TITLE POPE - 128 lipids & 40 H2O/lipid REMARK THIS IS A SIMULATION BOX CRYST1 61.498 58.651 84.000 90.00 90.00 90.00 P 1 1 MODEL 1 ATOM 1 N POP 1 58.670 21.840 65.310 1.00 0.00 ATOM 2 HN1 POP 1 59.330 22.450 64.790 1.00 0.00 ATOM 3 HN2 POP 1 57.770 21.790 64.790 1.00 0.00 ATOM 4 HN3 POP 1 58.330 22.360 66.140 1.00 0.00 ATOM 5 C12 POP 1 59.210 20.500 65.780 1.00 0.00 ATOM 6 H12A POP 1 58.490 20.130 66.550 1.00 0.00 ATOM 7 H12B POP 1 60.110 20.720 66.400 1.00 0.00 ATOM 8 C11 POP 1 59.300 19.430 64.690 1.00 0.00 ATOM 9 H11A POP 1 59.260 18.430 65.170 1.00 0.00 ATOM 10 H11B POP 1 60.300 19.550 64.220 1.00 0.00 ATOM 11 P POP 1 58.420 18.670 62.480 1.00 0.00 ATOM 12 O13 POP 1 57.400 19.030 61.470 1.00 0.00 ATOM 13 O14 POP 1 58.260 17.310 63.030 1.00 0.00 ATOM 14 O11 POP 1 59.870 18.810 61.820 1.00 0.00 ATOM 15 O12 POP 1 58.330 19.720 63.680 1.00 0.00 ATOM 16 C1 POP 1 60.400 20.020 61.270 1.00 0.00 ATOM 17 HA POP 1 61.330 20.180 61.850 1.00 0.00 ATOM 18 HB POP 1 59.820 20.950 61.430 1.00 0.00 ATOM 19 C2 POP 1 60.760 19.970 59.770 1.00 0.00 ATOM 20 HS POP 1 60.920 21.010 59.420 1.00 0.00 ATOM 21 O21 POP 1 59.720 19.350 59.020 1.00 0.00 ATOM 22 C21 POP 1 58.760 20.240 58.760 1.00 0.00 ATOM 23 O22 POP 1 58.890 21.420 59.050 1.00 0.00 ATOM 24 C22 POP 1 57.490 19.720 58.110 1.00 0.00 ATOM 25 H2R POP 1 56.820 20.570 57.850 1.00 0.00 ATOM 26 H2S POP 1 57.020 19.090 58.880 1.00 0.00 ATOM 27 C3 POP 1 62.090 19.240 59.510 1.00 0.00 ATOM 28 HX POP 1 62.040 18.230 59.970 1.00 0.00 ATOM 29 HY POP 1 62.950 19.700 60.040 1.00 0.00 ATOM 30 O31 POP 1 62.470 19.210 58.130 1.00 0.00 ATOM 31 C31 POP 1 62.720 20.420 57.620 1.00 0.00 ATOM 32 O32 POP 1 62.940 21.430 58.260 1.00 0.00 ATOM 33 C32 POP 1 62.810 20.200 56.110 1.00 0.00 ATOM 34 H2X POP 1 62.710 21.140 55.530 1.00 0.00 ATOM 35 H2Y POP 1 62.060 19.460 55.760 1.00 0.00 ATOM 36 C23 POP 1 57.800 18.930 56.840 1.00 0.00 ATOM 37 H3R POP 1 56.900 18.370 56.480 1.00 0.00 ATOM 38 H3S POP 1 58.700 18.300 57.000 1.00 0.00 ATOM 39 C24 POP 1 58.120 19.910 55.710 1.00 0.00 ATOM 40 H4R POP 1 58.930 20.560 56.110 1.00 0.00 ATOM 41 H4S POP 1 57.210 20.470 55.420 1.00 0.00 ATOM 42 C25 POP 1 58.430 19.230 54.380 1.00 0.00 ATOM 43 H5R POP 1 57.540 18.670 54.030 1.00 0.00 ATOM 44 H5S POP 1 59.320 18.570 54.520 1.00 0.00 ATOM 45 C26 POP 1 58.790 20.100 53.170 1.00 0.00 ATOM 46 H6R POP 1 59.610 20.760 53.530 1.00 0.00 ATOM 47 H6S POP 1 57.940 20.640 52.700 1.00 0.00 ATOM 48 C27 POP 1 59.380 19.200 52.080 1.00 0.00 ATOM 49 H7R POP 1 60.080 18.430 52.480 1.00 0.00 ATOM 50 H7S POP 1 60.060 19.820 51.450 1.00 0.00 ATOM 51 C28 POP 1 58.320 18.430 51.300 1.00 0.00 ATOM 52 H8R POP 1 57.640 19.250 51.010 1.00 0.00 ATOM 53 H8S POP 1 57.740 17.760 51.980 1.00 0.00 ATOM 54 C29 POP 1 59.020 17.620 50.250 1.00 0.00 ATOM 55 H91 POP 1 59.590 16.800 50.700 1.00 0.00 ATOM 56 0C21 POP 1 59.060 17.850 48.930 1.00 0.00 ATOM 57 1H10 POP 1 59.570 17.240 48.170 1.00 0.00 ATOM 58 1C21 POP 1 58.330 18.880 48.120 1.00 0.00 ATOM 59 H11R POP 1 57.600 19.470 48.720 1.00 0.00 ATOM 60 H11S POP 1 57.620 18.300 47.480 1.00 0.00 ATOM 61 2C21 POP 1 59.370 19.650 47.300 1.00 0.00 ATOM 62 H12R POP 1 58.730 20.400 46.780 1.00 0.00 ATOM 63 H12S POP 1 59.970 19.070 46.580 1.00 0.00 ATOM 64 3C21 POP 1 60.290 20.500 48.180 1.00 0.00 ATOM 65 H13R POP 1 60.890 19.930 48.930 1.00 0.00 ATOM 66 H13S POP 1 59.580 21.110 48.780 1.00 0.00 ATOM 67 4C21 POP 1 61.110 21.510 47.370 1.00 0.00 ATOM 68 H14R POP 1 60.330 21.930 46.710 1.00 0.00 ATOM 69 H14S POP 1 61.890 21.040 46.720 1.00 0.00 ATOM 70 5C21 POP 1 61.670 22.620 48.260 1.00 0.00 ATOM 71 H15R POP 1 60.890 23.270 48.710 1.00 0.00 ATOM 72 H15S POP 1 62.200 23.280 47.540 1.00 0.00 ATOM 73 6C21 POP 1 62.710 22.200 49.300 1.00 0.00 ATOM 74 H16R POP 1 63.590 21.840 48.720 1.00 0.00 ATOM 75 H16S POP 1 62.340 21.450 50.030 1.00 0.00 ATOM 76 7C21 POP 1 63.200 23.330 50.200 1.00 0.00 ATOM 77 H17R POP 1 64.150 22.960 50.660 1.00 0.00 ATOM 78 H17S POP 1 62.500 23.690 50.980 1.00 0.00 ATOM 79 8C21 POP 1 63.710 24.490 49.350 1.00 0.00 ATOM 80 H18R POP 1 64.180 25.250 50.000 1.00 0.00 ATOM 81 H18S POP 1 62.920 25.000 48.750 1.00 0.00 ATOM 82 H18T POP 1 64.470 24.050 48.650 1.00 0.00 ATOM 83 C33 POP 1 64.230 19.700 55.840 1.00 0.00 ATOM 84 H3X POP 1 64.410 18.690 56.250 1.00 0.00 ATOM 85 H3Y POP 1 64.950 20.310 56.420 1.00 0.00 ATOM 86 C34 POP 1 64.610 19.910 54.370 1.00 0.00 ATOM 87 H4X POP 1 65.650 19.520 54.270 1.00 0.00 ATOM 88 H4Y POP 1 64.550 20.990 54.150 1.00 0.00 ATOM 89 C35 POP 1 63.690 19.060 53.490 1.00 0.00 ATOM 90 H5X POP 1 62.740 19.630 53.510 1.00 0.00 ATOM 91 H5Y POP 1 63.550 18.030 53.880 1.00 0.00 ATOM 92 C36 POP 1 64.190 18.780 52.060 1.00 0.00 ATOM 93 H6X POP 1 65.190 18.300 52.110 1.00 0.00 ATOM 94 H6Y POP 1 64.160 19.700 51.440 1.00 0.00 ATOM 95 C37 POP 1 63.200 17.810 51.410 1.00 0.00 ATOM 96 H7X POP 1 62.220 18.300 51.220 1.00 0.00 ATOM 97 H7Y POP 1 62.970 16.990 52.120 1.00 0.00 ATOM 98 C38 POP 1 63.750 17.320 50.070 1.00 0.00 ATOM 99 H8X POP 1 64.720 16.810 50.280 1.00 0.00 ATOM 100 H8Y POP 1 63.960 18.270 49.530 1.00 0.00 ATOM 101 C39 POP 1 62.840 16.410 49.250 1.00 0.00 ATOM 102 H9X POP 1 61.870 16.920 49.090 1.00 0.00 ATOM 103 H9Y POP 1 62.640 15.480 49.830 1.00 0.00 ATOM 104 0C31 POP 1 63.500 16.020 47.930 1.00 0.00 ATOM 105 H10X POP 1 62.730 15.550 47.280 1.00 0.00 ATOM 106 H10Y POP 1 64.220 15.180 48.070 1.00 0.00 ATOM 107 1C31 POP 1 64.170 17.180 47.180 1.00 0.00 ATOM 108 H11X POP 1 65.080 17.450 47.750 1.00 0.00 ATOM 109 H11Y POP 1 63.470 18.040 47.170 1.00 0.00 ATOM 110 2C31 POP 1 64.610 16.770 45.780 1.00 0.00 ATOM 111 H12X POP 1 64.660 17.740 45.230 1.00 0.00 ATOM 112 H12Y POP 1 63.880 16.140 45.220 1.00 0.00 ATOM 113 3C31 POP 1 66.020 16.170 45.730 1.00 0.00 ATOM 114 H13X POP 1 66.580 16.650 46.560 1.00 0.00 ATOM 115 H13Y POP 1 66.530 16.380 44.760 1.00 0.00 ATOM 116 4C31 POP 1 66.090 14.650 45.840 1.00 0.00 ATOM 117 H14X POP 1 66.000 14.380 46.920 1.00 0.00 ATOM 118 H14Y POP 1 67.100 14.280 45.540 1.00 0.00 ATOM 119 5C31 POP 1 65.120 13.750 45.070 1.00 0.00 ATOM 120 H15X POP 1 65.140 14.070 44.010 1.00 0.00 ATOM 121 H15Y POP 1 64.110 14.070 45.430 1.00 0.00 ATOM 122 6C31 POP 1 65.330 12.250 45.270 1.00 0.00 ATOM 123 H16X POP 1 66.280 11.900 44.820 1.00 0.00 ATOM 124 H16Y POP 1 64.480 11.720 44.790 1.00 0.00 ATOM 125 H16Z POP 1 65.220 11.920 46.320 1.00 0.00 ATOM 126 N POP 2 51.940 10.880 64.730 1.00 0.00 ATOM 127 HN1 POP 2 51.210 10.980 63.990 1.00 0.00 ATOM 128 HN2 POP 2 52.700 11.590 64.610 1.00 0.00 ATOM 129 HN3 POP 2 52.340 9.930 64.630 1.00 0.00 ATOM 130 C12 POP 2 51.340 11.120 66.090 1.00 0.00 ATOM 131 H12A POP 2 50.830 12.100 66.110 1.00 0.00 ATOM 132 H12B POP 2 52.150 11.240 66.840 1.00 0.00 ATOM 133 C11 POP 2 50.330 10.010 66.440 1.00 0.00 ATOM 134 H11A POP 2 49.920 10.240 67.450 1.00 0.00 ATOM 135 H11B POP 2 50.980 9.120 66.600 1.00 0.00 ATOM 136 P POP 2 47.890 10.160 65.650 1.00 0.00 ATOM 137 O13 POP 2 47.650 11.600 65.400 1.00 0.00 ATOM 138 O14 POP 2 47.470 9.490 66.900 1.00 0.00 ATOM 139 O11 POP 2 47.140 9.440 64.440 1.00 0.00 ATOM 140 O12 POP 2 49.420 9.800 65.360 1.00 0.00 ATOM 141 C1 POP 2 47.300 8.030 64.250 1.00 0.00 ATOM 142 HA POP 2 46.330 7.670 63.860 1.00 0.00 ATOM 143 HB POP 2 47.630 7.500 65.170 1.00 0.00 ATOM 144 C2 POP 2 48.470 7.800 63.280 1.00 0.00 ATOM 145 HS POP 2 49.370 7.930 63.930 1.00 0.00 ATOM 146 O21 POP 2 48.540 8.810 62.270 1.00 0.00 ATOM 147 C21 POP 2 49.800 8.920 61.850 1.00 0.00 ATOM 148 O22 POP 2 50.800 8.530 62.430 1.00 0.00 ATOM 149 C22 POP 2 49.850 9.640 60.510 1.00 0.00 ATOM 150 H2R POP 2 49.020 10.380 60.500 1.00 0.00 ATOM 151 H2S POP 2 49.650 8.870 59.730 1.00 0.00 ATOM 152 C3 POP 2 48.420 6.380 62.680 1.00 0.00 ATOM 153 HX POP 2 48.440 5.740 63.580 1.00 0.00 ATOM 154 HY POP 2 49.370 6.220 62.110 1.00 0.00 ATOM 155 O31 POP 2 47.270 6.210 61.850 1.00 0.00 ATOM 156 C31 POP 2 47.500 6.320 60.540 1.00 0.00 ATOM 157 O32 POP 2 48.570 6.510 59.980 1.00 0.00 ATOM 158 C32 POP 2 46.170 6.010 59.880 1.00 0.00 ATOM 159 H2X POP 2 45.310 6.550 60.340 1.00 0.00 ATOM 160 H2Y POP 2 45.970 4.920 59.980 1.00 0.00 ATOM 161 C23 POP 2 51.220 10.270 60.250 1.00 0.00 ATOM 162 H3R POP 2 51.990 9.480 60.390 1.00 0.00 ATOM 163 H3S POP 2 51.480 10.940 61.090 1.00 0.00 ATOM 164 C24 POP 2 51.420 11.040 58.950 1.00 0.00 ATOM 165 H4R POP 2 52.510 11.220 58.840 1.00 0.00 ATOM 166 H4S POP 2 51.070 12.090 59.090 1.00 0.00 ATOM 167 C25 POP 2 50.880 10.310 57.720 1.00 0.00 ATOM 168 H5R POP 2 49.770 10.250 57.790 1.00 0.00 ATOM 169 H5S POP 2 51.300 9.280 57.780 1.00 0.00 ATOM 170 C26 POP 2 51.220 10.950 56.380 1.00 0.00 ATOM 171 H6R POP 2 50.750 10.380 55.550 1.00 0.00 ATOM 172 H6S POP 2 52.330 10.870 56.370 1.00 0.00 ATOM 173 C27 POP 2 50.940 12.460 56.440 1.00 0.00 ATOM 174 H7R POP 2 51.240 12.910 55.470 1.00 0.00 ATOM 175 H7S POP 2 51.620 12.910 57.190 1.00 0.00 ATOM 176 C28 POP 2 49.460 12.840 56.600 1.00 0.00 ATOM 177 H8R POP 2 49.060 12.560 57.600 1.00 0.00 ATOM 178 H8S POP 2 48.920 12.250 55.830 1.00 0.00 ATOM 179 C29 POP 2 49.170 14.300 56.400 1.00 0.00 ATOM 180 H91 POP 2 48.830 14.830 57.310 1.00 0.00 ATOM 181 0C21 POP 2 49.110 14.930 55.220 1.00 0.00 ATOM 182 1H10 POP 2 49.040 16.030 55.230 1.00 0.00 ATOM 183 1C21 POP 2 49.490 14.400 53.870 1.00 0.00 ATOM 184 H11R POP 2 48.690 14.680 53.150 1.00 0.00 ATOM 185 H11S POP 2 49.680 13.310 53.980 1.00 0.00 ATOM 186 2C21 POP 2 50.800 15.110 53.520 1.00 0.00 ATOM 187 H12R POP 2 51.020 14.740 52.500 1.00 0.00 ATOM 188 H12S POP 2 51.660 14.840 54.160 1.00 0.00 ATOM 189 3C21 POP 2 50.700 16.630 53.370 1.00 0.00 ATOM 190 H13R POP 2 50.510 17.120 54.350 1.00 0.00 ATOM 191 H13S POP 2 49.820 16.850 52.730 1.00 0.00 ATOM 192 4C21 POP 2 51.890 17.410 52.830 1.00 0.00 ATOM 193 H14R POP 2 52.580 17.400 53.700 1.00 0.00 ATOM 194 H14S POP 2 51.510 18.430 52.580 1.00 0.00 ATOM 195 5C21 POP 2 52.390 16.690 51.570 1.00 0.00 ATOM 196 H15R POP 2 51.440 16.530 51.020 1.00 0.00 ATOM 197 H15S POP 2 52.840 15.760 51.980 1.00 0.00 ATOM 198 6C21 POP 2 53.450 17.470 50.780 1.00 0.00 ATOM 199 H16R POP 2 54.430 17.430 51.310 1.00 0.00 ATOM 200 H16S POP 2 53.180 18.550 50.740 1.00 0.00 ATOM 201 7C21 POP 2 53.570 16.990 49.330 1.00 0.00 ATOM 202 H17R POP 2 52.570 16.700 48.940 1.00 0.00 ATOM 203 H17S POP 2 54.280 16.140 49.330 1.00 0.00 ATOM 204 8C21 POP 2 54.280 18.080 48.520 1.00 0.00 ATOM 205 H18R POP 2 53.540 18.850 48.200 1.00 0.00 ATOM 206 H18S POP 2 54.700 17.690 47.570 1.00 0.00 ATOM 207 H18T POP 2 55.060 18.640 49.070 1.00 0.00 ATOM 208 C33 POP 2 46.190 6.210 58.360 1.00 0.00 ATOM 209 H3X POP 2 47.030 5.610 57.970 1.00 0.00 ATOM 210 H3Y POP 2 46.360 7.260 58.030 1.00 0.00 ATOM 211 C34 POP 2 44.920 5.740 57.660 1.00 0.00 ATOM 212 H4X POP 2 44.110 6.390 58.040 1.00 0.00 ATOM 213 H4Y POP 2 44.600 4.700 57.880 1.00 0.00 ATOM 214 C35 POP 2 45.050 5.900 56.140 1.00 0.00 ATOM 215 H5X POP 2 44.290 5.230 55.670 1.00 0.00 ATOM 216 H5Y POP 2 46.090 5.670 55.820 1.00 0.00 ATOM 217 C36 POP 2 44.820 7.320 55.640 1.00 0.00 ATOM 218 H6X POP 2 45.660 7.890 56.080 1.00 0.00 ATOM 219 H6Y POP 2 43.860 7.730 56.010 1.00 0.00 ATOM 220 C37 POP 2 44.870 7.460 54.110 1.00 0.00 ATOM 221 H7X POP 2 45.770 6.910 53.750 1.00 0.00 ATOM 222 H7Y POP 2 44.860 8.500 53.730 1.00 0.00 ATOM 223 C38 POP 2 43.640 6.800 53.490 1.00 0.00 ATOM 224 H8X POP 2 42.670 7.060 53.980 1.00 0.00 ATOM 225 H8Y POP 2 43.810 5.700 53.440 1.00 0.00 ATOM 226 C39 POP 2 43.430 7.100 52.010 1.00 0.00 ATOM 227 H9X POP 2 43.260 8.190 51.910 1.00 0.00 ATOM 228 H9Y POP 2 42.470 6.590 51.800 1.00 0.00 ATOM 229 0C31 POP 2 44.490 6.660 50.990 1.00 0.00 ATOM 230 H10X POP 2 43.940 6.340 50.080 1.00 0.00 ATOM 231 H10Y POP 2 45.040 5.720 51.220 1.00 0.00 ATOM 232 1C31 POP 2 45.360 7.810 50.480 1.00 0.00 ATOM 233 H11X POP 2 46.190 8.150 51.140 1.00 0.00 ATOM 234 H11Y POP 2 44.760 8.740 50.420 1.00 0.00 ATOM 235 2C31 POP 2 45.900 7.480 49.090 1.00 0.00 ATOM 236 H12X POP 2 46.290 8.440 48.690 1.00 0.00 ATOM 237 H12Y POP 2 45.040 7.170 48.450 1.00 0.00 ATOM 238 3C31 POP 2 46.840 6.280 48.950 1.00 0.00 ATOM 239 H13X POP 2 47.350 6.250 49.940 1.00 0.00 ATOM 240 H13Y POP 2 47.640 6.600 48.240 1.00 0.00 ATOM 241 4C31 POP 2 46.230 4.920 48.590 1.00 0.00 ATOM 242 H14X POP 2 46.030 4.770 47.510 1.00 0.00 ATOM 243 H14Y POP 2 45.230 4.780 49.040 1.00 0.00 ATOM 244 5C31 POP 2 47.090 3.740 49.060 1.00 0.00 ATOM 245 H15X POP 2 48.090 3.830 48.580 1.00 0.00 ATOM 246 H15Y POP 2 46.620 2.780 48.760 1.00 0.00 ATOM 247 6C31 POP 2 47.290 3.680 50.570 1.00 0.00 ATOM 248 H16X POP 2 48.050 4.470 50.690 1.00 0.00 ATOM 249 H16Y POP 2 47.560 2.670 50.940 1.00 0.00 ATOM 250 H16Z POP 2 46.380 4.010 51.120 1.00 0.00 ATOM 251 N POP 3 34.040 47.720 64.820 1.00 0.00 ATOM 252 HN1 POP 3 34.900 47.580 64.260 1.00 0.00 ATOM 253 HN2 POP 3 34.390 47.750 65.800 1.00 0.00 ATOM 254 HN3 POP 3 33.340 46.990 64.580 1.00 0.00 ATOM 255 C12 POP 3 33.360 49.040 64.530 1.00 0.00 ATOM 256 H12A POP 3 32.680 49.240 65.380 1.00 0.00 ATOM 257 H12B POP 3 32.820 48.900 63.570 1.00 0.00 ATOM 258 C11 POP 3 34.200 50.310 64.440 1.00 0.00 ATOM 259 H11A POP 3 33.480 51.130 64.230 1.00 0.00 ATOM 260 H11B POP 3 34.850 50.330 63.540 1.00 0.00 ATOM 261 P POP 3 36.270 51.200 65.650 1.00 0.00 ATOM 262 O13 POP 3 37.050 50.930 66.880 1.00 0.00 ATOM 263 O14 POP 3 35.960 52.620 65.410 1.00 0.00 ATOM 264 O11 POP 3 37.170 50.700 64.430 1.00 0.00 ATOM 265 O12 POP 3 34.840 50.480 65.710 1.00 0.00 ATOM 266 C1 POP 3 37.750 51.710 63.600 1.00 0.00 ATOM 267 HA POP 3 38.730 51.290 63.300 1.00 0.00 ATOM 268 HB POP 3 38.100 52.600 64.180 1.00 0.00 ATOM 269 C2 POP 3 36.960 52.150 62.360 1.00 0.00 ATOM 270 HS POP 3 35.990 52.620 62.610 1.00 0.00 ATOM 271 O21 POP 3 36.810 51.080 61.420 1.00 0.00 ATOM 272 C21 POP 3 35.820 51.310 60.560 1.00 0.00 ATOM 273 O22 POP 3 34.890 52.080 60.770 1.00 0.00 ATOM 274 C22 POP 3 36.100 50.430 59.350 1.00 0.00 ATOM 275 H2R POP 3 35.140 49.990 58.990 1.00 0.00 ATOM 276 H2S POP 3 36.770 49.600 59.660 1.00 0.00 ATOM 277 C3 POP 3 37.690 53.310 61.670 1.00 0.00 ATOM 278 HX POP 3 38.620 52.800 61.350 1.00 0.00 ATOM 279 HY POP 3 38.040 54.080 62.390 1.00 0.00 ATOM 280 O31 POP 3 37.140 53.870 60.470 1.00 0.00 ATOM 281 C31 POP 3 36.240 54.790 60.840 1.00 0.00 ATOM 282 O32 POP 3 35.970 55.160 61.960 1.00 0.00 ATOM 283 C32 POP 3 35.420 55.210 59.630 1.00 0.00 ATOM 284 H2X POP 3 34.540 55.800 59.960 1.00 0.00 ATOM 285 H2Y POP 3 35.120 54.200 59.270 1.00 0.00 ATOM 286 C23 POP 3 36.780 51.380 58.370 1.00 0.00 ATOM 287 H3R POP 3 37.710 51.740 58.850 1.00 0.00 ATOM 288 H3S POP 3 36.210 52.320 58.210 1.00 0.00 ATOM 289 C24 POP 3 36.980 50.700 57.020 1.00 0.00 ATOM 290 H4R POP 3 37.600 49.790 57.200 1.00 0.00 ATOM 291 H4S POP 3 37.510 51.360 56.310 1.00 0.00 ATOM 292 C25 POP 3 35.780 50.210 56.210 1.00 0.00 ATOM 293 H5R POP 3 35.160 51.060 55.850 1.00 0.00 ATOM 294 H5S POP 3 35.090 49.570 56.800 1.00 0.00 ATOM 295 C26 POP 3 36.160 49.470 54.930 1.00 0.00 ATOM 296 H6R POP 3 36.930 48.710 55.200 1.00 0.00 ATOM 297 H6S POP 3 36.650 50.170 54.220 1.00 0.00 ATOM 298 C27 POP 3 34.960 48.800 54.260 1.00 0.00 ATOM 299 H7R POP 3 34.480 48.110 54.990 1.00 0.00 ATOM 300 H7S POP 3 35.360 48.150 53.450 1.00 0.00 ATOM 301 C28 POP 3 33.970 49.760 53.600 1.00 0.00 ATOM 302 H8R POP 3 34.600 50.560 53.170 1.00 0.00 ATOM 303 H8S POP 3 33.300 50.180 54.380 1.00 0.00 ATOM 304 C29 POP 3 33.070 49.090 52.600 1.00 0.00 ATOM 305 H91 POP 3 32.120 48.640 52.910 1.00 0.00 ATOM 306 0C21 POP 3 33.320 48.960 51.290 1.00 0.00 ATOM 307 1H10 POP 3 32.530 48.490 50.680 1.00 0.00 ATOM 308 1C21 POP 3 34.530 49.530 50.600 1.00 0.00 ATOM 309 H11R POP 3 34.810 48.910 49.720 1.00 0.00 ATOM 310 H11S POP 3 35.350 49.580 51.340 1.00 0.00 ATOM 311 2C21 POP 3 34.320 50.920 49.990 1.00 0.00 ATOM 312 H12R POP 3 35.320 51.230 49.620 1.00 0.00 ATOM 313 H12S POP 3 33.890 51.670 50.690 1.00 0.00 ATOM 314 3C21 POP 3 33.410 50.960 48.760 1.00 0.00 ATOM 315 H13R POP 3 33.900 50.490 47.880 1.00 0.00 ATOM 316 H13S POP 3 33.340 52.010 48.410 1.00 0.00 ATOM 317 4C21 POP 3 31.950 50.530 48.940 1.00 0.00 ATOM 318 H14R POP 3 31.690 50.970 49.920 1.00 0.00 ATOM 319 H14S POP 3 31.800 49.430 48.900 1.00 0.00 ATOM 320 5C21 POP 3 31.130 51.230 47.850 1.00 0.00 ATOM 321 H15R POP 3 31.580 50.880 46.900 1.00 0.00 ATOM 322 H15S POP 3 31.350 52.320 47.910 1.00 0.00 ATOM 323 6C21 POP 3 29.630 50.970 48.020 1.00 0.00 ATOM 324 H16R POP 3 29.340 51.530 48.940 1.00 0.00 ATOM 325 H16S POP 3 29.460 49.880 48.120 1.00 0.00 ATOM 326 7C21 POP 3 28.810 51.470 46.830 1.00 0.00 ATOM 327 H17R POP 3 29.020 50.940 45.880 1.00 0.00 ATOM 328 H17S POP 3 29.100 52.540 46.750 1.00 0.00 ATOM 329 8C21 POP 3 27.330 51.310 47.170 1.00 0.00 ATOM 330 H18R POP 3 26.670 51.460 46.290 1.00 0.00 ATOM 331 H18S POP 3 27.100 51.960 48.050 1.00 0.00 ATOM 332 H18T POP 3 27.190 50.220 47.320 1.00 0.00 ATOM 333 C33 POP 3 36.200 56.080 58.640 1.00 0.00 ATOM 334 H3X POP 3 37.130 55.520 58.420 1.00 0.00 ATOM 335 H3Y POP 3 36.510 57.010 59.170 1.00 0.00 ATOM 336 C34 POP 3 35.460 56.440 57.360 1.00 0.00 ATOM 337 H4X POP 3 36.110 57.020 56.670 1.00 0.00 ATOM 338 H4Y POP 3 34.590 57.070 57.650 1.00 0.00 ATOM 339 C35 POP 3 34.890 55.320 56.490 1.00 0.00 ATOM 340 H5X POP 3 34.060 55.750 55.890 1.00 0.00 ATOM 341 H5Y POP 3 34.600 54.430 57.090 1.00 0.00 ATOM 342 C36 POP 3 35.960 54.730 55.570 1.00 0.00 ATOM 343 H6X POP 3 36.850 54.450 56.180 1.00 0.00 ATOM 344 H6Y POP 3 36.360 55.540 54.920 1.00 0.00 ATOM 345 C37 POP 3 35.360 53.540 54.820 1.00 0.00 ATOM 346 H7X POP 3 34.460 53.230 55.400 1.00 0.00 ATOM 347 H7Y POP 3 36.040 52.660 54.850 1.00 0.00 ATOM 348 C38 POP 3 35.110 53.940 53.360 1.00 0.00 ATOM 349 H8X POP 3 34.700 53.050 52.850 1.00 0.00 ATOM 350 H8Y POP 3 36.050 54.190 52.820 1.00 0.00 ATOM 351 C39 POP 3 34.090 55.050 53.140 1.00 0.00 ATOM 352 H9X POP 3 34.180 55.350 52.070 1.00 0.00 ATOM 353 H9Y POP 3 34.420 56.000 53.630 1.00 0.00 ATOM 354 0C31 POP 3 32.660 54.760 53.620 1.00 0.00 ATOM 355 H10X POP 3 32.000 55.600 53.320 1.00 0.00 ATOM 356 H10Y POP 3 32.680 54.920 54.720 1.00 0.00 ATOM 357 1C31 POP 3 32.090 53.380 53.340 1.00 0.00 ATOM 358 H11X POP 3 32.650 52.720 54.040 1.00 0.00 ATOM 359 H11Y POP 3 32.470 53.150 52.320 1.00 0.00 ATOM 360 2C31 POP 3 30.560 53.230 53.270 1.00 0.00 ATOM 361 H12X POP 3 30.140 53.850 52.450 1.00 0.00 ATOM 362 H12Y POP 3 30.140 53.400 54.280 1.00 0.00 ATOM 363 3C31 POP 3 30.120 51.820 52.870 1.00 0.00 ATOM 364 H13X POP 3 30.120 51.090 53.700 1.00 0.00 ATOM 365 H13Y POP 3 30.780 51.400 52.080 1.00 0.00 ATOM 366 4C31 POP 3 28.650 51.770 52.450 1.00 0.00 ATOM 367 H14X POP 3 28.530 52.330 51.500 1.00 0.00 ATOM 368 H14Y POP 3 28.080 52.230 53.290 1.00 0.00 ATOM 369 5C31 POP 3 28.120 50.350 52.330 1.00 0.00 ATOM 370 H15X POP 3 28.920 49.590 52.490 1.00 0.00 ATOM 371 H15Y POP 3 27.590 50.220 51.360 1.00 0.00 ATOM 372 6C31 POP 3 27.170 50.050 53.480 1.00 0.00 ATOM 373 H16X POP 3 27.650 50.200 54.470 1.00 0.00 ATOM 374 H16Y POP 3 26.700 49.040 53.400 1.00 0.00 ATOM 375 H16Z POP 3 26.330 50.780 53.490 1.00 0.00 ATOM 376 N POP 4 41.990 6.440 63.470 1.00 0.00 ATOM 377 HN1 POP 4 41.680 7.270 64.010 1.00 0.00 ATOM 378 HN2 POP 4 42.350 6.770 62.550 1.00 0.00 ATOM 379 HN3 POP 4 41.090 5.940 63.320 1.00 0.00 ATOM 380 C12 POP 4 43.150 5.820 64.220 1.00 0.00 ATOM 381 H12A POP 4 42.850 4.890 64.750 1.00 0.00 ATOM 382 H12B POP 4 43.470 6.590 64.950 1.00 0.00 ATOM 383 C11 POP 4 44.250 5.500 63.210 1.00 0.00 ATOM 384 H11A POP 4 45.070 4.910 63.670 1.00 0.00 ATOM 385 H11B POP 4 44.770 6.480 63.080 1.00 0.00 ATOM 386 P POP 4 43.760 3.170 62.230 1.00 0.00 ATOM 387 O13 POP 4 42.510 2.810 62.940 1.00 0.00 ATOM 388 O14 POP 4 45.030 2.700 62.830 1.00 0.00 ATOM 389 O11 POP 4 43.740 2.720 60.690 1.00 0.00 ATOM 390 O12 POP 4 43.820 4.760 62.060 1.00 0.00 ATOM 391 C1 POP 4 43.870 1.320 60.440 1.00 0.00 ATOM 392 HA POP 4 43.280 1.200 59.510 1.00 0.00 ATOM 393 HB POP 4 43.260 0.880 61.250 1.00 0.00 ATOM 394 C2 POP 4 45.320 0.830 60.280 1.00 0.00 ATOM 395 HS POP 4 45.910 0.920 61.210 1.00 0.00 ATOM 396 O21 POP 4 45.990 1.660 59.330 1.00 0.00 ATOM 397 C21 POP 4 47.320 1.590 59.350 1.00 0.00 ATOM 398 O22 POP 4 47.980 0.870 60.080 1.00 0.00 ATOM 399 C22 POP 4 47.940 2.660 58.460 1.00 0.00 ATOM 400 H2R POP 4 48.950 2.370 58.100 1.00 0.00 ATOM 401 H2S POP 4 48.130 3.550 59.100 1.00 0.00 ATOM 402 C3 POP 4 45.320 -0.670 59.940 1.00 0.00 ATOM 403 HX POP 4 44.720 -1.400 60.540 1.00 0.00 ATOM 404 HY POP 4 46.380 -0.950 60.080 1.00 0.00 ATOM 405 O31 POP 4 44.920 -0.840 58.580 1.00 0.00 ATOM 406 C31 POP 4 45.120 -2.070 58.090 1.00 0.00 ATOM 407 O32 POP 4 45.500 -3.030 58.730 1.00 0.00 ATOM 408 C32 POP 4 44.670 -2.100 56.630 1.00 0.00 ATOM 409 H2X POP 4 45.100 -1.280 56.020 1.00 0.00 ATOM 410 H2Y POP 4 43.570 -1.970 56.600 1.00 0.00 ATOM 411 C23 POP 4 47.020 2.810 57.250 1.00 0.00 ATOM 412 H3R POP 4 47.440 3.680 56.710 1.00 0.00 ATOM 413 H3S POP 4 46.030 3.190 57.610 1.00 0.00 ATOM 414 C24 POP 4 47.010 1.600 56.320 1.00 0.00 ATOM 415 H4R POP 4 46.240 0.890 56.690 1.00 0.00 ATOM 416 H4S POP 4 47.970 1.130 56.020 1.00 0.00 ATOM 417 C25 POP 4 46.380 2.010 54.980 1.00 0.00 ATOM 418 H5R POP 4 46.870 1.390 54.210 1.00 0.00 ATOM 419 H5S POP 4 46.530 3.060 54.640 1.00 0.00 ATOM 420 C26 POP 4 44.860 1.840 55.070 1.00 0.00 ATOM 421 H6R POP 4 44.550 2.230 56.060 1.00 0.00 ATOM 422 H6S POP 4 44.570 0.770 55.010 1.00 0.00 ATOM 423 C27 POP 4 44.040 2.650 54.070 1.00 0.00 ATOM 424 H7R POP 4 44.820 3.100 53.420 1.00 0.00 ATOM 425 H7S POP 4 43.360 3.440 54.460 1.00 0.00 ATOM 426 C28 POP 4 43.200 1.920 53.030 1.00 0.00 ATOM 427 H8R POP 4 42.580 2.590 52.390 1.00 0.00 ATOM 428 H8S POP 4 42.430 1.410 53.640 1.00 0.00 ATOM 429 C29 POP 4 44.060 0.900 52.340 1.00 0.00 ATOM 430 H91 POP 4 44.720 0.330 53.020 1.00 0.00 ATOM 431 0C21 POP 4 44.150 0.670 51.020 1.00 0.00 ATOM 432 1H10 POP 4 44.670 -0.230 50.670 1.00 0.00 ATOM 433 1C21 POP 4 43.250 1.280 49.980 1.00 0.00 ATOM 434 H11R POP 4 43.880 2.050 49.480 1.00 0.00 ATOM 435 H11S POP 4 42.340 1.750 50.400 1.00 0.00 ATOM 436 2C21 POP 4 42.690 0.190 49.070 1.00 0.00 ATOM 437 H12R POP 4 42.200 -0.540 49.750 1.00 0.00 ATOM 438 H12S POP 4 43.570 -0.350 48.650 1.00 0.00 ATOM 439 3C21 POP 4 41.740 0.620 47.950 1.00 0.00 ATOM 440 H13R POP 4 42.300 1.400 47.400 1.00 0.00 ATOM 441 H13S POP 4 40.870 1.010 48.530 1.00 0.00 ATOM 442 4C21 POP 4 41.230 -0.440 46.980 1.00 0.00 ATOM 443 H14R POP 4 40.820 -1.270 47.600 1.00 0.00 ATOM 444 H14S POP 4 42.070 -0.860 46.390 1.00 0.00 ATOM 445 5C21 POP 4 40.250 0.160 45.980 1.00 0.00 ATOM 446 H15R POP 4 39.520 0.830 46.490 1.00 0.00 ATOM 447 H15S POP 4 39.710 -0.720 45.570 1.00 0.00 ATOM 448 6C21 POP 4 40.930 0.780 44.760 1.00 0.00 ATOM 449 H16R POP 4 41.600 -0.010 44.350 1.00 0.00 ATOM 450 H16S POP 4 41.580 1.570 45.190 1.00 0.00 ATOM 451 7C21 POP 4 39.950 1.270 43.690 1.00 0.00 ATOM 452 H17R POP 4 39.260 0.440 43.450 1.00 0.00 ATOM 453 H17S POP 4 40.480 1.650 42.790 1.00 0.00 ATOM 454 8C21 POP 4 38.920 2.330 44.090 1.00 0.00 ATOM 455 H18R POP 4 39.470 3.270 44.300 1.00 0.00 ATOM 456 H18S POP 4 38.410 1.870 44.970 1.00 0.00 ATOM 457 H18T POP 4 38.170 2.540 43.290 1.00 0.00 ATOM 458 C33 POP 4 45.070 -3.430 56.000 1.00 0.00 ATOM 459 H3X POP 4 44.520 -4.220 56.560 1.00 0.00 ATOM 460 H3Y POP 4 46.140 -3.620 56.230 1.00 0.00 ATOM 461 C34 POP 4 44.890 -3.500 54.490 1.00 0.00 ATOM 462 H4X POP 4 43.830 -3.310 54.190 1.00 0.00 ATOM 463 H4Y POP 4 45.030 -4.580 54.280 1.00 0.00 ATOM 464 C35 POP 4 45.800 -2.640 53.610 1.00 0.00 ATOM 465 H5X POP 4 46.810 -2.960 53.950 1.00 0.00 ATOM 466 H5Y POP 4 45.560 -1.590 53.870 1.00 0.00 ATOM 467 C36 POP 4 45.600 -2.780 52.100 1.00 0.00 ATOM 468 H6X POP 4 46.100 -1.930 51.580 1.00 0.00 ATOM 469 H6Y POP 4 44.510 -2.830 51.910 1.00 0.00 ATOM 470 C37 POP 4 46.100 -4.130 51.570 1.00 0.00 ATOM 471 H7X POP 4 45.550 -4.320 50.620 1.00 0.00 ATOM 472 H7Y POP 4 45.740 -4.920 52.270 1.00 0.00 ATOM 473 C38 POP 4 47.610 -4.130 51.330 1.00 0.00 ATOM 474 H8X POP 4 48.080 -3.340 51.960 1.00 0.00 ATOM 475 H8Y POP 4 47.880 -3.940 50.270 1.00 0.00 ATOM 476 C39 POP 4 48.290 -5.460 51.680 1.00 0.00 ATOM 477 H9X POP 4 47.860 -6.290 51.090 1.00 0.00 ATOM 478 H9Y POP 4 48.130 -5.680 52.760 1.00 0.00 ATOM 479 0C31 POP 4 49.780 -5.430 51.330 1.00 0.00 ATOM 480 H10X POP 4 50.420 -6.040 52.000 1.00 0.00 ATOM 481 H10Y POP 4 50.100 -4.370 51.430 1.00 0.00 ATOM 482 1C31 POP 4 50.090 -5.890 49.900 1.00 0.00 ATOM 483 H11X POP 4 49.330 -5.630 49.140 1.00 0.00 ATOM 484 H11Y POP 4 50.120 -7.000 49.880 1.00 0.00 ATOM 485 2C31 POP 4 51.450 -5.280 49.530 1.00 0.00 ATOM 486 H12X POP 4 52.270 -5.790 50.080 1.00 0.00 ATOM 487 H12Y POP 4 51.450 -4.230 49.890 1.00 0.00 ATOM 488 3C31 POP 4 51.720 -5.340 48.030 1.00 0.00 ATOM 489 H13X POP 4 52.610 -4.770 47.700 1.00 0.00 ATOM 490 H13Y POP 4 50.860 -4.820 47.560 1.00 0.00 ATOM 491 4C31 POP 4 51.900 -6.760 47.480 1.00 0.00 ATOM 492 H14X POP 4 52.160 -6.800 46.400 1.00 0.00 ATOM 493 H14Y POP 4 50.910 -7.250 47.560 1.00 0.00 ATOM 494 5C31 POP 4 52.990 -7.560 48.190 1.00 0.00 ATOM 495 H15X POP 4 52.630 -7.890 49.180 1.00 0.00 ATOM 496 H15Y POP 4 53.860 -6.890 48.390 1.00 0.00 ATOM 497 6C31 POP 4 53.460 -8.850 47.520 1.00 0.00 ATOM 498 H16X POP 4 52.810 -9.710 47.770 1.00 0.00 ATOM 499 H16Y POP 4 54.530 -9.030 47.760 1.00 0.00 ATOM 500 H16Z POP 4 53.390 -8.740 46.420 1.00 0.00 ATOM 501 N POP 5 54.980 53.110 67.130 1.00 0.00 ATOM 502 HN1 POP 5 54.370 53.180 67.970 1.00 0.00 ATOM 503 HN2 POP 5 54.550 52.610 66.320 1.00 0.00 ATOM 504 HN3 POP 5 55.700 52.450 67.480 1.00 0.00 ATOM 505 C12 POP 5 55.630 54.400 66.690 1.00 0.00 ATOM 506 H12A POP 5 56.520 54.610 67.320 1.00 0.00 ATOM 507 H12B POP 5 54.920 55.250 66.750 1.00 0.00 ATOM 508 C11 POP 5 56.070 54.210 65.240 1.00 0.00 ATOM 509 H11A POP 5 56.730 55.030 64.870 1.00 0.00 ATOM 510 H11B POP 5 55.120 54.280 64.660 1.00 0.00 ATOM 511 P POP 5 58.030 52.700 64.710 1.00 0.00 ATOM 512 O13 POP 5 58.320 51.310 64.300 1.00 0.00 ATOM 513 O14 POP 5 58.810 53.290 65.820 1.00 0.00 ATOM 514 O11 POP 5 58.250 53.540 63.370 1.00 0.00 ATOM 515 O12 POP 5 56.470 52.860 65.030 1.00 0.00 ATOM 516 C1 POP 5 59.490 53.350 62.690 1.00 0.00 ATOM 517 HA POP 5 59.300 53.220 61.600 1.00 0.00 ATOM 518 HB POP 5 60.030 52.400 62.930 1.00 0.00 ATOM 519 C2 POP 5 60.460 54.520 62.870 1.00 0.00 ATOM 520 HS POP 5 60.500 54.780 63.950 1.00 0.00 ATOM 521 O21 POP 5 60.010 55.600 62.050 1.00 0.00 ATOM 522 C21 POP 5 60.650 56.730 62.330 1.00 0.00 ATOM 523 O22 POP 5 61.470 56.870 63.220 1.00 0.00 ATOM 524 C22 POP 5 60.240 57.960 61.530 1.00 0.00 ATOM 525 H2R POP 5 60.480 58.820 62.180 1.00 0.00 ATOM 526 H2S POP 5 59.160 57.830 61.280 1.00 0.00 ATOM 527 C3 POP 5 61.880 54.050 62.490 1.00 0.00 ATOM 528 HX POP 5 62.210 53.250 63.190 1.00 0.00 ATOM 529 HY POP 5 62.660 54.800 62.760 1.00 0.00 ATOM 530 O31 POP 5 62.050 53.550 61.170 1.00 0.00 ATOM 531 C31 POP 5 62.700 54.420 60.390 1.00 0.00 ATOM 532 O32 POP 5 62.950 55.570 60.700 1.00 0.00 ATOM 533 C32 POP 5 63.210 53.710 59.140 1.00 0.00 ATOM 534 H2X POP 5 63.610 52.710 59.410 1.00 0.00 ATOM 535 H2Y POP 5 64.000 54.380 58.760 1.00 0.00 ATOM 536 C23 POP 5 60.970 58.080 60.190 1.00 0.00 ATOM 537 H3R POP 5 60.760 57.170 59.590 1.00 0.00 ATOM 538 H3S POP 5 62.060 58.120 60.410 1.00 0.00 ATOM 539 C24 POP 5 60.490 59.290 59.390 1.00 0.00 ATOM 540 H4R POP 5 60.540 60.200 60.030 1.00 0.00 ATOM 541 H4S POP 5 59.380 59.240 59.370 1.00 0.00 ATOM 542 C25 POP 5 61.230 59.550 58.070 1.00 0.00 ATOM 543 H5R POP 5 61.340 58.570 57.570 1.00 0.00 ATOM 544 H5S POP 5 62.270 59.670 58.430 1.00 0.00 ATOM 545 C26 POP 5 60.710 60.660 57.150 1.00 0.00 ATOM 546 H6R POP 5 61.050 61.650 57.510 1.00 0.00 ATOM 547 H6S POP 5 59.610 60.560 57.130 1.00 0.00 ATOM 548 C27 POP 5 61.370 60.510 55.780 1.00 0.00 ATOM 549 H7R POP 5 61.160 59.460 55.470 1.00 0.00 ATOM 550 H7S POP 5 62.480 60.560 55.790 1.00 0.00 ATOM 551 C28 POP 5 60.730 61.260 54.610 1.00 0.00 ATOM 552 H8R POP 5 60.710 62.330 54.920 1.00 0.00 ATOM 553 H8S POP 5 59.710 60.850 54.440 1.00 0.00 ATOM 554 C29 POP 5 61.600 61.270 53.390 1.00 0.00 ATOM 555 H91 POP 5 62.380 62.030 53.550 1.00 0.00 ATOM 556 0C21 POP 5 61.370 60.700 52.200 1.00 0.00 ATOM 557 1H10 POP 5 61.990 60.900 51.320 1.00 0.00 ATOM 558 1C21 POP 5 60.200 59.780 51.980 1.00 0.00 ATOM 559 H11R POP 5 59.310 60.310 51.570 1.00 0.00 ATOM 560 H11S POP 5 59.770 59.290 52.870 1.00 0.00 ATOM 561 2C21 POP 5 60.430 58.660 50.970 1.00 0.00 ATOM 562 H12R POP 5 61.370 58.180 51.320 1.00 0.00 ATOM 563 H12S POP 5 60.610 59.070 49.950 1.00 0.00 ATOM 564 3C21 POP 5 59.390 57.560 50.680 1.00 0.00 ATOM 565 H13R POP 5 58.900 57.280 51.640 1.00 0.00 ATOM 566 H13S POP 5 59.840 56.600 50.340 1.00 0.00 ATOM 567 4C21 POP 5 58.330 58.020 49.690 1.00 0.00 ATOM 568 H14R POP 5 58.080 59.070 49.970 1.00 0.00 ATOM 569 H14S POP 5 57.380 57.490 49.910 1.00 0.00 ATOM 570 5C21 POP 5 58.640 57.850 48.200 1.00 0.00 ATOM 571 H15R POP 5 58.490 56.830 47.790 1.00 0.00 ATOM 572 H15S POP 5 59.670 58.200 47.980 1.00 0.00 ATOM 573 6C21 POP 5 57.750 58.610 47.210 1.00 0.00 ATOM 574 H16R POP 5 57.760 59.680 47.530 1.00 0.00 ATOM 575 H16S POP 5 56.700 58.270 47.350 1.00 0.00 ATOM 576 7C21 POP 5 58.090 58.360 45.740 1.00 0.00 ATOM 577 H17R POP 5 57.960 57.270 45.600 1.00 0.00 ATOM 578 H17S POP 5 59.130 58.720 45.660 1.00 0.00 ATOM 579 8C21 POP 5 57.310 59.110 44.660 1.00 0.00 ATOM 580 H18R POP 5 56.280 58.710 44.700 1.00 0.00 ATOM 581 H18S POP 5 57.750 58.830 43.680 1.00 0.00 ATOM 582 H18T POP 5 57.360 60.220 44.780 1.00 0.00 ATOM 583 C33 POP 5 62.110 53.730 58.080 1.00 0.00 ATOM 584 H3X POP 5 62.050 54.780 57.720 1.00 0.00 ATOM 585 H3Y POP 5 61.190 53.500 58.660 1.00 0.00 ATOM 586 C34 POP 5 62.190 52.610 57.040 1.00 0.00 ATOM 587 H4X POP 5 62.350 51.700 57.660 1.00 0.00 ATOM 588 H4Y POP 5 63.020 52.900 56.370 1.00 0.00 ATOM 589 C35 POP 5 60.890 52.450 56.260 1.00 0.00 ATOM 590 H5X POP 5 60.040 52.910 56.800 1.00 0.00 ATOM 591 H5Y POP 5 60.650 51.390 56.040 1.00 0.00 ATOM 592 C36 POP 5 60.860 53.300 54.980 1.00 0.00 ATOM 593 H6X POP 5 61.010 54.390 55.140 1.00 0.00 ATOM 594 H6Y POP 5 59.820 53.330 54.610 1.00 0.00 ATOM 595 C37 POP 5 61.710 52.640 53.890 1.00 0.00 ATOM 596 H7X POP 5 61.560 51.540 53.820 1.00 0.00 ATOM 597 H7Y POP 5 62.790 52.800 54.110 1.00 0.00 ATOM 598 C38 POP 5 61.250 53.130 52.520 1.00 0.00 ATOM 599 H8X POP 5 61.650 54.160 52.340 1.00 0.00 ATOM 600 H8Y POP 5 60.150 53.130 52.440 1.00 0.00 ATOM 601 C39 POP 5 61.970 52.190 51.550 1.00 0.00 ATOM 602 H9X POP 5 61.550 51.160 51.580 1.00 0.00 ATOM 603 H9Y POP 5 63.010 52.030 51.880 1.00 0.00 ATOM 604 0C31 POP 5 61.980 52.690 50.100 1.00 0.00 ATOM 605 H10X POP 5 62.610 51.940 49.560 1.00 0.00 ATOM 606 H10Y POP 5 62.540 53.650 50.130 1.00 0.00 ATOM 607 1C31 POP 5 60.670 52.780 49.330 1.00 0.00 ATOM 608 H11X POP 5 60.290 53.830 49.390 1.00 0.00 ATOM 609 H11Y POP 5 59.980 52.080 49.850 1.00 0.00 ATOM 610 2C31 POP 5 60.740 52.480 47.830 1.00 0.00 ATOM 611 H12X POP 5 59.720 52.290 47.440 1.00 0.00 ATOM 612 H12Y POP 5 61.360 51.580 47.640 1.00 0.00 ATOM 613 3C31 POP 5 61.320 53.700 47.110 1.00 0.00 ATOM 614 H13X POP 5 61.960 53.320 46.290 1.00 0.00 ATOM 615 H13Y POP 5 61.910 54.280 47.850 1.00 0.00 ATOM 616 4C31 POP 5 60.260 54.610 46.480 1.00 0.00 ATOM 617 H14X POP 5 59.680 55.190 47.230 1.00 0.00 ATOM 618 H14Y POP 5 59.550 54.010 45.860 1.00 0.00 ATOM 619 5C31 POP 5 60.910 55.600 45.520 1.00 0.00 ATOM 620 H15X POP 5 60.080 56.210 45.100 1.00 0.00 ATOM 621 H15Y POP 5 61.290 54.940 44.710 1.00 0.00 ATOM 622 6C31 POP 5 61.980 56.600 45.960 1.00 0.00 ATOM 623 H16X POP 5 62.160 57.330 45.140 1.00 0.00 ATOM 624 H16Y POP 5 62.960 56.180 46.260 1.00 0.00 ATOM 625 H16Z POP 5 61.690 57.190 46.850 1.00 0.00 ATOM 626 N POP 6 45.930 36.880 67.080 1.00 0.00 ATOM 627 HN1 POP 6 45.900 37.830 66.670 1.00 0.00 ATOM 628 HN2 POP 6 45.630 36.110 66.440 1.00 0.00 ATOM 629 HN3 POP 6 45.280 36.920 67.880 1.00 0.00 ATOM 630 C12 POP 6 47.370 36.690 67.500 1.00 0.00 ATOM 631 H12A POP 6 47.530 36.260 68.510 1.00 0.00 ATOM 632 H12B POP 6 47.800 37.710 67.410 1.00 0.00 ATOM 633 C11 POP 6 48.100 35.880 66.420 1.00 0.00 ATOM 634 H11A POP 6 47.670 34.860 66.380 1.00 0.00 ATOM 635 H11B POP 6 49.170 35.960 66.710 1.00 0.00 ATOM 636 P POP 6 49.250 36.520 64.300 1.00 0.00 ATOM 637 O13 POP 6 49.820 35.160 64.420 1.00 0.00 ATOM 638 O14 POP 6 50.070 37.640 64.790 1.00 0.00 ATOM 639 O11 POP 6 48.820 36.740 62.770 1.00 0.00 ATOM 640 O12 POP 6 47.890 36.500 65.140 1.00 0.00 ATOM 641 C1 POP 6 47.480 36.530 62.320 1.00 0.00 ATOM 642 HA POP 6 47.470 37.050 61.340 1.00 0.00 ATOM 643 HB POP 6 46.710 36.930 63.010 1.00 0.00 ATOM 644 C2 POP 6 47.380 35.000 62.140 1.00 0.00 ATOM 645 HS POP 6 47.450 34.610 63.170 1.00 0.00 ATOM 646 O21 POP 6 48.580 34.540 61.500 1.00 0.00 ATOM 647 C21 POP 6 48.690 33.220 61.630 1.00 0.00 ATOM 648 O22 POP 6 47.840 32.540 62.180 1.00 0.00 ATOM 649 C22 POP 6 49.920 32.820 60.830 1.00 0.00 ATOM 650 H2R POP 6 50.860 33.150 61.300 1.00 0.00 ATOM 651 H2S POP 6 49.780 33.270 59.820 1.00 0.00 ATOM 652 C3 POP 6 46.090 34.560 61.420 1.00 0.00 ATOM 653 HX POP 6 45.310 35.010 62.070 1.00 0.00 ATOM 654 HY POP 6 46.040 33.460 61.360 1.00 0.00 ATOM 655 O31 POP 6 45.950 34.940 60.050 1.00 0.00 ATOM 656 C31 POP 6 44.780 35.540 59.830 1.00 0.00 ATOM 657 O32 POP 6 43.820 35.520 60.580 1.00 0.00 ATOM 658 C32 POP 6 44.830 36.300 58.510 1.00 0.00 ATOM 659 H2X POP 6 44.680 35.530 57.720 1.00 0.00 ATOM 660 H2Y POP 6 45.740 36.920 58.480 1.00 0.00 ATOM 661 C23 POP 6 49.930 31.340 60.440 1.00 0.00 ATOM 662 H3R POP 6 49.270 31.170 59.570 1.00 0.00 ATOM 663 H3S POP 6 49.400 30.740 61.210 1.00 0.00 ATOM 664 C24 POP 6 51.330 30.830 60.090 1.00 0.00 ATOM 665 H4R POP 6 52.070 31.090 60.870 1.00 0.00 ATOM 666 H4S POP 6 51.720 31.370 59.200 1.00 0.00 ATOM 667 C25 POP 6 51.370 29.320 59.850 1.00 0.00 ATOM 668 H5R POP 6 51.090 28.870 60.830 1.00 0.00 ATOM 669 H5S POP 6 52.440 29.100 59.650 1.00 0.00 ATOM 670 C26 POP 6 50.600 28.790 58.630 1.00 0.00 ATOM 671 H6R POP 6 49.540 29.080 58.720 1.00 0.00 ATOM 672 H6S POP 6 50.550 27.680 58.570 1.00 0.00 ATOM 673 C27 POP 6 51.270 29.250 57.340 1.00 0.00 ATOM 674 H7R POP 6 52.230 28.690 57.420 1.00 0.00 ATOM 675 H7S POP 6 51.510 30.330 57.330 1.00 0.00 ATOM 676 C28 POP 6 50.380 28.890 56.140 1.00 0.00 ATOM 677 H8R POP 6 49.460 29.480 56.320 1.00 0.00 ATOM 678 H8S POP 6 50.120 27.810 56.150 1.00 0.00 ATOM 679 C29 POP 6 50.930 29.260 54.790 1.00 0.00 ATOM 680 H91 POP 6 51.260 28.370 54.220 1.00 0.00 ATOM 681 0C21 POP 6 50.980 30.450 54.180 1.00 0.00 ATOM 682 1H10 POP 6 51.480 30.450 53.200 1.00 0.00 ATOM 683 1C21 POP 6 50.540 31.770 54.750 1.00 0.00 ATOM 684 H11R POP 6 49.840 31.670 55.600 1.00 0.00 ATOM 685 H11S POP 6 49.980 32.420 54.050 1.00 0.00 ATOM 686 2C21 POP 6 51.810 32.520 55.160 1.00 0.00 ATOM 687 H12R POP 6 52.620 32.420 54.400 1.00 0.00 ATOM 688 H12S POP 6 52.090 32.080 56.140 1.00 0.00 ATOM 689 3C21 POP 6 51.740 34.040 55.310 1.00 0.00 ATOM 690 H13R POP 6 51.520 34.520 54.340 1.00 0.00 ATOM 691 H13S POP 6 52.640 34.540 55.750 1.00 0.00 ATOM 692 4C21 POP 6 50.630 34.430 56.290 1.00 0.00 ATOM 693 H14R POP 6 50.890 34.040 57.300 1.00 0.00 ATOM 694 H14S POP 6 49.680 33.920 56.030 1.00 0.00 ATOM 695 5C21 POP 6 50.360 35.930 56.400 1.00 0.00 ATOM 696 H15R POP 6 50.140 36.170 55.340 1.00 0.00 ATOM 697 H15S POP 6 51.250 36.440 56.830 1.00 0.00 ATOM 698 6C21 POP 6 49.160 36.250 57.300 1.00 0.00 ATOM 699 H16R POP 6 49.390 36.060 58.360 1.00 0.00 ATOM 700 H16S POP 6 48.220 35.720 57.040 1.00 0.00 ATOM 701 7C21 POP 6 48.810 37.720 57.040 1.00 0.00 ATOM 702 H17R POP 6 47.720 37.690 57.250 1.00 0.00 ATOM 703 H17S POP 6 48.820 38.070 55.980 1.00 0.00 ATOM 704 8C21 POP 6 49.440 38.710 58.020 1.00 0.00 ATOM 705 H18R POP 6 48.840 38.660 58.950 1.00 0.00 ATOM 706 H18S POP 6 49.560 39.730 57.590 1.00 0.00 ATOM 707 H18T POP 6 50.440 38.350 58.360 1.00 0.00 ATOM 708 C33 POP 6 43.660 37.280 58.410 1.00 0.00 ATOM 709 H3X POP 6 43.650 37.930 59.320 1.00 0.00 ATOM 710 H3Y POP 6 42.690 36.750 58.330 1.00 0.00 ATOM 711 C34 POP 6 43.930 38.160 57.190 1.00 0.00 ATOM 712 H4X POP 6 44.450 37.700 56.310 1.00 0.00 ATOM 713 H4Y POP 6 44.530 39.030 57.530 1.00 0.00 ATOM 714 C35 POP 6 42.640 38.730 56.600 1.00 0.00 ATOM 715 H5X POP 6 41.980 39.150 57.390 1.00 0.00 ATOM 716 H5Y POP 6 42.070 37.900 56.130 1.00 0.00 ATOM 717 C36 POP 6 42.810 39.860 55.590 1.00 0.00 ATOM 718 H6X POP 6 43.800 40.330 55.800 1.00 0.00 ATOM 719 H6Y POP 6 42.000 40.620 55.660 1.00 0.00 ATOM 720 C37 POP 6 42.900 39.410 54.130 1.00 0.00 ATOM 721 H7X POP 6 42.160 38.580 54.100 1.00 0.00 ATOM 722 H7Y POP 6 43.960 39.090 54.050 1.00 0.00 ATOM 723 C38 POP 6 42.520 40.330 52.970 1.00 0.00 ATOM 724 H8X POP 6 42.670 39.730 52.050 1.00 0.00 ATOM 725 H8Y POP 6 43.250 41.180 52.970 1.00 0.00 ATOM 726 C39 POP 6 41.060 40.750 53.050 1.00 0.00 ATOM 727 H9X POP 6 40.710 41.610 53.670 1.00 0.00 ATOM 728 H9Y POP 6 40.460 39.850 53.300 1.00 0.00 ATOM 729 0C31 POP 6 40.790 41.210 51.620 1.00 0.00 ATOM 730 H10X POP 6 40.990 40.430 50.860 1.00 0.00 ATOM 731 H10Y POP 6 41.480 42.060 51.460 1.00 0.00 ATOM 732 1C31 POP 6 39.340 41.710 51.530 1.00 0.00 ATOM 733 H11X POP 6 39.290 42.470 52.330 1.00 0.00 ATOM 734 H11Y POP 6 38.540 40.950 51.650 1.00 0.00 ATOM 735 2C31 POP 6 38.940 42.520 50.300 1.00 0.00 ATOM 736 H12X POP 6 39.690 43.320 50.180 1.00 0.00 ATOM 737 H12Y POP 6 38.020 43.100 50.530 1.00 0.00 ATOM 738 3C31 POP 6 38.830 41.740 48.990 1.00 0.00 ATOM 739 H13X POP 6 38.110 40.900 49.140 1.00 0.00 ATOM 740 H13Y POP 6 39.810 41.220 48.890 1.00 0.00 ATOM 741 4C31 POP 6 38.630 42.530 47.700 1.00 0.00 ATOM 742 H14X POP 6 39.540 43.040 47.310 1.00 0.00 ATOM 743 H14Y POP 6 37.920 43.380 47.830 1.00 0.00 ATOM 744 5C31 POP 6 38.090 41.650 46.580 1.00 0.00 ATOM 745 H15X POP 6 37.730 42.350 45.800 1.00 0.00 ATOM 746 H15Y POP 6 37.280 41.010 47.000 1.00 0.00 ATOM 747 6C31 POP 6 39.050 40.570 46.070 1.00 0.00 ATOM 748 H16X POP 6 40.020 41.070 45.870 1.00 0.00 ATOM 749 H16Y POP 6 38.500 40.130 45.210 1.00 0.00 ATOM 750 H16Z POP 6 39.090 39.880 46.940 1.00 0.00 ATOM 751 N POP 7 24.960 23.330 66.320 1.00 0.00 ATOM 752 HN1 POP 7 25.880 23.410 65.850 1.00 0.00 ATOM 753 HN2 POP 7 24.790 24.120 66.980 1.00 0.00 ATOM 754 HN3 POP 7 24.860 22.440 66.850 1.00 0.00 ATOM 755 C12 POP 7 23.880 23.450 65.260 1.00 0.00 ATOM 756 H12A POP 7 22.940 23.110 65.750 1.00 0.00 ATOM 757 H12B POP 7 24.160 22.680 64.510 1.00 0.00 ATOM 758 C11 POP 7 23.790 24.900 64.800 1.00 0.00 ATOM 759 H11A POP 7 22.770 25.010 64.360 1.00 0.00 ATOM 760 H11B POP 7 24.540 24.950 63.980 1.00 0.00 ATOM 761 P POP 7 23.690 27.230 65.460 1.00 0.00 ATOM 762 O13 POP 7 24.750 28.060 66.070 1.00 0.00 ATOM 763 O14 POP 7 22.300 27.500 65.890 1.00 0.00 ATOM 764 O11 POP 7 23.880 27.340 63.870 1.00 0.00 ATOM 765 O12 POP 7 24.110 25.750 65.900 1.00 0.00 ATOM 766 C1 POP 7 25.070 27.880 63.300 1.00 0.00 ATOM 767 HA POP 7 25.310 27.570 62.260 1.00 0.00 ATOM 768 HB POP 7 25.970 27.570 63.880 1.00 0.00 ATOM 769 C2 POP 7 24.960 29.410 63.170 1.00 0.00 ATOM 770 HS POP 7 24.920 29.850 64.190 1.00 0.00 ATOM 771 O21 POP 7 23.750 29.700 62.460 1.00 0.00 ATOM 772 C21 POP 7 23.370 30.980 62.490 1.00 0.00 ATOM 773 O22 POP 7 23.950 31.870 63.080 1.00 0.00 ATOM 774 C22 POP 7 22.070 31.180 61.720 1.00 0.00 ATOM 775 H2R POP 7 21.320 30.980 62.520 1.00 0.00 ATOM 776 H2S POP 7 21.860 30.440 60.920 1.00 0.00 ATOM 777 C3 POP 7 26.180 30.040 62.480 1.00 0.00 ATOM 778 HX POP 7 27.090 29.790 63.060 1.00 0.00 ATOM 779 HY POP 7 26.110 31.140 62.460 1.00 0.00 ATOM 780 O31 POP 7 26.290 29.510 61.150 1.00 0.00 ATOM 781 C31 POP 7 27.270 30.020 60.410 1.00 0.00 ATOM 782 O32 POP 7 28.210 30.660 60.830 1.00 0.00 ATOM 783 C32 POP 7 27.060 29.560 58.970 1.00 0.00 ATOM 784 H2X POP 7 26.030 29.760 58.590 1.00 0.00 ATOM 785 H2Y POP 7 27.130 28.460 59.130 1.00 0.00 ATOM 786 C23 POP 7 22.150 32.600 61.160 1.00 0.00 ATOM 787 H3R POP 7 22.440 33.320 61.950 1.00 0.00 ATOM 788 H3S POP 7 21.120 32.820 60.820 1.00 0.00 ATOM 789 C24 POP 7 23.070 32.810 59.960 1.00 0.00 ATOM 790 H4R POP 7 24.110 32.430 60.080 1.00 0.00 ATOM 791 H4S POP 7 23.170 33.890 59.740 1.00 0.00 ATOM 792 C25 POP 7 22.560 32.060 58.730 1.00 0.00 ATOM 793 H5R POP 7 21.540 32.400 58.430 1.00 0.00 ATOM 794 H5S POP 7 22.570 30.980 58.980 1.00 0.00 ATOM 795 C26 POP 7 23.310 32.310 57.420 1.00 0.00 ATOM 796 H6R POP 7 24.310 31.850 57.580 1.00 0.00 ATOM 797 H6S POP 7 23.340 33.380 57.140 1.00 0.00 ATOM 798 C27 POP 7 22.560 31.630 56.270 1.00 0.00 ATOM 799 H7R POP 7 21.490 31.350 56.400 1.00 0.00 ATOM 800 H7S POP 7 23.140 30.710 56.060 1.00 0.00 ATOM 801 C28 POP 7 22.480 32.480 55.000 1.00 0.00 ATOM 802 H8R POP 7 23.470 32.450 54.500 1.00 0.00 ATOM 803 H8S POP 7 22.310 33.560 55.200 1.00 0.00 ATOM 804 C29 POP 7 21.370 32.060 54.080 1.00 0.00 ATOM 805 H91 POP 7 20.910 31.070 54.240 1.00 0.00 ATOM 806 0C21 POP 7 20.930 32.790 53.050 1.00 0.00 ATOM 807 1H10 POP 7 19.990 32.440 52.600 1.00 0.00 ATOM 808 1C21 POP 7 21.370 34.140 52.570 1.00 0.00 ATOM 809 H11R POP 7 22.400 34.330 52.940 1.00 0.00 ATOM 810 H11S POP 7 20.830 35.000 53.020 1.00 0.00 ATOM 811 2C21 POP 7 21.410 34.370 51.060 1.00 0.00 ATOM 812 H12R POP 7 20.330 34.380 50.780 1.00 0.00 ATOM 813 H12S POP 7 21.990 33.610 50.500 1.00 0.00 ATOM 814 3C21 POP 7 21.770 35.830 50.770 1.00 0.00 ATOM 815 H13R POP 7 22.850 35.960 50.970 1.00 0.00 ATOM 816 H13S POP 7 21.250 36.520 51.470 1.00 0.00 ATOM 817 4C21 POP 7 21.330 36.320 49.380 1.00 0.00 ATOM 818 H14R POP 7 21.850 37.260 49.120 1.00 0.00 ATOM 819 H14S POP 7 20.250 36.560 49.490 1.00 0.00 ATOM 820 5C21 POP 7 21.610 35.280 48.290 1.00 0.00 ATOM 821 H15R POP 7 20.890 34.460 48.490 1.00 0.00 ATOM 822 H15S POP 7 22.650 34.930 48.450 1.00 0.00 ATOM 823 6C21 POP 7 21.330 35.900 46.920 1.00 0.00 ATOM 824 H16R POP 7 21.940 36.800 46.720 1.00 0.00 ATOM 825 H16S POP 7 20.330 36.370 47.020 1.00 0.00 ATOM 826 7C21 POP 7 21.200 34.880 45.790 1.00 0.00 ATOM 827 H17R POP 7 20.810 35.340 44.850 1.00 0.00 ATOM 828 H17S POP 7 20.560 34.040 46.120 1.00 0.00 ATOM 829 8C21 POP 7 22.540 34.260 45.380 1.00 0.00 ATOM 830 H18R POP 7 23.310 34.950 44.990 1.00 0.00 ATOM 831 H18S POP 7 22.410 33.540 44.540 1.00 0.00 ATOM 832 H18T POP 7 23.020 33.680 46.190 1.00 0.00 ATOM 833 C33 POP 7 27.970 30.220 57.940 1.00 0.00 ATOM 834 H3X POP 7 28.450 29.450 57.300 1.00 0.00 ATOM 835 H3Y POP 7 28.820 30.800 58.380 1.00 0.00 ATOM 836 C34 POP 7 27.250 31.180 57.000 1.00 0.00 ATOM 837 H4X POP 7 27.990 31.850 56.510 1.00 0.00 ATOM 838 H4Y POP 7 26.490 31.770 57.560 1.00 0.00 ATOM 839 C35 POP 7 26.560 30.420 55.860 1.00 0.00 ATOM 840 H5X POP 7 25.790 31.110 55.460 1.00 0.00 ATOM 841 H5Y POP 7 25.970 29.590 56.290 1.00 0.00 ATOM 842 C36 POP 7 27.580 29.870 54.870 1.00 0.00 ATOM 843 H6X POP 7 28.330 29.260 55.410 1.00 0.00 ATOM 844 H6Y POP 7 28.080 30.650 54.260 1.00 0.00 ATOM 845 C37 POP 7 26.950 28.880 53.880 1.00 0.00 ATOM 846 H7X POP 7 26.240 29.490 53.290 1.00 0.00 ATOM 847 H7Y POP 7 26.510 28.080 54.510 1.00 0.00 ATOM 848 C38 POP 7 28.030 28.290 52.970 1.00 0.00 ATOM 849 H8X POP 7 27.460 27.840 52.130 1.00 0.00 ATOM 850 H8Y POP 7 28.500 27.410 53.480 1.00 0.00 ATOM 851 C39 POP 7 29.170 29.190 52.500 1.00 0.00 ATOM 852 H9X POP 7 29.710 29.630 53.370 1.00 0.00 ATOM 853 H9Y POP 7 28.700 30.090 52.050 1.00 0.00 ATOM 854 0C31 POP 7 30.130 28.550 51.500 1.00 0.00 ATOM 855 H10X POP 7 30.570 27.700 52.080 1.00 0.00 ATOM 856 H10Y POP 7 30.880 29.300 51.170 1.00 0.00 ATOM 857 1C31 POP 7 29.450 28.090 50.210 1.00 0.00 ATOM 858 H11X POP 7 28.650 28.830 49.980 1.00 0.00 ATOM 859 H11Y POP 7 28.940 27.120 50.400 1.00 0.00 ATOM 860 2C31 POP 7 30.500 27.960 49.100 1.00 0.00 ATOM 861 H12X POP 7 29.990 27.450 48.260 1.00 0.00 ATOM 862 H12Y POP 7 31.330 27.260 49.330 1.00 0.00 ATOM 863 3C31 POP 7 31.020 29.310 48.610 1.00 0.00 ATOM 864 H13X POP 7 31.720 29.690 49.390 1.00 0.00 ATOM 865 H13Y POP 7 30.220 30.060 48.460 1.00 0.00 ATOM 866 4C31 POP 7 31.730 29.220 47.260 1.00 0.00 ATOM 867 H14X POP 7 32.460 30.060 47.200 1.00 0.00 ATOM 868 H14Y POP 7 32.330 28.310 47.060 1.00 0.00 ATOM 869 5C31 POP 7 30.730 29.080 46.110 1.00 0.00 ATOM 870 H15X POP 7 29.830 29.720 46.160 1.00 0.00 ATOM 871 H15Y POP 7 30.360 28.040 46.140 1.00 0.00 ATOM 872 6C31 POP 7 31.390 29.260 44.740 1.00 0.00 ATOM 873 H16X POP 7 31.840 30.270 44.740 1.00 0.00 ATOM 874 H16Y POP 7 32.250 28.570 44.580 1.00 0.00 ATOM 875 H16Z POP 7 30.620 29.220 43.940 1.00 0.00 ATOM 876 N POP 8 45.230 12.610 66.680 1.00 0.00 ATOM 877 HN1 POP 8 44.940 12.810 65.700 1.00 0.00 ATOM 878 HN2 POP 8 45.200 13.450 67.290 1.00 0.00 ATOM 879 HN3 POP 8 46.200 12.250 66.690 1.00 0.00 ATOM 880 C12 POP 8 44.470 11.560 67.470 1.00 0.00 ATOM 881 H12A POP 8 44.430 11.810 68.550 1.00 0.00 ATOM 882 H12B POP 8 45.060 10.620 67.360 1.00 0.00 ATOM 883 C11 POP 8 43.070 11.280 66.920 1.00 0.00 ATOM 884 H11A POP 8 42.590 12.250 66.670 1.00 0.00 ATOM 885 H11B POP 8 42.460 10.760 67.680 1.00 0.00 ATOM 886 P POP 8 41.900 10.090 64.940 1.00 0.00 ATOM 887 O13 POP 8 40.770 10.890 65.450 1.00 0.00 ATOM 888 O14 POP 8 41.640 8.630 64.950 1.00 0.00 ATOM 889 O11 POP 8 42.380 10.570 63.480 1.00 0.00 ATOM 890 O12 POP 8 43.190 10.350 65.840 1.00 0.00 ATOM 891 C1 POP 8 43.700 10.160 63.110 1.00 0.00 ATOM 892 HA POP 8 43.970 9.140 63.470 1.00 0.00 ATOM 893 HB POP 8 44.430 10.780 63.670 1.00 0.00 ATOM 894 C2 POP 8 44.000 10.360 61.620 1.00 0.00 ATOM 895 HS POP 8 44.110 11.460 61.490 1.00 0.00 ATOM 896 O21 POP 8 42.990 9.930 60.710 1.00 0.00 ATOM 897 C21 POP 8 42.740 8.620 60.670 1.00 0.00 ATOM 898 O22 POP 8 43.110 7.810 61.500 1.00 0.00 ATOM 899 C22 POP 8 41.870 8.180 59.500 1.00 0.00 ATOM 900 H2R POP 8 42.430 8.460 58.570 1.00 0.00 ATOM 901 H2S POP 8 40.920 8.740 59.590 1.00 0.00 ATOM 902 C3 POP 8 45.400 9.790 61.340 1.00 0.00 ATOM 903 HX POP 8 45.380 8.780 61.810 1.00 0.00 ATOM 904 HY POP 8 46.070 10.410 61.970 1.00 0.00 ATOM 905 O31 POP 8 45.810 9.630 59.980 1.00 0.00 ATOM 906 C31 POP 8 45.960 10.780 59.330 1.00 0.00 ATOM 907 O32 POP 8 45.880 11.890 59.840 1.00 0.00 ATOM 908 C32 POP 8 46.210 10.530 57.850 1.00 0.00 ATOM 909 H2X POP 8 45.430 9.880 57.410 1.00 0.00 ATOM 910 H2Y POP 8 47.180 10.050 57.630 1.00 0.00 ATOM 911 C23 POP 8 41.710 6.660 59.480 1.00 0.00 ATOM 912 H3R POP 8 41.050 6.330 60.310 1.00 0.00 ATOM 913 H3S POP 8 42.680 6.180 59.710 1.00 0.00 ATOM 914 C24 POP 8 41.050 6.330 58.140 1.00 0.00 ATOM 915 H4R POP 8 41.500 6.930 57.330 1.00 0.00 ATOM 916 H4S POP 8 39.940 6.450 58.140 1.00 0.00 ATOM 917 C25 POP 8 41.110 4.850 57.760 1.00 0.00 ATOM 918 H5R POP 8 40.880 4.160 58.600 1.00 0.00 ATOM 919 H5S POP 8 42.160 4.740 57.410 1.00 0.00 ATOM 920 C26 POP 8 40.180 4.460 56.610 1.00 0.00 ATOM 921 H6R POP 8 39.120 4.390 56.940 1.00 0.00 ATOM 922 H6S POP 8 40.410 3.430 56.290 1.00 0.00 ATOM 923 C27 POP 8 40.310 5.350 55.370 1.00 0.00 ATOM 924 H7R POP 8 41.250 5.020 54.890 1.00 0.00 ATOM 925 H7S POP 8 40.200 6.420 55.610 1.00 0.00 ATOM 926 C28 POP 8 39.300 4.970 54.280 1.00 0.00 ATOM 927 H8R POP 8 39.170 5.720 53.470 1.00 0.00 ATOM 928 H8S POP 8 38.280 4.880 54.690 1.00 0.00 ATOM 929 C29 POP 8 39.610 3.660 53.610 1.00 0.00 ATOM 930 H91 POP 8 39.620 2.760 54.250 1.00 0.00 ATOM 931 0C21 POP 8 39.760 3.450 52.300 1.00 0.00 ATOM 932 1H10 POP 8 39.970 2.450 51.890 1.00 0.00 ATOM 933 1C21 POP 8 39.770 4.540 51.260 1.00 0.00 ATOM 934 H11R POP 8 40.360 5.390 51.680 1.00 0.00 ATOM 935 H11S POP 8 38.730 4.810 51.000 1.00 0.00 ATOM 936 2C21 POP 8 40.580 4.160 50.010 1.00 0.00 ATOM 937 H12R POP 8 40.400 3.090 49.770 1.00 0.00 ATOM 938 H12S POP 8 41.660 4.300 50.220 1.00 0.00 ATOM 939 3C21 POP 8 40.220 5.130 48.890 1.00 0.00 ATOM 940 H13R POP 8 40.460 6.160 49.230 1.00 0.00 ATOM 941 H13S POP 8 39.150 4.970 48.610 1.00 0.00 ATOM 942 4C21 POP 8 41.030 4.780 47.640 1.00 0.00 ATOM 943 H14R POP 8 40.560 3.830 47.310 1.00 0.00 ATOM 944 H14S POP 8 42.030 4.620 48.100 1.00 0.00 ATOM 945 5C21 POP 8 41.010 5.860 46.550 1.00 0.00 ATOM 946 H15R POP 8 41.310 6.820 47.030 1.00 0.00 ATOM 947 H15S POP 8 39.990 5.880 46.120 1.00 0.00 ATOM 948 6C21 POP 8 41.900 5.600 45.340 1.00 0.00 ATOM 949 H16R POP 8 41.640 6.290 44.510 1.00 0.00 ATOM 950 H16S POP 8 41.720 4.540 45.060 1.00 0.00 ATOM 951 7C21 POP 8 43.400 5.780 45.560 1.00 0.00 ATOM 952 H17R POP 8 43.690 5.340 46.540 1.00 0.00 ATOM 953 H17S POP 8 43.550 6.870 45.610 1.00 0.00 ATOM 954 8C21 POP 8 44.290 5.250 44.430 1.00 0.00 ATOM 955 H18R POP 8 44.900 4.420 44.840 1.00 0.00 ATOM 956 H18S POP 8 44.940 6.060 44.030 1.00 0.00 ATOM 957 H18T POP 8 43.640 4.900 43.600 1.00 0.00 ATOM 958 C33 POP 8 46.080 11.820 57.030 1.00 0.00 ATOM 959 H3X POP 8 46.810 12.620 57.290 1.00 0.00 ATOM 960 H3Y POP 8 45.030 12.160 57.180 1.00 0.00 ATOM 961 C34 POP 8 46.170 11.510 55.540 1.00 0.00 ATOM 962 H4X POP 8 45.270 10.880 55.360 1.00 0.00 ATOM 963 H4Y POP 8 47.020 10.810 55.390 1.00 0.00 ATOM 964 C35 POP 8 46.060 12.630 54.500 1.00 0.00 ATOM 965 H5X POP 8 47.000 13.210 54.380 1.00 0.00 ATOM 966 H5Y POP 8 45.330 13.360 54.880 1.00 0.00 ATOM 967 C36 POP 8 45.620 12.140 53.110 1.00 0.00 ATOM 968 H6X POP 8 44.740 11.480 53.230 1.00 0.00 ATOM 969 H6Y POP 8 46.420 11.590 52.580 1.00 0.00 ATOM 970 C37 POP 8 45.380 13.300 52.140 1.00 0.00 ATOM 971 H7X POP 8 46.350 13.810 51.970 1.00 0.00 ATOM 972 H7Y POP 8 44.620 13.990 52.560 1.00 0.00 ATOM 973 C38 POP 8 44.760 12.870 50.800 1.00 0.00 ATOM 974 H8X POP 8 43.670 12.860 50.980 1.00 0.00 ATOM 975 H8Y POP 8 45.200 11.930 50.400 1.00 0.00 ATOM 976 C39 POP 8 44.960 13.980 49.770 1.00 0.00 ATOM 977 H9X POP 8 46.060 14.110 49.890 1.00 0.00 ATOM 978 H9Y POP 8 44.440 14.940 49.980 1.00 0.00 ATOM 979 0C31 POP 8 44.660 13.420 48.380 1.00 0.00 ATOM 980 H10X POP 8 43.580 13.200 48.330 1.00 0.00 ATOM 981 H10Y POP 8 45.130 12.440 48.130 1.00 0.00 ATOM 982 1C31 POP 8 44.970 14.490 47.320 1.00 0.00 ATOM 983 H11X POP 8 46.010 14.880 47.440 1.00 0.00 ATOM 984 H11Y POP 8 44.200 15.280 47.410 1.00 0.00 ATOM 985 2C31 POP 8 44.940 13.940 45.890 1.00 0.00 ATOM 986 H12X POP 8 45.430 14.620 45.170 1.00 0.00 ATOM 987 H12Y POP 8 45.420 12.940 45.770 1.00 0.00 ATOM 988 3C31 POP 8 43.520 13.770 45.360 1.00 0.00 ATOM 989 H13X POP 8 42.890 14.690 45.450 1.00 0.00 ATOM 990 H13Y POP 8 43.020 13.020 46.020 1.00 0.00 ATOM 991 4C31 POP 8 43.530 13.260 43.920 1.00 0.00 ATOM 992 H14X POP 8 44.370 12.570 43.720 1.00 0.00 ATOM 993 H14Y POP 8 43.830 14.130 43.280 1.00 0.00 ATOM 994 5C31 POP 8 42.170 12.760 43.410 1.00 0.00 ATOM 995 H15X POP 8 42.120 12.950 42.320 1.00 0.00 ATOM 996 H15Y POP 8 41.440 13.380 43.970 1.00 0.00 ATOM 997 6C31 POP 8 41.860 11.310 43.790 1.00 0.00 ATOM 998 H16X POP 8 42.550 10.580 43.330 1.00 0.00 ATOM 999 H16Y POP 8 40.800 11.020 43.630 1.00 0.00 ATOM 1000 H16Z POP 8 42.030 11.100 44.870 1.00 0.00 ATOM 1001 N POP 9 31.050 44.400 69.020 1.00 0.00 ATOM 1002 HN1 POP 9 31.730 44.290 69.800 1.00 0.00 ATOM 1003 HN2 POP 9 31.470 44.400 68.070 1.00 0.00 ATOM 1004 HN3 POP 9 30.630 45.350 69.160 1.00 0.00 ATOM 1005 C12 POP 9 29.830 43.510 69.120 1.00 0.00 ATOM 1006 H12A POP 9 29.140 43.940 68.360 1.00 0.00 ATOM 1007 H12B POP 9 29.290 43.690 70.070 1.00 0.00 ATOM 1008 C11 POP 9 30.060 42.020 68.860 1.00 0.00 ATOM 1009 H11A POP 9 29.110 41.490 69.130 1.00 0.00 ATOM 1010 H11B POP 9 30.800 41.590 69.560 1.00 0.00 ATOM 1011 P POP 9 29.360 41.110 66.700 1.00 0.00 ATOM 1012 O13 POP 9 29.120 39.740 67.190 1.00 0.00 ATOM 1013 O14 POP 9 28.190 42.010 66.860 1.00 0.00 ATOM 1014 O11 POP 9 29.950 41.050 65.210 1.00 0.00 ATOM 1015 O12 POP 9 30.570 41.720 67.560 1.00 0.00 ATOM 1016 C1 POP 9 31.340 40.710 65.160 1.00 0.00 ATOM 1017 HA POP 9 31.510 39.680 65.550 1.00 0.00 ATOM 1018 HB POP 9 32.000 41.370 65.760 1.00 0.00 ATOM 1019 C2 POP 9 31.750 40.590 63.690 1.00 0.00 ATOM 1020 HS POP 9 32.090 41.610 63.410 1.00 0.00 ATOM 1021 O21 POP 9 30.680 40.290 62.790 1.00 0.00 ATOM 1022 C21 POP 9 30.120 39.080 62.860 1.00 0.00 ATOM 1023 O22 POP 9 30.450 38.210 63.650 1.00 0.00 ATOM 1024 C22 POP 9 28.980 38.940 61.870 1.00 0.00 ATOM 1025 H2R POP 9 28.780 39.900 61.350 1.00 0.00 ATOM 1026 H2S POP 9 28.040 38.580 62.350 1.00 0.00 ATOM 1027 C3 POP 9 32.950 39.640 63.460 1.00 0.00 ATOM 1028 HX POP 9 32.700 38.620 63.800 1.00 0.00 ATOM 1029 HY POP 9 33.740 40.050 64.120 1.00 0.00 ATOM 1030 O31 POP 9 33.210 39.600 62.060 1.00 0.00 ATOM 1031 C31 POP 9 34.500 39.780 61.760 1.00 0.00 ATOM 1032 O32 POP 9 35.250 40.410 62.490 1.00 0.00 ATOM 1033 C32 POP 9 34.740 39.250 60.360 1.00 0.00 ATOM 1034 H2X POP 9 34.120 38.350 60.170 1.00 0.00 ATOM 1035 H2Y POP 9 35.810 38.970 60.380 1.00 0.00 ATOM 1036 C23 POP 9 29.430 37.920 60.820 1.00 0.00 ATOM 1037 H3R POP 9 28.480 37.720 60.270 1.00 0.00 ATOM 1038 H3S POP 9 29.560 36.990 61.410 1.00 0.00 ATOM 1039 C24 POP 9 30.600 38.380 59.950 1.00 0.00 ATOM 1040 H4R POP 9 31.430 38.780 60.560 1.00 0.00 ATOM 1041 H4S POP 9 30.250 39.280 59.390 1.00 0.00 ATOM 1042 C25 POP 9 30.910 37.410 58.810 1.00 0.00 ATOM 1043 H5R POP 9 30.070 36.830 58.370 1.00 0.00 ATOM 1044 H5S POP 9 31.480 36.560 59.250 1.00 0.00 ATOM 1045 C26 POP 9 31.760 38.010 57.690 1.00 0.00 ATOM 1046 H6R POP 9 32.790 38.150 58.090 1.00 0.00 ATOM 1047 H6S POP 9 31.370 39.020 57.460 1.00 0.00 ATOM 1048 C27 POP 9 31.890 37.120 56.450 1.00 0.00 ATOM 1049 H7R POP 9 30.890 36.740 56.150 1.00 0.00 ATOM 1050 H7S POP 9 32.520 36.300 56.860 1.00 0.00 ATOM 1051 C28 POP 9 32.700 37.810 55.350 1.00 0.00 ATOM 1052 H8R POP 9 33.520 38.290 55.930 1.00 0.00 ATOM 1053 H8S POP 9 32.130 38.640 54.870 1.00 0.00 ATOM 1054 C29 POP 9 33.130 36.720 54.420 1.00 0.00 ATOM 1055 H91 POP 9 33.180 35.730 54.890 1.00 0.00 ATOM 1056 0C21 POP 9 33.310 36.920 53.100 1.00 0.00 ATOM 1057 1H10 POP 9 33.800 36.130 52.520 1.00 0.00 ATOM 1058 1C21 POP 9 33.160 38.260 52.440 1.00 0.00 ATOM 1059 H11R POP 9 34.090 38.380 51.840 1.00 0.00 ATOM 1060 H11S POP 9 33.180 39.160 53.110 1.00 0.00 ATOM 1061 2C21 POP 9 31.960 38.150 51.510 1.00 0.00 ATOM 1062 H12R POP 9 31.050 37.910 52.090 1.00 0.00 ATOM 1063 H12S POP 9 32.130 37.290 50.810 1.00 0.00 ATOM 1064 3C21 POP 9 31.740 39.450 50.740 1.00 0.00 ATOM 1065 H13R POP 9 32.670 39.810 50.260 1.00 0.00 ATOM 1066 H13S POP 9 31.200 40.150 51.420 1.00 0.00 ATOM 1067 4C21 POP 9 30.730 39.160 49.630 1.00 0.00 ATOM 1068 H14R POP 9 29.970 38.470 50.060 1.00 0.00 ATOM 1069 H14S POP 9 31.290 38.570 48.870 1.00 0.00 ATOM 1070 5C21 POP 9 30.080 40.440 49.110 1.00 0.00 ATOM 1071 H15R POP 9 30.830 41.220 48.870 1.00 0.00 ATOM 1072 H15S POP 9 29.490 40.950 49.900 1.00 0.00 ATOM 1073 6C21 POP 9 29.390 40.160 47.770 1.00 0.00 ATOM 1074 H16R POP 9 30.240 39.640 47.290 1.00 0.00 ATOM 1075 H16S POP 9 29.330 41.170 47.310 1.00 0.00 ATOM 1076 7C21 POP 9 28.190 39.220 47.700 1.00 0.00 ATOM 1077 H17R POP 9 27.360 39.370 48.420 1.00 0.00 ATOM 1078 H17S POP 9 28.490 38.150 47.730 1.00 0.00 ATOM 1079 8C21 POP 9 27.550 39.420 46.330 1.00 0.00 ATOM 1080 H18R POP 9 26.700 40.130 46.400 1.00 0.00 ATOM 1081 H18S POP 9 27.030 38.480 46.080 1.00 0.00 ATOM 1082 H18T POP 9 28.310 39.520 45.520 1.00 0.00 ATOM 1083 C33 POP 9 34.570 40.360 59.310 1.00 0.00 ATOM 1084 H3X POP 9 34.980 41.350 59.580 1.00 0.00 ATOM 1085 H3Y POP 9 33.470 40.460 59.190 1.00 0.00 ATOM 1086 C34 POP 9 35.260 39.950 58.000 1.00 0.00 ATOM 1087 H4X POP 9 34.990 38.890 57.800 1.00 0.00 ATOM 1088 H4Y POP 9 36.340 40.160 58.170 1.00 0.00 ATOM 1089 C35 POP 9 34.660 40.730 56.840 1.00 0.00 ATOM 1090 H5X POP 9 34.570 41.800 57.130 1.00 0.00 ATOM 1091 H5Y POP 9 33.660 40.310 56.610 1.00 0.00 ATOM 1092 C36 POP 9 35.430 40.450 55.550 1.00 0.00 ATOM 1093 H6X POP 9 35.270 39.420 55.170 1.00 0.00 ATOM 1094 H6Y POP 9 36.530 40.550 55.710 1.00 0.00 ATOM 1095 C37 POP 9 34.900 41.400 54.470 1.00 0.00 ATOM 1096 H7X POP 9 35.040 42.460 54.780 1.00 0.00 ATOM 1097 H7Y POP 9 33.810 41.210 54.420 1.00 0.00 ATOM 1098 C38 POP 9 35.610 41.140 53.140 1.00 0.00 ATOM 1099 H8X POP 9 35.770 40.040 53.090 1.00 0.00 ATOM 1100 H8Y POP 9 36.620 41.600 53.110 1.00 0.00 ATOM 1101 C39 POP 9 34.770 41.660 51.980 1.00 0.00 ATOM 1102 H9X POP 9 33.770 41.170 51.960 1.00 0.00 ATOM 1103 H9Y POP 9 34.620 42.740 52.220 1.00 0.00 ATOM 1104 0C31 POP 9 35.500 41.360 50.670 1.00 0.00 ATOM 1105 H10X POP 9 35.400 40.270 50.490 1.00 0.00 ATOM 1106 H10Y POP 9 36.550 41.720 50.700 1.00 0.00 ATOM 1107 1C31 POP 9 34.870 42.080 49.480 1.00 0.00 ATOM 1108 H11X POP 9 33.800 41.820 49.340 1.00 0.00 ATOM 1109 H11Y POP 9 35.400 41.840 48.530 1.00 0.00 ATOM 1110 2C31 POP 9 35.030 43.600 49.590 1.00 0.00 ATOM 1111 H12X POP 9 36.090 43.890 49.740 1.00 0.00 ATOM 1112 H12Y POP 9 34.400 44.140 50.330 1.00 0.00 ATOM 1113 3C31 POP 9 34.540 44.190 48.270 1.00 0.00 ATOM 1114 H13X POP 9 33.450 44.000 48.350 1.00 0.00 ATOM 1115 H13Y POP 9 34.930 43.710 47.340 1.00 0.00 ATOM 1116 4C31 POP 9 34.760 45.690 48.130 1.00 0.00 ATOM 1117 H14X POP 9 35.820 46.020 48.020 1.00 0.00 ATOM 1118 H14Y POP 9 34.400 46.180 49.060 1.00 0.00 ATOM 1119 5C31 POP 9 33.790 46.250 47.090 1.00 0.00 ATOM 1120 H15X POP 9 32.760 45.840 47.210 1.00 0.00 ATOM 1121 H15Y POP 9 34.040 45.780 46.110 1.00 0.00 ATOM 1122 6C31 POP 9 33.770 47.770 47.010 1.00 0.00 ATOM 1123 H16X POP 9 34.700 48.220 47.410 1.00 0.00 ATOM 1124 H16Y POP 9 33.050 48.070 47.810 1.00 0.00 ATOM 1125 H16Z POP 9 33.370 48.130 46.030 1.00 0.00 ATOM 1126 N POP 10 34.320 31.660 68.450 1.00 0.00 ATOM 1127 HN1 POP 10 34.110 31.650 69.470 1.00 0.00 ATOM 1128 HN2 POP 10 34.430 32.620 68.070 1.00 0.00 ATOM 1129 HN3 POP 10 33.430 31.210 68.170 1.00 0.00 ATOM 1130 C12 POP 10 35.510 30.730 68.370 1.00 0.00 ATOM 1131 H12A POP 10 35.290 29.930 69.100 1.00 0.00 ATOM 1132 H12B POP 10 36.330 31.330 68.830 1.00 0.00 ATOM 1133 C11 POP 10 35.690 30.150 66.960 1.00 0.00 ATOM 1134 H11A POP 10 36.480 29.370 66.950 1.00 0.00 ATOM 1135 H11B POP 10 35.940 31.020 66.320 1.00 0.00 ATOM 1136 P POP 10 34.350 28.580 65.460 1.00 0.00 ATOM 1137 O13 POP 10 33.290 28.880 64.470 1.00 0.00 ATOM 1138 O14 POP 10 34.230 27.350 66.280 1.00 0.00 ATOM 1139 O11 POP 10 35.740 28.520 64.660 1.00 0.00 ATOM 1140 O12 POP 10 34.380 29.780 66.520 1.00 0.00 ATOM 1141 C1 POP 10 36.090 29.530 63.710 1.00 0.00 ATOM 1142 HA POP 10 37.180 29.730 63.770 1.00 0.00 ATOM 1143 HB POP 10 35.580 30.510 63.880 1.00 0.00 ATOM 1144 C2 POP 10 35.810 28.880 62.350 1.00 0.00 ATOM 1145 HS POP 10 34.700 28.930 62.220 1.00 0.00 ATOM 1146 O21 POP 10 35.980 27.470 62.190 1.00 0.00 ATOM 1147 C21 POP 10 37.210 26.970 62.380 1.00 0.00 ATOM 1148 O22 POP 10 38.170 27.590 62.800 1.00 0.00 ATOM 1149 C22 POP 10 37.250 25.530 61.890 1.00 0.00 ATOM 1150 H2R POP 10 36.290 25.030 61.650 1.00 0.00 ATOM 1151 H2S POP 10 37.720 24.900 62.680 1.00 0.00 ATOM 1152 C3 POP 10 36.530 29.570 61.180 1.00 0.00 ATOM 1153 HX POP 10 37.580 29.770 61.460 1.00 0.00 ATOM 1154 HY POP 10 35.930 30.490 60.990 1.00 0.00 ATOM 1155 O31 POP 10 36.450 28.800 59.970 1.00 0.00 ATOM 1156 C31 POP 10 37.170 29.340 58.990 1.00 0.00 ATOM 1157 O32 POP 10 37.860 30.330 59.180 1.00 0.00 ATOM 1158 C32 POP 10 36.830 28.630 57.690 1.00 0.00 ATOM 1159 H2X POP 10 36.030 29.120 57.100 1.00 0.00 ATOM 1160 H2Y POP 10 36.510 27.590 57.900 1.00 0.00 ATOM 1161 C23 POP 10 38.240 25.610 60.730 1.00 0.00 ATOM 1162 H3R POP 10 39.290 25.540 61.100 1.00 0.00 ATOM 1163 H3S POP 10 38.260 26.520 60.090 1.00 0.00 ATOM 1164 C24 POP 10 38.130 24.420 59.780 1.00 0.00 ATOM 1165 H4R POP 10 37.040 24.270 59.610 1.00 0.00 ATOM 1166 H4S POP 10 38.570 23.480 60.170 1.00 0.00 ATOM 1167 C25 POP 10 38.920 24.590 58.480 1.00 0.00 ATOM 1168 H5R POP 10 39.950 24.920 58.760 1.00 0.00 ATOM 1169 H5S POP 10 38.370 25.330 57.860 1.00 0.00 ATOM 1170 C26 POP 10 39.070 23.270 57.720 1.00 0.00 ATOM 1171 H6R POP 10 38.110 22.800 57.440 1.00 0.00 ATOM 1172 H6S POP 10 39.600 22.490 58.300 1.00 0.00 ATOM 1173 C27 POP 10 39.890 23.500 56.450 1.00 0.00 ATOM 1174 H7R POP 10 40.810 24.030 56.770 1.00 0.00 ATOM 1175 H7S POP 10 39.230 24.010 55.720 1.00 0.00 ATOM 1176 C28 POP 10 40.300 22.190 55.770 1.00 0.00 ATOM 1177 H8R POP 10 40.140 22.220 54.670 1.00 0.00 ATOM 1178 H8S POP 10 39.580 21.430 56.140 1.00 0.00 ATOM 1179 C29 POP 10 41.640 21.670 56.230 1.00 0.00 ATOM 1180 H91 POP 10 41.900 21.960 57.260 1.00 0.00 ATOM 1181 0C21 POP 10 42.540 21.040 55.470 1.00 0.00 ATOM 1182 1H10 POP 10 43.460 20.600 55.890 1.00 0.00 ATOM 1183 1C21 POP 10 42.300 20.750 54.020 1.00 0.00 ATOM 1184 H11R POP 10 41.550 21.420 53.550 1.00 0.00 ATOM 1185 H11S POP 10 41.960 19.700 53.890 1.00 0.00 ATOM 1186 2C21 POP 10 43.630 20.750 53.270 1.00 0.00 ATOM 1187 H12R POP 10 43.400 20.210 52.320 1.00 0.00 ATOM 1188 H12S POP 10 44.370 20.120 53.810 1.00 0.00 ATOM 1189 3C21 POP 10 44.100 22.180 53.010 1.00 0.00 ATOM 1190 H13R POP 10 44.420 22.630 53.980 1.00 0.00 ATOM 1191 H13S POP 10 43.190 22.720 52.680 1.00 0.00 ATOM 1192 4C21 POP 10 45.260 22.300 52.020 1.00 0.00 ATOM 1193 H14R POP 10 46.080 21.580 52.270 1.00 0.00 ATOM 1194 H14S POP 10 45.640 23.320 52.250 1.00 0.00 ATOM 1195 5C21 POP 10 44.830 22.340 50.560 1.00 0.00 ATOM 1196 H15R POP 10 44.260 21.430 50.260 1.00 0.00 ATOM 1197 H15S POP 10 44.150 23.220 50.520 1.00 0.00 ATOM 1198 6C21 POP 10 46.030 22.640 49.660 1.00 0.00 ATOM 1199 H16R POP 10 46.570 21.700 49.410 1.00 0.00 ATOM 1200 H16S POP 10 46.750 23.310 50.180 1.00 0.00 ATOM 1201 7C21 POP 10 45.610 23.360 48.380 1.00 0.00 ATOM 1202 H17R POP 10 45.030 24.270 48.640 1.00 0.00 ATOM 1203 H17S POP 10 45.010 22.650 47.770 1.00 0.00 ATOM 1204 8C21 POP 10 46.790 23.760 47.500 1.00 0.00 ATOM 1205 H18R POP 10 47.440 24.330 48.200 1.00 0.00 ATOM 1206 H18S POP 10 46.530 24.410 46.640 1.00 0.00 ATOM 1207 H18T POP 10 47.300 22.860 47.090 1.00 0.00 ATOM 1208 C33 POP 10 38.060 28.570 56.770 1.00 0.00 ATOM 1209 H3X POP 10 38.840 28.070 57.370 1.00 0.00 ATOM 1210 H3Y POP 10 38.240 29.640 56.500 1.00 0.00 ATOM 1211 C34 POP 10 37.730 27.660 55.590 1.00 0.00 ATOM 1212 H4X POP 10 37.010 28.210 54.940 1.00 0.00 ATOM 1213 H4Y POP 10 37.150 26.810 56.020 1.00 0.00 ATOM 1214 C35 POP 10 39.020 27.260 54.880 1.00 0.00 ATOM 1215 H5X POP 10 39.700 26.830 55.650 1.00 0.00 ATOM 1216 H5Y POP 10 39.460 28.190 54.460 1.00 0.00 ATOM 1217 C36 POP 10 38.870 26.320 53.680 1.00 0.00 ATOM 1218 H6X POP 10 38.410 26.830 52.810 1.00 0.00 ATOM 1219 H6Y POP 10 38.220 25.450 53.910 1.00 0.00 ATOM 1220 C37 POP 10 40.220 25.660 53.410 1.00 0.00 ATOM 1221 H7X POP 10 40.390 25.000 54.280 1.00 0.00 ATOM 1222 H7Y POP 10 41.010 26.430 53.320 1.00 0.00 ATOM 1223 C38 POP 10 40.370 24.760 52.180 1.00 0.00 ATOM 1224 H8X POP 10 41.320 24.200 52.320 1.00 0.00 ATOM 1225 H8Y POP 10 40.540 25.420 51.300 1.00 0.00 ATOM 1226 C39 POP 10 39.200 23.810 51.960 1.00 0.00 ATOM 1227 H9X POP 10 38.260 24.250 51.570 1.00 0.00 ATOM 1228 H9Y POP 10 38.880 23.450 52.960 1.00 0.00 ATOM 1229 0C31 POP 10 39.610 22.640 51.070 1.00 0.00 ATOM 1230 H10X POP 10 40.610 22.190 51.230 1.00 0.00 ATOM 1231 H10Y POP 10 39.720 23.080 50.050 1.00 0.00 ATOM 1232 1C31 POP 10 38.620 21.480 51.060 1.00 0.00 ATOM 1233 H11X POP 10 38.940 20.760 50.270 1.00 0.00 ATOM 1234 H11Y POP 10 37.600 21.870 50.840 1.00 0.00 ATOM 1235 2C31 POP 10 38.590 20.740 52.400 1.00 0.00 ATOM 1236 H12X POP 10 38.210 21.470 53.140 1.00 0.00 ATOM 1237 H12Y POP 10 39.660 20.510 52.630 1.00 0.00 ATOM 1238 3C31 POP 10 37.530 19.640 52.450 1.00 0.00 ATOM 1239 H13X POP 10 37.940 18.950 51.680 1.00 0.00 ATOM 1240 H13Y POP 10 36.620 20.160 52.090 1.00 0.00 ATOM 1241 4C31 POP 10 37.210 19.060 53.820 1.00 0.00 ATOM 1242 H14X POP 10 36.710 19.870 54.390 1.00 0.00 ATOM 1243 H14Y POP 10 38.110 18.630 54.320 1.00 0.00 ATOM 1244 5C31 POP 10 36.210 17.900 53.750 1.00 0.00 ATOM 1245 H15X POP 10 35.580 17.980 52.840 1.00 0.00 ATOM 1246 H15Y POP 10 35.640 18.150 54.660 1.00 0.00 ATOM 1247 6C31 POP 10 36.850 16.510 53.730 1.00 0.00 ATOM 1248 H16X POP 10 36.070 15.720 53.660 1.00 0.00 ATOM 1249 H16Y POP 10 37.390 16.270 54.670 1.00 0.00 ATOM 1250 H16Z POP 10 37.490 16.480 52.830 1.00 0.00 ATOM 1251 N POP 11 1.480 55.880 65.360 1.00 0.00 ATOM 1252 HN1 POP 11 0.910 55.070 65.690 1.00 0.00 ATOM 1253 HN2 POP 11 1.020 56.100 64.450 1.00 0.00 ATOM 1254 HN3 POP 11 2.500 55.690 65.290 1.00 0.00 ATOM 1255 C12 POP 11 1.190 56.950 66.380 1.00 0.00 ATOM 1256 H12A POP 11 1.910 56.700 67.190 1.00 0.00 ATOM 1257 H12B POP 11 0.150 56.800 66.740 1.00 0.00 ATOM 1258 C11 POP 11 1.470 58.350 65.810 1.00 0.00 ATOM 1259 H11A POP 11 1.470 59.140 66.590 1.00 0.00 ATOM 1260 H11B POP 11 0.760 58.660 65.020 1.00 0.00 ATOM 1261 P POP 11 3.380 59.770 64.750 1.00 0.00 ATOM 1262 O13 POP 11 4.670 59.610 64.040 1.00 0.00 ATOM 1263 O14 POP 11 3.400 60.820 65.800 1.00 0.00 ATOM 1264 O11 POP 11 2.250 60.210 63.700 1.00 0.00 ATOM 1265 O12 POP 11 2.790 58.380 65.270 1.00 0.00 ATOM 1266 C1 POP 11 2.150 59.640 62.400 1.00 0.00 ATOM 1267 HA POP 11 1.110 59.730 62.030 1.00 0.00 ATOM 1268 HB POP 11 2.350 58.540 62.390 1.00 0.00 ATOM 1269 C2 POP 11 3.160 60.300 61.440 1.00 0.00 ATOM 1270 HS POP 11 3.760 60.960 62.100 1.00 0.00 ATOM 1271 O21 POP 11 2.370 61.010 60.490 1.00 0.00 ATOM 1272 C21 POP 11 3.090 61.840 59.740 1.00 0.00 ATOM 1273 O22 POP 11 4.260 62.060 59.970 1.00 0.00 ATOM 1274 C22 POP 11 2.250 62.470 58.630 1.00 0.00 ATOM 1275 H2R POP 11 1.650 63.300 59.050 1.00 0.00 ATOM 1276 H2S POP 11 1.620 61.680 58.170 1.00 0.00 ATOM 1277 C3 POP 11 4.130 59.240 60.870 1.00 0.00 ATOM 1278 HX POP 11 4.510 58.630 61.720 1.00 0.00 ATOM 1279 HY POP 11 5.030 59.750 60.480 1.00 0.00 ATOM 1280 O31 POP 11 3.470 58.320 59.990 1.00 0.00 ATOM 1281 C31 POP 11 3.890 58.210 58.730 1.00 0.00 ATOM 1282 O32 POP 11 4.990 58.540 58.340 1.00 0.00 ATOM 1283 C32 POP 11 2.850 57.400 57.960 1.00 0.00 ATOM 1284 H2X POP 11 1.810 57.730 58.160 1.00 0.00 ATOM 1285 H2Y POP 11 2.930 56.320 58.190 1.00 0.00 ATOM 1286 C23 POP 11 3.170 63.010 57.530 1.00 0.00 ATOM 1287 H3R POP 11 2.710 62.800 56.540 1.00 0.00 ATOM 1288 H3S POP 11 4.120 62.430 57.520 1.00 0.00 ATOM 1289 C24 POP 11 3.560 64.490 57.640 1.00 0.00 ATOM 1290 H4R POP 11 3.810 64.680 58.700 1.00 0.00 ATOM 1291 H4S POP 11 2.680 65.140 57.460 1.00 0.00 ATOM 1292 C25 POP 11 4.740 64.900 56.750 1.00 0.00 ATOM 1293 H5R POP 11 5.480 64.080 56.820 1.00 0.00 ATOM 1294 H5S POP 11 5.210 65.850 57.100 1.00 0.00 ATOM 1295 C26 POP 11 4.420 64.950 55.260 1.00 0.00 ATOM 1296 H6R POP 11 3.520 65.590 55.150 1.00 0.00 ATOM 1297 H6S POP 11 4.320 63.890 54.940 1.00 0.00 ATOM 1298 C27 POP 11 5.540 65.660 54.500 1.00 0.00 ATOM 1299 H7R POP 11 6.470 65.430 55.060 1.00 0.00 ATOM 1300 H7S POP 11 5.270 66.740 54.580 1.00 0.00 ATOM 1301 C28 POP 11 5.600 65.240 53.030 1.00 0.00 ATOM 1302 H8R POP 11 4.610 64.820 52.750 1.00 0.00 ATOM 1303 H8S POP 11 6.410 64.500 52.860 1.00 0.00 ATOM 1304 C29 POP 11 5.880 66.430 52.160 1.00 0.00 ATOM 1305 H91 POP 11 5.120 67.210 52.250 1.00 0.00 ATOM 1306 0C21 POP 11 6.710 66.540 51.110 1.00 0.00 ATOM 1307 1H10 POP 11 6.960 67.480 50.600 1.00 0.00 ATOM 1308 1C21 POP 11 7.610 65.410 50.700 1.00 0.00 ATOM 1309 H11R POP 11 6.980 64.500 50.630 1.00 0.00 ATOM 1310 H11S POP 11 8.420 65.130 51.410 1.00 0.00 ATOM 1311 2C21 POP 11 8.180 65.700 49.310 1.00 0.00 ATOM 1312 H12R POP 11 8.440 66.780 49.280 1.00 0.00 ATOM 1313 H12S POP 11 7.410 65.640 48.510 1.00 0.00 ATOM 1314 3C21 POP 11 9.450 64.930 48.930 1.00 0.00 ATOM 1315 H13R POP 11 9.360 63.830 49.080 1.00 0.00 ATOM 1316 H13S POP 11 10.290 65.250 49.570 1.00 0.00 ATOM 1317 4C21 POP 11 9.830 65.130 47.460 1.00 0.00 ATOM 1318 H14R POP 11 10.340 66.100 47.280 1.00 0.00 ATOM 1319 H14S POP 11 8.930 65.180 46.810 1.00 0.00 ATOM 1320 5C21 POP 11 10.600 63.910 46.960 1.00 0.00 ATOM 1321 H15R POP 11 9.900 63.070 47.130 1.00 0.00 ATOM 1322 H15S POP 11 11.580 63.760 47.450 1.00 0.00 ATOM 1323 6C21 POP 11 10.750 64.020 45.440 1.00 0.00 ATOM 1324 H16R POP 11 11.350 64.940 45.290 1.00 0.00 ATOM 1325 H16S POP 11 9.770 64.200 44.950 1.00 0.00 ATOM 1326 7C21 POP 11 11.430 62.820 44.790 1.00 0.00 ATOM 1327 H17R POP 11 11.690 63.120 43.750 1.00 0.00 ATOM 1328 H17S POP 11 10.880 61.850 44.770 1.00 0.00 ATOM 1329 8C21 POP 11 12.760 62.670 45.530 1.00 0.00 ATOM 1330 H18R POP 11 13.390 61.840 45.140 1.00 0.00 ATOM 1331 H18S POP 11 12.620 62.410 46.600 1.00 0.00 ATOM 1332 H18T POP 11 13.420 63.560 45.560 1.00 0.00 ATOM 1333 C33 POP 11 3.100 57.630 56.460 1.00 0.00 ATOM 1334 H3X POP 11 4.180 57.590 56.200 1.00 0.00 ATOM 1335 H3Y POP 11 2.810 58.650 56.140 1.00 0.00 ATOM 1336 C34 POP 11 2.250 56.570 55.770 1.00 0.00 ATOM 1337 H4X POP 11 1.300 56.720 56.330 1.00 0.00 ATOM 1338 H4Y POP 11 2.690 55.590 56.090 1.00 0.00 ATOM 1339 C35 POP 11 2.050 56.740 54.270 1.00 0.00 ATOM 1340 H5X POP 11 1.710 57.770 54.040 1.00 0.00 ATOM 1341 H5Y POP 11 1.300 56.000 53.910 1.00 0.00 ATOM 1342 C36 POP 11 3.420 56.440 53.650 1.00 0.00 ATOM 1343 H6X POP 11 3.740 55.420 53.960 1.00 0.00 ATOM 1344 H6Y POP 11 4.240 57.080 54.030 1.00 0.00 ATOM 1345 C37 POP 11 3.390 56.610 52.130 1.00 0.00 ATOM 1346 H7X POP 11 2.990 57.640 51.990 1.00 0.00 ATOM 1347 H7Y POP 11 2.780 55.840 51.610 1.00 0.00 ATOM 1348 C38 POP 11 4.780 56.640 51.500 1.00 0.00 ATOM 1349 H8X POP 11 5.500 57.080 52.230 1.00 0.00 ATOM 1350 H8Y POP 11 4.740 57.200 50.540 1.00 0.00 ATOM 1351 C39 POP 11 5.300 55.250 51.140 1.00 0.00 ATOM 1352 H9X POP 11 4.580 54.610 50.600 1.00 0.00 ATOM 1353 H9Y POP 11 5.250 54.600 52.040 1.00 0.00 ATOM 1354 0C31 POP 11 6.730 55.250 50.580 1.00 0.00 ATOM 1355 H10X POP 11 7.120 54.240 50.800 1.00 0.00 ATOM 1356 H10Y POP 11 7.420 56.010 50.990 1.00 0.00 ATOM 1357 1C31 POP 11 6.830 55.390 49.060 1.00 0.00 ATOM 1358 H11X POP 11 7.900 55.300 48.740 1.00 0.00 ATOM 1359 H11Y POP 11 6.430 56.350 48.670 1.00 0.00 ATOM 1360 2C31 POP 11 6.190 54.200 48.340 1.00 0.00 ATOM 1361 H12X POP 11 5.130 54.010 48.590 1.00 0.00 ATOM 1362 H12Y POP 11 6.780 53.290 48.550 1.00 0.00 ATOM 1363 3C31 POP 11 6.170 54.510 46.840 1.00 0.00 ATOM 1364 H13X POP 11 7.220 54.660 46.480 1.00 0.00 ATOM 1365 H13Y POP 11 5.630 55.450 46.600 1.00 0.00 ATOM 1366 4C31 POP 11 5.600 53.420 45.930 1.00 0.00 ATOM 1367 H14X POP 11 6.110 52.460 46.180 1.00 0.00 ATOM 1368 H14Y POP 11 5.920 53.590 44.880 1.00 0.00 ATOM 1369 5C31 POP 11 4.080 53.260 45.970 1.00 0.00 ATOM 1370 H15X POP 11 3.440 54.130 45.710 1.00 0.00 ATOM 1371 H15Y POP 11 4.020 52.930 47.030 1.00 0.00 ATOM 1372 6C31 POP 11 3.580 52.140 45.070 1.00 0.00 ATOM 1373 H16X POP 11 2.520 52.010 45.350 1.00 0.00 ATOM 1374 H16Y POP 11 4.070 51.160 45.250 1.00 0.00 ATOM 1375 H16Z POP 11 3.790 52.390 44.000 1.00 0.00 ATOM 1376 N POP 12 48.180 31.070 66.790 1.00 0.00 ATOM 1377 HN1 POP 12 47.490 31.790 67.060 1.00 0.00 ATOM 1378 HN2 POP 12 47.760 30.170 67.100 1.00 0.00 ATOM 1379 HN3 POP 12 49.010 31.400 67.320 1.00 0.00 ATOM 1380 C12 POP 12 48.430 31.120 65.300 1.00 0.00 ATOM 1381 H12A POP 12 49.190 30.350 65.060 1.00 0.00 ATOM 1382 H12B POP 12 48.670 32.170 65.040 1.00 0.00 ATOM 1383 C11 POP 12 47.110 30.780 64.610 1.00 0.00 ATOM 1384 H11A POP 12 47.330 30.810 63.520 1.00 0.00 ATOM 1385 H11B POP 12 46.360 31.570 64.820 1.00 0.00 ATOM 1386 P POP 12 45.090 29.260 64.850 1.00 0.00 ATOM 1387 O13 POP 12 44.310 29.840 65.960 1.00 0.00 ATOM 1388 O14 POP 12 44.790 27.810 64.710 1.00 0.00 ATOM 1389 O11 POP 12 44.770 29.990 63.460 1.00 0.00 ATOM 1390 O12 POP 12 46.660 29.500 65.060 1.00 0.00 ATOM 1391 C1 POP 12 43.460 30.510 63.210 1.00 0.00 ATOM 1392 HA POP 12 43.510 31.440 62.610 1.00 0.00 ATOM 1393 HB POP 12 43.020 30.620 64.220 1.00 0.00 ATOM 1394 C2 POP 12 42.520 29.490 62.530 1.00 0.00 ATOM 1395 HS POP 12 42.320 28.700 63.280 1.00 0.00 ATOM 1396 O21 POP 12 43.190 28.880 61.420 1.00 0.00 ATOM 1397 C21 POP 12 42.560 27.720 61.230 1.00 0.00 ATOM 1398 O22 POP 12 41.680 27.230 61.920 1.00 0.00 ATOM 1399 C22 POP 12 43.030 27.160 59.890 1.00 0.00 ATOM 1400 H2R POP 12 42.560 26.170 59.690 1.00 0.00 ATOM 1401 H2S POP 12 44.130 26.990 59.970 1.00 0.00 ATOM 1402 C3 POP 12 41.200 30.060 61.970 1.00 0.00 ATOM 1403 HX POP 12 40.740 30.510 62.870 1.00 0.00 ATOM 1404 HY POP 12 40.590 29.230 61.560 1.00 0.00 ATOM 1405 O31 POP 12 41.580 30.970 60.940 1.00 0.00 ATOM 1406 C31 POP 12 41.480 32.260 61.270 1.00 0.00 ATOM 1407 O32 POP 12 41.330 32.710 62.390 1.00 0.00 ATOM 1408 C32 POP 12 41.860 33.070 60.030 1.00 0.00 ATOM 1409 H2X POP 12 42.950 33.160 59.860 1.00 0.00 ATOM 1410 H2Y POP 12 41.450 34.090 60.180 1.00 0.00 ATOM 1411 C23 POP 12 42.560 27.900 58.640 1.00 0.00 ATOM 1412 H3R POP 12 42.960 28.920 58.480 1.00 0.00 ATOM 1413 H3S POP 12 41.450 27.980 58.700 1.00 0.00 ATOM 1414 C24 POP 12 43.020 27.200 57.360 1.00 0.00 ATOM 1415 H4R POP 12 42.850 26.110 57.330 1.00 0.00 ATOM 1416 H4S POP 12 44.130 27.260 57.280 1.00 0.00 ATOM 1417 C25 POP 12 42.340 27.750 56.100 1.00 0.00 ATOM 1418 H5R POP 12 41.310 28.090 56.310 1.00 0.00 ATOM 1419 H5S POP 12 42.380 27.010 55.280 1.00 0.00 ATOM 1420 C26 POP 12 43.050 28.990 55.530 1.00 0.00 ATOM 1421 H6R POP 12 44.150 28.870 55.600 1.00 0.00 ATOM 1422 H6S POP 12 42.740 29.760 56.270 1.00 0.00 ATOM 1423 C27 POP 12 42.640 29.320 54.090 1.00 0.00 ATOM 1424 H7R POP 12 41.550 29.510 54.020 1.00 0.00 ATOM 1425 H7S POP 12 42.720 28.440 53.420 1.00 0.00 ATOM 1426 C28 POP 12 43.390 30.500 53.490 1.00 0.00 ATOM 1427 H8R POP 12 43.370 31.390 54.160 1.00 0.00 ATOM 1428 H8S POP 12 42.890 30.720 52.520 1.00 0.00 ATOM 1429 C29 POP 12 44.810 30.080 53.250 1.00 0.00 ATOM 1430 H91 POP 12 45.110 29.200 53.840 1.00 0.00 ATOM 1431 0C21 POP 12 45.590 30.580 52.280 1.00 0.00 ATOM 1432 1H10 POP 12 46.600 30.180 52.080 1.00 0.00 ATOM 1433 1C21 POP 12 45.260 31.790 51.450 1.00 0.00 ATOM 1434 H11R POP 12 46.190 32.310 51.130 1.00 0.00 ATOM 1435 H11S POP 12 44.650 32.500 52.050 1.00 0.00 ATOM 1436 2C21 POP 12 44.560 31.490 50.130 1.00 0.00 ATOM 1437 H12R POP 12 43.550 31.090 50.380 1.00 0.00 ATOM 1438 H12S POP 12 45.200 30.770 49.580 1.00 0.00 ATOM 1439 3C21 POP 12 44.460 32.710 49.220 1.00 0.00 ATOM 1440 H13R POP 12 45.440 33.240 49.260 1.00 0.00 ATOM 1441 H13S POP 12 43.640 33.350 49.610 1.00 0.00 ATOM 1442 4C21 POP 12 44.170 32.430 47.740 1.00 0.00 ATOM 1443 H14R POP 12 44.930 31.810 47.240 1.00 0.00 ATOM 1444 H14S POP 12 44.210 33.410 47.230 1.00 0.00 ATOM 1445 5C21 POP 12 42.800 31.820 47.420 1.00 0.00 ATOM 1446 H15R POP 12 42.690 30.760 47.750 1.00 0.00 ATOM 1447 H15S POP 12 42.770 31.720 46.310 1.00 0.00 ATOM 1448 6C21 POP 12 41.610 32.510 48.080 1.00 0.00 ATOM 1449 H16R POP 12 41.730 33.610 48.030 1.00 0.00 ATOM 1450 H16S POP 12 41.520 32.050 49.090 1.00 0.00 ATOM 1451 7C21 POP 12 40.220 32.180 47.520 1.00 0.00 ATOM 1452 H17R POP 12 40.210 31.080 47.380 1.00 0.00 ATOM 1453 H17S POP 12 40.290 32.660 46.520 1.00 0.00 ATOM 1454 8C21 POP 12 38.940 32.580 48.250 1.00 0.00 ATOM 1455 H18R POP 12 38.860 32.010 49.190 1.00 0.00 ATOM 1456 H18S POP 12 37.990 32.390 47.700 1.00 0.00 ATOM 1457 H18T POP 12 38.900 33.680 48.420 1.00 0.00 ATOM 1458 C33 POP 12 41.250 32.500 58.750 1.00 0.00 ATOM 1459 H3X POP 12 40.150 32.420 58.900 1.00 0.00 ATOM 1460 H3Y POP 12 41.630 31.510 58.410 1.00 0.00 ATOM 1461 C34 POP 12 41.460 33.570 57.670 1.00 0.00 ATOM 1462 H4X POP 12 42.560 33.680 57.560 1.00 0.00 ATOM 1463 H4Y POP 12 41.060 34.540 58.030 1.00 0.00 ATOM 1464 C35 POP 12 41.010 33.150 56.270 1.00 0.00 ATOM 1465 H5X POP 12 41.480 32.150 56.210 1.00 0.00 ATOM 1466 H5Y POP 12 41.450 33.870 55.550 1.00 0.00 ATOM 1467 C36 POP 12 39.490 33.010 56.140 1.00 0.00 ATOM 1468 H6X POP 12 38.990 33.830 56.700 1.00 0.00 ATOM 1469 H6Y POP 12 39.200 32.140 56.760 1.00 0.00 ATOM 1470 C37 POP 12 38.940 32.820 54.730 1.00 0.00 ATOM 1471 H7X POP 12 38.880 33.810 54.240 1.00 0.00 ATOM 1472 H7Y POP 12 37.900 32.450 54.890 1.00 0.00 ATOM 1473 C38 POP 12 39.720 31.790 53.910 1.00 0.00 ATOM 1474 H8X POP 12 39.660 30.830 54.470 1.00 0.00 ATOM 1475 H8Y POP 12 40.740 32.220 53.850 1.00 0.00 ATOM 1476 C39 POP 12 39.000 31.570 52.580 1.00 0.00 ATOM 1477 H9X POP 12 39.250 32.290 51.780 1.00 0.00 ATOM 1478 H9Y POP 12 37.890 31.540 52.700 1.00 0.00 ATOM 1479 0C31 POP 12 39.250 30.120 52.150 1.00 0.00 ATOM 1480 H10X POP 12 38.830 29.490 52.960 1.00 0.00 ATOM 1481 H10Y POP 12 40.350 29.970 52.090 1.00 0.00 ATOM 1482 1C31 POP 12 38.650 29.650 50.830 1.00 0.00 ATOM 1483 H11X POP 12 39.250 30.190 50.060 1.00 0.00 ATOM 1484 H11Y POP 12 37.590 29.970 50.750 1.00 0.00 ATOM 1485 2C31 POP 12 38.770 28.140 50.640 1.00 0.00 ATOM 1486 H12X POP 12 37.950 27.750 51.280 1.00 0.00 ATOM 1487 H12Y POP 12 39.760 27.730 50.930 1.00 0.00 ATOM 1488 3C31 POP 12 38.430 27.680 49.220 1.00 0.00 ATOM 1489 H13X POP 12 37.350 27.750 48.940 1.00 0.00 ATOM 1490 H13Y POP 12 38.760 26.630 49.140 1.00 0.00 ATOM 1491 4C31 POP 12 39.170 28.520 48.170 1.00 0.00 ATOM 1492 H14X POP 12 40.260 28.590 48.340 1.00 0.00 ATOM 1493 H14Y POP 12 38.720 29.540 48.170 1.00 0.00 ATOM 1494 5C31 POP 12 39.070 27.790 46.830 1.00 0.00 ATOM 1495 H15X POP 12 39.220 28.500 45.990 1.00 0.00 ATOM 1496 H15Y POP 12 38.010 27.460 46.800 1.00 0.00 ATOM 1497 6C31 POP 12 39.890 26.510 46.700 1.00 0.00 ATOM 1498 H16X POP 12 39.490 25.690 47.330 1.00 0.00 ATOM 1499 H16Y POP 12 40.950 26.790 46.880 1.00 0.00 ATOM 1500 H16Z POP 12 39.810 26.240 45.630 1.00 0.00 ATOM 1501 N POP 13 31.060 35.570 64.600 1.00 0.00 ATOM 1502 HN1 POP 13 31.880 35.410 65.220 1.00 0.00 ATOM 1503 HN2 POP 13 31.080 36.580 64.340 1.00 0.00 ATOM 1504 HN3 POP 13 30.120 35.400 65.020 1.00 0.00 ATOM 1505 C12 POP 13 31.120 34.650 63.410 1.00 0.00 ATOM 1506 H12A POP 13 30.030 34.540 63.180 1.00 0.00 ATOM 1507 H12B POP 13 31.590 33.750 63.850 1.00 0.00 ATOM 1508 C11 POP 13 32.020 35.270 62.330 1.00 0.00 ATOM 1509 H11A POP 13 31.490 35.990 61.680 1.00 0.00 ATOM 1510 H11B POP 13 32.320 34.350 61.770 1.00 0.00 ATOM 1511 P POP 13 34.510 35.610 62.300 1.00 0.00 ATOM 1512 O13 POP 13 34.730 34.150 62.410 1.00 0.00 ATOM 1513 O14 POP 13 35.500 36.460 62.990 1.00 0.00 ATOM 1514 O11 POP 13 34.430 36.010 60.750 1.00 0.00 ATOM 1515 O12 POP 13 33.080 36.050 62.880 1.00 0.00 ATOM 1516 C1 POP 13 34.480 35.000 59.740 1.00 0.00 ATOM 1517 HA POP 13 33.940 35.400 58.850 1.00 0.00 ATOM 1518 HB POP 13 33.980 34.040 60.000 1.00 0.00 ATOM 1519 C2 POP 13 35.920 34.610 59.340 1.00 0.00 ATOM 1520 HS POP 13 36.420 34.250 60.260 1.00 0.00 ATOM 1521 O21 POP 13 36.550 35.850 58.990 1.00 0.00 ATOM 1522 C21 POP 13 37.870 35.780 59.090 1.00 0.00 ATOM 1523 O22 POP 13 38.490 34.800 59.450 1.00 0.00 ATOM 1524 C22 POP 13 38.350 37.170 58.690 1.00 0.00 ATOM 1525 H2R POP 13 38.900 37.590 59.560 1.00 0.00 ATOM 1526 H2S POP 13 37.480 37.850 58.580 1.00 0.00 ATOM 1527 C3 POP 13 36.060 33.440 58.360 1.00 0.00 ATOM 1528 HX POP 13 35.550 32.670 58.970 1.00 0.00 ATOM 1529 HY POP 13 37.110 33.210 58.080 1.00 0.00 ATOM 1530 O31 POP 13 35.480 33.670 57.070 1.00 0.00 ATOM 1531 C31 POP 13 34.850 32.580 56.630 1.00 0.00 ATOM 1532 O32 POP 13 34.810 31.540 57.280 1.00 0.00 ATOM 1533 C32 POP 13 34.140 32.840 55.310 1.00 0.00 ATOM 1534 H2X POP 13 33.730 33.860 55.420 1.00 0.00 ATOM 1535 H2Y POP 13 33.370 32.050 55.190 1.00 0.00 ATOM 1536 C23 POP 13 39.130 37.090 57.380 1.00 0.00 ATOM 1537 H3R POP 13 39.850 36.250 57.410 1.00 0.00 ATOM 1538 H3S POP 13 39.730 38.020 57.250 1.00 0.00 ATOM 1539 C24 POP 13 38.240 36.840 56.170 1.00 0.00 ATOM 1540 H4R POP 13 37.200 37.180 56.370 1.00 0.00 ATOM 1541 H4S POP 13 38.100 35.740 56.080 1.00 0.00 ATOM 1542 C25 POP 13 38.710 37.410 54.830 1.00 0.00 ATOM 1543 H5R POP 13 39.750 37.260 54.480 1.00 0.00 ATOM 1544 H5S POP 13 38.620 38.520 54.860 1.00 0.00 ATOM 1545 C26 POP 13 37.760 36.980 53.720 1.00 0.00 ATOM 1546 H6R POP 13 36.810 37.540 53.900 1.00 0.00 ATOM 1547 H6S POP 13 37.550 35.890 53.710 1.00 0.00 ATOM 1548 C27 POP 13 38.210 37.330 52.300 1.00 0.00 ATOM 1549 H7R POP 13 39.290 37.210 52.080 1.00 0.00 ATOM 1550 H7S POP 13 38.110 38.440 52.260 1.00 0.00 ATOM 1551 C28 POP 13 37.410 36.670 51.180 1.00 0.00 ATOM 1552 H8R POP 13 36.360 36.450 51.470 1.00 0.00 ATOM 1553 H8S POP 13 37.910 35.680 51.060 1.00 0.00 ATOM 1554 C29 POP 13 37.330 37.380 49.860 1.00 0.00 ATOM 1555 H91 POP 13 36.300 37.750 49.690 1.00 0.00 ATOM 1556 0C21 POP 13 38.280 37.420 48.920 1.00 0.00 ATOM 1557 1H10 POP 13 38.030 38.010 48.020 1.00 0.00 ATOM 1558 1C21 POP 13 39.650 36.830 49.090 1.00 0.00 ATOM 1559 H11R POP 13 39.720 35.790 48.700 1.00 0.00 ATOM 1560 H11S POP 13 39.970 36.750 50.150 1.00 0.00 ATOM 1561 2C21 POP 13 40.710 37.770 48.520 1.00 0.00 ATOM 1562 H12R POP 13 41.700 37.630 49.000 1.00 0.00 ATOM 1563 H12S POP 13 40.620 38.860 48.730 1.00 0.00 ATOM 1564 3C21 POP 13 40.970 37.550 47.030 1.00 0.00 ATOM 1565 H13R POP 13 40.140 38.010 46.460 1.00 0.00 ATOM 1566 H13S POP 13 41.050 36.450 46.840 1.00 0.00 ATOM 1567 4C21 POP 13 42.310 38.190 46.630 1.00 0.00 ATOM 1568 H14R POP 13 43.120 37.510 46.980 1.00 0.00 ATOM 1569 H14S POP 13 42.350 39.100 47.260 1.00 0.00 ATOM 1570 5C21 POP 13 42.410 38.480 45.130 1.00 0.00 ATOM 1571 H15R POP 13 41.690 39.290 44.900 1.00 0.00 ATOM 1572 H15S POP 13 42.190 37.540 44.580 1.00 0.00 ATOM 1573 6C21 POP 13 43.730 39.110 44.670 1.00 0.00 ATOM 1574 H16R POP 13 43.870 40.060 45.230 1.00 0.00 ATOM 1575 H16S POP 13 43.640 39.380 43.600 1.00 0.00 ATOM 1576 7C21 POP 13 44.890 38.120 44.810 1.00 0.00 ATOM 1577 H17R POP 13 44.510 37.120 44.520 1.00 0.00 ATOM 1578 H17S POP 13 45.180 37.910 45.860 1.00 0.00 ATOM 1579 8C21 POP 13 46.100 38.500 43.960 1.00 0.00 ATOM 1580 H18R POP 13 46.790 37.640 44.160 1.00 0.00 ATOM 1581 H18S POP 13 46.540 39.450 44.340 1.00 0.00 ATOM 1582 H18T POP 13 45.670 38.560 42.940 1.00 0.00 ATOM 1583 C33 POP 13 35.150 32.800 54.160 1.00 0.00 ATOM 1584 H3X POP 13 35.710 31.850 54.060 1.00 0.00 ATOM 1585 H3Y POP 13 35.950 33.550 54.370 1.00 0.00 ATOM 1586 C34 POP 13 34.510 33.040 52.790 1.00 0.00 ATOM 1587 H4X POP 13 33.830 33.920 52.830 1.00 0.00 ATOM 1588 H4Y POP 13 33.890 32.140 52.600 1.00 0.00 ATOM 1589 C35 POP 13 35.530 33.250 51.680 1.00 0.00 ATOM 1590 H5X POP 13 36.270 32.460 51.430 1.00 0.00 ATOM 1591 H5Y POP 13 36.000 34.210 51.990 1.00 0.00 ATOM 1592 C36 POP 13 34.640 33.470 50.450 1.00 0.00 ATOM 1593 H6X POP 13 33.940 34.310 50.630 1.00 0.00 ATOM 1594 H6Y POP 13 33.920 32.630 50.470 1.00 0.00 ATOM 1595 C37 POP 13 35.400 33.580 49.130 1.00 0.00 ATOM 1596 H7X POP 13 36.280 32.900 49.060 1.00 0.00 ATOM 1597 H7Y POP 13 35.890 34.570 49.030 1.00 0.00 ATOM 1598 C38 POP 13 34.560 33.430 47.850 1.00 0.00 ATOM 1599 H8X POP 13 33.720 34.150 47.750 1.00 0.00 ATOM 1600 H8Y POP 13 33.970 32.520 48.060 1.00 0.00 ATOM 1601 C39 POP 13 35.390 33.110 46.610 1.00 0.00 ATOM 1602 H9X POP 13 34.650 32.890 45.810 1.00 0.00 ATOM 1603 H9Y POP 13 36.000 32.200 46.780 1.00 0.00 ATOM 1604 0C31 POP 13 36.380 34.200 46.190 1.00 0.00 ATOM 1605 H10X POP 13 37.070 34.390 47.040 1.00 0.00 ATOM 1606 H10Y POP 13 35.880 35.180 46.060 1.00 0.00 ATOM 1607 1C31 POP 13 37.180 33.830 44.940 1.00 0.00 ATOM 1608 H11X POP 13 36.460 33.450 44.190 1.00 0.00 ATOM 1609 H11Y POP 13 37.910 33.010 45.070 1.00 0.00 ATOM 1610 2C31 POP 13 37.930 35.040 44.370 1.00 0.00 ATOM 1611 H12X POP 13 38.700 35.420 45.080 1.00 0.00 ATOM 1612 H12Y POP 13 37.300 35.900 44.070 1.00 0.00 ATOM 1613 3C31 POP 13 38.640 34.580 43.090 1.00 0.00 ATOM 1614 H13X POP 13 39.190 33.640 43.300 1.00 0.00 ATOM 1615 H13Y POP 13 39.400 35.350 42.820 1.00 0.00 ATOM 1616 4C31 POP 13 37.790 34.460 41.830 1.00 0.00 ATOM 1617 H14X POP 13 37.120 35.340 41.750 1.00 0.00 ATOM 1618 H14Y POP 13 37.260 33.490 41.800 1.00 0.00 ATOM 1619 5C31 POP 13 38.530 34.410 40.490 1.00 0.00 ATOM 1620 H15X POP 13 39.120 35.330 40.300 1.00 0.00 ATOM 1621 H15Y POP 13 37.880 34.210 39.610 1.00 0.00 ATOM 1622 6C31 POP 13 39.570 33.290 40.450 1.00 0.00 ATOM 1623 H16X POP 13 39.130 32.280 40.610 1.00 0.00 ATOM 1624 H16Y POP 13 40.360 33.520 41.200 1.00 0.00 ATOM 1625 H16Z POP 13 39.970 33.280 39.420 1.00 0.00 ATOM 1626 N POP 14 34.820 18.840 61.690 1.00 0.00 ATOM 1627 HN1 POP 14 35.470 18.200 61.190 1.00 0.00 ATOM 1628 HN2 POP 14 33.850 18.470 61.640 1.00 0.00 ATOM 1629 HN3 POP 14 34.750 19.830 61.370 1.00 0.00 ATOM 1630 C12 POP 14 35.180 18.760 63.160 1.00 0.00 ATOM 1631 H12A POP 14 35.000 17.740 63.530 1.00 0.00 ATOM 1632 H12B POP 14 34.590 19.580 63.630 1.00 0.00 ATOM 1633 C11 POP 14 36.640 19.080 63.500 1.00 0.00 ATOM 1634 H11A POP 14 36.900 18.740 64.520 1.00 0.00 ATOM 1635 H11B POP 14 36.690 20.190 63.530 1.00 0.00 ATOM 1636 P POP 14 38.580 17.440 63.110 1.00 0.00 ATOM 1637 O13 POP 14 37.860 16.190 63.430 1.00 0.00 ATOM 1638 O14 POP 14 39.450 17.980 64.180 1.00 0.00 ATOM 1639 O11 POP 14 39.370 17.170 61.750 1.00 0.00 ATOM 1640 O12 POP 14 37.570 18.550 62.550 1.00 0.00 ATOM 1641 C1 POP 14 40.500 18.010 61.480 1.00 0.00 ATOM 1642 HA POP 14 41.200 17.410 60.850 1.00 0.00 ATOM 1643 HB POP 14 41.080 18.280 62.380 1.00 0.00 ATOM 1644 C2 POP 14 40.160 19.360 60.820 1.00 0.00 ATOM 1645 HS POP 14 39.860 20.050 61.630 1.00 0.00 ATOM 1646 O21 POP 14 39.170 19.100 59.820 1.00 0.00 ATOM 1647 C21 POP 14 38.180 20.000 59.840 1.00 0.00 ATOM 1648 O22 POP 14 38.080 20.960 60.590 1.00 0.00 ATOM 1649 C22 POP 14 37.310 19.690 58.640 1.00 0.00 ATOM 1650 H2R POP 14 37.200 18.580 58.530 1.00 0.00 ATOM 1651 H2S POP 14 37.830 20.020 57.710 1.00 0.00 ATOM 1652 C3 POP 14 41.310 20.090 60.110 1.00 0.00 ATOM 1653 HX POP 14 42.040 20.360 60.910 1.00 0.00 ATOM 1654 HY POP 14 40.950 21.100 59.810 1.00 0.00 ATOM 1655 O31 POP 14 41.950 19.380 59.050 1.00 0.00 ATOM 1656 C31 POP 14 43.130 18.850 59.380 1.00 0.00 ATOM 1657 O32 POP 14 43.580 18.860 60.510 1.00 0.00 ATOM 1658 C32 POP 14 43.770 18.120 58.210 1.00 0.00 ATOM 1659 H2X POP 14 43.590 18.620 57.230 1.00 0.00 ATOM 1660 H2Y POP 14 43.380 17.080 58.090 1.00 0.00 ATOM 1661 C23 POP 14 36.180 20.720 58.590 1.00 0.00 ATOM 1662 H3R POP 14 36.590 21.750 58.650 1.00 0.00 ATOM 1663 H3S POP 14 35.570 20.520 59.500 1.00 0.00 ATOM 1664 C24 POP 14 35.180 20.530 57.450 1.00 0.00 ATOM 1665 H4R POP 14 35.610 20.860 56.470 1.00 0.00 ATOM 1666 H4S POP 14 34.410 21.330 57.550 1.00 0.00 ATOM 1667 C25 POP 14 34.650 19.120 57.200 1.00 0.00 ATOM 1668 H5R POP 14 35.500 18.410 57.200 1.00 0.00 ATOM 1669 H5S POP 14 34.090 19.060 56.250 1.00 0.00 ATOM 1670 C26 POP 14 33.830 18.690 58.420 1.00 0.00 ATOM 1671 H6R POP 14 33.130 19.500 58.740 1.00 0.00 ATOM 1672 H6S POP 14 34.530 18.530 59.270 1.00 0.00 ATOM 1673 C27 POP 14 32.950 17.460 58.210 1.00 0.00 ATOM 1674 H7R POP 14 32.110 17.730 57.530 1.00 0.00 ATOM 1675 H7S POP 14 32.460 17.370 59.200 1.00 0.00 ATOM 1676 C28 POP 14 33.650 16.180 57.730 1.00 0.00 ATOM 1677 H8R POP 14 34.360 16.060 58.560 1.00 0.00 ATOM 1678 H8S POP 14 34.220 16.430 56.810 1.00 0.00 ATOM 1679 C29 POP 14 32.710 15.030 57.510 1.00 0.00 ATOM 1680 H91 POP 14 32.410 14.440 58.380 1.00 0.00 ATOM 1681 0C21 POP 14 32.100 14.790 56.330 1.00 0.00 ATOM 1682 1H10 POP 14 31.360 14.000 56.170 1.00 0.00 ATOM 1683 1C21 POP 14 32.320 15.660 55.130 1.00 0.00 ATOM 1684 H11R POP 14 33.330 16.060 54.910 1.00 0.00 ATOM 1685 H11S POP 14 31.590 16.500 55.220 1.00 0.00 ATOM 1686 2C21 POP 14 32.120 14.750 53.920 1.00 0.00 ATOM 1687 H12R POP 14 31.060 14.420 53.960 1.00 0.00 ATOM 1688 H12S POP 14 32.770 13.860 54.040 1.00 0.00 ATOM 1689 3C21 POP 14 32.300 15.390 52.540 1.00 0.00 ATOM 1690 H13R POP 14 32.470 14.520 51.860 1.00 0.00 ATOM 1691 H13S POP 14 33.270 15.930 52.440 1.00 0.00 ATOM 1692 4C21 POP 14 31.170 16.300 52.050 1.00 0.00 ATOM 1693 H14R POP 14 31.340 17.330 52.430 1.00 0.00 ATOM 1694 H14S POP 14 30.180 16.000 52.450 1.00 0.00 ATOM 1695 5C21 POP 14 31.050 16.350 50.530 1.00 0.00 ATOM 1696 H15R POP 14 31.910 15.990 49.930 1.00 0.00 ATOM 1697 H15S POP 14 30.670 17.340 50.190 1.00 0.00 ATOM 1698 6C21 POP 14 29.900 15.400 50.200 1.00 0.00 ATOM 1699 H16R POP 14 28.990 15.800 50.690 1.00 0.00 ATOM 1700 H16S POP 14 30.210 14.390 50.540 1.00 0.00 ATOM 1701 7C21 POP 14 29.730 15.330 48.680 1.00 0.00 ATOM 1702 H17R POP 14 30.670 15.550 48.120 1.00 0.00 ATOM 1703 H17S POP 14 29.040 16.150 48.410 1.00 0.00 ATOM 1704 8C21 POP 14 29.210 14.000 48.140 1.00 0.00 ATOM 1705 H18R POP 14 29.400 13.090 48.750 1.00 0.00 ATOM 1706 H18S POP 14 29.600 13.870 47.100 1.00 0.00 ATOM 1707 H18T POP 14 28.110 13.980 48.020 1.00 0.00 ATOM 1708 C33 POP 14 45.290 17.970 58.290 1.00 0.00 ATOM 1709 H3X POP 14 45.700 17.540 59.230 1.00 0.00 ATOM 1710 H3Y POP 14 45.700 18.990 58.130 1.00 0.00 ATOM 1711 C34 POP 14 45.960 17.150 57.190 1.00 0.00 ATOM 1712 H4X POP 14 45.640 16.090 57.270 1.00 0.00 ATOM 1713 H4Y POP 14 47.050 17.340 57.350 1.00 0.00 ATOM 1714 C35 POP 14 45.690 17.570 55.740 1.00 0.00 ATOM 1715 H5X POP 14 45.980 18.630 55.570 1.00 0.00 ATOM 1716 H5Y POP 14 44.630 17.490 55.430 1.00 0.00 ATOM 1717 C36 POP 14 46.420 16.770 54.660 1.00 0.00 ATOM 1718 H6X POP 14 46.260 15.690 54.840 1.00 0.00 ATOM 1719 H6Y POP 14 47.510 16.940 54.820 1.00 0.00 ATOM 1720 C37 POP 14 46.160 17.050 53.180 1.00 0.00 ATOM 1721 H7X POP 14 45.050 17.020 53.110 1.00 0.00 ATOM 1722 H7Y POP 14 46.490 16.140 52.640 1.00 0.00 ATOM 1723 C38 POP 14 46.700 18.380 52.650 1.00 0.00 ATOM 1724 H8X POP 14 47.810 18.380 52.780 1.00 0.00 ATOM 1725 H8Y POP 14 46.300 19.190 53.280 1.00 0.00 ATOM 1726 C39 POP 14 46.160 18.750 51.260 1.00 0.00 ATOM 1727 H9X POP 14 46.700 19.680 51.010 1.00 0.00 ATOM 1728 H9Y POP 14 45.080 19.020 51.350 1.00 0.00 ATOM 1729 0C31 POP 14 46.430 17.660 50.230 1.00 0.00 ATOM 1730 H10X POP 14 45.800 17.980 49.370 1.00 0.00 ATOM 1731 H10Y POP 14 46.120 16.680 50.650 1.00 0.00 ATOM 1732 1C31 POP 14 47.890 17.630 49.770 1.00 0.00 ATOM 1733 H11X POP 14 47.940 16.710 49.130 1.00 0.00 ATOM 1734 H11Y POP 14 48.610 17.440 50.580 1.00 0.00 ATOM 1735 2C31 POP 14 48.390 18.830 48.970 1.00 0.00 ATOM 1736 H12X POP 14 48.300 19.760 49.570 1.00 0.00 ATOM 1737 H12Y POP 14 47.750 18.960 48.070 1.00 0.00 ATOM 1738 3C31 POP 14 49.810 18.640 48.430 1.00 0.00 ATOM 1739 H13X POP 14 50.190 17.610 48.260 1.00 0.00 ATOM 1740 H13Y POP 14 50.470 18.960 49.270 1.00 0.00 ATOM 1741 4C31 POP 14 50.020 19.370 47.100 1.00 0.00 ATOM 1742 H14X POP 14 49.510 18.770 46.320 1.00 0.00 ATOM 1743 H14Y POP 14 51.130 19.390 47.030 1.00 0.00 ATOM 1744 5C31 POP 14 49.540 20.820 46.970 1.00 0.00 ATOM 1745 H15X POP 14 48.440 20.890 46.850 1.00 0.00 ATOM 1746 H15Y POP 14 49.940 21.200 46.000 1.00 0.00 ATOM 1747 6C31 POP 14 49.870 21.730 48.140 1.00 0.00 ATOM 1748 H16X POP 14 49.570 22.770 47.890 1.00 0.00 ATOM 1749 H16Y POP 14 50.950 21.770 48.400 1.00 0.00 ATOM 1750 H16Z POP 14 49.300 21.520 49.070 1.00 0.00 ATOM 1751 N POP 15 23.480 13.900 68.820 1.00 0.00 ATOM 1752 HN1 POP 15 22.600 14.240 69.250 1.00 0.00 ATOM 1753 HN2 POP 15 23.300 13.960 67.800 1.00 0.00 ATOM 1754 HN3 POP 15 23.590 12.890 69.030 1.00 0.00 ATOM 1755 C12 POP 15 24.740 14.560 69.320 1.00 0.00 ATOM 1756 H12A POP 15 25.510 14.030 68.720 1.00 0.00 ATOM 1757 H12B POP 15 24.820 14.410 70.420 1.00 0.00 ATOM 1758 C11 POP 15 24.690 16.050 68.970 1.00 0.00 ATOM 1759 H11A POP 15 25.410 16.630 69.590 1.00 0.00 ATOM 1760 H11B POP 15 23.740 16.530 69.310 1.00 0.00 ATOM 1761 P POP 15 26.410 16.520 67.220 1.00 0.00 ATOM 1762 O13 POP 15 27.150 15.250 67.040 1.00 0.00 ATOM 1763 O14 POP 15 26.990 17.320 68.320 1.00 0.00 ATOM 1764 O11 POP 15 26.380 17.330 65.840 1.00 0.00 ATOM 1765 O12 POP 15 24.880 16.200 67.560 1.00 0.00 ATOM 1766 C1 POP 15 25.100 17.920 65.640 1.00 0.00 ATOM 1767 HA POP 15 24.660 18.480 66.500 1.00 0.00 ATOM 1768 HB POP 15 24.460 17.110 65.240 1.00 0.00 ATOM 1769 C2 POP 15 25.140 19.070 64.620 1.00 0.00 ATOM 1770 HS POP 15 24.120 19.520 64.610 1.00 0.00 ATOM 1771 O21 POP 15 25.500 18.520 63.350 1.00 0.00 ATOM 1772 C21 POP 15 24.870 19.070 62.320 1.00 0.00 ATOM 1773 O22 POP 15 23.990 19.920 62.370 1.00 0.00 ATOM 1774 C22 POP 15 25.600 18.530 61.100 1.00 0.00 ATOM 1775 H2R POP 15 25.570 17.420 61.040 1.00 0.00 ATOM 1776 H2S POP 15 26.680 18.750 61.180 1.00 0.00 ATOM 1777 C3 POP 15 26.220 20.120 64.950 1.00 0.00 ATOM 1778 HX POP 15 27.270 19.780 64.960 1.00 0.00 ATOM 1779 HY POP 15 25.880 20.330 65.980 1.00 0.00 ATOM 1780 O31 POP 15 25.970 21.360 64.280 1.00 0.00 ATOM 1781 C31 POP 15 26.720 21.520 63.190 1.00 0.00 ATOM 1782 O32 POP 15 27.680 20.850 62.870 1.00 0.00 ATOM 1783 C32 POP 15 26.360 22.820 62.480 1.00 0.00 ATOM 1784 H2X POP 15 26.230 23.640 63.210 1.00 0.00 ATOM 1785 H2Y POP 15 25.370 22.550 62.050 1.00 0.00 ATOM 1786 C23 POP 15 25.000 19.290 59.920 1.00 0.00 ATOM 1787 H3R POP 15 24.890 20.380 60.120 1.00 0.00 ATOM 1788 H3S POP 15 23.980 18.920 59.680 1.00 0.00 ATOM 1789 C24 POP 15 25.820 19.020 58.660 1.00 0.00 ATOM 1790 H4R POP 15 25.870 17.920 58.550 1.00 0.00 ATOM 1791 H4S POP 15 26.850 19.350 58.930 1.00 0.00 ATOM 1792 C25 POP 15 25.210 19.640 57.390 1.00 0.00 ATOM 1793 H5R POP 15 24.170 19.280 57.260 1.00 0.00 ATOM 1794 H5S POP 15 25.760 19.390 56.460 1.00 0.00 ATOM 1795 C26 POP 15 25.410 21.160 57.340 1.00 0.00 ATOM 1796 H6R POP 15 26.480 21.430 57.340 1.00 0.00 ATOM 1797 H6S POP 15 24.870 21.580 58.220 1.00 0.00 ATOM 1798 C27 POP 15 24.700 21.790 56.140 1.00 0.00 ATOM 1799 H7R POP 15 23.600 21.670 56.240 1.00 0.00 ATOM 1800 H7S POP 15 25.060 21.160 55.300 1.00 0.00 ATOM 1801 C28 POP 15 25.020 23.270 55.930 1.00 0.00 ATOM 1802 H8R POP 15 26.120 23.460 55.940 1.00 0.00 ATOM 1803 H8S POP 15 24.590 23.860 56.760 1.00 0.00 ATOM 1804 C29 POP 15 24.500 23.600 54.560 1.00 0.00 ATOM 1805 H91 POP 15 23.530 23.150 54.280 1.00 0.00 ATOM 1806 0C21 POP 15 25.160 24.220 53.580 1.00 0.00 ATOM 1807 1H10 POP 15 24.680 24.300 52.590 1.00 0.00 ATOM 1808 1C21 POP 15 26.540 24.820 53.630 1.00 0.00 ATOM 1809 H11R POP 15 26.880 25.220 54.600 1.00 0.00 ATOM 1810 H11S POP 15 26.410 25.670 52.930 1.00 0.00 ATOM 1811 2C21 POP 15 27.450 23.840 52.890 1.00 0.00 ATOM 1812 H12R POP 15 27.140 23.510 51.880 1.00 0.00 ATOM 1813 H12S POP 15 27.650 22.940 53.510 1.00 0.00 ATOM 1814 3C21 POP 15 28.830 24.470 52.700 1.00 0.00 ATOM 1815 H13R POP 15 29.150 24.740 53.730 1.00 0.00 ATOM 1816 H13S POP 15 28.730 25.440 52.180 1.00 0.00 ATOM 1817 4C21 POP 15 29.940 23.540 52.190 1.00 0.00 ATOM 1818 H14R POP 15 30.010 22.760 52.980 1.00 0.00 ATOM 1819 H14S POP 15 30.930 24.040 52.120 1.00 0.00 ATOM 1820 5C21 POP 15 29.700 22.860 50.840 1.00 0.00 ATOM 1821 H15R POP 15 28.910 22.100 51.010 1.00 0.00 ATOM 1822 H15S POP 15 30.540 22.190 50.540 1.00 0.00 ATOM 1823 6C21 POP 15 29.220 23.730 49.680 1.00 0.00 ATOM 1824 H16R POP 15 30.010 24.480 49.450 1.00 0.00 ATOM 1825 H16S POP 15 28.330 24.230 50.100 1.00 0.00 ATOM 1826 7C21 POP 15 28.680 22.920 48.500 1.00 0.00 ATOM 1827 H17R POP 15 27.930 22.260 48.970 1.00 0.00 ATOM 1828 H17S POP 15 29.610 22.410 48.160 1.00 0.00 ATOM 1829 8C21 POP 15 28.120 23.720 47.320 1.00 0.00 ATOM 1830 H18R POP 15 27.580 22.980 46.690 1.00 0.00 ATOM 1831 H18S POP 15 28.970 24.060 46.680 1.00 0.00 ATOM 1832 H18T POP 15 27.500 24.590 47.580 1.00 0.00 ATOM 1833 C33 POP 15 27.320 23.000 61.300 1.00 0.00 ATOM 1834 H3X POP 15 27.530 22.080 60.720 1.00 0.00 ATOM 1835 H3Y POP 15 28.250 23.400 61.760 1.00 0.00 ATOM 1836 C34 POP 15 26.820 24.120 60.380 1.00 0.00 ATOM 1837 H4X POP 15 26.820 25.040 61.010 1.00 0.00 ATOM 1838 H4Y POP 15 25.800 23.880 60.020 1.00 0.00 ATOM 1839 C35 POP 15 27.800 24.450 59.250 1.00 0.00 ATOM 1840 H5X POP 15 28.080 23.560 58.640 1.00 0.00 ATOM 1841 H5Y POP 15 28.740 24.780 59.730 1.00 0.00 ATOM 1842 C36 POP 15 27.240 25.520 58.320 1.00 0.00 ATOM 1843 H6X POP 15 27.180 26.430 58.940 1.00 0.00 ATOM 1844 H6Y POP 15 26.260 25.120 57.980 1.00 0.00 ATOM 1845 C37 POP 15 28.130 25.790 57.110 1.00 0.00 ATOM 1846 H7X POP 15 27.480 26.550 56.620 1.00 0.00 ATOM 1847 H7Y POP 15 28.310 24.940 56.420 1.00 0.00 ATOM 1848 C38 POP 15 29.430 26.500 57.520 1.00 0.00 ATOM 1849 H8X POP 15 30.180 25.830 57.990 1.00 0.00 ATOM 1850 H8Y POP 15 29.160 27.320 58.220 1.00 0.00 ATOM 1851 C39 POP 15 30.200 27.110 56.340 1.00 0.00 ATOM 1852 H9X POP 15 29.560 27.610 55.580 1.00 0.00 ATOM 1853 H9Y POP 15 30.630 26.270 55.760 1.00 0.00 ATOM 1854 0C31 POP 15 31.350 28.050 56.680 1.00 0.00 ATOM 1855 H10X POP 15 32.190 27.470 57.110 1.00 0.00 ATOM 1856 H10Y POP 15 30.990 28.840 57.380 1.00 0.00 ATOM 1857 1C31 POP 15 31.880 28.820 55.470 1.00 0.00 ATOM 1858 H11X POP 15 31.310 29.760 55.350 1.00 0.00 ATOM 1859 H11Y POP 15 31.700 28.270 54.520 1.00 0.00 ATOM 1860 2C31 POP 15 33.380 29.120 55.530 1.00 0.00 ATOM 1861 H12X POP 15 33.910 28.270 56.020 1.00 0.00 ATOM 1862 H12Y POP 15 33.550 29.980 56.220 1.00 0.00 ATOM 1863 3C31 POP 15 34.000 29.400 54.170 1.00 0.00 ATOM 1864 H13X POP 15 34.980 29.910 54.330 1.00 0.00 ATOM 1865 H13Y POP 15 33.400 30.150 53.610 1.00 0.00 ATOM 1866 4C31 POP 15 34.230 28.130 53.340 1.00 0.00 ATOM 1867 H14X POP 15 33.290 27.570 53.200 1.00 0.00 ATOM 1868 H14Y POP 15 34.950 27.550 53.960 1.00 0.00 ATOM 1869 5C31 POP 15 34.850 28.300 51.950 1.00 0.00 ATOM 1870 H15X POP 15 35.430 27.380 51.750 1.00 0.00 ATOM 1871 H15Y POP 15 35.700 29.010 52.020 1.00 0.00 ATOM 1872 6C31 POP 15 33.750 28.650 50.940 1.00 0.00 ATOM 1873 H16X POP 15 32.830 28.020 50.960 1.00 0.00 ATOM 1874 H16Y POP 15 34.220 28.670 49.940 1.00 0.00 ATOM 1875 H16Z POP 15 33.420 29.690 51.130 1.00 0.00 ATOM 1876 N POP 16 39.440 10.710 67.810 1.00 0.00 ATOM 1877 HN1 POP 16 39.900 10.710 66.870 1.00 0.00 ATOM 1878 HN2 POP 16 38.520 11.170 67.650 1.00 0.00 ATOM 1879 HN3 POP 16 39.920 11.430 68.400 1.00 0.00 ATOM 1880 C12 POP 16 39.280 9.410 68.560 1.00 0.00 ATOM 1881 H12A POP 16 38.610 9.650 69.410 1.00 0.00 ATOM 1882 H12B POP 16 40.300 9.140 68.930 1.00 0.00 ATOM 1883 C11 POP 16 38.810 8.310 67.610 1.00 0.00 ATOM 1884 H11A POP 16 38.920 7.280 68.000 1.00 0.00 ATOM 1885 H11B POP 16 39.550 8.420 66.790 1.00 0.00 ATOM 1886 P POP 16 37.040 7.690 65.930 1.00 0.00 ATOM 1887 O13 POP 16 35.770 8.170 65.340 1.00 0.00 ATOM 1888 O14 POP 16 37.030 6.360 66.580 1.00 0.00 ATOM 1889 O11 POP 16 38.140 7.790 64.770 1.00 0.00 ATOM 1890 O12 POP 16 37.510 8.660 67.110 1.00 0.00 ATOM 1891 C1 POP 16 38.330 9.050 64.110 1.00 0.00 ATOM 1892 HA POP 16 39.410 9.000 63.840 1.00 0.00 ATOM 1893 HB POP 16 38.180 10.000 64.670 1.00 0.00 ATOM 1894 C2 POP 16 37.470 9.060 62.840 1.00 0.00 ATOM 1895 HS POP 16 36.520 9.540 63.150 1.00 0.00 ATOM 1896 O21 POP 16 37.250 7.810 62.180 1.00 0.00 ATOM 1897 C21 POP 16 38.250 7.000 61.820 1.00 0.00 ATOM 1898 O22 POP 16 39.420 7.190 62.090 1.00 0.00 ATOM 1899 C22 POP 16 37.710 5.870 60.970 1.00 0.00 ATOM 1900 H2R POP 16 37.140 5.110 61.560 1.00 0.00 ATOM 1901 H2S POP 16 38.600 5.320 60.600 1.00 0.00 ATOM 1902 C3 POP 16 38.040 10.100 61.870 1.00 0.00 ATOM 1903 HX POP 16 39.100 9.820 61.670 1.00 0.00 ATOM 1904 HY POP 16 38.090 11.130 62.270 1.00 0.00 ATOM 1905 O31 POP 16 37.350 10.040 60.620 1.00 0.00 ATOM 1906 C31 POP 16 36.390 10.950 60.470 1.00 0.00 ATOM 1907 O32 POP 16 35.920 11.770 61.250 1.00 0.00 ATOM 1908 C32 POP 16 35.690 10.790 59.130 1.00 0.00 ATOM 1909 H2X POP 16 35.030 9.920 59.270 1.00 0.00 ATOM 1910 H2Y POP 16 36.410 10.450 58.350 1.00 0.00 ATOM 1911 C23 POP 16 36.890 6.360 59.770 1.00 0.00 ATOM 1912 H3R POP 16 37.390 7.260 59.340 1.00 0.00 ATOM 1913 H3S POP 16 35.870 6.520 60.170 1.00 0.00 ATOM 1914 C24 POP 16 36.770 5.240 58.730 1.00 0.00 ATOM 1915 H4R POP 16 36.580 4.280 59.260 1.00 0.00 ATOM 1916 H4S POP 16 37.730 5.130 58.180 1.00 0.00 ATOM 1917 C25 POP 16 35.580 5.350 57.780 1.00 0.00 ATOM 1918 H5R POP 16 34.730 5.060 58.440 1.00 0.00 ATOM 1919 H5S POP 16 35.620 4.640 56.930 1.00 0.00 ATOM 1920 C26 POP 16 35.430 6.760 57.210 1.00 0.00 ATOM 1921 H6R POP 16 35.270 7.580 57.950 1.00 0.00 ATOM 1922 H6S POP 16 34.480 6.730 56.640 1.00 0.00 ATOM 1923 C27 POP 16 36.660 6.940 56.310 1.00 0.00 ATOM 1924 H7R POP 16 36.890 6.070 55.660 1.00 0.00 ATOM 1925 H7S POP 16 37.560 6.980 56.950 1.00 0.00 ATOM 1926 C28 POP 16 36.500 8.210 55.470 1.00 0.00 ATOM 1927 H8R POP 16 36.330 9.080 56.140 1.00 0.00 ATOM 1928 H8S POP 16 35.600 8.030 54.840 1.00 0.00 ATOM 1929 C29 POP 16 37.650 8.480 54.550 1.00 0.00 ATOM 1930 H91 POP 16 38.580 8.710 55.090 1.00 0.00 ATOM 1931 0C21 POP 16 37.600 8.430 53.210 1.00 0.00 ATOM 1932 1H10 POP 16 38.510 8.710 52.650 1.00 0.00 ATOM 1933 1C21 POP 16 36.470 8.000 52.320 1.00 0.00 ATOM 1934 H11R POP 16 36.100 8.880 51.760 1.00 0.00 ATOM 1935 H11S POP 16 35.680 7.560 52.970 1.00 0.00 ATOM 1936 2C21 POP 16 36.940 6.890 51.370 1.00 0.00 ATOM 1937 H12R POP 16 37.040 5.980 52.010 1.00 0.00 ATOM 1938 H12S POP 16 37.870 7.120 50.810 1.00 0.00 ATOM 1939 3C21 POP 16 35.850 6.530 50.360 1.00 0.00 ATOM 1940 H13R POP 16 34.870 6.630 50.880 1.00 0.00 ATOM 1941 H13S POP 16 36.000 5.500 49.970 1.00 0.00 ATOM 1942 4C21 POP 16 35.880 7.450 49.140 1.00 0.00 ATOM 1943 H14R POP 16 35.830 8.530 49.410 1.00 0.00 ATOM 1944 H14S POP 16 34.970 7.290 48.510 1.00 0.00 ATOM 1945 5C21 POP 16 37.100 7.300 48.230 1.00 0.00 ATOM 1946 H15R POP 16 37.190 6.200 48.070 1.00 0.00 ATOM 1947 H15S POP 16 37.980 7.750 48.740 1.00 0.00 ATOM 1948 6C21 POP 16 37.030 8.070 46.920 1.00 0.00 ATOM 1949 H16R POP 16 36.040 7.750 46.530 1.00 0.00 ATOM 1950 H16S POP 16 37.960 7.710 46.430 1.00 0.00 ATOM 1951 7C21 POP 16 37.090 9.590 47.060 1.00 0.00 ATOM 1952 H17R POP 16 37.810 9.810 47.870 1.00 0.00 ATOM 1953 H17S POP 16 36.170 9.970 47.560 1.00 0.00 ATOM 1954 8C21 POP 16 37.310 10.380 45.770 1.00 0.00 ATOM 1955 H18R POP 16 37.010 11.450 45.740 1.00 0.00 ATOM 1956 H18S POP 16 36.840 9.740 44.990 1.00 0.00 ATOM 1957 H18T POP 16 38.410 10.290 45.650 1.00 0.00 ATOM 1958 C33 POP 16 35.080 12.130 58.700 1.00 0.00 ATOM 1959 H3X POP 16 34.500 12.520 59.560 1.00 0.00 ATOM 1960 H3Y POP 16 34.330 11.860 57.920 1.00 0.00 ATOM 1961 C34 POP 16 36.160 13.100 58.230 1.00 0.00 ATOM 1962 H4X POP 16 36.840 13.410 59.060 1.00 0.00 ATOM 1963 H4Y POP 16 35.630 14.040 57.950 1.00 0.00 ATOM 1964 C35 POP 16 36.890 12.580 56.990 1.00 0.00 ATOM 1965 H5X POP 16 37.460 11.620 57.050 1.00 0.00 ATOM 1966 H5Y POP 16 37.650 13.330 56.670 1.00 0.00 ATOM 1967 C36 POP 16 35.980 12.510 55.770 1.00 0.00 ATOM 1968 H6X POP 16 35.330 13.390 55.580 1.00 0.00 ATOM 1969 H6Y POP 16 35.340 11.600 55.740 1.00 0.00 ATOM 1970 C37 POP 16 36.890 12.390 54.540 1.00 0.00 ATOM 1971 H7X POP 16 37.530 11.490 54.610 1.00 0.00 ATOM 1972 H7Y POP 16 37.560 13.280 54.580 1.00 0.00 ATOM 1973 C38 POP 16 36.080 12.510 53.250 1.00 0.00 ATOM 1974 H8X POP 16 35.270 13.270 53.340 1.00 0.00 ATOM 1975 H8Y POP 16 35.500 11.570 53.110 1.00 0.00 ATOM 1976 C39 POP 16 36.860 12.730 51.950 1.00 0.00 ATOM 1977 H9X POP 16 37.550 11.870 51.840 1.00 0.00 ATOM 1978 H9Y POP 16 37.470 13.650 51.860 1.00 0.00 ATOM 1979 0C31 POP 16 35.880 12.750 50.780 1.00 0.00 ATOM 1980 H10X POP 16 35.060 13.480 50.950 1.00 0.00 ATOM 1981 H10Y POP 16 35.400 11.750 50.730 1.00 0.00 ATOM 1982 1C31 POP 16 36.460 13.020 49.390 1.00 0.00 ATOM 1983 H11X POP 16 35.750 12.880 48.540 1.00 0.00 ATOM 1984 H11Y POP 16 37.060 12.110 49.200 1.00 0.00 ATOM 1985 2C31 POP 16 37.180 14.360 49.180 1.00 0.00 ATOM 1986 H12X POP 16 37.370 14.340 48.090 1.00 0.00 ATOM 1987 H12Y POP 16 38.150 14.410 49.730 1.00 0.00 ATOM 1988 3C31 POP 16 36.430 15.650 49.480 1.00 0.00 ATOM 1989 H13X POP 16 36.460 15.750 50.590 1.00 0.00 ATOM 1990 H13Y POP 16 35.360 15.660 49.170 1.00 0.00 ATOM 1991 4C31 POP 16 37.040 16.910 48.870 1.00 0.00 ATOM 1992 H14X POP 16 37.100 16.860 47.760 1.00 0.00 ATOM 1993 H14Y POP 16 38.090 17.090 49.210 1.00 0.00 ATOM 1994 5C31 POP 16 36.330 18.190 49.300 1.00 0.00 ATOM 1995 H15X POP 16 36.140 18.210 50.400 1.00 0.00 ATOM 1996 H15Y POP 16 35.280 18.020 48.970 1.00 0.00 ATOM 1997 6C31 POP 16 36.900 19.490 48.740 1.00 0.00 ATOM 1998 H16X POP 16 37.940 19.700 49.070 1.00 0.00 ATOM 1999 H16Y POP 16 36.190 20.350 48.750 1.00 0.00 ATOM 2000 H16Z POP 16 37.000 19.350 47.640 1.00 0.00 ATOM 2001 N POP 17 60.330 24.790 70.280 1.00 0.00 ATOM 2002 HN1 POP 17 59.290 24.750 70.210 1.00 0.00 ATOM 2003 HN2 POP 17 60.690 23.950 69.780 1.00 0.00 ATOM 2004 HN3 POP 17 60.680 24.680 71.250 1.00 0.00 ATOM 2005 C12 POP 17 60.910 26.100 69.820 1.00 0.00 ATOM 2006 H12A POP 17 61.860 25.860 69.300 1.00 0.00 ATOM 2007 H12B POP 17 61.060 26.770 70.700 1.00 0.00 ATOM 2008 C11 POP 17 59.920 26.830 68.920 1.00 0.00 ATOM 2009 H11A POP 17 60.290 27.860 68.750 1.00 0.00 ATOM 2010 H11B POP 17 58.930 26.980 69.410 1.00 0.00 ATOM 2011 P POP 17 58.520 26.860 66.780 1.00 0.00 ATOM 2012 O13 POP 17 58.370 28.300 67.070 1.00 0.00 ATOM 2013 O14 POP 17 57.280 26.060 66.650 1.00 0.00 ATOM 2014 O11 POP 17 59.210 26.790 65.340 1.00 0.00 ATOM 2015 O12 POP 17 59.590 26.130 67.720 1.00 0.00 ATOM 2016 C1 POP 17 60.460 27.440 65.110 1.00 0.00 ATOM 2017 HA POP 17 61.160 26.730 64.610 1.00 0.00 ATOM 2018 HB POP 17 60.970 27.820 66.020 1.00 0.00 ATOM 2019 C2 POP 17 60.380 28.660 64.190 1.00 0.00 ATOM 2020 HS POP 17 59.730 29.350 64.780 1.00 0.00 ATOM 2021 O21 POP 17 59.770 28.130 63.020 1.00 0.00 ATOM 2022 C21 POP 17 59.320 28.960 62.070 1.00 0.00 ATOM 2023 O22 POP 17 58.820 30.040 62.320 1.00 0.00 ATOM 2024 C22 POP 17 59.650 28.290 60.750 1.00 0.00 ATOM 2025 H2R POP 17 59.170 27.290 60.810 1.00 0.00 ATOM 2026 H2S POP 17 60.740 28.090 60.710 1.00 0.00 ATOM 2027 C3 POP 17 61.740 29.340 63.960 1.00 0.00 ATOM 2028 HX POP 17 62.550 28.580 63.890 1.00 0.00 ATOM 2029 HY POP 17 62.080 30.020 64.780 1.00 0.00 ATOM 2030 O31 POP 17 61.780 30.060 62.730 1.00 0.00 ATOM 2031 C31 POP 17 61.470 31.350 62.830 1.00 0.00 ATOM 2032 O32 POP 17 61.090 31.980 63.800 1.00 0.00 ATOM 2033 C32 POP 17 61.780 31.930 61.450 1.00 0.00 ATOM 2034 H2X POP 17 61.890 31.150 60.670 1.00 0.00 ATOM 2035 H2Y POP 17 62.800 32.340 61.610 1.00 0.00 ATOM 2036 C23 POP 17 59.250 29.200 59.580 1.00 0.00 ATOM 2037 H3R POP 17 59.670 30.230 59.610 1.00 0.00 ATOM 2038 H3S POP 17 58.140 29.280 59.520 1.00 0.00 ATOM 2039 C24 POP 17 59.700 28.540 58.280 1.00 0.00 ATOM 2040 H4R POP 17 59.420 27.470 58.350 1.00 0.00 ATOM 2041 H4S POP 17 60.790 28.750 58.260 1.00 0.00 ATOM 2042 C25 POP 17 59.170 29.130 56.970 1.00 0.00 ATOM 2043 H5R POP 17 59.420 30.210 56.940 1.00 0.00 ATOM 2044 H5S POP 17 58.090 28.910 56.860 1.00 0.00 ATOM 2045 C26 POP 17 59.850 28.500 55.750 1.00 0.00 ATOM 2046 H6R POP 17 59.890 27.410 55.990 1.00 0.00 ATOM 2047 H6S POP 17 60.890 28.860 55.610 1.00 0.00 ATOM 2048 C27 POP 17 59.120 28.710 54.420 1.00 0.00 ATOM 2049 H7R POP 17 58.060 28.640 54.770 1.00 0.00 ATOM 2050 H7S POP 17 59.260 27.960 53.620 1.00 0.00 ATOM 2051 C28 POP 17 59.400 30.110 53.890 1.00 0.00 ATOM 2052 H8R POP 17 60.450 30.030 53.550 1.00 0.00 ATOM 2053 H8S POP 17 59.470 30.890 54.670 1.00 0.00 ATOM 2054 C29 POP 17 58.540 30.540 52.730 1.00 0.00 ATOM 2055 H91 POP 17 57.440 30.560 52.860 1.00 0.00 ATOM 2056 0C21 POP 17 59.050 30.850 51.540 1.00 0.00 ATOM 2057 1H10 POP 17 58.450 31.220 50.690 1.00 0.00 ATOM 2058 1C21 POP 17 60.480 30.900 51.080 1.00 0.00 ATOM 2059 H11R POP 17 60.930 29.890 50.970 1.00 0.00 ATOM 2060 H11S POP 17 61.080 31.510 51.790 1.00 0.00 ATOM 2061 2C21 POP 17 60.450 31.520 49.680 1.00 0.00 ATOM 2062 H12R POP 17 59.910 32.490 49.690 1.00 0.00 ATOM 2063 H12S POP 17 60.040 30.850 48.900 1.00 0.00 ATOM 2064 3C21 POP 17 61.830 31.910 49.120 1.00 0.00 ATOM 2065 H13R POP 17 62.460 31.000 49.280 1.00 0.00 ATOM 2066 H13S POP 17 62.200 32.750 49.750 1.00 0.00 ATOM 2067 4C21 POP 17 61.880 32.210 47.620 1.00 0.00 ATOM 2068 H14R POP 17 62.900 32.550 47.350 1.00 0.00 ATOM 2069 H14S POP 17 61.300 33.150 47.610 1.00 0.00 ATOM 2070 5C21 POP 17 61.290 31.120 46.720 1.00 0.00 ATOM 2071 H15R POP 17 60.190 31.150 46.570 1.00 0.00 ATOM 2072 H15S POP 17 61.740 30.150 47.040 1.00 0.00 ATOM 2073 6C21 POP 17 61.920 31.310 45.340 1.00 0.00 ATOM 2074 H16R POP 17 63.020 31.450 45.350 1.00 0.00 ATOM 2075 H16S POP 17 61.410 32.220 44.950 1.00 0.00 ATOM 2076 7C21 POP 17 61.460 30.230 44.360 1.00 0.00 ATOM 2077 H17R POP 17 60.350 30.310 44.360 1.00 0.00 ATOM 2078 H17S POP 17 61.750 29.300 44.900 1.00 0.00 ATOM 2079 8C21 POP 17 62.130 30.240 42.990 1.00 0.00 ATOM 2080 H18R POP 17 61.630 29.490 42.350 1.00 0.00 ATOM 2081 H18S POP 17 63.220 30.080 42.870 1.00 0.00 ATOM 2082 H18T POP 17 61.850 31.240 42.610 1.00 0.00 ATOM 2083 C33 POP 17 60.670 32.920 61.080 1.00 0.00 ATOM 2084 H3X POP 17 60.580 33.750 61.810 1.00 0.00 ATOM 2085 H3Y POP 17 59.660 32.450 61.040 1.00 0.00 ATOM 2086 C34 POP 17 60.780 33.800 59.840 1.00 0.00 ATOM 2087 H4X POP 17 61.540 34.560 60.100 1.00 0.00 ATOM 2088 H4Y POP 17 59.810 34.320 59.960 1.00 0.00 ATOM 2089 C35 POP 17 60.820 33.090 58.480 1.00 0.00 ATOM 2090 H5X POP 17 59.820 32.650 58.300 1.00 0.00 ATOM 2091 H5Y POP 17 61.520 32.230 58.530 1.00 0.00 ATOM 2092 C36 POP 17 61.130 34.050 57.330 1.00 0.00 ATOM 2093 H6X POP 17 62.140 34.470 57.540 1.00 0.00 ATOM 2094 H6Y POP 17 60.410 34.850 57.600 1.00 0.00 ATOM 2095 C37 POP 17 60.860 33.530 55.910 1.00 0.00 ATOM 2096 H7X POP 17 60.020 32.800 56.000 1.00 0.00 ATOM 2097 H7Y POP 17 61.810 33.010 55.630 1.00 0.00 ATOM 2098 C38 POP 17 60.750 34.640 54.870 1.00 0.00 ATOM 2099 H8X POP 17 61.750 35.070 54.700 1.00 0.00 ATOM 2100 H8Y POP 17 60.200 35.480 55.340 1.00 0.00 ATOM 2101 C39 POP 17 60.050 34.250 53.560 1.00 0.00 ATOM 2102 H9X POP 17 58.960 34.370 53.760 1.00 0.00 ATOM 2103 H9Y POP 17 60.300 33.200 53.300 1.00 0.00 ATOM 2104 0C31 POP 17 60.470 35.170 52.410 1.00 0.00 ATOM 2105 H10X POP 17 61.380 34.880 51.850 1.00 0.00 ATOM 2106 H10Y POP 17 60.550 36.180 52.870 1.00 0.00 ATOM 2107 1C31 POP 17 59.370 35.180 51.340 1.00 0.00 ATOM 2108 H11X POP 17 58.450 35.570 51.830 1.00 0.00 ATOM 2109 H11Y POP 17 59.220 34.110 51.090 1.00 0.00 ATOM 2110 2C31 POP 17 59.730 36.080 50.160 1.00 0.00 ATOM 2111 H12X POP 17 60.000 37.050 50.630 1.00 0.00 ATOM 2112 H12Y POP 17 58.750 36.150 49.640 1.00 0.00 ATOM 2113 3C31 POP 17 60.930 35.810 49.250 1.00 0.00 ATOM 2114 H13X POP 17 60.830 34.840 48.720 1.00 0.00 ATOM 2115 H13Y POP 17 61.840 35.730 49.880 1.00 0.00 ATOM 2116 4C31 POP 17 61.180 36.970 48.280 1.00 0.00 ATOM 2117 H14X POP 17 61.620 37.790 48.880 1.00 0.00 ATOM 2118 H14Y POP 17 60.240 37.330 47.810 1.00 0.00 ATOM 2119 5C31 POP 17 62.260 36.800 47.210 1.00 0.00 ATOM 2120 H15X POP 17 62.060 35.870 46.620 1.00 0.00 ATOM 2121 H15Y POP 17 63.150 36.630 47.850 1.00 0.00 ATOM 2122 6C31 POP 17 62.450 38.000 46.290 1.00 0.00 ATOM 2123 H16X POP 17 62.620 38.860 46.970 1.00 0.00 ATOM 2124 H16Y POP 17 61.600 38.240 45.610 1.00 0.00 ATOM 2125 H16Z POP 17 63.330 37.920 45.610 1.00 0.00 ATOM 2126 N POP 18 10.330 35.680 68.970 1.00 0.00 ATOM 2127 HN1 POP 18 9.470 35.140 68.780 1.00 0.00 ATOM 2128 HN2 POP 18 10.900 35.050 69.580 1.00 0.00 ATOM 2129 HN3 POP 18 9.960 36.560 69.380 1.00 0.00 ATOM 2130 C12 POP 18 10.940 36.020 67.630 1.00 0.00 ATOM 2131 H12A POP 18 11.600 36.900 67.790 1.00 0.00 ATOM 2132 H12B POP 18 10.160 36.220 66.870 1.00 0.00 ATOM 2133 C11 POP 18 11.680 34.790 67.110 1.00 0.00 ATOM 2134 H11A POP 18 12.070 34.840 66.070 1.00 0.00 ATOM 2135 H11B POP 18 10.990 33.910 67.140 1.00 0.00 ATOM 2136 P POP 18 14.090 35.240 67.860 1.00 0.00 ATOM 2137 O13 POP 18 15.190 34.520 68.530 1.00 0.00 ATOM 2138 O14 POP 18 13.760 36.570 68.430 1.00 0.00 ATOM 2139 O11 POP 18 14.390 35.410 66.300 1.00 0.00 ATOM 2140 O12 POP 18 12.780 34.320 67.890 1.00 0.00 ATOM 2141 C1 POP 18 15.150 34.370 65.690 1.00 0.00 ATOM 2142 HA POP 18 14.760 34.290 64.650 1.00 0.00 ATOM 2143 HB POP 18 14.980 33.390 66.180 1.00 0.00 ATOM 2144 C2 POP 18 16.660 34.610 65.870 1.00 0.00 ATOM 2145 HS POP 18 16.800 35.050 66.880 1.00 0.00 ATOM 2146 O21 POP 18 17.010 35.660 64.960 1.00 0.00 ATOM 2147 C21 POP 18 18.240 36.130 65.170 1.00 0.00 ATOM 2148 O22 POP 18 18.960 35.830 66.110 1.00 0.00 ATOM 2149 C22 POP 18 18.730 36.970 64.000 1.00 0.00 ATOM 2150 H2R POP 18 18.060 37.850 63.980 1.00 0.00 ATOM 2151 H2S POP 18 18.630 36.380 63.070 1.00 0.00 ATOM 2152 C3 POP 18 17.390 33.270 65.720 1.00 0.00 ATOM 2153 HX POP 18 16.960 32.660 66.540 1.00 0.00 ATOM 2154 HY POP 18 18.450 33.410 66.010 1.00 0.00 ATOM 2155 O31 POP 18 17.180 32.800 64.380 1.00 0.00 ATOM 2156 C31 POP 18 18.160 33.070 63.520 1.00 0.00 ATOM 2157 O32 POP 18 19.270 33.470 63.830 1.00 0.00 ATOM 2158 C32 POP 18 17.560 33.040 62.120 1.00 0.00 ATOM 2159 H2X POP 18 17.870 33.960 61.590 1.00 0.00 ATOM 2160 H2Y POP 18 16.460 33.110 62.240 1.00 0.00 ATOM 2161 C23 POP 18 20.190 37.370 64.260 1.00 0.00 ATOM 2162 H3R POP 18 20.900 36.540 64.450 1.00 0.00 ATOM 2163 H3S POP 18 20.270 38.150 65.060 1.00 0.00 ATOM 2164 C24 POP 18 20.670 38.280 63.130 1.00 0.00 ATOM 2165 H4R POP 18 21.520 38.800 63.630 1.00 0.00 ATOM 2166 H4S POP 18 19.930 39.050 62.810 1.00 0.00 ATOM 2167 C25 POP 18 21.230 37.510 61.940 1.00 0.00 ATOM 2168 H5R POP 18 20.410 36.870 61.540 1.00 0.00 ATOM 2169 H5S POP 18 21.890 36.780 62.460 1.00 0.00 ATOM 2170 C26 POP 18 21.900 38.320 60.830 1.00 0.00 ATOM 2171 H6R POP 18 22.210 37.540 60.090 1.00 0.00 ATOM 2172 H6S POP 18 22.810 38.690 61.340 1.00 0.00 ATOM 2173 C27 POP 18 21.170 39.520 60.230 1.00 0.00 ATOM 2174 H7R POP 18 21.700 39.920 59.340 1.00 0.00 ATOM 2175 H7S POP 18 21.140 40.390 60.920 1.00 0.00 ATOM 2176 C28 POP 18 19.820 39.100 59.650 1.00 0.00 ATOM 2177 H8R POP 18 19.070 39.230 60.460 1.00 0.00 ATOM 2178 H8S POP 18 19.730 38.020 59.390 1.00 0.00 ATOM 2179 C29 POP 18 19.370 39.910 58.480 1.00 0.00 ATOM 2180 H91 POP 18 18.810 40.830 58.700 1.00 0.00 ATOM 2181 0C21 POP 18 19.760 39.720 57.210 1.00 0.00 ATOM 2182 1H10 POP 18 19.390 40.420 56.440 1.00 0.00 ATOM 2183 1C21 POP 18 20.580 38.560 56.710 1.00 0.00 ATOM 2184 H11R POP 18 19.990 37.920 56.020 1.00 0.00 ATOM 2185 H11S POP 18 20.990 37.940 57.530 1.00 0.00 ATOM 2186 2C21 POP 18 21.880 39.100 56.100 1.00 0.00 ATOM 2187 H12R POP 18 22.600 38.250 56.130 1.00 0.00 ATOM 2188 H12S POP 18 22.260 39.940 56.720 1.00 0.00 ATOM 2189 3C21 POP 18 21.740 39.560 54.650 1.00 0.00 ATOM 2190 H13R POP 18 21.520 40.650 54.580 1.00 0.00 ATOM 2191 H13S POP 18 20.850 39.080 54.190 1.00 0.00 ATOM 2192 4C21 POP 18 22.960 39.390 53.740 1.00 0.00 ATOM 2193 H14R POP 18 23.000 38.280 53.690 1.00 0.00 ATOM 2194 H14S POP 18 23.850 39.760 54.280 1.00 0.00 ATOM 2195 5C21 POP 18 22.800 40.130 52.410 1.00 0.00 ATOM 2196 H15R POP 18 22.760 41.240 52.510 1.00 0.00 ATOM 2197 H15S POP 18 21.870 39.830 51.890 1.00 0.00 ATOM 2198 6C21 POP 18 23.790 39.690 51.330 1.00 0.00 ATOM 2199 H16R POP 18 23.870 38.580 51.360 1.00 0.00 ATOM 2200 H16S POP 18 24.770 40.140 51.600 1.00 0.00 ATOM 2201 7C21 POP 18 23.430 40.120 49.910 1.00 0.00 ATOM 2202 H17R POP 18 22.340 40.150 49.700 1.00 0.00 ATOM 2203 H17S POP 18 23.850 39.270 49.320 1.00 0.00 ATOM 2204 8C21 POP 18 24.060 41.450 49.480 1.00 0.00 ATOM 2205 H18R POP 18 25.060 41.610 49.930 1.00 0.00 ATOM 2206 H18S POP 18 23.470 42.350 49.730 1.00 0.00 ATOM 2207 H18T POP 18 24.110 41.410 48.370 1.00 0.00 ATOM 2208 C33 POP 18 18.250 31.780 61.590 1.00 0.00 ATOM 2209 H3X POP 18 17.820 30.880 62.060 1.00 0.00 ATOM 2210 H3Y POP 18 19.350 31.890 61.750 1.00 0.00 ATOM 2211 C34 POP 18 17.930 31.520 60.110 1.00 0.00 ATOM 2212 H4X POP 18 18.340 32.300 59.440 1.00 0.00 ATOM 2213 H4Y POP 18 16.840 31.370 59.950 1.00 0.00 ATOM 2214 C35 POP 18 18.630 30.200 59.770 1.00 0.00 ATOM 2215 H5X POP 18 18.400 29.410 60.510 1.00 0.00 ATOM 2216 H5Y POP 18 19.740 30.320 59.800 1.00 0.00 ATOM 2217 C36 POP 18 18.180 29.650 58.420 1.00 0.00 ATOM 2218 H6X POP 18 18.610 30.320 57.640 1.00 0.00 ATOM 2219 H6Y POP 18 17.070 29.640 58.370 1.00 0.00 ATOM 2220 C37 POP 18 18.710 28.250 58.100 1.00 0.00 ATOM 2221 H7X POP 18 18.240 27.500 58.770 1.00 0.00 ATOM 2222 H7Y POP 18 19.810 28.340 58.150 1.00 0.00 ATOM 2223 C38 POP 18 18.350 27.830 56.680 1.00 0.00 ATOM 2224 H8X POP 18 18.820 26.850 56.450 1.00 0.00 ATOM 2225 H8Y POP 18 18.870 28.540 56.000 1.00 0.00 ATOM 2226 C39 POP 18 16.860 27.730 56.340 1.00 0.00 ATOM 2227 H9X POP 18 16.410 28.740 56.500 1.00 0.00 ATOM 2228 H9Y POP 18 16.410 27.130 57.160 1.00 0.00 ATOM 2229 0C31 POP 18 16.530 27.220 54.940 1.00 0.00 ATOM 2230 H10X POP 18 16.760 26.140 55.120 1.00 0.00 ATOM 2231 H10Y POP 18 17.140 27.660 54.120 1.00 0.00 ATOM 2232 1C31 POP 18 15.030 27.240 54.640 1.00 0.00 ATOM 2233 H11X POP 18 14.760 28.310 54.580 1.00 0.00 ATOM 2234 H11Y POP 18 14.420 26.760 55.430 1.00 0.00 ATOM 2235 2C31 POP 18 14.650 26.420 53.400 1.00 0.00 ATOM 2236 H12X POP 18 13.550 26.480 53.230 1.00 0.00 ATOM 2237 H12Y POP 18 14.800 25.350 53.640 1.00 0.00 ATOM 2238 3C31 POP 18 15.440 26.740 52.130 1.00 0.00 ATOM 2239 H13X POP 18 16.530 26.710 52.350 1.00 0.00 ATOM 2240 H13Y POP 18 15.040 27.720 51.810 1.00 0.00 ATOM 2241 4C31 POP 18 15.280 25.950 50.830 1.00 0.00 ATOM 2242 H14X POP 18 15.650 24.960 51.160 1.00 0.00 ATOM 2243 H14Y POP 18 15.840 26.460 50.010 1.00 0.00 ATOM 2244 5C31 POP 18 13.840 25.710 50.390 1.00 0.00 ATOM 2245 H15X POP 18 13.230 25.480 51.290 1.00 0.00 ATOM 2246 H15Y POP 18 13.820 24.860 49.670 1.00 0.00 ATOM 2247 6C31 POP 18 13.120 26.940 49.840 1.00 0.00 ATOM 2248 H16X POP 18 13.060 27.710 50.640 1.00 0.00 ATOM 2249 H16Y POP 18 12.110 26.700 49.440 1.00 0.00 ATOM 2250 H16Z POP 18 13.670 27.470 49.030 1.00 0.00 ATOM 2251 N POP 19 4.770 11.910 62.720 1.00 0.00 ATOM 2252 HN1 POP 19 3.950 12.010 62.090 1.00 0.00 ATOM 2253 HN2 POP 19 5.270 12.810 62.860 1.00 0.00 ATOM 2254 HN3 POP 19 5.400 11.220 62.250 1.00 0.00 ATOM 2255 C12 POP 19 4.240 11.440 64.050 1.00 0.00 ATOM 2256 H12A POP 19 3.200 11.820 64.040 1.00 0.00 ATOM 2257 H12B POP 19 4.800 11.900 64.890 1.00 0.00 ATOM 2258 C11 POP 19 4.250 9.910 64.210 1.00 0.00 ATOM 2259 H11A POP 19 3.770 9.630 65.170 1.00 0.00 ATOM 2260 H11B POP 19 5.320 9.700 64.390 1.00 0.00 ATOM 2261 P POP 19 2.210 8.830 63.170 1.00 0.00 ATOM 2262 O13 POP 19 1.430 10.000 63.630 1.00 0.00 ATOM 2263 O14 POP 19 1.930 7.610 63.950 1.00 0.00 ATOM 2264 O11 POP 19 1.740 8.730 61.640 1.00 0.00 ATOM 2265 O12 POP 19 3.770 9.200 63.070 1.00 0.00 ATOM 2266 C1 POP 19 2.660 8.150 60.710 1.00 0.00 ATOM 2267 HA POP 19 1.990 7.620 59.990 1.00 0.00 ATOM 2268 HB POP 19 3.230 7.330 61.200 1.00 0.00 ATOM 2269 C2 POP 19 3.630 9.160 60.080 1.00 0.00 ATOM 2270 HS POP 19 3.320 10.140 60.500 1.00 0.00 ATOM 2271 O21 POP 19 3.350 9.200 58.680 1.00 0.00 ATOM 2272 C21 POP 19 3.720 10.310 58.030 1.00 0.00 ATOM 2273 O22 POP 19 4.290 11.230 58.600 1.00 0.00 ATOM 2274 C22 POP 19 3.490 10.260 56.530 1.00 0.00 ATOM 2275 H2R POP 19 3.320 9.190 56.300 1.00 0.00 ATOM 2276 H2S POP 19 4.350 10.630 55.920 1.00 0.00 ATOM 2277 C3 POP 19 5.090 8.780 60.360 1.00 0.00 ATOM 2278 HX POP 19 5.150 7.700 60.110 1.00 0.00 ATOM 2279 HY POP 19 5.240 8.780 61.460 1.00 0.00 ATOM 2280 O31 POP 19 6.080 9.350 59.500 1.00 0.00 ATOM 2281 C31 POP 19 6.820 10.290 60.090 1.00 0.00 ATOM 2282 O32 POP 19 6.630 10.630 61.250 1.00 0.00 ATOM 2283 C32 POP 19 7.840 10.990 59.200 1.00 0.00 ATOM 2284 H2X POP 19 8.810 10.450 59.240 1.00 0.00 ATOM 2285 H2Y POP 19 8.010 12.000 59.640 1.00 0.00 ATOM 2286 C23 POP 19 2.320 11.100 56.000 1.00 0.00 ATOM 2287 H3R POP 19 2.610 12.170 55.970 1.00 0.00 ATOM 2288 H3S POP 19 1.450 11.050 56.690 1.00 0.00 ATOM 2289 C24 POP 19 2.010 10.700 54.560 1.00 0.00 ATOM 2290 H4R POP 19 0.910 10.850 54.450 1.00 0.00 ATOM 2291 H4S POP 19 2.250 9.610 54.490 1.00 0.00 ATOM 2292 C25 POP 19 2.840 11.470 53.540 1.00 0.00 ATOM 2293 H5R POP 19 3.900 11.400 53.880 1.00 0.00 ATOM 2294 H5S POP 19 2.560 12.540 53.630 1.00 0.00 ATOM 2295 C26 POP 19 2.620 10.950 52.120 1.00 0.00 ATOM 2296 H6R POP 19 2.380 9.870 52.170 1.00 0.00 ATOM 2297 H6S POP 19 3.620 11.010 51.630 1.00 0.00 ATOM 2298 C27 POP 19 1.650 11.750 51.250 1.00 0.00 ATOM 2299 H7R POP 19 1.780 12.850 51.230 1.00 0.00 ATOM 2300 H7S POP 19 0.650 11.610 51.710 1.00 0.00 ATOM 2301 C28 POP 19 1.900 11.290 49.810 1.00 0.00 ATOM 2302 H8R POP 19 1.830 10.180 49.820 1.00 0.00 ATOM 2303 H8S POP 19 2.930 11.610 49.540 1.00 0.00 ATOM 2304 C29 POP 19 0.910 11.730 48.770 1.00 0.00 ATOM 2305 H91 POP 19 0.620 12.790 48.820 1.00 0.00 ATOM 2306 0C21 POP 19 0.370 11.070 47.740 1.00 0.00 ATOM 2307 1H10 POP 19 -0.210 11.730 47.070 1.00 0.00 ATOM 2308 1C21 POP 19 0.600 9.680 47.220 1.00 0.00 ATOM 2309 H11R POP 19 -0.180 9.060 47.720 1.00 0.00 ATOM 2310 H11S POP 19 1.550 9.310 47.650 1.00 0.00 ATOM 2311 2C21 POP 19 0.670 9.540 45.700 1.00 0.00 ATOM 2312 H12R POP 19 1.520 10.190 45.410 1.00 0.00 ATOM 2313 H12S POP 19 -0.200 9.830 45.060 1.00 0.00 ATOM 2314 3C21 POP 19 0.960 8.100 45.280 1.00 0.00 ATOM 2315 H13R POP 19 -0.030 7.630 45.460 1.00 0.00 ATOM 2316 H13S POP 19 1.750 7.760 45.980 1.00 0.00 ATOM 2317 4C21 POP 19 1.460 7.890 43.850 1.00 0.00 ATOM 2318 H14R POP 19 2.330 8.590 43.800 1.00 0.00 ATOM 2319 H14S POP 19 0.700 8.240 43.120 1.00 0.00 ATOM 2320 5C21 POP 19 2.120 6.550 43.500 1.00 0.00 ATOM 2321 H15R POP 19 3.060 6.600 44.100 1.00 0.00 ATOM 2322 H15S POP 19 2.440 6.620 42.440 1.00 0.00 ATOM 2323 6C21 POP 19 1.480 5.230 43.930 1.00 0.00 ATOM 2324 H16R POP 19 0.470 5.160 43.470 1.00 0.00 ATOM 2325 H16S POP 19 1.500 5.340 45.030 1.00 0.00 ATOM 2326 7C21 POP 19 2.290 4.020 43.470 1.00 0.00 ATOM 2327 H17R POP 19 2.260 4.050 42.360 1.00 0.00 ATOM 2328 H17S POP 19 1.740 3.080 43.710 1.00 0.00 ATOM 2329 8C21 POP 19 3.730 3.820 43.920 1.00 0.00 ATOM 2330 H18R POP 19 4.290 4.770 43.730 1.00 0.00 ATOM 2331 H18S POP 19 4.140 3.050 43.230 1.00 0.00 ATOM 2332 H18T POP 19 3.800 3.510 44.980 1.00 0.00 ATOM 2333 C33 POP 19 7.310 11.040 57.770 1.00 0.00 ATOM 2334 H3X POP 19 6.540 11.850 57.780 1.00 0.00 ATOM 2335 H3Y POP 19 6.910 10.060 57.450 1.00 0.00 ATOM 2336 C34 POP 19 8.420 11.380 56.780 1.00 0.00 ATOM 2337 H4X POP 19 9.080 10.490 56.700 1.00 0.00 ATOM 2338 H4Y POP 19 8.910 12.310 57.130 1.00 0.00 ATOM 2339 C35 POP 19 7.840 11.590 55.380 1.00 0.00 ATOM 2340 H5X POP 19 6.920 12.200 55.400 1.00 0.00 ATOM 2341 H5Y POP 19 7.530 10.590 54.980 1.00 0.00 ATOM 2342 C36 POP 19 8.820 12.180 54.360 1.00 0.00 ATOM 2343 H6X POP 19 8.290 12.120 53.380 1.00 0.00 ATOM 2344 H6Y POP 19 9.650 11.450 54.280 1.00 0.00 ATOM 2345 C37 POP 19 9.290 13.590 54.730 1.00 0.00 ATOM 2346 H7X POP 19 9.730 13.530 55.750 1.00 0.00 ATOM 2347 H7Y POP 19 8.350 14.170 54.840 1.00 0.00 ATOM 2348 C38 POP 19 10.160 14.220 53.650 1.00 0.00 ATOM 2349 H8X POP 19 10.320 15.280 53.920 1.00 0.00 ATOM 2350 H8Y POP 19 9.460 14.220 52.780 1.00 0.00 ATOM 2351 C39 POP 19 11.510 13.510 53.480 1.00 0.00 ATOM 2352 H9X POP 19 11.380 12.410 53.460 1.00 0.00 ATOM 2353 H9Y POP 19 12.070 13.900 54.360 1.00 0.00 ATOM 2354 0C31 POP 19 12.240 13.960 52.210 1.00 0.00 ATOM 2355 H10X POP 19 13.340 13.850 52.310 1.00 0.00 ATOM 2356 H10Y POP 19 12.100 15.060 52.130 1.00 0.00 ATOM 2357 1C31 POP 19 11.730 13.280 50.940 1.00 0.00 ATOM 2358 H11X POP 19 10.640 13.450 50.850 1.00 0.00 ATOM 2359 H11Y POP 19 11.800 12.190 51.120 1.00 0.00 ATOM 2360 2C31 POP 19 12.440 13.830 49.700 1.00 0.00 ATOM 2361 H12X POP 19 13.540 13.650 49.780 1.00 0.00 ATOM 2362 H12Y POP 19 12.210 14.920 49.630 1.00 0.00 ATOM 2363 3C31 POP 19 11.930 13.310 48.360 1.00 0.00 ATOM 2364 H13X POP 19 10.860 13.620 48.290 1.00 0.00 ATOM 2365 H13Y POP 19 11.870 12.220 48.200 1.00 0.00 ATOM 2366 4C31 POP 19 12.640 13.880 47.130 1.00 0.00 ATOM 2367 H14X POP 19 12.360 14.940 46.970 1.00 0.00 ATOM 2368 H14Y POP 19 12.400 13.360 46.180 1.00 0.00 ATOM 2369 5C31 POP 19 14.170 13.850 47.240 1.00 0.00 ATOM 2370 H15X POP 19 14.460 12.780 47.180 1.00 0.00 ATOM 2371 H15Y POP 19 14.570 14.210 48.220 1.00 0.00 ATOM 2372 6C31 POP 19 14.980 14.460 46.090 1.00 0.00 ATOM 2373 H16X POP 19 14.590 15.460 45.840 1.00 0.00 ATOM 2374 H16Y POP 19 14.810 13.870 45.160 1.00 0.00 ATOM 2375 H16Z POP 19 16.060 14.490 46.350 1.00 0.00 ATOM 2376 N POP 20 57.050 38.020 62.850 1.00 0.00 ATOM 2377 HN1 POP 20 57.980 37.630 63.110 1.00 0.00 ATOM 2378 HN2 POP 20 56.870 37.900 61.830 1.00 0.00 ATOM 2379 HN3 POP 20 57.110 39.050 62.990 1.00 0.00 ATOM 2380 C12 POP 20 55.930 37.460 63.700 1.00 0.00 ATOM 2381 H12A POP 20 56.370 37.430 64.720 1.00 0.00 ATOM 2382 H12B POP 20 55.720 36.420 63.370 1.00 0.00 ATOM 2383 C11 POP 20 54.730 38.410 63.650 1.00 0.00 ATOM 2384 H11A POP 20 55.050 39.450 63.870 1.00 0.00 ATOM 2385 H11B POP 20 53.930 38.050 64.340 1.00 0.00 ATOM 2386 P POP 20 53.050 39.580 62.230 1.00 0.00 ATOM 2387 O13 POP 20 53.660 40.880 61.860 1.00 0.00 ATOM 2388 O14 POP 20 52.270 39.490 63.490 1.00 0.00 ATOM 2389 O11 POP 20 52.190 38.970 61.030 1.00 0.00 ATOM 2390 O12 POP 20 54.260 38.540 62.310 1.00 0.00 ATOM 2391 C1 POP 20 51.750 37.610 61.120 1.00 0.00 ATOM 2392 HA POP 20 50.780 37.550 60.590 1.00 0.00 ATOM 2393 HB POP 20 51.490 37.340 62.160 1.00 0.00 ATOM 2394 C2 POP 20 52.610 36.650 60.280 1.00 0.00 ATOM 2395 HS POP 20 53.610 36.640 60.780 1.00 0.00 ATOM 2396 O21 POP 20 52.630 37.200 58.960 1.00 0.00 ATOM 2397 C21 POP 20 53.810 37.020 58.370 1.00 0.00 ATOM 2398 O22 POP 20 54.700 36.270 58.750 1.00 0.00 ATOM 2399 C22 POP 20 53.810 37.780 57.060 1.00 0.00 ATOM 2400 H2R POP 20 53.670 38.860 57.270 1.00 0.00 ATOM 2401 H2S POP 20 53.040 37.440 56.330 1.00 0.00 ATOM 2402 C3 POP 20 52.060 35.230 60.430 1.00 0.00 ATOM 2403 HX POP 20 50.980 35.260 60.160 1.00 0.00 ATOM 2404 HY POP 20 52.030 34.900 61.490 1.00 0.00 ATOM 2405 O31 POP 20 52.700 34.230 59.640 1.00 0.00 ATOM 2406 C31 POP 20 53.880 33.820 60.100 1.00 0.00 ATOM 2407 O32 POP 20 54.480 34.250 61.070 1.00 0.00 ATOM 2408 C32 POP 20 54.320 32.630 59.260 1.00 0.00 ATOM 2409 H2X POP 20 53.850 32.660 58.250 1.00 0.00 ATOM 2410 H2Y POP 20 53.990 31.730 59.810 1.00 0.00 ATOM 2411 C23 POP 20 55.180 37.450 56.470 1.00 0.00 ATOM 2412 H3R POP 20 55.510 36.410 56.630 1.00 0.00 ATOM 2413 H3S POP 20 55.780 38.210 57.030 1.00 0.00 ATOM 2414 C24 POP 20 55.300 37.770 54.980 1.00 0.00 ATOM 2415 H4R POP 20 55.250 38.850 54.730 1.00 0.00 ATOM 2416 H4S POP 20 54.440 37.290 54.450 1.00 0.00 ATOM 2417 C25 POP 20 56.520 37.070 54.380 1.00 0.00 ATOM 2418 H5R POP 20 56.320 37.020 53.290 1.00 0.00 ATOM 2419 H5S POP 20 56.610 36.010 54.700 1.00 0.00 ATOM 2420 C26 POP 20 57.820 37.790 54.730 1.00 0.00 ATOM 2421 H6R POP 20 58.670 37.200 54.330 1.00 0.00 ATOM 2422 H6S POP 20 57.920 37.770 55.830 1.00 0.00 ATOM 2423 C27 POP 20 57.940 39.220 54.190 1.00 0.00 ATOM 2424 H7R POP 20 58.940 39.560 54.520 1.00 0.00 ATOM 2425 H7S POP 20 57.150 39.770 54.760 1.00 0.00 ATOM 2426 C28 POP 20 57.800 39.360 52.680 1.00 0.00 ATOM 2427 H8R POP 20 56.770 39.060 52.380 1.00 0.00 ATOM 2428 H8S POP 20 58.300 38.480 52.220 1.00 0.00 ATOM 2429 C29 POP 20 58.160 40.720 52.160 1.00 0.00 ATOM 2430 H91 POP 20 57.760 41.630 52.630 1.00 0.00 ATOM 2431 0C21 POP 20 58.830 40.910 51.010 1.00 0.00 ATOM 2432 1H10 POP 20 59.190 41.910 50.740 1.00 0.00 ATOM 2433 1C21 POP 20 59.420 39.870 50.100 1.00 0.00 ATOM 2434 H11R POP 20 58.770 38.990 49.890 1.00 0.00 ATOM 2435 H11S POP 20 60.340 39.450 50.570 1.00 0.00 ATOM 2436 2C21 POP 20 59.870 40.430 48.760 1.00 0.00 ATOM 2437 H12R POP 20 59.000 40.870 48.230 1.00 0.00 ATOM 2438 H12S POP 20 60.260 39.680 48.030 1.00 0.00 ATOM 2439 3C21 POP 20 60.990 41.470 48.770 1.00 0.00 ATOM 2440 H13R POP 20 61.820 40.990 49.330 1.00 0.00 ATOM 2441 H13S POP 20 60.550 42.410 49.160 1.00 0.00 ATOM 2442 4C21 POP 20 61.700 41.650 47.420 1.00 0.00 ATOM 2443 H14R POP 20 60.990 42.050 46.670 1.00 0.00 ATOM 2444 H14S POP 20 62.300 40.840 46.950 1.00 0.00 ATOM 2445 5C21 POP 20 62.680 42.800 47.690 1.00 0.00 ATOM 2446 H15R POP 20 63.340 42.490 48.530 1.00 0.00 ATOM 2447 H15S POP 20 62.040 43.650 47.980 1.00 0.00 ATOM 2448 6C21 POP 20 63.420 43.150 46.400 1.00 0.00 ATOM 2449 H16R POP 20 62.770 42.990 45.510 1.00 0.00 ATOM 2450 H16S POP 20 64.310 42.500 46.210 1.00 0.00 ATOM 2451 7C21 POP 20 63.990 44.560 46.520 1.00 0.00 ATOM 2452 H17R POP 20 64.730 44.560 47.340 1.00 0.00 ATOM 2453 H17S POP 20 63.250 45.350 46.780 1.00 0.00 ATOM 2454 8C21 POP 20 64.730 45.030 45.270 1.00 0.00 ATOM 2455 H18R POP 20 65.290 45.940 45.580 1.00 0.00 ATOM 2456 H18S POP 20 64.040 45.340 44.460 1.00 0.00 ATOM 2457 H18T POP 20 65.470 44.230 45.020 1.00 0.00 ATOM 2458 C33 POP 20 55.820 32.800 59.030 1.00 0.00 ATOM 2459 H3X POP 20 56.350 32.770 60.010 1.00 0.00 ATOM 2460 H3Y POP 20 56.080 33.750 58.520 1.00 0.00 ATOM 2461 C34 POP 20 56.460 31.680 58.210 1.00 0.00 ATOM 2462 H4X POP 20 56.340 30.710 58.740 1.00 0.00 ATOM 2463 H4Y POP 20 57.550 31.920 58.130 1.00 0.00 ATOM 2464 C35 POP 20 56.020 31.560 56.760 1.00 0.00 ATOM 2465 H5X POP 20 54.960 31.210 56.760 1.00 0.00 ATOM 2466 H5Y POP 20 56.720 30.860 56.250 1.00 0.00 ATOM 2467 C36 POP 20 56.070 32.780 55.830 1.00 0.00 ATOM 2468 H6X POP 20 57.150 33.050 55.900 1.00 0.00 ATOM 2469 H6Y POP 20 55.410 33.500 56.370 1.00 0.00 ATOM 2470 C37 POP 20 55.620 32.440 54.410 1.00 0.00 ATOM 2471 H7X POP 20 54.750 31.750 54.420 1.00 0.00 ATOM 2472 H7Y POP 20 56.550 31.910 54.100 1.00 0.00 ATOM 2473 C38 POP 20 55.500 33.760 53.650 1.00 0.00 ATOM 2474 H8X POP 20 56.520 34.190 53.740 1.00 0.00 ATOM 2475 H8Y POP 20 54.800 34.460 54.160 1.00 0.00 ATOM 2476 C39 POP 20 55.060 33.860 52.190 1.00 0.00 ATOM 2477 H9X POP 20 55.960 33.710 51.550 1.00 0.00 ATOM 2478 H9Y POP 20 54.760 34.920 52.080 1.00 0.00 ATOM 2479 0C31 POP 20 53.840 33.050 51.740 1.00 0.00 ATOM 2480 H10X POP 20 52.920 33.440 52.230 1.00 0.00 ATOM 2481 H10Y POP 20 53.970 32.000 52.090 1.00 0.00 ATOM 2482 1C31 POP 20 53.630 33.050 50.230 1.00 0.00 ATOM 2483 H11X POP 20 52.570 32.720 50.130 1.00 0.00 ATOM 2484 H11Y POP 20 54.380 32.370 49.770 1.00 0.00 ATOM 2485 2C31 POP 20 53.620 34.400 49.500 1.00 0.00 ATOM 2486 H12X POP 20 54.680 34.720 49.350 1.00 0.00 ATOM 2487 H12Y POP 20 52.890 35.150 49.870 1.00 0.00 ATOM 2488 3C31 POP 20 53.120 34.160 48.070 1.00 0.00 ATOM 2489 H13X POP 20 52.290 33.420 48.100 1.00 0.00 ATOM 2490 H13Y POP 20 53.940 33.680 47.500 1.00 0.00 ATOM 2491 4C31 POP 20 52.640 35.430 47.370 1.00 0.00 ATOM 2492 H14X POP 20 53.430 36.190 47.570 1.00 0.00 ATOM 2493 H14Y POP 20 51.810 35.860 47.990 1.00 0.00 ATOM 2494 5C31 POP 20 52.340 35.370 45.870 1.00 0.00 ATOM 2495 H15X POP 20 53.130 34.830 45.300 1.00 0.00 ATOM 2496 H15Y POP 20 52.240 36.350 45.360 1.00 0.00 ATOM 2497 6C31 POP 20 51.000 34.780 45.450 1.00 0.00 ATOM 2498 H16X POP 20 50.870 33.760 45.880 1.00 0.00 ATOM 2499 H16Y POP 20 51.090 34.660 44.350 1.00 0.00 ATOM 2500 H16Z POP 20 50.180 35.450 45.800 1.00 0.00 ATOM 2501 N POP 21 16.300 6.810 63.090 1.00 0.00 ATOM 2502 HN1 POP 21 15.270 6.780 62.950 1.00 0.00 ATOM 2503 HN2 POP 21 16.720 6.620 64.020 1.00 0.00 ATOM 2504 HN3 POP 21 16.590 7.790 62.860 1.00 0.00 ATOM 2505 C12 POP 21 16.970 6.010 62.000 1.00 0.00 ATOM 2506 H12A POP 21 18.030 6.150 62.310 1.00 0.00 ATOM 2507 H12B POP 21 16.830 6.490 61.010 1.00 0.00 ATOM 2508 C11 POP 21 16.710 4.510 61.820 1.00 0.00 ATOM 2509 H11A POP 21 17.460 4.040 61.140 1.00 0.00 ATOM 2510 H11B POP 21 15.710 4.370 61.360 1.00 0.00 ATOM 2511 P POP 21 16.710 2.270 62.960 1.00 0.00 ATOM 2512 O13 POP 21 15.660 1.780 62.030 1.00 0.00 ATOM 2513 O14 POP 21 16.830 1.600 64.270 1.00 0.00 ATOM 2514 O11 POP 21 18.110 1.890 62.280 1.00 0.00 ATOM 2515 O12 POP 21 16.630 3.860 63.090 1.00 0.00 ATOM 2516 C1 POP 21 19.330 2.490 62.720 1.00 0.00 ATOM 2517 HA POP 21 19.320 2.510 63.830 1.00 0.00 ATOM 2518 HB POP 21 19.260 3.540 62.380 1.00 0.00 ATOM 2519 C2 POP 21 20.520 1.690 62.160 1.00 0.00 ATOM 2520 HS POP 21 21.500 2.200 62.280 1.00 0.00 ATOM 2521 O21 POP 21 20.220 1.320 60.810 1.00 0.00 ATOM 2522 C21 POP 21 21.210 1.630 59.980 1.00 0.00 ATOM 2523 O22 POP 21 22.210 2.270 60.260 1.00 0.00 ATOM 2524 C22 POP 21 21.050 1.040 58.580 1.00 0.00 ATOM 2525 H2R POP 21 20.660 -0.000 58.670 1.00 0.00 ATOM 2526 H2S POP 21 22.070 1.030 58.120 1.00 0.00 ATOM 2527 C3 POP 21 20.800 0.380 62.920 1.00 0.00 ATOM 2528 HX POP 21 19.900 -0.260 62.970 1.00 0.00 ATOM 2529 HY POP 21 21.160 0.510 63.970 1.00 0.00 ATOM 2530 O31 POP 21 21.730 -0.470 62.250 1.00 0.00 ATOM 2531 C31 POP 21 23.010 -0.190 62.470 1.00 0.00 ATOM 2532 O32 POP 21 23.440 0.540 63.360 1.00 0.00 ATOM 2533 C32 POP 21 23.850 -0.850 61.390 1.00 0.00 ATOM 2534 H2X POP 21 24.610 -1.510 61.860 1.00 0.00 ATOM 2535 H2Y POP 21 24.350 0.030 60.910 1.00 0.00 ATOM 2536 C23 POP 21 20.030 1.870 57.820 1.00 0.00 ATOM 2537 H3R POP 21 20.250 2.960 57.870 1.00 0.00 ATOM 2538 H3S POP 21 19.070 1.780 58.360 1.00 0.00 ATOM 2539 C24 POP 21 19.710 1.410 56.400 1.00 0.00 ATOM 2540 H4R POP 21 19.090 2.200 55.910 1.00 0.00 ATOM 2541 H4S POP 21 19.010 0.570 56.580 1.00 0.00 ATOM 2542 C25 POP 21 20.900 1.060 55.500 1.00 0.00 ATOM 2543 H5R POP 21 21.510 0.240 55.930 1.00 0.00 ATOM 2544 H5S POP 21 21.490 2.000 55.530 1.00 0.00 ATOM 2545 C26 POP 21 20.410 0.810 54.080 1.00 0.00 ATOM 2546 H6R POP 21 21.250 0.460 53.450 1.00 0.00 ATOM 2547 H6S POP 21 20.050 1.750 53.620 1.00 0.00 ATOM 2548 C27 POP 21 19.290 -0.230 53.930 1.00 0.00 ATOM 2549 H7R POP 21 18.470 0.120 54.590 1.00 0.00 ATOM 2550 H7S POP 21 19.620 -1.230 54.280 1.00 0.00 ATOM 2551 C28 POP 21 18.910 -0.420 52.460 1.00 0.00 ATOM 2552 H8R POP 21 18.850 0.600 52.020 1.00 0.00 ATOM 2553 H8S POP 21 17.860 -0.770 52.570 1.00 0.00 ATOM 2554 C29 POP 21 19.820 -1.400 51.770 1.00 0.00 ATOM 2555 H91 POP 21 20.290 -2.150 52.420 1.00 0.00 ATOM 2556 0C21 POP 21 20.090 -1.510 50.470 1.00 0.00 ATOM 2557 1H10 POP 21 20.630 -2.330 49.980 1.00 0.00 ATOM 2558 1C21 POP 21 19.680 -0.500 49.440 1.00 0.00 ATOM 2559 H11R POP 21 20.500 0.160 49.070 1.00 0.00 ATOM 2560 H11S POP 21 18.960 0.260 49.800 1.00 0.00 ATOM 2561 2C21 POP 21 18.820 -1.140 48.350 1.00 0.00 ATOM 2562 H12R POP 21 18.450 -0.300 47.710 1.00 0.00 ATOM 2563 H12S POP 21 17.920 -1.680 48.720 1.00 0.00 ATOM 2564 3C21 POP 21 19.670 -1.990 47.390 1.00 0.00 ATOM 2565 H13R POP 21 20.290 -2.620 48.070 1.00 0.00 ATOM 2566 H13S POP 21 20.300 -1.280 46.820 1.00 0.00 ATOM 2567 4C21 POP 21 18.820 -2.900 46.510 1.00 0.00 ATOM 2568 H14R POP 21 18.650 -3.890 46.980 1.00 0.00 ATOM 2569 H14S POP 21 19.430 -3.150 45.610 1.00 0.00 ATOM 2570 5C21 POP 21 17.490 -2.300 46.040 1.00 0.00 ATOM 2571 H15R POP 21 17.640 -1.270 45.660 1.00 0.00 ATOM 2572 H15S POP 21 16.920 -2.170 46.980 1.00 0.00 ATOM 2573 6C21 POP 21 16.910 -3.170 44.920 1.00 0.00 ATOM 2574 H16R POP 21 16.980 -4.220 45.250 1.00 0.00 ATOM 2575 H16S POP 21 17.400 -3.000 43.930 1.00 0.00 ATOM 2576 7C21 POP 21 15.410 -2.920 44.780 1.00 0.00 ATOM 2577 H17R POP 21 15.270 -1.870 44.440 1.00 0.00 ATOM 2578 H17S POP 21 14.970 -3.150 45.770 1.00 0.00 ATOM 2579 8C21 POP 21 14.760 -3.750 43.670 1.00 0.00 ATOM 2580 H18R POP 21 14.770 -4.840 43.870 1.00 0.00 ATOM 2581 H18S POP 21 15.320 -3.520 42.730 1.00 0.00 ATOM 2582 H18T POP 21 13.690 -3.520 43.510 1.00 0.00 ATOM 2583 C33 POP 21 23.110 -1.700 60.360 1.00 0.00 ATOM 2584 H3X POP 21 22.530 -1.070 59.650 1.00 0.00 ATOM 2585 H3Y POP 21 22.490 -2.300 61.060 1.00 0.00 ATOM 2586 C34 POP 21 24.090 -2.590 59.600 1.00 0.00 ATOM 2587 H4X POP 21 23.840 -3.600 59.220 1.00 0.00 ATOM 2588 H4Y POP 21 25.040 -2.770 60.150 1.00 0.00 ATOM 2589 C35 POP 21 24.690 -1.870 58.400 1.00 0.00 ATOM 2590 H5X POP 21 25.710 -2.300 58.280 1.00 0.00 ATOM 2591 H5Y POP 21 24.700 -0.780 58.620 1.00 0.00 ATOM 2592 C36 POP 21 23.850 -1.980 57.120 1.00 0.00 ATOM 2593 H6X POP 21 22.810 -1.880 57.500 1.00 0.00 ATOM 2594 H6Y POP 21 23.830 -3.020 56.740 1.00 0.00 ATOM 2595 C37 POP 21 24.180 -0.900 56.090 1.00 0.00 ATOM 2596 H7X POP 21 25.260 -0.790 55.840 1.00 0.00 ATOM 2597 H7Y POP 21 23.650 0.030 56.380 1.00 0.00 ATOM 2598 C38 POP 21 23.730 -1.250 54.670 1.00 0.00 ATOM 2599 H8X POP 21 22.630 -1.310 54.570 1.00 0.00 ATOM 2600 H8Y POP 21 24.140 -2.230 54.340 1.00 0.00 ATOM 2601 C39 POP 21 24.090 -0.110 53.710 1.00 0.00 ATOM 2602 H9X POP 21 25.140 0.240 53.670 1.00 0.00 ATOM 2603 H9Y POP 21 23.490 0.780 54.010 1.00 0.00 ATOM 2604 0C31 POP 21 23.660 -0.530 52.300 1.00 0.00 ATOM 2605 H10X POP 21 22.660 -1.000 52.280 1.00 0.00 ATOM 2606 H10Y POP 21 24.360 -1.320 51.960 1.00 0.00 ATOM 2607 1C31 POP 21 23.710 0.580 51.240 1.00 0.00 ATOM 2608 H11X POP 21 24.650 1.170 51.200 1.00 0.00 ATOM 2609 H11Y POP 21 22.790 1.150 51.470 1.00 0.00 ATOM 2610 2C31 POP 21 23.580 -0.020 49.840 1.00 0.00 ATOM 2611 H12X POP 21 22.810 -0.820 49.770 1.00 0.00 ATOM 2612 H12Y POP 21 24.530 -0.560 49.660 1.00 0.00 ATOM 2613 3C31 POP 21 23.190 1.030 48.800 1.00 0.00 ATOM 2614 H13X POP 21 23.960 1.820 48.920 1.00 0.00 ATOM 2615 H13Y POP 21 22.240 1.440 49.190 1.00 0.00 ATOM 2616 4C31 POP 21 23.020 0.720 47.310 1.00 0.00 ATOM 2617 H14X POP 21 22.400 -0.190 47.150 1.00 0.00 ATOM 2618 H14Y POP 21 24.020 0.470 46.900 1.00 0.00 ATOM 2619 5C31 POP 21 22.390 1.890 46.560 1.00 0.00 ATOM 2620 H15X POP 21 22.780 2.890 46.860 1.00 0.00 ATOM 2621 H15Y POP 21 21.290 1.990 46.690 1.00 0.00 ATOM 2622 6C31 POP 21 22.760 1.910 45.080 1.00 0.00 ATOM 2623 H16X POP 21 22.190 2.650 44.480 1.00 0.00 ATOM 2624 H16Y POP 21 22.650 0.880 44.680 1.00 0.00 ATOM 2625 H16Z POP 21 23.820 2.240 44.990 1.00 0.00 ATOM 2626 N POP 22 51.470 49.140 60.330 1.00 0.00 ATOM 2627 HN1 POP 22 52.000 48.570 61.020 1.00 0.00 ATOM 2628 HN2 POP 22 51.240 49.990 60.870 1.00 0.00 ATOM 2629 HN3 POP 22 50.540 48.770 60.060 1.00 0.00 ATOM 2630 C12 POP 22 52.450 49.510 59.230 1.00 0.00 ATOM 2631 H12A POP 22 52.030 50.430 58.750 1.00 0.00 ATOM 2632 H12B POP 22 52.490 48.680 58.500 1.00 0.00 ATOM 2633 C11 POP 22 53.750 49.860 59.960 1.00 0.00 ATOM 2634 H11A POP 22 54.370 50.250 59.120 1.00 0.00 ATOM 2635 H11B POP 22 54.190 48.980 60.470 1.00 0.00 ATOM 2636 P POP 22 54.910 51.610 61.380 1.00 0.00 ATOM 2637 O13 POP 22 55.870 50.520 61.670 1.00 0.00 ATOM 2638 O14 POP 22 54.710 52.610 62.460 1.00 0.00 ATOM 2639 O11 POP 22 55.330 52.310 60.000 1.00 0.00 ATOM 2640 O12 POP 22 53.560 50.840 60.980 1.00 0.00 ATOM 2641 C1 POP 22 56.480 53.150 60.130 1.00 0.00 ATOM 2642 HA POP 22 57.360 52.480 60.270 1.00 0.00 ATOM 2643 HB POP 22 56.400 53.850 60.980 1.00 0.00 ATOM 2644 C2 POP 22 56.830 53.950 58.860 1.00 0.00 ATOM 2645 HS POP 22 56.200 54.860 58.850 1.00 0.00 ATOM 2646 O21 POP 22 56.510 53.160 57.710 1.00 0.00 ATOM 2647 C21 POP 22 57.140 52.000 57.510 1.00 0.00 ATOM 2648 O22 POP 22 58.160 51.540 58.010 1.00 0.00 ATOM 2649 C22 POP 22 56.380 51.140 56.510 1.00 0.00 ATOM 2650 H2R POP 22 55.460 51.660 56.170 1.00 0.00 ATOM 2651 H2S POP 22 56.140 50.140 56.930 1.00 0.00 ATOM 2652 C3 POP 22 58.290 54.430 58.880 1.00 0.00 ATOM 2653 HX POP 22 58.900 53.540 59.120 1.00 0.00 ATOM 2654 HY POP 22 58.310 55.170 59.710 1.00 0.00 ATOM 2655 O31 POP 22 58.680 54.800 57.550 1.00 0.00 ATOM 2656 C31 POP 22 58.360 56.040 57.210 1.00 0.00 ATOM 2657 O32 POP 22 57.950 56.900 57.970 1.00 0.00 ATOM 2658 C32 POP 22 59.050 56.260 55.870 1.00 0.00 ATOM 2659 H2X POP 22 58.770 55.510 55.100 1.00 0.00 ATOM 2660 H2Y POP 22 60.130 56.530 55.880 1.00 0.00 ATOM 2661 C23 POP 22 57.260 50.930 55.280 1.00 0.00 ATOM 2662 H3R POP 22 57.920 51.810 55.130 1.00 0.00 ATOM 2663 H3S POP 22 56.610 50.780 54.390 1.00 0.00 ATOM 2664 C24 POP 22 58.090 49.670 55.500 1.00 0.00 ATOM 2665 H4R POP 22 57.360 48.910 55.860 1.00 0.00 ATOM 2666 H4S POP 22 58.840 49.840 56.310 1.00 0.00 ATOM 2667 C25 POP 22 58.770 49.350 54.170 1.00 0.00 ATOM 2668 H5R POP 22 59.390 48.460 54.420 1.00 0.00 ATOM 2669 H5S POP 22 59.480 50.130 53.840 1.00 0.00 ATOM 2670 C26 POP 22 57.950 48.960 52.940 1.00 0.00 ATOM 2671 H6R POP 22 57.080 49.640 52.780 1.00 0.00 ATOM 2672 H6S POP 22 57.400 48.020 53.190 1.00 0.00 ATOM 2673 C27 POP 22 58.750 48.720 51.650 1.00 0.00 ATOM 2674 H7R POP 22 59.410 47.850 51.810 1.00 0.00 ATOM 2675 H7S POP 22 59.500 49.470 51.340 1.00 0.00 ATOM 2676 C28 POP 22 57.860 48.520 50.430 1.00 0.00 ATOM 2677 H8R POP 22 57.010 49.230 50.370 1.00 0.00 ATOM 2678 H8S POP 22 57.430 47.500 50.470 1.00 0.00 ATOM 2679 C29 POP 22 58.760 48.650 49.230 1.00 0.00 ATOM 2680 H91 POP 22 59.810 48.910 49.410 1.00 0.00 ATOM 2681 0C21 POP 22 58.380 48.410 47.970 1.00 0.00 ATOM 2682 1H10 POP 22 59.070 48.520 47.110 1.00 0.00 ATOM 2683 1C21 POP 22 56.950 48.030 47.720 1.00 0.00 ATOM 2684 H11R POP 22 56.220 48.760 48.130 1.00 0.00 ATOM 2685 H11S POP 22 56.820 46.970 48.040 1.00 0.00 ATOM 2686 2C21 POP 22 56.650 48.210 46.230 1.00 0.00 ATOM 2687 H12R POP 22 56.510 49.300 46.140 1.00 0.00 ATOM 2688 H12S POP 22 55.760 47.640 45.890 1.00 0.00 ATOM 2689 3C21 POP 22 57.780 47.780 45.290 1.00 0.00 ATOM 2690 H13R POP 22 58.160 46.810 45.670 1.00 0.00 ATOM 2691 H13S POP 22 58.590 48.530 45.290 1.00 0.00 ATOM 2692 4C21 POP 22 57.220 47.490 43.890 1.00 0.00 ATOM 2693 H14R POP 22 56.580 48.340 43.580 1.00 0.00 ATOM 2694 H14S POP 22 56.510 46.640 43.980 1.00 0.00 ATOM 2695 5C21 POP 22 58.240 46.980 42.880 1.00 0.00 ATOM 2696 H15R POP 22 57.710 46.310 42.170 1.00 0.00 ATOM 2697 H15S POP 22 58.610 47.790 42.220 1.00 0.00 ATOM 2698 6C21 POP 22 59.540 46.430 43.470 1.00 0.00 ATOM 2699 H16R POP 22 59.490 45.600 44.210 1.00 0.00 ATOM 2700 H16S POP 22 60.100 47.220 44.020 1.00 0.00 ATOM 2701 7C21 POP 22 60.520 45.870 42.440 1.00 0.00 ATOM 2702 H17R POP 22 61.390 45.410 42.960 1.00 0.00 ATOM 2703 H17S POP 22 60.850 46.720 41.810 1.00 0.00 ATOM 2704 8C21 POP 22 59.890 44.740 41.630 1.00 0.00 ATOM 2705 H18R POP 22 58.940 44.870 41.070 1.00 0.00 ATOM 2706 H18S POP 22 59.730 43.850 42.270 1.00 0.00 ATOM 2707 H18T POP 22 60.620 44.340 40.890 1.00 0.00 ATOM 2708 C33 POP 22 58.400 57.570 55.420 1.00 0.00 ATOM 2709 H3X POP 22 58.970 57.960 54.550 1.00 0.00 ATOM 2710 H3Y POP 22 58.390 58.370 56.190 1.00 0.00 ATOM 2711 C34 POP 22 57.010 57.380 54.810 1.00 0.00 ATOM 2712 H4X POP 22 56.320 56.850 55.500 1.00 0.00 ATOM 2713 H4Y POP 22 57.160 56.780 53.890 1.00 0.00 ATOM 2714 C35 POP 22 56.320 58.670 54.340 1.00 0.00 ATOM 2715 H5X POP 22 57.080 59.120 53.670 1.00 0.00 ATOM 2716 H5Y POP 22 56.140 59.420 55.130 1.00 0.00 ATOM 2717 C36 POP 22 55.060 58.460 53.500 1.00 0.00 ATOM 2718 H6X POP 22 54.420 59.340 53.680 1.00 0.00 ATOM 2719 H6Y POP 22 54.320 57.740 53.900 1.00 0.00 ATOM 2720 C37 POP 22 55.350 58.260 52.010 1.00 0.00 ATOM 2721 H7X POP 22 56.020 57.370 52.030 1.00 0.00 ATOM 2722 H7Y POP 22 55.930 59.130 51.640 1.00 0.00 ATOM 2723 C38 POP 22 54.190 57.980 51.050 1.00 0.00 ATOM 2724 H8X POP 22 53.590 58.920 51.050 1.00 0.00 ATOM 2725 H8Y POP 22 53.520 57.300 51.620 1.00 0.00 ATOM 2726 C39 POP 22 54.590 57.480 49.660 1.00 0.00 ATOM 2727 H9X POP 22 55.330 56.680 49.870 1.00 0.00 ATOM 2728 H9Y POP 22 55.240 58.240 49.160 1.00 0.00 ATOM 2729 0C31 POP 22 53.470 56.980 48.750 1.00 0.00 ATOM 2730 H10X POP 22 52.720 57.790 48.660 1.00 0.00 ATOM 2731 H10Y POP 22 52.970 56.050 49.100 1.00 0.00 ATOM 2732 1C31 POP 22 53.890 56.780 47.290 1.00 0.00 ATOM 2733 H11X POP 22 54.190 57.720 46.790 1.00 0.00 ATOM 2734 H11Y POP 22 52.920 56.510 46.820 1.00 0.00 ATOM 2735 2C31 POP 22 54.910 55.660 47.100 1.00 0.00 ATOM 2736 H12X POP 22 54.470 54.740 47.550 1.00 0.00 ATOM 2737 H12Y POP 22 55.800 55.880 47.720 1.00 0.00 ATOM 2738 3C31 POP 22 55.240 55.390 45.630 1.00 0.00 ATOM 2739 H13X POP 22 55.500 56.350 45.140 1.00 0.00 ATOM 2740 H13Y POP 22 54.350 55.000 45.100 1.00 0.00 ATOM 2741 4C31 POP 22 56.440 54.480 45.330 1.00 0.00 ATOM 2742 H14X POP 22 57.260 54.790 46.020 1.00 0.00 ATOM 2743 H14Y POP 22 56.880 54.770 44.350 1.00 0.00 ATOM 2744 5C31 POP 22 56.130 53.010 45.600 1.00 0.00 ATOM 2745 H15X POP 22 55.120 52.680 45.260 1.00 0.00 ATOM 2746 H15Y POP 22 56.230 52.940 46.700 1.00 0.00 ATOM 2747 6C31 POP 22 57.240 52.130 45.010 1.00 0.00 ATOM 2748 H16X POP 22 58.280 52.380 45.330 1.00 0.00 ATOM 2749 H16Y POP 22 57.170 52.010 43.910 1.00 0.00 ATOM 2750 H16Z POP 22 57.060 51.120 45.440 1.00 0.00 ATOM 2751 N POP 23 55.910 49.240 63.990 1.00 0.00 ATOM 2752 HN1 POP 23 56.680 48.570 64.200 1.00 0.00 ATOM 2753 HN2 POP 23 55.970 49.370 62.960 1.00 0.00 ATOM 2754 HN3 POP 23 56.070 50.120 64.530 1.00 0.00 ATOM 2755 C12 POP 23 54.620 48.560 64.400 1.00 0.00 ATOM 2756 H12A POP 23 53.800 49.020 63.810 1.00 0.00 ATOM 2757 H12B POP 23 54.390 48.830 65.450 1.00 0.00 ATOM 2758 C11 POP 23 54.600 47.060 64.100 1.00 0.00 ATOM 2759 H11A POP 23 53.530 46.760 64.150 1.00 0.00 ATOM 2760 H11B POP 23 55.200 46.600 64.920 1.00 0.00 ATOM 2761 P POP 23 54.250 46.460 61.640 1.00 0.00 ATOM 2762 O13 POP 23 53.190 47.480 61.800 1.00 0.00 ATOM 2763 O14 POP 23 53.860 45.040 61.640 1.00 0.00 ATOM 2764 O11 POP 23 54.980 46.840 60.260 1.00 0.00 ATOM 2765 O12 POP 23 55.240 46.770 62.860 1.00 0.00 ATOM 2766 C1 POP 23 56.410 46.800 60.280 1.00 0.00 ATOM 2767 HA POP 23 56.790 45.840 60.680 1.00 0.00 ATOM 2768 HB POP 23 56.920 47.580 60.890 1.00 0.00 ATOM 2769 C2 POP 23 57.010 46.990 58.880 1.00 0.00 ATOM 2770 HS POP 23 57.170 48.080 58.700 1.00 0.00 ATOM 2771 O21 POP 23 56.220 46.340 57.880 1.00 0.00 ATOM 2772 C21 POP 23 55.240 47.080 57.370 1.00 0.00 ATOM 2773 O22 POP 23 54.850 48.170 57.770 1.00 0.00 ATOM 2774 C22 POP 23 54.450 46.230 56.380 1.00 0.00 ATOM 2775 H2R POP 23 53.440 46.220 56.840 1.00 0.00 ATOM 2776 H2S POP 23 54.820 45.190 56.360 1.00 0.00 ATOM 2777 C3 POP 23 58.450 46.460 58.790 1.00 0.00 ATOM 2778 HX POP 23 58.380 45.360 58.950 1.00 0.00 ATOM 2779 HY POP 23 58.840 46.830 59.750 1.00 0.00 ATOM 2780 O31 POP 23 59.200 46.940 57.670 1.00 0.00 ATOM 2781 C31 POP 23 60.510 46.840 57.900 1.00 0.00 ATOM 2782 O32 POP 23 60.950 46.410 58.950 1.00 0.00 ATOM 2783 C32 POP 23 61.200 47.610 56.790 1.00 0.00 ATOM 2784 H2X POP 23 60.750 48.620 56.720 1.00 0.00 ATOM 2785 H2Y POP 23 60.970 47.250 55.760 1.00 0.00 ATOM 2786 C23 POP 23 54.550 46.820 54.970 1.00 0.00 ATOM 2787 H3R POP 23 54.390 46.040 54.200 1.00 0.00 ATOM 2788 H3S POP 23 55.600 47.190 54.950 1.00 0.00 ATOM 2789 C24 POP 23 53.520 47.910 54.680 1.00 0.00 ATOM 2790 H4R POP 23 53.420 48.560 55.570 1.00 0.00 ATOM 2791 H4S POP 23 52.490 47.590 54.410 1.00 0.00 ATOM 2792 C25 POP 23 53.920 48.880 53.570 1.00 0.00 ATOM 2793 H5R POP 23 54.990 49.060 53.800 1.00 0.00 ATOM 2794 H5S POP 23 53.430 49.870 53.710 1.00 0.00 ATOM 2795 C26 POP 23 53.770 48.420 52.120 1.00 0.00 ATOM 2796 H6R POP 23 54.490 47.570 52.070 1.00 0.00 ATOM 2797 H6S POP 23 54.030 49.240 51.420 1.00 0.00 ATOM 2798 C27 POP 23 52.410 47.830 51.740 1.00 0.00 ATOM 2799 H7R POP 23 51.630 48.610 51.870 1.00 0.00 ATOM 2800 H7S POP 23 52.300 47.020 52.500 1.00 0.00 ATOM 2801 C28 POP 23 52.450 47.240 50.330 1.00 0.00 ATOM 2802 H8R POP 23 52.820 48.070 49.690 1.00 0.00 ATOM 2803 H8S POP 23 51.380 47.090 50.080 1.00 0.00 ATOM 2804 C29 POP 23 53.410 46.100 50.120 1.00 0.00 ATOM 2805 H91 POP 23 54.470 46.340 49.950 1.00 0.00 ATOM 2806 0C21 POP 23 53.000 44.820 50.150 1.00 0.00 ATOM 2807 1H10 POP 23 53.770 44.040 50.010 1.00 0.00 ATOM 2808 1C21 POP 23 51.600 44.340 50.380 1.00 0.00 ATOM 2809 H11R POP 23 50.800 44.940 49.900 1.00 0.00 ATOM 2810 H11S POP 23 51.310 44.540 51.440 1.00 0.00 ATOM 2811 2C21 POP 23 51.430 42.840 50.150 1.00 0.00 ATOM 2812 H12R POP 23 50.390 42.590 50.430 1.00 0.00 ATOM 2813 H12S POP 23 52.200 42.310 50.750 1.00 0.00 ATOM 2814 3C21 POP 23 51.600 42.520 48.660 1.00 0.00 ATOM 2815 H13R POP 23 52.640 42.180 48.490 1.00 0.00 ATOM 2816 H13S POP 23 51.480 43.430 48.030 1.00 0.00 ATOM 2817 4C21 POP 23 50.550 41.500 48.230 1.00 0.00 ATOM 2818 H14R POP 23 49.510 41.860 48.410 1.00 0.00 ATOM 2819 H14S POP 23 50.670 40.590 48.860 1.00 0.00 ATOM 2820 5C21 POP 23 50.550 41.090 46.750 1.00 0.00 ATOM 2821 H15R POP 23 51.350 40.330 46.590 1.00 0.00 ATOM 2822 H15S POP 23 50.790 42.000 46.150 1.00 0.00 ATOM 2823 6C21 POP 23 49.200 40.600 46.240 1.00 0.00 ATOM 2824 H16R POP 23 49.200 40.320 45.160 1.00 0.00 ATOM 2825 H16S POP 23 48.500 41.470 46.320 1.00 0.00 ATOM 2826 7C21 POP 23 48.520 39.440 46.960 1.00 0.00 ATOM 2827 H17R POP 23 47.500 39.350 46.550 1.00 0.00 ATOM 2828 H17S POP 23 48.480 39.680 48.040 1.00 0.00 ATOM 2829 8C21 POP 23 49.230 38.100 46.790 1.00 0.00 ATOM 2830 H18R POP 23 50.260 38.020 47.220 1.00 0.00 ATOM 2831 H18S POP 23 49.290 37.720 45.750 1.00 0.00 ATOM 2832 H18T POP 23 48.620 37.380 47.390 1.00 0.00 ATOM 2833 C33 POP 23 62.680 47.820 57.130 1.00 0.00 ATOM 2834 H3X POP 23 63.060 46.800 57.370 1.00 0.00 ATOM 2835 H3Y POP 23 62.800 48.480 58.010 1.00 0.00 ATOM 2836 C34 POP 23 63.430 48.120 55.830 1.00 0.00 ATOM 2837 H4X POP 23 62.900 48.850 55.170 1.00 0.00 ATOM 2838 H4Y POP 23 63.430 47.150 55.290 1.00 0.00 ATOM 2839 C35 POP 23 64.870 48.560 56.110 1.00 0.00 ATOM 2840 H5X POP 23 65.650 48.200 55.400 1.00 0.00 ATOM 2841 H5Y POP 23 65.160 48.110 57.090 1.00 0.00 ATOM 2842 C36 POP 23 65.100 50.060 56.270 1.00 0.00 ATOM 2843 H6X POP 23 66.190 50.150 56.490 1.00 0.00 ATOM 2844 H6Y POP 23 64.540 50.480 57.140 1.00 0.00 ATOM 2845 C37 POP 23 64.780 50.890 55.030 1.00 0.00 ATOM 2846 H7X POP 23 64.990 51.930 55.360 1.00 0.00 ATOM 2847 H7Y POP 23 63.750 50.790 54.620 1.00 0.00 ATOM 2848 C38 POP 23 65.550 50.480 53.770 1.00 0.00 ATOM 2849 H8X POP 23 65.460 51.280 53.010 1.00 0.00 ATOM 2850 H8Y POP 23 64.960 49.670 53.300 1.00 0.00 ATOM 2851 C39 POP 23 67.060 50.250 53.920 1.00 0.00 ATOM 2852 H9X POP 23 67.350 49.320 54.460 1.00 0.00 ATOM 2853 H9Y POP 23 67.370 51.080 54.580 1.00 0.00 ATOM 2854 0C31 POP 23 67.850 50.420 52.620 1.00 0.00 ATOM 2855 H10X POP 23 67.740 51.450 52.220 1.00 0.00 ATOM 2856 H10Y POP 23 67.450 49.760 51.820 1.00 0.00 ATOM 2857 1C31 POP 23 69.310 50.170 52.970 1.00 0.00 ATOM 2858 H11X POP 23 69.560 49.120 53.260 1.00 0.00 ATOM 2859 H11Y POP 23 69.700 50.720 53.850 1.00 0.00 ATOM 2860 2C31 POP 23 70.320 50.480 51.860 1.00 0.00 ATOM 2861 H12X POP 23 70.150 49.640 51.140 1.00 0.00 ATOM 2862 H12Y POP 23 71.280 50.480 52.410 1.00 0.00 ATOM 2863 3C31 POP 23 70.310 51.810 51.110 1.00 0.00 ATOM 2864 H13X POP 23 70.170 52.630 51.850 1.00 0.00 ATOM 2865 H13Y POP 23 69.470 51.820 50.370 1.00 0.00 ATOM 2866 4C31 POP 23 71.620 51.980 50.330 1.00 0.00 ATOM 2867 H14X POP 23 72.480 52.110 51.010 1.00 0.00 ATOM 2868 H14Y POP 23 71.760 51.020 49.790 1.00 0.00 ATOM 2869 5C31 POP 23 71.570 53.090 49.270 1.00 0.00 ATOM 2870 H15X POP 23 70.770 52.950 48.520 1.00 0.00 ATOM 2871 H15Y POP 23 71.280 54.020 49.800 1.00 0.00 ATOM 2872 6C31 POP 23 72.870 53.330 48.510 1.00 0.00 ATOM 2873 H16X POP 23 73.720 53.160 49.210 1.00 0.00 ATOM 2874 H16Y POP 23 72.990 54.360 48.120 1.00 0.00 ATOM 2875 H16Z POP 23 72.990 52.640 47.650 1.00 0.00 ATOM 2876 N POP 24 1.330 30.690 68.990 1.00 0.00 ATOM 2877 HN1 POP 24 1.920 29.840 68.900 1.00 0.00 ATOM 2878 HN2 POP 24 1.660 31.200 69.830 1.00 0.00 ATOM 2879 HN3 POP 24 0.350 30.360 69.060 1.00 0.00 ATOM 2880 C12 POP 24 1.680 31.600 67.830 1.00 0.00 ATOM 2881 H12A POP 24 1.420 32.590 68.270 1.00 0.00 ATOM 2882 H12B POP 24 0.900 31.500 67.050 1.00 0.00 ATOM 2883 C11 POP 24 3.170 31.670 67.470 1.00 0.00 ATOM 2884 H11A POP 24 3.240 32.570 66.820 1.00 0.00 ATOM 2885 H11B POP 24 3.240 30.740 66.870 1.00 0.00 ATOM 2886 P POP 24 5.480 31.580 68.400 1.00 0.00 ATOM 2887 O13 POP 24 6.020 30.530 69.290 1.00 0.00 ATOM 2888 O14 POP 24 5.950 32.910 68.850 1.00 0.00 ATOM 2889 O11 POP 24 5.720 31.170 66.870 1.00 0.00 ATOM 2890 O12 POP 24 3.910 31.650 68.690 1.00 0.00 ATOM 2891 C1 POP 24 6.940 31.700 66.340 1.00 0.00 ATOM 2892 HA POP 24 7.310 31.100 65.480 1.00 0.00 ATOM 2893 HB POP 24 7.700 31.770 67.150 1.00 0.00 ATOM 2894 C2 POP 24 6.810 33.100 65.740 1.00 0.00 ATOM 2895 HS POP 24 6.290 33.680 66.530 1.00 0.00 ATOM 2896 O21 POP 24 5.940 32.980 64.610 1.00 0.00 ATOM 2897 C21 POP 24 5.470 34.180 64.240 1.00 0.00 ATOM 2898 O22 POP 24 5.850 35.190 64.820 1.00 0.00 ATOM 2899 C22 POP 24 4.390 33.970 63.200 1.00 0.00 ATOM 2900 H2R POP 24 3.540 33.410 63.640 1.00 0.00 ATOM 2901 H2S POP 24 4.760 33.160 62.530 1.00 0.00 ATOM 2902 C3 POP 24 8.220 33.570 65.330 1.00 0.00 ATOM 2903 HX POP 24 8.900 32.710 65.490 1.00 0.00 ATOM 2904 HY POP 24 8.590 34.370 66.000 1.00 0.00 ATOM 2905 O31 POP 24 8.300 34.000 63.960 1.00 0.00 ATOM 2906 C31 POP 24 9.340 34.760 63.630 1.00 0.00 ATOM 2907 O32 POP 24 10.140 35.190 64.450 1.00 0.00 ATOM 2908 C32 POP 24 9.350 35.060 62.140 1.00 0.00 ATOM 2909 H2X POP 24 9.630 34.110 61.640 1.00 0.00 ATOM 2910 H2Y POP 24 10.200 35.730 61.930 1.00 0.00 ATOM 2911 C23 POP 24 3.930 35.340 62.690 1.00 0.00 ATOM 2912 H3R POP 24 4.820 35.950 62.440 1.00 0.00 ATOM 2913 H3S POP 24 3.400 35.840 63.530 1.00 0.00 ATOM 2914 C24 POP 24 3.110 35.440 61.400 1.00 0.00 ATOM 2915 H4R POP 24 2.480 36.350 61.370 1.00 0.00 ATOM 2916 H4S POP 24 2.380 34.610 61.340 1.00 0.00 ATOM 2917 C25 POP 24 3.960 35.230 60.140 1.00 0.00 ATOM 2918 H5R POP 24 4.570 34.300 60.110 1.00 0.00 ATOM 2919 H5S POP 24 4.660 36.090 60.060 1.00 0.00 ATOM 2920 C26 POP 24 3.150 35.260 58.840 1.00 0.00 ATOM 2921 H6R POP 24 2.550 36.190 58.750 1.00 0.00 ATOM 2922 H6S POP 24 2.450 34.400 58.950 1.00 0.00 ATOM 2923 C27 POP 24 4.000 35.070 57.580 1.00 0.00 ATOM 2924 H7R POP 24 3.380 34.730 56.720 1.00 0.00 ATOM 2925 H7S POP 24 4.700 34.230 57.800 1.00 0.00 ATOM 2926 C28 POP 24 4.790 36.290 57.130 1.00 0.00 ATOM 2927 H8R POP 24 5.650 36.030 56.470 1.00 0.00 ATOM 2928 H8S POP 24 5.120 36.830 58.040 1.00 0.00 ATOM 2929 C29 POP 24 4.110 37.380 56.350 1.00 0.00 ATOM 2930 H91 POP 24 3.550 38.070 57.000 1.00 0.00 ATOM 2931 0C21 POP 24 4.160 37.600 55.030 1.00 0.00 ATOM 2932 1H10 POP 24 3.480 38.340 54.580 1.00 0.00 ATOM 2933 1C21 POP 24 4.850 36.790 53.960 1.00 0.00 ATOM 2934 H11R POP 24 4.090 36.490 53.200 1.00 0.00 ATOM 2935 H11S POP 24 5.390 35.890 54.320 1.00 0.00 ATOM 2936 2C21 POP 24 5.930 37.700 53.370 1.00 0.00 ATOM 2937 H12R POP 24 6.670 38.200 54.030 1.00 0.00 ATOM 2938 H12S POP 24 5.410 38.560 52.910 1.00 0.00 ATOM 2939 3C21 POP 24 6.700 36.940 52.290 1.00 0.00 ATOM 2940 H13R POP 24 5.950 36.390 51.690 1.00 0.00 ATOM 2941 H13S POP 24 7.390 36.220 52.790 1.00 0.00 ATOM 2942 4C21 POP 24 7.570 37.840 51.420 1.00 0.00 ATOM 2943 H14R POP 24 8.310 38.200 52.170 1.00 0.00 ATOM 2944 H14S POP 24 6.890 38.660 51.110 1.00 0.00 ATOM 2945 5C21 POP 24 8.100 37.020 50.240 1.00 0.00 ATOM 2946 H15R POP 24 7.240 36.630 49.640 1.00 0.00 ATOM 2947 H15S POP 24 8.580 36.110 50.650 1.00 0.00 ATOM 2948 6C21 POP 24 8.860 37.960 49.290 1.00 0.00 ATOM 2949 H16R POP 24 9.900 38.180 49.600 1.00 0.00 ATOM 2950 H16S POP 24 8.350 38.950 49.260 1.00 0.00 ATOM 2951 7C21 POP 24 8.880 37.360 47.890 1.00 0.00 ATOM 2952 H17R POP 24 7.840 37.070 47.600 1.00 0.00 ATOM 2953 H17S POP 24 9.500 36.440 47.890 1.00 0.00 ATOM 2954 8C21 POP 24 9.400 38.440 46.940 1.00 0.00 ATOM 2955 H18R POP 24 10.340 38.860 47.350 1.00 0.00 ATOM 2956 H18S POP 24 8.610 39.220 46.920 1.00 0.00 ATOM 2957 H18T POP 24 9.460 37.970 45.930 1.00 0.00 ATOM 2958 C33 POP 24 8.000 35.660 61.730 1.00 0.00 ATOM 2959 H3X POP 24 7.850 36.590 62.310 1.00 0.00 ATOM 2960 H3Y POP 24 7.150 34.980 61.950 1.00 0.00 ATOM 2961 C34 POP 24 7.970 35.850 60.210 1.00 0.00 ATOM 2962 H4X POP 24 6.940 36.230 60.020 1.00 0.00 ATOM 2963 H4Y POP 24 8.050 34.860 59.710 1.00 0.00 ATOM 2964 C35 POP 24 8.990 36.810 59.590 1.00 0.00 ATOM 2965 H5X POP 24 10.020 36.400 59.640 1.00 0.00 ATOM 2966 H5Y POP 24 8.930 37.630 60.340 1.00 0.00 ATOM 2967 C36 POP 24 8.590 37.480 58.270 1.00 0.00 ATOM 2968 H6X POP 24 9.320 38.290 58.060 1.00 0.00 ATOM 2969 H6Y POP 24 7.580 37.930 58.290 1.00 0.00 ATOM 2970 C37 POP 24 8.620 36.410 57.170 1.00 0.00 ATOM 2971 H7X POP 24 7.760 35.760 57.420 1.00 0.00 ATOM 2972 H7Y POP 24 9.470 35.710 57.320 1.00 0.00 ATOM 2973 C38 POP 24 8.590 36.850 55.710 1.00 0.00 ATOM 2974 H8X POP 24 7.810 37.620 55.550 1.00 0.00 ATOM 2975 H8Y POP 24 8.270 36.020 55.050 1.00 0.00 ATOM 2976 C39 POP 24 9.900 37.280 55.050 1.00 0.00 ATOM 2977 H9X POP 24 9.670 37.500 53.990 1.00 0.00 ATOM 2978 H9Y POP 24 10.710 36.520 55.120 1.00 0.00 ATOM 2979 0C31 POP 24 10.550 38.630 55.350 1.00 0.00 ATOM 2980 H10X POP 24 11.510 38.760 54.810 1.00 0.00 ATOM 2981 H10Y POP 24 10.920 38.580 56.400 1.00 0.00 ATOM 2982 1C31 POP 24 9.800 39.960 55.200 1.00 0.00 ATOM 2983 H11X POP 24 8.960 39.840 55.910 1.00 0.00 ATOM 2984 H11Y POP 24 9.390 40.090 54.170 1.00 0.00 ATOM 2985 2C31 POP 24 10.700 41.160 55.470 1.00 0.00 ATOM 2986 H12X POP 24 10.330 42.060 54.930 1.00 0.00 ATOM 2987 H12Y POP 24 11.670 40.860 55.020 1.00 0.00 ATOM 2988 3C31 POP 24 11.080 41.380 56.940 1.00 0.00 ATOM 2989 H13X POP 24 12.080 40.890 57.030 1.00 0.00 ATOM 2990 H13Y POP 24 10.410 40.760 57.570 1.00 0.00 ATOM 2991 4C31 POP 24 11.200 42.810 57.460 1.00 0.00 ATOM 2992 H14X POP 24 11.990 43.280 56.830 1.00 0.00 ATOM 2993 H14Y POP 24 11.390 42.830 58.560 1.00 0.00 ATOM 2994 5C31 POP 24 9.910 43.610 57.300 1.00 0.00 ATOM 2995 H15X POP 24 9.480 43.470 56.280 1.00 0.00 ATOM 2996 H15Y POP 24 10.270 44.640 57.450 1.00 0.00 ATOM 2997 6C31 POP 24 8.850 43.260 58.340 1.00 0.00 ATOM 2998 H16X POP 24 8.110 44.090 58.440 1.00 0.00 ATOM 2999 H16Y POP 24 9.330 43.110 59.330 1.00 0.00 ATOM 3000 H16Z POP 24 8.380 42.330 57.970 1.00 0.00 ATOM 3001 N POP 25 23.760 34.070 64.900 1.00 0.00 ATOM 3002 HN1 POP 25 23.930 35.020 64.530 1.00 0.00 ATOM 3003 HN2 POP 25 23.830 33.350 64.150 1.00 0.00 ATOM 3004 HN3 POP 25 22.780 34.070 65.260 1.00 0.00 ATOM 3005 C12 POP 25 24.470 33.690 66.180 1.00 0.00 ATOM 3006 H12A POP 25 24.230 32.610 66.330 1.00 0.00 ATOM 3007 H12B POP 25 23.930 34.310 66.920 1.00 0.00 ATOM 3008 C11 POP 25 25.970 33.970 66.030 1.00 0.00 ATOM 3009 H11A POP 25 26.200 33.070 65.420 1.00 0.00 ATOM 3010 H11B POP 25 26.560 33.880 66.970 1.00 0.00 ATOM 3011 P POP 25 27.090 36.160 65.990 1.00 0.00 ATOM 3012 O13 POP 25 28.500 35.700 65.950 1.00 0.00 ATOM 3013 O14 POP 25 26.560 36.550 67.310 1.00 0.00 ATOM 3014 O11 POP 25 26.850 37.450 65.080 1.00 0.00 ATOM 3015 O12 POP 25 26.190 35.100 65.190 1.00 0.00 ATOM 3016 C1 POP 25 25.590 38.070 65.370 1.00 0.00 ATOM 3017 HA POP 25 25.670 38.870 66.140 1.00 0.00 ATOM 3018 HB POP 25 24.840 37.360 65.780 1.00 0.00 ATOM 3019 C2 POP 25 24.850 38.650 64.160 1.00 0.00 ATOM 3020 HS POP 25 23.770 38.530 64.370 1.00 0.00 ATOM 3021 O21 POP 25 25.290 38.140 62.910 1.00 0.00 ATOM 3022 C21 POP 25 24.900 36.880 62.670 1.00 0.00 ATOM 3023 O22 POP 25 24.270 36.200 63.460 1.00 0.00 ATOM 3024 C22 POP 25 25.470 36.480 61.320 1.00 0.00 ATOM 3025 H2R POP 25 25.830 37.380 60.790 1.00 0.00 ATOM 3026 H2S POP 25 24.610 36.050 60.760 1.00 0.00 ATOM 3027 C3 POP 25 24.920 40.190 64.080 1.00 0.00 ATOM 3028 HX POP 25 25.990 40.420 64.230 1.00 0.00 ATOM 3029 HY POP 25 24.280 40.670 64.860 1.00 0.00 ATOM 3030 O31 POP 25 24.500 40.690 62.810 1.00 0.00 ATOM 3031 C31 POP 25 25.400 41.060 61.890 1.00 0.00 ATOM 3032 O32 POP 25 26.600 41.110 62.090 1.00 0.00 ATOM 3033 C32 POP 25 24.640 41.370 60.610 1.00 0.00 ATOM 3034 H2X POP 25 24.250 42.410 60.550 1.00 0.00 ATOM 3035 H2Y POP 25 23.750 40.700 60.550 1.00 0.00 ATOM 3036 C23 POP 25 26.580 35.440 61.470 1.00 0.00 ATOM 3037 H3R POP 25 26.240 34.470 61.880 1.00 0.00 ATOM 3038 H3S POP 25 27.380 35.890 62.100 1.00 0.00 ATOM 3039 C24 POP 25 27.220 35.090 60.120 1.00 0.00 ATOM 3040 H4R POP 25 27.690 36.000 59.700 1.00 0.00 ATOM 3041 H4S POP 25 26.440 34.600 59.490 1.00 0.00 ATOM 3042 C25 POP 25 28.330 34.040 60.200 1.00 0.00 ATOM 3043 H5R POP 25 27.920 33.060 60.520 1.00 0.00 ATOM 3044 H5S POP 25 29.190 34.400 60.810 1.00 0.00 ATOM 3045 C26 POP 25 29.000 33.860 58.830 1.00 0.00 ATOM 3046 H6R POP 25 29.090 34.870 58.370 1.00 0.00 ATOM 3047 H6S POP 25 28.280 33.290 58.200 1.00 0.00 ATOM 3048 C27 POP 25 30.370 33.210 58.930 1.00 0.00 ATOM 3049 H7R POP 25 30.280 32.130 59.190 1.00 0.00 ATOM 3050 H7S POP 25 31.020 33.660 59.720 1.00 0.00 ATOM 3051 C28 POP 25 31.200 33.280 57.640 1.00 0.00 ATOM 3052 H8R POP 25 32.220 32.940 57.910 1.00 0.00 ATOM 3053 H8S POP 25 31.120 34.340 57.320 1.00 0.00 ATOM 3054 C29 POP 25 30.790 32.360 56.530 1.00 0.00 ATOM 3055 H91 POP 25 30.720 31.350 56.970 1.00 0.00 ATOM 3056 0C21 POP 25 30.330 32.540 55.280 1.00 0.00 ATOM 3057 1H10 POP 25 30.130 31.670 54.630 1.00 0.00 ATOM 3058 1C21 POP 25 30.110 33.880 54.630 1.00 0.00 ATOM 3059 H11R POP 25 30.490 34.660 55.320 1.00 0.00 ATOM 3060 H11S POP 25 29.010 33.980 54.590 1.00 0.00 ATOM 3061 2C21 POP 25 30.630 34.180 53.230 1.00 0.00 ATOM 3062 H12R POP 25 31.740 34.150 53.230 1.00 0.00 ATOM 3063 H12S POP 25 30.180 35.160 52.960 1.00 0.00 ATOM 3064 3C21 POP 25 30.180 33.140 52.200 1.00 0.00 ATOM 3065 H13R POP 25 29.120 32.830 52.260 1.00 0.00 ATOM 3066 H13S POP 25 30.750 32.220 52.460 1.00 0.00 ATOM 3067 4C21 POP 25 30.620 33.340 50.740 1.00 0.00 ATOM 3068 H14R POP 25 30.470 32.340 50.290 1.00 0.00 ATOM 3069 H14S POP 25 31.700 33.580 50.770 1.00 0.00 ATOM 3070 5C21 POP 25 29.950 34.430 49.890 1.00 0.00 ATOM 3071 H15R POP 25 30.250 35.420 50.290 1.00 0.00 ATOM 3072 H15S POP 25 28.870 34.180 49.970 1.00 0.00 ATOM 3073 6C21 POP 25 30.490 34.420 48.460 1.00 0.00 ATOM 3074 H16R POP 25 30.320 33.470 47.910 1.00 0.00 ATOM 3075 H16S POP 25 31.590 34.460 48.620 1.00 0.00 ATOM 3076 7C21 POP 25 30.320 35.610 47.520 1.00 0.00 ATOM 3077 H17R POP 25 30.740 36.530 47.990 1.00 0.00 ATOM 3078 H17S POP 25 29.240 35.870 47.550 1.00 0.00 ATOM 3079 8C21 POP 25 30.870 35.490 46.100 1.00 0.00 ATOM 3080 H18R POP 25 30.520 34.550 45.620 1.00 0.00 ATOM 3081 H18S POP 25 31.960 35.310 46.120 1.00 0.00 ATOM 3082 H18T POP 25 30.710 36.370 45.440 1.00 0.00 ATOM 3083 C33 POP 25 25.450 41.110 59.340 1.00 0.00 ATOM 3084 H3X POP 25 25.850 40.080 59.420 1.00 0.00 ATOM 3085 H3Y POP 25 26.220 41.920 59.290 1.00 0.00 ATOM 3086 C34 POP 25 24.630 40.970 58.050 1.00 0.00 ATOM 3087 H4X POP 25 24.130 41.890 57.690 1.00 0.00 ATOM 3088 H4Y POP 25 23.870 40.170 58.190 1.00 0.00 ATOM 3089 C35 POP 25 25.510 40.500 56.890 1.00 0.00 ATOM 3090 H5X POP 25 26.400 41.160 56.740 1.00 0.00 ATOM 3091 H5Y POP 25 24.880 40.430 55.990 1.00 0.00 ATOM 3092 C36 POP 25 26.040 39.080 57.060 1.00 0.00 ATOM 3093 H6X POP 25 25.220 38.440 57.450 1.00 0.00 ATOM 3094 H6Y POP 25 26.880 38.960 57.780 1.00 0.00 ATOM 3095 C37 POP 25 26.600 38.570 55.730 1.00 0.00 ATOM 3096 H7X POP 25 27.340 39.310 55.350 1.00 0.00 ATOM 3097 H7Y POP 25 25.800 38.520 54.960 1.00 0.00 ATOM 3098 C38 POP 25 27.320 37.220 55.820 1.00 0.00 ATOM 3099 H8X POP 25 28.270 37.400 56.360 1.00 0.00 ATOM 3100 H8Y POP 25 27.510 36.830 54.800 1.00 0.00 ATOM 3101 C39 POP 25 26.600 36.040 56.470 1.00 0.00 ATOM 3102 H9X POP 25 26.640 36.100 57.580 1.00 0.00 ATOM 3103 H9Y POP 25 27.350 35.230 56.380 1.00 0.00 ATOM 3104 0C31 POP 25 25.210 35.710 55.940 1.00 0.00 ATOM 3105 H10X POP 25 24.470 36.510 56.170 1.00 0.00 ATOM 3106 H10Y POP 25 24.820 34.810 56.460 1.00 0.00 ATOM 3107 1C31 POP 25 25.160 35.470 54.430 1.00 0.00 ATOM 3108 H11X POP 25 25.450 36.390 53.860 1.00 0.00 ATOM 3109 H11Y POP 25 24.110 35.210 54.200 1.00 0.00 ATOM 3110 2C31 POP 25 26.170 34.440 53.910 1.00 0.00 ATOM 3111 H12X POP 25 27.220 34.790 53.960 1.00 0.00 ATOM 3112 H12Y POP 25 26.000 33.570 54.580 1.00 0.00 ATOM 3113 3C31 POP 25 25.860 34.140 52.440 1.00 0.00 ATOM 3114 H13X POP 25 26.560 34.810 51.910 1.00 0.00 ATOM 3115 H13Y POP 25 24.810 34.370 52.140 1.00 0.00 ATOM 3116 4C31 POP 25 26.220 32.690 52.090 1.00 0.00 ATOM 3117 H14X POP 25 25.640 32.050 52.790 1.00 0.00 ATOM 3118 H14Y POP 25 27.290 32.540 52.330 1.00 0.00 ATOM 3119 5C31 POP 25 25.720 32.400 50.670 1.00 0.00 ATOM 3120 H15X POP 25 26.170 33.200 50.040 1.00 0.00 ATOM 3121 H15Y POP 25 24.620 32.500 50.660 1.00 0.00 ATOM 3122 6C31 POP 25 26.100 31.000 50.200 1.00 0.00 ATOM 3123 H16X POP 25 27.200 30.950 50.320 1.00 0.00 ATOM 3124 H16Y POP 25 25.910 30.900 49.110 1.00 0.00 ATOM 3125 H16Z POP 25 25.680 30.150 50.790 1.00 0.00 ATOM 3126 N POP 26 10.680 12.680 65.210 1.00 0.00 ATOM 3127 HN1 POP 26 10.860 13.620 64.800 1.00 0.00 ATOM 3128 HN2 POP 26 11.490 12.340 65.770 1.00 0.00 ATOM 3129 HN3 POP 26 10.450 11.990 64.460 1.00 0.00 ATOM 3130 C12 POP 26 9.470 12.870 66.090 1.00 0.00 ATOM 3131 H12A POP 26 9.720 13.740 66.730 1.00 0.00 ATOM 3132 H12B POP 26 9.250 11.930 66.640 1.00 0.00 ATOM 3133 C11 POP 26 8.240 13.100 65.220 1.00 0.00 ATOM 3134 H11A POP 26 7.340 13.120 65.880 1.00 0.00 ATOM 3135 H11B POP 26 8.060 12.200 64.590 1.00 0.00 ATOM 3136 P POP 26 7.430 14.560 63.210 1.00 0.00 ATOM 3137 O13 POP 26 6.010 14.220 63.460 1.00 0.00 ATOM 3138 O14 POP 26 7.620 15.950 62.730 1.00 0.00 ATOM 3139 O11 POP 26 8.070 13.500 62.190 1.00 0.00 ATOM 3140 O12 POP 26 8.340 14.330 64.500 1.00 0.00 ATOM 3141 C1 POP 26 9.480 13.550 61.950 1.00 0.00 ATOM 3142 HA POP 26 9.840 12.570 61.580 1.00 0.00 ATOM 3143 HB POP 26 10.070 13.900 62.820 1.00 0.00 ATOM 3144 C2 POP 26 9.740 14.580 60.840 1.00 0.00 ATOM 3145 HS POP 26 9.470 15.560 61.290 1.00 0.00 ATOM 3146 O21 POP 26 8.850 14.310 59.750 1.00 0.00 ATOM 3147 C21 POP 26 8.830 15.390 58.960 1.00 0.00 ATOM 3148 O22 POP 26 9.290 16.490 59.220 1.00 0.00 ATOM 3149 C22 POP 26 7.870 15.190 57.800 1.00 0.00 ATOM 3150 H2R POP 26 7.650 14.100 57.750 1.00 0.00 ATOM 3151 H2S POP 26 8.330 15.510 56.840 1.00 0.00 ATOM 3152 C3 POP 26 11.200 14.460 60.370 1.00 0.00 ATOM 3153 HX POP 26 11.880 14.550 61.240 1.00 0.00 ATOM 3154 HY POP 26 11.480 15.350 59.760 1.00 0.00 ATOM 3155 O31 POP 26 11.450 13.160 59.830 1.00 0.00 ATOM 3156 C31 POP 26 11.520 13.110 58.500 1.00 0.00 ATOM 3157 O32 POP 26 11.110 14.040 57.830 1.00 0.00 ATOM 3158 C32 POP 26 12.070 11.790 57.980 1.00 0.00 ATOM 3159 H2X POP 26 11.260 11.040 57.880 1.00 0.00 ATOM 3160 H2Y POP 26 12.680 11.330 58.780 1.00 0.00 ATOM 3161 C23 POP 26 6.650 16.090 58.020 1.00 0.00 ATOM 3162 H3R POP 26 6.960 17.150 58.130 1.00 0.00 ATOM 3163 H3S POP 26 6.090 15.820 58.940 1.00 0.00 ATOM 3164 C24 POP 26 5.600 16.300 56.930 1.00 0.00 ATOM 3165 H4R POP 26 6.140 16.960 56.210 1.00 0.00 ATOM 3166 H4S POP 26 4.810 16.930 57.410 1.00 0.00 ATOM 3167 C25 POP 26 5.100 15.110 56.120 1.00 0.00 ATOM 3168 H5R POP 26 4.650 14.450 56.890 1.00 0.00 ATOM 3169 H5S POP 26 6.030 14.600 55.800 1.00 0.00 ATOM 3170 C26 POP 26 4.180 15.440 54.930 1.00 0.00 ATOM 3171 H6R POP 26 3.370 16.140 55.210 1.00 0.00 ATOM 3172 H6S POP 26 3.760 14.520 54.480 1.00 0.00 ATOM 3173 C27 POP 26 4.860 16.200 53.790 1.00 0.00 ATOM 3174 H7R POP 26 5.070 17.260 54.040 1.00 0.00 ATOM 3175 H7S POP 26 4.090 16.130 52.990 1.00 0.00 ATOM 3176 C28 POP 26 6.110 15.470 53.300 1.00 0.00 ATOM 3177 H8R POP 26 5.780 14.430 53.080 1.00 0.00 ATOM 3178 H8S POP 26 6.870 15.430 54.110 1.00 0.00 ATOM 3179 C29 POP 26 6.670 16.140 52.080 1.00 0.00 ATOM 3180 H91 POP 26 6.670 17.240 52.090 1.00 0.00 ATOM 3181 0C21 POP 26 7.030 15.570 50.930 1.00 0.00 ATOM 3182 1H10 POP 26 7.480 16.160 50.110 1.00 0.00 ATOM 3183 1C21 POP 26 7.150 14.080 50.740 1.00 0.00 ATOM 3184 H11R POP 26 6.830 13.560 51.660 1.00 0.00 ATOM 3185 H11S POP 26 8.240 13.840 50.690 1.00 0.00 ATOM 3186 2C21 POP 26 6.450 13.700 49.430 1.00 0.00 ATOM 3187 H12R POP 26 7.030 14.120 48.580 1.00 0.00 ATOM 3188 H12S POP 26 5.390 14.010 49.540 1.00 0.00 ATOM 3189 3C21 POP 26 6.390 12.200 49.150 1.00 0.00 ATOM 3190 H13R POP 26 5.760 11.980 48.260 1.00 0.00 ATOM 3191 H13S POP 26 5.910 11.710 50.020 1.00 0.00 ATOM 3192 4C21 POP 26 7.740 11.530 48.860 1.00 0.00 ATOM 3193 H14R POP 26 7.620 10.420 48.820 1.00 0.00 ATOM 3194 H14S POP 26 8.510 11.800 49.610 1.00 0.00 ATOM 3195 5C21 POP 26 8.310 11.830 47.480 1.00 0.00 ATOM 3196 H15R POP 26 8.810 12.790 47.690 1.00 0.00 ATOM 3197 H15S POP 26 7.650 11.930 46.580 1.00 0.00 ATOM 3198 6C21 POP 26 9.310 10.830 46.900 1.00 0.00 ATOM 3199 H16R POP 26 8.800 9.850 46.710 1.00 0.00 ATOM 3200 H16S POP 26 10.130 10.720 47.630 1.00 0.00 ATOM 3201 7C21 POP 26 9.870 11.310 45.560 1.00 0.00 ATOM 3202 H17R POP 26 10.280 12.340 45.590 1.00 0.00 ATOM 3203 H17S POP 26 9.150 11.220 44.710 1.00 0.00 ATOM 3204 8C21 POP 26 11.170 10.580 45.240 1.00 0.00 ATOM 3205 H18R POP 26 11.020 9.520 45.550 1.00 0.00 ATOM 3206 H18S POP 26 11.470 10.730 44.180 1.00 0.00 ATOM 3207 H18T POP 26 11.970 11.030 45.860 1.00 0.00 ATOM 3208 C33 POP 26 12.930 12.030 56.730 1.00 0.00 ATOM 3209 H3X POP 26 12.740 13.000 56.240 1.00 0.00 ATOM 3210 H3Y POP 26 12.540 11.320 55.970 1.00 0.00 ATOM 3211 C34 POP 26 14.450 11.810 56.720 1.00 0.00 ATOM 3212 H4X POP 26 14.650 10.930 57.370 1.00 0.00 ATOM 3213 H4Y POP 26 14.950 12.610 57.290 1.00 0.00 ATOM 3214 C35 POP 26 15.050 11.770 55.310 1.00 0.00 ATOM 3215 H5X POP 26 16.140 11.730 55.500 1.00 0.00 ATOM 3216 H5Y POP 26 15.040 12.830 54.950 1.00 0.00 ATOM 3217 C36 POP 26 14.580 10.680 54.350 1.00 0.00 ATOM 3218 H6X POP 26 13.540 10.880 54.020 1.00 0.00 ATOM 3219 H6Y POP 26 14.560 9.680 54.840 1.00 0.00 ATOM 3220 C37 POP 26 15.380 10.490 53.060 1.00 0.00 ATOM 3221 H7X POP 26 15.070 9.580 52.510 1.00 0.00 ATOM 3222 H7Y POP 26 16.460 10.390 53.300 1.00 0.00 ATOM 3223 C38 POP 26 15.430 11.700 52.120 1.00 0.00 ATOM 3224 H8X POP 26 15.630 12.620 52.720 1.00 0.00 ATOM 3225 H8Y POP 26 14.470 11.940 51.610 1.00 0.00 ATOM 3226 C39 POP 26 16.450 11.500 51.000 1.00 0.00 ATOM 3227 H9X POP 26 16.100 10.690 50.320 1.00 0.00 ATOM 3228 H9Y POP 26 17.470 11.280 51.380 1.00 0.00 ATOM 3229 0C31 POP 26 16.620 12.850 50.290 1.00 0.00 ATOM 3230 H10X POP 26 16.690 13.550 51.150 1.00 0.00 ATOM 3231 H10Y POP 26 15.680 13.070 49.730 1.00 0.00 ATOM 3232 1C31 POP 26 17.910 12.940 49.470 1.00 0.00 ATOM 3233 H11X POP 26 18.860 12.890 50.040 1.00 0.00 ATOM 3234 H11Y POP 26 17.830 13.950 49.010 1.00 0.00 ATOM 3235 2C31 POP 26 18.130 11.980 48.300 1.00 0.00 ATOM 3236 H12X POP 26 17.270 11.990 47.590 1.00 0.00 ATOM 3237 H12Y POP 26 18.250 10.940 48.670 1.00 0.00 ATOM 3238 3C31 POP 26 19.370 12.410 47.520 1.00 0.00 ATOM 3239 H13X POP 26 20.240 12.540 48.200 1.00 0.00 ATOM 3240 H13Y POP 26 19.170 13.350 46.970 1.00 0.00 ATOM 3241 4C31 POP 26 19.690 11.310 46.500 1.00 0.00 ATOM 3242 H14X POP 26 18.780 11.250 45.860 1.00 0.00 ATOM 3243 H14Y POP 26 19.660 10.360 47.080 1.00 0.00 ATOM 3244 5C31 POP 26 20.950 11.490 45.660 1.00 0.00 ATOM 3245 H15X POP 26 21.120 10.540 45.120 1.00 0.00 ATOM 3246 H15Y POP 26 21.730 11.610 46.450 1.00 0.00 ATOM 3247 6C31 POP 26 20.880 12.730 44.760 1.00 0.00 ATOM 3248 H16X POP 26 20.610 13.630 45.350 1.00 0.00 ATOM 3249 H16Y POP 26 20.070 12.490 44.040 1.00 0.00 ATOM 3250 H16Z POP 26 21.790 12.860 44.140 1.00 0.00 ATOM 3251 N POP 27 12.870 23.240 68.490 1.00 0.00 ATOM 3252 HN1 POP 27 12.870 24.010 69.180 1.00 0.00 ATOM 3253 HN2 POP 27 13.440 22.420 68.810 1.00 0.00 ATOM 3254 HN3 POP 27 13.370 23.560 67.640 1.00 0.00 ATOM 3255 C12 POP 27 11.470 22.900 68.030 1.00 0.00 ATOM 3256 H12A POP 27 11.050 23.870 67.680 1.00 0.00 ATOM 3257 H12B POP 27 10.870 22.530 68.890 1.00 0.00 ATOM 3258 C11 POP 27 11.580 21.870 66.900 1.00 0.00 ATOM 3259 H11A POP 27 10.680 21.920 66.260 1.00 0.00 ATOM 3260 H11B POP 27 11.640 20.890 67.420 1.00 0.00 ATOM 3261 P POP 27 13.070 21.080 64.990 1.00 0.00 ATOM 3262 O13 POP 27 14.060 20.120 65.530 1.00 0.00 ATOM 3263 O14 POP 27 11.810 20.620 64.380 1.00 0.00 ATOM 3264 O11 POP 27 13.750 21.940 63.820 1.00 0.00 ATOM 3265 O12 POP 27 12.800 22.100 66.190 1.00 0.00 ATOM 3266 C1 POP 27 14.100 23.300 64.040 1.00 0.00 ATOM 3267 HA POP 27 14.940 23.540 63.360 1.00 0.00 ATOM 3268 HB POP 27 14.580 23.420 65.040 1.00 0.00 ATOM 3269 C2 POP 27 12.960 24.310 63.830 1.00 0.00 ATOM 3270 HS POP 27 12.320 24.200 64.730 1.00 0.00 ATOM 3271 O21 POP 27 12.300 23.990 62.610 1.00 0.00 ATOM 3272 C21 POP 27 11.220 24.760 62.440 1.00 0.00 ATOM 3273 O22 POP 27 10.820 25.470 63.350 1.00 0.00 ATOM 3274 C22 POP 27 10.590 24.590 61.070 1.00 0.00 ATOM 3275 H2R POP 27 10.050 23.620 61.060 1.00 0.00 ATOM 3276 H2S POP 27 11.340 24.630 60.250 1.00 0.00 ATOM 3277 C3 POP 27 13.630 25.700 63.780 1.00 0.00 ATOM 3278 HX POP 27 14.460 25.750 64.510 1.00 0.00 ATOM 3279 HY POP 27 12.810 26.360 64.130 1.00 0.00 ATOM 3280 O31 POP 27 14.030 25.970 62.430 1.00 0.00 ATOM 3281 C31 POP 27 14.770 27.070 62.380 1.00 0.00 ATOM 3282 O32 POP 27 15.290 27.570 63.370 1.00 0.00 ATOM 3283 C32 POP 27 15.030 27.550 60.960 1.00 0.00 ATOM 3284 H2X POP 27 14.650 26.780 60.250 1.00 0.00 ATOM 3285 H2Y POP 27 16.120 27.690 60.820 1.00 0.00 ATOM 3286 C23 POP 27 9.610 25.720 60.740 1.00 0.00 ATOM 3287 H3R POP 27 10.320 26.560 60.550 1.00 0.00 ATOM 3288 H3S POP 27 8.940 25.930 61.600 1.00 0.00 ATOM 3289 C24 POP 27 8.750 25.410 59.520 1.00 0.00 ATOM 3290 H4R POP 27 7.960 24.690 59.830 1.00 0.00 ATOM 3291 H4S POP 27 9.440 24.890 58.820 1.00 0.00 ATOM 3292 C25 POP 27 8.250 26.690 58.830 1.00 0.00 ATOM 3293 H5R POP 27 9.200 27.250 58.690 1.00 0.00 ATOM 3294 H5S POP 27 7.560 27.260 59.490 1.00 0.00 ATOM 3295 C26 POP 27 7.580 26.440 57.480 1.00 0.00 ATOM 3296 H6R POP 27 6.580 25.980 57.610 1.00 0.00 ATOM 3297 H6S POP 27 8.230 25.800 56.850 1.00 0.00 ATOM 3298 C27 POP 27 7.320 27.790 56.790 1.00 0.00 ATOM 3299 H7R POP 27 8.200 28.200 56.250 1.00 0.00 ATOM 3300 H7S POP 27 6.980 28.520 57.550 1.00 0.00 ATOM 3301 C28 POP 27 6.250 27.550 55.730 1.00 0.00 ATOM 3302 H8R POP 27 5.250 27.350 56.170 1.00 0.00 ATOM 3303 H8S POP 27 6.490 26.590 55.220 1.00 0.00 ATOM 3304 C29 POP 27 6.210 28.790 54.900 1.00 0.00 ATOM 3305 H91 POP 27 5.630 29.620 55.330 1.00 0.00 ATOM 3306 0C21 POP 27 6.930 29.090 53.800 1.00 0.00 ATOM 3307 1H10 POP 27 6.810 30.040 53.270 1.00 0.00 ATOM 3308 1C21 POP 27 7.950 28.150 53.230 1.00 0.00 ATOM 3309 H11R POP 27 7.970 27.120 53.650 1.00 0.00 ATOM 3310 H11S POP 27 8.960 28.600 53.330 1.00 0.00 ATOM 3311 2C21 POP 27 7.720 27.940 51.730 1.00 0.00 ATOM 3312 H12R POP 27 7.870 28.940 51.270 1.00 0.00 ATOM 3313 H12S POP 27 6.700 27.560 51.530 1.00 0.00 ATOM 3314 3C21 POP 27 8.740 27.000 51.070 1.00 0.00 ATOM 3315 H13R POP 27 8.590 25.980 51.480 1.00 0.00 ATOM 3316 H13S POP 27 9.710 27.380 51.440 1.00 0.00 ATOM 3317 4C21 POP 27 8.780 26.940 49.540 1.00 0.00 ATOM 3318 H14R POP 27 9.700 26.350 49.380 1.00 0.00 ATOM 3319 H14S POP 27 8.860 27.980 49.160 1.00 0.00 ATOM 3320 5C21 POP 27 7.710 26.180 48.750 1.00 0.00 ATOM 3321 H15R POP 27 6.690 26.540 49.020 1.00 0.00 ATOM 3322 H15S POP 27 7.820 25.110 49.020 1.00 0.00 ATOM 3323 6C21 POP 27 7.880 26.400 47.250 1.00 0.00 ATOM 3324 H16R POP 27 8.850 26.000 46.890 1.00 0.00 ATOM 3325 H16S POP 27 7.660 27.490 47.160 1.00 0.00 ATOM 3326 7C21 POP 27 6.810 25.700 46.420 1.00 0.00 ATOM 3327 H17R POP 27 5.850 26.210 46.640 1.00 0.00 ATOM 3328 H17S POP 27 6.770 24.640 46.740 1.00 0.00 ATOM 3329 8C21 POP 27 7.020 25.590 44.910 1.00 0.00 ATOM 3330 H18R POP 27 7.890 24.910 44.780 1.00 0.00 ATOM 3331 H18S POP 27 7.260 26.600 44.530 1.00 0.00 ATOM 3332 H18T POP 27 6.150 25.110 44.400 1.00 0.00 ATOM 3333 C33 POP 27 14.330 28.900 60.850 1.00 0.00 ATOM 3334 H3X POP 27 14.920 29.650 61.430 1.00 0.00 ATOM 3335 H3Y POP 27 13.340 28.880 61.340 1.00 0.00 ATOM 3336 C34 POP 27 14.200 29.380 59.400 1.00 0.00 ATOM 3337 H4X POP 27 14.960 28.910 58.740 1.00 0.00 ATOM 3338 H4Y POP 27 14.200 30.490 59.480 1.00 0.00 ATOM 3339 C35 POP 27 12.870 28.960 58.770 1.00 0.00 ATOM 3340 H5X POP 27 12.020 29.410 59.330 1.00 0.00 ATOM 3341 H5Y POP 27 12.800 27.860 58.820 1.00 0.00 ATOM 3342 C36 POP 27 12.770 29.350 57.300 1.00 0.00 ATOM 3343 H6X POP 27 13.570 28.780 56.770 1.00 0.00 ATOM 3344 H6Y POP 27 12.960 30.450 57.340 1.00 0.00 ATOM 3345 C37 POP 27 11.360 29.150 56.740 1.00 0.00 ATOM 3346 H7X POP 27 10.570 29.410 57.480 1.00 0.00 ATOM 3347 H7Y POP 27 11.260 28.100 56.410 1.00 0.00 ATOM 3348 C38 POP 27 11.150 29.960 55.470 1.00 0.00 ATOM 3349 H8X POP 27 11.060 31.050 55.690 1.00 0.00 ATOM 3350 H8Y POP 27 10.160 29.610 55.110 1.00 0.00 ATOM 3351 C39 POP 27 12.170 29.730 54.350 1.00 0.00 ATOM 3352 H9X POP 27 12.400 28.640 54.250 1.00 0.00 ATOM 3353 H9Y POP 27 13.070 30.300 54.650 1.00 0.00 ATOM 3354 0C31 POP 27 11.700 30.430 53.080 1.00 0.00 ATOM 3355 H10X POP 27 11.310 31.450 53.290 1.00 0.00 ATOM 3356 H10Y POP 27 10.820 29.880 52.680 1.00 0.00 ATOM 3357 1C31 POP 27 12.830 30.610 52.060 1.00 0.00 ATOM 3358 H11X POP 27 13.350 29.670 51.750 1.00 0.00 ATOM 3359 H11Y POP 27 13.640 31.210 52.530 1.00 0.00 ATOM 3360 2C31 POP 27 12.340 31.300 50.790 1.00 0.00 ATOM 3361 H12X POP 27 11.840 32.250 51.070 1.00 0.00 ATOM 3362 H12Y POP 27 11.570 30.710 50.250 1.00 0.00 ATOM 3363 3C31 POP 27 13.500 31.510 49.820 1.00 0.00 ATOM 3364 H13X POP 27 14.460 31.230 50.300 1.00 0.00 ATOM 3365 H13Y POP 27 13.600 32.540 49.400 1.00 0.00 ATOM 3366 4C31 POP 27 13.450 30.500 48.670 1.00 0.00 ATOM 3367 H14X POP 27 12.500 30.490 48.080 1.00 0.00 ATOM 3368 H14Y POP 27 13.460 29.490 49.140 1.00 0.00 ATOM 3369 5C31 POP 27 14.650 30.420 47.730 1.00 0.00 ATOM 3370 H15X POP 27 15.500 30.070 48.350 1.00 0.00 ATOM 3371 H15Y POP 27 14.900 31.470 47.460 1.00 0.00 ATOM 3372 6C31 POP 27 14.450 29.640 46.430 1.00 0.00 ATOM 3373 H16X POP 27 15.470 29.630 45.970 1.00 0.00 ATOM 3374 H16Y POP 27 14.010 28.640 46.600 1.00 0.00 ATOM 3375 H16Z POP 27 13.740 30.090 45.710 1.00 0.00 ATOM 3376 N POP 28 42.090 17.710 64.940 1.00 0.00 ATOM 3377 HN1 POP 28 41.090 17.970 64.850 1.00 0.00 ATOM 3378 HN2 POP 28 42.580 18.130 64.120 1.00 0.00 ATOM 3379 HN3 POP 28 42.260 16.680 64.920 1.00 0.00 ATOM 3380 C12 POP 28 42.610 18.100 66.300 1.00 0.00 ATOM 3381 H12A POP 28 42.250 17.440 67.120 1.00 0.00 ATOM 3382 H12B POP 28 42.090 19.050 66.530 1.00 0.00 ATOM 3383 C11 POP 28 44.140 18.210 66.250 1.00 0.00 ATOM 3384 H11A POP 28 44.410 18.400 67.310 1.00 0.00 ATOM 3385 H11B POP 28 44.310 19.110 65.630 1.00 0.00 ATOM 3386 P POP 28 46.290 17.010 65.860 1.00 0.00 ATOM 3387 O13 POP 28 46.790 15.880 65.050 1.00 0.00 ATOM 3388 O14 POP 28 46.610 17.050 67.300 1.00 0.00 ATOM 3389 O11 POP 28 46.690 18.410 65.190 1.00 0.00 ATOM 3390 O12 POP 28 44.690 16.990 65.750 1.00 0.00 ATOM 3391 C1 POP 28 47.880 19.120 65.560 1.00 0.00 ATOM 3392 HA POP 28 48.330 18.610 66.440 1.00 0.00 ATOM 3393 HB POP 28 47.730 20.130 65.990 1.00 0.00 ATOM 3394 C2 POP 28 48.840 19.220 64.370 1.00 0.00 ATOM 3395 HS POP 28 49.540 20.080 64.440 1.00 0.00 ATOM 3396 O21 POP 28 48.080 19.230 63.160 1.00 0.00 ATOM 3397 C21 POP 28 47.750 20.500 62.930 1.00 0.00 ATOM 3398 O22 POP 28 48.240 21.490 63.440 1.00 0.00 ATOM 3399 C22 POP 28 46.980 20.570 61.610 1.00 0.00 ATOM 3400 H2R POP 28 45.890 20.760 61.660 1.00 0.00 ATOM 3401 H2S POP 28 46.980 19.580 61.110 1.00 0.00 ATOM 3402 C3 POP 28 49.730 17.960 64.380 1.00 0.00 ATOM 3403 HX POP 28 49.070 17.070 64.450 1.00 0.00 ATOM 3404 HY POP 28 50.350 18.050 65.300 1.00 0.00 ATOM 3405 O31 POP 28 50.740 17.920 63.370 1.00 0.00 ATOM 3406 C31 POP 28 50.440 17.110 62.350 1.00 0.00 ATOM 3407 O32 POP 28 49.400 16.480 62.300 1.00 0.00 ATOM 3408 C32 POP 28 51.510 17.210 61.260 1.00 0.00 ATOM 3409 H2X POP 28 51.720 16.170 60.920 1.00 0.00 ATOM 3410 H2Y POP 28 52.480 17.640 61.580 1.00 0.00 ATOM 3411 C23 POP 28 47.610 21.680 60.760 1.00 0.00 ATOM 3412 H3R POP 28 48.700 21.470 60.770 1.00 0.00 ATOM 3413 H3S POP 28 47.380 22.720 61.090 1.00 0.00 ATOM 3414 C24 POP 28 47.210 21.490 59.300 1.00 0.00 ATOM 3415 H4R POP 28 46.170 21.810 59.070 1.00 0.00 ATOM 3416 H4S POP 28 47.480 20.460 58.980 1.00 0.00 ATOM 3417 C25 POP 28 48.000 22.480 58.430 1.00 0.00 ATOM 3418 H5R POP 28 47.620 22.270 57.400 1.00 0.00 ATOM 3419 H5S POP 28 49.080 22.250 58.310 1.00 0.00 ATOM 3420 C26 POP 28 47.600 23.910 58.770 1.00 0.00 ATOM 3421 H6R POP 28 47.980 24.180 59.780 1.00 0.00 ATOM 3422 H6S POP 28 46.520 24.070 58.960 1.00 0.00 ATOM 3423 C27 POP 28 47.920 25.080 57.830 1.00 0.00 ATOM 3424 H7R POP 28 48.970 25.410 57.980 1.00 0.00 ATOM 3425 H7S POP 28 47.400 26.010 58.140 1.00 0.00 ATOM 3426 C28 POP 28 47.600 24.770 56.360 1.00 0.00 ATOM 3427 H8R POP 28 46.590 24.300 56.310 1.00 0.00 ATOM 3428 H8S POP 28 48.350 24.040 56.000 1.00 0.00 ATOM 3429 C29 POP 28 47.770 26.050 55.600 1.00 0.00 ATOM 3430 H91 POP 28 48.660 26.580 55.960 1.00 0.00 ATOM 3431 0C21 POP 28 46.980 26.640 54.690 1.00 0.00 ATOM 3432 1H10 POP 28 47.340 27.540 54.170 1.00 0.00 ATOM 3433 1C21 POP 28 45.680 26.080 54.200 1.00 0.00 ATOM 3434 H11R POP 28 44.860 26.670 54.660 1.00 0.00 ATOM 3435 H11S POP 28 45.580 25.050 54.580 1.00 0.00 ATOM 3436 2C21 POP 28 45.510 26.360 52.710 1.00 0.00 ATOM 3437 H12R POP 28 46.190 25.810 52.030 1.00 0.00 ATOM 3438 H12S POP 28 45.670 27.420 52.400 1.00 0.00 ATOM 3439 3C21 POP 28 44.050 26.050 52.370 1.00 0.00 ATOM 3440 H13R POP 28 43.400 26.680 53.010 1.00 0.00 ATOM 3441 H13S POP 28 43.850 24.980 52.570 1.00 0.00 ATOM 3442 4C21 POP 28 43.580 26.330 50.940 1.00 0.00 ATOM 3443 H14R POP 28 42.550 26.040 50.640 1.00 0.00 ATOM 3444 H14S POP 28 44.300 25.690 50.380 1.00 0.00 ATOM 3445 5C21 POP 28 43.770 27.770 50.470 1.00 0.00 ATOM 3446 H15R POP 28 44.770 28.140 50.790 1.00 0.00 ATOM 3447 H15S POP 28 43.030 28.420 50.980 1.00 0.00 ATOM 3448 6C21 POP 28 43.400 28.020 49.000 1.00 0.00 ATOM 3449 H16R POP 28 43.290 29.110 48.840 1.00 0.00 ATOM 3450 H16S POP 28 42.380 27.620 48.840 1.00 0.00 ATOM 3451 7C21 POP 28 44.260 27.410 47.890 1.00 0.00 ATOM 3452 H17R POP 28 43.970 26.350 47.750 1.00 0.00 ATOM 3453 H17S POP 28 45.350 27.370 48.130 1.00 0.00 ATOM 3454 8C21 POP 28 44.220 28.020 46.490 1.00 0.00 ATOM 3455 H18R POP 28 43.230 27.720 46.070 1.00 0.00 ATOM 3456 H18S POP 28 45.080 27.600 45.940 1.00 0.00 ATOM 3457 H18T POP 28 44.240 29.120 46.670 1.00 0.00 ATOM 3458 C33 POP 28 50.960 18.290 60.330 1.00 0.00 ATOM 3459 H3X POP 28 51.010 19.360 60.590 1.00 0.00 ATOM 3460 H3Y POP 28 49.920 17.990 60.080 1.00 0.00 ATOM 3461 C34 POP 28 51.710 18.110 59.010 1.00 0.00 ATOM 3462 H4X POP 28 51.420 17.150 58.530 1.00 0.00 ATOM 3463 H4Y POP 28 52.790 17.980 59.260 1.00 0.00 ATOM 3464 C35 POP 28 51.610 19.190 57.930 1.00 0.00 ATOM 3465 H5X POP 28 52.600 19.190 57.410 1.00 0.00 ATOM 3466 H5Y POP 28 51.480 20.240 58.270 1.00 0.00 ATOM 3467 C36 POP 28 50.530 18.930 56.880 1.00 0.00 ATOM 3468 H6X POP 28 49.640 18.870 57.550 1.00 0.00 ATOM 3469 H6Y POP 28 50.690 17.930 56.430 1.00 0.00 ATOM 3470 C37 POP 28 50.360 20.010 55.820 1.00 0.00 ATOM 3471 H7X POP 28 51.190 19.910 55.090 1.00 0.00 ATOM 3472 H7Y POP 28 50.580 21.030 56.200 1.00 0.00 ATOM 3473 C38 POP 28 49.030 19.950 55.060 1.00 0.00 ATOM 3474 H8X POP 28 48.130 19.970 55.710 1.00 0.00 ATOM 3475 H8Y POP 28 48.940 19.010 54.470 1.00 0.00 ATOM 3476 C39 POP 28 48.800 21.150 54.140 1.00 0.00 ATOM 3477 H9X POP 28 48.860 22.120 54.680 1.00 0.00 ATOM 3478 H9Y POP 28 47.790 21.000 53.710 1.00 0.00 ATOM 3479 0C31 POP 28 49.800 21.130 52.970 1.00 0.00 ATOM 3480 H10X POP 28 49.560 20.210 52.400 1.00 0.00 ATOM 3481 H10Y POP 28 50.790 21.160 53.470 1.00 0.00 ATOM 3482 1C31 POP 28 49.740 22.320 52.010 1.00 0.00 ATOM 3483 H11X POP 28 48.880 22.170 51.330 1.00 0.00 ATOM 3484 H11Y POP 28 50.630 22.140 51.370 1.00 0.00 ATOM 3485 2C31 POP 28 49.770 23.720 52.620 1.00 0.00 ATOM 3486 H12X POP 28 50.290 23.590 53.600 1.00 0.00 ATOM 3487 H12Y POP 28 48.700 23.990 52.750 1.00 0.00 ATOM 3488 3C31 POP 28 50.520 24.810 51.850 1.00 0.00 ATOM 3489 H13X POP 28 50.400 24.580 50.770 1.00 0.00 ATOM 3490 H13Y POP 28 51.560 24.620 52.190 1.00 0.00 ATOM 3491 4C31 POP 28 49.970 26.220 52.060 1.00 0.00 ATOM 3492 H14X POP 28 50.020 26.410 53.160 1.00 0.00 ATOM 3493 H14Y POP 28 48.880 26.200 51.840 1.00 0.00 ATOM 3494 5C31 POP 28 50.720 27.340 51.350 1.00 0.00 ATOM 3495 H15X POP 28 51.790 27.120 51.550 1.00 0.00 ATOM 3496 H15Y POP 28 50.690 28.290 51.940 1.00 0.00 ATOM 3497 6C31 POP 28 50.400 27.520 49.870 1.00 0.00 ATOM 3498 H16X POP 28 50.120 26.580 49.350 1.00 0.00 ATOM 3499 H16Y POP 28 51.190 28.020 49.270 1.00 0.00 ATOM 3500 H16Z POP 28 49.490 28.160 49.790 1.00 0.00 ATOM 3501 N POP 29 8.740 41.950 67.170 1.00 0.00 ATOM 3502 HN1 POP 29 8.420 41.010 66.880 1.00 0.00 ATOM 3503 HN2 POP 29 8.790 42.660 66.410 1.00 0.00 ATOM 3504 HN3 POP 29 9.680 41.900 67.630 1.00 0.00 ATOM 3505 C12 POP 29 7.890 42.510 68.290 1.00 0.00 ATOM 3506 H12A POP 29 8.350 43.500 68.490 1.00 0.00 ATOM 3507 H12B POP 29 8.020 41.850 69.170 1.00 0.00 ATOM 3508 C11 POP 29 6.400 42.570 67.920 1.00 0.00 ATOM 3509 H11A POP 29 5.950 43.410 68.500 1.00 0.00 ATOM 3510 H11B POP 29 5.950 41.560 68.030 1.00 0.00 ATOM 3511 P POP 29 4.970 42.920 65.670 1.00 0.00 ATOM 3512 O13 POP 29 4.500 41.510 65.680 1.00 0.00 ATOM 3513 O14 POP 29 4.040 44.020 66.010 1.00 0.00 ATOM 3514 O11 POP 29 5.520 43.220 64.200 1.00 0.00 ATOM 3515 O12 POP 29 6.290 43.040 66.580 1.00 0.00 ATOM 3516 C1 POP 29 6.050 44.500 63.870 1.00 0.00 ATOM 3517 HA POP 29 6.970 44.300 63.270 1.00 0.00 ATOM 3518 HB POP 29 6.500 45.110 64.690 1.00 0.00 ATOM 3519 C2 POP 29 5.160 45.290 62.890 1.00 0.00 ATOM 3520 HS POP 29 4.130 45.280 63.310 1.00 0.00 ATOM 3521 O21 POP 29 5.240 44.760 61.570 1.00 0.00 ATOM 3522 C21 POP 29 4.200 44.950 60.760 1.00 0.00 ATOM 3523 O22 POP 29 3.260 45.670 61.070 1.00 0.00 ATOM 3524 C22 POP 29 4.380 44.100 59.510 1.00 0.00 ATOM 3525 H2R POP 29 3.550 43.370 59.390 1.00 0.00 ATOM 3526 H2S POP 29 5.320 43.500 59.520 1.00 0.00 ATOM 3527 C3 POP 29 5.680 46.740 62.960 1.00 0.00 ATOM 3528 HX POP 29 5.790 46.930 64.050 1.00 0.00 ATOM 3529 HY POP 29 4.830 47.330 62.550 1.00 0.00 ATOM 3530 O31 POP 29 6.950 46.790 62.320 1.00 0.00 ATOM 3531 C31 POP 29 6.960 47.240 61.060 1.00 0.00 ATOM 3532 O32 POP 29 5.950 47.710 60.560 1.00 0.00 ATOM 3533 C32 POP 29 8.360 47.080 60.490 1.00 0.00 ATOM 3534 H2X POP 29 8.730 46.060 60.740 1.00 0.00 ATOM 3535 H2Y POP 29 9.100 47.770 60.960 1.00 0.00 ATOM 3536 C23 POP 29 4.340 45.030 58.300 1.00 0.00 ATOM 3537 H3R POP 29 4.940 45.910 58.610 1.00 0.00 ATOM 3538 H3S POP 29 3.280 45.330 58.160 1.00 0.00 ATOM 3539 C24 POP 29 4.990 44.370 57.070 1.00 0.00 ATOM 3540 H4R POP 29 4.330 43.560 56.710 1.00 0.00 ATOM 3541 H4S POP 29 5.940 43.900 57.400 1.00 0.00 ATOM 3542 C25 POP 29 5.100 45.470 56.020 1.00 0.00 ATOM 3543 H5R POP 29 5.360 46.360 56.630 1.00 0.00 ATOM 3544 H5S POP 29 4.180 45.660 55.430 1.00 0.00 ATOM 3545 C26 POP 29 6.310 45.280 55.090 1.00 0.00 ATOM 3546 H6R POP 29 6.270 44.260 54.650 1.00 0.00 ATOM 3547 H6S POP 29 7.260 45.200 55.650 1.00 0.00 ATOM 3548 C27 POP 29 6.530 46.380 54.060 1.00 0.00 ATOM 3549 H7R POP 29 7.410 46.080 53.460 1.00 0.00 ATOM 3550 H7S POP 29 6.780 47.350 54.550 1.00 0.00 ATOM 3551 C28 POP 29 5.320 46.740 53.200 1.00 0.00 ATOM 3552 H8R POP 29 5.650 47.630 52.620 1.00 0.00 ATOM 3553 H8S POP 29 4.460 47.020 53.840 1.00 0.00 ATOM 3554 C29 POP 29 4.850 45.580 52.370 1.00 0.00 ATOM 3555 H91 POP 29 4.160 44.900 52.900 1.00 0.00 ATOM 3556 0C21 POP 29 5.100 45.350 51.080 1.00 0.00 ATOM 3557 1H10 POP 29 4.580 44.470 50.660 1.00 0.00 ATOM 3558 1C21 POP 29 5.790 46.290 50.120 1.00 0.00 ATOM 3559 H11R POP 29 6.830 46.030 49.840 1.00 0.00 ATOM 3560 H11S POP 29 5.750 47.300 50.580 1.00 0.00 ATOM 3561 2C21 POP 29 4.950 46.230 48.840 1.00 0.00 ATOM 3562 H12R POP 29 4.000 46.760 49.090 1.00 0.00 ATOM 3563 H12S POP 29 4.750 45.150 48.660 1.00 0.00 ATOM 3564 3C21 POP 29 5.640 46.940 47.680 1.00 0.00 ATOM 3565 H13R POP 29 4.920 47.040 46.840 1.00 0.00 ATOM 3566 H13S POP 29 6.480 46.260 47.410 1.00 0.00 ATOM 3567 4C21 POP 29 6.190 48.340 47.970 1.00 0.00 ATOM 3568 H14R POP 29 6.750 48.400 48.920 1.00 0.00 ATOM 3569 H14S POP 29 5.320 49.020 48.060 1.00 0.00 ATOM 3570 5C21 POP 29 7.100 48.840 46.840 1.00 0.00 ATOM 3571 H15R POP 29 7.180 49.940 46.760 1.00 0.00 ATOM 3572 H15S POP 29 6.590 48.570 45.890 1.00 0.00 ATOM 3573 6C21 POP 29 8.500 48.230 46.830 1.00 0.00 ATOM 3574 H16R POP 29 8.400 47.180 46.510 1.00 0.00 ATOM 3575 H16S POP 29 8.880 48.290 47.880 1.00 0.00 ATOM 3576 7C21 POP 29 9.550 49.000 46.020 1.00 0.00 ATOM 3577 H17R POP 29 9.220 49.000 44.960 1.00 0.00 ATOM 3578 H17S POP 29 10.490 48.440 46.210 1.00 0.00 ATOM 3579 8C21 POP 29 9.700 50.450 46.450 1.00 0.00 ATOM 3580 H18R POP 29 10.140 50.520 47.470 1.00 0.00 ATOM 3581 H18S POP 29 8.730 50.970 46.360 1.00 0.00 ATOM 3582 H18T POP 29 10.400 51.030 45.810 1.00 0.00 ATOM 3583 C33 POP 29 8.270 47.200 58.970 1.00 0.00 ATOM 3584 H3X POP 29 7.650 48.100 58.790 1.00 0.00 ATOM 3585 H3Y POP 29 7.790 46.330 58.460 1.00 0.00 ATOM 3586 C34 POP 29 9.580 47.540 58.260 1.00 0.00 ATOM 3587 H4X POP 29 10.240 46.660 58.400 1.00 0.00 ATOM 3588 H4Y POP 29 9.950 48.370 58.890 1.00 0.00 ATOM 3589 C35 POP 29 9.390 47.890 56.780 1.00 0.00 ATOM 3590 H5X POP 29 8.780 48.820 56.730 1.00 0.00 ATOM 3591 H5Y POP 29 8.880 47.010 56.340 1.00 0.00 ATOM 3592 C36 POP 29 10.740 48.080 56.090 1.00 0.00 ATOM 3593 H6X POP 29 11.460 48.560 56.780 1.00 0.00 ATOM 3594 H6Y POP 29 10.500 48.670 55.190 1.00 0.00 ATOM 3595 C37 POP 29 11.340 46.710 55.750 1.00 0.00 ATOM 3596 H7X POP 29 10.590 46.000 55.340 1.00 0.00 ATOM 3597 H7Y POP 29 11.670 46.240 56.710 1.00 0.00 ATOM 3598 C38 POP 29 12.600 46.800 54.900 1.00 0.00 ATOM 3599 H8X POP 29 13.410 47.350 55.430 1.00 0.00 ATOM 3600 H8Y POP 29 12.370 47.200 53.880 1.00 0.00 ATOM 3601 C39 POP 29 13.360 45.490 54.660 1.00 0.00 ATOM 3602 H9X POP 29 13.730 45.040 55.610 1.00 0.00 ATOM 3603 H9Y POP 29 14.260 45.620 54.020 1.00 0.00 ATOM 3604 0C31 POP 29 12.640 44.380 53.910 1.00 0.00 ATOM 3605 H10X POP 29 12.250 44.800 52.950 1.00 0.00 ATOM 3606 H10Y POP 29 11.810 44.030 54.570 1.00 0.00 ATOM 3607 1C31 POP 29 13.520 43.150 53.670 1.00 0.00 ATOM 3608 H11X POP 29 13.850 42.710 54.630 1.00 0.00 ATOM 3609 H11Y POP 29 14.410 43.530 53.120 1.00 0.00 ATOM 3610 2C31 POP 29 12.880 42.080 52.780 1.00 0.00 ATOM 3611 H12X POP 29 12.770 42.390 51.720 1.00 0.00 ATOM 3612 H12Y POP 29 11.850 41.780 53.070 1.00 0.00 ATOM 3613 3C31 POP 29 13.770 40.850 52.630 1.00 0.00 ATOM 3614 H13X POP 29 13.950 40.420 53.640 1.00 0.00 ATOM 3615 H13Y POP 29 14.760 41.180 52.240 1.00 0.00 ATOM 3616 4C31 POP 29 13.030 39.690 51.950 1.00 0.00 ATOM 3617 H14X POP 29 12.020 39.600 52.380 1.00 0.00 ATOM 3618 H14Y POP 29 13.750 38.870 52.140 1.00 0.00 ATOM 3619 5C31 POP 29 12.950 39.720 50.420 1.00 0.00 ATOM 3620 H15X POP 29 12.400 40.620 50.100 1.00 0.00 ATOM 3621 H15Y POP 29 12.460 38.800 50.040 1.00 0.00 ATOM 3622 6C31 POP 29 14.250 39.740 49.620 1.00 0.00 ATOM 3623 H16X POP 29 14.070 39.400 48.580 1.00 0.00 ATOM 3624 H16Y POP 29 15.020 39.160 50.180 1.00 0.00 ATOM 3625 H16Z POP 29 14.640 40.780 49.510 1.00 0.00 ATOM 3626 N POP 30 34.920 4.750 66.000 1.00 0.00 ATOM 3627 HN1 POP 30 35.320 3.790 66.020 1.00 0.00 ATOM 3628 HN2 POP 30 34.740 4.820 64.980 1.00 0.00 ATOM 3629 HN3 POP 30 35.710 5.380 66.250 1.00 0.00 ATOM 3630 C12 POP 30 33.760 4.820 66.960 1.00 0.00 ATOM 3631 H12A POP 30 34.220 4.890 67.970 1.00 0.00 ATOM 3632 H12B POP 30 33.140 3.910 66.830 1.00 0.00 ATOM 3633 C11 POP 30 32.800 5.930 66.540 1.00 0.00 ATOM 3634 H11A POP 30 33.330 6.900 66.590 1.00 0.00 ATOM 3635 H11B POP 30 31.990 5.840 67.300 1.00 0.00 ATOM 3636 P POP 30 31.550 7.050 64.610 1.00 0.00 ATOM 3637 O13 POP 30 32.480 7.980 63.930 1.00 0.00 ATOM 3638 O14 POP 30 30.680 7.630 65.660 1.00 0.00 ATOM 3639 O11 POP 30 30.650 6.410 63.450 1.00 0.00 ATOM 3640 O12 POP 30 32.320 5.780 65.200 1.00 0.00 ATOM 3641 C1 POP 30 30.250 5.060 63.700 1.00 0.00 ATOM 3642 HA POP 30 29.840 4.960 64.730 1.00 0.00 ATOM 3643 HB POP 30 31.150 4.420 63.580 1.00 0.00 ATOM 3644 C2 POP 30 29.240 4.490 62.700 1.00 0.00 ATOM 3645 HS POP 30 29.360 3.380 62.680 1.00 0.00 ATOM 3646 O21 POP 30 29.430 4.910 61.350 1.00 0.00 ATOM 3647 C21 POP 30 30.150 4.110 60.560 1.00 0.00 ATOM 3648 O22 POP 30 30.590 3.020 60.890 1.00 0.00 ATOM 3649 C22 POP 30 30.460 4.780 59.230 1.00 0.00 ATOM 3650 H2R POP 30 31.520 5.100 59.330 1.00 0.00 ATOM 3651 H2S POP 30 29.890 5.700 58.980 1.00 0.00 ATOM 3652 C3 POP 30 27.840 5.030 63.060 1.00 0.00 ATOM 3653 HX POP 30 27.840 6.130 62.960 1.00 0.00 ATOM 3654 HY POP 30 27.640 4.680 64.090 1.00 0.00 ATOM 3655 O31 POP 30 26.810 4.630 62.160 1.00 0.00 ATOM 3656 C31 POP 30 26.300 3.410 62.340 1.00 0.00 ATOM 3657 O32 POP 30 26.550 2.680 63.290 1.00 0.00 ATOM 3658 C32 POP 30 25.360 3.010 61.210 1.00 0.00 ATOM 3659 H2X POP 30 24.670 3.850 60.970 1.00 0.00 ATOM 3660 H2Y POP 30 24.800 2.100 61.520 1.00 0.00 ATOM 3661 C23 POP 30 30.310 3.690 58.160 1.00 0.00 ATOM 3662 H3R POP 30 29.340 3.160 58.250 1.00 0.00 ATOM 3663 H3S POP 30 31.040 2.900 58.450 1.00 0.00 ATOM 3664 C24 POP 30 30.590 4.170 56.730 1.00 0.00 ATOM 3665 H4R POP 30 29.830 4.930 56.450 1.00 0.00 ATOM 3666 H4S POP 30 30.450 3.340 56.000 1.00 0.00 ATOM 3667 C25 POP 30 31.960 4.820 56.540 1.00 0.00 ATOM 3668 H5R POP 30 32.710 4.220 57.100 1.00 0.00 ATOM 3669 H5S POP 30 31.980 5.840 56.960 1.00 0.00 ATOM 3670 C26 POP 30 32.260 4.830 55.040 1.00 0.00 ATOM 3671 H6R POP 30 32.260 3.820 54.560 1.00 0.00 ATOM 3672 H6S POP 30 33.290 5.220 54.920 1.00 0.00 ATOM 3673 C27 POP 30 31.430 5.740 54.140 1.00 0.00 ATOM 3674 H7R POP 30 31.260 6.730 54.610 1.00 0.00 ATOM 3675 H7S POP 30 30.450 5.240 54.010 1.00 0.00 ATOM 3676 C28 POP 30 32.140 6.020 52.810 1.00 0.00 ATOM 3677 H8R POP 30 32.920 6.730 53.130 1.00 0.00 ATOM 3678 H8S POP 30 31.480 6.610 52.130 1.00 0.00 ATOM 3679 C29 POP 30 32.780 4.810 52.200 1.00 0.00 ATOM 3680 H91 POP 30 33.450 4.220 52.840 1.00 0.00 ATOM 3681 0C21 POP 30 32.680 4.360 50.940 1.00 0.00 ATOM 3682 1H10 POP 30 33.250 3.460 50.660 1.00 0.00 ATOM 3683 1C21 POP 30 31.680 4.840 49.920 1.00 0.00 ATOM 3684 H11R POP 30 30.920 5.580 50.240 1.00 0.00 ATOM 3685 H11S POP 30 31.140 4.000 49.450 1.00 0.00 ATOM 3686 2C21 POP 30 32.360 5.520 48.730 1.00 0.00 ATOM 3687 H12R POP 30 33.350 5.040 48.560 1.00 0.00 ATOM 3688 H12S POP 30 32.430 6.630 48.730 1.00 0.00 ATOM 3689 3C21 POP 30 31.420 5.440 47.530 1.00 0.00 ATOM 3690 H13R POP 30 30.470 5.920 47.860 1.00 0.00 ATOM 3691 H13S POP 30 31.220 4.360 47.380 1.00 0.00 ATOM 3692 4C21 POP 30 31.920 6.010 46.200 1.00 0.00 ATOM 3693 H14R POP 30 32.690 5.220 46.070 1.00 0.00 ATOM 3694 H14S POP 30 32.230 7.070 46.230 1.00 0.00 ATOM 3695 5C21 POP 30 30.950 5.790 45.030 1.00 0.00 ATOM 3696 H15R POP 30 30.770 4.700 44.910 1.00 0.00 ATOM 3697 H15S POP 30 31.440 6.130 44.100 1.00 0.00 ATOM 3698 6C21 POP 30 29.610 6.530 45.140 1.00 0.00 ATOM 3699 H16R POP 30 29.720 7.630 45.170 1.00 0.00 ATOM 3700 H16S POP 30 29.130 6.160 46.070 1.00 0.00 ATOM 3701 7C21 POP 30 28.630 6.320 43.980 1.00 0.00 ATOM 3702 H17R POP 30 27.620 5.980 44.290 1.00 0.00 ATOM 3703 H17S POP 30 29.050 5.560 43.290 1.00 0.00 ATOM 3704 8C21 POP 30 28.400 7.550 43.100 1.00 0.00 ATOM 3705 H18R POP 30 28.210 8.490 43.670 1.00 0.00 ATOM 3706 H18S POP 30 27.500 7.350 42.480 1.00 0.00 ATOM 3707 H18T POP 30 29.240 7.670 42.380 1.00 0.00 ATOM 3708 C33 POP 30 26.230 2.630 60.020 1.00 0.00 ATOM 3709 H3X POP 30 26.900 3.480 59.740 1.00 0.00 ATOM 3710 H3Y POP 30 25.610 2.650 59.090 1.00 0.00 ATOM 3711 C34 POP 30 26.920 1.260 60.040 1.00 0.00 ATOM 3712 H4X POP 30 26.380 0.480 60.630 1.00 0.00 ATOM 3713 H4Y POP 30 27.820 1.300 60.690 1.00 0.00 ATOM 3714 C35 POP 30 27.370 0.880 58.630 1.00 0.00 ATOM 3715 H5X POP 30 27.950 1.680 58.130 1.00 0.00 ATOM 3716 H5Y POP 30 26.450 0.700 58.030 1.00 0.00 ATOM 3717 C36 POP 30 28.230 -0.380 58.570 1.00 0.00 ATOM 3718 H6X POP 30 27.700 -1.160 59.150 1.00 0.00 ATOM 3719 H6Y POP 30 29.140 -0.210 59.170 1.00 0.00 ATOM 3720 C37 POP 30 28.540 -0.870 57.150 1.00 0.00 ATOM 3721 H7X POP 30 27.640 -0.930 56.500 1.00 0.00 ATOM 3722 H7Y POP 30 29.070 -1.850 57.160 1.00 0.00 ATOM 3723 C38 POP 30 29.460 0.110 56.410 1.00 0.00 ATOM 3724 H8X POP 30 30.310 0.460 57.030 1.00 0.00 ATOM 3725 H8Y POP 30 28.940 1.030 56.080 1.00 0.00 ATOM 3726 C39 POP 30 29.840 -0.470 55.050 1.00 0.00 ATOM 3727 H9X POP 30 28.910 -0.730 54.480 1.00 0.00 ATOM 3728 H9Y POP 30 30.410 -1.370 55.350 1.00 0.00 ATOM 3729 0C31 POP 30 30.790 0.430 54.250 1.00 0.00 ATOM 3730 H10X POP 30 31.740 0.360 54.810 1.00 0.00 ATOM 3731 H10Y POP 30 30.380 1.450 54.370 1.00 0.00 ATOM 3732 1C31 POP 30 30.880 -0.050 52.800 1.00 0.00 ATOM 3733 H11X POP 30 30.160 0.540 52.200 1.00 0.00 ATOM 3734 H11Y POP 30 30.550 -1.110 52.810 1.00 0.00 ATOM 3735 2C31 POP 30 32.280 -0.110 52.180 1.00 0.00 ATOM 3736 H12X POP 30 32.820 -1.020 52.530 1.00 0.00 ATOM 3737 H12Y POP 30 32.780 0.780 52.610 1.00 0.00 ATOM 3738 3C31 POP 30 32.310 -0.070 50.650 1.00 0.00 ATOM 3739 H13X POP 30 33.350 -0.240 50.270 1.00 0.00 ATOM 3740 H13Y POP 30 31.970 0.910 50.240 1.00 0.00 ATOM 3741 4C31 POP 30 31.350 -1.130 50.110 1.00 0.00 ATOM 3742 H14X POP 30 31.080 -0.870 49.070 1.00 0.00 ATOM 3743 H14Y POP 30 30.410 -1.140 50.710 1.00 0.00 ATOM 3744 5C31 POP 30 32.010 -2.510 49.980 1.00 0.00 ATOM 3745 H15X POP 30 32.320 -2.860 50.990 1.00 0.00 ATOM 3746 H15Y POP 30 32.900 -2.500 49.320 1.00 0.00 ATOM 3747 6C31 POP 30 31.020 -3.590 49.530 1.00 0.00 ATOM 3748 H16X POP 30 30.230 -3.760 50.290 1.00 0.00 ATOM 3749 H16Y POP 30 31.530 -4.570 49.440 1.00 0.00 ATOM 3750 H16Z POP 30 30.650 -3.380 48.510 1.00 0.00 ATOM 3751 N POP 31 12.180 52.320 61.130 1.00 0.00 ATOM 3752 HN1 POP 31 12.180 53.200 60.570 1.00 0.00 ATOM 3753 HN2 POP 31 11.270 52.190 61.600 1.00 0.00 ATOM 3754 HN3 POP 31 12.710 52.440 62.020 1.00 0.00 ATOM 3755 C12 POP 31 12.590 51.030 60.450 1.00 0.00 ATOM 3756 H12A POP 31 13.570 51.200 59.950 1.00 0.00 ATOM 3757 H12B POP 31 11.770 50.840 59.730 1.00 0.00 ATOM 3758 C11 POP 31 12.600 49.850 61.420 1.00 0.00 ATOM 3759 H11A POP 31 12.830 48.990 60.760 1.00 0.00 ATOM 3760 H11B POP 31 11.590 49.740 61.860 1.00 0.00 ATOM 3761 P POP 31 13.900 48.850 63.290 1.00 0.00 ATOM 3762 O13 POP 31 12.620 48.450 63.910 1.00 0.00 ATOM 3763 O14 POP 31 14.990 49.240 64.220 1.00 0.00 ATOM 3764 O11 POP 31 14.400 47.740 62.250 1.00 0.00 ATOM 3765 O12 POP 31 13.600 50.150 62.410 1.00 0.00 ATOM 3766 C1 POP 31 15.750 47.270 62.250 1.00 0.00 ATOM 3767 HA POP 31 15.720 46.190 62.010 1.00 0.00 ATOM 3768 HB POP 31 16.200 47.290 63.270 1.00 0.00 ATOM 3769 C2 POP 31 16.550 48.060 61.210 1.00 0.00 ATOM 3770 HS POP 31 16.720 49.090 61.610 1.00 0.00 ATOM 3771 O21 POP 31 15.850 48.050 59.970 1.00 0.00 ATOM 3772 C21 POP 31 15.870 49.170 59.240 1.00 0.00 ATOM 3773 O22 POP 31 16.450 50.200 59.550 1.00 0.00 ATOM 3774 C22 POP 31 14.910 49.010 58.070 1.00 0.00 ATOM 3775 H2R POP 31 13.860 49.290 58.300 1.00 0.00 ATOM 3776 H2S POP 31 14.970 47.990 57.620 1.00 0.00 ATOM 3777 C3 POP 31 17.960 47.460 61.050 1.00 0.00 ATOM 3778 HX POP 31 17.860 46.400 60.720 1.00 0.00 ATOM 3779 HY POP 31 18.420 47.380 62.060 1.00 0.00 ATOM 3780 O31 POP 31 18.740 48.040 60.000 1.00 0.00 ATOM 3781 C31 POP 31 19.170 49.250 60.330 1.00 0.00 ATOM 3782 O32 POP 31 19.270 49.660 61.480 1.00 0.00 ATOM 3783 C32 POP 31 19.790 49.850 59.080 1.00 0.00 ATOM 3784 H2X POP 31 20.700 50.430 59.340 1.00 0.00 ATOM 3785 H2Y POP 31 19.050 50.450 58.510 1.00 0.00 ATOM 3786 C23 POP 31 15.340 50.050 57.040 1.00 0.00 ATOM 3787 H3R POP 31 15.570 51.010 57.550 1.00 0.00 ATOM 3788 H3S POP 31 14.500 50.260 56.340 1.00 0.00 ATOM 3789 C24 POP 31 16.590 49.630 56.260 1.00 0.00 ATOM 3790 H4R POP 31 17.510 49.720 56.880 1.00 0.00 ATOM 3791 H4S POP 31 16.800 50.440 55.540 1.00 0.00 ATOM 3792 C25 POP 31 16.600 48.250 55.590 1.00 0.00 ATOM 3793 H5R POP 31 15.640 48.250 55.040 1.00 0.00 ATOM 3794 H5S POP 31 16.670 47.420 56.320 1.00 0.00 ATOM 3795 C26 POP 31 17.730 48.170 54.560 1.00 0.00 ATOM 3796 H6R POP 31 18.690 48.120 55.100 1.00 0.00 ATOM 3797 H6S POP 31 17.630 49.070 53.910 1.00 0.00 ATOM 3798 C27 POP 31 17.490 46.990 53.610 1.00 0.00 ATOM 3799 H7R POP 31 17.950 47.180 52.620 1.00 0.00 ATOM 3800 H7S POP 31 16.390 46.910 53.490 1.00 0.00 ATOM 3801 C28 POP 31 17.890 45.600 54.110 1.00 0.00 ATOM 3802 H8R POP 31 17.700 44.890 53.270 1.00 0.00 ATOM 3803 H8S POP 31 17.270 45.280 54.970 1.00 0.00 ATOM 3804 C29 POP 31 19.350 45.590 54.450 1.00 0.00 ATOM 3805 H91 POP 31 19.660 46.250 55.270 1.00 0.00 ATOM 3806 0C21 POP 31 20.330 45.050 53.700 1.00 0.00 ATOM 3807 1H10 POP 31 21.360 45.230 54.030 1.00 0.00 ATOM 3808 1C21 POP 31 20.130 44.270 52.430 1.00 0.00 ATOM 3809 H11R POP 31 19.070 43.960 52.310 1.00 0.00 ATOM 3810 H11S POP 31 20.770 43.360 52.430 1.00 0.00 ATOM 3811 2C21 POP 31 20.670 44.920 51.160 1.00 0.00 ATOM 3812 H12R POP 31 21.760 45.140 51.190 1.00 0.00 ATOM 3813 H12S POP 31 20.270 45.950 51.060 1.00 0.00 ATOM 3814 3C21 POP 31 20.340 44.150 49.870 1.00 0.00 ATOM 3815 H13R POP 31 20.700 43.110 50.040 1.00 0.00 ATOM 3816 H13S POP 31 20.900 44.650 49.050 1.00 0.00 ATOM 3817 4C21 POP 31 18.870 44.170 49.440 1.00 0.00 ATOM 3818 H14R POP 31 18.530 45.220 49.580 1.00 0.00 ATOM 3819 H14S POP 31 18.170 43.540 50.030 1.00 0.00 ATOM 3820 5C21 POP 31 18.600 43.800 47.980 1.00 0.00 ATOM 3821 H15R POP 31 17.500 43.900 47.870 1.00 0.00 ATOM 3822 H15S POP 31 18.850 42.730 47.840 1.00 0.00 ATOM 3823 6C21 POP 31 19.350 44.750 47.050 1.00 0.00 ATOM 3824 H16R POP 31 20.400 44.400 47.030 1.00 0.00 ATOM 3825 H16S POP 31 19.180 45.800 47.370 1.00 0.00 ATOM 3826 7C21 POP 31 18.940 44.640 45.580 1.00 0.00 ATOM 3827 H17R POP 31 17.860 44.880 45.650 1.00 0.00 ATOM 3828 H17S POP 31 19.030 43.640 45.110 1.00 0.00 ATOM 3829 8C21 POP 31 19.640 45.730 44.760 1.00 0.00 ATOM 3830 H18R POP 31 19.210 45.610 43.740 1.00 0.00 ATOM 3831 H18S POP 31 20.710 45.530 44.540 1.00 0.00 ATOM 3832 H18T POP 31 19.460 46.720 45.220 1.00 0.00 ATOM 3833 C33 POP 31 20.360 48.780 58.140 1.00 0.00 ATOM 3834 H3X POP 31 19.530 48.320 57.560 1.00 0.00 ATOM 3835 H3Y POP 31 20.820 47.940 58.700 1.00 0.00 ATOM 3836 C34 POP 31 21.400 49.430 57.220 1.00 0.00 ATOM 3837 H4X POP 31 22.310 49.710 57.800 1.00 0.00 ATOM 3838 H4Y POP 31 20.860 50.290 56.780 1.00 0.00 ATOM 3839 C35 POP 31 21.840 48.450 56.130 1.00 0.00 ATOM 3840 H5X POP 31 20.930 48.150 55.570 1.00 0.00 ATOM 3841 H5Y POP 31 22.230 47.520 56.610 1.00 0.00 ATOM 3842 C36 POP 31 22.920 49.110 55.260 1.00 0.00 ATOM 3843 H6X POP 31 23.880 49.290 55.780 1.00 0.00 ATOM 3844 H6Y POP 31 22.580 50.100 54.890 1.00 0.00 ATOM 3845 C37 POP 31 23.330 48.300 54.030 1.00 0.00 ATOM 3846 H7X POP 31 23.640 47.350 54.510 1.00 0.00 ATOM 3847 H7Y POP 31 24.230 48.770 53.580 1.00 0.00 ATOM 3848 C38 POP 31 22.300 48.080 52.910 1.00 0.00 ATOM 3849 H8X POP 31 21.350 47.740 53.360 1.00 0.00 ATOM 3850 H8Y POP 31 22.730 47.270 52.280 1.00 0.00 ATOM 3851 C39 POP 31 22.050 49.340 52.080 1.00 0.00 ATOM 3852 H9X POP 31 23.080 49.700 51.900 1.00 0.00 ATOM 3853 H9Y POP 31 21.510 50.100 52.690 1.00 0.00 ATOM 3854 0C31 POP 31 21.340 49.190 50.730 1.00 0.00 ATOM 3855 H10X POP 31 21.880 48.470 50.070 1.00 0.00 ATOM 3856 H10Y POP 31 21.540 50.220 50.340 1.00 0.00 ATOM 3857 1C31 POP 31 19.840 48.940 50.890 1.00 0.00 ATOM 3858 H11X POP 31 19.600 49.410 51.870 1.00 0.00 ATOM 3859 H11Y POP 31 19.540 47.880 51.020 1.00 0.00 ATOM 3860 2C31 POP 31 19.110 49.460 49.650 1.00 0.00 ATOM 3861 H12X POP 31 19.620 50.400 49.350 1.00 0.00 ATOM 3862 H12Y POP 31 18.100 49.830 49.930 1.00 0.00 ATOM 3863 3C31 POP 31 19.090 48.490 48.470 1.00 0.00 ATOM 3864 H13X POP 31 18.450 47.670 48.840 1.00 0.00 ATOM 3865 H13Y POP 31 20.060 48.010 48.200 1.00 0.00 ATOM 3866 4C31 POP 31 18.460 49.130 47.230 1.00 0.00 ATOM 3867 H14X POP 31 17.820 49.960 47.590 1.00 0.00 ATOM 3868 H14Y POP 31 17.910 48.380 46.620 1.00 0.00 ATOM 3869 5C31 POP 31 19.470 49.690 46.220 1.00 0.00 ATOM 3870 H15X POP 31 19.880 48.990 45.470 1.00 0.00 ATOM 3871 H15Y POP 31 20.320 50.000 46.860 1.00 0.00 ATOM 3872 6C31 POP 31 18.990 51.000 45.590 1.00 0.00 ATOM 3873 H16X POP 31 18.120 50.770 44.940 1.00 0.00 ATOM 3874 H16Y POP 31 19.770 51.330 44.870 1.00 0.00 ATOM 3875 H16Z POP 31 18.850 51.790 46.370 1.00 0.00 ATOM 3876 N POP 32 46.010 53.200 66.320 1.00 0.00 ATOM 3877 HN1 POP 32 46.530 54.090 66.500 1.00 0.00 ATOM 3878 HN2 POP 32 46.340 52.470 66.980 1.00 0.00 ATOM 3879 HN3 POP 32 46.200 52.900 65.340 1.00 0.00 ATOM 3880 C12 POP 32 44.500 53.250 66.340 1.00 0.00 ATOM 3881 H12A POP 32 44.170 53.810 65.440 1.00 0.00 ATOM 3882 H12B POP 32 44.190 53.900 67.180 1.00 0.00 ATOM 3883 C11 POP 32 43.850 51.880 66.540 1.00 0.00 ATOM 3884 H11A POP 32 42.740 51.960 66.550 1.00 0.00 ATOM 3885 H11B POP 32 44.190 51.500 67.520 1.00 0.00 ATOM 3886 P POP 32 43.710 49.460 65.850 1.00 0.00 ATOM 3887 O13 POP 32 43.540 49.190 67.300 1.00 0.00 ATOM 3888 O14 POP 32 44.450 48.440 65.070 1.00 0.00 ATOM 3889 O11 POP 32 42.280 49.720 65.180 1.00 0.00 ATOM 3890 O12 POP 32 44.320 50.920 65.590 1.00 0.00 ATOM 3891 C1 POP 32 42.060 49.250 63.840 1.00 0.00 ATOM 3892 HA POP 32 40.960 49.310 63.690 1.00 0.00 ATOM 3893 HB POP 32 42.310 48.180 63.700 1.00 0.00 ATOM 3894 C2 POP 32 42.780 50.010 62.710 1.00 0.00 ATOM 3895 HS POP 32 43.800 49.560 62.740 1.00 0.00 ATOM 3896 O21 POP 32 43.050 51.390 62.950 1.00 0.00 ATOM 3897 C21 POP 32 42.070 52.240 63.270 1.00 0.00 ATOM 3898 O22 POP 32 40.970 51.960 63.710 1.00 0.00 ATOM 3899 C22 POP 32 42.660 53.620 63.030 1.00 0.00 ATOM 3900 H2R POP 32 43.690 53.570 62.600 1.00 0.00 ATOM 3901 H2S POP 32 42.730 54.070 64.040 1.00 0.00 ATOM 3902 C3 POP 32 42.220 49.660 61.320 1.00 0.00 ATOM 3903 HX POP 32 41.120 49.770 61.360 1.00 0.00 ATOM 3904 HY POP 32 42.380 48.570 61.170 1.00 0.00 ATOM 3905 O31 POP 32 42.730 50.510 60.290 1.00 0.00 ATOM 3906 C31 POP 32 43.750 50.100 59.530 1.00 0.00 ATOM 3907 O32 POP 32 44.320 49.030 59.630 1.00 0.00 ATOM 3908 C32 POP 32 44.090 51.150 58.490 1.00 0.00 ATOM 3909 H2X POP 32 43.910 52.140 58.960 1.00 0.00 ATOM 3910 H2Y POP 32 43.440 51.040 57.590 1.00 0.00 ATOM 3911 C23 POP 32 41.920 54.570 62.080 1.00 0.00 ATOM 3912 H3R POP 32 42.520 55.490 61.960 1.00 0.00 ATOM 3913 H3S POP 32 40.930 54.820 62.530 1.00 0.00 ATOM 3914 C24 POP 32 41.530 53.900 60.770 1.00 0.00 ATOM 3915 H4R POP 32 40.850 53.060 61.020 1.00 0.00 ATOM 3916 H4S POP 32 42.450 53.560 60.240 1.00 0.00 ATOM 3917 C25 POP 32 40.700 54.770 59.830 1.00 0.00 ATOM 3918 H5R POP 32 41.360 55.600 59.500 1.00 0.00 ATOM 3919 H5S POP 32 39.860 55.200 60.420 1.00 0.00 ATOM 3920 C26 POP 32 40.150 53.960 58.650 1.00 0.00 ATOM 3921 H6R POP 32 39.280 54.540 58.280 1.00 0.00 ATOM 3922 H6S POP 32 39.660 53.040 59.050 1.00 0.00 ATOM 3923 C27 POP 32 41.110 53.700 57.490 1.00 0.00 ATOM 3924 H7R POP 32 42.060 53.200 57.780 1.00 0.00 ATOM 3925 H7S POP 32 41.360 54.710 57.090 1.00 0.00 ATOM 3926 C28 POP 32 40.430 52.780 56.470 1.00 0.00 ATOM 3927 H8R POP 32 39.470 53.300 56.290 1.00 0.00 ATOM 3928 H8S POP 32 40.360 51.720 56.790 1.00 0.00 ATOM 3929 C29 POP 32 41.280 52.780 55.230 1.00 0.00 ATOM 3930 H91 POP 32 42.360 52.700 55.460 1.00 0.00 ATOM 3931 0C21 POP 32 40.860 53.070 53.990 1.00 0.00 ATOM 3932 1H10 POP 32 41.610 53.040 53.190 1.00 0.00 ATOM 3933 1C21 POP 32 39.510 53.300 53.380 1.00 0.00 ATOM 3934 H11R POP 32 39.520 54.220 52.760 1.00 0.00 ATOM 3935 H11S POP 32 38.700 53.460 54.130 1.00 0.00 ATOM 3936 2C21 POP 32 38.990 52.070 52.630 1.00 0.00 ATOM 3937 H12R POP 32 37.950 52.360 52.360 1.00 0.00 ATOM 3938 H12S POP 32 38.810 51.180 53.260 1.00 0.00 ATOM 3939 3C21 POP 32 39.730 51.710 51.340 1.00 0.00 ATOM 3940 H13R POP 32 39.090 50.990 50.780 1.00 0.00 ATOM 3941 H13S POP 32 40.670 51.180 51.590 1.00 0.00 ATOM 3942 4C21 POP 32 40.040 52.800 50.310 1.00 0.00 ATOM 3943 H14R POP 32 40.560 53.560 50.930 1.00 0.00 ATOM 3944 H14S POP 32 39.030 53.130 50.000 1.00 0.00 ATOM 3945 5C21 POP 32 40.880 52.450 49.080 1.00 0.00 ATOM 3946 H15R POP 32 41.790 51.840 49.260 1.00 0.00 ATOM 3947 H15S POP 32 40.210 51.990 48.320 1.00 0.00 ATOM 3948 6C21 POP 32 41.380 53.650 48.270 1.00 0.00 ATOM 3949 H16R POP 32 40.530 54.180 47.780 1.00 0.00 ATOM 3950 H16S POP 32 42.030 53.340 47.430 1.00 0.00 ATOM 3951 7C21 POP 32 42.220 54.620 49.110 1.00 0.00 ATOM 3952 H17R POP 32 42.660 53.970 49.890 1.00 0.00 ATOM 3953 H17S POP 32 41.740 55.490 49.610 1.00 0.00 ATOM 3954 8C21 POP 32 43.370 55.340 48.400 1.00 0.00 ATOM 3955 H18R POP 32 42.950 55.990 47.610 1.00 0.00 ATOM 3956 H18S POP 32 43.930 54.530 47.890 1.00 0.00 ATOM 3957 H18T POP 32 43.990 55.810 49.190 1.00 0.00 ATOM 3958 C33 POP 32 45.540 50.910 58.070 1.00 0.00 ATOM 3959 H3X POP 32 45.510 50.080 57.330 1.00 0.00 ATOM 3960 H3Y POP 32 46.300 50.590 58.810 1.00 0.00 ATOM 3961 C34 POP 32 46.160 52.170 57.450 1.00 0.00 ATOM 3962 H4X POP 32 45.940 53.060 58.070 1.00 0.00 ATOM 3963 H4Y POP 32 45.690 52.370 56.470 1.00 0.00 ATOM 3964 C35 POP 32 47.630 52.190 57.030 1.00 0.00 ATOM 3965 H5X POP 32 48.350 51.980 57.850 1.00 0.00 ATOM 3966 H5Y POP 32 47.880 53.260 56.830 1.00 0.00 ATOM 3967 C36 POP 32 47.890 51.240 55.860 1.00 0.00 ATOM 3968 H6X POP 32 47.290 51.430 54.950 1.00 0.00 ATOM 3969 H6Y POP 32 47.460 50.250 56.130 1.00 0.00 ATOM 3970 C37 POP 32 49.390 51.090 55.600 1.00 0.00 ATOM 3971 H7X POP 32 49.460 50.470 54.680 1.00 0.00 ATOM 3972 H7Y POP 32 49.750 50.550 56.510 1.00 0.00 ATOM 3973 C38 POP 32 50.290 52.300 55.340 1.00 0.00 ATOM 3974 H8X POP 32 50.300 52.850 56.310 1.00 0.00 ATOM 3975 H8Y POP 32 49.820 52.920 54.550 1.00 0.00 ATOM 3976 C39 POP 32 51.740 52.010 54.920 1.00 0.00 ATOM 3977 H9X POP 32 51.610 51.420 53.990 1.00 0.00 ATOM 3978 H9Y POP 32 52.260 51.350 55.640 1.00 0.00 ATOM 3979 0C31 POP 32 52.570 53.260 54.620 1.00 0.00 ATOM 3980 H10X POP 32 52.940 53.690 55.570 1.00 0.00 ATOM 3981 H10Y POP 32 51.900 53.950 54.070 1.00 0.00 ATOM 3982 1C31 POP 32 53.840 52.920 53.820 1.00 0.00 ATOM 3983 H11X POP 32 53.730 52.480 52.810 1.00 0.00 ATOM 3984 H11Y POP 32 54.510 52.190 54.340 1.00 0.00 ATOM 3985 2C31 POP 32 54.810 54.090 53.680 1.00 0.00 ATOM 3986 H12X POP 32 54.980 54.660 54.620 1.00 0.00 ATOM 3987 H12Y POP 32 54.280 54.860 53.080 1.00 0.00 ATOM 3988 3C31 POP 32 56.020 53.860 52.770 1.00 0.00 ATOM 3989 H13X POP 32 56.750 53.230 53.320 1.00 0.00 ATOM 3990 H13Y POP 32 56.450 54.880 52.670 1.00 0.00 ATOM 3991 4C31 POP 32 55.820 53.310 51.350 1.00 0.00 ATOM 3992 H14X POP 32 55.060 53.940 50.860 1.00 0.00 ATOM 3993 H14Y POP 32 55.510 52.240 51.400 1.00 0.00 ATOM 3994 5C31 POP 32 57.090 53.180 50.500 1.00 0.00 ATOM 3995 H15X POP 32 57.750 52.460 51.020 1.00 0.00 ATOM 3996 H15Y POP 32 57.580 54.180 50.410 1.00 0.00 ATOM 3997 6C31 POP 32 56.630 52.620 49.150 1.00 0.00 ATOM 3998 H16X POP 32 56.220 51.590 49.260 1.00 0.00 ATOM 3999 H16Y POP 32 57.420 52.510 48.390 1.00 0.00 ATOM 4000 H16Z POP 32 55.790 53.220 48.740 1.00 0.00 ATOM 4001 N POP 33 30.320 54.820 65.020 1.00 0.00 ATOM 4002 HN1 POP 33 31.100 54.730 64.340 1.00 0.00 ATOM 4003 HN2 POP 33 29.840 53.910 65.180 1.00 0.00 ATOM 4004 HN3 POP 33 29.610 55.430 64.550 1.00 0.00 ATOM 4005 C12 POP 33 30.630 55.370 66.390 1.00 0.00 ATOM 4006 H12A POP 33 31.410 54.680 66.800 1.00 0.00 ATOM 4007 H12B POP 33 29.740 55.360 67.050 1.00 0.00 ATOM 4008 C11 POP 33 31.180 56.790 66.310 1.00 0.00 ATOM 4009 H11A POP 33 31.410 57.230 67.310 1.00 0.00 ATOM 4010 H11B POP 33 30.320 57.370 65.920 1.00 0.00 ATOM 4011 P POP 33 32.650 58.150 64.800 1.00 0.00 ATOM 4012 O13 POP 33 33.360 58.910 65.850 1.00 0.00 ATOM 4013 O14 POP 33 31.440 58.810 64.270 1.00 0.00 ATOM 4014 O11 POP 33 33.670 57.910 63.590 1.00 0.00 ATOM 4015 O12 POP 33 32.310 56.720 65.430 1.00 0.00 ATOM 4016 C1 POP 33 35.000 58.420 63.500 1.00 0.00 ATOM 4017 HA POP 33 35.610 57.640 63.010 1.00 0.00 ATOM 4018 HB POP 33 35.440 58.640 64.490 1.00 0.00 ATOM 4019 C2 POP 33 34.940 59.690 62.630 1.00 0.00 ATOM 4020 HS POP 33 34.270 60.370 63.190 1.00 0.00 ATOM 4021 O21 POP 33 34.460 59.380 61.310 1.00 0.00 ATOM 4022 C21 POP 33 34.020 60.450 60.650 1.00 0.00 ATOM 4023 O22 POP 33 33.960 61.590 61.090 1.00 0.00 ATOM 4024 C22 POP 33 33.520 59.980 59.290 1.00 0.00 ATOM 4025 H2R POP 33 32.490 60.360 59.180 1.00 0.00 ATOM 4026 H2S POP 33 33.490 58.870 59.240 1.00 0.00 ATOM 4027 C3 POP 33 36.300 60.400 62.540 1.00 0.00 ATOM 4028 HX POP 33 36.580 60.610 63.590 1.00 0.00 ATOM 4029 HY POP 33 36.180 61.360 61.980 1.00 0.00 ATOM 4030 O31 POP 33 37.320 59.640 61.880 1.00 0.00 ATOM 4031 C31 POP 33 38.410 60.320 61.550 1.00 0.00 ATOM 4032 O32 POP 33 38.560 61.510 61.770 1.00 0.00 ATOM 4033 C32 POP 33 39.450 59.470 60.840 1.00 0.00 ATOM 4034 H2X POP 33 39.820 58.600 61.430 1.00 0.00 ATOM 4035 H2Y POP 33 40.330 60.110 60.600 1.00 0.00 ATOM 4036 C23 POP 33 34.330 60.580 58.140 1.00 0.00 ATOM 4037 H3R POP 33 35.420 60.420 58.330 1.00 0.00 ATOM 4038 H3S POP 33 34.160 61.670 58.040 1.00 0.00 ATOM 4039 C24 POP 33 34.020 60.000 56.760 1.00 0.00 ATOM 4040 H4R POP 33 33.030 60.420 56.490 1.00 0.00 ATOM 4041 H4S POP 33 34.060 58.890 56.780 1.00 0.00 ATOM 4042 C25 POP 33 35.070 60.510 55.770 1.00 0.00 ATOM 4043 H5R POP 33 36.030 59.980 55.980 1.00 0.00 ATOM 4044 H5S POP 33 35.310 61.590 55.830 1.00 0.00 ATOM 4045 C26 POP 33 34.680 60.290 54.310 1.00 0.00 ATOM 4046 H6R POP 33 33.950 61.020 53.890 1.00 0.00 ATOM 4047 H6S POP 33 34.220 59.280 54.190 1.00 0.00 ATOM 4048 C27 POP 33 35.910 60.390 53.410 1.00 0.00 ATOM 4049 H7R POP 33 36.700 59.710 53.800 1.00 0.00 ATOM 4050 H7S POP 33 36.410 61.380 53.490 1.00 0.00 ATOM 4051 C28 POP 33 35.650 60.190 51.910 1.00 0.00 ATOM 4052 H8R POP 33 35.390 59.110 51.850 1.00 0.00 ATOM 4053 H8S POP 33 34.880 60.910 51.570 1.00 0.00 ATOM 4054 C29 POP 33 36.880 60.340 51.070 1.00 0.00 ATOM 4055 H91 POP 33 37.830 60.060 51.550 1.00 0.00 ATOM 4056 0C21 POP 33 37.010 60.850 49.830 1.00 0.00 ATOM 4057 1H10 POP 33 37.980 61.080 49.380 1.00 0.00 ATOM 4058 1C21 POP 33 35.790 61.230 49.040 1.00 0.00 ATOM 4059 H11R POP 33 35.260 62.100 49.490 1.00 0.00 ATOM 4060 H11S POP 33 35.170 60.310 49.060 1.00 0.00 ATOM 4061 2C21 POP 33 36.400 61.500 47.670 1.00 0.00 ATOM 4062 H12R POP 33 37.140 60.720 47.380 1.00 0.00 ATOM 4063 H12S POP 33 36.950 62.470 47.730 1.00 0.00 ATOM 4064 3C21 POP 33 35.470 61.620 46.460 1.00 0.00 ATOM 4065 H13R POP 33 36.080 61.790 45.550 1.00 0.00 ATOM 4066 H13S POP 33 34.840 62.510 46.690 1.00 0.00 ATOM 4067 4C21 POP 33 34.530 60.440 46.210 1.00 0.00 ATOM 4068 H14R POP 33 34.160 60.100 47.200 1.00 0.00 ATOM 4069 H14S POP 33 35.080 59.560 45.810 1.00 0.00 ATOM 4070 5C21 POP 33 33.250 60.870 45.510 1.00 0.00 ATOM 4071 H15R POP 33 33.610 61.500 44.660 1.00 0.00 ATOM 4072 H15S POP 33 32.570 61.490 46.130 1.00 0.00 ATOM 4073 6C21 POP 33 32.430 59.710 44.940 1.00 0.00 ATOM 4074 H16R POP 33 32.980 59.210 44.110 1.00 0.00 ATOM 4075 H16S POP 33 31.490 60.080 44.480 1.00 0.00 ATOM 4076 7C21 POP 33 31.930 58.790 46.050 1.00 0.00 ATOM 4077 H17R POP 33 31.100 59.330 46.560 1.00 0.00 ATOM 4078 H17S POP 33 32.680 58.580 46.840 1.00 0.00 ATOM 4079 8C21 POP 33 31.430 57.420 45.570 1.00 0.00 ATOM 4080 H18R POP 33 31.060 56.810 46.430 1.00 0.00 ATOM 4081 H18S POP 33 32.260 56.840 45.110 1.00 0.00 ATOM 4082 H18T POP 33 30.610 57.640 44.860 1.00 0.00 ATOM 4083 C33 POP 33 38.870 59.080 59.480 1.00 0.00 ATOM 4084 H3X POP 33 38.620 60.010 58.930 1.00 0.00 ATOM 4085 H3Y POP 33 37.930 58.560 59.730 1.00 0.00 ATOM 4086 C34 POP 33 39.630 58.200 58.480 1.00 0.00 ATOM 4087 H4X POP 33 39.500 57.200 58.930 1.00 0.00 ATOM 4088 H4Y POP 33 40.710 58.470 58.410 1.00 0.00 ATOM 4089 C35 POP 33 39.130 57.930 57.060 1.00 0.00 ATOM 4090 H5X POP 33 38.110 57.480 57.080 1.00 0.00 ATOM 4091 H5Y POP 33 39.840 57.160 56.700 1.00 0.00 ATOM 4092 C36 POP 33 39.220 59.050 56.030 1.00 0.00 ATOM 4093 H6X POP 33 40.270 59.410 56.020 1.00 0.00 ATOM 4094 H6Y POP 33 38.570 59.910 56.300 1.00 0.00 ATOM 4095 C37 POP 33 38.810 58.610 54.620 1.00 0.00 ATOM 4096 H7X POP 33 38.840 59.490 53.940 1.00 0.00 ATOM 4097 H7Y POP 33 37.780 58.200 54.630 1.00 0.00 ATOM 4098 C38 POP 33 39.560 57.370 54.150 1.00 0.00 ATOM 4099 H8X POP 33 39.130 56.450 54.620 1.00 0.00 ATOM 4100 H8Y POP 33 40.580 57.400 54.600 1.00 0.00 ATOM 4101 C39 POP 33 39.370 57.060 52.660 1.00 0.00 ATOM 4102 H9X POP 33 40.250 56.420 52.450 1.00 0.00 ATOM 4103 H9Y POP 33 39.440 58.050 52.150 1.00 0.00 ATOM 4104 0C31 POP 33 38.020 56.460 52.270 1.00 0.00 ATOM 4105 H10X POP 33 37.270 57.280 52.290 1.00 0.00 ATOM 4106 H10Y POP 33 37.670 55.670 52.960 1.00 0.00 ATOM 4107 1C31 POP 33 38.080 55.960 50.820 1.00 0.00 ATOM 4108 H11X POP 33 39.020 55.370 50.690 1.00 0.00 ATOM 4109 H11Y POP 33 38.200 56.760 50.060 1.00 0.00 ATOM 4110 2C31 POP 33 36.920 55.030 50.480 1.00 0.00 ATOM 4111 H12X POP 33 35.980 55.260 51.030 1.00 0.00 ATOM 4112 H12Y POP 33 37.230 53.980 50.660 1.00 0.00 ATOM 4113 3C31 POP 33 36.510 55.220 49.020 1.00 0.00 ATOM 4114 H13X POP 33 37.360 55.030 48.330 1.00 0.00 ATOM 4115 H13Y POP 33 36.270 56.300 48.900 1.00 0.00 ATOM 4116 4C31 POP 33 35.360 54.280 48.640 1.00 0.00 ATOM 4117 H14X POP 33 34.560 54.420 49.390 1.00 0.00 ATOM 4118 H14Y POP 33 35.610 53.200 48.620 1.00 0.00 ATOM 4119 5C31 POP 33 34.770 54.660 47.290 1.00 0.00 ATOM 4120 H15X POP 33 33.710 54.320 47.360 1.00 0.00 ATOM 4121 H15Y POP 33 35.300 54.080 46.510 1.00 0.00 ATOM 4122 6C31 POP 33 34.650 56.150 46.980 1.00 0.00 ATOM 4123 H16X POP 33 34.020 56.390 46.100 1.00 0.00 ATOM 4124 H16Y POP 33 35.670 56.550 46.760 1.00 0.00 ATOM 4125 H16Z POP 33 34.230 56.710 47.840 1.00 0.00 ATOM 4126 N POP 34 49.820 40.200 63.990 1.00 0.00 ATOM 4127 HN1 POP 34 49.610 41.100 64.470 1.00 0.00 ATOM 4128 HN2 POP 34 49.340 39.450 64.530 1.00 0.00 ATOM 4129 HN3 POP 34 50.820 39.920 64.130 1.00 0.00 ATOM 4130 C12 POP 34 49.250 40.270 62.600 1.00 0.00 ATOM 4131 H12A POP 34 49.670 39.310 62.230 1.00 0.00 ATOM 4132 H12B POP 34 49.770 41.030 61.980 1.00 0.00 ATOM 4133 C11 POP 34 47.720 40.390 62.660 1.00 0.00 ATOM 4134 H11A POP 34 47.320 40.090 61.660 1.00 0.00 ATOM 4135 H11B POP 34 47.460 41.450 62.860 1.00 0.00 ATOM 4136 P POP 34 46.080 40.280 64.590 1.00 0.00 ATOM 4137 O13 POP 34 46.660 41.520 65.160 1.00 0.00 ATOM 4138 O14 POP 34 45.480 39.260 65.480 1.00 0.00 ATOM 4139 O11 POP 34 44.940 40.630 63.520 1.00 0.00 ATOM 4140 O12 POP 34 47.240 39.590 63.740 1.00 0.00 ATOM 4141 C1 POP 34 44.350 39.520 62.850 1.00 0.00 ATOM 4142 HA POP 34 43.780 38.970 63.620 1.00 0.00 ATOM 4143 HB POP 34 45.060 38.760 62.440 1.00 0.00 ATOM 4144 C2 POP 34 43.440 40.010 61.700 1.00 0.00 ATOM 4145 HS POP 34 43.140 39.160 61.060 1.00 0.00 ATOM 4146 O21 POP 34 44.160 41.060 61.050 1.00 0.00 ATOM 4147 C21 POP 34 45.090 40.600 60.210 1.00 0.00 ATOM 4148 O22 POP 34 45.340 39.430 59.960 1.00 0.00 ATOM 4149 C22 POP 34 45.780 41.820 59.630 1.00 0.00 ATOM 4150 H2R POP 34 46.620 42.190 60.260 1.00 0.00 ATOM 4151 H2S POP 34 45.000 42.610 59.560 1.00 0.00 ATOM 4152 C3 POP 34 42.110 40.640 62.160 1.00 0.00 ATOM 4153 HX POP 34 42.100 41.470 62.900 1.00 0.00 ATOM 4154 HY POP 34 41.550 39.860 62.720 1.00 0.00 ATOM 4155 O31 POP 34 41.280 41.010 61.070 1.00 0.00 ATOM 4156 C31 POP 34 40.510 40.020 60.620 1.00 0.00 ATOM 4157 O32 POP 34 40.660 38.830 60.810 1.00 0.00 ATOM 4158 C32 POP 34 39.310 40.580 59.850 1.00 0.00 ATOM 4159 H2X POP 34 38.720 41.100 60.640 1.00 0.00 ATOM 4160 H2Y POP 34 38.710 39.740 59.460 1.00 0.00 ATOM 4161 C23 POP 34 46.080 41.360 58.200 1.00 0.00 ATOM 4162 H3R POP 34 45.250 40.920 57.600 1.00 0.00 ATOM 4163 H3S POP 34 46.950 40.670 58.220 1.00 0.00 ATOM 4164 C24 POP 34 46.690 42.510 57.390 1.00 0.00 ATOM 4165 H4R POP 34 47.390 43.120 58.000 1.00 0.00 ATOM 4166 H4S POP 34 45.830 43.160 57.090 1.00 0.00 ATOM 4167 C25 POP 34 47.470 42.090 56.140 1.00 0.00 ATOM 4168 H5R POP 34 48.470 41.690 56.400 1.00 0.00 ATOM 4169 H5S POP 34 47.700 43.060 55.650 1.00 0.00 ATOM 4170 C26 POP 34 46.660 41.190 55.200 1.00 0.00 ATOM 4171 H6R POP 34 45.630 41.620 55.190 1.00 0.00 ATOM 4172 H6S POP 34 46.650 40.200 55.700 1.00 0.00 ATOM 4173 C27 POP 34 47.140 41.130 53.750 1.00 0.00 ATOM 4174 H7R POP 34 46.780 41.940 53.080 1.00 0.00 ATOM 4175 H7S POP 34 46.680 40.180 53.390 1.00 0.00 ATOM 4176 C28 POP 34 48.610 40.830 53.480 1.00 0.00 ATOM 4177 H8R POP 34 48.930 39.940 54.070 1.00 0.00 ATOM 4178 H8S POP 34 49.240 41.680 53.800 1.00 0.00 ATOM 4179 C29 POP 34 48.650 40.590 52.000 1.00 0.00 ATOM 4180 H91 POP 34 48.450 41.530 51.470 1.00 0.00 ATOM 4181 0C21 POP 34 48.880 39.430 51.370 1.00 0.00 ATOM 4182 1H10 POP 34 48.830 39.460 50.280 1.00 0.00 ATOM 4183 1C21 POP 34 49.220 38.080 51.940 1.00 0.00 ATOM 4184 H11R POP 34 48.330 37.800 52.540 1.00 0.00 ATOM 4185 H11S POP 34 50.070 38.140 52.640 1.00 0.00 ATOM 4186 2C21 POP 34 49.350 36.940 50.920 1.00 0.00 ATOM 4187 H12R POP 34 49.860 37.320 50.010 1.00 0.00 ATOM 4188 H12S POP 34 48.420 36.350 50.810 1.00 0.00 ATOM 4189 3C21 POP 34 50.320 35.860 51.390 1.00 0.00 ATOM 4190 H13R POP 34 50.070 35.390 52.360 1.00 0.00 ATOM 4191 H13S POP 34 51.280 36.360 51.630 1.00 0.00 ATOM 4192 4C21 POP 34 50.380 34.620 50.490 1.00 0.00 ATOM 4193 H14R POP 34 51.070 33.930 51.030 1.00 0.00 ATOM 4194 H14S POP 34 50.640 34.880 49.450 1.00 0.00 ATOM 4195 5C21 POP 34 49.060 33.850 50.370 1.00 0.00 ATOM 4196 H15R POP 34 48.200 34.250 49.790 1.00 0.00 ATOM 4197 H15S POP 34 48.690 33.580 51.380 1.00 0.00 ATOM 4198 6C21 POP 34 49.390 32.570 49.600 1.00 0.00 ATOM 4199 H16R POP 34 50.290 32.060 50.010 1.00 0.00 ATOM 4200 H16S POP 34 49.720 32.760 48.560 1.00 0.00 ATOM 4201 7C21 POP 34 48.210 31.590 49.570 1.00 0.00 ATOM 4202 H17R POP 34 47.340 32.100 49.110 1.00 0.00 ATOM 4203 H17S POP 34 48.060 31.150 50.580 1.00 0.00 ATOM 4204 8C21 POP 34 48.590 30.430 48.650 1.00 0.00 ATOM 4205 H18R POP 34 49.400 29.780 49.040 1.00 0.00 ATOM 4206 H18S POP 34 48.990 30.940 47.750 1.00 0.00 ATOM 4207 H18T POP 34 47.640 29.920 48.410 1.00 0.00 ATOM 4208 C33 POP 34 39.700 41.720 58.900 1.00 0.00 ATOM 4209 H3X POP 34 40.090 41.270 57.960 1.00 0.00 ATOM 4210 H3Y POP 34 40.520 42.310 59.350 1.00 0.00 ATOM 4211 C34 POP 34 38.550 42.720 58.710 1.00 0.00 ATOM 4212 H4X POP 34 38.270 43.240 59.650 1.00 0.00 ATOM 4213 H4Y POP 34 37.580 42.210 58.530 1.00 0.00 ATOM 4214 C35 POP 34 38.930 43.670 57.580 1.00 0.00 ATOM 4215 H5X POP 34 39.770 44.360 57.830 1.00 0.00 ATOM 4216 H5Y POP 34 38.040 44.290 57.330 1.00 0.00 ATOM 4217 C36 POP 34 39.240 42.990 56.240 1.00 0.00 ATOM 4218 H6X POP 34 38.560 42.110 56.210 1.00 0.00 ATOM 4219 H6Y POP 34 40.280 42.620 56.350 1.00 0.00 ATOM 4220 C37 POP 34 39.110 43.890 55.010 1.00 0.00 ATOM 4221 H7X POP 34 39.710 43.480 54.170 1.00 0.00 ATOM 4222 H7Y POP 34 39.740 44.780 55.230 1.00 0.00 ATOM 4223 C38 POP 34 37.670 44.350 54.770 1.00 0.00 ATOM 4224 H8X POP 34 37.530 45.300 55.330 1.00 0.00 ATOM 4225 H8Y POP 34 36.930 43.540 54.980 1.00 0.00 ATOM 4226 C39 POP 34 37.500 44.710 53.300 1.00 0.00 ATOM 4227 H9X POP 34 36.470 45.120 53.280 1.00 0.00 ATOM 4228 H9Y POP 34 37.370 43.770 52.720 1.00 0.00 ATOM 4229 0C31 POP 34 38.310 45.850 52.690 1.00 0.00 ATOM 4230 H10X POP 34 39.260 45.470 52.250 1.00 0.00 ATOM 4231 H10Y POP 34 38.400 46.580 53.520 1.00 0.00 ATOM 4232 1C31 POP 34 37.580 46.500 51.510 1.00 0.00 ATOM 4233 H11X POP 34 36.690 47.030 51.920 1.00 0.00 ATOM 4234 H11Y POP 34 37.180 45.640 50.930 1.00 0.00 ATOM 4235 2C31 POP 34 38.320 47.510 50.640 1.00 0.00 ATOM 4236 H12X POP 34 39.370 47.150 50.710 1.00 0.00 ATOM 4237 H12Y POP 34 38.170 48.420 51.270 1.00 0.00 ATOM 4238 3C31 POP 34 37.780 47.530 49.210 1.00 0.00 ATOM 4239 H13X POP 34 36.670 47.660 49.180 1.00 0.00 ATOM 4240 H13Y POP 34 38.000 46.550 48.750 1.00 0.00 ATOM 4241 4C31 POP 34 38.440 48.610 48.360 1.00 0.00 ATOM 4242 H14X POP 34 39.490 48.360 48.080 1.00 0.00 ATOM 4243 H14Y POP 34 38.460 49.500 49.020 1.00 0.00 ATOM 4244 5C31 POP 34 37.690 48.940 47.070 1.00 0.00 ATOM 4245 H15X POP 34 36.590 49.020 47.240 1.00 0.00 ATOM 4246 H15Y POP 34 37.800 48.090 46.360 1.00 0.00 ATOM 4247 6C31 POP 34 38.290 50.190 46.430 1.00 0.00 ATOM 4248 H16X POP 34 38.100 51.050 47.110 1.00 0.00 ATOM 4249 H16Y POP 34 37.720 50.380 45.500 1.00 0.00 ATOM 4250 H16Z POP 34 39.390 50.120 46.280 1.00 0.00 ATOM 4251 N POP 35 14.820 31.730 68.600 1.00 0.00 ATOM 4252 HN1 POP 35 15.720 31.210 68.550 1.00 0.00 ATOM 4253 HN2 POP 35 14.140 31.480 67.850 1.00 0.00 ATOM 4254 HN3 POP 35 15.000 32.750 68.570 1.00 0.00 ATOM 4255 C12 POP 35 14.410 31.260 69.970 1.00 0.00 ATOM 4256 H12A POP 35 15.150 31.570 70.740 1.00 0.00 ATOM 4257 H12B POP 35 14.420 30.150 70.000 1.00 0.00 ATOM 4258 C11 POP 35 13.050 31.810 70.390 1.00 0.00 ATOM 4259 H11A POP 35 13.240 32.900 70.480 1.00 0.00 ATOM 4260 H11B POP 35 12.770 31.340 71.360 1.00 0.00 ATOM 4261 P POP 35 10.610 31.540 69.700 1.00 0.00 ATOM 4262 O13 POP 35 10.210 32.840 70.290 1.00 0.00 ATOM 4263 O14 POP 35 10.320 30.290 70.440 1.00 0.00 ATOM 4264 O11 POP 35 9.870 31.310 68.290 1.00 0.00 ATOM 4265 O12 POP 35 12.150 31.640 69.290 1.00 0.00 ATOM 4266 C1 POP 35 10.110 30.060 67.640 1.00 0.00 ATOM 4267 HA POP 35 9.180 29.850 67.080 1.00 0.00 ATOM 4268 HB POP 35 10.270 29.230 68.360 1.00 0.00 ATOM 4269 C2 POP 35 11.360 30.130 66.750 1.00 0.00 ATOM 4270 HS POP 35 12.200 30.180 67.470 1.00 0.00 ATOM 4271 O21 POP 35 11.250 31.210 65.820 1.00 0.00 ATOM 4272 C21 POP 35 12.470 31.440 65.350 1.00 0.00 ATOM 4273 O22 POP 35 13.500 31.040 65.880 1.00 0.00 ATOM 4274 C22 POP 35 12.240 32.190 64.050 1.00 0.00 ATOM 4275 H2R POP 35 12.140 33.270 64.270 1.00 0.00 ATOM 4276 H2S POP 35 11.250 31.910 63.640 1.00 0.00 ATOM 4277 C3 POP 35 11.490 28.760 66.050 1.00 0.00 ATOM 4278 HX POP 35 11.420 28.010 66.860 1.00 0.00 ATOM 4279 HY POP 35 12.410 28.580 65.460 1.00 0.00 ATOM 4280 O31 POP 35 10.290 28.500 65.320 1.00 0.00 ATOM 4281 C31 POP 35 10.300 28.840 64.030 1.00 0.00 ATOM 4282 O32 POP 35 11.270 29.290 63.450 1.00 0.00 ATOM 4283 C32 POP 35 8.990 28.470 63.340 1.00 0.00 ATOM 4284 H2X POP 35 8.120 28.820 63.930 1.00 0.00 ATOM 4285 H2Y POP 35 8.910 27.360 63.360 1.00 0.00 ATOM 4286 C23 POP 35 13.410 31.820 63.130 1.00 0.00 ATOM 4287 H3R POP 35 13.290 30.740 62.900 1.00 0.00 ATOM 4288 H3S POP 35 14.410 31.880 63.610 1.00 0.00 ATOM 4289 C24 POP 35 13.550 32.640 61.850 1.00 0.00 ATOM 4290 H4R POP 35 14.490 32.300 61.350 1.00 0.00 ATOM 4291 H4S POP 35 13.680 33.710 62.090 1.00 0.00 ATOM 4292 C25 POP 35 12.450 32.470 60.800 1.00 0.00 ATOM 4293 H5R POP 35 11.490 32.800 61.240 1.00 0.00 ATOM 4294 H5S POP 35 12.280 31.450 60.390 1.00 0.00 ATOM 4295 C26 POP 35 12.590 33.370 59.570 1.00 0.00 ATOM 4296 H6R POP 35 13.630 33.390 59.190 1.00 0.00 ATOM 4297 H6S POP 35 12.410 34.340 60.070 1.00 0.00 ATOM 4298 C27 POP 35 11.670 33.100 58.370 1.00 0.00 ATOM 4299 H7R POP 35 10.600 33.080 58.680 1.00 0.00 ATOM 4300 H7S POP 35 11.830 32.080 57.970 1.00 0.00 ATOM 4301 C28 POP 35 11.900 34.150 57.280 1.00 0.00 ATOM 4302 H8R POP 35 12.990 34.180 57.060 1.00 0.00 ATOM 4303 H8S POP 35 11.560 35.120 57.700 1.00 0.00 ATOM 4304 C29 POP 35 11.170 33.880 56.000 1.00 0.00 ATOM 4305 H91 POP 35 10.180 33.460 56.220 1.00 0.00 ATOM 4306 0C21 POP 35 11.680 33.910 54.760 1.00 0.00 ATOM 4307 1H10 POP 35 10.880 33.870 54.000 1.00 0.00 ATOM 4308 1C21 POP 35 13.070 34.250 54.310 1.00 0.00 ATOM 4309 H11R POP 35 13.660 33.310 54.330 1.00 0.00 ATOM 4310 H11S POP 35 13.600 35.110 54.780 1.00 0.00 ATOM 4311 2C21 POP 35 13.020 34.460 52.800 1.00 0.00 ATOM 4312 H12R POP 35 12.450 33.590 52.420 1.00 0.00 ATOM 4313 H12S POP 35 14.010 34.410 52.310 1.00 0.00 ATOM 4314 3C21 POP 35 12.220 35.700 52.380 1.00 0.00 ATOM 4315 H13R POP 35 12.740 36.610 52.780 1.00 0.00 ATOM 4316 H13S POP 35 11.220 35.610 52.860 1.00 0.00 ATOM 4317 4C21 POP 35 12.040 35.800 50.870 1.00 0.00 ATOM 4318 H14R POP 35 11.330 36.620 50.620 1.00 0.00 ATOM 4319 H14S POP 35 11.590 34.840 50.540 1.00 0.00 ATOM 4320 5C21 POP 35 13.300 35.820 50.000 1.00 0.00 ATOM 4321 H15R POP 35 13.900 34.900 50.140 1.00 0.00 ATOM 4322 H15S POP 35 13.850 36.730 50.320 1.00 0.00 ATOM 4323 6C21 POP 35 13.000 36.010 48.510 1.00 0.00 ATOM 4324 H16R POP 35 12.450 36.960 48.360 1.00 0.00 ATOM 4325 H16S POP 35 12.390 35.210 48.050 1.00 0.00 ATOM 4326 7C21 POP 35 14.230 36.270 47.640 1.00 0.00 ATOM 4327 H17R POP 35 14.920 35.400 47.650 1.00 0.00 ATOM 4328 H17S POP 35 14.910 37.090 47.950 1.00 0.00 ATOM 4329 8C21 POP 35 13.780 36.580 46.210 1.00 0.00 ATOM 4330 H18R POP 35 13.070 35.810 45.840 1.00 0.00 ATOM 4331 H18S POP 35 14.640 36.650 45.520 1.00 0.00 ATOM 4332 H18T POP 35 13.380 37.610 46.060 1.00 0.00 ATOM 4333 C33 POP 35 8.890 29.320 62.080 1.00 0.00 ATOM 4334 H3X POP 35 8.000 28.860 61.600 1.00 0.00 ATOM 4335 H3Y POP 35 9.780 29.120 61.430 1.00 0.00 ATOM 4336 C34 POP 35 8.510 30.770 62.360 1.00 0.00 ATOM 4337 H4X POP 35 9.470 31.320 62.460 1.00 0.00 ATOM 4338 H4Y POP 35 7.820 30.920 63.220 1.00 0.00 ATOM 4339 C35 POP 35 7.750 31.350 61.170 1.00 0.00 ATOM 4340 H5X POP 35 7.310 32.360 61.360 1.00 0.00 ATOM 4341 H5Y POP 35 6.910 30.630 61.090 1.00 0.00 ATOM 4342 C36 POP 35 8.470 31.470 59.820 1.00 0.00 ATOM 4343 H6X POP 35 8.910 30.520 59.450 1.00 0.00 ATOM 4344 H6Y POP 35 9.320 32.180 59.920 1.00 0.00 ATOM 4345 C37 POP 35 7.570 31.880 58.660 1.00 0.00 ATOM 4346 H7X POP 35 6.900 32.750 58.860 1.00 0.00 ATOM 4347 H7Y POP 35 7.030 30.920 58.470 1.00 0.00 ATOM 4348 C38 POP 35 8.290 32.230 57.360 1.00 0.00 ATOM 4349 H8X POP 35 9.130 31.510 57.340 1.00 0.00 ATOM 4350 H8Y POP 35 8.600 33.270 57.610 1.00 0.00 ATOM 4351 C39 POP 35 7.310 32.290 56.180 1.00 0.00 ATOM 4352 H9X POP 35 6.510 33.040 56.330 1.00 0.00 ATOM 4353 H9Y POP 35 6.790 31.310 56.150 1.00 0.00 ATOM 4354 0C31 POP 35 7.930 32.550 54.800 1.00 0.00 ATOM 4355 H10X POP 35 8.410 31.610 54.450 1.00 0.00 ATOM 4356 H10Y POP 35 8.660 33.390 54.790 1.00 0.00 ATOM 4357 1C31 POP 35 6.870 32.880 53.740 1.00 0.00 ATOM 4358 H11X POP 35 6.310 33.790 54.040 1.00 0.00 ATOM 4359 H11Y POP 35 6.150 32.030 53.680 1.00 0.00 ATOM 4360 2C31 POP 35 7.570 33.180 52.420 1.00 0.00 ATOM 4361 H12X POP 35 8.470 33.830 52.450 1.00 0.00 ATOM 4362 H12Y POP 35 6.800 33.740 51.850 1.00 0.00 ATOM 4363 3C31 POP 35 8.010 31.930 51.650 1.00 0.00 ATOM 4364 H13X POP 35 7.180 31.240 51.370 1.00 0.00 ATOM 4365 H13Y POP 35 8.680 31.330 52.290 1.00 0.00 ATOM 4366 4C31 POP 35 8.820 32.310 50.400 1.00 0.00 ATOM 4367 H14X POP 35 9.390 31.380 50.210 1.00 0.00 ATOM 4368 H14Y POP 35 9.620 33.060 50.600 1.00 0.00 ATOM 4369 5C31 POP 35 8.130 32.910 49.170 1.00 0.00 ATOM 4370 H15X POP 35 7.530 33.840 49.270 1.00 0.00 ATOM 4371 H15Y POP 35 7.380 32.120 48.970 1.00 0.00 ATOM 4372 6C31 POP 35 8.880 33.020 47.850 1.00 0.00 ATOM 4373 H16X POP 35 9.720 33.750 47.920 1.00 0.00 ATOM 4374 H16Y POP 35 8.270 33.370 46.990 1.00 0.00 ATOM 4375 H16Z POP 35 9.350 32.080 47.490 1.00 0.00 ATOM 4376 N POP 36 20.730 25.070 69.420 1.00 0.00 ATOM 4377 HN1 POP 36 20.000 25.060 70.160 1.00 0.00 ATOM 4378 HN2 POP 36 21.570 25.500 69.860 1.00 0.00 ATOM 4379 HN3 POP 36 20.440 25.620 68.590 1.00 0.00 ATOM 4380 C12 POP 36 21.240 23.700 69.010 1.00 0.00 ATOM 4381 H12A POP 36 21.660 23.220 69.920 1.00 0.00 ATOM 4382 H12B POP 36 21.980 23.860 68.190 1.00 0.00 ATOM 4383 C11 POP 36 20.040 22.920 68.480 1.00 0.00 ATOM 4384 H11A POP 36 19.330 22.710 69.310 1.00 0.00 ATOM 4385 H11B POP 36 20.320 21.920 68.070 1.00 0.00 ATOM 4386 P POP 36 17.940 23.320 67.030 1.00 0.00 ATOM 4387 O13 POP 36 17.070 24.070 67.960 1.00 0.00 ATOM 4388 O14 POP 36 17.780 21.840 67.020 1.00 0.00 ATOM 4389 O11 POP 36 17.730 23.820 65.520 1.00 0.00 ATOM 4390 O12 POP 36 19.400 23.750 67.510 1.00 0.00 ATOM 4391 C1 POP 36 17.410 25.160 65.130 1.00 0.00 ATOM 4392 HA POP 36 17.510 25.830 66.020 1.00 0.00 ATOM 4393 HB POP 36 16.320 25.090 64.940 1.00 0.00 ATOM 4394 C2 POP 36 18.040 25.660 63.820 1.00 0.00 ATOM 4395 HS POP 36 17.530 26.600 63.510 1.00 0.00 ATOM 4396 O21 POP 36 17.710 24.680 62.830 1.00 0.00 ATOM 4397 C21 POP 36 17.620 25.190 61.600 1.00 0.00 ATOM 4398 O22 POP 36 17.910 26.330 61.250 1.00 0.00 ATOM 4399 C22 POP 36 16.710 24.250 60.830 1.00 0.00 ATOM 4400 H2R POP 36 15.710 24.210 61.320 1.00 0.00 ATOM 4401 H2S POP 36 17.080 23.200 60.820 1.00 0.00 ATOM 4402 C3 POP 36 19.540 25.930 64.030 1.00 0.00 ATOM 4403 HX POP 36 20.020 25.080 64.550 1.00 0.00 ATOM 4404 HY POP 36 19.600 26.840 64.670 1.00 0.00 ATOM 4405 O31 POP 36 20.260 26.090 62.800 1.00 0.00 ATOM 4406 C31 POP 36 20.500 27.380 62.540 1.00 0.00 ATOM 4407 O32 POP 36 20.280 28.400 63.170 1.00 0.00 ATOM 4408 C32 POP 36 20.980 27.500 61.100 1.00 0.00 ATOM 4409 H2X POP 36 21.130 28.560 60.820 1.00 0.00 ATOM 4410 H2Y POP 36 20.240 27.040 60.420 1.00 0.00 ATOM 4411 C23 POP 36 16.720 24.670 59.360 1.00 0.00 ATOM 4412 H3R POP 36 17.760 24.610 58.970 1.00 0.00 ATOM 4413 H3S POP 36 16.400 25.730 59.270 1.00 0.00 ATOM 4414 C24 POP 36 15.770 23.920 58.420 1.00 0.00 ATOM 4415 H4R POP 36 15.780 22.850 58.710 1.00 0.00 ATOM 4416 H4S POP 36 15.840 24.020 57.320 1.00 0.00 ATOM 4417 C25 POP 36 14.330 24.330 58.750 1.00 0.00 ATOM 4418 H5R POP 36 14.110 25.410 58.610 1.00 0.00 ATOM 4419 H5S POP 36 14.120 24.020 59.790 1.00 0.00 ATOM 4420 C26 POP 36 13.310 23.510 57.960 1.00 0.00 ATOM 4421 H6R POP 36 12.460 23.500 58.670 1.00 0.00 ATOM 4422 H6S POP 36 13.590 22.450 57.760 1.00 0.00 ATOM 4423 C27 POP 36 12.870 24.190 56.660 1.00 0.00 ATOM 4424 H7R POP 36 13.780 24.000 56.040 1.00 0.00 ATOM 4425 H7S POP 36 12.840 25.300 56.710 1.00 0.00 ATOM 4426 C28 POP 36 11.620 23.590 56.000 1.00 0.00 ATOM 4427 H8R POP 36 10.760 23.760 56.680 1.00 0.00 ATOM 4428 H8S POP 36 11.670 22.480 55.970 1.00 0.00 ATOM 4429 C29 POP 36 11.460 24.330 54.700 1.00 0.00 ATOM 4430 H91 POP 36 11.330 25.400 54.890 1.00 0.00 ATOM 4431 0C21 POP 36 11.240 23.930 53.450 1.00 0.00 ATOM 4432 1H10 POP 36 11.210 24.740 52.700 1.00 0.00 ATOM 4433 1C21 POP 36 11.230 22.510 52.970 1.00 0.00 ATOM 4434 H11R POP 36 10.210 22.170 52.660 1.00 0.00 ATOM 4435 H11S POP 36 11.650 21.830 53.750 1.00 0.00 ATOM 4436 2C21 POP 36 12.120 22.200 51.760 1.00 0.00 ATOM 4437 H12R POP 36 12.190 21.090 51.700 1.00 0.00 ATOM 4438 H12S POP 36 13.070 22.760 51.840 1.00 0.00 ATOM 4439 3C21 POP 36 11.510 22.700 50.450 1.00 0.00 ATOM 4440 H13R POP 36 11.330 23.790 50.510 1.00 0.00 ATOM 4441 H13S POP 36 10.500 22.260 50.300 1.00 0.00 ATOM 4442 4C21 POP 36 12.350 22.420 49.200 1.00 0.00 ATOM 4443 H14R POP 36 12.500 21.320 49.100 1.00 0.00 ATOM 4444 H14S POP 36 13.390 22.810 49.310 1.00 0.00 ATOM 4445 5C21 POP 36 11.680 22.890 47.910 1.00 0.00 ATOM 4446 H15R POP 36 12.520 23.040 47.190 1.00 0.00 ATOM 4447 H15S POP 36 11.230 23.900 48.020 1.00 0.00 ATOM 4448 6C21 POP 36 10.540 22.020 47.380 1.00 0.00 ATOM 4449 H16R POP 36 9.740 22.110 48.150 1.00 0.00 ATOM 4450 H16S POP 36 10.910 20.970 47.360 1.00 0.00 ATOM 4451 7C21 POP 36 9.960 22.400 46.020 1.00 0.00 ATOM 4452 H17R POP 36 10.730 22.470 45.220 1.00 0.00 ATOM 4453 H17S POP 36 9.710 23.480 46.090 1.00 0.00 ATOM 4454 8C21 POP 36 8.840 21.490 45.520 1.00 0.00 ATOM 4455 H18R POP 36 9.270 20.480 45.330 1.00 0.00 ATOM 4456 H18S POP 36 8.230 21.770 44.640 1.00 0.00 ATOM 4457 H18T POP 36 8.170 21.390 46.400 1.00 0.00 ATOM 4458 C33 POP 36 22.320 26.770 60.910 1.00 0.00 ATOM 4459 H3X POP 36 22.210 25.730 61.280 1.00 0.00 ATOM 4460 H3Y POP 36 23.130 27.200 61.540 1.00 0.00 ATOM 4461 C34 POP 36 22.650 26.640 59.420 1.00 0.00 ATOM 4462 H4X POP 36 21.840 26.250 58.770 1.00 0.00 ATOM 4463 H4Y POP 36 23.470 25.900 59.300 1.00 0.00 ATOM 4464 C35 POP 36 23.250 27.930 58.840 1.00 0.00 ATOM 4465 H5X POP 36 24.000 28.330 59.560 1.00 0.00 ATOM 4466 H5Y POP 36 22.540 28.760 58.640 1.00 0.00 ATOM 4467 C36 POP 36 23.800 27.740 57.430 1.00 0.00 ATOM 4468 H6X POP 36 24.610 26.970 57.390 1.00 0.00 ATOM 4469 H6Y POP 36 24.200 28.710 57.080 1.00 0.00 ATOM 4470 C37 POP 36 22.780 27.420 56.330 1.00 0.00 ATOM 4471 H7X POP 36 21.810 27.900 56.550 1.00 0.00 ATOM 4472 H7Y POP 36 22.610 26.320 56.330 1.00 0.00 ATOM 4473 C38 POP 36 23.250 27.820 54.930 1.00 0.00 ATOM 4474 H8X POP 36 24.240 27.340 54.740 1.00 0.00 ATOM 4475 H8Y POP 36 23.370 28.920 54.920 1.00 0.00 ATOM 4476 C39 POP 36 22.230 27.340 53.890 1.00 0.00 ATOM 4477 H9X POP 36 21.240 27.740 54.170 1.00 0.00 ATOM 4478 H9Y POP 36 22.200 26.260 54.120 1.00 0.00 ATOM 4479 0C31 POP 36 22.600 27.620 52.430 1.00 0.00 ATOM 4480 H10X POP 36 22.010 27.040 51.690 1.00 0.00 ATOM 4481 H10Y POP 36 23.700 27.480 52.290 1.00 0.00 ATOM 4482 1C31 POP 36 22.540 29.080 51.990 1.00 0.00 ATOM 4483 H11X POP 36 23.420 29.650 52.360 1.00 0.00 ATOM 4484 H11Y POP 36 21.630 29.650 52.290 1.00 0.00 ATOM 4485 2C31 POP 36 22.680 29.210 50.470 1.00 0.00 ATOM 4486 H12X POP 36 22.260 28.300 49.990 1.00 0.00 ATOM 4487 H12Y POP 36 23.760 29.010 50.360 1.00 0.00 ATOM 4488 3C31 POP 36 22.010 30.480 49.940 1.00 0.00 ATOM 4489 H13X POP 36 22.580 31.280 50.470 1.00 0.00 ATOM 4490 H13Y POP 36 20.940 30.560 50.220 1.00 0.00 ATOM 4491 4C31 POP 36 22.020 30.710 48.430 1.00 0.00 ATOM 4492 H14X POP 36 22.110 31.800 48.240 1.00 0.00 ATOM 4493 H14Y POP 36 21.090 30.360 47.930 1.00 0.00 ATOM 4494 5C31 POP 36 23.180 30.110 47.620 1.00 0.00 ATOM 4495 H15X POP 36 23.110 29.020 47.420 1.00 0.00 ATOM 4496 H15Y POP 36 24.070 30.250 48.270 1.00 0.00 ATOM 4497 6C31 POP 36 23.240 30.830 46.280 1.00 0.00 ATOM 4498 H16X POP 36 22.310 30.670 45.690 1.00 0.00 ATOM 4499 H16Y POP 36 24.120 30.320 45.840 1.00 0.00 ATOM 4500 H16Z POP 36 23.270 31.920 46.510 1.00 0.00 ATOM 4501 N POP 37 47.050 15.150 62.490 1.00 0.00 ATOM 4502 HN1 POP 37 48.010 15.410 62.200 1.00 0.00 ATOM 4503 HN2 POP 37 46.880 15.480 63.470 1.00 0.00 ATOM 4504 HN3 POP 37 46.950 14.130 62.630 1.00 0.00 ATOM 4505 C12 POP 37 46.040 15.650 61.490 1.00 0.00 ATOM 4506 H12A POP 37 46.380 15.360 60.470 1.00 0.00 ATOM 4507 H12B POP 37 46.070 16.760 61.500 1.00 0.00 ATOM 4508 C11 POP 37 44.700 14.920 61.650 1.00 0.00 ATOM 4509 H11A POP 37 44.970 13.850 61.790 1.00 0.00 ATOM 4510 H11B POP 37 44.090 15.000 60.720 1.00 0.00 ATOM 4511 P POP 37 43.220 14.350 63.710 1.00 0.00 ATOM 4512 O13 POP 37 42.270 15.050 64.610 1.00 0.00 ATOM 4513 O14 POP 37 44.220 13.450 64.340 1.00 0.00 ATOM 4514 O11 POP 37 42.410 13.520 62.610 1.00 0.00 ATOM 4515 O12 POP 37 43.960 15.410 62.770 1.00 0.00 ATOM 4516 C1 POP 37 41.260 14.210 62.130 1.00 0.00 ATOM 4517 HA POP 37 41.550 15.140 61.610 1.00 0.00 ATOM 4518 HB POP 37 40.510 14.490 62.910 1.00 0.00 ATOM 4519 C2 POP 37 40.580 13.400 61.010 1.00 0.00 ATOM 4520 HS POP 37 40.030 12.580 61.520 1.00 0.00 ATOM 4521 O21 POP 37 41.600 13.060 60.070 1.00 0.00 ATOM 4522 C21 POP 37 41.070 12.150 59.250 1.00 0.00 ATOM 4523 O22 POP 37 39.980 11.600 59.310 1.00 0.00 ATOM 4524 C22 POP 37 41.980 12.000 58.040 1.00 0.00 ATOM 4525 H2R POP 37 42.910 11.410 58.170 1.00 0.00 ATOM 4526 H2S POP 37 42.240 13.040 57.750 1.00 0.00 ATOM 4527 C3 POP 37 39.510 14.210 60.270 1.00 0.00 ATOM 4528 HX POP 37 38.910 14.780 61.020 1.00 0.00 ATOM 4529 HY POP 37 38.780 13.510 59.820 1.00 0.00 ATOM 4530 O31 POP 37 40.030 15.070 59.260 1.00 0.00 ATOM 4531 C31 POP 37 39.070 15.850 58.760 1.00 0.00 ATOM 4532 O32 POP 37 37.900 15.840 59.110 1.00 0.00 ATOM 4533 C32 POP 37 39.590 16.880 57.760 1.00 0.00 ATOM 4534 H2X POP 37 40.290 17.600 58.220 1.00 0.00 ATOM 4535 H2Y POP 37 38.650 17.330 57.370 1.00 0.00 ATOM 4536 C23 POP 37 41.140 11.430 56.890 1.00 0.00 ATOM 4537 H3R POP 37 40.110 11.860 56.830 1.00 0.00 ATOM 4538 H3S POP 37 40.910 10.350 57.000 1.00 0.00 ATOM 4539 C24 POP 37 41.780 11.760 55.550 1.00 0.00 ATOM 4540 H4R POP 37 42.880 11.680 55.660 1.00 0.00 ATOM 4541 H4S POP 37 41.590 12.810 55.210 1.00 0.00 ATOM 4542 C25 POP 37 41.370 10.720 54.510 1.00 0.00 ATOM 4543 H5R POP 37 40.290 10.490 54.680 1.00 0.00 ATOM 4544 H5S POP 37 41.980 9.800 54.650 1.00 0.00 ATOM 4545 C26 POP 37 41.460 11.230 53.070 1.00 0.00 ATOM 4546 H6R POP 37 42.530 11.390 52.820 1.00 0.00 ATOM 4547 H6S POP 37 40.840 12.150 52.960 1.00 0.00 ATOM 4548 C27 POP 37 40.940 10.260 52.020 1.00 0.00 ATOM 4549 H7R POP 37 39.830 10.250 52.090 1.00 0.00 ATOM 4550 H7S POP 37 41.390 9.250 52.080 1.00 0.00 ATOM 4551 C28 POP 37 41.420 10.730 50.650 1.00 0.00 ATOM 4552 H8R POP 37 42.520 10.530 50.600 1.00 0.00 ATOM 4553 H8S POP 37 41.270 11.830 50.580 1.00 0.00 ATOM 4554 C29 POP 37 40.650 10.190 49.480 1.00 0.00 ATOM 4555 H91 POP 37 39.690 9.720 49.750 1.00 0.00 ATOM 4556 0C21 POP 37 41.100 9.880 48.260 1.00 0.00 ATOM 4557 1H10 POP 37 40.440 9.480 47.470 1.00 0.00 ATOM 4558 1C21 POP 37 42.470 10.280 47.790 1.00 0.00 ATOM 4559 H11R POP 37 43.240 10.360 48.590 1.00 0.00 ATOM 4560 H11S POP 37 42.460 11.220 47.210 1.00 0.00 ATOM 4561 2C21 POP 37 43.220 9.370 46.810 1.00 0.00 ATOM 4562 H12R POP 37 42.530 9.100 45.990 1.00 0.00 ATOM 4563 H12S POP 37 43.390 8.430 47.380 1.00 0.00 ATOM 4564 3C21 POP 37 44.490 10.090 46.360 1.00 0.00 ATOM 4565 H13R POP 37 45.030 10.290 47.320 1.00 0.00 ATOM 4566 H13S POP 37 44.270 11.120 46.000 1.00 0.00 ATOM 4567 4C21 POP 37 45.250 9.320 45.280 1.00 0.00 ATOM 4568 H14R POP 37 44.490 8.990 44.540 1.00 0.00 ATOM 4569 H14S POP 37 45.700 8.420 45.740 1.00 0.00 ATOM 4570 5C21 POP 37 46.270 10.150 44.490 1.00 0.00 ATOM 4571 H15R POP 37 45.730 11.030 44.060 1.00 0.00 ATOM 4572 H15S POP 37 46.640 9.560 43.620 1.00 0.00 ATOM 4573 6C21 POP 37 47.360 10.820 45.320 1.00 0.00 ATOM 4574 H16R POP 37 47.130 10.840 46.410 1.00 0.00 ATOM 4575 H16S POP 37 47.370 11.890 45.000 1.00 0.00 ATOM 4576 7C21 POP 37 48.580 9.900 45.320 1.00 0.00 ATOM 4577 H17R POP 37 48.830 9.790 44.250 1.00 0.00 ATOM 4578 H17S POP 37 48.160 8.970 45.770 1.00 0.00 ATOM 4579 8C21 POP 37 49.840 10.250 46.110 1.00 0.00 ATOM 4580 H18R POP 37 50.630 9.570 45.730 1.00 0.00 ATOM 4581 H18S POP 37 49.560 10.040 47.160 1.00 0.00 ATOM 4582 H18T POP 37 50.250 11.280 45.970 1.00 0.00 ATOM 4583 C33 POP 37 40.400 16.180 56.660 1.00 0.00 ATOM 4584 H3X POP 37 39.810 15.360 56.210 1.00 0.00 ATOM 4585 H3Y POP 37 41.270 15.680 57.120 1.00 0.00 ATOM 4586 C34 POP 37 40.990 17.030 55.540 1.00 0.00 ATOM 4587 H4X POP 37 41.790 17.680 55.950 1.00 0.00 ATOM 4588 H4Y POP 37 40.180 17.680 55.140 1.00 0.00 ATOM 4589 C35 POP 37 41.420 16.110 54.390 1.00 0.00 ATOM 4590 H5X POP 37 40.640 15.350 54.220 1.00 0.00 ATOM 4591 H5Y POP 37 42.310 15.550 54.740 1.00 0.00 ATOM 4592 C36 POP 37 41.860 16.800 53.090 1.00 0.00 ATOM 4593 H6X POP 37 42.520 16.130 52.500 1.00 0.00 ATOM 4594 H6Y POP 37 42.420 17.720 53.370 1.00 0.00 ATOM 4595 C37 POP 37 40.700 17.250 52.200 1.00 0.00 ATOM 4596 H7X POP 37 39.950 17.690 52.900 1.00 0.00 ATOM 4597 H7Y POP 37 40.260 16.320 51.790 1.00 0.00 ATOM 4598 C38 POP 37 41.040 18.250 51.100 1.00 0.00 ATOM 4599 H8X POP 37 41.580 19.140 51.480 1.00 0.00 ATOM 4600 H8Y POP 37 40.100 18.610 50.610 1.00 0.00 ATOM 4601 C39 POP 37 41.990 17.750 50.020 1.00 0.00 ATOM 4602 H9X POP 37 41.350 17.070 49.410 1.00 0.00 ATOM 4603 H9Y POP 37 42.840 17.190 50.480 1.00 0.00 ATOM 4604 0C31 POP 37 42.580 18.870 49.160 1.00 0.00 ATOM 4605 H10X POP 37 43.110 18.420 48.300 1.00 0.00 ATOM 4606 H10Y POP 37 43.370 19.470 49.660 1.00 0.00 ATOM 4607 1C31 POP 37 41.510 19.830 48.630 1.00 0.00 ATOM 4608 H11X POP 37 40.920 20.320 49.430 1.00 0.00 ATOM 4609 H11Y POP 37 40.750 19.240 48.080 1.00 0.00 ATOM 4610 2C31 POP 37 42.170 20.860 47.710 1.00 0.00 ATOM 4611 H12X POP 37 42.540 20.360 46.790 1.00 0.00 ATOM 4612 H12Y POP 37 43.060 21.220 48.270 1.00 0.00 ATOM 4613 3C31 POP 37 41.190 21.950 47.300 1.00 0.00 ATOM 4614 H13X POP 37 40.540 22.200 48.170 1.00 0.00 ATOM 4615 H13Y POP 37 40.570 21.600 46.440 1.00 0.00 ATOM 4616 4C31 POP 37 41.910 23.200 46.770 1.00 0.00 ATOM 4617 H14X POP 37 42.540 23.730 47.510 1.00 0.00 ATOM 4618 H14Y POP 37 41.210 23.940 46.330 1.00 0.00 ATOM 4619 5C31 POP 37 42.900 22.860 45.650 1.00 0.00 ATOM 4620 H15X POP 37 42.390 22.520 44.720 1.00 0.00 ATOM 4621 H15Y POP 37 43.620 22.100 46.000 1.00 0.00 ATOM 4622 6C31 POP 37 43.820 24.010 45.260 1.00 0.00 ATOM 4623 H16X POP 37 44.070 24.570 46.180 1.00 0.00 ATOM 4624 H16Y POP 37 43.400 24.660 44.460 1.00 0.00 ATOM 4625 H16Z POP 37 44.800 23.600 44.920 1.00 0.00 ATOM 4626 N POP 38 60.030 41.530 66.170 1.00 0.00 ATOM 4627 HN1 POP 38 59.460 41.790 65.350 1.00 0.00 ATOM 4628 HN2 POP 38 59.840 42.280 66.870 1.00 0.00 ATOM 4629 HN3 POP 38 61.050 41.360 66.020 1.00 0.00 ATOM 4630 C12 POP 38 59.410 40.300 66.790 1.00 0.00 ATOM 4631 H12A POP 38 58.380 40.620 67.060 1.00 0.00 ATOM 4632 H12B POP 38 60.070 40.000 67.630 1.00 0.00 ATOM 4633 C11 POP 38 59.270 39.170 65.770 1.00 0.00 ATOM 4634 H11A POP 38 58.680 39.550 64.900 1.00 0.00 ATOM 4635 H11B POP 38 58.710 38.410 66.340 1.00 0.00 ATOM 4636 P POP 38 60.590 37.610 64.210 1.00 0.00 ATOM 4637 O13 POP 38 61.510 36.700 64.940 1.00 0.00 ATOM 4638 O14 POP 38 59.280 37.010 63.880 1.00 0.00 ATOM 4639 O11 POP 38 61.170 38.240 62.860 1.00 0.00 ATOM 4640 O12 POP 38 60.560 38.840 65.230 1.00 0.00 ATOM 4641 C1 POP 38 62.580 38.420 62.740 1.00 0.00 ATOM 4642 HA POP 38 62.910 38.450 61.680 1.00 0.00 ATOM 4643 HB POP 38 63.110 37.610 63.270 1.00 0.00 ATOM 4644 C2 POP 38 63.080 39.760 63.310 1.00 0.00 ATOM 4645 HS POP 38 62.750 39.770 64.370 1.00 0.00 ATOM 4646 O21 POP 38 62.340 40.700 62.520 1.00 0.00 ATOM 4647 C21 POP 38 62.040 41.840 63.140 1.00 0.00 ATOM 4648 O22 POP 38 62.250 42.020 64.330 1.00 0.00 ATOM 4649 C22 POP 38 61.350 42.900 62.300 1.00 0.00 ATOM 4650 H2R POP 38 61.980 43.810 62.230 1.00 0.00 ATOM 4651 H2S POP 38 60.460 43.250 62.850 1.00 0.00 ATOM 4652 C3 POP 38 64.610 39.840 63.180 1.00 0.00 ATOM 4653 HX POP 38 64.930 39.280 64.090 1.00 0.00 ATOM 4654 HY POP 38 64.840 40.910 63.400 1.00 0.00 ATOM 4655 O31 POP 38 65.230 39.360 61.990 1.00 0.00 ATOM 4656 C31 POP 38 65.250 40.220 60.970 1.00 0.00 ATOM 4657 O32 POP 38 64.930 41.390 61.040 1.00 0.00 ATOM 4658 C32 POP 38 65.710 39.520 59.700 1.00 0.00 ATOM 4659 H2X POP 38 64.810 39.340 59.070 1.00 0.00 ATOM 4660 H2Y POP 38 66.210 38.600 60.080 1.00 0.00 ATOM 4661 C23 POP 38 60.950 42.470 60.890 1.00 0.00 ATOM 4662 H3R POP 38 60.070 43.060 60.560 1.00 0.00 ATOM 4663 H3S POP 38 60.680 41.400 60.840 1.00 0.00 ATOM 4664 C24 POP 38 62.010 42.900 59.870 1.00 0.00 ATOM 4665 H4R POP 38 62.900 42.260 60.060 1.00 0.00 ATOM 4666 H4S POP 38 62.260 43.960 60.080 1.00 0.00 ATOM 4667 C25 POP 38 61.570 42.700 58.410 1.00 0.00 ATOM 4668 H5R POP 38 60.550 43.050 58.160 1.00 0.00 ATOM 4669 H5S POP 38 61.520 41.590 58.300 1.00 0.00 ATOM 4670 C26 POP 38 62.580 43.300 57.430 1.00 0.00 ATOM 4671 H6R POP 38 63.330 42.490 57.320 1.00 0.00 ATOM 4672 H6S POP 38 63.130 44.190 57.810 1.00 0.00 ATOM 4673 C27 POP 38 61.930 43.570 56.070 1.00 0.00 ATOM 4674 H7R POP 38 61.220 44.410 56.250 1.00 0.00 ATOM 4675 H7S POP 38 61.380 42.630 55.840 1.00 0.00 ATOM 4676 C28 POP 38 62.910 44.030 55.000 1.00 0.00 ATOM 4677 H8R POP 38 63.910 43.570 54.910 1.00 0.00 ATOM 4678 H8S POP 38 63.160 45.100 55.210 1.00 0.00 ATOM 4679 C29 POP 38 62.150 43.920 53.710 1.00 0.00 ATOM 4680 H91 POP 38 61.540 43.000 53.640 1.00 0.00 ATOM 4681 0C21 POP 38 61.990 44.860 52.770 1.00 0.00 ATOM 4682 1H10 POP 38 61.470 44.740 51.810 1.00 0.00 ATOM 4683 1C21 POP 38 62.570 46.250 52.790 1.00 0.00 ATOM 4684 H11R POP 38 63.550 46.200 53.300 1.00 0.00 ATOM 4685 H11S POP 38 61.930 46.940 53.370 1.00 0.00 ATOM 4686 2C21 POP 38 62.800 46.760 51.370 1.00 0.00 ATOM 4687 H12R POP 38 61.880 46.570 50.780 1.00 0.00 ATOM 4688 H12S POP 38 63.710 46.320 50.900 1.00 0.00 ATOM 4689 3C21 POP 38 63.100 48.270 51.350 1.00 0.00 ATOM 4690 H13R POP 38 63.820 48.560 52.140 1.00 0.00 ATOM 4691 H13S POP 38 62.050 48.610 51.520 1.00 0.00 ATOM 4692 4C21 POP 38 63.640 48.800 50.030 1.00 0.00 ATOM 4693 H14R POP 38 64.700 48.490 49.880 1.00 0.00 ATOM 4694 H14S POP 38 63.600 49.910 50.100 1.00 0.00 ATOM 4695 5C21 POP 38 62.980 48.270 48.760 1.00 0.00 ATOM 4696 H15R POP 38 61.890 48.200 48.950 1.00 0.00 ATOM 4697 H15S POP 38 63.360 47.250 48.530 1.00 0.00 ATOM 4698 6C21 POP 38 63.290 49.030 47.470 1.00 0.00 ATOM 4699 H16R POP 38 64.380 49.200 47.290 1.00 0.00 ATOM 4700 H16S POP 38 62.950 50.080 47.620 1.00 0.00 ATOM 4701 7C21 POP 38 62.520 48.540 46.240 1.00 0.00 ATOM 4702 H17R POP 38 61.450 48.840 46.350 1.00 0.00 ATOM 4703 H17S POP 38 62.470 47.440 46.080 1.00 0.00 ATOM 4704 8C21 POP 38 62.960 49.200 44.930 1.00 0.00 ATOM 4705 H18R POP 38 62.500 48.750 44.030 1.00 0.00 ATOM 4706 H18S POP 38 64.050 49.120 44.750 1.00 0.00 ATOM 4707 H18T POP 38 62.770 50.290 44.980 1.00 0.00 ATOM 4708 C33 POP 38 66.730 40.290 58.870 1.00 0.00 ATOM 4709 H3X POP 38 67.400 39.450 58.560 1.00 0.00 ATOM 4710 H3Y POP 38 67.310 41.040 59.450 1.00 0.00 ATOM 4711 C34 POP 38 66.170 40.910 57.590 1.00 0.00 ATOM 4712 H4X POP 38 65.640 41.870 57.780 1.00 0.00 ATOM 4713 H4Y POP 38 65.480 40.130 57.200 1.00 0.00 ATOM 4714 C35 POP 38 67.200 41.120 56.490 1.00 0.00 ATOM 4715 H5X POP 38 67.600 40.110 56.260 1.00 0.00 ATOM 4716 H5Y POP 38 67.990 41.880 56.660 1.00 0.00 ATOM 4717 C36 POP 38 66.630 41.380 55.090 1.00 0.00 ATOM 4718 H6X POP 38 66.030 42.320 55.100 1.00 0.00 ATOM 4719 H6Y POP 38 66.010 40.470 54.970 1.00 0.00 ATOM 4720 C37 POP 38 67.740 41.550 54.050 1.00 0.00 ATOM 4721 H7X POP 38 68.210 40.590 53.740 1.00 0.00 ATOM 4722 H7Y POP 38 68.530 42.190 54.500 1.00 0.00 ATOM 4723 C38 POP 38 67.250 41.900 52.650 1.00 0.00 ATOM 4724 H8X POP 38 66.640 42.820 52.820 1.00 0.00 ATOM 4725 H8Y POP 38 66.680 41.030 52.240 1.00 0.00 ATOM 4726 C39 POP 38 68.310 42.320 51.630 1.00 0.00 ATOM 4727 H9X POP 38 68.310 43.430 51.570 1.00 0.00 ATOM 4728 H9Y POP 38 68.070 41.860 50.650 1.00 0.00 ATOM 4729 0C31 POP 38 69.750 41.890 51.920 1.00 0.00 ATOM 4730 H10X POP 38 69.820 40.810 52.180 1.00 0.00 ATOM 4731 H10Y POP 38 70.110 42.440 52.820 1.00 0.00 ATOM 4732 1C31 POP 38 70.600 42.070 50.670 1.00 0.00 ATOM 4733 H11X POP 38 70.220 41.280 49.990 1.00 0.00 ATOM 4734 H11Y POP 38 71.670 41.760 50.710 1.00 0.00 ATOM 4735 2C31 POP 38 70.520 43.470 50.050 1.00 0.00 ATOM 4736 H12X POP 38 69.490 43.720 49.740 1.00 0.00 ATOM 4737 H12Y POP 38 71.060 43.330 49.080 1.00 0.00 ATOM 4738 3C31 POP 38 71.100 44.590 50.900 1.00 0.00 ATOM 4739 H13X POP 38 72.040 44.150 51.300 1.00 0.00 ATOM 4740 H13Y POP 38 70.430 44.890 51.740 1.00 0.00 ATOM 4741 4C31 POP 38 71.430 45.870 50.130 1.00 0.00 ATOM 4742 H14X POP 38 70.590 46.160 49.460 1.00 0.00 ATOM 4743 H14Y POP 38 72.300 45.530 49.530 1.00 0.00 ATOM 4744 5C31 POP 38 71.870 47.100 50.930 1.00 0.00 ATOM 4745 H15X POP 38 72.570 46.710 51.700 1.00 0.00 ATOM 4746 H15Y POP 38 70.930 47.440 51.420 1.00 0.00 ATOM 4747 6C31 POP 38 72.490 48.300 50.220 1.00 0.00 ATOM 4748 H16X POP 38 73.010 48.930 50.970 1.00 0.00 ATOM 4749 H16Y POP 38 71.650 48.880 49.780 1.00 0.00 ATOM 4750 H16Z POP 38 73.120 48.010 49.350 1.00 0.00 ATOM 4751 N POP 39 21.010 7.780 62.690 1.00 0.00 ATOM 4752 HN1 POP 39 21.380 8.580 63.240 1.00 0.00 ATOM 4753 HN2 POP 39 21.660 7.530 61.910 1.00 0.00 ATOM 4754 HN3 POP 39 20.140 8.030 62.190 1.00 0.00 ATOM 4755 C12 POP 39 20.890 6.530 63.540 1.00 0.00 ATOM 4756 H12A POP 39 21.030 5.690 62.830 1.00 0.00 ATOM 4757 H12B POP 39 19.830 6.420 63.840 1.00 0.00 ATOM 4758 C11 POP 39 21.950 6.380 64.640 1.00 0.00 ATOM 4759 H11A POP 39 21.760 5.430 65.180 1.00 0.00 ATOM 4760 H11B POP 39 21.790 7.070 65.490 1.00 0.00 ATOM 4761 P POP 39 24.500 6.170 65.010 1.00 0.00 ATOM 4762 O13 POP 39 24.160 6.740 66.330 1.00 0.00 ATOM 4763 O14 POP 39 24.730 4.710 65.010 1.00 0.00 ATOM 4764 O11 POP 39 25.600 7.140 64.390 1.00 0.00 ATOM 4765 O12 POP 39 23.250 6.460 64.050 1.00 0.00 ATOM 4766 C1 POP 39 25.240 8.450 63.940 1.00 0.00 ATOM 4767 HA POP 39 26.120 9.100 64.160 1.00 0.00 ATOM 4768 HB POP 39 24.270 8.820 64.330 1.00 0.00 ATOM 4769 C2 POP 39 24.980 8.360 62.430 1.00 0.00 ATOM 4770 HS POP 39 24.040 7.800 62.250 1.00 0.00 ATOM 4771 O21 POP 39 26.170 7.800 61.870 1.00 0.00 ATOM 4772 C21 POP 39 25.920 7.140 60.740 1.00 0.00 ATOM 4773 O22 POP 39 24.840 6.710 60.370 1.00 0.00 ATOM 4774 C22 POP 39 27.120 7.060 59.810 1.00 0.00 ATOM 4775 H2R POP 39 27.920 6.520 60.360 1.00 0.00 ATOM 4776 H2S POP 39 27.490 8.100 59.680 1.00 0.00 ATOM 4777 C3 POP 39 24.750 9.740 61.790 1.00 0.00 ATOM 4778 HX POP 39 25.650 10.350 62.010 1.00 0.00 ATOM 4779 HY POP 39 23.880 10.210 62.280 1.00 0.00 ATOM 4780 O31 POP 39 24.520 9.800 60.380 1.00 0.00 ATOM 4781 C31 POP 39 23.330 9.370 59.940 1.00 0.00 ATOM 4782 O32 POP 39 22.580 8.610 60.530 1.00 0.00 ATOM 4783 C32 POP 39 23.040 10.080 58.620 1.00 0.00 ATOM 4784 H2X POP 39 22.960 9.290 57.840 1.00 0.00 ATOM 4785 H2Y POP 39 23.720 10.920 58.370 1.00 0.00 ATOM 4786 C23 POP 39 26.620 6.520 58.470 1.00 0.00 ATOM 4787 H3R POP 39 25.630 6.960 58.210 1.00 0.00 ATOM 4788 H3S POP 39 26.370 5.440 58.510 1.00 0.00 ATOM 4789 C24 POP 39 27.530 6.700 57.250 1.00 0.00 ATOM 4790 H4R POP 39 27.330 5.900 56.510 1.00 0.00 ATOM 4791 H4S POP 39 28.540 6.460 57.650 1.00 0.00 ATOM 4792 C25 POP 39 27.570 8.150 56.760 1.00 0.00 ATOM 4793 H5R POP 39 28.290 8.250 55.920 1.00 0.00 ATOM 4794 H5S POP 39 27.840 8.870 57.560 1.00 0.00 ATOM 4795 C26 POP 39 26.260 8.710 56.190 1.00 0.00 ATOM 4796 H6R POP 39 26.450 9.710 55.750 1.00 0.00 ATOM 4797 H6S POP 39 25.550 8.860 57.030 1.00 0.00 ATOM 4798 C27 POP 39 25.480 7.920 55.140 1.00 0.00 ATOM 4799 H7R POP 39 25.160 6.960 55.600 1.00 0.00 ATOM 4800 H7S POP 39 26.060 7.680 54.230 1.00 0.00 ATOM 4801 C28 POP 39 24.250 8.630 54.560 1.00 0.00 ATOM 4802 H8R POP 39 24.630 9.660 54.370 1.00 0.00 ATOM 4803 H8S POP 39 23.380 8.760 55.230 1.00 0.00 ATOM 4804 C29 POP 39 23.740 8.040 53.270 1.00 0.00 ATOM 4805 H91 POP 39 24.370 7.280 52.790 1.00 0.00 ATOM 4806 0C21 POP 39 22.590 8.350 52.660 1.00 0.00 ATOM 4807 1H10 POP 39 22.490 7.830 51.700 1.00 0.00 ATOM 4808 1C21 POP 39 21.520 9.270 53.180 1.00 0.00 ATOM 4809 H11R POP 39 21.930 9.810 54.060 1.00 0.00 ATOM 4810 H11S POP 39 20.760 8.640 53.680 1.00 0.00 ATOM 4811 2C21 POP 39 20.790 10.180 52.190 1.00 0.00 ATOM 4812 H12R POP 39 21.510 10.950 51.830 1.00 0.00 ATOM 4813 H12S POP 39 20.050 10.760 52.780 1.00 0.00 ATOM 4814 3C21 POP 39 20.260 9.470 50.940 1.00 0.00 ATOM 4815 H13R POP 39 21.110 8.910 50.490 1.00 0.00 ATOM 4816 H13S POP 39 19.920 10.320 50.310 1.00 0.00 ATOM 4817 4C21 POP 39 19.030 8.580 51.100 1.00 0.00 ATOM 4818 H14R POP 39 18.180 9.010 51.670 1.00 0.00 ATOM 4819 H14S POP 39 19.490 7.760 51.700 1.00 0.00 ATOM 4820 5C21 POP 39 18.620 7.930 49.770 1.00 0.00 ATOM 4821 H15R POP 39 18.400 8.830 49.140 1.00 0.00 ATOM 4822 H15S POP 39 17.720 7.310 49.980 1.00 0.00 ATOM 4823 6C21 POP 39 19.670 7.030 49.120 1.00 0.00 ATOM 4824 H16R POP 39 19.910 6.310 49.930 1.00 0.00 ATOM 4825 H16S POP 39 20.490 7.670 48.730 1.00 0.00 ATOM 4826 7C21 POP 39 19.140 6.240 47.920 1.00 0.00 ATOM 4827 H17R POP 39 18.900 7.040 47.190 1.00 0.00 ATOM 4828 H17S POP 39 18.260 5.600 48.130 1.00 0.00 ATOM 4829 8C21 POP 39 20.170 5.360 47.210 1.00 0.00 ATOM 4830 H18R POP 39 21.050 5.940 46.870 1.00 0.00 ATOM 4831 H18S POP 39 19.640 4.890 46.360 1.00 0.00 ATOM 4832 H18T POP 39 20.460 4.540 47.910 1.00 0.00 ATOM 4833 C33 POP 39 21.690 10.800 58.670 1.00 0.00 ATOM 4834 H3X POP 39 21.850 11.710 59.300 1.00 0.00 ATOM 4835 H3Y POP 39 20.910 10.170 59.140 1.00 0.00 ATOM 4836 C34 POP 39 21.250 11.090 57.230 1.00 0.00 ATOM 4837 H4X POP 39 20.910 10.140 56.760 1.00 0.00 ATOM 4838 H4Y POP 39 22.080 11.570 56.680 1.00 0.00 ATOM 4839 C35 POP 39 20.120 12.110 57.220 1.00 0.00 ATOM 4840 H5X POP 39 20.400 13.090 57.670 1.00 0.00 ATOM 4841 H5Y POP 39 19.240 11.800 57.830 1.00 0.00 ATOM 4842 C36 POP 39 19.640 12.390 55.800 1.00 0.00 ATOM 4843 H6X POP 39 19.410 11.420 55.300 1.00 0.00 ATOM 4844 H6Y POP 39 20.540 12.820 55.310 1.00 0.00 ATOM 4845 C37 POP 39 18.550 13.450 55.660 1.00 0.00 ATOM 4846 H7X POP 39 18.900 14.430 56.050 1.00 0.00 ATOM 4847 H7Y POP 39 17.580 13.220 56.150 1.00 0.00 ATOM 4848 C38 POP 39 18.190 13.990 54.270 1.00 0.00 ATOM 4849 H8X POP 39 17.440 14.800 54.370 1.00 0.00 ATOM 4850 H8Y POP 39 17.730 13.150 53.700 1.00 0.00 ATOM 4851 C39 POP 39 19.390 14.470 53.460 1.00 0.00 ATOM 4852 H9X POP 39 19.950 13.530 53.310 1.00 0.00 ATOM 4853 H9Y POP 39 20.080 15.160 53.990 1.00 0.00 ATOM 4854 0C31 POP 39 19.130 15.040 52.060 1.00 0.00 ATOM 4855 H10X POP 39 18.590 16.000 52.140 1.00 0.00 ATOM 4856 H10Y POP 39 18.550 14.260 51.510 1.00 0.00 ATOM 4857 1C31 POP 39 20.410 15.300 51.260 1.00 0.00 ATOM 4858 H11X POP 39 21.020 14.410 51.000 1.00 0.00 ATOM 4859 H11Y POP 39 21.040 16.060 51.760 1.00 0.00 ATOM 4860 2C31 POP 39 20.070 16.050 49.970 1.00 0.00 ATOM 4861 H12X POP 39 20.120 17.160 50.030 1.00 0.00 ATOM 4862 H12Y POP 39 19.020 15.850 49.640 1.00 0.00 ATOM 4863 3C31 POP 39 20.970 15.610 48.820 1.00 0.00 ATOM 4864 H13X POP 39 20.890 14.520 48.600 1.00 0.00 ATOM 4865 H13Y POP 39 22.030 15.730 49.120 1.00 0.00 ATOM 4866 4C31 POP 39 20.640 16.270 47.480 1.00 0.00 ATOM 4867 H14X POP 39 20.510 17.360 47.620 1.00 0.00 ATOM 4868 H14Y POP 39 19.610 15.990 47.160 1.00 0.00 ATOM 4869 5C31 POP 39 21.740 16.110 46.430 1.00 0.00 ATOM 4870 H15X POP 39 22.010 15.030 46.400 1.00 0.00 ATOM 4871 H15Y POP 39 22.610 16.760 46.700 1.00 0.00 ATOM 4872 6C31 POP 39 21.320 16.460 45.010 1.00 0.00 ATOM 4873 H16X POP 39 22.050 16.310 44.190 1.00 0.00 ATOM 4874 H16Y POP 39 20.940 17.500 45.050 1.00 0.00 ATOM 4875 H16Z POP 39 20.520 15.760 44.670 1.00 0.00 ATOM 4876 N POP 40 56.710 30.330 65.890 1.00 0.00 ATOM 4877 HN1 POP 40 57.460 29.780 66.360 1.00 0.00 ATOM 4878 HN2 POP 40 56.240 29.560 65.390 1.00 0.00 ATOM 4879 HN3 POP 40 57.120 30.990 65.200 1.00 0.00 ATOM 4880 C12 POP 40 55.820 31.000 66.910 1.00 0.00 ATOM 4881 H12A POP 40 56.340 31.910 67.270 1.00 0.00 ATOM 4882 H12B POP 40 55.720 30.260 67.740 1.00 0.00 ATOM 4883 C11 POP 40 54.400 31.300 66.430 1.00 0.00 ATOM 4884 H11A POP 40 54.450 32.080 65.650 1.00 0.00 ATOM 4885 H11B POP 40 53.850 31.600 67.350 1.00 0.00 ATOM 4886 P POP 40 52.230 30.370 65.690 1.00 0.00 ATOM 4887 O13 POP 40 51.930 31.820 65.670 1.00 0.00 ATOM 4888 O14 POP 40 51.550 29.650 66.790 1.00 0.00 ATOM 4889 O11 POP 40 51.760 29.610 64.370 1.00 0.00 ATOM 4890 O12 POP 40 53.820 30.180 65.760 1.00 0.00 ATOM 4891 C1 POP 40 52.400 28.380 64.020 1.00 0.00 ATOM 4892 HA POP 40 53.460 28.260 64.320 1.00 0.00 ATOM 4893 HB POP 40 52.360 28.350 62.910 1.00 0.00 ATOM 4894 C2 POP 40 51.630 27.090 64.350 1.00 0.00 ATOM 4895 HS POP 40 52.070 26.830 65.330 1.00 0.00 ATOM 4896 O21 POP 40 51.890 26.100 63.350 1.00 0.00 ATOM 4897 C21 POP 40 51.660 24.860 63.800 1.00 0.00 ATOM 4898 O22 POP 40 51.290 24.650 64.940 1.00 0.00 ATOM 4899 C22 POP 40 52.060 23.850 62.740 1.00 0.00 ATOM 4900 H2R POP 40 51.890 22.830 63.150 1.00 0.00 ATOM 4901 H2S POP 40 53.160 23.870 62.590 1.00 0.00 ATOM 4902 C3 POP 40 50.140 27.440 64.490 1.00 0.00 ATOM 4903 HX POP 40 50.260 28.200 65.290 1.00 0.00 ATOM 4904 HY POP 40 49.520 26.620 64.910 1.00 0.00 ATOM 4905 O31 POP 40 49.690 28.080 63.290 1.00 0.00 ATOM 4906 C31 POP 40 48.750 27.350 62.690 1.00 0.00 ATOM 4907 O32 POP 40 48.530 26.170 62.910 1.00 0.00 ATOM 4908 C32 POP 40 48.110 28.210 61.610 1.00 0.00 ATOM 4909 H2X POP 40 48.950 28.510 60.940 1.00 0.00 ATOM 4910 H2Y POP 40 47.670 29.040 62.210 1.00 0.00 ATOM 4911 C23 POP 40 51.090 23.910 61.560 1.00 0.00 ATOM 4912 H3R POP 40 50.910 24.970 61.290 1.00 0.00 ATOM 4913 H3S POP 40 50.110 23.450 61.830 1.00 0.00 ATOM 4914 C24 POP 40 51.530 23.090 60.350 1.00 0.00 ATOM 4915 H4R POP 40 50.670 22.990 59.660 1.00 0.00 ATOM 4916 H4S POP 40 51.820 22.050 60.650 1.00 0.00 ATOM 4917 C25 POP 40 52.580 23.710 59.430 1.00 0.00 ATOM 4918 H5R POP 40 53.490 23.890 60.030 1.00 0.00 ATOM 4919 H5S POP 40 52.160 24.680 59.080 1.00 0.00 ATOM 4920 C26 POP 40 52.870 22.840 58.210 1.00 0.00 ATOM 4921 H6R POP 40 51.900 22.790 57.670 1.00 0.00 ATOM 4922 H6S POP 40 53.130 21.810 58.560 1.00 0.00 ATOM 4923 C27 POP 40 54.080 23.440 57.480 1.00 0.00 ATOM 4924 H7R POP 40 54.930 23.430 58.200 1.00 0.00 ATOM 4925 H7S POP 40 53.840 24.500 57.270 1.00 0.00 ATOM 4926 C28 POP 40 54.290 22.640 56.190 1.00 0.00 ATOM 4927 H8R POP 40 53.230 22.540 55.860 1.00 0.00 ATOM 4928 H8S POP 40 54.770 21.680 56.470 1.00 0.00 ATOM 4929 C29 POP 40 55.150 23.450 55.260 1.00 0.00 ATOM 4930 H91 POP 40 55.940 23.990 55.790 1.00 0.00 ATOM 4931 0C21 POP 40 55.090 23.360 53.920 1.00 0.00 ATOM 4932 1H10 POP 40 55.660 24.120 53.360 1.00 0.00 ATOM 4933 1C21 POP 40 54.160 22.490 53.130 1.00 0.00 ATOM 4934 H11R POP 40 53.130 22.880 53.000 1.00 0.00 ATOM 4935 H11S POP 40 54.000 21.510 53.620 1.00 0.00 ATOM 4936 2C21 POP 40 54.780 22.430 51.730 1.00 0.00 ATOM 4937 H12R POP 40 55.530 21.620 51.660 1.00 0.00 ATOM 4938 H12S POP 40 55.000 23.450 51.330 1.00 0.00 ATOM 4939 3C21 POP 40 53.720 21.900 50.760 1.00 0.00 ATOM 4940 H13R POP 40 52.970 22.720 50.740 1.00 0.00 ATOM 4941 H13S POP 40 53.230 20.940 51.000 1.00 0.00 ATOM 4942 4C21 POP 40 54.240 21.750 49.320 1.00 0.00 ATOM 4943 H14R POP 40 53.420 21.390 48.660 1.00 0.00 ATOM 4944 H14S POP 40 54.970 20.920 49.310 1.00 0.00 ATOM 4945 5C21 POP 40 54.870 22.970 48.650 1.00 0.00 ATOM 4946 H15R POP 40 55.360 22.510 47.770 1.00 0.00 ATOM 4947 H15S POP 40 55.670 23.430 49.260 1.00 0.00 ATOM 4948 6C21 POP 40 53.830 24.050 48.340 1.00 0.00 ATOM 4949 H16R POP 40 53.270 24.140 49.300 1.00 0.00 ATOM 4950 H16S POP 40 53.090 23.720 47.580 1.00 0.00 ATOM 4951 7C21 POP 40 54.510 25.340 47.880 1.00 0.00 ATOM 4952 H17R POP 40 55.290 25.170 47.110 1.00 0.00 ATOM 4953 H17S POP 40 55.100 25.660 48.770 1.00 0.00 ATOM 4954 8C21 POP 40 53.600 26.470 47.410 1.00 0.00 ATOM 4955 H18R POP 40 52.690 26.090 46.900 1.00 0.00 ATOM 4956 H18S POP 40 54.160 27.120 46.710 1.00 0.00 ATOM 4957 H18T POP 40 53.280 27.200 48.190 1.00 0.00 ATOM 4958 C33 POP 40 47.060 27.510 60.750 1.00 0.00 ATOM 4959 H3X POP 40 46.220 27.020 61.280 1.00 0.00 ATOM 4960 H3Y POP 40 47.600 26.710 60.200 1.00 0.00 ATOM 4961 C34 POP 40 46.560 28.400 59.600 1.00 0.00 ATOM 4962 H4X POP 40 45.880 27.800 58.970 1.00 0.00 ATOM 4963 H4Y POP 40 47.290 28.650 58.810 1.00 0.00 ATOM 4964 C35 POP 40 45.910 29.680 60.130 1.00 0.00 ATOM 4965 H5X POP 40 46.530 30.390 60.720 1.00 0.00 ATOM 4966 H5Y POP 40 45.290 29.250 60.950 1.00 0.00 ATOM 4967 C36 POP 40 45.150 30.540 59.130 1.00 0.00 ATOM 4968 H6X POP 40 44.280 31.110 59.520 1.00 0.00 ATOM 4969 H6Y POP 40 44.740 29.990 58.250 1.00 0.00 ATOM 4970 C37 POP 40 46.130 31.570 58.560 1.00 0.00 ATOM 4971 H7X POP 40 47.020 30.940 58.380 1.00 0.00 ATOM 4972 H7Y POP 40 46.400 32.280 59.360 1.00 0.00 ATOM 4973 C38 POP 40 45.750 32.290 57.260 1.00 0.00 ATOM 4974 H8X POP 40 44.920 33.010 57.400 1.00 0.00 ATOM 4975 H8Y POP 40 45.540 31.480 56.520 1.00 0.00 ATOM 4976 C39 POP 40 46.930 33.000 56.600 1.00 0.00 ATOM 4977 H9X POP 40 47.780 32.280 56.590 1.00 0.00 ATOM 4978 H9Y POP 40 47.300 33.860 57.210 1.00 0.00 ATOM 4979 0C31 POP 40 46.860 33.480 55.150 1.00 0.00 ATOM 4980 H10X POP 40 46.770 32.610 54.460 1.00 0.00 ATOM 4981 H10Y POP 40 47.820 33.940 54.870 1.00 0.00 ATOM 4982 1C31 POP 40 45.650 34.390 54.900 1.00 0.00 ATOM 4983 H11X POP 40 45.520 35.110 55.740 1.00 0.00 ATOM 4984 H11Y POP 40 44.750 33.740 54.950 1.00 0.00 ATOM 4985 2C31 POP 40 45.530 35.090 53.550 1.00 0.00 ATOM 4986 H12X POP 40 45.790 34.350 52.760 1.00 0.00 ATOM 4987 H12Y POP 40 46.220 35.960 53.450 1.00 0.00 ATOM 4988 3C31 POP 40 44.130 35.620 53.280 1.00 0.00 ATOM 4989 H13X POP 40 44.110 36.590 53.820 1.00 0.00 ATOM 4990 H13Y POP 40 43.480 34.930 53.860 1.00 0.00 ATOM 4991 4C31 POP 40 43.860 35.890 51.790 1.00 0.00 ATOM 4992 H14X POP 40 44.380 35.090 51.220 1.00 0.00 ATOM 4993 H14Y POP 40 44.300 36.880 51.580 1.00 0.00 ATOM 4994 5C31 POP 40 42.380 35.910 51.420 1.00 0.00 ATOM 4995 H15X POP 40 42.450 36.170 50.350 1.00 0.00 ATOM 4996 H15Y POP 40 41.850 36.830 51.750 1.00 0.00 ATOM 4997 6C31 POP 40 41.490 34.720 51.810 1.00 0.00 ATOM 4998 H16X POP 40 41.940 33.740 51.550 1.00 0.00 ATOM 4999 H16Y POP 40 40.490 34.770 51.330 1.00 0.00 ATOM 5000 H16Z POP 40 41.350 34.690 52.910 1.00 0.00 ATOM 5001 N POP 41 53.710 19.070 65.590 1.00 0.00 ATOM 5002 HN1 POP 41 52.750 19.470 65.580 1.00 0.00 ATOM 5003 HN2 POP 41 53.670 18.190 66.160 1.00 0.00 ATOM 5004 HN3 POP 41 54.410 19.640 66.110 1.00 0.00 ATOM 5005 C12 POP 41 54.130 18.870 64.160 1.00 0.00 ATOM 5006 H12A POP 41 53.590 17.980 63.790 1.00 0.00 ATOM 5007 H12B POP 41 55.230 18.780 64.240 1.00 0.00 ATOM 5008 C11 POP 41 53.680 20.080 63.330 1.00 0.00 ATOM 5009 H11A POP 41 52.600 20.030 63.070 1.00 0.00 ATOM 5010 H11B POP 41 54.240 20.100 62.370 1.00 0.00 ATOM 5011 P POP 41 55.030 22.240 63.930 1.00 0.00 ATOM 5012 O13 POP 41 54.600 23.520 64.540 1.00 0.00 ATOM 5013 O14 POP 41 56.190 21.650 64.630 1.00 0.00 ATOM 5014 O11 POP 41 55.260 22.420 62.360 1.00 0.00 ATOM 5015 O12 POP 41 53.770 21.280 64.120 1.00 0.00 ATOM 5016 C1 POP 41 56.570 22.730 61.870 1.00 0.00 ATOM 5017 HA POP 41 56.620 22.400 60.810 1.00 0.00 ATOM 5018 HB POP 41 57.330 22.070 62.350 1.00 0.00 ATOM 5019 C2 POP 41 56.870 24.230 61.850 1.00 0.00 ATOM 5020 HS POP 41 56.880 24.510 62.920 1.00 0.00 ATOM 5021 O21 POP 41 55.750 24.970 61.350 1.00 0.00 ATOM 5022 C21 POP 41 55.890 26.290 61.480 1.00 0.00 ATOM 5023 O22 POP 41 56.820 26.880 62.000 1.00 0.00 ATOM 5024 C22 POP 41 54.680 27.070 60.970 1.00 0.00 ATOM 5025 H2R POP 41 54.770 28.150 61.190 1.00 0.00 ATOM 5026 H2S POP 41 53.710 26.670 61.350 1.00 0.00 ATOM 5027 C3 POP 41 58.160 24.490 61.050 1.00 0.00 ATOM 5028 HX POP 41 58.880 23.690 61.350 1.00 0.00 ATOM 5029 HY POP 41 58.600 25.460 61.360 1.00 0.00 ATOM 5030 O31 POP 41 57.960 24.420 59.640 1.00 0.00 ATOM 5031 C31 POP 41 59.110 24.340 58.970 1.00 0.00 ATOM 5032 O32 POP 41 60.220 24.240 59.480 1.00 0.00 ATOM 5033 C32 POP 41 58.740 24.350 57.500 1.00 0.00 ATOM 5034 H2X POP 41 58.440 25.380 57.210 1.00 0.00 ATOM 5035 H2Y POP 41 57.920 23.640 57.220 1.00 0.00 ATOM 5036 C23 POP 41 54.470 26.990 59.460 1.00 0.00 ATOM 5037 H3R POP 41 53.540 27.570 59.260 1.00 0.00 ATOM 5038 H3S POP 41 54.190 25.950 59.180 1.00 0.00 ATOM 5039 C24 POP 41 55.760 27.350 58.720 1.00 0.00 ATOM 5040 H4R POP 41 56.670 26.960 59.230 1.00 0.00 ATOM 5041 H4S POP 41 55.970 28.440 58.810 1.00 0.00 ATOM 5042 C25 POP 41 55.810 26.950 57.250 1.00 0.00 ATOM 5043 H5R POP 41 55.640 25.860 57.100 1.00 0.00 ATOM 5044 H5S POP 41 56.870 27.060 56.920 1.00 0.00 ATOM 5045 C26 POP 41 54.910 27.680 56.250 1.00 0.00 ATOM 5046 H6R POP 41 54.960 28.790 56.340 1.00 0.00 ATOM 5047 H6S POP 41 53.850 27.470 56.500 1.00 0.00 ATOM 5048 C27 POP 41 55.280 27.360 54.800 1.00 0.00 ATOM 5049 H7R POP 41 55.470 26.270 54.780 1.00 0.00 ATOM 5050 H7S POP 41 56.220 27.840 54.470 1.00 0.00 ATOM 5051 C28 POP 41 54.160 27.710 53.810 1.00 0.00 ATOM 5052 H8R POP 41 54.360 28.780 53.560 1.00 0.00 ATOM 5053 H8S POP 41 53.080 27.570 53.980 1.00 0.00 ATOM 5054 C29 POP 41 54.400 26.810 52.630 1.00 0.00 ATOM 5055 H91 POP 41 54.400 25.720 52.770 1.00 0.00 ATOM 5056 0C21 POP 41 54.610 27.280 51.390 1.00 0.00 ATOM 5057 1H10 POP 41 54.880 26.650 50.540 1.00 0.00 ATOM 5058 1C21 POP 41 54.820 28.720 51.000 1.00 0.00 ATOM 5059 H11R POP 41 55.550 29.230 51.660 1.00 0.00 ATOM 5060 H11S POP 41 53.870 29.290 51.050 1.00 0.00 ATOM 5061 2C21 POP 41 55.310 28.760 49.550 1.00 0.00 ATOM 5062 H12R POP 41 54.530 28.600 48.780 1.00 0.00 ATOM 5063 H12S POP 41 55.940 27.840 49.620 1.00 0.00 ATOM 5064 3C21 POP 41 56.320 29.890 49.330 1.00 0.00 ATOM 5065 H13R POP 41 57.220 29.760 49.970 1.00 0.00 ATOM 5066 H13S POP 41 55.880 30.870 49.600 1.00 0.00 ATOM 5067 4C21 POP 41 56.780 29.890 47.870 1.00 0.00 ATOM 5068 H14R POP 41 55.920 29.500 47.270 1.00 0.00 ATOM 5069 H14S POP 41 57.630 29.180 47.840 1.00 0.00 ATOM 5070 5C21 POP 41 57.290 31.230 47.340 1.00 0.00 ATOM 5071 H15R POP 41 57.840 31.090 46.390 1.00 0.00 ATOM 5072 H15S POP 41 58.060 31.600 48.050 1.00 0.00 ATOM 5073 6C21 POP 41 56.230 32.310 47.120 1.00 0.00 ATOM 5074 H16R POP 41 55.970 32.810 48.080 1.00 0.00 ATOM 5075 H16S POP 41 55.330 31.790 46.700 1.00 0.00 ATOM 5076 7C21 POP 41 56.690 33.460 46.230 1.00 0.00 ATOM 5077 H17R POP 41 55.920 34.260 46.340 1.00 0.00 ATOM 5078 H17S POP 41 56.780 33.120 45.170 1.00 0.00 ATOM 5079 8C21 POP 41 58.080 34.010 46.530 1.00 0.00 ATOM 5080 H18R POP 41 58.910 33.300 46.300 1.00 0.00 ATOM 5081 H18S POP 41 58.050 34.230 47.620 1.00 0.00 ATOM 5082 H18T POP 41 58.120 34.940 45.930 1.00 0.00 ATOM 5083 C33 POP 41 60.050 24.120 56.740 1.00 0.00 ATOM 5084 H3X POP 41 60.520 23.170 57.090 1.00 0.00 ATOM 5085 H3Y POP 41 60.770 24.910 57.030 1.00 0.00 ATOM 5086 C34 POP 41 59.900 24.120 55.220 1.00 0.00 ATOM 5087 H4X POP 41 60.530 23.270 54.870 1.00 0.00 ATOM 5088 H4Y POP 41 60.400 25.050 54.870 1.00 0.00 ATOM 5089 C35 POP 41 58.500 24.000 54.610 1.00 0.00 ATOM 5090 H5X POP 41 57.830 24.870 54.730 1.00 0.00 ATOM 5091 H5Y POP 41 57.870 23.180 55.020 1.00 0.00 ATOM 5092 C36 POP 41 58.470 23.600 53.130 1.00 0.00 ATOM 5093 H6X POP 41 57.570 22.980 52.930 1.00 0.00 ATOM 5094 H6Y POP 41 59.330 22.960 52.850 1.00 0.00 ATOM 5095 C37 POP 41 58.320 24.750 52.130 1.00 0.00 ATOM 5096 H7X POP 41 59.110 25.480 52.420 1.00 0.00 ATOM 5097 H7Y POP 41 57.320 25.230 52.150 1.00 0.00 ATOM 5098 C38 POP 41 58.500 24.210 50.710 1.00 0.00 ATOM 5099 H8X POP 41 57.650 23.530 50.460 1.00 0.00 ATOM 5100 H8Y POP 41 59.400 23.560 50.650 1.00 0.00 ATOM 5101 C39 POP 41 58.530 25.310 49.650 1.00 0.00 ATOM 5102 H9X POP 41 57.710 26.060 49.740 1.00 0.00 ATOM 5103 H9Y POP 41 58.510 24.840 48.640 1.00 0.00 ATOM 5104 0C31 POP 41 59.810 26.120 49.850 1.00 0.00 ATOM 5105 H10X POP 41 60.620 25.360 49.800 1.00 0.00 ATOM 5106 H10Y POP 41 59.890 26.600 50.850 1.00 0.00 ATOM 5107 1C31 POP 41 59.960 27.330 48.910 1.00 0.00 ATOM 5108 H11X POP 41 60.870 27.890 49.180 1.00 0.00 ATOM 5109 H11Y POP 41 59.140 28.030 49.180 1.00 0.00 ATOM 5110 2C31 POP 41 59.810 27.160 47.400 1.00 0.00 ATOM 5111 H12X POP 41 59.880 28.230 47.110 1.00 0.00 ATOM 5112 H12Y POP 41 58.780 26.860 47.100 1.00 0.00 ATOM 5113 3C31 POP 41 60.880 26.330 46.690 1.00 0.00 ATOM 5114 H13X POP 41 60.560 26.090 45.660 1.00 0.00 ATOM 5115 H13Y POP 41 60.980 25.370 47.240 1.00 0.00 ATOM 5116 4C31 POP 41 62.280 26.950 46.770 1.00 0.00 ATOM 5117 H14X POP 41 62.520 27.140 47.840 1.00 0.00 ATOM 5118 H14Y POP 41 62.230 27.940 46.250 1.00 0.00 ATOM 5119 5C31 POP 41 63.230 26.050 45.980 1.00 0.00 ATOM 5120 H15X POP 41 62.750 25.730 45.030 1.00 0.00 ATOM 5121 H15Y POP 41 63.490 25.090 46.490 1.00 0.00 ATOM 5122 6C31 POP 41 64.550 26.770 45.750 1.00 0.00 ATOM 5123 H16X POP 41 65.110 26.880 46.700 1.00 0.00 ATOM 5124 H16Y POP 41 64.500 27.790 45.300 1.00 0.00 ATOM 5125 H16Z POP 41 65.110 26.030 45.130 1.00 0.00 ATOM 5126 N POP 42 61.150 9.990 65.570 1.00 0.00 ATOM 5127 HN1 POP 42 61.730 9.980 66.430 1.00 0.00 ATOM 5128 HN2 POP 42 60.740 9.060 65.320 1.00 0.00 ATOM 5129 HN3 POP 42 61.770 10.250 64.780 1.00 0.00 ATOM 5130 C12 POP 42 60.100 11.070 65.460 1.00 0.00 ATOM 5131 H12A POP 42 59.340 11.010 66.270 1.00 0.00 ATOM 5132 H12B POP 42 59.650 10.770 64.490 1.00 0.00 ATOM 5133 C11 POP 42 60.710 12.470 65.450 1.00 0.00 ATOM 5134 H11A POP 42 61.360 12.770 66.310 1.00 0.00 ATOM 5135 H11B POP 42 59.830 13.120 65.640 1.00 0.00 ATOM 5136 P POP 42 61.890 14.270 64.180 1.00 0.00 ATOM 5137 O13 POP 42 63.220 14.340 64.830 1.00 0.00 ATOM 5138 O14 POP 42 60.750 15.080 64.660 1.00 0.00 ATOM 5139 O11 POP 42 62.110 14.610 62.630 1.00 0.00 ATOM 5140 O12 POP 42 61.430 12.740 64.240 1.00 0.00 ATOM 5141 C1 POP 42 61.190 15.380 61.840 1.00 0.00 ATOM 5142 HA POP 42 61.630 15.480 60.830 1.00 0.00 ATOM 5143 HB POP 42 60.970 16.320 62.380 1.00 0.00 ATOM 5144 C2 POP 42 59.880 14.600 61.670 1.00 0.00 ATOM 5145 HS POP 42 59.350 14.660 62.640 1.00 0.00 ATOM 5146 O21 POP 42 60.260 13.270 61.290 1.00 0.00 ATOM 5147 C21 POP 42 59.400 12.300 61.600 1.00 0.00 ATOM 5148 O22 POP 42 58.390 12.480 62.260 1.00 0.00 ATOM 5149 C22 POP 42 59.910 10.900 61.300 1.00 0.00 ATOM 5150 H2R POP 42 59.150 10.090 61.280 1.00 0.00 ATOM 5151 H2S POP 42 60.720 10.620 62.010 1.00 0.00 ATOM 5152 C3 POP 42 58.950 15.200 60.600 1.00 0.00 ATOM 5153 HX POP 42 59.590 15.290 59.690 1.00 0.00 ATOM 5154 HY POP 42 58.580 16.210 60.890 1.00 0.00 ATOM 5155 O31 POP 42 57.840 14.390 60.220 1.00 0.00 ATOM 5156 C31 POP 42 57.130 15.020 59.280 1.00 0.00 ATOM 5157 O32 POP 42 57.290 16.170 58.900 1.00 0.00 ATOM 5158 C32 POP 42 56.040 14.150 58.670 1.00 0.00 ATOM 5159 H2X POP 42 55.020 14.550 58.850 1.00 0.00 ATOM 5160 H2Y POP 42 56.230 13.230 59.270 1.00 0.00 ATOM 5161 C23 POP 42 60.630 10.850 59.950 1.00 0.00 ATOM 5162 H3R POP 42 61.220 9.920 59.790 1.00 0.00 ATOM 5163 H3S POP 42 61.340 11.700 59.860 1.00 0.00 ATOM 5164 C24 POP 42 59.650 11.050 58.800 1.00 0.00 ATOM 5165 H4R POP 42 59.160 12.050 58.750 1.00 0.00 ATOM 5166 H4S POP 42 58.890 10.260 58.940 1.00 0.00 ATOM 5167 C25 POP 42 60.220 10.940 57.380 1.00 0.00 ATOM 5168 H5R POP 42 60.860 10.040 57.220 1.00 0.00 ATOM 5169 H5S POP 42 60.950 11.780 57.330 1.00 0.00 ATOM 5170 C26 POP 42 59.040 11.120 56.420 1.00 0.00 ATOM 5171 H6R POP 42 58.570 12.100 56.610 1.00 0.00 ATOM 5172 H6S POP 42 58.230 10.400 56.680 1.00 0.00 ATOM 5173 C27 POP 42 59.520 11.000 54.980 1.00 0.00 ATOM 5174 H7R POP 42 60.190 10.130 54.800 1.00 0.00 ATOM 5175 H7S POP 42 60.130 11.920 54.860 1.00 0.00 ATOM 5176 C28 POP 42 58.410 10.950 53.930 1.00 0.00 ATOM 5177 H8R POP 42 58.870 11.140 52.940 1.00 0.00 ATOM 5178 H8S POP 42 57.770 11.820 54.190 1.00 0.00 ATOM 5179 C29 POP 42 57.690 9.630 53.860 1.00 0.00 ATOM 5180 H91 POP 42 57.270 9.300 54.820 1.00 0.00 ATOM 5181 0C21 POP 42 57.520 8.850 52.780 1.00 0.00 ATOM 5182 1H10 POP 42 56.870 7.960 52.840 1.00 0.00 ATOM 5183 1C21 POP 42 58.020 9.130 51.390 1.00 0.00 ATOM 5184 H11R POP 42 58.980 8.600 51.240 1.00 0.00 ATOM 5185 H11S POP 42 58.310 10.190 51.220 1.00 0.00 ATOM 5186 2C21 POP 42 56.910 8.850 50.380 1.00 0.00 ATOM 5187 H12R POP 42 56.080 9.600 50.480 1.00 0.00 ATOM 5188 H12S POP 42 56.450 7.870 50.610 1.00 0.00 ATOM 5189 3C21 POP 42 57.410 8.820 48.930 1.00 0.00 ATOM 5190 H13R POP 42 58.060 7.930 48.880 1.00 0.00 ATOM 5191 H13S POP 42 57.960 9.780 48.820 1.00 0.00 ATOM 5192 4C21 POP 42 56.320 8.800 47.860 1.00 0.00 ATOM 5193 H14R POP 42 55.470 9.460 48.140 1.00 0.00 ATOM 5194 H14S POP 42 55.840 7.810 47.950 1.00 0.00 ATOM 5195 5C21 POP 42 56.920 9.030 46.470 1.00 0.00 ATOM 5196 H15R POP 42 57.700 8.290 46.220 1.00 0.00 ATOM 5197 H15S POP 42 57.500 9.980 46.540 1.00 0.00 ATOM 5198 6C21 POP 42 56.010 9.030 45.240 1.00 0.00 ATOM 5199 H16R POP 42 55.600 8.010 45.050 1.00 0.00 ATOM 5200 H16S POP 42 56.610 9.260 44.340 1.00 0.00 ATOM 5201 7C21 POP 42 54.730 9.870 45.220 1.00 0.00 ATOM 5202 H17R POP 42 55.050 10.930 45.360 1.00 0.00 ATOM 5203 H17S POP 42 54.090 9.560 46.080 1.00 0.00 ATOM 5204 8C21 POP 42 53.810 9.730 44.010 1.00 0.00 ATOM 5205 H18R POP 42 53.330 8.740 43.910 1.00 0.00 ATOM 5206 H18S POP 42 54.480 9.940 43.150 1.00 0.00 ATOM 5207 H18T POP 42 53.080 10.560 44.110 1.00 0.00 ATOM 5208 C33 POP 42 56.370 13.880 57.200 1.00 0.00 ATOM 5209 H3X POP 42 55.980 12.880 56.890 1.00 0.00 ATOM 5210 H3Y POP 42 57.470 13.740 57.100 1.00 0.00 ATOM 5211 C34 POP 42 55.790 14.890 56.210 1.00 0.00 ATOM 5212 H4X POP 42 56.560 15.690 56.180 1.00 0.00 ATOM 5213 H4Y POP 42 54.820 15.240 56.610 1.00 0.00 ATOM 5214 C35 POP 42 55.730 14.430 54.750 1.00 0.00 ATOM 5215 H5X POP 42 56.680 14.000 54.390 1.00 0.00 ATOM 5216 H5Y POP 42 55.470 15.270 54.070 1.00 0.00 ATOM 5217 C36 POP 42 54.590 13.440 54.530 1.00 0.00 ATOM 5218 H6X POP 42 53.600 13.750 54.920 1.00 0.00 ATOM 5219 H6Y POP 42 54.830 12.510 55.090 1.00 0.00 ATOM 5220 C37 POP 42 54.350 13.190 53.030 1.00 0.00 ATOM 5221 H7X POP 42 55.360 13.220 52.560 1.00 0.00 ATOM 5222 H7Y POP 42 53.700 14.030 52.710 1.00 0.00 ATOM 5223 C38 POP 42 53.780 11.810 52.700 1.00 0.00 ATOM 5224 H8X POP 42 53.280 11.410 53.610 1.00 0.00 ATOM 5225 H8Y POP 42 54.630 11.120 52.520 1.00 0.00 ATOM 5226 C39 POP 42 52.820 11.820 51.510 1.00 0.00 ATOM 5227 H9X POP 42 51.980 12.500 51.760 1.00 0.00 ATOM 5228 H9Y POP 42 52.410 10.780 51.520 1.00 0.00 ATOM 5229 0C31 POP 42 53.560 12.160 50.220 1.00 0.00 ATOM 5230 H10X POP 42 54.420 11.510 49.960 1.00 0.00 ATOM 5231 H10Y POP 42 53.810 13.240 50.270 1.00 0.00 ATOM 5232 1C31 POP 42 52.710 11.910 48.970 1.00 0.00 ATOM 5233 H11X POP 42 51.700 12.360 49.120 1.00 0.00 ATOM 5234 H11Y POP 42 52.630 10.810 48.840 1.00 0.00 ATOM 5235 2C31 POP 42 53.270 12.420 47.640 1.00 0.00 ATOM 5236 H12X POP 42 52.670 11.940 46.830 1.00 0.00 ATOM 5237 H12Y POP 42 54.290 12.020 47.440 1.00 0.00 ATOM 5238 3C31 POP 42 53.180 13.920 47.360 1.00 0.00 ATOM 5239 H13X POP 42 53.880 14.590 47.910 1.00 0.00 ATOM 5240 H13Y POP 42 52.120 14.220 47.520 1.00 0.00 ATOM 5241 4C31 POP 42 53.400 14.100 45.860 1.00 0.00 ATOM 5242 H14X POP 42 52.560 13.640 45.300 1.00 0.00 ATOM 5243 H14Y POP 42 54.350 13.590 45.590 1.00 0.00 ATOM 5244 5C31 POP 42 53.480 15.610 45.620 1.00 0.00 ATOM 5245 H15X POP 42 54.120 15.930 44.770 1.00 0.00 ATOM 5246 H15Y POP 42 54.100 15.990 46.470 1.00 0.00 ATOM 5247 6C31 POP 42 52.150 16.350 45.640 1.00 0.00 ATOM 5248 H16X POP 42 51.410 16.100 44.850 1.00 0.00 ATOM 5249 H16Y POP 42 52.290 17.450 45.550 1.00 0.00 ATOM 5250 H16Z POP 42 51.580 16.340 46.600 1.00 0.00 ATOM 5251 N POP 43 53.300 43.080 63.410 1.00 0.00 ATOM 5252 HN1 POP 43 53.640 42.210 62.940 1.00 0.00 ATOM 5253 HN2 POP 43 52.270 43.140 63.520 1.00 0.00 ATOM 5254 HN3 POP 43 53.610 43.770 62.680 1.00 0.00 ATOM 5255 C12 POP 43 53.990 43.370 64.720 1.00 0.00 ATOM 5256 H12A POP 43 53.730 42.510 65.380 1.00 0.00 ATOM 5257 H12B POP 43 53.680 44.350 65.140 1.00 0.00 ATOM 5258 C11 POP 43 55.500 43.390 64.480 1.00 0.00 ATOM 5259 H11A POP 43 56.030 43.520 65.450 1.00 0.00 ATOM 5260 H11B POP 43 55.690 44.230 63.790 1.00 0.00 ATOM 5261 P POP 43 57.380 41.960 63.350 1.00 0.00 ATOM 5262 O13 POP 43 57.620 40.520 63.090 1.00 0.00 ATOM 5263 O14 POP 43 58.320 42.580 64.320 1.00 0.00 ATOM 5264 O11 POP 43 57.290 42.800 61.990 1.00 0.00 ATOM 5265 O12 POP 43 55.940 42.100 64.040 1.00 0.00 ATOM 5266 C1 POP 43 56.340 42.460 60.980 1.00 0.00 ATOM 5267 HA POP 43 56.440 43.220 60.170 1.00 0.00 ATOM 5268 HB POP 43 55.300 42.550 61.370 1.00 0.00 ATOM 5269 C2 POP 43 56.470 41.050 60.390 1.00 0.00 ATOM 5270 HS POP 43 56.020 40.440 61.210 1.00 0.00 ATOM 5271 O21 POP 43 57.860 40.740 60.230 1.00 0.00 ATOM 5272 C21 POP 43 58.010 39.420 60.090 1.00 0.00 ATOM 5273 O22 POP 43 57.110 38.600 60.150 1.00 0.00 ATOM 5274 C22 POP 43 59.480 39.160 59.810 1.00 0.00 ATOM 5275 H2R POP 43 60.000 39.280 60.790 1.00 0.00 ATOM 5276 H2S POP 43 59.910 40.030 59.270 1.00 0.00 ATOM 5277 C3 POP 43 55.650 40.930 59.100 1.00 0.00 ATOM 5278 HX POP 43 54.570 40.890 59.370 1.00 0.00 ATOM 5279 HY POP 43 55.760 39.940 58.600 1.00 0.00 ATOM 5280 O31 POP 43 55.820 42.010 58.180 1.00 0.00 ATOM 5281 C31 POP 43 56.840 41.830 57.340 1.00 0.00 ATOM 5282 O32 POP 43 57.590 40.870 57.260 1.00 0.00 ATOM 5283 C32 POP 43 56.900 43.040 56.420 1.00 0.00 ATOM 5284 H2X POP 43 56.980 43.910 57.100 1.00 0.00 ATOM 5285 H2Y POP 43 55.910 43.050 55.910 1.00 0.00 ATOM 5286 C23 POP 43 59.660 37.750 59.250 1.00 0.00 ATOM 5287 H3R POP 43 59.160 37.880 58.260 1.00 0.00 ATOM 5288 H3S POP 43 59.140 36.990 59.880 1.00 0.00 ATOM 5289 C24 POP 43 61.120 37.380 59.000 1.00 0.00 ATOM 5290 H4R POP 43 61.040 36.410 58.460 1.00 0.00 ATOM 5291 H4S POP 43 61.670 37.290 59.960 1.00 0.00 ATOM 5292 C25 POP 43 61.870 38.400 58.140 1.00 0.00 ATOM 5293 H5R POP 43 62.910 38.020 58.180 1.00 0.00 ATOM 5294 H5S POP 43 61.750 39.410 58.590 1.00 0.00 ATOM 5295 C26 POP 43 61.420 38.540 56.680 1.00 0.00 ATOM 5296 H6R POP 43 60.410 39.010 56.650 1.00 0.00 ATOM 5297 H6S POP 43 61.400 37.610 56.080 1.00 0.00 ATOM 5298 C27 POP 43 62.340 39.480 55.900 1.00 0.00 ATOM 5299 H7R POP 43 63.360 39.050 55.890 1.00 0.00 ATOM 5300 H7S POP 43 62.230 40.430 56.480 1.00 0.00 ATOM 5301 C28 POP 43 61.830 40.010 54.560 1.00 0.00 ATOM 5302 H8R POP 43 62.490 40.810 54.160 1.00 0.00 ATOM 5303 H8S POP 43 60.890 40.580 54.720 1.00 0.00 ATOM 5304 C29 POP 43 61.550 38.850 53.650 1.00 0.00 ATOM 5305 H91 POP 43 60.780 38.130 53.960 1.00 0.00 ATOM 5306 0C21 POP 43 62.100 38.650 52.440 1.00 0.00 ATOM 5307 1H10 POP 43 61.760 37.690 52.010 1.00 0.00 ATOM 5308 1C21 POP 43 63.140 39.550 51.830 1.00 0.00 ATOM 5309 H11R POP 43 63.970 39.800 52.530 1.00 0.00 ATOM 5310 H11S POP 43 62.700 40.550 51.630 1.00 0.00 ATOM 5311 2C21 POP 43 63.700 39.130 50.470 1.00 0.00 ATOM 5312 H12R POP 43 62.990 39.290 49.640 1.00 0.00 ATOM 5313 H12S POP 43 64.140 38.120 50.580 1.00 0.00 ATOM 5314 3C21 POP 43 64.860 39.960 49.920 1.00 0.00 ATOM 5315 H13R POP 43 65.610 39.900 50.740 1.00 0.00 ATOM 5316 H13S POP 43 64.480 40.980 49.670 1.00 0.00 ATOM 5317 4C21 POP 43 65.440 39.400 48.620 1.00 0.00 ATOM 5318 H14R POP 43 64.860 39.660 47.710 1.00 0.00 ATOM 5319 H14S POP 43 65.550 38.320 48.830 1.00 0.00 ATOM 5320 5C21 POP 43 66.870 39.880 48.410 1.00 0.00 ATOM 5321 H15R POP 43 67.200 39.290 47.520 1.00 0.00 ATOM 5322 H15S POP 43 67.520 39.690 49.290 1.00 0.00 ATOM 5323 6C21 POP 43 66.810 41.370 48.100 1.00 0.00 ATOM 5324 H16R POP 43 66.750 41.950 49.050 1.00 0.00 ATOM 5325 H16S POP 43 65.920 41.610 47.470 1.00 0.00 ATOM 5326 7C21 POP 43 67.960 41.820 47.190 1.00 0.00 ATOM 5327 H17R POP 43 67.740 41.380 46.200 1.00 0.00 ATOM 5328 H17S POP 43 68.910 41.400 47.590 1.00 0.00 ATOM 5329 8C21 POP 43 68.080 43.330 47.020 1.00 0.00 ATOM 5330 H18R POP 43 68.530 43.690 46.070 1.00 0.00 ATOM 5331 H18S POP 43 68.650 43.750 47.880 1.00 0.00 ATOM 5332 H18T POP 43 67.120 43.860 47.160 1.00 0.00 ATOM 5333 C33 POP 43 58.070 42.890 55.450 1.00 0.00 ATOM 5334 H3X POP 43 58.060 41.880 54.970 1.00 0.00 ATOM 5335 H3Y POP 43 58.940 43.020 56.130 1.00 0.00 ATOM 5336 C34 POP 43 58.160 44.070 54.480 1.00 0.00 ATOM 5337 H4X POP 43 59.170 44.130 54.030 1.00 0.00 ATOM 5338 H4Y POP 43 57.960 45.020 55.020 1.00 0.00 ATOM 5339 C35 POP 43 57.060 43.980 53.420 1.00 0.00 ATOM 5340 H5X POP 43 56.230 44.670 53.670 1.00 0.00 ATOM 5341 H5Y POP 43 56.730 42.930 53.270 1.00 0.00 ATOM 5342 C36 POP 43 57.560 44.430 52.040 1.00 0.00 ATOM 5343 H6X POP 43 58.540 43.950 51.850 1.00 0.00 ATOM 5344 H6Y POP 43 57.670 45.530 51.910 1.00 0.00 ATOM 5345 C37 POP 43 56.580 43.920 50.980 1.00 0.00 ATOM 5346 H7X POP 43 55.570 44.290 51.260 1.00 0.00 ATOM 5347 H7Y POP 43 56.750 42.820 51.010 1.00 0.00 ATOM 5348 C38 POP 43 56.660 44.360 49.520 1.00 0.00 ATOM 5349 H8X POP 43 57.070 45.400 49.470 1.00 0.00 ATOM 5350 H8Y POP 43 55.690 44.330 48.980 1.00 0.00 ATOM 5351 C39 POP 43 57.800 43.590 48.850 1.00 0.00 ATOM 5352 H9X POP 43 57.490 42.530 48.990 1.00 0.00 ATOM 5353 H9Y POP 43 58.810 43.870 49.220 1.00 0.00 ATOM 5354 0C31 POP 43 57.850 43.880 47.350 1.00 0.00 ATOM 5355 H10X POP 43 58.900 43.970 47.000 1.00 0.00 ATOM 5356 H10Y POP 43 57.320 44.840 47.150 1.00 0.00 ATOM 5357 1C31 POP 43 57.180 42.830 46.460 1.00 0.00 ATOM 5358 H11X POP 43 56.120 42.800 46.820 1.00 0.00 ATOM 5359 H11Y POP 43 57.760 41.890 46.620 1.00 0.00 ATOM 5360 2C31 POP 43 57.080 43.240 44.990 1.00 0.00 ATOM 5361 H12X POP 43 58.070 43.030 44.550 1.00 0.00 ATOM 5362 H12Y POP 43 57.030 44.350 44.980 1.00 0.00 ATOM 5363 3C31 POP 43 55.920 42.540 44.290 1.00 0.00 ATOM 5364 H13X POP 43 55.050 42.540 44.980 1.00 0.00 ATOM 5365 H13Y POP 43 56.190 41.470 44.350 1.00 0.00 ATOM 5366 4C31 POP 43 55.450 43.100 42.940 1.00 0.00 ATOM 5367 H14X POP 43 55.410 44.210 42.930 1.00 0.00 ATOM 5368 H14Y POP 43 54.450 42.610 42.860 1.00 0.00 ATOM 5369 5C31 POP 43 56.280 42.700 41.720 1.00 0.00 ATOM 5370 H15X POP 43 57.220 43.280 41.660 1.00 0.00 ATOM 5371 H15Y POP 43 55.660 43.130 40.900 1.00 0.00 ATOM 5372 6C31 POP 43 56.530 41.210 41.450 1.00 0.00 ATOM 5373 H16X POP 43 55.560 40.670 41.450 1.00 0.00 ATOM 5374 H16Y POP 43 57.130 40.750 42.260 1.00 0.00 ATOM 5375 H16Z POP 43 56.960 40.970 40.450 1.00 0.00 ATOM 5376 N POP 44 21.320 56.100 67.290 1.00 0.00 ATOM 5377 HN1 POP 44 20.710 55.280 67.440 1.00 0.00 ATOM 5378 HN2 POP 44 21.540 56.520 68.220 1.00 0.00 ATOM 5379 HN3 POP 44 20.880 56.800 66.670 1.00 0.00 ATOM 5380 C12 POP 44 22.700 55.670 66.840 1.00 0.00 ATOM 5381 H12A POP 44 22.970 54.700 67.310 1.00 0.00 ATOM 5382 H12B POP 44 23.440 56.360 67.290 1.00 0.00 ATOM 5383 C11 POP 44 22.770 55.540 65.320 1.00 0.00 ATOM 5384 H11A POP 44 23.770 55.580 64.830 1.00 0.00 ATOM 5385 H11B POP 44 22.330 56.480 64.930 1.00 0.00 ATOM 5386 P POP 44 23.060 53.180 64.620 1.00 0.00 ATOM 5387 O13 POP 44 22.330 51.980 65.090 1.00 0.00 ATOM 5388 O14 POP 44 24.360 53.520 65.260 1.00 0.00 ATOM 5389 O11 POP 44 23.220 53.210 63.030 1.00 0.00 ATOM 5390 O12 POP 44 22.060 54.400 64.830 1.00 0.00 ATOM 5391 C1 POP 44 23.590 52.020 62.330 1.00 0.00 ATOM 5392 HA POP 44 23.200 52.080 61.290 1.00 0.00 ATOM 5393 HB POP 44 23.280 51.060 62.780 1.00 0.00 ATOM 5394 C2 POP 44 25.110 51.860 62.160 1.00 0.00 ATOM 5395 HS POP 44 25.470 51.780 63.210 1.00 0.00 ATOM 5396 O21 POP 44 25.770 53.000 61.600 1.00 0.00 ATOM 5397 C21 POP 44 27.100 52.960 61.640 1.00 0.00 ATOM 5398 O22 POP 44 27.730 52.060 62.180 1.00 0.00 ATOM 5399 C22 POP 44 27.670 54.220 61.000 1.00 0.00 ATOM 5400 H2R POP 44 27.890 54.990 61.760 1.00 0.00 ATOM 5401 H2S POP 44 27.020 54.770 60.290 1.00 0.00 ATOM 5402 C3 POP 44 25.470 50.600 61.360 1.00 0.00 ATOM 5403 HX POP 44 24.930 49.790 61.910 1.00 0.00 ATOM 5404 HY POP 44 26.550 50.360 61.390 1.00 0.00 ATOM 5405 O31 POP 44 24.980 50.680 60.020 1.00 0.00 ATOM 5406 C31 POP 44 25.880 51.020 59.090 1.00 0.00 ATOM 5407 O32 POP 44 27.080 51.100 59.280 1.00 0.00 ATOM 5408 C32 POP 44 25.140 51.310 57.790 1.00 0.00 ATOM 5409 H2X POP 44 24.160 51.750 58.060 1.00 0.00 ATOM 5410 H2Y POP 44 24.830 50.310 57.400 1.00 0.00 ATOM 5411 C23 POP 44 28.970 53.840 60.270 1.00 0.00 ATOM 5412 H3R POP 44 28.580 53.200 59.460 1.00 0.00 ATOM 5413 H3S POP 44 29.680 53.320 60.950 1.00 0.00 ATOM 5414 C24 POP 44 29.690 55.010 59.590 1.00 0.00 ATOM 5415 H4R POP 44 30.000 55.680 60.410 1.00 0.00 ATOM 5416 H4S POP 44 28.970 55.600 58.980 1.00 0.00 ATOM 5417 C25 POP 44 30.890 54.610 58.730 1.00 0.00 ATOM 5418 H5R POP 44 31.810 54.570 59.340 1.00 0.00 ATOM 5419 H5S POP 44 31.050 55.340 57.910 1.00 0.00 ATOM 5420 C26 POP 44 30.760 53.250 58.020 1.00 0.00 ATOM 5421 H6R POP 44 29.880 53.190 57.350 1.00 0.00 ATOM 5422 H6S POP 44 30.460 52.530 58.810 1.00 0.00 ATOM 5423 C27 POP 44 32.050 52.960 57.250 1.00 0.00 ATOM 5424 H7R POP 44 32.990 53.010 57.850 1.00 0.00 ATOM 5425 H7S POP 44 32.210 53.670 56.410 1.00 0.00 ATOM 5426 C28 POP 44 32.130 51.580 56.600 1.00 0.00 ATOM 5427 H8R POP 44 33.060 51.480 56.010 1.00 0.00 ATOM 5428 H8S POP 44 31.230 51.370 55.980 1.00 0.00 ATOM 5429 C29 POP 44 32.140 50.550 57.700 1.00 0.00 ATOM 5430 H91 POP 44 32.900 50.760 58.460 1.00 0.00 ATOM 5431 0C21 POP 44 31.280 49.550 57.930 1.00 0.00 ATOM 5432 1H10 POP 44 31.490 49.100 58.910 1.00 0.00 ATOM 5433 1C21 POP 44 30.150 49.050 57.080 1.00 0.00 ATOM 5434 H11R POP 44 30.340 49.370 56.040 1.00 0.00 ATOM 5435 H11S POP 44 29.200 49.550 57.360 1.00 0.00 ATOM 5436 2C21 POP 44 30.010 47.530 57.200 1.00 0.00 ATOM 5437 H12R POP 44 29.680 47.280 58.230 1.00 0.00 ATOM 5438 H12S POP 44 31.010 47.050 57.120 1.00 0.00 ATOM 5439 3C21 POP 44 29.000 46.820 56.300 1.00 0.00 ATOM 5440 H13R POP 44 29.050 45.720 56.420 1.00 0.00 ATOM 5441 H13S POP 44 29.370 46.970 55.260 1.00 0.00 ATOM 5442 4C21 POP 44 27.570 47.320 56.490 1.00 0.00 ATOM 5443 H14R POP 44 27.080 47.060 55.520 1.00 0.00 ATOM 5444 H14S POP 44 27.490 48.410 56.680 1.00 0.00 ATOM 5445 5C21 POP 44 26.780 46.540 57.550 1.00 0.00 ATOM 5446 H15R POP 44 27.290 46.570 58.530 1.00 0.00 ATOM 5447 H15S POP 44 26.700 45.450 57.370 1.00 0.00 ATOM 5448 6C21 POP 44 25.400 47.150 57.840 1.00 0.00 ATOM 5449 H16R POP 44 24.650 46.940 57.040 1.00 0.00 ATOM 5450 H16S POP 44 25.600 48.240 57.840 1.00 0.00 ATOM 5451 7C21 POP 44 24.880 46.760 59.220 1.00 0.00 ATOM 5452 H17R POP 44 25.720 47.010 59.910 1.00 0.00 ATOM 5453 H17S POP 44 24.730 45.670 59.320 1.00 0.00 ATOM 5454 8C21 POP 44 23.620 47.470 59.700 1.00 0.00 ATOM 5455 H18R POP 44 23.700 48.520 60.040 1.00 0.00 ATOM 5456 H18S POP 44 23.220 47.000 60.630 1.00 0.00 ATOM 5457 H18T POP 44 22.900 47.310 58.870 1.00 0.00 ATOM 5458 C33 POP 44 26.030 52.130 56.850 1.00 0.00 ATOM 5459 H3X POP 44 25.570 52.080 55.840 1.00 0.00 ATOM 5460 H3Y POP 44 27.010 51.610 56.790 1.00 0.00 ATOM 5461 C34 POP 44 26.160 53.610 57.180 1.00 0.00 ATOM 5462 H4X POP 44 26.490 53.800 58.230 1.00 0.00 ATOM 5463 H4Y POP 44 25.120 54.000 57.220 1.00 0.00 ATOM 5464 C35 POP 44 26.920 54.490 56.190 1.00 0.00 ATOM 5465 H5X POP 44 27.990 54.200 56.210 1.00 0.00 ATOM 5466 H5Y POP 44 26.900 55.560 56.490 1.00 0.00 ATOM 5467 C36 POP 44 26.450 54.420 54.730 1.00 0.00 ATOM 5468 H6X POP 44 25.350 54.550 54.820 1.00 0.00 ATOM 5469 H6Y POP 44 26.630 53.390 54.370 1.00 0.00 ATOM 5470 C37 POP 44 27.150 55.540 53.960 1.00 0.00 ATOM 5471 H7X POP 44 28.230 55.550 54.220 1.00 0.00 ATOM 5472 H7Y POP 44 26.760 56.420 54.500 1.00 0.00 ATOM 5473 C38 POP 44 26.950 55.670 52.450 1.00 0.00 ATOM 5474 H8X POP 44 25.850 55.570 52.330 1.00 0.00 ATOM 5475 H8Y POP 44 27.290 54.840 51.800 1.00 0.00 ATOM 5476 C39 POP 44 27.470 57.030 51.980 1.00 0.00 ATOM 5477 H9X POP 44 28.460 57.130 52.460 1.00 0.00 ATOM 5478 H9Y POP 44 26.810 57.840 52.390 1.00 0.00 ATOM 5479 0C31 POP 44 27.410 57.200 50.460 1.00 0.00 ATOM 5480 H10X POP 44 26.480 56.780 50.020 1.00 0.00 ATOM 5481 H10Y POP 44 28.310 56.660 50.100 1.00 0.00 ATOM 5482 1C31 POP 44 27.440 58.690 50.120 1.00 0.00 ATOM 5483 H11X POP 44 28.170 59.080 50.860 1.00 0.00 ATOM 5484 H11Y POP 44 26.410 59.080 50.300 1.00 0.00 ATOM 5485 2C31 POP 44 28.010 59.110 48.760 1.00 0.00 ATOM 5486 H12X POP 44 27.390 58.700 47.930 1.00 0.00 ATOM 5487 H12Y POP 44 29.010 58.670 48.560 1.00 0.00 ATOM 5488 3C31 POP 44 27.990 60.610 48.440 1.00 0.00 ATOM 5489 H13X POP 44 28.610 61.000 49.280 1.00 0.00 ATOM 5490 H13Y POP 44 26.970 61.020 48.550 1.00 0.00 ATOM 5491 4C31 POP 44 28.660 61.060 47.150 1.00 0.00 ATOM 5492 H14X POP 44 29.520 60.360 47.050 1.00 0.00 ATOM 5493 H14Y POP 44 29.130 62.070 47.110 1.00 0.00 ATOM 5494 5C31 POP 44 27.750 60.930 45.920 1.00 0.00 ATOM 5495 H15X POP 44 26.950 61.690 45.970 1.00 0.00 ATOM 5496 H15Y POP 44 27.190 59.970 45.860 1.00 0.00 ATOM 5497 6C31 POP 44 28.510 61.210 44.620 1.00 0.00 ATOM 5498 H16X POP 44 28.910 62.240 44.720 1.00 0.00 ATOM 5499 H16Y POP 44 27.780 61.210 43.780 1.00 0.00 ATOM 5500 H16Z POP 44 29.290 60.430 44.520 1.00 0.00 ATOM 5501 N POP 45 51.050 56.040 63.110 1.00 0.00 ATOM 5502 HN1 POP 45 51.980 55.840 62.700 1.00 0.00 ATOM 5503 HN2 POP 45 50.390 56.420 62.410 1.00 0.00 ATOM 5504 HN3 POP 45 51.140 56.810 63.800 1.00 0.00 ATOM 5505 C12 POP 45 50.580 54.780 63.800 1.00 0.00 ATOM 5506 H12A POP 45 49.990 55.170 64.660 1.00 0.00 ATOM 5507 H12B POP 45 51.460 54.230 64.210 1.00 0.00 ATOM 5508 C11 POP 45 49.730 53.950 62.840 1.00 0.00 ATOM 5509 H11A POP 45 48.770 54.520 62.790 1.00 0.00 ATOM 5510 H11B POP 45 49.460 52.970 63.280 1.00 0.00 ATOM 5511 P POP 45 49.820 52.520 60.800 1.00 0.00 ATOM 5512 O13 POP 45 48.350 52.640 60.820 1.00 0.00 ATOM 5513 O14 POP 45 50.460 51.330 61.390 1.00 0.00 ATOM 5514 O11 POP 45 50.370 52.710 59.300 1.00 0.00 ATOM 5515 O12 POP 45 50.290 53.870 61.530 1.00 0.00 ATOM 5516 C1 POP 45 51.710 53.170 59.130 1.00 0.00 ATOM 5517 HA POP 45 52.090 52.680 58.200 1.00 0.00 ATOM 5518 HB POP 45 52.390 52.840 59.950 1.00 0.00 ATOM 5519 C2 POP 45 51.860 54.690 58.960 1.00 0.00 ATOM 5520 HS POP 45 51.340 55.150 59.820 1.00 0.00 ATOM 5521 O21 POP 45 51.370 55.000 57.650 1.00 0.00 ATOM 5522 C21 POP 45 50.400 55.920 57.690 1.00 0.00 ATOM 5523 O22 POP 45 50.100 56.600 58.660 1.00 0.00 ATOM 5524 C22 POP 45 49.630 55.910 56.380 1.00 0.00 ATOM 5525 H2R POP 45 48.550 55.850 56.650 1.00 0.00 ATOM 5526 H2S POP 45 49.810 54.960 55.850 1.00 0.00 ATOM 5527 C3 POP 45 53.360 55.020 58.900 1.00 0.00 ATOM 5528 HX POP 45 53.770 54.220 58.250 1.00 0.00 ATOM 5529 HY POP 45 53.800 54.920 59.920 1.00 0.00 ATOM 5530 O31 POP 45 53.630 56.330 58.390 1.00 0.00 ATOM 5531 C31 POP 45 53.250 57.330 59.190 1.00 0.00 ATOM 5532 O32 POP 45 52.830 57.170 60.320 1.00 0.00 ATOM 5533 C32 POP 45 53.780 58.530 58.410 1.00 0.00 ATOM 5534 H2X POP 45 54.660 58.180 57.820 1.00 0.00 ATOM 5535 H2Y POP 45 54.020 59.330 59.140 1.00 0.00 ATOM 5536 C23 POP 45 49.940 57.160 55.550 1.00 0.00 ATOM 5537 H3R POP 45 50.930 57.030 55.060 1.00 0.00 ATOM 5538 H3S POP 45 49.960 58.040 56.240 1.00 0.00 ATOM 5539 C24 POP 45 48.970 57.420 54.400 1.00 0.00 ATOM 5540 H4R POP 45 47.950 57.780 54.650 1.00 0.00 ATOM 5541 H4S POP 45 49.020 56.470 53.840 1.00 0.00 ATOM 5542 C25 POP 45 49.450 58.640 53.610 1.00 0.00 ATOM 5543 H5R POP 45 50.500 58.580 53.260 1.00 0.00 ATOM 5544 H5S POP 45 49.400 59.550 54.250 1.00 0.00 ATOM 5545 C26 POP 45 48.650 58.870 52.320 1.00 0.00 ATOM 5546 H6R POP 45 48.870 59.930 52.080 1.00 0.00 ATOM 5547 H6S POP 45 47.550 58.770 52.360 1.00 0.00 ATOM 5548 C27 POP 45 49.290 58.100 51.160 1.00 0.00 ATOM 5549 H7R POP 45 49.350 57.000 51.360 1.00 0.00 ATOM 5550 H7S POP 45 50.320 58.500 51.090 1.00 0.00 ATOM 5551 C28 POP 45 48.710 58.450 49.790 1.00 0.00 ATOM 5552 H8R POP 45 48.840 59.500 49.450 1.00 0.00 ATOM 5553 H8S POP 45 47.610 58.310 49.780 1.00 0.00 ATOM 5554 C29 POP 45 49.360 57.590 48.750 1.00 0.00 ATOM 5555 H91 POP 45 49.940 56.700 49.040 1.00 0.00 ATOM 5556 0C21 POP 45 49.300 57.740 47.420 1.00 0.00 ATOM 5557 1H10 POP 45 49.940 57.120 46.780 1.00 0.00 ATOM 5558 1C21 POP 45 48.550 58.750 46.600 1.00 0.00 ATOM 5559 H11R POP 45 49.170 59.270 45.830 1.00 0.00 ATOM 5560 H11S POP 45 48.150 59.580 47.230 1.00 0.00 ATOM 5561 2C21 POP 45 47.450 57.980 45.870 1.00 0.00 ATOM 5562 H12R POP 45 47.640 56.890 45.930 1.00 0.00 ATOM 5563 H12S POP 45 47.450 58.070 44.760 1.00 0.00 ATOM 5564 3C21 POP 45 46.040 58.250 46.380 1.00 0.00 ATOM 5565 H13R POP 45 46.140 58.460 47.470 1.00 0.00 ATOM 5566 H13S POP 45 45.320 57.460 46.080 1.00 0.00 ATOM 5567 4C21 POP 45 45.450 59.470 45.680 1.00 0.00 ATOM 5568 H14R POP 45 46.340 60.100 45.460 1.00 0.00 ATOM 5569 H14S POP 45 44.700 59.940 46.350 1.00 0.00 ATOM 5570 5C21 POP 45 44.690 59.210 44.380 1.00 0.00 ATOM 5571 H15R POP 45 43.880 58.470 44.530 1.00 0.00 ATOM 5572 H15S POP 45 45.480 58.820 43.700 1.00 0.00 ATOM 5573 6C21 POP 45 44.410 60.470 43.540 1.00 0.00 ATOM 5574 H16R POP 45 45.240 61.200 43.630 1.00 0.00 ATOM 5575 H16S POP 45 43.490 60.880 44.000 1.00 0.00 ATOM 5576 7C21 POP 45 43.980 60.080 42.130 1.00 0.00 ATOM 5577 H17R POP 45 43.990 61.050 41.590 1.00 0.00 ATOM 5578 H17S POP 45 42.910 59.760 42.180 1.00 0.00 ATOM 5579 8C21 POP 45 44.720 59.020 41.330 1.00 0.00 ATOM 5580 H18R POP 45 44.230 58.930 40.340 1.00 0.00 ATOM 5581 H18S POP 45 44.780 58.080 41.910 1.00 0.00 ATOM 5582 H18T POP 45 45.770 59.330 41.100 1.00 0.00 ATOM 5583 C33 POP 45 52.760 59.010 57.380 1.00 0.00 ATOM 5584 H3X POP 45 51.790 59.060 57.940 1.00 0.00 ATOM 5585 H3Y POP 45 52.730 58.190 56.630 1.00 0.00 ATOM 5586 C34 POP 45 53.180 60.240 56.580 1.00 0.00 ATOM 5587 H4X POP 45 54.190 60.050 56.170 1.00 0.00 ATOM 5588 H4Y POP 45 53.300 61.160 57.180 1.00 0.00 ATOM 5589 C35 POP 45 52.240 60.530 55.410 1.00 0.00 ATOM 5590 H5X POP 45 51.210 60.530 55.830 1.00 0.00 ATOM 5591 H5Y POP 45 52.310 59.610 54.790 1.00 0.00 ATOM 5592 C36 POP 45 52.580 61.830 54.670 1.00 0.00 ATOM 5593 H6X POP 45 53.630 61.830 54.330 1.00 0.00 ATOM 5594 H6Y POP 45 52.450 62.800 55.210 1.00 0.00 ATOM 5595 C37 POP 45 51.710 62.030 53.430 1.00 0.00 ATOM 5596 H7X POP 45 51.590 63.110 53.170 1.00 0.00 ATOM 5597 H7Y POP 45 50.640 61.740 53.510 1.00 0.00 ATOM 5598 C38 POP 45 52.290 61.310 52.210 1.00 0.00 ATOM 5599 H8X POP 45 52.360 60.220 52.370 1.00 0.00 ATOM 5600 H8Y POP 45 53.360 61.610 52.170 1.00 0.00 ATOM 5601 C39 POP 45 51.520 61.520 50.910 1.00 0.00 ATOM 5602 H9X POP 45 51.230 62.590 50.780 1.00 0.00 ATOM 5603 H9Y POP 45 50.540 60.990 50.930 1.00 0.00 ATOM 5604 0C31 POP 45 52.390 60.970 49.770 1.00 0.00 ATOM 5605 H10X POP 45 52.630 59.890 49.790 1.00 0.00 ATOM 5606 H10Y POP 45 53.310 61.570 49.880 1.00 0.00 ATOM 5607 1C31 POP 45 51.750 61.210 48.400 1.00 0.00 ATOM 5608 H11X POP 45 51.530 62.290 48.300 1.00 0.00 ATOM 5609 H11Y POP 45 50.740 60.760 48.360 1.00 0.00 ATOM 5610 2C31 POP 45 52.480 60.620 47.190 1.00 0.00 ATOM 5611 H12X POP 45 51.930 60.880 46.260 1.00 0.00 ATOM 5612 H12Y POP 45 52.460 59.520 47.330 1.00 0.00 ATOM 5613 3C31 POP 45 53.940 60.780 46.780 1.00 0.00 ATOM 5614 H13X POP 45 54.290 60.080 46.000 1.00 0.00 ATOM 5615 H13Y POP 45 54.500 60.550 47.710 1.00 0.00 ATOM 5616 4C31 POP 45 54.360 62.250 46.610 1.00 0.00 ATOM 5617 H14X POP 45 54.020 62.750 47.540 1.00 0.00 ATOM 5618 H14Y POP 45 53.670 62.660 45.840 1.00 0.00 ATOM 5619 5C31 POP 45 55.820 62.570 46.280 1.00 0.00 ATOM 5620 H15X POP 45 55.950 62.160 45.260 1.00 0.00 ATOM 5621 H15Y POP 45 56.410 61.880 46.930 1.00 0.00 ATOM 5622 6C31 POP 45 56.200 64.040 46.320 1.00 0.00 ATOM 5623 H16X POP 45 55.590 64.560 45.550 1.00 0.00 ATOM 5624 H16Y POP 45 57.250 64.210 45.980 1.00 0.00 ATOM 5625 H16Z POP 45 55.930 64.420 47.330 1.00 0.00 ATOM 5626 N POP 46 28.280 12.710 67.370 1.00 0.00 ATOM 5627 HN1 POP 46 28.850 12.870 66.510 1.00 0.00 ATOM 5628 HN2 POP 46 27.560 13.450 67.270 1.00 0.00 ATOM 5629 HN3 POP 46 28.770 12.820 68.280 1.00 0.00 ATOM 5630 C12 POP 46 27.650 11.340 67.290 1.00 0.00 ATOM 5631 H12A POP 46 27.430 11.090 68.350 1.00 0.00 ATOM 5632 H12B POP 46 28.500 10.720 66.910 1.00 0.00 ATOM 5633 C11 POP 46 26.480 11.350 66.310 1.00 0.00 ATOM 5634 H11A POP 46 25.990 10.360 66.380 1.00 0.00 ATOM 5635 H11B POP 46 26.810 11.500 65.260 1.00 0.00 ATOM 5636 P POP 46 24.330 12.640 65.710 1.00 0.00 ATOM 5637 O13 POP 46 23.280 13.520 66.280 1.00 0.00 ATOM 5638 O14 POP 46 23.680 11.340 65.390 1.00 0.00 ATOM 5639 O11 POP 46 24.990 13.170 64.350 1.00 0.00 ATOM 5640 O12 POP 46 25.580 12.410 66.670 1.00 0.00 ATOM 5641 C1 POP 46 25.220 14.570 64.150 1.00 0.00 ATOM 5642 HA POP 46 25.950 14.900 64.910 1.00 0.00 ATOM 5643 HB POP 46 24.260 15.130 64.230 1.00 0.00 ATOM 5644 C2 POP 46 25.900 14.920 62.810 1.00 0.00 ATOM 5645 HS POP 46 25.960 16.020 62.690 1.00 0.00 ATOM 5646 O21 POP 46 25.270 14.300 61.690 1.00 0.00 ATOM 5647 C21 POP 46 24.110 14.760 61.240 1.00 0.00 ATOM 5648 O22 POP 46 23.670 15.850 61.590 1.00 0.00 ATOM 5649 C22 POP 46 23.530 13.850 60.170 1.00 0.00 ATOM 5650 H2R POP 46 22.530 14.240 59.910 1.00 0.00 ATOM 5651 H2S POP 46 23.310 12.820 60.540 1.00 0.00 ATOM 5652 C3 POP 46 27.350 14.420 62.800 1.00 0.00 ATOM 5653 HX POP 46 27.220 13.320 62.720 1.00 0.00 ATOM 5654 HY POP 46 28.090 14.680 63.590 1.00 0.00 ATOM 5655 O31 POP 46 27.960 14.690 61.530 1.00 0.00 ATOM 5656 C31 POP 46 28.520 15.880 61.320 1.00 0.00 ATOM 5657 O32 POP 46 28.380 16.850 62.040 1.00 0.00 ATOM 5658 C32 POP 46 29.370 15.760 60.060 1.00 0.00 ATOM 5659 H2X POP 46 29.220 14.750 59.610 1.00 0.00 ATOM 5660 H2Y POP 46 30.440 15.830 60.350 1.00 0.00 ATOM 5661 C23 POP 46 24.410 13.860 58.920 1.00 0.00 ATOM 5662 H3R POP 46 24.510 12.800 58.590 1.00 0.00 ATOM 5663 H3S POP 46 25.410 14.230 59.220 1.00 0.00 ATOM 5664 C24 POP 46 23.850 14.740 57.800 1.00 0.00 ATOM 5665 H4R POP 46 23.780 15.810 58.080 1.00 0.00 ATOM 5666 H4S POP 46 22.780 14.490 57.630 1.00 0.00 ATOM 5667 C25 POP 46 24.420 14.590 56.380 1.00 0.00 ATOM 5668 H5R POP 46 24.360 13.500 56.200 1.00 0.00 ATOM 5669 H5S POP 46 25.440 15.020 56.260 1.00 0.00 ATOM 5670 C26 POP 46 23.550 15.250 55.300 1.00 0.00 ATOM 5671 H6R POP 46 23.650 16.330 55.540 1.00 0.00 ATOM 5672 H6S POP 46 22.470 14.990 55.300 1.00 0.00 ATOM 5673 C27 POP 46 24.230 15.110 53.940 1.00 0.00 ATOM 5674 H7R POP 46 25.340 15.070 53.940 1.00 0.00 ATOM 5675 H7S POP 46 23.950 16.050 53.420 1.00 0.00 ATOM 5676 C28 POP 46 23.690 13.980 53.070 1.00 0.00 ATOM 5677 H8R POP 46 22.590 13.920 53.200 1.00 0.00 ATOM 5678 H8S POP 46 24.110 13.010 53.420 1.00 0.00 ATOM 5679 C29 POP 46 24.110 14.280 51.660 1.00 0.00 ATOM 5680 H91 POP 46 24.020 15.340 51.380 1.00 0.00 ATOM 5681 0C21 POP 46 24.290 13.350 50.710 1.00 0.00 ATOM 5682 1H10 POP 46 24.670 13.710 49.740 1.00 0.00 ATOM 5683 1C21 POP 46 24.200 11.850 50.660 1.00 0.00 ATOM 5684 H11R POP 46 23.430 11.520 51.390 1.00 0.00 ATOM 5685 H11S POP 46 25.190 11.440 50.960 1.00 0.00 ATOM 5686 2C21 POP 46 23.910 11.300 49.260 1.00 0.00 ATOM 5687 H12R POP 46 24.610 11.670 48.480 1.00 0.00 ATOM 5688 H12S POP 46 22.900 11.620 48.940 1.00 0.00 ATOM 5689 3C21 POP 46 23.890 9.770 49.220 1.00 0.00 ATOM 5690 H13R POP 46 23.350 9.360 50.100 1.00 0.00 ATOM 5691 H13S POP 46 24.890 9.300 49.280 1.00 0.00 ATOM 5692 4C21 POP 46 23.420 9.260 47.850 1.00 0.00 ATOM 5693 H14R POP 46 23.820 10.060 47.190 1.00 0.00 ATOM 5694 H14S POP 46 22.320 9.350 47.980 1.00 0.00 ATOM 5695 5C21 POP 46 23.940 7.880 47.460 1.00 0.00 ATOM 5696 H15R POP 46 23.440 7.100 48.070 1.00 0.00 ATOM 5697 H15S POP 46 25.000 7.730 47.770 1.00 0.00 ATOM 5698 6C21 POP 46 23.710 7.530 45.990 1.00 0.00 ATOM 5699 H16R POP 46 24.320 8.200 45.350 1.00 0.00 ATOM 5700 H16S POP 46 22.650 7.690 45.700 1.00 0.00 ATOM 5701 7C21 POP 46 24.270 6.130 45.720 1.00 0.00 ATOM 5702 H17R POP 46 23.810 5.480 46.500 1.00 0.00 ATOM 5703 H17S POP 46 25.370 6.190 45.800 1.00 0.00 ATOM 5704 8C21 POP 46 23.890 5.580 44.350 1.00 0.00 ATOM 5705 H18R POP 46 22.810 5.340 44.220 1.00 0.00 ATOM 5706 H18S POP 46 24.470 4.650 44.200 1.00 0.00 ATOM 5707 H18T POP 46 24.270 6.270 43.570 1.00 0.00 ATOM 5708 C33 POP 46 29.130 16.880 59.040 1.00 0.00 ATOM 5709 H3X POP 46 30.110 17.350 58.820 1.00 0.00 ATOM 5710 H3Y POP 46 28.600 17.740 59.500 1.00 0.00 ATOM 5711 C34 POP 46 28.510 16.470 57.710 1.00 0.00 ATOM 5712 H4X POP 46 27.490 16.170 58.030 1.00 0.00 ATOM 5713 H4Y POP 46 29.140 15.580 57.470 1.00 0.00 ATOM 5714 C35 POP 46 28.490 17.410 56.500 1.00 0.00 ATOM 5715 H5X POP 46 29.490 17.680 56.110 1.00 0.00 ATOM 5716 H5Y POP 46 28.020 18.380 56.780 1.00 0.00 ATOM 5717 C36 POP 46 27.670 16.970 55.290 1.00 0.00 ATOM 5718 H6X POP 46 26.670 16.610 55.630 1.00 0.00 ATOM 5719 H6Y POP 46 28.200 16.140 54.780 1.00 0.00 ATOM 5720 C37 POP 46 27.490 18.070 54.240 1.00 0.00 ATOM 5721 H7X POP 46 28.540 18.270 53.960 1.00 0.00 ATOM 5722 H7Y POP 46 27.070 19.010 54.660 1.00 0.00 ATOM 5723 C38 POP 46 26.980 17.520 52.900 1.00 0.00 ATOM 5724 H8X POP 46 25.920 17.300 53.180 1.00 0.00 ATOM 5725 H8Y POP 46 27.510 16.570 52.720 1.00 0.00 ATOM 5726 C39 POP 46 27.270 18.470 51.740 1.00 0.00 ATOM 5727 H9X POP 46 28.350 18.570 51.490 1.00 0.00 ATOM 5728 H9Y POP 46 26.930 19.470 52.080 1.00 0.00 ATOM 5729 0C31 POP 46 26.540 18.080 50.450 1.00 0.00 ATOM 5730 H10X POP 46 25.470 17.910 50.680 1.00 0.00 ATOM 5731 H10Y POP 46 27.050 17.140 50.160 1.00 0.00 ATOM 5732 1C31 POP 46 26.630 19.100 49.310 1.00 0.00 ATOM 5733 H11X POP 46 27.670 19.050 48.930 1.00 0.00 ATOM 5734 H11Y POP 46 26.420 20.100 49.750 1.00 0.00 ATOM 5735 2C31 POP 46 25.600 18.870 48.200 1.00 0.00 ATOM 5736 H12X POP 46 24.710 18.340 48.600 1.00 0.00 ATOM 5737 H12Y POP 46 26.040 18.110 47.520 1.00 0.00 ATOM 5738 3C31 POP 46 25.320 20.150 47.400 1.00 0.00 ATOM 5739 H13X POP 46 26.230 20.240 46.770 1.00 0.00 ATOM 5740 H13Y POP 46 25.190 20.980 48.120 1.00 0.00 ATOM 5741 4C31 POP 46 24.110 19.970 46.480 1.00 0.00 ATOM 5742 H14X POP 46 24.280 18.990 45.970 1.00 0.00 ATOM 5743 H14Y POP 46 23.890 20.680 45.660 1.00 0.00 ATOM 5744 5C31 POP 46 22.830 19.860 47.320 1.00 0.00 ATOM 5745 H15X POP 46 23.190 19.750 48.370 1.00 0.00 ATOM 5746 H15Y POP 46 22.250 18.940 47.090 1.00 0.00 ATOM 5747 6C31 POP 46 21.890 21.060 47.290 1.00 0.00 ATOM 5748 H16X POP 46 22.400 22.040 47.400 1.00 0.00 ATOM 5749 H16Y POP 46 21.120 20.970 48.090 1.00 0.00 ATOM 5750 H16Z POP 46 21.300 21.080 46.350 1.00 0.00 ATOM 5751 N POP 47 30.980 17.630 66.120 1.00 0.00 ATOM 5752 HN1 POP 47 31.960 17.450 65.790 1.00 0.00 ATOM 5753 HN2 POP 47 31.040 18.230 66.960 1.00 0.00 ATOM 5754 HN3 POP 47 30.640 16.760 66.570 1.00 0.00 ATOM 5755 C12 POP 47 29.990 18.080 65.070 1.00 0.00 ATOM 5756 H12A POP 47 29.020 18.000 65.610 1.00 0.00 ATOM 5757 H12B POP 47 30.060 17.340 64.240 1.00 0.00 ATOM 5758 C11 POP 47 30.390 19.510 64.710 1.00 0.00 ATOM 5759 H11A POP 47 29.580 19.930 64.070 1.00 0.00 ATOM 5760 H11B POP 47 31.340 19.460 64.130 1.00 0.00 ATOM 5761 P POP 47 31.840 21.090 66.090 1.00 0.00 ATOM 5762 O13 POP 47 32.930 20.090 66.120 1.00 0.00 ATOM 5763 O14 POP 47 31.730 22.020 67.240 1.00 0.00 ATOM 5764 O11 POP 47 32.020 21.900 64.720 1.00 0.00 ATOM 5765 O12 POP 47 30.460 20.320 65.890 1.00 0.00 ATOM 5766 C1 POP 47 30.980 22.800 64.330 1.00 0.00 ATOM 5767 HA POP 47 31.080 23.670 65.010 1.00 0.00 ATOM 5768 HB POP 47 29.940 22.410 64.340 1.00 0.00 ATOM 5769 C2 POP 47 31.360 23.540 63.040 1.00 0.00 ATOM 5770 HS POP 47 30.450 24.160 62.860 1.00 0.00 ATOM 5771 O21 POP 47 31.420 22.580 61.980 1.00 0.00 ATOM 5772 C21 POP 47 31.200 23.100 60.770 1.00 0.00 ATOM 5773 O22 POP 47 30.870 24.240 60.480 1.00 0.00 ATOM 5774 C22 POP 47 31.240 21.950 59.780 1.00 0.00 ATOM 5775 H2R POP 47 31.150 20.930 60.220 1.00 0.00 ATOM 5776 H2S POP 47 32.320 22.010 59.550 1.00 0.00 ATOM 5777 C3 POP 47 32.640 24.360 63.210 1.00 0.00 ATOM 5778 HX POP 47 33.480 23.660 63.410 1.00 0.00 ATOM 5779 HY POP 47 32.360 24.930 64.120 1.00 0.00 ATOM 5780 O31 POP 47 32.890 25.350 62.200 1.00 0.00 ATOM 5781 C31 POP 47 33.550 25.120 61.060 1.00 0.00 ATOM 5782 O32 POP 47 34.130 24.090 60.750 1.00 0.00 ATOM 5783 C32 POP 47 33.370 26.340 60.170 1.00 0.00 ATOM 5784 H2X POP 47 33.740 27.260 60.680 1.00 0.00 ATOM 5785 H2Y POP 47 32.290 26.520 59.970 1.00 0.00 ATOM 5786 C23 POP 47 30.340 22.100 58.550 1.00 0.00 ATOM 5787 H3R POP 47 30.100 23.160 58.300 1.00 0.00 ATOM 5788 H3S POP 47 29.300 21.710 58.690 1.00 0.00 ATOM 5789 C24 POP 47 30.920 21.450 57.300 1.00 0.00 ATOM 5790 H4R POP 47 31.230 20.410 57.540 1.00 0.00 ATOM 5791 H4S POP 47 31.820 22.100 57.290 1.00 0.00 ATOM 5792 C25 POP 47 30.100 21.580 56.010 1.00 0.00 ATOM 5793 H5R POP 47 30.230 22.630 55.660 1.00 0.00 ATOM 5794 H5S POP 47 29.040 21.450 56.320 1.00 0.00 ATOM 5795 C26 POP 47 30.620 20.600 54.960 1.00 0.00 ATOM 5796 H6R POP 47 30.010 20.670 54.040 1.00 0.00 ATOM 5797 H6S POP 47 30.440 19.600 55.430 1.00 0.00 ATOM 5798 C27 POP 47 32.030 20.750 54.390 1.00 0.00 ATOM 5799 H7R POP 47 32.810 20.790 55.180 1.00 0.00 ATOM 5800 H7S POP 47 32.030 21.680 53.790 1.00 0.00 ATOM 5801 C28 POP 47 32.420 19.650 53.390 1.00 0.00 ATOM 5802 H8R POP 47 31.500 19.270 52.890 1.00 0.00 ATOM 5803 H8S POP 47 32.760 18.730 53.910 1.00 0.00 ATOM 5804 C29 POP 47 33.530 20.080 52.470 1.00 0.00 ATOM 5805 H91 POP 47 34.330 20.540 53.070 1.00 0.00 ATOM 5806 0C21 POP 47 33.550 20.090 51.130 1.00 0.00 ATOM 5807 1H10 POP 47 34.470 20.450 50.660 1.00 0.00 ATOM 5808 1C21 POP 47 32.470 19.640 50.180 1.00 0.00 ATOM 5809 H11R POP 47 31.460 19.720 50.620 1.00 0.00 ATOM 5810 H11S POP 47 32.640 18.580 49.890 1.00 0.00 ATOM 5811 2C21 POP 47 32.450 20.610 49.000 1.00 0.00 ATOM 5812 H12R POP 47 33.420 20.500 48.470 1.00 0.00 ATOM 5813 H12S POP 47 32.300 21.600 49.490 1.00 0.00 ATOM 5814 3C21 POP 47 31.420 20.260 47.930 1.00 0.00 ATOM 5815 H13R POP 47 31.380 21.160 47.270 1.00 0.00 ATOM 5816 H13S POP 47 30.520 19.940 48.500 1.00 0.00 ATOM 5817 4C21 POP 47 31.700 19.070 47.010 1.00 0.00 ATOM 5818 H14R POP 47 31.830 18.190 47.670 1.00 0.00 ATOM 5819 H14S POP 47 32.550 19.350 46.350 1.00 0.00 ATOM 5820 5C21 POP 47 30.580 18.770 46.010 1.00 0.00 ATOM 5821 H15R POP 47 30.220 19.610 45.380 1.00 0.00 ATOM 5822 H15S POP 47 29.680 18.610 46.650 1.00 0.00 ATOM 5823 6C21 POP 47 30.780 17.450 45.270 1.00 0.00 ATOM 5824 H16R POP 47 30.650 16.610 45.980 1.00 0.00 ATOM 5825 H16S POP 47 31.860 17.530 45.010 1.00 0.00 ATOM 5826 7C21 POP 47 29.890 17.230 44.040 1.00 0.00 ATOM 5827 H17R POP 47 30.170 17.850 43.160 1.00 0.00 ATOM 5828 H17S POP 47 28.810 17.430 44.190 1.00 0.00 ATOM 5829 8C21 POP 47 29.930 15.780 43.570 1.00 0.00 ATOM 5830 H18R POP 47 29.030 15.630 42.930 1.00 0.00 ATOM 5831 H18S POP 47 29.970 15.140 44.480 1.00 0.00 ATOM 5832 H18T POP 47 30.840 15.520 42.990 1.00 0.00 ATOM 5833 C33 POP 47 34.190 26.130 58.900 1.00 0.00 ATOM 5834 H3X POP 47 35.270 25.940 59.080 1.00 0.00 ATOM 5835 H3Y POP 47 34.200 27.090 58.340 1.00 0.00 ATOM 5836 C34 POP 47 33.570 25.190 57.860 1.00 0.00 ATOM 5837 H4X POP 47 32.470 25.280 57.860 1.00 0.00 ATOM 5838 H4Y POP 47 33.890 24.170 58.170 1.00 0.00 ATOM 5839 C35 POP 47 34.300 25.230 56.520 1.00 0.00 ATOM 5840 H5X POP 47 34.890 26.170 56.660 1.00 0.00 ATOM 5841 H5Y POP 47 33.520 25.540 55.790 1.00 0.00 ATOM 5842 C36 POP 47 34.990 23.910 56.190 1.00 0.00 ATOM 5843 H6X POP 47 34.270 23.080 56.330 1.00 0.00 ATOM 5844 H6Y POP 47 35.770 23.710 56.960 1.00 0.00 ATOM 5845 C37 POP 47 35.590 23.870 54.780 1.00 0.00 ATOM 5846 H7X POP 47 36.080 22.880 54.680 1.00 0.00 ATOM 5847 H7Y POP 47 36.330 24.690 54.670 1.00 0.00 ATOM 5848 C38 POP 47 34.540 24.010 53.670 1.00 0.00 ATOM 5849 H8X POP 47 33.830 24.840 53.890 1.00 0.00 ATOM 5850 H8Y POP 47 33.930 23.090 53.590 1.00 0.00 ATOM 5851 C39 POP 47 35.260 24.350 52.360 1.00 0.00 ATOM 5852 H9X POP 47 36.200 23.760 52.240 1.00 0.00 ATOM 5853 H9Y POP 47 35.600 25.400 52.400 1.00 0.00 ATOM 5854 0C31 POP 47 34.490 24.010 51.090 1.00 0.00 ATOM 5855 H10X POP 47 33.580 24.630 51.000 1.00 0.00 ATOM 5856 H10Y POP 47 34.190 22.950 51.230 1.00 0.00 ATOM 5857 1C31 POP 47 35.400 24.060 49.860 1.00 0.00 ATOM 5858 H11X POP 47 36.300 23.450 50.070 1.00 0.00 ATOM 5859 H11Y POP 47 35.770 25.110 49.790 1.00 0.00 ATOM 5860 2C31 POP 47 34.670 23.740 48.550 1.00 0.00 ATOM 5861 H12X POP 47 34.250 22.720 48.660 1.00 0.00 ATOM 5862 H12Y POP 47 35.410 23.690 47.720 1.00 0.00 ATOM 5863 3C31 POP 47 33.450 24.590 48.180 1.00 0.00 ATOM 5864 H13X POP 47 33.800 25.630 48.020 1.00 0.00 ATOM 5865 H13Y POP 47 32.700 24.600 49.010 1.00 0.00 ATOM 5866 4C31 POP 47 32.870 24.180 46.830 1.00 0.00 ATOM 5867 H14X POP 47 32.370 23.200 47.000 1.00 0.00 ATOM 5868 H14Y POP 47 33.720 23.980 46.140 1.00 0.00 ATOM 5869 5C31 POP 47 31.850 25.190 46.300 1.00 0.00 ATOM 5870 H15X POP 47 32.420 26.140 46.230 1.00 0.00 ATOM 5871 H15Y POP 47 31.050 25.200 47.070 1.00 0.00 ATOM 5872 6C31 POP 47 31.240 24.890 44.930 1.00 0.00 ATOM 5873 H16X POP 47 32.030 24.690 44.180 1.00 0.00 ATOM 5874 H16Y POP 47 30.580 25.720 44.590 1.00 0.00 ATOM 5875 H16Z POP 47 30.640 23.960 44.920 1.00 0.00 ATOM 5876 N POP 48 45.760 43.800 64.170 1.00 0.00 ATOM 5877 HN1 POP 48 44.830 43.810 64.620 1.00 0.00 ATOM 5878 HN2 POP 48 46.280 42.930 64.380 1.00 0.00 ATOM 5879 HN3 POP 48 46.320 44.560 64.600 1.00 0.00 ATOM 5880 C12 POP 48 45.650 44.110 62.690 1.00 0.00 ATOM 5881 H12A POP 48 44.750 44.740 62.540 1.00 0.00 ATOM 5882 H12B POP 48 45.390 43.130 62.240 1.00 0.00 ATOM 5883 C11 POP 48 46.990 44.580 62.100 1.00 0.00 ATOM 5884 H11A POP 48 47.160 45.650 62.340 1.00 0.00 ATOM 5885 H11B POP 48 46.960 44.480 61.000 1.00 0.00 ATOM 5886 P POP 48 49.500 44.170 62.140 1.00 0.00 ATOM 5887 O13 POP 48 50.510 43.620 63.070 1.00 0.00 ATOM 5888 O14 POP 48 49.560 45.590 61.730 1.00 0.00 ATOM 5889 O11 POP 48 49.480 43.320 60.790 1.00 0.00 ATOM 5890 O12 POP 48 48.050 43.840 62.720 1.00 0.00 ATOM 5891 C1 POP 48 50.700 42.780 60.260 1.00 0.00 ATOM 5892 HA POP 48 50.490 41.860 59.670 1.00 0.00 ATOM 5893 HB POP 48 51.320 42.380 61.090 1.00 0.00 ATOM 5894 C2 POP 48 51.550 43.750 59.420 1.00 0.00 ATOM 5895 HS POP 48 51.810 44.650 60.020 1.00 0.00 ATOM 5896 O21 POP 48 50.670 44.100 58.350 1.00 0.00 ATOM 5897 C21 POP 48 50.800 45.370 57.960 1.00 0.00 ATOM 5898 O22 POP 48 51.630 46.150 58.400 1.00 0.00 ATOM 5899 C22 POP 48 49.830 45.600 56.810 1.00 0.00 ATOM 5900 H2R POP 48 49.030 46.270 57.190 1.00 0.00 ATOM 5901 H2S POP 48 49.390 44.610 56.570 1.00 0.00 ATOM 5902 C3 POP 48 52.820 43.120 58.840 1.00 0.00 ATOM 5903 HX POP 48 53.260 42.770 59.800 1.00 0.00 ATOM 5904 HY POP 48 53.620 43.750 58.390 1.00 0.00 ATOM 5905 O31 POP 48 52.580 41.960 58.050 1.00 0.00 ATOM 5906 C31 POP 48 52.630 42.310 56.760 1.00 0.00 ATOM 5907 O32 POP 48 53.020 43.410 56.400 1.00 0.00 ATOM 5908 C32 POP 48 52.070 41.220 55.860 1.00 0.00 ATOM 5909 H2X POP 48 50.970 41.230 55.980 1.00 0.00 ATOM 5910 H2Y POP 48 52.520 40.250 56.150 1.00 0.00 ATOM 5911 C23 POP 48 50.560 46.310 55.670 1.00 0.00 ATOM 5912 H3R POP 48 51.350 45.590 55.360 1.00 0.00 ATOM 5913 H3S POP 48 51.060 47.250 56.010 1.00 0.00 ATOM 5914 C24 POP 48 49.590 46.720 54.560 1.00 0.00 ATOM 5915 H4R POP 48 50.070 47.360 53.800 1.00 0.00 ATOM 5916 H4S POP 48 48.800 47.390 54.980 1.00 0.00 ATOM 5917 C25 POP 48 48.870 45.550 53.870 1.00 0.00 ATOM 5918 H5R POP 48 48.200 45.100 54.630 1.00 0.00 ATOM 5919 H5S POP 48 49.680 44.870 53.520 1.00 0.00 ATOM 5920 C26 POP 48 47.990 46.120 52.750 1.00 0.00 ATOM 5921 H6R POP 48 47.340 46.840 53.290 1.00 0.00 ATOM 5922 H6S POP 48 47.380 45.310 52.290 1.00 0.00 ATOM 5923 C27 POP 48 48.710 46.950 51.690 1.00 0.00 ATOM 5924 H7R POP 48 49.690 46.500 51.430 1.00 0.00 ATOM 5925 H7S POP 48 48.900 47.920 52.200 1.00 0.00 ATOM 5926 C28 POP 48 47.850 47.140 50.440 1.00 0.00 ATOM 5927 H8R POP 48 46.910 47.660 50.710 1.00 0.00 ATOM 5928 H8S POP 48 47.650 46.140 49.990 1.00 0.00 ATOM 5929 C29 POP 48 48.540 48.030 49.450 1.00 0.00 ATOM 5930 H91 POP 48 49.340 48.660 49.880 1.00 0.00 ATOM 5931 0C21 POP 48 48.370 48.110 48.120 1.00 0.00 ATOM 5932 1H10 POP 48 49.030 48.770 47.550 1.00 0.00 ATOM 5933 1C21 POP 48 47.470 47.190 47.350 1.00 0.00 ATOM 5934 H11R POP 48 46.940 47.680 46.500 1.00 0.00 ATOM 5935 H11S POP 48 46.560 46.930 47.940 1.00 0.00 ATOM 5936 2C21 POP 48 48.000 45.820 46.920 1.00 0.00 ATOM 5937 H12R POP 48 48.540 45.340 47.760 1.00 0.00 ATOM 5938 H12S POP 48 48.630 45.990 46.020 1.00 0.00 ATOM 5939 3C21 POP 48 47.030 44.750 46.420 1.00 0.00 ATOM 5940 H13R POP 48 47.590 44.110 45.700 1.00 0.00 ATOM 5941 H13S POP 48 46.270 45.260 45.780 1.00 0.00 ATOM 5942 4C21 POP 48 46.380 43.810 47.430 1.00 0.00 ATOM 5943 H14R POP 48 45.770 44.490 48.080 1.00 0.00 ATOM 5944 H14S POP 48 47.150 43.350 48.080 1.00 0.00 ATOM 5945 5C21 POP 48 45.490 42.780 46.740 1.00 0.00 ATOM 5946 H15R POP 48 46.180 42.190 46.100 1.00 0.00 ATOM 5947 H15S POP 48 44.720 43.350 46.180 1.00 0.00 ATOM 5948 6C21 POP 48 44.800 41.850 47.740 1.00 0.00 ATOM 5949 H16R POP 48 44.000 41.250 47.270 1.00 0.00 ATOM 5950 H16S POP 48 44.300 42.490 48.500 1.00 0.00 ATOM 5951 7C21 POP 48 45.680 40.900 48.560 1.00 0.00 ATOM 5952 H17R POP 48 46.520 41.440 49.040 1.00 0.00 ATOM 5953 H17S POP 48 46.130 40.120 47.910 1.00 0.00 ATOM 5954 8C21 POP 48 44.920 40.100 49.630 1.00 0.00 ATOM 5955 H18R POP 48 45.590 39.640 50.390 1.00 0.00 ATOM 5956 H18S POP 48 44.210 39.320 49.290 1.00 0.00 ATOM 5957 H18T POP 48 44.360 40.880 50.180 1.00 0.00 ATOM 5958 C33 POP 48 52.540 41.270 54.410 1.00 0.00 ATOM 5959 H3X POP 48 53.590 41.550 54.170 1.00 0.00 ATOM 5960 H3Y POP 48 51.980 42.140 54.010 1.00 0.00 ATOM 5961 C34 POP 48 52.160 39.970 53.700 1.00 0.00 ATOM 5962 H4X POP 48 51.080 39.710 53.680 1.00 0.00 ATOM 5963 H4Y POP 48 52.760 39.180 54.190 1.00 0.00 ATOM 5964 C35 POP 48 52.620 39.820 52.250 1.00 0.00 ATOM 5965 H5X POP 48 51.840 40.410 51.720 1.00 0.00 ATOM 5966 H5Y POP 48 52.480 38.760 51.940 1.00 0.00 ATOM 5967 C36 POP 48 54.080 40.230 52.060 1.00 0.00 ATOM 5968 H6X POP 48 54.700 39.920 52.930 1.00 0.00 ATOM 5969 H6Y POP 48 54.230 41.330 52.000 1.00 0.00 ATOM 5970 C37 POP 48 54.580 39.690 50.710 1.00 0.00 ATOM 5971 H7X POP 48 55.620 40.060 50.620 1.00 0.00 ATOM 5972 H7Y POP 48 53.940 40.210 49.960 1.00 0.00 ATOM 5973 C38 POP 48 54.530 38.190 50.460 1.00 0.00 ATOM 5974 H8X POP 48 53.580 37.830 50.010 1.00 0.00 ATOM 5975 H8Y POP 48 54.700 37.630 51.410 1.00 0.00 ATOM 5976 C39 POP 48 55.640 37.720 49.520 1.00 0.00 ATOM 5977 H9X POP 48 55.690 36.610 49.460 1.00 0.00 ATOM 5978 H9Y POP 48 56.610 38.070 49.930 1.00 0.00 ATOM 5979 0C31 POP 48 55.460 38.320 48.120 1.00 0.00 ATOM 5980 H10X POP 48 55.460 39.420 48.320 1.00 0.00 ATOM 5981 H10Y POP 48 54.530 38.070 47.560 1.00 0.00 ATOM 5982 1C31 POP 48 56.700 37.960 47.310 1.00 0.00 ATOM 5983 H11X POP 48 56.600 36.900 46.980 1.00 0.00 ATOM 5984 H11Y POP 48 57.540 37.900 48.040 1.00 0.00 ATOM 5985 2C31 POP 48 56.880 38.680 45.970 1.00 0.00 ATOM 5986 H12X POP 48 56.820 39.740 46.310 1.00 0.00 ATOM 5987 H12Y POP 48 56.230 38.390 45.120 1.00 0.00 ATOM 5988 3C31 POP 48 58.300 38.580 45.420 1.00 0.00 ATOM 5989 H13X POP 48 58.590 37.570 45.060 1.00 0.00 ATOM 5990 H13Y POP 48 59.120 38.690 46.170 1.00 0.00 ATOM 5991 4C31 POP 48 58.670 39.490 44.250 1.00 0.00 ATOM 5992 H14X POP 48 58.270 40.510 44.470 1.00 0.00 ATOM 5993 H14Y POP 48 58.110 39.150 43.350 1.00 0.00 ATOM 5994 5C31 POP 48 60.120 39.460 43.750 1.00 0.00 ATOM 5995 H15X POP 48 60.470 38.410 43.710 1.00 0.00 ATOM 5996 H15Y POP 48 60.730 40.110 44.410 1.00 0.00 ATOM 5997 6C31 POP 48 60.350 39.990 42.340 1.00 0.00 ATOM 5998 H16X POP 48 59.840 39.400 41.540 1.00 0.00 ATOM 5999 H16Y POP 48 61.440 39.930 42.110 1.00 0.00 ATOM 6000 H16Z POP 48 60.060 41.060 42.370 1.00 0.00 ATOM 6001 N POP 49 27.540 43.740 64.940 1.00 0.00 ATOM 6002 HN1 POP 49 27.890 43.030 65.620 1.00 0.00 ATOM 6003 HN2 POP 49 27.460 44.680 65.380 1.00 0.00 ATOM 6004 HN3 POP 49 26.560 43.460 64.730 1.00 0.00 ATOM 6005 C12 POP 49 28.370 43.790 63.680 1.00 0.00 ATOM 6006 H12A POP 49 27.650 44.110 62.890 1.00 0.00 ATOM 6007 H12B POP 49 28.610 42.720 63.540 1.00 0.00 ATOM 6008 C11 POP 49 29.500 44.800 63.900 1.00 0.00 ATOM 6009 H11A POP 49 29.030 45.800 63.910 1.00 0.00 ATOM 6010 H11B POP 49 30.230 44.690 63.070 1.00 0.00 ATOM 6011 P POP 49 31.680 44.790 65.190 1.00 0.00 ATOM 6012 O13 POP 49 31.890 46.160 64.670 1.00 0.00 ATOM 6013 O14 POP 49 32.110 44.500 66.570 1.00 0.00 ATOM 6014 O11 POP 49 32.370 43.690 64.250 1.00 0.00 ATOM 6015 O12 POP 49 30.100 44.550 65.170 1.00 0.00 ATOM 6016 C1 POP 49 33.650 44.040 63.710 1.00 0.00 ATOM 6017 HA POP 49 34.240 43.110 63.850 1.00 0.00 ATOM 6018 HB POP 49 34.150 44.740 64.400 1.00 0.00 ATOM 6019 C2 POP 49 33.590 44.310 62.190 1.00 0.00 ATOM 6020 HS POP 49 33.140 45.320 62.070 1.00 0.00 ATOM 6021 O21 POP 49 32.790 43.200 61.780 1.00 0.00 ATOM 6022 C21 POP 49 31.980 43.500 60.750 1.00 0.00 ATOM 6023 O22 POP 49 31.930 44.580 60.200 1.00 0.00 ATOM 6024 C22 POP 49 31.050 42.330 60.460 1.00 0.00 ATOM 6025 H2R POP 49 30.460 42.150 61.380 1.00 0.00 ATOM 6026 H2S POP 49 31.610 41.410 60.180 1.00 0.00 ATOM 6027 C3 POP 49 34.930 44.210 61.460 1.00 0.00 ATOM 6028 HX POP 49 35.460 43.250 61.640 1.00 0.00 ATOM 6029 HY POP 49 35.510 45.060 61.890 1.00 0.00 ATOM 6030 O31 POP 49 34.890 44.390 60.040 1.00 0.00 ATOM 6031 C31 POP 49 35.250 45.550 59.480 1.00 0.00 ATOM 6032 O32 POP 49 35.750 46.500 60.050 1.00 0.00 ATOM 6033 C32 POP 49 35.160 45.360 57.970 1.00 0.00 ATOM 6034 H2X POP 49 35.770 44.460 57.740 1.00 0.00 ATOM 6035 H2Y POP 49 35.760 46.160 57.470 1.00 0.00 ATOM 6036 C23 POP 49 30.060 42.650 59.340 1.00 0.00 ATOM 6037 H3R POP 49 29.790 43.720 59.220 1.00 0.00 ATOM 6038 H3S POP 49 29.160 42.080 59.660 1.00 0.00 ATOM 6039 C24 POP 49 30.410 42.030 57.990 1.00 0.00 ATOM 6040 H4R POP 49 30.550 40.940 58.120 1.00 0.00 ATOM 6041 H4S POP 49 31.400 42.390 57.620 1.00 0.00 ATOM 6042 C25 POP 49 29.360 42.420 56.940 1.00 0.00 ATOM 6043 H5R POP 49 29.410 43.490 56.660 1.00 0.00 ATOM 6044 H5S POP 49 28.350 42.240 57.370 1.00 0.00 ATOM 6045 C26 POP 49 29.630 41.510 55.740 1.00 0.00 ATOM 6046 H6R POP 49 29.650 40.480 56.150 1.00 0.00 ATOM 6047 H6S POP 49 30.610 41.830 55.320 1.00 0.00 ATOM 6048 C27 POP 49 28.610 41.730 54.610 1.00 0.00 ATOM 6049 H7R POP 49 28.380 42.800 54.460 1.00 0.00 ATOM 6050 H7S POP 49 27.640 41.290 54.930 1.00 0.00 ATOM 6051 C28 POP 49 29.060 41.140 53.270 1.00 0.00 ATOM 6052 H8R POP 49 30.030 41.660 53.100 1.00 0.00 ATOM 6053 H8S POP 49 28.270 41.420 52.540 1.00 0.00 ATOM 6054 C29 POP 49 29.270 39.660 53.350 1.00 0.00 ATOM 6055 H91 POP 49 30.070 39.440 54.060 1.00 0.00 ATOM 6056 0C21 POP 49 28.680 38.620 52.740 1.00 0.00 ATOM 6057 1H10 POP 49 29.120 37.630 52.950 1.00 0.00 ATOM 6058 1C21 POP 49 27.530 38.750 51.790 1.00 0.00 ATOM 6059 H11R POP 49 27.820 39.450 50.990 1.00 0.00 ATOM 6060 H11S POP 49 26.580 38.960 52.330 1.00 0.00 ATOM 6061 2C21 POP 49 27.330 37.360 51.180 1.00 0.00 ATOM 6062 H12R POP 49 27.340 36.650 52.040 1.00 0.00 ATOM 6063 H12S POP 49 28.140 37.160 50.440 1.00 0.00 ATOM 6064 3C21 POP 49 25.950 37.310 50.530 1.00 0.00 ATOM 6065 H13R POP 49 25.680 38.180 49.890 1.00 0.00 ATOM 6066 H13S POP 49 25.210 37.270 51.360 1.00 0.00 ATOM 6067 4C21 POP 49 25.730 36.120 49.600 1.00 0.00 ATOM 6068 H14R POP 49 24.720 35.740 49.850 1.00 0.00 ATOM 6069 H14S POP 49 26.520 35.350 49.770 1.00 0.00 ATOM 6070 5C21 POP 49 25.680 36.470 48.110 1.00 0.00 ATOM 6071 H15R POP 49 26.560 37.060 47.780 1.00 0.00 ATOM 6072 H15S POP 49 24.840 37.180 48.080 1.00 0.00 ATOM 6073 6C21 POP 49 25.520 35.230 47.230 1.00 0.00 ATOM 6074 H16R POP 49 25.180 35.610 46.230 1.00 0.00 ATOM 6075 H16S POP 49 24.820 34.510 47.710 1.00 0.00 ATOM 6076 7C21 POP 49 26.780 34.420 46.940 1.00 0.00 ATOM 6077 H17R POP 49 27.260 34.170 47.910 1.00 0.00 ATOM 6078 H17S POP 49 27.460 35.000 46.270 1.00 0.00 ATOM 6079 8C21 POP 49 26.400 33.160 46.170 1.00 0.00 ATOM 6080 H18R POP 49 27.290 32.570 45.860 1.00 0.00 ATOM 6081 H18S POP 49 25.710 33.420 45.340 1.00 0.00 ATOM 6082 H18T POP 49 25.830 32.530 46.880 1.00 0.00 ATOM 6083 C33 POP 49 33.750 45.330 57.390 1.00 0.00 ATOM 6084 H3X POP 49 33.380 46.370 57.470 1.00 0.00 ATOM 6085 H3Y POP 49 33.140 44.660 58.030 1.00 0.00 ATOM 6086 C34 POP 49 33.790 44.720 55.980 1.00 0.00 ATOM 6087 H4X POP 49 33.770 43.630 56.190 1.00 0.00 ATOM 6088 H4Y POP 49 34.720 44.990 55.430 1.00 0.00 ATOM 6089 C35 POP 49 32.500 45.130 55.270 1.00 0.00 ATOM 6090 H5X POP 49 32.320 46.210 55.480 1.00 0.00 ATOM 6091 H5Y POP 49 31.640 44.680 55.810 1.00 0.00 ATOM 6092 C36 POP 49 32.540 44.900 53.760 1.00 0.00 ATOM 6093 H6X POP 49 32.530 43.790 53.720 1.00 0.00 ATOM 6094 H6Y POP 49 33.480 45.180 53.230 1.00 0.00 ATOM 6095 C37 POP 49 31.410 45.620 53.020 1.00 0.00 ATOM 6096 H7X POP 49 31.480 46.730 53.100 1.00 0.00 ATOM 6097 H7Y POP 49 30.400 45.260 53.300 1.00 0.00 ATOM 6098 C38 POP 49 31.530 45.290 51.530 1.00 0.00 ATOM 6099 H8X POP 49 32.030 44.330 51.270 1.00 0.00 ATOM 6100 H8Y POP 49 32.160 46.030 50.990 1.00 0.00 ATOM 6101 C39 POP 49 30.190 45.180 50.810 1.00 0.00 ATOM 6102 H9X POP 49 29.610 46.120 50.760 1.00 0.00 ATOM 6103 H9Y POP 49 29.420 44.480 51.210 1.00 0.00 ATOM 6104 0C31 POP 49 30.340 44.790 49.340 1.00 0.00 ATOM 6105 H10X POP 49 30.610 43.710 49.250 1.00 0.00 ATOM 6106 H10Y POP 49 31.140 45.370 48.830 1.00 0.00 ATOM 6107 1C31 POP 49 29.130 44.960 48.420 1.00 0.00 ATOM 6108 H11X POP 49 29.390 44.780 47.350 1.00 0.00 ATOM 6109 H11Y POP 49 28.740 46.000 48.490 1.00 0.00 ATOM 6110 2C31 POP 49 27.980 43.960 48.560 1.00 0.00 ATOM 6111 H12X POP 49 27.580 44.020 49.590 1.00 0.00 ATOM 6112 H12Y POP 49 28.250 42.880 48.470 1.00 0.00 ATOM 6113 3C31 POP 49 26.870 44.230 47.540 1.00 0.00 ATOM 6114 H13X POP 49 26.440 45.250 47.450 1.00 0.00 ATOM 6115 H13Y POP 49 26.080 43.520 47.840 1.00 0.00 ATOM 6116 4C31 POP 49 27.330 43.790 46.140 1.00 0.00 ATOM 6117 H14X POP 49 27.690 42.740 46.160 1.00 0.00 ATOM 6118 H14Y POP 49 28.210 44.370 45.800 1.00 0.00 ATOM 6119 5C31 POP 49 26.190 43.890 45.130 1.00 0.00 ATOM 6120 H15X POP 49 25.740 44.900 45.020 1.00 0.00 ATOM 6121 H15Y POP 49 25.400 43.270 45.610 1.00 0.00 ATOM 6122 6C31 POP 49 26.600 43.340 43.770 1.00 0.00 ATOM 6123 H16X POP 49 25.690 43.350 43.140 1.00 0.00 ATOM 6124 H16Y POP 49 26.890 42.270 43.870 1.00 0.00 ATOM 6125 H16Z POP 49 27.410 43.910 43.270 1.00 0.00 ATOM 6126 N POP 50 14.630 40.520 67.550 1.00 0.00 ATOM 6127 HN1 POP 50 14.340 41.340 68.130 1.00 0.00 ATOM 6128 HN2 POP 50 15.110 39.820 68.140 1.00 0.00 ATOM 6129 HN3 POP 50 15.200 40.780 66.720 1.00 0.00 ATOM 6130 C12 POP 50 13.390 39.840 67.020 1.00 0.00 ATOM 6131 H12A POP 50 12.790 39.500 67.900 1.00 0.00 ATOM 6132 H12B POP 50 13.600 38.930 66.420 1.00 0.00 ATOM 6133 C11 POP 50 12.430 40.730 66.230 1.00 0.00 ATOM 6134 H11A POP 50 11.940 41.440 66.930 1.00 0.00 ATOM 6135 H11B POP 50 11.630 40.040 65.870 1.00 0.00 ATOM 6136 P POP 50 13.320 42.880 65.150 1.00 0.00 ATOM 6137 O13 POP 50 14.350 43.240 66.150 1.00 0.00 ATOM 6138 O14 POP 50 11.990 43.530 65.260 1.00 0.00 ATOM 6139 O11 POP 50 13.790 43.190 63.650 1.00 0.00 ATOM 6140 O12 POP 50 13.120 41.300 65.110 1.00 0.00 ATOM 6141 C1 POP 50 13.350 44.380 63.000 1.00 0.00 ATOM 6142 HA POP 50 14.110 44.720 62.260 1.00 0.00 ATOM 6143 HB POP 50 13.190 45.200 63.730 1.00 0.00 ATOM 6144 C2 POP 50 12.020 44.130 62.250 1.00 0.00 ATOM 6145 HS POP 50 11.260 44.390 63.020 1.00 0.00 ATOM 6146 O21 POP 50 11.890 42.760 61.870 1.00 0.00 ATOM 6147 C21 POP 50 10.640 42.300 61.930 1.00 0.00 ATOM 6148 O22 POP 50 9.680 42.950 62.280 1.00 0.00 ATOM 6149 C22 POP 50 10.650 40.860 61.410 1.00 0.00 ATOM 6150 H2R POP 50 11.190 40.780 60.440 1.00 0.00 ATOM 6151 H2S POP 50 9.630 40.430 61.390 1.00 0.00 ATOM 6152 C3 POP 50 11.780 44.990 61.000 1.00 0.00 ATOM 6153 HX POP 50 12.000 46.040 61.290 1.00 0.00 ATOM 6154 HY POP 50 10.740 44.930 60.600 1.00 0.00 ATOM 6155 O31 POP 50 12.660 44.540 59.970 1.00 0.00 ATOM 6156 C31 POP 50 13.170 45.560 59.270 1.00 0.00 ATOM 6157 O32 POP 50 12.830 46.730 59.380 1.00 0.00 ATOM 6158 C32 POP 50 14.270 45.030 58.370 1.00 0.00 ATOM 6159 H2X POP 50 14.770 45.890 57.890 1.00 0.00 ATOM 6160 H2Y POP 50 13.800 44.380 57.610 1.00 0.00 ATOM 6161 C23 POP 50 11.380 40.150 62.550 1.00 0.00 ATOM 6162 H3R POP 50 10.950 40.420 63.540 1.00 0.00 ATOM 6163 H3S POP 50 12.410 40.550 62.470 1.00 0.00 ATOM 6164 C24 POP 50 11.530 38.630 62.460 1.00 0.00 ATOM 6165 H4R POP 50 12.170 38.470 61.560 1.00 0.00 ATOM 6166 H4S POP 50 10.660 37.940 62.490 1.00 0.00 ATOM 6167 C25 POP 50 12.460 38.110 63.560 1.00 0.00 ATOM 6168 H5R POP 50 12.010 37.800 64.530 1.00 0.00 ATOM 6169 H5S POP 50 13.190 38.910 63.780 1.00 0.00 ATOM 6170 C26 POP 50 13.300 36.930 63.060 1.00 0.00 ATOM 6171 H6R POP 50 12.510 36.330 62.560 1.00 0.00 ATOM 6172 H6S POP 50 13.590 36.350 63.960 1.00 0.00 ATOM 6173 C27 POP 50 14.500 37.150 62.130 1.00 0.00 ATOM 6174 H7R POP 50 15.290 37.780 62.600 1.00 0.00 ATOM 6175 H7S POP 50 14.230 37.740 61.240 1.00 0.00 ATOM 6176 C28 POP 50 15.260 35.940 61.570 1.00 0.00 ATOM 6177 H8R POP 50 14.480 35.280 61.140 1.00 0.00 ATOM 6178 H8S POP 50 15.680 35.290 62.370 1.00 0.00 ATOM 6179 C29 POP 50 16.290 36.520 60.650 1.00 0.00 ATOM 6180 H91 POP 50 16.870 37.400 60.990 1.00 0.00 ATOM 6181 0C21 POP 50 16.370 36.190 59.350 1.00 0.00 ATOM 6182 1H10 POP 50 17.060 36.760 58.720 1.00 0.00 ATOM 6183 1C21 POP 50 15.850 34.950 58.680 1.00 0.00 ATOM 6184 H11R POP 50 14.890 35.050 58.130 1.00 0.00 ATOM 6185 H11S POP 50 15.720 34.270 59.550 1.00 0.00 ATOM 6186 2C21 POP 50 16.910 34.400 57.740 1.00 0.00 ATOM 6187 H12R POP 50 17.830 34.140 58.310 1.00 0.00 ATOM 6188 H12S POP 50 17.190 35.100 56.920 1.00 0.00 ATOM 6189 3C21 POP 50 16.350 33.220 56.930 1.00 0.00 ATOM 6190 H13R POP 50 15.470 33.510 56.320 1.00 0.00 ATOM 6191 H13S POP 50 16.030 32.420 57.630 1.00 0.00 ATOM 6192 4C21 POP 50 17.320 32.580 55.930 1.00 0.00 ATOM 6193 H14R POP 50 18.030 32.060 56.600 1.00 0.00 ATOM 6194 H14S POP 50 17.930 33.320 55.360 1.00 0.00 ATOM 6195 5C21 POP 50 16.600 31.670 54.930 1.00 0.00 ATOM 6196 H15R POP 50 16.210 30.780 55.480 1.00 0.00 ATOM 6197 H15S POP 50 15.650 32.120 54.590 1.00 0.00 ATOM 6198 6C21 POP 50 17.530 31.150 53.830 1.00 0.00 ATOM 6199 H16R POP 50 18.330 30.470 54.200 1.00 0.00 ATOM 6200 H16S POP 50 17.990 32.060 53.380 1.00 0.00 ATOM 6201 7C21 POP 50 16.760 30.410 52.740 1.00 0.00 ATOM 6202 H17R POP 50 16.100 31.110 52.190 1.00 0.00 ATOM 6203 H17S POP 50 16.180 29.590 53.210 1.00 0.00 ATOM 6204 8C21 POP 50 17.630 29.750 51.670 1.00 0.00 ATOM 6205 H18R POP 50 18.000 28.760 52.020 1.00 0.00 ATOM 6206 H18S POP 50 18.560 30.360 51.600 1.00 0.00 ATOM 6207 H18T POP 50 17.060 29.650 50.730 1.00 0.00 ATOM 6208 C33 POP 50 15.310 44.210 59.150 1.00 0.00 ATOM 6209 H3X POP 50 14.770 43.290 59.440 1.00 0.00 ATOM 6210 H3Y POP 50 15.730 44.710 60.050 1.00 0.00 ATOM 6211 C34 POP 50 16.510 43.810 58.300 1.00 0.00 ATOM 6212 H4X POP 50 17.110 43.030 58.830 1.00 0.00 ATOM 6213 H4Y POP 50 17.140 44.700 58.070 1.00 0.00 ATOM 6214 C35 POP 50 16.160 43.080 57.000 1.00 0.00 ATOM 6215 H5X POP 50 15.770 43.790 56.240 1.00 0.00 ATOM 6216 H5Y POP 50 15.390 42.320 57.260 1.00 0.00 ATOM 6217 C36 POP 50 17.250 42.330 56.230 1.00 0.00 ATOM 6218 H6X POP 50 17.480 41.330 56.660 1.00 0.00 ATOM 6219 H6Y POP 50 18.170 42.950 56.280 1.00 0.00 ATOM 6220 C37 POP 50 16.870 41.900 54.810 1.00 0.00 ATOM 6221 H7X POP 50 16.390 42.740 54.250 1.00 0.00 ATOM 6222 H7Y POP 50 16.090 41.110 54.800 1.00 0.00 ATOM 6223 C38 POP 50 18.000 41.500 53.860 1.00 0.00 ATOM 6224 H8X POP 50 18.550 40.630 54.270 1.00 0.00 ATOM 6225 H8Y POP 50 18.740 42.300 54.090 1.00 0.00 ATOM 6226 C39 POP 50 17.500 41.220 52.440 1.00 0.00 ATOM 6227 H9X POP 50 17.090 42.130 51.960 1.00 0.00 ATOM 6228 H9Y POP 50 16.650 40.520 52.540 1.00 0.00 ATOM 6229 0C31 POP 50 18.580 40.670 51.500 1.00 0.00 ATOM 6230 H10X POP 50 18.820 39.650 51.870 1.00 0.00 ATOM 6231 H10Y POP 50 19.490 41.310 51.550 1.00 0.00 ATOM 6232 1C31 POP 50 18.080 40.490 50.070 1.00 0.00 ATOM 6233 H11X POP 50 17.800 41.510 49.760 1.00 0.00 ATOM 6234 H11Y POP 50 17.190 39.850 50.240 1.00 0.00 ATOM 6235 2C31 POP 50 18.850 39.730 48.990 1.00 0.00 ATOM 6236 H12X POP 50 19.050 38.700 49.370 1.00 0.00 ATOM 6237 H12Y POP 50 19.770 40.300 48.770 1.00 0.00 ATOM 6238 3C31 POP 50 18.160 39.630 47.620 1.00 0.00 ATOM 6239 H13X POP 50 18.430 40.540 47.040 1.00 0.00 ATOM 6240 H13Y POP 50 17.060 39.620 47.780 1.00 0.00 ATOM 6241 4C31 POP 50 18.620 38.370 46.880 1.00 0.00 ATOM 6242 H14X POP 50 18.430 37.460 47.480 1.00 0.00 ATOM 6243 H14Y POP 50 19.730 38.410 46.840 1.00 0.00 ATOM 6244 5C31 POP 50 18.160 38.250 45.430 1.00 0.00 ATOM 6245 H15X POP 50 18.670 39.100 44.920 1.00 0.00 ATOM 6246 H15Y POP 50 17.050 38.340 45.530 1.00 0.00 ATOM 6247 6C31 POP 50 18.510 36.980 44.660 1.00 0.00 ATOM 6248 H16X POP 50 18.520 36.050 45.270 1.00 0.00 ATOM 6249 H16Y POP 50 19.590 37.080 44.450 1.00 0.00 ATOM 6250 H16Z POP 50 17.960 36.830 43.710 1.00 0.00 ATOM 6251 N POP 51 15.040 44.960 67.980 1.00 0.00 ATOM 6252 HN1 POP 51 16.050 44.940 68.200 1.00 0.00 ATOM 6253 HN2 POP 51 14.540 44.860 68.880 1.00 0.00 ATOM 6254 HN3 POP 51 14.840 44.240 67.250 1.00 0.00 ATOM 6255 C12 POP 51 15.110 46.320 67.320 1.00 0.00 ATOM 6256 H12A POP 51 15.530 46.910 68.170 1.00 0.00 ATOM 6257 H12B POP 51 14.130 46.760 67.060 1.00 0.00 ATOM 6258 C11 POP 51 16.060 46.480 66.130 1.00 0.00 ATOM 6259 H11A POP 51 16.190 47.490 65.680 1.00 0.00 ATOM 6260 H11B POP 51 15.860 45.780 65.300 1.00 0.00 ATOM 6261 P POP 51 18.420 45.840 65.420 1.00 0.00 ATOM 6262 O13 POP 51 19.330 44.770 65.860 1.00 0.00 ATOM 6263 O14 POP 51 18.920 47.220 65.180 1.00 0.00 ATOM 6264 O11 POP 51 17.680 45.390 64.080 1.00 0.00 ATOM 6265 O12 POP 51 17.350 46.060 66.590 1.00 0.00 ATOM 6266 C1 POP 51 17.400 44.030 63.730 1.00 0.00 ATOM 6267 HA POP 51 16.560 44.120 63.000 1.00 0.00 ATOM 6268 HB POP 51 16.970 43.450 64.570 1.00 0.00 ATOM 6269 C2 POP 51 18.600 43.330 63.070 1.00 0.00 ATOM 6270 HS POP 51 19.490 43.370 63.720 1.00 0.00 ATOM 6271 O21 POP 51 18.820 44.020 61.830 1.00 0.00 ATOM 6272 C21 POP 51 20.040 43.770 61.360 1.00 0.00 ATOM 6273 O22 POP 51 20.900 43.040 61.830 1.00 0.00 ATOM 6274 C22 POP 51 20.250 44.630 60.120 1.00 0.00 ATOM 6275 H2R POP 51 20.840 45.510 60.470 1.00 0.00 ATOM 6276 H2S POP 51 19.260 44.810 59.660 1.00 0.00 ATOM 6277 C3 POP 51 18.380 41.840 62.780 1.00 0.00 ATOM 6278 HX POP 51 18.120 41.460 63.800 1.00 0.00 ATOM 6279 HY POP 51 19.340 41.380 62.450 1.00 0.00 ATOM 6280 O31 POP 51 17.290 41.700 61.870 1.00 0.00 ATOM 6281 C31 POP 51 16.520 40.650 62.150 1.00 0.00 ATOM 6282 O32 POP 51 16.800 39.770 62.940 1.00 0.00 ATOM 6283 C32 POP 51 15.220 40.750 61.360 1.00 0.00 ATOM 6284 H2X POP 51 14.750 41.750 61.350 1.00 0.00 ATOM 6285 H2Y POP 51 14.470 40.110 61.870 1.00 0.00 ATOM 6286 C23 POP 51 21.010 43.840 59.050 1.00 0.00 ATOM 6287 H3R POP 51 20.600 42.810 58.970 1.00 0.00 ATOM 6288 H3S POP 51 22.030 43.680 59.450 1.00 0.00 ATOM 6289 C24 POP 51 21.050 44.390 57.630 1.00 0.00 ATOM 6290 H4R POP 51 21.330 45.460 57.720 1.00 0.00 ATOM 6291 H4S POP 51 19.990 44.340 57.290 1.00 0.00 ATOM 6292 C25 POP 51 21.930 43.670 56.610 1.00 0.00 ATOM 6293 H5R POP 51 21.360 43.650 55.650 1.00 0.00 ATOM 6294 H5S POP 51 22.170 42.670 57.030 1.00 0.00 ATOM 6295 C26 POP 51 23.220 44.470 56.400 1.00 0.00 ATOM 6296 H6R POP 51 23.750 44.610 57.370 1.00 0.00 ATOM 6297 H6S POP 51 23.030 45.490 56.000 1.00 0.00 ATOM 6298 C27 POP 51 24.200 43.890 55.380 1.00 0.00 ATOM 6299 H7R POP 51 24.610 42.940 55.790 1.00 0.00 ATOM 6300 H7S POP 51 25.120 44.510 55.310 1.00 0.00 ATOM 6301 C28 POP 51 23.690 43.950 53.940 1.00 0.00 ATOM 6302 H8R POP 51 23.470 45.010 53.700 1.00 0.00 ATOM 6303 H8S POP 51 22.680 43.510 53.870 1.00 0.00 ATOM 6304 C29 POP 51 24.750 43.240 53.140 1.00 0.00 ATOM 6305 H91 POP 51 24.630 42.150 52.980 1.00 0.00 ATOM 6306 0C21 POP 51 25.780 43.820 52.520 1.00 0.00 ATOM 6307 1H10 POP 51 26.540 43.130 52.120 1.00 0.00 ATOM 6308 1C21 POP 51 26.270 45.240 52.480 1.00 0.00 ATOM 6309 H11R POP 51 27.350 45.100 52.660 1.00 0.00 ATOM 6310 H11S POP 51 25.850 45.820 53.330 1.00 0.00 ATOM 6311 2C21 POP 51 25.920 45.890 51.140 1.00 0.00 ATOM 6312 H12R POP 51 24.810 45.850 51.140 1.00 0.00 ATOM 6313 H12S POP 51 26.290 45.240 50.320 1.00 0.00 ATOM 6314 3C21 POP 51 26.200 47.390 50.980 1.00 0.00 ATOM 6315 H13R POP 51 27.280 47.590 51.150 1.00 0.00 ATOM 6316 H13S POP 51 25.560 47.980 51.660 1.00 0.00 ATOM 6317 4C21 POP 51 26.080 47.900 49.540 1.00 0.00 ATOM 6318 H14R POP 51 26.900 47.600 48.850 1.00 0.00 ATOM 6319 H14S POP 51 26.250 49.000 49.590 1.00 0.00 ATOM 6320 5C21 POP 51 24.770 47.530 48.850 1.00 0.00 ATOM 6321 H15R POP 51 23.850 48.090 49.150 1.00 0.00 ATOM 6322 H15S POP 51 24.580 46.460 49.040 1.00 0.00 ATOM 6323 6C21 POP 51 24.970 47.740 47.350 1.00 0.00 ATOM 6324 H16R POP 51 25.930 47.280 47.020 1.00 0.00 ATOM 6325 H16S POP 51 25.020 48.850 47.260 1.00 0.00 ATOM 6326 7C21 POP 51 23.840 47.250 46.440 1.00 0.00 ATOM 6327 H17R POP 51 23.690 46.150 46.540 1.00 0.00 ATOM 6328 H17S POP 51 24.280 47.340 45.430 1.00 0.00 ATOM 6329 8C21 POP 51 22.550 48.020 46.720 1.00 0.00 ATOM 6330 H18R POP 51 21.840 47.590 45.980 1.00 0.00 ATOM 6331 H18S POP 51 22.660 49.120 46.600 1.00 0.00 ATOM 6332 H18T POP 51 22.100 47.820 47.720 1.00 0.00 ATOM 6333 C33 POP 51 15.450 40.270 59.930 1.00 0.00 ATOM 6334 H3X POP 51 16.060 39.340 59.890 1.00 0.00 ATOM 6335 H3Y POP 51 16.100 40.920 59.310 1.00 0.00 ATOM 6336 C34 POP 51 14.120 40.180 59.170 1.00 0.00 ATOM 6337 H4X POP 51 13.670 41.100 58.760 1.00 0.00 ATOM 6338 H4Y POP 51 13.460 39.840 59.990 1.00 0.00 ATOM 6339 C35 POP 51 13.990 38.990 58.210 1.00 0.00 ATOM 6340 H5X POP 51 12.910 38.780 58.090 1.00 0.00 ATOM 6341 H5Y POP 51 14.240 38.110 58.830 1.00 0.00 ATOM 6342 C36 POP 51 14.790 39.080 56.910 1.00 0.00 ATOM 6343 H6X POP 51 15.860 39.200 57.180 1.00 0.00 ATOM 6344 H6Y POP 51 14.530 39.940 56.270 1.00 0.00 ATOM 6345 C37 POP 51 14.620 37.880 55.970 1.00 0.00 ATOM 6346 H7X POP 51 13.630 37.870 55.460 1.00 0.00 ATOM 6347 H7Y POP 51 14.730 36.940 56.570 1.00 0.00 ATOM 6348 C38 POP 51 15.520 37.960 54.740 1.00 0.00 ATOM 6349 H8X POP 51 15.550 39.010 54.380 1.00 0.00 ATOM 6350 H8Y POP 51 14.990 37.400 53.940 1.00 0.00 ATOM 6351 C39 POP 51 16.870 37.260 54.910 1.00 0.00 ATOM 6352 H9X POP 51 16.690 36.230 55.270 1.00 0.00 ATOM 6353 H9Y POP 51 17.570 37.690 55.660 1.00 0.00 ATOM 6354 0C31 POP 51 17.620 37.180 53.580 1.00 0.00 ATOM 6355 H10X POP 51 18.450 36.450 53.740 1.00 0.00 ATOM 6356 H10Y POP 51 17.920 38.240 53.410 1.00 0.00 ATOM 6357 1C31 POP 51 16.860 36.580 52.400 1.00 0.00 ATOM 6358 H11X POP 51 16.260 37.320 51.820 1.00 0.00 ATOM 6359 H11Y POP 51 16.140 35.760 52.630 1.00 0.00 ATOM 6360 2C31 POP 51 17.710 35.880 51.340 1.00 0.00 ATOM 6361 H12X POP 51 18.670 35.490 51.760 1.00 0.00 ATOM 6362 H12Y POP 51 18.080 36.540 50.530 1.00 0.00 ATOM 6363 3C31 POP 51 17.020 34.710 50.630 1.00 0.00 ATOM 6364 H13X POP 51 16.110 35.120 50.150 1.00 0.00 ATOM 6365 H13Y POP 51 16.660 33.870 51.260 1.00 0.00 ATOM 6366 4C31 POP 51 17.940 33.940 49.690 1.00 0.00 ATOM 6367 H14X POP 51 18.620 33.350 50.330 1.00 0.00 ATOM 6368 H14Y POP 51 18.650 34.550 49.090 1.00 0.00 ATOM 6369 5C31 POP 51 17.130 32.970 48.830 1.00 0.00 ATOM 6370 H15X POP 51 16.570 33.540 48.060 1.00 0.00 ATOM 6371 H15Y POP 51 16.430 32.370 49.450 1.00 0.00 ATOM 6372 6C31 POP 51 18.050 31.950 48.140 1.00 0.00 ATOM 6373 H16X POP 51 18.910 32.380 47.580 1.00 0.00 ATOM 6374 H16Y POP 51 17.470 31.440 47.340 1.00 0.00 ATOM 6375 H16Z POP 51 18.320 31.170 48.880 1.00 0.00 ATOM 6376 N POP 52 9.580 19.120 64.880 1.00 0.00 ATOM 6377 HN1 POP 52 8.710 19.660 65.020 1.00 0.00 ATOM 6378 HN2 POP 52 10.410 19.690 64.610 1.00 0.00 ATOM 6379 HN3 POP 52 9.470 18.500 64.050 1.00 0.00 ATOM 6380 C12 POP 52 9.940 18.230 66.040 1.00 0.00 ATOM 6381 H12A POP 52 9.080 18.100 66.740 1.00 0.00 ATOM 6382 H12B POP 52 10.740 18.810 66.550 1.00 0.00 ATOM 6383 C11 POP 52 10.760 17.000 65.640 1.00 0.00 ATOM 6384 H11A POP 52 10.120 16.130 65.400 1.00 0.00 ATOM 6385 H11B POP 52 11.290 16.810 66.600 1.00 0.00 ATOM 6386 P POP 52 12.570 16.100 64.190 1.00 0.00 ATOM 6387 O13 POP 52 13.750 16.170 65.080 1.00 0.00 ATOM 6388 O14 POP 52 11.780 14.840 64.240 1.00 0.00 ATOM 6389 O11 POP 52 12.920 16.420 62.660 1.00 0.00 ATOM 6390 O12 POP 52 11.670 17.350 64.590 1.00 0.00 ATOM 6391 C1 POP 52 13.690 17.550 62.230 1.00 0.00 ATOM 6392 HA POP 52 14.490 17.220 61.540 1.00 0.00 ATOM 6393 HB POP 52 14.200 18.020 63.100 1.00 0.00 ATOM 6394 C2 POP 52 12.870 18.650 61.530 1.00 0.00 ATOM 6395 HS POP 52 11.950 18.680 62.160 1.00 0.00 ATOM 6396 O21 POP 52 12.590 18.140 60.220 1.00 0.00 ATOM 6397 C21 POP 52 11.580 18.820 59.670 1.00 0.00 ATOM 6398 O22 POP 52 10.870 19.630 60.240 1.00 0.00 ATOM 6399 C22 POP 52 11.570 18.370 58.210 1.00 0.00 ATOM 6400 H2R POP 52 11.450 17.270 58.310 1.00 0.00 ATOM 6401 H2S POP 52 12.610 18.580 57.880 1.00 0.00 ATOM 6402 C3 POP 52 13.560 20.020 61.450 1.00 0.00 ATOM 6403 HX POP 52 14.200 20.190 62.340 1.00 0.00 ATOM 6404 HY POP 52 12.810 20.830 61.390 1.00 0.00 ATOM 6405 O31 POP 52 14.330 19.990 60.250 1.00 0.00 ATOM 6406 C31 POP 52 15.570 19.550 60.440 1.00 0.00 ATOM 6407 O32 POP 52 16.080 19.290 61.520 1.00 0.00 ATOM 6408 C32 POP 52 16.350 19.570 59.140 1.00 0.00 ATOM 6409 H2X POP 52 16.820 18.580 58.970 1.00 0.00 ATOM 6410 H2Y POP 52 17.090 20.370 59.360 1.00 0.00 ATOM 6411 C23 POP 52 10.400 18.960 57.420 1.00 0.00 ATOM 6412 H3R POP 52 10.480 20.070 57.430 1.00 0.00 ATOM 6413 H3S POP 52 9.420 18.650 57.830 1.00 0.00 ATOM 6414 C24 POP 52 10.480 18.580 55.940 1.00 0.00 ATOM 6415 H4R POP 52 10.530 17.480 56.090 1.00 0.00 ATOM 6416 H4S POP 52 11.430 18.930 55.480 1.00 0.00 ATOM 6417 C25 POP 52 9.190 18.840 55.170 1.00 0.00 ATOM 6418 H5R POP 52 8.900 19.900 54.970 1.00 0.00 ATOM 6419 H5S POP 52 8.350 18.360 55.720 1.00 0.00 ATOM 6420 C26 POP 52 9.200 18.220 53.770 1.00 0.00 ATOM 6421 H6R POP 52 8.180 18.460 53.400 1.00 0.00 ATOM 6422 H6S POP 52 9.410 17.130 53.830 1.00 0.00 ATOM 6423 C27 POP 52 10.230 18.800 52.800 1.00 0.00 ATOM 6424 H7R POP 52 11.250 18.690 53.230 1.00 0.00 ATOM 6425 H7S POP 52 10.020 19.870 52.610 1.00 0.00 ATOM 6426 C28 POP 52 10.330 18.050 51.470 1.00 0.00 ATOM 6427 H8R POP 52 9.270 17.820 51.250 1.00 0.00 ATOM 6428 H8S POP 52 10.870 17.080 51.530 1.00 0.00 ATOM 6429 C29 POP 52 11.030 18.910 50.460 1.00 0.00 ATOM 6430 H91 POP 52 11.590 19.790 50.800 1.00 0.00 ATOM 6431 0C21 POP 52 11.230 18.560 49.180 1.00 0.00 ATOM 6432 1H10 POP 52 11.710 19.320 48.530 1.00 0.00 ATOM 6433 1C21 POP 52 10.840 17.230 48.610 1.00 0.00 ATOM 6434 H11R POP 52 10.860 16.460 49.410 1.00 0.00 ATOM 6435 H11S POP 52 11.530 16.970 47.770 1.00 0.00 ATOM 6436 2C21 POP 52 9.400 17.240 48.080 1.00 0.00 ATOM 6437 H12R POP 52 9.290 18.110 47.400 1.00 0.00 ATOM 6438 H12S POP 52 8.740 17.540 48.920 1.00 0.00 ATOM 6439 3C21 POP 52 8.830 16.010 47.380 1.00 0.00 ATOM 6440 H13R POP 52 7.740 16.190 47.270 1.00 0.00 ATOM 6441 H13S POP 52 8.950 15.170 48.110 1.00 0.00 ATOM 6442 4C21 POP 52 9.510 15.790 46.030 1.00 0.00 ATOM 6443 H14R POP 52 10.550 15.410 46.010 1.00 0.00 ATOM 6444 H14S POP 52 9.500 16.750 45.460 1.00 0.00 ATOM 6445 5C21 POP 52 8.790 14.800 45.120 1.00 0.00 ATOM 6446 H15R POP 52 7.740 15.150 45.030 1.00 0.00 ATOM 6447 H15S POP 52 8.820 13.770 45.550 1.00 0.00 ATOM 6448 6C21 POP 52 9.660 14.750 43.860 1.00 0.00 ATOM 6449 H16R POP 52 10.480 14.000 43.880 1.00 0.00 ATOM 6450 H16S POP 52 10.150 15.730 43.720 1.00 0.00 ATOM 6451 7C21 POP 52 8.810 14.420 42.630 1.00 0.00 ATOM 6452 H17R POP 52 9.500 14.490 41.760 1.00 0.00 ATOM 6453 H17S POP 52 8.050 15.210 42.450 1.00 0.00 ATOM 6454 8C21 POP 52 8.030 13.110 42.550 1.00 0.00 ATOM 6455 H18R POP 52 7.410 12.900 43.450 1.00 0.00 ATOM 6456 H18S POP 52 8.720 12.250 42.400 1.00 0.00 ATOM 6457 H18T POP 52 7.350 13.200 41.680 1.00 0.00 ATOM 6458 C33 POP 52 15.520 19.900 57.900 1.00 0.00 ATOM 6459 H3X POP 52 15.060 20.900 58.060 1.00 0.00 ATOM 6460 H3Y POP 52 14.760 19.100 57.710 1.00 0.00 ATOM 6461 C34 POP 52 16.480 20.090 56.720 1.00 0.00 ATOM 6462 H4X POP 52 17.030 19.120 56.670 1.00 0.00 ATOM 6463 H4Y POP 52 17.170 20.930 56.920 1.00 0.00 ATOM 6464 C35 POP 52 15.810 20.560 55.430 1.00 0.00 ATOM 6465 H5X POP 52 15.180 21.470 55.460 1.00 0.00 ATOM 6466 H5Y POP 52 15.170 19.730 55.070 1.00 0.00 ATOM 6467 C36 POP 52 16.720 20.730 54.210 1.00 0.00 ATOM 6468 H6X POP 52 17.140 19.740 53.900 1.00 0.00 ATOM 6469 H6Y POP 52 17.610 21.380 54.370 1.00 0.00 ATOM 6470 C37 POP 52 15.960 21.290 53.010 1.00 0.00 ATOM 6471 H7X POP 52 15.500 22.170 53.520 1.00 0.00 ATOM 6472 H7Y POP 52 15.170 20.570 52.720 1.00 0.00 ATOM 6473 C38 POP 52 16.890 21.670 51.860 1.00 0.00 ATOM 6474 H8X POP 52 17.660 20.860 51.860 1.00 0.00 ATOM 6475 H8Y POP 52 17.400 22.600 52.190 1.00 0.00 ATOM 6476 C39 POP 52 16.130 21.950 50.570 1.00 0.00 ATOM 6477 H9X POP 52 15.520 21.080 50.240 1.00 0.00 ATOM 6478 H9Y POP 52 15.340 22.730 50.590 1.00 0.00 ATOM 6479 0C31 POP 52 16.990 22.430 49.400 1.00 0.00 ATOM 6480 H10X POP 52 17.760 21.720 49.020 1.00 0.00 ATOM 6481 H10Y POP 52 17.620 23.300 49.680 1.00 0.00 ATOM 6482 1C31 POP 52 16.190 23.100 48.280 1.00 0.00 ATOM 6483 H11X POP 52 15.490 23.880 48.650 1.00 0.00 ATOM 6484 H11Y POP 52 15.430 22.310 48.070 1.00 0.00 ATOM 6485 2C31 POP 52 16.960 23.610 47.070 1.00 0.00 ATOM 6486 H12X POP 52 17.520 22.770 46.610 1.00 0.00 ATOM 6487 H12Y POP 52 17.660 24.430 47.350 1.00 0.00 ATOM 6488 3C31 POP 52 16.060 24.230 46.000 1.00 0.00 ATOM 6489 H13X POP 52 15.450 23.400 45.570 1.00 0.00 ATOM 6490 H13Y POP 52 16.830 24.650 45.320 1.00 0.00 ATOM 6491 4C31 POP 52 15.160 25.370 46.500 1.00 0.00 ATOM 6492 H14X POP 52 15.960 26.130 46.630 1.00 0.00 ATOM 6493 H14Y POP 52 14.600 25.160 47.440 1.00 0.00 ATOM 6494 5C31 POP 52 14.190 25.810 45.410 1.00 0.00 ATOM 6495 H15X POP 52 14.550 25.700 44.360 1.00 0.00 ATOM 6496 H15Y POP 52 14.170 26.900 45.600 1.00 0.00 ATOM 6497 6C31 POP 52 12.760 25.260 45.470 1.00 0.00 ATOM 6498 H16X POP 52 12.360 25.540 46.470 1.00 0.00 ATOM 6499 H16Y POP 52 12.710 24.160 45.310 1.00 0.00 ATOM 6500 H16Z POP 52 11.970 25.800 44.910 1.00 0.00 ATOM 6501 N POP 53 16.520 19.570 66.450 1.00 0.00 ATOM 6502 HN1 POP 53 16.810 20.480 66.850 1.00 0.00 ATOM 6503 HN2 POP 53 16.980 19.530 65.520 1.00 0.00 ATOM 6504 HN3 POP 53 15.500 19.400 66.310 1.00 0.00 ATOM 6505 C12 POP 53 16.870 18.440 67.390 1.00 0.00 ATOM 6506 H12A POP 53 16.730 17.490 66.820 1.00 0.00 ATOM 6507 H12B POP 53 16.160 18.400 68.240 1.00 0.00 ATOM 6508 C11 POP 53 18.280 18.560 67.960 1.00 0.00 ATOM 6509 H11A POP 53 18.560 17.580 68.420 1.00 0.00 ATOM 6510 H11B POP 53 18.170 19.380 68.710 1.00 0.00 ATOM 6511 P POP 53 20.630 18.790 67.300 1.00 0.00 ATOM 6512 O13 POP 53 20.920 17.340 67.220 1.00 0.00 ATOM 6513 O14 POP 53 21.060 19.460 68.540 1.00 0.00 ATOM 6514 O11 POP 53 21.460 19.550 66.170 1.00 0.00 ATOM 6515 O12 POP 53 19.100 19.070 66.910 1.00 0.00 ATOM 6516 C1 POP 53 20.880 20.690 65.530 1.00 0.00 ATOM 6517 HA POP 53 21.660 21.450 65.310 1.00 0.00 ATOM 6518 HB POP 53 20.100 21.210 66.120 1.00 0.00 ATOM 6519 C2 POP 53 20.060 20.260 64.300 1.00 0.00 ATOM 6520 HS POP 53 19.380 19.460 64.650 1.00 0.00 ATOM 6521 O21 POP 53 20.920 19.660 63.330 1.00 0.00 ATOM 6522 C21 POP 53 20.350 18.760 62.510 1.00 0.00 ATOM 6523 O22 POP 53 19.280 18.200 62.660 1.00 0.00 ATOM 6524 C22 POP 53 21.160 18.680 61.220 1.00 0.00 ATOM 6525 H2R POP 53 21.860 17.820 61.300 1.00 0.00 ATOM 6526 H2S POP 53 21.710 19.630 61.050 1.00 0.00 ATOM 6527 C3 POP 53 19.240 21.430 63.740 1.00 0.00 ATOM 6528 HX POP 53 18.770 21.890 64.630 1.00 0.00 ATOM 6529 HY POP 53 18.370 21.160 63.100 1.00 0.00 ATOM 6530 O31 POP 53 20.120 22.420 63.210 1.00 0.00 ATOM 6531 C31 POP 53 20.040 22.480 61.880 1.00 0.00 ATOM 6532 O32 POP 53 19.250 21.860 61.190 1.00 0.00 ATOM 6533 C32 POP 53 21.160 23.300 61.260 1.00 0.00 ATOM 6534 H2X POP 53 22.120 23.440 61.810 1.00 0.00 ATOM 6535 H2Y POP 53 20.660 24.280 61.180 1.00 0.00 ATOM 6536 C23 POP 53 20.220 18.430 60.040 1.00 0.00 ATOM 6537 H3R POP 53 19.350 19.120 60.030 1.00 0.00 ATOM 6538 H3S POP 53 19.890 17.360 60.080 1.00 0.00 ATOM 6539 C24 POP 53 20.740 18.590 58.610 1.00 0.00 ATOM 6540 H4R POP 53 21.630 17.960 58.420 1.00 0.00 ATOM 6541 H4S POP 53 21.000 19.650 58.440 1.00 0.00 ATOM 6542 C25 POP 53 19.750 18.060 57.560 1.00 0.00 ATOM 6543 H5R POP 53 18.860 18.720 57.560 1.00 0.00 ATOM 6544 H5S POP 53 19.430 17.050 57.870 1.00 0.00 ATOM 6545 C26 POP 53 20.360 17.960 56.160 1.00 0.00 ATOM 6546 H6R POP 53 19.590 17.670 55.410 1.00 0.00 ATOM 6547 H6S POP 53 21.140 17.190 56.260 1.00 0.00 ATOM 6548 C27 POP 53 21.000 19.220 55.570 1.00 0.00 ATOM 6549 H7R POP 53 21.650 19.540 56.410 1.00 0.00 ATOM 6550 H7S POP 53 20.340 20.080 55.350 1.00 0.00 ATOM 6551 C28 POP 53 21.980 19.010 54.410 1.00 0.00 ATOM 6552 H8R POP 53 22.720 18.350 54.910 1.00 0.00 ATOM 6553 H8S POP 53 22.450 20.000 54.210 1.00 0.00 ATOM 6554 C29 POP 53 21.380 18.490 53.140 1.00 0.00 ATOM 6555 H91 POP 53 20.600 17.720 53.070 1.00 0.00 ATOM 6556 0C21 POP 53 21.760 18.750 51.880 1.00 0.00 ATOM 6557 1H10 POP 53 21.390 18.200 51.000 1.00 0.00 ATOM 6558 1C21 POP 53 22.860 19.660 51.410 1.00 0.00 ATOM 6559 H11R POP 53 23.150 19.360 50.380 1.00 0.00 ATOM 6560 H11S POP 53 23.780 19.520 52.010 1.00 0.00 ATOM 6561 2C21 POP 53 22.480 21.140 51.340 1.00 0.00 ATOM 6562 H12R POP 53 22.050 21.470 52.310 1.00 0.00 ATOM 6563 H12S POP 53 21.650 21.160 50.610 1.00 0.00 ATOM 6564 3C21 POP 53 23.590 22.080 50.860 1.00 0.00 ATOM 6565 H13R POP 53 24.180 21.590 50.060 1.00 0.00 ATOM 6566 H13S POP 53 24.250 22.310 51.720 1.00 0.00 ATOM 6567 4C21 POP 53 23.050 23.420 50.360 1.00 0.00 ATOM 6568 H14R POP 53 22.510 23.950 51.170 1.00 0.00 ATOM 6569 H14S POP 53 22.220 23.340 49.620 1.00 0.00 ATOM 6570 5C21 POP 53 24.150 24.230 49.680 1.00 0.00 ATOM 6571 H15R POP 53 24.560 23.570 48.890 1.00 0.00 ATOM 6572 H15S POP 53 24.890 24.450 50.480 1.00 0.00 ATOM 6573 6C21 POP 53 23.670 25.590 49.170 1.00 0.00 ATOM 6574 H16R POP 53 24.530 26.290 49.160 1.00 0.00 ATOM 6575 H16S POP 53 22.940 25.900 49.950 1.00 0.00 ATOM 6576 7C21 POP 53 22.920 25.580 47.830 1.00 0.00 ATOM 6577 H17R POP 53 22.520 26.580 47.560 1.00 0.00 ATOM 6578 H17S POP 53 21.990 25.000 48.050 1.00 0.00 ATOM 6579 8C21 POP 53 23.610 24.990 46.600 1.00 0.00 ATOM 6580 H18R POP 53 23.960 23.940 46.730 1.00 0.00 ATOM 6581 H18S POP 53 24.450 25.650 46.310 1.00 0.00 ATOM 6582 H18T POP 53 22.970 24.980 45.690 1.00 0.00 ATOM 6583 C33 POP 53 21.410 22.900 59.800 1.00 0.00 ATOM 6584 H3X POP 53 21.490 21.810 59.630 1.00 0.00 ATOM 6585 H3Y POP 53 22.440 23.210 59.530 1.00 0.00 ATOM 6586 C34 POP 53 20.350 23.370 58.800 1.00 0.00 ATOM 6587 H4X POP 53 20.230 24.430 59.100 1.00 0.00 ATOM 6588 H4Y POP 53 19.330 22.930 58.890 1.00 0.00 ATOM 6589 C35 POP 53 20.810 23.140 57.360 1.00 0.00 ATOM 6590 H5X POP 53 21.050 22.100 57.050 1.00 0.00 ATOM 6591 H5Y POP 53 21.820 23.590 57.290 1.00 0.00 ATOM 6592 C36 POP 53 19.850 23.680 56.290 1.00 0.00 ATOM 6593 H6X POP 53 19.630 24.740 56.520 1.00 0.00 ATOM 6594 H6Y POP 53 18.900 23.110 56.390 1.00 0.00 ATOM 6595 C37 POP 53 20.460 23.610 54.890 1.00 0.00 ATOM 6596 H7X POP 53 20.690 22.550 54.660 1.00 0.00 ATOM 6597 H7Y POP 53 21.340 24.290 54.800 1.00 0.00 ATOM 6598 C38 POP 53 19.360 24.160 53.970 1.00 0.00 ATOM 6599 H8X POP 53 19.040 25.150 54.350 1.00 0.00 ATOM 6600 H8Y POP 53 18.450 23.530 54.080 1.00 0.00 ATOM 6601 C39 POP 53 19.860 24.240 52.530 1.00 0.00 ATOM 6602 H9X POP 53 19.980 23.250 52.030 1.00 0.00 ATOM 6603 H9Y POP 53 20.910 24.590 52.540 1.00 0.00 ATOM 6604 0C31 POP 53 18.970 25.210 51.750 1.00 0.00 ATOM 6605 H10X POP 53 18.780 26.170 52.270 1.00 0.00 ATOM 6606 H10Y POP 53 18.020 24.690 51.480 1.00 0.00 ATOM 6607 1C31 POP 53 19.610 25.630 50.420 1.00 0.00 ATOM 6608 H11X POP 53 19.800 24.710 49.830 1.00 0.00 ATOM 6609 H11Y POP 53 20.540 26.210 50.610 1.00 0.00 ATOM 6610 2C31 POP 53 18.680 26.560 49.640 1.00 0.00 ATOM 6611 H12X POP 53 18.460 27.410 50.310 1.00 0.00 ATOM 6612 H12Y POP 53 17.700 26.090 49.430 1.00 0.00 ATOM 6613 3C31 POP 53 19.400 27.130 48.420 1.00 0.00 ATOM 6614 H13X POP 53 19.730 26.230 47.860 1.00 0.00 ATOM 6615 H13Y POP 53 20.330 27.570 48.840 1.00 0.00 ATOM 6616 4C31 POP 53 18.620 28.110 47.550 1.00 0.00 ATOM 6617 H14X POP 53 18.220 28.960 48.140 1.00 0.00 ATOM 6618 H14Y POP 53 17.700 27.620 47.170 1.00 0.00 ATOM 6619 5C31 POP 53 19.330 28.630 46.300 1.00 0.00 ATOM 6620 H15X POP 53 19.680 27.650 45.920 1.00 0.00 ATOM 6621 H15Y POP 53 20.210 29.240 46.590 1.00 0.00 ATOM 6622 6C31 POP 53 18.420 29.400 45.330 1.00 0.00 ATOM 6623 H16X POP 53 17.610 28.760 44.920 1.00 0.00 ATOM 6624 H16Y POP 53 19.000 29.880 44.520 1.00 0.00 ATOM 6625 H16Z POP 53 17.980 30.250 45.900 1.00 0.00 ATOM 6626 N POP 54 13.410 4.810 67.200 1.00 0.00 ATOM 6627 HN1 POP 54 13.020 4.090 66.560 1.00 0.00 ATOM 6628 HN2 POP 54 12.910 4.600 68.080 1.00 0.00 ATOM 6629 HN3 POP 54 14.430 4.620 67.300 1.00 0.00 ATOM 6630 C12 POP 54 13.020 6.230 66.880 1.00 0.00 ATOM 6631 H12A POP 54 13.630 6.890 67.540 1.00 0.00 ATOM 6632 H12B POP 54 11.970 6.380 67.210 1.00 0.00 ATOM 6633 C11 POP 54 13.350 6.550 65.420 1.00 0.00 ATOM 6634 H11A POP 54 14.450 6.590 65.260 1.00 0.00 ATOM 6635 H11B POP 54 12.940 7.560 65.190 1.00 0.00 ATOM 6636 P POP 54 12.450 5.820 63.140 1.00 0.00 ATOM 6637 O13 POP 54 13.550 6.510 62.430 1.00 0.00 ATOM 6638 O14 POP 54 11.140 6.480 63.030 1.00 0.00 ATOM 6639 O11 POP 54 12.350 4.360 62.490 1.00 0.00 ATOM 6640 O12 POP 54 12.840 5.470 64.650 1.00 0.00 ATOM 6641 C1 POP 54 11.100 3.860 62.030 1.00 0.00 ATOM 6642 HA POP 54 10.260 4.150 62.690 1.00 0.00 ATOM 6643 HB POP 54 11.140 2.750 61.950 1.00 0.00 ATOM 6644 C2 POP 54 10.740 4.140 60.560 1.00 0.00 ATOM 6645 HS POP 54 10.590 3.180 60.020 1.00 0.00 ATOM 6646 O21 POP 54 11.760 4.870 59.870 1.00 0.00 ATOM 6647 C21 POP 54 12.740 4.120 59.370 1.00 0.00 ATOM 6648 O22 POP 54 12.770 2.900 59.430 1.00 0.00 ATOM 6649 C22 POP 54 13.840 5.010 58.820 1.00 0.00 ATOM 6650 H2R POP 54 14.700 4.340 58.590 1.00 0.00 ATOM 6651 H2S POP 54 14.210 5.700 59.610 1.00 0.00 ATOM 6652 C3 POP 54 9.400 4.890 60.570 1.00 0.00 ATOM 6653 HX POP 54 9.430 5.790 61.220 1.00 0.00 ATOM 6654 HY POP 54 8.600 4.300 61.070 1.00 0.00 ATOM 6655 O31 POP 54 8.830 5.060 59.260 1.00 0.00 ATOM 6656 C31 POP 54 8.500 6.300 58.910 1.00 0.00 ATOM 6657 O32 POP 54 8.610 7.270 59.640 1.00 0.00 ATOM 6658 C32 POP 54 8.230 6.430 57.420 1.00 0.00 ATOM 6659 H2X POP 54 7.620 7.350 57.340 1.00 0.00 ATOM 6660 H2Y POP 54 7.590 5.610 57.030 1.00 0.00 ATOM 6661 C23 POP 54 13.360 5.720 57.550 1.00 0.00 ATOM 6662 H3R POP 54 13.290 6.800 57.780 1.00 0.00 ATOM 6663 H3S POP 54 12.330 5.390 57.290 1.00 0.00 ATOM 6664 C24 POP 54 14.250 5.410 56.350 1.00 0.00 ATOM 6665 H4R POP 54 14.210 4.370 55.950 1.00 0.00 ATOM 6666 H4S POP 54 15.310 5.490 56.680 1.00 0.00 ATOM 6667 C25 POP 54 14.050 6.320 55.140 1.00 0.00 ATOM 6668 H5R POP 54 13.800 7.300 55.590 1.00 0.00 ATOM 6669 H5S POP 54 13.180 6.080 54.490 1.00 0.00 ATOM 6670 C26 POP 54 15.260 6.640 54.250 1.00 0.00 ATOM 6671 H6R POP 54 15.990 7.130 54.930 1.00 0.00 ATOM 6672 H6S POP 54 15.050 7.240 53.340 1.00 0.00 ATOM 6673 C27 POP 54 15.910 5.370 53.680 1.00 0.00 ATOM 6674 H7R POP 54 15.160 4.630 53.340 1.00 0.00 ATOM 6675 H7S POP 54 16.480 4.790 54.440 1.00 0.00 ATOM 6676 C28 POP 54 17.020 5.540 52.640 1.00 0.00 ATOM 6677 H8R POP 54 17.950 5.870 53.140 1.00 0.00 ATOM 6678 H8S POP 54 16.730 6.270 51.850 1.00 0.00 ATOM 6679 C29 POP 54 17.370 4.200 52.080 1.00 0.00 ATOM 6680 H91 POP 54 16.640 3.700 51.420 1.00 0.00 ATOM 6681 0C21 POP 54 18.620 3.740 51.950 1.00 0.00 ATOM 6682 1H10 POP 54 18.790 2.780 51.430 1.00 0.00 ATOM 6683 1C21 POP 54 19.890 4.340 52.480 1.00 0.00 ATOM 6684 H11R POP 54 20.020 4.070 53.550 1.00 0.00 ATOM 6685 H11S POP 54 19.830 5.450 52.420 1.00 0.00 ATOM 6686 2C21 POP 54 21.070 3.820 51.670 1.00 0.00 ATOM 6687 H12R POP 54 20.770 4.110 50.640 1.00 0.00 ATOM 6688 H12S POP 54 21.120 2.730 51.890 1.00 0.00 ATOM 6689 3C21 POP 54 22.400 4.560 51.860 1.00 0.00 ATOM 6690 H13R POP 54 22.810 4.460 52.890 1.00 0.00 ATOM 6691 H13S POP 54 22.120 5.610 51.630 1.00 0.00 ATOM 6692 4C21 POP 54 23.440 4.100 50.840 1.00 0.00 ATOM 6693 H14R POP 54 23.060 3.850 49.820 1.00 0.00 ATOM 6694 H14S POP 54 23.840 3.220 51.380 1.00 0.00 ATOM 6695 5C21 POP 54 24.600 5.090 50.740 1.00 0.00 ATOM 6696 H15R POP 54 25.140 5.100 51.710 1.00 0.00 ATOM 6697 H15S POP 54 24.250 6.090 50.410 1.00 0.00 ATOM 6698 6C21 POP 54 25.580 4.660 49.650 1.00 0.00 ATOM 6699 H16R POP 54 24.980 4.460 48.740 1.00 0.00 ATOM 6700 H16S POP 54 25.990 3.670 49.940 1.00 0.00 ATOM 6701 7C21 POP 54 26.570 5.750 49.220 1.00 0.00 ATOM 6702 H17R POP 54 27.230 6.000 50.080 1.00 0.00 ATOM 6703 H17S POP 54 26.070 6.730 49.090 1.00 0.00 ATOM 6704 8C21 POP 54 27.480 5.410 48.040 1.00 0.00 ATOM 6705 H18R POP 54 28.140 4.590 48.370 1.00 0.00 ATOM 6706 H18S POP 54 28.010 6.360 47.810 1.00 0.00 ATOM 6707 H18T POP 54 26.980 5.050 47.120 1.00 0.00 ATOM 6708 C33 POP 54 9.560 6.430 56.650 1.00 0.00 ATOM 6709 H3X POP 54 10.050 5.440 56.690 1.00 0.00 ATOM 6710 H3Y POP 54 10.130 7.240 57.160 1.00 0.00 ATOM 6711 C34 POP 54 9.400 7.100 55.280 1.00 0.00 ATOM 6712 H4X POP 54 8.750 7.970 55.520 1.00 0.00 ATOM 6713 H4Y POP 54 8.920 6.400 54.570 1.00 0.00 ATOM 6714 C35 POP 54 10.730 7.550 54.660 1.00 0.00 ATOM 6715 H5X POP 54 11.350 6.700 54.330 1.00 0.00 ATOM 6716 H5Y POP 54 11.160 8.130 55.510 1.00 0.00 ATOM 6717 C36 POP 54 10.570 8.300 53.340 1.00 0.00 ATOM 6718 H6X POP 54 10.110 9.300 53.490 1.00 0.00 ATOM 6719 H6Y POP 54 9.850 7.590 52.890 1.00 0.00 ATOM 6720 C37 POP 54 11.910 8.500 52.630 1.00 0.00 ATOM 6721 H7X POP 54 12.390 7.500 52.670 1.00 0.00 ATOM 6722 H7Y POP 54 12.520 9.240 53.190 1.00 0.00 ATOM 6723 C38 POP 54 11.760 8.840 51.140 1.00 0.00 ATOM 6724 H8X POP 54 11.000 9.660 51.090 1.00 0.00 ATOM 6725 H8Y POP 54 11.250 7.910 50.830 1.00 0.00 ATOM 6726 C39 POP 54 13.010 9.080 50.300 1.00 0.00 ATOM 6727 H9X POP 54 13.820 8.330 50.460 1.00 0.00 ATOM 6728 H9Y POP 54 13.420 10.050 50.670 1.00 0.00 ATOM 6729 0C31 POP 54 12.730 9.410 48.840 1.00 0.00 ATOM 6730 H10X POP 54 11.890 10.140 48.850 1.00 0.00 ATOM 6731 H10Y POP 54 12.410 8.460 48.360 1.00 0.00 ATOM 6732 1C31 POP 54 13.910 9.980 48.050 1.00 0.00 ATOM 6733 H11X POP 54 14.370 10.720 48.740 1.00 0.00 ATOM 6734 H11Y POP 54 13.520 10.490 47.140 1.00 0.00 ATOM 6735 2C31 POP 54 14.830 8.880 47.510 1.00 0.00 ATOM 6736 H12X POP 54 15.140 8.220 48.350 1.00 0.00 ATOM 6737 H12Y POP 54 15.620 9.610 47.230 1.00 0.00 ATOM 6738 3C31 POP 54 14.170 8.150 46.340 1.00 0.00 ATOM 6739 H13X POP 54 13.880 8.880 45.550 1.00 0.00 ATOM 6740 H13Y POP 54 13.240 7.620 46.630 1.00 0.00 ATOM 6741 4C31 POP 54 15.040 7.060 45.700 1.00 0.00 ATOM 6742 H14X POP 54 14.540 6.550 44.850 1.00 0.00 ATOM 6743 H14Y POP 54 15.110 6.210 46.410 1.00 0.00 ATOM 6744 5C31 POP 54 16.410 7.540 45.250 1.00 0.00 ATOM 6745 H15X POP 54 16.790 8.260 46.010 1.00 0.00 ATOM 6746 H15Y POP 54 16.350 8.060 44.270 1.00 0.00 ATOM 6747 6C31 POP 54 17.390 6.370 45.120 1.00 0.00 ATOM 6748 H16X POP 54 18.450 6.710 45.240 1.00 0.00 ATOM 6749 H16Y POP 54 17.330 5.970 44.090 1.00 0.00 ATOM 6750 H16Z POP 54 17.230 5.550 45.850 1.00 0.00 ATOM 6751 N POP 55 39.740 50.310 66.670 1.00 0.00 ATOM 6752 HN1 POP 55 40.330 50.980 67.200 1.00 0.00 ATOM 6753 HN2 POP 55 40.170 50.250 65.730 1.00 0.00 ATOM 6754 HN3 POP 55 38.770 50.710 66.660 1.00 0.00 ATOM 6755 C12 POP 55 39.760 48.940 67.320 1.00 0.00 ATOM 6756 H12A POP 55 39.060 48.890 68.180 1.00 0.00 ATOM 6757 H12B POP 55 40.800 48.710 67.640 1.00 0.00 ATOM 6758 C11 POP 55 39.200 47.890 66.360 1.00 0.00 ATOM 6759 H11A POP 55 38.740 47.080 66.960 1.00 0.00 ATOM 6760 H11B POP 55 40.080 47.420 65.860 1.00 0.00 ATOM 6761 P POP 55 37.920 47.510 64.160 1.00 0.00 ATOM 6762 O13 POP 55 36.470 47.550 63.870 1.00 0.00 ATOM 6763 O14 POP 55 38.600 46.190 64.240 1.00 0.00 ATOM 6764 O11 POP 55 38.770 48.260 63.030 1.00 0.00 ATOM 6765 O12 POP 55 38.300 48.440 65.400 1.00 0.00 ATOM 6766 C1 POP 55 38.520 48.020 61.650 1.00 0.00 ATOM 6767 HA POP 55 39.030 48.750 60.990 1.00 0.00 ATOM 6768 HB POP 55 37.440 48.170 61.420 1.00 0.00 ATOM 6769 C2 POP 55 39.090 46.690 61.120 1.00 0.00 ATOM 6770 HS POP 55 38.400 45.970 61.620 1.00 0.00 ATOM 6771 O21 POP 55 40.460 46.600 61.530 1.00 0.00 ATOM 6772 C21 POP 55 40.910 45.350 61.460 1.00 0.00 ATOM 6773 O22 POP 55 40.200 44.370 61.330 1.00 0.00 ATOM 6774 C22 POP 55 42.420 45.260 61.650 1.00 0.00 ATOM 6775 H2R POP 55 42.620 44.720 62.600 1.00 0.00 ATOM 6776 H2S POP 55 42.930 46.240 61.770 1.00 0.00 ATOM 6777 C3 POP 55 38.950 46.510 59.600 1.00 0.00 ATOM 6778 HX POP 55 37.850 46.450 59.440 1.00 0.00 ATOM 6779 HY POP 55 39.460 45.570 59.300 1.00 0.00 ATOM 6780 O31 POP 55 39.600 47.630 59.000 1.00 0.00 ATOM 6781 C31 POP 55 39.380 47.720 57.690 1.00 0.00 ATOM 6782 O32 POP 55 38.560 47.100 57.030 1.00 0.00 ATOM 6783 C32 POP 55 40.420 48.680 57.140 1.00 0.00 ATOM 6784 H2X POP 55 41.350 48.530 57.730 1.00 0.00 ATOM 6785 H2Y POP 55 40.120 49.740 57.280 1.00 0.00 ATOM 6786 C23 POP 55 42.980 44.610 60.390 1.00 0.00 ATOM 6787 H3R POP 55 42.560 43.580 60.290 1.00 0.00 ATOM 6788 H3S POP 55 44.080 44.440 60.430 1.00 0.00 ATOM 6789 C24 POP 55 42.920 45.400 59.080 1.00 0.00 ATOM 6790 H4R POP 55 43.380 46.400 59.270 1.00 0.00 ATOM 6791 H4S POP 55 41.890 45.500 58.680 1.00 0.00 ATOM 6792 C25 POP 55 43.720 44.760 57.950 1.00 0.00 ATOM 6793 H5R POP 55 43.760 43.650 57.970 1.00 0.00 ATOM 6794 H5S POP 55 44.810 44.950 58.030 1.00 0.00 ATOM 6795 C26 POP 55 43.330 45.150 56.520 1.00 0.00 ATOM 6796 H6R POP 55 43.270 46.250 56.370 1.00 0.00 ATOM 6797 H6S POP 55 42.350 44.670 56.320 1.00 0.00 ATOM 6798 C27 POP 55 44.270 44.590 55.460 1.00 0.00 ATOM 6799 H7R POP 55 44.380 43.490 55.610 1.00 0.00 ATOM 6800 H7S POP 55 45.230 45.020 55.810 1.00 0.00 ATOM 6801 C28 POP 55 43.960 45.160 54.070 1.00 0.00 ATOM 6802 H8R POP 55 44.770 44.780 53.410 1.00 0.00 ATOM 6803 H8S POP 55 44.020 46.270 54.100 1.00 0.00 ATOM 6804 C29 POP 55 42.620 44.880 53.480 1.00 0.00 ATOM 6805 H91 POP 55 41.840 44.860 54.260 1.00 0.00 ATOM 6806 0C21 POP 55 42.290 44.590 52.210 1.00 0.00 ATOM 6807 1H10 POP 55 41.230 44.570 51.900 1.00 0.00 ATOM 6808 1C21 POP 55 43.140 44.570 50.970 1.00 0.00 ATOM 6809 H11R POP 55 43.500 43.570 50.650 1.00 0.00 ATOM 6810 H11S POP 55 44.120 45.090 51.060 1.00 0.00 ATOM 6811 2C21 POP 55 42.230 45.170 49.900 1.00 0.00 ATOM 6812 H12R POP 55 41.740 45.990 50.460 1.00 0.00 ATOM 6813 H12S POP 55 41.420 44.470 49.610 1.00 0.00 ATOM 6814 3C21 POP 55 43.110 45.700 48.760 1.00 0.00 ATOM 6815 H13R POP 55 43.620 44.980 48.080 1.00 0.00 ATOM 6816 H13S POP 55 43.940 46.270 49.210 1.00 0.00 ATOM 6817 4C21 POP 55 42.320 46.640 47.840 1.00 0.00 ATOM 6818 H14R POP 55 41.870 47.410 48.500 1.00 0.00 ATOM 6819 H14S POP 55 41.490 46.110 47.320 1.00 0.00 ATOM 6820 5C21 POP 55 43.240 47.160 46.730 1.00 0.00 ATOM 6821 H15R POP 55 43.390 46.290 46.060 1.00 0.00 ATOM 6822 H15S POP 55 44.210 47.410 47.220 1.00 0.00 ATOM 6823 6C21 POP 55 42.660 48.290 45.870 1.00 0.00 ATOM 6824 H16R POP 55 41.800 47.870 45.300 1.00 0.00 ATOM 6825 H16S POP 55 43.390 48.560 45.080 1.00 0.00 ATOM 6826 7C21 POP 55 42.130 49.430 46.740 1.00 0.00 ATOM 6827 H17R POP 55 42.670 49.670 47.680 1.00 0.00 ATOM 6828 H17S POP 55 41.070 49.110 46.870 1.00 0.00 ATOM 6829 8C21 POP 55 42.080 50.720 45.940 1.00 0.00 ATOM 6830 H18R POP 55 41.390 50.650 45.080 1.00 0.00 ATOM 6831 H18S POP 55 43.090 51.120 45.690 1.00 0.00 ATOM 6832 H18T POP 55 41.650 51.440 46.660 1.00 0.00 ATOM 6833 C33 POP 55 40.530 48.360 55.650 1.00 0.00 ATOM 6834 H3X POP 55 39.550 48.470 55.140 1.00 0.00 ATOM 6835 H3Y POP 55 40.860 47.310 55.470 1.00 0.00 ATOM 6836 C34 POP 55 41.460 49.290 54.870 1.00 0.00 ATOM 6837 H4X POP 55 41.140 50.290 55.230 1.00 0.00 ATOM 6838 H4Y POP 55 41.250 49.370 53.780 1.00 0.00 ATOM 6839 C35 POP 55 42.970 49.150 55.090 1.00 0.00 ATOM 6840 H5X POP 55 43.130 48.130 54.670 1.00 0.00 ATOM 6841 H5Y POP 55 43.190 49.120 56.180 1.00 0.00 ATOM 6842 C36 POP 55 43.930 50.250 54.650 1.00 0.00 ATOM 6843 H6X POP 55 44.970 49.870 54.770 1.00 0.00 ATOM 6844 H6Y POP 55 43.890 51.210 55.200 1.00 0.00 ATOM 6845 C37 POP 55 43.710 50.830 53.250 1.00 0.00 ATOM 6846 H7X POP 55 44.370 51.710 53.110 1.00 0.00 ATOM 6847 H7Y POP 55 42.660 51.200 53.180 1.00 0.00 ATOM 6848 C38 POP 55 44.080 49.900 52.100 1.00 0.00 ATOM 6849 H8X POP 55 43.510 48.950 52.230 1.00 0.00 ATOM 6850 H8Y POP 55 45.150 49.590 52.220 1.00 0.00 ATOM 6851 C39 POP 55 44.030 50.550 50.720 1.00 0.00 ATOM 6852 H9X POP 55 44.420 51.580 50.870 1.00 0.00 ATOM 6853 H9Y POP 55 42.970 50.630 50.380 1.00 0.00 ATOM 6854 0C31 POP 55 44.790 49.680 49.730 1.00 0.00 ATOM 6855 H10X POP 55 44.290 48.750 49.390 1.00 0.00 ATOM 6856 H10Y POP 55 45.840 49.550 50.080 1.00 0.00 ATOM 6857 1C31 POP 55 45.100 50.330 48.370 1.00 0.00 ATOM 6858 H11X POP 55 44.190 50.860 48.010 1.00 0.00 ATOM 6859 H11Y POP 55 45.300 49.500 47.670 1.00 0.00 ATOM 6860 2C31 POP 55 46.160 51.430 48.350 1.00 0.00 ATOM 6861 H12X POP 55 47.140 50.970 48.620 1.00 0.00 ATOM 6862 H12Y POP 55 45.890 52.090 49.200 1.00 0.00 ATOM 6863 3C31 POP 55 46.120 52.300 47.090 1.00 0.00 ATOM 6864 H13X POP 55 46.660 53.270 47.120 1.00 0.00 ATOM 6865 H13Y POP 55 45.120 52.750 46.940 1.00 0.00 ATOM 6866 4C31 POP 55 46.420 51.520 45.810 1.00 0.00 ATOM 6867 H14X POP 55 46.060 52.050 44.910 1.00 0.00 ATOM 6868 H14Y POP 55 45.870 50.550 45.860 1.00 0.00 ATOM 6869 5C31 POP 55 47.900 51.130 45.690 1.00 0.00 ATOM 6870 H15X POP 55 48.070 50.380 44.880 1.00 0.00 ATOM 6871 H15Y POP 55 48.080 50.750 46.720 1.00 0.00 ATOM 6872 6C31 POP 55 48.830 52.320 45.480 1.00 0.00 ATOM 6873 H16X POP 55 48.770 53.020 46.340 1.00 0.00 ATOM 6874 H16Y POP 55 48.430 52.880 44.620 1.00 0.00 ATOM 6875 H16Z POP 55 49.860 51.950 45.290 1.00 0.00 ATOM 6876 N POP 56 21.140 14.980 65.720 1.00 0.00 ATOM 6877 HN1 POP 56 21.790 14.200 65.970 1.00 0.00 ATOM 6878 HN2 POP 56 21.230 15.700 66.460 1.00 0.00 ATOM 6879 HN3 POP 56 20.210 14.540 65.550 1.00 0.00 ATOM 6880 C12 POP 56 21.310 15.590 64.350 1.00 0.00 ATOM 6881 H12A POP 56 22.200 16.240 64.310 1.00 0.00 ATOM 6882 H12B POP 56 20.480 16.310 64.180 1.00 0.00 ATOM 6883 C11 POP 56 21.360 14.440 63.340 1.00 0.00 ATOM 6884 H11A POP 56 22.200 13.750 63.600 1.00 0.00 ATOM 6885 H11B POP 56 21.620 14.870 62.350 1.00 0.00 ATOM 6886 P POP 56 20.130 12.580 62.240 1.00 0.00 ATOM 6887 O13 POP 56 19.040 11.590 62.470 1.00 0.00 ATOM 6888 O14 POP 56 21.490 12.010 62.120 1.00 0.00 ATOM 6889 O11 POP 56 19.840 13.460 60.940 1.00 0.00 ATOM 6890 O12 POP 56 20.120 13.730 63.350 1.00 0.00 ATOM 6891 C1 POP 56 18.920 14.550 61.060 1.00 0.00 ATOM 6892 HA POP 56 18.970 15.070 60.080 1.00 0.00 ATOM 6893 HB POP 56 19.370 15.380 61.660 1.00 0.00 ATOM 6894 C2 POP 56 17.440 14.180 61.210 1.00 0.00 ATOM 6895 HS POP 56 17.270 14.040 62.300 1.00 0.00 ATOM 6896 O21 POP 56 16.930 13.020 60.540 1.00 0.00 ATOM 6897 C21 POP 56 15.980 12.330 61.170 1.00 0.00 ATOM 6898 O22 POP 56 15.300 12.760 62.090 1.00 0.00 ATOM 6899 C22 POP 56 15.810 10.960 60.530 1.00 0.00 ATOM 6900 H2R POP 56 14.950 10.870 59.830 1.00 0.00 ATOM 6901 H2S POP 56 15.620 10.270 61.370 1.00 0.00 ATOM 6902 C3 POP 56 16.520 15.350 60.820 1.00 0.00 ATOM 6903 HX POP 56 16.930 16.200 61.400 1.00 0.00 ATOM 6904 HY POP 56 15.520 15.120 61.260 1.00 0.00 ATOM 6905 O31 POP 56 16.460 15.690 59.430 1.00 0.00 ATOM 6906 C31 POP 56 15.440 15.200 58.730 1.00 0.00 ATOM 6907 O32 POP 56 14.640 14.380 59.170 1.00 0.00 ATOM 6908 C32 POP 56 15.440 15.820 57.340 1.00 0.00 ATOM 6909 H2X POP 56 15.970 15.100 56.680 1.00 0.00 ATOM 6910 H2Y POP 56 15.890 16.830 57.400 1.00 0.00 ATOM 6911 C23 POP 56 17.030 10.550 59.690 1.00 0.00 ATOM 6912 H3R POP 56 17.980 10.590 60.260 1.00 0.00 ATOM 6913 H3S POP 56 17.200 11.320 58.910 1.00 0.00 ATOM 6914 C24 POP 56 16.900 9.150 59.070 1.00 0.00 ATOM 6915 H4R POP 56 16.020 9.270 58.400 1.00 0.00 ATOM 6916 H4S POP 56 16.560 8.440 59.860 1.00 0.00 ATOM 6917 C25 POP 56 18.070 8.680 58.210 1.00 0.00 ATOM 6918 H5R POP 56 18.970 8.420 58.810 1.00 0.00 ATOM 6919 H5S POP 56 18.240 9.390 57.370 1.00 0.00 ATOM 6920 C26 POP 56 17.670 7.460 57.400 1.00 0.00 ATOM 6921 H6R POP 56 16.710 7.770 56.920 1.00 0.00 ATOM 6922 H6S POP 56 17.390 6.690 58.150 1.00 0.00 ATOM 6923 C27 POP 56 18.700 7.010 56.360 1.00 0.00 ATOM 6924 H7R POP 56 18.810 7.740 55.530 1.00 0.00 ATOM 6925 H7S POP 56 18.360 6.100 55.840 1.00 0.00 ATOM 6926 C28 POP 56 20.090 6.760 56.950 1.00 0.00 ATOM 6927 H8R POP 56 20.070 6.060 57.820 1.00 0.00 ATOM 6928 H8S POP 56 20.630 7.670 57.300 1.00 0.00 ATOM 6929 C29 POP 56 20.870 6.150 55.810 1.00 0.00 ATOM 6930 H91 POP 56 20.460 6.260 54.790 1.00 0.00 ATOM 6931 0C21 POP 56 22.060 5.570 55.990 1.00 0.00 ATOM 6932 1H10 POP 56 22.610 5.240 55.100 1.00 0.00 ATOM 6933 1C21 POP 56 22.830 5.390 57.270 1.00 0.00 ATOM 6934 H11R POP 56 22.070 5.500 58.080 1.00 0.00 ATOM 6935 H11S POP 56 23.550 6.230 57.400 1.00 0.00 ATOM 6936 2C21 POP 56 23.500 4.030 57.450 1.00 0.00 ATOM 6937 H12R POP 56 22.730 3.240 57.340 1.00 0.00 ATOM 6938 H12S POP 56 23.890 3.980 58.490 1.00 0.00 ATOM 6939 3C21 POP 56 24.700 3.890 56.510 1.00 0.00 ATOM 6940 H13R POP 56 25.670 4.310 56.850 1.00 0.00 ATOM 6941 H13S POP 56 24.550 4.380 55.520 1.00 0.00 ATOM 6942 4C21 POP 56 24.970 2.420 56.180 1.00 0.00 ATOM 6943 H14R POP 56 24.150 2.010 55.550 1.00 0.00 ATOM 6944 H14S POP 56 24.950 1.830 57.120 1.00 0.00 ATOM 6945 5C21 POP 56 26.340 2.330 55.510 1.00 0.00 ATOM 6946 H15R POP 56 26.630 1.260 55.440 1.00 0.00 ATOM 6947 H15S POP 56 27.050 2.940 56.090 1.00 0.00 ATOM 6948 6C21 POP 56 26.430 2.870 54.080 1.00 0.00 ATOM 6949 H16R POP 56 26.280 3.970 54.080 1.00 0.00 ATOM 6950 H16S POP 56 25.530 2.480 53.560 1.00 0.00 ATOM 6951 7C21 POP 56 27.780 2.440 53.500 1.00 0.00 ATOM 6952 H17R POP 56 27.650 1.350 53.370 1.00 0.00 ATOM 6953 H17S POP 56 28.590 2.740 54.190 1.00 0.00 ATOM 6954 8C21 POP 56 28.260 3.020 52.170 1.00 0.00 ATOM 6955 H18R POP 56 28.310 4.130 52.240 1.00 0.00 ATOM 6956 H18S POP 56 27.540 2.680 51.390 1.00 0.00 ATOM 6957 H18T POP 56 29.290 2.670 51.960 1.00 0.00 ATOM 6958 C33 POP 56 13.980 15.950 56.910 1.00 0.00 ATOM 6959 H3X POP 56 13.490 16.520 57.730 1.00 0.00 ATOM 6960 H3Y POP 56 13.400 15.000 56.870 1.00 0.00 ATOM 6961 C34 POP 56 13.790 16.790 55.640 1.00 0.00 ATOM 6962 H4X POP 56 14.020 17.830 55.950 1.00 0.00 ATOM 6963 H4Y POP 56 12.710 16.840 55.390 1.00 0.00 ATOM 6964 C35 POP 56 14.790 16.550 54.510 1.00 0.00 ATOM 6965 H5X POP 56 14.630 15.480 54.260 1.00 0.00 ATOM 6966 H5Y POP 56 15.840 16.490 54.880 1.00 0.00 ATOM 6967 C36 POP 56 14.610 17.350 53.220 1.00 0.00 ATOM 6968 H6X POP 56 14.840 18.390 53.550 1.00 0.00 ATOM 6969 H6Y POP 56 13.570 17.280 52.840 1.00 0.00 ATOM 6970 C37 POP 56 15.600 16.960 52.120 1.00 0.00 ATOM 6971 H7X POP 56 15.700 15.880 51.910 1.00 0.00 ATOM 6972 H7Y POP 56 16.600 17.220 52.520 1.00 0.00 ATOM 6973 C38 POP 56 15.490 17.790 50.830 1.00 0.00 ATOM 6974 H8X POP 56 15.330 18.870 51.030 1.00 0.00 ATOM 6975 H8Y POP 56 14.620 17.470 50.230 1.00 0.00 ATOM 6976 C39 POP 56 16.610 17.490 49.830 1.00 0.00 ATOM 6977 H9X POP 56 16.530 16.390 49.660 1.00 0.00 ATOM 6978 H9Y POP 56 17.590 17.810 50.240 1.00 0.00 ATOM 6979 0C31 POP 56 16.330 18.200 48.510 1.00 0.00 ATOM 6980 H10X POP 56 16.230 19.260 48.840 1.00 0.00 ATOM 6981 H10Y POP 56 15.360 17.940 48.040 1.00 0.00 ATOM 6982 1C31 POP 56 17.600 18.180 47.650 1.00 0.00 ATOM 6983 H11X POP 56 18.000 17.190 47.340 1.00 0.00 ATOM 6984 H11Y POP 56 18.440 18.620 48.230 1.00 0.00 ATOM 6985 2C31 POP 56 17.440 19.030 46.390 1.00 0.00 ATOM 6986 H12X POP 56 17.060 20.030 46.690 1.00 0.00 ATOM 6987 H12Y POP 56 16.660 18.490 45.810 1.00 0.00 ATOM 6988 3C31 POP 56 18.710 19.080 45.540 1.00 0.00 ATOM 6989 H13X POP 56 18.960 18.130 45.030 1.00 0.00 ATOM 6990 H13Y POP 56 19.510 19.300 46.280 1.00 0.00 ATOM 6991 4C31 POP 56 18.720 20.200 44.490 1.00 0.00 ATOM 6992 H14X POP 56 19.710 20.290 44.000 1.00 0.00 ATOM 6993 H14Y POP 56 18.620 21.210 44.930 1.00 0.00 ATOM 6994 5C31 POP 56 17.720 19.880 43.380 1.00 0.00 ATOM 6995 H15X POP 56 16.680 19.750 43.740 1.00 0.00 ATOM 6996 H15Y POP 56 18.080 18.890 43.020 1.00 0.00 ATOM 6997 6C31 POP 56 17.650 20.900 42.240 1.00 0.00 ATOM 6998 H16X POP 56 18.630 21.280 41.880 1.00 0.00 ATOM 6999 H16Y POP 56 17.030 21.760 42.580 1.00 0.00 ATOM 7000 H16Z POP 56 17.180 20.410 41.370 1.00 0.00 ATOM 7001 N POP 57 7.770 30.070 71.240 1.00 0.00 ATOM 7002 HN1 POP 57 7.290 29.940 70.320 1.00 0.00 ATOM 7003 HN2 POP 57 7.550 30.960 71.720 1.00 0.00 ATOM 7004 HN3 POP 57 8.760 30.190 70.950 1.00 0.00 ATOM 7005 C12 POP 57 7.730 28.830 72.100 1.00 0.00 ATOM 7006 H12A POP 57 6.650 28.710 72.340 1.00 0.00 ATOM 7007 H12B POP 57 8.300 28.870 73.050 1.00 0.00 ATOM 7008 C11 POP 57 8.240 27.630 71.300 1.00 0.00 ATOM 7009 H11A POP 57 7.910 26.660 71.730 1.00 0.00 ATOM 7010 H11B POP 57 9.320 27.820 71.460 1.00 0.00 ATOM 7011 P POP 57 8.720 26.580 69.080 1.00 0.00 ATOM 7012 O13 POP 57 7.990 25.310 69.250 1.00 0.00 ATOM 7013 O14 POP 57 10.130 26.620 69.510 1.00 0.00 ATOM 7014 O11 POP 57 8.590 27.070 67.560 1.00 0.00 ATOM 7015 O12 POP 57 7.950 27.730 69.900 1.00 0.00 ATOM 7016 C1 POP 57 7.410 27.720 67.060 1.00 0.00 ATOM 7017 HA POP 57 7.610 28.370 66.190 1.00 0.00 ATOM 7018 HB POP 57 6.970 28.470 67.740 1.00 0.00 ATOM 7019 C2 POP 57 6.390 26.640 66.640 1.00 0.00 ATOM 7020 HS POP 57 6.370 25.900 67.460 1.00 0.00 ATOM 7021 O21 POP 57 6.960 26.110 65.440 1.00 0.00 ATOM 7022 C21 POP 57 6.290 25.090 64.890 1.00 0.00 ATOM 7023 O22 POP 57 5.490 24.390 65.490 1.00 0.00 ATOM 7024 C22 POP 57 6.660 24.970 63.420 1.00 0.00 ATOM 7025 H2R POP 57 7.220 24.050 63.180 1.00 0.00 ATOM 7026 H2S POP 57 7.180 25.930 63.190 1.00 0.00 ATOM 7027 C3 POP 57 4.980 27.160 66.310 1.00 0.00 ATOM 7028 HX POP 57 4.520 27.530 67.250 1.00 0.00 ATOM 7029 HY POP 57 4.250 26.400 65.960 1.00 0.00 ATOM 7030 O31 POP 57 5.110 28.200 65.330 1.00 0.00 ATOM 7031 C31 POP 57 3.910 28.670 64.970 1.00 0.00 ATOM 7032 O32 POP 57 2.880 28.310 65.500 1.00 0.00 ATOM 7033 C32 POP 57 4.050 29.800 63.950 1.00 0.00 ATOM 7034 H2X POP 57 5.100 30.170 63.970 1.00 0.00 ATOM 7035 H2Y POP 57 3.440 30.670 64.260 1.00 0.00 ATOM 7036 C23 POP 57 5.320 24.900 62.670 1.00 0.00 ATOM 7037 H3R POP 57 4.670 25.710 63.060 1.00 0.00 ATOM 7038 H3S POP 57 4.800 23.930 62.780 1.00 0.00 ATOM 7039 C24 POP 57 5.430 25.170 61.170 1.00 0.00 ATOM 7040 H4R POP 57 6.110 24.480 60.640 1.00 0.00 ATOM 7041 H4S POP 57 5.760 26.210 60.960 1.00 0.00 ATOM 7042 C25 POP 57 4.030 25.100 60.560 1.00 0.00 ATOM 7043 H5R POP 57 3.260 25.870 60.790 1.00 0.00 ATOM 7044 H5S POP 57 3.600 24.100 60.780 1.00 0.00 ATOM 7045 C26 POP 57 4.270 25.150 59.050 1.00 0.00 ATOM 7046 H6R POP 57 5.130 24.480 58.820 1.00 0.00 ATOM 7047 H6S POP 57 4.600 26.110 58.600 1.00 0.00 ATOM 7048 C27 POP 57 3.060 24.680 58.230 1.00 0.00 ATOM 7049 H7R POP 57 2.240 25.330 58.580 1.00 0.00 ATOM 7050 H7S POP 57 2.860 23.610 58.470 1.00 0.00 ATOM 7051 C28 POP 57 3.370 24.560 56.730 1.00 0.00 ATOM 7052 H8R POP 57 4.170 23.790 56.710 1.00 0.00 ATOM 7053 H8S POP 57 3.820 25.490 56.310 1.00 0.00 ATOM 7054 C29 POP 57 2.290 24.000 55.860 1.00 0.00 ATOM 7055 H91 POP 57 1.480 23.490 56.410 1.00 0.00 ATOM 7056 0C21 POP 57 1.980 24.260 54.580 1.00 0.00 ATOM 7057 1H10 POP 57 1.060 23.850 54.140 1.00 0.00 ATOM 7058 1C21 POP 57 2.740 25.170 53.660 1.00 0.00 ATOM 7059 H11R POP 57 3.210 24.590 52.830 1.00 0.00 ATOM 7060 H11S POP 57 3.640 25.570 54.180 1.00 0.00 ATOM 7061 2C21 POP 57 1.920 26.350 53.140 1.00 0.00 ATOM 7062 H12R POP 57 1.490 26.850 54.040 1.00 0.00 ATOM 7063 H12S POP 57 1.110 25.970 52.490 1.00 0.00 ATOM 7064 3C21 POP 57 2.950 27.210 52.400 1.00 0.00 ATOM 7065 H13R POP 57 3.870 26.640 52.140 1.00 0.00 ATOM 7066 H13S POP 57 3.130 28.140 52.990 1.00 0.00 ATOM 7067 4C21 POP 57 2.430 27.810 51.090 1.00 0.00 ATOM 7068 H14R POP 57 1.860 28.750 51.250 1.00 0.00 ATOM 7069 H14S POP 57 1.700 27.070 50.690 1.00 0.00 ATOM 7070 5C21 POP 57 3.680 28.180 50.290 1.00 0.00 ATOM 7071 H15R POP 57 4.250 27.270 50.020 1.00 0.00 ATOM 7072 H15S POP 57 4.190 28.800 51.060 1.00 0.00 ATOM 7073 6C21 POP 57 3.350 28.980 49.030 1.00 0.00 ATOM 7074 H16R POP 57 2.610 29.720 49.410 1.00 0.00 ATOM 7075 H16S POP 57 2.780 28.400 48.280 1.00 0.00 ATOM 7076 7C21 POP 57 4.510 29.730 48.380 1.00 0.00 ATOM 7077 H17R POP 57 5.290 28.970 48.150 1.00 0.00 ATOM 7078 H17S POP 57 4.880 30.410 49.170 1.00 0.00 ATOM 7079 8C21 POP 57 4.080 30.730 47.300 1.00 0.00 ATOM 7080 H18R POP 57 3.410 30.320 46.520 1.00 0.00 ATOM 7081 H18S POP 57 4.950 31.210 46.810 1.00 0.00 ATOM 7082 H18T POP 57 3.500 31.580 47.710 1.00 0.00 ATOM 7083 C33 POP 57 3.730 29.240 62.570 1.00 0.00 ATOM 7084 H3X POP 57 2.730 28.770 62.490 1.00 0.00 ATOM 7085 H3Y POP 57 4.420 28.420 62.280 1.00 0.00 ATOM 7086 C34 POP 57 3.850 30.200 61.380 1.00 0.00 ATOM 7087 H4X POP 57 4.570 31.040 61.500 1.00 0.00 ATOM 7088 H4Y POP 57 2.820 30.610 61.320 1.00 0.00 ATOM 7089 C35 POP 57 4.260 29.490 60.090 1.00 0.00 ATOM 7090 H5X POP 57 3.580 28.640 59.870 1.00 0.00 ATOM 7091 H5Y POP 57 5.310 29.110 60.160 1.00 0.00 ATOM 7092 C36 POP 57 4.270 30.230 58.750 1.00 0.00 ATOM 7093 H6X POP 57 4.810 29.680 57.950 1.00 0.00 ATOM 7094 H6Y POP 57 4.640 31.270 58.920 1.00 0.00 ATOM 7095 C37 POP 57 2.830 30.440 58.280 1.00 0.00 ATOM 7096 H7X POP 57 2.450 31.220 58.970 1.00 0.00 ATOM 7097 H7Y POP 57 2.160 29.580 58.500 1.00 0.00 ATOM 7098 C38 POP 57 2.550 31.060 56.910 1.00 0.00 ATOM 7099 H8X POP 57 3.400 31.730 56.630 1.00 0.00 ATOM 7100 H8Y POP 57 1.640 31.690 56.900 1.00 0.00 ATOM 7101 C39 POP 57 2.500 30.120 55.700 1.00 0.00 ATOM 7102 H9X POP 57 1.790 29.290 55.880 1.00 0.00 ATOM 7103 H9Y POP 57 3.480 29.610 55.620 1.00 0.00 ATOM 7104 0C31 POP 57 2.150 30.790 54.380 1.00 0.00 ATOM 7105 H10X POP 57 1.150 31.290 54.350 1.00 0.00 ATOM 7106 H10Y POP 57 2.100 29.940 53.670 1.00 0.00 ATOM 7107 1C31 POP 57 3.230 31.690 53.780 1.00 0.00 ATOM 7108 H11X POP 57 4.190 31.180 53.540 1.00 0.00 ATOM 7109 H11Y POP 57 3.490 32.530 54.470 1.00 0.00 ATOM 7110 2C31 POP 57 2.670 32.470 52.590 1.00 0.00 ATOM 7111 H12X POP 57 1.930 33.220 52.940 1.00 0.00 ATOM 7112 H12Y POP 57 2.190 31.860 51.800 1.00 0.00 ATOM 7113 3C31 POP 57 3.830 33.270 52.000 1.00 0.00 ATOM 7114 H13X POP 57 4.550 32.450 51.760 1.00 0.00 ATOM 7115 H13Y POP 57 4.300 34.080 52.590 1.00 0.00 ATOM 7116 4C31 POP 57 3.480 33.960 50.680 1.00 0.00 ATOM 7117 H14X POP 57 3.000 34.920 50.960 1.00 0.00 ATOM 7118 H14Y POP 57 2.710 33.370 50.140 1.00 0.00 ATOM 7119 5C31 POP 57 4.730 34.230 49.830 1.00 0.00 ATOM 7120 H15X POP 57 5.130 33.210 49.670 1.00 0.00 ATOM 7121 H15Y POP 57 5.490 34.840 50.370 1.00 0.00 ATOM 7122 6C31 POP 57 4.540 35.080 48.580 1.00 0.00 ATOM 7123 H16X POP 57 3.820 34.500 47.960 1.00 0.00 ATOM 7124 H16Y POP 57 5.450 35.420 48.040 1.00 0.00 ATOM 7125 H16Z POP 57 4.060 35.930 49.100 1.00 0.00 ATOM 7126 N POP 58 61.190 4.470 63.850 1.00 0.00 ATOM 7127 HN1 POP 58 60.610 4.020 64.600 1.00 0.00 ATOM 7128 HN2 POP 58 62.170 4.460 64.210 1.00 0.00 ATOM 7129 HN3 POP 58 60.820 5.430 63.780 1.00 0.00 ATOM 7130 C12 POP 58 60.910 3.910 62.480 1.00 0.00 ATOM 7131 H12A POP 58 61.750 3.190 62.380 1.00 0.00 ATOM 7132 H12B POP 58 61.130 4.720 61.750 1.00 0.00 ATOM 7133 C11 POP 58 59.490 3.380 62.260 1.00 0.00 ATOM 7134 H11A POP 58 59.310 3.030 61.220 1.00 0.00 ATOM 7135 H11B POP 58 58.780 4.160 62.610 1.00 0.00 ATOM 7136 P POP 58 58.300 2.370 64.290 1.00 0.00 ATOM 7137 O13 POP 58 58.850 3.440 65.140 1.00 0.00 ATOM 7138 O14 POP 58 58.150 1.030 64.900 1.00 0.00 ATOM 7139 O11 POP 58 56.990 2.940 63.570 1.00 0.00 ATOM 7140 O12 POP 58 59.240 2.190 63.010 1.00 0.00 ATOM 7141 C1 POP 58 56.350 2.000 62.700 1.00 0.00 ATOM 7142 HA POP 58 55.600 1.390 63.260 1.00 0.00 ATOM 7143 HB POP 58 57.060 1.430 62.070 1.00 0.00 ATOM 7144 C2 POP 58 55.510 2.760 61.650 1.00 0.00 ATOM 7145 HS POP 58 54.900 1.950 61.200 1.00 0.00 ATOM 7146 O21 POP 58 56.280 3.500 60.700 1.00 0.00 ATOM 7147 C21 POP 58 56.770 2.670 59.790 1.00 0.00 ATOM 7148 O22 POP 58 56.780 1.450 59.850 1.00 0.00 ATOM 7149 C22 POP 58 57.440 3.440 58.660 1.00 0.00 ATOM 7150 H2R POP 58 58.550 3.350 58.670 1.00 0.00 ATOM 7151 H2S POP 58 57.060 4.480 58.780 1.00 0.00 ATOM 7152 C3 POP 58 54.450 3.650 62.310 1.00 0.00 ATOM 7153 HX POP 58 54.990 4.270 63.060 1.00 0.00 ATOM 7154 HY POP 58 53.750 3.000 62.870 1.00 0.00 ATOM 7155 O31 POP 58 53.810 4.520 61.370 1.00 0.00 ATOM 7156 C31 POP 58 52.620 4.080 60.980 1.00 0.00 ATOM 7157 O32 POP 58 52.040 3.090 61.400 1.00 0.00 ATOM 7158 C32 POP 58 52.210 5.000 59.840 1.00 0.00 ATOM 7159 H2X POP 58 52.920 5.170 59.010 1.00 0.00 ATOM 7160 H2Y POP 58 51.930 6.010 60.200 1.00 0.00 ATOM 7161 C23 POP 58 56.860 2.960 57.320 1.00 0.00 ATOM 7162 H3R POP 58 55.760 2.950 57.410 1.00 0.00 ATOM 7163 H3S POP 58 57.170 1.920 57.090 1.00 0.00 ATOM 7164 C24 POP 58 57.290 3.860 56.160 1.00 0.00 ATOM 7165 H4R POP 58 58.380 3.750 56.000 1.00 0.00 ATOM 7166 H4S POP 58 57.130 4.890 56.560 1.00 0.00 ATOM 7167 C25 POP 58 56.630 3.630 54.800 1.00 0.00 ATOM 7168 H5R POP 58 55.530 3.690 54.940 1.00 0.00 ATOM 7169 H5S POP 58 56.840 2.570 54.560 1.00 0.00 ATOM 7170 C26 POP 58 57.230 4.520 53.700 1.00 0.00 ATOM 7171 H6R POP 58 58.330 4.390 53.700 1.00 0.00 ATOM 7172 H6S POP 58 57.040 5.600 53.830 1.00 0.00 ATOM 7173 C27 POP 58 56.770 4.050 52.320 1.00 0.00 ATOM 7174 H7R POP 58 55.660 4.060 52.330 1.00 0.00 ATOM 7175 H7S POP 58 56.990 2.970 52.170 1.00 0.00 ATOM 7176 C28 POP 58 57.390 4.880 51.190 1.00 0.00 ATOM 7177 H8R POP 58 57.220 5.940 51.460 1.00 0.00 ATOM 7178 H8S POP 58 56.940 4.640 50.200 1.00 0.00 ATOM 7179 C29 POP 58 58.860 4.600 51.130 1.00 0.00 ATOM 7180 H91 POP 58 59.430 4.780 52.050 1.00 0.00 ATOM 7181 0C21 POP 58 59.510 4.120 50.060 1.00 0.00 ATOM 7182 1H10 POP 58 60.600 4.040 50.160 1.00 0.00 ATOM 7183 1C21 POP 58 58.850 3.850 48.730 1.00 0.00 ATOM 7184 H11R POP 58 58.500 4.810 48.300 1.00 0.00 ATOM 7185 H11S POP 58 57.890 3.380 49.030 1.00 0.00 ATOM 7186 2C21 POP 58 59.610 3.030 47.690 1.00 0.00 ATOM 7187 H12R POP 58 58.970 2.740 46.820 1.00 0.00 ATOM 7188 H12S POP 58 59.890 2.090 48.200 1.00 0.00 ATOM 7189 3C21 POP 58 60.780 3.840 47.130 1.00 0.00 ATOM 7190 H13R POP 58 61.190 4.450 47.970 1.00 0.00 ATOM 7191 H13S POP 58 60.390 4.530 46.340 1.00 0.00 ATOM 7192 4C21 POP 58 61.750 2.790 46.590 1.00 0.00 ATOM 7193 H14R POP 58 62.420 3.350 45.890 1.00 0.00 ATOM 7194 H14S POP 58 61.240 2.030 45.960 1.00 0.00 ATOM 7195 5C21 POP 58 62.510 2.070 47.700 1.00 0.00 ATOM 7196 H15R POP 58 61.930 1.280 48.210 1.00 0.00 ATOM 7197 H15S POP 58 62.790 2.770 48.520 1.00 0.00 ATOM 7198 6C21 POP 58 63.740 1.310 47.200 1.00 0.00 ATOM 7199 H16R POP 58 64.280 2.070 46.590 1.00 0.00 ATOM 7200 H16S POP 58 63.440 0.520 46.470 1.00 0.00 ATOM 7201 7C21 POP 58 64.520 0.420 48.170 1.00 0.00 ATOM 7202 H17R POP 58 65.250 0.920 48.830 1.00 0.00 ATOM 7203 H17S POP 58 65.180 -0.270 47.610 1.00 0.00 ATOM 7204 8C21 POP 58 63.660 -0.440 49.100 1.00 0.00 ATOM 7205 H18R POP 58 62.850 -0.850 48.450 1.00 0.00 ATOM 7206 H18S POP 58 63.050 0.070 49.880 1.00 0.00 ATOM 7207 H18T POP 58 64.180 -1.300 49.570 1.00 0.00 ATOM 7208 C33 POP 58 50.860 4.460 59.340 1.00 0.00 ATOM 7209 H3X POP 58 50.080 4.910 59.990 1.00 0.00 ATOM 7210 H3Y POP 58 50.820 3.350 59.400 1.00 0.00 ATOM 7211 C34 POP 58 50.610 4.820 57.870 1.00 0.00 ATOM 7212 H4X POP 58 49.550 4.580 57.670 1.00 0.00 ATOM 7213 H4Y POP 58 51.210 4.170 57.190 1.00 0.00 ATOM 7214 C35 POP 58 50.800 6.290 57.500 1.00 0.00 ATOM 7215 H5X POP 58 51.790 6.720 57.770 1.00 0.00 ATOM 7216 H5Y POP 58 50.140 6.920 58.130 1.00 0.00 ATOM 7217 C36 POP 58 50.500 6.690 56.050 1.00 0.00 ATOM 7218 H6X POP 58 51.070 5.960 55.440 1.00 0.00 ATOM 7219 H6Y POP 58 50.930 7.710 55.960 1.00 0.00 ATOM 7220 C37 POP 58 49.020 6.640 55.690 1.00 0.00 ATOM 7221 H7X POP 58 48.350 7.170 56.410 1.00 0.00 ATOM 7222 H7Y POP 58 48.690 5.580 55.720 1.00 0.00 ATOM 7223 C38 POP 58 48.740 7.060 54.240 1.00 0.00 ATOM 7224 H8X POP 58 47.650 6.960 54.100 1.00 0.00 ATOM 7225 H8Y POP 58 49.220 6.410 53.480 1.00 0.00 ATOM 7226 C39 POP 58 49.290 8.440 53.870 1.00 0.00 ATOM 7227 H9X POP 58 50.400 8.380 53.760 1.00 0.00 ATOM 7228 H9Y POP 58 49.050 9.180 54.660 1.00 0.00 ATOM 7229 0C31 POP 58 48.770 8.900 52.510 1.00 0.00 ATOM 7230 H10X POP 58 47.680 8.720 52.450 1.00 0.00 ATOM 7231 H10Y POP 58 49.250 8.420 51.630 1.00 0.00 ATOM 7232 1C31 POP 58 49.140 10.360 52.240 1.00 0.00 ATOM 7233 H11X POP 58 50.250 10.420 52.210 1.00 0.00 ATOM 7234 H11Y POP 58 48.760 11.050 53.030 1.00 0.00 ATOM 7235 2C31 POP 58 48.780 10.580 50.770 1.00 0.00 ATOM 7236 H12X POP 58 47.740 10.220 50.680 1.00 0.00 ATOM 7237 H12Y POP 58 49.420 10.000 50.070 1.00 0.00 ATOM 7238 3C31 POP 58 49.020 12.040 50.400 1.00 0.00 ATOM 7239 H13X POP 58 50.050 12.300 50.730 1.00 0.00 ATOM 7240 H13Y POP 58 48.260 12.670 50.910 1.00 0.00 ATOM 7241 4C31 POP 58 48.980 12.220 48.880 1.00 0.00 ATOM 7242 H14X POP 58 47.990 11.960 48.450 1.00 0.00 ATOM 7243 H14Y POP 58 49.650 11.440 48.460 1.00 0.00 ATOM 7244 5C31 POP 58 49.120 13.660 48.380 1.00 0.00 ATOM 7245 H15X POP 58 50.110 14.000 48.740 1.00 0.00 ATOM 7246 H15Y POP 58 48.450 14.260 49.030 1.00 0.00 ATOM 7247 6C31 POP 58 48.990 13.760 46.860 1.00 0.00 ATOM 7248 H16X POP 58 49.000 14.840 46.580 1.00 0.00 ATOM 7249 H16Y POP 58 48.080 13.270 46.450 1.00 0.00 ATOM 7250 H16Z POP 58 49.870 13.240 46.410 1.00 0.00 ATOM 7251 N POP 59 13.140 57.630 62.220 1.00 0.00 ATOM 7252 HN1 POP 59 13.950 57.040 62.510 1.00 0.00 ATOM 7253 HN2 POP 59 13.440 58.570 61.870 1.00 0.00 ATOM 7254 HN3 POP 59 12.610 57.840 63.090 1.00 0.00 ATOM 7255 C12 POP 59 12.280 56.850 61.260 1.00 0.00 ATOM 7256 H12A POP 59 11.850 55.980 61.810 1.00 0.00 ATOM 7257 H12B POP 59 13.010 56.510 60.490 1.00 0.00 ATOM 7258 C11 POP 59 11.220 57.890 60.880 1.00 0.00 ATOM 7259 H11A POP 59 10.540 57.290 60.240 1.00 0.00 ATOM 7260 H11B POP 59 11.630 58.790 60.370 1.00 0.00 ATOM 7261 P POP 59 9.010 58.970 61.750 1.00 0.00 ATOM 7262 O13 POP 59 8.670 59.920 62.830 1.00 0.00 ATOM 7263 O14 POP 59 8.050 57.860 61.550 1.00 0.00 ATOM 7264 O11 POP 59 9.050 59.780 60.370 1.00 0.00 ATOM 7265 O12 POP 59 10.440 58.310 62.000 1.00 0.00 ATOM 7266 C1 POP 59 7.790 60.240 59.870 1.00 0.00 ATOM 7267 HA POP 59 7.520 61.230 60.290 1.00 0.00 ATOM 7268 HB POP 59 6.900 59.610 60.120 1.00 0.00 ATOM 7269 C2 POP 59 7.820 60.290 58.340 1.00 0.00 ATOM 7270 HS POP 59 7.710 59.270 57.900 1.00 0.00 ATOM 7271 O21 POP 59 9.080 60.810 57.910 1.00 0.00 ATOM 7272 C21 POP 59 9.920 59.830 57.590 1.00 0.00 ATOM 7273 O22 POP 59 9.750 58.640 57.800 1.00 0.00 ATOM 7274 C22 POP 59 11.150 60.400 56.890 1.00 0.00 ATOM 7275 H2R POP 59 11.970 59.710 57.190 1.00 0.00 ATOM 7276 H2S POP 59 11.330 61.460 57.150 1.00 0.00 ATOM 7277 C3 POP 59 6.740 61.160 57.680 1.00 0.00 ATOM 7278 HX POP 59 6.790 62.110 58.260 1.00 0.00 ATOM 7279 HY POP 59 5.730 60.770 57.920 1.00 0.00 ATOM 7280 O31 POP 59 7.060 61.370 56.300 1.00 0.00 ATOM 7281 C31 POP 59 6.090 60.960 55.480 1.00 0.00 ATOM 7282 O32 POP 59 4.990 60.640 55.900 1.00 0.00 ATOM 7283 C32 POP 59 6.520 61.120 54.030 1.00 0.00 ATOM 7284 H2X POP 59 7.550 61.490 54.220 1.00 0.00 ATOM 7285 H2Y POP 59 5.920 61.880 53.480 1.00 0.00 ATOM 7286 C23 POP 59 11.040 60.280 55.370 1.00 0.00 ATOM 7287 H3R POP 59 10.050 59.790 55.210 1.00 0.00 ATOM 7288 H3S POP 59 11.890 59.680 54.990 1.00 0.00 ATOM 7289 C24 POP 59 11.110 61.570 54.540 1.00 0.00 ATOM 7290 H4R POP 59 12.180 61.890 54.610 1.00 0.00 ATOM 7291 H4S POP 59 10.400 62.290 55.000 1.00 0.00 ATOM 7292 C25 POP 59 10.740 61.400 53.070 1.00 0.00 ATOM 7293 H5R POP 59 9.650 61.210 53.150 1.00 0.00 ATOM 7294 H5S POP 59 11.270 60.480 52.770 1.00 0.00 ATOM 7295 C26 POP 59 10.870 62.490 52.000 1.00 0.00 ATOM 7296 H6R POP 59 10.310 63.400 52.320 1.00 0.00 ATOM 7297 H6S POP 59 10.480 62.040 51.060 1.00 0.00 ATOM 7298 C27 POP 59 12.340 62.860 51.800 1.00 0.00 ATOM 7299 H7R POP 59 12.870 61.890 51.760 1.00 0.00 ATOM 7300 H7S POP 59 12.620 63.540 52.630 1.00 0.00 ATOM 7301 C28 POP 59 12.690 63.630 50.530 1.00 0.00 ATOM 7302 H8R POP 59 12.070 64.560 50.550 1.00 0.00 ATOM 7303 H8S POP 59 12.310 63.130 49.610 1.00 0.00 ATOM 7304 C29 POP 59 14.130 64.060 50.510 1.00 0.00 ATOM 7305 H91 POP 59 14.390 64.810 51.270 1.00 0.00 ATOM 7306 0C21 POP 59 15.090 63.500 49.770 1.00 0.00 ATOM 7307 1H10 POP 59 16.130 63.850 49.860 1.00 0.00 ATOM 7308 1C21 POP 59 14.730 62.570 48.650 1.00 0.00 ATOM 7309 H11R POP 59 14.480 63.170 47.750 1.00 0.00 ATOM 7310 H11S POP 59 13.820 61.960 48.850 1.00 0.00 ATOM 7311 2C21 POP 59 15.920 61.710 48.230 1.00 0.00 ATOM 7312 H12R POP 59 16.160 60.780 48.800 1.00 0.00 ATOM 7313 H12S POP 59 16.830 62.310 48.430 1.00 0.00 ATOM 7314 3C21 POP 59 15.980 61.300 46.760 1.00 0.00 ATOM 7315 H13R POP 59 15.640 62.080 46.040 1.00 0.00 ATOM 7316 H13S POP 59 15.370 60.380 46.620 1.00 0.00 ATOM 7317 4C21 POP 59 17.420 60.910 46.400 1.00 0.00 ATOM 7318 H14R POP 59 17.760 60.180 47.160 1.00 0.00 ATOM 7319 H14S POP 59 18.110 61.770 46.360 1.00 0.00 ATOM 7320 5C21 POP 59 17.300 60.300 45.000 1.00 0.00 ATOM 7321 H15R POP 59 16.740 60.910 44.250 1.00 0.00 ATOM 7322 H15S POP 59 16.810 59.310 45.140 1.00 0.00 ATOM 7323 6C21 POP 59 18.670 60.030 44.380 1.00 0.00 ATOM 7324 H16R POP 59 19.210 59.350 45.080 1.00 0.00 ATOM 7325 H16S POP 59 19.360 60.890 44.210 1.00 0.00 ATOM 7326 7C21 POP 59 18.520 59.380 43.010 1.00 0.00 ATOM 7327 H17R POP 59 18.110 60.150 42.330 1.00 0.00 ATOM 7328 H17S POP 59 17.950 58.440 43.160 1.00 0.00 ATOM 7329 8C21 POP 59 19.870 58.990 42.410 1.00 0.00 ATOM 7330 H18R POP 59 20.620 59.810 42.490 1.00 0.00 ATOM 7331 H18S POP 59 19.710 58.730 41.350 1.00 0.00 ATOM 7332 H18T POP 59 20.290 58.080 42.910 1.00 0.00 ATOM 7333 C33 POP 59 6.310 59.880 53.170 1.00 0.00 ATOM 7334 H3X POP 59 5.280 59.480 53.310 1.00 0.00 ATOM 7335 H3Y POP 59 7.020 59.040 53.320 1.00 0.00 ATOM 7336 C34 POP 59 6.200 60.260 51.690 1.00 0.00 ATOM 7337 H4X POP 59 5.690 61.240 51.610 1.00 0.00 ATOM 7338 H4Y POP 59 5.610 59.490 51.150 1.00 0.00 ATOM 7339 C35 POP 59 7.580 60.510 51.070 1.00 0.00 ATOM 7340 H5X POP 59 8.150 59.560 51.060 1.00 0.00 ATOM 7341 H5Y POP 59 8.140 61.220 51.710 1.00 0.00 ATOM 7342 C36 POP 59 7.640 61.240 49.720 1.00 0.00 ATOM 7343 H6X POP 59 8.500 61.940 49.780 1.00 0.00 ATOM 7344 H6Y POP 59 6.800 61.960 49.630 1.00 0.00 ATOM 7345 C37 POP 59 7.710 60.250 48.560 1.00 0.00 ATOM 7346 H7X POP 59 6.940 59.480 48.790 1.00 0.00 ATOM 7347 H7Y POP 59 8.760 59.880 48.500 1.00 0.00 ATOM 7348 C38 POP 59 7.440 60.990 47.250 1.00 0.00 ATOM 7349 H8X POP 59 8.060 61.920 47.190 1.00 0.00 ATOM 7350 H8Y POP 59 6.370 61.270 47.130 1.00 0.00 ATOM 7351 C39 POP 59 7.980 60.240 46.030 1.00 0.00 ATOM 7352 H9X POP 59 9.090 60.230 46.090 1.00 0.00 ATOM 7353 H9Y POP 59 7.730 60.740 45.070 1.00 0.00 ATOM 7354 0C31 POP 59 7.560 58.770 45.860 1.00 0.00 ATOM 7355 H10X POP 59 6.500 58.820 46.190 1.00 0.00 ATOM 7356 H10Y POP 59 8.090 58.020 46.490 1.00 0.00 ATOM 7357 1C31 POP 59 7.460 58.300 44.410 1.00 0.00 ATOM 7358 H11X POP 59 7.210 59.080 43.670 1.00 0.00 ATOM 7359 H11Y POP 59 6.720 57.470 44.390 1.00 0.00 ATOM 7360 2C31 POP 59 8.820 57.720 44.010 1.00 0.00 ATOM 7361 H12X POP 59 9.450 57.360 44.850 1.00 0.00 ATOM 7362 H12Y POP 59 9.440 58.590 43.720 1.00 0.00 ATOM 7363 3C31 POP 59 8.800 56.620 42.950 1.00 0.00 ATOM 7364 H13X POP 59 8.190 56.920 42.070 1.00 0.00 ATOM 7365 H13Y POP 59 8.410 55.730 43.490 1.00 0.00 ATOM 7366 4C31 POP 59 10.200 56.340 42.400 1.00 0.00 ATOM 7367 H14X POP 59 10.970 56.570 43.170 1.00 0.00 ATOM 7368 H14Y POP 59 10.120 55.240 42.230 1.00 0.00 ATOM 7369 5C31 POP 59 10.540 57.090 41.110 1.00 0.00 ATOM 7370 H15X POP 59 9.660 57.070 40.430 1.00 0.00 ATOM 7371 H15Y POP 59 10.650 58.170 41.380 1.00 0.00 ATOM 7372 6C31 POP 59 11.750 56.510 40.380 1.00 0.00 ATOM 7373 H16X POP 59 12.580 56.260 41.090 1.00 0.00 ATOM 7374 H16Y POP 59 12.090 57.300 39.680 1.00 0.00 ATOM 7375 H16Z POP 59 11.430 55.590 39.860 1.00 0.00 ATOM 7376 N POP 60 57.420 4.500 67.080 1.00 0.00 ATOM 7377 HN1 POP 60 58.050 4.040 66.400 1.00 0.00 ATOM 7378 HN2 POP 60 57.660 4.450 68.090 1.00 0.00 ATOM 7379 HN3 POP 60 56.460 4.140 66.910 1.00 0.00 ATOM 7380 C12 POP 60 57.270 5.990 66.890 1.00 0.00 ATOM 7381 H12A POP 60 58.300 6.400 66.990 1.00 0.00 ATOM 7382 H12B POP 60 56.690 6.330 67.780 1.00 0.00 ATOM 7383 C11 POP 60 56.670 6.530 65.590 1.00 0.00 ATOM 7384 H11A POP 60 56.520 7.620 65.680 1.00 0.00 ATOM 7385 H11B POP 60 55.720 5.970 65.480 1.00 0.00 ATOM 7386 P POP 60 58.540 7.240 63.920 1.00 0.00 ATOM 7387 O13 POP 60 59.910 6.720 64.070 1.00 0.00 ATOM 7388 O14 POP 60 58.440 8.500 64.700 1.00 0.00 ATOM 7389 O11 POP 60 58.160 7.470 62.380 1.00 0.00 ATOM 7390 O12 POP 60 57.480 6.170 64.470 1.00 0.00 ATOM 7391 C1 POP 60 56.810 7.140 62.030 1.00 0.00 ATOM 7392 HA POP 60 56.090 7.760 62.600 1.00 0.00 ATOM 7393 HB POP 60 56.510 6.100 62.290 1.00 0.00 ATOM 7394 C2 POP 60 56.580 7.250 60.520 1.00 0.00 ATOM 7395 HS POP 60 56.430 6.200 60.180 1.00 0.00 ATOM 7396 O21 POP 60 57.760 7.710 59.870 1.00 0.00 ATOM 7397 C21 POP 60 58.760 6.830 59.750 1.00 0.00 ATOM 7398 O22 POP 60 58.790 5.700 60.210 1.00 0.00 ATOM 7399 C22 POP 60 59.770 7.380 58.750 1.00 0.00 ATOM 7400 H2R POP 60 60.520 8.020 59.260 1.00 0.00 ATOM 7401 H2S POP 60 59.120 7.890 58.020 1.00 0.00 ATOM 7402 C3 POP 60 55.300 8.030 60.150 1.00 0.00 ATOM 7403 HX POP 60 55.260 8.850 60.890 1.00 0.00 ATOM 7404 HY POP 60 54.470 7.360 60.460 1.00 0.00 ATOM 7405 O31 POP 60 55.140 8.610 58.860 1.00 0.00 ATOM 7406 C31 POP 60 54.850 7.730 57.890 1.00 0.00 ATOM 7407 O32 POP 60 54.920 6.520 58.050 1.00 0.00 ATOM 7408 C32 POP 60 54.430 8.440 56.610 1.00 0.00 ATOM 7409 H2X POP 60 55.290 9.090 56.340 1.00 0.00 ATOM 7410 H2Y POP 60 53.530 9.060 56.810 1.00 0.00 ATOM 7411 C23 POP 60 60.390 6.200 58.000 1.00 0.00 ATOM 7412 H3R POP 60 59.610 5.490 57.650 1.00 0.00 ATOM 7413 H3S POP 60 60.990 5.610 58.730 1.00 0.00 ATOM 7414 C24 POP 60 61.220 6.630 56.790 1.00 0.00 ATOM 7415 H4R POP 60 61.720 5.720 56.400 1.00 0.00 ATOM 7416 H4S POP 60 61.920 7.430 57.080 1.00 0.00 ATOM 7417 C25 POP 60 60.320 7.120 55.660 1.00 0.00 ATOM 7418 H5R POP 60 59.930 8.110 55.990 1.00 0.00 ATOM 7419 H5S POP 60 59.510 6.410 55.380 1.00 0.00 ATOM 7420 C26 POP 60 61.180 7.370 54.410 1.00 0.00 ATOM 7421 H6R POP 60 62.070 7.980 54.650 1.00 0.00 ATOM 7422 H6S POP 60 60.460 7.890 53.740 1.00 0.00 ATOM 7423 C27 POP 60 61.700 6.110 53.720 1.00 0.00 ATOM 7424 H7R POP 60 60.900 5.470 53.300 1.00 0.00 ATOM 7425 H7S POP 60 62.440 5.540 54.320 1.00 0.00 ATOM 7426 C28 POP 60 62.620 6.520 52.560 1.00 0.00 ATOM 7427 H8R POP 60 63.630 6.910 52.840 1.00 0.00 ATOM 7428 H8S POP 60 62.080 7.380 52.110 1.00 0.00 ATOM 7429 C29 POP 60 62.630 5.460 51.510 1.00 0.00 ATOM 7430 H91 POP 60 61.800 4.750 51.580 1.00 0.00 ATOM 7431 0C21 POP 60 63.570 5.330 50.550 1.00 0.00 ATOM 7432 1H10 POP 60 63.590 4.460 49.880 1.00 0.00 ATOM 7433 1C21 POP 60 64.620 6.370 50.290 1.00 0.00 ATOM 7434 H11R POP 60 65.630 6.050 50.620 1.00 0.00 ATOM 7435 H11S POP 60 64.370 7.280 50.860 1.00 0.00 ATOM 7436 2C21 POP 60 64.790 6.820 48.830 1.00 0.00 ATOM 7437 H12R POP 60 63.790 7.120 48.450 1.00 0.00 ATOM 7438 H12S POP 60 65.010 5.930 48.210 1.00 0.00 ATOM 7439 3C21 POP 60 65.790 7.970 48.720 1.00 0.00 ATOM 7440 H13R POP 60 66.770 7.660 49.140 1.00 0.00 ATOM 7441 H13S POP 60 65.350 8.900 49.140 1.00 0.00 ATOM 7442 4C21 POP 60 66.150 8.310 47.270 1.00 0.00 ATOM 7443 H14R POP 60 66.810 9.200 47.340 1.00 0.00 ATOM 7444 H14S POP 60 65.250 8.620 46.690 1.00 0.00 ATOM 7445 5C21 POP 60 66.890 7.130 46.640 1.00 0.00 ATOM 7446 H15R POP 60 66.210 6.370 46.200 1.00 0.00 ATOM 7447 H15S POP 60 67.460 6.650 47.460 1.00 0.00 ATOM 7448 6C21 POP 60 67.840 7.650 45.550 1.00 0.00 ATOM 7449 H16R POP 60 68.580 6.900 45.200 1.00 0.00 ATOM 7450 H16S POP 60 68.340 8.400 46.200 1.00 0.00 ATOM 7451 7C21 POP 60 67.240 8.440 44.390 1.00 0.00 ATOM 7452 H17R POP 60 66.480 9.220 44.610 1.00 0.00 ATOM 7453 H17S POP 60 66.790 7.720 43.670 1.00 0.00 ATOM 7454 8C21 POP 60 68.410 8.880 43.510 1.00 0.00 ATOM 7455 H18R POP 60 69.100 8.010 43.390 1.00 0.00 ATOM 7456 H18S POP 60 69.050 9.650 43.990 1.00 0.00 ATOM 7457 H18T POP 60 68.110 9.160 42.480 1.00 0.00 ATOM 7458 C33 POP 60 54.130 7.320 55.610 1.00 0.00 ATOM 7459 H3X POP 60 53.450 6.520 55.970 1.00 0.00 ATOM 7460 H3Y POP 60 55.080 6.790 55.440 1.00 0.00 ATOM 7461 C34 POP 60 53.640 7.820 54.250 1.00 0.00 ATOM 7462 H4X POP 60 54.330 8.600 53.870 1.00 0.00 ATOM 7463 H4Y POP 60 52.680 8.370 54.390 1.00 0.00 ATOM 7464 C35 POP 60 53.550 6.650 53.270 1.00 0.00 ATOM 7465 H5X POP 60 53.020 5.810 53.750 1.00 0.00 ATOM 7466 H5Y POP 60 54.590 6.340 53.020 1.00 0.00 ATOM 7467 C36 POP 60 52.760 6.990 52.000 1.00 0.00 ATOM 7468 H6X POP 60 51.950 7.710 52.250 1.00 0.00 ATOM 7469 H6Y POP 60 52.290 6.030 51.700 1.00 0.00 ATOM 7470 C37 POP 60 53.730 7.530 50.960 1.00 0.00 ATOM 7471 H7X POP 60 54.510 6.770 50.730 1.00 0.00 ATOM 7472 H7Y POP 60 54.270 8.390 51.410 1.00 0.00 ATOM 7473 C38 POP 60 52.890 7.940 49.750 1.00 0.00 ATOM 7474 H8X POP 60 53.630 8.340 49.020 1.00 0.00 ATOM 7475 H8Y POP 60 52.140 8.730 49.990 1.00 0.00 ATOM 7476 C39 POP 60 52.130 6.790 49.090 1.00 0.00 ATOM 7477 H9X POP 60 51.400 6.420 49.840 1.00 0.00 ATOM 7478 H9Y POP 60 52.920 6.020 48.930 1.00 0.00 ATOM 7479 0C31 POP 60 51.480 7.220 47.770 1.00 0.00 ATOM 7480 H10X POP 60 52.260 7.640 47.110 1.00 0.00 ATOM 7481 H10Y POP 60 50.720 8.000 47.980 1.00 0.00 ATOM 7482 1C31 POP 60 50.820 6.050 47.030 1.00 0.00 ATOM 7483 H11X POP 60 50.050 5.580 47.680 1.00 0.00 ATOM 7484 H11Y POP 60 51.620 5.340 46.740 1.00 0.00 ATOM 7485 2C31 POP 60 50.160 6.520 45.730 1.00 0.00 ATOM 7486 H12X POP 60 50.940 6.780 44.990 1.00 0.00 ATOM 7487 H12Y POP 60 49.570 7.430 45.970 1.00 0.00 ATOM 7488 3C31 POP 60 49.200 5.510 45.090 1.00 0.00 ATOM 7489 H13X POP 60 48.340 5.330 45.770 1.00 0.00 ATOM 7490 H13Y POP 60 49.760 4.560 45.060 1.00 0.00 ATOM 7491 4C31 POP 60 48.670 5.920 43.710 1.00 0.00 ATOM 7492 H14X POP 60 49.510 5.920 42.980 1.00 0.00 ATOM 7493 H14Y POP 60 48.460 7.000 43.880 1.00 0.00 ATOM 7494 5C31 POP 60 47.490 5.090 43.200 1.00 0.00 ATOM 7495 H15X POP 60 47.090 5.620 42.310 1.00 0.00 ATOM 7496 H15Y POP 60 46.740 4.870 43.990 1.00 0.00 ATOM 7497 6C31 POP 60 47.820 3.680 42.700 1.00 0.00 ATOM 7498 H16X POP 60 47.200 3.160 41.940 1.00 0.00 ATOM 7499 H16Y POP 60 48.890 3.630 42.440 1.00 0.00 ATOM 7500 H16Z POP 60 47.600 3.080 43.610 1.00 0.00 ATOM 7501 N POP 61 5.610 17.360 66.400 1.00 0.00 ATOM 7502 HN1 POP 61 6.080 17.640 65.520 1.00 0.00 ATOM 7503 HN2 POP 61 6.290 16.900 67.040 1.00 0.00 ATOM 7504 HN3 POP 61 4.850 16.670 66.230 1.00 0.00 ATOM 7505 C12 POP 61 4.930 18.580 66.980 1.00 0.00 ATOM 7506 H12A POP 61 5.630 19.240 67.530 1.00 0.00 ATOM 7507 H12B POP 61 4.210 18.240 67.760 1.00 0.00 ATOM 7508 C11 POP 61 4.260 19.400 65.880 1.00 0.00 ATOM 7509 H11A POP 61 4.970 20.020 65.300 1.00 0.00 ATOM 7510 H11B POP 61 3.630 20.130 66.440 1.00 0.00 ATOM 7511 P POP 61 2.170 19.100 64.560 1.00 0.00 ATOM 7512 O13 POP 61 2.300 20.570 64.490 1.00 0.00 ATOM 7513 O14 POP 61 1.210 18.580 65.560 1.00 0.00 ATOM 7514 O11 POP 61 1.840 18.580 63.080 1.00 0.00 ATOM 7515 O12 POP 61 3.590 18.500 65.000 1.00 0.00 ATOM 7516 C1 POP 61 2.560 17.490 62.490 1.00 0.00 ATOM 7517 HA POP 61 1.940 17.180 61.610 1.00 0.00 ATOM 7518 HB POP 61 2.570 16.610 63.170 1.00 0.00 ATOM 7519 C2 POP 61 4.000 17.790 62.060 1.00 0.00 ATOM 7520 HS POP 61 4.620 17.930 62.980 1.00 0.00 ATOM 7521 O21 POP 61 3.970 18.950 61.220 1.00 0.00 ATOM 7522 C21 POP 61 4.990 19.790 61.340 1.00 0.00 ATOM 7523 O22 POP 61 5.950 19.640 62.080 1.00 0.00 ATOM 7524 C22 POP 61 4.800 21.060 60.530 1.00 0.00 ATOM 7525 H2R POP 61 4.550 21.920 61.200 1.00 0.00 ATOM 7526 H2S POP 61 3.880 20.920 59.920 1.00 0.00 ATOM 7527 C3 POP 61 4.520 16.590 61.250 1.00 0.00 ATOM 7528 HX POP 61 4.680 15.860 62.070 1.00 0.00 ATOM 7529 HY POP 61 5.480 16.830 60.750 1.00 0.00 ATOM 7530 O31 POP 61 3.650 16.000 60.290 1.00 0.00 ATOM 7531 C31 POP 61 3.400 14.690 60.220 1.00 0.00 ATOM 7532 O32 POP 61 3.820 13.900 61.040 1.00 0.00 ATOM 7533 C32 POP 61 2.570 14.230 59.030 1.00 0.00 ATOM 7534 H2X POP 61 1.940 13.470 59.540 1.00 0.00 ATOM 7535 H2Y POP 61 3.270 13.760 58.310 1.00 0.00 ATOM 7536 C23 POP 61 6.050 21.580 59.820 1.00 0.00 ATOM 7537 H3R POP 61 6.870 21.800 60.540 1.00 0.00 ATOM 7538 H3S POP 61 5.680 22.490 59.300 1.00 0.00 ATOM 7539 C24 POP 61 6.460 20.590 58.730 1.00 0.00 ATOM 7540 H4R POP 61 5.600 20.180 58.170 1.00 0.00 ATOM 7541 H4S POP 61 6.920 19.710 59.230 1.00 0.00 ATOM 7542 C25 POP 61 7.440 21.240 57.760 1.00 0.00 ATOM 7543 H5R POP 61 8.000 20.440 57.220 1.00 0.00 ATOM 7544 H5S POP 61 8.120 21.870 58.380 1.00 0.00 ATOM 7545 C26 POP 61 6.790 22.150 56.710 1.00 0.00 ATOM 7546 H6R POP 61 6.310 23.000 57.230 1.00 0.00 ATOM 7547 H6S POP 61 6.040 21.520 56.190 1.00 0.00 ATOM 7548 C27 POP 61 7.840 22.820 55.810 1.00 0.00 ATOM 7549 H7R POP 61 8.500 22.060 55.340 1.00 0.00 ATOM 7550 H7S POP 61 8.550 23.360 56.480 1.00 0.00 ATOM 7551 C28 POP 61 7.110 23.710 54.800 1.00 0.00 ATOM 7552 H8R POP 61 7.960 24.190 54.260 1.00 0.00 ATOM 7553 H8S POP 61 6.590 24.510 55.360 1.00 0.00 ATOM 7554 C29 POP 61 6.010 23.160 53.940 1.00 0.00 ATOM 7555 H91 POP 61 5.050 23.150 54.470 1.00 0.00 ATOM 7556 0C21 POP 61 6.020 22.950 52.610 1.00 0.00 ATOM 7557 1H10 POP 61 5.060 22.650 52.160 1.00 0.00 ATOM 7558 1C21 POP 61 7.220 23.110 51.720 1.00 0.00 ATOM 7559 H11R POP 61 8.080 23.470 52.330 1.00 0.00 ATOM 7560 H11S POP 61 7.160 23.900 50.940 1.00 0.00 ATOM 7561 2C21 POP 61 7.570 21.760 51.100 1.00 0.00 ATOM 7562 H12R POP 61 7.760 21.100 51.970 1.00 0.00 ATOM 7563 H12S POP 61 8.450 21.860 50.430 1.00 0.00 ATOM 7564 3C21 POP 61 6.520 21.260 50.100 1.00 0.00 ATOM 7565 H13R POP 61 5.590 21.050 50.670 1.00 0.00 ATOM 7566 H13S POP 61 6.960 20.340 49.680 1.00 0.00 ATOM 7567 4C21 POP 61 6.270 22.240 48.950 1.00 0.00 ATOM 7568 H14R POP 61 7.290 22.340 48.510 1.00 0.00 ATOM 7569 H14S POP 61 5.890 23.190 49.390 1.00 0.00 ATOM 7570 5C21 POP 61 5.160 21.640 48.090 1.00 0.00 ATOM 7571 H15R POP 61 4.160 21.850 48.520 1.00 0.00 ATOM 7572 H15S POP 61 5.150 20.530 48.020 1.00 0.00 ATOM 7573 6C21 POP 61 5.160 22.280 46.700 1.00 0.00 ATOM 7574 H16R POP 61 6.130 22.050 46.200 1.00 0.00 ATOM 7575 H16S POP 61 5.180 23.370 46.880 1.00 0.00 ATOM 7576 7C21 POP 61 3.990 21.940 45.780 1.00 0.00 ATOM 7577 H17R POP 61 3.850 22.780 45.070 1.00 0.00 ATOM 7578 H17S POP 61 3.030 21.770 46.310 1.00 0.00 ATOM 7579 8C21 POP 61 4.120 20.670 44.930 1.00 0.00 ATOM 7580 H18R POP 61 3.520 20.660 44.000 1.00 0.00 ATOM 7581 H18S POP 61 3.880 19.770 45.540 1.00 0.00 ATOM 7582 H18T POP 61 5.190 20.480 44.690 1.00 0.00 ATOM 7583 C33 POP 61 1.820 15.370 58.350 1.00 0.00 ATOM 7584 H3X POP 61 2.530 15.960 57.730 1.00 0.00 ATOM 7585 H3Y POP 61 1.440 15.960 59.220 1.00 0.00 ATOM 7586 C34 POP 61 0.590 14.850 57.600 1.00 0.00 ATOM 7587 H4X POP 61 -0.090 14.220 58.210 1.00 0.00 ATOM 7588 H4Y POP 61 0.940 14.140 56.820 1.00 0.00 ATOM 7589 C35 POP 61 -0.280 15.960 57.000 1.00 0.00 ATOM 7590 H5X POP 61 0.390 16.660 56.460 1.00 0.00 ATOM 7591 H5Y POP 61 -0.770 16.500 57.850 1.00 0.00 ATOM 7592 C36 POP 61 -1.420 15.450 56.120 1.00 0.00 ATOM 7593 H6X POP 61 -2.140 16.280 55.940 1.00 0.00 ATOM 7594 H6Y POP 61 -2.070 14.610 56.450 1.00 0.00 ATOM 7595 C37 POP 61 -1.010 14.990 54.720 1.00 0.00 ATOM 7596 H7X POP 61 -0.440 14.040 54.820 1.00 0.00 ATOM 7597 H7Y POP 61 -0.360 15.750 54.230 1.00 0.00 ATOM 7598 C38 POP 61 -2.210 14.870 53.790 1.00 0.00 ATOM 7599 H8X POP 61 -2.780 15.820 53.840 1.00 0.00 ATOM 7600 H8Y POP 61 -2.850 14.070 54.220 1.00 0.00 ATOM 7601 C39 POP 61 -1.930 14.470 52.340 1.00 0.00 ATOM 7602 H9X POP 61 -1.130 13.700 52.230 1.00 0.00 ATOM 7603 H9Y POP 61 -1.360 15.310 51.890 1.00 0.00 ATOM 7604 0C31 POP 61 -3.180 14.120 51.530 1.00 0.00 ATOM 7605 H10X POP 61 -3.830 15.020 51.390 1.00 0.00 ATOM 7606 H10Y POP 61 -3.790 13.280 51.930 1.00 0.00 ATOM 7607 1C31 POP 61 -2.800 13.660 50.130 1.00 0.00 ATOM 7608 H11X POP 61 -2.050 12.840 50.110 1.00 0.00 ATOM 7609 H11Y POP 61 -2.470 14.510 49.500 1.00 0.00 ATOM 7610 2C31 POP 61 -4.040 13.030 49.470 1.00 0.00 ATOM 7611 H12X POP 61 -4.800 13.820 49.310 1.00 0.00 ATOM 7612 H12Y POP 61 -4.530 12.170 49.970 1.00 0.00 ATOM 7613 3C31 POP 61 -3.690 12.540 48.060 1.00 0.00 ATOM 7614 H13X POP 61 -4.520 11.990 47.560 1.00 0.00 ATOM 7615 H13Y POP 61 -2.860 11.810 48.170 1.00 0.00 ATOM 7616 4C31 POP 61 -3.200 13.680 47.160 1.00 0.00 ATOM 7617 H14X POP 61 -2.150 13.950 47.380 1.00 0.00 ATOM 7618 H14Y POP 61 -3.840 14.580 47.320 1.00 0.00 ATOM 7619 5C31 POP 61 -3.220 13.350 45.670 1.00 0.00 ATOM 7620 H15X POP 61 -4.270 13.080 45.450 1.00 0.00 ATOM 7621 H15Y POP 61 -2.660 12.430 45.380 1.00 0.00 ATOM 7622 6C31 POP 61 -2.730 14.560 44.870 1.00 0.00 ATOM 7623 H16X POP 61 -1.870 14.990 45.420 1.00 0.00 ATOM 7624 H16Y POP 61 -3.510 15.330 44.680 1.00 0.00 ATOM 7625 H16Z POP 61 -2.380 14.250 43.870 1.00 0.00 ATOM 7626 N POP 62 33.830 10.030 64.720 1.00 0.00 ATOM 7627 HN1 POP 62 34.160 10.730 64.020 1.00 0.00 ATOM 7628 HN2 POP 62 34.580 9.420 65.110 1.00 0.00 ATOM 7629 HN3 POP 62 33.110 9.400 64.320 1.00 0.00 ATOM 7630 C12 POP 62 33.210 10.810 65.860 1.00 0.00 ATOM 7631 H12A POP 62 34.120 11.190 66.360 1.00 0.00 ATOM 7632 H12B POP 62 32.580 10.100 66.430 1.00 0.00 ATOM 7633 C11 POP 62 32.320 11.970 65.400 1.00 0.00 ATOM 7634 H11A POP 62 32.950 12.750 64.920 1.00 0.00 ATOM 7635 H11B POP 62 31.920 12.320 66.380 1.00 0.00 ATOM 7636 P POP 62 30.180 12.410 64.230 1.00 0.00 ATOM 7637 O13 POP 62 30.650 13.300 63.150 1.00 0.00 ATOM 7638 O14 POP 62 29.760 13.090 65.480 1.00 0.00 ATOM 7639 O11 POP 62 28.940 11.540 63.720 1.00 0.00 ATOM 7640 O12 POP 62 31.380 11.390 64.490 1.00 0.00 ATOM 7641 C1 POP 62 29.160 10.190 63.310 1.00 0.00 ATOM 7642 HA POP 62 28.210 9.620 63.370 1.00 0.00 ATOM 7643 HB POP 62 29.760 9.610 64.040 1.00 0.00 ATOM 7644 C2 POP 62 29.690 10.080 61.870 1.00 0.00 ATOM 7645 HS POP 62 30.570 10.770 61.820 1.00 0.00 ATOM 7646 O21 POP 62 28.660 10.640 61.050 1.00 0.00 ATOM 7647 C21 POP 62 29.070 11.370 60.020 1.00 0.00 ATOM 7648 O22 POP 62 30.240 11.520 59.710 1.00 0.00 ATOM 7649 C22 POP 62 27.880 11.780 59.160 1.00 0.00 ATOM 7650 H2R POP 62 27.130 12.460 59.620 1.00 0.00 ATOM 7651 H2S POP 62 27.370 10.820 58.920 1.00 0.00 ATOM 7652 C3 POP 62 30.070 8.670 61.390 1.00 0.00 ATOM 7653 HX POP 62 29.260 8.020 61.790 1.00 0.00 ATOM 7654 HY POP 62 30.990 8.300 61.900 1.00 0.00 ATOM 7655 O31 POP 62 30.020 8.500 59.970 1.00 0.00 ATOM 7656 C31 POP 62 31.200 8.690 59.370 1.00 0.00 ATOM 7657 O32 POP 62 32.250 8.920 59.940 1.00 0.00 ATOM 7658 C32 POP 62 31.000 8.770 57.860 1.00 0.00 ATOM 7659 H2X POP 62 30.190 9.450 57.500 1.00 0.00 ATOM 7660 H2Y POP 62 30.760 7.740 57.520 1.00 0.00 ATOM 7661 C23 POP 62 28.260 12.360 57.800 1.00 0.00 ATOM 7662 H3R POP 62 29.020 11.670 57.380 1.00 0.00 ATOM 7663 H3S POP 62 28.680 13.370 57.990 1.00 0.00 ATOM 7664 C24 POP 62 27.080 12.530 56.850 1.00 0.00 ATOM 7665 H4R POP 62 26.410 13.280 57.320 1.00 0.00 ATOM 7666 H4S POP 62 26.580 11.540 56.770 1.00 0.00 ATOM 7667 C25 POP 62 27.500 13.070 55.480 1.00 0.00 ATOM 7668 H5R POP 62 28.010 14.010 55.760 1.00 0.00 ATOM 7669 H5S POP 62 26.620 13.350 54.860 1.00 0.00 ATOM 7670 C26 POP 62 28.610 12.380 54.680 1.00 0.00 ATOM 7671 H6R POP 62 28.560 11.290 54.890 1.00 0.00 ATOM 7672 H6S POP 62 29.530 12.620 55.260 1.00 0.00 ATOM 7673 C27 POP 62 28.710 12.800 53.210 1.00 0.00 ATOM 7674 H7R POP 62 29.700 12.510 52.800 1.00 0.00 ATOM 7675 H7S POP 62 28.580 13.900 53.290 1.00 0.00 ATOM 7676 C28 POP 62 27.580 12.400 52.260 1.00 0.00 ATOM 7677 H8R POP 62 27.750 12.840 51.250 1.00 0.00 ATOM 7678 H8S POP 62 26.590 12.740 52.650 1.00 0.00 ATOM 7679 C29 POP 62 27.600 10.900 52.200 1.00 0.00 ATOM 7680 H91 POP 62 27.420 10.410 53.170 1.00 0.00 ATOM 7681 0C21 POP 62 27.870 10.170 51.110 1.00 0.00 ATOM 7682 1H10 POP 62 27.960 9.090 51.280 1.00 0.00 ATOM 7683 1C21 POP 62 28.220 10.770 49.780 1.00 0.00 ATOM 7684 H11R POP 62 29.070 11.480 49.840 1.00 0.00 ATOM 7685 H11S POP 62 27.380 11.400 49.420 1.00 0.00 ATOM 7686 2C21 POP 62 28.390 9.630 48.770 1.00 0.00 ATOM 7687 H12R POP 62 27.470 9.010 48.840 1.00 0.00 ATOM 7688 H12S POP 62 29.180 8.900 49.050 1.00 0.00 ATOM 7689 3C21 POP 62 28.510 9.900 47.270 1.00 0.00 ATOM 7690 H13R POP 62 28.380 8.980 46.660 1.00 0.00 ATOM 7691 H13S POP 62 29.550 10.250 47.100 1.00 0.00 ATOM 7692 4C21 POP 62 27.520 10.880 46.640 1.00 0.00 ATOM 7693 H14R POP 62 27.450 11.720 47.370 1.00 0.00 ATOM 7694 H14S POP 62 26.530 10.400 46.480 1.00 0.00 ATOM 7695 5C21 POP 62 28.000 11.430 45.300 1.00 0.00 ATOM 7696 H15R POP 62 28.040 10.660 44.500 1.00 0.00 ATOM 7697 H15S POP 62 28.950 11.980 45.450 1.00 0.00 ATOM 7698 6C21 POP 62 26.990 12.460 44.770 1.00 0.00 ATOM 7699 H16R POP 62 27.350 12.860 43.800 1.00 0.00 ATOM 7700 H16S POP 62 26.930 13.280 45.510 1.00 0.00 ATOM 7701 7C21 POP 62 25.570 11.960 44.480 1.00 0.00 ATOM 7702 H17R POP 62 24.970 12.790 44.050 1.00 0.00 ATOM 7703 H17S POP 62 25.070 11.620 45.410 1.00 0.00 ATOM 7704 8C21 POP 62 25.460 10.880 43.410 1.00 0.00 ATOM 7705 H18R POP 62 26.020 9.990 43.750 1.00 0.00 ATOM 7706 H18S POP 62 25.940 11.250 42.470 1.00 0.00 ATOM 7707 H18T POP 62 24.410 10.610 43.170 1.00 0.00 ATOM 7708 C33 POP 62 32.360 9.260 57.370 1.00 0.00 ATOM 7709 H3X POP 62 33.080 8.420 57.480 1.00 0.00 ATOM 7710 H3Y POP 62 32.820 10.120 57.910 1.00 0.00 ATOM 7711 C34 POP 62 32.450 9.480 55.860 1.00 0.00 ATOM 7712 H4X POP 62 32.000 8.660 55.250 1.00 0.00 ATOM 7713 H4Y POP 62 33.520 9.500 55.570 1.00 0.00 ATOM 7714 C35 POP 62 31.750 10.730 55.330 1.00 0.00 ATOM 7715 H5X POP 62 32.110 11.570 55.970 1.00 0.00 ATOM 7716 H5Y POP 62 30.650 10.570 55.340 1.00 0.00 ATOM 7717 C36 POP 62 32.270 11.140 53.960 1.00 0.00 ATOM 7718 H6X POP 62 33.330 11.450 54.120 1.00 0.00 ATOM 7719 H6Y POP 62 31.670 11.950 53.480 1.00 0.00 ATOM 7720 C37 POP 62 32.220 9.980 52.960 1.00 0.00 ATOM 7721 H7X POP 62 31.210 9.530 53.110 1.00 0.00 ATOM 7722 H7Y POP 62 33.100 9.340 53.190 1.00 0.00 ATOM 7723 C38 POP 62 32.370 10.480 51.530 1.00 0.00 ATOM 7724 H8X POP 62 33.260 11.140 51.540 1.00 0.00 ATOM 7725 H8Y POP 62 31.490 11.130 51.300 1.00 0.00 ATOM 7726 C39 POP 62 32.450 9.350 50.490 1.00 0.00 ATOM 7727 H9X POP 62 31.700 8.550 50.670 1.00 0.00 ATOM 7728 H9Y POP 62 33.480 8.950 50.610 1.00 0.00 ATOM 7729 0C31 POP 62 32.270 9.790 49.040 1.00 0.00 ATOM 7730 H10X POP 62 31.300 10.230 48.750 1.00 0.00 ATOM 7731 H10Y POP 62 32.410 8.930 48.350 1.00 0.00 ATOM 7732 1C31 POP 62 33.320 10.780 48.520 1.00 0.00 ATOM 7733 H11X POP 62 34.270 10.370 48.950 1.00 0.00 ATOM 7734 H11Y POP 62 33.180 11.850 48.770 1.00 0.00 ATOM 7735 2C31 POP 62 33.330 10.660 47.000 1.00 0.00 ATOM 7736 H12X POP 62 32.280 10.580 46.640 1.00 0.00 ATOM 7737 H12Y POP 62 33.850 9.710 46.770 1.00 0.00 ATOM 7738 3C31 POP 62 34.090 11.710 46.180 1.00 0.00 ATOM 7739 H13X POP 62 34.160 11.300 45.160 1.00 0.00 ATOM 7740 H13Y POP 62 35.150 11.830 46.490 1.00 0.00 ATOM 7741 4C31 POP 62 33.430 13.080 45.990 1.00 0.00 ATOM 7742 H14X POP 62 32.330 13.020 46.160 1.00 0.00 ATOM 7743 H14Y POP 62 33.690 13.360 44.950 1.00 0.00 ATOM 7744 5C31 POP 62 34.040 14.200 46.830 1.00 0.00 ATOM 7745 H15X POP 62 35.140 14.210 46.950 1.00 0.00 ATOM 7746 H15Y POP 62 33.570 14.060 47.820 1.00 0.00 ATOM 7747 6C31 POP 62 33.680 15.550 46.210 1.00 0.00 ATOM 7748 H16X POP 62 32.600 15.620 45.950 1.00 0.00 ATOM 7749 H16Y POP 62 34.240 15.730 45.260 1.00 0.00 ATOM 7750 H16Z POP 62 33.860 16.360 46.940 1.00 0.00 ATOM 7751 N POP 63 4.990 51.630 64.720 1.00 0.00 ATOM 7752 HN1 POP 63 4.630 51.990 65.630 1.00 0.00 ATOM 7753 HN2 POP 63 5.430 52.440 64.240 1.00 0.00 ATOM 7754 HN3 POP 63 4.180 51.280 64.170 1.00 0.00 ATOM 7755 C12 POP 63 5.970 50.590 65.180 1.00 0.00 ATOM 7756 H12A POP 63 5.420 49.790 65.720 1.00 0.00 ATOM 7757 H12B POP 63 6.650 51.080 65.910 1.00 0.00 ATOM 7758 C11 POP 63 6.800 49.940 64.070 1.00 0.00 ATOM 7759 H11A POP 63 6.130 49.480 63.310 1.00 0.00 ATOM 7760 H11B POP 63 7.450 49.090 64.370 1.00 0.00 ATOM 7761 P POP 63 8.700 50.480 62.530 1.00 0.00 ATOM 7762 O13 POP 63 9.260 49.230 63.090 1.00 0.00 ATOM 7763 O14 POP 63 9.690 51.550 62.290 1.00 0.00 ATOM 7764 O11 POP 63 7.830 50.040 61.260 1.00 0.00 ATOM 7765 O12 POP 63 7.630 51.010 63.600 1.00 0.00 ATOM 7766 C1 POP 63 6.720 50.840 60.850 1.00 0.00 ATOM 7767 HA POP 63 6.690 51.740 61.490 1.00 0.00 ATOM 7768 HB POP 63 5.770 50.310 61.080 1.00 0.00 ATOM 7769 C2 POP 63 6.770 51.370 59.400 1.00 0.00 ATOM 7770 HS POP 63 6.530 50.510 58.740 1.00 0.00 ATOM 7771 O21 POP 63 8.040 51.990 59.150 1.00 0.00 ATOM 7772 C21 POP 63 8.380 51.650 57.910 1.00 0.00 ATOM 7773 O22 POP 63 7.650 51.120 57.100 1.00 0.00 ATOM 7774 C22 POP 63 9.840 52.000 57.620 1.00 0.00 ATOM 7775 H2R POP 63 10.460 51.230 58.120 1.00 0.00 ATOM 7776 H2S POP 63 10.010 53.020 58.010 1.00 0.00 ATOM 7777 C3 POP 63 5.690 52.440 59.200 1.00 0.00 ATOM 7778 HX POP 63 5.620 53.150 60.060 1.00 0.00 ATOM 7779 HY POP 63 4.760 51.860 59.060 1.00 0.00 ATOM 7780 O31 POP 63 5.870 53.200 58.000 1.00 0.00 ATOM 7781 C31 POP 63 6.300 54.450 58.210 1.00 0.00 ATOM 7782 O32 POP 63 6.830 54.920 59.200 1.00 0.00 ATOM 7783 C32 POP 63 5.890 55.330 57.030 1.00 0.00 ATOM 7784 H2X POP 63 5.960 56.350 57.480 1.00 0.00 ATOM 7785 H2Y POP 63 4.920 55.240 56.510 1.00 0.00 ATOM 7786 C23 POP 63 10.220 52.050 56.140 1.00 0.00 ATOM 7787 H3R POP 63 9.550 52.800 55.680 1.00 0.00 ATOM 7788 H3S POP 63 10.110 51.020 55.730 1.00 0.00 ATOM 7789 C24 POP 63 11.710 52.410 56.030 1.00 0.00 ATOM 7790 H4R POP 63 12.170 51.960 56.930 1.00 0.00 ATOM 7791 H4S POP 63 11.930 53.490 56.210 1.00 0.00 ATOM 7792 C25 POP 63 12.450 52.040 54.750 1.00 0.00 ATOM 7793 H5R POP 63 13.530 52.270 54.840 1.00 0.00 ATOM 7794 H5S POP 63 12.110 52.580 53.840 1.00 0.00 ATOM 7795 C26 POP 63 12.550 50.550 54.400 1.00 0.00 ATOM 7796 H6R POP 63 11.600 50.100 54.030 1.00 0.00 ATOM 7797 H6S POP 63 12.780 49.970 55.320 1.00 0.00 ATOM 7798 C27 POP 63 13.690 50.170 53.450 1.00 0.00 ATOM 7799 H7R POP 63 13.640 49.090 53.220 1.00 0.00 ATOM 7800 H7S POP 63 14.690 50.420 53.870 1.00 0.00 ATOM 7801 C28 POP 63 13.730 50.900 52.110 1.00 0.00 ATOM 7802 H8R POP 63 13.940 51.910 52.520 1.00 0.00 ATOM 7803 H8S POP 63 12.840 50.870 51.440 1.00 0.00 ATOM 7804 C29 POP 63 15.060 50.430 51.580 1.00 0.00 ATOM 7805 H91 POP 63 15.920 51.090 51.750 1.00 0.00 ATOM 7806 0C21 POP 63 15.380 49.280 50.970 1.00 0.00 ATOM 7807 1H10 POP 63 16.360 49.030 50.550 1.00 0.00 ATOM 7808 1C21 POP 63 14.400 48.250 50.470 1.00 0.00 ATOM 7809 H11R POP 63 13.850 48.740 49.640 1.00 0.00 ATOM 7810 H11S POP 63 13.800 48.090 51.390 1.00 0.00 ATOM 7811 2C21 POP 63 14.950 46.920 49.950 1.00 0.00 ATOM 7812 H12R POP 63 15.740 46.410 50.530 1.00 0.00 ATOM 7813 H12S POP 63 15.410 47.050 48.950 1.00 0.00 ATOM 7814 3C21 POP 63 13.850 45.880 49.770 1.00 0.00 ATOM 7815 H13R POP 63 13.110 46.410 49.130 1.00 0.00 ATOM 7816 H13S POP 63 13.400 45.520 50.720 1.00 0.00 ATOM 7817 4C21 POP 63 14.300 44.660 48.960 1.00 0.00 ATOM 7818 H14R POP 63 15.120 44.300 49.610 1.00 0.00 ATOM 7819 H14S POP 63 14.720 45.000 47.980 1.00 0.00 ATOM 7820 5C21 POP 63 13.280 43.600 48.550 1.00 0.00 ATOM 7821 H15R POP 63 12.340 44.080 48.210 1.00 0.00 ATOM 7822 H15S POP 63 12.950 42.880 49.330 1.00 0.00 ATOM 7823 6C21 POP 63 13.690 42.810 47.300 1.00 0.00 ATOM 7824 H16R POP 63 14.490 42.110 47.620 1.00 0.00 ATOM 7825 H16S POP 63 13.830 43.410 46.380 1.00 0.00 ATOM 7826 7C21 POP 63 12.450 42.000 46.910 1.00 0.00 ATOM 7827 H17R POP 63 11.670 42.720 46.560 1.00 0.00 ATOM 7828 H17S POP 63 12.140 41.450 47.820 1.00 0.00 ATOM 7829 8C21 POP 63 12.810 41.100 45.740 1.00 0.00 ATOM 7830 H18R POP 63 13.850 40.710 45.720 1.00 0.00 ATOM 7831 H18S POP 63 12.610 41.700 44.830 1.00 0.00 ATOM 7832 H18T POP 63 12.180 40.180 45.720 1.00 0.00 ATOM 7833 C33 POP 63 6.950 55.330 55.920 1.00 0.00 ATOM 7834 H3X POP 63 6.800 54.500 55.200 1.00 0.00 ATOM 7835 H3Y POP 63 7.920 55.290 56.460 1.00 0.00 ATOM 7836 C34 POP 63 7.120 56.560 55.040 1.00 0.00 ATOM 7837 H4X POP 63 7.270 57.440 55.700 1.00 0.00 ATOM 7838 H4Y POP 63 6.140 56.610 54.520 1.00 0.00 ATOM 7839 C35 POP 63 8.330 56.590 54.100 1.00 0.00 ATOM 7840 H5X POP 63 8.370 57.610 53.650 1.00 0.00 ATOM 7841 H5Y POP 63 8.050 55.800 53.370 1.00 0.00 ATOM 7842 C36 POP 63 9.660 56.320 54.800 1.00 0.00 ATOM 7843 H6X POP 63 9.630 55.230 55.010 1.00 0.00 ATOM 7844 H6Y POP 63 9.660 56.740 55.820 1.00 0.00 ATOM 7845 C37 POP 63 10.860 56.640 53.910 1.00 0.00 ATOM 7846 H7X POP 63 11.740 56.410 54.540 1.00 0.00 ATOM 7847 H7Y POP 63 10.900 57.740 53.730 1.00 0.00 ATOM 7848 C38 POP 63 10.850 55.840 52.610 1.00 0.00 ATOM 7849 H8X POP 63 9.930 56.060 52.020 1.00 0.00 ATOM 7850 H8Y POP 63 10.860 54.750 52.840 1.00 0.00 ATOM 7851 C39 POP 63 12.090 56.090 51.730 1.00 0.00 ATOM 7852 H9X POP 63 12.020 55.360 50.900 1.00 0.00 ATOM 7853 H9Y POP 63 12.960 55.760 52.330 1.00 0.00 ATOM 7854 0C31 POP 63 12.310 57.510 51.210 1.00 0.00 ATOM 7855 H10X POP 63 12.100 58.310 51.950 1.00 0.00 ATOM 7856 H10Y POP 63 11.740 57.750 50.290 1.00 0.00 ATOM 7857 1C31 POP 63 13.750 57.790 50.770 1.00 0.00 ATOM 7858 H11X POP 63 13.910 58.740 50.220 1.00 0.00 ATOM 7859 H11Y POP 63 14.010 56.930 50.130 1.00 0.00 ATOM 7860 2C31 POP 63 14.740 57.760 51.930 1.00 0.00 ATOM 7861 H12X POP 63 15.660 58.080 51.400 1.00 0.00 ATOM 7862 H12Y POP 63 14.930 56.810 52.470 1.00 0.00 ATOM 7863 3C31 POP 63 14.480 58.810 53.020 1.00 0.00 ATOM 7864 H13X POP 63 13.600 58.550 53.650 1.00 0.00 ATOM 7865 H13Y POP 63 14.240 59.760 52.510 1.00 0.00 ATOM 7866 4C31 POP 63 15.720 59.130 53.850 1.00 0.00 ATOM 7867 H14X POP 63 16.450 59.470 53.090 1.00 0.00 ATOM 7868 H14Y POP 63 16.140 58.180 54.260 1.00 0.00 ATOM 7869 5C31 POP 63 15.530 60.270 54.860 1.00 0.00 ATOM 7870 H15X POP 63 15.120 61.170 54.350 1.00 0.00 ATOM 7871 H15Y POP 63 16.550 60.450 55.250 1.00 0.00 ATOM 7872 6C31 POP 63 14.650 59.880 56.050 1.00 0.00 ATOM 7873 H16X POP 63 13.770 59.300 55.690 1.00 0.00 ATOM 7874 H16Y POP 63 14.300 60.790 56.580 1.00 0.00 ATOM 7875 H16Z POP 63 15.230 59.270 56.770 1.00 0.00 ATOM 7876 N POP 64 18.380 52.050 63.200 1.00 0.00 ATOM 7877 HN1 POP 64 17.350 52.170 63.190 1.00 0.00 ATOM 7878 HN2 POP 64 18.530 51.120 62.760 1.00 0.00 ATOM 7879 HN3 POP 64 18.780 51.980 64.160 1.00 0.00 ATOM 7880 C12 POP 64 19.120 53.020 62.310 1.00 0.00 ATOM 7881 H12A POP 64 18.980 52.690 61.260 1.00 0.00 ATOM 7882 H12B POP 64 20.210 52.840 62.440 1.00 0.00 ATOM 7883 C11 POP 64 18.760 54.480 62.600 1.00 0.00 ATOM 7884 H11A POP 64 19.180 55.100 61.770 1.00 0.00 ATOM 7885 H11B POP 64 19.120 54.780 63.600 1.00 0.00 ATOM 7886 P POP 64 16.870 56.040 63.010 1.00 0.00 ATOM 7887 O13 POP 64 17.040 56.240 64.470 1.00 0.00 ATOM 7888 O14 POP 64 15.470 56.240 62.600 1.00 0.00 ATOM 7889 O11 POP 64 17.830 57.060 62.240 1.00 0.00 ATOM 7890 O12 POP 64 17.340 54.570 62.580 1.00 0.00 ATOM 7891 C1 POP 64 17.370 57.580 60.990 1.00 0.00 ATOM 7892 HA POP 64 18.060 58.380 60.660 1.00 0.00 ATOM 7893 HB POP 64 16.350 57.980 61.190 1.00 0.00 ATOM 7894 C2 POP 64 17.290 56.560 59.840 1.00 0.00 ATOM 7895 HS POP 64 16.710 55.680 60.180 1.00 0.00 ATOM 7896 O21 POP 64 18.580 56.290 59.290 1.00 0.00 ATOM 7897 C21 POP 64 18.840 55.010 58.990 1.00 0.00 ATOM 7898 O22 POP 64 18.100 54.060 59.160 1.00 0.00 ATOM 7899 C22 POP 64 20.170 54.860 58.250 1.00 0.00 ATOM 7900 H2R POP 64 20.970 55.460 58.730 1.00 0.00 ATOM 7901 H2S POP 64 19.970 55.250 57.230 1.00 0.00 ATOM 7902 C3 POP 64 16.420 57.200 58.750 1.00 0.00 ATOM 7903 HX POP 64 16.940 58.130 58.420 1.00 0.00 ATOM 7904 HY POP 64 15.430 57.510 59.170 1.00 0.00 ATOM 7905 O31 POP 64 16.350 56.440 57.540 1.00 0.00 ATOM 7906 C31 POP 64 15.200 55.790 57.360 1.00 0.00 ATOM 7907 O32 POP 64 14.240 55.760 58.120 1.00 0.00 ATOM 7908 C32 POP 64 15.270 55.200 55.950 1.00 0.00 ATOM 7909 H2X POP 64 14.800 55.820 55.160 1.00 0.00 ATOM 7910 H2Y POP 64 14.740 54.230 55.960 1.00 0.00 ATOM 7911 C23 POP 64 20.560 53.390 58.120 1.00 0.00 ATOM 7912 H3R POP 64 19.710 52.820 57.700 1.00 0.00 ATOM 7913 H3S POP 64 20.890 53.000 59.110 1.00 0.00 ATOM 7914 C24 POP 64 21.770 53.130 57.230 1.00 0.00 ATOM 7915 H4R POP 64 21.860 52.020 57.180 1.00 0.00 ATOM 7916 H4S POP 64 22.670 53.620 57.660 1.00 0.00 ATOM 7917 C25 POP 64 21.580 53.610 55.790 1.00 0.00 ATOM 7918 H5R POP 64 21.360 54.700 55.700 1.00 0.00 ATOM 7919 H5S POP 64 20.680 53.060 55.460 1.00 0.00 ATOM 7920 C26 POP 64 22.730 53.210 54.860 1.00 0.00 ATOM 7921 H6R POP 64 22.840 52.110 54.980 1.00 0.00 ATOM 7922 H6S POP 64 23.700 53.640 55.190 1.00 0.00 ATOM 7923 C27 POP 64 22.310 53.590 53.430 1.00 0.00 ATOM 7924 H7R POP 64 21.620 54.460 53.500 1.00 0.00 ATOM 7925 H7S POP 64 21.660 52.750 53.110 1.00 0.00 ATOM 7926 C28 POP 64 23.410 53.850 52.400 1.00 0.00 ATOM 7927 H8R POP 64 24.170 54.480 52.910 1.00 0.00 ATOM 7928 H8S POP 64 22.790 54.410 51.660 1.00 0.00 ATOM 7929 C29 POP 64 23.940 52.650 51.670 1.00 0.00 ATOM 7930 H91 POP 64 23.860 51.670 52.170 1.00 0.00 ATOM 7931 0C21 POP 64 24.460 52.640 50.440 1.00 0.00 ATOM 7932 1H10 POP 64 24.610 51.670 49.940 1.00 0.00 ATOM 7933 1C21 POP 64 24.670 53.820 49.540 1.00 0.00 ATOM 7934 H11R POP 64 25.690 53.790 49.090 1.00 0.00 ATOM 7935 H11S POP 64 24.590 54.720 50.180 1.00 0.00 ATOM 7936 2C21 POP 64 23.550 53.930 48.510 1.00 0.00 ATOM 7937 H12R POP 64 23.440 54.930 48.050 1.00 0.00 ATOM 7938 H12S POP 64 22.540 53.620 48.860 1.00 0.00 ATOM 7939 3C21 POP 64 23.840 53.070 47.270 1.00 0.00 ATOM 7940 H13R POP 64 24.000 52.050 47.700 1.00 0.00 ATOM 7941 H13S POP 64 24.800 53.480 46.880 1.00 0.00 ATOM 7942 4C21 POP 64 22.740 52.980 46.220 1.00 0.00 ATOM 7943 H14R POP 64 21.850 52.450 46.620 1.00 0.00 ATOM 7944 H14S POP 64 23.120 52.380 45.370 1.00 0.00 ATOM 7945 5C21 POP 64 22.250 54.300 45.630 1.00 0.00 ATOM 7946 H15R POP 64 21.370 54.140 44.960 1.00 0.00 ATOM 7947 H15S POP 64 21.890 54.880 46.500 1.00 0.00 ATOM 7948 6C21 POP 64 23.270 54.970 44.710 1.00 0.00 ATOM 7949 H16R POP 64 23.510 54.260 43.890 1.00 0.00 ATOM 7950 H16S POP 64 24.260 54.890 45.220 1.00 0.00 ATOM 7951 7C21 POP 64 22.920 56.400 44.290 1.00 0.00 ATOM 7952 H17R POP 64 22.830 56.980 45.230 1.00 0.00 ATOM 7953 H17S POP 64 21.870 56.400 43.920 1.00 0.00 ATOM 7954 8C21 POP 64 23.830 57.130 43.310 1.00 0.00 ATOM 7955 H18R POP 64 23.300 58.040 42.940 1.00 0.00 ATOM 7956 H18S POP 64 23.950 56.410 42.480 1.00 0.00 ATOM 7957 H18T POP 64 24.840 57.440 43.650 1.00 0.00 ATOM 7958 C33 POP 64 16.720 55.060 55.490 1.00 0.00 ATOM 7959 H3X POP 64 17.370 54.600 56.270 1.00 0.00 ATOM 7960 H3Y POP 64 17.080 56.090 55.300 1.00 0.00 ATOM 7961 C34 POP 64 16.780 54.320 54.140 1.00 0.00 ATOM 7962 H4X POP 64 15.970 54.600 53.440 1.00 0.00 ATOM 7963 H4Y POP 64 16.710 53.240 54.380 1.00 0.00 ATOM 7964 C35 POP 64 18.070 54.590 53.350 1.00 0.00 ATOM 7965 H5X POP 64 18.940 54.170 53.900 1.00 0.00 ATOM 7966 H5Y POP 64 18.280 55.670 53.230 1.00 0.00 ATOM 7967 C36 POP 64 18.100 54.000 51.940 1.00 0.00 ATOM 7968 H6X POP 64 17.630 53.000 51.910 1.00 0.00 ATOM 7969 H6Y POP 64 19.120 53.770 51.590 1.00 0.00 ATOM 7970 C37 POP 64 17.280 54.820 50.940 1.00 0.00 ATOM 7971 H7X POP 64 17.600 55.860 50.730 1.00 0.00 ATOM 7972 H7Y POP 64 16.250 54.810 51.360 1.00 0.00 ATOM 7973 C38 POP 64 17.180 54.140 49.580 1.00 0.00 ATOM 7974 H8X POP 64 18.100 53.800 49.070 1.00 0.00 ATOM 7975 H8Y POP 64 16.720 54.960 48.980 1.00 0.00 ATOM 7976 C39 POP 64 16.160 52.990 49.510 1.00 0.00 ATOM 7977 H9X POP 64 15.260 53.090 50.150 1.00 0.00 ATOM 7978 H9Y POP 64 16.720 52.120 49.930 1.00 0.00 ATOM 7979 0C31 POP 64 15.700 52.760 48.070 1.00 0.00 ATOM 7980 H10X POP 64 16.550 52.660 47.370 1.00 0.00 ATOM 7981 H10Y POP 64 15.010 53.580 47.790 1.00 0.00 ATOM 7982 1C31 POP 64 15.100 51.380 47.790 1.00 0.00 ATOM 7983 H11X POP 64 14.640 50.970 48.720 1.00 0.00 ATOM 7984 H11Y POP 64 15.970 50.740 47.540 1.00 0.00 ATOM 7985 2C31 POP 64 14.220 51.270 46.540 1.00 0.00 ATOM 7986 H12X POP 64 13.500 52.120 46.560 1.00 0.00 ATOM 7987 H12Y POP 64 14.790 51.350 45.590 1.00 0.00 ATOM 7988 3C31 POP 64 13.310 50.050 46.480 1.00 0.00 ATOM 7989 H13X POP 64 12.720 50.080 45.540 1.00 0.00 ATOM 7990 H13Y POP 64 12.640 50.100 47.360 1.00 0.00 ATOM 7991 4C31 POP 64 14.100 48.740 46.360 1.00 0.00 ATOM 7992 H14X POP 64 13.330 47.960 46.190 1.00 0.00 ATOM 7993 H14Y POP 64 14.710 48.530 47.260 1.00 0.00 ATOM 7994 5C31 POP 64 15.040 48.570 45.170 1.00 0.00 ATOM 7995 H15X POP 64 15.920 49.230 45.300 1.00 0.00 ATOM 7996 H15Y POP 64 14.330 48.740 44.330 1.00 0.00 ATOM 7997 6C31 POP 64 15.530 47.130 45.060 1.00 0.00 ATOM 7998 H16X POP 64 16.310 46.850 45.800 1.00 0.00 ATOM 7999 H16Y POP 64 16.040 46.960 44.080 1.00 0.00 ATOM 8000 H16Z POP 64 14.690 46.420 45.210 1.00 0.00 ATOM 8001 N POP 65 1.740 50.840 20.030 1.00 0.00 ATOM 8002 HN1 POP 65 2.470 51.580 19.990 1.00 0.00 ATOM 8003 HN2 POP 65 2.230 50.010 19.620 1.00 0.00 ATOM 8004 HN3 POP 65 0.830 51.030 19.570 1.00 0.00 ATOM 8005 C12 POP 65 1.650 50.620 21.520 1.00 0.00 ATOM 8006 H12A POP 65 2.640 50.280 21.920 1.00 0.00 ATOM 8007 H12B POP 65 0.890 49.840 21.720 1.00 0.00 ATOM 8008 C11 POP 65 1.220 51.970 22.080 1.00 0.00 ATOM 8009 H11A POP 65 0.900 51.820 23.130 1.00 0.00 ATOM 8010 H11B POP 65 0.270 52.300 21.590 1.00 0.00 ATOM 8011 P POP 65 1.860 54.310 22.690 1.00 0.00 ATOM 8012 O13 POP 65 0.420 54.530 22.390 1.00 0.00 ATOM 8013 O14 POP 65 2.870 55.370 22.460 1.00 0.00 ATOM 8014 O11 POP 65 1.810 53.810 24.200 1.00 0.00 ATOM 8015 O12 POP 65 2.240 52.960 21.930 1.00 0.00 ATOM 8016 C1 POP 65 3.020 53.220 24.700 1.00 0.00 ATOM 8017 HA POP 65 3.650 54.080 24.990 1.00 0.00 ATOM 8018 HB POP 65 3.530 52.670 23.880 1.00 0.00 ATOM 8019 C2 POP 65 2.810 52.080 25.710 1.00 0.00 ATOM 8020 HS POP 65 2.410 51.270 25.060 1.00 0.00 ATOM 8021 O21 POP 65 1.890 52.480 26.730 1.00 0.00 ATOM 8022 C21 POP 65 0.620 52.100 26.550 1.00 0.00 ATOM 8023 O22 POP 65 0.220 51.390 25.650 1.00 0.00 ATOM 8024 C22 POP 65 -0.190 52.920 27.540 1.00 0.00 ATOM 8025 H2R POP 65 -1.240 52.830 27.180 1.00 0.00 ATOM 8026 H2S POP 65 0.190 53.960 27.480 1.00 0.00 ATOM 8027 C3 POP 65 4.120 51.560 26.330 1.00 0.00 ATOM 8028 HX POP 65 4.510 50.910 25.520 1.00 0.00 ATOM 8029 HY POP 65 4.030 50.860 27.190 1.00 0.00 ATOM 8030 O31 POP 65 5.090 52.560 26.680 1.00 0.00 ATOM 8031 C31 POP 65 6.370 52.230 26.540 1.00 0.00 ATOM 8032 O32 POP 65 6.800 51.180 26.080 1.00 0.00 ATOM 8033 C32 POP 65 7.220 53.380 27.060 1.00 0.00 ATOM 8034 H2X POP 65 6.650 54.330 26.920 1.00 0.00 ATOM 8035 H2Y POP 65 8.210 53.310 26.560 1.00 0.00 ATOM 8036 C23 POP 65 0.060 52.450 28.980 1.00 0.00 ATOM 8037 H3R POP 65 1.170 52.360 29.060 1.00 0.00 ATOM 8038 H3S POP 65 -0.420 51.460 29.090 1.00 0.00 ATOM 8039 C24 POP 65 -0.350 53.480 30.030 1.00 0.00 ATOM 8040 H4R POP 65 -1.450 53.590 30.130 1.00 0.00 ATOM 8041 H4S POP 65 -0.010 54.510 29.790 1.00 0.00 ATOM 8042 C25 POP 65 0.240 53.080 31.380 1.00 0.00 ATOM 8043 H5R POP 65 0.650 54.000 31.840 1.00 0.00 ATOM 8044 H5S POP 65 1.110 52.390 31.340 1.00 0.00 ATOM 8045 C26 POP 65 -0.800 52.490 32.340 1.00 0.00 ATOM 8046 H6R POP 65 -1.190 51.530 31.930 1.00 0.00 ATOM 8047 H6S POP 65 -1.690 53.120 32.540 1.00 0.00 ATOM 8048 C27 POP 65 -0.000 52.170 33.600 1.00 0.00 ATOM 8049 H7R POP 65 0.350 53.140 34.030 1.00 0.00 ATOM 8050 H7S POP 65 0.930 51.620 33.350 1.00 0.00 ATOM 8051 C28 POP 65 -0.780 51.430 34.680 1.00 0.00 ATOM 8052 H8R POP 65 -0.080 51.190 35.510 1.00 0.00 ATOM 8053 H8S POP 65 -1.130 50.430 34.330 1.00 0.00 ATOM 8054 C29 POP 65 -1.820 52.350 35.260 1.00 0.00 ATOM 8055 H91 POP 65 -2.110 53.280 34.750 1.00 0.00 ATOM 8056 0C21 POP 65 -2.540 52.030 36.350 1.00 0.00 ATOM 8057 1H10 POP 65 -3.310 52.690 36.780 1.00 0.00 ATOM 8058 1C21 POP 65 -2.300 50.820 37.200 1.00 0.00 ATOM 8059 H11R POP 65 -1.200 50.720 37.300 1.00 0.00 ATOM 8060 H11S POP 65 -2.760 49.910 36.750 1.00 0.00 ATOM 8061 2C21 POP 65 -2.870 50.870 38.620 1.00 0.00 ATOM 8062 H12R POP 65 -2.420 51.660 39.260 1.00 0.00 ATOM 8063 H12S POP 65 -2.550 49.860 38.970 1.00 0.00 ATOM 8064 3C21 POP 65 -4.380 51.050 38.580 1.00 0.00 ATOM 8065 H13R POP 65 -4.860 50.570 37.690 1.00 0.00 ATOM 8066 H13S POP 65 -4.730 52.080 38.360 1.00 0.00 ATOM 8067 4C21 POP 65 -5.150 50.630 39.840 1.00 0.00 ATOM 8068 H14R POP 65 -4.740 51.240 40.670 1.00 0.00 ATOM 8069 H14S POP 65 -4.940 49.580 40.140 1.00 0.00 ATOM 8070 5C21 POP 65 -6.670 50.790 39.720 1.00 0.00 ATOM 8071 H15R POP 65 -7.140 50.210 38.900 1.00 0.00 ATOM 8072 H15S POP 65 -6.850 51.880 39.670 1.00 0.00 ATOM 8073 6C21 POP 65 -7.460 50.420 40.980 1.00 0.00 ATOM 8074 H16R POP 65 -7.560 49.310 40.910 1.00 0.00 ATOM 8075 H16S POP 65 -8.460 50.910 40.990 1.00 0.00 ATOM 8076 7C21 POP 65 -6.940 50.910 42.330 1.00 0.00 ATOM 8077 H17R POP 65 -6.680 51.950 42.040 1.00 0.00 ATOM 8078 H17S POP 65 -6.020 50.430 42.710 1.00 0.00 ATOM 8079 8C21 POP 65 -7.980 50.790 43.440 1.00 0.00 ATOM 8080 H18R POP 65 -7.500 51.020 44.420 1.00 0.00 ATOM 8081 H18S POP 65 -8.170 49.700 43.490 1.00 0.00 ATOM 8082 H18T POP 65 -8.890 51.410 43.290 1.00 0.00 ATOM 8083 C33 POP 65 7.700 53.070 28.480 1.00 0.00 ATOM 8084 H3X POP 65 8.430 52.230 28.360 1.00 0.00 ATOM 8085 H3Y POP 65 6.750 52.690 28.910 1.00 0.00 ATOM 8086 C34 POP 65 8.200 54.310 29.220 1.00 0.00 ATOM 8087 H4X POP 65 7.460 55.110 28.990 1.00 0.00 ATOM 8088 H4Y POP 65 9.200 54.620 28.840 1.00 0.00 ATOM 8089 C35 POP 65 8.360 54.140 30.730 1.00 0.00 ATOM 8090 H5X POP 65 7.550 53.550 31.210 1.00 0.00 ATOM 8091 H5Y POP 65 8.340 55.150 31.190 1.00 0.00 ATOM 8092 C36 POP 65 9.680 53.430 31.010 1.00 0.00 ATOM 8093 H6X POP 65 10.610 53.990 30.750 1.00 0.00 ATOM 8094 H6Y POP 65 9.770 52.430 30.510 1.00 0.00 ATOM 8095 C37 POP 65 9.720 53.140 32.510 1.00 0.00 ATOM 8096 H7X POP 65 10.730 52.690 32.620 1.00 0.00 ATOM 8097 H7Y POP 65 9.030 52.370 32.900 1.00 0.00 ATOM 8098 C38 POP 65 9.750 54.370 33.430 1.00 0.00 ATOM 8099 H8X POP 65 8.770 54.870 33.290 1.00 0.00 ATOM 8100 H8Y POP 65 10.480 55.070 32.980 1.00 0.00 ATOM 8101 C39 POP 65 9.930 53.930 34.880 1.00 0.00 ATOM 8102 H9X POP 65 8.930 53.700 35.310 1.00 0.00 ATOM 8103 H9Y POP 65 10.200 54.860 35.430 1.00 0.00 ATOM 8104 0C31 POP 65 10.940 52.850 35.290 1.00 0.00 ATOM 8105 H10X POP 65 10.690 51.910 34.750 1.00 0.00 ATOM 8106 H10Y POP 65 10.750 52.660 36.370 1.00 0.00 ATOM 8107 1C31 POP 65 12.420 53.220 35.200 1.00 0.00 ATOM 8108 H11X POP 65 12.500 54.280 35.520 1.00 0.00 ATOM 8109 H11Y POP 65 12.650 53.010 34.140 1.00 0.00 ATOM 8110 2C31 POP 65 13.240 52.260 36.070 1.00 0.00 ATOM 8111 H12X POP 65 12.760 52.180 37.070 1.00 0.00 ATOM 8112 H12Y POP 65 13.190 51.260 35.580 1.00 0.00 ATOM 8113 3C31 POP 65 14.710 52.640 36.200 1.00 0.00 ATOM 8114 H13X POP 65 15.120 52.950 35.210 1.00 0.00 ATOM 8115 H13Y POP 65 15.280 51.740 36.500 1.00 0.00 ATOM 8116 4C31 POP 65 15.120 53.720 37.210 1.00 0.00 ATOM 8117 H14X POP 65 14.560 54.600 36.820 1.00 0.00 ATOM 8118 H14Y POP 65 16.170 54.020 37.040 1.00 0.00 ATOM 8119 5C31 POP 65 14.770 53.450 38.680 1.00 0.00 ATOM 8120 H15X POP 65 15.040 52.380 38.850 1.00 0.00 ATOM 8121 H15Y POP 65 13.660 53.500 38.730 1.00 0.00 ATOM 8122 6C31 POP 65 15.390 54.490 39.620 1.00 0.00 ATOM 8123 H16X POP 65 15.420 53.970 40.600 1.00 0.00 ATOM 8124 H16Y POP 65 14.810 55.430 39.690 1.00 0.00 ATOM 8125 H16Z POP 65 16.370 54.920 39.320 1.00 0.00 ATOM 8126 N POP 66 22.540 48.500 21.170 1.00 0.00 ATOM 8127 HN1 POP 66 22.040 48.980 21.940 1.00 0.00 ATOM 8128 HN2 POP 66 23.120 49.220 20.700 1.00 0.00 ATOM 8129 HN3 POP 66 21.980 48.020 20.430 1.00 0.00 ATOM 8130 C12 POP 66 23.380 47.410 21.790 1.00 0.00 ATOM 8131 H12A POP 66 24.430 47.490 21.420 1.00 0.00 ATOM 8132 H12B POP 66 23.070 46.460 21.310 1.00 0.00 ATOM 8133 C11 POP 66 23.330 47.370 23.310 1.00 0.00 ATOM 8134 H11A POP 66 23.920 48.240 23.640 1.00 0.00 ATOM 8135 H11B POP 66 23.890 46.470 23.650 1.00 0.00 ATOM 8136 P POP 66 21.530 48.730 24.490 1.00 0.00 ATOM 8137 O13 POP 66 20.170 48.510 25.020 1.00 0.00 ATOM 8138 O14 POP 66 21.730 49.670 23.370 1.00 0.00 ATOM 8139 O11 POP 66 22.490 49.060 25.730 1.00 0.00 ATOM 8140 O12 POP 66 21.980 47.360 23.790 1.00 0.00 ATOM 8141 C1 POP 66 22.960 47.970 26.530 1.00 0.00 ATOM 8142 HA POP 66 23.830 48.310 27.140 1.00 0.00 ATOM 8143 HB POP 66 23.540 47.250 25.910 1.00 0.00 ATOM 8144 C2 POP 66 21.880 47.220 27.330 1.00 0.00 ATOM 8145 HS POP 66 21.260 46.710 26.560 1.00 0.00 ATOM 8146 O21 POP 66 21.110 48.190 28.050 1.00 0.00 ATOM 8147 C21 POP 66 19.920 47.720 28.410 1.00 0.00 ATOM 8148 O22 POP 66 19.550 46.570 28.200 1.00 0.00 ATOM 8149 C22 POP 66 19.050 48.830 28.990 1.00 0.00 ATOM 8150 H2R POP 66 18.090 48.910 28.440 1.00 0.00 ATOM 8151 H2S POP 66 19.540 49.810 28.820 1.00 0.00 ATOM 8152 C3 POP 66 22.460 46.120 28.230 1.00 0.00 ATOM 8153 HX POP 66 23.180 45.540 27.620 1.00 0.00 ATOM 8154 HY POP 66 21.610 45.450 28.490 1.00 0.00 ATOM 8155 O31 POP 66 23.080 46.610 29.420 1.00 0.00 ATOM 8156 C31 POP 66 24.230 46.040 29.800 1.00 0.00 ATOM 8157 O32 POP 66 24.700 45.030 29.320 1.00 0.00 ATOM 8158 C32 POP 66 24.900 46.760 30.960 1.00 0.00 ATOM 8159 H2X POP 66 24.210 46.760 31.820 1.00 0.00 ATOM 8160 H2Y POP 66 25.040 47.790 30.580 1.00 0.00 ATOM 8161 C23 POP 66 18.600 48.520 30.420 1.00 0.00 ATOM 8162 H3R POP 66 19.420 48.250 31.110 1.00 0.00 ATOM 8163 H3S POP 66 17.870 47.680 30.330 1.00 0.00 ATOM 8164 C24 POP 66 17.840 49.730 30.970 1.00 0.00 ATOM 8165 H4R POP 66 17.280 50.190 30.140 1.00 0.00 ATOM 8166 H4S POP 66 18.560 50.520 31.270 1.00 0.00 ATOM 8167 C25 POP 66 16.810 49.410 32.050 1.00 0.00 ATOM 8168 H5R POP 66 16.180 48.600 31.630 1.00 0.00 ATOM 8169 H5S POP 66 16.280 50.350 32.350 1.00 0.00 ATOM 8170 C26 POP 66 17.290 48.960 33.430 1.00 0.00 ATOM 8171 H6R POP 66 17.930 49.790 33.780 1.00 0.00 ATOM 8172 H6S POP 66 17.950 48.060 33.360 1.00 0.00 ATOM 8173 C27 POP 66 16.280 49.000 34.580 1.00 0.00 ATOM 8174 H7R POP 66 15.460 48.250 34.470 1.00 0.00 ATOM 8175 H7S POP 66 15.770 49.980 34.630 1.00 0.00 ATOM 8176 C28 POP 66 16.950 48.800 35.940 1.00 0.00 ATOM 8177 H8R POP 66 17.740 49.570 36.080 1.00 0.00 ATOM 8178 H8S POP 66 17.490 47.830 35.850 1.00 0.00 ATOM 8179 C29 POP 66 15.900 49.000 36.990 1.00 0.00 ATOM 8180 H91 POP 66 15.800 50.040 37.330 1.00 0.00 ATOM 8181 0C21 POP 66 15.430 48.040 37.800 1.00 0.00 ATOM 8182 1H10 POP 66 14.650 48.210 38.550 1.00 0.00 ATOM 8183 1C21 POP 66 15.770 46.580 37.670 1.00 0.00 ATOM 8184 H11R POP 66 16.850 46.350 37.670 1.00 0.00 ATOM 8185 H11S POP 66 15.290 46.060 36.820 1.00 0.00 ATOM 8186 2C21 POP 66 15.050 45.910 38.840 1.00 0.00 ATOM 8187 H12R POP 66 13.980 46.030 38.540 1.00 0.00 ATOM 8188 H12S POP 66 15.300 46.360 39.820 1.00 0.00 ATOM 8189 3C21 POP 66 15.490 44.450 38.860 1.00 0.00 ATOM 8190 H13R POP 66 16.590 44.390 38.750 1.00 0.00 ATOM 8191 H13S POP 66 14.900 44.000 38.040 1.00 0.00 ATOM 8192 4C21 POP 66 15.280 43.640 40.150 1.00 0.00 ATOM 8193 H14R POP 66 15.280 42.540 40.000 1.00 0.00 ATOM 8194 H14S POP 66 14.280 43.890 40.540 1.00 0.00 ATOM 8195 5C21 POP 66 16.250 44.110 41.230 1.00 0.00 ATOM 8196 H15R POP 66 16.080 45.210 41.350 1.00 0.00 ATOM 8197 H15S POP 66 17.270 44.100 40.810 1.00 0.00 ATOM 8198 6C21 POP 66 15.940 43.430 42.570 1.00 0.00 ATOM 8199 H16R POP 66 15.170 42.670 42.310 1.00 0.00 ATOM 8200 H16S POP 66 15.350 44.090 43.240 1.00 0.00 ATOM 8201 7C21 POP 66 17.100 42.770 43.310 1.00 0.00 ATOM 8202 H17R POP 66 17.950 43.480 43.380 1.00 0.00 ATOM 8203 H17S POP 66 17.460 41.980 42.610 1.00 0.00 ATOM 8204 8C21 POP 66 16.760 42.290 44.720 1.00 0.00 ATOM 8205 H18R POP 66 17.650 41.810 45.200 1.00 0.00 ATOM 8206 H18S POP 66 15.900 41.620 44.900 1.00 0.00 ATOM 8207 H18T POP 66 16.520 43.180 45.330 1.00 0.00 ATOM 8208 C33 POP 66 26.350 46.250 31.020 1.00 0.00 ATOM 8209 H3X POP 66 26.900 46.160 30.060 1.00 0.00 ATOM 8210 H3Y POP 66 26.300 45.230 31.450 1.00 0.00 ATOM 8211 C34 POP 66 27.250 46.980 32.020 1.00 0.00 ATOM 8212 H4X POP 66 27.650 47.940 31.610 1.00 0.00 ATOM 8213 H4Y POP 66 28.090 46.330 32.320 1.00 0.00 ATOM 8214 C35 POP 66 26.570 47.410 33.320 1.00 0.00 ATOM 8215 H5X POP 66 25.990 46.640 33.870 1.00 0.00 ATOM 8216 H5Y POP 66 25.750 48.150 33.200 1.00 0.00 ATOM 8217 C36 POP 66 27.640 47.990 34.250 1.00 0.00 ATOM 8218 H6X POP 66 28.130 48.860 33.760 1.00 0.00 ATOM 8219 H6Y POP 66 28.400 47.220 34.490 1.00 0.00 ATOM 8220 C37 POP 66 27.100 48.400 35.620 1.00 0.00 ATOM 8221 H7X POP 66 26.770 47.470 36.130 1.00 0.00 ATOM 8222 H7Y POP 66 26.170 49.000 35.550 1.00 0.00 ATOM 8223 C38 POP 66 28.230 48.960 36.480 1.00 0.00 ATOM 8224 H8X POP 66 27.820 49.510 37.350 1.00 0.00 ATOM 8225 H8Y POP 66 28.870 49.660 35.900 1.00 0.00 ATOM 8226 C39 POP 66 29.080 47.900 37.190 1.00 0.00 ATOM 8227 H9X POP 66 29.440 47.290 36.340 1.00 0.00 ATOM 8228 H9Y POP 66 28.380 47.350 37.860 1.00 0.00 ATOM 8229 0C31 POP 66 30.210 48.370 38.110 1.00 0.00 ATOM 8230 H10X POP 66 31.020 48.630 37.400 1.00 0.00 ATOM 8231 H10Y POP 66 30.600 47.520 38.720 1.00 0.00 ATOM 8232 1C31 POP 66 29.840 49.580 38.960 1.00 0.00 ATOM 8233 H11X POP 66 28.820 49.330 39.350 1.00 0.00 ATOM 8234 H11Y POP 66 29.730 50.410 38.230 1.00 0.00 ATOM 8235 2C31 POP 66 30.830 49.970 40.060 1.00 0.00 ATOM 8236 H12X POP 66 31.730 50.130 39.430 1.00 0.00 ATOM 8237 H12Y POP 66 31.070 49.030 40.610 1.00 0.00 ATOM 8238 3C31 POP 66 30.440 51.100 41.010 1.00 0.00 ATOM 8239 H13X POP 66 30.140 50.760 42.020 1.00 0.00 ATOM 8240 H13Y POP 66 29.650 51.720 40.530 1.00 0.00 ATOM 8241 4C31 POP 66 31.670 51.980 41.260 1.00 0.00 ATOM 8242 H14X POP 66 32.180 52.430 40.380 1.00 0.00 ATOM 8243 H14Y POP 66 32.500 51.330 41.610 1.00 0.00 ATOM 8244 5C31 POP 66 31.290 53.090 42.240 1.00 0.00 ATOM 8245 H15X POP 66 30.780 52.630 43.110 1.00 0.00 ATOM 8246 H15Y POP 66 30.680 53.880 41.750 1.00 0.00 ATOM 8247 6C31 POP 66 32.560 53.710 42.840 1.00 0.00 ATOM 8248 H16X POP 66 33.210 52.930 43.290 1.00 0.00 ATOM 8249 H16Y POP 66 32.200 54.440 43.590 1.00 0.00 ATOM 8250 H16Z POP 66 33.200 54.320 42.170 1.00 0.00 ATOM 8251 N POP 67 55.210 46.710 23.290 1.00 0.00 ATOM 8252 HN1 POP 67 54.640 47.570 23.360 1.00 0.00 ATOM 8253 HN2 POP 67 54.880 46.090 22.520 1.00 0.00 ATOM 8254 HN3 POP 67 55.200 46.220 24.210 1.00 0.00 ATOM 8255 C12 POP 67 56.640 47.080 22.980 1.00 0.00 ATOM 8256 H12A POP 67 56.510 47.490 21.960 1.00 0.00 ATOM 8257 H12B POP 67 57.360 46.230 22.950 1.00 0.00 ATOM 8258 C11 POP 67 57.240 48.080 23.980 1.00 0.00 ATOM 8259 H11A POP 67 58.240 48.460 23.710 1.00 0.00 ATOM 8260 H11B POP 67 57.310 47.440 24.890 1.00 0.00 ATOM 8261 P POP 67 56.690 50.520 24.620 1.00 0.00 ATOM 8262 O13 POP 67 57.480 51.080 23.500 1.00 0.00 ATOM 8263 O14 POP 67 55.480 51.230 25.080 1.00 0.00 ATOM 8264 O11 POP 67 57.710 50.330 25.840 1.00 0.00 ATOM 8265 O12 POP 67 56.210 49.050 24.220 1.00 0.00 ATOM 8266 C1 POP 67 57.180 49.830 27.080 1.00 0.00 ATOM 8267 HA POP 67 57.150 48.740 26.900 1.00 0.00 ATOM 8268 HB POP 67 56.120 50.090 27.260 1.00 0.00 ATOM 8269 C2 POP 67 58.110 50.120 28.270 1.00 0.00 ATOM 8270 HS POP 67 57.710 49.690 29.210 1.00 0.00 ATOM 8271 O21 POP 67 58.170 51.540 28.420 1.00 0.00 ATOM 8272 C21 POP 67 57.090 52.170 28.890 1.00 0.00 ATOM 8273 O22 POP 67 56.140 51.640 29.440 1.00 0.00 ATOM 8274 C22 POP 67 57.300 53.680 28.800 1.00 0.00 ATOM 8275 H2R POP 67 56.800 54.050 27.880 1.00 0.00 ATOM 8276 H2S POP 67 58.390 53.850 28.700 1.00 0.00 ATOM 8277 C3 POP 67 59.530 49.570 28.050 1.00 0.00 ATOM 8278 HX POP 67 60.050 50.270 27.360 1.00 0.00 ATOM 8279 HY POP 67 59.370 48.620 27.490 1.00 0.00 ATOM 8280 O31 POP 67 60.200 49.320 29.290 1.00 0.00 ATOM 8281 C31 POP 67 61.420 48.780 29.160 1.00 0.00 ATOM 8282 O32 POP 67 61.870 48.440 28.080 1.00 0.00 ATOM 8283 C32 POP 67 61.970 48.540 30.560 1.00 0.00 ATOM 8284 H2X POP 67 61.530 47.640 31.040 1.00 0.00 ATOM 8285 H2Y POP 67 61.650 49.480 31.070 1.00 0.00 ATOM 8286 C23 POP 67 56.640 54.570 29.850 1.00 0.00 ATOM 8287 H3R POP 67 55.690 54.060 30.120 1.00 0.00 ATOM 8288 H3S POP 67 56.440 55.590 29.450 1.00 0.00 ATOM 8289 C24 POP 67 57.380 54.690 31.190 1.00 0.00 ATOM 8290 H4R POP 67 58.350 55.180 30.980 1.00 0.00 ATOM 8291 H4S POP 67 57.680 53.740 31.680 1.00 0.00 ATOM 8292 C25 POP 67 56.720 55.680 32.160 1.00 0.00 ATOM 8293 H5R POP 67 55.680 55.380 32.400 1.00 0.00 ATOM 8294 H5S POP 67 56.710 56.710 31.750 1.00 0.00 ATOM 8295 C26 POP 67 57.650 55.820 33.360 1.00 0.00 ATOM 8296 H6R POP 67 58.700 56.030 33.030 1.00 0.00 ATOM 8297 H6S POP 67 57.550 54.820 33.830 1.00 0.00 ATOM 8298 C27 POP 67 57.200 56.810 34.430 1.00 0.00 ATOM 8299 H7R POP 67 56.180 56.570 34.810 1.00 0.00 ATOM 8300 H7S POP 67 57.160 57.840 34.010 1.00 0.00 ATOM 8301 C28 POP 67 58.140 56.850 35.630 1.00 0.00 ATOM 8302 H8R POP 67 57.760 57.670 36.280 1.00 0.00 ATOM 8303 H8S POP 67 59.200 57.110 35.410 1.00 0.00 ATOM 8304 C29 POP 67 58.100 55.580 36.430 1.00 0.00 ATOM 8305 H91 POP 67 57.410 54.770 36.150 1.00 0.00 ATOM 8306 0C21 POP 67 58.820 55.330 37.530 1.00 0.00 ATOM 8307 1H10 POP 67 58.670 54.370 38.050 1.00 0.00 ATOM 8308 1C21 POP 67 59.840 56.250 38.130 1.00 0.00 ATOM 8309 H11R POP 67 59.810 57.230 37.610 1.00 0.00 ATOM 8310 H11S POP 67 60.830 55.790 37.930 1.00 0.00 ATOM 8311 2C21 POP 67 59.720 56.490 39.630 1.00 0.00 ATOM 8312 H12R POP 67 59.960 55.570 40.200 1.00 0.00 ATOM 8313 H12S POP 67 58.760 56.910 40.000 1.00 0.00 ATOM 8314 3C21 POP 67 60.620 57.630 40.120 1.00 0.00 ATOM 8315 H13R POP 67 60.220 58.580 39.710 1.00 0.00 ATOM 8316 H13S POP 67 61.660 57.450 39.750 1.00 0.00 ATOM 8317 4C21 POP 67 60.500 57.850 41.630 1.00 0.00 ATOM 8318 H14R POP 67 60.460 56.970 42.300 1.00 0.00 ATOM 8319 H14S POP 67 59.530 58.370 41.770 1.00 0.00 ATOM 8320 5C21 POP 67 61.600 58.850 42.010 1.00 0.00 ATOM 8321 H15R POP 67 61.310 59.400 42.920 1.00 0.00 ATOM 8322 H15S POP 67 61.760 59.630 41.240 1.00 0.00 ATOM 8323 6C21 POP 67 62.810 58.050 42.500 1.00 0.00 ATOM 8324 H16R POP 67 63.340 57.690 41.600 1.00 0.00 ATOM 8325 H16S POP 67 62.420 57.200 43.090 1.00 0.00 ATOM 8326 7C21 POP 67 63.770 58.860 43.380 1.00 0.00 ATOM 8327 H17R POP 67 63.100 59.280 44.160 1.00 0.00 ATOM 8328 H17S POP 67 64.160 59.750 42.840 1.00 0.00 ATOM 8329 8C21 POP 67 64.860 58.030 44.050 1.00 0.00 ATOM 8330 H18R POP 67 64.360 57.230 44.640 1.00 0.00 ATOM 8331 H18S POP 67 65.350 58.700 44.790 1.00 0.00 ATOM 8332 H18T POP 67 65.660 57.630 43.400 1.00 0.00 ATOM 8333 C33 POP 67 63.500 48.490 30.460 1.00 0.00 ATOM 8334 H3X POP 67 63.860 48.980 29.530 1.00 0.00 ATOM 8335 H3Y POP 67 63.800 47.430 30.280 1.00 0.00 ATOM 8336 C34 POP 67 64.110 49.030 31.750 1.00 0.00 ATOM 8337 H4X POP 67 63.990 50.130 31.910 1.00 0.00 ATOM 8338 H4Y POP 67 65.170 48.710 31.670 1.00 0.00 ATOM 8339 C35 POP 67 63.530 48.290 32.950 1.00 0.00 ATOM 8340 H5X POP 67 63.720 47.200 32.800 1.00 0.00 ATOM 8341 H5Y POP 67 62.440 48.310 33.120 1.00 0.00 ATOM 8342 C36 POP 67 64.240 48.830 34.200 1.00 0.00 ATOM 8343 H6X POP 67 63.950 49.870 34.430 1.00 0.00 ATOM 8344 H6Y POP 67 65.340 48.850 34.030 1.00 0.00 ATOM 8345 C37 POP 67 64.140 47.900 35.410 1.00 0.00 ATOM 8346 H7X POP 67 64.770 48.200 36.280 1.00 0.00 ATOM 8347 H7Y POP 67 64.400 46.840 35.210 1.00 0.00 ATOM 8348 C38 POP 67 62.680 47.780 35.820 1.00 0.00 ATOM 8349 H8X POP 67 62.190 47.070 35.120 1.00 0.00 ATOM 8350 H8Y POP 67 62.150 48.760 35.730 1.00 0.00 ATOM 8351 C39 POP 67 62.450 47.250 37.240 1.00 0.00 ATOM 8352 H9X POP 67 62.950 47.880 38.010 1.00 0.00 ATOM 8353 H9Y POP 67 62.680 46.180 37.390 1.00 0.00 ATOM 8354 0C31 POP 67 60.980 47.400 37.620 1.00 0.00 ATOM 8355 H10X POP 67 60.620 48.430 37.870 1.00 0.00 ATOM 8356 H10Y POP 67 60.920 46.960 38.630 1.00 0.00 ATOM 8357 1C31 POP 67 60.050 46.660 36.650 1.00 0.00 ATOM 8358 H11X POP 67 60.700 45.910 36.160 1.00 0.00 ATOM 8359 H11Y POP 67 59.630 47.330 35.860 1.00 0.00 ATOM 8360 2C31 POP 67 58.850 46.010 37.330 1.00 0.00 ATOM 8361 H12X POP 67 59.250 45.530 38.250 1.00 0.00 ATOM 8362 H12Y POP 67 58.360 45.200 36.740 1.00 0.00 ATOM 8363 3C31 POP 67 57.730 46.960 37.760 1.00 0.00 ATOM 8364 H13X POP 67 57.110 47.050 36.840 1.00 0.00 ATOM 8365 H13Y POP 67 58.100 47.980 38.000 1.00 0.00 ATOM 8366 4C31 POP 67 57.020 46.310 38.960 1.00 0.00 ATOM 8367 H14X POP 67 57.550 46.520 39.910 1.00 0.00 ATOM 8368 H14Y POP 67 56.980 45.200 38.880 1.00 0.00 ATOM 8369 5C31 POP 67 55.640 46.950 38.970 1.00 0.00 ATOM 8370 H15X POP 67 55.240 46.740 37.960 1.00 0.00 ATOM 8371 H15Y POP 67 55.700 48.030 39.220 1.00 0.00 ATOM 8372 6C31 POP 67 54.600 46.370 39.930 1.00 0.00 ATOM 8373 H16X POP 67 53.670 46.980 39.910 1.00 0.00 ATOM 8374 H16Y POP 67 54.930 46.570 40.970 1.00 0.00 ATOM 8375 H16Z POP 67 54.480 45.290 39.710 1.00 0.00 ATOM 8376 N POP 68 53.660 31.970 25.310 1.00 0.00 ATOM 8377 HN1 POP 68 52.920 31.240 25.400 1.00 0.00 ATOM 8378 HN2 POP 68 54.510 31.490 24.950 1.00 0.00 ATOM 8379 HN3 POP 68 53.920 32.210 26.290 1.00 0.00 ATOM 8380 C12 POP 68 53.220 33.090 24.400 1.00 0.00 ATOM 8381 H12A POP 68 52.930 32.710 23.400 1.00 0.00 ATOM 8382 H12B POP 68 54.100 33.720 24.160 1.00 0.00 ATOM 8383 C11 POP 68 52.150 33.890 25.150 1.00 0.00 ATOM 8384 H11A POP 68 52.050 34.930 24.770 1.00 0.00 ATOM 8385 H11B POP 68 52.460 34.010 26.200 1.00 0.00 ATOM 8386 P POP 68 49.590 34.200 25.670 1.00 0.00 ATOM 8387 O13 POP 68 48.530 33.270 26.110 1.00 0.00 ATOM 8388 O14 POP 68 49.240 35.090 24.540 1.00 0.00 ATOM 8389 O11 POP 68 50.090 34.990 26.960 1.00 0.00 ATOM 8390 O12 POP 68 50.840 33.310 25.200 1.00 0.00 ATOM 8391 C1 POP 68 49.100 35.840 27.560 1.00 0.00 ATOM 8392 HA POP 68 49.360 35.910 28.630 1.00 0.00 ATOM 8393 HB POP 68 48.100 35.370 27.480 1.00 0.00 ATOM 8394 C2 POP 68 48.960 37.210 26.870 1.00 0.00 ATOM 8395 HS POP 68 48.180 37.070 26.090 1.00 0.00 ATOM 8396 O21 POP 68 50.180 37.540 26.190 1.00 0.00 ATOM 8397 C21 POP 68 50.190 38.720 25.580 1.00 0.00 ATOM 8398 O22 POP 68 49.190 39.400 25.420 1.00 0.00 ATOM 8399 C22 POP 68 51.590 39.100 25.110 1.00 0.00 ATOM 8400 H2R POP 68 51.690 40.190 24.890 1.00 0.00 ATOM 8401 H2S POP 68 51.680 38.670 24.090 1.00 0.00 ATOM 8402 C3 POP 68 48.410 38.140 27.950 1.00 0.00 ATOM 8403 HX POP 68 47.690 37.460 28.460 1.00 0.00 ATOM 8404 HY POP 68 47.690 38.880 27.540 1.00 0.00 ATOM 8405 O31 POP 68 49.400 38.750 28.780 1.00 0.00 ATOM 8406 C31 POP 68 49.180 38.580 30.080 1.00 0.00 ATOM 8407 O32 POP 68 48.100 38.370 30.620 1.00 0.00 ATOM 8408 C32 POP 68 50.520 38.590 30.810 1.00 0.00 ATOM 8409 H2X POP 68 50.930 39.620 30.830 1.00 0.00 ATOM 8410 H2Y POP 68 51.110 37.960 30.120 1.00 0.00 ATOM 8411 C23 POP 68 52.680 38.480 25.990 1.00 0.00 ATOM 8412 H3R POP 68 53.700 38.510 25.540 1.00 0.00 ATOM 8413 H3S POP 68 52.390 37.420 26.130 1.00 0.00 ATOM 8414 C24 POP 68 52.700 39.120 27.380 1.00 0.00 ATOM 8415 H4R POP 68 53.440 38.540 27.970 1.00 0.00 ATOM 8416 H4S POP 68 51.760 38.970 27.940 1.00 0.00 ATOM 8417 C25 POP 68 53.210 40.570 27.330 1.00 0.00 ATOM 8418 H5R POP 68 52.710 41.110 26.490 1.00 0.00 ATOM 8419 H5S POP 68 54.310 40.510 27.270 1.00 0.00 ATOM 8420 C26 POP 68 52.730 41.380 28.540 1.00 0.00 ATOM 8421 H6R POP 68 52.860 40.630 29.350 1.00 0.00 ATOM 8422 H6S POP 68 51.670 41.670 28.610 1.00 0.00 ATOM 8423 C27 POP 68 53.490 42.680 28.800 1.00 0.00 ATOM 8424 H7R POP 68 53.360 43.340 27.910 1.00 0.00 ATOM 8425 H7S POP 68 54.560 42.410 28.870 1.00 0.00 ATOM 8426 C28 POP 68 52.890 43.260 30.090 1.00 0.00 ATOM 8427 H8R POP 68 53.430 44.190 30.380 1.00 0.00 ATOM 8428 H8S POP 68 53.020 42.510 30.900 1.00 0.00 ATOM 8429 C29 POP 68 51.470 43.700 29.940 1.00 0.00 ATOM 8430 H91 POP 68 51.280 44.290 29.030 1.00 0.00 ATOM 8431 0C21 POP 68 50.460 43.520 30.810 1.00 0.00 ATOM 8432 1H10 POP 68 49.470 43.960 30.650 1.00 0.00 ATOM 8433 1C21 POP 68 50.540 42.780 32.120 1.00 0.00 ATOM 8434 H11R POP 68 51.610 42.550 32.280 1.00 0.00 ATOM 8435 H11S POP 68 49.860 41.900 32.160 1.00 0.00 ATOM 8436 2C21 POP 68 50.000 43.690 33.230 1.00 0.00 ATOM 8437 H12R POP 68 49.090 44.270 32.980 1.00 0.00 ATOM 8438 H12S POP 68 50.710 44.530 33.300 1.00 0.00 ATOM 8439 3C21 POP 68 49.870 42.940 34.560 1.00 0.00 ATOM 8440 H13R POP 68 50.840 42.530 34.900 1.00 0.00 ATOM 8441 H13S POP 68 49.170 42.080 34.580 1.00 0.00 ATOM 8442 4C21 POP 68 49.550 44.020 35.590 1.00 0.00 ATOM 8443 H14R POP 68 48.670 44.580 35.210 1.00 0.00 ATOM 8444 H14S POP 68 50.410 44.710 35.720 1.00 0.00 ATOM 8445 5C21 POP 68 49.300 43.540 37.030 1.00 0.00 ATOM 8446 H15R POP 68 50.270 43.360 37.530 1.00 0.00 ATOM 8447 H15S POP 68 48.880 42.510 36.930 1.00 0.00 ATOM 8448 6C21 POP 68 48.390 44.460 37.840 1.00 0.00 ATOM 8449 H16R POP 68 48.200 43.980 38.830 1.00 0.00 ATOM 8450 H16S POP 68 47.390 44.550 37.360 1.00 0.00 ATOM 8451 7C21 POP 68 49.040 45.810 38.150 1.00 0.00 ATOM 8452 H17R POP 68 49.320 46.260 37.180 1.00 0.00 ATOM 8453 H17S POP 68 49.970 45.720 38.740 1.00 0.00 ATOM 8454 8C21 POP 68 48.240 46.800 39.000 1.00 0.00 ATOM 8455 H18R POP 68 48.630 47.820 38.780 1.00 0.00 ATOM 8456 H18S POP 68 48.260 46.680 40.100 1.00 0.00 ATOM 8457 H18T POP 68 47.160 46.710 38.770 1.00 0.00 ATOM 8458 C33 POP 68 50.490 37.890 32.170 1.00 0.00 ATOM 8459 H3X POP 68 51.530 37.670 32.470 1.00 0.00 ATOM 8460 H3Y POP 68 49.970 36.920 31.980 1.00 0.00 ATOM 8461 C34 POP 68 49.680 38.630 33.240 1.00 0.00 ATOM 8462 H4X POP 68 48.740 39.040 32.830 1.00 0.00 ATOM 8463 H4Y POP 68 50.380 39.410 33.610 1.00 0.00 ATOM 8464 C35 POP 68 49.330 37.620 34.330 1.00 0.00 ATOM 8465 H5X POP 68 50.240 37.080 34.660 1.00 0.00 ATOM 8466 H5Y POP 68 48.550 36.990 33.850 1.00 0.00 ATOM 8467 C36 POP 68 48.680 38.210 35.580 1.00 0.00 ATOM 8468 H6X POP 68 47.680 38.610 35.310 1.00 0.00 ATOM 8469 H6Y POP 68 49.240 39.070 36.030 1.00 0.00 ATOM 8470 C37 POP 68 48.590 37.150 36.680 1.00 0.00 ATOM 8471 H7X POP 68 48.270 36.140 36.350 1.00 0.00 ATOM 8472 H7Y POP 68 47.900 37.680 37.370 1.00 0.00 ATOM 8473 C38 POP 68 49.950 37.030 37.380 1.00 0.00 ATOM 8474 H8X POP 68 50.260 38.090 37.510 1.00 0.00 ATOM 8475 H8Y POP 68 50.640 36.470 36.710 1.00 0.00 ATOM 8476 C39 POP 68 49.830 36.200 38.660 1.00 0.00 ATOM 8477 H9X POP 68 49.070 36.700 39.310 1.00 0.00 ATOM 8478 H9Y POP 68 50.750 36.310 39.280 1.00 0.00 ATOM 8479 0C31 POP 68 49.370 34.760 38.440 1.00 0.00 ATOM 8480 H10X POP 68 50.100 34.300 37.730 1.00 0.00 ATOM 8481 H10Y POP 68 48.350 34.750 37.990 1.00 0.00 ATOM 8482 1C31 POP 68 49.490 33.980 39.740 1.00 0.00 ATOM 8483 H11X POP 68 50.560 33.860 40.040 1.00 0.00 ATOM 8484 H11Y POP 68 49.060 32.960 39.690 1.00 0.00 ATOM 8485 2C31 POP 68 48.800 34.670 40.920 1.00 0.00 ATOM 8486 H12X POP 68 47.750 34.890 40.660 1.00 0.00 ATOM 8487 H12Y POP 68 49.320 35.580 41.300 1.00 0.00 ATOM 8488 3C31 POP 68 48.680 33.660 42.070 1.00 0.00 ATOM 8489 H13X POP 68 49.660 33.210 42.350 1.00 0.00 ATOM 8490 H13Y POP 68 47.990 32.860 41.740 1.00 0.00 ATOM 8491 4C31 POP 68 48.180 34.200 43.410 1.00 0.00 ATOM 8492 H14X POP 68 47.260 34.770 43.170 1.00 0.00 ATOM 8493 H14Y POP 68 48.900 34.990 43.710 1.00 0.00 ATOM 8494 5C31 POP 68 47.890 33.130 44.460 1.00 0.00 ATOM 8495 H15X POP 68 48.790 32.540 44.740 1.00 0.00 ATOM 8496 H15Y POP 68 47.200 32.340 44.110 1.00 0.00 ATOM 8497 6C31 POP 68 47.240 33.610 45.760 1.00 0.00 ATOM 8498 H16X POP 68 47.740 34.470 46.260 1.00 0.00 ATOM 8499 H16Y POP 68 47.180 32.810 46.520 1.00 0.00 ATOM 8500 H16Z POP 68 46.230 33.970 45.470 1.00 0.00 ATOM 8501 N POP 69 39.680 31.080 28.750 1.00 0.00 ATOM 8502 HN1 POP 69 38.780 31.040 28.220 1.00 0.00 ATOM 8503 HN2 POP 69 39.710 32.030 29.160 1.00 0.00 ATOM 8504 HN3 POP 69 40.520 31.000 28.140 1.00 0.00 ATOM 8505 C12 POP 69 39.810 29.890 29.670 1.00 0.00 ATOM 8506 H12A POP 69 38.800 29.690 30.090 1.00 0.00 ATOM 8507 H12B POP 69 40.490 30.100 30.530 1.00 0.00 ATOM 8508 C11 POP 69 40.490 28.690 29.020 1.00 0.00 ATOM 8509 H11A POP 69 40.600 27.850 29.750 1.00 0.00 ATOM 8510 H11B POP 69 41.540 28.920 28.730 1.00 0.00 ATOM 8511 P POP 69 40.660 27.470 26.810 1.00 0.00 ATOM 8512 O13 POP 69 41.690 28.350 26.230 1.00 0.00 ATOM 8513 O14 POP 69 39.640 26.850 25.930 1.00 0.00 ATOM 8514 O11 POP 69 41.310 26.410 27.810 1.00 0.00 ATOM 8515 O12 POP 69 39.770 28.290 27.850 1.00 0.00 ATOM 8516 C1 POP 69 40.690 25.120 27.700 1.00 0.00 ATOM 8517 HA POP 69 41.280 24.430 28.340 1.00 0.00 ATOM 8518 HB POP 69 40.690 24.800 26.640 1.00 0.00 ATOM 8519 C2 POP 69 39.260 24.880 28.230 1.00 0.00 ATOM 8520 HS POP 69 38.590 25.170 27.400 1.00 0.00 ATOM 8521 O21 POP 69 39.130 25.710 29.390 1.00 0.00 ATOM 8522 C21 POP 69 37.870 26.070 29.620 1.00 0.00 ATOM 8523 O22 POP 69 36.930 25.840 28.870 1.00 0.00 ATOM 8524 C22 POP 69 37.900 26.770 30.970 1.00 0.00 ATOM 8525 H2R POP 69 38.640 27.600 31.000 1.00 0.00 ATOM 8526 H2S POP 69 38.180 25.970 31.680 1.00 0.00 ATOM 8527 C3 POP 69 38.860 23.460 28.650 1.00 0.00 ATOM 8528 HX POP 69 38.880 22.840 27.730 1.00 0.00 ATOM 8529 HY POP 69 37.780 23.400 28.930 1.00 0.00 ATOM 8530 O31 POP 69 39.790 22.840 29.550 1.00 0.00 ATOM 8531 C31 POP 69 39.270 22.590 30.750 1.00 0.00 ATOM 8532 O32 POP 69 38.280 23.130 31.220 1.00 0.00 ATOM 8533 C32 POP 69 40.150 21.520 31.380 1.00 0.00 ATOM 8534 H2X POP 69 41.160 21.980 31.420 1.00 0.00 ATOM 8535 H2Y POP 69 40.070 20.630 30.720 1.00 0.00 ATOM 8536 C23 POP 69 36.460 27.160 31.330 1.00 0.00 ATOM 8537 H3R POP 69 35.850 27.670 30.550 1.00 0.00 ATOM 8538 H3S POP 69 36.620 27.910 32.120 1.00 0.00 ATOM 8539 C24 POP 69 35.530 26.080 31.900 1.00 0.00 ATOM 8540 H4R POP 69 35.700 25.080 31.450 1.00 0.00 ATOM 8541 H4S POP 69 34.550 26.280 31.410 1.00 0.00 ATOM 8542 C25 POP 69 35.480 25.900 33.420 1.00 0.00 ATOM 8543 H5R POP 69 34.600 26.430 33.850 1.00 0.00 ATOM 8544 H5S POP 69 36.330 26.370 33.950 1.00 0.00 ATOM 8545 C26 POP 69 35.330 24.450 33.860 1.00 0.00 ATOM 8546 H6R POP 69 36.120 23.800 33.430 1.00 0.00 ATOM 8547 H6S POP 69 34.390 23.960 33.510 1.00 0.00 ATOM 8548 C27 POP 69 35.300 24.400 35.390 1.00 0.00 ATOM 8549 H7R POP 69 34.280 24.780 35.620 1.00 0.00 ATOM 8550 H7S POP 69 35.950 25.170 35.850 1.00 0.00 ATOM 8551 C28 POP 69 35.410 23.000 36.000 1.00 0.00 ATOM 8552 H8R POP 69 35.400 23.100 37.100 1.00 0.00 ATOM 8553 H8S POP 69 36.320 22.390 35.830 1.00 0.00 ATOM 8554 C29 POP 69 34.270 22.120 35.580 1.00 0.00 ATOM 8555 H91 POP 69 34.520 21.390 34.800 1.00 0.00 ATOM 8556 0C21 POP 69 33.050 21.900 36.100 1.00 0.00 ATOM 8557 1H10 POP 69 32.530 20.960 35.880 1.00 0.00 ATOM 8558 1C21 POP 69 32.350 22.560 37.260 1.00 0.00 ATOM 8559 H11R POP 69 31.590 23.320 36.980 1.00 0.00 ATOM 8560 H11S POP 69 33.050 23.220 37.810 1.00 0.00 ATOM 8561 2C21 POP 69 31.800 21.560 38.280 1.00 0.00 ATOM 8562 H12R POP 69 32.660 20.950 38.630 1.00 0.00 ATOM 8563 H12S POP 69 31.000 20.980 37.760 1.00 0.00 ATOM 8564 3C21 POP 69 31.230 22.350 39.450 1.00 0.00 ATOM 8565 H13R POP 69 30.470 23.020 38.990 1.00 0.00 ATOM 8566 H13S POP 69 31.990 22.930 40.030 1.00 0.00 ATOM 8567 4C21 POP 69 30.460 21.420 40.390 1.00 0.00 ATOM 8568 H14R POP 69 31.270 20.710 40.680 1.00 0.00 ATOM 8569 H14S POP 69 29.760 20.770 39.830 1.00 0.00 ATOM 8570 5C21 POP 69 29.840 22.210 41.540 1.00 0.00 ATOM 8571 H15R POP 69 29.320 23.080 41.100 1.00 0.00 ATOM 8572 H15S POP 69 30.740 22.610 42.070 1.00 0.00 ATOM 8573 6C21 POP 69 29.010 21.330 42.480 1.00 0.00 ATOM 8574 H16R POP 69 29.670 20.520 42.850 1.00 0.00 ATOM 8575 H16S POP 69 28.200 20.870 41.870 1.00 0.00 ATOM 8576 7C21 POP 69 28.350 22.090 43.630 1.00 0.00 ATOM 8577 H17R POP 69 29.240 22.550 44.110 1.00 0.00 ATOM 8578 H17S POP 69 27.930 21.320 44.310 1.00 0.00 ATOM 8579 8C21 POP 69 27.330 23.170 43.290 1.00 0.00 ATOM 8580 H18R POP 69 27.340 23.910 44.120 1.00 0.00 ATOM 8581 H18S POP 69 26.310 22.750 43.200 1.00 0.00 ATOM 8582 H18T POP 69 27.470 23.650 42.300 1.00 0.00 ATOM 8583 C33 POP 69 39.650 21.320 32.810 1.00 0.00 ATOM 8584 H3X POP 69 40.190 20.390 33.060 1.00 0.00 ATOM 8585 H3Y POP 69 38.560 21.110 32.800 1.00 0.00 ATOM 8586 C34 POP 69 40.090 22.400 33.800 1.00 0.00 ATOM 8587 H4X POP 69 39.730 23.390 33.440 1.00 0.00 ATOM 8588 H4Y POP 69 41.190 22.410 33.890 1.00 0.00 ATOM 8589 C35 POP 69 39.550 22.220 35.220 1.00 0.00 ATOM 8590 H5X POP 69 39.700 21.120 35.360 1.00 0.00 ATOM 8591 H5Y POP 69 38.480 22.510 35.160 1.00 0.00 ATOM 8592 C36 POP 69 40.180 23.100 36.300 1.00 0.00 ATOM 8593 H6X POP 69 40.300 24.110 35.870 1.00 0.00 ATOM 8594 H6Y POP 69 41.140 22.660 36.610 1.00 0.00 ATOM 8595 C37 POP 69 39.300 23.270 37.540 1.00 0.00 ATOM 8596 H7X POP 69 39.270 22.320 38.110 1.00 0.00 ATOM 8597 H7Y POP 69 38.270 23.380 37.120 1.00 0.00 ATOM 8598 C38 POP 69 39.760 24.520 38.280 1.00 0.00 ATOM 8599 H8X POP 69 39.510 25.390 37.640 1.00 0.00 ATOM 8600 H8Y POP 69 40.820 24.530 38.640 1.00 0.00 ATOM 8601 C39 POP 69 39.000 24.660 39.600 1.00 0.00 ATOM 8602 H9X POP 69 39.150 23.740 40.200 1.00 0.00 ATOM 8603 H9Y POP 69 37.940 24.780 39.310 1.00 0.00 ATOM 8604 0C31 POP 69 39.530 25.840 40.430 1.00 0.00 ATOM 8605 H10X POP 69 39.540 26.720 39.760 1.00 0.00 ATOM 8606 H10Y POP 69 40.510 25.460 40.770 1.00 0.00 ATOM 8607 1C31 POP 69 38.700 26.290 41.640 1.00 0.00 ATOM 8608 H11X POP 69 37.730 26.670 41.240 1.00 0.00 ATOM 8609 H11Y POP 69 39.100 27.170 42.190 1.00 0.00 ATOM 8610 2C31 POP 69 38.390 25.220 42.680 1.00 0.00 ATOM 8611 H12X POP 69 39.330 24.700 42.950 1.00 0.00 ATOM 8612 H12Y POP 69 37.680 24.520 42.180 1.00 0.00 ATOM 8613 3C31 POP 69 37.450 25.640 43.810 1.00 0.00 ATOM 8614 H13X POP 69 36.580 26.210 43.420 1.00 0.00 ATOM 8615 H13Y POP 69 37.960 26.340 44.510 1.00 0.00 ATOM 8616 4C31 POP 69 36.970 24.370 44.490 1.00 0.00 ATOM 8617 H14X POP 69 36.330 24.660 45.360 1.00 0.00 ATOM 8618 H14Y POP 69 36.420 23.700 43.790 1.00 0.00 ATOM 8619 5C31 POP 69 38.030 23.510 45.190 1.00 0.00 ATOM 8620 H15X POP 69 38.720 23.080 44.430 1.00 0.00 ATOM 8621 H15Y POP 69 38.530 24.120 45.970 1.00 0.00 ATOM 8622 6C31 POP 69 37.320 22.380 45.940 1.00 0.00 ATOM 8623 H16X POP 69 36.300 22.090 45.590 1.00 0.00 ATOM 8624 H16Y POP 69 37.310 22.640 47.020 1.00 0.00 ATOM 8625 H16Z POP 69 37.930 21.470 45.800 1.00 0.00 ATOM 8626 N POP 70 23.010 23.600 25.700 1.00 0.00 ATOM 8627 HN1 POP 70 23.510 24.450 25.370 1.00 0.00 ATOM 8628 HN2 POP 70 23.380 22.860 25.060 1.00 0.00 ATOM 8629 HN3 POP 70 22.060 23.870 25.390 1.00 0.00 ATOM 8630 C12 POP 70 23.060 23.360 27.190 1.00 0.00 ATOM 8631 H12A POP 70 22.160 22.720 27.320 1.00 0.00 ATOM 8632 H12B POP 70 23.070 24.310 27.770 1.00 0.00 ATOM 8633 C11 POP 70 24.230 22.420 27.530 1.00 0.00 ATOM 8634 H11A POP 70 24.090 22.070 28.570 1.00 0.00 ATOM 8635 H11B POP 70 25.150 23.040 27.470 1.00 0.00 ATOM 8636 P POP 70 25.660 20.570 26.490 1.00 0.00 ATOM 8637 O13 POP 70 26.760 21.400 27.030 1.00 0.00 ATOM 8638 O14 POP 70 25.950 20.030 25.140 1.00 0.00 ATOM 8639 O11 POP 70 25.360 19.360 27.490 1.00 0.00 ATOM 8640 O12 POP 70 24.300 21.420 26.510 1.00 0.00 ATOM 8641 C1 POP 70 25.810 18.030 27.230 1.00 0.00 ATOM 8642 HA POP 70 26.080 17.550 28.190 1.00 0.00 ATOM 8643 HB POP 70 26.810 18.070 26.730 1.00 0.00 ATOM 8644 C2 POP 70 24.920 17.180 26.320 1.00 0.00 ATOM 8645 HS POP 70 25.220 17.340 25.260 1.00 0.00 ATOM 8646 O21 POP 70 23.550 17.460 26.630 1.00 0.00 ATOM 8647 C21 POP 70 22.710 17.050 25.680 1.00 0.00 ATOM 8648 O22 POP 70 23.020 16.510 24.630 1.00 0.00 ATOM 8649 C22 POP 70 21.280 17.440 26.040 1.00 0.00 ATOM 8650 H2R POP 70 20.740 16.520 26.340 1.00 0.00 ATOM 8651 H2S POP 70 20.810 17.920 25.150 1.00 0.00 ATOM 8652 C3 POP 70 25.240 15.700 26.590 1.00 0.00 ATOM 8653 HX POP 70 26.300 15.650 26.270 1.00 0.00 ATOM 8654 HY POP 70 24.700 15.000 25.900 1.00 0.00 ATOM 8655 O31 POP 70 25.070 15.360 27.970 1.00 0.00 ATOM 8656 C31 POP 70 23.990 14.700 28.370 1.00 0.00 ATOM 8657 O32 POP 70 23.060 14.330 27.670 1.00 0.00 ATOM 8658 C32 POP 70 24.010 14.850 29.890 1.00 0.00 ATOM 8659 H2X POP 70 23.000 14.770 30.320 1.00 0.00 ATOM 8660 H2Y POP 70 24.600 15.750 30.130 1.00 0.00 ATOM 8661 C23 POP 70 21.190 18.510 27.130 1.00 0.00 ATOM 8662 H3R POP 70 20.270 19.120 27.000 1.00 0.00 ATOM 8663 H3S POP 70 22.100 19.140 27.010 1.00 0.00 ATOM 8664 C24 POP 70 21.290 17.960 28.550 1.00 0.00 ATOM 8665 H4R POP 70 21.500 18.840 29.200 1.00 0.00 ATOM 8666 H4S POP 70 22.190 17.350 28.790 1.00 0.00 ATOM 8667 C25 POP 70 20.010 17.250 28.980 1.00 0.00 ATOM 8668 H5R POP 70 19.750 16.500 28.190 1.00 0.00 ATOM 8669 H5S POP 70 19.100 17.880 29.000 1.00 0.00 ATOM 8670 C26 POP 70 20.080 16.580 30.350 1.00 0.00 ATOM 8671 H6R POP 70 19.780 17.340 31.120 1.00 0.00 ATOM 8672 H6S POP 70 21.120 16.260 30.540 1.00 0.00 ATOM 8673 C27 POP 70 19.170 15.350 30.340 1.00 0.00 ATOM 8674 H7R POP 70 19.320 14.680 29.470 1.00 0.00 ATOM 8675 H7S POP 70 18.080 15.590 30.410 1.00 0.00 ATOM 8676 C28 POP 70 19.360 14.450 31.560 1.00 0.00 ATOM 8677 H8R POP 70 20.370 13.980 31.480 1.00 0.00 ATOM 8678 H8S POP 70 18.640 13.640 31.310 1.00 0.00 ATOM 8679 C29 POP 70 19.020 14.810 32.970 1.00 0.00 ATOM 8680 H91 POP 70 18.010 14.560 33.340 1.00 0.00 ATOM 8681 0C21 POP 70 19.690 15.490 33.910 1.00 0.00 ATOM 8682 1H10 POP 70 19.310 15.670 34.930 1.00 0.00 ATOM 8683 1C21 POP 70 21.090 16.000 33.720 1.00 0.00 ATOM 8684 H11R POP 70 21.430 15.760 32.690 1.00 0.00 ATOM 8685 H11S POP 70 21.720 15.380 34.380 1.00 0.00 ATOM 8686 2C21 POP 70 21.280 17.500 33.980 1.00 0.00 ATOM 8687 H12R POP 70 20.790 17.590 34.970 1.00 0.00 ATOM 8688 H12S POP 70 20.780 18.190 33.270 1.00 0.00 ATOM 8689 3C21 POP 70 22.750 17.930 33.990 1.00 0.00 ATOM 8690 H13R POP 70 23.420 17.110 34.320 1.00 0.00 ATOM 8691 H13S POP 70 22.820 18.720 34.770 1.00 0.00 ATOM 8692 4C21 POP 70 23.140 18.570 32.660 1.00 0.00 ATOM 8693 H14R POP 70 22.510 19.440 32.410 1.00 0.00 ATOM 8694 H14S POP 70 23.130 17.800 31.850 1.00 0.00 ATOM 8695 5C21 POP 70 24.560 19.140 32.740 1.00 0.00 ATOM 8696 H15R POP 70 25.340 18.430 33.090 1.00 0.00 ATOM 8697 H15S POP 70 24.540 19.950 33.500 1.00 0.00 ATOM 8698 6C21 POP 70 25.090 19.730 31.430 1.00 0.00 ATOM 8699 H16R POP 70 24.240 20.190 30.870 1.00 0.00 ATOM 8700 H16S POP 70 25.410 18.840 30.850 1.00 0.00 ATOM 8701 7C21 POP 70 26.170 20.800 31.570 1.00 0.00 ATOM 8702 H17R POP 70 26.960 20.200 32.050 1.00 0.00 ATOM 8703 H17S POP 70 25.880 21.640 32.230 1.00 0.00 ATOM 8704 8C21 POP 70 26.670 21.300 30.210 1.00 0.00 ATOM 8705 H18R POP 70 26.790 20.380 29.600 1.00 0.00 ATOM 8706 H18S POP 70 27.670 21.740 30.430 1.00 0.00 ATOM 8707 H18T POP 70 25.930 21.920 29.660 1.00 0.00 ATOM 8708 C33 POP 70 24.820 13.690 30.480 1.00 0.00 ATOM 8709 H3X POP 70 25.910 13.720 30.300 1.00 0.00 ATOM 8710 H3Y POP 70 24.480 12.680 30.150 1.00 0.00 ATOM 8711 C34 POP 70 24.430 13.610 31.960 1.00 0.00 ATOM 8712 H4X POP 70 23.360 13.290 31.950 1.00 0.00 ATOM 8713 H4Y POP 70 24.520 14.600 32.450 1.00 0.00 ATOM 8714 C35 POP 70 25.160 12.650 32.910 1.00 0.00 ATOM 8715 H5X POP 70 26.170 13.050 33.110 1.00 0.00 ATOM 8716 H5Y POP 70 25.250 11.640 32.460 1.00 0.00 ATOM 8717 C36 POP 70 24.280 12.500 34.150 1.00 0.00 ATOM 8718 H6X POP 70 23.230 12.200 33.990 1.00 0.00 ATOM 8719 H6Y POP 70 24.140 13.500 34.610 1.00 0.00 ATOM 8720 C37 POP 70 24.930 11.580 35.190 1.00 0.00 ATOM 8721 H7X POP 70 25.910 11.940 35.570 1.00 0.00 ATOM 8722 H7Y POP 70 25.220 10.670 34.630 1.00 0.00 ATOM 8723 C38 POP 70 24.130 11.350 36.480 1.00 0.00 ATOM 8724 H8X POP 70 23.100 11.120 36.140 1.00 0.00 ATOM 8725 H8Y POP 70 24.210 12.300 37.040 1.00 0.00 ATOM 8726 C39 POP 70 24.750 10.210 37.280 1.00 0.00 ATOM 8727 H9X POP 70 25.720 10.540 37.700 1.00 0.00 ATOM 8728 H9Y POP 70 24.920 9.270 36.700 1.00 0.00 ATOM 8729 0C31 POP 70 23.910 9.840 38.510 1.00 0.00 ATOM 8730 H10X POP 70 24.470 9.010 38.980 1.00 0.00 ATOM 8731 H10Y POP 70 22.960 9.350 38.190 1.00 0.00 ATOM 8732 1C31 POP 70 23.520 10.920 39.520 1.00 0.00 ATOM 8733 H11X POP 70 23.110 11.830 39.020 1.00 0.00 ATOM 8734 H11Y POP 70 24.490 11.240 39.950 1.00 0.00 ATOM 8735 2C31 POP 70 22.580 10.400 40.610 1.00 0.00 ATOM 8736 H12X POP 70 22.750 11.250 41.300 1.00 0.00 ATOM 8737 H12Y POP 70 23.000 9.510 41.120 1.00 0.00 ATOM 8738 3C31 POP 70 21.100 10.230 40.270 1.00 0.00 ATOM 8739 H13X POP 70 21.130 9.380 39.550 1.00 0.00 ATOM 8740 H13Y POP 70 20.800 11.160 39.730 1.00 0.00 ATOM 8741 4C31 POP 70 20.090 9.990 41.390 1.00 0.00 ATOM 8742 H14X POP 70 19.020 9.890 41.100 1.00 0.00 ATOM 8743 H14Y POP 70 20.160 10.930 41.970 1.00 0.00 ATOM 8744 5C31 POP 70 20.330 8.750 42.260 1.00 0.00 ATOM 8745 H15X POP 70 21.390 8.800 42.570 1.00 0.00 ATOM 8746 H15Y POP 70 20.250 7.870 41.580 1.00 0.00 ATOM 8747 6C31 POP 70 19.390 8.600 43.450 1.00 0.00 ATOM 8748 H16X POP 70 19.340 9.550 44.030 1.00 0.00 ATOM 8749 H16Y POP 70 19.710 7.850 44.210 1.00 0.00 ATOM 8750 H16Z POP 70 18.440 8.240 43.010 1.00 0.00 ATOM 8751 N POP 71 32.580 50.800 24.350 1.00 0.00 ATOM 8752 HN1 POP 71 32.970 49.870 24.630 1.00 0.00 ATOM 8753 HN2 POP 71 33.110 51.480 24.940 1.00 0.00 ATOM 8754 HN3 POP 71 31.570 50.980 24.530 1.00 0.00 ATOM 8755 C12 POP 71 32.930 51.030 22.900 1.00 0.00 ATOM 8756 H12A POP 71 32.580 52.050 22.640 1.00 0.00 ATOM 8757 H12B POP 71 32.450 50.330 22.180 1.00 0.00 ATOM 8758 C11 POP 71 34.440 51.230 22.740 1.00 0.00 ATOM 8759 H11A POP 71 34.620 52.030 21.990 1.00 0.00 ATOM 8760 H11B POP 71 34.900 50.260 22.450 1.00 0.00 ATOM 8761 P POP 71 36.580 52.010 23.770 1.00 0.00 ATOM 8762 O13 POP 71 36.710 53.360 23.180 1.00 0.00 ATOM 8763 O14 POP 71 37.320 50.930 23.070 1.00 0.00 ATOM 8764 O11 POP 71 37.050 52.010 25.300 1.00 0.00 ATOM 8765 O12 POP 71 35.030 51.650 23.960 1.00 0.00 ATOM 8766 C1 POP 71 36.820 50.910 26.180 1.00 0.00 ATOM 8767 HA POP 71 37.460 51.000 27.080 1.00 0.00 ATOM 8768 HB POP 71 36.980 49.910 25.720 1.00 0.00 ATOM 8769 C2 POP 71 35.380 50.760 26.700 1.00 0.00 ATOM 8770 HS POP 71 34.650 50.570 25.880 1.00 0.00 ATOM 8771 O21 POP 71 34.990 51.940 27.390 1.00 0.00 ATOM 8772 C21 POP 71 33.670 52.040 27.520 1.00 0.00 ATOM 8773 O22 POP 71 32.840 51.410 26.900 1.00 0.00 ATOM 8774 C22 POP 71 33.270 53.180 28.450 1.00 0.00 ATOM 8775 H2R POP 71 32.990 54.020 27.770 1.00 0.00 ATOM 8776 H2S POP 71 34.060 53.500 29.170 1.00 0.00 ATOM 8777 C3 POP 71 35.330 49.510 27.600 1.00 0.00 ATOM 8778 HX POP 71 35.530 48.650 26.930 1.00 0.00 ATOM 8779 HY POP 71 34.300 49.360 27.990 1.00 0.00 ATOM 8780 O31 POP 71 36.310 49.600 28.640 1.00 0.00 ATOM 8781 C31 POP 71 35.930 49.950 29.870 1.00 0.00 ATOM 8782 O32 POP 71 34.840 50.360 30.230 1.00 0.00 ATOM 8783 C32 POP 71 37.180 49.990 30.730 1.00 0.00 ATOM 8784 H2X POP 71 37.960 49.300 30.340 1.00 0.00 ATOM 8785 H2Y POP 71 36.860 49.790 31.780 1.00 0.00 ATOM 8786 C23 POP 71 31.990 52.850 29.220 1.00 0.00 ATOM 8787 H3R POP 71 32.170 51.890 29.730 1.00 0.00 ATOM 8788 H3S POP 71 31.120 52.760 28.530 1.00 0.00 ATOM 8789 C24 POP 71 31.510 53.990 30.130 1.00 0.00 ATOM 8790 H4R POP 71 32.300 54.500 30.710 1.00 0.00 ATOM 8791 H4S POP 71 30.770 53.510 30.810 1.00 0.00 ATOM 8792 C25 POP 71 30.860 55.140 29.360 1.00 0.00 ATOM 8793 H5R POP 71 30.000 54.750 28.780 1.00 0.00 ATOM 8794 H5S POP 71 31.590 55.480 28.590 1.00 0.00 ATOM 8795 C26 POP 71 30.450 56.380 30.170 1.00 0.00 ATOM 8796 H6R POP 71 31.340 56.840 30.650 1.00 0.00 ATOM 8797 H6S POP 71 29.690 56.110 30.930 1.00 0.00 ATOM 8798 C27 POP 71 29.920 57.470 29.240 1.00 0.00 ATOM 8799 H7R POP 71 30.290 57.260 28.210 1.00 0.00 ATOM 8800 H7S POP 71 30.380 58.430 29.550 1.00 0.00 ATOM 8801 C28 POP 71 28.400 57.600 29.180 1.00 0.00 ATOM 8802 H8R POP 71 28.160 58.300 28.350 1.00 0.00 ATOM 8803 H8S POP 71 28.050 58.090 30.110 1.00 0.00 ATOM 8804 C29 POP 71 27.660 56.330 28.850 1.00 0.00 ATOM 8805 H91 POP 71 27.990 55.820 27.930 1.00 0.00 ATOM 8806 0C21 POP 71 26.530 55.910 29.430 1.00 0.00 ATOM 8807 1H10 POP 71 26.000 54.980 29.170 1.00 0.00 ATOM 8808 1C21 POP 71 25.900 56.400 30.710 1.00 0.00 ATOM 8809 H11R POP 71 25.380 57.380 30.630 1.00 0.00 ATOM 8810 H11S POP 71 26.760 56.480 31.410 1.00 0.00 ATOM 8811 2C21 POP 71 24.730 55.490 31.090 1.00 0.00 ATOM 8812 H12R POP 71 25.140 54.450 31.120 1.00 0.00 ATOM 8813 H12S POP 71 23.950 55.560 30.310 1.00 0.00 ATOM 8814 3C21 POP 71 24.160 55.830 32.460 1.00 0.00 ATOM 8815 H13R POP 71 23.540 56.750 32.390 1.00 0.00 ATOM 8816 H13S POP 71 24.860 55.970 33.320 1.00 0.00 ATOM 8817 4C21 POP 71 23.160 54.750 32.880 1.00 0.00 ATOM 8818 H14R POP 71 23.640 53.740 32.830 1.00 0.00 ATOM 8819 H14S POP 71 22.420 54.600 32.070 1.00 0.00 ATOM 8820 5C21 POP 71 22.620 54.870 34.310 1.00 0.00 ATOM 8821 H15R POP 71 22.300 55.930 34.340 1.00 0.00 ATOM 8822 H15S POP 71 23.370 54.750 35.120 1.00 0.00 ATOM 8823 6C21 POP 71 21.420 53.990 34.650 1.00 0.00 ATOM 8824 H16R POP 71 20.650 54.130 33.860 1.00 0.00 ATOM 8825 H16S POP 71 20.950 54.390 35.570 1.00 0.00 ATOM 8826 7C21 POP 71 21.700 52.500 34.890 1.00 0.00 ATOM 8827 H17R POP 71 22.100 52.420 35.930 1.00 0.00 ATOM 8828 H17S POP 71 22.390 52.160 34.090 1.00 0.00 ATOM 8829 8C21 POP 71 20.440 51.640 34.850 1.00 0.00 ATOM 8830 H18R POP 71 19.650 52.010 35.540 1.00 0.00 ATOM 8831 H18S POP 71 20.900 50.730 35.300 1.00 0.00 ATOM 8832 H18T POP 71 20.040 51.510 33.820 1.00 0.00 ATOM 8833 C33 POP 71 37.840 51.370 30.670 1.00 0.00 ATOM 8834 H3X POP 71 38.040 51.460 29.580 1.00 0.00 ATOM 8835 H3Y POP 71 38.870 51.230 31.070 1.00 0.00 ATOM 8836 C34 POP 71 37.200 52.590 31.330 1.00 0.00 ATOM 8837 H4X POP 71 36.170 52.670 30.920 1.00 0.00 ATOM 8838 H4Y POP 71 37.750 53.490 30.980 1.00 0.00 ATOM 8839 C35 POP 71 37.200 52.540 32.860 1.00 0.00 ATOM 8840 H5X POP 71 38.240 52.180 32.980 1.00 0.00 ATOM 8841 H5Y POP 71 36.500 51.720 33.120 1.00 0.00 ATOM 8842 C36 POP 71 36.880 53.850 33.590 1.00 0.00 ATOM 8843 H6X POP 71 35.790 54.060 33.500 1.00 0.00 ATOM 8844 H6Y POP 71 37.300 54.760 33.100 1.00 0.00 ATOM 8845 C37 POP 71 37.340 53.880 35.050 1.00 0.00 ATOM 8846 H7X POP 71 38.440 53.740 35.060 1.00 0.00 ATOM 8847 H7Y POP 71 36.960 53.000 35.620 1.00 0.00 ATOM 8848 C38 POP 71 37.070 55.140 35.880 1.00 0.00 ATOM 8849 H8X POP 71 35.990 55.380 35.800 1.00 0.00 ATOM 8850 H8Y POP 71 37.580 56.000 35.380 1.00 0.00 ATOM 8851 C39 POP 71 37.450 55.090 37.360 1.00 0.00 ATOM 8852 H9X POP 71 38.540 55.070 37.540 1.00 0.00 ATOM 8853 H9Y POP 71 37.020 54.150 37.770 1.00 0.00 ATOM 8854 0C31 POP 71 36.900 56.180 38.290 1.00 0.00 ATOM 8855 H10X POP 71 35.930 56.540 37.890 1.00 0.00 ATOM 8856 H10Y POP 71 37.580 57.060 38.300 1.00 0.00 ATOM 8857 1C31 POP 71 36.730 55.510 39.650 1.00 0.00 ATOM 8858 H11X POP 71 37.720 55.210 40.040 1.00 0.00 ATOM 8859 H11Y POP 71 36.090 54.610 39.490 1.00 0.00 ATOM 8860 2C31 POP 71 36.000 56.380 40.680 1.00 0.00 ATOM 8861 H12X POP 71 34.980 56.610 40.310 1.00 0.00 ATOM 8862 H12Y POP 71 36.530 57.350 40.770 1.00 0.00 ATOM 8863 3C31 POP 71 35.850 55.780 42.080 1.00 0.00 ATOM 8864 H13X POP 71 36.810 55.330 42.410 1.00 0.00 ATOM 8865 H13Y POP 71 35.130 54.930 41.990 1.00 0.00 ATOM 8866 4C31 POP 71 35.380 56.720 43.190 1.00 0.00 ATOM 8867 H14X POP 71 35.330 56.150 44.140 1.00 0.00 ATOM 8868 H14Y POP 71 34.340 57.070 43.030 1.00 0.00 ATOM 8869 5C31 POP 71 36.270 57.930 43.490 1.00 0.00 ATOM 8870 H15X POP 71 37.230 57.650 43.000 1.00 0.00 ATOM 8871 H15Y POP 71 36.430 58.030 44.580 1.00 0.00 ATOM 8872 6C31 POP 71 35.730 59.230 42.890 1.00 0.00 ATOM 8873 H16X POP 71 34.820 59.480 43.490 1.00 0.00 ATOM 8874 H16Y POP 71 35.370 58.960 41.880 1.00 0.00 ATOM 8875 H16Z POP 71 36.510 60.030 42.900 1.00 0.00 ATOM 8876 N POP 72 1.890 25.190 21.360 1.00 0.00 ATOM 8877 HN1 POP 72 1.790 25.020 20.340 1.00 0.00 ATOM 8878 HN2 POP 72 2.010 26.180 21.660 1.00 0.00 ATOM 8879 HN3 POP 72 2.650 24.660 21.840 1.00 0.00 ATOM 8880 C12 POP 72 0.530 24.710 21.820 1.00 0.00 ATOM 8881 H12A POP 72 0.730 24.550 22.900 1.00 0.00 ATOM 8882 H12B POP 72 0.220 23.810 21.250 1.00 0.00 ATOM 8883 C11 POP 72 -0.540 25.790 21.590 1.00 0.00 ATOM 8884 H11A POP 72 -1.450 25.550 22.190 1.00 0.00 ATOM 8885 H11B POP 72 -0.780 25.650 20.520 1.00 0.00 ATOM 8886 P POP 72 -0.760 28.370 21.550 1.00 0.00 ATOM 8887 O13 POP 72 -2.160 28.230 22.010 1.00 0.00 ATOM 8888 O14 POP 72 -0.630 28.560 20.080 1.00 0.00 ATOM 8889 O11 POP 72 0.010 29.550 22.300 1.00 0.00 ATOM 8890 O12 POP 72 0.060 27.050 21.920 1.00 0.00 ATOM 8891 C1 POP 72 1.050 29.390 23.280 1.00 0.00 ATOM 8892 HA POP 72 1.640 30.330 23.350 1.00 0.00 ATOM 8893 HB POP 72 1.790 28.630 22.960 1.00 0.00 ATOM 8894 C2 POP 72 0.530 29.060 24.690 1.00 0.00 ATOM 8895 HS POP 72 0.060 28.060 24.750 1.00 0.00 ATOM 8896 O21 POP 72 -0.580 29.910 25.010 1.00 0.00 ATOM 8897 C21 POP 72 -0.300 31.200 25.200 1.00 0.00 ATOM 8898 O22 POP 72 0.770 31.780 25.060 1.00 0.00 ATOM 8899 C22 POP 72 -1.520 31.950 25.700 1.00 0.00 ATOM 8900 H2R POP 72 -2.550 31.530 25.600 1.00 0.00 ATOM 8901 H2S POP 72 -1.510 32.850 25.050 1.00 0.00 ATOM 8902 C3 POP 72 1.800 29.190 25.550 1.00 0.00 ATOM 8903 HX POP 72 2.450 29.960 25.080 1.00 0.00 ATOM 8904 HY POP 72 2.420 28.270 25.480 1.00 0.00 ATOM 8905 O31 POP 72 1.510 29.470 26.920 1.00 0.00 ATOM 8906 C31 POP 72 2.660 29.610 27.590 1.00 0.00 ATOM 8907 O32 POP 72 3.780 29.390 27.180 1.00 0.00 ATOM 8908 C32 POP 72 2.390 30.160 28.990 1.00 0.00 ATOM 8909 H2X POP 72 1.830 29.420 29.600 1.00 0.00 ATOM 8910 H2Y POP 72 1.900 31.150 28.970 1.00 0.00 ATOM 8911 C23 POP 72 -1.360 32.220 27.200 1.00 0.00 ATOM 8912 H3R POP 72 -2.070 33.030 27.460 1.00 0.00 ATOM 8913 H3S POP 72 -0.330 32.600 27.310 1.00 0.00 ATOM 8914 C24 POP 72 -1.460 30.960 28.060 1.00 0.00 ATOM 8915 H4R POP 72 -0.840 31.110 28.970 1.00 0.00 ATOM 8916 H4S POP 72 -1.140 30.070 27.490 1.00 0.00 ATOM 8917 C25 POP 72 -2.890 30.740 28.580 1.00 0.00 ATOM 8918 H5R POP 72 -3.360 30.250 27.710 1.00 0.00 ATOM 8919 H5S POP 72 -3.400 31.710 28.760 1.00 0.00 ATOM 8920 C26 POP 72 -2.990 29.880 29.840 1.00 0.00 ATOM 8921 H6R POP 72 -2.630 28.840 29.700 1.00 0.00 ATOM 8922 H6S POP 72 -4.070 29.760 30.040 1.00 0.00 ATOM 8923 C27 POP 72 -2.390 30.560 31.080 1.00 0.00 ATOM 8924 H7R POP 72 -2.920 31.530 31.100 1.00 0.00 ATOM 8925 H7S POP 72 -1.320 30.840 30.930 1.00 0.00 ATOM 8926 C28 POP 72 -2.370 29.880 32.450 1.00 0.00 ATOM 8927 H8R POP 72 -1.780 30.520 33.140 1.00 0.00 ATOM 8928 H8S POP 72 -1.880 28.890 32.430 1.00 0.00 ATOM 8929 C29 POP 72 -3.780 29.690 32.950 1.00 0.00 ATOM 8930 H91 POP 72 -4.580 29.510 32.220 1.00 0.00 ATOM 8931 0C21 POP 72 -4.250 29.700 34.210 1.00 0.00 ATOM 8932 1H10 POP 72 -5.260 29.320 34.420 1.00 0.00 ATOM 8933 1C21 POP 72 -3.380 29.870 35.420 1.00 0.00 ATOM 8934 H11R POP 72 -2.330 30.050 35.120 1.00 0.00 ATOM 8935 H11S POP 72 -3.520 28.950 36.020 1.00 0.00 ATOM 8936 2C21 POP 72 -3.980 31.080 36.150 1.00 0.00 ATOM 8937 H12R POP 72 -5.030 30.810 36.400 1.00 0.00 ATOM 8938 H12S POP 72 -4.010 31.970 35.490 1.00 0.00 ATOM 8939 3C21 POP 72 -3.260 31.530 37.420 1.00 0.00 ATOM 8940 H13R POP 72 -3.530 32.540 37.810 1.00 0.00 ATOM 8941 H13S POP 72 -2.220 31.610 37.030 1.00 0.00 ATOM 8942 4C21 POP 72 -3.300 30.560 38.600 1.00 0.00 ATOM 8943 H14R POP 72 -3.470 29.520 38.260 1.00 0.00 ATOM 8944 H14S POP 72 -4.180 30.800 39.240 1.00 0.00 ATOM 8945 5C21 POP 72 -2.050 30.650 39.470 1.00 0.00 ATOM 8946 H15R POP 72 -1.280 30.100 38.870 1.00 0.00 ATOM 8947 H15S POP 72 -2.120 30.100 40.440 1.00 0.00 ATOM 8948 6C21 POP 72 -1.500 32.040 39.770 1.00 0.00 ATOM 8949 H16R POP 72 -1.220 32.560 38.820 1.00 0.00 ATOM 8950 H16S POP 72 -0.670 32.050 40.510 1.00 0.00 ATOM 8951 7C21 POP 72 -2.540 32.940 40.440 1.00 0.00 ATOM 8952 H17R POP 72 -3.400 33.070 39.740 1.00 0.00 ATOM 8953 H17S POP 72 -1.920 33.860 40.420 1.00 0.00 ATOM 8954 8C21 POP 72 -3.040 32.540 41.830 1.00 0.00 ATOM 8955 H18R POP 72 -4.030 32.980 42.060 1.00 0.00 ATOM 8956 H18S POP 72 -2.310 32.990 42.540 1.00 0.00 ATOM 8957 H18T POP 72 -2.940 31.440 41.930 1.00 0.00 ATOM 8958 C33 POP 72 3.730 30.500 29.650 1.00 0.00 ATOM 8959 H3X POP 72 4.070 31.550 29.480 1.00 0.00 ATOM 8960 H3Y POP 72 4.600 29.860 29.370 1.00 0.00 ATOM 8961 C34 POP 72 3.620 30.300 31.160 1.00 0.00 ATOM 8962 H4X POP 72 4.630 30.650 31.440 1.00 0.00 ATOM 8963 H4Y POP 72 3.570 29.200 31.320 1.00 0.00 ATOM 8964 C35 POP 72 2.560 31.080 31.930 1.00 0.00 ATOM 8965 H5X POP 72 1.570 30.620 31.720 1.00 0.00 ATOM 8966 H5Y POP 72 2.430 32.120 31.550 1.00 0.00 ATOM 8967 C36 POP 72 2.770 31.020 33.450 1.00 0.00 ATOM 8968 H6X POP 72 3.750 31.480 33.720 1.00 0.00 ATOM 8969 H6Y POP 72 2.720 30.020 33.940 1.00 0.00 ATOM 8970 C37 POP 72 1.680 31.840 34.140 1.00 0.00 ATOM 8971 H7X POP 72 0.720 31.350 33.850 1.00 0.00 ATOM 8972 H7Y POP 72 1.770 32.870 33.740 1.00 0.00 ATOM 8973 C38 POP 72 1.520 31.880 35.660 1.00 0.00 ATOM 8974 H8X POP 72 1.090 30.910 35.980 1.00 0.00 ATOM 8975 H8Y POP 72 0.770 32.700 35.800 1.00 0.00 ATOM 8976 C39 POP 72 2.820 32.040 36.450 1.00 0.00 ATOM 8977 H9X POP 72 3.300 33.010 36.220 1.00 0.00 ATOM 8978 H9Y POP 72 3.480 31.250 36.040 1.00 0.00 ATOM 8979 0C31 POP 72 2.710 31.820 37.960 1.00 0.00 ATOM 8980 H10X POP 72 2.300 30.790 37.930 1.00 0.00 ATOM 8981 H10Y POP 72 1.940 32.470 38.430 1.00 0.00 ATOM 8982 1C31 POP 72 4.000 31.930 38.780 1.00 0.00 ATOM 8983 H11X POP 72 4.770 32.380 38.120 1.00 0.00 ATOM 8984 H11Y POP 72 4.410 30.940 39.090 1.00 0.00 ATOM 8985 2C31 POP 72 3.940 32.870 39.990 1.00 0.00 ATOM 8986 H12X POP 72 5.000 33.180 40.140 1.00 0.00 ATOM 8987 H12Y POP 72 3.240 33.690 39.720 1.00 0.00 ATOM 8988 3C31 POP 72 3.460 32.320 41.330 1.00 0.00 ATOM 8989 H13X POP 72 3.710 31.230 41.360 1.00 0.00 ATOM 8990 H13Y POP 72 2.360 32.420 41.340 1.00 0.00 ATOM 8991 4C31 POP 72 4.120 33.130 42.450 1.00 0.00 ATOM 8992 H14X POP 72 3.680 34.160 42.450 1.00 0.00 ATOM 8993 H14Y POP 72 5.220 33.120 42.320 1.00 0.00 ATOM 8994 5C31 POP 72 3.740 32.560 43.820 1.00 0.00 ATOM 8995 H15X POP 72 4.480 31.730 43.870 1.00 0.00 ATOM 8996 H15Y POP 72 2.690 32.220 43.770 1.00 0.00 ATOM 8997 6C31 POP 72 3.910 33.560 44.960 1.00 0.00 ATOM 8998 H16X POP 72 3.650 33.260 46.000 1.00 0.00 ATOM 8999 H16Y POP 72 3.270 34.440 44.740 1.00 0.00 ATOM 9000 H16Z POP 72 4.960 33.920 44.890 1.00 0.00 ATOM 9001 N POP 73 54.730 48.340 16.030 1.00 0.00 ATOM 9002 HN1 POP 73 54.110 47.740 16.620 1.00 0.00 ATOM 9003 HN2 POP 73 54.650 49.300 16.400 1.00 0.00 ATOM 9004 HN3 POP 73 54.300 48.320 15.090 1.00 0.00 ATOM 9005 C12 POP 73 56.150 47.860 15.850 1.00 0.00 ATOM 9006 H12A POP 73 56.700 48.620 15.250 1.00 0.00 ATOM 9007 H12B POP 73 56.020 46.960 15.220 1.00 0.00 ATOM 9008 C11 POP 73 56.710 47.480 17.220 1.00 0.00 ATOM 9009 H11A POP 73 56.520 48.280 17.960 1.00 0.00 ATOM 9010 H11B POP 73 57.810 47.470 17.070 1.00 0.00 ATOM 9011 P POP 73 56.090 46.110 19.190 1.00 0.00 ATOM 9012 O13 POP 73 55.600 44.770 19.560 1.00 0.00 ATOM 9013 O14 POP 73 55.250 47.280 19.560 1.00 0.00 ATOM 9014 O11 POP 73 57.560 46.410 19.710 1.00 0.00 ATOM 9015 O12 POP 73 56.210 46.190 17.590 1.00 0.00 ATOM 9016 C1 POP 73 58.580 45.440 19.460 1.00 0.00 ATOM 9017 HA POP 73 59.250 45.850 18.690 1.00 0.00 ATOM 9018 HB POP 73 58.160 44.450 19.140 1.00 0.00 ATOM 9019 C2 POP 73 59.410 45.230 20.730 1.00 0.00 ATOM 9020 HS POP 73 60.360 44.740 20.440 1.00 0.00 ATOM 9021 O21 POP 73 58.620 44.450 21.630 1.00 0.00 ATOM 9022 C21 POP 73 59.010 43.170 21.640 1.00 0.00 ATOM 9023 O22 POP 73 59.990 42.710 21.090 1.00 0.00 ATOM 9024 C22 POP 73 58.040 42.320 22.450 1.00 0.00 ATOM 9025 H2R POP 73 57.980 41.320 21.970 1.00 0.00 ATOM 9026 H2S POP 73 57.060 42.840 22.500 1.00 0.00 ATOM 9027 C3 POP 73 59.830 46.530 21.450 1.00 0.00 ATOM 9028 HX POP 73 59.120 47.350 21.190 1.00 0.00 ATOM 9029 HY POP 73 60.780 46.850 20.970 1.00 0.00 ATOM 9030 O31 POP 73 59.950 46.630 22.870 1.00 0.00 ATOM 9031 C31 POP 73 60.890 45.830 23.390 1.00 0.00 ATOM 9032 O32 POP 73 61.650 45.120 22.750 1.00 0.00 ATOM 9033 C32 POP 73 60.750 45.860 24.900 1.00 0.00 ATOM 9034 H2X POP 73 59.710 45.590 25.160 1.00 0.00 ATOM 9035 H2Y POP 73 60.970 46.900 25.220 1.00 0.00 ATOM 9036 C23 POP 73 58.720 42.230 23.820 1.00 0.00 ATOM 9037 H3R POP 73 58.990 43.240 24.210 1.00 0.00 ATOM 9038 H3S POP 73 59.640 41.620 23.670 1.00 0.00 ATOM 9039 C24 POP 73 58.120 41.510 25.020 1.00 0.00 ATOM 9040 H4R POP 73 57.640 40.550 24.720 1.00 0.00 ATOM 9041 H4S POP 73 57.240 42.080 25.380 1.00 0.00 ATOM 9042 C25 POP 73 59.070 41.340 26.200 1.00 0.00 ATOM 9043 H5R POP 73 59.780 42.190 26.300 1.00 0.00 ATOM 9044 H5S POP 73 59.750 40.490 26.000 1.00 0.00 ATOM 9045 C26 POP 73 58.360 41.250 27.560 1.00 0.00 ATOM 9046 H6R POP 73 57.590 40.470 27.380 1.00 0.00 ATOM 9047 H6S POP 73 57.860 42.210 27.810 1.00 0.00 ATOM 9048 C27 POP 73 59.260 41.050 28.780 1.00 0.00 ATOM 9049 H7R POP 73 59.670 42.060 28.940 1.00 0.00 ATOM 9050 H7S POP 73 60.020 40.320 28.430 1.00 0.00 ATOM 9051 C28 POP 73 58.480 40.630 30.030 1.00 0.00 ATOM 9052 H8R POP 73 59.190 40.770 30.870 1.00 0.00 ATOM 9053 H8S POP 73 58.250 39.550 29.870 1.00 0.00 ATOM 9054 C29 POP 73 57.210 41.410 30.210 1.00 0.00 ATOM 9055 H91 POP 73 57.080 42.450 29.870 1.00 0.00 ATOM 9056 0C21 POP 73 56.080 40.810 30.600 1.00 0.00 ATOM 9057 1H10 POP 73 55.170 41.420 30.640 1.00 0.00 ATOM 9058 1C21 POP 73 55.980 39.360 30.990 1.00 0.00 ATOM 9059 H11R POP 73 57.000 39.060 31.320 1.00 0.00 ATOM 9060 H11S POP 73 55.850 38.730 30.090 1.00 0.00 ATOM 9061 2C21 POP 73 54.820 39.010 31.930 1.00 0.00 ATOM 9062 H12R POP 73 54.810 37.900 31.970 1.00 0.00 ATOM 9063 H12S POP 73 53.820 39.330 31.560 1.00 0.00 ATOM 9064 3C21 POP 73 55.030 39.570 33.330 1.00 0.00 ATOM 9065 H13R POP 73 54.940 40.670 33.310 1.00 0.00 ATOM 9066 H13S POP 73 56.070 39.450 33.720 1.00 0.00 ATOM 9067 4C21 POP 73 54.140 38.840 34.340 1.00 0.00 ATOM 9068 H14R POP 73 54.110 37.750 34.140 1.00 0.00 ATOM 9069 H14S POP 73 53.130 39.270 34.150 1.00 0.00 ATOM 9070 5C21 POP 73 54.420 39.090 35.820 1.00 0.00 ATOM 9071 H15R POP 73 54.370 40.180 36.070 1.00 0.00 ATOM 9072 H15S POP 73 55.480 38.800 35.940 1.00 0.00 ATOM 9073 6C21 POP 73 53.520 38.300 36.780 1.00 0.00 ATOM 9074 H16R POP 73 53.670 37.210 36.640 1.00 0.00 ATOM 9075 H16S POP 73 52.440 38.490 36.620 1.00 0.00 ATOM 9076 7C21 POP 73 53.870 38.590 38.240 1.00 0.00 ATOM 9077 H17R POP 73 54.910 38.920 38.450 1.00 0.00 ATOM 9078 H17S POP 73 53.660 37.610 38.710 1.00 0.00 ATOM 9079 8C21 POP 73 52.850 39.600 38.750 1.00 0.00 ATOM 9080 H18R POP 73 51.870 39.140 39.020 1.00 0.00 ATOM 9081 H18S POP 73 52.490 40.270 37.940 1.00 0.00 ATOM 9082 H18T POP 73 53.140 40.220 39.620 1.00 0.00 ATOM 9083 C33 POP 73 61.690 44.880 25.620 1.00 0.00 ATOM 9084 H3X POP 73 62.690 45.130 25.190 1.00 0.00 ATOM 9085 H3Y POP 73 61.450 43.840 25.290 1.00 0.00 ATOM 9086 C34 POP 73 61.750 45.110 27.130 1.00 0.00 ATOM 9087 H4X POP 73 62.380 45.990 27.360 1.00 0.00 ATOM 9088 H4Y POP 73 62.270 44.260 27.620 1.00 0.00 ATOM 9089 C35 POP 73 60.370 45.190 27.780 1.00 0.00 ATOM 9090 H5X POP 73 59.650 44.560 27.210 1.00 0.00 ATOM 9091 H5Y POP 73 59.900 46.190 27.650 1.00 0.00 ATOM 9092 C36 POP 73 60.550 44.820 29.260 1.00 0.00 ATOM 9093 H6X POP 73 61.480 45.400 29.480 1.00 0.00 ATOM 9094 H6Y POP 73 60.910 43.800 29.500 1.00 0.00 ATOM 9095 C37 POP 73 59.370 45.250 30.130 1.00 0.00 ATOM 9096 H7X POP 73 58.460 44.620 30.010 1.00 0.00 ATOM 9097 H7Y POP 73 59.090 46.310 29.950 1.00 0.00 ATOM 9098 C38 POP 73 59.600 44.960 31.610 1.00 0.00 ATOM 9099 H8X POP 73 60.540 45.520 31.800 1.00 0.00 ATOM 9100 H8Y POP 73 59.740 43.870 31.740 1.00 0.00 ATOM 9101 C39 POP 73 58.440 45.510 32.440 1.00 0.00 ATOM 9102 H9X POP 73 58.560 45.160 33.490 1.00 0.00 ATOM 9103 H9Y POP 73 57.500 45.100 32.000 1.00 0.00 ATOM 9104 0C31 POP 73 58.210 47.020 32.370 1.00 0.00 ATOM 9105 H10X POP 73 57.860 47.180 31.330 1.00 0.00 ATOM 9106 H10Y POP 73 59.110 47.640 32.550 1.00 0.00 ATOM 9107 1C31 POP 73 57.150 47.570 33.330 1.00 0.00 ATOM 9108 H11X POP 73 57.490 47.490 34.380 1.00 0.00 ATOM 9109 H11Y POP 73 56.250 46.930 33.260 1.00 0.00 ATOM 9110 2C31 POP 73 56.490 48.840 32.770 1.00 0.00 ATOM 9111 H12X POP 73 55.480 48.920 33.230 1.00 0.00 ATOM 9112 H12Y POP 73 56.510 48.960 31.670 1.00 0.00 ATOM 9113 3C31 POP 73 57.370 49.950 33.340 1.00 0.00 ATOM 9114 H13X POP 73 58.410 49.800 33.000 1.00 0.00 ATOM 9115 H13Y POP 73 57.350 49.820 34.450 1.00 0.00 ATOM 9116 4C31 POP 73 56.890 51.350 32.970 1.00 0.00 ATOM 9117 H14X POP 73 56.890 51.530 31.870 1.00 0.00 ATOM 9118 H14Y POP 73 57.560 52.140 33.380 1.00 0.00 ATOM 9119 5C31 POP 73 55.520 51.780 33.480 1.00 0.00 ATOM 9120 H15X POP 73 54.690 51.070 33.260 1.00 0.00 ATOM 9121 H15Y POP 73 55.220 52.690 32.920 1.00 0.00 ATOM 9122 6C31 POP 73 55.250 52.140 34.950 1.00 0.00 ATOM 9123 H16X POP 73 55.760 53.110 35.170 1.00 0.00 ATOM 9124 H16Y POP 73 55.590 51.380 35.680 1.00 0.00 ATOM 9125 H16Z POP 73 54.170 52.340 35.060 1.00 0.00 ATOM 9126 N POP 74 22.710 10.100 23.890 1.00 0.00 ATOM 9127 HN1 POP 74 22.140 9.570 24.580 1.00 0.00 ATOM 9128 HN2 POP 74 22.420 10.000 22.900 1.00 0.00 ATOM 9129 HN3 POP 74 23.640 9.650 23.990 1.00 0.00 ATOM 9130 C12 POP 74 22.800 11.560 24.280 1.00 0.00 ATOM 9131 H12A POP 74 23.260 11.570 25.290 1.00 0.00 ATOM 9132 H12B POP 74 21.750 11.920 24.300 1.00 0.00 ATOM 9133 C11 POP 74 23.640 12.450 23.360 1.00 0.00 ATOM 9134 H11A POP 74 23.550 13.460 23.810 1.00 0.00 ATOM 9135 H11B POP 74 23.170 12.440 22.350 1.00 0.00 ATOM 9136 P POP 74 26.000 13.070 22.690 1.00 0.00 ATOM 9137 O13 POP 74 26.840 12.390 21.680 1.00 0.00 ATOM 9138 O14 POP 74 25.250 14.290 22.320 1.00 0.00 ATOM 9139 O11 POP 74 26.900 13.450 23.950 1.00 0.00 ATOM 9140 O12 POP 74 24.990 11.990 23.280 1.00 0.00 ATOM 9141 C1 POP 74 28.250 12.980 24.040 1.00 0.00 ATOM 9142 HA POP 74 28.900 13.520 23.320 1.00 0.00 ATOM 9143 HB POP 74 28.320 11.910 23.760 1.00 0.00 ATOM 9144 C2 POP 74 28.920 13.110 25.420 1.00 0.00 ATOM 9145 HS POP 74 29.570 12.220 25.540 1.00 0.00 ATOM 9146 O21 POP 74 28.000 13.050 26.510 1.00 0.00 ATOM 9147 C21 POP 74 27.190 11.990 26.560 1.00 0.00 ATOM 9148 O22 POP 74 27.290 11.000 25.860 1.00 0.00 ATOM 9149 C22 POP 74 26.060 12.190 27.560 1.00 0.00 ATOM 9150 H2R POP 74 25.200 12.540 26.960 1.00 0.00 ATOM 9151 H2S POP 74 26.160 13.080 28.220 1.00 0.00 ATOM 9152 C3 POP 74 29.880 14.300 25.560 1.00 0.00 ATOM 9153 HX POP 74 29.440 15.170 25.020 1.00 0.00 ATOM 9154 HY POP 74 30.730 14.060 24.880 1.00 0.00 ATOM 9155 O31 POP 74 30.260 14.700 26.880 1.00 0.00 ATOM 9156 C31 POP 74 29.450 15.520 27.550 1.00 0.00 ATOM 9157 O32 POP 74 28.490 16.060 27.020 1.00 0.00 ATOM 9158 C32 POP 74 29.770 15.620 29.030 1.00 0.00 ATOM 9159 H2X POP 74 30.680 16.220 29.230 1.00 0.00 ATOM 9160 H2Y POP 74 29.860 14.630 29.530 1.00 0.00 ATOM 9161 C23 POP 74 25.680 10.870 28.240 1.00 0.00 ATOM 9162 H3R POP 74 25.690 9.950 27.610 1.00 0.00 ATOM 9163 H3S POP 74 24.600 11.010 28.460 1.00 0.00 ATOM 9164 C24 POP 74 26.330 10.580 29.590 1.00 0.00 ATOM 9165 H4R POP 74 26.390 11.530 30.170 1.00 0.00 ATOM 9166 H4S POP 74 27.380 10.220 29.490 1.00 0.00 ATOM 9167 C25 POP 74 25.500 9.580 30.390 1.00 0.00 ATOM 9168 H5R POP 74 25.410 8.640 29.810 1.00 0.00 ATOM 9169 H5S POP 74 24.480 9.940 30.660 1.00 0.00 ATOM 9170 C26 POP 74 26.310 9.090 31.580 1.00 0.00 ATOM 9171 H6R POP 74 26.510 10.030 32.140 1.00 0.00 ATOM 9172 H6S POP 74 27.250 8.570 31.290 1.00 0.00 ATOM 9173 C27 POP 74 25.450 8.190 32.480 1.00 0.00 ATOM 9174 H7R POP 74 25.030 7.340 31.900 1.00 0.00 ATOM 9175 H7S POP 74 24.630 8.740 32.980 1.00 0.00 ATOM 9176 C28 POP 74 26.130 7.700 33.760 1.00 0.00 ATOM 9177 H8R POP 74 26.510 8.590 34.290 1.00 0.00 ATOM 9178 H8S POP 74 26.940 6.970 33.520 1.00 0.00 ATOM 9179 C29 POP 74 25.240 6.960 34.710 1.00 0.00 ATOM 9180 H91 POP 74 24.290 6.530 34.350 1.00 0.00 ATOM 9181 0C21 POP 74 25.580 6.630 35.960 1.00 0.00 ATOM 9182 1H10 POP 74 24.850 6.110 36.600 1.00 0.00 ATOM 9183 1C21 POP 74 26.860 6.890 36.720 1.00 0.00 ATOM 9184 H11R POP 74 26.680 7.490 37.630 1.00 0.00 ATOM 9185 H11S POP 74 27.510 7.390 35.970 1.00 0.00 ATOM 9186 2C21 POP 74 27.680 5.670 37.150 1.00 0.00 ATOM 9187 H12R POP 74 28.700 6.070 37.320 1.00 0.00 ATOM 9188 H12S POP 74 27.730 4.850 36.400 1.00 0.00 ATOM 9189 3C21 POP 74 27.210 5.040 38.460 1.00 0.00 ATOM 9190 H13R POP 74 26.280 4.460 38.280 1.00 0.00 ATOM 9191 H13S POP 74 26.990 5.820 39.220 1.00 0.00 ATOM 9192 4C21 POP 74 28.130 4.060 39.190 1.00 0.00 ATOM 9193 H14R POP 74 29.120 4.510 39.400 1.00 0.00 ATOM 9194 H14S POP 74 28.300 3.180 38.540 1.00 0.00 ATOM 9195 5C21 POP 74 27.650 3.580 40.560 1.00 0.00 ATOM 9196 H15R POP 74 27.830 4.470 41.200 1.00 0.00 ATOM 9197 H15S POP 74 28.210 2.710 40.980 1.00 0.00 ATOM 9198 6C21 POP 74 26.170 3.210 40.620 1.00 0.00 ATOM 9199 H16R POP 74 26.080 2.480 39.780 1.00 0.00 ATOM 9200 H16S POP 74 25.550 4.120 40.520 1.00 0.00 ATOM 9201 7C21 POP 74 25.820 2.420 41.880 1.00 0.00 ATOM 9202 H17R POP 74 25.590 3.080 42.750 1.00 0.00 ATOM 9203 H17S POP 74 26.650 1.750 42.190 1.00 0.00 ATOM 9204 8C21 POP 74 24.570 1.550 41.780 1.00 0.00 ATOM 9205 H18R POP 74 24.700 0.590 41.240 1.00 0.00 ATOM 9206 H18S POP 74 23.810 2.100 41.190 1.00 0.00 ATOM 9207 H18T POP 74 24.100 1.260 42.750 1.00 0.00 ATOM 9208 C33 POP 74 28.580 16.270 29.750 1.00 0.00 ATOM 9209 H3X POP 74 27.700 15.600 29.700 1.00 0.00 ATOM 9210 H3Y POP 74 28.310 17.240 29.280 1.00 0.00 ATOM 9211 C34 POP 74 29.040 16.450 31.200 1.00 0.00 ATOM 9212 H4X POP 74 29.910 17.100 31.450 1.00 0.00 ATOM 9213 H4Y POP 74 29.420 15.450 31.470 1.00 0.00 ATOM 9214 C35 POP 74 27.860 16.670 32.140 1.00 0.00 ATOM 9215 H5X POP 74 26.900 16.500 31.610 1.00 0.00 ATOM 9216 H5Y POP 74 27.950 17.710 32.520 1.00 0.00 ATOM 9217 C36 POP 74 27.870 15.930 33.480 1.00 0.00 ATOM 9218 H6X POP 74 28.880 15.820 33.930 1.00 0.00 ATOM 9219 H6Y POP 74 27.480 14.930 33.210 1.00 0.00 ATOM 9220 C37 POP 74 26.780 16.500 34.390 1.00 0.00 ATOM 9221 H7X POP 74 25.910 16.610 33.710 1.00 0.00 ATOM 9222 H7Y POP 74 27.040 17.480 34.830 1.00 0.00 ATOM 9223 C38 POP 74 26.420 15.570 35.560 1.00 0.00 ATOM 9224 H8X POP 74 26.010 14.640 35.100 1.00 0.00 ATOM 9225 H8Y POP 74 25.530 16.020 36.040 1.00 0.00 ATOM 9226 C39 POP 74 27.580 15.220 36.500 1.00 0.00 ATOM 9227 H9X POP 74 28.180 16.120 36.760 1.00 0.00 ATOM 9228 H9Y POP 74 28.210 14.530 35.900 1.00 0.00 ATOM 9229 0C31 POP 74 27.060 14.490 37.740 1.00 0.00 ATOM 9230 H10X POP 74 27.930 14.030 38.260 1.00 0.00 ATOM 9231 H10Y POP 74 26.410 13.630 37.480 1.00 0.00 ATOM 9232 1C31 POP 74 26.420 15.550 38.640 1.00 0.00 ATOM 9233 H11X POP 74 25.410 15.880 38.310 1.00 0.00 ATOM 9234 H11Y POP 74 27.010 16.490 38.580 1.00 0.00 ATOM 9235 2C31 POP 74 26.270 14.960 40.040 1.00 0.00 ATOM 9236 H12X POP 74 27.180 14.510 40.490 1.00 0.00 ATOM 9237 H12Y POP 74 25.450 14.220 40.100 1.00 0.00 ATOM 9238 3C31 POP 74 25.830 16.050 41.020 1.00 0.00 ATOM 9239 H13X POP 74 24.840 16.400 40.660 1.00 0.00 ATOM 9240 H13Y POP 74 26.490 16.940 40.900 1.00 0.00 ATOM 9241 4C31 POP 74 25.740 15.510 42.450 1.00 0.00 ATOM 9242 H14X POP 74 26.730 15.050 42.630 1.00 0.00 ATOM 9243 H14Y POP 74 24.890 14.800 42.550 1.00 0.00 ATOM 9244 5C31 POP 74 25.400 16.590 43.480 1.00 0.00 ATOM 9245 H15X POP 74 24.340 16.850 43.230 1.00 0.00 ATOM 9246 H15Y POP 74 26.100 17.440 43.370 1.00 0.00 ATOM 9247 6C31 POP 74 25.430 16.050 44.900 1.00 0.00 ATOM 9248 H16X POP 74 24.740 16.640 45.530 1.00 0.00 ATOM 9249 H16Y POP 74 26.470 16.060 45.320 1.00 0.00 ATOM 9250 H16Z POP 74 25.130 14.980 44.960 1.00 0.00 ATOM 9251 N POP 75 38.870 46.720 24.620 1.00 0.00 ATOM 9252 HN1 POP 75 39.750 46.230 24.340 1.00 0.00 ATOM 9253 HN2 POP 75 38.990 47.750 24.660 1.00 0.00 ATOM 9254 HN3 POP 75 38.510 46.420 25.550 1.00 0.00 ATOM 9255 C12 POP 75 37.790 46.370 23.630 1.00 0.00 ATOM 9256 H12A POP 75 37.430 45.340 23.830 1.00 0.00 ATOM 9257 H12B POP 75 38.380 46.240 22.700 1.00 0.00 ATOM 9258 C11 POP 75 36.570 47.290 23.580 1.00 0.00 ATOM 9259 H11A POP 75 36.050 47.320 22.600 1.00 0.00 ATOM 9260 H11B POP 75 36.890 48.290 23.940 1.00 0.00 ATOM 9261 P POP 75 34.190 47.020 24.640 1.00 0.00 ATOM 9262 O13 POP 75 33.650 46.750 23.290 1.00 0.00 ATOM 9263 O14 POP 75 33.960 48.380 25.180 1.00 0.00 ATOM 9264 O11 POP 75 33.530 46.010 25.690 1.00 0.00 ATOM 9265 O12 POP 75 35.760 46.720 24.610 1.00 0.00 ATOM 9266 C1 POP 75 32.130 45.750 25.610 1.00 0.00 ATOM 9267 HA POP 75 31.920 44.830 26.200 1.00 0.00 ATOM 9268 HB POP 75 31.800 45.460 24.590 1.00 0.00 ATOM 9269 C2 POP 75 31.250 46.920 26.090 1.00 0.00 ATOM 9270 HS POP 75 31.240 47.810 25.430 1.00 0.00 ATOM 9271 O21 POP 75 31.680 47.210 27.420 1.00 0.00 ATOM 9272 C21 POP 75 31.280 48.430 27.780 1.00 0.00 ATOM 9273 O22 POP 75 30.630 49.150 27.050 1.00 0.00 ATOM 9274 C22 POP 75 31.790 48.700 29.190 1.00 0.00 ATOM 9275 H2R POP 75 31.890 49.810 29.140 1.00 0.00 ATOM 9276 H2S POP 75 32.770 48.200 29.250 1.00 0.00 ATOM 9277 C3 POP 75 29.800 46.410 26.080 1.00 0.00 ATOM 9278 HX POP 75 29.670 46.210 25.000 1.00 0.00 ATOM 9279 HY POP 75 29.220 47.300 26.400 1.00 0.00 ATOM 9280 O31 POP 75 29.580 45.240 26.880 1.00 0.00 ATOM 9281 C31 POP 75 29.080 45.540 28.080 1.00 0.00 ATOM 9282 O32 POP 75 28.830 46.650 28.530 1.00 0.00 ATOM 9283 C32 POP 75 29.030 44.270 28.910 1.00 0.00 ATOM 9284 H2X POP 75 29.500 43.420 28.380 1.00 0.00 ATOM 9285 H2Y POP 75 27.950 44.110 29.120 1.00 0.00 ATOM 9286 C23 POP 75 30.820 48.180 30.260 1.00 0.00 ATOM 9287 H3R POP 75 30.880 47.080 30.390 1.00 0.00 ATOM 9288 H3S POP 75 29.800 48.550 30.030 1.00 0.00 ATOM 9289 C24 POP 75 31.260 48.590 31.670 1.00 0.00 ATOM 9290 H4R POP 75 32.300 48.200 31.710 1.00 0.00 ATOM 9291 H4S POP 75 30.580 48.020 32.330 1.00 0.00 ATOM 9292 C25 POP 75 31.190 50.090 31.990 1.00 0.00 ATOM 9293 H5R POP 75 30.330 50.490 31.420 1.00 0.00 ATOM 9294 H5S POP 75 32.070 50.460 31.420 1.00 0.00 ATOM 9295 C26 POP 75 31.170 50.660 33.410 1.00 0.00 ATOM 9296 H6R POP 75 31.960 50.140 33.990 1.00 0.00 ATOM 9297 H6S POP 75 30.210 50.350 33.880 1.00 0.00 ATOM 9298 C27 POP 75 31.250 52.180 33.440 1.00 0.00 ATOM 9299 H7R POP 75 31.060 52.620 34.440 1.00 0.00 ATOM 9300 H7S POP 75 30.560 52.770 32.790 1.00 0.00 ATOM 9301 C28 POP 75 32.650 52.780 33.250 1.00 0.00 ATOM 9302 H8R POP 75 32.560 53.850 32.970 1.00 0.00 ATOM 9303 H8S POP 75 33.150 52.240 32.420 1.00 0.00 ATOM 9304 C29 POP 75 33.540 52.480 34.420 1.00 0.00 ATOM 9305 H91 POP 75 34.140 51.590 34.190 1.00 0.00 ATOM 9306 0C21 POP 75 33.610 53.080 35.620 1.00 0.00 ATOM 9307 1H10 POP 75 34.340 52.780 36.380 1.00 0.00 ATOM 9308 1C21 POP 75 32.800 54.280 36.030 1.00 0.00 ATOM 9309 H11R POP 75 31.940 54.540 35.370 1.00 0.00 ATOM 9310 H11S POP 75 33.420 55.190 36.180 1.00 0.00 ATOM 9311 2C21 POP 75 32.170 53.740 37.320 1.00 0.00 ATOM 9312 H12R POP 75 33.050 53.360 37.880 1.00 0.00 ATOM 9313 H12S POP 75 31.510 52.860 37.140 1.00 0.00 ATOM 9314 3C21 POP 75 31.470 54.830 38.130 1.00 0.00 ATOM 9315 H13R POP 75 30.980 54.240 38.930 1.00 0.00 ATOM 9316 H13S POP 75 30.670 55.280 37.490 1.00 0.00 ATOM 9317 4C21 POP 75 32.380 55.920 38.690 1.00 0.00 ATOM 9318 H14R POP 75 32.430 56.800 38.010 1.00 0.00 ATOM 9319 H14S POP 75 33.430 55.550 38.730 1.00 0.00 ATOM 9320 5C21 POP 75 31.880 56.590 39.970 1.00 0.00 ATOM 9321 H15R POP 75 32.640 57.260 40.430 1.00 0.00 ATOM 9322 H15S POP 75 31.510 55.920 40.770 1.00 0.00 ATOM 9323 6C21 POP 75 30.590 57.380 39.740 1.00 0.00 ATOM 9324 H16R POP 75 29.880 56.550 39.570 1.00 0.00 ATOM 9325 H16S POP 75 30.580 58.100 38.890 1.00 0.00 ATOM 9326 7C21 POP 75 29.990 58.020 41.000 1.00 0.00 ATOM 9327 H17R POP 75 30.520 58.950 41.290 1.00 0.00 ATOM 9328 H17S POP 75 30.210 57.280 41.790 1.00 0.00 ATOM 9329 8C21 POP 75 28.480 58.240 40.990 1.00 0.00 ATOM 9330 H18R POP 75 28.210 58.660 40.000 1.00 0.00 ATOM 9331 H18S POP 75 28.130 58.830 41.870 1.00 0.00 ATOM 9332 H18T POP 75 27.840 57.330 41.000 1.00 0.00 ATOM 9333 C33 POP 75 29.890 44.420 30.170 1.00 0.00 ATOM 9334 H3X POP 75 29.550 45.410 30.550 1.00 0.00 ATOM 9335 H3Y POP 75 30.990 44.260 30.120 1.00 0.00 ATOM 9336 C34 POP 75 29.590 43.500 31.350 1.00 0.00 ATOM 9337 H4X POP 75 29.900 42.460 31.130 1.00 0.00 ATOM 9338 H4Y POP 75 28.490 43.410 31.470 1.00 0.00 ATOM 9339 C35 POP 75 30.180 44.030 32.660 1.00 0.00 ATOM 9340 H5X POP 75 30.540 45.080 32.560 1.00 0.00 ATOM 9341 H5Y POP 75 31.030 43.390 32.970 1.00 0.00 ATOM 9342 C36 POP 75 29.140 43.780 33.750 1.00 0.00 ATOM 9343 H6X POP 75 28.890 42.710 33.570 1.00 0.00 ATOM 9344 H6Y POP 75 28.250 44.440 33.720 1.00 0.00 ATOM 9345 C37 POP 75 29.640 43.840 35.190 1.00 0.00 ATOM 9346 H7X POP 75 30.210 44.780 35.280 1.00 0.00 ATOM 9347 H7Y POP 75 30.470 43.120 35.020 1.00 0.00 ATOM 9348 C38 POP 75 28.590 43.630 36.290 1.00 0.00 ATOM 9349 H8X POP 75 27.890 42.810 36.030 1.00 0.00 ATOM 9350 H8Y POP 75 27.830 44.430 36.120 1.00 0.00 ATOM 9351 C39 POP 75 29.070 43.430 37.720 1.00 0.00 ATOM 9352 H9X POP 75 29.760 42.560 37.630 1.00 0.00 ATOM 9353 H9Y POP 75 28.280 43.020 38.380 1.00 0.00 ATOM 9354 0C31 POP 75 29.710 44.610 38.460 1.00 0.00 ATOM 9355 H10X POP 75 28.980 45.450 38.460 1.00 0.00 ATOM 9356 H10Y POP 75 30.630 44.840 37.870 1.00 0.00 ATOM 9357 1C31 POP 75 30.140 44.350 39.900 1.00 0.00 ATOM 9358 H11X POP 75 30.870 43.510 39.860 1.00 0.00 ATOM 9359 H11Y POP 75 29.220 44.100 40.480 1.00 0.00 ATOM 9360 2C31 POP 75 30.780 45.590 40.520 1.00 0.00 ATOM 9361 H12X POP 75 30.140 46.470 40.290 1.00 0.00 ATOM 9362 H12Y POP 75 31.800 45.800 40.140 1.00 0.00 ATOM 9363 3C31 POP 75 30.920 45.430 42.030 1.00 0.00 ATOM 9364 H13X POP 75 31.830 44.820 42.230 1.00 0.00 ATOM 9365 H13Y POP 75 30.070 44.760 42.310 1.00 0.00 ATOM 9366 4C31 POP 75 30.940 46.650 42.950 1.00 0.00 ATOM 9367 H14X POP 75 30.370 47.490 42.490 1.00 0.00 ATOM 9368 H14Y POP 75 31.990 46.970 43.100 1.00 0.00 ATOM 9369 5C31 POP 75 30.390 46.400 44.350 1.00 0.00 ATOM 9370 H15X POP 75 31.080 45.740 44.920 1.00 0.00 ATOM 9371 H15Y POP 75 29.400 45.900 44.430 1.00 0.00 ATOM 9372 6C31 POP 75 30.430 47.660 45.220 1.00 0.00 ATOM 9373 H16X POP 75 31.400 48.200 45.210 1.00 0.00 ATOM 9374 H16Y POP 75 30.230 47.300 46.250 1.00 0.00 ATOM 9375 H16Z POP 75 29.620 48.350 44.910 1.00 0.00 ATOM 9376 N POP 76 36.190 37.100 26.600 1.00 0.00 ATOM 9377 HN1 POP 76 35.520 37.280 25.830 1.00 0.00 ATOM 9378 HN2 POP 76 37.060 37.670 26.500 1.00 0.00 ATOM 9379 HN3 POP 76 36.440 36.090 26.540 1.00 0.00 ATOM 9380 C12 POP 76 35.420 37.310 27.880 1.00 0.00 ATOM 9381 H12A POP 76 35.060 38.360 27.950 1.00 0.00 ATOM 9382 H12B POP 76 36.010 37.050 28.790 1.00 0.00 ATOM 9383 C11 POP 76 34.230 36.350 27.840 1.00 0.00 ATOM 9384 H11A POP 76 33.620 36.490 28.760 1.00 0.00 ATOM 9385 H11B POP 76 34.730 35.360 27.820 1.00 0.00 ATOM 9386 P POP 76 32.250 35.770 26.300 1.00 0.00 ATOM 9387 O13 POP 76 32.630 34.360 26.070 1.00 0.00 ATOM 9388 O14 POP 76 31.500 36.440 25.210 1.00 0.00 ATOM 9389 O11 POP 76 31.380 35.910 27.630 1.00 0.00 ATOM 9390 O12 POP 76 33.530 36.680 26.640 1.00 0.00 ATOM 9391 C1 POP 76 30.220 36.740 27.750 1.00 0.00 ATOM 9392 HA POP 76 29.600 36.400 28.610 1.00 0.00 ATOM 9393 HB POP 76 29.590 36.480 26.870 1.00 0.00 ATOM 9394 C2 POP 76 30.570 38.230 27.710 1.00 0.00 ATOM 9395 HS POP 76 30.970 38.420 26.690 1.00 0.00 ATOM 9396 O21 POP 76 31.600 38.480 28.670 1.00 0.00 ATOM 9397 C21 POP 76 32.250 39.640 28.510 1.00 0.00 ATOM 9398 O22 POP 76 32.120 40.420 27.580 1.00 0.00 ATOM 9399 C22 POP 76 33.180 39.910 29.680 1.00 0.00 ATOM 9400 H2R POP 76 33.960 40.670 29.470 1.00 0.00 ATOM 9401 H2S POP 76 33.700 39.000 30.030 1.00 0.00 ATOM 9402 C3 POP 76 29.390 39.130 28.100 1.00 0.00 ATOM 9403 HX POP 76 28.560 38.910 27.390 1.00 0.00 ATOM 9404 HY POP 76 29.590 40.220 28.020 1.00 0.00 ATOM 9405 O31 POP 76 28.940 38.870 29.430 1.00 0.00 ATOM 9406 C31 POP 76 28.150 39.750 30.060 1.00 0.00 ATOM 9407 O32 POP 76 27.910 40.870 29.650 1.00 0.00 ATOM 9408 C32 POP 76 27.780 39.080 31.380 1.00 0.00 ATOM 9409 H2X POP 76 28.090 38.010 31.370 1.00 0.00 ATOM 9410 H2Y POP 76 26.680 39.060 31.480 1.00 0.00 ATOM 9411 C23 POP 76 32.200 40.200 30.820 1.00 0.00 ATOM 9412 H3R POP 76 31.480 39.350 30.830 1.00 0.00 ATOM 9413 H3S POP 76 31.580 41.100 30.620 1.00 0.00 ATOM 9414 C24 POP 76 32.830 40.230 32.210 1.00 0.00 ATOM 9415 H4R POP 76 33.640 40.990 32.160 1.00 0.00 ATOM 9416 H4S POP 76 33.280 39.250 32.460 1.00 0.00 ATOM 9417 C25 POP 76 32.020 40.580 33.470 1.00 0.00 ATOM 9418 H5R POP 76 31.390 39.730 33.800 1.00 0.00 ATOM 9419 H5S POP 76 31.450 41.490 33.190 1.00 0.00 ATOM 9420 C26 POP 76 32.790 41.000 34.720 1.00 0.00 ATOM 9421 H6R POP 76 32.070 41.360 35.490 1.00 0.00 ATOM 9422 H6S POP 76 33.280 41.960 34.430 1.00 0.00 ATOM 9423 C27 POP 76 33.870 40.090 35.310 1.00 0.00 ATOM 9424 H7R POP 76 34.670 39.820 34.580 1.00 0.00 ATOM 9425 H7S POP 76 33.350 39.110 35.420 1.00 0.00 ATOM 9426 C28 POP 76 34.310 40.450 36.730 1.00 0.00 ATOM 9427 H8R POP 76 34.780 41.450 36.740 1.00 0.00 ATOM 9428 H8S POP 76 35.180 39.860 37.090 1.00 0.00 ATOM 9429 C29 POP 76 33.170 40.400 37.710 1.00 0.00 ATOM 9430 H91 POP 76 32.600 39.460 37.720 1.00 0.00 ATOM 9431 0C21 POP 76 32.720 41.450 38.410 1.00 0.00 ATOM 9432 1H10 POP 76 31.820 41.330 39.030 1.00 0.00 ATOM 9433 1C21 POP 76 33.420 42.780 38.480 1.00 0.00 ATOM 9434 H11R POP 76 32.740 43.650 38.610 1.00 0.00 ATOM 9435 H11S POP 76 34.020 42.980 37.570 1.00 0.00 ATOM 9436 2C21 POP 76 34.320 42.900 39.720 1.00 0.00 ATOM 9437 H12R POP 76 34.850 43.860 39.540 1.00 0.00 ATOM 9438 H12S POP 76 34.980 42.010 39.750 1.00 0.00 ATOM 9439 3C21 POP 76 33.610 43.020 41.070 1.00 0.00 ATOM 9440 H13R POP 76 33.220 42.050 41.460 1.00 0.00 ATOM 9441 H13S POP 76 32.650 43.570 40.980 1.00 0.00 ATOM 9442 4C21 POP 76 34.490 43.610 42.170 1.00 0.00 ATOM 9443 H14R POP 76 34.260 43.130 43.150 1.00 0.00 ATOM 9444 H14S POP 76 34.340 44.710 42.210 1.00 0.00 ATOM 9445 5C21 POP 76 35.980 43.460 41.890 1.00 0.00 ATOM 9446 H15R POP 76 36.270 44.230 41.140 1.00 0.00 ATOM 9447 H15S POP 76 36.390 42.480 41.550 1.00 0.00 ATOM 9448 6C21 POP 76 36.810 43.760 43.140 1.00 0.00 ATOM 9449 H16R POP 76 37.860 43.750 42.770 1.00 0.00 ATOM 9450 H16S POP 76 36.700 42.870 43.790 1.00 0.00 ATOM 9451 7C21 POP 76 36.510 45.100 43.810 1.00 0.00 ATOM 9452 H17R POP 76 35.430 45.100 44.050 1.00 0.00 ATOM 9453 H17S POP 76 36.740 45.880 43.050 1.00 0.00 ATOM 9454 8C21 POP 76 37.270 45.440 45.100 1.00 0.00 ATOM 9455 H18R POP 76 36.990 44.700 45.870 1.00 0.00 ATOM 9456 H18S POP 76 36.900 46.430 45.440 1.00 0.00 ATOM 9457 H18T POP 76 38.370 45.490 45.000 1.00 0.00 ATOM 9458 C33 POP 76 28.370 39.830 32.570 1.00 0.00 ATOM 9459 H3X POP 76 27.950 40.860 32.540 1.00 0.00 ATOM 9460 H3Y POP 76 29.430 39.940 32.260 1.00 0.00 ATOM 9461 C34 POP 76 28.190 39.180 33.950 1.00 0.00 ATOM 9462 H4X POP 76 28.910 38.340 33.960 1.00 0.00 ATOM 9463 H4Y POP 76 27.130 38.890 34.120 1.00 0.00 ATOM 9464 C35 POP 76 28.560 40.150 35.080 1.00 0.00 ATOM 9465 H5X POP 76 27.840 41.000 35.110 1.00 0.00 ATOM 9466 H5Y POP 76 29.600 40.530 35.010 1.00 0.00 ATOM 9467 C36 POP 76 28.370 39.590 36.490 1.00 0.00 ATOM 9468 H6X POP 76 29.020 40.200 37.140 1.00 0.00 ATOM 9469 H6Y POP 76 28.820 38.570 36.480 1.00 0.00 ATOM 9470 C37 POP 76 26.960 39.900 36.990 1.00 0.00 ATOM 9471 H7X POP 76 26.270 39.340 36.320 1.00 0.00 ATOM 9472 H7Y POP 76 26.790 40.990 37.000 1.00 0.00 ATOM 9473 C38 POP 76 26.740 39.370 38.410 1.00 0.00 ATOM 9474 H8X POP 76 26.930 38.280 38.340 1.00 0.00 ATOM 9475 H8Y POP 76 25.660 39.530 38.620 1.00 0.00 ATOM 9476 C39 POP 76 27.620 40.040 39.470 1.00 0.00 ATOM 9477 H9X POP 76 27.600 41.120 39.230 1.00 0.00 ATOM 9478 H9Y POP 76 28.660 39.650 39.410 1.00 0.00 ATOM 9479 0C31 POP 76 27.240 39.710 40.920 1.00 0.00 ATOM 9480 H10X POP 76 27.740 38.750 41.150 1.00 0.00 ATOM 9481 H10Y POP 76 26.170 39.570 41.180 1.00 0.00 ATOM 9482 1C31 POP 76 27.730 40.790 41.900 1.00 0.00 ATOM 9483 H11X POP 76 27.440 40.460 42.920 1.00 0.00 ATOM 9484 H11Y POP 76 27.350 41.800 41.660 1.00 0.00 ATOM 9485 2C31 POP 76 29.240 40.770 42.130 1.00 0.00 ATOM 9486 H12X POP 76 29.740 41.460 41.410 1.00 0.00 ATOM 9487 H12Y POP 76 29.650 39.750 42.000 1.00 0.00 ATOM 9488 3C31 POP 76 29.670 41.120 43.560 1.00 0.00 ATOM 9489 H13X POP 76 29.390 40.290 44.230 1.00 0.00 ATOM 9490 H13Y POP 76 29.180 42.080 43.850 1.00 0.00 ATOM 9491 4C31 POP 76 31.180 41.290 43.750 1.00 0.00 ATOM 9492 H14X POP 76 31.430 42.220 43.210 1.00 0.00 ATOM 9493 H14Y POP 76 31.820 40.470 43.350 1.00 0.00 ATOM 9494 5C31 POP 76 31.600 41.620 45.180 1.00 0.00 ATOM 9495 H15X POP 76 31.490 40.650 45.700 1.00 0.00 ATOM 9496 H15Y POP 76 30.830 42.230 45.700 1.00 0.00 ATOM 9497 6C31 POP 76 32.910 42.380 45.370 1.00 0.00 ATOM 9498 H16X POP 76 32.930 43.190 44.600 1.00 0.00 ATOM 9499 H16Y POP 76 33.910 41.910 45.260 1.00 0.00 ATOM 9500 H16Z POP 76 32.820 42.910 46.340 1.00 0.00 ATOM 9501 N POP 77 12.990 24.160 21.770 1.00 0.00 ATOM 9502 HN1 POP 77 13.680 23.570 21.260 1.00 0.00 ATOM 9503 HN2 POP 77 12.970 23.740 22.720 1.00 0.00 ATOM 9504 HN3 POP 77 12.120 24.100 21.200 1.00 0.00 ATOM 9505 C12 POP 77 13.310 25.610 22.070 1.00 0.00 ATOM 9506 H12A POP 77 13.260 26.240 21.160 1.00 0.00 ATOM 9507 H12B POP 77 14.330 25.610 22.510 1.00 0.00 ATOM 9508 C11 POP 77 12.380 26.130 23.160 1.00 0.00 ATOM 9509 H11A POP 77 11.470 26.600 22.730 1.00 0.00 ATOM 9510 H11B POP 77 12.800 26.960 23.760 1.00 0.00 ATOM 9511 P POP 77 10.920 25.460 25.080 1.00 0.00 ATOM 9512 O13 POP 77 9.650 25.750 24.370 1.00 0.00 ATOM 9513 O14 POP 77 11.390 26.540 25.980 1.00 0.00 ATOM 9514 O11 POP 77 10.760 24.140 25.970 1.00 0.00 ATOM 9515 O12 POP 77 12.040 25.030 24.010 1.00 0.00 ATOM 9516 C1 POP 77 9.520 23.450 25.860 1.00 0.00 ATOM 9517 HA POP 77 9.610 22.690 26.660 1.00 0.00 ATOM 9518 HB POP 77 9.450 22.860 24.920 1.00 0.00 ATOM 9519 C2 POP 77 8.300 24.240 26.360 1.00 0.00 ATOM 9520 HS POP 77 7.800 24.790 25.540 1.00 0.00 ATOM 9521 O21 POP 77 8.740 25.140 27.380 1.00 0.00 ATOM 9522 C21 POP 77 7.960 26.220 27.410 1.00 0.00 ATOM 9523 O22 POP 77 7.000 26.480 26.690 1.00 0.00 ATOM 9524 C22 POP 77 8.310 26.960 28.690 1.00 0.00 ATOM 9525 H2R POP 77 9.320 27.420 28.630 1.00 0.00 ATOM 9526 H2S POP 77 8.330 26.360 29.630 1.00 0.00 ATOM 9527 C3 POP 77 7.150 23.370 26.920 1.00 0.00 ATOM 9528 HX POP 77 6.980 22.560 26.170 1.00 0.00 ATOM 9529 HY POP 77 6.260 23.990 27.150 1.00 0.00 ATOM 9530 O31 POP 77 7.640 22.660 28.060 1.00 0.00 ATOM 9531 C31 POP 77 7.460 23.100 29.300 1.00 0.00 ATOM 9532 O32 POP 77 6.700 24.010 29.630 1.00 0.00 ATOM 9533 C32 POP 77 8.150 22.160 30.270 1.00 0.00 ATOM 9534 H2X POP 77 8.930 21.640 29.680 1.00 0.00 ATOM 9535 H2Y POP 77 7.300 21.510 30.570 1.00 0.00 ATOM 9536 C23 POP 77 7.250 28.050 28.780 1.00 0.00 ATOM 9537 H3R POP 77 6.200 27.690 28.700 1.00 0.00 ATOM 9538 H3S POP 77 7.510 28.810 28.010 1.00 0.00 ATOM 9539 C24 POP 77 7.300 28.790 30.130 1.00 0.00 ATOM 9540 H4R POP 77 6.650 29.690 30.100 1.00 0.00 ATOM 9541 H4S POP 77 8.370 29.070 30.010 1.00 0.00 ATOM 9542 C25 POP 77 7.170 28.070 31.470 1.00 0.00 ATOM 9543 H5R POP 77 7.500 28.750 32.290 1.00 0.00 ATOM 9544 H5S POP 77 7.930 27.270 31.610 1.00 0.00 ATOM 9545 C26 POP 77 5.770 27.550 31.790 1.00 0.00 ATOM 9546 H6R POP 77 5.050 27.630 30.950 1.00 0.00 ATOM 9547 H6S POP 77 5.440 28.270 32.570 1.00 0.00 ATOM 9548 C27 POP 77 5.690 26.120 32.320 1.00 0.00 ATOM 9549 H7R POP 77 6.330 25.440 31.720 1.00 0.00 ATOM 9550 H7S POP 77 4.620 25.870 32.120 1.00 0.00 ATOM 9551 C28 POP 77 5.980 26.080 33.830 1.00 0.00 ATOM 9552 H8R POP 77 5.080 26.560 34.270 1.00 0.00 ATOM 9553 H8S POP 77 6.800 26.770 34.150 1.00 0.00 ATOM 9554 C29 POP 77 6.180 24.670 34.300 1.00 0.00 ATOM 9555 H91 POP 77 5.660 23.840 33.800 1.00 0.00 ATOM 9556 0C21 POP 77 6.840 24.190 35.360 1.00 0.00 ATOM 9557 1H10 POP 77 6.800 23.100 35.520 1.00 0.00 ATOM 9558 1C21 POP 77 7.570 24.970 36.420 1.00 0.00 ATOM 9559 H11R POP 77 8.160 25.780 35.940 1.00 0.00 ATOM 9560 H11S POP 77 8.240 24.300 36.980 1.00 0.00 ATOM 9561 2C21 POP 77 6.560 25.580 37.400 1.00 0.00 ATOM 9562 H12R POP 77 5.770 24.860 37.680 1.00 0.00 ATOM 9563 H12S POP 77 5.990 26.350 36.830 1.00 0.00 ATOM 9564 3C21 POP 77 7.280 26.170 38.620 1.00 0.00 ATOM 9565 H13R POP 77 6.620 26.830 39.230 1.00 0.00 ATOM 9566 H13S POP 77 8.150 26.760 38.270 1.00 0.00 ATOM 9567 4C21 POP 77 7.870 25.180 39.620 1.00 0.00 ATOM 9568 H14R POP 77 8.270 25.860 40.410 1.00 0.00 ATOM 9569 H14S POP 77 8.670 24.600 39.120 1.00 0.00 ATOM 9570 5C21 POP 77 6.890 24.210 40.290 1.00 0.00 ATOM 9571 H15R POP 77 6.660 23.390 39.580 1.00 0.00 ATOM 9572 H15S POP 77 5.940 24.690 40.600 1.00 0.00 ATOM 9573 6C21 POP 77 7.560 23.670 41.560 1.00 0.00 ATOM 9574 H16R POP 77 7.720 24.440 42.350 1.00 0.00 ATOM 9575 H16S POP 77 8.570 23.420 41.170 1.00 0.00 ATOM 9576 7C21 POP 77 6.940 22.390 42.100 1.00 0.00 ATOM 9577 H17R POP 77 7.480 22.050 43.010 1.00 0.00 ATOM 9578 H17S POP 77 7.250 21.540 41.450 1.00 0.00 ATOM 9579 8C21 POP 77 5.430 22.290 42.320 1.00 0.00 ATOM 9580 H18R POP 77 5.130 21.290 42.700 1.00 0.00 ATOM 9581 H18S POP 77 4.840 22.430 41.380 1.00 0.00 ATOM 9582 H18T POP 77 5.190 22.980 43.150 1.00 0.00 ATOM 9583 C33 POP 77 8.780 22.910 31.450 1.00 0.00 ATOM 9584 H3X POP 77 8.070 23.680 31.810 1.00 0.00 ATOM 9585 H3Y POP 77 9.740 23.390 31.150 1.00 0.00 ATOM 9586 C34 POP 77 8.920 22.010 32.670 1.00 0.00 ATOM 9587 H4X POP 77 9.500 21.110 32.370 1.00 0.00 ATOM 9588 H4Y POP 77 7.950 21.790 33.150 1.00 0.00 ATOM 9589 C35 POP 77 9.600 22.900 33.720 1.00 0.00 ATOM 9590 H5X POP 77 9.090 23.860 33.960 1.00 0.00 ATOM 9591 H5Y POP 77 10.540 23.160 33.200 1.00 0.00 ATOM 9592 C36 POP 77 9.940 22.050 34.950 1.00 0.00 ATOM 9593 H6X POP 77 10.730 21.310 34.680 1.00 0.00 ATOM 9594 H6Y POP 77 9.050 21.530 35.370 1.00 0.00 ATOM 9595 C37 POP 77 10.660 22.890 36.000 1.00 0.00 ATOM 9596 H7X POP 77 10.050 23.790 36.260 1.00 0.00 ATOM 9597 H7Y POP 77 11.550 23.280 35.470 1.00 0.00 ATOM 9598 C38 POP 77 11.060 22.110 37.260 1.00 0.00 ATOM 9599 H8X POP 77 11.560 21.220 36.820 1.00 0.00 ATOM 9600 H8Y POP 77 10.170 21.730 37.810 1.00 0.00 ATOM 9601 C39 POP 77 11.950 23.060 38.070 1.00 0.00 ATOM 9602 H9X POP 77 11.300 23.960 38.170 1.00 0.00 ATOM 9603 H9Y POP 77 12.810 23.530 37.550 1.00 0.00 ATOM 9604 0C31 POP 77 12.340 22.540 39.450 1.00 0.00 ATOM 9605 H10X POP 77 12.630 21.470 39.380 1.00 0.00 ATOM 9606 H10Y POP 77 11.480 22.620 40.150 1.00 0.00 ATOM 9607 1C31 POP 77 13.550 23.210 40.110 1.00 0.00 ATOM 9608 H11X POP 77 13.340 24.240 40.480 1.00 0.00 ATOM 9609 H11Y POP 77 14.240 23.320 39.250 1.00 0.00 ATOM 9610 2C31 POP 77 14.250 22.350 41.160 1.00 0.00 ATOM 9611 H12X POP 77 15.040 23.070 41.470 1.00 0.00 ATOM 9612 H12Y POP 77 14.710 21.500 40.620 1.00 0.00 ATOM 9613 3C31 POP 77 13.430 21.960 42.390 1.00 0.00 ATOM 9614 H13X POP 77 12.750 21.170 42.030 1.00 0.00 ATOM 9615 H13Y POP 77 12.740 22.760 42.740 1.00 0.00 ATOM 9616 4C31 POP 77 14.260 21.410 43.550 1.00 0.00 ATOM 9617 H14X POP 77 14.830 22.280 43.970 1.00 0.00 ATOM 9618 H14Y POP 77 14.950 20.620 43.180 1.00 0.00 ATOM 9619 5C31 POP 77 13.560 20.830 44.770 1.00 0.00 ATOM 9620 H15X POP 77 12.680 21.460 45.020 1.00 0.00 ATOM 9621 H15Y POP 77 14.070 20.950 45.750 1.00 0.00 ATOM 9622 6C31 POP 77 13.140 19.370 44.620 1.00 0.00 ATOM 9623 H16X POP 77 12.620 19.390 43.650 1.00 0.00 ATOM 9624 H16Y POP 77 12.410 19.180 45.440 1.00 0.00 ATOM 9625 H16Z POP 77 14.000 18.680 44.470 1.00 0.00 ATOM 9626 N POP 78 60.950 55.440 19.850 1.00 0.00 ATOM 9627 HN1 POP 78 61.220 55.260 20.840 1.00 0.00 ATOM 9628 HN2 POP 78 59.980 55.100 19.690 1.00 0.00 ATOM 9629 HN3 POP 78 61.670 54.880 19.360 1.00 0.00 ATOM 9630 C12 POP 78 61.280 56.870 19.500 1.00 0.00 ATOM 9631 H12A POP 78 60.990 56.890 18.430 1.00 0.00 ATOM 9632 H12B POP 78 62.370 56.960 19.690 1.00 0.00 ATOM 9633 C11 POP 78 60.650 57.900 20.440 1.00 0.00 ATOM 9634 H11A POP 78 59.560 57.710 20.550 1.00 0.00 ATOM 9635 H11B POP 78 60.750 58.940 20.050 1.00 0.00 ATOM 9636 P POP 78 60.520 58.700 22.840 1.00 0.00 ATOM 9637 O13 POP 78 59.620 57.790 23.590 1.00 0.00 ATOM 9638 O14 POP 78 59.800 59.820 22.180 1.00 0.00 ATOM 9639 O11 POP 78 61.660 59.260 23.820 1.00 0.00 ATOM 9640 O12 POP 78 61.250 57.820 21.730 1.00 0.00 ATOM 9641 C1 POP 78 62.710 58.320 24.050 1.00 0.00 ATOM 9642 HA POP 78 63.690 58.780 24.320 1.00 0.00 ATOM 9643 HB POP 78 62.980 57.670 23.190 1.00 0.00 ATOM 9644 C2 POP 78 62.460 57.400 25.260 1.00 0.00 ATOM 9645 HS POP 78 62.050 56.400 24.990 1.00 0.00 ATOM 9646 O21 POP 78 61.420 58.010 26.040 1.00 0.00 ATOM 9647 C21 POP 78 60.730 57.170 26.800 1.00 0.00 ATOM 9648 O22 POP 78 60.670 55.960 26.650 1.00 0.00 ATOM 9649 C22 POP 78 60.000 57.980 27.860 1.00 0.00 ATOM 9650 H2R POP 78 58.920 57.820 27.650 1.00 0.00 ATOM 9651 H2S POP 78 60.320 59.050 27.870 1.00 0.00 ATOM 9652 C3 POP 78 63.770 57.110 26.000 1.00 0.00 ATOM 9653 HX POP 78 64.290 58.070 26.240 1.00 0.00 ATOM 9654 HY POP 78 64.440 56.470 25.380 1.00 0.00 ATOM 9655 O31 POP 78 63.690 56.390 27.230 1.00 0.00 ATOM 9656 C31 POP 78 64.840 56.020 27.780 1.00 0.00 ATOM 9657 O32 POP 78 65.940 56.460 27.490 1.00 0.00 ATOM 9658 C32 POP 78 64.550 55.060 28.930 1.00 0.00 ATOM 9659 H2X POP 78 64.040 54.200 28.450 1.00 0.00 ATOM 9660 H2Y POP 78 63.800 55.560 29.580 1.00 0.00 ATOM 9661 C23 POP 78 60.310 57.410 29.240 1.00 0.00 ATOM 9662 H3R POP 78 60.620 56.350 29.130 1.00 0.00 ATOM 9663 H3S POP 78 59.380 57.550 29.830 1.00 0.00 ATOM 9664 C24 POP 78 61.390 58.190 30.000 1.00 0.00 ATOM 9665 H4R POP 78 61.130 59.260 30.170 1.00 0.00 ATOM 9666 H4S POP 78 62.360 58.310 29.460 1.00 0.00 ATOM 9667 C25 POP 78 61.580 57.480 31.340 1.00 0.00 ATOM 9668 H5R POP 78 61.660 56.390 31.100 1.00 0.00 ATOM 9669 H5S POP 78 60.600 57.620 31.830 1.00 0.00 ATOM 9670 C26 POP 78 62.780 57.950 32.160 1.00 0.00 ATOM 9671 H6R POP 78 62.600 59.040 32.300 1.00 0.00 ATOM 9672 H6S POP 78 63.720 57.770 31.600 1.00 0.00 ATOM 9673 C27 POP 78 63.010 57.390 33.570 1.00 0.00 ATOM 9674 H7R POP 78 63.970 57.730 34.010 1.00 0.00 ATOM 9675 H7S POP 78 63.050 56.320 33.290 1.00 0.00 ATOM 9676 C28 POP 78 61.900 57.750 34.560 1.00 0.00 ATOM 9677 H8R POP 78 60.980 57.510 33.990 1.00 0.00 ATOM 9678 H8S POP 78 61.850 58.850 34.750 1.00 0.00 ATOM 9679 C29 POP 78 62.060 56.970 35.830 1.00 0.00 ATOM 9680 H91 POP 78 61.840 55.900 35.680 1.00 0.00 ATOM 9681 0C21 POP 78 62.720 57.390 36.920 1.00 0.00 ATOM 9682 1H10 POP 78 62.850 56.610 37.690 1.00 0.00 ATOM 9683 1C21 POP 78 63.340 58.750 37.050 1.00 0.00 ATOM 9684 H11R POP 78 63.630 59.180 36.070 1.00 0.00 ATOM 9685 H11S POP 78 64.190 58.640 37.760 1.00 0.00 ATOM 9686 2C21 POP 78 62.470 59.810 37.730 1.00 0.00 ATOM 9687 H12R POP 78 62.110 59.510 38.740 1.00 0.00 ATOM 9688 H12S POP 78 61.620 60.160 37.110 1.00 0.00 ATOM 9689 3C21 POP 78 63.280 61.090 37.920 1.00 0.00 ATOM 9690 H13R POP 78 63.910 61.180 37.010 1.00 0.00 ATOM 9691 H13S POP 78 64.040 61.020 38.730 1.00 0.00 ATOM 9692 4C21 POP 78 62.520 62.380 38.230 1.00 0.00 ATOM 9693 H14R POP 78 61.840 62.520 37.370 1.00 0.00 ATOM 9694 H14S POP 78 63.240 63.230 38.300 1.00 0.00 ATOM 9695 5C21 POP 78 61.710 62.300 39.530 1.00 0.00 ATOM 9696 H15R POP 78 62.320 61.980 40.390 1.00 0.00 ATOM 9697 H15S POP 78 61.040 61.410 39.500 1.00 0.00 ATOM 9698 6C21 POP 78 60.990 63.620 39.830 1.00 0.00 ATOM 9699 H16R POP 78 60.320 63.430 40.700 1.00 0.00 ATOM 9700 H16S POP 78 60.340 63.800 38.950 1.00 0.00 ATOM 9701 7C21 POP 78 61.920 64.770 40.210 1.00 0.00 ATOM 9702 H17R POP 78 62.400 65.230 39.320 1.00 0.00 ATOM 9703 H17S POP 78 62.660 64.310 40.890 1.00 0.00 ATOM 9704 8C21 POP 78 61.240 65.960 40.890 1.00 0.00 ATOM 9705 H18R POP 78 62.000 66.770 40.970 1.00 0.00 ATOM 9706 H18S POP 78 60.790 65.720 41.870 1.00 0.00 ATOM 9707 H18T POP 78 60.440 66.310 40.200 1.00 0.00 ATOM 9708 C33 POP 78 65.860 54.580 29.570 1.00 0.00 ATOM 9709 H3X POP 78 66.400 55.390 30.110 1.00 0.00 ATOM 9710 H3Y POP 78 66.570 54.220 28.790 1.00 0.00 ATOM 9711 C34 POP 78 65.770 53.310 30.420 1.00 0.00 ATOM 9712 H4X POP 78 66.800 52.900 30.440 1.00 0.00 ATOM 9713 H4Y POP 78 65.220 52.530 29.850 1.00 0.00 ATOM 9714 C35 POP 78 65.160 53.430 31.810 1.00 0.00 ATOM 9715 H5X POP 78 64.880 52.400 32.120 1.00 0.00 ATOM 9716 H5Y POP 78 64.280 54.090 31.680 1.00 0.00 ATOM 9717 C36 POP 78 66.110 53.920 32.910 1.00 0.00 ATOM 9718 H6X POP 78 66.580 54.910 32.720 1.00 0.00 ATOM 9719 H6Y POP 78 66.970 53.220 32.950 1.00 0.00 ATOM 9720 C37 POP 78 65.490 53.940 34.310 1.00 0.00 ATOM 9721 H7X POP 78 64.640 54.650 34.300 1.00 0.00 ATOM 9722 H7Y POP 78 66.290 54.360 34.950 1.00 0.00 ATOM 9723 C38 POP 78 65.070 52.550 34.790 1.00 0.00 ATOM 9724 H8X POP 78 65.860 51.820 34.480 1.00 0.00 ATOM 9725 H8Y POP 78 64.160 52.240 34.240 1.00 0.00 ATOM 9726 C39 POP 78 64.920 52.450 36.310 1.00 0.00 ATOM 9727 H9X POP 78 65.930 52.660 36.710 1.00 0.00 ATOM 9728 H9Y POP 78 64.620 51.420 36.590 1.00 0.00 ATOM 9729 0C31 POP 78 64.010 53.480 36.970 1.00 0.00 ATOM 9730 H10X POP 78 63.020 53.170 36.580 1.00 0.00 ATOM 9731 H10Y POP 78 64.300 54.480 36.570 1.00 0.00 ATOM 9732 1C31 POP 78 64.030 53.490 38.500 1.00 0.00 ATOM 9733 H11X POP 78 63.700 54.510 38.780 1.00 0.00 ATOM 9734 H11Y POP 78 64.990 53.110 38.920 1.00 0.00 ATOM 9735 2C31 POP 78 63.030 52.480 39.080 1.00 0.00 ATOM 9736 H12X POP 78 63.400 51.440 38.980 1.00 0.00 ATOM 9737 H12Y POP 78 62.050 52.630 38.570 1.00 0.00 ATOM 9738 3C31 POP 78 62.740 52.610 40.580 1.00 0.00 ATOM 9739 H13X POP 78 62.400 53.660 40.740 1.00 0.00 ATOM 9740 H13Y POP 78 63.650 52.580 41.210 1.00 0.00 ATOM 9741 4C31 POP 78 61.650 51.610 40.930 1.00 0.00 ATOM 9742 H14X POP 78 62.070 50.600 40.730 1.00 0.00 ATOM 9743 H14Y POP 78 60.760 51.740 40.280 1.00 0.00 ATOM 9744 5C31 POP 78 61.100 51.710 42.360 1.00 0.00 ATOM 9745 H15X POP 78 60.580 52.690 42.430 1.00 0.00 ATOM 9746 H15Y POP 78 61.970 51.840 43.030 1.00 0.00 ATOM 9747 6C31 POP 78 60.060 50.690 42.830 1.00 0.00 ATOM 9748 H16X POP 78 59.360 50.320 42.050 1.00 0.00 ATOM 9749 H16Y POP 78 59.350 51.120 43.560 1.00 0.00 ATOM 9750 H16Z POP 78 60.640 49.880 43.330 1.00 0.00 ATOM 9751 N POP 79 52.690 22.080 24.150 1.00 0.00 ATOM 9752 HN1 POP 79 52.320 22.620 24.950 1.00 0.00 ATOM 9753 HN2 POP 79 53.200 21.220 24.450 1.00 0.00 ATOM 9754 HN3 POP 79 53.350 22.660 23.590 1.00 0.00 ATOM 9755 C12 POP 79 51.530 21.790 23.220 1.00 0.00 ATOM 9756 H12A POP 79 51.070 20.820 23.500 1.00 0.00 ATOM 9757 H12B POP 79 51.920 21.540 22.210 1.00 0.00 ATOM 9758 C11 POP 79 50.580 22.990 23.170 1.00 0.00 ATOM 9759 H11A POP 79 49.750 22.790 22.450 1.00 0.00 ATOM 9760 H11B POP 79 51.230 23.750 22.700 1.00 0.00 ATOM 9761 P POP 79 48.900 22.350 24.970 1.00 0.00 ATOM 9762 O13 POP 79 48.520 21.410 23.890 1.00 0.00 ATOM 9763 O14 POP 79 47.830 23.260 25.440 1.00 0.00 ATOM 9764 O11 POP 79 49.560 21.520 26.170 1.00 0.00 ATOM 9765 O12 POP 79 50.040 23.340 24.450 1.00 0.00 ATOM 9766 C1 POP 79 48.640 20.780 26.980 1.00 0.00 ATOM 9767 HA POP 79 49.030 19.750 27.140 1.00 0.00 ATOM 9768 HB POP 79 47.600 20.660 26.590 1.00 0.00 ATOM 9769 C2 POP 79 48.610 21.410 28.380 1.00 0.00 ATOM 9770 HS POP 79 48.310 22.470 28.230 1.00 0.00 ATOM 9771 O21 POP 79 49.940 21.270 28.880 1.00 0.00 ATOM 9772 C21 POP 79 50.170 22.200 29.810 1.00 0.00 ATOM 9773 O22 POP 79 49.310 22.970 30.210 1.00 0.00 ATOM 9774 C22 POP 79 51.620 22.260 30.240 1.00 0.00 ATOM 9775 H2R POP 79 52.300 22.460 29.380 1.00 0.00 ATOM 9776 H2S POP 79 51.920 21.350 30.810 1.00 0.00 ATOM 9777 C3 POP 79 47.580 20.840 29.380 1.00 0.00 ATOM 9778 HX POP 79 46.580 20.940 28.910 1.00 0.00 ATOM 9779 HY POP 79 47.530 21.310 30.390 1.00 0.00 ATOM 9780 O31 POP 79 47.820 19.450 29.580 1.00 0.00 ATOM 9781 C31 POP 79 46.700 18.800 29.900 1.00 0.00 ATOM 9782 O32 POP 79 45.600 19.240 29.610 1.00 0.00 ATOM 9783 C32 POP 79 46.920 17.440 30.540 1.00 0.00 ATOM 9784 H2X POP 79 47.990 17.140 30.500 1.00 0.00 ATOM 9785 H2Y POP 79 46.310 16.670 30.010 1.00 0.00 ATOM 9786 C23 POP 79 51.830 23.450 31.180 1.00 0.00 ATOM 9787 H3R POP 79 50.990 23.380 31.900 1.00 0.00 ATOM 9788 H3S POP 79 51.780 24.430 30.660 1.00 0.00 ATOM 9789 C24 POP 79 52.950 23.290 32.210 1.00 0.00 ATOM 9790 H4R POP 79 53.760 23.790 31.630 1.00 0.00 ATOM 9791 H4S POP 79 53.130 22.200 32.310 1.00 0.00 ATOM 9792 C25 POP 79 52.860 23.940 33.590 1.00 0.00 ATOM 9793 H5R POP 79 51.940 23.770 34.180 1.00 0.00 ATOM 9794 H5S POP 79 52.820 25.030 33.390 1.00 0.00 ATOM 9795 C26 POP 79 54.100 23.740 34.450 1.00 0.00 ATOM 9796 H6R POP 79 55.010 23.960 33.850 1.00 0.00 ATOM 9797 H6S POP 79 54.120 22.650 34.640 1.00 0.00 ATOM 9798 C27 POP 79 54.180 24.590 35.720 1.00 0.00 ATOM 9799 H7R POP 79 53.400 24.200 36.410 1.00 0.00 ATOM 9800 H7S POP 79 54.010 25.670 35.540 1.00 0.00 ATOM 9801 C28 POP 79 55.490 24.430 36.500 1.00 0.00 ATOM 9802 H8R POP 79 55.410 24.940 37.490 1.00 0.00 ATOM 9803 H8S POP 79 56.360 24.710 35.880 1.00 0.00 ATOM 9804 C29 POP 79 55.670 22.960 36.750 1.00 0.00 ATOM 9805 H91 POP 79 56.300 22.490 35.980 1.00 0.00 ATOM 9806 0C21 POP 79 55.310 22.270 37.840 1.00 0.00 ATOM 9807 1H10 POP 79 55.500 21.200 37.690 1.00 0.00 ATOM 9808 1C21 POP 79 54.570 22.790 39.040 1.00 0.00 ATOM 9809 H11R POP 79 53.930 23.660 38.790 1.00 0.00 ATOM 9810 H11S POP 79 55.320 23.140 39.770 1.00 0.00 ATOM 9811 2C21 POP 79 53.720 21.680 39.660 1.00 0.00 ATOM 9812 H12R POP 79 54.260 20.750 39.940 1.00 0.00 ATOM 9813 H12S POP 79 52.850 21.510 38.990 1.00 0.00 ATOM 9814 3C21 POP 79 53.230 22.270 40.980 1.00 0.00 ATOM 9815 H13R POP 79 52.380 22.960 40.760 1.00 0.00 ATOM 9816 H13S POP 79 54.010 22.930 41.410 1.00 0.00 ATOM 9817 4C21 POP 79 52.920 21.280 42.100 1.00 0.00 ATOM 9818 H14R POP 79 53.840 20.670 42.230 1.00 0.00 ATOM 9819 H14S POP 79 52.020 20.720 41.780 1.00 0.00 ATOM 9820 5C21 POP 79 52.610 21.930 43.450 1.00 0.00 ATOM 9821 H15R POP 79 52.070 21.180 44.060 1.00 0.00 ATOM 9822 H15S POP 79 51.890 22.770 43.350 1.00 0.00 ATOM 9823 6C21 POP 79 53.780 22.420 44.300 1.00 0.00 ATOM 9824 H16R POP 79 53.570 22.820 45.320 1.00 0.00 ATOM 9825 H16S POP 79 54.220 23.290 43.770 1.00 0.00 ATOM 9826 7C21 POP 79 54.940 21.430 44.380 1.00 0.00 ATOM 9827 H17R POP 79 55.730 21.830 45.060 1.00 0.00 ATOM 9828 H17S POP 79 55.420 21.350 43.380 1.00 0.00 ATOM 9829 8C21 POP 79 54.560 20.090 44.990 1.00 0.00 ATOM 9830 H18R POP 79 54.050 19.370 44.320 1.00 0.00 ATOM 9831 H18S POP 79 54.110 20.170 46.010 1.00 0.00 ATOM 9832 H18T POP 79 55.500 19.530 45.190 1.00 0.00 ATOM 9833 C33 POP 79 46.430 17.570 31.980 1.00 0.00 ATOM 9834 H3X POP 79 45.370 17.900 31.960 1.00 0.00 ATOM 9835 H3Y POP 79 46.960 18.390 32.510 1.00 0.00 ATOM 9836 C34 POP 79 46.480 16.360 32.910 1.00 0.00 ATOM 9837 H4X POP 79 47.490 15.920 32.800 1.00 0.00 ATOM 9838 H4Y POP 79 45.710 15.610 32.610 1.00 0.00 ATOM 9839 C35 POP 79 46.250 16.670 34.390 1.00 0.00 ATOM 9840 H5X POP 79 45.370 17.340 34.500 1.00 0.00 ATOM 9841 H5Y POP 79 47.120 17.220 34.810 1.00 0.00 ATOM 9842 C36 POP 79 46.170 15.370 35.210 1.00 0.00 ATOM 9843 H6X POP 79 46.990 14.630 35.090 1.00 0.00 ATOM 9844 H6Y POP 79 45.310 14.720 34.950 1.00 0.00 ATOM 9845 C37 POP 79 46.110 15.800 36.670 1.00 0.00 ATOM 9846 H7X POP 79 45.040 16.060 36.820 1.00 0.00 ATOM 9847 H7Y POP 79 46.710 16.690 36.970 1.00 0.00 ATOM 9848 C38 POP 79 46.460 14.610 37.560 1.00 0.00 ATOM 9849 H8X POP 79 47.540 14.390 37.440 1.00 0.00 ATOM 9850 H8Y POP 79 45.910 13.680 37.290 1.00 0.00 ATOM 9851 C39 POP 79 46.220 14.990 39.020 1.00 0.00 ATOM 9852 H9X POP 79 45.200 15.360 39.220 1.00 0.00 ATOM 9853 H9Y POP 79 46.890 15.850 39.240 1.00 0.00 ATOM 9854 0C31 POP 79 46.350 13.790 39.970 1.00 0.00 ATOM 9855 H10X POP 79 46.360 14.130 41.030 1.00 0.00 ATOM 9856 H10Y POP 79 47.370 13.400 39.830 1.00 0.00 ATOM 9857 1C31 POP 79 45.280 12.720 39.740 1.00 0.00 ATOM 9858 H11X POP 79 45.570 12.170 38.820 1.00 0.00 ATOM 9859 H11Y POP 79 44.260 13.150 39.700 1.00 0.00 ATOM 9860 2C31 POP 79 45.260 11.550 40.730 1.00 0.00 ATOM 9861 H12X POP 79 46.110 10.850 40.640 1.00 0.00 ATOM 9862 H12Y POP 79 45.330 11.970 41.760 1.00 0.00 ATOM 9863 3C31 POP 79 44.010 10.720 40.470 1.00 0.00 ATOM 9864 H13X POP 79 43.920 10.460 39.390 1.00 0.00 ATOM 9865 H13Y POP 79 43.130 11.350 40.750 1.00 0.00 ATOM 9866 4C31 POP 79 43.790 9.500 41.360 1.00 0.00 ATOM 9867 H14X POP 79 42.770 9.060 41.280 1.00 0.00 ATOM 9868 H14Y POP 79 44.150 9.660 42.400 1.00 0.00 ATOM 9869 5C31 POP 79 44.650 8.290 40.970 1.00 0.00 ATOM 9870 H15X POP 79 44.630 7.400 41.630 1.00 0.00 ATOM 9871 H15Y POP 79 45.700 8.640 41.060 1.00 0.00 ATOM 9872 6C31 POP 79 44.440 7.890 39.520 1.00 0.00 ATOM 9873 H16X POP 79 43.350 7.790 39.290 1.00 0.00 ATOM 9874 H16Y POP 79 44.890 6.900 39.270 1.00 0.00 ATOM 9875 H16Z POP 79 44.830 8.590 38.750 1.00 0.00 ATOM 9876 N POP 80 30.560 38.730 23.850 1.00 0.00 ATOM 9877 HN1 POP 80 30.790 39.520 24.490 1.00 0.00 ATOM 9878 HN2 POP 80 29.520 38.710 23.900 1.00 0.00 ATOM 9879 HN3 POP 80 31.100 37.910 24.200 1.00 0.00 ATOM 9880 C12 POP 80 31.100 38.940 22.460 1.00 0.00 ATOM 9881 H12A POP 80 30.830 39.980 22.210 1.00 0.00 ATOM 9882 H12B POP 80 30.570 38.240 21.780 1.00 0.00 ATOM 9883 C11 POP 80 32.590 38.680 22.250 1.00 0.00 ATOM 9884 H11A POP 80 33.010 39.650 21.920 1.00 0.00 ATOM 9885 H11B POP 80 32.810 37.900 21.490 1.00 0.00 ATOM 9886 P POP 80 34.690 38.220 23.690 1.00 0.00 ATOM 9887 O13 POP 80 35.110 36.820 23.950 1.00 0.00 ATOM 9888 O14 POP 80 35.360 38.890 22.550 1.00 0.00 ATOM 9889 O11 POP 80 35.020 39.030 25.030 1.00 0.00 ATOM 9890 O12 POP 80 33.100 38.290 23.530 1.00 0.00 ATOM 9891 C1 POP 80 34.590 40.390 25.140 1.00 0.00 ATOM 9892 HA POP 80 33.730 40.550 25.820 1.00 0.00 ATOM 9893 HB POP 80 34.220 40.820 24.180 1.00 0.00 ATOM 9894 C2 POP 80 35.760 41.300 25.550 1.00 0.00 ATOM 9895 HS POP 80 36.620 41.240 24.850 1.00 0.00 ATOM 9896 O21 POP 80 36.150 40.910 26.860 1.00 0.00 ATOM 9897 C21 POP 80 37.400 41.160 27.250 1.00 0.00 ATOM 9898 O22 POP 80 38.150 42.000 26.780 1.00 0.00 ATOM 9899 C22 POP 80 37.640 40.370 28.540 1.00 0.00 ATOM 9900 H2R POP 80 38.700 40.060 28.520 1.00 0.00 ATOM 9901 H2S POP 80 37.200 39.360 28.630 1.00 0.00 ATOM 9902 C3 POP 80 35.260 42.750 25.610 1.00 0.00 ATOM 9903 HX POP 80 34.750 43.030 24.670 1.00 0.00 ATOM 9904 HY POP 80 36.180 43.380 25.650 1.00 0.00 ATOM 9905 O31 POP 80 34.320 42.990 26.660 1.00 0.00 ATOM 9906 C31 POP 80 34.640 43.750 27.710 1.00 0.00 ATOM 9907 O32 POP 80 35.770 44.170 27.900 1.00 0.00 ATOM 9908 C32 POP 80 33.420 43.880 28.610 1.00 0.00 ATOM 9909 H2X POP 80 32.740 43.080 28.250 1.00 0.00 ATOM 9910 H2Y POP 80 33.050 44.920 28.450 1.00 0.00 ATOM 9911 C23 POP 80 37.040 41.190 29.680 1.00 0.00 ATOM 9912 H3R POP 80 35.950 40.970 29.670 1.00 0.00 ATOM 9913 H3S POP 80 37.230 42.240 29.350 1.00 0.00 ATOM 9914 C24 POP 80 37.730 41.000 31.040 1.00 0.00 ATOM 9915 H4R POP 80 38.820 41.050 30.840 1.00 0.00 ATOM 9916 H4S POP 80 37.370 40.030 31.430 1.00 0.00 ATOM 9917 C25 POP 80 37.250 42.050 32.050 1.00 0.00 ATOM 9918 H5R POP 80 36.160 41.840 32.040 1.00 0.00 ATOM 9919 H5S POP 80 37.360 43.080 31.640 1.00 0.00 ATOM 9920 C26 POP 80 37.850 41.860 33.440 1.00 0.00 ATOM 9921 H6R POP 80 38.930 42.090 33.320 1.00 0.00 ATOM 9922 H6S POP 80 37.980 40.780 33.650 1.00 0.00 ATOM 9923 C27 POP 80 37.140 42.420 34.670 1.00 0.00 ATOM 9924 H7R POP 80 36.090 42.070 34.580 1.00 0.00 ATOM 9925 H7S POP 80 37.050 43.520 34.810 1.00 0.00 ATOM 9926 C28 POP 80 37.860 41.930 35.930 1.00 0.00 ATOM 9927 H8R POP 80 38.890 42.340 35.980 1.00 0.00 ATOM 9928 H8S POP 80 37.950 40.830 35.840 1.00 0.00 ATOM 9929 C29 POP 80 37.240 42.370 37.230 1.00 0.00 ATOM 9930 H91 POP 80 36.660 41.670 37.840 1.00 0.00 ATOM 9931 0C21 POP 80 37.480 43.520 37.880 1.00 0.00 ATOM 9932 1H10 POP 80 36.950 43.750 38.820 1.00 0.00 ATOM 9933 1C21 POP 80 38.380 44.620 37.400 1.00 0.00 ATOM 9934 H11R POP 80 37.890 45.240 36.620 1.00 0.00 ATOM 9935 H11S POP 80 39.370 44.290 37.020 1.00 0.00 ATOM 9936 2C21 POP 80 38.610 45.520 38.610 1.00 0.00 ATOM 9937 H12R POP 80 39.080 44.880 39.400 1.00 0.00 ATOM 9938 H12S POP 80 37.620 45.860 38.980 1.00 0.00 ATOM 9939 3C21 POP 80 39.600 46.670 38.370 1.00 0.00 ATOM 9940 H13R POP 80 39.640 47.030 37.310 1.00 0.00 ATOM 9941 H13S POP 80 40.600 46.360 38.720 1.00 0.00 ATOM 9942 4C21 POP 80 39.320 47.930 39.180 1.00 0.00 ATOM 9943 H14R POP 80 38.390 48.340 38.730 1.00 0.00 ATOM 9944 H14S POP 80 40.080 48.700 38.930 1.00 0.00 ATOM 9945 5C21 POP 80 39.090 47.730 40.680 1.00 0.00 ATOM 9946 H15R POP 80 38.380 46.870 40.710 1.00 0.00 ATOM 9947 H15S POP 80 38.680 48.690 41.060 1.00 0.00 ATOM 9948 6C21 POP 80 40.290 47.370 41.560 1.00 0.00 ATOM 9949 H16R POP 80 40.850 48.330 41.690 1.00 0.00 ATOM 9950 H16S POP 80 40.840 46.570 41.020 1.00 0.00 ATOM 9951 7C21 POP 80 40.000 46.900 42.990 1.00 0.00 ATOM 9952 H17R POP 80 40.970 46.660 43.470 1.00 0.00 ATOM 9953 H17S POP 80 39.420 45.960 43.020 1.00 0.00 ATOM 9954 8C21 POP 80 39.180 47.890 43.810 1.00 0.00 ATOM 9955 H18R POP 80 38.160 47.920 43.380 1.00 0.00 ATOM 9956 H18S POP 80 39.680 48.890 43.880 1.00 0.00 ATOM 9957 H18T POP 80 39.090 47.530 44.850 1.00 0.00 ATOM 9958 C33 POP 80 33.800 43.570 30.050 1.00 0.00 ATOM 9959 H3X POP 80 34.730 42.970 30.040 1.00 0.00 ATOM 9960 H3Y POP 80 33.010 42.940 30.530 1.00 0.00 ATOM 9961 C34 POP 80 33.860 44.790 30.970 1.00 0.00 ATOM 9962 H4X POP 80 32.810 45.140 31.060 1.00 0.00 ATOM 9963 H4Y POP 80 34.540 45.530 30.480 1.00 0.00 ATOM 9964 C35 POP 80 34.350 44.540 32.400 1.00 0.00 ATOM 9965 H5X POP 80 35.360 44.090 32.330 1.00 0.00 ATOM 9966 H5Y POP 80 33.680 43.780 32.880 1.00 0.00 ATOM 9967 C36 POP 80 34.190 45.710 33.370 1.00 0.00 ATOM 9968 H6X POP 80 33.130 46.020 33.250 1.00 0.00 ATOM 9969 H6Y POP 80 34.810 46.580 33.040 1.00 0.00 ATOM 9970 C37 POP 80 34.630 45.320 34.780 1.00 0.00 ATOM 9971 H7X POP 80 35.720 45.460 34.910 1.00 0.00 ATOM 9972 H7Y POP 80 34.330 44.260 34.840 1.00 0.00 ATOM 9973 C38 POP 80 33.850 46.210 35.750 1.00 0.00 ATOM 9974 H8X POP 80 32.750 46.150 35.640 1.00 0.00 ATOM 9975 H8Y POP 80 34.040 47.300 35.640 1.00 0.00 ATOM 9976 C39 POP 80 34.430 45.980 37.150 1.00 0.00 ATOM 9977 H9X POP 80 35.500 46.250 37.250 1.00 0.00 ATOM 9978 H9Y POP 80 34.520 44.880 37.320 1.00 0.00 ATOM 9979 0C31 POP 80 33.630 46.620 38.290 1.00 0.00 ATOM 9980 H10X POP 80 32.630 46.140 38.250 1.00 0.00 ATOM 9981 H10Y POP 80 33.550 47.640 37.850 1.00 0.00 ATOM 9982 1C31 POP 80 34.240 46.680 39.690 1.00 0.00 ATOM 9983 H11X POP 80 35.350 46.660 39.570 1.00 0.00 ATOM 9984 H11Y POP 80 33.990 45.750 40.230 1.00 0.00 ATOM 9985 2C31 POP 80 33.790 47.790 40.650 1.00 0.00 ATOM 9986 H12X POP 80 32.790 47.490 41.040 1.00 0.00 ATOM 9987 H12Y POP 80 33.640 48.760 40.130 1.00 0.00 ATOM 9988 3C31 POP 80 34.840 48.260 41.660 1.00 0.00 ATOM 9989 H13X POP 80 35.740 48.690 41.170 1.00 0.00 ATOM 9990 H13Y POP 80 35.160 47.290 42.100 1.00 0.00 ATOM 9991 4C31 POP 80 34.300 49.240 42.700 1.00 0.00 ATOM 9992 H14X POP 80 33.320 48.870 43.060 1.00 0.00 ATOM 9993 H14Y POP 80 34.240 50.300 42.360 1.00 0.00 ATOM 9994 5C31 POP 80 35.220 49.430 43.910 1.00 0.00 ATOM 9995 H15X POP 80 36.210 49.670 43.470 1.00 0.00 ATOM 9996 H15Y POP 80 35.350 48.510 44.510 1.00 0.00 ATOM 9997 6C31 POP 80 34.800 50.610 44.790 1.00 0.00 ATOM 9998 H16X POP 80 35.490 50.580 45.660 1.00 0.00 ATOM 9999 H16Y POP 80 33.730 50.480 45.050 1.00 0.00 ATOM 10000 H16Z POP 80 35.020 51.590 44.310 1.00 0.00 ATOM 10001 N POP 81 57.240 26.930 22.650 1.00 0.00 ATOM 10002 HN1 POP 81 56.390 27.280 22.160 1.00 0.00 ATOM 10003 HN2 POP 81 58.080 27.490 22.400 1.00 0.00 ATOM 10004 HN3 POP 81 57.370 25.930 22.370 1.00 0.00 ATOM 10005 C12 POP 81 56.930 27.100 24.120 1.00 0.00 ATOM 10006 H12A POP 81 56.460 26.140 24.430 1.00 0.00 ATOM 10007 H12B POP 81 56.290 28.000 24.140 1.00 0.00 ATOM 10008 C11 POP 81 58.220 27.280 24.920 1.00 0.00 ATOM 10009 H11A POP 81 58.000 27.410 26.000 1.00 0.00 ATOM 10010 H11B POP 81 58.610 28.270 24.600 1.00 0.00 ATOM 10011 P POP 81 59.420 25.140 25.560 1.00 0.00 ATOM 10012 O13 POP 81 60.720 24.430 25.410 1.00 0.00 ATOM 10013 O14 POP 81 58.250 24.260 25.360 1.00 0.00 ATOM 10014 O11 POP 81 59.380 25.710 27.050 1.00 0.00 ATOM 10015 O12 POP 81 59.310 26.420 24.590 1.00 0.00 ATOM 10016 C1 POP 81 60.590 25.990 27.760 1.00 0.00 ATOM 10017 HA POP 81 60.400 26.750 28.550 1.00 0.00 ATOM 10018 HB POP 81 61.230 26.440 26.970 1.00 0.00 ATOM 10019 C2 POP 81 61.200 24.760 28.440 1.00 0.00 ATOM 10020 HS POP 81 61.490 24.020 27.660 1.00 0.00 ATOM 10021 O21 POP 81 60.110 24.170 29.160 1.00 0.00 ATOM 10022 C21 POP 81 60.280 22.880 29.430 1.00 0.00 ATOM 10023 O22 POP 81 61.240 22.190 29.140 1.00 0.00 ATOM 10024 C22 POP 81 58.970 22.360 30.010 1.00 0.00 ATOM 10025 H2R POP 81 58.410 21.630 29.390 1.00 0.00 ATOM 10026 H2S POP 81 58.200 23.160 30.060 1.00 0.00 ATOM 10027 C3 POP 81 62.390 25.130 29.340 1.00 0.00 ATOM 10028 HX POP 81 63.150 25.690 28.750 1.00 0.00 ATOM 10029 HY POP 81 62.860 24.180 29.650 1.00 0.00 ATOM 10030 O31 POP 81 61.900 25.750 30.530 1.00 0.00 ATOM 10031 C31 POP 81 62.870 26.360 31.210 1.00 0.00 ATOM 10032 O32 POP 81 64.030 26.420 30.840 1.00 0.00 ATOM 10033 C32 POP 81 62.380 26.590 32.640 1.00 0.00 ATOM 10034 H2X POP 81 61.950 25.600 32.900 1.00 0.00 ATOM 10035 H2Y POP 81 61.640 27.410 32.640 1.00 0.00 ATOM 10036 C23 POP 81 59.260 21.850 31.420 1.00 0.00 ATOM 10037 H3R POP 81 58.310 21.900 32.000 1.00 0.00 ATOM 10038 H3S POP 81 59.980 22.520 31.940 1.00 0.00 ATOM 10039 C24 POP 81 59.840 20.440 31.560 1.00 0.00 ATOM 10040 H4R POP 81 60.800 20.450 31.000 1.00 0.00 ATOM 10041 H4S POP 81 59.150 19.740 31.050 1.00 0.00 ATOM 10042 C25 POP 81 60.040 20.060 33.030 1.00 0.00 ATOM 10043 H5R POP 81 59.090 19.900 33.580 1.00 0.00 ATOM 10044 H5S POP 81 60.580 20.900 33.520 1.00 0.00 ATOM 10045 C26 POP 81 60.780 18.740 33.260 1.00 0.00 ATOM 10046 H6R POP 81 60.570 18.440 34.310 1.00 0.00 ATOM 10047 H6S POP 81 61.880 18.810 33.160 1.00 0.00 ATOM 10048 C27 POP 81 60.420 17.500 32.440 1.00 0.00 ATOM 10049 H7R POP 81 61.040 16.690 32.890 1.00 0.00 ATOM 10050 H7S POP 81 60.740 17.660 31.390 1.00 0.00 ATOM 10051 C28 POP 81 58.910 17.210 32.470 1.00 0.00 ATOM 10052 H8R POP 81 58.310 18.000 31.960 1.00 0.00 ATOM 10053 H8S POP 81 58.520 17.170 33.510 1.00 0.00 ATOM 10054 C29 POP 81 58.740 15.900 31.770 1.00 0.00 ATOM 10055 H91 POP 81 59.640 15.450 31.320 1.00 0.00 ATOM 10056 0C21 POP 81 57.560 15.340 31.460 1.00 0.00 ATOM 10057 1H10 POP 81 57.460 14.400 30.890 1.00 0.00 ATOM 10058 1C21 POP 81 56.280 15.960 31.950 1.00 0.00 ATOM 10059 H11R POP 81 56.320 17.070 31.880 1.00 0.00 ATOM 10060 H11S POP 81 56.100 15.620 32.990 1.00 0.00 ATOM 10061 2C21 POP 81 55.140 15.270 31.210 1.00 0.00 ATOM 10062 H12R POP 81 55.250 14.160 31.250 1.00 0.00 ATOM 10063 H12S POP 81 55.190 15.600 30.150 1.00 0.00 ATOM 10064 3C21 POP 81 53.750 15.670 31.740 1.00 0.00 ATOM 10065 H13R POP 81 52.970 15.330 31.020 1.00 0.00 ATOM 10066 H13S POP 81 53.680 16.770 31.800 1.00 0.00 ATOM 10067 4C21 POP 81 53.400 14.900 33.010 1.00 0.00 ATOM 10068 H14R POP 81 54.040 15.330 33.810 1.00 0.00 ATOM 10069 H14S POP 81 53.610 13.840 32.750 1.00 0.00 ATOM 10070 5C21 POP 81 51.970 15.000 33.530 1.00 0.00 ATOM 10071 H15R POP 81 51.280 14.360 32.950 1.00 0.00 ATOM 10072 H15S POP 81 51.640 16.070 33.570 1.00 0.00 ATOM 10073 6C21 POP 81 51.830 14.580 34.990 1.00 0.00 ATOM 10074 H16R POP 81 52.670 14.950 35.620 1.00 0.00 ATOM 10075 H16S POP 81 51.930 13.470 34.990 1.00 0.00 ATOM 10076 7C21 POP 81 50.520 15.080 35.610 1.00 0.00 ATOM 10077 H17R POP 81 49.710 14.800 34.900 1.00 0.00 ATOM 10078 H17S POP 81 50.580 16.180 35.720 1.00 0.00 ATOM 10079 8C21 POP 81 50.300 14.490 37.000 1.00 0.00 ATOM 10080 H18R POP 81 51.170 14.760 37.630 1.00 0.00 ATOM 10081 H18S POP 81 50.200 13.400 36.810 1.00 0.00 ATOM 10082 H18T POP 81 49.380 14.710 37.580 1.00 0.00 ATOM 10083 C33 POP 81 63.530 26.910 33.600 1.00 0.00 ATOM 10084 H3X POP 81 64.170 27.700 33.150 1.00 0.00 ATOM 10085 H3Y POP 81 64.040 25.930 33.740 1.00 0.00 ATOM 10086 C34 POP 81 63.060 27.330 34.990 1.00 0.00 ATOM 10087 H4X POP 81 62.170 26.770 35.340 1.00 0.00 ATOM 10088 H4Y POP 81 62.850 28.420 34.900 1.00 0.00 ATOM 10089 C35 POP 81 64.180 27.310 36.030 1.00 0.00 ATOM 10090 H5X POP 81 65.150 27.660 35.610 1.00 0.00 ATOM 10091 H5Y POP 81 64.460 26.280 36.340 1.00 0.00 ATOM 10092 C36 POP 81 63.720 28.070 37.270 1.00 0.00 ATOM 10093 H6X POP 81 62.710 27.710 37.580 1.00 0.00 ATOM 10094 H6Y POP 81 63.560 29.110 36.910 1.00 0.00 ATOM 10095 C37 POP 81 64.660 28.010 38.470 1.00 0.00 ATOM 10096 H7X POP 81 64.320 28.910 39.020 1.00 0.00 ATOM 10097 H7Y POP 81 65.700 28.280 38.200 1.00 0.00 ATOM 10098 C38 POP 81 64.830 26.690 39.230 1.00 0.00 ATOM 10099 H8X POP 81 65.600 26.900 40.010 1.00 0.00 ATOM 10100 H8Y POP 81 65.270 25.870 38.620 1.00 0.00 ATOM 10101 C39 POP 81 63.600 26.140 39.950 1.00 0.00 ATOM 10102 H9X POP 81 62.880 25.870 39.150 1.00 0.00 ATOM 10103 H9Y POP 81 63.130 26.940 40.570 1.00 0.00 ATOM 10104 0C31 POP 81 63.940 24.910 40.790 1.00 0.00 ATOM 10105 H10X POP 81 64.360 25.300 41.740 1.00 0.00 ATOM 10106 H10Y POP 81 64.670 24.280 40.240 1.00 0.00 ATOM 10107 1C31 POP 81 62.660 24.090 41.020 1.00 0.00 ATOM 10108 H11X POP 81 62.380 23.590 40.070 1.00 0.00 ATOM 10109 H11Y POP 81 61.800 24.740 41.290 1.00 0.00 ATOM 10110 2C31 POP 81 62.950 23.050 42.110 1.00 0.00 ATOM 10111 H12X POP 81 62.690 23.480 43.100 1.00 0.00 ATOM 10112 H12Y POP 81 64.060 22.970 42.130 1.00 0.00 ATOM 10113 3C31 POP 81 62.180 21.740 41.920 1.00 0.00 ATOM 10114 H13X POP 81 62.360 21.400 40.880 1.00 0.00 ATOM 10115 H13Y POP 81 61.090 21.900 42.000 1.00 0.00 ATOM 10116 4C31 POP 81 62.610 20.630 42.880 1.00 0.00 ATOM 10117 H14X POP 81 62.910 21.000 43.890 1.00 0.00 ATOM 10118 H14Y POP 81 63.480 20.090 42.440 1.00 0.00 ATOM 10119 5C31 POP 81 61.440 19.690 43.160 1.00 0.00 ATOM 10120 H15X POP 81 61.050 19.270 42.210 1.00 0.00 ATOM 10121 H15Y POP 81 60.560 20.270 43.520 1.00 0.00 ATOM 10122 6C31 POP 81 61.740 18.630 44.220 1.00 0.00 ATOM 10123 H16X POP 81 61.920 19.170 45.170 1.00 0.00 ATOM 10124 H16Y POP 81 62.670 18.080 43.950 1.00 0.00 ATOM 10125 H16Z POP 81 60.910 17.930 44.430 1.00 0.00 ATOM 10126 N POP 82 27.680 3.080 21.890 1.00 0.00 ATOM 10127 HN1 POP 82 28.610 3.010 21.430 1.00 0.00 ATOM 10128 HN2 POP 82 27.570 2.180 22.390 1.00 0.00 ATOM 10129 HN3 POP 82 26.880 3.240 21.240 1.00 0.00 ATOM 10130 C12 POP 82 27.840 4.250 22.840 1.00 0.00 ATOM 10131 H12A POP 82 28.670 4.860 22.430 1.00 0.00 ATOM 10132 H12B POP 82 28.080 3.870 23.850 1.00 0.00 ATOM 10133 C11 POP 82 26.460 4.870 23.060 1.00 0.00 ATOM 10134 H11A POP 82 26.160 5.590 22.270 1.00 0.00 ATOM 10135 H11B POP 82 26.550 5.590 23.910 1.00 0.00 ATOM 10136 P POP 82 23.970 4.210 23.200 1.00 0.00 ATOM 10137 O13 POP 82 23.300 2.930 22.840 1.00 0.00 ATOM 10138 O14 POP 82 23.770 5.330 22.250 1.00 0.00 ATOM 10139 O11 POP 82 23.550 4.640 24.680 1.00 0.00 ATOM 10140 O12 POP 82 25.510 3.880 23.460 1.00 0.00 ATOM 10141 C1 POP 82 22.180 4.890 25.000 1.00 0.00 ATOM 10142 HA POP 82 21.700 4.000 25.450 1.00 0.00 ATOM 10143 HB POP 82 21.650 5.100 24.050 1.00 0.00 ATOM 10144 C2 POP 82 22.090 5.990 26.080 1.00 0.00 ATOM 10145 HS POP 82 22.550 6.860 25.570 1.00 0.00 ATOM 10146 O21 POP 82 22.910 5.480 27.130 1.00 0.00 ATOM 10147 C21 POP 82 23.370 6.500 27.870 1.00 0.00 ATOM 10148 O22 POP 82 23.380 7.690 27.590 1.00 0.00 ATOM 10149 C22 POP 82 23.950 6.010 29.180 1.00 0.00 ATOM 10150 H2R POP 82 24.470 6.850 29.690 1.00 0.00 ATOM 10151 H2S POP 82 24.480 5.040 29.040 1.00 0.00 ATOM 10152 C3 POP 82 20.650 6.380 26.460 1.00 0.00 ATOM 10153 HX POP 82 20.120 5.560 26.990 1.00 0.00 ATOM 10154 HY POP 82 20.060 6.530 25.530 1.00 0.00 ATOM 10155 O31 POP 82 20.460 7.470 27.360 1.00 0.00 ATOM 10156 C31 POP 82 20.660 8.680 26.850 1.00 0.00 ATOM 10157 O32 POP 82 21.100 8.930 25.730 1.00 0.00 ATOM 10158 C32 POP 82 20.240 9.650 27.950 1.00 0.00 ATOM 10159 H2X POP 82 19.770 9.200 28.850 1.00 0.00 ATOM 10160 H2Y POP 82 19.510 10.380 27.550 1.00 0.00 ATOM 10161 C23 POP 82 22.790 5.810 30.160 1.00 0.00 ATOM 10162 H3R POP 82 22.030 5.230 29.600 1.00 0.00 ATOM 10163 H3S POP 82 22.290 6.790 30.340 1.00 0.00 ATOM 10164 C24 POP 82 23.150 5.030 31.430 1.00 0.00 ATOM 10165 H4R POP 82 23.790 5.620 32.120 1.00 0.00 ATOM 10166 H4S POP 82 23.680 4.080 31.200 1.00 0.00 ATOM 10167 C25 POP 82 21.930 4.650 32.270 1.00 0.00 ATOM 10168 H5R POP 82 21.220 4.030 31.670 1.00 0.00 ATOM 10169 H5S POP 82 21.310 5.570 32.360 1.00 0.00 ATOM 10170 C26 POP 82 22.180 4.010 33.630 1.00 0.00 ATOM 10171 H6R POP 82 22.860 4.660 34.220 1.00 0.00 ATOM 10172 H6S POP 82 22.800 3.110 33.450 1.00 0.00 ATOM 10173 C27 POP 82 20.930 3.740 34.480 1.00 0.00 ATOM 10174 H7R POP 82 20.100 3.280 33.910 1.00 0.00 ATOM 10175 H7S POP 82 20.750 4.670 35.060 1.00 0.00 ATOM 10176 C28 POP 82 21.160 2.740 35.620 1.00 0.00 ATOM 10177 H8R POP 82 21.560 1.810 35.160 1.00 0.00 ATOM 10178 H8S POP 82 20.170 2.490 36.040 1.00 0.00 ATOM 10179 C29 POP 82 22.180 3.200 36.630 1.00 0.00 ATOM 10180 H91 POP 82 22.850 3.980 36.240 1.00 0.00 ATOM 10181 0C21 POP 82 22.390 2.570 37.790 1.00 0.00 ATOM 10182 1H10 POP 82 23.170 3.110 38.350 1.00 0.00 ATOM 10183 1C21 POP 82 21.710 1.390 38.420 1.00 0.00 ATOM 10184 H11R POP 82 20.750 1.230 37.880 1.00 0.00 ATOM 10185 H11S POP 82 21.380 1.600 39.460 1.00 0.00 ATOM 10186 2C21 POP 82 22.660 0.190 38.360 1.00 0.00 ATOM 10187 H12R POP 82 23.620 0.490 38.820 1.00 0.00 ATOM 10188 H12S POP 82 22.860 -0.010 37.280 1.00 0.00 ATOM 10189 3C21 POP 82 22.050 -0.950 39.180 1.00 0.00 ATOM 10190 H13R POP 82 21.070 -1.270 38.760 1.00 0.00 ATOM 10191 H13S POP 82 21.770 -0.550 40.180 1.00 0.00 ATOM 10192 4C21 POP 82 23.050 -2.080 39.390 1.00 0.00 ATOM 10193 H14R POP 82 23.910 -1.720 40.000 1.00 0.00 ATOM 10194 H14S POP 82 23.560 -2.270 38.430 1.00 0.00 ATOM 10195 5C21 POP 82 22.500 -3.430 39.870 1.00 0.00 ATOM 10196 H15R POP 82 21.990 -3.250 40.840 1.00 0.00 ATOM 10197 H15S POP 82 23.340 -4.100 40.120 1.00 0.00 ATOM 10198 6C21 POP 82 21.580 -4.120 38.860 1.00 0.00 ATOM 10199 H16R POP 82 22.090 -4.420 37.910 1.00 0.00 ATOM 10200 H16S POP 82 20.850 -3.320 38.610 1.00 0.00 ATOM 10201 7C21 POP 82 20.670 -5.240 39.360 1.00 0.00 ATOM 10202 H17R POP 82 20.280 -4.990 40.370 1.00 0.00 ATOM 10203 H17S POP 82 21.310 -6.150 39.400 1.00 0.00 ATOM 10204 8C21 POP 82 19.470 -5.500 38.460 1.00 0.00 ATOM 10205 H18R POP 82 19.800 -5.770 37.430 1.00 0.00 ATOM 10206 H18S POP 82 18.800 -4.610 38.440 1.00 0.00 ATOM 10207 H18T POP 82 18.820 -6.360 38.720 1.00 0.00 ATOM 10208 C33 POP 82 21.410 10.500 28.440 1.00 0.00 ATOM 10209 H3X POP 82 21.740 11.170 27.620 1.00 0.00 ATOM 10210 H3Y POP 82 22.230 9.860 28.830 1.00 0.00 ATOM 10211 C34 POP 82 21.020 11.480 29.540 1.00 0.00 ATOM 10212 H4X POP 82 20.230 12.140 29.120 1.00 0.00 ATOM 10213 H4Y POP 82 21.880 12.080 29.910 1.00 0.00 ATOM 10214 C35 POP 82 20.530 10.800 30.830 1.00 0.00 ATOM 10215 H5X POP 82 19.730 10.050 30.650 1.00 0.00 ATOM 10216 H5Y POP 82 20.080 11.570 31.490 1.00 0.00 ATOM 10217 C36 POP 82 21.640 10.110 31.640 1.00 0.00 ATOM 10218 H6X POP 82 22.540 10.720 31.870 1.00 0.00 ATOM 10219 H6Y POP 82 22.110 9.290 31.060 1.00 0.00 ATOM 10220 C37 POP 82 21.120 9.570 32.970 1.00 0.00 ATOM 10221 H7X POP 82 20.150 9.140 32.640 1.00 0.00 ATOM 10222 H7Y POP 82 20.890 10.450 33.610 1.00 0.00 ATOM 10223 C38 POP 82 21.960 8.620 33.830 1.00 0.00 ATOM 10224 H8X POP 82 22.870 9.200 34.090 1.00 0.00 ATOM 10225 H8Y POP 82 22.210 7.780 33.150 1.00 0.00 ATOM 10226 C39 POP 82 21.240 8.330 35.150 1.00 0.00 ATOM 10227 H9X POP 82 20.250 7.840 35.070 1.00 0.00 ATOM 10228 H9Y POP 82 21.020 9.310 35.630 1.00 0.00 ATOM 10229 0C31 POP 82 22.040 7.440 36.110 1.00 0.00 ATOM 10230 H10X POP 82 22.930 8.000 36.460 1.00 0.00 ATOM 10231 H10Y POP 82 22.350 6.460 35.690 1.00 0.00 ATOM 10232 1C31 POP 82 21.260 7.000 37.350 1.00 0.00 ATOM 10233 H11X POP 82 20.480 6.260 37.080 1.00 0.00 ATOM 10234 H11Y POP 82 20.760 7.900 37.770 1.00 0.00 ATOM 10235 2C31 POP 82 22.080 6.380 38.490 1.00 0.00 ATOM 10236 H12X POP 82 22.600 7.160 39.080 1.00 0.00 ATOM 10237 H12Y POP 82 22.780 5.630 38.050 1.00 0.00 ATOM 10238 3C31 POP 82 21.120 5.700 39.460 1.00 0.00 ATOM 10239 H13X POP 82 20.500 4.960 38.910 1.00 0.00 ATOM 10240 H13Y POP 82 20.490 6.510 39.890 1.00 0.00 ATOM 10241 4C31 POP 82 21.840 5.200 40.710 1.00 0.00 ATOM 10242 H14X POP 82 22.070 6.050 41.380 1.00 0.00 ATOM 10243 H14Y POP 82 22.710 4.510 40.590 1.00 0.00 ATOM 10244 5C31 POP 82 20.900 4.320 41.540 1.00 0.00 ATOM 10245 H15X POP 82 21.500 3.760 42.280 1.00 0.00 ATOM 10246 H15Y POP 82 20.400 3.570 40.890 1.00 0.00 ATOM 10247 6C31 POP 82 19.850 5.140 42.300 1.00 0.00 ATOM 10248 H16X POP 82 19.250 4.560 43.030 1.00 0.00 ATOM 10249 H16Y POP 82 19.130 5.630 41.610 1.00 0.00 ATOM 10250 H16Z POP 82 20.460 5.840 42.900 1.00 0.00 ATOM 10251 N POP 83 45.750 24.530 24.120 1.00 0.00 ATOM 10252 HN1 POP 83 45.870 25.550 24.270 1.00 0.00 ATOM 10253 HN2 POP 83 46.530 23.940 24.480 1.00 0.00 ATOM 10254 HN3 POP 83 45.870 24.320 23.110 1.00 0.00 ATOM 10255 C12 POP 83 44.350 24.130 24.530 1.00 0.00 ATOM 10256 H12A POP 83 44.270 23.020 24.590 1.00 0.00 ATOM 10257 H12B POP 83 43.750 24.610 23.730 1.00 0.00 ATOM 10258 C11 POP 83 43.930 24.760 25.860 1.00 0.00 ATOM 10259 H11A POP 83 43.050 24.140 26.160 1.00 0.00 ATOM 10260 H11B POP 83 43.600 25.810 25.750 1.00 0.00 ATOM 10261 P POP 83 44.740 23.830 28.200 1.00 0.00 ATOM 10262 O13 POP 83 46.080 23.780 28.830 1.00 0.00 ATOM 10263 O14 POP 83 44.110 22.520 27.940 1.00 0.00 ATOM 10264 O11 POP 83 43.810 24.800 29.070 1.00 0.00 ATOM 10265 O12 POP 83 44.970 24.610 26.820 1.00 0.00 ATOM 10266 C1 POP 83 44.180 25.690 30.130 1.00 0.00 ATOM 10267 HA POP 83 43.980 26.740 29.810 1.00 0.00 ATOM 10268 HB POP 83 45.240 25.560 30.430 1.00 0.00 ATOM 10269 C2 POP 83 43.400 25.290 31.390 1.00 0.00 ATOM 10270 HS POP 83 43.870 26.030 32.080 1.00 0.00 ATOM 10271 O21 POP 83 43.710 23.920 31.660 1.00 0.00 ATOM 10272 C21 POP 83 43.950 23.690 32.950 1.00 0.00 ATOM 10273 O22 POP 83 43.700 24.500 33.820 1.00 0.00 ATOM 10274 C22 POP 83 44.450 22.260 33.150 1.00 0.00 ATOM 10275 H2R POP 83 45.340 22.040 32.520 1.00 0.00 ATOM 10276 H2S POP 83 43.650 21.540 32.880 1.00 0.00 ATOM 10277 C3 POP 83 41.900 25.450 31.070 1.00 0.00 ATOM 10278 HX POP 83 41.540 24.560 30.520 1.00 0.00 ATOM 10279 HY POP 83 41.770 26.330 30.410 1.00 0.00 ATOM 10280 O31 POP 83 41.110 25.620 32.250 1.00 0.00 ATOM 10281 C31 POP 83 41.040 26.870 32.690 1.00 0.00 ATOM 10282 O32 POP 83 41.600 27.830 32.180 1.00 0.00 ATOM 10283 C32 POP 83 40.260 26.820 34.000 1.00 0.00 ATOM 10284 H2X POP 83 40.890 26.460 34.850 1.00 0.00 ATOM 10285 H2Y POP 83 39.420 26.100 33.980 1.00 0.00 ATOM 10286 C23 POP 83 44.690 21.990 34.640 1.00 0.00 ATOM 10287 H3R POP 83 43.700 22.190 35.120 1.00 0.00 ATOM 10288 H3S POP 83 45.420 22.700 35.090 1.00 0.00 ATOM 10289 C24 POP 83 45.190 20.610 35.040 1.00 0.00 ATOM 10290 H4R POP 83 46.290 20.650 34.920 1.00 0.00 ATOM 10291 H4S POP 83 44.840 19.880 34.270 1.00 0.00 ATOM 10292 C25 POP 83 44.890 20.070 36.440 1.00 0.00 ATOM 10293 H5R POP 83 45.420 19.090 36.440 1.00 0.00 ATOM 10294 H5S POP 83 43.820 19.810 36.600 1.00 0.00 ATOM 10295 C26 POP 83 45.310 21.000 37.580 1.00 0.00 ATOM 10296 H6R POP 83 44.720 21.940 37.530 1.00 0.00 ATOM 10297 H6S POP 83 46.380 21.270 37.460 1.00 0.00 ATOM 10298 C27 POP 83 45.030 20.390 38.950 1.00 0.00 ATOM 10299 H7R POP 83 45.750 19.580 39.170 1.00 0.00 ATOM 10300 H7S POP 83 43.980 20.020 38.940 1.00 0.00 ATOM 10301 C28 POP 83 45.270 21.330 40.130 1.00 0.00 ATOM 10302 H8R POP 83 44.890 22.350 39.880 1.00 0.00 ATOM 10303 H8S POP 83 46.360 21.380 40.350 1.00 0.00 ATOM 10304 C29 POP 83 44.570 20.850 41.370 1.00 0.00 ATOM 10305 H91 POP 83 45.200 20.360 42.130 1.00 0.00 ATOM 10306 0C21 POP 83 43.320 21.210 41.650 1.00 0.00 ATOM 10307 1H10 POP 83 42.940 21.060 42.670 1.00 0.00 ATOM 10308 1C21 POP 83 42.370 22.060 40.840 1.00 0.00 ATOM 10309 H11R POP 83 42.770 22.430 39.880 1.00 0.00 ATOM 10310 H11S POP 83 42.060 22.950 41.430 1.00 0.00 ATOM 10311 2C21 POP 83 41.120 21.220 40.590 1.00 0.00 ATOM 10312 H12R POP 83 41.480 20.330 40.030 1.00 0.00 ATOM 10313 H12S POP 83 40.420 21.780 39.930 1.00 0.00 ATOM 10314 3C21 POP 83 40.460 20.900 41.940 1.00 0.00 ATOM 10315 H13R POP 83 40.360 21.860 42.500 1.00 0.00 ATOM 10316 H13S POP 83 41.120 20.240 42.540 1.00 0.00 ATOM 10317 4C21 POP 83 39.150 20.170 41.670 1.00 0.00 ATOM 10318 H14R POP 83 39.330 19.360 40.930 1.00 0.00 ATOM 10319 H14S POP 83 38.540 20.940 41.140 1.00 0.00 ATOM 10320 5C21 POP 83 38.390 19.730 42.930 1.00 0.00 ATOM 10321 H15R POP 83 37.400 19.320 42.650 1.00 0.00 ATOM 10322 H15S POP 83 38.240 20.630 43.570 1.00 0.00 ATOM 10323 6C21 POP 83 39.290 18.700 43.610 1.00 0.00 ATOM 10324 H16R POP 83 40.160 19.230 44.060 1.00 0.00 ATOM 10325 H16S POP 83 39.700 18.050 42.800 1.00 0.00 ATOM 10326 7C21 POP 83 38.470 18.000 44.700 1.00 0.00 ATOM 10327 H17R POP 83 37.520 17.650 44.240 1.00 0.00 ATOM 10328 H17S POP 83 38.320 18.730 45.520 1.00 0.00 ATOM 10329 8C21 POP 83 39.140 16.750 45.270 1.00 0.00 ATOM 10330 H18R POP 83 40.080 17.070 45.760 1.00 0.00 ATOM 10331 H18S POP 83 39.430 15.950 44.560 1.00 0.00 ATOM 10332 H18T POP 83 38.470 16.310 46.040 1.00 0.00 ATOM 10333 C33 POP 83 39.910 28.250 34.400 1.00 0.00 ATOM 10334 H3X POP 83 39.180 28.510 33.590 1.00 0.00 ATOM 10335 H3Y POP 83 40.740 28.990 34.430 1.00 0.00 ATOM 10336 C34 POP 83 39.260 28.330 35.780 1.00 0.00 ATOM 10337 H4X POP 83 39.900 27.850 36.550 1.00 0.00 ATOM 10338 H4Y POP 83 38.400 27.650 35.670 1.00 0.00 ATOM 10339 C35 POP 83 38.660 29.710 36.090 1.00 0.00 ATOM 10340 H5X POP 83 38.150 30.140 35.200 1.00 0.00 ATOM 10341 H5Y POP 83 39.550 30.330 36.330 1.00 0.00 ATOM 10342 C36 POP 83 37.680 29.770 37.260 1.00 0.00 ATOM 10343 H6X POP 83 37.340 30.830 37.270 1.00 0.00 ATOM 10344 H6Y POP 83 38.310 29.540 38.140 1.00 0.00 ATOM 10345 C37 POP 83 36.460 28.850 37.190 1.00 0.00 ATOM 10346 H7X POP 83 35.940 28.890 38.170 1.00 0.00 ATOM 10347 H7Y POP 83 36.840 27.830 36.950 1.00 0.00 ATOM 10348 C38 POP 83 35.450 29.250 36.110 1.00 0.00 ATOM 10349 H8X POP 83 35.890 29.490 35.120 1.00 0.00 ATOM 10350 H8Y POP 83 34.960 30.180 36.470 1.00 0.00 ATOM 10351 C39 POP 83 34.290 28.260 36.130 1.00 0.00 ATOM 10352 H9X POP 83 33.900 28.110 37.160 1.00 0.00 ATOM 10353 H9Y POP 83 34.820 27.330 35.840 1.00 0.00 ATOM 10354 0C31 POP 83 33.280 28.490 35.000 1.00 0.00 ATOM 10355 H10X POP 83 32.650 27.590 34.890 1.00 0.00 ATOM 10356 H10Y POP 83 33.750 28.540 34.000 1.00 0.00 ATOM 10357 1C31 POP 83 32.450 29.780 35.130 1.00 0.00 ATOM 10358 H11X POP 83 31.870 29.910 34.200 1.00 0.00 ATOM 10359 H11Y POP 83 33.130 30.660 35.220 1.00 0.00 ATOM 10360 2C31 POP 83 31.530 29.740 36.350 1.00 0.00 ATOM 10361 H12X POP 83 32.050 30.080 37.270 1.00 0.00 ATOM 10362 H12Y POP 83 31.340 28.650 36.410 1.00 0.00 ATOM 10363 3C31 POP 83 30.290 30.630 36.230 1.00 0.00 ATOM 10364 H13X POP 83 29.790 30.280 35.300 1.00 0.00 ATOM 10365 H13Y POP 83 30.590 31.690 36.070 1.00 0.00 ATOM 10366 4C31 POP 83 29.260 30.490 37.360 1.00 0.00 ATOM 10367 H14X POP 83 29.110 29.400 37.530 1.00 0.00 ATOM 10368 H14Y POP 83 28.330 30.990 37.020 1.00 0.00 ATOM 10369 5C31 POP 83 29.630 31.320 38.590 1.00 0.00 ATOM 10370 H15X POP 83 28.810 31.950 39.000 1.00 0.00 ATOM 10371 H15Y POP 83 30.440 31.960 38.170 1.00 0.00 ATOM 10372 6C31 POP 83 30.340 30.510 39.670 1.00 0.00 ATOM 10373 H16X POP 83 31.280 30.190 39.190 1.00 0.00 ATOM 10374 H16Y POP 83 29.880 29.560 40.000 1.00 0.00 ATOM 10375 H16Z POP 83 30.510 31.140 40.580 1.00 0.00 ATOM 10376 N POP 84 57.500 10.510 24.860 1.00 0.00 ATOM 10377 HN1 POP 84 57.520 10.040 23.930 1.00 0.00 ATOM 10378 HN2 POP 84 58.160 10.030 25.500 1.00 0.00 ATOM 10379 HN3 POP 84 56.550 10.540 25.270 1.00 0.00 ATOM 10380 C12 POP 84 57.920 11.940 24.640 1.00 0.00 ATOM 10381 H12A POP 84 57.850 12.500 25.600 1.00 0.00 ATOM 10382 H12B POP 84 57.170 12.410 23.960 1.00 0.00 ATOM 10383 C11 POP 84 59.370 12.160 24.210 1.00 0.00 ATOM 10384 H11A POP 84 59.460 13.260 24.270 1.00 0.00 ATOM 10385 H11B POP 84 59.570 11.840 23.160 1.00 0.00 ATOM 10386 P POP 84 61.830 11.550 24.550 1.00 0.00 ATOM 10387 O13 POP 84 62.420 12.880 24.820 1.00 0.00 ATOM 10388 O14 POP 84 61.930 11.040 23.160 1.00 0.00 ATOM 10389 O11 POP 84 62.570 10.470 25.480 1.00 0.00 ATOM 10390 O12 POP 84 60.330 11.590 25.100 1.00 0.00 ATOM 10391 C1 POP 84 61.970 9.190 25.670 1.00 0.00 ATOM 10392 HA POP 84 62.570 8.390 25.190 1.00 0.00 ATOM 10393 HB POP 84 61.010 9.140 25.110 1.00 0.00 ATOM 10394 C2 POP 84 61.820 8.840 27.160 1.00 0.00 ATOM 10395 HS POP 84 61.050 8.050 27.290 1.00 0.00 ATOM 10396 O21 POP 84 61.390 9.970 27.920 1.00 0.00 ATOM 10397 C21 POP 84 60.110 10.290 27.730 1.00 0.00 ATOM 10398 O22 POP 84 59.310 9.750 26.980 1.00 0.00 ATOM 10399 C22 POP 84 59.850 11.600 28.450 1.00 0.00 ATOM 10400 H2R POP 84 59.750 12.440 27.730 1.00 0.00 ATOM 10401 H2S POP 84 60.660 11.870 29.170 1.00 0.00 ATOM 10402 C3 POP 84 63.170 8.300 27.680 1.00 0.00 ATOM 10403 HX POP 84 63.860 9.060 27.270 1.00 0.00 ATOM 10404 HY POP 84 63.400 7.270 27.320 1.00 0.00 ATOM 10405 O31 POP 84 63.230 8.360 29.110 1.00 0.00 ATOM 10406 C31 POP 84 62.610 7.370 29.740 1.00 0.00 ATOM 10407 O32 POP 84 62.200 6.360 29.180 1.00 0.00 ATOM 10408 C32 POP 84 62.470 7.680 31.230 1.00 0.00 ATOM 10409 H2X POP 84 62.280 8.760 31.370 1.00 0.00 ATOM 10410 H2Y POP 84 63.460 7.440 31.670 1.00 0.00 ATOM 10411 C23 POP 84 58.450 11.620 29.080 1.00 0.00 ATOM 10412 H3R POP 84 57.640 11.660 28.320 1.00 0.00 ATOM 10413 H3S POP 84 58.470 12.560 29.670 1.00 0.00 ATOM 10414 C24 POP 84 58.200 10.580 30.170 1.00 0.00 ATOM 10415 H4R POP 84 58.870 10.690 31.040 1.00 0.00 ATOM 10416 H4S POP 84 58.160 9.570 29.700 1.00 0.00 ATOM 10417 C25 POP 84 56.730 10.730 30.570 1.00 0.00 ATOM 10418 H5R POP 84 56.070 10.280 29.790 1.00 0.00 ATOM 10419 H5S POP 84 56.470 11.810 30.560 1.00 0.00 ATOM 10420 C26 POP 84 56.410 10.120 31.940 1.00 0.00 ATOM 10421 H6R POP 84 56.800 9.100 32.130 1.00 0.00 ATOM 10422 H6S POP 84 55.300 10.050 32.020 1.00 0.00 ATOM 10423 C27 POP 84 56.990 11.050 33.000 1.00 0.00 ATOM 10424 H7R POP 84 57.030 12.110 32.660 1.00 0.00 ATOM 10425 H7S POP 84 58.000 10.650 33.240 1.00 0.00 ATOM 10426 C28 POP 84 56.120 11.060 34.250 1.00 0.00 ATOM 10427 H8R POP 84 55.110 10.660 34.000 1.00 0.00 ATOM 10428 H8S POP 84 56.060 12.010 34.820 1.00 0.00 ATOM 10429 C29 POP 84 56.670 10.060 35.230 1.00 0.00 ATOM 10430 H91 POP 84 57.100 9.180 34.730 1.00 0.00 ATOM 10431 0C21 POP 84 56.420 10.000 36.550 1.00 0.00 ATOM 10432 1H10 POP 84 56.890 9.210 37.150 1.00 0.00 ATOM 10433 1C21 POP 84 55.760 11.090 37.340 1.00 0.00 ATOM 10434 H11R POP 84 55.270 11.750 36.600 1.00 0.00 ATOM 10435 H11S POP 84 56.500 11.590 38.000 1.00 0.00 ATOM 10436 2C21 POP 84 54.580 10.540 38.160 1.00 0.00 ATOM 10437 H12R POP 84 55.090 10.270 39.110 1.00 0.00 ATOM 10438 H12S POP 84 53.950 9.780 37.660 1.00 0.00 ATOM 10439 3C21 POP 84 53.610 11.590 38.710 1.00 0.00 ATOM 10440 H13R POP 84 52.950 12.000 37.920 1.00 0.00 ATOM 10441 H13S POP 84 54.160 12.470 39.110 1.00 0.00 ATOM 10442 4C21 POP 84 52.740 10.840 39.730 1.00 0.00 ATOM 10443 H14R POP 84 53.350 10.420 40.560 1.00 0.00 ATOM 10444 H14S POP 84 52.180 10.020 39.230 1.00 0.00 ATOM 10445 5C21 POP 84 51.720 11.750 40.420 1.00 0.00 ATOM 10446 H15R POP 84 51.090 11.190 41.130 1.00 0.00 ATOM 10447 H15S POP 84 51.020 12.080 39.620 1.00 0.00 ATOM 10448 6C21 POP 84 52.380 12.910 41.170 1.00 0.00 ATOM 10449 H16R POP 84 52.970 13.560 40.490 1.00 0.00 ATOM 10450 H16S POP 84 53.220 12.520 41.790 1.00 0.00 ATOM 10451 7C21 POP 84 51.420 13.730 42.030 1.00 0.00 ATOM 10452 H17R POP 84 50.570 14.060 41.410 1.00 0.00 ATOM 10453 H17S POP 84 52.000 14.620 42.390 1.00 0.00 ATOM 10454 8C21 POP 84 50.840 13.030 43.260 1.00 0.00 ATOM 10455 H18R POP 84 50.410 12.040 43.020 1.00 0.00 ATOM 10456 H18S POP 84 50.050 13.590 43.790 1.00 0.00 ATOM 10457 H18T POP 84 51.670 12.760 43.950 1.00 0.00 ATOM 10458 C33 POP 84 61.310 6.890 31.840 1.00 0.00 ATOM 10459 H3X POP 84 61.630 5.840 32.000 1.00 0.00 ATOM 10460 H3Y POP 84 60.410 6.800 31.180 1.00 0.00 ATOM 10461 C34 POP 84 60.750 7.460 33.140 1.00 0.00 ATOM 10462 H4X POP 84 59.900 6.870 33.560 1.00 0.00 ATOM 10463 H4Y POP 84 60.330 8.440 32.830 1.00 0.00 ATOM 10464 C35 POP 84 61.800 7.680 34.230 1.00 0.00 ATOM 10465 H5X POP 84 62.520 8.410 33.790 1.00 0.00 ATOM 10466 H5Y POP 84 62.300 6.760 34.600 1.00 0.00 ATOM 10467 C36 POP 84 61.140 8.400 35.410 1.00 0.00 ATOM 10468 H6X POP 84 60.120 7.990 35.520 1.00 0.00 ATOM 10469 H6Y POP 84 61.120 9.480 35.140 1.00 0.00 ATOM 10470 C37 POP 84 61.970 8.140 36.670 1.00 0.00 ATOM 10471 H7X POP 84 63.080 8.210 36.620 1.00 0.00 ATOM 10472 H7Y POP 84 61.780 7.080 36.920 1.00 0.00 ATOM 10473 C38 POP 84 61.550 9.100 37.790 1.00 0.00 ATOM 10474 H8X POP 84 62.090 8.960 38.760 1.00 0.00 ATOM 10475 H8Y POP 84 60.510 8.820 38.050 1.00 0.00 ATOM 10476 C39 POP 84 61.810 10.560 37.440 1.00 0.00 ATOM 10477 H9X POP 84 61.100 10.980 36.700 1.00 0.00 ATOM 10478 H9Y POP 84 62.820 10.520 36.980 1.00 0.00 ATOM 10479 0C31 POP 84 61.670 11.530 38.620 1.00 0.00 ATOM 10480 H10X POP 84 61.920 12.540 38.230 1.00 0.00 ATOM 10481 H10Y POP 84 62.430 11.460 39.430 1.00 0.00 ATOM 10482 1C31 POP 84 60.270 11.420 39.240 1.00 0.00 ATOM 10483 H11X POP 84 60.020 10.390 39.580 1.00 0.00 ATOM 10484 H11Y POP 84 59.490 11.740 38.530 1.00 0.00 ATOM 10485 2C31 POP 84 60.230 12.310 40.490 1.00 0.00 ATOM 10486 H12X POP 84 60.240 13.370 40.180 1.00 0.00 ATOM 10487 H12Y POP 84 60.990 12.130 41.270 1.00 0.00 ATOM 10488 3C31 POP 84 58.940 12.290 41.320 1.00 0.00 ATOM 10489 H13X POP 84 58.930 13.100 42.080 1.00 0.00 ATOM 10490 H13Y POP 84 59.030 11.400 41.990 1.00 0.00 ATOM 10491 4C31 POP 84 57.660 12.190 40.500 1.00 0.00 ATOM 10492 H14X POP 84 57.790 11.200 40.010 1.00 0.00 ATOM 10493 H14Y POP 84 57.740 13.030 39.780 1.00 0.00 ATOM 10494 5C31 POP 84 56.370 12.210 41.340 1.00 0.00 ATOM 10495 H15X POP 84 56.410 11.240 41.870 1.00 0.00 ATOM 10496 H15Y POP 84 55.500 12.270 40.650 1.00 0.00 ATOM 10497 6C31 POP 84 56.220 13.320 42.380 1.00 0.00 ATOM 10498 H16X POP 84 55.390 13.220 43.110 1.00 0.00 ATOM 10499 H16Y POP 84 55.990 14.250 41.810 1.00 0.00 ATOM 10500 H16Z POP 84 57.190 13.480 42.900 1.00 0.00 ATOM 10501 N POP 85 7.480 51.280 21.630 1.00 0.00 ATOM 10502 HN1 POP 85 7.820 50.590 20.940 1.00 0.00 ATOM 10503 HN2 POP 85 6.660 51.780 21.260 1.00 0.00 ATOM 10504 HN3 POP 85 8.230 51.970 21.850 1.00 0.00 ATOM 10505 C12 POP 85 7.010 50.580 22.890 1.00 0.00 ATOM 10506 H12A POP 85 7.060 51.380 23.650 1.00 0.00 ATOM 10507 H12B POP 85 7.730 49.760 23.090 1.00 0.00 ATOM 10508 C11 POP 85 5.530 50.190 22.860 1.00 0.00 ATOM 10509 H11A POP 85 4.860 51.070 23.000 1.00 0.00 ATOM 10510 H11B POP 85 5.420 49.580 23.780 1.00 0.00 ATOM 10511 P POP 85 5.230 47.900 21.820 1.00 0.00 ATOM 10512 O13 POP 85 5.660 47.450 20.470 1.00 0.00 ATOM 10513 O14 POP 85 3.940 47.310 22.260 1.00 0.00 ATOM 10514 O11 POP 85 6.320 47.530 22.920 1.00 0.00 ATOM 10515 O12 POP 85 5.230 49.490 21.650 1.00 0.00 ATOM 10516 C1 POP 85 6.570 46.140 23.170 1.00 0.00 ATOM 10517 HA POP 85 7.670 45.990 23.300 1.00 0.00 ATOM 10518 HB POP 85 6.130 45.450 22.420 1.00 0.00 ATOM 10519 C2 POP 85 6.040 45.650 24.530 1.00 0.00 ATOM 10520 HS POP 85 4.940 45.790 24.510 1.00 0.00 ATOM 10521 O21 POP 85 6.670 46.470 25.510 1.00 0.00 ATOM 10522 C21 POP 85 5.880 47.010 26.430 1.00 0.00 ATOM 10523 O22 POP 85 4.680 46.810 26.510 1.00 0.00 ATOM 10524 C22 POP 85 6.680 47.920 27.350 1.00 0.00 ATOM 10525 H2R POP 85 6.950 48.850 26.800 1.00 0.00 ATOM 10526 H2S POP 85 7.580 47.340 27.650 1.00 0.00 ATOM 10527 C3 POP 85 6.260 44.140 24.740 1.00 0.00 ATOM 10528 HX POP 85 7.350 43.950 24.870 1.00 0.00 ATOM 10529 HY POP 85 5.940 43.620 23.820 1.00 0.00 ATOM 10530 O31 POP 85 5.630 43.710 25.940 1.00 0.00 ATOM 10531 C31 POP 85 4.340 43.390 25.950 1.00 0.00 ATOM 10532 O32 POP 85 3.620 43.360 24.970 1.00 0.00 ATOM 10533 C32 POP 85 3.890 43.030 27.360 1.00 0.00 ATOM 10534 H2X POP 85 4.550 42.290 27.860 1.00 0.00 ATOM 10535 H2Y POP 85 2.850 42.650 27.280 1.00 0.00 ATOM 10536 C23 POP 85 5.860 48.290 28.580 1.00 0.00 ATOM 10537 H3R POP 85 5.530 47.360 29.100 1.00 0.00 ATOM 10538 H3S POP 85 5.080 49.030 28.290 1.00 0.00 ATOM 10539 C24 POP 85 6.770 49.020 29.570 1.00 0.00 ATOM 10540 H4R POP 85 7.240 49.910 29.100 1.00 0.00 ATOM 10541 H4S POP 85 7.610 48.350 29.850 1.00 0.00 ATOM 10542 C25 POP 85 6.140 49.180 30.960 1.00 0.00 ATOM 10543 H5R POP 85 5.650 48.240 31.300 1.00 0.00 ATOM 10544 H5S POP 85 5.350 49.950 30.810 1.00 0.00 ATOM 10545 C26 POP 85 7.190 49.740 31.920 1.00 0.00 ATOM 10546 H6R POP 85 7.560 50.770 31.710 1.00 0.00 ATOM 10547 H6S POP 85 8.110 49.130 31.860 1.00 0.00 ATOM 10548 C27 POP 85 6.640 49.760 33.350 1.00 0.00 ATOM 10549 H7R POP 85 6.190 48.750 33.460 1.00 0.00 ATOM 10550 H7S POP 85 5.770 50.450 33.330 1.00 0.00 ATOM 10551 C28 POP 85 7.640 50.030 34.480 1.00 0.00 ATOM 10552 H8R POP 85 7.910 51.110 34.420 1.00 0.00 ATOM 10553 H8S POP 85 8.500 49.380 34.240 1.00 0.00 ATOM 10554 C29 POP 85 7.190 49.620 35.850 1.00 0.00 ATOM 10555 H91 POP 85 6.830 48.590 36.000 1.00 0.00 ATOM 10556 0C21 POP 85 7.410 50.310 36.980 1.00 0.00 ATOM 10557 1H10 POP 85 7.130 49.900 37.960 1.00 0.00 ATOM 10558 1C21 POP 85 7.960 51.700 37.110 1.00 0.00 ATOM 10559 H11R POP 85 7.860 52.320 36.190 1.00 0.00 ATOM 10560 H11S POP 85 9.040 51.590 37.350 1.00 0.00 ATOM 10561 2C21 POP 85 7.420 52.620 38.210 1.00 0.00 ATOM 10562 H12R POP 85 6.370 52.940 38.000 1.00 0.00 ATOM 10563 H12S POP 85 8.070 53.520 38.120 1.00 0.00 ATOM 10564 3C21 POP 85 7.540 52.090 39.640 1.00 0.00 ATOM 10565 H13R POP 85 8.430 51.430 39.710 1.00 0.00 ATOM 10566 H13S POP 85 6.660 51.430 39.760 1.00 0.00 ATOM 10567 4C21 POP 85 7.600 53.130 40.750 1.00 0.00 ATOM 10568 H14R POP 85 6.590 53.580 40.770 1.00 0.00 ATOM 10569 H14S POP 85 8.410 53.880 40.600 1.00 0.00 ATOM 10570 5C21 POP 85 7.840 52.580 42.160 1.00 0.00 ATOM 10571 H15R POP 85 7.300 53.140 42.950 1.00 0.00 ATOM 10572 H15S POP 85 8.930 52.640 42.350 1.00 0.00 ATOM 10573 6C21 POP 85 7.430 51.130 42.440 1.00 0.00 ATOM 10574 H16R POP 85 8.010 50.760 43.310 1.00 0.00 ATOM 10575 H16S POP 85 7.860 50.570 41.580 1.00 0.00 ATOM 10576 7C21 POP 85 5.920 50.990 42.620 1.00 0.00 ATOM 10577 H17R POP 85 5.320 51.270 41.730 1.00 0.00 ATOM 10578 H17S POP 85 5.630 51.750 43.380 1.00 0.00 ATOM 10579 8C21 POP 85 5.480 49.600 43.100 1.00 0.00 ATOM 10580 H18R POP 85 4.410 49.760 43.350 1.00 0.00 ATOM 10581 H18S POP 85 6.090 49.280 43.970 1.00 0.00 ATOM 10582 H18T POP 85 5.730 48.980 42.210 1.00 0.00 ATOM 10583 C33 POP 85 3.960 44.210 28.320 1.00 0.00 ATOM 10584 H3X POP 85 3.400 45.100 27.970 1.00 0.00 ATOM 10585 H3Y POP 85 5.030 44.520 28.300 1.00 0.00 ATOM 10586 C34 POP 85 3.460 43.830 29.710 1.00 0.00 ATOM 10587 H4X POP 85 3.650 42.740 29.820 1.00 0.00 ATOM 10588 H4Y POP 85 2.360 44.010 29.670 1.00 0.00 ATOM 10589 C35 POP 85 4.120 44.630 30.840 1.00 0.00 ATOM 10590 H5X POP 85 3.580 45.570 31.080 1.00 0.00 ATOM 10591 H5Y POP 85 5.200 44.860 30.690 1.00 0.00 ATOM 10592 C36 POP 85 4.150 43.820 32.130 1.00 0.00 ATOM 10593 H6X POP 85 4.860 44.330 32.820 1.00 0.00 ATOM 10594 H6Y POP 85 4.700 42.890 31.850 1.00 0.00 ATOM 10595 C37 POP 85 2.850 43.520 32.880 1.00 0.00 ATOM 10596 H7X POP 85 2.220 42.810 32.300 1.00 0.00 ATOM 10597 H7Y POP 85 2.310 44.490 32.990 1.00 0.00 ATOM 10598 C38 POP 85 3.170 42.920 34.250 1.00 0.00 ATOM 10599 H8X POP 85 4.090 43.320 34.730 1.00 0.00 ATOM 10600 H8Y POP 85 3.520 41.900 34.010 1.00 0.00 ATOM 10601 C39 POP 85 1.940 42.950 35.170 1.00 0.00 ATOM 10602 H9X POP 85 1.150 42.250 34.810 1.00 0.00 ATOM 10603 H9Y POP 85 1.570 43.980 35.000 1.00 0.00 ATOM 10604 0C31 POP 85 2.220 42.830 36.670 1.00 0.00 ATOM 10605 H10X POP 85 1.480 43.490 37.170 1.00 0.00 ATOM 10606 H10Y POP 85 3.250 43.170 36.900 1.00 0.00 ATOM 10607 1C31 POP 85 2.110 41.430 37.270 1.00 0.00 ATOM 10608 H11X POP 85 3.040 40.850 37.060 1.00 0.00 ATOM 10609 H11Y POP 85 1.310 40.940 36.680 1.00 0.00 ATOM 10610 2C31 POP 85 1.560 41.320 38.690 1.00 0.00 ATOM 10611 H12X POP 85 1.480 40.230 38.850 1.00 0.00 ATOM 10612 H12Y POP 85 0.540 41.750 38.600 1.00 0.00 ATOM 10613 3C31 POP 85 2.410 41.840 39.860 1.00 0.00 ATOM 10614 H13X POP 85 2.720 42.890 39.670 1.00 0.00 ATOM 10615 H13Y POP 85 3.290 41.160 39.930 1.00 0.00 ATOM 10616 4C31 POP 85 1.710 41.840 41.220 1.00 0.00 ATOM 10617 H14X POP 85 1.800 40.780 41.540 1.00 0.00 ATOM 10618 H14Y POP 85 0.700 42.220 40.970 1.00 0.00 ATOM 10619 5C31 POP 85 2.430 42.750 42.220 1.00 0.00 ATOM 10620 H15X POP 85 1.700 43.080 42.990 1.00 0.00 ATOM 10621 H15Y POP 85 2.740 43.700 41.740 1.00 0.00 ATOM 10622 6C31 POP 85 3.710 42.110 42.740 1.00 0.00 ATOM 10623 H16X POP 85 4.400 41.780 41.930 1.00 0.00 ATOM 10624 H16Y POP 85 3.570 41.340 43.530 1.00 0.00 ATOM 10625 H16Z POP 85 4.260 42.900 43.290 1.00 0.00 ATOM 10626 N POP 86 15.210 9.700 20.440 1.00 0.00 ATOM 10627 HN1 POP 86 15.290 8.770 20.890 1.00 0.00 ATOM 10628 HN2 POP 86 14.940 10.420 21.140 1.00 0.00 ATOM 10629 HN3 POP 86 14.460 9.680 19.720 1.00 0.00 ATOM 10630 C12 POP 86 16.480 10.220 19.820 1.00 0.00 ATOM 10631 H12A POP 86 16.290 11.280 19.560 1.00 0.00 ATOM 10632 H12B POP 86 16.740 9.700 18.870 1.00 0.00 ATOM 10633 C11 POP 86 17.630 10.230 20.830 1.00 0.00 ATOM 10634 H11A POP 86 18.440 10.810 20.340 1.00 0.00 ATOM 10635 H11B POP 86 18.080 9.220 20.950 1.00 0.00 ATOM 10636 P POP 86 18.510 11.420 22.840 1.00 0.00 ATOM 10637 O13 POP 86 18.650 12.880 22.680 1.00 0.00 ATOM 10638 O14 POP 86 19.660 10.580 22.410 1.00 0.00 ATOM 10639 O11 POP 86 18.130 11.080 24.350 1.00 0.00 ATOM 10640 O12 POP 86 17.240 10.800 22.090 1.00 0.00 ATOM 10641 C1 POP 86 18.080 9.730 24.840 1.00 0.00 ATOM 10642 HA POP 86 18.380 9.780 25.910 1.00 0.00 ATOM 10643 HB POP 86 18.880 9.120 24.370 1.00 0.00 ATOM 10644 C2 POP 86 16.700 9.070 24.750 1.00 0.00 ATOM 10645 HS POP 86 16.600 8.770 23.690 1.00 0.00 ATOM 10646 O21 POP 86 15.700 9.970 25.240 1.00 0.00 ATOM 10647 C21 POP 86 14.440 9.640 24.950 1.00 0.00 ATOM 10648 O22 POP 86 14.100 8.720 24.240 1.00 0.00 ATOM 10649 C22 POP 86 13.560 10.360 25.970 1.00 0.00 ATOM 10650 H2R POP 86 12.760 10.930 25.450 1.00 0.00 ATOM 10651 H2S POP 86 14.160 11.160 26.470 1.00 0.00 ATOM 10652 C3 POP 86 16.640 7.820 25.650 1.00 0.00 ATOM 10653 HX POP 86 17.400 7.200 25.120 1.00 0.00 ATOM 10654 HY POP 86 15.660 7.300 25.600 1.00 0.00 ATOM 10655 O31 POP 86 16.960 8.090 27.010 1.00 0.00 ATOM 10656 C31 POP 86 16.990 6.900 27.610 1.00 0.00 ATOM 10657 O32 POP 86 16.890 5.810 27.050 1.00 0.00 ATOM 10658 C32 POP 86 17.170 7.070 29.110 1.00 0.00 ATOM 10659 H2X POP 86 16.190 6.990 29.640 1.00 0.00 ATOM 10660 H2Y POP 86 17.630 8.060 29.330 1.00 0.00 ATOM 10661 C23 POP 86 13.150 9.440 27.110 1.00 0.00 ATOM 10662 H3R POP 86 14.070 8.880 27.360 1.00 0.00 ATOM 10663 H3S POP 86 12.380 8.730 26.720 1.00 0.00 ATOM 10664 C24 POP 86 12.660 10.110 28.390 1.00 0.00 ATOM 10665 H4R POP 86 11.820 10.730 27.990 1.00 0.00 ATOM 10666 H4S POP 86 13.450 10.760 28.820 1.00 0.00 ATOM 10667 C25 POP 86 12.110 9.090 29.390 1.00 0.00 ATOM 10668 H5R POP 86 12.750 8.230 29.690 1.00 0.00 ATOM 10669 H5S POP 86 11.100 8.780 29.040 1.00 0.00 ATOM 10670 C26 POP 86 11.680 9.800 30.670 1.00 0.00 ATOM 10671 H6R POP 86 11.150 10.770 30.510 1.00 0.00 ATOM 10672 H6S POP 86 12.600 10.140 31.200 1.00 0.00 ATOM 10673 C27 POP 86 10.940 8.860 31.620 1.00 0.00 ATOM 10674 H7R POP 86 10.850 7.810 31.280 1.00 0.00 ATOM 10675 H7S POP 86 9.910 9.270 31.610 1.00 0.00 ATOM 10676 C28 POP 86 11.490 8.780 33.040 1.00 0.00 ATOM 10677 H8R POP 86 11.270 9.780 33.480 1.00 0.00 ATOM 10678 H8S POP 86 12.580 8.600 32.970 1.00 0.00 ATOM 10679 C29 POP 86 10.770 7.670 33.750 1.00 0.00 ATOM 10680 H91 POP 86 11.110 6.670 33.430 1.00 0.00 ATOM 10681 0C21 POP 86 10.160 7.810 34.940 1.00 0.00 ATOM 10682 1H10 POP 86 9.770 6.900 35.430 1.00 0.00 ATOM 10683 1C21 POP 86 9.640 9.090 35.510 1.00 0.00 ATOM 10684 H11R POP 86 9.260 9.800 34.750 1.00 0.00 ATOM 10685 H11S POP 86 10.520 9.680 35.840 1.00 0.00 ATOM 10686 2C21 POP 86 8.540 9.030 36.580 1.00 0.00 ATOM 10687 H12R POP 86 7.700 8.440 36.160 1.00 0.00 ATOM 10688 H12S POP 86 8.150 10.030 36.860 1.00 0.00 ATOM 10689 3C21 POP 86 9.080 8.430 37.880 1.00 0.00 ATOM 10690 H13R POP 86 9.940 9.080 38.160 1.00 0.00 ATOM 10691 H13S POP 86 9.410 7.380 37.720 1.00 0.00 ATOM 10692 4C21 POP 86 8.060 8.310 39.020 1.00 0.00 ATOM 10693 H14R POP 86 7.140 7.770 38.720 1.00 0.00 ATOM 10694 H14S POP 86 7.770 9.360 39.240 1.00 0.00 ATOM 10695 5C21 POP 86 8.670 7.700 40.280 1.00 0.00 ATOM 10696 H15R POP 86 9.220 6.770 40.020 1.00 0.00 ATOM 10697 H15S POP 86 7.830 7.330 40.910 1.00 0.00 ATOM 10698 6C21 POP 86 9.670 8.610 41.000 1.00 0.00 ATOM 10699 H16R POP 86 9.070 9.450 41.430 1.00 0.00 ATOM 10700 H16S POP 86 10.490 8.920 40.330 1.00 0.00 ATOM 10701 7C21 POP 86 10.310 7.780 42.120 1.00 0.00 ATOM 10702 H17R POP 86 9.680 6.980 42.560 1.00 0.00 ATOM 10703 H17S POP 86 10.690 8.430 42.930 1.00 0.00 ATOM 10704 8C21 POP 86 11.630 7.120 41.720 1.00 0.00 ATOM 10705 H18R POP 86 11.870 6.540 42.630 1.00 0.00 ATOM 10706 H18S POP 86 12.360 7.920 41.440 1.00 0.00 ATOM 10707 H18T POP 86 11.510 6.410 40.880 1.00 0.00 ATOM 10708 C33 POP 86 18.150 5.970 29.510 1.00 0.00 ATOM 10709 H3X POP 86 19.100 5.930 28.930 1.00 0.00 ATOM 10710 H3Y POP 86 17.680 4.990 29.300 1.00 0.00 ATOM 10711 C34 POP 86 18.700 5.950 30.940 1.00 0.00 ATOM 10712 H4X POP 86 19.670 6.470 31.130 1.00 0.00 ATOM 10713 H4Y POP 86 18.930 4.890 31.170 1.00 0.00 ATOM 10714 C35 POP 86 17.630 6.370 31.950 1.00 0.00 ATOM 10715 H5X POP 86 16.640 5.890 31.760 1.00 0.00 ATOM 10716 H5Y POP 86 17.590 7.480 31.880 1.00 0.00 ATOM 10717 C36 POP 86 18.030 5.850 33.330 1.00 0.00 ATOM 10718 H6X POP 86 18.990 6.360 33.550 1.00 0.00 ATOM 10719 H6Y POP 86 18.070 4.740 33.380 1.00 0.00 ATOM 10720 C37 POP 86 17.010 6.110 34.430 1.00 0.00 ATOM 10721 H7X POP 86 15.980 5.820 34.120 1.00 0.00 ATOM 10722 H7Y POP 86 16.990 7.220 34.440 1.00 0.00 ATOM 10723 C38 POP 86 17.540 5.570 35.760 1.00 0.00 ATOM 10724 H8X POP 86 17.200 6.220 36.590 1.00 0.00 ATOM 10725 H8Y POP 86 18.640 5.630 35.850 1.00 0.00 ATOM 10726 C39 POP 86 17.210 4.110 36.100 1.00 0.00 ATOM 10727 H9X POP 86 17.590 3.470 35.280 1.00 0.00 ATOM 10728 H9Y POP 86 16.120 4.020 36.330 1.00 0.00 ATOM 10729 0C31 POP 86 17.720 3.620 37.460 1.00 0.00 ATOM 10730 H10X POP 86 18.650 4.170 37.690 1.00 0.00 ATOM 10731 H10Y POP 86 17.890 2.520 37.450 1.00 0.00 ATOM 10732 1C31 POP 86 16.780 3.930 38.620 1.00 0.00 ATOM 10733 H11X POP 86 15.960 3.190 38.630 1.00 0.00 ATOM 10734 H11Y POP 86 16.400 4.980 38.550 1.00 0.00 ATOM 10735 2C31 POP 86 17.560 3.930 39.940 1.00 0.00 ATOM 10736 H12X POP 86 18.290 4.760 39.890 1.00 0.00 ATOM 10737 H12Y POP 86 18.300 3.110 39.890 1.00 0.00 ATOM 10738 3C31 POP 86 16.730 4.000 41.230 1.00 0.00 ATOM 10739 H13X POP 86 17.450 4.110 42.070 1.00 0.00 ATOM 10740 H13Y POP 86 16.110 3.090 41.400 1.00 0.00 ATOM 10741 4C31 POP 86 15.690 5.120 41.300 1.00 0.00 ATOM 10742 H14X POP 86 15.140 4.860 42.240 1.00 0.00 ATOM 10743 H14Y POP 86 14.960 4.990 40.470 1.00 0.00 ATOM 10744 5C31 POP 86 16.300 6.510 41.320 1.00 0.00 ATOM 10745 H15X POP 86 16.780 6.590 40.320 1.00 0.00 ATOM 10746 H15Y POP 86 17.030 6.490 42.160 1.00 0.00 ATOM 10747 6C31 POP 86 15.240 7.610 41.300 1.00 0.00 ATOM 10748 H16X POP 86 14.700 7.520 42.260 1.00 0.00 ATOM 10749 H16Y POP 86 14.610 7.450 40.400 1.00 0.00 ATOM 10750 H16Z POP 86 15.760 8.600 41.240 1.00 0.00 ATOM 10751 N POP 87 42.070 29.070 23.620 1.00 0.00 ATOM 10752 HN1 POP 87 42.140 28.750 24.610 1.00 0.00 ATOM 10753 HN2 POP 87 41.960 30.100 23.620 1.00 0.00 ATOM 10754 HN3 POP 87 41.420 28.560 22.990 1.00 0.00 ATOM 10755 C12 POP 87 43.440 29.050 22.990 1.00 0.00 ATOM 10756 H12A POP 87 43.960 30.000 23.250 1.00 0.00 ATOM 10757 H12B POP 87 43.260 28.760 21.930 1.00 0.00 ATOM 10758 C11 POP 87 44.280 27.890 23.520 1.00 0.00 ATOM 10759 H11A POP 87 45.260 27.950 22.990 1.00 0.00 ATOM 10760 H11B POP 87 43.960 26.900 23.140 1.00 0.00 ATOM 10761 P POP 87 45.830 28.100 25.480 1.00 0.00 ATOM 10762 O13 POP 87 46.470 29.340 25.000 1.00 0.00 ATOM 10763 O14 POP 87 46.520 26.830 25.150 1.00 0.00 ATOM 10764 O11 POP 87 45.680 28.150 27.070 1.00 0.00 ATOM 10765 O12 POP 87 44.320 27.990 24.950 1.00 0.00 ATOM 10766 C1 POP 87 44.710 28.940 27.760 1.00 0.00 ATOM 10767 HA POP 87 43.890 28.240 28.010 1.00 0.00 ATOM 10768 HB POP 87 44.170 29.680 27.130 1.00 0.00 ATOM 10769 C2 POP 87 45.280 29.640 29.000 1.00 0.00 ATOM 10770 HS POP 87 45.930 30.470 28.660 1.00 0.00 ATOM 10771 O21 POP 87 45.980 28.630 29.730 1.00 0.00 ATOM 10772 C21 POP 87 47.010 29.110 30.420 1.00 0.00 ATOM 10773 O22 POP 87 47.350 30.280 30.550 1.00 0.00 ATOM 10774 C22 POP 87 47.810 27.990 31.070 1.00 0.00 ATOM 10775 H2R POP 87 48.900 28.210 31.130 1.00 0.00 ATOM 10776 H2S POP 87 47.670 27.070 30.470 1.00 0.00 ATOM 10777 C3 POP 87 44.070 30.210 29.760 1.00 0.00 ATOM 10778 HX POP 87 43.520 29.340 30.200 1.00 0.00 ATOM 10779 HY POP 87 43.450 30.740 29.000 1.00 0.00 ATOM 10780 O31 POP 87 44.490 30.980 30.880 1.00 0.00 ATOM 10781 C31 POP 87 43.470 31.590 31.500 1.00 0.00 ATOM 10782 O32 POP 87 42.370 31.790 31.010 1.00 0.00 ATOM 10783 C32 POP 87 43.980 32.190 32.810 1.00 0.00 ATOM 10784 H2X POP 87 43.560 33.210 32.810 1.00 0.00 ATOM 10785 H2Y POP 87 45.090 32.240 32.780 1.00 0.00 ATOM 10786 C23 POP 87 47.330 27.720 32.500 1.00 0.00 ATOM 10787 H3R POP 87 46.400 27.110 32.510 1.00 0.00 ATOM 10788 H3S POP 87 47.120 28.700 32.970 1.00 0.00 ATOM 10789 C24 POP 87 48.510 27.090 33.250 1.00 0.00 ATOM 10790 H4R POP 87 49.280 27.880 33.340 1.00 0.00 ATOM 10791 H4S POP 87 48.890 26.250 32.620 1.00 0.00 ATOM 10792 C25 POP 87 48.140 26.740 34.690 1.00 0.00 ATOM 10793 H5R POP 87 47.320 26.000 34.610 1.00 0.00 ATOM 10794 H5S POP 87 47.630 27.560 35.230 1.00 0.00 ATOM 10795 C26 POP 87 49.250 26.180 35.590 1.00 0.00 ATOM 10796 H6R POP 87 50.080 26.890 35.390 1.00 0.00 ATOM 10797 H6S POP 87 49.610 25.220 35.170 1.00 0.00 ATOM 10798 C27 POP 87 48.980 25.950 37.080 1.00 0.00 ATOM 10799 H7R POP 87 48.030 25.380 37.130 1.00 0.00 ATOM 10800 H7S POP 87 48.850 26.940 37.570 1.00 0.00 ATOM 10801 C28 POP 87 50.040 25.140 37.830 1.00 0.00 ATOM 10802 H8R POP 87 50.020 24.110 37.400 1.00 0.00 ATOM 10803 H8S POP 87 49.690 25.110 38.880 1.00 0.00 ATOM 10804 C29 POP 87 51.430 25.690 37.700 1.00 0.00 ATOM 10805 H91 POP 87 51.800 25.780 36.670 1.00 0.00 ATOM 10806 0C21 POP 87 52.190 25.960 38.780 1.00 0.00 ATOM 10807 1H10 POP 87 53.180 26.410 38.600 1.00 0.00 ATOM 10808 1C21 POP 87 51.750 25.920 40.210 1.00 0.00 ATOM 10809 H11R POP 87 51.230 24.970 40.470 1.00 0.00 ATOM 10810 H11S POP 87 51.000 26.690 40.500 1.00 0.00 ATOM 10811 2C21 POP 87 52.920 26.250 41.140 1.00 0.00 ATOM 10812 H12R POP 87 53.360 27.230 40.850 1.00 0.00 ATOM 10813 H12S POP 87 53.670 25.440 40.970 1.00 0.00 ATOM 10814 3C21 POP 87 52.550 26.270 42.620 1.00 0.00 ATOM 10815 H13R POP 87 52.540 25.300 43.170 1.00 0.00 ATOM 10816 H13S POP 87 51.550 26.740 42.670 1.00 0.00 ATOM 10817 4C21 POP 87 53.480 27.110 43.500 1.00 0.00 ATOM 10818 H14R POP 87 53.180 27.160 44.570 1.00 0.00 ATOM 10819 H14S POP 87 53.420 28.180 43.180 1.00 0.00 ATOM 10820 5C21 POP 87 54.940 26.660 43.400 1.00 0.00 ATOM 10821 H15R POP 87 55.380 26.630 42.380 1.00 0.00 ATOM 10822 H15S POP 87 54.930 25.600 43.730 1.00 0.00 ATOM 10823 6C21 POP 87 55.920 27.450 44.270 1.00 0.00 ATOM 10824 H16R POP 87 56.900 27.070 43.900 1.00 0.00 ATOM 10825 H16S POP 87 55.740 27.310 45.350 1.00 0.00 ATOM 10826 7C21 POP 87 55.930 28.950 43.960 1.00 0.00 ATOM 10827 H17R POP 87 56.580 29.570 44.620 1.00 0.00 ATOM 10828 H17S POP 87 54.940 29.440 44.120 1.00 0.00 ATOM 10829 8C21 POP 87 56.360 29.360 42.550 1.00 0.00 ATOM 10830 H18R POP 87 56.230 30.460 42.570 1.00 0.00 ATOM 10831 H18S POP 87 55.580 29.020 41.830 1.00 0.00 ATOM 10832 H18T POP 87 57.350 29.030 42.160 1.00 0.00 ATOM 10833 C33 POP 87 43.430 31.370 33.970 1.00 0.00 ATOM 10834 H3X POP 87 42.480 30.830 33.750 1.00 0.00 ATOM 10835 H3Y POP 87 43.390 31.990 34.890 1.00 0.00 ATOM 10836 C34 POP 87 44.410 30.260 34.370 1.00 0.00 ATOM 10837 H4X POP 87 45.290 30.650 34.920 1.00 0.00 ATOM 10838 H4Y POP 87 44.740 29.850 33.390 1.00 0.00 ATOM 10839 C35 POP 87 43.700 29.160 35.150 1.00 0.00 ATOM 10840 H5X POP 87 42.860 28.740 34.560 1.00 0.00 ATOM 10841 H5Y POP 87 43.300 29.560 36.110 1.00 0.00 ATOM 10842 C36 POP 87 44.680 28.030 35.460 1.00 0.00 ATOM 10843 H6X POP 87 45.520 28.520 35.980 1.00 0.00 ATOM 10844 H6Y POP 87 45.110 27.520 34.560 1.00 0.00 ATOM 10845 C37 POP 87 44.000 26.930 36.290 1.00 0.00 ATOM 10846 H7X POP 87 43.290 26.490 35.560 1.00 0.00 ATOM 10847 H7Y POP 87 43.390 27.500 37.020 1.00 0.00 ATOM 10848 C38 POP 87 44.950 25.950 36.980 1.00 0.00 ATOM 10849 H8X POP 87 45.570 26.610 37.620 1.00 0.00 ATOM 10850 H8Y POP 87 45.510 25.470 36.150 1.00 0.00 ATOM 10851 C39 POP 87 44.230 24.970 37.910 1.00 0.00 ATOM 10852 H9X POP 87 44.850 24.090 38.190 1.00 0.00 ATOM 10853 H9Y POP 87 43.380 24.480 37.390 1.00 0.00 ATOM 10854 0C31 POP 87 43.770 25.590 39.230 1.00 0.00 ATOM 10855 H10X POP 87 43.090 25.000 39.890 1.00 0.00 ATOM 10856 H10Y POP 87 43.170 26.490 38.990 1.00 0.00 ATOM 10857 1C31 POP 87 44.890 26.070 40.160 1.00 0.00 ATOM 10858 H11X POP 87 44.440 26.600 41.020 1.00 0.00 ATOM 10859 H11Y POP 87 45.590 26.760 39.640 1.00 0.00 ATOM 10860 2C31 POP 87 45.680 24.950 40.820 1.00 0.00 ATOM 10861 H12X POP 87 46.360 24.370 40.150 1.00 0.00 ATOM 10862 H12Y POP 87 44.890 24.340 41.300 1.00 0.00 ATOM 10863 3C31 POP 87 46.570 25.460 41.960 1.00 0.00 ATOM 10864 H13X POP 87 45.880 26.080 42.580 1.00 0.00 ATOM 10865 H13Y POP 87 47.450 25.980 41.530 1.00 0.00 ATOM 10866 4C31 POP 87 47.090 24.350 42.870 1.00 0.00 ATOM 10867 H14X POP 87 46.270 23.650 43.130 1.00 0.00 ATOM 10868 H14Y POP 87 47.410 24.880 43.800 1.00 0.00 ATOM 10869 5C31 POP 87 48.240 23.440 42.440 1.00 0.00 ATOM 10870 H15X POP 87 49.150 24.070 42.360 1.00 0.00 ATOM 10871 H15Y POP 87 47.920 23.040 41.450 1.00 0.00 ATOM 10872 6C31 POP 87 48.520 22.350 43.470 1.00 0.00 ATOM 10873 H16X POP 87 47.600 21.760 43.670 1.00 0.00 ATOM 10874 H16Y POP 87 49.010 22.760 44.380 1.00 0.00 ATOM 10875 H16Z POP 87 49.230 21.640 43.000 1.00 0.00 ATOM 10876 N POP 88 42.380 53.920 24.160 1.00 0.00 ATOM 10877 HN1 POP 88 43.230 53.440 24.510 1.00 0.00 ATOM 10878 HN2 POP 88 42.140 54.750 24.740 1.00 0.00 ATOM 10879 HN3 POP 88 41.550 53.290 24.230 1.00 0.00 ATOM 10880 C12 POP 88 42.540 54.310 22.710 1.00 0.00 ATOM 10881 H12A POP 88 41.570 54.800 22.460 1.00 0.00 ATOM 10882 H12B POP 88 42.770 53.370 22.170 1.00 0.00 ATOM 10883 C11 POP 88 43.770 55.220 22.610 1.00 0.00 ATOM 10884 H11A POP 88 43.590 56.170 23.150 1.00 0.00 ATOM 10885 H11B POP 88 44.030 55.400 21.550 1.00 0.00 ATOM 10886 P POP 88 45.850 55.490 24.030 1.00 0.00 ATOM 10887 O13 POP 88 46.160 56.650 23.160 1.00 0.00 ATOM 10888 O14 POP 88 47.000 54.710 24.550 1.00 0.00 ATOM 10889 O11 POP 88 44.880 55.870 25.240 1.00 0.00 ATOM 10890 O12 POP 88 44.900 54.530 23.160 1.00 0.00 ATOM 10891 C1 POP 88 45.100 57.130 25.870 1.00 0.00 ATOM 10892 HA POP 88 44.330 57.260 26.650 1.00 0.00 ATOM 10893 HB POP 88 44.810 57.960 25.200 1.00 0.00 ATOM 10894 C2 POP 88 46.500 57.340 26.480 1.00 0.00 ATOM 10895 HS POP 88 47.150 57.540 25.600 1.00 0.00 ATOM 10896 O21 POP 88 46.910 56.200 27.250 1.00 0.00 ATOM 10897 C21 POP 88 48.210 56.160 27.520 1.00 0.00 ATOM 10898 O22 POP 88 49.040 56.990 27.160 1.00 0.00 ATOM 10899 C22 POP 88 48.560 54.990 28.420 1.00 0.00 ATOM 10900 H2R POP 88 49.470 55.260 29.010 1.00 0.00 ATOM 10901 H2S POP 88 48.730 54.080 27.800 1.00 0.00 ATOM 10902 C3 POP 88 46.520 58.580 27.380 1.00 0.00 ATOM 10903 HX POP 88 45.550 59.120 27.240 1.00 0.00 ATOM 10904 HY POP 88 47.280 59.340 27.110 1.00 0.00 ATOM 10905 O31 POP 88 46.640 58.290 28.770 1.00 0.00 ATOM 10906 C31 POP 88 45.530 58.270 29.510 1.00 0.00 ATOM 10907 O32 POP 88 44.400 58.390 29.080 1.00 0.00 ATOM 10908 C32 POP 88 45.780 58.020 30.990 1.00 0.00 ATOM 10909 H2X POP 88 45.800 56.940 31.240 1.00 0.00 ATOM 10910 H2Y POP 88 44.940 58.430 31.600 1.00 0.00 ATOM 10911 C23 POP 88 47.360 54.690 29.320 1.00 0.00 ATOM 10912 H3R POP 88 46.550 54.340 28.640 1.00 0.00 ATOM 10913 H3S POP 88 46.980 55.590 29.840 1.00 0.00 ATOM 10914 C24 POP 88 47.710 53.500 30.210 1.00 0.00 ATOM 10915 H4R POP 88 48.390 53.850 31.010 1.00 0.00 ATOM 10916 H4S POP 88 48.260 52.740 29.610 1.00 0.00 ATOM 10917 C25 POP 88 46.510 52.660 30.660 1.00 0.00 ATOM 10918 H5R POP 88 45.780 52.560 29.830 1.00 0.00 ATOM 10919 H5S POP 88 46.010 53.230 31.470 1.00 0.00 ATOM 10920 C26 POP 88 46.870 51.290 31.220 1.00 0.00 ATOM 10921 H6R POP 88 47.390 51.430 32.200 1.00 0.00 ATOM 10922 H6S POP 88 47.790 50.910 30.710 1.00 0.00 ATOM 10923 C27 POP 88 45.670 50.350 31.300 1.00 0.00 ATOM 10924 H7R POP 88 45.980 49.310 31.550 1.00 0.00 ATOM 10925 H7S POP 88 45.480 50.180 30.220 1.00 0.00 ATOM 10926 C28 POP 88 44.440 50.820 32.080 1.00 0.00 ATOM 10927 H8R POP 88 44.180 51.880 31.850 1.00 0.00 ATOM 10928 H8S POP 88 44.610 50.790 33.180 1.00 0.00 ATOM 10929 C29 POP 88 43.180 50.110 31.690 1.00 0.00 ATOM 10930 H91 POP 88 43.320 49.500 30.790 1.00 0.00 ATOM 10931 0C21 POP 88 41.950 50.310 32.200 1.00 0.00 ATOM 10932 1H10 POP 88 41.110 49.660 31.910 1.00 0.00 ATOM 10933 1C21 POP 88 41.740 51.270 33.340 1.00 0.00 ATOM 10934 H11R POP 88 40.850 51.920 33.200 1.00 0.00 ATOM 10935 H11S POP 88 42.590 51.990 33.370 1.00 0.00 ATOM 10936 2C21 POP 88 41.700 50.450 34.630 1.00 0.00 ATOM 10937 H12R POP 88 42.660 49.930 34.840 1.00 0.00 ATOM 10938 H12S POP 88 40.900 49.680 34.530 1.00 0.00 ATOM 10939 3C21 POP 88 41.370 51.290 35.860 1.00 0.00 ATOM 10940 H13R POP 88 40.400 51.780 35.630 1.00 0.00 ATOM 10941 H13S POP 88 42.180 52.030 35.990 1.00 0.00 ATOM 10942 4C21 POP 88 41.220 50.480 37.160 1.00 0.00 ATOM 10943 H14R POP 88 42.250 50.160 37.430 1.00 0.00 ATOM 10944 H14S POP 88 40.520 49.620 37.070 1.00 0.00 ATOM 10945 5C21 POP 88 40.700 51.340 38.310 1.00 0.00 ATOM 10946 H15R POP 88 40.910 50.750 39.230 1.00 0.00 ATOM 10947 H15S POP 88 39.640 51.580 38.070 1.00 0.00 ATOM 10948 6C21 POP 88 41.260 52.760 38.430 1.00 0.00 ATOM 10949 H16R POP 88 41.080 53.360 37.520 1.00 0.00 ATOM 10950 H16S POP 88 42.360 52.550 38.420 1.00 0.00 ATOM 10951 7C21 POP 88 40.870 53.570 39.670 1.00 0.00 ATOM 10952 H17R POP 88 39.760 53.530 39.640 1.00 0.00 ATOM 10953 H17S POP 88 41.150 54.640 39.570 1.00 0.00 ATOM 10954 8C21 POP 88 41.580 52.980 40.890 1.00 0.00 ATOM 10955 H18R POP 88 41.090 52.000 41.070 1.00 0.00 ATOM 10956 H18S POP 88 41.390 53.760 41.660 1.00 0.00 ATOM 10957 H18T POP 88 42.650 52.820 40.650 1.00 0.00 ATOM 10958 C33 POP 88 47.070 58.690 31.470 1.00 0.00 ATOM 10959 H3X POP 88 46.750 59.720 31.750 1.00 0.00 ATOM 10960 H3Y POP 88 47.970 58.590 30.830 1.00 0.00 ATOM 10961 C34 POP 88 47.480 57.920 32.730 1.00 0.00 ATOM 10962 H4X POP 88 47.870 56.900 32.500 1.00 0.00 ATOM 10963 H4Y POP 88 46.560 57.710 33.310 1.00 0.00 ATOM 10964 C35 POP 88 48.610 58.500 33.580 1.00 0.00 ATOM 10965 H5X POP 88 48.400 59.580 33.710 1.00 0.00 ATOM 10966 H5Y POP 88 49.470 58.540 32.870 1.00 0.00 ATOM 10967 C36 POP 88 48.820 57.820 34.930 1.00 0.00 ATOM 10968 H6X POP 88 49.240 56.800 34.830 1.00 0.00 ATOM 10969 H6Y POP 88 47.890 57.810 35.550 1.00 0.00 ATOM 10970 C37 POP 88 49.870 58.580 35.740 1.00 0.00 ATOM 10971 H7X POP 88 49.480 59.600 35.890 1.00 0.00 ATOM 10972 H7Y POP 88 50.790 58.690 35.120 1.00 0.00 ATOM 10973 C38 POP 88 50.240 57.850 37.040 1.00 0.00 ATOM 10974 H8X POP 88 51.060 58.450 37.490 1.00 0.00 ATOM 10975 H8Y POP 88 50.680 56.910 36.650 1.00 0.00 ATOM 10976 C39 POP 88 49.100 57.680 38.050 1.00 0.00 ATOM 10977 H9X POP 88 48.230 57.100 37.670 1.00 0.00 ATOM 10978 H9Y POP 88 48.840 58.740 38.230 1.00 0.00 ATOM 10979 0C31 POP 88 49.570 56.990 39.330 1.00 0.00 ATOM 10980 H10X POP 88 50.130 56.100 38.960 1.00 0.00 ATOM 10981 H10Y POP 88 48.640 56.720 39.870 1.00 0.00 ATOM 10982 1C31 POP 88 50.310 58.040 40.160 1.00 0.00 ATOM 10983 H11X POP 88 49.910 59.060 40.000 1.00 0.00 ATOM 10984 H11Y POP 88 51.400 58.050 39.940 1.00 0.00 ATOM 10985 2C31 POP 88 50.110 57.860 41.660 1.00 0.00 ATOM 10986 H12X POP 88 49.030 57.660 41.810 1.00 0.00 ATOM 10987 H12Y POP 88 50.480 58.740 42.240 1.00 0.00 ATOM 10988 3C31 POP 88 50.800 56.650 42.300 1.00 0.00 ATOM 10989 H13X POP 88 51.190 56.930 43.300 1.00 0.00 ATOM 10990 H13Y POP 88 51.700 56.260 41.770 1.00 0.00 ATOM 10991 4C31 POP 88 49.800 55.530 42.550 1.00 0.00 ATOM 10992 H14X POP 88 49.230 55.330 41.610 1.00 0.00 ATOM 10993 H14Y POP 88 49.110 55.820 43.370 1.00 0.00 ATOM 10994 5C31 POP 88 50.560 54.230 42.810 1.00 0.00 ATOM 10995 H15X POP 88 51.170 53.980 41.920 1.00 0.00 ATOM 10996 H15Y POP 88 49.930 53.310 42.890 1.00 0.00 ATOM 10997 6C31 POP 88 51.520 54.270 44.000 1.00 0.00 ATOM 10998 H16X POP 88 52.240 53.420 43.930 1.00 0.00 ATOM 10999 H16Y POP 88 51.040 54.380 44.990 1.00 0.00 ATOM 11000 H16Z POP 88 52.100 55.190 43.800 1.00 0.00 ATOM 11001 N POP 89 46.970 31.900 24.240 1.00 0.00 ATOM 11002 HN1 POP 89 47.420 32.360 25.050 1.00 0.00 ATOM 11003 HN2 POP 89 46.080 32.350 23.940 1.00 0.00 ATOM 11004 HN3 POP 89 46.720 30.940 24.550 1.00 0.00 ATOM 11005 C12 POP 89 47.870 31.820 23.030 1.00 0.00 ATOM 11006 H12A POP 89 48.160 32.850 22.720 1.00 0.00 ATOM 11007 H12B POP 89 47.210 31.560 22.170 1.00 0.00 ATOM 11008 C11 POP 89 48.920 30.720 23.240 1.00 0.00 ATOM 11009 H11A POP 89 49.580 30.650 22.350 1.00 0.00 ATOM 11010 H11B POP 89 48.250 29.840 23.260 1.00 0.00 ATOM 11011 P POP 89 50.420 29.490 24.820 1.00 0.00 ATOM 11012 O13 POP 89 51.830 29.860 25.120 1.00 0.00 ATOM 11013 O14 POP 89 50.260 28.460 23.770 1.00 0.00 ATOM 11014 O11 POP 89 49.770 29.090 26.220 1.00 0.00 ATOM 11015 O12 POP 89 49.700 30.870 24.430 1.00 0.00 ATOM 11016 C1 POP 89 49.410 30.040 27.230 1.00 0.00 ATOM 11017 HA POP 89 49.030 29.400 28.060 1.00 0.00 ATOM 11018 HB POP 89 48.560 30.710 26.980 1.00 0.00 ATOM 11019 C2 POP 89 50.560 30.860 27.840 1.00 0.00 ATOM 11020 HS POP 89 50.910 31.540 27.030 1.00 0.00 ATOM 11021 O21 POP 89 51.590 29.950 28.240 1.00 0.00 ATOM 11022 C21 POP 89 52.740 30.580 28.510 1.00 0.00 ATOM 11023 O22 POP 89 53.060 31.690 28.100 1.00 0.00 ATOM 11024 C22 POP 89 53.750 29.700 29.230 1.00 0.00 ATOM 11025 H2R POP 89 54.700 30.290 29.240 1.00 0.00 ATOM 11026 H2S POP 89 53.870 28.790 28.610 1.00 0.00 ATOM 11027 C3 POP 89 50.060 31.740 28.990 1.00 0.00 ATOM 11028 HX POP 89 49.070 32.130 28.680 1.00 0.00 ATOM 11029 HY POP 89 50.840 32.530 28.970 1.00 0.00 ATOM 11030 O31 POP 89 50.020 31.120 30.280 1.00 0.00 ATOM 11031 C31 POP 89 49.620 32.020 31.190 1.00 0.00 ATOM 11032 O32 POP 89 49.160 33.120 30.940 1.00 0.00 ATOM 11033 C32 POP 89 49.590 31.390 32.580 1.00 0.00 ATOM 11034 H2X POP 89 50.550 31.400 33.130 1.00 0.00 ATOM 11035 H2Y POP 89 49.370 30.310 32.490 1.00 0.00 ATOM 11036 C23 POP 89 53.360 29.420 30.680 1.00 0.00 ATOM 11037 H3R POP 89 52.750 30.160 31.240 1.00 0.00 ATOM 11038 H3S POP 89 54.360 29.170 31.110 1.00 0.00 ATOM 11039 C24 POP 89 52.500 28.160 30.730 1.00 0.00 ATOM 11040 H4R POP 89 52.760 27.340 30.030 1.00 0.00 ATOM 11041 H4S POP 89 51.470 28.480 30.460 1.00 0.00 ATOM 11042 C25 POP 89 52.640 27.490 32.100 1.00 0.00 ATOM 11043 H5R POP 89 53.600 26.940 32.200 1.00 0.00 ATOM 11044 H5S POP 89 51.740 26.880 32.290 1.00 0.00 ATOM 11045 C26 POP 89 52.770 28.520 33.220 1.00 0.00 ATOM 11046 H6R POP 89 51.810 29.070 33.290 1.00 0.00 ATOM 11047 H6S POP 89 53.510 29.330 33.060 1.00 0.00 ATOM 11048 C27 POP 89 53.110 27.900 34.580 1.00 0.00 ATOM 11049 H7R POP 89 54.040 27.310 34.430 1.00 0.00 ATOM 11050 H7S POP 89 52.240 27.320 34.960 1.00 0.00 ATOM 11051 C28 POP 89 53.430 28.960 35.640 1.00 0.00 ATOM 11052 H8R POP 89 54.240 29.670 35.390 1.00 0.00 ATOM 11053 H8S POP 89 53.730 28.400 36.550 1.00 0.00 ATOM 11054 C29 POP 89 52.170 29.760 35.870 1.00 0.00 ATOM 11055 H91 POP 89 51.560 29.970 34.980 1.00 0.00 ATOM 11056 0C21 POP 89 51.630 30.210 37.000 1.00 0.00 ATOM 11057 1H10 POP 89 50.600 30.600 36.980 1.00 0.00 ATOM 11058 1C21 POP 89 52.180 30.070 38.390 1.00 0.00 ATOM 11059 H11R POP 89 53.200 30.490 38.500 1.00 0.00 ATOM 11060 H11S POP 89 52.240 28.990 38.650 1.00 0.00 ATOM 11061 2C21 POP 89 51.180 30.700 39.360 1.00 0.00 ATOM 11062 H12R POP 89 50.200 30.320 38.990 1.00 0.00 ATOM 11063 H12S POP 89 51.160 31.810 39.270 1.00 0.00 ATOM 11064 3C21 POP 89 51.230 30.240 40.820 1.00 0.00 ATOM 11065 H13R POP 89 51.360 29.140 40.860 1.00 0.00 ATOM 11066 H13S POP 89 50.310 30.470 41.400 1.00 0.00 ATOM 11067 4C21 POP 89 52.360 30.830 41.650 1.00 0.00 ATOM 11068 H14R POP 89 52.360 31.910 41.360 1.00 0.00 ATOM 11069 H14S POP 89 53.350 30.440 41.330 1.00 0.00 ATOM 11070 5C21 POP 89 52.090 30.760 43.160 1.00 0.00 ATOM 11071 H15R POP 89 52.270 29.710 43.450 1.00 0.00 ATOM 11072 H15S POP 89 51.060 31.070 43.460 1.00 0.00 ATOM 11073 6C21 POP 89 53.010 31.610 44.040 1.00 0.00 ATOM 11074 H16R POP 89 52.980 32.680 43.740 1.00 0.00 ATOM 11075 H16S POP 89 54.080 31.330 43.950 1.00 0.00 ATOM 11076 7C21 POP 89 52.600 31.500 45.510 1.00 0.00 ATOM 11077 H17R POP 89 51.560 31.820 45.740 1.00 0.00 ATOM 11078 H17S POP 89 53.320 32.220 45.950 1.00 0.00 ATOM 11079 8C21 POP 89 52.740 30.140 46.200 1.00 0.00 ATOM 11080 H18R POP 89 53.760 29.800 45.920 1.00 0.00 ATOM 11081 H18S POP 89 52.040 29.340 45.890 1.00 0.00 ATOM 11082 H18T POP 89 52.610 30.220 47.300 1.00 0.00 ATOM 11083 C33 POP 89 48.590 32.190 33.420 1.00 0.00 ATOM 11084 H3X POP 89 47.590 32.140 32.930 1.00 0.00 ATOM 11085 H3Y POP 89 49.090 33.180 33.450 1.00 0.00 ATOM 11086 C34 POP 89 48.350 31.510 34.770 1.00 0.00 ATOM 11087 H4X POP 89 49.290 31.240 35.290 1.00 0.00 ATOM 11088 H4Y POP 89 47.810 30.590 34.450 1.00 0.00 ATOM 11089 C35 POP 89 47.580 32.270 35.840 1.00 0.00 ATOM 11090 H5X POP 89 46.600 32.670 35.490 1.00 0.00 ATOM 11091 H5Y POP 89 48.130 33.140 36.250 1.00 0.00 ATOM 11092 C36 POP 89 47.290 31.280 36.980 1.00 0.00 ATOM 11093 H6X POP 89 48.270 30.960 37.400 1.00 0.00 ATOM 11094 H6Y POP 89 46.810 30.400 36.510 1.00 0.00 ATOM 11095 C37 POP 89 46.560 32.020 38.100 1.00 0.00 ATOM 11096 H7X POP 89 45.830 32.720 37.650 1.00 0.00 ATOM 11097 H7Y POP 89 47.270 32.700 38.620 1.00 0.00 ATOM 11098 C38 POP 89 45.850 31.090 39.100 1.00 0.00 ATOM 11099 H8X POP 89 45.220 30.380 38.520 1.00 0.00 ATOM 11100 H8Y POP 89 45.100 31.650 39.690 1.00 0.00 ATOM 11101 C39 POP 89 46.830 30.520 40.120 1.00 0.00 ATOM 11102 H9X POP 89 47.620 31.270 40.380 1.00 0.00 ATOM 11103 H9Y POP 89 47.440 29.740 39.620 1.00 0.00 ATOM 11104 0C31 POP 89 46.270 29.950 41.420 1.00 0.00 ATOM 11105 H10X POP 89 45.590 29.090 41.220 1.00 0.00 ATOM 11106 H10Y POP 89 45.680 30.690 41.990 1.00 0.00 ATOM 11107 1C31 POP 89 47.400 29.320 42.250 1.00 0.00 ATOM 11108 H11X POP 89 48.190 30.070 42.450 1.00 0.00 ATOM 11109 H11Y POP 89 47.880 28.540 41.620 1.00 0.00 ATOM 11110 2C31 POP 89 46.940 28.910 43.640 1.00 0.00 ATOM 11111 H12X POP 89 46.140 28.140 43.680 1.00 0.00 ATOM 11112 H12Y POP 89 46.550 29.770 44.230 1.00 0.00 ATOM 11113 3C31 POP 89 48.150 28.320 44.370 1.00 0.00 ATOM 11114 H13X POP 89 49.080 28.910 44.230 1.00 0.00 ATOM 11115 H13Y POP 89 48.330 27.320 43.920 1.00 0.00 ATOM 11116 4C31 POP 89 47.760 28.050 45.830 1.00 0.00 ATOM 11117 H14X POP 89 46.880 27.380 45.760 1.00 0.00 ATOM 11118 H14Y POP 89 47.480 29.010 46.300 1.00 0.00 ATOM 11119 5C31 POP 89 48.760 27.230 46.650 1.00 0.00 ATOM 11120 H15X POP 89 48.700 26.170 46.310 1.00 0.00 ATOM 11121 H15Y POP 89 48.490 27.290 47.720 1.00 0.00 ATOM 11122 6C31 POP 89 50.190 27.710 46.420 1.00 0.00 ATOM 11123 H16X POP 89 50.560 27.430 45.410 1.00 0.00 ATOM 11124 H16Y POP 89 50.970 27.290 47.080 1.00 0.00 ATOM 11125 H16Z POP 89 50.310 28.820 46.390 1.00 0.00 ATOM 11126 N POP 90 9.120 32.950 19.920 1.00 0.00 ATOM 11127 HN1 POP 90 9.970 32.890 19.320 1.00 0.00 ATOM 11128 HN2 POP 90 8.490 33.740 19.650 1.00 0.00 ATOM 11129 HN3 POP 90 9.440 32.980 20.910 1.00 0.00 ATOM 11130 C12 POP 90 8.270 31.740 19.630 1.00 0.00 ATOM 11131 H12A POP 90 8.890 30.910 20.040 1.00 0.00 ATOM 11132 H12B POP 90 8.100 31.660 18.530 1.00 0.00 ATOM 11133 C11 POP 90 6.890 31.740 20.300 1.00 0.00 ATOM 11134 H11A POP 90 6.290 30.870 19.960 1.00 0.00 ATOM 11135 H11B POP 90 6.260 32.580 19.960 1.00 0.00 ATOM 11136 P POP 90 6.030 30.770 22.510 1.00 0.00 ATOM 11137 O13 POP 90 6.780 29.490 22.540 1.00 0.00 ATOM 11138 O14 POP 90 4.700 30.630 21.890 1.00 0.00 ATOM 11139 O11 POP 90 5.890 31.370 23.990 1.00 0.00 ATOM 11140 O12 POP 90 7.000 31.780 21.730 1.00 0.00 ATOM 11141 C1 POP 90 5.650 32.780 24.030 1.00 0.00 ATOM 11142 HA POP 90 4.760 32.930 23.380 1.00 0.00 ATOM 11143 HB POP 90 6.460 33.360 23.550 1.00 0.00 ATOM 11144 C2 POP 90 5.410 33.250 25.480 1.00 0.00 ATOM 11145 HS POP 90 5.180 34.340 25.520 1.00 0.00 ATOM 11146 O21 POP 90 6.570 32.980 26.260 1.00 0.00 ATOM 11147 C21 POP 90 6.810 33.700 27.360 1.00 0.00 ATOM 11148 O22 POP 90 6.290 34.760 27.700 1.00 0.00 ATOM 11149 C22 POP 90 7.760 32.980 28.310 1.00 0.00 ATOM 11150 H2R POP 90 8.780 33.420 28.250 1.00 0.00 ATOM 11151 H2S POP 90 7.860 31.940 27.950 1.00 0.00 ATOM 11152 C3 POP 90 4.120 32.610 26.010 1.00 0.00 ATOM 11153 HX POP 90 4.350 31.530 26.060 1.00 0.00 ATOM 11154 HY POP 90 3.350 32.690 25.200 1.00 0.00 ATOM 11155 O31 POP 90 3.660 33.060 27.290 1.00 0.00 ATOM 11156 C31 POP 90 2.910 34.170 27.280 1.00 0.00 ATOM 11157 O32 POP 90 2.710 34.790 26.250 1.00 0.00 ATOM 11158 C32 POP 90 2.460 34.480 28.700 1.00 0.00 ATOM 11159 H2X POP 90 2.150 33.490 29.100 1.00 0.00 ATOM 11160 H2Y POP 90 1.620 35.200 28.590 1.00 0.00 ATOM 11161 C23 POP 90 7.310 33.230 29.750 1.00 0.00 ATOM 11162 H3R POP 90 6.250 32.900 29.870 1.00 0.00 ATOM 11163 H3S POP 90 7.250 34.330 29.860 1.00 0.00 ATOM 11164 C24 POP 90 8.210 32.600 30.810 1.00 0.00 ATOM 11165 H4R POP 90 9.070 33.220 31.150 1.00 0.00 ATOM 11166 H4S POP 90 8.750 31.740 30.380 1.00 0.00 ATOM 11167 C25 POP 90 7.360 32.130 32.000 1.00 0.00 ATOM 11168 H5R POP 90 6.460 31.530 31.740 1.00 0.00 ATOM 11169 H5S POP 90 7.020 33.080 32.450 1.00 0.00 ATOM 11170 C26 POP 90 8.090 31.320 33.070 1.00 0.00 ATOM 11171 H6R POP 90 8.980 31.950 33.310 1.00 0.00 ATOM 11172 H6S POP 90 8.560 30.390 32.690 1.00 0.00 ATOM 11173 C27 POP 90 7.160 30.870 34.190 1.00 0.00 ATOM 11174 H7R POP 90 6.420 30.150 33.790 1.00 0.00 ATOM 11175 H7S POP 90 6.550 31.730 34.540 1.00 0.00 ATOM 11176 C28 POP 90 7.880 30.360 35.450 1.00 0.00 ATOM 11177 H8R POP 90 8.250 31.260 35.970 1.00 0.00 ATOM 11178 H8S POP 90 8.670 29.620 35.180 1.00 0.00 ATOM 11179 C29 POP 90 6.940 29.690 36.410 1.00 0.00 ATOM 11180 H91 POP 90 6.090 29.190 35.930 1.00 0.00 ATOM 11181 0C21 POP 90 7.070 29.540 37.740 1.00 0.00 ATOM 11182 1H10 POP 90 6.240 29.110 38.310 1.00 0.00 ATOM 11183 1C21 POP 90 8.280 29.990 38.510 1.00 0.00 ATOM 11184 H11R POP 90 9.110 30.190 37.800 1.00 0.00 ATOM 11185 H11S POP 90 8.740 29.320 39.260 1.00 0.00 ATOM 11186 2C21 POP 90 8.150 31.420 39.030 1.00 0.00 ATOM 11187 H12R POP 90 7.760 32.080 38.220 1.00 0.00 ATOM 11188 H12S POP 90 9.150 31.900 39.090 1.00 0.00 ATOM 11189 3C21 POP 90 7.510 31.490 40.420 1.00 0.00 ATOM 11190 H13R POP 90 6.570 30.900 40.430 1.00 0.00 ATOM 11191 H13S POP 90 7.190 32.550 40.550 1.00 0.00 ATOM 11192 4C21 POP 90 8.310 30.930 41.600 1.00 0.00 ATOM 11193 H14R POP 90 9.250 31.510 41.700 1.00 0.00 ATOM 11194 H14S POP 90 8.570 29.890 41.300 1.00 0.00 ATOM 11195 5C21 POP 90 7.520 30.980 42.910 1.00 0.00 ATOM 11196 H15R POP 90 7.200 31.980 43.270 1.00 0.00 ATOM 11197 H15S POP 90 8.210 30.630 43.710 1.00 0.00 ATOM 11198 6C21 POP 90 6.340 30.020 42.920 1.00 0.00 ATOM 11199 H16R POP 90 5.510 30.380 42.270 1.00 0.00 ATOM 11200 H16S POP 90 5.810 29.940 43.890 1.00 0.00 ATOM 11201 7C21 POP 90 6.600 28.560 42.540 1.00 0.00 ATOM 11202 H17R POP 90 7.180 28.130 43.390 1.00 0.00 ATOM 11203 H17S POP 90 7.160 28.380 41.600 1.00 0.00 ATOM 11204 8C21 POP 90 5.350 27.680 42.520 1.00 0.00 ATOM 11205 H18R POP 90 5.580 26.590 42.480 1.00 0.00 ATOM 11206 H18S POP 90 4.830 28.000 41.590 1.00 0.00 ATOM 11207 H18T POP 90 4.570 27.790 43.300 1.00 0.00 ATOM 11208 C33 POP 90 3.680 35.070 29.400 1.00 0.00 ATOM 11209 H3X POP 90 3.770 36.070 28.930 1.00 0.00 ATOM 11210 H3Y POP 90 4.530 34.400 29.160 1.00 0.00 ATOM 11211 C34 POP 90 3.420 35.160 30.910 1.00 0.00 ATOM 11212 H4X POP 90 3.020 34.220 31.340 1.00 0.00 ATOM 11213 H4Y POP 90 2.760 36.040 31.000 1.00 0.00 ATOM 11214 C35 POP 90 4.700 35.380 31.730 1.00 0.00 ATOM 11215 H5X POP 90 5.390 36.230 31.570 1.00 0.00 ATOM 11216 H5Y POP 90 5.440 34.560 31.640 1.00 0.00 ATOM 11217 C36 POP 90 4.410 35.590 33.220 1.00 0.00 ATOM 11218 H6X POP 90 5.260 36.190 33.610 1.00 0.00 ATOM 11219 H6Y POP 90 4.440 34.590 33.710 1.00 0.00 ATOM 11220 C37 POP 90 3.060 36.200 33.570 1.00 0.00 ATOM 11221 H7X POP 90 2.140 35.670 33.260 1.00 0.00 ATOM 11222 H7Y POP 90 3.080 37.170 33.030 1.00 0.00 ATOM 11223 C38 POP 90 3.020 36.460 35.080 1.00 0.00 ATOM 11224 H8X POP 90 3.950 36.870 35.520 1.00 0.00 ATOM 11225 H8Y POP 90 2.840 35.470 35.540 1.00 0.00 ATOM 11226 C39 POP 90 1.800 37.310 35.460 1.00 0.00 ATOM 11227 H9X POP 90 0.860 36.880 35.070 1.00 0.00 ATOM 11228 H9Y POP 90 2.010 38.270 34.950 1.00 0.00 ATOM 11229 0C31 POP 90 1.620 37.370 36.980 1.00 0.00 ATOM 11230 H10X POP 90 0.940 38.240 37.090 1.00 0.00 ATOM 11231 H10Y POP 90 2.560 37.640 37.520 1.00 0.00 ATOM 11232 1C31 POP 90 1.130 36.140 37.750 1.00 0.00 ATOM 11233 H11X POP 90 1.880 35.320 37.680 1.00 0.00 ATOM 11234 H11Y POP 90 0.150 35.830 37.320 1.00 0.00 ATOM 11235 2C31 POP 90 0.900 36.410 39.240 1.00 0.00 ATOM 11236 H12X POP 90 0.330 37.320 39.520 1.00 0.00 ATOM 11237 H12Y POP 90 1.920 36.540 39.650 1.00 0.00 ATOM 11238 3C31 POP 90 0.170 35.270 39.950 1.00 0.00 ATOM 11239 H13X POP 90 0.360 34.380 39.310 1.00 0.00 ATOM 11240 H13Y POP 90 -0.900 35.540 40.060 1.00 0.00 ATOM 11241 4C31 POP 90 0.720 35.100 41.370 1.00 0.00 ATOM 11242 H14X POP 90 1.750 35.520 41.380 1.00 0.00 ATOM 11243 H14Y POP 90 0.780 34.050 41.710 1.00 0.00 ATOM 11244 5C31 POP 90 -0.140 35.810 42.420 1.00 0.00 ATOM 11245 H15X POP 90 -1.190 35.460 42.340 1.00 0.00 ATOM 11246 H15Y POP 90 -0.040 36.850 42.060 1.00 0.00 ATOM 11247 6C31 POP 90 0.140 35.500 43.890 1.00 0.00 ATOM 11248 H16X POP 90 0.330 34.420 44.080 1.00 0.00 ATOM 11249 H16Y POP 90 1.080 35.970 44.260 1.00 0.00 ATOM 11250 H16Z POP 90 -0.680 35.780 44.590 1.00 0.00 ATOM 11251 N POP 91 49.530 51.980 22.370 1.00 0.00 ATOM 11252 HN1 POP 91 48.620 52.010 21.870 1.00 0.00 ATOM 11253 HN2 POP 91 49.350 52.000 23.390 1.00 0.00 ATOM 11254 HN3 POP 91 50.100 52.820 22.120 1.00 0.00 ATOM 11255 C12 POP 91 50.280 50.710 22.040 1.00 0.00 ATOM 11256 H12A POP 91 51.340 50.960 22.230 1.00 0.00 ATOM 11257 H12B POP 91 50.150 50.510 20.960 1.00 0.00 ATOM 11258 C11 POP 91 49.740 49.510 22.820 1.00 0.00 ATOM 11259 H11A POP 91 50.230 48.540 22.570 1.00 0.00 ATOM 11260 H11B POP 91 48.660 49.330 22.600 1.00 0.00 ATOM 11261 P POP 91 49.420 49.030 25.370 1.00 0.00 ATOM 11262 O13 POP 91 50.380 48.040 25.910 1.00 0.00 ATOM 11263 O14 POP 91 48.120 48.470 24.940 1.00 0.00 ATOM 11264 O11 POP 91 49.110 50.130 26.480 1.00 0.00 ATOM 11265 O12 POP 91 50.000 49.910 24.160 1.00 0.00 ATOM 11266 C1 POP 91 50.030 50.340 27.560 1.00 0.00 ATOM 11267 HA POP 91 49.880 51.300 28.090 1.00 0.00 ATOM 11268 HB POP 91 51.050 50.390 27.120 1.00 0.00 ATOM 11269 C2 POP 91 49.990 49.290 28.680 1.00 0.00 ATOM 11270 HS POP 91 50.650 48.470 28.320 1.00 0.00 ATOM 11271 O21 POP 91 48.610 48.980 28.910 1.00 0.00 ATOM 11272 C21 POP 91 48.480 47.680 29.190 1.00 0.00 ATOM 11273 O22 POP 91 49.380 46.850 29.220 1.00 0.00 ATOM 11274 C22 POP 91 47.020 47.300 29.330 1.00 0.00 ATOM 11275 H2R POP 91 46.730 47.030 28.290 1.00 0.00 ATOM 11276 H2S POP 91 46.460 48.250 29.450 1.00 0.00 ATOM 11277 C3 POP 91 50.540 49.810 30.020 1.00 0.00 ATOM 11278 HX POP 91 49.820 50.560 30.400 1.00 0.00 ATOM 11279 HY POP 91 51.530 50.300 29.850 1.00 0.00 ATOM 11280 O31 POP 91 50.710 48.710 30.930 1.00 0.00 ATOM 11281 C31 POP 91 51.560 48.940 31.930 1.00 0.00 ATOM 11282 O32 POP 91 51.980 50.060 32.200 1.00 0.00 ATOM 11283 C32 POP 91 51.570 47.750 32.870 1.00 0.00 ATOM 11284 H2X POP 91 52.140 46.940 32.360 1.00 0.00 ATOM 11285 H2Y POP 91 50.600 47.320 33.190 1.00 0.00 ATOM 11286 C23 POP 91 46.780 46.070 30.210 1.00 0.00 ATOM 11287 H3R POP 91 47.680 45.450 30.030 1.00 0.00 ATOM 11288 H3S POP 91 45.980 45.550 29.630 1.00 0.00 ATOM 11289 C24 POP 91 46.380 46.260 31.670 1.00 0.00 ATOM 11290 H4R POP 91 46.110 45.300 32.150 1.00 0.00 ATOM 11291 H4S POP 91 45.490 46.920 31.790 1.00 0.00 ATOM 11292 C25 POP 91 47.480 46.970 32.470 1.00 0.00 ATOM 11293 H5R POP 91 47.570 48.000 32.070 1.00 0.00 ATOM 11294 H5S POP 91 48.510 46.590 32.310 1.00 0.00 ATOM 11295 C26 POP 91 47.250 47.000 33.990 1.00 0.00 ATOM 11296 H6R POP 91 48.130 47.380 34.540 1.00 0.00 ATOM 11297 H6S POP 91 47.180 45.900 34.150 1.00 0.00 ATOM 11298 C27 POP 91 45.970 47.620 34.550 1.00 0.00 ATOM 11299 H7R POP 91 44.970 47.190 34.300 1.00 0.00 ATOM 11300 H7S POP 91 45.970 48.630 34.090 1.00 0.00 ATOM 11301 C28 POP 91 46.200 47.880 36.040 1.00 0.00 ATOM 11302 H8R POP 91 47.280 48.050 36.250 1.00 0.00 ATOM 11303 H8S POP 91 45.920 47.000 36.660 1.00 0.00 ATOM 11304 C29 POP 91 45.250 48.960 36.470 1.00 0.00 ATOM 11305 H91 POP 91 44.200 48.640 36.590 1.00 0.00 ATOM 11306 0C21 POP 91 45.530 50.270 36.480 1.00 0.00 ATOM 11307 1H10 POP 91 44.870 51.060 36.850 1.00 0.00 ATOM 11308 1C21 POP 91 46.930 50.750 36.230 1.00 0.00 ATOM 11309 H11R POP 91 46.850 51.640 35.570 1.00 0.00 ATOM 11310 H11S POP 91 47.580 50.100 35.620 1.00 0.00 ATOM 11311 2C21 POP 91 47.760 51.140 37.450 1.00 0.00 ATOM 11312 H12R POP 91 48.670 51.450 36.890 1.00 0.00 ATOM 11313 H12S POP 91 48.030 50.360 38.210 1.00 0.00 ATOM 11314 3C21 POP 91 47.410 52.370 38.290 1.00 0.00 ATOM 11315 H13R POP 91 46.510 52.780 37.790 1.00 0.00 ATOM 11316 H13S POP 91 48.220 53.120 38.220 1.00 0.00 ATOM 11317 4C21 POP 91 47.310 52.100 39.800 1.00 0.00 ATOM 11318 H14R POP 91 47.090 53.060 40.310 1.00 0.00 ATOM 11319 H14S POP 91 48.260 51.840 40.310 1.00 0.00 ATOM 11320 5C21 POP 91 46.440 50.950 40.300 1.00 0.00 ATOM 11321 H15R POP 91 46.750 50.010 39.790 1.00 0.00 ATOM 11322 H15S POP 91 45.430 51.260 39.950 1.00 0.00 ATOM 11323 6C21 POP 91 46.420 50.780 41.820 1.00 0.00 ATOM 11324 H16R POP 91 46.140 51.760 42.250 1.00 0.00 ATOM 11325 H16S POP 91 47.450 50.560 42.180 1.00 0.00 ATOM 11326 7C21 POP 91 45.340 49.820 42.310 1.00 0.00 ATOM 11327 H17R POP 91 44.320 50.140 42.000 1.00 0.00 ATOM 11328 H17S POP 91 45.330 49.900 43.420 1.00 0.00 ATOM 11329 8C21 POP 91 45.630 48.390 41.860 1.00 0.00 ATOM 11330 H18R POP 91 44.920 47.630 42.250 1.00 0.00 ATOM 11331 H18S POP 91 46.660 48.190 42.190 1.00 0.00 ATOM 11332 H18T POP 91 45.570 48.310 40.750 1.00 0.00 ATOM 11333 C33 POP 91 52.550 48.110 33.990 1.00 0.00 ATOM 11334 H3X POP 91 53.470 48.550 33.560 1.00 0.00 ATOM 11335 H3Y POP 91 52.770 47.260 34.670 1.00 0.00 ATOM 11336 C34 POP 91 51.880 49.010 35.040 1.00 0.00 ATOM 11337 H4X POP 91 50.780 49.130 34.860 1.00 0.00 ATOM 11338 H4Y POP 91 52.390 50.000 35.000 1.00 0.00 ATOM 11339 C35 POP 91 51.970 48.560 36.490 1.00 0.00 ATOM 11340 H5X POP 91 53.070 48.590 36.650 1.00 0.00 ATOM 11341 H5Y POP 91 51.600 47.520 36.530 1.00 0.00 ATOM 11342 C36 POP 91 51.210 49.360 37.550 1.00 0.00 ATOM 11343 H6X POP 91 50.120 49.440 37.360 1.00 0.00 ATOM 11344 H6Y POP 91 51.720 50.340 37.460 1.00 0.00 ATOM 11345 C37 POP 91 51.460 48.710 38.910 1.00 0.00 ATOM 11346 H7X POP 91 52.560 48.680 39.080 1.00 0.00 ATOM 11347 H7Y POP 91 50.950 47.720 38.840 1.00 0.00 ATOM 11348 C38 POP 91 50.650 49.410 40.010 1.00 0.00 ATOM 11349 H8X POP 91 49.580 49.330 39.740 1.00 0.00 ATOM 11350 H8Y POP 91 50.970 50.480 40.000 1.00 0.00 ATOM 11351 C39 POP 91 50.890 48.830 41.410 1.00 0.00 ATOM 11352 H9X POP 91 51.890 49.190 41.710 1.00 0.00 ATOM 11353 H9Y POP 91 50.970 47.730 41.300 1.00 0.00 ATOM 11354 0C31 POP 91 49.780 49.110 42.420 1.00 0.00 ATOM 11355 H10X POP 91 48.930 48.450 42.170 1.00 0.00 ATOM 11356 H10Y POP 91 49.540 50.190 42.310 1.00 0.00 ATOM 11357 1C31 POP 91 50.350 48.780 43.810 1.00 0.00 ATOM 11358 H11X POP 91 49.470 48.880 44.470 1.00 0.00 ATOM 11359 H11Y POP 91 51.120 49.540 44.060 1.00 0.00 ATOM 11360 2C31 POP 91 50.970 47.380 43.900 1.00 0.00 ATOM 11361 H12X POP 91 51.790 47.200 43.170 1.00 0.00 ATOM 11362 H12Y POP 91 50.110 46.730 43.680 1.00 0.00 ATOM 11363 3C31 POP 91 51.410 47.190 45.360 1.00 0.00 ATOM 11364 H13X POP 91 50.700 47.710 46.040 1.00 0.00 ATOM 11365 H13Y POP 91 52.370 47.740 45.500 1.00 0.00 ATOM 11366 4C31 POP 91 51.680 45.860 46.050 1.00 0.00 ATOM 11367 H14X POP 91 50.810 45.170 46.150 1.00 0.00 ATOM 11368 H14Y POP 91 52.020 46.130 47.080 1.00 0.00 ATOM 11369 5C31 POP 91 52.750 44.970 45.400 1.00 0.00 ATOM 11370 H15X POP 91 52.610 44.960 44.300 1.00 0.00 ATOM 11371 H15Y POP 91 52.550 43.920 45.680 1.00 0.00 ATOM 11372 6C31 POP 91 54.190 45.370 45.720 1.00 0.00 ATOM 11373 H16X POP 91 54.790 44.550 45.260 1.00 0.00 ATOM 11374 H16Y POP 91 54.440 45.620 46.770 1.00 0.00 ATOM 11375 H16Z POP 91 54.450 46.310 45.180 1.00 0.00 ATOM 11376 N POP 92 18.820 46.360 23.780 1.00 0.00 ATOM 11377 HN1 POP 92 17.930 46.480 23.250 1.00 0.00 ATOM 11378 HN2 POP 92 19.260 47.260 24.040 1.00 0.00 ATOM 11379 HN3 POP 92 19.490 45.780 23.220 1.00 0.00 ATOM 11380 C12 POP 92 18.360 45.550 24.960 1.00 0.00 ATOM 11381 H12A POP 92 17.780 46.190 25.660 1.00 0.00 ATOM 11382 H12B POP 92 19.190 45.130 25.580 1.00 0.00 ATOM 11383 C11 POP 92 17.340 44.450 24.660 1.00 0.00 ATOM 11384 H11A POP 92 16.360 44.930 24.420 1.00 0.00 ATOM 11385 H11B POP 92 17.120 43.900 25.600 1.00 0.00 ATOM 11386 P POP 92 17.140 42.230 23.580 1.00 0.00 ATOM 11387 O13 POP 92 17.640 41.420 22.450 1.00 0.00 ATOM 11388 O14 POP 92 15.660 42.300 23.580 1.00 0.00 ATOM 11389 O11 POP 92 17.560 41.650 25.010 1.00 0.00 ATOM 11390 O12 POP 92 17.820 43.670 23.560 1.00 0.00 ATOM 11391 C1 POP 92 17.680 40.250 25.280 1.00 0.00 ATOM 11392 HA POP 92 18.250 40.130 26.220 1.00 0.00 ATOM 11393 HB POP 92 18.470 39.900 24.570 1.00 0.00 ATOM 11394 C2 POP 92 16.430 39.410 25.540 1.00 0.00 ATOM 11395 HS POP 92 15.990 39.310 24.530 1.00 0.00 ATOM 11396 O21 POP 92 15.630 40.270 26.370 1.00 0.00 ATOM 11397 C21 POP 92 14.310 40.060 26.290 1.00 0.00 ATOM 11398 O22 POP 92 13.810 39.280 25.500 1.00 0.00 ATOM 11399 C22 POP 92 13.540 40.940 27.260 1.00 0.00 ATOM 11400 H2R POP 92 13.280 41.900 26.770 1.00 0.00 ATOM 11401 H2S POP 92 14.190 41.180 28.130 1.00 0.00 ATOM 11402 C3 POP 92 16.620 38.050 26.220 1.00 0.00 ATOM 11403 HX POP 92 17.210 37.330 25.620 1.00 0.00 ATOM 11404 HY POP 92 15.570 37.750 26.420 1.00 0.00 ATOM 11405 O31 POP 92 17.340 38.360 27.420 1.00 0.00 ATOM 11406 C31 POP 92 16.590 38.460 28.530 1.00 0.00 ATOM 11407 O32 POP 92 15.430 38.100 28.590 1.00 0.00 ATOM 11408 C32 POP 92 17.490 38.990 29.640 1.00 0.00 ATOM 11409 H2X POP 92 18.020 39.860 29.200 1.00 0.00 ATOM 11410 H2Y POP 92 18.220 38.200 29.910 1.00 0.00 ATOM 11411 C23 POP 92 12.230 40.260 27.650 1.00 0.00 ATOM 11412 H3R POP 92 12.370 39.160 27.750 1.00 0.00 ATOM 11413 H3S POP 92 11.510 40.510 26.850 1.00 0.00 ATOM 11414 C24 POP 92 11.590 40.770 28.940 1.00 0.00 ATOM 11415 H4R POP 92 10.600 40.280 29.100 1.00 0.00 ATOM 11416 H4S POP 92 11.460 41.870 28.910 1.00 0.00 ATOM 11417 C25 POP 92 12.470 40.570 30.180 1.00 0.00 ATOM 11418 H5R POP 92 13.430 41.130 30.110 1.00 0.00 ATOM 11419 H5S POP 92 12.710 39.500 30.370 1.00 0.00 ATOM 11420 C26 POP 92 11.910 41.010 31.530 1.00 0.00 ATOM 11421 H6R POP 92 10.830 40.760 31.450 1.00 0.00 ATOM 11422 H6S POP 92 12.020 42.110 31.670 1.00 0.00 ATOM 11423 C27 POP 92 12.520 40.300 32.740 1.00 0.00 ATOM 11424 H7R POP 92 13.610 40.390 32.580 1.00 0.00 ATOM 11425 H7S POP 92 12.310 39.210 32.850 1.00 0.00 ATOM 11426 C28 POP 92 12.210 40.980 34.080 1.00 0.00 ATOM 11427 H8R POP 92 11.140 40.700 34.260 1.00 0.00 ATOM 11428 H8S POP 92 12.220 42.070 33.890 1.00 0.00 ATOM 11429 C29 POP 92 13.200 40.620 35.150 1.00 0.00 ATOM 11430 H91 POP 92 14.110 40.090 34.830 1.00 0.00 ATOM 11431 0C21 POP 92 13.050 40.830 36.460 1.00 0.00 ATOM 11432 1H10 POP 92 13.790 40.510 37.210 1.00 0.00 ATOM 11433 1C21 POP 92 11.850 41.500 37.050 1.00 0.00 ATOM 11434 H11R POP 92 11.120 40.860 37.600 1.00 0.00 ATOM 11435 H11S POP 92 11.300 42.000 36.230 1.00 0.00 ATOM 11436 2C21 POP 92 12.130 42.570 38.100 1.00 0.00 ATOM 11437 H12R POP 92 12.890 43.300 37.750 1.00 0.00 ATOM 11438 H12S POP 92 12.490 42.120 39.050 1.00 0.00 ATOM 11439 3C21 POP 92 10.900 43.480 38.250 1.00 0.00 ATOM 11440 H13R POP 92 10.020 42.940 38.670 1.00 0.00 ATOM 11441 H13S POP 92 10.570 43.900 37.280 1.00 0.00 ATOM 11442 4C21 POP 92 11.200 44.570 39.280 1.00 0.00 ATOM 11443 H14R POP 92 10.480 45.400 39.440 1.00 0.00 ATOM 11444 H14S POP 92 12.240 44.890 39.030 1.00 0.00 ATOM 11445 5C21 POP 92 11.170 43.980 40.690 1.00 0.00 ATOM 11446 H15R POP 92 10.140 43.660 40.950 1.00 0.00 ATOM 11447 H15S POP 92 11.760 43.040 40.770 1.00 0.00 ATOM 11448 6C21 POP 92 11.670 44.980 41.740 1.00 0.00 ATOM 11449 H16R POP 92 11.100 45.930 41.670 1.00 0.00 ATOM 11450 H16S POP 92 12.670 45.250 41.320 1.00 0.00 ATOM 11451 7C21 POP 92 11.810 44.500 43.190 1.00 0.00 ATOM 11452 H17R POP 92 12.390 43.560 43.280 1.00 0.00 ATOM 11453 H17S POP 92 10.790 44.210 43.530 1.00 0.00 ATOM 11454 8C21 POP 92 12.460 45.520 44.110 1.00 0.00 ATOM 11455 H18R POP 92 12.050 46.540 43.940 1.00 0.00 ATOM 11456 H18S POP 92 13.560 45.520 43.920 1.00 0.00 ATOM 11457 H18T POP 92 12.410 45.270 45.190 1.00 0.00 ATOM 11458 C33 POP 92 16.680 39.420 30.860 1.00 0.00 ATOM 11459 H3X POP 92 16.480 38.540 31.500 1.00 0.00 ATOM 11460 H3Y POP 92 15.760 39.860 30.410 1.00 0.00 ATOM 11461 C34 POP 92 17.450 40.390 31.760 1.00 0.00 ATOM 11462 H4X POP 92 16.770 40.980 32.410 1.00 0.00 ATOM 11463 H4Y POP 92 17.920 41.140 31.080 1.00 0.00 ATOM 11464 C35 POP 92 18.490 39.690 32.630 1.00 0.00 ATOM 11465 H5X POP 92 19.070 39.000 31.980 1.00 0.00 ATOM 11466 H5Y POP 92 18.100 38.930 33.340 1.00 0.00 ATOM 11467 C36 POP 92 19.470 40.700 33.230 1.00 0.00 ATOM 11468 H6X POP 92 18.900 41.530 33.700 1.00 0.00 ATOM 11469 H6Y POP 92 20.140 41.120 32.460 1.00 0.00 ATOM 11470 C37 POP 92 20.370 39.910 34.170 1.00 0.00 ATOM 11471 H7X POP 92 21.040 39.260 33.560 1.00 0.00 ATOM 11472 H7Y POP 92 19.650 39.250 34.710 1.00 0.00 ATOM 11473 C38 POP 92 21.100 40.770 35.200 1.00 0.00 ATOM 11474 H8X POP 92 20.360 41.430 35.700 1.00 0.00 ATOM 11475 H8Y POP 92 21.810 41.350 34.580 1.00 0.00 ATOM 11476 C39 POP 92 21.660 39.940 36.360 1.00 0.00 ATOM 11477 H9X POP 92 22.190 39.000 36.130 1.00 0.00 ATOM 11478 H9Y POP 92 20.800 39.600 36.980 1.00 0.00 ATOM 11479 0C31 POP 92 22.700 40.850 37.020 1.00 0.00 ATOM 11480 H10X POP 92 22.530 41.910 36.730 1.00 0.00 ATOM 11481 H10Y POP 92 23.600 40.440 36.510 1.00 0.00 ATOM 11482 1C31 POP 92 22.680 40.660 38.540 1.00 0.00 ATOM 11483 H11X POP 92 23.130 39.660 38.670 1.00 0.00 ATOM 11484 H11Y POP 92 21.690 40.560 39.040 1.00 0.00 ATOM 11485 2C31 POP 92 23.500 41.650 39.370 1.00 0.00 ATOM 11486 H12X POP 92 23.180 42.680 39.150 1.00 0.00 ATOM 11487 H12Y POP 92 24.580 41.610 39.100 1.00 0.00 ATOM 11488 3C31 POP 92 23.350 41.320 40.860 1.00 0.00 ATOM 11489 H13X POP 92 24.040 40.450 40.890 1.00 0.00 ATOM 11490 H13Y POP 92 22.310 40.990 41.090 1.00 0.00 ATOM 11491 4C31 POP 92 23.850 42.440 41.770 1.00 0.00 ATOM 11492 H14X POP 92 24.850 42.780 41.400 1.00 0.00 ATOM 11493 H14Y POP 92 23.900 42.150 42.840 1.00 0.00 ATOM 11494 5C31 POP 92 22.980 43.700 41.760 1.00 0.00 ATOM 11495 H15X POP 92 22.980 44.260 40.810 1.00 0.00 ATOM 11496 H15Y POP 92 23.270 44.360 42.610 1.00 0.00 ATOM 11497 6C31 POP 92 21.500 43.510 42.080 1.00 0.00 ATOM 11498 H16X POP 92 20.940 43.170 41.180 1.00 0.00 ATOM 11499 H16Y POP 92 21.050 44.460 42.450 1.00 0.00 ATOM 11500 H16Z POP 92 21.310 42.840 42.950 1.00 0.00 ATOM 11501 N POP 93 13.180 18.000 19.030 1.00 0.00 ATOM 11502 HN1 POP 93 12.760 18.170 19.960 1.00 0.00 ATOM 11503 HN2 POP 93 13.130 18.920 18.550 1.00 0.00 ATOM 11504 HN3 POP 93 12.580 17.310 18.530 1.00 0.00 ATOM 11505 C12 POP 93 14.560 17.400 19.190 1.00 0.00 ATOM 11506 H12A POP 93 14.860 17.360 18.120 1.00 0.00 ATOM 11507 H12B POP 93 14.400 16.430 19.710 1.00 0.00 ATOM 11508 C11 POP 93 15.510 18.240 20.040 1.00 0.00 ATOM 11509 H11A POP 93 15.350 19.300 19.730 1.00 0.00 ATOM 11510 H11B POP 93 16.520 17.840 19.820 1.00 0.00 ATOM 11511 P POP 93 16.190 18.100 22.410 1.00 0.00 ATOM 11512 O13 POP 93 16.760 19.460 22.310 1.00 0.00 ATOM 11513 O14 POP 93 17.150 17.020 22.100 1.00 0.00 ATOM 11514 O11 POP 93 15.510 17.840 23.840 1.00 0.00 ATOM 11515 O12 POP 93 15.000 18.000 21.350 1.00 0.00 ATOM 11516 C1 POP 93 14.160 17.360 23.890 1.00 0.00 ATOM 11517 HA POP 93 14.100 16.870 24.890 1.00 0.00 ATOM 11518 HB POP 93 13.850 16.600 23.140 1.00 0.00 ATOM 11519 C2 POP 93 13.040 18.420 23.930 1.00 0.00 ATOM 11520 HS POP 93 13.040 18.880 22.930 1.00 0.00 ATOM 11521 O21 POP 93 13.440 19.440 24.850 1.00 0.00 ATOM 11522 C21 POP 93 12.580 20.460 24.850 1.00 0.00 ATOM 11523 O22 POP 93 11.660 20.680 24.080 1.00 0.00 ATOM 11524 C22 POP 93 13.070 21.410 25.940 1.00 0.00 ATOM 11525 H2R POP 93 12.660 22.430 25.820 1.00 0.00 ATOM 11526 H2S POP 93 14.160 21.520 26.080 1.00 0.00 ATOM 11527 C3 POP 93 11.740 17.680 24.330 1.00 0.00 ATOM 11528 HX POP 93 11.720 16.720 23.770 1.00 0.00 ATOM 11529 HY POP 93 10.880 18.320 24.050 1.00 0.00 ATOM 11530 O31 POP 93 11.570 17.290 25.690 1.00 0.00 ATOM 11531 C31 POP 93 10.430 17.610 26.300 1.00 0.00 ATOM 11532 O32 POP 93 9.440 17.980 25.680 1.00 0.00 ATOM 11533 C32 POP 93 10.620 17.310 27.780 1.00 0.00 ATOM 11534 H2X POP 93 11.520 17.900 28.040 1.00 0.00 ATOM 11535 H2Y POP 93 10.630 16.210 27.900 1.00 0.00 ATOM 11536 C23 POP 93 12.510 20.940 27.290 1.00 0.00 ATOM 11537 H3R POP 93 13.080 20.040 27.610 1.00 0.00 ATOM 11538 H3S POP 93 11.450 20.600 27.220 1.00 0.00 ATOM 11539 C24 POP 93 12.580 21.920 28.460 1.00 0.00 ATOM 11540 H4R POP 93 11.760 22.650 28.320 1.00 0.00 ATOM 11541 H4S POP 93 13.600 22.360 28.470 1.00 0.00 ATOM 11542 C25 POP 93 12.490 21.200 29.810 1.00 0.00 ATOM 11543 H5R POP 93 13.320 20.480 29.970 1.00 0.00 ATOM 11544 H5S POP 93 11.460 20.790 29.860 1.00 0.00 ATOM 11545 C26 POP 93 12.640 22.160 30.990 1.00 0.00 ATOM 11546 H6R POP 93 11.690 22.710 31.150 1.00 0.00 ATOM 11547 H6S POP 93 13.550 22.790 30.860 1.00 0.00 ATOM 11548 C27 POP 93 12.970 21.420 32.280 1.00 0.00 ATOM 11549 H7R POP 93 13.820 20.710 32.260 1.00 0.00 ATOM 11550 H7S POP 93 12.000 21.000 32.650 1.00 0.00 ATOM 11551 C28 POP 93 13.480 22.460 33.280 1.00 0.00 ATOM 11552 H8R POP 93 12.680 23.220 33.420 1.00 0.00 ATOM 11553 H8S POP 93 14.380 22.950 32.860 1.00 0.00 ATOM 11554 C29 POP 93 13.770 21.900 34.650 1.00 0.00 ATOM 11555 H91 POP 93 13.270 20.930 34.770 1.00 0.00 ATOM 11556 0C21 POP 93 14.710 22.340 35.490 1.00 0.00 ATOM 11557 1H10 POP 93 14.730 21.840 36.470 1.00 0.00 ATOM 11558 1C21 POP 93 15.610 23.540 35.440 1.00 0.00 ATOM 11559 H11R POP 93 15.650 23.880 34.380 1.00 0.00 ATOM 11560 H11S POP 93 16.630 23.230 35.750 1.00 0.00 ATOM 11561 2C21 POP 93 15.150 24.580 36.460 1.00 0.00 ATOM 11562 H12R POP 93 15.260 24.130 37.470 1.00 0.00 ATOM 11563 H12S POP 93 14.100 24.870 36.260 1.00 0.00 ATOM 11564 3C21 POP 93 16.150 25.750 36.420 1.00 0.00 ATOM 11565 H13R POP 93 16.300 26.170 35.410 1.00 0.00 ATOM 11566 H13S POP 93 17.100 25.240 36.700 1.00 0.00 ATOM 11567 4C21 POP 93 15.800 26.890 37.380 1.00 0.00 ATOM 11568 H14R POP 93 14.830 27.380 37.170 1.00 0.00 ATOM 11569 H14S POP 93 16.570 27.690 37.330 1.00 0.00 ATOM 11570 5C21 POP 93 15.730 26.510 38.860 1.00 0.00 ATOM 11571 H15R POP 93 16.560 25.850 39.210 1.00 0.00 ATOM 11572 H15S POP 93 14.790 25.960 39.080 1.00 0.00 ATOM 11573 6C21 POP 93 15.810 27.770 39.720 1.00 0.00 ATOM 11574 H16R POP 93 14.880 28.330 39.490 1.00 0.00 ATOM 11575 H16S POP 93 16.660 28.440 39.490 1.00 0.00 ATOM 11576 7C21 POP 93 15.900 27.440 41.210 1.00 0.00 ATOM 11577 H17R POP 93 16.480 26.490 41.210 1.00 0.00 ATOM 11578 H17S POP 93 14.860 27.220 41.520 1.00 0.00 ATOM 11579 8C21 POP 93 16.580 28.590 41.960 1.00 0.00 ATOM 11580 H18R POP 93 17.640 28.700 41.660 1.00 0.00 ATOM 11581 H18S POP 93 16.470 28.400 43.050 1.00 0.00 ATOM 11582 H18T POP 93 16.090 29.560 41.740 1.00 0.00 ATOM 11583 C33 POP 93 9.450 17.900 28.580 1.00 0.00 ATOM 11584 H3X POP 93 8.510 17.940 27.980 1.00 0.00 ATOM 11585 H3Y POP 93 9.700 18.910 28.950 1.00 0.00 ATOM 11586 C34 POP 93 9.290 17.140 29.900 1.00 0.00 ATOM 11587 H4X POP 93 10.350 17.040 30.220 1.00 0.00 ATOM 11588 H4Y POP 93 8.810 16.170 29.650 1.00 0.00 ATOM 11589 C35 POP 93 8.420 17.950 30.860 1.00 0.00 ATOM 11590 H5X POP 93 7.330 17.760 30.780 1.00 0.00 ATOM 11591 H5Y POP 93 8.640 19.030 30.700 1.00 0.00 ATOM 11592 C36 POP 93 8.680 17.570 32.320 1.00 0.00 ATOM 11593 H6X POP 93 8.450 16.490 32.470 1.00 0.00 ATOM 11594 H6Y POP 93 7.920 18.120 32.900 1.00 0.00 ATOM 11595 C37 POP 93 10.080 17.980 32.780 1.00 0.00 ATOM 11596 H7X POP 93 10.240 19.080 32.750 1.00 0.00 ATOM 11597 H7Y POP 93 10.880 17.710 32.060 1.00 0.00 ATOM 11598 C38 POP 93 10.400 17.310 34.110 1.00 0.00 ATOM 11599 H8X POP 93 10.790 16.310 33.840 1.00 0.00 ATOM 11600 H8Y POP 93 9.500 17.170 34.750 1.00 0.00 ATOM 11601 C39 POP 93 11.360 18.070 35.030 1.00 0.00 ATOM 11602 H9X POP 93 10.910 19.050 35.320 1.00 0.00 ATOM 11603 H9Y POP 93 12.280 18.260 34.440 1.00 0.00 ATOM 11604 0C31 POP 93 11.530 17.360 36.370 1.00 0.00 ATOM 11605 H10X POP 93 12.140 16.460 36.130 1.00 0.00 ATOM 11606 H10Y POP 93 10.570 17.030 36.810 1.00 0.00 ATOM 11607 1C31 POP 93 12.200 18.300 37.380 1.00 0.00 ATOM 11608 H11X POP 93 11.400 18.960 37.780 1.00 0.00 ATOM 11609 H11Y POP 93 12.940 18.920 36.820 1.00 0.00 ATOM 11610 2C31 POP 93 12.750 17.430 38.510 1.00 0.00 ATOM 11611 H12X POP 93 13.520 16.720 38.130 1.00 0.00 ATOM 11612 H12Y POP 93 11.960 16.750 38.890 1.00 0.00 ATOM 11613 3C31 POP 93 13.420 18.370 39.510 1.00 0.00 ATOM 11614 H13X POP 93 12.700 19.070 39.980 1.00 0.00 ATOM 11615 H13Y POP 93 14.250 18.940 39.030 1.00 0.00 ATOM 11616 4C31 POP 93 14.120 17.540 40.600 1.00 0.00 ATOM 11617 H14X POP 93 14.730 18.230 41.220 1.00 0.00 ATOM 11618 H14Y POP 93 14.760 16.780 40.100 1.00 0.00 ATOM 11619 5C31 POP 93 13.220 16.930 41.680 1.00 0.00 ATOM 11620 H15X POP 93 12.340 16.380 41.280 1.00 0.00 ATOM 11621 H15Y POP 93 12.870 17.780 42.300 1.00 0.00 ATOM 11622 6C31 POP 93 13.990 15.980 42.600 1.00 0.00 ATOM 11623 H16X POP 93 14.700 16.540 43.250 1.00 0.00 ATOM 11624 H16Y POP 93 14.380 15.130 42.000 1.00 0.00 ATOM 11625 H16Z POP 93 13.190 15.630 43.280 1.00 0.00 ATOM 11626 N POP 94 31.240 56.830 23.900 1.00 0.00 ATOM 11627 HN1 POP 94 30.900 55.840 23.940 1.00 0.00 ATOM 11628 HN2 POP 94 30.990 57.300 23.010 1.00 0.00 ATOM 11629 HN3 POP 94 32.270 56.700 23.790 1.00 0.00 ATOM 11630 C12 POP 94 30.890 57.550 25.180 1.00 0.00 ATOM 11631 H12A POP 94 31.410 58.520 25.190 1.00 0.00 ATOM 11632 H12B POP 94 31.340 56.890 25.950 1.00 0.00 ATOM 11633 C11 POP 94 29.370 57.640 25.320 1.00 0.00 ATOM 11634 H11A POP 94 29.030 58.260 26.180 1.00 0.00 ATOM 11635 H11B POP 94 29.090 56.590 25.550 1.00 0.00 ATOM 11636 P POP 94 27.320 58.480 24.060 1.00 0.00 ATOM 11637 O13 POP 94 26.620 57.190 24.230 1.00 0.00 ATOM 11638 O14 POP 94 27.060 59.220 22.810 1.00 0.00 ATOM 11639 O11 POP 94 27.090 59.430 25.330 1.00 0.00 ATOM 11640 O12 POP 94 28.870 58.100 24.060 1.00 0.00 ATOM 11641 C1 POP 94 25.890 60.190 25.500 1.00 0.00 ATOM 11642 HA POP 94 25.350 60.290 24.530 1.00 0.00 ATOM 11643 HB POP 94 26.180 61.210 25.820 1.00 0.00 ATOM 11644 C2 POP 94 24.920 59.720 26.610 1.00 0.00 ATOM 11645 HS POP 94 25.480 59.460 27.540 1.00 0.00 ATOM 11646 O21 POP 94 24.230 58.540 26.170 1.00 0.00 ATOM 11647 C21 POP 94 23.780 57.670 27.060 1.00 0.00 ATOM 11648 O22 POP 94 24.000 57.720 28.260 1.00 0.00 ATOM 11649 C22 POP 94 22.990 56.570 26.360 1.00 0.00 ATOM 11650 H2R POP 94 23.610 56.000 25.630 1.00 0.00 ATOM 11651 H2S POP 94 22.190 57.000 25.710 1.00 0.00 ATOM 11652 C3 POP 94 23.910 60.780 27.080 1.00 0.00 ATOM 11653 HX POP 94 23.020 60.720 26.420 1.00 0.00 ATOM 11654 HY POP 94 24.340 61.800 27.000 1.00 0.00 ATOM 11655 O31 POP 94 23.550 60.490 28.430 1.00 0.00 ATOM 11656 C31 POP 94 22.260 60.370 28.760 1.00 0.00 ATOM 11657 O32 POP 94 21.260 60.520 28.080 1.00 0.00 ATOM 11658 C32 POP 94 22.230 60.170 30.260 1.00 0.00 ATOM 11659 H2X POP 94 22.350 61.190 30.700 1.00 0.00 ATOM 11660 H2Y POP 94 23.080 59.590 30.690 1.00 0.00 ATOM 11661 C23 POP 94 22.320 55.610 27.340 1.00 0.00 ATOM 11662 H3R POP 94 22.980 55.470 28.220 1.00 0.00 ATOM 11663 H3S POP 94 22.170 54.650 26.800 1.00 0.00 ATOM 11664 C24 POP 94 20.950 56.110 27.840 1.00 0.00 ATOM 11665 H4R POP 94 20.340 56.210 26.920 1.00 0.00 ATOM 11666 H4S POP 94 21.000 57.120 28.290 1.00 0.00 ATOM 11667 C25 POP 94 20.120 55.100 28.630 1.00 0.00 ATOM 11668 H5R POP 94 19.990 54.200 28.000 1.00 0.00 ATOM 11669 H5S POP 94 19.070 55.450 28.620 1.00 0.00 ATOM 11670 C26 POP 94 20.670 54.770 30.020 1.00 0.00 ATOM 11671 H6R POP 94 20.630 55.690 30.640 1.00 0.00 ATOM 11672 H6S POP 94 21.720 54.420 30.110 1.00 0.00 ATOM 11673 C27 POP 94 19.690 53.810 30.710 1.00 0.00 ATOM 11674 H7R POP 94 20.310 53.240 31.430 1.00 0.00 ATOM 11675 H7S POP 94 19.290 53.100 29.950 1.00 0.00 ATOM 11676 C28 POP 94 18.580 54.500 31.510 1.00 0.00 ATOM 11677 H8R POP 94 18.180 55.340 30.900 1.00 0.00 ATOM 11678 H8S POP 94 19.100 55.080 32.300 1.00 0.00 ATOM 11679 C29 POP 94 17.530 53.630 32.130 1.00 0.00 ATOM 11680 H91 POP 94 17.770 52.720 32.710 1.00 0.00 ATOM 11681 0C21 POP 94 16.210 53.810 32.030 1.00 0.00 ATOM 11682 1H10 POP 94 15.450 53.180 32.530 1.00 0.00 ATOM 11683 1C21 POP 94 15.550 55.020 31.420 1.00 0.00 ATOM 11684 H11R POP 94 15.100 54.760 30.430 1.00 0.00 ATOM 11685 H11S POP 94 16.320 55.790 31.220 1.00 0.00 ATOM 11686 2C21 POP 94 14.530 55.590 32.410 1.00 0.00 ATOM 11687 H12R POP 94 14.900 55.570 33.460 1.00 0.00 ATOM 11688 H12S POP 94 13.650 54.920 32.270 1.00 0.00 ATOM 11689 3C21 POP 94 14.210 57.010 31.940 1.00 0.00 ATOM 11690 H13R POP 94 13.960 57.000 30.860 1.00 0.00 ATOM 11691 H13S POP 94 15.110 57.630 32.130 1.00 0.00 ATOM 11692 4C21 POP 94 12.940 57.420 32.690 1.00 0.00 ATOM 11693 H14R POP 94 12.190 56.720 32.270 1.00 0.00 ATOM 11694 H14S POP 94 12.680 58.490 32.490 1.00 0.00 ATOM 11695 5C21 POP 94 13.050 57.270 34.210 1.00 0.00 ATOM 11696 H15R POP 94 13.980 57.780 34.530 1.00 0.00 ATOM 11697 H15S POP 94 13.080 56.260 34.670 1.00 0.00 ATOM 11698 6C21 POP 94 11.960 58.000 34.990 1.00 0.00 ATOM 11699 H16R POP 94 10.940 57.590 34.810 1.00 0.00 ATOM 11700 H16S POP 94 11.930 59.010 34.520 1.00 0.00 ATOM 11701 7C21 POP 94 12.160 58.130 36.510 1.00 0.00 ATOM 11702 H17R POP 94 13.070 58.690 36.820 1.00 0.00 ATOM 11703 H17S POP 94 12.370 57.120 36.920 1.00 0.00 ATOM 11704 8C21 POP 94 10.890 58.540 37.250 1.00 0.00 ATOM 11705 H18R POP 94 10.910 59.640 37.380 1.00 0.00 ATOM 11706 H18S POP 94 10.790 58.000 38.220 1.00 0.00 ATOM 11707 H18T POP 94 9.980 58.350 36.640 1.00 0.00 ATOM 11708 C33 POP 94 21.010 59.320 30.600 1.00 0.00 ATOM 11709 H3X POP 94 21.200 58.300 30.210 1.00 0.00 ATOM 11710 H3Y POP 94 20.100 59.650 30.070 1.00 0.00 ATOM 11711 C34 POP 94 20.660 59.260 32.090 1.00 0.00 ATOM 11712 H4X POP 94 20.560 60.340 32.350 1.00 0.00 ATOM 11713 H4Y POP 94 21.540 58.830 32.630 1.00 0.00 ATOM 11714 C35 POP 94 19.390 58.510 32.490 1.00 0.00 ATOM 11715 H5X POP 94 19.620 57.430 32.360 1.00 0.00 ATOM 11716 H5Y POP 94 18.590 58.780 31.760 1.00 0.00 ATOM 11717 C36 POP 94 19.140 58.750 33.980 1.00 0.00 ATOM 11718 H6X POP 94 19.050 59.830 34.200 1.00 0.00 ATOM 11719 H6Y POP 94 19.930 58.270 34.600 1.00 0.00 ATOM 11720 C37 POP 94 17.770 58.140 34.320 1.00 0.00 ATOM 11721 H7X POP 94 17.700 57.070 34.020 1.00 0.00 ATOM 11722 H7Y POP 94 17.000 58.760 33.800 1.00 0.00 ATOM 11723 C38 POP 94 17.680 58.130 35.840 1.00 0.00 ATOM 11724 H8X POP 94 18.070 59.050 36.330 1.00 0.00 ATOM 11725 H8Y POP 94 18.320 57.260 36.120 1.00 0.00 ATOM 11726 C39 POP 94 16.260 57.790 36.300 1.00 0.00 ATOM 11727 H9X POP 94 15.810 56.900 35.810 1.00 0.00 ATOM 11728 H9Y POP 94 15.420 58.510 36.180 1.00 0.00 ATOM 11729 0C31 POP 94 16.330 57.350 37.760 1.00 0.00 ATOM 11730 H10X POP 94 16.830 56.380 37.980 1.00 0.00 ATOM 11731 H10Y POP 94 15.250 57.100 37.880 1.00 0.00 ATOM 11732 1C31 POP 94 16.960 58.370 38.710 1.00 0.00 ATOM 11733 H11X POP 94 17.030 59.440 38.430 1.00 0.00 ATOM 11734 H11Y POP 94 17.970 57.980 38.970 1.00 0.00 ATOM 11735 2C31 POP 94 16.370 58.330 40.120 1.00 0.00 ATOM 11736 H12X POP 94 17.020 58.860 40.840 1.00 0.00 ATOM 11737 H12Y POP 94 16.280 57.260 40.400 1.00 0.00 ATOM 11738 3C31 POP 94 14.920 58.820 40.160 1.00 0.00 ATOM 11739 H13X POP 94 14.400 58.120 39.470 1.00 0.00 ATOM 11740 H13Y POP 94 14.850 59.830 39.690 1.00 0.00 ATOM 11741 4C31 POP 94 14.210 58.710 41.510 1.00 0.00 ATOM 11742 H14X POP 94 14.210 57.690 41.940 1.00 0.00 ATOM 11743 H14Y POP 94 13.160 58.900 41.210 1.00 0.00 ATOM 11744 5C31 POP 94 14.440 59.730 42.630 1.00 0.00 ATOM 11745 H15X POP 94 15.530 59.910 42.670 1.00 0.00 ATOM 11746 H15Y POP 94 14.090 59.340 43.620 1.00 0.00 ATOM 11747 6C31 POP 94 13.650 61.020 42.390 1.00 0.00 ATOM 11748 H16X POP 94 12.570 60.810 42.260 1.00 0.00 ATOM 11749 H16Y POP 94 14.110 61.490 41.490 1.00 0.00 ATOM 11750 H16Z POP 94 13.880 61.530 43.350 1.00 0.00 ATOM 11751 N POP 95 2.320 43.490 22.330 1.00 0.00 ATOM 11752 HN1 POP 95 1.550 44.140 22.090 1.00 0.00 ATOM 11753 HN2 POP 95 2.790 43.610 23.260 1.00 0.00 ATOM 11754 HN3 POP 95 3.070 43.690 21.640 1.00 0.00 ATOM 11755 C12 POP 95 2.070 42.010 22.170 1.00 0.00 ATOM 11756 H12A POP 95 1.660 41.980 21.130 1.00 0.00 ATOM 11757 H12B POP 95 1.250 41.640 22.810 1.00 0.00 ATOM 11758 C11 POP 95 3.320 41.160 22.380 1.00 0.00 ATOM 11759 H11A POP 95 3.010 40.180 21.960 1.00 0.00 ATOM 11760 H11B POP 95 3.520 41.180 23.470 1.00 0.00 ATOM 11761 P POP 95 5.490 40.640 21.240 1.00 0.00 ATOM 11762 O13 POP 95 6.770 41.360 21.020 1.00 0.00 ATOM 11763 O14 POP 95 5.040 39.780 20.120 1.00 0.00 ATOM 11764 O11 POP 95 5.630 39.770 22.580 1.00 0.00 ATOM 11765 O12 POP 95 4.390 41.730 21.610 1.00 0.00 ATOM 11766 C1 POP 95 6.440 38.590 22.520 1.00 0.00 ATOM 11767 HA POP 95 7.470 38.890 22.230 1.00 0.00 ATOM 11768 HB POP 95 6.040 37.860 21.780 1.00 0.00 ATOM 11769 C2 POP 95 6.540 37.890 23.890 1.00 0.00 ATOM 11770 HS POP 95 6.250 36.820 23.730 1.00 0.00 ATOM 11771 O21 POP 95 5.640 38.450 24.850 1.00 0.00 ATOM 11772 C21 POP 95 4.350 38.180 24.670 1.00 0.00 ATOM 11773 O22 POP 95 3.970 37.360 23.850 1.00 0.00 ATOM 11774 C22 POP 95 3.480 39.010 25.610 1.00 0.00 ATOM 11775 H2R POP 95 2.430 39.190 25.300 1.00 0.00 ATOM 11776 H2S POP 95 3.850 40.050 25.690 1.00 0.00 ATOM 11777 C3 POP 95 7.930 37.800 24.530 1.00 0.00 ATOM 11778 HX POP 95 8.440 38.770 24.340 1.00 0.00 ATOM 11779 HY POP 95 8.580 37.030 24.070 1.00 0.00 ATOM 11780 O31 POP 95 7.820 37.450 25.920 1.00 0.00 ATOM 11781 C31 POP 95 7.850 38.480 26.760 1.00 0.00 ATOM 11782 O32 POP 95 7.980 39.650 26.440 1.00 0.00 ATOM 11783 C32 POP 95 7.310 38.020 28.110 1.00 0.00 ATOM 11784 H2X POP 95 8.060 37.330 28.550 1.00 0.00 ATOM 11785 H2Y POP 95 6.340 37.480 28.020 1.00 0.00 ATOM 11786 C23 POP 95 3.290 38.410 27.010 1.00 0.00 ATOM 11787 H3R POP 95 4.300 38.290 27.450 1.00 0.00 ATOM 11788 H3S POP 95 2.850 37.400 26.890 1.00 0.00 ATOM 11789 C24 POP 95 2.560 39.350 27.980 1.00 0.00 ATOM 11790 H4R POP 95 1.650 39.600 27.400 1.00 0.00 ATOM 11791 H4S POP 95 3.090 40.320 28.020 1.00 0.00 ATOM 11792 C25 POP 95 2.360 38.710 29.350 1.00 0.00 ATOM 11793 H5R POP 95 3.270 38.130 29.610 1.00 0.00 ATOM 11794 H5S POP 95 1.600 37.900 29.280 1.00 0.00 ATOM 11795 C26 POP 95 1.900 39.760 30.370 1.00 0.00 ATOM 11796 H6R POP 95 1.300 40.550 29.860 1.00 0.00 ATOM 11797 H6S POP 95 2.770 40.290 30.820 1.00 0.00 ATOM 11798 C27 POP 95 1.060 39.250 31.540 1.00 0.00 ATOM 11799 H7R POP 95 1.710 38.620 32.190 1.00 0.00 ATOM 11800 H7S POP 95 0.230 38.630 31.170 1.00 0.00 ATOM 11801 C28 POP 95 0.510 40.330 32.480 1.00 0.00 ATOM 11802 H8R POP 95 -0.040 41.150 31.980 1.00 0.00 ATOM 11803 H8S POP 95 1.410 40.820 32.920 1.00 0.00 ATOM 11804 C29 POP 95 -0.340 39.640 33.500 1.00 0.00 ATOM 11805 H91 POP 95 -0.230 38.570 33.750 1.00 0.00 ATOM 11806 0C21 POP 95 -1.380 40.280 34.050 1.00 0.00 ATOM 11807 1H10 POP 95 -1.890 39.800 34.910 1.00 0.00 ATOM 11808 1C21 POP 95 -1.790 41.680 33.700 1.00 0.00 ATOM 11809 H11R POP 95 -2.380 41.580 32.760 1.00 0.00 ATOM 11810 H11S POP 95 -0.790 42.150 33.560 1.00 0.00 ATOM 11811 2C21 POP 95 -2.650 42.400 34.740 1.00 0.00 ATOM 11812 H12R POP 95 -2.250 43.440 34.640 1.00 0.00 ATOM 11813 H12S POP 95 -2.500 42.120 35.800 1.00 0.00 ATOM 11814 3C21 POP 95 -4.130 42.540 34.370 1.00 0.00 ATOM 11815 H13R POP 95 -4.510 41.500 34.410 1.00 0.00 ATOM 11816 H13S POP 95 -4.150 42.850 33.300 1.00 0.00 ATOM 11817 4C21 POP 95 -4.930 43.600 35.130 1.00 0.00 ATOM 11818 H14R POP 95 -4.570 44.640 34.990 1.00 0.00 ATOM 11819 H14S POP 95 -4.920 43.400 36.220 1.00 0.00 ATOM 11820 5C21 POP 95 -6.420 43.550 34.800 1.00 0.00 ATOM 11821 H15R POP 95 -6.830 42.510 34.820 1.00 0.00 ATOM 11822 H15S POP 95 -6.500 43.860 33.730 1.00 0.00 ATOM 11823 6C21 POP 95 -7.170 44.490 35.750 1.00 0.00 ATOM 11824 H16R POP 95 -8.010 44.940 35.190 1.00 0.00 ATOM 11825 H16S POP 95 -6.520 45.330 36.070 1.00 0.00 ATOM 11826 7C21 POP 95 -7.890 43.800 36.910 1.00 0.00 ATOM 11827 H17R POP 95 -8.630 43.150 36.400 1.00 0.00 ATOM 11828 H17S POP 95 -8.430 44.570 37.490 1.00 0.00 ATOM 11829 8C21 POP 95 -7.000 43.020 37.880 1.00 0.00 ATOM 11830 H18R POP 95 -7.590 42.370 38.550 1.00 0.00 ATOM 11831 H18S POP 95 -6.350 43.750 38.410 1.00 0.00 ATOM 11832 H18T POP 95 -6.290 42.440 37.240 1.00 0.00 ATOM 11833 C33 POP 95 7.150 39.190 29.090 1.00 0.00 ATOM 11834 H3X POP 95 6.350 39.820 28.650 1.00 0.00 ATOM 11835 H3Y POP 95 8.100 39.780 29.120 1.00 0.00 ATOM 11836 C34 POP 95 6.700 38.840 30.500 1.00 0.00 ATOM 11837 H4X POP 95 7.530 38.290 31.000 1.00 0.00 ATOM 11838 H4Y POP 95 5.780 38.210 30.450 1.00 0.00 ATOM 11839 C35 POP 95 6.290 40.110 31.250 1.00 0.00 ATOM 11840 H5X POP 95 5.460 40.560 30.670 1.00 0.00 ATOM 11841 H5Y POP 95 7.240 40.690 31.260 1.00 0.00 ATOM 11842 C36 POP 95 5.800 39.970 32.690 1.00 0.00 ATOM 11843 H6X POP 95 5.090 39.120 32.810 1.00 0.00 ATOM 11844 H6Y POP 95 5.300 40.910 33.030 1.00 0.00 ATOM 11845 C37 POP 95 6.960 39.790 33.670 1.00 0.00 ATOM 11846 H7X POP 95 7.710 40.590 33.480 1.00 0.00 ATOM 11847 H7Y POP 95 7.440 38.810 33.450 1.00 0.00 ATOM 11848 C38 POP 95 6.580 39.930 35.140 1.00 0.00 ATOM 11849 H8X POP 95 7.370 39.470 35.770 1.00 0.00 ATOM 11850 H8Y POP 95 5.560 39.490 35.210 1.00 0.00 ATOM 11851 C39 POP 95 6.690 41.410 35.530 1.00 0.00 ATOM 11852 H9X POP 95 6.040 42.060 34.910 1.00 0.00 ATOM 11853 H9Y POP 95 7.740 41.730 35.350 1.00 0.00 ATOM 11854 0C31 POP 95 6.370 41.570 37.010 1.00 0.00 ATOM 11855 H10X POP 95 5.380 41.170 37.320 1.00 0.00 ATOM 11856 H10Y POP 95 6.380 42.650 37.290 1.00 0.00 ATOM 11857 1C31 POP 95 7.360 40.970 38.010 1.00 0.00 ATOM 11858 H11X POP 95 8.400 41.130 37.640 1.00 0.00 ATOM 11859 H11Y POP 95 7.300 39.880 37.820 1.00 0.00 ATOM 11860 2C31 POP 95 7.180 41.310 39.490 1.00 0.00 ATOM 11861 H12X POP 95 6.170 40.900 39.710 1.00 0.00 ATOM 11862 H12Y POP 95 7.520 42.370 39.510 1.00 0.00 ATOM 11863 3C31 POP 95 8.220 40.460 40.230 1.00 0.00 ATOM 11864 H13X POP 95 9.200 40.650 39.750 1.00 0.00 ATOM 11865 H13Y POP 95 7.930 39.390 40.180 1.00 0.00 ATOM 11866 4C31 POP 95 8.360 40.770 41.720 1.00 0.00 ATOM 11867 H14X POP 95 7.420 40.470 42.220 1.00 0.00 ATOM 11868 H14Y POP 95 8.600 41.850 41.810 1.00 0.00 ATOM 11869 5C31 POP 95 9.650 40.200 42.330 1.00 0.00 ATOM 11870 H15X POP 95 10.570 40.480 41.780 1.00 0.00 ATOM 11871 H15Y POP 95 9.540 39.100 42.310 1.00 0.00 ATOM 11872 6C31 POP 95 9.790 40.580 43.800 1.00 0.00 ATOM 11873 H16X POP 95 10.620 40.000 44.250 1.00 0.00 ATOM 11874 H16Y POP 95 8.840 40.490 44.390 1.00 0.00 ATOM 11875 H16Z POP 95 10.100 41.640 43.810 1.00 0.00 ATOM 11876 N POP 96 4.840 15.630 23.770 1.00 0.00 ATOM 11877 HN1 POP 96 3.940 15.790 24.270 1.00 0.00 ATOM 11878 HN2 POP 96 4.670 15.960 22.800 1.00 0.00 ATOM 11879 HN3 POP 96 4.970 14.610 23.590 1.00 0.00 ATOM 11880 C12 POP 96 6.160 16.180 24.280 1.00 0.00 ATOM 11881 H12A POP 96 6.140 16.310 25.380 1.00 0.00 ATOM 11882 H12B POP 96 6.270 17.230 23.950 1.00 0.00 ATOM 11883 C11 POP 96 7.350 15.370 23.760 1.00 0.00 ATOM 11884 H11A POP 96 7.480 14.470 24.400 1.00 0.00 ATOM 11885 H11B POP 96 8.210 16.080 23.770 1.00 0.00 ATOM 11886 P POP 96 8.210 14.310 21.800 1.00 0.00 ATOM 11887 O13 POP 96 9.360 15.240 21.880 1.00 0.00 ATOM 11888 O14 POP 96 7.990 13.810 20.420 1.00 0.00 ATOM 11889 O11 POP 96 8.520 13.090 22.790 1.00 0.00 ATOM 11890 O12 POP 96 6.930 15.030 22.440 1.00 0.00 ATOM 11891 C1 POP 96 9.610 12.200 22.560 1.00 0.00 ATOM 11892 HA POP 96 10.280 12.630 21.780 1.00 0.00 ATOM 11893 HB POP 96 9.310 11.180 22.270 1.00 0.00 ATOM 11894 C2 POP 96 10.500 12.110 23.820 1.00 0.00 ATOM 11895 HS POP 96 11.300 11.380 23.580 1.00 0.00 ATOM 11896 O21 POP 96 9.780 11.630 24.960 1.00 0.00 ATOM 11897 C21 POP 96 9.410 10.350 24.910 1.00 0.00 ATOM 11898 O22 POP 96 9.780 9.520 24.090 1.00 0.00 ATOM 11899 C22 POP 96 8.500 10.170 26.110 1.00 0.00 ATOM 11900 H2R POP 96 7.740 10.970 26.070 1.00 0.00 ATOM 11901 H2S POP 96 9.090 10.360 27.040 1.00 0.00 ATOM 11902 C3 POP 96 11.260 13.390 24.200 1.00 0.00 ATOM 11903 HX POP 96 10.500 14.120 24.540 1.00 0.00 ATOM 11904 HY POP 96 11.530 13.930 23.270 1.00 0.00 ATOM 11905 O31 POP 96 12.340 13.330 25.140 1.00 0.00 ATOM 11906 C31 POP 96 12.030 13.700 26.380 1.00 0.00 ATOM 11907 O32 POP 96 10.880 13.890 26.740 1.00 0.00 ATOM 11908 C32 POP 96 13.270 13.960 27.230 1.00 0.00 ATOM 11909 H2X POP 96 13.730 14.850 26.760 1.00 0.00 ATOM 11910 H2Y POP 96 13.920 13.060 27.190 1.00 0.00 ATOM 11911 C23 POP 96 7.900 8.770 26.220 1.00 0.00 ATOM 11912 H3R POP 96 8.700 8.010 26.370 1.00 0.00 ATOM 11913 H3S POP 96 7.390 8.540 25.260 1.00 0.00 ATOM 11914 C24 POP 96 6.840 8.640 27.320 1.00 0.00 ATOM 11915 H4R POP 96 6.300 7.670 27.290 1.00 0.00 ATOM 11916 H4S POP 96 6.150 9.470 27.080 1.00 0.00 ATOM 11917 C25 POP 96 7.390 8.880 28.730 1.00 0.00 ATOM 11918 H5R POP 96 7.740 9.930 28.840 1.00 0.00 ATOM 11919 H5S POP 96 8.160 8.130 29.000 1.00 0.00 ATOM 11920 C26 POP 96 6.250 8.690 29.740 1.00 0.00 ATOM 11921 H6R POP 96 5.900 7.650 29.560 1.00 0.00 ATOM 11922 H6S POP 96 5.410 9.400 29.570 1.00 0.00 ATOM 11923 C27 POP 96 6.760 8.810 31.180 1.00 0.00 ATOM 11924 H7R POP 96 7.310 9.760 31.300 1.00 0.00 ATOM 11925 H7S POP 96 7.560 8.060 31.350 1.00 0.00 ATOM 11926 C28 POP 96 5.630 8.740 32.210 1.00 0.00 ATOM 11927 H8R POP 96 5.230 7.710 32.280 1.00 0.00 ATOM 11928 H8S POP 96 4.760 9.410 32.040 1.00 0.00 ATOM 11929 C29 POP 96 6.180 9.070 33.570 1.00 0.00 ATOM 11930 H91 POP 96 7.090 8.490 33.770 1.00 0.00 ATOM 11931 0C21 POP 96 5.660 9.820 34.550 1.00 0.00 ATOM 11932 1H10 POP 96 6.230 9.910 35.480 1.00 0.00 ATOM 11933 1C21 POP 96 4.400 10.640 34.430 1.00 0.00 ATOM 11934 H11R POP 96 3.460 10.110 34.660 1.00 0.00 ATOM 11935 H11S POP 96 4.210 10.950 33.380 1.00 0.00 ATOM 11936 2C21 POP 96 4.520 11.870 35.340 1.00 0.00 ATOM 11937 H12R POP 96 5.220 12.700 35.110 1.00 0.00 ATOM 11938 H12S POP 96 4.560 11.540 36.400 1.00 0.00 ATOM 11939 3C21 POP 96 3.250 12.720 35.310 1.00 0.00 ATOM 11940 H13R POP 96 2.320 12.120 35.470 1.00 0.00 ATOM 11941 H13S POP 96 3.190 13.130 34.280 1.00 0.00 ATOM 11942 4C21 POP 96 3.270 13.860 36.330 1.00 0.00 ATOM 11943 H14R POP 96 4.250 14.360 36.170 1.00 0.00 ATOM 11944 H14S POP 96 3.220 13.310 37.300 1.00 0.00 ATOM 11945 5C21 POP 96 2.100 14.840 36.430 1.00 0.00 ATOM 11946 H15R POP 96 1.140 14.290 36.510 1.00 0.00 ATOM 11947 H15S POP 96 2.160 15.440 35.490 1.00 0.00 ATOM 11948 6C21 POP 96 2.360 15.920 37.480 1.00 0.00 ATOM 11949 H16R POP 96 3.340 16.430 37.380 1.00 0.00 ATOM 11950 H16S POP 96 2.500 15.710 38.560 1.00 0.00 ATOM 11951 7C21 POP 96 1.360 17.080 37.350 1.00 0.00 ATOM 11952 H17R POP 96 1.390 17.420 38.400 1.00 0.00 ATOM 11953 H17S POP 96 0.380 16.700 37.000 1.00 0.00 ATOM 11954 8C21 POP 96 1.860 18.120 36.340 1.00 0.00 ATOM 11955 H18R POP 96 2.780 18.630 36.700 1.00 0.00 ATOM 11956 H18S POP 96 1.100 18.890 36.130 1.00 0.00 ATOM 11957 H18T POP 96 2.100 17.620 35.380 1.00 0.00 ATOM 11958 C33 POP 96 12.890 14.220 28.690 1.00 0.00 ATOM 11959 H3X POP 96 12.570 13.260 29.160 1.00 0.00 ATOM 11960 H3Y POP 96 12.040 14.920 28.840 1.00 0.00 ATOM 11961 C34 POP 96 14.110 14.680 29.490 1.00 0.00 ATOM 11962 H4X POP 96 14.600 15.550 29.000 1.00 0.00 ATOM 11963 H4Y POP 96 14.840 13.840 29.530 1.00 0.00 ATOM 11964 C35 POP 96 13.820 15.000 30.960 1.00 0.00 ATOM 11965 H5X POP 96 13.020 15.750 31.110 1.00 0.00 ATOM 11966 H5Y POP 96 14.840 15.310 31.280 1.00 0.00 ATOM 11967 C36 POP 96 13.460 13.720 31.720 1.00 0.00 ATOM 11968 H6X POP 96 14.310 13.010 31.760 1.00 0.00 ATOM 11969 H6Y POP 96 12.680 13.140 31.180 1.00 0.00 ATOM 11970 C37 POP 96 12.970 13.900 33.160 1.00 0.00 ATOM 11971 H7X POP 96 12.650 12.910 33.520 1.00 0.00 ATOM 11972 H7Y POP 96 12.050 14.520 33.260 1.00 0.00 ATOM 11973 C38 POP 96 14.000 14.450 34.150 1.00 0.00 ATOM 11974 H8X POP 96 14.040 15.540 33.950 1.00 0.00 ATOM 11975 H8Y POP 96 15.030 14.130 33.860 1.00 0.00 ATOM 11976 C39 POP 96 13.710 14.010 35.590 1.00 0.00 ATOM 11977 H9X POP 96 13.840 12.900 35.540 1.00 0.00 ATOM 11978 H9Y POP 96 12.740 14.330 36.020 1.00 0.00 ATOM 11979 0C31 POP 96 14.870 14.460 36.490 1.00 0.00 ATOM 11980 H10X POP 96 14.710 15.490 36.850 1.00 0.00 ATOM 11981 H10Y POP 96 15.810 14.510 35.900 1.00 0.00 ATOM 11982 1C31 POP 96 15.190 13.630 37.730 1.00 0.00 ATOM 11983 H11X POP 96 15.630 12.660 37.410 1.00 0.00 ATOM 11984 H11Y POP 96 14.260 13.420 38.300 1.00 0.00 ATOM 11985 2C31 POP 96 16.170 14.340 38.670 1.00 0.00 ATOM 11986 H12X POP 96 15.780 15.380 38.750 1.00 0.00 ATOM 11987 H12Y POP 96 17.160 14.420 38.180 1.00 0.00 ATOM 11988 3C31 POP 96 16.210 13.420 39.880 1.00 0.00 ATOM 11989 H13X POP 96 16.340 12.370 39.550 1.00 0.00 ATOM 11990 H13Y POP 96 15.240 13.520 40.430 1.00 0.00 ATOM 11991 4C31 POP 96 17.360 13.630 40.870 1.00 0.00 ATOM 11992 H14X POP 96 18.330 13.780 40.350 1.00 0.00 ATOM 11993 H14Y POP 96 17.500 12.710 41.480 1.00 0.00 ATOM 11994 5C31 POP 96 17.370 14.860 41.780 1.00 0.00 ATOM 11995 H15X POP 96 16.530 14.730 42.490 1.00 0.00 ATOM 11996 H15Y POP 96 17.280 15.810 41.210 1.00 0.00 ATOM 11997 6C31 POP 96 18.580 14.970 42.710 1.00 0.00 ATOM 11998 H16X POP 96 18.440 15.860 43.360 1.00 0.00 ATOM 11999 H16Y POP 96 19.550 15.110 42.180 1.00 0.00 ATOM 12000 H16Z POP 96 18.550 14.070 43.360 1.00 0.00 ATOM 12001 N POP 97 1.690 8.520 22.340 1.00 0.00 ATOM 12002 HN1 POP 97 1.280 9.320 22.860 1.00 0.00 ATOM 12003 HN2 POP 97 0.940 7.890 22.000 1.00 0.00 ATOM 12004 HN3 POP 97 2.240 7.870 22.930 1.00 0.00 ATOM 12005 C12 POP 97 2.560 9.020 21.210 1.00 0.00 ATOM 12006 H12A POP 97 1.940 9.740 20.640 1.00 0.00 ATOM 12007 H12B POP 97 2.670 8.150 20.540 1.00 0.00 ATOM 12008 C11 POP 97 3.880 9.590 21.730 1.00 0.00 ATOM 12009 H11A POP 97 4.530 9.730 20.830 1.00 0.00 ATOM 12010 H11B POP 97 4.360 8.840 22.400 1.00 0.00 ATOM 12011 P POP 97 5.020 11.540 22.910 1.00 0.00 ATOM 12012 O13 POP 97 4.730 12.990 23.010 1.00 0.00 ATOM 12013 O14 POP 97 6.110 11.140 21.980 1.00 0.00 ATOM 12014 O11 POP 97 5.260 10.800 24.310 1.00 0.00 ATOM 12015 O12 POP 97 3.680 10.810 22.450 1.00 0.00 ATOM 12016 C1 POP 97 4.410 11.130 25.410 1.00 0.00 ATOM 12017 HA POP 97 4.450 10.240 26.080 1.00 0.00 ATOM 12018 HB POP 97 3.360 11.240 25.100 1.00 0.00 ATOM 12019 C2 POP 97 4.800 12.390 26.200 1.00 0.00 ATOM 12020 HS POP 97 4.970 13.210 25.470 1.00 0.00 ATOM 12021 O21 POP 97 5.990 12.220 26.980 1.00 0.00 ATOM 12022 C21 POP 97 6.520 13.390 27.330 1.00 0.00 ATOM 12023 O22 POP 97 6.100 14.510 27.100 1.00 0.00 ATOM 12024 C22 POP 97 7.750 13.150 28.200 1.00 0.00 ATOM 12025 H2R POP 97 8.520 13.800 27.720 1.00 0.00 ATOM 12026 H2S POP 97 8.130 12.110 28.080 1.00 0.00 ATOM 12027 C3 POP 97 3.560 12.790 27.010 1.00 0.00 ATOM 12028 HX POP 97 2.660 12.580 26.400 1.00 0.00 ATOM 12029 HY POP 97 3.660 13.880 27.230 1.00 0.00 ATOM 12030 O31 POP 97 3.460 12.090 28.250 1.00 0.00 ATOM 12031 C31 POP 97 2.360 12.400 28.940 1.00 0.00 ATOM 12032 O32 POP 97 1.560 13.250 28.580 1.00 0.00 ATOM 12033 C32 POP 97 2.170 11.600 30.220 1.00 0.00 ATOM 12034 H2X POP 97 3.130 11.070 30.360 1.00 0.00 ATOM 12035 H2Y POP 97 1.390 10.850 29.950 1.00 0.00 ATOM 12036 C23 POP 97 7.360 13.360 29.660 1.00 0.00 ATOM 12037 H3R POP 97 6.640 12.550 29.920 1.00 0.00 ATOM 12038 H3S POP 97 6.770 14.280 29.860 1.00 0.00 ATOM 12039 C24 POP 97 8.490 13.230 30.690 1.00 0.00 ATOM 12040 H4R POP 97 9.220 14.030 30.450 1.00 0.00 ATOM 12041 H4S POP 97 8.980 12.250 30.470 1.00 0.00 ATOM 12042 C25 POP 97 8.030 13.300 32.140 1.00 0.00 ATOM 12043 H5R POP 97 7.190 12.570 32.200 1.00 0.00 ATOM 12044 H5S POP 97 7.640 14.350 32.220 1.00 0.00 ATOM 12045 C26 POP 97 9.080 13.190 33.240 1.00 0.00 ATOM 12046 H6R POP 97 9.730 14.090 33.190 1.00 0.00 ATOM 12047 H6S POP 97 9.680 12.260 33.100 1.00 0.00 ATOM 12048 C27 POP 97 8.530 13.090 34.670 1.00 0.00 ATOM 12049 H7R POP 97 8.320 12.030 34.930 1.00 0.00 ATOM 12050 H7S POP 97 7.610 13.700 34.720 1.00 0.00 ATOM 12051 C28 POP 97 9.520 13.590 35.720 1.00 0.00 ATOM 12052 H8R POP 97 9.850 14.610 35.420 1.00 0.00 ATOM 12053 H8S POP 97 10.440 12.960 35.800 1.00 0.00 ATOM 12054 C29 POP 97 8.910 13.890 37.060 1.00 0.00 ATOM 12055 H91 POP 97 8.200 14.720 37.090 1.00 0.00 ATOM 12056 0C21 POP 97 9.390 13.290 38.160 1.00 0.00 ATOM 12057 1H10 POP 97 9.100 13.710 39.130 1.00 0.00 ATOM 12058 1C21 POP 97 10.470 12.250 38.290 1.00 0.00 ATOM 12059 H11R POP 97 11.360 12.380 37.640 1.00 0.00 ATOM 12060 H11S POP 97 10.020 11.330 37.880 1.00 0.00 ATOM 12061 2C21 POP 97 10.910 11.860 39.700 1.00 0.00 ATOM 12062 H12R POP 97 11.590 10.980 39.710 1.00 0.00 ATOM 12063 H12S POP 97 10.070 11.580 40.380 1.00 0.00 ATOM 12064 3C21 POP 97 11.660 13.060 40.280 1.00 0.00 ATOM 12065 H13R POP 97 11.000 13.950 40.280 1.00 0.00 ATOM 12066 H13S POP 97 12.580 13.260 39.690 1.00 0.00 ATOM 12067 4C21 POP 97 11.990 12.830 41.760 1.00 0.00 ATOM 12068 H14R POP 97 11.100 12.590 42.380 1.00 0.00 ATOM 12069 H14S POP 97 12.330 13.810 42.150 1.00 0.00 ATOM 12070 5C21 POP 97 13.140 11.830 41.890 1.00 0.00 ATOM 12071 H15R POP 97 13.810 11.870 41.010 1.00 0.00 ATOM 12072 H15S POP 97 12.740 10.800 42.000 1.00 0.00 ATOM 12073 6C21 POP 97 13.990 12.090 43.130 1.00 0.00 ATOM 12074 H16R POP 97 13.360 12.150 44.050 1.00 0.00 ATOM 12075 H16S POP 97 14.370 13.130 43.110 1.00 0.00 ATOM 12076 7C21 POP 97 15.090 11.040 43.340 1.00 0.00 ATOM 12077 H17R POP 97 15.720 11.100 42.430 1.00 0.00 ATOM 12078 H17S POP 97 14.640 10.030 43.480 1.00 0.00 ATOM 12079 8C21 POP 97 15.940 11.440 44.550 1.00 0.00 ATOM 12080 H18R POP 97 16.660 12.280 44.440 1.00 0.00 ATOM 12081 H18S POP 97 16.600 10.590 44.810 1.00 0.00 ATOM 12082 H18T POP 97 15.380 11.580 45.500 1.00 0.00 ATOM 12083 C33 POP 97 1.780 12.510 31.390 1.00 0.00 ATOM 12084 H3X POP 97 1.290 13.460 31.120 1.00 0.00 ATOM 12085 H3Y POP 97 2.630 12.870 32.010 1.00 0.00 ATOM 12086 C34 POP 97 0.750 12.010 32.390 1.00 0.00 ATOM 12087 H4X POP 97 1.250 11.280 33.060 1.00 0.00 ATOM 12088 H4Y POP 97 -0.150 11.570 31.910 1.00 0.00 ATOM 12089 C35 POP 97 0.120 13.130 33.240 1.00 0.00 ATOM 12090 H5X POP 97 -0.710 13.550 32.630 1.00 0.00 ATOM 12091 H5Y POP 97 0.770 13.990 33.500 1.00 0.00 ATOM 12092 C36 POP 97 -0.710 12.750 34.460 1.00 0.00 ATOM 12093 H6X POP 97 0.000 12.650 35.310 1.00 0.00 ATOM 12094 H6Y POP 97 -1.170 11.760 34.230 1.00 0.00 ATOM 12095 C37 POP 97 -1.820 13.750 34.810 1.00 0.00 ATOM 12096 H7X POP 97 -2.650 13.570 34.100 1.00 0.00 ATOM 12097 H7Y POP 97 -1.400 14.760 34.630 1.00 0.00 ATOM 12098 C38 POP 97 -2.330 13.580 36.250 1.00 0.00 ATOM 12099 H8X POP 97 -1.450 13.780 36.890 1.00 0.00 ATOM 12100 H8Y POP 97 -2.560 12.490 36.210 1.00 0.00 ATOM 12101 C39 POP 97 -3.510 14.420 36.730 1.00 0.00 ATOM 12102 H9X POP 97 -3.740 14.060 37.760 1.00 0.00 ATOM 12103 H9Y POP 97 -4.470 14.310 36.180 1.00 0.00 ATOM 12104 0C31 POP 97 -3.240 15.920 36.710 1.00 0.00 ATOM 12105 H10X POP 97 -3.390 16.140 35.630 1.00 0.00 ATOM 12106 H10Y POP 97 -2.260 16.160 37.180 1.00 0.00 ATOM 12107 1C31 POP 97 -4.340 16.750 37.390 1.00 0.00 ATOM 12108 H11X POP 97 -4.360 16.390 38.440 1.00 0.00 ATOM 12109 H11Y POP 97 -5.310 16.340 37.020 1.00 0.00 ATOM 12110 2C31 POP 97 -4.220 18.270 37.320 1.00 0.00 ATOM 12111 H12X POP 97 -5.190 18.700 37.650 1.00 0.00 ATOM 12112 H12Y POP 97 -4.060 18.430 36.230 1.00 0.00 ATOM 12113 3C31 POP 97 -3.160 18.930 38.190 1.00 0.00 ATOM 12114 H13X POP 97 -2.210 18.370 38.030 1.00 0.00 ATOM 12115 H13Y POP 97 -3.440 18.890 39.270 1.00 0.00 ATOM 12116 4C31 POP 97 -2.810 20.370 37.810 1.00 0.00 ATOM 12117 H14X POP 97 -3.600 21.130 38.030 1.00 0.00 ATOM 12118 H14Y POP 97 -2.690 20.390 36.710 1.00 0.00 ATOM 12119 5C31 POP 97 -1.490 20.690 38.500 1.00 0.00 ATOM 12120 H15X POP 97 -0.650 20.010 38.240 1.00 0.00 ATOM 12121 H15Y POP 97 -1.690 20.870 39.580 1.00 0.00 ATOM 12122 6C31 POP 97 -0.930 22.030 38.030 1.00 0.00 ATOM 12123 H16X POP 97 0.080 22.160 38.460 1.00 0.00 ATOM 12124 H16Y POP 97 -1.540 22.830 38.520 1.00 0.00 ATOM 12125 H16Z POP 97 -0.920 22.230 36.940 1.00 0.00 ATOM 12126 N POP 98 43.390 20.720 26.140 1.00 0.00 ATOM 12127 HN1 POP 98 44.230 20.480 25.580 1.00 0.00 ATOM 12128 HN2 POP 98 42.610 21.130 25.590 1.00 0.00 ATOM 12129 HN3 POP 98 43.690 21.440 26.830 1.00 0.00 ATOM 12130 C12 POP 98 42.900 19.650 27.080 1.00 0.00 ATOM 12131 H12A POP 98 43.470 19.860 28.010 1.00 0.00 ATOM 12132 H12B POP 98 43.170 18.650 26.670 1.00 0.00 ATOM 12133 C11 POP 98 41.390 19.690 27.340 1.00 0.00 ATOM 12134 H11A POP 98 41.100 20.690 27.730 1.00 0.00 ATOM 12135 H11B POP 98 41.160 18.910 28.100 1.00 0.00 ATOM 12136 P POP 98 39.170 19.590 26.060 1.00 0.00 ATOM 12137 O13 POP 98 38.620 18.700 25.020 1.00 0.00 ATOM 12138 O14 POP 98 38.870 21.030 25.930 1.00 0.00 ATOM 12139 O11 POP 98 38.530 19.010 27.410 1.00 0.00 ATOM 12140 O12 POP 98 40.770 19.480 26.080 1.00 0.00 ATOM 12141 C1 POP 98 38.930 17.770 28.010 1.00 0.00 ATOM 12142 HA POP 98 38.940 17.950 29.100 1.00 0.00 ATOM 12143 HB POP 98 39.890 17.290 27.710 1.00 0.00 ATOM 12144 C2 POP 98 37.960 16.610 27.710 1.00 0.00 ATOM 12145 HS POP 98 38.000 16.440 26.610 1.00 0.00 ATOM 12146 O21 POP 98 36.640 16.990 28.100 1.00 0.00 ATOM 12147 C21 POP 98 35.700 16.300 27.450 1.00 0.00 ATOM 12148 O22 POP 98 35.850 15.480 26.560 1.00 0.00 ATOM 12149 C22 POP 98 34.350 16.670 28.020 1.00 0.00 ATOM 12150 H2R POP 98 33.640 16.660 27.170 1.00 0.00 ATOM 12151 H2S POP 98 34.340 17.700 28.450 1.00 0.00 ATOM 12152 C3 POP 98 38.500 15.320 28.360 1.00 0.00 ATOM 12153 HX POP 98 39.580 15.270 28.110 1.00 0.00 ATOM 12154 HY POP 98 37.940 14.500 27.860 1.00 0.00 ATOM 12155 O31 POP 98 38.300 15.350 29.780 1.00 0.00 ATOM 12156 C31 POP 98 38.740 14.230 30.350 1.00 0.00 ATOM 12157 O32 POP 98 39.150 13.230 29.780 1.00 0.00 ATOM 12158 C32 POP 98 38.790 14.390 31.870 1.00 0.00 ATOM 12159 H2X POP 98 37.850 14.860 32.230 1.00 0.00 ATOM 12160 H2Y POP 98 39.650 15.000 32.210 1.00 0.00 ATOM 12161 C23 POP 98 33.920 15.650 29.080 1.00 0.00 ATOM 12162 H3R POP 98 34.080 14.710 28.520 1.00 0.00 ATOM 12163 H3S POP 98 32.820 15.750 29.180 1.00 0.00 ATOM 12164 C24 POP 98 34.600 15.790 30.450 1.00 0.00 ATOM 12165 H4R POP 98 34.290 16.710 30.990 1.00 0.00 ATOM 12166 H4S POP 98 35.710 15.850 30.330 1.00 0.00 ATOM 12167 C25 POP 98 34.120 14.560 31.220 1.00 0.00 ATOM 12168 H5R POP 98 34.630 13.650 30.840 1.00 0.00 ATOM 12169 H5S POP 98 33.020 14.440 31.200 1.00 0.00 ATOM 12170 C26 POP 98 34.470 14.560 32.710 1.00 0.00 ATOM 12171 H6R POP 98 35.550 14.300 32.700 1.00 0.00 ATOM 12172 H6S POP 98 33.980 13.700 33.210 1.00 0.00 ATOM 12173 C27 POP 98 34.240 15.770 33.630 1.00 0.00 ATOM 12174 H7R POP 98 34.950 16.560 33.320 1.00 0.00 ATOM 12175 H7S POP 98 34.480 15.530 34.690 1.00 0.00 ATOM 12176 C28 POP 98 32.890 16.440 33.380 1.00 0.00 ATOM 12177 H8R POP 98 32.700 16.550 32.290 1.00 0.00 ATOM 12178 H8S POP 98 32.980 17.430 33.880 1.00 0.00 ATOM 12179 C29 POP 98 31.770 15.660 34.010 1.00 0.00 ATOM 12180 H91 POP 98 31.100 15.030 33.400 1.00 0.00 ATOM 12181 0C21 POP 98 31.320 15.840 35.260 1.00 0.00 ATOM 12182 1H10 POP 98 30.420 15.260 35.520 1.00 0.00 ATOM 12183 1C21 POP 98 31.960 16.730 36.280 1.00 0.00 ATOM 12184 H11R POP 98 32.480 17.640 35.900 1.00 0.00 ATOM 12185 H11S POP 98 32.670 16.060 36.820 1.00 0.00 ATOM 12186 2C21 POP 98 30.920 17.280 37.270 1.00 0.00 ATOM 12187 H12R POP 98 30.230 16.480 37.600 1.00 0.00 ATOM 12188 H12S POP 98 30.290 18.040 36.740 1.00 0.00 ATOM 12189 3C21 POP 98 31.550 17.950 38.490 1.00 0.00 ATOM 12190 H13R POP 98 30.790 18.510 39.070 1.00 0.00 ATOM 12191 H13S POP 98 32.370 18.590 38.120 1.00 0.00 ATOM 12192 4C21 POP 98 32.120 16.950 39.500 1.00 0.00 ATOM 12193 H14R POP 98 33.040 16.430 39.160 1.00 0.00 ATOM 12194 H14S POP 98 31.310 16.230 39.750 1.00 0.00 ATOM 12195 5C21 POP 98 32.440 17.580 40.850 1.00 0.00 ATOM 12196 H15R POP 98 31.570 18.200 41.170 1.00 0.00 ATOM 12197 H15S POP 98 33.220 18.340 40.630 1.00 0.00 ATOM 12198 6C21 POP 98 33.060 16.610 41.870 1.00 0.00 ATOM 12199 H16R POP 98 32.550 15.620 41.880 1.00 0.00 ATOM 12200 H16S POP 98 32.910 17.080 42.870 1.00 0.00 ATOM 12201 7C21 POP 98 34.560 16.400 41.640 1.00 0.00 ATOM 12202 H17R POP 98 34.680 16.030 40.610 1.00 0.00 ATOM 12203 H17S POP 98 34.990 15.580 42.250 1.00 0.00 ATOM 12204 8C21 POP 98 35.380 17.660 41.910 1.00 0.00 ATOM 12205 H18R POP 98 36.450 17.400 41.740 1.00 0.00 ATOM 12206 H18S POP 98 35.350 17.930 42.990 1.00 0.00 ATOM 12207 H18T POP 98 34.980 18.610 41.490 1.00 0.00 ATOM 12208 C33 POP 98 38.890 13.000 32.490 1.00 0.00 ATOM 12209 H3X POP 98 39.760 12.520 32.000 1.00 0.00 ATOM 12210 H3Y POP 98 37.930 12.490 32.250 1.00 0.00 ATOM 12211 C34 POP 98 39.160 13.000 34.000 1.00 0.00 ATOM 12212 H4X POP 98 39.950 13.740 34.230 1.00 0.00 ATOM 12213 H4Y POP 98 39.500 12.020 34.410 1.00 0.00 ATOM 12214 C35 POP 98 37.760 13.240 34.560 1.00 0.00 ATOM 12215 H5X POP 98 37.100 12.410 34.210 1.00 0.00 ATOM 12216 H5Y POP 98 37.410 14.250 34.260 1.00 0.00 ATOM 12217 C36 POP 98 37.720 13.230 36.090 1.00 0.00 ATOM 12218 H6X POP 98 38.290 14.070 36.550 1.00 0.00 ATOM 12219 H6Y POP 98 38.100 12.210 36.300 1.00 0.00 ATOM 12220 C37 POP 98 36.320 13.380 36.690 1.00 0.00 ATOM 12221 H7X POP 98 35.830 12.440 36.350 1.00 0.00 ATOM 12222 H7Y POP 98 35.700 14.210 36.270 1.00 0.00 ATOM 12223 C38 POP 98 36.400 13.460 38.210 1.00 0.00 ATOM 12224 H8X POP 98 37.080 14.280 38.520 1.00 0.00 ATOM 12225 H8Y POP 98 36.850 12.490 38.510 1.00 0.00 ATOM 12226 C39 POP 98 34.990 13.740 38.730 1.00 0.00 ATOM 12227 H9X POP 98 34.670 14.730 38.330 1.00 0.00 ATOM 12228 H9Y POP 98 35.190 13.850 39.810 1.00 0.00 ATOM 12229 0C31 POP 98 33.960 12.650 38.430 1.00 0.00 ATOM 12230 H10X POP 98 34.390 11.630 38.510 1.00 0.00 ATOM 12231 H10Y POP 98 33.730 12.800 37.350 1.00 0.00 ATOM 12232 1C31 POP 98 32.600 12.700 39.130 1.00 0.00 ATOM 12233 H11X POP 98 31.940 11.900 38.730 1.00 0.00 ATOM 12234 H11Y POP 98 32.220 13.720 38.940 1.00 0.00 ATOM 12235 2C31 POP 98 32.640 12.380 40.620 1.00 0.00 ATOM 12236 H12X POP 98 31.760 12.890 41.070 1.00 0.00 ATOM 12237 H12Y POP 98 33.510 12.800 41.170 1.00 0.00 ATOM 12238 3C31 POP 98 32.820 10.930 41.060 1.00 0.00 ATOM 12239 H13X POP 98 33.500 10.340 40.420 1.00 0.00 ATOM 12240 H13Y POP 98 31.820 10.460 40.960 1.00 0.00 ATOM 12241 4C31 POP 98 33.240 10.870 42.530 1.00 0.00 ATOM 12242 H14X POP 98 32.590 11.470 43.190 1.00 0.00 ATOM 12243 H14Y POP 98 34.310 11.160 42.640 1.00 0.00 ATOM 12244 5C31 POP 98 33.180 9.460 43.120 1.00 0.00 ATOM 12245 H15X POP 98 32.120 9.140 42.980 1.00 0.00 ATOM 12246 H15Y POP 98 33.400 9.550 44.210 1.00 0.00 ATOM 12247 6C31 POP 98 34.100 8.360 42.580 1.00 0.00 ATOM 12248 H16X POP 98 35.180 8.520 42.800 1.00 0.00 ATOM 12249 H16Y POP 98 33.750 7.420 43.060 1.00 0.00 ATOM 12250 H16Z POP 98 34.000 8.350 41.480 1.00 0.00 ATOM 12251 N POP 99 9.030 28.400 23.820 1.00 0.00 ATOM 12252 HN1 POP 99 9.710 28.360 23.040 1.00 0.00 ATOM 12253 HN2 POP 99 8.860 27.400 24.050 1.00 0.00 ATOM 12254 HN3 POP 99 8.140 28.730 23.390 1.00 0.00 ATOM 12255 C12 POP 99 9.560 29.210 24.980 1.00 0.00 ATOM 12256 H12A POP 99 10.650 29.060 25.100 1.00 0.00 ATOM 12257 H12B POP 99 9.170 28.660 25.860 1.00 0.00 ATOM 12258 C11 POP 99 9.040 30.650 24.980 1.00 0.00 ATOM 12259 H11A POP 99 9.380 31.110 25.940 1.00 0.00 ATOM 12260 H11B POP 99 7.940 30.540 24.900 1.00 0.00 ATOM 12261 P POP 99 10.330 32.670 23.930 1.00 0.00 ATOM 12262 O13 POP 99 10.100 33.360 22.640 1.00 0.00 ATOM 12263 O14 POP 99 11.740 32.320 24.220 1.00 0.00 ATOM 12264 O11 POP 99 9.570 33.470 25.100 1.00 0.00 ATOM 12265 O12 POP 99 9.500 31.310 23.800 1.00 0.00 ATOM 12266 C1 POP 99 10.120 34.690 25.590 1.00 0.00 ATOM 12267 HA POP 99 9.300 35.190 26.150 1.00 0.00 ATOM 12268 HB POP 99 10.400 35.350 24.740 1.00 0.00 ATOM 12269 C2 POP 99 11.360 34.400 26.450 1.00 0.00 ATOM 12270 HS POP 99 12.180 34.070 25.780 1.00 0.00 ATOM 12271 O21 POP 99 11.060 33.440 27.470 1.00 0.00 ATOM 12272 C21 POP 99 12.150 32.840 27.960 1.00 0.00 ATOM 12273 O22 POP 99 13.240 32.880 27.420 1.00 0.00 ATOM 12274 C22 POP 99 11.790 32.020 29.190 1.00 0.00 ATOM 12275 H2R POP 99 10.920 31.400 28.930 1.00 0.00 ATOM 12276 H2S POP 99 11.450 32.710 30.000 1.00 0.00 ATOM 12277 C3 POP 99 11.860 35.710 27.090 1.00 0.00 ATOM 12278 HX POP 99 12.090 36.430 26.270 1.00 0.00 ATOM 12279 HY POP 99 12.890 35.500 27.460 1.00 0.00 ATOM 12280 O31 POP 99 11.000 36.290 28.070 1.00 0.00 ATOM 12281 C31 POP 99 11.270 35.940 29.330 1.00 0.00 ATOM 12282 O32 POP 99 12.280 35.320 29.640 1.00 0.00 ATOM 12283 C32 POP 99 10.190 36.500 30.250 1.00 0.00 ATOM 12284 H2X POP 99 9.140 36.300 29.930 1.00 0.00 ATOM 12285 H2Y POP 99 10.220 37.610 30.220 1.00 0.00 ATOM 12286 C23 POP 99 13.000 31.260 29.760 1.00 0.00 ATOM 12287 H3R POP 99 13.710 32.000 30.180 1.00 0.00 ATOM 12288 H3S POP 99 13.610 30.750 28.990 1.00 0.00 ATOM 12289 C24 POP 99 12.620 30.350 30.930 1.00 0.00 ATOM 12290 H4R POP 99 13.560 29.980 31.390 1.00 0.00 ATOM 12291 H4S POP 99 12.060 29.500 30.490 1.00 0.00 ATOM 12292 C25 POP 99 11.810 31.010 32.040 1.00 0.00 ATOM 12293 H5R POP 99 11.580 30.310 32.880 1.00 0.00 ATOM 12294 H5S POP 99 10.840 31.290 31.570 1.00 0.00 ATOM 12295 C26 POP 99 12.440 32.260 32.670 1.00 0.00 ATOM 12296 H6R POP 99 12.620 32.990 31.860 1.00 0.00 ATOM 12297 H6S POP 99 13.450 31.940 32.990 1.00 0.00 ATOM 12298 C27 POP 99 11.780 32.650 33.990 1.00 0.00 ATOM 12299 H7R POP 99 10.790 33.130 33.810 1.00 0.00 ATOM 12300 H7S POP 99 12.400 33.490 34.370 1.00 0.00 ATOM 12301 C28 POP 99 11.740 31.580 35.070 1.00 0.00 ATOM 12302 H8R POP 99 12.820 31.320 35.100 1.00 0.00 ATOM 12303 H8S POP 99 11.120 30.690 34.840 1.00 0.00 ATOM 12304 C29 POP 99 11.300 32.260 36.330 1.00 0.00 ATOM 12305 H91 POP 99 10.210 32.410 36.360 1.00 0.00 ATOM 12306 0C21 POP 99 12.090 32.870 37.230 1.00 0.00 ATOM 12307 1H10 POP 99 11.590 33.210 38.150 1.00 0.00 ATOM 12308 1C21 POP 99 13.580 32.780 37.390 1.00 0.00 ATOM 12309 H11R POP 99 14.030 33.720 37.010 1.00 0.00 ATOM 12310 H11S POP 99 14.120 32.070 36.720 1.00 0.00 ATOM 12311 2C21 POP 99 13.990 32.530 38.840 1.00 0.00 ATOM 12312 H12R POP 99 13.470 33.300 39.450 1.00 0.00 ATOM 12313 H12S POP 99 15.070 32.650 39.040 1.00 0.00 ATOM 12314 3C21 POP 99 13.530 31.160 39.360 1.00 0.00 ATOM 12315 H13R POP 99 14.150 30.380 38.870 1.00 0.00 ATOM 12316 H13S POP 99 12.500 30.820 39.130 1.00 0.00 ATOM 12317 4C21 POP 99 13.630 31.160 40.890 1.00 0.00 ATOM 12318 H14R POP 99 14.660 31.360 41.250 1.00 0.00 ATOM 12319 H14S POP 99 13.390 30.130 41.220 1.00 0.00 ATOM 12320 5C21 POP 99 12.570 32.050 41.540 1.00 0.00 ATOM 12321 H15R POP 99 11.570 31.790 41.120 1.00 0.00 ATOM 12322 H15S POP 99 12.760 33.120 41.340 1.00 0.00 ATOM 12323 6C21 POP 99 12.620 31.850 43.050 1.00 0.00 ATOM 12324 H16R POP 99 13.670 31.960 43.410 1.00 0.00 ATOM 12325 H16S POP 99 12.250 30.850 43.370 1.00 0.00 ATOM 12326 7C21 POP 99 11.830 33.010 43.660 1.00 0.00 ATOM 12327 H17R POP 99 10.750 33.030 43.380 1.00 0.00 ATOM 12328 H17S POP 99 12.300 33.890 43.170 1.00 0.00 ATOM 12329 8C21 POP 99 11.920 33.100 45.180 1.00 0.00 ATOM 12330 H18R POP 99 11.250 33.900 45.540 1.00 0.00 ATOM 12331 H18S POP 99 13.010 33.250 45.370 1.00 0.00 ATOM 12332 H18T POP 99 11.630 32.100 45.590 1.00 0.00 ATOM 12333 C33 POP 99 10.540 36.190 31.700 1.00 0.00 ATOM 12334 H3X POP 99 11.620 36.400 31.830 1.00 0.00 ATOM 12335 H3Y POP 99 10.550 35.090 31.870 1.00 0.00 ATOM 12336 C34 POP 99 9.550 36.810 32.690 1.00 0.00 ATOM 12337 H4X POP 99 8.560 36.900 32.190 1.00 0.00 ATOM 12338 H4Y POP 99 9.610 37.820 33.140 1.00 0.00 ATOM 12339 C35 POP 99 9.360 35.970 33.960 1.00 0.00 ATOM 12340 H5X POP 99 9.310 36.720 34.780 1.00 0.00 ATOM 12341 H5Y POP 99 10.270 35.440 34.300 1.00 0.00 ATOM 12342 C36 POP 99 8.210 34.970 34.120 1.00 0.00 ATOM 12343 H6X POP 99 8.590 34.100 33.530 1.00 0.00 ATOM 12344 H6Y POP 99 7.220 35.250 33.700 1.00 0.00 ATOM 12345 C37 POP 99 7.970 34.490 35.550 1.00 0.00 ATOM 12346 H7X POP 99 8.860 34.010 36.000 1.00 0.00 ATOM 12347 H7Y POP 99 7.190 33.710 35.410 1.00 0.00 ATOM 12348 C38 POP 99 7.320 35.520 36.470 1.00 0.00 ATOM 12349 H8X POP 99 6.520 35.910 35.810 1.00 0.00 ATOM 12350 H8Y POP 99 8.110 36.300 36.600 1.00 0.00 ATOM 12351 C39 POP 99 6.740 35.050 37.810 1.00 0.00 ATOM 12352 H9X POP 99 7.510 34.360 38.210 1.00 0.00 ATOM 12353 H9Y POP 99 5.790 34.550 37.550 1.00 0.00 ATOM 12354 0C31 POP 99 6.480 36.200 38.790 1.00 0.00 ATOM 12355 H10X POP 99 7.420 36.790 38.800 1.00 0.00 ATOM 12356 H10Y POP 99 6.280 35.810 39.820 1.00 0.00 ATOM 12357 1C31 POP 99 5.260 37.060 38.470 1.00 0.00 ATOM 12358 H11X POP 99 4.400 36.360 38.400 1.00 0.00 ATOM 12359 H11Y POP 99 5.390 37.620 37.520 1.00 0.00 ATOM 12360 2C31 POP 99 4.950 38.080 39.570 1.00 0.00 ATOM 12361 H12X POP 99 4.200 38.830 39.240 1.00 0.00 ATOM 12362 H12Y POP 99 5.900 38.540 39.940 1.00 0.00 ATOM 12363 3C31 POP 99 4.490 37.490 40.900 1.00 0.00 ATOM 12364 H13X POP 99 5.050 36.560 41.110 1.00 0.00 ATOM 12365 H13Y POP 99 3.470 37.100 40.730 1.00 0.00 ATOM 12366 4C31 POP 99 4.560 38.470 42.080 1.00 0.00 ATOM 12367 H14X POP 99 4.020 39.370 41.730 1.00 0.00 ATOM 12368 H14Y POP 99 5.630 38.700 42.240 1.00 0.00 ATOM 12369 5C31 POP 99 4.050 37.900 43.410 1.00 0.00 ATOM 12370 H15X POP 99 4.450 36.870 43.470 1.00 0.00 ATOM 12371 H15Y POP 99 2.950 37.950 43.250 1.00 0.00 ATOM 12372 6C31 POP 99 4.620 38.650 44.610 1.00 0.00 ATOM 12373 H16X POP 99 5.680 38.830 44.370 1.00 0.00 ATOM 12374 H16Y POP 99 4.570 37.980 45.500 1.00 0.00 ATOM 12375 H16Z POP 99 4.060 39.610 44.710 1.00 0.00 ATOM 12376 N POP 100 47.670 25.270 27.180 1.00 0.00 ATOM 12377 HN1 POP 100 46.940 25.050 27.880 1.00 0.00 ATOM 12378 HN2 POP 100 47.190 25.720 26.380 1.00 0.00 ATOM 12379 HN3 POP 100 48.050 24.380 26.800 1.00 0.00 ATOM 12380 C12 POP 100 48.720 26.210 27.720 1.00 0.00 ATOM 12381 H12A POP 100 48.840 26.090 28.820 1.00 0.00 ATOM 12382 H12B POP 100 48.340 27.250 27.570 1.00 0.00 ATOM 12383 C11 POP 100 49.980 26.020 26.870 1.00 0.00 ATOM 12384 H11A POP 100 50.800 26.720 27.130 1.00 0.00 ATOM 12385 H11B POP 100 49.760 26.240 25.800 1.00 0.00 ATOM 12386 P POP 100 52.110 24.610 26.860 1.00 0.00 ATOM 12387 O13 POP 100 52.410 23.170 26.720 1.00 0.00 ATOM 12388 O14 POP 100 52.610 25.660 25.940 1.00 0.00 ATOM 12389 O11 POP 100 52.560 25.040 28.340 1.00 0.00 ATOM 12390 O12 POP 100 50.520 24.690 26.940 1.00 0.00 ATOM 12391 C1 POP 100 53.890 25.550 28.480 1.00 0.00 ATOM 12392 HA POP 100 53.960 25.830 29.550 1.00 0.00 ATOM 12393 HB POP 100 54.080 26.510 27.960 1.00 0.00 ATOM 12394 C2 POP 100 54.980 24.500 28.200 1.00 0.00 ATOM 12395 HS POP 100 55.000 24.280 27.110 1.00 0.00 ATOM 12396 O21 POP 100 54.830 23.290 28.940 1.00 0.00 ATOM 12397 C21 POP 100 55.320 22.200 28.350 1.00 0.00 ATOM 12398 O22 POP 100 55.970 22.120 27.320 1.00 0.00 ATOM 12399 C22 POP 100 55.030 20.940 29.150 1.00 0.00 ATOM 12400 H2R POP 100 55.480 20.070 28.620 1.00 0.00 ATOM 12401 H2S POP 100 53.950 20.680 29.250 1.00 0.00 ATOM 12402 C3 POP 100 56.380 25.040 28.510 1.00 0.00 ATOM 12403 HX POP 100 56.470 25.950 27.880 1.00 0.00 ATOM 12404 HY POP 100 57.200 24.360 28.200 1.00 0.00 ATOM 12405 O31 POP 100 56.370 25.360 29.910 1.00 0.00 ATOM 12406 C31 POP 100 56.260 26.640 30.270 1.00 0.00 ATOM 12407 O32 POP 100 56.090 27.580 29.510 1.00 0.00 ATOM 12408 C32 POP 100 56.110 26.740 31.780 1.00 0.00 ATOM 12409 H2X POP 100 55.350 25.980 32.090 1.00 0.00 ATOM 12410 H2Y POP 100 55.730 27.740 32.060 1.00 0.00 ATOM 12411 C23 POP 100 55.550 21.100 30.580 1.00 0.00 ATOM 12412 H3R POP 100 55.240 22.060 31.050 1.00 0.00 ATOM 12413 H3S POP 100 56.660 21.130 30.560 1.00 0.00 ATOM 12414 C24 POP 100 55.120 20.040 31.590 1.00 0.00 ATOM 12415 H4R POP 100 55.600 19.090 31.260 1.00 0.00 ATOM 12416 H4S POP 100 54.010 19.990 31.570 1.00 0.00 ATOM 12417 C25 POP 100 55.720 20.090 32.990 1.00 0.00 ATOM 12418 H5R POP 100 55.310 21.020 33.420 1.00 0.00 ATOM 12419 H5S POP 100 56.810 20.280 32.970 1.00 0.00 ATOM 12420 C26 POP 100 55.380 19.040 34.060 1.00 0.00 ATOM 12421 H6R POP 100 55.800 19.370 35.030 1.00 0.00 ATOM 12422 H6S POP 100 55.780 18.020 33.860 1.00 0.00 ATOM 12423 C27 POP 100 53.870 18.920 34.280 1.00 0.00 ATOM 12424 H7R POP 100 53.450 18.410 33.400 1.00 0.00 ATOM 12425 H7S POP 100 53.390 19.890 34.530 1.00 0.00 ATOM 12426 C28 POP 100 53.560 18.030 35.480 1.00 0.00 ATOM 12427 H8R POP 100 54.160 17.110 35.650 1.00 0.00 ATOM 12428 H8S POP 100 52.490 17.730 35.420 1.00 0.00 ATOM 12429 C29 POP 100 53.720 18.940 36.660 1.00 0.00 ATOM 12430 H91 POP 100 53.990 19.990 36.460 1.00 0.00 ATOM 12431 0C21 POP 100 53.380 18.600 37.910 1.00 0.00 ATOM 12432 1H10 POP 100 53.530 19.290 38.760 1.00 0.00 ATOM 12433 1C21 POP 100 52.890 17.240 38.310 1.00 0.00 ATOM 12434 H11R POP 100 53.220 16.370 37.700 1.00 0.00 ATOM 12435 H11S POP 100 51.800 17.370 38.170 1.00 0.00 ATOM 12436 2C21 POP 100 52.960 16.920 39.810 1.00 0.00 ATOM 12437 H12R POP 100 52.380 16.010 40.060 1.00 0.00 ATOM 12438 H12S POP 100 52.510 17.780 40.360 1.00 0.00 ATOM 12439 3C21 POP 100 54.400 16.710 40.280 1.00 0.00 ATOM 12440 H13R POP 100 55.050 17.530 39.920 1.00 0.00 ATOM 12441 H13S POP 100 54.730 15.750 39.830 1.00 0.00 ATOM 12442 4C21 POP 100 54.390 16.610 41.810 1.00 0.00 ATOM 12443 H14R POP 100 54.420 15.550 42.140 1.00 0.00 ATOM 12444 H14S POP 100 53.460 17.120 42.150 1.00 0.00 ATOM 12445 5C21 POP 100 55.540 17.410 42.430 1.00 0.00 ATOM 12446 H15R POP 100 55.280 17.610 43.490 1.00 0.00 ATOM 12447 H15S POP 100 55.550 18.420 41.970 1.00 0.00 ATOM 12448 6C21 POP 100 56.960 16.890 42.250 1.00 0.00 ATOM 12449 H16R POP 100 56.990 16.370 41.270 1.00 0.00 ATOM 12450 H16S POP 100 57.070 16.140 43.060 1.00 0.00 ATOM 12451 7C21 POP 100 58.060 17.930 42.470 1.00 0.00 ATOM 12452 H17R POP 100 57.840 18.860 41.890 1.00 0.00 ATOM 12453 H17S POP 100 58.960 17.520 41.970 1.00 0.00 ATOM 12454 8C21 POP 100 58.320 18.260 43.940 1.00 0.00 ATOM 12455 H18R POP 100 58.920 17.380 44.260 1.00 0.00 ATOM 12456 H18S POP 100 57.390 18.350 44.530 1.00 0.00 ATOM 12457 H18T POP 100 58.890 19.210 44.070 1.00 0.00 ATOM 12458 C33 POP 100 57.390 26.450 32.580 1.00 0.00 ATOM 12459 H3X POP 100 57.330 27.020 33.530 1.00 0.00 ATOM 12460 H3Y POP 100 58.230 26.850 31.980 1.00 0.00 ATOM 12461 C34 POP 100 57.640 25.010 33.030 1.00 0.00 ATOM 12462 H4X POP 100 57.600 24.350 32.140 1.00 0.00 ATOM 12463 H4Y POP 100 56.790 24.710 33.680 1.00 0.00 ATOM 12464 C35 POP 100 59.040 24.790 33.620 1.00 0.00 ATOM 12465 H5X POP 100 59.760 24.750 32.780 1.00 0.00 ATOM 12466 H5Y POP 100 59.010 23.760 34.040 1.00 0.00 ATOM 12467 C36 POP 100 59.690 25.800 34.560 1.00 0.00 ATOM 12468 H6X POP 100 59.780 26.790 34.070 1.00 0.00 ATOM 12469 H6Y POP 100 60.710 25.450 34.830 1.00 0.00 ATOM 12470 C37 POP 100 58.890 26.050 35.840 1.00 0.00 ATOM 12471 H7X POP 100 58.830 25.020 36.270 1.00 0.00 ATOM 12472 H7Y POP 100 57.890 26.500 35.670 1.00 0.00 ATOM 12473 C38 POP 100 59.620 26.990 36.800 1.00 0.00 ATOM 12474 H8X POP 100 59.820 28.050 36.550 1.00 0.00 ATOM 12475 H8Y POP 100 60.620 26.540 36.960 1.00 0.00 ATOM 12476 C39 POP 100 59.000 27.020 38.200 1.00 0.00 ATOM 12477 H9X POP 100 57.980 27.460 38.180 1.00 0.00 ATOM 12478 H9Y POP 100 59.630 27.560 38.930 1.00 0.00 ATOM 12479 0C31 POP 100 58.810 25.620 38.810 1.00 0.00 ATOM 12480 H10X POP 100 59.740 25.010 38.770 1.00 0.00 ATOM 12481 H10Y POP 100 57.960 25.040 38.410 1.00 0.00 ATOM 12482 1C31 POP 100 58.580 25.960 40.280 1.00 0.00 ATOM 12483 H11X POP 100 57.840 26.790 40.240 1.00 0.00 ATOM 12484 H11Y POP 100 59.450 26.480 40.730 1.00 0.00 ATOM 12485 2C31 POP 100 57.880 24.970 41.210 1.00 0.00 ATOM 12486 H12X POP 100 57.770 23.980 40.710 1.00 0.00 ATOM 12487 H12Y POP 100 56.880 25.320 41.530 1.00 0.00 ATOM 12488 3C31 POP 100 58.690 24.660 42.470 1.00 0.00 ATOM 12489 H13X POP 100 58.750 25.620 43.040 1.00 0.00 ATOM 12490 H13Y POP 100 59.670 24.250 42.150 1.00 0.00 ATOM 12491 4C31 POP 100 57.950 23.620 43.310 1.00 0.00 ATOM 12492 H14X POP 100 58.050 22.620 42.830 1.00 0.00 ATOM 12493 H14Y POP 100 56.870 23.870 43.340 1.00 0.00 ATOM 12494 5C31 POP 100 58.450 23.510 44.750 1.00 0.00 ATOM 12495 H15X POP 100 59.540 23.320 44.910 1.00 0.00 ATOM 12496 H15Y POP 100 57.920 22.600 45.090 1.00 0.00 ATOM 12497 6C31 POP 100 58.010 24.740 45.530 1.00 0.00 ATOM 12498 H16X POP 100 58.410 24.830 46.560 1.00 0.00 ATOM 12499 H16Y POP 100 56.920 24.590 45.690 1.00 0.00 ATOM 12500 H16Z POP 100 58.140 25.730 45.030 1.00 0.00 ATOM 12501 N POP 101 52.470 4.200 24.360 1.00 0.00 ATOM 12502 HN1 POP 101 51.950 4.540 25.190 1.00 0.00 ATOM 12503 HN2 POP 101 51.780 3.630 23.830 1.00 0.00 ATOM 12504 HN3 POP 101 53.290 3.630 24.680 1.00 0.00 ATOM 12505 C12 POP 101 52.790 5.420 23.540 1.00 0.00 ATOM 12506 H12A POP 101 53.440 5.100 22.700 1.00 0.00 ATOM 12507 H12B POP 101 53.340 6.100 24.230 1.00 0.00 ATOM 12508 C11 POP 101 51.480 5.900 22.910 1.00 0.00 ATOM 12509 H11A POP 101 51.190 5.310 22.010 1.00 0.00 ATOM 12510 H11B POP 101 51.540 6.950 22.560 1.00 0.00 ATOM 12511 P POP 101 48.940 6.430 23.280 1.00 0.00 ATOM 12512 O13 POP 101 48.020 5.280 23.190 1.00 0.00 ATOM 12513 O14 POP 101 49.110 7.210 22.030 1.00 0.00 ATOM 12514 O11 POP 101 48.500 7.380 24.480 1.00 0.00 ATOM 12515 O12 POP 101 50.350 5.870 23.790 1.00 0.00 ATOM 12516 C1 POP 101 49.240 8.590 24.670 1.00 0.00 ATOM 12517 HA POP 101 48.640 9.530 24.580 1.00 0.00 ATOM 12518 HB POP 101 49.960 8.790 23.840 1.00 0.00 ATOM 12519 C2 POP 101 50.030 8.570 25.990 1.00 0.00 ATOM 12520 HS POP 101 51.100 8.450 25.710 1.00 0.00 ATOM 12521 O21 POP 101 49.560 7.650 26.970 1.00 0.00 ATOM 12522 C21 POP 101 50.330 7.490 28.050 1.00 0.00 ATOM 12523 O22 POP 101 51.490 7.870 28.150 1.00 0.00 ATOM 12524 C22 POP 101 49.540 6.790 29.140 1.00 0.00 ATOM 12525 H2R POP 101 49.680 5.690 29.190 1.00 0.00 ATOM 12526 H2S POP 101 48.480 7.080 28.970 1.00 0.00 ATOM 12527 C3 POP 101 50.020 9.990 26.580 1.00 0.00 ATOM 12528 HX POP 101 50.710 10.630 25.980 1.00 0.00 ATOM 12529 HY POP 101 50.670 10.010 27.480 1.00 0.00 ATOM 12530 O31 POP 101 48.740 10.570 26.840 1.00 0.00 ATOM 12531 C31 POP 101 48.470 10.550 28.150 1.00 0.00 ATOM 12532 O32 POP 101 49.280 10.340 29.030 1.00 0.00 ATOM 12533 C32 POP 101 46.990 10.850 28.380 1.00 0.00 ATOM 12534 H2X POP 101 46.510 10.920 27.380 1.00 0.00 ATOM 12535 H2Y POP 101 46.930 11.830 28.890 1.00 0.00 ATOM 12536 C23 POP 101 49.960 7.430 30.470 1.00 0.00 ATOM 12537 H3R POP 101 49.950 8.540 30.480 1.00 0.00 ATOM 12538 H3S POP 101 50.930 7.000 30.810 1.00 0.00 ATOM 12539 C24 POP 101 49.010 7.010 31.590 1.00 0.00 ATOM 12540 H4R POP 101 48.070 7.590 31.450 1.00 0.00 ATOM 12541 H4S POP 101 49.430 7.460 32.510 1.00 0.00 ATOM 12542 C25 POP 101 48.860 5.500 31.790 1.00 0.00 ATOM 12543 H5R POP 101 49.850 5.070 32.030 1.00 0.00 ATOM 12544 H5S POP 101 48.530 4.890 30.920 1.00 0.00 ATOM 12545 C26 POP 101 47.840 5.220 32.900 1.00 0.00 ATOM 12546 H6R POP 101 46.880 5.690 32.590 1.00 0.00 ATOM 12547 H6S POP 101 48.150 5.730 33.840 1.00 0.00 ATOM 12548 C27 POP 101 47.490 3.770 33.260 1.00 0.00 ATOM 12549 H7R POP 101 48.420 3.270 33.610 1.00 0.00 ATOM 12550 H7S POP 101 47.150 3.270 32.340 1.00 0.00 ATOM 12551 C28 POP 101 46.410 3.620 34.340 1.00 0.00 ATOM 12552 H8R POP 101 45.500 4.210 34.100 1.00 0.00 ATOM 12553 H8S POP 101 46.630 4.220 35.250 1.00 0.00 ATOM 12554 C29 POP 101 45.990 2.190 34.530 1.00 0.00 ATOM 12555 H91 POP 101 45.360 1.810 33.720 1.00 0.00 ATOM 12556 0C21 POP 101 46.000 1.440 35.640 1.00 0.00 ATOM 12557 1H10 POP 101 45.650 0.410 35.750 1.00 0.00 ATOM 12558 1C21 POP 101 46.580 1.960 36.930 1.00 0.00 ATOM 12559 H11R POP 101 47.460 2.620 36.780 1.00 0.00 ATOM 12560 H11S POP 101 46.910 1.060 37.500 1.00 0.00 ATOM 12561 2C21 POP 101 45.610 2.700 37.840 1.00 0.00 ATOM 12562 H12R POP 101 44.980 1.880 38.260 1.00 0.00 ATOM 12563 H12S POP 101 44.960 3.410 37.270 1.00 0.00 ATOM 12564 3C21 POP 101 46.220 3.560 38.960 1.00 0.00 ATOM 12565 H13R POP 101 46.970 2.960 39.510 1.00 0.00 ATOM 12566 H13S POP 101 45.490 3.910 39.720 1.00 0.00 ATOM 12567 4C21 POP 101 46.910 4.790 38.380 1.00 0.00 ATOM 12568 H14R POP 101 46.300 5.410 37.680 1.00 0.00 ATOM 12569 H14S POP 101 47.830 4.390 37.890 1.00 0.00 ATOM 12570 5C21 POP 101 47.570 5.700 39.410 1.00 0.00 ATOM 12571 H15R POP 101 48.300 5.090 39.990 1.00 0.00 ATOM 12572 H15S POP 101 46.770 6.090 40.090 1.00 0.00 ATOM 12573 6C21 POP 101 48.190 6.980 38.830 1.00 0.00 ATOM 12574 H16R POP 101 47.490 7.480 38.130 1.00 0.00 ATOM 12575 H16S POP 101 48.940 6.610 38.110 1.00 0.00 ATOM 12576 7C21 POP 101 48.820 7.920 39.860 1.00 0.00 ATOM 12577 H17R POP 101 49.410 7.190 40.460 1.00 0.00 ATOM 12578 H17S POP 101 48.030 8.450 40.420 1.00 0.00 ATOM 12579 8C21 POP 101 49.850 8.920 39.320 1.00 0.00 ATOM 12580 H18R POP 101 50.430 9.290 40.200 1.00 0.00 ATOM 12581 H18S POP 101 49.330 9.810 38.900 1.00 0.00 ATOM 12582 H18T POP 101 50.570 8.510 38.580 1.00 0.00 ATOM 12583 C33 POP 101 46.340 9.680 29.120 1.00 0.00 ATOM 12584 H3X POP 101 46.820 9.790 30.110 1.00 0.00 ATOM 12585 H3Y POP 101 46.540 8.720 28.580 1.00 0.00 ATOM 12586 C34 POP 101 44.820 9.790 29.260 1.00 0.00 ATOM 12587 H4X POP 101 44.290 10.010 28.310 1.00 0.00 ATOM 12588 H4Y POP 101 44.600 10.720 29.830 1.00 0.00 ATOM 12589 C35 POP 101 44.210 8.620 30.030 1.00 0.00 ATOM 12590 H5X POP 101 44.650 7.700 29.590 1.00 0.00 ATOM 12591 H5Y POP 101 43.110 8.510 29.920 1.00 0.00 ATOM 12592 C36 POP 101 44.460 8.600 31.530 1.00 0.00 ATOM 12593 H6X POP 101 44.070 9.490 32.070 1.00 0.00 ATOM 12594 H6Y POP 101 45.530 8.450 31.780 1.00 0.00 ATOM 12595 C37 POP 101 43.650 7.570 32.330 1.00 0.00 ATOM 12596 H7X POP 101 44.040 6.630 31.890 1.00 0.00 ATOM 12597 H7Y POP 101 42.590 7.540 32.010 1.00 0.00 ATOM 12598 C38 POP 101 43.790 7.490 33.850 1.00 0.00 ATOM 12599 H8X POP 101 43.310 8.340 34.390 1.00 0.00 ATOM 12600 H8Y POP 101 44.870 7.550 34.080 1.00 0.00 ATOM 12601 C39 POP 101 43.180 6.180 34.360 1.00 0.00 ATOM 12602 H9X POP 101 43.600 5.290 33.840 1.00 0.00 ATOM 12603 H9Y POP 101 42.070 6.240 34.320 1.00 0.00 ATOM 12604 0C31 POP 101 43.550 6.040 35.840 1.00 0.00 ATOM 12605 H10X POP 101 43.270 6.960 36.390 1.00 0.00 ATOM 12606 H10Y POP 101 44.660 6.020 35.830 1.00 0.00 ATOM 12607 1C31 POP 101 42.870 4.960 36.680 1.00 0.00 ATOM 12608 H11X POP 101 43.460 4.830 37.610 1.00 0.00 ATOM 12609 H11Y POP 101 43.070 4.000 36.150 1.00 0.00 ATOM 12610 2C31 POP 101 41.370 5.190 36.840 1.00 0.00 ATOM 12611 H12X POP 101 40.950 5.360 35.830 1.00 0.00 ATOM 12612 H12Y POP 101 41.150 6.130 37.390 1.00 0.00 ATOM 12613 3C31 POP 101 40.630 4.080 37.590 1.00 0.00 ATOM 12614 H13X POP 101 40.630 3.160 36.970 1.00 0.00 ATOM 12615 H13Y POP 101 39.590 4.450 37.580 1.00 0.00 ATOM 12616 4C31 POP 101 41.250 3.710 38.940 1.00 0.00 ATOM 12617 H14X POP 101 42.320 3.420 38.950 1.00 0.00 ATOM 12618 H14Y POP 101 40.660 2.890 39.390 1.00 0.00 ATOM 12619 5C31 POP 101 41.090 4.800 40.000 1.00 0.00 ATOM 12620 H15X POP 101 40.020 5.050 40.110 1.00 0.00 ATOM 12621 H15Y POP 101 41.690 5.660 39.630 1.00 0.00 ATOM 12622 6C31 POP 101 41.510 4.330 41.400 1.00 0.00 ATOM 12623 H16X POP 101 42.610 4.390 41.440 1.00 0.00 ATOM 12624 H16Y POP 101 41.130 3.290 41.540 1.00 0.00 ATOM 12625 H16Z POP 101 41.150 4.950 42.250 1.00 0.00 ATOM 12626 N POP 102 24.520 31.470 25.730 1.00 0.00 ATOM 12627 HN1 POP 102 23.510 31.610 25.960 1.00 0.00 ATOM 12628 HN2 POP 102 24.870 32.410 25.460 1.00 0.00 ATOM 12629 HN3 POP 102 24.780 30.990 24.850 1.00 0.00 ATOM 12630 C12 POP 102 25.220 30.900 26.940 1.00 0.00 ATOM 12631 H12A POP 102 25.580 31.680 27.650 1.00 0.00 ATOM 12632 H12B POP 102 26.120 30.370 26.570 1.00 0.00 ATOM 12633 C11 POP 102 24.380 29.880 27.710 1.00 0.00 ATOM 12634 H11A POP 102 23.670 30.510 28.290 1.00 0.00 ATOM 12635 H11B POP 102 25.010 29.370 28.470 1.00 0.00 ATOM 12636 P POP 102 24.330 27.570 26.640 1.00 0.00 ATOM 12637 O13 POP 102 25.450 27.370 27.590 1.00 0.00 ATOM 12638 O14 POP 102 24.630 27.390 25.200 1.00 0.00 ATOM 12639 O11 POP 102 23.230 26.490 27.050 1.00 0.00 ATOM 12640 O12 POP 102 23.670 29.010 26.820 1.00 0.00 ATOM 12641 C1 POP 102 21.860 26.910 27.130 1.00 0.00 ATOM 12642 HA POP 102 21.330 25.970 26.860 1.00 0.00 ATOM 12643 HB POP 102 21.670 27.580 26.270 1.00 0.00 ATOM 12644 C2 POP 102 21.330 27.380 28.490 1.00 0.00 ATOM 12645 HS POP 102 21.700 28.410 28.700 1.00 0.00 ATOM 12646 O21 POP 102 21.620 26.430 29.520 1.00 0.00 ATOM 12647 C21 POP 102 22.720 26.820 30.180 1.00 0.00 ATOM 12648 O22 POP 102 23.310 27.880 30.030 1.00 0.00 ATOM 12649 C22 POP 102 22.950 25.810 31.290 1.00 0.00 ATOM 12650 H2R POP 102 23.200 24.870 30.750 1.00 0.00 ATOM 12651 H2S POP 102 22.000 25.550 31.810 1.00 0.00 ATOM 12652 C3 POP 102 19.830 27.670 28.310 1.00 0.00 ATOM 12653 HX POP 102 19.360 26.670 28.480 1.00 0.00 ATOM 12654 HY POP 102 19.620 27.900 27.250 1.00 0.00 ATOM 12655 O31 POP 102 19.350 28.560 29.320 1.00 0.00 ATOM 12656 C31 POP 102 18.040 28.680 29.130 1.00 0.00 ATOM 12657 O32 POP 102 17.460 28.280 28.130 1.00 0.00 ATOM 12658 C32 POP 102 17.520 29.550 30.260 1.00 0.00 ATOM 12659 H2X POP 102 16.870 30.290 29.740 1.00 0.00 ATOM 12660 H2Y POP 102 18.330 30.090 30.790 1.00 0.00 ATOM 12661 C23 POP 102 24.090 26.180 32.240 1.00 0.00 ATOM 12662 H3R POP 102 23.680 26.880 33.010 1.00 0.00 ATOM 12663 H3S POP 102 24.880 26.720 31.670 1.00 0.00 ATOM 12664 C24 POP 102 24.690 24.980 32.960 1.00 0.00 ATOM 12665 H4R POP 102 25.750 25.100 33.270 1.00 0.00 ATOM 12666 H4S POP 102 24.730 23.990 32.460 1.00 0.00 ATOM 12667 C25 POP 102 23.840 24.700 34.200 1.00 0.00 ATOM 12668 H5R POP 102 22.760 24.650 33.930 1.00 0.00 ATOM 12669 H5S POP 102 24.010 25.630 34.790 1.00 0.00 ATOM 12670 C26 POP 102 24.100 23.380 34.920 1.00 0.00 ATOM 12671 H6R POP 102 25.190 23.180 34.940 1.00 0.00 ATOM 12672 H6S POP 102 23.660 22.490 34.400 1.00 0.00 ATOM 12673 C27 POP 102 23.470 23.300 36.310 1.00 0.00 ATOM 12674 H7R POP 102 23.690 22.240 36.560 1.00 0.00 ATOM 12675 H7S POP 102 22.370 23.390 36.470 1.00 0.00 ATOM 12676 C28 POP 102 24.210 24.160 37.340 1.00 0.00 ATOM 12677 H8R POP 102 23.870 25.200 37.140 1.00 0.00 ATOM 12678 H8S POP 102 25.270 24.250 37.030 1.00 0.00 ATOM 12679 C29 POP 102 23.920 23.700 38.740 1.00 0.00 ATOM 12680 H91 POP 102 23.610 22.650 38.880 1.00 0.00 ATOM 12681 0C21 POP 102 23.780 24.510 39.800 1.00 0.00 ATOM 12682 1H10 POP 102 23.650 24.130 40.820 1.00 0.00 ATOM 12683 1C21 POP 102 23.890 26.010 39.870 1.00 0.00 ATOM 12684 H11R POP 102 22.990 26.500 39.440 1.00 0.00 ATOM 12685 H11S POP 102 24.870 26.290 39.410 1.00 0.00 ATOM 12686 2C21 POP 102 24.230 26.560 41.250 1.00 0.00 ATOM 12687 H12R POP 102 25.180 26.130 41.640 1.00 0.00 ATOM 12688 H12S POP 102 23.350 26.290 41.880 1.00 0.00 ATOM 12689 3C21 POP 102 24.470 28.070 41.260 1.00 0.00 ATOM 12690 H13R POP 102 23.460 28.500 41.090 1.00 0.00 ATOM 12691 H13S POP 102 25.140 28.370 40.420 1.00 0.00 ATOM 12692 4C21 POP 102 24.960 28.620 42.600 1.00 0.00 ATOM 12693 H14R POP 102 24.290 28.240 43.390 1.00 0.00 ATOM 12694 H14S POP 102 24.970 29.730 42.490 1.00 0.00 ATOM 12695 5C21 POP 102 26.320 28.010 42.980 1.00 0.00 ATOM 12696 H15R POP 102 26.680 27.380 42.140 1.00 0.00 ATOM 12697 H15S POP 102 26.110 27.360 43.850 1.00 0.00 ATOM 12698 6C21 POP 102 27.540 28.870 43.290 1.00 0.00 ATOM 12699 H16R POP 102 28.450 28.250 43.140 1.00 0.00 ATOM 12700 H16S POP 102 27.440 29.220 44.340 1.00 0.00 ATOM 12701 7C21 POP 102 27.590 30.150 42.450 1.00 0.00 ATOM 12702 H17R POP 102 26.790 30.840 42.800 1.00 0.00 ATOM 12703 H17S POP 102 27.320 29.940 41.400 1.00 0.00 ATOM 12704 8C21 POP 102 28.820 31.020 42.680 1.00 0.00 ATOM 12705 H18R POP 102 29.720 30.410 42.460 1.00 0.00 ATOM 12706 H18S POP 102 28.900 31.290 43.750 1.00 0.00 ATOM 12707 H18T POP 102 28.960 31.910 42.020 1.00 0.00 ATOM 12708 C33 POP 102 16.740 28.680 31.250 1.00 0.00 ATOM 12709 H3X POP 102 17.020 27.620 31.150 1.00 0.00 ATOM 12710 H3Y POP 102 15.690 28.620 30.880 1.00 0.00 ATOM 12711 C34 POP 102 16.880 29.060 32.730 1.00 0.00 ATOM 12712 H4X POP 102 17.960 29.170 32.960 1.00 0.00 ATOM 12713 H4Y POP 102 16.410 28.330 33.420 1.00 0.00 ATOM 12714 C35 POP 102 16.230 30.410 33.040 1.00 0.00 ATOM 12715 H5X POP 102 15.200 30.340 32.620 1.00 0.00 ATOM 12716 H5Y POP 102 16.810 31.230 32.570 1.00 0.00 ATOM 12717 C36 POP 102 16.110 30.780 34.520 1.00 0.00 ATOM 12718 H6X POP 102 15.740 29.910 35.110 1.00 0.00 ATOM 12719 H6Y POP 102 15.400 31.620 34.660 1.00 0.00 ATOM 12720 C37 POP 102 17.410 31.170 35.220 1.00 0.00 ATOM 12721 H7X POP 102 17.750 32.170 34.870 1.00 0.00 ATOM 12722 H7Y POP 102 18.240 30.450 35.090 1.00 0.00 ATOM 12723 C38 POP 102 17.110 31.410 36.710 1.00 0.00 ATOM 12724 H8X POP 102 16.450 30.580 37.030 1.00 0.00 ATOM 12725 H8Y POP 102 16.630 32.390 36.890 1.00 0.00 ATOM 12726 C39 POP 102 18.410 31.530 37.510 1.00 0.00 ATOM 12727 H9X POP 102 18.950 32.370 37.030 1.00 0.00 ATOM 12728 H9Y POP 102 19.030 30.620 37.420 1.00 0.00 ATOM 12729 0C31 POP 102 18.220 31.930 38.980 1.00 0.00 ATOM 12730 H10X POP 102 17.380 31.350 39.420 1.00 0.00 ATOM 12731 H10Y POP 102 17.980 33.010 38.860 1.00 0.00 ATOM 12732 1C31 POP 102 19.410 31.780 39.930 1.00 0.00 ATOM 12733 H11X POP 102 20.290 31.830 39.250 1.00 0.00 ATOM 12734 H11Y POP 102 19.500 30.730 40.270 1.00 0.00 ATOM 12735 2C31 POP 102 19.610 32.780 41.070 1.00 0.00 ATOM 12736 H12X POP 102 19.360 33.800 40.690 1.00 0.00 ATOM 12737 H12Y POP 102 20.680 32.820 41.370 1.00 0.00 ATOM 12738 3C31 POP 102 18.550 32.540 42.140 1.00 0.00 ATOM 12739 H13X POP 102 18.720 31.500 42.500 1.00 0.00 ATOM 12740 H13Y POP 102 17.490 32.480 41.830 1.00 0.00 ATOM 12741 4C31 POP 102 18.640 33.380 43.420 1.00 0.00 ATOM 12742 H14X POP 102 19.050 34.360 43.120 1.00 0.00 ATOM 12743 H14Y POP 102 19.450 32.940 44.040 1.00 0.00 ATOM 12744 5C31 POP 102 17.330 33.480 44.200 1.00 0.00 ATOM 12745 H15X POP 102 17.550 34.060 45.130 1.00 0.00 ATOM 12746 H15Y POP 102 17.040 32.460 44.510 1.00 0.00 ATOM 12747 6C31 POP 102 16.130 34.190 43.590 1.00 0.00 ATOM 12748 H16X POP 102 15.960 33.920 42.530 1.00 0.00 ATOM 12749 H16Y POP 102 16.320 35.290 43.530 1.00 0.00 ATOM 12750 H16Z POP 102 15.150 34.060 44.090 1.00 0.00 ATOM 12751 N POP 103 47.280 1.810 19.330 1.00 0.00 ATOM 12752 HN1 POP 103 48.070 2.370 19.700 1.00 0.00 ATOM 12753 HN2 POP 103 47.430 1.650 18.320 1.00 0.00 ATOM 12754 HN3 POP 103 46.450 2.430 19.460 1.00 0.00 ATOM 12755 C12 POP 103 47.320 0.500 20.090 1.00 0.00 ATOM 12756 H12A POP 103 48.190 -0.060 19.710 1.00 0.00 ATOM 12757 H12B POP 103 46.400 -0.080 19.850 1.00 0.00 ATOM 12758 C11 POP 103 47.650 0.760 21.560 1.00 0.00 ATOM 12759 H11A POP 103 47.810 -0.220 22.050 1.00 0.00 ATOM 12760 H11B POP 103 46.790 1.270 22.050 1.00 0.00 ATOM 12761 P POP 103 49.770 1.400 22.880 1.00 0.00 ATOM 12762 O13 POP 103 50.500 2.660 23.140 1.00 0.00 ATOM 12763 O14 POP 103 50.670 0.220 22.770 1.00 0.00 ATOM 12764 O11 POP 103 48.740 1.100 24.070 1.00 0.00 ATOM 12765 O12 POP 103 48.790 1.620 21.640 1.00 0.00 ATOM 12766 C1 POP 103 48.000 2.130 24.740 1.00 0.00 ATOM 12767 HA POP 103 47.130 1.660 25.240 1.00 0.00 ATOM 12768 HB POP 103 47.470 2.760 23.990 1.00 0.00 ATOM 12769 C2 POP 103 48.750 3.090 25.670 1.00 0.00 ATOM 12770 HS POP 103 49.460 3.650 25.020 1.00 0.00 ATOM 12771 O21 POP 103 49.420 2.310 26.660 1.00 0.00 ATOM 12772 C21 POP 103 50.550 2.900 27.070 1.00 0.00 ATOM 12773 O22 POP 103 50.880 4.010 26.680 1.00 0.00 ATOM 12774 C22 POP 103 51.220 2.120 28.190 1.00 0.00 ATOM 12775 H2R POP 103 52.260 2.000 27.830 1.00 0.00 ATOM 12776 H2S POP 103 50.830 1.080 28.260 1.00 0.00 ATOM 12777 C3 POP 103 47.820 4.100 26.370 1.00 0.00 ATOM 12778 HX POP 103 47.100 4.630 25.720 1.00 0.00 ATOM 12779 HY POP 103 48.490 4.810 26.900 1.00 0.00 ATOM 12780 O31 POP 103 47.060 3.440 27.390 1.00 0.00 ATOM 12781 C31 POP 103 46.400 4.350 28.100 1.00 0.00 ATOM 12782 O32 POP 103 46.340 5.550 27.930 1.00 0.00 ATOM 12783 C32 POP 103 45.790 3.600 29.280 1.00 0.00 ATOM 12784 H2X POP 103 46.590 3.450 30.040 1.00 0.00 ATOM 12785 H2Y POP 103 45.400 2.580 29.050 1.00 0.00 ATOM 12786 C23 POP 103 51.200 2.950 29.470 1.00 0.00 ATOM 12787 H3R POP 103 50.230 3.060 30.010 1.00 0.00 ATOM 12788 H3S POP 103 51.390 4.020 29.230 1.00 0.00 ATOM 12789 C24 POP 103 52.290 2.500 30.450 1.00 0.00 ATOM 12790 H4R POP 103 52.800 3.300 31.020 1.00 0.00 ATOM 12791 H4S POP 103 53.030 1.870 29.920 1.00 0.00 ATOM 12792 C25 POP 103 51.710 1.470 31.430 1.00 0.00 ATOM 12793 H5R POP 103 51.020 0.750 30.940 1.00 0.00 ATOM 12794 H5S POP 103 51.140 2.120 32.130 1.00 0.00 ATOM 12795 C26 POP 103 52.780 0.760 32.260 1.00 0.00 ATOM 12796 H6R POP 103 53.240 0.080 31.520 1.00 0.00 ATOM 12797 H6S POP 103 52.260 0.120 33.010 1.00 0.00 ATOM 12798 C27 POP 103 53.720 1.720 32.990 1.00 0.00 ATOM 12799 H7R POP 103 53.130 2.120 33.840 1.00 0.00 ATOM 12800 H7S POP 103 54.180 2.410 32.260 1.00 0.00 ATOM 12801 C28 POP 103 54.750 0.920 33.800 1.00 0.00 ATOM 12802 H8R POP 103 55.120 1.750 34.440 1.00 0.00 ATOM 12803 H8S POP 103 55.520 0.640 33.050 1.00 0.00 ATOM 12804 C29 POP 103 54.190 -0.250 34.560 1.00 0.00 ATOM 12805 H91 POP 103 54.010 -1.120 33.910 1.00 0.00 ATOM 12806 0C21 POP 103 53.940 -0.340 35.870 1.00 0.00 ATOM 12807 1H10 POP 103 53.390 -1.240 36.200 1.00 0.00 ATOM 12808 1C21 POP 103 54.080 0.690 36.950 1.00 0.00 ATOM 12809 H11R POP 103 53.360 0.640 37.790 1.00 0.00 ATOM 12810 H11S POP 103 53.920 1.670 36.440 1.00 0.00 ATOM 12811 2C21 POP 103 55.440 0.850 37.620 1.00 0.00 ATOM 12812 H12R POP 103 56.120 1.050 36.760 1.00 0.00 ATOM 12813 H12S POP 103 55.580 -0.170 38.050 1.00 0.00 ATOM 12814 3C21 POP 103 55.520 1.920 38.710 1.00 0.00 ATOM 12815 H13R POP 103 54.580 1.850 39.300 1.00 0.00 ATOM 12816 H13S POP 103 55.580 2.900 38.200 1.00 0.00 ATOM 12817 4C21 POP 103 56.750 1.710 39.600 1.00 0.00 ATOM 12818 H14R POP 103 57.650 1.890 38.970 1.00 0.00 ATOM 12819 H14S POP 103 56.790 0.640 39.910 1.00 0.00 ATOM 12820 5C21 POP 103 56.780 2.590 40.850 1.00 0.00 ATOM 12821 H15R POP 103 55.940 2.380 41.550 1.00 0.00 ATOM 12822 H15S POP 103 56.620 3.620 40.480 1.00 0.00 ATOM 12823 6C21 POP 103 58.140 2.640 41.550 1.00 0.00 ATOM 12824 H16R POP 103 58.940 3.030 40.880 1.00 0.00 ATOM 12825 H16S POP 103 58.540 1.620 41.770 1.00 0.00 ATOM 12826 7C21 POP 103 58.290 3.510 42.800 1.00 0.00 ATOM 12827 H17R POP 103 57.550 3.230 43.580 1.00 0.00 ATOM 12828 H17S POP 103 57.940 4.520 42.490 1.00 0.00 ATOM 12829 8C21 POP 103 59.640 3.580 43.500 1.00 0.00 ATOM 12830 H18R POP 103 60.100 2.570 43.480 1.00 0.00 ATOM 12831 H18S POP 103 59.550 3.710 44.600 1.00 0.00 ATOM 12832 H18T POP 103 60.380 4.220 42.970 1.00 0.00 ATOM 12833 C33 POP 103 44.660 4.420 29.890 1.00 0.00 ATOM 12834 H3X POP 103 43.860 4.720 29.180 1.00 0.00 ATOM 12835 H3Y POP 103 45.140 5.390 30.140 1.00 0.00 ATOM 12836 C34 POP 103 44.140 3.750 31.160 1.00 0.00 ATOM 12837 H4X POP 103 43.680 4.600 31.700 1.00 0.00 ATOM 12838 H4Y POP 103 45.050 3.400 31.680 1.00 0.00 ATOM 12839 C35 POP 103 43.140 2.630 30.850 1.00 0.00 ATOM 12840 H5X POP 103 43.590 1.810 30.250 1.00 0.00 ATOM 12841 H5Y POP 103 42.220 3.090 30.440 1.00 0.00 ATOM 12842 C36 POP 103 42.610 1.870 32.070 1.00 0.00 ATOM 12843 H6X POP 103 42.160 2.610 32.770 1.00 0.00 ATOM 12844 H6Y POP 103 43.480 1.320 32.470 1.00 0.00 ATOM 12845 C37 POP 103 41.400 0.960 31.870 1.00 0.00 ATOM 12846 H7X POP 103 41.680 0.130 31.190 1.00 0.00 ATOM 12847 H7Y POP 103 40.600 1.480 31.300 1.00 0.00 ATOM 12848 C38 POP 103 40.950 0.490 33.260 1.00 0.00 ATOM 12849 H8X POP 103 41.880 0.260 33.810 1.00 0.00 ATOM 12850 H8Y POP 103 40.330 -0.430 33.190 1.00 0.00 ATOM 12851 C39 POP 103 40.280 1.510 34.190 1.00 0.00 ATOM 12852 H9X POP 103 39.420 1.860 33.580 1.00 0.00 ATOM 12853 H9Y POP 103 40.930 2.370 34.460 1.00 0.00 ATOM 12854 0C31 POP 103 39.680 1.020 35.510 1.00 0.00 ATOM 12855 H10X POP 103 38.940 0.220 35.280 1.00 0.00 ATOM 12856 H10Y POP 103 39.310 1.930 36.030 1.00 0.00 ATOM 12857 1C31 POP 103 40.650 0.270 36.420 1.00 0.00 ATOM 12858 H11X POP 103 41.420 1.060 36.530 1.00 0.00 ATOM 12859 H11Y POP 103 41.050 -0.650 35.940 1.00 0.00 ATOM 12860 2C31 POP 103 40.010 0.040 37.800 1.00 0.00 ATOM 12861 H12X POP 103 39.150 -0.650 37.690 1.00 0.00 ATOM 12862 H12Y POP 103 39.590 1.000 38.180 1.00 0.00 ATOM 12863 3C31 POP 103 40.960 -0.410 38.910 1.00 0.00 ATOM 12864 H13X POP 103 41.750 0.360 38.970 1.00 0.00 ATOM 12865 H13Y POP 103 41.520 -1.320 38.590 1.00 0.00 ATOM 12866 4C31 POP 103 40.120 -0.910 40.090 1.00 0.00 ATOM 12867 H14X POP 103 39.540 -1.770 39.700 1.00 0.00 ATOM 12868 H14Y POP 103 39.470 -0.160 40.590 1.00 0.00 ATOM 12869 5C31 POP 103 40.960 -1.440 41.260 1.00 0.00 ATOM 12870 H15X POP 103 41.530 -0.610 41.720 1.00 0.00 ATOM 12871 H15Y POP 103 41.690 -2.130 40.780 1.00 0.00 ATOM 12872 6C31 POP 103 40.280 -2.220 42.390 1.00 0.00 ATOM 12873 H16X POP 103 40.820 -2.310 43.350 1.00 0.00 ATOM 12874 H16Y POP 103 39.970 -3.170 41.910 1.00 0.00 ATOM 12875 H16Z POP 103 39.370 -1.640 42.650 1.00 0.00 ATOM 12876 N POP 104 37.460 35.270 22.390 1.00 0.00 ATOM 12877 HN1 POP 104 37.900 34.340 22.510 1.00 0.00 ATOM 12878 HN2 POP 104 37.120 35.520 23.350 1.00 0.00 ATOM 12879 HN3 POP 104 36.550 35.320 21.880 1.00 0.00 ATOM 12880 C12 POP 104 38.420 36.300 21.840 1.00 0.00 ATOM 12881 H12A POP 104 37.920 37.290 21.810 1.00 0.00 ATOM 12882 H12B POP 104 38.790 36.010 20.840 1.00 0.00 ATOM 12883 C11 POP 104 39.600 36.470 22.810 1.00 0.00 ATOM 12884 H11A POP 104 40.300 37.250 22.430 1.00 0.00 ATOM 12885 H11B POP 104 40.130 35.500 22.780 1.00 0.00 ATOM 12886 P POP 104 39.170 38.370 24.610 1.00 0.00 ATOM 12887 O13 POP 104 38.270 38.480 25.790 1.00 0.00 ATOM 12888 O14 POP 104 38.920 39.290 23.480 1.00 0.00 ATOM 12889 O11 POP 104 40.690 38.490 25.090 1.00 0.00 ATOM 12890 O12 POP 104 39.150 36.850 24.110 1.00 0.00 ATOM 12891 C1 POP 104 41.470 37.320 25.330 1.00 0.00 ATOM 12892 HA POP 104 42.500 37.520 25.700 1.00 0.00 ATOM 12893 HB POP 104 41.620 36.790 24.360 1.00 0.00 ATOM 12894 C2 POP 104 40.880 36.330 26.360 1.00 0.00 ATOM 12895 HS POP 104 39.910 36.010 25.910 1.00 0.00 ATOM 12896 O21 POP 104 40.800 37.100 27.550 1.00 0.00 ATOM 12897 C21 POP 104 39.750 36.810 28.320 1.00 0.00 ATOM 12898 O22 POP 104 38.850 36.060 27.980 1.00 0.00 ATOM 12899 C22 POP 104 39.940 37.480 29.670 1.00 0.00 ATOM 12900 H2R POP 104 40.000 38.590 29.670 1.00 0.00 ATOM 12901 H2S POP 104 40.940 37.180 30.050 1.00 0.00 ATOM 12902 C3 POP 104 41.720 35.040 26.450 1.00 0.00 ATOM 12903 HX POP 104 41.790 34.750 25.380 1.00 0.00 ATOM 12904 HY POP 104 41.270 34.180 26.980 1.00 0.00 ATOM 12905 O31 POP 104 43.030 35.420 26.900 1.00 0.00 ATOM 12906 C31 POP 104 43.060 35.290 28.230 1.00 0.00 ATOM 12907 O32 POP 104 42.100 35.130 28.970 1.00 0.00 ATOM 12908 C32 POP 104 44.410 35.720 28.770 1.00 0.00 ATOM 12909 H2X POP 104 44.300 36.820 28.650 1.00 0.00 ATOM 12910 H2Y POP 104 45.230 35.300 28.140 1.00 0.00 ATOM 12911 C23 POP 104 38.800 37.140 30.630 1.00 0.00 ATOM 12912 H3R POP 104 38.790 36.030 30.660 1.00 0.00 ATOM 12913 H3S POP 104 37.850 37.560 30.250 1.00 0.00 ATOM 12914 C24 POP 104 38.970 37.700 32.040 1.00 0.00 ATOM 12915 H4R POP 104 39.080 38.810 32.030 1.00 0.00 ATOM 12916 H4S POP 104 39.940 37.260 32.360 1.00 0.00 ATOM 12917 C25 POP 104 37.920 37.230 33.040 1.00 0.00 ATOM 12918 H5R POP 104 37.870 36.120 33.110 1.00 0.00 ATOM 12919 H5S POP 104 36.900 37.600 32.790 1.00 0.00 ATOM 12920 C26 POP 104 38.240 37.650 34.480 1.00 0.00 ATOM 12921 H6R POP 104 38.330 38.760 34.540 1.00 0.00 ATOM 12922 H6S POP 104 39.170 37.210 34.900 1.00 0.00 ATOM 12923 C27 POP 104 37.060 37.350 35.410 1.00 0.00 ATOM 12924 H7R POP 104 36.750 36.280 35.350 1.00 0.00 ATOM 12925 H7S POP 104 36.250 38.040 35.100 1.00 0.00 ATOM 12926 C28 POP 104 37.430 37.630 36.870 1.00 0.00 ATOM 12927 H8R POP 104 37.610 38.700 37.080 1.00 0.00 ATOM 12928 H8S POP 104 38.370 37.080 37.060 1.00 0.00 ATOM 12929 C29 POP 104 36.430 37.080 37.850 1.00 0.00 ATOM 12930 H91 POP 104 35.940 36.150 37.530 1.00 0.00 ATOM 12931 0C21 POP 104 36.240 37.490 39.110 1.00 0.00 ATOM 12932 1H10 POP 104 35.550 36.920 39.760 1.00 0.00 ATOM 12933 1C21 POP 104 36.930 38.710 39.660 1.00 0.00 ATOM 12934 H11R POP 104 36.740 39.530 38.930 1.00 0.00 ATOM 12935 H11S POP 104 38.020 38.580 39.860 1.00 0.00 ATOM 12936 2C21 POP 104 36.290 39.280 40.920 1.00 0.00 ATOM 12937 H12R POP 104 35.220 39.560 40.800 1.00 0.00 ATOM 12938 H12S POP 104 36.770 40.270 41.050 1.00 0.00 ATOM 12939 3C21 POP 104 36.340 38.370 42.160 1.00 0.00 ATOM 12940 H13R POP 104 37.360 38.080 42.480 1.00 0.00 ATOM 12941 H13S POP 104 35.890 37.360 42.070 1.00 0.00 ATOM 12942 4C21 POP 104 35.800 39.060 43.410 1.00 0.00 ATOM 12943 H14R POP 104 34.830 39.560 43.210 1.00 0.00 ATOM 12944 H14S POP 104 36.400 39.980 43.580 1.00 0.00 ATOM 12945 5C21 POP 104 35.690 38.110 44.610 1.00 0.00 ATOM 12946 H15R POP 104 36.680 37.860 45.050 1.00 0.00 ATOM 12947 H15S POP 104 35.280 37.120 44.320 1.00 0.00 ATOM 12948 6C21 POP 104 34.970 38.860 45.730 1.00 0.00 ATOM 12949 H16R POP 104 34.020 39.360 45.460 1.00 0.00 ATOM 12950 H16S POP 104 35.710 39.560 46.170 1.00 0.00 ATOM 12951 7C21 POP 104 34.680 37.870 46.860 1.00 0.00 ATOM 12952 H17R POP 104 35.540 37.180 46.980 1.00 0.00 ATOM 12953 H17S POP 104 33.890 37.160 46.540 1.00 0.00 ATOM 12954 8C21 POP 104 34.230 38.550 48.150 1.00 0.00 ATOM 12955 H18R POP 104 33.300 39.150 48.020 1.00 0.00 ATOM 12956 H18S POP 104 34.910 39.400 48.390 1.00 0.00 ATOM 12957 H18T POP 104 33.990 37.820 48.950 1.00 0.00 ATOM 12958 C33 POP 104 44.650 35.480 30.260 1.00 0.00 ATOM 12959 H3X POP 104 44.550 34.440 30.640 1.00 0.00 ATOM 12960 H3Y POP 104 43.790 36.020 30.710 1.00 0.00 ATOM 12961 C34 POP 104 45.980 36.130 30.630 1.00 0.00 ATOM 12962 H4X POP 104 45.770 37.220 30.630 1.00 0.00 ATOM 12963 H4Y POP 104 46.780 35.900 29.900 1.00 0.00 ATOM 12964 C35 POP 104 46.350 35.510 31.980 1.00 0.00 ATOM 12965 H5X POP 104 47.370 35.840 32.260 1.00 0.00 ATOM 12966 H5Y POP 104 46.380 34.400 31.880 1.00 0.00 ATOM 12967 C36 POP 104 45.400 35.920 33.100 1.00 0.00 ATOM 12968 H6X POP 104 44.370 35.670 32.770 1.00 0.00 ATOM 12969 H6Y POP 104 45.550 37.020 33.180 1.00 0.00 ATOM 12970 C37 POP 104 45.720 35.210 34.420 1.00 0.00 ATOM 12971 H7X POP 104 46.820 35.280 34.610 1.00 0.00 ATOM 12972 H7Y POP 104 45.530 34.120 34.310 1.00 0.00 ATOM 12973 C38 POP 104 44.850 35.800 35.530 1.00 0.00 ATOM 12974 H8X POP 104 43.830 35.440 35.260 1.00 0.00 ATOM 12975 H8Y POP 104 44.800 36.900 35.360 1.00 0.00 ATOM 12976 C39 POP 104 45.250 35.550 36.980 1.00 0.00 ATOM 12977 H9X POP 104 46.330 35.790 37.100 1.00 0.00 ATOM 12978 H9Y POP 104 45.020 34.490 37.210 1.00 0.00 ATOM 12979 0C31 POP 104 44.490 36.470 37.940 1.00 0.00 ATOM 12980 H10X POP 104 43.390 36.290 37.900 1.00 0.00 ATOM 12981 H10Y POP 104 44.690 37.540 37.710 1.00 0.00 ATOM 12982 1C31 POP 104 44.960 36.290 39.380 1.00 0.00 ATOM 12983 H11X POP 104 44.630 37.250 39.840 1.00 0.00 ATOM 12984 H11Y POP 104 46.070 36.200 39.400 1.00 0.00 ATOM 12985 2C31 POP 104 44.320 35.020 39.960 1.00 0.00 ATOM 12986 H12X POP 104 44.800 34.120 39.520 1.00 0.00 ATOM 12987 H12Y POP 104 43.230 35.050 39.750 1.00 0.00 ATOM 12988 3C31 POP 104 44.500 35.070 41.480 1.00 0.00 ATOM 12989 H13X POP 104 44.560 36.110 41.840 1.00 0.00 ATOM 12990 H13Y POP 104 45.460 34.590 41.780 1.00 0.00 ATOM 12991 4C31 POP 104 43.300 34.440 42.190 1.00 0.00 ATOM 12992 H14X POP 104 43.120 33.420 41.780 1.00 0.00 ATOM 12993 H14Y POP 104 42.440 35.120 42.050 1.00 0.00 ATOM 12994 5C31 POP 104 43.510 34.320 43.700 1.00 0.00 ATOM 12995 H15X POP 104 43.980 35.240 44.130 1.00 0.00 ATOM 12996 H15Y POP 104 44.390 33.670 43.880 1.00 0.00 ATOM 12997 6C31 POP 104 42.300 33.840 44.490 1.00 0.00 ATOM 12998 H16X POP 104 42.510 33.660 45.560 1.00 0.00 ATOM 12999 H16Y POP 104 41.910 32.890 44.050 1.00 0.00 ATOM 13000 H16Z POP 104 41.560 34.660 44.430 1.00 0.00 ATOM 13001 N POP 105 29.950 32.630 22.750 1.00 0.00 ATOM 13002 HN1 POP 105 30.680 32.140 22.190 1.00 0.00 ATOM 13003 HN2 POP 105 29.890 33.640 22.490 1.00 0.00 ATOM 13004 HN3 POP 105 30.380 32.600 23.690 1.00 0.00 ATOM 13005 C12 POP 105 28.610 31.930 22.760 1.00 0.00 ATOM 13006 H12A POP 105 28.870 30.930 23.170 1.00 0.00 ATOM 13007 H12B POP 105 28.320 31.800 21.690 1.00 0.00 ATOM 13008 C11 POP 105 27.600 32.720 23.590 1.00 0.00 ATOM 13009 H11A POP 105 26.650 32.200 23.370 1.00 0.00 ATOM 13010 H11B POP 105 27.430 33.760 23.220 1.00 0.00 ATOM 13011 P POP 105 27.200 33.930 25.730 1.00 0.00 ATOM 13012 O13 POP 105 27.780 35.240 25.370 1.00 0.00 ATOM 13013 O14 POP 105 25.770 33.870 25.370 1.00 0.00 ATOM 13014 O11 POP 105 27.470 33.460 27.230 1.00 0.00 ATOM 13015 O12 POP 105 27.890 32.690 24.990 1.00 0.00 ATOM 13016 C1 POP 105 28.840 33.520 27.650 1.00 0.00 ATOM 13017 HA POP 105 29.040 34.330 28.390 1.00 0.00 ATOM 13018 HB POP 105 29.540 33.690 26.810 1.00 0.00 ATOM 13019 C2 POP 105 29.280 32.190 28.270 1.00 0.00 ATOM 13020 HS POP 105 29.360 31.480 27.420 1.00 0.00 ATOM 13021 O21 POP 105 28.260 31.770 29.190 1.00 0.00 ATOM 13022 C21 POP 105 28.360 30.470 29.480 1.00 0.00 ATOM 13023 O22 POP 105 29.010 29.630 28.880 1.00 0.00 ATOM 13024 C22 POP 105 27.430 30.070 30.620 1.00 0.00 ATOM 13025 H2R POP 105 26.920 29.100 30.430 1.00 0.00 ATOM 13026 H2S POP 105 26.700 30.900 30.720 1.00 0.00 ATOM 13027 C3 POP 105 30.680 32.310 28.890 1.00 0.00 ATOM 13028 HX POP 105 31.330 32.630 28.050 1.00 0.00 ATOM 13029 HY POP 105 30.960 31.310 29.270 1.00 0.00 ATOM 13030 O31 POP 105 30.660 33.330 29.900 1.00 0.00 ATOM 13031 C31 POP 105 31.870 33.860 30.070 1.00 0.00 ATOM 13032 O32 POP 105 32.890 33.410 29.580 1.00 0.00 ATOM 13033 C32 POP 105 31.640 35.000 31.050 1.00 0.00 ATOM 13034 H2X POP 105 30.900 34.700 31.830 1.00 0.00 ATOM 13035 H2Y POP 105 31.300 35.840 30.410 1.00 0.00 ATOM 13036 C23 POP 105 28.210 29.860 31.920 1.00 0.00 ATOM 13037 H3R POP 105 28.530 30.890 32.190 1.00 0.00 ATOM 13038 H3S POP 105 29.190 29.370 31.750 1.00 0.00 ATOM 13039 C24 POP 105 27.410 29.180 33.030 1.00 0.00 ATOM 13040 H4R POP 105 27.900 29.340 34.020 1.00 0.00 ATOM 13041 H4S POP 105 27.560 28.090 32.870 1.00 0.00 ATOM 13042 C25 POP 105 25.990 29.700 33.290 1.00 0.00 ATOM 13043 H5R POP 105 25.400 29.700 32.350 1.00 0.00 ATOM 13044 H5S POP 105 26.120 30.750 33.620 1.00 0.00 ATOM 13045 C26 POP 105 25.260 28.980 34.430 1.00 0.00 ATOM 13046 H6R POP 105 25.220 27.900 34.170 1.00 0.00 ATOM 13047 H6S POP 105 24.190 29.250 34.460 1.00 0.00 ATOM 13048 C27 POP 105 25.930 29.130 35.790 1.00 0.00 ATOM 13049 H7R POP 105 26.110 30.200 36.020 1.00 0.00 ATOM 13050 H7S POP 105 26.980 28.750 35.820 1.00 0.00 ATOM 13051 C28 POP 105 25.350 28.380 36.980 1.00 0.00 ATOM 13052 H8R POP 105 26.200 28.620 37.660 1.00 0.00 ATOM 13053 H8S POP 105 25.380 27.300 36.700 1.00 0.00 ATOM 13054 C29 POP 105 24.050 28.880 37.540 1.00 0.00 ATOM 13055 H91 POP 105 23.130 28.340 37.270 1.00 0.00 ATOM 13056 0C21 POP 105 24.000 29.950 38.350 1.00 0.00 ATOM 13057 1H10 POP 105 22.990 30.140 38.740 1.00 0.00 ATOM 13058 1C21 POP 105 25.210 30.710 38.820 1.00 0.00 ATOM 13059 H11R POP 105 25.720 31.290 38.030 1.00 0.00 ATOM 13060 H11S POP 105 25.850 29.950 39.340 1.00 0.00 ATOM 13061 2C21 POP 105 24.590 31.730 39.780 1.00 0.00 ATOM 13062 H12R POP 105 23.980 31.200 40.540 1.00 0.00 ATOM 13063 H12S POP 105 23.880 32.330 39.170 1.00 0.00 ATOM 13064 3C21 POP 105 25.500 32.730 40.490 1.00 0.00 ATOM 13065 H13R POP 105 26.040 33.250 39.660 1.00 0.00 ATOM 13066 H13S POP 105 26.230 32.290 41.200 1.00 0.00 ATOM 13067 4C21 POP 105 24.830 33.860 41.280 1.00 0.00 ATOM 13068 H14R POP 105 24.420 33.470 42.230 1.00 0.00 ATOM 13069 H14S POP 105 24.040 34.260 40.610 1.00 0.00 ATOM 13070 5C21 POP 105 25.790 34.960 41.730 1.00 0.00 ATOM 13071 H15R POP 105 25.000 35.720 41.920 1.00 0.00 ATOM 13072 H15S POP 105 26.510 35.310 40.970 1.00 0.00 ATOM 13073 6C21 POP 105 26.480 34.550 43.040 1.00 0.00 ATOM 13074 H16R POP 105 26.740 33.470 43.100 1.00 0.00 ATOM 13075 H16S POP 105 25.780 34.920 43.810 1.00 0.00 ATOM 13076 7C21 POP 105 27.680 35.420 43.430 1.00 0.00 ATOM 13077 H17R POP 105 28.370 35.270 42.570 1.00 0.00 ATOM 13078 H17S POP 105 28.100 35.000 44.370 1.00 0.00 ATOM 13079 8C21 POP 105 27.310 36.880 43.690 1.00 0.00 ATOM 13080 H18R POP 105 26.830 37.340 42.810 1.00 0.00 ATOM 13081 H18S POP 105 28.260 37.410 43.900 1.00 0.00 ATOM 13082 H18T POP 105 26.530 36.910 44.490 1.00 0.00 ATOM 13083 C33 POP 105 32.970 35.240 31.760 1.00 0.00 ATOM 13084 H3X POP 105 33.680 35.740 31.060 1.00 0.00 ATOM 13085 H3Y POP 105 33.380 34.270 32.110 1.00 0.00 ATOM 13086 C34 POP 105 32.800 36.120 33.000 1.00 0.00 ATOM 13087 H4X POP 105 31.980 36.870 32.930 1.00 0.00 ATOM 13088 H4Y POP 105 33.790 36.620 33.110 1.00 0.00 ATOM 13089 C35 POP 105 32.530 35.340 34.290 1.00 0.00 ATOM 13090 H5X POP 105 31.680 34.630 34.200 1.00 0.00 ATOM 13091 H5Y POP 105 32.320 36.060 35.110 1.00 0.00 ATOM 13092 C36 POP 105 33.770 34.570 34.730 1.00 0.00 ATOM 13093 H6X POP 105 34.670 35.220 34.650 1.00 0.00 ATOM 13094 H6Y POP 105 33.950 33.720 34.030 1.00 0.00 ATOM 13095 C37 POP 105 33.700 34.030 36.160 1.00 0.00 ATOM 13096 H7X POP 105 32.970 33.190 36.230 1.00 0.00 ATOM 13097 H7Y POP 105 33.390 34.840 36.850 1.00 0.00 ATOM 13098 C38 POP 105 35.030 33.670 36.830 1.00 0.00 ATOM 13099 H8X POP 105 35.830 34.430 36.740 1.00 0.00 ATOM 13100 H8Y POP 105 35.390 32.820 36.210 1.00 0.00 ATOM 13101 C39 POP 105 35.000 33.330 38.320 1.00 0.00 ATOM 13102 H9X POP 105 34.810 34.270 38.880 1.00 0.00 ATOM 13103 H9Y POP 105 35.990 33.000 38.700 1.00 0.00 ATOM 13104 0C31 POP 105 33.920 32.340 38.750 1.00 0.00 ATOM 13105 H10X POP 105 34.020 31.550 37.970 1.00 0.00 ATOM 13106 H10Y POP 105 32.870 32.720 38.690 1.00 0.00 ATOM 13107 1C31 POP 105 34.030 31.950 40.220 1.00 0.00 ATOM 13108 H11X POP 105 33.190 31.260 40.460 1.00 0.00 ATOM 13109 H11Y POP 105 33.900 32.730 41.000 1.00 0.00 ATOM 13110 2C31 POP 105 35.300 31.210 40.620 1.00 0.00 ATOM 13111 H12X POP 105 36.300 31.690 40.550 1.00 0.00 ATOM 13112 H12Y POP 105 35.340 30.340 39.930 1.00 0.00 ATOM 13113 3C31 POP 105 35.340 30.720 42.070 1.00 0.00 ATOM 13114 H13X POP 105 34.500 30.000 42.200 1.00 0.00 ATOM 13115 H13Y POP 105 35.190 31.620 42.710 1.00 0.00 ATOM 13116 4C31 POP 105 36.650 30.040 42.460 1.00 0.00 ATOM 13117 H14X POP 105 37.500 30.620 42.050 1.00 0.00 ATOM 13118 H14Y POP 105 36.720 29.060 41.940 1.00 0.00 ATOM 13119 5C31 POP 105 36.830 29.880 43.970 1.00 0.00 ATOM 13120 H15X POP 105 37.260 30.850 44.310 1.00 0.00 ATOM 13121 H15Y POP 105 37.550 29.070 44.220 1.00 0.00 ATOM 13122 6C31 POP 105 35.540 29.570 44.720 1.00 0.00 ATOM 13123 H16X POP 105 35.020 28.650 44.380 1.00 0.00 ATOM 13124 H16Y POP 105 34.750 30.350 44.680 1.00 0.00 ATOM 13125 H16Z POP 105 35.800 29.510 45.800 1.00 0.00 ATOM 13126 N POP 106 58.890 3.570 20.720 1.00 0.00 ATOM 13127 HN1 POP 106 58.280 4.130 21.350 1.00 0.00 ATOM 13128 HN2 POP 106 58.500 3.440 19.770 1.00 0.00 ATOM 13129 HN3 POP 106 59.020 2.630 21.150 1.00 0.00 ATOM 13130 C12 POP 106 60.190 4.290 20.460 1.00 0.00 ATOM 13131 H12A POP 106 60.010 5.320 20.090 1.00 0.00 ATOM 13132 H12B POP 106 60.750 3.790 19.640 1.00 0.00 ATOM 13133 C11 POP 106 61.110 4.210 21.680 1.00 0.00 ATOM 13134 H11A POP 106 61.990 4.870 21.510 1.00 0.00 ATOM 13135 H11B POP 106 61.460 3.160 21.750 1.00 0.00 ATOM 13136 P POP 106 60.470 6.100 23.310 1.00 0.00 ATOM 13137 O13 POP 106 59.120 6.490 23.790 1.00 0.00 ATOM 13138 O14 POP 106 61.010 6.950 22.230 1.00 0.00 ATOM 13139 O11 POP 106 61.470 6.080 24.560 1.00 0.00 ATOM 13140 O12 POP 106 60.370 4.570 22.850 1.00 0.00 ATOM 13141 C1 POP 106 61.710 4.790 25.140 1.00 0.00 ATOM 13142 HA POP 106 62.480 5.010 25.910 1.00 0.00 ATOM 13143 HB POP 106 62.120 4.040 24.440 1.00 0.00 ATOM 13144 C2 POP 106 60.530 4.180 25.910 1.00 0.00 ATOM 13145 HS POP 106 59.720 3.930 25.190 1.00 0.00 ATOM 13146 O21 POP 106 60.150 5.250 26.780 1.00 0.00 ATOM 13147 C21 POP 106 58.920 5.100 27.270 1.00 0.00 ATOM 13148 O22 POP 106 58.200 4.130 27.090 1.00 0.00 ATOM 13149 C22 POP 106 58.770 6.330 28.150 1.00 0.00 ATOM 13150 H2R POP 106 59.070 7.220 27.550 1.00 0.00 ATOM 13151 H2S POP 106 59.320 6.090 29.080 1.00 0.00 ATOM 13152 C3 POP 106 60.940 2.990 26.790 1.00 0.00 ATOM 13153 HX POP 106 61.680 2.310 26.300 1.00 0.00 ATOM 13154 HY POP 106 59.990 2.460 27.020 1.00 0.00 ATOM 13155 O31 POP 106 61.460 3.290 28.090 1.00 0.00 ATOM 13156 C31 POP 106 62.750 3.060 28.320 1.00 0.00 ATOM 13157 O32 POP 106 63.560 2.590 27.530 1.00 0.00 ATOM 13158 C32 POP 106 63.040 3.490 29.750 1.00 0.00 ATOM 13159 H2X POP 106 62.150 3.580 30.410 1.00 0.00 ATOM 13160 H2Y POP 106 63.600 4.440 29.670 1.00 0.00 ATOM 13161 C23 POP 106 57.310 6.460 28.610 1.00 0.00 ATOM 13162 H3R POP 106 56.620 5.740 28.120 1.00 0.00 ATOM 13163 H3S POP 106 56.890 7.450 28.310 1.00 0.00 ATOM 13164 C24 POP 106 57.220 6.390 30.130 1.00 0.00 ATOM 13165 H4R POP 106 57.750 7.300 30.490 1.00 0.00 ATOM 13166 H4S POP 106 57.560 5.400 30.500 1.00 0.00 ATOM 13167 C25 POP 106 55.720 6.630 30.370 1.00 0.00 ATOM 13168 H5R POP 106 55.060 6.270 29.550 1.00 0.00 ATOM 13169 H5S POP 106 55.540 7.720 30.430 1.00 0.00 ATOM 13170 C26 POP 106 55.280 6.000 31.700 1.00 0.00 ATOM 13171 H6R POP 106 55.950 6.270 32.540 1.00 0.00 ATOM 13172 H6S POP 106 55.360 4.890 31.590 1.00 0.00 ATOM 13173 C27 POP 106 53.830 6.300 32.090 1.00 0.00 ATOM 13174 H7R POP 106 53.140 5.780 31.390 1.00 0.00 ATOM 13175 H7S POP 106 53.720 7.400 32.190 1.00 0.00 ATOM 13176 C28 POP 106 53.560 5.740 33.490 1.00 0.00 ATOM 13177 H8R POP 106 54.150 6.340 34.210 1.00 0.00 ATOM 13178 H8S POP 106 53.960 4.720 33.650 1.00 0.00 ATOM 13179 C29 POP 106 52.070 5.840 33.670 1.00 0.00 ATOM 13180 H91 POP 106 51.750 6.660 33.010 1.00 0.00 ATOM 13181 0C21 POP 106 51.260 5.330 34.600 1.00 0.00 ATOM 13182 1H10 POP 106 50.210 5.680 34.610 1.00 0.00 ATOM 13183 1C21 POP 106 51.500 4.300 35.670 1.00 0.00 ATOM 13184 H11R POP 106 52.470 4.570 36.150 1.00 0.00 ATOM 13185 H11S POP 106 51.640 3.300 35.220 1.00 0.00 ATOM 13186 2C21 POP 106 50.410 4.210 36.740 1.00 0.00 ATOM 13187 H12R POP 106 49.530 3.650 36.330 1.00 0.00 ATOM 13188 H12S POP 106 50.050 5.230 37.000 1.00 0.00 ATOM 13189 3C21 POP 106 50.760 3.380 37.980 1.00 0.00 ATOM 13190 H13R POP 106 50.990 2.310 37.810 1.00 0.00 ATOM 13191 H13S POP 106 49.770 3.430 38.480 1.00 0.00 ATOM 13192 4C21 POP 106 51.790 4.110 38.840 1.00 0.00 ATOM 13193 H14R POP 106 51.700 5.220 38.720 1.00 0.00 ATOM 13194 H14S POP 106 52.830 3.840 38.580 1.00 0.00 ATOM 13195 5C21 POP 106 51.530 3.800 40.320 1.00 0.00 ATOM 13196 H15R POP 106 51.550 2.690 40.220 1.00 0.00 ATOM 13197 H15S POP 106 50.500 4.050 40.650 1.00 0.00 ATOM 13198 6C21 POP 106 52.550 4.030 41.430 1.00 0.00 ATOM 13199 H16R POP 106 53.570 4.040 40.990 1.00 0.00 ATOM 13200 H16S POP 106 52.650 3.130 42.080 1.00 0.00 ATOM 13201 7C21 POP 106 52.480 5.400 42.110 1.00 0.00 ATOM 13202 H17R POP 106 51.520 5.520 42.650 1.00 0.00 ATOM 13203 H17S POP 106 52.710 6.170 41.340 1.00 0.00 ATOM 13204 8C21 POP 106 53.450 5.520 43.290 1.00 0.00 ATOM 13205 H18R POP 106 54.510 5.580 42.980 1.00 0.00 ATOM 13206 H18S POP 106 53.200 4.720 44.020 1.00 0.00 ATOM 13207 H18T POP 106 53.290 6.490 43.820 1.00 0.00 ATOM 13208 C33 POP 106 63.970 2.510 30.460 1.00 0.00 ATOM 13209 H3X POP 106 64.980 2.510 29.990 1.00 0.00 ATOM 13210 H3Y POP 106 63.450 1.560 30.220 1.00 0.00 ATOM 13211 C34 POP 106 64.040 2.620 31.980 1.00 0.00 ATOM 13212 H4X POP 106 64.610 1.790 32.460 1.00 0.00 ATOM 13213 H4Y POP 106 62.980 2.390 32.240 1.00 0.00 ATOM 13214 C35 POP 106 64.550 4.000 32.380 1.00 0.00 ATOM 13215 H5X POP 106 63.850 4.760 31.970 1.00 0.00 ATOM 13216 H5Y POP 106 65.540 4.020 31.890 1.00 0.00 ATOM 13217 C36 POP 106 64.620 4.140 33.900 1.00 0.00 ATOM 13218 H6X POP 106 65.290 3.360 34.320 1.00 0.00 ATOM 13219 H6Y POP 106 63.640 3.960 34.390 1.00 0.00 ATOM 13220 C37 POP 106 65.170 5.510 34.330 1.00 0.00 ATOM 13221 H7X POP 106 64.450 6.320 34.080 1.00 0.00 ATOM 13222 H7Y POP 106 66.170 5.850 33.990 1.00 0.00 ATOM 13223 C38 POP 106 65.310 5.500 35.850 1.00 0.00 ATOM 13224 H8X POP 106 66.100 4.750 36.110 1.00 0.00 ATOM 13225 H8Y POP 106 64.360 5.070 36.220 1.00 0.00 ATOM 13226 C39 POP 106 65.640 6.850 36.480 1.00 0.00 ATOM 13227 H9X POP 106 64.890 7.600 36.120 1.00 0.00 ATOM 13228 H9Y POP 106 66.680 7.230 36.380 1.00 0.00 ATOM 13229 0C31 POP 106 65.420 6.760 37.990 1.00 0.00 ATOM 13230 H10X POP 106 66.250 6.280 38.550 1.00 0.00 ATOM 13231 H10Y POP 106 64.490 6.320 38.410 1.00 0.00 ATOM 13232 1C31 POP 106 65.320 8.170 38.590 1.00 0.00 ATOM 13233 H11X POP 106 64.360 8.580 38.220 1.00 0.00 ATOM 13234 H11Y POP 106 66.140 8.790 38.160 1.00 0.00 ATOM 13235 2C31 POP 106 65.350 8.160 40.120 1.00 0.00 ATOM 13236 H12X POP 106 66.080 7.530 40.670 1.00 0.00 ATOM 13237 H12Y POP 106 64.390 7.650 40.370 1.00 0.00 ATOM 13238 3C31 POP 106 65.370 9.530 40.800 1.00 0.00 ATOM 13239 H13X POP 106 65.280 9.430 41.900 1.00 0.00 ATOM 13240 H13Y POP 106 64.440 10.020 40.460 1.00 0.00 ATOM 13241 4C31 POP 106 66.640 10.280 40.380 1.00 0.00 ATOM 13242 H14X POP 106 67.420 9.700 39.850 1.00 0.00 ATOM 13243 H14Y POP 106 67.120 10.580 41.330 1.00 0.00 ATOM 13244 5C31 POP 106 66.260 11.520 39.570 1.00 0.00 ATOM 13245 H15X POP 106 65.670 12.260 40.150 1.00 0.00 ATOM 13246 H15Y POP 106 65.590 11.200 38.740 1.00 0.00 ATOM 13247 6C31 POP 106 67.460 12.280 39.020 1.00 0.00 ATOM 13248 H16X POP 106 68.100 11.500 38.560 1.00 0.00 ATOM 13249 H16Y POP 106 67.890 13.040 39.700 1.00 0.00 ATOM 13250 H16Z POP 106 67.060 12.790 38.110 1.00 0.00 ATOM 13251 N POP 107 43.390 9.440 21.610 1.00 0.00 ATOM 13252 HN1 POP 107 43.930 9.400 20.720 1.00 0.00 ATOM 13253 HN2 POP 107 42.380 9.470 21.330 1.00 0.00 ATOM 13254 HN3 POP 107 43.600 10.330 22.100 1.00 0.00 ATOM 13255 C12 POP 107 43.770 8.230 22.430 1.00 0.00 ATOM 13256 H12A POP 107 43.130 8.230 23.340 1.00 0.00 ATOM 13257 H12B POP 107 44.840 8.360 22.700 1.00 0.00 ATOM 13258 C11 POP 107 43.640 6.950 21.610 1.00 0.00 ATOM 13259 H11A POP 107 43.580 6.060 22.270 1.00 0.00 ATOM 13260 H11B POP 107 44.500 6.930 20.900 1.00 0.00 ATOM 13261 P POP 107 41.800 5.680 20.390 1.00 0.00 ATOM 13262 O13 POP 107 42.720 4.520 20.350 1.00 0.00 ATOM 13263 O14 POP 107 40.880 5.910 19.250 1.00 0.00 ATOM 13264 O11 POP 107 40.820 5.540 21.640 1.00 0.00 ATOM 13265 O12 POP 107 42.510 7.070 20.740 1.00 0.00 ATOM 13266 C1 POP 107 40.240 6.530 22.500 1.00 0.00 ATOM 13267 HA POP 107 39.150 6.600 22.300 1.00 0.00 ATOM 13268 HB POP 107 40.660 7.530 22.250 1.00 0.00 ATOM 13269 C2 POP 107 40.500 6.210 23.980 1.00 0.00 ATOM 13270 HS POP 107 41.600 6.070 24.050 1.00 0.00 ATOM 13271 O21 POP 107 39.650 5.130 24.390 1.00 0.00 ATOM 13272 C21 POP 107 40.280 4.230 25.140 1.00 0.00 ATOM 13273 O22 POP 107 41.390 4.310 25.640 1.00 0.00 ATOM 13274 C22 POP 107 39.200 3.220 25.490 1.00 0.00 ATOM 13275 H2R POP 107 39.100 2.480 24.670 1.00 0.00 ATOM 13276 H2S POP 107 38.290 3.820 25.700 1.00 0.00 ATOM 13277 C3 POP 107 40.280 7.410 24.910 1.00 0.00 ATOM 13278 HX POP 107 39.260 7.730 24.600 1.00 0.00 ATOM 13279 HY POP 107 40.950 8.260 24.650 1.00 0.00 ATOM 13280 O31 POP 107 40.230 7.120 26.310 1.00 0.00 ATOM 13281 C31 POP 107 41.410 7.210 26.920 1.00 0.00 ATOM 13282 O32 POP 107 42.410 7.770 26.480 1.00 0.00 ATOM 13283 C32 POP 107 41.250 6.700 28.340 1.00 0.00 ATOM 13284 H2X POP 107 42.180 6.860 28.930 1.00 0.00 ATOM 13285 H2Y POP 107 41.220 5.600 28.170 1.00 0.00 ATOM 13286 C23 POP 107 39.540 2.560 26.830 1.00 0.00 ATOM 13287 H3R POP 107 40.200 3.160 27.490 1.00 0.00 ATOM 13288 H3S POP 107 40.070 1.620 26.570 1.00 0.00 ATOM 13289 C24 POP 107 38.260 2.230 27.600 1.00 0.00 ATOM 13290 H4R POP 107 37.770 3.130 28.020 1.00 0.00 ATOM 13291 H4S POP 107 38.530 1.630 28.500 1.00 0.00 ATOM 13292 C25 POP 107 37.130 1.620 26.780 1.00 0.00 ATOM 13293 H5R POP 107 37.540 0.710 26.300 1.00 0.00 ATOM 13294 H5S POP 107 36.820 2.280 25.940 1.00 0.00 ATOM 13295 C26 POP 107 35.790 1.390 27.490 1.00 0.00 ATOM 13296 H6R POP 107 35.380 2.340 27.890 1.00 0.00 ATOM 13297 H6S POP 107 35.940 0.760 28.390 1.00 0.00 ATOM 13298 C27 POP 107 34.740 0.660 26.650 1.00 0.00 ATOM 13299 H7R POP 107 35.180 -0.300 26.300 1.00 0.00 ATOM 13300 H7S POP 107 34.530 1.280 25.750 1.00 0.00 ATOM 13301 C28 POP 107 33.420 0.480 27.400 1.00 0.00 ATOM 13302 H8R POP 107 33.500 -0.120 28.330 1.00 0.00 ATOM 13303 H8S POP 107 32.760 -0.260 26.900 1.00 0.00 ATOM 13304 C29 POP 107 32.820 1.850 27.540 1.00 0.00 ATOM 13305 H91 POP 107 32.810 2.410 26.590 1.00 0.00 ATOM 13306 0C21 POP 107 32.360 2.380 28.680 1.00 0.00 ATOM 13307 1H10 POP 107 32.150 3.460 28.740 1.00 0.00 ATOM 13308 1C21 POP 107 32.440 1.750 30.040 1.00 0.00 ATOM 13309 H11R POP 107 33.450 1.870 30.490 1.00 0.00 ATOM 13310 H11S POP 107 32.260 0.650 30.020 1.00 0.00 ATOM 13311 2C21 POP 107 31.410 2.370 30.990 1.00 0.00 ATOM 13312 H12R POP 107 30.350 2.300 30.660 1.00 0.00 ATOM 13313 H12S POP 107 31.670 3.440 31.060 1.00 0.00 ATOM 13314 3C21 POP 107 31.460 1.730 32.380 1.00 0.00 ATOM 13315 H13R POP 107 30.880 2.410 33.030 1.00 0.00 ATOM 13316 H13S POP 107 32.540 1.700 32.670 1.00 0.00 ATOM 13317 4C21 POP 107 30.770 0.370 32.510 1.00 0.00 ATOM 13318 H14R POP 107 31.220 -0.370 31.820 1.00 0.00 ATOM 13319 H14S POP 107 29.720 0.540 32.180 1.00 0.00 ATOM 13320 5C21 POP 107 30.770 -0.060 33.980 1.00 0.00 ATOM 13321 H15R POP 107 30.050 0.640 34.460 1.00 0.00 ATOM 13322 H15S POP 107 31.800 0.120 34.360 1.00 0.00 ATOM 13323 6C21 POP 107 30.340 -1.530 34.030 1.00 0.00 ATOM 13324 H16R POP 107 30.430 -1.830 35.090 1.00 0.00 ATOM 13325 H16S POP 107 31.010 -2.180 33.420 1.00 0.00 ATOM 13326 7C21 POP 107 28.860 -1.740 33.710 1.00 0.00 ATOM 13327 H17R POP 107 28.630 -1.350 32.700 1.00 0.00 ATOM 13328 H17S POP 107 28.330 -1.050 34.390 1.00 0.00 ATOM 13329 8C21 POP 107 28.340 -3.170 33.850 1.00 0.00 ATOM 13330 H18R POP 107 28.870 -3.880 33.190 1.00 0.00 ATOM 13331 H18S POP 107 27.280 -3.050 33.530 1.00 0.00 ATOM 13332 H18T POP 107 28.350 -3.490 34.920 1.00 0.00 ATOM 13333 C33 POP 107 40.040 7.240 29.110 1.00 0.00 ATOM 13334 H3X POP 107 39.180 7.560 28.480 1.00 0.00 ATOM 13335 H3Y POP 107 40.430 8.110 29.680 1.00 0.00 ATOM 13336 C34 POP 107 39.410 6.200 30.030 1.00 0.00 ATOM 13337 H4X POP 107 40.230 5.550 30.400 1.00 0.00 ATOM 13338 H4Y POP 107 38.630 5.570 29.550 1.00 0.00 ATOM 13339 C35 POP 107 38.730 6.850 31.240 1.00 0.00 ATOM 13340 H5X POP 107 37.850 6.260 31.580 1.00 0.00 ATOM 13341 H5Y POP 107 38.330 7.840 30.930 1.00 0.00 ATOM 13342 C36 POP 107 39.690 7.080 32.400 1.00 0.00 ATOM 13343 H6X POP 107 40.590 7.530 31.940 1.00 0.00 ATOM 13344 H6Y POP 107 39.990 6.150 32.930 1.00 0.00 ATOM 13345 C37 POP 107 39.190 8.120 33.410 1.00 0.00 ATOM 13346 H7X POP 107 38.860 9.080 32.950 1.00 0.00 ATOM 13347 H7Y POP 107 40.030 8.280 34.110 1.00 0.00 ATOM 13348 C38 POP 107 37.920 7.660 34.140 1.00 0.00 ATOM 13349 H8X POP 107 37.300 7.030 33.460 1.00 0.00 ATOM 13350 H8Y POP 107 37.320 8.560 34.380 1.00 0.00 ATOM 13351 C39 POP 107 38.140 6.820 35.400 1.00 0.00 ATOM 13352 H9X POP 107 38.750 7.510 36.010 1.00 0.00 ATOM 13353 H9Y POP 107 38.810 5.940 35.310 1.00 0.00 ATOM 13354 0C31 POP 107 36.850 6.430 36.130 1.00 0.00 ATOM 13355 H10X POP 107 36.380 7.290 36.660 1.00 0.00 ATOM 13356 H10Y POP 107 37.040 5.630 36.870 1.00 0.00 ATOM 13357 1C31 POP 107 35.730 5.930 35.210 1.00 0.00 ATOM 13358 H11X POP 107 35.360 6.690 34.490 1.00 0.00 ATOM 13359 H11Y POP 107 34.810 5.900 35.840 1.00 0.00 ATOM 13360 2C31 POP 107 36.040 4.740 34.310 1.00 0.00 ATOM 13361 H12X POP 107 35.970 3.850 34.980 1.00 0.00 ATOM 13362 H12Y POP 107 37.140 4.670 34.140 1.00 0.00 ATOM 13363 3C31 POP 107 35.160 4.480 33.090 1.00 0.00 ATOM 13364 H13X POP 107 35.260 5.360 32.420 1.00 0.00 ATOM 13365 H13Y POP 107 34.090 4.390 33.390 1.00 0.00 ATOM 13366 4C31 POP 107 35.520 3.230 32.290 1.00 0.00 ATOM 13367 H14X POP 107 34.900 3.330 31.370 1.00 0.00 ATOM 13368 H14Y POP 107 35.340 2.240 32.770 1.00 0.00 ATOM 13369 5C31 POP 107 36.970 3.330 31.820 1.00 0.00 ATOM 13370 H15X POP 107 37.670 3.180 32.660 1.00 0.00 ATOM 13371 H15Y POP 107 37.240 4.340 31.430 1.00 0.00 ATOM 13372 6C31 POP 107 37.350 2.190 30.880 1.00 0.00 ATOM 13373 H16X POP 107 37.180 2.530 29.830 1.00 0.00 ATOM 13374 H16Y POP 107 36.840 1.230 31.080 1.00 0.00 ATOM 13375 H16Z POP 107 38.420 1.940 31.050 1.00 0.00 ATOM 13376 N POP 108 39.160 13.640 23.630 1.00 0.00 ATOM 13377 HN1 POP 108 39.230 12.830 24.270 1.00 0.00 ATOM 13378 HN2 POP 108 39.210 14.490 24.230 1.00 0.00 ATOM 13379 HN3 POP 108 38.260 13.490 23.150 1.00 0.00 ATOM 13380 C12 POP 108 40.290 13.540 22.620 1.00 0.00 ATOM 13381 H12A POP 108 41.130 13.500 23.340 1.00 0.00 ATOM 13382 H12B POP 108 40.450 14.410 21.960 1.00 0.00 ATOM 13383 C11 POP 108 40.180 12.340 21.670 1.00 0.00 ATOM 13384 H11A POP 108 41.160 11.990 21.290 1.00 0.00 ATOM 13385 H11B POP 108 39.710 12.840 20.800 1.00 0.00 ATOM 13386 P POP 108 39.370 10.140 21.390 1.00 0.00 ATOM 13387 O13 POP 108 40.730 9.620 21.110 1.00 0.00 ATOM 13388 O14 POP 108 38.650 10.520 20.150 1.00 0.00 ATOM 13389 O11 POP 108 38.600 9.000 22.190 1.00 0.00 ATOM 13390 O12 POP 108 39.420 11.380 22.410 1.00 0.00 ATOM 13391 C1 POP 108 37.170 9.100 22.290 1.00 0.00 ATOM 13392 HA POP 108 36.830 8.040 22.350 1.00 0.00 ATOM 13393 HB POP 108 36.800 9.530 21.340 1.00 0.00 ATOM 13394 C2 POP 108 36.690 9.890 23.520 1.00 0.00 ATOM 13395 HS POP 108 36.770 10.980 23.330 1.00 0.00 ATOM 13396 O21 POP 108 37.500 9.470 24.630 1.00 0.00 ATOM 13397 C21 POP 108 37.740 10.450 25.500 1.00 0.00 ATOM 13398 O22 POP 108 37.510 11.630 25.250 1.00 0.00 ATOM 13399 C22 POP 108 38.190 9.800 26.800 1.00 0.00 ATOM 13400 H2R POP 108 39.300 9.760 26.830 1.00 0.00 ATOM 13401 H2S POP 108 37.840 8.750 26.880 1.00 0.00 ATOM 13402 C3 POP 108 35.220 9.480 23.710 1.00 0.00 ATOM 13403 HX POP 108 35.130 8.400 23.470 1.00 0.00 ATOM 13404 HY POP 108 34.660 10.040 22.940 1.00 0.00 ATOM 13405 O31 POP 108 34.790 9.770 25.050 1.00 0.00 ATOM 13406 C31 POP 108 33.480 9.970 25.200 1.00 0.00 ATOM 13407 O32 POP 108 32.590 9.740 24.400 1.00 0.00 ATOM 13408 C32 POP 108 33.290 10.460 26.630 1.00 0.00 ATOM 13409 H2X POP 108 34.170 11.100 26.850 1.00 0.00 ATOM 13410 H2Y POP 108 33.310 9.570 27.280 1.00 0.00 ATOM 13411 C23 POP 108 37.660 10.660 27.950 1.00 0.00 ATOM 13412 H3R POP 108 36.670 11.020 27.610 1.00 0.00 ATOM 13413 H3S POP 108 38.320 11.540 28.090 1.00 0.00 ATOM 13414 C24 POP 108 37.490 9.930 29.290 1.00 0.00 ATOM 13415 H4R POP 108 38.350 10.010 29.990 1.00 0.00 ATOM 13416 H4S POP 108 37.400 8.850 29.030 1.00 0.00 ATOM 13417 C25 POP 108 36.120 10.250 29.910 1.00 0.00 ATOM 13418 H5R POP 108 35.290 10.010 29.220 1.00 0.00 ATOM 13419 H5S POP 108 36.220 11.320 30.200 1.00 0.00 ATOM 13420 C26 POP 108 35.990 9.430 31.190 1.00 0.00 ATOM 13421 H6R POP 108 36.890 9.710 31.770 1.00 0.00 ATOM 13422 H6S POP 108 36.020 8.360 30.880 1.00 0.00 ATOM 13423 C27 POP 108 34.770 9.910 31.980 1.00 0.00 ATOM 13424 H7R POP 108 33.910 9.210 31.900 1.00 0.00 ATOM 13425 H7S POP 108 34.360 10.850 31.560 1.00 0.00 ATOM 13426 C28 POP 108 35.020 9.980 33.490 1.00 0.00 ATOM 13427 H8R POP 108 35.680 10.860 33.670 1.00 0.00 ATOM 13428 H8S POP 108 35.380 9.010 33.890 1.00 0.00 ATOM 13429 C29 POP 108 33.660 10.410 33.970 1.00 0.00 ATOM 13430 H91 POP 108 33.020 10.960 33.260 1.00 0.00 ATOM 13431 0C21 POP 108 33.160 10.020 35.150 1.00 0.00 ATOM 13432 1H10 POP 108 32.180 10.340 35.540 1.00 0.00 ATOM 13433 1C21 POP 108 33.880 9.300 36.250 1.00 0.00 ATOM 13434 H11R POP 108 34.580 9.990 36.770 1.00 0.00 ATOM 13435 H11S POP 108 34.530 8.480 35.880 1.00 0.00 ATOM 13436 2C21 POP 108 32.940 8.760 37.330 1.00 0.00 ATOM 13437 H12R POP 108 32.000 8.260 37.020 1.00 0.00 ATOM 13438 H12S POP 108 32.800 9.440 38.190 1.00 0.00 ATOM 13439 3C21 POP 108 33.640 7.650 38.120 1.00 0.00 ATOM 13440 H13R POP 108 34.450 8.120 38.730 1.00 0.00 ATOM 13441 H13S POP 108 34.080 6.890 37.440 1.00 0.00 ATOM 13442 4C21 POP 108 32.590 7.080 39.080 1.00 0.00 ATOM 13443 H14R POP 108 31.830 6.730 38.350 1.00 0.00 ATOM 13444 H14S POP 108 32.130 7.830 39.760 1.00 0.00 ATOM 13445 5C21 POP 108 32.980 5.790 39.800 1.00 0.00 ATOM 13446 H15R POP 108 33.970 6.060 40.230 1.00 0.00 ATOM 13447 H15S POP 108 33.160 5.020 39.020 1.00 0.00 ATOM 13448 6C21 POP 108 31.920 5.490 40.870 1.00 0.00 ATOM 13449 H16R POP 108 30.870 5.600 40.540 1.00 0.00 ATOM 13450 H16S POP 108 32.090 6.270 41.640 1.00 0.00 ATOM 13451 7C21 POP 108 32.010 4.130 41.560 1.00 0.00 ATOM 13452 H17R POP 108 31.410 4.230 42.490 1.00 0.00 ATOM 13453 H17S POP 108 33.080 4.040 41.870 1.00 0.00 ATOM 13454 8C21 POP 108 31.720 2.990 40.580 1.00 0.00 ATOM 13455 H18R POP 108 30.810 3.200 39.990 1.00 0.00 ATOM 13456 H18S POP 108 31.710 2.100 41.240 1.00 0.00 ATOM 13457 H18T POP 108 32.580 2.880 39.880 1.00 0.00 ATOM 13458 C33 POP 108 31.980 11.250 26.750 1.00 0.00 ATOM 13459 H3X POP 108 31.160 10.510 26.600 1.00 0.00 ATOM 13460 H3Y POP 108 31.880 12.000 25.950 1.00 0.00 ATOM 13461 C34 POP 108 31.850 12.010 28.070 1.00 0.00 ATOM 13462 H4X POP 108 30.930 12.630 28.110 1.00 0.00 ATOM 13463 H4Y POP 108 32.710 12.700 28.270 1.00 0.00 ATOM 13464 C35 POP 108 31.710 10.960 29.170 1.00 0.00 ATOM 13465 H5X POP 108 32.660 10.390 29.240 1.00 0.00 ATOM 13466 H5Y POP 108 30.880 10.280 28.900 1.00 0.00 ATOM 13467 C36 POP 108 31.510 11.510 30.580 1.00 0.00 ATOM 13468 H6X POP 108 32.140 12.420 30.720 1.00 0.00 ATOM 13469 H6Y POP 108 31.790 10.620 31.190 1.00 0.00 ATOM 13470 C37 POP 108 30.010 11.740 30.790 1.00 0.00 ATOM 13471 H7X POP 108 29.330 10.870 30.640 1.00 0.00 ATOM 13472 H7Y POP 108 29.710 12.520 30.050 1.00 0.00 ATOM 13473 C38 POP 108 29.630 12.210 32.190 1.00 0.00 ATOM 13474 H8X POP 108 28.600 12.650 32.180 1.00 0.00 ATOM 13475 H8Y POP 108 30.360 12.970 32.540 1.00 0.00 ATOM 13476 C39 POP 108 29.540 11.090 33.220 1.00 0.00 ATOM 13477 H9X POP 108 30.570 10.700 33.390 1.00 0.00 ATOM 13478 H9Y POP 108 28.860 10.290 32.860 1.00 0.00 ATOM 13479 0C31 POP 108 29.130 11.750 34.530 1.00 0.00 ATOM 13480 H10X POP 108 28.110 12.200 34.590 1.00 0.00 ATOM 13481 H10Y POP 108 29.860 12.530 34.820 1.00 0.00 ATOM 13482 1C31 POP 108 29.240 10.710 35.650 1.00 0.00 ATOM 13483 H11X POP 108 30.170 10.150 35.440 1.00 0.00 ATOM 13484 H11Y POP 108 28.390 10.020 35.440 1.00 0.00 ATOM 13485 2C31 POP 108 29.210 11.080 37.140 1.00 0.00 ATOM 13486 H12X POP 108 28.280 11.650 37.370 1.00 0.00 ATOM 13487 H12Y POP 108 30.090 11.680 37.430 1.00 0.00 ATOM 13488 3C31 POP 108 29.130 9.800 37.970 1.00 0.00 ATOM 13489 H13X POP 108 29.820 9.000 37.610 1.00 0.00 ATOM 13490 H13Y POP 108 28.110 9.390 38.120 1.00 0.00 ATOM 13491 4C31 POP 108 29.540 10.070 39.410 1.00 0.00 ATOM 13492 H14X POP 108 30.500 10.630 39.470 1.00 0.00 ATOM 13493 H14Y POP 108 29.600 9.100 39.940 1.00 0.00 ATOM 13494 5C31 POP 108 28.390 10.730 40.170 1.00 0.00 ATOM 13495 H15X POP 108 27.590 10.010 40.450 1.00 0.00 ATOM 13496 H15Y POP 108 27.970 11.530 39.520 1.00 0.00 ATOM 13497 6C31 POP 108 28.880 11.390 41.460 1.00 0.00 ATOM 13498 H16X POP 108 28.150 12.120 41.870 1.00 0.00 ATOM 13499 H16Y POP 108 29.810 11.970 41.260 1.00 0.00 ATOM 13500 H16Z POP 108 29.110 10.520 42.110 1.00 0.00 ATOM 13501 N POP 109 20.900 52.350 23.080 1.00 0.00 ATOM 13502 HN1 POP 109 21.520 51.520 22.990 1.00 0.00 ATOM 13503 HN2 POP 109 19.940 51.960 23.030 1.00 0.00 ATOM 13504 HN3 POP 109 20.980 52.920 22.210 1.00 0.00 ATOM 13505 C12 POP 109 21.110 53.100 24.370 1.00 0.00 ATOM 13506 H12A POP 109 22.200 53.270 24.510 1.00 0.00 ATOM 13507 H12B POP 109 20.600 52.520 25.170 1.00 0.00 ATOM 13508 C11 POP 109 20.420 54.460 24.220 1.00 0.00 ATOM 13509 H11A POP 109 21.090 55.020 23.540 1.00 0.00 ATOM 13510 H11B POP 109 20.350 54.990 25.190 1.00 0.00 ATOM 13511 P POP 109 18.240 55.530 23.720 1.00 0.00 ATOM 13512 O13 POP 109 17.180 55.500 22.690 1.00 0.00 ATOM 13513 O14 POP 109 19.160 56.690 23.730 1.00 0.00 ATOM 13514 O11 POP 109 17.760 55.360 25.240 1.00 0.00 ATOM 13515 O12 POP 109 19.140 54.220 23.630 1.00 0.00 ATOM 13516 C1 POP 109 16.970 54.260 25.700 1.00 0.00 ATOM 13517 HA POP 109 17.280 54.150 26.770 1.00 0.00 ATOM 13518 HB POP 109 17.240 53.240 25.370 1.00 0.00 ATOM 13519 C2 POP 109 15.490 54.690 25.650 1.00 0.00 ATOM 13520 HS POP 109 15.350 55.170 24.660 1.00 0.00 ATOM 13521 O21 POP 109 15.300 55.650 26.700 1.00 0.00 ATOM 13522 C21 POP 109 14.170 56.340 26.610 1.00 0.00 ATOM 13523 O22 POP 109 13.340 56.100 25.740 1.00 0.00 ATOM 13524 C22 POP 109 13.990 57.360 27.730 1.00 0.00 ATOM 13525 H2R POP 109 13.880 58.370 27.290 1.00 0.00 ATOM 13526 H2S POP 109 14.920 57.230 28.340 1.00 0.00 ATOM 13527 C3 POP 109 14.550 53.500 25.870 1.00 0.00 ATOM 13528 HX POP 109 14.930 52.640 25.270 1.00 0.00 ATOM 13529 HY POP 109 13.610 53.780 25.330 1.00 0.00 ATOM 13530 O31 POP 109 14.350 53.060 27.210 1.00 0.00 ATOM 13531 C31 POP 109 13.090 52.690 27.450 1.00 0.00 ATOM 13532 O32 POP 109 12.300 52.380 26.590 1.00 0.00 ATOM 13533 C32 POP 109 12.810 52.680 28.950 1.00 0.00 ATOM 13534 H2X POP 109 11.770 52.330 29.070 1.00 0.00 ATOM 13535 H2Y POP 109 12.920 53.740 29.270 1.00 0.00 ATOM 13536 C23 POP 109 12.650 57.170 28.450 1.00 0.00 ATOM 13537 H3R POP 109 12.810 56.380 29.220 1.00 0.00 ATOM 13538 H3S POP 109 11.760 56.880 27.860 1.00 0.00 ATOM 13539 C24 POP 109 12.160 58.400 29.210 1.00 0.00 ATOM 13540 H4R POP 109 12.070 59.280 28.540 1.00 0.00 ATOM 13541 H4S POP 109 12.840 58.570 30.070 1.00 0.00 ATOM 13542 C25 POP 109 10.690 58.250 29.610 1.00 0.00 ATOM 13543 H5R POP 109 10.610 57.320 30.230 1.00 0.00 ATOM 13544 H5S POP 109 9.960 58.240 28.770 1.00 0.00 ATOM 13545 C26 POP 109 10.140 59.410 30.440 1.00 0.00 ATOM 13546 H6R POP 109 10.530 60.390 30.110 1.00 0.00 ATOM 13547 H6S POP 109 10.310 59.330 31.540 1.00 0.00 ATOM 13548 C27 POP 109 8.630 59.560 30.280 1.00 0.00 ATOM 13549 H7R POP 109 8.450 59.980 29.270 1.00 0.00 ATOM 13550 H7S POP 109 8.440 60.370 31.010 1.00 0.00 ATOM 13551 C28 POP 109 7.740 58.310 30.340 1.00 0.00 ATOM 13552 H8R POP 109 7.910 57.710 31.260 1.00 0.00 ATOM 13553 H8S POP 109 7.890 57.720 29.410 1.00 0.00 ATOM 13554 C29 POP 109 6.330 58.840 30.290 1.00 0.00 ATOM 13555 H91 POP 109 6.000 59.190 29.310 1.00 0.00 ATOM 13556 0C21 POP 109 5.400 58.790 31.250 1.00 0.00 ATOM 13557 1H10 POP 109 4.400 59.130 30.920 1.00 0.00 ATOM 13558 1C21 POP 109 5.380 58.260 32.650 1.00 0.00 ATOM 13559 H11R POP 109 5.970 57.320 32.730 1.00 0.00 ATOM 13560 H11S POP 109 4.310 57.970 32.770 1.00 0.00 ATOM 13561 2C21 POP 109 5.730 59.170 33.820 1.00 0.00 ATOM 13562 H12R POP 109 5.210 60.110 33.530 1.00 0.00 ATOM 13563 H12S POP 109 6.830 59.350 33.790 1.00 0.00 ATOM 13564 3C21 POP 109 5.290 58.680 35.200 1.00 0.00 ATOM 13565 H13R POP 109 4.250 58.300 35.230 1.00 0.00 ATOM 13566 H13S POP 109 5.440 59.400 36.040 1.00 0.00 ATOM 13567 4C21 POP 109 6.120 57.500 35.700 1.00 0.00 ATOM 13568 H14R POP 109 7.130 57.950 35.760 1.00 0.00 ATOM 13569 H14S POP 109 6.130 56.650 34.980 1.00 0.00 ATOM 13570 5C21 POP 109 5.820 57.020 37.120 1.00 0.00 ATOM 13571 H15R POP 109 6.440 56.120 37.320 1.00 0.00 ATOM 13572 H15S POP 109 4.750 56.710 37.150 1.00 0.00 ATOM 13573 6C21 POP 109 5.970 58.080 38.220 1.00 0.00 ATOM 13574 H16R POP 109 5.100 58.770 38.210 1.00 0.00 ATOM 13575 H16S POP 109 6.900 58.670 38.040 1.00 0.00 ATOM 13576 7C21 POP 109 5.890 57.530 39.640 1.00 0.00 ATOM 13577 H17R POP 109 6.380 58.300 40.280 1.00 0.00 ATOM 13578 H17S POP 109 6.540 56.640 39.710 1.00 0.00 ATOM 13579 8C21 POP 109 4.510 57.080 40.110 1.00 0.00 ATOM 13580 H18R POP 109 4.450 56.920 41.200 1.00 0.00 ATOM 13581 H18S POP 109 4.180 56.170 39.560 1.00 0.00 ATOM 13582 H18T POP 109 3.850 57.940 39.900 1.00 0.00 ATOM 13583 C33 POP 109 13.700 51.730 29.750 1.00 0.00 ATOM 13584 H3X POP 109 14.550 52.390 30.050 1.00 0.00 ATOM 13585 H3Y POP 109 14.190 51.000 29.060 1.00 0.00 ATOM 13586 C34 POP 109 13.080 51.050 30.970 1.00 0.00 ATOM 13587 H4X POP 109 12.260 51.680 31.370 1.00 0.00 ATOM 13588 H4Y POP 109 13.780 51.050 31.830 1.00 0.00 ATOM 13589 C35 POP 109 12.740 49.600 30.620 1.00 0.00 ATOM 13590 H5X POP 109 13.610 48.920 30.530 1.00 0.00 ATOM 13591 H5Y POP 109 12.110 49.430 29.720 1.00 0.00 ATOM 13592 C36 POP 109 11.800 49.200 31.770 1.00 0.00 ATOM 13593 H6X POP 109 11.290 48.230 31.590 1.00 0.00 ATOM 13594 H6Y POP 109 11.010 49.960 31.960 1.00 0.00 ATOM 13595 C37 POP 109 12.410 48.990 33.160 1.00 0.00 ATOM 13596 H7X POP 109 12.840 49.940 33.540 1.00 0.00 ATOM 13597 H7Y POP 109 13.280 48.300 33.120 1.00 0.00 ATOM 13598 C38 POP 109 11.370 48.360 34.080 1.00 0.00 ATOM 13599 H8X POP 109 11.190 47.300 33.790 1.00 0.00 ATOM 13600 H8Y POP 109 10.420 48.900 33.870 1.00 0.00 ATOM 13601 C39 POP 109 11.850 48.330 35.530 1.00 0.00 ATOM 13602 H9X POP 109 12.060 49.360 35.880 1.00 0.00 ATOM 13603 H9Y POP 109 12.730 47.670 35.650 1.00 0.00 ATOM 13604 0C31 POP 109 10.820 47.750 36.510 1.00 0.00 ATOM 13605 H10X POP 109 10.630 46.680 36.250 1.00 0.00 ATOM 13606 H10Y POP 109 9.890 48.290 36.230 1.00 0.00 ATOM 13607 1C31 POP 109 11.080 47.950 38.000 1.00 0.00 ATOM 13608 H11X POP 109 12.050 47.480 38.260 1.00 0.00 ATOM 13609 H11Y POP 109 10.330 47.490 38.670 1.00 0.00 ATOM 13610 2C31 POP 109 11.150 49.440 38.340 1.00 0.00 ATOM 13611 H12X POP 109 10.130 49.870 38.390 1.00 0.00 ATOM 13612 H12Y POP 109 11.840 50.010 37.680 1.00 0.00 ATOM 13613 3C31 POP 109 11.710 49.620 39.750 1.00 0.00 ATOM 13614 H13X POP 109 12.810 49.450 39.760 1.00 0.00 ATOM 13615 H13Y POP 109 11.190 48.930 40.450 1.00 0.00 ATOM 13616 4C31 POP 109 11.480 51.040 40.270 1.00 0.00 ATOM 13617 H14X POP 109 10.440 51.070 40.670 1.00 0.00 ATOM 13618 H14Y POP 109 11.480 51.750 39.410 1.00 0.00 ATOM 13619 5C31 POP 109 12.490 51.500 41.320 1.00 0.00 ATOM 13620 H15X POP 109 13.530 51.430 40.930 1.00 0.00 ATOM 13621 H15Y POP 109 12.490 50.960 42.290 1.00 0.00 ATOM 13622 6C31 POP 109 12.280 52.990 41.590 1.00 0.00 ATOM 13623 H16X POP 109 12.880 53.730 41.030 1.00 0.00 ATOM 13624 H16Y POP 109 12.320 53.220 42.680 1.00 0.00 ATOM 13625 H16Z POP 109 11.280 53.360 41.280 1.00 0.00 ATOM 13626 N POP 110 18.100 14.810 20.890 1.00 0.00 ATOM 13627 HN1 POP 110 17.800 15.700 21.340 1.00 0.00 ATOM 13628 HN2 POP 110 18.090 14.120 21.660 1.00 0.00 ATOM 13629 HN3 POP 110 19.050 14.860 20.480 1.00 0.00 ATOM 13630 C12 POP 110 17.140 14.350 19.810 1.00 0.00 ATOM 13631 H12A POP 110 17.630 13.460 19.340 1.00 0.00 ATOM 13632 H12B POP 110 17.020 15.110 19.010 1.00 0.00 ATOM 13633 C11 POP 110 15.820 14.080 20.530 1.00 0.00 ATOM 13634 H11A POP 110 15.060 13.710 19.810 1.00 0.00 ATOM 13635 H11B POP 110 15.390 15.020 20.950 1.00 0.00 ATOM 13636 P POP 110 14.740 12.820 22.520 1.00 0.00 ATOM 13637 O13 POP 110 14.250 11.490 22.080 1.00 0.00 ATOM 13638 O14 POP 110 13.760 13.930 22.470 1.00 0.00 ATOM 13639 O11 POP 110 15.290 12.760 24.020 1.00 0.00 ATOM 13640 O12 POP 110 16.010 13.180 21.630 1.00 0.00 ATOM 13641 C1 POP 110 15.840 13.990 24.490 1.00 0.00 ATOM 13642 HA POP 110 15.050 14.700 24.820 1.00 0.00 ATOM 13643 HB POP 110 16.400 14.550 23.700 1.00 0.00 ATOM 13644 C2 POP 110 16.830 13.830 25.650 1.00 0.00 ATOM 13645 HS POP 110 17.670 13.240 25.230 1.00 0.00 ATOM 13646 O21 POP 110 16.100 13.140 26.670 1.00 0.00 ATOM 13647 C21 POP 110 16.960 12.640 27.560 1.00 0.00 ATOM 13648 O22 POP 110 18.130 12.970 27.620 1.00 0.00 ATOM 13649 C22 POP 110 16.370 11.560 28.460 1.00 0.00 ATOM 13650 H2R POP 110 16.650 10.540 28.130 1.00 0.00 ATOM 13651 H2S POP 110 15.270 11.690 28.550 1.00 0.00 ATOM 13652 C3 POP 110 17.450 15.200 25.990 1.00 0.00 ATOM 13653 HX POP 110 18.040 15.460 25.080 1.00 0.00 ATOM 13654 HY POP 110 18.140 15.220 26.850 1.00 0.00 ATOM 13655 O31 POP 110 16.440 16.150 26.360 1.00 0.00 ATOM 13656 C31 POP 110 16.790 17.420 26.580 1.00 0.00 ATOM 13657 O32 POP 110 17.910 17.850 26.350 1.00 0.00 ATOM 13658 C32 POP 110 15.630 18.110 27.290 1.00 0.00 ATOM 13659 H2X POP 110 15.060 17.300 27.800 1.00 0.00 ATOM 13660 H2Y POP 110 14.920 18.520 26.540 1.00 0.00 ATOM 13661 C23 POP 110 16.930 11.650 29.880 1.00 0.00 ATOM 13662 H3R POP 110 16.890 12.700 30.220 1.00 0.00 ATOM 13663 H3S POP 110 17.990 11.330 29.790 1.00 0.00 ATOM 13664 C24 POP 110 16.360 10.610 30.850 1.00 0.00 ATOM 13665 H4R POP 110 16.730 9.630 30.490 1.00 0.00 ATOM 13666 H4S POP 110 15.250 10.540 30.910 1.00 0.00 ATOM 13667 C25 POP 110 16.850 10.980 32.250 1.00 0.00 ATOM 13668 H5R POP 110 16.580 12.010 32.580 1.00 0.00 ATOM 13669 H5S POP 110 17.960 10.900 32.330 1.00 0.00 ATOM 13670 C26 POP 110 16.220 10.080 33.310 1.00 0.00 ATOM 13671 H6R POP 110 16.610 9.070 33.060 1.00 0.00 ATOM 13672 H6S POP 110 15.110 10.120 33.210 1.00 0.00 ATOM 13673 C27 POP 110 16.510 10.480 34.750 1.00 0.00 ATOM 13674 H7R POP 110 15.980 9.780 35.430 1.00 0.00 ATOM 13675 H7S POP 110 16.000 11.440 34.980 1.00 0.00 ATOM 13676 C28 POP 110 17.970 10.350 35.190 1.00 0.00 ATOM 13677 H8R POP 110 18.580 11.230 34.860 1.00 0.00 ATOM 13678 H8S POP 110 18.440 9.480 34.680 1.00 0.00 ATOM 13679 C29 POP 110 18.120 10.140 36.670 1.00 0.00 ATOM 13680 H91 POP 110 17.290 9.530 37.050 1.00 0.00 ATOM 13681 0C21 POP 110 19.140 10.640 37.380 1.00 0.00 ATOM 13682 1H10 POP 110 19.160 10.520 38.480 1.00 0.00 ATOM 13683 1C21 POP 110 20.370 11.380 36.950 1.00 0.00 ATOM 13684 H11R POP 110 20.440 11.440 35.840 1.00 0.00 ATOM 13685 H11S POP 110 21.220 11.080 37.590 1.00 0.00 ATOM 13686 2C21 POP 110 20.070 12.830 37.350 1.00 0.00 ATOM 13687 H12R POP 110 19.730 12.900 38.410 1.00 0.00 ATOM 13688 H12S POP 110 19.210 13.290 36.820 1.00 0.00 ATOM 13689 3C21 POP 110 21.260 13.710 36.960 1.00 0.00 ATOM 13690 H13R POP 110 21.480 13.580 35.880 1.00 0.00 ATOM 13691 H13S POP 110 22.100 13.350 37.590 1.00 0.00 ATOM 13692 4C21 POP 110 21.160 15.180 37.390 1.00 0.00 ATOM 13693 H14R POP 110 20.810 15.220 38.450 1.00 0.00 ATOM 13694 H14S POP 110 20.320 15.640 36.820 1.00 0.00 ATOM 13695 5C21 POP 110 22.310 16.170 37.210 1.00 0.00 ATOM 13696 H15R POP 110 22.430 16.260 36.110 1.00 0.00 ATOM 13697 H15S POP 110 23.240 15.760 37.660 1.00 0.00 ATOM 13698 6C21 POP 110 22.020 17.640 37.560 1.00 0.00 ATOM 13699 H16R POP 110 20.940 17.890 37.540 1.00 0.00 ATOM 13700 H16S POP 110 22.580 18.190 36.770 1.00 0.00 ATOM 13701 7C21 POP 110 22.530 18.060 38.940 1.00 0.00 ATOM 13702 H17R POP 110 22.220 19.120 39.060 1.00 0.00 ATOM 13703 H17S POP 110 23.630 17.950 38.820 1.00 0.00 ATOM 13704 8C21 POP 110 21.990 17.340 40.170 1.00 0.00 ATOM 13705 H18R POP 110 22.040 16.230 40.090 1.00 0.00 ATOM 13706 H18S POP 110 20.980 17.770 40.380 1.00 0.00 ATOM 13707 H18T POP 110 22.580 17.660 41.050 1.00 0.00 ATOM 13708 C33 POP 110 16.130 19.220 28.210 1.00 0.00 ATOM 13709 H3X POP 110 15.720 20.180 27.850 1.00 0.00 ATOM 13710 H3Y POP 110 17.230 19.370 28.190 1.00 0.00 ATOM 13711 C34 POP 110 15.650 19.050 29.660 1.00 0.00 ATOM 13712 H4X POP 110 14.690 18.510 29.560 1.00 0.00 ATOM 13713 H4Y POP 110 15.410 20.050 30.070 1.00 0.00 ATOM 13714 C35 POP 110 16.560 18.290 30.630 1.00 0.00 ATOM 13715 H5X POP 110 17.590 18.700 30.660 1.00 0.00 ATOM 13716 H5Y POP 110 16.660 17.250 30.260 1.00 0.00 ATOM 13717 C36 POP 110 16.010 18.250 32.060 1.00 0.00 ATOM 13718 H6X POP 110 15.040 17.710 32.090 1.00 0.00 ATOM 13719 H6Y POP 110 15.880 19.300 32.410 1.00 0.00 ATOM 13720 C37 POP 110 16.970 17.500 32.980 1.00 0.00 ATOM 13721 H7X POP 110 18.000 17.910 32.910 1.00 0.00 ATOM 13722 H7Y POP 110 16.930 16.430 32.670 1.00 0.00 ATOM 13723 C38 POP 110 16.650 17.700 34.460 1.00 0.00 ATOM 13724 H8X POP 110 17.340 17.100 35.090 1.00 0.00 ATOM 13725 H8Y POP 110 15.650 17.250 34.670 1.00 0.00 ATOM 13726 C39 POP 110 16.750 19.140 34.940 1.00 0.00 ATOM 13727 H9X POP 110 15.960 19.690 34.380 1.00 0.00 ATOM 13728 H9Y POP 110 17.770 19.580 34.860 1.00 0.00 ATOM 13729 0C31 POP 110 16.320 19.410 36.380 1.00 0.00 ATOM 13730 H10X POP 110 15.230 19.210 36.310 1.00 0.00 ATOM 13731 H10Y POP 110 16.470 20.500 36.570 1.00 0.00 ATOM 13732 1C31 POP 110 16.870 18.540 37.510 1.00 0.00 ATOM 13733 H11X POP 110 16.410 17.530 37.500 1.00 0.00 ATOM 13734 H11Y POP 110 16.380 18.930 38.430 1.00 0.00 ATOM 13735 2C31 POP 110 18.380 18.460 37.720 1.00 0.00 ATOM 13736 H12X POP 110 18.950 18.320 36.780 1.00 0.00 ATOM 13737 H12Y POP 110 18.600 17.530 38.290 1.00 0.00 ATOM 13738 3C31 POP 110 18.940 19.630 38.550 1.00 0.00 ATOM 13739 H13X POP 110 19.850 19.260 39.060 1.00 0.00 ATOM 13740 H13Y POP 110 18.190 19.930 39.320 1.00 0.00 ATOM 13741 4C31 POP 110 19.350 20.880 37.760 1.00 0.00 ATOM 13742 H14X POP 110 20.210 20.450 37.210 1.00 0.00 ATOM 13743 H14Y POP 110 18.680 21.120 36.900 1.00 0.00 ATOM 13744 5C31 POP 110 19.800 21.980 38.720 1.00 0.00 ATOM 13745 H15X POP 110 20.060 21.530 39.700 1.00 0.00 ATOM 13746 H15Y POP 110 20.780 22.380 38.370 1.00 0.00 ATOM 13747 6C31 POP 110 18.830 23.160 38.770 1.00 0.00 ATOM 13748 H16X POP 110 17.760 22.900 38.900 1.00 0.00 ATOM 13749 H16Y POP 110 18.810 23.690 37.800 1.00 0.00 ATOM 13750 H16Z POP 110 19.180 23.970 39.450 1.00 0.00 ATOM 13751 N POP 111 28.140 27.510 27.400 1.00 0.00 ATOM 13752 HN1 POP 111 27.130 27.420 27.620 1.00 0.00 ATOM 13753 HN2 POP 111 28.520 26.600 27.080 1.00 0.00 ATOM 13754 HN3 POP 111 28.710 27.880 28.190 1.00 0.00 ATOM 13755 C12 POP 111 28.230 28.500 26.260 1.00 0.00 ATOM 13756 H12A POP 111 28.030 29.490 26.730 1.00 0.00 ATOM 13757 H12B POP 111 27.540 28.190 25.450 1.00 0.00 ATOM 13758 C11 POP 111 29.670 28.370 25.760 1.00 0.00 ATOM 13759 H11A POP 111 29.850 29.110 24.950 1.00 0.00 ATOM 13760 H11B POP 111 29.600 27.400 25.220 1.00 0.00 ATOM 13761 P POP 111 32.050 28.860 26.480 1.00 0.00 ATOM 13762 O13 POP 111 32.240 28.310 25.120 1.00 0.00 ATOM 13763 O14 POP 111 32.170 30.320 26.690 1.00 0.00 ATOM 13764 O11 POP 111 33.020 28.060 27.470 1.00 0.00 ATOM 13765 O12 POP 111 30.570 28.380 26.870 1.00 0.00 ATOM 13766 C1 POP 111 32.450 27.620 28.710 1.00 0.00 ATOM 13767 HA POP 111 33.180 26.910 29.160 1.00 0.00 ATOM 13768 HB POP 111 31.510 27.040 28.620 1.00 0.00 ATOM 13769 C2 POP 111 32.360 28.710 29.790 1.00 0.00 ATOM 13770 HS POP 111 31.660 29.500 29.430 1.00 0.00 ATOM 13771 O21 POP 111 33.600 29.420 29.830 1.00 0.00 ATOM 13772 C21 POP 111 33.760 30.430 30.680 1.00 0.00 ATOM 13773 O22 POP 111 32.910 30.870 31.440 1.00 0.00 ATOM 13774 C22 POP 111 35.120 31.100 30.540 1.00 0.00 ATOM 13775 H2R POP 111 35.200 31.960 29.850 1.00 0.00 ATOM 13776 H2S POP 111 35.820 30.260 30.340 1.00 0.00 ATOM 13777 C3 POP 111 31.870 28.210 31.160 1.00 0.00 ATOM 13778 HX POP 111 31.580 29.040 31.840 1.00 0.00 ATOM 13779 HY POP 111 32.840 27.910 31.630 1.00 0.00 ATOM 13780 O31 POP 111 30.860 27.210 31.120 1.00 0.00 ATOM 13781 C31 POP 111 31.180 26.040 31.680 1.00 0.00 ATOM 13782 O32 POP 111 32.200 25.780 32.300 1.00 0.00 ATOM 13783 C32 POP 111 30.040 25.040 31.540 1.00 0.00 ATOM 13784 H2X POP 111 30.410 24.080 31.960 1.00 0.00 ATOM 13785 H2Y POP 111 29.890 24.870 30.450 1.00 0.00 ATOM 13786 C23 POP 111 35.550 31.600 31.920 1.00 0.00 ATOM 13787 H3R POP 111 35.390 30.770 32.640 1.00 0.00 ATOM 13788 H3S POP 111 34.770 32.310 32.260 1.00 0.00 ATOM 13789 C24 POP 111 36.950 32.190 32.100 1.00 0.00 ATOM 13790 H4R POP 111 36.940 33.080 31.430 1.00 0.00 ATOM 13791 H4S POP 111 37.700 31.440 31.800 1.00 0.00 ATOM 13792 C25 POP 111 37.250 32.790 33.480 1.00 0.00 ATOM 13793 H5R POP 111 36.840 32.130 34.280 1.00 0.00 ATOM 13794 H5S POP 111 36.660 33.720 33.610 1.00 0.00 ATOM 13795 C26 POP 111 38.740 33.130 33.550 1.00 0.00 ATOM 13796 H6R POP 111 39.050 33.780 32.700 1.00 0.00 ATOM 13797 H6S POP 111 39.270 32.180 33.330 1.00 0.00 ATOM 13798 C27 POP 111 39.250 33.790 34.830 1.00 0.00 ATOM 13799 H7R POP 111 38.580 33.390 35.610 1.00 0.00 ATOM 13800 H7S POP 111 39.190 34.900 34.820 1.00 0.00 ATOM 13801 C28 POP 111 40.690 33.380 35.150 1.00 0.00 ATOM 13802 H8R POP 111 41.490 33.710 34.440 1.00 0.00 ATOM 13803 H8S POP 111 40.670 32.280 35.260 1.00 0.00 ATOM 13804 C29 POP 111 41.180 33.920 36.460 1.00 0.00 ATOM 13805 H91 POP 111 40.900 34.980 36.570 1.00 0.00 ATOM 13806 0C21 POP 111 41.820 33.320 37.470 1.00 0.00 ATOM 13807 1H10 POP 111 42.110 33.960 38.310 1.00 0.00 ATOM 13808 1C21 POP 111 42.260 31.890 37.600 1.00 0.00 ATOM 13809 H11R POP 111 43.370 31.890 37.500 1.00 0.00 ATOM 13810 H11S POP 111 41.840 31.330 36.730 1.00 0.00 ATOM 13811 2C21 POP 111 41.830 31.050 38.800 1.00 0.00 ATOM 13812 H12R POP 111 40.740 30.980 39.020 1.00 0.00 ATOM 13813 H12S POP 111 42.140 31.630 39.700 1.00 0.00 ATOM 13814 3C21 POP 111 42.210 29.560 38.760 1.00 0.00 ATOM 13815 H13R POP 111 43.290 29.380 38.910 1.00 0.00 ATOM 13816 H13S POP 111 41.850 29.170 37.790 1.00 0.00 ATOM 13817 4C21 POP 111 41.520 28.880 39.950 1.00 0.00 ATOM 13818 H14R POP 111 41.320 27.810 39.730 1.00 0.00 ATOM 13819 H14S POP 111 40.580 29.420 40.210 1.00 0.00 ATOM 13820 5C21 POP 111 42.550 28.990 41.080 1.00 0.00 ATOM 13821 H15R POP 111 43.100 29.930 40.880 1.00 0.00 ATOM 13822 H15S POP 111 43.270 28.150 40.910 1.00 0.00 ATOM 13823 6C21 POP 111 41.980 28.920 42.490 1.00 0.00 ATOM 13824 H16R POP 111 42.760 28.630 43.230 1.00 0.00 ATOM 13825 H16S POP 111 41.250 28.080 42.480 1.00 0.00 ATOM 13826 7C21 POP 111 41.310 30.240 42.890 1.00 0.00 ATOM 13827 H17R POP 111 40.650 30.490 42.030 1.00 0.00 ATOM 13828 H17S POP 111 42.090 31.030 42.980 1.00 0.00 ATOM 13829 8C21 POP 111 40.440 30.200 44.140 1.00 0.00 ATOM 13830 H18R POP 111 39.780 29.300 44.090 1.00 0.00 ATOM 13831 H18S POP 111 39.780 31.090 44.080 1.00 0.00 ATOM 13832 H18T POP 111 41.060 30.010 45.040 1.00 0.00 ATOM 13833 C33 POP 111 28.850 25.430 32.420 1.00 0.00 ATOM 13834 H3X POP 111 28.240 24.510 32.390 1.00 0.00 ATOM 13835 H3Y POP 111 28.350 26.340 32.030 1.00 0.00 ATOM 13836 C34 POP 111 29.300 25.560 33.880 1.00 0.00 ATOM 13837 H4X POP 111 30.170 26.240 33.920 1.00 0.00 ATOM 13838 H4Y POP 111 29.720 24.550 34.100 1.00 0.00 ATOM 13839 C35 POP 111 28.190 25.810 34.900 1.00 0.00 ATOM 13840 H5X POP 111 27.300 25.220 34.600 1.00 0.00 ATOM 13841 H5Y POP 111 27.980 26.900 34.910 1.00 0.00 ATOM 13842 C36 POP 111 28.680 25.300 36.260 1.00 0.00 ATOM 13843 H6X POP 111 29.720 25.650 36.440 1.00 0.00 ATOM 13844 H6Y POP 111 28.720 24.190 36.280 1.00 0.00 ATOM 13845 C37 POP 111 27.860 25.770 37.460 1.00 0.00 ATOM 13846 H7X POP 111 26.840 25.580 37.070 1.00 0.00 ATOM 13847 H7Y POP 111 27.800 26.870 37.560 1.00 0.00 ATOM 13848 C38 POP 111 28.020 25.140 38.850 1.00 0.00 ATOM 13849 H8X POP 111 28.960 24.550 38.730 1.00 0.00 ATOM 13850 H8Y POP 111 27.160 24.430 38.870 1.00 0.00 ATOM 13851 C39 POP 111 28.200 26.190 39.940 1.00 0.00 ATOM 13852 H9X POP 111 27.420 26.960 39.780 1.00 0.00 ATOM 13853 H9Y POP 111 28.010 25.640 40.890 1.00 0.00 ATOM 13854 0C31 POP 111 29.620 26.770 39.860 1.00 0.00 ATOM 13855 H10X POP 111 29.550 27.500 40.700 1.00 0.00 ATOM 13856 H10Y POP 111 29.980 27.280 38.950 1.00 0.00 ATOM 13857 1C31 POP 111 30.670 25.750 40.310 1.00 0.00 ATOM 13858 H11X POP 111 31.390 25.530 39.490 1.00 0.00 ATOM 13859 H11Y POP 111 30.230 24.760 40.550 1.00 0.00 ATOM 13860 2C31 POP 111 31.500 26.180 41.520 1.00 0.00 ATOM 13861 H12X POP 111 32.080 25.320 41.930 1.00 0.00 ATOM 13862 H12Y POP 111 30.820 26.410 42.360 1.00 0.00 ATOM 13863 3C31 POP 111 32.440 27.360 41.230 1.00 0.00 ATOM 13864 H13X POP 111 33.010 27.480 42.180 1.00 0.00 ATOM 13865 H13Y POP 111 31.830 28.260 41.010 1.00 0.00 ATOM 13866 4C31 POP 111 33.380 27.150 40.040 1.00 0.00 ATOM 13867 H14X POP 111 34.090 28.000 39.900 1.00 0.00 ATOM 13868 H14Y POP 111 32.820 26.930 39.110 1.00 0.00 ATOM 13869 5C31 POP 111 34.350 25.980 40.220 1.00 0.00 ATOM 13870 H15X POP 111 33.760 25.040 40.190 1.00 0.00 ATOM 13871 H15Y POP 111 34.810 26.180 41.220 1.00 0.00 ATOM 13872 6C31 POP 111 35.430 25.940 39.140 1.00 0.00 ATOM 13873 H16X POP 111 36.250 26.690 39.210 1.00 0.00 ATOM 13874 H16Y POP 111 34.970 26.150 38.150 1.00 0.00 ATOM 13875 H16Z POP 111 35.920 24.940 39.160 1.00 0.00 ATOM 13876 N POP 112 14.960 41.920 21.020 1.00 0.00 ATOM 13877 HN1 POP 112 15.110 42.370 21.950 1.00 0.00 ATOM 13878 HN2 POP 112 13.940 41.730 20.920 1.00 0.00 ATOM 13879 HN3 POP 112 15.540 41.070 21.140 1.00 0.00 ATOM 13880 C12 POP 112 15.590 42.680 19.870 1.00 0.00 ATOM 13881 H12A POP 112 15.270 42.100 18.980 1.00 0.00 ATOM 13882 H12B POP 112 16.660 42.420 20.040 1.00 0.00 ATOM 13883 C11 POP 112 15.300 44.180 19.820 1.00 0.00 ATOM 13884 H11A POP 112 14.200 44.300 19.730 1.00 0.00 ATOM 13885 H11B POP 112 15.890 44.610 18.970 1.00 0.00 ATOM 13886 P POP 112 15.470 46.200 21.510 1.00 0.00 ATOM 13887 O13 POP 112 16.390 46.850 22.470 1.00 0.00 ATOM 13888 O14 POP 112 15.310 46.950 20.240 1.00 0.00 ATOM 13889 O11 POP 112 14.040 46.180 22.210 1.00 0.00 ATOM 13890 O12 POP 112 15.780 44.690 21.060 1.00 0.00 ATOM 13891 C1 POP 112 13.550 44.970 22.800 1.00 0.00 ATOM 13892 HA POP 112 14.440 44.340 22.970 1.00 0.00 ATOM 13893 HB POP 112 12.770 44.500 22.150 1.00 0.00 ATOM 13894 C2 POP 112 12.960 45.280 24.180 1.00 0.00 ATOM 13895 HS POP 112 12.040 45.850 23.920 1.00 0.00 ATOM 13896 O21 POP 112 13.900 45.980 24.990 1.00 0.00 ATOM 13897 C21 POP 112 13.240 46.720 25.880 1.00 0.00 ATOM 13898 O22 POP 112 12.020 46.800 26.000 1.00 0.00 ATOM 13899 C22 POP 112 14.280 47.570 26.590 1.00 0.00 ATOM 13900 H2R POP 112 14.050 48.580 26.190 1.00 0.00 ATOM 13901 H2S POP 112 15.290 47.450 26.150 1.00 0.00 ATOM 13902 C3 POP 112 12.610 43.930 24.830 1.00 0.00 ATOM 13903 HX POP 112 13.560 43.360 24.950 1.00 0.00 ATOM 13904 HY POP 112 11.960 43.340 24.140 1.00 0.00 ATOM 13905 O31 POP 112 12.060 44.060 26.140 1.00 0.00 ATOM 13906 C31 POP 112 10.730 44.150 26.220 1.00 0.00 ATOM 13907 O32 POP 112 9.990 44.130 25.250 1.00 0.00 ATOM 13908 C32 POP 112 10.370 44.410 27.670 1.00 0.00 ATOM 13909 H2X POP 112 10.510 45.500 27.880 1.00 0.00 ATOM 13910 H2Y POP 112 10.990 43.890 28.430 1.00 0.00 ATOM 13911 C23 POP 112 14.100 47.530 28.110 1.00 0.00 ATOM 13912 H3R POP 112 13.040 47.720 28.390 1.00 0.00 ATOM 13913 H3S POP 112 14.590 48.490 28.390 1.00 0.00 ATOM 13914 C24 POP 112 14.810 46.330 28.740 1.00 0.00 ATOM 13915 H4R POP 112 14.870 46.570 29.820 1.00 0.00 ATOM 13916 H4S POP 112 15.870 46.270 28.410 1.00 0.00 ATOM 13917 C25 POP 112 14.010 45.040 28.550 1.00 0.00 ATOM 13918 H5R POP 112 14.330 44.540 27.620 1.00 0.00 ATOM 13919 H5S POP 112 12.930 45.330 28.530 1.00 0.00 ATOM 13920 C26 POP 112 14.150 44.050 29.700 1.00 0.00 ATOM 13921 H6R POP 112 15.250 43.880 29.790 1.00 0.00 ATOM 13922 H6S POP 112 13.710 43.060 29.460 1.00 0.00 ATOM 13923 C27 POP 112 13.670 44.510 31.080 1.00 0.00 ATOM 13924 H7R POP 112 12.920 43.760 31.410 1.00 0.00 ATOM 13925 H7S POP 112 13.220 45.530 30.990 1.00 0.00 ATOM 13926 C28 POP 112 14.880 44.500 32.000 1.00 0.00 ATOM 13927 H8R POP 112 15.570 45.310 31.670 1.00 0.00 ATOM 13928 H8S POP 112 15.480 43.560 31.940 1.00 0.00 ATOM 13929 C29 POP 112 14.420 44.760 33.410 1.00 0.00 ATOM 13930 H91 POP 112 13.610 45.470 33.620 1.00 0.00 ATOM 13931 0C21 POP 112 14.870 44.030 34.430 1.00 0.00 ATOM 13932 1H10 POP 112 14.620 44.340 35.460 1.00 0.00 ATOM 13933 1C21 POP 112 15.870 42.910 34.450 1.00 0.00 ATOM 13934 H11R POP 112 16.870 43.220 34.080 1.00 0.00 ATOM 13935 H11S POP 112 15.530 42.050 33.820 1.00 0.00 ATOM 13936 2C21 POP 112 16.160 42.510 35.900 1.00 0.00 ATOM 13937 H12R POP 112 15.170 42.500 36.400 1.00 0.00 ATOM 13938 H12S POP 112 16.850 43.350 36.130 1.00 0.00 ATOM 13939 3C21 POP 112 16.880 41.170 36.050 1.00 0.00 ATOM 13940 H13R POP 112 17.840 41.110 35.490 1.00 0.00 ATOM 13941 H13S POP 112 16.260 40.360 35.620 1.00 0.00 ATOM 13942 4C21 POP 112 17.150 40.750 37.500 1.00 0.00 ATOM 13943 H14R POP 112 17.710 39.800 37.370 1.00 0.00 ATOM 13944 H14S POP 112 16.200 40.460 38.000 1.00 0.00 ATOM 13945 5C21 POP 112 17.940 41.720 38.380 1.00 0.00 ATOM 13946 H15R POP 112 17.620 42.780 38.400 1.00 0.00 ATOM 13947 H15S POP 112 18.960 41.690 37.930 1.00 0.00 ATOM 13948 6C21 POP 112 18.110 41.300 39.850 1.00 0.00 ATOM 13949 H16R POP 112 17.150 41.260 40.410 1.00 0.00 ATOM 13950 H16S POP 112 18.800 41.960 40.420 1.00 0.00 ATOM 13951 7C21 POP 112 18.710 39.910 40.060 1.00 0.00 ATOM 13952 H17R POP 112 19.680 39.780 39.550 1.00 0.00 ATOM 13953 H17S POP 112 17.970 39.250 39.550 1.00 0.00 ATOM 13954 8C21 POP 112 18.850 39.660 41.560 1.00 0.00 ATOM 13955 H18R POP 112 19.410 38.740 41.840 1.00 0.00 ATOM 13956 H18S POP 112 17.780 39.790 41.840 1.00 0.00 ATOM 13957 H18T POP 112 19.420 40.490 42.040 1.00 0.00 ATOM 13958 C33 POP 112 8.890 44.180 27.950 1.00 0.00 ATOM 13959 H3X POP 112 8.600 43.110 27.940 1.00 0.00 ATOM 13960 H3Y POP 112 8.360 44.780 27.170 1.00 0.00 ATOM 13961 C34 POP 112 8.470 44.540 29.380 1.00 0.00 ATOM 13962 H4X POP 112 7.440 44.200 29.580 1.00 0.00 ATOM 13963 H4Y POP 112 8.520 45.620 29.620 1.00 0.00 ATOM 13964 C35 POP 112 9.350 43.840 30.420 1.00 0.00 ATOM 13965 H5X POP 112 10.360 44.300 30.370 1.00 0.00 ATOM 13966 H5Y POP 112 9.380 42.790 30.050 1.00 0.00 ATOM 13967 C36 POP 112 8.760 43.690 31.830 1.00 0.00 ATOM 13968 H6X POP 112 9.470 43.090 32.440 1.00 0.00 ATOM 13969 H6Y POP 112 7.860 43.050 31.760 1.00 0.00 ATOM 13970 C37 POP 112 8.480 45.010 32.550 1.00 0.00 ATOM 13971 H7X POP 112 7.560 45.420 32.090 1.00 0.00 ATOM 13972 H7Y POP 112 9.330 45.700 32.400 1.00 0.00 ATOM 13973 C38 POP 112 8.110 44.860 34.030 1.00 0.00 ATOM 13974 H8X POP 112 8.940 44.270 34.480 1.00 0.00 ATOM 13975 H8Y POP 112 7.170 44.270 34.130 1.00 0.00 ATOM 13976 C39 POP 112 7.980 46.210 34.740 1.00 0.00 ATOM 13977 H9X POP 112 7.130 46.740 34.250 1.00 0.00 ATOM 13978 H9Y POP 112 8.900 46.820 34.610 1.00 0.00 ATOM 13979 0C31 POP 112 7.760 46.060 36.250 1.00 0.00 ATOM 13980 H10X POP 112 8.200 46.980 36.700 1.00 0.00 ATOM 13981 H10Y POP 112 8.490 45.350 36.690 1.00 0.00 ATOM 13982 1C31 POP 112 6.350 45.800 36.780 1.00 0.00 ATOM 13983 H11X POP 112 5.800 44.960 36.320 1.00 0.00 ATOM 13984 H11Y POP 112 5.710 46.650 36.450 1.00 0.00 ATOM 13985 2C31 POP 112 6.370 45.680 38.300 1.00 0.00 ATOM 13986 H12X POP 112 6.850 46.540 38.810 1.00 0.00 ATOM 13987 H12Y POP 112 7.110 44.870 38.520 1.00 0.00 ATOM 13988 3C31 POP 112 5.020 45.410 38.960 1.00 0.00 ATOM 13989 H13X POP 112 4.520 44.580 38.420 1.00 0.00 ATOM 13990 H13Y POP 112 4.330 46.270 38.790 1.00 0.00 ATOM 13991 4C31 POP 112 5.020 44.950 40.420 1.00 0.00 ATOM 13992 H14X POP 112 5.170 43.850 40.310 1.00 0.00 ATOM 13993 H14Y POP 112 4.000 45.150 40.820 1.00 0.00 ATOM 13994 5C31 POP 112 6.060 45.530 41.380 1.00 0.00 ATOM 13995 H15X POP 112 6.640 46.340 40.890 1.00 0.00 ATOM 13996 H15Y POP 112 6.860 44.770 41.500 1.00 0.00 ATOM 13997 6C31 POP 112 5.410 45.990 42.690 1.00 0.00 ATOM 13998 H16X POP 112 4.620 46.680 42.320 1.00 0.00 ATOM 13999 H16Y POP 112 6.130 46.560 43.320 1.00 0.00 ATOM 14000 H16Z POP 112 4.980 45.140 43.250 1.00 0.00 ATOM 14001 N POP 113 19.010 20.700 23.070 1.00 0.00 ATOM 14002 HN1 POP 113 19.960 20.340 22.830 1.00 0.00 ATOM 14003 HN2 POP 113 18.330 19.980 22.760 1.00 0.00 ATOM 14004 HN3 POP 113 18.770 21.590 22.600 1.00 0.00 ATOM 14005 C12 POP 113 18.750 20.640 24.560 1.00 0.00 ATOM 14006 H12A POP 113 19.720 20.940 25.010 1.00 0.00 ATOM 14007 H12B POP 113 18.610 19.580 24.850 1.00 0.00 ATOM 14008 C11 POP 113 17.520 21.500 24.860 1.00 0.00 ATOM 14009 H11A POP 113 17.310 21.490 25.950 1.00 0.00 ATOM 14010 H11B POP 113 16.600 21.050 24.420 1.00 0.00 ATOM 14011 P POP 113 16.250 23.630 24.260 1.00 0.00 ATOM 14012 O13 POP 113 16.680 25.030 24.050 1.00 0.00 ATOM 14013 O14 POP 113 15.200 23.110 23.350 1.00 0.00 ATOM 14014 O11 POP 113 15.750 23.370 25.760 1.00 0.00 ATOM 14015 O12 POP 113 17.570 22.740 24.150 1.00 0.00 ATOM 14016 C1 POP 113 15.020 24.470 26.300 1.00 0.00 ATOM 14017 HA POP 113 14.160 24.110 26.900 1.00 0.00 ATOM 14018 HB POP 113 14.510 25.110 25.550 1.00 0.00 ATOM 14019 C2 POP 113 15.830 25.290 27.320 1.00 0.00 ATOM 14020 HS POP 113 16.520 25.930 26.730 1.00 0.00 ATOM 14021 O21 POP 113 16.400 24.420 28.300 1.00 0.00 ATOM 14022 C21 POP 113 17.630 24.060 27.900 1.00 0.00 ATOM 14023 O22 POP 113 18.290 24.590 27.020 1.00 0.00 ATOM 14024 C22 POP 113 17.850 22.730 28.600 1.00 0.00 ATOM 14025 H2R POP 113 17.130 21.930 28.300 1.00 0.00 ATOM 14026 H2S POP 113 17.630 22.960 29.660 1.00 0.00 ATOM 14027 C3 POP 113 15.030 26.280 28.180 1.00 0.00 ATOM 14028 HX POP 113 14.790 27.070 27.430 1.00 0.00 ATOM 14029 HY POP 113 15.720 26.720 28.930 1.00 0.00 ATOM 14030 O31 POP 113 13.810 25.710 28.660 1.00 0.00 ATOM 14031 C31 POP 113 12.850 26.590 28.940 1.00 0.00 ATOM 14032 O32 POP 113 12.880 27.810 28.830 1.00 0.00 ATOM 14033 C32 POP 113 11.670 25.790 29.460 1.00 0.00 ATOM 14034 H2X POP 113 12.000 24.750 29.710 1.00 0.00 ATOM 14035 H2Y POP 113 10.920 25.780 28.650 1.00 0.00 ATOM 14036 C23 POP 113 19.310 22.370 28.340 1.00 0.00 ATOM 14037 H3R POP 113 19.850 23.300 28.630 1.00 0.00 ATOM 14038 H3S POP 113 19.610 22.190 27.290 1.00 0.00 ATOM 14039 C24 POP 113 19.890 21.180 29.120 1.00 0.00 ATOM 14040 H4R POP 113 21.000 21.280 29.150 1.00 0.00 ATOM 14041 H4S POP 113 19.640 20.250 28.570 1.00 0.00 ATOM 14042 C25 POP 113 19.480 21.040 30.590 1.00 0.00 ATOM 14043 H5R POP 113 19.920 20.080 30.930 1.00 0.00 ATOM 14044 H5S POP 113 18.380 20.870 30.560 1.00 0.00 ATOM 14045 C26 POP 113 20.010 22.090 31.570 1.00 0.00 ATOM 14046 H6R POP 113 19.760 23.080 31.130 1.00 0.00 ATOM 14047 H6S POP 113 21.120 22.110 31.570 1.00 0.00 ATOM 14048 C27 POP 113 19.410 21.750 32.930 1.00 0.00 ATOM 14049 H7R POP 113 20.140 21.110 33.480 1.00 0.00 ATOM 14050 H7S POP 113 18.390 21.310 32.950 1.00 0.00 ATOM 14051 C28 POP 113 19.220 22.950 33.870 1.00 0.00 ATOM 14052 H8R POP 113 20.240 23.370 34.020 1.00 0.00 ATOM 14053 H8S POP 113 18.970 22.580 34.890 1.00 0.00 ATOM 14054 C29 POP 113 18.240 24.000 33.450 1.00 0.00 ATOM 14055 H91 POP 113 17.320 23.600 33.000 1.00 0.00 ATOM 14056 0C21 POP 113 18.400 25.330 33.510 1.00 0.00 ATOM 14057 1H10 POP 113 17.600 26.020 33.190 1.00 0.00 ATOM 14058 1C21 POP 113 19.580 26.090 34.040 1.00 0.00 ATOM 14059 H11R POP 113 19.640 26.970 33.370 1.00 0.00 ATOM 14060 H11S POP 113 20.500 25.520 33.780 1.00 0.00 ATOM 14061 2C21 POP 113 19.370 26.530 35.490 1.00 0.00 ATOM 14062 H12R POP 113 19.250 25.600 36.090 1.00 0.00 ATOM 14063 H12S POP 113 18.450 27.140 35.540 1.00 0.00 ATOM 14064 3C21 POP 113 20.470 27.510 35.880 1.00 0.00 ATOM 14065 H13R POP 113 20.420 28.110 34.950 1.00 0.00 ATOM 14066 H13S POP 113 21.410 26.930 36.030 1.00 0.00 ATOM 14067 4C21 POP 113 20.130 28.050 37.260 1.00 0.00 ATOM 14068 H14R POP 113 19.100 28.460 37.270 1.00 0.00 ATOM 14069 H14S POP 113 20.910 28.820 37.480 1.00 0.00 ATOM 14070 5C21 POP 113 20.230 27.020 38.390 1.00 0.00 ATOM 14071 H15R POP 113 21.110 26.400 38.130 1.00 0.00 ATOM 14072 H15S POP 113 19.260 26.480 38.450 1.00 0.00 ATOM 14073 6C21 POP 113 20.320 27.690 39.760 1.00 0.00 ATOM 14074 H16R POP 113 19.510 28.440 39.890 1.00 0.00 ATOM 14075 H16S POP 113 21.310 28.130 39.980 1.00 0.00 ATOM 14076 7C21 POP 113 19.870 26.670 40.810 1.00 0.00 ATOM 14077 H17R POP 113 20.500 25.760 40.720 1.00 0.00 ATOM 14078 H17S POP 113 18.810 26.310 40.800 1.00 0.00 ATOM 14079 8C21 POP 113 20.130 27.230 42.210 1.00 0.00 ATOM 14080 H18R POP 113 19.500 28.130 42.390 1.00 0.00 ATOM 14081 H18S POP 113 21.220 27.450 42.230 1.00 0.00 ATOM 14082 H18T POP 113 19.950 26.390 42.910 1.00 0.00 ATOM 14083 C33 POP 113 11.070 26.470 30.690 1.00 0.00 ATOM 14084 H3X POP 113 10.110 25.950 30.910 1.00 0.00 ATOM 14085 H3Y POP 113 10.770 27.530 30.520 1.00 0.00 ATOM 14086 C34 POP 113 11.970 26.420 31.920 1.00 0.00 ATOM 14087 H4X POP 113 12.780 27.170 31.780 1.00 0.00 ATOM 14088 H4Y POP 113 12.500 25.440 31.930 1.00 0.00 ATOM 14089 C35 POP 113 11.200 26.750 33.210 1.00 0.00 ATOM 14090 H5X POP 113 10.530 25.880 33.390 1.00 0.00 ATOM 14091 H5Y POP 113 10.560 27.650 33.070 1.00 0.00 ATOM 14092 C36 POP 113 12.040 26.760 34.490 1.00 0.00 ATOM 14093 H6X POP 113 12.960 27.380 34.400 1.00 0.00 ATOM 14094 H6Y POP 113 12.390 25.720 34.620 1.00 0.00 ATOM 14095 C37 POP 113 11.310 27.280 35.730 1.00 0.00 ATOM 14096 H7X POP 113 10.450 26.600 35.880 1.00 0.00 ATOM 14097 H7Y POP 113 10.990 28.320 35.500 1.00 0.00 ATOM 14098 C38 POP 113 12.140 27.410 37.010 1.00 0.00 ATOM 14099 H8X POP 113 12.910 28.180 36.750 1.00 0.00 ATOM 14100 H8Y POP 113 12.630 26.460 37.290 1.00 0.00 ATOM 14101 C39 POP 113 11.250 27.800 38.190 1.00 0.00 ATOM 14102 H9X POP 113 10.360 27.160 38.330 1.00 0.00 ATOM 14103 H9Y POP 113 10.860 28.840 38.080 1.00 0.00 ATOM 14104 0C31 POP 113 11.890 27.820 39.580 1.00 0.00 ATOM 14105 H10X POP 113 12.760 28.520 39.490 1.00 0.00 ATOM 14106 H10Y POP 113 12.280 26.820 39.860 1.00 0.00 ATOM 14107 1C31 POP 113 10.970 28.280 40.710 1.00 0.00 ATOM 14108 H11X POP 113 9.960 27.860 40.540 1.00 0.00 ATOM 14109 H11Y POP 113 10.900 29.380 40.580 1.00 0.00 ATOM 14110 2C31 POP 113 11.440 27.820 42.090 1.00 0.00 ATOM 14111 H12X POP 113 12.490 28.120 42.310 1.00 0.00 ATOM 14112 H12Y POP 113 11.350 26.730 42.270 1.00 0.00 ATOM 14113 3C31 POP 113 10.540 28.450 43.160 1.00 0.00 ATOM 14114 H13X POP 113 9.480 28.180 42.990 1.00 0.00 ATOM 14115 H13Y POP 113 10.560 29.550 42.990 1.00 0.00 ATOM 14116 4C31 POP 113 10.920 28.030 44.580 1.00 0.00 ATOM 14117 H14X POP 113 12.020 28.010 44.720 1.00 0.00 ATOM 14118 H14Y POP 113 10.440 27.060 44.830 1.00 0.00 ATOM 14119 5C31 POP 113 10.380 29.020 45.620 1.00 0.00 ATOM 14120 H15X POP 113 9.280 29.010 45.450 1.00 0.00 ATOM 14121 H15Y POP 113 10.770 30.060 45.520 1.00 0.00 ATOM 14122 6C31 POP 113 10.600 28.600 47.070 1.00 0.00 ATOM 14123 H16X POP 113 10.440 29.420 47.800 1.00 0.00 ATOM 14124 H16Y POP 113 11.610 28.180 47.280 1.00 0.00 ATOM 14125 H16Z POP 113 9.910 27.790 47.380 1.00 0.00 ATOM 14126 N POP 114 18.730 30.750 21.990 1.00 0.00 ATOM 14127 HN1 POP 114 18.290 30.190 21.240 1.00 0.00 ATOM 14128 HN2 POP 114 19.460 31.420 21.690 1.00 0.00 ATOM 14129 HN3 POP 114 19.260 29.990 22.470 1.00 0.00 ATOM 14130 C12 POP 114 17.820 31.410 22.990 1.00 0.00 ATOM 14131 H12A POP 114 16.840 30.880 22.920 1.00 0.00 ATOM 14132 H12B POP 114 17.870 32.500 22.780 1.00 0.00 ATOM 14133 C11 POP 114 18.410 31.310 24.400 1.00 0.00 ATOM 14134 H11A POP 114 18.230 30.240 24.660 1.00 0.00 ATOM 14135 H11B POP 114 17.930 31.930 25.190 1.00 0.00 ATOM 14136 P POP 114 20.780 31.020 25.410 1.00 0.00 ATOM 14137 O13 POP 114 21.840 32.030 25.640 1.00 0.00 ATOM 14138 O14 POP 114 21.100 29.750 24.730 1.00 0.00 ATOM 14139 O11 POP 114 19.920 30.810 26.740 1.00 0.00 ATOM 14140 O12 POP 114 19.760 31.770 24.420 1.00 0.00 ATOM 14141 C1 POP 114 19.460 31.960 27.440 1.00 0.00 ATOM 14142 HA POP 114 18.430 31.720 27.780 1.00 0.00 ATOM 14143 HB POP 114 19.360 32.810 26.730 1.00 0.00 ATOM 14144 C2 POP 114 20.330 32.470 28.600 1.00 0.00 ATOM 14145 HS POP 114 21.360 32.550 28.190 1.00 0.00 ATOM 14146 O21 POP 114 20.340 31.510 29.670 1.00 0.00 ATOM 14147 C21 POP 114 21.480 31.540 30.350 1.00 0.00 ATOM 14148 O22 POP 114 22.430 32.280 30.130 1.00 0.00 ATOM 14149 C22 POP 114 21.500 30.430 31.400 1.00 0.00 ATOM 14150 H2R POP 114 22.550 30.150 31.650 1.00 0.00 ATOM 14151 H2S POP 114 20.970 29.630 30.840 1.00 0.00 ATOM 14152 C3 POP 114 19.800 33.810 29.140 1.00 0.00 ATOM 14153 HX POP 114 19.680 34.460 28.250 1.00 0.00 ATOM 14154 HY POP 114 20.590 34.270 29.780 1.00 0.00 ATOM 14155 O31 POP 114 18.560 33.610 29.830 1.00 0.00 ATOM 14156 C31 POP 114 17.940 34.760 30.110 1.00 0.00 ATOM 14157 O32 POP 114 18.230 35.870 29.700 1.00 0.00 ATOM 14158 C32 POP 114 16.670 34.370 30.860 1.00 0.00 ATOM 14159 H2X POP 114 16.950 33.630 31.640 1.00 0.00 ATOM 14160 H2Y POP 114 15.990 34.010 30.060 1.00 0.00 ATOM 14161 C23 POP 114 20.610 30.870 32.560 1.00 0.00 ATOM 14162 H3R POP 114 20.550 30.070 33.330 1.00 0.00 ATOM 14163 H3S POP 114 19.600 30.980 32.110 1.00 0.00 ATOM 14164 C24 POP 114 21.110 32.130 33.280 1.00 0.00 ATOM 14165 H4R POP 114 20.270 32.450 33.930 1.00 0.00 ATOM 14166 H4S POP 114 21.450 32.920 32.570 1.00 0.00 ATOM 14167 C25 POP 114 22.250 31.730 34.210 1.00 0.00 ATOM 14168 H5R POP 114 23.110 31.520 33.540 1.00 0.00 ATOM 14169 H5S POP 114 21.990 30.710 34.570 1.00 0.00 ATOM 14170 C26 POP 114 22.810 32.690 35.250 1.00 0.00 ATOM 14171 H6R POP 114 23.090 33.670 34.790 1.00 0.00 ATOM 14172 H6S POP 114 23.750 32.280 35.690 1.00 0.00 ATOM 14173 C27 POP 114 21.880 32.800 36.460 1.00 0.00 ATOM 14174 H7R POP 114 21.920 31.740 36.780 1.00 0.00 ATOM 14175 H7S POP 114 20.910 33.140 36.070 1.00 0.00 ATOM 14176 C28 POP 114 22.240 33.840 37.530 1.00 0.00 ATOM 14177 H8R POP 114 23.290 33.580 37.810 1.00 0.00 ATOM 14178 H8S POP 114 21.600 33.650 38.420 1.00 0.00 ATOM 14179 C29 POP 114 22.190 35.260 37.070 1.00 0.00 ATOM 14180 H91 POP 114 22.880 35.540 36.260 1.00 0.00 ATOM 14181 0C21 POP 114 21.420 36.260 37.540 1.00 0.00 ATOM 14182 1H10 POP 114 21.450 37.190 36.960 1.00 0.00 ATOM 14183 1C21 POP 114 20.390 36.250 38.630 1.00 0.00 ATOM 14184 H11R POP 114 19.720 35.380 38.450 1.00 0.00 ATOM 14185 H11S POP 114 19.770 37.150 38.410 1.00 0.00 ATOM 14186 2C21 POP 114 20.910 36.280 40.070 1.00 0.00 ATOM 14187 H12R POP 114 21.160 35.220 40.280 1.00 0.00 ATOM 14188 H12S POP 114 20.000 36.430 40.680 1.00 0.00 ATOM 14189 3C21 POP 114 21.970 37.310 40.480 1.00 0.00 ATOM 14190 H13R POP 114 21.660 38.340 40.210 1.00 0.00 ATOM 14191 H13S POP 114 22.930 37.070 39.980 1.00 0.00 ATOM 14192 4C21 POP 114 22.170 37.280 41.990 1.00 0.00 ATOM 14193 H14R POP 114 22.640 36.350 42.390 1.00 0.00 ATOM 14194 H14S POP 114 21.190 37.320 42.500 1.00 0.00 ATOM 14195 5C21 POP 114 22.790 38.520 42.650 1.00 0.00 ATOM 14196 H15R POP 114 22.220 39.440 42.430 1.00 0.00 ATOM 14197 H15S POP 114 23.860 38.680 42.400 1.00 0.00 ATOM 14198 6C21 POP 114 22.740 38.370 44.170 1.00 0.00 ATOM 14199 H16R POP 114 23.380 37.510 44.450 1.00 0.00 ATOM 14200 H16S POP 114 21.720 38.340 44.610 1.00 0.00 ATOM 14201 7C21 POP 114 23.370 39.670 44.690 1.00 0.00 ATOM 14202 H17R POP 114 22.710 40.520 44.400 1.00 0.00 ATOM 14203 H17S POP 114 24.220 40.090 44.120 1.00 0.00 ATOM 14204 8C21 POP 114 23.880 39.780 46.120 1.00 0.00 ATOM 14205 H18R POP 114 24.630 38.970 46.260 1.00 0.00 ATOM 14206 H18S POP 114 23.140 39.500 46.890 1.00 0.00 ATOM 14207 H18T POP 114 24.350 40.770 46.320 1.00 0.00 ATOM 14208 C33 POP 114 16.100 35.590 31.580 1.00 0.00 ATOM 14209 H3X POP 114 15.920 36.440 30.890 1.00 0.00 ATOM 14210 H3Y POP 114 16.760 36.020 32.360 1.00 0.00 ATOM 14211 C34 POP 114 14.780 35.330 32.320 1.00 0.00 ATOM 14212 H4X POP 114 14.960 34.570 33.100 1.00 0.00 ATOM 14213 H4Y POP 114 14.010 34.900 31.650 1.00 0.00 ATOM 14214 C35 POP 114 14.230 36.590 33.000 1.00 0.00 ATOM 14215 H5X POP 114 13.680 37.280 32.320 1.00 0.00 ATOM 14216 H5Y POP 114 15.020 37.190 33.480 1.00 0.00 ATOM 14217 C36 POP 114 13.240 36.190 34.100 1.00 0.00 ATOM 14218 H6X POP 114 13.770 35.410 34.690 1.00 0.00 ATOM 14219 H6Y POP 114 12.360 35.730 33.590 1.00 0.00 ATOM 14220 C37 POP 114 12.910 37.250 35.140 1.00 0.00 ATOM 14221 H7X POP 114 12.170 37.940 34.690 1.00 0.00 ATOM 14222 H7Y POP 114 13.780 37.830 35.520 1.00 0.00 ATOM 14223 C38 POP 114 12.290 36.570 36.360 1.00 0.00 ATOM 14224 H8X POP 114 13.060 35.920 36.820 1.00 0.00 ATOM 14225 H8Y POP 114 11.510 35.830 36.060 1.00 0.00 ATOM 14226 C39 POP 114 11.790 37.570 37.400 1.00 0.00 ATOM 14227 H9X POP 114 11.340 38.410 36.830 1.00 0.00 ATOM 14228 H9Y POP 114 12.630 37.950 38.030 1.00 0.00 ATOM 14229 0C31 POP 114 10.750 37.070 38.410 1.00 0.00 ATOM 14230 H10X POP 114 9.950 36.490 37.880 1.00 0.00 ATOM 14231 H10Y POP 114 10.220 37.880 38.940 1.00 0.00 ATOM 14232 1C31 POP 114 11.470 36.050 39.290 1.00 0.00 ATOM 14233 H11X POP 114 12.220 36.690 39.790 1.00 0.00 ATOM 14234 H11Y POP 114 12.100 35.400 38.650 1.00 0.00 ATOM 14235 2C31 POP 114 10.650 35.150 40.220 1.00 0.00 ATOM 14236 H12X POP 114 11.440 34.680 40.850 1.00 0.00 ATOM 14237 H12Y POP 114 10.090 34.280 39.820 1.00 0.00 ATOM 14238 3C31 POP 114 9.640 35.950 41.050 1.00 0.00 ATOM 14239 H13X POP 114 8.790 36.360 40.460 1.00 0.00 ATOM 14240 H13Y POP 114 10.220 36.870 41.310 1.00 0.00 ATOM 14241 4C31 POP 114 9.100 35.420 42.370 1.00 0.00 ATOM 14242 H14X POP 114 10.020 35.140 42.930 1.00 0.00 ATOM 14243 H14Y POP 114 8.500 34.500 42.160 1.00 0.00 ATOM 14244 5C31 POP 114 8.230 36.340 43.240 1.00 0.00 ATOM 14245 H15X POP 114 7.260 36.560 42.750 1.00 0.00 ATOM 14246 H15Y POP 114 8.830 37.270 43.320 1.00 0.00 ATOM 14247 6C31 POP 114 7.990 35.900 44.680 1.00 0.00 ATOM 14248 H16X POP 114 8.990 35.980 45.160 1.00 0.00 ATOM 14249 H16Y POP 114 7.680 34.840 44.810 1.00 0.00 ATOM 14250 H16Z POP 114 7.240 36.500 45.240 1.00 0.00 ATOM 14251 N POP 115 49.620 39.370 21.880 1.00 0.00 ATOM 14252 HN1 POP 115 49.450 39.700 22.850 1.00 0.00 ATOM 14253 HN2 POP 115 50.640 39.280 21.740 1.00 0.00 ATOM 14254 HN3 POP 115 49.310 40.110 21.210 1.00 0.00 ATOM 14255 C12 POP 115 48.810 38.170 21.450 1.00 0.00 ATOM 14256 H12A POP 115 48.690 37.490 22.320 1.00 0.00 ATOM 14257 H12B POP 115 49.360 37.680 20.620 1.00 0.00 ATOM 14258 C11 POP 115 47.390 38.600 21.070 1.00 0.00 ATOM 14259 H11A POP 115 46.830 37.650 21.070 1.00 0.00 ATOM 14260 H11B POP 115 47.270 39.120 20.090 1.00 0.00 ATOM 14261 P POP 115 45.390 39.920 22.120 1.00 0.00 ATOM 14262 O13 POP 115 44.630 38.700 21.790 1.00 0.00 ATOM 14263 O14 POP 115 45.240 41.110 21.260 1.00 0.00 ATOM 14264 O11 POP 115 45.180 40.340 23.650 1.00 0.00 ATOM 14265 O12 POP 115 46.930 39.470 22.110 1.00 0.00 ATOM 14266 C1 POP 115 46.040 41.350 24.200 1.00 0.00 ATOM 14267 HA POP 115 45.650 42.380 24.150 1.00 0.00 ATOM 14268 HB POP 115 47.010 41.220 23.670 1.00 0.00 ATOM 14269 C2 POP 115 46.370 41.060 25.670 1.00 0.00 ATOM 14270 HS POP 115 46.840 40.050 25.750 1.00 0.00 ATOM 14271 O21 POP 115 45.140 41.110 26.400 1.00 0.00 ATOM 14272 C21 POP 115 44.670 39.890 26.700 1.00 0.00 ATOM 14273 O22 POP 115 45.110 38.800 26.400 1.00 0.00 ATOM 14274 C22 POP 115 43.450 40.100 27.600 1.00 0.00 ATOM 14275 H2R POP 115 42.700 39.310 27.420 1.00 0.00 ATOM 14276 H2S POP 115 43.030 41.090 27.320 1.00 0.00 ATOM 14277 C3 POP 115 47.280 42.090 26.340 1.00 0.00 ATOM 14278 HX POP 115 46.640 42.990 26.370 1.00 0.00 ATOM 14279 HY POP 115 48.190 42.120 25.700 1.00 0.00 ATOM 14280 O31 POP 115 47.600 41.680 27.680 1.00 0.00 ATOM 14281 C31 POP 115 47.010 42.360 28.660 1.00 0.00 ATOM 14282 O32 POP 115 46.300 43.350 28.550 1.00 0.00 ATOM 14283 C32 POP 115 47.390 41.630 29.940 1.00 0.00 ATOM 14284 H2X POP 115 48.480 41.660 30.110 1.00 0.00 ATOM 14285 H2Y POP 115 47.060 40.570 29.920 1.00 0.00 ATOM 14286 C23 POP 115 43.810 39.900 29.070 1.00 0.00 ATOM 14287 H3R POP 115 44.500 40.730 29.330 1.00 0.00 ATOM 14288 H3S POP 115 44.360 38.980 29.350 1.00 0.00 ATOM 14289 C24 POP 115 42.630 39.940 30.040 1.00 0.00 ATOM 14290 H4R POP 115 42.090 38.980 29.950 1.00 0.00 ATOM 14291 H4S POP 115 41.880 40.720 29.830 1.00 0.00 ATOM 14292 C25 POP 115 43.220 40.050 31.450 1.00 0.00 ATOM 14293 H5R POP 115 43.760 41.020 31.510 1.00 0.00 ATOM 14294 H5S POP 115 44.000 39.260 31.600 1.00 0.00 ATOM 14295 C26 POP 115 42.130 40.040 32.530 1.00 0.00 ATOM 14296 H6R POP 115 41.440 39.170 32.440 1.00 0.00 ATOM 14297 H6S POP 115 41.510 40.960 32.540 1.00 0.00 ATOM 14298 C27 POP 115 42.650 39.720 33.930 1.00 0.00 ATOM 14299 H7R POP 115 43.610 40.170 34.280 1.00 0.00 ATOM 14300 H7S POP 115 42.960 38.650 34.000 1.00 0.00 ATOM 14301 C28 POP 115 41.660 40.020 35.050 1.00 0.00 ATOM 14302 H8R POP 115 40.690 39.500 34.920 1.00 0.00 ATOM 14303 H8S POP 115 41.440 41.110 35.140 1.00 0.00 ATOM 14304 C29 POP 115 42.330 39.430 36.260 1.00 0.00 ATOM 14305 H91 POP 115 42.890 38.530 35.980 1.00 0.00 ATOM 14306 0C21 POP 115 42.190 39.840 37.530 1.00 0.00 ATOM 14307 1H10 POP 115 42.860 39.380 38.280 1.00 0.00 ATOM 14308 1C21 POP 115 41.410 40.990 38.100 1.00 0.00 ATOM 14309 H11R POP 115 40.980 41.580 37.270 1.00 0.00 ATOM 14310 H11S POP 115 42.190 41.580 38.620 1.00 0.00 ATOM 14311 2C21 POP 115 40.310 40.530 39.070 1.00 0.00 ATOM 14312 H12R POP 115 40.610 39.710 39.760 1.00 0.00 ATOM 14313 H12S POP 115 39.480 40.190 38.420 1.00 0.00 ATOM 14314 3C21 POP 115 39.820 41.730 39.880 1.00 0.00 ATOM 14315 H13R POP 115 38.910 41.350 40.390 1.00 0.00 ATOM 14316 H13S POP 115 39.500 42.490 39.140 1.00 0.00 ATOM 14317 4C21 POP 115 40.620 42.340 41.040 1.00 0.00 ATOM 14318 H14R POP 115 40.010 43.150 41.490 1.00 0.00 ATOM 14319 H14S POP 115 41.620 42.690 40.700 1.00 0.00 ATOM 14320 5C21 POP 115 40.870 41.330 42.160 1.00 0.00 ATOM 14321 H15R POP 115 41.440 40.440 41.800 1.00 0.00 ATOM 14322 H15S POP 115 39.860 41.040 42.520 1.00 0.00 ATOM 14323 6C21 POP 115 41.660 41.980 43.300 1.00 0.00 ATOM 14324 H16R POP 115 42.700 42.210 42.990 1.00 0.00 ATOM 14325 H16S POP 115 41.730 41.350 44.210 1.00 0.00 ATOM 14326 7C21 POP 115 40.940 43.200 43.890 1.00 0.00 ATOM 14327 H17R POP 115 39.870 42.930 43.950 1.00 0.00 ATOM 14328 H17S POP 115 41.100 43.920 43.060 1.00 0.00 ATOM 14329 8C21 POP 115 41.450 43.710 45.240 1.00 0.00 ATOM 14330 H18R POP 115 41.610 42.920 46.000 1.00 0.00 ATOM 14331 H18S POP 115 40.650 44.320 45.700 1.00 0.00 ATOM 14332 H18T POP 115 42.370 44.310 45.120 1.00 0.00 ATOM 14333 C33 POP 115 46.660 42.240 31.140 1.00 0.00 ATOM 14334 H3X POP 115 45.570 42.470 31.040 1.00 0.00 ATOM 14335 H3Y POP 115 47.080 43.220 31.440 1.00 0.00 ATOM 14336 C34 POP 115 46.710 41.290 32.340 1.00 0.00 ATOM 14337 H4X POP 115 47.760 41.000 32.570 1.00 0.00 ATOM 14338 H4Y POP 115 46.190 40.330 32.150 1.00 0.00 ATOM 14339 C35 POP 115 46.040 41.900 33.580 1.00 0.00 ATOM 14340 H5X POP 115 44.960 41.940 33.350 1.00 0.00 ATOM 14341 H5Y POP 115 46.340 42.960 33.700 1.00 0.00 ATOM 14342 C36 POP 115 46.310 41.110 34.860 1.00 0.00 ATOM 14343 H6X POP 115 47.410 41.080 35.030 1.00 0.00 ATOM 14344 H6Y POP 115 46.110 40.040 34.660 1.00 0.00 ATOM 14345 C37 POP 115 45.550 41.600 36.100 1.00 0.00 ATOM 14346 H7X POP 115 44.480 41.440 35.820 1.00 0.00 ATOM 14347 H7Y POP 115 45.820 42.670 36.190 1.00 0.00 ATOM 14348 C38 POP 115 45.840 40.830 37.390 1.00 0.00 ATOM 14349 H8X POP 115 46.920 40.590 37.300 1.00 0.00 ATOM 14350 H8Y POP 115 45.300 39.870 37.520 1.00 0.00 ATOM 14351 C39 POP 115 45.590 41.640 38.670 1.00 0.00 ATOM 14352 H9X POP 115 44.500 41.810 38.630 1.00 0.00 ATOM 14353 H9Y POP 115 46.090 42.620 38.520 1.00 0.00 ATOM 14354 0C31 POP 115 45.980 40.890 39.940 1.00 0.00 ATOM 14355 H10X POP 115 45.720 39.810 39.890 1.00 0.00 ATOM 14356 H10Y POP 115 45.480 41.320 40.840 1.00 0.00 ATOM 14357 1C31 POP 115 47.470 40.910 40.310 1.00 0.00 ATOM 14358 H11X POP 115 47.530 41.330 41.330 1.00 0.00 ATOM 14359 H11Y POP 115 47.930 41.700 39.680 1.00 0.00 ATOM 14360 2C31 POP 115 48.210 39.570 40.330 1.00 0.00 ATOM 14361 H12X POP 115 48.140 39.240 39.270 1.00 0.00 ATOM 14362 H12Y POP 115 47.640 38.770 40.850 1.00 0.00 ATOM 14363 3C31 POP 115 49.590 39.680 40.990 1.00 0.00 ATOM 14364 H13X POP 115 49.930 40.730 40.880 1.00 0.00 ATOM 14365 H13Y POP 115 50.260 39.050 40.360 1.00 0.00 ATOM 14366 4C31 POP 115 49.520 39.280 42.460 1.00 0.00 ATOM 14367 H14X POP 115 48.920 38.360 42.610 1.00 0.00 ATOM 14368 H14Y POP 115 48.990 40.080 43.030 1.00 0.00 ATOM 14369 5C31 POP 115 50.860 39.090 43.180 1.00 0.00 ATOM 14370 H15X POP 115 50.680 38.830 44.240 1.00 0.00 ATOM 14371 H15Y POP 115 51.440 40.030 43.080 1.00 0.00 ATOM 14372 6C31 POP 115 51.650 37.980 42.480 1.00 0.00 ATOM 14373 H16X POP 115 52.410 37.600 43.190 1.00 0.00 ATOM 14374 H16Y POP 115 52.240 38.320 41.610 1.00 0.00 ATOM 14375 H16Z POP 115 51.000 37.130 42.200 1.00 0.00 ATOM 14376 N POP 116 18.340 1.710 21.410 1.00 0.00 ATOM 14377 HN1 POP 116 18.260 2.660 20.980 1.00 0.00 ATOM 14378 HN2 POP 116 19.310 1.330 21.460 1.00 0.00 ATOM 14379 HN3 POP 116 17.670 1.080 20.930 1.00 0.00 ATOM 14380 C12 POP 116 17.880 1.920 22.840 1.00 0.00 ATOM 14381 H12A POP 116 18.640 2.530 23.370 1.00 0.00 ATOM 14382 H12B POP 116 17.820 0.950 23.370 1.00 0.00 ATOM 14383 C11 POP 116 16.420 2.380 22.800 1.00 0.00 ATOM 14384 H11A POP 116 16.160 2.520 23.870 1.00 0.00 ATOM 14385 H11B POP 116 15.770 1.620 22.320 1.00 0.00 ATOM 14386 P POP 116 14.670 3.930 21.850 1.00 0.00 ATOM 14387 O13 POP 116 14.020 2.820 21.110 1.00 0.00 ATOM 14388 O14 POP 116 14.620 5.220 21.130 1.00 0.00 ATOM 14389 O11 POP 116 13.870 4.110 23.230 1.00 0.00 ATOM 14390 O12 POP 116 16.210 3.630 22.140 1.00 0.00 ATOM 14391 C1 POP 116 14.030 5.380 23.880 1.00 0.00 ATOM 14392 HA POP 116 13.740 6.180 23.160 1.00 0.00 ATOM 14393 HB POP 116 15.110 5.610 23.970 1.00 0.00 ATOM 14394 C2 POP 116 13.300 5.440 25.230 1.00 0.00 ATOM 14395 HS POP 116 13.680 6.330 25.760 1.00 0.00 ATOM 14396 O21 POP 116 13.630 4.260 25.970 1.00 0.00 ATOM 14397 C21 POP 116 13.850 4.460 27.270 1.00 0.00 ATOM 14398 O22 POP 116 13.680 5.510 27.860 1.00 0.00 ATOM 14399 C22 POP 116 14.280 3.180 27.980 1.00 0.00 ATOM 14400 H2R POP 116 14.980 2.530 27.410 1.00 0.00 ATOM 14401 H2S POP 116 13.330 2.670 28.240 1.00 0.00 ATOM 14402 C3 POP 116 11.780 5.630 25.090 1.00 0.00 ATOM 14403 HX POP 116 11.240 4.780 24.630 1.00 0.00 ATOM 14404 HY POP 116 11.570 6.360 24.270 1.00 0.00 ATOM 14405 O31 POP 116 11.270 6.260 26.270 1.00 0.00 ATOM 14406 C31 POP 116 10.420 5.450 26.900 1.00 0.00 ATOM 14407 O32 POP 116 10.050 4.370 26.450 1.00 0.00 ATOM 14408 C32 POP 116 10.070 6.040 28.250 1.00 0.00 ATOM 14409 H2X POP 116 9.590 7.040 28.120 1.00 0.00 ATOM 14410 H2Y POP 116 10.950 6.300 28.880 1.00 0.00 ATOM 14411 C23 POP 116 15.060 3.470 29.270 1.00 0.00 ATOM 14412 H3R POP 116 14.550 4.180 29.950 1.00 0.00 ATOM 14413 H3S POP 116 16.090 3.690 28.920 1.00 0.00 ATOM 14414 C24 POP 116 15.280 2.130 29.970 1.00 0.00 ATOM 14415 H4R POP 116 15.990 1.510 29.380 1.00 0.00 ATOM 14416 H4S POP 116 14.320 1.590 30.150 1.00 0.00 ATOM 14417 C25 POP 116 15.910 2.250 31.360 1.00 0.00 ATOM 14418 H5R POP 116 16.980 2.540 31.230 1.00 0.00 ATOM 14419 H5S POP 116 15.940 1.260 31.850 1.00 0.00 ATOM 14420 C26 POP 116 15.290 3.190 32.400 1.00 0.00 ATOM 14421 H6R POP 116 15.320 4.260 32.100 1.00 0.00 ATOM 14422 H6S POP 116 16.070 3.150 33.190 1.00 0.00 ATOM 14423 C27 POP 116 14.020 2.590 33.010 1.00 0.00 ATOM 14424 H7R POP 116 14.310 1.570 33.360 1.00 0.00 ATOM 14425 H7S POP 116 13.290 2.640 32.180 1.00 0.00 ATOM 14426 C28 POP 116 13.620 3.470 34.190 1.00 0.00 ATOM 14427 H8R POP 116 13.380 4.520 33.940 1.00 0.00 ATOM 14428 H8S POP 116 14.540 3.520 34.800 1.00 0.00 ATOM 14429 C29 POP 116 12.370 2.950 34.860 1.00 0.00 ATOM 14430 H91 POP 116 11.490 2.820 34.230 1.00 0.00 ATOM 14431 0C21 POP 116 12.150 2.870 36.180 1.00 0.00 ATOM 14432 1H10 POP 116 11.150 2.690 36.590 1.00 0.00 ATOM 14433 1C21 POP 116 13.070 3.210 37.320 1.00 0.00 ATOM 14434 H11R POP 116 14.070 3.510 36.930 1.00 0.00 ATOM 14435 H11S POP 116 13.220 2.330 37.980 1.00 0.00 ATOM 14436 2C21 POP 116 12.600 4.370 38.200 1.00 0.00 ATOM 14437 H12R POP 116 13.320 4.420 39.050 1.00 0.00 ATOM 14438 H12S POP 116 11.620 4.160 38.670 1.00 0.00 ATOM 14439 3C21 POP 116 12.480 5.800 37.680 1.00 0.00 ATOM 14440 H13R POP 116 12.340 6.510 38.520 1.00 0.00 ATOM 14441 H13S POP 116 11.720 5.900 36.880 1.00 0.00 ATOM 14442 4C21 POP 116 13.800 6.120 36.980 1.00 0.00 ATOM 14443 H14R POP 116 14.170 5.370 36.240 1.00 0.00 ATOM 14444 H14S POP 116 14.610 6.260 37.720 1.00 0.00 ATOM 14445 5C21 POP 116 13.690 7.350 36.080 1.00 0.00 ATOM 14446 H15R POP 116 12.990 7.090 35.250 1.00 0.00 ATOM 14447 H15S POP 116 14.680 7.420 35.580 1.00 0.00 ATOM 14448 6C21 POP 116 13.290 8.710 36.640 1.00 0.00 ATOM 14449 H16R POP 116 12.230 8.710 36.970 1.00 0.00 ATOM 14450 H16S POP 116 13.400 9.470 35.840 1.00 0.00 ATOM 14451 7C21 POP 116 14.080 9.060 37.900 1.00 0.00 ATOM 14452 H17R POP 116 15.140 9.140 37.580 1.00 0.00 ATOM 14453 H17S POP 116 13.970 8.330 38.730 1.00 0.00 ATOM 14454 8C21 POP 116 13.840 10.360 38.680 1.00 0.00 ATOM 14455 H18R POP 116 13.190 11.120 38.180 1.00 0.00 ATOM 14456 H18S POP 116 14.740 10.880 39.060 1.00 0.00 ATOM 14457 H18T POP 116 13.240 10.020 39.550 1.00 0.00 ATOM 14458 C33 POP 116 9.210 5.080 29.070 1.00 0.00 ATOM 14459 H3X POP 116 9.460 4.000 28.960 1.00 0.00 ATOM 14460 H3Y POP 116 8.190 5.160 28.630 1.00 0.00 ATOM 14461 C34 POP 116 9.030 5.440 30.550 1.00 0.00 ATOM 14462 H4X POP 116 9.060 6.540 30.620 1.00 0.00 ATOM 14463 H4Y POP 116 9.860 4.920 31.070 1.00 0.00 ATOM 14464 C35 POP 116 7.760 4.820 31.150 1.00 0.00 ATOM 14465 H5X POP 116 7.860 3.740 30.890 1.00 0.00 ATOM 14466 H5Y POP 116 6.920 5.320 30.630 1.00 0.00 ATOM 14467 C36 POP 116 7.570 5.090 32.640 1.00 0.00 ATOM 14468 H6X POP 116 6.830 5.910 32.770 1.00 0.00 ATOM 14469 H6Y POP 116 8.560 5.510 32.940 1.00 0.00 ATOM 14470 C37 POP 116 7.240 3.800 33.380 1.00 0.00 ATOM 14471 H7X POP 116 8.100 3.140 33.150 1.00 0.00 ATOM 14472 H7Y POP 116 6.250 3.410 33.040 1.00 0.00 ATOM 14473 C38 POP 116 7.180 3.880 34.910 1.00 0.00 ATOM 14474 H8X POP 116 6.820 2.870 35.230 1.00 0.00 ATOM 14475 H8Y POP 116 6.600 4.740 35.300 1.00 0.00 ATOM 14476 C39 POP 116 8.520 4.040 35.620 1.00 0.00 ATOM 14477 H9X POP 116 8.970 5.010 35.310 1.00 0.00 ATOM 14478 H9Y POP 116 9.100 3.190 35.200 1.00 0.00 ATOM 14479 0C31 POP 116 8.460 4.020 37.150 1.00 0.00 ATOM 14480 H10X POP 116 7.720 4.740 37.550 1.00 0.00 ATOM 14481 H10Y POP 116 9.440 4.260 37.610 1.00 0.00 ATOM 14482 1C31 POP 116 8.140 2.630 37.700 1.00 0.00 ATOM 14483 H11X POP 116 8.730 1.810 37.230 1.00 0.00 ATOM 14484 H11Y POP 116 7.060 2.420 37.590 1.00 0.00 ATOM 14485 2C31 POP 116 8.400 2.400 39.190 1.00 0.00 ATOM 14486 H12X POP 116 9.470 2.130 39.300 1.00 0.00 ATOM 14487 H12Y POP 116 7.850 1.480 39.490 1.00 0.00 ATOM 14488 3C31 POP 116 8.070 3.480 40.220 1.00 0.00 ATOM 14489 H13X POP 116 8.440 4.460 39.840 1.00 0.00 ATOM 14490 H13Y POP 116 8.640 3.200 41.130 1.00 0.00 ATOM 14491 4C31 POP 116 6.590 3.740 40.490 1.00 0.00 ATOM 14492 H14X POP 116 6.170 2.900 41.090 1.00 0.00 ATOM 14493 H14Y POP 116 6.020 3.820 39.540 1.00 0.00 ATOM 14494 5C31 POP 116 6.300 5.010 41.290 1.00 0.00 ATOM 14495 H15X POP 116 5.230 4.960 41.600 1.00 0.00 ATOM 14496 H15Y POP 116 6.340 5.850 40.560 1.00 0.00 ATOM 14497 6C31 POP 116 7.190 5.270 42.500 1.00 0.00 ATOM 14498 H16X POP 116 6.780 6.080 43.130 1.00 0.00 ATOM 14499 H16Y POP 116 8.200 5.690 42.290 1.00 0.00 ATOM 14500 H16Z POP 116 7.440 4.490 43.250 1.00 0.00 ATOM 14501 N POP 117 54.280 14.430 19.500 1.00 0.00 ATOM 14502 HN1 POP 117 54.730 14.530 18.570 1.00 0.00 ATOM 14503 HN2 POP 117 54.270 15.290 20.090 1.00 0.00 ATOM 14504 HN3 POP 117 54.840 13.690 19.980 1.00 0.00 ATOM 14505 C12 POP 117 52.870 13.940 19.300 1.00 0.00 ATOM 14506 H12A POP 117 52.990 13.010 18.700 1.00 0.00 ATOM 14507 H12B POP 117 52.350 14.650 18.620 1.00 0.00 ATOM 14508 C11 POP 117 52.130 13.660 20.610 1.00 0.00 ATOM 14509 H11A POP 117 51.220 13.110 20.290 1.00 0.00 ATOM 14510 H11B POP 117 51.870 14.620 21.090 1.00 0.00 ATOM 14511 P POP 117 52.260 12.560 22.880 1.00 0.00 ATOM 14512 O13 POP 117 52.880 11.460 23.660 1.00 0.00 ATOM 14513 O14 POP 117 50.790 12.430 22.780 1.00 0.00 ATOM 14514 O11 POP 117 52.520 13.970 23.590 1.00 0.00 ATOM 14515 O12 POP 117 52.910 12.790 21.440 1.00 0.00 ATOM 14516 C1 POP 117 53.860 14.420 23.770 1.00 0.00 ATOM 14517 HA POP 117 54.140 15.270 23.110 1.00 0.00 ATOM 14518 HB POP 117 54.630 13.620 23.680 1.00 0.00 ATOM 14519 C2 POP 117 53.960 14.670 25.280 1.00 0.00 ATOM 14520 HS POP 117 55.040 14.820 25.510 1.00 0.00 ATOM 14521 O21 POP 117 53.490 13.550 26.040 1.00 0.00 ATOM 14522 C21 POP 117 54.180 13.290 27.150 1.00 0.00 ATOM 14523 O22 POP 117 55.220 13.800 27.520 1.00 0.00 ATOM 14524 C22 POP 117 53.510 12.190 27.970 1.00 0.00 ATOM 14525 H2R POP 117 54.400 11.680 28.410 1.00 0.00 ATOM 14526 H2S POP 117 52.980 11.430 27.370 1.00 0.00 ATOM 14527 C3 POP 117 53.070 15.860 25.690 1.00 0.00 ATOM 14528 HX POP 117 52.080 15.600 25.260 1.00 0.00 ATOM 14529 HY POP 117 53.470 16.760 25.180 1.00 0.00 ATOM 14530 O31 POP 117 52.900 16.000 27.110 1.00 0.00 ATOM 14531 C31 POP 117 51.990 16.900 27.470 1.00 0.00 ATOM 14532 O32 POP 117 51.320 17.520 26.650 1.00 0.00 ATOM 14533 C32 POP 117 52.140 17.160 28.960 1.00 0.00 ATOM 14534 H2X POP 117 53.120 17.630 29.200 1.00 0.00 ATOM 14535 H2Y POP 117 52.060 16.180 29.480 1.00 0.00 ATOM 14536 C23 POP 117 52.760 12.830 29.140 1.00 0.00 ATOM 14537 H3R POP 117 51.920 13.330 28.620 1.00 0.00 ATOM 14538 H3S POP 117 53.330 13.680 29.560 1.00 0.00 ATOM 14539 C24 POP 117 52.080 11.780 30.020 1.00 0.00 ATOM 14540 H4R POP 117 51.750 10.900 29.420 1.00 0.00 ATOM 14541 H4S POP 117 51.160 12.180 30.490 1.00 0.00 ATOM 14542 C25 POP 117 53.060 11.300 31.100 1.00 0.00 ATOM 14543 H5R POP 117 53.450 12.150 31.690 1.00 0.00 ATOM 14544 H5S POP 117 53.980 10.950 30.580 1.00 0.00 ATOM 14545 C26 POP 117 52.650 10.270 32.160 1.00 0.00 ATOM 14546 H6R POP 117 53.440 9.580 32.530 1.00 0.00 ATOM 14547 H6S POP 117 51.910 9.570 31.720 1.00 0.00 ATOM 14548 C27 POP 117 51.980 10.860 33.400 1.00 0.00 ATOM 14549 H7R POP 117 51.060 11.340 33.020 1.00 0.00 ATOM 14550 H7S POP 117 52.780 11.540 33.750 1.00 0.00 ATOM 14551 C28 POP 117 51.570 9.820 34.440 1.00 0.00 ATOM 14552 H8R POP 117 52.410 9.130 34.680 1.00 0.00 ATOM 14553 H8S POP 117 50.880 9.120 33.920 1.00 0.00 ATOM 14554 C29 POP 117 50.960 10.370 35.700 1.00 0.00 ATOM 14555 H91 POP 117 51.670 10.940 36.310 1.00 0.00 ATOM 14556 0C21 POP 117 49.770 10.040 36.230 1.00 0.00 ATOM 14557 1H10 POP 117 49.350 10.620 37.060 1.00 0.00 ATOM 14558 1C21 POP 117 48.790 9.110 35.570 1.00 0.00 ATOM 14559 H11R POP 117 48.650 8.120 36.040 1.00 0.00 ATOM 14560 H11S POP 117 48.990 9.000 34.480 1.00 0.00 ATOM 14561 2C21 POP 117 47.380 9.680 35.690 1.00 0.00 ATOM 14562 H12R POP 117 47.060 9.660 36.760 1.00 0.00 ATOM 14563 H12S POP 117 46.750 9.050 35.030 1.00 0.00 ATOM 14564 3C21 POP 117 47.190 11.080 35.110 1.00 0.00 ATOM 14565 H13R POP 117 47.800 11.770 35.730 1.00 0.00 ATOM 14566 H13S POP 117 46.150 11.360 35.380 1.00 0.00 ATOM 14567 4C21 POP 117 47.380 11.300 33.610 1.00 0.00 ATOM 14568 H14R POP 117 46.650 10.750 32.980 1.00 0.00 ATOM 14569 H14S POP 117 48.340 10.790 33.390 1.00 0.00 ATOM 14570 5C21 POP 117 47.430 12.770 33.200 1.00 0.00 ATOM 14571 H15R POP 117 48.280 13.190 33.780 1.00 0.00 ATOM 14572 H15S POP 117 46.490 13.280 33.510 1.00 0.00 ATOM 14573 6C21 POP 117 47.620 13.100 31.710 1.00 0.00 ATOM 14574 H16R POP 117 46.890 13.860 31.370 1.00 0.00 ATOM 14575 H16S POP 117 47.630 12.170 31.100 1.00 0.00 ATOM 14576 7C21 POP 117 48.970 13.730 31.390 1.00 0.00 ATOM 14577 H17R POP 117 49.730 13.000 31.760 1.00 0.00 ATOM 14578 H17S POP 117 49.060 14.590 32.090 1.00 0.00 ATOM 14579 8C21 POP 117 49.160 14.110 29.930 1.00 0.00 ATOM 14580 H18R POP 117 48.730 13.350 29.240 1.00 0.00 ATOM 14581 H18S POP 117 50.200 14.300 29.580 1.00 0.00 ATOM 14582 H18T POP 117 48.570 15.020 29.720 1.00 0.00 ATOM 14583 C33 POP 117 51.070 18.100 29.520 1.00 0.00 ATOM 14584 H3X POP 117 50.080 18.080 29.010 1.00 0.00 ATOM 14585 H3Y POP 117 51.540 19.100 29.430 1.00 0.00 ATOM 14586 C34 POP 117 50.820 17.760 30.990 1.00 0.00 ATOM 14587 H4X POP 117 51.690 17.300 31.510 1.00 0.00 ATOM 14588 H4Y POP 117 50.040 16.970 30.940 1.00 0.00 ATOM 14589 C35 POP 117 50.450 18.930 31.890 1.00 0.00 ATOM 14590 H5X POP 117 49.630 19.560 31.490 1.00 0.00 ATOM 14591 H5Y POP 117 51.350 19.590 31.950 1.00 0.00 ATOM 14592 C36 POP 117 50.130 18.520 33.330 1.00 0.00 ATOM 14593 H6X POP 117 51.040 17.990 33.670 1.00 0.00 ATOM 14594 H6Y POP 117 49.200 17.910 33.390 1.00 0.00 ATOM 14595 C37 POP 117 49.960 19.760 34.210 1.00 0.00 ATOM 14596 H7X POP 117 48.940 20.150 33.960 1.00 0.00 ATOM 14597 H7Y POP 117 50.660 20.590 33.990 1.00 0.00 ATOM 14598 C38 POP 117 49.930 19.410 35.700 1.00 0.00 ATOM 14599 H8X POP 117 50.930 19.090 36.070 1.00 0.00 ATOM 14600 H8Y POP 117 49.310 18.540 35.960 1.00 0.00 ATOM 14601 C39 POP 117 49.530 20.610 36.550 1.00 0.00 ATOM 14602 H9X POP 117 48.460 20.850 36.340 1.00 0.00 ATOM 14603 H9Y POP 117 50.150 21.460 36.170 1.00 0.00 ATOM 14604 0C31 POP 117 49.670 20.460 38.060 1.00 0.00 ATOM 14605 H10X POP 117 49.450 21.340 38.710 1.00 0.00 ATOM 14606 H10Y POP 117 50.730 20.250 38.340 1.00 0.00 ATOM 14607 1C31 POP 117 48.950 19.280 38.720 1.00 0.00 ATOM 14608 H11X POP 117 49.130 18.300 38.220 1.00 0.00 ATOM 14609 H11Y POP 117 47.860 19.510 38.650 1.00 0.00 ATOM 14610 2C31 POP 117 49.400 19.170 40.180 1.00 0.00 ATOM 14611 H12X POP 117 49.510 20.220 40.540 1.00 0.00 ATOM 14612 H12Y POP 117 50.380 18.650 40.240 1.00 0.00 ATOM 14613 3C31 POP 117 48.470 18.240 40.950 1.00 0.00 ATOM 14614 H13X POP 117 48.520 17.300 40.380 1.00 0.00 ATOM 14615 H13Y POP 117 47.410 18.600 40.910 1.00 0.00 ATOM 14616 4C31 POP 117 48.940 18.180 42.410 1.00 0.00 ATOM 14617 H14X POP 117 48.720 19.110 42.970 1.00 0.00 ATOM 14618 H14Y POP 117 50.040 18.030 42.490 1.00 0.00 ATOM 14619 5C31 POP 117 48.130 17.110 43.150 1.00 0.00 ATOM 14620 H15X POP 117 48.470 16.090 42.880 1.00 0.00 ATOM 14621 H15Y POP 117 47.060 17.120 42.860 1.00 0.00 ATOM 14622 6C31 POP 117 48.220 17.210 44.670 1.00 0.00 ATOM 14623 H16X POP 117 48.080 18.260 45.010 1.00 0.00 ATOM 14624 H16Y POP 117 49.210 16.840 45.010 1.00 0.00 ATOM 14625 H16Z POP 117 47.470 16.540 45.160 1.00 0.00 ATOM 14626 N POP 118 48.850 13.720 23.820 1.00 0.00 ATOM 14627 HN1 POP 118 47.990 13.170 23.670 1.00 0.00 ATOM 14628 HN2 POP 118 48.910 14.520 23.160 1.00 0.00 ATOM 14629 HN3 POP 118 49.630 13.100 23.500 1.00 0.00 ATOM 14630 C12 POP 118 49.300 14.160 25.190 1.00 0.00 ATOM 14631 H12A POP 118 50.410 14.260 25.230 1.00 0.00 ATOM 14632 H12B POP 118 48.920 13.370 25.870 1.00 0.00 ATOM 14633 C11 POP 118 48.650 15.510 25.520 1.00 0.00 ATOM 14634 H11A POP 118 48.830 16.100 24.600 1.00 0.00 ATOM 14635 H11B POP 118 49.080 16.050 26.390 1.00 0.00 ATOM 14636 P POP 118 46.360 16.400 26.170 1.00 0.00 ATOM 14637 O13 POP 118 47.090 17.690 26.100 1.00 0.00 ATOM 14638 O14 POP 118 45.080 16.370 25.440 1.00 0.00 ATOM 14639 O11 POP 118 46.160 16.000 27.700 1.00 0.00 ATOM 14640 O12 POP 118 47.250 15.220 25.560 1.00 0.00 ATOM 14641 C1 POP 118 45.390 14.810 27.900 1.00 0.00 ATOM 14642 HA POP 118 45.820 14.260 28.760 1.00 0.00 ATOM 14643 HB POP 118 45.380 14.140 27.020 1.00 0.00 ATOM 14644 C2 POP 118 43.900 15.080 28.220 1.00 0.00 ATOM 14645 HS POP 118 43.440 15.180 27.210 1.00 0.00 ATOM 14646 O21 POP 118 43.830 16.290 28.980 1.00 0.00 ATOM 14647 C21 POP 118 42.630 16.630 29.440 1.00 0.00 ATOM 14648 O22 POP 118 41.580 16.310 28.910 1.00 0.00 ATOM 14649 C22 POP 118 42.740 17.670 30.550 1.00 0.00 ATOM 14650 H2R POP 118 42.010 18.510 30.430 1.00 0.00 ATOM 14651 H2S POP 118 43.730 18.160 30.430 1.00 0.00 ATOM 14652 C3 POP 118 43.290 13.890 28.980 1.00 0.00 ATOM 14653 HX POP 118 43.580 12.950 28.470 1.00 0.00 ATOM 14654 HY POP 118 42.180 14.000 28.920 1.00 0.00 ATOM 14655 O31 POP 118 43.690 13.750 30.340 1.00 0.00 ATOM 14656 C31 POP 118 43.070 12.850 31.110 1.00 0.00 ATOM 14657 O32 POP 118 42.250 12.000 30.780 1.00 0.00 ATOM 14658 C32 POP 118 43.570 12.920 32.540 1.00 0.00 ATOM 14659 H2X POP 118 43.480 13.990 32.800 1.00 0.00 ATOM 14660 H2Y POP 118 44.680 12.830 32.490 1.00 0.00 ATOM 14661 C23 POP 118 42.600 17.060 31.940 1.00 0.00 ATOM 14662 H3R POP 118 43.390 16.270 31.930 1.00 0.00 ATOM 14663 H3S POP 118 41.690 16.430 31.880 1.00 0.00 ATOM 14664 C24 POP 118 42.550 18.050 33.100 1.00 0.00 ATOM 14665 H4R POP 118 41.960 18.910 32.730 1.00 0.00 ATOM 14666 H4S POP 118 43.520 18.460 33.440 1.00 0.00 ATOM 14667 C25 POP 118 41.830 17.480 34.330 1.00 0.00 ATOM 14668 H5R POP 118 40.840 17.020 34.120 1.00 0.00 ATOM 14669 H5S POP 118 41.570 18.290 35.030 1.00 0.00 ATOM 14670 C26 POP 118 42.660 16.630 35.290 1.00 0.00 ATOM 14671 H6R POP 118 43.550 17.200 35.630 1.00 0.00 ATOM 14672 H6S POP 118 42.900 15.710 34.710 1.00 0.00 ATOM 14673 C27 POP 118 41.920 16.190 36.560 1.00 0.00 ATOM 14674 H7R POP 118 41.030 15.620 36.220 1.00 0.00 ATOM 14675 H7S POP 118 41.680 17.100 37.150 1.00 0.00 ATOM 14676 C28 POP 118 42.640 15.190 37.470 1.00 0.00 ATOM 14677 H8R POP 118 43.270 15.870 38.080 1.00 0.00 ATOM 14678 H8S POP 118 43.350 14.550 36.900 1.00 0.00 ATOM 14679 C29 POP 118 41.670 14.390 38.270 1.00 0.00 ATOM 14680 H91 POP 118 41.290 13.490 37.760 1.00 0.00 ATOM 14681 0C21 POP 118 41.190 14.750 39.470 1.00 0.00 ATOM 14682 1H10 POP 118 40.340 14.230 39.940 1.00 0.00 ATOM 14683 1C21 POP 118 41.480 15.970 40.300 1.00 0.00 ATOM 14684 H11R POP 118 40.520 16.450 40.600 1.00 0.00 ATOM 14685 H11S POP 118 41.850 16.770 39.620 1.00 0.00 ATOM 14686 2C21 POP 118 42.510 15.800 41.410 1.00 0.00 ATOM 14687 H12R POP 118 43.130 14.870 41.340 1.00 0.00 ATOM 14688 H12S POP 118 41.870 15.730 42.310 1.00 0.00 ATOM 14689 3C21 POP 118 43.550 16.920 41.420 1.00 0.00 ATOM 14690 H13R POP 118 42.960 17.840 41.260 1.00 0.00 ATOM 14691 H13S POP 118 44.450 16.820 40.770 1.00 0.00 ATOM 14692 4C21 POP 118 44.140 17.020 42.830 1.00 0.00 ATOM 14693 H14R POP 118 44.910 17.820 42.760 1.00 0.00 ATOM 14694 H14S POP 118 44.800 16.140 43.030 1.00 0.00 ATOM 14695 5C21 POP 118 43.270 17.440 44.010 1.00 0.00 ATOM 14696 H15R POP 118 42.680 16.530 44.220 1.00 0.00 ATOM 14697 H15S POP 118 42.550 18.250 43.790 1.00 0.00 ATOM 14698 6C21 POP 118 44.180 17.770 45.200 1.00 0.00 ATOM 14699 H16R POP 118 45.000 17.020 45.130 1.00 0.00 ATOM 14700 H16S POP 118 43.590 17.560 46.120 1.00 0.00 ATOM 14701 7C21 POP 118 44.620 19.230 45.180 1.00 0.00 ATOM 14702 H17R POP 118 43.760 19.930 45.280 1.00 0.00 ATOM 14703 H17S POP 118 45.100 19.560 44.230 1.00 0.00 ATOM 14704 8C21 POP 118 45.630 19.670 46.240 1.00 0.00 ATOM 14705 H18R POP 118 45.060 19.480 47.170 1.00 0.00 ATOM 14706 H18S POP 118 45.990 20.720 46.260 1.00 0.00 ATOM 14707 H18T POP 118 46.490 18.970 46.300 1.00 0.00 ATOM 14708 C33 POP 118 43.040 11.820 33.470 1.00 0.00 ATOM 14709 H3X POP 118 43.620 10.890 33.290 1.00 0.00 ATOM 14710 H3Y POP 118 41.950 11.600 33.400 1.00 0.00 ATOM 14711 C34 POP 118 43.450 12.310 34.860 1.00 0.00 ATOM 14712 H4X POP 118 42.900 13.260 35.010 1.00 0.00 ATOM 14713 H4Y POP 118 44.520 12.600 34.870 1.00 0.00 ATOM 14714 C35 POP 118 43.220 11.160 35.840 1.00 0.00 ATOM 14715 H5X POP 118 43.680 11.550 36.770 1.00 0.00 ATOM 14716 H5Y POP 118 43.790 10.260 35.500 1.00 0.00 ATOM 14717 C36 POP 118 41.740 10.820 36.060 1.00 0.00 ATOM 14718 H6X POP 118 41.200 10.420 35.180 1.00 0.00 ATOM 14719 H6Y POP 118 41.260 11.810 36.220 1.00 0.00 ATOM 14720 C37 POP 118 41.540 9.880 37.260 1.00 0.00 ATOM 14721 H7X POP 118 42.290 10.280 37.980 1.00 0.00 ATOM 14722 H7Y POP 118 41.920 8.900 36.910 1.00 0.00 ATOM 14723 C38 POP 118 40.160 9.750 37.900 1.00 0.00 ATOM 14724 H8X POP 118 39.430 9.550 37.080 1.00 0.00 ATOM 14725 H8Y POP 118 39.980 10.790 38.250 1.00 0.00 ATOM 14726 C39 POP 118 40.260 8.800 39.090 1.00 0.00 ATOM 14727 H9X POP 118 41.020 9.190 39.800 1.00 0.00 ATOM 14728 H9Y POP 118 40.770 7.920 38.640 1.00 0.00 ATOM 14729 0C31 POP 118 38.910 8.350 39.670 1.00 0.00 ATOM 14730 H10X POP 118 39.050 7.540 40.420 1.00 0.00 ATOM 14731 H10Y POP 118 38.430 7.780 38.850 1.00 0.00 ATOM 14732 1C31 POP 118 37.870 9.340 40.180 1.00 0.00 ATOM 14733 H11X POP 118 36.980 8.840 40.620 1.00 0.00 ATOM 14734 H11Y POP 118 37.460 9.860 39.290 1.00 0.00 ATOM 14735 2C31 POP 118 38.470 10.350 41.160 1.00 0.00 ATOM 14736 H12X POP 118 39.310 10.930 40.720 1.00 0.00 ATOM 14737 H12Y POP 118 38.930 9.820 42.030 1.00 0.00 ATOM 14738 3C31 POP 118 37.400 11.300 41.690 1.00 0.00 ATOM 14739 H13X POP 118 36.630 10.750 42.270 1.00 0.00 ATOM 14740 H13Y POP 118 36.840 11.750 40.850 1.00 0.00 ATOM 14741 4C31 POP 118 37.810 12.360 42.720 1.00 0.00 ATOM 14742 H14X POP 118 38.480 13.030 42.150 1.00 0.00 ATOM 14743 H14Y POP 118 38.390 11.830 43.510 1.00 0.00 ATOM 14744 5C31 POP 118 36.640 13.230 43.190 1.00 0.00 ATOM 14745 H15X POP 118 36.050 12.430 43.700 1.00 0.00 ATOM 14746 H15Y POP 118 36.170 13.430 42.200 1.00 0.00 ATOM 14747 6C31 POP 118 36.960 14.370 44.150 1.00 0.00 ATOM 14748 H16X POP 118 36.020 14.880 44.450 1.00 0.00 ATOM 14749 H16Y POP 118 37.640 15.080 43.630 1.00 0.00 ATOM 14750 H16Z POP 118 37.420 13.980 45.090 1.00 0.00 ATOM 14751 N POP 119 53.490 32.720 18.120 1.00 0.00 ATOM 14752 HN1 POP 119 54.310 33.360 18.020 1.00 0.00 ATOM 14753 HN2 POP 119 53.660 32.250 19.040 1.00 0.00 ATOM 14754 HN3 POP 119 53.310 32.010 17.380 1.00 0.00 ATOM 14755 C12 POP 119 52.230 33.520 18.300 1.00 0.00 ATOM 14756 H12A POP 119 51.310 32.910 18.120 1.00 0.00 ATOM 14757 H12B POP 119 52.320 34.270 17.490 1.00 0.00 ATOM 14758 C11 POP 119 52.190 34.110 19.710 1.00 0.00 ATOM 14759 H11A POP 119 51.960 33.350 20.480 1.00 0.00 ATOM 14760 H11B POP 119 51.380 34.870 19.760 1.00 0.00 ATOM 14761 P POP 119 53.450 36.160 20.450 1.00 0.00 ATOM 14762 O13 POP 119 52.330 36.530 21.360 1.00 0.00 ATOM 14763 O14 POP 119 53.610 36.880 19.170 1.00 0.00 ATOM 14764 O11 POP 119 54.820 36.420 21.240 1.00 0.00 ATOM 14765 O12 POP 119 53.480 34.600 20.120 1.00 0.00 ATOM 14766 C1 POP 119 55.890 35.660 20.680 1.00 0.00 ATOM 14767 HA POP 119 55.930 35.950 19.610 1.00 0.00 ATOM 14768 HB POP 119 55.850 34.550 20.730 1.00 0.00 ATOM 14769 C2 POP 119 57.160 36.230 21.340 1.00 0.00 ATOM 14770 HS POP 119 57.960 35.470 21.190 1.00 0.00 ATOM 14771 O21 POP 119 57.050 36.460 22.740 1.00 0.00 ATOM 14772 C21 POP 119 56.670 35.340 23.350 1.00 0.00 ATOM 14773 O22 POP 119 56.740 34.230 22.850 1.00 0.00 ATOM 14774 C22 POP 119 56.150 35.540 24.770 1.00 0.00 ATOM 14775 H2R POP 119 55.050 35.580 24.870 1.00 0.00 ATOM 14776 H2S POP 119 56.560 36.520 25.090 1.00 0.00 ATOM 14777 C3 POP 119 57.580 37.620 20.820 1.00 0.00 ATOM 14778 HX POP 119 56.680 38.260 20.960 1.00 0.00 ATOM 14779 HY POP 119 57.830 37.510 19.740 1.00 0.00 ATOM 14780 O31 POP 119 58.700 38.270 21.420 1.00 0.00 ATOM 14781 C31 POP 119 59.890 37.800 21.060 1.00 0.00 ATOM 14782 O32 POP 119 60.030 36.730 20.480 1.00 0.00 ATOM 14783 C32 POP 119 60.980 38.730 21.570 1.00 0.00 ATOM 14784 H2X POP 119 61.000 39.660 20.960 1.00 0.00 ATOM 14785 H2Y POP 119 62.020 38.370 21.410 1.00 0.00 ATOM 14786 C23 POP 119 56.730 34.430 25.640 1.00 0.00 ATOM 14787 H3R POP 119 57.840 34.420 25.610 1.00 0.00 ATOM 14788 H3S POP 119 56.380 33.400 25.400 1.00 0.00 ATOM 14789 C24 POP 119 56.290 34.660 27.090 1.00 0.00 ATOM 14790 H4R POP 119 56.650 35.660 27.420 1.00 0.00 ATOM 14791 H4S POP 119 56.890 34.000 27.760 1.00 0.00 ATOM 14792 C25 POP 119 54.830 34.600 27.550 1.00 0.00 ATOM 14793 H5R POP 119 54.390 33.580 27.450 1.00 0.00 ATOM 14794 H5S POP 119 54.400 35.420 26.940 1.00 0.00 ATOM 14795 C26 POP 119 54.780 34.920 29.040 1.00 0.00 ATOM 14796 H6R POP 119 55.220 35.880 29.370 1.00 0.00 ATOM 14797 H6S POP 119 55.380 34.090 29.480 1.00 0.00 ATOM 14798 C27 POP 119 53.410 34.950 29.720 1.00 0.00 ATOM 14799 H7R POP 119 52.620 34.220 29.440 1.00 0.00 ATOM 14800 H7S POP 119 53.050 35.910 29.290 1.00 0.00 ATOM 14801 C28 POP 119 53.530 35.110 31.240 1.00 0.00 ATOM 14802 H8R POP 119 52.570 35.600 31.510 1.00 0.00 ATOM 14803 H8S POP 119 54.350 35.790 31.560 1.00 0.00 ATOM 14804 C29 POP 119 53.870 33.800 31.890 1.00 0.00 ATOM 14805 H91 POP 119 54.710 33.280 31.400 1.00 0.00 ATOM 14806 0C21 POP 119 53.290 33.210 32.940 1.00 0.00 ATOM 14807 1H10 POP 119 53.700 32.240 33.250 1.00 0.00 ATOM 14808 1C21 POP 119 52.180 33.840 33.740 1.00 0.00 ATOM 14809 H11R POP 119 51.590 33.080 34.300 1.00 0.00 ATOM 14810 H11S POP 119 51.570 34.550 33.150 1.00 0.00 ATOM 14811 2C21 POP 119 52.800 34.550 34.950 1.00 0.00 ATOM 14812 H12R POP 119 52.150 35.420 35.190 1.00 0.00 ATOM 14813 H12S POP 119 53.730 35.080 34.650 1.00 0.00 ATOM 14814 3C21 POP 119 53.070 33.650 36.160 1.00 0.00 ATOM 14815 H13R POP 119 53.770 32.870 35.810 1.00 0.00 ATOM 14816 H13S POP 119 52.130 33.200 36.540 1.00 0.00 ATOM 14817 4C21 POP 119 53.750 34.460 37.270 1.00 0.00 ATOM 14818 H14R POP 119 53.030 35.080 37.860 1.00 0.00 ATOM 14819 H14S POP 119 54.350 35.230 36.750 1.00 0.00 ATOM 14820 5C21 POP 119 54.280 33.630 38.440 1.00 0.00 ATOM 14821 H15R POP 119 53.420 32.930 38.570 1.00 0.00 ATOM 14822 H15S POP 119 55.220 33.110 38.160 1.00 0.00 ATOM 14823 6C21 POP 119 54.300 34.350 39.790 1.00 0.00 ATOM 14824 H16R POP 119 54.270 33.570 40.580 1.00 0.00 ATOM 14825 H16S POP 119 53.400 35.010 39.810 1.00 0.00 ATOM 14826 7C21 POP 119 55.660 35.030 39.920 1.00 0.00 ATOM 14827 H17R POP 119 55.970 35.440 38.930 1.00 0.00 ATOM 14828 H17S POP 119 56.500 34.320 40.130 1.00 0.00 ATOM 14829 8C21 POP 119 55.780 36.170 40.930 1.00 0.00 ATOM 14830 H18R POP 119 56.780 36.620 40.760 1.00 0.00 ATOM 14831 H18S POP 119 55.600 35.820 41.970 1.00 0.00 ATOM 14832 H18T POP 119 55.060 36.990 40.740 1.00 0.00 ATOM 14833 C33 POP 119 60.830 39.000 23.070 1.00 0.00 ATOM 14834 H3X POP 119 59.770 39.270 23.250 1.00 0.00 ATOM 14835 H3Y POP 119 61.560 39.760 23.430 1.00 0.00 ATOM 14836 C34 POP 119 61.210 37.860 24.020 1.00 0.00 ATOM 14837 H4X POP 119 62.300 37.670 23.980 1.00 0.00 ATOM 14838 H4Y POP 119 60.780 36.900 23.660 1.00 0.00 ATOM 14839 C35 POP 119 60.840 38.090 25.480 1.00 0.00 ATOM 14840 H5X POP 119 59.830 38.540 25.580 1.00 0.00 ATOM 14841 H5Y POP 119 61.530 38.810 25.960 1.00 0.00 ATOM 14842 C36 POP 119 60.840 36.850 26.390 1.00 0.00 ATOM 14843 H6X POP 119 61.840 36.690 26.830 1.00 0.00 ATOM 14844 H6Y POP 119 60.390 35.930 25.960 1.00 0.00 ATOM 14845 C37 POP 119 59.760 37.120 27.440 1.00 0.00 ATOM 14846 H7X POP 119 58.710 37.150 27.080 1.00 0.00 ATOM 14847 H7Y POP 119 59.970 38.140 27.820 1.00 0.00 ATOM 14848 C38 POP 119 59.960 36.130 28.590 1.00 0.00 ATOM 14849 H8X POP 119 61.000 36.120 28.950 1.00 0.00 ATOM 14850 H8Y POP 119 59.700 35.080 28.330 1.00 0.00 ATOM 14851 C39 POP 119 59.170 36.550 29.830 1.00 0.00 ATOM 14852 H9X POP 119 58.060 36.500 29.710 1.00 0.00 ATOM 14853 H9Y POP 119 59.430 37.590 30.100 1.00 0.00 ATOM 14854 0C31 POP 119 59.620 35.750 31.060 1.00 0.00 ATOM 14855 H10X POP 119 60.670 36.050 31.270 1.00 0.00 ATOM 14856 H10Y POP 119 59.500 34.680 30.810 1.00 0.00 ATOM 14857 1C31 POP 119 58.890 36.160 32.340 1.00 0.00 ATOM 14858 H11X POP 119 58.570 37.230 32.330 1.00 0.00 ATOM 14859 H11Y POP 119 59.530 36.010 33.240 1.00 0.00 ATOM 14860 2C31 POP 119 57.580 35.450 32.690 1.00 0.00 ATOM 14861 H12X POP 119 57.720 34.360 32.600 1.00 0.00 ATOM 14862 H12Y POP 119 56.780 35.790 32.000 1.00 0.00 ATOM 14863 3C31 POP 119 57.090 35.770 34.100 1.00 0.00 ATOM 14864 H13X POP 119 55.990 35.640 34.200 1.00 0.00 ATOM 14865 H13Y POP 119 57.100 36.870 34.260 1.00 0.00 ATOM 14866 4C31 POP 119 57.870 35.050 35.200 1.00 0.00 ATOM 14867 H14X POP 119 58.920 34.900 34.850 1.00 0.00 ATOM 14868 H14Y POP 119 57.400 34.050 35.240 1.00 0.00 ATOM 14869 5C31 POP 119 57.650 35.660 36.580 1.00 0.00 ATOM 14870 H15X POP 119 58.180 34.990 37.290 1.00 0.00 ATOM 14871 H15Y POP 119 56.540 35.720 36.700 1.00 0.00 ATOM 14872 6C31 POP 119 58.260 37.060 36.640 1.00 0.00 ATOM 14873 H16X POP 119 59.360 37.090 36.820 1.00 0.00 ATOM 14874 H16Y POP 119 57.730 37.800 37.280 1.00 0.00 ATOM 14875 H16Z POP 119 58.210 37.520 35.630 1.00 0.00 ATOM 14876 N POP 120 43.320 50.180 27.010 1.00 0.00 ATOM 14877 HN1 POP 120 43.910 49.320 27.050 1.00 0.00 ATOM 14878 HN2 POP 120 42.370 49.800 26.820 1.00 0.00 ATOM 14879 HN3 POP 120 43.660 50.730 26.200 1.00 0.00 ATOM 14880 C12 POP 120 43.300 51.060 28.240 1.00 0.00 ATOM 14881 H12A POP 120 44.120 51.760 27.980 1.00 0.00 ATOM 14882 H12B POP 120 43.430 50.420 29.140 1.00 0.00 ATOM 14883 C11 POP 120 41.960 51.790 28.300 1.00 0.00 ATOM 14884 H11A POP 120 42.000 52.530 29.120 1.00 0.00 ATOM 14885 H11B POP 120 41.050 51.200 28.550 1.00 0.00 ATOM 14886 P POP 120 40.360 52.250 26.510 1.00 0.00 ATOM 14887 O13 POP 120 40.090 53.150 25.360 1.00 0.00 ATOM 14888 O14 POP 120 40.260 50.810 26.190 1.00 0.00 ATOM 14889 O11 POP 120 39.380 52.570 27.740 1.00 0.00 ATOM 14890 O12 POP 120 41.820 52.560 27.100 1.00 0.00 ATOM 14891 C1 POP 120 38.530 53.720 27.710 1.00 0.00 ATOM 14892 HA POP 120 38.010 53.750 28.690 1.00 0.00 ATOM 14893 HB POP 120 37.690 53.630 26.990 1.00 0.00 ATOM 14894 C2 POP 120 39.270 55.070 27.610 1.00 0.00 ATOM 14895 HS POP 120 39.700 55.160 26.590 1.00 0.00 ATOM 14896 O21 POP 120 40.240 55.120 28.660 1.00 0.00 ATOM 14897 C21 POP 120 41.140 56.110 28.610 1.00 0.00 ATOM 14898 O22 POP 120 41.180 56.930 27.710 1.00 0.00 ATOM 14899 C22 POP 120 42.130 55.760 29.710 1.00 0.00 ATOM 14900 H2R POP 120 42.560 56.710 30.100 1.00 0.00 ATOM 14901 H2S POP 120 42.950 55.180 29.240 1.00 0.00 ATOM 14902 C3 POP 120 38.220 56.190 27.710 1.00 0.00 ATOM 14903 HX POP 120 37.500 56.100 26.880 1.00 0.00 ATOM 14904 HY POP 120 38.710 57.150 27.410 1.00 0.00 ATOM 14905 O31 POP 120 37.720 56.280 29.050 1.00 0.00 ATOM 14906 C31 POP 120 36.390 56.360 29.110 1.00 0.00 ATOM 14907 O32 POP 120 35.560 56.070 28.270 1.00 0.00 ATOM 14908 C32 POP 120 36.000 56.960 30.460 1.00 0.00 ATOM 14909 H2X POP 120 35.640 58.000 30.330 1.00 0.00 ATOM 14910 H2Y POP 120 36.840 56.910 31.190 1.00 0.00 ATOM 14911 C23 POP 120 41.560 54.900 30.840 1.00 0.00 ATOM 14912 H3R POP 120 41.150 54.000 30.350 1.00 0.00 ATOM 14913 H3S POP 120 40.620 55.290 31.270 1.00 0.00 ATOM 14914 C24 POP 120 42.730 54.620 31.790 1.00 0.00 ATOM 14915 H4R POP 120 43.680 54.250 31.340 1.00 0.00 ATOM 14916 H4S POP 120 42.360 53.860 32.520 1.00 0.00 ATOM 14917 C25 POP 120 43.090 55.840 32.630 1.00 0.00 ATOM 14918 H5R POP 120 42.230 56.490 32.900 1.00 0.00 ATOM 14919 H5S POP 120 43.930 56.370 32.130 1.00 0.00 ATOM 14920 C26 POP 120 43.710 55.480 33.980 1.00 0.00 ATOM 14921 H6R POP 120 42.940 55.090 34.690 1.00 0.00 ATOM 14922 H6S POP 120 44.240 56.340 34.430 1.00 0.00 ATOM 14923 C27 POP 120 44.800 54.410 33.870 1.00 0.00 ATOM 14924 H7R POP 120 45.670 54.580 33.200 1.00 0.00 ATOM 14925 H7S POP 120 44.280 53.520 33.460 1.00 0.00 ATOM 14926 C28 POP 120 45.490 54.260 35.230 1.00 0.00 ATOM 14927 H8R POP 120 45.900 55.250 35.520 1.00 0.00 ATOM 14928 H8S POP 120 46.310 53.520 35.140 1.00 0.00 ATOM 14929 C29 POP 120 44.650 53.820 36.400 1.00 0.00 ATOM 14930 H91 POP 120 44.240 52.800 36.340 1.00 0.00 ATOM 14931 0C21 POP 120 44.270 54.500 37.490 1.00 0.00 ATOM 14932 1H10 POP 120 43.620 54.040 38.250 1.00 0.00 ATOM 14933 1C21 POP 120 44.600 55.960 37.620 1.00 0.00 ATOM 14934 H11R POP 120 43.720 56.530 37.970 1.00 0.00 ATOM 14935 H11S POP 120 44.800 56.370 36.610 1.00 0.00 ATOM 14936 2C21 POP 120 45.720 56.160 38.650 1.00 0.00 ATOM 14937 H12R POP 120 46.040 57.220 38.640 1.00 0.00 ATOM 14938 H12S POP 120 46.530 55.440 38.420 1.00 0.00 ATOM 14939 3C21 POP 120 45.260 55.600 40.000 1.00 0.00 ATOM 14940 H13R POP 120 45.170 54.500 39.850 1.00 0.00 ATOM 14941 H13S POP 120 44.310 56.080 40.320 1.00 0.00 ATOM 14942 4C21 POP 120 46.250 55.730 41.150 1.00 0.00 ATOM 14943 H14R POP 120 46.550 56.790 41.320 1.00 0.00 ATOM 14944 H14S POP 120 47.210 55.260 40.850 1.00 0.00 ATOM 14945 5C21 POP 120 45.870 55.050 42.470 1.00 0.00 ATOM 14946 H15R POP 120 46.560 55.340 43.300 1.00 0.00 ATOM 14947 H15S POP 120 46.250 54.000 42.390 1.00 0.00 ATOM 14948 6C21 POP 120 44.410 55.190 42.900 1.00 0.00 ATOM 14949 H16R POP 120 43.830 54.740 42.070 1.00 0.00 ATOM 14950 H16S POP 120 44.010 56.220 43.030 1.00 0.00 ATOM 14951 7C21 POP 120 44.060 54.310 44.100 1.00 0.00 ATOM 14952 H17R POP 120 44.900 54.290 44.820 1.00 0.00 ATOM 14953 H17S POP 120 44.080 53.270 43.710 1.00 0.00 ATOM 14954 8C21 POP 120 42.670 54.520 44.720 1.00 0.00 ATOM 14955 H18R POP 120 42.650 55.510 45.230 1.00 0.00 ATOM 14956 H18S POP 120 42.470 53.760 45.490 1.00 0.00 ATOM 14957 H18T POP 120 41.820 54.490 44.000 1.00 0.00 ATOM 14958 C33 POP 120 35.020 56.020 31.170 1.00 0.00 ATOM 14959 H3X POP 120 35.590 55.190 31.620 1.00 0.00 ATOM 14960 H3Y POP 120 34.330 55.640 30.390 1.00 0.00 ATOM 14961 C34 POP 120 34.200 56.670 32.280 1.00 0.00 ATOM 14962 H4X POP 120 33.560 55.960 32.850 1.00 0.00 ATOM 14963 H4Y POP 120 33.560 57.500 31.910 1.00 0.00 ATOM 14964 C35 POP 120 35.140 57.410 33.250 1.00 0.00 ATOM 14965 H5X POP 120 35.610 58.270 32.720 1.00 0.00 ATOM 14966 H5Y POP 120 35.980 56.810 33.660 1.00 0.00 ATOM 14967 C36 POP 120 34.530 58.020 34.510 1.00 0.00 ATOM 14968 H6X POP 120 33.860 57.220 34.900 1.00 0.00 ATOM 14969 H6Y POP 120 33.920 58.910 34.270 1.00 0.00 ATOM 14970 C37 POP 120 35.630 58.460 35.480 1.00 0.00 ATOM 14971 H7X POP 120 36.100 59.380 35.070 1.00 0.00 ATOM 14972 H7Y POP 120 36.480 57.750 35.580 1.00 0.00 ATOM 14973 C38 POP 120 35.120 59.060 36.790 1.00 0.00 ATOM 14974 H8X POP 120 34.530 58.490 37.530 1.00 0.00 ATOM 14975 H8Y POP 120 34.390 59.860 36.540 1.00 0.00 ATOM 14976 C39 POP 120 36.190 59.830 37.560 1.00 0.00 ATOM 14977 H9X POP 120 36.870 60.300 36.820 1.00 0.00 ATOM 14978 H9Y POP 120 36.750 59.140 38.230 1.00 0.00 ATOM 14979 0C31 POP 120 35.740 60.920 38.540 1.00 0.00 ATOM 14980 H10X POP 120 35.030 60.480 39.270 1.00 0.00 ATOM 14981 H10Y POP 120 35.180 61.660 37.940 1.00 0.00 ATOM 14982 1C31 POP 120 36.850 61.640 39.310 1.00 0.00 ATOM 14983 H11X POP 120 37.630 61.960 38.590 1.00 0.00 ATOM 14984 H11Y POP 120 37.370 60.890 39.950 1.00 0.00 ATOM 14985 2C31 POP 120 36.340 62.770 40.220 1.00 0.00 ATOM 14986 H12X POP 120 35.310 62.550 40.570 1.00 0.00 ATOM 14987 H12Y POP 120 36.230 63.680 39.590 1.00 0.00 ATOM 14988 3C31 POP 120 37.310 63.190 41.320 1.00 0.00 ATOM 14989 H13X POP 120 38.030 63.950 40.950 1.00 0.00 ATOM 14990 H13Y POP 120 37.790 62.230 41.600 1.00 0.00 ATOM 14991 4C31 POP 120 36.450 63.870 42.400 1.00 0.00 ATOM 14992 H14X POP 120 35.710 63.140 42.800 1.00 0.00 ATOM 14993 H14Y POP 120 36.000 64.770 41.930 1.00 0.00 ATOM 14994 5C31 POP 120 37.270 64.250 43.640 1.00 0.00 ATOM 14995 H15X POP 120 37.880 63.400 43.990 1.00 0.00 ATOM 14996 H15Y POP 120 36.580 64.570 44.450 1.00 0.00 ATOM 14997 6C31 POP 120 38.200 65.460 43.470 1.00 0.00 ATOM 14998 H16X POP 120 37.560 66.340 43.250 1.00 0.00 ATOM 14999 H16Y POP 120 38.930 65.310 42.650 1.00 0.00 ATOM 15000 H16Z POP 120 38.680 65.810 44.400 1.00 0.00 ATOM 15001 N POP 121 21.690 34.310 24.420 1.00 0.00 ATOM 15002 HN1 POP 121 21.860 33.310 24.680 1.00 0.00 ATOM 15003 HN2 POP 121 22.570 34.600 23.960 1.00 0.00 ATOM 15004 HN3 POP 121 21.650 34.960 25.230 1.00 0.00 ATOM 15005 C12 POP 121 20.680 34.450 23.310 1.00 0.00 ATOM 15006 H12A POP 121 19.660 34.550 23.730 1.00 0.00 ATOM 15007 H12B POP 121 20.740 33.610 22.590 1.00 0.00 ATOM 15008 C11 POP 121 21.010 35.810 22.690 1.00 0.00 ATOM 15009 H11A POP 121 20.130 36.130 22.100 1.00 0.00 ATOM 15010 H11B POP 121 21.850 35.510 22.030 1.00 0.00 ATOM 15011 P POP 121 21.540 38.230 22.990 1.00 0.00 ATOM 15012 O13 POP 121 22.550 38.150 21.910 1.00 0.00 ATOM 15013 O14 POP 121 20.150 38.610 22.650 1.00 0.00 ATOM 15014 O11 POP 121 22.100 39.230 24.100 1.00 0.00 ATOM 15015 O12 POP 121 21.480 36.770 23.650 1.00 0.00 ATOM 15016 C1 POP 121 23.420 39.070 24.630 1.00 0.00 ATOM 15017 HA POP 121 23.820 40.040 25.020 1.00 0.00 ATOM 15018 HB POP 121 24.080 38.660 23.850 1.00 0.00 ATOM 15019 C2 POP 121 23.440 38.010 25.750 1.00 0.00 ATOM 15020 HS POP 121 23.290 37.070 25.190 1.00 0.00 ATOM 15021 O21 POP 121 22.400 38.310 26.680 1.00 0.00 ATOM 15022 C21 POP 121 21.570 37.290 26.890 1.00 0.00 ATOM 15023 O22 POP 121 21.610 36.160 26.420 1.00 0.00 ATOM 15024 C22 POP 121 20.600 37.650 28.010 1.00 0.00 ATOM 15025 H2R POP 121 19.830 36.870 28.190 1.00 0.00 ATOM 15026 H2S POP 121 20.170 38.640 27.750 1.00 0.00 ATOM 15027 C3 POP 121 24.790 37.810 26.460 1.00 0.00 ATOM 15028 HX POP 121 25.190 38.720 26.960 1.00 0.00 ATOM 15029 HY POP 121 25.580 37.530 25.720 1.00 0.00 ATOM 15030 O31 POP 121 24.700 36.760 27.430 1.00 0.00 ATOM 15031 C31 POP 121 25.690 36.480 28.270 1.00 0.00 ATOM 15032 O32 POP 121 26.720 37.130 28.380 1.00 0.00 ATOM 15033 C32 POP 121 25.430 35.170 28.990 1.00 0.00 ATOM 15034 H2X POP 121 25.490 34.250 28.380 1.00 0.00 ATOM 15035 H2Y POP 121 24.480 35.250 29.570 1.00 0.00 ATOM 15036 C23 POP 121 21.430 38.100 29.220 1.00 0.00 ATOM 15037 H3R POP 121 20.920 38.980 29.670 1.00 0.00 ATOM 15038 H3S POP 121 22.460 38.390 28.920 1.00 0.00 ATOM 15039 C24 POP 121 21.440 37.010 30.290 1.00 0.00 ATOM 15040 H4R POP 121 22.260 36.260 30.200 1.00 0.00 ATOM 15041 H4S POP 121 20.490 36.460 30.450 1.00 0.00 ATOM 15042 C25 POP 121 21.770 37.690 31.620 1.00 0.00 ATOM 15043 H5R POP 121 21.040 38.500 31.860 1.00 0.00 ATOM 15044 H5S POP 121 22.800 38.110 31.580 1.00 0.00 ATOM 15045 C26 POP 121 21.590 36.690 32.760 1.00 0.00 ATOM 15046 H6R POP 121 21.960 37.190 33.680 1.00 0.00 ATOM 15047 H6S POP 121 22.380 35.910 32.660 1.00 0.00 ATOM 15048 C27 POP 121 20.150 36.220 32.970 1.00 0.00 ATOM 15049 H7R POP 121 19.910 35.370 32.290 1.00 0.00 ATOM 15050 H7S POP 121 19.470 37.050 32.680 1.00 0.00 ATOM 15051 C28 POP 121 20.070 35.770 34.430 1.00 0.00 ATOM 15052 H8R POP 121 20.000 36.630 35.130 1.00 0.00 ATOM 15053 H8S POP 121 20.920 35.090 34.620 1.00 0.00 ATOM 15054 C29 POP 121 18.770 35.010 34.370 1.00 0.00 ATOM 15055 H91 POP 121 18.850 34.220 33.610 1.00 0.00 ATOM 15056 0C21 POP 121 17.630 35.220 35.040 1.00 0.00 ATOM 15057 1H10 POP 121 16.750 34.570 34.940 1.00 0.00 ATOM 15058 1C21 POP 121 17.390 36.260 36.100 1.00 0.00 ATOM 15059 H11R POP 121 16.650 37.030 35.810 1.00 0.00 ATOM 15060 H11S POP 121 18.280 36.840 36.420 1.00 0.00 ATOM 15061 2C21 POP 121 16.780 35.680 37.390 1.00 0.00 ATOM 15062 H12R POP 121 17.570 35.030 37.820 1.00 0.00 ATOM 15063 H12S POP 121 15.880 35.040 37.240 1.00 0.00 ATOM 15064 3C21 POP 121 16.230 36.800 38.260 1.00 0.00 ATOM 15065 H13R POP 121 15.270 37.140 37.810 1.00 0.00 ATOM 15066 H13S POP 121 16.960 37.640 38.360 1.00 0.00 ATOM 15067 4C21 POP 121 15.810 36.230 39.620 1.00 0.00 ATOM 15068 H14R POP 121 16.480 35.400 39.940 1.00 0.00 ATOM 15069 H14S POP 121 14.780 35.810 39.550 1.00 0.00 ATOM 15070 5C21 POP 121 15.680 37.260 40.740 1.00 0.00 ATOM 15071 H15R POP 121 16.720 37.600 40.920 1.00 0.00 ATOM 15072 H15S POP 121 15.380 36.750 41.680 1.00 0.00 ATOM 15073 6C21 POP 121 14.810 38.480 40.440 1.00 0.00 ATOM 15074 H16R POP 121 13.830 38.040 40.150 1.00 0.00 ATOM 15075 H16S POP 121 15.180 38.970 39.520 1.00 0.00 ATOM 15076 7C21 POP 121 14.570 39.490 41.570 1.00 0.00 ATOM 15077 H17R POP 121 14.010 40.320 41.100 1.00 0.00 ATOM 15078 H17S POP 121 15.550 39.860 41.950 1.00 0.00 ATOM 15079 8C21 POP 121 13.710 38.970 42.720 1.00 0.00 ATOM 15080 H18R POP 121 12.740 38.610 42.310 1.00 0.00 ATOM 15081 H18S POP 121 14.200 38.140 43.270 1.00 0.00 ATOM 15082 H18T POP 121 13.590 39.770 43.480 1.00 0.00 ATOM 15083 C33 POP 121 26.440 34.920 30.110 1.00 0.00 ATOM 15084 H3X POP 121 26.630 35.790 30.780 1.00 0.00 ATOM 15085 H3Y POP 121 27.410 34.640 29.650 1.00 0.00 ATOM 15086 C34 POP 121 25.960 33.770 30.990 1.00 0.00 ATOM 15087 H4X POP 121 25.740 32.880 30.370 1.00 0.00 ATOM 15088 H4Y POP 121 24.970 34.180 31.250 1.00 0.00 ATOM 15089 C35 POP 121 26.940 33.450 32.130 1.00 0.00 ATOM 15090 H5X POP 121 27.780 32.850 31.700 1.00 0.00 ATOM 15091 H5Y POP 121 26.490 32.690 32.790 1.00 0.00 ATOM 15092 C36 POP 121 27.540 34.580 32.960 1.00 0.00 ATOM 15093 H6X POP 121 26.700 35.240 33.290 1.00 0.00 ATOM 15094 H6Y POP 121 28.220 35.140 32.290 1.00 0.00 ATOM 15095 C37 POP 121 28.280 34.010 34.170 1.00 0.00 ATOM 15096 H7X POP 121 29.300 33.720 33.860 1.00 0.00 ATOM 15097 H7Y POP 121 27.780 33.110 34.590 1.00 0.00 ATOM 15098 C38 POP 121 28.480 35.010 35.320 1.00 0.00 ATOM 15099 H8X POP 121 27.500 35.310 35.740 1.00 0.00 ATOM 15100 H8Y POP 121 28.920 35.910 34.850 1.00 0.00 ATOM 15101 C39 POP 121 29.400 34.560 36.460 1.00 0.00 ATOM 15102 H9X POP 121 30.350 34.290 35.950 1.00 0.00 ATOM 15103 H9Y POP 121 29.080 33.570 36.840 1.00 0.00 ATOM 15104 0C31 POP 121 29.710 35.720 37.400 1.00 0.00 ATOM 15105 H10X POP 121 28.770 36.080 37.870 1.00 0.00 ATOM 15106 H10Y POP 121 30.130 36.620 36.890 1.00 0.00 ATOM 15107 1C31 POP 121 30.500 35.510 38.690 1.00 0.00 ATOM 15108 H11X POP 121 31.520 35.110 38.520 1.00 0.00 ATOM 15109 H11Y POP 121 29.840 34.860 39.310 1.00 0.00 ATOM 15110 2C31 POP 121 30.650 36.870 39.370 1.00 0.00 ATOM 15111 H12X POP 121 29.740 37.060 39.980 1.00 0.00 ATOM 15112 H12Y POP 121 30.680 37.650 38.590 1.00 0.00 ATOM 15113 3C31 POP 121 31.920 36.920 40.230 1.00 0.00 ATOM 15114 H13X POP 121 31.710 37.760 40.930 1.00 0.00 ATOM 15115 H13Y POP 121 32.860 37.170 39.680 1.00 0.00 ATOM 15116 4C31 POP 121 32.070 35.720 41.170 1.00 0.00 ATOM 15117 H14X POP 121 32.480 34.930 40.510 1.00 0.00 ATOM 15118 H14Y POP 121 31.140 35.430 41.710 1.00 0.00 ATOM 15119 5C31 POP 121 33.200 36.010 42.160 1.00 0.00 ATOM 15120 H15X POP 121 33.050 37.010 42.620 1.00 0.00 ATOM 15121 H15Y POP 121 34.140 36.140 41.590 1.00 0.00 ATOM 15122 6C31 POP 121 33.390 34.970 43.260 1.00 0.00 ATOM 15123 H16X POP 121 33.400 33.890 42.980 1.00 0.00 ATOM 15124 H16Y POP 121 32.600 35.200 44.010 1.00 0.00 ATOM 15125 H16Z POP 121 34.410 35.170 43.650 1.00 0.00 ATOM 15126 N POP 122 27.150 54.010 20.560 1.00 0.00 ATOM 15127 HN1 POP 122 26.270 54.330 20.100 1.00 0.00 ATOM 15128 HN2 POP 122 27.940 54.260 19.930 1.00 0.00 ATOM 15129 HN3 POP 122 27.120 53.020 20.870 1.00 0.00 ATOM 15130 C12 POP 122 27.230 55.010 21.690 1.00 0.00 ATOM 15131 H12A POP 122 26.380 54.750 22.360 1.00 0.00 ATOM 15132 H12B POP 122 27.270 56.050 21.290 1.00 0.00 ATOM 15133 C11 POP 122 28.550 54.860 22.440 1.00 0.00 ATOM 15134 H11A POP 122 28.590 55.520 23.340 1.00 0.00 ATOM 15135 H11B POP 122 29.420 55.150 21.810 1.00 0.00 ATOM 15136 P POP 122 29.490 53.230 24.200 1.00 0.00 ATOM 15137 O13 POP 122 30.510 54.280 24.360 1.00 0.00 ATOM 15138 O14 POP 122 30.020 51.840 24.270 1.00 0.00 ATOM 15139 O11 POP 122 28.480 53.500 25.410 1.00 0.00 ATOM 15140 O12 POP 122 28.640 53.510 22.880 1.00 0.00 ATOM 15141 C1 POP 122 28.930 52.990 26.660 1.00 0.00 ATOM 15142 HA POP 122 28.470 53.610 27.460 1.00 0.00 ATOM 15143 HB POP 122 30.030 53.120 26.740 1.00 0.00 ATOM 15144 C2 POP 122 28.420 51.600 27.090 1.00 0.00 ATOM 15145 HS POP 122 28.680 50.850 26.310 1.00 0.00 ATOM 15146 O21 POP 122 27.000 51.720 27.230 1.00 0.00 ATOM 15147 C21 POP 122 26.350 51.210 26.180 1.00 0.00 ATOM 15148 O22 POP 122 26.810 50.650 25.200 1.00 0.00 ATOM 15149 C22 POP 122 24.870 51.560 26.270 1.00 0.00 ATOM 15150 H2R POP 122 24.220 50.850 25.700 1.00 0.00 ATOM 15151 H2S POP 122 24.820 52.520 25.720 1.00 0.00 ATOM 15152 C3 POP 122 29.010 51.030 28.380 1.00 0.00 ATOM 15153 HX POP 122 30.120 50.900 28.350 1.00 0.00 ATOM 15154 HY POP 122 28.670 49.970 28.460 1.00 0.00 ATOM 15155 O31 POP 122 28.560 51.640 29.600 1.00 0.00 ATOM 15156 C31 POP 122 27.460 51.170 30.190 1.00 0.00 ATOM 15157 O32 POP 122 26.940 50.110 29.890 1.00 0.00 ATOM 15158 C32 POP 122 27.000 52.150 31.260 1.00 0.00 ATOM 15159 H2X POP 122 25.900 52.210 31.160 1.00 0.00 ATOM 15160 H2Y POP 122 27.370 53.190 31.140 1.00 0.00 ATOM 15161 C23 POP 122 24.420 51.560 27.740 1.00 0.00 ATOM 15162 H3R POP 122 24.870 52.240 28.490 1.00 0.00 ATOM 15163 H3S POP 122 24.560 50.560 28.190 1.00 0.00 ATOM 15164 C24 POP 122 22.910 51.780 27.730 1.00 0.00 ATOM 15165 H4R POP 122 22.440 51.000 27.090 1.00 0.00 ATOM 15166 H4S POP 122 22.680 52.710 27.160 1.00 0.00 ATOM 15167 C25 POP 122 22.420 51.860 29.180 1.00 0.00 ATOM 15168 H5R POP 122 21.310 51.860 29.190 1.00 0.00 ATOM 15169 H5S POP 122 22.660 52.770 29.770 1.00 0.00 ATOM 15170 C26 POP 122 22.750 50.710 30.140 1.00 0.00 ATOM 15171 H6R POP 122 23.840 50.640 30.370 1.00 0.00 ATOM 15172 H6S POP 122 22.410 49.820 29.580 1.00 0.00 ATOM 15173 C27 POP 122 21.920 50.780 31.420 1.00 0.00 ATOM 15174 H7R POP 122 20.880 51.050 31.170 1.00 0.00 ATOM 15175 H7S POP 122 22.220 51.710 31.950 1.00 0.00 ATOM 15176 C28 POP 122 21.980 49.550 32.330 1.00 0.00 ATOM 15177 H8R POP 122 21.730 48.630 31.750 1.00 0.00 ATOM 15178 H8S POP 122 21.160 49.680 33.070 1.00 0.00 ATOM 15179 C29 POP 122 23.340 49.240 32.890 1.00 0.00 ATOM 15180 H91 POP 122 24.240 49.330 32.270 1.00 0.00 ATOM 15181 0C21 POP 122 23.460 48.800 34.150 1.00 0.00 ATOM 15182 1H10 POP 122 24.420 48.550 34.630 1.00 0.00 ATOM 15183 1C21 POP 122 22.440 48.350 35.150 1.00 0.00 ATOM 15184 H11R POP 122 22.220 47.300 34.830 1.00 0.00 ATOM 15185 H11S POP 122 21.530 48.990 35.200 1.00 0.00 ATOM 15186 2C21 POP 122 22.830 48.110 36.610 1.00 0.00 ATOM 15187 H12R POP 122 23.880 47.750 36.600 1.00 0.00 ATOM 15188 H12S POP 122 22.240 47.290 37.080 1.00 0.00 ATOM 15189 3C21 POP 122 22.740 49.380 37.440 1.00 0.00 ATOM 15190 H13R POP 122 21.780 49.840 37.130 1.00 0.00 ATOM 15191 H13S POP 122 23.590 50.060 37.200 1.00 0.00 ATOM 15192 4C21 POP 122 22.800 49.020 38.930 1.00 0.00 ATOM 15193 H14R POP 122 23.880 48.790 39.070 1.00 0.00 ATOM 15194 H14S POP 122 22.160 48.110 38.970 1.00 0.00 ATOM 15195 5C21 POP 122 22.240 50.030 39.930 1.00 0.00 ATOM 15196 H15R POP 122 21.140 49.850 39.920 1.00 0.00 ATOM 15197 H15S POP 122 22.460 51.090 39.680 1.00 0.00 ATOM 15198 6C21 POP 122 22.810 49.750 41.320 1.00 0.00 ATOM 15199 H16R POP 122 23.890 50.000 41.260 1.00 0.00 ATOM 15200 H16S POP 122 22.720 48.660 41.500 1.00 0.00 ATOM 15201 7C21 POP 122 22.200 50.560 42.470 1.00 0.00 ATOM 15202 H17R POP 122 21.110 50.550 42.240 1.00 0.00 ATOM 15203 H17S POP 122 22.630 51.590 42.490 1.00 0.00 ATOM 15204 8C21 POP 122 22.640 49.750 43.680 1.00 0.00 ATOM 15205 H18R POP 122 22.060 48.800 43.690 1.00 0.00 ATOM 15206 H18S POP 122 22.410 50.260 44.640 1.00 0.00 ATOM 15207 H18T POP 122 23.720 49.480 43.720 1.00 0.00 ATOM 15208 C33 POP 122 27.200 51.520 32.640 1.00 0.00 ATOM 15209 H3X POP 122 28.210 51.170 32.930 1.00 0.00 ATOM 15210 H3Y POP 122 26.560 50.610 32.530 1.00 0.00 ATOM 15211 C34 POP 122 26.470 52.300 33.740 1.00 0.00 ATOM 15212 H4X POP 122 25.660 52.910 33.280 1.00 0.00 ATOM 15213 H4Y POP 122 27.220 53.070 34.050 1.00 0.00 ATOM 15214 C35 POP 122 25.910 51.480 34.900 1.00 0.00 ATOM 15215 H5X POP 122 26.740 50.810 35.200 1.00 0.00 ATOM 15216 H5Y POP 122 25.060 50.840 34.570 1.00 0.00 ATOM 15217 C36 POP 122 25.510 52.230 36.170 1.00 0.00 ATOM 15218 H6X POP 122 25.160 51.500 36.930 1.00 0.00 ATOM 15219 H6Y POP 122 24.570 52.800 36.000 1.00 0.00 ATOM 15220 C37 POP 122 26.690 53.030 36.730 1.00 0.00 ATOM 15221 H7X POP 122 26.990 53.950 36.180 1.00 0.00 ATOM 15222 H7Y POP 122 27.420 52.200 36.820 1.00 0.00 ATOM 15223 C38 POP 122 26.450 53.530 38.160 1.00 0.00 ATOM 15224 H8X POP 122 25.560 54.180 38.210 1.00 0.00 ATOM 15225 H8Y POP 122 27.320 54.170 38.440 1.00 0.00 ATOM 15226 C39 POP 122 26.480 52.370 39.160 1.00 0.00 ATOM 15227 H9X POP 122 27.410 51.780 39.300 1.00 0.00 ATOM 15228 H9Y POP 122 25.640 51.670 38.960 1.00 0.00 ATOM 15229 0C31 POP 122 26.130 53.000 40.510 1.00 0.00 ATOM 15230 H10X POP 122 26.050 52.290 41.360 1.00 0.00 ATOM 15231 H10Y POP 122 25.180 53.570 40.470 1.00 0.00 ATOM 15232 1C31 POP 122 27.100 53.980 41.180 1.00 0.00 ATOM 15233 H11X POP 122 26.990 54.860 40.510 1.00 0.00 ATOM 15234 H11Y POP 122 28.150 53.630 41.170 1.00 0.00 ATOM 15235 2C31 POP 122 26.670 54.320 42.610 1.00 0.00 ATOM 15236 H12X POP 122 26.560 53.290 43.000 1.00 0.00 ATOM 15237 H12Y POP 122 25.650 54.760 42.700 1.00 0.00 ATOM 15238 3C31 POP 122 27.720 55.140 43.370 1.00 0.00 ATOM 15239 H13X POP 122 27.930 56.210 43.150 1.00 0.00 ATOM 15240 H13Y POP 122 28.670 54.550 43.320 1.00 0.00 ATOM 15241 4C31 POP 122 27.380 55.050 44.850 1.00 0.00 ATOM 15242 H14X POP 122 27.060 54.010 45.090 1.00 0.00 ATOM 15243 H14Y POP 122 26.420 55.610 44.860 1.00 0.00 ATOM 15244 5C31 POP 122 28.320 55.620 45.910 1.00 0.00 ATOM 15245 H15X POP 122 28.810 56.550 45.550 1.00 0.00 ATOM 15246 H15Y POP 122 29.100 54.850 46.050 1.00 0.00 ATOM 15247 6C31 POP 122 27.750 55.880 47.310 1.00 0.00 ATOM 15248 H16X POP 122 26.970 56.670 47.260 1.00 0.00 ATOM 15249 H16Y POP 122 28.580 56.180 47.980 1.00 0.00 ATOM 15250 H16Z POP 122 27.230 55.020 47.780 1.00 0.00 ATOM 15251 N POP 123 9.390 20.040 21.780 1.00 0.00 ATOM 15252 HN1 POP 123 9.560 20.520 20.870 1.00 0.00 ATOM 15253 HN2 POP 123 10.220 19.830 22.370 1.00 0.00 ATOM 15254 HN3 POP 123 8.770 19.230 21.600 1.00 0.00 ATOM 15255 C12 POP 123 8.770 21.080 22.670 1.00 0.00 ATOM 15256 H12A POP 123 8.120 21.770 22.090 1.00 0.00 ATOM 15257 H12B POP 123 9.610 21.690 23.070 1.00 0.00 ATOM 15258 C11 POP 123 8.070 20.450 23.870 1.00 0.00 ATOM 15259 H11A POP 123 7.930 21.260 24.610 1.00 0.00 ATOM 15260 H11B POP 123 8.750 19.800 24.470 1.00 0.00 ATOM 15261 P POP 123 5.560 20.340 24.020 1.00 0.00 ATOM 15262 O13 POP 123 4.530 19.300 23.880 1.00 0.00 ATOM 15263 O14 POP 123 5.390 21.700 23.450 1.00 0.00 ATOM 15264 O11 POP 123 5.820 20.630 25.570 1.00 0.00 ATOM 15265 O12 POP 123 6.920 19.710 23.450 1.00 0.00 ATOM 15266 C1 POP 123 6.110 19.490 26.390 1.00 0.00 ATOM 15267 HA POP 123 6.840 19.790 27.170 1.00 0.00 ATOM 15268 HB POP 123 6.640 18.660 25.860 1.00 0.00 ATOM 15269 C2 POP 123 4.850 18.890 27.030 1.00 0.00 ATOM 15270 HS POP 123 4.170 18.520 26.240 1.00 0.00 ATOM 15271 O21 POP 123 4.000 19.900 27.590 1.00 0.00 ATOM 15272 C21 POP 123 4.480 20.550 28.650 1.00 0.00 ATOM 15273 O22 POP 123 5.360 20.140 29.390 1.00 0.00 ATOM 15274 C22 POP 123 3.630 21.800 28.800 1.00 0.00 ATOM 15275 H2R POP 123 2.730 21.680 28.160 1.00 0.00 ATOM 15276 H2S POP 123 4.100 22.710 28.360 1.00 0.00 ATOM 15277 C3 POP 123 5.050 17.740 28.030 1.00 0.00 ATOM 15278 HX POP 123 6.030 17.910 28.530 1.00 0.00 ATOM 15279 HY POP 123 5.080 16.890 27.310 1.00 0.00 ATOM 15280 O31 POP 123 4.030 17.500 29.000 1.00 0.00 ATOM 15281 C31 POP 123 2.860 17.030 28.580 1.00 0.00 ATOM 15282 O32 POP 123 2.560 16.660 27.450 1.00 0.00 ATOM 15283 C32 POP 123 1.970 16.960 29.810 1.00 0.00 ATOM 15284 H2X POP 123 0.920 16.780 29.480 1.00 0.00 ATOM 15285 H2Y POP 123 1.970 17.990 30.230 1.00 0.00 ATOM 15286 C23 POP 123 3.340 22.090 30.270 1.00 0.00 ATOM 15287 H3R POP 123 2.810 23.060 30.280 1.00 0.00 ATOM 15288 H3S POP 123 4.280 22.330 30.820 1.00 0.00 ATOM 15289 C24 POP 123 2.370 21.090 30.910 1.00 0.00 ATOM 15290 H4R POP 123 2.810 20.070 30.870 1.00 0.00 ATOM 15291 H4S POP 123 1.410 20.990 30.360 1.00 0.00 ATOM 15292 C25 POP 123 1.890 21.440 32.320 1.00 0.00 ATOM 15293 H5R POP 123 1.150 20.710 32.710 1.00 0.00 ATOM 15294 H5S POP 123 1.310 22.380 32.260 1.00 0.00 ATOM 15295 C26 POP 123 3.020 21.610 33.340 1.00 0.00 ATOM 15296 H6R POP 123 4.000 21.770 32.850 1.00 0.00 ATOM 15297 H6S POP 123 2.970 20.630 33.870 1.00 0.00 ATOM 15298 C27 POP 123 2.900 22.800 34.300 1.00 0.00 ATOM 15299 H7R POP 123 2.680 23.670 33.650 1.00 0.00 ATOM 15300 H7S POP 123 3.930 23.040 34.650 1.00 0.00 ATOM 15301 C28 POP 123 1.780 22.780 35.340 1.00 0.00 ATOM 15302 H8R POP 123 1.750 21.730 35.710 1.00 0.00 ATOM 15303 H8S POP 123 0.780 23.070 34.970 1.00 0.00 ATOM 15304 C29 POP 123 2.180 23.620 36.520 1.00 0.00 ATOM 15305 H91 POP 123 2.130 24.720 36.520 1.00 0.00 ATOM 15306 0C21 POP 123 2.760 23.100 37.610 1.00 0.00 ATOM 15307 1H10 POP 123 3.100 23.750 38.420 1.00 0.00 ATOM 15308 1C21 POP 123 2.830 21.620 37.860 1.00 0.00 ATOM 15309 H11R POP 123 3.310 21.150 36.980 1.00 0.00 ATOM 15310 H11S POP 123 1.870 21.080 37.950 1.00 0.00 ATOM 15311 2C21 POP 123 3.640 21.310 39.130 1.00 0.00 ATOM 15312 H12R POP 123 3.180 21.850 39.980 1.00 0.00 ATOM 15313 H12S POP 123 4.720 21.540 39.120 1.00 0.00 ATOM 15314 3C21 POP 123 3.610 19.800 39.370 1.00 0.00 ATOM 15315 H13R POP 123 4.100 19.150 38.620 1.00 0.00 ATOM 15316 H13S POP 123 2.540 19.470 39.420 1.00 0.00 ATOM 15317 4C21 POP 123 4.190 19.400 40.730 1.00 0.00 ATOM 15318 H14R POP 123 3.960 20.220 41.450 1.00 0.00 ATOM 15319 H14S POP 123 5.300 19.380 40.640 1.00 0.00 ATOM 15320 5C21 POP 123 3.740 18.070 41.320 1.00 0.00 ATOM 15321 H15R POP 123 2.660 17.880 41.120 1.00 0.00 ATOM 15322 H15S POP 123 3.990 18.080 42.400 1.00 0.00 ATOM 15323 6C21 POP 123 4.720 16.970 40.900 1.00 0.00 ATOM 15324 H16R POP 123 5.720 17.350 41.190 1.00 0.00 ATOM 15325 H16S POP 123 4.660 16.890 39.800 1.00 0.00 ATOM 15326 7C21 POP 123 4.340 15.700 41.670 1.00 0.00 ATOM 15327 H17R POP 123 4.030 15.940 42.710 1.00 0.00 ATOM 15328 H17S POP 123 5.250 15.070 41.710 1.00 0.00 ATOM 15329 8C21 POP 123 3.220 14.860 41.050 1.00 0.00 ATOM 15330 H18R POP 123 2.360 15.530 40.810 1.00 0.00 ATOM 15331 H18S POP 123 2.840 14.040 41.700 1.00 0.00 ATOM 15332 H18T POP 123 3.580 14.380 40.120 1.00 0.00 ATOM 15333 C33 POP 123 2.540 15.890 30.740 1.00 0.00 ATOM 15334 H3X POP 123 2.980 15.070 30.130 1.00 0.00 ATOM 15335 H3Y POP 123 1.610 15.440 31.160 1.00 0.00 ATOM 15336 C34 POP 123 3.480 16.510 31.770 1.00 0.00 ATOM 15337 H4X POP 123 3.020 17.360 32.320 1.00 0.00 ATOM 15338 H4Y POP 123 4.420 16.860 31.290 1.00 0.00 ATOM 15339 C35 POP 123 3.970 15.540 32.850 1.00 0.00 ATOM 15340 H5X POP 123 4.350 14.590 32.430 1.00 0.00 ATOM 15341 H5Y POP 123 3.190 15.180 33.560 1.00 0.00 ATOM 15342 C36 POP 123 5.190 16.060 33.610 1.00 0.00 ATOM 15343 H6X POP 123 5.910 16.480 32.880 1.00 0.00 ATOM 15344 H6Y POP 123 5.740 15.300 34.210 1.00 0.00 ATOM 15345 C37 POP 123 4.780 17.210 34.530 1.00 0.00 ATOM 15346 H7X POP 123 3.910 16.920 35.160 1.00 0.00 ATOM 15347 H7Y POP 123 4.490 18.080 33.910 1.00 0.00 ATOM 15348 C38 POP 123 6.040 17.610 35.310 1.00 0.00 ATOM 15349 H8X POP 123 6.880 17.980 34.700 1.00 0.00 ATOM 15350 H8Y POP 123 6.340 16.700 35.890 1.00 0.00 ATOM 15351 C39 POP 123 5.830 18.780 36.270 1.00 0.00 ATOM 15352 H9X POP 123 4.730 18.870 36.410 1.00 0.00 ATOM 15353 H9Y POP 123 6.050 19.810 35.910 1.00 0.00 ATOM 15354 0C31 POP 123 6.480 18.540 37.630 1.00 0.00 ATOM 15355 H10X POP 123 5.970 17.730 38.180 1.00 0.00 ATOM 15356 H10Y POP 123 6.380 19.390 38.340 1.00 0.00 ATOM 15357 1C31 POP 123 7.960 18.140 37.550 1.00 0.00 ATOM 15358 H11X POP 123 8.520 19.050 37.250 1.00 0.00 ATOM 15359 H11Y POP 123 7.970 17.340 36.780 1.00 0.00 ATOM 15360 2C31 POP 123 8.470 17.470 38.820 1.00 0.00 ATOM 15361 H12X POP 123 9.380 16.870 38.590 1.00 0.00 ATOM 15362 H12Y POP 123 7.760 16.790 39.350 1.00 0.00 ATOM 15363 3C31 POP 123 8.880 18.560 39.810 1.00 0.00 ATOM 15364 H13X POP 123 8.000 19.230 39.900 1.00 0.00 ATOM 15365 H13Y POP 123 9.640 19.190 39.300 1.00 0.00 ATOM 15366 4C31 POP 123 9.420 17.900 41.080 1.00 0.00 ATOM 15367 H14X POP 123 10.050 17.030 40.820 1.00 0.00 ATOM 15368 H14Y POP 123 8.620 17.520 41.750 1.00 0.00 ATOM 15369 5C31 POP 123 10.290 18.760 42.000 1.00 0.00 ATOM 15370 H15X POP 123 11.300 18.910 41.550 1.00 0.00 ATOM 15371 H15Y POP 123 10.280 18.350 43.040 1.00 0.00 ATOM 15372 6C31 POP 123 9.780 20.200 42.050 1.00 0.00 ATOM 15373 H16X POP 123 10.420 20.800 42.720 1.00 0.00 ATOM 15374 H16Y POP 123 8.750 20.110 42.460 1.00 0.00 ATOM 15375 H16Z POP 123 9.690 20.730 41.070 1.00 0.00 ATOM 15376 N POP 124 38.080 5.340 19.340 1.00 0.00 ATOM 15377 HN1 POP 124 38.900 5.960 19.490 1.00 0.00 ATOM 15378 HN2 POP 124 38.160 4.300 19.390 1.00 0.00 ATOM 15379 HN3 POP 124 37.750 5.550 18.380 1.00 0.00 ATOM 15380 C12 POP 124 36.920 5.660 20.260 1.00 0.00 ATOM 15381 H12A POP 124 36.850 6.750 20.450 1.00 0.00 ATOM 15382 H12B POP 124 37.260 5.200 21.210 1.00 0.00 ATOM 15383 C11 POP 124 35.590 5.160 19.700 1.00 0.00 ATOM 15384 H11A POP 124 35.390 5.720 18.770 1.00 0.00 ATOM 15385 H11B POP 124 34.720 5.260 20.380 1.00 0.00 ATOM 15386 P POP 124 34.430 3.060 18.900 1.00 0.00 ATOM 15387 O13 POP 124 34.700 1.900 18.010 1.00 0.00 ATOM 15388 O14 POP 124 33.450 4.080 18.480 1.00 0.00 ATOM 15389 O11 POP 124 33.940 2.480 20.310 1.00 0.00 ATOM 15390 O12 POP 124 35.800 3.810 19.280 1.00 0.00 ATOM 15391 C1 POP 124 34.910 1.810 21.110 1.00 0.00 ATOM 15392 HA POP 124 35.910 1.670 20.660 1.00 0.00 ATOM 15393 HB POP 124 34.620 0.740 21.120 1.00 0.00 ATOM 15394 C2 POP 124 34.930 2.340 22.550 1.00 0.00 ATOM 15395 HS POP 124 35.120 1.520 23.270 1.00 0.00 ATOM 15396 O21 POP 124 33.690 3.020 22.760 1.00 0.00 ATOM 15397 C21 POP 124 32.800 2.240 23.380 1.00 0.00 ATOM 15398 O22 POP 124 32.970 1.130 23.850 1.00 0.00 ATOM 15399 C22 POP 124 31.440 2.930 23.320 1.00 0.00 ATOM 15400 H2R POP 124 30.580 2.240 23.190 1.00 0.00 ATOM 15401 H2S POP 124 31.470 3.730 22.550 1.00 0.00 ATOM 15402 C3 POP 124 36.050 3.390 22.710 1.00 0.00 ATOM 15403 HX POP 124 35.730 4.230 22.060 1.00 0.00 ATOM 15404 HY POP 124 37.070 3.020 22.490 1.00 0.00 ATOM 15405 O31 POP 124 36.000 3.720 24.100 1.00 0.00 ATOM 15406 C31 POP 124 35.520 4.920 24.440 1.00 0.00 ATOM 15407 O32 POP 124 35.290 5.810 23.650 1.00 0.00 ATOM 15408 C32 POP 124 35.300 4.970 25.950 1.00 0.00 ATOM 15409 H2X POP 124 36.090 4.390 26.460 1.00 0.00 ATOM 15410 H2Y POP 124 34.360 4.480 26.270 1.00 0.00 ATOM 15411 C23 POP 124 31.110 3.580 24.660 1.00 0.00 ATOM 15412 H3R POP 124 30.640 4.580 24.570 1.00 0.00 ATOM 15413 H3S POP 124 32.030 3.760 25.260 1.00 0.00 ATOM 15414 C24 POP 124 30.210 2.830 25.650 1.00 0.00 ATOM 15415 H4R POP 124 30.530 1.880 26.130 1.00 0.00 ATOM 15416 H4S POP 124 29.290 2.650 25.050 1.00 0.00 ATOM 15417 C25 POP 124 29.800 3.820 26.740 1.00 0.00 ATOM 15418 H5R POP 124 29.270 4.720 26.350 1.00 0.00 ATOM 15419 H5S POP 124 30.730 4.160 27.230 1.00 0.00 ATOM 15420 C26 POP 124 28.830 3.190 27.750 1.00 0.00 ATOM 15421 H6R POP 124 29.420 2.470 28.360 1.00 0.00 ATOM 15422 H6S POP 124 28.010 2.740 27.150 1.00 0.00 ATOM 15423 C27 POP 124 28.190 4.180 28.720 1.00 0.00 ATOM 15424 H7R POP 124 28.090 5.120 28.120 1.00 0.00 ATOM 15425 H7S POP 124 28.840 4.520 29.550 1.00 0.00 ATOM 15426 C28 POP 124 26.850 3.600 29.170 1.00 0.00 ATOM 15427 H8R POP 124 26.980 2.500 29.140 1.00 0.00 ATOM 15428 H8S POP 124 26.080 3.890 28.430 1.00 0.00 ATOM 15429 C29 POP 124 26.640 4.150 30.560 1.00 0.00 ATOM 15430 H91 POP 124 26.350 5.210 30.570 1.00 0.00 ATOM 15431 0C21 POP 124 26.990 3.510 31.680 1.00 0.00 ATOM 15432 1H10 POP 124 26.830 4.020 32.640 1.00 0.00 ATOM 15433 1C21 POP 124 27.390 2.070 31.810 1.00 0.00 ATOM 15434 H11R POP 124 28.250 2.060 32.520 1.00 0.00 ATOM 15435 H11S POP 124 27.850 1.710 30.870 1.00 0.00 ATOM 15436 2C21 POP 124 26.320 1.130 32.380 1.00 0.00 ATOM 15437 H12R POP 124 26.760 0.150 32.620 1.00 0.00 ATOM 15438 H12S POP 124 25.640 0.960 31.520 1.00 0.00 ATOM 15439 3C21 POP 124 25.510 1.640 33.580 1.00 0.00 ATOM 15440 H13R POP 124 24.880 2.540 33.480 1.00 0.00 ATOM 15441 H13S POP 124 26.300 1.960 34.290 1.00 0.00 ATOM 15442 4C21 POP 124 24.520 0.610 34.120 1.00 0.00 ATOM 15443 H14R POP 124 24.030 0.020 33.310 1.00 0.00 ATOM 15444 H14S POP 124 23.740 1.150 34.710 1.00 0.00 ATOM 15445 5C21 POP 124 25.300 -0.300 35.070 1.00 0.00 ATOM 15446 H15R POP 124 25.990 -1.010 34.570 1.00 0.00 ATOM 15447 H15S POP 124 24.520 -1.030 35.390 1.00 0.00 ATOM 15448 6C21 POP 124 25.890 0.300 36.340 1.00 0.00 ATOM 15449 H16R POP 124 25.140 0.990 36.790 1.00 0.00 ATOM 15450 H16S POP 124 26.740 0.970 36.060 1.00 0.00 ATOM 15451 7C21 POP 124 26.160 -0.710 37.450 1.00 0.00 ATOM 15452 H17R POP 124 25.250 -1.350 37.450 1.00 0.00 ATOM 15453 H17S POP 124 26.110 -0.130 38.400 1.00 0.00 ATOM 15454 8C21 POP 124 27.510 -1.420 37.370 1.00 0.00 ATOM 15455 H18R POP 124 27.510 -2.290 38.060 1.00 0.00 ATOM 15456 H18S POP 124 28.320 -0.680 37.610 1.00 0.00 ATOM 15457 H18T POP 124 27.590 -1.750 36.310 1.00 0.00 ATOM 15458 C33 POP 124 35.240 6.480 26.210 1.00 0.00 ATOM 15459 H3X POP 124 34.370 6.950 25.690 1.00 0.00 ATOM 15460 H3Y POP 124 36.180 6.990 25.900 1.00 0.00 ATOM 15461 C34 POP 124 35.200 6.850 27.690 1.00 0.00 ATOM 15462 H4X POP 124 35.150 7.940 27.870 1.00 0.00 ATOM 15463 H4Y POP 124 36.080 6.490 28.260 1.00 0.00 ATOM 15464 C35 POP 124 33.960 6.280 28.390 1.00 0.00 ATOM 15465 H5X POP 124 33.860 5.180 28.240 1.00 0.00 ATOM 15466 H5Y POP 124 33.020 6.620 27.890 1.00 0.00 ATOM 15467 C36 POP 124 33.930 6.610 29.880 1.00 0.00 ATOM 15468 H6X POP 124 34.040 7.710 30.010 1.00 0.00 ATOM 15469 H6Y POP 124 34.800 6.130 30.380 1.00 0.00 ATOM 15470 C37 POP 124 32.550 6.290 30.470 1.00 0.00 ATOM 15471 H7X POP 124 32.820 6.130 31.540 1.00 0.00 ATOM 15472 H7Y POP 124 32.100 5.410 29.980 1.00 0.00 ATOM 15473 C38 POP 124 31.480 7.390 30.540 1.00 0.00 ATOM 15474 H8X POP 124 31.410 7.820 29.530 1.00 0.00 ATOM 15475 H8Y POP 124 31.850 8.260 31.130 1.00 0.00 ATOM 15476 C39 POP 124 30.130 6.990 31.140 1.00 0.00 ATOM 15477 H9X POP 124 29.510 6.460 30.390 1.00 0.00 ATOM 15478 H9Y POP 124 29.520 7.910 31.310 1.00 0.00 ATOM 15479 0C31 POP 124 30.210 6.140 32.400 1.00 0.00 ATOM 15480 H10X POP 124 30.810 5.240 32.160 1.00 0.00 ATOM 15481 H10Y POP 124 29.220 5.800 32.790 1.00 0.00 ATOM 15482 1C31 POP 124 30.890 6.930 33.530 1.00 0.00 ATOM 15483 H11X POP 124 30.350 7.900 33.610 1.00 0.00 ATOM 15484 H11Y POP 124 31.990 6.960 33.410 1.00 0.00 ATOM 15485 2C31 POP 124 30.690 6.350 34.930 1.00 0.00 ATOM 15486 H12X POP 124 29.630 6.520 35.210 1.00 0.00 ATOM 15487 H12Y POP 124 31.330 6.780 35.740 1.00 0.00 ATOM 15488 3C31 POP 124 31.020 4.860 34.980 1.00 0.00 ATOM 15489 H13X POP 124 31.970 4.690 34.440 1.00 0.00 ATOM 15490 H13Y POP 124 30.290 4.200 34.450 1.00 0.00 ATOM 15491 4C31 POP 124 31.130 4.300 36.400 1.00 0.00 ATOM 15492 H14X POP 124 30.130 4.340 36.880 1.00 0.00 ATOM 15493 H14Y POP 124 31.800 4.850 37.090 1.00 0.00 ATOM 15494 5C31 POP 124 31.590 2.850 36.230 1.00 0.00 ATOM 15495 H15X POP 124 32.560 2.790 35.700 1.00 0.00 ATOM 15496 H15Y POP 124 30.850 2.380 35.540 1.00 0.00 ATOM 15497 6C31 POP 124 31.610 2.010 37.510 1.00 0.00 ATOM 15498 H16X POP 124 32.540 2.170 38.080 1.00 0.00 ATOM 15499 H16Y POP 124 31.540 0.930 37.230 1.00 0.00 ATOM 15500 H16Z POP 124 30.700 2.410 38.010 1.00 0.00 ATOM 15501 N POP 125 19.120 40.100 20.660 1.00 0.00 ATOM 15502 HN1 POP 125 18.700 39.460 19.960 1.00 0.00 ATOM 15503 HN2 POP 125 19.660 39.520 21.340 1.00 0.00 ATOM 15504 HN3 POP 125 18.450 40.720 21.150 1.00 0.00 ATOM 15505 C12 POP 125 20.030 40.990 19.850 1.00 0.00 ATOM 15506 H12A POP 125 19.650 40.920 18.800 1.00 0.00 ATOM 15507 H12B POP 125 21.020 40.510 19.970 1.00 0.00 ATOM 15508 C11 POP 125 20.050 42.440 20.340 1.00 0.00 ATOM 15509 H11A POP 125 19.110 43.030 20.260 1.00 0.00 ATOM 15510 H11B POP 125 20.780 43.040 19.760 1.00 0.00 ATOM 15511 P POP 125 21.060 43.670 22.340 1.00 0.00 ATOM 15512 O13 POP 125 20.330 44.930 22.070 1.00 0.00 ATOM 15513 O14 POP 125 22.480 43.780 21.930 1.00 0.00 ATOM 15514 O11 POP 125 21.080 43.470 23.920 1.00 0.00 ATOM 15515 O12 POP 125 20.400 42.350 21.730 1.00 0.00 ATOM 15516 C1 POP 125 20.890 42.160 24.460 1.00 0.00 ATOM 15517 HA POP 125 21.810 41.600 24.170 1.00 0.00 ATOM 15518 HB POP 125 20.070 41.630 23.930 1.00 0.00 ATOM 15519 C2 POP 125 20.910 42.110 25.990 1.00 0.00 ATOM 15520 HS POP 125 20.900 41.010 26.120 1.00 0.00 ATOM 15521 O21 POP 125 19.750 42.720 26.560 1.00 0.00 ATOM 15522 C21 POP 125 19.430 42.210 27.750 1.00 0.00 ATOM 15523 O22 POP 125 20.040 41.360 28.370 1.00 0.00 ATOM 15524 C22 POP 125 18.290 42.940 28.440 1.00 0.00 ATOM 15525 H2R POP 125 17.530 42.200 28.770 1.00 0.00 ATOM 15526 H2S POP 125 17.780 43.760 27.880 1.00 0.00 ATOM 15527 C3 POP 125 22.220 42.690 26.570 1.00 0.00 ATOM 15528 HX POP 125 22.310 43.680 26.080 1.00 0.00 ATOM 15529 HY POP 125 23.050 42.080 26.180 1.00 0.00 ATOM 15530 O31 POP 125 22.260 42.910 27.980 1.00 0.00 ATOM 15531 C31 POP 125 23.060 42.050 28.610 1.00 0.00 ATOM 15532 O32 POP 125 23.820 41.220 28.120 1.00 0.00 ATOM 15533 C32 POP 125 22.870 42.250 30.100 1.00 0.00 ATOM 15534 H2X POP 125 21.960 41.700 30.400 1.00 0.00 ATOM 15535 H2Y POP 125 22.810 43.350 30.300 1.00 0.00 ATOM 15536 C23 POP 125 18.970 43.500 29.700 1.00 0.00 ATOM 15537 H3R POP 125 19.960 43.960 29.470 1.00 0.00 ATOM 15538 H3S POP 125 19.240 42.630 30.340 1.00 0.00 ATOM 15539 C24 POP 125 18.200 44.560 30.480 1.00 0.00 ATOM 15540 H4R POP 125 17.300 44.000 30.840 1.00 0.00 ATOM 15541 H4S POP 125 17.900 45.300 29.710 1.00 0.00 ATOM 15542 C25 POP 125 19.080 45.310 31.480 1.00 0.00 ATOM 15543 H5R POP 125 18.570 46.160 31.990 1.00 0.00 ATOM 15544 H5S POP 125 19.970 45.780 31.020 1.00 0.00 ATOM 15545 C26 POP 125 19.610 44.490 32.660 1.00 0.00 ATOM 15546 H6R POP 125 20.000 43.530 32.270 1.00 0.00 ATOM 15547 H6S POP 125 18.700 44.040 33.120 1.00 0.00 ATOM 15548 C27 POP 125 20.730 44.930 33.590 1.00 0.00 ATOM 15549 H7R POP 125 20.630 46.030 33.760 1.00 0.00 ATOM 15550 H7S POP 125 21.690 44.940 33.040 1.00 0.00 ATOM 15551 C28 POP 125 20.820 44.360 35.010 1.00 0.00 ATOM 15552 H8R POP 125 21.660 44.850 35.550 1.00 0.00 ATOM 15553 H8S POP 125 21.090 43.290 34.940 1.00 0.00 ATOM 15554 C29 POP 125 19.500 44.450 35.720 1.00 0.00 ATOM 15555 H91 POP 125 18.600 44.140 35.160 1.00 0.00 ATOM 15556 0C21 POP 125 19.470 44.690 37.040 1.00 0.00 ATOM 15557 1H10 POP 125 18.490 44.650 37.540 1.00 0.00 ATOM 15558 1C21 POP 125 20.600 44.820 38.010 1.00 0.00 ATOM 15559 H11R POP 125 21.390 45.440 37.530 1.00 0.00 ATOM 15560 H11S POP 125 21.080 43.860 38.310 1.00 0.00 ATOM 15561 2C21 POP 125 20.120 45.510 39.290 1.00 0.00 ATOM 15562 H12R POP 125 21.020 45.640 39.930 1.00 0.00 ATOM 15563 H12S POP 125 19.460 44.810 39.850 1.00 0.00 ATOM 15564 3C21 POP 125 19.470 46.890 39.170 1.00 0.00 ATOM 15565 H13R POP 125 18.550 46.900 38.550 1.00 0.00 ATOM 15566 H13S POP 125 20.170 47.640 38.750 1.00 0.00 ATOM 15567 4C21 POP 125 19.260 47.330 40.620 1.00 0.00 ATOM 15568 H14R POP 125 20.190 47.600 41.170 1.00 0.00 ATOM 15569 H14S POP 125 18.810 46.470 41.160 1.00 0.00 ATOM 15570 5C21 POP 125 18.330 48.540 40.730 1.00 0.00 ATOM 15571 H15R POP 125 17.450 48.290 40.100 1.00 0.00 ATOM 15572 H15S POP 125 18.870 49.340 40.170 1.00 0.00 ATOM 15573 6C21 POP 125 17.960 48.960 42.150 1.00 0.00 ATOM 15574 H16R POP 125 18.900 49.180 42.700 1.00 0.00 ATOM 15575 H16S POP 125 17.450 48.210 42.800 1.00 0.00 ATOM 15576 7C21 POP 125 16.980 50.140 42.190 1.00 0.00 ATOM 15577 H17R POP 125 16.440 50.300 43.140 1.00 0.00 ATOM 15578 H17S POP 125 16.240 49.920 41.390 1.00 0.00 ATOM 15579 8C21 POP 125 17.590 51.430 41.640 1.00 0.00 ATOM 15580 H18R POP 125 18.440 51.690 42.300 1.00 0.00 ATOM 15581 H18S POP 125 16.790 52.200 41.620 1.00 0.00 ATOM 15582 H18T POP 125 17.890 51.400 40.570 1.00 0.00 ATOM 15583 C33 POP 125 24.120 41.800 30.860 1.00 0.00 ATOM 15584 H3X POP 125 24.970 42.430 30.490 1.00 0.00 ATOM 15585 H3Y POP 125 24.330 40.730 30.640 1.00 0.00 ATOM 15586 C34 POP 125 23.950 41.900 32.380 1.00 0.00 ATOM 15587 H4X POP 125 24.610 41.130 32.820 1.00 0.00 ATOM 15588 H4Y POP 125 22.920 41.620 32.660 1.00 0.00 ATOM 15589 C35 POP 125 24.550 43.120 33.070 1.00 0.00 ATOM 15590 H5X POP 125 23.770 43.910 33.010 1.00 0.00 ATOM 15591 H5Y POP 125 25.430 43.520 32.520 1.00 0.00 ATOM 15592 C36 POP 125 24.820 42.800 34.540 1.00 0.00 ATOM 15593 H6X POP 125 25.610 42.020 34.640 1.00 0.00 ATOM 15594 H6Y POP 125 23.960 42.220 34.950 1.00 0.00 ATOM 15595 C37 POP 125 24.990 44.090 35.340 1.00 0.00 ATOM 15596 H7X POP 125 24.070 44.690 35.130 1.00 0.00 ATOM 15597 H7Y POP 125 25.880 44.690 35.030 1.00 0.00 ATOM 15598 C38 POP 125 25.100 43.820 36.840 1.00 0.00 ATOM 15599 H8X POP 125 25.840 43.000 36.970 1.00 0.00 ATOM 15600 H8Y POP 125 24.080 43.390 37.010 1.00 0.00 ATOM 15601 C39 POP 125 25.480 45.030 37.680 1.00 0.00 ATOM 15602 H9X POP 125 24.720 45.830 37.530 1.00 0.00 ATOM 15603 H9Y POP 125 26.370 45.510 37.220 1.00 0.00 ATOM 15604 0C31 POP 125 25.670 44.730 39.170 1.00 0.00 ATOM 15605 H10X POP 125 26.120 43.720 39.270 1.00 0.00 ATOM 15606 H10Y POP 125 24.610 44.500 39.430 1.00 0.00 ATOM 15607 1C31 POP 125 26.310 45.750 40.110 1.00 0.00 ATOM 15608 H11X POP 125 27.400 45.650 39.930 1.00 0.00 ATOM 15609 H11Y POP 125 26.160 45.410 41.160 1.00 0.00 ATOM 15610 2C31 POP 125 25.820 47.180 39.940 1.00 0.00 ATOM 15611 H12X POP 125 24.710 47.190 40.020 1.00 0.00 ATOM 15612 H12Y POP 125 26.000 47.580 38.920 1.00 0.00 ATOM 15613 3C31 POP 125 26.550 48.170 40.840 1.00 0.00 ATOM 15614 H13X POP 125 26.390 49.240 40.570 1.00 0.00 ATOM 15615 H13Y POP 125 27.630 48.060 40.620 1.00 0.00 ATOM 15616 4C31 POP 125 26.200 47.920 42.310 1.00 0.00 ATOM 15617 H14X POP 125 26.280 46.850 42.580 1.00 0.00 ATOM 15618 H14Y POP 125 25.140 48.240 42.420 1.00 0.00 ATOM 15619 5C31 POP 125 27.120 48.730 43.220 1.00 0.00 ATOM 15620 H15X POP 125 28.120 48.280 42.990 1.00 0.00 ATOM 15621 H15Y POP 125 26.940 48.580 44.310 1.00 0.00 ATOM 15622 6C31 POP 125 27.170 50.230 42.930 1.00 0.00 ATOM 15623 H16X POP 125 27.980 50.670 43.550 1.00 0.00 ATOM 15624 H16Y POP 125 26.200 50.620 43.280 1.00 0.00 ATOM 15625 H16Z POP 125 27.410 50.500 41.880 1.00 0.00 ATOM 15626 N POP 126 40.410 41.050 22.210 1.00 0.00 ATOM 15627 HN1 POP 126 40.540 40.410 21.400 1.00 0.00 ATOM 15628 HN2 POP 126 39.780 40.440 22.760 1.00 0.00 ATOM 15629 HN3 POP 126 40.040 41.960 21.880 1.00 0.00 ATOM 15630 C12 POP 126 41.700 41.090 23.000 1.00 0.00 ATOM 15631 H12A POP 126 42.390 41.700 22.380 1.00 0.00 ATOM 15632 H12B POP 126 42.090 40.050 23.020 1.00 0.00 ATOM 15633 C11 POP 126 41.680 41.610 24.430 1.00 0.00 ATOM 15634 H11A POP 126 42.710 41.640 24.830 1.00 0.00 ATOM 15635 H11B POP 126 41.290 40.870 25.170 1.00 0.00 ATOM 15636 P POP 126 41.860 44.150 24.560 1.00 0.00 ATOM 15637 O13 POP 126 41.180 45.390 24.120 1.00 0.00 ATOM 15638 O14 POP 126 43.190 43.840 23.990 1.00 0.00 ATOM 15639 O11 POP 126 41.980 44.240 26.160 1.00 0.00 ATOM 15640 O12 POP 126 40.950 42.850 24.420 1.00 0.00 ATOM 15641 C1 POP 126 40.860 43.840 26.940 1.00 0.00 ATOM 15642 HA POP 126 40.770 42.730 27.030 1.00 0.00 ATOM 15643 HB POP 126 39.920 44.060 26.390 1.00 0.00 ATOM 15644 C2 POP 126 40.720 44.390 28.370 1.00 0.00 ATOM 15645 HS POP 126 40.680 45.500 28.320 1.00 0.00 ATOM 15646 O21 POP 126 41.880 43.950 29.080 1.00 0.00 ATOM 15647 C21 POP 126 42.230 44.760 30.080 1.00 0.00 ATOM 15648 O22 POP 126 41.820 45.910 30.170 1.00 0.00 ATOM 15649 C22 POP 126 43.260 44.060 30.950 1.00 0.00 ATOM 15650 H2R POP 126 44.230 44.490 30.610 1.00 0.00 ATOM 15651 H2S POP 126 43.290 42.980 30.700 1.00 0.00 ATOM 15652 C3 POP 126 39.420 43.940 29.050 1.00 0.00 ATOM 15653 HX POP 126 39.460 42.830 29.060 1.00 0.00 ATOM 15654 HY POP 126 38.490 44.180 28.500 1.00 0.00 ATOM 15655 O31 POP 126 39.280 44.350 30.420 1.00 0.00 ATOM 15656 C31 POP 126 38.880 45.610 30.590 1.00 0.00 ATOM 15657 O32 POP 126 38.500 46.400 29.750 1.00 0.00 ATOM 15658 C32 POP 126 39.240 45.870 32.050 1.00 0.00 ATOM 15659 H2X POP 126 40.190 46.450 31.980 1.00 0.00 ATOM 15660 H2Y POP 126 39.300 44.860 32.510 1.00 0.00 ATOM 15661 C23 POP 126 43.080 44.380 32.440 1.00 0.00 ATOM 15662 H3R POP 126 42.850 45.460 32.540 1.00 0.00 ATOM 15663 H3S POP 126 44.040 44.240 32.980 1.00 0.00 ATOM 15664 C24 POP 126 41.960 43.650 33.180 1.00 0.00 ATOM 15665 H4R POP 126 42.450 42.680 33.440 1.00 0.00 ATOM 15666 H4S POP 126 41.090 43.620 32.480 1.00 0.00 ATOM 15667 C25 POP 126 41.560 44.380 34.460 1.00 0.00 ATOM 15668 H5R POP 126 40.550 44.050 34.780 1.00 0.00 ATOM 15669 H5S POP 126 41.530 45.430 34.110 1.00 0.00 ATOM 15670 C26 POP 126 42.450 44.060 35.660 1.00 0.00 ATOM 15671 H6R POP 126 43.430 43.880 35.190 1.00 0.00 ATOM 15672 H6S POP 126 42.180 43.140 36.230 1.00 0.00 ATOM 15673 C27 POP 126 42.620 45.170 36.700 1.00 0.00 ATOM 15674 H7R POP 126 41.640 45.270 37.190 1.00 0.00 ATOM 15675 H7S POP 126 42.800 46.060 36.050 1.00 0.00 ATOM 15676 C28 POP 126 43.820 45.060 37.650 1.00 0.00 ATOM 15677 H8R POP 126 44.760 44.990 37.060 1.00 0.00 ATOM 15678 H8S POP 126 43.740 44.070 38.160 1.00 0.00 ATOM 15679 C29 POP 126 43.840 46.210 38.610 1.00 0.00 ATOM 15680 H91 POP 126 43.940 47.160 38.050 1.00 0.00 ATOM 15681 0C21 POP 126 43.620 46.140 39.930 1.00 0.00 ATOM 15682 1H10 POP 126 43.420 47.090 40.440 1.00 0.00 ATOM 15683 1C21 POP 126 43.410 44.850 40.680 1.00 0.00 ATOM 15684 H11R POP 126 43.470 44.010 39.960 1.00 0.00 ATOM 15685 H11S POP 126 42.430 44.720 41.180 1.00 0.00 ATOM 15686 2C21 POP 126 44.370 44.780 41.860 1.00 0.00 ATOM 15687 H12R POP 126 44.070 43.910 42.480 1.00 0.00 ATOM 15688 H12S POP 126 44.300 45.690 42.490 1.00 0.00 ATOM 15689 3C21 POP 126 45.830 44.870 41.400 1.00 0.00 ATOM 15690 H13R POP 126 45.920 45.960 41.250 1.00 0.00 ATOM 15691 H13S POP 126 45.860 44.150 40.550 1.00 0.00 ATOM 15692 4C21 POP 126 46.760 44.480 42.550 1.00 0.00 ATOM 15693 H14R POP 126 46.680 43.380 42.720 1.00 0.00 ATOM 15694 H14S POP 126 46.360 45.070 43.400 1.00 0.00 ATOM 15695 5C21 POP 126 48.230 44.850 42.340 1.00 0.00 ATOM 15696 H15R POP 126 48.590 45.070 43.370 1.00 0.00 ATOM 15697 H15S POP 126 48.300 45.810 41.800 1.00 0.00 ATOM 15698 6C21 POP 126 49.050 43.730 41.720 1.00 0.00 ATOM 15699 H16R POP 126 48.580 43.480 40.740 1.00 0.00 ATOM 15700 H16S POP 126 48.910 42.840 42.380 1.00 0.00 ATOM 15701 7C21 POP 126 50.500 44.220 41.630 1.00 0.00 ATOM 15702 H17R POP 126 50.770 44.450 42.680 1.00 0.00 ATOM 15703 H17S POP 126 50.510 45.130 41.000 1.00 0.00 ATOM 15704 8C21 POP 126 51.470 43.210 41.030 1.00 0.00 ATOM 15705 H18R POP 126 52.510 43.590 41.030 1.00 0.00 ATOM 15706 H18S POP 126 51.170 42.820 40.030 1.00 0.00 ATOM 15707 H18T POP 126 51.520 42.370 41.760 1.00 0.00 ATOM 15708 C33 POP 126 38.100 46.580 32.770 1.00 0.00 ATOM 15709 H3X POP 126 37.230 45.970 33.100 1.00 0.00 ATOM 15710 H3Y POP 126 37.840 47.350 32.010 1.00 0.00 ATOM 15711 C34 POP 126 38.440 47.370 34.040 1.00 0.00 ATOM 15712 H4X POP 126 39.280 48.050 33.790 1.00 0.00 ATOM 15713 H4Y POP 126 38.800 46.750 34.890 1.00 0.00 ATOM 15714 C35 POP 126 37.350 48.360 34.460 1.00 0.00 ATOM 15715 H5X POP 126 36.450 47.750 34.670 1.00 0.00 ATOM 15716 H5Y POP 126 37.120 49.060 33.630 1.00 0.00 ATOM 15717 C36 POP 126 37.730 49.190 35.680 1.00 0.00 ATOM 15718 H6X POP 126 38.610 49.820 35.400 1.00 0.00 ATOM 15719 H6Y POP 126 37.930 48.490 36.520 1.00 0.00 ATOM 15720 C37 POP 126 36.570 50.090 36.120 1.00 0.00 ATOM 15721 H7X POP 126 35.660 49.460 36.240 1.00 0.00 ATOM 15722 H7Y POP 126 36.400 50.820 35.300 1.00 0.00 ATOM 15723 C38 POP 126 36.790 50.830 37.430 1.00 0.00 ATOM 15724 H8X POP 126 36.640 51.930 37.370 1.00 0.00 ATOM 15725 H8Y POP 126 37.800 50.610 37.860 1.00 0.00 ATOM 15726 C39 POP 126 35.680 50.560 38.450 1.00 0.00 ATOM 15727 H9X POP 126 35.860 49.500 38.760 1.00 0.00 ATOM 15728 H9Y POP 126 34.770 50.830 37.880 1.00 0.00 ATOM 15729 0C31 POP 126 35.680 51.430 39.710 1.00 0.00 ATOM 15730 H10X POP 126 34.800 51.180 40.330 1.00 0.00 ATOM 15731 H10Y POP 126 35.540 52.410 39.200 1.00 0.00 ATOM 15732 1C31 POP 126 37.040 51.480 40.410 1.00 0.00 ATOM 15733 H11X POP 126 37.850 52.030 39.880 1.00 0.00 ATOM 15734 H11Y POP 126 37.460 50.460 40.550 1.00 0.00 ATOM 15735 2C31 POP 126 37.050 52.170 41.780 1.00 0.00 ATOM 15736 H12X POP 126 36.060 51.860 42.170 1.00 0.00 ATOM 15737 H12Y POP 126 37.070 53.260 41.580 1.00 0.00 ATOM 15738 3C31 POP 126 38.240 51.720 42.620 1.00 0.00 ATOM 15739 H13X POP 126 38.930 51.210 41.900 1.00 0.00 ATOM 15740 H13Y POP 126 37.850 50.930 43.300 1.00 0.00 ATOM 15741 4C31 POP 126 38.870 52.850 43.440 1.00 0.00 ATOM 15742 H14X POP 126 39.220 53.580 42.670 1.00 0.00 ATOM 15743 H14Y POP 126 39.740 52.440 43.990 1.00 0.00 ATOM 15744 5C31 POP 126 37.770 53.330 44.390 1.00 0.00 ATOM 15745 H15X POP 126 37.290 52.490 44.930 1.00 0.00 ATOM 15746 H15Y POP 126 36.940 53.840 43.860 1.00 0.00 ATOM 15747 6C31 POP 126 38.310 54.250 45.480 1.00 0.00 ATOM 15748 H16X POP 126 38.770 53.790 46.380 1.00 0.00 ATOM 15749 H16Y POP 126 37.590 55.010 45.840 1.00 0.00 ATOM 15750 H16Z POP 126 39.180 54.730 44.990 1.00 0.00 ATOM 15751 N POP 127 59.530 55.120 23.590 1.00 0.00 ATOM 15752 HN1 POP 127 60.450 54.980 23.140 1.00 0.00 ATOM 15753 HN2 POP 127 58.880 55.030 22.780 1.00 0.00 ATOM 15754 HN3 POP 127 59.400 56.090 23.930 1.00 0.00 ATOM 15755 C12 POP 127 59.200 54.080 24.640 1.00 0.00 ATOM 15756 H12A POP 127 60.080 53.880 25.280 1.00 0.00 ATOM 15757 H12B POP 127 58.960 53.130 24.130 1.00 0.00 ATOM 15758 C11 POP 127 57.930 54.560 25.350 1.00 0.00 ATOM 15759 H11A POP 127 58.260 55.320 26.090 1.00 0.00 ATOM 15760 H11B POP 127 57.460 53.680 25.850 1.00 0.00 ATOM 15761 P POP 127 55.680 55.740 24.720 1.00 0.00 ATOM 15762 O13 POP 127 54.770 55.330 23.620 1.00 0.00 ATOM 15763 O14 POP 127 55.790 57.200 24.880 1.00 0.00 ATOM 15764 O11 POP 127 55.410 55.010 26.120 1.00 0.00 ATOM 15765 O12 POP 127 57.090 55.090 24.330 1.00 0.00 ATOM 15766 C1 POP 127 54.050 54.970 26.540 1.00 0.00 ATOM 15767 HA POP 127 53.810 54.140 27.250 1.00 0.00 ATOM 15768 HB POP 127 53.340 54.630 25.760 1.00 0.00 ATOM 15769 C2 POP 127 53.710 56.260 27.300 1.00 0.00 ATOM 15770 HS POP 127 53.520 57.000 26.500 1.00 0.00 ATOM 15771 O21 POP 127 54.790 56.750 28.100 1.00 0.00 ATOM 15772 C21 POP 127 54.810 58.080 28.280 1.00 0.00 ATOM 15773 O22 POP 127 53.920 58.780 27.830 1.00 0.00 ATOM 15774 C22 POP 127 56.110 58.460 28.960 1.00 0.00 ATOM 15775 H2R POP 127 56.960 57.990 28.420 1.00 0.00 ATOM 15776 H2S POP 127 56.170 58.020 29.980 1.00 0.00 ATOM 15777 C3 POP 127 52.430 56.060 28.130 1.00 0.00 ATOM 15778 HX POP 127 51.540 55.730 27.550 1.00 0.00 ATOM 15779 HY POP 127 52.130 57.060 28.490 1.00 0.00 ATOM 15780 O31 POP 127 52.700 55.270 29.290 1.00 0.00 ATOM 15781 C31 POP 127 52.190 54.040 29.420 1.00 0.00 ATOM 15782 O32 POP 127 51.560 53.510 28.510 1.00 0.00 ATOM 15783 C32 POP 127 52.550 53.290 30.690 1.00 0.00 ATOM 15784 H2X POP 127 53.460 52.660 30.580 1.00 0.00 ATOM 15785 H2Y POP 127 51.730 52.680 31.130 1.00 0.00 ATOM 15786 C23 POP 127 56.120 59.990 28.960 1.00 0.00 ATOM 15787 H3R POP 127 55.330 60.400 29.620 1.00 0.00 ATOM 15788 H3S POP 127 55.940 60.230 27.890 1.00 0.00 ATOM 15789 C24 POP 127 57.470 60.560 29.390 1.00 0.00 ATOM 15790 H4R POP 127 57.480 61.660 29.260 1.00 0.00 ATOM 15791 H4S POP 127 58.240 60.150 28.710 1.00 0.00 ATOM 15792 C25 POP 127 57.780 60.240 30.860 1.00 0.00 ATOM 15793 H5R POP 127 58.160 59.200 30.950 1.00 0.00 ATOM 15794 H5S POP 127 56.910 60.450 31.510 1.00 0.00 ATOM 15795 C26 POP 127 58.840 61.220 31.370 1.00 0.00 ATOM 15796 H6R POP 127 58.470 62.260 31.270 1.00 0.00 ATOM 15797 H6S POP 127 59.720 61.070 30.710 1.00 0.00 ATOM 15798 C27 POP 127 59.300 61.070 32.820 1.00 0.00 ATOM 15799 H7R POP 127 59.790 60.070 32.790 1.00 0.00 ATOM 15800 H7S POP 127 58.360 61.110 33.410 1.00 0.00 ATOM 15801 C28 POP 127 60.190 62.190 33.380 1.00 0.00 ATOM 15802 H8R POP 127 59.810 63.220 33.210 1.00 0.00 ATOM 15803 H8S POP 127 61.110 62.200 32.750 1.00 0.00 ATOM 15804 C29 POP 127 60.470 61.990 34.840 1.00 0.00 ATOM 15805 H91 POP 127 61.190 61.180 35.060 1.00 0.00 ATOM 15806 0C21 POP 127 59.740 62.470 35.850 1.00 0.00 ATOM 15807 1H10 POP 127 60.140 62.260 36.860 1.00 0.00 ATOM 15808 1C21 POP 127 58.570 63.410 35.860 1.00 0.00 ATOM 15809 H11R POP 127 58.400 63.890 34.880 1.00 0.00 ATOM 15810 H11S POP 127 58.950 64.200 36.550 1.00 0.00 ATOM 15811 2C21 POP 127 57.210 62.900 36.350 1.00 0.00 ATOM 15812 H12R POP 127 57.360 62.370 37.320 1.00 0.00 ATOM 15813 H12S POP 127 56.890 62.100 35.650 1.00 0.00 ATOM 15814 3C21 POP 127 56.110 63.960 36.230 1.00 0.00 ATOM 15815 H13R POP 127 55.190 63.420 36.520 1.00 0.00 ATOM 15816 H13S POP 127 55.980 64.360 35.200 1.00 0.00 ATOM 15817 4C21 POP 127 56.240 65.120 37.230 1.00 0.00 ATOM 15818 H14R POP 127 55.330 65.750 37.120 1.00 0.00 ATOM 15819 H14S POP 127 57.070 65.800 36.980 1.00 0.00 ATOM 15820 5C21 POP 127 56.330 64.690 38.690 1.00 0.00 ATOM 15821 H15R POP 127 57.010 63.820 38.710 1.00 0.00 ATOM 15822 H15S POP 127 55.310 64.380 39.010 1.00 0.00 ATOM 15823 6C21 POP 127 56.860 65.860 39.530 1.00 0.00 ATOM 15824 H16R POP 127 56.080 66.650 39.560 1.00 0.00 ATOM 15825 H16S POP 127 57.880 66.180 39.200 1.00 0.00 ATOM 15826 7C21 POP 127 57.050 65.400 40.970 1.00 0.00 ATOM 15827 H17R POP 127 57.730 64.540 40.800 1.00 0.00 ATOM 15828 H17S POP 127 56.130 64.940 41.380 1.00 0.00 ATOM 15829 8C21 POP 127 57.650 66.420 41.940 1.00 0.00 ATOM 15830 H18R POP 127 56.880 67.220 42.010 1.00 0.00 ATOM 15831 H18S POP 127 57.880 66.000 42.940 1.00 0.00 ATOM 15832 H18T POP 127 58.580 66.810 41.460 1.00 0.00 ATOM 15833 C33 POP 127 52.840 54.260 31.840 1.00 0.00 ATOM 15834 H3X POP 127 53.480 55.090 31.470 1.00 0.00 ATOM 15835 H3Y POP 127 53.380 53.720 32.640 1.00 0.00 ATOM 15836 C34 POP 127 51.630 54.920 32.510 1.00 0.00 ATOM 15837 H4X POP 127 51.150 55.740 31.930 1.00 0.00 ATOM 15838 H4Y POP 127 52.110 55.510 33.310 1.00 0.00 ATOM 15839 C35 POP 127 50.530 54.040 33.120 1.00 0.00 ATOM 15840 H5X POP 127 49.640 54.670 33.300 1.00 0.00 ATOM 15841 H5Y POP 127 50.100 53.440 32.280 1.00 0.00 ATOM 15842 C36 POP 127 50.970 53.210 34.330 1.00 0.00 ATOM 15843 H6X POP 127 51.890 52.630 34.120 1.00 0.00 ATOM 15844 H6Y POP 127 50.120 52.530 34.570 1.00 0.00 ATOM 15845 C37 POP 127 51.390 53.950 35.590 1.00 0.00 ATOM 15846 H7X POP 127 50.560 54.600 35.970 1.00 0.00 ATOM 15847 H7Y POP 127 52.280 54.610 35.500 1.00 0.00 ATOM 15848 C38 POP 127 51.760 52.980 36.710 1.00 0.00 ATOM 15849 H8X POP 127 52.610 52.350 36.360 1.00 0.00 ATOM 15850 H8Y POP 127 50.990 52.180 36.780 1.00 0.00 ATOM 15851 C39 POP 127 51.990 53.580 38.100 1.00 0.00 ATOM 15852 H9X POP 127 52.120 52.720 38.790 1.00 0.00 ATOM 15853 H9Y POP 127 51.040 54.120 38.260 1.00 0.00 ATOM 15854 0C31 POP 127 53.240 54.460 38.190 1.00 0.00 ATOM 15855 H10X POP 127 53.030 55.330 37.540 1.00 0.00 ATOM 15856 H10Y POP 127 54.050 53.870 37.700 1.00 0.00 ATOM 15857 1C31 POP 127 53.720 55.050 39.520 1.00 0.00 ATOM 15858 H11X POP 127 53.640 54.220 40.240 1.00 0.00 ATOM 15859 H11Y POP 127 53.070 55.870 39.900 1.00 0.00 ATOM 15860 2C31 POP 127 55.170 55.530 39.610 1.00 0.00 ATOM 15861 H12X POP 127 55.310 56.550 39.190 1.00 0.00 ATOM 15862 H12Y POP 127 55.770 54.750 39.100 1.00 0.00 ATOM 15863 3C31 POP 127 55.780 55.720 41.000 1.00 0.00 ATOM 15864 H13X POP 127 56.780 56.180 40.860 1.00 0.00 ATOM 15865 H13Y POP 127 55.830 54.690 41.420 1.00 0.00 ATOM 15866 4C31 POP 127 54.980 56.520 42.030 1.00 0.00 ATOM 15867 H14X POP 127 55.610 56.760 42.920 1.00 0.00 ATOM 15868 H14Y POP 127 54.060 55.990 42.340 1.00 0.00 ATOM 15869 5C31 POP 127 54.590 57.910 41.510 1.00 0.00 ATOM 15870 H15X POP 127 53.950 57.880 40.610 1.00 0.00 ATOM 15871 H15Y POP 127 55.530 58.400 41.180 1.00 0.00 ATOM 15872 6C31 POP 127 53.790 58.710 42.540 1.00 0.00 ATOM 15873 H16X POP 127 52.840 58.210 42.800 1.00 0.00 ATOM 15874 H16Y POP 127 53.520 59.740 42.220 1.00 0.00 ATOM 15875 H16Z POP 127 54.420 58.810 43.450 1.00 0.00 ATOM 15876 N POP 128 33.610 25.890 24.530 1.00 0.00 ATOM 15877 HN1 POP 128 34.220 26.240 23.760 1.00 0.00 ATOM 15878 HN2 POP 128 32.940 26.660 24.750 1.00 0.00 ATOM 15879 HN3 POP 128 34.200 25.690 25.360 1.00 0.00 ATOM 15880 C12 POP 128 32.820 24.650 24.190 1.00 0.00 ATOM 15881 H12A POP 128 33.470 23.800 24.470 1.00 0.00 ATOM 15882 H12B POP 128 32.680 24.690 23.090 1.00 0.00 ATOM 15883 C11 POP 128 31.470 24.720 24.900 1.00 0.00 ATOM 15884 H11A POP 128 30.860 23.830 24.620 1.00 0.00 ATOM 15885 H11B POP 128 30.890 25.570 24.480 1.00 0.00 ATOM 15886 P POP 128 30.730 24.260 27.280 1.00 0.00 ATOM 15887 O13 POP 128 29.500 25.040 27.040 1.00 0.00 ATOM 15888 O14 POP 128 30.580 22.830 26.960 1.00 0.00 ATOM 15889 O11 POP 128 31.280 24.450 28.770 1.00 0.00 ATOM 15890 O12 POP 128 31.820 24.860 26.280 1.00 0.00 ATOM 15891 C1 POP 128 32.660 24.200 29.060 1.00 0.00 ATOM 15892 HA POP 128 32.930 24.750 29.990 1.00 0.00 ATOM 15893 HB POP 128 33.400 24.520 28.290 1.00 0.00 ATOM 15894 C2 POP 128 32.870 22.720 29.410 1.00 0.00 ATOM 15895 HS POP 128 32.810 22.260 28.400 1.00 0.00 ATOM 15896 O21 POP 128 31.790 22.340 30.270 1.00 0.00 ATOM 15897 C21 POP 128 31.720 21.010 30.310 1.00 0.00 ATOM 15898 O22 POP 128 32.380 20.260 29.600 1.00 0.00 ATOM 15899 C22 POP 128 30.680 20.510 31.290 1.00 0.00 ATOM 15900 H2R POP 128 29.940 19.830 30.810 1.00 0.00 ATOM 15901 H2S POP 128 30.020 21.370 31.540 1.00 0.00 ATOM 15902 C3 POP 128 34.250 22.600 30.080 1.00 0.00 ATOM 15903 HX POP 128 34.290 23.330 30.910 1.00 0.00 ATOM 15904 HY POP 128 35.010 23.120 29.460 1.00 0.00 ATOM 15905 O31 POP 128 34.620 21.340 30.630 1.00 0.00 ATOM 15906 C31 POP 128 35.300 20.620 29.730 1.00 0.00 ATOM 15907 O32 POP 128 35.530 20.950 28.580 1.00 0.00 ATOM 15908 C32 POP 128 35.640 19.310 30.430 1.00 0.00 ATOM 15909 H2X POP 128 35.890 18.580 29.630 1.00 0.00 ATOM 15910 H2Y POP 128 34.780 18.930 31.010 1.00 0.00 ATOM 15911 C23 POP 128 31.380 19.870 32.490 1.00 0.00 ATOM 15912 H3R POP 128 32.120 20.580 32.910 1.00 0.00 ATOM 15913 H3S POP 128 31.930 19.000 32.070 1.00 0.00 ATOM 15914 C24 POP 128 30.440 19.300 33.550 1.00 0.00 ATOM 15915 H4R POP 128 31.160 19.080 34.370 1.00 0.00 ATOM 15916 H4S POP 128 29.880 18.380 33.290 1.00 0.00 ATOM 15917 C25 POP 128 29.360 20.260 34.040 1.00 0.00 ATOM 15918 H5R POP 128 28.640 20.300 33.190 1.00 0.00 ATOM 15919 H5S POP 128 29.680 21.320 34.120 1.00 0.00 ATOM 15920 C26 POP 128 28.680 19.960 35.380 1.00 0.00 ATOM 15921 H6R POP 128 29.400 20.080 36.210 1.00 0.00 ATOM 15922 H6S POP 128 28.370 18.900 35.500 1.00 0.00 ATOM 15923 C27 POP 128 27.470 20.870 35.590 1.00 0.00 ATOM 15924 H7R POP 128 26.830 20.620 34.710 1.00 0.00 ATOM 15925 H7S POP 128 27.750 21.940 35.480 1.00 0.00 ATOM 15926 C28 POP 128 26.590 20.640 36.820 1.00 0.00 ATOM 15927 H8R POP 128 26.070 19.670 36.930 1.00 0.00 ATOM 15928 H8S POP 128 25.720 21.330 36.700 1.00 0.00 ATOM 15929 C29 POP 128 27.250 21.070 38.090 1.00 0.00 ATOM 15930 H91 POP 128 28.170 21.600 37.810 1.00 0.00 ATOM 15931 0C21 POP 128 26.880 20.860 39.360 1.00 0.00 ATOM 15932 1H10 POP 128 27.370 21.480 40.130 1.00 0.00 ATOM 15933 1C21 POP 128 25.570 20.240 39.780 1.00 0.00 ATOM 15934 H11R POP 128 25.710 19.190 40.100 1.00 0.00 ATOM 15935 H11S POP 128 24.750 20.190 39.030 1.00 0.00 ATOM 15936 2C21 POP 128 24.980 20.990 40.970 1.00 0.00 ATOM 15937 H12R POP 128 24.710 22.040 40.710 1.00 0.00 ATOM 15938 H12S POP 128 25.830 21.020 41.700 1.00 0.00 ATOM 15939 3C21 POP 128 23.850 20.160 41.570 1.00 0.00 ATOM 15940 H13R POP 128 24.180 19.110 41.690 1.00 0.00 ATOM 15941 H13S POP 128 22.980 20.050 40.880 1.00 0.00 ATOM 15942 4C21 POP 128 23.290 20.880 42.800 1.00 0.00 ATOM 15943 H14R POP 128 24.150 21.210 43.410 1.00 0.00 ATOM 15944 H14S POP 128 22.800 20.180 43.510 1.00 0.00 ATOM 15945 5C21 POP 128 22.270 22.000 42.530 1.00 0.00 ATOM 15946 H15R POP 128 21.440 21.660 41.880 1.00 0.00 ATOM 15947 H15S POP 128 22.800 22.810 41.970 1.00 0.00 ATOM 15948 6C21 POP 128 21.660 22.430 43.870 1.00 0.00 ATOM 15949 H16R POP 128 22.580 22.760 44.390 1.00 0.00 ATOM 15950 H16S POP 128 21.260 21.560 44.430 1.00 0.00 ATOM 15951 7C21 POP 128 20.660 23.580 43.870 1.00 0.00 ATOM 15952 H17R POP 128 19.830 23.080 43.320 1.00 0.00 ATOM 15953 H17S POP 128 21.070 24.520 43.440 1.00 0.00 ATOM 15954 8C21 POP 128 20.160 24.060 45.230 1.00 0.00 ATOM 15955 H18R POP 128 21.010 24.200 45.930 1.00 0.00 ATOM 15956 H18S POP 128 19.510 23.240 45.610 1.00 0.00 ATOM 15957 H18T POP 128 19.640 25.040 45.170 1.00 0.00 ATOM 15958 C33 POP 128 36.870 19.650 31.270 1.00 0.00 ATOM 15959 H3X POP 128 36.730 20.550 31.900 1.00 0.00 ATOM 15960 H3Y POP 128 37.670 19.970 30.570 1.00 0.00 ATOM 15961 C34 POP 128 37.310 18.420 32.080 1.00 0.00 ATOM 15962 H4X POP 128 38.410 18.400 32.200 1.00 0.00 ATOM 15963 H4Y POP 128 36.850 17.500 31.660 1.00 0.00 ATOM 15964 C35 POP 128 36.760 18.470 33.510 1.00 0.00 ATOM 15965 H5X POP 128 35.660 18.330 33.530 1.00 0.00 ATOM 15966 H5Y POP 128 37.040 19.420 34.020 1.00 0.00 ATOM 15967 C36 POP 128 37.420 17.530 34.530 1.00 0.00 ATOM 15968 H6X POP 128 38.470 17.890 34.670 1.00 0.00 ATOM 15969 H6Y POP 128 37.290 16.500 34.150 1.00 0.00 ATOM 15970 C37 POP 128 36.720 17.580 35.890 1.00 0.00 ATOM 15971 H7X POP 128 37.300 17.100 36.710 1.00 0.00 ATOM 15972 H7Y POP 128 35.690 17.180 35.840 1.00 0.00 ATOM 15973 C38 POP 128 36.660 18.970 36.520 1.00 0.00 ATOM 15974 H8X POP 128 36.080 19.770 36.020 1.00 0.00 ATOM 15975 H8Y POP 128 37.760 19.110 36.450 1.00 0.00 ATOM 15976 C39 POP 128 36.360 19.000 38.020 1.00 0.00 ATOM 15977 H9X POP 128 36.980 18.310 38.640 1.00 0.00 ATOM 15978 H9Y POP 128 35.270 18.840 38.050 1.00 0.00 ATOM 15979 0C31 POP 128 36.490 20.420 38.600 1.00 0.00 ATOM 15980 H10X POP 128 35.900 21.020 37.880 1.00 0.00 ATOM 15981 H10Y POP 128 37.580 20.670 38.570 1.00 0.00 ATOM 15982 1C31 POP 128 35.740 20.660 39.900 1.00 0.00 ATOM 15983 H11X POP 128 36.170 19.980 40.670 1.00 0.00 ATOM 15984 H11Y POP 128 34.730 20.200 39.780 1.00 0.00 ATOM 15985 2C31 POP 128 35.600 22.160 40.200 1.00 0.00 ATOM 15986 H12X POP 128 34.820 22.670 39.590 1.00 0.00 ATOM 15987 H12Y POP 128 36.610 22.550 39.960 1.00 0.00 ATOM 15988 3C31 POP 128 35.240 22.380 41.670 1.00 0.00 ATOM 15989 H13X POP 128 35.050 23.460 41.810 1.00 0.00 ATOM 15990 H13Y POP 128 36.080 22.200 42.370 1.00 0.00 ATOM 15991 4C31 POP 128 34.020 21.590 42.130 1.00 0.00 ATOM 15992 H14X POP 128 34.240 20.500 42.120 1.00 0.00 ATOM 15993 H14Y POP 128 33.120 21.900 41.550 1.00 0.00 ATOM 15994 5C31 POP 128 33.730 21.950 43.590 1.00 0.00 ATOM 15995 H15X POP 128 33.520 23.040 43.620 1.00 0.00 ATOM 15996 H15Y POP 128 34.650 21.730 44.160 1.00 0.00 ATOM 15997 6C31 POP 128 32.510 21.230 44.170 1.00 0.00 ATOM 15998 H16X POP 128 32.670 20.130 44.170 1.00 0.00 ATOM 15999 H16Y POP 128 31.630 21.380 43.510 1.00 0.00 ATOM 16000 H16Z POP 128 32.280 21.420 45.240 1.00 0.00 ATOM 16001 OH2 SOL 129 31.830 46.830 80.490 1.00 0.00 ATOM 16002 H1 SOL 129 32.130 45.970 80.770 1.00 0.00 ATOM 16003 H2 SOL 129 32.460 47.440 80.860 1.00 0.00 ATOM 16004 OH2 SOL 130 59.850 38.050 78.190 1.00 0.00 ATOM 16005 H1 SOL 130 59.960 38.990 78.300 1.00 0.00 ATOM 16006 H2 SOL 130 60.420 37.650 78.840 1.00 0.00 ATOM 16007 OH2 SOL 131 4.270 58.470 79.790 1.00 0.00 ATOM 16008 H1 SOL 131 3.490 59.000 79.960 1.00 0.00 ATOM 16009 H2 SOL 131 3.950 57.730 79.270 1.00 0.00 ATOM 16010 OH2 SOL 132 40.330 24.870 20.080 1.00 0.00 ATOM 16011 H1 SOL 132 40.470 24.360 19.290 1.00 0.00 ATOM 16012 H2 SOL 132 39.720 25.560 19.820 1.00 0.00 ATOM 16013 OH2 SOL 133 44.410 44.590 6.890 1.00 0.00 ATOM 16014 H1 SOL 133 44.500 43.960 7.600 1.00 0.00 ATOM 16015 H2 SOL 133 45.180 45.160 6.970 1.00 0.00 ATOM 16016 OH2 SOL 134 1.870 47.790 23.880 1.00 0.00 ATOM 16017 H1 SOL 134 2.390 47.990 24.660 1.00 0.00 ATOM 16018 H2 SOL 134 2.510 47.560 23.210 1.00 0.00 ATOM 16019 OH2 SOL 135 45.830 7.470 17.470 1.00 0.00 ATOM 16020 H1 SOL 135 46.220 7.290 16.620 1.00 0.00 ATOM 16021 H2 SOL 135 45.310 6.690 17.670 1.00 0.00 ATOM 16022 OH2 SOL 136 37.550 53.850 5.500 1.00 0.00 ATOM 16023 H1 SOL 136 38.130 53.290 4.980 1.00 0.00 ATOM 16024 H2 SOL 136 37.840 54.740 5.290 1.00 0.00 ATOM 16025 OH2 SOL 137 37.570 35.650 64.870 1.00 0.00 ATOM 16026 H1 SOL 137 37.480 34.810 64.410 1.00 0.00 ATOM 16027 H2 SOL 137 37.090 36.270 64.330 1.00 0.00 ATOM 16028 OH2 SOL 138 26.780 32.080 14.090 1.00 0.00 ATOM 16029 H1 SOL 138 26.820 31.130 14.250 1.00 0.00 ATOM 16030 H2 SOL 138 27.560 32.420 14.530 1.00 0.00 ATOM 16031 OH2 SOL 139 2.460 2.830 77.960 1.00 0.00 ATOM 16032 H1 SOL 139 2.200 2.490 78.820 1.00 0.00 ATOM 16033 H2 SOL 139 3.060 3.550 78.160 1.00 0.00 ATOM 16034 OH2 SOL 140 50.460 45.700 17.200 1.00 0.00 ATOM 16035 H1 SOL 140 49.570 45.430 17.450 1.00 0.00 ATOM 16036 H2 SOL 140 50.350 46.140 16.360 1.00 0.00 ATOM 16037 OH2 SOL 141 23.260 55.030 10.180 1.00 0.00 ATOM 16038 H1 SOL 141 23.700 54.180 10.110 1.00 0.00 ATOM 16039 H2 SOL 141 23.890 55.590 10.640 1.00 0.00 ATOM 16040 OH2 SOL 142 33.970 3.130 9.720 1.00 0.00 ATOM 16041 H1 SOL 142 34.230 2.690 10.530 1.00 0.00 ATOM 16042 H2 SOL 142 34.780 3.200 9.210 1.00 0.00 ATOM 16043 OH2 SOL 143 11.080 34.680 73.960 1.00 0.00 ATOM 16044 H1 SOL 143 11.900 34.870 74.400 1.00 0.00 ATOM 16045 H2 SOL 143 10.400 34.920 74.590 1.00 0.00 ATOM 16046 OH2 SOL 144 18.130 26.980 18.780 1.00 0.00 ATOM 16047 H1 SOL 144 17.900 27.070 17.850 1.00 0.00 ATOM 16048 H2 SOL 144 19.030 26.660 18.770 1.00 0.00 ATOM 16049 OH2 SOL 145 16.970 12.870 82.100 1.00 0.00 ATOM 16050 H1 SOL 145 16.480 12.140 81.720 1.00 0.00 ATOM 16051 H2 SOL 145 16.420 13.640 81.940 1.00 0.00 ATOM 16052 OH2 SOL 146 12.310 49.100 17.830 1.00 0.00 ATOM 16053 H1 SOL 146 13.050 48.900 17.260 1.00 0.00 ATOM 16054 H2 SOL 146 12.380 48.480 18.560 1.00 0.00 ATOM 16055 OH2 SOL 147 15.130 20.940 76.300 1.00 0.00 ATOM 16056 H1 SOL 147 14.970 20.010 76.450 1.00 0.00 ATOM 16057 H2 SOL 147 14.360 21.380 76.670 1.00 0.00 ATOM 16058 OH2 SOL 148 39.590 13.330 65.390 1.00 0.00 ATOM 16059 H1 SOL 148 40.370 13.870 65.530 1.00 0.00 ATOM 16060 H2 SOL 148 39.940 12.450 65.240 1.00 0.00 ATOM 16061 OH2 SOL 149 33.620 53.490 65.310 1.00 0.00 ATOM 16062 H1 SOL 149 33.480 53.770 64.410 1.00 0.00 ATOM 16063 H2 SOL 149 34.540 53.220 65.330 1.00 0.00 ATOM 16064 OH2 SOL 150 9.880 47.660 73.290 1.00 0.00 ATOM 16065 H1 SOL 150 9.250 48.380 73.320 1.00 0.00 ATOM 16066 H2 SOL 150 10.220 47.600 74.180 1.00 0.00 ATOM 16067 OH2 SOL 151 10.860 48.250 0.450 1.00 0.00 ATOM 16068 H1 SOL 151 10.120 47.890 -0.040 1.00 0.00 ATOM 16069 H2 SOL 151 11.360 48.750 -0.200 1.00 0.00 ATOM 16070 OH2 SOL 152 35.010 4.700 80.190 1.00 0.00 ATOM 16071 H1 SOL 152 35.200 5.260 80.950 1.00 0.00 ATOM 16072 H2 SOL 152 34.080 4.500 80.270 1.00 0.00 ATOM 16073 OH2 SOL 153 41.040 13.060 6.530 1.00 0.00 ATOM 16074 H1 SOL 153 41.720 13.670 6.820 1.00 0.00 ATOM 16075 H2 SOL 153 40.700 12.690 7.350 1.00 0.00 ATOM 16076 OH2 SOL 154 12.870 7.170 10.720 1.00 0.00 ATOM 16077 H1 SOL 154 12.250 7.890 10.590 1.00 0.00 ATOM 16078 H2 SOL 154 13.280 7.360 11.570 1.00 0.00 ATOM 16079 OH2 SOL 155 23.440 53.350 73.210 1.00 0.00 ATOM 16080 H1 SOL 155 23.210 53.760 74.040 1.00 0.00 ATOM 16081 H2 SOL 155 22.700 52.790 73.010 1.00 0.00 ATOM 16082 OH2 SOL 156 4.090 28.510 81.730 1.00 0.00 ATOM 16083 H1 SOL 156 3.480 27.770 81.700 1.00 0.00 ATOM 16084 H2 SOL 156 3.870 28.960 82.550 1.00 0.00 ATOM 16085 OH2 SOL 157 36.640 56.880 79.990 1.00 0.00 ATOM 16086 H1 SOL 157 35.790 57.210 80.290 1.00 0.00 ATOM 16087 H2 SOL 157 37.090 56.610 80.790 1.00 0.00 ATOM 16088 OH2 SOL 158 0.720 46.270 5.280 1.00 0.00 ATOM 16089 H1 SOL 158 0.740 46.480 6.210 1.00 0.00 ATOM 16090 H2 SOL 158 -0.040 46.750 4.940 1.00 0.00 ATOM 16091 OH2 SOL 159 31.880 8.530 5.750 1.00 0.00 ATOM 16092 H1 SOL 159 31.370 8.100 6.430 1.00 0.00 ATOM 16093 H2 SOL 159 32.470 7.840 5.430 1.00 0.00 ATOM 16094 OH2 SOL 160 29.180 55.260 19.040 1.00 0.00 ATOM 16095 H1 SOL 160 29.400 55.110 18.120 1.00 0.00 ATOM 16096 H2 SOL 160 30.000 55.510 19.450 1.00 0.00 ATOM 16097 OH2 SOL 161 21.430 38.690 15.220 1.00 0.00 ATOM 16098 H1 SOL 161 21.080 39.090 14.420 1.00 0.00 ATOM 16099 H2 SOL 161 21.670 37.810 14.950 1.00 0.00 ATOM 16100 OH2 SOL 162 56.040 43.120 74.530 1.00 0.00 ATOM 16101 H1 SOL 162 55.420 43.730 74.140 1.00 0.00 ATOM 16102 H2 SOL 162 55.860 42.280 74.110 1.00 0.00 ATOM 16103 OH2 SOL 163 55.460 46.240 5.220 1.00 0.00 ATOM 16104 H1 SOL 163 54.890 46.970 5.480 1.00 0.00 ATOM 16105 H2 SOL 163 56.110 46.180 5.920 1.00 0.00 ATOM 16106 OH2 SOL 164 21.090 46.990 2.000 1.00 0.00 ATOM 16107 H1 SOL 164 20.200 46.670 2.180 1.00 0.00 ATOM 16108 H2 SOL 164 21.000 47.470 1.170 1.00 0.00 ATOM 16109 OH2 SOL 165 12.610 52.090 64.860 1.00 0.00 ATOM 16110 H1 SOL 165 12.400 52.870 65.360 1.00 0.00 ATOM 16111 H2 SOL 165 11.950 51.450 65.130 1.00 0.00 ATOM 16112 OH2 SOL 166 27.940 52.600 83.250 1.00 0.00 ATOM 16113 H1 SOL 166 28.380 53.120 83.930 1.00 0.00 ATOM 16114 H2 SOL 166 27.480 53.250 82.720 1.00 0.00 ATOM 16115 OH2 SOL 167 20.460 7.540 11.900 1.00 0.00 ATOM 16116 H1 SOL 167 20.470 8.330 12.430 1.00 0.00 ATOM 16117 H2 SOL 167 20.050 7.810 11.080 1.00 0.00 ATOM 16118 OH2 SOL 168 42.260 17.100 17.600 1.00 0.00 ATOM 16119 H1 SOL 168 41.960 17.690 18.290 1.00 0.00 ATOM 16120 H2 SOL 168 41.620 16.390 17.590 1.00 0.00 ATOM 16121 OH2 SOL 169 3.630 4.780 -0.180 1.00 0.00 ATOM 16122 H1 SOL 169 4.150 5.520 0.120 1.00 0.00 ATOM 16123 H2 SOL 169 3.220 4.440 0.620 1.00 0.00 ATOM 16124 OH2 SOL 170 9.210 21.730 12.830 1.00 0.00 ATOM 16125 H1 SOL 170 8.860 22.250 12.100 1.00 0.00 ATOM 16126 H2 SOL 170 10.010 21.340 12.490 1.00 0.00 ATOM 16127 OH2 SOL 171 54.050 0.230 7.450 1.00 0.00 ATOM 16128 H1 SOL 171 54.480 0.770 6.790 1.00 0.00 ATOM 16129 H2 SOL 171 53.140 0.520 7.450 1.00 0.00 ATOM 16130 OH2 SOL 172 29.570 51.110 70.330 1.00 0.00 ATOM 16131 H1 SOL 172 29.770 51.010 69.400 1.00 0.00 ATOM 16132 H2 SOL 172 30.430 51.160 70.750 1.00 0.00 ATOM 16133 OH2 SOL 173 22.270 4.410 19.640 1.00 0.00 ATOM 16134 H1 SOL 173 23.110 4.280 20.090 1.00 0.00 ATOM 16135 H2 SOL 173 22.010 5.300 19.880 1.00 0.00 ATOM 16136 OH2 SOL 174 29.070 54.150 11.600 1.00 0.00 ATOM 16137 H1 SOL 174 28.670 53.560 12.240 1.00 0.00 ATOM 16138 H2 SOL 174 30.000 54.110 11.800 1.00 0.00 ATOM 16139 OH2 SOL 175 31.800 1.540 13.260 1.00 0.00 ATOM 16140 H1 SOL 175 32.300 1.230 12.520 1.00 0.00 ATOM 16141 H2 SOL 175 32.380 1.430 14.020 1.00 0.00 ATOM 16142 OH2 SOL 176 33.330 29.050 71.260 1.00 0.00 ATOM 16143 H1 SOL 176 32.480 29.280 71.630 1.00 0.00 ATOM 16144 H2 SOL 176 33.230 28.150 70.950 1.00 0.00 ATOM 16145 OH2 SOL 177 17.020 55.350 66.840 1.00 0.00 ATOM 16146 H1 SOL 177 16.770 55.620 65.960 1.00 0.00 ATOM 16147 H2 SOL 177 16.680 56.030 67.420 1.00 0.00 ATOM 16148 OH2 SOL 178 18.370 26.500 25.200 1.00 0.00 ATOM 16149 H1 SOL 178 18.350 26.010 26.030 1.00 0.00 ATOM 16150 H2 SOL 178 17.830 25.980 24.600 1.00 0.00 ATOM 16151 OH2 SOL 179 36.220 30.610 77.960 1.00 0.00 ATOM 16152 H1 SOL 179 36.730 31.410 78.090 1.00 0.00 ATOM 16153 H2 SOL 179 36.870 29.900 78.040 1.00 0.00 ATOM 16154 OH2 SOL 180 45.480 40.120 6.230 1.00 0.00 ATOM 16155 H1 SOL 180 44.830 39.490 5.910 1.00 0.00 ATOM 16156 H2 SOL 180 45.840 40.510 5.430 1.00 0.00 ATOM 16157 OH2 SOL 181 7.500 26.010 23.110 1.00 0.00 ATOM 16158 H1 SOL 181 6.880 25.320 23.360 1.00 0.00 ATOM 16159 H2 SOL 181 8.310 25.760 23.550 1.00 0.00 ATOM 16160 OH2 SOL 182 60.110 20.180 10.560 1.00 0.00 ATOM 16161 H1 SOL 182 60.680 20.070 9.800 1.00 0.00 ATOM 16162 H2 SOL 182 60.290 19.410 11.110 1.00 0.00 ATOM 16163 OH2 SOL 183 32.160 51.650 61.210 1.00 0.00 ATOM 16164 H1 SOL 183 33.100 51.810 61.100 1.00 0.00 ATOM 16165 H2 SOL 183 32.020 50.770 60.870 1.00 0.00 ATOM 16166 OH2 SOL 184 16.240 28.950 25.810 1.00 0.00 ATOM 16167 H1 SOL 184 15.910 29.820 26.070 1.00 0.00 ATOM 16168 H2 SOL 184 16.720 28.640 26.580 1.00 0.00 ATOM 16169 OH2 SOL 185 12.600 45.300 17.450 1.00 0.00 ATOM 16170 H1 SOL 185 12.850 45.380 18.370 1.00 0.00 ATOM 16171 H2 SOL 185 12.340 46.190 17.200 1.00 0.00 ATOM 16172 OH2 SOL 186 3.290 17.810 13.430 1.00 0.00 ATOM 16173 H1 SOL 186 4.080 18.330 13.610 1.00 0.00 ATOM 16174 H2 SOL 186 3.330 17.640 12.490 1.00 0.00 ATOM 16175 OH2 SOL 187 35.950 53.250 19.870 1.00 0.00 ATOM 16176 H1 SOL 187 35.420 53.620 20.570 1.00 0.00 ATOM 16177 H2 SOL 187 36.580 53.930 19.650 1.00 0.00 ATOM 16178 OH2 SOL 188 58.920 16.890 68.320 1.00 0.00 ATOM 16179 H1 SOL 188 58.470 17.740 68.300 1.00 0.00 ATOM 16180 H2 SOL 188 59.690 17.000 67.760 1.00 0.00 ATOM 16181 OH2 SOL 189 5.880 6.520 20.480 1.00 0.00 ATOM 16182 H1 SOL 189 6.300 7.350 20.670 1.00 0.00 ATOM 16183 H2 SOL 189 6.580 5.980 20.110 1.00 0.00 ATOM 16184 OH2 SOL 190 43.130 24.490 21.210 1.00 0.00 ATOM 16185 H1 SOL 190 42.210 24.440 20.940 1.00 0.00 ATOM 16186 H2 SOL 190 43.440 23.590 21.190 1.00 0.00 ATOM 16187 OH2 SOL 191 58.430 27.920 7.360 1.00 0.00 ATOM 16188 H1 SOL 191 58.670 27.190 7.930 1.00 0.00 ATOM 16189 H2 SOL 191 57.700 27.590 6.840 1.00 0.00 ATOM 16190 OH2 SOL 192 44.720 7.950 77.740 1.00 0.00 ATOM 16191 H1 SOL 192 44.080 7.560 78.340 1.00 0.00 ATOM 16192 H2 SOL 192 44.490 8.880 77.730 1.00 0.00 ATOM 16193 OH2 SOL 193 45.160 36.340 25.330 1.00 0.00 ATOM 16194 H1 SOL 193 45.240 37.220 25.710 1.00 0.00 ATOM 16195 H2 SOL 193 44.900 35.790 26.070 1.00 0.00 ATOM 16196 OH2 SOL 194 1.130 0.360 11.620 1.00 0.00 ATOM 16197 H1 SOL 194 1.580 0.700 10.840 1.00 0.00 ATOM 16198 H2 SOL 194 0.480 1.040 11.830 1.00 0.00 ATOM 16199 OH2 SOL 195 51.670 27.870 74.040 1.00 0.00 ATOM 16200 H1 SOL 195 52.090 28.060 73.200 1.00 0.00 ATOM 16201 H2 SOL 195 51.440 26.950 73.990 1.00 0.00 ATOM 16202 OH2 SOL 196 52.030 57.860 14.540 1.00 0.00 ATOM 16203 H1 SOL 196 52.040 58.820 14.470 1.00 0.00 ATOM 16204 H2 SOL 196 51.220 57.660 15.010 1.00 0.00 ATOM 16205 OH2 SOL 197 46.970 51.760 83.530 1.00 0.00 ATOM 16206 H1 SOL 197 46.430 51.930 82.750 1.00 0.00 ATOM 16207 H2 SOL 197 46.940 52.580 84.020 1.00 0.00 ATOM 16208 OH2 SOL 198 49.090 54.050 73.140 1.00 0.00 ATOM 16209 H1 SOL 198 49.440 53.200 73.380 1.00 0.00 ATOM 16210 H2 SOL 198 48.170 53.890 72.910 1.00 0.00 ATOM 16211 OH2 SOL 199 54.300 50.900 17.090 1.00 0.00 ATOM 16212 H1 SOL 199 54.230 51.400 17.900 1.00 0.00 ATOM 16213 H2 SOL 199 54.250 51.550 16.400 1.00 0.00 ATOM 16214 OH2 SOL 200 31.860 10.790 21.900 1.00 0.00 ATOM 16215 H1 SOL 200 31.650 11.700 22.110 1.00 0.00 ATOM 16216 H2 SOL 200 32.160 10.420 22.730 1.00 0.00 ATOM 16217 OH2 SOL 201 23.780 27.560 75.010 1.00 0.00 ATOM 16218 H1 SOL 201 24.060 27.590 74.100 1.00 0.00 ATOM 16219 H2 SOL 201 24.430 27.000 75.440 1.00 0.00 ATOM 16220 OH2 SOL 202 3.910 25.320 83.660 1.00 0.00 ATOM 16221 H1 SOL 202 3.400 25.540 82.880 1.00 0.00 ATOM 16222 H2 SOL 202 4.190 24.410 83.520 1.00 0.00 ATOM 16223 OH2 SOL 203 39.120 34.780 72.180 1.00 0.00 ATOM 16224 H1 SOL 203 38.510 34.480 72.850 1.00 0.00 ATOM 16225 H2 SOL 203 39.310 34.000 71.660 1.00 0.00 ATOM 16226 OH2 SOL 204 13.100 17.820 69.590 1.00 0.00 ATOM 16227 H1 SOL 204 13.290 17.880 68.650 1.00 0.00 ATOM 16228 H2 SOL 204 12.290 18.320 69.700 1.00 0.00 ATOM 16229 OH2 SOL 205 56.360 37.800 82.700 1.00 0.00 ATOM 16230 H1 SOL 205 56.610 38.350 83.440 1.00 0.00 ATOM 16231 H2 SOL 205 55.950 37.030 83.100 1.00 0.00 ATOM 16232 OH2 SOL 206 41.400 2.310 21.300 1.00 0.00 ATOM 16233 H1 SOL 206 41.710 3.090 21.750 1.00 0.00 ATOM 16234 H2 SOL 206 42.160 2.000 20.810 1.00 0.00 ATOM 16235 OH2 SOL 207 34.070 57.910 73.580 1.00 0.00 ATOM 16236 H1 SOL 207 33.640 57.590 72.790 1.00 0.00 ATOM 16237 H2 SOL 207 34.350 58.800 73.360 1.00 0.00 ATOM 16238 OH2 SOL 208 55.090 9.380 0.170 1.00 0.00 ATOM 16239 H1 SOL 208 54.680 9.650 -0.640 1.00 0.00 ATOM 16240 H2 SOL 208 54.550 9.760 0.860 1.00 0.00 ATOM 16241 OH2 SOL 209 32.040 25.130 69.160 1.00 0.00 ATOM 16242 H1 SOL 209 31.230 25.390 69.600 1.00 0.00 ATOM 16243 H2 SOL 209 32.030 25.600 68.320 1.00 0.00 ATOM 16244 OH2 SOL 210 56.530 58.970 2.650 1.00 0.00 ATOM 16245 H1 SOL 210 57.260 58.740 2.080 1.00 0.00 ATOM 16246 H2 SOL 210 56.310 58.160 3.110 1.00 0.00 ATOM 16247 OH2 SOL 211 45.840 49.310 7.660 1.00 0.00 ATOM 16248 H1 SOL 211 46.060 48.420 7.940 1.00 0.00 ATOM 16249 H2 SOL 211 46.680 49.720 7.470 1.00 0.00 ATOM 16250 OH2 SOL 212 27.080 23.980 75.330 1.00 0.00 ATOM 16251 H1 SOL 212 27.730 23.400 75.710 1.00 0.00 ATOM 16252 H2 SOL 212 26.400 23.390 74.980 1.00 0.00 ATOM 16253 OH2 SOL 213 7.670 15.030 1.720 1.00 0.00 ATOM 16254 H1 SOL 213 8.440 15.560 1.540 1.00 0.00 ATOM 16255 H2 SOL 213 6.930 15.610 1.530 1.00 0.00 ATOM 16256 OH2 SOL 214 54.310 37.050 74.590 1.00 0.00 ATOM 16257 H1 SOL 214 54.300 37.670 75.310 1.00 0.00 ATOM 16258 H2 SOL 214 54.900 37.450 73.940 1.00 0.00 ATOM 16259 OH2 SOL 215 46.180 17.960 76.750 1.00 0.00 ATOM 16260 H1 SOL 215 45.500 17.690 77.380 1.00 0.00 ATOM 16261 H2 SOL 215 45.700 18.460 76.090 1.00 0.00 ATOM 16262 OH2 SOL 216 25.580 47.920 65.180 1.00 0.00 ATOM 16263 H1 SOL 216 25.940 48.430 65.910 1.00 0.00 ATOM 16264 H2 SOL 216 24.760 48.370 64.950 1.00 0.00 ATOM 16265 OH2 SOL 217 14.660 15.390 3.510 1.00 0.00 ATOM 16266 H1 SOL 217 14.580 16.350 3.430 1.00 0.00 ATOM 16267 H2 SOL 217 15.570 15.250 3.760 1.00 0.00 ATOM 16268 OH2 SOL 218 31.570 1.270 73.680 1.00 0.00 ATOM 16269 H1 SOL 218 32.100 0.730 74.280 1.00 0.00 ATOM 16270 H2 SOL 218 31.210 1.950 74.240 1.00 0.00 ATOM 16271 OH2 SOL 219 10.760 4.370 18.030 1.00 0.00 ATOM 16272 H1 SOL 219 10.950 3.500 17.680 1.00 0.00 ATOM 16273 H2 SOL 219 10.550 4.220 18.950 1.00 0.00 ATOM 16274 OH2 SOL 220 49.080 19.940 21.450 1.00 0.00 ATOM 16275 H1 SOL 220 48.870 20.490 22.210 1.00 0.00 ATOM 16276 H2 SOL 220 50.020 19.780 21.520 1.00 0.00 ATOM 16277 OH2 SOL 221 46.190 25.790 65.420 1.00 0.00 ATOM 16278 H1 SOL 221 45.560 26.430 65.100 1.00 0.00 ATOM 16279 H2 SOL 221 46.370 25.220 64.660 1.00 0.00 ATOM 16280 OH2 SOL 222 27.960 3.410 81.340 1.00 0.00 ATOM 16281 H1 SOL 222 28.280 2.750 80.720 1.00 0.00 ATOM 16282 H2 SOL 222 27.410 3.990 80.800 1.00 0.00 ATOM 16283 OH2 SOL 223 24.440 56.020 83.780 1.00 0.00 ATOM 16284 H1 SOL 223 24.020 55.370 84.350 1.00 0.00 ATOM 16285 H2 SOL 223 23.780 56.700 83.670 1.00 0.00 ATOM 16286 OH2 SOL 224 12.480 56.570 8.130 1.00 0.00 ATOM 16287 H1 SOL 224 12.660 55.760 8.600 1.00 0.00 ATOM 16288 H2 SOL 224 11.620 56.850 8.460 1.00 0.00 ATOM 16289 OH2 SOL 225 53.950 11.780 2.770 1.00 0.00 ATOM 16290 H1 SOL 225 54.600 12.230 3.310 1.00 0.00 ATOM 16291 H2 SOL 225 53.730 12.410 2.090 1.00 0.00 ATOM 16292 OH2 SOL 226 41.370 2.290 3.150 1.00 0.00 ATOM 16293 H1 SOL 226 41.090 2.790 2.380 1.00 0.00 ATOM 16294 H2 SOL 226 40.630 2.340 3.760 1.00 0.00 ATOM 16295 OH2 SOL 227 55.010 18.030 60.880 1.00 0.00 ATOM 16296 H1 SOL 227 55.170 17.450 60.140 1.00 0.00 ATOM 16297 H2 SOL 227 55.810 18.550 60.960 1.00 0.00 ATOM 16298 OH2 SOL 228 42.540 23.070 3.410 1.00 0.00 ATOM 16299 H1 SOL 228 43.160 22.490 3.840 1.00 0.00 ATOM 16300 H2 SOL 228 42.020 22.500 2.850 1.00 0.00 ATOM 16301 OH2 SOL 229 37.270 47.600 6.600 1.00 0.00 ATOM 16302 H1 SOL 229 37.190 46.970 5.890 1.00 0.00 ATOM 16303 H2 SOL 229 36.500 47.450 7.150 1.00 0.00 ATOM 16304 OH2 SOL 230 20.970 15.380 20.390 1.00 0.00 ATOM 16305 H1 SOL 230 21.520 14.740 19.940 1.00 0.00 ATOM 16306 H2 SOL 230 21.440 15.550 21.210 1.00 0.00 ATOM 16307 OH2 SOL 231 26.430 43.260 9.030 1.00 0.00 ATOM 16308 H1 SOL 231 26.930 44.050 8.820 1.00 0.00 ATOM 16309 H2 SOL 231 25.950 43.050 8.230 1.00 0.00 ATOM 16310 OH2 SOL 232 42.150 23.460 59.940 1.00 0.00 ATOM 16311 H1 SOL 232 41.660 23.430 60.760 1.00 0.00 ATOM 16312 H2 SOL 232 43.070 23.490 60.210 1.00 0.00 ATOM 16313 OH2 SOL 233 24.830 49.140 8.540 1.00 0.00 ATOM 16314 H1 SOL 233 24.330 48.350 8.760 1.00 0.00 ATOM 16315 H2 SOL 233 24.160 49.780 8.310 1.00 0.00 ATOM 16316 OH2 SOL 234 14.250 18.060 4.630 1.00 0.00 ATOM 16317 H1 SOL 234 13.600 18.470 5.190 1.00 0.00 ATOM 16318 H2 SOL 234 13.760 17.800 3.840 1.00 0.00 ATOM 16319 OH2 SOL 235 3.500 34.790 22.440 1.00 0.00 ATOM 16320 H1 SOL 235 2.620 34.680 22.070 1.00 0.00 ATOM 16321 H2 SOL 235 3.400 35.470 23.100 1.00 0.00 ATOM 16322 OH2 SOL 236 38.950 42.630 62.980 1.00 0.00 ATOM 16323 H1 SOL 236 38.190 43.070 63.370 1.00 0.00 ATOM 16324 H2 SOL 236 39.280 43.240 62.330 1.00 0.00 ATOM 16325 OH2 SOL 237 13.310 26.600 68.420 1.00 0.00 ATOM 16326 H1 SOL 237 13.670 27.480 68.420 1.00 0.00 ATOM 16327 H2 SOL 237 12.570 26.640 69.030 1.00 0.00 ATOM 16328 OH2 SOL 238 10.480 18.370 82.690 1.00 0.00 ATOM 16329 H1 SOL 238 10.950 17.740 83.240 1.00 0.00 ATOM 16330 H2 SOL 238 10.150 17.840 81.960 1.00 0.00 ATOM 16331 OH2 SOL 239 40.660 26.240 11.780 1.00 0.00 ATOM 16332 H1 SOL 239 40.680 26.210 12.740 1.00 0.00 ATOM 16333 H2 SOL 239 39.770 25.980 11.560 1.00 0.00 ATOM 16334 OH2 SOL 240 16.230 24.060 3.520 1.00 0.00 ATOM 16335 H1 SOL 240 15.390 23.700 3.780 1.00 0.00 ATOM 16336 H2 SOL 240 16.430 23.650 2.680 1.00 0.00 ATOM 16337 OH2 SOL 241 40.330 39.150 79.720 1.00 0.00 ATOM 16338 H1 SOL 241 39.760 39.020 80.480 1.00 0.00 ATOM 16339 H2 SOL 241 40.220 38.360 79.200 1.00 0.00 ATOM 16340 OH2 SOL 242 13.970 33.500 23.960 1.00 0.00 ATOM 16341 H1 SOL 242 14.310 32.840 24.560 1.00 0.00 ATOM 16342 H2 SOL 242 13.110 33.190 23.720 1.00 0.00 ATOM 16343 OH2 SOL 243 42.460 0.430 76.580 1.00 0.00 ATOM 16344 H1 SOL 243 42.780 1.180 77.090 1.00 0.00 ATOM 16345 H2 SOL 243 42.910 0.500 75.740 1.00 0.00 ATOM 16346 OH2 SOL 244 26.980 31.740 79.780 1.00 0.00 ATOM 16347 H1 SOL 244 27.070 32.220 80.600 1.00 0.00 ATOM 16348 H2 SOL 244 26.030 31.630 79.660 1.00 0.00 ATOM 16349 OH2 SOL 245 34.370 40.840 3.650 1.00 0.00 ATOM 16350 H1 SOL 245 34.370 41.650 3.140 1.00 0.00 ATOM 16351 H2 SOL 245 34.420 41.130 4.560 1.00 0.00 ATOM 16352 OH2 SOL 246 54.110 16.480 69.620 1.00 0.00 ATOM 16353 H1 SOL 246 53.350 16.620 70.190 1.00 0.00 ATOM 16354 H2 SOL 246 54.860 16.440 70.220 1.00 0.00 ATOM 16355 OH2 SOL 247 4.590 48.850 83.360 1.00 0.00 ATOM 16356 H1 SOL 247 4.840 49.240 84.200 1.00 0.00 ATOM 16357 H2 SOL 247 3.890 49.400 83.030 1.00 0.00 ATOM 16358 OH2 SOL 248 23.840 57.330 17.300 1.00 0.00 ATOM 16359 H1 SOL 248 23.290 57.820 17.920 1.00 0.00 ATOM 16360 H2 SOL 248 24.050 57.970 16.610 1.00 0.00 ATOM 16361 OH2 SOL 249 7.150 10.860 15.640 1.00 0.00 ATOM 16362 H1 SOL 249 7.240 9.910 15.560 1.00 0.00 ATOM 16363 H2 SOL 249 6.280 11.050 15.280 1.00 0.00 ATOM 16364 OH2 SOL 250 41.130 5.480 1.290 1.00 0.00 ATOM 16365 H1 SOL 250 40.690 5.560 2.140 1.00 0.00 ATOM 16366 H2 SOL 250 41.980 5.100 1.490 1.00 0.00 ATOM 16367 OH2 SOL 251 8.390 19.740 79.170 1.00 0.00 ATOM 16368 H1 SOL 251 9.250 19.780 78.750 1.00 0.00 ATOM 16369 H2 SOL 251 8.270 18.810 79.360 1.00 0.00 ATOM 16370 OH2 SOL 252 8.420 36.410 83.140 1.00 0.00 ATOM 16371 H1 SOL 252 7.980 36.400 82.290 1.00 0.00 ATOM 16372 H2 SOL 252 8.540 35.490 83.360 1.00 0.00 ATOM 16373 OH2 SOL 253 21.050 2.470 20.790 1.00 0.00 ATOM 16374 H1 SOL 253 21.680 2.820 20.160 1.00 0.00 ATOM 16375 H2 SOL 253 21.490 2.550 21.640 1.00 0.00 ATOM 16376 OH2 SOL 254 44.100 47.550 26.870 1.00 0.00 ATOM 16377 H1 SOL 254 44.130 47.500 25.910 1.00 0.00 ATOM 16378 H2 SOL 254 44.330 46.670 27.160 1.00 0.00 ATOM 16379 OH2 SOL 255 56.010 28.970 27.040 1.00 0.00 ATOM 16380 H1 SOL 255 55.160 28.700 26.690 1.00 0.00 ATOM 16381 H2 SOL 255 56.070 28.540 27.890 1.00 0.00 ATOM 16382 OH2 SOL 256 60.470 24.540 7.850 1.00 0.00 ATOM 16383 H1 SOL 256 61.120 24.620 7.160 1.00 0.00 ATOM 16384 H2 SOL 256 60.770 25.120 8.540 1.00 0.00 ATOM 16385 OH2 SOL 257 48.350 11.360 78.090 1.00 0.00 ATOM 16386 H1 SOL 257 48.230 10.590 77.540 1.00 0.00 ATOM 16387 H2 SOL 257 48.690 12.030 77.490 1.00 0.00 ATOM 16388 OH2 SOL 258 12.180 25.150 70.530 1.00 0.00 ATOM 16389 H1 SOL 258 12.400 25.320 71.450 1.00 0.00 ATOM 16390 H2 SOL 258 11.360 25.600 70.380 1.00 0.00 ATOM 16391 OH2 SOL 259 25.850 43.720 5.410 1.00 0.00 ATOM 16392 H1 SOL 259 25.830 44.670 5.390 1.00 0.00 ATOM 16393 H2 SOL 259 25.070 43.440 4.930 1.00 0.00 ATOM 16394 OH2 SOL 260 3.600 47.720 79.150 1.00 0.00 ATOM 16395 H1 SOL 260 4.290 47.050 79.160 1.00 0.00 ATOM 16396 H2 SOL 260 2.780 47.230 79.110 1.00 0.00 ATOM 16397 OH2 SOL 261 8.250 45.810 13.630 1.00 0.00 ATOM 16398 H1 SOL 261 8.620 45.360 14.390 1.00 0.00 ATOM 16399 H2 SOL 261 8.640 45.360 12.880 1.00 0.00 ATOM 16400 OH2 SOL 262 45.890 35.390 9.020 1.00 0.00 ATOM 16401 H1 SOL 262 46.280 35.300 9.880 1.00 0.00 ATOM 16402 H2 SOL 262 45.320 36.160 9.090 1.00 0.00 ATOM 16403 OH2 SOL 263 38.470 55.720 3.320 1.00 0.00 ATOM 16404 H1 SOL 263 38.810 56.040 2.490 1.00 0.00 ATOM 16405 H2 SOL 263 39.020 56.130 3.980 1.00 0.00 ATOM 16406 OH2 SOL 264 41.220 25.630 8.600 1.00 0.00 ATOM 16407 H1 SOL 264 40.750 24.960 9.100 1.00 0.00 ATOM 16408 H2 SOL 264 40.580 26.340 8.480 1.00 0.00 ATOM 16409 OH2 SOL 265 17.370 9.140 1.220 1.00 0.00 ATOM 16410 H1 SOL 265 17.730 8.520 1.850 1.00 0.00 ATOM 16411 H2 SOL 265 17.240 9.950 1.720 1.00 0.00 ATOM 16412 OH2 SOL 266 32.860 31.930 21.590 1.00 0.00 ATOM 16413 H1 SOL 266 33.030 32.150 20.670 1.00 0.00 ATOM 16414 H2 SOL 266 33.400 32.550 22.090 1.00 0.00 ATOM 16415 OH2 SOL 267 36.780 10.400 13.430 1.00 0.00 ATOM 16416 H1 SOL 267 37.680 10.250 13.700 1.00 0.00 ATOM 16417 H2 SOL 267 36.850 10.840 12.590 1.00 0.00 ATOM 16418 OH2 SOL 268 6.670 15.000 10.010 1.00 0.00 ATOM 16419 H1 SOL 268 6.720 14.780 10.940 1.00 0.00 ATOM 16420 H2 SOL 268 7.240 15.760 9.910 1.00 0.00 ATOM 16421 OH2 SOL 269 4.800 54.180 2.400 1.00 0.00 ATOM 16422 H1 SOL 269 4.750 53.390 1.870 1.00 0.00 ATOM 16423 H2 SOL 269 5.110 53.880 3.250 1.00 0.00 ATOM 16424 OH2 SOL 270 40.840 0.450 67.570 1.00 0.00 ATOM 16425 H1 SOL 270 41.320 1.220 67.860 1.00 0.00 ATOM 16426 H2 SOL 270 41.260 0.190 66.750 1.00 0.00 ATOM 16427 OH2 SOL 271 29.790 4.300 78.630 1.00 0.00 ATOM 16428 H1 SOL 271 28.930 4.640 78.390 1.00 0.00 ATOM 16429 H2 SOL 271 29.610 3.400 78.910 1.00 0.00 ATOM 16430 OH2 SOL 272 13.740 43.200 8.770 1.00 0.00 ATOM 16431 H1 SOL 272 14.350 42.520 8.470 1.00 0.00 ATOM 16432 H2 SOL 272 13.420 43.590 7.960 1.00 0.00 ATOM 16433 OH2 SOL 273 58.500 34.360 3.150 1.00 0.00 ATOM 16434 H1 SOL 273 58.570 33.560 2.630 1.00 0.00 ATOM 16435 H2 SOL 273 59.210 34.290 3.800 1.00 0.00 ATOM 16436 OH2 SOL 274 52.750 1.380 25.170 1.00 0.00 ATOM 16437 H1 SOL 274 53.040 1.170 26.060 1.00 0.00 ATOM 16438 H2 SOL 274 52.440 0.550 24.810 1.00 0.00 ATOM 16439 OH2 SOL 275 35.770 23.630 20.520 1.00 0.00 ATOM 16440 H1 SOL 275 35.650 24.440 20.010 1.00 0.00 ATOM 16441 H2 SOL 275 36.230 23.920 21.310 1.00 0.00 ATOM 16442 OH2 SOL 276 53.040 32.380 82.540 1.00 0.00 ATOM 16443 H1 SOL 276 53.380 32.590 81.670 1.00 0.00 ATOM 16444 H2 SOL 276 53.720 31.840 82.950 1.00 0.00 ATOM 16445 OH2 SOL 277 18.150 51.090 23.120 1.00 0.00 ATOM 16446 H1 SOL 277 17.300 51.480 22.920 1.00 0.00 ATOM 16447 H2 SOL 277 18.290 50.440 22.430 1.00 0.00 ATOM 16448 OH2 SOL 278 5.830 -0.040 21.310 1.00 0.00 ATOM 16449 H1 SOL 278 5.010 -0.500 21.460 1.00 0.00 ATOM 16450 H2 SOL 278 5.580 0.880 21.230 1.00 0.00 ATOM 16451 OH2 SOL 279 25.840 57.870 72.190 1.00 0.00 ATOM 16452 H1 SOL 279 25.860 57.510 71.310 1.00 0.00 ATOM 16453 H2 SOL 279 26.010 58.800 72.080 1.00 0.00 ATOM 16454 OH2 SOL 280 25.320 48.240 80.890 1.00 0.00 ATOM 16455 H1 SOL 280 25.730 48.970 81.340 1.00 0.00 ATOM 16456 H2 SOL 280 24.780 47.820 81.560 1.00 0.00 ATOM 16457 OH2 SOL 281 43.950 21.640 63.440 1.00 0.00 ATOM 16458 H1 SOL 281 43.610 22.130 64.190 1.00 0.00 ATOM 16459 H2 SOL 281 43.810 22.220 62.690 1.00 0.00 ATOM 16460 OH2 SOL 282 55.320 50.970 11.920 1.00 0.00 ATOM 16461 H1 SOL 282 55.990 50.460 12.370 1.00 0.00 ATOM 16462 H2 SOL 282 55.330 51.820 12.350 1.00 0.00 ATOM 16463 OH2 SOL 283 37.510 56.540 77.590 1.00 0.00 ATOM 16464 H1 SOL 283 37.150 56.810 78.430 1.00 0.00 ATOM 16465 H2 SOL 283 36.890 56.880 76.940 1.00 0.00 ATOM 16466 OH2 SOL 284 29.690 24.040 67.190 1.00 0.00 ATOM 16467 H1 SOL 284 30.230 24.830 67.160 1.00 0.00 ATOM 16468 H2 SOL 284 30.310 23.330 67.330 1.00 0.00 ATOM 16469 OH2 SOL 285 20.970 4.030 78.480 1.00 0.00 ATOM 16470 H1 SOL 285 20.800 4.930 78.230 1.00 0.00 ATOM 16471 H2 SOL 285 21.910 3.930 78.400 1.00 0.00 ATOM 16472 OH2 SOL 286 38.230 50.390 11.860 1.00 0.00 ATOM 16473 H1 SOL 286 37.790 49.880 12.540 1.00 0.00 ATOM 16474 H2 SOL 286 37.750 50.170 11.060 1.00 0.00 ATOM 16475 OH2 SOL 287 58.800 10.860 74.110 1.00 0.00 ATOM 16476 H1 SOL 287 59.370 10.110 74.300 1.00 0.00 ATOM 16477 H2 SOL 287 58.860 11.410 74.890 1.00 0.00 ATOM 16478 OH2 SOL 288 7.130 54.280 83.470 1.00 0.00 ATOM 16479 H1 SOL 288 7.830 54.750 83.930 1.00 0.00 ATOM 16480 H2 SOL 288 7.210 53.380 83.770 1.00 0.00 ATOM 16481 OH2 SOL 289 3.750 28.400 72.040 1.00 0.00 ATOM 16482 H1 SOL 289 2.800 28.420 72.060 1.00 0.00 ATOM 16483 H2 SOL 289 4.020 29.240 72.410 1.00 0.00 ATOM 16484 OH2 SOL 290 51.960 4.570 13.480 1.00 0.00 ATOM 16485 H1 SOL 290 52.840 4.910 13.380 1.00 0.00 ATOM 16486 H2 SOL 290 51.490 5.240 13.970 1.00 0.00 ATOM 16487 OH2 SOL 291 35.300 46.840 8.340 1.00 0.00 ATOM 16488 H1 SOL 291 34.420 46.490 8.490 1.00 0.00 ATOM 16489 H2 SOL 291 35.890 46.120 8.570 1.00 0.00 ATOM 16490 OH2 SOL 292 24.560 27.460 1.170 1.00 0.00 ATOM 16491 H1 SOL 292 24.190 27.480 0.280 1.00 0.00 ATOM 16492 H2 SOL 292 24.950 26.590 1.240 1.00 0.00 ATOM 16493 OH2 SOL 293 48.390 25.190 70.790 1.00 0.00 ATOM 16494 H1 SOL 293 48.180 24.790 69.950 1.00 0.00 ATOM 16495 H2 SOL 293 49.190 25.690 70.630 1.00 0.00 ATOM 16496 OH2 SOL 294 49.280 40.910 5.650 1.00 0.00 ATOM 16497 H1 SOL 294 49.790 41.410 5.010 1.00 0.00 ATOM 16498 H2 SOL 294 49.480 41.320 6.490 1.00 0.00 ATOM 16499 OH2 SOL 295 38.770 32.810 83.900 1.00 0.00 ATOM 16500 H1 SOL 295 38.920 33.300 83.090 1.00 0.00 ATOM 16501 H2 SOL 295 39.530 33.020 84.450 1.00 0.00 ATOM 16502 OH2 SOL 296 39.300 16.690 3.210 1.00 0.00 ATOM 16503 H1 SOL 296 39.350 17.340 2.500 1.00 0.00 ATOM 16504 H2 SOL 296 40.180 16.680 3.590 1.00 0.00 ATOM 16505 OH2 SOL 297 4.000 4.870 79.020 1.00 0.00 ATOM 16506 H1 SOL 297 4.730 4.400 79.420 1.00 0.00 ATOM 16507 H2 SOL 297 4.130 5.780 79.280 1.00 0.00 ATOM 16508 OH2 SOL 298 52.550 7.760 81.650 1.00 0.00 ATOM 16509 H1 SOL 298 51.730 8.260 81.650 1.00 0.00 ATOM 16510 H2 SOL 298 52.670 7.510 82.570 1.00 0.00 ATOM 16511 OH2 SOL 299 9.710 28.080 76.420 1.00 0.00 ATOM 16512 H1 SOL 299 9.630 27.990 77.370 1.00 0.00 ATOM 16513 H2 SOL 299 8.800 28.120 76.110 1.00 0.00 ATOM 16514 OH2 SOL 300 2.440 32.990 19.330 1.00 0.00 ATOM 16515 H1 SOL 300 2.750 33.890 19.420 1.00 0.00 ATOM 16516 H2 SOL 300 2.280 32.690 20.220 1.00 0.00 ATOM 16517 OH2 SOL 301 33.490 17.040 19.650 1.00 0.00 ATOM 16518 H1 SOL 301 32.610 16.700 19.760 1.00 0.00 ATOM 16519 H2 SOL 301 33.490 17.450 18.790 1.00 0.00 ATOM 16520 OH2 SOL 302 56.280 18.370 72.890 1.00 0.00 ATOM 16521 H1 SOL 302 56.860 18.740 72.220 1.00 0.00 ATOM 16522 H2 SOL 302 55.980 17.540 72.520 1.00 0.00 ATOM 16523 OH2 SOL 303 11.640 6.090 74.490 1.00 0.00 ATOM 16524 H1 SOL 303 10.990 5.470 74.170 1.00 0.00 ATOM 16525 H2 SOL 303 12.110 6.380 73.710 1.00 0.00 ATOM 16526 OH2 SOL 304 19.360 57.280 65.610 1.00 0.00 ATOM 16527 H1 SOL 304 18.860 57.900 66.140 1.00 0.00 ATOM 16528 H2 SOL 304 18.730 56.920 64.990 1.00 0.00 ATOM 16529 OH2 SOL 305 40.410 30.550 2.940 1.00 0.00 ATOM 16530 H1 SOL 305 40.000 29.690 2.880 1.00 0.00 ATOM 16531 H2 SOL 305 39.950 30.990 3.650 1.00 0.00 ATOM 16532 OH2 SOL 306 39.290 11.970 8.520 1.00 0.00 ATOM 16533 H1 SOL 306 39.730 11.440 9.190 1.00 0.00 ATOM 16534 H2 SOL 306 38.690 11.360 8.090 1.00 0.00 ATOM 16535 OH2 SOL 307 40.780 52.620 68.460 1.00 0.00 ATOM 16536 H1 SOL 307 40.150 53.070 69.020 1.00 0.00 ATOM 16537 H2 SOL 307 41.350 52.150 69.070 1.00 0.00 ATOM 16538 OH2 SOL 308 45.600 57.400 10.400 1.00 0.00 ATOM 16539 H1 SOL 308 45.600 56.630 10.970 1.00 0.00 ATOM 16540 H2 SOL 308 46.430 57.840 10.580 1.00 0.00 ATOM 16541 OH2 SOL 309 46.890 12.110 7.510 1.00 0.00 ATOM 16542 H1 SOL 309 46.360 11.650 8.160 1.00 0.00 ATOM 16543 H2 SOL 309 47.680 12.380 7.980 1.00 0.00 ATOM 16544 OH2 SOL 310 20.010 15.850 4.310 1.00 0.00 ATOM 16545 H1 SOL 310 20.860 15.780 4.740 1.00 0.00 ATOM 16546 H2 SOL 310 20.060 15.250 3.570 1.00 0.00 ATOM 16547 OH2 SOL 311 29.070 42.370 80.490 1.00 0.00 ATOM 16548 H1 SOL 311 29.140 43.260 80.840 1.00 0.00 ATOM 16549 H2 SOL 311 28.780 42.490 79.590 1.00 0.00 ATOM 16550 OH2 SOL 312 59.520 50.850 22.020 1.00 0.00 ATOM 16551 H1 SOL 312 60.120 50.260 22.480 1.00 0.00 ATOM 16552 H2 SOL 312 58.830 51.040 22.650 1.00 0.00 ATOM 16553 OH2 SOL 313 18.270 41.420 10.870 1.00 0.00 ATOM 16554 H1 SOL 313 18.040 40.490 10.960 1.00 0.00 ATOM 16555 H2 SOL 313 18.000 41.810 11.700 1.00 0.00 ATOM 16556 OH2 SOL 314 18.120 56.960 14.650 1.00 0.00 ATOM 16557 H1 SOL 314 18.460 57.840 14.530 1.00 0.00 ATOM 16558 H2 SOL 314 17.960 56.900 15.600 1.00 0.00 ATOM 16559 OH2 SOL 315 38.890 58.140 69.420 1.00 0.00 ATOM 16560 H1 SOL 315 39.420 58.460 68.680 1.00 0.00 ATOM 16561 H2 SOL 315 38.170 58.750 69.480 1.00 0.00 ATOM 16562 OH2 SOL 316 29.820 15.250 66.710 1.00 0.00 ATOM 16563 H1 SOL 316 30.010 14.520 66.120 1.00 0.00 ATOM 16564 H2 SOL 316 28.880 15.170 66.900 1.00 0.00 ATOM 16565 OH2 SOL 317 55.720 37.810 67.450 1.00 0.00 ATOM 16566 H1 SOL 317 55.700 38.660 67.020 1.00 0.00 ATOM 16567 H2 SOL 317 55.160 37.250 66.910 1.00 0.00 ATOM 16568 OH2 SOL 318 45.040 52.400 81.530 1.00 0.00 ATOM 16569 H1 SOL 318 45.230 53.320 81.360 1.00 0.00 ATOM 16570 H2 SOL 318 44.460 52.140 80.820 1.00 0.00 ATOM 16571 OH2 SOL 319 41.210 0.510 12.280 1.00 0.00 ATOM 16572 H1 SOL 319 40.320 0.200 12.470 1.00 0.00 ATOM 16573 H2 SOL 319 41.530 -0.090 11.610 1.00 0.00 ATOM 16574 OH2 SOL 320 7.540 3.880 78.160 1.00 0.00 ATOM 16575 H1 SOL 320 6.890 3.530 78.770 1.00 0.00 ATOM 16576 H2 SOL 320 8.330 3.380 78.340 1.00 0.00 ATOM 16577 OH2 SOL 321 28.210 42.540 5.110 1.00 0.00 ATOM 16578 H1 SOL 321 27.430 42.940 5.480 1.00 0.00 ATOM 16579 H2 SOL 321 27.890 41.730 4.700 1.00 0.00 ATOM 16580 OH2 SOL 322 39.010 49.690 0.560 1.00 0.00 ATOM 16581 H1 SOL 322 39.490 48.900 0.320 1.00 0.00 ATOM 16582 H2 SOL 322 39.020 49.690 1.520 1.00 0.00 ATOM 16583 OH2 SOL 323 31.850 7.550 72.490 1.00 0.00 ATOM 16584 H1 SOL 323 32.040 7.480 71.550 1.00 0.00 ATOM 16585 H2 SOL 323 32.600 7.120 72.910 1.00 0.00 ATOM 16586 OH2 SOL 324 15.840 29.360 65.150 1.00 0.00 ATOM 16587 H1 SOL 324 15.540 30.200 64.800 1.00 0.00 ATOM 16588 H2 SOL 324 15.600 28.720 64.480 1.00 0.00 ATOM 16589 OH2 SOL 325 50.870 4.360 72.100 1.00 0.00 ATOM 16590 H1 SOL 325 51.490 3.690 71.810 1.00 0.00 ATOM 16591 H2 SOL 325 50.550 4.760 71.300 1.00 0.00 ATOM 16592 OH2 SOL 326 51.430 53.490 15.790 1.00 0.00 ATOM 16593 H1 SOL 326 52.040 53.050 15.190 1.00 0.00 ATOM 16594 H2 SOL 326 51.020 52.780 16.270 1.00 0.00 ATOM 16595 OH2 SOL 327 29.470 31.310 1.540 1.00 0.00 ATOM 16596 H1 SOL 327 28.660 31.060 2.000 1.00 0.00 ATOM 16597 H2 SOL 327 30.160 30.810 1.980 1.00 0.00 ATOM 16598 OH2 SOL 328 25.570 44.790 13.060 1.00 0.00 ATOM 16599 H1 SOL 328 25.270 43.990 12.640 1.00 0.00 ATOM 16600 H2 SOL 328 26.410 44.990 12.630 1.00 0.00 ATOM 16601 OH2 SOL 329 45.990 33.610 14.140 1.00 0.00 ATOM 16602 H1 SOL 329 45.760 32.770 13.730 1.00 0.00 ATOM 16603 H2 SOL 329 46.910 33.750 13.910 1.00 0.00 ATOM 16604 OH2 SOL 330 8.000 40.640 3.740 1.00 0.00 ATOM 16605 H1 SOL 330 8.570 39.870 3.670 1.00 0.00 ATOM 16606 H2 SOL 330 8.260 41.190 3.000 1.00 0.00 ATOM 16607 OH2 SOL 331 3.160 39.340 15.590 1.00 0.00 ATOM 16608 H1 SOL 331 3.440 39.440 16.490 1.00 0.00 ATOM 16609 H2 SOL 331 3.310 40.190 15.190 1.00 0.00 ATOM 16610 OH2 SOL 332 34.640 4.520 63.270 1.00 0.00 ATOM 16611 H1 SOL 332 34.380 3.940 62.560 1.00 0.00 ATOM 16612 H2 SOL 332 34.700 5.390 62.870 1.00 0.00 ATOM 16613 OH2 SOL 333 26.280 47.920 25.140 1.00 0.00 ATOM 16614 H1 SOL 333 26.390 48.860 24.980 1.00 0.00 ATOM 16615 H2 SOL 333 26.820 47.740 25.910 1.00 0.00 ATOM 16616 OH2 SOL 334 7.120 57.620 80.290 1.00 0.00 ATOM 16617 H1 SOL 334 7.050 56.770 80.720 1.00 0.00 ATOM 16618 H2 SOL 334 6.240 58.000 80.350 1.00 0.00 ATOM 16619 OH2 SOL 335 19.950 18.830 70.860 1.00 0.00 ATOM 16620 H1 SOL 335 20.420 19.000 70.050 1.00 0.00 ATOM 16621 H2 SOL 335 19.060 19.140 70.680 1.00 0.00 ATOM 16622 OH2 SOL 336 52.810 12.970 5.650 1.00 0.00 ATOM 16623 H1 SOL 336 53.290 12.220 5.990 1.00 0.00 ATOM 16624 H2 SOL 336 53.160 13.100 4.770 1.00 0.00 ATOM 16625 OH2 SOL 337 52.630 32.380 12.010 1.00 0.00 ATOM 16626 H1 SOL 337 52.340 33.160 12.470 1.00 0.00 ATOM 16627 H2 SOL 337 53.410 32.650 11.530 1.00 0.00 ATOM 16628 OH2 SOL 338 3.600 56.180 78.140 1.00 0.00 ATOM 16629 H1 SOL 338 2.650 56.160 78.030 1.00 0.00 ATOM 16630 H2 SOL 338 3.800 55.430 78.700 1.00 0.00 ATOM 16631 OH2 SOL 339 60.530 53.430 2.910 1.00 0.00 ATOM 16632 H1 SOL 339 59.890 53.110 3.550 1.00 0.00 ATOM 16633 H2 SOL 339 60.040 53.460 2.090 1.00 0.00 ATOM 16634 OH2 SOL 340 10.280 18.330 18.950 1.00 0.00 ATOM 16635 H1 SOL 340 10.590 18.530 18.070 1.00 0.00 ATOM 16636 H2 SOL 340 9.540 17.730 18.820 1.00 0.00 ATOM 16637 OH2 SOL 341 37.840 1.260 66.420 1.00 0.00 ATOM 16638 H1 SOL 341 38.690 1.700 66.540 1.00 0.00 ATOM 16639 H2 SOL 341 37.990 0.630 65.720 1.00 0.00 ATOM 16640 OH2 SOL 342 61.190 32.290 20.700 1.00 0.00 ATOM 16641 H1 SOL 342 62.120 32.330 20.500 1.00 0.00 ATOM 16642 H2 SOL 342 60.980 31.350 20.700 1.00 0.00 ATOM 16643 OH2 SOL 343 1.670 21.350 77.880 1.00 0.00 ATOM 16644 H1 SOL 343 1.350 21.580 78.750 1.00 0.00 ATOM 16645 H2 SOL 343 1.330 22.030 77.300 1.00 0.00 ATOM 16646 OH2 SOL 344 39.730 8.490 15.290 1.00 0.00 ATOM 16647 H1 SOL 344 39.100 7.910 14.860 1.00 0.00 ATOM 16648 H2 SOL 344 40.150 7.940 15.950 1.00 0.00 ATOM 16649 OH2 SOL 345 57.670 6.980 9.500 1.00 0.00 ATOM 16650 H1 SOL 345 57.570 6.290 8.840 1.00 0.00 ATOM 16651 H2 SOL 345 57.090 6.720 10.210 1.00 0.00 ATOM 16652 OH2 SOL 346 28.000 55.650 80.890 1.00 0.00 ATOM 16653 H1 SOL 346 28.950 55.750 80.830 1.00 0.00 ATOM 16654 H2 SOL 346 27.730 55.350 80.030 1.00 0.00 ATOM 16655 OH2 SOL 347 53.770 21.520 9.910 1.00 0.00 ATOM 16656 H1 SOL 347 53.500 21.940 10.730 1.00 0.00 ATOM 16657 H2 SOL 347 54.000 20.630 10.160 1.00 0.00 ATOM 16658 OH2 SOL 348 50.380 9.160 70.530 1.00 0.00 ATOM 16659 H1 SOL 348 49.860 8.400 70.250 1.00 0.00 ATOM 16660 H2 SOL 348 50.330 9.150 71.480 1.00 0.00 ATOM 16661 OH2 SOL 349 43.620 35.320 11.660 1.00 0.00 ATOM 16662 H1 SOL 349 43.620 35.740 10.800 1.00 0.00 ATOM 16663 H2 SOL 349 43.370 34.410 11.490 1.00 0.00 ATOM 16664 OH2 SOL 350 10.110 27.540 81.640 1.00 0.00 ATOM 16665 H1 SOL 350 9.910 27.290 80.740 1.00 0.00 ATOM 16666 H2 SOL 350 11.010 27.250 81.780 1.00 0.00 ATOM 16667 OH2 SOL 351 23.710 27.400 10.800 1.00 0.00 ATOM 16668 H1 SOL 351 22.840 27.560 10.430 1.00 0.00 ATOM 16669 H2 SOL 351 23.990 26.580 10.400 1.00 0.00 ATOM 16670 OH2 SOL 352 0.290 12.560 1.390 1.00 0.00 ATOM 16671 H1 SOL 352 0.960 13.100 0.960 1.00 0.00 ATOM 16672 H2 SOL 352 0.210 11.790 0.830 1.00 0.00 ATOM 16673 OH2 SOL 353 17.050 15.980 4.590 1.00 0.00 ATOM 16674 H1 SOL 353 17.760 15.400 4.880 1.00 0.00 ATOM 16675 H2 SOL 353 17.490 16.660 4.080 1.00 0.00 ATOM 16676 OH2 SOL 354 24.190 35.060 23.430 1.00 0.00 ATOM 16677 H1 SOL 354 24.730 35.490 22.770 1.00 0.00 ATOM 16678 H2 SOL 354 24.790 34.470 23.880 1.00 0.00 ATOM 16679 OH2 SOL 355 55.890 20.530 66.800 1.00 0.00 ATOM 16680 H1 SOL 355 55.180 21.050 67.170 1.00 0.00 ATOM 16681 H2 SOL 355 56.180 21.030 66.030 1.00 0.00 ATOM 16682 OH2 SOL 356 23.030 38.410 5.640 1.00 0.00 ATOM 16683 H1 SOL 356 23.600 38.000 6.280 1.00 0.00 ATOM 16684 H2 SOL 356 23.600 39.010 5.150 1.00 0.00 ATOM 16685 OH2 SOL 357 57.430 0.840 20.240 1.00 0.00 ATOM 16686 H1 SOL 357 57.450 0.020 19.750 1.00 0.00 ATOM 16687 H2 SOL 357 57.320 0.570 21.160 1.00 0.00 ATOM 16688 OH2 SOL 358 39.960 38.260 4.520 1.00 0.00 ATOM 16689 H1 SOL 358 40.820 38.660 4.410 1.00 0.00 ATOM 16690 H2 SOL 358 40.140 37.400 4.890 1.00 0.00 ATOM 16691 OH2 SOL 359 59.490 28.080 4.140 1.00 0.00 ATOM 16692 H1 SOL 359 58.550 27.910 4.140 1.00 0.00 ATOM 16693 H2 SOL 359 59.830 27.570 4.870 1.00 0.00 ATOM 16694 OH2 SOL 360 24.570 54.400 23.860 1.00 0.00 ATOM 16695 H1 SOL 360 25.140 54.470 24.630 1.00 0.00 ATOM 16696 H2 SOL 360 24.340 55.300 23.640 1.00 0.00 ATOM 16697 OH2 SOL 361 47.670 9.380 1.100 1.00 0.00 ATOM 16698 H1 SOL 361 47.520 8.460 1.300 1.00 0.00 ATOM 16699 H2 SOL 361 48.600 9.430 0.870 1.00 0.00 ATOM 16700 OH2 SOL 362 59.110 45.560 76.030 1.00 0.00 ATOM 16701 H1 SOL 362 60.020 45.590 76.330 1.00 0.00 ATOM 16702 H2 SOL 362 58.610 45.890 76.780 1.00 0.00 ATOM 16703 OH2 SOL 363 23.270 5.890 68.490 1.00 0.00 ATOM 16704 H1 SOL 363 23.760 6.020 67.680 1.00 0.00 ATOM 16705 H2 SOL 363 22.580 5.270 68.260 1.00 0.00 ATOM 16706 OH2 SOL 364 50.700 39.170 71.840 1.00 0.00 ATOM 16707 H1 SOL 364 50.430 38.930 72.720 1.00 0.00 ATOM 16708 H2 SOL 364 50.600 40.120 71.810 1.00 0.00 ATOM 16709 OH2 SOL 365 48.880 -0.010 67.140 1.00 0.00 ATOM 16710 H1 SOL 365 48.650 0.580 67.860 1.00 0.00 ATOM 16711 H2 SOL 365 49.220 0.570 66.460 1.00 0.00 ATOM 16712 OH2 SOL 366 45.190 55.210 7.180 1.00 0.00 ATOM 16713 H1 SOL 366 45.880 54.560 7.110 1.00 0.00 ATOM 16714 H2 SOL 366 44.730 54.990 7.990 1.00 0.00 ATOM 16715 OH2 SOL 367 47.580 16.620 7.550 1.00 0.00 ATOM 16716 H1 SOL 367 48.500 16.360 7.650 1.00 0.00 ATOM 16717 H2 SOL 367 47.630 17.570 7.390 1.00 0.00 ATOM 16718 OH2 SOL 368 23.550 30.080 4.710 1.00 0.00 ATOM 16719 H1 SOL 368 23.460 31.010 4.890 1.00 0.00 ATOM 16720 H2 SOL 368 24.310 30.020 4.120 1.00 0.00 ATOM 16721 OH2 SOL 369 32.450 44.220 71.300 1.00 0.00 ATOM 16722 H1 SOL 369 33.120 44.870 71.510 1.00 0.00 ATOM 16723 H2 SOL 369 32.760 43.410 71.700 1.00 0.00 ATOM 16724 OH2 SOL 370 24.530 32.290 22.220 1.00 0.00 ATOM 16725 H1 SOL 370 24.970 33.100 21.970 1.00 0.00 ATOM 16726 H2 SOL 370 25.030 31.600 21.790 1.00 0.00 ATOM 16727 OH2 SOL 371 45.450 7.020 72.940 1.00 0.00 ATOM 16728 H1 SOL 371 45.760 7.180 73.830 1.00 0.00 ATOM 16729 H2 SOL 371 46.040 6.340 72.600 1.00 0.00 ATOM 16730 OH2 SOL 372 8.010 17.490 21.390 1.00 0.00 ATOM 16731 H1 SOL 372 8.610 16.750 21.500 1.00 0.00 ATOM 16732 H2 SOL 372 7.340 17.160 20.790 1.00 0.00 ATOM 16733 OH2 SOL 373 20.800 17.480 83.750 1.00 0.00 ATOM 16734 H1 SOL 373 20.260 17.630 82.970 1.00 0.00 ATOM 16735 H2 SOL 373 20.460 18.100 84.390 1.00 0.00 ATOM 16736 OH2 SOL 374 52.510 18.990 75.230 1.00 0.00 ATOM 16737 H1 SOL 374 51.750 19.380 74.810 1.00 0.00 ATOM 16738 H2 SOL 374 52.540 19.390 76.100 1.00 0.00 ATOM 16739 OH2 SOL 375 36.960 29.560 1.850 1.00 0.00 ATOM 16740 H1 SOL 375 36.860 30.420 2.260 1.00 0.00 ATOM 16741 H2 SOL 375 37.380 29.730 1.010 1.00 0.00 ATOM 16742 OH2 SOL 376 39.290 15.630 12.150 1.00 0.00 ATOM 16743 H1 SOL 376 38.680 16.250 12.550 1.00 0.00 ATOM 16744 H2 SOL 376 39.080 15.650 11.220 1.00 0.00 ATOM 16745 OH2 SOL 377 55.970 17.030 3.090 1.00 0.00 ATOM 16746 H1 SOL 377 55.760 16.800 3.990 1.00 0.00 ATOM 16747 H2 SOL 377 56.920 16.920 3.040 1.00 0.00 ATOM 16748 OH2 SOL 378 59.150 55.460 7.350 1.00 0.00 ATOM 16749 H1 SOL 378 59.550 54.590 7.400 1.00 0.00 ATOM 16750 H2 SOL 378 59.130 55.780 8.250 1.00 0.00 ATOM 16751 OH2 SOL 379 34.700 37.610 9.490 1.00 0.00 ATOM 16752 H1 SOL 379 35.480 37.800 10.000 1.00 0.00 ATOM 16753 H2 SOL 379 34.970 36.900 8.900 1.00 0.00 ATOM 16754 OH2 SOL 380 15.230 32.920 73.140 1.00 0.00 ATOM 16755 H1 SOL 380 15.940 32.390 73.510 1.00 0.00 ATOM 16756 H2 SOL 380 14.430 32.540 73.500 1.00 0.00 ATOM 16757 OH2 SOL 381 2.940 46.790 72.120 1.00 0.00 ATOM 16758 H1 SOL 381 3.070 47.680 71.770 1.00 0.00 ATOM 16759 H2 SOL 381 3.560 46.250 71.620 1.00 0.00 ATOM 16760 OH2 SOL 382 50.030 30.370 0.490 1.00 0.00 ATOM 16761 H1 SOL 382 49.450 29.710 0.870 1.00 0.00 ATOM 16762 H2 SOL 382 50.400 30.830 1.240 1.00 0.00 ATOM 16763 OH2 SOL 383 41.850 15.440 79.310 1.00 0.00 ATOM 16764 H1 SOL 383 42.160 15.890 80.100 1.00 0.00 ATOM 16765 H2 SOL 383 41.900 14.510 79.530 1.00 0.00 ATOM 16766 OH2 SOL 384 3.930 41.770 14.760 1.00 0.00 ATOM 16767 H1 SOL 384 4.790 42.190 14.710 1.00 0.00 ATOM 16768 H2 SOL 384 3.380 42.400 15.220 1.00 0.00 ATOM 16769 OH2 SOL 385 52.670 5.860 18.650 1.00 0.00 ATOM 16770 H1 SOL 385 52.000 6.310 19.160 1.00 0.00 ATOM 16771 H2 SOL 385 53.320 6.530 18.470 1.00 0.00 ATOM 16772 OH2 SOL 386 19.480 19.740 0.870 1.00 0.00 ATOM 16773 H1 SOL 386 19.000 19.510 1.660 1.00 0.00 ATOM 16774 H2 SOL 386 18.940 20.400 0.440 1.00 0.00 ATOM 16775 OH2 SOL 387 56.590 18.410 77.320 1.00 0.00 ATOM 16776 H1 SOL 387 56.990 19.270 77.470 1.00 0.00 ATOM 16777 H2 SOL 387 57.210 17.800 77.700 1.00 0.00 ATOM 16778 OH2 SOL 388 61.230 27.650 15.690 1.00 0.00 ATOM 16779 H1 SOL 388 60.910 27.890 14.810 1.00 0.00 ATOM 16780 H2 SOL 388 61.250 28.480 16.160 1.00 0.00 ATOM 16781 OH2 SOL 389 4.340 51.570 9.490 1.00 0.00 ATOM 16782 H1 SOL 389 4.680 51.870 10.340 1.00 0.00 ATOM 16783 H2 SOL 389 5.010 50.970 9.160 1.00 0.00 ATOM 16784 OH2 SOL 390 33.580 58.320 14.290 1.00 0.00 ATOM 16785 H1 SOL 390 34.080 59.030 14.700 1.00 0.00 ATOM 16786 H2 SOL 390 33.950 58.240 13.410 1.00 0.00 ATOM 16787 OH2 SOL 391 7.630 42.670 11.210 1.00 0.00 ATOM 16788 H1 SOL 391 8.170 42.550 11.990 1.00 0.00 ATOM 16789 H2 SOL 391 8.200 42.420 10.480 1.00 0.00 ATOM 16790 OH2 SOL 392 22.470 37.790 77.670 1.00 0.00 ATOM 16791 H1 SOL 392 21.780 38.370 77.340 1.00 0.00 ATOM 16792 H2 SOL 392 22.240 37.630 78.580 1.00 0.00 ATOM 16793 OH2 SOL 393 38.050 57.750 64.760 1.00 0.00 ATOM 16794 H1 SOL 393 38.870 57.310 64.540 1.00 0.00 ATOM 16795 H2 SOL 393 37.470 57.050 65.060 1.00 0.00 ATOM 16796 OH2 SOL 394 43.780 51.120 76.960 1.00 0.00 ATOM 16797 H1 SOL 394 44.180 51.960 76.760 1.00 0.00 ATOM 16798 H2 SOL 394 44.210 50.500 76.360 1.00 0.00 ATOM 16799 OH2 SOL 395 7.590 49.420 67.720 1.00 0.00 ATOM 16800 H1 SOL 395 7.170 50.220 68.020 1.00 0.00 ATOM 16801 H2 SOL 395 8.440 49.400 68.170 1.00 0.00 ATOM 16802 OH2 SOL 396 39.410 12.560 18.120 1.00 0.00 ATOM 16803 H1 SOL 396 39.270 11.910 18.810 1.00 0.00 ATOM 16804 H2 SOL 396 39.440 12.040 17.310 1.00 0.00 ATOM 16805 OH2 SOL 397 44.520 58.690 0.960 1.00 0.00 ATOM 16806 H1 SOL 397 43.620 58.600 1.290 1.00 0.00 ATOM 16807 H2 SOL 397 44.670 57.890 0.470 1.00 0.00 ATOM 16808 OH2 SOL 398 1.850 1.320 20.810 1.00 0.00 ATOM 16809 H1 SOL 398 2.450 1.980 21.150 1.00 0.00 ATOM 16810 H2 SOL 398 2.150 0.500 21.210 1.00 0.00 ATOM 16811 OH2 SOL 399 11.840 41.150 9.260 1.00 0.00 ATOM 16812 H1 SOL 399 10.890 41.290 9.350 1.00 0.00 ATOM 16813 H2 SOL 399 12.200 42.010 9.080 1.00 0.00 ATOM 16814 OH2 SOL 400 17.810 57.030 8.840 1.00 0.00 ATOM 16815 H1 SOL 400 17.290 57.440 9.540 1.00 0.00 ATOM 16816 H2 SOL 400 17.290 56.280 8.570 1.00 0.00 ATOM 16817 OH2 SOL 401 38.070 55.040 18.710 1.00 0.00 ATOM 16818 H1 SOL 401 38.360 54.700 19.560 1.00 0.00 ATOM 16819 H2 SOL 401 38.870 55.280 18.260 1.00 0.00 ATOM 16820 OH2 SOL 402 54.950 34.890 17.440 1.00 0.00 ATOM 16821 H1 SOL 402 55.600 35.120 16.770 1.00 0.00 ATOM 16822 H2 SOL 402 54.580 35.730 17.720 1.00 0.00 ATOM 16823 OH2 SOL 403 8.270 23.990 80.190 1.00 0.00 ATOM 16824 H1 SOL 403 8.480 23.230 80.730 1.00 0.00 ATOM 16825 H2 SOL 403 7.820 24.590 80.780 1.00 0.00 ATOM 16826 OH2 SOL 404 40.020 12.980 3.970 1.00 0.00 ATOM 16827 H1 SOL 404 40.390 13.100 4.850 1.00 0.00 ATOM 16828 H2 SOL 404 40.760 13.120 3.380 1.00 0.00 ATOM 16829 OH2 SOL 405 56.590 57.150 19.130 1.00 0.00 ATOM 16830 H1 SOL 405 55.910 56.980 19.780 1.00 0.00 ATOM 16831 H2 SOL 405 56.580 56.370 18.570 1.00 0.00 ATOM 16832 OH2 SOL 406 2.730 20.030 73.280 1.00 0.00 ATOM 16833 H1 SOL 406 2.020 19.680 72.750 1.00 0.00 ATOM 16834 H2 SOL 406 2.540 19.710 74.170 1.00 0.00 ATOM 16835 OH2 SOL 407 60.440 11.760 3.600 1.00 0.00 ATOM 16836 H1 SOL 407 60.940 12.010 2.820 1.00 0.00 ATOM 16837 H2 SOL 407 61.110 11.530 4.250 1.00 0.00 ATOM 16838 OH2 SOL 408 12.470 36.460 16.930 1.00 0.00 ATOM 16839 H1 SOL 408 12.090 35.750 17.460 1.00 0.00 ATOM 16840 H2 SOL 408 12.840 37.060 17.570 1.00 0.00 ATOM 16841 OH2 SOL 409 18.650 19.940 80.910 1.00 0.00 ATOM 16842 H1 SOL 409 18.820 19.030 81.120 1.00 0.00 ATOM 16843 H2 SOL 409 19.480 20.270 80.550 1.00 0.00 ATOM 16844 OH2 SOL 410 38.180 11.950 81.480 1.00 0.00 ATOM 16845 H1 SOL 410 38.440 12.870 81.390 1.00 0.00 ATOM 16846 H2 SOL 410 37.580 11.940 82.220 1.00 0.00 ATOM 16847 OH2 SOL 411 51.450 48.820 66.090 1.00 0.00 ATOM 16848 H1 SOL 411 51.420 49.510 65.430 1.00 0.00 ATOM 16849 H2 SOL 411 50.970 48.090 65.690 1.00 0.00 ATOM 16850 OH2 SOL 412 7.340 28.440 6.780 1.00 0.00 ATOM 16851 H1 SOL 412 7.890 28.590 6.010 1.00 0.00 ATOM 16852 H2 SOL 412 6.800 29.230 6.850 1.00 0.00 ATOM 16853 OH2 SOL 413 7.260 5.230 64.950 1.00 0.00 ATOM 16854 H1 SOL 413 6.990 5.720 64.170 1.00 0.00 ATOM 16855 H2 SOL 413 7.370 4.330 64.650 1.00 0.00 ATOM 16856 OH2 SOL 414 48.470 47.440 80.590 1.00 0.00 ATOM 16857 H1 SOL 414 47.680 47.710 80.130 1.00 0.00 ATOM 16858 H2 SOL 414 48.650 48.150 81.200 1.00 0.00 ATOM 16859 OH2 SOL 415 48.490 52.210 80.470 1.00 0.00 ATOM 16860 H1 SOL 415 48.980 52.480 81.240 1.00 0.00 ATOM 16861 H2 SOL 415 48.240 51.300 80.660 1.00 0.00 ATOM 16862 OH2 SOL 416 54.950 28.250 0.740 1.00 0.00 ATOM 16863 H1 SOL 416 54.690 27.460 1.220 1.00 0.00 ATOM 16864 H2 SOL 416 54.560 28.140 -0.120 1.00 0.00 ATOM 16865 OH2 SOL 417 17.080 54.930 17.430 1.00 0.00 ATOM 16866 H1 SOL 417 17.840 54.370 17.270 1.00 0.00 ATOM 16867 H2 SOL 417 17.150 55.180 18.350 1.00 0.00 ATOM 16868 OH2 SOL 418 20.160 6.810 83.520 1.00 0.00 ATOM 16869 H1 SOL 418 21.110 6.680 83.610 1.00 0.00 ATOM 16870 H2 SOL 418 19.900 6.200 82.830 1.00 0.00 ATOM 16871 OH2 SOL 419 8.070 49.290 74.550 1.00 0.00 ATOM 16872 H1 SOL 419 7.840 50.080 74.060 1.00 0.00 ATOM 16873 H2 SOL 419 8.760 49.570 75.160 1.00 0.00 ATOM 16874 OH2 SOL 420 56.860 42.620 79.900 1.00 0.00 ATOM 16875 H1 SOL 420 56.930 43.560 79.730 1.00 0.00 ATOM 16876 H2 SOL 420 56.970 42.220 79.040 1.00 0.00 ATOM 16877 OH2 SOL 421 47.940 40.970 0.820 1.00 0.00 ATOM 16878 H1 SOL 421 48.120 41.910 0.750 1.00 0.00 ATOM 16879 H2 SOL 421 48.690 40.620 1.300 1.00 0.00 ATOM 16880 OH2 SOL 422 14.480 32.120 13.220 1.00 0.00 ATOM 16881 H1 SOL 422 14.080 32.690 12.570 1.00 0.00 ATOM 16882 H2 SOL 422 14.140 32.440 14.060 1.00 0.00 ATOM 16883 OH2 SOL 423 39.950 11.100 15.830 1.00 0.00 ATOM 16884 H1 SOL 423 40.160 10.190 15.590 1.00 0.00 ATOM 16885 H2 SOL 423 39.750 11.520 14.990 1.00 0.00 ATOM 16886 OH2 SOL 424 59.630 36.970 10.470 1.00 0.00 ATOM 16887 H1 SOL 424 59.990 37.130 9.600 1.00 0.00 ATOM 16888 H2 SOL 424 60.400 36.930 11.040 1.00 0.00 ATOM 16889 OH2 SOL 425 7.000 0.370 64.700 1.00 0.00 ATOM 16890 H1 SOL 425 7.550 0.730 64.010 1.00 0.00 ATOM 16891 H2 SOL 425 6.100 0.500 64.380 1.00 0.00 ATOM 16892 OH2 SOL 426 51.000 47.200 7.600 1.00 0.00 ATOM 16893 H1 SOL 426 51.210 46.710 6.800 1.00 0.00 ATOM 16894 H2 SOL 426 50.340 46.670 8.050 1.00 0.00 ATOM 16895 OH2 SOL 427 44.410 57.550 18.510 1.00 0.00 ATOM 16896 H1 SOL 427 44.720 56.750 18.940 1.00 0.00 ATOM 16897 H2 SOL 427 44.710 57.470 17.610 1.00 0.00 ATOM 16898 OH2 SOL 428 5.670 44.840 14.560 1.00 0.00 ATOM 16899 H1 SOL 428 5.810 43.990 14.130 1.00 0.00 ATOM 16900 H2 SOL 428 6.470 45.330 14.400 1.00 0.00 ATOM 16901 OH2 SOL 429 34.620 25.830 13.150 1.00 0.00 ATOM 16902 H1 SOL 429 34.350 25.050 13.640 1.00 0.00 ATOM 16903 H2 SOL 429 34.870 26.460 13.830 1.00 0.00 ATOM 16904 OH2 SOL 430 23.390 23.670 79.850 1.00 0.00 ATOM 16905 H1 SOL 430 22.700 23.120 80.230 1.00 0.00 ATOM 16906 H2 SOL 430 24.150 23.510 80.400 1.00 0.00 ATOM 16907 OH2 SOL 431 47.670 4.880 0.280 1.00 0.00 ATOM 16908 H1 SOL 431 47.210 4.130 0.680 1.00 0.00 ATOM 16909 H2 SOL 431 46.980 5.530 0.150 1.00 0.00 ATOM 16910 OH2 SOL 432 0.220 4.550 81.600 1.00 0.00 ATOM 16911 H1 SOL 432 -0.070 3.910 80.940 1.00 0.00 ATOM 16912 H2 SOL 432 0.610 4.010 82.290 1.00 0.00 ATOM 16913 OH2 SOL 433 15.220 48.850 23.920 1.00 0.00 ATOM 16914 H1 SOL 433 16.030 49.210 24.280 1.00 0.00 ATOM 16915 H2 SOL 433 15.480 48.020 23.510 1.00 0.00 ATOM 16916 OH2 SOL 434 41.500 47.550 14.700 1.00 0.00 ATOM 16917 H1 SOL 434 41.280 47.490 15.630 1.00 0.00 ATOM 16918 H2 SOL 434 40.760 47.140 14.250 1.00 0.00 ATOM 16919 OH2 SOL 435 5.970 22.190 20.400 1.00 0.00 ATOM 16920 H1 SOL 435 6.920 22.280 20.370 1.00 0.00 ATOM 16921 H2 SOL 435 5.820 21.250 20.350 1.00 0.00 ATOM 16922 OH2 SOL 436 29.500 17.650 12.020 1.00 0.00 ATOM 16923 H1 SOL 436 28.870 18.330 11.770 1.00 0.00 ATOM 16924 H2 SOL 436 28.990 16.840 12.000 1.00 0.00 ATOM 16925 OH2 SOL 437 39.430 19.690 16.530 1.00 0.00 ATOM 16926 H1 SOL 437 38.920 20.480 16.730 1.00 0.00 ATOM 16927 H2 SOL 437 39.120 19.050 17.170 1.00 0.00 ATOM 16928 OH2 SOL 438 46.610 37.130 83.990 1.00 0.00 ATOM 16929 H1 SOL 438 47.370 37.710 84.100 1.00 0.00 ATOM 16930 H2 SOL 438 46.310 37.290 83.100 1.00 0.00 ATOM 16931 OH2 SOL 439 54.290 7.980 7.810 1.00 0.00 ATOM 16932 H1 SOL 439 53.390 8.310 7.750 1.00 0.00 ATOM 16933 H2 SOL 439 54.190 7.050 8.020 1.00 0.00 ATOM 16934 OH2 SOL 440 17.930 16.580 8.080 1.00 0.00 ATOM 16935 H1 SOL 440 18.870 16.770 8.060 1.00 0.00 ATOM 16936 H2 SOL 440 17.530 17.310 7.600 1.00 0.00 ATOM 16937 OH2 SOL 441 50.750 34.960 10.540 1.00 0.00 ATOM 16938 H1 SOL 441 49.870 34.840 10.160 1.00 0.00 ATOM 16939 H2 SOL 441 51.350 34.770 9.820 1.00 0.00 ATOM 16940 OH2 SOL 442 56.200 20.040 16.020 1.00 0.00 ATOM 16941 H1 SOL 442 56.700 20.740 16.430 1.00 0.00 ATOM 16942 H2 SOL 442 56.310 19.290 16.600 1.00 0.00 ATOM 16943 OH2 SOL 443 4.070 55.130 69.160 1.00 0.00 ATOM 16944 H1 SOL 443 3.800 56.000 69.450 1.00 0.00 ATOM 16945 H2 SOL 443 4.790 55.280 68.550 1.00 0.00 ATOM 16946 OH2 SOL 444 41.640 24.390 69.340 1.00 0.00 ATOM 16947 H1 SOL 444 41.210 24.800 68.590 1.00 0.00 ATOM 16948 H2 SOL 444 41.220 24.780 70.110 1.00 0.00 ATOM 16949 OH2 SOL 445 14.470 0.320 74.970 1.00 0.00 ATOM 16950 H1 SOL 445 14.950 0.440 74.150 1.00 0.00 ATOM 16951 H2 SOL 445 14.200 1.200 75.220 1.00 0.00 ATOM 16952 OH2 SOL 446 41.520 38.210 73.370 1.00 0.00 ATOM 16953 H1 SOL 446 41.570 37.290 73.110 1.00 0.00 ATOM 16954 H2 SOL 446 41.620 38.700 72.550 1.00 0.00 ATOM 16955 OH2 SOL 447 43.880 35.830 80.230 1.00 0.00 ATOM 16956 H1 SOL 447 44.770 35.470 80.190 1.00 0.00 ATOM 16957 H2 SOL 447 43.590 35.870 79.320 1.00 0.00 ATOM 16958 OH2 SOL 448 28.480 2.270 69.690 1.00 0.00 ATOM 16959 H1 SOL 448 29.090 1.790 70.240 1.00 0.00 ATOM 16960 H2 SOL 448 28.390 1.740 68.900 1.00 0.00 ATOM 16961 OH2 SOL 449 46.410 14.270 6.230 1.00 0.00 ATOM 16962 H1 SOL 449 46.760 14.990 6.750 1.00 0.00 ATOM 16963 H2 SOL 449 46.490 13.500 6.800 1.00 0.00 ATOM 16964 OH2 SOL 450 16.310 48.490 70.700 1.00 0.00 ATOM 16965 H1 SOL 450 16.830 48.800 69.960 1.00 0.00 ATOM 16966 H2 SOL 450 15.420 48.410 70.350 1.00 0.00 ATOM 16967 OH2 SOL 451 50.220 51.510 17.770 1.00 0.00 ATOM 16968 H1 SOL 451 50.980 51.410 18.340 1.00 0.00 ATOM 16969 H2 SOL 451 49.750 52.260 18.130 1.00 0.00 ATOM 16970 OH2 SOL 452 47.470 35.680 74.850 1.00 0.00 ATOM 16971 H1 SOL 452 47.080 34.820 75.030 1.00 0.00 ATOM 16972 H2 SOL 452 47.230 36.220 75.600 1.00 0.00 ATOM 16973 OH2 SOL 453 46.650 26.770 15.430 1.00 0.00 ATOM 16974 H1 SOL 453 46.450 25.830 15.400 1.00 0.00 ATOM 16975 H2 SOL 453 46.130 27.100 16.160 1.00 0.00 ATOM 16976 OH2 SOL 454 48.690 41.020 71.600 1.00 0.00 ATOM 16977 H1 SOL 454 47.770 40.910 71.860 1.00 0.00 ATOM 16978 H2 SOL 454 48.760 41.940 71.340 1.00 0.00 ATOM 16979 OH2 SOL 455 -0.210 21.960 64.360 1.00 0.00 ATOM 16980 H1 SOL 455 0.590 21.430 64.310 1.00 0.00 ATOM 16981 H2 SOL 455 0.060 22.740 64.830 1.00 0.00 ATOM 16982 OH2 SOL 456 20.810 7.200 74.070 1.00 0.00 ATOM 16983 H1 SOL 456 21.500 6.610 73.750 1.00 0.00 ATOM 16984 H2 SOL 456 20.960 8.020 73.600 1.00 0.00 ATOM 16985 OH2 SOL 457 54.380 50.850 78.060 1.00 0.00 ATOM 16986 H1 SOL 457 53.470 50.960 77.780 1.00 0.00 ATOM 16987 H2 SOL 457 54.330 50.760 79.010 1.00 0.00 ATOM 16988 OH2 SOL 458 14.780 11.960 74.000 1.00 0.00 ATOM 16989 H1 SOL 458 14.280 11.140 74.000 1.00 0.00 ATOM 16990 H2 SOL 458 14.290 12.540 73.420 1.00 0.00 ATOM 16991 OH2 SOL 459 48.060 6.840 2.890 1.00 0.00 ATOM 16992 H1 SOL 459 47.550 6.040 2.990 1.00 0.00 ATOM 16993 H2 SOL 459 48.970 6.570 3.050 1.00 0.00 ATOM 16994 OH2 SOL 460 5.800 58.420 3.270 1.00 0.00 ATOM 16995 H1 SOL 460 6.040 57.680 3.840 1.00 0.00 ATOM 16996 H2 SOL 460 5.870 58.060 2.380 1.00 0.00 ATOM 16997 OH2 SOL 461 52.200 11.490 82.430 1.00 0.00 ATOM 16998 H1 SOL 461 51.770 10.690 82.750 1.00 0.00 ATOM 16999 H2 SOL 461 51.480 12.070 82.190 1.00 0.00 ATOM 17000 OH2 SOL 462 25.100 43.270 72.990 1.00 0.00 ATOM 17001 H1 SOL 462 25.050 43.180 72.040 1.00 0.00 ATOM 17002 H2 SOL 462 24.240 43.620 73.240 1.00 0.00 ATOM 17003 OH2 SOL 463 53.470 11.510 9.150 1.00 0.00 ATOM 17004 H1 SOL 463 54.380 11.800 9.100 1.00 0.00 ATOM 17005 H2 SOL 463 53.260 11.520 10.080 1.00 0.00 ATOM 17006 OH2 SOL 464 2.600 30.310 83.290 1.00 0.00 ATOM 17007 H1 SOL 464 2.140 30.920 82.720 1.00 0.00 ATOM 17008 H2 SOL 464 1.920 29.740 83.650 1.00 0.00 ATOM 17009 OH2 SOL 465 1.560 44.470 74.140 1.00 0.00 ATOM 17010 H1 SOL 465 1.810 45.300 74.530 1.00 0.00 ATOM 17011 H2 SOL 465 0.790 44.680 73.610 1.00 0.00 ATOM 17012 OH2 SOL 466 43.340 49.330 5.790 1.00 0.00 ATOM 17013 H1 SOL 466 43.310 48.630 6.440 1.00 0.00 ATOM 17014 H2 SOL 466 42.810 49.020 5.060 1.00 0.00 ATOM 17015 OH2 SOL 467 52.410 42.930 21.220 1.00 0.00 ATOM 17016 H1 SOL 467 51.740 43.270 20.630 1.00 0.00 ATOM 17017 H2 SOL 467 51.950 42.300 21.760 1.00 0.00 ATOM 17018 OH2 SOL 468 45.690 20.060 7.450 1.00 0.00 ATOM 17019 H1 SOL 468 45.920 19.510 6.700 1.00 0.00 ATOM 17020 H2 SOL 468 45.320 19.460 8.090 1.00 0.00 ATOM 17021 OH2 SOL 469 21.340 45.960 79.680 1.00 0.00 ATOM 17022 H1 SOL 469 21.680 46.690 79.160 1.00 0.00 ATOM 17023 H2 SOL 469 22.080 45.350 79.750 1.00 0.00 ATOM 17024 OH2 SOL 470 6.540 34.070 74.410 1.00 0.00 ATOM 17025 H1 SOL 470 6.560 35.010 74.580 1.00 0.00 ATOM 17026 H2 SOL 470 5.680 33.790 74.720 1.00 0.00 ATOM 17027 OH2 SOL 471 26.980 9.490 22.430 1.00 0.00 ATOM 17028 H1 SOL 471 26.060 9.540 22.700 1.00 0.00 ATOM 17029 H2 SOL 471 27.230 10.410 22.280 1.00 0.00 ATOM 17030 OH2 SOL 472 61.150 53.050 16.040 1.00 0.00 ATOM 17031 H1 SOL 472 60.310 53.270 16.430 1.00 0.00 ATOM 17032 H2 SOL 472 61.800 53.440 16.620 1.00 0.00 ATOM 17033 OH2 SOL 473 4.710 5.370 8.820 1.00 0.00 ATOM 17034 H1 SOL 473 4.840 4.450 8.580 1.00 0.00 ATOM 17035 H2 SOL 473 3.770 5.510 8.710 1.00 0.00 ATOM 17036 OH2 SOL 474 60.830 42.530 70.120 1.00 0.00 ATOM 17037 H1 SOL 474 59.980 42.560 69.680 1.00 0.00 ATOM 17038 H2 SOL 474 61.450 42.330 69.420 1.00 0.00 ATOM 17039 OH2 SOL 475 36.020 52.810 17.150 1.00 0.00 ATOM 17040 H1 SOL 475 35.180 52.640 16.730 1.00 0.00 ATOM 17041 H2 SOL 475 35.860 52.680 18.080 1.00 0.00 ATOM 17042 OH2 SOL 476 59.530 7.730 75.310 1.00 0.00 ATOM 17043 H1 SOL 476 60.180 8.130 75.890 1.00 0.00 ATOM 17044 H2 SOL 476 58.880 7.350 75.900 1.00 0.00 ATOM 17045 OH2 SOL 477 4.310 42.630 71.080 1.00 0.00 ATOM 17046 H1 SOL 477 4.740 41.820 71.350 1.00 0.00 ATOM 17047 H2 SOL 477 4.220 42.560 70.130 1.00 0.00 ATOM 17048 OH2 SOL 478 23.350 39.760 0.770 1.00 0.00 ATOM 17049 H1 SOL 478 24.190 39.430 1.090 1.00 0.00 ATOM 17050 H2 SOL 478 22.960 39.030 0.310 1.00 0.00 ATOM 17051 OH2 SOL 479 14.440 36.670 81.800 1.00 0.00 ATOM 17052 H1 SOL 479 15.340 36.980 81.730 1.00 0.00 ATOM 17053 H2 SOL 479 14.470 35.980 82.470 1.00 0.00 ATOM 17054 OH2 SOL 480 21.470 34.220 77.110 1.00 0.00 ATOM 17055 H1 SOL 480 22.190 34.150 77.740 1.00 0.00 ATOM 17056 H2 SOL 480 20.850 34.830 77.530 1.00 0.00 ATOM 17057 OH2 SOL 481 46.190 53.560 72.580 1.00 0.00 ATOM 17058 H1 SOL 481 45.480 52.930 72.690 1.00 0.00 ATOM 17059 H2 SOL 481 45.830 54.390 72.910 1.00 0.00 ATOM 17060 OH2 SOL 482 5.080 1.310 25.300 1.00 0.00 ATOM 17061 H1 SOL 482 5.230 0.370 25.190 1.00 0.00 ATOM 17062 H2 SOL 482 5.890 1.630 25.710 1.00 0.00 ATOM 17063 OH2 SOL 483 31.820 33.820 71.970 1.00 0.00 ATOM 17064 H1 SOL 483 32.230 34.660 71.780 1.00 0.00 ATOM 17065 H2 SOL 483 30.890 34.020 72.060 1.00 0.00 ATOM 17066 OH2 SOL 484 32.500 18.330 73.650 1.00 0.00 ATOM 17067 H1 SOL 484 32.360 18.420 72.710 1.00 0.00 ATOM 17068 H2 SOL 484 32.560 19.230 73.970 1.00 0.00 ATOM 17069 OH2 SOL 485 18.210 -0.180 2.790 1.00 0.00 ATOM 17070 H1 SOL 485 17.350 0.220 2.940 1.00 0.00 ATOM 17071 H2 SOL 485 18.840 0.500 3.010 1.00 0.00 ATOM 17072 OH2 SOL 486 15.960 9.670 66.400 1.00 0.00 ATOM 17073 H1 SOL 486 15.640 10.380 65.840 1.00 0.00 ATOM 17074 H2 SOL 486 16.560 9.180 65.840 1.00 0.00 ATOM 17075 OH2 SOL 487 4.300 25.120 72.330 1.00 0.00 ATOM 17076 H1 SOL 487 5.190 24.780 72.290 1.00 0.00 ATOM 17077 H2 SOL 487 4.360 25.890 72.900 1.00 0.00 ATOM 17078 OH2 SOL 488 4.160 29.350 6.840 1.00 0.00 ATOM 17079 H1 SOL 488 4.140 30.120 6.270 1.00 0.00 ATOM 17080 H2 SOL 488 3.300 29.350 7.270 1.00 0.00 ATOM 17081 OH2 SOL 489 23.720 3.220 79.450 1.00 0.00 ATOM 17082 H1 SOL 489 24.240 3.340 78.650 1.00 0.00 ATOM 17083 H2 SOL 489 24.210 2.580 79.960 1.00 0.00 ATOM 17084 OH2 SOL 490 27.860 12.860 73.190 1.00 0.00 ATOM 17085 H1 SOL 490 28.010 13.280 74.040 1.00 0.00 ATOM 17086 H2 SOL 490 26.940 13.010 73.000 1.00 0.00 ATOM 17087 OH2 SOL 491 5.910 18.770 9.120 1.00 0.00 ATOM 17088 H1 SOL 491 6.830 18.830 8.870 1.00 0.00 ATOM 17089 H2 SOL 491 5.560 18.080 8.570 1.00 0.00 ATOM 17090 OH2 SOL 492 32.020 56.520 16.300 1.00 0.00 ATOM 17091 H1 SOL 492 32.150 57.050 15.510 1.00 0.00 ATOM 17092 H2 SOL 492 32.530 56.970 16.980 1.00 0.00 ATOM 17093 OH2 SOL 493 18.640 12.260 68.480 1.00 0.00 ATOM 17094 H1 SOL 493 18.670 12.850 67.730 1.00 0.00 ATOM 17095 H2 SOL 493 19.550 12.150 68.730 1.00 0.00 ATOM 17096 OH2 SOL 494 45.490 14.880 22.490 1.00 0.00 ATOM 17097 H1 SOL 494 45.770 15.740 22.800 1.00 0.00 ATOM 17098 H2 SOL 494 44.630 15.040 22.100 1.00 0.00 ATOM 17099 OH2 SOL 495 8.830 12.800 16.690 1.00 0.00 ATOM 17100 H1 SOL 495 7.890 12.870 16.840 1.00 0.00 ATOM 17101 H2 SOL 495 8.940 12.010 16.160 1.00 0.00 ATOM 17102 OH2 SOL 496 47.330 10.930 17.060 1.00 0.00 ATOM 17103 H1 SOL 496 47.940 11.670 17.100 1.00 0.00 ATOM 17104 H2 SOL 496 46.620 11.180 17.660 1.00 0.00 ATOM 17105 OH2 SOL 497 49.760 28.470 77.870 1.00 0.00 ATOM 17106 H1 SOL 497 50.000 28.970 78.650 1.00 0.00 ATOM 17107 H2 SOL 497 50.500 27.880 77.720 1.00 0.00 ATOM 17108 OH2 SOL 498 16.690 28.080 1.360 1.00 0.00 ATOM 17109 H1 SOL 498 17.320 28.040 0.630 1.00 0.00 ATOM 17110 H2 SOL 498 16.490 29.010 1.440 1.00 0.00 ATOM 17111 OH2 SOL 499 58.950 4.270 82.890 1.00 0.00 ATOM 17112 H1 SOL 499 58.300 4.970 82.800 1.00 0.00 ATOM 17113 H2 SOL 499 59.740 4.720 83.190 1.00 0.00 ATOM 17114 OH2 SOL 500 36.770 0.060 18.730 1.00 0.00 ATOM 17115 H1 SOL 500 37.030 -0.300 19.580 1.00 0.00 ATOM 17116 H2 SOL 500 36.340 0.890 18.940 1.00 0.00 ATOM 17117 OH2 SOL 501 0.530 46.300 66.470 1.00 0.00 ATOM 17118 H1 SOL 501 1.050 45.580 66.110 1.00 0.00 ATOM 17119 H2 SOL 501 0.400 46.890 65.720 1.00 0.00 ATOM 17120 OH2 SOL 502 56.710 15.160 0.710 1.00 0.00 ATOM 17121 H1 SOL 502 56.470 15.040 1.620 1.00 0.00 ATOM 17122 H2 SOL 502 57.670 15.140 0.710 1.00 0.00 ATOM 17123 OH2 SOL 503 9.580 10.990 78.870 1.00 0.00 ATOM 17124 H1 SOL 503 9.180 10.820 79.720 1.00 0.00 ATOM 17125 H2 SOL 503 9.050 11.700 78.500 1.00 0.00 ATOM 17126 OH2 SOL 504 11.680 25.950 15.240 1.00 0.00 ATOM 17127 H1 SOL 504 11.130 26.720 15.380 1.00 0.00 ATOM 17128 H2 SOL 504 11.830 25.930 14.290 1.00 0.00 ATOM 17129 OH2 SOL 505 20.220 6.250 60.450 1.00 0.00 ATOM 17130 H1 SOL 505 21.120 5.910 60.450 1.00 0.00 ATOM 17131 H2 SOL 505 20.230 6.940 59.800 1.00 0.00 ATOM 17132 OH2 SOL 506 60.200 8.150 67.730 1.00 0.00 ATOM 17133 H1 SOL 506 60.480 7.750 66.910 1.00 0.00 ATOM 17134 H2 SOL 506 59.440 8.680 67.490 1.00 0.00 ATOM 17135 OH2 SOL 507 36.360 56.730 10.110 1.00 0.00 ATOM 17136 H1 SOL 507 36.110 55.810 10.030 1.00 0.00 ATOM 17137 H2 SOL 507 36.830 56.930 9.300 1.00 0.00 ATOM 17138 OH2 SOL 508 26.380 24.970 15.240 1.00 0.00 ATOM 17139 H1 SOL 508 26.600 25.080 16.170 1.00 0.00 ATOM 17140 H2 SOL 508 26.960 25.580 14.780 1.00 0.00 ATOM 17141 OH2 SOL 509 44.640 7.520 9.090 1.00 0.00 ATOM 17142 H1 SOL 509 45.330 7.350 9.730 1.00 0.00 ATOM 17143 H2 SOL 509 45.090 7.510 8.250 1.00 0.00 ATOM 17144 OH2 SOL 510 8.940 37.850 70.160 1.00 0.00 ATOM 17145 H1 SOL 510 8.150 38.360 70.310 1.00 0.00 ATOM 17146 H2 SOL 510 9.070 37.360 70.970 1.00 0.00 ATOM 17147 OH2 SOL 511 26.100 33.320 72.380 1.00 0.00 ATOM 17148 H1 SOL 511 25.480 33.870 72.850 1.00 0.00 ATOM 17149 H2 SOL 511 25.810 33.340 71.470 1.00 0.00 ATOM 17150 OH2 SOL 512 47.040 14.530 71.470 1.00 0.00 ATOM 17151 H1 SOL 512 46.720 15.350 71.860 1.00 0.00 ATOM 17152 H2 SOL 512 47.970 14.500 71.710 1.00 0.00 ATOM 17153 OH2 SOL 513 2.660 14.980 10.950 1.00 0.00 ATOM 17154 H1 SOL 513 3.220 14.730 10.220 1.00 0.00 ATOM 17155 H2 SOL 513 3.100 14.630 11.720 1.00 0.00 ATOM 17156 OH2 SOL 514 20.450 23.750 25.130 1.00 0.00 ATOM 17157 H1 SOL 514 20.270 24.050 24.240 1.00 0.00 ATOM 17158 H2 SOL 514 19.590 23.640 25.530 1.00 0.00 ATOM 17159 OH2 SOL 515 22.940 4.020 14.980 1.00 0.00 ATOM 17160 H1 SOL 515 22.640 3.970 15.890 1.00 0.00 ATOM 17161 H2 SOL 515 23.880 4.180 15.050 1.00 0.00 ATOM 17162 OH2 SOL 516 39.290 21.280 67.300 1.00 0.00 ATOM 17163 H1 SOL 516 39.300 20.340 67.130 1.00 0.00 ATOM 17164 H2 SOL 516 38.970 21.360 68.200 1.00 0.00 ATOM 17165 OH2 SOL 517 21.360 35.180 71.380 1.00 0.00 ATOM 17166 H1 SOL 517 21.300 34.430 71.970 1.00 0.00 ATOM 17167 H2 SOL 517 22.270 35.180 71.080 1.00 0.00 ATOM 17168 OH2 SOL 518 4.990 19.220 19.270 1.00 0.00 ATOM 17169 H1 SOL 518 4.890 18.910 20.170 1.00 0.00 ATOM 17170 H2 SOL 518 5.540 18.560 18.850 1.00 0.00 ATOM 17171 OH2 SOL 519 1.620 11.910 61.380 1.00 0.00 ATOM 17172 H1 SOL 519 1.250 12.670 61.820 1.00 0.00 ATOM 17173 H2 SOL 519 1.270 11.160 61.860 1.00 0.00 ATOM 17174 OH2 SOL 520 13.470 52.840 22.750 1.00 0.00 ATOM 17175 H1 SOL 520 12.880 53.110 22.050 1.00 0.00 ATOM 17176 H2 SOL 520 13.170 51.960 22.990 1.00 0.00 ATOM 17177 OH2 SOL 521 37.760 6.340 72.440 1.00 0.00 ATOM 17178 H1 SOL 521 38.510 6.590 72.990 1.00 0.00 ATOM 17179 H2 SOL 521 37.120 5.990 73.060 1.00 0.00 ATOM 17180 OH2 SOL 522 7.540 44.770 4.270 1.00 0.00 ATOM 17181 H1 SOL 522 7.110 45.550 4.620 1.00 0.00 ATOM 17182 H2 SOL 522 7.570 44.160 5.000 1.00 0.00 ATOM 17183 OH2 SOL 523 43.360 -0.110 80.400 1.00 0.00 ATOM 17184 H1 SOL 523 42.980 0.160 81.240 1.00 0.00 ATOM 17185 H2 SOL 523 44.150 0.420 80.300 1.00 0.00 ATOM 17186 OH2 SOL 524 29.110 33.950 0.590 1.00 0.00 ATOM 17187 H1 SOL 524 29.420 33.170 1.060 1.00 0.00 ATOM 17188 H2 SOL 524 29.270 34.670 1.200 1.00 0.00 ATOM 17189 OH2 SOL 525 55.790 40.470 66.800 1.00 0.00 ATOM 17190 H1 SOL 525 54.930 40.150 66.520 1.00 0.00 ATOM 17191 H2 SOL 525 55.640 41.380 67.040 1.00 0.00 ATOM 17192 OH2 SOL 526 51.480 24.180 10.600 1.00 0.00 ATOM 17193 H1 SOL 526 50.800 24.200 9.920 1.00 0.00 ATOM 17194 H2 SOL 526 51.340 24.990 11.100 1.00 0.00 ATOM 17195 OH2 SOL 527 43.720 17.850 23.880 1.00 0.00 ATOM 17196 H1 SOL 527 44.000 17.150 24.470 1.00 0.00 ATOM 17197 H2 SOL 527 44.050 18.650 24.290 1.00 0.00 ATOM 17198 OH2 SOL 528 37.760 39.690 63.060 1.00 0.00 ATOM 17199 H1 SOL 528 38.420 40.290 63.410 1.00 0.00 ATOM 17200 H2 SOL 528 36.940 40.170 63.140 1.00 0.00 ATOM 17201 OH2 SOL 529 56.540 24.770 17.410 1.00 0.00 ATOM 17202 H1 SOL 529 57.260 24.160 17.300 1.00 0.00 ATOM 17203 H2 SOL 529 55.750 24.240 17.290 1.00 0.00 ATOM 17204 OH2 SOL 530 29.270 6.890 13.080 1.00 0.00 ATOM 17205 H1 SOL 530 29.750 7.030 12.260 1.00 0.00 ATOM 17206 H2 SOL 530 28.590 6.260 12.850 1.00 0.00 ATOM 17207 OH2 SOL 531 26.720 7.090 5.330 1.00 0.00 ATOM 17208 H1 SOL 531 26.650 7.580 4.510 1.00 0.00 ATOM 17209 H2 SOL 531 26.630 6.170 5.070 1.00 0.00 ATOM 17210 OH2 SOL 532 22.620 45.760 7.390 1.00 0.00 ATOM 17211 H1 SOL 532 21.880 46.360 7.370 1.00 0.00 ATOM 17212 H2 SOL 532 22.700 45.430 6.500 1.00 0.00 ATOM 17213 OH2 SOL 533 50.540 33.080 15.150 1.00 0.00 ATOM 17214 H1 SOL 533 50.720 32.560 14.360 1.00 0.00 ATOM 17215 H2 SOL 533 51.400 33.310 15.480 1.00 0.00 ATOM 17216 OH2 SOL 534 6.090 34.970 21.150 1.00 0.00 ATOM 17217 H1 SOL 534 5.970 35.430 20.320 1.00 0.00 ATOM 17218 H2 SOL 534 5.230 34.980 21.560 1.00 0.00 ATOM 17219 OH2 SOL 535 7.650 42.950 80.180 1.00 0.00 ATOM 17220 H1 SOL 535 8.040 43.670 80.680 1.00 0.00 ATOM 17221 H2 SOL 535 6.710 43.050 80.310 1.00 0.00 ATOM 17222 OH2 SOL 536 27.770 46.450 2.840 1.00 0.00 ATOM 17223 H1 SOL 536 27.800 45.740 2.200 1.00 0.00 ATOM 17224 H2 SOL 536 28.680 46.560 3.110 1.00 0.00 ATOM 17225 OH2 SOL 537 6.080 47.080 4.840 1.00 0.00 ATOM 17226 H1 SOL 537 5.180 46.780 4.730 1.00 0.00 ATOM 17227 H2 SOL 537 6.070 47.580 5.650 1.00 0.00 ATOM 17228 OH2 SOL 538 43.610 53.160 19.260 1.00 0.00 ATOM 17229 H1 SOL 538 44.140 53.930 19.480 1.00 0.00 ATOM 17230 H2 SOL 538 43.830 52.980 18.350 1.00 0.00 ATOM 17231 OH2 SOL 539 57.710 7.840 79.250 1.00 0.00 ATOM 17232 H1 SOL 539 57.560 8.090 80.160 1.00 0.00 ATOM 17233 H2 SOL 539 57.340 8.560 78.740 1.00 0.00 ATOM 17234 OH2 SOL 540 56.610 10.270 79.320 1.00 0.00 ATOM 17235 H1 SOL 540 56.200 10.380 80.180 1.00 0.00 ATOM 17236 H2 SOL 540 55.910 10.460 78.700 1.00 0.00 ATOM 17237 OH2 SOL 541 22.760 32.660 10.430 1.00 0.00 ATOM 17238 H1 SOL 541 22.820 31.860 10.960 1.00 0.00 ATOM 17239 H2 SOL 541 23.680 32.890 10.250 1.00 0.00 ATOM 17240 OH2 SOL 542 2.680 54.490 71.890 1.00 0.00 ATOM 17241 H1 SOL 542 3.010 54.530 70.990 1.00 0.00 ATOM 17242 H2 SOL 542 3.160 55.180 72.350 1.00 0.00 ATOM 17243 OH2 SOL 543 40.180 23.470 14.020 1.00 0.00 ATOM 17244 H1 SOL 543 40.810 22.930 13.550 1.00 0.00 ATOM 17245 H2 SOL 543 39.360 23.350 13.550 1.00 0.00 ATOM 17246 OH2 SOL 544 15.040 47.500 2.060 1.00 0.00 ATOM 17247 H1 SOL 544 14.530 48.040 2.670 1.00 0.00 ATOM 17248 H2 SOL 544 14.410 47.230 1.400 1.00 0.00 ATOM 17249 OH2 SOL 545 54.710 41.060 15.000 1.00 0.00 ATOM 17250 H1 SOL 545 55.590 40.890 14.670 1.00 0.00 ATOM 17251 H2 SOL 545 54.750 41.950 15.340 1.00 0.00 ATOM 17252 OH2 SOL 546 10.180 34.030 14.480 1.00 0.00 ATOM 17253 H1 SOL 546 9.340 33.570 14.440 1.00 0.00 ATOM 17254 H2 SOL 546 10.450 34.130 13.570 1.00 0.00 ATOM 17255 OH2 SOL 547 58.640 25.870 2.370 1.00 0.00 ATOM 17256 H1 SOL 547 58.010 25.430 1.800 1.00 0.00 ATOM 17257 H2 SOL 547 58.550 26.800 2.170 1.00 0.00 ATOM 17258 OH2 SOL 548 14.590 58.720 9.100 1.00 0.00 ATOM 17259 H1 SOL 548 14.040 58.000 8.770 1.00 0.00 ATOM 17260 H2 SOL 548 15.160 58.300 9.750 1.00 0.00 ATOM 17261 OH2 SOL 549 60.540 30.510 82.600 1.00 0.00 ATOM 17262 H1 SOL 549 61.270 30.870 82.090 1.00 0.00 ATOM 17263 H2 SOL 549 59.790 31.050 82.360 1.00 0.00 ATOM 17264 OH2 SOL 550 43.840 36.320 22.900 1.00 0.00 ATOM 17265 H1 SOL 550 43.890 37.150 22.430 1.00 0.00 ATOM 17266 H2 SOL 550 44.230 36.510 23.760 1.00 0.00 ATOM 17267 OH2 SOL 551 49.960 22.280 7.960 1.00 0.00 ATOM 17268 H1 SOL 551 50.100 23.230 7.910 1.00 0.00 ATOM 17269 H2 SOL 551 49.010 22.180 7.940 1.00 0.00 ATOM 17270 OH2 SOL 552 57.400 52.350 8.750 1.00 0.00 ATOM 17271 H1 SOL 552 57.450 52.990 9.460 1.00 0.00 ATOM 17272 H2 SOL 552 58.280 51.990 8.690 1.00 0.00 ATOM 17273 OH2 SOL 553 33.480 26.760 15.690 1.00 0.00 ATOM 17274 H1 SOL 553 33.720 26.290 16.500 1.00 0.00 ATOM 17275 H2 SOL 553 32.650 26.370 15.430 1.00 0.00 ATOM 17276 OH2 SOL 554 48.120 13.270 20.180 1.00 0.00 ATOM 17277 H1 SOL 554 47.770 13.040 21.050 1.00 0.00 ATOM 17278 H2 SOL 554 48.870 12.680 20.060 1.00 0.00 ATOM 17279 OH2 SOL 555 11.260 8.380 19.960 1.00 0.00 ATOM 17280 H1 SOL 555 11.330 8.710 20.860 1.00 0.00 ATOM 17281 H2 SOL 555 11.940 7.700 19.910 1.00 0.00 ATOM 17282 OH2 SOL 556 17.590 34.410 76.990 1.00 0.00 ATOM 17283 H1 SOL 556 17.180 34.510 77.850 1.00 0.00 ATOM 17284 H2 SOL 556 16.930 34.720 76.370 1.00 0.00 ATOM 17285 OH2 SOL 557 29.840 32.610 18.800 1.00 0.00 ATOM 17286 H1 SOL 557 29.520 33.140 18.070 1.00 0.00 ATOM 17287 H2 SOL 557 29.720 33.160 19.570 1.00 0.00 ATOM 17288 OH2 SOL 558 57.940 54.020 81.080 1.00 0.00 ATOM 17289 H1 SOL 558 58.590 54.380 81.680 1.00 0.00 ATOM 17290 H2 SOL 558 58.030 53.070 81.170 1.00 0.00 ATOM 17291 OH2 SOL 559 50.820 47.180 77.990 1.00 0.00 ATOM 17292 H1 SOL 559 50.780 46.800 78.870 1.00 0.00 ATOM 17293 H2 SOL 559 50.260 47.950 78.030 1.00 0.00 ATOM 17294 OH2 SOL 560 53.010 38.260 5.780 1.00 0.00 ATOM 17295 H1 SOL 560 53.300 38.250 6.690 1.00 0.00 ATOM 17296 H2 SOL 560 53.810 38.440 5.270 1.00 0.00 ATOM 17297 OH2 SOL 561 26.560 9.510 81.260 1.00 0.00 ATOM 17298 H1 SOL 561 27.180 9.940 80.670 1.00 0.00 ATOM 17299 H2 SOL 561 26.940 9.620 82.130 1.00 0.00 ATOM 17300 OH2 SOL 562 37.770 48.810 18.550 1.00 0.00 ATOM 17301 H1 SOL 562 37.930 49.380 17.790 1.00 0.00 ATOM 17302 H2 SOL 562 37.690 49.420 19.290 1.00 0.00 ATOM 17303 OH2 SOL 563 57.870 49.820 12.690 1.00 0.00 ATOM 17304 H1 SOL 563 58.460 50.570 12.700 1.00 0.00 ATOM 17305 H2 SOL 563 58.290 49.200 12.090 1.00 0.00 ATOM 17306 OH2 SOL 564 56.680 32.550 70.070 1.00 0.00 ATOM 17307 H1 SOL 564 56.390 33.320 69.570 1.00 0.00 ATOM 17308 H2 SOL 564 57.620 32.680 70.180 1.00 0.00 ATOM 17309 OH2 SOL 565 18.170 4.250 25.090 1.00 0.00 ATOM 17310 H1 SOL 565 17.610 4.620 25.770 1.00 0.00 ATOM 17311 H2 SOL 565 18.590 3.500 25.510 1.00 0.00 ATOM 17312 OH2 SOL 566 1.960 28.450 11.070 1.00 0.00 ATOM 17313 H1 SOL 566 1.710 29.240 10.600 1.00 0.00 ATOM 17314 H2 SOL 566 2.200 28.760 11.950 1.00 0.00 ATOM 17315 OH2 SOL 567 58.800 37.300 81.620 1.00 0.00 ATOM 17316 H1 SOL 567 59.390 38.060 81.640 1.00 0.00 ATOM 17317 H2 SOL 567 57.940 37.660 81.830 1.00 0.00 ATOM 17318 OH2 SOL 568 43.690 16.440 9.910 1.00 0.00 ATOM 17319 H1 SOL 568 43.260 16.450 10.760 1.00 0.00 ATOM 17320 H2 SOL 568 44.310 15.710 9.960 1.00 0.00 ATOM 17321 OH2 SOL 569 59.240 56.440 75.670 1.00 0.00 ATOM 17322 H1 SOL 569 59.870 56.780 75.030 1.00 0.00 ATOM 17323 H2 SOL 569 58.430 56.910 75.480 1.00 0.00 ATOM 17324 OH2 SOL 570 31.170 40.630 3.750 1.00 0.00 ATOM 17325 H1 SOL 570 30.470 40.300 3.190 1.00 0.00 ATOM 17326 H2 SOL 570 31.380 41.490 3.400 1.00 0.00 ATOM 17327 OH2 SOL 571 47.100 41.680 9.930 1.00 0.00 ATOM 17328 H1 SOL 571 46.820 41.450 10.810 1.00 0.00 ATOM 17329 H2 SOL 571 47.260 40.830 9.510 1.00 0.00 ATOM 17330 OH2 SOL 572 49.980 52.890 69.180 1.00 0.00 ATOM 17331 H1 SOL 572 49.220 52.730 69.740 1.00 0.00 ATOM 17332 H2 SOL 572 49.880 53.790 68.880 1.00 0.00 ATOM 17333 OH2 SOL 573 51.110 28.530 15.510 1.00 0.00 ATOM 17334 H1 SOL 573 50.980 29.300 16.070 1.00 0.00 ATOM 17335 H2 SOL 573 52.030 28.290 15.640 1.00 0.00 ATOM 17336 OH2 SOL 574 40.990 54.690 8.610 1.00 0.00 ATOM 17337 H1 SOL 574 41.930 54.510 8.690 1.00 0.00 ATOM 17338 H2 SOL 574 40.600 54.220 9.340 1.00 0.00 ATOM 17339 OH2 SOL 575 35.460 1.630 82.370 1.00 0.00 ATOM 17340 H1 SOL 575 36.250 1.110 82.230 1.00 0.00 ATOM 17341 H2 SOL 575 35.010 1.600 81.530 1.00 0.00 ATOM 17342 OH2 SOL 576 32.560 16.470 5.150 1.00 0.00 ATOM 17343 H1 SOL 576 32.410 17.060 4.410 1.00 0.00 ATOM 17344 H2 SOL 576 31.690 16.290 5.500 1.00 0.00 ATOM 17345 OH2 SOL 577 61.070 27.450 12.890 1.00 0.00 ATOM 17346 H1 SOL 577 61.040 27.850 12.030 1.00 0.00 ATOM 17347 H2 SOL 577 60.810 26.540 12.740 1.00 0.00 ATOM 17348 OH2 SOL 578 54.070 14.060 66.950 1.00 0.00 ATOM 17349 H1 SOL 578 54.790 13.640 67.430 1.00 0.00 ATOM 17350 H2 SOL 578 53.420 14.260 67.630 1.00 0.00 ATOM 17351 OH2 SOL 579 15.860 10.290 12.060 1.00 0.00 ATOM 17352 H1 SOL 579 15.390 10.530 11.260 1.00 0.00 ATOM 17353 H2 SOL 579 15.870 11.100 12.580 1.00 0.00 ATOM 17354 OH2 SOL 580 56.530 50.300 4.740 1.00 0.00 ATOM 17355 H1 SOL 580 56.170 49.640 4.150 1.00 0.00 ATOM 17356 H2 SOL 580 55.800 50.530 5.320 1.00 0.00 ATOM 17357 OH2 SOL 581 32.490 19.150 71.130 1.00 0.00 ATOM 17358 H1 SOL 581 31.530 19.100 71.090 1.00 0.00 ATOM 17359 H2 SOL 581 32.770 19.280 70.230 1.00 0.00 ATOM 17360 OH2 SOL 582 13.120 33.520 3.170 1.00 0.00 ATOM 17361 H1 SOL 582 13.220 32.580 3.050 1.00 0.00 ATOM 17362 H2 SOL 582 12.480 33.780 2.500 1.00 0.00 ATOM 17363 OH2 SOL 583 26.700 11.710 13.860 1.00 0.00 ATOM 17364 H1 SOL 583 27.060 11.620 14.740 1.00 0.00 ATOM 17365 H2 SOL 583 27.360 12.190 13.370 1.00 0.00 ATOM 17366 OH2 SOL 584 46.450 19.540 68.860 1.00 0.00 ATOM 17367 H1 SOL 584 46.470 18.730 68.340 1.00 0.00 ATOM 17368 H2 SOL 584 45.820 20.100 68.410 1.00 0.00 ATOM 17369 OH2 SOL 585 13.030 28.750 0.730 1.00 0.00 ATOM 17370 H1 SOL 585 13.350 28.020 0.200 1.00 0.00 ATOM 17371 H2 SOL 585 12.090 28.600 0.800 1.00 0.00 ATOM 17372 OH2 SOL 586 34.350 13.510 78.470 1.00 0.00 ATOM 17373 H1 SOL 586 34.630 13.200 79.330 1.00 0.00 ATOM 17374 H2 SOL 586 34.500 14.450 78.490 1.00 0.00 ATOM 17375 OH2 SOL 587 23.410 56.470 13.380 1.00 0.00 ATOM 17376 H1 SOL 587 23.550 56.950 12.560 1.00 0.00 ATOM 17377 H2 SOL 587 24.110 56.780 13.960 1.00 0.00 ATOM 17378 OH2 SOL 588 60.520 39.730 70.330 1.00 0.00 ATOM 17379 H1 SOL 588 59.660 39.480 70.010 1.00 0.00 ATOM 17380 H2 SOL 588 60.480 40.690 70.410 1.00 0.00 ATOM 17381 OH2 SOL 589 1.280 45.230 81.170 1.00 0.00 ATOM 17382 H1 SOL 589 2.070 45.650 81.500 1.00 0.00 ATOM 17383 H2 SOL 589 0.750 45.070 81.950 1.00 0.00 ATOM 17384 OH2 SOL 590 22.800 12.740 5.690 1.00 0.00 ATOM 17385 H1 SOL 590 22.020 12.920 6.210 1.00 0.00 ATOM 17386 H2 SOL 590 23.050 13.590 5.330 1.00 0.00 ATOM 17387 OH2 SOL 591 46.700 50.760 3.140 1.00 0.00 ATOM 17388 H1 SOL 591 46.530 50.220 3.910 1.00 0.00 ATOM 17389 H2 SOL 591 45.960 50.580 2.550 1.00 0.00 ATOM 17390 OH2 SOL 592 15.280 37.130 19.630 1.00 0.00 ATOM 17391 H1 SOL 592 14.890 36.800 20.440 1.00 0.00 ATOM 17392 H2 SOL 592 16.060 36.580 19.500 1.00 0.00 ATOM 17393 OH2 SOL 593 17.610 38.340 8.020 1.00 0.00 ATOM 17394 H1 SOL 593 17.830 37.800 7.260 1.00 0.00 ATOM 17395 H2 SOL 593 18.160 38.010 8.730 1.00 0.00 ATOM 17396 OH2 SOL 594 41.920 43.490 16.270 1.00 0.00 ATOM 17397 H1 SOL 594 41.940 43.630 17.220 1.00 0.00 ATOM 17398 H2 SOL 594 42.590 44.080 15.930 1.00 0.00 ATOM 17399 OH2 SOL 595 39.660 40.160 2.460 1.00 0.00 ATOM 17400 H1 SOL 595 39.300 39.380 2.880 1.00 0.00 ATOM 17401 H2 SOL 595 38.900 40.670 2.190 1.00 0.00 ATOM 17402 OH2 SOL 596 57.310 13.260 66.990 1.00 0.00 ATOM 17403 H1 SOL 596 57.360 13.870 67.730 1.00 0.00 ATOM 17404 H2 SOL 596 57.550 13.780 66.230 1.00 0.00 ATOM 17405 OH2 SOL 597 18.650 30.670 6.340 1.00 0.00 ATOM 17406 H1 SOL 597 18.450 29.850 5.900 1.00 0.00 ATOM 17407 H2 SOL 597 17.820 31.150 6.340 1.00 0.00 ATOM 17408 OH2 SOL 598 3.210 11.180 9.870 1.00 0.00 ATOM 17409 H1 SOL 598 3.800 11.850 9.530 1.00 0.00 ATOM 17410 H2 SOL 598 3.150 10.530 9.170 1.00 0.00 ATOM 17411 OH2 SOL 599 61.390 4.990 72.050 1.00 0.00 ATOM 17412 H1 SOL 599 60.770 4.500 72.590 1.00 0.00 ATOM 17413 H2 SOL 599 61.240 5.910 72.280 1.00 0.00 ATOM 17414 OH2 SOL 600 52.050 22.330 4.290 1.00 0.00 ATOM 17415 H1 SOL 600 52.840 22.330 3.740 1.00 0.00 ATOM 17416 H2 SOL 600 52.290 21.810 5.060 1.00 0.00 ATOM 17417 OH2 SOL 601 17.900 23.490 15.980 1.00 0.00 ATOM 17418 H1 SOL 601 17.790 23.910 16.830 1.00 0.00 ATOM 17419 H2 SOL 601 18.610 23.970 15.560 1.00 0.00 ATOM 17420 OH2 SOL 602 60.680 10.760 12.170 1.00 0.00 ATOM 17421 H1 SOL 602 61.480 11.260 12.030 1.00 0.00 ATOM 17422 H2 SOL 602 60.400 10.500 11.300 1.00 0.00 ATOM 17423 OH2 SOL 603 44.140 47.390 70.700 1.00 0.00 ATOM 17424 H1 SOL 603 44.620 47.190 71.500 1.00 0.00 ATOM 17425 H2 SOL 603 43.250 47.600 71.000 1.00 0.00 ATOM 17426 OH2 SOL 604 26.090 27.080 23.140 1.00 0.00 ATOM 17427 H1 SOL 604 25.520 27.040 23.900 1.00 0.00 ATOM 17428 H2 SOL 604 26.860 26.570 23.380 1.00 0.00 ATOM 17429 OH2 SOL 605 33.510 17.810 76.280 1.00 0.00 ATOM 17430 H1 SOL 605 33.200 17.870 75.380 1.00 0.00 ATOM 17431 H2 SOL 605 33.560 18.720 76.580 1.00 0.00 ATOM 17432 OH2 SOL 606 28.930 22.330 12.270 1.00 0.00 ATOM 17433 H1 SOL 606 28.490 21.510 12.030 1.00 0.00 ATOM 17434 H2 SOL 606 28.770 22.430 13.200 1.00 0.00 ATOM 17435 OH2 SOL 607 15.470 58.250 65.450 1.00 0.00 ATOM 17436 H1 SOL 607 15.940 58.960 65.010 1.00 0.00 ATOM 17437 H2 SOL 607 15.770 57.460 65.020 1.00 0.00 ATOM 17438 OH2 SOL 608 54.500 8.640 3.330 1.00 0.00 ATOM 17439 H1 SOL 608 53.560 8.690 3.510 1.00 0.00 ATOM 17440 H2 SOL 608 54.830 9.510 3.530 1.00 0.00 ATOM 17441 OH2 SOL 609 55.080 38.330 3.750 1.00 0.00 ATOM 17442 H1 SOL 609 55.470 37.590 3.280 1.00 0.00 ATOM 17443 H2 SOL 609 55.630 38.440 4.520 1.00 0.00 ATOM 17444 OH2 SOL 610 49.630 0.030 83.880 1.00 0.00 ATOM 17445 H1 SOL 610 49.280 0.170 83.000 1.00 0.00 ATOM 17446 H2 SOL 610 49.160 0.650 84.430 1.00 0.00 ATOM 17447 OH2 SOL 611 26.820 48.800 1.880 1.00 0.00 ATOM 17448 H1 SOL 611 27.100 48.050 2.410 1.00 0.00 ATOM 17449 H2 SOL 611 27.590 49.030 1.360 1.00 0.00 ATOM 17450 OH2 SOL 612 38.740 36.180 17.220 1.00 0.00 ATOM 17451 H1 SOL 612 39.250 36.850 17.670 1.00 0.00 ATOM 17452 H2 SOL 612 38.500 36.580 16.380 1.00 0.00 ATOM 17453 OH2 SOL 613 26.280 3.950 9.090 1.00 0.00 ATOM 17454 H1 SOL 613 26.220 4.810 8.680 1.00 0.00 ATOM 17455 H2 SOL 613 25.370 3.660 9.170 1.00 0.00 ATOM 17456 OH2 SOL 614 21.770 11.750 72.350 1.00 0.00 ATOM 17457 H1 SOL 614 21.630 12.670 72.150 1.00 0.00 ATOM 17458 H2 SOL 614 21.880 11.720 73.300 1.00 0.00 ATOM 17459 OH2 SOL 615 21.570 4.900 2.530 1.00 0.00 ATOM 17460 H1 SOL 615 20.700 4.510 2.480 1.00 0.00 ATOM 17461 H2 SOL 615 22.000 4.620 1.720 1.00 0.00 ATOM 17462 OH2 SOL 616 1.660 6.470 6.620 1.00 0.00 ATOM 17463 H1 SOL 616 2.370 7.090 6.450 1.00 0.00 ATOM 17464 H2 SOL 616 0.860 6.980 6.460 1.00 0.00 ATOM 17465 OH2 SOL 617 12.660 20.030 14.360 1.00 0.00 ATOM 17466 H1 SOL 617 13.390 19.410 14.440 1.00 0.00 ATOM 17467 H2 SOL 617 13.020 20.850 14.690 1.00 0.00 ATOM 17468 OH2 SOL 618 59.510 39.280 15.330 1.00 0.00 ATOM 17469 H1 SOL 618 59.010 39.110 16.130 1.00 0.00 ATOM 17470 H2 SOL 618 60.410 39.000 15.550 1.00 0.00 ATOM 17471 OH2 SOL 619 13.680 21.590 10.660 1.00 0.00 ATOM 17472 H1 SOL 619 13.840 20.990 9.920 1.00 0.00 ATOM 17473 H2 SOL 619 12.770 21.420 10.910 1.00 0.00 ATOM 17474 OH2 SOL 620 8.660 20.120 16.790 1.00 0.00 ATOM 17475 H1 SOL 620 8.070 19.950 16.060 1.00 0.00 ATOM 17476 H2 SOL 620 8.120 20.010 17.570 1.00 0.00 ATOM 17477 OH2 SOL 621 41.450 43.280 19.010 1.00 0.00 ATOM 17478 H1 SOL 621 42.190 42.660 19.030 1.00 0.00 ATOM 17479 H2 SOL 621 40.670 42.720 18.980 1.00 0.00 ATOM 17480 OH2 SOL 622 28.220 37.380 16.250 1.00 0.00 ATOM 17481 H1 SOL 622 29.030 37.880 16.390 1.00 0.00 ATOM 17482 H2 SOL 622 27.560 37.870 16.740 1.00 0.00 ATOM 17483 OH2 SOL 623 2.000 38.530 10.600 1.00 0.00 ATOM 17484 H1 SOL 623 2.510 39.270 10.940 1.00 0.00 ATOM 17485 H2 SOL 623 2.220 37.800 11.180 1.00 0.00 ATOM 17486 OH2 SOL 624 9.310 27.230 16.260 1.00 0.00 ATOM 17487 H1 SOL 624 9.180 27.630 15.400 1.00 0.00 ATOM 17488 H2 SOL 624 8.440 26.910 16.520 1.00 0.00 ATOM 17489 OH2 SOL 625 54.570 1.220 21.630 1.00 0.00 ATOM 17490 H1 SOL 625 55.280 0.660 21.320 1.00 0.00 ATOM 17491 H2 SOL 625 54.960 1.740 22.340 1.00 0.00 ATOM 17492 OH2 SOL 626 38.750 16.740 17.640 1.00 0.00 ATOM 17493 H1 SOL 626 38.300 17.010 16.850 1.00 0.00 ATOM 17494 H2 SOL 626 38.710 17.510 18.220 1.00 0.00 ATOM 17495 OH2 SOL 627 33.890 26.810 75.550 1.00 0.00 ATOM 17496 H1 SOL 627 34.290 26.850 76.420 1.00 0.00 ATOM 17497 H2 SOL 627 34.600 26.520 74.980 1.00 0.00 ATOM 17498 OH2 SOL 628 41.100 14.170 75.140 1.00 0.00 ATOM 17499 H1 SOL 628 40.550 14.650 74.510 1.00 0.00 ATOM 17500 H2 SOL 628 41.710 14.830 75.460 1.00 0.00 ATOM 17501 OH2 SOL 629 36.590 22.480 26.520 1.00 0.00 ATOM 17502 H1 SOL 629 37.430 22.060 26.320 1.00 0.00 ATOM 17503 H2 SOL 629 36.150 21.860 27.110 1.00 0.00 ATOM 17504 OH2 SOL 630 11.970 24.240 7.790 1.00 0.00 ATOM 17505 H1 SOL 630 11.880 24.340 8.730 1.00 0.00 ATOM 17506 H2 SOL 630 11.070 24.180 7.460 1.00 0.00 ATOM 17507 OH2 SOL 631 34.740 58.600 2.030 1.00 0.00 ATOM 17508 H1 SOL 631 34.980 57.810 1.540 1.00 0.00 ATOM 17509 H2 SOL 631 35.260 58.540 2.830 1.00 0.00 ATOM 17510 OH2 SOL 632 26.440 49.030 18.740 1.00 0.00 ATOM 17511 H1 SOL 632 27.170 49.650 18.690 1.00 0.00 ATOM 17512 H2 SOL 632 26.850 48.170 18.730 1.00 0.00 ATOM 17513 OH2 SOL 633 24.890 43.060 78.080 1.00 0.00 ATOM 17514 H1 SOL 633 25.300 43.020 77.220 1.00 0.00 ATOM 17515 H2 SOL 633 24.500 43.940 78.120 1.00 0.00 ATOM 17516 OH2 SOL 634 32.380 32.620 78.000 1.00 0.00 ATOM 17517 H1 SOL 634 31.470 32.350 77.900 1.00 0.00 ATOM 17518 H2 SOL 634 32.870 31.800 78.090 1.00 0.00 ATOM 17519 OH2 SOL 635 25.040 47.520 72.430 1.00 0.00 ATOM 17520 H1 SOL 635 25.050 48.440 72.170 1.00 0.00 ATOM 17521 H2 SOL 635 24.390 47.110 71.860 1.00 0.00 ATOM 17522 OH2 SOL 636 37.540 50.890 20.520 1.00 0.00 ATOM 17523 H1 SOL 636 36.940 51.580 20.230 1.00 0.00 ATOM 17524 H2 SOL 636 37.410 50.860 21.470 1.00 0.00 ATOM 17525 OH2 SOL 637 19.350 20.110 14.160 1.00 0.00 ATOM 17526 H1 SOL 637 19.770 19.370 13.730 1.00 0.00 ATOM 17527 H2 SOL 637 19.880 20.280 14.940 1.00 0.00 ATOM 17528 OH2 SOL 638 22.520 9.620 9.820 1.00 0.00 ATOM 17529 H1 SOL 638 22.720 9.450 8.900 1.00 0.00 ATOM 17530 H2 SOL 638 23.320 9.390 10.280 1.00 0.00 ATOM 17531 OH2 SOL 639 49.360 44.460 6.520 1.00 0.00 ATOM 17532 H1 SOL 639 48.670 44.760 5.930 1.00 0.00 ATOM 17533 H2 SOL 639 50.170 44.660 6.070 1.00 0.00 ATOM 17534 OH2 SOL 640 49.060 49.190 5.250 1.00 0.00 ATOM 17535 H1 SOL 640 48.140 49.260 4.980 1.00 0.00 ATOM 17536 H2 SOL 640 49.250 48.260 5.210 1.00 0.00 ATOM 17537 OH2 SOL 641 45.360 46.210 65.610 1.00 0.00 ATOM 17538 H1 SOL 641 44.980 47.070 65.380 1.00 0.00 ATOM 17539 H2 SOL 641 44.870 45.940 66.380 1.00 0.00 ATOM 17540 OH2 SOL 642 59.220 53.010 0.470 1.00 0.00 ATOM 17541 H1 SOL 642 59.200 53.890 0.090 1.00 0.00 ATOM 17542 H2 SOL 642 59.470 52.440 -0.260 1.00 0.00 ATOM 17543 OH2 SOL 643 59.170 17.530 76.590 1.00 0.00 ATOM 17544 H1 SOL 643 59.450 18.370 76.950 1.00 0.00 ATOM 17545 H2 SOL 643 59.030 16.980 77.360 1.00 0.00 ATOM 17546 OH2 SOL 644 18.930 44.770 1.850 1.00 0.00 ATOM 17547 H1 SOL 644 19.400 44.810 1.020 1.00 0.00 ATOM 17548 H2 SOL 644 18.290 45.480 1.800 1.00 0.00 ATOM 17549 OH2 SOL 645 56.400 1.710 83.050 1.00 0.00 ATOM 17550 H1 SOL 645 57.280 1.540 82.730 1.00 0.00 ATOM 17551 H2 SOL 645 55.900 1.940 82.270 1.00 0.00 ATOM 17552 OH2 SOL 646 17.180 31.630 81.220 1.00 0.00 ATOM 17553 H1 SOL 646 17.750 31.720 81.980 1.00 0.00 ATOM 17554 H2 SOL 646 17.770 31.720 80.470 1.00 0.00 ATOM 17555 OH2 SOL 647 55.980 52.930 76.430 1.00 0.00 ATOM 17556 H1 SOL 647 55.260 53.520 76.660 1.00 0.00 ATOM 17557 H2 SOL 647 55.890 52.200 77.040 1.00 0.00 ATOM 17558 OH2 SOL 648 18.260 19.120 11.070 1.00 0.00 ATOM 17559 H1 SOL 648 17.830 19.040 11.920 1.00 0.00 ATOM 17560 H2 SOL 648 19.130 18.750 11.210 1.00 0.00 ATOM 17561 OH2 SOL 649 28.310 38.810 79.760 1.00 0.00 ATOM 17562 H1 SOL 649 29.240 38.930 79.950 1.00 0.00 ATOM 17563 H2 SOL 649 27.880 38.910 80.610 1.00 0.00 ATOM 17564 OH2 SOL 650 33.750 43.270 21.930 1.00 0.00 ATOM 17565 H1 SOL 650 32.810 43.130 22.030 1.00 0.00 ATOM 17566 H2 SOL 650 33.820 44.140 21.540 1.00 0.00 ATOM 17567 OH2 SOL 651 56.680 19.880 3.550 1.00 0.00 ATOM 17568 H1 SOL 651 56.720 19.680 2.620 1.00 0.00 ATOM 17569 H2 SOL 651 55.750 20.040 3.720 1.00 0.00 ATOM 17570 OH2 SOL 652 42.470 0.100 9.020 1.00 0.00 ATOM 17571 H1 SOL 652 42.610 -0.570 9.690 1.00 0.00 ATOM 17572 H2 SOL 652 43.060 0.810 9.270 1.00 0.00 ATOM 17573 OH2 SOL 653 39.230 33.420 15.490 1.00 0.00 ATOM 17574 H1 SOL 653 38.810 33.970 16.150 1.00 0.00 ATOM 17575 H2 SOL 653 39.700 32.750 15.980 1.00 0.00 ATOM 17576 OH2 SOL 654 52.790 34.600 0.390 1.00 0.00 ATOM 17577 H1 SOL 654 52.020 34.470 0.940 1.00 0.00 ATOM 17578 H2 SOL 654 52.740 33.900 -0.260 1.00 0.00 ATOM 17579 OH2 SOL 655 41.240 55.090 20.050 1.00 0.00 ATOM 17580 H1 SOL 655 41.380 54.500 19.300 1.00 0.00 ATOM 17581 H2 SOL 655 40.920 54.520 20.740 1.00 0.00 ATOM 17582 OH2 SOL 656 50.390 34.920 22.210 1.00 0.00 ATOM 17583 H1 SOL 656 51.080 35.570 22.100 1.00 0.00 ATOM 17584 H2 SOL 656 49.950 35.170 23.020 1.00 0.00 ATOM 17585 OH2 SOL 657 10.410 1.880 17.050 1.00 0.00 ATOM 17586 H1 SOL 657 9.790 1.590 16.380 1.00 0.00 ATOM 17587 H2 SOL 657 10.430 1.170 17.680 1.00 0.00 ATOM 17588 OH2 SOL 658 45.850 38.770 74.980 1.00 0.00 ATOM 17589 H1 SOL 658 46.710 39.080 74.700 1.00 0.00 ATOM 17590 H2 SOL 658 45.240 39.470 74.720 1.00 0.00 ATOM 17591 OH2 SOL 659 41.000 18.550 76.570 1.00 0.00 ATOM 17592 H1 SOL 659 41.130 19.290 77.170 1.00 0.00 ATOM 17593 H2 SOL 659 40.070 18.340 76.650 1.00 0.00 ATOM 17594 OH2 SOL 660 53.140 52.720 75.360 1.00 0.00 ATOM 17595 H1 SOL 660 54.060 52.820 75.600 1.00 0.00 ATOM 17596 H2 SOL 660 52.700 52.500 76.190 1.00 0.00 ATOM 17597 OH2 SOL 661 26.010 26.460 5.110 1.00 0.00 ATOM 17598 H1 SOL 661 25.080 26.610 4.930 1.00 0.00 ATOM 17599 H2 SOL 661 26.050 26.310 6.050 1.00 0.00 ATOM 17600 OH2 SOL 662 7.790 44.980 75.590 1.00 0.00 ATOM 17601 H1 SOL 662 7.560 44.820 74.670 1.00 0.00 ATOM 17602 H2 SOL 662 7.450 45.860 75.770 1.00 0.00 ATOM 17603 OH2 SOL 663 11.740 21.710 20.680 1.00 0.00 ATOM 17604 H1 SOL 663 12.050 21.830 19.780 1.00 0.00 ATOM 17605 H2 SOL 663 12.460 21.280 21.130 1.00 0.00 ATOM 17606 OH2 SOL 664 14.390 17.470 15.230 1.00 0.00 ATOM 17607 H1 SOL 664 15.140 16.930 15.490 1.00 0.00 ATOM 17608 H2 SOL 664 13.920 16.940 14.580 1.00 0.00 ATOM 17609 OH2 SOL 665 6.380 2.660 63.160 1.00 0.00 ATOM 17610 H1 SOL 665 7.200 2.240 63.400 1.00 0.00 ATOM 17611 H2 SOL 665 5.710 2.160 63.640 1.00 0.00 ATOM 17612 OH2 SOL 666 18.130 38.680 11.250 1.00 0.00 ATOM 17613 H1 SOL 666 17.180 38.560 11.280 1.00 0.00 ATOM 17614 H2 SOL 666 18.490 37.790 11.230 1.00 0.00 ATOM 17615 OH2 SOL 667 54.850 30.650 13.840 1.00 0.00 ATOM 17616 H1 SOL 667 54.690 29.780 14.210 1.00 0.00 ATOM 17617 H2 SOL 667 54.760 30.530 12.900 1.00 0.00 ATOM 17618 OH2 SOL 668 47.160 42.770 67.570 1.00 0.00 ATOM 17619 H1 SOL 668 47.120 42.490 66.650 1.00 0.00 ATOM 17620 H2 SOL 668 48.090 42.930 67.730 1.00 0.00 ATOM 17621 OH2 SOL 669 52.290 49.300 9.810 1.00 0.00 ATOM 17622 H1 SOL 669 51.940 49.410 8.930 1.00 0.00 ATOM 17623 H2 SOL 669 51.700 48.670 10.230 1.00 0.00 ATOM 17624 OH2 SOL 670 33.800 14.420 18.580 1.00 0.00 ATOM 17625 H1 SOL 670 33.500 15.070 19.210 1.00 0.00 ATOM 17626 H2 SOL 670 34.710 14.660 18.400 1.00 0.00 ATOM 17627 OH2 SOL 671 6.300 5.410 23.150 1.00 0.00 ATOM 17628 H1 SOL 671 6.220 5.760 22.260 1.00 0.00 ATOM 17629 H2 SOL 671 7.190 5.660 23.420 1.00 0.00 ATOM 17630 OH2 SOL 672 60.170 21.810 73.530 1.00 0.00 ATOM 17631 H1 SOL 672 60.740 21.070 73.320 1.00 0.00 ATOM 17632 H2 SOL 672 59.330 21.420 73.750 1.00 0.00 ATOM 17633 OH2 SOL 673 15.080 52.410 73.260 1.00 0.00 ATOM 17634 H1 SOL 673 14.130 52.380 73.360 1.00 0.00 ATOM 17635 H2 SOL 673 15.350 53.190 73.760 1.00 0.00 ATOM 17636 OH2 SOL 674 20.560 54.200 20.720 1.00 0.00 ATOM 17637 H1 SOL 674 20.240 54.400 19.840 1.00 0.00 ATOM 17638 H2 SOL 674 21.050 54.980 20.980 1.00 0.00 ATOM 17639 OH2 SOL 675 6.970 37.240 1.480 1.00 0.00 ATOM 17640 H1 SOL 675 7.540 36.840 0.830 1.00 0.00 ATOM 17641 H2 SOL 675 7.500 37.280 2.280 1.00 0.00 ATOM 17642 OH2 SOL 676 14.980 57.230 83.670 1.00 0.00 ATOM 17643 H1 SOL 676 15.410 57.340 84.520 1.00 0.00 ATOM 17644 H2 SOL 676 15.570 56.660 83.180 1.00 0.00 ATOM 17645 OH2 SOL 677 17.180 43.560 69.030 1.00 0.00 ATOM 17646 H1 SOL 677 18.130 43.640 69.090 1.00 0.00 ATOM 17647 H2 SOL 677 16.940 43.000 69.770 1.00 0.00 ATOM 17648 OH2 SOL 678 19.960 54.770 17.570 1.00 0.00 ATOM 17649 H1 SOL 678 20.330 54.920 16.700 1.00 0.00 ATOM 17650 H2 SOL 678 19.960 55.640 17.980 1.00 0.00 ATOM 17651 OH2 SOL 679 16.850 0.300 19.320 1.00 0.00 ATOM 17652 H1 SOL 679 16.870 -0.630 19.090 1.00 0.00 ATOM 17653 H2 SOL 679 16.810 0.750 18.480 1.00 0.00 ATOM 17654 OH2 SOL 680 51.180 11.280 2.600 1.00 0.00 ATOM 17655 H1 SOL 680 51.130 10.370 2.280 1.00 0.00 ATOM 17656 H2 SOL 680 52.110 11.420 2.760 1.00 0.00 ATOM 17657 OH2 SOL 681 14.720 24.820 67.040 1.00 0.00 ATOM 17658 H1 SOL 681 14.320 25.520 67.560 1.00 0.00 ATOM 17659 H2 SOL 681 15.590 24.700 67.410 1.00 0.00 ATOM 17660 OH2 SOL 682 46.850 6.160 78.660 1.00 0.00 ATOM 17661 H1 SOL 682 46.050 6.660 78.530 1.00 0.00 ATOM 17662 H2 SOL 682 46.930 5.630 77.860 1.00 0.00 ATOM 17663 OH2 SOL 683 3.450 30.660 9.500 1.00 0.00 ATOM 17664 H1 SOL 683 2.520 30.880 9.500 1.00 0.00 ATOM 17665 H2 SOL 683 3.900 31.500 9.550 1.00 0.00 ATOM 17666 OH2 SOL 684 50.830 41.970 15.000 1.00 0.00 ATOM 17667 H1 SOL 684 50.950 42.090 14.060 1.00 0.00 ATOM 17668 H2 SOL 684 49.880 41.890 15.110 1.00 0.00 ATOM 17669 OH2 SOL 685 35.120 32.780 11.260 1.00 0.00 ATOM 17670 H1 SOL 685 35.710 33.220 11.880 1.00 0.00 ATOM 17671 H2 SOL 685 34.260 33.160 11.440 1.00 0.00 ATOM 17672 OH2 SOL 686 20.240 50.560 81.690 1.00 0.00 ATOM 17673 H1 SOL 686 20.370 50.610 82.640 1.00 0.00 ATOM 17674 H2 SOL 686 21.110 50.680 81.320 1.00 0.00 ATOM 17675 OH2 SOL 687 29.830 9.570 83.630 1.00 0.00 ATOM 17676 H1 SOL 687 30.180 8.690 83.760 1.00 0.00 ATOM 17677 H2 SOL 687 30.530 10.160 83.920 1.00 0.00 ATOM 17678 OH2 SOL 688 60.060 44.400 14.190 1.00 0.00 ATOM 17679 H1 SOL 688 59.500 44.240 14.950 1.00 0.00 ATOM 17680 H2 SOL 688 60.210 43.540 13.810 1.00 0.00 ATOM 17681 OH2 SOL 689 8.260 13.950 4.510 1.00 0.00 ATOM 17682 H1 SOL 689 8.350 14.350 3.650 1.00 0.00 ATOM 17683 H2 SOL 689 9.130 14.060 4.920 1.00 0.00 ATOM 17684 OH2 SOL 690 6.100 24.920 13.400 1.00 0.00 ATOM 17685 H1 SOL 690 5.440 25.520 13.760 1.00 0.00 ATOM 17686 H2 SOL 690 5.630 24.410 12.750 1.00 0.00 ATOM 17687 OH2 SOL 691 54.210 35.990 66.150 1.00 0.00 ATOM 17688 H1 SOL 691 54.150 35.370 65.420 1.00 0.00 ATOM 17689 H2 SOL 691 53.310 36.060 66.480 1.00 0.00 ATOM 17690 OH2 SOL 692 56.780 22.830 80.150 1.00 0.00 ATOM 17691 H1 SOL 692 55.870 23.110 80.240 1.00 0.00 ATOM 17692 H2 SOL 692 56.940 22.800 79.210 1.00 0.00 ATOM 17693 OH2 SOL 693 52.320 46.330 83.340 1.00 0.00 ATOM 17694 H1 SOL 693 52.130 47.270 83.230 1.00 0.00 ATOM 17695 H2 SOL 693 53.240 46.250 83.090 1.00 0.00 ATOM 17696 OH2 SOL 694 29.870 18.240 25.240 1.00 0.00 ATOM 17697 H1 SOL 694 30.100 19.010 25.750 1.00 0.00 ATOM 17698 H2 SOL 694 29.420 17.660 25.870 1.00 0.00 ATOM 17699 OH2 SOL 695 24.640 18.990 22.730 1.00 0.00 ATOM 17700 H1 SOL 695 25.080 18.140 22.740 1.00 0.00 ATOM 17701 H2 SOL 695 24.810 19.350 23.600 1.00 0.00 ATOM 17702 OH2 SOL 696 61.640 56.830 15.570 1.00 0.00 ATOM 17703 H1 SOL 696 61.380 57.570 16.120 1.00 0.00 ATOM 17704 H2 SOL 696 60.820 56.340 15.430 1.00 0.00 ATOM 17705 OH2 SOL 697 46.600 35.080 11.450 1.00 0.00 ATOM 17706 H1 SOL 697 47.070 35.220 12.270 1.00 0.00 ATOM 17707 H2 SOL 697 45.680 35.100 11.690 1.00 0.00 ATOM 17708 OH2 SOL 698 61.260 17.540 23.490 1.00 0.00 ATOM 17709 H1 SOL 698 61.910 17.740 24.160 1.00 0.00 ATOM 17710 H2 SOL 698 60.570 18.190 23.620 1.00 0.00 ATOM 17711 OH2 SOL 699 8.690 25.730 12.160 1.00 0.00 ATOM 17712 H1 SOL 699 8.810 24.940 11.640 1.00 0.00 ATOM 17713 H2 SOL 699 7.830 25.620 12.580 1.00 0.00 ATOM 17714 OH2 SOL 700 4.880 40.280 4.930 1.00 0.00 ATOM 17715 H1 SOL 700 5.330 40.570 4.130 1.00 0.00 ATOM 17716 H2 SOL 700 4.280 41.000 5.140 1.00 0.00 ATOM 17717 OH2 SOL 701 57.060 30.090 77.360 1.00 0.00 ATOM 17718 H1 SOL 701 57.120 29.180 77.050 1.00 0.00 ATOM 17719 H2 SOL 701 57.640 30.120 78.120 1.00 0.00 ATOM 17720 OH2 SOL 702 30.490 21.010 22.920 1.00 0.00 ATOM 17721 H1 SOL 702 29.780 20.950 23.570 1.00 0.00 ATOM 17722 H2 SOL 702 31.290 21.090 23.450 1.00 0.00 ATOM 17723 OH2 SOL 703 59.910 28.830 80.150 1.00 0.00 ATOM 17724 H1 SOL 703 60.110 29.420 79.430 1.00 0.00 ATOM 17725 H2 SOL 703 59.830 29.400 80.910 1.00 0.00 ATOM 17726 OH2 SOL 704 6.410 16.680 77.960 1.00 0.00 ATOM 17727 H1 SOL 704 5.870 15.990 77.570 1.00 0.00 ATOM 17728 H2 SOL 704 5.960 16.910 78.770 1.00 0.00 ATOM 17729 OH2 SOL 705 27.410 38.330 22.720 1.00 0.00 ATOM 17730 H1 SOL 705 26.520 37.990 22.750 1.00 0.00 ATOM 17731 H2 SOL 705 27.460 38.810 21.890 1.00 0.00 ATOM 17732 OH2 SOL 706 19.440 48.300 8.110 1.00 0.00 ATOM 17733 H1 SOL 706 19.650 49.100 8.590 1.00 0.00 ATOM 17734 H2 SOL 706 20.120 48.240 7.430 1.00 0.00 ATOM 17735 OH2 SOL 707 18.870 57.920 82.530 1.00 0.00 ATOM 17736 H1 SOL 707 19.140 57.510 81.710 1.00 0.00 ATOM 17737 H2 SOL 707 18.600 57.180 83.080 1.00 0.00 ATOM 17738 OH2 SOL 708 24.000 21.340 67.830 1.00 0.00 ATOM 17739 H1 SOL 708 23.060 21.140 67.800 1.00 0.00 ATOM 17740 H2 SOL 708 24.250 21.210 68.740 1.00 0.00 ATOM 17741 OH2 SOL 709 11.720 54.340 21.090 1.00 0.00 ATOM 17742 H1 SOL 709 10.910 53.870 21.280 1.00 0.00 ATOM 17743 H2 SOL 709 11.470 55.260 21.060 1.00 0.00 ATOM 17744 OH2 SOL 710 48.550 6.980 80.330 1.00 0.00 ATOM 17745 H1 SOL 710 48.180 7.760 80.750 1.00 0.00 ATOM 17746 H2 SOL 710 47.830 6.630 79.800 1.00 0.00 ATOM 17747 OH2 SOL 711 18.790 34.440 7.040 1.00 0.00 ATOM 17748 H1 SOL 711 18.160 34.020 7.620 1.00 0.00 ATOM 17749 H2 SOL 711 19.440 33.760 6.860 1.00 0.00 ATOM 17750 OH2 SOL 712 13.030 23.440 82.240 1.00 0.00 ATOM 17751 H1 SOL 712 13.900 23.350 81.850 1.00 0.00 ATOM 17752 H2 SOL 712 13.030 22.830 82.980 1.00 0.00 ATOM 17753 OH2 SOL 713 36.460 6.610 11.700 1.00 0.00 ATOM 17754 H1 SOL 713 37.380 6.350 11.830 1.00 0.00 ATOM 17755 H2 SOL 713 35.960 5.990 12.230 1.00 0.00 ATOM 17756 OH2 SOL 714 2.050 6.660 9.730 1.00 0.00 ATOM 17757 H1 SOL 714 1.640 6.190 10.460 1.00 0.00 ATOM 17758 H2 SOL 714 1.480 6.510 8.980 1.00 0.00 ATOM 17759 OH2 SOL 715 49.230 12.800 16.620 1.00 0.00 ATOM 17760 H1 SOL 715 49.550 13.620 17.010 1.00 0.00 ATOM 17761 H2 SOL 715 50.020 12.290 16.460 1.00 0.00 ATOM 17762 OH2 SOL 716 16.150 25.860 74.460 1.00 0.00 ATOM 17763 H1 SOL 716 17.020 26.250 74.330 1.00 0.00 ATOM 17764 H2 SOL 716 15.650 26.540 74.900 1.00 0.00 ATOM 17765 OH2 SOL 717 40.520 15.040 19.270 1.00 0.00 ATOM 17766 H1 SOL 717 40.470 14.250 18.740 1.00 0.00 ATOM 17767 H2 SOL 717 40.040 15.700 18.770 1.00 0.00 ATOM 17768 OH2 SOL 718 32.400 28.940 12.260 1.00 0.00 ATOM 17769 H1 SOL 718 31.550 28.510 12.180 1.00 0.00 ATOM 17770 H2 SOL 718 32.970 28.450 11.680 1.00 0.00 ATOM 17771 OH2 SOL 719 1.290 31.970 81.480 1.00 0.00 ATOM 17772 H1 SOL 719 1.420 32.870 81.780 1.00 0.00 ATOM 17773 H2 SOL 719 1.520 31.980 80.550 1.00 0.00 ATOM 17774 OH2 SOL 720 44.900 24.950 9.480 1.00 0.00 ATOM 17775 H1 SOL 720 45.080 24.710 10.400 1.00 0.00 ATOM 17776 H2 SOL 720 44.480 24.180 9.120 1.00 0.00 ATOM 17777 OH2 SOL 721 14.450 18.020 76.770 1.00 0.00 ATOM 17778 H1 SOL 721 13.780 17.670 76.180 1.00 0.00 ATOM 17779 H2 SOL 721 15.020 17.270 76.960 1.00 0.00 ATOM 17780 OH2 SOL 722 52.410 57.970 1.790 1.00 0.00 ATOM 17781 H1 SOL 722 53.000 58.650 1.470 1.00 0.00 ATOM 17782 H2 SOL 722 51.860 58.410 2.440 1.00 0.00 ATOM 17783 OH2 SOL 723 43.440 0.870 20.120 1.00 0.00 ATOM 17784 H1 SOL 723 43.800 0.270 19.470 1.00 0.00 ATOM 17785 H2 SOL 723 43.840 0.590 20.950 1.00 0.00 ATOM 17786 OH2 SOL 724 37.200 8.270 0.640 1.00 0.00 ATOM 17787 H1 SOL 724 37.290 9.150 1.000 1.00 0.00 ATOM 17788 H2 SOL 724 36.430 8.320 0.070 1.00 0.00 ATOM 17789 OH2 SOL 725 -0.080 34.850 69.810 1.00 0.00 ATOM 17790 H1 SOL 725 0.330 35.320 70.540 1.00 0.00 ATOM 17791 H2 SOL 725 0.110 35.380 69.040 1.00 0.00 ATOM 17792 OH2 SOL 726 28.640 36.210 7.000 1.00 0.00 ATOM 17793 H1 SOL 726 28.300 37.030 7.380 1.00 0.00 ATOM 17794 H2 SOL 726 27.890 35.840 6.540 1.00 0.00 ATOM 17795 OH2 SOL 727 28.380 14.950 11.990 1.00 0.00 ATOM 17796 H1 SOL 727 29.180 14.510 11.700 1.00 0.00 ATOM 17797 H2 SOL 727 28.260 14.660 12.900 1.00 0.00 ATOM 17798 OH2 SOL 728 50.220 3.380 83.850 1.00 0.00 ATOM 17799 H1 SOL 728 49.470 3.720 84.340 1.00 0.00 ATOM 17800 H2 SOL 728 49.820 2.860 83.150 1.00 0.00 ATOM 17801 OH2 SOL 729 24.740 53.000 79.920 1.00 0.00 ATOM 17802 H1 SOL 729 25.210 53.510 80.580 1.00 0.00 ATOM 17803 H2 SOL 729 24.910 53.460 79.100 1.00 0.00 ATOM 17804 OH2 SOL 730 2.210 12.840 73.480 1.00 0.00 ATOM 17805 H1 SOL 730 1.880 13.530 72.910 1.00 0.00 ATOM 17806 H2 SOL 730 1.520 12.170 73.460 1.00 0.00 ATOM 17807 OH2 SOL 731 4.630 27.120 25.960 1.00 0.00 ATOM 17808 H1 SOL 731 5.540 26.990 26.240 1.00 0.00 ATOM 17809 H2 SOL 731 4.360 27.930 26.380 1.00 0.00 ATOM 17810 OH2 SOL 732 17.020 49.290 76.970 1.00 0.00 ATOM 17811 H1 SOL 732 16.590 48.890 76.220 1.00 0.00 ATOM 17812 H2 SOL 732 16.560 50.120 77.100 1.00 0.00 ATOM 17813 OH2 SOL 733 13.020 2.240 8.260 1.00 0.00 ATOM 17814 H1 SOL 733 12.550 1.820 8.980 1.00 0.00 ATOM 17815 H2 SOL 733 13.750 1.650 8.080 1.00 0.00 ATOM 17816 OH2 SOL 734 13.660 15.350 79.230 1.00 0.00 ATOM 17817 H1 SOL 734 13.010 14.650 79.170 1.00 0.00 ATOM 17818 H2 SOL 734 14.100 15.350 78.380 1.00 0.00 ATOM 17819 OH2 SOL 735 45.890 31.450 70.360 1.00 0.00 ATOM 17820 H1 SOL 735 46.450 32.200 70.540 1.00 0.00 ATOM 17821 H2 SOL 735 46.470 30.820 69.920 1.00 0.00 ATOM 17822 OH2 SOL 736 47.330 32.310 10.580 1.00 0.00 ATOM 17823 H1 SOL 736 46.540 32.830 10.760 1.00 0.00 ATOM 17824 H2 SOL 736 47.140 31.860 9.750 1.00 0.00 ATOM 17825 OH2 SOL 737 3.900 42.840 6.160 1.00 0.00 ATOM 17826 H1 SOL 737 3.270 42.390 6.730 1.00 0.00 ATOM 17827 H2 SOL 737 4.410 43.390 6.750 1.00 0.00 ATOM 17828 OH2 SOL 738 37.170 40.640 22.500 1.00 0.00 ATOM 17829 H1 SOL 738 37.940 40.080 22.600 1.00 0.00 ATOM 17830 H2 SOL 738 36.430 40.030 22.570 1.00 0.00 ATOM 17831 OH2 SOL 739 20.480 40.370 80.320 1.00 0.00 ATOM 17832 H1 SOL 739 20.600 41.160 79.780 1.00 0.00 ATOM 17833 H2 SOL 739 20.070 40.690 81.120 1.00 0.00 ATOM 17834 OH2 SOL 740 35.120 25.020 65.840 1.00 0.00 ATOM 17835 H1 SOL 740 34.870 25.900 66.110 1.00 0.00 ATOM 17836 H2 SOL 740 34.880 24.470 66.590 1.00 0.00 ATOM 17837 OH2 SOL 741 59.100 18.400 6.310 1.00 0.00 ATOM 17838 H1 SOL 741 59.110 18.470 5.360 1.00 0.00 ATOM 17839 H2 SOL 741 59.280 19.290 6.630 1.00 0.00 ATOM 17840 OH2 SOL 742 58.290 14.960 12.260 1.00 0.00 ATOM 17841 H1 SOL 742 58.220 14.400 11.490 1.00 0.00 ATOM 17842 H2 SOL 742 59.230 14.990 12.440 1.00 0.00 ATOM 17843 OH2 SOL 743 43.530 42.200 83.680 1.00 0.00 ATOM 17844 H1 SOL 743 44.070 41.410 83.640 1.00 0.00 ATOM 17845 H2 SOL 743 43.800 42.640 84.490 1.00 0.00 ATOM 17846 OH2 SOL 744 25.070 40.730 67.610 1.00 0.00 ATOM 17847 H1 SOL 744 25.620 40.110 68.090 1.00 0.00 ATOM 17848 H2 SOL 744 24.180 40.440 67.800 1.00 0.00 ATOM 17849 OH2 SOL 745 20.260 48.600 13.700 1.00 0.00 ATOM 17850 H1 SOL 745 20.150 47.870 14.310 1.00 0.00 ATOM 17851 H2 SOL 745 20.520 49.340 14.260 1.00 0.00 ATOM 17852 OH2 SOL 746 1.520 35.290 7.340 1.00 0.00 ATOM 17853 H1 SOL 746 2.480 35.280 7.250 1.00 0.00 ATOM 17854 H2 SOL 746 1.350 34.750 8.110 1.00 0.00 ATOM 17855 OH2 SOL 747 31.040 14.780 69.140 1.00 0.00 ATOM 17856 H1 SOL 747 30.980 13.830 69.210 1.00 0.00 ATOM 17857 H2 SOL 747 30.710 14.980 68.260 1.00 0.00 ATOM 17858 OH2 SOL 748 37.150 29.530 9.020 1.00 0.00 ATOM 17859 H1 SOL 748 37.170 30.200 9.700 1.00 0.00 ATOM 17860 H2 SOL 748 36.270 29.570 8.660 1.00 0.00 ATOM 17861 OH2 SOL 749 34.860 47.950 61.830 1.00 0.00 ATOM 17862 H1 SOL 749 35.530 47.810 62.500 1.00 0.00 ATOM 17863 H2 SOL 749 35.210 47.510 61.050 1.00 0.00 ATOM 17864 OH2 SOL 750 17.470 55.920 1.690 1.00 0.00 ATOM 17865 H1 SOL 750 17.370 56.700 2.230 1.00 0.00 ATOM 17866 H2 SOL 750 17.690 55.230 2.310 1.00 0.00 ATOM 17867 OH2 SOL 751 40.520 57.320 76.400 1.00 0.00 ATOM 17868 H1 SOL 751 41.220 57.930 76.620 1.00 0.00 ATOM 17869 H2 SOL 751 39.850 57.460 77.070 1.00 0.00 ATOM 17870 OH2 SOL 752 5.580 20.640 84.080 1.00 0.00 ATOM 17871 H1 SOL 752 5.690 20.240 83.220 1.00 0.00 ATOM 17872 H2 SOL 752 4.700 20.360 84.360 1.00 0.00 ATOM 17873 OH2 SOL 753 38.560 37.530 74.020 1.00 0.00 ATOM 17874 H1 SOL 753 39.160 38.150 73.610 1.00 0.00 ATOM 17875 H2 SOL 753 38.050 37.170 73.290 1.00 0.00 ATOM 17876 OH2 SOL 754 47.220 31.640 17.520 1.00 0.00 ATOM 17877 H1 SOL 754 46.370 31.190 17.520 1.00 0.00 ATOM 17878 H2 SOL 754 47.010 32.540 17.250 1.00 0.00 ATOM 17879 OH2 SOL 755 35.640 12.150 63.850 1.00 0.00 ATOM 17880 H1 SOL 755 36.430 12.670 63.980 1.00 0.00 ATOM 17881 H2 SOL 755 35.540 12.100 62.900 1.00 0.00 ATOM 17882 OH2 SOL 756 40.800 7.910 78.840 1.00 0.00 ATOM 17883 H1 SOL 756 41.130 8.550 78.210 1.00 0.00 ATOM 17884 H2 SOL 756 40.330 8.430 79.490 1.00 0.00 ATOM 17885 OH2 SOL 757 59.200 11.740 78.760 1.00 0.00 ATOM 17886 H1 SOL 757 58.430 11.170 78.830 1.00 0.00 ATOM 17887 H2 SOL 757 59.910 11.240 79.180 1.00 0.00 ATOM 17888 OH2 SOL 758 2.800 5.160 74.570 1.00 0.00 ATOM 17889 H1 SOL 758 2.550 4.350 74.130 1.00 0.00 ATOM 17890 H2 SOL 758 3.630 5.410 74.170 1.00 0.00 ATOM 17891 OH2 SOL 759 16.080 55.480 72.140 1.00 0.00 ATOM 17892 H1 SOL 759 15.350 55.270 72.710 1.00 0.00 ATOM 17893 H2 SOL 759 16.680 56.000 72.680 1.00 0.00 ATOM 17894 OH2 SOL 760 31.270 7.760 11.120 1.00 0.00 ATOM 17895 H1 SOL 760 31.850 8.520 10.990 1.00 0.00 ATOM 17896 H2 SOL 760 31.810 7.010 10.860 1.00 0.00 ATOM 17897 OH2 SOL 761 44.170 29.530 6.570 1.00 0.00 ATOM 17898 H1 SOL 761 43.850 28.810 7.110 1.00 0.00 ATOM 17899 H2 SOL 761 45.090 29.630 6.820 1.00 0.00 ATOM 17900 OH2 SOL 762 27.450 3.830 11.900 1.00 0.00 ATOM 17901 H1 SOL 762 28.360 4.040 11.680 1.00 0.00 ATOM 17902 H2 SOL 762 27.000 3.780 11.060 1.00 0.00 ATOM 17903 OH2 SOL 763 12.980 27.200 8.080 1.00 0.00 ATOM 17904 H1 SOL 763 13.060 26.370 7.610 1.00 0.00 ATOM 17905 H2 SOL 763 12.040 27.350 8.160 1.00 0.00 ATOM 17906 OH2 SOL 764 54.180 21.830 70.360 1.00 0.00 ATOM 17907 H1 SOL 764 53.850 21.230 69.690 1.00 0.00 ATOM 17908 H2 SOL 764 53.720 22.660 70.190 1.00 0.00 ATOM 17909 OH2 SOL 765 46.320 35.190 79.940 1.00 0.00 ATOM 17910 H1 SOL 765 47.050 35.450 79.370 1.00 0.00 ATOM 17911 H2 SOL 765 46.620 34.380 80.360 1.00 0.00 ATOM 17912 OH2 SOL 766 21.590 39.390 3.330 1.00 0.00 ATOM 17913 H1 SOL 766 22.130 39.630 2.590 1.00 0.00 ATOM 17914 H2 SOL 766 22.100 38.730 3.800 1.00 0.00 ATOM 17915 OH2 SOL 767 22.750 23.570 15.440 1.00 0.00 ATOM 17916 H1 SOL 767 21.850 23.260 15.480 1.00 0.00 ATOM 17917 H2 SOL 767 23.010 23.660 16.360 1.00 0.00 ATOM 17918 OH2 SOL 768 39.600 41.530 68.340 1.00 0.00 ATOM 17919 H1 SOL 768 39.330 41.080 67.540 1.00 0.00 ATOM 17920 H2 SOL 768 39.180 41.030 69.040 1.00 0.00 ATOM 17921 OH2 SOL 769 36.570 57.810 4.180 1.00 0.00 ATOM 17922 H1 SOL 769 36.190 56.960 4.420 1.00 0.00 ATOM 17923 H2 SOL 769 37.460 57.770 4.510 1.00 0.00 ATOM 17924 OH2 SOL 770 6.110 21.310 78.920 1.00 0.00 ATOM 17925 H1 SOL 770 5.720 21.240 78.050 1.00 0.00 ATOM 17926 H2 SOL 770 6.980 20.920 78.830 1.00 0.00 ATOM 17927 OH2 SOL 771 31.420 27.230 74.530 1.00 0.00 ATOM 17928 H1 SOL 771 32.320 27.410 74.810 1.00 0.00 ATOM 17929 H2 SOL 771 30.880 27.760 75.120 1.00 0.00 ATOM 17930 OH2 SOL 772 5.710 36.060 77.630 1.00 0.00 ATOM 17931 H1 SOL 772 6.540 36.160 78.080 1.00 0.00 ATOM 17932 H2 SOL 772 5.790 36.620 76.860 1.00 0.00 ATOM 17933 OH2 SOL 773 45.750 28.040 17.760 1.00 0.00 ATOM 17934 H1 SOL 773 45.240 28.820 17.540 1.00 0.00 ATOM 17935 H2 SOL 773 45.350 27.700 18.550 1.00 0.00 ATOM 17936 OH2 SOL 774 59.840 21.320 19.690 1.00 0.00 ATOM 17937 H1 SOL 774 60.430 21.050 18.980 1.00 0.00 ATOM 17938 H2 SOL 774 59.970 22.260 19.760 1.00 0.00 ATOM 17939 OH2 SOL 775 40.060 23.270 22.420 1.00 0.00 ATOM 17940 H1 SOL 775 40.100 23.920 21.720 1.00 0.00 ATOM 17941 H2 SOL 775 39.140 23.020 22.460 1.00 0.00 ATOM 17942 OH2 SOL 776 30.980 54.430 9.180 1.00 0.00 ATOM 17943 H1 SOL 776 30.220 53.850 9.170 1.00 0.00 ATOM 17944 H2 SOL 776 30.810 55.050 8.470 1.00 0.00 ATOM 17945 OH2 SOL 777 17.130 47.460 82.220 1.00 0.00 ATOM 17946 H1 SOL 777 17.940 47.040 82.510 1.00 0.00 ATOM 17947 H2 SOL 777 17.420 48.150 81.620 1.00 0.00 ATOM 17948 OH2 SOL 778 33.330 10.570 61.930 1.00 0.00 ATOM 17949 H1 SOL 778 33.200 10.010 61.170 1.00 0.00 ATOM 17950 H2 SOL 778 32.860 11.370 61.720 1.00 0.00 ATOM 17951 OH2 SOL 779 30.790 28.030 70.130 1.00 0.00 ATOM 17952 H1 SOL 779 30.600 27.470 70.880 1.00 0.00 ATOM 17953 H2 SOL 779 29.930 28.200 69.730 1.00 0.00 ATOM 17954 OH2 SOL 780 21.080 42.890 16.650 1.00 0.00 ATOM 17955 H1 SOL 780 21.560 43.440 17.270 1.00 0.00 ATOM 17956 H2 SOL 780 21.590 42.080 16.610 1.00 0.00 ATOM 17957 OH2 SOL 781 60.060 30.460 67.710 1.00 0.00 ATOM 17958 H1 SOL 781 59.430 29.760 67.880 1.00 0.00 ATOM 17959 H2 SOL 781 59.520 31.180 67.360 1.00 0.00 ATOM 17960 OH2 SOL 782 48.440 26.510 23.410 1.00 0.00 ATOM 17961 H1 SOL 782 49.110 27.180 23.290 1.00 0.00 ATOM 17962 H2 SOL 782 47.830 26.890 24.040 1.00 0.00 ATOM 17963 OH2 SOL 783 47.390 44.180 22.630 1.00 0.00 ATOM 17964 H1 SOL 783 47.430 44.680 23.450 1.00 0.00 ATOM 17965 H2 SOL 783 46.470 44.190 22.380 1.00 0.00 ATOM 17966 OH2 SOL 784 18.150 52.410 20.000 1.00 0.00 ATOM 17967 H1 SOL 784 17.310 52.430 20.450 1.00 0.00 ATOM 17968 H2 SOL 784 18.660 53.110 20.410 1.00 0.00 ATOM 17969 OH2 SOL 785 56.450 38.380 5.890 1.00 0.00 ATOM 17970 H1 SOL 785 56.960 37.570 5.920 1.00 0.00 ATOM 17971 H2 SOL 785 56.300 38.610 6.800 1.00 0.00 ATOM 17972 OH2 SOL 786 19.350 2.140 79.990 1.00 0.00 ATOM 17973 H1 SOL 786 18.990 1.460 79.410 1.00 0.00 ATOM 17974 H2 SOL 786 19.760 2.770 79.400 1.00 0.00 ATOM 17975 OH2 SOL 787 56.320 49.500 66.990 1.00 0.00 ATOM 17976 H1 SOL 787 56.600 48.820 67.600 1.00 0.00 ATOM 17977 H2 SOL 787 56.650 50.320 67.370 1.00 0.00 ATOM 17978 OH2 SOL 788 43.040 57.440 63.310 1.00 0.00 ATOM 17979 H1 SOL 788 43.220 57.970 64.090 1.00 0.00 ATOM 17980 H2 SOL 788 43.810 56.880 63.230 1.00 0.00 ATOM 17981 OH2 SOL 789 17.070 18.890 63.840 1.00 0.00 ATOM 17982 H1 SOL 789 16.560 19.060 63.050 1.00 0.00 ATOM 17983 H2 SOL 789 17.940 18.650 63.520 1.00 0.00 ATOM 17984 OH2 SOL 790 49.400 33.500 73.030 1.00 0.00 ATOM 17985 H1 SOL 790 49.940 32.810 72.640 1.00 0.00 ATOM 17986 H2 SOL 790 48.750 33.030 73.540 1.00 0.00 ATOM 17987 OH2 SOL 791 58.090 2.350 79.310 1.00 0.00 ATOM 17988 H1 SOL 791 57.650 3.190 79.240 1.00 0.00 ATOM 17989 H2 SOL 791 59.020 2.550 79.220 1.00 0.00 ATOM 17990 OH2 SOL 792 3.230 54.850 82.060 1.00 0.00 ATOM 17991 H1 SOL 792 3.070 54.450 81.200 1.00 0.00 ATOM 17992 H2 SOL 792 2.500 54.550 82.590 1.00 0.00 ATOM 17993 OH2 SOL 793 30.210 51.880 7.750 1.00 0.00 ATOM 17994 H1 SOL 793 29.690 51.520 8.470 1.00 0.00 ATOM 17995 H2 SOL 793 29.580 51.990 7.040 1.00 0.00 ATOM 17996 OH2 SOL 794 45.380 31.400 13.110 1.00 0.00 ATOM 17997 H1 SOL 794 44.600 31.620 12.590 1.00 0.00 ATOM 17998 H2 SOL 794 45.790 30.680 12.630 1.00 0.00 ATOM 17999 OH2 SOL 795 52.820 22.560 82.650 1.00 0.00 ATOM 18000 H1 SOL 795 53.720 22.480 82.980 1.00 0.00 ATOM 18001 H2 SOL 795 52.420 21.710 82.850 1.00 0.00 ATOM 18002 OH2 SOL 796 44.080 15.790 72.640 1.00 0.00 ATOM 18003 H1 SOL 796 44.250 14.860 72.440 1.00 0.00 ATOM 18004 H2 SOL 796 43.580 15.770 73.450 1.00 0.00 ATOM 18005 OH2 SOL 797 44.970 42.300 8.410 1.00 0.00 ATOM 18006 H1 SOL 797 45.380 41.620 7.870 1.00 0.00 ATOM 18007 H2 SOL 797 45.620 42.490 9.080 1.00 0.00 ATOM 18008 OH2 SOL 798 16.490 42.120 1.550 1.00 0.00 ATOM 18009 H1 SOL 798 16.550 42.540 2.410 1.00 0.00 ATOM 18010 H2 SOL 798 15.570 42.160 1.320 1.00 0.00 ATOM 18011 OH2 SOL 799 59.180 21.910 1.280 1.00 0.00 ATOM 18012 H1 SOL 799 58.790 21.110 1.620 1.00 0.00 ATOM 18013 H2 SOL 799 59.840 22.160 1.930 1.00 0.00 ATOM 18014 OH2 SOL 800 43.060 25.680 73.270 1.00 0.00 ATOM 18015 H1 SOL 800 42.640 25.290 74.030 1.00 0.00 ATOM 18016 H2 SOL 800 43.630 24.990 72.930 1.00 0.00 ATOM 18017 OH2 SOL 801 43.690 54.030 9.140 1.00 0.00 ATOM 18018 H1 SOL 801 44.050 54.460 9.920 1.00 0.00 ATOM 18019 H2 SOL 801 43.810 53.100 9.300 1.00 0.00 ATOM 18020 OH2 SOL 802 19.220 28.180 5.240 1.00 0.00 ATOM 18021 H1 SOL 802 20.110 28.200 5.590 1.00 0.00 ATOM 18022 H2 SOL 802 19.270 27.580 4.500 1.00 0.00 ATOM 18023 OH2 SOL 803 19.930 57.220 18.850 1.00 0.00 ATOM 18024 H1 SOL 803 20.370 57.940 18.400 1.00 0.00 ATOM 18025 H2 SOL 803 19.690 57.570 19.700 1.00 0.00 ATOM 18026 OH2 SOL 804 30.060 41.240 12.290 1.00 0.00 ATOM 18027 H1 SOL 804 29.450 40.520 12.440 1.00 0.00 ATOM 18028 H2 SOL 804 29.850 41.560 11.410 1.00 0.00 ATOM 18029 OH2 SOL 805 48.010 12.580 75.550 1.00 0.00 ATOM 18030 H1 SOL 805 48.900 12.590 75.200 1.00 0.00 ATOM 18031 H2 SOL 805 47.440 12.610 74.780 1.00 0.00 ATOM 18032 OH2 SOL 806 57.580 19.630 0.740 1.00 0.00 ATOM 18033 H1 SOL 806 58.080 18.920 0.340 1.00 0.00 ATOM 18034 H2 SOL 806 57.130 20.050 0.010 1.00 0.00 ATOM 18035 OH2 SOL 807 44.370 9.750 25.800 1.00 0.00 ATOM 18036 H1 SOL 807 45.220 9.300 25.760 1.00 0.00 ATOM 18037 H2 SOL 807 43.760 9.080 26.110 1.00 0.00 ATOM 18038 OH2 SOL 808 7.400 24.940 0.710 1.00 0.00 ATOM 18039 H1 SOL 808 7.550 25.770 0.260 1.00 0.00 ATOM 18040 H2 SOL 808 8.240 24.740 1.140 1.00 0.00 ATOM 18041 OH2 SOL 809 42.230 1.670 65.310 1.00 0.00 ATOM 18042 H1 SOL 809 42.560 1.940 64.450 1.00 0.00 ATOM 18043 H2 SOL 809 42.600 0.800 65.450 1.00 0.00 ATOM 18044 OH2 SOL 810 19.290 26.160 2.870 1.00 0.00 ATOM 18045 H1 SOL 810 20.060 26.480 2.400 1.00 0.00 ATOM 18046 H2 SOL 810 18.800 25.660 2.220 1.00 0.00 ATOM 18047 OH2 SOL 811 24.290 37.400 68.510 1.00 0.00 ATOM 18048 H1 SOL 811 25.080 37.390 67.980 1.00 0.00 ATOM 18049 H2 SOL 811 23.610 37.760 67.930 1.00 0.00 ATOM 18050 OH2 SOL 812 18.440 54.790 13.280 1.00 0.00 ATOM 18051 H1 SOL 812 19.340 54.570 13.090 1.00 0.00 ATOM 18052 H2 SOL 812 18.500 55.460 13.970 1.00 0.00 ATOM 18053 OH2 SOL 813 53.410 25.410 82.600 1.00 0.00 ATOM 18054 H1 SOL 813 52.460 25.310 82.690 1.00 0.00 ATOM 18055 H2 SOL 813 53.650 24.800 81.910 1.00 0.00 ATOM 18056 OH2 SOL 814 12.490 57.370 18.100 1.00 0.00 ATOM 18057 H1 SOL 814 12.910 57.690 17.300 1.00 0.00 ATOM 18058 H2 SOL 814 12.820 57.940 18.790 1.00 0.00 ATOM 18059 OH2 SOL 815 35.760 17.700 3.860 1.00 0.00 ATOM 18060 H1 SOL 815 35.070 17.510 3.220 1.00 0.00 ATOM 18061 H2 SOL 815 35.930 18.640 3.760 1.00 0.00 ATOM 18062 OH2 SOL 816 7.030 9.090 18.280 1.00 0.00 ATOM 18063 H1 SOL 816 7.180 10.020 18.420 1.00 0.00 ATOM 18064 H2 SOL 816 6.110 9.020 18.020 1.00 0.00 ATOM 18065 OH2 SOL 817 37.310 38.140 1.700 1.00 0.00 ATOM 18066 H1 SOL 817 36.700 37.810 1.040 1.00 0.00 ATOM 18067 H2 SOL 817 37.600 37.360 2.170 1.00 0.00 ATOM 18068 OH2 SOL 818 33.840 31.770 61.520 1.00 0.00 ATOM 18069 H1 SOL 818 33.220 31.800 62.250 1.00 0.00 ATOM 18070 H2 SOL 818 34.350 32.580 61.610 1.00 0.00 ATOM 18071 OH2 SOL 819 49.120 56.150 67.920 1.00 0.00 ATOM 18072 H1 SOL 819 49.980 56.120 68.340 1.00 0.00 ATOM 18073 H2 SOL 819 48.980 57.080 67.740 1.00 0.00 ATOM 18074 OH2 SOL 820 26.910 57.090 66.900 1.00 0.00 ATOM 18075 H1 SOL 820 26.510 57.130 66.030 1.00 0.00 ATOM 18076 H2 SOL 820 26.690 56.210 67.220 1.00 0.00 ATOM 18077 OH2 SOL 821 48.790 38.200 6.200 1.00 0.00 ATOM 18078 H1 SOL 821 49.280 37.700 5.540 1.00 0.00 ATOM 18079 H2 SOL 821 48.990 39.110 6.010 1.00 0.00 ATOM 18080 OH2 SOL 822 18.290 28.260 75.840 1.00 0.00 ATOM 18081 H1 SOL 822 18.720 27.880 75.070 1.00 0.00 ATOM 18082 H2 SOL 822 18.980 28.770 76.270 1.00 0.00 ATOM 18083 OH2 SOL 823 50.340 16.800 5.410 1.00 0.00 ATOM 18084 H1 SOL 823 49.580 16.920 4.840 1.00 0.00 ATOM 18085 H2 SOL 823 50.380 15.850 5.560 1.00 0.00 ATOM 18086 OH2 SOL 824 30.900 0.210 61.620 1.00 0.00 ATOM 18087 H1 SOL 824 30.530 0.990 61.190 1.00 0.00 ATOM 18088 H2 SOL 824 31.010 0.480 62.540 1.00 0.00 ATOM 18089 OH2 SOL 825 7.650 6.900 10.880 1.00 0.00 ATOM 18090 H1 SOL 825 7.740 6.050 11.310 1.00 0.00 ATOM 18091 H2 SOL 825 8.280 6.870 10.160 1.00 0.00 ATOM 18092 OH2 SOL 826 24.380 3.380 12.440 1.00 0.00 ATOM 18093 H1 SOL 826 25.090 4.020 12.360 1.00 0.00 ATOM 18094 H2 SOL 826 23.990 3.560 13.290 1.00 0.00 ATOM 18095 OH2 SOL 827 38.560 52.690 84.030 1.00 0.00 ATOM 18096 H1 SOL 827 39.120 51.930 84.220 1.00 0.00 ATOM 18097 H2 SOL 827 38.490 52.710 83.080 1.00 0.00 ATOM 18098 OH2 SOL 828 12.150 38.390 8.120 1.00 0.00 ATOM 18099 H1 SOL 828 13.040 38.440 7.760 1.00 0.00 ATOM 18100 H2 SOL 828 11.940 39.300 8.350 1.00 0.00 ATOM 18101 OH2 SOL 829 21.630 31.730 0.440 1.00 0.00 ATOM 18102 H1 SOL 829 22.460 31.580 -0.020 1.00 0.00 ATOM 18103 H2 SOL 829 21.720 31.240 1.260 1.00 0.00 ATOM 18104 OH2 SOL 830 17.780 49.240 25.210 1.00 0.00 ATOM 18105 H1 SOL 830 17.900 50.180 25.020 1.00 0.00 ATOM 18106 H2 SOL 830 18.670 48.910 25.320 1.00 0.00 ATOM 18107 OH2 SOL 831 57.470 8.860 17.310 1.00 0.00 ATOM 18108 H1 SOL 831 57.520 8.930 16.360 1.00 0.00 ATOM 18109 H2 SOL 831 57.830 9.680 17.640 1.00 0.00 ATOM 18110 OH2 SOL 832 45.200 55.140 81.150 1.00 0.00 ATOM 18111 H1 SOL 832 46.030 55.580 80.960 1.00 0.00 ATOM 18112 H2 SOL 832 44.630 55.370 80.420 1.00 0.00 ATOM 18113 OH2 SOL 833 4.800 36.360 -0.040 1.00 0.00 ATOM 18114 H1 SOL 833 5.350 36.670 0.680 1.00 0.00 ATOM 18115 H2 SOL 833 4.590 35.450 0.190 1.00 0.00 ATOM 18116 OH2 SOL 834 1.130 50.820 65.830 1.00 0.00 ATOM 18117 H1 SOL 834 0.420 50.380 65.360 1.00 0.00 ATOM 18118 H2 SOL 834 1.930 50.540 65.370 1.00 0.00 ATOM 18119 OH2 SOL 835 41.590 48.170 75.140 1.00 0.00 ATOM 18120 H1 SOL 835 42.010 48.950 74.770 1.00 0.00 ATOM 18121 H2 SOL 835 40.660 48.300 74.950 1.00 0.00 ATOM 18122 OH2 SOL 836 55.060 6.130 2.090 1.00 0.00 ATOM 18123 H1 SOL 836 54.910 6.960 2.550 1.00 0.00 ATOM 18124 H2 SOL 836 55.960 5.900 2.300 1.00 0.00 ATOM 18125 OH2 SOL 837 5.980 56.500 61.750 1.00 0.00 ATOM 18126 H1 SOL 837 6.040 56.160 60.860 1.00 0.00 ATOM 18127 H2 SOL 837 6.620 57.210 61.780 1.00 0.00 ATOM 18128 OH2 SOL 838 23.100 45.860 71.200 1.00 0.00 ATOM 18129 H1 SOL 838 23.610 45.210 70.710 1.00 0.00 ATOM 18130 H2 SOL 838 22.270 45.910 70.740 1.00 0.00 ATOM 18131 OH2 SOL 839 9.470 53.610 71.760 1.00 0.00 ATOM 18132 H1 SOL 839 10.390 53.780 71.580 1.00 0.00 ATOM 18133 H2 SOL 839 9.210 54.300 72.380 1.00 0.00 ATOM 18134 OH2 SOL 840 3.980 53.160 7.240 1.00 0.00 ATOM 18135 H1 SOL 840 4.040 52.710 8.080 1.00 0.00 ATOM 18136 H2 SOL 840 4.050 54.090 7.450 1.00 0.00 ATOM 18137 OH2 SOL 841 0.590 46.090 8.270 1.00 0.00 ATOM 18138 H1 SOL 841 0.260 45.190 8.230 1.00 0.00 ATOM 18139 H2 SOL 841 0.590 46.310 9.200 1.00 0.00 ATOM 18140 OH2 SOL 842 43.140 5.150 4.590 1.00 0.00 ATOM 18141 H1 SOL 842 43.240 6.090 4.740 1.00 0.00 ATOM 18142 H2 SOL 842 42.330 4.920 5.040 1.00 0.00 ATOM 18143 OH2 SOL 843 18.130 38.740 70.080 1.00 0.00 ATOM 18144 H1 SOL 843 18.550 37.930 70.360 1.00 0.00 ATOM 18145 H2 SOL 843 17.280 38.480 69.740 1.00 0.00 ATOM 18146 OH2 SOL 844 0.680 9.880 7.410 1.00 0.00 ATOM 18147 H1 SOL 844 1.600 9.650 7.300 1.00 0.00 ATOM 18148 H2 SOL 844 0.460 10.400 6.630 1.00 0.00 ATOM 18149 OH2 SOL 845 33.250 42.790 18.600 1.00 0.00 ATOM 18150 H1 SOL 845 32.670 43.380 19.090 1.00 0.00 ATOM 18151 H2 SOL 845 32.820 42.680 17.750 1.00 0.00 ATOM 18152 OH2 SOL 846 6.460 54.590 16.150 1.00 0.00 ATOM 18153 H1 SOL 846 6.940 53.760 16.120 1.00 0.00 ATOM 18154 H2 SOL 846 7.140 55.260 16.250 1.00 0.00 ATOM 18155 OH2 SOL 847 58.990 48.690 5.970 1.00 0.00 ATOM 18156 H1 SOL 847 58.190 49.130 5.680 1.00 0.00 ATOM 18157 H2 SOL 847 58.710 48.160 6.720 1.00 0.00 ATOM 18158 OH2 SOL 848 24.680 20.470 77.650 1.00 0.00 ATOM 18159 H1 SOL 848 24.460 21.400 77.640 1.00 0.00 ATOM 18160 H2 SOL 848 24.360 20.150 78.490 1.00 0.00 ATOM 18161 OH2 SOL 849 35.260 55.430 4.680 1.00 0.00 ATOM 18162 H1 SOL 849 34.690 55.170 3.950 1.00 0.00 ATOM 18163 H2 SOL 849 35.720 54.620 4.920 1.00 0.00 ATOM 18164 OH2 SOL 850 9.690 43.160 75.830 1.00 0.00 ATOM 18165 H1 SOL 850 9.740 43.080 76.780 1.00 0.00 ATOM 18166 H2 SOL 850 8.960 43.750 75.670 1.00 0.00 ATOM 18167 OH2 SOL 851 9.860 30.200 78.710 1.00 0.00 ATOM 18168 H1 SOL 851 10.800 30.150 78.880 1.00 0.00 ATOM 18169 H2 SOL 851 9.710 31.120 78.480 1.00 0.00 ATOM 18170 OH2 SOL 852 11.490 21.820 75.020 1.00 0.00 ATOM 18171 H1 SOL 852 10.970 21.100 75.370 1.00 0.00 ATOM 18172 H2 SOL 852 12.170 21.960 75.670 1.00 0.00 ATOM 18173 OH2 SOL 853 28.200 22.650 24.900 1.00 0.00 ATOM 18174 H1 SOL 853 28.900 22.930 25.490 1.00 0.00 ATOM 18175 H2 SOL 853 27.610 22.130 25.450 1.00 0.00 ATOM 18176 OH2 SOL 854 60.300 7.650 6.950 1.00 0.00 ATOM 18177 H1 SOL 854 60.000 8.110 6.160 1.00 0.00 ATOM 18178 H2 SOL 854 60.790 8.310 7.440 1.00 0.00 ATOM 18179 OH2 SOL 855 2.390 36.470 12.560 1.00 0.00 ATOM 18180 H1 SOL 855 3.160 36.020 12.200 1.00 0.00 ATOM 18181 H2 SOL 855 2.560 36.510 13.510 1.00 0.00 ATOM 18182 OH2 SOL 856 41.230 29.590 16.450 1.00 0.00 ATOM 18183 H1 SOL 856 41.630 29.210 15.660 1.00 0.00 ATOM 18184 H2 SOL 856 40.980 28.840 16.980 1.00 0.00 ATOM 18185 OH2 SOL 857 55.730 17.140 83.000 1.00 0.00 ATOM 18186 H1 SOL 857 56.040 16.660 83.760 1.00 0.00 ATOM 18187 H2 SOL 857 56.450 17.090 82.370 1.00 0.00 ATOM 18188 OH2 SOL 858 54.920 2.620 80.870 1.00 0.00 ATOM 18189 H1 SOL 858 54.310 3.300 81.170 1.00 0.00 ATOM 18190 H2 SOL 858 54.420 2.120 80.220 1.00 0.00 ATOM 18191 OH2 SOL 859 31.530 31.580 5.540 1.00 0.00 ATOM 18192 H1 SOL 859 32.310 32.000 5.180 1.00 0.00 ATOM 18193 H2 SOL 859 31.080 31.230 4.770 1.00 0.00 ATOM 18194 OH2 SOL 860 56.610 33.980 65.850 1.00 0.00 ATOM 18195 H1 SOL 860 55.890 34.170 65.250 1.00 0.00 ATOM 18196 H2 SOL 860 57.390 34.260 65.390 1.00 0.00 ATOM 18197 OH2 SOL 861 54.170 1.300 1.030 1.00 0.00 ATOM 18198 H1 SOL 861 54.940 1.040 1.540 1.00 0.00 ATOM 18199 H2 SOL 861 54.410 1.120 0.120 1.00 0.00 ATOM 18200 OH2 SOL 862 7.780 49.040 18.060 1.00 0.00 ATOM 18201 H1 SOL 862 7.390 48.190 18.260 1.00 0.00 ATOM 18202 H2 SOL 862 7.830 49.060 17.100 1.00 0.00 ATOM 18203 OH2 SOL 863 31.860 39.700 76.060 1.00 0.00 ATOM 18204 H1 SOL 863 31.430 38.990 75.580 1.00 0.00 ATOM 18205 H2 SOL 863 32.530 40.030 75.450 1.00 0.00 ATOM 18206 OH2 SOL 864 7.470 19.250 69.340 1.00 0.00 ATOM 18207 H1 SOL 864 8.160 19.820 69.680 1.00 0.00 ATOM 18208 H2 SOL 864 6.760 19.850 69.120 1.00 0.00 ATOM 18209 OH2 SOL 865 39.300 5.990 77.170 1.00 0.00 ATOM 18210 H1 SOL 865 38.370 6.170 77.090 1.00 0.00 ATOM 18211 H2 SOL 865 39.570 6.430 77.980 1.00 0.00 ATOM 18212 OH2 SOL 866 50.600 5.620 78.600 1.00 0.00 ATOM 18213 H1 SOL 866 50.270 4.740 78.750 1.00 0.00 ATOM 18214 H2 SOL 866 50.430 6.090 79.410 1.00 0.00 ATOM 18215 OH2 SOL 867 51.350 13.570 8.140 1.00 0.00 ATOM 18216 H1 SOL 867 51.540 13.670 7.210 1.00 0.00 ATOM 18217 H2 SOL 867 51.900 12.840 8.430 1.00 0.00 ATOM 18218 OH2 SOL 868 1.950 51.210 68.350 1.00 0.00 ATOM 18219 H1 SOL 868 1.710 50.760 67.540 1.00 0.00 ATOM 18220 H2 SOL 868 1.230 51.000 68.950 1.00 0.00 ATOM 18221 OH2 SOL 869 9.160 32.690 78.250 1.00 0.00 ATOM 18222 H1 SOL 869 8.800 33.220 78.950 1.00 0.00 ATOM 18223 H2 SOL 869 8.400 32.450 77.710 1.00 0.00 ATOM 18224 OH2 SOL 870 40.370 27.320 2.720 1.00 0.00 ATOM 18225 H1 SOL 870 41.190 27.470 3.180 1.00 0.00 ATOM 18226 H2 SOL 870 40.580 27.450 1.800 1.00 0.00 ATOM 18227 OH2 SOL 871 17.650 33.760 13.170 1.00 0.00 ATOM 18228 H1 SOL 871 17.580 33.570 12.230 1.00 0.00 ATOM 18229 H2 SOL 871 18.520 33.450 13.410 1.00 0.00 ATOM 18230 OH2 SOL 872 13.060 31.480 74.080 1.00 0.00 ATOM 18231 H1 SOL 872 12.160 31.680 73.840 1.00 0.00 ATOM 18232 H2 SOL 872 13.150 30.540 73.920 1.00 0.00 ATOM 18233 OH2 SOL 873 33.830 48.260 0.040 1.00 0.00 ATOM 18234 H1 SOL 873 34.050 47.380 0.360 1.00 0.00 ATOM 18235 H2 SOL 873 34.610 48.780 0.220 1.00 0.00 ATOM 18236 OH2 SOL 874 2.920 22.620 66.340 1.00 0.00 ATOM 18237 H1 SOL 874 2.610 22.060 65.640 1.00 0.00 ATOM 18238 H2 SOL 874 3.290 23.380 65.900 1.00 0.00 ATOM 18239 OH2 SOL 875 38.910 25.150 71.870 1.00 0.00 ATOM 18240 H1 SOL 875 38.040 25.260 72.260 1.00 0.00 ATOM 18241 H2 SOL 875 39.360 24.560 72.480 1.00 0.00 ATOM 18242 OH2 SOL 876 17.020 24.550 0.370 1.00 0.00 ATOM 18243 H1 SOL 876 17.490 23.860 0.830 1.00 0.00 ATOM 18244 H2 SOL 876 17.700 25.070 -0.050 1.00 0.00 ATOM 18245 OH2 SOL 877 19.620 43.340 14.480 1.00 0.00 ATOM 18246 H1 SOL 877 20.330 43.190 15.090 1.00 0.00 ATOM 18247 H2 SOL 877 19.170 42.500 14.420 1.00 0.00 ATOM 18248 OH2 SOL 878 27.820 53.160 75.980 1.00 0.00 ATOM 18249 H1 SOL 878 27.390 53.310 75.140 1.00 0.00 ATOM 18250 H2 SOL 878 27.420 52.360 76.320 1.00 0.00 ATOM 18251 OH2 SOL 879 55.410 6.550 74.120 1.00 0.00 ATOM 18252 H1 SOL 879 54.830 5.790 74.030 1.00 0.00 ATOM 18253 H2 SOL 879 56.290 6.190 74.060 1.00 0.00 ATOM 18254 OH2 SOL 880 36.200 35.810 72.650 1.00 0.00 ATOM 18255 H1 SOL 880 35.730 35.910 71.820 1.00 0.00 ATOM 18256 H2 SOL 880 36.310 34.860 72.740 1.00 0.00 ATOM 18257 OH2 SOL 881 60.440 30.520 4.930 1.00 0.00 ATOM 18258 H1 SOL 881 61.020 30.390 4.180 1.00 0.00 ATOM 18259 H2 SOL 881 60.090 29.650 5.120 1.00 0.00 ATOM 18260 OH2 SOL 882 49.900 29.690 80.250 1.00 0.00 ATOM 18261 H1 SOL 882 50.310 29.750 81.110 1.00 0.00 ATOM 18262 H2 SOL 882 49.000 30.000 80.380 1.00 0.00 ATOM 18263 OH2 SOL 883 24.620 9.860 71.240 1.00 0.00 ATOM 18264 H1 SOL 883 24.070 9.170 70.890 1.00 0.00 ATOM 18265 H2 SOL 883 24.670 9.690 72.180 1.00 0.00 ATOM 18266 OH2 SOL 884 50.080 57.700 10.500 1.00 0.00 ATOM 18267 H1 SOL 884 49.400 57.290 9.970 1.00 0.00 ATOM 18268 H2 SOL 884 49.620 58.390 10.980 1.00 0.00 ATOM 18269 OH2 SOL 885 19.630 7.200 70.080 1.00 0.00 ATOM 18270 H1 SOL 885 19.470 7.770 70.830 1.00 0.00 ATOM 18271 H2 SOL 885 20.040 7.770 69.430 1.00 0.00 ATOM 18272 OH2 SOL 886 10.260 13.320 19.050 1.00 0.00 ATOM 18273 H1 SOL 886 9.490 13.660 19.520 1.00 0.00 ATOM 18274 H2 SOL 886 9.950 13.190 18.160 1.00 0.00 ATOM 18275 OH2 SOL 887 43.440 20.850 30.040 1.00 0.00 ATOM 18276 H1 SOL 887 43.550 21.510 29.360 1.00 0.00 ATOM 18277 H2 SOL 887 44.150 20.220 29.880 1.00 0.00 ATOM 18278 OH2 SOL 888 60.480 50.100 77.420 1.00 0.00 ATOM 18279 H1 SOL 888 61.330 49.670 77.450 1.00 0.00 ATOM 18280 H2 SOL 888 60.580 50.780 76.750 1.00 0.00 ATOM 18281 OH2 SOL 889 18.860 37.720 75.510 1.00 0.00 ATOM 18282 H1 SOL 889 18.590 36.880 75.150 1.00 0.00 ATOM 18283 H2 SOL 889 18.930 38.300 74.750 1.00 0.00 ATOM 18284 OH2 SOL 890 26.360 4.740 4.110 1.00 0.00 ATOM 18285 H1 SOL 890 25.830 4.930 3.340 1.00 0.00 ATOM 18286 H2 SOL 890 26.070 3.860 4.390 1.00 0.00 ATOM 18287 OH2 SOL 891 42.400 0.950 27.760 1.00 0.00 ATOM 18288 H1 SOL 891 41.750 0.260 27.870 1.00 0.00 ATOM 18289 H2 SOL 891 43.200 0.570 28.120 1.00 0.00 ATOM 18290 OH2 SOL 892 42.300 33.150 14.980 1.00 0.00 ATOM 18291 H1 SOL 892 42.600 32.850 14.120 1.00 0.00 ATOM 18292 H2 SOL 892 41.380 33.380 14.840 1.00 0.00 ATOM 18293 OH2 SOL 893 17.080 4.300 16.810 1.00 0.00 ATOM 18294 H1 SOL 893 17.400 3.660 17.440 1.00 0.00 ATOM 18295 H2 SOL 893 16.570 4.920 17.330 1.00 0.00 ATOM 18296 OH2 SOL 894 7.540 37.030 12.340 1.00 0.00 ATOM 18297 H1 SOL 894 6.840 37.220 11.720 1.00 0.00 ATOM 18298 H2 SOL 894 7.650 37.850 12.830 1.00 0.00 ATOM 18299 OH2 SOL 895 54.350 11.540 61.580 1.00 0.00 ATOM 18300 H1 SOL 895 54.490 10.770 62.140 1.00 0.00 ATOM 18301 H2 SOL 895 54.950 12.190 61.930 1.00 0.00 ATOM 18302 OH2 SOL 896 26.700 7.320 26.090 1.00 0.00 ATOM 18303 H1 SOL 896 26.960 7.080 25.190 1.00 0.00 ATOM 18304 H2 SOL 896 27.510 7.240 26.600 1.00 0.00 ATOM 18305 OH2 SOL 897 60.870 34.180 11.960 1.00 0.00 ATOM 18306 H1 SOL 897 61.040 34.300 12.900 1.00 0.00 ATOM 18307 H2 SOL 897 60.050 33.680 11.930 1.00 0.00 ATOM 18308 OH2 SOL 898 58.480 4.770 12.440 1.00 0.00 ATOM 18309 H1 SOL 898 58.400 4.550 11.520 1.00 0.00 ATOM 18310 H2 SOL 898 59.190 5.400 12.490 1.00 0.00 ATOM 18311 OH2 SOL 899 23.340 1.260 11.020 1.00 0.00 ATOM 18312 H1 SOL 899 22.400 1.430 11.150 1.00 0.00 ATOM 18313 H2 SOL 899 23.770 1.810 11.680 1.00 0.00 ATOM 18314 OH2 SOL 900 14.830 28.910 67.830 1.00 0.00 ATOM 18315 H1 SOL 900 15.080 29.040 66.910 1.00 0.00 ATOM 18316 H2 SOL 900 15.380 28.190 68.140 1.00 0.00 ATOM 18317 OH2 SOL 901 20.820 48.470 63.450 1.00 0.00 ATOM 18318 H1 SOL 901 20.470 49.020 62.760 1.00 0.00 ATOM 18319 H2 SOL 901 20.050 48.190 63.950 1.00 0.00 ATOM 18320 OH2 SOL 902 13.630 55.690 65.710 1.00 0.00 ATOM 18321 H1 SOL 902 14.420 55.230 65.440 1.00 0.00 ATOM 18322 H2 SOL 902 13.020 55.000 65.960 1.00 0.00 ATOM 18323 OH2 SOL 903 20.790 18.050 19.220 1.00 0.00 ATOM 18324 H1 SOL 903 20.300 17.270 19.510 1.00 0.00 ATOM 18325 H2 SOL 903 21.550 18.080 19.800 1.00 0.00 ATOM 18326 OH2 SOL 904 37.230 16.400 69.750 1.00 0.00 ATOM 18327 H1 SOL 904 37.260 15.740 70.430 1.00 0.00 ATOM 18328 H2 SOL 904 36.460 16.930 69.950 1.00 0.00 ATOM 18329 OH2 SOL 905 24.630 11.060 3.150 1.00 0.00 ATOM 18330 H1 SOL 905 23.730 11.370 3.110 1.00 0.00 ATOM 18331 H2 SOL 905 25.060 11.650 3.770 1.00 0.00 ATOM 18332 OH2 SOL 906 39.710 12.820 0.320 1.00 0.00 ATOM 18333 H1 SOL 906 39.500 13.520 -0.310 1.00 0.00 ATOM 18334 H2 SOL 906 38.900 12.690 0.810 1.00 0.00 ATOM 18335 OH2 SOL 907 40.080 55.220 11.670 1.00 0.00 ATOM 18336 H1 SOL 907 39.430 54.540 11.860 1.00 0.00 ATOM 18337 H2 SOL 907 40.040 55.800 12.430 1.00 0.00 ATOM 18338 OH2 SOL 908 38.630 26.300 69.350 1.00 0.00 ATOM 18339 H1 SOL 908 38.850 26.030 70.250 1.00 0.00 ATOM 18340 H2 SOL 908 38.420 27.230 69.440 1.00 0.00 ATOM 18341 OH2 SOL 909 33.960 7.220 62.010 1.00 0.00 ATOM 18342 H1 SOL 909 33.630 7.560 62.850 1.00 0.00 ATOM 18343 H2 SOL 909 33.480 7.710 61.350 1.00 0.00 ATOM 18344 OH2 SOL 910 24.060 18.220 76.040 1.00 0.00 ATOM 18345 H1 SOL 910 23.150 18.120 76.330 1.00 0.00 ATOM 18346 H2 SOL 910 24.380 18.970 76.540 1.00 0.00 ATOM 18347 OH2 SOL 911 45.690 11.150 75.890 1.00 0.00 ATOM 18348 H1 SOL 911 45.340 11.640 75.150 1.00 0.00 ATOM 18349 H2 SOL 911 46.540 11.550 76.060 1.00 0.00 ATOM 18350 OH2 SOL 912 18.230 48.550 3.090 1.00 0.00 ATOM 18351 H1 SOL 912 17.690 47.830 2.770 1.00 0.00 ATOM 18352 H2 SOL 912 17.760 49.340 2.820 1.00 0.00 ATOM 18353 OH2 SOL 913 31.050 38.680 80.010 1.00 0.00 ATOM 18354 H1 SOL 913 31.180 37.980 79.360 1.00 0.00 ATOM 18355 H2 SOL 913 31.420 39.460 79.600 1.00 0.00 ATOM 18356 OH2 SOL 914 7.990 10.350 81.800 1.00 0.00 ATOM 18357 H1 SOL 914 8.350 11.100 82.270 1.00 0.00 ATOM 18358 H2 SOL 914 8.190 9.600 82.360 1.00 0.00 ATOM 18359 OH2 SOL 915 54.880 43.060 23.980 1.00 0.00 ATOM 18360 H1 SOL 915 54.900 43.420 23.100 1.00 0.00 ATOM 18361 H2 SOL 915 54.750 42.120 23.860 1.00 0.00 ATOM 18362 OH2 SOL 916 22.320 17.500 6.280 1.00 0.00 ATOM 18363 H1 SOL 916 21.970 16.830 6.860 1.00 0.00 ATOM 18364 H2 SOL 916 22.920 17.040 5.700 1.00 0.00 ATOM 18365 OH2 SOL 917 9.910 45.130 9.180 1.00 0.00 ATOM 18366 H1 SOL 917 10.050 44.920 10.110 1.00 0.00 ATOM 18367 H2 SOL 917 10.540 45.820 8.990 1.00 0.00 ATOM 18368 OH2 SOL 918 9.180 16.320 9.890 1.00 0.00 ATOM 18369 H1 SOL 918 9.960 15.780 10.020 1.00 0.00 ATOM 18370 H2 SOL 918 9.500 17.100 9.440 1.00 0.00 ATOM 18371 OH2 SOL 919 18.580 48.740 80.030 1.00 0.00 ATOM 18372 H1 SOL 919 19.080 49.210 80.700 1.00 0.00 ATOM 18373 H2 SOL 919 18.330 49.420 79.400 1.00 0.00 ATOM 18374 OH2 SOL 920 24.290 6.680 6.510 1.00 0.00 ATOM 18375 H1 SOL 920 24.670 6.620 7.390 1.00 0.00 ATOM 18376 H2 SOL 920 25.040 6.610 5.920 1.00 0.00 ATOM 18377 OH2 SOL 921 29.510 30.480 7.350 1.00 0.00 ATOM 18378 H1 SOL 921 28.760 30.540 6.760 1.00 0.00 ATOM 18379 H2 SOL 921 30.090 31.190 7.070 1.00 0.00 ATOM 18380 OH2 SOL 922 45.420 4.300 67.360 1.00 0.00 ATOM 18381 H1 SOL 922 45.440 5.250 67.480 1.00 0.00 ATOM 18382 H2 SOL 922 46.320 4.020 67.540 1.00 0.00 ATOM 18383 OH2 SOL 923 49.650 15.700 22.010 1.00 0.00 ATOM 18384 H1 SOL 923 48.770 15.850 21.650 1.00 0.00 ATOM 18385 H2 SOL 923 50.210 16.290 21.510 1.00 0.00 ATOM 18386 OH2 SOL 924 37.470 14.040 78.430 1.00 0.00 ATOM 18387 H1 SOL 924 37.010 13.720 77.660 1.00 0.00 ATOM 18388 H2 SOL 924 37.830 14.890 78.150 1.00 0.00 ATOM 18389 OH2 SOL 925 39.200 16.850 78.760 1.00 0.00 ATOM 18390 H1 SOL 925 39.110 17.150 79.670 1.00 0.00 ATOM 18391 H2 SOL 925 40.030 16.380 78.740 1.00 0.00 ATOM 18392 OH2 SOL 926 0.680 5.070 11.520 1.00 0.00 ATOM 18393 H1 SOL 926 -0.160 4.860 11.120 1.00 0.00 ATOM 18394 H2 SOL 926 0.840 4.350 12.130 1.00 0.00 ATOM 18395 OH2 SOL 927 29.900 43.880 72.970 1.00 0.00 ATOM 18396 H1 SOL 927 28.990 43.910 72.700 1.00 0.00 ATOM 18397 H2 SOL 927 30.390 44.290 72.260 1.00 0.00 ATOM 18398 OH2 SOL 928 58.160 20.190 74.450 1.00 0.00 ATOM 18399 H1 SOL 928 57.330 20.500 74.090 1.00 0.00 ATOM 18400 H2 SOL 928 58.250 19.290 74.120 1.00 0.00 ATOM 18401 OH2 SOL 929 19.730 11.370 78.750 1.00 0.00 ATOM 18402 H1 SOL 929 20.250 10.770 78.210 1.00 0.00 ATOM 18403 H2 SOL 929 19.170 10.800 79.270 1.00 0.00 ATOM 18404 OH2 SOL 930 35.780 25.890 19.000 1.00 0.00 ATOM 18405 H1 SOL 930 35.850 26.830 19.180 1.00 0.00 ATOM 18406 H2 SOL 930 36.360 25.750 18.250 1.00 0.00 ATOM 18407 OH2 SOL 931 55.290 22.700 84.000 1.00 0.00 ATOM 18408 H1 SOL 931 55.540 23.630 84.030 1.00 0.00 ATOM 18409 H2 SOL 931 56.120 22.240 83.860 1.00 0.00 ATOM 18410 OH2 SOL 932 35.130 27.670 7.030 1.00 0.00 ATOM 18411 H1 SOL 932 34.950 28.490 6.570 1.00 0.00 ATOM 18412 H2 SOL 932 35.780 27.230 6.480 1.00 0.00 ATOM 18413 OH2 SOL 933 12.140 58.010 65.190 1.00 0.00 ATOM 18414 H1 SOL 933 12.550 58.880 65.230 1.00 0.00 ATOM 18415 H2 SOL 933 12.740 57.440 65.670 1.00 0.00 ATOM 18416 OH2 SOL 934 12.690 55.450 83.030 1.00 0.00 ATOM 18417 H1 SOL 934 13.340 55.990 83.480 1.00 0.00 ATOM 18418 H2 SOL 934 12.720 55.740 82.120 1.00 0.00 ATOM 18419 OH2 SOL 935 33.120 30.990 74.790 1.00 0.00 ATOM 18420 H1 SOL 935 32.960 30.650 73.920 1.00 0.00 ATOM 18421 H2 SOL 935 34.070 31.110 74.830 1.00 0.00 ATOM 18422 OH2 SOL 936 57.980 10.720 7.460 1.00 0.00 ATOM 18423 H1 SOL 936 57.300 11.320 7.760 1.00 0.00 ATOM 18424 H2 SOL 936 57.490 9.970 7.110 1.00 0.00 ATOM 18425 OH2 SOL 937 40.170 12.170 76.830 1.00 0.00 ATOM 18426 H1 SOL 937 39.820 12.330 77.700 1.00 0.00 ATOM 18427 H2 SOL 937 40.480 13.030 76.530 1.00 0.00 ATOM 18428 OH2 SOL 938 22.330 38.030 12.010 1.00 0.00 ATOM 18429 H1 SOL 938 23.070 37.680 12.500 1.00 0.00 ATOM 18430 H2 SOL 938 22.280 37.500 11.220 1.00 0.00 ATOM 18431 OH2 SOL 939 13.770 52.610 68.610 1.00 0.00 ATOM 18432 H1 SOL 939 13.960 51.680 68.710 1.00 0.00 ATOM 18433 H2 SOL 939 14.410 52.910 67.960 1.00 0.00 ATOM 18434 OH2 SOL 940 55.640 57.000 62.780 1.00 0.00 ATOM 18435 H1 SOL 940 54.990 57.690 62.640 1.00 0.00 ATOM 18436 H2 SOL 940 56.050 56.890 61.930 1.00 0.00 ATOM 18437 OH2 SOL 941 22.490 20.250 17.240 1.00 0.00 ATOM 18438 H1 SOL 941 21.730 19.690 17.090 1.00 0.00 ATOM 18439 H2 SOL 941 22.130 21.130 17.360 1.00 0.00 ATOM 18440 OH2 SOL 942 20.440 7.530 23.250 1.00 0.00 ATOM 18441 H1 SOL 942 19.900 8.320 23.230 1.00 0.00 ATOM 18442 H2 SOL 942 21.300 7.820 22.930 1.00 0.00 ATOM 18443 OH2 SOL 943 9.050 36.720 72.940 1.00 0.00 ATOM 18444 H1 SOL 943 8.980 36.030 73.600 1.00 0.00 ATOM 18445 H2 SOL 943 9.090 37.530 73.450 1.00 0.00 ATOM 18446 OH2 SOL 944 14.320 47.890 16.100 1.00 0.00 ATOM 18447 H1 SOL 944 14.180 47.360 15.310 1.00 0.00 ATOM 18448 H2 SOL 944 14.660 48.720 15.780 1.00 0.00 ATOM 18449 OH2 SOL 945 30.350 4.220 11.280 1.00 0.00 ATOM 18450 H1 SOL 945 31.030 4.860 11.040 1.00 0.00 ATOM 18451 H2 SOL 945 30.840 3.430 11.500 1.00 0.00 ATOM 18452 OH2 SOL 946 4.300 35.260 7.390 1.00 0.00 ATOM 18453 H1 SOL 946 4.700 36.050 7.750 1.00 0.00 ATOM 18454 H2 SOL 946 4.980 34.860 6.850 1.00 0.00 ATOM 18455 OH2 SOL 947 15.180 57.070 22.230 1.00 0.00 ATOM 18456 H1 SOL 947 16.000 56.610 22.420 1.00 0.00 ATOM 18457 H2 SOL 947 14.880 56.680 21.410 1.00 0.00 ATOM 18458 OH2 SOL 948 13.710 8.110 79.890 1.00 0.00 ATOM 18459 H1 SOL 948 13.170 8.880 79.770 1.00 0.00 ATOM 18460 H2 SOL 948 14.550 8.450 80.200 1.00 0.00 ATOM 18461 OH2 SOL 949 23.550 44.870 15.500 1.00 0.00 ATOM 18462 H1 SOL 949 23.550 45.830 15.510 1.00 0.00 ATOM 18463 H2 SOL 949 23.330 44.640 14.590 1.00 0.00 ATOM 18464 OH2 SOL 950 16.290 0.520 13.120 1.00 0.00 ATOM 18465 H1 SOL 950 15.710 0.950 12.490 1.00 0.00 ATOM 18466 H2 SOL 950 16.250 1.080 13.900 1.00 0.00 ATOM 18467 OH2 SOL 951 61.080 0.850 16.310 1.00 0.00 ATOM 18468 H1 SOL 951 61.480 1.250 17.080 1.00 0.00 ATOM 18469 H2 SOL 951 60.140 0.960 16.440 1.00 0.00 ATOM 18470 OH2 SOL 952 42.950 5.720 73.190 1.00 0.00 ATOM 18471 H1 SOL 952 42.660 6.220 73.950 1.00 0.00 ATOM 18472 H2 SOL 952 43.650 6.250 72.810 1.00 0.00 ATOM 18473 OH2 SOL 953 31.900 49.880 14.540 1.00 0.00 ATOM 18474 H1 SOL 953 32.140 49.110 15.060 1.00 0.00 ATOM 18475 H2 SOL 953 31.170 50.270 15.010 1.00 0.00 ATOM 18476 OH2 SOL 954 41.600 50.090 80.330 1.00 0.00 ATOM 18477 H1 SOL 954 41.610 49.350 80.940 1.00 0.00 ATOM 18478 H2 SOL 954 41.030 50.740 80.740 1.00 0.00 ATOM 18479 OH2 SOL 955 28.390 14.980 6.490 1.00 0.00 ATOM 18480 H1 SOL 955 29.030 14.270 6.360 1.00 0.00 ATOM 18481 H2 SOL 955 28.880 15.650 6.960 1.00 0.00 ATOM 18482 OH2 SOL 956 51.270 3.460 5.670 1.00 0.00 ATOM 18483 H1 SOL 956 51.160 3.480 4.720 1.00 0.00 ATOM 18484 H2 SOL 956 51.150 2.540 5.910 1.00 0.00 ATOM 18485 OH2 SOL 957 30.130 26.560 61.900 1.00 0.00 ATOM 18486 H1 SOL 957 30.280 25.740 61.430 1.00 0.00 ATOM 18487 H2 SOL 957 30.430 27.240 61.300 1.00 0.00 ATOM 18488 OH2 SOL 958 43.620 18.850 63.020 1.00 0.00 ATOM 18489 H1 SOL 958 43.750 19.750 63.320 1.00 0.00 ATOM 18490 H2 SOL 958 43.690 18.900 62.060 1.00 0.00 ATOM 18491 OH2 SOL 959 41.650 47.140 1.360 1.00 0.00 ATOM 18492 H1 SOL 959 41.010 47.230 0.660 1.00 0.00 ATOM 18493 H2 SOL 959 42.360 46.640 0.970 1.00 0.00 ATOM 18494 OH2 SOL 960 45.870 31.950 77.810 1.00 0.00 ATOM 18495 H1 SOL 960 45.740 31.190 78.390 1.00 0.00 ATOM 18496 H2 SOL 960 45.340 31.770 77.040 1.00 0.00 ATOM 18497 OH2 SOL 961 15.920 40.160 75.480 1.00 0.00 ATOM 18498 H1 SOL 961 15.830 39.690 74.650 1.00 0.00 ATOM 18499 H2 SOL 961 15.150 39.910 75.980 1.00 0.00 ATOM 18500 OH2 SOL 962 34.640 45.910 70.320 1.00 0.00 ATOM 18501 H1 SOL 962 34.440 45.300 69.600 1.00 0.00 ATOM 18502 H2 SOL 962 33.930 46.550 70.290 1.00 0.00 ATOM 18503 OH2 SOL 963 8.460 21.750 19.410 1.00 0.00 ATOM 18504 H1 SOL 963 7.830 22.030 18.740 1.00 0.00 ATOM 18505 H2 SOL 963 9.310 21.960 19.030 1.00 0.00 ATOM 18506 OH2 SOL 964 34.100 45.160 16.400 1.00 0.00 ATOM 18507 H1 SOL 964 33.290 44.660 16.510 1.00 0.00 ATOM 18508 H2 SOL 964 34.590 45.000 17.200 1.00 0.00 ATOM 18509 OH2 SOL 965 46.950 43.550 83.800 1.00 0.00 ATOM 18510 H1 SOL 965 46.600 44.180 84.430 1.00 0.00 ATOM 18511 H2 SOL 965 46.200 43.310 83.260 1.00 0.00 ATOM 18512 OH2 SOL 966 1.990 21.410 10.310 1.00 0.00 ATOM 18513 H1 SOL 966 1.250 21.170 9.760 1.00 0.00 ATOM 18514 H2 SOL 966 1.600 21.610 11.160 1.00 0.00 ATOM 18515 OH2 SOL 967 2.490 41.230 77.540 1.00 0.00 ATOM 18516 H1 SOL 967 2.330 40.360 77.910 1.00 0.00 ATOM 18517 H2 SOL 967 2.730 41.060 76.630 1.00 0.00 ATOM 18518 OH2 SOL 968 55.560 38.780 8.580 1.00 0.00 ATOM 18519 H1 SOL 968 55.160 37.920 8.460 1.00 0.00 ATOM 18520 H2 SOL 968 56.160 38.670 9.320 1.00 0.00 ATOM 18521 OH2 SOL 969 36.380 11.880 3.540 1.00 0.00 ATOM 18522 H1 SOL 969 36.970 11.730 4.280 1.00 0.00 ATOM 18523 H2 SOL 969 35.860 12.640 3.800 1.00 0.00 ATOM 18524 OH2 SOL 970 34.090 17.440 1.580 1.00 0.00 ATOM 18525 H1 SOL 970 34.770 16.960 1.100 1.00 0.00 ATOM 18526 H2 SOL 970 33.530 17.810 0.890 1.00 0.00 ATOM 18527 OH2 SOL 971 52.010 9.040 20.620 1.00 0.00 ATOM 18528 H1 SOL 971 51.410 8.310 20.500 1.00 0.00 ATOM 18529 H2 SOL 971 52.430 8.880 21.460 1.00 0.00 ATOM 18530 OH2 SOL 972 57.770 38.450 74.250 1.00 0.00 ATOM 18531 H1 SOL 972 57.510 38.470 75.170 1.00 0.00 ATOM 18532 H2 SOL 972 58.260 39.260 74.120 1.00 0.00 ATOM 18533 OH2 SOL 973 4.290 50.620 73.000 1.00 0.00 ATOM 18534 H1 SOL 973 3.440 50.760 72.580 1.00 0.00 ATOM 18535 H2 SOL 973 4.880 51.230 72.550 1.00 0.00 ATOM 18536 OH2 SOL 974 8.670 7.040 23.620 1.00 0.00 ATOM 18537 H1 SOL 974 8.010 7.410 23.030 1.00 0.00 ATOM 18538 H2 SOL 974 9.200 7.800 23.880 1.00 0.00 ATOM 18539 OH2 SOL 975 50.150 1.460 65.310 1.00 0.00 ATOM 18540 H1 SOL 975 50.510 2.280 65.640 1.00 0.00 ATOM 18541 H2 SOL 975 49.860 1.670 64.420 1.00 0.00 ATOM 18542 OH2 SOL 976 55.560 22.440 6.770 1.00 0.00 ATOM 18543 H1 SOL 976 54.910 22.870 7.320 1.00 0.00 ATOM 18544 H2 SOL 976 56.400 22.790 7.070 1.00 0.00 ATOM 18545 OH2 SOL 977 23.610 37.020 14.300 1.00 0.00 ATOM 18546 H1 SOL 977 24.190 36.380 14.710 1.00 0.00 ATOM 18547 H2 SOL 977 24.080 37.850 14.360 1.00 0.00 ATOM 18548 OH2 SOL 978 12.750 6.040 19.570 1.00 0.00 ATOM 18549 H1 SOL 978 13.300 5.750 20.300 1.00 0.00 ATOM 18550 H2 SOL 978 12.190 5.280 19.380 1.00 0.00 ATOM 18551 OH2 SOL 979 14.890 40.090 82.870 1.00 0.00 ATOM 18552 H1 SOL 979 15.050 41.030 82.780 1.00 0.00 ATOM 18553 H2 SOL 979 15.600 39.770 83.420 1.00 0.00 ATOM 18554 OH2 SOL 980 8.450 35.310 17.540 1.00 0.00 ATOM 18555 H1 SOL 980 9.260 34.860 17.280 1.00 0.00 ATOM 18556 H2 SOL 980 7.940 35.360 16.740 1.00 0.00 ATOM 18557 OH2 SOL 981 39.560 21.170 80.780 1.00 0.00 ATOM 18558 H1 SOL 981 38.760 21.590 81.090 1.00 0.00 ATOM 18559 H2 SOL 981 40.240 21.490 81.370 1.00 0.00 ATOM 18560 OH2 SOL 982 10.130 54.940 3.040 1.00 0.00 ATOM 18561 H1 SOL 982 9.470 55.470 3.500 1.00 0.00 ATOM 18562 H2 SOL 982 10.960 55.180 3.460 1.00 0.00 ATOM 18563 OH2 SOL 983 61.250 49.100 74.780 1.00 0.00 ATOM 18564 H1 SOL 983 61.310 50.060 74.750 1.00 0.00 ATOM 18565 H2 SOL 983 60.360 48.920 75.050 1.00 0.00 ATOM 18566 OH2 SOL 984 59.830 55.350 83.180 1.00 0.00 ATOM 18567 H1 SOL 984 59.830 55.810 84.030 1.00 0.00 ATOM 18568 H2 SOL 984 59.760 56.050 82.530 1.00 0.00 ATOM 18569 OH2 SOL 985 48.670 48.010 74.320 1.00 0.00 ATOM 18570 H1 SOL 985 47.920 48.600 74.240 1.00 0.00 ATOM 18571 H2 SOL 985 49.400 48.570 74.580 1.00 0.00 ATOM 18572 OH2 SOL 986 19.690 17.660 22.370 1.00 0.00 ATOM 18573 H1 SOL 986 20.050 16.990 22.950 1.00 0.00 ATOM 18574 H2 SOL 986 18.780 17.390 22.230 1.00 0.00 ATOM 18575 OH2 SOL 987 14.090 10.910 1.180 1.00 0.00 ATOM 18576 H1 SOL 987 13.910 11.310 2.030 1.00 0.00 ATOM 18577 H2 SOL 987 14.690 11.520 0.750 1.00 0.00 ATOM 18578 OH2 SOL 988 58.070 15.260 64.970 1.00 0.00 ATOM 18579 H1 SOL 988 57.870 15.950 64.340 1.00 0.00 ATOM 18580 H2 SOL 988 59.020 15.160 64.920 1.00 0.00 ATOM 18581 OH2 SOL 989 10.460 24.260 77.290 1.00 0.00 ATOM 18582 H1 SOL 989 10.530 24.400 78.240 1.00 0.00 ATOM 18583 H2 SOL 989 9.520 24.210 77.130 1.00 0.00 ATOM 18584 OH2 SOL 990 51.790 39.800 19.210 1.00 0.00 ATOM 18585 H1 SOL 990 51.120 39.660 18.550 1.00 0.00 ATOM 18586 H2 SOL 990 52.620 39.760 18.730 1.00 0.00 ATOM 18587 OH2 SOL 991 6.580 50.320 71.540 1.00 0.00 ATOM 18588 H1 SOL 991 6.270 49.450 71.290 1.00 0.00 ATOM 18589 H2 SOL 991 6.720 50.780 70.710 1.00 0.00 ATOM 18590 OH2 SOL 992 24.310 37.400 75.980 1.00 0.00 ATOM 18591 H1 SOL 992 25.060 37.340 76.580 1.00 0.00 ATOM 18592 H2 SOL 992 23.590 37.700 76.530 1.00 0.00 ATOM 18593 OH2 SOL 993 60.240 30.380 75.660 1.00 0.00 ATOM 18594 H1 SOL 993 59.840 31.200 75.370 1.00 0.00 ATOM 18595 H2 SOL 993 59.610 29.710 75.430 1.00 0.00 ATOM 18596 OH2 SOL 994 51.410 37.760 66.890 1.00 0.00 ATOM 18597 H1 SOL 994 50.980 37.750 66.040 1.00 0.00 ATOM 18598 H2 SOL 994 50.700 37.920 67.510 1.00 0.00 ATOM 18599 OH2 SOL 995 13.450 38.210 3.200 1.00 0.00 ATOM 18600 H1 SOL 995 13.350 37.310 3.500 1.00 0.00 ATOM 18601 H2 SOL 995 13.510 38.720 4.010 1.00 0.00 ATOM 18602 OH2 SOL 996 4.790 0.110 76.320 1.00 0.00 ATOM 18603 H1 SOL 996 5.600 -0.200 76.730 1.00 0.00 ATOM 18604 H2 SOL 996 5.040 0.930 75.900 1.00 0.00 ATOM 18605 OH2 SOL 997 24.570 11.740 81.010 1.00 0.00 ATOM 18606 H1 SOL 997 24.770 10.820 80.870 1.00 0.00 ATOM 18607 H2 SOL 997 24.760 11.890 81.940 1.00 0.00 ATOM 18608 OH2 SOL 998 8.760 50.170 3.570 1.00 0.00 ATOM 18609 H1 SOL 998 8.990 50.160 4.500 1.00 0.00 ATOM 18610 H2 SOL 998 8.590 49.260 3.350 1.00 0.00 ATOM 18611 OH2 SOL 999 27.030 16.150 9.770 1.00 0.00 ATOM 18612 H1 SOL 999 27.350 15.660 10.530 1.00 0.00 ATOM 18613 H2 SOL 999 27.820 16.350 9.270 1.00 0.00 ATOM 18614 OH2 SOL 1000 9.980 45.280 82.190 1.00 0.00 ATOM 18615 H1 SOL 1000 9.840 45.810 81.400 1.00 0.00 ATOM 18616 H2 SOL 1000 10.850 45.530 82.490 1.00 0.00 ATOM 18617 OH2 SOL 1001 17.920 31.810 19.490 1.00 0.00 ATOM 18618 H1 SOL 1001 17.500 31.040 19.090 1.00 0.00 ATOM 18619 H2 SOL 1001 17.480 32.560 19.080 1.00 0.00 ATOM 18620 OH2 SOL 1002 15.740 51.320 13.020 1.00 0.00 ATOM 18621 H1 SOL 1002 15.240 51.180 13.830 1.00 0.00 ATOM 18622 H2 SOL 1002 16.290 50.540 12.940 1.00 0.00 ATOM 18623 OH2 SOL 1003 22.020 34.410 81.930 1.00 0.00 ATOM 18624 H1 SOL 1003 21.420 34.830 81.310 1.00 0.00 ATOM 18625 H2 SOL 1003 21.820 34.810 82.770 1.00 0.00 ATOM 18626 OH2 SOL 1004 55.430 42.110 0.010 1.00 0.00 ATOM 18627 H1 SOL 1004 55.300 41.960 0.940 1.00 0.00 ATOM 18628 H2 SOL 1004 55.190 41.290 -0.410 1.00 0.00 ATOM 18629 OH2 SOL 1005 37.280 14.670 66.170 1.00 0.00 ATOM 18630 H1 SOL 1005 37.560 15.040 65.330 1.00 0.00 ATOM 18631 H2 SOL 1005 37.860 13.920 66.310 1.00 0.00 ATOM 18632 OH2 SOL 1006 41.530 37.470 64.780 1.00 0.00 ATOM 18633 H1 SOL 1006 41.980 36.900 64.150 1.00 0.00 ATOM 18634 H2 SOL 1006 40.720 37.010 64.980 1.00 0.00 ATOM 18635 OH2 SOL 1007 8.140 9.230 5.470 1.00 0.00 ATOM 18636 H1 SOL 1007 8.120 9.520 6.380 1.00 0.00 ATOM 18637 H2 SOL 1007 8.770 8.510 5.460 1.00 0.00 ATOM 18638 OH2 SOL 1008 14.560 55.510 16.410 1.00 0.00 ATOM 18639 H1 SOL 1008 14.750 55.640 15.490 1.00 0.00 ATOM 18640 H2 SOL 1008 15.400 55.300 16.810 1.00 0.00 ATOM 18641 OH2 SOL 1009 42.160 38.220 2.020 1.00 0.00 ATOM 18642 H1 SOL 1009 41.990 38.790 1.260 1.00 0.00 ATOM 18643 H2 SOL 1009 43.050 38.440 2.290 1.00 0.00 ATOM 18644 OH2 SOL 1010 2.750 57.340 75.470 1.00 0.00 ATOM 18645 H1 SOL 1010 3.470 57.840 75.850 1.00 0.00 ATOM 18646 H2 SOL 1010 3.160 56.820 74.770 1.00 0.00 ATOM 18647 OH2 SOL 1011 12.940 24.620 2.570 1.00 0.00 ATOM 18648 H1 SOL 1011 13.470 24.960 3.280 1.00 0.00 ATOM 18649 H2 SOL 1011 13.090 25.220 1.840 1.00 0.00 ATOM 18650 OH2 SOL 1012 34.820 19.200 11.070 1.00 0.00 ATOM 18651 H1 SOL 1012 34.430 20.050 10.870 1.00 0.00 ATOM 18652 H2 SOL 1012 34.090 18.580 11.050 1.00 0.00 ATOM 18653 OH2 SOL 1013 43.860 32.090 25.800 1.00 0.00 ATOM 18654 H1 SOL 1013 44.690 32.220 26.270 1.00 0.00 ATOM 18655 H2 SOL 1013 43.960 32.610 25.000 1.00 0.00 ATOM 18656 OH2 SOL 1014 43.090 44.800 73.790 1.00 0.00 ATOM 18657 H1 SOL 1014 42.840 44.960 72.870 1.00 0.00 ATOM 18658 H2 SOL 1014 43.710 45.510 73.990 1.00 0.00 ATOM 18659 OH2 SOL 1015 58.190 36.520 68.210 1.00 0.00 ATOM 18660 H1 SOL 1015 57.760 35.770 68.630 1.00 0.00 ATOM 18661 H2 SOL 1015 57.480 37.000 67.790 1.00 0.00 ATOM 18662 OH2 SOL 1016 55.050 24.020 4.200 1.00 0.00 ATOM 18663 H1 SOL 1016 55.010 23.080 4.350 1.00 0.00 ATOM 18664 H2 SOL 1016 55.890 24.160 3.750 1.00 0.00 ATOM 18665 OH2 SOL 1017 8.690 3.510 69.650 1.00 0.00 ATOM 18666 H1 SOL 1017 8.960 4.180 69.020 1.00 0.00 ATOM 18667 H2 SOL 1017 8.500 2.740 69.120 1.00 0.00 ATOM 18668 OH2 SOL 1018 48.020 34.720 20.890 1.00 0.00 ATOM 18669 H1 SOL 1018 48.900 34.830 21.230 1.00 0.00 ATOM 18670 H2 SOL 1018 47.450 34.930 21.630 1.00 0.00 ATOM 18671 OH2 SOL 1019 37.260 17.910 12.570 1.00 0.00 ATOM 18672 H1 SOL 1019 37.590 18.790 12.370 1.00 0.00 ATOM 18673 H2 SOL 1019 36.470 17.830 12.040 1.00 0.00 ATOM 18674 OH2 SOL 1020 6.300 1.290 10.830 1.00 0.00 ATOM 18675 H1 SOL 1020 6.580 2.200 10.750 1.00 0.00 ATOM 18676 H2 SOL 1020 5.980 1.210 11.720 1.00 0.00 ATOM 18677 OH2 SOL 1021 2.270 45.610 18.020 1.00 0.00 ATOM 18678 H1 SOL 1021 3.150 45.570 17.660 1.00 0.00 ATOM 18679 H2 SOL 1021 2.060 44.700 18.230 1.00 0.00 ATOM 18680 OH2 SOL 1022 38.820 21.390 72.140 1.00 0.00 ATOM 18681 H1 SOL 1022 38.350 20.970 71.420 1.00 0.00 ATOM 18682 H2 SOL 1022 38.770 20.760 72.860 1.00 0.00 ATOM 18683 OH2 SOL 1023 22.200 55.470 4.980 1.00 0.00 ATOM 18684 H1 SOL 1023 21.260 55.450 4.800 1.00 0.00 ATOM 18685 H2 SOL 1023 22.410 56.400 5.020 1.00 0.00 ATOM 18686 OH2 SOL 1024 45.510 35.010 1.790 1.00 0.00 ATOM 18687 H1 SOL 1024 45.000 34.390 1.270 1.00 0.00 ATOM 18688 H2 SOL 1024 45.360 35.850 1.370 1.00 0.00 ATOM 18689 OH2 SOL 1025 53.800 21.650 1.830 1.00 0.00 ATOM 18690 H1 SOL 1025 53.630 20.750 1.540 1.00 0.00 ATOM 18691 H2 SOL 1025 54.450 21.980 1.210 1.00 0.00 ATOM 18692 OH2 SOL 1026 38.360 17.920 76.480 1.00 0.00 ATOM 18693 H1 SOL 1026 38.570 17.690 77.380 1.00 0.00 ATOM 18694 H2 SOL 1026 37.980 17.120 76.110 1.00 0.00 ATOM 18695 OH2 SOL 1027 0.480 15.760 80.970 1.00 0.00 ATOM 18696 H1 SOL 1027 1.180 15.410 80.430 1.00 0.00 ATOM 18697 H2 SOL 1027 -0.290 15.250 80.720 1.00 0.00 ATOM 18698 OH2 SOL 1028 16.140 57.540 10.870 1.00 0.00 ATOM 18699 H1 SOL 1028 16.250 57.880 11.760 1.00 0.00 ATOM 18700 H2 SOL 1028 16.350 56.610 10.940 1.00 0.00 ATOM 18701 OH2 SOL 1029 31.700 54.120 12.370 1.00 0.00 ATOM 18702 H1 SOL 1029 32.170 54.170 11.540 1.00 0.00 ATOM 18703 H2 SOL 1029 31.800 54.990 12.760 1.00 0.00 ATOM 18704 OH2 SOL 1030 54.900 7.490 17.740 1.00 0.00 ATOM 18705 H1 SOL 1030 55.160 6.810 17.120 1.00 0.00 ATOM 18706 H2 SOL 1030 55.640 8.100 17.740 1.00 0.00 ATOM 18707 OH2 SOL 1031 8.380 33.910 5.230 1.00 0.00 ATOM 18708 H1 SOL 1031 8.650 33.050 4.930 1.00 0.00 ATOM 18709 H2 SOL 1031 8.730 34.520 4.580 1.00 0.00 ATOM 18710 OH2 SOL 1032 52.330 56.930 76.440 1.00 0.00 ATOM 18711 H1 SOL 1032 53.230 57.230 76.340 1.00 0.00 ATOM 18712 H2 SOL 1032 51.850 57.700 76.720 1.00 0.00 ATOM 18713 OH2 SOL 1033 16.460 30.880 1.100 1.00 0.00 ATOM 18714 H1 SOL 1033 17.250 31.060 1.620 1.00 0.00 ATOM 18715 H2 SOL 1033 16.480 31.540 0.400 1.00 0.00 ATOM 18716 OH2 SOL 1034 51.910 2.920 11.180 1.00 0.00 ATOM 18717 H1 SOL 1034 51.950 3.450 11.970 1.00 0.00 ATOM 18718 H2 SOL 1034 51.280 3.380 10.620 1.00 0.00 ATOM 18719 OH2 SOL 1035 26.410 14.460 2.530 1.00 0.00 ATOM 18720 H1 SOL 1035 26.130 14.280 3.420 1.00 0.00 ATOM 18721 H2 SOL 1035 27.130 15.080 2.630 1.00 0.00 ATOM 18722 OH2 SOL 1036 42.800 53.040 12.820 1.00 0.00 ATOM 18723 H1 SOL 1036 42.290 53.210 13.610 1.00 0.00 ATOM 18724 H2 SOL 1036 43.120 52.140 12.940 1.00 0.00 ATOM 18725 OH2 SOL 1037 30.050 20.120 70.430 1.00 0.00 ATOM 18726 H1 SOL 1037 29.160 20.460 70.310 1.00 0.00 ATOM 18727 H2 SOL 1037 30.620 20.840 70.180 1.00 0.00 ATOM 18728 OH2 SOL 1038 26.060 36.170 8.480 1.00 0.00 ATOM 18729 H1 SOL 1038 26.580 36.970 8.480 1.00 0.00 ATOM 18730 H2 SOL 1038 25.800 36.060 7.570 1.00 0.00 ATOM 18731 OH2 SOL 1039 55.880 13.340 62.890 1.00 0.00 ATOM 18732 H1 SOL 1039 56.770 13.070 62.660 1.00 0.00 ATOM 18733 H2 SOL 1039 55.970 14.240 63.190 1.00 0.00 ATOM 18734 OH2 SOL 1040 56.690 15.500 74.540 1.00 0.00 ATOM 18735 H1 SOL 1040 57.260 15.660 75.290 1.00 0.00 ATOM 18736 H2 SOL 1040 56.010 16.170 74.610 1.00 0.00 ATOM 18737 OH2 SOL 1041 12.380 39.700 82.350 1.00 0.00 ATOM 18738 H1 SOL 1041 13.310 39.740 82.560 1.00 0.00 ATOM 18739 H2 SOL 1041 11.970 39.280 83.100 1.00 0.00 ATOM 18740 OH2 SOL 1042 37.010 56.170 73.230 1.00 0.00 ATOM 18741 H1 SOL 1042 37.910 56.380 72.950 1.00 0.00 ATOM 18742 H2 SOL 1042 37.090 55.970 74.160 1.00 0.00 ATOM 18743 OH2 SOL 1043 0.600 34.200 65.540 1.00 0.00 ATOM 18744 H1 SOL 1043 0.250 35.020 65.190 1.00 0.00 ATOM 18745 H2 SOL 1043 -0.050 33.540 65.280 1.00 0.00 ATOM 18746 OH2 SOL 1044 39.400 19.760 5.160 1.00 0.00 ATOM 18747 H1 SOL 1044 39.550 19.580 4.230 1.00 0.00 ATOM 18748 H2 SOL 1044 39.550 20.700 5.240 1.00 0.00 ATOM 18749 OH2 SOL 1045 15.730 38.050 73.520 1.00 0.00 ATOM 18750 H1 SOL 1045 15.430 38.420 72.690 1.00 0.00 ATOM 18751 H2 SOL 1045 15.950 37.140 73.320 1.00 0.00 ATOM 18752 OH2 SOL 1046 56.470 2.960 13.380 1.00 0.00 ATOM 18753 H1 SOL 1046 56.330 2.080 13.050 1.00 0.00 ATOM 18754 H2 SOL 1046 57.410 3.100 13.310 1.00 0.00 ATOM 18755 OH2 SOL 1047 38.090 50.690 69.380 1.00 0.00 ATOM 18756 H1 SOL 1047 37.760 49.870 69.740 1.00 0.00 ATOM 18757 H2 SOL 1047 37.640 50.790 68.540 1.00 0.00 ATOM 18758 OH2 SOL 1048 26.480 50.600 81.790 1.00 0.00 ATOM 18759 H1 SOL 1048 26.320 51.200 82.520 1.00 0.00 ATOM 18760 H2 SOL 1048 27.040 51.100 81.190 1.00 0.00 ATOM 18761 OH2 SOL 1049 36.470 42.360 7.760 1.00 0.00 ATOM 18762 H1 SOL 1049 36.850 41.520 7.520 1.00 0.00 ATOM 18763 H2 SOL 1049 35.650 42.400 7.270 1.00 0.00 ATOM 18764 OH2 SOL 1050 33.520 36.660 74.590 1.00 0.00 ATOM 18765 H1 SOL 1050 32.910 35.970 74.820 1.00 0.00 ATOM 18766 H2 SOL 1050 34.340 36.200 74.380 1.00 0.00 ATOM 18767 OH2 SOL 1051 46.530 38.270 8.010 1.00 0.00 ATOM 18768 H1 SOL 1051 47.280 38.210 7.410 1.00 0.00 ATOM 18769 H2 SOL 1051 45.950 38.920 7.600 1.00 0.00 ATOM 18770 OH2 SOL 1052 44.210 8.360 81.640 1.00 0.00 ATOM 18771 H1 SOL 1052 43.900 7.750 80.970 1.00 0.00 ATOM 18772 H2 SOL 1052 43.410 8.790 81.950 1.00 0.00 ATOM 18773 OH2 SOL 1053 10.420 52.640 1.640 1.00 0.00 ATOM 18774 H1 SOL 1053 9.860 52.150 2.240 1.00 0.00 ATOM 18775 H2 SOL 1053 10.260 53.560 1.860 1.00 0.00 ATOM 18776 OH2 SOL 1054 8.540 58.280 26.120 1.00 0.00 ATOM 18777 H1 SOL 1054 9.160 57.650 25.760 1.00 0.00 ATOM 18778 H2 SOL 1054 9.070 59.040 26.340 1.00 0.00 ATOM 18779 OH2 SOL 1055 39.580 47.170 82.760 1.00 0.00 ATOM 18780 H1 SOL 1055 39.590 46.280 82.400 1.00 0.00 ATOM 18781 H2 SOL 1055 40.460 47.500 82.590 1.00 0.00 ATOM 18782 OH2 SOL 1056 51.850 53.250 6.660 1.00 0.00 ATOM 18783 H1 SOL 1056 52.330 54.060 6.460 1.00 0.00 ATOM 18784 H2 SOL 1056 52.420 52.790 7.280 1.00 0.00 ATOM 18785 OH2 SOL 1057 7.870 9.760 75.970 1.00 0.00 ATOM 18786 H1 SOL 1057 8.810 9.560 76.040 1.00 0.00 ATOM 18787 H2 SOL 1057 7.520 9.040 75.460 1.00 0.00 ATOM 18788 OH2 SOL 1058 56.720 46.250 74.640 1.00 0.00 ATOM 18789 H1 SOL 1058 57.130 45.380 74.680 1.00 0.00 ATOM 18790 H2 SOL 1058 57.310 46.800 75.160 1.00 0.00 ATOM 18791 OH2 SOL 1059 52.320 50.740 19.200 1.00 0.00 ATOM 18792 H1 SOL 1059 52.510 50.550 20.120 1.00 0.00 ATOM 18793 H2 SOL 1059 51.910 49.950 18.860 1.00 0.00 ATOM 18794 OH2 SOL 1060 37.190 16.790 15.250 1.00 0.00 ATOM 18795 H1 SOL 1060 37.230 17.310 14.440 1.00 0.00 ATOM 18796 H2 SOL 1060 37.000 15.900 14.950 1.00 0.00 ATOM 18797 OH2 SOL 1061 28.530 6.840 77.430 1.00 0.00 ATOM 18798 H1 SOL 1061 29.300 7.240 77.840 1.00 0.00 ATOM 18799 H2 SOL 1061 28.380 7.350 76.640 1.00 0.00 ATOM 18800 OH2 SOL 1062 18.660 23.630 80.980 1.00 0.00 ATOM 18801 H1 SOL 1062 18.590 24.100 81.820 1.00 0.00 ATOM 18802 H2 SOL 1062 18.250 24.210 80.350 1.00 0.00 ATOM 18803 OH2 SOL 1063 58.400 50.470 61.340 1.00 0.00 ATOM 18804 H1 SOL 1063 58.660 50.800 62.200 1.00 0.00 ATOM 18805 H2 SOL 1063 57.450 50.550 61.330 1.00 0.00 ATOM 18806 OH2 SOL 1064 11.960 54.110 9.350 1.00 0.00 ATOM 18807 H1 SOL 1064 11.110 54.070 9.780 1.00 0.00 ATOM 18808 H2 SOL 1064 12.590 54.200 10.060 1.00 0.00 ATOM 18809 OH2 SOL 1065 49.580 41.910 23.380 1.00 0.00 ATOM 18810 H1 SOL 1065 50.020 42.460 24.020 1.00 0.00 ATOM 18811 H2 SOL 1065 49.090 42.530 22.830 1.00 0.00 ATOM 18812 OH2 SOL 1066 39.960 33.660 3.040 1.00 0.00 ATOM 18813 H1 SOL 1066 40.860 33.980 3.040 1.00 0.00 ATOM 18814 H2 SOL 1066 39.510 34.220 2.410 1.00 0.00 ATOM 18815 OH2 SOL 1067 59.540 1.030 67.290 1.00 0.00 ATOM 18816 H1 SOL 1067 59.270 0.890 66.380 1.00 0.00 ATOM 18817 H2 SOL 1067 59.140 0.310 67.770 1.00 0.00 ATOM 18818 OH2 SOL 1068 26.940 9.500 3.470 1.00 0.00 ATOM 18819 H1 SOL 1068 27.400 9.950 4.180 1.00 0.00 ATOM 18820 H2 SOL 1068 26.160 10.020 3.310 1.00 0.00 ATOM 18821 OH2 SOL 1069 1.760 47.520 75.330 1.00 0.00 ATOM 18822 H1 SOL 1069 2.510 48.000 74.990 1.00 0.00 ATOM 18823 H2 SOL 1069 1.000 48.070 75.120 1.00 0.00 ATOM 18824 OH2 SOL 1070 44.020 12.820 84.240 1.00 0.00 ATOM 18825 H1 SOL 1070 43.390 12.730 83.530 1.00 0.00 ATOM 18826 H2 SOL 1070 44.700 12.170 84.050 1.00 0.00 ATOM 18827 OH2 SOL 1071 33.110 23.090 80.290 1.00 0.00 ATOM 18828 H1 SOL 1071 32.830 23.320 79.400 1.00 0.00 ATOM 18829 H2 SOL 1071 34.060 23.160 80.260 1.00 0.00 ATOM 18830 OH2 SOL 1072 25.430 45.810 69.360 1.00 0.00 ATOM 18831 H1 SOL 1072 25.590 45.190 68.640 1.00 0.00 ATOM 18832 H2 SOL 1072 26.270 46.230 69.500 1.00 0.00 ATOM 18833 OH2 SOL 1073 3.330 37.640 21.200 1.00 0.00 ATOM 18834 H1 SOL 1073 3.570 37.020 21.890 1.00 0.00 ATOM 18835 H2 SOL 1073 4.030 38.300 21.220 1.00 0.00 ATOM 18836 OH2 SOL 1074 26.580 3.730 77.350 1.00 0.00 ATOM 18837 H1 SOL 1074 27.180 3.780 76.600 1.00 0.00 ATOM 18838 H2 SOL 1074 25.740 4.040 77.010 1.00 0.00 ATOM 18839 OH2 SOL 1075 28.160 11.880 19.580 1.00 0.00 ATOM 18840 H1 SOL 1075 27.690 12.100 20.380 1.00 0.00 ATOM 18841 H2 SOL 1075 29.050 12.210 19.720 1.00 0.00 ATOM 18842 OH2 SOL 1076 30.600 38.910 15.330 1.00 0.00 ATOM 18843 H1 SOL 1076 31.370 38.830 14.780 1.00 0.00 ATOM 18844 H2 SOL 1076 30.930 39.240 16.170 1.00 0.00 ATOM 18845 OH2 SOL 1077 38.940 55.380 75.080 1.00 0.00 ATOM 18846 H1 SOL 1077 39.520 56.110 75.300 1.00 0.00 ATOM 18847 H2 SOL 1077 38.960 54.810 75.850 1.00 0.00 ATOM 18848 OH2 SOL 1078 2.740 23.570 4.570 1.00 0.00 ATOM 18849 H1 SOL 1078 3.370 23.340 5.250 1.00 0.00 ATOM 18850 H2 SOL 1078 3.280 23.920 3.860 1.00 0.00 ATOM 18851 OH2 SOL 1079 21.960 4.420 7.220 1.00 0.00 ATOM 18852 H1 SOL 1079 22.910 4.480 7.290 1.00 0.00 ATOM 18853 H2 SOL 1079 21.640 5.180 7.700 1.00 0.00 ATOM 18854 OH2 SOL 1080 46.810 37.830 70.490 1.00 0.00 ATOM 18855 H1 SOL 1080 46.900 37.290 71.270 1.00 0.00 ATOM 18856 H2 SOL 1080 46.160 38.490 70.730 1.00 0.00 ATOM 18857 OH2 SOL 1081 3.490 3.600 25.750 1.00 0.00 ATOM 18858 H1 SOL 1081 2.910 3.210 26.410 1.00 0.00 ATOM 18859 H2 SOL 1081 4.120 2.900 25.550 1.00 0.00 ATOM 18860 OH2 SOL 1082 25.870 8.680 12.590 1.00 0.00 ATOM 18861 H1 SOL 1082 26.260 8.280 13.370 1.00 0.00 ATOM 18862 H2 SOL 1082 25.920 9.620 12.760 1.00 0.00 ATOM 18863 OH2 SOL 1083 16.280 14.240 74.640 1.00 0.00 ATOM 18864 H1 SOL 1083 16.470 13.580 75.300 1.00 0.00 ATOM 18865 H2 SOL 1083 15.400 14.020 74.330 1.00 0.00 ATOM 18866 OH2 SOL 1084 25.200 24.750 10.610 1.00 0.00 ATOM 18867 H1 SOL 1084 25.020 24.120 11.310 1.00 0.00 ATOM 18868 H2 SOL 1084 25.430 24.220 9.850 1.00 0.00 ATOM 18869 OH2 SOL 1085 44.870 27.200 0.250 1.00 0.00 ATOM 18870 H1 SOL 1085 44.820 26.390 0.760 1.00 0.00 ATOM 18871 H2 SOL 1085 44.710 27.900 0.890 1.00 0.00 ATOM 18872 OH2 SOL 1086 28.440 17.540 81.740 1.00 0.00 ATOM 18873 H1 SOL 1086 28.570 18.460 81.970 1.00 0.00 ATOM 18874 H2 SOL 1086 27.890 17.560 80.960 1.00 0.00 ATOM 18875 OH2 SOL 1087 50.000 51.810 4.860 1.00 0.00 ATOM 18876 H1 SOL 1087 50.500 52.060 5.640 1.00 0.00 ATOM 18877 H2 SOL 1087 49.860 50.870 4.960 1.00 0.00 ATOM 18878 OH2 SOL 1088 44.720 33.380 23.240 1.00 0.00 ATOM 18879 H1 SOL 1088 45.380 34.080 23.240 1.00 0.00 ATOM 18880 H2 SOL 1088 43.940 33.780 22.880 1.00 0.00 ATOM 18881 OH2 SOL 1089 53.900 48.660 27.890 1.00 0.00 ATOM 18882 H1 SOL 1089 53.730 49.530 27.530 1.00 0.00 ATOM 18883 H2 SOL 1089 53.960 48.800 28.830 1.00 0.00 ATOM 18884 OH2 SOL 1090 8.470 9.450 11.750 1.00 0.00 ATOM 18885 H1 SOL 1090 8.950 8.840 12.310 1.00 0.00 ATOM 18886 H2 SOL 1090 7.950 8.890 11.170 1.00 0.00 ATOM 18887 OH2 SOL 1091 34.670 29.760 24.340 1.00 0.00 ATOM 18888 H1 SOL 1091 34.480 30.640 24.650 1.00 0.00 ATOM 18889 H2 SOL 1091 33.820 29.310 24.340 1.00 0.00 ATOM 18890 OH2 SOL 1092 50.960 14.090 70.490 1.00 0.00 ATOM 18891 H1 SOL 1092 50.060 13.760 70.560 1.00 0.00 ATOM 18892 H2 SOL 1092 51.030 14.400 69.590 1.00 0.00 ATOM 18893 OH2 SOL 1093 43.780 24.180 83.510 1.00 0.00 ATOM 18894 H1 SOL 1093 44.640 23.870 83.230 1.00 0.00 ATOM 18895 H2 SOL 1093 43.920 24.530 84.390 1.00 0.00 ATOM 18896 OH2 SOL 1094 31.080 42.640 22.580 1.00 0.00 ATOM 18897 H1 SOL 1094 31.100 42.130 23.390 1.00 0.00 ATOM 18898 H2 SOL 1094 30.420 43.310 22.730 1.00 0.00 ATOM 18899 OH2 SOL 1095 52.490 46.160 66.940 1.00 0.00 ATOM 18900 H1 SOL 1095 51.860 46.470 66.300 1.00 0.00 ATOM 18901 H2 SOL 1095 52.390 46.750 67.690 1.00 0.00 ATOM 18902 OH2 SOL 1096 22.830 25.520 83.760 1.00 0.00 ATOM 18903 H1 SOL 1096 22.780 25.860 82.870 1.00 0.00 ATOM 18904 H2 SOL 1096 23.550 24.890 83.740 1.00 0.00 ATOM 18905 OH2 SOL 1097 6.630 29.260 81.020 1.00 0.00 ATOM 18906 H1 SOL 1097 5.890 28.830 81.460 1.00 0.00 ATOM 18907 H2 SOL 1097 6.340 30.160 80.890 1.00 0.00 ATOM 18908 OH2 SOL 1098 21.740 9.170 0.960 1.00 0.00 ATOM 18909 H1 SOL 1098 22.150 8.500 1.500 1.00 0.00 ATOM 18910 H2 SOL 1098 22.190 9.110 0.110 1.00 0.00 ATOM 18911 OH2 SOL 1099 10.530 21.550 62.280 1.00 0.00 ATOM 18912 H1 SOL 1099 10.720 20.920 61.580 1.00 0.00 ATOM 18913 H2 SOL 1099 11.170 21.360 62.960 1.00 0.00 ATOM 18914 OH2 SOL 1100 11.000 47.450 67.780 1.00 0.00 ATOM 18915 H1 SOL 1100 11.260 47.660 66.880 1.00 0.00 ATOM 18916 H2 SOL 1100 10.570 48.250 68.090 1.00 0.00 ATOM 18917 OH2 SOL 1101 55.310 2.740 73.940 1.00 0.00 ATOM 18918 H1 SOL 1101 55.550 3.090 74.800 1.00 0.00 ATOM 18919 H2 SOL 1101 54.480 3.160 73.730 1.00 0.00 ATOM 18920 OH2 SOL 1102 2.900 58.800 83.430 1.00 0.00 ATOM 18921 H1 SOL 1102 3.610 58.480 82.870 1.00 0.00 ATOM 18922 H2 SOL 1102 2.890 58.180 84.160 1.00 0.00 ATOM 18923 OH2 SOL 1103 30.850 28.660 60.190 1.00 0.00 ATOM 18924 H1 SOL 1103 31.670 28.910 59.760 1.00 0.00 ATOM 18925 H2 SOL 1103 30.450 29.490 60.440 1.00 0.00 ATOM 18926 OH2 SOL 1104 36.420 3.670 8.320 1.00 0.00 ATOM 18927 H1 SOL 1104 36.640 3.510 7.410 1.00 0.00 ATOM 18928 H2 SOL 1104 36.410 2.800 8.720 1.00 0.00 ATOM 18929 OH2 SOL 1105 21.490 19.580 22.540 1.00 0.00 ATOM 18930 H1 SOL 1105 22.310 19.110 22.670 1.00 0.00 ATOM 18931 H2 SOL 1105 20.820 18.900 22.610 1.00 0.00 ATOM 18932 OH2 SOL 1106 9.360 3.670 4.440 1.00 0.00 ATOM 18933 H1 SOL 1106 9.940 3.410 5.160 1.00 0.00 ATOM 18934 H2 SOL 1106 8.870 2.870 4.230 1.00 0.00 ATOM 18935 OH2 SOL 1107 12.810 20.860 7.790 1.00 0.00 ATOM 18936 H1 SOL 1107 12.570 20.430 6.960 1.00 0.00 ATOM 18937 H2 SOL 1107 12.380 21.710 7.750 1.00 0.00 ATOM 18938 OH2 SOL 1108 14.650 40.000 71.840 1.00 0.00 ATOM 18939 H1 SOL 1108 13.700 40.020 71.950 1.00 0.00 ATOM 18940 H2 SOL 1108 14.970 40.690 72.420 1.00 0.00 ATOM 18941 OH2 SOL 1109 55.770 16.860 66.600 1.00 0.00 ATOM 18942 H1 SOL 1109 55.230 16.090 66.440 1.00 0.00 ATOM 18943 H2 SOL 1109 56.550 16.720 66.070 1.00 0.00 ATOM 18944 OH2 SOL 1110 0.620 28.610 83.820 1.00 0.00 ATOM 18945 H1 SOL 1110 -0.070 29.140 83.410 1.00 0.00 ATOM 18946 H2 SOL 1110 0.170 28.140 84.520 1.00 0.00 ATOM 18947 OH2 SOL 1111 8.360 58.030 67.260 1.00 0.00 ATOM 18948 H1 SOL 1111 9.160 58.550 67.160 1.00 0.00 ATOM 18949 H2 SOL 1111 8.040 57.910 66.370 1.00 0.00 ATOM 18950 OH2 SOL 1112 40.930 33.610 64.940 1.00 0.00 ATOM 18951 H1 SOL 1112 40.860 33.400 64.000 1.00 0.00 ATOM 18952 H2 SOL 1112 41.800 33.300 65.190 1.00 0.00 ATOM 18953 OH2 SOL 1113 26.920 22.050 14.620 1.00 0.00 ATOM 18954 H1 SOL 1113 26.300 21.760 13.940 1.00 0.00 ATOM 18955 H2 SOL 1113 26.860 23.000 14.610 1.00 0.00 ATOM 18956 OH2 SOL 1114 57.660 19.580 70.890 1.00 0.00 ATOM 18957 H1 SOL 1114 58.580 19.510 70.650 1.00 0.00 ATOM 18958 H2 SOL 1114 57.200 19.110 70.190 1.00 0.00 ATOM 18959 OH2 SOL 1115 7.750 11.260 19.840 1.00 0.00 ATOM 18960 H1 SOL 1115 8.030 12.170 19.760 1.00 0.00 ATOM 18961 H2 SOL 1115 7.080 11.270 20.520 1.00 0.00 ATOM 18962 OH2 SOL 1116 26.050 17.480 2.240 1.00 0.00 ATOM 18963 H1 SOL 1116 25.710 17.540 1.340 1.00 0.00 ATOM 18964 H2 SOL 1116 27.000 17.460 2.140 1.00 0.00 ATOM 18965 OH2 SOL 1117 3.500 38.790 82.080 1.00 0.00 ATOM 18966 H1 SOL 1117 3.910 39.640 82.180 1.00 0.00 ATOM 18967 H2 SOL 1117 3.700 38.320 82.890 1.00 0.00 ATOM 18968 OH2 SOL 1118 26.160 24.770 79.230 1.00 0.00 ATOM 18969 H1 SOL 1118 26.920 24.990 79.760 1.00 0.00 ATOM 18970 H2 SOL 1118 26.100 23.810 79.280 1.00 0.00 ATOM 18971 OH2 SOL 1119 54.650 36.450 7.870 1.00 0.00 ATOM 18972 H1 SOL 1119 53.800 36.020 7.920 1.00 0.00 ATOM 18973 H2 SOL 1119 55.270 35.790 8.170 1.00 0.00 ATOM 18974 OH2 SOL 1120 45.380 13.910 9.890 1.00 0.00 ATOM 18975 H1 SOL 1120 45.340 13.560 10.780 1.00 0.00 ATOM 18976 H2 SOL 1120 46.260 13.680 9.580 1.00 0.00 ATOM 18977 OH2 SOL 1121 11.220 9.360 76.290 1.00 0.00 ATOM 18978 H1 SOL 1121 11.970 9.630 75.760 1.00 0.00 ATOM 18979 H2 SOL 1121 11.360 8.420 76.450 1.00 0.00 ATOM 18980 OH2 SOL 1122 60.660 56.550 4.370 1.00 0.00 ATOM 18981 H1 SOL 1122 61.170 55.830 4.010 1.00 0.00 ATOM 18982 H2 SOL 1122 59.820 56.160 4.590 1.00 0.00 ATOM 18983 OH2 SOL 1123 0.190 49.030 16.220 1.00 0.00 ATOM 18984 H1 SOL 1123 0.000 48.380 15.540 1.00 0.00 ATOM 18985 H2 SOL 1123 1.120 48.900 16.420 1.00 0.00 ATOM 18986 OH2 SOL 1124 58.510 53.600 75.650 1.00 0.00 ATOM 18987 H1 SOL 1124 58.670 54.530 75.790 1.00 0.00 ATOM 18988 H2 SOL 1124 57.680 53.430 76.080 1.00 0.00 ATOM 18989 OH2 SOL 1125 55.740 3.100 19.960 1.00 0.00 ATOM 18990 H1 SOL 1125 56.430 2.450 19.860 1.00 0.00 ATOM 18991 H2 SOL 1125 55.160 2.730 20.620 1.00 0.00 ATOM 18992 OH2 SOL 1126 19.870 3.000 69.690 1.00 0.00 ATOM 18993 H1 SOL 1126 19.160 2.600 70.210 1.00 0.00 ATOM 18994 H2 SOL 1126 20.630 2.440 69.850 1.00 0.00 ATOM 18995 OH2 SOL 1127 23.090 21.130 13.720 1.00 0.00 ATOM 18996 H1 SOL 1127 23.240 20.410 14.330 1.00 0.00 ATOM 18997 H2 SOL 1127 22.930 21.890 14.270 1.00 0.00 ATOM 18998 OH2 SOL 1128 19.290 31.040 9.200 1.00 0.00 ATOM 18999 H1 SOL 1128 19.510 30.860 8.280 1.00 0.00 ATOM 19000 H2 SOL 1128 18.570 30.440 9.390 1.00 0.00 ATOM 19001 OH2 SOL 1129 18.470 36.140 70.850 1.00 0.00 ATOM 19002 H1 SOL 1129 19.080 35.770 71.490 1.00 0.00 ATOM 19003 H2 SOL 1129 17.610 35.860 71.140 1.00 0.00 ATOM 19004 OH2 SOL 1130 11.470 9.420 4.750 1.00 0.00 ATOM 19005 H1 SOL 1130 11.210 8.520 4.950 1.00 0.00 ATOM 19006 H2 SOL 1130 11.230 9.550 3.840 1.00 0.00 ATOM 19007 OH2 SOL 1131 13.610 1.870 66.440 1.00 0.00 ATOM 19008 H1 SOL 1131 14.360 1.990 65.850 1.00 0.00 ATOM 19009 H2 SOL 1131 13.950 1.320 67.150 1.00 0.00 ATOM 19010 OH2 SOL 1132 14.380 31.330 20.000 1.00 0.00 ATOM 19011 H1 SOL 1132 14.510 30.430 20.300 1.00 0.00 ATOM 19012 H2 SOL 1132 14.870 31.380 19.180 1.00 0.00 ATOM 19013 OH2 SOL 1133 24.380 1.720 68.700 1.00 0.00 ATOM 19014 H1 SOL 1133 24.270 2.170 67.860 1.00 0.00 ATOM 19015 H2 SOL 1133 23.550 1.840 69.150 1.00 0.00 ATOM 19016 OH2 SOL 1134 54.690 11.180 5.690 1.00 0.00 ATOM 19017 H1 SOL 1134 54.540 10.280 6.000 1.00 0.00 ATOM 19018 H2 SOL 1134 55.340 11.090 5.000 1.00 0.00 ATOM 19019 OH2 SOL 1135 59.800 36.500 17.070 1.00 0.00 ATOM 19020 H1 SOL 1135 59.140 37.180 17.000 1.00 0.00 ATOM 19021 H2 SOL 1135 60.070 36.510 17.990 1.00 0.00 ATOM 19022 OH2 SOL 1136 31.230 16.910 23.220 1.00 0.00 ATOM 19023 H1 SOL 1136 30.680 17.460 23.780 1.00 0.00 ATOM 19024 H2 SOL 1136 32.020 16.750 23.730 1.00 0.00 ATOM 19025 OH2 SOL 1137 50.410 16.230 2.170 1.00 0.00 ATOM 19026 H1 SOL 1137 50.310 15.540 2.830 1.00 0.00 ATOM 19027 H2 SOL 1137 50.600 15.750 1.360 1.00 0.00 ATOM 19028 OH2 SOL 1138 14.340 51.990 10.690 1.00 0.00 ATOM 19029 H1 SOL 1138 14.840 51.800 9.890 1.00 0.00 ATOM 19030 H2 SOL 1138 14.960 51.820 11.400 1.00 0.00 ATOM 19031 OH2 SOL 1139 31.610 24.600 82.310 1.00 0.00 ATOM 19032 H1 SOL 1139 32.000 23.890 81.800 1.00 0.00 ATOM 19033 H2 SOL 1139 32.350 25.010 82.770 1.00 0.00 ATOM 19034 OH2 SOL 1140 27.000 47.060 62.830 1.00 0.00 ATOM 19035 H1 SOL 1140 27.680 47.720 62.920 1.00 0.00 ATOM 19036 H2 SOL 1140 26.310 47.340 63.420 1.00 0.00 ATOM 19037 OH2 SOL 1141 47.060 54.200 0.820 1.00 0.00 ATOM 19038 H1 SOL 1141 46.350 53.740 1.270 1.00 0.00 ATOM 19039 H2 SOL 1141 46.730 55.090 0.700 1.00 0.00 ATOM 19040 OH2 SOL 1142 42.320 4.030 81.050 1.00 0.00 ATOM 19041 H1 SOL 1142 43.170 3.990 81.480 1.00 0.00 ATOM 19042 H2 SOL 1142 41.860 4.740 81.510 1.00 0.00 ATOM 19043 OH2 SOL 1143 1.290 50.410 60.640 1.00 0.00 ATOM 19044 H1 SOL 1143 0.530 50.310 60.070 1.00 0.00 ATOM 19045 H2 SOL 1143 1.820 49.630 60.470 1.00 0.00 ATOM 19046 OH2 SOL 1144 51.510 37.600 1.910 1.00 0.00 ATOM 19047 H1 SOL 1144 52.310 37.920 1.480 1.00 0.00 ATOM 19048 H2 SOL 1144 51.620 36.650 1.950 1.00 0.00 ATOM 19049 OH2 SOL 1145 44.080 47.260 3.460 1.00 0.00 ATOM 19050 H1 SOL 1145 43.770 46.460 3.890 1.00 0.00 ATOM 19051 H2 SOL 1145 43.290 47.630 3.060 1.00 0.00 ATOM 19052 OH2 SOL 1146 17.220 53.450 70.400 1.00 0.00 ATOM 19053 H1 SOL 1146 16.820 54.150 70.910 1.00 0.00 ATOM 19054 H2 SOL 1146 18.160 53.580 70.520 1.00 0.00 ATOM 19055 OH2 SOL 1147 24.990 50.750 2.580 1.00 0.00 ATOM 19056 H1 SOL 1147 25.770 50.250 2.330 1.00 0.00 ATOM 19057 H2 SOL 1147 24.280 50.110 2.580 1.00 0.00 ATOM 19058 OH2 SOL 1148 12.890 48.940 2.220 1.00 0.00 ATOM 19059 H1 SOL 1148 12.110 48.690 1.740 1.00 0.00 ATOM 19060 H2 SOL 1148 12.740 48.620 3.110 1.00 0.00 ATOM 19061 OH2 SOL 1149 35.690 28.810 72.730 1.00 0.00 ATOM 19062 H1 SOL 1149 36.310 29.450 72.370 1.00 0.00 ATOM 19063 H2 SOL 1149 34.870 28.980 72.270 1.00 0.00 ATOM 19064 OH2 SOL 1150 17.780 6.070 73.730 1.00 0.00 ATOM 19065 H1 SOL 1150 17.450 6.930 73.950 1.00 0.00 ATOM 19066 H2 SOL 1150 18.630 6.230 73.310 1.00 0.00 ATOM 19067 OH2 SOL 1151 15.210 35.060 13.370 1.00 0.00 ATOM 19068 H1 SOL 1151 15.250 35.480 12.510 1.00 0.00 ATOM 19069 H2 SOL 1151 16.090 34.690 13.490 1.00 0.00 ATOM 19070 OH2 SOL 1152 35.820 21.200 19.340 1.00 0.00 ATOM 19071 H1 SOL 1152 35.780 22.100 19.650 1.00 0.00 ATOM 19072 H2 SOL 1152 35.070 20.770 19.750 1.00 0.00 ATOM 19073 OH2 SOL 1153 33.100 20.690 82.200 1.00 0.00 ATOM 19074 H1 SOL 1153 33.540 21.000 82.990 1.00 0.00 ATOM 19075 H2 SOL 1153 32.920 21.490 81.690 1.00 0.00 ATOM 19076 OH2 SOL 1154 53.650 24.520 8.770 1.00 0.00 ATOM 19077 H1 SOL 1154 54.430 24.580 9.330 1.00 0.00 ATOM 19078 H2 SOL 1154 53.000 24.080 9.320 1.00 0.00 ATOM 19079 OH2 SOL 1155 27.480 23.840 28.230 1.00 0.00 ATOM 19080 H1 SOL 1155 27.330 22.940 27.960 1.00 0.00 ATOM 19081 H2 SOL 1155 28.210 24.150 27.700 1.00 0.00 ATOM 19082 OH2 SOL 1156 59.440 24.430 64.050 1.00 0.00 ATOM 19083 H1 SOL 1156 59.080 25.190 64.520 1.00 0.00 ATOM 19084 H2 SOL 1156 60.330 24.340 64.390 1.00 0.00 ATOM 19085 OH2 SOL 1157 50.400 22.670 75.220 1.00 0.00 ATOM 19086 H1 SOL 1157 50.740 21.800 74.990 1.00 0.00 ATOM 19087 H2 SOL 1157 49.710 22.840 74.580 1.00 0.00 ATOM 19088 OH2 SOL 1158 51.280 30.680 74.640 1.00 0.00 ATOM 19089 H1 SOL 1158 51.890 31.190 74.110 1.00 0.00 ATOM 19090 H2 SOL 1158 51.060 29.930 74.080 1.00 0.00 ATOM 19091 OH2 SOL 1159 36.020 22.920 64.280 1.00 0.00 ATOM 19092 H1 SOL 1159 36.190 22.400 65.070 1.00 0.00 ATOM 19093 H2 SOL 1159 35.720 23.760 64.610 1.00 0.00 ATOM 19094 OH2 SOL 1160 55.170 43.250 9.310 1.00 0.00 ATOM 19095 H1 SOL 1160 55.110 43.270 8.350 1.00 0.00 ATOM 19096 H2 SOL 1160 54.730 42.430 9.550 1.00 0.00 ATOM 19097 OH2 SOL 1161 20.230 46.990 20.330 1.00 0.00 ATOM 19098 H1 SOL 1161 19.740 46.630 19.590 1.00 0.00 ATOM 19099 H2 SOL 1161 20.260 46.270 20.970 1.00 0.00 ATOM 19100 OH2 SOL 1162 23.050 28.650 23.350 1.00 0.00 ATOM 19101 H1 SOL 1162 23.670 28.380 24.030 1.00 0.00 ATOM 19102 H2 SOL 1162 22.290 28.970 23.830 1.00 0.00 ATOM 19103 OH2 SOL 1163 60.570 10.900 69.290 1.00 0.00 ATOM 19104 H1 SOL 1163 60.810 10.610 68.410 1.00 0.00 ATOM 19105 H2 SOL 1163 60.070 11.710 69.150 1.00 0.00 ATOM 19106 OH2 SOL 1164 2.020 6.660 17.890 1.00 0.00 ATOM 19107 H1 SOL 1164 2.460 5.840 18.140 1.00 0.00 ATOM 19108 H2 SOL 1164 1.160 6.380 17.570 1.00 0.00 ATOM 19109 OH2 SOL 1165 25.480 9.880 73.770 1.00 0.00 ATOM 19110 H1 SOL 1165 26.430 9.930 73.790 1.00 0.00 ATOM 19111 H2 SOL 1165 25.290 8.950 73.940 1.00 0.00 ATOM 19112 OH2 SOL 1166 30.710 39.620 72.610 1.00 0.00 ATOM 19113 H1 SOL 1166 30.450 38.900 73.190 1.00 0.00 ATOM 19114 H2 SOL 1166 30.030 39.650 71.940 1.00 0.00 ATOM 19115 OH2 SOL 1167 21.980 10.170 63.870 1.00 0.00 ATOM 19116 H1 SOL 1167 22.720 10.570 64.330 1.00 0.00 ATOM 19117 H2 SOL 1167 21.730 10.820 63.210 1.00 0.00 ATOM 19118 OH2 SOL 1168 34.460 53.620 78.150 1.00 0.00 ATOM 19119 H1 SOL 1168 33.670 54.160 78.230 1.00 0.00 ATOM 19120 H2 SOL 1168 34.890 53.950 77.360 1.00 0.00 ATOM 19121 OH2 SOL 1169 58.230 47.730 64.540 1.00 0.00 ATOM 19122 H1 SOL 1169 58.750 48.000 63.780 1.00 0.00 ATOM 19123 H2 SOL 1169 58.560 46.860 64.750 1.00 0.00 ATOM 19124 OH2 SOL 1170 31.310 7.110 24.850 1.00 0.00 ATOM 19125 H1 SOL 1170 31.590 7.990 24.580 1.00 0.00 ATOM 19126 H2 SOL 1170 31.530 6.550 24.100 1.00 0.00 ATOM 19127 OH2 SOL 1171 25.140 34.320 10.550 1.00 0.00 ATOM 19128 H1 SOL 1171 25.150 34.640 11.460 1.00 0.00 ATOM 19129 H2 SOL 1171 25.360 35.090 10.020 1.00 0.00 ATOM 19130 OH2 SOL 1172 22.690 49.080 3.260 1.00 0.00 ATOM 19131 H1 SOL 1172 22.240 48.410 2.750 1.00 0.00 ATOM 19132 H2 SOL 1172 21.990 49.670 3.550 1.00 0.00 ATOM 19133 OH2 SOL 1173 8.930 5.940 2.510 1.00 0.00 ATOM 19134 H1 SOL 1173 9.620 5.720 1.880 1.00 0.00 ATOM 19135 H2 SOL 1173 8.670 5.090 2.880 1.00 0.00 ATOM 19136 OH2 SOL 1174 4.210 25.040 29.280 1.00 0.00 ATOM 19137 H1 SOL 1174 3.890 25.550 30.020 1.00 0.00 ATOM 19138 H2 SOL 1174 5.110 24.810 29.510 1.00 0.00 ATOM 19139 OH2 SOL 1175 54.080 56.950 69.510 1.00 0.00 ATOM 19140 H1 SOL 1175 54.490 57.680 69.980 1.00 0.00 ATOM 19141 H2 SOL 1175 54.400 56.170 69.960 1.00 0.00 ATOM 19142 OH2 SOL 1176 21.250 53.200 83.060 1.00 0.00 ATOM 19143 H1 SOL 1176 21.430 53.810 83.770 1.00 0.00 ATOM 19144 H2 SOL 1176 21.280 52.330 83.480 1.00 0.00 ATOM 19145 OH2 SOL 1177 33.970 2.540 76.250 1.00 0.00 ATOM 19146 H1 SOL 1177 33.950 3.480 76.430 1.00 0.00 ATOM 19147 H2 SOL 1177 34.880 2.370 75.980 1.00 0.00 ATOM 19148 OH2 SOL 1178 41.460 41.450 65.900 1.00 0.00 ATOM 19149 H1 SOL 1178 41.700 42.320 66.230 1.00 0.00 ATOM 19150 H2 SOL 1178 42.200 40.890 66.120 1.00 0.00 ATOM 19151 OH2 SOL 1179 1.810 36.380 78.550 1.00 0.00 ATOM 19152 H1 SOL 1179 2.130 37.230 78.860 1.00 0.00 ATOM 19153 H2 SOL 1179 1.050 36.200 79.100 1.00 0.00 ATOM 19154 OH2 SOL 1180 55.460 1.720 5.810 1.00 0.00 ATOM 19155 H1 SOL 1180 55.780 2.610 5.930 1.00 0.00 ATOM 19156 H2 SOL 1180 54.870 1.770 5.060 1.00 0.00 ATOM 19157 OH2 SOL 1181 39.540 48.640 73.660 1.00 0.00 ATOM 19158 H1 SOL 1181 39.300 47.750 73.420 1.00 0.00 ATOM 19159 H2 SOL 1181 38.710 49.050 73.900 1.00 0.00 ATOM 19160 OH2 SOL 1182 6.470 51.820 68.890 1.00 0.00 ATOM 19161 H1 SOL 1182 5.820 52.050 68.230 1.00 0.00 ATOM 19162 H2 SOL 1182 6.260 52.380 69.640 1.00 0.00 ATOM 19163 OH2 SOL 1183 48.630 28.370 1.660 1.00 0.00 ATOM 19164 H1 SOL 1183 48.560 27.660 1.020 1.00 0.00 ATOM 19165 H2 SOL 1183 49.090 27.980 2.400 1.00 0.00 ATOM 19166 OH2 SOL 1184 15.240 2.460 18.280 1.00 0.00 ATOM 19167 H1 SOL 1184 14.420 2.430 17.790 1.00 0.00 ATOM 19168 H2 SOL 1184 15.020 2.110 19.140 1.00 0.00 ATOM 19169 OH2 SOL 1185 47.210 54.100 9.470 1.00 0.00 ATOM 19170 H1 SOL 1185 46.680 53.430 9.910 1.00 0.00 ATOM 19171 H2 SOL 1185 48.010 53.650 9.220 1.00 0.00 ATOM 19172 OH2 SOL 1186 55.380 42.850 6.300 1.00 0.00 ATOM 19173 H1 SOL 1186 54.610 42.340 6.560 1.00 0.00 ATOM 19174 H2 SOL 1186 55.890 42.240 5.760 1.00 0.00 ATOM 19175 OH2 SOL 1187 44.010 0.230 73.070 1.00 0.00 ATOM 19176 H1 SOL 1187 43.300 0.720 72.660 1.00 0.00 ATOM 19177 H2 SOL 1187 43.690 -0.660 73.140 1.00 0.00 ATOM 19178 OH2 SOL 1188 29.770 29.250 11.300 1.00 0.00 ATOM 19179 H1 SOL 1188 29.020 29.150 10.720 1.00 0.00 ATOM 19180 H2 SOL 1188 30.270 29.970 10.930 1.00 0.00 ATOM 19181 OH2 SOL 1189 28.470 19.600 18.280 1.00 0.00 ATOM 19182 H1 SOL 1189 28.710 18.720 17.990 1.00 0.00 ATOM 19183 H2 SOL 1189 28.070 19.470 19.140 1.00 0.00 ATOM 19184 OH2 SOL 1190 42.870 20.470 23.230 1.00 0.00 ATOM 19185 H1 SOL 1190 42.460 19.640 22.970 1.00 0.00 ATOM 19186 H2 SOL 1190 42.180 20.940 23.690 1.00 0.00 ATOM 19187 OH2 SOL 1191 9.940 45.240 78.100 1.00 0.00 ATOM 19188 H1 SOL 1191 10.080 45.640 78.960 1.00 0.00 ATOM 19189 H2 SOL 1191 9.280 45.790 77.690 1.00 0.00 ATOM 19190 OH2 SOL 1192 14.560 25.840 0.770 1.00 0.00 ATOM 19191 H1 SOL 1192 15.230 25.180 0.630 1.00 0.00 ATOM 19192 H2 SOL 1192 15.040 26.630 1.020 1.00 0.00 ATOM 19193 OH2 SOL 1193 33.780 34.760 22.640 1.00 0.00 ATOM 19194 H1 SOL 1193 34.150 35.260 21.910 1.00 0.00 ATOM 19195 H2 SOL 1193 33.860 35.340 23.400 1.00 0.00 ATOM 19196 OH2 SOL 1194 7.750 6.640 71.060 1.00 0.00 ATOM 19197 H1 SOL 1194 6.960 7.140 70.860 1.00 0.00 ATOM 19198 H2 SOL 1194 7.430 5.780 71.320 1.00 0.00 ATOM 19199 OH2 SOL 1195 17.260 6.060 80.740 1.00 0.00 ATOM 19200 H1 SOL 1195 16.930 6.710 81.350 1.00 0.00 ATOM 19201 H2 SOL 1195 17.480 6.560 79.950 1.00 0.00 ATOM 19202 OH2 SOL 1196 60.190 50.270 59.420 1.00 0.00 ATOM 19203 H1 SOL 1196 59.730 50.720 58.710 1.00 0.00 ATOM 19204 H2 SOL 1196 59.590 50.330 60.170 1.00 0.00 ATOM 19205 OH2 SOL 1197 6.430 39.310 17.770 1.00 0.00 ATOM 19206 H1 SOL 1197 7.270 39.700 17.990 1.00 0.00 ATOM 19207 H2 SOL 1197 5.800 39.750 18.340 1.00 0.00 ATOM 19208 OH2 SOL 1198 53.090 43.620 77.750 1.00 0.00 ATOM 19209 H1 SOL 1198 53.770 44.040 77.230 1.00 0.00 ATOM 19210 H2 SOL 1198 52.530 44.340 78.050 1.00 0.00 ATOM 19211 OH2 SOL 1199 10.510 57.900 70.790 1.00 0.00 ATOM 19212 H1 SOL 1199 10.330 57.300 70.060 1.00 0.00 ATOM 19213 H2 SOL 1199 9.870 58.610 70.680 1.00 0.00 ATOM 19214 OH2 SOL 1200 9.150 35.050 2.940 1.00 0.00 ATOM 19215 H1 SOL 1200 8.470 34.620 2.420 1.00 0.00 ATOM 19216 H2 SOL 1200 9.960 34.840 2.480 1.00 0.00 ATOM 19217 OH2 SOL 1201 40.830 56.130 82.670 1.00 0.00 ATOM 19218 H1 SOL 1201 40.730 56.620 81.860 1.00 0.00 ATOM 19219 H2 SOL 1201 41.360 55.370 82.440 1.00 0.00 ATOM 19220 OH2 SOL 1202 27.270 41.820 22.880 1.00 0.00 ATOM 19221 H1 SOL 1202 26.590 42.300 22.420 1.00 0.00 ATOM 19222 H2 SOL 1202 27.570 41.160 22.260 1.00 0.00 ATOM 19223 OH2 SOL 1203 27.370 10.920 8.230 1.00 0.00 ATOM 19224 H1 SOL 1203 27.510 9.980 8.140 1.00 0.00 ATOM 19225 H2 SOL 1203 26.530 11.080 7.810 1.00 0.00 ATOM 19226 OH2 SOL 1204 48.900 3.900 73.880 1.00 0.00 ATOM 19227 H1 SOL 1204 48.870 2.950 73.910 1.00 0.00 ATOM 19228 H2 SOL 1204 49.650 4.110 73.330 1.00 0.00 ATOM 19229 OH2 SOL 1205 59.850 13.840 80.610 1.00 0.00 ATOM 19230 H1 SOL 1205 60.300 13.180 81.130 1.00 0.00 ATOM 19231 H2 SOL 1205 59.320 13.340 79.980 1.00 0.00 ATOM 19232 OH2 SOL 1206 49.360 17.010 12.480 1.00 0.00 ATOM 19233 H1 SOL 1206 50.260 17.130 12.770 1.00 0.00 ATOM 19234 H2 SOL 1206 48.830 17.450 13.140 1.00 0.00 ATOM 19235 OH2 SOL 1207 16.300 1.810 2.430 1.00 0.00 ATOM 19236 H1 SOL 1207 15.550 2.110 1.910 1.00 0.00 ATOM 19237 H2 SOL 1207 16.470 2.530 3.040 1.00 0.00 ATOM 19238 OH2 SOL 1208 17.270 46.660 1.190 1.00 0.00 ATOM 19239 H1 SOL 1208 17.290 47.030 0.310 1.00 0.00 ATOM 19240 H2 SOL 1208 16.420 46.930 1.540 1.00 0.00 ATOM 19241 OH2 SOL 1209 55.850 45.180 25.530 1.00 0.00 ATOM 19242 H1 SOL 1209 55.210 45.220 26.240 1.00 0.00 ATOM 19243 H2 SOL 1209 55.710 44.330 25.130 1.00 0.00 ATOM 19244 OH2 SOL 1210 28.240 55.700 71.710 1.00 0.00 ATOM 19245 H1 SOL 1210 27.760 55.890 72.510 1.00 0.00 ATOM 19246 H2 SOL 1210 27.970 56.390 71.100 1.00 0.00 ATOM 19247 OH2 SOL 1211 17.900 1.300 66.530 1.00 0.00 ATOM 19248 H1 SOL 1211 17.350 1.440 65.770 1.00 0.00 ATOM 19249 H2 SOL 1211 18.790 1.500 66.220 1.00 0.00 ATOM 19250 OH2 SOL 1212 46.140 34.710 16.660 1.00 0.00 ATOM 19251 H1 SOL 1212 45.850 34.170 15.930 1.00 0.00 ATOM 19252 H2 SOL 1212 46.320 35.570 16.270 1.00 0.00 ATOM 19253 OH2 SOL 1213 0.080 22.910 2.520 1.00 0.00 ATOM 19254 H1 SOL 1213 0.270 22.120 3.030 1.00 0.00 ATOM 19255 H2 SOL 1213 0.930 23.330 2.400 1.00 0.00 ATOM 19256 OH2 SOL 1214 35.530 25.000 26.510 1.00 0.00 ATOM 19257 H1 SOL 1214 35.730 25.510 27.300 1.00 0.00 ATOM 19258 H2 SOL 1214 35.870 24.130 26.700 1.00 0.00 ATOM 19259 OH2 SOL 1215 49.240 7.200 83.520 1.00 0.00 ATOM 19260 H1 SOL 1215 48.960 6.980 82.630 1.00 0.00 ATOM 19261 H2 SOL 1215 48.880 6.500 84.070 1.00 0.00 ATOM 19262 OH2 SOL 1216 33.260 54.360 18.020 1.00 0.00 ATOM 19263 H1 SOL 1216 33.240 54.030 17.120 1.00 0.00 ATOM 19264 H2 SOL 1216 34.070 54.870 18.070 1.00 0.00 ATOM 19265 OH2 SOL 1217 43.770 22.870 71.150 1.00 0.00 ATOM 19266 H1 SOL 1217 43.350 23.680 70.860 1.00 0.00 ATOM 19267 H2 SOL 1217 43.060 22.230 71.200 1.00 0.00 ATOM 19268 OH2 SOL 1218 29.000 33.900 72.780 1.00 0.00 ATOM 19269 H1 SOL 1218 28.080 33.880 72.520 1.00 0.00 ATOM 19270 H2 SOL 1218 29.170 34.820 73.000 1.00 0.00 ATOM 19271 OH2 SOL 1219 8.000 51.800 77.990 1.00 0.00 ATOM 19272 H1 SOL 1219 7.690 52.660 78.280 1.00 0.00 ATOM 19273 H2 SOL 1219 7.300 51.470 77.430 1.00 0.00 ATOM 19274 OH2 SOL 1220 29.980 38.670 19.500 1.00 0.00 ATOM 19275 H1 SOL 1220 30.380 39.490 19.790 1.00 0.00 ATOM 19276 H2 SOL 1220 30.670 38.220 19.010 1.00 0.00 ATOM 19277 OH2 SOL 1221 36.970 44.740 8.650 1.00 0.00 ATOM 19278 H1 SOL 1221 37.750 44.760 8.100 1.00 0.00 ATOM 19279 H2 SOL 1221 36.680 43.830 8.630 1.00 0.00 ATOM 19280 OH2 SOL 1222 15.650 23.290 81.690 1.00 0.00 ATOM 19281 H1 SOL 1222 16.050 22.780 80.980 1.00 0.00 ATOM 19282 H2 SOL 1222 16.310 23.300 82.380 1.00 0.00 ATOM 19283 OH2 SOL 1223 43.710 33.360 4.540 1.00 0.00 ATOM 19284 H1 SOL 1223 43.690 34.280 4.270 1.00 0.00 ATOM 19285 H2 SOL 1223 43.530 32.870 3.740 1.00 0.00 ATOM 19286 OH2 SOL 1224 10.120 13.110 73.270 1.00 0.00 ATOM 19287 H1 SOL 1224 11.030 12.930 73.030 1.00 0.00 ATOM 19288 H2 SOL 1224 9.670 12.270 73.150 1.00 0.00 ATOM 19289 OH2 SOL 1225 11.710 5.110 69.750 1.00 0.00 ATOM 19290 H1 SOL 1225 11.160 5.890 69.720 1.00 0.00 ATOM 19291 H2 SOL 1225 11.100 4.400 69.980 1.00 0.00 ATOM 19292 OH2 SOL 1226 15.270 57.820 2.810 1.00 0.00 ATOM 19293 H1 SOL 1226 15.390 58.670 3.250 1.00 0.00 ATOM 19294 H2 SOL 1226 15.750 57.200 3.360 1.00 0.00 ATOM 19295 OH2 SOL 1227 28.260 6.770 82.730 1.00 0.00 ATOM 19296 H1 SOL 1227 28.090 6.930 83.660 1.00 0.00 ATOM 19297 H2 SOL 1227 27.400 6.560 82.360 1.00 0.00 ATOM 19298 OH2 SOL 1228 19.440 0.760 14.480 1.00 0.00 ATOM 19299 H1 SOL 1228 19.370 1.540 13.920 1.00 0.00 ATOM 19300 H2 SOL 1228 20.270 0.360 14.220 1.00 0.00 ATOM 19301 OH2 SOL 1229 7.320 -0.100 77.550 1.00 0.00 ATOM 19302 H1 SOL 1229 7.470 -0.550 78.380 1.00 0.00 ATOM 19303 H2 SOL 1229 7.840 0.710 77.630 1.00 0.00 ATOM 19304 OH2 SOL 1230 17.670 4.790 76.540 1.00 0.00 ATOM 19305 H1 SOL 1230 16.810 5.090 76.830 1.00 0.00 ATOM 19306 H2 SOL 1230 17.720 5.040 75.620 1.00 0.00 ATOM 19307 OH2 SOL 1231 34.080 3.010 0.320 1.00 0.00 ATOM 19308 H1 SOL 1231 34.580 2.520 -0.330 1.00 0.00 ATOM 19309 H2 SOL 1231 33.370 2.410 0.580 1.00 0.00 ATOM 19310 OH2 SOL 1232 26.570 28.440 11.720 1.00 0.00 ATOM 19311 H1 SOL 1232 26.550 27.500 11.560 1.00 0.00 ATOM 19312 H2 SOL 1232 27.030 28.800 10.960 1.00 0.00 ATOM 19313 OH2 SOL 1233 14.640 44.940 70.890 1.00 0.00 ATOM 19314 H1 SOL 1233 13.790 45.380 70.920 1.00 0.00 ATOM 19315 H2 SOL 1233 15.080 45.210 71.700 1.00 0.00 ATOM 19316 OH2 SOL 1234 54.170 27.370 22.040 1.00 0.00 ATOM 19317 H1 SOL 1234 53.410 27.040 22.510 1.00 0.00 ATOM 19318 H2 SOL 1234 54.330 26.720 21.360 1.00 0.00 ATOM 19319 OH2 SOL 1235 0.120 20.410 17.970 1.00 0.00 ATOM 19320 H1 SOL 1235 0.180 19.640 17.400 1.00 0.00 ATOM 19321 H2 SOL 1235 1.020 20.730 18.020 1.00 0.00 ATOM 19322 OH2 SOL 1236 61.000 2.070 78.690 1.00 0.00 ATOM 19323 H1 SOL 1236 61.790 1.920 79.220 1.00 0.00 ATOM 19324 H2 SOL 1236 61.200 1.650 77.850 1.00 0.00 ATOM 19325 OH2 SOL 1237 8.650 22.950 7.760 1.00 0.00 ATOM 19326 H1 SOL 1237 7.890 23.330 7.340 1.00 0.00 ATOM 19327 H2 SOL 1237 9.130 22.510 7.060 1.00 0.00 ATOM 19328 OH2 SOL 1238 42.910 19.420 79.410 1.00 0.00 ATOM 19329 H1 SOL 1238 43.050 20.200 78.870 1.00 0.00 ATOM 19330 H2 SOL 1238 43.240 19.670 80.270 1.00 0.00 ATOM 19331 OH2 SOL 1239 56.530 8.790 6.350 1.00 0.00 ATOM 19332 H1 SOL 1239 55.730 8.780 6.880 1.00 0.00 ATOM 19333 H2 SOL 1239 56.620 7.900 6.020 1.00 0.00 ATOM 19334 OH2 SOL 1240 43.700 1.550 4.210 1.00 0.00 ATOM 19335 H1 SOL 1240 42.900 1.890 3.810 1.00 0.00 ATOM 19336 H2 SOL 1240 43.530 0.610 4.310 1.00 0.00 ATOM 19337 OH2 SOL 1241 51.020 58.390 4.630 1.00 0.00 ATOM 19338 H1 SOL 1241 50.120 58.420 4.290 1.00 0.00 ATOM 19339 H2 SOL 1241 50.930 58.020 5.510 1.00 0.00 ATOM 19340 OH2 SOL 1242 41.120 8.790 18.630 1.00 0.00 ATOM 19341 H1 SOL 1242 40.910 9.280 19.430 1.00 0.00 ATOM 19342 H2 SOL 1242 41.070 7.870 18.890 1.00 0.00 ATOM 19343 OH2 SOL 1243 44.880 4.880 82.460 1.00 0.00 ATOM 19344 H1 SOL 1243 44.440 5.520 83.010 1.00 0.00 ATOM 19345 H2 SOL 1243 44.960 4.100 83.010 1.00 0.00 ATOM 19346 OH2 SOL 1244 30.400 55.290 73.440 1.00 0.00 ATOM 19347 H1 SOL 1244 29.860 55.750 74.090 1.00 0.00 ATOM 19348 H2 SOL 1244 29.930 55.390 72.620 1.00 0.00 ATOM 19349 OH2 SOL 1245 35.030 20.260 16.950 1.00 0.00 ATOM 19350 H1 SOL 1245 35.650 20.730 16.400 1.00 0.00 ATOM 19351 H2 SOL 1245 35.200 20.590 17.840 1.00 0.00 ATOM 19352 OH2 SOL 1246 20.900 12.900 8.060 1.00 0.00 ATOM 19353 H1 SOL 1246 20.810 12.500 8.920 1.00 0.00 ATOM 19354 H2 SOL 1246 20.090 12.660 7.600 1.00 0.00 ATOM 19355 OH2 SOL 1247 54.000 13.970 77.380 1.00 0.00 ATOM 19356 H1 SOL 1247 53.250 14.550 77.510 1.00 0.00 ATOM 19357 H2 SOL 1247 53.780 13.470 76.590 1.00 0.00 ATOM 19358 OH2 SOL 1248 11.040 53.900 14.480 1.00 0.00 ATOM 19359 H1 SOL 1248 11.580 54.090 15.250 1.00 0.00 ATOM 19360 H2 SOL 1248 11.410 53.100 14.130 1.00 0.00 ATOM 19361 OH2 SOL 1249 51.890 51.910 77.830 1.00 0.00 ATOM 19362 H1 SOL 1249 51.000 51.590 77.770 1.00 0.00 ATOM 19363 H2 SOL 1249 51.900 52.430 78.640 1.00 0.00 ATOM 19364 OH2 SOL 1250 11.900 53.670 67.060 1.00 0.00 ATOM 19365 H1 SOL 1250 12.590 53.270 67.600 1.00 0.00 ATOM 19366 H2 SOL 1250 11.100 53.210 67.320 1.00 0.00 ATOM 19367 OH2 SOL 1251 6.540 5.820 81.900 1.00 0.00 ATOM 19368 H1 SOL 1251 6.550 4.880 82.060 1.00 0.00 ATOM 19369 H2 SOL 1251 7.450 6.040 81.700 1.00 0.00 ATOM 19370 OH2 SOL 1252 57.110 15.110 23.080 1.00 0.00 ATOM 19371 H1 SOL 1252 58.040 14.960 23.290 1.00 0.00 ATOM 19372 H2 SOL 1252 56.920 15.980 23.430 1.00 0.00 ATOM 19373 OH2 SOL 1253 0.510 17.150 2.000 1.00 0.00 ATOM 19374 H1 SOL 1253 1.040 17.020 1.220 1.00 0.00 ATOM 19375 H2 SOL 1253 0.300 16.270 2.300 1.00 0.00 ATOM 19376 OH2 SOL 1254 20.660 22.260 16.590 1.00 0.00 ATOM 19377 H1 SOL 1254 19.870 21.720 16.650 1.00 0.00 ATOM 19378 H2 SOL 1254 20.500 22.970 17.220 1.00 0.00 ATOM 19379 OH2 SOL 1255 41.340 10.910 83.220 1.00 0.00 ATOM 19380 H1 SOL 1255 41.060 10.120 83.670 1.00 0.00 ATOM 19381 H2 SOL 1255 40.660 11.550 83.400 1.00 0.00 ATOM 19382 OH2 SOL 1256 52.870 4.680 64.880 1.00 0.00 ATOM 19383 H1 SOL 1256 52.090 4.330 64.450 1.00 0.00 ATOM 19384 H2 SOL 1256 52.950 5.570 64.550 1.00 0.00 ATOM 19385 OH2 SOL 1257 28.720 40.570 76.080 1.00 0.00 ATOM 19386 H1 SOL 1257 29.510 40.210 76.480 1.00 0.00 ATOM 19387 H2 SOL 1257 28.380 39.860 75.530 1.00 0.00 ATOM 19388 OH2 SOL 1258 59.810 33.090 7.620 1.00 0.00 ATOM 19389 H1 SOL 1258 59.400 32.230 7.730 1.00 0.00 ATOM 19390 H2 SOL 1258 59.250 33.690 8.110 1.00 0.00 ATOM 19391 OH2 SOL 1259 47.540 9.420 69.590 1.00 0.00 ATOM 19392 H1 SOL 1259 47.520 8.540 69.970 1.00 0.00 ATOM 19393 H2 SOL 1259 47.660 9.270 68.650 1.00 0.00 ATOM 19394 OH2 SOL 1260 32.550 33.660 11.970 1.00 0.00 ATOM 19395 H1 SOL 1260 32.570 34.560 11.650 1.00 0.00 ATOM 19396 H2 SOL 1260 31.720 33.610 12.450 1.00 0.00 ATOM 19397 OH2 SOL 1261 22.020 35.020 17.250 1.00 0.00 ATOM 19398 H1 SOL 1261 21.960 34.490 16.460 1.00 0.00 ATOM 19399 H2 SOL 1261 21.490 34.550 17.900 1.00 0.00 ATOM 19400 OH2 SOL 1262 22.260 57.590 83.750 1.00 0.00 ATOM 19401 H1 SOL 1262 21.660 56.950 83.360 1.00 0.00 ATOM 19402 H2 SOL 1262 21.800 57.920 84.520 1.00 0.00 ATOM 19403 OH2 SOL 1263 59.460 23.010 68.320 1.00 0.00 ATOM 19404 H1 SOL 1263 59.530 22.480 69.120 1.00 0.00 ATOM 19405 H2 SOL 1263 58.650 23.500 68.430 1.00 0.00 ATOM 19406 OH2 SOL 1264 20.090 4.240 72.270 1.00 0.00 ATOM 19407 H1 SOL 1264 19.970 4.720 71.450 1.00 0.00 ATOM 19408 H2 SOL 1264 19.220 3.900 72.470 1.00 0.00 ATOM 19409 OH2 SOL 1265 46.630 56.380 3.420 1.00 0.00 ATOM 19410 H1 SOL 1265 46.980 55.550 3.750 1.00 0.00 ATOM 19411 H2 SOL 1265 45.700 56.200 3.280 1.00 0.00 ATOM 19412 OH2 SOL 1266 57.890 12.490 2.420 1.00 0.00 ATOM 19413 H1 SOL 1266 58.770 12.600 2.780 1.00 0.00 ATOM 19414 H2 SOL 1266 57.500 11.800 2.960 1.00 0.00 ATOM 19415 OH2 SOL 1267 19.660 15.310 10.720 1.00 0.00 ATOM 19416 H1 SOL 1267 18.720 15.230 10.510 1.00 0.00 ATOM 19417 H2 SOL 1267 19.980 15.990 10.130 1.00 0.00 ATOM 19418 OH2 SOL 1268 45.480 4.180 23.190 1.00 0.00 ATOM 19419 H1 SOL 1268 46.410 4.390 23.250 1.00 0.00 ATOM 19420 H2 SOL 1268 45.060 4.800 23.800 1.00 0.00 ATOM 19421 OH2 SOL 1269 44.520 15.000 18.120 1.00 0.00 ATOM 19422 H1 SOL 1269 43.590 14.770 18.050 1.00 0.00 ATOM 19423 H2 SOL 1269 44.640 15.710 17.490 1.00 0.00 ATOM 19424 OH2 SOL 1270 32.150 11.930 78.940 1.00 0.00 ATOM 19425 H1 SOL 1270 32.820 12.600 78.900 1.00 0.00 ATOM 19426 H2 SOL 1270 31.850 11.940 79.850 1.00 0.00 ATOM 19427 OH2 SOL 1271 29.150 42.710 10.190 1.00 0.00 ATOM 19428 H1 SOL 1271 29.930 43.180 9.880 1.00 0.00 ATOM 19429 H2 SOL 1271 28.420 43.130 9.730 1.00 0.00 ATOM 19430 OH2 SOL 1272 58.470 32.690 11.760 1.00 0.00 ATOM 19431 H1 SOL 1272 58.200 31.880 11.340 1.00 0.00 ATOM 19432 H2 SOL 1272 58.040 32.680 12.610 1.00 0.00 ATOM 19433 OH2 SOL 1273 32.950 54.040 24.620 1.00 0.00 ATOM 19434 H1 SOL 1273 32.000 54.150 24.580 1.00 0.00 ATOM 19435 H2 SOL 1273 33.230 54.680 25.270 1.00 0.00 ATOM 19436 OH2 SOL 1274 19.850 16.630 14.140 1.00 0.00 ATOM 19437 H1 SOL 1274 20.460 16.030 14.560 1.00 0.00 ATOM 19438 H2 SOL 1274 19.130 16.070 13.830 1.00 0.00 ATOM 19439 OH2 SOL 1275 33.700 41.640 14.830 1.00 0.00 ATOM 19440 H1 SOL 1275 33.480 41.780 13.910 1.00 0.00 ATOM 19441 H2 SOL 1275 33.410 42.440 15.270 1.00 0.00 ATOM 19442 OH2 SOL 1276 22.300 56.270 21.200 1.00 0.00 ATOM 19443 H1 SOL 1276 22.900 56.410 21.930 1.00 0.00 ATOM 19444 H2 SOL 1276 22.700 56.730 20.460 1.00 0.00 ATOM 19445 OH2 SOL 1277 35.370 38.390 78.790 1.00 0.00 ATOM 19446 H1 SOL 1277 35.130 39.310 78.900 1.00 0.00 ATOM 19447 H2 SOL 1277 36.240 38.420 78.380 1.00 0.00 ATOM 19448 OH2 SOL 1278 44.640 1.440 12.190 1.00 0.00 ATOM 19449 H1 SOL 1278 43.970 1.680 11.560 1.00 0.00 ATOM 19450 H2 SOL 1278 45.430 1.860 11.870 1.00 0.00 ATOM 19451 OH2 SOL 1279 7.680 49.290 15.400 1.00 0.00 ATOM 19452 H1 SOL 1279 7.550 50.000 14.780 1.00 0.00 ATOM 19453 H2 SOL 1279 8.620 49.090 15.330 1.00 0.00 ATOM 19454 OH2 SOL 1280 34.600 25.440 70.520 1.00 0.00 ATOM 19455 H1 SOL 1280 33.690 25.450 70.240 1.00 0.00 ATOM 19456 H2 SOL 1280 35.070 25.880 69.820 1.00 0.00 ATOM 19457 OH2 SOL 1281 42.850 28.420 4.420 1.00 0.00 ATOM 19458 H1 SOL 1281 43.080 27.490 4.420 1.00 0.00 ATOM 19459 H2 SOL 1281 43.440 28.810 5.060 1.00 0.00 ATOM 19460 OH2 SOL 1282 30.930 50.840 63.380 1.00 0.00 ATOM 19461 H1 SOL 1282 31.460 51.240 62.690 1.00 0.00 ATOM 19462 H2 SOL 1282 30.380 50.210 62.910 1.00 0.00 ATOM 19463 OH2 SOL 1283 19.180 6.040 16.420 1.00 0.00 ATOM 19464 H1 SOL 1283 18.440 5.460 16.590 1.00 0.00 ATOM 19465 H2 SOL 1283 19.420 5.850 15.520 1.00 0.00 ATOM 19466 OH2 SOL 1284 24.270 40.170 79.130 1.00 0.00 ATOM 19467 H1 SOL 1284 23.430 40.150 78.660 1.00 0.00 ATOM 19468 H2 SOL 1284 24.530 41.090 79.110 1.00 0.00 ATOM 19469 OH2 SOL 1285 53.510 51.990 8.620 1.00 0.00 ATOM 19470 H1 SOL 1285 53.150 52.500 9.340 1.00 0.00 ATOM 19471 H2 SOL 1285 53.570 51.100 8.960 1.00 0.00 ATOM 19472 OH2 SOL 1286 0.970 14.390 22.280 1.00 0.00 ATOM 19473 H1 SOL 1286 0.060 14.140 22.140 1.00 0.00 ATOM 19474 H2 SOL 1286 1.160 14.120 23.170 1.00 0.00 ATOM 19475 OH2 SOL 1287 41.060 50.790 77.540 1.00 0.00 ATOM 19476 H1 SOL 1287 41.990 50.790 77.320 1.00 0.00 ATOM 19477 H2 SOL 1287 40.970 50.100 78.190 1.00 0.00 ATOM 19478 OH2 SOL 1288 39.880 35.340 62.220 1.00 0.00 ATOM 19479 H1 SOL 1288 39.310 35.920 62.720 1.00 0.00 ATOM 19480 H2 SOL 1288 39.630 35.510 61.300 1.00 0.00 ATOM 19481 OH2 SOL 1289 32.260 50.970 81.350 1.00 0.00 ATOM 19482 H1 SOL 1289 31.740 50.970 80.540 1.00 0.00 ATOM 19483 H2 SOL 1289 32.110 51.840 81.720 1.00 0.00 ATOM 19484 OH2 SOL 1290 32.170 8.500 75.720 1.00 0.00 ATOM 19485 H1 SOL 1290 32.110 8.130 74.840 1.00 0.00 ATOM 19486 H2 SOL 1290 31.720 9.340 75.660 1.00 0.00 ATOM 19487 OH2 SOL 1291 59.110 21.090 7.340 1.00 0.00 ATOM 19488 H1 SOL 1291 58.310 21.400 7.760 1.00 0.00 ATOM 19489 H2 SOL 1291 59.350 21.780 6.730 1.00 0.00 ATOM 19490 OH2 SOL 1292 41.880 25.880 82.090 1.00 0.00 ATOM 19491 H1 SOL 1292 42.470 25.390 82.660 1.00 0.00 ATOM 19492 H2 SOL 1292 42.330 25.890 81.240 1.00 0.00 ATOM 19493 OH2 SOL 1293 43.540 11.460 16.820 1.00 0.00 ATOM 19494 H1 SOL 1293 44.250 11.630 17.430 1.00 0.00 ATOM 19495 H2 SOL 1293 43.520 10.510 16.730 1.00 0.00 ATOM 19496 OH2 SOL 1294 50.200 56.440 21.690 1.00 0.00 ATOM 19497 H1 SOL 1294 50.250 57.330 22.020 1.00 0.00 ATOM 19498 H2 SOL 1294 50.910 55.970 22.120 1.00 0.00 ATOM 19499 OH2 SOL 1295 9.110 35.390 75.470 1.00 0.00 ATOM 19500 H1 SOL 1295 8.850 35.940 76.210 1.00 0.00 ATOM 19501 H2 SOL 1295 8.560 34.610 75.540 1.00 0.00 ATOM 19502 OH2 SOL 1296 50.570 0.850 80.240 1.00 0.00 ATOM 19503 H1 SOL 1296 51.000 0.510 79.450 1.00 0.00 ATOM 19504 H2 SOL 1296 51.200 0.700 80.940 1.00 0.00 ATOM 19505 OH2 SOL 1297 10.970 21.430 16.800 1.00 0.00 ATOM 19506 H1 SOL 1297 10.340 20.730 16.940 1.00 0.00 ATOM 19507 H2 SOL 1297 10.450 22.230 16.710 1.00 0.00 ATOM 19508 OH2 SOL 1298 56.730 6.280 82.700 1.00 0.00 ATOM 19509 H1 SOL 1298 56.750 7.140 82.280 1.00 0.00 ATOM 19510 H2 SOL 1298 55.910 5.890 82.410 1.00 0.00 ATOM 19511 OH2 SOL 1299 0.870 53.840 82.860 1.00 0.00 ATOM 19512 H1 SOL 1299 -0.050 54.090 82.960 1.00 0.00 ATOM 19513 H2 SOL 1299 0.910 53.410 82.000 1.00 0.00 ATOM 19514 OH2 SOL 1300 24.210 30.170 69.470 1.00 0.00 ATOM 19515 H1 SOL 1300 23.270 30.240 69.590 1.00 0.00 ATOM 19516 H2 SOL 1300 24.390 29.230 69.460 1.00 0.00 ATOM 19517 OH2 SOL 1301 1.390 10.740 67.390 1.00 0.00 ATOM 19518 H1 SOL 1301 1.850 10.090 67.940 1.00 0.00 ATOM 19519 H2 SOL 1301 2.080 11.340 67.110 1.00 0.00 ATOM 19520 OH2 SOL 1302 53.470 49.930 21.680 1.00 0.00 ATOM 19521 H1 SOL 1302 53.500 50.420 22.510 1.00 0.00 ATOM 19522 H2 SOL 1302 54.350 50.030 21.310 1.00 0.00 ATOM 19523 OH2 SOL 1303 54.490 10.150 81.450 1.00 0.00 ATOM 19524 H1 SOL 1303 53.770 10.780 81.500 1.00 0.00 ATOM 19525 H2 SOL 1303 54.060 9.290 81.460 1.00 0.00 ATOM 19526 OH2 SOL 1304 39.480 45.960 72.580 1.00 0.00 ATOM 19527 H1 SOL 1304 38.720 45.640 73.060 1.00 0.00 ATOM 19528 H2 SOL 1304 39.980 45.180 72.350 1.00 0.00 ATOM 19529 OH2 SOL 1305 39.740 5.980 4.130 1.00 0.00 ATOM 19530 H1 SOL 1305 38.840 5.990 3.820 1.00 0.00 ATOM 19531 H2 SOL 1305 39.670 5.700 5.050 1.00 0.00 ATOM 19532 OH2 SOL 1306 20.620 2.450 11.980 1.00 0.00 ATOM 19533 H1 SOL 1306 20.200 1.780 11.440 1.00 0.00 ATOM 19534 H2 SOL 1306 20.200 3.270 11.720 1.00 0.00 ATOM 19535 OH2 SOL 1307 26.940 50.720 77.250 1.00 0.00 ATOM 19536 H1 SOL 1307 26.010 50.630 77.030 1.00 0.00 ATOM 19537 H2 SOL 1307 27.250 49.820 77.330 1.00 0.00 ATOM 19538 OH2 SOL 1308 0.450 19.530 68.010 1.00 0.00 ATOM 19539 H1 SOL 1308 0.900 20.370 67.890 1.00 0.00 ATOM 19540 H2 SOL 1308 0.370 19.180 67.120 1.00 0.00 ATOM 19541 OH2 SOL 1309 38.850 35.890 5.830 1.00 0.00 ATOM 19542 H1 SOL 1309 37.950 35.980 5.530 1.00 0.00 ATOM 19543 H2 SOL 1309 38.920 34.990 6.140 1.00 0.00 ATOM 19544 OH2 SOL 1310 46.960 28.880 13.700 1.00 0.00 ATOM 19545 H1 SOL 1310 46.890 28.410 14.530 1.00 0.00 ATOM 19546 H2 SOL 1310 46.720 28.230 13.030 1.00 0.00 ATOM 19547 OH2 SOL 1311 57.060 35.970 59.720 1.00 0.00 ATOM 19548 H1 SOL 1311 56.210 35.950 59.290 1.00 0.00 ATOM 19549 H2 SOL 1311 57.280 36.900 59.800 1.00 0.00 ATOM 19550 OH2 SOL 1312 46.070 40.650 72.480 1.00 0.00 ATOM 19551 H1 SOL 1312 45.450 41.200 72.970 1.00 0.00 ATOM 19552 H2 SOL 1312 45.530 40.220 71.830 1.00 0.00 ATOM 19553 OH2 SOL 1313 4.390 55.580 8.230 1.00 0.00 ATOM 19554 H1 SOL 1313 4.880 56.330 8.560 1.00 0.00 ATOM 19555 H2 SOL 1313 3.670 55.960 7.740 1.00 0.00 ATOM 19556 OH2 SOL 1314 10.120 49.630 69.120 1.00 0.00 ATOM 19557 H1 SOL 1314 9.370 49.200 69.540 1.00 0.00 ATOM 19558 H2 SOL 1314 10.670 49.920 69.840 1.00 0.00 ATOM 19559 OH2 SOL 1315 32.650 0.420 10.580 1.00 0.00 ATOM 19560 H1 SOL 1315 32.810 0.990 9.830 1.00 0.00 ATOM 19561 H2 SOL 1315 32.670 -0.460 10.230 1.00 0.00 ATOM 19562 OH2 SOL 1316 38.060 35.120 79.690 1.00 0.00 ATOM 19563 H1 SOL 1316 38.590 35.920 79.630 1.00 0.00 ATOM 19564 H2 SOL 1316 38.380 34.680 80.480 1.00 0.00 ATOM 19565 OH2 SOL 1317 31.190 27.540 64.320 1.00 0.00 ATOM 19566 H1 SOL 1317 31.990 28.070 64.310 1.00 0.00 ATOM 19567 H2 SOL 1317 31.110 27.220 63.420 1.00 0.00 ATOM 19568 OH2 SOL 1318 31.510 44.670 20.240 1.00 0.00 ATOM 19569 H1 SOL 1318 30.670 44.430 19.840 1.00 0.00 ATOM 19570 H2 SOL 1318 31.280 45.310 20.910 1.00 0.00 ATOM 19571 OH2 SOL 1319 31.410 45.780 0.650 1.00 0.00 ATOM 19572 H1 SOL 1319 32.020 45.140 0.290 1.00 0.00 ATOM 19573 H2 SOL 1319 31.490 45.670 1.600 1.00 0.00 ATOM 19574 OH2 SOL 1320 20.890 43.600 68.100 1.00 0.00 ATOM 19575 H1 SOL 1320 21.660 43.200 67.690 1.00 0.00 ATOM 19576 H2 SOL 1320 20.450 44.060 67.390 1.00 0.00 ATOM 19577 OH2 SOL 1321 31.320 40.220 0.520 1.00 0.00 ATOM 19578 H1 SOL 1321 30.970 39.580 -0.100 1.00 0.00 ATOM 19579 H2 SOL 1321 31.650 40.930 -0.030 1.00 0.00 ATOM 19580 OH2 SOL 1322 30.650 3.770 5.580 1.00 0.00 ATOM 19581 H1 SOL 1322 29.720 3.570 5.430 1.00 0.00 ATOM 19582 H2 SOL 1322 31.080 3.530 4.760 1.00 0.00 ATOM 19583 OH2 SOL 1323 41.850 56.660 25.120 1.00 0.00 ATOM 19584 H1 SOL 1323 41.870 57.110 25.960 1.00 0.00 ATOM 19585 H2 SOL 1323 41.660 57.360 24.490 1.00 0.00 ATOM 19586 OH2 SOL 1324 59.480 54.720 11.740 1.00 0.00 ATOM 19587 H1 SOL 1324 60.060 55.420 12.030 1.00 0.00 ATOM 19588 H2 SOL 1324 58.840 55.150 11.180 1.00 0.00 ATOM 19589 OH2 SOL 1325 31.370 43.550 8.530 1.00 0.00 ATOM 19590 H1 SOL 1325 31.100 43.040 7.760 1.00 0.00 ATOM 19591 H2 SOL 1325 31.910 42.950 9.030 1.00 0.00 ATOM 19592 OH2 SOL 1326 47.230 34.150 83.610 1.00 0.00 ATOM 19593 H1 SOL 1326 48.040 34.470 83.210 1.00 0.00 ATOM 19594 H2 SOL 1326 46.940 34.870 84.170 1.00 0.00 ATOM 19595 OH2 SOL 1327 27.430 55.060 78.280 1.00 0.00 ATOM 19596 H1 SOL 1327 27.840 54.880 77.440 1.00 0.00 ATOM 19597 H2 SOL 1327 26.510 55.240 78.060 1.00 0.00 ATOM 19598 OH2 SOL 1328 1.330 2.930 3.910 1.00 0.00 ATOM 19599 H1 SOL 1328 1.680 3.390 3.150 1.00 0.00 ATOM 19600 H2 SOL 1328 0.690 2.320 3.550 1.00 0.00 ATOM 19601 OH2 SOL 1329 59.110 43.890 16.690 1.00 0.00 ATOM 19602 H1 SOL 1329 59.850 44.440 16.940 1.00 0.00 ATOM 19603 H2 SOL 1329 59.430 43.000 16.800 1.00 0.00 ATOM 19604 OH2 SOL 1330 37.270 21.920 82.180 1.00 0.00 ATOM 19605 H1 SOL 1330 37.920 22.280 82.790 1.00 0.00 ATOM 19606 H2 SOL 1330 36.440 22.310 82.460 1.00 0.00 ATOM 19607 OH2 SOL 1331 32.340 37.290 18.370 1.00 0.00 ATOM 19608 H1 SOL 1331 33.200 37.370 18.790 1.00 0.00 ATOM 19609 H2 SOL 1331 32.400 36.500 17.840 1.00 0.00 ATOM 19610 OH2 SOL 1332 41.820 52.010 10.530 1.00 0.00 ATOM 19611 H1 SOL 1332 41.990 52.190 11.460 1.00 0.00 ATOM 19612 H2 SOL 1332 42.150 51.120 10.400 1.00 0.00 ATOM 19613 OH2 SOL 1333 10.740 45.530 5.000 1.00 0.00 ATOM 19614 H1 SOL 1333 10.680 46.470 5.180 1.00 0.00 ATOM 19615 H2 SOL 1333 10.750 45.470 4.040 1.00 0.00 ATOM 19616 OH2 SOL 1334 54.010 36.550 14.970 1.00 0.00 ATOM 19617 H1 SOL 1334 53.980 37.290 14.370 1.00 0.00 ATOM 19618 H2 SOL 1334 53.270 36.680 15.560 1.00 0.00 ATOM 19619 OH2 SOL 1335 2.120 33.490 15.860 1.00 0.00 ATOM 19620 H1 SOL 1335 2.220 34.090 16.590 1.00 0.00 ATOM 19621 H2 SOL 1335 2.860 33.700 15.270 1.00 0.00 ATOM 19622 OH2 SOL 1336 6.870 12.020 76.890 1.00 0.00 ATOM 19623 H1 SOL 1336 6.510 11.670 77.700 1.00 0.00 ATOM 19624 H2 SOL 1336 7.430 11.320 76.550 1.00 0.00 ATOM 19625 OH2 SOL 1337 54.970 55.650 10.480 1.00 0.00 ATOM 19626 H1 SOL 1337 54.100 55.770 10.110 1.00 0.00 ATOM 19627 H2 SOL 1337 54.990 56.220 11.250 1.00 0.00 ATOM 19628 OH2 SOL 1338 53.990 0.880 78.930 1.00 0.00 ATOM 19629 H1 SOL 1338 54.730 0.740 78.340 1.00 0.00 ATOM 19630 H2 SOL 1338 54.190 0.360 79.710 1.00 0.00 ATOM 19631 OH2 SOL 1339 21.920 42.130 0.900 1.00 0.00 ATOM 19632 H1 SOL 1339 22.720 42.460 0.500 1.00 0.00 ATOM 19633 H2 SOL 1339 22.090 41.200 1.040 1.00 0.00 ATOM 19634 OH2 SOL 1340 56.870 56.870 79.020 1.00 0.00 ATOM 19635 H1 SOL 1340 56.810 57.720 78.590 1.00 0.00 ATOM 19636 H2 SOL 1340 56.420 57.000 79.860 1.00 0.00 ATOM 19637 OH2 SOL 1341 7.000 2.830 18.430 1.00 0.00 ATOM 19638 H1 SOL 1341 6.620 2.010 18.110 1.00 0.00 ATOM 19639 H2 SOL 1341 6.430 3.520 18.070 1.00 0.00 ATOM 19640 OH2 SOL 1342 41.190 53.540 77.330 1.00 0.00 ATOM 19641 H1 SOL 1342 40.250 53.710 77.260 1.00 0.00 ATOM 19642 H2 SOL 1342 41.250 52.610 77.530 1.00 0.00 ATOM 19643 OH2 SOL 1343 38.300 45.480 1.010 1.00 0.00 ATOM 19644 H1 SOL 1343 38.850 46.100 0.530 1.00 0.00 ATOM 19645 H2 SOL 1343 38.590 44.620 0.720 1.00 0.00 ATOM 19646 OH2 SOL 1344 25.620 43.970 2.440 1.00 0.00 ATOM 19647 H1 SOL 1344 25.030 43.470 3.020 1.00 0.00 ATOM 19648 H2 SOL 1344 25.080 44.690 2.130 1.00 0.00 ATOM 19649 OH2 SOL 1345 46.030 33.690 6.620 1.00 0.00 ATOM 19650 H1 SOL 1345 45.470 34.190 6.020 1.00 0.00 ATOM 19651 H2 SOL 1345 46.150 34.280 7.360 1.00 0.00 ATOM 19652 OH2 SOL 1346 24.840 42.860 11.230 1.00 0.00 ATOM 19653 H1 SOL 1346 25.540 43.020 10.600 1.00 0.00 ATOM 19654 H2 SOL 1346 25.000 41.970 11.550 1.00 0.00 ATOM 19655 OH2 SOL 1347 27.850 36.960 19.680 1.00 0.00 ATOM 19656 H1 SOL 1347 28.500 37.650 19.770 1.00 0.00 ATOM 19657 H2 SOL 1347 27.150 37.360 19.170 1.00 0.00 ATOM 19658 OH2 SOL 1348 7.580 16.760 70.970 1.00 0.00 ATOM 19659 H1 SOL 1348 8.230 16.090 71.160 1.00 0.00 ATOM 19660 H2 SOL 1348 7.900 17.180 70.170 1.00 0.00 ATOM 19661 OH2 SOL 1349 59.100 48.860 80.810 1.00 0.00 ATOM 19662 H1 SOL 1349 59.260 48.700 79.880 1.00 0.00 ATOM 19663 H2 SOL 1349 58.920 49.800 80.870 1.00 0.00 ATOM 19664 OH2 SOL 1350 23.720 21.550 3.560 1.00 0.00 ATOM 19665 H1 SOL 1350 23.140 21.560 4.320 1.00 0.00 ATOM 19666 H2 SOL 1350 24.060 20.660 3.540 1.00 0.00 ATOM 19667 OH2 SOL 1351 4.600 0.240 6.670 1.00 0.00 ATOM 19668 H1 SOL 1351 4.910 -0.160 5.850 1.00 0.00 ATOM 19669 H2 SOL 1351 3.730 0.580 6.450 1.00 0.00 ATOM 19670 OH2 SOL 1352 1.500 39.140 80.160 1.00 0.00 ATOM 19671 H1 SOL 1352 0.700 39.090 80.670 1.00 0.00 ATOM 19672 H2 SOL 1352 2.190 38.840 80.760 1.00 0.00 ATOM 19673 OH2 SOL 1353 37.900 25.520 10.410 1.00 0.00 ATOM 19674 H1 SOL 1353 36.950 25.420 10.470 1.00 0.00 ATOM 19675 H2 SOL 1353 38.030 26.320 9.890 1.00 0.00 ATOM 19676 OH2 SOL 1354 7.410 55.390 7.390 1.00 0.00 ATOM 19677 H1 SOL 1354 6.510 55.410 7.700 1.00 0.00 ATOM 19678 H2 SOL 1354 7.830 56.140 7.830 1.00 0.00 ATOM 19679 OH2 SOL 1355 46.470 7.940 26.280 1.00 0.00 ATOM 19680 H1 SOL 1355 46.300 7.240 26.910 1.00 0.00 ATOM 19681 H2 SOL 1355 47.170 7.600 25.730 1.00 0.00 ATOM 19682 OH2 SOL 1356 46.340 44.610 72.470 1.00 0.00 ATOM 19683 H1 SOL 1356 46.630 44.180 71.670 1.00 0.00 ATOM 19684 H2 SOL 1356 46.800 44.160 73.170 1.00 0.00 ATOM 19685 OH2 SOL 1357 47.020 43.180 70.150 1.00 0.00 ATOM 19686 H1 SOL 1357 46.290 43.760 69.970 1.00 0.00 ATOM 19687 H2 SOL 1357 47.340 42.910 69.290 1.00 0.00 ATOM 19688 OH2 SOL 1358 10.380 2.250 6.990 1.00 0.00 ATOM 19689 H1 SOL 1358 10.490 1.490 6.410 1.00 0.00 ATOM 19690 H2 SOL 1358 11.210 2.310 7.460 1.00 0.00 ATOM 19691 OH2 SOL 1359 18.840 45.770 18.550 1.00 0.00 ATOM 19692 H1 SOL 1359 18.730 44.920 18.120 1.00 0.00 ATOM 19693 H2 SOL 1359 18.040 46.260 18.340 1.00 0.00 ATOM 19694 OH2 SOL 1360 60.930 3.670 1.820 1.00 0.00 ATOM 19695 H1 SOL 1360 60.700 4.070 2.660 1.00 0.00 ATOM 19696 H2 SOL 1360 60.130 3.240 1.530 1.00 0.00 ATOM 19697 OH2 SOL 1361 11.280 15.760 14.880 1.00 0.00 ATOM 19698 H1 SOL 1361 11.570 14.850 14.850 1.00 0.00 ATOM 19699 H2 SOL 1361 11.860 16.210 14.260 1.00 0.00 ATOM 19700 OH2 SOL 1362 43.550 3.060 26.770 1.00 0.00 ATOM 19701 H1 SOL 1362 43.270 2.400 27.400 1.00 0.00 ATOM 19702 H2 SOL 1362 42.740 3.480 26.480 1.00 0.00 ATOM 19703 OH2 SOL 1363 16.360 9.790 7.410 1.00 0.00 ATOM 19704 H1 SOL 1363 15.730 10.510 7.340 1.00 0.00 ATOM 19705 H2 SOL 1363 16.470 9.470 6.520 1.00 0.00 ATOM 19706 OH2 SOL 1364 60.300 22.770 9.830 1.00 0.00 ATOM 19707 H1 SOL 1364 59.910 23.110 9.030 1.00 0.00 ATOM 19708 H2 SOL 1364 59.740 22.040 10.080 1.00 0.00 ATOM 19709 OH2 SOL 1365 47.450 27.940 71.630 1.00 0.00 ATOM 19710 H1 SOL 1365 46.680 27.480 71.300 1.00 0.00 ATOM 19711 H2 SOL 1365 48.180 27.330 71.480 1.00 0.00 ATOM 19712 OH2 SOL 1366 42.570 3.040 18.160 1.00 0.00 ATOM 19713 H1 SOL 1366 43.260 2.510 18.560 1.00 0.00 ATOM 19714 H2 SOL 1366 41.850 3.020 18.780 1.00 0.00 ATOM 19715 OH2 SOL 1367 27.390 21.120 72.570 1.00 0.00 ATOM 19716 H1 SOL 1367 28.180 21.660 72.630 1.00 0.00 ATOM 19717 H2 SOL 1367 27.240 20.800 73.460 1.00 0.00 ATOM 19718 OH2 SOL 1368 44.480 0.200 68.910 1.00 0.00 ATOM 19719 H1 SOL 1368 45.260 0.300 69.450 1.00 0.00 ATOM 19720 H2 SOL 1368 43.750 0.450 69.480 1.00 0.00 ATOM 19721 OH2 SOL 1369 48.900 3.860 68.520 1.00 0.00 ATOM 19722 H1 SOL 1369 48.800 4.740 68.160 1.00 0.00 ATOM 19723 H2 SOL 1369 49.790 3.600 68.280 1.00 0.00 ATOM 19724 OH2 SOL 1370 56.640 4.510 79.790 1.00 0.00 ATOM 19725 H1 SOL 1370 56.910 5.190 80.410 1.00 0.00 ATOM 19726 H2 SOL 1370 55.830 4.150 80.160 1.00 0.00 ATOM 19727 OH2 SOL 1371 27.450 40.480 3.320 1.00 0.00 ATOM 19728 H1 SOL 1371 27.150 39.600 3.090 1.00 0.00 ATOM 19729 H2 SOL 1371 27.840 40.820 2.510 1.00 0.00 ATOM 19730 OH2 SOL 1372 35.450 55.110 15.270 1.00 0.00 ATOM 19731 H1 SOL 1372 36.290 55.310 14.860 1.00 0.00 ATOM 19732 H2 SOL 1372 35.290 55.840 15.870 1.00 0.00 ATOM 19733 OH2 SOL 1373 8.920 43.510 2.290 1.00 0.00 ATOM 19734 H1 SOL 1373 8.170 43.930 1.880 1.00 0.00 ATOM 19735 H2 SOL 1373 8.810 43.670 3.230 1.00 0.00 ATOM 19736 OH2 SOL 1374 14.430 54.390 2.650 1.00 0.00 ATOM 19737 H1 SOL 1374 13.910 55.070 3.100 1.00 0.00 ATOM 19738 H2 SOL 1374 14.080 54.370 1.760 1.00 0.00 ATOM 19739 OH2 SOL 1375 20.450 23.720 1.090 1.00 0.00 ATOM 19740 H1 SOL 1375 19.720 23.120 1.270 1.00 0.00 ATOM 19741 H2 SOL 1375 20.920 23.770 1.920 1.00 0.00 ATOM 19742 OH2 SOL 1376 4.290 22.990 11.570 1.00 0.00 ATOM 19743 H1 SOL 1376 4.420 22.070 11.330 1.00 0.00 ATOM 19744 H2 SOL 1376 3.430 23.010 11.990 1.00 0.00 ATOM 19745 OH2 SOL 1377 39.340 3.050 76.390 1.00 0.00 ATOM 19746 H1 SOL 1377 39.700 2.630 77.170 1.00 0.00 ATOM 19747 H2 SOL 1377 39.280 3.980 76.620 1.00 0.00 ATOM 19748 OH2 SOL 1378 21.330 6.820 8.540 1.00 0.00 ATOM 19749 H1 SOL 1378 22.100 7.330 8.280 1.00 0.00 ATOM 19750 H2 SOL 1378 20.680 7.470 8.810 1.00 0.00 ATOM 19751 OH2 SOL 1379 60.590 35.470 5.510 1.00 0.00 ATOM 19752 H1 SOL 1379 60.890 34.730 6.040 1.00 0.00 ATOM 19753 H2 SOL 1379 61.090 35.400 4.700 1.00 0.00 ATOM 19754 OH2 SOL 1380 9.520 4.730 10.030 1.00 0.00 ATOM 19755 H1 SOL 1380 10.400 4.680 10.400 1.00 0.00 ATOM 19756 H2 SOL 1380 9.530 5.520 9.490 1.00 0.00 ATOM 19757 OH2 SOL 1381 59.050 6.850 17.960 1.00 0.00 ATOM 19758 H1 SOL 1381 59.100 7.070 18.890 1.00 0.00 ATOM 19759 H2 SOL 1381 58.650 7.620 17.550 1.00 0.00 ATOM 19760 OH2 SOL 1382 41.880 5.800 75.810 1.00 0.00 ATOM 19761 H1 SOL 1382 42.070 5.110 76.440 1.00 0.00 ATOM 19762 H2 SOL 1382 41.090 6.230 76.150 1.00 0.00 ATOM 19763 OH2 SOL 1383 37.170 34.150 67.360 1.00 0.00 ATOM 19764 H1 SOL 1383 37.650 34.860 66.930 1.00 0.00 ATOM 19765 H2 SOL 1383 37.070 33.490 66.680 1.00 0.00 ATOM 19766 OH2 SOL 1384 58.750 40.710 19.400 1.00 0.00 ATOM 19767 H1 SOL 1384 59.250 41.240 20.030 1.00 0.00 ATOM 19768 H2 SOL 1384 57.860 41.050 19.450 1.00 0.00 ATOM 19769 OH2 SOL 1385 52.760 7.060 63.250 1.00 0.00 ATOM 19770 H1 SOL 1385 51.930 7.350 62.890 1.00 0.00 ATOM 19771 H2 SOL 1385 53.230 7.870 63.440 1.00 0.00 ATOM 19772 OH2 SOL 1386 56.890 30.810 4.730 1.00 0.00 ATOM 19773 H1 SOL 1386 57.700 31.320 4.700 1.00 0.00 ATOM 19774 H2 SOL 1386 56.280 31.370 5.220 1.00 0.00 ATOM 19775 OH2 SOL 1387 40.350 25.870 67.370 1.00 0.00 ATOM 19776 H1 SOL 1387 39.670 25.990 68.030 1.00 0.00 ATOM 19777 H2 SOL 1387 40.000 25.200 66.790 1.00 0.00 ATOM 19778 OH2 SOL 1388 46.580 7.510 14.990 1.00 0.00 ATOM 19779 H1 SOL 1388 47.010 7.040 14.270 1.00 0.00 ATOM 19780 H2 SOL 1388 46.870 8.410 14.900 1.00 0.00 ATOM 19781 OH2 SOL 1389 0.130 26.830 80.140 1.00 0.00 ATOM 19782 H1 SOL 1389 -0.480 27.560 80.140 1.00 0.00 ATOM 19783 H2 SOL 1389 0.850 27.130 79.580 1.00 0.00 ATOM 19784 OH2 SOL 1390 55.270 19.620 8.030 1.00 0.00 ATOM 19785 H1 SOL 1390 55.660 19.800 8.890 1.00 0.00 ATOM 19786 H2 SOL 1390 55.190 20.470 7.610 1.00 0.00 ATOM 19787 OH2 SOL 1391 40.810 11.530 28.530 1.00 0.00 ATOM 19788 H1 SOL 1391 41.530 11.310 29.130 1.00 0.00 ATOM 19789 H2 SOL 1391 40.290 12.170 29.020 1.00 0.00 ATOM 19790 OH2 SOL 1392 34.680 19.660 23.570 1.00 0.00 ATOM 19791 H1 SOL 1392 34.270 20.140 22.850 1.00 0.00 ATOM 19792 H2 SOL 1392 34.060 19.760 24.300 1.00 0.00 ATOM 19793 OH2 SOL 1393 21.580 23.090 8.560 1.00 0.00 ATOM 19794 H1 SOL 1393 20.810 22.760 8.080 1.00 0.00 ATOM 19795 H2 SOL 1393 21.210 23.510 9.330 1.00 0.00 ATOM 19796 OH2 SOL 1394 52.640 47.700 20.280 1.00 0.00 ATOM 19797 H1 SOL 1394 53.560 47.490 20.100 1.00 0.00 ATOM 19798 H2 SOL 1394 52.680 48.440 20.890 1.00 0.00 ATOM 19799 OH2 SOL 1395 16.150 8.080 9.420 1.00 0.00 ATOM 19800 H1 SOL 1395 16.170 8.480 8.550 1.00 0.00 ATOM 19801 H2 SOL 1395 15.660 8.700 9.960 1.00 0.00 ATOM 19802 OH2 SOL 1396 48.520 51.610 8.010 1.00 0.00 ATOM 19803 H1 SOL 1396 49.110 52.360 8.000 1.00 0.00 ATOM 19804 H2 SOL 1396 47.920 51.770 7.280 1.00 0.00 ATOM 19805 OH2 SOL 1397 12.160 44.530 1.450 1.00 0.00 ATOM 19806 H1 SOL 1397 11.370 44.010 1.320 1.00 0.00 ATOM 19807 H2 SOL 1397 11.880 45.270 1.980 1.00 0.00 ATOM 19808 OH2 SOL 1398 54.410 54.560 70.670 1.00 0.00 ATOM 19809 H1 SOL 1398 53.680 54.140 70.210 1.00 0.00 ATOM 19810 H2 SOL 1398 54.070 54.760 71.540 1.00 0.00 ATOM 19811 OH2 SOL 1399 27.120 49.920 15.170 1.00 0.00 ATOM 19812 H1 SOL 1399 26.550 50.050 14.420 1.00 0.00 ATOM 19813 H2 SOL 1399 27.510 49.050 15.030 1.00 0.00 ATOM 19814 OH2 SOL 1400 5.310 58.000 9.080 1.00 0.00 ATOM 19815 H1 SOL 1400 5.210 58.450 8.240 1.00 0.00 ATOM 19816 H2 SOL 1400 5.200 58.690 9.730 1.00 0.00 ATOM 19817 OH2 SOL 1401 28.530 26.140 64.240 1.00 0.00 ATOM 19818 H1 SOL 1401 28.570 26.300 63.290 1.00 0.00 ATOM 19819 H2 SOL 1401 29.260 26.640 64.590 1.00 0.00 ATOM 19820 OH2 SOL 1402 5.270 22.820 68.210 1.00 0.00 ATOM 19821 H1 SOL 1402 5.980 23.180 67.690 1.00 0.00 ATOM 19822 H2 SOL 1402 4.560 22.690 67.580 1.00 0.00 ATOM 19823 OH2 SOL 1403 2.140 22.940 73.300 1.00 0.00 ATOM 19824 H1 SOL 1403 2.430 22.040 73.380 1.00 0.00 ATOM 19825 H2 SOL 1403 2.850 23.390 72.840 1.00 0.00 ATOM 19826 OH2 SOL 1404 31.390 51.800 65.770 1.00 0.00 ATOM 19827 H1 SOL 1404 31.190 51.400 64.920 1.00 0.00 ATOM 19828 H2 SOL 1404 32.130 52.370 65.600 1.00 0.00 ATOM 19829 OH2 SOL 1405 26.480 38.070 2.030 1.00 0.00 ATOM 19830 H1 SOL 1405 26.700 37.860 1.120 1.00 0.00 ATOM 19831 H2 SOL 1405 26.710 37.290 2.530 1.00 0.00 ATOM 19832 OH2 SOL 1406 36.710 20.610 70.210 1.00 0.00 ATOM 19833 H1 SOL 1406 36.850 20.280 69.320 1.00 0.00 ATOM 19834 H2 SOL 1406 36.630 21.560 70.100 1.00 0.00 ATOM 19835 OH2 SOL 1407 16.020 45.780 73.060 1.00 0.00 ATOM 19836 H1 SOL 1407 16.470 45.100 73.550 1.00 0.00 ATOM 19837 H2 SOL 1407 16.720 46.350 72.740 1.00 0.00 ATOM 19838 OH2 SOL 1408 20.550 42.940 3.070 1.00 0.00 ATOM 19839 H1 SOL 1408 20.990 42.510 2.340 1.00 0.00 ATOM 19840 H2 SOL 1408 19.830 43.420 2.680 1.00 0.00 ATOM 19841 OH2 SOL 1409 51.980 15.040 74.160 1.00 0.00 ATOM 19842 H1 SOL 1409 52.320 15.840 74.550 1.00 0.00 ATOM 19843 H2 SOL 1409 51.740 15.290 73.270 1.00 0.00 ATOM 19844 OH2 SOL 1410 57.480 29.970 22.730 1.00 0.00 ATOM 19845 H1 SOL 1410 57.730 30.710 22.170 1.00 0.00 ATOM 19846 H2 SOL 1410 58.270 29.430 22.770 1.00 0.00 ATOM 19847 OH2 SOL 1411 40.780 18.590 20.140 1.00 0.00 ATOM 19848 H1 SOL 1411 39.970 18.530 19.650 1.00 0.00 ATOM 19849 H2 SOL 1411 40.510 18.870 21.020 1.00 0.00 ATOM 19850 OH2 SOL 1412 1.330 2.860 71.270 1.00 0.00 ATOM 19851 H1 SOL 1412 0.880 2.750 70.430 1.00 0.00 ATOM 19852 H2 SOL 1412 1.010 3.700 71.600 1.00 0.00 ATOM 19853 OH2 SOL 1413 47.140 22.900 21.880 1.00 0.00 ATOM 19854 H1 SOL 1413 46.670 22.430 21.200 1.00 0.00 ATOM 19855 H2 SOL 1413 47.500 22.220 22.440 1.00 0.00 ATOM 19856 OH2 SOL 1414 57.320 24.300 21.500 1.00 0.00 ATOM 19857 H1 SOL 1414 57.930 23.670 21.880 1.00 0.00 ATOM 19858 H2 SOL 1414 57.710 24.520 20.650 1.00 0.00 ATOM 19859 OH2 SOL 1415 7.310 30.210 13.130 1.00 0.00 ATOM 19860 H1 SOL 1415 6.640 29.780 13.660 1.00 0.00 ATOM 19861 H2 SOL 1415 6.910 30.320 12.270 1.00 0.00 ATOM 19862 OH2 SOL 1416 41.670 6.710 8.090 1.00 0.00 ATOM 19863 H1 SOL 1416 41.480 6.750 9.030 1.00 0.00 ATOM 19864 H2 SOL 1416 40.820 6.830 7.660 1.00 0.00 ATOM 19865 OH2 SOL 1417 6.040 9.330 13.050 1.00 0.00 ATOM 19866 H1 SOL 1417 6.870 9.570 12.640 1.00 0.00 ATOM 19867 H2 SOL 1417 5.900 8.420 12.800 1.00 0.00 ATOM 19868 OH2 SOL 1418 13.890 24.030 5.410 1.00 0.00 ATOM 19869 H1 SOL 1418 14.400 23.930 6.210 1.00 0.00 ATOM 19870 H2 SOL 1418 12.990 24.110 5.710 1.00 0.00 ATOM 19871 OH2 SOL 1419 51.530 39.850 74.580 1.00 0.00 ATOM 19872 H1 SOL 1419 51.700 40.790 74.480 1.00 0.00 ATOM 19873 H2 SOL 1419 52.350 39.430 74.340 1.00 0.00 ATOM 19874 OH2 SOL 1420 27.390 36.850 83.810 1.00 0.00 ATOM 19875 H1 SOL 1420 28.320 36.990 83.630 1.00 0.00 ATOM 19876 H2 SOL 1420 27.210 35.970 83.470 1.00 0.00 ATOM 19877 OH2 SOL 1421 2.790 5.990 81.450 1.00 0.00 ATOM 19878 H1 SOL 1421 2.800 5.810 82.390 1.00 0.00 ATOM 19879 H2 SOL 1421 1.870 5.960 81.210 1.00 0.00 ATOM 19880 OH2 SOL 1422 19.330 55.320 83.490 1.00 0.00 ATOM 19881 H1 SOL 1422 18.940 55.330 84.370 1.00 0.00 ATOM 19882 H2 SOL 1422 19.430 54.390 83.290 1.00 0.00 ATOM 19883 OH2 SOL 1423 28.910 43.980 23.800 1.00 0.00 ATOM 19884 H1 SOL 1423 28.520 43.140 23.530 1.00 0.00 ATOM 19885 H2 SOL 1423 28.160 44.510 24.080 1.00 0.00 ATOM 19886 OH2 SOL 1424 44.550 55.440 73.500 1.00 0.00 ATOM 19887 H1 SOL 1424 43.840 55.470 72.870 1.00 0.00 ATOM 19888 H2 SOL 1424 44.120 55.360 74.350 1.00 0.00 ATOM 19889 OH2 SOL 1425 20.040 54.180 70.710 1.00 0.00 ATOM 19890 H1 SOL 1425 19.940 54.150 69.750 1.00 0.00 ATOM 19891 H2 SOL 1425 20.690 53.510 70.900 1.00 0.00 ATOM 19892 OH2 SOL 1426 47.270 36.280 18.900 1.00 0.00 ATOM 19893 H1 SOL 1426 47.000 35.640 18.250 1.00 0.00 ATOM 19894 H2 SOL 1426 47.560 35.770 19.650 1.00 0.00 ATOM 19895 OH2 SOL 1427 14.610 44.290 79.260 1.00 0.00 ATOM 19896 H1 SOL 1427 13.780 43.950 79.600 1.00 0.00 ATOM 19897 H2 SOL 1427 14.540 45.240 79.380 1.00 0.00 ATOM 19898 OH2 SOL 1428 7.020 48.690 11.780 1.00 0.00 ATOM 19899 H1 SOL 1428 7.930 48.420 11.870 1.00 0.00 ATOM 19900 H2 SOL 1428 7.000 49.600 12.040 1.00 0.00 ATOM 19901 OH2 SOL 1429 33.370 50.590 68.090 1.00 0.00 ATOM 19902 H1 SOL 1429 32.870 50.750 67.290 1.00 0.00 ATOM 19903 H2 SOL 1429 33.990 49.910 67.850 1.00 0.00 ATOM 19904 OH2 SOL 1430 23.410 32.600 78.130 1.00 0.00 ATOM 19905 H1 SOL 1430 24.260 32.950 77.880 1.00 0.00 ATOM 19906 H2 SOL 1430 22.940 32.490 77.310 1.00 0.00 ATOM 19907 OH2 SOL 1431 38.840 40.040 6.230 1.00 0.00 ATOM 19908 H1 SOL 1431 39.470 40.140 6.950 1.00 0.00 ATOM 19909 H2 SOL 1431 39.270 39.460 5.610 1.00 0.00 ATOM 19910 OH2 SOL 1432 53.030 48.730 14.010 1.00 0.00 ATOM 19911 H1 SOL 1432 52.370 49.430 14.090 1.00 0.00 ATOM 19912 H2 SOL 1432 53.360 48.810 13.120 1.00 0.00 ATOM 19913 OH2 SOL 1433 35.240 15.430 63.800 1.00 0.00 ATOM 19914 H1 SOL 1433 36.080 15.870 63.670 1.00 0.00 ATOM 19915 H2 SOL 1433 35.210 14.760 63.110 1.00 0.00 ATOM 19916 OH2 SOL 1434 37.150 49.780 74.330 1.00 0.00 ATOM 19917 H1 SOL 1434 37.430 50.140 75.180 1.00 0.00 ATOM 19918 H2 SOL 1434 36.580 49.050 74.550 1.00 0.00 ATOM 19919 OH2 SOL 1435 20.300 44.920 73.520 1.00 0.00 ATOM 19920 H1 SOL 1435 19.950 44.360 72.830 1.00 0.00 ATOM 19921 H2 SOL 1435 19.600 45.550 73.690 1.00 0.00 ATOM 19922 OH2 SOL 1436 50.540 55.410 12.030 1.00 0.00 ATOM 19923 H1 SOL 1436 50.410 55.580 12.960 1.00 0.00 ATOM 19924 H2 SOL 1436 50.530 56.280 11.620 1.00 0.00 ATOM 19925 OH2 SOL 1437 54.580 20.440 79.790 1.00 0.00 ATOM 19926 H1 SOL 1437 54.120 19.930 79.130 1.00 0.00 ATOM 19927 H2 SOL 1437 54.280 21.340 79.660 1.00 0.00 ATOM 19928 OH2 SOL 1438 0.950 18.180 25.910 1.00 0.00 ATOM 19929 H1 SOL 1438 0.550 18.830 26.480 1.00 0.00 ATOM 19930 H2 SOL 1438 1.460 17.620 26.500 1.00 0.00 ATOM 19931 OH2 SOL 1439 51.230 0.670 69.690 1.00 0.00 ATOM 19932 H1 SOL 1439 50.290 0.820 69.760 1.00 0.00 ATOM 19933 H2 SOL 1439 51.320 -0.240 69.430 1.00 0.00 ATOM 19934 OH2 SOL 1440 7.690 28.780 78.500 1.00 0.00 ATOM 19935 H1 SOL 1440 7.280 28.840 79.360 1.00 0.00 ATOM 19936 H2 SOL 1440 8.450 29.360 78.560 1.00 0.00 ATOM 19937 OH2 SOL 1441 4.160 56.300 73.130 1.00 0.00 ATOM 19938 H1 SOL 1441 4.820 55.800 73.610 1.00 0.00 ATOM 19939 H2 SOL 1441 4.650 56.940 72.620 1.00 0.00 ATOM 19940 OH2 SOL 1442 15.420 38.760 10.520 1.00 0.00 ATOM 19941 H1 SOL 1442 15.430 39.190 9.660 1.00 0.00 ATOM 19942 H2 SOL 1442 14.620 39.080 10.930 1.00 0.00 ATOM 19943 OH2 SOL 1443 20.950 53.430 8.440 1.00 0.00 ATOM 19944 H1 SOL 1443 20.320 54.140 8.300 1.00 0.00 ATOM 19945 H2 SOL 1443 21.690 53.850 8.870 1.00 0.00 ATOM 19946 OH2 SOL 1444 28.540 41.230 25.800 1.00 0.00 ATOM 19947 H1 SOL 1444 27.990 41.250 25.010 1.00 0.00 ATOM 19948 H2 SOL 1444 27.920 41.400 26.510 1.00 0.00 ATOM 19949 OH2 SOL 1445 0.990 24.940 6.150 1.00 0.00 ATOM 19950 H1 SOL 1445 1.660 24.590 5.570 1.00 0.00 ATOM 19951 H2 SOL 1445 1.080 25.890 6.080 1.00 0.00 ATOM 19952 OH2 SOL 1446 10.760 56.630 25.230 1.00 0.00 ATOM 19953 H1 SOL 1446 11.670 56.410 25.420 1.00 0.00 ATOM 19954 H2 SOL 1446 10.400 55.840 24.810 1.00 0.00 ATOM 19955 OH2 SOL 1447 61.500 7.140 81.910 1.00 0.00 ATOM 19956 H1 SOL 1447 61.530 6.190 81.760 1.00 0.00 ATOM 19957 H2 SOL 1447 61.140 7.500 81.100 1.00 0.00 ATOM 19958 OH2 SOL 1448 19.650 40.970 4.990 1.00 0.00 ATOM 19959 H1 SOL 1448 19.440 41.520 4.230 1.00 0.00 ATOM 19960 H2 SOL 1448 20.250 40.300 4.640 1.00 0.00 ATOM 19961 OH2 SOL 1449 8.030 -0.020 75.040 1.00 0.00 ATOM 19962 H1 SOL 1449 7.990 0.930 75.080 1.00 0.00 ATOM 19963 H2 SOL 1449 7.650 -0.310 75.880 1.00 0.00 ATOM 19964 OH2 SOL 1450 42.910 2.370 10.110 1.00 0.00 ATOM 19965 H1 SOL 1450 43.150 3.260 9.870 1.00 0.00 ATOM 19966 H2 SOL 1450 42.010 2.280 9.800 1.00 0.00 ATOM 19967 OH2 SOL 1451 53.460 38.910 72.050 1.00 0.00 ATOM 19968 H1 SOL 1451 52.530 38.980 71.880 1.00 0.00 ATOM 19969 H2 SOL 1451 53.770 38.260 71.430 1.00 0.00 ATOM 19970 OH2 SOL 1452 38.040 32.480 60.770 1.00 0.00 ATOM 19971 H1 SOL 1452 38.280 33.370 60.520 1.00 0.00 ATOM 19972 H2 SOL 1452 38.260 31.950 60.010 1.00 0.00 ATOM 19973 OH2 SOL 1453 59.750 15.280 22.950 1.00 0.00 ATOM 19974 H1 SOL 1453 60.360 15.990 23.120 1.00 0.00 ATOM 19975 H2 SOL 1453 59.750 15.180 22.000 1.00 0.00 ATOM 19976 OH2 SOL 1454 19.830 27.570 12.930 1.00 0.00 ATOM 19977 H1 SOL 1454 18.940 27.550 12.580 1.00 0.00 ATOM 19978 H2 SOL 1454 20.240 28.320 12.500 1.00 0.00 ATOM 19979 OH2 SOL 1455 39.890 32.460 70.800 1.00 0.00 ATOM 19980 H1 SOL 1455 39.530 32.360 69.920 1.00 0.00 ATOM 19981 H2 SOL 1455 40.660 31.890 70.810 1.00 0.00 ATOM 19982 OH2 SOL 1456 45.780 42.140 16.250 1.00 0.00 ATOM 19983 H1 SOL 1456 46.380 42.130 17.000 1.00 0.00 ATOM 19984 H2 SOL 1456 45.260 41.350 16.350 1.00 0.00 ATOM 19985 OH2 SOL 1457 54.340 22.410 75.890 1.00 0.00 ATOM 19986 H1 SOL 1457 54.060 23.130 75.320 1.00 0.00 ATOM 19987 H2 SOL 1457 54.610 21.720 75.290 1.00 0.00 ATOM 19988 OH2 SOL 1458 7.490 21.090 65.460 1.00 0.00 ATOM 19989 H1 SOL 1458 7.340 21.380 64.570 1.00 0.00 ATOM 19990 H2 SOL 1458 7.110 21.780 66.010 1.00 0.00 ATOM 19991 OH2 SOL 1459 9.950 15.500 68.590 1.00 0.00 ATOM 19992 H1 SOL 1459 10.060 15.600 69.530 1.00 0.00 ATOM 19993 H2 SOL 1459 10.620 14.860 68.340 1.00 0.00 ATOM 19994 OH2 SOL 1460 18.210 22.340 1.560 1.00 0.00 ATOM 19995 H1 SOL 1460 17.580 21.880 1.010 1.00 0.00 ATOM 19996 H2 SOL 1460 18.270 21.810 2.350 1.00 0.00 ATOM 19997 OH2 SOL 1461 17.290 24.240 18.410 1.00 0.00 ATOM 19998 H1 SOL 1461 18.240 24.270 18.550 1.00 0.00 ATOM 19999 H2 SOL 1461 16.920 24.520 19.250 1.00 0.00 ATOM 20000 OH2 SOL 1462 1.590 12.450 11.450 1.00 0.00 ATOM 20001 H1 SOL 1462 2.190 11.970 10.880 1.00 0.00 ATOM 20002 H2 SOL 1462 2.170 13.000 11.980 1.00 0.00 ATOM 20003 OH2 SOL 1463 25.310 7.200 73.780 1.00 0.00 ATOM 20004 H1 SOL 1463 25.460 6.860 72.900 1.00 0.00 ATOM 20005 H2 SOL 1463 25.060 6.430 74.290 1.00 0.00 ATOM 20006 OH2 SOL 1464 15.390 23.480 70.030 1.00 0.00 ATOM 20007 H1 SOL 1464 15.800 22.880 70.660 1.00 0.00 ATOM 20008 H2 SOL 1464 16.110 23.810 69.500 1.00 0.00 ATOM 20009 OH2 SOL 1465 34.130 31.880 27.480 1.00 0.00 ATOM 20010 H1 SOL 1465 33.620 32.560 27.920 1.00 0.00 ATOM 20011 H2 SOL 1465 33.490 31.220 27.240 1.00 0.00 ATOM 20012 OH2 SOL 1466 43.310 33.280 71.400 1.00 0.00 ATOM 20013 H1 SOL 1466 44.090 33.370 71.950 1.00 0.00 ATOM 20014 H2 SOL 1466 43.640 32.890 70.580 1.00 0.00 ATOM 20015 OH2 SOL 1467 58.180 36.740 13.390 1.00 0.00 ATOM 20016 H1 SOL 1467 58.740 36.330 12.720 1.00 0.00 ATOM 20017 H2 SOL 1467 58.750 37.390 13.810 1.00 0.00 ATOM 20018 OH2 SOL 1468 29.340 46.570 76.850 1.00 0.00 ATOM 20019 H1 SOL 1468 29.230 45.650 76.620 1.00 0.00 ATOM 20020 H2 SOL 1468 30.090 46.580 77.440 1.00 0.00 ATOM 20021 OH2 SOL 1469 18.530 41.060 75.220 1.00 0.00 ATOM 20022 H1 SOL 1469 18.810 40.580 74.430 1.00 0.00 ATOM 20023 H2 SOL 1469 17.630 40.760 75.360 1.00 0.00 ATOM 20024 OH2 SOL 1470 5.830 44.870 81.270 1.00 0.00 ATOM 20025 H1 SOL 1470 5.290 45.360 81.890 1.00 0.00 ATOM 20026 H2 SOL 1470 5.670 45.310 80.430 1.00 0.00 ATOM 20027 OH2 SOL 1471 60.430 30.580 70.760 1.00 0.00 ATOM 20028 H1 SOL 1471 59.670 30.410 71.320 1.00 0.00 ATOM 20029 H2 SOL 1471 60.370 31.500 70.530 1.00 0.00 ATOM 20030 OH2 SOL 1472 48.260 0.430 11.900 1.00 0.00 ATOM 20031 H1 SOL 1472 47.930 0.100 12.740 1.00 0.00 ATOM 20032 H2 SOL 1472 48.120 1.380 11.950 1.00 0.00 ATOM 20033 OH2 SOL 1473 57.230 8.860 81.860 1.00 0.00 ATOM 20034 H1 SOL 1473 56.650 9.280 82.500 1.00 0.00 ATOM 20035 H2 SOL 1473 58.090 9.240 82.020 1.00 0.00 ATOM 20036 OH2 SOL 1474 0.930 53.860 74.870 1.00 0.00 ATOM 20037 H1 SOL 1474 0.520 54.420 74.210 1.00 0.00 ATOM 20038 H2 SOL 1474 0.820 54.340 75.690 1.00 0.00 ATOM 20039 OH2 SOL 1475 14.110 11.560 70.330 1.00 0.00 ATOM 20040 H1 SOL 1475 14.850 12.130 70.500 1.00 0.00 ATOM 20041 H2 SOL 1475 14.370 11.040 69.580 1.00 0.00 ATOM 20042 OH2 SOL 1476 58.450 41.020 11.500 1.00 0.00 ATOM 20043 H1 SOL 1476 57.800 41.680 11.740 1.00 0.00 ATOM 20044 H2 SOL 1476 57.950 40.220 11.380 1.00 0.00 ATOM 20045 OH2 SOL 1477 54.460 14.530 11.940 1.00 0.00 ATOM 20046 H1 SOL 1477 54.970 15.340 11.920 1.00 0.00 ATOM 20047 H2 SOL 1477 54.150 14.430 11.040 1.00 0.00 ATOM 20048 OH2 SOL 1478 24.830 32.290 6.790 1.00 0.00 ATOM 20049 H1 SOL 1478 24.590 33.070 6.300 1.00 0.00 ATOM 20050 H2 SOL 1478 25.640 31.980 6.390 1.00 0.00 ATOM 20051 OH2 SOL 1479 44.060 43.890 79.790 1.00 0.00 ATOM 20052 H1 SOL 1479 44.300 43.380 80.560 1.00 0.00 ATOM 20053 H2 SOL 1479 43.340 43.410 79.400 1.00 0.00 ATOM 20054 OH2 SOL 1480 43.880 14.150 24.600 1.00 0.00 ATOM 20055 H1 SOL 1480 44.010 14.950 25.110 1.00 0.00 ATOM 20056 H2 SOL 1480 44.510 14.200 23.890 1.00 0.00 ATOM 20057 OH2 SOL 1481 26.940 22.970 22.450 1.00 0.00 ATOM 20058 H1 SOL 1481 27.240 22.790 23.340 1.00 0.00 ATOM 20059 H2 SOL 1481 26.520 22.160 22.170 1.00 0.00 ATOM 20060 OH2 SOL 1482 53.250 48.230 5.980 1.00 0.00 ATOM 20061 H1 SOL 1482 52.570 47.720 5.560 1.00 0.00 ATOM 20062 H2 SOL 1482 53.370 48.990 5.420 1.00 0.00 ATOM 20063 OH2 SOL 1483 55.460 35.750 0.200 1.00 0.00 ATOM 20064 H1 SOL 1483 54.540 35.490 0.250 1.00 0.00 ATOM 20065 H2 SOL 1483 55.940 34.930 0.060 1.00 0.00 ATOM 20066 OH2 SOL 1484 8.160 34.020 68.860 1.00 0.00 ATOM 20067 H1 SOL 1484 8.590 33.590 69.610 1.00 0.00 ATOM 20068 H2 SOL 1484 7.310 33.590 68.800 1.00 0.00 ATOM 20069 OH2 SOL 1485 42.440 47.770 8.300 1.00 0.00 ATOM 20070 H1 SOL 1485 41.660 47.220 8.220 1.00 0.00 ATOM 20071 H2 SOL 1485 43.160 47.140 8.420 1.00 0.00 ATOM 20072 OH2 SOL 1486 19.700 42.840 71.920 1.00 0.00 ATOM 20073 H1 SOL 1486 20.350 42.200 71.640 1.00 0.00 ATOM 20074 H2 SOL 1486 18.860 42.460 71.640 1.00 0.00 ATOM 20075 OH2 SOL 1487 27.080 48.920 10.910 1.00 0.00 ATOM 20076 H1 SOL 1487 26.150 48.740 10.760 1.00 0.00 ATOM 20077 H2 SOL 1487 27.540 48.270 10.370 1.00 0.00 ATOM 20078 OH2 SOL 1488 36.620 34.220 0.940 1.00 0.00 ATOM 20079 H1 SOL 1488 35.800 33.910 0.550 1.00 0.00 ATOM 20080 H2 SOL 1488 37.310 33.860 0.380 1.00 0.00 ATOM 20081 OH2 SOL 1489 13.000 19.900 78.680 1.00 0.00 ATOM 20082 H1 SOL 1489 13.540 19.500 78.000 1.00 0.00 ATOM 20083 H2 SOL 1489 13.250 19.450 79.490 1.00 0.00 ATOM 20084 OH2 SOL 1490 13.150 30.270 4.850 1.00 0.00 ATOM 20085 H1 SOL 1490 13.350 29.340 4.780 1.00 0.00 ATOM 20086 H2 SOL 1490 12.930 30.530 3.950 1.00 0.00 ATOM 20087 OH2 SOL 1491 48.620 55.460 77.950 1.00 0.00 ATOM 20088 H1 SOL 1491 48.100 55.360 78.750 1.00 0.00 ATOM 20089 H2 SOL 1491 48.590 56.390 77.760 1.00 0.00 ATOM 20090 OH2 SOL 1492 22.200 41.970 11.340 1.00 0.00 ATOM 20091 H1 SOL 1492 21.900 41.880 10.430 1.00 0.00 ATOM 20092 H2 SOL 1492 23.100 42.290 11.260 1.00 0.00 ATOM 20093 OH2 SOL 1493 36.850 48.550 70.210 1.00 0.00 ATOM 20094 H1 SOL 1493 36.990 48.150 71.070 1.00 0.00 ATOM 20095 H2 SOL 1493 35.980 48.930 70.260 1.00 0.00 ATOM 20096 OH2 SOL 1494 41.140 14.580 71.280 1.00 0.00 ATOM 20097 H1 SOL 1494 41.060 15.440 71.710 1.00 0.00 ATOM 20098 H2 SOL 1494 42.020 14.280 71.500 1.00 0.00 ATOM 20099 OH2 SOL 1495 8.190 16.860 74.460 1.00 0.00 ATOM 20100 H1 SOL 1495 7.450 16.890 73.850 1.00 0.00 ATOM 20101 H2 SOL 1495 8.060 16.050 74.950 1.00 0.00 ATOM 20102 OH2 SOL 1496 61.440 30.400 2.240 1.00 0.00 ATOM 20103 H1 SOL 1496 60.990 31.180 1.890 1.00 0.00 ATOM 20104 H2 SOL 1496 61.900 30.040 1.480 1.00 0.00 ATOM 20105 OH2 SOL 1497 20.880 22.070 80.130 1.00 0.00 ATOM 20106 H1 SOL 1497 20.070 22.570 80.260 1.00 0.00 ATOM 20107 H2 SOL 1497 21.260 22.440 79.330 1.00 0.00 ATOM 20108 OH2 SOL 1498 42.290 35.880 62.620 1.00 0.00 ATOM 20109 H1 SOL 1498 42.720 35.710 61.790 1.00 0.00 ATOM 20110 H2 SOL 1498 41.370 35.650 62.470 1.00 0.00 ATOM 20111 OH2 SOL 1499 4.990 15.320 70.640 1.00 0.00 ATOM 20112 H1 SOL 1499 5.420 14.460 70.550 1.00 0.00 ATOM 20113 H2 SOL 1499 5.710 15.950 70.540 1.00 0.00 ATOM 20114 OH2 SOL 1500 25.680 18.390 17.980 1.00 0.00 ATOM 20115 H1 SOL 1500 25.980 18.220 17.080 1.00 0.00 ATOM 20116 H2 SOL 1500 25.260 19.260 17.930 1.00 0.00 ATOM 20117 OH2 SOL 1501 1.600 54.720 4.120 1.00 0.00 ATOM 20118 H1 SOL 1501 1.570 54.550 3.180 1.00 0.00 ATOM 20119 H2 SOL 1501 1.780 53.870 4.520 1.00 0.00 ATOM 20120 OH2 SOL 1502 55.970 12.690 7.800 1.00 0.00 ATOM 20121 H1 SOL 1502 55.710 13.590 7.990 1.00 0.00 ATOM 20122 H2 SOL 1502 55.480 12.450 7.010 1.00 0.00 ATOM 20123 OH2 SOL 1503 13.740 37.130 14.330 1.00 0.00 ATOM 20124 H1 SOL 1503 14.140 36.310 14.050 1.00 0.00 ATOM 20125 H2 SOL 1503 13.440 36.960 15.220 1.00 0.00 ATOM 20126 OH2 SOL 1504 1.800 29.040 19.570 1.00 0.00 ATOM 20127 H1 SOL 1504 1.730 29.740 18.920 1.00 0.00 ATOM 20128 H2 SOL 1504 0.890 28.750 19.710 1.00 0.00 ATOM 20129 OH2 SOL 1505 51.230 53.530 20.890 1.00 0.00 ATOM 20130 H1 SOL 1505 51.970 53.900 21.360 1.00 0.00 ATOM 20131 H2 SOL 1505 51.280 53.930 20.020 1.00 0.00 ATOM 20132 OH2 SOL 1506 54.850 31.080 0.230 1.00 0.00 ATOM 20133 H1 SOL 1506 55.220 30.210 0.340 1.00 0.00 ATOM 20134 H2 SOL 1506 54.540 31.330 1.110 1.00 0.00 ATOM 20135 OH2 SOL 1507 49.160 58.000 76.990 1.00 0.00 ATOM 20136 H1 SOL 1507 49.940 58.560 77.020 1.00 0.00 ATOM 20137 H2 SOL 1507 49.400 57.300 76.380 1.00 0.00 ATOM 20138 OH2 SOL 1508 16.390 33.800 79.410 1.00 0.00 ATOM 20139 H1 SOL 1508 16.670 32.900 79.230 1.00 0.00 ATOM 20140 H2 SOL 1508 16.060 33.780 80.300 1.00 0.00 ATOM 20141 OH2 SOL 1509 41.850 13.270 1.870 1.00 0.00 ATOM 20142 H1 SOL 1509 42.650 13.000 1.420 1.00 0.00 ATOM 20143 H2 SOL 1509 41.150 13.050 1.260 1.00 0.00 ATOM 20144 OH2 SOL 1510 26.750 16.630 19.570 1.00 0.00 ATOM 20145 H1 SOL 1510 26.340 17.300 19.030 1.00 0.00 ATOM 20146 H2 SOL 1510 26.510 16.860 20.470 1.00 0.00 ATOM 20147 OH2 SOL 1511 33.340 23.940 17.940 1.00 0.00 ATOM 20148 H1 SOL 1511 33.990 23.800 18.630 1.00 0.00 ATOM 20149 H2 SOL 1511 32.510 23.650 18.320 1.00 0.00 ATOM 20150 OH2 SOL 1512 9.200 40.340 17.980 1.00 0.00 ATOM 20151 H1 SOL 1512 9.530 39.820 18.720 1.00 0.00 ATOM 20152 H2 SOL 1512 9.980 40.590 17.490 1.00 0.00 ATOM 20153 OH2 SOL 1513 22.570 7.310 14.200 1.00 0.00 ATOM 20154 H1 SOL 1513 21.920 6.620 14.110 1.00 0.00 ATOM 20155 H2 SOL 1513 22.870 7.250 15.100 1.00 0.00 ATOM 20156 OH2 SOL 1514 17.290 40.490 18.010 1.00 0.00 ATOM 20157 H1 SOL 1514 16.390 40.410 17.670 1.00 0.00 ATOM 20158 H2 SOL 1514 17.610 39.590 18.030 1.00 0.00 ATOM 20159 OH2 SOL 1515 50.320 30.860 16.880 1.00 0.00 ATOM 20160 H1 SOL 1515 49.420 30.600 17.110 1.00 0.00 ATOM 20161 H2 SOL 1515 50.200 31.650 16.350 1.00 0.00 ATOM 20162 OH2 SOL 1516 37.110 53.890 9.700 1.00 0.00 ATOM 20163 H1 SOL 1516 37.850 53.290 9.600 1.00 0.00 ATOM 20164 H2 SOL 1516 36.430 53.530 9.130 1.00 0.00 ATOM 20165 OH2 SOL 1517 43.450 2.700 6.840 1.00 0.00 ATOM 20166 H1 SOL 1517 43.750 1.790 6.820 1.00 0.00 ATOM 20167 H2 SOL 1517 43.430 2.960 5.920 1.00 0.00 ATOM 20168 OH2 SOL 1518 4.100 45.800 2.060 1.00 0.00 ATOM 20169 H1 SOL 1518 3.470 45.190 1.690 1.00 0.00 ATOM 20170 H2 SOL 1518 3.750 45.990 2.940 1.00 0.00 ATOM 20171 OH2 SOL 1519 14.350 10.430 9.870 1.00 0.00 ATOM 20172 H1 SOL 1519 13.610 9.850 9.700 1.00 0.00 ATOM 20173 H2 SOL 1519 14.520 10.860 9.030 1.00 0.00 ATOM 20174 OH2 SOL 1520 23.770 26.100 19.210 1.00 0.00 ATOM 20175 H1 SOL 1520 23.930 26.730 19.910 1.00 0.00 ATOM 20176 H2 SOL 1520 24.590 26.090 18.710 1.00 0.00 ATOM 20177 OH2 SOL 1521 15.740 52.900 66.710 1.00 0.00 ATOM 20178 H1 SOL 1521 15.740 52.730 65.770 1.00 0.00 ATOM 20179 H2 SOL 1521 16.310 53.660 66.830 1.00 0.00 ATOM 20180 OH2 SOL 1522 44.330 54.870 11.660 1.00 0.00 ATOM 20181 H1 SOL 1522 43.840 54.130 12.000 1.00 0.00 ATOM 20182 H2 SOL 1522 45.020 55.020 12.310 1.00 0.00 ATOM 20183 OH2 SOL 1523 42.240 29.240 80.600 1.00 0.00 ATOM 20184 H1 SOL 1523 42.950 29.260 81.240 1.00 0.00 ATOM 20185 H2 SOL 1523 42.220 28.330 80.300 1.00 0.00 ATOM 20186 OH2 SOL 1524 41.270 27.700 84.110 1.00 0.00 ATOM 20187 H1 SOL 1524 41.950 28.360 84.110 1.00 0.00 ATOM 20188 H2 SOL 1524 41.650 26.960 83.640 1.00 0.00 ATOM 20189 OH2 SOL 1525 44.370 36.780 13.700 1.00 0.00 ATOM 20190 H1 SOL 1525 43.910 36.370 12.960 1.00 0.00 ATOM 20191 H2 SOL 1525 44.690 36.030 14.210 1.00 0.00 ATOM 20192 OH2 SOL 1526 41.800 39.790 75.670 1.00 0.00 ATOM 20193 H1 SOL 1526 40.960 39.520 76.040 1.00 0.00 ATOM 20194 H2 SOL 1526 41.970 39.160 74.970 1.00 0.00 ATOM 20195 OH2 SOL 1527 15.670 31.430 17.790 1.00 0.00 ATOM 20196 H1 SOL 1527 15.630 30.600 17.310 1.00 0.00 ATOM 20197 H2 SOL 1527 16.070 32.040 17.170 1.00 0.00 ATOM 20198 OH2 SOL 1528 40.950 10.510 10.130 1.00 0.00 ATOM 20199 H1 SOL 1528 41.880 10.290 10.040 1.00 0.00 ATOM 20200 H2 SOL 1528 40.530 9.690 10.360 1.00 0.00 ATOM 20201 OH2 SOL 1529 5.170 7.390 70.210 1.00 0.00 ATOM 20202 H1 SOL 1529 4.950 6.980 69.370 1.00 0.00 ATOM 20203 H2 SOL 1529 4.390 7.880 70.460 1.00 0.00 ATOM 20204 OH2 SOL 1530 59.020 17.430 83.690 1.00 0.00 ATOM 20205 H1 SOL 1530 58.880 16.630 83.180 1.00 0.00 ATOM 20206 H2 SOL 1530 59.860 17.280 84.130 1.00 0.00 ATOM 20207 OH2 SOL 1531 20.430 48.350 69.350 1.00 0.00 ATOM 20208 H1 SOL 1531 20.760 48.620 70.210 1.00 0.00 ATOM 20209 H2 SOL 1531 20.450 47.400 69.370 1.00 0.00 ATOM 20210 OH2 SOL 1532 41.740 56.300 67.880 1.00 0.00 ATOM 20211 H1 SOL 1532 41.140 56.920 68.290 1.00 0.00 ATOM 20212 H2 SOL 1532 41.170 55.690 67.410 1.00 0.00 ATOM 20213 OH2 SOL 1533 35.410 34.490 15.370 1.00 0.00 ATOM 20214 H1 SOL 1533 35.550 35.430 15.460 1.00 0.00 ATOM 20215 H2 SOL 1533 35.490 34.320 14.440 1.00 0.00 ATOM 20216 OH2 SOL 1534 56.810 22.080 71.070 1.00 0.00 ATOM 20217 H1 SOL 1534 55.950 22.090 70.650 1.00 0.00 ATOM 20218 H2 SOL 1534 57.070 21.160 71.060 1.00 0.00 ATOM 20219 OH2 SOL 1535 9.770 32.240 73.330 1.00 0.00 ATOM 20220 H1 SOL 1535 10.180 33.090 73.180 1.00 0.00 ATOM 20221 H2 SOL 1535 10.250 31.870 74.080 1.00 0.00 ATOM 20222 OH2 SOL 1536 29.570 51.610 2.250 1.00 0.00 ATOM 20223 H1 SOL 1536 29.240 51.240 1.430 1.00 0.00 ATOM 20224 H2 SOL 1536 30.380 52.050 2.000 1.00 0.00 ATOM 20225 OH2 SOL 1537 35.800 32.260 21.090 1.00 0.00 ATOM 20226 H1 SOL 1537 35.870 33.000 20.480 1.00 0.00 ATOM 20227 H2 SOL 1537 35.550 31.520 20.530 1.00 0.00 ATOM 20228 OH2 SOL 1538 38.620 27.270 83.420 1.00 0.00 ATOM 20229 H1 SOL 1538 39.510 27.260 83.780 1.00 0.00 ATOM 20230 H2 SOL 1538 38.390 28.200 83.410 1.00 0.00 ATOM 20231 OH2 SOL 1539 59.700 53.900 79.300 1.00 0.00 ATOM 20232 H1 SOL 1539 59.600 54.510 78.570 1.00 0.00 ATOM 20233 H2 SOL 1539 58.970 54.120 79.890 1.00 0.00 ATOM 20234 OH2 SOL 1540 27.620 13.240 0.440 1.00 0.00 ATOM 20235 H1 SOL 1540 27.060 13.590 -0.250 1.00 0.00 ATOM 20236 H2 SOL 1540 27.150 13.430 1.250 1.00 0.00 ATOM 20237 OH2 SOL 1541 58.070 45.360 80.390 1.00 0.00 ATOM 20238 H1 SOL 1541 58.920 45.290 79.970 1.00 0.00 ATOM 20239 H2 SOL 1541 58.270 45.390 81.330 1.00 0.00 ATOM 20240 OH2 SOL 1542 8.560 53.520 13.710 1.00 0.00 ATOM 20241 H1 SOL 1542 9.430 53.820 13.990 1.00 0.00 ATOM 20242 H2 SOL 1542 8.070 54.330 13.570 1.00 0.00 ATOM 20243 OH2 SOL 1543 46.700 14.210 77.090 1.00 0.00 ATOM 20244 H1 SOL 1543 47.130 13.760 76.360 1.00 0.00 ATOM 20245 H2 SOL 1543 47.230 14.990 77.240 1.00 0.00 ATOM 20246 OH2 SOL 1544 49.830 22.450 65.400 1.00 0.00 ATOM 20247 H1 SOL 1544 50.270 23.280 65.260 1.00 0.00 ATOM 20248 H2 SOL 1544 49.330 22.290 64.600 1.00 0.00 ATOM 20249 OH2 SOL 1545 20.900 9.150 71.840 1.00 0.00 ATOM 20250 H1 SOL 1545 21.590 8.680 71.380 1.00 0.00 ATOM 20251 H2 SOL 1545 21.280 9.990 72.070 1.00 0.00 ATOM 20252 OH2 SOL 1546 25.360 57.040 11.250 1.00 0.00 ATOM 20253 H1 SOL 1546 26.120 57.470 11.650 1.00 0.00 ATOM 20254 H2 SOL 1546 25.630 56.900 10.340 1.00 0.00 ATOM 20255 OH2 SOL 1547 38.570 10.760 4.710 1.00 0.00 ATOM 20256 H1 SOL 1547 39.010 11.580 4.470 1.00 0.00 ATOM 20257 H2 SOL 1547 39.200 10.300 5.260 1.00 0.00 ATOM 20258 OH2 SOL 1548 3.370 57.810 69.790 1.00 0.00 ATOM 20259 H1 SOL 1548 2.970 58.460 69.210 1.00 0.00 ATOM 20260 H2 SOL 1548 3.480 58.270 70.620 1.00 0.00 ATOM 20261 OH2 SOL 1549 25.420 47.850 16.210 1.00 0.00 ATOM 20262 H1 SOL 1549 25.140 48.390 15.470 1.00 0.00 ATOM 20263 H2 SOL 1549 25.880 48.460 16.790 1.00 0.00 ATOM 20264 OH2 SOL 1550 53.180 4.490 76.980 1.00 0.00 ATOM 20265 H1 SOL 1550 53.780 5.120 77.370 1.00 0.00 ATOM 20266 H2 SOL 1550 52.420 4.480 77.550 1.00 0.00 ATOM 20267 OH2 SOL 1551 5.320 48.880 2.160 1.00 0.00 ATOM 20268 H1 SOL 1551 5.230 49.360 2.980 1.00 0.00 ATOM 20269 H2 SOL 1551 4.850 48.060 2.310 1.00 0.00 ATOM 20270 OH2 SOL 1552 39.930 36.170 75.930 1.00 0.00 ATOM 20271 H1 SOL 1552 40.810 35.820 75.790 1.00 0.00 ATOM 20272 H2 SOL 1552 39.670 36.520 75.080 1.00 0.00 ATOM 20273 OH2 SOL 1553 48.560 1.370 69.570 1.00 0.00 ATOM 20274 H1 SOL 1553 48.460 2.280 69.290 1.00 0.00 ATOM 20275 H2 SOL 1553 47.720 1.150 69.970 1.00 0.00 ATOM 20276 OH2 SOL 1554 28.570 5.200 19.930 1.00 0.00 ATOM 20277 H1 SOL 1554 27.920 5.860 20.180 1.00 0.00 ATOM 20278 H2 SOL 1554 29.290 5.710 19.570 1.00 0.00 ATOM 20279 OH2 SOL 1555 24.880 39.680 81.800 1.00 0.00 ATOM 20280 H1 SOL 1555 25.780 40.010 81.870 1.00 0.00 ATOM 20281 H2 SOL 1555 24.650 39.800 80.880 1.00 0.00 ATOM 20282 OH2 SOL 1556 20.240 56.590 72.080 1.00 0.00 ATOM 20283 H1 SOL 1556 20.120 55.650 72.170 1.00 0.00 ATOM 20284 H2 SOL 1556 19.840 56.950 72.880 1.00 0.00 ATOM 20285 OH2 SOL 1557 37.890 40.590 73.740 1.00 0.00 ATOM 20286 H1 SOL 1557 37.230 39.890 73.710 1.00 0.00 ATOM 20287 H2 SOL 1557 37.820 40.940 74.630 1.00 0.00 ATOM 20288 OH2 SOL 1558 46.790 26.660 80.560 1.00 0.00 ATOM 20289 H1 SOL 1558 47.410 25.940 80.490 1.00 0.00 ATOM 20290 H2 SOL 1558 46.850 27.110 79.720 1.00 0.00 ATOM 20291 OH2 SOL 1559 2.610 28.310 75.660 1.00 0.00 ATOM 20292 H1 SOL 1559 2.860 29.180 75.980 1.00 0.00 ATOM 20293 H2 SOL 1559 3.430 27.820 75.670 1.00 0.00 ATOM 20294 OH2 SOL 1560 2.580 22.780 63.100 1.00 0.00 ATOM 20295 H1 SOL 1560 2.510 21.880 63.420 1.00 0.00 ATOM 20296 H2 SOL 1560 2.170 22.760 62.230 1.00 0.00 ATOM 20297 OH2 SOL 1561 5.150 3.870 16.720 1.00 0.00 ATOM 20298 H1 SOL 1561 4.370 3.890 17.270 1.00 0.00 ATOM 20299 H2 SOL 1561 4.960 3.200 16.070 1.00 0.00 ATOM 20300 OH2 SOL 1562 7.830 20.310 7.740 1.00 0.00 ATOM 20301 H1 SOL 1562 8.060 21.230 7.870 1.00 0.00 ATOM 20302 H2 SOL 1562 7.880 20.180 6.800 1.00 0.00 ATOM 20303 OH2 SOL 1563 24.130 31.010 83.460 1.00 0.00 ATOM 20304 H1 SOL 1563 24.410 31.640 82.790 1.00 0.00 ATOM 20305 H2 SOL 1563 24.640 30.220 83.280 1.00 0.00 ATOM 20306 OH2 SOL 1564 2.310 31.940 21.780 1.00 0.00 ATOM 20307 H1 SOL 1564 3.180 31.530 21.810 1.00 0.00 ATOM 20308 H2 SOL 1564 2.240 32.400 22.610 1.00 0.00 ATOM 20309 OH2 SOL 1565 50.320 11.440 73.590 1.00 0.00 ATOM 20310 H1 SOL 1565 51.160 11.000 73.420 1.00 0.00 ATOM 20311 H2 SOL 1565 49.790 10.770 74.030 1.00 0.00 ATOM 20312 OH2 SOL 1566 9.440 52.880 22.520 1.00 0.00 ATOM 20313 H1 SOL 1566 9.060 53.740 22.700 1.00 0.00 ATOM 20314 H2 SOL 1566 9.890 52.640 23.330 1.00 0.00 ATOM 20315 OH2 SOL 1567 10.230 1.740 26.600 1.00 0.00 ATOM 20316 H1 SOL 1567 10.070 2.650 26.860 1.00 0.00 ATOM 20317 H2 SOL 1567 11.150 1.720 26.360 1.00 0.00 ATOM 20318 OH2 SOL 1568 24.020 50.780 16.680 1.00 0.00 ATOM 20319 H1 SOL 1568 24.030 50.120 15.990 1.00 0.00 ATOM 20320 H2 SOL 1568 23.460 51.480 16.340 1.00 0.00 ATOM 20321 OH2 SOL 1569 4.860 16.210 80.460 1.00 0.00 ATOM 20322 H1 SOL 1569 3.970 16.250 80.100 1.00 0.00 ATOM 20323 H2 SOL 1569 5.130 15.300 80.340 1.00 0.00 ATOM 20324 OH2 SOL 1570 36.270 43.130 21.440 1.00 0.00 ATOM 20325 H1 SOL 1570 35.340 43.270 21.640 1.00 0.00 ATOM 20326 H2 SOL 1570 36.490 42.310 21.870 1.00 0.00 ATOM 20327 OH2 SOL 1571 3.240 3.780 18.930 1.00 0.00 ATOM 20328 H1 SOL 1571 2.970 4.210 19.740 1.00 0.00 ATOM 20329 H2 SOL 1571 3.520 2.910 19.190 1.00 0.00 ATOM 20330 OH2 SOL 1572 18.280 22.660 7.950 1.00 0.00 ATOM 20331 H1 SOL 1572 18.320 22.950 7.040 1.00 0.00 ATOM 20332 H2 SOL 1572 18.640 23.400 8.450 1.00 0.00 ATOM 20333 OH2 SOL 1573 41.770 23.790 75.110 1.00 0.00 ATOM 20334 H1 SOL 1573 42.110 22.910 75.280 1.00 0.00 ATOM 20335 H2 SOL 1573 40.900 23.650 74.740 1.00 0.00 ATOM 20336 OH2 SOL 1574 6.820 11.700 5.410 1.00 0.00 ATOM 20337 H1 SOL 1574 7.390 12.410 5.120 1.00 0.00 ATOM 20338 H2 SOL 1574 7.140 11.470 6.280 1.00 0.00 ATOM 20339 OH2 SOL 1575 2.010 42.130 80.290 1.00 0.00 ATOM 20340 H1 SOL 1575 1.490 41.340 80.190 1.00 0.00 ATOM 20341 H2 SOL 1575 1.430 42.750 80.730 1.00 0.00 ATOM 20342 OH2 SOL 1576 53.990 47.510 78.900 1.00 0.00 ATOM 20343 H1 SOL 1576 53.290 48.110 78.620 1.00 0.00 ATOM 20344 H2 SOL 1576 54.230 47.040 78.100 1.00 0.00 ATOM 20345 OH2 SOL 1577 52.980 12.640 75.120 1.00 0.00 ATOM 20346 H1 SOL 1577 53.520 12.160 74.500 1.00 0.00 ATOM 20347 H2 SOL 1577 52.450 13.220 74.570 1.00 0.00 ATOM 20348 OH2 SOL 1578 21.260 27.080 17.640 1.00 0.00 ATOM 20349 H1 SOL 1578 21.400 27.420 16.750 1.00 0.00 ATOM 20350 H2 SOL 1578 22.120 26.740 17.890 1.00 0.00 ATOM 20351 OH2 SOL 1579 3.870 15.970 15.900 1.00 0.00 ATOM 20352 H1 SOL 1579 3.630 16.240 15.010 1.00 0.00 ATOM 20353 H2 SOL 1579 4.800 16.180 15.970 1.00 0.00 ATOM 20354 OH2 SOL 1580 17.360 48.530 15.640 1.00 0.00 ATOM 20355 H1 SOL 1580 17.840 47.700 15.730 1.00 0.00 ATOM 20356 H2 SOL 1580 17.500 48.980 16.480 1.00 0.00 ATOM 20357 OH2 SOL 1581 25.320 22.960 81.400 1.00 0.00 ATOM 20358 H1 SOL 1581 25.780 23.670 81.840 1.00 0.00 ATOM 20359 H2 SOL 1581 25.460 22.200 81.960 1.00 0.00 ATOM 20360 OH2 SOL 1582 58.250 4.670 15.280 1.00 0.00 ATOM 20361 H1 SOL 1582 59.150 4.970 15.390 1.00 0.00 ATOM 20362 H2 SOL 1582 58.040 4.840 14.360 1.00 0.00 ATOM 20363 OH2 SOL 1583 9.060 41.240 24.610 1.00 0.00 ATOM 20364 H1 SOL 1583 8.640 40.710 25.290 1.00 0.00 ATOM 20365 H2 SOL 1583 9.870 40.780 24.410 1.00 0.00 ATOM 20366 OH2 SOL 1584 17.280 13.000 15.600 1.00 0.00 ATOM 20367 H1 SOL 1584 17.810 12.550 14.940 1.00 0.00 ATOM 20368 H2 SOL 1584 16.600 12.370 15.830 1.00 0.00 ATOM 20369 OH2 SOL 1585 51.410 43.510 25.360 1.00 0.00 ATOM 20370 H1 SOL 1585 52.060 44.150 25.050 1.00 0.00 ATOM 20371 H2 SOL 1585 50.830 44.010 25.930 1.00 0.00 ATOM 20372 OH2 SOL 1586 35.800 52.510 7.620 1.00 0.00 ATOM 20373 H1 SOL 1586 34.850 52.630 7.750 1.00 0.00 ATOM 20374 H2 SOL 1586 35.950 52.760 6.710 1.00 0.00 ATOM 20375 OH2 SOL 1587 50.690 51.060 11.470 1.00 0.00 ATOM 20376 H1 SOL 1587 49.780 51.050 11.170 1.00 0.00 ATOM 20377 H2 SOL 1587 51.190 50.680 10.750 1.00 0.00 ATOM 20378 OH2 SOL 1588 56.700 2.030 8.430 1.00 0.00 ATOM 20379 H1 SOL 1588 56.300 2.170 7.570 1.00 0.00 ATOM 20380 H2 SOL 1588 56.080 1.480 8.900 1.00 0.00 ATOM 20381 OH2 SOL 1589 38.710 38.840 15.450 1.00 0.00 ATOM 20382 H1 SOL 1589 37.820 38.510 15.340 1.00 0.00 ATOM 20383 H2 SOL 1589 38.750 39.110 16.370 1.00 0.00 ATOM 20384 OH2 SOL 1590 51.720 16.800 71.330 1.00 0.00 ATOM 20385 H1 SOL 1590 51.210 15.990 71.310 1.00 0.00 ATOM 20386 H2 SOL 1590 51.130 17.450 71.720 1.00 0.00 ATOM 20387 OH2 SOL 1591 19.590 51.040 69.130 1.00 0.00 ATOM 20388 H1 SOL 1591 18.700 51.090 68.790 1.00 0.00 ATOM 20389 H2 SOL 1591 19.860 50.130 68.980 1.00 0.00 ATOM 20390 OH2 SOL 1592 18.570 8.040 4.720 1.00 0.00 ATOM 20391 H1 SOL 1592 18.860 7.890 3.820 1.00 0.00 ATOM 20392 H2 SOL 1592 17.820 8.630 4.630 1.00 0.00 ATOM 20393 OH2 SOL 1593 38.560 50.950 16.740 1.00 0.00 ATOM 20394 H1 SOL 1593 38.180 51.830 16.790 1.00 0.00 ATOM 20395 H2 SOL 1593 38.420 50.680 15.840 1.00 0.00 ATOM 20396 OH2 SOL 1594 31.040 53.070 82.380 1.00 0.00 ATOM 20397 H1 SOL 1594 31.050 52.900 83.330 1.00 0.00 ATOM 20398 H2 SOL 1594 30.350 53.720 82.270 1.00 0.00 ATOM 20399 OH2 SOL 1595 41.750 42.860 69.090 1.00 0.00 ATOM 20400 H1 SOL 1595 41.020 42.320 68.800 1.00 0.00 ATOM 20401 H2 SOL 1595 42.520 42.440 68.710 1.00 0.00 ATOM 20402 OH2 SOL 1596 35.370 1.990 66.180 1.00 0.00 ATOM 20403 H1 SOL 1596 36.220 1.570 66.190 1.00 0.00 ATOM 20404 H2 SOL 1596 34.750 1.280 65.990 1.00 0.00 ATOM 20405 OH2 SOL 1597 49.720 11.130 20.800 1.00 0.00 ATOM 20406 H1 SOL 1597 50.540 10.650 20.670 1.00 0.00 ATOM 20407 H2 SOL 1597 49.790 11.480 21.690 1.00 0.00 ATOM 20408 OH2 SOL 1598 44.220 14.510 75.470 1.00 0.00 ATOM 20409 H1 SOL 1598 43.770 15.230 75.910 1.00 0.00 ATOM 20410 H2 SOL 1598 45.030 14.400 75.970 1.00 0.00 ATOM 20411 OH2 SOL 1599 56.840 19.060 10.990 1.00 0.00 ATOM 20412 H1 SOL 1599 56.970 18.920 11.930 1.00 0.00 ATOM 20413 H2 SOL 1599 56.060 18.550 10.780 1.00 0.00 ATOM 20414 OH2 SOL 1600 33.980 21.120 72.150 1.00 0.00 ATOM 20415 H1 SOL 1600 34.770 21.310 71.650 1.00 0.00 ATOM 20416 H2 SOL 1600 33.660 20.290 71.790 1.00 0.00 ATOM 20417 OH2 SOL 1601 43.340 21.670 77.650 1.00 0.00 ATOM 20418 H1 SOL 1601 42.930 22.370 78.140 1.00 0.00 ATOM 20419 H2 SOL 1601 44.050 22.090 77.170 1.00 0.00 ATOM 20420 OH2 SOL 1602 13.370 32.590 15.770 1.00 0.00 ATOM 20421 H1 SOL 1602 13.750 32.410 16.630 1.00 0.00 ATOM 20422 H2 SOL 1602 12.560 32.090 15.750 1.00 0.00 ATOM 20423 OH2 SOL 1603 39.210 27.190 19.260 1.00 0.00 ATOM 20424 H1 SOL 1603 39.680 27.640 18.550 1.00 0.00 ATOM 20425 H2 SOL 1603 38.390 27.680 19.340 1.00 0.00 ATOM 20426 OH2 SOL 1604 31.470 31.360 11.150 1.00 0.00 ATOM 20427 H1 SOL 1604 32.020 30.590 11.340 1.00 0.00 ATOM 20428 H2 SOL 1604 32.060 32.110 11.270 1.00 0.00 ATOM 20429 OH2 SOL 1605 33.420 36.010 2.470 1.00 0.00 ATOM 20430 H1 SOL 1605 33.540 36.960 2.370 1.00 0.00 ATOM 20431 H2 SOL 1605 33.970 35.780 3.220 1.00 0.00 ATOM 20432 OH2 SOL 1606 35.830 6.770 70.140 1.00 0.00 ATOM 20433 H1 SOL 1606 36.560 6.850 70.750 1.00 0.00 ATOM 20434 H2 SOL 1606 35.570 7.670 69.960 1.00 0.00 ATOM 20435 OH2 SOL 1607 7.840 57.160 10.890 1.00 0.00 ATOM 20436 H1 SOL 1607 7.440 56.650 11.600 1.00 0.00 ATOM 20437 H2 SOL 1607 7.170 57.790 10.640 1.00 0.00 ATOM 20438 OH2 SOL 1608 41.100 51.830 1.030 1.00 0.00 ATOM 20439 H1 SOL 1608 40.610 51.200 1.550 1.00 0.00 ATOM 20440 H2 SOL 1608 41.000 52.660 1.510 1.00 0.00 ATOM 20441 OH2 SOL 1609 8.870 8.310 67.960 1.00 0.00 ATOM 20442 H1 SOL 1609 8.380 9.130 68.010 1.00 0.00 ATOM 20443 H2 SOL 1609 9.430 8.410 67.190 1.00 0.00 ATOM 20444 OH2 SOL 1610 44.650 7.590 2.670 1.00 0.00 ATOM 20445 H1 SOL 1610 44.270 8.360 3.100 1.00 0.00 ATOM 20446 H2 SOL 1610 45.520 7.500 3.050 1.00 0.00 ATOM 20447 OH2 SOL 1611 59.970 18.810 20.590 1.00 0.00 ATOM 20448 H1 SOL 1611 59.660 19.650 20.270 1.00 0.00 ATOM 20449 H2 SOL 1611 59.980 18.900 21.540 1.00 0.00 ATOM 20450 OH2 SOL 1612 25.290 6.500 2.150 1.00 0.00 ATOM 20451 H1 SOL 1612 25.600 7.280 1.690 1.00 0.00 ATOM 20452 H2 SOL 1612 24.390 6.710 2.390 1.00 0.00 ATOM 20453 OH2 SOL 1613 8.660 34.140 80.820 1.00 0.00 ATOM 20454 H1 SOL 1613 9.130 34.880 80.420 1.00 0.00 ATOM 20455 H2 SOL 1613 9.320 33.670 81.320 1.00 0.00 ATOM 20456 OH2 SOL 1614 45.630 7.330 6.640 1.00 0.00 ATOM 20457 H1 SOL 1614 46.560 7.540 6.490 1.00 0.00 ATOM 20458 H2 SOL 1614 45.600 6.370 6.620 1.00 0.00 ATOM 20459 OH2 SOL 1615 12.280 56.270 72.250 1.00 0.00 ATOM 20460 H1 SOL 1615 12.630 56.400 73.130 1.00 0.00 ATOM 20461 H2 SOL 1615 11.460 56.770 72.240 1.00 0.00 ATOM 20462 OH2 SOL 1616 15.400 1.460 15.560 1.00 0.00 ATOM 20463 H1 SOL 1616 15.850 1.720 16.360 1.00 0.00 ATOM 20464 H2 SOL 1616 14.570 1.940 15.590 1.00 0.00 ATOM 20465 OH2 SOL 1617 6.300 2.750 21.130 1.00 0.00 ATOM 20466 H1 SOL 1617 6.660 3.540 21.520 1.00 0.00 ATOM 20467 H2 SOL 1617 6.470 2.840 20.190 1.00 0.00 ATOM 20468 OH2 SOL 1618 24.070 6.430 11.520 1.00 0.00 ATOM 20469 H1 SOL 1618 24.210 6.890 12.350 1.00 0.00 ATOM 20470 H2 SOL 1618 23.180 6.660 11.260 1.00 0.00 ATOM 20471 OH2 SOL 1619 6.990 36.170 6.240 1.00 0.00 ATOM 20472 H1 SOL 1619 7.220 35.240 6.250 1.00 0.00 ATOM 20473 H2 SOL 1619 7.830 36.630 6.310 1.00 0.00 ATOM 20474 OH2 SOL 1620 49.260 13.160 3.240 1.00 0.00 ATOM 20475 H1 SOL 1620 49.860 12.430 3.150 1.00 0.00 ATOM 20476 H2 SOL 1620 48.740 13.150 2.440 1.00 0.00 ATOM 20477 OH2 SOL 1621 1.370 36.610 0.940 1.00 0.00 ATOM 20478 H1 SOL 1621 2.150 37.080 1.250 1.00 0.00 ATOM 20479 H2 SOL 1621 1.110 36.070 1.690 1.00 0.00 ATOM 20480 OH2 SOL 1622 46.230 27.050 3.230 1.00 0.00 ATOM 20481 H1 SOL 1622 46.100 27.990 3.080 1.00 0.00 ATOM 20482 H2 SOL 1622 46.420 26.980 4.160 1.00 0.00 ATOM 20483 OH2 SOL 1623 41.100 6.660 10.970 1.00 0.00 ATOM 20484 H1 SOL 1623 41.190 6.570 11.920 1.00 0.00 ATOM 20485 H2 SOL 1623 40.270 7.100 10.840 1.00 0.00 ATOM 20486 OH2 SOL 1624 24.260 28.810 15.550 1.00 0.00 ATOM 20487 H1 SOL 1624 25.140 29.040 15.250 1.00 0.00 ATOM 20488 H2 SOL 1624 24.100 27.940 15.170 1.00 0.00 ATOM 20489 OH2 SOL 1625 22.260 25.110 72.810 1.00 0.00 ATOM 20490 H1 SOL 1625 22.200 24.170 72.920 1.00 0.00 ATOM 20491 H2 SOL 1625 23.130 25.260 72.430 1.00 0.00 ATOM 20492 OH2 SOL 1626 0.800 9.180 18.700 1.00 0.00 ATOM 20493 H1 SOL 1626 1.000 8.250 18.600 1.00 0.00 ATOM 20494 H2 SOL 1626 1.480 9.630 18.210 1.00 0.00 ATOM 20495 OH2 SOL 1627 28.050 19.150 23.480 1.00 0.00 ATOM 20496 H1 SOL 1627 28.800 18.740 23.900 1.00 0.00 ATOM 20497 H2 SOL 1627 27.430 19.310 24.190 1.00 0.00 ATOM 20498 OH2 SOL 1628 46.300 17.820 9.830 1.00 0.00 ATOM 20499 H1 SOL 1628 46.850 17.360 9.200 1.00 0.00 ATOM 20500 H2 SOL 1628 45.470 17.350 9.810 1.00 0.00 ATOM 20501 OH2 SOL 1629 41.210 31.830 81.000 1.00 0.00 ATOM 20502 H1 SOL 1629 41.300 30.880 81.010 1.00 0.00 ATOM 20503 H2 SOL 1629 42.100 32.160 81.140 1.00 0.00 ATOM 20504 OH2 SOL 1630 52.440 13.490 61.570 1.00 0.00 ATOM 20505 H1 SOL 1630 52.960 12.690 61.460 1.00 0.00 ATOM 20506 H2 SOL 1630 51.580 13.180 61.840 1.00 0.00 ATOM 20507 OH2 SOL 1631 34.610 45.900 20.980 1.00 0.00 ATOM 20508 H1 SOL 1631 34.770 46.770 20.610 1.00 0.00 ATOM 20509 H2 SOL 1631 34.120 46.070 21.780 1.00 0.00 ATOM 20510 OH2 SOL 1632 49.350 11.740 69.850 1.00 0.00 ATOM 20511 H1 SOL 1632 50.200 11.380 70.100 1.00 0.00 ATOM 20512 H2 SOL 1632 48.740 11.010 69.920 1.00 0.00 ATOM 20513 OH2 SOL 1633 54.070 12.480 64.520 1.00 0.00 ATOM 20514 H1 SOL 1633 54.080 13.150 65.210 1.00 0.00 ATOM 20515 H2 SOL 1633 54.750 12.770 63.910 1.00 0.00 ATOM 20516 OH2 SOL 1634 1.490 28.550 7.940 1.00 0.00 ATOM 20517 H1 SOL 1634 1.380 27.810 8.540 1.00 0.00 ATOM 20518 H2 SOL 1634 1.070 29.280 8.390 1.00 0.00 ATOM 20519 OH2 SOL 1635 53.300 56.490 17.230 1.00 0.00 ATOM 20520 H1 SOL 1635 54.240 56.330 17.250 1.00 0.00 ATOM 20521 H2 SOL 1635 53.050 56.390 16.310 1.00 0.00 ATOM 20522 OH2 SOL 1636 26.510 7.130 20.320 1.00 0.00 ATOM 20523 H1 SOL 1636 26.340 8.010 20.650 1.00 0.00 ATOM 20524 H2 SOL 1636 26.130 6.550 20.980 1.00 0.00 ATOM 20525 OH2 SOL 1637 2.820 20.970 18.200 1.00 0.00 ATOM 20526 H1 SOL 1637 3.490 20.320 18.390 1.00 0.00 ATOM 20527 H2 SOL 1637 3.000 21.690 18.790 1.00 0.00 ATOM 20528 OH2 SOL 1638 38.490 7.350 8.100 1.00 0.00 ATOM 20529 H1 SOL 1638 38.600 6.400 8.030 1.00 0.00 ATOM 20530 H2 SOL 1638 38.010 7.580 7.310 1.00 0.00 ATOM 20531 OH2 SOL 1639 35.900 10.290 17.390 1.00 0.00 ATOM 20532 H1 SOL 1639 36.000 10.860 18.150 1.00 0.00 ATOM 20533 H2 SOL 1639 36.600 9.640 17.470 1.00 0.00 ATOM 20534 OH2 SOL 1640 13.530 48.330 76.650 1.00 0.00 ATOM 20535 H1 SOL 1640 12.730 47.800 76.590 1.00 0.00 ATOM 20536 H2 SOL 1640 14.240 47.690 76.650 1.00 0.00 ATOM 20537 OH2 SOL 1641 31.660 28.390 0.530 1.00 0.00 ATOM 20538 H1 SOL 1641 32.130 29.140 0.890 1.00 0.00 ATOM 20539 H2 SOL 1641 30.920 28.770 0.060 1.00 0.00 ATOM 20540 OH2 SOL 1642 24.550 30.100 18.190 1.00 0.00 ATOM 20541 H1 SOL 1642 23.700 30.550 18.230 1.00 0.00 ATOM 20542 H2 SOL 1642 24.550 29.680 17.330 1.00 0.00 ATOM 20543 OH2 SOL 1643 -0.050 57.170 1.620 1.00 0.00 ATOM 20544 H1 SOL 1643 -0.030 57.740 2.390 1.00 0.00 ATOM 20545 H2 SOL 1643 0.840 56.810 1.560 1.00 0.00 ATOM 20546 OH2 SOL 1644 21.810 44.030 13.010 1.00 0.00 ATOM 20547 H1 SOL 1644 21.900 43.230 12.490 1.00 0.00 ATOM 20548 H2 SOL 1644 21.030 43.890 13.530 1.00 0.00 ATOM 20549 OH2 SOL 1645 37.220 38.260 10.420 1.00 0.00 ATOM 20550 H1 SOL 1645 38.080 38.640 10.610 1.00 0.00 ATOM 20551 H2 SOL 1645 37.290 37.950 9.520 1.00 0.00 ATOM 20552 OH2 SOL 1646 5.720 24.210 24.180 1.00 0.00 ATOM 20553 H1 SOL 1646 4.920 24.720 24.040 1.00 0.00 ATOM 20554 H2 SOL 1646 5.510 23.330 23.850 1.00 0.00 ATOM 20555 OH2 SOL 1647 32.050 51.780 11.000 1.00 0.00 ATOM 20556 H1 SOL 1647 31.960 52.430 11.700 1.00 0.00 ATOM 20557 H2 SOL 1647 31.830 52.260 10.200 1.00 0.00 ATOM 20558 OH2 SOL 1648 24.420 48.740 5.090 1.00 0.00 ATOM 20559 H1 SOL 1648 24.110 49.260 5.830 1.00 0.00 ATOM 20560 H2 SOL 1648 23.810 48.960 4.380 1.00 0.00 ATOM 20561 OH2 SOL 1649 3.020 35.150 66.190 1.00 0.00 ATOM 20562 H1 SOL 1649 2.170 34.750 65.970 1.00 0.00 ATOM 20563 H2 SOL 1649 3.630 34.420 66.220 1.00 0.00 ATOM 20564 OH2 SOL 1650 2.060 44.030 4.040 1.00 0.00 ATOM 20565 H1 SOL 1650 1.810 44.850 4.460 1.00 0.00 ATOM 20566 H2 SOL 1650 2.680 43.620 4.640 1.00 0.00 ATOM 20567 OH2 SOL 1651 56.850 57.950 5.700 1.00 0.00 ATOM 20568 H1 SOL 1651 56.970 57.840 6.650 1.00 0.00 ATOM 20569 H2 SOL 1651 56.370 58.780 5.620 1.00 0.00 ATOM 20570 OH2 SOL 1652 26.370 25.880 18.160 1.00 0.00 ATOM 20571 H1 SOL 1652 26.670 26.670 18.600 1.00 0.00 ATOM 20572 H2 SOL 1652 26.770 25.160 18.650 1.00 0.00 ATOM 20573 OH2 SOL 1653 28.520 19.760 8.220 1.00 0.00 ATOM 20574 H1 SOL 1653 28.980 19.790 9.050 1.00 0.00 ATOM 20575 H2 SOL 1653 29.200 19.820 7.550 1.00 0.00 ATOM 20576 OH2 SOL 1654 32.170 17.610 8.510 1.00 0.00 ATOM 20577 H1 SOL 1654 32.900 17.860 7.950 1.00 0.00 ATOM 20578 H2 SOL 1654 32.550 17.560 9.390 1.00 0.00 ATOM 20579 OH2 SOL 1655 50.520 40.450 79.930 1.00 0.00 ATOM 20580 H1 SOL 1655 50.700 39.790 79.250 1.00 0.00 ATOM 20581 H2 SOL 1655 51.360 40.880 80.080 1.00 0.00 ATOM 20582 OH2 SOL 1656 5.610 44.540 11.350 1.00 0.00 ATOM 20583 H1 SOL 1656 6.060 43.710 11.460 1.00 0.00 ATOM 20584 H2 SOL 1656 4.800 44.450 11.850 1.00 0.00 ATOM 20585 OH2 SOL 1657 56.480 18.520 68.760 1.00 0.00 ATOM 20586 H1 SOL 1657 55.940 17.860 68.330 1.00 0.00 ATOM 20587 H2 SOL 1657 56.540 19.230 68.130 1.00 0.00 ATOM 20588 OH2 SOL 1658 1.290 35.470 3.650 1.00 0.00 ATOM 20589 H1 SOL 1658 1.990 36.100 3.830 1.00 0.00 ATOM 20590 H2 SOL 1658 1.740 34.640 3.510 1.00 0.00 ATOM 20591 OH2 SOL 1659 53.270 13.300 0.440 1.00 0.00 ATOM 20592 H1 SOL 1659 53.040 12.740 -0.300 1.00 0.00 ATOM 20593 H2 SOL 1659 52.530 13.890 0.520 1.00 0.00 ATOM 20594 OH2 SOL 1660 9.410 50.490 6.090 1.00 0.00 ATOM 20595 H1 SOL 1660 8.550 50.170 6.370 1.00 0.00 ATOM 20596 H2 SOL 1660 9.440 51.390 6.400 1.00 0.00 ATOM 20597 OH2 SOL 1661 29.010 33.180 66.090 1.00 0.00 ATOM 20598 H1 SOL 1661 28.900 34.120 65.950 1.00 0.00 ATOM 20599 H2 SOL 1661 29.070 33.090 67.050 1.00 0.00 ATOM 20600 OH2 SOL 1662 36.160 35.040 69.880 1.00 0.00 ATOM 20601 H1 SOL 1662 36.660 34.910 69.080 1.00 0.00 ATOM 20602 H2 SOL 1662 36.350 34.260 70.410 1.00 0.00 ATOM 20603 OH2 SOL 1663 1.820 22.020 68.790 1.00 0.00 ATOM 20604 H1 SOL 1663 2.430 22.250 69.490 1.00 0.00 ATOM 20605 H2 SOL 1663 2.240 22.340 67.990 1.00 0.00 ATOM 20606 OH2 SOL 1664 10.950 13.780 79.130 1.00 0.00 ATOM 20607 H1 SOL 1664 10.530 14.310 78.450 1.00 0.00 ATOM 20608 H2 SOL 1664 10.410 13.920 79.910 1.00 0.00 ATOM 20609 OH2 SOL 1665 41.050 23.120 62.500 1.00 0.00 ATOM 20610 H1 SOL 1665 40.180 22.720 62.630 1.00 0.00 ATOM 20611 H2 SOL 1665 41.000 23.950 62.970 1.00 0.00 ATOM 20612 OH2 SOL 1666 56.740 25.530 8.760 1.00 0.00 ATOM 20613 H1 SOL 1666 57.260 24.790 8.450 1.00 0.00 ATOM 20614 H2 SOL 1666 56.530 25.300 9.670 1.00 0.00 ATOM 20615 OH2 SOL 1667 15.700 50.080 4.740 1.00 0.00 ATOM 20616 H1 SOL 1667 16.170 49.830 5.540 1.00 0.00 ATOM 20617 H2 SOL 1667 14.930 50.550 5.050 1.00 0.00 ATOM 20618 OH2 SOL 1668 20.690 40.320 70.630 1.00 0.00 ATOM 20619 H1 SOL 1668 21.370 39.710 70.920 1.00 0.00 ATOM 20620 H2 SOL 1668 20.050 39.770 70.180 1.00 0.00 ATOM 20621 OH2 SOL 1669 59.030 55.700 66.530 1.00 0.00 ATOM 20622 H1 SOL 1669 58.990 56.180 65.710 1.00 0.00 ATOM 20623 H2 SOL 1669 59.010 54.780 66.270 1.00 0.00 ATOM 20624 OH2 SOL 1670 27.700 0.290 63.640 1.00 0.00 ATOM 20625 H1 SOL 1670 27.180 1.080 63.470 1.00 0.00 ATOM 20626 H2 SOL 1670 28.560 0.630 63.900 1.00 0.00 ATOM 20627 OH2 SOL 1671 47.350 23.870 5.880 1.00 0.00 ATOM 20628 H1 SOL 1671 47.260 24.600 6.480 1.00 0.00 ATOM 20629 H2 SOL 1671 47.860 24.220 5.150 1.00 0.00 ATOM 20630 OH2 SOL 1672 28.540 42.440 77.860 1.00 0.00 ATOM 20631 H1 SOL 1672 28.460 41.640 77.340 1.00 0.00 ATOM 20632 H2 SOL 1672 28.690 43.130 77.210 1.00 0.00 ATOM 20633 OH2 SOL 1673 33.530 19.830 20.340 1.00 0.00 ATOM 20634 H1 SOL 1673 33.340 18.990 20.750 1.00 0.00 ATOM 20635 H2 SOL 1673 32.800 19.980 19.740 1.00 0.00 ATOM 20636 OH2 SOL 1674 0.940 34.170 24.400 1.00 0.00 ATOM 20637 H1 SOL 1674 0.910 33.230 24.550 1.00 0.00 ATOM 20638 H2 SOL 1674 1.460 34.510 25.130 1.00 0.00 ATOM 20639 OH2 SOL 1675 45.180 49.830 0.840 1.00 0.00 ATOM 20640 H1 SOL 1675 45.860 50.370 0.430 1.00 0.00 ATOM 20641 H2 SOL 1675 44.360 50.160 0.480 1.00 0.00 ATOM 20642 OH2 SOL 1676 16.950 51.570 68.450 1.00 0.00 ATOM 20643 H1 SOL 1676 16.430 51.820 67.700 1.00 0.00 ATOM 20644 H2 SOL 1676 16.700 52.180 69.140 1.00 0.00 ATOM 20645 OH2 SOL 1677 4.110 52.130 67.310 1.00 0.00 ATOM 20646 H1 SOL 1677 3.480 51.610 67.810 1.00 0.00 ATOM 20647 H2 SOL 1677 3.880 53.040 67.510 1.00 0.00 ATOM 20648 OH2 SOL 1678 57.500 25.940 73.910 1.00 0.00 ATOM 20649 H1 SOL 1678 56.630 26.280 74.130 1.00 0.00 ATOM 20650 H2 SOL 1678 57.370 24.990 73.860 1.00 0.00 ATOM 20651 OH2 SOL 1679 47.200 53.290 3.940 1.00 0.00 ATOM 20652 H1 SOL 1679 48.100 53.020 3.790 1.00 0.00 ATOM 20653 H2 SOL 1679 46.680 52.690 3.410 1.00 0.00 ATOM 20654 OH2 SOL 1680 61.390 11.470 15.160 1.00 0.00 ATOM 20655 H1 SOL 1680 60.580 10.990 15.030 1.00 0.00 ATOM 20656 H2 SOL 1680 61.890 11.320 14.360 1.00 0.00 ATOM 20657 OH2 SOL 1681 37.470 44.040 67.950 1.00 0.00 ATOM 20658 H1 SOL 1681 38.260 43.490 68.020 1.00 0.00 ATOM 20659 H2 SOL 1681 37.630 44.760 68.560 1.00 0.00 ATOM 20660 OH2 SOL 1682 57.910 9.450 67.240 1.00 0.00 ATOM 20661 H1 SOL 1682 57.690 10.380 67.210 1.00 0.00 ATOM 20662 H2 SOL 1682 57.780 9.140 66.340 1.00 0.00 ATOM 20663 OH2 SOL 1683 23.080 15.810 22.210 1.00 0.00 ATOM 20664 H1 SOL 1683 23.890 15.300 22.280 1.00 0.00 ATOM 20665 H2 SOL 1683 22.760 15.870 23.110 1.00 0.00 ATOM 20666 OH2 SOL 1684 45.860 15.930 81.450 1.00 0.00 ATOM 20667 H1 SOL 1684 45.430 16.300 80.680 1.00 0.00 ATOM 20668 H2 SOL 1684 46.790 16.150 81.330 1.00 0.00 ATOM 20669 OH2 SOL 1685 12.240 50.600 71.340 1.00 0.00 ATOM 20670 H1 SOL 1685 12.170 51.520 71.080 1.00 0.00 ATOM 20671 H2 SOL 1685 12.230 50.620 72.300 1.00 0.00 ATOM 20672 OH2 SOL 1686 48.080 24.800 3.420 1.00 0.00 ATOM 20673 H1 SOL 1686 48.880 24.930 3.930 1.00 0.00 ATOM 20674 H2 SOL 1686 48.030 25.560 2.850 1.00 0.00 ATOM 20675 OH2 SOL 1687 19.440 17.250 81.380 1.00 0.00 ATOM 20676 H1 SOL 1687 19.350 16.300 81.440 1.00 0.00 ATOM 20677 H2 SOL 1687 20.110 17.380 80.720 1.00 0.00 ATOM 20678 OH2 SOL 1688 46.100 41.970 79.050 1.00 0.00 ATOM 20679 H1 SOL 1688 45.470 42.160 79.750 1.00 0.00 ATOM 20680 H2 SOL 1688 46.870 41.640 79.510 1.00 0.00 ATOM 20681 OH2 SOL 1689 38.270 13.610 70.700 1.00 0.00 ATOM 20682 H1 SOL 1689 38.830 13.100 70.110 1.00 0.00 ATOM 20683 H2 SOL 1689 38.880 14.010 71.320 1.00 0.00 ATOM 20684 OH2 SOL 1690 20.290 50.840 9.590 1.00 0.00 ATOM 20685 H1 SOL 1690 20.970 50.610 10.220 1.00 0.00 ATOM 20686 H2 SOL 1690 20.530 51.720 9.290 1.00 0.00 ATOM 20687 OH2 SOL 1691 45.660 32.080 0.450 1.00 0.00 ATOM 20688 H1 SOL 1691 46.340 32.710 0.200 1.00 0.00 ATOM 20689 H2 SOL 1691 46.070 31.540 1.120 1.00 0.00 ATOM 20690 OH2 SOL 1692 1.770 25.870 66.970 1.00 0.00 ATOM 20691 H1 SOL 1692 2.500 25.560 67.510 1.00 0.00 ATOM 20692 H2 SOL 1692 2.130 25.920 66.080 1.00 0.00 ATOM 20693 OH2 SOL 1693 42.240 3.720 70.010 1.00 0.00 ATOM 20694 H1 SOL 1693 42.270 4.670 69.940 1.00 0.00 ATOM 20695 H2 SOL 1693 42.530 3.410 69.150 1.00 0.00 ATOM 20696 OH2 SOL 1694 46.830 13.970 1.090 1.00 0.00 ATOM 20697 H1 SOL 1694 46.830 13.540 0.240 1.00 0.00 ATOM 20698 H2 SOL 1694 46.560 13.300 1.710 1.00 0.00 ATOM 20699 OH2 SOL 1695 23.060 25.960 3.380 1.00 0.00 ATOM 20700 H1 SOL 1695 23.370 25.110 3.060 1.00 0.00 ATOM 20701 H2 SOL 1695 23.350 26.590 2.710 1.00 0.00 ATOM 20702 OH2 SOL 1696 58.190 29.920 13.880 1.00 0.00 ATOM 20703 H1 SOL 1696 57.560 30.630 14.000 1.00 0.00 ATOM 20704 H2 SOL 1696 58.820 30.030 14.590 1.00 0.00 ATOM 20705 OH2 SOL 1697 30.020 11.940 12.090 1.00 0.00 ATOM 20706 H1 SOL 1697 30.130 11.000 12.220 1.00 0.00 ATOM 20707 H2 SOL 1697 29.260 12.010 11.500 1.00 0.00 ATOM 20708 OH2 SOL 1698 33.100 39.000 2.290 1.00 0.00 ATOM 20709 H1 SOL 1698 33.380 39.570 3.000 1.00 0.00 ATOM 20710 H2 SOL 1698 32.240 39.330 2.040 1.00 0.00 ATOM 20711 OH2 SOL 1699 9.150 36.030 10.300 1.00 0.00 ATOM 20712 H1 SOL 1699 8.850 36.520 11.060 1.00 0.00 ATOM 20713 H2 SOL 1699 9.890 35.510 10.610 1.00 0.00 ATOM 20714 OH2 SOL 1700 8.850 42.640 72.120 1.00 0.00 ATOM 20715 H1 SOL 1700 8.390 43.430 71.820 1.00 0.00 ATOM 20716 H2 SOL 1700 8.210 41.930 71.990 1.00 0.00 ATOM 20717 OH2 SOL 1701 2.540 28.280 68.270 1.00 0.00 ATOM 20718 H1 SOL 1701 2.820 27.460 68.670 1.00 0.00 ATOM 20719 H2 SOL 1701 2.320 28.050 67.370 1.00 0.00 ATOM 20720 OH2 SOL 1702 16.560 46.860 13.810 1.00 0.00 ATOM 20721 H1 SOL 1702 16.700 47.630 14.360 1.00 0.00 ATOM 20722 H2 SOL 1702 16.490 46.130 14.420 1.00 0.00 ATOM 20723 OH2 SOL 1703 13.170 38.620 18.700 1.00 0.00 ATOM 20724 H1 SOL 1703 14.020 38.240 18.930 1.00 0.00 ATOM 20725 H2 SOL 1703 12.810 38.920 19.540 1.00 0.00 ATOM 20726 OH2 SOL 1704 55.680 16.310 62.940 1.00 0.00 ATOM 20727 H1 SOL 1704 55.090 16.910 62.490 1.00 0.00 ATOM 20728 H2 SOL 1704 56.550 16.550 62.620 1.00 0.00 ATOM 20729 OH2 SOL 1705 56.120 51.000 71.080 1.00 0.00 ATOM 20730 H1 SOL 1705 56.830 50.540 71.530 1.00 0.00 ATOM 20731 H2 SOL 1705 56.570 51.600 70.490 1.00 0.00 ATOM 20732 OH2 SOL 1706 60.660 14.630 17.720 1.00 0.00 ATOM 20733 H1 SOL 1706 61.240 14.670 16.970 1.00 0.00 ATOM 20734 H2 SOL 1706 59.950 14.040 17.450 1.00 0.00 ATOM 20735 OH2 SOL 1707 1.390 48.570 77.780 1.00 0.00 ATOM 20736 H1 SOL 1707 2.220 48.390 78.220 1.00 0.00 ATOM 20737 H2 SOL 1707 1.520 48.240 76.890 1.00 0.00 ATOM 20738 OH2 SOL 1708 13.480 39.900 14.660 1.00 0.00 ATOM 20739 H1 SOL 1708 13.700 38.970 14.680 1.00 0.00 ATOM 20740 H2 SOL 1708 13.550 40.140 13.740 1.00 0.00 ATOM 20741 OH2 SOL 1709 59.580 14.270 20.420 1.00 0.00 ATOM 20742 H1 SOL 1709 59.230 13.400 20.240 1.00 0.00 ATOM 20743 H2 SOL 1709 59.910 14.570 19.580 1.00 0.00 ATOM 20744 OH2 SOL 1710 56.420 57.820 14.990 1.00 0.00 ATOM 20745 H1 SOL 1710 56.180 58.390 15.720 1.00 0.00 ATOM 20746 H2 SOL 1710 55.940 58.190 14.240 1.00 0.00 ATOM 20747 OH2 SOL 1711 28.320 7.460 23.730 1.00 0.00 ATOM 20748 H1 SOL 1711 29.130 7.530 23.230 1.00 0.00 ATOM 20749 H2 SOL 1711 27.740 8.130 23.370 1.00 0.00 ATOM 20750 OH2 SOL 1712 35.340 6.190 7.620 1.00 0.00 ATOM 20751 H1 SOL 1712 34.420 5.910 7.610 1.00 0.00 ATOM 20752 H2 SOL 1712 35.810 5.470 8.030 1.00 0.00 ATOM 20753 OH2 SOL 1713 19.310 8.450 9.370 1.00 0.00 ATOM 20754 H1 SOL 1713 19.540 9.370 9.200 1.00 0.00 ATOM 20755 H2 SOL 1713 18.450 8.500 9.790 1.00 0.00 ATOM 20756 OH2 SOL 1714 51.000 5.730 7.090 1.00 0.00 ATOM 20757 H1 SOL 1714 51.300 6.290 6.370 1.00 0.00 ATOM 20758 H2 SOL 1714 50.890 4.870 6.690 1.00 0.00 ATOM 20759 OH2 SOL 1715 29.210 44.020 18.900 1.00 0.00 ATOM 20760 H1 SOL 1715 28.540 43.480 19.330 1.00 0.00 ATOM 20761 H2 SOL 1715 29.210 43.710 18.000 1.00 0.00 ATOM 20762 OH2 SOL 1716 29.560 30.960 82.710 1.00 0.00 ATOM 20763 H1 SOL 1716 29.600 31.310 83.600 1.00 0.00 ATOM 20764 H2 SOL 1716 30.480 30.840 82.460 1.00 0.00 ATOM 20765 OH2 SOL 1717 22.050 15.340 8.050 1.00 0.00 ATOM 20766 H1 SOL 1717 21.510 14.550 8.030 1.00 0.00 ATOM 20767 H2 SOL 1717 22.880 15.050 8.420 1.00 0.00 ATOM 20768 OH2 SOL 1718 17.890 23.530 5.370 1.00 0.00 ATOM 20769 H1 SOL 1718 18.130 24.340 5.830 1.00 0.00 ATOM 20770 H2 SOL 1718 17.500 23.830 4.550 1.00 0.00 ATOM 20771 OH2 SOL 1719 33.640 31.910 71.240 1.00 0.00 ATOM 20772 H1 SOL 1719 32.890 32.460 71.460 1.00 0.00 ATOM 20773 H2 SOL 1719 33.290 31.020 71.210 1.00 0.00 ATOM 20774 OH2 SOL 1720 1.890 27.530 78.360 1.00 0.00 ATOM 20775 H1 SOL 1720 2.570 26.860 78.290 1.00 0.00 ATOM 20776 H2 SOL 1720 1.310 27.370 77.620 1.00 0.00 ATOM 20777 OH2 SOL 1721 40.040 19.710 22.440 1.00 0.00 ATOM 20778 H1 SOL 1721 39.880 19.120 23.180 1.00 0.00 ATOM 20779 H2 SOL 1721 39.160 20.010 22.180 1.00 0.00 ATOM 20780 OH2 SOL 1722 2.450 13.530 16.010 1.00 0.00 ATOM 20781 H1 SOL 1722 1.590 13.950 15.930 1.00 0.00 ATOM 20782 H2 SOL 1722 3.070 14.260 16.000 1.00 0.00 ATOM 20783 OH2 SOL 1723 32.860 30.480 59.250 1.00 0.00 ATOM 20784 H1 SOL 1723 33.440 30.870 58.590 1.00 0.00 ATOM 20785 H2 SOL 1723 33.190 30.840 60.080 1.00 0.00 ATOM 20786 OH2 SOL 1724 7.960 2.760 8.680 1.00 0.00 ATOM 20787 H1 SOL 1724 8.520 2.260 8.090 1.00 0.00 ATOM 20788 H2 SOL 1724 8.570 3.200 9.280 1.00 0.00 ATOM 20789 OH2 SOL 1725 39.510 39.830 11.020 1.00 0.00 ATOM 20790 H1 SOL 1725 40.210 39.630 11.630 1.00 0.00 ATOM 20791 H2 SOL 1725 39.240 40.720 11.250 1.00 0.00 ATOM 20792 OH2 SOL 1726 52.440 0.390 11.060 1.00 0.00 ATOM 20793 H1 SOL 1726 51.600 -0.020 10.870 1.00 0.00 ATOM 20794 H2 SOL 1726 52.240 1.320 11.110 1.00 0.00 ATOM 20795 OH2 SOL 1727 56.300 8.120 20.410 1.00 0.00 ATOM 20796 H1 SOL 1727 55.900 8.990 20.350 1.00 0.00 ATOM 20797 H2 SOL 1727 56.620 7.930 19.530 1.00 0.00 ATOM 20798 OH2 SOL 1728 3.600 14.370 20.990 1.00 0.00 ATOM 20799 H1 SOL 1728 2.660 14.310 21.140 1.00 0.00 ATOM 20800 H2 SOL 1728 3.980 13.720 21.570 1.00 0.00 ATOM 20801 OH2 SOL 1729 31.590 14.180 6.750 1.00 0.00 ATOM 20802 H1 SOL 1729 31.690 13.710 5.930 1.00 0.00 ATOM 20803 H2 SOL 1729 31.610 13.490 7.420 1.00 0.00 ATOM 20804 OH2 SOL 1730 43.650 51.700 79.560 1.00 0.00 ATOM 20805 H1 SOL 1730 42.830 51.250 79.750 1.00 0.00 ATOM 20806 H2 SOL 1730 43.800 51.550 78.630 1.00 0.00 ATOM 20807 OH2 SOL 1731 58.490 4.450 7.620 1.00 0.00 ATOM 20808 H1 SOL 1731 57.660 4.070 7.360 1.00 0.00 ATOM 20809 H2 SOL 1731 59.050 3.710 7.820 1.00 0.00 ATOM 20810 OH2 SOL 1732 53.460 33.360 69.080 1.00 0.00 ATOM 20811 H1 SOL 1732 54.010 33.790 68.420 1.00 0.00 ATOM 20812 H2 SOL 1732 53.680 33.810 69.900 1.00 0.00 ATOM 20813 OH2 SOL 1733 0.690 47.010 61.340 1.00 0.00 ATOM 20814 H1 SOL 1733 0.240 46.820 60.520 1.00 0.00 ATOM 20815 H2 SOL 1733 1.370 46.350 61.410 1.00 0.00 ATOM 20816 OH2 SOL 1734 35.680 13.500 69.930 1.00 0.00 ATOM 20817 H1 SOL 1734 36.510 13.630 70.380 1.00 0.00 ATOM 20818 H2 SOL 1734 35.160 14.280 70.160 1.00 0.00 ATOM 20819 OH2 SOL 1735 0.050 56.600 12.530 1.00 0.00 ATOM 20820 H1 SOL 1735 0.530 56.050 13.150 1.00 0.00 ATOM 20821 H2 SOL 1735 0.690 57.230 12.220 1.00 0.00 ATOM 20822 OH2 SOL 1736 9.280 13.900 81.370 1.00 0.00 ATOM 20823 H1 SOL 1736 8.320 13.970 81.420 1.00 0.00 ATOM 20824 H2 SOL 1736 9.520 13.400 82.150 1.00 0.00 ATOM 20825 OH2 SOL 1737 1.550 36.260 19.490 1.00 0.00 ATOM 20826 H1 SOL 1737 1.080 35.730 20.130 1.00 0.00 ATOM 20827 H2 SOL 1737 2.250 36.680 19.990 1.00 0.00 ATOM 20828 OH2 SOL 1738 2.830 5.110 63.100 1.00 0.00 ATOM 20829 H1 SOL 1738 2.960 4.820 64.000 1.00 0.00 ATOM 20830 H2 SOL 1738 2.520 6.020 63.190 1.00 0.00 ATOM 20831 OH2 SOL 1739 33.830 9.540 79.110 1.00 0.00 ATOM 20832 H1 SOL 1739 33.250 8.940 79.570 1.00 0.00 ATOM 20833 H2 SOL 1739 33.290 10.320 78.950 1.00 0.00 ATOM 20834 OH2 SOL 1740 2.230 50.360 2.280 1.00 0.00 ATOM 20835 H1 SOL 1740 2.390 51.270 2.030 1.00 0.00 ATOM 20836 H2 SOL 1740 1.280 50.300 2.370 1.00 0.00 ATOM 20837 OH2 SOL 1741 29.780 19.850 82.370 1.00 0.00 ATOM 20838 H1 SOL 1741 29.500 20.650 82.810 1.00 0.00 ATOM 20839 H2 SOL 1741 30.350 20.160 81.660 1.00 0.00 ATOM 20840 OH2 SOL 1742 42.230 34.310 22.440 1.00 0.00 ATOM 20841 H1 SOL 1742 42.710 35.130 22.500 1.00 0.00 ATOM 20842 H2 SOL 1742 41.980 34.240 21.510 1.00 0.00 ATOM 20843 OH2 SOL 1743 53.260 10.020 18.340 1.00 0.00 ATOM 20844 H1 SOL 1743 53.810 10.240 19.090 1.00 0.00 ATOM 20845 H2 SOL 1743 52.510 9.560 18.720 1.00 0.00 ATOM 20846 OH2 SOL 1744 30.320 2.650 83.000 1.00 0.00 ATOM 20847 H1 SOL 1744 29.770 3.060 82.330 1.00 0.00 ATOM 20848 H2 SOL 1744 30.110 3.110 83.810 1.00 0.00 ATOM 20849 OH2 SOL 1745 56.390 57.320 83.580 1.00 0.00 ATOM 20850 H1 SOL 1745 56.000 56.750 84.250 1.00 0.00 ATOM 20851 H2 SOL 1745 57.110 57.760 84.030 1.00 0.00 ATOM 20852 OH2 SOL 1746 50.220 34.090 82.730 1.00 0.00 ATOM 20853 H1 SOL 1746 51.100 33.930 83.080 1.00 0.00 ATOM 20854 H2 SOL 1746 50.260 33.760 81.830 1.00 0.00 ATOM 20855 OH2 SOL 1747 19.420 38.610 1.770 1.00 0.00 ATOM 20856 H1 SOL 1747 20.060 38.590 1.060 1.00 0.00 ATOM 20857 H2 SOL 1747 19.940 38.470 2.560 1.00 0.00 ATOM 20858 OH2 SOL 1748 14.180 55.310 20.260 1.00 0.00 ATOM 20859 H1 SOL 1748 14.030 55.270 19.310 1.00 0.00 ATOM 20860 H2 SOL 1748 13.380 54.950 20.640 1.00 0.00 ATOM 20861 OH2 SOL 1749 57.950 26.970 16.480 1.00 0.00 ATOM 20862 H1 SOL 1749 57.760 26.240 17.070 1.00 0.00 ATOM 20863 H2 SOL 1749 58.870 27.190 16.660 1.00 0.00 ATOM 20864 OH2 SOL 1750 59.600 9.780 83.020 1.00 0.00 ATOM 20865 H1 SOL 1750 60.530 9.930 83.170 1.00 0.00 ATOM 20866 H2 SOL 1750 59.170 10.610 83.240 1.00 0.00 ATOM 20867 OH2 SOL 1751 20.840 15.960 74.010 1.00 0.00 ATOM 20868 H1 SOL 1751 20.020 15.480 73.880 1.00 0.00 ATOM 20869 H2 SOL 1751 20.870 16.130 74.950 1.00 0.00 ATOM 20870 OH2 SOL 1752 60.740 40.180 8.080 1.00 0.00 ATOM 20871 H1 SOL 1752 61.590 39.810 7.870 1.00 0.00 ATOM 20872 H2 SOL 1752 60.170 39.420 8.220 1.00 0.00 ATOM 20873 OH2 SOL 1753 14.060 9.190 63.590 1.00 0.00 ATOM 20874 H1 SOL 1753 13.910 10.090 63.900 1.00 0.00 ATOM 20875 H2 SOL 1753 13.240 8.940 63.160 1.00 0.00 ATOM 20876 OH2 SOL 1754 52.300 37.080 16.860 1.00 0.00 ATOM 20877 H1 SOL 1754 52.660 36.980 17.740 1.00 0.00 ATOM 20878 H2 SOL 1754 52.090 38.010 16.790 1.00 0.00 ATOM 20879 OH2 SOL 1755 25.710 8.240 67.800 1.00 0.00 ATOM 20880 H1 SOL 1755 26.480 8.240 67.230 1.00 0.00 ATOM 20881 H2 SOL 1755 25.050 7.740 67.310 1.00 0.00 ATOM 20882 OH2 SOL 1756 14.460 4.700 5.210 1.00 0.00 ATOM 20883 H1 SOL 1756 14.330 4.740 6.150 1.00 0.00 ATOM 20884 H2 SOL 1756 13.620 4.970 4.840 1.00 0.00 ATOM 20885 OH2 SOL 1757 59.670 27.080 72.750 1.00 0.00 ATOM 20886 H1 SOL 1757 60.240 26.480 73.220 1.00 0.00 ATOM 20887 H2 SOL 1757 58.850 26.590 72.650 1.00 0.00 ATOM 20888 OH2 SOL 1758 37.110 19.080 0.100 1.00 0.00 ATOM 20889 H1 SOL 1758 36.980 18.230 0.500 1.00 0.00 ATOM 20890 H2 SOL 1758 36.230 19.410 -0.080 1.00 0.00 ATOM 20891 OH2 SOL 1759 28.220 43.500 13.120 1.00 0.00 ATOM 20892 H1 SOL 1759 28.570 42.840 12.530 1.00 0.00 ATOM 20893 H2 SOL 1759 28.730 44.290 12.930 1.00 0.00 ATOM 20894 OH2 SOL 1760 10.640 47.580 22.050 1.00 0.00 ATOM 20895 H1 SOL 1760 10.090 47.680 22.830 1.00 0.00 ATOM 20896 H2 SOL 1760 10.200 48.110 21.390 1.00 0.00 ATOM 20897 OH2 SOL 1761 61.580 14.510 15.040 1.00 0.00 ATOM 20898 H1 SOL 1761 61.270 13.610 14.880 1.00 0.00 ATOM 20899 H2 SOL 1761 61.510 14.930 14.180 1.00 0.00 ATOM 20900 OH2 SOL 1762 24.370 9.740 20.570 1.00 0.00 ATOM 20901 H1 SOL 1762 23.470 10.060 20.660 1.00 0.00 ATOM 20902 H2 SOL 1762 24.860 10.500 20.250 1.00 0.00 ATOM 20903 OH2 SOL 1763 11.670 40.240 16.880 1.00 0.00 ATOM 20904 H1 SOL 1763 12.110 39.610 17.450 1.00 0.00 ATOM 20905 H2 SOL 1763 12.040 40.090 16.010 1.00 0.00 ATOM 20906 OH2 SOL 1764 54.960 57.990 75.960 1.00 0.00 ATOM 20907 H1 SOL 1764 55.620 57.720 75.330 1.00 0.00 ATOM 20908 H2 SOL 1764 55.420 58.020 76.800 1.00 0.00 ATOM 20909 OH2 SOL 1765 23.900 2.270 6.620 1.00 0.00 ATOM 20910 H1 SOL 1765 24.060 1.740 7.400 1.00 0.00 ATOM 20911 H2 SOL 1765 23.090 1.920 6.250 1.00 0.00 ATOM 20912 OH2 SOL 1766 34.050 50.530 2.250 1.00 0.00 ATOM 20913 H1 SOL 1766 34.450 50.200 3.050 1.00 0.00 ATOM 20914 H2 SOL 1766 34.680 50.320 1.560 1.00 0.00 ATOM 20915 OH2 SOL 1767 19.950 20.780 19.640 1.00 0.00 ATOM 20916 H1 SOL 1767 20.220 19.870 19.640 1.00 0.00 ATOM 20917 H2 SOL 1767 19.510 20.900 18.800 1.00 0.00 ATOM 20918 OH2 SOL 1768 48.130 23.560 73.450 1.00 0.00 ATOM 20919 H1 SOL 1768 48.070 23.400 72.510 1.00 0.00 ATOM 20920 H2 SOL 1768 47.500 24.250 73.620 1.00 0.00 ATOM 20921 OH2 SOL 1769 12.260 22.980 14.670 1.00 0.00 ATOM 20922 H1 SOL 1769 11.520 22.390 14.860 1.00 0.00 ATOM 20923 H2 SOL 1769 11.990 23.820 15.040 1.00 0.00 ATOM 20924 OH2 SOL 1770 53.160 22.990 78.370 1.00 0.00 ATOM 20925 H1 SOL 1770 52.400 23.280 77.870 1.00 0.00 ATOM 20926 H2 SOL 1770 53.840 22.850 77.720 1.00 0.00 ATOM 20927 OH2 SOL 1771 2.180 9.000 69.280 1.00 0.00 ATOM 20928 H1 SOL 1771 1.920 8.150 68.920 1.00 0.00 ATOM 20929 H2 SOL 1771 1.960 8.940 70.210 1.00 0.00 ATOM 20930 OH2 SOL 1772 8.850 39.410 77.330 1.00 0.00 ATOM 20931 H1 SOL 1772 7.920 39.650 77.400 1.00 0.00 ATOM 20932 H2 SOL 1772 9.230 39.700 78.150 1.00 0.00 ATOM 20933 OH2 SOL 1773 17.080 25.510 21.020 1.00 0.00 ATOM 20934 H1 SOL 1773 17.360 26.320 20.600 1.00 0.00 ATOM 20935 H2 SOL 1773 17.280 25.630 21.950 1.00 0.00 ATOM 20936 OH2 SOL 1774 53.180 25.240 5.710 1.00 0.00 ATOM 20937 H1 SOL 1774 53.400 24.820 6.540 1.00 0.00 ATOM 20938 H2 SOL 1774 53.660 24.740 5.050 1.00 0.00 ATOM 20939 OH2 SOL 1775 51.550 45.850 5.170 1.00 0.00 ATOM 20940 H1 SOL 1775 51.610 46.340 4.350 1.00 0.00 ATOM 20941 H2 SOL 1775 52.250 45.210 5.120 1.00 0.00 ATOM 20942 OH2 SOL 1776 23.230 49.330 64.860 1.00 0.00 ATOM 20943 H1 SOL 1776 22.580 48.800 64.410 1.00 0.00 ATOM 20944 H2 SOL 1776 22.790 50.170 65.020 1.00 0.00 ATOM 20945 OH2 SOL 1777 1.730 51.160 78.310 1.00 0.00 ATOM 20946 H1 SOL 1777 1.820 50.210 78.160 1.00 0.00 ATOM 20947 H2 SOL 1777 1.910 51.550 77.450 1.00 0.00 ATOM 20948 OH2 SOL 1778 29.480 18.160 68.470 1.00 0.00 ATOM 20949 H1 SOL 1778 28.610 17.770 68.390 1.00 0.00 ATOM 20950 H2 SOL 1778 29.400 18.790 69.180 1.00 0.00 ATOM 20951 OH2 SOL 1779 45.480 57.590 15.800 1.00 0.00 ATOM 20952 H1 SOL 1779 46.300 57.650 15.310 1.00 0.00 ATOM 20953 H2 SOL 1779 44.790 57.590 15.130 1.00 0.00 ATOM 20954 OH2 SOL 1780 13.980 25.580 16.620 1.00 0.00 ATOM 20955 H1 SOL 1780 13.170 25.780 16.150 1.00 0.00 ATOM 20956 H2 SOL 1780 14.530 25.140 15.970 1.00 0.00 ATOM 20957 OH2 SOL 1781 26.180 18.130 80.120 1.00 0.00 ATOM 20958 H1 SOL 1781 26.130 18.970 80.580 1.00 0.00 ATOM 20959 H2 SOL 1781 26.130 18.360 79.200 1.00 0.00 ATOM 20960 OH2 SOL 1782 8.040 4.980 20.370 1.00 0.00 ATOM 20961 H1 SOL 1782 8.540 5.630 19.880 1.00 0.00 ATOM 20962 H2 SOL 1782 8.230 4.150 19.920 1.00 0.00 ATOM 20963 OH2 SOL 1783 47.090 25.820 8.180 1.00 0.00 ATOM 20964 H1 SOL 1783 46.290 25.440 8.550 1.00 0.00 ATOM 20965 H2 SOL 1783 47.550 26.190 8.930 1.00 0.00 ATOM 20966 OH2 SOL 1784 33.740 6.240 74.290 1.00 0.00 ATOM 20967 H1 SOL 1784 33.810 6.500 75.210 1.00 0.00 ATOM 20968 H2 SOL 1784 34.590 5.850 74.090 1.00 0.00 ATOM 20969 OH2 SOL 1785 14.060 51.510 18.150 1.00 0.00 ATOM 20970 H1 SOL 1785 13.360 50.900 18.400 1.00 0.00 ATOM 20971 H2 SOL 1785 14.720 51.410 18.840 1.00 0.00 ATOM 20972 OH2 SOL 1786 6.960 6.810 78.850 1.00 0.00 ATOM 20973 H1 SOL 1786 7.230 5.920 78.630 1.00 0.00 ATOM 20974 H2 SOL 1786 7.770 7.270 79.060 1.00 0.00 ATOM 20975 OH2 SOL 1787 17.980 35.740 16.610 1.00 0.00 ATOM 20976 H1 SOL 1787 18.680 35.720 15.960 1.00 0.00 ATOM 20977 H2 SOL 1787 17.420 34.990 16.380 1.00 0.00 ATOM 20978 OH2 SOL 1788 7.860 23.490 67.380 1.00 0.00 ATOM 20979 H1 SOL 1788 8.500 23.840 66.760 1.00 0.00 ATOM 20980 H2 SOL 1788 7.890 24.090 68.120 1.00 0.00 ATOM 20981 OH2 SOL 1789 19.630 28.160 23.360 1.00 0.00 ATOM 20982 H1 SOL 1789 19.080 27.570 23.870 1.00 0.00 ATOM 20983 H2 SOL 1789 20.260 28.510 23.990 1.00 0.00 ATOM 20984 OH2 SOL 1790 21.190 11.500 69.630 1.00 0.00 ATOM 20985 H1 SOL 1790 22.070 11.560 69.270 1.00 0.00 ATOM 20986 H2 SOL 1790 21.320 11.390 70.570 1.00 0.00 ATOM 20987 OH2 SOL 1791 28.550 49.960 84.170 1.00 0.00 ATOM 20988 H1 SOL 1791 28.270 50.700 83.630 1.00 0.00 ATOM 20989 H2 SOL 1791 28.910 49.330 83.550 1.00 0.00 ATOM 20990 OH2 SOL 1792 26.000 56.830 14.980 1.00 0.00 ATOM 20991 H1 SOL 1792 26.770 56.710 15.540 1.00 0.00 ATOM 20992 H2 SOL 1792 26.330 57.270 14.200 1.00 0.00 ATOM 20993 OH2 SOL 1793 60.170 16.510 27.740 1.00 0.00 ATOM 20994 H1 SOL 1793 60.160 16.980 26.910 1.00 0.00 ATOM 20995 H2 SOL 1793 60.810 15.810 27.620 1.00 0.00 ATOM 20996 OH2 SOL 1794 29.880 52.270 4.940 1.00 0.00 ATOM 20997 H1 SOL 1794 30.730 51.900 5.200 1.00 0.00 ATOM 20998 H2 SOL 1794 29.740 51.950 4.050 1.00 0.00 ATOM 20999 OH2 SOL 1795 21.500 51.780 77.550 1.00 0.00 ATOM 21000 H1 SOL 1795 21.720 51.660 78.470 1.00 0.00 ATOM 21001 H2 SOL 1795 20.590 51.480 77.480 1.00 0.00 ATOM 21002 OH2 SOL 1796 42.770 28.050 69.790 1.00 0.00 ATOM 21003 H1 SOL 1796 42.880 27.740 68.890 1.00 0.00 ATOM 21004 H2 SOL 1796 43.390 27.530 70.300 1.00 0.00 ATOM 21005 OH2 SOL 1797 57.160 40.940 5.230 1.00 0.00 ATOM 21006 H1 SOL 1797 56.860 40.170 5.700 1.00 0.00 ATOM 21007 H2 SOL 1797 58.080 40.750 5.020 1.00 0.00 ATOM 21008 OH2 SOL 1798 4.640 17.060 6.130 1.00 0.00 ATOM 21009 H1 SOL 1798 4.350 16.780 5.260 1.00 0.00 ATOM 21010 H2 SOL 1798 5.520 16.710 6.220 1.00 0.00 ATOM 21011 OH2 SOL 1799 53.840 38.640 13.470 1.00 0.00 ATOM 21012 H1 SOL 1799 53.780 39.430 14.010 1.00 0.00 ATOM 21013 H2 SOL 1799 53.270 38.810 12.730 1.00 0.00 ATOM 21014 OH2 SOL 1800 18.350 38.410 16.340 1.00 0.00 ATOM 21015 H1 SOL 1800 19.270 38.290 16.130 1.00 0.00 ATOM 21016 H2 SOL 1800 18.000 37.520 16.400 1.00 0.00 ATOM 21017 OH2 SOL 1801 41.950 14.640 67.380 1.00 0.00 ATOM 21018 H1 SOL 1801 42.330 14.820 66.520 1.00 0.00 ATOM 21019 H2 SOL 1801 41.590 15.480 67.660 1.00 0.00 ATOM 21020 OH2 SOL 1802 1.330 32.530 74.660 1.00 0.00 ATOM 21021 H1 SOL 1802 1.010 33.350 75.040 1.00 0.00 ATOM 21022 H2 SOL 1802 0.750 31.850 75.000 1.00 0.00 ATOM 21023 OH2 SOL 1803 55.540 46.150 72.210 1.00 0.00 ATOM 21024 H1 SOL 1803 54.750 46.690 72.230 1.00 0.00 ATOM 21025 H2 SOL 1803 55.780 46.050 73.130 1.00 0.00 ATOM 21026 OH2 SOL 1804 59.400 14.860 8.150 1.00 0.00 ATOM 21027 H1 SOL 1804 59.980 14.140 8.390 1.00 0.00 ATOM 21028 H2 SOL 1804 59.300 15.360 8.960 1.00 0.00 ATOM 21029 OH2 SOL 1805 16.850 1.800 68.990 1.00 0.00 ATOM 21030 H1 SOL 1805 16.050 1.320 68.820 1.00 0.00 ATOM 21031 H2 SOL 1805 17.490 1.440 68.370 1.00 0.00 ATOM 21032 OH2 SOL 1806 18.720 47.040 74.510 1.00 0.00 ATOM 21033 H1 SOL 1806 19.290 47.600 75.030 1.00 0.00 ATOM 21034 H2 SOL 1806 17.830 47.310 74.760 1.00 0.00 ATOM 21035 OH2 SOL 1807 35.710 36.410 80.460 1.00 0.00 ATOM 21036 H1 SOL 1807 36.370 35.970 79.930 1.00 0.00 ATOM 21037 H2 SOL 1807 35.410 37.150 79.920 1.00 0.00 ATOM 21038 OH2 SOL 1808 34.590 57.470 82.310 1.00 0.00 ATOM 21039 H1 SOL 1808 34.090 58.140 82.790 1.00 0.00 ATOM 21040 H2 SOL 1808 34.170 56.640 82.530 1.00 0.00 ATOM 21041 OH2 SOL 1809 17.590 32.890 10.540 1.00 0.00 ATOM 21042 H1 SOL 1809 18.370 32.600 10.080 1.00 0.00 ATOM 21043 H2 SOL 1809 17.050 33.300 9.870 1.00 0.00 ATOM 21044 OH2 SOL 1810 61.230 49.520 23.870 1.00 0.00 ATOM 21045 H1 SOL 1810 61.320 50.250 24.480 1.00 0.00 ATOM 21046 H2 SOL 1810 61.690 48.790 24.290 1.00 0.00 ATOM 21047 OH2 SOL 1811 54.230 49.960 30.200 1.00 0.00 ATOM 21048 H1 SOL 1811 54.750 50.610 29.720 1.00 0.00 ATOM 21049 H2 SOL 1811 53.980 50.400 31.010 1.00 0.00 ATOM 21050 OH2 SOL 1812 25.830 52.560 9.140 1.00 0.00 ATOM 21051 H1 SOL 1812 24.970 52.630 9.570 1.00 0.00 ATOM 21052 H2 SOL 1812 25.870 51.650 8.850 1.00 0.00 ATOM 21053 OH2 SOL 1813 14.110 37.870 79.080 1.00 0.00 ATOM 21054 H1 SOL 1813 14.420 37.560 79.930 1.00 0.00 ATOM 21055 H2 SOL 1813 14.880 37.810 78.520 1.00 0.00 ATOM 21056 OH2 SOL 1814 34.810 33.840 75.530 1.00 0.00 ATOM 21057 H1 SOL 1814 35.300 34.170 76.290 1.00 0.00 ATOM 21058 H2 SOL 1814 33.890 33.860 75.810 1.00 0.00 ATOM 21059 OH2 SOL 1815 46.350 52.510 63.480 1.00 0.00 ATOM 21060 H1 SOL 1815 46.640 52.890 62.650 1.00 0.00 ATOM 21061 H2 SOL 1815 46.130 51.610 63.260 1.00 0.00 ATOM 21062 OH2 SOL 1816 8.990 0.930 81.760 1.00 0.00 ATOM 21063 H1 SOL 1816 8.270 1.350 82.230 1.00 0.00 ATOM 21064 H2 SOL 1816 8.620 0.120 81.420 1.00 0.00 ATOM 21065 OH2 SOL 1817 38.360 46.270 69.750 1.00 0.00 ATOM 21066 H1 SOL 1817 37.670 46.940 69.700 1.00 0.00 ATOM 21067 H2 SOL 1817 38.480 46.110 70.680 1.00 0.00 ATOM 21068 OH2 SOL 1818 26.070 54.550 66.890 1.00 0.00 ATOM 21069 H1 SOL 1818 26.840 53.980 66.950 1.00 0.00 ATOM 21070 H2 SOL 1818 25.520 54.140 66.220 1.00 0.00 ATOM 21071 OH2 SOL 1819 16.290 50.750 1.940 1.00 0.00 ATOM 21072 H1 SOL 1819 15.450 50.490 1.570 1.00 0.00 ATOM 21073 H2 SOL 1819 16.210 50.570 2.880 1.00 0.00 ATOM 21074 OH2 SOL 1820 34.720 12.310 80.980 1.00 0.00 ATOM 21075 H1 SOL 1820 35.320 12.240 81.720 1.00 0.00 ATOM 21076 H2 SOL 1820 33.920 11.880 81.280 1.00 0.00 ATOM 21077 OH2 SOL 1821 54.300 4.190 0.210 1.00 0.00 ATOM 21078 H1 SOL 1821 54.580 3.430 0.720 1.00 0.00 ATOM 21079 H2 SOL 1821 54.880 4.900 0.490 1.00 0.00 ATOM 21080 OH2 SOL 1822 19.190 51.570 12.600 1.00 0.00 ATOM 21081 H1 SOL 1822 18.770 51.890 13.400 1.00 0.00 ATOM 21082 H2 SOL 1822 20.080 51.930 12.640 1.00 0.00 ATOM 21083 OH2 SOL 1823 37.180 25.020 75.770 1.00 0.00 ATOM 21084 H1 SOL 1823 37.820 24.470 75.310 1.00 0.00 ATOM 21085 H2 SOL 1823 36.780 25.540 75.080 1.00 0.00 ATOM 21086 OH2 SOL 1824 60.780 7.640 72.630 1.00 0.00 ATOM 21087 H1 SOL 1824 60.310 7.550 73.460 1.00 0.00 ATOM 21088 H2 SOL 1824 60.100 7.900 72.000 1.00 0.00 ATOM 21089 OH2 SOL 1825 52.000 18.500 2.240 1.00 0.00 ATOM 21090 H1 SOL 1825 52.910 18.330 1.980 1.00 0.00 ATOM 21091 H2 SOL 1825 51.570 17.650 2.170 1.00 0.00 ATOM 21092 OH2 SOL 1826 60.760 24.940 11.350 1.00 0.00 ATOM 21093 H1 SOL 1826 61.450 25.400 10.880 1.00 0.00 ATOM 21094 H2 SOL 1826 60.570 24.170 10.820 1.00 0.00 ATOM 21095 OH2 SOL 1827 31.870 13.360 4.230 1.00 0.00 ATOM 21096 H1 SOL 1827 30.980 13.350 3.890 1.00 0.00 ATOM 21097 H2 SOL 1827 32.240 14.180 3.900 1.00 0.00 ATOM 21098 OH2 SOL 1828 34.280 44.910 67.860 1.00 0.00 ATOM 21099 H1 SOL 1828 34.900 44.270 67.490 1.00 0.00 ATOM 21100 H2 SOL 1828 33.470 44.760 67.380 1.00 0.00 ATOM 21101 OH2 SOL 1829 4.010 28.270 21.080 1.00 0.00 ATOM 21102 H1 SOL 1829 3.460 28.590 20.360 1.00 0.00 ATOM 21103 H2 SOL 1829 4.350 29.070 21.490 1.00 0.00 ATOM 21104 OH2 SOL 1830 33.150 35.210 66.310 1.00 0.00 ATOM 21105 H1 SOL 1830 32.780 34.720 67.040 1.00 0.00 ATOM 21106 H2 SOL 1830 33.820 35.760 66.710 1.00 0.00 ATOM 21107 OH2 SOL 1831 48.940 41.290 20.060 1.00 0.00 ATOM 21108 H1 SOL 1831 49.590 41.860 19.660 1.00 0.00 ATOM 21109 H2 SOL 1831 48.100 41.580 19.680 1.00 0.00 ATOM 21110 OH2 SOL 1832 57.780 54.280 13.950 1.00 0.00 ATOM 21111 H1 SOL 1832 57.780 53.350 14.150 1.00 0.00 ATOM 21112 H2 SOL 1832 58.200 54.350 13.090 1.00 0.00 ATOM 21113 OH2 SOL 1833 20.610 1.410 82.400 1.00 0.00 ATOM 21114 H1 SOL 1833 20.030 2.140 82.180 1.00 0.00 ATOM 21115 H2 SOL 1833 20.020 0.660 82.510 1.00 0.00 ATOM 21116 OH2 SOL 1834 10.270 6.820 4.890 1.00 0.00 ATOM 21117 H1 SOL 1834 11.050 6.330 4.640 1.00 0.00 ATOM 21118 H2 SOL 1834 9.690 6.740 4.140 1.00 0.00 ATOM 21119 OH2 SOL 1835 61.090 37.430 12.920 1.00 0.00 ATOM 21120 H1 SOL 1835 61.880 36.970 12.620 1.00 0.00 ATOM 21121 H2 SOL 1835 61.420 38.240 13.310 1.00 0.00 ATOM 21122 OH2 SOL 1836 6.260 21.680 2.310 1.00 0.00 ATOM 21123 H1 SOL 1836 5.920 21.430 1.450 1.00 0.00 ATOM 21124 H2 SOL 1836 5.780 21.130 2.930 1.00 0.00 ATOM 21125 OH2 SOL 1837 32.570 9.460 13.570 1.00 0.00 ATOM 21126 H1 SOL 1837 32.940 10.170 13.050 1.00 0.00 ATOM 21127 H2 SOL 1837 33.220 8.750 13.510 1.00 0.00 ATOM 21128 OH2 SOL 1838 39.550 28.390 77.070 1.00 0.00 ATOM 21129 H1 SOL 1838 39.330 28.500 78.000 1.00 0.00 ATOM 21130 H2 SOL 1838 39.630 27.450 76.960 1.00 0.00 ATOM 21131 OH2 SOL 1839 50.520 37.180 12.030 1.00 0.00 ATOM 21132 H1 SOL 1839 51.430 37.220 12.330 1.00 0.00 ATOM 21133 H2 SOL 1839 50.460 36.340 11.570 1.00 0.00 ATOM 21134 OH2 SOL 1840 50.770 33.630 1.870 1.00 0.00 ATOM 21135 H1 SOL 1840 50.860 32.710 2.120 1.00 0.00 ATOM 21136 H2 SOL 1840 49.880 33.700 1.520 1.00 0.00 ATOM 21137 OH2 SOL 1841 7.960 9.270 8.190 1.00 0.00 ATOM 21138 H1 SOL 1841 7.110 9.000 8.560 1.00 0.00 ATOM 21139 H2 SOL 1841 7.960 10.230 8.270 1.00 0.00 ATOM 21140 OH2 SOL 1842 4.760 47.120 13.130 1.00 0.00 ATOM 21141 H1 SOL 1842 5.570 47.420 12.710 1.00 0.00 ATOM 21142 H2 SOL 1842 4.980 46.260 13.500 1.00 0.00 ATOM 21143 OH2 SOL 1843 42.270 23.850 11.240 1.00 0.00 ATOM 21144 H1 SOL 1843 41.490 23.720 10.710 1.00 0.00 ATOM 21145 H2 SOL 1843 42.240 24.770 11.500 1.00 0.00 ATOM 21146 OH2 SOL 1844 7.930 20.920 73.520 1.00 0.00 ATOM 21147 H1 SOL 1844 7.890 21.870 73.490 1.00 0.00 ATOM 21148 H2 SOL 1844 7.070 20.630 73.210 1.00 0.00 ATOM 21149 OH2 SOL 1845 17.370 20.660 83.450 1.00 0.00 ATOM 21150 H1 SOL 1845 17.600 20.610 82.520 1.00 0.00 ATOM 21151 H2 SOL 1845 16.800 19.920 83.600 1.00 0.00 ATOM 21152 OH2 SOL 1846 29.060 5.680 7.480 1.00 0.00 ATOM 21153 H1 SOL 1846 28.520 4.900 7.440 1.00 0.00 ATOM 21154 H2 SOL 1846 29.830 5.470 6.960 1.00 0.00 ATOM 21155 OH2 SOL 1847 50.630 24.220 83.220 1.00 0.00 ATOM 21156 H1 SOL 1847 49.810 23.750 83.100 1.00 0.00 ATOM 21157 H2 SOL 1847 51.310 23.550 83.060 1.00 0.00 ATOM 21158 OH2 SOL 1848 21.600 31.640 80.890 1.00 0.00 ATOM 21159 H1 SOL 1848 21.720 32.260 81.610 1.00 0.00 ATOM 21160 H2 SOL 1848 22.470 31.510 80.530 1.00 0.00 ATOM 21161 OH2 SOL 1849 43.460 47.120 79.560 1.00 0.00 ATOM 21162 H1 SOL 1849 44.130 46.600 79.090 1.00 0.00 ATOM 21163 H2 SOL 1849 43.040 46.480 80.140 1.00 0.00 ATOM 21164 OH2 SOL 1850 50.050 55.740 14.680 1.00 0.00 ATOM 21165 H1 SOL 1850 50.330 54.830 14.810 1.00 0.00 ATOM 21166 H2 SOL 1850 49.930 56.080 15.560 1.00 0.00 ATOM 21167 OH2 SOL 1851 26.400 44.430 26.740 1.00 0.00 ATOM 21168 H1 SOL 1851 26.020 44.860 27.510 1.00 0.00 ATOM 21169 H2 SOL 1851 26.750 43.610 27.080 1.00 0.00 ATOM 21170 OH2 SOL 1852 50.400 6.220 15.530 1.00 0.00 ATOM 21171 H1 SOL 1852 50.150 6.820 16.230 1.00 0.00 ATOM 21172 H2 SOL 1852 50.410 5.360 15.940 1.00 0.00 ATOM 21173 OH2 SOL 1853 7.320 11.940 8.450 1.00 0.00 ATOM 21174 H1 SOL 1853 6.500 12.440 8.440 1.00 0.00 ATOM 21175 H2 SOL 1853 7.730 12.160 9.280 1.00 0.00 ATOM 21176 OH2 SOL 1854 27.780 47.760 21.890 1.00 0.00 ATOM 21177 H1 SOL 1854 27.360 47.090 22.440 1.00 0.00 ATOM 21178 H2 SOL 1854 27.230 48.530 22.010 1.00 0.00 ATOM 21179 OH2 SOL 1855 55.190 15.220 9.130 1.00 0.00 ATOM 21180 H1 SOL 1855 56.050 15.620 9.260 1.00 0.00 ATOM 21181 H2 SOL 1855 54.670 15.910 8.690 1.00 0.00 ATOM 21182 OH2 SOL 1856 37.580 33.860 18.070 1.00 0.00 ATOM 21183 H1 SOL 1856 37.750 34.790 18.160 1.00 0.00 ATOM 21184 H2 SOL 1856 38.440 33.450 18.020 1.00 0.00 ATOM 21185 OH2 SOL 1857 36.820 28.250 19.730 1.00 0.00 ATOM 21186 H1 SOL 1857 36.660 28.550 20.620 1.00 0.00 ATOM 21187 H2 SOL 1857 36.720 29.030 19.190 1.00 0.00 ATOM 21188 OH2 SOL 1858 53.810 27.830 25.740 1.00 0.00 ATOM 21189 H1 SOL 1858 53.550 26.910 25.630 1.00 0.00 ATOM 21190 H2 SOL 1858 53.020 28.330 25.540 1.00 0.00 ATOM 21191 OH2 SOL 1859 53.780 41.040 17.710 1.00 0.00 ATOM 21192 H1 SOL 1859 53.620 41.970 17.870 1.00 0.00 ATOM 21193 H2 SOL 1859 53.700 40.940 16.760 1.00 0.00 ATOM 21194 OH2 SOL 1860 3.470 15.170 1.550 1.00 0.00 ATOM 21195 H1 SOL 1860 3.740 15.880 0.960 1.00 0.00 ATOM 21196 H2 SOL 1860 3.140 14.490 0.970 1.00 0.00 ATOM 21197 OH2 SOL 1861 53.560 20.550 14.780 1.00 0.00 ATOM 21198 H1 SOL 1861 53.200 21.060 15.500 1.00 0.00 ATOM 21199 H2 SOL 1861 54.490 20.450 15.010 1.00 0.00 ATOM 21200 OH2 SOL 1862 48.380 19.290 10.620 1.00 0.00 ATOM 21201 H1 SOL 1862 48.130 19.100 11.530 1.00 0.00 ATOM 21202 H2 SOL 1862 47.640 19.000 10.100 1.00 0.00 ATOM 21203 OH2 SOL 1863 41.010 7.650 70.940 1.00 0.00 ATOM 21204 H1 SOL 1863 40.210 7.160 70.760 1.00 0.00 ATOM 21205 H2 SOL 1863 41.160 7.540 71.880 1.00 0.00 ATOM 21206 OH2 SOL 1864 10.450 8.920 2.120 1.00 0.00 ATOM 21207 H1 SOL 1864 10.900 9.350 1.390 1.00 0.00 ATOM 21208 H2 SOL 1864 9.630 8.610 1.750 1.00 0.00 ATOM 21209 OH2 SOL 1865 28.190 0.870 74.430 1.00 0.00 ATOM 21210 H1 SOL 1865 27.480 1.500 74.440 1.00 0.00 ATOM 21211 H2 SOL 1865 28.450 0.820 73.500 1.00 0.00 ATOM 21212 OH2 SOL 1866 0.380 39.500 72.770 1.00 0.00 ATOM 21213 H1 SOL 1866 0.920 40.220 72.430 1.00 0.00 ATOM 21214 H2 SOL 1866 -0.240 39.320 72.060 1.00 0.00 ATOM 21215 OH2 SOL 1867 30.080 11.370 72.080 1.00 0.00 ATOM 21216 H1 SOL 1867 29.480 11.920 72.580 1.00 0.00 ATOM 21217 H2 SOL 1867 29.770 11.430 71.170 1.00 0.00 ATOM 21218 OH2 SOL 1868 19.270 15.560 76.510 1.00 0.00 ATOM 21219 H1 SOL 1868 19.100 15.560 77.450 1.00 0.00 ATOM 21220 H2 SOL 1868 19.340 14.640 76.280 1.00 0.00 ATOM 21221 OH2 SOL 1869 9.900 42.110 78.880 1.00 0.00 ATOM 21222 H1 SOL 1869 9.950 41.350 79.470 1.00 0.00 ATOM 21223 H2 SOL 1869 9.030 42.470 79.050 1.00 0.00 ATOM 21224 OH2 SOL 1870 38.400 20.830 2.120 1.00 0.00 ATOM 21225 H1 SOL 1870 38.030 20.350 1.380 1.00 0.00 ATOM 21226 H2 SOL 1870 39.340 20.720 2.030 1.00 0.00 ATOM 21227 OH2 SOL 1871 24.730 37.930 71.050 1.00 0.00 ATOM 21228 H1 SOL 1871 25.290 38.650 71.340 1.00 0.00 ATOM 21229 H2 SOL 1871 24.750 37.980 70.090 1.00 0.00 ATOM 21230 OH2 SOL 1872 5.220 32.190 78.460 1.00 0.00 ATOM 21231 H1 SOL 1872 4.840 31.310 78.570 1.00 0.00 ATOM 21232 H2 SOL 1872 4.510 32.790 78.670 1.00 0.00 ATOM 21233 OH2 SOL 1873 60.800 13.270 10.200 1.00 0.00 ATOM 21234 H1 SOL 1873 60.160 12.790 10.740 1.00 0.00 ATOM 21235 H2 SOL 1873 61.630 13.130 10.640 1.00 0.00 ATOM 21236 OH2 SOL 1874 5.450 47.880 70.560 1.00 0.00 ATOM 21237 H1 SOL 1874 4.790 47.950 69.880 1.00 0.00 ATOM 21238 H2 SOL 1874 5.340 46.990 70.900 1.00 0.00 ATOM 21239 OH2 SOL 1875 53.600 0.460 73.880 1.00 0.00 ATOM 21240 H1 SOL 1875 53.880 0.070 74.720 1.00 0.00 ATOM 21241 H2 SOL 1875 54.270 1.110 73.690 1.00 0.00 ATOM 21242 OH2 SOL 1876 27.520 25.740 11.330 1.00 0.00 ATOM 21243 H1 SOL 1876 26.670 25.320 11.230 1.00 0.00 ATOM 21244 H2 SOL 1876 28.110 25.210 10.790 1.00 0.00 ATOM 21245 OH2 SOL 1877 58.620 32.370 74.820 1.00 0.00 ATOM 21246 H1 SOL 1877 58.950 33.260 74.690 1.00 0.00 ATOM 21247 H2 SOL 1877 57.940 32.250 74.160 1.00 0.00 ATOM 21248 OH2 SOL 1878 6.750 56.480 65.110 1.00 0.00 ATOM 21249 H1 SOL 1878 6.610 57.420 65.050 1.00 0.00 ATOM 21250 H2 SOL 1878 7.410 56.290 64.450 1.00 0.00 ATOM 21251 OH2 SOL 1879 55.680 45.290 83.570 1.00 0.00 ATOM 21252 H1 SOL 1879 55.520 44.700 82.830 1.00 0.00 ATOM 21253 H2 SOL 1879 55.500 46.160 83.220 1.00 0.00 ATOM 21254 OH2 SOL 1880 6.840 30.050 16.740 1.00 0.00 ATOM 21255 H1 SOL 1880 7.050 29.530 15.960 1.00 0.00 ATOM 21256 H2 SOL 1880 6.520 29.420 17.370 1.00 0.00 ATOM 21257 OH2 SOL 1881 2.270 0.590 4.980 1.00 0.00 ATOM 21258 H1 SOL 1881 1.540 -0.010 4.790 1.00 0.00 ATOM 21259 H2 SOL 1881 2.030 1.400 4.540 1.00 0.00 ATOM 21260 OH2 SOL 1882 9.460 41.120 13.020 1.00 0.00 ATOM 21261 H1 SOL 1882 9.150 40.490 13.670 1.00 0.00 ATOM 21262 H2 SOL 1882 10.220 41.530 13.420 1.00 0.00 ATOM 21263 OH2 SOL 1883 44.910 1.660 14.900 1.00 0.00 ATOM 21264 H1 SOL 1883 44.250 1.310 15.500 1.00 0.00 ATOM 21265 H2 SOL 1883 44.570 1.460 14.030 1.00 0.00 ATOM 21266 OH2 SOL 1884 40.210 24.460 2.720 1.00 0.00 ATOM 21267 H1 SOL 1884 41.020 24.010 2.500 1.00 0.00 ATOM 21268 H2 SOL 1884 40.500 25.330 3.030 1.00 0.00 ATOM 21269 OH2 SOL 1885 39.800 18.070 0.760 1.00 0.00 ATOM 21270 H1 SOL 1885 39.200 18.590 0.210 1.00 0.00 ATOM 21271 H2 SOL 1885 40.290 17.540 0.130 1.00 0.00 ATOM 21272 OH2 SOL 1886 14.750 27.940 75.800 1.00 0.00 ATOM 21273 H1 SOL 1886 14.670 28.680 76.400 1.00 0.00 ATOM 21274 H2 SOL 1886 13.870 27.570 75.750 1.00 0.00 ATOM 21275 OH2 SOL 1887 34.360 24.870 7.850 1.00 0.00 ATOM 21276 H1 SOL 1887 34.590 25.280 8.680 1.00 0.00 ATOM 21277 H2 SOL 1887 34.790 25.420 7.190 1.00 0.00 ATOM 21278 OH2 SOL 1888 57.690 28.390 1.140 1.00 0.00 ATOM 21279 H1 SOL 1888 57.950 28.370 0.220 1.00 0.00 ATOM 21280 H2 SOL 1888 56.780 28.100 1.140 1.00 0.00 ATOM 21281 OH2 SOL 1889 31.380 2.770 17.740 1.00 0.00 ATOM 21282 H1 SOL 1889 31.980 3.430 18.100 1.00 0.00 ATOM 21283 H2 SOL 1889 31.150 3.100 16.870 1.00 0.00 ATOM 21284 OH2 SOL 1890 15.300 12.520 13.480 1.00 0.00 ATOM 21285 H1 SOL 1890 14.460 12.380 13.920 1.00 0.00 ATOM 21286 H2 SOL 1890 15.700 13.250 13.950 1.00 0.00 ATOM 21287 OH2 SOL 1891 17.050 30.680 74.590 1.00 0.00 ATOM 21288 H1 SOL 1891 17.220 29.740 74.700 1.00 0.00 ATOM 21289 H2 SOL 1891 16.870 30.990 75.480 1.00 0.00 ATOM 21290 OH2 SOL 1892 36.220 40.590 66.440 1.00 0.00 ATOM 21291 H1 SOL 1892 37.080 40.680 66.040 1.00 0.00 ATOM 21292 H2 SOL 1892 35.850 39.800 66.050 1.00 0.00 ATOM 21293 OH2 SOL 1893 49.880 14.920 10.720 1.00 0.00 ATOM 21294 H1 SOL 1893 50.300 15.480 10.070 1.00 0.00 ATOM 21295 H2 SOL 1893 49.400 15.520 11.280 1.00 0.00 ATOM 21296 OH2 SOL 1894 10.660 46.290 2.470 1.00 0.00 ATOM 21297 H1 SOL 1894 10.830 46.770 1.660 1.00 0.00 ATOM 21298 H2 SOL 1894 9.870 46.690 2.820 1.00 0.00 ATOM 21299 OH2 SOL 1895 10.500 48.940 15.570 1.00 0.00 ATOM 21300 H1 SOL 1895 11.000 48.680 16.340 1.00 0.00 ATOM 21301 H2 SOL 1895 11.010 48.600 14.830 1.00 0.00 ATOM 21302 OH2 SOL 1896 19.710 56.390 4.660 1.00 0.00 ATOM 21303 H1 SOL 1896 19.730 56.300 3.710 1.00 0.00 ATOM 21304 H2 SOL 1896 19.110 57.130 4.820 1.00 0.00 ATOM 21305 OH2 SOL 1897 13.440 1.650 80.210 1.00 0.00 ATOM 21306 H1 SOL 1897 13.520 2.120 79.380 1.00 0.00 ATOM 21307 H2 SOL 1897 13.120 2.310 80.830 1.00 0.00 ATOM 21308 OH2 SOL 1898 3.480 36.410 75.220 1.00 0.00 ATOM 21309 H1 SOL 1898 2.790 36.770 74.660 1.00 0.00 ATOM 21310 H2 SOL 1898 3.920 37.180 75.570 1.00 0.00 ATOM 21311 OH2 SOL 1899 25.990 9.840 77.300 1.00 0.00 ATOM 21312 H1 SOL 1899 26.590 9.100 77.210 1.00 0.00 ATOM 21313 H2 SOL 1899 26.510 10.600 77.020 1.00 0.00 ATOM 21314 OH2 SOL 1900 28.170 3.030 7.440 1.00 0.00 ATOM 21315 H1 SOL 1900 28.730 2.360 7.840 1.00 0.00 ATOM 21316 H2 SOL 1900 27.480 3.180 8.090 1.00 0.00 ATOM 21317 OH2 SOL 1901 48.400 38.650 2.510 1.00 0.00 ATOM 21318 H1 SOL 1901 48.060 38.020 3.150 1.00 0.00 ATOM 21319 H2 SOL 1901 49.330 38.710 2.700 1.00 0.00 ATOM 21320 OH2 SOL 1902 45.230 22.160 80.510 1.00 0.00 ATOM 21321 H1 SOL 1902 45.770 22.400 81.260 1.00 0.00 ATOM 21322 H2 SOL 1902 44.450 21.770 80.900 1.00 0.00 ATOM 21323 OH2 SOL 1903 15.120 22.840 74.330 1.00 0.00 ATOM 21324 H1 SOL 1903 15.140 22.200 75.040 1.00 0.00 ATOM 21325 H2 SOL 1903 15.570 23.610 74.670 1.00 0.00 ATOM 21326 OH2 SOL 1904 12.800 45.120 10.570 1.00 0.00 ATOM 21327 H1 SOL 1904 12.460 45.390 9.720 1.00 0.00 ATOM 21328 H2 SOL 1904 13.470 44.460 10.370 1.00 0.00 ATOM 21329 OH2 SOL 1905 45.420 46.980 73.030 1.00 0.00 ATOM 21330 H1 SOL 1905 45.920 47.200 73.820 1.00 0.00 ATOM 21331 H2 SOL 1905 45.750 46.130 72.760 1.00 0.00 ATOM 21332 OH2 SOL 1906 30.380 35.980 9.230 1.00 0.00 ATOM 21333 H1 SOL 1906 30.010 35.110 9.400 1.00 0.00 ATOM 21334 H2 SOL 1906 29.960 36.260 8.420 1.00 0.00 ATOM 21335 OH2 SOL 1907 29.530 0.670 1.760 1.00 0.00 ATOM 21336 H1 SOL 1907 29.000 0.360 2.490 1.00 0.00 ATOM 21337 H2 SOL 1907 29.730 -0.120 1.250 1.00 0.00 ATOM 21338 OH2 SOL 1908 61.330 19.330 72.740 1.00 0.00 ATOM 21339 H1 SOL 1908 60.910 18.550 73.120 1.00 0.00 ATOM 21340 H2 SOL 1908 61.200 19.230 71.800 1.00 0.00 ATOM 21341 OH2 SOL 1909 51.660 0.780 77.530 1.00 0.00 ATOM 21342 H1 SOL 1909 51.410 1.700 77.560 1.00 0.00 ATOM 21343 H2 SOL 1909 52.450 0.730 78.070 1.00 0.00 ATOM 21344 OH2 SOL 1910 3.380 15.720 74.250 1.00 0.00 ATOM 21345 H1 SOL 1910 3.960 15.110 74.700 1.00 0.00 ATOM 21346 H2 SOL 1910 3.970 16.300 73.770 1.00 0.00 ATOM 21347 OH2 SOL 1911 42.620 11.160 24.290 1.00 0.00 ATOM 21348 H1 SOL 1911 42.980 12.030 24.160 1.00 0.00 ATOM 21349 H2 SOL 1911 43.280 10.710 24.830 1.00 0.00 ATOM 21350 OH2 SOL 1912 14.610 11.470 78.430 1.00 0.00 ATOM 21351 H1 SOL 1912 13.850 11.660 77.880 1.00 0.00 ATOM 21352 H2 SOL 1912 14.280 11.520 79.330 1.00 0.00 ATOM 21353 OH2 SOL 1913 51.200 43.630 1.160 1.00 0.00 ATOM 21354 H1 SOL 1913 51.160 42.700 1.410 1.00 0.00 ATOM 21355 H2 SOL 1913 51.560 43.620 0.270 1.00 0.00 ATOM 21356 OH2 SOL 1914 35.480 29.350 14.730 1.00 0.00 ATOM 21357 H1 SOL 1914 34.920 29.170 13.970 1.00 0.00 ATOM 21358 H2 SOL 1914 36.130 28.650 14.720 1.00 0.00 ATOM 21359 OH2 SOL 1915 61.710 30.610 9.850 1.00 0.00 ATOM 21360 H1 SOL 1915 60.790 30.550 10.120 1.00 0.00 ATOM 21361 H2 SOL 1915 61.880 31.550 9.800 1.00 0.00 ATOM 21362 OH2 SOL 1916 49.630 22.370 20.040 1.00 0.00 ATOM 21363 H1 SOL 1916 48.970 22.980 20.390 1.00 0.00 ATOM 21364 H2 SOL 1916 49.350 21.510 20.350 1.00 0.00 ATOM 21365 OH2 SOL 1917 53.220 4.680 74.030 1.00 0.00 ATOM 21366 H1 SOL 1917 52.900 4.830 74.910 1.00 0.00 ATOM 21367 H2 SOL 1917 52.440 4.510 73.510 1.00 0.00 ATOM 21368 OH2 SOL 1918 9.460 4.710 73.770 1.00 0.00 ATOM 21369 H1 SOL 1918 9.640 3.800 74.010 1.00 0.00 ATOM 21370 H2 SOL 1918 9.080 4.660 72.890 1.00 0.00 ATOM 21371 OH2 SOL 1919 20.600 50.630 15.730 1.00 0.00 ATOM 21372 H1 SOL 1919 19.780 51.010 16.060 1.00 0.00 ATOM 21373 H2 SOL 1919 21.260 51.300 15.900 1.00 0.00 ATOM 21374 OH2 SOL 1920 36.540 15.680 80.850 1.00 0.00 ATOM 21375 H1 SOL 1920 36.700 15.390 79.960 1.00 0.00 ATOM 21376 H2 SOL 1920 36.820 16.600 80.860 1.00 0.00 ATOM 21377 OH2 SOL 1921 43.170 32.370 68.620 1.00 0.00 ATOM 21378 H1 SOL 1921 42.700 33.160 68.880 1.00 0.00 ATOM 21379 H2 SOL 1921 42.500 31.680 68.630 1.00 0.00 ATOM 21380 OH2 SOL 1922 4.400 33.840 1.030 1.00 0.00 ATOM 21381 H1 SOL 1922 3.690 33.760 1.660 1.00 0.00 ATOM 21382 H2 SOL 1922 4.380 33.010 0.540 1.00 0.00 ATOM 21383 OH2 SOL 1923 50.720 51.560 73.740 1.00 0.00 ATOM 21384 H1 SOL 1923 51.090 51.130 72.970 1.00 0.00 ATOM 21385 H2 SOL 1923 51.410 52.160 74.040 1.00 0.00 ATOM 21386 OH2 SOL 1924 11.210 58.370 15.080 1.00 0.00 ATOM 21387 H1 SOL 1924 11.520 57.530 14.750 1.00 0.00 ATOM 21388 H2 SOL 1924 11.090 58.910 14.310 1.00 0.00 ATOM 21389 OH2 SOL 1925 14.310 50.760 15.230 1.00 0.00 ATOM 21390 H1 SOL 1925 14.360 51.240 16.060 1.00 0.00 ATOM 21391 H2 SOL 1925 13.540 51.110 14.790 1.00 0.00 ATOM 21392 OH2 SOL 1926 50.520 43.170 18.410 1.00 0.00 ATOM 21393 H1 SOL 1926 50.060 43.990 18.250 1.00 0.00 ATOM 21394 H2 SOL 1926 51.440 43.360 18.230 1.00 0.00 ATOM 21395 OH2 SOL 1927 3.420 20.080 6.400 1.00 0.00 ATOM 21396 H1 SOL 1927 3.720 19.250 6.750 1.00 0.00 ATOM 21397 H2 SOL 1927 2.480 19.950 6.250 1.00 0.00 ATOM 21398 OH2 SOL 1928 30.070 19.580 1.370 1.00 0.00 ATOM 21399 H1 SOL 1928 29.630 18.840 0.950 1.00 0.00 ATOM 21400 H2 SOL 1928 29.720 20.350 0.920 1.00 0.00 ATOM 21401 OH2 SOL 1929 35.030 48.270 75.190 1.00 0.00 ATOM 21402 H1 SOL 1929 34.850 47.530 75.760 1.00 0.00 ATOM 21403 H2 SOL 1929 34.160 48.560 74.900 1.00 0.00 ATOM 21404 OH2 SOL 1930 37.450 14.470 20.440 1.00 0.00 ATOM 21405 H1 SOL 1930 36.730 14.820 19.930 1.00 0.00 ATOM 21406 H2 SOL 1930 38.220 14.950 20.130 1.00 0.00 ATOM 21407 OH2 SOL 1931 4.540 26.320 75.750 1.00 0.00 ATOM 21408 H1 SOL 1931 3.980 25.600 76.010 1.00 0.00 ATOM 21409 H2 SOL 1931 5.250 26.320 76.390 1.00 0.00 ATOM 21410 OH2 SOL 1932 40.720 37.390 13.890 1.00 0.00 ATOM 21411 H1 SOL 1932 41.200 38.050 13.390 1.00 0.00 ATOM 21412 H2 SOL 1932 39.900 37.820 14.140 1.00 0.00 ATOM 21413 OH2 SOL 1933 55.100 20.190 74.210 1.00 0.00 ATOM 21414 H1 SOL 1933 54.230 19.860 74.410 1.00 0.00 ATOM 21415 H2 SOL 1933 55.560 19.450 73.820 1.00 0.00 ATOM 21416 OH2 SOL 1934 40.120 21.110 78.220 1.00 0.00 ATOM 21417 H1 SOL 1934 39.990 21.370 79.130 1.00 0.00 ATOM 21418 H2 SOL 1934 40.450 21.910 77.800 1.00 0.00 ATOM 21419 OH2 SOL 1935 19.000 39.540 73.120 1.00 0.00 ATOM 21420 H1 SOL 1935 19.560 39.900 72.430 1.00 0.00 ATOM 21421 H2 SOL 1935 18.510 38.830 72.690 1.00 0.00 ATOM 21422 OH2 SOL 1936 3.010 1.730 15.760 1.00 0.00 ATOM 21423 H1 SOL 1936 2.660 0.920 15.380 1.00 0.00 ATOM 21424 H2 SOL 1936 2.260 2.330 15.770 1.00 0.00 ATOM 21425 OH2 SOL 1937 7.300 27.670 20.890 1.00 0.00 ATOM 21426 H1 SOL 1937 7.210 27.050 21.620 1.00 0.00 ATOM 21427 H2 SOL 1937 7.430 28.520 21.310 1.00 0.00 ATOM 21428 OH2 SOL 1938 8.870 12.210 -0.180 1.00 0.00 ATOM 21429 H1 SOL 1938 8.330 12.480 0.570 1.00 0.00 ATOM 21430 H2 SOL 1938 9.550 11.660 0.210 1.00 0.00 ATOM 21431 OH2 SOL 1939 42.610 4.180 77.680 1.00 0.00 ATOM 21432 H1 SOL 1939 43.100 3.420 77.380 1.00 0.00 ATOM 21433 H2 SOL 1939 43.230 4.660 78.230 1.00 0.00 ATOM 21434 OH2 SOL 1940 57.300 39.350 1.170 1.00 0.00 ATOM 21435 H1 SOL 1940 57.120 40.190 1.600 1.00 0.00 ATOM 21436 H2 SOL 1940 58.050 39.000 1.660 1.00 0.00 ATOM 21437 OH2 SOL 1941 35.860 38.750 73.650 1.00 0.00 ATOM 21438 H1 SOL 1941 35.040 39.110 73.300 1.00 0.00 ATOM 21439 H2 SOL 1941 35.770 37.800 73.540 1.00 0.00 ATOM 21440 OH2 SOL 1942 49.030 30.500 76.140 1.00 0.00 ATOM 21441 H1 SOL 1942 49.160 29.960 76.930 1.00 0.00 ATOM 21442 H2 SOL 1942 49.910 30.780 75.900 1.00 0.00 ATOM 21443 OH2 SOL 1943 52.590 49.380 75.380 1.00 0.00 ATOM 21444 H1 SOL 1943 51.780 49.870 75.550 1.00 0.00 ATOM 21445 H2 SOL 1943 52.660 49.350 74.430 1.00 0.00 ATOM 21446 OH2 SOL 1944 56.960 36.330 79.490 1.00 0.00 ATOM 21447 H1 SOL 1944 56.280 36.060 80.110 1.00 0.00 ATOM 21448 H2 SOL 1944 57.780 36.140 79.940 1.00 0.00 ATOM 21449 OH2 SOL 1945 34.810 52.550 70.460 1.00 0.00 ATOM 21450 H1 SOL 1945 35.460 52.590 69.760 1.00 0.00 ATOM 21451 H2 SOL 1945 34.810 53.430 70.840 1.00 0.00 ATOM 21452 OH2 SOL 1946 31.120 41.820 6.350 1.00 0.00 ATOM 21453 H1 SOL 1946 30.770 42.610 5.950 1.00 0.00 ATOM 21454 H2 SOL 1946 31.090 41.160 5.660 1.00 0.00 ATOM 21455 OH2 SOL 1947 42.510 24.000 78.870 1.00 0.00 ATOM 21456 H1 SOL 1947 43.080 24.390 79.520 1.00 0.00 ATOM 21457 H2 SOL 1947 41.800 24.630 78.760 1.00 0.00 ATOM 21458 OH2 SOL 1948 12.670 13.910 71.830 1.00 0.00 ATOM 21459 H1 SOL 1948 13.200 13.250 71.380 1.00 0.00 ATOM 21460 H2 SOL 1948 12.280 14.430 71.130 1.00 0.00 ATOM 21461 OH2 SOL 1949 8.680 21.880 82.150 1.00 0.00 ATOM 21462 H1 SOL 1949 9.190 22.610 82.490 1.00 0.00 ATOM 21463 H2 SOL 1949 8.920 21.140 82.710 1.00 0.00 ATOM 21464 OH2 SOL 1950 59.170 15.560 71.960 1.00 0.00 ATOM 21465 H1 SOL 1950 59.810 15.620 71.250 1.00 0.00 ATOM 21466 H2 SOL 1950 59.240 14.660 72.270 1.00 0.00 ATOM 21467 OH2 SOL 1951 41.630 44.410 12.620 1.00 0.00 ATOM 21468 H1 SOL 1951 41.070 45.040 12.170 1.00 0.00 ATOM 21469 H2 SOL 1951 41.130 44.150 13.390 1.00 0.00 ATOM 21470 OH2 SOL 1952 48.160 46.090 4.620 1.00 0.00 ATOM 21471 H1 SOL 1952 48.530 45.660 3.840 1.00 0.00 ATOM 21472 H2 SOL 1952 47.790 46.910 4.290 1.00 0.00 ATOM 21473 OH2 SOL 1953 49.960 57.940 60.980 1.00 0.00 ATOM 21474 H1 SOL 1953 49.150 58.440 60.870 1.00 0.00 ATOM 21475 H2 SOL 1953 50.120 57.540 60.130 1.00 0.00 ATOM 21476 OH2 SOL 1954 33.560 8.720 20.900 1.00 0.00 ATOM 21477 H1 SOL 1954 33.440 8.700 19.950 1.00 0.00 ATOM 21478 H2 SOL 1954 32.840 9.270 21.220 1.00 0.00 ATOM 21479 OH2 SOL 1955 19.850 30.470 73.540 1.00 0.00 ATOM 21480 H1 SOL 1955 19.050 30.990 73.440 1.00 0.00 ATOM 21481 H2 SOL 1955 19.710 29.950 74.330 1.00 0.00 ATOM 21482 OH2 SOL 1956 14.240 52.770 83.030 1.00 0.00 ATOM 21483 H1 SOL 1956 13.640 53.510 82.920 1.00 0.00 ATOM 21484 H2 SOL 1956 13.770 52.170 83.610 1.00 0.00 ATOM 21485 OH2 SOL 1957 36.970 34.760 25.300 1.00 0.00 ATOM 21486 H1 SOL 1957 36.320 34.080 25.480 1.00 0.00 ATOM 21487 H2 SOL 1957 37.810 34.300 25.350 1.00 0.00 ATOM 21488 OH2 SOL 1958 31.590 49.270 7.870 1.00 0.00 ATOM 21489 H1 SOL 1958 31.060 48.940 7.140 1.00 0.00 ATOM 21490 H2 SOL 1958 31.160 50.080 8.130 1.00 0.00 ATOM 21491 OH2 SOL 1959 28.780 9.170 18.660 1.00 0.00 ATOM 21492 H1 SOL 1959 28.670 10.090 18.890 1.00 0.00 ATOM 21493 H2 SOL 1959 28.830 8.720 19.510 1.00 0.00 ATOM 21494 OH2 SOL 1960 55.040 9.530 13.830 1.00 0.00 ATOM 21495 H1 SOL 1960 54.530 9.800 14.590 1.00 0.00 ATOM 21496 H2 SOL 1960 54.950 10.260 13.210 1.00 0.00 ATOM 21497 OH2 SOL 1961 48.880 39.150 11.310 1.00 0.00 ATOM 21498 H1 SOL 1961 49.640 38.610 11.570 1.00 0.00 ATOM 21499 H2 SOL 1961 49.120 39.500 10.460 1.00 0.00 ATOM 21500 OH2 SOL 1962 11.680 31.500 18.810 1.00 0.00 ATOM 21501 H1 SOL 1962 12.520 31.240 19.210 1.00 0.00 ATOM 21502 H2 SOL 1962 11.610 30.960 18.020 1.00 0.00 ATOM 21503 OH2 SOL 1963 16.380 16.210 64.370 1.00 0.00 ATOM 21504 H1 SOL 1963 16.580 17.150 64.410 1.00 0.00 ATOM 21505 H2 SOL 1963 15.430 16.170 64.350 1.00 0.00 ATOM 21506 OH2 SOL 1964 33.340 58.160 17.910 1.00 0.00 ATOM 21507 H1 SOL 1964 33.680 59.060 17.940 1.00 0.00 ATOM 21508 H2 SOL 1964 33.870 57.690 18.550 1.00 0.00 ATOM 21509 OH2 SOL 1965 29.350 34.090 12.200 1.00 0.00 ATOM 21510 H1 SOL 1965 29.400 33.760 11.310 1.00 0.00 ATOM 21511 H2 SOL 1965 29.080 35.010 12.100 1.00 0.00 ATOM 21512 OH2 SOL 1966 0.090 8.160 76.950 1.00 0.00 ATOM 21513 H1 SOL 1966 0.860 7.620 77.130 1.00 0.00 ATOM 21514 H2 SOL 1966 0.420 9.060 76.950 1.00 0.00 ATOM 21515 OH2 SOL 1967 49.900 6.950 10.950 1.00 0.00 ATOM 21516 H1 SOL 1967 50.110 7.550 11.670 1.00 0.00 ATOM 21517 H2 SOL 1967 49.140 7.350 10.530 1.00 0.00 ATOM 21518 OH2 SOL 1968 2.500 56.180 16.760 1.00 0.00 ATOM 21519 H1 SOL 1968 3.020 55.810 16.040 1.00 0.00 ATOM 21520 H2 SOL 1968 1.830 56.700 16.320 1.00 0.00 ATOM 21521 OH2 SOL 1969 26.860 42.860 20.040 1.00 0.00 ATOM 21522 H1 SOL 1969 26.280 43.220 20.710 1.00 0.00 ATOM 21523 H2 SOL 1969 26.400 43.040 19.210 1.00 0.00 ATOM 21524 OH2 SOL 1970 41.780 13.770 10.720 1.00 0.00 ATOM 21525 H1 SOL 1970 41.810 14.520 11.310 1.00 0.00 ATOM 21526 H2 SOL 1970 41.200 14.050 10.010 1.00 0.00 ATOM 21527 OH2 SOL 1971 45.680 40.190 83.480 1.00 0.00 ATOM 21528 H1 SOL 1971 45.420 39.350 83.860 1.00 0.00 ATOM 21529 H2 SOL 1971 46.520 40.390 83.900 1.00 0.00 ATOM 21530 OH2 SOL 1972 30.590 15.810 1.730 1.00 0.00 ATOM 21531 H1 SOL 1972 30.050 15.930 2.510 1.00 0.00 ATOM 21532 H2 SOL 1972 31.360 15.320 2.030 1.00 0.00 ATOM 21533 OH2 SOL 1973 25.020 37.190 22.050 1.00 0.00 ATOM 21534 H1 SOL 1973 24.170 37.630 21.960 1.00 0.00 ATOM 21535 H2 SOL 1973 25.250 36.940 21.160 1.00 0.00 ATOM 21536 OH2 SOL 1974 13.740 8.320 0.490 1.00 0.00 ATOM 21537 H1 SOL 1974 13.720 9.260 0.670 1.00 0.00 ATOM 21538 H2 SOL 1974 12.820 8.080 0.400 1.00 0.00 ATOM 21539 OH2 SOL 1975 23.540 1.460 2.790 1.00 0.00 ATOM 21540 H1 SOL 1975 23.080 1.950 3.470 1.00 0.00 ATOM 21541 H2 SOL 1975 24.420 1.310 3.160 1.00 0.00 ATOM 21542 OH2 SOL 1976 8.040 52.380 16.100 1.00 0.00 ATOM 21543 H1 SOL 1976 8.410 52.680 15.270 1.00 0.00 ATOM 21544 H2 SOL 1976 8.770 52.410 16.720 1.00 0.00 ATOM 21545 OH2 SOL 1977 31.100 27.630 22.730 1.00 0.00 ATOM 21546 H1 SOL 1977 31.630 28.130 22.110 1.00 0.00 ATOM 21547 H2 SOL 1977 31.420 27.890 23.590 1.00 0.00 ATOM 21548 OH2 SOL 1978 40.090 30.060 13.410 1.00 0.00 ATOM 21549 H1 SOL 1978 40.700 30.220 14.130 1.00 0.00 ATOM 21550 H2 SOL 1978 39.220 30.190 13.810 1.00 0.00 ATOM 21551 OH2 SOL 1979 28.780 30.040 19.810 1.00 0.00 ATOM 21552 H1 SOL 1979 29.040 30.860 19.380 1.00 0.00 ATOM 21553 H2 SOL 1979 27.830 30.130 19.940 1.00 0.00 ATOM 21554 OH2 SOL 1980 49.010 25.060 79.700 1.00 0.00 ATOM 21555 H1 SOL 1980 49.520 24.920 78.900 1.00 0.00 ATOM 21556 H2 SOL 1980 49.110 24.240 80.190 1.00 0.00 ATOM 21557 OH2 SOL 1981 57.420 46.240 3.000 1.00 0.00 ATOM 21558 H1 SOL 1981 56.900 45.650 2.450 1.00 0.00 ATOM 21559 H2 SOL 1981 57.260 45.950 3.890 1.00 0.00 ATOM 21560 OH2 SOL 1982 51.240 20.290 66.210 1.00 0.00 ATOM 21561 H1 SOL 1982 50.940 21.180 66.010 1.00 0.00 ATOM 21562 H2 SOL 1982 51.060 20.190 67.150 1.00 0.00 ATOM 21563 OH2 SOL 1983 32.180 50.700 77.270 1.00 0.00 ATOM 21564 H1 SOL 1983 32.290 51.650 77.280 1.00 0.00 ATOM 21565 H2 SOL 1983 31.320 50.560 77.660 1.00 0.00 ATOM 21566 OH2 SOL 1984 50.480 46.510 65.340 1.00 0.00 ATOM 21567 H1 SOL 1984 50.470 46.820 64.440 1.00 0.00 ATOM 21568 H2 SOL 1984 49.590 46.170 65.490 1.00 0.00 ATOM 21569 OH2 SOL 1985 5.320 53.470 21.320 1.00 0.00 ATOM 21570 H1 SOL 1985 5.260 54.000 22.110 1.00 0.00 ATOM 21571 H2 SOL 1985 5.240 54.100 20.600 1.00 0.00 ATOM 21572 OH2 SOL 1986 51.270 57.530 25.130 1.00 0.00 ATOM 21573 H1 SOL 1986 50.530 57.320 25.710 1.00 0.00 ATOM 21574 H2 SOL 1986 50.870 58.020 24.410 1.00 0.00 ATOM 21575 OH2 SOL 1987 16.080 39.350 20.990 1.00 0.00 ATOM 21576 H1 SOL 1987 16.810 39.130 21.580 1.00 0.00 ATOM 21577 H2 SOL 1987 16.210 38.790 20.230 1.00 0.00 ATOM 21578 OH2 SOL 1988 27.730 29.650 9.380 1.00 0.00 ATOM 21579 H1 SOL 1988 27.110 30.340 9.600 1.00 0.00 ATOM 21580 H2 SOL 1988 28.310 30.050 8.720 1.00 0.00 ATOM 21581 OH2 SOL 1989 1.560 3.980 15.300 1.00 0.00 ATOM 21582 H1 SOL 1989 2.210 4.610 14.990 1.00 0.00 ATOM 21583 H2 SOL 1989 0.820 4.520 15.580 1.00 0.00 ATOM 21584 OH2 SOL 1990 32.620 54.620 3.530 1.00 0.00 ATOM 21585 H1 SOL 1990 32.300 55.500 3.320 1.00 0.00 ATOM 21586 H2 SOL 1990 32.050 54.310 4.230 1.00 0.00 ATOM 21587 OH2 SOL 1991 34.260 27.040 22.220 1.00 0.00 ATOM 21588 H1 SOL 1991 35.100 27.380 21.900 1.00 0.00 ATOM 21589 H2 SOL 1991 33.630 27.720 21.990 1.00 0.00 ATOM 21590 OH2 SOL 1992 37.560 40.040 81.080 1.00 0.00 ATOM 21591 H1 SOL 1992 37.520 40.150 82.030 1.00 0.00 ATOM 21592 H2 SOL 1992 36.650 40.170 80.790 1.00 0.00 ATOM 21593 OH2 SOL 1993 22.760 22.700 0.340 1.00 0.00 ATOM 21594 H1 SOL 1993 21.950 23.220 0.290 1.00 0.00 ATOM 21595 H2 SOL 1993 23.250 23.100 1.070 1.00 0.00 ATOM 21596 OH2 SOL 1994 12.450 29.470 16.870 1.00 0.00 ATOM 21597 H1 SOL 1994 12.170 29.410 15.960 1.00 0.00 ATOM 21598 H2 SOL 1994 13.400 29.550 16.820 1.00 0.00 ATOM 21599 OH2 SOL 1995 44.380 43.790 21.930 1.00 0.00 ATOM 21600 H1 SOL 1995 43.890 43.850 22.750 1.00 0.00 ATOM 21601 H2 SOL 1995 44.540 42.860 21.810 1.00 0.00 ATOM 21602 OH2 SOL 1996 15.970 4.280 68.130 1.00 0.00 ATOM 21603 H1 SOL 1996 16.060 3.330 68.260 1.00 0.00 ATOM 21604 H2 SOL 1996 16.850 4.620 68.220 1.00 0.00 ATOM 21605 OH2 SOL 1997 11.130 5.230 1.020 1.00 0.00 ATOM 21606 H1 SOL 1997 11.630 5.390 0.210 1.00 0.00 ATOM 21607 H2 SOL 1997 11.030 4.280 1.050 1.00 0.00 ATOM 21608 OH2 SOL 1998 9.720 49.890 78.830 1.00 0.00 ATOM 21609 H1 SOL 1998 9.090 50.600 78.900 1.00 0.00 ATOM 21610 H2 SOL 1998 10.440 50.260 78.310 1.00 0.00 ATOM 21611 OH2 SOL 1999 40.570 33.500 29.980 1.00 0.00 ATOM 21612 H1 SOL 1999 41.260 32.930 30.330 1.00 0.00 ATOM 21613 H2 SOL 1999 41.020 34.300 29.720 1.00 0.00 ATOM 21614 OH2 SOL 2000 28.360 27.460 0.580 1.00 0.00 ATOM 21615 H1 SOL 2000 28.670 27.720 1.450 1.00 0.00 ATOM 21616 H2 SOL 2000 27.830 28.200 0.280 1.00 0.00 ATOM 21617 OH2 SOL 2001 51.000 30.160 11.640 1.00 0.00 ATOM 21618 H1 SOL 2001 51.420 31.000 11.450 1.00 0.00 ATOM 21619 H2 SOL 2001 50.230 30.380 12.160 1.00 0.00 ATOM 21620 OH2 SOL 2002 51.280 20.100 69.010 1.00 0.00 ATOM 21621 H1 SOL 2002 50.670 20.610 69.540 1.00 0.00 ATOM 21622 H2 SOL 2002 51.030 19.190 69.160 1.00 0.00 ATOM 21623 OH2 SOL 2003 40.180 36.640 78.580 1.00 0.00 ATOM 21624 H1 SOL 2003 41.140 36.610 78.510 1.00 0.00 ATOM 21625 H2 SOL 2003 39.870 36.560 77.680 1.00 0.00 ATOM 21626 OH2 SOL 2004 43.390 9.210 0.240 1.00 0.00 ATOM 21627 H1 SOL 2004 42.990 10.080 0.160 1.00 0.00 ATOM 21628 H2 SOL 2004 43.000 8.840 1.020 1.00 0.00 ATOM 21629 OH2 SOL 2005 6.580 47.210 66.340 1.00 0.00 ATOM 21630 H1 SOL 2005 6.990 47.780 66.990 1.00 0.00 ATOM 21631 H2 SOL 2005 7.300 46.730 65.940 1.00 0.00 ATOM 21632 OH2 SOL 2006 59.210 14.550 83.300 1.00 0.00 ATOM 21633 H1 SOL 2006 58.910 13.790 83.810 1.00 0.00 ATOM 21634 H2 SOL 2006 59.240 14.230 82.400 1.00 0.00 ATOM 21635 OH2 SOL 2007 45.720 0.450 75.650 1.00 0.00 ATOM 21636 H1 SOL 2007 45.990 -0.440 75.860 1.00 0.00 ATOM 21637 H2 SOL 2007 45.530 0.420 74.710 1.00 0.00 ATOM 21638 OH2 SOL 2008 55.460 5.050 16.300 1.00 0.00 ATOM 21639 H1 SOL 2008 55.090 4.190 16.510 1.00 0.00 ATOM 21640 H2 SOL 2008 56.360 4.870 16.020 1.00 0.00 ATOM 21641 OH2 SOL 2009 31.520 8.020 69.860 1.00 0.00 ATOM 21642 H1 SOL 2009 30.700 7.530 69.800 1.00 0.00 ATOM 21643 H2 SOL 2009 31.440 8.690 69.180 1.00 0.00 ATOM 21644 OH2 SOL 2010 21.660 30.810 16.360 1.00 0.00 ATOM 21645 H1 SOL 2010 20.780 30.590 16.660 1.00 0.00 ATOM 21646 H2 SOL 2010 21.940 30.060 15.830 1.00 0.00 ATOM 21647 OH2 SOL 2011 25.210 45.310 81.720 1.00 0.00 ATOM 21648 H1 SOL 2011 25.070 44.370 81.570 1.00 0.00 ATOM 21649 H2 SOL 2011 25.830 45.580 81.040 1.00 0.00 ATOM 21650 OH2 SOL 2012 40.430 57.630 3.040 1.00 0.00 ATOM 21651 H1 SOL 2012 40.860 57.960 2.240 1.00 0.00 ATOM 21652 H2 SOL 2012 39.620 58.140 3.100 1.00 0.00 ATOM 21653 OH2 SOL 2013 35.720 35.710 8.030 1.00 0.00 ATOM 21654 H1 SOL 2013 35.540 34.790 8.210 1.00 0.00 ATOM 21655 H2 SOL 2013 36.670 35.750 7.920 1.00 0.00 ATOM 21656 OH2 SOL 2014 48.840 0.490 7.470 1.00 0.00 ATOM 21657 H1 SOL 2014 48.700 -0.350 7.910 1.00 0.00 ATOM 21658 H2 SOL 2014 48.450 0.380 6.600 1.00 0.00 ATOM 21659 OH2 SOL 2015 36.400 25.020 23.380 1.00 0.00 ATOM 21660 H1 SOL 2015 36.640 24.210 23.820 1.00 0.00 ATOM 21661 H2 SOL 2015 36.520 25.700 24.050 1.00 0.00 ATOM 21662 OH2 SOL 2016 47.260 53.590 76.460 1.00 0.00 ATOM 21663 H1 SOL 2016 46.380 53.580 76.850 1.00 0.00 ATOM 21664 H2 SOL 2016 47.680 54.360 76.850 1.00 0.00 ATOM 21665 OH2 SOL 2017 24.030 17.380 10.950 1.00 0.00 ATOM 21666 H1 SOL 2017 24.110 17.040 10.050 1.00 0.00 ATOM 21667 H2 SOL 2017 24.170 16.610 11.510 1.00 0.00 ATOM 21668 OH2 SOL 2018 26.710 45.390 15.690 1.00 0.00 ATOM 21669 H1 SOL 2018 26.210 45.060 14.950 1.00 0.00 ATOM 21670 H2 SOL 2018 26.270 46.200 15.940 1.00 0.00 ATOM 21671 OH2 SOL 2019 53.490 32.650 3.800 1.00 0.00 ATOM 21672 H1 SOL 2019 53.500 33.590 3.970 1.00 0.00 ATOM 21673 H2 SOL 2019 54.160 32.300 4.390 1.00 0.00 ATOM 21674 OH2 SOL 2020 49.600 44.480 71.360 1.00 0.00 ATOM 21675 H1 SOL 2020 50.380 43.960 71.200 1.00 0.00 ATOM 21676 H2 SOL 2020 49.860 45.100 72.050 1.00 0.00 ATOM 21677 OH2 SOL 2021 12.030 15.300 20.990 1.00 0.00 ATOM 21678 H1 SOL 2021 11.290 15.390 21.580 1.00 0.00 ATOM 21679 H2 SOL 2021 12.650 14.760 21.460 1.00 0.00 ATOM 21680 OH2 SOL 2022 9.350 50.060 26.400 1.00 0.00 ATOM 21681 H1 SOL 2022 9.840 50.580 25.760 1.00 0.00 ATOM 21682 H2 SOL 2022 8.440 50.360 26.310 1.00 0.00 ATOM 21683 OH2 SOL 2023 43.860 5.320 17.290 1.00 0.00 ATOM 21684 H1 SOL 2023 43.590 4.670 17.940 1.00 0.00 ATOM 21685 H2 SOL 2023 43.590 4.940 16.450 1.00 0.00 ATOM 21686 OH2 SOL 2024 33.790 35.220 81.920 1.00 0.00 ATOM 21687 H1 SOL 2024 34.370 35.510 81.220 1.00 0.00 ATOM 21688 H2 SOL 2024 33.010 35.770 81.840 1.00 0.00 ATOM 21689 OH2 SOL 2025 6.200 31.200 10.930 1.00 0.00 ATOM 21690 H1 SOL 2025 6.110 31.080 9.990 1.00 0.00 ATOM 21691 H2 SOL 2025 5.400 31.650 11.190 1.00 0.00 ATOM 21692 OH2 SOL 2026 42.420 0.710 70.490 1.00 0.00 ATOM 21693 H1 SOL 2026 41.810 0.400 71.160 1.00 0.00 ATOM 21694 H2 SOL 2026 42.460 1.660 70.630 1.00 0.00 ATOM 21695 OH2 SOL 2027 39.790 26.390 14.530 1.00 0.00 ATOM 21696 H1 SOL 2027 40.520 26.750 15.030 1.00 0.00 ATOM 21697 H2 SOL 2027 39.920 25.440 14.570 1.00 0.00 ATOM 21698 OH2 SOL 2028 50.610 33.570 6.830 1.00 0.00 ATOM 21699 H1 SOL 2028 50.510 33.890 5.930 1.00 0.00 ATOM 21700 H2 SOL 2028 49.820 33.870 7.270 1.00 0.00 ATOM 21701 OH2 SOL 2029 39.220 57.960 23.910 1.00 0.00 ATOM 21702 H1 SOL 2029 40.150 58.160 23.970 1.00 0.00 ATOM 21703 H2 SOL 2029 39.150 57.050 24.180 1.00 0.00 ATOM 21704 OH2 SOL 2030 29.330 48.870 6.640 1.00 0.00 ATOM 21705 H1 SOL 2030 28.510 49.350 6.530 1.00 0.00 ATOM 21706 H2 SOL 2030 29.620 48.680 5.750 1.00 0.00 ATOM 21707 OH2 SOL 2031 60.700 5.000 78.430 1.00 0.00 ATOM 21708 H1 SOL 2031 60.860 4.060 78.380 1.00 0.00 ATOM 21709 H2 SOL 2031 61.570 5.390 78.360 1.00 0.00 ATOM 21710 OH2 SOL 2032 4.790 57.090 82.820 1.00 0.00 ATOM 21711 H1 SOL 2032 4.630 56.320 82.270 1.00 0.00 ATOM 21712 H2 SOL 2032 5.290 56.740 83.570 1.00 0.00 ATOM 21713 OH2 SOL 2033 22.170 1.070 70.340 1.00 0.00 ATOM 21714 H1 SOL 2033 22.080 1.090 71.290 1.00 0.00 ATOM 21715 H2 SOL 2033 22.360 0.160 70.130 1.00 0.00 ATOM 21716 OH2 SOL 2034 53.740 18.970 81.970 1.00 0.00 ATOM 21717 H1 SOL 2034 54.590 18.590 82.210 1.00 0.00 ATOM 21718 H2 SOL 2034 53.940 19.560 81.240 1.00 0.00 ATOM 21719 OH2 SOL 2035 46.790 45.800 25.140 1.00 0.00 ATOM 21720 H1 SOL 2035 47.130 46.680 25.320 1.00 0.00 ATOM 21721 H2 SOL 2035 45.860 45.850 25.380 1.00 0.00 ATOM 21722 OH2 SOL 2036 4.210 54.980 65.630 1.00 0.00 ATOM 21723 H1 SOL 2036 4.990 55.070 66.180 1.00 0.00 ATOM 21724 H2 SOL 2036 4.440 55.420 64.810 1.00 0.00 ATOM 21725 OH2 SOL 2037 54.200 20.260 4.950 1.00 0.00 ATOM 21726 H1 SOL 2037 53.940 21.040 5.450 1.00 0.00 ATOM 21727 H2 SOL 2037 54.640 19.710 5.600 1.00 0.00 ATOM 21728 OH2 SOL 2038 42.720 21.530 14.310 1.00 0.00 ATOM 21729 H1 SOL 2038 42.250 21.380 13.490 1.00 0.00 ATOM 21730 H2 SOL 2038 43.180 20.710 14.480 1.00 0.00 ATOM 21731 OH2 SOL 2039 9.830 1.720 65.240 1.00 0.00 ATOM 21732 H1 SOL 2039 10.620 1.190 65.210 1.00 0.00 ATOM 21733 H2 SOL 2039 9.410 1.570 64.390 1.00 0.00 ATOM 21734 OH2 SOL 2040 28.580 14.860 21.050 1.00 0.00 ATOM 21735 H1 SOL 2040 28.250 15.420 20.350 1.00 0.00 ATOM 21736 H2 SOL 2040 28.370 13.970 20.770 1.00 0.00 ATOM 21737 OH2 SOL 2041 42.280 34.580 75.570 1.00 0.00 ATOM 21738 H1 SOL 2041 42.870 34.330 74.860 1.00 0.00 ATOM 21739 H2 SOL 2041 41.880 33.760 75.850 1.00 0.00 ATOM 21740 OH2 SOL 2042 56.390 54.350 18.080 1.00 0.00 ATOM 21741 H1 SOL 2042 55.980 54.150 17.240 1.00 0.00 ATOM 21742 H2 SOL 2042 56.040 53.690 18.680 1.00 0.00 ATOM 21743 OH2 SOL 2043 33.860 41.920 71.140 1.00 0.00 ATOM 21744 H1 SOL 2043 33.630 41.790 70.220 1.00 0.00 ATOM 21745 H2 SOL 2043 34.720 42.340 71.110 1.00 0.00 ATOM 21746 OH2 SOL 2044 56.780 13.090 70.820 1.00 0.00 ATOM 21747 H1 SOL 2044 57.600 13.040 71.320 1.00 0.00 ATOM 21748 H2 SOL 2044 56.980 13.660 70.080 1.00 0.00 ATOM 21749 OH2 SOL 2045 36.880 23.070 69.320 1.00 0.00 ATOM 21750 H1 SOL 2045 37.260 23.720 68.730 1.00 0.00 ATOM 21751 H2 SOL 2045 35.940 23.210 69.250 1.00 0.00 ATOM 21752 OH2 SOL 2046 26.400 25.220 82.570 1.00 0.00 ATOM 21753 H1 SOL 2046 27.070 25.120 83.250 1.00 0.00 ATOM 21754 H2 SOL 2046 26.330 26.160 82.440 1.00 0.00 ATOM 21755 OH2 SOL 2047 41.690 39.700 12.540 1.00 0.00 ATOM 21756 H1 SOL 2047 42.080 39.390 11.730 1.00 0.00 ATOM 21757 H2 SOL 2047 41.740 40.650 12.480 1.00 0.00 ATOM 21758 OH2 SOL 2048 18.370 22.580 12.710 1.00 0.00 ATOM 21759 H1 SOL 2048 18.190 22.250 13.590 1.00 0.00 ATOM 21760 H2 SOL 2048 19.320 22.710 12.690 1.00 0.00 ATOM 21761 OH2 SOL 2049 21.100 15.360 68.800 1.00 0.00 ATOM 21762 H1 SOL 2049 21.250 16.140 68.270 1.00 0.00 ATOM 21763 H2 SOL 2049 20.430 15.620 69.430 1.00 0.00 ATOM 21764 OH2 SOL 2050 43.350 19.040 8.760 1.00 0.00 ATOM 21765 H1 SOL 2050 43.340 18.150 9.120 1.00 0.00 ATOM 21766 H2 SOL 2050 42.630 19.480 9.210 1.00 0.00 ATOM 21767 OH2 SOL 2051 27.550 21.050 80.010 1.00 0.00 ATOM 21768 H1 SOL 2051 27.010 21.570 80.600 1.00 0.00 ATOM 21769 H2 SOL 2051 28.440 21.370 80.160 1.00 0.00 ATOM 21770 OH2 SOL 2052 53.370 1.910 68.340 1.00 0.00 ATOM 21771 H1 SOL 2052 52.640 1.600 68.870 1.00 0.00 ATOM 21772 H2 SOL 2052 53.520 1.220 67.710 1.00 0.00 ATOM 21773 OH2 SOL 2053 8.380 40.180 65.080 1.00 0.00 ATOM 21774 H1 SOL 2053 7.780 39.460 64.910 1.00 0.00 ATOM 21775 H2 SOL 2053 8.210 40.800 64.370 1.00 0.00 ATOM 21776 OH2 SOL 2054 29.450 1.680 76.540 1.00 0.00 ATOM 21777 H1 SOL 2054 29.140 2.440 76.060 1.00 0.00 ATOM 21778 H2 SOL 2054 29.360 0.950 75.930 1.00 0.00 ATOM 21779 OH2 SOL 2055 30.790 38.550 69.890 1.00 0.00 ATOM 21780 H1 SOL 2055 29.960 38.840 70.260 1.00 0.00 ATOM 21781 H2 SOL 2055 30.570 38.190 69.030 1.00 0.00 ATOM 21782 OH2 SOL 2056 48.020 27.110 19.140 1.00 0.00 ATOM 21783 H1 SOL 2056 48.230 27.550 19.960 1.00 0.00 ATOM 21784 H2 SOL 2056 47.290 27.610 18.770 1.00 0.00 ATOM 21785 OH2 SOL 2057 32.430 47.140 18.690 1.00 0.00 ATOM 21786 H1 SOL 2057 31.970 46.640 19.360 1.00 0.00 ATOM 21787 H2 SOL 2057 33.240 47.440 19.110 1.00 0.00 ATOM 21788 OH2 SOL 2058 43.850 26.500 14.490 1.00 0.00 ATOM 21789 H1 SOL 2058 43.900 25.550 14.430 1.00 0.00 ATOM 21790 H2 SOL 2058 44.760 26.800 14.460 1.00 0.00 ATOM 21791 OH2 SOL 2059 29.770 11.830 16.630 1.00 0.00 ATOM 21792 H1 SOL 2059 30.450 12.200 17.200 1.00 0.00 ATOM 21793 H2 SOL 2059 30.240 11.260 16.030 1.00 0.00 ATOM 21794 OH2 SOL 2060 14.250 53.890 62.270 1.00 0.00 ATOM 21795 H1 SOL 2060 14.920 53.450 61.750 1.00 0.00 ATOM 21796 H2 SOL 2060 14.580 54.780 62.370 1.00 0.00 ATOM 21797 OH2 SOL 2061 35.590 21.200 66.190 1.00 0.00 ATOM 21798 H1 SOL 2061 36.120 20.660 66.780 1.00 0.00 ATOM 21799 H2 SOL 2061 34.900 20.610 65.890 1.00 0.00 ATOM 21800 OH2 SOL 2062 48.770 21.200 69.170 1.00 0.00 ATOM 21801 H1 SOL 2062 47.990 20.700 68.930 1.00 0.00 ATOM 21802 H2 SOL 2062 48.980 21.700 68.380 1.00 0.00 ATOM 21803 OH2 SOL 2063 19.320 33.570 75.160 1.00 0.00 ATOM 21804 H1 SOL 2063 20.040 33.150 75.630 1.00 0.00 ATOM 21805 H2 SOL 2063 18.770 33.940 75.840 1.00 0.00 ATOM 21806 OH2 SOL 2064 51.440 56.540 69.330 1.00 0.00 ATOM 21807 H1 SOL 2064 51.310 56.300 70.250 1.00 0.00 ATOM 21808 H2 SOL 2064 52.390 56.450 69.200 1.00 0.00 ATOM 21809 OH2 SOL 2065 25.120 34.530 18.520 1.00 0.00 ATOM 21810 H1 SOL 2065 24.870 33.890 17.850 1.00 0.00 ATOM 21811 H2 SOL 2065 25.090 35.370 18.080 1.00 0.00 ATOM 21812 OH2 SOL 2066 39.480 4.890 6.590 1.00 0.00 ATOM 21813 H1 SOL 2066 38.610 4.520 6.470 1.00 0.00 ATOM 21814 H2 SOL 2066 40.000 4.170 6.950 1.00 0.00 ATOM 21815 OH2 SOL 2067 18.400 43.200 17.370 1.00 0.00 ATOM 21816 H1 SOL 2067 19.200 42.900 16.950 1.00 0.00 ATOM 21817 H2 SOL 2067 17.880 42.410 17.510 1.00 0.00 ATOM 21818 OH2 SOL 2068 57.420 17.170 20.520 1.00 0.00 ATOM 21819 H1 SOL 2068 57.370 16.840 21.410 1.00 0.00 ATOM 21820 H2 SOL 2068 58.330 17.450 20.420 1.00 0.00 ATOM 21821 OH2 SOL 2069 4.210 12.710 3.040 1.00 0.00 ATOM 21822 H1 SOL 2069 3.580 12.930 2.340 1.00 0.00 ATOM 21823 H2 SOL 2069 5.030 12.540 2.570 1.00 0.00 ATOM 21824 OH2 SOL 2070 53.670 8.810 27.000 1.00 0.00 ATOM 21825 H1 SOL 2070 54.030 7.930 26.910 1.00 0.00 ATOM 21826 H2 SOL 2070 52.830 8.670 27.450 1.00 0.00 ATOM 21827 OH2 SOL 2071 13.550 9.480 18.130 1.00 0.00 ATOM 21828 H1 SOL 2071 13.230 10.240 18.610 1.00 0.00 ATOM 21829 H2 SOL 2071 12.960 9.410 17.380 1.00 0.00 ATOM 21830 OH2 SOL 2072 58.230 57.380 71.710 1.00 0.00 ATOM 21831 H1 SOL 2072 58.610 58.260 71.730 1.00 0.00 ATOM 21832 H2 SOL 2072 58.920 56.830 71.340 1.00 0.00 ATOM 21833 OH2 SOL 2073 6.490 4.240 72.100 1.00 0.00 ATOM 21834 H1 SOL 2073 5.690 3.720 72.010 1.00 0.00 ATOM 21835 H2 SOL 2073 6.240 4.970 72.660 1.00 0.00 ATOM 21836 OH2 SOL 2074 11.100 13.050 8.360 1.00 0.00 ATOM 21837 H1 SOL 2074 11.520 13.750 8.850 1.00 0.00 ATOM 21838 H2 SOL 2074 10.460 12.680 8.980 1.00 0.00 ATOM 21839 OH2 SOL 2075 1.730 25.180 1.500 1.00 0.00 ATOM 21840 H1 SOL 2075 2.490 25.140 0.920 1.00 0.00 ATOM 21841 H2 SOL 2075 1.720 26.090 1.800 1.00 0.00 ATOM 21842 OH2 SOL 2076 26.680 42.870 75.340 1.00 0.00 ATOM 21843 H1 SOL 2076 26.150 42.700 74.560 1.00 0.00 ATOM 21844 H2 SOL 2076 26.990 42.010 75.610 1.00 0.00 ATOM 21845 OH2 SOL 2077 3.050 7.040 24.110 1.00 0.00 ATOM 21846 H1 SOL 2077 3.160 7.250 25.040 1.00 0.00 ATOM 21847 H2 SOL 2077 3.750 6.410 23.920 1.00 0.00 ATOM 21848 OH2 SOL 2078 20.290 43.260 75.800 1.00 0.00 ATOM 21849 H1 SOL 2078 20.180 43.860 75.070 1.00 0.00 ATOM 21850 H2 SOL 2078 19.660 42.560 75.640 1.00 0.00 ATOM 21851 OH2 SOL 2079 4.790 12.430 82.990 1.00 0.00 ATOM 21852 H1 SOL 2079 4.770 11.470 82.950 1.00 0.00 ATOM 21853 H2 SOL 2079 5.430 12.620 83.680 1.00 0.00 ATOM 21854 OH2 SOL 2080 26.590 52.310 17.670 1.00 0.00 ATOM 21855 H1 SOL 2080 26.070 52.630 18.410 1.00 0.00 ATOM 21856 H2 SOL 2080 26.040 51.650 17.260 1.00 0.00 ATOM 21857 OH2 SOL 2081 44.080 25.550 80.430 1.00 0.00 ATOM 21858 H1 SOL 2081 43.930 26.230 79.770 1.00 0.00 ATOM 21859 H2 SOL 2081 45.000 25.660 80.690 1.00 0.00 ATOM 21860 OH2 SOL 2082 58.260 2.610 10.570 1.00 0.00 ATOM 21861 H1 SOL 2082 57.740 2.400 9.790 1.00 0.00 ATOM 21862 H2 SOL 2082 57.940 2.000 11.230 1.00 0.00 ATOM 21863 OH2 SOL 2083 59.800 17.180 18.160 1.00 0.00 ATOM 21864 H1 SOL 2083 60.200 16.310 18.090 1.00 0.00 ATOM 21865 H2 SOL 2083 60.250 17.580 18.900 1.00 0.00 ATOM 21866 OH2 SOL 2084 53.500 51.770 64.750 1.00 0.00 ATOM 21867 H1 SOL 2084 52.760 51.410 64.260 1.00 0.00 ATOM 21868 H2 SOL 2084 53.990 52.270 64.110 1.00 0.00 ATOM 21869 OH2 SOL 2085 32.330 57.210 2.540 1.00 0.00 ATOM 21870 H1 SOL 2085 31.890 56.930 1.740 1.00 0.00 ATOM 21871 H2 SOL 2085 33.130 57.640 2.240 1.00 0.00 ATOM 21872 OH2 SOL 2086 38.350 22.090 62.920 1.00 0.00 ATOM 21873 H1 SOL 2086 38.180 21.880 62.000 1.00 0.00 ATOM 21874 H2 SOL 2086 37.490 22.100 63.330 1.00 0.00 ATOM 21875 OH2 SOL 2087 40.470 18.880 7.710 1.00 0.00 ATOM 21876 H1 SOL 2087 40.950 18.050 7.630 1.00 0.00 ATOM 21877 H2 SOL 2087 40.260 19.120 6.810 1.00 0.00 ATOM 21878 OH2 SOL 2088 54.540 16.770 20.670 1.00 0.00 ATOM 21879 H1 SOL 2088 55.400 17.070 20.400 1.00 0.00 ATOM 21880 H2 SOL 2088 54.370 17.200 21.500 1.00 0.00 ATOM 21881 OH2 SOL 2089 33.130 41.760 9.470 1.00 0.00 ATOM 21882 H1 SOL 2089 33.990 41.800 9.900 1.00 0.00 ATOM 21883 H2 SOL 2089 33.160 40.970 8.940 1.00 0.00 ATOM 21884 OH2 SOL 2090 57.820 40.970 82.870 1.00 0.00 ATOM 21885 H1 SOL 2090 56.990 41.040 82.410 1.00 0.00 ATOM 21886 H2 SOL 2090 57.660 40.320 83.560 1.00 0.00 ATOM 21887 OH2 SOL 2091 25.010 24.360 24.140 1.00 0.00 ATOM 21888 H1 SOL 2091 25.380 25.110 23.690 1.00 0.00 ATOM 21889 H2 SOL 2091 25.310 23.600 23.630 1.00 0.00 ATOM 21890 OH2 SOL 2092 23.700 45.500 77.910 1.00 0.00 ATOM 21891 H1 SOL 2092 24.490 45.530 77.360 1.00 0.00 ATOM 21892 H2 SOL 2092 22.980 45.580 77.280 1.00 0.00 ATOM 21893 OH2 SOL 2093 41.570 35.790 82.170 1.00 0.00 ATOM 21894 H1 SOL 2093 42.410 35.850 81.730 1.00 0.00 ATOM 21895 H2 SOL 2093 41.340 36.690 82.400 1.00 0.00 ATOM 21896 OH2 SOL 2094 36.480 40.470 13.070 1.00 0.00 ATOM 21897 H1 SOL 2094 36.960 39.820 13.580 1.00 0.00 ATOM 21898 H2 SOL 2094 35.910 40.900 13.710 1.00 0.00 ATOM 21899 OH2 SOL 2095 56.920 41.930 2.660 1.00 0.00 ATOM 21900 H1 SOL 2095 57.140 42.140 3.570 1.00 0.00 ATOM 21901 H2 SOL 2095 57.640 42.310 2.150 1.00 0.00 ATOM 21902 OH2 SOL 2096 32.680 45.940 8.470 1.00 0.00 ATOM 21903 H1 SOL 2096 32.210 45.110 8.450 1.00 0.00 ATOM 21904 H2 SOL 2096 32.200 46.480 9.100 1.00 0.00 ATOM 21905 OH2 SOL 2097 53.470 14.150 14.470 1.00 0.00 ATOM 21906 H1 SOL 2097 53.030 14.990 14.400 1.00 0.00 ATOM 21907 H2 SOL 2097 53.710 13.920 13.580 1.00 0.00 ATOM 21908 OH2 SOL 2098 47.260 18.110 2.750 1.00 0.00 ATOM 21909 H1 SOL 2098 47.040 17.600 1.960 1.00 0.00 ATOM 21910 H2 SOL 2098 47.730 17.490 3.310 1.00 0.00 ATOM 21911 OH2 SOL 2099 61.070 42.490 2.590 1.00 0.00 ATOM 21912 H1 SOL 2099 61.840 42.700 3.120 1.00 0.00 ATOM 21913 H2 SOL 2099 60.710 41.710 3.000 1.00 0.00 ATOM 21914 OH2 SOL 2100 24.430 22.800 20.550 1.00 0.00 ATOM 21915 H1 SOL 2100 25.270 23.230 20.380 1.00 0.00 ATOM 21916 H2 SOL 2100 24.400 22.060 19.950 1.00 0.00 ATOM 21917 OH2 SOL 2101 59.400 1.210 13.790 1.00 0.00 ATOM 21918 H1 SOL 2101 59.790 0.400 14.140 1.00 0.00 ATOM 21919 H2 SOL 2101 58.720 1.440 14.410 1.00 0.00 ATOM 21920 OH2 SOL 2102 44.310 27.580 78.330 1.00 0.00 ATOM 21921 H1 SOL 2102 45.080 27.300 77.840 1.00 0.00 ATOM 21922 H2 SOL 2102 43.970 28.320 77.830 1.00 0.00 ATOM 21923 OH2 SOL 2103 11.550 1.540 75.970 1.00 0.00 ATOM 21924 H1 SOL 2103 11.130 1.940 75.210 1.00 0.00 ATOM 21925 H2 SOL 2103 11.970 0.750 75.630 1.00 0.00 ATOM 21926 OH2 SOL 2104 13.000 0.010 20.820 1.00 0.00 ATOM 21927 H1 SOL 2104 13.240 -0.490 21.600 1.00 0.00 ATOM 21928 H2 SOL 2104 13.330 0.890 20.990 1.00 0.00 ATOM 21929 OH2 SOL 2105 35.020 50.580 12.960 1.00 0.00 ATOM 21930 H1 SOL 2105 34.340 50.970 13.510 1.00 0.00 ATOM 21931 H2 SOL 2105 35.250 51.260 12.330 1.00 0.00 ATOM 21932 OH2 SOL 2106 35.930 32.280 16.830 1.00 0.00 ATOM 21933 H1 SOL 2106 35.690 32.870 16.120 1.00 0.00 ATOM 21934 H2 SOL 2106 36.220 32.860 17.540 1.00 0.00 ATOM 21935 OH2 SOL 2107 0.420 32.750 78.790 1.00 0.00 ATOM 21936 H1 SOL 2107 0.870 33.370 78.220 1.00 0.00 ATOM 21937 H2 SOL 2107 -0.340 33.230 79.110 1.00 0.00 ATOM 21938 OH2 SOL 2108 57.550 51.680 67.990 1.00 0.00 ATOM 21939 H1 SOL 2108 57.560 52.150 68.830 1.00 0.00 ATOM 21940 H2 SOL 2108 57.890 52.310 67.360 1.00 0.00 ATOM 21941 OH2 SOL 2109 34.760 18.220 82.110 1.00 0.00 ATOM 21942 H1 SOL 2109 34.150 18.930 82.320 1.00 0.00 ATOM 21943 H2 SOL 2109 34.230 17.590 81.620 1.00 0.00 ATOM 21944 OH2 SOL 2110 33.900 57.920 68.080 1.00 0.00 ATOM 21945 H1 SOL 2110 33.800 58.100 67.140 1.00 0.00 ATOM 21946 H2 SOL 2110 34.020 56.970 68.130 1.00 0.00 ATOM 21947 OH2 SOL 2111 40.610 52.460 21.240 1.00 0.00 ATOM 21948 H1 SOL 2111 40.980 52.170 20.410 1.00 0.00 ATOM 21949 H2 SOL 2111 40.890 51.810 21.870 1.00 0.00 ATOM 21950 OH2 SOL 2112 43.430 4.670 12.140 1.00 0.00 ATOM 21951 H1 SOL 2112 43.230 5.540 12.500 1.00 0.00 ATOM 21952 H2 SOL 2112 43.610 4.820 11.220 1.00 0.00 ATOM 21953 OH2 SOL 2113 43.090 8.740 6.800 1.00 0.00 ATOM 21954 H1 SOL 2113 43.990 8.530 6.540 1.00 0.00 ATOM 21955 H2 SOL 2113 42.830 8.020 7.380 1.00 0.00 ATOM 21956 OH2 SOL 2114 52.490 7.480 77.350 1.00 0.00 ATOM 21957 H1 SOL 2114 53.300 7.400 77.850 1.00 0.00 ATOM 21958 H2 SOL 2114 51.880 6.890 77.780 1.00 0.00 ATOM 21959 OH2 SOL 2115 6.570 3.210 82.690 1.00 0.00 ATOM 21960 H1 SOL 2115 6.680 2.270 82.820 1.00 0.00 ATOM 21961 H2 SOL 2115 6.170 3.520 83.510 1.00 0.00 ATOM 21962 OH2 SOL 2116 40.120 9.320 6.110 1.00 0.00 ATOM 21963 H1 SOL 2116 41.010 9.130 6.410 1.00 0.00 ATOM 21964 H2 SOL 2116 39.550 8.970 6.800 1.00 0.00 ATOM 21965 OH2 SOL 2117 9.800 48.030 12.180 1.00 0.00 ATOM 21966 H1 SOL 2117 9.460 47.140 12.150 1.00 0.00 ATOM 21967 H2 SOL 2117 10.550 47.990 12.790 1.00 0.00 ATOM 21968 OH2 SOL 2118 37.330 24.140 2.060 1.00 0.00 ATOM 21969 H1 SOL 2118 37.050 25.050 1.970 1.00 0.00 ATOM 21970 H2 SOL 2118 38.280 24.200 2.190 1.00 0.00 ATOM 21971 OH2 SOL 2119 22.750 16.000 82.660 1.00 0.00 ATOM 21972 H1 SOL 2119 22.030 16.560 82.940 1.00 0.00 ATOM 21973 H2 SOL 2119 22.460 15.110 82.860 1.00 0.00 ATOM 21974 OH2 SOL 2120 25.860 1.160 13.920 1.00 0.00 ATOM 21975 H1 SOL 2120 26.650 1.510 14.330 1.00 0.00 ATOM 21976 H2 SOL 2120 25.730 1.720 13.150 1.00 0.00 ATOM 21977 OH2 SOL 2121 50.810 26.880 70.610 1.00 0.00 ATOM 21978 H1 SOL 2121 51.390 27.530 71.010 1.00 0.00 ATOM 21979 H2 SOL 2121 50.750 27.150 69.700 1.00 0.00 ATOM 21980 OH2 SOL 2122 33.070 17.080 11.390 1.00 0.00 ATOM 21981 H1 SOL 2122 33.810 16.500 11.590 1.00 0.00 ATOM 21982 H2 SOL 2122 32.550 17.080 12.200 1.00 0.00 ATOM 21983 OH2 SOL 2123 30.220 9.030 14.620 1.00 0.00 ATOM 21984 H1 SOL 2123 31.090 8.970 14.220 1.00 0.00 ATOM 21985 H2 SOL 2123 29.670 8.490 14.060 1.00 0.00 ATOM 21986 OH2 SOL 2124 47.090 1.000 1.520 1.00 0.00 ATOM 21987 H1 SOL 2124 46.630 1.800 1.760 1.00 0.00 ATOM 21988 H2 SOL 2124 46.390 0.350 1.430 1.00 0.00 ATOM 21989 OH2 SOL 2125 30.280 57.730 21.020 1.00 0.00 ATOM 21990 H1 SOL 2125 30.860 58.320 20.540 1.00 0.00 ATOM 21991 H2 SOL 2125 29.390 58.010 20.780 1.00 0.00 ATOM 21992 OH2 SOL 2126 25.540 3.250 20.150 1.00 0.00 ATOM 21993 H1 SOL 2126 25.040 3.200 19.340 1.00 0.00 ATOM 21994 H2 SOL 2126 25.160 2.560 20.700 1.00 0.00 ATOM 21995 OH2 SOL 2127 22.190 3.210 4.720 1.00 0.00 ATOM 21996 H1 SOL 2127 22.410 4.100 4.420 1.00 0.00 ATOM 21997 H2 SOL 2127 22.110 3.290 5.670 1.00 0.00 ATOM 21998 OH2 SOL 2128 57.240 38.290 10.920 1.00 0.00 ATOM 21999 H1 SOL 2128 58.170 38.150 10.750 1.00 0.00 ATOM 22000 H2 SOL 2128 57.090 37.890 11.770 1.00 0.00 ATOM 22001 OH2 SOL 2129 59.390 25.270 78.090 1.00 0.00 ATOM 22002 H1 SOL 2129 59.380 25.790 78.900 1.00 0.00 ATOM 22003 H2 SOL 2129 60.310 25.290 77.810 1.00 0.00 ATOM 22004 OH2 SOL 2130 15.860 5.690 18.810 1.00 0.00 ATOM 22005 H1 SOL 2130 15.150 6.100 18.310 1.00 0.00 ATOM 22006 H2 SOL 2130 15.450 5.470 19.650 1.00 0.00 ATOM 22007 OH2 SOL 2131 20.050 35.740 14.560 1.00 0.00 ATOM 22008 H1 SOL 2131 20.770 35.720 13.930 1.00 0.00 ATOM 22009 H2 SOL 2131 20.230 35.010 15.150 1.00 0.00 ATOM 22010 OH2 SOL 2132 31.610 19.620 12.160 1.00 0.00 ATOM 22011 H1 SOL 2132 31.100 18.810 12.060 1.00 0.00 ATOM 22012 H2 SOL 2132 31.700 19.730 13.110 1.00 0.00 ATOM 22013 OH2 SOL 2133 56.350 41.780 19.750 1.00 0.00 ATOM 22014 H1 SOL 2133 56.260 42.710 19.530 1.00 0.00 ATOM 22015 H2 SOL 2133 55.500 41.400 19.520 1.00 0.00 ATOM 22016 OH2 SOL 2134 20.670 43.340 78.490 1.00 0.00 ATOM 22017 H1 SOL 2134 20.640 43.620 77.580 1.00 0.00 ATOM 22018 H2 SOL 2134 20.640 44.160 78.990 1.00 0.00 ATOM 22019 OH2 SOL 2135 40.620 28.960 10.810 1.00 0.00 ATOM 22020 H1 SOL 2135 40.970 28.120 11.100 1.00 0.00 ATOM 22021 H2 SOL 2135 40.360 29.400 11.620 1.00 0.00 ATOM 22022 OH2 SOL 2136 42.790 41.840 77.090 1.00 0.00 ATOM 22023 H1 SOL 2136 42.440 41.200 76.470 1.00 0.00 ATOM 22024 H2 SOL 2136 43.710 41.910 76.870 1.00 0.00 ATOM 22025 OH2 SOL 2137 41.940 40.090 5.040 1.00 0.00 ATOM 22026 H1 SOL 2137 42.470 39.910 4.260 1.00 0.00 ATOM 22027 H2 SOL 2137 41.700 41.010 4.960 1.00 0.00 ATOM 22028 OH2 SOL 2138 38.800 42.320 80.330 1.00 0.00 ATOM 22029 H1 SOL 2138 38.660 41.500 80.800 1.00 0.00 ATOM 22030 H2 SOL 2138 39.370 42.080 79.600 1.00 0.00 ATOM 22031 OH2 SOL 2139 11.280 0.580 10.090 1.00 0.00 ATOM 22032 H1 SOL 2139 10.970 1.040 10.870 1.00 0.00 ATOM 22033 H2 SOL 2139 11.970 0.000 10.400 1.00 0.00 ATOM 22034 OH2 SOL 2140 50.700 49.950 7.770 1.00 0.00 ATOM 22035 H1 SOL 2140 49.820 50.320 7.660 1.00 0.00 ATOM 22036 H2 SOL 2140 50.610 49.030 7.530 1.00 0.00 ATOM 22037 OH2 SOL 2141 0.010 55.200 77.310 1.00 0.00 ATOM 22038 H1 SOL 2141 0.520 55.380 78.100 1.00 0.00 ATOM 22039 H2 SOL 2141 -0.490 56.000 77.160 1.00 0.00 ATOM 22040 OH2 SOL 2142 55.170 26.930 74.750 1.00 0.00 ATOM 22041 H1 SOL 2142 55.370 27.770 74.340 1.00 0.00 ATOM 22042 H2 SOL 2142 54.950 27.160 75.660 1.00 0.00 ATOM 22043 OH2 SOL 2143 60.920 50.180 2.710 1.00 0.00 ATOM 22044 H1 SOL 2143 60.490 51.000 2.940 1.00 0.00 ATOM 22045 H2 SOL 2143 60.420 49.510 3.180 1.00 0.00 ATOM 22046 OH2 SOL 2144 19.420 23.820 22.310 1.00 0.00 ATOM 22047 H1 SOL 2144 18.580 24.110 21.940 1.00 0.00 ATOM 22048 H2 SOL 2144 20.070 24.160 21.700 1.00 0.00 ATOM 22049 OH2 SOL 2145 16.930 16.200 10.560 1.00 0.00 ATOM 22050 H1 SOL 2145 17.260 16.270 9.660 1.00 0.00 ATOM 22051 H2 SOL 2145 16.710 17.100 10.810 1.00 0.00 ATOM 22052 OH2 SOL 2146 16.830 52.380 -0.080 1.00 0.00 ATOM 22053 H1 SOL 2146 16.730 51.990 0.790 1.00 0.00 ATOM 22054 H2 SOL 2146 15.930 52.510 -0.390 1.00 0.00 ATOM 22055 OH2 SOL 2147 48.870 13.920 64.820 1.00 0.00 ATOM 22056 H1 SOL 2147 48.310 14.700 64.910 1.00 0.00 ATOM 22057 H2 SOL 2147 48.260 13.190 64.890 1.00 0.00 ATOM 22058 OH2 SOL 2148 19.220 28.420 79.390 1.00 0.00 ATOM 22059 H1 SOL 2148 19.590 28.110 78.570 1.00 0.00 ATOM 22060 H2 SOL 2148 18.840 27.640 79.800 1.00 0.00 ATOM 22061 OH2 SOL 2149 41.680 58.420 0.550 1.00 0.00 ATOM 22062 H1 SOL 2149 41.380 57.760 -0.070 1.00 0.00 ATOM 22063 H2 SOL 2149 41.770 59.220 0.030 1.00 0.00 ATOM 22064 OH2 SOL 2150 40.350 12.060 25.910 1.00 0.00 ATOM 22065 H1 SOL 2150 41.010 11.550 25.440 1.00 0.00 ATOM 22066 H2 SOL 2150 40.510 11.870 26.830 1.00 0.00 ATOM 22067 OH2 SOL 2151 35.100 36.290 20.820 1.00 0.00 ATOM 22068 H1 SOL 2151 35.060 36.000 19.910 1.00 0.00 ATOM 22069 H2 SOL 2151 35.270 37.230 20.760 1.00 0.00 ATOM 22070 OH2 SOL 2152 38.780 23.390 73.850 1.00 0.00 ATOM 22071 H1 SOL 2152 38.100 23.070 74.460 1.00 0.00 ATOM 22072 H2 SOL 2152 38.700 22.810 73.100 1.00 0.00 ATOM 22073 OH2 SOL 2153 52.560 39.530 21.890 1.00 0.00 ATOM 22074 H1 SOL 2153 52.840 38.620 21.860 1.00 0.00 ATOM 22075 H2 SOL 2153 52.500 39.790 20.970 1.00 0.00 ATOM 22076 OH2 SOL 2154 58.760 35.720 0.850 1.00 0.00 ATOM 22077 H1 SOL 2154 58.930 36.650 0.990 1.00 0.00 ATOM 22078 H2 SOL 2154 58.470 35.390 1.700 1.00 0.00 ATOM 22079 OH2 SOL 2155 23.840 49.230 14.540 1.00 0.00 ATOM 22080 H1 SOL 2155 23.220 48.630 14.110 1.00 0.00 ATOM 22081 H2 SOL 2155 24.150 49.800 13.830 1.00 0.00 ATOM 22082 OH2 SOL 2156 52.930 31.680 72.490 1.00 0.00 ATOM 22083 H1 SOL 2156 52.230 31.880 71.860 1.00 0.00 ATOM 22084 H2 SOL 2156 53.400 32.500 72.600 1.00 0.00 ATOM 22085 OH2 SOL 2157 54.150 57.110 12.600 1.00 0.00 ATOM 22086 H1 SOL 2157 54.010 57.920 12.100 1.00 0.00 ATOM 22087 H2 SOL 2157 53.470 57.130 13.280 1.00 0.00 ATOM 22088 OH2 SOL 2158 9.130 7.400 13.520 1.00 0.00 ATOM 22089 H1 SOL 2158 9.660 6.610 13.540 1.00 0.00 ATOM 22090 H2 SOL 2158 8.590 7.360 14.300 1.00 0.00 ATOM 22091 OH2 SOL 2159 15.970 27.430 23.420 1.00 0.00 ATOM 22092 H1 SOL 2159 16.190 27.880 24.240 1.00 0.00 ATOM 22093 H2 SOL 2159 16.060 26.500 23.620 1.00 0.00 ATOM 22094 OH2 SOL 2160 52.070 2.100 15.070 1.00 0.00 ATOM 22095 H1 SOL 2160 51.880 2.630 15.840 1.00 0.00 ATOM 22096 H2 SOL 2160 51.890 2.690 14.330 1.00 0.00 ATOM 22097 OH2 SOL 2161 38.770 0.700 2.130 1.00 0.00 ATOM 22098 H1 SOL 2161 39.440 1.260 1.710 1.00 0.00 ATOM 22099 H2 SOL 2161 38.290 0.320 1.390 1.00 0.00 ATOM 22100 OH2 SOL 2162 42.830 32.500 11.850 1.00 0.00 ATOM 22101 H1 SOL 2162 42.940 31.620 11.480 1.00 0.00 ATOM 22102 H2 SOL 2162 41.920 32.730 11.670 1.00 0.00 ATOM 22103 OH2 SOL 2163 31.010 11.240 75.220 1.00 0.00 ATOM 22104 H1 SOL 2163 31.570 11.070 74.460 1.00 0.00 ATOM 22105 H2 SOL 2163 30.910 12.190 75.240 1.00 0.00 ATOM 22106 OH2 SOL 2164 8.160 11.220 2.950 1.00 0.00 ATOM 22107 H1 SOL 2164 7.470 10.760 2.460 1.00 0.00 ATOM 22108 H2 SOL 2164 7.980 11.010 3.870 1.00 0.00 ATOM 22109 OH2 SOL 2165 33.100 14.920 2.290 1.00 0.00 ATOM 22110 H1 SOL 2165 33.590 15.720 2.070 1.00 0.00 ATOM 22111 H2 SOL 2165 33.670 14.210 2.010 1.00 0.00 ATOM 22112 OH2 SOL 2166 18.310 1.370 71.260 1.00 0.00 ATOM 22113 H1 SOL 2166 17.560 1.600 70.710 1.00 0.00 ATOM 22114 H2 SOL 2166 18.520 0.470 71.010 1.00 0.00 ATOM 22115 OH2 SOL 2167 21.080 48.670 72.000 1.00 0.00 ATOM 22116 H1 SOL 2167 20.960 48.770 72.940 1.00 0.00 ATOM 22117 H2 SOL 2167 21.980 48.360 71.910 1.00 0.00 ATOM 22118 OH2 SOL 2168 12.990 11.980 66.610 1.00 0.00 ATOM 22119 H1 SOL 2168 12.930 11.140 67.060 1.00 0.00 ATOM 22120 H2 SOL 2168 13.160 12.620 67.300 1.00 0.00 ATOM 22121 OH2 SOL 2169 8.300 56.980 15.820 1.00 0.00 ATOM 22122 H1 SOL 2169 7.980 57.700 16.360 1.00 0.00 ATOM 22123 H2 SOL 2169 9.100 56.680 16.260 1.00 0.00 ATOM 22124 OH2 SOL 2170 39.600 52.740 81.460 1.00 0.00 ATOM 22125 H1 SOL 2170 38.710 52.530 81.190 1.00 0.00 ATOM 22126 H2 SOL 2170 39.840 53.500 80.930 1.00 0.00 ATOM 22127 OH2 SOL 2171 6.150 48.190 76.280 1.00 0.00 ATOM 22128 H1 SOL 2171 5.450 47.830 75.740 1.00 0.00 ATOM 22129 H2 SOL 2171 6.850 48.400 75.650 1.00 0.00 ATOM 22130 OH2 SOL 2172 16.510 26.930 77.470 1.00 0.00 ATOM 22131 H1 SOL 2172 17.200 27.590 77.420 1.00 0.00 ATOM 22132 H2 SOL 2172 15.770 27.310 77.000 1.00 0.00 ATOM 22133 OH2 SOL 2173 47.370 21.000 78.360 1.00 0.00 ATOM 22134 H1 SOL 2173 46.810 20.430 78.890 1.00 0.00 ATOM 22135 H2 SOL 2173 48.000 21.370 78.980 1.00 0.00 ATOM 22136 OH2 SOL 2174 20.580 37.710 83.560 1.00 0.00 ATOM 22137 H1 SOL 2174 21.360 37.470 83.050 1.00 0.00 ATOM 22138 H2 SOL 2174 19.990 38.110 82.920 1.00 0.00 ATOM 22139 OH2 SOL 2175 39.250 29.000 64.860 1.00 0.00 ATOM 22140 H1 SOL 2175 38.550 29.630 65.020 1.00 0.00 ATOM 22141 H2 SOL 2175 38.920 28.440 64.160 1.00 0.00 ATOM 22142 OH2 SOL 2176 43.860 10.650 77.750 1.00 0.00 ATOM 22143 H1 SOL 2176 44.540 10.940 77.140 1.00 0.00 ATOM 22144 H2 SOL 2176 43.050 11.040 77.410 1.00 0.00 ATOM 22145 OH2 SOL 2177 6.330 16.780 15.080 1.00 0.00 ATOM 22146 H1 SOL 2177 7.100 16.300 15.390 1.00 0.00 ATOM 22147 H2 SOL 2177 6.680 17.430 14.470 1.00 0.00 ATOM 22148 OH2 SOL 2178 14.130 54.050 5.970 1.00 0.00 ATOM 22149 H1 SOL 2178 13.490 54.160 5.270 1.00 0.00 ATOM 22150 H2 SOL 2178 14.080 53.120 6.200 1.00 0.00 ATOM 22151 OH2 SOL 2179 54.870 53.620 12.740 1.00 0.00 ATOM 22152 H1 SOL 2179 55.560 54.280 12.860 1.00 0.00 ATOM 22153 H2 SOL 2179 54.320 53.980 12.050 1.00 0.00 ATOM 22154 OH2 SOL 2180 22.590 41.860 75.090 1.00 0.00 ATOM 22155 H1 SOL 2180 23.170 42.570 74.840 1.00 0.00 ATOM 22156 H2 SOL 2180 21.760 42.280 75.310 1.00 0.00 ATOM 22157 OH2 SOL 2181 27.180 23.640 69.040 1.00 0.00 ATOM 22158 H1 SOL 2181 27.910 24.270 68.980 1.00 0.00 ATOM 22159 H2 SOL 2181 27.510 22.850 68.620 1.00 0.00 ATOM 22160 OH2 SOL 2182 27.620 28.960 3.940 1.00 0.00 ATOM 22161 H1 SOL 2182 27.030 29.160 3.210 1.00 0.00 ATOM 22162 H2 SOL 2182 27.250 28.160 4.330 1.00 0.00 ATOM 22163 OH2 SOL 2183 38.770 2.890 17.930 1.00 0.00 ATOM 22164 H1 SOL 2183 39.580 2.980 17.430 1.00 0.00 ATOM 22165 H2 SOL 2183 38.080 3.030 17.280 1.00 0.00 ATOM 22166 OH2 SOL 2184 39.310 22.880 83.760 1.00 0.00 ATOM 22167 H1 SOL 2184 38.760 22.990 84.530 1.00 0.00 ATOM 22168 H2 SOL 2184 39.370 23.770 83.390 1.00 0.00 ATOM 22169 OH2 SOL 2185 21.600 14.680 14.630 1.00 0.00 ATOM 22170 H1 SOL 2185 22.520 14.920 14.740 1.00 0.00 ATOM 22171 H2 SOL 2185 21.570 14.170 13.820 1.00 0.00 ATOM 22172 OH2 SOL 2186 47.970 27.710 66.940 1.00 0.00 ATOM 22173 H1 SOL 2186 47.320 27.750 67.650 1.00 0.00 ATOM 22174 H2 SOL 2186 47.530 27.230 66.240 1.00 0.00 ATOM 22175 OH2 SOL 2187 0.430 40.080 0.260 1.00 0.00 ATOM 22176 H1 SOL 2187 -0.120 40.770 -0.110 1.00 0.00 ATOM 22177 H2 SOL 2187 1.090 40.540 0.780 1.00 0.00 ATOM 22178 OH2 SOL 2188 43.270 9.580 3.500 1.00 0.00 ATOM 22179 H1 SOL 2188 42.420 9.430 3.940 1.00 0.00 ATOM 22180 H2 SOL 2188 43.500 10.480 3.730 1.00 0.00 ATOM 22181 OH2 SOL 2189 53.390 55.670 6.200 1.00 0.00 ATOM 22182 H1 SOL 2189 53.960 55.520 5.450 1.00 0.00 ATOM 22183 H2 SOL 2189 53.930 56.140 6.830 1.00 0.00 ATOM 22184 OH2 SOL 2190 19.670 35.570 80.870 1.00 0.00 ATOM 22185 H1 SOL 2190 18.730 35.580 81.080 1.00 0.00 ATOM 22186 H2 SOL 2190 19.690 35.580 79.910 1.00 0.00 ATOM 22187 OH2 SOL 2191 24.770 21.550 71.990 1.00 0.00 ATOM 22188 H1 SOL 2191 25.710 21.480 72.190 1.00 0.00 ATOM 22189 H2 SOL 2191 24.360 20.860 72.500 1.00 0.00 ATOM 22190 OH2 SOL 2192 3.420 23.000 20.240 1.00 0.00 ATOM 22191 H1 SOL 2192 3.240 22.660 21.120 1.00 0.00 ATOM 22192 H2 SOL 2192 4.370 22.900 20.140 1.00 0.00 ATOM 22193 OH2 SOL 2193 6.820 0.420 83.490 1.00 0.00 ATOM 22194 H1 SOL 2193 6.800 0.350 84.440 1.00 0.00 ATOM 22195 H2 SOL 2193 6.090 -0.120 83.190 1.00 0.00 ATOM 22196 OH2 SOL 2194 9.380 57.780 6.060 1.00 0.00 ATOM 22197 H1 SOL 2194 10.210 58.070 5.660 1.00 0.00 ATOM 22198 H2 SOL 2194 9.580 57.710 6.990 1.00 0.00 ATOM 22199 OH2 SOL 2195 55.290 26.020 68.450 1.00 0.00 ATOM 22200 H1 SOL 2195 54.590 25.600 67.950 1.00 0.00 ATOM 22201 H2 SOL 2195 56.010 26.110 67.830 1.00 0.00 ATOM 22202 OH2 SOL 2196 7.220 27.820 75.330 1.00 0.00 ATOM 22203 H1 SOL 2196 6.710 28.640 75.300 1.00 0.00 ATOM 22204 H2 SOL 2196 6.750 27.280 75.960 1.00 0.00 ATOM 22205 OH2 SOL 2197 29.280 50.370 73.680 1.00 0.00 ATOM 22206 H1 SOL 2197 29.500 49.510 74.050 1.00 0.00 ATOM 22207 H2 SOL 2197 28.400 50.260 73.330 1.00 0.00 ATOM 22208 OH2 SOL 2198 38.180 10.560 1.620 1.00 0.00 ATOM 22209 H1 SOL 2198 39.060 10.170 1.620 1.00 0.00 ATOM 22210 H2 SOL 2198 37.930 10.570 2.550 1.00 0.00 ATOM 22211 OH2 SOL 2199 3.270 33.360 73.110 1.00 0.00 ATOM 22212 H1 SOL 2199 2.710 32.880 73.710 1.00 0.00 ATOM 22213 H2 SOL 2199 3.800 33.930 73.670 1.00 0.00 ATOM 22214 OH2 SOL 2200 49.980 48.020 19.960 1.00 0.00 ATOM 22215 H1 SOL 2200 50.860 47.670 20.050 1.00 0.00 ATOM 22216 H2 SOL 2200 49.430 47.400 20.450 1.00 0.00 ATOM 22217 OH2 SOL 2201 35.220 55.200 71.300 1.00 0.00 ATOM 22218 H1 SOL 2201 34.370 55.440 71.660 1.00 0.00 ATOM 22219 H2 SOL 2201 35.840 55.390 72.010 1.00 0.00 ATOM 22220 OH2 SOL 2202 39.110 45.120 7.050 1.00 0.00 ATOM 22221 H1 SOL 2202 39.340 45.970 6.680 1.00 0.00 ATOM 22222 H2 SOL 2202 39.930 44.800 7.420 1.00 0.00 ATOM 22223 OH2 SOL 2203 34.150 36.830 13.340 1.00 0.00 ATOM 22224 H1 SOL 2203 33.830 37.680 13.660 1.00 0.00 ATOM 22225 H2 SOL 2203 33.690 36.700 12.520 1.00 0.00 ATOM 22226 OH2 SOL 2204 53.620 10.820 15.800 1.00 0.00 ATOM 22227 H1 SOL 2204 52.980 11.510 15.630 1.00 0.00 ATOM 22228 H2 SOL 2204 53.330 10.420 16.610 1.00 0.00 ATOM 22229 OH2 SOL 2205 24.630 23.840 13.410 1.00 0.00 ATOM 22230 H1 SOL 2205 23.820 23.580 13.840 1.00 0.00 ATOM 22231 H2 SOL 2205 25.240 24.040 14.120 1.00 0.00 ATOM 22232 OH2 SOL 2206 25.800 40.200 71.890 1.00 0.00 ATOM 22233 H1 SOL 2206 25.340 40.920 71.470 1.00 0.00 ATOM 22234 H2 SOL 2206 25.400 40.130 72.760 1.00 0.00 ATOM 22235 OH2 SOL 2207 51.950 47.350 3.000 1.00 0.00 ATOM 22236 H1 SOL 2207 52.630 46.970 2.440 1.00 0.00 ATOM 22237 H2 SOL 2207 51.610 48.090 2.500 1.00 0.00 ATOM 22238 OH2 SOL 2208 38.530 54.160 77.480 1.00 0.00 ATOM 22239 H1 SOL 2208 37.980 53.610 78.040 1.00 0.00 ATOM 22240 H2 SOL 2208 38.070 54.990 77.430 1.00 0.00 ATOM 22241 OH2 SOL 2209 10.500 47.050 63.270 1.00 0.00 ATOM 22242 H1 SOL 2209 9.950 47.760 62.950 1.00 0.00 ATOM 22243 H2 SOL 2209 11.250 47.490 63.670 1.00 0.00 ATOM 22244 OH2 SOL 2210 53.580 51.840 71.680 1.00 0.00 ATOM 22245 H1 SOL 2210 53.230 51.470 72.500 1.00 0.00 ATOM 22246 H2 SOL 2210 54.470 51.490 71.620 1.00 0.00 ATOM 22247 OH2 SOL 2211 50.690 6.950 3.710 1.00 0.00 ATOM 22248 H1 SOL 2211 51.150 7.740 3.990 1.00 0.00 ATOM 22249 H2 SOL 2211 51.390 6.310 3.560 1.00 0.00 ATOM 22250 OH2 SOL 2212 23.810 14.370 19.750 1.00 0.00 ATOM 22251 H1 SOL 2212 24.280 14.840 20.440 1.00 0.00 ATOM 22252 H2 SOL 2212 24.350 13.590 19.590 1.00 0.00 ATOM 22253 OH2 SOL 2213 52.810 58.010 21.600 1.00 0.00 ATOM 22254 H1 SOL 2213 53.190 58.850 21.340 1.00 0.00 ATOM 22255 H2 SOL 2213 52.030 58.240 22.100 1.00 0.00 ATOM 22256 OH2 SOL 2214 46.400 48.490 13.900 1.00 0.00 ATOM 22257 H1 SOL 2214 45.700 47.830 13.830 1.00 0.00 ATOM 22258 H2 SOL 2214 47.120 48.110 13.400 1.00 0.00 ATOM 22259 OH2 SOL 2215 51.560 27.530 6.000 1.00 0.00 ATOM 22260 H1 SOL 2215 52.150 26.780 6.090 1.00 0.00 ATOM 22261 H2 SOL 2215 51.930 28.020 5.260 1.00 0.00 ATOM 22262 OH2 SOL 2216 57.150 31.660 63.300 1.00 0.00 ATOM 22263 H1 SOL 2216 57.840 31.050 63.020 1.00 0.00 ATOM 22264 H2 SOL 2216 57.240 32.410 62.710 1.00 0.00 ATOM 22265 OH2 SOL 2217 17.730 7.360 65.370 1.00 0.00 ATOM 22266 H1 SOL 2217 17.700 7.120 66.290 1.00 0.00 ATOM 22267 H2 SOL 2217 18.450 7.990 65.300 1.00 0.00 ATOM 22268 OH2 SOL 2218 13.540 39.080 76.740 1.00 0.00 ATOM 22269 H1 SOL 2218 13.280 39.970 76.960 1.00 0.00 ATOM 22270 H2 SOL 2218 13.570 38.620 77.580 1.00 0.00 ATOM 22271 OH2 SOL 2219 24.580 0.140 80.160 1.00 0.00 ATOM 22272 H1 SOL 2219 24.340 0.670 80.930 1.00 0.00 ATOM 22273 H2 SOL 2219 24.040 -0.650 80.240 1.00 0.00 ATOM 22274 OH2 SOL 2220 53.560 44.550 74.840 1.00 0.00 ATOM 22275 H1 SOL 2220 53.300 45.380 75.250 1.00 0.00 ATOM 22276 H2 SOL 2220 52.890 43.930 75.110 1.00 0.00 ATOM 22277 OH2 SOL 2221 56.530 57.370 60.200 1.00 0.00 ATOM 22278 H1 SOL 2221 56.990 57.270 59.370 1.00 0.00 ATOM 22279 H2 SOL 2221 56.340 58.300 60.270 1.00 0.00 ATOM 22280 OH2 SOL 2222 35.740 12.130 76.600 1.00 0.00 ATOM 22281 H1 SOL 2222 35.900 11.190 76.620 1.00 0.00 ATOM 22282 H2 SOL 2222 35.060 12.280 77.260 1.00 0.00 ATOM 22283 OH2 SOL 2223 40.950 55.150 5.520 1.00 0.00 ATOM 22284 H1 SOL 2223 41.290 54.460 6.080 1.00 0.00 ATOM 22285 H2 SOL 2223 41.110 55.960 6.010 1.00 0.00 ATOM 22286 OH2 SOL 2224 14.650 14.470 11.300 1.00 0.00 ATOM 22287 H1 SOL 2224 15.500 14.890 11.230 1.00 0.00 ATOM 22288 H2 SOL 2224 14.830 13.610 11.680 1.00 0.00 ATOM 22289 OH2 SOL 2225 13.080 37.170 70.970 1.00 0.00 ATOM 22290 H1 SOL 2225 13.140 36.850 70.070 1.00 0.00 ATOM 22291 H2 SOL 2225 12.460 36.590 71.400 1.00 0.00 ATOM 22292 OH2 SOL 2226 40.240 2.950 79.080 1.00 0.00 ATOM 22293 H1 SOL 2226 40.890 3.640 79.020 1.00 0.00 ATOM 22294 H2 SOL 2226 39.870 3.050 79.960 1.00 0.00 ATOM 22295 OH2 SOL 2227 51.460 55.200 78.660 1.00 0.00 ATOM 22296 H1 SOL 2227 50.730 55.210 78.030 1.00 0.00 ATOM 22297 H2 SOL 2227 52.040 55.900 78.350 1.00 0.00 ATOM 22298 OH2 SOL 2228 4.840 12.010 73.800 1.00 0.00 ATOM 22299 H1 SOL 2228 3.950 12.310 73.640 1.00 0.00 ATOM 22300 H2 SOL 2228 5.030 11.410 73.090 1.00 0.00 ATOM 22301 OH2 SOL 2229 32.790 36.270 11.000 1.00 0.00 ATOM 22302 H1 SOL 2229 31.980 36.210 10.480 1.00 0.00 ATOM 22303 H2 SOL 2229 33.410 36.710 10.420 1.00 0.00 ATOM 22304 OH2 SOL 2230 17.820 7.010 13.740 1.00 0.00 ATOM 22305 H1 SOL 2230 17.640 6.080 13.880 1.00 0.00 ATOM 22306 H2 SOL 2230 18.660 7.020 13.280 1.00 0.00 ATOM 22307 OH2 SOL 2231 17.610 25.230 12.380 1.00 0.00 ATOM 22308 H1 SOL 2231 17.700 24.370 12.800 1.00 0.00 ATOM 22309 H2 SOL 2231 16.850 25.130 11.800 1.00 0.00 ATOM 22310 OH2 SOL 2232 22.840 7.680 21.800 1.00 0.00 ATOM 22311 H1 SOL 2232 23.250 6.840 21.990 1.00 0.00 ATOM 22312 H2 SOL 2232 23.490 8.170 21.300 1.00 0.00 ATOM 22313 OH2 SOL 2233 47.950 3.060 63.010 1.00 0.00 ATOM 22314 H1 SOL 2233 48.350 2.370 62.480 1.00 0.00 ATOM 22315 H2 SOL 2233 47.010 2.960 62.870 1.00 0.00 ATOM 22316 OH2 SOL 2234 31.080 30.370 72.450 1.00 0.00 ATOM 22317 H1 SOL 2234 30.920 30.890 73.240 1.00 0.00 ATOM 22318 H2 SOL 2234 30.240 30.350 72.000 1.00 0.00 ATOM 22319 OH2 SOL 2235 20.840 29.600 65.460 1.00 0.00 ATOM 22320 H1 SOL 2235 20.630 29.380 64.560 1.00 0.00 ATOM 22321 H2 SOL 2235 21.490 28.950 65.720 1.00 0.00 ATOM 22322 OH2 SOL 2236 14.480 49.900 67.160 1.00 0.00 ATOM 22323 H1 SOL 2236 15.250 49.420 66.860 1.00 0.00 ATOM 22324 H2 SOL 2236 14.240 50.460 66.430 1.00 0.00 ATOM 22325 OH2 SOL 2237 35.340 58.180 12.310 1.00 0.00 ATOM 22326 H1 SOL 2237 35.980 57.880 12.950 1.00 0.00 ATOM 22327 H2 SOL 2237 35.600 57.750 11.490 1.00 0.00 ATOM 22328 OH2 SOL 2238 2.430 18.820 70.190 1.00 0.00 ATOM 22329 H1 SOL 2238 1.610 19.010 69.740 1.00 0.00 ATOM 22330 H2 SOL 2238 2.280 17.990 70.640 1.00 0.00 ATOM 22331 OH2 SOL 2239 3.160 13.500 13.350 1.00 0.00 ATOM 22332 H1 SOL 2239 2.530 13.810 14.000 1.00 0.00 ATOM 22333 H2 SOL 2239 3.590 12.750 13.750 1.00 0.00 ATOM 22334 OH2 SOL 2240 36.700 12.040 19.360 1.00 0.00 ATOM 22335 H1 SOL 2240 36.950 12.940 19.590 1.00 0.00 ATOM 22336 H2 SOL 2240 37.450 11.510 19.620 1.00 0.00 ATOM 22337 OH2 SOL 2241 34.670 4.000 5.390 1.00 0.00 ATOM 22338 H1 SOL 2241 33.950 4.140 6.000 1.00 0.00 ATOM 22339 H2 SOL 2241 34.270 3.600 4.620 1.00 0.00 ATOM 22340 OH2 SOL 2242 46.590 21.910 12.920 1.00 0.00 ATOM 22341 H1 SOL 2242 46.390 20.970 12.880 1.00 0.00 ATOM 22342 H2 SOL 2242 47.080 22.080 12.120 1.00 0.00 ATOM 22343 OH2 SOL 2243 56.520 3.810 76.210 1.00 0.00 ATOM 22344 H1 SOL 2243 57.130 4.290 76.770 1.00 0.00 ATOM 22345 H2 SOL 2243 55.650 4.040 76.540 1.00 0.00 ATOM 22346 OH2 SOL 2244 30.390 35.960 2.920 1.00 0.00 ATOM 22347 H1 SOL 2244 30.870 35.960 3.750 1.00 0.00 ATOM 22348 H2 SOL 2244 31.070 35.910 2.250 1.00 0.00 ATOM 22349 OH2 SOL 2245 56.700 10.480 4.040 1.00 0.00 ATOM 22350 H1 SOL 2245 57.010 9.970 4.790 1.00 0.00 ATOM 22351 H2 SOL 2245 57.020 10.000 3.270 1.00 0.00 ATOM 22352 OH2 SOL 2246 24.350 32.940 81.520 1.00 0.00 ATOM 22353 H1 SOL 2246 25.190 33.330 81.280 1.00 0.00 ATOM 22354 H2 SOL 2246 23.740 33.670 81.530 1.00 0.00 ATOM 22355 OH2 SOL 2247 16.480 46.820 17.910 1.00 0.00 ATOM 22356 H1 SOL 2247 16.040 46.960 18.740 1.00 0.00 ATOM 22357 H2 SOL 2247 15.970 47.330 17.280 1.00 0.00 ATOM 22358 OH2 SOL 2248 31.950 18.140 61.510 1.00 0.00 ATOM 22359 H1 SOL 2248 31.080 18.540 61.510 1.00 0.00 ATOM 22360 H2 SOL 2248 31.790 17.220 61.720 1.00 0.00 ATOM 22361 OH2 SOL 2249 10.100 27.150 7.920 1.00 0.00 ATOM 22362 H1 SOL 2249 9.240 26.970 8.310 1.00 0.00 ATOM 22363 H2 SOL 2249 9.990 27.990 7.470 1.00 0.00 ATOM 22364 OH2 SOL 2250 23.560 35.170 69.900 1.00 0.00 ATOM 22365 H1 SOL 2250 24.170 34.450 69.820 1.00 0.00 ATOM 22366 H2 SOL 2250 23.930 35.870 69.360 1.00 0.00 ATOM 22367 OH2 SOL 2251 23.380 48.380 78.960 1.00 0.00 ATOM 22368 H1 SOL 2251 24.040 48.250 79.640 1.00 0.00 ATOM 22369 H2 SOL 2251 23.840 48.220 78.140 1.00 0.00 ATOM 22370 OH2 SOL 2252 33.650 51.050 19.160 1.00 0.00 ATOM 22371 H1 SOL 2252 32.790 51.080 19.590 1.00 0.00 ATOM 22372 H2 SOL 2252 33.670 51.840 18.620 1.00 0.00 ATOM 22373 OH2 SOL 2253 12.820 14.430 4.970 1.00 0.00 ATOM 22374 H1 SOL 2253 13.250 14.610 5.810 1.00 0.00 ATOM 22375 H2 SOL 2253 13.370 14.870 4.330 1.00 0.00 ATOM 22376 OH2 SOL 2254 32.450 56.100 61.490 1.00 0.00 ATOM 22377 H1 SOL 2254 33.020 56.620 62.050 1.00 0.00 ATOM 22378 H2 SOL 2254 31.860 56.750 61.090 1.00 0.00 ATOM 22379 OH2 SOL 2255 3.910 26.450 23.370 1.00 0.00 ATOM 22380 H1 SOL 2255 4.220 27.020 22.660 1.00 0.00 ATOM 22381 H2 SOL 2255 4.260 26.850 24.170 1.00 0.00 ATOM 22382 OH2 SOL 2256 59.680 30.210 18.340 1.00 0.00 ATOM 22383 H1 SOL 2256 58.860 30.350 18.820 1.00 0.00 ATOM 22384 H2 SOL 2256 60.220 29.690 18.930 1.00 0.00 ATOM 22385 OH2 SOL 2257 12.610 14.920 18.300 1.00 0.00 ATOM 22386 H1 SOL 2257 12.200 14.850 19.160 1.00 0.00 ATOM 22387 H2 SOL 2257 11.910 14.700 17.680 1.00 0.00 ATOM 22388 OH2 SOL 2258 36.180 15.940 0.300 1.00 0.00 ATOM 22389 H1 SOL 2258 36.850 15.480 0.800 1.00 0.00 ATOM 22390 H2 SOL 2258 36.100 15.450 -0.520 1.00 0.00 ATOM 22391 OH2 SOL 2259 17.080 44.500 7.060 1.00 0.00 ATOM 22392 H1 SOL 2259 17.940 44.700 7.440 1.00 0.00 ATOM 22393 H2 SOL 2259 16.870 43.630 7.380 1.00 0.00 ATOM 22394 OH2 SOL 2260 35.680 24.170 80.870 1.00 0.00 ATOM 22395 H1 SOL 2260 36.040 24.950 81.290 1.00 0.00 ATOM 22396 H2 SOL 2260 36.430 23.760 80.440 1.00 0.00 ATOM 22397 OH2 SOL 2261 49.860 50.030 75.800 1.00 0.00 ATOM 22398 H1 SOL 2261 49.480 50.530 76.510 1.00 0.00 ATOM 22399 H2 SOL 2261 50.010 50.670 75.100 1.00 0.00 ATOM 22400 OH2 SOL 2262 12.820 46.000 81.610 1.00 0.00 ATOM 22401 H1 SOL 2262 12.500 45.300 81.030 1.00 0.00 ATOM 22402 H2 SOL 2262 13.400 45.560 82.220 1.00 0.00 ATOM 22403 OH2 SOL 2263 58.070 36.120 6.490 1.00 0.00 ATOM 22404 H1 SOL 2263 58.710 35.870 5.810 1.00 0.00 ATOM 22405 H2 SOL 2263 58.070 35.380 7.100 1.00 0.00 ATOM 22406 OH2 SOL 2264 40.890 5.790 68.410 1.00 0.00 ATOM 22407 H1 SOL 2264 40.550 6.200 69.200 1.00 0.00 ATOM 22408 H2 SOL 2264 40.590 4.880 68.460 1.00 0.00 ATOM 22409 OH2 SOL 2265 45.070 47.480 10.780 1.00 0.00 ATOM 22410 H1 SOL 2265 44.870 46.770 11.390 1.00 0.00 ATOM 22411 H2 SOL 2265 44.510 48.210 11.050 1.00 0.00 ATOM 22412 OH2 SOL 2266 34.610 25.770 0.860 1.00 0.00 ATOM 22413 H1 SOL 2266 34.180 26.080 0.070 1.00 0.00 ATOM 22414 H2 SOL 2266 34.320 26.370 1.540 1.00 0.00 ATOM 22415 OH2 SOL 2267 13.770 46.980 73.660 1.00 0.00 ATOM 22416 H1 SOL 2267 14.550 46.610 73.250 1.00 0.00 ATOM 22417 H2 SOL 2267 13.300 46.220 74.010 1.00 0.00 ATOM 22418 OH2 SOL 2268 57.400 24.660 70.090 1.00 0.00 ATOM 22419 H1 SOL 2268 56.920 23.930 70.500 1.00 0.00 ATOM 22420 H2 SOL 2268 56.720 25.160 69.640 1.00 0.00 ATOM 22421 OH2 SOL 2269 54.580 20.120 18.940 1.00 0.00 ATOM 22422 H1 SOL 2269 53.900 19.590 18.520 1.00 0.00 ATOM 22423 H2 SOL 2269 55.200 19.470 19.280 1.00 0.00 ATOM 22424 OH2 SOL 2270 21.210 58.060 13.060 1.00 0.00 ATOM 22425 H1 SOL 2270 22.110 58.380 12.960 1.00 0.00 ATOM 22426 H2 SOL 2270 21.090 57.450 12.340 1.00 0.00 ATOM 22427 OH2 SOL 2271 53.990 32.270 79.940 1.00 0.00 ATOM 22428 H1 SOL 2271 54.510 32.600 79.210 1.00 0.00 ATOM 22429 H2 SOL 2271 53.180 31.970 79.550 1.00 0.00 ATOM 22430 OH2 SOL 2272 8.970 44.740 16.060 1.00 0.00 ATOM 22431 H1 SOL 2272 8.990 45.310 16.830 1.00 0.00 ATOM 22432 H2 SOL 2272 9.800 44.270 16.080 1.00 0.00 ATOM 22433 OH2 SOL 2273 41.060 17.930 71.270 1.00 0.00 ATOM 22434 H1 SOL 2273 41.230 17.980 72.210 1.00 0.00 ATOM 22435 H2 SOL 2273 41.760 18.460 70.870 1.00 0.00 ATOM 22436 OH2 SOL 2274 20.240 36.180 19.510 1.00 0.00 ATOM 22437 H1 SOL 2274 19.940 35.270 19.470 1.00 0.00 ATOM 22438 H2 SOL 2274 20.990 36.220 18.910 1.00 0.00 ATOM 22439 OH2 SOL 2275 24.030 3.980 83.590 1.00 0.00 ATOM 22440 H1 SOL 2275 23.270 4.360 83.170 1.00 0.00 ATOM 22441 H2 SOL 2275 23.840 3.050 83.650 1.00 0.00 ATOM 22442 OH2 SOL 2276 27.820 53.800 5.520 1.00 0.00 ATOM 22443 H1 SOL 2276 26.970 53.600 5.140 1.00 0.00 ATOM 22444 H2 SOL 2276 28.420 53.160 5.140 1.00 0.00 ATOM 22445 OH2 SOL 2277 17.500 31.620 77.390 1.00 0.00 ATOM 22446 H1 SOL 2277 18.150 31.560 78.090 1.00 0.00 ATOM 22447 H2 SOL 2277 17.540 32.530 77.090 1.00 0.00 ATOM 22448 OH2 SOL 2278 41.160 43.850 77.890 1.00 0.00 ATOM 22449 H1 SOL 2278 41.610 44.650 77.600 1.00 0.00 ATOM 22450 H2 SOL 2278 41.640 43.140 77.490 1.00 0.00 ATOM 22451 OH2 SOL 2279 24.740 24.290 71.830 1.00 0.00 ATOM 22452 H1 SOL 2279 24.640 23.340 71.900 1.00 0.00 ATOM 22453 H2 SOL 2279 25.680 24.430 71.940 1.00 0.00 ATOM 22454 OH2 SOL 2280 30.120 29.810 3.900 1.00 0.00 ATOM 22455 H1 SOL 2280 29.210 29.530 3.810 1.00 0.00 ATOM 22456 H2 SOL 2280 30.550 29.100 4.380 1.00 0.00 ATOM 22457 OH2 SOL 2281 26.180 45.250 24.280 1.00 0.00 ATOM 22458 H1 SOL 2281 26.190 46.180 24.520 1.00 0.00 ATOM 22459 H2 SOL 2281 26.170 44.790 25.120 1.00 0.00 ATOM 22460 OH2 SOL 2282 13.750 48.810 69.770 1.00 0.00 ATOM 22461 H1 SOL 2282 13.090 49.290 70.260 1.00 0.00 ATOM 22462 H2 SOL 2282 13.840 49.290 68.950 1.00 0.00 ATOM 22463 OH2 SOL 2283 18.690 35.990 1.270 1.00 0.00 ATOM 22464 H1 SOL 2283 19.590 35.660 1.250 1.00 0.00 ATOM 22465 H2 SOL 2283 18.780 36.930 1.440 1.00 0.00 ATOM 22466 OH2 SOL 2284 42.410 50.060 72.800 1.00 0.00 ATOM 22467 H1 SOL 2284 41.490 50.000 73.060 1.00 0.00 ATOM 22468 H2 SOL 2284 42.560 49.290 72.250 1.00 0.00 ATOM 22469 OH2 SOL 2285 17.640 44.510 77.490 1.00 0.00 ATOM 22470 H1 SOL 2285 16.690 44.480 77.620 1.00 0.00 ATOM 22471 H2 SOL 2285 17.990 44.710 78.360 1.00 0.00 ATOM 22472 OH2 SOL 2286 36.010 31.770 74.390 1.00 0.00 ATOM 22473 H1 SOL 2286 36.950 31.700 74.550 1.00 0.00 ATOM 22474 H2 SOL 2286 35.740 32.560 74.860 1.00 0.00 ATOM 22475 OH2 SOL 2287 13.220 1.570 24.860 1.00 0.00 ATOM 22476 H1 SOL 2287 13.380 2.440 24.500 1.00 0.00 ATOM 22477 H2 SOL 2287 12.500 1.230 24.330 1.00 0.00 ATOM 22478 OH2 SOL 2288 16.770 16.140 15.870 1.00 0.00 ATOM 22479 H1 SOL 2288 16.780 15.350 16.420 1.00 0.00 ATOM 22480 H2 SOL 2288 17.040 15.820 15.000 1.00 0.00 ATOM 22481 OH2 SOL 2289 25.930 15.310 77.770 1.00 0.00 ATOM 22482 H1 SOL 2289 25.190 15.380 77.160 1.00 0.00 ATOM 22483 H2 SOL 2289 26.470 16.080 77.590 1.00 0.00 ATOM 22484 OH2 SOL 2290 45.840 1.120 64.730 1.00 0.00 ATOM 22485 H1 SOL 2290 45.060 1.190 65.290 1.00 0.00 ATOM 22486 H2 SOL 2290 45.570 1.520 63.900 1.00 0.00 ATOM 22487 OH2 SOL 2291 44.590 20.370 72.150 1.00 0.00 ATOM 22488 H1 SOL 2291 44.680 21.320 72.180 1.00 0.00 ATOM 22489 H2 SOL 2291 44.280 20.180 71.260 1.00 0.00 ATOM 22490 OH2 SOL 2292 0.330 20.430 8.420 1.00 0.00 ATOM 22491 H1 SOL 2292 0.510 19.600 7.970 1.00 0.00 ATOM 22492 H2 SOL 2292 -0.190 20.930 7.790 1.00 0.00 ATOM 22493 OH2 SOL 2293 8.180 0.350 23.060 1.00 0.00 ATOM 22494 H1 SOL 2293 7.960 0.970 23.760 1.00 0.00 ATOM 22495 H2 SOL 2293 7.340 0.100 22.680 1.00 0.00 ATOM 22496 OH2 SOL 2294 17.600 41.470 71.010 1.00 0.00 ATOM 22497 H1 SOL 2294 17.630 40.570 70.700 1.00 0.00 ATOM 22498 H2 SOL 2294 17.140 41.430 71.850 1.00 0.00 ATOM 22499 OH2 SOL 2295 18.990 54.410 6.590 1.00 0.00 ATOM 22500 H1 SOL 2295 18.750 53.600 6.150 1.00 0.00 ATOM 22501 H2 SOL 2295 19.230 55.000 5.870 1.00 0.00 ATOM 22502 OH2 SOL 2296 40.880 25.650 63.910 1.00 0.00 ATOM 22503 H1 SOL 2296 39.980 25.700 64.230 1.00 0.00 ATOM 22504 H2 SOL 2296 40.950 26.370 63.280 1.00 0.00 ATOM 22505 OH2 SOL 2297 22.690 16.200 18.020 1.00 0.00 ATOM 22506 H1 SOL 2297 23.090 15.580 18.630 1.00 0.00 ATOM 22507 H2 SOL 2297 22.470 16.960 18.550 1.00 0.00 ATOM 22508 OH2 SOL 2298 21.040 22.350 11.850 1.00 0.00 ATOM 22509 H1 SOL 2298 21.390 21.500 12.110 1.00 0.00 ATOM 22510 H2 SOL 2298 21.820 22.870 11.640 1.00 0.00 ATOM 22511 OH2 SOL 2299 30.770 56.020 80.770 1.00 0.00 ATOM 22512 H1 SOL 2299 31.300 55.230 80.740 1.00 0.00 ATOM 22513 H2 SOL 2299 31.050 56.520 80.000 1.00 0.00 ATOM 22514 OH2 SOL 2300 45.680 36.860 5.200 1.00 0.00 ATOM 22515 H1 SOL 2300 46.250 36.520 4.500 1.00 0.00 ATOM 22516 H2 SOL 2300 46.270 37.000 5.940 1.00 0.00 ATOM 22517 OH2 SOL 2301 17.020 34.600 26.160 1.00 0.00 ATOM 22518 H1 SOL 2301 16.510 34.960 26.890 1.00 0.00 ATOM 22519 H2 SOL 2301 16.870 33.650 26.220 1.00 0.00 ATOM 22520 OH2 SOL 2302 19.970 31.460 67.350 1.00 0.00 ATOM 22521 H1 SOL 2302 20.340 31.010 66.590 1.00 0.00 ATOM 22522 H2 SOL 2302 19.990 32.380 67.120 1.00 0.00 ATOM 22523 OH2 SOL 2303 52.420 6.580 70.920 1.00 0.00 ATOM 22524 H1 SOL 2303 51.880 6.720 71.700 1.00 0.00 ATOM 22525 H2 SOL 2303 53.160 7.160 71.030 1.00 0.00 ATOM 22526 OH2 SOL 2304 44.850 31.850 8.800 1.00 0.00 ATOM 22527 H1 SOL 2304 44.490 32.370 8.080 1.00 0.00 ATOM 22528 H2 SOL 2304 44.120 31.300 9.080 1.00 0.00 ATOM 22529 OH2 SOL 2305 55.430 33.270 11.640 1.00 0.00 ATOM 22530 H1 SOL 2305 55.650 32.560 11.040 1.00 0.00 ATOM 22531 H2 SOL 2305 56.260 33.530 12.040 1.00 0.00 ATOM 22532 OH2 SOL 2306 6.490 55.080 67.290 1.00 0.00 ATOM 22533 H1 SOL 2306 7.130 54.370 67.290 1.00 0.00 ATOM 22534 H2 SOL 2306 6.730 55.620 66.540 1.00 0.00 ATOM 22535 OH2 SOL 2307 17.480 7.820 78.490 1.00 0.00 ATOM 22536 H1 SOL 2307 16.990 8.170 77.750 1.00 0.00 ATOM 22537 H2 SOL 2307 18.270 8.360 78.540 1.00 0.00 ATOM 22538 OH2 SOL 2308 13.760 40.220 5.290 1.00 0.00 ATOM 22539 H1 SOL 2308 12.970 40.720 5.470 1.00 0.00 ATOM 22540 H2 SOL 2308 14.390 40.870 4.960 1.00 0.00 ATOM 22541 OH2 SOL 2309 45.530 25.950 76.550 1.00 0.00 ATOM 22542 H1 SOL 2309 45.630 25.140 77.060 1.00 0.00 ATOM 22543 H2 SOL 2309 45.890 25.740 75.690 1.00 0.00 ATOM 22544 OH2 SOL 2310 12.450 38.210 74.260 1.00 0.00 ATOM 22545 H1 SOL 2310 12.820 38.470 75.100 1.00 0.00 ATOM 22546 H2 SOL 2310 11.830 37.520 74.480 1.00 0.00 ATOM 22547 OH2 SOL 2311 16.640 44.670 15.870 1.00 0.00 ATOM 22548 H1 SOL 2311 16.380 45.300 16.540 1.00 0.00 ATOM 22549 H2 SOL 2311 17.530 44.400 16.120 1.00 0.00 ATOM 22550 OH2 SOL 2312 13.010 36.880 24.030 1.00 0.00 ATOM 22551 H1 SOL 2312 13.310 36.440 23.230 1.00 0.00 ATOM 22552 H2 SOL 2312 13.550 37.660 24.080 1.00 0.00 ATOM 22553 OH2 SOL 2313 4.950 8.600 77.680 1.00 0.00 ATOM 22554 H1 SOL 2313 5.490 7.890 78.010 1.00 0.00 ATOM 22555 H2 SOL 2313 4.120 8.520 78.160 1.00 0.00 ATOM 22556 OH2 SOL 2314 48.830 18.780 24.460 1.00 0.00 ATOM 22557 H1 SOL 2314 48.430 18.280 25.170 1.00 0.00 ATOM 22558 H2 SOL 2314 48.580 19.680 24.620 1.00 0.00 ATOM 22559 OH2 SOL 2315 46.360 3.540 2.220 1.00 0.00 ATOM 22560 H1 SOL 2315 46.470 3.160 3.090 1.00 0.00 ATOM 22561 H2 SOL 2315 45.460 3.880 2.220 1.00 0.00 ATOM 22562 OH2 SOL 2316 53.510 22.800 12.700 1.00 0.00 ATOM 22563 H1 SOL 2316 52.750 23.050 12.170 1.00 0.00 ATOM 22564 H2 SOL 2316 53.220 22.020 13.190 1.00 0.00 ATOM 22565 OH2 SOL 2317 28.570 46.910 19.410 1.00 0.00 ATOM 22566 H1 SOL 2317 28.650 45.950 19.460 1.00 0.00 ATOM 22567 H2 SOL 2317 28.300 47.170 20.290 1.00 0.00 ATOM 22568 OH2 SOL 2318 7.490 2.190 67.500 1.00 0.00 ATOM 22569 H1 SOL 2318 7.980 2.050 66.680 1.00 0.00 ATOM 22570 H2 SOL 2318 6.900 1.430 67.550 1.00 0.00 ATOM 22571 OH2 SOL 2319 10.660 10.580 15.250 1.00 0.00 ATOM 22572 H1 SOL 2319 10.330 10.110 16.010 1.00 0.00 ATOM 22573 H2 SOL 2319 11.200 9.940 14.780 1.00 0.00 ATOM 22574 OH2 SOL 2320 10.360 47.470 80.170 1.00 0.00 ATOM 22575 H1 SOL 2320 10.200 48.290 79.700 1.00 0.00 ATOM 22576 H2 SOL 2320 11.020 47.690 80.830 1.00 0.00 ATOM 22577 OH2 SOL 2321 13.530 43.750 76.630 1.00 0.00 ATOM 22578 H1 SOL 2321 12.970 42.980 76.760 1.00 0.00 ATOM 22579 H2 SOL 2321 14.170 43.700 77.340 1.00 0.00 ATOM 22580 OH2 SOL 2322 2.990 57.470 21.180 1.00 0.00 ATOM 22581 H1 SOL 2322 2.900 56.680 21.720 1.00 0.00 ATOM 22582 H2 SOL 2322 3.150 57.130 20.290 1.00 0.00 ATOM 22583 OH2 SOL 2323 44.480 0.080 22.570 1.00 0.00 ATOM 22584 H1 SOL 2323 45.200 -0.520 22.750 1.00 0.00 ATOM 22585 H2 SOL 2323 44.500 0.710 23.290 1.00 0.00 ATOM 22586 OH2 SOL 2324 4.650 13.670 8.900 1.00 0.00 ATOM 22587 H1 SOL 2324 5.380 14.160 9.280 1.00 0.00 ATOM 22588 H2 SOL 2324 4.200 14.310 8.340 1.00 0.00 ATOM 22589 OH2 SOL 2325 1.220 26.460 74.170 1.00 0.00 ATOM 22590 H1 SOL 2325 1.620 27.270 74.490 1.00 0.00 ATOM 22591 H2 SOL 2325 1.510 26.400 73.260 1.00 0.00 ATOM 22592 OH2 SOL 2326 18.080 6.150 22.710 1.00 0.00 ATOM 22593 H1 SOL 2326 18.040 5.230 22.980 1.00 0.00 ATOM 22594 H2 SOL 2326 19.010 6.360 22.720 1.00 0.00 ATOM 22595 OH2 SOL 2327 4.340 8.820 17.780 1.00 0.00 ATOM 22596 H1 SOL 2327 3.810 8.020 17.820 1.00 0.00 ATOM 22597 H2 SOL 2327 3.760 9.480 17.410 1.00 0.00 ATOM 22598 OH2 SOL 2328 4.450 44.650 20.610 1.00 0.00 ATOM 22599 H1 SOL 2328 4.290 45.590 20.570 1.00 0.00 ATOM 22600 H2 SOL 2328 5.400 44.560 20.670 1.00 0.00 ATOM 22601 OH2 SOL 2329 52.150 35.410 73.140 1.00 0.00 ATOM 22602 H1 SOL 2329 51.230 35.420 73.380 1.00 0.00 ATOM 22603 H2 SOL 2329 52.580 35.930 73.820 1.00 0.00 ATOM 22604 OH2 SOL 2330 14.410 50.000 8.370 1.00 0.00 ATOM 22605 H1 SOL 2330 14.200 49.600 9.210 1.00 0.00 ATOM 22606 H2 SOL 2330 15.070 49.430 7.990 1.00 0.00 ATOM 22607 OH2 SOL 2331 46.400 26.510 12.320 1.00 0.00 ATOM 22608 H1 SOL 2331 47.090 26.150 11.760 1.00 0.00 ATOM 22609 H2 SOL 2331 45.790 25.780 12.440 1.00 0.00 ATOM 22610 OH2 SOL 2332 43.200 19.250 12.320 1.00 0.00 ATOM 22611 H1 SOL 2332 42.530 18.570 12.410 1.00 0.00 ATOM 22612 H2 SOL 2332 42.750 19.970 11.870 1.00 0.00 ATOM 22613 OH2 SOL 2333 12.920 2.570 15.930 1.00 0.00 ATOM 22614 H1 SOL 2333 12.010 2.440 16.210 1.00 0.00 ATOM 22615 H2 SOL 2333 12.870 2.700 14.980 1.00 0.00 ATOM 22616 OH2 SOL 2334 53.260 32.740 15.100 1.00 0.00 ATOM 22617 H1 SOL 2334 53.590 32.070 14.500 1.00 0.00 ATOM 22618 H2 SOL 2334 53.990 33.360 15.180 1.00 0.00 ATOM 22619 OH2 SOL 2335 12.500 8.360 7.870 1.00 0.00 ATOM 22620 H1 SOL 2335 12.730 7.430 7.830 1.00 0.00 ATOM 22621 H2 SOL 2335 12.980 8.750 7.150 1.00 0.00 ATOM 22622 OH2 SOL 2336 43.660 16.840 69.630 1.00 0.00 ATOM 22623 H1 SOL 2336 43.660 16.600 70.560 1.00 0.00 ATOM 22624 H2 SOL 2336 43.900 16.040 69.180 1.00 0.00 ATOM 22625 OH2 SOL 2337 10.040 48.040 24.660 1.00 0.00 ATOM 22626 H1 SOL 2337 10.750 47.650 25.150 1.00 0.00 ATOM 22627 H2 SOL 2337 9.480 48.450 25.330 1.00 0.00 ATOM 22628 OH2 SOL 2338 9.580 7.950 78.710 1.00 0.00 ATOM 22629 H1 SOL 2338 10.190 7.390 78.240 1.00 0.00 ATOM 22630 H2 SOL 2338 9.450 8.710 78.140 1.00 0.00 ATOM 22631 OH2 SOL 2339 24.540 9.440 17.160 1.00 0.00 ATOM 22632 H1 SOL 2339 25.310 9.420 16.600 1.00 0.00 ATOM 22633 H2 SOL 2339 24.050 8.650 16.920 1.00 0.00 ATOM 22634 OH2 SOL 2340 27.250 22.010 17.290 1.00 0.00 ATOM 22635 H1 SOL 2340 27.640 21.140 17.220 1.00 0.00 ATOM 22636 H2 SOL 2340 27.040 22.250 16.390 1.00 0.00 ATOM 22637 OH2 SOL 2341 59.310 7.480 3.830 1.00 0.00 ATOM 22638 H1 SOL 2341 59.060 7.560 2.910 1.00 0.00 ATOM 22639 H2 SOL 2341 59.220 8.370 4.180 1.00 0.00 ATOM 22640 OH2 SOL 2342 55.800 35.850 2.840 1.00 0.00 ATOM 22641 H1 SOL 2342 55.730 35.780 1.890 1.00 0.00 ATOM 22642 H2 SOL 2342 56.500 35.250 3.070 1.00 0.00 ATOM 22643 OH2 SOL 2343 54.860 56.150 1.760 1.00 0.00 ATOM 22644 H1 SOL 2343 54.250 55.500 1.420 1.00 0.00 ATOM 22645 H2 SOL 2343 54.310 56.820 2.150 1.00 0.00 ATOM 22646 OH2 SOL 2344 27.740 31.140 69.380 1.00 0.00 ATOM 22647 H1 SOL 2344 28.040 30.360 68.920 1.00 0.00 ATOM 22648 H2 SOL 2344 27.940 30.980 70.300 1.00 0.00 ATOM 22649 OH2 SOL 2345 32.520 55.890 6.280 1.00 0.00 ATOM 22650 H1 SOL 2345 31.710 56.190 5.860 1.00 0.00 ATOM 22651 H2 SOL 2345 33.100 55.660 5.540 1.00 0.00 ATOM 22652 OH2 SOL 2346 54.930 58.030 81.320 1.00 0.00 ATOM 22653 H1 SOL 2346 54.100 58.250 81.750 1.00 0.00 ATOM 22654 H2 SOL 2346 55.530 57.850 82.040 1.00 0.00 ATOM 22655 OH2 SOL 2347 9.200 16.210 78.010 1.00 0.00 ATOM 22656 H1 SOL 2347 9.250 15.740 77.180 1.00 0.00 ATOM 22657 H2 SOL 2347 8.310 16.540 78.050 1.00 0.00 ATOM 22658 OH2 SOL 2348 30.220 15.970 74.000 1.00 0.00 ATOM 22659 H1 SOL 2348 30.270 15.990 73.040 1.00 0.00 ATOM 22660 H2 SOL 2348 31.130 16.050 74.280 1.00 0.00 ATOM 22661 OH2 SOL 2349 17.910 28.730 82.770 1.00 0.00 ATOM 22662 H1 SOL 2349 17.590 29.630 82.670 1.00 0.00 ATOM 22663 H2 SOL 2349 18.860 28.800 82.680 1.00 0.00 ATOM 22664 OH2 SOL 2350 10.900 44.180 67.540 1.00 0.00 ATOM 22665 H1 SOL 2350 10.760 45.130 67.550 1.00 0.00 ATOM 22666 H2 SOL 2350 11.310 44.000 66.700 1.00 0.00 ATOM 22667 OH2 SOL 2351 4.110 34.820 17.790 1.00 0.00 ATOM 22668 H1 SOL 2351 4.550 34.060 17.410 1.00 0.00 ATOM 22669 H2 SOL 2351 4.820 35.390 18.090 1.00 0.00 ATOM 22670 OH2 SOL 2352 40.280 27.880 21.840 1.00 0.00 ATOM 22671 H1 SOL 2352 40.340 27.140 22.450 1.00 0.00 ATOM 22672 H2 SOL 2352 40.270 27.470 20.970 1.00 0.00 ATOM 22673 OH2 SOL 2353 7.810 21.030 62.870 1.00 0.00 ATOM 22674 H1 SOL 2353 8.570 21.290 62.350 1.00 0.00 ATOM 22675 H2 SOL 2353 7.300 20.470 62.290 1.00 0.00 ATOM 22676 OH2 SOL 2354 36.540 42.460 70.200 1.00 0.00 ATOM 22677 H1 SOL 2354 36.800 42.970 69.430 1.00 0.00 ATOM 22678 H2 SOL 2354 36.780 41.560 69.990 1.00 0.00 ATOM 22679 OH2 SOL 2355 1.720 44.620 64.900 1.00 0.00 ATOM 22680 H1 SOL 2355 2.610 44.460 65.210 1.00 0.00 ATOM 22681 H2 SOL 2355 1.380 43.750 64.700 1.00 0.00 ATOM 22682 OH2 SOL 2356 17.210 10.720 73.580 1.00 0.00 ATOM 22683 H1 SOL 2356 17.130 10.270 72.740 1.00 0.00 ATOM 22684 H2 SOL 2356 16.400 11.240 73.660 1.00 0.00 ATOM 22685 OH2 SOL 2357 14.700 38.560 7.320 1.00 0.00 ATOM 22686 H1 SOL 2357 14.420 39.190 6.660 1.00 0.00 ATOM 22687 H2 SOL 2357 15.650 38.550 7.260 1.00 0.00 ATOM 22688 OH2 SOL 2358 24.410 23.790 2.220 1.00 0.00 ATOM 22689 H1 SOL 2358 24.230 23.070 2.830 1.00 0.00 ATOM 22690 H2 SOL 2358 25.370 23.870 2.230 1.00 0.00 ATOM 22691 OH2 SOL 2359 14.930 35.610 6.840 1.00 0.00 ATOM 22692 H1 SOL 2359 14.580 35.290 6.000 1.00 0.00 ATOM 22693 H2 SOL 2359 14.550 36.480 6.940 1.00 0.00 ATOM 22694 OH2 SOL 2360 3.390 14.510 68.690 1.00 0.00 ATOM 22695 H1 SOL 2360 3.060 15.280 68.210 1.00 0.00 ATOM 22696 H2 SOL 2360 3.840 14.880 69.450 1.00 0.00 ATOM 22697 OH2 SOL 2361 51.980 26.480 23.580 1.00 0.00 ATOM 22698 H1 SOL 2361 51.370 27.190 23.760 1.00 0.00 ATOM 22699 H2 SOL 2361 52.100 26.040 24.420 1.00 0.00 ATOM 22700 OH2 SOL 2362 2.330 29.120 13.660 1.00 0.00 ATOM 22701 H1 SOL 2362 1.790 28.340 13.760 1.00 0.00 ATOM 22702 H2 SOL 2362 1.840 29.810 14.110 1.00 0.00 ATOM 22703 OH2 SOL 2363 9.820 36.800 80.180 1.00 0.00 ATOM 22704 H1 SOL 2363 9.900 37.750 80.120 1.00 0.00 ATOM 22705 H2 SOL 2363 10.490 36.460 79.590 1.00 0.00 ATOM 22706 OH2 SOL 2364 16.660 50.330 73.140 1.00 0.00 ATOM 22707 H1 SOL 2364 16.500 49.850 72.330 1.00 0.00 ATOM 22708 H2 SOL 2364 16.130 51.120 73.050 1.00 0.00 ATOM 22709 OH2 SOL 2365 59.980 7.580 12.240 1.00 0.00 ATOM 22710 H1 SOL 2365 60.110 8.460 11.870 1.00 0.00 ATOM 22711 H2 SOL 2365 60.430 6.990 11.640 1.00 0.00 ATOM 22712 OH2 SOL 2366 36.780 53.630 1.930 1.00 0.00 ATOM 22713 H1 SOL 2366 37.230 53.050 1.320 1.00 0.00 ATOM 22714 H2 SOL 2366 37.440 54.280 2.180 1.00 0.00 ATOM 22715 OH2 SOL 2367 17.340 52.870 79.020 1.00 0.00 ATOM 22716 H1 SOL 2367 16.520 52.570 78.620 1.00 0.00 ATOM 22717 H2 SOL 2367 17.380 52.410 79.860 1.00 0.00 ATOM 22718 OH2 SOL 2368 23.130 45.420 67.670 1.00 0.00 ATOM 22719 H1 SOL 2368 23.840 45.380 68.310 1.00 0.00 ATOM 22720 H2 SOL 2368 22.800 46.310 67.730 1.00 0.00 ATOM 22721 OH2 SOL 2369 34.610 23.310 67.770 1.00 0.00 ATOM 22722 H1 SOL 2369 33.740 22.930 67.800 1.00 0.00 ATOM 22723 H2 SOL 2369 35.110 22.720 67.200 1.00 0.00 ATOM 22724 OH2 SOL 2370 12.220 10.330 61.360 1.00 0.00 ATOM 22725 H1 SOL 2370 12.270 11.040 62.000 1.00 0.00 ATOM 22726 H2 SOL 2370 11.390 10.480 60.910 1.00 0.00 ATOM 22727 OH2 SOL 2371 52.040 42.270 67.200 1.00 0.00 ATOM 22728 H1 SOL 2371 51.700 41.730 67.910 1.00 0.00 ATOM 22729 H2 SOL 2371 52.520 41.650 66.640 1.00 0.00 ATOM 22730 OH2 SOL 2372 24.030 40.000 74.130 1.00 0.00 ATOM 22731 H1 SOL 2372 23.860 39.280 74.740 1.00 0.00 ATOM 22732 H2 SOL 2372 23.490 40.720 74.460 1.00 0.00 ATOM 22733 OH2 SOL 2373 32.140 53.760 69.490 1.00 0.00 ATOM 22734 H1 SOL 2373 32.670 53.020 69.800 1.00 0.00 ATOM 22735 H2 SOL 2373 32.760 54.320 69.030 1.00 0.00 ATOM 22736 OH2 SOL 2374 30.370 5.660 3.120 1.00 0.00 ATOM 22737 H1 SOL 2374 30.720 6.510 2.850 1.00 0.00 ATOM 22738 H2 SOL 2374 30.580 5.590 4.050 1.00 0.00 ATOM 22739 OH2 SOL 2375 55.130 52.370 2.020 1.00 0.00 ATOM 22740 H1 SOL 2375 55.920 51.850 1.850 1.00 0.00 ATOM 22741 H2 SOL 2375 55.280 52.730 2.900 1.00 0.00 ATOM 22742 OH2 SOL 2376 42.390 16.380 76.580 1.00 0.00 ATOM 22743 H1 SOL 2376 42.450 16.130 77.510 1.00 0.00 ATOM 22744 H2 SOL 2376 42.110 17.290 76.600 1.00 0.00 ATOM 22745 OH2 SOL 2377 29.520 33.500 9.450 1.00 0.00 ATOM 22746 H1 SOL 2377 28.910 32.870 9.070 1.00 0.00 ATOM 22747 H2 SOL 2377 30.320 32.990 9.610 1.00 0.00 ATOM 22748 OH2 SOL 2378 3.640 31.700 5.510 1.00 0.00 ATOM 22749 H1 SOL 2378 4.130 32.360 6.000 1.00 0.00 ATOM 22750 H2 SOL 2378 2.790 32.110 5.350 1.00 0.00 ATOM 22751 OH2 SOL 2379 7.970 1.250 4.650 1.00 0.00 ATOM 22752 H1 SOL 2379 8.290 0.460 5.080 1.00 0.00 ATOM 22753 H2 SOL 2379 7.230 0.950 4.120 1.00 0.00 ATOM 22754 OH2 SOL 2380 21.440 0.810 17.320 1.00 0.00 ATOM 22755 H1 SOL 2380 22.200 0.770 16.730 1.00 0.00 ATOM 22756 H2 SOL 2380 21.170 1.730 17.310 1.00 0.00 ATOM 22757 OH2 SOL 2381 25.850 54.330 82.080 1.00 0.00 ATOM 22758 H1 SOL 2381 25.220 54.740 82.680 1.00 0.00 ATOM 22759 H2 SOL 2381 26.520 55.000 81.960 1.00 0.00 ATOM 22760 OH2 SOL 2382 26.900 41.460 14.550 1.00 0.00 ATOM 22761 H1 SOL 2382 25.990 41.630 14.790 1.00 0.00 ATOM 22762 H2 SOL 2382 27.110 42.140 13.920 1.00 0.00 ATOM 22763 OH2 SOL 2383 39.820 3.370 65.920 1.00 0.00 ATOM 22764 H1 SOL 2383 40.540 2.820 65.610 1.00 0.00 ATOM 22765 H2 SOL 2383 39.610 3.930 65.170 1.00 0.00 ATOM 22766 OH2 SOL 2384 17.620 37.840 22.750 1.00 0.00 ATOM 22767 H1 SOL 2384 17.610 36.920 23.000 1.00 0.00 ATOM 22768 H2 SOL 2384 18.550 38.080 22.760 1.00 0.00 ATOM 22769 OH2 SOL 2385 51.690 29.870 82.390 1.00 0.00 ATOM 22770 H1 SOL 2385 51.080 29.880 83.120 1.00 0.00 ATOM 22771 H2 SOL 2385 52.140 30.710 82.430 1.00 0.00 ATOM 22772 OH2 SOL 2386 7.750 24.210 77.520 1.00 0.00 ATOM 22773 H1 SOL 2386 7.010 24.810 77.570 1.00 0.00 ATOM 22774 H2 SOL 2386 7.850 23.870 78.410 1.00 0.00 ATOM 22775 OH2 SOL 2387 32.460 4.430 79.890 1.00 0.00 ATOM 22776 H1 SOL 2387 31.750 4.790 80.410 1.00 0.00 ATOM 22777 H2 SOL 2387 32.050 4.140 79.070 1.00 0.00 ATOM 22778 OH2 SOL 2388 58.660 47.020 82.680 1.00 0.00 ATOM 22779 H1 SOL 2388 58.570 47.560 81.900 1.00 0.00 ATOM 22780 H2 SOL 2388 58.020 47.370 83.300 1.00 0.00 ATOM 22781 OH2 SOL 2389 53.150 16.780 15.050 1.00 0.00 ATOM 22782 H1 SOL 2389 54.020 16.960 14.700 1.00 0.00 ATOM 22783 H2 SOL 2389 52.560 17.330 14.530 1.00 0.00 ATOM 22784 OH2 SOL 2390 19.690 38.580 78.040 1.00 0.00 ATOM 22785 H1 SOL 2390 19.700 39.320 78.650 1.00 0.00 ATOM 22786 H2 SOL 2390 19.440 38.960 77.200 1.00 0.00 ATOM 22787 OH2 SOL 2391 54.090 34.590 71.350 1.00 0.00 ATOM 22788 H1 SOL 2391 53.550 34.590 72.140 1.00 0.00 ATOM 22789 H2 SOL 2391 54.160 35.510 71.100 1.00 0.00 ATOM 22790 OH2 SOL 2392 9.000 44.070 6.500 1.00 0.00 ATOM 22791 H1 SOL 2392 9.730 44.480 6.050 1.00 0.00 ATOM 22792 H2 SOL 2392 8.750 44.690 7.180 1.00 0.00 ATOM 22793 OH2 SOL 2393 3.320 5.600 20.830 1.00 0.00 ATOM 22794 H1 SOL 2393 4.140 6.020 20.560 1.00 0.00 ATOM 22795 H2 SOL 2393 3.570 5.060 21.590 1.00 0.00 ATOM 22796 OH2 SOL 2394 35.000 43.400 12.340 1.00 0.00 ATOM 22797 H1 SOL 2394 35.550 43.300 11.570 1.00 0.00 ATOM 22798 H2 SOL 2394 35.600 43.660 13.040 1.00 0.00 ATOM 22799 OH2 SOL 2395 31.980 57.050 75.210 1.00 0.00 ATOM 22800 H1 SOL 2395 32.750 57.320 74.700 1.00 0.00 ATOM 22801 H2 SOL 2395 31.850 56.130 74.970 1.00 0.00 ATOM 22802 OH2 SOL 2396 22.900 9.460 66.970 1.00 0.00 ATOM 22803 H1 SOL 2396 23.590 8.790 66.980 1.00 0.00 ATOM 22804 H2 SOL 2396 23.160 10.060 66.280 1.00 0.00 ATOM 22805 OH2 SOL 2397 22.050 55.640 15.700 1.00 0.00 ATOM 22806 H1 SOL 2397 22.230 56.260 14.990 1.00 0.00 ATOM 22807 H2 SOL 2397 22.520 55.990 16.450 1.00 0.00 ATOM 22808 OH2 SOL 2398 -0.090 37.980 4.580 1.00 0.00 ATOM 22809 H1 SOL 2398 -0.400 37.090 4.690 1.00 0.00 ATOM 22810 H2 SOL 2398 0.850 37.940 4.750 1.00 0.00 ATOM 22811 OH2 SOL 2399 45.010 14.350 69.120 1.00 0.00 ATOM 22812 H1 SOL 2399 45.060 13.650 69.780 1.00 0.00 ATOM 22813 H2 SOL 2399 45.890 14.710 69.080 1.00 0.00 ATOM 22814 OH2 SOL 2400 10.410 23.650 83.000 1.00 0.00 ATOM 22815 H1 SOL 2400 10.350 24.120 83.830 1.00 0.00 ATOM 22816 H2 SOL 2400 11.260 23.900 82.640 1.00 0.00 ATOM 22817 OH2 SOL 2401 59.650 48.270 8.860 1.00 0.00 ATOM 22818 H1 SOL 2401 60.550 48.020 9.080 1.00 0.00 ATOM 22819 H2 SOL 2401 59.280 47.490 8.440 1.00 0.00 ATOM 22820 OH2 SOL 2402 26.250 4.900 14.190 1.00 0.00 ATOM 22821 H1 SOL 2402 26.600 4.550 13.370 1.00 0.00 ATOM 22822 H2 SOL 2402 26.920 4.720 14.840 1.00 0.00 ATOM 22823 OH2 SOL 2403 1.340 16.260 5.500 1.00 0.00 ATOM 22824 H1 SOL 2403 0.690 15.810 4.950 1.00 0.00 ATOM 22825 H2 SOL 2403 2.180 16.090 5.070 1.00 0.00 ATOM 22826 OH2 SOL 2404 61.220 46.500 1.260 1.00 0.00 ATOM 22827 H1 SOL 2404 60.890 46.520 2.160 1.00 0.00 ATOM 22828 H2 SOL 2404 62.100 46.140 1.330 1.00 0.00 ATOM 22829 OH2 SOL 2405 40.170 16.760 68.490 1.00 0.00 ATOM 22830 H1 SOL 2405 40.380 16.970 69.400 1.00 0.00 ATOM 22831 H2 SOL 2405 39.350 16.270 68.540 1.00 0.00 ATOM 22832 OH2 SOL 2406 19.120 31.140 79.550 1.00 0.00 ATOM 22833 H1 SOL 2406 20.030 31.220 79.830 1.00 0.00 ATOM 22834 H2 SOL 2406 18.910 30.210 79.630 1.00 0.00 ATOM 22835 OH2 SOL 2407 58.550 34.550 64.230 1.00 0.00 ATOM 22836 H1 SOL 2407 58.030 34.300 63.470 1.00 0.00 ATOM 22837 H2 SOL 2407 58.870 35.430 64.020 1.00 0.00 ATOM 22838 OH2 SOL 2408 5.200 37.050 80.540 1.00 0.00 ATOM 22839 H1 SOL 2408 4.360 37.300 80.930 1.00 0.00 ATOM 22840 H2 SOL 2408 5.140 36.100 80.430 1.00 0.00 ATOM 22841 OH2 SOL 2409 6.710 56.490 13.330 1.00 0.00 ATOM 22842 H1 SOL 2409 7.370 56.680 14.000 1.00 0.00 ATOM 22843 H2 SOL 2409 5.930 56.950 13.640 1.00 0.00 ATOM 22844 OH2 SOL 2410 1.820 17.630 16.550 1.00 0.00 ATOM 22845 H1 SOL 2410 1.910 18.000 17.420 1.00 0.00 ATOM 22846 H2 SOL 2410 2.580 17.050 16.450 1.00 0.00 ATOM 22847 OH2 SOL 2411 36.950 48.790 82.050 1.00 0.00 ATOM 22848 H1 SOL 2411 37.610 48.170 82.350 1.00 0.00 ATOM 22849 H2 SOL 2411 36.740 48.510 81.160 1.00 0.00 ATOM 22850 OH2 SOL 2412 59.810 0.790 70.780 1.00 0.00 ATOM 22851 H1 SOL 2412 58.920 1.130 70.880 1.00 0.00 ATOM 22852 H2 SOL 2412 60.360 1.440 71.210 1.00 0.00 ATOM 22853 OH2 SOL 2413 60.620 53.230 7.490 1.00 0.00 ATOM 22854 H1 SOL 2413 61.560 53.380 7.550 1.00 0.00 ATOM 22855 H2 SOL 2413 60.500 52.320 7.740 1.00 0.00 ATOM 22856 OH2 SOL 2414 35.090 0.700 6.100 1.00 0.00 ATOM 22857 H1 SOL 2414 34.940 1.530 5.650 1.00 0.00 ATOM 22858 H2 SOL 2414 35.360 0.090 5.410 1.00 0.00 ATOM 22859 OH2 SOL 2415 2.330 15.120 24.880 1.00 0.00 ATOM 22860 H1 SOL 2415 1.950 14.240 24.830 1.00 0.00 ATOM 22861 H2 SOL 2415 2.040 15.460 25.730 1.00 0.00 ATOM 22862 OH2 SOL 2416 6.710 32.080 80.970 1.00 0.00 ATOM 22863 H1 SOL 2416 7.320 32.810 81.010 1.00 0.00 ATOM 22864 H2 SOL 2416 6.250 32.200 80.140 1.00 0.00 ATOM 22865 OH2 SOL 2417 25.230 9.310 24.890 1.00 0.00 ATOM 22866 H1 SOL 2417 25.560 8.650 25.500 1.00 0.00 ATOM 22867 H2 SOL 2417 25.920 9.980 24.870 1.00 0.00 ATOM 22868 OH2 SOL 2418 44.290 30.500 17.440 1.00 0.00 ATOM 22869 H1 SOL 2418 43.540 30.100 17.010 1.00 0.00 ATOM 22870 H2 SOL 2418 44.040 31.410 17.560 1.00 0.00 ATOM 22871 OH2 SOL 2419 -0.120 21.740 23.820 1.00 0.00 ATOM 22872 H1 SOL 2419 0.710 21.260 23.720 1.00 0.00 ATOM 22873 H2 SOL 2419 0.120 22.510 24.340 1.00 0.00 ATOM 22874 OH2 SOL 2420 50.430 56.260 6.370 1.00 0.00 ATOM 22875 H1 SOL 2420 49.910 55.820 5.690 1.00 0.00 ATOM 22876 H2 SOL 2420 51.340 56.080 6.120 1.00 0.00 ATOM 22877 OH2 SOL 2421 2.080 40.820 18.160 1.00 0.00 ATOM 22878 H1 SOL 2421 2.880 41.340 18.080 1.00 0.00 ATOM 22879 H2 SOL 2421 2.360 40.010 18.600 1.00 0.00 ATOM 22880 OH2 SOL 2422 29.730 0.590 71.690 1.00 0.00 ATOM 22881 H1 SOL 2422 30.110 -0.170 71.250 1.00 0.00 ATOM 22882 H2 SOL 2422 30.210 0.670 72.510 1.00 0.00 ATOM 22883 OH2 SOL 2423 46.380 28.430 82.530 1.00 0.00 ATOM 22884 H1 SOL 2423 45.900 27.920 83.180 1.00 0.00 ATOM 22885 H2 SOL 2423 46.580 27.800 81.830 1.00 0.00 ATOM 22886 OH2 SOL 2424 49.280 38.860 82.580 1.00 0.00 ATOM 22887 H1 SOL 2424 49.220 38.750 83.530 1.00 0.00 ATOM 22888 H2 SOL 2424 49.960 39.520 82.450 1.00 0.00 ATOM 22889 OH2 SOL 2425 26.720 29.280 14.340 1.00 0.00 ATOM 22890 H1 SOL 2425 27.670 29.200 14.470 1.00 0.00 ATOM 22891 H2 SOL 2425 26.570 28.930 13.460 1.00 0.00 ATOM 22892 OH2 SOL 2426 29.420 6.310 69.100 1.00 0.00 ATOM 22893 H1 SOL 2426 28.470 6.420 69.080 1.00 0.00 ATOM 22894 H2 SOL 2426 29.610 5.760 68.350 1.00 0.00 ATOM 22895 OH2 SOL 2427 19.570 57.110 79.500 1.00 0.00 ATOM 22896 H1 SOL 2427 19.650 56.160 79.440 1.00 0.00 ATOM 22897 H2 SOL 2427 18.670 57.290 79.220 1.00 0.00 ATOM 22898 OH2 SOL 2428 20.370 4.510 67.500 1.00 0.00 ATOM 22899 H1 SOL 2428 20.130 4.080 68.320 1.00 0.00 ATOM 22900 H2 SOL 2428 20.420 3.800 66.860 1.00 0.00 ATOM 22901 OH2 SOL 2429 5.700 30.300 74.870 1.00 0.00 ATOM 22902 H1 SOL 2429 5.600 30.650 73.990 1.00 0.00 ATOM 22903 H2 SOL 2429 5.010 30.720 75.380 1.00 0.00 ATOM 22904 OH2 SOL 2430 35.610 2.420 12.430 1.00 0.00 ATOM 22905 H1 SOL 2430 36.530 2.160 12.530 1.00 0.00 ATOM 22906 H2 SOL 2430 35.120 1.730 12.890 1.00 0.00 ATOM 22907 OH2 SOL 2431 41.120 45.760 69.340 1.00 0.00 ATOM 22908 H1 SOL 2431 40.180 45.940 69.220 1.00 0.00 ATOM 22909 H2 SOL 2431 41.150 44.910 69.770 1.00 0.00 ATOM 22910 OH2 SOL 2432 16.010 52.720 60.590 1.00 0.00 ATOM 22911 H1 SOL 2432 16.360 51.910 60.220 1.00 0.00 ATOM 22912 H2 SOL 2432 16.390 53.410 60.050 1.00 0.00 ATOM 22913 OH2 SOL 2433 38.580 58.180 11.430 1.00 0.00 ATOM 22914 H1 SOL 2433 38.610 58.470 10.520 1.00 0.00 ATOM 22915 H2 SOL 2433 37.960 57.450 11.430 1.00 0.00 ATOM 22916 OH2 SOL 2434 59.690 39.840 80.940 1.00 0.00 ATOM 22917 H1 SOL 2434 59.220 40.430 81.530 1.00 0.00 ATOM 22918 H2 SOL 2434 59.720 40.310 80.110 1.00 0.00 ATOM 22919 OH2 SOL 2435 44.180 37.760 19.250 1.00 0.00 ATOM 22920 H1 SOL 2435 44.800 38.340 18.800 1.00 0.00 ATOM 22921 H2 SOL 2435 44.300 37.950 20.180 1.00 0.00 ATOM 22922 OH2 SOL 2436 34.980 21.840 61.960 1.00 0.00 ATOM 22923 H1 SOL 2436 35.200 22.230 62.810 1.00 0.00 ATOM 22924 H2 SOL 2436 34.740 22.580 61.410 1.00 0.00 ATOM 22925 OH2 SOL 2437 16.430 33.150 15.740 1.00 0.00 ATOM 22926 H1 SOL 2437 15.660 33.610 15.420 1.00 0.00 ATOM 22927 H2 SOL 2437 16.950 32.950 14.960 1.00 0.00 ATOM 22928 OH2 SOL 2438 1.330 12.290 70.150 1.00 0.00 ATOM 22929 H1 SOL 2438 1.230 13.160 69.780 1.00 0.00 ATOM 22930 H2 SOL 2438 0.960 11.700 69.490 1.00 0.00 ATOM 22931 OH2 SOL 2439 38.720 6.970 81.940 1.00 0.00 ATOM 22932 H1 SOL 2439 38.880 7.790 81.480 1.00 0.00 ATOM 22933 H2 SOL 2439 37.790 7.000 82.170 1.00 0.00 ATOM 22934 OH2 SOL 2440 59.880 10.310 9.620 1.00 0.00 ATOM 22935 H1 SOL 2440 60.630 10.270 9.030 1.00 0.00 ATOM 22936 H2 SOL 2440 59.120 10.290 9.050 1.00 0.00 ATOM 22937 OH2 SOL 2441 13.600 0.840 82.880 1.00 0.00 ATOM 22938 H1 SOL 2441 14.230 0.150 83.100 1.00 0.00 ATOM 22939 H2 SOL 2441 13.600 0.860 81.920 1.00 0.00 ATOM 22940 OH2 SOL 2442 32.320 52.720 1.310 1.00 0.00 ATOM 22941 H1 SOL 2442 32.940 52.000 1.330 1.00 0.00 ATOM 22942 H2 SOL 2442 32.520 53.230 2.090 1.00 0.00 ATOM 22943 OH2 SOL 2443 56.630 18.730 26.240 1.00 0.00 ATOM 22944 H1 SOL 2443 57.070 19.290 26.880 1.00 0.00 ATOM 22945 H2 SOL 2443 56.930 17.850 26.430 1.00 0.00 ATOM 22946 OH2 SOL 2444 53.660 21.870 67.250 1.00 0.00 ATOM 22947 H1 SOL 2444 53.630 22.790 66.990 1.00 0.00 ATOM 22948 H2 SOL 2444 52.860 21.490 66.880 1.00 0.00 ATOM 22949 OH2 SOL 2445 8.500 55.100 69.550 1.00 0.00 ATOM 22950 H1 SOL 2445 7.900 54.560 69.040 1.00 0.00 ATOM 22951 H2 SOL 2445 8.670 54.590 70.340 1.00 0.00 ATOM 22952 OH2 SOL 2446 32.920 13.200 15.680 1.00 0.00 ATOM 22953 H1 SOL 2446 33.740 12.730 15.530 1.00 0.00 ATOM 22954 H2 SOL 2446 32.430 13.090 14.860 1.00 0.00 ATOM 22955 OH2 SOL 2447 15.960 31.680 5.490 1.00 0.00 ATOM 22956 H1 SOL 2447 15.250 31.770 6.120 1.00 0.00 ATOM 22957 H2 SOL 2447 15.700 30.940 4.940 1.00 0.00 ATOM 22958 OH2 SOL 2448 32.680 10.830 3.090 1.00 0.00 ATOM 22959 H1 SOL 2448 31.890 10.320 3.290 1.00 0.00 ATOM 22960 H2 SOL 2448 32.600 11.610 3.640 1.00 0.00 ATOM 22961 OH2 SOL 2449 58.140 55.300 4.400 1.00 0.00 ATOM 22962 H1 SOL 2449 58.640 55.100 5.200 1.00 0.00 ATOM 22963 H2 SOL 2449 57.590 56.040 4.640 1.00 0.00 ATOM 22964 OH2 SOL 2450 41.990 33.860 84.190 1.00 0.00 ATOM 22965 H1 SOL 2450 41.550 34.570 83.710 1.00 0.00 ATOM 22966 H2 SOL 2450 42.480 33.390 83.520 1.00 0.00 ATOM 22967 OH2 SOL 2451 26.840 56.130 74.060 1.00 0.00 ATOM 22968 H1 SOL 2451 26.380 56.730 73.470 1.00 0.00 ATOM 22969 H2 SOL 2451 26.900 56.610 74.890 1.00 0.00 ATOM 22970 OH2 SOL 2452 7.100 6.890 62.590 1.00 0.00 ATOM 22971 H1 SOL 2452 6.800 6.210 61.980 1.00 0.00 ATOM 22972 H2 SOL 2452 7.780 7.360 62.100 1.00 0.00 ATOM 22973 OH2 SOL 2453 53.370 5.310 68.350 1.00 0.00 ATOM 22974 H1 SOL 2453 53.900 4.660 68.820 1.00 0.00 ATOM 22975 H2 SOL 2453 52.910 5.780 69.040 1.00 0.00 ATOM 22976 OH2 SOL 2454 53.190 39.790 66.350 1.00 0.00 ATOM 22977 H1 SOL 2454 52.690 39.090 66.760 1.00 0.00 ATOM 22978 H2 SOL 2454 52.990 39.720 65.420 1.00 0.00 ATOM 22979 OH2 SOL 2455 46.530 50.720 61.180 1.00 0.00 ATOM 22980 H1 SOL 2455 46.790 50.060 60.540 1.00 0.00 ATOM 22981 H2 SOL 2455 47.150 51.440 61.040 1.00 0.00 ATOM 22982 OH2 SOL 2456 30.890 19.860 6.640 1.00 0.00 ATOM 22983 H1 SOL 2456 31.520 19.140 6.610 1.00 0.00 ATOM 22984 H2 SOL 2456 30.930 20.250 5.770 1.00 0.00 ATOM 22985 OH2 SOL 2457 39.810 31.590 17.400 1.00 0.00 ATOM 22986 H1 SOL 2457 39.020 31.170 17.050 1.00 0.00 ATOM 22987 H2 SOL 2457 40.510 30.950 17.240 1.00 0.00 ATOM 22988 OH2 SOL 2458 20.750 56.820 7.810 1.00 0.00 ATOM 22989 H1 SOL 2458 21.220 57.130 7.030 1.00 0.00 ATOM 22990 H2 SOL 2458 19.840 56.740 7.520 1.00 0.00 ATOM 22991 OH2 SOL 2459 41.670 45.440 5.420 1.00 0.00 ATOM 22992 H1 SOL 2459 42.250 45.230 6.140 1.00 0.00 ATOM 22993 H2 SOL 2459 41.410 46.350 5.570 1.00 0.00 ATOM 22994 OH2 SOL 2460 58.440 44.940 64.990 1.00 0.00 ATOM 22995 H1 SOL 2460 57.880 44.910 65.760 1.00 0.00 ATOM 22996 H2 SOL 2460 58.590 44.030 64.750 1.00 0.00 ATOM 22997 OH2 SOL 2461 50.220 36.830 81.070 1.00 0.00 ATOM 22998 H1 SOL 2461 49.960 36.230 81.770 1.00 0.00 ATOM 22999 H2 SOL 2461 49.750 37.640 81.260 1.00 0.00 ATOM 23000 OH2 SOL 2462 39.010 1.200 82.680 1.00 0.00 ATOM 23001 H1 SOL 2462 38.340 0.800 83.230 1.00 0.00 ATOM 23002 H2 SOL 2462 38.930 0.760 81.830 1.00 0.00 ATOM 23003 OH2 SOL 2463 48.200 16.340 77.660 1.00 0.00 ATOM 23004 H1 SOL 2463 47.570 16.940 77.270 1.00 0.00 ATOM 23005 H2 SOL 2463 49.020 16.520 77.200 1.00 0.00 ATOM 23006 OH2 SOL 2464 12.680 28.740 26.410 1.00 0.00 ATOM 23007 H1 SOL 2464 12.920 28.550 27.320 1.00 0.00 ATOM 23008 H2 SOL 2464 12.270 27.940 26.100 1.00 0.00 ATOM 23009 OH2 SOL 2465 1.820 26.650 82.180 1.00 0.00 ATOM 23010 H1 SOL 2465 1.460 27.300 82.780 1.00 0.00 ATOM 23011 H2 SOL 2465 1.120 26.480 81.560 1.00 0.00 ATOM 23012 OH2 SOL 2466 52.800 9.000 23.240 1.00 0.00 ATOM 23013 H1 SOL 2466 53.630 8.600 23.500 1.00 0.00 ATOM 23014 H2 SOL 2466 52.930 9.930 23.400 1.00 0.00 ATOM 23015 OH2 SOL 2467 19.200 50.760 76.690 1.00 0.00 ATOM 23016 H1 SOL 2467 18.780 51.330 76.050 1.00 0.00 ATOM 23017 H2 SOL 2467 18.530 50.110 76.910 1.00 0.00 ATOM 23018 OH2 SOL 2468 10.360 49.880 76.010 1.00 0.00 ATOM 23019 H1 SOL 2468 11.030 50.160 75.390 1.00 0.00 ATOM 23020 H2 SOL 2468 10.460 48.930 76.060 1.00 0.00 ATOM 23021 OH2 SOL 2469 53.390 51.660 23.770 1.00 0.00 ATOM 23022 H1 SOL 2469 52.780 52.170 24.310 1.00 0.00 ATOM 23023 H2 SOL 2469 54.140 51.510 24.340 1.00 0.00 ATOM 23024 OH2 SOL 2470 12.910 3.340 77.670 1.00 0.00 ATOM 23025 H1 SOL 2470 12.580 2.780 76.970 1.00 0.00 ATOM 23026 H2 SOL 2470 13.580 3.880 77.250 1.00 0.00 ATOM 23027 OH2 SOL 2471 36.810 28.600 75.440 1.00 0.00 ATOM 23028 H1 SOL 2471 36.480 29.120 74.710 1.00 0.00 ATOM 23029 H2 SOL 2471 37.760 28.750 75.440 1.00 0.00 ATOM 23030 OH2 SOL 2472 4.720 6.980 1.420 1.00 0.00 ATOM 23031 H1 SOL 2472 5.450 6.920 2.040 1.00 0.00 ATOM 23032 H2 SOL 2472 3.940 6.820 1.950 1.00 0.00 ATOM 23033 OH2 SOL 2473 10.540 18.020 4.120 1.00 0.00 ATOM 23034 H1 SOL 2473 9.940 18.210 3.400 1.00 0.00 ATOM 23035 H2 SOL 2473 10.100 17.340 4.630 1.00 0.00 ATOM 23036 OH2 SOL 2474 57.760 2.310 72.150 1.00 0.00 ATOM 23037 H1 SOL 2474 58.630 2.560 72.480 1.00 0.00 ATOM 23038 H2 SOL 2474 57.160 2.550 72.850 1.00 0.00 ATOM 23039 OH2 SOL 2475 5.320 37.360 10.820 1.00 0.00 ATOM 23040 H1 SOL 2475 5.520 37.370 9.880 1.00 0.00 ATOM 23041 H2 SOL 2475 4.860 38.190 10.970 1.00 0.00 ATOM 23042 OH2 SOL 2476 61.080 51.800 18.380 1.00 0.00 ATOM 23043 H1 SOL 2476 60.660 51.650 17.540 1.00 0.00 ATOM 23044 H2 SOL 2476 60.380 52.110 18.950 1.00 0.00 ATOM 23045 OH2 SOL 2477 40.760 57.490 80.240 1.00 0.00 ATOM 23046 H1 SOL 2477 41.600 57.920 80.100 1.00 0.00 ATOM 23047 H2 SOL 2477 40.110 58.160 80.010 1.00 0.00 ATOM 23048 OH2 SOL 2478 16.100 41.550 8.860 1.00 0.00 ATOM 23049 H1 SOL 2478 16.890 41.550 9.400 1.00 0.00 ATOM 23050 H2 SOL 2478 16.360 41.100 8.050 1.00 0.00 ATOM 23051 OH2 SOL 2479 37.690 22.480 23.570 1.00 0.00 ATOM 23052 H1 SOL 2479 37.410 21.750 23.030 1.00 0.00 ATOM 23053 H2 SOL 2479 37.830 22.100 24.440 1.00 0.00 ATOM 23054 OH2 SOL 2480 34.240 54.310 83.310 1.00 0.00 ATOM 23055 H1 SOL 2480 34.340 53.980 82.420 1.00 0.00 ATOM 23056 H2 SOL 2480 33.570 53.750 83.700 1.00 0.00 ATOM 23057 OH2 SOL 2481 20.500 41.590 8.960 1.00 0.00 ATOM 23058 H1 SOL 2481 20.860 40.870 8.450 1.00 0.00 ATOM 23059 H2 SOL 2481 19.960 41.170 9.630 1.00 0.00 ATOM 23060 OH2 SOL 2482 18.730 46.010 80.060 1.00 0.00 ATOM 23061 H1 SOL 2482 19.670 45.930 79.940 1.00 0.00 ATOM 23062 H2 SOL 2482 18.540 46.940 79.890 1.00 0.00 ATOM 23063 OH2 SOL 2483 15.390 29.940 77.590 1.00 0.00 ATOM 23064 H1 SOL 2483 16.240 30.360 77.480 1.00 0.00 ATOM 23065 H2 SOL 2483 15.090 30.240 78.450 1.00 0.00 ATOM 23066 OH2 SOL 2484 39.720 36.070 1.070 1.00 0.00 ATOM 23067 H1 SOL 2484 40.440 36.430 1.590 1.00 0.00 ATOM 23068 H2 SOL 2484 39.510 36.760 0.450 1.00 0.00 ATOM 23069 OH2 SOL 2485 44.580 2.950 72.110 1.00 0.00 ATOM 23070 H1 SOL 2485 44.260 2.900 73.010 1.00 0.00 ATOM 23071 H2 SOL 2485 43.830 3.300 71.620 1.00 0.00 ATOM 23072 OH2 SOL 2486 42.950 29.510 14.290 1.00 0.00 ATOM 23073 H1 SOL 2486 43.670 30.140 14.220 1.00 0.00 ATOM 23074 H2 SOL 2486 43.040 28.950 13.520 1.00 0.00 ATOM 23075 OH2 SOL 2487 13.710 18.000 66.940 1.00 0.00 ATOM 23076 H1 SOL 2487 13.680 18.790 66.410 1.00 0.00 ATOM 23077 H2 SOL 2487 13.770 17.290 66.300 1.00 0.00 ATOM 23078 OH2 SOL 2488 56.330 0.230 66.680 1.00 0.00 ATOM 23079 H1 SOL 2488 56.760 -0.040 67.500 1.00 0.00 ATOM 23080 H2 SOL 2488 57.040 0.310 66.050 1.00 0.00 ATOM 23081 OH2 SOL 2489 33.140 39.080 14.070 1.00 0.00 ATOM 23082 H1 SOL 2489 33.160 39.270 13.130 1.00 0.00 ATOM 23083 H2 SOL 2489 33.530 39.860 14.480 1.00 0.00 ATOM 23084 OH2 SOL 2490 32.970 6.600 22.160 1.00 0.00 ATOM 23085 H1 SOL 2490 33.620 6.220 22.760 1.00 0.00 ATOM 23086 H2 SOL 2490 33.440 7.310 21.720 1.00 0.00 ATOM 23087 OH2 SOL 2491 31.170 43.160 13.840 1.00 0.00 ATOM 23088 H1 SOL 2491 30.640 43.850 13.440 1.00 0.00 ATOM 23089 H2 SOL 2491 30.900 42.360 13.380 1.00 0.00 ATOM 23090 OH2 SOL 2492 44.210 51.890 24.990 1.00 0.00 ATOM 23091 H1 SOL 2492 44.040 51.460 24.150 1.00 0.00 ATOM 23092 H2 SOL 2492 45.160 51.950 25.040 1.00 0.00 ATOM 23093 OH2 SOL 2493 48.430 44.870 18.680 1.00 0.00 ATOM 23094 H1 SOL 2493 48.180 45.590 19.260 1.00 0.00 ATOM 23095 H2 SOL 2493 48.020 44.100 19.070 1.00 0.00 ATOM 23096 OH2 SOL 2494 30.670 12.830 19.630 1.00 0.00 ATOM 23097 H1 SOL 2494 31.500 12.410 19.430 1.00 0.00 ATOM 23098 H2 SOL 2494 30.910 13.640 20.090 1.00 0.00 ATOM 23099 OH2 SOL 2495 6.770 40.940 72.200 1.00 0.00 ATOM 23100 H1 SOL 2495 6.580 40.060 71.890 1.00 0.00 ATOM 23101 H2 SOL 2495 6.270 41.020 73.010 1.00 0.00 ATOM 23102 OH2 SOL 2496 46.310 29.240 9.050 1.00 0.00 ATOM 23103 H1 SOL 2496 46.920 29.150 8.320 1.00 0.00 ATOM 23104 H2 SOL 2496 45.910 30.100 8.920 1.00 0.00 ATOM 23105 OH2 SOL 2497 5.230 28.830 14.050 1.00 0.00 ATOM 23106 H1 SOL 2497 4.430 28.990 13.550 1.00 0.00 ATOM 23107 H2 SOL 2497 5.130 27.940 14.380 1.00 0.00 ATOM 23108 OH2 SOL 2498 6.870 13.370 70.680 1.00 0.00 ATOM 23109 H1 SOL 2498 7.060 13.200 71.600 1.00 0.00 ATOM 23110 H2 SOL 2498 7.730 13.430 70.260 1.00 0.00 ATOM 23111 OH2 SOL 2499 14.410 23.030 12.830 1.00 0.00 ATOM 23112 H1 SOL 2499 13.650 22.900 13.400 1.00 0.00 ATOM 23113 H2 SOL 2499 14.370 22.310 12.200 1.00 0.00 ATOM 23114 OH2 SOL 2500 7.090 4.460 14.640 1.00 0.00 ATOM 23115 H1 SOL 2500 6.200 4.540 15.000 1.00 0.00 ATOM 23116 H2 SOL 2500 7.660 4.800 15.330 1.00 0.00 ATOM 23117 OH2 SOL 2501 8.440 3.120 12.660 1.00 0.00 ATOM 23118 H1 SOL 2501 8.390 3.420 11.760 1.00 0.00 ATOM 23119 H2 SOL 2501 7.930 3.760 13.160 1.00 0.00 ATOM 23120 OH2 SOL 2502 33.550 39.710 7.740 1.00 0.00 ATOM 23121 H1 SOL 2502 33.410 39.190 6.950 1.00 0.00 ATOM 23122 H2 SOL 2502 33.940 39.090 8.360 1.00 0.00 ATOM 23123 OH2 SOL 2503 0.210 6.940 65.910 1.00 0.00 ATOM 23124 H1 SOL 2503 -0.400 6.720 65.200 1.00 0.00 ATOM 23125 H2 SOL 2503 1.020 7.180 65.460 1.00 0.00 ATOM 23126 OH2 SOL 2504 0.890 19.810 5.290 1.00 0.00 ATOM 23127 H1 SOL 2504 0.840 19.740 4.330 1.00 0.00 ATOM 23128 H2 SOL 2504 0.300 19.130 5.610 1.00 0.00 ATOM 23129 OH2 SOL 2505 53.200 16.900 78.060 1.00 0.00 ATOM 23130 H1 SOL 2505 53.840 16.650 78.730 1.00 0.00 ATOM 23131 H2 SOL 2505 53.730 17.080 77.280 1.00 0.00 ATOM 23132 OH2 SOL 2506 53.330 8.390 11.920 1.00 0.00 ATOM 23133 H1 SOL 2506 52.450 8.220 12.240 1.00 0.00 ATOM 23134 H2 SOL 2506 53.840 8.560 12.720 1.00 0.00 ATOM 23135 OH2 SOL 2507 30.790 35.970 81.060 1.00 0.00 ATOM 23136 H1 SOL 2507 30.830 35.950 80.110 1.00 0.00 ATOM 23137 H2 SOL 2507 30.660 35.060 81.320 1.00 0.00 ATOM 23138 OH2 SOL 2508 21.530 26.000 80.550 1.00 0.00 ATOM 23139 H1 SOL 2508 21.870 25.190 80.180 1.00 0.00 ATOM 23140 H2 SOL 2508 22.140 26.680 80.260 1.00 0.00 ATOM 23141 OH2 SOL 2509 4.620 26.330 15.180 1.00 0.00 ATOM 23142 H1 SOL 2509 5.200 26.300 15.950 1.00 0.00 ATOM 23143 H2 SOL 2509 3.780 26.630 15.520 1.00 0.00 ATOM 23144 OH2 SOL 2510 15.940 35.640 72.040 1.00 0.00 ATOM 23145 H1 SOL 2510 15.780 34.740 72.340 1.00 0.00 ATOM 23146 H2 SOL 2510 15.250 35.810 71.410 1.00 0.00 ATOM 23147 OH2 SOL 2511 10.570 42.400 0.750 1.00 0.00 ATOM 23148 H1 SOL 2511 10.030 42.780 1.450 1.00 0.00 ATOM 23149 H2 SOL 2511 9.940 42.010 0.150 1.00 0.00 ATOM 23150 OH2 SOL 2512 16.880 55.560 20.030 1.00 0.00 ATOM 23151 H1 SOL 2512 17.210 55.610 20.930 1.00 0.00 ATOM 23152 H2 SOL 2512 15.950 55.380 20.130 1.00 0.00 ATOM 23153 OH2 SOL 2513 14.800 7.510 2.800 1.00 0.00 ATOM 23154 H1 SOL 2513 14.420 7.770 1.960 1.00 0.00 ATOM 23155 H2 SOL 2513 15.400 6.800 2.570 1.00 0.00 ATOM 23156 OH2 SOL 2514 21.820 10.390 21.030 1.00 0.00 ATOM 23157 H1 SOL 2514 20.990 10.230 21.460 1.00 0.00 ATOM 23158 H2 SOL 2514 21.680 11.190 20.520 1.00 0.00 ATOM 23159 OH2 SOL 2515 13.070 11.920 3.650 1.00 0.00 ATOM 23160 H1 SOL 2515 13.030 11.330 4.410 1.00 0.00 ATOM 23161 H2 SOL 2515 13.210 12.790 4.040 1.00 0.00 ATOM 23162 OH2 SOL 2516 25.220 46.930 83.920 1.00 0.00 ATOM 23163 H1 SOL 2516 26.150 47.000 84.110 1.00 0.00 ATOM 23164 H2 SOL 2516 25.170 46.320 83.180 1.00 0.00 ATOM 23165 OH2 SOL 2517 34.410 21.090 0.920 1.00 0.00 ATOM 23166 H1 SOL 2517 34.950 20.950 1.710 1.00 0.00 ATOM 23167 H2 SOL 2517 34.700 21.930 0.570 1.00 0.00 ATOM 23168 OH2 SOL 2518 38.530 37.020 70.700 1.00 0.00 ATOM 23169 H1 SOL 2518 38.550 36.560 69.860 1.00 0.00 ATOM 23170 H2 SOL 2518 38.670 36.330 71.350 1.00 0.00 ATOM 23171 OH2 SOL 2519 40.210 2.830 0.660 1.00 0.00 ATOM 23172 H1 SOL 2519 40.360 3.750 0.470 1.00 0.00 ATOM 23173 H2 SOL 2519 39.670 2.520 -0.070 1.00 0.00 ATOM 23174 OH2 SOL 2520 24.420 42.110 15.350 1.00 0.00 ATOM 23175 H1 SOL 2520 23.790 41.680 15.940 1.00 0.00 ATOM 23176 H2 SOL 2520 24.440 43.020 15.640 1.00 0.00 ATOM 23177 OH2 SOL 2521 11.470 3.430 20.530 1.00 0.00 ATOM 23178 H1 SOL 2521 12.400 3.250 20.650 1.00 0.00 ATOM 23179 H2 SOL 2521 11.210 3.870 21.340 1.00 0.00 ATOM 23180 OH2 SOL 2522 43.170 5.010 9.430 1.00 0.00 ATOM 23181 H1 SOL 2522 42.420 4.930 8.840 1.00 0.00 ATOM 23182 H2 SOL 2522 43.590 5.830 9.170 1.00 0.00 ATOM 23183 OH2 SOL 2523 10.780 19.230 69.670 1.00 0.00 ATOM 23184 H1 SOL 2523 9.880 19.110 69.390 1.00 0.00 ATOM 23185 H2 SOL 2523 10.740 19.920 70.330 1.00 0.00 ATOM 23186 OH2 SOL 2524 15.170 37.130 1.360 1.00 0.00 ATOM 23187 H1 SOL 2524 14.520 37.330 2.030 1.00 0.00 ATOM 23188 H2 SOL 2524 15.770 37.880 1.380 1.00 0.00 ATOM 23189 OH2 SOL 2525 47.640 22.150 10.470 1.00 0.00 ATOM 23190 H1 SOL 2525 48.420 21.670 10.190 1.00 0.00 ATOM 23191 H2 SOL 2525 47.160 22.320 9.660 1.00 0.00 ATOM 23192 OH2 SOL 2526 24.160 0.360 8.690 1.00 0.00 ATOM 23193 H1 SOL 2526 24.570 -0.480 8.890 1.00 0.00 ATOM 23194 H2 SOL 2526 23.700 0.600 9.500 1.00 0.00 ATOM 23195 OH2 SOL 2527 54.260 27.460 77.280 1.00 0.00 ATOM 23196 H1 SOL 2527 54.020 28.370 77.100 1.00 0.00 ATOM 23197 H2 SOL 2527 53.980 27.310 78.180 1.00 0.00 ATOM 23198 OH2 SOL 2528 16.620 34.770 4.030 1.00 0.00 ATOM 23199 H1 SOL 2528 16.710 34.940 3.090 1.00 0.00 ATOM 23200 H2 SOL 2528 16.670 33.820 4.110 1.00 0.00 ATOM 23201 OH2 SOL 2529 41.300 57.790 6.670 1.00 0.00 ATOM 23202 H1 SOL 2529 41.660 57.970 7.540 1.00 0.00 ATOM 23203 H2 SOL 2529 42.080 57.670 6.120 1.00 0.00 ATOM 23204 OH2 SOL 2530 29.710 31.550 78.200 1.00 0.00 ATOM 23205 H1 SOL 2530 30.030 30.690 78.460 1.00 0.00 ATOM 23206 H2 SOL 2530 29.010 31.740 78.830 1.00 0.00 ATOM 23207 OH2 SOL 2531 36.730 8.360 6.040 1.00 0.00 ATOM 23208 H1 SOL 2531 36.820 8.240 5.100 1.00 0.00 ATOM 23209 H2 SOL 2531 36.020 7.770 6.290 1.00 0.00 ATOM 23210 OH2 SOL 2532 47.150 16.190 19.740 1.00 0.00 ATOM 23211 H1 SOL 2532 46.940 16.310 20.670 1.00 0.00 ATOM 23212 H2 SOL 2532 47.360 15.260 19.660 1.00 0.00 ATOM 23213 OH2 SOL 2533 26.390 4.600 0.730 1.00 0.00 ATOM 23214 H1 SOL 2533 26.400 5.550 0.750 1.00 0.00 ATOM 23215 H2 SOL 2533 25.470 4.370 0.620 1.00 0.00 ATOM 23216 OH2 SOL 2534 24.970 53.810 1.730 1.00 0.00 ATOM 23217 H1 SOL 2534 25.420 52.960 1.760 1.00 0.00 ATOM 23218 H2 SOL 2534 24.860 54.050 2.640 1.00 0.00 ATOM 23219 OH2 SOL 2535 39.430 14.590 9.120 1.00 0.00 ATOM 23220 H1 SOL 2535 39.530 13.630 9.120 1.00 0.00 ATOM 23221 H2 SOL 2535 38.550 14.740 8.780 1.00 0.00 ATOM 23222 OH2 SOL 2536 16.920 44.040 3.970 1.00 0.00 ATOM 23223 H1 SOL 2536 17.210 44.670 4.620 1.00 0.00 ATOM 23224 H2 SOL 2536 17.520 44.150 3.230 1.00 0.00 ATOM 23225 OH2 SOL 2537 47.100 5.060 72.500 1.00 0.00 ATOM 23226 H1 SOL 2537 46.470 4.340 72.420 1.00 0.00 ATOM 23227 H2 SOL 2537 47.840 4.670 72.960 1.00 0.00 ATOM 23228 OH2 SOL 2538 45.640 34.170 76.160 1.00 0.00 ATOM 23229 H1 SOL 2538 45.900 33.370 76.610 1.00 0.00 ATOM 23230 H2 SOL 2538 45.460 34.790 76.870 1.00 0.00 ATOM 23231 OH2 SOL 2539 24.610 47.850 75.010 1.00 0.00 ATOM 23232 H1 SOL 2539 24.500 47.890 74.060 1.00 0.00 ATOM 23233 H2 SOL 2539 23.760 48.130 75.360 1.00 0.00 ATOM 23234 OH2 SOL 2540 15.610 56.050 13.910 1.00 0.00 ATOM 23235 H1 SOL 2540 16.410 56.480 14.210 1.00 0.00 ATOM 23236 H2 SOL 2540 15.140 56.720 13.420 1.00 0.00 ATOM 23237 OH2 SOL 2541 49.770 50.090 71.210 1.00 0.00 ATOM 23238 H1 SOL 2541 48.900 50.450 71.390 1.00 0.00 ATOM 23239 H2 SOL 2541 49.810 50.030 70.250 1.00 0.00 ATOM 23240 OH2 SOL 2542 34.890 42.970 1.820 1.00 0.00 ATOM 23241 H1 SOL 2542 35.710 42.690 2.240 1.00 0.00 ATOM 23242 H2 SOL 2542 34.790 42.370 1.080 1.00 0.00 ATOM 23243 OH2 SOL 2543 53.950 18.750 22.590 1.00 0.00 ATOM 23244 H1 SOL 2543 54.780 19.150 22.850 1.00 0.00 ATOM 23245 H2 SOL 2543 53.410 18.790 23.380 1.00 0.00 ATOM 23246 OH2 SOL 2544 11.150 33.570 7.820 1.00 0.00 ATOM 23247 H1 SOL 2544 11.730 34.280 8.100 1.00 0.00 ATOM 23248 H2 SOL 2544 11.180 32.940 8.540 1.00 0.00 ATOM 23249 OH2 SOL 2545 33.340 7.330 81.710 1.00 0.00 ATOM 23250 H1 SOL 2545 33.070 6.680 82.350 1.00 0.00 ATOM 23251 H2 SOL 2545 32.680 7.280 81.020 1.00 0.00 ATOM 23252 OH2 SOL 2546 26.650 1.730 71.620 1.00 0.00 ATOM 23253 H1 SOL 2546 27.130 1.610 70.800 1.00 0.00 ATOM 23254 H2 SOL 2546 27.170 2.380 72.100 1.00 0.00 ATOM 23255 OH2 SOL 2547 25.110 43.600 22.130 1.00 0.00 ATOM 23256 H1 SOL 2547 25.280 44.350 22.700 1.00 0.00 ATOM 23257 H2 SOL 2547 24.160 43.600 22.010 1.00 0.00 ATOM 23258 OH2 SOL 2548 38.090 13.600 63.170 1.00 0.00 ATOM 23259 H1 SOL 2548 38.820 13.630 63.790 1.00 0.00 ATOM 23260 H2 SOL 2548 37.800 14.510 63.100 1.00 0.00 ATOM 23261 OH2 SOL 2549 50.620 39.300 16.370 1.00 0.00 ATOM 23262 H1 SOL 2549 50.910 40.060 15.860 1.00 0.00 ATOM 23263 H2 SOL 2549 49.990 38.860 15.800 1.00 0.00 ATOM 23264 OH2 SOL 2550 25.730 46.260 4.800 1.00 0.00 ATOM 23265 H1 SOL 2550 26.440 46.480 4.190 1.00 0.00 ATOM 23266 H2 SOL 2550 25.210 47.060 4.860 1.00 0.00 ATOM 23267 OH2 SOL 2551 8.180 1.680 72.140 1.00 0.00 ATOM 23268 H1 SOL 2551 7.430 1.100 72.050 1.00 0.00 ATOM 23269 H2 SOL 2551 7.910 2.490 71.690 1.00 0.00 ATOM 23270 OH2 SOL 2552 13.400 3.470 71.570 1.00 0.00 ATOM 23271 H1 SOL 2552 13.310 2.600 71.170 1.00 0.00 ATOM 23272 H2 SOL 2552 13.040 4.070 70.910 1.00 0.00 ATOM 23273 OH2 SOL 2553 24.010 26.810 79.750 1.00 0.00 ATOM 23274 H1 SOL 2553 24.640 26.090 79.760 1.00 0.00 ATOM 23275 H2 SOL 2553 24.240 27.320 78.970 1.00 0.00 ATOM 23276 OH2 SOL 2554 61.020 24.190 72.820 1.00 0.00 ATOM 23277 H1 SOL 2554 61.930 23.900 72.800 1.00 0.00 ATOM 23278 H2 SOL 2554 60.520 23.400 73.020 1.00 0.00 ATOM 23279 OH2 SOL 2555 42.720 39.060 66.510 1.00 0.00 ATOM 23280 H1 SOL 2555 43.660 39.080 66.330 1.00 0.00 ATOM 23281 H2 SOL 2555 42.330 38.700 65.720 1.00 0.00 ATOM 23282 OH2 SOL 2556 42.810 14.770 20.740 1.00 0.00 ATOM 23283 H1 SOL 2556 42.010 14.970 20.260 1.00 0.00 ATOM 23284 H2 SOL 2556 43.380 15.530 20.590 1.00 0.00 ATOM 23285 OH2 SOL 2557 52.580 16.420 81.790 1.00 0.00 ATOM 23286 H1 SOL 2557 53.430 16.100 81.500 1.00 0.00 ATOM 23287 H2 SOL 2557 52.700 17.370 81.880 1.00 0.00 ATOM 23288 OH2 SOL 2558 43.750 50.450 8.920 1.00 0.00 ATOM 23289 H1 SOL 2558 44.470 50.040 8.430 1.00 0.00 ATOM 23290 H2 SOL 2558 43.050 49.790 8.900 1.00 0.00 ATOM 23291 OH2 SOL 2559 7.090 51.460 18.640 1.00 0.00 ATOM 23292 H1 SOL 2559 7.760 51.960 18.170 1.00 0.00 ATOM 23293 H2 SOL 2559 7.400 50.550 18.610 1.00 0.00 ATOM 23294 OH2 SOL 2560 28.020 17.120 78.060 1.00 0.00 ATOM 23295 H1 SOL 2560 28.910 16.780 78.120 1.00 0.00 ATOM 23296 H2 SOL 2560 28.120 18.060 77.900 1.00 0.00 ATOM 23297 OH2 SOL 2561 55.070 23.540 14.980 1.00 0.00 ATOM 23298 H1 SOL 2561 54.240 23.880 15.340 1.00 0.00 ATOM 23299 H2 SOL 2561 54.850 23.280 14.090 1.00 0.00 ATOM 23300 OH2 SOL 2562 10.390 1.140 12.760 1.00 0.00 ATOM 23301 H1 SOL 2562 9.770 1.870 12.810 1.00 0.00 ATOM 23302 H2 SOL 2562 10.000 0.550 12.110 1.00 0.00 ATOM 23303 OH2 SOL 2563 26.610 41.620 27.580 1.00 0.00 ATOM 23304 H1 SOL 2563 27.120 41.450 28.370 1.00 0.00 ATOM 23305 H2 SOL 2563 25.720 41.340 27.790 1.00 0.00 ATOM 23306 OH2 SOL 2564 30.820 6.800 83.880 1.00 0.00 ATOM 23307 H1 SOL 2564 31.470 6.160 83.590 1.00 0.00 ATOM 23308 H2 SOL 2564 29.990 6.470 83.550 1.00 0.00 ATOM 23309 OH2 SOL 2565 11.720 42.520 13.640 1.00 0.00 ATOM 23310 H1 SOL 2565 12.620 42.630 13.340 1.00 0.00 ATOM 23311 H2 SOL 2565 11.700 42.890 14.520 1.00 0.00 ATOM 23312 OH2 SOL 2566 13.760 42.180 0.740 1.00 0.00 ATOM 23313 H1 SOL 2566 13.570 41.280 0.470 1.00 0.00 ATOM 23314 H2 SOL 2566 12.910 42.520 1.020 1.00 0.00 ATOM 23315 OH2 SOL 2567 35.510 17.730 73.590 1.00 0.00 ATOM 23316 H1 SOL 2567 34.570 17.560 73.660 1.00 0.00 ATOM 23317 H2 SOL 2567 35.630 18.070 72.710 1.00 0.00 ATOM 23318 OH2 SOL 2568 20.010 24.690 18.260 1.00 0.00 ATOM 23319 H1 SOL 2568 20.510 24.600 19.070 1.00 0.00 ATOM 23320 H2 SOL 2568 20.470 25.360 17.760 1.00 0.00 ATOM 23321 OH2 SOL 2569 5.830 37.730 15.620 1.00 0.00 ATOM 23322 H1 SOL 2569 5.920 38.340 16.360 1.00 0.00 ATOM 23323 H2 SOL 2569 4.900 37.740 15.400 1.00 0.00 ATOM 23324 OH2 SOL 2570 18.680 27.260 9.280 1.00 0.00 ATOM 23325 H1 SOL 2570 17.910 26.730 9.100 1.00 0.00 ATOM 23326 H2 SOL 2570 18.340 28.050 9.710 1.00 0.00 ATOM 23327 OH2 SOL 2571 2.840 15.400 7.760 1.00 0.00 ATOM 23328 H1 SOL 2571 1.940 15.680 7.550 1.00 0.00 ATOM 23329 H2 SOL 2571 3.390 16.020 7.290 1.00 0.00 ATOM 23330 OH2 SOL 2572 41.140 21.130 11.950 1.00 0.00 ATOM 23331 H1 SOL 2572 40.200 20.980 11.860 1.00 0.00 ATOM 23332 H2 SOL 2572 41.450 21.300 11.060 1.00 0.00 ATOM 23333 OH2 SOL 2573 56.030 4.290 6.410 1.00 0.00 ATOM 23334 H1 SOL 2573 55.750 4.460 7.310 1.00 0.00 ATOM 23335 H2 SOL 2573 56.240 5.160 6.060 1.00 0.00 ATOM 23336 OH2 SOL 2574 4.530 19.880 11.260 1.00 0.00 ATOM 23337 H1 SOL 2574 3.570 19.790 11.230 1.00 0.00 ATOM 23338 H2 SOL 2574 4.840 19.300 10.560 1.00 0.00 ATOM 23339 OH2 SOL 2575 28.540 49.630 62.680 1.00 0.00 ATOM 23340 H1 SOL 2575 28.830 49.570 61.760 1.00 0.00 ATOM 23341 H2 SOL 2575 28.220 50.520 62.770 1.00 0.00 ATOM 23342 OH2 SOL 2576 51.850 26.690 76.330 1.00 0.00 ATOM 23343 H1 SOL 2576 52.710 26.970 76.640 1.00 0.00 ATOM 23344 H2 SOL 2576 51.640 27.300 75.620 1.00 0.00 ATOM 23345 OH2 SOL 2577 39.480 43.400 21.220 1.00 0.00 ATOM 23346 H1 SOL 2577 40.090 44.100 20.980 1.00 0.00 ATOM 23347 H2 SOL 2577 38.630 43.700 20.880 1.00 0.00 ATOM 23348 OH2 SOL 2578 33.520 36.950 77.350 1.00 0.00 ATOM 23349 H1 SOL 2578 34.220 37.200 77.950 1.00 0.00 ATOM 23350 H2 SOL 2578 33.930 36.950 76.490 1.00 0.00 ATOM 23351 OH2 SOL 2579 15.420 58.430 24.640 1.00 0.00 ATOM 23352 H1 SOL 2579 15.400 58.070 23.750 1.00 0.00 ATOM 23353 H2 SOL 2579 14.640 58.990 24.690 1.00 0.00 ATOM 23354 OH2 SOL 2580 32.870 46.970 72.860 1.00 0.00 ATOM 23355 H1 SOL 2580 32.160 47.260 72.280 1.00 0.00 ATOM 23356 H2 SOL 2580 32.920 47.640 73.540 1.00 0.00 ATOM 23357 OH2 SOL 2581 0.250 52.580 80.150 1.00 0.00 ATOM 23358 H1 SOL 2581 0.690 52.120 79.430 1.00 0.00 ATOM 23359 H2 SOL 2581 -0.450 53.070 79.720 1.00 0.00 ATOM 23360 OH2 SOL 2582 32.910 32.720 80.770 1.00 0.00 ATOM 23361 H1 SOL 2582 32.700 32.850 79.850 1.00 0.00 ATOM 23362 H2 SOL 2582 33.360 33.530 81.030 1.00 0.00 ATOM 23363 OH2 SOL 2583 1.960 8.500 72.460 1.00 0.00 ATOM 23364 H1 SOL 2583 1.420 7.900 72.970 1.00 0.00 ATOM 23365 H2 SOL 2583 2.810 8.070 72.390 1.00 0.00 ATOM 23366 OH2 SOL 2584 11.330 9.280 10.030 1.00 0.00 ATOM 23367 H1 SOL 2584 11.470 9.040 9.110 1.00 0.00 ATOM 23368 H2 SOL 2584 10.380 9.190 10.150 1.00 0.00 ATOM 23369 OH2 SOL 2585 36.500 46.620 72.200 1.00 0.00 ATOM 23370 H1 SOL 2585 35.900 46.300 71.530 1.00 0.00 ATOM 23371 H2 SOL 2585 35.980 46.630 73.010 1.00 0.00 ATOM 23372 OH2 SOL 2586 29.050 23.460 72.540 1.00 0.00 ATOM 23373 H1 SOL 2586 29.780 23.800 73.050 1.00 0.00 ATOM 23374 H2 SOL 2586 29.330 23.540 71.630 1.00 0.00 ATOM 23375 OH2 SOL 2587 41.100 29.180 6.180 1.00 0.00 ATOM 23376 H1 SOL 2587 41.400 28.710 6.960 1.00 0.00 ATOM 23377 H2 SOL 2587 41.740 28.940 5.500 1.00 0.00 ATOM 23378 OH2 SOL 2588 29.700 23.610 22.540 1.00 0.00 ATOM 23379 H1 SOL 2588 28.760 23.500 22.690 1.00 0.00 ATOM 23380 H2 SOL 2588 30.030 22.710 22.460 1.00 0.00 ATOM 23381 OH2 SOL 2589 14.910 50.270 80.650 1.00 0.00 ATOM 23382 H1 SOL 2589 15.630 50.690 80.180 1.00 0.00 ATOM 23383 H2 SOL 2589 15.320 49.900 81.430 1.00 0.00 ATOM 23384 OH2 SOL 2590 57.610 51.340 1.690 1.00 0.00 ATOM 23385 H1 SOL 2590 58.240 51.950 1.300 1.00 0.00 ATOM 23386 H2 SOL 2590 57.860 51.300 2.620 1.00 0.00 ATOM 23387 OH2 SOL 2591 28.330 45.330 8.270 1.00 0.00 ATOM 23388 H1 SOL 2591 28.760 45.340 7.410 1.00 0.00 ATOM 23389 H2 SOL 2591 28.270 46.250 8.520 1.00 0.00 ATOM 23390 OH2 SOL 2592 42.220 28.320 73.190 1.00 0.00 ATOM 23391 H1 SOL 2592 43.130 28.580 73.330 1.00 0.00 ATOM 23392 H2 SOL 2592 42.280 27.380 72.990 1.00 0.00 ATOM 23393 OH2 SOL 2593 57.580 56.020 1.920 1.00 0.00 ATOM 23394 H1 SOL 2593 56.650 55.780 1.880 1.00 0.00 ATOM 23395 H2 SOL 2593 57.900 55.590 2.710 1.00 0.00 ATOM 23396 OH2 SOL 2594 20.030 1.810 3.770 1.00 0.00 ATOM 23397 H1 SOL 2594 19.280 2.300 4.090 1.00 0.00 ATOM 23398 H2 SOL 2594 20.750 2.070 4.350 1.00 0.00 ATOM 23399 OH2 SOL 2595 20.560 6.510 19.910 1.00 0.00 ATOM 23400 H1 SOL 2595 20.010 7.090 19.380 1.00 0.00 ATOM 23401 H2 SOL 2595 20.780 7.020 20.690 1.00 0.00 ATOM 23402 OH2 SOL 2596 42.190 50.300 69.230 1.00 0.00 ATOM 23403 H1 SOL 2596 42.790 50.840 69.750 1.00 0.00 ATOM 23404 H2 SOL 2596 42.740 49.900 68.560 1.00 0.00 ATOM 23405 OH2 SOL 2597 18.290 13.180 12.540 1.00 0.00 ATOM 23406 H1 SOL 2597 18.370 12.880 11.640 1.00 0.00 ATOM 23407 H2 SOL 2597 18.920 12.650 13.030 1.00 0.00 ATOM 23408 OH2 SOL 2598 60.600 18.560 70.010 1.00 0.00 ATOM 23409 H1 SOL 2598 60.130 17.770 69.750 1.00 0.00 ATOM 23410 H2 SOL 2598 61.040 18.850 69.210 1.00 0.00 ATOM 23411 OH2 SOL 2599 34.520 23.550 15.340 1.00 0.00 ATOM 23412 H1 SOL 2599 33.820 23.450 15.990 1.00 0.00 ATOM 23413 H2 SOL 2599 35.140 24.150 15.740 1.00 0.00 ATOM 23414 OH2 SOL 2600 40.240 23.340 5.160 1.00 0.00 ATOM 23415 H1 SOL 2600 40.210 23.850 4.350 1.00 0.00 ATOM 23416 H2 SOL 2600 41.050 23.610 5.590 1.00 0.00 ATOM 23417 OH2 SOL 2601 4.080 6.660 12.110 1.00 0.00 ATOM 23418 H1 SOL 2601 4.640 6.280 11.440 1.00 0.00 ATOM 23419 H2 SOL 2601 3.620 7.370 11.670 1.00 0.00 ATOM 23420 OH2 SOL 2602 21.870 14.060 11.960 1.00 0.00 ATOM 23421 H1 SOL 2602 21.470 13.310 11.540 1.00 0.00 ATOM 23422 H2 SOL 2602 21.360 14.810 11.660 1.00 0.00 ATOM 23423 OH2 SOL 2603 27.760 1.010 67.350 1.00 0.00 ATOM 23424 H1 SOL 2603 27.510 0.100 67.160 1.00 0.00 ATOM 23425 H2 SOL 2603 27.040 1.530 67.000 1.00 0.00 ATOM 23426 OH2 SOL 2604 20.460 5.080 14.170 1.00 0.00 ATOM 23427 H1 SOL 2604 20.070 4.620 13.420 1.00 0.00 ATOM 23428 H2 SOL 2604 21.130 4.480 14.500 1.00 0.00 ATOM 23429 OH2 SOL 2605 13.100 50.610 78.550 1.00 0.00 ATOM 23430 H1 SOL 2605 13.030 50.040 77.780 1.00 0.00 ATOM 23431 H2 SOL 2605 13.580 50.080 79.190 1.00 0.00 ATOM 23432 OH2 SOL 2606 45.790 23.790 78.270 1.00 0.00 ATOM 23433 H1 SOL 2606 46.700 23.560 78.430 1.00 0.00 ATOM 23434 H2 SOL 2606 45.330 23.510 79.060 1.00 0.00 ATOM 23435 OH2 SOL 2607 42.330 32.190 74.020 1.00 0.00 ATOM 23436 H1 SOL 2607 42.940 32.460 73.340 1.00 0.00 ATOM 23437 H2 SOL 2607 41.570 31.850 73.550 1.00 0.00 ATOM 23438 OH2 SOL 2608 23.470 21.930 23.160 1.00 0.00 ATOM 23439 H1 SOL 2608 23.680 22.370 22.340 1.00 0.00 ATOM 23440 H2 SOL 2608 23.310 21.020 22.920 1.00 0.00 ATOM 23441 OH2 SOL 2609 23.770 49.470 83.330 1.00 0.00 ATOM 23442 H1 SOL 2609 24.470 49.030 83.810 1.00 0.00 ATOM 23443 H2 SOL 2609 24.080 50.370 83.220 1.00 0.00 ATOM 23444 OH2 SOL 2610 11.250 39.550 23.990 1.00 0.00 ATOM 23445 H1 SOL 2610 12.070 39.580 24.470 1.00 0.00 ATOM 23446 H2 SOL 2610 11.120 38.620 23.790 1.00 0.00 ATOM 23447 OH2 SOL 2611 58.560 19.290 28.480 1.00 0.00 ATOM 23448 H1 SOL 2611 58.770 18.740 29.240 1.00 0.00 ATOM 23449 H2 SOL 2611 59.400 19.410 28.030 1.00 0.00 ATOM 23450 OH2 SOL 2612 21.670 17.680 80.040 1.00 0.00 ATOM 23451 H1 SOL 2612 22.020 16.810 80.220 1.00 0.00 ATOM 23452 H2 SOL 2612 22.400 18.160 79.630 1.00 0.00 ATOM 23453 OH2 SOL 2613 38.730 55.050 24.170 1.00 0.00 ATOM 23454 H1 SOL 2613 39.150 54.260 24.520 1.00 0.00 ATOM 23455 H2 SOL 2613 38.080 54.710 23.550 1.00 0.00 ATOM 23456 OH2 SOL 2614 46.180 25.620 73.360 1.00 0.00 ATOM 23457 H1 SOL 2614 46.750 26.380 73.260 1.00 0.00 ATOM 23458 H2 SOL 2614 45.290 25.970 73.260 1.00 0.00 ATOM 23459 OH2 SOL 2615 50.250 45.510 26.760 1.00 0.00 ATOM 23460 H1 SOL 2615 50.300 46.380 26.350 1.00 0.00 ATOM 23461 H2 SOL 2615 49.660 45.630 27.500 1.00 0.00 ATOM 23462 OH2 SOL 2616 7.420 32.630 71.860 1.00 0.00 ATOM 23463 H1 SOL 2616 6.950 33.420 72.100 1.00 0.00 ATOM 23464 H2 SOL 2616 8.280 32.720 72.270 1.00 0.00 ATOM 23465 OH2 SOL 2617 60.900 47.160 14.580 1.00 0.00 ATOM 23466 H1 SOL 2617 61.550 47.410 13.920 1.00 0.00 ATOM 23467 H2 SOL 2617 60.690 46.240 14.380 1.00 0.00 ATOM 23468 OH2 SOL 2618 12.050 58.040 2.060 1.00 0.00 ATOM 23469 H1 SOL 2618 12.770 58.670 1.980 1.00 0.00 ATOM 23470 H2 SOL 2618 11.620 58.060 1.200 1.00 0.00 ATOM 23471 OH2 SOL 2619 22.120 10.710 17.320 1.00 0.00 ATOM 23472 H1 SOL 2619 21.800 9.830 17.100 1.00 0.00 ATOM 23473 H2 SOL 2619 23.070 10.630 17.260 1.00 0.00 ATOM 23474 OH2 SOL 2620 2.020 43.960 15.350 1.00 0.00 ATOM 23475 H1 SOL 2620 1.140 44.190 15.040 1.00 0.00 ATOM 23476 H2 SOL 2620 2.160 44.520 16.110 1.00 0.00 ATOM 23477 OH2 SOL 2621 32.600 19.820 14.820 1.00 0.00 ATOM 23478 H1 SOL 2621 32.760 20.240 15.670 1.00 0.00 ATOM 23479 H2 SOL 2621 32.990 18.950 14.910 1.00 0.00 ATOM 23480 OH2 SOL 2622 3.570 48.020 10.930 1.00 0.00 ATOM 23481 H1 SOL 2622 4.270 47.660 11.480 1.00 0.00 ATOM 23482 H2 SOL 2622 3.230 48.760 11.440 1.00 0.00 ATOM 23483 OH2 SOL 2623 57.940 20.730 77.140 1.00 0.00 ATOM 23484 H1 SOL 2623 57.590 21.610 77.000 1.00 0.00 ATOM 23485 H2 SOL 2623 58.160 20.420 76.260 1.00 0.00 ATOM 23486 OH2 SOL 2624 49.730 23.310 13.190 1.00 0.00 ATOM 23487 H1 SOL 2624 50.350 22.720 12.760 1.00 0.00 ATOM 23488 H2 SOL 2624 49.430 23.890 12.500 1.00 0.00 ATOM 23489 OH2 SOL 2625 59.610 13.490 69.190 1.00 0.00 ATOM 23490 H1 SOL 2625 59.060 13.890 68.520 1.00 0.00 ATOM 23491 H2 SOL 2625 60.350 14.090 69.280 1.00 0.00 ATOM 23492 OH2 SOL 2626 38.690 46.340 19.070 1.00 0.00 ATOM 23493 H1 SOL 2626 38.290 47.210 18.990 1.00 0.00 ATOM 23494 H2 SOL 2626 39.410 46.450 19.690 1.00 0.00 ATOM 23495 OH2 SOL 2627 10.740 5.820 22.060 1.00 0.00 ATOM 23496 H1 SOL 2627 11.030 6.440 21.390 1.00 0.00 ATOM 23497 H2 SOL 2627 9.830 6.070 22.240 1.00 0.00 ATOM 23498 OH2 SOL 2628 60.270 26.790 18.140 1.00 0.00 ATOM 23499 H1 SOL 2628 60.710 26.950 17.310 1.00 0.00 ATOM 23500 H2 SOL 2628 60.570 27.490 18.710 1.00 0.00 ATOM 23501 OH2 SOL 2629 39.540 54.500 69.870 1.00 0.00 ATOM 23502 H1 SOL 2629 39.620 54.440 70.820 1.00 0.00 ATOM 23503 H2 SOL 2629 38.740 55.000 69.720 1.00 0.00 ATOM 23504 OH2 SOL 2630 21.320 48.550 17.240 1.00 0.00 ATOM 23505 H1 SOL 2630 21.310 49.180 16.530 1.00 0.00 ATOM 23506 H2 SOL 2630 20.560 48.770 17.780 1.00 0.00 ATOM 23507 OH2 SOL 2631 36.940 21.020 12.390 1.00 0.00 ATOM 23508 H1 SOL 2631 36.990 20.580 11.540 1.00 0.00 ATOM 23509 H2 SOL 2631 36.130 20.710 12.780 1.00 0.00 ATOM 23510 OH2 SOL 2632 43.460 32.520 65.820 1.00 0.00 ATOM 23511 H1 SOL 2632 43.610 31.610 66.060 1.00 0.00 ATOM 23512 H2 SOL 2632 43.190 32.940 66.640 1.00 0.00 ATOM 23513 OH2 SOL 2633 46.370 18.030 5.360 1.00 0.00 ATOM 23514 H1 SOL 2633 46.360 17.100 5.120 1.00 0.00 ATOM 23515 H2 SOL 2633 46.260 18.490 4.520 1.00 0.00 ATOM 23516 OH2 SOL 2634 33.430 18.910 68.440 1.00 0.00 ATOM 23517 H1 SOL 2634 33.480 19.310 67.570 1.00 0.00 ATOM 23518 H2 SOL 2634 33.460 17.970 68.270 1.00 0.00 ATOM 23519 OH2 SOL 2635 29.440 29.380 14.040 1.00 0.00 ATOM 23520 H1 SOL 2635 29.570 29.590 13.120 1.00 0.00 ATOM 23521 H2 SOL 2635 30.300 29.520 14.440 1.00 0.00 ATOM 23522 OH2 SOL 2636 57.620 25.150 81.840 1.00 0.00 ATOM 23523 H1 SOL 2636 58.560 25.020 81.730 1.00 0.00 ATOM 23524 H2 SOL 2636 57.210 24.490 81.280 1.00 0.00 ATOM 23525 OH2 SOL 2637 12.860 52.520 80.480 1.00 0.00 ATOM 23526 H1 SOL 2637 13.590 52.120 80.960 1.00 0.00 ATOM 23527 H2 SOL 2637 12.900 52.120 79.610 1.00 0.00 ATOM 23528 OH2 SOL 2638 37.230 3.850 5.660 1.00 0.00 ATOM 23529 H1 SOL 2638 36.300 3.750 5.460 1.00 0.00 ATOM 23530 H2 SOL 2638 37.670 3.230 5.070 1.00 0.00 ATOM 23531 OH2 SOL 2639 46.640 4.600 76.710 1.00 0.00 ATOM 23532 H1 SOL 2639 47.090 3.770 76.550 1.00 0.00 ATOM 23533 H2 SOL 2639 45.850 4.550 76.160 1.00 0.00 ATOM 23534 OH2 SOL 2640 36.550 14.790 17.610 1.00 0.00 ATOM 23535 H1 SOL 2640 36.400 14.390 16.760 1.00 0.00 ATOM 23536 H2 SOL 2640 37.170 15.510 17.440 1.00 0.00 ATOM 23537 OH2 SOL 2641 2.960 1.380 68.410 1.00 0.00 ATOM 23538 H1 SOL 2641 2.050 1.600 68.600 1.00 0.00 ATOM 23539 H2 SOL 2641 3.190 1.920 67.660 1.00 0.00 ATOM 23540 OH2 SOL 2642 22.660 52.230 2.650 1.00 0.00 ATOM 23541 H1 SOL 2642 22.480 52.310 3.580 1.00 0.00 ATOM 23542 H2 SOL 2642 23.520 51.810 2.610 1.00 0.00 ATOM 23543 OH2 SOL 2643 35.130 50.130 71.960 1.00 0.00 ATOM 23544 H1 SOL 2643 35.180 50.930 71.430 1.00 0.00 ATOM 23545 H2 SOL 2643 35.600 50.360 72.760 1.00 0.00 ATOM 23546 OH2 SOL 2644 10.540 27.560 0.600 1.00 0.00 ATOM 23547 H1 SOL 2644 10.780 27.300 -0.290 1.00 0.00 ATOM 23548 H2 SOL 2644 9.600 27.760 0.550 1.00 0.00 ATOM 23549 OH2 SOL 2645 58.580 30.880 8.310 1.00 0.00 ATOM 23550 H1 SOL 2645 58.580 30.060 7.820 1.00 0.00 ATOM 23551 H2 SOL 2645 58.930 30.650 9.180 1.00 0.00 ATOM 23552 OH2 SOL 2646 43.950 4.940 2.010 1.00 0.00 ATOM 23553 H1 SOL 2646 43.620 4.960 2.910 1.00 0.00 ATOM 23554 H2 SOL 2646 44.190 5.840 1.820 1.00 0.00 ATOM 23555 OH2 SOL 2647 60.200 2.270 7.350 1.00 0.00 ATOM 23556 H1 SOL 2647 60.940 2.770 7.020 1.00 0.00 ATOM 23557 H2 SOL 2647 60.450 1.360 7.240 1.00 0.00 ATOM 23558 OH2 SOL 2648 2.360 10.800 17.020 1.00 0.00 ATOM 23559 H1 SOL 2648 2.490 11.740 17.100 1.00 0.00 ATOM 23560 H2 SOL 2648 1.920 10.690 16.170 1.00 0.00 ATOM 23561 OH2 SOL 2649 52.440 35.960 68.390 1.00 0.00 ATOM 23562 H1 SOL 2649 51.900 35.210 68.120 1.00 0.00 ATOM 23563 H2 SOL 2649 51.990 36.720 68.030 1.00 0.00 ATOM 23564 OH2 SOL 2650 36.690 44.160 14.550 1.00 0.00 ATOM 23565 H1 SOL 2650 37.100 43.370 14.910 1.00 0.00 ATOM 23566 H2 SOL 2650 36.150 44.490 15.270 1.00 0.00 ATOM 23567 OH2 SOL 2651 56.110 51.320 81.450 1.00 0.00 ATOM 23568 H1 SOL 2651 56.860 51.410 80.870 1.00 0.00 ATOM 23569 H2 SOL 2651 55.960 50.380 81.510 1.00 0.00 ATOM 23570 OH2 SOL 2652 44.140 21.990 21.620 1.00 0.00 ATOM 23571 H1 SOL 2652 44.060 21.390 20.880 1.00 0.00 ATOM 23572 H2 SOL 2652 43.590 21.610 22.300 1.00 0.00 ATOM 23573 OH2 SOL 2653 50.850 52.290 0.400 1.00 0.00 ATOM 23574 H1 SOL 2653 51.250 52.670 1.180 1.00 0.00 ATOM 23575 H2 SOL 2653 50.140 51.740 0.730 1.00 0.00 ATOM 23576 OH2 SOL 2654 5.140 9.610 5.110 1.00 0.00 ATOM 23577 H1 SOL 2654 5.860 8.990 5.180 1.00 0.00 ATOM 23578 H2 SOL 2654 5.570 10.470 5.040 1.00 0.00 ATOM 23579 OH2 SOL 2655 6.220 36.250 18.760 1.00 0.00 ATOM 23580 H1 SOL 2655 7.040 35.940 18.380 1.00 0.00 ATOM 23581 H2 SOL 2655 6.320 37.200 18.820 1.00 0.00 ATOM 23582 OH2 SOL 2656 2.150 41.750 72.780 1.00 0.00 ATOM 23583 H1 SOL 2656 1.800 42.520 73.230 1.00 0.00 ATOM 23584 H2 SOL 2656 2.840 42.100 72.210 1.00 0.00 ATOM 23585 OH2 SOL 2657 26.380 6.930 70.110 1.00 0.00 ATOM 23586 H1 SOL 2657 26.620 6.240 69.490 1.00 0.00 ATOM 23587 H2 SOL 2657 26.030 7.640 69.560 1.00 0.00 ATOM 23588 OH2 SOL 2658 36.840 31.960 23.620 1.00 0.00 ATOM 23589 H1 SOL 2658 36.150 31.980 24.290 1.00 0.00 ATOM 23590 H2 SOL 2658 36.370 31.850 22.790 1.00 0.00 ATOM 23591 OH2 SOL 2659 56.200 41.380 71.220 1.00 0.00 ATOM 23592 H1 SOL 2659 55.470 41.980 71.090 1.00 0.00 ATOM 23593 H2 SOL 2659 56.140 41.120 72.140 1.00 0.00 ATOM 23594 OH2 SOL 2660 54.580 9.210 66.910 1.00 0.00 ATOM 23595 H1 SOL 2660 55.210 9.930 66.850 1.00 0.00 ATOM 23596 H2 SOL 2660 54.020 9.440 67.650 1.00 0.00 ATOM 23597 OH2 SOL 2661 9.490 41.420 20.690 1.00 0.00 ATOM 23598 H1 SOL 2661 9.660 42.130 21.320 1.00 0.00 ATOM 23599 H2 SOL 2661 8.540 41.390 20.610 1.00 0.00 ATOM 23600 OH2 SOL 2662 12.800 51.340 0.880 1.00 0.00 ATOM 23601 H1 SOL 2662 12.950 50.470 1.260 1.00 0.00 ATOM 23602 H2 SOL 2662 12.000 51.650 1.310 1.00 0.00 ATOM 23603 OH2 SOL 2663 22.630 50.920 80.060 1.00 0.00 ATOM 23604 H1 SOL 2663 23.480 51.280 80.300 1.00 0.00 ATOM 23605 H2 SOL 2663 22.840 50.170 79.500 1.00 0.00 ATOM 23606 OH2 SOL 2664 1.470 10.720 77.750 1.00 0.00 ATOM 23607 H1 SOL 2664 1.160 11.610 77.580 1.00 0.00 ATOM 23608 H2 SOL 2664 2.240 10.620 77.190 1.00 0.00 ATOM 23609 OH2 SOL 2665 48.670 20.380 4.790 1.00 0.00 ATOM 23610 H1 SOL 2665 48.020 19.780 4.410 1.00 0.00 ATOM 23611 H2 SOL 2665 49.240 20.610 4.050 1.00 0.00 ATOM 23612 OH2 SOL 2666 54.340 45.700 9.950 1.00 0.00 ATOM 23613 H1 SOL 2666 54.720 44.850 9.730 1.00 0.00 ATOM 23614 H2 SOL 2666 54.740 46.320 9.340 1.00 0.00 ATOM 23615 OH2 SOL 2667 25.540 34.020 77.400 1.00 0.00 ATOM 23616 H1 SOL 2667 25.980 33.940 76.550 1.00 0.00 ATOM 23617 H2 SOL 2667 26.170 34.480 77.960 1.00 0.00 ATOM 23618 OH2 SOL 2668 7.130 20.850 14.400 1.00 0.00 ATOM 23619 H1 SOL 2668 7.930 21.240 14.060 1.00 0.00 ATOM 23620 H2 SOL 2668 6.540 21.590 14.550 1.00 0.00 ATOM 23621 OH2 SOL 2669 49.330 54.480 83.130 1.00 0.00 ATOM 23622 H1 SOL 2669 49.910 53.790 83.450 1.00 0.00 ATOM 23623 H2 SOL 2669 48.470 54.270 83.510 1.00 0.00 ATOM 23624 OH2 SOL 2670 53.550 17.190 7.770 1.00 0.00 ATOM 23625 H1 SOL 2670 53.110 17.360 6.940 1.00 0.00 ATOM 23626 H2 SOL 2670 54.030 18.000 7.950 1.00 0.00 ATOM 23627 OH2 SOL 2671 57.030 53.620 70.210 1.00 0.00 ATOM 23628 H1 SOL 2671 57.620 53.530 70.950 1.00 0.00 ATOM 23629 H2 SOL 2671 56.170 53.800 70.600 1.00 0.00 ATOM 23630 OH2 SOL 2672 57.060 20.990 82.300 1.00 0.00 ATOM 23631 H1 SOL 2672 58.000 21.150 82.280 1.00 0.00 ATOM 23632 H2 SOL 2672 56.750 21.250 81.430 1.00 0.00 ATOM 23633 OH2 SOL 2673 55.300 47.530 8.400 1.00 0.00 ATOM 23634 H1 SOL 2673 55.440 48.400 8.780 1.00 0.00 ATOM 23635 H2 SOL 2673 54.680 47.680 7.680 1.00 0.00 ATOM 23636 OH2 SOL 2674 27.010 34.710 75.070 1.00 0.00 ATOM 23637 H1 SOL 2674 27.920 34.970 75.180 1.00 0.00 ATOM 23638 H2 SOL 2674 26.590 35.470 74.670 1.00 0.00 ATOM 23639 OH2 SOL 2675 24.640 29.770 8.110 1.00 0.00 ATOM 23640 H1 SOL 2675 24.120 30.510 7.790 1.00 0.00 ATOM 23641 H2 SOL 2675 24.480 29.760 9.050 1.00 0.00 ATOM 23642 OH2 SOL 2676 3.020 28.190 16.860 1.00 0.00 ATOM 23643 H1 SOL 2676 3.340 28.960 17.330 1.00 0.00 ATOM 23644 H2 SOL 2676 2.390 28.540 16.230 1.00 0.00 ATOM 23645 OH2 SOL 2677 1.670 27.540 5.380 1.00 0.00 ATOM 23646 H1 SOL 2677 1.460 28.270 4.800 1.00 0.00 ATOM 23647 H2 SOL 2677 1.840 27.940 6.230 1.00 0.00 ATOM 23648 OH2 SOL 2678 29.420 50.870 10.270 1.00 0.00 ATOM 23649 H1 SOL 2678 28.570 50.460 10.380 1.00 0.00 ATOM 23650 H2 SOL 2678 29.920 50.610 11.050 1.00 0.00 ATOM 23651 OH2 SOL 2679 56.520 13.270 21.220 1.00 0.00 ATOM 23652 H1 SOL 2679 56.660 13.930 21.890 1.00 0.00 ATOM 23653 H2 SOL 2679 57.380 12.850 21.110 1.00 0.00 ATOM 23654 OH2 SOL 2680 20.980 47.980 5.730 1.00 0.00 ATOM 23655 H1 SOL 2680 20.770 48.560 5.000 1.00 0.00 ATOM 23656 H2 SOL 2680 21.140 47.130 5.320 1.00 0.00 ATOM 23657 OH2 SOL 2681 21.360 28.620 72.310 1.00 0.00 ATOM 23658 H1 SOL 2681 20.560 28.100 72.230 1.00 0.00 ATOM 23659 H2 SOL 2681 21.070 29.440 72.710 1.00 0.00 ATOM 23660 OH2 SOL 2682 6.880 18.530 12.700 1.00 0.00 ATOM 23661 H1 SOL 2682 6.520 18.730 11.830 1.00 0.00 ATOM 23662 H2 SOL 2682 7.120 19.390 13.060 1.00 0.00 ATOM 23663 OH2 SOL 2683 52.620 45.390 70.390 1.00 0.00 ATOM 23664 H1 SOL 2683 53.150 45.770 71.090 1.00 0.00 ATOM 23665 H2 SOL 2683 52.390 46.140 69.830 1.00 0.00 ATOM 23666 OH2 SOL 2684 2.910 40.080 75.140 1.00 0.00 ATOM 23667 H1 SOL 2684 2.480 40.580 74.440 1.00 0.00 ATOM 23668 H2 SOL 2684 2.230 39.490 75.460 1.00 0.00 ATOM 23669 OH2 SOL 2685 59.060 51.670 4.400 1.00 0.00 ATOM 23670 H1 SOL 2685 58.120 51.540 4.550 1.00 0.00 ATOM 23671 H2 SOL 2685 59.450 51.640 5.270 1.00 0.00 ATOM 23672 OH2 SOL 2686 29.510 56.810 76.390 1.00 0.00 ATOM 23673 H1 SOL 2686 30.320 57.290 76.180 1.00 0.00 ATOM 23674 H2 SOL 2686 29.240 57.160 77.240 1.00 0.00 ATOM 23675 OH2 SOL 2687 61.060 7.460 0.630 1.00 0.00 ATOM 23676 H1 SOL 2687 61.250 7.360 -0.300 1.00 0.00 ATOM 23677 H2 SOL 2687 60.110 7.490 0.680 1.00 0.00 ATOM 23678 OH2 SOL 2688 12.500 46.830 8.480 1.00 0.00 ATOM 23679 H1 SOL 2688 12.100 47.470 7.890 1.00 0.00 ATOM 23680 H2 SOL 2688 13.430 47.060 8.500 1.00 0.00 ATOM 23681 OH2 SOL 2689 58.520 16.350 2.780 1.00 0.00 ATOM 23682 H1 SOL 2689 58.970 17.120 3.130 1.00 0.00 ATOM 23683 H2 SOL 2689 59.230 15.770 2.490 1.00 0.00 ATOM 23684 OH2 SOL 2690 54.900 43.980 15.250 1.00 0.00 ATOM 23685 H1 SOL 2690 54.660 44.360 14.400 1.00 0.00 ATOM 23686 H2 SOL 2690 55.660 44.490 15.530 1.00 0.00 ATOM 23687 OH2 SOL 2691 30.120 54.680 16.700 1.00 0.00 ATOM 23688 H1 SOL 2691 30.980 55.090 16.620 1.00 0.00 ATOM 23689 H2 SOL 2691 30.290 53.830 17.110 1.00 0.00 ATOM 23690 OH2 SOL 2692 37.570 0.290 16.050 1.00 0.00 ATOM 23691 H1 SOL 2692 37.280 0.140 16.950 1.00 0.00 ATOM 23692 H2 SOL 2692 38.520 0.150 16.080 1.00 0.00 ATOM 23693 OH2 SOL 2693 23.650 45.980 1.890 1.00 0.00 ATOM 23694 H1 SOL 2693 24.130 46.500 1.240 1.00 0.00 ATOM 23695 H2 SOL 2693 22.740 46.270 1.800 1.00 0.00 ATOM 23696 OH2 SOL 2694 19.630 51.510 65.610 1.00 0.00 ATOM 23697 H1 SOL 2694 20.560 51.500 65.370 1.00 0.00 ATOM 23698 H2 SOL 2694 19.510 50.710 66.110 1.00 0.00 ATOM 23699 OH2 SOL 2695 18.160 35.500 73.880 1.00 0.00 ATOM 23700 H1 SOL 2695 18.810 34.810 74.010 1.00 0.00 ATOM 23701 H2 SOL 2695 17.460 35.080 73.380 1.00 0.00 ATOM 23702 OH2 SOL 2696 32.690 4.380 7.590 1.00 0.00 ATOM 23703 H1 SOL 2696 31.960 4.040 7.070 1.00 0.00 ATOM 23704 H2 SOL 2696 32.770 3.770 8.320 1.00 0.00 ATOM 23705 OH2 SOL 2697 54.050 11.200 78.050 1.00 0.00 ATOM 23706 H1 SOL 2697 53.760 12.110 78.100 1.00 0.00 ATOM 23707 H2 SOL 2697 53.250 10.690 78.200 1.00 0.00 ATOM 23708 OH2 SOL 2698 12.890 42.090 73.750 1.00 0.00 ATOM 23709 H1 SOL 2698 12.150 41.640 73.350 1.00 0.00 ATOM 23710 H2 SOL 2698 12.810 41.910 74.680 1.00 0.00 ATOM 23711 OH2 SOL 2699 43.650 19.420 19.780 1.00 0.00 ATOM 23712 H1 SOL 2699 43.910 19.540 18.870 1.00 0.00 ATOM 23713 H2 SOL 2699 42.820 18.950 19.730 1.00 0.00 ATOM 23714 OH2 SOL 2700 25.410 1.930 75.530 1.00 0.00 ATOM 23715 H1 SOL 2700 25.640 1.400 76.290 1.00 0.00 ATOM 23716 H2 SOL 2700 25.430 2.830 75.850 1.00 0.00 ATOM 23717 OH2 SOL 2701 16.770 48.590 7.040 1.00 0.00 ATOM 23718 H1 SOL 2701 16.980 48.000 6.310 1.00 0.00 ATOM 23719 H2 SOL 2701 17.560 48.610 7.570 1.00 0.00 ATOM 23720 OH2 SOL 2702 5.110 52.510 11.910 1.00 0.00 ATOM 23721 H1 SOL 2702 5.150 53.460 11.840 1.00 0.00 ATOM 23722 H2 SOL 2702 4.810 52.340 12.800 1.00 0.00 ATOM 23723 OH2 SOL 2703 3.740 20.080 79.970 1.00 0.00 ATOM 23724 H1 SOL 2703 4.270 20.670 79.440 1.00 0.00 ATOM 23725 H2 SOL 2703 2.890 20.520 80.040 1.00 0.00 ATOM 23726 OH2 SOL 2704 5.100 4.460 4.670 1.00 0.00 ATOM 23727 H1 SOL 2704 5.090 3.540 4.420 1.00 0.00 ATOM 23728 H2 SOL 2704 5.980 4.600 5.020 1.00 0.00 ATOM 23729 OH2 SOL 2705 55.570 29.550 73.860 1.00 0.00 ATOM 23730 H1 SOL 2705 55.320 30.120 74.580 1.00 0.00 ATOM 23731 H2 SOL 2705 54.960 29.760 73.160 1.00 0.00 ATOM 23732 OH2 SOL 2706 30.200 10.140 4.170 1.00 0.00 ATOM 23733 H1 SOL 2706 30.020 9.550 3.440 1.00 0.00 ATOM 23734 H2 SOL 2706 30.730 9.620 4.770 1.00 0.00 ATOM 23735 OH2 SOL 2707 59.940 5.340 69.060 1.00 0.00 ATOM 23736 H1 SOL 2707 60.280 6.230 69.070 1.00 0.00 ATOM 23737 H2 SOL 2707 59.250 5.350 69.720 1.00 0.00 ATOM 23738 OH2 SOL 2708 51.790 31.220 79.020 1.00 0.00 ATOM 23739 H1 SOL 2708 51.310 30.580 79.550 1.00 0.00 ATOM 23740 H2 SOL 2708 52.020 30.750 78.230 1.00 0.00 ATOM 23741 OH2 SOL 2709 12.830 20.750 83.360 1.00 0.00 ATOM 23742 H1 SOL 2709 12.460 19.910 83.120 1.00 0.00 ATOM 23743 H2 SOL 2709 12.440 20.950 84.210 1.00 0.00 ATOM 23744 OH2 SOL 2710 47.890 23.180 17.010 1.00 0.00 ATOM 23745 H1 SOL 2710 48.640 23.620 16.610 1.00 0.00 ATOM 23746 H2 SOL 2710 47.820 23.550 17.890 1.00 0.00 ATOM 23747 OH2 SOL 2711 22.060 40.850 77.590 1.00 0.00 ATOM 23748 H1 SOL 2711 21.430 41.510 77.860 1.00 0.00 ATOM 23749 H2 SOL 2711 22.230 41.040 76.670 1.00 0.00 ATOM 23750 OH2 SOL 2712 7.510 47.700 0.430 1.00 0.00 ATOM 23751 H1 SOL 2712 6.650 48.110 0.530 1.00 0.00 ATOM 23752 H2 SOL 2712 7.950 48.210 -0.250 1.00 0.00 ATOM 23753 OH2 SOL 2713 31.440 19.360 27.350 1.00 0.00 ATOM 23754 H1 SOL 2713 31.970 19.450 28.140 1.00 0.00 ATOM 23755 H2 SOL 2713 30.590 19.740 27.590 1.00 0.00 ATOM 23756 OH2 SOL 2714 37.460 32.470 3.310 1.00 0.00 ATOM 23757 H1 SOL 2714 38.340 32.410 3.690 1.00 0.00 ATOM 23758 H2 SOL 2714 37.580 32.970 2.510 1.00 0.00 ATOM 23759 OH2 SOL 2715 54.300 27.750 70.310 1.00 0.00 ATOM 23760 H1 SOL 2715 54.790 27.290 69.630 1.00 0.00 ATOM 23761 H2 SOL 2715 54.750 28.590 70.400 1.00 0.00 ATOM 23762 OH2 SOL 2716 32.310 43.620 76.930 1.00 0.00 ATOM 23763 H1 SOL 2716 31.410 43.320 76.890 1.00 0.00 ATOM 23764 H2 SOL 2716 32.520 43.910 76.040 1.00 0.00 ATOM 23765 OH2 SOL 2717 59.320 40.800 74.460 1.00 0.00 ATOM 23766 H1 SOL 2717 60.110 40.700 73.920 1.00 0.00 ATOM 23767 H2 SOL 2717 59.190 41.750 74.500 1.00 0.00 ATOM 23768 OH2 SOL 2718 1.040 21.000 83.730 1.00 0.00 ATOM 23769 H1 SOL 2718 1.570 21.780 83.570 1.00 0.00 ATOM 23770 H2 SOL 2718 0.460 20.950 82.970 1.00 0.00 ATOM 23771 OH2 SOL 2719 5.780 37.830 8.310 1.00 0.00 ATOM 23772 H1 SOL 2719 5.920 38.780 8.220 1.00 0.00 ATOM 23773 H2 SOL 2719 6.470 37.440 7.780 1.00 0.00 ATOM 23774 OH2 SOL 2720 51.070 58.360 73.310 1.00 0.00 ATOM 23775 H1 SOL 2720 52.010 58.460 73.450 1.00 0.00 ATOM 23776 H2 SOL 2720 50.960 57.460 73.020 1.00 0.00 ATOM 23777 OH2 SOL 2721 21.870 2.610 0.840 1.00 0.00 ATOM 23778 H1 SOL 2721 21.530 1.880 0.310 1.00 0.00 ATOM 23779 H2 SOL 2721 22.360 2.180 1.540 1.00 0.00 ATOM 23780 OH2 SOL 2722 21.690 28.070 5.790 1.00 0.00 ATOM 23781 H1 SOL 2722 22.160 27.240 5.880 1.00 0.00 ATOM 23782 H2 SOL 2722 22.370 28.690 5.540 1.00 0.00 ATOM 23783 OH2 SOL 2723 1.760 51.890 5.710 1.00 0.00 ATOM 23784 H1 SOL 2723 1.080 51.620 6.320 1.00 0.00 ATOM 23785 H2 SOL 2723 2.530 52.050 6.260 1.00 0.00 ATOM 23786 OH2 SOL 2724 61.420 34.250 14.530 1.00 0.00 ATOM 23787 H1 SOL 2724 60.800 34.280 15.260 1.00 0.00 ATOM 23788 H2 SOL 2724 62.250 33.960 14.930 1.00 0.00 ATOM 23789 OH2 SOL 2725 7.170 56.200 20.920 1.00 0.00 ATOM 23790 H1 SOL 2725 6.440 55.900 21.460 1.00 0.00 ATOM 23791 H2 SOL 2725 7.100 57.150 20.920 1.00 0.00 ATOM 23792 OH2 SOL 2726 19.050 46.030 9.870 1.00 0.00 ATOM 23793 H1 SOL 2726 19.100 46.690 9.180 1.00 0.00 ATOM 23794 H2 SOL 2726 18.190 46.170 10.270 1.00 0.00 ATOM 23795 OH2 SOL 2727 28.200 28.120 68.970 1.00 0.00 ATOM 23796 H1 SOL 2727 28.210 27.560 68.190 1.00 0.00 ATOM 23797 H2 SOL 2727 27.600 27.670 69.570 1.00 0.00 ATOM 23798 OH2 SOL 2728 30.480 3.270 15.150 1.00 0.00 ATOM 23799 H1 SOL 2728 30.800 2.500 14.680 1.00 0.00 ATOM 23800 H2 SOL 2728 30.810 4.010 14.640 1.00 0.00 ATOM 23801 OH2 SOL 2729 39.680 31.190 68.230 1.00 0.00 ATOM 23802 H1 SOL 2729 40.400 30.830 67.710 1.00 0.00 ATOM 23803 H2 SOL 2729 39.180 31.720 67.600 1.00 0.00 ATOM 23804 OH2 SOL 2730 50.160 53.610 8.690 1.00 0.00 ATOM 23805 H1 SOL 2730 50.760 53.730 7.960 1.00 0.00 ATOM 23806 H2 SOL 2730 50.700 53.770 9.470 1.00 0.00 ATOM 23807 OH2 SOL 2731 21.810 52.800 5.710 1.00 0.00 ATOM 23808 H1 SOL 2731 22.000 53.730 5.660 1.00 0.00 ATOM 23809 H2 SOL 2731 21.200 52.710 6.440 1.00 0.00 ATOM 23810 OH2 SOL 2732 5.030 1.250 73.830 1.00 0.00 ATOM 23811 H1 SOL 2732 4.930 1.780 73.030 1.00 0.00 ATOM 23812 H2 SOL 2732 5.200 0.370 73.510 1.00 0.00 ATOM 23813 OH2 SOL 2733 49.160 17.830 83.500 1.00 0.00 ATOM 23814 H1 SOL 2733 48.330 17.470 83.820 1.00 0.00 ATOM 23815 H2 SOL 2733 49.830 17.320 83.950 1.00 0.00 ATOM 23816 OH2 SOL 2734 30.010 26.580 72.170 1.00 0.00 ATOM 23817 H1 SOL 2734 29.080 26.670 72.370 1.00 0.00 ATOM 23818 H2 SOL 2734 30.460 26.920 72.940 1.00 0.00 ATOM 23819 OH2 SOL 2735 20.110 20.100 76.590 1.00 0.00 ATOM 23820 H1 SOL 2735 20.080 21.020 76.860 1.00 0.00 ATOM 23821 H2 SOL 2735 20.150 20.130 75.640 1.00 0.00 ATOM 23822 OH2 SOL 2736 26.930 33.040 2.330 1.00 0.00 ATOM 23823 H1 SOL 2736 26.040 33.370 2.170 1.00 0.00 ATOM 23824 H2 SOL 2736 27.270 32.820 1.470 1.00 0.00 ATOM 23825 OH2 SOL 2737 42.420 32.250 2.380 1.00 0.00 ATOM 23826 H1 SOL 2737 41.720 31.600 2.410 1.00 0.00 ATOM 23827 H2 SOL 2737 42.120 32.890 1.730 1.00 0.00 ATOM 23828 OH2 SOL 2738 36.480 58.040 23.370 1.00 0.00 ATOM 23829 H1 SOL 2738 37.360 58.120 23.750 1.00 0.00 ATOM 23830 H2 SOL 2738 36.630 57.740 22.480 1.00 0.00 ATOM 23831 OH2 SOL 2739 20.950 32.820 72.760 1.00 0.00 ATOM 23832 H1 SOL 2739 20.310 33.120 73.400 1.00 0.00 ATOM 23833 H2 SOL 2739 20.570 32.030 72.390 1.00 0.00 ATOM 23834 OH2 SOL 2740 48.730 8.590 8.290 1.00 0.00 ATOM 23835 H1 SOL 2740 48.600 8.460 7.350 1.00 0.00 ATOM 23836 H2 SOL 2740 49.670 8.480 8.430 1.00 0.00 ATOM 23837 OH2 SOL 2741 31.080 41.050 25.260 1.00 0.00 ATOM 23838 H1 SOL 2741 30.220 41.230 25.620 1.00 0.00 ATOM 23839 H2 SOL 2741 31.630 40.880 26.020 1.00 0.00 ATOM 23840 OH2 SOL 2742 4.800 36.560 72.340 1.00 0.00 ATOM 23841 H1 SOL 2742 5.150 35.670 72.440 1.00 0.00 ATOM 23842 H2 SOL 2742 3.850 36.450 72.320 1.00 0.00 ATOM 23843 OH2 SOL 2743 42.240 1.420 15.730 1.00 0.00 ATOM 23844 H1 SOL 2743 42.150 1.930 14.930 1.00 0.00 ATOM 23845 H2 SOL 2743 42.330 2.080 16.420 1.00 0.00 ATOM 23846 OH2 SOL 2744 47.060 56.990 72.860 1.00 0.00 ATOM 23847 H1 SOL 2744 46.250 56.490 72.830 1.00 0.00 ATOM 23848 H2 SOL 2744 47.460 56.860 72.000 1.00 0.00 ATOM 23849 OH2 SOL 2745 19.360 1.030 9.790 1.00 0.00 ATOM 23850 H1 SOL 2745 19.110 0.110 9.790 1.00 0.00 ATOM 23851 H2 SOL 2745 19.820 1.160 8.960 1.00 0.00 ATOM 23852 OH2 SOL 2746 46.680 47.480 22.810 1.00 0.00 ATOM 23853 H1 SOL 2746 47.320 47.720 23.480 1.00 0.00 ATOM 23854 H2 SOL 2746 45.850 47.380 23.280 1.00 0.00 ATOM 23855 OH2 SOL 2747 45.510 19.540 22.120 1.00 0.00 ATOM 23856 H1 SOL 2747 44.650 19.200 22.350 1.00 0.00 ATOM 23857 H2 SOL 2747 45.360 20.440 21.840 1.00 0.00 ATOM 23858 OH2 SOL 2748 47.350 31.040 2.310 1.00 0.00 ATOM 23859 H1 SOL 2748 47.950 30.290 2.220 1.00 0.00 ATOM 23860 H2 SOL 2748 46.980 30.940 3.180 1.00 0.00 ATOM 23861 OH2 SOL 2749 35.970 37.910 15.000 1.00 0.00 ATOM 23862 H1 SOL 2749 35.440 37.270 14.530 1.00 0.00 ATOM 23863 H2 SOL 2749 35.350 38.350 15.590 1.00 0.00 ATOM 23864 OH2 SOL 2750 0.650 37.790 82.770 1.00 0.00 ATOM 23865 H1 SOL 2750 0.630 38.700 83.060 1.00 0.00 ATOM 23866 H2 SOL 2750 1.020 37.310 83.500 1.00 0.00 ATOM 23867 OH2 SOL 2751 16.220 26.800 69.270 1.00 0.00 ATOM 23868 H1 SOL 2751 15.910 26.590 70.150 1.00 0.00 ATOM 23869 H2 SOL 2751 16.690 26.020 68.990 1.00 0.00 ATOM 23870 OH2 SOL 2752 61.070 36.730 67.960 1.00 0.00 ATOM 23871 H1 SOL 2752 60.140 36.500 67.970 1.00 0.00 ATOM 23872 H2 SOL 2752 61.380 36.430 67.100 1.00 0.00 ATOM 23873 OH2 SOL 2753 46.440 32.840 29.790 1.00 0.00 ATOM 23874 H1 SOL 2753 47.350 33.140 29.850 1.00 0.00 ATOM 23875 H2 SOL 2753 46.400 32.090 30.380 1.00 0.00 ATOM 23876 OH2 SOL 2754 37.480 40.300 83.730 1.00 0.00 ATOM 23877 H1 SOL 2754 37.480 39.480 84.210 1.00 0.00 ATOM 23878 H2 SOL 2754 36.600 40.660 83.860 1.00 0.00 ATOM 23879 OH2 SOL 2755 43.130 2.800 67.740 1.00 0.00 ATOM 23880 H1 SOL 2755 42.710 2.580 66.900 1.00 0.00 ATOM 23881 H2 SOL 2755 43.860 3.370 67.510 1.00 0.00 ATOM 23882 OH2 SOL 2756 36.690 41.130 76.670 1.00 0.00 ATOM 23883 H1 SOL 2756 36.780 42.060 76.910 1.00 0.00 ATOM 23884 H2 SOL 2756 35.800 41.060 76.340 1.00 0.00 ATOM 23885 OH2 SOL 2757 56.820 56.970 74.240 1.00 0.00 ATOM 23886 H1 SOL 2757 57.140 57.070 73.340 1.00 0.00 ATOM 23887 H2 SOL 2757 56.270 56.200 74.220 1.00 0.00 ATOM 23888 OH2 SOL 2758 58.170 23.830 6.890 1.00 0.00 ATOM 23889 H1 SOL 2758 58.310 23.690 5.960 1.00 0.00 ATOM 23890 H2 SOL 2758 59.020 24.110 7.230 1.00 0.00 ATOM 23891 OH2 SOL 2759 52.310 56.250 8.880 1.00 0.00 ATOM 23892 H1 SOL 2759 51.880 56.480 8.060 1.00 0.00 ATOM 23893 H2 SOL 2759 51.990 56.910 9.500 1.00 0.00 ATOM 23894 OH2 SOL 2760 28.830 58.270 6.600 1.00 0.00 ATOM 23895 H1 SOL 2760 28.800 58.640 7.480 1.00 0.00 ATOM 23896 H2 SOL 2760 29.650 58.620 6.230 1.00 0.00 ATOM 23897 OH2 SOL 2761 24.320 18.240 83.910 1.00 0.00 ATOM 23898 H1 SOL 2761 23.630 17.770 83.450 1.00 0.00 ATOM 23899 H2 SOL 2761 23.870 18.730 84.600 1.00 0.00 ATOM 23900 OH2 SOL 2762 27.310 25.570 73.220 1.00 0.00 ATOM 23901 H1 SOL 2762 27.220 25.140 74.070 1.00 0.00 ATOM 23902 H2 SOL 2762 27.830 24.960 72.690 1.00 0.00 ATOM 23903 OH2 SOL 2763 59.060 54.260 17.640 1.00 0.00 ATOM 23904 H1 SOL 2763 58.190 54.530 17.940 1.00 0.00 ATOM 23905 H2 SOL 2763 59.270 54.870 16.930 1.00 0.00 ATOM 23906 OH2 SOL 2764 50.970 8.960 1.550 1.00 0.00 ATOM 23907 H1 SOL 2764 50.210 8.570 1.980 1.00 0.00 ATOM 23908 H2 SOL 2764 51.330 8.250 1.020 1.00 0.00 ATOM 23909 OH2 SOL 2765 7.300 31.520 7.620 1.00 0.00 ATOM 23910 H1 SOL 2765 7.590 31.240 8.490 1.00 0.00 ATOM 23911 H2 SOL 2765 8.110 31.630 7.120 1.00 0.00 ATOM 23912 OH2 SOL 2766 60.190 41.620 13.780 1.00 0.00 ATOM 23913 H1 SOL 2766 59.750 40.940 14.290 1.00 0.00 ATOM 23914 H2 SOL 2766 59.980 41.410 12.870 1.00 0.00 ATOM 23915 OH2 SOL 2767 57.230 21.650 17.740 1.00 0.00 ATOM 23916 H1 SOL 2767 56.690 22.070 18.410 1.00 0.00 ATOM 23917 H2 SOL 2767 57.950 21.250 18.240 1.00 0.00 ATOM 23918 OH2 SOL 2768 12.550 56.470 80.680 1.00 0.00 ATOM 23919 H1 SOL 2768 12.190 55.590 80.570 1.00 0.00 ATOM 23920 H2 SOL 2768 13.460 56.390 80.410 1.00 0.00 ATOM 23921 OH2 SOL 2769 29.220 27.670 7.410 1.00 0.00 ATOM 23922 H1 SOL 2769 29.740 27.510 6.620 1.00 0.00 ATOM 23923 H2 SOL 2769 29.420 28.570 7.650 1.00 0.00 ATOM 23924 OH2 SOL 2770 26.030 28.750 77.580 1.00 0.00 ATOM 23925 H1 SOL 2770 26.910 28.960 77.290 1.00 0.00 ATOM 23926 H2 SOL 2770 25.780 27.980 77.060 1.00 0.00 ATOM 23927 OH2 SOL 2771 15.450 54.280 75.200 1.00 0.00 ATOM 23928 H1 SOL 2771 15.540 55.210 74.970 1.00 0.00 ATOM 23929 H2 SOL 2771 14.840 54.270 75.930 1.00 0.00 ATOM 23930 OH2 SOL 2772 53.400 26.260 2.950 1.00 0.00 ATOM 23931 H1 SOL 2772 53.880 25.740 3.590 1.00 0.00 ATOM 23932 H2 SOL 2772 52.860 25.630 2.480 1.00 0.00 ATOM 23933 OH2 SOL 2773 57.430 6.350 5.660 1.00 0.00 ATOM 23934 H1 SOL 2773 58.030 5.760 6.110 1.00 0.00 ATOM 23935 H2 SOL 2773 57.940 6.720 4.950 1.00 0.00 ATOM 23936 OH2 SOL 2774 37.610 20.400 77.670 1.00 0.00 ATOM 23937 H1 SOL 2774 38.560 20.530 77.770 1.00 0.00 ATOM 23938 H2 SOL 2774 37.540 19.510 77.320 1.00 0.00 ATOM 23939 OH2 SOL 2775 7.210 41.660 62.840 1.00 0.00 ATOM 23940 H1 SOL 2775 6.550 42.240 63.220 1.00 0.00 ATOM 23941 H2 SOL 2775 7.660 42.200 62.190 1.00 0.00 ATOM 23942 OH2 SOL 2776 46.060 32.800 27.060 1.00 0.00 ATOM 23943 H1 SOL 2776 46.950 32.940 26.750 1.00 0.00 ATOM 23944 H2 SOL 2776 46.140 32.760 28.010 1.00 0.00 ATOM 23945 OH2 SOL 2777 53.220 55.350 82.680 1.00 0.00 ATOM 23946 H1 SOL 2777 53.850 54.910 82.120 1.00 0.00 ATOM 23947 H2 SOL 2777 53.230 54.840 83.500 1.00 0.00 ATOM 23948 OH2 SOL 2778 40.420 56.600 14.020 1.00 0.00 ATOM 23949 H1 SOL 2778 40.080 57.300 14.590 1.00 0.00 ATOM 23950 H2 SOL 2778 40.980 56.080 14.590 1.00 0.00 ATOM 23951 OH2 SOL 2779 40.670 2.700 8.290 1.00 0.00 ATOM 23952 H1 SOL 2779 39.910 2.130 8.400 1.00 0.00 ATOM 23953 H2 SOL 2779 41.280 2.180 7.760 1.00 0.00 ATOM 23954 OH2 SOL 2780 30.640 0.460 16.500 1.00 0.00 ATOM 23955 H1 SOL 2780 31.410 0.040 16.880 1.00 0.00 ATOM 23956 H2 SOL 2780 30.490 1.240 17.050 1.00 0.00 ATOM 23957 OH2 SOL 2781 44.470 18.510 0.250 1.00 0.00 ATOM 23958 H1 SOL 2781 45.420 18.440 0.190 1.00 0.00 ATOM 23959 H2 SOL 2781 44.180 17.640 0.520 1.00 0.00 ATOM 23960 OH2 SOL 2782 9.710 57.350 18.430 1.00 0.00 ATOM 23961 H1 SOL 2782 9.420 58.070 19.000 1.00 0.00 ATOM 23962 H2 SOL 2782 10.670 57.440 18.410 1.00 0.00 ATOM 23963 OH2 SOL 2783 57.940 42.860 69.410 1.00 0.00 ATOM 23964 H1 SOL 2783 57.790 43.720 69.800 1.00 0.00 ATOM 23965 H2 SOL 2783 57.330 42.280 69.870 1.00 0.00 ATOM 23966 OH2 SOL 2784 8.340 23.560 10.610 1.00 0.00 ATOM 23967 H1 SOL 2784 8.550 23.330 9.710 1.00 0.00 ATOM 23968 H2 SOL 2784 7.410 23.780 10.600 1.00 0.00 ATOM 23969 OH2 SOL 2785 4.080 2.910 71.250 1.00 0.00 ATOM 23970 H1 SOL 2785 4.230 2.870 70.310 1.00 0.00 ATOM 23971 H2 SOL 2785 3.130 2.920 71.350 1.00 0.00 ATOM 23972 OH2 SOL 2786 30.080 27.180 4.830 1.00 0.00 ATOM 23973 H1 SOL 2786 29.610 26.400 4.530 1.00 0.00 ATOM 23974 H2 SOL 2786 31.000 26.930 4.790 1.00 0.00 ATOM 23975 OH2 SOL 2787 0.370 25.730 76.700 1.00 0.00 ATOM 23976 H1 SOL 2787 0.450 24.780 76.660 1.00 0.00 ATOM 23977 H2 SOL 2787 0.700 26.020 75.840 1.00 0.00 ATOM 23978 OH2 SOL 2788 15.460 9.330 76.720 1.00 0.00 ATOM 23979 H1 SOL 2788 15.610 10.130 77.220 1.00 0.00 ATOM 23980 H2 SOL 2788 14.780 9.560 76.090 1.00 0.00 ATOM 23981 OH2 SOL 2789 35.720 13.230 9.560 1.00 0.00 ATOM 23982 H1 SOL 2789 36.420 13.790 9.230 1.00 0.00 ATOM 23983 H2 SOL 2789 35.400 12.760 8.790 1.00 0.00 ATOM 23984 OH2 SOL 2790 61.370 53.700 66.110 1.00 0.00 ATOM 23985 H1 SOL 2790 61.920 52.930 66.220 1.00 0.00 ATOM 23986 H2 SOL 2790 60.470 53.370 66.090 1.00 0.00 ATOM 23987 OH2 SOL 2791 7.270 10.370 67.750 1.00 0.00 ATOM 23988 H1 SOL 2791 6.500 9.800 67.660 1.00 0.00 ATOM 23989 H2 SOL 2791 6.900 11.250 67.850 1.00 0.00 ATOM 23990 OH2 SOL 2792 38.190 19.070 19.150 1.00 0.00 ATOM 23991 H1 SOL 2792 37.500 18.660 19.670 1.00 0.00 ATOM 23992 H2 SOL 2792 38.000 20.010 19.210 1.00 0.00 ATOM 23993 OH2 SOL 2793 18.100 1.550 16.900 1.00 0.00 ATOM 23994 H1 SOL 2793 18.230 0.990 16.130 1.00 0.00 ATOM 23995 H2 SOL 2793 18.970 1.890 17.100 1.00 0.00 ATOM 23996 OH2 SOL 2794 37.280 31.180 11.060 1.00 0.00 ATOM 23997 H1 SOL 2794 37.780 31.500 11.810 1.00 0.00 ATOM 23998 H2 SOL 2794 36.520 31.750 11.010 1.00 0.00 ATOM 23999 OH2 SOL 2795 39.660 34.000 81.460 1.00 0.00 ATOM 24000 H1 SOL 2795 40.310 34.690 81.340 1.00 0.00 ATOM 24001 H2 SOL 2795 40.150 33.180 81.390 1.00 0.00 ATOM 24002 OH2 SOL 2796 45.410 42.910 76.450 1.00 0.00 ATOM 24003 H1 SOL 2796 45.690 42.570 77.300 1.00 0.00 ATOM 24004 H2 SOL 2796 45.940 43.700 76.320 1.00 0.00 ATOM 24005 OH2 SOL 2797 8.980 53.180 7.720 1.00 0.00 ATOM 24006 H1 SOL 2797 8.620 54.050 7.530 1.00 0.00 ATOM 24007 H2 SOL 2797 8.970 53.130 8.670 1.00 0.00 ATOM 24008 OH2 SOL 2798 25.540 39.860 6.960 1.00 0.00 ATOM 24009 H1 SOL 2798 25.280 39.210 7.610 1.00 0.00 ATOM 24010 H2 SOL 2798 26.350 40.230 7.300 1.00 0.00 ATOM 24011 OH2 SOL 2799 8.560 10.720 72.820 1.00 0.00 ATOM 24012 H1 SOL 2799 7.670 10.640 72.490 1.00 0.00 ATOM 24013 H2 SOL 2799 8.670 9.980 73.410 1.00 0.00 ATOM 24014 OH2 SOL 2800 23.280 42.830 3.910 1.00 0.00 ATOM 24015 H1 SOL 2800 22.370 43.000 4.150 1.00 0.00 ATOM 24016 H2 SOL 2800 23.390 41.890 4.040 1.00 0.00 ATOM 24017 OH2 SOL 2801 37.010 51.600 81.850 1.00 0.00 ATOM 24018 H1 SOL 2801 36.100 51.860 81.700 1.00 0.00 ATOM 24019 H2 SOL 2801 36.990 50.640 81.830 1.00 0.00 ATOM 24020 OH2 SOL 2802 55.340 44.440 2.160 1.00 0.00 ATOM 24021 H1 SOL 2802 55.810 43.630 1.950 1.00 0.00 ATOM 24022 H2 SOL 2802 55.070 44.780 1.310 1.00 0.00 ATOM 24023 OH2 SOL 2803 23.580 28.030 82.790 1.00 0.00 ATOM 24024 H1 SOL 2803 22.680 28.280 82.610 1.00 0.00 ATOM 24025 H2 SOL 2803 24.070 28.350 82.030 1.00 0.00 ATOM 24026 OH2 SOL 2804 19.470 23.960 10.050 1.00 0.00 ATOM 24027 H1 SOL 2804 18.580 24.300 10.180 1.00 0.00 ATOM 24028 H2 SOL 2804 19.590 23.330 10.760 1.00 0.00 ATOM 24029 OH2 SOL 2805 42.850 33.380 17.560 1.00 0.00 ATOM 24030 H1 SOL 2805 43.350 34.190 17.650 1.00 0.00 ATOM 24031 H2 SOL 2805 42.680 33.300 16.620 1.00 0.00 ATOM 24032 OH2 SOL 2806 3.650 3.040 22.330 1.00 0.00 ATOM 24033 H1 SOL 2806 3.630 3.080 23.290 1.00 0.00 ATOM 24034 H2 SOL 2806 4.580 2.950 22.110 1.00 0.00 ATOM 24035 OH2 SOL 2807 13.560 9.260 74.580 1.00 0.00 ATOM 24036 H1 SOL 2807 13.680 8.340 74.800 1.00 0.00 ATOM 24037 H2 SOL 2807 13.380 9.270 73.640 1.00 0.00 ATOM 24038 OH2 SOL 2808 31.160 40.960 20.110 1.00 0.00 ATOM 24039 H1 SOL 2808 30.920 41.630 20.740 1.00 0.00 ATOM 24040 H2 SOL 2808 31.680 41.430 19.450 1.00 0.00 ATOM 24041 OH2 SOL 2809 16.010 7.320 21.670 1.00 0.00 ATOM 24042 H1 SOL 2809 15.460 6.550 21.510 1.00 0.00 ATOM 24043 H2 SOL 2809 16.840 6.960 21.980 1.00 0.00 ATOM 24044 OH2 SOL 2810 27.850 24.170 8.340 1.00 0.00 ATOM 24045 H1 SOL 2810 28.610 23.720 8.700 1.00 0.00 ATOM 24046 H2 SOL 2810 27.910 24.040 7.400 1.00 0.00 ATOM 24047 OH2 SOL 2811 45.000 24.030 12.400 1.00 0.00 ATOM 24048 H1 SOL 2811 44.100 23.720 12.300 1.00 0.00 ATOM 24049 H2 SOL 2811 45.510 23.240 12.550 1.00 0.00 ATOM 24050 OH2 SOL 2812 40.280 4.280 63.120 1.00 0.00 ATOM 24051 H1 SOL 2812 41.030 3.710 62.950 1.00 0.00 ATOM 24052 H2 SOL 2812 39.550 3.870 62.640 1.00 0.00 ATOM 24053 OH2 SOL 2813 19.220 1.720 76.350 1.00 0.00 ATOM 24054 H1 SOL 2813 19.190 2.680 76.410 1.00 0.00 ATOM 24055 H2 SOL 2813 18.340 1.440 76.590 1.00 0.00 ATOM 24056 OH2 SOL 2814 48.790 46.160 69.320 1.00 0.00 ATOM 24057 H1 SOL 2814 47.840 46.130 69.250 1.00 0.00 ATOM 24058 H2 SOL 2814 49.000 45.640 70.100 1.00 0.00 ATOM 24059 OH2 SOL 2815 15.460 26.850 3.470 1.00 0.00 ATOM 24060 H1 SOL 2815 16.020 27.340 2.890 1.00 0.00 ATOM 24061 H2 SOL 2815 15.760 25.940 3.390 1.00 0.00 ATOM 24062 OH2 SOL 2816 46.870 34.220 70.110 1.00 0.00 ATOM 24063 H1 SOL 2816 47.700 34.520 69.740 1.00 0.00 ATOM 24064 H2 SOL 2816 46.720 34.810 70.850 1.00 0.00 ATOM 24065 OH2 SOL 2817 49.380 34.190 69.090 1.00 0.00 ATOM 24066 H1 SOL 2817 50.200 33.900 68.690 1.00 0.00 ATOM 24067 H2 SOL 2817 49.640 34.550 69.940 1.00 0.00 ATOM 24068 OH2 SOL 2818 36.550 2.250 75.520 1.00 0.00 ATOM 24069 H1 SOL 2818 36.800 1.670 74.800 1.00 0.00 ATOM 24070 H2 SOL 2818 37.380 2.430 75.970 1.00 0.00 ATOM 24071 OH2 SOL 2819 51.070 15.110 83.820 1.00 0.00 ATOM 24072 H1 SOL 2819 51.550 15.640 83.180 1.00 0.00 ATOM 24073 H2 SOL 2819 50.730 14.380 83.310 1.00 0.00 ATOM 24074 OH2 SOL 2820 31.730 22.440 69.740 1.00 0.00 ATOM 24075 H1 SOL 2820 31.920 23.380 69.780 1.00 0.00 ATOM 24076 H2 SOL 2820 31.730 22.240 68.810 1.00 0.00 ATOM 24077 OH2 SOL 2821 3.270 5.890 14.640 1.00 0.00 ATOM 24078 H1 SOL 2821 3.630 6.320 13.860 1.00 0.00 ATOM 24079 H2 SOL 2821 3.090 6.610 15.240 1.00 0.00 ATOM 24080 OH2 SOL 2822 24.600 4.840 75.440 1.00 0.00 ATOM 24081 H1 SOL 2822 24.060 4.690 74.660 1.00 0.00 ATOM 24082 H2 SOL 2822 24.000 5.230 76.080 1.00 0.00 ATOM 24083 OH2 SOL 2823 25.830 15.550 6.030 1.00 0.00 ATOM 24084 H1 SOL 2823 26.690 15.130 6.140 1.00 0.00 ATOM 24085 H2 SOL 2823 25.960 16.440 6.330 1.00 0.00 ATOM 24086 OH2 SOL 2824 3.670 29.880 79.240 1.00 0.00 ATOM 24087 H1 SOL 2824 3.060 29.250 78.850 1.00 0.00 ATOM 24088 H2 SOL 2824 3.950 29.460 80.060 1.00 0.00 ATOM 24089 OH2 SOL 2825 21.810 41.810 64.000 1.00 0.00 ATOM 24090 H1 SOL 2825 22.730 42.010 64.160 1.00 0.00 ATOM 24091 H2 SOL 2825 21.610 42.280 63.190 1.00 0.00 ATOM 24092 OH2 SOL 2826 57.100 44.890 67.350 1.00 0.00 ATOM 24093 H1 SOL 2826 57.790 44.500 67.880 1.00 0.00 ATOM 24094 H2 SOL 2826 56.320 44.380 67.550 1.00 0.00 ATOM 24095 OH2 SOL 2827 52.960 41.410 7.040 1.00 0.00 ATOM 24096 H1 SOL 2827 52.700 41.160 6.150 1.00 0.00 ATOM 24097 H2 SOL 2827 52.140 41.630 7.480 1.00 0.00 ATOM 24098 OH2 SOL 2828 43.710 39.960 10.810 1.00 0.00 ATOM 24099 H1 SOL 2828 44.120 40.570 10.200 1.00 0.00 ATOM 24100 H2 SOL 2828 44.420 39.370 11.080 1.00 0.00 ATOM 24101 OH2 SOL 2829 41.100 39.670 19.820 1.00 0.00 ATOM 24102 H1 SOL 2829 41.910 40.000 19.430 1.00 0.00 ATOM 24103 H2 SOL 2829 41.290 38.760 20.040 1.00 0.00 ATOM 24104 OH2 SOL 2830 22.350 25.110 6.570 1.00 0.00 ATOM 24105 H1 SOL 2830 22.280 24.500 7.310 1.00 0.00 ATOM 24106 H2 SOL 2830 22.850 25.850 6.920 1.00 0.00 ATOM 24107 OH2 SOL 2831 42.520 36.350 8.520 1.00 0.00 ATOM 24108 H1 SOL 2831 42.680 35.420 8.610 1.00 0.00 ATOM 24109 H2 SOL 2831 41.820 36.540 9.150 1.00 0.00 ATOM 24110 OH2 SOL 2832 33.460 29.910 77.680 1.00 0.00 ATOM 24111 H1 SOL 2832 33.450 29.740 76.740 1.00 0.00 ATOM 24112 H2 SOL 2832 34.310 30.320 77.840 1.00 0.00 ATOM 24113 OH2 SOL 2833 18.370 11.380 8.010 1.00 0.00 ATOM 24114 H1 SOL 2833 17.660 10.770 7.820 1.00 0.00 ATOM 24115 H2 SOL 2833 17.960 12.090 8.490 1.00 0.00 ATOM 24116 OH2 SOL 2834 41.510 47.650 71.630 1.00 0.00 ATOM 24117 H1 SOL 2834 41.130 47.130 70.920 1.00 0.00 ATOM 24118 H2 SOL 2834 41.030 47.380 72.410 1.00 0.00 ATOM 24119 OH2 SOL 2835 46.040 56.640 76.280 1.00 0.00 ATOM 24120 H1 SOL 2835 46.960 56.370 76.290 1.00 0.00 ATOM 24121 H2 SOL 2835 45.570 55.860 76.000 1.00 0.00 ATOM 24122 OH2 SOL 2836 18.530 36.070 9.820 1.00 0.00 ATOM 24123 H1 SOL 2836 18.360 35.740 8.940 1.00 0.00 ATOM 24124 H2 SOL 2836 19.360 35.660 10.070 1.00 0.00 ATOM 24125 OH2 SOL 2837 5.600 19.480 16.010 1.00 0.00 ATOM 24126 H1 SOL 2837 6.020 18.620 16.030 1.00 0.00 ATOM 24127 H2 SOL 2837 6.140 19.990 15.400 1.00 0.00 ATOM 24128 OH2 SOL 2838 56.940 0.590 11.970 1.00 0.00 ATOM 24129 H1 SOL 2838 56.110 0.360 11.550 1.00 0.00 ATOM 24130 H2 SOL 2838 57.300 -0.240 12.270 1.00 0.00 ATOM 24131 OH2 SOL 2839 44.560 17.040 16.000 1.00 0.00 ATOM 24132 H1 SOL 2839 43.720 17.030 16.460 1.00 0.00 ATOM 24133 H2 SOL 2839 44.430 16.470 15.240 1.00 0.00 ATOM 24134 OH2 SOL 2840 16.920 35.060 23.610 1.00 0.00 ATOM 24135 H1 SOL 2840 16.800 35.030 24.560 1.00 0.00 ATOM 24136 H2 SOL 2840 16.490 34.270 23.290 1.00 0.00 ATOM 24137 OH2 SOL 2841 29.180 33.400 15.060 1.00 0.00 ATOM 24138 H1 SOL 2841 29.540 34.110 15.570 1.00 0.00 ATOM 24139 H2 SOL 2841 29.430 33.600 14.150 1.00 0.00 ATOM 24140 OH2 SOL 2842 10.260 25.300 5.860 1.00 0.00 ATOM 24141 H1 SOL 2842 10.690 25.960 5.320 1.00 0.00 ATOM 24142 H2 SOL 2842 10.180 25.700 6.730 1.00 0.00 ATOM 24143 OH2 SOL 2843 6.480 49.590 6.460 1.00 0.00 ATOM 24144 H1 SOL 2843 5.520 49.680 6.480 1.00 0.00 ATOM 24145 H2 SOL 2843 6.730 49.530 7.380 1.00 0.00 ATOM 24146 OH2 SOL 2844 56.020 11.170 66.010 1.00 0.00 ATOM 24147 H1 SOL 2844 55.330 11.370 65.390 1.00 0.00 ATOM 24148 H2 SOL 2844 56.410 12.020 66.230 1.00 0.00 ATOM 24149 OH2 SOL 2845 42.380 56.770 11.010 1.00 0.00 ATOM 24150 H1 SOL 2845 41.680 56.130 10.890 1.00 0.00 ATOM 24151 H2 SOL 2845 43.120 56.270 11.340 1.00 0.00 ATOM 24152 OH2 SOL 2846 35.350 38.890 19.900 1.00 0.00 ATOM 24153 H1 SOL 2846 35.260 39.060 20.840 1.00 0.00 ATOM 24154 H2 SOL 2846 36.160 39.340 19.660 1.00 0.00 ATOM 24155 OH2 SOL 2847 57.730 45.500 70.630 1.00 0.00 ATOM 24156 H1 SOL 2847 56.990 45.680 71.210 1.00 0.00 ATOM 24157 H2 SOL 2847 58.490 45.480 71.220 1.00 0.00 ATOM 24158 OH2 SOL 2848 59.460 43.330 74.340 1.00 0.00 ATOM 24159 H1 SOL 2848 59.940 43.590 73.560 1.00 0.00 ATOM 24160 H2 SOL 2848 59.290 44.160 74.800 1.00 0.00 ATOM 24161 OH2 SOL 2849 37.190 15.890 75.160 1.00 0.00 ATOM 24162 H1 SOL 2849 36.550 16.300 74.570 1.00 0.00 ATOM 24163 H2 SOL 2849 37.010 14.950 75.090 1.00 0.00 ATOM 24164 OH2 SOL 2850 19.650 7.910 2.260 1.00 0.00 ATOM 24165 H1 SOL 2850 20.340 8.570 2.220 1.00 0.00 ATOM 24166 H2 SOL 2850 19.860 7.300 1.560 1.00 0.00 ATOM 24167 OH2 SOL 2851 41.510 38.610 70.390 1.00 0.00 ATOM 24168 H1 SOL 2851 40.650 39.040 70.370 1.00 0.00 ATOM 24169 H2 SOL 2851 41.490 38.000 69.660 1.00 0.00 ATOM 24170 OH2 SOL 2852 44.130 12.250 21.230 1.00 0.00 ATOM 24171 H1 SOL 2852 43.520 12.990 21.270 1.00 0.00 ATOM 24172 H2 SOL 2852 44.470 12.270 20.330 1.00 0.00 ATOM 24173 OH2 SOL 2853 61.300 58.270 7.060 1.00 0.00 ATOM 24174 H1 SOL 2853 61.640 57.500 7.530 1.00 0.00 ATOM 24175 H2 SOL 2853 60.470 57.970 6.680 1.00 0.00 ATOM 24176 OH2 SOL 2854 3.510 43.810 12.820 1.00 0.00 ATOM 24177 H1 SOL 2854 3.510 42.890 12.530 1.00 0.00 ATOM 24178 H2 SOL 2854 2.850 43.840 13.510 1.00 0.00 ATOM 24179 OH2 SOL 2855 37.630 37.160 61.800 1.00 0.00 ATOM 24180 H1 SOL 2855 36.860 36.810 62.250 1.00 0.00 ATOM 24181 H2 SOL 2855 37.730 38.050 62.140 1.00 0.00 ATOM 24182 OH2 SOL 2856 7.170 57.610 69.540 1.00 0.00 ATOM 24183 H1 SOL 2856 7.630 57.950 68.770 1.00 0.00 ATOM 24184 H2 SOL 2856 7.400 56.680 69.560 1.00 0.00 ATOM 24185 OH2 SOL 2857 30.230 5.180 81.260 1.00 0.00 ATOM 24186 H1 SOL 2857 29.310 4.940 81.130 1.00 0.00 ATOM 24187 H2 SOL 2857 30.260 6.110 81.050 1.00 0.00 ATOM 24188 OH2 SOL 2858 7.000 39.170 61.610 1.00 0.00 ATOM 24189 H1 SOL 2858 7.050 40.110 61.790 1.00 0.00 ATOM 24190 H2 SOL 2858 7.120 38.750 62.460 1.00 0.00 ATOM 24191 OH2 SOL 2859 0.360 18.380 80.350 1.00 0.00 ATOM 24192 H1 SOL 2859 0.310 17.600 80.900 1.00 0.00 ATOM 24193 H2 SOL 2859 0.530 18.040 79.470 1.00 0.00 ATOM 24194 OH2 SOL 2860 41.760 1.260 82.250 1.00 0.00 ATOM 24195 H1 SOL 2860 42.090 2.140 82.030 1.00 0.00 ATOM 24196 H2 SOL 2860 40.860 1.410 82.530 1.00 0.00 ATOM 24197 OH2 SOL 2861 10.310 55.990 78.510 1.00 0.00 ATOM 24198 H1 SOL 2861 10.600 55.500 79.280 1.00 0.00 ATOM 24199 H2 SOL 2861 10.880 56.760 78.500 1.00 0.00 ATOM 24200 OH2 SOL 2862 59.480 9.850 5.300 1.00 0.00 ATOM 24201 H1 SOL 2862 59.780 10.540 4.720 1.00 0.00 ATOM 24202 H2 SOL 2862 59.100 10.310 6.050 1.00 0.00 ATOM 24203 OH2 SOL 2863 16.400 15.690 0.470 1.00 0.00 ATOM 24204 H1 SOL 2863 17.140 15.270 0.910 1.00 0.00 ATOM 24205 H2 SOL 2863 16.790 16.140 -0.280 1.00 0.00 ATOM 24206 OH2 SOL 2864 19.170 4.970 11.620 1.00 0.00 ATOM 24207 H1 SOL 2864 18.710 5.300 10.840 1.00 0.00 ATOM 24208 H2 SOL 2864 19.750 5.680 11.880 1.00 0.00 ATOM 24209 OH2 SOL 2865 37.450 42.420 2.690 1.00 0.00 ATOM 24210 H1 SOL 2865 37.740 42.530 3.590 1.00 0.00 ATOM 24211 H2 SOL 2865 38.140 42.810 2.160 1.00 0.00 ATOM 24212 OH2 SOL 2866 13.300 53.610 76.630 1.00 0.00 ATOM 24213 H1 SOL 2866 12.550 53.200 76.210 1.00 0.00 ATOM 24214 H2 SOL 2866 12.920 54.240 77.250 1.00 0.00 ATOM 24215 OH2 SOL 2867 57.040 37.680 77.260 1.00 0.00 ATOM 24216 H1 SOL 2867 57.050 37.250 78.110 1.00 0.00 ATOM 24217 H2 SOL 2867 57.940 37.940 77.100 1.00 0.00 ATOM 24218 OH2 SOL 2868 29.120 24.950 78.250 1.00 0.00 ATOM 24219 H1 SOL 2868 29.470 24.420 77.530 1.00 0.00 ATOM 24220 H2 SOL 2868 28.550 24.350 78.730 1.00 0.00 ATOM 24221 OH2 SOL 2869 0.670 17.140 77.930 1.00 0.00 ATOM 24222 H1 SOL 2869 -0.170 17.590 77.890 1.00 0.00 ATOM 24223 H2 SOL 2869 0.850 16.860 77.030 1.00 0.00 ATOM 24224 OH2 SOL 2870 49.890 36.590 74.030 1.00 0.00 ATOM 24225 H1 SOL 2870 49.150 35.990 73.990 1.00 0.00 ATOM 24226 H2 SOL 2870 49.600 37.290 74.620 1.00 0.00 ATOM 24227 OH2 SOL 2871 41.320 44.920 8.470 1.00 0.00 ATOM 24228 H1 SOL 2871 41.360 45.070 9.410 1.00 0.00 ATOM 24229 H2 SOL 2871 41.760 44.090 8.330 1.00 0.00 ATOM 24230 OH2 SOL 2872 3.220 40.810 12.170 1.00 0.00 ATOM 24231 H1 SOL 2872 4.170 40.700 12.050 1.00 0.00 ATOM 24232 H2 SOL 2872 3.070 40.630 13.100 1.00 0.00 ATOM 24233 OH2 SOL 2873 55.040 47.880 76.290 1.00 0.00 ATOM 24234 H1 SOL 2873 54.560 48.520 75.760 1.00 0.00 ATOM 24235 H2 SOL 2873 55.460 47.310 75.640 1.00 0.00 ATOM 24236 OH2 SOL 2874 48.620 47.670 1.590 1.00 0.00 ATOM 24237 H1 SOL 2874 47.860 47.440 1.070 1.00 0.00 ATOM 24238 H2 SOL 2874 48.970 46.840 1.900 1.00 0.00 ATOM 24239 OH2 SOL 2875 35.030 13.490 1.380 1.00 0.00 ATOM 24240 H1 SOL 2875 35.330 12.700 1.820 1.00 0.00 ATOM 24241 H2 SOL 2875 35.830 14.030 1.310 1.00 0.00 ATOM 24242 OH2 SOL 2876 34.650 32.880 83.930 1.00 0.00 ATOM 24243 H1 SOL 2876 34.820 32.030 83.530 1.00 0.00 ATOM 24244 H2 SOL 2876 34.320 33.420 83.210 1.00 0.00 ATOM 24245 OH2 SOL 2877 32.470 26.700 18.330 1.00 0.00 ATOM 24246 H1 SOL 2877 31.650 26.200 18.300 1.00 0.00 ATOM 24247 H2 SOL 2877 33.130 26.060 18.590 1.00 0.00 ATOM 24248 OH2 SOL 2878 53.770 49.230 67.750 1.00 0.00 ATOM 24249 H1 SOL 2878 54.670 49.060 67.470 1.00 0.00 ATOM 24250 H2 SOL 2878 53.240 49.020 66.990 1.00 0.00 ATOM 24251 OH2 SOL 2879 16.640 39.660 79.880 1.00 0.00 ATOM 24252 H1 SOL 2879 17.270 39.840 80.590 1.00 0.00 ATOM 24253 H2 SOL 2879 16.220 40.510 79.720 1.00 0.00 ATOM 24254 OH2 SOL 2880 7.990 6.380 75.500 1.00 0.00 ATOM 24255 H1 SOL 2880 8.030 6.250 76.450 1.00 0.00 ATOM 24256 H2 SOL 2880 8.720 5.840 75.170 1.00 0.00 ATOM 24257 OH2 SOL 2881 25.430 32.840 69.500 1.00 0.00 ATOM 24258 H1 SOL 2881 24.850 32.080 69.470 1.00 0.00 ATOM 24259 H2 SOL 2881 26.290 32.490 69.260 1.00 0.00 ATOM 24260 OH2 SOL 2882 24.810 19.080 3.890 1.00 0.00 ATOM 24261 H1 SOL 2882 24.920 18.400 3.220 1.00 0.00 ATOM 24262 H2 SOL 2882 25.360 18.800 4.610 1.00 0.00 ATOM 24263 OH2 SOL 2883 54.900 43.780 70.790 1.00 0.00 ATOM 24264 H1 SOL 2883 55.170 44.550 71.280 1.00 0.00 ATOM 24265 H2 SOL 2883 54.560 44.130 69.960 1.00 0.00 ATOM 24266 OH2 SOL 2884 37.080 20.260 21.760 1.00 0.00 ATOM 24267 H1 SOL 2884 36.700 20.430 20.900 1.00 0.00 ATOM 24268 H2 SOL 2884 36.470 19.660 22.180 1.00 0.00 ATOM 24269 OH2 SOL 2885 26.230 51.700 65.850 1.00 0.00 ATOM 24270 H1 SOL 2885 26.030 51.620 66.780 1.00 0.00 ATOM 24271 H2 SOL 2885 25.420 52.030 65.460 1.00 0.00 ATOM 24272 OH2 SOL 2886 16.540 40.190 65.530 1.00 0.00 ATOM 24273 H1 SOL 2886 16.640 39.890 64.630 1.00 0.00 ATOM 24274 H2 SOL 2886 16.990 39.520 66.050 1.00 0.00 ATOM 24275 OH2 SOL 2887 15.320 51.560 77.470 1.00 0.00 ATOM 24276 H1 SOL 2887 14.830 52.230 76.980 1.00 0.00 ATOM 24277 H2 SOL 2887 14.750 51.350 78.210 1.00 0.00 ATOM 24278 OH2 SOL 2888 59.700 34.920 77.390 1.00 0.00 ATOM 24279 H1 SOL 2888 59.530 35.860 77.370 1.00 0.00 ATOM 24280 H2 SOL 2888 59.690 34.690 78.320 1.00 0.00 ATOM 24281 OH2 SOL 2889 47.030 8.700 81.750 1.00 0.00 ATOM 24282 H1 SOL 2889 46.110 8.530 81.540 1.00 0.00 ATOM 24283 H2 SOL 2889 47.080 8.590 82.700 1.00 0.00 ATOM 24284 OH2 SOL 2890 37.930 23.410 12.530 1.00 0.00 ATOM 24285 H1 SOL 2890 37.210 23.950 12.220 1.00 0.00 ATOM 24286 H2 SOL 2890 37.550 22.540 12.630 1.00 0.00 ATOM 24287 OH2 SOL 2891 12.470 41.420 77.770 1.00 0.00 ATOM 24288 H1 SOL 2891 12.780 41.340 78.670 1.00 0.00 ATOM 24289 H2 SOL 2891 11.540 41.620 77.850 1.00 0.00 ATOM 24290 OH2 SOL 2892 9.400 6.890 8.380 1.00 0.00 ATOM 24291 H1 SOL 2892 9.120 7.800 8.280 1.00 0.00 ATOM 24292 H2 SOL 2892 9.930 6.720 7.600 1.00 0.00 ATOM 24293 OH2 SOL 2893 33.680 7.180 4.550 1.00 0.00 ATOM 24294 H1 SOL 2893 34.280 7.820 4.160 1.00 0.00 ATOM 24295 H2 SOL 2893 34.010 6.340 4.240 1.00 0.00 ATOM 24296 OH2 SOL 2894 25.410 11.610 19.000 1.00 0.00 ATOM 24297 H1 SOL 2894 26.360 11.600 18.970 1.00 0.00 ATOM 24298 H2 SOL 2894 25.130 11.090 18.250 1.00 0.00 ATOM 24299 OH2 SOL 2895 51.730 49.580 83.670 1.00 0.00 ATOM 24300 H1 SOL 2895 51.320 50.340 84.090 1.00 0.00 ATOM 24301 H2 SOL 2895 52.670 49.710 83.800 1.00 0.00 ATOM 24302 OH2 SOL 2896 18.530 51.830 17.090 1.00 0.00 ATOM 24303 H1 SOL 2896 18.130 52.360 17.780 1.00 0.00 ATOM 24304 H2 SOL 2896 18.250 52.250 16.270 1.00 0.00 ATOM 24305 OH2 SOL 2897 30.050 40.210 9.240 1.00 0.00 ATOM 24306 H1 SOL 2897 29.710 41.080 9.440 1.00 0.00 ATOM 24307 H2 SOL 2897 30.570 40.340 8.440 1.00 0.00 ATOM 24308 OH2 SOL 2898 1.160 26.120 9.700 1.00 0.00 ATOM 24309 H1 SOL 2898 1.770 25.440 9.400 1.00 0.00 ATOM 24310 H2 SOL 2898 1.710 26.750 10.150 1.00 0.00 ATOM 24311 OH2 SOL 2899 41.220 43.950 71.600 1.00 0.00 ATOM 24312 H1 SOL 2899 41.370 43.520 72.440 1.00 0.00 ATOM 24313 H2 SOL 2899 41.360 43.260 70.950 1.00 0.00 ATOM 24314 OH2 SOL 2900 32.480 1.070 7.470 1.00 0.00 ATOM 24315 H1 SOL 2900 31.710 1.320 6.950 1.00 0.00 ATOM 24316 H2 SOL 2900 33.010 0.530 6.880 1.00 0.00 ATOM 24317 OH2 SOL 2901 26.130 8.980 9.910 1.00 0.00 ATOM 24318 H1 SOL 2901 26.090 8.850 10.850 1.00 0.00 ATOM 24319 H2 SOL 2901 26.510 9.860 9.800 1.00 0.00 ATOM 24320 OH2 SOL 2902 14.060 3.170 74.850 1.00 0.00 ATOM 24321 H1 SOL 2902 13.390 3.450 74.230 1.00 0.00 ATOM 24322 H2 SOL 2902 14.870 3.210 74.340 1.00 0.00 ATOM 24323 OH2 SOL 2903 3.750 27.280 3.070 1.00 0.00 ATOM 24324 H1 SOL 2903 3.540 26.880 3.920 1.00 0.00 ATOM 24325 H2 SOL 2903 3.480 28.200 3.170 1.00 0.00 ATOM 24326 OH2 SOL 2904 20.800 56.420 10.920 1.00 0.00 ATOM 24327 H1 SOL 2904 20.120 56.420 10.240 1.00 0.00 ATOM 24328 H2 SOL 2904 21.610 56.220 10.440 1.00 0.00 ATOM 24329 OH2 SOL 2905 60.270 24.660 81.040 1.00 0.00 ATOM 24330 H1 SOL 2905 60.390 24.550 81.980 1.00 0.00 ATOM 24331 H2 SOL 2905 60.880 25.350 80.790 1.00 0.00 ATOM 24332 OH2 SOL 2906 7.120 23.700 15.800 1.00 0.00 ATOM 24333 H1 SOL 2906 6.730 24.030 14.990 1.00 0.00 ATOM 24334 H2 SOL 2906 6.470 23.890 16.480 1.00 0.00 ATOM 24335 OH2 SOL 2907 4.320 15.310 65.030 1.00 0.00 ATOM 24336 H1 SOL 2907 4.890 14.760 64.490 1.00 0.00 ATOM 24337 H2 SOL 2907 3.440 15.160 64.680 1.00 0.00 ATOM 24338 OH2 SOL 2908 47.120 57.840 79.290 1.00 0.00 ATOM 24339 H1 SOL 2908 47.920 57.390 79.570 1.00 0.00 ATOM 24340 H2 SOL 2908 47.100 57.720 78.340 1.00 0.00 ATOM 24341 OH2 SOL 2909 1.860 4.260 65.620 1.00 0.00 ATOM 24342 H1 SOL 2909 1.170 4.150 66.270 1.00 0.00 ATOM 24343 H2 SOL 2909 2.260 3.390 65.530 1.00 0.00 ATOM 24344 OH2 SOL 2910 7.430 14.150 12.640 1.00 0.00 ATOM 24345 H1 SOL 2910 7.790 13.290 12.870 1.00 0.00 ATOM 24346 H2 SOL 2910 7.480 14.660 13.450 1.00 0.00 ATOM 24347 OH2 SOL 2911 2.400 25.130 64.480 1.00 0.00 ATOM 24348 H1 SOL 2911 1.850 25.440 63.770 1.00 0.00 ATOM 24349 H2 SOL 2911 2.750 24.300 64.170 1.00 0.00 ATOM 24350 OH2 SOL 2912 25.110 13.950 82.820 1.00 0.00 ATOM 24351 H1 SOL 2912 24.330 14.490 82.920 1.00 0.00 ATOM 24352 H2 SOL 2912 25.340 14.030 81.890 1.00 0.00 ATOM 24353 OH2 SOL 2913 54.660 10.590 25.130 1.00 0.00 ATOM 24354 H1 SOL 2913 53.890 10.920 24.670 1.00 0.00 ATOM 24355 H2 SOL 2913 54.340 9.850 25.640 1.00 0.00 ATOM 24356 OH2 SOL 2914 31.830 13.300 22.960 1.00 0.00 ATOM 24357 H1 SOL 2914 32.680 13.730 23.020 1.00 0.00 ATOM 24358 H2 SOL 2914 31.330 13.830 22.350 1.00 0.00 ATOM 24359 OH2 SOL 2915 22.930 58.140 6.210 1.00 0.00 ATOM 24360 H1 SOL 2915 23.320 58.350 7.060 1.00 0.00 ATOM 24361 H2 SOL 2915 23.660 58.220 5.590 1.00 0.00 ATOM 24362 OH2 SOL 2916 59.810 10.320 17.500 1.00 0.00 ATOM 24363 H1 SOL 2916 59.990 11.020 16.880 1.00 0.00 ATOM 24364 H2 SOL 2916 60.670 10.000 17.770 1.00 0.00 ATOM 24365 OH2 SOL 2917 15.490 46.850 79.790 1.00 0.00 ATOM 24366 H1 SOL 2917 14.980 47.220 80.510 1.00 0.00 ATOM 24367 H2 SOL 2917 16.390 46.830 80.120 1.00 0.00 ATOM 24368 OH2 SOL 2918 0.640 33.430 9.590 1.00 0.00 ATOM 24369 H1 SOL 2918 0.490 33.680 10.500 1.00 0.00 ATOM 24370 H2 SOL 2918 -0.230 33.430 9.200 1.00 0.00 ATOM 24371 OH2 SOL 2919 54.560 48.220 82.990 1.00 0.00 ATOM 24372 H1 SOL 2919 54.540 49.140 83.280 1.00 0.00 ATOM 24373 H2 SOL 2919 55.060 48.240 82.180 1.00 0.00 ATOM 24374 OH2 SOL 2920 26.960 36.600 13.910 1.00 0.00 ATOM 24375 H1 SOL 2920 27.480 36.640 14.710 1.00 0.00 ATOM 24376 H2 SOL 2920 27.600 36.690 13.200 1.00 0.00 ATOM 24377 OH2 SOL 2921 2.710 2.880 10.350 1.00 0.00 ATOM 24378 H1 SOL 2921 2.390 3.760 10.160 1.00 0.00 ATOM 24379 H2 SOL 2921 2.550 2.390 9.540 1.00 0.00 ATOM 24380 OH2 SOL 2922 16.660 19.740 13.310 1.00 0.00 ATOM 24381 H1 SOL 2922 16.210 20.410 13.820 1.00 0.00 ATOM 24382 H2 SOL 2922 17.580 19.820 13.570 1.00 0.00 ATOM 24383 OH2 SOL 2923 40.220 31.880 11.190 1.00 0.00 ATOM 24384 H1 SOL 2923 40.240 31.420 10.350 1.00 0.00 ATOM 24385 H2 SOL 2923 40.080 31.190 11.840 1.00 0.00 ATOM 24386 OH2 SOL 2924 37.440 47.600 2.780 1.00 0.00 ATOM 24387 H1 SOL 2924 37.420 46.650 2.730 1.00 0.00 ATOM 24388 H2 SOL 2924 37.400 47.880 1.860 1.00 0.00 ATOM 24389 OH2 SOL 2925 48.530 8.490 17.480 1.00 0.00 ATOM 24390 H1 SOL 2925 48.550 9.450 17.510 1.00 0.00 ATOM 24391 H2 SOL 2925 47.600 8.280 17.350 1.00 0.00 ATOM 24392 OH2 SOL 2926 29.230 36.570 72.370 1.00 0.00 ATOM 24393 H1 SOL 2926 28.480 36.290 71.860 1.00 0.00 ATOM 24394 H2 SOL 2926 29.850 36.900 71.730 1.00 0.00 ATOM 24395 OH2 SOL 2927 23.250 57.770 74.260 1.00 0.00 ATOM 24396 H1 SOL 2927 24.080 57.740 73.780 1.00 0.00 ATOM 24397 H2 SOL 2927 22.690 58.340 73.740 1.00 0.00 ATOM 24398 OH2 SOL 2928 49.620 42.570 65.260 1.00 0.00 ATOM 24399 H1 SOL 2928 49.980 43.190 64.630 1.00 0.00 ATOM 24400 H2 SOL 2928 50.200 42.630 66.020 1.00 0.00 ATOM 24401 OH2 SOL 2929 4.170 11.280 69.970 1.00 0.00 ATOM 24402 H1 SOL 2929 3.580 12.020 70.120 1.00 0.00 ATOM 24403 H2 SOL 2929 3.590 10.540 69.790 1.00 0.00 ATOM 24404 OH2 SOL 2930 53.230 54.070 1.180 1.00 0.00 ATOM 24405 H1 SOL 2930 53.750 53.320 1.460 1.00 0.00 ATOM 24406 H2 SOL 2930 52.690 54.290 1.930 1.00 0.00 ATOM 24407 OH2 SOL 2931 55.660 30.030 81.440 1.00 0.00 ATOM 24408 H1 SOL 2931 55.080 30.740 81.150 1.00 0.00 ATOM 24409 H2 SOL 2931 55.070 29.300 81.640 1.00 0.00 ATOM 24410 OH2 SOL 2932 35.230 30.450 18.790 1.00 0.00 ATOM 24411 H1 SOL 2932 35.550 30.890 18.000 1.00 0.00 ATOM 24412 H2 SOL 2932 34.430 30.000 18.510 1.00 0.00 ATOM 24413 OH2 SOL 2933 18.310 28.490 66.180 1.00 0.00 ATOM 24414 H1 SOL 2933 17.380 28.630 65.970 1.00 0.00 ATOM 24415 H2 SOL 2933 18.760 29.240 65.770 1.00 0.00 ATOM 24416 OH2 SOL 2934 53.720 46.010 27.700 1.00 0.00 ATOM 24417 H1 SOL 2934 52.790 45.810 27.650 1.00 0.00 ATOM 24418 H2 SOL 2934 53.750 46.960 27.820 1.00 0.00 ATOM 24419 OH2 SOL 2935 2.290 2.070 75.030 1.00 0.00 ATOM 24420 H1 SOL 2935 3.240 1.980 74.920 1.00 0.00 ATOM 24421 H2 SOL 2935 2.170 2.080 75.980 1.00 0.00 ATOM 24422 OH2 SOL 2936 1.430 41.000 4.930 1.00 0.00 ATOM 24423 H1 SOL 2936 1.800 40.150 5.160 1.00 0.00 ATOM 24424 H2 SOL 2936 1.600 41.550 5.690 1.00 0.00 ATOM 24425 OH2 SOL 2937 18.240 3.650 6.460 1.00 0.00 ATOM 24426 H1 SOL 2937 18.520 4.560 6.570 1.00 0.00 ATOM 24427 H2 SOL 2937 17.660 3.480 7.200 1.00 0.00 ATOM 24428 OH2 SOL 2938 27.740 12.060 10.830 1.00 0.00 ATOM 24429 H1 SOL 2938 27.900 12.300 9.910 1.00 0.00 ATOM 24430 H2 SOL 2938 26.810 12.230 10.970 1.00 0.00 ATOM 24431 OH2 SOL 2939 28.280 11.800 5.450 1.00 0.00 ATOM 24432 H1 SOL 2939 29.010 11.280 5.120 1.00 0.00 ATOM 24433 H2 SOL 2939 28.220 11.560 6.380 1.00 0.00 ATOM 24434 OH2 SOL 2940 6.490 55.040 80.850 1.00 0.00 ATOM 24435 H1 SOL 2940 6.720 55.070 81.780 1.00 0.00 ATOM 24436 H2 SOL 2940 6.290 54.120 80.690 1.00 0.00 ATOM 24437 OH2 SOL 2941 39.200 13.490 13.930 1.00 0.00 ATOM 24438 H1 SOL 2941 39.520 12.720 13.460 1.00 0.00 ATOM 24439 H2 SOL 2941 39.360 14.220 13.330 1.00 0.00 ATOM 24440 OH2 SOL 2942 30.350 51.050 79.210 1.00 0.00 ATOM 24441 H1 SOL 2942 30.240 50.100 79.310 1.00 0.00 ATOM 24442 H2 SOL 2942 29.480 51.400 79.410 1.00 0.00 ATOM 24443 OH2 SOL 2943 48.770 6.760 74.910 1.00 0.00 ATOM 24444 H1 SOL 2943 48.500 5.890 75.210 1.00 0.00 ATOM 24445 H2 SOL 2943 48.010 7.320 75.070 1.00 0.00 ATOM 24446 OH2 SOL 2944 16.460 9.250 14.860 1.00 0.00 ATOM 24447 H1 SOL 2944 16.500 9.820 14.090 1.00 0.00 ATOM 24448 H2 SOL 2944 17.040 8.520 14.650 1.00 0.00 ATOM 24449 OH2 SOL 2945 51.290 41.950 4.070 1.00 0.00 ATOM 24450 H1 SOL 2945 51.510 41.190 3.540 1.00 0.00 ATOM 24451 H2 SOL 2945 52.070 42.510 4.030 1.00 0.00 ATOM 24452 OH2 SOL 2946 0.750 28.750 72.000 1.00 0.00 ATOM 24453 H1 SOL 2946 0.210 29.440 71.620 1.00 0.00 ATOM 24454 H2 SOL 2946 0.150 28.290 72.590 1.00 0.00 ATOM 24455 OH2 SOL 2947 44.150 42.280 74.130 1.00 0.00 ATOM 24456 H1 SOL 2947 44.410 42.430 75.040 1.00 0.00 ATOM 24457 H2 SOL 2947 43.790 43.120 73.850 1.00 0.00 ATOM 24458 OH2 SOL 2948 40.750 29.890 19.600 1.00 0.00 ATOM 24459 H1 SOL 2948 40.630 30.690 19.090 1.00 0.00 ATOM 24460 H2 SOL 2948 40.150 29.980 20.340 1.00 0.00 ATOM 24461 OH2 SOL 2949 0.510 58.630 81.980 1.00 0.00 ATOM 24462 H1 SOL 2949 1.110 58.510 82.720 1.00 0.00 ATOM 24463 H2 SOL 2949 -0.360 58.610 82.370 1.00 0.00 ATOM 24464 OH2 SOL 2950 34.710 15.410 7.580 1.00 0.00 ATOM 24465 H1 SOL 2950 33.860 15.350 7.150 1.00 0.00 ATOM 24466 H2 SOL 2950 34.690 16.250 8.030 1.00 0.00 ATOM 24467 OH2 SOL 2951 22.730 5.310 60.580 1.00 0.00 ATOM 24468 H1 SOL 2951 23.610 5.680 60.490 1.00 0.00 ATOM 24469 H2 SOL 2951 22.880 4.370 60.700 1.00 0.00 ATOM 24470 OH2 SOL 2952 57.480 9.400 1.640 1.00 0.00 ATOM 24471 H1 SOL 2952 56.740 9.230 1.070 1.00 0.00 ATOM 24472 H2 SOL 2952 58.090 8.690 1.460 1.00 0.00 ATOM 24473 OH2 SOL 2953 39.190 49.610 24.160 1.00 0.00 ATOM 24474 H1 SOL 2953 39.360 50.060 24.990 1.00 0.00 ATOM 24475 H2 SOL 2953 38.470 50.110 23.760 1.00 0.00 ATOM 24476 OH2 SOL 2954 15.930 13.370 70.420 1.00 0.00 ATOM 24477 H1 SOL 2954 15.910 14.080 69.780 1.00 0.00 ATOM 24478 H2 SOL 2954 16.820 13.020 70.360 1.00 0.00 ATOM 24479 OH2 SOL 2955 3.640 15.480 4.270 1.00 0.00 ATOM 24480 H1 SOL 2955 3.560 15.430 3.320 1.00 0.00 ATOM 24481 H2 SOL 2955 3.630 14.570 4.560 1.00 0.00 ATOM 24482 OH2 SOL 2956 32.890 29.270 21.550 1.00 0.00 ATOM 24483 H1 SOL 2956 32.740 29.290 20.600 1.00 0.00 ATOM 24484 H2 SOL 2956 32.990 30.190 21.790 1.00 0.00 ATOM 24485 OH2 SOL 2957 50.430 42.210 7.570 1.00 0.00 ATOM 24486 H1 SOL 2957 50.110 43.000 7.140 1.00 0.00 ATOM 24487 H2 SOL 2957 50.560 42.460 8.480 1.00 0.00 ATOM 24488 OH2 SOL 2958 26.120 45.540 75.930 1.00 0.00 ATOM 24489 H1 SOL 2958 26.510 44.750 75.560 1.00 0.00 ATOM 24490 H2 SOL 2958 25.360 45.720 75.390 1.00 0.00 ATOM 24491 OH2 SOL 2959 54.890 54.820 78.730 1.00 0.00 ATOM 24492 H1 SOL 2959 55.660 55.380 78.860 1.00 0.00 ATOM 24493 H2 SOL 2959 54.590 54.610 79.610 1.00 0.00 ATOM 24494 OH2 SOL 2960 31.690 43.350 16.430 1.00 0.00 ATOM 24495 H1 SOL 2960 30.780 43.360 16.720 1.00 0.00 ATOM 24496 H2 SOL 2960 31.650 43.410 15.470 1.00 0.00 ATOM 24497 OH2 SOL 2961 10.180 27.000 3.280 1.00 0.00 ATOM 24498 H1 SOL 2961 10.440 27.130 2.370 1.00 0.00 ATOM 24499 H2 SOL 2961 9.340 26.540 3.220 1.00 0.00 ATOM 24500 OH2 SOL 2962 22.270 42.590 81.570 1.00 0.00 ATOM 24501 H1 SOL 2962 23.090 42.790 82.020 1.00 0.00 ATOM 24502 H2 SOL 2962 22.510 42.490 80.650 1.00 0.00 ATOM 24503 OH2 SOL 2963 27.520 35.850 3.220 1.00 0.00 ATOM 24504 H1 SOL 2963 27.600 34.890 3.240 1.00 0.00 ATOM 24505 H2 SOL 2963 28.420 36.160 3.180 1.00 0.00 ATOM 24506 OH2 SOL 2964 14.600 18.490 11.720 1.00 0.00 ATOM 24507 H1 SOL 2964 14.660 18.740 10.800 1.00 0.00 ATOM 24508 H2 SOL 2964 15.460 18.700 12.090 1.00 0.00 ATOM 24509 OH2 SOL 2965 48.390 6.210 67.400 1.00 0.00 ATOM 24510 H1 SOL 2965 47.620 6.520 66.920 1.00 0.00 ATOM 24511 H2 SOL 2965 49.110 6.320 66.780 1.00 0.00 ATOM 24512 OH2 SOL 2966 55.400 32.590 6.120 1.00 0.00 ATOM 24513 H1 SOL 2966 54.530 32.680 6.510 1.00 0.00 ATOM 24514 H2 SOL 2966 55.930 33.280 6.540 1.00 0.00 ATOM 24515 OH2 SOL 2967 22.140 52.840 15.840 1.00 0.00 ATOM 24516 H1 SOL 2967 22.730 53.000 15.100 1.00 0.00 ATOM 24517 H2 SOL 2967 21.800 53.710 16.060 1.00 0.00 ATOM 24518 OH2 SOL 2968 8.920 55.920 0.550 1.00 0.00 ATOM 24519 H1 SOL 2968 9.500 55.490 1.180 1.00 0.00 ATOM 24520 H2 SOL 2968 9.350 56.760 0.370 1.00 0.00 ATOM 24521 OH2 SOL 2969 14.380 34.220 83.330 1.00 0.00 ATOM 24522 H1 SOL 2969 13.780 34.670 83.930 1.00 0.00 ATOM 24523 H2 SOL 2969 13.970 33.370 83.170 1.00 0.00 ATOM 24524 OH2 SOL 2970 10.650 33.980 17.260 1.00 0.00 ATOM 24525 H1 SOL 2970 10.810 33.070 17.520 1.00 0.00 ATOM 24526 H2 SOL 2970 10.800 34.000 16.310 1.00 0.00 ATOM 24527 OH2 SOL 2971 36.680 44.140 80.820 1.00 0.00 ATOM 24528 H1 SOL 2971 36.940 44.970 80.410 1.00 0.00 ATOM 24529 H2 SOL 2971 37.270 43.490 80.430 1.00 0.00 ATOM 24530 OH2 SOL 2972 29.920 48.280 79.390 1.00 0.00 ATOM 24531 H1 SOL 2972 29.150 47.720 79.320 1.00 0.00 ATOM 24532 H2 SOL 2972 30.550 47.740 79.880 1.00 0.00 ATOM 24533 OH2 SOL 2973 31.670 26.180 66.790 1.00 0.00 ATOM 24534 H1 SOL 2973 31.120 26.810 66.320 1.00 0.00 ATOM 24535 H2 SOL 2973 32.560 26.500 66.670 1.00 0.00 ATOM 24536 OH2 SOL 2974 30.370 8.070 21.970 1.00 0.00 ATOM 24537 H1 SOL 2974 31.210 7.600 21.960 1.00 0.00 ATOM 24538 H2 SOL 2974 30.620 8.990 22.010 1.00 0.00 ATOM 24539 OH2 SOL 2975 20.160 19.340 6.140 1.00 0.00 ATOM 24540 H1 SOL 2975 20.890 18.760 6.370 1.00 0.00 ATOM 24541 H2 SOL 2975 19.660 19.430 6.940 1.00 0.00 ATOM 24542 OH2 SOL 2976 18.880 18.380 3.860 1.00 0.00 ATOM 24543 H1 SOL 2976 19.310 17.530 3.990 1.00 0.00 ATOM 24544 H2 SOL 2976 19.190 18.920 4.580 1.00 0.00 ATOM 24545 OH2 SOL 2977 45.820 47.370 1.180 1.00 0.00 ATOM 24546 H1 SOL 2977 45.540 48.250 0.920 1.00 0.00 ATOM 24547 H2 SOL 2977 45.450 47.250 2.050 1.00 0.00 ATOM 24548 OH2 SOL 2978 44.160 46.940 13.520 1.00 0.00 ATOM 24549 H1 SOL 2978 43.300 47.290 13.750 1.00 0.00 ATOM 24550 H2 SOL 2978 44.200 46.090 13.960 1.00 0.00 ATOM 24551 OH2 SOL 2979 54.950 34.260 75.350 1.00 0.00 ATOM 24552 H1 SOL 2979 54.700 35.180 75.350 1.00 0.00 ATOM 24553 H2 SOL 2979 55.460 34.150 74.540 1.00 0.00 ATOM 24554 OH2 SOL 2980 44.500 35.010 64.780 1.00 0.00 ATOM 24555 H1 SOL 2980 44.650 34.130 65.140 1.00 0.00 ATOM 24556 H2 SOL 2980 43.630 34.950 64.380 1.00 0.00 ATOM 24557 OH2 SOL 2981 12.970 22.180 77.250 1.00 0.00 ATOM 24558 H1 SOL 2981 12.400 22.940 77.400 1.00 0.00 ATOM 24559 H2 SOL 2981 12.670 21.530 77.890 1.00 0.00 ATOM 24560 OH2 SOL 2982 51.980 11.790 11.480 1.00 0.00 ATOM 24561 H1 SOL 2982 51.920 11.090 12.130 1.00 0.00 ATOM 24562 H2 SOL 2982 51.210 12.330 11.620 1.00 0.00 ATOM 24563 OH2 SOL 2983 57.480 47.010 10.840 1.00 0.00 ATOM 24564 H1 SOL 2983 56.590 47.300 10.630 1.00 0.00 ATOM 24565 H2 SOL 2983 58.040 47.520 10.260 1.00 0.00 ATOM 24566 OH2 SOL 2984 32.430 26.070 5.270 1.00 0.00 ATOM 24567 H1 SOL 2984 32.650 26.090 6.200 1.00 0.00 ATOM 24568 H2 SOL 2984 31.950 25.260 5.150 1.00 0.00 ATOM 24569 OH2 SOL 2985 12.670 50.210 11.910 1.00 0.00 ATOM 24570 H1 SOL 2985 13.230 50.920 11.610 1.00 0.00 ATOM 24571 H2 SOL 2985 13.230 49.440 11.890 1.00 0.00 ATOM 24572 OH2 SOL 2986 42.080 13.820 16.950 1.00 0.00 ATOM 24573 H1 SOL 2986 41.190 13.640 16.650 1.00 0.00 ATOM 24574 H2 SOL 2986 42.520 12.970 16.920 1.00 0.00 ATOM 24575 OH2 SOL 2987 36.470 9.500 79.800 1.00 0.00 ATOM 24576 H1 SOL 2987 35.550 9.470 79.550 1.00 0.00 ATOM 24577 H2 SOL 2987 36.720 10.410 79.680 1.00 0.00 ATOM 24578 OH2 SOL 2988 12.580 56.140 3.850 1.00 0.00 ATOM 24579 H1 SOL 2988 12.620 56.930 3.310 1.00 0.00 ATOM 24580 H2 SOL 2988 12.800 56.450 4.730 1.00 0.00 ATOM 24581 OH2 SOL 2989 57.160 18.540 13.710 1.00 0.00 ATOM 24582 H1 SOL 2989 56.840 17.710 14.070 1.00 0.00 ATOM 24583 H2 SOL 2989 57.060 19.160 14.440 1.00 0.00 ATOM 24584 OH2 SOL 2990 17.240 49.030 67.710 1.00 0.00 ATOM 24585 H1 SOL 2990 17.110 49.980 67.710 1.00 0.00 ATOM 24586 H2 SOL 2990 18.050 48.900 67.210 1.00 0.00 ATOM 24587 OH2 SOL 2991 24.590 53.530 19.290 1.00 0.00 ATOM 24588 H1 SOL 2991 23.750 53.410 19.730 1.00 0.00 ATOM 24589 H2 SOL 2991 24.420 54.160 18.600 1.00 0.00 ATOM 24590 OH2 SOL 2992 43.450 58.120 66.410 1.00 0.00 ATOM 24591 H1 SOL 2992 43.750 58.530 67.220 1.00 0.00 ATOM 24592 H2 SOL 2992 43.160 57.250 66.680 1.00 0.00 ATOM 24593 OH2 SOL 2993 27.680 53.560 15.070 1.00 0.00 ATOM 24594 H1 SOL 2993 28.450 54.090 15.280 1.00 0.00 ATOM 24595 H2 SOL 2993 27.260 53.400 15.920 1.00 0.00 ATOM 24596 OH2 SOL 2994 20.570 32.460 5.430 1.00 0.00 ATOM 24597 H1 SOL 2994 20.060 31.700 5.700 1.00 0.00 ATOM 24598 H2 SOL 2994 21.360 32.430 5.950 1.00 0.00 ATOM 24599 OH2 SOL 2995 22.820 -0.140 19.620 1.00 0.00 ATOM 24600 H1 SOL 2995 23.230 0.090 20.460 1.00 0.00 ATOM 24601 H2 SOL 2995 22.060 0.430 19.560 1.00 0.00 ATOM 24602 OH2 SOL 2996 44.250 39.530 13.700 1.00 0.00 ATOM 24603 H1 SOL 2996 43.490 39.750 13.160 1.00 0.00 ATOM 24604 H2 SOL 2996 44.260 38.570 13.720 1.00 0.00 ATOM 24605 OH2 SOL 2997 11.970 16.910 74.940 1.00 0.00 ATOM 24606 H1 SOL 2997 11.260 17.240 75.490 1.00 0.00 ATOM 24607 H2 SOL 2997 11.660 17.020 74.040 1.00 0.00 ATOM 24608 OH2 SOL 2998 0.600 11.950 5.630 1.00 0.00 ATOM 24609 H1 SOL 2998 1.500 11.840 5.310 1.00 0.00 ATOM 24610 H2 SOL 2998 0.700 12.390 6.470 1.00 0.00 ATOM 24611 OH2 SOL 2999 26.260 53.320 12.770 1.00 0.00 ATOM 24612 H1 SOL 2999 26.780 53.090 13.540 1.00 0.00 ATOM 24613 H2 SOL 2999 26.620 54.150 12.470 1.00 0.00 ATOM 24614 OH2 SOL 3000 23.180 56.240 79.700 1.00 0.00 ATOM 24615 H1 SOL 3000 22.700 56.880 79.170 1.00 0.00 ATOM 24616 H2 SOL 3000 22.510 55.610 79.960 1.00 0.00 ATOM 24617 OH2 SOL 3001 36.900 26.520 5.360 1.00 0.00 ATOM 24618 H1 SOL 3001 37.280 25.680 5.610 1.00 0.00 ATOM 24619 H2 SOL 3001 37.140 26.630 4.440 1.00 0.00 ATOM 24620 OH2 SOL 3002 13.020 9.730 71.780 1.00 0.00 ATOM 24621 H1 SOL 3002 13.640 10.350 71.410 1.00 0.00 ATOM 24622 H2 SOL 3002 12.180 9.970 71.380 1.00 0.00 ATOM 24623 OH2 SOL 3003 50.950 42.880 74.130 1.00 0.00 ATOM 24624 H1 SOL 3003 51.260 42.730 73.230 1.00 0.00 ATOM 24625 H2 SOL 3003 50.360 43.630 74.050 1.00 0.00 ATOM 24626 OH2 SOL 3004 49.930 18.290 18.080 1.00 0.00 ATOM 24627 H1 SOL 3004 50.250 19.170 17.900 1.00 0.00 ATOM 24628 H2 SOL 3004 49.120 18.430 18.580 1.00 0.00 ATOM 24629 OH2 SOL 3005 32.260 31.100 63.700 1.00 0.00 ATOM 24630 H1 SOL 3005 31.330 30.900 63.540 1.00 0.00 ATOM 24631 H2 SOL 3005 32.630 30.270 64.000 1.00 0.00 ATOM 24632 OH2 SOL 3006 21.520 37.860 80.370 1.00 0.00 ATOM 24633 H1 SOL 3006 21.390 38.800 80.260 1.00 0.00 ATOM 24634 H2 SOL 3006 20.780 37.460 79.910 1.00 0.00 ATOM 24635 OH2 SOL 3007 3.600 52.300 18.250 1.00 0.00 ATOM 24636 H1 SOL 3007 4.330 52.910 18.310 1.00 0.00 ATOM 24637 H2 SOL 3007 4.000 51.450 18.060 1.00 0.00 ATOM 24638 OH2 SOL 3008 46.170 18.580 12.450 1.00 0.00 ATOM 24639 H1 SOL 3008 46.380 18.210 11.590 1.00 0.00 ATOM 24640 H2 SOL 3008 45.250 18.810 12.390 1.00 0.00 ATOM 24641 OH2 SOL 3009 17.730 58.340 26.500 1.00 0.00 ATOM 24642 H1 SOL 3009 17.770 57.400 26.340 1.00 0.00 ATOM 24643 H2 SOL 3009 17.040 58.660 25.910 1.00 0.00 ATOM 24644 OH2 SOL 3010 11.830 13.130 14.710 1.00 0.00 ATOM 24645 H1 SOL 3010 11.540 12.370 15.210 1.00 0.00 ATOM 24646 H2 SOL 3010 11.240 13.160 13.950 1.00 0.00 ATOM 24647 OH2 SOL 3011 11.340 0.160 4.560 1.00 0.00 ATOM 24648 H1 SOL 3011 12.230 0.500 4.660 1.00 0.00 ATOM 24649 H2 SOL 3011 11.250 -0.030 3.630 1.00 0.00 ATOM 24650 OH2 SOL 3012 41.600 30.170 71.030 1.00 0.00 ATOM 24651 H1 SOL 3012 42.010 29.650 70.340 1.00 0.00 ATOM 24652 H2 SOL 3012 41.930 29.790 71.850 1.00 0.00 ATOM 24653 OH2 SOL 3013 34.960 54.510 75.570 1.00 0.00 ATOM 24654 H1 SOL 3013 35.380 53.910 74.960 1.00 0.00 ATOM 24655 H2 SOL 3013 34.120 54.100 75.770 1.00 0.00 ATOM 24656 OH2 SOL 3014 13.580 29.530 11.290 1.00 0.00 ATOM 24657 H1 SOL 3014 14.160 30.280 11.390 1.00 0.00 ATOM 24658 H2 SOL 3014 12.710 29.880 11.480 1.00 0.00 ATOM 24659 OH2 SOL 3015 16.920 54.930 11.130 1.00 0.00 ATOM 24660 H1 SOL 3015 17.230 54.070 10.840 1.00 0.00 ATOM 24661 H2 SOL 3015 17.240 55.020 12.030 1.00 0.00 ATOM 24662 OH2 SOL 3016 14.910 28.250 82.440 1.00 0.00 ATOM 24663 H1 SOL 3016 15.560 28.800 82.870 1.00 0.00 ATOM 24664 H2 SOL 3016 15.390 27.450 82.210 1.00 0.00 ATOM 24665 OH2 SOL 3017 2.030 47.350 13.520 1.00 0.00 ATOM 24666 H1 SOL 3017 2.920 47.070 13.320 1.00 0.00 ATOM 24667 H2 SOL 3017 2.050 48.300 13.410 1.00 0.00 ATOM 24668 OH2 SOL 3018 31.450 26.080 1.990 1.00 0.00 ATOM 24669 H1 SOL 3018 32.340 26.310 2.230 1.00 0.00 ATOM 24670 H2 SOL 3018 31.200 26.740 1.340 1.00 0.00 ATOM 24671 OH2 SOL 3019 13.260 24.830 73.040 1.00 0.00 ATOM 24672 H1 SOL 3019 12.560 24.940 73.680 1.00 0.00 ATOM 24673 H2 SOL 3019 13.770 24.090 73.360 1.00 0.00 ATOM 24674 OH2 SOL 3020 9.260 11.840 13.290 1.00 0.00 ATOM 24675 H1 SOL 3020 9.550 11.290 14.010 1.00 0.00 ATOM 24676 H2 SOL 3020 8.710 11.270 12.760 1.00 0.00 ATOM 24677 OH2 SOL 3021 38.230 30.630 72.310 1.00 0.00 ATOM 24678 H1 SOL 3021 38.440 31.490 71.960 1.00 0.00 ATOM 24679 H2 SOL 3021 38.570 30.010 71.660 1.00 0.00 ATOM 24680 OH2 SOL 3022 35.410 18.160 70.860 1.00 0.00 ATOM 24681 H1 SOL 3022 35.910 18.950 70.660 1.00 0.00 ATOM 24682 H2 SOL 3022 34.520 18.340 70.550 1.00 0.00 ATOM 24683 OH2 SOL 3023 36.670 28.510 22.720 1.00 0.00 ATOM 24684 H1 SOL 3023 35.920 28.970 23.100 1.00 0.00 ATOM 24685 H2 SOL 3023 37.070 28.050 23.450 1.00 0.00 ATOM 24686 OH2 SOL 3024 34.880 11.350 15.220 1.00 0.00 ATOM 24687 H1 SOL 3024 35.360 10.800 14.590 1.00 0.00 ATOM 24688 H2 SOL 3024 35.290 11.160 16.060 1.00 0.00 ATOM 24689 OH2 SOL 3025 13.110 1.900 62.990 1.00 0.00 ATOM 24690 H1 SOL 3025 14.000 2.020 62.670 1.00 0.00 ATOM 24691 H2 SOL 3025 12.610 2.600 62.580 1.00 0.00 ATOM 24692 OH2 SOL 3026 50.670 33.670 79.950 1.00 0.00 ATOM 24693 H1 SOL 3026 50.930 33.020 79.300 1.00 0.00 ATOM 24694 H2 SOL 3026 50.040 34.230 79.490 1.00 0.00 ATOM 24695 OH2 SOL 3027 36.530 28.220 79.800 1.00 0.00 ATOM 24696 H1 SOL 3027 36.450 27.590 80.510 1.00 0.00 ATOM 24697 H2 SOL 3027 36.190 27.770 79.030 1.00 0.00 ATOM 24698 OH2 SOL 3028 56.010 33.930 8.370 1.00 0.00 ATOM 24699 H1 SOL 3028 55.890 33.010 8.630 1.00 0.00 ATOM 24700 H2 SOL 3028 56.750 34.230 8.890 1.00 0.00 ATOM 24701 OH2 SOL 3029 8.050 27.780 83.860 1.00 0.00 ATOM 24702 H1 SOL 3029 7.160 28.050 84.090 1.00 0.00 ATOM 24703 H2 SOL 3029 8.150 28.030 82.940 1.00 0.00 ATOM 24704 OH2 SOL 3030 59.020 1.550 81.910 1.00 0.00 ATOM 24705 H1 SOL 3030 59.290 2.370 82.330 1.00 0.00 ATOM 24706 H2 SOL 3030 58.690 1.810 81.050 1.00 0.00 ATOM 24707 OH2 SOL 3031 27.800 7.930 1.320 1.00 0.00 ATOM 24708 H1 SOL 3031 27.730 8.010 2.270 1.00 0.00 ATOM 24709 H2 SOL 3031 27.990 8.810 1.010 1.00 0.00 ATOM 24710 OH2 SOL 3032 44.350 25.810 63.190 1.00 0.00 ATOM 24711 H1 SOL 3032 43.510 25.500 63.520 1.00 0.00 ATOM 24712 H2 SOL 3032 44.510 26.630 63.660 1.00 0.00 ATOM 24713 OH2 SOL 3033 12.120 44.850 74.530 1.00 0.00 ATOM 24714 H1 SOL 3033 12.170 44.290 73.750 1.00 0.00 ATOM 24715 H2 SOL 3033 12.630 44.380 75.190 1.00 0.00 ATOM 24716 OH2 SOL 3034 47.000 16.580 84.050 1.00 0.00 ATOM 24717 H1 SOL 3034 47.080 15.770 84.550 1.00 0.00 ATOM 24718 H2 SOL 3034 46.580 16.320 83.230 1.00 0.00 ATOM 24719 OH2 SOL 3035 57.660 56.290 10.450 1.00 0.00 ATOM 24720 H1 SOL 3035 57.910 57.120 10.050 1.00 0.00 ATOM 24721 H2 SOL 3035 56.720 56.200 10.250 1.00 0.00 ATOM 24722 OH2 SOL 3036 23.260 33.450 4.380 1.00 0.00 ATOM 24723 H1 SOL 3036 22.330 33.290 4.200 1.00 0.00 ATOM 24724 H2 SOL 3036 23.660 33.540 3.520 1.00 0.00 ATOM 24725 OH2 SOL 3037 29.140 54.260 1.180 1.00 0.00 ATOM 24726 H1 SOL 3037 28.500 54.950 1.340 1.00 0.00 ATOM 24727 H2 SOL 3037 29.220 53.800 2.010 1.00 0.00 ATOM 24728 OH2 SOL 3038 49.540 43.640 68.210 1.00 0.00 ATOM 24729 H1 SOL 3038 49.450 44.570 68.440 1.00 0.00 ATOM 24730 H2 SOL 3038 50.450 43.540 67.960 1.00 0.00 ATOM 24731 OH2 SOL 3039 38.250 51.690 72.090 1.00 0.00 ATOM 24732 H1 SOL 3039 38.440 50.750 72.070 1.00 0.00 ATOM 24733 H2 SOL 3039 38.480 51.990 71.210 1.00 0.00 ATOM 24734 OH2 SOL 3040 46.780 50.740 75.170 1.00 0.00 ATOM 24735 H1 SOL 3040 47.160 50.100 75.770 1.00 0.00 ATOM 24736 H2 SOL 3040 47.110 51.590 75.460 1.00 0.00 ATOM 24737 OH2 SOL 3041 2.290 19.490 76.040 1.00 0.00 ATOM 24738 H1 SOL 3041 2.150 19.940 76.870 1.00 0.00 ATOM 24739 H2 SOL 3041 1.580 18.850 75.980 1.00 0.00 ATOM 24740 OH2 SOL 3042 31.750 34.090 68.450 1.00 0.00 ATOM 24741 H1 SOL 3042 30.820 33.930 68.590 1.00 0.00 ATOM 24742 H2 SOL 3042 32.090 34.350 69.310 1.00 0.00 ATOM 24743 OH2 SOL 3043 32.660 5.710 10.710 1.00 0.00 ATOM 24744 H1 SOL 3043 32.890 4.910 10.240 1.00 0.00 ATOM 24745 H2 SOL 3043 33.220 5.710 11.480 1.00 0.00 ATOM 24746 OH2 SOL 3044 22.960 53.740 76.200 1.00 0.00 ATOM 24747 H1 SOL 3044 22.510 52.920 76.350 1.00 0.00 ATOM 24748 H2 SOL 3044 22.310 54.420 76.380 1.00 0.00 ATOM 24749 OH2 SOL 3045 60.290 6.420 9.360 1.00 0.00 ATOM 24750 H1 SOL 3045 59.340 6.460 9.410 1.00 0.00 ATOM 24751 H2 SOL 3045 60.490 6.540 8.430 1.00 0.00 ATOM 24752 OH2 SOL 3046 7.290 51.240 12.760 1.00 0.00 ATOM 24753 H1 SOL 3046 7.960 51.830 13.100 1.00 0.00 ATOM 24754 H2 SOL 3046 6.600 51.820 12.420 1.00 0.00 ATOM 24755 OH2 SOL 3047 34.630 48.040 67.520 1.00 0.00 ATOM 24756 H1 SOL 3047 34.130 47.670 68.250 1.00 0.00 ATOM 24757 H2 SOL 3047 35.540 47.840 67.730 1.00 0.00 ATOM 24758 OH2 SOL 3048 36.770 49.950 9.300 1.00 0.00 ATOM 24759 H1 SOL 3048 36.630 50.810 8.920 1.00 0.00 ATOM 24760 H2 SOL 3048 35.900 49.640 9.540 1.00 0.00 ATOM 24761 OH2 SOL 3049 48.660 37.850 76.920 1.00 0.00 ATOM 24762 H1 SOL 3049 47.910 38.100 77.460 1.00 0.00 ATOM 24763 H2 SOL 3049 48.630 38.460 76.180 1.00 0.00 ATOM 24764 OH2 SOL 3050 56.630 5.790 24.530 1.00 0.00 ATOM 24765 H1 SOL 3050 57.550 6.050 24.430 1.00 0.00 ATOM 24766 H2 SOL 3050 56.450 5.250 23.750 1.00 0.00 ATOM 24767 OH2 SOL 3051 4.730 37.040 69.000 1.00 0.00 ATOM 24768 H1 SOL 3051 4.820 37.170 68.060 1.00 0.00 ATOM 24769 H2 SOL 3051 4.180 36.260 69.090 1.00 0.00 ATOM 24770 OH2 SOL 3052 37.240 58.260 0.100 1.00 0.00 ATOM 24771 H1 SOL 3052 36.440 58.590 0.510 1.00 0.00 ATOM 24772 H2 SOL 3052 37.030 57.360 -0.130 1.00 0.00 ATOM 24773 OH2 SOL 3053 16.330 29.740 12.750 1.00 0.00 ATOM 24774 H1 SOL 3053 16.880 30.090 13.460 1.00 0.00 ATOM 24775 H2 SOL 3053 15.620 30.380 12.670 1.00 0.00 ATOM 24776 OH2 SOL 3054 48.350 56.150 74.900 1.00 0.00 ATOM 24777 H1 SOL 3054 47.930 56.580 74.150 1.00 0.00 ATOM 24778 H2 SOL 3054 48.700 55.340 74.540 1.00 0.00 ATOM 24779 OH2 SOL 3055 5.800 33.330 6.140 1.00 0.00 ATOM 24780 H1 SOL 3055 6.550 33.420 5.550 1.00 0.00 ATOM 24781 H2 SOL 3055 5.990 32.550 6.660 1.00 0.00 ATOM 24782 OH2 SOL 3056 35.140 23.370 83.630 1.00 0.00 ATOM 24783 H1 SOL 3056 35.060 24.100 84.250 1.00 0.00 ATOM 24784 H2 SOL 3056 35.180 23.800 82.770 1.00 0.00 ATOM 24785 OH2 SOL 3057 24.740 15.100 8.720 1.00 0.00 ATOM 24786 H1 SOL 3057 24.910 14.730 7.850 1.00 0.00 ATOM 24787 H2 SOL 3057 25.580 15.460 9.000 1.00 0.00 ATOM 24788 OH2 SOL 3058 59.670 34.010 80.010 1.00 0.00 ATOM 24789 H1 SOL 3058 58.950 33.430 79.750 1.00 0.00 ATOM 24790 H2 SOL 3058 59.590 34.070 80.960 1.00 0.00 ATOM 24791 OH2 SOL 3059 1.140 16.780 75.480 1.00 0.00 ATOM 24792 H1 SOL 3059 0.470 16.970 74.820 1.00 0.00 ATOM 24793 H2 SOL 3059 1.850 16.380 74.990 1.00 0.00 ATOM 24794 OH2 SOL 3060 39.050 8.580 10.330 1.00 0.00 ATOM 24795 H1 SOL 3060 38.170 8.880 10.580 1.00 0.00 ATOM 24796 H2 SOL 3060 39.000 8.470 9.380 1.00 0.00 ATOM 24797 OH2 SOL 3061 46.870 51.650 21.240 1.00 0.00 ATOM 24798 H1 SOL 3061 46.320 50.980 20.830 1.00 0.00 ATOM 24799 H2 SOL 3061 46.970 52.320 20.560 1.00 0.00 ATOM 24800 OH2 SOL 3062 21.010 49.080 75.160 1.00 0.00 ATOM 24801 H1 SOL 3062 21.010 49.450 76.050 1.00 0.00 ATOM 24802 H2 SOL 3062 20.350 49.580 74.690 1.00 0.00 ATOM 24803 OH2 SOL 3063 13.200 56.480 74.900 1.00 0.00 ATOM 24804 H1 SOL 3063 12.300 56.770 75.040 1.00 0.00 ATOM 24805 H2 SOL 3063 13.740 57.200 75.210 1.00 0.00 ATOM 24806 OH2 SOL 3064 30.430 9.360 67.600 1.00 0.00 ATOM 24807 H1 SOL 3064 29.690 8.780 67.780 1.00 0.00 ATOM 24808 H2 SOL 3064 30.840 8.990 66.820 1.00 0.00 ATOM 24809 OH2 SOL 3065 44.020 7.380 14.350 1.00 0.00 ATOM 24810 H1 SOL 3065 43.610 7.620 15.180 1.00 0.00 ATOM 24811 H2 SOL 3065 44.960 7.440 14.520 1.00 0.00 ATOM 24812 OH2 SOL 3066 1.100 25.400 15.680 1.00 0.00 ATOM 24813 H1 SOL 3066 0.770 26.300 15.600 1.00 0.00 ATOM 24814 H2 SOL 3066 0.620 24.910 15.010 1.00 0.00 ATOM 24815 OH2 SOL 3067 21.390 8.510 5.170 1.00 0.00 ATOM 24816 H1 SOL 3067 21.420 9.290 4.620 1.00 0.00 ATOM 24817 H2 SOL 3067 20.450 8.320 5.260 1.00 0.00 ATOM 24818 OH2 SOL 3068 54.680 18.600 1.150 1.00 0.00 ATOM 24819 H1 SOL 3068 55.240 18.170 1.790 1.00 0.00 ATOM 24820 H2 SOL 3068 55.000 18.310 0.300 1.00 0.00 ATOM 24821 OH2 SOL 3069 46.200 6.520 11.010 1.00 0.00 ATOM 24822 H1 SOL 3069 46.750 6.060 10.380 1.00 0.00 ATOM 24823 H2 SOL 3069 46.590 6.330 11.860 1.00 0.00 ATOM 24824 OH2 SOL 3070 51.560 38.880 77.290 1.00 0.00 ATOM 24825 H1 SOL 3070 51.050 38.230 76.810 1.00 0.00 ATOM 24826 H2 SOL 3070 51.880 39.480 76.620 1.00 0.00 ATOM 24827 OH2 SOL 3071 38.380 30.230 83.480 1.00 0.00 ATOM 24828 H1 SOL 3071 38.690 31.080 83.780 1.00 0.00 ATOM 24829 H2 SOL 3071 37.940 30.410 82.650 1.00 0.00 ATOM 24830 OH2 SOL 3072 38.170 43.170 5.260 1.00 0.00 ATOM 24831 H1 SOL 3072 38.300 42.330 5.680 1.00 0.00 ATOM 24832 H2 SOL 3072 38.760 43.770 5.730 1.00 0.00 ATOM 24833 OH2 SOL 3073 9.150 51.030 72.400 1.00 0.00 ATOM 24834 H1 SOL 3073 9.250 51.890 72.000 1.00 0.00 ATOM 24835 H2 SOL 3073 8.300 50.710 72.070 1.00 0.00 ATOM 24836 OH2 SOL 3074 5.030 30.500 0.440 1.00 0.00 ATOM 24837 H1 SOL 3074 4.190 30.590 -0.010 1.00 0.00 ATOM 24838 H2 SOL 3074 5.040 29.590 0.740 1.00 0.00 ATOM 24839 OH2 SOL 3075 13.790 8.260 60.530 1.00 0.00 ATOM 24840 H1 SOL 3075 13.860 7.620 61.230 1.00 0.00 ATOM 24841 H2 SOL 3075 13.100 8.860 60.820 1.00 0.00 ATOM 24842 OH2 SOL 3076 20.630 14.530 17.430 1.00 0.00 ATOM 24843 H1 SOL 3076 21.320 15.120 17.760 1.00 0.00 ATOM 24844 H2 SOL 3076 20.800 14.450 16.500 1.00 0.00 ATOM 24845 OH2 SOL 3077 59.030 31.890 65.620 1.00 0.00 ATOM 24846 H1 SOL 3077 59.770 31.790 65.020 1.00 0.00 ATOM 24847 H2 SOL 3077 58.830 32.820 65.610 1.00 0.00 ATOM 24848 OH2 SOL 3078 16.430 21.740 10.120 1.00 0.00 ATOM 24849 H1 SOL 3078 17.180 21.310 10.540 1.00 0.00 ATOM 24850 H2 SOL 3078 15.810 21.890 10.830 1.00 0.00 ATOM 24851 OH2 SOL 3079 56.660 14.420 77.220 1.00 0.00 ATOM 24852 H1 SOL 3079 56.940 13.950 76.430 1.00 0.00 ATOM 24853 H2 SOL 3079 55.780 14.090 77.390 1.00 0.00 ATOM 24854 OH2 SOL 3080 34.570 22.810 11.220 1.00 0.00 ATOM 24855 H1 SOL 3080 33.620 22.860 11.320 1.00 0.00 ATOM 24856 H2 SOL 3080 34.850 22.230 11.940 1.00 0.00 ATOM 24857 OH2 SOL 3081 37.160 12.230 67.760 1.00 0.00 ATOM 24858 H1 SOL 3081 36.590 12.250 68.530 1.00 0.00 ATOM 24859 H2 SOL 3081 36.820 12.910 67.190 1.00 0.00 ATOM 24860 OH2 SOL 3082 23.110 7.860 70.370 1.00 0.00 ATOM 24861 H1 SOL 3082 23.350 7.110 70.920 1.00 0.00 ATOM 24862 H2 SOL 3082 23.110 7.510 69.480 1.00 0.00 ATOM 24863 OH2 SOL 3083 57.460 23.400 77.180 1.00 0.00 ATOM 24864 H1 SOL 3083 57.930 24.210 77.370 1.00 0.00 ATOM 24865 H2 SOL 3083 57.010 23.570 76.350 1.00 0.00 ATOM 24866 OH2 SOL 3084 56.340 31.500 9.860 1.00 0.00 ATOM 24867 H1 SOL 3084 57.020 31.360 9.200 1.00 0.00 ATOM 24868 H2 SOL 3084 55.990 30.630 10.040 1.00 0.00 ATOM 24869 OH2 SOL 3085 40.210 30.020 74.260 1.00 0.00 ATOM 24870 H1 SOL 3085 40.970 29.450 74.140 1.00 0.00 ATOM 24871 H2 SOL 3085 39.670 29.880 73.490 1.00 0.00 ATOM 24872 OH2 SOL 3086 4.210 18.070 21.680 1.00 0.00 ATOM 24873 H1 SOL 3086 4.310 18.550 22.500 1.00 0.00 ATOM 24874 H2 SOL 3086 3.340 17.680 21.740 1.00 0.00 ATOM 24875 OH2 SOL 3087 10.020 45.970 18.610 1.00 0.00 ATOM 24876 H1 SOL 3087 10.400 46.760 19.000 1.00 0.00 ATOM 24877 H2 SOL 3087 9.840 45.400 19.350 1.00 0.00 ATOM 24878 OH2 SOL 3088 14.860 19.900 81.480 1.00 0.00 ATOM 24879 H1 SOL 3088 14.220 20.150 82.150 1.00 0.00 ATOM 24880 H2 SOL 3088 15.270 19.110 81.830 1.00 0.00 ATOM 24881 OH2 SOL 3089 10.500 28.300 21.350 1.00 0.00 ATOM 24882 H1 SOL 3089 11.280 28.840 21.270 1.00 0.00 ATOM 24883 H2 SOL 3089 10.280 28.050 20.450 1.00 0.00 ATOM 24884 OH2 SOL 3090 55.330 25.710 20.040 1.00 0.00 ATOM 24885 H1 SOL 3090 55.410 25.630 19.090 1.00 0.00 ATOM 24886 H2 SOL 3090 55.650 24.870 20.380 1.00 0.00 ATOM 24887 OH2 SOL 3091 0.800 3.750 6.600 1.00 0.00 ATOM 24888 H1 SOL 3091 1.370 3.430 5.900 1.00 0.00 ATOM 24889 H2 SOL 3091 0.850 4.700 6.540 1.00 0.00 ATOM 24890 OH2 SOL 3092 3.830 2.540 82.110 1.00 0.00 ATOM 24891 H1 SOL 3092 3.820 3.380 82.560 1.00 0.00 ATOM 24892 H2 SOL 3092 3.700 1.890 82.800 1.00 0.00 ATOM 24893 OH2 SOL 3093 50.300 14.300 76.290 1.00 0.00 ATOM 24894 H1 SOL 3093 50.570 15.170 75.990 1.00 0.00 ATOM 24895 H2 SOL 3093 50.960 13.710 75.940 1.00 0.00 ATOM 24896 OH2 SOL 3094 5.830 24.520 9.920 1.00 0.00 ATOM 24897 H1 SOL 3094 5.260 24.970 9.300 1.00 0.00 ATOM 24898 H2 SOL 3094 5.230 24.090 10.530 1.00 0.00 ATOM 24899 OH2 SOL 3095 34.000 4.930 77.340 1.00 0.00 ATOM 24900 H1 SOL 3095 33.090 5.220 77.450 1.00 0.00 ATOM 24901 H2 SOL 3095 34.360 4.930 78.220 1.00 0.00 ATOM 24902 OH2 SOL 3096 32.550 29.340 18.450 1.00 0.00 ATOM 24903 H1 SOL 3096 32.590 28.390 18.330 1.00 0.00 ATOM 24904 H2 SOL 3096 31.890 29.630 17.820 1.00 0.00 ATOM 24905 OH2 SOL 3097 33.080 45.400 12.330 1.00 0.00 ATOM 24906 H1 SOL 3097 33.420 44.510 12.250 1.00 0.00 ATOM 24907 H2 SOL 3097 33.860 45.950 12.430 1.00 0.00 ATOM 24908 OH2 SOL 3098 54.870 22.860 19.180 1.00 0.00 ATOM 24909 H1 SOL 3098 54.010 22.920 19.600 1.00 0.00 ATOM 24910 H2 SOL 3098 55.080 21.920 19.190 1.00 0.00 ATOM 24911 OH2 SOL 3099 9.520 31.330 3.270 1.00 0.00 ATOM 24912 H1 SOL 3099 8.770 31.200 2.700 1.00 0.00 ATOM 24913 H2 SOL 3099 10.120 31.880 2.760 1.00 0.00 ATOM 24914 OH2 SOL 3100 13.320 56.530 69.750 1.00 0.00 ATOM 24915 H1 SOL 3100 12.960 56.470 70.640 1.00 0.00 ATOM 24916 H2 SOL 3100 12.610 56.220 69.190 1.00 0.00 ATOM 24917 OH2 SOL 3101 36.200 26.500 81.950 1.00 0.00 ATOM 24918 H1 SOL 3101 36.840 26.650 82.640 1.00 0.00 ATOM 24919 H2 SOL 3101 35.350 26.680 82.360 1.00 0.00 ATOM 24920 OH2 SOL 3102 52.830 4.190 82.000 1.00 0.00 ATOM 24921 H1 SOL 3102 53.370 4.290 82.780 1.00 0.00 ATOM 24922 H2 SOL 3102 51.930 4.140 82.340 1.00 0.00 ATOM 24923 OH2 SOL 3103 45.600 26.130 67.810 1.00 0.00 ATOM 24924 H1 SOL 3103 45.890 25.860 66.940 1.00 0.00 ATOM 24925 H2 SOL 3103 44.690 26.400 67.680 1.00 0.00 ATOM 24926 OH2 SOL 3104 35.870 4.800 1.350 1.00 0.00 ATOM 24927 H1 SOL 3104 36.460 4.700 0.610 1.00 0.00 ATOM 24928 H2 SOL 3104 35.160 4.180 1.190 1.00 0.00 ATOM 24929 OH2 SOL 3105 11.290 17.970 21.270 1.00 0.00 ATOM 24930 H1 SOL 3105 10.740 18.110 20.510 1.00 0.00 ATOM 24931 H2 SOL 3105 11.470 17.030 21.270 1.00 0.00 ATOM 24932 OH2 SOL 3106 60.410 23.090 16.620 1.00 0.00 ATOM 24933 H1 SOL 3106 60.950 22.310 16.710 1.00 0.00 ATOM 24934 H2 SOL 3106 60.780 23.560 15.880 1.00 0.00 ATOM 24935 OH2 SOL 3107 25.720 5.800 17.770 1.00 0.00 ATOM 24936 H1 SOL 3107 25.670 6.370 18.540 1.00 0.00 ATOM 24937 H2 SOL 3107 26.560 6.020 17.370 1.00 0.00 ATOM 24938 OH2 SOL 3108 23.790 20.040 6.840 1.00 0.00 ATOM 24939 H1 SOL 3108 23.400 19.180 7.010 1.00 0.00 ATOM 24940 H2 SOL 3108 23.110 20.510 6.350 1.00 0.00 ATOM 24941 OH2 SOL 3109 5.590 40.830 74.730 1.00 0.00 ATOM 24942 H1 SOL 3109 5.940 40.810 75.620 1.00 0.00 ATOM 24943 H2 SOL 3109 4.680 40.570 74.830 1.00 0.00 ATOM 24944 OH2 SOL 3110 17.540 19.970 74.500 1.00 0.00 ATOM 24945 H1 SOL 3110 17.160 20.440 75.240 1.00 0.00 ATOM 24946 H2 SOL 3110 17.410 19.050 74.710 1.00 0.00 ATOM 24947 OH2 SOL 3111 0.950 30.910 15.370 1.00 0.00 ATOM 24948 H1 SOL 3111 0.020 31.060 15.540 1.00 0.00 ATOM 24949 H2 SOL 3111 1.380 31.700 15.660 1.00 0.00 ATOM 24950 OH2 SOL 3112 7.350 18.050 83.190 1.00 0.00 ATOM 24951 H1 SOL 3112 7.010 18.580 82.470 1.00 0.00 ATOM 24952 H2 SOL 3112 7.900 17.390 82.760 1.00 0.00 ATOM 24953 OH2 SOL 3113 31.450 5.990 77.500 1.00 0.00 ATOM 24954 H1 SOL 3113 30.850 5.360 77.900 1.00 0.00 ATOM 24955 H2 SOL 3113 31.000 6.290 76.710 1.00 0.00 ATOM 24956 OH2 SOL 3114 12.600 5.940 3.650 1.00 0.00 ATOM 24957 H1 SOL 3114 13.290 6.550 3.380 1.00 0.00 ATOM 24958 H2 SOL 3114 12.090 5.790 2.850 1.00 0.00 ATOM 24959 OH2 SOL 3115 29.930 34.880 20.800 1.00 0.00 ATOM 24960 H1 SOL 3115 30.010 35.310 21.650 1.00 0.00 ATOM 24961 H2 SOL 3115 29.230 35.350 20.360 1.00 0.00 ATOM 24962 OH2 SOL 3116 54.830 56.450 21.210 1.00 0.00 ATOM 24963 H1 SOL 3116 54.020 56.950 21.260 1.00 0.00 ATOM 24964 H2 SOL 3116 54.790 55.860 21.960 1.00 0.00 ATOM 24965 OH2 SOL 3117 17.280 40.660 6.700 1.00 0.00 ATOM 24966 H1 SOL 3117 17.620 39.800 6.950 1.00 0.00 ATOM 24967 H2 SOL 3117 17.910 40.990 6.060 1.00 0.00 ATOM 24968 OH2 SOL 3118 57.430 22.480 12.540 1.00 0.00 ATOM 24969 H1 SOL 3118 58.270 22.050 12.410 1.00 0.00 ATOM 24970 H2 SOL 3118 57.100 22.130 13.370 1.00 0.00 ATOM 24971 OH2 SOL 3119 37.260 22.050 75.620 1.00 0.00 ATOM 24972 H1 SOL 3119 36.530 21.640 75.150 1.00 0.00 ATOM 24973 H2 SOL 3119 37.440 21.460 76.350 1.00 0.00 ATOM 24974 OH2 SOL 3120 43.700 21.090 0.890 1.00 0.00 ATOM 24975 H1 SOL 3120 44.320 20.360 0.960 1.00 0.00 ATOM 24976 H2 SOL 3120 44.230 21.820 0.580 1.00 0.00 ATOM 24977 OH2 SOL 3121 29.500 7.430 26.970 1.00 0.00 ATOM 24978 H1 SOL 3121 29.410 8.330 26.670 1.00 0.00 ATOM 24979 H2 SOL 3121 30.150 7.030 26.400 1.00 0.00 ATOM 24980 OH2 SOL 3122 12.430 28.090 79.120 1.00 0.00 ATOM 24981 H1 SOL 3122 12.350 29.010 78.870 1.00 0.00 ATOM 24982 H2 SOL 3122 12.370 27.620 78.290 1.00 0.00 ATOM 24983 OH2 SOL 3123 35.090 8.120 9.310 1.00 0.00 ATOM 24984 H1 SOL 3123 35.130 7.420 8.660 1.00 0.00 ATOM 24985 H2 SOL 3123 35.860 7.970 9.860 1.00 0.00 ATOM 24986 OH2 SOL 3124 2.400 6.530 77.120 1.00 0.00 ATOM 24987 H1 SOL 3124 2.740 6.210 76.280 1.00 0.00 ATOM 24988 H2 SOL 3124 2.610 5.830 77.740 1.00 0.00 ATOM 24989 OH2 SOL 3125 55.720 13.300 83.020 1.00 0.00 ATOM 24990 H1 SOL 3125 54.880 13.120 83.440 1.00 0.00 ATOM 24991 H2 SOL 3125 56.000 14.140 83.390 1.00 0.00 ATOM 24992 OH2 SOL 3126 16.200 21.050 6.120 1.00 0.00 ATOM 24993 H1 SOL 3126 15.380 21.330 6.540 1.00 0.00 ATOM 24994 H2 SOL 3126 16.800 21.780 6.270 1.00 0.00 ATOM 24995 OH2 SOL 3127 6.740 5.540 25.810 1.00 0.00 ATOM 24996 H1 SOL 3127 7.560 5.960 25.530 1.00 0.00 ATOM 24997 H2 SOL 3127 6.280 5.370 24.990 1.00 0.00 ATOM 24998 OH2 SOL 3128 34.560 11.640 20.910 1.00 0.00 ATOM 24999 H1 SOL 3128 35.290 11.380 20.350 1.00 0.00 ATOM 25000 H2 SOL 3128 33.780 11.390 20.410 1.00 0.00 ATOM 25001 OH2 SOL 3129 23.900 50.190 19.340 1.00 0.00 ATOM 25002 H1 SOL 3129 23.730 50.230 18.400 1.00 0.00 ATOM 25003 H2 SOL 3129 24.710 49.670 19.410 1.00 0.00 ATOM 25004 OH2 SOL 3130 12.760 5.550 8.450 1.00 0.00 ATOM 25005 H1 SOL 3130 12.860 6.030 9.260 1.00 0.00 ATOM 25006 H2 SOL 3130 12.920 4.640 8.680 1.00 0.00 ATOM 25007 OH2 SOL 3131 60.580 41.600 17.190 1.00 0.00 ATOM 25008 H1 SOL 3131 60.350 41.370 16.290 1.00 0.00 ATOM 25009 H2 SOL 3131 60.000 41.070 17.730 1.00 0.00 ATOM 25010 OH2 SOL 3132 12.520 55.770 13.140 1.00 0.00 ATOM 25011 H1 SOL 3132 13.330 55.260 13.120 1.00 0.00 ATOM 25012 H2 SOL 3132 11.950 55.300 13.750 1.00 0.00 ATOM 25013 OH2 SOL 3133 28.490 57.720 83.670 1.00 0.00 ATOM 25014 H1 SOL 3133 28.220 58.590 83.360 1.00 0.00 ATOM 25015 H2 SOL 3133 27.670 57.230 83.730 1.00 0.00 ATOM 25016 OH2 SOL 3134 26.070 38.600 17.230 1.00 0.00 ATOM 25017 H1 SOL 3134 25.360 38.000 17.000 1.00 0.00 ATOM 25018 H2 SOL 3134 25.630 39.340 17.650 1.00 0.00 ATOM 25019 OH2 SOL 3135 41.130 45.600 20.610 1.00 0.00 ATOM 25020 H1 SOL 3135 41.320 44.970 19.920 1.00 0.00 ATOM 25021 H2 SOL 3135 41.900 46.160 20.640 1.00 0.00 ATOM 25022 OH2 SOL 3136 22.030 4.840 82.130 1.00 0.00 ATOM 25023 H1 SOL 3136 22.210 5.710 81.750 1.00 0.00 ATOM 25024 H2 SOL 3136 21.440 4.420 81.500 1.00 0.00 ATOM 25025 OH2 SOL 3137 49.610 20.680 14.440 1.00 0.00 ATOM 25026 H1 SOL 3137 49.490 21.510 13.980 1.00 0.00 ATOM 25027 H2 SOL 3137 49.710 20.930 15.360 1.00 0.00 ATOM 25028 OH2 SOL 3138 6.550 9.340 1.900 1.00 0.00 ATOM 25029 H1 SOL 3138 6.200 8.900 1.120 1.00 0.00 ATOM 25030 H2 SOL 3138 6.580 8.650 2.570 1.00 0.00 ATOM 25031 OH2 SOL 3139 38.900 30.430 25.270 1.00 0.00 ATOM 25032 H1 SOL 3139 38.180 30.740 24.720 1.00 0.00 ATOM 25033 H2 SOL 3139 38.760 29.480 25.340 1.00 0.00 ATOM 25034 OH2 SOL 3140 51.030 33.960 66.940 1.00 0.00 ATOM 25035 H1 SOL 3140 50.420 34.240 66.260 1.00 0.00 ATOM 25036 H2 SOL 3140 51.430 33.160 66.600 1.00 0.00 ATOM 25037 OH2 SOL 3141 55.840 25.500 84.200 1.00 0.00 ATOM 25038 H1 SOL 3141 55.070 25.720 83.670 1.00 0.00 ATOM 25039 H2 SOL 3141 56.540 25.370 83.560 1.00 0.00 ATOM 25040 OH2 SOL 3142 36.730 46.900 11.820 1.00 0.00 ATOM 25041 H1 SOL 3142 35.860 47.290 11.710 1.00 0.00 ATOM 25042 H2 SOL 3142 37.030 46.710 10.930 1.00 0.00 ATOM 25043 OH2 SOL 3143 22.200 22.350 72.940 1.00 0.00 ATOM 25044 H1 SOL 3143 21.450 21.780 73.060 1.00 0.00 ATOM 25045 H2 SOL 3143 22.620 22.040 72.130 1.00 0.00 ATOM 25046 OH2 SOL 3144 6.050 49.390 9.150 1.00 0.00 ATOM 25047 H1 SOL 3144 6.360 49.140 10.020 1.00 0.00 ATOM 25048 H2 SOL 3144 5.620 48.600 8.810 1.00 0.00 ATOM 25049 OH2 SOL 3145 46.080 33.010 67.670 1.00 0.00 ATOM 25050 H1 SOL 3145 45.260 32.670 68.020 1.00 0.00 ATOM 25051 H2 SOL 3145 46.400 33.610 68.340 1.00 0.00 ATOM 25052 OH2 SOL 3146 56.630 9.330 69.910 1.00 0.00 ATOM 25053 H1 SOL 3146 57.260 9.220 69.200 1.00 0.00 ATOM 25054 H2 SOL 3146 55.980 9.940 69.550 1.00 0.00 ATOM 25055 OH2 SOL 3147 48.210 16.540 80.530 1.00 0.00 ATOM 25056 H1 SOL 3147 48.080 16.170 79.660 1.00 0.00 ATOM 25057 H2 SOL 3147 49.130 16.810 80.540 1.00 0.00 ATOM 25058 OH2 SOL 3148 9.950 54.220 74.590 1.00 0.00 ATOM 25059 H1 SOL 3148 10.190 54.020 75.490 1.00 0.00 ATOM 25060 H2 SOL 3148 10.540 53.680 74.060 1.00 0.00 ATOM 25061 OH2 SOL 3149 11.330 20.560 1.710 1.00 0.00 ATOM 25062 H1 SOL 3149 10.590 20.370 1.140 1.00 0.00 ATOM 25063 H2 SOL 3149 10.940 20.740 2.570 1.00 0.00 ATOM 25064 OH2 SOL 3150 15.380 19.070 9.100 1.00 0.00 ATOM 25065 H1 SOL 3150 15.520 18.710 8.220 1.00 0.00 ATOM 25066 H2 SOL 3150 15.560 20.010 9.000 1.00 0.00 ATOM 25067 OH2 SOL 3151 29.500 19.110 61.520 1.00 0.00 ATOM 25068 H1 SOL 3151 29.020 19.920 61.710 1.00 0.00 ATOM 25069 H2 SOL 3151 28.960 18.420 61.910 1.00 0.00 ATOM 25070 OH2 SOL 3152 21.460 -0.170 2.160 1.00 0.00 ATOM 25071 H1 SOL 3152 20.880 0.320 2.740 1.00 0.00 ATOM 25072 H2 SOL 3152 22.340 0.140 2.360 1.00 0.00 ATOM 25073 OH2 SOL 3153 28.630 43.370 16.160 1.00 0.00 ATOM 25074 H1 SOL 3153 28.560 42.750 15.430 1.00 0.00 ATOM 25075 H2 SOL 3153 27.830 43.880 16.120 1.00 0.00 ATOM 25076 OH2 SOL 3154 50.210 45.770 73.690 1.00 0.00 ATOM 25077 H1 SOL 3154 50.950 46.300 73.990 1.00 0.00 ATOM 25078 H2 SOL 3154 49.440 46.310 73.870 1.00 0.00 ATOM 25079 OH2 SOL 3155 34.720 14.220 61.280 1.00 0.00 ATOM 25080 H1 SOL 3155 33.820 13.910 61.240 1.00 0.00 ATOM 25081 H2 SOL 3155 35.250 13.460 61.040 1.00 0.00 ATOM 25082 OH2 SOL 3156 21.760 53.750 80.370 1.00 0.00 ATOM 25083 H1 SOL 3156 21.670 53.590 81.310 1.00 0.00 ATOM 25084 H2 SOL 3156 22.360 53.080 80.070 1.00 0.00 ATOM 25085 OH2 SOL 3157 5.380 32.940 16.560 1.00 0.00 ATOM 25086 H1 SOL 3157 5.690 32.140 16.130 1.00 0.00 ATOM 25087 H2 SOL 3157 5.320 33.580 15.850 1.00 0.00 ATOM 25088 OH2 SOL 3158 54.370 44.740 21.670 1.00 0.00 ATOM 25089 H1 SOL 3158 54.870 44.600 20.870 1.00 0.00 ATOM 25090 H2 SOL 3158 53.580 44.210 21.570 1.00 0.00 ATOM 25091 OH2 SOL 3159 38.790 20.490 10.160 1.00 0.00 ATOM 25092 H1 SOL 3159 38.610 21.270 9.630 1.00 0.00 ATOM 25093 H2 SOL 3159 38.690 19.760 9.540 1.00 0.00 ATOM 25094 OH2 SOL 3160 43.120 12.370 14.240 1.00 0.00 ATOM 25095 H1 SOL 3160 43.000 11.520 13.820 1.00 0.00 ATOM 25096 H2 SOL 3160 43.500 12.160 15.100 1.00 0.00 ATOM 25097 OH2 SOL 3161 0.950 42.290 68.110 1.00 0.00 ATOM 25098 H1 SOL 3161 1.590 42.950 68.360 1.00 0.00 ATOM 25099 H2 SOL 3161 1.460 41.590 67.720 1.00 0.00 ATOM 25100 OH2 SOL 3162 51.200 54.630 18.320 1.00 0.00 ATOM 25101 H1 SOL 3162 51.560 55.480 18.060 1.00 0.00 ATOM 25102 H2 SOL 3162 51.350 54.070 17.560 1.00 0.00 ATOM 25103 OH2 SOL 3163 24.270 36.330 0.840 1.00 0.00 ATOM 25104 H1 SOL 3163 23.840 36.670 0.050 1.00 0.00 ATOM 25105 H2 SOL 3163 24.970 36.960 1.010 1.00 0.00 ATOM 25106 OH2 SOL 3164 24.060 33.570 1.760 1.00 0.00 ATOM 25107 H1 SOL 3164 24.420 34.440 1.560 1.00 0.00 ATOM 25108 H2 SOL 3164 24.060 33.110 0.930 1.00 0.00 ATOM 25109 OH2 SOL 3165 57.010 52.960 21.960 1.00 0.00 ATOM 25110 H1 SOL 3165 57.180 52.330 22.670 1.00 0.00 ATOM 25111 H2 SOL 3165 56.060 53.000 21.900 1.00 0.00 ATOM 25112 OH2 SOL 3166 52.310 23.510 20.220 1.00 0.00 ATOM 25113 H1 SOL 3166 52.180 24.410 19.910 1.00 0.00 ATOM 25114 H2 SOL 3166 51.450 23.100 20.120 1.00 0.00 ATOM 25115 OH2 SOL 3167 43.830 8.850 69.600 1.00 0.00 ATOM 25116 H1 SOL 3167 43.570 8.330 68.840 1.00 0.00 ATOM 25117 H2 SOL 3167 43.140 8.700 70.240 1.00 0.00 ATOM 25118 OH2 SOL 3168 31.410 42.450 81.940 1.00 0.00 ATOM 25119 H1 SOL 3168 31.260 41.770 81.280 1.00 0.00 ATOM 25120 H2 SOL 3168 30.850 43.170 81.660 1.00 0.00 ATOM 25121 OH2 SOL 3169 0.850 34.870 21.880 1.00 0.00 ATOM 25122 H1 SOL 3169 0.250 34.180 21.590 1.00 0.00 ATOM 25123 H2 SOL 3169 0.910 34.740 22.830 1.00 0.00 ATOM 25124 OH2 SOL 3170 15.270 17.530 79.600 1.00 0.00 ATOM 25125 H1 SOL 3170 14.450 17.040 79.460 1.00 0.00 ATOM 25126 H2 SOL 3170 15.690 17.540 78.740 1.00 0.00 ATOM 25127 OH2 SOL 3171 54.060 31.710 20.650 1.00 0.00 ATOM 25128 H1 SOL 3171 53.370 31.060 20.740 1.00 0.00 ATOM 25129 H2 SOL 3171 54.460 31.770 21.510 1.00 0.00 ATOM 25130 OH2 SOL 3172 59.550 17.150 9.940 1.00 0.00 ATOM 25131 H1 SOL 3172 59.510 17.580 10.790 1.00 0.00 ATOM 25132 H2 SOL 3172 58.990 17.680 9.370 1.00 0.00 ATOM 25133 OH2 SOL 3173 34.420 43.220 78.690 1.00 0.00 ATOM 25134 H1 SOL 3173 33.700 43.540 78.150 1.00 0.00 ATOM 25135 H2 SOL 3173 35.200 43.330 78.150 1.00 0.00 ATOM 25136 OH2 SOL 3174 2.570 49.060 70.270 1.00 0.00 ATOM 25137 H1 SOL 3174 2.710 50.000 70.170 1.00 0.00 ATOM 25138 H2 SOL 3174 1.990 48.830 69.540 1.00 0.00 ATOM 25139 OH2 SOL 3175 55.400 3.610 26.380 1.00 0.00 ATOM 25140 H1 SOL 3175 56.190 4.060 26.670 1.00 0.00 ATOM 25141 H2 SOL 3175 55.640 2.680 26.370 1.00 0.00 ATOM 25142 OH2 SOL 3176 52.620 5.270 2.820 1.00 0.00 ATOM 25143 H1 SOL 3176 53.550 5.430 2.650 1.00 0.00 ATOM 25144 H2 SOL 3176 52.530 4.320 2.800 1.00 0.00 ATOM 25145 OH2 SOL 3177 9.280 16.900 81.010 1.00 0.00 ATOM 25146 H1 SOL 3177 9.020 16.920 80.090 1.00 0.00 ATOM 25147 H2 SOL 3177 9.500 15.990 81.180 1.00 0.00 ATOM 25148 OH2 SOL 3178 7.540 2.670 75.350 1.00 0.00 ATOM 25149 H1 SOL 3178 6.800 2.860 74.770 1.00 0.00 ATOM 25150 H2 SOL 3178 7.310 3.100 76.170 1.00 0.00 ATOM 25151 OH2 SOL 3179 43.050 25.710 4.360 1.00 0.00 ATOM 25152 H1 SOL 3179 42.960 25.330 5.240 1.00 0.00 ATOM 25153 H2 SOL 3179 43.140 24.950 3.780 1.00 0.00 ATOM 25154 OH2 SOL 3180 16.420 1.910 80.880 1.00 0.00 ATOM 25155 H1 SOL 3180 15.480 1.690 80.860 1.00 0.00 ATOM 25156 H2 SOL 3180 16.650 1.920 81.810 1.00 0.00 ATOM 25157 OH2 SOL 3181 31.060 46.910 10.570 1.00 0.00 ATOM 25158 H1 SOL 3181 31.710 46.330 10.970 1.00 0.00 ATOM 25159 H2 SOL 3181 31.210 47.760 10.990 1.00 0.00 ATOM 25160 OH2 SOL 3182 31.900 11.150 81.970 1.00 0.00 ATOM 25161 H1 SOL 3182 32.100 11.670 82.750 1.00 0.00 ATOM 25162 H2 SOL 3182 31.010 10.820 82.120 1.00 0.00 ATOM 25163 OH2 SOL 3183 39.190 50.080 3.170 1.00 0.00 ATOM 25164 H1 SOL 3183 38.230 50.020 3.100 1.00 0.00 ATOM 25165 H2 SOL 3183 39.340 50.770 3.810 1.00 0.00 ATOM 25166 OH2 SOL 3184 21.160 27.420 1.100 1.00 0.00 ATOM 25167 H1 SOL 3184 21.690 26.630 1.190 1.00 0.00 ATOM 25168 H2 SOL 3184 21.470 27.830 0.290 1.00 0.00 ATOM 25169 OH2 SOL 3185 59.460 19.750 23.370 1.00 0.00 ATOM 25170 H1 SOL 3185 58.730 19.910 23.970 1.00 0.00 ATOM 25171 H2 SOL 3185 60.070 20.470 23.530 1.00 0.00 ATOM 25172 OH2 SOL 3186 6.260 13.370 18.180 1.00 0.00 ATOM 25173 H1 SOL 3186 5.440 13.470 18.670 1.00 0.00 ATOM 25174 H2 SOL 3186 6.930 13.680 18.790 1.00 0.00 ATOM 25175 OH2 SOL 3187 45.650 52.000 10.790 1.00 0.00 ATOM 25176 H1 SOL 3187 45.110 51.370 10.300 1.00 0.00 ATOM 25177 H2 SOL 3187 45.490 51.780 11.710 1.00 0.00 ATOM 25178 OH2 SOL 3188 48.080 46.350 20.950 1.00 0.00 ATOM 25179 H1 SOL 3188 47.980 45.560 21.490 1.00 0.00 ATOM 25180 H2 SOL 3188 47.490 46.980 21.350 1.00 0.00 ATOM 25181 OH2 SOL 3189 41.740 26.730 79.070 1.00 0.00 ATOM 25182 H1 SOL 3189 42.550 26.940 78.610 1.00 0.00 ATOM 25183 H2 SOL 3189 41.110 26.530 78.380 1.00 0.00 ATOM 25184 OH2 SOL 3190 5.410 16.220 20.210 1.00 0.00 ATOM 25185 H1 SOL 3190 5.010 16.850 20.810 1.00 0.00 ATOM 25186 H2 SOL 3190 4.820 15.470 20.230 1.00 0.00 ATOM 25187 OH2 SOL 3191 22.040 44.860 64.980 1.00 0.00 ATOM 25188 H1 SOL 3191 22.200 45.190 65.870 1.00 0.00 ATOM 25189 H2 SOL 3191 21.120 44.620 64.970 1.00 0.00 ATOM 25190 OH2 SOL 3192 28.090 54.120 8.990 1.00 0.00 ATOM 25191 H1 SOL 3192 28.330 54.300 9.900 1.00 0.00 ATOM 25192 H2 SOL 3192 27.290 53.590 9.050 1.00 0.00 ATOM 25193 OH2 SOL 3193 21.350 27.160 21.390 1.00 0.00 ATOM 25194 H1 SOL 3193 20.660 27.330 22.040 1.00 0.00 ATOM 25195 H2 SOL 3193 22.160 27.460 21.820 1.00 0.00 ATOM 25196 OH2 SOL 3194 20.980 39.770 7.240 1.00 0.00 ATOM 25197 H1 SOL 3194 21.670 39.580 6.600 1.00 0.00 ATOM 25198 H2 SOL 3194 20.350 40.300 6.750 1.00 0.00 ATOM 25199 OH2 SOL 3195 27.210 46.290 66.580 1.00 0.00 ATOM 25200 H1 SOL 3195 27.600 47.070 66.960 1.00 0.00 ATOM 25201 H2 SOL 3195 26.450 46.610 66.100 1.00 0.00 ATOM 25202 OH2 SOL 3196 7.010 56.670 4.920 1.00 0.00 ATOM 25203 H1 SOL 3196 6.740 55.970 5.510 1.00 0.00 ATOM 25204 H2 SOL 3196 7.940 56.810 5.120 1.00 0.00 ATOM 25205 OH2 SOL 3197 27.580 25.370 24.860 1.00 0.00 ATOM 25206 H1 SOL 3197 28.390 25.350 25.370 1.00 0.00 ATOM 25207 H2 SOL 3197 27.150 24.540 25.060 1.00 0.00 ATOM 25208 OH2 SOL 3198 5.330 28.390 9.250 1.00 0.00 ATOM 25209 H1 SOL 3198 5.000 28.880 8.500 1.00 0.00 ATOM 25210 H2 SOL 3198 4.630 28.450 9.910 1.00 0.00 ATOM 25211 OH2 SOL 3199 45.300 1.990 83.090 1.00 0.00 ATOM 25212 H1 SOL 3199 46.230 2.210 83.060 1.00 0.00 ATOM 25213 H2 SOL 3199 45.250 1.280 83.720 1.00 0.00 ATOM 25214 OH2 SOL 3200 37.810 55.500 81.920 1.00 0.00 ATOM 25215 H1 SOL 3200 37.030 55.060 82.250 1.00 0.00 ATOM 25216 H2 SOL 3200 38.530 55.070 82.360 1.00 0.00 ATOM 25217 OH2 SOL 3201 8.130 2.140 1.740 1.00 0.00 ATOM 25218 H1 SOL 3201 8.320 1.920 2.650 1.00 0.00 ATOM 25219 H2 SOL 3201 8.980 2.420 1.380 1.00 0.00 ATOM 25220 OH2 SOL 3202 5.280 13.880 75.820 1.00 0.00 ATOM 25221 H1 SOL 3202 5.820 13.240 76.290 1.00 0.00 ATOM 25222 H2 SOL 3202 5.070 13.450 74.990 1.00 0.00 ATOM 25223 OH2 SOL 3203 16.650 56.840 5.030 1.00 0.00 ATOM 25224 H1 SOL 3203 16.200 56.510 5.810 1.00 0.00 ATOM 25225 H2 SOL 3203 17.500 57.120 5.360 1.00 0.00 ATOM 25226 OH2 SOL 3204 27.600 47.990 73.320 1.00 0.00 ATOM 25227 H1 SOL 3204 27.580 47.430 74.100 1.00 0.00 ATOM 25228 H2 SOL 3204 26.680 48.100 73.080 1.00 0.00 ATOM 25229 OH2 SOL 3205 24.070 21.730 9.130 1.00 0.00 ATOM 25230 H1 SOL 3205 24.060 20.970 8.560 1.00 0.00 ATOM 25231 H2 SOL 3205 23.370 22.290 8.810 1.00 0.00 ATOM 25232 OH2 SOL 3206 59.220 18.950 3.740 1.00 0.00 ATOM 25233 H1 SOL 3206 59.810 19.460 3.190 1.00 0.00 ATOM 25234 H2 SOL 3206 58.360 19.340 3.610 1.00 0.00 ATOM 25235 OH2 SOL 3207 36.670 25.130 16.360 1.00 0.00 ATOM 25236 H1 SOL 3207 37.430 24.560 16.490 1.00 0.00 ATOM 25237 H2 SOL 3207 37.000 25.860 15.840 1.00 0.00 ATOM 25238 OH2 SOL 3208 45.570 30.190 79.670 1.00 0.00 ATOM 25239 H1 SOL 3208 44.920 30.140 80.370 1.00 0.00 ATOM 25240 H2 SOL 3208 45.720 29.280 79.420 1.00 0.00 ATOM 25241 OH2 SOL 3209 10.430 47.930 7.000 1.00 0.00 ATOM 25242 H1 SOL 3209 9.900 47.920 7.790 1.00 0.00 ATOM 25243 H2 SOL 3209 10.030 48.600 6.450 1.00 0.00 ATOM 25244 OH2 SOL 3210 31.140 11.530 8.870 1.00 0.00 ATOM 25245 H1 SOL 3210 31.040 10.890 9.580 1.00 0.00 ATOM 25246 H2 SOL 3210 30.770 12.340 9.220 1.00 0.00 ATOM 25247 OH2 SOL 3211 60.680 36.910 7.990 1.00 0.00 ATOM 25248 H1 SOL 3211 60.300 36.790 7.110 1.00 0.00 ATOM 25249 H2 SOL 3211 61.330 36.220 8.070 1.00 0.00 ATOM 25250 OH2 SOL 3212 32.400 26.480 10.910 1.00 0.00 ATOM 25251 H1 SOL 3212 31.730 26.060 10.380 1.00 0.00 ATOM 25252 H2 SOL 3212 32.370 26.020 11.750 1.00 0.00 ATOM 25253 OH2 SOL 3213 24.290 2.380 73.220 1.00 0.00 ATOM 25254 H1 SOL 3213 24.520 2.060 74.090 1.00 0.00 ATOM 25255 H2 SOL 3213 25.120 2.550 72.790 1.00 0.00 ATOM 25256 OH2 SOL 3214 45.320 46.620 82.230 1.00 0.00 ATOM 25257 H1 SOL 3214 45.690 46.710 83.110 1.00 0.00 ATOM 25258 H2 SOL 3214 46.050 46.320 81.690 1.00 0.00 ATOM 25259 OH2 SOL 3215 33.540 2.160 3.490 1.00 0.00 ATOM 25260 H1 SOL 3215 33.790 1.310 3.120 1.00 0.00 ATOM 25261 H2 SOL 3215 32.810 2.460 2.940 1.00 0.00 ATOM 25262 OH2 SOL 3216 44.990 26.480 70.440 1.00 0.00 ATOM 25263 H1 SOL 3216 45.220 26.490 69.510 1.00 0.00 ATOM 25264 H2 SOL 3216 45.050 25.560 70.690 1.00 0.00 ATOM 25265 OH2 SOL 3217 27.720 -0.020 3.800 1.00 0.00 ATOM 25266 H1 SOL 3217 27.230 0.790 3.700 1.00 0.00 ATOM 25267 H2 SOL 3217 28.100 0.030 4.680 1.00 0.00 ATOM 25268 OH2 SOL 3218 21.590 31.730 21.160 1.00 0.00 ATOM 25269 H1 SOL 3218 21.630 30.890 20.710 1.00 0.00 ATOM 25270 H2 SOL 3218 22.510 31.930 21.380 1.00 0.00 ATOM 25271 OH2 SOL 3219 51.980 2.630 2.300 1.00 0.00 ATOM 25272 H1 SOL 3219 52.590 2.130 1.760 1.00 0.00 ATOM 25273 H2 SOL 3219 51.140 2.570 1.850 1.00 0.00 ATOM 25274 OH2 SOL 3220 33.160 39.890 11.640 1.00 0.00 ATOM 25275 H1 SOL 3220 33.940 39.930 11.080 1.00 0.00 ATOM 25276 H2 SOL 3220 32.510 40.420 11.180 1.00 0.00 ATOM 25277 OH2 SOL 3221 12.570 17.040 12.570 1.00 0.00 ATOM 25278 H1 SOL 3221 13.230 17.670 12.270 1.00 0.00 ATOM 25279 H2 SOL 3221 11.740 17.380 12.240 1.00 0.00 ATOM 25280 OH2 SOL 3222 55.030 14.010 16.750 1.00 0.00 ATOM 25281 H1 SOL 3222 54.340 13.980 16.080 1.00 0.00 ATOM 25282 H2 SOL 3222 55.640 13.310 16.490 1.00 0.00 ATOM 25283 OH2 SOL 3223 45.950 41.420 12.390 1.00 0.00 ATOM 25284 H1 SOL 3223 45.760 40.900 13.170 1.00 0.00 ATOM 25285 H2 SOL 3223 45.280 42.110 12.400 1.00 0.00 ATOM 25286 OH2 SOL 3224 24.380 52.060 83.310 1.00 0.00 ATOM 25287 H1 SOL 3224 24.770 52.570 82.600 1.00 0.00 ATOM 25288 H2 SOL 3224 24.380 52.640 84.060 1.00 0.00 ATOM 25289 OH2 SOL 3225 14.460 5.050 13.200 1.00 0.00 ATOM 25290 H1 SOL 3225 14.110 4.170 13.090 1.00 0.00 ATOM 25291 H2 SOL 3225 15.290 4.940 13.660 1.00 0.00 ATOM 25292 OH2 SOL 3226 34.740 15.040 72.190 1.00 0.00 ATOM 25293 H1 SOL 3226 35.360 14.860 72.890 1.00 0.00 ATOM 25294 H2 SOL 3226 33.930 14.620 72.470 1.00 0.00 ATOM 25295 OH2 SOL 3227 14.700 40.220 17.280 1.00 0.00 ATOM 25296 H1 SOL 3227 14.260 39.740 17.980 1.00 0.00 ATOM 25297 H2 SOL 3227 14.190 40.010 16.500 1.00 0.00 ATOM 25298 OH2 SOL 3228 18.750 42.180 66.450 1.00 0.00 ATOM 25299 H1 SOL 3228 18.920 43.100 66.260 1.00 0.00 ATOM 25300 H2 SOL 3228 17.790 42.130 66.530 1.00 0.00 ATOM 25301 OH2 SOL 3229 42.830 55.290 75.820 1.00 0.00 ATOM 25302 H1 SOL 3229 42.280 54.570 76.140 1.00 0.00 ATOM 25303 H2 SOL 3229 42.220 55.980 75.580 1.00 0.00 ATOM 25304 OH2 SOL 3230 5.070 37.320 4.610 1.00 0.00 ATOM 25305 H1 SOL 3230 5.210 38.230 4.900 1.00 0.00 ATOM 25306 H2 SOL 3230 5.780 36.830 5.030 1.00 0.00 ATOM 25307 OH2 SOL 3231 8.870 28.040 13.820 1.00 0.00 ATOM 25308 H1 SOL 3231 8.380 28.720 13.350 1.00 0.00 ATOM 25309 H2 SOL 3231 8.980 27.330 13.180 1.00 0.00 ATOM 25310 OH2 SOL 3232 39.690 32.290 5.190 1.00 0.00 ATOM 25311 H1 SOL 3232 40.550 32.290 5.620 1.00 0.00 ATOM 25312 H2 SOL 3232 39.750 32.970 4.520 1.00 0.00 ATOM 25313 OH2 SOL 3233 25.440 43.620 17.820 1.00 0.00 ATOM 25314 H1 SOL 3233 24.560 43.920 18.090 1.00 0.00 ATOM 25315 H2 SOL 3233 25.720 44.270 17.170 1.00 0.00 ATOM 25316 OH2 SOL 3234 29.780 33.630 82.040 1.00 0.00 ATOM 25317 H1 SOL 3234 30.010 32.700 82.080 1.00 0.00 ATOM 25318 H2 SOL 3234 29.530 33.850 82.940 1.00 0.00 ATOM 25319 OH2 SOL 3235 31.660 51.710 73.390 1.00 0.00 ATOM 25320 H1 SOL 3235 31.450 52.490 72.880 1.00 0.00 ATOM 25321 H2 SOL 3235 30.820 51.280 73.530 1.00 0.00 ATOM 25322 OH2 SOL 3236 48.170 50.500 10.530 1.00 0.00 ATOM 25323 H1 SOL 3236 48.290 50.800 9.630 1.00 0.00 ATOM 25324 H2 SOL 3236 47.300 50.810 10.770 1.00 0.00 ATOM 25325 OH2 SOL 3237 38.810 41.060 65.320 1.00 0.00 ATOM 25326 H1 SOL 3237 39.750 41.180 65.420 1.00 0.00 ATOM 25327 H2 SOL 3237 38.590 41.540 64.520 1.00 0.00 ATOM 25328 OH2 SOL 3238 33.910 28.280 80.630 1.00 0.00 ATOM 25329 H1 SOL 3238 33.680 27.680 79.930 1.00 0.00 ATOM 25330 H2 SOL 3238 34.780 28.610 80.400 1.00 0.00 ATOM 25331 OH2 SOL 3239 52.200 24.180 1.870 1.00 0.00 ATOM 25332 H1 SOL 3239 52.820 23.500 1.590 1.00 0.00 ATOM 25333 H2 SOL 3239 51.400 23.980 1.400 1.00 0.00 ATOM 25334 OH2 SOL 3240 58.450 7.050 1.210 1.00 0.00 ATOM 25335 H1 SOL 3240 58.240 6.250 1.680 1.00 0.00 ATOM 25336 H2 SOL 3240 57.690 7.200 0.640 1.00 0.00 ATOM 25337 OH2 SOL 3241 51.810 20.190 77.880 1.00 0.00 ATOM 25338 H1 SOL 3241 51.100 20.380 77.260 1.00 0.00 ATOM 25339 H2 SOL 3241 51.420 19.580 78.500 1.00 0.00 ATOM 25340 OH2 SOL 3242 15.350 11.950 64.840 1.00 0.00 ATOM 25341 H1 SOL 3242 14.680 12.370 65.380 1.00 0.00 ATOM 25342 H2 SOL 3242 15.040 12.080 63.940 1.00 0.00 ATOM 25343 OH2 SOL 3243 27.620 47.120 70.440 1.00 0.00 ATOM 25344 H1 SOL 3243 28.450 47.230 70.890 1.00 0.00 ATOM 25345 H2 SOL 3243 27.150 47.940 70.590 1.00 0.00 ATOM 25346 OH2 SOL 3244 3.790 53.150 79.350 1.00 0.00 ATOM 25347 H1 SOL 3244 3.170 52.420 79.270 1.00 0.00 ATOM 25348 H2 SOL 3244 4.640 52.760 79.150 1.00 0.00 ATOM 25349 OH2 SOL 3245 59.220 12.500 76.160 1.00 0.00 ATOM 25350 H1 SOL 3245 60.010 13.040 76.070 1.00 0.00 ATOM 25351 H2 SOL 3245 59.200 12.260 77.090 1.00 0.00 ATOM 25352 OH2 SOL 3246 13.340 43.620 3.670 1.00 0.00 ATOM 25353 H1 SOL 3246 14.190 44.030 3.850 1.00 0.00 ATOM 25354 H2 SOL 3246 13.150 43.860 2.760 1.00 0.00 ATOM 25355 OH2 SOL 3247 4.250 47.990 74.450 1.00 0.00 ATOM 25356 H1 SOL 3247 3.890 47.450 73.750 1.00 0.00 ATOM 25357 H2 SOL 3247 4.670 48.720 74.000 1.00 0.00 ATOM 25358 OH2 SOL 3248 60.880 3.880 66.930 1.00 0.00 ATOM 25359 H1 SOL 3248 60.440 4.190 67.720 1.00 0.00 ATOM 25360 H2 SOL 3248 60.170 3.590 66.360 1.00 0.00 ATOM 25361 OH2 SOL 3249 17.860 36.730 5.760 1.00 0.00 ATOM 25362 H1 SOL 3249 17.370 36.310 5.050 1.00 0.00 ATOM 25363 H2 SOL 3249 18.090 36.020 6.360 1.00 0.00 ATOM 25364 OH2 SOL 3250 0.310 39.040 16.710 1.00 0.00 ATOM 25365 H1 SOL 3250 1.220 38.730 16.660 1.00 0.00 ATOM 25366 H2 SOL 3250 0.380 39.900 17.120 1.00 0.00 ATOM 25367 OH2 SOL 3251 23.350 15.190 4.810 1.00 0.00 ATOM 25368 H1 SOL 3251 24.250 15.400 5.060 1.00 0.00 ATOM 25369 H2 SOL 3251 23.380 15.100 3.860 1.00 0.00 ATOM 25370 OH2 SOL 3252 31.830 53.750 78.790 1.00 0.00 ATOM 25371 H1 SOL 3252 31.210 53.080 79.090 1.00 0.00 ATOM 25372 H2 SOL 3252 31.410 54.130 78.020 1.00 0.00 ATOM 25373 OH2 SOL 3253 22.870 38.750 19.350 1.00 0.00 ATOM 25374 H1 SOL 3253 22.790 38.300 20.190 1.00 0.00 ATOM 25375 H2 SOL 3253 23.090 39.650 19.570 1.00 0.00 ATOM 25376 OH2 SOL 3254 23.140 6.850 16.780 1.00 0.00 ATOM 25377 H1 SOL 3254 22.680 7.010 17.610 1.00 0.00 ATOM 25378 H2 SOL 3254 23.950 6.410 17.040 1.00 0.00 ATOM 25379 OH2 SOL 3255 51.890 23.490 69.990 1.00 0.00 ATOM 25380 H1 SOL 3255 52.280 23.420 69.130 1.00 0.00 ATOM 25381 H2 SOL 3255 52.130 24.360 70.300 1.00 0.00 ATOM 25382 OH2 SOL 3256 27.440 58.450 80.110 1.00 0.00 ATOM 25383 H1 SOL 3256 26.490 58.550 80.050 1.00 0.00 ATOM 25384 H2 SOL 3256 27.580 57.850 80.850 1.00 0.00 ATOM 25385 OH2 SOL 3257 40.130 8.570 0.710 1.00 0.00 ATOM 25386 H1 SOL 3257 39.250 8.280 0.460 1.00 0.00 ATOM 25387 H2 SOL 3257 40.170 8.420 1.660 1.00 0.00 ATOM 25388 OH2 SOL 3258 50.720 42.940 10.370 1.00 0.00 ATOM 25389 H1 SOL 3258 51.430 43.520 10.660 1.00 0.00 ATOM 25390 H2 SOL 3258 50.240 42.740 11.170 1.00 0.00 ATOM 25391 OH2 SOL 3259 51.820 57.760 65.080 1.00 0.00 ATOM 25392 H1 SOL 3259 52.580 57.740 65.670 1.00 0.00 ATOM 25393 H2 SOL 3259 51.180 58.320 65.520 1.00 0.00 ATOM 25394 OH2 SOL 3260 16.020 3.920 78.980 1.00 0.00 ATOM 25395 H1 SOL 3260 16.390 4.700 79.390 1.00 0.00 ATOM 25396 H2 SOL 3260 16.460 3.190 79.420 1.00 0.00 ATOM 25397 OH2 SOL 3261 10.920 0.420 67.650 1.00 0.00 ATOM 25398 H1 SOL 3261 11.380 -0.080 66.980 1.00 0.00 ATOM 25399 H2 SOL 3261 11.200 1.330 67.510 1.00 0.00 ATOM 25400 OH2 SOL 3262 1.720 34.560 82.240 1.00 0.00 ATOM 25401 H1 SOL 3262 2.120 35.210 81.660 1.00 0.00 ATOM 25402 H2 SOL 3262 2.020 34.800 83.120 1.00 0.00 ATOM 25403 OH2 SOL 3263 39.250 27.890 8.950 1.00 0.00 ATOM 25404 H1 SOL 3263 38.540 28.520 8.860 1.00 0.00 ATOM 25405 H2 SOL 3263 39.780 28.220 9.680 1.00 0.00 ATOM 25406 OH2 SOL 3264 26.090 53.210 73.850 1.00 0.00 ATOM 25407 H1 SOL 3264 25.260 53.570 73.530 1.00 0.00 ATOM 25408 H2 SOL 3264 26.700 53.950 73.840 1.00 0.00 ATOM 25409 OH2 SOL 3265 34.950 9.320 3.190 1.00 0.00 ATOM 25410 H1 SOL 3265 35.390 10.110 3.510 1.00 0.00 ATOM 25411 H2 SOL 3265 34.020 9.540 3.210 1.00 0.00 ATOM 25412 OH2 SOL 3266 15.340 4.470 83.200 1.00 0.00 ATOM 25413 H1 SOL 3266 16.050 4.390 82.560 1.00 0.00 ATOM 25414 H2 SOL 3266 15.510 3.780 83.840 1.00 0.00 ATOM 25415 OH2 SOL 3267 35.840 56.320 17.900 1.00 0.00 ATOM 25416 H1 SOL 3267 36.570 55.760 18.180 1.00 0.00 ATOM 25417 H2 SOL 3267 36.140 57.210 18.070 1.00 0.00 ATOM 25418 OH2 SOL 3268 35.840 0.780 78.860 1.00 0.00 ATOM 25419 H1 SOL 3268 35.050 1.020 79.350 1.00 0.00 ATOM 25420 H2 SOL 3268 35.550 0.720 77.950 1.00 0.00 ATOM 25421 OH2 SOL 3269 32.090 29.830 68.520 1.00 0.00 ATOM 25422 H1 SOL 3269 31.540 29.840 67.740 1.00 0.00 ATOM 25423 H2 SOL 3269 31.660 29.230 69.120 1.00 0.00 ATOM 25424 OH2 SOL 3270 7.190 15.790 67.910 1.00 0.00 ATOM 25425 H1 SOL 3270 8.140 15.860 68.030 1.00 0.00 ATOM 25426 H2 SOL 3270 7.000 14.870 68.060 1.00 0.00 ATOM 25427 OH2 SOL 3271 55.280 3.100 23.570 1.00 0.00 ATOM 25428 H1 SOL 3271 55.430 3.150 24.510 1.00 0.00 ATOM 25429 H2 SOL 3271 56.150 2.970 23.190 1.00 0.00 ATOM 25430 OH2 SOL 3272 2.390 48.770 26.310 1.00 0.00 ATOM 25431 H1 SOL 3272 1.590 48.800 26.830 1.00 0.00 ATOM 25432 H2 SOL 3272 2.940 48.130 26.750 1.00 0.00 ATOM 25433 OH2 SOL 3273 3.630 38.610 18.360 1.00 0.00 ATOM 25434 H1 SOL 3273 3.500 37.720 18.670 1.00 0.00 ATOM 25435 H2 SOL 3273 4.090 39.060 19.070 1.00 0.00 ATOM 25436 OH2 SOL 3274 53.520 35.370 4.420 1.00 0.00 ATOM 25437 H1 SOL 3274 53.320 36.100 5.010 1.00 0.00 ATOM 25438 H2 SOL 3274 54.230 35.690 3.880 1.00 0.00 ATOM 25439 OH2 SOL 3275 60.770 44.720 72.190 1.00 0.00 ATOM 25440 H1 SOL 3275 60.870 44.090 71.480 1.00 0.00 ATOM 25441 H2 SOL 3275 61.090 45.550 71.830 1.00 0.00 ATOM 25442 OH2 SOL 3276 0.990 43.300 18.330 1.00 0.00 ATOM 25443 H1 SOL 3276 0.280 42.740 18.010 1.00 0.00 ATOM 25444 H2 SOL 3276 1.760 42.730 18.340 1.00 0.00 ATOM 25445 OH2 SOL 3277 0.920 19.270 13.790 1.00 0.00 ATOM 25446 H1 SOL 3277 0.450 18.730 14.430 1.00 0.00 ATOM 25447 H2 SOL 3277 1.810 18.930 13.810 1.00 0.00 ATOM 25448 OH2 SOL 3278 54.940 0.140 10.070 1.00 0.00 ATOM 25449 H1 SOL 3278 54.900 -0.170 9.160 1.00 0.00 ATOM 25450 H2 SOL 3278 54.030 0.250 10.320 1.00 0.00 ATOM 25451 OH2 SOL 3279 47.900 54.740 12.020 1.00 0.00 ATOM 25452 H1 SOL 3279 47.520 54.950 11.170 1.00 0.00 ATOM 25453 H2 SOL 3279 48.850 54.790 11.880 1.00 0.00 ATOM 25454 OH2 SOL 3280 43.170 6.620 79.660 1.00 0.00 ATOM 25455 H1 SOL 3280 43.190 5.710 79.980 1.00 0.00 ATOM 25456 H2 SOL 3280 42.240 6.780 79.470 1.00 0.00 ATOM 25457 OH2 SOL 3281 29.770 48.540 82.270 1.00 0.00 ATOM 25458 H1 SOL 3281 29.760 49.350 81.760 1.00 0.00 ATOM 25459 H2 SOL 3281 30.600 48.120 82.050 1.00 0.00 ATOM 25460 OH2 SOL 3282 10.670 52.500 77.080 1.00 0.00 ATOM 25461 H1 SOL 3282 9.950 52.850 77.610 1.00 0.00 ATOM 25462 H2 SOL 3282 10.330 51.680 76.730 1.00 0.00 ATOM 25463 OH2 SOL 3283 3.050 24.950 26.930 1.00 0.00 ATOM 25464 H1 SOL 3283 3.670 24.910 27.660 1.00 0.00 ATOM 25465 H2 SOL 3283 3.430 25.570 26.320 1.00 0.00 ATOM 25466 OH2 SOL 3284 43.220 45.230 83.310 1.00 0.00 ATOM 25467 H1 SOL 3284 43.900 45.720 82.830 1.00 0.00 ATOM 25468 H2 SOL 3284 43.370 44.320 83.060 1.00 0.00 ATOM 25469 OH2 SOL 3285 58.160 44.080 6.680 1.00 0.00 ATOM 25470 H1 SOL 3285 57.300 43.650 6.670 1.00 0.00 ATOM 25471 H2 SOL 3285 58.540 43.870 5.830 1.00 0.00 ATOM 25472 OH2 SOL 3286 19.120 14.080 79.070 1.00 0.00 ATOM 25473 H1 SOL 3286 18.240 13.870 78.780 1.00 0.00 ATOM 25474 H2 SOL 3286 19.640 13.300 78.870 1.00 0.00 ATOM 25475 OH2 SOL 3287 19.800 49.050 66.610 1.00 0.00 ATOM 25476 H1 SOL 3287 19.560 48.320 66.030 1.00 0.00 ATOM 25477 H2 SOL 3287 20.130 48.630 67.400 1.00 0.00 ATOM 25478 OH2 SOL 3288 11.250 2.730 81.350 1.00 0.00 ATOM 25479 H1 SOL 3288 10.720 2.170 80.780 1.00 0.00 ATOM 25480 H2 SOL 3288 10.630 3.130 81.950 1.00 0.00 ATOM 25481 OH2 SOL 3289 0.480 15.200 69.280 1.00 0.00 ATOM 25482 H1 SOL 3289 1.210 15.340 69.880 1.00 0.00 ATOM 25483 H2 SOL 3289 0.670 15.750 68.520 1.00 0.00 ATOM 25484 OH2 SOL 3290 37.940 33.630 29.070 1.00 0.00 ATOM 25485 H1 SOL 3290 38.550 33.590 29.810 1.00 0.00 ATOM 25486 H2 SOL 3290 37.990 34.540 28.760 1.00 0.00 ATOM 25487 OH2 SOL 3291 12.700 7.010 71.880 1.00 0.00 ATOM 25488 H1 SOL 3291 12.090 6.780 71.170 1.00 0.00 ATOM 25489 H2 SOL 3291 12.750 7.970 71.850 1.00 0.00 ATOM 25490 OH2 SOL 3292 50.230 24.930 7.980 1.00 0.00 ATOM 25491 H1 SOL 3292 50.270 24.870 7.020 1.00 0.00 ATOM 25492 H2 SOL 3292 49.540 25.570 8.150 1.00 0.00 ATOM 25493 OH2 SOL 3293 26.170 16.740 22.430 1.00 0.00 ATOM 25494 H1 SOL 3293 25.700 15.940 22.200 1.00 0.00 ATOM 25495 H2 SOL 3293 26.940 16.430 22.910 1.00 0.00 ATOM 25496 OH2 SOL 3294 24.590 40.260 4.630 1.00 0.00 ATOM 25497 H1 SOL 3294 25.370 40.290 4.080 1.00 0.00 ATOM 25498 H2 SOL 3294 24.920 40.020 5.500 1.00 0.00 ATOM 25499 OH2 SOL 3295 5.800 3.500 1.420 1.00 0.00 ATOM 25500 H1 SOL 3295 6.640 3.080 1.590 1.00 0.00 ATOM 25501 H2 SOL 3295 5.160 2.990 1.910 1.00 0.00 ATOM 25502 OH2 SOL 3296 35.570 26.840 68.470 1.00 0.00 ATOM 25503 H1 SOL 3296 36.490 26.640 68.290 1.00 0.00 ATOM 25504 H2 SOL 3296 35.210 27.070 67.620 1.00 0.00 ATOM 25505 OH2 SOL 3297 22.350 10.490 78.010 1.00 0.00 ATOM 25506 H1 SOL 3297 22.660 10.640 77.110 1.00 0.00 ATOM 25507 H2 SOL 3297 22.950 11.000 78.560 1.00 0.00 ATOM 25508 OH2 SOL 3298 33.730 53.140 15.820 1.00 0.00 ATOM 25509 H1 SOL 3298 33.150 52.900 15.100 1.00 0.00 ATOM 25510 H2 SOL 3298 34.360 53.750 15.440 1.00 0.00 ATOM 25511 OH2 SOL 3299 47.510 44.940 76.860 1.00 0.00 ATOM 25512 H1 SOL 3299 48.190 44.300 77.080 1.00 0.00 ATOM 25513 H2 SOL 3299 47.930 45.790 76.990 1.00 0.00 ATOM 25514 OH2 SOL 3300 54.750 17.380 75.370 1.00 0.00 ATOM 25515 H1 SOL 3300 53.930 17.780 75.110 1.00 0.00 ATOM 25516 H2 SOL 3300 55.210 18.060 75.870 1.00 0.00 ATOM 25517 OH2 SOL 3301 45.120 46.600 17.140 1.00 0.00 ATOM 25518 H1 SOL 3301 44.730 47.450 17.370 1.00 0.00 ATOM 25519 H2 SOL 3301 45.400 46.220 17.970 1.00 0.00 ATOM 25520 OH2 SOL 3302 41.280 39.850 7.670 1.00 0.00 ATOM 25521 H1 SOL 3302 41.240 38.930 7.940 1.00 0.00 ATOM 25522 H2 SOL 3302 41.610 39.820 6.770 1.00 0.00 ATOM 25523 OH2 SOL 3303 40.950 48.510 26.330 1.00 0.00 ATOM 25524 H1 SOL 3303 40.350 49.260 26.340 1.00 0.00 ATOM 25525 H2 SOL 3303 40.990 48.220 27.240 1.00 0.00 ATOM 25526 OH2 SOL 3304 20.130 58.020 21.520 1.00 0.00 ATOM 25527 H1 SOL 3304 19.620 57.680 22.260 1.00 0.00 ATOM 25528 H2 SOL 3304 20.950 57.530 21.550 1.00 0.00 ATOM 25529 OH2 SOL 3305 23.400 11.930 13.100 1.00 0.00 ATOM 25530 H1 SOL 3305 22.860 12.700 13.270 1.00 0.00 ATOM 25531 H2 SOL 3305 24.060 11.930 13.790 1.00 0.00 ATOM 25532 OH2 SOL 3306 16.480 1.050 73.250 1.00 0.00 ATOM 25533 H1 SOL 3306 16.160 1.930 73.030 1.00 0.00 ATOM 25534 H2 SOL 3306 17.380 1.030 72.950 1.00 0.00 ATOM 25535 OH2 SOL 3307 38.640 55.770 7.740 1.00 0.00 ATOM 25536 H1 SOL 3307 39.450 55.470 8.160 1.00 0.00 ATOM 25537 H2 SOL 3307 37.950 55.270 8.190 1.00 0.00 ATOM 25538 OH2 SOL 3308 34.310 1.920 72.530 1.00 0.00 ATOM 25539 H1 SOL 3308 35.030 2.520 72.690 1.00 0.00 ATOM 25540 H2 SOL 3308 34.450 1.590 71.640 1.00 0.00 ATOM 25541 OH2 SOL 3309 8.720 38.010 8.680 1.00 0.00 ATOM 25542 H1 SOL 3309 9.080 37.240 9.120 1.00 0.00 ATOM 25543 H2 SOL 3309 8.950 38.740 9.250 1.00 0.00 ATOM 25544 OH2 SOL 3310 42.570 54.000 81.930 1.00 0.00 ATOM 25545 H1 SOL 3310 42.080 53.240 81.630 1.00 0.00 ATOM 25546 H2 SOL 3310 43.090 54.270 81.170 1.00 0.00 ATOM 25547 OH2 SOL 3311 12.790 12.610 62.780 1.00 0.00 ATOM 25548 H1 SOL 3311 12.460 13.420 63.170 1.00 0.00 ATOM 25549 H2 SOL 3311 13.550 12.880 62.270 1.00 0.00 ATOM 25550 OH2 SOL 3312 41.610 51.050 23.540 1.00 0.00 ATOM 25551 H1 SOL 3312 42.000 50.350 23.030 1.00 0.00 ATOM 25552 H2 SOL 3312 40.760 50.710 23.830 1.00 0.00 ATOM 25553 OH2 SOL 3313 25.730 0.440 77.690 1.00 0.00 ATOM 25554 H1 SOL 3313 25.030 0.430 78.340 1.00 0.00 ATOM 25555 H2 SOL 3313 26.410 -0.130 78.060 1.00 0.00 ATOM 25556 OH2 SOL 3314 37.650 3.740 80.340 1.00 0.00 ATOM 25557 H1 SOL 3314 36.930 3.490 79.770 1.00 0.00 ATOM 25558 H2 SOL 3314 37.800 4.670 80.150 1.00 0.00 ATOM 25559 OH2 SOL 3315 33.250 44.690 74.540 1.00 0.00 ATOM 25560 H1 SOL 3315 33.880 44.100 74.140 1.00 0.00 ATOM 25561 H2 SOL 3315 33.280 45.480 73.990 1.00 0.00 ATOM 25562 OH2 SOL 3316 28.640 1.720 79.010 1.00 0.00 ATOM 25563 H1 SOL 3316 28.170 0.920 79.270 1.00 0.00 ATOM 25564 H2 SOL 3316 28.880 1.560 78.100 1.00 0.00 ATOM 25565 OH2 SOL 3317 30.770 29.020 78.530 1.00 0.00 ATOM 25566 H1 SOL 3317 30.930 28.730 79.430 1.00 0.00 ATOM 25567 H2 SOL 3317 31.600 29.420 78.260 1.00 0.00 ATOM 25568 OH2 SOL 3318 42.560 14.920 14.240 1.00 0.00 ATOM 25569 H1 SOL 3318 42.900 14.040 14.070 1.00 0.00 ATOM 25570 H2 SOL 3318 41.780 14.780 14.770 1.00 0.00 ATOM 25571 OH2 SOL 3319 1.530 37.250 73.610 1.00 0.00 ATOM 25572 H1 SOL 3319 1.690 36.790 72.790 1.00 0.00 ATOM 25573 H2 SOL 3319 1.270 38.130 73.340 1.00 0.00 ATOM 25574 OH2 SOL 3320 56.560 43.070 11.810 1.00 0.00 ATOM 25575 H1 SOL 3320 55.970 43.430 11.140 1.00 0.00 ATOM 25576 H2 SOL 3320 56.730 43.810 12.390 1.00 0.00 ATOM 25577 OH2 SOL 3321 34.060 32.640 65.630 1.00 0.00 ATOM 25578 H1 SOL 3321 33.350 32.020 65.440 1.00 0.00 ATOM 25579 H2 SOL 3321 33.750 33.470 65.270 1.00 0.00 ATOM 25580 OH2 SOL 3322 54.900 30.450 70.430 1.00 0.00 ATOM 25581 H1 SOL 3322 54.200 31.070 70.650 1.00 0.00 ATOM 25582 H2 SOL 3322 55.660 30.990 70.260 1.00 0.00 ATOM 25583 OH2 SOL 3323 7.950 18.290 2.750 1.00 0.00 ATOM 25584 H1 SOL 3323 7.110 17.850 2.570 1.00 0.00 ATOM 25585 H2 SOL 3323 7.900 19.100 2.250 1.00 0.00 ATOM 25586 OH2 SOL 3324 58.730 58.270 0.850 1.00 0.00 ATOM 25587 H1 SOL 3324 59.580 58.440 1.250 1.00 0.00 ATOM 25588 H2 SOL 3324 58.440 57.450 1.240 1.00 0.00 ATOM 25589 OH2 SOL 3325 7.750 45.290 72.800 1.00 0.00 ATOM 25590 H1 SOL 3325 8.310 45.100 72.040 1.00 0.00 ATOM 25591 H2 SOL 3325 8.160 46.050 73.210 1.00 0.00 ATOM 25592 OH2 SOL 3326 16.910 33.490 0.200 1.00 0.00 ATOM 25593 H1 SOL 3326 17.540 34.210 0.200 1.00 0.00 ATOM 25594 H2 SOL 3326 16.100 33.890 -0.110 1.00 0.00 ATOM 25595 OH2 SOL 3327 28.960 33.520 68.620 1.00 0.00 ATOM 25596 H1 SOL 3327 28.590 34.180 69.210 1.00 0.00 ATOM 25597 H2 SOL 3327 28.610 32.690 68.940 1.00 0.00 ATOM 25598 OH2 SOL 3328 28.470 39.320 13.940 1.00 0.00 ATOM 25599 H1 SOL 3328 27.960 40.040 14.320 1.00 0.00 ATOM 25600 H2 SOL 3328 29.160 39.160 14.580 1.00 0.00 ATOM 25601 OH2 SOL 3329 50.380 13.850 5.470 1.00 0.00 ATOM 25602 H1 SOL 3329 50.020 13.420 4.690 1.00 0.00 ATOM 25603 H2 SOL 3329 51.310 13.630 5.450 1.00 0.00 ATOM 25604 OH2 SOL 3330 11.540 34.710 71.280 1.00 0.00 ATOM 25605 H1 SOL 3330 11.390 34.800 72.220 1.00 0.00 ATOM 25606 H2 SOL 3330 11.180 33.850 71.060 1.00 0.00 ATOM 25607 OH2 SOL 3331 33.650 22.990 5.940 1.00 0.00 ATOM 25608 H1 SOL 3331 33.920 23.780 6.400 1.00 0.00 ATOM 25609 H2 SOL 3331 34.360 22.800 5.330 1.00 0.00 ATOM 25610 OH2 SOL 3332 59.500 52.000 11.970 1.00 0.00 ATOM 25611 H1 SOL 3332 59.420 52.950 11.940 1.00 0.00 ATOM 25612 H2 SOL 3332 59.870 51.820 12.830 1.00 0.00 ATOM 25613 OH2 SOL 3333 43.080 27.040 67.200 1.00 0.00 ATOM 25614 H1 SOL 3333 43.230 27.400 66.330 1.00 0.00 ATOM 25615 H2 SOL 3333 42.180 26.730 67.180 1.00 0.00 ATOM 25616 OH2 SOL 3334 34.450 13.870 22.360 1.00 0.00 ATOM 25617 H1 SOL 3334 35.280 13.800 22.840 1.00 0.00 ATOM 25618 H2 SOL 3334 34.490 13.160 21.720 1.00 0.00 ATOM 25619 OH2 SOL 3335 17.940 52.730 75.190 1.00 0.00 ATOM 25620 H1 SOL 3335 18.120 53.660 75.030 1.00 0.00 ATOM 25621 H2 SOL 3335 17.080 52.720 75.600 1.00 0.00 ATOM 25622 OH2 SOL 3336 2.710 9.220 81.680 1.00 0.00 ATOM 25623 H1 SOL 3336 3.550 9.260 81.220 1.00 0.00 ATOM 25624 H2 SOL 3336 2.480 8.290 81.660 1.00 0.00 ATOM 25625 OH2 SOL 3337 33.750 1.340 80.230 1.00 0.00 ATOM 25626 H1 SOL 3337 33.050 1.470 79.600 1.00 0.00 ATOM 25627 H2 SOL 3337 33.440 0.630 80.790 1.00 0.00 ATOM 25628 OH2 SOL 3338 21.770 46.370 76.230 1.00 0.00 ATOM 25629 H1 SOL 3338 21.290 47.180 76.050 1.00 0.00 ATOM 25630 H2 SOL 3338 21.160 45.670 76.010 1.00 0.00 ATOM 25631 OH2 SOL 3339 52.680 38.090 81.650 1.00 0.00 ATOM 25632 H1 SOL 3339 52.370 37.740 82.490 1.00 0.00 ATOM 25633 H2 SOL 3339 52.060 37.750 81.010 1.00 0.00 ATOM 25634 OH2 SOL 3340 51.060 40.790 69.090 1.00 0.00 ATOM 25635 H1 SOL 3340 50.470 41.470 69.430 1.00 0.00 ATOM 25636 H2 SOL 3340 50.740 39.980 69.500 1.00 0.00 ATOM 25637 OH2 SOL 3341 39.050 40.100 71.070 1.00 0.00 ATOM 25638 H1 SOL 3341 38.450 39.390 70.850 1.00 0.00 ATOM 25639 H2 SOL 3341 38.930 40.230 72.020 1.00 0.00 ATOM 25640 OH2 SOL 3342 47.470 30.170 6.530 1.00 0.00 ATOM 25641 H1 SOL 3342 47.050 30.690 5.840 1.00 0.00 ATOM 25642 H2 SOL 3342 48.340 30.560 6.620 1.00 0.00 ATOM 25643 OH2 SOL 3343 8.890 14.530 75.860 1.00 0.00 ATOM 25644 H1 SOL 3343 9.430 14.280 75.110 1.00 0.00 ATOM 25645 H2 SOL 3343 8.410 13.740 76.090 1.00 0.00 ATOM 25646 OH2 SOL 3344 52.880 46.980 17.670 1.00 0.00 ATOM 25647 H1 SOL 3344 51.990 46.670 17.520 1.00 0.00 ATOM 25648 H2 SOL 3344 52.950 47.060 18.620 1.00 0.00 ATOM 25649 OH2 SOL 3345 3.150 22.940 23.300 1.00 0.00 ATOM 25650 H1 SOL 3345 3.980 22.460 23.320 1.00 0.00 ATOM 25651 H2 SOL 3345 2.900 23.020 24.220 1.00 0.00 ATOM 25652 OH2 SOL 3346 54.630 40.660 2.530 1.00 0.00 ATOM 25653 H1 SOL 3346 55.430 41.160 2.710 1.00 0.00 ATOM 25654 H2 SOL 3346 54.770 39.820 2.950 1.00 0.00 ATOM 25655 OH2 SOL 3347 39.220 39.830 76.660 1.00 0.00 ATOM 25656 H1 SOL 3347 39.190 39.140 77.330 1.00 0.00 ATOM 25657 H2 SOL 3347 38.340 40.210 76.670 1.00 0.00 ATOM 25658 OH2 SOL 3348 38.310 47.840 9.340 1.00 0.00 ATOM 25659 H1 SOL 3348 37.700 48.570 9.260 1.00 0.00 ATOM 25660 H2 SOL 3348 38.200 47.350 8.520 1.00 0.00 ATOM 25661 OH2 SOL 3349 10.680 49.290 65.520 1.00 0.00 ATOM 25662 H1 SOL 3349 11.500 49.110 65.070 1.00 0.00 ATOM 25663 H2 SOL 3349 10.010 49.200 64.850 1.00 0.00 ATOM 25664 OH2 SOL 3350 3.850 23.650 76.760 1.00 0.00 ATOM 25665 H1 SOL 3350 4.520 23.000 76.540 1.00 0.00 ATOM 25666 H2 SOL 3350 3.100 23.410 76.220 1.00 0.00 ATOM 25667 OH2 SOL 3351 16.670 13.180 77.750 1.00 0.00 ATOM 25668 H1 SOL 3351 17.350 12.660 77.320 1.00 0.00 ATOM 25669 H2 SOL 3351 15.960 12.560 77.930 1.00 0.00 ATOM 25670 OH2 SOL 3352 42.760 24.240 6.680 1.00 0.00 ATOM 25671 H1 SOL 3352 43.140 23.570 7.240 1.00 0.00 ATOM 25672 H2 SOL 3352 42.470 24.920 7.290 1.00 0.00 ATOM 25673 OH2 SOL 3353 30.540 20.250 9.750 1.00 0.00 ATOM 25674 H1 SOL 3353 30.940 20.110 10.610 1.00 0.00 ATOM 25675 H2 SOL 3353 31.170 19.900 9.130 1.00 0.00 ATOM 25676 OH2 SOL 3354 37.180 15.090 7.830 1.00 0.00 ATOM 25677 H1 SOL 3354 36.220 15.090 7.770 1.00 0.00 ATOM 25678 H2 SOL 3354 37.470 15.170 6.920 1.00 0.00 ATOM 25679 OH2 SOL 3355 41.900 31.790 23.730 1.00 0.00 ATOM 25680 H1 SOL 3355 41.420 32.450 23.230 1.00 0.00 ATOM 25681 H2 SOL 3355 42.490 32.290 24.300 1.00 0.00 ATOM 25682 OH2 SOL 3356 30.700 20.870 16.860 1.00 0.00 ATOM 25683 H1 SOL 3356 30.970 21.680 16.410 1.00 0.00 ATOM 25684 H2 SOL 3356 29.790 21.040 17.120 1.00 0.00 ATOM 25685 OH2 SOL 3357 12.760 48.030 4.810 1.00 0.00 ATOM 25686 H1 SOL 3357 12.150 48.380 5.450 1.00 0.00 ATOM 25687 H2 SOL 3357 13.270 47.370 5.300 1.00 0.00 ATOM 25688 OH2 SOL 3358 40.250 8.530 3.350 1.00 0.00 ATOM 25689 H1 SOL 3358 40.240 7.610 3.600 1.00 0.00 ATOM 25690 H2 SOL 3358 39.970 9.000 4.140 1.00 0.00 ATOM 25691 OH2 SOL 3359 28.100 53.060 67.760 1.00 0.00 ATOM 25692 H1 SOL 3359 28.500 53.530 68.490 1.00 0.00 ATOM 25693 H2 SOL 3359 28.560 52.220 67.740 1.00 0.00 ATOM 25694 OH2 SOL 3360 11.470 24.670 79.680 1.00 0.00 ATOM 25695 H1 SOL 3360 12.100 25.330 79.950 1.00 0.00 ATOM 25696 H2 SOL 3360 11.390 24.080 80.440 1.00 0.00 ATOM 25697 OH2 SOL 3361 47.110 58.480 5.520 1.00 0.00 ATOM 25698 H1 SOL 3361 47.450 58.510 4.620 1.00 0.00 ATOM 25699 H2 SOL 3361 46.350 57.900 5.470 1.00 0.00 ATOM 25700 OH2 SOL 3362 15.870 48.000 74.960 1.00 0.00 ATOM 25701 H1 SOL 3362 15.990 48.830 74.500 1.00 0.00 ATOM 25702 H2 SOL 3362 15.080 47.620 74.570 1.00 0.00 ATOM 25703 OH2 SOL 3363 3.920 34.410 69.740 1.00 0.00 ATOM 25704 H1 SOL 3363 4.810 34.110 69.550 1.00 0.00 ATOM 25705 H2 SOL 3363 3.450 33.610 69.980 1.00 0.00 ATOM 25706 OH2 SOL 3364 41.430 40.400 0.600 1.00 0.00 ATOM 25707 H1 SOL 3364 41.700 41.320 0.580 1.00 0.00 ATOM 25708 H2 SOL 3364 40.790 40.350 1.310 1.00 0.00 ATOM 25709 OH2 SOL 3365 2.560 16.290 71.270 1.00 0.00 ATOM 25710 H1 SOL 3365 2.510 16.320 72.230 1.00 0.00 ATOM 25711 H2 SOL 3365 3.460 16.000 71.090 1.00 0.00 ATOM 25712 OH2 SOL 3366 54.630 29.190 5.560 1.00 0.00 ATOM 25713 H1 SOL 3366 55.280 29.790 5.190 1.00 0.00 ATOM 25714 H2 SOL 3366 55.130 28.600 6.110 1.00 0.00 ATOM 25715 OH2 SOL 3367 0.620 47.780 64.180 1.00 0.00 ATOM 25716 H1 SOL 3367 0.500 47.550 63.260 1.00 0.00 ATOM 25717 H2 SOL 3367 0.170 48.630 64.270 1.00 0.00 ATOM 25718 OH2 SOL 3368 57.940 1.860 16.040 1.00 0.00 ATOM 25719 H1 SOL 3368 57.970 2.360 16.850 1.00 0.00 ATOM 25720 H2 SOL 3368 57.200 2.230 15.550 1.00 0.00 ATOM 25721 OH2 SOL 3369 11.360 9.840 83.550 1.00 0.00 ATOM 25722 H1 SOL 3369 11.900 10.580 83.270 1.00 0.00 ATOM 25723 H2 SOL 3369 11.460 9.200 82.840 1.00 0.00 ATOM 25724 OH2 SOL 3370 60.100 50.920 9.320 1.00 0.00 ATOM 25725 H1 SOL 3370 59.640 50.080 9.420 1.00 0.00 ATOM 25726 H2 SOL 3370 60.240 51.220 10.220 1.00 0.00 ATOM 25727 OH2 SOL 3371 14.190 42.880 15.090 1.00 0.00 ATOM 25728 H1 SOL 3371 15.000 43.210 15.480 1.00 0.00 ATOM 25729 H2 SOL 3371 14.390 41.970 14.850 1.00 0.00 ATOM 25730 OH2 SOL 3372 26.980 30.610 6.060 1.00 0.00 ATOM 25731 H1 SOL 3372 26.850 30.000 6.780 1.00 0.00 ATOM 25732 H2 SOL 3372 27.090 30.060 5.290 1.00 0.00 ATOM 25733 OH2 SOL 3373 3.460 9.530 7.640 1.00 0.00 ATOM 25734 H1 SOL 3373 3.860 9.370 6.790 1.00 0.00 ATOM 25735 H2 SOL 3373 4.040 9.100 8.270 1.00 0.00 ATOM 25736 OH2 SOL 3374 42.820 31.960 6.590 1.00 0.00 ATOM 25737 H1 SOL 3374 43.070 32.570 5.890 1.00 0.00 ATOM 25738 H2 SOL 3374 43.070 31.100 6.260 1.00 0.00 ATOM 25739 OH2 SOL 3375 24.680 27.990 21.170 1.00 0.00 ATOM 25740 H1 SOL 3375 25.310 27.380 21.550 1.00 0.00 ATOM 25741 H2 SOL 3375 24.160 28.300 21.910 1.00 0.00 ATOM 25742 OH2 SOL 3376 25.180 7.970 79.220 1.00 0.00 ATOM 25743 H1 SOL 3376 25.410 8.400 80.040 1.00 0.00 ATOM 25744 H2 SOL 3376 25.500 8.570 78.540 1.00 0.00 ATOM 25745 OH2 SOL 3377 57.500 21.350 9.600 1.00 0.00 ATOM 25746 H1 SOL 3377 57.480 22.120 10.170 1.00 0.00 ATOM 25747 H2 SOL 3377 57.820 20.650 10.170 1.00 0.00 ATOM 25748 OH2 SOL 3378 35.230 40.120 16.690 1.00 0.00 ATOM 25749 H1 SOL 3378 34.840 40.140 17.570 1.00 0.00 ATOM 25750 H2 SOL 3378 34.680 40.720 16.180 1.00 0.00 ATOM 25751 OH2 SOL 3379 43.070 15.590 81.750 1.00 0.00 ATOM 25752 H1 SOL 3379 44.000 15.740 81.900 1.00 0.00 ATOM 25753 H2 SOL 3379 42.960 14.640 81.820 1.00 0.00 ATOM 25754 OH2 SOL 3380 54.860 31.450 75.790 1.00 0.00 ATOM 25755 H1 SOL 3380 55.780 31.370 76.010 1.00 0.00 ATOM 25756 H2 SOL 3380 54.690 32.390 75.770 1.00 0.00 ATOM 25757 OH2 SOL 3381 38.590 37.470 8.010 1.00 0.00 ATOM 25758 H1 SOL 3381 38.200 38.270 7.650 1.00 0.00 ATOM 25759 H2 SOL 3381 38.830 36.950 7.250 1.00 0.00 ATOM 25760 OH2 SOL 3382 7.660 54.830 78.060 1.00 0.00 ATOM 25761 H1 SOL 3382 7.120 55.060 78.810 1.00 0.00 ATOM 25762 H2 SOL 3382 8.420 55.400 78.130 1.00 0.00 ATOM 25763 OH2 SOL 3383 33.950 9.610 83.790 1.00 0.00 ATOM 25764 H1 SOL 3383 33.550 9.230 83.010 1.00 0.00 ATOM 25765 H2 SOL 3383 33.740 9.000 84.490 1.00 0.00 ATOM 25766 OH2 SOL 3384 10.450 58.030 83.640 1.00 0.00 ATOM 25767 H1 SOL 3384 9.920 58.640 83.130 1.00 0.00 ATOM 25768 H2 SOL 3384 11.130 57.740 83.030 1.00 0.00 ATOM 25769 OH2 SOL 3385 33.730 15.630 80.350 1.00 0.00 ATOM 25770 H1 SOL 3385 34.590 15.580 80.780 1.00 0.00 ATOM 25771 H2 SOL 3385 33.110 15.410 81.050 1.00 0.00 ATOM 25772 OH2 SOL 3386 27.010 9.480 16.360 1.00 0.00 ATOM 25773 H1 SOL 3386 27.210 9.500 17.300 1.00 0.00 ATOM 25774 H2 SOL 3386 27.870 9.400 15.940 1.00 0.00 ATOM 25775 OH2 SOL 3387 39.290 18.620 66.770 1.00 0.00 ATOM 25776 H1 SOL 3387 39.630 17.870 67.250 1.00 0.00 ATOM 25777 H2 SOL 3387 39.310 18.350 65.850 1.00 0.00 ATOM 25778 OH2 SOL 3388 26.350 55.040 25.570 1.00 0.00 ATOM 25779 H1 SOL 3388 27.170 54.550 25.540 1.00 0.00 ATOM 25780 H2 SOL 3388 26.570 55.910 25.240 1.00 0.00 ATOM 25781 OH2 SOL 3389 31.120 52.510 20.110 1.00 0.00 ATOM 25782 H1 SOL 3389 31.370 53.390 20.380 1.00 0.00 ATOM 25783 H2 SOL 3389 30.380 52.630 19.510 1.00 0.00 ATOM 25784 OH2 SOL 3390 6.810 42.180 14.670 1.00 0.00 ATOM 25785 H1 SOL 3390 6.930 42.450 15.580 1.00 0.00 ATOM 25786 H2 SOL 3390 7.260 41.340 14.610 1.00 0.00 ATOM 25787 OH2 SOL 3391 55.560 50.120 9.380 1.00 0.00 ATOM 25788 H1 SOL 3391 56.210 50.640 8.920 1.00 0.00 ATOM 25789 H2 SOL 3391 55.480 50.530 10.240 1.00 0.00 ATOM 25790 OH2 SOL 3392 3.200 18.260 2.590 1.00 0.00 ATOM 25791 H1 SOL 3392 2.480 17.680 2.830 1.00 0.00 ATOM 25792 H2 SOL 3392 2.860 18.790 1.880 1.00 0.00 ATOM 25793 OH2 SOL 3393 44.830 19.380 74.770 1.00 0.00 ATOM 25794 H1 SOL 3393 45.210 20.130 75.240 1.00 0.00 ATOM 25795 H2 SOL 3393 44.770 19.670 73.860 1.00 0.00 ATOM 25796 OH2 SOL 3394 25.030 15.170 12.550 1.00 0.00 ATOM 25797 H1 SOL 3394 24.480 14.790 13.240 1.00 0.00 ATOM 25798 H2 SOL 3394 25.390 14.410 12.090 1.00 0.00 ATOM 25799 OH2 SOL 3395 41.470 22.130 82.250 1.00 0.00 ATOM 25800 H1 SOL 3395 41.930 22.940 82.020 1.00 0.00 ATOM 25801 H2 SOL 3395 40.820 22.410 82.900 1.00 0.00 ATOM 25802 OH2 SOL 3396 46.540 12.390 73.300 1.00 0.00 ATOM 25803 H1 SOL 3396 46.330 13.210 72.840 1.00 0.00 ATOM 25804 H2 SOL 3396 46.260 11.700 72.700 1.00 0.00 ATOM 25805 OH2 SOL 3397 12.690 26.710 82.690 1.00 0.00 ATOM 25806 H1 SOL 3397 12.980 25.820 82.900 1.00 0.00 ATOM 25807 H2 SOL 3397 13.480 27.140 82.360 1.00 0.00 ATOM 25808 OH2 SOL 3398 46.870 24.240 63.500 1.00 0.00 ATOM 25809 H1 SOL 3398 47.560 24.780 63.120 1.00 0.00 ATOM 25810 H2 SOL 3398 46.130 24.340 62.900 1.00 0.00 ATOM 25811 OH2 SOL 3399 34.450 54.850 22.390 1.00 0.00 ATOM 25812 H1 SOL 3399 35.310 54.460 22.520 1.00 0.00 ATOM 25813 H2 SOL 3399 33.870 54.350 22.950 1.00 0.00 ATOM 25814 OH2 SOL 3400 11.930 28.150 70.700 1.00 0.00 ATOM 25815 H1 SOL 3400 11.180 27.610 70.450 1.00 0.00 ATOM 25816 H2 SOL 3400 11.550 29.020 70.860 1.00 0.00 ATOM 25817 OH2 SOL 3401 27.740 14.070 79.800 1.00 0.00 ATOM 25818 H1 SOL 3401 27.010 14.620 79.510 1.00 0.00 ATOM 25819 H2 SOL 3401 28.480 14.680 79.830 1.00 0.00 ATOM 25820 OH2 SOL 3402 14.870 14.920 81.730 1.00 0.00 ATOM 25821 H1 SOL 3402 14.070 15.130 82.210 1.00 0.00 ATOM 25822 H2 SOL 3402 14.790 15.420 80.920 1.00 0.00 ATOM 25823 OH2 SOL 3403 58.910 56.030 15.630 1.00 0.00 ATOM 25824 H1 SOL 3403 58.340 56.780 15.780 1.00 0.00 ATOM 25825 H2 SOL 3403 58.440 55.500 14.990 1.00 0.00 ATOM 25826 OH2 SOL 3404 50.450 24.570 4.880 1.00 0.00 ATOM 25827 H1 SOL 3404 51.350 24.770 4.660 1.00 0.00 ATOM 25828 H2 SOL 3404 50.410 23.610 4.880 1.00 0.00 ATOM 25829 OH2 SOL 3405 40.690 12.750 69.270 1.00 0.00 ATOM 25830 H1 SOL 3405 41.100 13.210 68.540 1.00 0.00 ATOM 25831 H2 SOL 3405 41.090 13.130 70.050 1.00 0.00 ATOM 25832 OH2 SOL 3406 8.340 43.300 83.000 1.00 0.00 ATOM 25833 H1 SOL 3406 9.030 43.910 82.730 1.00 0.00 ATOM 25834 H2 SOL 3406 7.820 43.790 83.630 1.00 0.00 ATOM 25835 OH2 SOL 3407 44.490 44.640 15.210 1.00 0.00 ATOM 25836 H1 SOL 3407 44.820 43.850 15.630 1.00 0.00 ATOM 25837 H2 SOL 3407 44.800 45.350 15.770 1.00 0.00 ATOM 25838 OH2 SOL 3408 55.470 38.790 18.490 1.00 0.00 ATOM 25839 H1 SOL 3408 54.920 39.540 18.270 1.00 0.00 ATOM 25840 H2 SOL 3408 54.850 38.090 18.720 1.00 0.00 ATOM 25841 OH2 SOL 3409 18.940 12.230 71.610 1.00 0.00 ATOM 25842 H1 SOL 3409 18.950 11.400 72.080 1.00 0.00 ATOM 25843 H2 SOL 3409 19.020 12.000 70.690 1.00 0.00 ATOM 25844 OH2 SOL 3410 45.110 25.100 1.800 1.00 0.00 ATOM 25845 H1 SOL 3410 45.160 24.280 2.280 1.00 0.00 ATOM 25846 H2 SOL 3410 45.410 25.760 2.420 1.00 0.00 ATOM 25847 OH2 SOL 3411 18.660 12.310 75.380 1.00 0.00 ATOM 25848 H1 SOL 3411 18.070 11.660 74.990 1.00 0.00 ATOM 25849 H2 SOL 3411 19.520 11.870 75.390 1.00 0.00 ATOM 25850 OH2 SOL 3412 10.820 31.060 9.400 1.00 0.00 ATOM 25851 H1 SOL 3412 11.380 30.670 8.730 1.00 0.00 ATOM 25852 H2 SOL 3412 9.960 30.650 9.270 1.00 0.00 ATOM 25853 OH2 SOL 3413 11.350 34.820 11.780 1.00 0.00 ATOM 25854 H1 SOL 3413 12.000 34.750 11.080 1.00 0.00 ATOM 25855 H2 SOL 3413 11.630 35.570 12.290 1.00 0.00 ATOM 25856 OH2 SOL 3414 1.040 3.050 -0.340 1.00 0.00 ATOM 25857 H1 SOL 3414 0.530 3.310 0.430 1.00 0.00 ATOM 25858 H2 SOL 3414 1.520 2.270 -0.050 1.00 0.00 ATOM 25859 OH2 SOL 3415 42.020 16.760 12.310 1.00 0.00 ATOM 25860 H1 SOL 3415 41.090 16.590 12.130 1.00 0.00 ATOM 25861 H2 SOL 3415 42.160 16.420 13.190 1.00 0.00 ATOM 25862 OH2 SOL 3416 59.900 48.180 62.140 1.00 0.00 ATOM 25863 H1 SOL 3416 60.560 47.610 61.750 1.00 0.00 ATOM 25864 H2 SOL 3416 59.510 48.630 61.390 1.00 0.00 ATOM 25865 OH2 SOL 3417 27.860 0.220 20.240 1.00 0.00 ATOM 25866 H1 SOL 3417 27.350 -0.520 19.910 1.00 0.00 ATOM 25867 H2 SOL 3417 27.550 0.350 21.130 1.00 0.00 ATOM 25868 OH2 SOL 3418 19.040 6.300 6.890 1.00 0.00 ATOM 25869 H1 SOL 3418 18.760 6.900 6.200 1.00 0.00 ATOM 25870 H2 SOL 3418 19.910 6.610 7.140 1.00 0.00 ATOM 25871 OH2 SOL 3419 1.050 22.990 60.710 1.00 0.00 ATOM 25872 H1 SOL 3419 0.400 23.590 60.350 1.00 0.00 ATOM 25873 H2 SOL 3419 1.510 22.640 59.940 1.00 0.00 ATOM 25874 OH2 SOL 3420 11.960 39.570 71.890 1.00 0.00 ATOM 25875 H1 SOL 3420 11.610 39.540 72.780 1.00 0.00 ATOM 25876 H2 SOL 3420 12.590 38.850 71.860 1.00 0.00 ATOM 25877 OH2 SOL 3421 39.390 34.370 8.110 1.00 0.00 ATOM 25878 H1 SOL 3421 39.310 34.670 9.010 1.00 0.00 ATOM 25879 H2 SOL 3421 39.540 33.420 8.180 1.00 0.00 ATOM 25880 OH2 SOL 3422 37.050 22.290 79.480 1.00 0.00 ATOM 25881 H1 SOL 3422 37.210 21.620 78.810 1.00 0.00 ATOM 25882 H2 SOL 3422 37.030 21.820 80.300 1.00 0.00 ATOM 25883 OH2 SOL 3423 3.610 39.780 69.930 1.00 0.00 ATOM 25884 H1 SOL 3423 3.930 38.880 70.000 1.00 0.00 ATOM 25885 H2 SOL 3423 2.830 39.710 69.380 1.00 0.00 ATOM 25886 OH2 SOL 3424 5.320 13.150 80.390 1.00 0.00 ATOM 25887 H1 SOL 3424 5.800 12.520 79.860 1.00 0.00 ATOM 25888 H2 SOL 3424 5.150 12.680 81.210 1.00 0.00 ATOM 25889 OH2 SOL 3425 10.540 10.220 71.100 1.00 0.00 ATOM 25890 H1 SOL 3425 9.750 10.270 71.640 1.00 0.00 ATOM 25891 H2 SOL 3425 10.530 9.340 70.730 1.00 0.00 ATOM 25892 OH2 SOL 3426 41.230 45.310 80.460 1.00 0.00 ATOM 25893 H1 SOL 3426 41.240 44.690 79.740 1.00 0.00 ATOM 25894 H2 SOL 3426 41.300 44.760 81.250 1.00 0.00 ATOM 25895 OH2 SOL 3427 30.580 46.710 60.980 1.00 0.00 ATOM 25896 H1 SOL 3427 29.760 46.500 60.530 1.00 0.00 ATOM 25897 H2 SOL 3427 31.220 46.100 60.610 1.00 0.00 ATOM 25898 OH2 SOL 3428 30.580 15.790 81.140 1.00 0.00 ATOM 25899 H1 SOL 3428 29.800 16.290 81.380 1.00 0.00 ATOM 25900 H2 SOL 3428 31.030 15.630 81.970 1.00 0.00 ATOM 25901 OH2 SOL 3429 57.630 46.850 7.380 1.00 0.00 ATOM 25902 H1 SOL 3429 56.850 47.010 7.920 1.00 0.00 ATOM 25903 H2 SOL 3429 57.690 45.890 7.340 1.00 0.00 ATOM 25904 OH2 SOL 3430 27.800 15.940 70.970 1.00 0.00 ATOM 25905 H1 SOL 3430 27.690 16.320 70.100 1.00 0.00 ATOM 25906 H2 SOL 3430 26.920 15.670 71.230 1.00 0.00 ATOM 25907 OH2 SOL 3431 57.920 53.720 73.000 1.00 0.00 ATOM 25908 H1 SOL 3431 58.300 53.380 73.810 1.00 0.00 ATOM 25909 H2 SOL 3431 58.160 54.640 72.990 1.00 0.00 ATOM 25910 OH2 SOL 3432 9.560 7.490 65.140 1.00 0.00 ATOM 25911 H1 SOL 3432 8.720 7.110 64.900 1.00 0.00 ATOM 25912 H2 SOL 3432 10.190 7.100 64.530 1.00 0.00 ATOM 25913 OH2 SOL 3433 16.460 25.960 81.900 1.00 0.00 ATOM 25914 H1 SOL 3433 16.450 25.630 81.000 1.00 0.00 ATOM 25915 H2 SOL 3433 16.010 25.280 82.410 1.00 0.00 ATOM 25916 OH2 SOL 3434 56.390 22.620 24.740 1.00 0.00 ATOM 25917 H1 SOL 3434 56.970 23.330 24.990 1.00 0.00 ATOM 25918 H2 SOL 3434 56.150 22.200 25.570 1.00 0.00 ATOM 25919 OH2 SOL 3435 50.770 7.910 73.100 1.00 0.00 ATOM 25920 H1 SOL 3435 50.150 7.500 73.700 1.00 0.00 ATOM 25921 H2 SOL 3435 51.550 8.060 73.640 1.00 0.00 ATOM 25922 OH2 SOL 3436 51.300 14.620 67.520 1.00 0.00 ATOM 25923 H1 SOL 3436 51.300 14.130 66.700 1.00 0.00 ATOM 25924 H2 SOL 3436 50.500 15.150 67.480 1.00 0.00 ATOM 25925 OH2 SOL 3437 47.800 53.430 19.450 1.00 0.00 ATOM 25926 H1 SOL 3437 48.140 54.190 19.930 1.00 0.00 ATOM 25927 H2 SOL 3437 47.810 53.690 18.530 1.00 0.00 ATOM 25928 OH2 SOL 3438 34.590 32.260 3.860 1.00 0.00 ATOM 25929 H1 SOL 3438 34.450 32.890 4.570 1.00 0.00 ATOM 25930 H2 SOL 3438 35.540 32.250 3.720 1.00 0.00 ATOM 25931 OH2 SOL 3439 26.560 31.860 10.650 1.00 0.00 ATOM 25932 H1 SOL 3439 26.590 31.840 11.610 1.00 0.00 ATOM 25933 H2 SOL 3439 26.160 32.700 10.440 1.00 0.00 ATOM 25934 OH2 SOL 3440 33.180 26.220 78.930 1.00 0.00 ATOM 25935 H1 SOL 3440 32.940 25.960 78.040 1.00 0.00 ATOM 25936 H2 SOL 3440 33.530 25.420 79.330 1.00 0.00 ATOM 25937 OH2 SOL 3441 25.880 36.930 73.510 1.00 0.00 ATOM 25938 H1 SOL 3441 25.450 37.080 72.670 1.00 0.00 ATOM 25939 H2 SOL 3441 25.230 37.200 74.160 1.00 0.00 ATOM 25940 OH2 SOL 3442 9.340 53.870 63.630 1.00 0.00 ATOM 25941 H1 SOL 3442 9.090 54.230 62.780 1.00 0.00 ATOM 25942 H2 SOL 3442 9.450 52.930 63.470 1.00 0.00 ATOM 25943 OH2 SOL 3443 21.720 21.680 5.660 1.00 0.00 ATOM 25944 H1 SOL 3443 21.160 22.180 5.060 1.00 0.00 ATOM 25945 H2 SOL 3443 21.140 21.020 6.040 1.00 0.00 ATOM 25946 OH2 SOL 3444 44.360 26.470 20.090 1.00 0.00 ATOM 25947 H1 SOL 3444 43.800 25.740 20.350 1.00 0.00 ATOM 25948 H2 SOL 3444 45.110 26.410 20.680 1.00 0.00 ATOM 25949 OH2 SOL 3445 3.750 30.800 17.870 1.00 0.00 ATOM 25950 H1 SOL 3445 3.360 31.670 17.860 1.00 0.00 ATOM 25951 H2 SOL 3445 4.680 30.960 17.720 1.00 0.00 ATOM 25952 OH2 SOL 3446 40.580 50.120 13.190 1.00 0.00 ATOM 25953 H1 SOL 3446 39.870 49.830 12.610 1.00 0.00 ATOM 25954 H2 SOL 3446 40.120 50.490 13.950 1.00 0.00 ATOM 25955 OH2 SOL 3447 12.750 47.450 19.930 1.00 0.00 ATOM 25956 H1 SOL 3447 13.690 47.310 20.020 1.00 0.00 ATOM 25957 H2 SOL 3447 12.380 47.080 20.730 1.00 0.00 ATOM 25958 OH2 SOL 3448 34.720 55.450 7.990 1.00 0.00 ATOM 25959 H1 SOL 3448 33.920 55.130 7.580 1.00 0.00 ATOM 25960 H2 SOL 3448 35.400 55.280 7.330 1.00 0.00 ATOM 25961 OH2 SOL 3449 3.440 51.720 61.980 1.00 0.00 ATOM 25962 H1 SOL 3449 2.700 51.500 61.410 1.00 0.00 ATOM 25963 H2 SOL 3449 3.740 50.870 62.320 1.00 0.00 ATOM 25964 OH2 SOL 3450 41.180 23.120 17.720 1.00 0.00 ATOM 25965 H1 SOL 3450 41.650 23.530 17.000 1.00 0.00 ATOM 25966 H2 SOL 3450 41.750 22.400 18.010 1.00 0.00 ATOM 25967 OH2 SOL 3451 16.840 55.200 82.190 1.00 0.00 ATOM 25968 H1 SOL 3451 17.700 55.400 82.550 1.00 0.00 ATOM 25969 H2 SOL 3451 16.460 54.560 82.800 1.00 0.00 ATOM 25970 OH2 SOL 3452 29.370 13.180 2.760 1.00 0.00 ATOM 25971 H1 SOL 3452 28.850 12.440 3.090 1.00 0.00 ATOM 25972 H2 SOL 3452 29.050 13.320 1.870 1.00 0.00 ATOM 25973 OH2 SOL 3453 57.090 17.470 8.230 1.00 0.00 ATOM 25974 H1 SOL 3453 57.850 17.400 7.640 1.00 0.00 ATOM 25975 H2 SOL 3453 56.800 18.380 8.150 1.00 0.00 ATOM 25976 OH2 SOL 3454 31.800 7.660 79.520 1.00 0.00 ATOM 25977 H1 SOL 3454 31.880 7.070 78.770 1.00 0.00 ATOM 25978 H2 SOL 3454 31.240 8.380 79.210 1.00 0.00 ATOM 25979 OH2 SOL 3455 20.950 34.060 65.750 1.00 0.00 ATOM 25980 H1 SOL 3455 20.470 33.750 64.990 1.00 0.00 ATOM 25981 H2 SOL 3455 20.430 34.800 66.080 1.00 0.00 ATOM 25982 OH2 SOL 3456 47.320 2.930 12.410 1.00 0.00 ATOM 25983 H1 SOL 3456 47.590 3.830 12.200 1.00 0.00 ATOM 25984 H2 SOL 3456 46.860 3.020 13.250 1.00 0.00 ATOM 25985 OH2 SOL 3457 20.020 20.470 73.120 1.00 0.00 ATOM 25986 H1 SOL 3457 19.240 20.220 73.610 1.00 0.00 ATOM 25987 H2 SOL 3457 19.840 20.180 72.220 1.00 0.00 ATOM 25988 OH2 SOL 3458 19.580 31.500 12.770 1.00 0.00 ATOM 25989 H1 SOL 3458 18.940 31.870 12.170 1.00 0.00 ATOM 25990 H2 SOL 3458 19.990 30.790 12.270 1.00 0.00 ATOM 25991 OH2 SOL 3459 45.770 19.810 25.180 1.00 0.00 ATOM 25992 H1 SOL 3459 46.080 18.960 25.510 1.00 0.00 ATOM 25993 H2 SOL 3459 46.410 20.040 24.500 1.00 0.00 ATOM 25994 OH2 SOL 3460 1.050 1.990 18.060 1.00 0.00 ATOM 25995 H1 SOL 3460 1.370 1.640 18.890 1.00 0.00 ATOM 25996 H2 SOL 3460 1.650 2.710 17.850 1.00 0.00 ATOM 25997 OH2 SOL 3461 1.800 44.210 1.480 1.00 0.00 ATOM 25998 H1 SOL 3461 1.990 44.220 2.410 1.00 0.00 ATOM 25999 H2 SOL 3461 1.220 43.460 1.360 1.00 0.00 ATOM 26000 OH2 SOL 3462 9.570 24.920 65.610 1.00 0.00 ATOM 26001 H1 SOL 3462 10.030 25.320 64.880 1.00 0.00 ATOM 26002 H2 SOL 3462 9.150 25.650 66.060 1.00 0.00 ATOM 26003 OH2 SOL 3463 43.470 12.660 71.520 1.00 0.00 ATOM 26004 H1 SOL 3463 44.060 12.190 70.930 1.00 0.00 ATOM 26005 H2 SOL 3463 43.190 12.010 72.160 1.00 0.00 ATOM 26006 OH2 SOL 3464 5.060 23.100 80.470 1.00 0.00 ATOM 26007 H1 SOL 3464 5.720 22.670 79.930 1.00 0.00 ATOM 26008 H2 SOL 3464 5.460 23.150 81.340 1.00 0.00 ATOM 26009 OH2 SOL 3465 36.650 17.480 23.510 1.00 0.00 ATOM 26010 H1 SOL 3465 36.960 18.050 24.220 1.00 0.00 ATOM 26011 H2 SOL 3465 37.310 16.790 23.450 1.00 0.00 ATOM 26012 OH2 SOL 3466 29.720 16.960 17.510 1.00 0.00 ATOM 26013 H1 SOL 3466 30.460 16.630 17.000 1.00 0.00 ATOM 26014 H2 SOL 3466 28.950 16.560 17.100 1.00 0.00 ATOM 26015 OH2 SOL 3467 45.840 49.010 79.910 1.00 0.00 ATOM 26016 H1 SOL 3467 45.190 48.320 79.970 1.00 0.00 ATOM 26017 H2 SOL 3467 45.340 49.810 79.760 1.00 0.00 ATOM 26018 OH2 SOL 3468 28.960 21.040 28.220 1.00 0.00 ATOM 26019 H1 SOL 3468 29.460 21.790 27.900 1.00 0.00 ATOM 26020 H2 SOL 3468 28.080 21.180 27.870 1.00 0.00 ATOM 26021 OH2 SOL 3469 30.110 26.840 80.390 1.00 0.00 ATOM 26022 H1 SOL 3469 30.580 26.180 80.910 1.00 0.00 ATOM 26023 H2 SOL 3469 30.350 26.650 79.480 1.00 0.00 ATOM 26024 OH2 SOL 3470 1.110 36.020 16.730 1.00 0.00 ATOM 26025 H1 SOL 3470 1.300 35.980 17.660 1.00 0.00 ATOM 26026 H2 SOL 3470 0.160 36.110 16.680 1.00 0.00 ATOM 26027 OH2 SOL 3471 28.600 47.530 14.770 1.00 0.00 ATOM 26028 H1 SOL 3471 28.160 46.720 15.020 1.00 0.00 ATOM 26029 H2 SOL 3471 29.470 47.470 15.180 1.00 0.00 ATOM 26030 OH2 SOL 3472 30.650 24.910 14.990 1.00 0.00 ATOM 26031 H1 SOL 3472 30.450 25.290 15.850 1.00 0.00 ATOM 26032 H2 SOL 3472 29.870 25.090 14.470 1.00 0.00 ATOM 26033 OH2 SOL 3473 18.690 25.450 71.330 1.00 0.00 ATOM 26034 H1 SOL 3473 18.040 24.770 71.500 1.00 0.00 ATOM 26035 H2 SOL 3473 18.200 26.270 71.390 1.00 0.00 ATOM 26036 OH2 SOL 3474 32.030 48.740 2.160 1.00 0.00 ATOM 26037 H1 SOL 3474 32.640 49.460 2.330 1.00 0.00 ATOM 26038 H2 SOL 3474 32.420 48.270 1.430 1.00 0.00 ATOM 26039 OH2 SOL 3475 45.730 7.240 0.120 1.00 0.00 ATOM 26040 H1 SOL 3475 45.130 7.550 -0.560 1.00 0.00 ATOM 26041 H2 SOL 3475 45.170 7.070 0.880 1.00 0.00 ATOM 26042 OH2 SOL 3476 34.990 15.390 11.480 1.00 0.00 ATOM 26043 H1 SOL 3476 35.050 14.680 12.130 1.00 0.00 ATOM 26044 H2 SOL 3476 35.360 15.010 10.680 1.00 0.00 ATOM 26045 OH2 SOL 3477 58.360 34.830 9.490 1.00 0.00 ATOM 26046 H1 SOL 3477 58.410 34.300 10.290 1.00 0.00 ATOM 26047 H2 SOL 3477 58.750 35.670 9.730 1.00 0.00 ATOM 26048 OH2 SOL 3478 45.640 49.770 69.250 1.00 0.00 ATOM 26049 H1 SOL 3478 44.900 49.250 68.910 1.00 0.00 ATOM 26050 H2 SOL 3478 45.970 49.250 69.980 1.00 0.00 ATOM 26051 OH2 SOL 3479 38.340 29.240 5.240 1.00 0.00 ATOM 26052 H1 SOL 3479 39.190 29.330 5.670 1.00 0.00 ATOM 26053 H2 SOL 3479 38.200 28.300 5.180 1.00 0.00 ATOM 26054 OH2 SOL 3480 49.370 26.540 14.840 1.00 0.00 ATOM 26055 H1 SOL 3480 49.940 27.310 14.820 1.00 0.00 ATOM 26056 H2 SOL 3480 48.590 26.830 15.310 1.00 0.00 ATOM 26057 OH2 SOL 3481 17.540 56.570 74.110 1.00 0.00 ATOM 26058 H1 SOL 3481 17.980 57.420 74.070 1.00 0.00 ATOM 26059 H2 SOL 3481 17.740 56.220 74.980 1.00 0.00 ATOM 26060 OH2 SOL 3482 28.040 5.390 66.570 1.00 0.00 ATOM 26061 H1 SOL 3482 28.770 4.800 66.730 1.00 0.00 ATOM 26062 H2 SOL 3482 27.290 4.960 66.970 1.00 0.00 ATOM 26063 OH2 SOL 3483 0.220 46.910 70.750 1.00 0.00 ATOM 26064 H1 SOL 3483 0.140 47.390 69.920 1.00 0.00 ATOM 26065 H2 SOL 3483 1.050 47.210 71.120 1.00 0.00 ATOM 26066 OH2 SOL 3484 29.400 50.460 60.110 1.00 0.00 ATOM 26067 H1 SOL 3484 30.140 50.970 59.790 1.00 0.00 ATOM 26068 H2 SOL 3484 28.630 50.890 59.750 1.00 0.00 ATOM 26069 OH2 SOL 3485 43.060 36.070 5.560 1.00 0.00 ATOM 26070 H1 SOL 3485 42.710 35.970 6.450 1.00 0.00 ATOM 26071 H2 SOL 3485 43.810 36.650 5.670 1.00 0.00 ATOM 26072 OH2 SOL 3486 35.550 45.900 0.700 1.00 0.00 ATOM 26073 H1 SOL 3486 36.490 45.760 0.600 1.00 0.00 ATOM 26074 H2 SOL 3486 35.250 45.160 1.220 1.00 0.00 ATOM 26075 OH2 SOL 3487 48.660 58.350 3.210 1.00 0.00 ATOM 26076 H1 SOL 3487 48.250 57.520 2.970 1.00 0.00 ATOM 26077 H2 SOL 3487 48.180 59.010 2.710 1.00 0.00 ATOM 26078 OH2 SOL 3488 38.750 23.710 77.860 1.00 0.00 ATOM 26079 H1 SOL 3488 38.180 23.620 77.100 1.00 0.00 ATOM 26080 H2 SOL 3488 38.250 23.340 78.590 1.00 0.00 ATOM 26081 OH2 SOL 3489 49.260 56.180 1.350 1.00 0.00 ATOM 26082 H1 SOL 3489 49.500 57.110 1.280 1.00 0.00 ATOM 26083 H2 SOL 3489 49.200 55.880 0.440 1.00 0.00 ATOM 26084 OH2 SOL 3490 28.330 17.070 0.460 1.00 0.00 ATOM 26085 H1 SOL 3490 28.850 16.290 0.650 1.00 0.00 ATOM 26086 H2 SOL 3490 28.340 17.150 -0.490 1.00 0.00 ATOM 26087 OH2 SOL 3491 32.360 21.260 74.340 1.00 0.00 ATOM 26088 H1 SOL 3491 32.840 21.300 73.510 1.00 0.00 ATOM 26089 H2 SOL 3491 32.800 21.900 74.900 1.00 0.00 ATOM 26090 OH2 SOL 3492 49.670 13.450 13.120 1.00 0.00 ATOM 26091 H1 SOL 3492 49.880 13.830 12.260 1.00 0.00 ATOM 26092 H2 SOL 3492 49.270 14.170 13.600 1.00 0.00 ATOM 26093 OH2 SOL 3493 26.410 49.430 70.100 1.00 0.00 ATOM 26094 H1 SOL 3493 26.710 49.940 70.860 1.00 0.00 ATOM 26095 H2 SOL 3493 25.740 49.980 69.700 1.00 0.00 ATOM 26096 OH2 SOL 3494 38.100 50.860 76.780 1.00 0.00 ATOM 26097 H1 SOL 3494 39.010 50.890 77.090 1.00 0.00 ATOM 26098 H2 SOL 3494 37.690 51.620 77.170 1.00 0.00 ATOM 26099 OH2 SOL 3495 14.990 29.300 7.880 1.00 0.00 ATOM 26100 H1 SOL 3495 14.680 28.420 8.060 1.00 0.00 ATOM 26101 H2 SOL 3495 15.350 29.250 6.990 1.00 0.00 ATOM 26102 OH2 SOL 3496 52.820 29.750 76.830 1.00 0.00 ATOM 26103 H1 SOL 3496 52.040 29.780 76.280 1.00 0.00 ATOM 26104 H2 SOL 3496 53.420 30.380 76.430 1.00 0.00 ATOM 26105 OH2 SOL 3497 35.110 38.030 65.210 1.00 0.00 ATOM 26106 H1 SOL 3497 34.950 37.600 64.370 1.00 0.00 ATOM 26107 H2 SOL 3497 35.510 37.350 65.750 1.00 0.00 ATOM 26108 OH2 SOL 3498 17.020 20.160 3.420 1.00 0.00 ATOM 26109 H1 SOL 3498 17.490 19.400 3.760 1.00 0.00 ATOM 26110 H2 SOL 3498 16.470 20.450 4.140 1.00 0.00 ATOM 26111 OH2 SOL 3499 39.310 33.130 22.260 1.00 0.00 ATOM 26112 H1 SOL 3499 38.830 32.300 22.170 1.00 0.00 ATOM 26113 H2 SOL 3499 40.000 33.080 21.600 1.00 0.00 ATOM 26114 OH2 SOL 3500 57.990 8.530 22.770 1.00 0.00 ATOM 26115 H1 SOL 3500 57.720 8.280 21.880 1.00 0.00 ATOM 26116 H2 SOL 3500 58.510 7.780 23.080 1.00 0.00 ATOM 26117 OH2 SOL 3501 37.780 42.470 16.230 1.00 0.00 ATOM 26118 H1 SOL 3501 37.530 41.580 16.500 1.00 0.00 ATOM 26119 H2 SOL 3501 37.990 42.920 17.040 1.00 0.00 ATOM 26120 OH2 SOL 3502 54.380 43.960 67.740 1.00 0.00 ATOM 26121 H1 SOL 3502 53.750 43.250 67.660 1.00 0.00 ATOM 26122 H2 SOL 3502 53.930 44.720 67.370 1.00 0.00 ATOM 26123 OH2 SOL 3503 55.580 52.330 6.750 1.00 0.00 ATOM 26124 H1 SOL 3503 56.290 52.490 7.370 1.00 0.00 ATOM 26125 H2 SOL 3503 54.820 52.130 7.300 1.00 0.00 ATOM 26126 OH2 SOL 3504 0.300 11.060 72.710 1.00 0.00 ATOM 26127 H1 SOL 3504 0.320 11.230 71.770 1.00 0.00 ATOM 26128 H2 SOL 3504 0.530 10.140 72.790 1.00 0.00 ATOM 26129 OH2 SOL 3505 43.560 51.920 4.460 1.00 0.00 ATOM 26130 H1 SOL 3505 43.040 52.370 5.120 1.00 0.00 ATOM 26131 H2 SOL 3505 43.790 51.090 4.860 1.00 0.00 ATOM 26132 OH2 SOL 3506 37.890 46.030 27.020 1.00 0.00 ATOM 26133 H1 SOL 3506 37.260 45.310 27.010 1.00 0.00 ATOM 26134 H2 SOL 3506 38.120 46.130 27.940 1.00 0.00 ATOM 26135 OH2 SOL 3507 41.200 20.670 1.150 1.00 0.00 ATOM 26136 H1 SOL 3507 41.170 19.750 0.900 1.00 0.00 ATOM 26137 H2 SOL 3507 42.050 20.970 0.840 1.00 0.00 ATOM 26138 OH2 SOL 3508 50.860 50.500 14.080 1.00 0.00 ATOM 26139 H1 SOL 3508 50.830 50.790 13.170 1.00 0.00 ATOM 26140 H2 SOL 3508 49.990 50.700 14.430 1.00 0.00 ATOM 26141 OH2 SOL 3509 3.870 56.290 19.060 1.00 0.00 ATOM 26142 H1 SOL 3509 4.390 55.480 19.120 1.00 0.00 ATOM 26143 H2 SOL 3509 3.420 56.220 18.220 1.00 0.00 ATOM 26144 OH2 SOL 3510 1.450 6.380 68.280 1.00 0.00 ATOM 26145 H1 SOL 3510 0.880 5.700 68.650 1.00 0.00 ATOM 26146 H2 SOL 3510 1.000 6.670 67.490 1.00 0.00 ATOM 26147 OH2 SOL 3511 24.880 51.400 68.470 1.00 0.00 ATOM 26148 H1 SOL 3511 24.720 52.120 69.090 1.00 0.00 ATOM 26149 H2 SOL 3511 24.040 51.290 68.010 1.00 0.00 ATOM 26150 OH2 SOL 3512 59.030 12.830 72.300 1.00 0.00 ATOM 26151 H1 SOL 3512 59.720 12.440 71.760 1.00 0.00 ATOM 26152 H2 SOL 3512 58.980 12.260 73.070 1.00 0.00 ATOM 26153 OH2 SOL 3513 11.930 7.470 82.490 1.00 0.00 ATOM 26154 H1 SOL 3513 12.180 6.580 82.720 1.00 0.00 ATOM 26155 H2 SOL 3513 12.400 7.650 81.680 1.00 0.00 ATOM 26156 OH2 SOL 3514 15.510 17.120 70.710 1.00 0.00 ATOM 26157 H1 SOL 3514 15.390 17.320 71.640 1.00 0.00 ATOM 26158 H2 SOL 3514 14.650 17.280 70.320 1.00 0.00 ATOM 26159 OH2 SOL 3515 38.690 1.140 74.000 1.00 0.00 ATOM 26160 H1 SOL 3515 38.820 0.450 74.650 1.00 0.00 ATOM 26161 H2 SOL 3515 39.410 1.750 74.160 1.00 0.00 ATOM 26162 OH2 SOL 3516 34.100 57.160 20.580 1.00 0.00 ATOM 26163 H1 SOL 3516 34.990 57.130 20.250 1.00 0.00 ATOM 26164 H2 SOL 3516 34.100 56.550 21.320 1.00 0.00 ATOM 26165 OH2 SOL 3517 9.190 12.630 10.350 1.00 0.00 ATOM 26166 H1 SOL 3517 9.080 13.550 10.140 1.00 0.00 ATOM 26167 H2 SOL 3517 9.500 12.620 11.260 1.00 0.00 ATOM 26168 OH2 SOL 3518 43.710 52.780 70.840 1.00 0.00 ATOM 26169 H1 SOL 3518 43.400 53.580 71.260 1.00 0.00 ATOM 26170 H2 SOL 3518 44.040 52.240 71.560 1.00 0.00 ATOM 26171 OH2 SOL 3519 43.330 56.130 3.260 1.00 0.00 ATOM 26172 H1 SOL 3519 42.390 56.310 3.320 1.00 0.00 ATOM 26173 H2 SOL 3519 43.410 55.490 2.550 1.00 0.00 ATOM 26174 OH2 SOL 3520 49.610 8.380 77.970 1.00 0.00 ATOM 26175 H1 SOL 3520 49.060 8.100 78.700 1.00 0.00 ATOM 26176 H2 SOL 3520 49.850 7.570 77.530 1.00 0.00 ATOM 26177 OH2 SOL 3521 13.690 51.250 6.220 1.00 0.00 ATOM 26178 H1 SOL 3521 12.780 51.540 6.140 1.00 0.00 ATOM 26179 H2 SOL 3521 13.740 50.850 7.080 1.00 0.00 ATOM 26180 OH2 SOL 3522 59.110 24.240 18.950 1.00 0.00 ATOM 26181 H1 SOL 3522 59.340 23.480 18.420 1.00 0.00 ATOM 26182 H2 SOL 3522 59.570 24.970 18.540 1.00 0.00 ATOM 26183 OH2 SOL 3523 25.050 9.440 1.080 1.00 0.00 ATOM 26184 H1 SOL 3523 24.740 9.910 1.850 1.00 0.00 ATOM 26185 H2 SOL 3523 25.740 9.990 0.710 1.00 0.00 ATOM 26186 OH2 SOL 3524 53.530 30.110 22.920 1.00 0.00 ATOM 26187 H1 SOL 3524 54.030 29.300 22.890 1.00 0.00 ATOM 26188 H2 SOL 3524 52.990 30.030 23.700 1.00 0.00 ATOM 26189 OH2 SOL 3525 18.230 11.650 65.120 1.00 0.00 ATOM 26190 H1 SOL 3525 17.290 11.790 64.960 1.00 0.00 ATOM 26191 H2 SOL 3525 18.640 11.880 64.290 1.00 0.00 ATOM 26192 OH2 SOL 3526 10.880 54.270 80.540 1.00 0.00 ATOM 26193 H1 SOL 3526 11.450 53.510 80.440 1.00 0.00 ATOM 26194 H2 SOL 3526 10.460 54.140 81.400 1.00 0.00 ATOM 26195 OH2 SOL 3527 50.610 45.750 80.600 1.00 0.00 ATOM 26196 H1 SOL 3527 50.960 45.870 81.480 1.00 0.00 ATOM 26197 H2 SOL 3527 49.700 46.050 80.650 1.00 0.00 ATOM 26198 OH2 SOL 3528 58.620 31.700 1.920 1.00 0.00 ATOM 26199 H1 SOL 3528 58.820 30.870 2.350 1.00 0.00 ATOM 26200 H2 SOL 3528 58.060 31.460 1.180 1.00 0.00 ATOM 26201 OH2 SOL 3529 30.190 22.920 9.370 1.00 0.00 ATOM 26202 H1 SOL 3529 30.180 23.000 10.320 1.00 0.00 ATOM 26203 H2 SOL 3529 30.180 21.980 9.210 1.00 0.00 ATOM 26204 OH2 SOL 3530 40.630 16.360 82.380 1.00 0.00 ATOM 26205 H1 SOL 3530 40.520 17.050 81.730 1.00 0.00 ATOM 26206 H2 SOL 3530 41.530 16.050 82.260 1.00 0.00 ATOM 26207 OH2 SOL 3531 17.510 52.240 10.180 1.00 0.00 ATOM 26208 H1 SOL 3531 17.880 51.980 11.020 1.00 0.00 ATOM 26209 H2 SOL 3531 18.260 52.320 9.600 1.00 0.00 ATOM 26210 OH2 SOL 3532 6.140 16.940 73.050 1.00 0.00 ATOM 26211 H1 SOL 3532 5.760 17.820 72.970 1.00 0.00 ATOM 26212 H2 SOL 3532 6.680 16.840 72.270 1.00 0.00 ATOM 26213 OH2 SOL 3533 61.070 0.490 3.810 1.00 0.00 ATOM 26214 H1 SOL 3533 60.350 1.090 4.010 1.00 0.00 ATOM 26215 H2 SOL 3533 60.720 -0.380 4.000 1.00 0.00 ATOM 26216 OH2 SOL 3534 43.440 27.370 8.310 1.00 0.00 ATOM 26217 H1 SOL 3534 42.680 26.830 8.510 1.00 0.00 ATOM 26218 H2 SOL 3534 44.180 26.890 8.670 1.00 0.00 ATOM 26219 OH2 SOL 3535 27.430 46.720 79.920 1.00 0.00 ATOM 26220 H1 SOL 3535 26.860 46.530 79.180 1.00 0.00 ATOM 26221 H2 SOL 3535 26.950 47.360 80.440 1.00 0.00 ATOM 26222 OH2 SOL 3536 41.840 -0.090 23.120 1.00 0.00 ATOM 26223 H1 SOL 3536 42.720 -0.350 22.850 1.00 0.00 ATOM 26224 H2 SOL 3536 41.810 0.850 22.950 1.00 0.00 ATOM 26225 OH2 SOL 3537 24.790 54.940 77.900 1.00 0.00 ATOM 26226 H1 SOL 3537 24.220 54.490 77.280 1.00 0.00 ATOM 26227 H2 SOL 3537 24.190 55.460 78.440 1.00 0.00 ATOM 26228 OH2 SOL 3538 58.070 12.130 83.700 1.00 0.00 ATOM 26229 H1 SOL 3538 58.050 11.950 84.640 1.00 0.00 ATOM 26230 H2 SOL 3538 57.280 12.650 83.540 1.00 0.00 ATOM 26231 OH2 SOL 3539 25.080 15.480 72.660 1.00 0.00 ATOM 26232 H1 SOL 3539 25.570 15.860 73.380 1.00 0.00 ATOM 26233 H2 SOL 3539 25.090 14.540 72.830 1.00 0.00 ATOM 26234 OH2 SOL 3540 4.050 3.490 12.700 1.00 0.00 ATOM 26235 H1 SOL 3540 3.460 3.150 12.030 1.00 0.00 ATOM 26236 H2 SOL 3540 3.550 4.160 13.160 1.00 0.00 ATOM 26237 OH2 SOL 3541 33.800 33.830 6.140 1.00 0.00 ATOM 26238 H1 SOL 3541 33.080 34.440 6.000 1.00 0.00 ATOM 26239 H2 SOL 3541 33.730 33.590 7.070 1.00 0.00 ATOM 26240 OH2 SOL 3542 45.460 1.770 79.670 1.00 0.00 ATOM 26241 H1 SOL 3542 45.860 2.580 79.980 1.00 0.00 ATOM 26242 H2 SOL 3542 46.150 1.110 79.760 1.00 0.00 ATOM 26243 OH2 SOL 3543 36.940 34.990 77.090 1.00 0.00 ATOM 26244 H1 SOL 3543 36.910 35.930 76.910 1.00 0.00 ATOM 26245 H2 SOL 3543 37.330 34.930 77.960 1.00 0.00 ATOM 26246 OH2 SOL 3544 23.120 44.440 19.030 1.00 0.00 ATOM 26247 H1 SOL 3544 23.220 45.340 18.740 1.00 0.00 ATOM 26248 H2 SOL 3544 22.840 44.500 19.940 1.00 0.00 ATOM 26249 OH2 SOL 3545 4.930 33.190 9.420 1.00 0.00 ATOM 26250 H1 SOL 3545 5.600 33.820 9.670 1.00 0.00 ATOM 26251 H2 SOL 3545 4.510 33.570 8.650 1.00 0.00 ATOM 26252 OH2 SOL 3546 59.460 52.920 20.430 1.00 0.00 ATOM 26253 H1 SOL 3546 59.450 52.340 21.200 1.00 0.00 ATOM 26254 H2 SOL 3546 58.560 52.930 20.130 1.00 0.00 ATOM 26255 OH2 SOL 3547 4.320 42.180 81.830 1.00 0.00 ATOM 26256 H1 SOL 3547 4.340 43.120 81.620 1.00 0.00 ATOM 26257 H2 SOL 3547 3.540 41.850 81.390 1.00 0.00 ATOM 26258 OH2 SOL 3548 7.350 35.560 14.830 1.00 0.00 ATOM 26259 H1 SOL 3548 6.690 36.180 15.130 1.00 0.00 ATOM 26260 H2 SOL 3548 7.560 35.840 13.930 1.00 0.00 ATOM 26261 OH2 SOL 3549 12.120 10.550 79.800 1.00 0.00 ATOM 26262 H1 SOL 3549 12.140 11.160 80.540 1.00 0.00 ATOM 26263 H2 SOL 3549 11.250 10.660 79.430 1.00 0.00 ATOM 26264 OH2 SOL 3550 23.160 37.940 82.840 1.00 0.00 ATOM 26265 H1 SOL 3550 23.770 38.600 82.530 1.00 0.00 ATOM 26266 H2 SOL 3550 22.620 37.740 82.080 1.00 0.00 ATOM 26267 OH2 SOL 3551 18.810 31.470 70.820 1.00 0.00 ATOM 26268 H1 SOL 3551 18.210 30.740 70.950 1.00 0.00 ATOM 26269 H2 SOL 3551 18.250 32.210 70.600 1.00 0.00 ATOM 26270 OH2 SOL 3552 44.700 45.450 19.600 1.00 0.00 ATOM 26271 H1 SOL 3552 44.260 46.200 19.990 1.00 0.00 ATOM 26272 H2 SOL 3552 44.680 44.780 20.290 1.00 0.00 ATOM 26273 OH2 SOL 3553 34.950 8.870 76.390 1.00 0.00 ATOM 26274 H1 SOL 3553 34.690 8.950 77.300 1.00 0.00 ATOM 26275 H2 SOL 3553 34.120 8.790 75.910 1.00 0.00 ATOM 26276 OH2 SOL 3554 30.070 23.390 76.140 1.00 0.00 ATOM 26277 H1 SOL 3554 29.950 22.530 75.720 1.00 0.00 ATOM 26278 H2 SOL 3554 30.500 23.920 75.470 1.00 0.00 ATOM 26279 OH2 SOL 3555 44.460 53.010 2.100 1.00 0.00 ATOM 26280 H1 SOL 3555 43.840 53.580 1.640 1.00 0.00 ATOM 26281 H2 SOL 3555 43.910 52.500 2.690 1.00 0.00 ATOM 26282 OH2 SOL 3556 26.210 34.530 20.880 1.00 0.00 ATOM 26283 H1 SOL 3556 25.840 34.330 20.020 1.00 0.00 ATOM 26284 H2 SOL 3556 26.920 35.140 20.700 1.00 0.00 ATOM 26285 OH2 SOL 3557 41.320 6.130 82.620 1.00 0.00 ATOM 26286 H1 SOL 3557 41.190 6.330 83.550 1.00 0.00 ATOM 26287 H2 SOL 3557 40.560 6.510 82.180 1.00 0.00 ATOM 26288 OH2 SOL 3558 24.810 24.850 68.840 1.00 0.00 ATOM 26289 H1 SOL 3558 24.440 25.020 69.710 1.00 0.00 ATOM 26290 H2 SOL 3558 25.680 24.500 69.010 1.00 0.00 ATOM 26291 OH2 SOL 3559 33.780 27.100 2.880 1.00 0.00 ATOM 26292 H1 SOL 3559 33.360 26.810 3.680 1.00 0.00 ATOM 26293 H2 SOL 3559 34.530 27.620 3.170 1.00 0.00 ATOM 26294 OH2 SOL 3560 39.790 11.170 71.910 1.00 0.00 ATOM 26295 H1 SOL 3560 40.590 10.670 71.750 1.00 0.00 ATOM 26296 H2 SOL 3560 39.780 11.330 72.850 1.00 0.00 ATOM 26297 OH2 SOL 3561 46.890 3.950 80.610 1.00 0.00 ATOM 26298 H1 SOL 3561 47.120 4.470 79.840 1.00 0.00 ATOM 26299 H2 SOL 3561 46.140 4.410 80.990 1.00 0.00 ATOM 26300 OH2 SOL 3562 60.410 54.310 69.630 1.00 0.00 ATOM 26301 H1 SOL 3562 60.340 54.580 68.710 1.00 0.00 ATOM 26302 H2 SOL 3562 60.360 53.350 69.600 1.00 0.00 ATOM 26303 OH2 SOL 3563 20.150 14.920 23.600 1.00 0.00 ATOM 26304 H1 SOL 3563 19.830 14.130 23.170 1.00 0.00 ATOM 26305 H2 SOL 3563 20.430 14.630 24.460 1.00 0.00 ATOM 26306 OH2 SOL 3564 55.110 11.370 69.360 1.00 0.00 ATOM 26307 H1 SOL 3564 55.670 11.880 69.940 1.00 0.00 ATOM 26308 H2 SOL 3564 54.220 11.540 69.660 1.00 0.00 ATOM 26309 OH2 SOL 3565 0.120 54.770 72.260 1.00 0.00 ATOM 26310 H1 SOL 3565 1.040 54.690 72.030 1.00 0.00 ATOM 26311 H2 SOL 3565 -0.350 54.640 71.430 1.00 0.00 ATOM 26312 OH2 SOL 3566 36.350 34.910 12.850 1.00 0.00 ATOM 26313 H1 SOL 3566 36.030 35.800 12.720 1.00 0.00 ATOM 26314 H2 SOL 3566 37.300 35.010 12.960 1.00 0.00 ATOM 26315 OH2 SOL 3567 38.420 32.020 79.140 1.00 0.00 ATOM 26316 H1 SOL 3567 38.640 32.300 78.250 1.00 0.00 ATOM 26317 H2 SOL 3567 39.100 32.420 79.680 1.00 0.00 ATOM 26318 OH2 SOL 3568 40.620 44.670 64.550 1.00 0.00 ATOM 26319 H1 SOL 3568 40.080 45.430 64.340 1.00 0.00 ATOM 26320 H2 SOL 3568 40.090 43.920 64.300 1.00 0.00 ATOM 26321 OH2 SOL 3569 36.060 49.570 0.530 1.00 0.00 ATOM 26322 H1 SOL 3569 36.580 50.360 0.720 1.00 0.00 ATOM 26323 H2 SOL 3569 36.470 49.200 -0.250 1.00 0.00 ATOM 26324 OH2 SOL 3570 23.590 18.130 19.970 1.00 0.00 ATOM 26325 H1 SOL 3570 24.260 18.570 19.440 1.00 0.00 ATOM 26326 H2 SOL 3570 23.970 18.090 20.850 1.00 0.00 ATOM 26327 OH2 SOL 3571 28.310 53.010 64.920 1.00 0.00 ATOM 26328 H1 SOL 3571 27.430 52.680 65.100 1.00 0.00 ATOM 26329 H2 SOL 3571 28.690 52.350 64.340 1.00 0.00 ATOM 26330 OH2 SOL 3572 28.010 8.140 66.390 1.00 0.00 ATOM 26331 H1 SOL 3572 28.870 8.310 66.010 1.00 0.00 ATOM 26332 H2 SOL 3572 27.910 7.190 66.350 1.00 0.00 ATOM 26333 OH2 SOL 3573 3.560 17.990 82.030 1.00 0.00 ATOM 26334 H1 SOL 3573 4.270 17.460 81.670 1.00 0.00 ATOM 26335 H2 SOL 3573 3.180 18.430 81.260 1.00 0.00 ATOM 26336 OH2 SOL 3574 56.210 13.700 80.040 1.00 0.00 ATOM 26337 H1 SOL 3574 55.680 13.000 79.650 1.00 0.00 ATOM 26338 H2 SOL 3574 56.120 13.570 80.990 1.00 0.00 ATOM 26339 OH2 SOL 3575 9.830 19.010 75.020 1.00 0.00 ATOM 26340 H1 SOL 3575 9.470 19.800 74.610 1.00 0.00 ATOM 26341 H2 SOL 3575 9.320 18.290 74.650 1.00 0.00 ATOM 26342 OH2 SOL 3576 46.590 53.950 14.160 1.00 0.00 ATOM 26343 H1 SOL 3576 46.670 53.010 14.300 1.00 0.00 ATOM 26344 H2 SOL 3576 47.040 54.110 13.340 1.00 0.00 ATOM 26345 OH2 SOL 3577 9.620 39.900 10.530 1.00 0.00 ATOM 26346 H1 SOL 3577 9.460 40.220 11.420 1.00 0.00 ATOM 26347 H2 SOL 3577 9.360 40.630 9.970 1.00 0.00 ATOM 26348 OH2 SOL 3578 40.330 25.780 76.980 1.00 0.00 ATOM 26349 H1 SOL 3578 40.950 25.200 76.520 1.00 0.00 ATOM 26350 H2 SOL 3578 39.650 25.190 77.300 1.00 0.00 ATOM 26351 OH2 SOL 3579 12.720 14.980 69.460 1.00 0.00 ATOM 26352 H1 SOL 3579 12.900 15.910 69.360 1.00 0.00 ATOM 26353 H2 SOL 3579 13.240 14.560 68.780 1.00 0.00 ATOM 26354 OH2 SOL 3580 44.990 56.470 83.400 1.00 0.00 ATOM 26355 H1 SOL 3580 45.200 55.780 82.770 1.00 0.00 ATOM 26356 H2 SOL 3580 44.070 56.310 83.640 1.00 0.00 ATOM 26357 OH2 SOL 3581 42.700 9.590 74.250 1.00 0.00 ATOM 26358 H1 SOL 3581 42.730 10.530 74.450 1.00 0.00 ATOM 26359 H2 SOL 3581 43.370 9.460 73.580 1.00 0.00 ATOM 26360 OH2 SOL 3582 31.340 58.540 69.270 1.00 0.00 ATOM 26361 H1 SOL 3582 31.760 59.140 69.900 1.00 0.00 ATOM 26362 H2 SOL 3582 32.060 58.120 68.820 1.00 0.00 ATOM 26363 OH2 SOL 3583 9.040 29.160 4.740 1.00 0.00 ATOM 26364 H1 SOL 3583 9.150 29.970 4.260 1.00 0.00 ATOM 26365 H2 SOL 3583 9.570 28.520 4.260 1.00 0.00 ATOM 26366 OH2 SOL 3584 6.430 36.770 74.840 1.00 0.00 ATOM 26367 H1 SOL 3584 6.880 37.600 75.030 1.00 0.00 ATOM 26368 H2 SOL 3584 5.990 36.920 74.000 1.00 0.00 ATOM 26369 OH2 SOL 3585 15.470 17.350 73.760 1.00 0.00 ATOM 26370 H1 SOL 3585 15.160 16.450 73.730 1.00 0.00 ATOM 26371 H2 SOL 3585 16.130 17.350 74.460 1.00 0.00 ATOM 26372 OH2 SOL 3586 50.920 22.150 72.160 1.00 0.00 ATOM 26373 H1 SOL 3586 51.810 21.790 72.230 1.00 0.00 ATOM 26374 H2 SOL 3586 50.950 22.700 71.380 1.00 0.00 ATOM 26375 OH2 SOL 3587 25.600 12.600 76.870 1.00 0.00 ATOM 26376 H1 SOL 3587 25.280 13.060 77.640 1.00 0.00 ATOM 26377 H2 SOL 3587 26.350 13.120 76.570 1.00 0.00 ATOM 26378 OH2 SOL 3588 31.830 3.830 72.200 1.00 0.00 ATOM 26379 H1 SOL 3588 32.270 3.020 72.460 1.00 0.00 ATOM 26380 H2 SOL 3588 32.500 4.350 71.770 1.00 0.00 ATOM 26381 OH2 SOL 3589 39.060 31.920 75.890 1.00 0.00 ATOM 26382 H1 SOL 3589 39.080 31.150 75.320 1.00 0.00 ATOM 26383 H2 SOL 3589 39.780 31.780 76.500 1.00 0.00 ATOM 26384 OH2 SOL 3590 11.950 29.830 7.330 1.00 0.00 ATOM 26385 H1 SOL 3590 12.390 30.180 6.550 1.00 0.00 ATOM 26386 H2 SOL 3590 12.580 29.200 7.690 1.00 0.00 ATOM 26387 OH2 SOL 3591 39.690 23.350 10.000 1.00 0.00 ATOM 26388 H1 SOL 3591 39.390 23.430 10.910 1.00 0.00 ATOM 26389 H2 SOL 3591 38.910 23.520 9.480 1.00 0.00 ATOM 26390 OH2 SOL 3592 15.550 11.270 16.430 1.00 0.00 ATOM 26391 H1 SOL 3592 15.800 10.480 15.950 1.00 0.00 ATOM 26392 H2 SOL 3592 15.110 10.950 17.210 1.00 0.00 ATOM 26393 OH2 SOL 3593 2.580 51.730 75.480 1.00 0.00 ATOM 26394 H1 SOL 3593 2.420 52.670 75.570 1.00 0.00 ATOM 26395 H2 SOL 3593 2.480 51.550 74.550 1.00 0.00 ATOM 26396 OH2 SOL 3594 53.580 32.070 8.950 1.00 0.00 ATOM 26397 H1 SOL 3594 54.450 31.670 8.920 1.00 0.00 ATOM 26398 H2 SOL 3594 52.980 31.340 8.770 1.00 0.00 ATOM 26399 OH2 SOL 3595 46.950 12.810 82.560 1.00 0.00 ATOM 26400 H1 SOL 3595 46.610 11.930 82.730 1.00 0.00 ATOM 26401 H2 SOL 3595 46.660 13.010 81.670 1.00 0.00 ATOM 26402 OH2 SOL 3596 2.490 15.570 79.060 1.00 0.00 ATOM 26403 H1 SOL 3596 2.540 14.990 78.300 1.00 0.00 ATOM 26404 H2 SOL 3596 1.960 16.310 78.770 1.00 0.00 ATOM 26405 OH2 SOL 3597 23.010 20.220 80.000 1.00 0.00 ATOM 26406 H1 SOL 3597 22.200 20.650 80.260 1.00 0.00 ATOM 26407 H2 SOL 3597 23.540 20.200 80.800 1.00 0.00 ATOM 26408 OH2 SOL 3598 13.250 20.800 69.930 1.00 0.00 ATOM 26409 H1 SOL 3598 13.520 20.750 70.840 1.00 0.00 ATOM 26410 H2 SOL 3598 13.160 19.880 69.660 1.00 0.00 ATOM 26411 OH2 SOL 3599 45.280 45.310 69.420 1.00 0.00 ATOM 26412 H1 SOL 3599 44.650 45.330 68.700 1.00 0.00 ATOM 26413 H2 SOL 3599 45.080 46.090 69.940 1.00 0.00 ATOM 26414 OH2 SOL 3600 56.770 17.640 23.690 1.00 0.00 ATOM 26415 H1 SOL 3600 56.720 17.840 24.620 1.00 0.00 ATOM 26416 H2 SOL 3600 56.700 18.490 23.260 1.00 0.00 ATOM 26417 OH2 SOL 3601 45.630 10.580 83.620 1.00 0.00 ATOM 26418 H1 SOL 3601 44.860 10.010 83.560 1.00 0.00 ATOM 26419 H2 SOL 3601 46.260 10.080 84.140 1.00 0.00 ATOM 26420 OH2 SOL 3602 9.040 5.450 67.620 1.00 0.00 ATOM 26421 H1 SOL 3602 9.050 6.390 67.850 1.00 0.00 ATOM 26422 H2 SOL 3602 8.220 5.330 67.150 1.00 0.00 ATOM 26423 OH2 SOL 3603 5.060 44.280 8.300 1.00 0.00 ATOM 26424 H1 SOL 3603 4.340 44.530 8.880 1.00 0.00 ATOM 26425 H2 SOL 3603 5.740 43.960 8.890 1.00 0.00 ATOM 26426 OH2 SOL 3604 40.580 54.600 79.910 1.00 0.00 ATOM 26427 H1 SOL 3604 40.630 55.550 79.920 1.00 0.00 ATOM 26428 H2 SOL 3604 40.490 54.360 78.990 1.00 0.00 ATOM 26429 OH2 SOL 3605 29.370 16.970 8.400 1.00 0.00 ATOM 26430 H1 SOL 3605 29.050 17.870 8.350 1.00 0.00 ATOM 26431 H2 SOL 3605 30.320 17.060 8.450 1.00 0.00 ATOM 26432 OH2 SOL 3606 26.380 54.040 69.680 1.00 0.00 ATOM 26433 H1 SOL 3606 26.510 54.010 68.730 1.00 0.00 ATOM 26434 H2 SOL 3606 27.240 54.270 70.030 1.00 0.00 ATOM 26435 OH2 SOL 3607 25.020 39.250 14.620 1.00 0.00 ATOM 26436 H1 SOL 3607 25.820 39.020 15.090 1.00 0.00 ATOM 26437 H2 SOL 3607 24.560 39.850 15.200 1.00 0.00 ATOM 26438 OH2 SOL 3608 37.190 27.000 25.180 1.00 0.00 ATOM 26439 H1 SOL 3608 36.810 26.910 26.050 1.00 0.00 ATOM 26440 H2 SOL 3608 38.140 26.950 25.330 1.00 0.00 ATOM 26441 OH2 SOL 3609 11.830 4.650 11.540 1.00 0.00 ATOM 26442 H1 SOL 3609 12.060 4.340 12.420 1.00 0.00 ATOM 26443 H2 SOL 3609 12.210 5.520 11.480 1.00 0.00 ATOM 26444 OH2 SOL 3610 1.610 18.080 19.310 1.00 0.00 ATOM 26445 H1 SOL 3610 1.070 18.850 19.460 1.00 0.00 ATOM 26446 H2 SOL 3610 1.730 17.690 20.170 1.00 0.00 ATOM 26447 OH2 SOL 3611 19.690 25.220 82.950 1.00 0.00 ATOM 26448 H1 SOL 3611 20.410 25.020 83.540 1.00 0.00 ATOM 26449 H2 SOL 3611 20.110 25.640 82.190 1.00 0.00 ATOM 26450 OH2 SOL 3612 33.310 15.190 75.270 1.00 0.00 ATOM 26451 H1 SOL 3612 34.130 14.840 74.910 1.00 0.00 ATOM 26452 H2 SOL 3612 33.590 15.880 75.880 1.00 0.00 ATOM 26453 OH2 SOL 3613 50.370 6.350 65.430 1.00 0.00 ATOM 26454 H1 SOL 3613 51.140 6.820 65.730 1.00 0.00 ATOM 26455 H2 SOL 3613 50.710 5.560 65.030 1.00 0.00 ATOM 26456 OH2 SOL 3614 47.670 9.280 21.230 1.00 0.00 ATOM 26457 H1 SOL 3614 48.270 10.010 21.090 1.00 0.00 ATOM 26458 H2 SOL 3614 48.230 8.530 21.400 1.00 0.00 ATOM 26459 OH2 SOL 3615 48.560 30.970 12.600 1.00 0.00 ATOM 26460 H1 SOL 3615 48.120 31.540 11.980 1.00 0.00 ATOM 26461 H2 SOL 3615 47.870 30.410 12.950 1.00 0.00 ATOM 26462 OH2 SOL 3616 8.540 25.140 19.600 1.00 0.00 ATOM 26463 H1 SOL 3616 7.750 24.650 19.360 1.00 0.00 ATOM 26464 H2 SOL 3616 8.220 25.850 20.160 1.00 0.00 ATOM 26465 OH2 SOL 3617 14.870 26.810 19.030 1.00 0.00 ATOM 26466 H1 SOL 3617 15.610 26.270 19.320 1.00 0.00 ATOM 26467 H2 SOL 3617 14.400 26.270 18.400 1.00 0.00 ATOM 26468 OH2 SOL 3618 35.930 40.860 10.430 1.00 0.00 ATOM 26469 H1 SOL 3618 35.960 40.740 11.370 1.00 0.00 ATOM 26470 H2 SOL 3618 36.440 40.140 10.070 1.00 0.00 ATOM 26471 OH2 SOL 3619 5.100 51.090 76.830 1.00 0.00 ATOM 26472 H1 SOL 3619 5.500 50.300 76.470 1.00 0.00 ATOM 26473 H2 SOL 3619 4.210 51.090 76.480 1.00 0.00 ATOM 26474 OH2 SOL 3620 32.050 53.730 62.810 1.00 0.00 ATOM 26475 H1 SOL 3620 31.960 53.010 62.190 1.00 0.00 ATOM 26476 H2 SOL 3620 32.280 54.490 62.270 1.00 0.00 ATOM 26477 OH2 SOL 3621 42.280 41.250 79.740 1.00 0.00 ATOM 26478 H1 SOL 3621 41.760 40.460 79.600 1.00 0.00 ATOM 26479 H2 SOL 3621 42.610 41.490 78.870 1.00 0.00 ATOM 26480 OH2 SOL 3622 21.450 11.910 75.400 1.00 0.00 ATOM 26481 H1 SOL 3622 21.730 12.650 75.930 1.00 0.00 ATOM 26482 H2 SOL 3622 22.200 11.320 75.380 1.00 0.00 ATOM 26483 OH2 SOL 3623 22.110 11.980 1.890 1.00 0.00 ATOM 26484 H1 SOL 3623 22.080 11.350 1.170 1.00 0.00 ATOM 26485 H2 SOL 3623 21.980 12.830 1.470 1.00 0.00 ATOM 26486 OH2 SOL 3624 22.490 49.420 10.930 1.00 0.00 ATOM 26487 H1 SOL 3624 22.850 48.820 10.280 1.00 0.00 ATOM 26488 H2 SOL 3624 22.050 48.850 11.560 1.00 0.00 ATOM 26489 OH2 SOL 3625 50.880 16.960 76.480 1.00 0.00 ATOM 26490 H1 SOL 3625 50.960 17.570 75.750 1.00 0.00 ATOM 26491 H2 SOL 3625 51.550 17.240 77.110 1.00 0.00 ATOM 26492 OH2 SOL 3626 30.030 49.000 3.800 1.00 0.00 ATOM 26493 H1 SOL 3626 29.520 49.780 3.600 1.00 0.00 ATOM 26494 H2 SOL 3626 30.650 48.920 3.070 1.00 0.00 ATOM 26495 OH2 SOL 3627 30.810 23.230 18.830 1.00 0.00 ATOM 26496 H1 SOL 3627 30.550 23.840 19.520 1.00 0.00 ATOM 26497 H2 SOL 3627 30.590 22.360 19.190 1.00 0.00 ATOM 26498 OH2 SOL 3628 29.290 18.750 73.460 1.00 0.00 ATOM 26499 H1 SOL 3628 29.830 17.970 73.410 1.00 0.00 ATOM 26500 H2 SOL 3628 28.930 18.860 72.570 1.00 0.00 ATOM 26501 OH2 SOL 3629 47.850 33.650 2.650 1.00 0.00 ATOM 26502 H1 SOL 3629 47.240 33.990 1.980 1.00 0.00 ATOM 26503 H2 SOL 3629 47.910 32.710 2.460 1.00 0.00 ATOM 26504 OH2 SOL 3630 54.210 41.810 80.450 1.00 0.00 ATOM 26505 H1 SOL 3630 54.140 41.240 81.220 1.00 0.00 ATOM 26506 H2 SOL 3630 55.020 42.300 80.600 1.00 0.00 ATOM 26507 OH2 SOL 3631 38.130 8.970 18.310 1.00 0.00 ATOM 26508 H1 SOL 3631 38.300 9.560 19.040 1.00 0.00 ATOM 26509 H2 SOL 3631 38.830 9.140 17.690 1.00 0.00 ATOM 26510 OH2 SOL 3632 42.790 50.940 20.370 1.00 0.00 ATOM 26511 H1 SOL 3632 43.200 51.700 19.970 1.00 0.00 ATOM 26512 H2 SOL 3632 42.360 50.490 19.630 1.00 0.00 ATOM 26513 OH2 SOL 3633 26.940 48.020 77.160 1.00 0.00 ATOM 26514 H1 SOL 3633 26.430 47.600 76.470 1.00 0.00 ATOM 26515 H2 SOL 3633 27.800 47.590 77.110 1.00 0.00 ATOM 26516 OH2 SOL 3634 48.260 15.370 14.570 1.00 0.00 ATOM 26517 H1 SOL 3634 48.120 16.310 14.670 1.00 0.00 ATOM 26518 H2 SOL 3634 47.890 14.990 15.370 1.00 0.00 ATOM 26519 OH2 SOL 3635 58.730 1.610 4.310 1.00 0.00 ATOM 26520 H1 SOL 3635 58.350 2.210 4.950 1.00 0.00 ATOM 26521 H2 SOL 3635 57.970 1.180 3.900 1.00 0.00 ATOM 26522 OH2 SOL 3636 44.120 46.790 24.180 1.00 0.00 ATOM 26523 H1 SOL 3636 43.160 46.850 24.220 1.00 0.00 ATOM 26524 H2 SOL 3636 44.290 45.910 23.840 1.00 0.00 ATOM 26525 OH2 SOL 3637 19.070 49.460 18.660 1.00 0.00 ATOM 26526 H1 SOL 3637 19.090 50.320 18.250 1.00 0.00 ATOM 26527 H2 SOL 3637 18.530 49.570 19.430 1.00 0.00 ATOM 26528 OH2 SOL 3638 57.350 45.460 13.080 1.00 0.00 ATOM 26529 H1 SOL 3638 58.190 45.720 13.450 1.00 0.00 ATOM 26530 H2 SOL 3638 57.330 45.870 12.220 1.00 0.00 ATOM 26531 OH2 SOL 3639 6.330 26.570 78.100 1.00 0.00 ATOM 26532 H1 SOL 3639 6.760 27.360 78.430 1.00 0.00 ATOM 26533 H2 SOL 3639 5.640 26.390 78.740 1.00 0.00 ATOM 26534 OH2 SOL 3640 49.500 43.500 79.260 1.00 0.00 ATOM 26535 H1 SOL 3640 50.090 44.210 79.530 1.00 0.00 ATOM 26536 H2 SOL 3640 50.080 42.740 79.150 1.00 0.00 ATOM 26537 OH2 SOL 3641 57.330 16.270 27.160 1.00 0.00 ATOM 26538 H1 SOL 3641 58.100 16.060 27.690 1.00 0.00 ATOM 26539 H2 SOL 3641 56.730 15.540 27.300 1.00 0.00 ATOM 26540 OH2 SOL 3642 46.460 24.110 15.040 1.00 0.00 ATOM 26541 H1 SOL 3642 46.880 23.500 15.650 1.00 0.00 ATOM 26542 H2 SOL 3642 46.700 23.790 14.180 1.00 0.00 ATOM 26543 OH2 SOL 3643 9.930 31.600 6.330 1.00 0.00 ATOM 26544 H1 SOL 3643 10.360 32.240 6.890 1.00 0.00 ATOM 26545 H2 SOL 3643 10.420 30.790 6.480 1.00 0.00 ATOM 26546 OH2 SOL 3644 45.290 10.730 9.400 1.00 0.00 ATOM 26547 H1 SOL 3644 44.840 9.900 9.230 1.00 0.00 ATOM 26548 H2 SOL 3644 44.860 11.090 10.170 1.00 0.00 ATOM 26549 OH2 SOL 3645 13.780 30.790 25.100 1.00 0.00 ATOM 26550 H1 SOL 3645 13.030 31.280 24.750 1.00 0.00 ATOM 26551 H2 SOL 3645 13.380 30.050 25.560 1.00 0.00 ATOM 26552 OH2 SOL 3646 25.100 3.180 17.180 1.00 0.00 ATOM 26553 H1 SOL 3646 25.970 2.810 17.020 1.00 0.00 ATOM 26554 H2 SOL 3646 25.270 4.100 17.400 1.00 0.00 ATOM 26555 OH2 SOL 3647 52.310 58.120 82.610 1.00 0.00 ATOM 26556 H1 SOL 3647 52.520 57.190 82.610 1.00 0.00 ATOM 26557 H2 SOL 3647 51.620 58.220 83.270 1.00 0.00 ATOM 26558 OH2 SOL 3648 52.300 29.060 71.660 1.00 0.00 ATOM 26559 H1 SOL 3648 52.560 29.980 71.730 1.00 0.00 ATOM 26560 H2 SOL 3648 53.030 28.640 71.200 1.00 0.00 ATOM 26561 OH2 SOL 3649 30.380 16.840 71.380 1.00 0.00 ATOM 26562 H1 SOL 3649 30.950 16.780 70.610 1.00 0.00 ATOM 26563 H2 SOL 3649 29.500 16.770 71.020 1.00 0.00 ATOM 26564 OH2 SOL 3650 23.540 47.030 18.200 1.00 0.00 ATOM 26565 H1 SOL 3650 22.940 47.620 17.760 1.00 0.00 ATOM 26566 H2 SOL 3650 24.400 47.220 17.810 1.00 0.00 ATOM 26567 OH2 SOL 3651 29.830 35.510 23.450 1.00 0.00 ATOM 26568 H1 SOL 3651 30.570 35.820 23.970 1.00 0.00 ATOM 26569 H2 SOL 3651 29.070 35.660 24.000 1.00 0.00 ATOM 26570 OH2 SOL 3652 30.990 43.040 2.150 1.00 0.00 ATOM 26571 H1 SOL 3652 30.160 43.520 2.090 1.00 0.00 ATOM 26572 H2 SOL 3652 31.480 43.310 1.370 1.00 0.00 ATOM 26573 OH2 SOL 3653 15.210 35.300 28.190 1.00 0.00 ATOM 26574 H1 SOL 3653 15.630 36.020 28.650 1.00 0.00 ATOM 26575 H2 SOL 3653 14.340 35.240 28.580 1.00 0.00 ATOM 26576 OH2 SOL 3654 26.620 4.260 68.790 1.00 0.00 ATOM 26577 H1 SOL 3654 27.210 3.570 69.100 1.00 0.00 ATOM 26578 H2 SOL 3654 26.050 3.820 68.150 1.00 0.00 ATOM 26579 OH2 SOL 3655 53.330 24.520 66.700 1.00 0.00 ATOM 26580 H1 SOL 3655 53.660 24.120 65.890 1.00 0.00 ATOM 26581 H2 SOL 3655 52.460 24.840 66.460 1.00 0.00 ATOM 26582 OH2 SOL 3656 5.380 8.090 83.130 1.00 0.00 ATOM 26583 H1 SOL 3656 4.960 7.830 83.950 1.00 0.00 ATOM 26584 H2 SOL 3656 5.630 7.260 82.720 1.00 0.00 ATOM 26585 OH2 SOL 3657 42.820 28.060 18.400 1.00 0.00 ATOM 26586 H1 SOL 3657 42.200 28.570 18.930 1.00 0.00 ATOM 26587 H2 SOL 3657 43.260 27.500 19.040 1.00 0.00 ATOM 26588 OH2 SOL 3658 22.880 9.040 7.240 1.00 0.00 ATOM 26589 H1 SOL 3658 23.510 8.480 6.790 1.00 0.00 ATOM 26590 H2 SOL 3658 22.210 9.240 6.590 1.00 0.00 ATOM 26591 OH2 SOL 3659 5.420 55.650 23.280 1.00 0.00 ATOM 26592 H1 SOL 3659 5.510 56.220 24.040 1.00 0.00 ATOM 26593 H2 SOL 3659 4.500 55.750 23.010 1.00 0.00 ATOM 26594 OH2 SOL 3660 50.600 24.280 77.660 1.00 0.00 ATOM 26595 H1 SOL 3660 50.360 23.740 76.900 1.00 0.00 ATOM 26596 H2 SOL 3660 50.860 25.120 77.290 1.00 0.00 ATOM 26597 OH2 SOL 3661 3.860 23.120 70.640 1.00 0.00 ATOM 26598 H1 SOL 3661 4.160 23.980 70.970 1.00 0.00 ATOM 26599 H2 SOL 3661 4.200 23.080 69.750 1.00 0.00 ATOM 26600 OH2 SOL 3662 5.480 54.800 76.240 1.00 0.00 ATOM 26601 H1 SOL 3662 6.220 54.870 76.840 1.00 0.00 ATOM 26602 H2 SOL 3662 4.780 55.310 76.670 1.00 0.00 ATOM 26603 OH2 SOL 3663 56.000 48.520 80.740 1.00 0.00 ATOM 26604 H1 SOL 3663 55.270 48.240 80.180 1.00 0.00 ATOM 26605 H2 SOL 3663 56.780 48.190 80.300 1.00 0.00 ATOM 26606 OH2 SOL 3664 3.900 25.440 78.860 1.00 0.00 ATOM 26607 H1 SOL 3664 4.040 24.910 78.070 1.00 0.00 ATOM 26608 H2 SOL 3664 3.870 24.800 79.570 1.00 0.00 ATOM 26609 OH2 SOL 3665 9.900 17.840 12.160 1.00 0.00 ATOM 26610 H1 SOL 3665 9.690 17.360 11.360 1.00 0.00 ATOM 26611 H2 SOL 3665 9.080 17.860 12.650 1.00 0.00 ATOM 26612 OH2 SOL 3666 7.580 7.490 15.800 1.00 0.00 ATOM 26613 H1 SOL 3666 7.840 6.700 16.260 1.00 0.00 ATOM 26614 H2 SOL 3666 7.350 8.110 16.490 1.00 0.00 ATOM 26615 OH2 SOL 3667 37.330 6.580 2.920 1.00 0.00 ATOM 26616 H1 SOL 3667 36.820 5.850 2.560 1.00 0.00 ATOM 26617 H2 SOL 3667 37.520 7.130 2.160 1.00 0.00 ATOM 26618 OH2 SOL 3668 40.200 58.350 16.240 1.00 0.00 ATOM 26619 H1 SOL 3668 40.630 57.850 16.930 1.00 0.00 ATOM 26620 H2 SOL 3668 40.880 58.940 15.910 1.00 0.00 ATOM 26621 OH2 SOL 3669 12.910 35.310 75.830 1.00 0.00 ATOM 26622 H1 SOL 3669 12.940 34.630 76.510 1.00 0.00 ATOM 26623 H2 SOL 3669 13.830 35.530 75.680 1.00 0.00 ATOM 26624 OH2 SOL 3670 11.920 51.380 14.290 1.00 0.00 ATOM 26625 H1 SOL 3670 11.280 51.010 14.900 1.00 0.00 ATOM 26626 H2 SOL 3670 11.870 50.810 13.520 1.00 0.00 ATOM 26627 OH2 SOL 3671 55.640 53.400 4.380 1.00 0.00 ATOM 26628 H1 SOL 3671 55.810 53.030 5.250 1.00 0.00 ATOM 26629 H2 SOL 3671 56.270 54.120 4.300 1.00 0.00 ATOM 26630 OH2 SOL 3672 35.340 47.530 15.310 1.00 0.00 ATOM 26631 H1 SOL 3672 35.170 47.680 16.240 1.00 0.00 ATOM 26632 H2 SOL 3672 34.850 46.740 15.100 1.00 0.00 ATOM 26633 OH2 SOL 3673 25.720 12.760 4.750 1.00 0.00 ATOM 26634 H1 SOL 3673 26.520 12.280 4.940 1.00 0.00 ATOM 26635 H2 SOL 3673 25.580 13.310 5.520 1.00 0.00 ATOM 26636 OH2 SOL 3674 53.940 3.400 17.850 1.00 0.00 ATOM 26637 H1 SOL 3674 54.500 3.420 18.630 1.00 0.00 ATOM 26638 H2 SOL 3674 53.320 4.120 17.990 1.00 0.00 ATOM 26639 OH2 SOL 3675 48.190 4.420 20.480 1.00 0.00 ATOM 26640 H1 SOL 3675 48.040 3.980 21.320 1.00 0.00 ATOM 26641 H2 SOL 3675 48.690 5.200 20.700 1.00 0.00 ATOM 26642 OH2 SOL 3676 8.600 15.550 16.150 1.00 0.00 ATOM 26643 H1 SOL 3676 8.630 14.600 16.190 1.00 0.00 ATOM 26644 H2 SOL 3676 9.490 15.810 15.920 1.00 0.00 ATOM 26645 OH2 SOL 3677 27.630 23.850 19.560 1.00 0.00 ATOM 26646 H1 SOL 3677 27.610 23.090 18.980 1.00 0.00 ATOM 26647 H2 SOL 3677 27.840 23.490 20.420 1.00 0.00 ATOM 26648 OH2 SOL 3678 3.650 37.870 2.340 1.00 0.00 ATOM 26649 H1 SOL 3678 4.130 38.690 2.290 1.00 0.00 ATOM 26650 H2 SOL 3678 4.230 37.260 2.790 1.00 0.00 ATOM 26651 OH2 SOL 3679 46.530 21.910 82.940 1.00 0.00 ATOM 26652 H1 SOL 3679 46.540 21.280 83.670 1.00 0.00 ATOM 26653 H2 SOL 3679 47.060 22.640 83.260 1.00 0.00 ATOM 26654 OH2 SOL 3680 49.220 19.060 7.110 1.00 0.00 ATOM 26655 H1 SOL 3680 49.960 18.540 6.790 1.00 0.00 ATOM 26656 H2 SOL 3680 49.000 19.630 6.370 1.00 0.00 ATOM 26657 OH2 SOL 3681 48.600 1.960 81.910 1.00 0.00 ATOM 26658 H1 SOL 3681 48.060 2.690 81.610 1.00 0.00 ATOM 26659 H2 SOL 3681 48.970 1.590 81.100 1.00 0.00 ATOM 26660 OH2 SOL 3682 12.910 39.560 11.490 1.00 0.00 ATOM 26661 H1 SOL 3682 12.380 39.880 10.760 1.00 0.00 ATOM 26662 H2 SOL 3682 12.360 38.880 11.890 1.00 0.00 ATOM 26663 OH2 SOL 3683 32.720 32.440 15.220 1.00 0.00 ATOM 26664 H1 SOL 3683 33.290 32.120 15.910 1.00 0.00 ATOM 26665 H2 SOL 3683 32.230 31.670 14.930 1.00 0.00 ATOM 26666 OH2 SOL 3684 16.810 13.250 9.260 1.00 0.00 ATOM 26667 H1 SOL 3684 15.950 13.000 9.580 1.00 0.00 ATOM 26668 H2 SOL 3684 16.660 14.050 8.750 1.00 0.00 ATOM 26669 OH2 SOL 3685 22.810 2.660 65.090 1.00 0.00 ATOM 26670 H1 SOL 3685 23.360 3.440 65.120 1.00 0.00 ATOM 26671 H2 SOL 3685 23.250 2.080 64.470 1.00 0.00 ATOM 26672 OH2 SOL 3686 18.830 14.710 81.630 1.00 0.00 ATOM 26673 H1 SOL 3686 18.890 14.460 80.710 1.00 0.00 ATOM 26674 H2 SOL 3686 18.260 14.050 82.020 1.00 0.00 ATOM 26675 OH2 SOL 3687 26.540 20.470 75.230 1.00 0.00 ATOM 26676 H1 SOL 3687 25.800 21.060 75.100 1.00 0.00 ATOM 26677 H2 SOL 3687 26.430 20.140 76.120 1.00 0.00 ATOM 26678 OH2 SOL 3688 8.290 55.120 18.670 1.00 0.00 ATOM 26679 H1 SOL 3688 7.750 55.610 19.290 1.00 0.00 ATOM 26680 H2 SOL 3688 8.910 55.770 18.330 1.00 0.00 ATOM 26681 OH2 SOL 3689 13.960 9.480 68.210 1.00 0.00 ATOM 26682 H1 SOL 3689 14.320 8.790 68.770 1.00 0.00 ATOM 26683 H2 SOL 3689 14.590 9.570 67.500 1.00 0.00 ATOM 26684 OH2 SOL 3690 4.260 11.030 14.110 1.00 0.00 ATOM 26685 H1 SOL 3690 4.720 10.450 13.500 1.00 0.00 ATOM 26686 H2 SOL 3690 3.720 10.440 14.640 1.00 0.00 ATOM 26687 OH2 SOL 3691 36.400 11.360 83.360 1.00 0.00 ATOM 26688 H1 SOL 3691 35.570 10.890 83.450 1.00 0.00 ATOM 26689 H2 SOL 3691 36.870 11.170 84.170 1.00 0.00 ATOM 26690 OH2 SOL 3692 37.130 30.490 81.190 1.00 0.00 ATOM 26691 H1 SOL 3692 37.590 30.960 80.510 1.00 0.00 ATOM 26692 H2 SOL 3692 36.780 29.710 80.750 1.00 0.00 ATOM 26693 OH2 SOL 3693 45.620 56.260 63.280 1.00 0.00 ATOM 26694 H1 SOL 3693 46.360 56.770 63.590 1.00 0.00 ATOM 26695 H2 SOL 3693 45.980 55.700 62.590 1.00 0.00 ATOM 26696 OH2 SOL 3694 19.070 2.060 26.540 1.00 0.00 ATOM 26697 H1 SOL 3694 18.530 1.310 26.780 1.00 0.00 ATOM 26698 H2 SOL 3694 19.880 1.950 27.050 1.00 0.00 ATOM 26699 OH2 SOL 3695 2.050 36.460 71.080 1.00 0.00 ATOM 26700 H1 SOL 3695 1.840 37.230 70.550 1.00 0.00 ATOM 26701 H2 SOL 3695 2.620 35.930 70.520 1.00 0.00 ATOM 26702 OH2 SOL 3696 20.260 0.340 24.520 1.00 0.00 ATOM 26703 H1 SOL 3696 19.790 0.730 25.270 1.00 0.00 ATOM 26704 H2 SOL 3696 19.890 -0.540 24.440 1.00 0.00 ATOM 26705 OH2 SOL 3697 14.360 14.490 67.310 1.00 0.00 ATOM 26706 H1 SOL 3697 15.190 14.860 67.590 1.00 0.00 ATOM 26707 H2 SOL 3697 14.150 14.940 66.490 1.00 0.00 ATOM 26708 OH2 SOL 3698 14.370 7.960 12.960 1.00 0.00 ATOM 26709 H1 SOL 3698 15.300 8.190 12.850 1.00 0.00 ATOM 26710 H2 SOL 3698 14.380 7.040 13.190 1.00 0.00 ATOM 26711 OH2 SOL 3699 24.940 20.570 11.650 1.00 0.00 ATOM 26712 H1 SOL 3699 24.160 20.520 12.200 1.00 0.00 ATOM 26713 H2 SOL 3699 24.670 21.100 10.900 1.00 0.00 ATOM 26714 OH2 SOL 3700 18.380 27.040 16.050 1.00 0.00 ATOM 26715 H1 SOL 3700 18.900 26.270 15.840 1.00 0.00 ATOM 26716 H2 SOL 3700 17.800 27.160 15.290 1.00 0.00 ATOM 26717 OH2 SOL 3701 56.740 46.270 28.200 1.00 0.00 ATOM 26718 H1 SOL 3701 55.880 45.970 27.920 1.00 0.00 ATOM 26719 H2 SOL 3701 57.350 45.620 27.860 1.00 0.00 ATOM 26720 OH2 SOL 3702 28.660 41.230 1.210 1.00 0.00 ATOM 26721 H1 SOL 3702 29.570 41.050 0.980 1.00 0.00 ATOM 26722 H2 SOL 3702 28.670 42.110 1.580 1.00 0.00 ATOM 26723 OH2 SOL 3703 28.250 40.420 20.940 1.00 0.00 ATOM 26724 H1 SOL 3703 27.860 41.180 20.510 1.00 0.00 ATOM 26725 H2 SOL 3703 28.880 40.080 20.300 1.00 0.00 ATOM 26726 OH2 SOL 3704 60.070 43.920 67.550 1.00 0.00 ATOM 26727 H1 SOL 3704 60.290 44.690 67.020 1.00 0.00 ATOM 26728 H2 SOL 3704 60.860 43.750 68.060 1.00 0.00 ATOM 26729 OH2 SOL 3705 36.130 26.990 77.470 1.00 0.00 ATOM 26730 H1 SOL 3705 36.420 27.630 76.820 1.00 0.00 ATOM 26731 H2 SOL 3705 36.530 26.170 77.210 1.00 0.00 ATOM 26732 OH2 SOL 3706 46.400 51.960 6.230 1.00 0.00 ATOM 26733 H1 SOL 3706 46.340 52.250 5.320 1.00 0.00 ATOM 26734 H2 SOL 3706 45.490 51.970 6.540 1.00 0.00 ATOM 26735 OH2 SOL 3707 29.680 1.340 8.870 1.00 0.00 ATOM 26736 H1 SOL 3707 28.960 1.210 9.480 1.00 0.00 ATOM 26737 H2 SOL 3707 30.470 1.130 9.370 1.00 0.00 ATOM 26738 OH2 SOL 3708 29.470 24.650 3.550 1.00 0.00 ATOM 26739 H1 SOL 3708 29.920 24.190 4.260 1.00 0.00 ATOM 26740 H2 SOL 3708 30.180 25.010 3.020 1.00 0.00 ATOM 26741 OH2 SOL 3709 17.170 22.930 72.180 1.00 0.00 ATOM 26742 H1 SOL 3709 17.830 23.050 72.860 1.00 0.00 ATOM 26743 H2 SOL 3709 16.340 23.050 72.630 1.00 0.00 ATOM 26744 OH2 SOL 3710 33.880 38.540 69.810 1.00 0.00 ATOM 26745 H1 SOL 3710 33.010 38.870 69.580 1.00 0.00 ATOM 26746 H2 SOL 3710 34.000 38.790 70.730 1.00 0.00 ATOM 26747 OH2 SOL 3711 0.990 13.500 7.700 1.00 0.00 ATOM 26748 H1 SOL 3711 1.780 14.040 7.780 1.00 0.00 ATOM 26749 H2 SOL 3711 0.410 13.810 8.390 1.00 0.00 ATOM 26750 OH2 SOL 3712 28.050 35.950 69.590 1.00 0.00 ATOM 26751 H1 SOL 3712 28.730 36.540 69.280 1.00 0.00 ATOM 26752 H2 SOL 3712 27.300 36.130 69.030 1.00 0.00 ATOM 26753 OH2 SOL 3713 31.750 15.660 62.420 1.00 0.00 ATOM 26754 H1 SOL 3713 31.220 14.970 62.830 1.00 0.00 ATOM 26755 H2 SOL 3713 32.650 15.350 62.500 1.00 0.00 ATOM 26756 OH2 SOL 3714 45.680 48.950 20.790 1.00 0.00 ATOM 26757 H1 SOL 3714 46.000 48.370 21.480 1.00 0.00 ATOM 26758 H2 SOL 3714 46.320 48.870 20.080 1.00 0.00 ATOM 26759 OH2 SOL 3715 48.920 38.580 14.170 1.00 0.00 ATOM 26760 H1 SOL 3715 48.510 39.160 13.520 1.00 0.00 ATOM 26761 H2 SOL 3715 49.450 37.970 13.650 1.00 0.00 ATOM 26762 OH2 SOL 3716 49.980 15.320 17.510 1.00 0.00 ATOM 26763 H1 SOL 3716 49.810 16.170 17.090 1.00 0.00 ATOM 26764 H2 SOL 3716 49.920 15.500 18.440 1.00 0.00 ATOM 26765 OH2 SOL 3717 47.280 52.310 25.850 1.00 0.00 ATOM 26766 H1 SOL 3717 47.070 53.110 25.350 1.00 0.00 ATOM 26767 H2 SOL 3717 48.230 52.240 25.810 1.00 0.00 ATOM 26768 OH2 SOL 3718 58.060 29.650 72.420 1.00 0.00 ATOM 26769 H1 SOL 3718 57.520 29.540 73.200 1.00 0.00 ATOM 26770 H2 SOL 3718 58.370 28.770 72.210 1.00 0.00 ATOM 26771 OH2 SOL 3719 4.060 8.060 75.110 1.00 0.00 ATOM 26772 H1 SOL 3719 4.250 7.910 76.040 1.00 0.00 ATOM 26773 H2 SOL 3719 3.490 8.830 75.100 1.00 0.00 ATOM 26774 OH2 SOL 3720 1.370 54.000 18.310 1.00 0.00 ATOM 26775 H1 SOL 3720 1.760 54.830 18.020 1.00 0.00 ATOM 26776 H2 SOL 3720 2.120 53.430 18.460 1.00 0.00 ATOM 26777 OH2 SOL 3721 13.140 11.610 82.370 1.00 0.00 ATOM 26778 H1 SOL 3721 13.140 12.360 82.960 1.00 0.00 ATOM 26779 H2 SOL 3721 14.070 11.390 82.270 1.00 0.00 ATOM 26780 OH2 SOL 3722 53.880 28.090 82.060 1.00 0.00 ATOM 26781 H1 SOL 3722 53.750 27.140 82.080 1.00 0.00 ATOM 26782 H2 SOL 3722 52.990 28.450 82.140 1.00 0.00 ATOM 26783 OH2 SOL 3723 24.130 56.980 23.160 1.00 0.00 ATOM 26784 H1 SOL 3723 23.700 57.780 23.450 1.00 0.00 ATOM 26785 H2 SOL 3723 25.040 57.080 23.430 1.00 0.00 ATOM 26786 OH2 SOL 3724 23.490 6.410 77.620 1.00 0.00 ATOM 26787 H1 SOL 3724 23.900 7.270 77.530 1.00 0.00 ATOM 26788 H2 SOL 3724 23.300 6.330 78.550 1.00 0.00 ATOM 26789 OH2 SOL 3725 37.200 33.190 63.380 1.00 0.00 ATOM 26790 H1 SOL 3725 37.530 32.910 62.520 1.00 0.00 ATOM 26791 H2 SOL 3725 36.260 33.290 63.250 1.00 0.00 ATOM 26792 OH2 SOL 3726 22.590 7.330 2.810 1.00 0.00 ATOM 26793 H1 SOL 3726 22.680 7.480 3.750 1.00 0.00 ATOM 26794 H2 SOL 3726 22.060 6.540 2.740 1.00 0.00 ATOM 26795 OH2 SOL 3727 51.140 55.840 71.850 1.00 0.00 ATOM 26796 H1 SOL 3727 50.360 55.280 71.760 1.00 0.00 ATOM 26797 H2 SOL 3727 51.600 55.490 72.610 1.00 0.00 ATOM 26798 OH2 SOL 3728 21.400 47.400 83.330 1.00 0.00 ATOM 26799 H1 SOL 3728 21.710 46.600 82.900 1.00 0.00 ATOM 26800 H2 SOL 3728 22.130 48.020 83.230 1.00 0.00 ATOM 26801 OH2 SOL 3729 58.630 43.630 1.160 1.00 0.00 ATOM 26802 H1 SOL 3729 58.380 44.190 0.430 1.00 0.00 ATOM 26803 H2 SOL 3729 59.500 43.310 0.930 1.00 0.00 ATOM 26804 OH2 SOL 3730 31.930 30.480 81.550 1.00 0.00 ATOM 26805 H1 SOL 3730 32.340 31.330 81.390 1.00 0.00 ATOM 26806 H2 SOL 3730 32.490 29.850 81.110 1.00 0.00 ATOM 26807 OH2 SOL 3731 45.230 0.400 8.040 1.00 0.00 ATOM 26808 H1 SOL 3731 44.780 -0.260 7.520 1.00 0.00 ATOM 26809 H2 SOL 3731 45.280 0.030 8.920 1.00 0.00 ATOM 26810 OH2 SOL 3732 33.450 48.760 81.400 1.00 0.00 ATOM 26811 H1 SOL 3732 33.900 48.560 82.220 1.00 0.00 ATOM 26812 H2 SOL 3732 33.070 49.630 81.530 1.00 0.00 ATOM 26813 OH2 SOL 3733 23.050 23.510 18.240 1.00 0.00 ATOM 26814 H1 SOL 3733 23.430 22.800 18.760 1.00 0.00 ATOM 26815 H2 SOL 3733 23.460 24.300 18.580 1.00 0.00 ATOM 26816 OH2 SOL 3734 21.500 29.380 19.750 1.00 0.00 ATOM 26817 H1 SOL 3734 21.340 29.490 18.820 1.00 0.00 ATOM 26818 H2 SOL 3734 21.480 28.430 19.890 1.00 0.00 ATOM 26819 OH2 SOL 3735 55.310 16.470 79.640 1.00 0.00 ATOM 26820 H1 SOL 3735 56.060 16.790 80.150 1.00 0.00 ATOM 26821 H2 SOL 3735 55.450 15.530 79.570 1.00 0.00 ATOM 26822 OH2 SOL 3736 60.290 8.390 14.900 1.00 0.00 ATOM 26823 H1 SOL 3736 59.420 8.750 15.110 1.00 0.00 ATOM 26824 H2 SOL 3736 60.170 7.940 14.070 1.00 0.00 ATOM 26825 OH2 SOL 3737 18.950 25.520 6.870 1.00 0.00 ATOM 26826 H1 SOL 3737 19.670 26.140 7.010 1.00 0.00 ATOM 26827 H2 SOL 3737 18.170 25.990 7.180 1.00 0.00 ATOM 26828 OH2 SOL 3738 7.910 31.270 1.040 1.00 0.00 ATOM 26829 H1 SOL 3738 7.030 31.170 0.690 1.00 0.00 ATOM 26830 H2 SOL 3738 8.480 30.880 0.370 1.00 0.00 ATOM 26831 OH2 SOL 3739 29.470 54.160 69.710 1.00 0.00 ATOM 26832 H1 SOL 3739 30.370 53.910 69.510 1.00 0.00 ATOM 26833 H2 SOL 3739 29.540 54.750 70.450 1.00 0.00 ATOM 26834 OH2 SOL 3740 48.730 47.790 60.330 1.00 0.00 ATOM 26835 H1 SOL 3740 49.070 46.970 60.670 1.00 0.00 ATOM 26836 H2 SOL 3740 47.860 47.560 59.990 1.00 0.00 ATOM 26837 OH2 SOL 3741 31.650 34.830 74.790 1.00 0.00 ATOM 26838 H1 SOL 3741 31.650 34.090 74.180 1.00 0.00 ATOM 26839 H2 SOL 3741 31.050 34.560 75.490 1.00 0.00 ATOM 26840 OH2 SOL 3742 32.960 10.850 73.160 1.00 0.00 ATOM 26841 H1 SOL 3742 32.750 9.980 72.830 1.00 0.00 ATOM 26842 H2 SOL 3742 33.450 11.260 72.450 1.00 0.00 ATOM 26843 OH2 SOL 3743 32.840 43.880 83.680 1.00 0.00 ATOM 26844 H1 SOL 3743 33.620 44.120 83.170 1.00 0.00 ATOM 26845 H2 SOL 3743 32.350 43.300 83.100 1.00 0.00 ATOM 26846 OH2 SOL 3744 48.880 39.410 74.500 1.00 0.00 ATOM 26847 H1 SOL 3744 48.510 39.860 73.740 1.00 0.00 ATOM 26848 H2 SOL 3744 49.780 39.740 74.560 1.00 0.00 ATOM 26849 OH2 SOL 3745 22.030 14.100 77.010 1.00 0.00 ATOM 26850 H1 SOL 3745 22.210 15.040 76.870 1.00 0.00 ATOM 26851 H2 SOL 3745 22.300 13.940 77.910 1.00 0.00 ATOM 26852 OH2 SOL 3746 41.330 37.290 68.120 1.00 0.00 ATOM 26853 H1 SOL 3746 41.900 37.960 67.740 1.00 0.00 ATOM 26854 H2 SOL 3746 40.840 36.950 67.380 1.00 0.00 ATOM 26855 OH2 SOL 3747 0.840 38.580 75.920 1.00 0.00 ATOM 26856 H1 SOL 3747 0.810 37.880 75.260 1.00 0.00 ATOM 26857 H2 SOL 3747 0.040 38.460 76.440 1.00 0.00 ATOM 26858 OH2 SOL 3748 32.640 53.230 75.480 1.00 0.00 ATOM 26859 H1 SOL 3748 32.450 52.600 74.780 1.00 0.00 ATOM 26860 H2 SOL 3748 31.780 53.540 75.760 1.00 0.00 ATOM 26861 OH2 SOL 3749 47.050 28.090 77.940 1.00 0.00 ATOM 26862 H1 SOL 3749 47.980 28.110 77.710 1.00 0.00 ATOM 26863 H2 SOL 3749 46.620 27.710 77.170 1.00 0.00 ATOM 26864 OH2 SOL 3750 13.080 57.390 11.120 1.00 0.00 ATOM 26865 H1 SOL 3750 13.450 56.730 10.540 1.00 0.00 ATOM 26866 H2 SOL 3750 12.800 56.900 11.890 1.00 0.00 ATOM 26867 OH2 SOL 3751 18.910 52.010 2.650 1.00 0.00 ATOM 26868 H1 SOL 3751 18.420 51.640 1.920 1.00 0.00 ATOM 26869 H2 SOL 3751 18.270 52.550 3.120 1.00 0.00 ATOM 26870 OH2 SOL 3752 56.230 33.440 82.970 1.00 0.00 ATOM 26871 H1 SOL 3752 57.180 33.320 82.980 1.00 0.00 ATOM 26872 H2 SOL 3752 55.880 32.610 83.310 1.00 0.00 ATOM 26873 OH2 SOL 3753 20.220 6.270 76.760 1.00 0.00 ATOM 26874 H1 SOL 3753 19.570 5.570 76.760 1.00 0.00 ATOM 26875 H2 SOL 3753 20.250 6.570 75.850 1.00 0.00 ATOM 26876 OH2 SOL 3754 7.930 32.650 14.050 1.00 0.00 ATOM 26877 H1 SOL 3754 7.550 31.770 14.020 1.00 0.00 ATOM 26878 H2 SOL 3754 7.650 33.050 13.230 1.00 0.00 ATOM 26879 OH2 SOL 3755 31.160 13.760 76.180 1.00 0.00 ATOM 26880 H1 SOL 3755 31.970 14.280 76.190 1.00 0.00 ATOM 26881 H2 SOL 3755 31.100 13.400 77.070 1.00 0.00 ATOM 26882 OH2 SOL 3756 24.720 21.150 18.420 1.00 0.00 ATOM 26883 H1 SOL 3756 24.050 20.740 17.880 1.00 0.00 ATOM 26884 H2 SOL 3756 25.330 21.530 17.790 1.00 0.00 ATOM 26885 OH2 SOL 3757 54.630 3.740 69.990 1.00 0.00 ATOM 26886 H1 SOL 3757 54.510 3.060 69.330 1.00 0.00 ATOM 26887 H2 SOL 3757 54.150 3.420 70.760 1.00 0.00 ATOM 26888 OH2 SOL 3758 37.740 24.160 5.910 1.00 0.00 ATOM 26889 H1 SOL 3758 38.500 23.800 5.460 1.00 0.00 ATOM 26890 H2 SOL 3758 37.880 23.930 6.830 1.00 0.00 ATOM 26891 OH2 SOL 3759 44.500 23.970 61.180 1.00 0.00 ATOM 26892 H1 SOL 3759 44.230 24.790 61.590 1.00 0.00 ATOM 26893 H2 SOL 3759 45.450 23.940 61.310 1.00 0.00 ATOM 26894 OH2 SOL 3760 51.280 52.990 80.470 1.00 0.00 ATOM 26895 H1 SOL 3760 51.260 53.840 80.030 1.00 0.00 ATOM 26896 H2 SOL 3760 51.690 53.170 81.320 1.00 0.00 ATOM 26897 OH2 SOL 3761 20.570 26.710 77.690 1.00 0.00 ATOM 26898 H1 SOL 3761 19.790 26.180 77.550 1.00 0.00 ATOM 26899 H2 SOL 3761 21.020 26.700 76.850 1.00 0.00 ATOM 26900 OH2 SOL 3762 17.000 29.410 70.350 1.00 0.00 ATOM 26901 H1 SOL 3762 16.710 28.610 69.900 1.00 0.00 ATOM 26902 H2 SOL 3762 16.450 29.460 71.130 1.00 0.00 ATOM 26903 OH2 SOL 3763 39.310 16.320 24.280 1.00 0.00 ATOM 26904 H1 SOL 3763 39.850 16.600 23.540 1.00 0.00 ATOM 26905 H2 SOL 3763 39.090 17.130 24.740 1.00 0.00 ATOM 26906 OH2 SOL 3764 52.750 28.150 18.220 1.00 0.00 ATOM 26907 H1 SOL 3764 53.200 27.970 19.040 1.00 0.00 ATOM 26908 H2 SOL 3764 51.970 27.600 18.240 1.00 0.00 ATOM 26909 OH2 SOL 3765 12.280 46.160 71.120 1.00 0.00 ATOM 26910 H1 SOL 3765 12.260 46.730 70.350 1.00 0.00 ATOM 26911 H2 SOL 3765 12.360 46.760 71.860 1.00 0.00 ATOM 26912 OH2 SOL 3766 51.970 40.070 12.050 1.00 0.00 ATOM 26913 H1 SOL 3766 51.260 40.690 12.200 1.00 0.00 ATOM 26914 H2 SOL 3766 52.500 40.480 11.360 1.00 0.00 ATOM 26915 OH2 SOL 3767 52.810 21.970 16.910 1.00 0.00 ATOM 26916 H1 SOL 3767 53.490 21.510 17.400 1.00 0.00 ATOM 26917 H2 SOL 3767 52.840 22.870 17.250 1.00 0.00 ATOM 26918 OH2 SOL 3768 47.670 5.110 9.340 1.00 0.00 ATOM 26919 H1 SOL 3768 47.440 4.430 8.700 1.00 0.00 ATOM 26920 H2 SOL 3768 48.600 5.000 9.500 1.00 0.00 ATOM 26921 OH2 SOL 3769 61.000 24.060 66.140 1.00 0.00 ATOM 26922 H1 SOL 3769 60.470 23.690 66.840 1.00 0.00 ATOM 26923 H2 SOL 3769 61.660 24.600 66.580 1.00 0.00 ATOM 26924 OH2 SOL 3770 9.130 47.950 9.450 1.00 0.00 ATOM 26925 H1 SOL 3770 9.880 47.860 10.030 1.00 0.00 ATOM 26926 H2 SOL 3770 8.470 47.370 9.820 1.00 0.00 ATOM 26927 OH2 SOL 3771 44.450 50.590 22.550 1.00 0.00 ATOM 26928 H1 SOL 3771 45.080 50.040 22.080 1.00 0.00 ATOM 26929 H2 SOL 3771 43.870 50.920 21.870 1.00 0.00 ATOM 26930 OH2 SOL 3772 31.720 49.110 11.920 1.00 0.00 ATOM 26931 H1 SOL 3772 31.830 49.880 11.380 1.00 0.00 ATOM 26932 H2 SOL 3772 31.980 49.390 12.800 1.00 0.00 ATOM 26933 OH2 SOL 3773 46.390 35.980 72.410 1.00 0.00 ATOM 26934 H1 SOL 3773 47.030 36.080 73.120 1.00 0.00 ATOM 26935 H2 SOL 3773 45.680 35.470 72.800 1.00 0.00 ATOM 26936 OH2 SOL 3774 7.210 15.790 6.510 1.00 0.00 ATOM 26937 H1 SOL 3774 7.260 15.170 5.780 1.00 0.00 ATOM 26938 H2 SOL 3774 8.120 15.900 6.780 1.00 0.00 ATOM 26939 OH2 SOL 3775 22.920 26.640 70.450 1.00 0.00 ATOM 26940 H1 SOL 3775 23.250 27.060 69.650 1.00 0.00 ATOM 26941 H2 SOL 3775 22.860 27.340 71.090 1.00 0.00 ATOM 26942 OH2 SOL 3776 31.420 2.800 2.000 1.00 0.00 ATOM 26943 H1 SOL 3776 30.680 2.310 1.640 1.00 0.00 ATOM 26944 H2 SOL 3776 31.090 3.700 2.080 1.00 0.00 ATOM 26945 OH2 SOL 3777 58.630 27.540 76.290 1.00 0.00 ATOM 26946 H1 SOL 3777 58.450 27.130 75.440 1.00 0.00 ATOM 26947 H2 SOL 3777 59.130 26.880 76.770 1.00 0.00 ATOM 26948 OH2 SOL 3778 5.430 53.440 73.970 1.00 0.00 ATOM 26949 H1 SOL 3778 5.080 52.570 74.170 1.00 0.00 ATOM 26950 H2 SOL 3778 5.750 53.760 74.820 1.00 0.00 ATOM 26951 OH2 SOL 3779 4.310 46.120 83.210 1.00 0.00 ATOM 26952 H1 SOL 3779 4.230 45.950 84.150 1.00 0.00 ATOM 26953 H2 SOL 3779 4.230 47.070 83.120 1.00 0.00 ATOM 26954 OH2 SOL 3780 52.750 9.520 68.650 1.00 0.00 ATOM 26955 H1 SOL 3780 52.000 9.900 69.100 1.00 0.00 ATOM 26956 H2 SOL 3780 53.120 8.900 69.280 1.00 0.00 ATOM 26957 OH2 SOL 3781 60.280 42.080 83.120 1.00 0.00 ATOM 26958 H1 SOL 3781 60.280 43.040 83.070 1.00 0.00 ATOM 26959 H2 SOL 3781 59.380 41.830 82.920 1.00 0.00 ATOM 26960 OH2 SOL 3782 10.910 3.510 67.150 1.00 0.00 ATOM 26961 H1 SOL 3782 10.600 3.050 66.370 1.00 0.00 ATOM 26962 H2 SOL 3782 10.150 3.970 67.480 1.00 0.00 ATOM 26963 OH2 SOL 3783 35.640 43.130 66.400 1.00 0.00 ATOM 26964 H1 SOL 3783 36.300 43.370 67.050 1.00 0.00 ATOM 26965 H2 SOL 3783 35.590 42.180 66.450 1.00 0.00 ATOM 26966 OH2 SOL 3784 41.830 36.770 19.330 1.00 0.00 ATOM 26967 H1 SOL 3784 41.540 37.410 18.680 1.00 0.00 ATOM 26968 H2 SOL 3784 42.780 36.780 19.280 1.00 0.00 ATOM 26969 OH2 SOL 3785 16.980 11.400 2.930 1.00 0.00 ATOM 26970 H1 SOL 3785 16.670 12.040 2.290 1.00 0.00 ATOM 26971 H2 SOL 3785 17.500 11.920 3.550 1.00 0.00 ATOM 26972 OH2 SOL 3786 8.440 48.020 70.420 1.00 0.00 ATOM 26973 H1 SOL 3786 7.570 47.930 70.800 1.00 0.00 ATOM 26974 H2 SOL 3786 8.800 47.130 70.430 1.00 0.00 ATOM 26975 OH2 SOL 3787 11.940 36.010 78.590 1.00 0.00 ATOM 26976 H1 SOL 3787 12.730 36.440 78.930 1.00 0.00 ATOM 26977 H2 SOL 3787 11.950 36.220 77.660 1.00 0.00 ATOM 26978 OH2 SOL 3788 48.040 5.340 12.990 1.00 0.00 ATOM 26979 H1 SOL 3788 48.860 5.800 13.140 1.00 0.00 ATOM 26980 H2 SOL 3788 47.640 5.270 13.860 1.00 0.00 ATOM 26981 OH2 SOL 3789 7.670 40.170 0.600 1.00 0.00 ATOM 26982 H1 SOL 3789 7.020 40.860 0.510 1.00 0.00 ATOM 26983 H2 SOL 3789 7.160 39.380 0.760 1.00 0.00 ATOM 26984 OH2 SOL 3790 34.380 7.280 1.610 1.00 0.00 ATOM 26985 H1 SOL 3790 34.900 7.930 2.100 1.00 0.00 ATOM 26986 H2 SOL 3790 35.000 6.580 1.420 1.00 0.00 ATOM 26987 OH2 SOL 3791 34.190 42.170 6.090 1.00 0.00 ATOM 26988 H1 SOL 3791 33.630 42.780 5.590 1.00 0.00 ATOM 26989 H2 SOL 3791 33.600 41.780 6.730 1.00 0.00 ATOM 26990 OH2 SOL 3792 18.820 14.570 72.910 1.00 0.00 ATOM 26991 H1 SOL 3792 17.970 14.880 73.210 1.00 0.00 ATOM 26992 H2 SOL 3792 18.700 13.640 72.750 1.00 0.00 ATOM 26993 OH2 SOL 3793 10.760 12.320 2.200 1.00 0.00 ATOM 26994 H1 SOL 3793 11.540 12.080 2.700 1.00 0.00 ATOM 26995 H2 SOL 3793 10.030 11.920 2.670 1.00 0.00 ATOM 26996 OH2 SOL 3794 36.310 6.390 77.210 1.00 0.00 ATOM 26997 H1 SOL 3794 35.540 5.830 77.260 1.00 0.00 ATOM 26998 H2 SOL 3794 35.990 7.260 77.460 1.00 0.00 ATOM 26999 OH2 SOL 3795 61.200 15.250 12.340 1.00 0.00 ATOM 27000 H1 SOL 3795 62.100 15.180 12.030 1.00 0.00 ATOM 27001 H2 SOL 3795 60.840 15.990 11.850 1.00 0.00 ATOM 27002 OH2 SOL 3796 44.430 53.650 16.560 1.00 0.00 ATOM 27003 H1 SOL 3796 45.080 54.070 16.000 1.00 0.00 ATOM 27004 H2 SOL 3796 44.020 52.990 16.010 1.00 0.00 ATOM 27005 OH2 SOL 3797 43.930 22.420 8.500 1.00 0.00 ATOM 27006 H1 SOL 3797 43.250 21.970 9.010 1.00 0.00 ATOM 27007 H2 SOL 3797 44.520 21.720 8.210 1.00 0.00 ATOM 27008 OH2 SOL 3798 17.290 15.540 13.230 1.00 0.00 ATOM 27009 H1 SOL 3798 17.390 15.940 12.360 1.00 0.00 ATOM 27010 H2 SOL 3798 17.490 14.610 13.090 1.00 0.00 ATOM 27011 OH2 SOL 3799 36.290 28.370 27.740 1.00 0.00 ATOM 27012 H1 SOL 3799 36.090 29.140 27.210 1.00 0.00 ATOM 27013 H2 SOL 3799 35.440 28.070 28.060 1.00 0.00 ATOM 27014 OH2 SOL 3800 41.450 21.300 9.310 1.00 0.00 ATOM 27015 H1 SOL 3800 40.820 22.010 9.460 1.00 0.00 ATOM 27016 H2 SOL 3800 41.010 20.710 8.700 1.00 0.00 ATOM 27017 OH2 SOL 3801 30.090 3.910 67.690 1.00 0.00 ATOM 27018 H1 SOL 3801 30.920 3.440 67.770 1.00 0.00 ATOM 27019 H2 SOL 3801 29.540 3.550 68.380 1.00 0.00 ATOM 27020 OH2 SOL 3802 42.830 12.280 74.950 1.00 0.00 ATOM 27021 H1 SOL 3802 43.400 13.030 75.090 1.00 0.00 ATOM 27022 H2 SOL 3802 41.960 12.660 74.850 1.00 0.00 ATOM 27023 OH2 SOL 3803 17.140 -0.120 79.190 1.00 0.00 ATOM 27024 H1 SOL 3803 16.670 0.270 78.460 1.00 0.00 ATOM 27025 H2 SOL 3803 16.920 0.430 79.940 1.00 0.00 ATOM 27026 OH2 SOL 3804 14.300 5.550 77.850 1.00 0.00 ATOM 27027 H1 SOL 3804 14.220 6.270 78.470 1.00 0.00 ATOM 27028 H2 SOL 3804 14.900 4.930 78.270 1.00 0.00 ATOM 27029 OH2 SOL 3805 50.010 12.960 82.110 1.00 0.00 ATOM 27030 H1 SOL 3805 49.210 12.500 82.350 1.00 0.00 ATOM 27031 H2 SOL 3805 49.910 13.140 81.180 1.00 0.00 ATOM 27032 OH2 SOL 3806 46.900 20.450 1.220 1.00 0.00 ATOM 27033 H1 SOL 3806 46.800 21.020 1.980 1.00 0.00 ATOM 27034 H2 SOL 3806 47.230 19.630 1.570 1.00 0.00 ATOM 27035 OH2 SOL 3807 11.810 33.400 77.800 1.00 0.00 ATOM 27036 H1 SOL 3807 11.650 34.190 78.320 1.00 0.00 ATOM 27037 H2 SOL 3807 10.940 33.150 77.480 1.00 0.00 ATOM 27038 OH2 SOL 3808 20.080 33.920 69.140 1.00 0.00 ATOM 27039 H1 SOL 3808 20.250 32.980 69.150 1.00 0.00 ATOM 27040 H2 SOL 3808 20.790 34.300 69.660 1.00 0.00 ATOM 27041 OH2 SOL 3809 53.990 38.170 0.790 1.00 0.00 ATOM 27042 H1 SOL 3809 54.490 38.870 1.200 1.00 0.00 ATOM 27043 H2 SOL 3809 54.600 37.430 0.730 1.00 0.00 ATOM 27044 OH2 SOL 3810 21.850 46.130 62.530 1.00 0.00 ATOM 27045 H1 SOL 3810 21.400 46.920 62.830 1.00 0.00 ATOM 27046 H2 SOL 3810 22.060 45.660 63.340 1.00 0.00 ATOM 27047 OH2 SOL 3811 46.450 46.810 8.720 1.00 0.00 ATOM 27048 H1 SOL 3811 46.070 47.100 9.550 1.00 0.00 ATOM 27049 H2 SOL 3811 47.100 46.160 8.970 1.00 0.00 ATOM 27050 OH2 SOL 3812 37.720 6.610 16.900 1.00 0.00 ATOM 27051 H1 SOL 3812 37.770 7.440 17.370 1.00 0.00 ATOM 27052 H2 SOL 3812 36.840 6.600 16.520 1.00 0.00 ATOM 27053 OH2 SOL 3813 20.840 40.740 66.390 1.00 0.00 ATOM 27054 H1 SOL 3813 21.240 40.990 65.550 1.00 0.00 ATOM 27055 H2 SOL 3813 20.050 41.270 66.440 1.00 0.00 ATOM 27056 OH2 SOL 3814 1.070 56.460 79.750 1.00 0.00 ATOM 27057 H1 SOL 3814 1.390 57.150 80.330 1.00 0.00 ATOM 27058 H2 SOL 3814 0.200 56.250 80.080 1.00 0.00 ATOM 27059 OH2 SOL 3815 38.020 3.800 14.680 1.00 0.00 ATOM 27060 H1 SOL 3815 37.900 3.320 13.860 1.00 0.00 ATOM 27061 H2 SOL 3815 37.170 4.230 14.840 1.00 0.00 ATOM 27062 OH2 SOL 3816 41.590 57.350 18.140 1.00 0.00 ATOM 27063 H1 SOL 3816 42.460 57.640 18.400 1.00 0.00 ATOM 27064 H2 SOL 3816 41.240 56.890 18.900 1.00 0.00 ATOM 27065 OH2 SOL 3817 60.580 41.950 10.110 1.00 0.00 ATOM 27066 H1 SOL 3817 60.680 41.300 9.410 1.00 0.00 ATOM 27067 H2 SOL 3817 59.710 41.780 10.470 1.00 0.00 ATOM 27068 OH2 SOL 3818 7.080 46.260 18.660 1.00 0.00 ATOM 27069 H1 SOL 3818 7.410 45.510 19.150 1.00 0.00 ATOM 27070 H2 SOL 3818 6.610 46.780 19.310 1.00 0.00 ATOM 27071 OH2 SOL 3819 21.610 58.140 77.960 1.00 0.00 ATOM 27072 H1 SOL 3819 21.480 58.960 77.480 1.00 0.00 ATOM 27073 H2 SOL 3819 20.830 58.060 78.500 1.00 0.00 ATOM 27074 OH2 SOL 3820 33.380 54.440 10.240 1.00 0.00 ATOM 27075 H1 SOL 3820 33.920 55.140 9.860 1.00 0.00 ATOM 27076 H2 SOL 3820 32.600 54.430 9.680 1.00 0.00 ATOM 27077 OH2 SOL 3821 13.820 32.100 8.520 1.00 0.00 ATOM 27078 H1 SOL 3821 13.980 31.170 8.390 1.00 0.00 ATOM 27079 H2 SOL 3821 13.350 32.370 7.730 1.00 0.00 ATOM 27080 OH2 SOL 3822 30.200 21.270 20.190 1.00 0.00 ATOM 27081 H1 SOL 3822 30.280 20.410 19.780 1.00 0.00 ATOM 27082 H2 SOL 3822 29.960 21.090 21.090 1.00 0.00 ATOM 27083 OH2 SOL 3823 26.820 56.230 6.360 1.00 0.00 ATOM 27084 H1 SOL 3823 27.440 56.930 6.550 1.00 0.00 ATOM 27085 H2 SOL 3823 27.370 55.450 6.250 1.00 0.00 ATOM 27086 OH2 SOL 3824 2.110 58.480 14.090 1.00 0.00 ATOM 27087 H1 SOL 3824 1.840 58.640 13.190 1.00 0.00 ATOM 27088 H2 SOL 3824 1.330 58.120 14.510 1.00 0.00 ATOM 27089 OH2 SOL 3825 51.740 19.970 83.190 1.00 0.00 ATOM 27090 H1 SOL 3825 52.520 19.620 82.750 1.00 0.00 ATOM 27091 H2 SOL 3825 51.570 19.360 83.900 1.00 0.00 ATOM 27092 OH2 SOL 3826 19.750 25.100 14.770 1.00 0.00 ATOM 27093 H1 SOL 3826 20.630 24.760 14.630 1.00 0.00 ATOM 27094 H2 SOL 3826 19.500 25.490 13.930 1.00 0.00 ATOM 27095 OH2 SOL 3827 47.020 40.340 3.940 1.00 0.00 ATOM 27096 H1 SOL 3827 47.170 39.900 3.100 1.00 0.00 ATOM 27097 H2 SOL 3827 47.890 40.390 4.340 1.00 0.00 ATOM 27098 OH2 SOL 3828 0.720 34.500 76.600 1.00 0.00 ATOM 27099 H1 SOL 3828 1.090 35.280 77.030 1.00 0.00 ATOM 27100 H2 SOL 3828 -0.230 34.620 76.650 1.00 0.00 ATOM 27101 OH2 SOL 3829 27.550 15.870 15.730 1.00 0.00 ATOM 27102 H1 SOL 3829 27.180 16.700 15.420 1.00 0.00 ATOM 27103 H2 SOL 3829 26.910 15.530 16.340 1.00 0.00 ATOM 27104 OH2 SOL 3830 1.560 53.300 1.590 1.00 0.00 ATOM 27105 H1 SOL 3830 0.760 52.980 2.010 1.00 0.00 ATOM 27106 H2 SOL 3830 1.290 53.560 0.720 1.00 0.00 ATOM 27107 OH2 SOL 3831 39.270 33.420 25.020 1.00 0.00 ATOM 27108 H1 SOL 3831 39.030 32.530 25.310 1.00 0.00 ATOM 27109 H2 SOL 3831 39.360 33.340 24.070 1.00 0.00 ATOM 27110 OH2 SOL 3832 23.030 17.740 15.770 1.00 0.00 ATOM 27111 H1 SOL 3832 22.820 17.070 16.410 1.00 0.00 ATOM 27112 H2 SOL 3832 22.250 18.290 15.720 1.00 0.00 ATOM 27113 OH2 SOL 3833 20.650 45.680 69.900 1.00 0.00 ATOM 27114 H1 SOL 3833 20.130 45.220 70.550 1.00 0.00 ATOM 27115 H2 SOL 3833 20.760 45.060 69.180 1.00 0.00 ATOM 27116 OH2 SOL 3834 50.160 7.150 19.290 1.00 0.00 ATOM 27117 H1 SOL 3834 49.600 7.660 18.700 1.00 0.00 ATOM 27118 H2 SOL 3834 49.650 7.080 20.100 1.00 0.00 ATOM 27119 OH2 SOL 3835 35.120 4.000 15.310 1.00 0.00 ATOM 27120 H1 SOL 3835 35.190 3.050 15.380 1.00 0.00 ATOM 27121 H2 SOL 3835 34.860 4.290 16.180 1.00 0.00 ATOM 27122 OH2 SOL 3836 56.350 20.540 23.020 1.00 0.00 ATOM 27123 H1 SOL 3836 57.180 20.640 22.560 1.00 0.00 ATOM 27124 H2 SOL 3836 56.230 21.370 23.490 1.00 0.00 ATOM 27125 OH2 SOL 3837 0.880 0.630 73.070 1.00 0.00 ATOM 27126 H1 SOL 3837 0.950 1.280 72.370 1.00 0.00 ATOM 27127 H2 SOL 3837 1.570 0.860 73.680 1.00 0.00 ATOM 27128 OH2 SOL 3838 31.050 19.680 78.240 1.00 0.00 ATOM 27129 H1 SOL 3838 30.800 19.540 77.320 1.00 0.00 ATOM 27130 H2 SOL 3838 31.340 18.820 78.540 1.00 0.00 ATOM 27131 OH2 SOL 3839 42.480 23.700 65.280 1.00 0.00 ATOM 27132 H1 SOL 3839 42.020 24.430 64.870 1.00 0.00 ATOM 27133 H2 SOL 3839 42.150 23.690 66.180 1.00 0.00 ATOM 27134 OH2 SOL 3840 28.260 50.890 20.100 1.00 0.00 ATOM 27135 H1 SOL 3840 29.060 50.460 19.810 1.00 0.00 ATOM 27136 H2 SOL 3840 28.200 50.680 21.030 1.00 0.00 ATOM 27137 OH2 SOL 3841 9.620 8.440 61.790 1.00 0.00 ATOM 27138 H1 SOL 3841 10.220 7.800 62.160 1.00 0.00 ATOM 27139 H2 SOL 3841 9.480 8.150 60.890 1.00 0.00 ATOM 27140 OH2 SOL 3842 47.790 57.210 14.150 1.00 0.00 ATOM 27141 H1 SOL 3842 47.520 56.330 13.900 1.00 0.00 ATOM 27142 H2 SOL 3842 48.680 57.100 14.510 1.00 0.00 ATOM 27143 OH2 SOL 3843 46.890 35.340 23.410 1.00 0.00 ATOM 27144 H1 SOL 3843 47.800 35.330 23.700 1.00 0.00 ATOM 27145 H2 SOL 3843 46.480 36.020 23.950 1.00 0.00 ATOM 27146 OH2 SOL 3844 41.590 29.930 66.720 1.00 0.00 ATOM 27147 H1 SOL 3844 41.040 29.390 66.150 1.00 0.00 ATOM 27148 H2 SOL 3844 42.480 29.670 66.520 1.00 0.00 ATOM 27149 OH2 SOL 3845 54.680 39.850 82.540 1.00 0.00 ATOM 27150 H1 SOL 3845 55.260 39.130 82.270 1.00 0.00 ATOM 27151 H2 SOL 3845 53.800 39.560 82.300 1.00 0.00 ATOM 27152 OH2 SOL 3846 34.640 34.730 18.530 1.00 0.00 ATOM 27153 H1 SOL 3846 33.840 34.200 18.500 1.00 0.00 ATOM 27154 H2 SOL 3846 35.120 34.480 17.740 1.00 0.00 ATOM 27155 OH2 SOL 3847 38.770 30.360 21.890 1.00 0.00 ATOM 27156 H1 SOL 3847 37.940 29.980 22.170 1.00 0.00 ATOM 27157 H2 SOL 3847 39.370 29.610 21.860 1.00 0.00 ATOM 27158 OH2 SOL 3848 13.720 16.510 9.690 1.00 0.00 ATOM 27159 H1 SOL 3848 14.030 17.340 10.050 1.00 0.00 ATOM 27160 H2 SOL 3848 13.870 15.870 10.380 1.00 0.00 ATOM 27161 OH2 SOL 3849 17.680 46.470 5.310 1.00 0.00 ATOM 27162 H1 SOL 3849 17.670 45.960 6.120 1.00 0.00 ATOM 27163 H2 SOL 3849 18.390 46.090 4.800 1.00 0.00 ATOM 27164 OH2 SOL 3850 11.180 43.230 16.470 1.00 0.00 ATOM 27165 H1 SOL 3850 11.450 42.340 16.700 1.00 0.00 ATOM 27166 H2 SOL 3850 11.770 43.790 16.970 1.00 0.00 ATOM 27167 OH2 SOL 3851 53.690 57.820 67.030 1.00 0.00 ATOM 27168 H1 SOL 3851 53.800 57.520 67.930 1.00 0.00 ATOM 27169 H2 SOL 3851 54.580 58.000 66.730 1.00 0.00 ATOM 27170 OH2 SOL 3852 32.080 29.780 14.920 1.00 0.00 ATOM 27171 H1 SOL 3852 32.620 29.090 15.310 1.00 0.00 ATOM 27172 H2 SOL 3852 32.230 29.700 13.980 1.00 0.00 ATOM 27173 OH2 SOL 3853 25.520 29.780 2.140 1.00 0.00 ATOM 27174 H1 SOL 3853 25.220 28.980 1.700 1.00 0.00 ATOM 27175 H2 SOL 3853 25.670 30.410 1.440 1.00 0.00 ATOM 27176 OH2 SOL 3854 34.090 44.380 81.310 1.00 0.00 ATOM 27177 H1 SOL 3854 35.040 44.500 81.290 1.00 0.00 ATOM 27178 H2 SOL 3854 33.860 44.150 80.400 1.00 0.00 ATOM 27179 OH2 SOL 3855 17.820 5.970 9.250 1.00 0.00 ATOM 27180 H1 SOL 3855 17.210 6.690 9.380 1.00 0.00 ATOM 27181 H2 SOL 3855 18.220 6.140 8.390 1.00 0.00 ATOM 27182 OH2 SOL 3856 15.250 29.620 72.530 1.00 0.00 ATOM 27183 H1 SOL 3856 14.500 29.100 72.810 1.00 0.00 ATOM 27184 H2 SOL 3856 15.480 30.140 73.300 1.00 0.00 ATOM 27185 OH2 SOL 3857 9.880 9.950 18.090 1.00 0.00 ATOM 27186 H1 SOL 3857 10.300 9.560 18.860 1.00 0.00 ATOM 27187 H2 SOL 3857 9.130 10.420 18.450 1.00 0.00 ATOM 27188 OH2 SOL 3858 30.220 37.730 74.740 1.00 0.00 ATOM 27189 H1 SOL 3858 30.310 36.890 74.280 1.00 0.00 ATOM 27190 H2 SOL 3858 29.280 37.780 74.950 1.00 0.00 ATOM 27191 OH2 SOL 3859 56.570 33.200 73.130 1.00 0.00 ATOM 27192 H1 SOL 3859 56.140 33.100 72.280 1.00 0.00 ATOM 27193 H2 SOL 3859 57.220 33.890 73.000 1.00 0.00 ATOM 27194 OH2 SOL 3860 59.180 34.820 82.460 1.00 0.00 ATOM 27195 H1 SOL 3860 59.050 35.740 82.240 1.00 0.00 ATOM 27196 H2 SOL 3860 58.850 34.740 83.350 1.00 0.00 ATOM 27197 OH2 SOL 3861 25.720 20.010 82.250 1.00 0.00 ATOM 27198 H1 SOL 3861 26.010 19.130 82.490 1.00 0.00 ATOM 27199 H2 SOL 3861 25.040 20.220 82.890 1.00 0.00 ATOM 27200 OH2 SOL 3862 43.820 41.440 67.990 1.00 0.00 ATOM 27201 H1 SOL 3862 43.740 40.630 67.500 1.00 0.00 ATOM 27202 H2 SOL 3862 44.690 41.770 67.780 1.00 0.00 ATOM 27203 OH2 SOL 3863 20.850 24.000 3.890 1.00 0.00 ATOM 27204 H1 SOL 3863 21.520 24.110 4.570 1.00 0.00 ATOM 27205 H2 SOL 3863 20.350 24.820 3.920 1.00 0.00 ATOM 27206 OH2 SOL 3864 21.410 24.610 20.660 1.00 0.00 ATOM 27207 H1 SOL 3864 21.720 25.510 20.770 1.00 0.00 ATOM 27208 H2 SOL 3864 22.210 24.080 20.720 1.00 0.00 ATOM 27209 OH2 SOL 3865 17.520 51.540 81.360 1.00 0.00 ATOM 27210 H1 SOL 3865 17.420 51.880 82.250 1.00 0.00 ATOM 27211 H2 SOL 3865 18.420 51.230 81.310 1.00 0.00 ATOM 27212 OH2 SOL 3866 25.930 55.410 17.520 1.00 0.00 ATOM 27213 H1 SOL 3866 26.840 55.700 17.480 1.00 0.00 ATOM 27214 H2 SOL 3866 25.460 55.980 16.920 1.00 0.00 ATOM 27215 OH2 SOL 3867 18.620 10.270 11.670 1.00 0.00 ATOM 27216 H1 SOL 3867 18.980 10.250 12.560 1.00 0.00 ATOM 27217 H2 SOL 3867 17.680 10.430 11.800 1.00 0.00 ATOM 27218 OH2 SOL 3868 5.860 41.900 83.960 1.00 0.00 ATOM 27219 H1 SOL 3868 5.120 41.880 83.340 1.00 0.00 ATOM 27220 H2 SOL 3868 6.470 42.530 83.570 1.00 0.00 ATOM 27221 OH2 SOL 3869 38.610 0.740 8.480 1.00 0.00 ATOM 27222 H1 SOL 3869 37.670 0.810 8.670 1.00 0.00 ATOM 27223 H2 SOL 3869 38.660 0.280 7.650 1.00 0.00 ATOM 27224 OH2 SOL 3870 44.590 19.830 16.620 1.00 0.00 ATOM 27225 H1 SOL 3870 45.480 19.740 16.280 1.00 0.00 ATOM 27226 H2 SOL 3870 44.150 19.020 16.350 1.00 0.00 ATOM 27227 OH2 SOL 3871 38.770 1.770 4.620 1.00 0.00 ATOM 27228 H1 SOL 3871 38.550 1.540 3.720 1.00 0.00 ATOM 27229 H2 SOL 3871 38.510 1.000 5.130 1.00 0.00 ATOM 27230 OH2 SOL 3872 46.280 49.780 16.390 1.00 0.00 ATOM 27231 H1 SOL 3872 45.400 50.090 16.570 1.00 0.00 ATOM 27232 H2 SOL 3872 46.180 49.200 15.630 1.00 0.00 ATOM 27233 OH2 SOL 3873 60.660 42.720 5.950 1.00 0.00 ATOM 27234 H1 SOL 3873 60.020 43.040 6.590 1.00 0.00 ATOM 27235 H2 SOL 3873 61.510 42.970 6.310 1.00 0.00 ATOM 27236 OH2 SOL 3874 25.440 29.440 81.330 1.00 0.00 ATOM 27237 H1 SOL 3874 24.660 29.680 80.830 1.00 0.00 ATOM 27238 H2 SOL 3874 25.960 28.900 80.730 1.00 0.00 ATOM 27239 OH2 SOL 3875 52.560 2.150 71.850 1.00 0.00 ATOM 27240 H1 SOL 3875 52.890 1.670 72.610 1.00 0.00 ATOM 27241 H2 SOL 3875 52.230 1.470 71.260 1.00 0.00 ATOM 27242 OH2 SOL 3876 18.190 4.610 20.050 1.00 0.00 ATOM 27243 H1 SOL 3876 18.990 5.140 20.120 1.00 0.00 ATOM 27244 H2 SOL 3876 17.620 5.110 19.460 1.00 0.00 ATOM 27245 OH2 SOL 3877 40.650 25.690 23.530 1.00 0.00 ATOM 27246 H1 SOL 3877 40.250 24.870 23.260 1.00 0.00 ATOM 27247 H2 SOL 3877 40.180 25.930 24.340 1.00 0.00 ATOM 27248 OH2 SOL 3878 38.770 39.080 18.250 1.00 0.00 ATOM 27249 H1 SOL 3878 38.090 39.620 18.640 1.00 0.00 ATOM 27250 H2 SOL 3878 39.590 39.410 18.610 1.00 0.00 ATOM 27251 OH2 SOL 3879 54.100 48.410 70.700 1.00 0.00 ATOM 27252 H1 SOL 3879 54.650 49.130 70.990 1.00 0.00 ATOM 27253 H2 SOL 3879 53.880 48.620 69.790 1.00 0.00 ATOM 27254 OH2 SOL 3880 46.520 4.490 18.110 1.00 0.00 ATOM 27255 H1 SOL 3880 45.640 4.830 17.950 1.00 0.00 ATOM 27256 H2 SOL 3880 46.670 4.630 19.040 1.00 0.00 ATOM 27257 OH2 SOL 3881 59.820 40.690 78.300 1.00 0.00 ATOM 27258 H1 SOL 3881 60.630 41.190 78.180 1.00 0.00 ATOM 27259 H2 SOL 3881 59.190 41.110 77.720 1.00 0.00 ATOM 27260 OH2 SOL 3882 27.190 41.240 82.300 1.00 0.00 ATOM 27261 H1 SOL 3882 27.790 41.440 81.580 1.00 0.00 ATOM 27262 H2 SOL 3882 27.720 41.360 83.090 1.00 0.00 ATOM 27263 OH2 SOL 3883 47.820 4.730 5.400 1.00 0.00 ATOM 27264 H1 SOL 3883 47.100 4.970 5.980 1.00 0.00 ATOM 27265 H2 SOL 3883 47.580 3.870 5.050 1.00 0.00 ATOM 27266 OH2 SOL 3884 19.360 29.660 17.130 1.00 0.00 ATOM 27267 H1 SOL 3884 19.180 28.720 17.090 1.00 0.00 ATOM 27268 H2 SOL 3884 18.960 29.940 17.950 1.00 0.00 ATOM 27269 OH2 SOL 3885 33.620 20.440 77.020 1.00 0.00 ATOM 27270 H1 SOL 3885 34.090 21.240 77.270 1.00 0.00 ATOM 27271 H2 SOL 3885 32.880 20.400 77.620 1.00 0.00 ATOM 27272 OH2 SOL 3886 27.440 20.090 10.980 1.00 0.00 ATOM 27273 H1 SOL 3886 26.590 20.140 11.420 1.00 0.00 ATOM 27274 H2 SOL 3886 27.220 19.990 10.060 1.00 0.00 ATOM 27275 OH2 SOL 3887 50.630 4.670 9.670 1.00 0.00 ATOM 27276 H1 SOL 3887 50.680 4.990 8.770 1.00 0.00 ATOM 27277 H2 SOL 3887 50.560 5.470 10.200 1.00 0.00 ATOM 27278 OH2 SOL 3888 4.850 45.650 17.000 1.00 0.00 ATOM 27279 H1 SOL 3888 5.140 45.320 16.150 1.00 0.00 ATOM 27280 H2 SOL 3888 5.650 45.800 17.500 1.00 0.00 ATOM 27281 OH2 SOL 3889 17.330 8.400 74.960 1.00 0.00 ATOM 27282 H1 SOL 3889 16.880 8.680 75.760 1.00 0.00 ATOM 27283 H2 SOL 3889 17.430 9.210 74.450 1.00 0.00 ATOM 27284 OH2 SOL 3890 22.790 5.250 73.680 1.00 0.00 ATOM 27285 H1 SOL 3890 22.000 4.810 73.370 1.00 0.00 ATOM 27286 H2 SOL 3890 23.380 5.250 72.920 1.00 0.00 ATOM 27287 OH2 SOL 3891 13.800 35.930 21.560 1.00 0.00 ATOM 27288 H1 SOL 3891 13.160 35.490 20.990 1.00 0.00 ATOM 27289 H2 SOL 3891 14.430 35.250 21.780 1.00 0.00 ATOM 27290 OH2 SOL 3892 22.620 40.390 16.840 1.00 0.00 ATOM 27291 H1 SOL 3892 22.610 40.010 17.720 1.00 0.00 ATOM 27292 H2 SOL 3892 22.320 39.680 16.270 1.00 0.00 ATOM 27293 OH2 SOL 3893 34.780 47.670 3.910 1.00 0.00 ATOM 27294 H1 SOL 3893 34.840 46.930 4.510 1.00 0.00 ATOM 27295 H2 SOL 3893 35.590 47.650 3.410 1.00 0.00 ATOM 27296 OH2 SOL 3894 5.850 16.990 1.390 1.00 0.00 ATOM 27297 H1 SOL 3894 5.190 17.480 1.890 1.00 0.00 ATOM 27298 H2 SOL 3894 6.070 17.570 0.660 1.00 0.00 ATOM 27299 OH2 SOL 3895 2.730 4.510 2.260 1.00 0.00 ATOM 27300 H1 SOL 3895 2.320 5.360 2.460 1.00 0.00 ATOM 27301 H2 SOL 3895 3.560 4.530 2.730 1.00 0.00 ATOM 27302 OH2 SOL 3896 61.700 32.800 84.290 1.00 0.00 ATOM 27303 H1 SOL 3896 61.410 33.400 83.610 1.00 0.00 ATOM 27304 H2 SOL 3896 61.330 31.950 84.040 1.00 0.00 ATOM 27305 OH2 SOL 3897 9.110 37.930 3.230 1.00 0.00 ATOM 27306 H1 SOL 3897 9.270 37.950 4.180 1.00 0.00 ATOM 27307 H2 SOL 3897 9.110 37.000 3.010 1.00 0.00 ATOM 27308 OH2 SOL 3898 22.840 0.550 23.830 1.00 0.00 ATOM 27309 H1 SOL 3898 21.940 0.370 24.090 1.00 0.00 ATOM 27310 H2 SOL 3898 22.810 1.420 23.440 1.00 0.00 ATOM 27311 OH2 SOL 3899 21.320 36.250 6.860 1.00 0.00 ATOM 27312 H1 SOL 3899 20.440 35.920 6.670 1.00 0.00 ATOM 27313 H2 SOL 3899 21.350 37.110 6.450 1.00 0.00 ATOM 27314 OH2 SOL 3900 4.540 20.810 76.250 1.00 0.00 ATOM 27315 H1 SOL 3900 5.340 20.280 76.220 1.00 0.00 ATOM 27316 H2 SOL 3900 3.860 20.250 75.890 1.00 0.00 ATOM 27317 OH2 SOL 3901 46.130 0.800 71.200 1.00 0.00 ATOM 27318 H1 SOL 3901 45.550 1.540 71.360 1.00 0.00 ATOM 27319 H2 SOL 3901 46.180 0.340 72.040 1.00 0.00 ATOM 27320 OH2 SOL 3902 23.390 47.190 9.700 1.00 0.00 ATOM 27321 H1 SOL 3902 23.450 46.450 9.090 1.00 0.00 ATOM 27322 H2 SOL 3902 22.920 46.840 10.450 1.00 0.00 ATOM 27323 OH2 SOL 3903 35.690 43.350 74.030 1.00 0.00 ATOM 27324 H1 SOL 3903 35.730 42.390 74.130 1.00 0.00 ATOM 27325 H2 SOL 3903 36.390 43.560 73.420 1.00 0.00 ATOM 27326 OH2 SOL 3904 23.790 10.970 75.670 1.00 0.00 ATOM 27327 H1 SOL 3904 24.260 10.550 74.950 1.00 0.00 ATOM 27328 H2 SOL 3904 24.470 11.220 76.290 1.00 0.00 ATOM 27329 OH2 SOL 3905 42.000 21.810 67.960 1.00 0.00 ATOM 27330 H1 SOL 3905 41.840 22.440 68.660 1.00 0.00 ATOM 27331 H2 SOL 3905 41.140 21.660 67.570 1.00 0.00 ATOM 27332 OH2 SOL 3906 29.920 47.090 68.800 1.00 0.00 ATOM 27333 H1 SOL 3906 29.000 47.140 69.040 1.00 0.00 ATOM 27334 H2 SOL 3906 29.950 47.330 67.880 1.00 0.00 ATOM 27335 OH2 SOL 3907 7.880 19.850 5.140 1.00 0.00 ATOM 27336 H1 SOL 3907 6.980 20.070 4.900 1.00 0.00 ATOM 27337 H2 SOL 3907 8.160 19.210 4.480 1.00 0.00 ATOM 27338 OH2 SOL 3908 28.520 16.140 3.590 1.00 0.00 ATOM 27339 H1 SOL 3908 28.730 17.030 3.850 1.00 0.00 ATOM 27340 H2 SOL 3908 28.220 15.720 4.400 1.00 0.00 ATOM 27341 OH2 SOL 3909 37.300 9.990 71.750 1.00 0.00 ATOM 27342 H1 SOL 3909 36.910 9.690 72.570 1.00 0.00 ATOM 27343 H2 SOL 3909 37.900 10.690 72.010 1.00 0.00 ATOM 27344 OH2 SOL 3910 45.310 42.330 81.790 1.00 0.00 ATOM 27345 H1 SOL 3910 45.160 41.790 82.560 1.00 0.00 ATOM 27346 H2 SOL 3910 46.240 42.210 81.600 1.00 0.00 ATOM 27347 OH2 SOL 3911 4.460 22.360 7.440 1.00 0.00 ATOM 27348 H1 SOL 3911 4.950 21.890 8.110 1.00 0.00 ATOM 27349 H2 SOL 3911 4.070 21.670 6.900 1.00 0.00 ATOM 27350 OH2 SOL 3912 37.120 2.480 69.120 1.00 0.00 ATOM 27351 H1 SOL 3912 37.160 1.810 68.440 1.00 0.00 ATOM 27352 H2 SOL 3912 37.580 3.240 68.740 1.00 0.00 ATOM 27353 OH2 SOL 3913 13.220 45.580 14.510 1.00 0.00 ATOM 27354 H1 SOL 3913 13.880 45.260 13.900 1.00 0.00 ATOM 27355 H2 SOL 3913 13.440 45.170 15.340 1.00 0.00 ATOM 27356 OH2 SOL 3914 43.800 20.690 4.670 1.00 0.00 ATOM 27357 H1 SOL 3914 43.370 19.870 4.930 1.00 0.00 ATOM 27358 H2 SOL 3914 44.630 20.680 5.140 1.00 0.00 ATOM 27359 OH2 SOL 3915 25.290 25.110 29.360 1.00 0.00 ATOM 27360 H1 SOL 3915 26.050 24.630 29.030 1.00 0.00 ATOM 27361 H2 SOL 3915 25.250 25.900 28.810 1.00 0.00 ATOM 27362 OH2 SOL 3916 44.140 14.860 4.690 1.00 0.00 ATOM 27363 H1 SOL 3916 44.020 15.670 5.180 1.00 0.00 ATOM 27364 H2 SOL 3916 44.940 14.480 5.050 1.00 0.00 ATOM 27365 OH2 SOL 3917 36.350 13.830 24.480 1.00 0.00 ATOM 27366 H1 SOL 3917 36.590 13.040 24.960 1.00 0.00 ATOM 27367 H2 SOL 3917 36.050 14.440 25.150 1.00 0.00 ATOM 27368 OH2 SOL 3918 35.330 50.280 79.140 1.00 0.00 ATOM 27369 H1 SOL 3918 34.590 50.480 78.570 1.00 0.00 ATOM 27370 H2 SOL 3918 35.330 49.320 79.200 1.00 0.00 ATOM 27371 OH2 SOL 3919 49.360 18.000 70.140 1.00 0.00 ATOM 27372 H1 SOL 3919 48.760 18.690 69.850 1.00 0.00 ATOM 27373 H2 SOL 3919 49.050 17.750 71.000 1.00 0.00 ATOM 27374 OH2 SOL 3920 55.290 54.430 73.540 1.00 0.00 ATOM 27375 H1 SOL 3920 54.460 53.950 73.590 1.00 0.00 ATOM 27376 H2 SOL 3920 55.880 53.850 73.060 1.00 0.00 ATOM 27377 OH2 SOL 3921 46.240 38.450 17.280 1.00 0.00 ATOM 27378 H1 SOL 3921 46.570 38.380 16.390 1.00 0.00 ATOM 27379 H2 SOL 3921 46.820 37.910 17.800 1.00 0.00 ATOM 27380 OH2 SOL 3922 53.410 43.800 4.270 1.00 0.00 ATOM 27381 H1 SOL 3922 54.080 43.620 4.930 1.00 0.00 ATOM 27382 H2 SOL 3922 53.900 44.040 3.490 1.00 0.00 ATOM 27383 OH2 SOL 3923 52.120 2.950 21.060 1.00 0.00 ATOM 27384 H1 SOL 3923 52.960 2.590 21.350 1.00 0.00 ATOM 27385 H2 SOL 3923 51.560 2.900 21.840 1.00 0.00 ATOM 27386 OH2 SOL 3924 33.840 11.660 69.550 1.00 0.00 ATOM 27387 H1 SOL 3924 34.550 12.240 69.840 1.00 0.00 ATOM 27388 H2 SOL 3924 34.240 10.790 69.520 1.00 0.00 ATOM 27389 OH2 SOL 3925 38.970 23.920 16.400 1.00 0.00 ATOM 27390 H1 SOL 3925 39.120 23.370 15.620 1.00 0.00 ATOM 27391 H2 SOL 3925 39.790 23.860 16.890 1.00 0.00 ATOM 27392 OH2 SOL 3926 52.080 40.720 1.890 1.00 0.00 ATOM 27393 H1 SOL 3926 53.000 40.730 2.170 1.00 0.00 ATOM 27394 H2 SOL 3926 52.130 40.880 0.940 1.00 0.00 ATOM 27395 OH2 SOL 3927 2.570 38.230 4.820 1.00 0.00 ATOM 27396 H1 SOL 3927 2.640 38.260 3.870 1.00 0.00 ATOM 27397 H2 SOL 3927 3.420 37.900 5.120 1.00 0.00 ATOM 27398 OH2 SOL 3928 30.570 21.740 80.030 1.00 0.00 ATOM 27399 H1 SOL 3928 31.300 22.340 79.900 1.00 0.00 ATOM 27400 H2 SOL 3928 30.690 21.070 79.350 1.00 0.00 ATOM 27401 OH2 SOL 3929 42.010 2.750 13.350 1.00 0.00 ATOM 27402 H1 SOL 3929 42.590 3.160 12.700 1.00 0.00 ATOM 27403 H2 SOL 3929 41.520 2.100 12.850 1.00 0.00 ATOM 27404 OH2 SOL 3930 2.360 13.660 83.540 1.00 0.00 ATOM 27405 H1 SOL 3930 3.150 13.280 83.170 1.00 0.00 ATOM 27406 H2 SOL 3930 1.700 13.560 82.850 1.00 0.00 ATOM 27407 OH2 SOL 3931 37.110 52.510 79.030 1.00 0.00 ATOM 27408 H1 SOL 3931 36.790 51.650 79.280 1.00 0.00 ATOM 27409 H2 SOL 3931 36.350 53.090 79.120 1.00 0.00 ATOM 27410 OH2 SOL 3932 5.640 39.330 66.400 1.00 0.00 ATOM 27411 H1 SOL 3932 5.390 40.080 65.860 1.00 0.00 ATOM 27412 H2 SOL 3932 5.090 39.400 67.180 1.00 0.00 ATOM 27413 OH2 SOL 3933 59.040 34.440 72.250 1.00 0.00 ATOM 27414 H1 SOL 3933 59.940 34.540 72.540 1.00 0.00 ATOM 27415 H2 SOL 3933 58.800 35.300 71.910 1.00 0.00 ATOM 27416 OH2 SOL 3934 42.370 55.050 72.000 1.00 0.00 ATOM 27417 H1 SOL 3934 42.270 55.260 71.070 1.00 0.00 ATOM 27418 H2 SOL 3934 41.490 54.830 72.300 1.00 0.00 ATOM 27419 OH2 SOL 3935 19.440 0.000 74.160 1.00 0.00 ATOM 27420 H1 SOL 3935 19.800 0.670 73.570 1.00 0.00 ATOM 27421 H2 SOL 3935 19.410 0.420 75.020 1.00 0.00 ATOM 27422 OH2 SOL 3936 5.460 20.040 72.600 1.00 0.00 ATOM 27423 H1 SOL 3936 5.370 20.070 71.640 1.00 0.00 ATOM 27424 H2 SOL 3936 4.560 20.060 72.920 1.00 0.00 ATOM 27425 OH2 SOL 3937 4.100 47.040 67.660 1.00 0.00 ATOM 27426 H1 SOL 3937 4.850 47.040 67.060 1.00 0.00 ATOM 27427 H2 SOL 3937 3.380 47.400 67.150 1.00 0.00 ATOM 27428 OH2 SOL 3938 37.900 34.000 74.450 1.00 0.00 ATOM 27429 H1 SOL 3938 38.530 33.360 74.780 1.00 0.00 ATOM 27430 H2 SOL 3938 37.640 34.500 75.220 1.00 0.00 ATOM 27431 OH2 SOL 3939 26.980 26.740 66.720 1.00 0.00 ATOM 27432 H1 SOL 3939 26.250 27.310 66.440 1.00 0.00 ATOM 27433 H2 SOL 3939 27.560 26.720 65.960 1.00 0.00 ATOM 27434 OH2 SOL 3940 10.480 32.720 82.250 1.00 0.00 ATOM 27435 H1 SOL 3940 10.090 31.870 82.450 1.00 0.00 ATOM 27436 H2 SOL 3940 11.390 32.530 82.030 1.00 0.00 ATOM 27437 OH2 SOL 3941 38.030 14.360 2.220 1.00 0.00 ATOM 27438 H1 SOL 3941 38.660 15.050 2.430 1.00 0.00 ATOM 27439 H2 SOL 3941 38.150 13.700 2.910 1.00 0.00 ATOM 27440 OH2 SOL 3942 38.530 24.550 64.990 1.00 0.00 ATOM 27441 H1 SOL 3942 37.720 24.980 65.270 1.00 0.00 ATOM 27442 H2 SOL 3942 38.240 23.840 64.420 1.00 0.00 ATOM 27443 OH2 SOL 3943 30.470 25.520 20.620 1.00 0.00 ATOM 27444 H1 SOL 3943 30.990 26.290 20.840 1.00 0.00 ATOM 27445 H2 SOL 3943 30.290 25.110 21.470 1.00 0.00 ATOM 27446 OH2 SOL 3944 39.210 24.940 82.230 1.00 0.00 ATOM 27447 H1 SOL 3944 40.070 25.230 81.930 1.00 0.00 ATOM 27448 H2 SOL 3944 38.870 25.690 82.730 1.00 0.00 ATOM 27449 OH2 SOL 3945 25.680 57.270 19.700 1.00 0.00 ATOM 27450 H1 SOL 3945 25.230 56.790 19.000 1.00 0.00 ATOM 27451 H2 SOL 3945 25.030 57.900 20.020 1.00 0.00 ATOM 27452 OH2 SOL 3946 46.550 22.020 19.280 1.00 0.00 ATOM 27453 H1 SOL 3946 46.860 21.140 19.060 1.00 0.00 ATOM 27454 H2 SOL 3946 45.840 22.190 18.660 1.00 0.00 ATOM 27455 OH2 SOL 3947 39.840 54.240 72.650 1.00 0.00 ATOM 27456 H1 SOL 3947 39.460 53.410 72.930 1.00 0.00 ATOM 27457 H2 SOL 3947 39.600 54.860 73.350 1.00 0.00 ATOM 27458 OH2 SOL 3948 27.690 21.580 67.710 1.00 0.00 ATOM 27459 H1 SOL 3948 28.340 21.210 67.120 1.00 0.00 ATOM 27460 H2 SOL 3948 27.360 20.840 68.210 1.00 0.00 ATOM 27461 OH2 SOL 3949 8.910 46.240 65.190 1.00 0.00 ATOM 27462 H1 SOL 3949 9.310 46.560 64.380 1.00 0.00 ATOM 27463 H2 SOL 3949 9.290 45.370 65.320 1.00 0.00 ATOM 27464 OH2 SOL 3950 54.190 50.950 83.720 1.00 0.00 ATOM 27465 H1 SOL 3950 54.400 51.680 83.130 1.00 0.00 ATOM 27466 H2 SOL 3950 54.500 51.240 84.580 1.00 0.00 ATOM 27467 OH2 SOL 3951 17.080 29.140 10.060 1.00 0.00 ATOM 27468 H1 SOL 3951 16.410 29.390 9.430 1.00 0.00 ATOM 27469 H2 SOL 3951 16.710 29.380 10.910 1.00 0.00 ATOM 27470 OH2 SOL 3952 52.610 24.910 16.620 1.00 0.00 ATOM 27471 H1 SOL 3952 51.980 24.370 16.130 1.00 0.00 ATOM 27472 H2 SOL 3952 52.060 25.550 17.080 1.00 0.00 ATOM 27473 OH2 SOL 3953 11.030 51.250 19.310 1.00 0.00 ATOM 27474 H1 SOL 3953 10.830 52.070 18.860 1.00 0.00 ATOM 27475 H2 SOL 3953 11.330 50.660 18.620 1.00 0.00 ATOM 27476 OH2 SOL 3954 38.180 45.680 78.720 1.00 0.00 ATOM 27477 H1 SOL 3954 39.130 45.690 78.840 1.00 0.00 ATOM 27478 H2 SOL 3954 37.940 46.600 78.600 1.00 0.00 ATOM 27479 OH2 SOL 3955 43.530 10.920 80.340 1.00 0.00 ATOM 27480 H1 SOL 3955 44.250 10.570 80.860 1.00 0.00 ATOM 27481 H2 SOL 3955 43.760 10.730 79.430 1.00 0.00 ATOM 27482 OH2 SOL 3956 56.070 29.300 16.800 1.00 0.00 ATOM 27483 H1 SOL 3956 56.560 29.960 17.290 1.00 0.00 ATOM 27484 H2 SOL 3956 56.630 28.530 16.810 1.00 0.00 ATOM 27485 OH2 SOL 3957 41.500 48.490 3.640 1.00 0.00 ATOM 27486 H1 SOL 3957 40.890 49.170 3.350 1.00 0.00 ATOM 27487 H2 SOL 3957 41.470 47.830 2.950 1.00 0.00 ATOM 27488 OH2 SOL 3958 35.290 16.440 78.040 1.00 0.00 ATOM 27489 H1 SOL 3958 34.760 16.960 77.440 1.00 0.00 ATOM 27490 H2 SOL 3958 34.860 16.570 78.890 1.00 0.00 ATOM 27491 OH2 SOL 3959 36.800 55.890 69.340 1.00 0.00 ATOM 27492 H1 SOL 3959 36.650 56.830 69.260 1.00 0.00 ATOM 27493 H2 SOL 3959 36.170 55.600 70.000 1.00 0.00 ATOM 27494 OH2 SOL 3960 44.600 4.020 74.980 1.00 0.00 ATOM 27495 H1 SOL 3960 44.340 3.500 75.740 1.00 0.00 ATOM 27496 H2 SOL 3960 43.780 4.390 74.650 1.00 0.00 ATOM 27497 OH2 SOL 3961 27.330 10.550 83.910 1.00 0.00 ATOM 27498 H1 SOL 3961 28.110 10.080 83.640 1.00 0.00 ATOM 27499 H2 SOL 3961 27.630 11.450 84.070 1.00 0.00 ATOM 27500 OH2 SOL 3962 22.980 44.710 73.770 1.00 0.00 ATOM 27501 H1 SOL 3962 22.050 44.960 73.800 1.00 0.00 ATOM 27502 H2 SOL 3962 23.340 45.220 73.050 1.00 0.00 ATOM 27503 OH2 SOL 3963 40.270 36.810 10.000 1.00 0.00 ATOM 27504 H1 SOL 3963 39.800 37.210 9.270 1.00 0.00 ATOM 27505 H2 SOL 3963 39.600 36.370 10.510 1.00 0.00 ATOM 27506 OH2 SOL 3964 27.050 49.180 67.270 1.00 0.00 ATOM 27507 H1 SOL 3964 26.820 49.160 68.200 1.00 0.00 ATOM 27508 H2 SOL 3964 26.910 50.090 67.020 1.00 0.00 ATOM 27509 OH2 SOL 3965 40.530 56.690 64.470 1.00 0.00 ATOM 27510 H1 SOL 3965 41.350 56.810 64.000 1.00 0.00 ATOM 27511 H2 SOL 3965 40.700 55.940 65.050 1.00 0.00 ATOM 27512 OH2 SOL 3966 26.570 49.790 6.030 1.00 0.00 ATOM 27513 H1 SOL 3966 25.940 49.460 5.390 1.00 0.00 ATOM 27514 H2 SOL 3966 26.230 49.500 6.880 1.00 0.00 ATOM 27515 OH2 SOL 3967 35.050 8.220 13.410 1.00 0.00 ATOM 27516 H1 SOL 3967 35.350 7.700 12.660 1.00 0.00 ATOM 27517 H2 SOL 3967 35.650 8.960 13.440 1.00 0.00 ATOM 27518 OH2 SOL 3968 1.920 32.600 70.950 1.00 0.00 ATOM 27519 H1 SOL 3968 2.190 32.860 71.830 1.00 0.00 ATOM 27520 H2 SOL 3968 1.210 33.200 70.720 1.00 0.00 ATOM 27521 OH2 SOL 3969 45.390 55.290 19.270 1.00 0.00 ATOM 27522 H1 SOL 3969 45.960 55.140 20.020 1.00 0.00 ATOM 27523 H2 SOL 3969 45.720 54.720 18.590 1.00 0.00 ATOM 27524 OH2 SOL 3970 23.910 19.380 73.560 1.00 0.00 ATOM 27525 H1 SOL 3970 23.890 19.010 74.440 1.00 0.00 ATOM 27526 H2 SOL 3970 23.140 19.000 73.120 1.00 0.00 ATOM 27527 OH2 SOL 3971 47.810 15.430 3.740 1.00 0.00 ATOM 27528 H1 SOL 3971 47.710 14.880 4.520 1.00 0.00 ATOM 27529 H2 SOL 3971 47.660 14.840 3.010 1.00 0.00 ATOM 27530 OH2 SOL 3972 55.570 11.930 12.450 1.00 0.00 ATOM 27531 H1 SOL 3972 55.900 11.530 11.640 1.00 0.00 ATOM 27532 H2 SOL 3972 55.240 12.790 12.170 1.00 0.00 ATOM 27533 OH2 SOL 3973 38.670 46.480 13.660 1.00 0.00 ATOM 27534 H1 SOL 3973 37.910 46.570 13.080 1.00 0.00 ATOM 27535 H2 SOL 3973 38.500 45.690 14.160 1.00 0.00 ATOM 27536 OH2 SOL 3974 11.310 24.680 74.760 1.00 0.00 ATOM 27537 H1 SOL 3974 11.260 23.770 74.470 1.00 0.00 ATOM 27538 H2 SOL 3974 11.070 24.650 75.690 1.00 0.00 ATOM 27539 OH2 SOL 3975 13.950 30.790 2.110 1.00 0.00 ATOM 27540 H1 SOL 3975 13.550 30.050 1.640 1.00 0.00 ATOM 27541 H2 SOL 3975 14.830 30.850 1.750 1.00 0.00 ATOM 27542 OH2 SOL 3976 48.830 41.540 16.970 1.00 0.00 ATOM 27543 H1 SOL 3976 49.600 41.980 17.330 1.00 0.00 ATOM 27544 H2 SOL 3976 49.040 40.610 17.000 1.00 0.00 ATOM 27545 OH2 SOL 3977 7.160 34.650 9.090 1.00 0.00 ATOM 27546 H1 SOL 3977 7.720 34.080 8.560 1.00 0.00 ATOM 27547 H2 SOL 3977 7.760 35.130 9.660 1.00 0.00 ATOM 27548 OH2 SOL 3978 5.130 4.030 66.620 1.00 0.00 ATOM 27549 H1 SOL 3978 5.950 3.540 66.730 1.00 0.00 ATOM 27550 H2 SOL 3978 4.520 3.390 66.260 1.00 0.00 ATOM 27551 OH2 SOL 3979 59.650 33.830 16.860 1.00 0.00 ATOM 27552 H1 SOL 3979 59.240 33.740 17.720 1.00 0.00 ATOM 27553 H2 SOL 3979 59.620 34.770 16.680 1.00 0.00 ATOM 27554 OH2 SOL 3980 12.330 29.670 14.230 1.00 0.00 ATOM 27555 H1 SOL 3980 13.180 29.690 13.790 1.00 0.00 ATOM 27556 H2 SOL 3980 11.930 30.510 14.020 1.00 0.00 ATOM 27557 OH2 SOL 3981 39.870 35.690 66.300 1.00 0.00 ATOM 27558 H1 SOL 3981 39.260 36.090 65.690 1.00 0.00 ATOM 27559 H2 SOL 3981 40.250 34.960 65.820 1.00 0.00 ATOM 27560 OH2 SOL 3982 5.920 13.020 67.870 1.00 0.00 ATOM 27561 H1 SOL 3982 5.490 12.860 68.710 1.00 0.00 ATOM 27562 H2 SOL 3982 5.210 13.100 67.240 1.00 0.00 ATOM 27563 OH2 SOL 3983 55.190 29.080 10.570 1.00 0.00 ATOM 27564 H1 SOL 3983 54.490 28.590 10.120 1.00 0.00 ATOM 27565 H2 SOL 3983 55.670 28.410 11.060 1.00 0.00 ATOM 27566 OH2 SOL 3984 21.930 17.890 72.390 1.00 0.00 ATOM 27567 H1 SOL 3984 21.230 18.290 71.890 1.00 0.00 ATOM 27568 H2 SOL 3984 21.490 17.280 72.980 1.00 0.00 ATOM 27569 OH2 SOL 3985 36.120 28.870 11.840 1.00 0.00 ATOM 27570 H1 SOL 3985 35.460 28.620 11.190 1.00 0.00 ATOM 27571 H2 SOL 3985 36.320 29.780 11.650 1.00 0.00 ATOM 27572 OH2 SOL 3986 45.310 33.360 73.380 1.00 0.00 ATOM 27573 H1 SOL 3986 45.250 33.380 74.340 1.00 0.00 ATOM 27574 H2 SOL 3986 45.850 32.590 73.190 1.00 0.00 ATOM 27575 OH2 SOL 3987 5.740 1.960 14.230 1.00 0.00 ATOM 27576 H1 SOL 3987 6.370 2.680 14.290 1.00 0.00 ATOM 27577 H2 SOL 3987 5.090 2.260 13.610 1.00 0.00 ATOM 27578 OH2 SOL 3988 29.360 56.840 63.170 1.00 0.00 ATOM 27579 H1 SOL 3988 28.630 57.410 63.420 1.00 0.00 ATOM 27580 H2 SOL 3988 29.970 57.420 62.710 1.00 0.00 ATOM 27581 OH2 SOL 3989 30.440 38.210 82.480 1.00 0.00 ATOM 27582 H1 SOL 3989 30.470 38.230 81.520 1.00 0.00 ATOM 27583 H2 SOL 3989 30.560 37.280 82.700 1.00 0.00 ATOM 27584 OH2 SOL 3990 15.450 19.790 1.350 1.00 0.00 ATOM 27585 H1 SOL 3990 16.040 20.010 2.070 1.00 0.00 ATOM 27586 H2 SOL 3990 14.850 20.530 1.290 1.00 0.00 ATOM 27587 OH2 SOL 3991 13.880 2.190 1.100 1.00 0.00 ATOM 27588 H1 SOL 3991 13.090 2.730 1.020 1.00 0.00 ATOM 27589 H2 SOL 3991 13.860 1.630 0.330 1.00 0.00 ATOM 27590 OH2 SOL 3992 34.960 36.900 68.150 1.00 0.00 ATOM 27591 H1 SOL 3992 35.540 36.450 68.760 1.00 0.00 ATOM 27592 H2 SOL 3992 34.580 37.610 68.670 1.00 0.00 ATOM 27593 OH2 SOL 3993 46.990 2.530 8.240 1.00 0.00 ATOM 27594 H1 SOL 3993 46.300 1.970 8.590 1.00 0.00 ATOM 27595 H2 SOL 3993 47.710 1.920 8.060 1.00 0.00 ATOM 27596 OH2 SOL 3994 20.480 9.160 68.310 1.00 0.00 ATOM 27597 H1 SOL 3994 20.490 9.990 68.780 1.00 0.00 ATOM 27598 H2 SOL 3994 21.260 9.180 67.760 1.00 0.00 ATOM 27599 OH2 SOL 3995 9.980 30.700 75.550 1.00 0.00 ATOM 27600 H1 SOL 3995 9.990 29.850 75.980 1.00 0.00 ATOM 27601 H2 SOL 3995 9.180 31.120 75.860 1.00 0.00 ATOM 27602 OH2 SOL 3996 47.730 55.680 21.020 1.00 0.00 ATOM 27603 H1 SOL 3996 47.200 55.850 21.800 1.00 0.00 ATOM 27604 H2 SOL 3996 48.600 56.010 21.250 1.00 0.00 ATOM 27605 OH2 SOL 3997 20.440 2.150 66.080 1.00 0.00 ATOM 27606 H1 SOL 3997 21.270 2.350 65.640 1.00 0.00 ATOM 27607 H2 SOL 3997 20.690 1.550 66.790 1.00 0.00 ATOM 27608 OH2 SOL 3998 44.240 43.500 12.460 1.00 0.00 ATOM 27609 H1 SOL 3998 43.340 43.670 12.180 1.00 0.00 ATOM 27610 H2 SOL 3998 44.310 43.910 13.320 1.00 0.00 ATOM 27611 OH2 SOL 3999 59.450 24.050 4.380 1.00 0.00 ATOM 27612 H1 SOL 3999 60.310 23.620 4.330 1.00 0.00 ATOM 27613 H2 SOL 3999 59.460 24.680 3.660 1.00 0.00 ATOM 27614 OH2 SOL 4000 12.720 28.880 73.130 1.00 0.00 ATOM 27615 H1 SOL 4000 12.500 28.150 73.720 1.00 0.00 ATOM 27616 H2 SOL 4000 12.610 28.510 72.250 1.00 0.00 ATOM 27617 OH2 SOL 4001 39.970 43.570 14.570 1.00 0.00 ATOM 27618 H1 SOL 4001 39.190 43.070 14.790 1.00 0.00 ATOM 27619 H2 SOL 4001 40.660 43.200 15.110 1.00 0.00 ATOM 27620 OH2 SOL 4002 12.910 31.450 82.310 1.00 0.00 ATOM 27621 H1 SOL 4002 13.570 31.100 81.720 1.00 0.00 ATOM 27622 H2 SOL 4002 12.580 30.680 82.780 1.00 0.00 ATOM 27623 OH2 SOL 4003 30.910 31.900 32.560 1.00 0.00 ATOM 27624 H1 SOL 4003 31.630 31.340 32.250 1.00 0.00 ATOM 27625 H2 SOL 4003 30.800 31.650 33.480 1.00 0.00 ATOM 27626 OH2 SOL 4004 44.720 54.110 77.250 1.00 0.00 ATOM 27627 H1 SOL 4004 43.960 54.340 76.720 1.00 0.00 ATOM 27628 H2 SOL 4004 44.540 54.490 78.110 1.00 0.00 ATOM 27629 OH2 SOL 4005 23.270 51.100 7.400 1.00 0.00 ATOM 27630 H1 SOL 4005 22.930 51.590 8.150 1.00 0.00 ATOM 27631 H2 SOL 4005 22.910 51.550 6.630 1.00 0.00 ATOM 27632 OH2 SOL 4006 40.030 11.340 12.820 1.00 0.00 ATOM 27633 H1 SOL 4006 40.890 11.010 13.090 1.00 0.00 ATOM 27634 H2 SOL 4006 40.110 11.480 11.880 1.00 0.00 ATOM 27635 OH2 SOL 4007 21.490 56.140 76.110 1.00 0.00 ATOM 27636 H1 SOL 4007 21.470 56.630 76.930 1.00 0.00 ATOM 27637 H2 SOL 4007 21.960 56.710 75.500 1.00 0.00 ATOM 27638 OH2 SOL 4008 19.110 26.350 73.860 1.00 0.00 ATOM 27639 H1 SOL 4008 19.050 25.800 73.080 1.00 0.00 ATOM 27640 H2 SOL 4008 19.960 26.110 74.260 1.00 0.00 ATOM 27641 OH2 SOL 4009 3.970 48.120 16.460 1.00 0.00 ATOM 27642 H1 SOL 4009 4.400 47.280 16.610 1.00 0.00 ATOM 27643 H2 SOL 4009 4.640 48.660 16.040 1.00 0.00 ATOM 27644 OH2 SOL 4010 15.690 42.180 73.000 1.00 0.00 ATOM 27645 H1 SOL 4010 16.330 42.700 73.500 1.00 0.00 ATOM 27646 H2 SOL 4010 14.850 42.420 73.380 1.00 0.00 ATOM 27647 OH2 SOL 4011 58.510 11.950 19.750 1.00 0.00 ATOM 27648 H1 SOL 4011 59.300 11.480 20.020 1.00 0.00 ATOM 27649 H2 SOL 4011 58.460 11.810 18.800 1.00 0.00 ATOM 27650 OH2 SOL 4012 42.640 7.650 67.300 1.00 0.00 ATOM 27651 H1 SOL 4012 41.990 7.120 67.750 1.00 0.00 ATOM 27652 H2 SOL 4012 42.140 8.120 66.630 1.00 0.00 ATOM 27653 OH2 SOL 4013 40.050 47.520 5.750 1.00 0.00 ATOM 27654 H1 SOL 4013 40.390 47.700 4.870 1.00 0.00 ATOM 27655 H2 SOL 4013 39.360 48.180 5.880 1.00 0.00 ATOM 27656 OH2 SOL 4014 12.070 27.280 75.770 1.00 0.00 ATOM 27657 H1 SOL 4014 11.310 27.850 75.870 1.00 0.00 ATOM 27658 H2 SOL 4014 11.700 26.410 75.600 1.00 0.00 ATOM 27659 OH2 SOL 4015 23.630 35.600 5.790 1.00 0.00 ATOM 27660 H1 SOL 4015 23.430 34.820 5.260 1.00 0.00 ATOM 27661 H2 SOL 4015 22.790 35.880 6.140 1.00 0.00 ATOM 27662 OH2 SOL 4016 19.360 8.340 18.050 1.00 0.00 ATOM 27663 H1 SOL 4016 19.030 9.100 17.580 1.00 0.00 ATOM 27664 H2 SOL 4016 18.990 7.590 17.590 1.00 0.00 ATOM 27665 OH2 SOL 4017 43.110 30.210 10.320 1.00 0.00 ATOM 27666 H1 SOL 4017 43.700 29.480 10.510 1.00 0.00 ATOM 27667 H2 SOL 4017 42.230 29.850 10.420 1.00 0.00 ATOM 27668 OH2 SOL 4018 20.960 12.450 19.170 1.00 0.00 ATOM 27669 H1 SOL 4018 21.420 11.750 18.720 1.00 0.00 ATOM 27670 H2 SOL 4018 21.060 13.210 18.600 1.00 0.00 ATOM 27671 OH2 SOL 4019 37.830 49.150 14.610 1.00 0.00 ATOM 27672 H1 SOL 4019 36.920 48.860 14.760 1.00 0.00 ATOM 27673 H2 SOL 4019 38.260 48.390 14.230 1.00 0.00 ATOM 27674 OH2 SOL 4020 45.160 29.430 68.300 1.00 0.00 ATOM 27675 H1 SOL 4020 44.730 29.280 67.460 1.00 0.00 ATOM 27676 H2 SOL 4020 44.690 30.170 68.680 1.00 0.00 ATOM 27677 OH2 SOL 4021 48.270 51.430 15.350 1.00 0.00 ATOM 27678 H1 SOL 4021 47.610 50.740 15.350 1.00 0.00 ATOM 27679 H2 SOL 4021 48.800 51.260 16.130 1.00 0.00 ATOM 27680 OH2 SOL 4022 52.790 16.890 67.090 1.00 0.00 ATOM 27681 H1 SOL 4022 52.980 16.960 68.020 1.00 0.00 ATOM 27682 H2 SOL 4022 52.360 16.040 67.000 1.00 0.00 ATOM 27683 OH2 SOL 4023 44.050 57.720 13.430 1.00 0.00 ATOM 27684 H1 SOL 4023 44.180 58.500 12.890 1.00 0.00 ATOM 27685 H2 SOL 4023 43.120 57.510 13.330 1.00 0.00 ATOM 27686 OH2 SOL 4024 2.420 41.220 7.520 1.00 0.00 ATOM 27687 H1 SOL 4024 2.640 40.310 7.300 1.00 0.00 ATOM 27688 H2 SOL 4024 2.490 41.260 8.470 1.00 0.00 ATOM 27689 OH2 SOL 4025 32.420 50.870 70.620 1.00 0.00 ATOM 27690 H1 SOL 4025 32.770 50.850 69.730 1.00 0.00 ATOM 27691 H2 SOL 4025 33.190 50.980 71.180 1.00 0.00 ATOM 27692 OH2 SOL 4026 43.910 31.350 76.020 1.00 0.00 ATOM 27693 H1 SOL 4026 43.620 30.430 76.070 1.00 0.00 ATOM 27694 H2 SOL 4026 43.490 31.690 75.230 1.00 0.00 ATOM 27695 OH2 SOL 4027 55.410 33.840 78.160 1.00 0.00 ATOM 27696 H1 SOL 4027 54.640 34.330 78.450 1.00 0.00 ATOM 27697 H2 SOL 4027 55.410 33.950 77.210 1.00 0.00 ATOM 27698 OH2 SOL 4028 56.440 35.360 14.970 1.00 0.00 ATOM 27699 H1 SOL 4028 55.740 35.990 14.780 1.00 0.00 ATOM 27700 H2 SOL 4028 57.200 35.710 14.510 1.00 0.00 ATOM 27701 OH2 SOL 4029 37.920 11.490 74.250 1.00 0.00 ATOM 27702 H1 SOL 4029 37.590 10.600 74.340 1.00 0.00 ATOM 27703 H2 SOL 4029 38.320 11.690 75.100 1.00 0.00 ATOM 27704 OH2 SOL 4030 47.720 40.430 80.800 1.00 0.00 ATOM 27705 H1 SOL 4030 47.700 40.170 81.720 1.00 0.00 ATOM 27706 H2 SOL 4030 48.580 40.150 80.490 1.00 0.00 ATOM 27707 OH2 SOL 4031 35.140 1.390 15.450 1.00 0.00 ATOM 27708 H1 SOL 4031 36.020 1.010 15.470 1.00 0.00 ATOM 27709 H2 SOL 4031 34.870 1.420 16.370 1.00 0.00 ATOM 27710 OH2 SOL 4032 16.020 35.920 10.870 1.00 0.00 ATOM 27711 H1 SOL 4032 15.680 36.800 10.760 1.00 0.00 ATOM 27712 H2 SOL 4032 16.920 35.960 10.550 1.00 0.00 ATOM 27713 OH2 SOL 4033 1.700 42.090 10.480 1.00 0.00 ATOM 27714 H1 SOL 4033 0.770 41.950 10.690 1.00 0.00 ATOM 27715 H2 SOL 4033 2.170 41.520 11.090 1.00 0.00 ATOM 27716 OH2 SOL 4034 45.370 8.970 19.660 1.00 0.00 ATOM 27717 H1 SOL 4034 45.700 8.710 18.800 1.00 0.00 ATOM 27718 H2 SOL 4034 46.140 8.950 20.220 1.00 0.00 ATOM 27719 OH2 SOL 4035 30.680 25.680 8.900 1.00 0.00 ATOM 27720 H1 SOL 4035 30.550 24.750 9.090 1.00 0.00 ATOM 27721 H2 SOL 4035 30.020 25.880 8.240 1.00 0.00 ATOM 27722 OH2 SOL 4036 24.590 22.410 74.700 1.00 0.00 ATOM 27723 H1 SOL 4036 23.820 22.460 74.130 1.00 0.00 ATOM 27724 H2 SOL 4036 24.250 22.540 75.580 1.00 0.00 ATOM 27725 OH2 SOL 4037 48.930 30.540 71.980 1.00 0.00 ATOM 27726 H1 SOL 4037 48.390 29.750 72.000 1.00 0.00 ATOM 27727 H2 SOL 4037 49.080 30.700 71.050 1.00 0.00 ATOM 27728 OH2 SOL 4038 56.440 12.900 73.870 1.00 0.00 ATOM 27729 H1 SOL 4038 57.330 12.760 73.530 1.00 0.00 ATOM 27730 H2 SOL 4038 56.480 13.770 74.270 1.00 0.00 ATOM 27731 OH2 SOL 4039 58.580 50.100 19.490 1.00 0.00 ATOM 27732 H1 SOL 4039 59.200 49.430 19.210 1.00 0.00 ATOM 27733 H2 SOL 4039 58.770 50.240 20.420 1.00 0.00 ATOM 27734 OH2 SOL 4040 38.300 2.350 20.540 1.00 0.00 ATOM 27735 H1 SOL 4040 38.390 2.300 19.590 1.00 0.00 ATOM 27736 H2 SOL 4040 38.950 1.740 20.880 1.00 0.00 ATOM 27737 OH2 SOL 4041 18.380 58.300 6.260 1.00 0.00 ATOM 27738 H1 SOL 4041 18.170 57.960 7.130 1.00 0.00 ATOM 27739 H2 SOL 4041 19.130 58.890 6.410 1.00 0.00 ATOM 27740 OH2 SOL 4042 17.070 25.130 79.260 1.00 0.00 ATOM 27741 H1 SOL 4042 16.830 25.940 78.800 1.00 0.00 ATOM 27742 H2 SOL 4042 16.700 24.430 78.720 1.00 0.00 ATOM 27743 OH2 SOL 4043 49.810 46.850 14.960 1.00 0.00 ATOM 27744 H1 SOL 4043 49.640 47.710 14.570 1.00 0.00 ATOM 27745 H2 SOL 4043 49.460 46.230 14.320 1.00 0.00 ATOM 27746 OH2 SOL 4044 17.650 19.110 77.850 1.00 0.00 ATOM 27747 H1 SOL 4044 18.500 19.430 77.550 1.00 0.00 ATOM 27748 H2 SOL 4044 17.470 19.600 78.660 1.00 0.00 ATOM 27749 OH2 SOL 4045 42.650 52.350 7.000 1.00 0.00 ATOM 27750 H1 SOL 4045 43.110 51.690 7.520 1.00 0.00 ATOM 27751 H2 SOL 4045 42.740 53.160 7.500 1.00 0.00 ATOM 27752 OH2 SOL 4046 32.420 4.940 82.890 1.00 0.00 ATOM 27753 H1 SOL 4046 32.810 4.220 83.390 1.00 0.00 ATOM 27754 H2 SOL 4046 31.780 4.510 82.310 1.00 0.00 ATOM 27755 OH2 SOL 4047 29.950 44.860 5.450 1.00 0.00 ATOM 27756 H1 SOL 4047 29.280 44.230 5.200 1.00 0.00 ATOM 27757 H2 SOL 4047 30.330 45.140 4.620 1.00 0.00 ATOM 27758 OH2 SOL 4048 22.200 20.000 0.680 1.00 0.00 ATOM 27759 H1 SOL 4048 22.550 20.890 0.640 1.00 0.00 ATOM 27760 H2 SOL 4048 21.280 20.100 0.450 1.00 0.00 ATOM 27761 OH2 SOL 4049 22.090 13.500 83.330 1.00 0.00 ATOM 27762 H1 SOL 4049 22.520 12.760 82.890 1.00 0.00 ATOM 27763 H2 SOL 4049 21.170 13.450 83.040 1.00 0.00 ATOM 27764 OH2 SOL 4050 10.180 50.970 10.840 1.00 0.00 ATOM 27765 H1 SOL 4050 10.910 50.650 11.360 1.00 0.00 ATOM 27766 H2 SOL 4050 9.560 50.250 10.820 1.00 0.00 ATOM 27767 OH2 SOL 4051 2.220 55.890 6.470 1.00 0.00 ATOM 27768 H1 SOL 4051 1.270 55.980 6.570 1.00 0.00 ATOM 27769 H2 SOL 4051 2.340 55.640 5.560 1.00 0.00 ATOM 27770 OH2 SOL 4052 51.890 46.820 75.620 1.00 0.00 ATOM 27771 H1 SOL 4052 52.340 47.660 75.630 1.00 0.00 ATOM 27772 H2 SOL 4052 51.310 46.850 76.390 1.00 0.00 ATOM 27773 OH2 SOL 4053 51.970 9.070 4.760 1.00 0.00 ATOM 27774 H1 SOL 4053 52.060 9.250 5.690 1.00 0.00 ATOM 27775 H2 SOL 4053 51.640 9.880 4.390 1.00 0.00 ATOM 27776 OH2 SOL 4054 30.190 37.060 67.700 1.00 0.00 ATOM 27777 H1 SOL 4054 29.610 36.480 67.210 1.00 0.00 ATOM 27778 H2 SOL 4054 29.960 37.940 67.400 1.00 0.00 ATOM 27779 OH2 SOL 4055 61.230 36.570 80.140 1.00 0.00 ATOM 27780 H1 SOL 4055 60.670 35.830 80.380 1.00 0.00 ATOM 27781 H2 SOL 4055 61.450 36.980 80.980 1.00 0.00 ATOM 27782 OH2 SOL 4056 4.580 52.550 83.860 1.00 0.00 ATOM 27783 H1 SOL 4056 4.230 53.410 83.630 1.00 0.00 ATOM 27784 H2 SOL 4056 4.250 51.960 83.170 1.00 0.00 ATOM 27785 OH2 SOL 4057 32.900 50.900 5.130 1.00 0.00 ATOM 27786 H1 SOL 4057 33.850 50.830 5.190 1.00 0.00 ATOM 27787 H2 SOL 4057 32.590 50.000 5.020 1.00 0.00 ATOM 27788 OH2 SOL 4058 54.210 9.290 64.170 1.00 0.00 ATOM 27789 H1 SOL 4058 54.310 9.100 65.100 1.00 0.00 ATOM 27790 H2 SOL 4058 55.060 9.640 63.910 1.00 0.00 ATOM 27791 OH2 SOL 4059 52.700 34.620 8.070 1.00 0.00 ATOM 27792 H1 SOL 4059 51.960 34.220 7.620 1.00 0.00 ATOM 27793 H2 SOL 4059 53.100 33.910 8.560 1.00 0.00 ATOM 27794 OH2 SOL 4060 48.950 12.800 9.080 1.00 0.00 ATOM 27795 H1 SOL 4060 49.290 12.390 9.870 1.00 0.00 ATOM 27796 H2 SOL 4060 49.690 13.320 8.750 1.00 0.00 ATOM 27797 OH2 SOL 4061 38.950 42.400 0.470 1.00 0.00 ATOM 27798 H1 SOL 4061 39.560 42.630 -0.240 1.00 0.00 ATOM 27799 H2 SOL 4061 38.540 41.590 0.170 1.00 0.00 ATOM 27800 OH2 SOL 4062 49.840 35.830 16.330 1.00 0.00 ATOM 27801 H1 SOL 4062 50.640 36.170 16.720 1.00 0.00 ATOM 27802 H2 SOL 4062 50.020 34.910 16.160 1.00 0.00 ATOM 27803 OH2 SOL 4063 46.960 43.060 2.810 1.00 0.00 ATOM 27804 H1 SOL 4063 46.320 43.560 3.320 1.00 0.00 ATOM 27805 H2 SOL 4063 46.780 42.150 3.030 1.00 0.00 ATOM 27806 OH2 SOL 4064 58.000 2.540 23.700 1.00 0.00 ATOM 27807 H1 SOL 4064 58.060 2.100 24.550 1.00 0.00 ATOM 27808 H2 SOL 4064 58.650 2.100 23.160 1.00 0.00 ATOM 27809 OH2 SOL 4065 2.520 41.000 1.970 1.00 0.00 ATOM 27810 H1 SOL 4065 3.390 41.350 2.150 1.00 0.00 ATOM 27811 H2 SOL 4065 2.090 40.980 2.830 1.00 0.00 ATOM 27812 OH2 SOL 4066 9.210 3.590 82.730 1.00 0.00 ATOM 27813 H1 SOL 4066 8.280 3.380 82.850 1.00 0.00 ATOM 27814 H2 SOL 4066 9.200 4.470 82.360 1.00 0.00 ATOM 27815 OH2 SOL 4067 20.810 33.420 19.080 1.00 0.00 ATOM 27816 H1 SOL 4067 21.430 32.980 19.650 1.00 0.00 ATOM 27817 H2 SOL 4067 20.030 32.870 19.100 1.00 0.00 ATOM 27818 OH2 SOL 4068 55.090 6.170 77.880 1.00 0.00 ATOM 27819 H1 SOL 4068 55.650 6.770 77.380 1.00 0.00 ATOM 27820 H2 SOL 4068 55.650 5.840 78.570 1.00 0.00 ATOM 27821 OH2 SOL 4069 29.120 4.540 0.850 1.00 0.00 ATOM 27822 H1 SOL 4069 29.390 5.030 1.630 1.00 0.00 ATOM 27823 H2 SOL 4069 28.160 4.620 0.830 1.00 0.00 ATOM 27824 OH2 SOL 4070 26.480 5.490 79.430 1.00 0.00 ATOM 27825 H1 SOL 4070 26.200 6.290 78.980 1.00 0.00 ATOM 27826 H2 SOL 4070 26.500 4.820 78.750 1.00 0.00 ATOM 27827 OH2 SOL 4071 32.330 49.260 74.500 1.00 0.00 ATOM 27828 H1 SOL 4071 32.350 50.020 73.910 1.00 0.00 ATOM 27829 H2 SOL 4071 32.070 49.620 75.340 1.00 0.00 ATOM 27830 OH2 SOL 4072 32.680 6.000 16.460 1.00 0.00 ATOM 27831 H1 SOL 4072 32.850 5.470 17.240 1.00 0.00 ATOM 27832 H2 SOL 4072 31.950 6.570 16.710 1.00 0.00 ATOM 27833 OH2 SOL 4073 16.050 56.480 69.540 1.00 0.00 ATOM 27834 H1 SOL 4073 15.110 56.550 69.700 1.00 0.00 ATOM 27835 H2 SOL 4073 16.410 56.160 70.370 1.00 0.00 ATOM 27836 OH2 SOL 4074 16.400 21.390 79.930 1.00 0.00 ATOM 27837 H1 SOL 4074 15.760 20.850 80.380 1.00 0.00 ATOM 27838 H2 SOL 4074 17.240 21.150 80.320 1.00 0.00 ATOM 27839 OH2 SOL 4075 41.570 16.620 22.490 1.00 0.00 ATOM 27840 H1 SOL 4075 41.990 15.960 21.930 1.00 0.00 ATOM 27841 H2 SOL 4075 42.290 17.010 22.980 1.00 0.00 ATOM 27842 OH2 SOL 4076 54.830 5.410 13.500 1.00 0.00 ATOM 27843 H1 SOL 4076 55.260 4.580 13.330 1.00 0.00 ATOM 27844 H2 SOL 4076 54.980 5.580 14.430 1.00 0.00 ATOM 27845 OH2 SOL 4077 28.360 14.350 75.490 1.00 0.00 ATOM 27846 H1 SOL 4077 28.120 15.140 75.970 1.00 0.00 ATOM 27847 H2 SOL 4077 29.250 14.530 75.170 1.00 0.00 ATOM 27848 OH2 SOL 4078 12.600 49.430 73.980 1.00 0.00 ATOM 27849 H1 SOL 4078 13.410 49.250 74.450 1.00 0.00 ATOM 27850 H2 SOL 4078 12.340 48.570 73.620 1.00 0.00 ATOM 27851 OH2 SOL 4079 24.200 15.080 15.220 1.00 0.00 ATOM 27852 H1 SOL 4079 24.860 14.870 15.880 1.00 0.00 ATOM 27853 H2 SOL 4079 24.270 16.030 15.100 1.00 0.00 ATOM 27854 OH2 SOL 4080 5.360 0.450 67.670 1.00 0.00 ATOM 27855 H1 SOL 4080 5.710 0.160 68.510 1.00 0.00 ATOM 27856 H2 SOL 4080 4.440 0.660 67.840 1.00 0.00 ATOM 27857 OH2 SOL 4081 59.280 27.170 10.580 1.00 0.00 ATOM 27858 H1 SOL 4081 59.630 26.290 10.640 1.00 0.00 ATOM 27859 H2 SOL 4081 58.510 27.170 11.150 1.00 0.00 ATOM 27860 OH2 SOL 4082 22.210 56.940 69.930 1.00 0.00 ATOM 27861 H1 SOL 4082 23.020 56.450 70.070 1.00 0.00 ATOM 27862 H2 SOL 4082 21.610 56.580 70.580 1.00 0.00 ATOM 27863 OH2 SOL 4083 20.600 13.690 26.210 1.00 0.00 ATOM 27864 H1 SOL 4083 21.460 14.000 26.510 1.00 0.00 ATOM 27865 H2 SOL 4083 20.120 13.500 27.010 1.00 0.00 ATOM 27866 OH2 SOL 4084 39.220 9.430 80.740 1.00 0.00 ATOM 27867 H1 SOL 4084 38.440 9.210 80.220 1.00 0.00 ATOM 27868 H2 SOL 4084 39.020 10.280 81.120 1.00 0.00 ATOM 27869 OH2 SOL 4085 6.420 38.350 70.810 1.00 0.00 ATOM 27870 H1 SOL 4085 5.990 38.030 70.010 1.00 0.00 ATOM 27871 H2 SOL 4085 6.070 37.790 71.500 1.00 0.00 ATOM 27872 OH2 SOL 4086 28.050 37.720 25.120 1.00 0.00 ATOM 27873 H1 SOL 4086 27.720 37.790 24.220 1.00 0.00 ATOM 27874 H2 SOL 4086 28.020 36.780 25.310 1.00 0.00 ATOM 27875 OH2 SOL 4087 25.350 6.630 9.080 1.00 0.00 ATOM 27876 H1 SOL 4087 24.920 6.450 9.910 1.00 0.00 ATOM 27877 H2 SOL 4087 25.770 7.490 9.210 1.00 0.00 ATOM 27878 OH2 SOL 4088 28.070 1.680 15.230 1.00 0.00 ATOM 27879 H1 SOL 4088 28.970 2.010 15.230 1.00 0.00 ATOM 27880 H2 SOL 4088 27.810 1.710 16.150 1.00 0.00 ATOM 27881 OH2 SOL 4089 24.880 11.190 7.140 1.00 0.00 ATOM 27882 H1 SOL 4089 24.250 11.890 6.940 1.00 0.00 ATOM 27883 H2 SOL 4089 24.390 10.380 6.990 1.00 0.00 ATOM 27884 OH2 SOL 4090 25.380 29.670 72.030 1.00 0.00 ATOM 27885 H1 SOL 4090 25.730 30.430 72.490 1.00 0.00 ATOM 27886 H2 SOL 4090 24.980 30.020 71.240 1.00 0.00 ATOM 27887 OH2 SOL 4091 61.200 50.390 6.890 1.00 0.00 ATOM 27888 H1 SOL 4091 60.900 50.600 7.780 1.00 0.00 ATOM 27889 H2 SOL 4091 60.630 49.670 6.620 1.00 0.00 ATOM 27890 OH2 SOL 4092 2.880 22.700 82.440 1.00 0.00 ATOM 27891 H1 SOL 4092 2.070 22.790 81.930 1.00 0.00 ATOM 27892 H2 SOL 4092 3.570 22.670 81.780 1.00 0.00 ATOM 27893 OH2 SOL 4093 58.250 51.560 17.010 1.00 0.00 ATOM 27894 H1 SOL 4093 58.210 51.100 17.840 1.00 0.00 ATOM 27895 H2 SOL 4093 58.560 52.440 17.240 1.00 0.00 ATOM 27896 OH2 SOL 4094 3.290 48.440 60.490 1.00 0.00 ATOM 27897 H1 SOL 4094 4.230 48.250 60.510 1.00 0.00 ATOM 27898 H2 SOL 4094 2.870 47.620 60.750 1.00 0.00 ATOM 27899 OH2 SOL 4095 55.260 6.290 11.080 1.00 0.00 ATOM 27900 H1 SOL 4095 55.160 5.790 11.890 1.00 0.00 ATOM 27901 H2 SOL 4095 54.550 6.940 11.110 1.00 0.00 ATOM 27902 OH2 SOL 4096 15.770 1.020 6.440 1.00 0.00 ATOM 27903 H1 SOL 4096 16.630 0.670 6.220 1.00 0.00 ATOM 27904 H2 SOL 4096 15.890 1.390 7.320 1.00 0.00 ATOM 27905 OH2 SOL 4097 34.450 40.740 79.760 1.00 0.00 ATOM 27906 H1 SOL 4097 33.510 40.570 79.780 1.00 0.00 ATOM 27907 H2 SOL 4097 34.530 41.680 79.650 1.00 0.00 ATOM 27908 OH2 SOL 4098 15.640 24.360 14.840 1.00 0.00 ATOM 27909 H1 SOL 4098 16.420 23.940 15.200 1.00 0.00 ATOM 27910 H2 SOL 4098 15.610 24.060 13.930 1.00 0.00 ATOM 27911 OH2 SOL 4099 51.430 31.960 70.320 1.00 0.00 ATOM 27912 H1 SOL 4099 50.840 31.520 69.710 1.00 0.00 ATOM 27913 H2 SOL 4099 52.040 32.430 69.760 1.00 0.00 ATOM 27914 OH2 SOL 4100 58.500 49.320 75.300 1.00 0.00 ATOM 27915 H1 SOL 4100 59.000 49.770 75.980 1.00 0.00 ATOM 27916 H2 SOL 4100 57.580 49.460 75.540 1.00 0.00 ATOM 27917 OH2 SOL 4101 25.770 14.670 17.630 1.00 0.00 ATOM 27918 H1 SOL 4101 25.620 13.770 17.920 1.00 0.00 ATOM 27919 H2 SOL 4101 25.820 15.180 18.450 1.00 0.00 ATOM 27920 OH2 SOL 4102 28.910 36.780 11.750 1.00 0.00 ATOM 27921 H1 SOL 4102 29.560 36.820 11.050 1.00 0.00 ATOM 27922 H2 SOL 4102 28.290 37.480 11.530 1.00 0.00 ATOM 27923 OH2 SOL 4103 59.640 17.620 73.840 1.00 0.00 ATOM 27924 H1 SOL 4103 59.340 17.510 74.750 1.00 0.00 ATOM 27925 H2 SOL 4103 59.170 16.950 73.350 1.00 0.00 ATOM 27926 OH2 SOL 4104 53.730 24.620 74.220 1.00 0.00 ATOM 27927 H1 SOL 4104 54.040 25.490 74.470 1.00 0.00 ATOM 27928 H2 SOL 4104 52.790 24.630 74.390 1.00 0.00 ATOM 27929 OH2 SOL 4105 37.230 31.500 6.100 1.00 0.00 ATOM 27930 H1 SOL 4105 37.320 30.560 5.960 1.00 0.00 ATOM 27931 H2 SOL 4105 38.100 31.860 5.900 1.00 0.00 ATOM 27932 OH2 SOL 4106 34.630 18.310 7.620 1.00 0.00 ATOM 27933 H1 SOL 4106 35.570 18.240 7.450 1.00 0.00 ATOM 27934 H2 SOL 4106 34.290 18.820 6.890 1.00 0.00 ATOM 27935 OH2 SOL 4107 17.040 53.440 4.300 1.00 0.00 ATOM 27936 H1 SOL 4107 16.910 53.760 5.190 1.00 0.00 ATOM 27937 H2 SOL 4107 16.160 53.420 3.920 1.00 0.00 ATOM 27938 OH2 SOL 4108 35.300 37.820 4.180 1.00 0.00 ATOM 27939 H1 SOL 4108 35.630 38.680 3.940 1.00 0.00 ATOM 27940 H2 SOL 4108 35.970 37.210 3.870 1.00 0.00 ATOM 27941 OH2 SOL 4109 48.350 7.840 5.600 1.00 0.00 ATOM 27942 H1 SOL 4109 48.710 7.280 4.910 1.00 0.00 ATOM 27943 H2 SOL 4109 48.070 8.630 5.140 1.00 0.00 ATOM 27944 OH2 SOL 4110 53.350 58.650 62.470 1.00 0.00 ATOM 27945 H1 SOL 4110 52.940 58.690 63.330 1.00 0.00 ATOM 27946 H2 SOL 4110 52.760 58.110 61.950 1.00 0.00 ATOM 27947 OH2 SOL 4111 44.490 5.630 25.320 1.00 0.00 ATOM 27948 H1 SOL 4111 44.490 4.970 26.020 1.00 0.00 ATOM 27949 H2 SOL 4111 43.940 6.330 25.660 1.00 0.00 ATOM 27950 OH2 SOL 4112 31.260 17.000 78.760 1.00 0.00 ATOM 27951 H1 SOL 4112 31.180 16.640 79.640 1.00 0.00 ATOM 27952 H2 SOL 4112 32.060 16.620 78.410 1.00 0.00 ATOM 27953 OH2 SOL 4113 52.830 18.480 17.700 1.00 0.00 ATOM 27954 H1 SOL 4113 51.990 18.050 17.890 1.00 0.00 ATOM 27955 H2 SOL 4113 53.170 18.000 16.950 1.00 0.00 ATOM 27956 OH2 SOL 4114 18.410 20.970 17.010 1.00 0.00 ATOM 27957 H1 SOL 4114 17.800 21.710 16.980 1.00 0.00 ATOM 27958 H2 SOL 4114 18.050 20.330 16.400 1.00 0.00 ATOM 27959 OH2 SOL 4115 6.640 23.920 6.210 1.00 0.00 ATOM 27960 H1 SOL 4115 6.150 24.690 6.490 1.00 0.00 ATOM 27961 H2 SOL 4115 6.040 23.190 6.380 1.00 0.00 ATOM 27962 OH2 SOL 4116 1.860 1.390 8.120 1.00 0.00 ATOM 27963 H1 SOL 4116 1.590 2.130 7.570 1.00 0.00 ATOM 27964 H2 SOL 4116 1.420 0.630 7.740 1.00 0.00 ATOM 27965 OH2 SOL 4117 24.820 32.780 16.450 1.00 0.00 ATOM 27966 H1 SOL 4117 23.970 32.540 16.080 1.00 0.00 ATOM 27967 H2 SOL 4117 25.460 32.360 15.870 1.00 0.00 ATOM 27968 OH2 SOL 4118 27.570 38.450 8.580 1.00 0.00 ATOM 27969 H1 SOL 4118 28.390 38.930 8.430 1.00 0.00 ATOM 27970 H2 SOL 4118 27.220 38.830 9.380 1.00 0.00 ATOM 27971 OH2 SOL 4119 7.790 42.630 17.220 1.00 0.00 ATOM 27972 H1 SOL 4119 8.430 43.270 16.910 1.00 0.00 ATOM 27973 H2 SOL 4119 8.300 42.020 17.750 1.00 0.00 ATOM 27974 OH2 SOL 4120 8.390 55.250 23.430 1.00 0.00 ATOM 27975 H1 SOL 4120 8.650 55.860 22.740 1.00 0.00 ATOM 27976 H2 SOL 4120 7.450 55.370 23.520 1.00 0.00 ATOM 27977 OH2 SOL 4121 50.430 9.460 82.570 1.00 0.00 ATOM 27978 H1 SOL 4121 49.800 10.000 82.100 1.00 0.00 ATOM 27979 H2 SOL 4121 49.910 8.810 83.030 1.00 0.00 ATOM 27980 OH2 SOL 4122 31.340 35.160 6.210 1.00 0.00 ATOM 27981 H1 SOL 4122 30.390 35.250 6.210 1.00 0.00 ATOM 27982 H2 SOL 4122 31.660 36.010 6.500 1.00 0.00 ATOM 27983 OH2 SOL 4123 53.200 35.220 79.030 1.00 0.00 ATOM 27984 H1 SOL 4123 52.260 35.310 79.170 1.00 0.00 ATOM 27985 H2 SOL 4123 53.530 36.120 79.050 1.00 0.00 ATOM 27986 OH2 SOL 4124 47.540 54.440 16.960 1.00 0.00 ATOM 27987 H1 SOL 4124 47.520 55.180 16.350 1.00 0.00 ATOM 27988 H2 SOL 4124 47.640 53.670 16.400 1.00 0.00 ATOM 27989 OH2 SOL 4125 45.320 7.060 67.020 1.00 0.00 ATOM 27990 H1 SOL 4125 45.620 7.970 66.940 1.00 0.00 ATOM 27991 H2 SOL 4125 44.370 7.120 67.050 1.00 0.00 ATOM 27992 OH2 SOL 4126 28.120 6.210 71.970 1.00 0.00 ATOM 27993 H1 SOL 4126 28.580 7.040 72.070 1.00 0.00 ATOM 27994 H2 SOL 4126 27.410 6.410 71.350 1.00 0.00 ATOM 27995 OH2 SOL 4127 41.860 26.700 16.290 1.00 0.00 ATOM 27996 H1 SOL 4127 42.560 26.560 15.650 1.00 0.00 ATOM 27997 H2 SOL 4127 42.320 26.960 17.090 1.00 0.00 ATOM 27998 OH2 SOL 4128 50.160 49.940 68.170 1.00 0.00 ATOM 27999 H1 SOL 4128 50.410 50.780 68.540 1.00 0.00 ATOM 28000 H2 SOL 4128 50.820 49.750 67.500 1.00 0.00 ATOM 28001 OH2 SOL 4129 33.200 30.720 1.610 1.00 0.00 ATOM 28002 H1 SOL 4129 33.130 30.650 2.560 1.00 0.00 ATOM 28003 H2 SOL 4129 33.380 31.650 1.450 1.00 0.00 ATOM 28004 OH2 SOL 4130 48.120 9.340 13.470 1.00 0.00 ATOM 28005 H1 SOL 4130 48.050 9.180 12.530 1.00 0.00 ATOM 28006 H2 SOL 4130 48.100 10.290 13.560 1.00 0.00 ATOM 28007 OH2 SOL 4131 50.030 28.320 21.030 1.00 0.00 ATOM 28008 H1 SOL 4131 50.290 29.050 20.480 1.00 0.00 ATOM 28009 H2 SOL 4131 50.290 28.580 21.920 1.00 0.00 ATOM 28010 OH2 SOL 4132 32.970 38.270 5.580 1.00 0.00 ATOM 28011 H1 SOL 4132 32.780 39.100 5.130 1.00 0.00 ATOM 28012 H2 SOL 4132 33.810 37.990 5.210 1.00 0.00 ATOM 28013 OH2 SOL 4133 29.650 50.620 67.540 1.00 0.00 ATOM 28014 H1 SOL 4133 29.420 49.770 67.160 1.00 0.00 ATOM 28015 H2 SOL 4133 30.160 51.060 66.860 1.00 0.00 ATOM 28016 OH2 SOL 4134 25.150 40.810 18.380 1.00 0.00 ATOM 28017 H1 SOL 4134 24.800 41.220 19.170 1.00 0.00 ATOM 28018 H2 SOL 4134 25.010 41.470 17.690 1.00 0.00 ATOM 28019 OH2 SOL 4135 57.000 18.050 17.980 1.00 0.00 ATOM 28020 H1 SOL 4135 57.100 17.790 18.900 1.00 0.00 ATOM 28021 H2 SOL 4135 57.720 17.600 17.530 1.00 0.00 ATOM 28022 OH2 SOL 4136 33.840 49.730 9.450 1.00 0.00 ATOM 28023 H1 SOL 4136 33.110 49.750 8.840 1.00 0.00 ATOM 28024 H2 SOL 4136 34.010 48.800 9.600 1.00 0.00 ATOM 28025 OH2 SOL 4137 49.050 13.520 72.900 1.00 0.00 ATOM 28026 H1 SOL 4137 49.250 14.170 73.570 1.00 0.00 ATOM 28027 H2 SOL 4137 49.670 12.810 73.070 1.00 0.00 ATOM 28028 OH2 SOL 4138 25.280 34.260 13.250 1.00 0.00 ATOM 28029 H1 SOL 4138 25.740 33.450 13.450 1.00 0.00 ATOM 28030 H2 SOL 4138 25.770 34.930 13.730 1.00 0.00 ATOM 28031 OH2 SOL 4139 56.160 10.180 9.640 1.00 0.00 ATOM 28032 H1 SOL 4139 55.660 9.470 9.250 1.00 0.00 ATOM 28033 H2 SOL 4139 57.030 9.820 9.780 1.00 0.00 ATOM 28034 OH2 SOL 4140 44.760 38.730 3.430 1.00 0.00 ATOM 28035 H1 SOL 4140 44.940 38.090 4.120 1.00 0.00 ATOM 28036 H2 SOL 4140 45.540 39.290 3.410 1.00 0.00 ATOM 28037 OH2 SOL 4141 50.660 34.790 4.370 1.00 0.00 ATOM 28038 H1 SOL 4141 50.770 34.660 3.430 1.00 0.00 ATOM 28039 H2 SOL 4141 51.530 35.080 4.670 1.00 0.00 ATOM 28040 OH2 SOL 4142 25.490 30.340 66.960 1.00 0.00 ATOM 28041 H1 SOL 4142 25.240 29.450 66.720 1.00 0.00 ATOM 28042 H2 SOL 4142 25.210 30.440 67.870 1.00 0.00 ATOM 28043 OH2 SOL 4143 57.580 49.460 83.730 1.00 0.00 ATOM 28044 H1 SOL 4143 58.520 49.300 83.800 1.00 0.00 ATOM 28045 H2 SOL 4143 57.400 50.150 84.370 1.00 0.00 ATOM 28046 OH2 SOL 4144 21.600 27.340 15.060 1.00 0.00 ATOM 28047 H1 SOL 4144 20.920 27.110 14.430 1.00 0.00 ATOM 28048 H2 SOL 4144 22.420 27.210 14.600 1.00 0.00 ATOM 28049 OH2 SOL 4145 49.170 17.180 72.790 1.00 0.00 ATOM 28050 H1 SOL 4145 48.290 17.570 72.830 1.00 0.00 ATOM 28051 H2 SOL 4145 49.620 17.540 73.560 1.00 0.00 ATOM 28052 OH2 SOL 4146 18.120 38.450 67.140 1.00 0.00 ATOM 28053 H1 SOL 4146 17.970 38.780 68.030 1.00 0.00 ATOM 28054 H2 SOL 4146 18.900 37.910 67.220 1.00 0.00 ATOM 28055 OH2 SOL 4147 56.560 5.430 21.520 1.00 0.00 ATOM 28056 H1 SOL 4147 56.890 6.160 21.010 1.00 0.00 ATOM 28057 H2 SOL 4147 55.940 4.990 20.940 1.00 0.00 ATOM 28058 OH2 SOL 4148 14.740 12.030 7.310 1.00 0.00 ATOM 28059 H1 SOL 4148 15.110 12.840 6.970 1.00 0.00 ATOM 28060 H2 SOL 4148 13.840 12.010 6.980 1.00 0.00 ATOM 28061 OH2 SOL 4149 23.520 53.680 13.740 1.00 0.00 ATOM 28062 H1 SOL 4149 24.410 53.410 13.540 1.00 0.00 ATOM 28063 H2 SOL 4149 23.470 54.590 13.460 1.00 0.00 ATOM 28064 OH2 SOL 4150 0.650 49.350 80.920 1.00 0.00 ATOM 28065 H1 SOL 4150 0.890 49.610 80.040 1.00 0.00 ATOM 28066 H2 SOL 4150 -0.300 49.440 80.950 1.00 0.00 ATOM 28067 OH2 SOL 4151 52.350 29.730 7.840 1.00 0.00 ATOM 28068 H1 SOL 4151 52.810 29.440 7.050 1.00 0.00 ATOM 28069 H2 SOL 4151 52.210 28.930 8.350 1.00 0.00 ATOM 28070 OH2 SOL 4152 58.000 31.250 81.590 1.00 0.00 ATOM 28071 H1 SOL 4152 57.950 31.690 80.740 1.00 0.00 ATOM 28072 H2 SOL 4152 57.220 30.700 81.620 1.00 0.00 ATOM 28073 OH2 SOL 4153 10.690 57.040 21.220 1.00 0.00 ATOM 28074 H1 SOL 4153 10.130 57.400 20.530 1.00 0.00 ATOM 28075 H2 SOL 4153 11.420 57.650 21.270 1.00 0.00 ATOM 28076 OH2 SOL 4154 44.710 28.380 11.090 1.00 0.00 ATOM 28077 H1 SOL 4154 45.330 28.680 10.430 1.00 0.00 ATOM 28078 H2 SOL 4154 45.150 27.630 11.500 1.00 0.00 ATOM 28079 OH2 SOL 4155 9.150 7.100 19.230 1.00 0.00 ATOM 28080 H1 SOL 4155 10.020 7.460 19.380 1.00 0.00 ATOM 28081 H2 SOL 4155 8.610 7.870 19.010 1.00 0.00 ATOM 28082 OH2 SOL 4156 26.930 55.970 1.270 1.00 0.00 ATOM 28083 H1 SOL 4156 26.700 56.360 2.120 1.00 0.00 ATOM 28084 H2 SOL 4156 26.100 55.930 0.800 1.00 0.00 ATOM 28085 OH2 SOL 4157 23.410 34.290 75.240 1.00 0.00 ATOM 28086 H1 SOL 4157 22.590 34.660 75.560 1.00 0.00 ATOM 28087 H2 SOL 4157 24.080 34.620 75.840 1.00 0.00 ATOM 28088 OH2 SOL 4158 28.760 11.740 76.900 1.00 0.00 ATOM 28089 H1 SOL 4158 28.690 12.510 76.340 1.00 0.00 ATOM 28090 H2 SOL 4158 29.350 11.150 76.430 1.00 0.00 ATOM 28091 OH2 SOL 4159 8.490 47.540 77.430 1.00 0.00 ATOM 28092 H1 SOL 4159 8.820 48.140 78.090 1.00 0.00 ATOM 28093 H2 SOL 4159 7.590 47.830 77.280 1.00 0.00 ATOM 28094 OH2 SOL 4160 25.680 50.660 12.680 1.00 0.00 ATOM 28095 H1 SOL 4160 26.320 50.210 12.130 1.00 0.00 ATOM 28096 H2 SOL 4160 25.870 51.590 12.550 1.00 0.00 ATOM 28097 OH2 SOL 4161 47.330 27.310 5.810 1.00 0.00 ATOM 28098 H1 SOL 4161 47.510 28.180 6.170 1.00 0.00 ATOM 28099 H2 SOL 4161 47.240 26.750 6.580 1.00 0.00 ATOM 28100 OH2 SOL 4162 17.090 1.470 83.540 1.00 0.00 ATOM 28101 H1 SOL 4162 17.230 1.400 84.480 1.00 0.00 ATOM 28102 H2 SOL 4162 17.740 0.890 83.150 1.00 0.00 ATOM 28103 OH2 SOL 4163 47.360 31.380 73.980 1.00 0.00 ATOM 28104 H1 SOL 4163 48.000 31.200 73.300 1.00 0.00 ATOM 28105 H2 SOL 4163 47.660 30.890 74.740 1.00 0.00 ATOM 28106 OH2 SOL 4164 26.240 17.590 12.740 1.00 0.00 ATOM 28107 H1 SOL 4164 25.970 16.670 12.810 1.00 0.00 ATOM 28108 H2 SOL 4164 26.060 17.830 11.830 1.00 0.00 ATOM 28109 OH2 SOL 4165 21.710 29.890 2.800 1.00 0.00 ATOM 28110 H1 SOL 4165 22.360 29.600 3.440 1.00 0.00 ATOM 28111 H2 SOL 4165 21.500 29.110 2.290 1.00 0.00 ATOM 28112 OH2 SOL 4166 40.950 42.540 4.280 1.00 0.00 ATOM 28113 H1 SOL 4166 40.780 43.350 4.750 1.00 0.00 ATOM 28114 H2 SOL 4166 40.150 42.370 3.780 1.00 0.00 ATOM 28115 OH2 SOL 4167 56.560 23.370 73.600 1.00 0.00 ATOM 28116 H1 SOL 4167 55.620 23.340 73.790 1.00 0.00 ATOM 28117 H2 SOL 4167 56.650 22.930 72.760 1.00 0.00 ATOM 28118 OH2 SOL 4168 23.540 1.450 82.480 1.00 0.00 ATOM 28119 H1 SOL 4168 23.500 0.700 83.070 1.00 0.00 ATOM 28120 H2 SOL 4168 22.640 1.770 82.420 1.00 0.00 ATOM 28121 OH2 SOL 4169 8.340 39.230 14.670 1.00 0.00 ATOM 28122 H1 SOL 4169 8.880 38.450 14.770 1.00 0.00 ATOM 28123 H2 SOL 4169 7.570 39.060 15.210 1.00 0.00 ATOM 28124 OH2 SOL 4170 44.390 36.630 69.490 1.00 0.00 ATOM 28125 H1 SOL 4170 43.630 36.160 69.840 1.00 0.00 ATOM 28126 H2 SOL 4170 44.950 36.780 70.250 1.00 0.00 ATOM 28127 OH2 SOL 4171 46.220 11.600 2.520 1.00 0.00 ATOM 28128 H1 SOL 4171 45.280 11.510 2.320 1.00 0.00 ATOM 28129 H2 SOL 4171 46.590 10.750 2.260 1.00 0.00 ATOM 28130 OH2 SOL 4172 31.110 23.800 5.630 1.00 0.00 ATOM 28131 H1 SOL 4172 31.940 23.330 5.750 1.00 0.00 ATOM 28132 H2 SOL 4172 30.630 23.640 6.450 1.00 0.00 ATOM 28133 OH2 SOL 4173 8.370 47.420 2.980 1.00 0.00 ATOM 28134 H1 SOL 4173 7.630 47.460 3.590 1.00 0.00 ATOM 28135 H2 SOL 4173 7.960 47.480 2.120 1.00 0.00 ATOM 28136 OH2 SOL 4174 10.050 10.000 64.060 1.00 0.00 ATOM 28137 H1 SOL 4174 9.860 9.830 63.130 1.00 0.00 ATOM 28138 H2 SOL 4174 9.800 9.190 64.510 1.00 0.00 ATOM 28139 OH2 SOL 4175 28.160 8.340 7.590 1.00 0.00 ATOM 28140 H1 SOL 4175 27.630 8.010 6.870 1.00 0.00 ATOM 28141 H2 SOL 4175 28.520 7.550 7.990 1.00 0.00 ATOM 28142 OH2 SOL 4176 15.170 47.070 8.630 1.00 0.00 ATOM 28143 H1 SOL 4176 15.700 46.810 9.390 1.00 0.00 ATOM 28144 H2 SOL 4176 15.800 47.410 8.000 1.00 0.00 ATOM 28145 OH2 SOL 4177 36.910 43.950 63.930 1.00 0.00 ATOM 28146 H1 SOL 4177 36.470 43.740 64.750 1.00 0.00 ATOM 28147 H2 SOL 4177 37.350 44.780 64.090 1.00 0.00 ATOM 28148 OH2 SOL 4178 44.300 44.930 27.310 1.00 0.00 ATOM 28149 H1 SOL 4178 44.700 44.360 27.970 1.00 0.00 ATOM 28150 H2 SOL 4178 43.560 44.420 26.970 1.00 0.00 ATOM 28151 OH2 SOL 4179 27.040 35.610 79.100 1.00 0.00 ATOM 28152 H1 SOL 4179 27.920 35.530 78.720 1.00 0.00 ATOM 28153 H2 SOL 4179 26.800 36.530 78.960 1.00 0.00 ATOM 28154 OH2 SOL 4180 57.360 41.830 76.850 1.00 0.00 ATOM 28155 H1 SOL 4180 56.550 41.310 76.860 1.00 0.00 ATOM 28156 H2 SOL 4180 57.500 42.020 75.920 1.00 0.00 ATOM 28157 OH2 SOL 4181 46.830 4.540 15.200 1.00 0.00 ATOM 28158 H1 SOL 4181 45.890 4.710 15.270 1.00 0.00 ATOM 28159 H2 SOL 4181 47.130 4.470 16.110 1.00 0.00 ATOM 28160 OH2 SOL 4182 56.770 23.500 66.780 1.00 0.00 ATOM 28161 H1 SOL 4182 55.900 23.490 66.370 1.00 0.00 ATOM 28162 H2 SOL 4182 57.030 24.430 66.760 1.00 0.00 ATOM 28163 OH2 SOL 4183 45.860 12.740 18.540 1.00 0.00 ATOM 28164 H1 SOL 4183 46.600 13.100 19.030 1.00 0.00 ATOM 28165 H2 SOL 4183 45.250 13.470 18.450 1.00 0.00 ATOM 28166 OH2 SOL 4184 30.800 0.480 4.960 1.00 0.00 ATOM 28167 H1 SOL 4184 30.810 1.090 4.220 1.00 0.00 ATOM 28168 H2 SOL 4184 31.190 -0.330 4.600 1.00 0.00 ATOM 28169 OH2 SOL 4185 17.720 52.780 14.840 1.00 0.00 ATOM 28170 H1 SOL 4185 16.780 52.620 14.730 1.00 0.00 ATOM 28171 H2 SOL 4185 17.890 53.550 14.300 1.00 0.00 ATOM 28172 OH2 SOL 4186 15.810 41.800 4.640 1.00 0.00 ATOM 28173 H1 SOL 4186 16.220 42.660 4.520 1.00 0.00 ATOM 28174 H2 SOL 4186 16.280 41.410 5.380 1.00 0.00 ATOM 28175 OH2 SOL 4187 28.410 57.260 16.490 1.00 0.00 ATOM 28176 H1 SOL 4187 29.240 56.880 16.790 1.00 0.00 ATOM 28177 H2 SOL 4187 28.650 58.130 16.170 1.00 0.00 ATOM 28178 OH2 SOL 4188 34.150 47.990 11.590 1.00 0.00 ATOM 28179 H1 SOL 4188 34.450 48.750 12.100 1.00 0.00 ATOM 28180 H2 SOL 4188 33.210 47.960 11.750 1.00 0.00 ATOM 28181 OH2 SOL 4189 8.670 25.450 73.990 1.00 0.00 ATOM 28182 H1 SOL 4189 7.960 26.040 74.250 1.00 0.00 ATOM 28183 H2 SOL 4189 9.410 25.710 74.540 1.00 0.00 ATOM 28184 OH2 SOL 4190 10.960 15.190 2.380 1.00 0.00 ATOM 28185 H1 SOL 4190 11.560 15.390 3.100 1.00 0.00 ATOM 28186 H2 SOL 4190 11.090 14.260 2.210 1.00 0.00 ATOM 28187 OH2 SOL 4191 43.960 42.730 4.470 1.00 0.00 ATOM 28188 H1 SOL 4191 43.420 42.070 4.900 1.00 0.00 ATOM 28189 H2 SOL 4191 44.100 43.410 5.130 1.00 0.00 ATOM 28190 OH2 SOL 4192 43.220 18.130 5.820 1.00 0.00 ATOM 28191 H1 SOL 4192 43.580 18.550 6.610 1.00 0.00 ATOM 28192 H2 SOL 4192 42.480 17.610 6.150 1.00 0.00 ATOM 28193 OH2 SOL 4193 11.990 44.100 79.670 1.00 0.00 ATOM 28194 H1 SOL 4193 11.520 43.320 79.980 1.00 0.00 ATOM 28195 H2 SOL 4193 11.420 44.470 79.000 1.00 0.00 ATOM 28196 OH2 SOL 4194 49.970 30.310 68.680 1.00 0.00 ATOM 28197 H1 SOL 4194 49.500 29.530 68.970 1.00 0.00 ATOM 28198 H2 SOL 4194 50.710 29.980 68.180 1.00 0.00 ATOM 28199 OH2 SOL 4195 1.080 38.290 69.330 1.00 0.00 ATOM 28200 H1 SOL 4195 0.640 37.870 68.600 1.00 0.00 ATOM 28201 H2 SOL 4195 0.390 38.790 69.770 1.00 0.00 ATOM 28202 OH2 SOL 4196 12.700 4.820 82.780 1.00 0.00 ATOM 28203 H1 SOL 4196 12.390 3.920 82.690 1.00 0.00 ATOM 28204 H2 SOL 4196 13.650 4.740 82.840 1.00 0.00 ATOM 28205 OH2 SOL 4197 22.470 38.560 66.750 1.00 0.00 ATOM 28206 H1 SOL 4197 21.900 39.290 66.520 1.00 0.00 ATOM 28207 H2 SOL 4197 21.870 37.900 67.110 1.00 0.00 ATOM 28208 OH2 SOL 4198 42.090 35.400 3.200 1.00 0.00 ATOM 28209 H1 SOL 4198 42.110 36.170 2.650 1.00 0.00 ATOM 28210 H2 SOL 4198 42.330 35.720 4.070 1.00 0.00 ATOM 28211 OH2 SOL 4199 4.390 26.650 18.960 1.00 0.00 ATOM 28212 H1 SOL 4199 4.230 27.210 19.720 1.00 0.00 ATOM 28213 H2 SOL 4199 3.700 26.870 18.340 1.00 0.00 ATOM 28214 OH2 SOL 4200 57.760 49.510 72.280 1.00 0.00 ATOM 28215 H1 SOL 4200 57.970 49.510 73.210 1.00 0.00 ATOM 28216 H2 SOL 4200 58.570 49.250 71.850 1.00 0.00 ATOM 28217 OH2 SOL 4201 44.360 15.830 0.830 1.00 0.00 ATOM 28218 H1 SOL 4201 43.520 15.420 1.080 1.00 0.00 ATOM 28219 H2 SOL 4201 45.000 15.130 0.930 1.00 0.00 ATOM 28220 OH2 SOL 4202 35.650 37.320 83.590 1.00 0.00 ATOM 28221 H1 SOL 4202 36.040 37.420 82.730 1.00 0.00 ATOM 28222 H2 SOL 4202 35.040 36.590 83.500 1.00 0.00 ATOM 28223 OH2 SOL 4203 1.950 32.650 2.510 1.00 0.00 ATOM 28224 H1 SOL 4203 1.320 33.060 1.910 1.00 0.00 ATOM 28225 H2 SOL 4203 1.490 31.870 2.830 1.00 0.00 ATOM 28226 OH2 SOL 4204 22.020 37.760 71.450 1.00 0.00 ATOM 28227 H1 SOL 4204 21.700 36.930 71.800 1.00 0.00 ATOM 28228 H2 SOL 4204 22.970 37.630 71.360 1.00 0.00 ATOM 28229 OH2 SOL 4205 56.210 15.900 71.500 1.00 0.00 ATOM 28230 H1 SOL 4205 57.100 15.590 71.700 1.00 0.00 ATOM 28231 H2 SOL 4205 55.640 15.290 71.950 1.00 0.00 ATOM 28232 OH2 SOL 4206 16.860 10.300 68.940 1.00 0.00 ATOM 28233 H1 SOL 4206 16.510 10.040 68.080 1.00 0.00 ATOM 28234 H2 SOL 4206 17.610 10.850 68.740 1.00 0.00 ATOM 28235 OH2 SOL 4207 4.670 7.700 80.090 1.00 0.00 ATOM 28236 H1 SOL 4207 4.330 7.100 80.770 1.00 0.00 ATOM 28237 H2 SOL 4207 5.610 7.540 80.080 1.00 0.00 ATOM 28238 OH2 SOL 4208 13.860 22.200 1.990 1.00 0.00 ATOM 28239 H1 SOL 4208 13.730 23.140 2.030 1.00 0.00 ATOM 28240 H2 SOL 4208 12.980 21.840 1.920 1.00 0.00 ATOM 28241 OH2 SOL 4209 6.010 4.720 61.540 1.00 0.00 ATOM 28242 H1 SOL 4209 5.800 4.090 62.230 1.00 0.00 ATOM 28243 H2 SOL 4209 5.500 4.440 60.790 1.00 0.00 ATOM 28244 OH2 SOL 4210 44.480 17.510 78.680 1.00 0.00 ATOM 28245 H1 SOL 4210 45.050 17.920 79.330 1.00 0.00 ATOM 28246 H2 SOL 4210 43.710 18.080 78.650 1.00 0.00 ATOM 28247 OH2 SOL 4211 23.040 48.210 67.450 1.00 0.00 ATOM 28248 H1 SOL 4211 22.530 48.790 68.010 1.00 0.00 ATOM 28249 H2 SOL 4211 23.190 48.720 66.650 1.00 0.00 ATOM 28250 OH2 SOL 4212 9.530 17.770 62.190 1.00 0.00 ATOM 28251 H1 SOL 4212 8.940 17.020 62.230 1.00 0.00 ATOM 28252 H2 SOL 4212 9.630 17.940 61.260 1.00 0.00 ATOM 28253 OH2 SOL 4213 32.210 15.880 16.340 1.00 0.00 ATOM 28254 H1 SOL 4213 32.550 15.020 16.600 1.00 0.00 ATOM 28255 H2 SOL 4213 32.950 16.310 15.920 1.00 0.00 ATOM 28256 OH2 SOL 4214 44.580 9.660 72.270 1.00 0.00 ATOM 28257 H1 SOL 4214 44.560 9.710 71.320 1.00 0.00 ATOM 28258 H2 SOL 4214 45.090 8.870 72.460 1.00 0.00 ATOM 28259 OH2 SOL 4215 58.140 38.930 69.540 1.00 0.00 ATOM 28260 H1 SOL 4215 57.320 39.420 69.470 1.00 0.00 ATOM 28261 H2 SOL 4215 57.930 38.060 69.220 1.00 0.00 ATOM 28262 OH2 SOL 4216 57.880 55.430 21.290 1.00 0.00 ATOM 28263 H1 SOL 4216 57.070 55.910 21.140 1.00 0.00 ATOM 28264 H2 SOL 4216 57.590 54.520 21.390 1.00 0.00 ATOM 28265 OH2 SOL 4217 54.160 37.180 70.120 1.00 0.00 ATOM 28266 H1 SOL 4217 54.740 37.680 69.550 1.00 0.00 ATOM 28267 H2 SOL 4217 53.630 36.660 69.520 1.00 0.00 ATOM 28268 OH2 SOL 4218 42.060 17.700 73.940 1.00 0.00 ATOM 28269 H1 SOL 4218 43.020 17.650 73.850 1.00 0.00 ATOM 28270 H2 SOL 4218 41.920 18.030 74.830 1.00 0.00 ATOM 28271 OH2 SOL 4219 57.160 27.800 12.410 1.00 0.00 ATOM 28272 H1 SOL 4219 57.310 28.610 12.900 1.00 0.00 ATOM 28273 H2 SOL 4219 57.020 27.130 13.080 1.00 0.00 ATOM 28274 OH2 SOL 4220 5.200 8.720 67.400 1.00 0.00 ATOM 28275 H1 SOL 4220 5.410 8.220 66.610 1.00 0.00 ATOM 28276 H2 SOL 4220 4.520 8.200 67.830 1.00 0.00 ATOM 28277 OH2 SOL 4221 18.370 6.340 67.800 1.00 0.00 ATOM 28278 H1 SOL 4221 19.060 5.710 67.610 1.00 0.00 ATOM 28279 H2 SOL 4221 18.600 6.690 68.660 1.00 0.00 ATOM 28280 OH2 SOL 4222 16.760 46.960 10.980 1.00 0.00 ATOM 28281 H1 SOL 4222 17.200 47.810 10.980 1.00 0.00 ATOM 28282 H2 SOL 4222 16.680 46.720 11.900 1.00 0.00 ATOM 28283 OH2 SOL 4223 35.020 29.290 4.340 1.00 0.00 ATOM 28284 H1 SOL 4223 34.940 30.240 4.240 1.00 0.00 ATOM 28285 H2 SOL 4223 35.970 29.130 4.350 1.00 0.00 ATOM 28286 OH2 SOL 4224 36.620 55.270 65.050 1.00 0.00 ATOM 28287 H1 SOL 4224 36.520 55.210 64.100 1.00 0.00 ATOM 28288 H2 SOL 4224 36.190 54.480 65.380 1.00 0.00 ATOM 28289 OH2 SOL 4225 50.620 47.710 62.880 1.00 0.00 ATOM 28290 H1 SOL 4225 51.460 47.580 62.450 1.00 0.00 ATOM 28291 H2 SOL 4225 50.090 46.960 62.600 1.00 0.00 ATOM 28292 OH2 SOL 4226 12.790 23.610 18.200 1.00 0.00 ATOM 28293 H1 SOL 4226 12.980 24.040 17.370 1.00 0.00 ATOM 28294 H2 SOL 4226 12.080 24.130 18.580 1.00 0.00 ATOM 28295 OH2 SOL 4227 46.330 25.590 21.680 1.00 0.00 ATOM 28296 H1 SOL 4227 47.290 25.630 21.740 1.00 0.00 ATOM 28297 H2 SOL 4227 46.170 24.840 21.090 1.00 0.00 ATOM 28298 OH2 SOL 4228 44.410 51.700 73.320 1.00 0.00 ATOM 28299 H1 SOL 4228 43.680 51.070 73.290 1.00 0.00 ATOM 28300 H2 SOL 4228 45.090 51.240 73.810 1.00 0.00 ATOM 28301 OH2 SOL 4229 22.060 14.400 71.720 1.00 0.00 ATOM 28302 H1 SOL 4229 21.910 14.680 72.620 1.00 0.00 ATOM 28303 H2 SOL 4229 21.730 15.120 71.190 1.00 0.00 ATOM 28304 OH2 SOL 4230 26.740 27.390 71.200 1.00 0.00 ATOM 28305 H1 SOL 4230 26.120 28.120 71.320 1.00 0.00 ATOM 28306 H2 SOL 4230 26.710 26.910 72.030 1.00 0.00 ATOM 28307 OH2 SOL 4231 38.640 32.090 65.510 1.00 0.00 ATOM 28308 H1 SOL 4231 38.150 32.350 64.730 1.00 0.00 ATOM 28309 H2 SOL 4231 39.540 32.340 65.310 1.00 0.00 ATOM 28310 OH2 SOL 4232 9.620 49.170 20.170 1.00 0.00 ATOM 28311 H1 SOL 4232 9.130 49.090 19.350 1.00 0.00 ATOM 28312 H2 SOL 4232 10.120 49.990 20.070 1.00 0.00 ATOM 28313 OH2 SOL 4233 47.250 51.760 70.780 1.00 0.00 ATOM 28314 H1 SOL 4233 47.130 52.090 69.880 1.00 0.00 ATOM 28315 H2 SOL 4233 46.810 52.410 71.330 1.00 0.00 ATOM 28316 OH2 SOL 4234 51.530 33.630 63.640 1.00 0.00 ATOM 28317 H1 SOL 4234 51.620 32.960 64.320 1.00 0.00 ATOM 28318 H2 SOL 4234 50.820 34.200 63.950 1.00 0.00 ATOM 28319 OH2 SOL 4235 33.510 43.820 4.150 1.00 0.00 ATOM 28320 H1 SOL 4235 32.640 44.000 3.810 1.00 0.00 ATOM 28321 H2 SOL 4235 34.090 43.960 3.400 1.00 0.00 ATOM 28322 OH2 SOL 4236 47.610 20.130 16.250 1.00 0.00 ATOM 28323 H1 SOL 4236 48.170 19.970 17.010 1.00 0.00 ATOM 28324 H2 SOL 4236 47.750 21.060 16.040 1.00 0.00 ATOM 28325 OH2 SOL 4237 34.350 52.680 80.800 1.00 0.00 ATOM 28326 H1 SOL 4237 34.130 52.880 79.890 1.00 0.00 ATOM 28327 H2 SOL 4237 34.030 51.790 80.940 1.00 0.00 ATOM 28328 OH2 SOL 4238 49.820 38.130 69.320 1.00 0.00 ATOM 28329 H1 SOL 4238 50.370 38.100 70.100 1.00 0.00 ATOM 28330 H2 SOL 4238 48.930 38.000 69.650 1.00 0.00 ATOM 28331 OH2 SOL 4239 13.940 47.680 11.440 1.00 0.00 ATOM 28332 H1 SOL 4239 14.760 47.450 11.000 1.00 0.00 ATOM 28333 H2 SOL 4239 13.340 46.960 11.200 1.00 0.00 ATOM 28334 OH2 SOL 4240 43.330 47.370 20.760 1.00 0.00 ATOM 28335 H1 SOL 4240 42.700 47.500 21.480 1.00 0.00 ATOM 28336 H2 SOL 4240 43.980 48.050 20.890 1.00 0.00 ATOM 28337 OH2 SOL 4241 24.610 27.630 68.620 1.00 0.00 ATOM 28338 H1 SOL 4241 24.680 26.700 68.820 1.00 0.00 ATOM 28339 H2 SOL 4241 24.880 27.710 67.700 1.00 0.00 ATOM 28340 OH2 SOL 4242 37.490 4.520 83.050 1.00 0.00 ATOM 28341 H1 SOL 4242 37.430 3.900 82.320 1.00 0.00 ATOM 28342 H2 SOL 4242 38.080 5.200 82.740 1.00 0.00 ATOM 28343 OH2 SOL 4243 17.740 43.070 82.730 1.00 0.00 ATOM 28344 H1 SOL 4243 17.440 42.790 83.600 1.00 0.00 ATOM 28345 H2 SOL 4243 18.680 43.170 82.830 1.00 0.00 ATOM 28346 OH2 SOL 4244 5.130 27.610 69.850 1.00 0.00 ATOM 28347 H1 SOL 4244 4.760 27.620 70.730 1.00 0.00 ATOM 28348 H2 SOL 4244 5.490 28.490 69.730 1.00 0.00 ATOM 28349 OH2 SOL 4245 46.330 22.440 2.860 1.00 0.00 ATOM 28350 H1 SOL 4245 45.740 22.630 3.590 1.00 0.00 ATOM 28351 H2 SOL 4245 47.200 22.720 3.180 1.00 0.00 ATOM 28352 OH2 SOL 4246 30.760 29.890 66.130 1.00 0.00 ATOM 28353 H1 SOL 4246 30.160 30.550 65.770 1.00 0.00 ATOM 28354 H2 SOL 4246 30.700 29.160 65.520 1.00 0.00 ATOM 28355 OH2 SOL 4247 59.270 7.710 20.440 1.00 0.00 ATOM 28356 H1 SOL 4247 59.420 8.650 20.370 1.00 0.00 ATOM 28357 H2 SOL 4247 59.900 7.410 21.090 1.00 0.00 ATOM 28358 OH2 SOL 4248 3.500 29.860 3.650 1.00 0.00 ATOM 28359 H1 SOL 4248 3.610 30.420 4.430 1.00 0.00 ATOM 28360 H2 SOL 4248 4.370 29.830 3.260 1.00 0.00 ATOM 28361 OH2 SOL 4249 14.260 0.710 60.100 1.00 0.00 ATOM 28362 H1 SOL 4249 14.980 1.090 60.600 1.00 0.00 ATOM 28363 H2 SOL 4249 13.610 1.410 60.030 1.00 0.00 ATOM 28364 OH2 SOL 4250 21.360 53.680 12.320 1.00 0.00 ATOM 28365 H1 SOL 4250 21.380 54.540 11.910 1.00 0.00 ATOM 28366 H2 SOL 4250 22.140 53.670 12.890 1.00 0.00 ATOM 28367 OH2 SOL 4251 45.630 53.870 69.180 1.00 0.00 ATOM 28368 H1 SOL 4251 45.250 54.650 68.790 1.00 0.00 ATOM 28369 H2 SOL 4251 44.910 53.460 69.660 1.00 0.00 ATOM 28370 OH2 SOL 4252 38.130 43.670 18.670 1.00 0.00 ATOM 28371 H1 SOL 4252 38.740 44.410 18.630 1.00 0.00 ATOM 28372 H2 SOL 4252 37.270 44.070 18.730 1.00 0.00 ATOM 28373 OH2 SOL 4253 52.760 7.280 66.470 1.00 0.00 ATOM 28374 H1 SOL 4253 53.140 8.030 66.920 1.00 0.00 ATOM 28375 H2 SOL 4253 53.020 6.520 66.990 1.00 0.00 ATOM 28376 OH2 SOL 4254 45.980 47.100 59.900 1.00 0.00 ATOM 28377 H1 SOL 4254 45.970 46.990 60.850 1.00 0.00 ATOM 28378 H2 SOL 4254 45.250 47.680 59.710 1.00 0.00 ATOM 28379 OH2 SOL 4255 13.800 33.750 10.720 1.00 0.00 ATOM 28380 H1 SOL 4255 13.700 33.180 9.970 1.00 0.00 ATOM 28381 H2 SOL 4255 14.610 34.240 10.560 1.00 0.00 ATOM 28382 OH2 SOL 4256 17.670 10.380 80.120 1.00 0.00 ATOM 28383 H1 SOL 4256 16.740 10.420 80.340 1.00 0.00 ATOM 28384 H2 SOL 4256 18.040 9.760 80.750 1.00 0.00 ATOM 28385 OH2 SOL 4257 10.570 20.380 72.200 1.00 0.00 ATOM 28386 H1 SOL 4257 9.840 20.700 72.730 1.00 0.00 ATOM 28387 H2 SOL 4257 11.340 20.500 72.750 1.00 0.00 ATOM 28388 OH2 SOL 4258 53.500 43.380 82.920 1.00 0.00 ATOM 28389 H1 SOL 4258 54.280 42.970 83.300 1.00 0.00 ATOM 28390 H2 SOL 4258 53.820 43.820 82.130 1.00 0.00 ATOM 28391 OH2 SOL 4259 16.370 28.840 5.270 1.00 0.00 ATOM 28392 H1 SOL 4259 16.000 28.310 4.560 1.00 0.00 ATOM 28393 H2 SOL 4259 17.310 28.660 5.240 1.00 0.00 ATOM 28394 OH2 SOL 4260 37.550 27.000 2.780 1.00 0.00 ATOM 28395 H1 SOL 4260 37.200 27.750 2.310 1.00 0.00 ATOM 28396 H2 SOL 4260 38.450 27.250 3.000 1.00 0.00 ATOM 28397 OH2 SOL 4261 41.310 34.200 20.020 1.00 0.00 ATOM 28398 H1 SOL 4261 41.480 33.660 19.240 1.00 0.00 ATOM 28399 H2 SOL 4261 41.430 35.100 19.730 1.00 0.00 ATOM 28400 OH2 SOL 4262 4.190 10.730 76.210 1.00 0.00 ATOM 28401 H1 SOL 4262 4.860 10.290 76.720 1.00 0.00 ATOM 28402 H2 SOL 4262 4.660 11.080 75.450 1.00 0.00 ATOM 28403 OH2 SOL 4263 45.510 37.070 77.140 1.00 0.00 ATOM 28404 H1 SOL 4263 45.440 37.550 76.320 1.00 0.00 ATOM 28405 H2 SOL 4263 45.570 37.750 77.810 1.00 0.00 ATOM 28406 OH2 SOL 4264 29.800 20.980 75.030 1.00 0.00 ATOM 28407 H1 SOL 4264 29.630 20.260 74.420 1.00 0.00 ATOM 28408 H2 SOL 4264 30.720 21.200 74.890 1.00 0.00 ATOM 28409 OH2 SOL 4265 28.700 23.520 81.050 1.00 0.00 ATOM 28410 H1 SOL 4265 28.820 24.060 81.830 1.00 0.00 ATOM 28411 H2 SOL 4265 29.590 23.320 80.760 1.00 0.00 ATOM 28412 OH2 SOL 4266 7.270 2.610 26.020 1.00 0.00 ATOM 28413 H1 SOL 4266 8.180 2.430 26.220 1.00 0.00 ATOM 28414 H2 SOL 4266 7.200 3.560 26.010 1.00 0.00 ATOM 28415 OH2 SOL 4267 55.750 24.790 11.050 1.00 0.00 ATOM 28416 H1 SOL 4267 56.090 23.890 11.150 1.00 0.00 ATOM 28417 H2 SOL 4267 55.480 25.040 11.930 1.00 0.00 ATOM 28418 OH2 SOL 4268 15.470 15.440 76.980 1.00 0.00 ATOM 28419 H1 SOL 4268 15.930 14.760 77.470 1.00 0.00 ATOM 28420 H2 SOL 4268 15.650 15.250 76.070 1.00 0.00 ATOM 28421 OH2 SOL 4269 38.700 57.900 6.160 1.00 0.00 ATOM 28422 H1 SOL 4269 39.650 57.960 6.190 1.00 0.00 ATOM 28423 H2 SOL 4269 38.470 57.210 6.780 1.00 0.00 ATOM 28424 OH2 SOL 4270 27.310 27.430 80.260 1.00 0.00 ATOM 28425 H1 SOL 4270 28.260 27.360 80.310 1.00 0.00 ATOM 28426 H2 SOL 4270 27.090 27.030 79.420 1.00 0.00 ATOM 28427 OH2 SOL 4271 49.070 50.510 1.600 1.00 0.00 ATOM 28428 H1 SOL 4271 49.090 49.560 1.640 1.00 0.00 ATOM 28429 H2 SOL 4271 48.320 50.770 2.130 1.00 0.00 ATOM 28430 OH2 SOL 4272 54.750 23.400 22.740 1.00 0.00 ATOM 28431 H1 SOL 4272 55.460 23.390 23.380 1.00 0.00 ATOM 28432 H2 SOL 4272 55.190 23.570 21.900 1.00 0.00 ATOM 28433 OH2 SOL 4273 12.280 11.460 6.380 1.00 0.00 ATOM 28434 H1 SOL 4273 11.840 11.860 7.130 1.00 0.00 ATOM 28435 H2 SOL 4273 11.580 11.080 5.860 1.00 0.00 ATOM 28436 OH2 SOL 4274 20.690 34.430 10.510 1.00 0.00 ATOM 28437 H1 SOL 4274 21.190 34.790 11.240 1.00 0.00 ATOM 28438 H2 SOL 4274 21.040 33.540 10.400 1.00 0.00 ATOM 28439 OH2 SOL 4275 56.070 49.720 20.360 1.00 0.00 ATOM 28440 H1 SOL 4275 56.910 49.890 19.940 1.00 0.00 ATOM 28441 H2 SOL 4275 55.920 48.780 20.230 1.00 0.00 ATOM 28442 OH2 SOL 4276 29.920 2.770 20.350 1.00 0.00 ATOM 28443 H1 SOL 4276 29.980 3.730 20.350 1.00 0.00 ATOM 28444 H2 SOL 4276 30.500 2.500 19.640 1.00 0.00 ATOM 28445 OH2 SOL 4277 18.020 48.760 21.520 1.00 0.00 ATOM 28446 H1 SOL 4277 18.690 48.190 21.160 1.00 0.00 ATOM 28447 H2 SOL 4277 17.410 48.180 21.970 1.00 0.00 ATOM 28448 OH2 SOL 4278 60.140 49.270 0.300 1.00 0.00 ATOM 28449 H1 SOL 4278 60.630 49.370 1.120 1.00 0.00 ATOM 28450 H2 SOL 4278 60.700 48.710 -0.240 1.00 0.00 ATOM 28451 OH2 SOL 4279 48.370 13.490 60.400 1.00 0.00 ATOM 28452 H1 SOL 4279 47.560 12.990 60.250 1.00 0.00 ATOM 28453 H2 SOL 4279 48.450 14.050 59.640 1.00 0.00 ATOM 28454 OH2 SOL 4280 54.890 39.110 76.270 1.00 0.00 ATOM 28455 H1 SOL 4280 55.620 38.530 76.500 1.00 0.00 ATOM 28456 H2 SOL 4280 54.890 39.780 76.950 1.00 0.00 ATOM 28457 OH2 SOL 4281 2.840 44.590 9.650 1.00 0.00 ATOM 28458 H1 SOL 4281 2.770 44.480 10.600 1.00 0.00 ATOM 28459 H2 SOL 4281 2.310 43.880 9.290 1.00 0.00 ATOM 28460 OH2 SOL 4282 50.890 16.100 8.510 1.00 0.00 ATOM 28461 H1 SOL 4282 51.800 16.370 8.330 1.00 0.00 ATOM 28462 H2 SOL 4282 50.880 15.160 8.330 1.00 0.00 ATOM 28463 OH2 SOL 4283 44.370 16.930 20.340 1.00 0.00 ATOM 28464 H1 SOL 4283 45.120 16.770 19.770 1.00 0.00 ATOM 28465 H2 SOL 4283 44.320 17.880 20.420 1.00 0.00 ATOM 28466 OH2 SOL 4284 0.480 19.800 2.190 1.00 0.00 ATOM 28467 H1 SOL 4284 0.700 20.180 1.340 1.00 0.00 ATOM 28468 H2 SOL 4284 0.400 18.860 2.030 1.00 0.00 ATOM 28469 OH2 SOL 4285 52.090 45.050 11.370 1.00 0.00 ATOM 28470 H1 SOL 4285 52.830 45.420 10.890 1.00 0.00 ATOM 28471 H2 SOL 4285 52.170 45.420 12.250 1.00 0.00 ATOM 28472 OH2 SOL 4286 41.820 48.470 29.350 1.00 0.00 ATOM 28473 H1 SOL 4286 41.880 47.530 29.210 1.00 0.00 ATOM 28474 H2 SOL 4286 42.080 48.600 30.260 1.00 0.00 ATOM 28475 OH2 SOL 4287 47.450 51.170 67.570 1.00 0.00 ATOM 28476 H1 SOL 4287 48.340 50.800 67.600 1.00 0.00 ATOM 28477 H2 SOL 4287 46.900 50.490 67.970 1.00 0.00 ATOM 28478 OH2 SOL 4288 19.730 9.160 65.370 1.00 0.00 ATOM 28479 H1 SOL 4288 19.540 9.470 66.260 1.00 0.00 ATOM 28480 H2 SOL 4288 20.600 9.510 65.180 1.00 0.00 ATOM 28481 OH2 SOL 4289 56.440 8.270 76.550 1.00 0.00 ATOM 28482 H1 SOL 4289 56.370 9.210 76.390 1.00 0.00 ATOM 28483 H2 SOL 4289 56.150 7.870 75.740 1.00 0.00 ATOM 28484 OH2 SOL 4290 6.110 56.600 1.190 1.00 0.00 ATOM 28485 H1 SOL 4290 5.690 55.830 1.570 1.00 0.00 ATOM 28486 H2 SOL 4290 6.980 56.300 0.930 1.00 0.00 ATOM 28487 OH2 SOL 4291 31.680 40.800 78.690 1.00 0.00 ATOM 28488 H1 SOL 4291 31.820 40.490 77.800 1.00 0.00 ATOM 28489 H2 SOL 4291 30.920 41.380 78.630 1.00 0.00 ATOM 28490 OH2 SOL 4292 52.980 17.630 4.940 1.00 0.00 ATOM 28491 H1 SOL 4292 52.920 18.540 4.660 1.00 0.00 ATOM 28492 H2 SOL 4292 52.070 17.330 4.970 1.00 0.00 ATOM 28493 OH2 SOL 4293 60.080 30.800 78.240 1.00 0.00 ATOM 28494 H1 SOL 4293 60.780 31.420 78.430 1.00 0.00 ATOM 28495 H2 SOL 4293 60.110 30.670 77.290 1.00 0.00 ATOM 28496 OH2 SOL 4294 48.450 49.320 63.490 1.00 0.00 ATOM 28497 H1 SOL 4294 48.260 49.720 62.640 1.00 0.00 ATOM 28498 H2 SOL 4294 48.950 48.530 63.290 1.00 0.00 ATOM 28499 OH2 SOL 4295 34.620 4.870 12.590 1.00 0.00 ATOM 28500 H1 SOL 4295 34.450 4.880 13.530 1.00 0.00 ATOM 28501 H2 SOL 4295 34.960 3.990 12.430 1.00 0.00 ATOM 28502 OH2 SOL 4296 61.280 10.120 79.950 1.00 0.00 ATOM 28503 H1 SOL 4296 60.950 9.220 80.050 1.00 0.00 ATOM 28504 H2 SOL 4296 62.010 10.040 79.350 1.00 0.00 ATOM 28505 OH2 SOL 4297 58.670 12.100 13.550 1.00 0.00 ATOM 28506 H1 SOL 4297 58.230 12.680 12.930 1.00 0.00 ATOM 28507 H2 SOL 4297 59.360 11.680 13.030 1.00 0.00 ATOM 28508 OH2 SOL 4298 49.550 35.590 71.280 1.00 0.00 ATOM 28509 H1 SOL 4298 49.570 34.840 71.890 1.00 0.00 ATOM 28510 H2 SOL 4298 49.970 36.300 71.770 1.00 0.00 ATOM 28511 OH2 SOL 4299 40.650 53.520 2.880 1.00 0.00 ATOM 28512 H1 SOL 4299 39.800 53.910 3.060 1.00 0.00 ATOM 28513 H2 SOL 4299 41.010 53.320 3.750 1.00 0.00 ATOM 28514 OH2 SOL 4300 32.070 13.330 60.680 1.00 0.00 ATOM 28515 H1 SOL 4300 31.560 12.690 60.190 1.00 0.00 ATOM 28516 H2 SOL 4300 31.450 13.690 61.320 1.00 0.00 ATOM 28517 OH2 SOL 4301 7.840 41.590 6.250 1.00 0.00 ATOM 28518 H1 SOL 4301 8.390 42.370 6.120 1.00 0.00 ATOM 28519 H2 SOL 4301 7.720 41.240 5.360 1.00 0.00 ATOM 28520 OH2 SOL 4302 14.010 35.790 4.160 1.00 0.00 ATOM 28521 H1 SOL 4302 13.690 34.900 4.000 1.00 0.00 ATOM 28522 H2 SOL 4302 14.880 35.820 3.750 1.00 0.00 ATOM 28523 OH2 SOL 4303 18.530 9.000 82.660 1.00 0.00 ATOM 28524 H1 SOL 4303 18.720 8.080 82.480 1.00 0.00 ATOM 28525 H2 SOL 4303 18.210 9.000 83.560 1.00 0.00 ATOM 28526 OH2 SOL 4304 36.290 3.990 71.270 1.00 0.00 ATOM 28527 H1 SOL 4304 36.550 3.450 70.520 1.00 0.00 ATOM 28528 H2 SOL 4304 35.550 4.510 70.960 1.00 0.00 ATOM 28529 OH2 SOL 4305 42.240 29.240 76.920 1.00 0.00 ATOM 28530 H1 SOL 4305 41.590 28.830 76.340 1.00 0.00 ATOM 28531 H2 SOL 4305 41.750 29.950 77.350 1.00 0.00 ATOM 28532 OH2 SOL 4306 24.520 42.390 70.520 1.00 0.00 ATOM 28533 H1 SOL 4306 25.160 42.460 69.810 1.00 0.00 ATOM 28534 H2 SOL 4306 23.740 42.040 70.100 1.00 0.00 ATOM 28535 OH2 SOL 4307 18.850 20.070 8.570 1.00 0.00 ATOM 28536 H1 SOL 4307 18.790 19.820 9.500 1.00 0.00 ATOM 28537 H2 SOL 4307 18.900 21.020 8.580 1.00 0.00 ATOM 28538 OH2 SOL 4308 2.270 9.080 4.610 1.00 0.00 ATOM 28539 H1 SOL 4308 2.590 9.610 3.880 1.00 0.00 ATOM 28540 H2 SOL 4308 3.050 8.630 4.940 1.00 0.00 ATOM 28541 OH2 SOL 4309 29.010 24.650 83.680 1.00 0.00 ATOM 28542 H1 SOL 4309 28.900 25.260 84.400 1.00 0.00 ATOM 28543 H2 SOL 4309 29.840 24.890 83.280 1.00 0.00 ATOM 28544 OH2 SOL 4310 56.810 51.640 14.690 1.00 0.00 ATOM 28545 H1 SOL 4310 57.310 51.630 15.500 1.00 0.00 ATOM 28546 H2 SOL 4310 56.730 50.720 14.440 1.00 0.00 ATOM 28547 OH2 SOL 4311 12.100 5.580 15.230 1.00 0.00 ATOM 28548 H1 SOL 4311 12.090 5.150 16.090 1.00 0.00 ATOM 28549 H2 SOL 4311 13.000 5.450 14.910 1.00 0.00 ATOM 28550 OH2 SOL 4312 11.940 47.780 13.570 1.00 0.00 ATOM 28551 H1 SOL 4312 12.320 46.970 13.920 1.00 0.00 ATOM 28552 H2 SOL 4312 12.510 48.000 12.820 1.00 0.00 ATOM 28553 OH2 SOL 4313 60.390 7.650 79.620 1.00 0.00 ATOM 28554 H1 SOL 4313 59.450 7.470 79.570 1.00 0.00 ATOM 28555 H2 SOL 4313 60.710 7.540 78.730 1.00 0.00 ATOM 28556 OH2 SOL 4314 31.410 16.320 13.550 1.00 0.00 ATOM 28557 H1 SOL 4314 31.310 16.330 14.500 1.00 0.00 ATOM 28558 H2 SOL 4314 30.700 16.880 13.220 1.00 0.00 ATOM 28559 OH2 SOL 4315 31.310 5.740 19.640 1.00 0.00 ATOM 28560 H1 SOL 4315 31.900 4.980 19.550 1.00 0.00 ATOM 28561 H2 SOL 4315 31.900 6.490 19.720 1.00 0.00 ATOM 28562 OH2 SOL 4316 15.650 9.940 82.380 1.00 0.00 ATOM 28563 H1 SOL 4316 16.470 10.080 82.840 1.00 0.00 ATOM 28564 H2 SOL 4316 15.310 9.120 82.720 1.00 0.00 ATOM 28565 OH2 SOL 4317 52.080 19.680 20.670 1.00 0.00 ATOM 28566 H1 SOL 4317 52.490 19.030 21.240 1.00 0.00 ATOM 28567 H2 SOL 4317 52.800 20.060 20.170 1.00 0.00 ATOM 28568 OH2 SOL 4318 43.400 12.080 4.470 1.00 0.00 ATOM 28569 H1 SOL 4318 42.710 12.100 5.130 1.00 0.00 ATOM 28570 H2 SOL 4318 43.710 12.980 4.410 1.00 0.00 ATOM 28571 OH2 SOL 4319 52.540 20.630 26.960 1.00 0.00 ATOM 28572 H1 SOL 4319 51.730 20.390 27.410 1.00 0.00 ATOM 28573 H2 SOL 4319 52.480 21.580 26.840 1.00 0.00 ATOM 28574 OH2 SOL 4320 41.340 41.860 73.830 1.00 0.00 ATOM 28575 H1 SOL 4320 41.160 41.030 74.270 1.00 0.00 ATOM 28576 H2 SOL 4320 42.300 41.920 73.810 1.00 0.00 ATOM 28577 OH2 SOL 4321 20.560 54.150 2.220 1.00 0.00 ATOM 28578 H1 SOL 4321 20.040 53.430 2.590 1.00 0.00 ATOM 28579 H2 SOL 4321 21.460 53.880 2.360 1.00 0.00 ATOM 28580 OH2 SOL 4322 21.050 51.830 71.780 1.00 0.00 ATOM 28581 H1 SOL 4322 20.930 51.450 70.910 1.00 0.00 ATOM 28582 H2 SOL 4322 20.350 51.430 72.310 1.00 0.00 ATOM 28583 OH2 SOL 4323 1.240 21.380 80.410 1.00 0.00 ATOM 28584 H1 SOL 4323 0.930 20.480 80.490 1.00 0.00 ATOM 28585 H2 SOL 4323 0.460 21.890 80.200 1.00 0.00 ATOM 28586 OH2 SOL 4324 34.020 57.360 24.050 1.00 0.00 ATOM 28587 H1 SOL 4324 33.660 58.240 23.960 1.00 0.00 ATOM 28588 H2 SOL 4324 34.900 57.410 23.670 1.00 0.00 ATOM 28589 OH2 SOL 4325 40.560 47.400 78.540 1.00 0.00 ATOM 28590 H1 SOL 4325 41.070 47.700 77.790 1.00 0.00 ATOM 28591 H2 SOL 4325 41.180 46.910 79.080 1.00 0.00 ATOM 28592 OH2 SOL 4326 50.140 12.250 62.780 1.00 0.00 ATOM 28593 H1 SOL 4326 49.740 12.790 63.460 1.00 0.00 ATOM 28594 H2 SOL 4326 49.750 12.570 61.960 1.00 0.00 ATOM 28595 OH2 SOL 4327 30.100 49.050 23.210 1.00 0.00 ATOM 28596 H1 SOL 4327 29.180 48.870 23.030 1.00 0.00 ATOM 28597 H2 SOL 4327 30.160 50.000 23.240 1.00 0.00 ATOM 28598 OH2 SOL 4328 60.110 44.850 83.130 1.00 0.00 ATOM 28599 H1 SOL 4328 60.540 45.270 83.880 1.00 0.00 ATOM 28600 H2 SOL 4328 59.570 45.540 82.750 1.00 0.00 ATOM 28601 OH2 SOL 4329 58.570 12.900 16.190 1.00 0.00 ATOM 28602 H1 SOL 4329 57.770 12.380 16.260 1.00 0.00 ATOM 28603 H2 SOL 4329 58.870 12.760 15.290 1.00 0.00 ATOM 28604 OH2 SOL 4330 42.150 45.650 76.150 1.00 0.00 ATOM 28605 H1 SOL 4330 42.100 45.290 75.260 1.00 0.00 ATOM 28606 H2 SOL 4330 42.070 46.600 76.030 1.00 0.00 ATOM 28607 OH2 SOL 4331 17.520 19.940 71.240 1.00 0.00 ATOM 28608 H1 SOL 4331 16.730 19.430 71.070 1.00 0.00 ATOM 28609 H2 SOL 4331 17.230 20.650 71.810 1.00 0.00 ATOM 28610 OH2 SOL 4332 46.790 54.750 61.230 1.00 0.00 ATOM 28611 H1 SOL 4332 47.410 54.020 61.180 1.00 0.00 ATOM 28612 H2 SOL 4332 46.460 54.840 60.330 1.00 0.00 ATOM 28613 OH2 SOL 4333 18.230 9.230 62.960 1.00 0.00 ATOM 28614 H1 SOL 4333 18.450 10.130 62.700 1.00 0.00 ATOM 28615 H2 SOL 4333 18.700 9.100 63.780 1.00 0.00 ATOM 28616 OH2 SOL 4334 26.420 38.160 77.880 1.00 0.00 ATOM 28617 H1 SOL 4334 25.620 38.400 78.340 1.00 0.00 ATOM 28618 H2 SOL 4334 27.130 38.500 78.430 1.00 0.00 ATOM 28619 OH2 SOL 4335 36.280 26.170 73.190 1.00 0.00 ATOM 28620 H1 SOL 4335 36.370 27.100 72.990 1.00 0.00 ATOM 28621 H2 SOL 4335 35.630 25.850 72.570 1.00 0.00 ATOM 28622 OH2 SOL 4336 6.680 46.320 9.330 1.00 0.00 ATOM 28623 H1 SOL 4336 6.260 45.950 8.550 1.00 0.00 ATOM 28624 H2 SOL 4336 6.370 45.760 10.050 1.00 0.00 ATOM 28625 OH2 SOL 4337 54.450 5.930 80.770 1.00 0.00 ATOM 28626 H1 SOL 4337 54.330 6.840 80.490 1.00 0.00 ATOM 28627 H2 SOL 4337 53.600 5.670 81.110 1.00 0.00 ATOM 28628 OH2 SOL 4338 34.330 17.630 15.880 1.00 0.00 ATOM 28629 H1 SOL 4338 34.640 18.440 16.280 1.00 0.00 ATOM 28630 H2 SOL 4338 35.120 17.180 15.590 1.00 0.00 ATOM 28631 OH2 SOL 4339 27.530 38.060 75.430 1.00 0.00 ATOM 28632 H1 SOL 4339 27.120 37.960 76.290 1.00 0.00 ATOM 28633 H2 SOL 4339 26.810 37.990 74.810 1.00 0.00 ATOM 28634 OH2 SOL 4340 6.030 57.190 25.440 1.00 0.00 ATOM 28635 H1 SOL 4340 5.670 56.820 26.240 1.00 0.00 ATOM 28636 H2 SOL 4340 6.860 57.590 25.710 1.00 0.00 ATOM 28637 OH2 SOL 4341 38.450 14.540 82.500 1.00 0.00 ATOM 28638 H1 SOL 4341 39.050 15.290 82.550 1.00 0.00 ATOM 28639 H2 SOL 4341 37.740 14.850 81.930 1.00 0.00 ATOM 28640 OH2 SOL 4342 50.210 25.950 12.190 1.00 0.00 ATOM 28641 H1 SOL 4342 51.060 26.350 12.360 1.00 0.00 ATOM 28642 H2 SOL 4342 49.720 26.070 13.000 1.00 0.00 ATOM 28643 OH2 SOL 4343 47.480 55.590 70.440 1.00 0.00 ATOM 28644 H1 SOL 4343 46.910 54.890 70.110 1.00 0.00 ATOM 28645 H2 SOL 4343 47.860 55.980 69.650 1.00 0.00 ATOM 28646 OH2 SOL 4344 3.830 34.540 78.720 1.00 0.00 ATOM 28647 H1 SOL 4344 4.530 35.070 78.340 1.00 0.00 ATOM 28648 H2 SOL 4344 3.030 35.050 78.560 1.00 0.00 ATOM 28649 OH2 SOL 4345 47.880 13.310 68.150 1.00 0.00 ATOM 28650 H1 SOL 4345 48.310 14.160 68.210 1.00 0.00 ATOM 28651 H2 SOL 4345 48.560 12.680 68.400 1.00 0.00 ATOM 28652 OH2 SOL 4346 16.660 22.750 77.780 1.00 0.00 ATOM 28653 H1 SOL 4346 16.810 22.200 78.550 1.00 0.00 ATOM 28654 H2 SOL 4346 16.060 22.240 77.240 1.00 0.00 ATOM 28655 OH2 SOL 4347 18.610 3.950 81.910 1.00 0.00 ATOM 28656 H1 SOL 4347 18.220 4.670 81.430 1.00 0.00 ATOM 28657 H2 SOL 4347 18.770 3.270 81.250 1.00 0.00 ATOM 28658 OH2 SOL 4348 36.030 21.000 8.340 1.00 0.00 ATOM 28659 H1 SOL 4348 35.900 20.210 7.810 1.00 0.00 ATOM 28660 H2 SOL 4348 35.140 21.260 8.580 1.00 0.00 ATOM 28661 OH2 SOL 4349 17.760 49.420 12.300 1.00 0.00 ATOM 28662 H1 SOL 4349 18.460 50.070 12.410 1.00 0.00 ATOM 28663 H2 SOL 4349 18.030 48.680 12.830 1.00 0.00 ATOM 28664 OH2 SOL 4350 4.070 25.400 68.490 1.00 0.00 ATOM 28665 H1 SOL 4350 4.410 26.150 68.970 1.00 0.00 ATOM 28666 H2 SOL 4350 4.790 24.760 68.510 1.00 0.00 ATOM 28667 OH2 SOL 4351 35.170 33.030 8.630 1.00 0.00 ATOM 28668 H1 SOL 4351 35.140 33.020 9.580 1.00 0.00 ATOM 28669 H2 SOL 4351 35.040 32.120 8.370 1.00 0.00 ATOM 28670 OH2 SOL 4352 50.380 19.210 79.910 1.00 0.00 ATOM 28671 H1 SOL 4352 50.990 19.040 80.620 1.00 0.00 ATOM 28672 H2 SOL 4352 49.520 19.260 80.340 1.00 0.00 ATOM 28673 OH2 SOL 4353 36.450 17.510 20.630 1.00 0.00 ATOM 28674 H1 SOL 4353 35.570 17.190 20.410 1.00 0.00 ATOM 28675 H2 SOL 4353 36.520 17.370 21.570 1.00 0.00 ATOM 28676 OH2 SOL 4354 16.210 9.380 4.780 1.00 0.00 ATOM 28677 H1 SOL 4354 15.570 8.800 4.380 1.00 0.00 ATOM 28678 H2 SOL 4354 16.260 10.130 4.180 1.00 0.00 ATOM 28679 OH2 SOL 4355 42.340 55.850 15.990 1.00 0.00 ATOM 28680 H1 SOL 4355 43.190 55.490 16.250 1.00 0.00 ATOM 28681 H2 SOL 4355 42.070 56.380 16.740 1.00 0.00 ATOM 28682 OH2 SOL 4356 7.190 51.860 2.310 1.00 0.00 ATOM 28683 H1 SOL 4356 6.600 52.070 3.030 1.00 0.00 ATOM 28684 H2 SOL 4356 7.820 51.240 2.700 1.00 0.00 ATOM 28685 OH2 SOL 4357 16.640 17.590 82.370 1.00 0.00 ATOM 28686 H1 SOL 4357 17.430 17.780 81.860 1.00 0.00 ATOM 28687 H2 SOL 4357 16.090 17.080 81.770 1.00 0.00 ATOM 28688 OH2 SOL 4358 24.120 26.970 7.390 1.00 0.00 ATOM 28689 H1 SOL 4358 24.010 27.920 7.430 1.00 0.00 ATOM 28690 H2 SOL 4358 24.930 26.800 7.870 1.00 0.00 ATOM 28691 OH2 SOL 4359 39.150 44.520 82.320 1.00 0.00 ATOM 28692 H1 SOL 4359 39.570 43.900 81.720 1.00 0.00 ATOM 28693 H2 SOL 4359 38.240 44.540 82.040 1.00 0.00 ATOM 28694 OH2 SOL 4360 59.490 33.130 70.000 1.00 0.00 ATOM 28695 H1 SOL 4360 59.990 33.840 69.600 1.00 0.00 ATOM 28696 H2 SOL 4360 59.300 33.440 70.880 1.00 0.00 ATOM 28697 OH2 SOL 4361 47.720 55.280 65.750 1.00 0.00 ATOM 28698 H1 SOL 4361 47.530 56.090 65.270 1.00 0.00 ATOM 28699 H2 SOL 4361 48.350 55.550 66.420 1.00 0.00 ATOM 28700 OH2 SOL 4362 8.880 43.380 23.020 1.00 0.00 ATOM 28701 H1 SOL 4362 8.820 42.520 23.440 1.00 0.00 ATOM 28702 H2 SOL 4362 9.160 43.960 23.730 1.00 0.00 ATOM 28703 OH2 SOL 4363 10.260 22.600 5.260 1.00 0.00 ATOM 28704 H1 SOL 4363 9.640 22.600 4.530 1.00 0.00 ATOM 28705 H2 SOL 4363 10.210 23.480 5.610 1.00 0.00 ATOM 28706 OH2 SOL 4364 48.870 6.920 70.650 1.00 0.00 ATOM 28707 H1 SOL 4364 48.550 6.430 71.410 1.00 0.00 ATOM 28708 H2 SOL 4364 48.780 6.310 69.920 1.00 0.00 ATOM 28709 OH2 SOL 4365 52.130 52.300 3.210 1.00 0.00 ATOM 28710 H1 SOL 4365 51.360 52.150 3.760 1.00 0.00 ATOM 28711 H2 SOL 4365 52.710 52.850 3.730 1.00 0.00 ATOM 28712 OH2 SOL 4366 10.640 39.960 69.650 1.00 0.00 ATOM 28713 H1 SOL 4366 11.200 39.810 70.410 1.00 0.00 ATOM 28714 H2 SOL 4366 9.950 39.300 69.720 1.00 0.00 ATOM 28715 OH2 SOL 4367 48.760 10.650 80.740 1.00 0.00 ATOM 28716 H1 SOL 4367 48.570 10.930 79.840 1.00 0.00 ATOM 28717 H2 SOL 4367 48.100 9.990 80.940 1.00 0.00 ATOM 28718 OH2 SOL 4368 50.690 38.040 4.310 1.00 0.00 ATOM 28719 H1 SOL 4368 51.520 38.160 4.770 1.00 0.00 ATOM 28720 H2 SOL 4368 50.940 37.940 3.390 1.00 0.00 ATOM 28721 OH2 SOL 4369 35.280 25.460 10.240 1.00 0.00 ATOM 28722 H1 SOL 4369 35.050 25.880 11.070 1.00 0.00 ATOM 28723 H2 SOL 4369 35.080 24.540 10.380 1.00 0.00 ATOM 28724 OH2 SOL 4370 32.320 13.690 73.130 1.00 0.00 ATOM 28725 H1 SOL 4370 32.190 12.750 73.280 1.00 0.00 ATOM 28726 H2 SOL 4370 32.130 14.100 73.970 1.00 0.00 ATOM 28727 OH2 SOL 4371 60.910 18.170 15.870 1.00 0.00 ATOM 28728 H1 SOL 4371 60.350 17.850 16.580 1.00 0.00 ATOM 28729 H2 SOL 4371 61.750 17.730 16.020 1.00 0.00 ATOM 28730 OH2 SOL 4372 43.650 23.870 15.700 1.00 0.00 ATOM 28731 H1 SOL 4372 43.360 23.190 15.080 1.00 0.00 ATOM 28732 H2 SOL 4372 44.570 24.010 15.490 1.00 0.00 ATOM 28733 OH2 SOL 4373 48.850 35.660 78.820 1.00 0.00 ATOM 28734 H1 SOL 4373 49.300 36.110 79.530 1.00 0.00 ATOM 28735 H2 SOL 4373 48.870 36.280 78.090 1.00 0.00 ATOM 28736 OH2 SOL 4374 27.240 29.680 83.540 1.00 0.00 ATOM 28737 H1 SOL 4374 28.080 30.040 83.250 1.00 0.00 ATOM 28738 H2 SOL 4374 26.650 29.850 82.810 1.00 0.00 ATOM 28739 OH2 SOL 4375 28.850 27.550 76.640 1.00 0.00 ATOM 28740 H1 SOL 4375 29.070 28.250 77.250 1.00 0.00 ATOM 28741 H2 SOL 4375 29.130 26.750 77.080 1.00 0.00 ATOM 28742 OH2 SOL 4376 47.550 1.330 15.950 1.00 0.00 ATOM 28743 H1 SOL 4376 47.920 2.120 15.560 1.00 0.00 ATOM 28744 H2 SOL 4376 46.900 1.020 15.320 1.00 0.00 ATOM 28745 OH2 SOL 4377 41.530 2.620 73.100 1.00 0.00 ATOM 28746 H1 SOL 4377 40.670 2.670 72.690 1.00 0.00 ATOM 28747 H2 SOL 4377 41.890 3.500 73.010 1.00 0.00 ATOM 28748 OH2 SOL 4378 7.020 18.000 63.960 1.00 0.00 ATOM 28749 H1 SOL 4378 7.160 17.250 63.380 1.00 0.00 ATOM 28750 H2 SOL 4378 6.870 18.740 63.360 1.00 0.00 ATOM 28751 OH2 SOL 4379 30.340 54.170 76.180 1.00 0.00 ATOM 28752 H1 SOL 4379 30.060 55.080 76.080 1.00 0.00 ATOM 28753 H2 SOL 4379 29.530 53.670 76.060 1.00 0.00 ATOM 28754 OH2 SOL 4380 52.540 28.800 3.790 1.00 0.00 ATOM 28755 H1 SOL 4380 52.750 28.040 3.240 1.00 0.00 ATOM 28756 H2 SOL 4380 53.300 28.890 4.370 1.00 0.00 ATOM 28757 OH2 SOL 4381 12.280 53.600 71.160 1.00 0.00 ATOM 28758 H1 SOL 4381 12.970 53.510 70.500 1.00 0.00 ATOM 28759 H2 SOL 4381 12.360 54.510 71.450 1.00 0.00 ATOM 28760 OH2 SOL 4382 8.630 53.360 66.460 1.00 0.00 ATOM 28761 H1 SOL 4382 8.870 53.740 65.600 1.00 0.00 ATOM 28762 H2 SOL 4382 8.890 52.450 66.400 1.00 0.00 ATOM 28763 OH2 SOL 4383 23.890 36.900 17.550 1.00 0.00 ATOM 28764 H1 SOL 4383 23.090 36.440 17.280 1.00 0.00 ATOM 28765 H2 SOL 4383 23.610 37.470 18.260 1.00 0.00 ATOM 28766 OH2 SOL 4384 14.800 14.060 17.000 1.00 0.00 ATOM 28767 H1 SOL 4384 14.650 13.240 16.530 1.00 0.00 ATOM 28768 H2 SOL 4384 13.980 14.240 17.450 1.00 0.00 ATOM 28769 OH2 SOL 4385 61.020 57.080 73.550 1.00 0.00 ATOM 28770 H1 SOL 4385 61.210 56.400 72.910 1.00 0.00 ATOM 28771 H2 SOL 4385 61.550 57.830 73.270 1.00 0.00 ATOM 28772 OH2 SOL 4386 0.020 14.550 26.670 1.00 0.00 ATOM 28773 H1 SOL 4386 0.350 14.060 27.430 1.00 0.00 ATOM 28774 H2 SOL 4386 0.270 14.020 25.920 1.00 0.00 ATOM 28775 OH2 SOL 4387 50.120 24.170 15.740 1.00 0.00 ATOM 28776 H1 SOL 4387 50.030 23.750 14.890 1.00 0.00 ATOM 28777 H2 SOL 4387 49.790 25.060 15.600 1.00 0.00 ATOM 28778 OH2 SOL 4388 25.590 6.010 81.990 1.00 0.00 ATOM 28779 H1 SOL 4388 25.580 5.950 81.040 1.00 0.00 ATOM 28780 H2 SOL 4388 25.480 5.110 82.300 1.00 0.00 ATOM 28781 OH2 SOL 4389 49.140 26.440 83.600 1.00 0.00 ATOM 28782 H1 SOL 4389 49.760 25.720 83.740 1.00 0.00 ATOM 28783 H2 SOL 4389 49.510 26.930 82.870 1.00 0.00 ATOM 28784 OH2 SOL 4390 11.420 31.790 12.220 1.00 0.00 ATOM 28785 H1 SOL 4390 11.060 31.480 11.390 1.00 0.00 ATOM 28786 H2 SOL 4390 11.620 32.710 12.070 1.00 0.00 ATOM 28787 OH2 SOL 4391 56.200 30.890 24.990 1.00 0.00 ATOM 28788 H1 SOL 4391 56.340 30.220 25.670 1.00 0.00 ATOM 28789 H2 SOL 4391 56.690 30.570 24.240 1.00 0.00 ATOM 28790 OH2 SOL 4392 5.720 40.440 10.620 1.00 0.00 ATOM 28791 H1 SOL 4392 5.650 40.620 9.680 1.00 0.00 ATOM 28792 H2 SOL 4392 6.270 41.140 10.960 1.00 0.00 ATOM 28793 OH2 SOL 4393 46.320 12.860 79.950 1.00 0.00 ATOM 28794 H1 SOL 4393 47.100 12.350 79.730 1.00 0.00 ATOM 28795 H2 SOL 4393 46.220 13.460 79.220 1.00 0.00 ATOM 28796 OH2 SOL 4394 6.720 7.000 3.810 1.00 0.00 ATOM 28797 H1 SOL 4394 6.870 6.570 4.650 1.00 0.00 ATOM 28798 H2 SOL 4394 7.510 6.800 3.290 1.00 0.00 ATOM 28799 OH2 SOL 4395 3.080 51.120 81.920 1.00 0.00 ATOM 28800 H1 SOL 4395 3.500 51.070 81.070 1.00 0.00 ATOM 28801 H2 SOL 4395 2.300 50.570 81.850 1.00 0.00 ATOM 28802 OH2 SOL 4396 4.130 50.210 4.320 1.00 0.00 ATOM 28803 H1 SOL 4396 3.560 50.220 5.090 1.00 0.00 ATOM 28804 H2 SOL 4396 3.570 50.490 3.600 1.00 0.00 ATOM 28805 OH2 SOL 4397 34.350 1.220 70.020 1.00 0.00 ATOM 28806 H1 SOL 4397 34.190 2.010 69.510 1.00 0.00 ATOM 28807 H2 SOL 4397 34.520 0.550 69.360 1.00 0.00 ATOM 28808 OH2 SOL 4398 49.020 49.440 82.480 1.00 0.00 ATOM 28809 H1 SOL 4398 49.910 49.250 82.790 1.00 0.00 ATOM 28810 H2 SOL 4398 48.630 49.950 83.180 1.00 0.00 ATOM 28811 OH2 SOL 4399 53.430 30.160 16.700 1.00 0.00 ATOM 28812 H1 SOL 4399 54.360 29.930 16.650 1.00 0.00 ATOM 28813 H2 SOL 4399 53.040 29.470 17.230 1.00 0.00 ATOM 28814 OH2 SOL 4400 35.990 8.140 81.890 1.00 0.00 ATOM 28815 H1 SOL 4400 35.040 8.010 81.890 1.00 0.00 ATOM 28816 H2 SOL 4400 36.170 8.570 81.050 1.00 0.00 ATOM 28817 OH2 SOL 4401 35.210 55.960 1.110 1.00 0.00 ATOM 28818 H1 SOL 4401 35.610 55.330 1.710 1.00 0.00 ATOM 28819 H2 SOL 4401 34.830 55.430 0.420 1.00 0.00 ATOM 28820 OH2 SOL 4402 52.200 9.460 7.410 1.00 0.00 ATOM 28821 H1 SOL 4402 52.500 9.990 8.150 1.00 0.00 ATOM 28822 H2 SOL 4402 51.380 9.870 7.140 1.00 0.00 ATOM 28823 OH2 SOL 4403 22.540 34.820 12.750 1.00 0.00 ATOM 28824 H1 SOL 4403 22.800 35.510 13.370 1.00 0.00 ATOM 28825 H2 SOL 4403 23.370 34.470 12.430 1.00 0.00 ATOM 28826 OH2 SOL 4404 49.420 57.530 16.650 1.00 0.00 ATOM 28827 H1 SOL 4404 48.730 58.190 16.720 1.00 0.00 ATOM 28828 H2 SOL 4404 50.030 57.760 17.350 1.00 0.00 ATOM 28829 OH2 SOL 4405 60.800 50.950 14.450 1.00 0.00 ATOM 28830 H1 SOL 4405 60.950 50.140 14.950 1.00 0.00 ATOM 28831 H2 SOL 4405 60.990 51.650 15.080 1.00 0.00 ATOM 28832 OH2 SOL 4406 31.770 55.130 20.500 1.00 0.00 ATOM 28833 H1 SOL 4406 32.040 55.990 20.790 1.00 0.00 ATOM 28834 H2 SOL 4406 32.230 55.000 19.670 1.00 0.00 ATOM 28835 OH2 SOL 4407 43.940 43.550 1.800 1.00 0.00 ATOM 28836 H1 SOL 4407 43.840 43.220 2.690 1.00 0.00 ATOM 28837 H2 SOL 4407 43.340 44.290 1.750 1.00 0.00 ATOM 28838 OH2 SOL 4408 8.570 29.660 8.950 1.00 0.00 ATOM 28839 H1 SOL 4408 8.150 29.410 8.130 1.00 0.00 ATOM 28840 H2 SOL 4408 8.420 28.920 9.530 1.00 0.00 ATOM 28841 OH2 SOL 4409 28.230 11.330 79.620 1.00 0.00 ATOM 28842 H1 SOL 4409 28.060 11.330 78.680 1.00 0.00 ATOM 28843 H2 SOL 4409 28.070 12.230 79.890 1.00 0.00 ATOM 28844 OH2 SOL 4410 28.080 29.430 74.150 1.00 0.00 ATOM 28845 H1 SOL 4410 28.310 28.860 74.890 1.00 0.00 ATOM 28846 H2 SOL 4410 27.570 30.140 74.550 1.00 0.00 ATOM 28847 OH2 SOL 4411 58.100 51.100 79.640 1.00 0.00 ATOM 28848 H1 SOL 4411 58.790 51.630 79.250 1.00 0.00 ATOM 28849 H2 SOL 4411 57.710 50.630 78.900 1.00 0.00 ATOM 28850 OH2 SOL 4412 2.350 16.250 67.230 1.00 0.00 ATOM 28851 H1 SOL 4412 2.480 15.880 66.360 1.00 0.00 ATOM 28852 H2 SOL 4412 1.850 17.060 67.080 1.00 0.00 ATOM 28853 OH2 SOL 4413 49.550 27.350 4.150 1.00 0.00 ATOM 28854 H1 SOL 4413 48.690 27.280 4.560 1.00 0.00 ATOM 28855 H2 SOL 4413 50.160 27.360 4.880 1.00 0.00 ATOM 28856 OH2 SOL 4414 43.720 19.930 69.750 1.00 0.00 ATOM 28857 H1 SOL 4414 44.150 19.120 69.490 1.00 0.00 ATOM 28858 H2 SOL 4414 43.450 20.330 68.920 1.00 0.00 ATOM 28859 OH2 SOL 4415 40.430 3.920 15.420 1.00 0.00 ATOM 28860 H1 SOL 4415 39.510 3.910 15.160 1.00 0.00 ATOM 28861 H2 SOL 4415 40.880 3.390 14.770 1.00 0.00 ATOM 28862 OH2 SOL 4416 16.400 18.080 6.460 1.00 0.00 ATOM 28863 H1 SOL 4416 16.040 17.460 5.820 1.00 0.00 ATOM 28864 H2 SOL 4416 16.110 18.940 6.160 1.00 0.00 ATOM 28865 OH2 SOL 4417 15.360 33.580 21.560 1.00 0.00 ATOM 28866 H1 SOL 4417 15.030 32.860 21.030 1.00 0.00 ATOM 28867 H2 SOL 4417 14.890 33.500 22.390 1.00 0.00 ATOM 28868 OH2 SOL 4418 0.150 17.710 7.370 1.00 0.00 ATOM 28869 H1 SOL 4418 0.620 17.220 6.690 1.00 0.00 ATOM 28870 H2 SOL 4418 -0.750 17.390 7.300 1.00 0.00 ATOM 28871 OH2 SOL 4419 31.480 24.510 73.790 1.00 0.00 ATOM 28872 H1 SOL 4419 31.620 25.440 74.010 1.00 0.00 ATOM 28873 H2 SOL 4419 32.220 24.280 73.240 1.00 0.00 ATOM 28874 OH2 SOL 4420 46.370 32.550 81.060 1.00 0.00 ATOM 28875 H1 SOL 4420 46.290 31.940 80.330 1.00 0.00 ATOM 28876 H2 SOL 4420 47.110 32.210 81.580 1.00 0.00 ATOM 28877 OH2 SOL 4421 33.030 41.620 68.300 1.00 0.00 ATOM 28878 H1 SOL 4421 33.050 40.690 68.080 1.00 0.00 ATOM 28879 H2 SOL 4421 32.260 41.960 67.840 1.00 0.00 ATOM 28880 OH2 SOL 4422 33.010 55.180 72.820 1.00 0.00 ATOM 28881 H1 SOL 4422 33.240 54.900 73.700 1.00 0.00 ATOM 28882 H2 SOL 4422 32.060 55.250 72.820 1.00 0.00 ATOM 28883 OH2 SOL 4423 25.090 52.220 22.090 1.00 0.00 ATOM 28884 H1 SOL 4423 24.930 52.980 22.650 1.00 0.00 ATOM 28885 H2 SOL 4423 24.280 52.120 21.590 1.00 0.00 ATOM 28886 OH2 SOL 4424 7.430 16.890 18.220 1.00 0.00 ATOM 28887 H1 SOL 4424 7.730 16.360 17.480 1.00 0.00 ATOM 28888 H2 SOL 4424 6.890 16.300 18.740 1.00 0.00 ATOM 28889 OH2 SOL 4425 33.640 16.450 65.930 1.00 0.00 ATOM 28890 H1 SOL 4425 34.470 16.550 66.380 1.00 0.00 ATOM 28891 H2 SOL 4425 33.870 16.070 65.080 1.00 0.00 ATOM 28892 OH2 SOL 4426 46.370 39.200 78.440 1.00 0.00 ATOM 28893 H1 SOL 4426 46.660 39.100 79.350 1.00 0.00 ATOM 28894 H2 SOL 4426 46.070 40.100 78.380 1.00 0.00 ATOM 28895 OH2 SOL 4427 25.370 18.000 71.750 1.00 0.00 ATOM 28896 H1 SOL 4427 25.330 17.050 71.850 1.00 0.00 ATOM 28897 H2 SOL 4427 24.910 18.340 72.520 1.00 0.00 ATOM 28898 OH2 SOL 4428 24.980 12.730 10.890 1.00 0.00 ATOM 28899 H1 SOL 4428 24.500 13.260 10.250 1.00 0.00 ATOM 28900 H2 SOL 4428 24.310 12.400 11.480 1.00 0.00 ATOM 28901 OH2 SOL 4429 11.930 49.830 82.380 1.00 0.00 ATOM 28902 H1 SOL 4429 12.550 50.550 82.230 1.00 0.00 ATOM 28903 H2 SOL 4429 11.070 50.240 82.350 1.00 0.00 ATOM 28904 OH2 SOL 4430 10.440 44.670 12.000 1.00 0.00 ATOM 28905 H1 SOL 4430 11.370 44.740 11.780 1.00 0.00 ATOM 28906 H2 SOL 4430 10.360 43.830 12.440 1.00 0.00 ATOM 28907 OH2 SOL 4431 18.650 13.960 0.680 1.00 0.00 ATOM 28908 H1 SOL 4431 19.020 13.210 0.210 1.00 0.00 ATOM 28909 H2 SOL 4431 19.360 14.250 1.260 1.00 0.00 ATOM 28910 OH2 SOL 4432 38.420 54.190 21.300 1.00 0.00 ATOM 28911 H1 SOL 4432 37.700 53.970 21.900 1.00 0.00 ATOM 28912 H2 SOL 4432 39.060 53.490 21.430 1.00 0.00 ATOM 28913 OH2 SOL 4433 43.130 46.180 67.530 1.00 0.00 ATOM 28914 H1 SOL 4433 43.150 47.130 67.570 1.00 0.00 ATOM 28915 H2 SOL 4433 42.370 45.930 68.070 1.00 0.00 ATOM 28916 OH2 SOL 4434 20.630 30.050 76.770 1.00 0.00 ATOM 28917 H1 SOL 4434 21.510 30.110 76.390 1.00 0.00 ATOM 28918 H2 SOL 4434 20.780 29.780 77.670 1.00 0.00 ATOM 28919 OH2 SOL 4435 6.910 44.890 0.760 1.00 0.00 ATOM 28920 H1 SOL 4435 6.120 44.960 1.300 1.00 0.00 ATOM 28921 H2 SOL 4435 7.130 45.790 0.530 1.00 0.00 ATOM 28922 OH2 SOL 4436 26.330 16.910 74.410 1.00 0.00 ATOM 28923 H1 SOL 4436 25.840 17.450 75.030 1.00 0.00 ATOM 28924 H2 SOL 4436 27.100 17.420 74.190 1.00 0.00 ATOM 28925 OH2 SOL 4437 37.630 16.130 5.180 1.00 0.00 ATOM 28926 H1 SOL 4437 38.390 16.070 4.600 1.00 0.00 ATOM 28927 H2 SOL 4437 37.030 16.710 4.720 1.00 0.00 ATOM 28928 OH2 SOL 4438 39.240 52.290 10.320 1.00 0.00 ATOM 28929 H1 SOL 4438 40.180 52.220 10.450 1.00 0.00 ATOM 28930 H2 SOL 4438 38.860 51.930 11.120 1.00 0.00 ATOM 28931 OH2 SOL 4439 1.800 1.820 80.390 1.00 0.00 ATOM 28932 H1 SOL 4439 1.290 1.310 81.020 1.00 0.00 ATOM 28933 H2 SOL 4439 2.520 2.190 80.900 1.00 0.00 ATOM 28934 OH2 SOL 4440 9.670 45.350 70.620 1.00 0.00 ATOM 28935 H1 SOL 4440 10.470 45.790 70.930 1.00 0.00 ATOM 28936 H2 SOL 4440 9.960 44.810 69.890 1.00 0.00 ATOM 28937 OH2 SOL 4441 49.520 55.110 3.880 1.00 0.00 ATOM 28938 H1 SOL 4441 49.270 55.570 3.070 1.00 0.00 ATOM 28939 H2 SOL 4441 48.840 54.450 4.000 1.00 0.00 ATOM 28940 OH2 SOL 4442 43.880 39.900 16.450 1.00 0.00 ATOM 28941 H1 SOL 4442 43.780 39.940 15.490 1.00 0.00 ATOM 28942 H2 SOL 4442 44.590 39.280 16.590 1.00 0.00 ATOM 28943 OH2 SOL 4443 46.460 22.950 66.200 1.00 0.00 ATOM 28944 H1 SOL 4443 46.510 23.800 66.620 1.00 0.00 ATOM 28945 H2 SOL 4443 46.730 23.110 65.290 1.00 0.00 ATOM 28946 OH2 SOL 4444 39.150 3.200 71.820 1.00 0.00 ATOM 28947 H1 SOL 4444 38.220 3.260 72.030 1.00 0.00 ATOM 28948 H2 SOL 4444 39.330 3.970 71.280 1.00 0.00 ATOM 28949 OH2 SOL 4445 3.270 47.440 4.240 1.00 0.00 ATOM 28950 H1 SOL 4445 3.400 48.370 4.390 1.00 0.00 ATOM 28951 H2 SOL 4445 2.350 47.280 4.460 1.00 0.00 ATOM 28952 OH2 SOL 4446 48.400 19.260 76.460 1.00 0.00 ATOM 28953 H1 SOL 4446 47.670 18.650 76.540 1.00 0.00 ATOM 28954 H2 SOL 4446 48.190 19.960 77.090 1.00 0.00 ATOM 28955 OH2 SOL 4447 10.320 16.020 6.060 1.00 0.00 ATOM 28956 H1 SOL 4447 10.690 16.650 6.690 1.00 0.00 ATOM 28957 H2 SOL 4447 10.810 15.210 6.210 1.00 0.00 ATOM 28958 OH2 SOL 4448 55.740 55.250 15.460 1.00 0.00 ATOM 28959 H1 SOL 4448 56.350 54.780 14.890 1.00 0.00 ATOM 28960 H2 SOL 4448 55.950 56.170 15.330 1.00 0.00 ATOM 28961 OH2 SOL 4449 26.960 38.910 68.410 1.00 0.00 ATOM 28962 H1 SOL 4449 27.620 39.360 67.880 1.00 0.00 ATOM 28963 H2 SOL 4449 26.750 38.120 67.910 1.00 0.00 ATOM 28964 OH2 SOL 4450 39.870 31.560 8.500 1.00 0.00 ATOM 28965 H1 SOL 4450 39.110 31.000 8.310 1.00 0.00 ATOM 28966 H2 SOL 4450 40.530 31.290 7.860 1.00 0.00 ATOM 28967 OH2 SOL 4451 9.280 6.550 81.470 1.00 0.00 ATOM 28968 H1 SOL 4451 9.480 7.120 80.730 1.00 0.00 ATOM 28969 H2 SOL 4451 10.080 6.570 82.000 1.00 0.00 ATOM 28970 OH2 SOL 4452 8.820 38.890 74.720 1.00 0.00 ATOM 28971 H1 SOL 4452 9.370 39.560 74.320 1.00 0.00 ATOM 28972 H2 SOL 4452 9.030 38.940 75.660 1.00 0.00 ATOM 28973 OH2 SOL 4453 9.970 53.260 17.830 1.00 0.00 ATOM 28974 H1 SOL 4453 10.620 53.840 17.460 1.00 0.00 ATOM 28975 H2 SOL 4453 9.390 53.830 18.340 1.00 0.00 ATOM 28976 OH2 SOL 4454 1.910 53.180 11.460 1.00 0.00 ATOM 28977 H1 SOL 4454 2.850 53.140 11.640 1.00 0.00 ATOM 28978 H2 SOL 4454 1.530 53.550 12.250 1.00 0.00 ATOM 28979 OH2 SOL 4455 17.050 37.110 83.110 1.00 0.00 ATOM 28980 H1 SOL 4455 17.680 36.540 83.540 1.00 0.00 ATOM 28981 H2 SOL 4455 16.250 37.020 83.630 1.00 0.00 ATOM 28982 OH2 SOL 4456 57.200 47.070 78.050 1.00 0.00 ATOM 28983 H1 SOL 4456 57.720 46.600 78.710 1.00 0.00 ATOM 28984 H2 SOL 4456 56.420 46.530 77.940 1.00 0.00 ATOM 28985 OH2 SOL 4457 5.440 8.010 9.350 1.00 0.00 ATOM 28986 H1 SOL 4457 5.980 7.780 10.100 1.00 0.00 ATOM 28987 H2 SOL 4457 5.100 7.170 9.030 1.00 0.00 ATOM 28988 OH2 SOL 4458 45.560 4.590 7.280 1.00 0.00 ATOM 28989 H1 SOL 4458 46.190 3.950 7.610 1.00 0.00 ATOM 28990 H2 SOL 4458 44.720 4.140 7.300 1.00 0.00 ATOM 28991 OH2 SOL 4459 27.200 51.450 71.630 1.00 0.00 ATOM 28992 H1 SOL 4459 27.260 52.310 72.040 1.00 0.00 ATOM 28993 H2 SOL 4459 28.010 51.360 71.130 1.00 0.00 ATOM 28994 OH2 SOL 4460 47.790 45.480 13.730 1.00 0.00 ATOM 28995 H1 SOL 4460 47.800 45.560 12.780 1.00 0.00 ATOM 28996 H2 SOL 4460 47.280 44.680 13.910 1.00 0.00 ATOM 28997 OH2 SOL 4461 10.940 58.780 23.680 1.00 0.00 ATOM 28998 H1 SOL 4461 10.870 58.050 24.300 1.00 0.00 ATOM 28999 H2 SOL 4461 10.030 58.990 23.470 1.00 0.00 ATOM 29000 OH2 SOL 4462 52.780 45.960 14.270 1.00 0.00 ATOM 29001 H1 SOL 4462 52.690 45.810 15.210 1.00 0.00 ATOM 29002 H2 SOL 4462 52.630 46.890 14.150 1.00 0.00 ATOM 29003 OH2 SOL 4463 9.070 19.940 0.340 1.00 0.00 ATOM 29004 H1 SOL 4463 8.270 19.430 0.260 1.00 0.00 ATOM 29005 H2 SOL 4463 9.720 19.440 -0.170 1.00 0.00 ATOM 29006 OH2 SOL 4464 59.820 14.940 5.580 1.00 0.00 ATOM 29007 H1 SOL 4464 60.030 14.530 6.420 1.00 0.00 ATOM 29008 H2 SOL 4464 59.000 15.410 5.740 1.00 0.00 ATOM 29009 OH2 SOL 4465 6.340 0.260 16.470 1.00 0.00 ATOM 29010 H1 SOL 4465 5.510 -0.040 16.100 1.00 0.00 ATOM 29011 H2 SOL 4465 6.560 1.050 15.960 1.00 0.00 ATOM 29012 OH2 SOL 4466 59.440 49.510 68.130 1.00 0.00 ATOM 29013 H1 SOL 4466 58.810 48.820 68.340 1.00 0.00 ATOM 29014 H2 SOL 4466 59.000 50.040 67.470 1.00 0.00 ATOM 29015 OH2 SOL 4467 46.710 18.250 72.360 1.00 0.00 ATOM 29016 H1 SOL 4467 45.870 18.590 72.700 1.00 0.00 ATOM 29017 H2 SOL 4467 47.110 19.000 71.920 1.00 0.00 ATOM 29018 OH2 SOL 4468 52.290 55.290 74.180 1.00 0.00 ATOM 29019 H1 SOL 4468 52.540 54.470 74.600 1.00 0.00 ATOM 29020 H2 SOL 4468 52.290 55.940 74.890 1.00 0.00 ATOM 29021 OH2 SOL 4469 26.290 19.040 6.490 1.00 0.00 ATOM 29022 H1 SOL 4469 25.410 19.350 6.700 1.00 0.00 ATOM 29023 H2 SOL 4469 26.810 19.210 7.280 1.00 0.00 ATOM 29024 OH2 SOL 4470 53.500 47.820 25.030 1.00 0.00 ATOM 29025 H1 SOL 4470 53.630 48.240 25.880 1.00 0.00 ATOM 29026 H2 SOL 4470 52.590 48.000 24.800 1.00 0.00 ATOM 29027 OH2 SOL 4471 55.030 3.430 66.310 1.00 0.00 ATOM 29028 H1 SOL 4471 54.410 2.810 66.690 1.00 0.00 ATOM 29029 H2 SOL 4471 54.500 3.930 65.680 1.00 0.00 ATOM 29030 OH2 SOL 4472 4.130 49.380 18.920 1.00 0.00 ATOM 29031 H1 SOL 4472 4.590 48.710 19.420 1.00 0.00 ATOM 29032 H2 SOL 4472 4.040 49.000 18.040 1.00 0.00 ATOM 29033 OH2 SOL 4473 39.740 15.870 73.580 1.00 0.00 ATOM 29034 H1 SOL 4473 38.840 16.190 73.680 1.00 0.00 ATOM 29035 H2 SOL 4473 40.290 16.570 73.930 1.00 0.00 ATOM 29036 OH2 SOL 4474 57.900 27.870 82.410 1.00 0.00 ATOM 29037 H1 SOL 4474 57.370 28.440 81.850 1.00 0.00 ATOM 29038 H2 SOL 4474 57.750 26.990 82.060 1.00 0.00 ATOM 29039 OH2 SOL 4475 26.230 31.390 74.710 1.00 0.00 ATOM 29040 H1 SOL 4475 26.130 32.150 74.150 1.00 0.00 ATOM 29041 H2 SOL 4475 25.340 31.130 74.930 1.00 0.00 ATOM 29042 OH2 SOL 4476 27.900 19.790 77.660 1.00 0.00 ATOM 29043 H1 SOL 4476 27.810 20.400 78.400 1.00 0.00 ATOM 29044 H2 SOL 4476 28.330 20.310 76.980 1.00 0.00 ATOM 29045 OH2 SOL 4477 34.560 45.990 76.800 1.00 0.00 ATOM 29046 H1 SOL 4477 34.020 45.430 76.240 1.00 0.00 ATOM 29047 H2 SOL 4477 34.030 46.150 77.570 1.00 0.00 ATOM 29048 OH2 SOL 4478 35.960 13.450 74.220 1.00 0.00 ATOM 29049 H1 SOL 4478 36.540 12.770 73.870 1.00 0.00 ATOM 29050 H2 SOL 4478 35.800 13.180 75.130 1.00 0.00 ATOM 29051 OH2 SOL 4479 60.900 49.540 71.840 1.00 0.00 ATOM 29052 H1 SOL 4479 60.950 48.630 71.570 1.00 0.00 ATOM 29053 H2 SOL 4479 61.190 49.540 72.750 1.00 0.00 ATOM 29054 OH2 SOL 4480 49.550 53.860 24.670 1.00 0.00 ATOM 29055 H1 SOL 4480 50.080 54.520 24.220 1.00 0.00 ATOM 29056 H2 SOL 4480 48.650 54.080 24.440 1.00 0.00 ATOM 29057 OH2 SOL 4481 18.710 12.230 5.250 1.00 0.00 ATOM 29058 H1 SOL 4481 18.530 11.980 6.160 1.00 0.00 ATOM 29059 H2 SOL 4481 19.390 11.620 4.970 1.00 0.00 ATOM 29060 OH2 SOL 4482 36.110 16.770 66.990 1.00 0.00 ATOM 29061 H1 SOL 4482 36.460 16.100 66.410 1.00 0.00 ATOM 29062 H2 SOL 4482 36.210 16.400 67.870 1.00 0.00 ATOM 29063 OH2 SOL 4483 28.330 39.580 70.810 1.00 0.00 ATOM 29064 H1 SOL 4483 27.880 39.540 69.970 1.00 0.00 ATOM 29065 H2 SOL 4483 27.650 39.810 71.440 1.00 0.00 ATOM 29066 OH2 SOL 4484 23.660 30.180 79.300 1.00 0.00 ATOM 29067 H1 SOL 4484 24.050 29.760 78.540 1.00 0.00 ATOM 29068 H2 SOL 4484 23.430 31.060 79.000 1.00 0.00 ATOM 29069 OH2 SOL 4485 12.600 49.910 23.180 1.00 0.00 ATOM 29070 H1 SOL 4485 12.120 49.300 22.610 1.00 0.00 ATOM 29071 H2 SOL 4485 13.410 49.450 23.390 1.00 0.00 ATOM 29072 OH2 SOL 4486 46.070 38.240 10.740 1.00 0.00 ATOM 29073 H1 SOL 4486 46.950 38.260 11.120 1.00 0.00 ATOM 29074 H2 SOL 4486 46.220 38.130 9.800 1.00 0.00 ATOM 29075 OH2 SOL 4487 38.980 5.940 70.250 1.00 0.00 ATOM 29076 H1 SOL 4487 38.300 6.130 70.900 1.00 0.00 ATOM 29077 H2 SOL 4487 38.510 5.480 69.550 1.00 0.00 ATOM 29078 OH2 SOL 4488 33.160 11.760 18.430 1.00 0.00 ATOM 29079 H1 SOL 4488 33.130 11.700 17.470 1.00 0.00 ATOM 29080 H2 SOL 4488 33.460 12.650 18.600 1.00 0.00 ATOM 29081 OH2 SOL 4489 23.940 23.230 77.340 1.00 0.00 ATOM 29082 H1 SOL 4489 24.560 23.950 77.220 1.00 0.00 ATOM 29083 H2 SOL 4489 23.700 23.280 78.260 1.00 0.00 ATOM 29084 OH2 SOL 4490 27.170 50.280 22.690 1.00 0.00 ATOM 29085 H1 SOL 4490 26.320 50.670 22.460 1.00 0.00 ATOM 29086 H2 SOL 4490 27.270 50.480 23.620 1.00 0.00 ATOM 29087 OH2 SOL 4491 58.040 57.380 68.640 1.00 0.00 ATOM 29088 H1 SOL 4491 58.040 56.830 67.860 1.00 0.00 ATOM 29089 H2 SOL 4491 57.800 56.790 69.350 1.00 0.00 ATOM 29090 OH2 SOL 4492 20.770 23.040 77.000 1.00 0.00 ATOM 29091 H1 SOL 4492 20.160 23.670 76.620 1.00 0.00 ATOM 29092 H2 SOL 4492 21.630 23.470 76.950 1.00 0.00 ATOM 29093 OH2 SOL 4493 34.090 54.900 67.670 1.00 0.00 ATOM 29094 H1 SOL 4493 34.720 54.220 67.900 1.00 0.00 ATOM 29095 H2 SOL 4493 33.790 54.680 66.790 1.00 0.00 ATOM 29096 OH2 SOL 4494 39.770 49.040 20.980 1.00 0.00 ATOM 29097 H1 SOL 4494 40.370 49.080 21.730 1.00 0.00 ATOM 29098 H2 SOL 4494 39.120 49.720 21.160 1.00 0.00 ATOM 29099 OH2 SOL 4495 48.340 34.270 8.770 1.00 0.00 ATOM 29100 H1 SOL 4495 47.690 34.960 8.610 1.00 0.00 ATOM 29101 H2 SOL 4495 48.030 33.830 9.560 1.00 0.00 ATOM 29102 OH2 SOL 4496 9.790 2.000 78.220 1.00 0.00 ATOM 29103 H1 SOL 4496 10.360 2.480 77.620 1.00 0.00 ATOM 29104 H2 SOL 4496 10.370 1.370 78.660 1.00 0.00 ATOM 29105 OH2 SOL 4497 55.940 34.770 68.460 1.00 0.00 ATOM 29106 H1 SOL 4497 56.320 34.390 67.670 1.00 0.00 ATOM 29107 H2 SOL 4497 55.290 35.400 68.140 1.00 0.00 ATOM 29108 OH2 SOL 4498 53.120 27.070 9.470 1.00 0.00 ATOM 29109 H1 SOL 4498 52.840 27.070 10.390 1.00 0.00 ATOM 29110 H2 SOL 4498 53.010 26.170 9.190 1.00 0.00 ATOM 29111 OH2 SOL 4499 34.980 52.210 10.610 1.00 0.00 ATOM 29112 H1 SOL 4499 34.510 53.040 10.520 1.00 0.00 ATOM 29113 H2 SOL 4499 34.430 51.570 10.180 1.00 0.00 ATOM 29114 OH2 SOL 4500 13.810 1.370 4.480 1.00 0.00 ATOM 29115 H1 SOL 4500 14.410 1.170 5.200 1.00 0.00 ATOM 29116 H2 SOL 4500 14.100 2.220 4.160 1.00 0.00 ATOM 29117 OH2 SOL 4501 11.170 46.860 76.080 1.00 0.00 ATOM 29118 H1 SOL 4501 11.300 45.980 75.730 1.00 0.00 ATOM 29119 H2 SOL 4501 10.670 46.730 76.890 1.00 0.00 ATOM 29120 OH2 SOL 4502 8.560 23.120 3.080 1.00 0.00 ATOM 29121 H1 SOL 4502 8.140 23.970 3.210 1.00 0.00 ATOM 29122 H2 SOL 4502 7.950 22.630 2.530 1.00 0.00 ATOM 29123 OH2 SOL 4503 16.880 4.410 14.050 1.00 0.00 ATOM 29124 H1 SOL 4503 16.890 3.980 14.910 1.00 0.00 ATOM 29125 H2 SOL 4503 17.360 3.820 13.480 1.00 0.00 ATOM 29126 OH2 SOL 4504 14.110 6.940 17.280 1.00 0.00 ATOM 29127 H1 SOL 4504 13.370 6.760 17.860 1.00 0.00 ATOM 29128 H2 SOL 4504 14.190 7.890 17.290 1.00 0.00 ATOM 29129 OH2 SOL 4505 26.000 43.210 68.000 1.00 0.00 ATOM 29130 H1 SOL 4505 25.300 42.670 67.630 1.00 0.00 ATOM 29131 H2 SOL 4505 26.800 42.710 67.820 1.00 0.00 ATOM 29132 OH2 SOL 4506 5.470 54.360 18.640 1.00 0.00 ATOM 29133 H1 SOL 4506 6.170 53.750 18.890 1.00 0.00 ATOM 29134 H2 SOL 4506 5.750 54.720 17.800 1.00 0.00 ATOM 29135 OH2 SOL 4507 29.850 30.380 63.010 1.00 0.00 ATOM 29136 H1 SOL 4507 29.430 30.860 62.290 1.00 0.00 ATOM 29137 H2 SOL 4507 29.120 29.980 63.490 1.00 0.00 ATOM 29138 OH2 SOL 4508 29.460 36.180 77.260 1.00 0.00 ATOM 29139 H1 SOL 4508 29.710 36.850 76.630 1.00 0.00 ATOM 29140 H2 SOL 4508 30.280 35.920 77.680 1.00 0.00 ATOM 29141 OH2 SOL 4509 18.790 55.610 76.320 1.00 0.00 ATOM 29142 H1 SOL 4509 19.710 55.860 76.330 1.00 0.00 ATOM 29143 H2 SOL 4509 18.670 55.080 77.110 1.00 0.00 ATOM 29144 OH2 SOL 4510 55.890 10.850 75.670 1.00 0.00 ATOM 29145 H1 SOL 4510 55.990 11.280 74.820 1.00 0.00 ATOM 29146 H2 SOL 4510 55.120 11.260 76.060 1.00 0.00 ATOM 29147 OH2 SOL 4511 40.250 46.580 11.430 1.00 0.00 ATOM 29148 H1 SOL 4511 39.670 46.600 12.190 1.00 0.00 ATOM 29149 H2 SOL 4511 39.710 46.920 10.710 1.00 0.00 ATOM 29150 OH2 SOL 4512 50.560 4.170 63.640 1.00 0.00 ATOM 29151 H1 SOL 4512 49.690 3.930 63.970 1.00 0.00 ATOM 29152 H2 SOL 4512 50.550 3.890 62.720 1.00 0.00 ATOM 29153 OH2 SOL 4513 2.850 17.540 10.780 1.00 0.00 ATOM 29154 H1 SOL 4513 2.850 16.590 10.950 1.00 0.00 ATOM 29155 H2 SOL 4513 2.930 17.610 9.830 1.00 0.00 ATOM 29156 OH2 SOL 4514 14.930 28.820 21.180 1.00 0.00 ATOM 29157 H1 SOL 4514 15.060 28.510 22.080 1.00 0.00 ATOM 29158 H2 SOL 4514 14.580 28.060 20.720 1.00 0.00 ATOM 29159 OH2 SOL 4515 54.280 19.340 25.250 1.00 0.00 ATOM 29160 H1 SOL 4515 53.690 19.400 26.000 1.00 0.00 ATOM 29161 H2 SOL 4515 55.130 19.120 25.630 1.00 0.00 ATOM 29162 OH2 SOL 4516 55.180 7.630 23.320 1.00 0.00 ATOM 29163 H1 SOL 4516 55.610 7.650 22.460 1.00 0.00 ATOM 29164 H2 SOL 4516 55.690 7.010 23.830 1.00 0.00 ATOM 29165 OH2 SOL 4517 44.200 56.020 68.460 1.00 0.00 ATOM 29166 H1 SOL 4517 44.520 56.900 68.660 1.00 0.00 ATOM 29167 H2 SOL 4517 43.280 56.130 68.260 1.00 0.00 ATOM 29168 OH2 SOL 4518 22.270 32.760 7.590 1.00 0.00 ATOM 29169 H1 SOL 4518 22.280 32.670 8.540 1.00 0.00 ATOM 29170 H2 SOL 4518 23.180 32.700 7.330 1.00 0.00 ATOM 29171 OH2 SOL 4519 57.290 3.870 69.870 1.00 0.00 ATOM 29172 H1 SOL 4519 57.270 3.290 70.630 1.00 0.00 ATOM 29173 H2 SOL 4519 56.360 4.030 69.670 1.00 0.00 ATOM 29174 OH2 SOL 4520 43.680 56.040 79.300 1.00 0.00 ATOM 29175 H1 SOL 4520 43.530 56.840 79.800 1.00 0.00 ATOM 29176 H2 SOL 4520 43.040 56.090 78.580 1.00 0.00 ATOM 29177 OH2 SOL 4521 9.780 12.100 69.310 1.00 0.00 ATOM 29178 H1 SOL 4521 10.140 11.480 69.950 1.00 0.00 ATOM 29179 H2 SOL 4521 9.130 11.590 68.830 1.00 0.00 ATOM 29180 OH2 SOL 4522 49.540 21.740 83.580 1.00 0.00 ATOM 29181 H1 SOL 4522 49.770 20.810 83.640 1.00 0.00 ATOM 29182 H2 SOL 4522 49.240 21.970 84.460 1.00 0.00 ATOM 29183 OH2 SOL 4523 46.620 48.360 77.120 1.00 0.00 ATOM 29184 H1 SOL 4523 46.530 47.430 77.330 1.00 0.00 ATOM 29185 H2 SOL 4523 46.660 48.800 77.970 1.00 0.00 ATOM 29186 OH2 SOL 4524 4.590 24.210 2.760 1.00 0.00 ATOM 29187 H1 SOL 4524 4.580 24.900 2.090 1.00 0.00 ATOM 29188 H2 SOL 4524 5.280 23.610 2.490 1.00 0.00 ATOM 29189 OH2 SOL 4525 43.060 14.040 8.100 1.00 0.00 ATOM 29190 H1 SOL 4525 43.050 13.430 8.840 1.00 0.00 ATOM 29191 H2 SOL 4525 43.900 14.490 8.180 1.00 0.00 ATOM 29192 OH2 SOL 4526 33.760 23.930 72.510 1.00 0.00 ATOM 29193 H1 SOL 4526 33.700 23.060 72.130 1.00 0.00 ATOM 29194 H2 SOL 4526 34.110 24.480 71.810 1.00 0.00 ATOM 29195 OH2 SOL 4527 3.030 49.830 63.950 1.00 0.00 ATOM 29196 H1 SOL 4527 2.310 49.460 63.440 1.00 0.00 ATOM 29197 H2 SOL 4527 3.420 49.090 64.400 1.00 0.00 ATOM 29198 OH2 SOL 4528 23.300 47.000 13.030 1.00 0.00 ATOM 29199 H1 SOL 4528 23.940 46.290 12.950 1.00 0.00 ATOM 29200 H2 SOL 4528 22.500 46.640 12.640 1.00 0.00 ATOM 29201 OH2 SOL 4529 49.980 19.610 74.480 1.00 0.00 ATOM 29202 H1 SOL 4529 49.460 19.800 73.700 1.00 0.00 ATOM 29203 H2 SOL 4529 49.340 19.550 75.190 1.00 0.00 ATOM 29204 OH2 SOL 4530 55.490 16.480 5.680 1.00 0.00 ATOM 29205 H1 SOL 4530 55.980 16.780 6.450 1.00 0.00 ATOM 29206 H2 SOL 4530 54.620 16.860 5.790 1.00 0.00 ATOM 29207 OH2 SOL 4531 38.330 53.900 15.470 1.00 0.00 ATOM 29208 H1 SOL 4531 37.880 53.560 14.700 1.00 0.00 ATOM 29209 H2 SOL 4531 37.650 53.960 16.140 1.00 0.00 ATOM 29210 OH2 SOL 4532 11.720 37.590 12.810 1.00 0.00 ATOM 29211 H1 SOL 4532 10.980 37.390 13.380 1.00 0.00 ATOM 29212 H2 SOL 4532 12.490 37.310 13.300 1.00 0.00 ATOM 29213 OH2 SOL 4533 39.200 34.460 10.800 1.00 0.00 ATOM 29214 H1 SOL 4533 39.650 33.620 10.680 1.00 0.00 ATOM 29215 H2 SOL 4533 39.190 34.590 11.750 1.00 0.00 ATOM 29216 OH2 SOL 4534 6.330 10.200 71.370 1.00 0.00 ATOM 29217 H1 SOL 4534 5.700 10.710 70.870 1.00 0.00 ATOM 29218 H2 SOL 4534 6.600 9.500 70.770 1.00 0.00 ATOM 29219 OH2 SOL 4535 48.210 36.060 3.750 1.00 0.00 ATOM 29220 H1 SOL 4535 47.620 35.370 3.460 1.00 0.00 ATOM 29221 H2 SOL 4535 49.060 35.630 3.840 1.00 0.00 ATOM 29222 OH2 SOL 4536 52.860 10.140 72.990 1.00 0.00 ATOM 29223 H1 SOL 4536 52.780 9.500 73.710 1.00 0.00 ATOM 29224 H2 SOL 4536 53.590 9.820 72.470 1.00 0.00 ATOM 29225 OH2 SOL 4537 19.280 16.020 70.610 1.00 0.00 ATOM 29226 H1 SOL 4537 19.520 16.780 71.130 1.00 0.00 ATOM 29227 H2 SOL 4537 18.970 15.380 71.250 1.00 0.00 ATOM 29228 OH2 SOL 4538 47.930 11.860 14.030 1.00 0.00 ATOM 29229 H1 SOL 4538 47.770 11.900 14.970 1.00 0.00 ATOM 29230 H2 SOL 4538 48.540 12.580 13.860 1.00 0.00 ATOM 29231 OH2 SOL 4539 36.890 37.680 76.200 1.00 0.00 ATOM 29232 H1 SOL 4539 37.550 37.530 75.520 1.00 0.00 ATOM 29233 H2 SOL 4539 36.270 38.290 75.810 1.00 0.00 ATOM 29234 OH2 SOL 4540 22.280 51.080 67.550 1.00 0.00 ATOM 29235 H1 SOL 4540 21.510 51.420 68.000 1.00 0.00 ATOM 29236 H2 SOL 4540 22.150 51.300 66.630 1.00 0.00 ATOM 29237 OH2 SOL 4541 29.440 22.020 0.070 1.00 0.00 ATOM 29238 H1 SOL 4541 28.980 22.850 -0.050 1.00 0.00 ATOM 29239 H2 SOL 4541 30.230 22.250 0.570 1.00 0.00 ATOM 29240 OH2 SOL 4542 29.730 1.960 64.580 1.00 0.00 ATOM 29241 H1 SOL 4542 29.690 2.130 65.520 1.00 0.00 ATOM 29242 H2 SOL 4542 30.440 1.340 64.470 1.00 0.00 ATOM 29243 OH2 SOL 4543 53.830 40.620 9.940 1.00 0.00 ATOM 29244 H1 SOL 4543 54.650 40.300 10.330 1.00 0.00 ATOM 29245 H2 SOL 4543 53.830 40.240 9.060 1.00 0.00 ATOM 29246 OH2 SOL 4544 41.570 48.160 23.190 1.00 0.00 ATOM 29247 H1 SOL 4544 41.610 48.440 24.110 1.00 0.00 ATOM 29248 H2 SOL 4544 41.240 47.270 23.230 1.00 0.00 ATOM 29249 OH2 SOL 4545 48.230 19.750 81.700 1.00 0.00 ATOM 29250 H1 SOL 4545 47.980 20.380 82.380 1.00 0.00 ATOM 29251 H2 SOL 4545 48.490 18.970 82.180 1.00 0.00 ATOM 29252 OH2 SOL 4546 8.830 35.440 21.590 1.00 0.00 ATOM 29253 H1 SOL 4546 9.230 34.720 22.090 1.00 0.00 ATOM 29254 H2 SOL 4546 7.890 35.310 21.700 1.00 0.00 ATOM 29255 OH2 SOL 4547 24.560 15.800 80.830 1.00 0.00 ATOM 29256 H1 SOL 4547 25.240 16.470 80.710 1.00 0.00 ATOM 29257 H2 SOL 4547 24.090 16.080 81.620 1.00 0.00 ATOM 29258 OH2 SOL 4548 1.900 13.070 76.370 1.00 0.00 ATOM 29259 H1 SOL 4548 2.790 13.040 76.740 1.00 0.00 ATOM 29260 H2 SOL 4548 2.030 12.900 75.440 1.00 0.00 ATOM 29261 OH2 SOL 4549 7.320 8.850 21.580 1.00 0.00 ATOM 29262 H1 SOL 4549 7.680 9.240 20.780 1.00 0.00 ATOM 29263 H2 SOL 4549 6.870 9.580 22.010 1.00 0.00 ATOM 29264 OH2 SOL 4550 17.570 17.340 75.470 1.00 0.00 ATOM 29265 H1 SOL 4550 17.620 17.680 76.370 1.00 0.00 ATOM 29266 H2 SOL 4550 17.970 16.470 75.530 1.00 0.00 ATOM 29267 OH2 SOL 4551 14.460 44.970 83.560 1.00 0.00 ATOM 29268 H1 SOL 4551 15.150 45.390 84.080 1.00 0.00 ATOM 29269 H2 SOL 4551 13.990 44.420 84.190 1.00 0.00 ATOM 29270 OH2 SOL 4552 26.310 36.070 5.640 1.00 0.00 ATOM 29271 H1 SOL 4552 26.560 35.900 4.730 1.00 0.00 ATOM 29272 H2 SOL 4552 25.370 36.220 5.600 1.00 0.00 ATOM 29273 OH2 SOL 4553 12.370 9.450 22.210 1.00 0.00 ATOM 29274 H1 SOL 4553 12.750 9.100 23.010 1.00 0.00 ATOM 29275 H2 SOL 4553 12.880 10.240 22.020 1.00 0.00 ATOM 29276 OH2 SOL 4554 10.140 39.600 80.260 1.00 0.00 ATOM 29277 H1 SOL 4554 9.460 39.800 80.890 1.00 0.00 ATOM 29278 H2 SOL 4554 10.940 39.500 80.780 1.00 0.00 ATOM 29279 OH2 SOL 4555 19.750 11.590 14.240 1.00 0.00 ATOM 29280 H1 SOL 4555 20.530 11.100 13.990 1.00 0.00 ATOM 29281 H2 SOL 4555 19.750 11.570 15.200 1.00 0.00 ATOM 29282 OH2 SOL 4556 12.680 43.990 6.410 1.00 0.00 ATOM 29283 H1 SOL 4556 12.000 44.600 6.100 1.00 0.00 ATOM 29284 H2 SOL 4556 13.000 43.570 5.610 1.00 0.00 ATOM 29285 OH2 SOL 4557 2.790 56.650 2.450 1.00 0.00 ATOM 29286 H1 SOL 4557 3.340 55.900 2.220 1.00 0.00 ATOM 29287 H2 SOL 4557 2.620 56.550 3.390 1.00 0.00 ATOM 29288 OH2 SOL 4558 38.050 1.860 12.790 1.00 0.00 ATOM 29289 H1 SOL 4558 38.120 0.930 12.580 1.00 0.00 ATOM 29290 H2 SOL 4558 38.510 2.300 12.080 1.00 0.00 ATOM 29291 OH2 SOL 4559 59.650 4.800 4.350 1.00 0.00 ATOM 29292 H1 SOL 4559 60.130 4.470 5.110 1.00 0.00 ATOM 29293 H2 SOL 4559 59.960 5.700 4.250 1.00 0.00 ATOM 29294 OH2 SOL 4560 41.280 22.210 24.870 1.00 0.00 ATOM 29295 H1 SOL 4560 40.400 22.030 25.200 1.00 0.00 ATOM 29296 H2 SOL 4560 41.150 22.750 24.100 1.00 0.00 ATOM 29297 OH2 SOL 4561 31.960 22.330 0.990 1.00 0.00 ATOM 29298 H1 SOL 4561 32.400 23.180 0.920 1.00 0.00 ATOM 29299 H2 SOL 4561 32.650 21.690 0.830 1.00 0.00 ATOM 29300 OH2 SOL 4562 9.600 53.530 10.820 1.00 0.00 ATOM 29301 H1 SOL 4562 9.930 52.630 10.850 1.00 0.00 ATOM 29302 H2 SOL 4562 9.600 53.820 11.730 1.00 0.00 ATOM 29303 OH2 SOL 4563 60.730 45.200 79.380 1.00 0.00 ATOM 29304 H1 SOL 4563 61.310 45.070 78.630 1.00 0.00 ATOM 29305 H2 SOL 4563 61.320 45.280 80.130 1.00 0.00 ATOM 29306 OH2 SOL 4564 17.460 49.360 63.980 1.00 0.00 ATOM 29307 H1 SOL 4564 16.530 49.290 64.180 1.00 0.00 ATOM 29308 H2 SOL 4564 17.860 48.630 64.450 1.00 0.00 ATOM 29309 OH2 SOL 4565 31.390 46.620 22.130 1.00 0.00 ATOM 29310 H1 SOL 4565 32.210 46.790 22.590 1.00 0.00 ATOM 29311 H2 SOL 4565 30.830 47.370 22.350 1.00 0.00 ATOM 29312 OH2 SOL 4566 58.630 29.910 10.960 1.00 0.00 ATOM 29313 H1 SOL 4566 58.980 29.060 10.710 1.00 0.00 ATOM 29314 H2 SOL 4566 58.450 29.840 11.890 1.00 0.00 ATOM 29315 OH2 SOL 4567 1.850 50.620 10.040 1.00 0.00 ATOM 29316 H1 SOL 4567 1.210 51.260 9.720 1.00 0.00 ATOM 29317 H2 SOL 4567 2.700 50.970 9.770 1.00 0.00 ATOM 29318 OH2 SOL 4568 11.370 51.810 74.030 1.00 0.00 ATOM 29319 H1 SOL 4568 10.560 51.570 73.580 1.00 0.00 ATOM 29320 H2 SOL 4568 11.900 51.010 74.010 1.00 0.00 ATOM 29321 OH2 SOL 4569 41.650 16.420 7.400 1.00 0.00 ATOM 29322 H1 SOL 4569 42.270 15.730 7.640 1.00 0.00 ATOM 29323 H2 SOL 4569 40.800 16.090 7.700 1.00 0.00 ATOM 29324 OH2 SOL 4570 56.990 58.300 22.630 1.00 0.00 ATOM 29325 H1 SOL 4570 56.380 58.020 23.310 1.00 0.00 ATOM 29326 H2 SOL 4570 57.850 58.160 23.010 1.00 0.00 ATOM 29327 OH2 SOL 4571 30.040 47.180 72.470 1.00 0.00 ATOM 29328 H1 SOL 4571 29.160 47.010 72.800 1.00 0.00 ATOM 29329 H2 SOL 4571 30.140 48.130 72.530 1.00 0.00 ATOM 29330 OH2 SOL 4572 19.400 53.990 67.270 1.00 0.00 ATOM 29331 H1 SOL 4572 19.370 53.220 66.700 1.00 0.00 ATOM 29332 H2 SOL 4572 18.640 54.510 67.020 1.00 0.00 ATOM 29333 OH2 SOL 4573 49.590 22.410 80.680 1.00 0.00 ATOM 29334 H1 SOL 4573 49.880 22.030 81.510 1.00 0.00 ATOM 29335 H2 SOL 4573 50.080 21.910 80.010 1.00 0.00 ATOM 29336 OH2 SOL 4574 28.320 27.360 19.170 1.00 0.00 ATOM 29337 H1 SOL 4574 28.690 28.210 19.400 1.00 0.00 ATOM 29338 H2 SOL 4574 28.870 26.720 19.640 1.00 0.00 ATOM 29339 OH2 SOL 4575 48.840 1.050 73.950 1.00 0.00 ATOM 29340 H1 SOL 4575 48.220 0.400 73.640 1.00 0.00 ATOM 29341 H2 SOL 4575 49.700 0.680 73.740 1.00 0.00 ATOM 29342 OH2 SOL 4576 42.950 8.710 10.560 1.00 0.00 ATOM 29343 H1 SOL 4576 42.320 8.060 10.870 1.00 0.00 ATOM 29344 H2 SOL 4576 43.520 8.230 9.960 1.00 0.00 ATOM 29345 OH2 SOL 4577 1.690 6.990 2.490 1.00 0.00 ATOM 29346 H1 SOL 4577 0.860 7.170 2.050 1.00 0.00 ATOM 29347 H2 SOL 4577 1.600 7.400 3.350 1.00 0.00 ATOM 29348 OH2 SOL 4578 19.320 31.400 2.430 1.00 0.00 ATOM 29349 H1 SOL 4578 19.580 32.100 3.010 1.00 0.00 ATOM 29350 H2 SOL 4578 20.040 30.770 2.460 1.00 0.00 ATOM 29351 OH2 SOL 4579 57.000 32.590 14.000 1.00 0.00 ATOM 29352 H1 SOL 4579 56.100 32.300 13.860 1.00 0.00 ATOM 29353 H2 SOL 4579 56.920 33.500 14.300 1.00 0.00 ATOM 29354 OH2 SOL 4580 22.470 17.620 2.540 1.00 0.00 ATOM 29355 H1 SOL 4580 22.300 18.260 1.840 1.00 0.00 ATOM 29356 H2 SOL 4580 22.630 18.160 3.320 1.00 0.00 ATOM 29357 OH2 SOL 4581 12.680 35.780 8.790 1.00 0.00 ATOM 29358 H1 SOL 4581 12.510 36.700 8.610 1.00 0.00 ATOM 29359 H2 SOL 4581 13.590 35.760 9.080 1.00 0.00 ATOM 29360 OH2 SOL 4582 21.550 26.090 75.250 1.00 0.00 ATOM 29361 H1 SOL 4582 22.270 26.720 75.350 1.00 0.00 ATOM 29362 H2 SOL 4582 21.740 25.630 74.430 1.00 0.00 ATOM 29363 OH2 SOL 4583 31.670 36.120 0.300 1.00 0.00 ATOM 29364 H1 SOL 4583 32.130 35.360 -0.030 1.00 0.00 ATOM 29365 H2 SOL 4583 32.170 36.400 1.060 1.00 0.00 ATOM 29366 OH2 SOL 4584 41.630 37.990 16.800 1.00 0.00 ATOM 29367 H1 SOL 4584 42.390 38.510 16.530 1.00 0.00 ATOM 29368 H2 SOL 4584 41.130 37.870 15.990 1.00 0.00 ATOM 29369 OH2 SOL 4585 9.800 31.240 16.450 1.00 0.00 ATOM 29370 H1 SOL 4585 9.660 31.760 15.660 1.00 0.00 ATOM 29371 H2 SOL 4585 8.910 31.060 16.770 1.00 0.00 ATOM 29372 OH2 SOL 4586 10.200 37.260 14.830 1.00 0.00 ATOM 29373 H1 SOL 4586 10.980 37.260 15.390 1.00 0.00 ATOM 29374 H2 SOL 4586 9.860 36.370 14.880 1.00 0.00 ATOM 29375 OH2 SOL 4587 10.910 2.560 0.700 1.00 0.00 ATOM 29376 H1 SOL 4587 10.840 1.650 0.400 1.00 0.00 ATOM 29377 H2 SOL 4587 10.460 3.070 0.020 1.00 0.00 ATOM 29378 OH2 SOL 4588 33.570 8.680 18.160 1.00 0.00 ATOM 29379 H1 SOL 4588 34.040 8.230 17.460 1.00 0.00 ATOM 29380 H2 SOL 4588 33.720 9.610 17.980 1.00 0.00 ATOM 29381 OH2 SOL 4589 1.500 54.770 13.870 1.00 0.00 ATOM 29382 H1 SOL 4589 1.050 55.150 14.620 1.00 0.00 ATOM 29383 H2 SOL 4589 2.420 54.700 14.150 1.00 0.00 ATOM 29384 OH2 SOL 4590 32.290 18.870 0.090 1.00 0.00 ATOM 29385 H1 SOL 4590 32.310 19.590 -0.540 1.00 0.00 ATOM 29386 H2 SOL 4590 31.460 18.960 0.550 1.00 0.00 ATOM 29387 OH2 SOL 4591 15.180 14.890 7.080 1.00 0.00 ATOM 29388 H1 SOL 4591 15.750 15.470 6.580 1.00 0.00 ATOM 29389 H2 SOL 4591 14.860 15.430 7.810 1.00 0.00 ATOM 29390 OH2 SOL 4592 28.100 8.500 75.090 1.00 0.00 ATOM 29391 H1 SOL 4592 27.370 7.930 74.860 1.00 0.00 ATOM 29392 H2 SOL 4592 28.430 8.840 74.250 1.00 0.00 ATOM 29393 OH2 SOL 4593 54.050 48.060 11.360 1.00 0.00 ATOM 29394 H1 SOL 4593 53.750 48.660 10.680 1.00 0.00 ATOM 29395 H2 SOL 4593 54.100 47.210 10.930 1.00 0.00 ATOM 29396 OH2 SOL 4594 12.520 36.450 83.960 1.00 0.00 ATOM 29397 H1 SOL 4594 12.590 36.800 83.070 1.00 0.00 ATOM 29398 H2 SOL 4594 12.580 37.230 84.520 1.00 0.00 ATOM 29399 OH2 SOL 4595 60.210 19.980 81.800 1.00 0.00 ATOM 29400 H1 SOL 4595 60.550 19.550 82.580 1.00 0.00 ATOM 29401 H2 SOL 4595 60.570 19.480 81.070 1.00 0.00 ATOM 29402 OH2 SOL 4596 58.360 5.750 77.370 1.00 0.00 ATOM 29403 H1 SOL 4596 59.260 5.760 77.700 1.00 0.00 ATOM 29404 H2 SOL 4596 57.850 6.210 78.040 1.00 0.00 ATOM 29405 OH2 SOL 4597 16.550 39.330 0.960 1.00 0.00 ATOM 29406 H1 SOL 4597 17.440 39.170 1.290 1.00 0.00 ATOM 29407 H2 SOL 4597 16.390 40.250 1.180 1.00 0.00 ATOM 29408 OH2 SOL 4598 7.250 5.330 5.950 1.00 0.00 ATOM 29409 H1 SOL 4598 8.010 4.830 5.670 1.00 0.00 ATOM 29410 H2 SOL 4598 7.170 5.150 6.880 1.00 0.00 ATOM 29411 OH2 SOL 4599 24.690 38.530 9.290 1.00 0.00 ATOM 29412 H1 SOL 4599 23.850 38.150 9.570 1.00 0.00 ATOM 29413 H2 SOL 4599 25.260 38.410 10.050 1.00 0.00 ATOM 29414 OH2 SOL 4600 7.550 56.070 73.960 1.00 0.00 ATOM 29415 H1 SOL 4600 8.180 55.460 74.340 1.00 0.00 ATOM 29416 H2 SOL 4600 7.460 56.760 74.620 1.00 0.00 ATOM 29417 OH2 SOL 4601 25.890 26.360 76.040 1.00 0.00 ATOM 29418 H1 SOL 4601 26.550 26.790 75.500 1.00 0.00 ATOM 29419 H2 SOL 4601 26.190 25.460 76.120 1.00 0.00 ATOM 29420 OH2 SOL 4602 56.960 49.580 77.640 1.00 0.00 ATOM 29421 H1 SOL 4602 56.960 48.630 77.740 1.00 0.00 ATOM 29422 H2 SOL 4602 56.060 49.800 77.410 1.00 0.00 ATOM 29423 OH2 SOL 4603 7.700 31.850 76.020 1.00 0.00 ATOM 29424 H1 SOL 4603 7.140 31.110 75.800 1.00 0.00 ATOM 29425 H2 SOL 4603 7.440 32.540 75.400 1.00 0.00 ATOM 29426 OH2 SOL 4604 46.010 49.960 26.360 1.00 0.00 ATOM 29427 H1 SOL 4604 46.480 49.310 25.820 1.00 0.00 ATOM 29428 H2 SOL 4604 46.680 50.610 26.580 1.00 0.00 ATOM 29429 OH2 SOL 4605 47.600 10.520 5.110 1.00 0.00 ATOM 29430 H1 SOL 4605 47.000 10.660 5.840 1.00 0.00 ATOM 29431 H2 SOL 4605 47.370 11.200 4.470 1.00 0.00 ATOM 29432 OH2 SOL 4606 53.290 52.460 69.080 1.00 0.00 ATOM 29433 H1 SOL 4606 52.350 52.360 68.960 1.00 0.00 ATOM 29434 H2 SOL 4606 53.470 52.000 69.900 1.00 0.00 ATOM 29435 OH2 SOL 4607 55.520 -0.110 71.240 1.00 0.00 ATOM 29436 H1 SOL 4607 56.450 -0.320 71.340 1.00 0.00 ATOM 29437 H2 SOL 4607 55.370 0.610 71.850 1.00 0.00 ATOM 29438 OH2 SOL 4608 48.460 56.410 8.630 1.00 0.00 ATOM 29439 H1 SOL 4608 49.050 55.920 8.050 1.00 0.00 ATOM 29440 H2 SOL 4608 47.770 55.790 8.840 1.00 0.00 ATOM 29441 OH2 SOL 4609 23.850 27.140 13.520 1.00 0.00 ATOM 29442 H1 SOL 4609 23.480 27.170 12.640 1.00 0.00 ATOM 29443 H2 SOL 4609 24.530 26.470 13.470 1.00 0.00 ATOM 29444 OH2 SOL 4610 31.410 8.160 2.060 1.00 0.00 ATOM 29445 H1 SOL 4610 30.990 7.820 1.270 1.00 0.00 ATOM 29446 H2 SOL 4610 32.300 7.830 2.020 1.00 0.00 ATOM 29447 OH2 SOL 4611 44.970 3.500 20.640 1.00 0.00 ATOM 29448 H1 SOL 4611 45.010 3.480 21.600 1.00 0.00 ATOM 29449 H2 SOL 4611 44.140 3.940 20.450 1.00 0.00 ATOM 29450 OH2 SOL 4612 47.540 18.960 19.230 1.00 0.00 ATOM 29451 H1 SOL 4612 47.890 19.100 20.110 1.00 0.00 ATOM 29452 H2 SOL 4612 47.190 18.070 19.240 1.00 0.00 ATOM 29453 OH2 SOL 4613 51.260 41.230 83.090 1.00 0.00 ATOM 29454 H1 SOL 4613 52.010 41.770 82.850 1.00 0.00 ATOM 29455 H2 SOL 4613 50.500 41.790 82.930 1.00 0.00 ATOM 29456 OH2 SOL 4614 60.190 22.300 79.180 1.00 0.00 ATOM 29457 H1 SOL 4614 60.030 22.840 79.960 1.00 0.00 ATOM 29458 H2 SOL 4614 59.450 22.480 78.610 1.00 0.00 ATOM 29459 OH2 SOL 4615 1.000 10.110 83.620 1.00 0.00 ATOM 29460 H1 SOL 4615 1.740 10.030 83.010 1.00 0.00 ATOM 29461 H2 SOL 4615 0.970 9.260 84.070 1.00 0.00 ATOM 29462 OH2 SOL 4616 41.600 34.360 68.930 1.00 0.00 ATOM 29463 H1 SOL 4616 41.820 34.920 68.190 1.00 0.00 ATOM 29464 H2 SOL 4616 40.830 34.780 69.330 1.00 0.00 ATOM 29465 OH2 SOL 4617 3.490 43.650 78.380 1.00 0.00 ATOM 29466 H1 SOL 4617 3.470 42.810 77.930 1.00 0.00 ATOM 29467 H2 SOL 4617 3.090 43.480 79.230 1.00 0.00 ATOM 29468 OH2 SOL 4618 2.990 49.210 6.470 1.00 0.00 ATOM 29469 H1 SOL 4618 2.220 49.760 6.560 1.00 0.00 ATOM 29470 H2 SOL 4618 3.040 48.720 7.290 1.00 0.00 ATOM 29471 OH2 SOL 4619 5.540 53.770 62.820 1.00 0.00 ATOM 29472 H1 SOL 4619 6.120 54.540 62.850 1.00 0.00 ATOM 29473 H2 SOL 4619 4.660 54.140 62.800 1.00 0.00 ATOM 29474 OH2 SOL 4620 48.050 45.350 65.580 1.00 0.00 ATOM 29475 H1 SOL 4620 47.890 44.630 66.190 1.00 0.00 ATOM 29476 H2 SOL 4620 47.360 45.980 65.780 1.00 0.00 ATOM 29477 OH2 SOL 4621 20.210 8.580 78.070 1.00 0.00 ATOM 29478 H1 SOL 4621 21.060 9.020 78.060 1.00 0.00 ATOM 29479 H2 SOL 4621 20.380 7.720 77.680 1.00 0.00 ATOM 29480 OH2 SOL 4622 5.020 31.180 72.420 1.00 0.00 ATOM 29481 H1 SOL 4622 5.690 31.430 71.790 1.00 0.00 ATOM 29482 H2 SOL 4622 4.460 31.960 72.500 1.00 0.00 ATOM 29483 OH2 SOL 4623 51.530 18.530 24.080 1.00 0.00 ATOM 29484 H1 SOL 4623 50.600 18.680 23.900 1.00 0.00 ATOM 29485 H2 SOL 4623 51.550 18.180 24.970 1.00 0.00 ATOM 29486 OH2 SOL 4624 21.130 36.640 68.210 1.00 0.00 ATOM 29487 H1 SOL 4624 21.370 36.440 69.120 1.00 0.00 ATOM 29488 H2 SOL 4624 20.300 36.170 68.070 1.00 0.00 ATOM 29489 OH2 SOL 4625 3.210 44.540 68.350 1.00 0.00 ATOM 29490 H1 SOL 4625 3.520 44.400 67.450 1.00 0.00 ATOM 29491 H2 SOL 4625 3.350 45.470 68.500 1.00 0.00 ATOM 29492 OH2 SOL 4626 39.720 7.040 74.030 1.00 0.00 ATOM 29493 H1 SOL 4626 40.470 6.470 74.190 1.00 0.00 ATOM 29494 H2 SOL 4626 39.980 7.880 74.410 1.00 0.00 ATOM 29495 OH2 SOL 4627 16.170 4.290 10.620 1.00 0.00 ATOM 29496 H1 SOL 4627 15.490 4.790 11.070 1.00 0.00 ATOM 29497 H2 SOL 4627 16.720 4.940 10.190 1.00 0.00 ATOM 29498 OH2 SOL 4628 35.630 44.590 18.570 1.00 0.00 ATOM 29499 H1 SOL 4628 35.460 45.150 19.330 1.00 0.00 ATOM 29500 H2 SOL 4628 35.020 43.870 18.670 1.00 0.00 ATOM 29501 OH2 SOL 4629 57.910 13.330 9.900 1.00 0.00 ATOM 29502 H1 SOL 4629 58.440 13.810 9.260 1.00 0.00 ATOM 29503 H2 SOL 4629 57.160 13.020 9.400 1.00 0.00 ATOM 29504 OH2 SOL 4630 4.760 20.330 69.880 1.00 0.00 ATOM 29505 H1 SOL 4630 4.410 21.160 70.200 1.00 0.00 ATOM 29506 H2 SOL 4630 4.100 19.680 70.110 1.00 0.00 ATOM 29507 OH2 SOL 4631 46.300 48.810 4.900 1.00 0.00 ATOM 29508 H1 SOL 4631 45.770 49.090 5.650 1.00 0.00 ATOM 29509 H2 SOL 4631 45.730 48.210 4.410 1.00 0.00 ATOM 29510 OH2 SOL 4632 12.330 11.530 19.450 1.00 0.00 ATOM 29511 H1 SOL 4632 12.530 11.650 20.380 1.00 0.00 ATOM 29512 H2 SOL 4632 11.630 12.160 19.270 1.00 0.00 ATOM 29513 OH2 SOL 4633 49.920 2.860 78.510 1.00 0.00 ATOM 29514 H1 SOL 4633 49.220 2.670 77.880 1.00 0.00 ATOM 29515 H2 SOL 4633 49.780 2.240 79.220 1.00 0.00 ATOM 29516 OH2 SOL 4634 0.700 47.350 10.720 1.00 0.00 ATOM 29517 H1 SOL 4634 1.500 47.870 10.570 1.00 0.00 ATOM 29518 H2 SOL 4634 0.740 47.110 11.640 1.00 0.00 ATOM 29519 OH2 SOL 4635 60.620 24.360 -0.210 1.00 0.00 ATOM 29520 H1 SOL 4635 60.350 23.680 0.410 1.00 0.00 ATOM 29521 H2 SOL 4635 61.420 24.730 0.170 1.00 0.00 ATOM 29522 OH2 SOL 4636 20.950 3.520 17.340 1.00 0.00 ATOM 29523 H1 SOL 4636 20.370 4.210 17.030 1.00 0.00 ATOM 29524 H2 SOL 4636 21.370 3.880 18.120 1.00 0.00 ATOM 29525 OH2 SOL 4637 32.160 20.940 25.200 1.00 0.00 ATOM 29526 H1 SOL 4637 31.800 21.690 25.670 1.00 0.00 ATOM 29527 H2 SOL 4637 32.250 20.250 25.870 1.00 0.00 ATOM 29528 OH2 SOL 4638 24.420 5.250 71.440 1.00 0.00 ATOM 29529 H1 SOL 4638 24.240 4.430 70.990 1.00 0.00 ATOM 29530 H2 SOL 4638 25.070 5.690 70.890 1.00 0.00 ATOM 29531 OH2 SOL 4639 43.030 44.020 65.610 1.00 0.00 ATOM 29532 H1 SOL 4639 43.180 44.530 66.400 1.00 0.00 ATOM 29533 H2 SOL 4639 42.220 44.380 65.240 1.00 0.00 ATOM 29534 OH2 SOL 4640 16.110 27.310 14.240 1.00 0.00 ATOM 29535 H1 SOL 4640 16.190 27.950 13.530 1.00 0.00 ATOM 29536 H2 SOL 4640 15.700 26.550 13.830 1.00 0.00 ATOM 29537 OH2 SOL 4641 14.810 2.020 11.210 1.00 0.00 ATOM 29538 H1 SOL 4641 14.620 1.340 10.570 1.00 0.00 ATOM 29539 H2 SOL 4641 15.330 2.670 10.740 1.00 0.00 ATOM 29540 OH2 SOL 4642 48.730 34.600 13.320 1.00 0.00 ATOM 29541 H1 SOL 4642 49.380 34.820 12.650 1.00 0.00 ATOM 29542 H2 SOL 4642 49.250 34.350 14.090 1.00 0.00 ATOM 29543 OH2 SOL 4643 11.400 20.480 12.090 1.00 0.00 ATOM 29544 H1 SOL 4643 11.980 20.530 12.840 1.00 0.00 ATOM 29545 H2 SOL 4643 10.860 19.700 12.250 1.00 0.00 ATOM 29546 OH2 SOL 4644 41.360 9.770 76.850 1.00 0.00 ATOM 29547 H1 SOL 4644 40.900 10.590 76.660 1.00 0.00 ATOM 29548 H2 SOL 4644 41.950 9.640 76.100 1.00 0.00 ATOM 29549 OH2 SOL 4645 33.110 9.770 10.630 1.00 0.00 ATOM 29550 H1 SOL 4645 33.690 9.300 10.020 1.00 0.00 ATOM 29551 H2 SOL 4645 33.490 10.640 10.700 1.00 0.00 ATOM 29552 OH2 SOL 4646 46.020 19.020 80.370 1.00 0.00 ATOM 29553 H1 SOL 4646 45.620 19.760 80.820 1.00 0.00 ATOM 29554 H2 SOL 4646 46.890 18.940 80.760 1.00 0.00 ATOM 29555 OH2 SOL 4647 54.820 1.430 16.170 1.00 0.00 ATOM 29556 H1 SOL 4647 54.580 2.100 16.820 1.00 0.00 ATOM 29557 H2 SOL 4647 54.000 1.260 15.700 1.00 0.00 ATOM 29558 OH2 SOL 4648 58.940 45.200 62.140 1.00 0.00 ATOM 29559 H1 SOL 4648 58.970 45.120 63.090 1.00 0.00 ATOM 29560 H2 SOL 4648 58.420 44.450 61.850 1.00 0.00 ATOM 29561 OH2 SOL 4649 15.510 52.020 64.080 1.00 0.00 ATOM 29562 H1 SOL 4649 15.170 51.150 64.290 1.00 0.00 ATOM 29563 H2 SOL 4649 14.750 52.510 63.760 1.00 0.00 ATOM 29564 OH2 SOL 4650 5.910 19.580 81.370 1.00 0.00 ATOM 29565 H1 SOL 4650 5.010 19.620 81.060 1.00 0.00 ATOM 29566 H2 SOL 4650 6.380 20.230 80.840 1.00 0.00 ATOM 29567 OH2 SOL 4651 49.030 51.820 77.730 1.00 0.00 ATOM 29568 H1 SOL 4651 48.510 52.520 77.330 1.00 0.00 ATOM 29569 H2 SOL 4651 49.150 52.110 78.640 1.00 0.00 ATOM 29570 OH2 SOL 4652 41.870 20.990 74.800 1.00 0.00 ATOM 29571 H1 SOL 4652 41.870 20.060 74.550 1.00 0.00 ATOM 29572 H2 SOL 4652 42.800 21.200 74.900 1.00 0.00 ATOM 29573 OH2 SOL 4653 58.970 37.190 72.000 1.00 0.00 ATOM 29574 H1 SOL 4653 58.500 37.440 72.800 1.00 0.00 ATOM 29575 H2 SOL 4653 59.080 38.020 71.520 1.00 0.00 ATOM 29576 OH2 SOL 4654 43.240 41.210 19.140 1.00 0.00 ATOM 29577 H1 SOL 4654 44.020 41.180 19.690 1.00 0.00 ATOM 29578 H2 SOL 4654 43.550 40.920 18.280 1.00 0.00 ATOM 29579 OH2 SOL 4655 27.510 23.760 65.450 1.00 0.00 ATOM 29580 H1 SOL 4655 28.250 23.350 65.910 1.00 0.00 ATOM 29581 H2 SOL 4655 27.820 24.640 65.240 1.00 0.00 ATOM 29582 OH2 SOL 4656 42.640 49.080 11.530 1.00 0.00 ATOM 29583 H1 SOL 4656 42.120 49.370 12.280 1.00 0.00 ATOM 29584 H2 SOL 4656 42.020 48.630 10.960 1.00 0.00 ATOM 29585 OH2 SOL 4657 45.990 47.890 62.690 1.00 0.00 ATOM 29586 H1 SOL 4657 46.480 48.700 62.540 1.00 0.00 ATOM 29587 H2 SOL 4657 45.670 47.970 63.590 1.00 0.00 ATOM 29588 OH2 SOL 4658 46.700 12.630 22.630 1.00 0.00 ATOM 29589 H1 SOL 4658 46.060 11.970 22.350 1.00 0.00 ATOM 29590 H2 SOL 4658 46.200 13.450 22.670 1.00 0.00 ATOM 29591 OH2 SOL 4659 0.440 20.490 27.140 1.00 0.00 ATOM 29592 H1 SOL 4659 0.360 20.960 27.970 1.00 0.00 ATOM 29593 H2 SOL 4659 0.780 21.140 26.520 1.00 0.00 ATOM 29594 OH2 SOL 4660 52.340 55.290 3.330 1.00 0.00 ATOM 29595 H1 SOL 4660 51.410 55.260 3.550 1.00 0.00 ATOM 29596 H2 SOL 4660 52.490 56.180 3.010 1.00 0.00 ATOM 29597 OH2 SOL 4661 28.280 5.820 15.980 1.00 0.00 ATOM 29598 H1 SOL 4661 28.160 6.410 15.240 1.00 0.00 ATOM 29599 H2 SOL 4661 28.940 6.250 16.530 1.00 0.00 ATOM 29600 OH2 SOL 4662 5.070 2.820 8.100 1.00 0.00 ATOM 29601 H1 SOL 4662 6.000 2.600 8.240 1.00 0.00 ATOM 29602 H2 SOL 4662 4.690 2.000 7.770 1.00 0.00 ATOM 29603 OH2 SOL 4663 32.140 13.280 12.610 1.00 0.00 ATOM 29604 H1 SOL 4663 31.950 14.200 12.810 1.00 0.00 ATOM 29605 H2 SOL 4663 31.290 12.910 12.360 1.00 0.00 ATOM 29606 OH2 SOL 4664 11.010 56.240 68.390 1.00 0.00 ATOM 29607 H1 SOL 4664 10.320 56.580 67.820 1.00 0.00 ATOM 29608 H2 SOL 4664 11.100 55.320 68.130 1.00 0.00 ATOM 29609 OH2 SOL 4665 47.100 17.340 22.350 1.00 0.00 ATOM 29610 H1 SOL 4665 46.470 18.070 22.330 1.00 0.00 ATOM 29611 H2 SOL 4665 47.800 17.650 22.920 1.00 0.00 ATOM 29612 OH2 SOL 4666 57.110 15.100 68.960 1.00 0.00 ATOM 29613 H1 SOL 4666 57.840 15.710 68.790 1.00 0.00 ATOM 29614 H2 SOL 4666 56.470 15.620 69.430 1.00 0.00 ATOM 29615 OH2 SOL 4667 1.400 17.140 83.420 1.00 0.00 ATOM 29616 H1 SOL 4667 2.210 17.420 83.010 1.00 0.00 ATOM 29617 H2 SOL 4667 1.070 16.450 82.840 1.00 0.00 ATOM 29618 OH2 SOL 4668 34.270 28.080 9.790 1.00 0.00 ATOM 29619 H1 SOL 4668 33.750 27.340 10.100 1.00 0.00 ATOM 29620 H2 SOL 4668 34.790 27.720 9.070 1.00 0.00 ATOM 29621 OH2 SOL 4669 48.370 26.580 10.340 1.00 0.00 ATOM 29622 H1 SOL 4669 48.560 27.520 10.330 1.00 0.00 ATOM 29623 H2 SOL 4669 49.180 26.180 10.670 1.00 0.00 ATOM 29624 OH2 SOL 4670 36.620 10.580 10.720 1.00 0.00 ATOM 29625 H1 SOL 4670 35.850 10.010 10.700 1.00 0.00 ATOM 29626 H2 SOL 4670 36.680 10.940 9.830 1.00 0.00 ATOM 29627 OH2 SOL 4671 54.220 34.190 63.900 1.00 0.00 ATOM 29628 H1 SOL 4671 53.320 33.890 63.850 1.00 0.00 ATOM 29629 H2 SOL 4671 54.590 33.990 63.040 1.00 0.00 ATOM 29630 OH2 SOL 4672 51.130 25.490 72.930 1.00 0.00 ATOM 29631 H1 SOL 4672 51.180 25.890 72.060 1.00 0.00 ATOM 29632 H2 SOL 4672 50.340 24.950 72.900 1.00 0.00 ATOM 29633 OH2 SOL 4673 38.940 35.060 13.520 1.00 0.00 ATOM 29634 H1 SOL 4673 38.990 34.550 14.330 1.00 0.00 ATOM 29635 H2 SOL 4673 39.640 35.710 13.600 1.00 0.00 ATOM 29636 OH2 SOL 4674 55.330 26.080 64.880 1.00 0.00 ATOM 29637 H1 SOL 4674 55.020 25.190 64.710 1.00 0.00 ATOM 29638 H2 SOL 4674 56.060 25.960 65.480 1.00 0.00 ATOM 29639 OH2 SOL 4675 36.500 34.040 5.460 1.00 0.00 ATOM 29640 H1 SOL 4675 36.770 33.190 5.810 1.00 0.00 ATOM 29641 H2 SOL 4675 35.590 34.130 5.740 1.00 0.00 ATOM 29642 OH2 SOL 4676 7.860 25.710 3.790 1.00 0.00 ATOM 29643 H1 SOL 4676 8.040 25.740 4.730 1.00 0.00 ATOM 29644 H2 SOL 4676 6.910 25.600 3.740 1.00 0.00 ATOM 29645 OH2 SOL 4677 1.990 20.000 23.830 1.00 0.00 ATOM 29646 H1 SOL 4677 2.830 19.550 23.680 1.00 0.00 ATOM 29647 H2 SOL 4677 1.640 19.600 24.630 1.00 0.00 ATOM 29648 OH2 SOL 4678 29.680 8.840 72.880 1.00 0.00 ATOM 29649 H1 SOL 4678 29.940 9.750 73.020 1.00 0.00 ATOM 29650 H2 SOL 4678 30.500 8.400 72.650 1.00 0.00 ATOM 29651 OH2 SOL 4679 1.510 53.850 8.860 1.00 0.00 ATOM 29652 H1 SOL 4679 2.390 54.000 8.510 1.00 0.00 ATOM 29653 H2 SOL 4679 1.650 53.520 9.740 1.00 0.00 ATOM 29654 OH2 SOL 4680 41.630 35.560 72.440 1.00 0.00 ATOM 29655 H1 SOL 4680 40.700 35.310 72.460 1.00 0.00 ATOM 29656 H2 SOL 4680 42.080 34.790 72.110 1.00 0.00 ATOM 29657 OH2 SOL 4681 5.430 45.720 78.600 1.00 0.00 ATOM 29658 H1 SOL 4681 4.840 45.040 78.270 1.00 0.00 ATOM 29659 H2 SOL 4681 6.110 45.800 77.940 1.00 0.00 ATOM 29660 OH2 SOL 4682 17.960 37.990 19.250 1.00 0.00 ATOM 29661 H1 SOL 4682 17.880 37.800 18.320 1.00 0.00 ATOM 29662 H2 SOL 4682 18.620 37.360 19.560 1.00 0.00 ATOM 29663 OH2 SOL 4683 58.450 15.850 78.890 1.00 0.00 ATOM 29664 H1 SOL 4683 57.780 15.320 78.440 1.00 0.00 ATOM 29665 H2 SOL 4683 58.950 15.220 79.400 1.00 0.00 ATOM 29666 OH2 SOL 4684 32.960 52.830 7.110 1.00 0.00 ATOM 29667 H1 SOL 4684 33.020 52.070 6.530 1.00 0.00 ATOM 29668 H2 SOL 4684 32.100 52.750 7.530 1.00 0.00 ATOM 29669 OH2 SOL 4685 57.600 4.160 18.380 1.00 0.00 ATOM 29670 H1 SOL 4685 56.660 4.250 18.560 1.00 0.00 ATOM 29671 H2 SOL 4685 57.810 4.900 17.810 1.00 0.00 ATOM 29672 OH2 SOL 4686 15.800 42.460 81.100 1.00 0.00 ATOM 29673 H1 SOL 4686 16.500 42.780 81.680 1.00 0.00 ATOM 29674 H2 SOL 4686 15.630 43.200 80.510 1.00 0.00 ATOM 29675 OH2 SOL 4687 12.040 39.620 21.010 1.00 0.00 ATOM 29676 H1 SOL 4687 11.830 39.040 21.740 1.00 0.00 ATOM 29677 H2 SOL 4687 11.200 39.950 20.720 1.00 0.00 ATOM 29678 OH2 SOL 4688 32.640 36.410 71.810 1.00 0.00 ATOM 29679 H1 SOL 4688 32.950 37.080 71.200 1.00 0.00 ATOM 29680 H2 SOL 4688 32.790 36.790 72.670 1.00 0.00 ATOM 29681 OH2 SOL 4689 15.460 35.830 75.900 1.00 0.00 ATOM 29682 H1 SOL 4689 15.580 36.470 76.600 1.00 0.00 ATOM 29683 H2 SOL 4689 15.770 36.270 75.110 1.00 0.00 ATOM 29684 OH2 SOL 4690 11.180 34.330 1.030 1.00 0.00 ATOM 29685 H1 SOL 4690 10.730 34.140 0.210 1.00 0.00 ATOM 29686 H2 SOL 4690 11.580 35.180 0.900 1.00 0.00 ATOM 29687 OH2 SOL 4691 37.460 57.030 13.820 1.00 0.00 ATOM 29688 H1 SOL 4691 38.370 56.800 13.670 1.00 0.00 ATOM 29689 H2 SOL 4691 37.460 57.480 14.670 1.00 0.00 ATOM 29690 OH2 SOL 4692 52.570 11.930 70.580 1.00 0.00 ATOM 29691 H1 SOL 4692 52.190 11.450 71.320 1.00 0.00 ATOM 29692 H2 SOL 4692 52.250 12.820 70.680 1.00 0.00 ATOM 29693 OH2 SOL 4693 28.370 3.890 75.270 1.00 0.00 ATOM 29694 H1 SOL 4693 28.820 4.710 75.480 1.00 0.00 ATOM 29695 H2 SOL 4693 28.560 3.740 74.350 1.00 0.00 ATOM 29696 OH2 SOL 4694 55.160 52.350 19.410 1.00 0.00 ATOM 29697 H1 SOL 4694 55.370 51.440 19.630 1.00 0.00 ATOM 29698 H2 SOL 4694 54.680 52.680 20.170 1.00 0.00 ATOM 29699 OH2 SOL 4695 61.440 23.990 13.690 1.00 0.00 ATOM 29700 H1 SOL 4695 62.120 23.400 13.370 1.00 0.00 ATOM 29701 H2 SOL 4695 60.900 24.160 12.920 1.00 0.00 ATOM 29702 OH2 SOL 4696 37.400 18.390 7.040 1.00 0.00 ATOM 29703 H1 SOL 4696 37.930 18.980 6.500 1.00 0.00 ATOM 29704 H2 SOL 4696 37.500 17.530 6.620 1.00 0.00 ATOM 29705 OH2 SOL 4697 50.730 27.540 67.950 1.00 0.00 ATOM 29706 H1 SOL 4697 51.160 28.260 67.480 1.00 0.00 ATOM 29707 H2 SOL 4697 49.870 27.460 67.540 1.00 0.00 ATOM 29708 OH2 SOL 4698 11.060 27.740 18.590 1.00 0.00 ATOM 29709 H1 SOL 4698 10.360 27.770 17.950 1.00 0.00 ATOM 29710 H2 SOL 4698 11.710 28.360 18.270 1.00 0.00 ATOM 29711 OH2 SOL 4699 5.740 6.300 74.040 1.00 0.00 ATOM 29712 H1 SOL 4699 6.510 6.390 74.610 1.00 0.00 ATOM 29713 H2 SOL 4699 5.140 6.990 74.340 1.00 0.00 ATOM 29714 OH2 SOL 4700 10.690 51.660 24.560 1.00 0.00 ATOM 29715 H1 SOL 4700 11.380 51.910 25.170 1.00 0.00 ATOM 29716 H2 SOL 4700 11.110 51.050 23.950 1.00 0.00 ATOM 29717 OH2 SOL 4701 51.160 47.610 69.110 1.00 0.00 ATOM 29718 H1 SOL 4701 50.920 48.410 68.630 1.00 0.00 ATOM 29719 H2 SOL 4701 50.330 47.170 69.270 1.00 0.00 ATOM 29720 OH2 SOL 4702 7.360 23.870 71.720 1.00 0.00 ATOM 29721 H1 SOL 4702 7.340 24.320 70.870 1.00 0.00 ATOM 29722 H2 SOL 4702 7.810 24.470 72.300 1.00 0.00 ATOM 29723 OH2 SOL 4703 28.910 32.760 75.950 1.00 0.00 ATOM 29724 H1 SOL 4703 29.050 32.490 76.860 1.00 0.00 ATOM 29725 H2 SOL 4703 27.970 32.710 75.820 1.00 0.00 ATOM 29726 OH2 SOL 4704 4.950 26.250 6.720 1.00 0.00 ATOM 29727 H1 SOL 4704 5.610 26.770 7.180 1.00 0.00 ATOM 29728 H2 SOL 4704 4.300 26.890 6.450 1.00 0.00 ATOM 29729 OH2 SOL 4705 36.800 43.800 77.220 1.00 0.00 ATOM 29730 H1 SOL 4705 36.650 44.270 76.400 1.00 0.00 ATOM 29731 H2 SOL 4705 37.560 44.230 77.610 1.00 0.00 ATOM 29732 OH2 SOL 4706 11.570 52.950 6.750 1.00 0.00 ATOM 29733 H1 SOL 4706 12.080 53.280 7.490 1.00 0.00 ATOM 29734 H2 SOL 4706 10.660 53.100 7.010 1.00 0.00 ATOM 29735 OH2 SOL 4707 21.130 15.030 1.980 1.00 0.00 ATOM 29736 H1 SOL 4707 20.920 15.900 1.650 1.00 0.00 ATOM 29737 H2 SOL 4707 22.050 15.070 2.230 1.00 0.00 ATOM 29738 OH2 SOL 4708 38.510 0.330 79.870 1.00 0.00 ATOM 29739 H1 SOL 4708 38.190 1.010 79.280 1.00 0.00 ATOM 29740 H2 SOL 4708 37.850 -0.360 79.840 1.00 0.00 ATOM 29741 OH2 SOL 4709 26.770 1.250 82.860 1.00 0.00 ATOM 29742 H1 SOL 4709 25.860 1.540 82.820 1.00 0.00 ATOM 29743 H2 SOL 4709 27.250 1.890 82.340 1.00 0.00 ATOM 29744 OH2 SOL 4710 37.570 31.560 13.770 1.00 0.00 ATOM 29745 H1 SOL 4710 37.640 32.390 14.230 1.00 0.00 ATOM 29746 H2 SOL 4710 36.750 31.170 14.090 1.00 0.00 ATOM 29747 OH2 SOL 4711 45.890 37.470 81.280 1.00 0.00 ATOM 29748 H1 SOL 4711 46.070 36.630 80.860 1.00 0.00 ATOM 29749 H2 SOL 4711 45.000 37.690 81.010 1.00 0.00 ATOM 29750 OH2 SOL 4712 37.400 27.430 13.930 1.00 0.00 ATOM 29751 H1 SOL 4712 38.220 27.010 14.170 1.00 0.00 ATOM 29752 H2 SOL 4712 37.470 27.570 12.980 1.00 0.00 ATOM 29753 OH2 SOL 4713 56.510 0.770 77.830 1.00 0.00 ATOM 29754 H1 SOL 4713 56.600 1.320 77.040 1.00 0.00 ATOM 29755 H2 SOL 4713 57.210 1.060 78.400 1.00 0.00 ATOM 29756 OH2 SOL 4714 44.300 22.140 17.890 1.00 0.00 ATOM 29757 H1 SOL 4714 44.090 21.250 17.600 1.00 0.00 ATOM 29758 H2 SOL 4714 44.200 22.680 17.110 1.00 0.00 ATOM 29759 OH2 SOL 4715 16.620 4.010 3.860 1.00 0.00 ATOM 29760 H1 SOL 4715 15.820 4.360 4.250 1.00 0.00 ATOM 29761 H2 SOL 4715 17.230 3.930 4.600 1.00 0.00 ATOM 29762 OH2 SOL 4716 27.690 2.060 17.920 1.00 0.00 ATOM 29763 H1 SOL 4716 28.400 2.390 18.470 1.00 0.00 ATOM 29764 H2 SOL 4716 27.210 1.450 18.490 1.00 0.00 ATOM 29765 OH2 SOL 4717 20.500 39.750 12.890 1.00 0.00 ATOM 29766 H1 SOL 4717 19.720 39.860 12.350 1.00 0.00 ATOM 29767 H2 SOL 4717 21.120 39.280 12.340 1.00 0.00 ATOM 29768 OH2 SOL 4718 37.590 41.010 19.830 1.00 0.00 ATOM 29769 H1 SOL 4718 37.370 41.900 19.550 1.00 0.00 ATOM 29770 H2 SOL 4718 37.730 41.090 20.770 1.00 0.00 ATOM 29771 OH2 SOL 4719 39.220 55.310 0.590 1.00 0.00 ATOM 29772 H1 SOL 4719 39.650 55.560 -0.230 1.00 0.00 ATOM 29773 H2 SOL 4719 39.070 54.370 0.500 1.00 0.00 ATOM 29774 OH2 SOL 4720 46.270 11.670 70.660 1.00 0.00 ATOM 29775 H1 SOL 4720 46.550 10.800 70.370 1.00 0.00 ATOM 29776 H2 SOL 4720 47.010 12.240 70.460 1.00 0.00 ATOM 29777 OH2 SOL 4721 25.160 55.150 4.110 1.00 0.00 ATOM 29778 H1 SOL 4721 24.440 54.690 4.550 1.00 0.00 ATOM 29779 H2 SOL 4721 25.430 55.820 4.740 1.00 0.00 ATOM 29780 OH2 SOL 4722 61.230 45.670 16.930 1.00 0.00 ATOM 29781 H1 SOL 4722 61.070 46.210 16.160 1.00 0.00 ATOM 29782 H2 SOL 4722 62.090 45.940 17.240 1.00 0.00 ATOM 29783 OH2 SOL 4723 15.970 3.770 73.200 1.00 0.00 ATOM 29784 H1 SOL 4723 16.410 4.500 73.660 1.00 0.00 ATOM 29785 H2 SOL 4723 15.560 4.180 72.440 1.00 0.00 ATOM 29786 OH2 SOL 4724 46.550 12.510 63.120 1.00 0.00 ATOM 29787 H1 SOL 4724 45.670 12.540 63.490 1.00 0.00 ATOM 29788 H2 SOL 4724 47.100 12.180 63.830 1.00 0.00 ATOM 29789 OH2 SOL 4725 4.360 2.000 3.210 1.00 0.00 ATOM 29790 H1 SOL 4725 4.730 1.180 2.870 1.00 0.00 ATOM 29791 H2 SOL 4725 3.500 1.740 3.540 1.00 0.00 ATOM 29792 OH2 SOL 4726 26.790 48.410 28.000 1.00 0.00 ATOM 29793 H1 SOL 4726 26.670 49.120 28.640 1.00 0.00 ATOM 29794 H2 SOL 4726 27.310 47.760 28.470 1.00 0.00 ATOM 29795 OH2 SOL 4727 55.420 27.300 7.050 1.00 0.00 ATOM 29796 H1 SOL 4727 54.600 26.830 6.880 1.00 0.00 ATOM 29797 H2 SOL 4727 55.960 26.680 7.530 1.00 0.00 ATOM 29798 OH2 SOL 4728 30.800 11.960 69.160 1.00 0.00 ATOM 29799 H1 SOL 4728 31.510 11.910 69.800 1.00 0.00 ATOM 29800 H2 SOL 4728 30.770 11.100 68.750 1.00 0.00 ATOM 29801 OH2 SOL 4729 49.960 39.600 9.070 1.00 0.00 ATOM 29802 H1 SOL 4729 49.760 38.870 8.500 1.00 0.00 ATOM 29803 H2 SOL 4729 50.400 40.240 8.500 1.00 0.00 ATOM 29804 OH2 SOL 4730 53.670 25.220 71.160 1.00 0.00 ATOM 29805 H1 SOL 4730 53.840 26.100 70.820 1.00 0.00 ATOM 29806 H2 SOL 4730 53.790 25.300 72.100 1.00 0.00 ATOM 29807 OH2 SOL 4731 36.410 4.910 74.520 1.00 0.00 ATOM 29808 H1 SOL 4731 36.430 5.250 75.420 1.00 0.00 ATOM 29809 H2 SOL 4731 36.530 3.970 74.620 1.00 0.00 ATOM 29810 OH2 SOL 4732 5.450 50.720 16.380 1.00 0.00 ATOM 29811 H1 SOL 4732 5.840 51.590 16.510 1.00 0.00 ATOM 29812 H2 SOL 4732 6.210 50.150 16.220 1.00 0.00 ATOM 29813 OH2 SOL 4733 6.620 52.310 80.600 1.00 0.00 ATOM 29814 H1 SOL 4733 7.020 51.610 80.090 1.00 0.00 ATOM 29815 H2 SOL 4733 6.760 52.060 81.510 1.00 0.00 ATOM 29816 OH2 SOL 4734 47.050 24.590 83.680 1.00 0.00 ATOM 29817 H1 SOL 4734 46.620 25.050 84.400 1.00 0.00 ATOM 29818 H2 SOL 4734 47.690 25.220 83.350 1.00 0.00 ATOM 29819 OH2 SOL 4735 17.580 44.020 74.610 1.00 0.00 ATOM 29820 H1 SOL 4735 18.160 43.280 74.830 1.00 0.00 ATOM 29821 H2 SOL 4735 17.500 44.500 75.430 1.00 0.00 ATOM 29822 OH2 SOL 4736 17.390 30.820 68.110 1.00 0.00 ATOM 29823 H1 SOL 4736 17.450 30.360 68.960 1.00 0.00 ATOM 29824 H2 SOL 4736 18.240 31.240 68.000 1.00 0.00 ATOM 29825 OH2 SOL 4737 58.990 58.300 9.310 1.00 0.00 ATOM 29826 H1 SOL 4737 59.930 58.210 9.110 1.00 0.00 ATOM 29827 H2 SOL 4737 58.820 59.240 9.230 1.00 0.00 ATOM 29828 OH2 SOL 4738 10.270 7.330 70.230 1.00 0.00 ATOM 29829 H1 SOL 4738 9.850 7.890 69.580 1.00 0.00 ATOM 29830 H2 SOL 4738 9.550 6.830 70.610 1.00 0.00 ATOM 29831 OH2 SOL 4739 16.850 2.430 8.550 1.00 0.00 ATOM 29832 H1 SOL 4739 17.630 1.990 8.900 1.00 0.00 ATOM 29833 H2 SOL 4739 16.520 2.950 9.280 1.00 0.00 ATOM 29834 OH2 SOL 4740 59.470 34.170 19.630 1.00 0.00 ATOM 29835 H1 SOL 4740 59.830 35.000 19.940 1.00 0.00 ATOM 29836 H2 SOL 4740 60.190 33.540 19.710 1.00 0.00 ATOM 29837 OH2 SOL 4741 14.240 17.430 1.370 1.00 0.00 ATOM 29838 H1 SOL 4741 14.960 16.870 1.110 1.00 0.00 ATOM 29839 H2 SOL 4741 14.590 18.320 1.320 1.00 0.00 ATOM 29840 OH2 SOL 4742 43.350 51.530 15.340 1.00 0.00 ATOM 29841 H1 SOL 4742 43.330 50.770 15.920 1.00 0.00 ATOM 29842 H2 SOL 4742 42.590 52.050 15.590 1.00 0.00 ATOM 29843 OH2 SOL 4743 50.130 1.670 62.210 1.00 0.00 ATOM 29844 H1 SOL 4743 50.930 2.080 61.890 1.00 0.00 ATOM 29845 H2 SOL 4743 50.160 0.780 61.860 1.00 0.00 ATOM 29846 OH2 SOL 4744 42.150 42.360 8.140 1.00 0.00 ATOM 29847 H1 SOL 4744 41.760 41.480 8.160 1.00 0.00 ATOM 29848 H2 SOL 4744 43.060 42.220 8.370 1.00 0.00 ATOM 29849 OH2 SOL 4745 53.180 8.120 74.740 1.00 0.00 ATOM 29850 H1 SOL 4745 54.010 7.720 74.490 1.00 0.00 ATOM 29851 H2 SOL 4745 53.030 7.810 75.640 1.00 0.00 ATOM 29852 OH2 SOL 4746 50.880 3.940 17.060 1.00 0.00 ATOM 29853 H1 SOL 4746 51.460 4.590 17.450 1.00 0.00 ATOM 29854 H2 SOL 4746 50.590 3.400 17.790 1.00 0.00 ATOM 29855 OH2 SOL 4747 13.290 41.500 80.340 1.00 0.00 ATOM 29856 H1 SOL 4747 13.040 40.770 80.910 1.00 0.00 ATOM 29857 H2 SOL 4747 14.080 41.860 80.730 1.00 0.00 ATOM 29858 OH2 SOL 4748 3.280 19.500 84.190 1.00 0.00 ATOM 29859 H1 SOL 4748 2.430 19.920 84.090 1.00 0.00 ATOM 29860 H2 SOL 4748 3.450 19.080 83.340 1.00 0.00 ATOM 29861 OH2 SOL 4749 36.990 31.570 27.710 1.00 0.00 ATOM 29862 H1 SOL 4749 36.040 31.680 27.700 1.00 0.00 ATOM 29863 H2 SOL 4749 37.310 32.400 28.080 1.00 0.00 ATOM 29864 OH2 SOL 4750 18.700 56.940 69.400 1.00 0.00 ATOM 29865 H1 SOL 4750 19.060 56.300 70.010 1.00 0.00 ATOM 29866 H2 SOL 4750 17.760 56.770 69.400 1.00 0.00 ATOM 29867 OH2 SOL 4751 10.250 41.100 73.880 1.00 0.00 ATOM 29868 H1 SOL 4751 10.020 41.570 74.680 1.00 0.00 ATOM 29869 H2 SOL 4751 9.800 41.600 73.180 1.00 0.00 ATOM 29870 OH2 SOL 4752 18.810 31.440 83.350 1.00 0.00 ATOM 29871 H1 SOL 4752 19.660 31.320 83.750 1.00 0.00 ATOM 29872 H2 SOL 4752 18.380 32.110 83.880 1.00 0.00 ATOM 29873 OH2 SOL 4753 27.170 20.000 69.700 1.00 0.00 ATOM 29874 H1 SOL 4753 26.710 20.080 70.530 1.00 0.00 ATOM 29875 H2 SOL 4753 27.030 19.090 69.430 1.00 0.00 ATOM 29876 OH2 SOL 4754 61.700 1.800 69.100 1.00 0.00 ATOM 29877 H1 SOL 4754 61.270 2.290 68.400 1.00 0.00 ATOM 29878 H2 SOL 4754 61.050 1.140 69.360 1.00 0.00 ATOM 29879 OH2 SOL 4755 19.680 11.830 83.160 1.00 0.00 ATOM 29880 H1 SOL 4755 19.760 11.140 83.830 1.00 0.00 ATOM 29881 H2 SOL 4755 19.070 11.470 82.520 1.00 0.00 ATOM 29882 OH2 SOL 4756 47.870 58.310 64.040 1.00 0.00 ATOM 29883 H1 SOL 4756 47.040 58.700 64.300 1.00 0.00 ATOM 29884 H2 SOL 4756 48.510 58.670 64.660 1.00 0.00 ATOM 29885 OH2 SOL 4757 33.840 56.400 78.650 1.00 0.00 ATOM 29886 H1 SOL 4757 33.910 56.810 77.790 1.00 0.00 ATOM 29887 H2 SOL 4757 34.710 56.030 78.810 1.00 0.00 ATOM 29888 OH2 SOL 4758 4.720 34.270 14.460 1.00 0.00 ATOM 29889 H1 SOL 4758 4.260 35.070 14.700 1.00 0.00 ATOM 29890 H2 SOL 4758 5.420 34.570 13.880 1.00 0.00 ATOM 29891 OH2 SOL 4759 11.640 39.130 1.150 1.00 0.00 ATOM 29892 H1 SOL 4759 12.230 39.020 1.890 1.00 0.00 ATOM 29893 H2 SOL 4759 10.900 39.630 1.510 1.00 0.00 ATOM 29894 OH2 SOL 4760 10.380 45.080 21.130 1.00 0.00 ATOM 29895 H1 SOL 4760 9.840 44.810 21.860 1.00 0.00 ATOM 29896 H2 SOL 4760 10.610 45.990 21.310 1.00 0.00 ATOM 29897 OH2 SOL 4761 8.920 55.420 61.150 1.00 0.00 ATOM 29898 H1 SOL 4761 8.580 56.310 61.300 1.00 0.00 ATOM 29899 H2 SOL 4761 8.590 55.180 60.290 1.00 0.00 ATOM 29900 OH2 SOL 4762 1.800 47.490 19.950 1.00 0.00 ATOM 29901 H1 SOL 4762 2.420 47.440 20.680 1.00 0.00 ATOM 29902 H2 SOL 4762 2.130 46.860 19.310 1.00 0.00 ATOM 29903 OH2 SOL 4763 52.650 21.430 7.050 1.00 0.00 ATOM 29904 H1 SOL 4763 53.000 21.200 7.910 1.00 0.00 ATOM 29905 H2 SOL 4763 51.770 21.770 7.230 1.00 0.00 ATOM 29906 OH2 SOL 4764 15.230 28.930 16.580 1.00 0.00 ATOM 29907 H1 SOL 4764 15.520 28.510 15.760 1.00 0.00 ATOM 29908 H2 SOL 4764 14.890 28.220 17.110 1.00 0.00 ATOM 29909 OH2 SOL 4765 57.040 30.750 19.080 1.00 0.00 ATOM 29910 H1 SOL 4765 56.300 30.140 19.070 1.00 0.00 ATOM 29911 H2 SOL 4765 56.790 31.410 19.720 1.00 0.00 ATOM 29912 OH2 SOL 4766 42.360 13.070 81.520 1.00 0.00 ATOM 29913 H1 SOL 4766 41.610 12.520 81.770 1.00 0.00 ATOM 29914 H2 SOL 4766 42.940 12.480 81.040 1.00 0.00 ATOM 29915 OH2 SOL 4767 25.360 58.150 64.930 1.00 0.00 ATOM 29916 H1 SOL 4767 26.160 58.280 64.430 1.00 0.00 ATOM 29917 H2 SOL 4767 24.670 58.560 64.400 1.00 0.00 ATOM 29918 OH2 SOL 4768 11.640 17.520 7.850 1.00 0.00 ATOM 29919 H1 SOL 4768 12.440 17.300 8.340 1.00 0.00 ATOM 29920 H2 SOL 4768 11.340 18.340 8.240 1.00 0.00 ATOM 29921 OH2 SOL 4769 18.400 14.350 66.090 1.00 0.00 ATOM 29922 H1 SOL 4769 17.650 14.920 65.900 1.00 0.00 ATOM 29923 H2 SOL 4769 18.190 13.520 65.650 1.00 0.00 ATOM 29924 OH2 SOL 4770 29.210 52.340 17.990 1.00 0.00 ATOM 29925 H1 SOL 4770 29.020 51.890 18.820 1.00 0.00 ATOM 29926 H2 SOL 4770 28.350 52.560 17.630 1.00 0.00 ATOM 29927 OH2 SOL 4771 27.950 13.140 70.360 1.00 0.00 ATOM 29928 H1 SOL 4771 28.320 14.000 70.540 1.00 0.00 ATOM 29929 H2 SOL 4771 27.990 12.680 71.200 1.00 0.00 ATOM 29930 OH2 SOL 4772 52.960 6.990 0.180 1.00 0.00 ATOM 29931 H1 SOL 4772 53.840 7.280 0.410 1.00 0.00 ATOM 29932 H2 SOL 4772 52.880 6.110 0.550 1.00 0.00 ATOM 29933 OH2 SOL 4773 4.050 32.090 12.550 1.00 0.00 ATOM 29934 H1 SOL 4773 4.460 32.830 12.990 1.00 0.00 ATOM 29935 H2 SOL 4773 3.450 31.720 13.200 1.00 0.00 ATOM 29936 OH2 SOL 4774 30.810 5.340 75.020 1.00 0.00 ATOM 29937 H1 SOL 4774 31.770 5.320 74.950 1.00 0.00 ATOM 29938 H2 SOL 4774 30.510 5.360 74.110 1.00 0.00 ATOM 29939 OH2 SOL 4775 -0.100 22.540 5.410 1.00 0.00 ATOM 29940 H1 SOL 4775 0.380 23.330 5.670 1.00 0.00 ATOM 29941 H2 SOL 4775 0.570 21.850 5.410 1.00 0.00 ATOM 29942 OH2 SOL 4776 42.720 35.950 77.850 1.00 0.00 ATOM 29943 H1 SOL 4776 43.380 36.540 77.460 1.00 0.00 ATOM 29944 H2 SOL 4776 42.650 35.230 77.220 1.00 0.00 ATOM 29945 OH2 SOL 4777 3.890 47.100 8.470 1.00 0.00 ATOM 29946 H1 SOL 4777 3.910 47.710 9.200 1.00 0.00 ATOM 29947 H2 SOL 4777 3.400 46.350 8.790 1.00 0.00 ATOM 29948 OH2 SOL 4778 25.740 18.140 15.500 1.00 0.00 ATOM 29949 H1 SOL 4778 24.800 18.300 15.390 1.00 0.00 ATOM 29950 H2 SOL 4778 26.040 17.890 14.620 1.00 0.00 ATOM 29951 OH2 SOL 4779 31.940 23.220 12.440 1.00 0.00 ATOM 29952 H1 SOL 4779 31.890 22.420 12.960 1.00 0.00 ATOM 29953 H2 SOL 4779 31.070 23.620 12.540 1.00 0.00 ATOM 29954 OH2 SOL 4780 19.550 44.490 5.160 1.00 0.00 ATOM 29955 H1 SOL 4780 19.740 44.310 6.080 1.00 0.00 ATOM 29956 H2 SOL 4780 20.300 44.120 4.690 1.00 0.00 ATOM 29957 OH2 SOL 4781 24.970 12.880 73.460 1.00 0.00 ATOM 29958 H1 SOL 4781 24.420 12.780 74.240 1.00 0.00 ATOM 29959 H2 SOL 4781 25.190 11.990 73.200 1.00 0.00 ATOM 29960 OH2 SOL 4782 47.970 54.860 80.480 1.00 0.00 ATOM 29961 H1 SOL 4782 48.420 55.010 81.320 1.00 0.00 ATOM 29962 H2 SOL 4782 48.040 53.910 80.340 1.00 0.00 ATOM 29963 OH2 SOL 4783 26.020 2.110 5.300 1.00 0.00 ATOM 29964 H1 SOL 4783 26.730 2.430 5.850 1.00 0.00 ATOM 29965 H2 SOL 4783 25.230 2.220 5.840 1.00 0.00 ATOM 29966 OH2 SOL 4784 37.460 23.370 8.430 1.00 0.00 ATOM 29967 H1 SOL 4784 36.940 22.570 8.330 1.00 0.00 ATOM 29968 H2 SOL 4784 36.810 24.060 8.560 1.00 0.00 ATOM 29969 OH2 SOL 4785 26.040 2.870 66.210 1.00 0.00 ATOM 29970 H1 SOL 4785 25.500 3.530 65.780 1.00 0.00 ATOM 29971 H2 SOL 4785 26.640 2.570 65.520 1.00 0.00 ATOM 29972 OH2 SOL 4786 19.430 54.530 78.880 1.00 0.00 ATOM 29973 H1 SOL 4786 18.890 53.750 78.980 1.00 0.00 ATOM 29974 H2 SOL 4786 20.290 54.270 79.190 1.00 0.00 ATOM 29975 OH2 SOL 4787 13.290 20.340 17.630 1.00 0.00 ATOM 29976 H1 SOL 4787 14.050 20.930 17.620 1.00 0.00 ATOM 29977 H2 SOL 4787 12.570 20.870 17.280 1.00 0.00 ATOM 29978 OH2 SOL 4788 47.000 23.780 31.200 1.00 0.00 ATOM 29979 H1 SOL 4788 47.940 23.570 31.130 1.00 0.00 ATOM 29980 H2 SOL 4788 46.710 23.880 30.300 1.00 0.00 ATOM 29981 OH2 SOL 4789 51.390 12.170 14.890 1.00 0.00 ATOM 29982 H1 SOL 4789 52.170 12.640 14.610 1.00 0.00 ATOM 29983 H2 SOL 4789 50.660 12.660 14.500 1.00 0.00 ATOM 29984 OH2 SOL 4790 36.040 16.600 60.670 1.00 0.00 ATOM 29985 H1 SOL 4790 35.430 15.860 60.690 1.00 0.00 ATOM 29986 H2 SOL 4790 36.780 16.280 60.150 1.00 0.00 ATOM 29987 OH2 SOL 4791 49.100 45.050 2.280 1.00 0.00 ATOM 29988 H1 SOL 4791 48.590 44.240 2.380 1.00 0.00 ATOM 29989 H2 SOL 4791 49.880 44.780 1.790 1.00 0.00 ATOM 29990 OH2 SOL 4792 46.430 8.100 75.460 1.00 0.00 ATOM 29991 H1 SOL 4792 46.340 8.950 75.050 1.00 0.00 ATOM 29992 H2 SOL 4792 45.770 8.090 76.150 1.00 0.00 ATOM 29993 OH2 SOL 4793 34.630 21.050 13.550 1.00 0.00 ATOM 29994 H1 SOL 4793 33.810 20.650 13.840 1.00 0.00 ATOM 29995 H2 SOL 4793 34.800 21.740 14.190 1.00 0.00 ATOM 29996 OH2 SOL 4794 23.310 29.930 76.410 1.00 0.00 ATOM 29997 H1 SOL 4794 23.500 30.530 75.680 1.00 0.00 ATOM 29998 H2 SOL 4794 23.510 29.060 76.060 1.00 0.00 ATOM 29999 OH2 SOL 4795 4.870 55.160 11.490 1.00 0.00 ATOM 30000 H1 SOL 4795 5.000 55.660 10.680 1.00 0.00 ATOM 30001 H2 SOL 4795 5.600 55.430 12.050 1.00 0.00 ATOM 30002 OH2 SOL 4796 43.620 33.120 81.030 1.00 0.00 ATOM 30003 H1 SOL 4796 44.530 32.830 81.000 1.00 0.00 ATOM 30004 H2 SOL 4796 43.630 33.980 80.600 1.00 0.00 ATOM 30005 OH2 SOL 4797 54.560 30.630 62.660 1.00 0.00 ATOM 30006 H1 SOL 4797 55.330 31.150 62.850 1.00 0.00 ATOM 30007 H2 SOL 4797 54.680 29.830 63.170 1.00 0.00 ATOM 30008 OH2 SOL 4798 38.290 4.670 67.990 1.00 0.00 ATOM 30009 H1 SOL 4798 37.840 5.310 67.430 1.00 0.00 ATOM 30010 H2 SOL 4798 38.630 4.020 67.370 1.00 0.00 ATOM 30011 OH2 SOL 4799 12.900 27.570 4.410 1.00 0.00 ATOM 30012 H1 SOL 4799 12.110 27.200 4.020 1.00 0.00 ATOM 30013 H2 SOL 4799 13.620 27.110 3.990 1.00 0.00 ATOM 30014 OH2 SOL 4800 5.300 45.220 71.520 1.00 0.00 ATOM 30015 H1 SOL 4800 5.940 45.290 72.230 1.00 0.00 ATOM 30016 H2 SOL 4800 5.150 44.280 71.430 1.00 0.00 ATOM 30017 OH2 SOL 4801 2.900 12.840 66.580 1.00 0.00 ATOM 30018 H1 SOL 4801 3.130 13.380 67.340 1.00 0.00 ATOM 30019 H2 SOL 4801 2.720 13.480 65.890 1.00 0.00 ATOM 30020 OH2 SOL 4802 61.240 14.990 3.410 1.00 0.00 ATOM 30021 H1 SOL 4802 61.340 14.050 3.300 1.00 0.00 ATOM 30022 H2 SOL 4802 60.560 15.080 4.080 1.00 0.00 ATOM 30023 OH2 SOL 4803 31.750 35.220 78.670 1.00 0.00 ATOM 30024 H1 SOL 4803 31.980 34.340 78.390 1.00 0.00 ATOM 30025 H2 SOL 4803 32.340 35.790 78.170 1.00 0.00 ATOM 30026 OH2 SOL 4804 32.220 48.900 61.040 1.00 0.00 ATOM 30027 H1 SOL 4804 32.980 48.510 61.470 1.00 0.00 ATOM 30028 H2 SOL 4804 31.600 48.170 60.940 1.00 0.00 ATOM 30029 OH2 SOL 4805 18.240 46.510 71.710 1.00 0.00 ATOM 30030 H1 SOL 4805 17.680 47.130 71.240 1.00 0.00 ATOM 30031 H2 SOL 4805 18.740 47.060 72.310 1.00 0.00 ATOM 30032 OH2 SOL 4806 18.540 24.710 76.370 1.00 0.00 ATOM 30033 H1 SOL 4806 18.310 24.140 77.110 1.00 0.00 ATOM 30034 H2 SOL 4806 17.750 25.230 76.220 1.00 0.00 ATOM 30035 OH2 SOL 4807 48.720 20.390 72.240 1.00 0.00 ATOM 30036 H1 SOL 4807 48.190 21.190 72.270 1.00 0.00 ATOM 30037 H2 SOL 4807 49.430 20.600 71.630 1.00 0.00 ATOM 30038 OH2 SOL 4808 41.830 57.530 73.880 1.00 0.00 ATOM 30039 H1 SOL 4808 41.300 57.550 74.670 1.00 0.00 ATOM 30040 H2 SOL 4808 41.220 57.780 73.180 1.00 0.00 ATOM 30041 OH2 SOL 4809 54.550 45.350 80.880 1.00 0.00 ATOM 30042 H1 SOL 4809 55.200 46.040 80.740 1.00 0.00 ATOM 30043 H2 SOL 4809 53.810 45.590 80.330 1.00 0.00 ATOM 30044 OH2 SOL 4810 0.820 44.090 77.140 1.00 0.00 ATOM 30045 H1 SOL 4810 1.620 43.580 77.200 1.00 0.00 ATOM 30046 H2 SOL 4810 0.600 44.080 76.210 1.00 0.00 ATOM 30047 OH2 SOL 4811 35.160 12.310 6.910 1.00 0.00 ATOM 30048 H1 SOL 4811 34.290 11.930 6.870 1.00 0.00 ATOM 30049 H2 SOL 4811 35.160 12.980 6.230 1.00 0.00 ATOM 30050 OH2 SOL 4812 11.380 6.280 77.280 1.00 0.00 ATOM 30051 H1 SOL 4812 12.170 5.840 77.590 1.00 0.00 ATOM 30052 H2 SOL 4812 11.370 6.130 76.340 1.00 0.00 ATOM 30053 OH2 SOL 4813 54.630 7.880 71.670 1.00 0.00 ATOM 30054 H1 SOL 4813 54.840 7.370 72.460 1.00 0.00 ATOM 30055 H2 SOL 4813 55.430 8.390 71.500 1.00 0.00 ATOM 30056 OH2 SOL 4814 8.810 30.360 82.260 1.00 0.00 ATOM 30057 H1 SOL 4814 9.240 29.760 81.650 1.00 0.00 ATOM 30058 H2 SOL 4814 7.930 30.480 81.900 1.00 0.00 ATOM 30059 OH2 SOL 4815 11.240 14.690 10.700 1.00 0.00 ATOM 30060 H1 SOL 4815 11.940 15.320 10.890 1.00 0.00 ATOM 30061 H2 SOL 4815 11.450 13.930 11.240 1.00 0.00 ATOM 30062 OH2 SOL 4816 31.930 1.210 77.570 1.00 0.00 ATOM 30063 H1 SOL 4816 31.190 1.800 77.440 1.00 0.00 ATOM 30064 H2 SOL 4816 32.670 1.680 77.190 1.00 0.00 ATOM 30065 OH2 SOL 4817 23.920 15.080 2.150 1.00 0.00 ATOM 30066 H1 SOL 4817 24.810 14.750 2.050 1.00 0.00 ATOM 30067 H2 SOL 4817 23.850 15.770 1.480 1.00 0.00 ATOM 30068 OH2 SOL 4818 31.230 56.450 0.360 1.00 0.00 ATOM 30069 H1 SOL 4818 30.490 56.880 -0.070 1.00 0.00 ATOM 30070 H2 SOL 4818 30.890 55.590 0.610 1.00 0.00 ATOM 30071 OH2 SOL 4819 32.210 23.720 77.650 1.00 0.00 ATOM 30072 H1 SOL 4819 31.330 23.670 77.280 1.00 0.00 ATOM 30073 H2 SOL 4819 32.780 23.840 76.890 1.00 0.00 ATOM 30074 OH2 SOL 4820 1.820 38.520 7.760 1.00 0.00 ATOM 30075 H1 SOL 4820 1.830 38.480 8.720 1.00 0.00 ATOM 30076 H2 SOL 4820 1.870 37.610 7.480 1.00 0.00 ATOM 30077 OH2 SOL 4821 34.110 41.390 75.480 1.00 0.00 ATOM 30078 H1 SOL 4821 34.090 41.810 74.620 1.00 0.00 ATOM 30079 H2 SOL 4821 33.400 41.820 75.970 1.00 0.00 ATOM 30080 OH2 SOL 4822 29.660 35.080 17.430 1.00 0.00 ATOM 30081 H1 SOL 4822 30.450 35.280 16.920 1.00 0.00 ATOM 30082 H2 SOL 4822 29.000 35.670 17.080 1.00 0.00 ATOM 30083 OH2 SOL 4823 2.550 40.420 66.930 1.00 0.00 ATOM 30084 H1 SOL 4823 3.190 40.840 66.360 1.00 0.00 ATOM 30085 H2 SOL 4823 2.500 39.520 66.620 1.00 0.00 ATOM 30086 OH2 SOL 4824 28.700 46.380 84.060 1.00 0.00 ATOM 30087 H1 SOL 4824 28.820 46.930 83.290 1.00 0.00 ATOM 30088 H2 SOL 4824 29.570 46.050 84.270 1.00 0.00 ATOM 30089 OH2 SOL 4825 41.040 38.530 82.590 1.00 0.00 ATOM 30090 H1 SOL 4825 40.950 39.160 83.300 1.00 0.00 ATOM 30091 H2 SOL 4825 41.290 39.060 81.830 1.00 0.00 ATOM 30092 OH2 SOL 4826 59.240 57.230 81.150 1.00 0.00 ATOM 30093 H1 SOL 4826 58.740 57.000 80.370 1.00 0.00 ATOM 30094 H2 SOL 4826 58.950 58.110 81.370 1.00 0.00 ATOM 30095 OH2 SOL 4827 40.390 18.680 80.670 1.00 0.00 ATOM 30096 H1 SOL 4827 40.030 19.560 80.730 1.00 0.00 ATOM 30097 H2 SOL 4827 41.270 18.800 80.330 1.00 0.00 ATOM 30098 OH2 SOL 4828 15.340 24.850 11.070 1.00 0.00 ATOM 30099 H1 SOL 4828 15.010 24.110 11.560 1.00 0.00 ATOM 30100 H2 SOL 4828 14.570 25.390 10.880 1.00 0.00 ATOM 30101 OH2 SOL 4829 27.690 52.170 79.370 1.00 0.00 ATOM 30102 H1 SOL 4829 27.600 53.120 79.360 1.00 0.00 ATOM 30103 H2 SOL 4829 27.200 51.870 78.610 1.00 0.00 ATOM 30104 OH2 SOL 4830 60.020 40.330 4.600 1.00 0.00 ATOM 30105 H1 SOL 4830 60.510 40.930 5.150 1.00 0.00 ATOM 30106 H2 SOL 4830 60.530 39.520 4.600 1.00 0.00 ATOM 30107 OH2 SOL 4831 28.300 30.990 72.060 1.00 0.00 ATOM 30108 H1 SOL 4831 28.640 31.770 72.490 1.00 0.00 ATOM 30109 H2 SOL 4831 28.180 30.360 72.770 1.00 0.00 ATOM 30110 OH2 SOL 4832 43.080 29.510 1.790 1.00 0.00 ATOM 30111 H1 SOL 4832 43.060 30.470 1.790 1.00 0.00 ATOM 30112 H2 SOL 4832 42.990 29.270 2.710 1.00 0.00 ATOM 30113 OH2 SOL 4833 51.430 1.120 7.610 1.00 0.00 ATOM 30114 H1 SOL 4833 51.310 1.610 8.420 1.00 0.00 ATOM 30115 H2 SOL 4833 50.620 0.610 7.520 1.00 0.00 ATOM 30116 OH2 SOL 4834 1.710 51.800 72.790 1.00 0.00 ATOM 30117 H1 SOL 4834 1.700 52.740 72.980 1.00 0.00 ATOM 30118 H2 SOL 4834 1.070 51.700 72.080 1.00 0.00 ATOM 30119 OH2 SOL 4835 57.530 9.260 14.690 1.00 0.00 ATOM 30120 H1 SOL 4835 56.690 9.190 14.230 1.00 0.00 ATOM 30121 H2 SOL 4835 57.770 10.190 14.610 1.00 0.00 ATOM 30122 OH2 SOL 4836 43.120 49.010 16.910 1.00 0.00 ATOM 30123 H1 SOL 4836 42.390 48.750 17.490 1.00 0.00 ATOM 30124 H2 SOL 4836 42.870 48.670 16.050 1.00 0.00 ATOM 30125 OH2 SOL 4837 57.590 17.490 81.000 1.00 0.00 ATOM 30126 H1 SOL 4837 58.090 17.080 80.300 1.00 0.00 ATOM 30127 H2 SOL 4837 58.190 18.130 81.380 1.00 0.00 ATOM 30128 OH2 SOL 4838 25.540 52.150 5.110 1.00 0.00 ATOM 30129 H1 SOL 4838 25.100 51.660 4.420 1.00 0.00 ATOM 30130 H2 SOL 4838 26.000 51.490 5.630 1.00 0.00 ATOM 30131 OH2 SOL 4839 51.960 55.320 23.520 1.00 0.00 ATOM 30132 H1 SOL 4839 52.900 55.330 23.400 1.00 0.00 ATOM 30133 H2 SOL 4839 51.790 56.040 24.130 1.00 0.00 ATOM 30134 OH2 SOL 4840 58.390 32.190 21.800 1.00 0.00 ATOM 30135 H1 SOL 4840 57.820 32.950 21.900 1.00 0.00 ATOM 30136 H2 SOL 4840 59.150 32.510 21.320 1.00 0.00 ATOM 30137 OH2 SOL 4841 16.460 25.860 8.840 1.00 0.00 ATOM 30138 H1 SOL 4841 15.970 25.230 8.320 1.00 0.00 ATOM 30139 H2 SOL 4841 16.100 25.780 9.720 1.00 0.00 ATOM 30140 OH2 SOL 4842 40.330 54.380 66.670 1.00 0.00 ATOM 30141 H1 SOL 4842 40.490 53.790 67.410 1.00 0.00 ATOM 30142 H2 SOL 4842 39.370 54.370 66.560 1.00 0.00 ATOM 30143 OH2 SOL 4843 59.980 47.100 3.740 1.00 0.00 ATOM 30144 H1 SOL 4843 59.590 47.660 4.410 1.00 0.00 ATOM 30145 H2 SOL 4843 59.240 46.780 3.230 1.00 0.00 ATOM 30146 OH2 SOL 4844 24.810 1.060 21.410 1.00 0.00 ATOM 30147 H1 SOL 4844 25.420 0.590 21.980 1.00 0.00 ATOM 30148 H2 SOL 4844 24.240 1.550 22.010 1.00 0.00 ATOM 30149 OH2 SOL 4845 57.730 4.880 2.520 1.00 0.00 ATOM 30150 H1 SOL 4845 58.130 4.840 3.380 1.00 0.00 ATOM 30151 H2 SOL 4845 57.730 3.970 2.220 1.00 0.00 ATOM 30152 OH2 SOL 4846 37.920 19.550 74.000 1.00 0.00 ATOM 30153 H1 SOL 4846 38.190 19.270 74.880 1.00 0.00 ATOM 30154 H2 SOL 4846 37.220 18.950 73.760 1.00 0.00 ATOM 30155 OH2 SOL 4847 5.640 24.290 18.540 1.00 0.00 ATOM 30156 H1 SOL 4847 5.190 25.100 18.790 1.00 0.00 ATOM 30157 H2 SOL 4847 5.210 23.610 19.050 1.00 0.00 ATOM 30158 OH2 SOL 4848 45.580 12.620 12.520 1.00 0.00 ATOM 30159 H1 SOL 4848 44.830 12.870 13.070 1.00 0.00 ATOM 30160 H2 SOL 4848 46.250 12.350 13.150 1.00 0.00 ATOM 30161 OH2 SOL 4849 18.080 30.700 14.750 1.00 0.00 ATOM 30162 H1 SOL 4849 18.980 30.790 14.440 1.00 0.00 ATOM 30163 H2 SOL 4849 18.110 29.970 15.360 1.00 0.00 ATOM 30164 OH2 SOL 4850 54.700 40.610 73.660 1.00 0.00 ATOM 30165 H1 SOL 4850 54.660 40.180 74.510 1.00 0.00 ATOM 30166 H2 SOL 4850 54.360 39.960 73.040 1.00 0.00 ATOM 30167 OH2 SOL 4851 34.370 11.910 11.920 1.00 0.00 ATOM 30168 H1 SOL 4851 33.810 12.530 12.390 1.00 0.00 ATOM 30169 H2 SOL 4851 34.600 12.360 11.110 1.00 0.00 ATOM 30170 OH2 SOL 4852 35.670 9.620 69.620 1.00 0.00 ATOM 30171 H1 SOL 4852 36.290 9.720 70.350 1.00 0.00 ATOM 30172 H2 SOL 4852 36.190 9.810 68.840 1.00 0.00 ATOM 30173 OH2 SOL 4853 27.930 56.700 12.650 1.00 0.00 ATOM 30174 H1 SOL 4853 28.660 57.020 13.190 1.00 0.00 ATOM 30175 H2 SOL 4853 28.290 55.950 12.180 1.00 0.00 ATOM 30176 OH2 SOL 4854 17.220 33.450 69.750 1.00 0.00 ATOM 30177 H1 SOL 4854 16.370 33.800 69.460 1.00 0.00 ATOM 30178 H2 SOL 4854 17.860 33.940 69.240 1.00 0.00 ATOM 30179 OH2 SOL 4855 28.210 43.500 2.380 1.00 0.00 ATOM 30180 H1 SOL 4855 27.330 43.860 2.250 1.00 0.00 ATOM 30181 H2 SOL 4855 28.210 43.170 3.280 1.00 0.00 ATOM 30182 OH2 SOL 4856 11.810 54.950 16.810 1.00 0.00 ATOM 30183 H1 SOL 4856 11.490 55.720 17.270 1.00 0.00 ATOM 30184 H2 SOL 4856 12.760 55.070 16.760 1.00 0.00 ATOM 30185 OH2 SOL 4857 8.950 49.560 82.420 1.00 0.00 ATOM 30186 H1 SOL 4857 8.160 49.510 81.880 1.00 0.00 ATOM 30187 H2 SOL 4857 8.870 50.410 82.870 1.00 0.00 ATOM 30188 OH2 SOL 4858 51.020 18.970 9.840 1.00 0.00 ATOM 30189 H1 SOL 4858 50.110 19.280 9.860 1.00 0.00 ATOM 30190 H2 SOL 4858 50.940 18.030 9.670 1.00 0.00 ATOM 30191 OH2 SOL 4859 36.950 18.390 80.470 1.00 0.00 ATOM 30192 H1 SOL 4859 36.190 18.660 80.990 1.00 0.00 ATOM 30193 H2 SOL 4859 37.560 19.120 80.550 1.00 0.00 ATOM 30194 OH2 SOL 4860 35.510 57.110 75.720 1.00 0.00 ATOM 30195 H1 SOL 4860 34.880 57.450 75.070 1.00 0.00 ATOM 30196 H2 SOL 4860 35.400 56.160 75.680 1.00 0.00 ATOM 30197 OH2 SOL 4861 43.630 20.190 81.900 1.00 0.00 ATOM 30198 H1 SOL 4861 42.940 20.570 82.440 1.00 0.00 ATOM 30199 H2 SOL 4861 44.290 19.890 82.520 1.00 0.00 ATOM 30200 OH2 SOL 4862 37.700 29.970 16.510 1.00 0.00 ATOM 30201 H1 SOL 4862 36.940 30.550 16.440 1.00 0.00 ATOM 30202 H2 SOL 4862 37.340 29.090 16.440 1.00 0.00 ATOM 30203 OH2 SOL 4863 51.620 31.120 2.730 1.00 0.00 ATOM 30204 H1 SOL 4863 51.910 30.220 2.860 1.00 0.00 ATOM 30205 H2 SOL 4863 52.290 31.660 3.150 1.00 0.00 ATOM 30206 OH2 SOL 4864 11.200 56.510 58.140 1.00 0.00 ATOM 30207 H1 SOL 4864 11.960 57.090 58.180 1.00 0.00 ATOM 30208 H2 SOL 4864 10.460 57.100 58.030 1.00 0.00 ATOM 30209 OH2 SOL 4865 10.770 57.150 74.780 1.00 0.00 ATOM 30210 H1 SOL 4865 10.380 56.310 74.550 1.00 0.00 ATOM 30211 H2 SOL 4865 10.100 57.800 74.550 1.00 0.00 ATOM 30212 OH2 SOL 4866 4.050 33.860 75.900 1.00 0.00 ATOM 30213 H1 SOL 4866 3.800 34.770 75.710 1.00 0.00 ATOM 30214 H2 SOL 4866 4.120 33.820 76.850 1.00 0.00 ATOM 30215 OH2 SOL 4867 9.730 57.430 8.940 1.00 0.00 ATOM 30216 H1 SOL 4867 10.300 58.120 9.300 1.00 0.00 ATOM 30217 H2 SOL 4867 9.090 57.270 9.640 1.00 0.00 ATOM 30218 OH2 SOL 4868 60.620 10.330 20.740 1.00 0.00 ATOM 30219 H1 SOL 4868 61.060 10.530 21.570 1.00 0.00 ATOM 30220 H2 SOL 4868 61.340 10.240 20.110 1.00 0.00 ATOM 30221 OH2 SOL 4869 55.050 53.800 81.400 1.00 0.00 ATOM 30222 H1 SOL 4869 55.990 53.960 81.280 1.00 0.00 ATOM 30223 H2 SOL 4869 54.970 52.850 81.320 1.00 0.00 ATOM 30224 OH2 SOL 4870 44.820 1.920 24.460 1.00 0.00 ATOM 30225 H1 SOL 4870 44.330 2.180 25.240 1.00 0.00 ATOM 30226 H2 SOL 4870 44.950 2.740 23.980 1.00 0.00 ATOM 30227 OH2 SOL 4871 51.900 18.930 13.720 1.00 0.00 ATOM 30228 H1 SOL 4871 52.690 19.420 13.940 1.00 0.00 ATOM 30229 H2 SOL 4871 51.200 19.380 14.190 1.00 0.00 ATOM 30230 OH2 SOL 4872 4.120 6.980 5.370 1.00 0.00 ATOM 30231 H1 SOL 4872 4.730 7.360 4.730 1.00 0.00 ATOM 30232 H2 SOL 4872 4.320 6.040 5.370 1.00 0.00 ATOM 30233 OH2 SOL 4873 11.400 42.460 70.320 1.00 0.00 ATOM 30234 H1 SOL 4873 10.680 42.800 70.850 1.00 0.00 ATOM 30235 H2 SOL 4873 11.140 41.560 70.100 1.00 0.00 ATOM 30236 OH2 SOL 4874 21.630 9.770 13.610 1.00 0.00 ATOM 30237 H1 SOL 4874 22.230 10.320 13.110 1.00 0.00 ATOM 30238 H2 SOL 4874 22.160 9.040 13.920 1.00 0.00 ATOM 30239 OH2 SOL 4875 51.160 57.980 18.720 1.00 0.00 ATOM 30240 H1 SOL 4875 50.860 57.190 19.170 1.00 0.00 ATOM 30241 H2 SOL 4875 52.070 57.800 18.510 1.00 0.00 ATOM 30242 OH2 SOL 4876 42.240 48.210 82.240 1.00 0.00 ATOM 30243 H1 SOL 4876 42.990 47.930 81.710 1.00 0.00 ATOM 30244 H2 SOL 4876 42.470 49.090 82.550 1.00 0.00 ATOM 30245 OH2 SOL 4877 44.120 39.730 70.770 1.00 0.00 ATOM 30246 H1 SOL 4877 44.250 40.420 70.110 1.00 0.00 ATOM 30247 H2 SOL 4877 43.230 39.430 70.630 1.00 0.00 ATOM 30248 OH2 SOL 4878 53.780 51.270 27.160 1.00 0.00 ATOM 30249 H1 SOL 4878 53.050 51.800 26.830 1.00 0.00 ATOM 30250 H2 SOL 4878 54.410 51.260 26.430 1.00 0.00 ATOM 30251 OH2 SOL 4879 4.540 20.140 3.760 1.00 0.00 ATOM 30252 H1 SOL 4879 4.180 20.260 4.640 1.00 0.00 ATOM 30253 H2 SOL 4879 3.900 19.580 3.310 1.00 0.00 ATOM 30254 OH2 SOL 4880 16.090 7.290 83.180 1.00 0.00 ATOM 30255 H1 SOL 4880 15.310 6.750 83.280 1.00 0.00 ATOM 30256 H2 SOL 4880 16.230 7.690 84.040 1.00 0.00 ATOM 30257 OH2 SOL 4881 29.700 50.630 15.790 1.00 0.00 ATOM 30258 H1 SOL 4881 29.750 51.150 16.590 1.00 0.00 ATOM 30259 H2 SOL 4881 28.760 50.540 15.610 1.00 0.00 ATOM 30260 OH2 SOL 4882 21.080 51.640 18.520 1.00 0.00 ATOM 30261 H1 SOL 4882 21.480 51.810 17.660 1.00 0.00 ATOM 30262 H2 SOL 4882 20.220 52.060 18.460 1.00 0.00 ATOM 30263 OH2 SOL 4883 4.300 50.140 79.620 1.00 0.00 ATOM 30264 H1 SOL 4883 4.050 49.210 79.570 1.00 0.00 ATOM 30265 H2 SOL 4883 4.300 50.430 78.710 1.00 0.00 ATOM 30266 OH2 SOL 4884 19.130 46.270 15.590 1.00 0.00 ATOM 30267 H1 SOL 4884 19.320 45.420 15.190 1.00 0.00 ATOM 30268 H2 SOL 4884 19.650 46.270 16.390 1.00 0.00 ATOM 30269 OH2 SOL 4885 26.960 38.540 11.510 1.00 0.00 ATOM 30270 H1 SOL 4885 26.330 39.250 11.630 1.00 0.00 ATOM 30271 H2 SOL 4885 27.470 38.530 12.310 1.00 0.00 ATOM 30272 OH2 SOL 4886 15.350 56.400 80.310 1.00 0.00 ATOM 30273 H1 SOL 4886 15.710 55.790 80.960 1.00 0.00 ATOM 30274 H2 SOL 4886 16.120 56.880 79.990 1.00 0.00 ATOM 30275 OH2 SOL 4887 14.040 42.470 69.500 1.00 0.00 ATOM 30276 H1 SOL 4887 14.410 43.020 70.200 1.00 0.00 ATOM 30277 H2 SOL 4887 13.130 42.340 69.750 1.00 0.00 ATOM 30278 OH2 SOL 4888 31.660 41.740 73.850 1.00 0.00 ATOM 30279 H1 SOL 4888 31.060 42.480 73.780 1.00 0.00 ATOM 30280 H2 SOL 4888 31.240 41.040 73.340 1.00 0.00 ATOM 30281 OH2 SOL 4889 1.330 24.540 18.490 1.00 0.00 ATOM 30282 H1 SOL 4889 1.750 23.680 18.410 1.00 0.00 ATOM 30283 H2 SOL 4889 1.090 24.760 17.590 1.00 0.00 ATOM 30284 OH2 SOL 4890 44.200 4.220 14.720 1.00 0.00 ATOM 30285 H1 SOL 4890 44.470 3.310 14.780 1.00 0.00 ATOM 30286 H2 SOL 4890 43.740 4.280 13.890 1.00 0.00 ATOM 30287 OH2 SOL 4891 32.130 15.680 83.170 1.00 0.00 ATOM 30288 H1 SOL 4891 32.540 14.980 83.680 1.00 0.00 ATOM 30289 H2 SOL 4891 31.800 16.300 83.820 1.00 0.00 ATOM 30290 OH2 SOL 4892 22.540 36.490 9.730 1.00 0.00 ATOM 30291 H1 SOL 4892 22.730 35.580 9.970 1.00 0.00 ATOM 30292 H2 SOL 4892 22.310 36.440 8.800 1.00 0.00 ATOM 30293 OH2 SOL 4893 7.860 27.130 9.710 1.00 0.00 ATOM 30294 H1 SOL 4893 6.990 27.490 9.540 1.00 0.00 ATOM 30295 H2 SOL 4893 7.750 26.600 10.500 1.00 0.00 ATOM 30296 OH2 SOL 4894 51.120 30.400 19.750 1.00 0.00 ATOM 30297 H1 SOL 4894 51.290 30.440 18.810 1.00 0.00 ATOM 30298 H2 SOL 4894 50.360 30.960 19.880 1.00 0.00 ATOM 30299 OH2 SOL 4895 40.040 0.030 20.870 1.00 0.00 ATOM 30300 H1 SOL 4895 40.560 0.800 20.650 1.00 0.00 ATOM 30301 H2 SOL 4895 40.530 -0.400 21.570 1.00 0.00 ATOM 30302 OH2 SOL 4896 13.690 14.880 74.120 1.00 0.00 ATOM 30303 H1 SOL 4896 13.110 15.520 74.540 1.00 0.00 ATOM 30304 H2 SOL 4896 13.170 14.510 73.400 1.00 0.00 ATOM 30305 OH2 SOL 4897 50.100 20.700 2.490 1.00 0.00 ATOM 30306 H1 SOL 4897 50.750 21.250 2.920 1.00 0.00 ATOM 30307 H2 SOL 4897 50.530 19.850 2.380 1.00 0.00 ATOM 30308 OH2 SOL 4898 60.110 51.820 82.310 1.00 0.00 ATOM 30309 H1 SOL 4898 60.890 51.960 81.780 1.00 0.00 ATOM 30310 H2 SOL 4898 60.140 50.890 82.530 1.00 0.00 ATOM 30311 OH2 SOL 4899 3.530 51.750 14.300 1.00 0.00 ATOM 30312 H1 SOL 4899 3.580 51.070 14.970 1.00 0.00 ATOM 30313 H2 SOL 4899 3.140 51.310 13.540 1.00 0.00 ATOM 30314 OH2 SOL 4900 41.760 31.060 27.010 1.00 0.00 ATOM 30315 H1 SOL 4900 42.530 31.410 26.570 1.00 0.00 ATOM 30316 H2 SOL 4900 41.690 30.160 26.680 1.00 0.00 ATOM 30317 OH2 SOL 4901 47.910 42.640 14.700 1.00 0.00 ATOM 30318 H1 SOL 4901 48.210 42.740 15.610 1.00 0.00 ATOM 30319 H2 SOL 4901 47.000 42.380 14.770 1.00 0.00 ATOM 30320 OH2 SOL 4902 25.490 56.030 8.780 1.00 0.00 ATOM 30321 H1 SOL 4902 25.970 55.230 9.000 1.00 0.00 ATOM 30322 H2 SOL 4902 25.750 56.230 7.880 1.00 0.00 ATOM 30323 OH2 SOL 4903 23.840 13.570 79.200 1.00 0.00 ATOM 30324 H1 SOL 4903 24.030 14.430 79.560 1.00 0.00 ATOM 30325 H2 SOL 4903 24.210 12.960 79.840 1.00 0.00 ATOM 30326 OH2 SOL 4904 58.460 2.530 0.980 1.00 0.00 ATOM 30327 H1 SOL 4904 58.330 1.610 0.780 1.00 0.00 ATOM 30328 H2 SOL 4904 58.290 2.990 0.160 1.00 0.00 ATOM 30329 OH2 SOL 4905 50.590 26.690 17.680 1.00 0.00 ATOM 30330 H1 SOL 4905 50.300 27.240 16.960 1.00 0.00 ATOM 30331 H2 SOL 4905 49.880 26.740 18.320 1.00 0.00 ATOM 30332 OH2 SOL 4906 35.510 50.480 5.000 1.00 0.00 ATOM 30333 H1 SOL 4906 35.420 49.530 4.970 1.00 0.00 ATOM 30334 H2 SOL 4906 36.440 50.640 5.160 1.00 0.00 ATOM 30335 OH2 SOL 4907 6.340 10.560 79.570 1.00 0.00 ATOM 30336 H1 SOL 4907 6.050 9.780 79.090 1.00 0.00 ATOM 30337 H2 SOL 4907 6.790 10.210 80.340 1.00 0.00 ATOM 30338 OH2 SOL 4908 26.830 26.630 8.100 1.00 0.00 ATOM 30339 H1 SOL 4908 27.140 25.910 8.640 1.00 0.00 ATOM 30340 H2 SOL 4908 27.620 27.140 7.900 1.00 0.00 ATOM 30341 OH2 SOL 4909 54.000 49.580 3.670 1.00 0.00 ATOM 30342 H1 SOL 4909 54.080 48.830 3.090 1.00 0.00 ATOM 30343 H2 SOL 4909 53.590 50.260 3.130 1.00 0.00 ATOM 30344 OH2 SOL 4910 17.180 6.020 2.120 1.00 0.00 ATOM 30345 H1 SOL 4910 17.410 5.290 2.690 1.00 0.00 ATOM 30346 H2 SOL 4910 17.240 5.660 1.230 1.00 0.00 ATOM 30347 OH2 SOL 4911 1.030 0.350 76.960 1.00 0.00 ATOM 30348 H1 SOL 4911 1.400 -0.390 76.480 1.00 0.00 ATOM 30349 H2 SOL 4911 1.740 0.990 77.000 1.00 0.00 ATOM 30350 OH2 SOL 4912 50.120 11.090 6.720 1.00 0.00 ATOM 30351 H1 SOL 4912 49.340 10.550 6.860 1.00 0.00 ATOM 30352 H2 SOL 4912 49.770 11.960 6.510 1.00 0.00 ATOM 30353 OH2 SOL 4913 51.240 3.480 66.920 1.00 0.00 ATOM 30354 H1 SOL 4913 51.830 3.990 66.370 1.00 0.00 ATOM 30355 H2 SOL 4913 51.810 3.060 67.560 1.00 0.00 ATOM 30356 OH2 SOL 4914 12.400 30.830 78.980 1.00 0.00 ATOM 30357 H1 SOL 4914 12.520 31.520 78.330 1.00 0.00 ATOM 30358 H2 SOL 4914 12.820 31.180 79.770 1.00 0.00 ATOM 30359 OH2 SOL 4915 43.880 57.370 5.450 1.00 0.00 ATOM 30360 H1 SOL 4915 44.080 56.660 6.060 1.00 0.00 ATOM 30361 H2 SOL 4915 43.630 56.930 4.640 1.00 0.00 ATOM 30362 OH2 SOL 4916 51.440 16.960 20.170 1.00 0.00 ATOM 30363 H1 SOL 4916 51.300 17.880 19.960 1.00 0.00 ATOM 30364 H2 SOL 4916 52.370 16.810 20.000 1.00 0.00 ATOM 30365 OH2 SOL 4917 31.220 46.400 3.280 1.00 0.00 ATOM 30366 H1 SOL 4917 31.290 46.580 4.210 1.00 0.00 ATOM 30367 H2 SOL 4917 31.490 47.210 2.850 1.00 0.00 ATOM 30368 OH2 SOL 4918 51.990 42.480 71.480 1.00 0.00 ATOM 30369 H1 SOL 4918 52.620 43.200 71.400 1.00 0.00 ATOM 30370 H2 SOL 4918 52.260 41.840 70.820 1.00 0.00 ATOM 30371 OH2 SOL 4919 17.170 34.810 20.010 1.00 0.00 ATOM 30372 H1 SOL 4919 16.650 34.240 20.570 1.00 0.00 ATOM 30373 H2 SOL 4919 17.190 35.650 20.470 1.00 0.00 ATOM 30374 OH2 SOL 4920 9.410 43.570 64.760 1.00 0.00 ATOM 30375 H1 SOL 4920 9.320 43.640 63.810 1.00 0.00 ATOM 30376 H2 SOL 4920 10.360 43.530 64.900 1.00 0.00 ATOM 30377 OH2 SOL 4921 49.140 42.930 82.360 1.00 0.00 ATOM 30378 H1 SOL 4921 48.440 43.320 82.890 1.00 0.00 ATOM 30379 H2 SOL 4921 49.210 43.510 81.600 1.00 0.00 ATOM 30380 OH2 SOL 4922 16.790 15.640 68.790 1.00 0.00 ATOM 30381 H1 SOL 4922 16.550 16.160 69.560 1.00 0.00 ATOM 30382 H2 SOL 4922 17.730 15.520 68.870 1.00 0.00 ATOM 30383 OH2 SOL 4923 18.740 11.460 17.390 1.00 0.00 ATOM 30384 H1 SOL 4923 19.180 11.820 18.160 1.00 0.00 ATOM 30385 H2 SOL 4923 18.450 12.230 16.890 1.00 0.00 ATOM 30386 OH2 SOL 4924 57.560 47.450 68.600 1.00 0.00 ATOM 30387 H1 SOL 4924 57.830 46.800 69.240 1.00 0.00 ATOM 30388 H2 SOL 4924 57.400 46.950 67.800 1.00 0.00 ATOM 30389 OH2 SOL 4925 29.010 18.360 4.940 1.00 0.00 ATOM 30390 H1 SOL 4925 28.230 18.910 4.860 1.00 0.00 ATOM 30391 H2 SOL 4925 29.610 18.870 5.480 1.00 0.00 ATOM 30392 OH2 SOL 4926 20.500 17.270 8.750 1.00 0.00 ATOM 30393 H1 SOL 4926 21.140 16.590 8.550 1.00 0.00 ATOM 30394 H2 SOL 4926 21.020 18.020 9.040 1.00 0.00 ATOM 30395 OH2 SOL 4927 21.140 10.940 4.350 1.00 0.00 ATOM 30396 H1 SOL 4927 21.720 11.400 4.960 1.00 0.00 ATOM 30397 H2 SOL 4927 21.390 11.270 3.480 1.00 0.00 ATOM 30398 OH2 SOL 4928 13.220 32.970 6.080 1.00 0.00 ATOM 30399 H1 SOL 4928 13.070 33.050 5.130 1.00 0.00 ATOM 30400 H2 SOL 4928 12.490 33.440 6.480 1.00 0.00 ATOM 30401 OH2 SOL 4929 47.420 29.250 69.330 1.00 0.00 ATOM 30402 H1 SOL 4929 46.520 29.270 68.990 1.00 0.00 ATOM 30403 H2 SOL 4929 47.430 28.520 69.950 1.00 0.00 ATOM 30404 OH2 SOL 4930 43.070 8.740 16.720 1.00 0.00 ATOM 30405 H1 SOL 4930 42.260 8.600 17.200 1.00 0.00 ATOM 30406 H2 SOL 4930 43.710 8.180 17.150 1.00 0.00 ATOM 30407 OH2 SOL 4931 7.130 51.220 83.510 1.00 0.00 ATOM 30408 H1 SOL 4931 7.420 51.200 84.420 1.00 0.00 ATOM 30409 H2 SOL 4931 6.190 51.370 83.550 1.00 0.00 ATOM 30410 OH2 SOL 4932 10.480 53.750 83.140 1.00 0.00 ATOM 30411 H1 SOL 4932 11.370 54.110 83.160 1.00 0.00 ATOM 30412 H2 SOL 4932 10.470 53.110 83.860 1.00 0.00 ATOM 30413 OH2 SOL 4933 33.350 26.820 82.850 1.00 0.00 ATOM 30414 H1 SOL 4933 32.820 27.320 83.470 1.00 0.00 ATOM 30415 H2 SOL 4933 33.560 27.450 82.160 1.00 0.00 ATOM 30416 OH2 SOL 4934 0.580 22.940 75.980 1.00 0.00 ATOM 30417 H1 SOL 4934 1.060 23.130 75.170 1.00 0.00 ATOM 30418 H2 SOL 4934 -0.240 22.560 75.690 1.00 0.00 ATOM 30419 OH2 SOL 4935 53.640 54.930 62.490 1.00 0.00 ATOM 30420 H1 SOL 4935 54.380 55.530 62.500 1.00 0.00 ATOM 30421 H2 SOL 4935 54.030 54.060 62.490 1.00 0.00 ATOM 30422 OH2 SOL 4936 20.560 18.550 16.450 1.00 0.00 ATOM 30423 H1 SOL 4936 20.240 17.820 15.920 1.00 0.00 ATOM 30424 H2 SOL 4936 20.610 18.200 17.340 1.00 0.00 ATOM 30425 OH2 SOL 4937 6.370 12.780 1.270 1.00 0.00 ATOM 30426 H1 SOL 4937 6.720 13.670 1.310 1.00 0.00 ATOM 30427 H2 SOL 4937 7.010 12.250 1.740 1.00 0.00 ATOM 30428 OH2 SOL 4938 4.120 6.070 26.720 1.00 0.00 ATOM 30429 H1 SOL 4938 5.040 5.790 26.760 1.00 0.00 ATOM 30430 H2 SOL 4938 3.650 5.290 26.420 1.00 0.00 ATOM 30431 OH2 SOL 4939 28.860 47.830 9.000 1.00 0.00 ATOM 30432 H1 SOL 4939 29.560 47.620 9.610 1.00 0.00 ATOM 30433 H2 SOL 4939 29.290 48.340 8.310 1.00 0.00 ATOM 30434 OH2 SOL 4940 36.600 13.670 14.770 1.00 0.00 ATOM 30435 H1 SOL 4940 37.510 13.550 14.480 1.00 0.00 ATOM 30436 H2 SOL 4940 36.320 12.810 15.080 1.00 0.00 ATOM 30437 OH2 SOL 4941 48.140 10.000 10.780 1.00 0.00 ATOM 30438 H1 SOL 4941 48.100 9.280 10.150 1.00 0.00 ATOM 30439 H2 SOL 4941 47.570 10.670 10.390 1.00 0.00 ATOM 30440 OH2 SOL 4942 15.430 38.670 69.520 1.00 0.00 ATOM 30441 H1 SOL 4942 14.820 37.950 69.350 1.00 0.00 ATOM 30442 H2 SOL 4942 15.060 39.120 70.280 1.00 0.00 ATOM 30443 OH2 SOL 4943 9.620 19.100 9.350 1.00 0.00 ATOM 30444 H1 SOL 4943 8.990 19.530 8.760 1.00 0.00 ATOM 30445 H2 SOL 4943 9.580 19.600 10.160 1.00 0.00 ATOM 30446 OH2 SOL 4944 23.960 55.110 70.830 1.00 0.00 ATOM 30447 H1 SOL 4944 24.800 54.790 70.490 1.00 0.00 ATOM 30448 H2 SOL 4944 23.840 54.630 71.650 1.00 0.00 ATOM 30449 OH2 SOL 4945 15.910 12.720 0.770 1.00 0.00 ATOM 30450 H1 SOL 4945 15.400 13.490 1.000 1.00 0.00 ATOM 30451 H2 SOL 4945 16.750 13.070 0.460 1.00 0.00 ATOM 30452 OH2 SOL 4946 46.450 2.380 4.650 1.00 0.00 ATOM 30453 H1 SOL 4946 45.530 2.150 4.550 1.00 0.00 ATOM 30454 H2 SOL 4946 46.760 1.820 5.360 1.00 0.00 ATOM 30455 OH2 SOL 4947 4.780 42.160 2.480 1.00 0.00 ATOM 30456 H1 SOL 4947 5.230 42.130 1.630 1.00 0.00 ATOM 30457 H2 SOL 4947 5.210 42.880 2.940 1.00 0.00 ATOM 30458 OH2 SOL 4948 54.190 23.670 80.700 1.00 0.00 ATOM 30459 H1 SOL 4948 53.490 23.370 81.280 1.00 0.00 ATOM 30460 H2 SOL 4948 53.820 23.600 79.820 1.00 0.00 ATOM 30461 OH2 SOL 4949 10.000 15.400 71.300 1.00 0.00 ATOM 30462 H1 SOL 4949 10.180 14.750 71.980 1.00 0.00 ATOM 30463 H2 SOL 4949 10.220 16.240 71.710 1.00 0.00 ATOM 30464 OH2 SOL 4950 30.390 7.520 17.050 1.00 0.00 ATOM 30465 H1 SOL 4950 29.800 8.100 17.530 1.00 0.00 ATOM 30466 H2 SOL 4950 30.930 8.110 16.530 1.00 0.00 ATOM 30467 OH2 SOL 4951 55.220 35.110 81.110 1.00 0.00 ATOM 30468 H1 SOL 4951 54.770 34.770 80.340 1.00 0.00 ATOM 30469 H2 SOL 4951 55.520 34.330 81.580 1.00 0.00 ATOM 30470 OH2 SOL 4952 20.930 11.470 10.570 1.00 0.00 ATOM 30471 H1 SOL 4952 20.090 11.040 10.770 1.00 0.00 ATOM 30472 H2 SOL 4952 21.440 10.800 10.120 1.00 0.00 ATOM 30473 OH2 SOL 4953 46.340 21.810 75.530 1.00 0.00 ATOM 30474 H1 SOL 4953 46.640 21.930 76.430 1.00 0.00 ATOM 30475 H2 SOL 4953 47.150 21.810 75.010 1.00 0.00 ATOM 30476 OH2 SOL 4954 54.490 41.100 77.950 1.00 0.00 ATOM 30477 H1 SOL 4954 54.110 41.970 77.800 1.00 0.00 ATOM 30478 H2 SOL 4954 54.540 41.020 78.900 1.00 0.00 ATOM 30479 OH2 SOL 4955 14.240 54.710 10.860 1.00 0.00 ATOM 30480 H1 SOL 4955 15.150 54.990 10.980 1.00 0.00 ATOM 30481 H2 SOL 4955 14.280 53.750 10.820 1.00 0.00 ATOM 30482 OH2 SOL 4956 21.330 17.600 76.700 1.00 0.00 ATOM 30483 H1 SOL 4956 21.070 18.500 76.910 1.00 0.00 ATOM 30484 H2 SOL 4956 20.500 17.150 76.530 1.00 0.00 ATOM 30485 OH2 SOL 4957 24.330 50.090 72.140 1.00 0.00 ATOM 30486 H1 SOL 4957 24.730 50.780 72.680 1.00 0.00 ATOM 30487 H2 SOL 4957 24.310 50.460 71.260 1.00 0.00 ATOM 30488 OH2 SOL 4958 12.220 54.130 59.030 1.00 0.00 ATOM 30489 H1 SOL 4958 11.730 54.740 58.480 1.00 0.00 ATOM 30490 H2 SOL 4958 13.110 54.470 59.020 1.00 0.00 ATOM 30491 OH2 SOL 4959 10.080 24.650 1.540 1.00 0.00 ATOM 30492 H1 SOL 4959 9.600 24.040 2.110 1.00 0.00 ATOM 30493 H2 SOL 4959 10.830 24.920 2.060 1.00 0.00 ATOM 30494 OH2 SOL 4960 33.260 5.500 70.510 1.00 0.00 ATOM 30495 H1 SOL 4960 32.460 5.990 70.310 1.00 0.00 ATOM 30496 H2 SOL 4960 33.970 6.040 70.190 1.00 0.00 ATOM 30497 OH2 SOL 4961 45.930 45.670 79.120 1.00 0.00 ATOM 30498 H1 SOL 4961 45.290 45.010 79.370 1.00 0.00 ATOM 30499 H2 SOL 4961 46.290 45.340 78.290 1.00 0.00 ATOM 30500 OH2 SOL 4962 6.400 4.140 11.030 1.00 0.00 ATOM 30501 H1 SOL 4962 5.940 4.460 10.260 1.00 0.00 ATOM 30502 H2 SOL 4962 5.710 3.980 11.670 1.00 0.00 ATOM 30503 OH2 SOL 4963 11.470 17.430 72.300 1.00 0.00 ATOM 30504 H1 SOL 4963 12.200 17.120 71.770 1.00 0.00 ATOM 30505 H2 SOL 4963 11.540 18.380 72.270 1.00 0.00 ATOM 30506 OH2 SOL 4964 41.810 15.360 3.450 1.00 0.00 ATOM 30507 H1 SOL 4964 41.590 14.690 2.810 1.00 0.00 ATOM 30508 H2 SOL 4964 42.660 15.100 3.810 1.00 0.00 ATOM 30509 OH2 SOL 4965 31.450 18.840 18.660 1.00 0.00 ATOM 30510 H1 SOL 4965 30.940 18.040 18.510 1.00 0.00 ATOM 30511 H2 SOL 4965 31.070 19.480 18.050 1.00 0.00 ATOM 30512 OH2 SOL 4966 16.090 52.890 22.160 1.00 0.00 ATOM 30513 H1 SOL 4966 16.170 53.840 22.250 1.00 0.00 ATOM 30514 H2 SOL 4966 15.150 52.720 22.240 1.00 0.00 ATOM 30515 OH2 SOL 4967 20.380 58.700 68.230 1.00 0.00 ATOM 30516 H1 SOL 4967 19.600 58.210 68.490 1.00 0.00 ATOM 30517 H2 SOL 4967 20.960 58.650 68.990 1.00 0.00 ATOM 30518 OH2 SOL 4968 32.440 47.810 69.760 1.00 0.00 ATOM 30519 H1 SOL 4968 32.300 48.760 69.800 1.00 0.00 ATOM 30520 H2 SOL 4968 31.590 47.450 69.510 1.00 0.00 ATOM 30521 OH2 SOL 4969 38.130 43.370 72.430 1.00 0.00 ATOM 30522 H1 SOL 4969 38.730 42.630 72.430 1.00 0.00 ATOM 30523 H2 SOL 4969 37.550 43.200 71.690 1.00 0.00 ATOM 30524 OH2 SOL 4970 3.870 1.230 18.430 1.00 0.00 ATOM 30525 H1 SOL 4970 3.920 0.280 18.490 1.00 0.00 ATOM 30526 H2 SOL 4970 3.560 1.400 17.540 1.00 0.00 ATOM 30527 OH2 SOL 4971 19.230 50.830 73.610 1.00 0.00 ATOM 30528 H1 SOL 4971 18.340 50.650 73.300 1.00 0.00 ATOM 30529 H2 SOL 4971 19.160 51.670 74.060 1.00 0.00 ATOM 30530 OH2 SOL 4972 28.520 26.350 13.910 1.00 0.00 ATOM 30531 H1 SOL 4972 28.890 27.230 14.010 1.00 0.00 ATOM 30532 H2 SOL 4972 28.250 26.300 12.990 1.00 0.00 ATOM 30533 OH2 SOL 4973 5.770 53.540 70.950 1.00 0.00 ATOM 30534 H1 SOL 4973 5.870 53.880 71.840 1.00 0.00 ATOM 30535 H2 SOL 4973 5.040 54.040 70.580 1.00 0.00 ATOM 30536 OH2 SOL 4974 11.870 20.130 5.480 1.00 0.00 ATOM 30537 H1 SOL 4974 11.320 20.900 5.340 1.00 0.00 ATOM 30538 H2 SOL 4974 11.470 19.450 4.940 1.00 0.00 ATOM 30539 OH2 SOL 4975 21.530 50.700 0.220 1.00 0.00 ATOM 30540 H1 SOL 4975 21.720 50.930 1.130 1.00 0.00 ATOM 30541 H2 SOL 4975 22.270 50.170 -0.050 1.00 0.00 ATOM 30542 OH2 SOL 4976 32.060 1.900 67.560 1.00 0.00 ATOM 30543 H1 SOL 4976 31.620 1.160 67.980 1.00 0.00 ATOM 30544 H2 SOL 4976 32.490 1.530 66.790 1.00 0.00 ATOM 30545 OH2 SOL 4977 34.280 23.350 75.210 1.00 0.00 ATOM 30546 H1 SOL 4977 34.160 23.710 74.340 1.00 0.00 ATOM 30547 H2 SOL 4977 35.200 23.510 75.430 1.00 0.00 ATOM 30548 OH2 SOL 4978 51.410 10.140 79.120 1.00 0.00 ATOM 30549 H1 SOL 4978 50.900 10.320 79.910 1.00 0.00 ATOM 30550 H2 SOL 4978 50.820 9.670 78.540 1.00 0.00 ATOM 30551 OH2 SOL 4979 38.180 48.540 78.870 1.00 0.00 ATOM 30552 H1 SOL 4979 38.190 49.170 78.150 1.00 0.00 ATOM 30553 H2 SOL 4979 39.060 48.160 78.870 1.00 0.00 ATOM 30554 OH2 SOL 4980 0.140 56.120 8.550 1.00 0.00 ATOM 30555 H1 SOL 4980 0.470 55.220 8.600 1.00 0.00 ATOM 30556 H2 SOL 4980 0.600 56.580 9.250 1.00 0.00 ATOM 30557 OH2 SOL 4981 27.700 23.490 5.750 1.00 0.00 ATOM 30558 H1 SOL 4981 28.070 23.570 4.870 1.00 0.00 ATOM 30559 H2 SOL 4981 26.750 23.490 5.610 1.00 0.00 ATOM 30560 OH2 SOL 4982 45.970 31.680 4.850 1.00 0.00 ATOM 30561 H1 SOL 4982 45.130 32.020 4.550 1.00 0.00 ATOM 30562 H2 SOL 4982 46.290 32.340 5.460 1.00 0.00 ATOM 30563 OH2 SOL 4983 21.190 29.270 11.030 1.00 0.00 ATOM 30564 H1 SOL 4983 22.080 29.450 11.320 1.00 0.00 ATOM 30565 H2 SOL 4983 21.090 29.770 10.220 1.00 0.00 ATOM 30566 OH2 SOL 4984 53.980 27.750 14.610 1.00 0.00 ATOM 30567 H1 SOL 4984 54.610 27.060 14.390 1.00 0.00 ATOM 30568 H2 SOL 4984 54.030 27.820 15.560 1.00 0.00 ATOM 30569 OH2 SOL 4985 59.660 3.600 73.500 1.00 0.00 ATOM 30570 H1 SOL 4985 59.770 2.910 74.160 1.00 0.00 ATOM 30571 H2 SOL 4985 58.950 4.140 73.840 1.00 0.00 ATOM 30572 OH2 SOL 4986 31.880 46.770 6.060 1.00 0.00 ATOM 30573 H1 SOL 4986 31.140 46.220 6.310 1.00 0.00 ATOM 30574 H2 SOL 4986 32.470 46.730 6.810 1.00 0.00 ATOM 30575 OH2 SOL 4987 57.040 34.330 61.930 1.00 0.00 ATOM 30576 H1 SOL 4987 57.410 34.630 61.100 1.00 0.00 ATOM 30577 H2 SOL 4987 56.100 34.490 61.850 1.00 0.00 ATOM 30578 OH2 SOL 4988 1.440 23.050 25.950 1.00 0.00 ATOM 30579 H1 SOL 4988 2.120 23.660 26.220 1.00 0.00 ATOM 30580 H2 SOL 4988 0.660 23.590 25.830 1.00 0.00 ATOM 30581 OH2 SOL 4989 59.030 22.870 22.960 1.00 0.00 ATOM 30582 H1 SOL 4989 59.880 22.430 23.050 1.00 0.00 ATOM 30583 H2 SOL 4989 58.870 23.250 23.820 1.00 0.00 ATOM 30584 OH2 SOL 4990 26.990 2.220 2.330 1.00 0.00 ATOM 30585 H1 SOL 4990 26.690 3.080 2.030 1.00 0.00 ATOM 30586 H2 SOL 4990 27.550 1.900 1.620 1.00 0.00 ATOM 30587 OH2 SOL 4991 36.930 53.720 12.510 1.00 0.00 ATOM 30588 H1 SOL 4991 36.000 53.560 12.670 1.00 0.00 ATOM 30589 H2 SOL 4991 36.990 53.890 11.570 1.00 0.00 ATOM 30590 OH2 SOL 4992 60.470 51.920 75.460 1.00 0.00 ATOM 30591 H1 SOL 4992 59.830 52.620 75.560 1.00 0.00 ATOM 30592 H2 SOL 4992 61.240 52.350 75.080 1.00 0.00 ATOM 30593 OH2 SOL 4993 3.660 55.990 62.860 1.00 0.00 ATOM 30594 H1 SOL 4993 3.110 55.820 62.100 1.00 0.00 ATOM 30595 H2 SOL 4993 4.520 56.220 62.490 1.00 0.00 ATOM 30596 OH2 SOL 4994 24.780 45.080 62.290 1.00 0.00 ATOM 30597 H1 SOL 4994 24.030 45.670 62.180 1.00 0.00 ATOM 30598 H2 SOL 4994 25.520 45.560 61.920 1.00 0.00 ATOM 30599 OH2 SOL 4995 7.120 33.820 1.580 1.00 0.00 ATOM 30600 H1 SOL 4995 6.200 33.820 1.310 1.00 0.00 ATOM 30601 H2 SOL 4995 7.480 33.010 1.230 1.00 0.00 ATOM 30602 OH2 SOL 4996 56.170 11.760 15.560 1.00 0.00 ATOM 30603 H1 SOL 4996 56.290 11.660 14.620 1.00 0.00 ATOM 30604 H2 SOL 4996 55.330 11.340 15.740 1.00 0.00 ATOM 30605 OH2 SOL 4997 24.540 42.790 82.910 1.00 0.00 ATOM 30606 H1 SOL 4997 25.080 43.210 83.580 1.00 0.00 ATOM 30607 H2 SOL 4997 24.890 41.910 82.840 1.00 0.00 ATOM 30608 OH2 SOL 4998 45.240 51.030 13.270 1.00 0.00 ATOM 30609 H1 SOL 4998 45.810 50.270 13.340 1.00 0.00 ATOM 30610 H2 SOL 4998 44.930 51.170 14.170 1.00 0.00 ATOM 30611 OH2 SOL 4999 53.280 43.680 17.780 1.00 0.00 ATOM 30612 H1 SOL 4999 53.800 44.340 18.240 1.00 0.00 ATOM 30613 H2 SOL 4999 53.280 43.970 16.870 1.00 0.00 ATOM 30614 OH2 SOL 5000 36.040 45.300 5.020 1.00 0.00 ATOM 30615 H1 SOL 5000 35.150 44.980 5.170 1.00 0.00 ATOM 30616 H2 SOL 5000 36.580 44.510 5.000 1.00 0.00 ATOM 30617 OH2 SOL 5001 12.900 8.670 15.010 1.00 0.00 ATOM 30618 H1 SOL 5001 13.660 8.700 14.420 1.00 0.00 ATOM 30619 H2 SOL 5001 12.970 7.820 15.440 1.00 0.00 ATOM 30620 OH2 SOL 5002 60.650 48.390 19.000 1.00 0.00 ATOM 30621 H1 SOL 5002 60.980 48.510 18.110 1.00 0.00 ATOM 30622 H2 SOL 5002 61.440 48.230 19.520 1.00 0.00 ATOM 30623 OH2 SOL 5003 9.420 0.600 20.070 1.00 0.00 ATOM 30624 H1 SOL 5003 8.530 0.910 19.940 1.00 0.00 ATOM 30625 H2 SOL 5003 9.650 0.870 20.960 1.00 0.00 ATOM 30626 OH2 SOL 5004 10.420 2.230 73.720 1.00 0.00 ATOM 30627 H1 SOL 5004 9.500 2.060 73.920 1.00 0.00 ATOM 30628 H2 SOL 5004 10.480 2.140 72.770 1.00 0.00 ATOM 30629 OH2 SOL 5005 5.850 2.610 79.690 1.00 0.00 ATOM 30630 H1 SOL 5005 5.410 1.860 79.310 1.00 0.00 ATOM 30631 H2 SOL 5005 5.920 2.400 80.620 1.00 0.00 ATOM 30632 OH2 SOL 5006 47.280 21.960 7.890 1.00 0.00 ATOM 30633 H1 SOL 5006 47.210 22.470 7.080 1.00 0.00 ATOM 30634 H2 SOL 5006 46.710 21.210 7.750 1.00 0.00 ATOM 30635 OH2 SOL 5007 47.340 36.580 15.250 1.00 0.00 ATOM 30636 H1 SOL 5007 48.180 36.210 15.480 1.00 0.00 ATOM 30637 H2 SOL 5007 47.550 37.390 14.780 1.00 0.00 ATOM 30638 OH2 SOL 5008 49.980 25.480 21.040 1.00 0.00 ATOM 30639 H1 SOL 5008 50.210 26.410 21.070 1.00 0.00 ATOM 30640 H2 SOL 5008 49.750 25.270 21.940 1.00 0.00 ATOM 30641 OH2 SOL 5009 36.260 53.350 68.380 1.00 0.00 ATOM 30642 H1 SOL 5009 36.680 52.750 67.760 1.00 0.00 ATOM 30643 H2 SOL 5009 36.670 54.190 68.210 1.00 0.00 ATOM 30644 OH2 SOL 5010 6.190 34.540 12.150 1.00 0.00 ATOM 30645 H1 SOL 5010 5.640 34.300 11.400 1.00 0.00 ATOM 30646 H2 SOL 5010 6.450 35.450 11.980 1.00 0.00 ATOM 30647 OH2 SOL 5011 47.380 48.810 18.830 1.00 0.00 ATOM 30648 H1 SOL 5011 48.270 48.510 19.040 1.00 0.00 ATOM 30649 H2 SOL 5011 47.430 49.060 17.900 1.00 0.00 ATOM 30650 OH2 SOL 5012 24.700 43.590 64.740 1.00 0.00 ATOM 30651 H1 SOL 5012 23.970 44.120 65.080 1.00 0.00 ATOM 30652 H2 SOL 5012 24.840 43.910 63.850 1.00 0.00 ATOM 30653 OH2 SOL 5013 34.790 33.000 25.210 1.00 0.00 ATOM 30654 H1 SOL 5013 34.600 32.730 26.110 1.00 0.00 ATOM 30655 H2 SOL 5013 34.020 33.500 24.950 1.00 0.00 ATOM 30656 OH2 SOL 5014 58.250 57.070 64.150 1.00 0.00 ATOM 30657 H1 SOL 5014 58.260 58.020 64.220 1.00 0.00 ATOM 30658 H2 SOL 5014 57.320 56.850 64.020 1.00 0.00 ATOM 30659 OH2 SOL 5015 29.670 44.840 81.530 1.00 0.00 ATOM 30660 H1 SOL 5015 29.030 45.490 81.230 1.00 0.00 ATOM 30661 H2 SOL 5015 30.480 45.350 81.650 1.00 0.00 ATOM 30662 OH2 SOL 5016 37.190 10.460 7.740 1.00 0.00 ATOM 30663 H1 SOL 5016 37.080 9.780 7.080 1.00 0.00 ATOM 30664 H2 SOL 5016 36.500 11.100 7.550 1.00 0.00 ATOM 30665 OH2 SOL 5017 4.550 42.710 18.210 1.00 0.00 ATOM 30666 H1 SOL 5017 4.650 43.120 19.060 1.00 0.00 ATOM 30667 H2 SOL 5017 5.350 42.930 17.740 1.00 0.00 ATOM 30668 OH2 SOL 5018 33.580 39.570 72.440 1.00 0.00 ATOM 30669 H1 SOL 5018 33.950 40.400 72.140 1.00 0.00 ATOM 30670 H2 SOL 5018 32.640 39.660 72.300 1.00 0.00 ATOM 30671 OH2 SOL 5019 31.760 19.300 3.640 1.00 0.00 ATOM 30672 H1 SOL 5019 32.580 19.000 3.260 1.00 0.00 ATOM 30673 H2 SOL 5019 31.200 19.500 2.880 1.00 0.00 ATOM 30674 OH2 SOL 5020 16.940 18.820 16.140 1.00 0.00 ATOM 30675 H1 SOL 5020 17.140 17.880 16.230 1.00 0.00 ATOM 30676 H2 SOL 5020 16.130 18.840 15.640 1.00 0.00 ATOM 30677 OH2 SOL 5021 31.820 12.120 0.630 1.00 0.00 ATOM 30678 H1 SOL 5021 32.500 11.690 1.140 1.00 0.00 ATOM 30679 H2 SOL 5021 31.140 12.350 1.270 1.00 0.00 ATOM 30680 OH2 SOL 5022 15.610 32.240 26.420 1.00 0.00 ATOM 30681 H1 SOL 5022 14.930 32.590 27.000 1.00 0.00 ATOM 30682 H2 SOL 5022 15.170 31.580 25.890 1.00 0.00 ATOM 30683 OH2 SOL 5023 8.370 5.070 17.010 1.00 0.00 ATOM 30684 H1 SOL 5023 8.130 4.160 17.150 1.00 0.00 ATOM 30685 H2 SOL 5023 9.280 5.130 17.300 1.00 0.00 ATOM 30686 OH2 SOL 5024 32.030 0.620 82.390 1.00 0.00 ATOM 30687 H1 SOL 5024 31.490 -0.040 81.950 1.00 0.00 ATOM 30688 H2 SOL 5024 31.400 1.250 82.750 1.00 0.00 ATOM 30689 OH2 SOL 5025 51.570 52.840 25.920 1.00 0.00 ATOM 30690 H1 SOL 5025 51.490 52.930 26.870 1.00 0.00 ATOM 30691 H2 SOL 5025 50.710 53.100 25.580 1.00 0.00 ATOM 30692 OH2 SOL 5026 8.300 40.450 81.990 1.00 0.00 ATOM 30693 H1 SOL 5026 8.140 40.300 82.930 1.00 0.00 ATOM 30694 H2 SOL 5026 8.130 41.390 81.870 1.00 0.00 ATOM 30695 OH2 SOL 5027 8.620 7.920 73.170 1.00 0.00 ATOM 30696 H1 SOL 5027 8.340 7.270 73.820 1.00 0.00 ATOM 30697 H2 SOL 5027 8.350 7.550 72.330 1.00 0.00 ATOM 30698 OH2 SOL 5028 36.920 35.640 3.330 1.00 0.00 ATOM 30699 H1 SOL 5028 36.910 35.290 2.440 1.00 0.00 ATOM 30700 H2 SOL 5028 36.900 34.860 3.890 1.00 0.00 ATOM 30701 OH2 SOL 5029 31.240 15.360 20.890 1.00 0.00 ATOM 30702 H1 SOL 5029 31.530 15.780 21.700 1.00 0.00 ATOM 30703 H2 SOL 5029 30.290 15.370 20.940 1.00 0.00 ATOM 30704 OH2 SOL 5030 9.510 37.750 6.130 1.00 0.00 ATOM 30705 H1 SOL 5030 9.040 37.880 6.960 1.00 0.00 ATOM 30706 H2 SOL 5030 10.360 37.400 6.390 1.00 0.00 ATOM 30707 OH2 SOL 5031 26.820 25.020 2.930 1.00 0.00 ATOM 30708 H1 SOL 5031 27.770 24.970 2.870 1.00 0.00 ATOM 30709 H2 SOL 5031 26.650 25.590 3.680 1.00 0.00 ATOM 30710 OH2 SOL 5032 27.530 44.520 72.050 1.00 0.00 ATOM 30711 H1 SOL 5032 26.690 44.470 72.520 1.00 0.00 ATOM 30712 H2 SOL 5032 27.320 45.000 71.240 1.00 0.00 ATOM 30713 OH2 SOL 5033 19.490 35.970 78.190 1.00 0.00 ATOM 30714 H1 SOL 5033 19.610 36.910 78.020 1.00 0.00 ATOM 30715 H2 SOL 5033 18.800 35.710 77.580 1.00 0.00 ATOM 30716 OH2 SOL 5034 18.960 40.900 14.670 1.00 0.00 ATOM 30717 H1 SOL 5034 19.800 40.610 14.320 1.00 0.00 ATOM 30718 H2 SOL 5034 18.540 40.090 14.960 1.00 0.00 ATOM 30719 OH2 SOL 5035 28.670 13.780 14.540 1.00 0.00 ATOM 30720 H1 SOL 5035 28.450 14.560 15.040 1.00 0.00 ATOM 30721 H2 SOL 5035 29.090 13.200 15.180 1.00 0.00 ATOM 30722 OH2 SOL 5036 3.300 20.790 15.510 1.00 0.00 ATOM 30723 H1 SOL 5036 3.920 20.060 15.510 1.00 0.00 ATOM 30724 H2 SOL 5036 2.910 20.770 16.380 1.00 0.00 ATOM 30725 OH2 SOL 5037 10.490 37.130 22.670 1.00 0.00 ATOM 30726 H1 SOL 5037 9.990 36.670 22.000 1.00 0.00 ATOM 30727 H2 SOL 5037 11.200 36.530 22.900 1.00 0.00 ATOM 30728 OH2 SOL 5038 35.930 20.600 3.240 1.00 0.00 ATOM 30729 H1 SOL 5038 36.740 20.660 2.740 1.00 0.00 ATOM 30730 H2 SOL 5038 36.070 21.190 3.990 1.00 0.00 ATOM 30731 OH2 SOL 5039 19.200 3.500 1.800 1.00 0.00 ATOM 30732 H1 SOL 5039 19.640 2.730 2.160 1.00 0.00 ATOM 30733 H2 SOL 5039 19.300 3.410 0.850 1.00 0.00 ATOM 30734 OH2 SOL 5040 54.340 53.420 21.980 1.00 0.00 ATOM 30735 H1 SOL 5040 54.480 54.210 22.490 1.00 0.00 ATOM 30736 H2 SOL 5040 54.020 52.770 22.610 1.00 0.00 ATOM 30737 OH2 SOL 5041 31.340 57.580 78.670 1.00 0.00 ATOM 30738 H1 SOL 5041 31.390 58.360 78.130 1.00 0.00 ATOM 30739 H2 SOL 5041 32.250 57.250 78.700 1.00 0.00 ATOM 30740 OH2 SOL 5042 21.370 30.430 69.440 1.00 0.00 ATOM 30741 H1 SOL 5042 20.830 30.470 70.230 1.00 0.00 ATOM 30742 H2 SOL 5042 20.750 30.570 68.720 1.00 0.00 ATOM 30743 OH2 SOL 5043 22.300 20.920 70.440 1.00 0.00 ATOM 30744 H1 SOL 5043 21.920 20.440 69.700 1.00 0.00 ATOM 30745 H2 SOL 5043 22.780 20.250 70.940 1.00 0.00 ATOM 30746 OH2 SOL 5044 5.780 52.640 4.840 1.00 0.00 ATOM 30747 H1 SOL 5044 5.380 52.920 5.660 1.00 0.00 ATOM 30748 H2 SOL 5044 5.670 51.690 4.830 1.00 0.00 ATOM 30749 OH2 SOL 5045 19.710 44.180 8.050 1.00 0.00 ATOM 30750 H1 SOL 5045 19.780 44.810 8.760 1.00 0.00 ATOM 30751 H2 SOL 5045 20.050 43.370 8.410 1.00 0.00 ATOM 30752 OH2 SOL 5046 36.780 19.260 67.910 1.00 0.00 ATOM 30753 H1 SOL 5046 36.160 18.530 67.890 1.00 0.00 ATOM 30754 H2 SOL 5046 37.600 18.880 67.610 1.00 0.00 ATOM 30755 OH2 SOL 5047 21.460 7.380 80.660 1.00 0.00 ATOM 30756 H1 SOL 5047 21.870 8.060 81.190 1.00 0.00 ATOM 30757 H2 SOL 5047 20.970 7.860 79.990 1.00 0.00 ATOM 30758 OH2 SOL 5048 60.190 18.310 12.390 1.00 0.00 ATOM 30759 H1 SOL 5048 59.700 18.430 13.200 1.00 0.00 ATOM 30760 H2 SOL 5048 61.060 18.650 12.590 1.00 0.00 ATOM 30761 OH2 SOL 5049 36.600 52.750 74.250 1.00 0.00 ATOM 30762 H1 SOL 5049 36.900 52.510 73.370 1.00 0.00 ATOM 30763 H2 SOL 5049 36.800 51.980 74.790 1.00 0.00 ATOM 30764 OH2 SOL 5050 3.340 47.120 64.780 1.00 0.00 ATOM 30765 H1 SOL 5050 3.610 46.460 65.410 1.00 0.00 ATOM 30766 H2 SOL 5050 2.420 46.910 64.590 1.00 0.00 ATOM 30767 OH2 SOL 5051 23.410 7.910 82.890 1.00 0.00 ATOM 30768 H1 SOL 5051 23.900 7.220 82.440 1.00 0.00 ATOM 30769 H2 SOL 5051 24.090 8.500 83.220 1.00 0.00 ATOM 30770 OH2 SOL 5052 49.990 30.830 7.430 1.00 0.00 ATOM 30771 H1 SOL 5052 50.240 31.750 7.330 1.00 0.00 ATOM 30772 H2 SOL 5052 50.790 30.330 7.250 1.00 0.00 ATOM 30773 OH2 SOL 5053 4.030 54.460 14.940 1.00 0.00 ATOM 30774 H1 SOL 5053 3.830 53.530 15.020 1.00 0.00 ATOM 30775 H2 SOL 5053 4.850 54.580 15.420 1.00 0.00 ATOM 30776 OH2 SOL 5054 29.310 43.920 75.840 1.00 0.00 ATOM 30777 H1 SOL 5054 28.460 43.610 75.520 1.00 0.00 ATOM 30778 H2 SOL 5054 29.790 44.150 75.050 1.00 0.00 ATOM 30779 OH2 SOL 5055 52.110 27.760 12.090 1.00 0.00 ATOM 30780 H1 SOL 5055 52.480 27.870 12.970 1.00 0.00 ATOM 30781 H2 SOL 5055 51.520 28.500 11.980 1.00 0.00 ATOM 30782 OH2 SOL 5056 20.870 29.100 81.990 1.00 0.00 ATOM 30783 H1 SOL 5056 20.910 28.630 81.150 1.00 0.00 ATOM 30784 H2 SOL 5056 20.880 30.030 81.750 1.00 0.00 ATOM 30785 OH2 SOL 5057 33.360 16.290 69.300 1.00 0.00 ATOM 30786 H1 SOL 5057 32.550 15.820 69.090 1.00 0.00 ATOM 30787 H2 SOL 5057 33.540 16.070 70.210 1.00 0.00 ATOM 30788 OH2 SOL 5058 5.370 7.310 65.240 1.00 0.00 ATOM 30789 H1 SOL 5058 6.000 6.590 65.330 1.00 0.00 ATOM 30790 H2 SOL 5058 5.280 7.420 64.290 1.00 0.00 ATOM 30791 OH2 SOL 5059 44.790 21.020 67.310 1.00 0.00 ATOM 30792 H1 SOL 5059 45.370 21.550 66.770 1.00 0.00 ATOM 30793 H2 SOL 5059 43.910 21.340 67.090 1.00 0.00 ATOM 30794 OH2 SOL 5060 26.310 57.990 69.530 1.00 0.00 ATOM 30795 H1 SOL 5060 26.500 57.720 68.630 1.00 0.00 ATOM 30796 H2 SOL 5060 25.680 58.710 69.440 1.00 0.00 ATOM 30797 OH2 SOL 5061 53.220 15.130 3.470 1.00 0.00 ATOM 30798 H1 SOL 5061 53.510 15.470 2.630 1.00 0.00 ATOM 30799 H2 SOL 5061 53.000 15.920 3.980 1.00 0.00 ATOM 30800 OH2 SOL 5062 36.010 1.000 8.660 1.00 0.00 ATOM 30801 H1 SOL 5062 35.740 0.810 7.760 1.00 0.00 ATOM 30802 H2 SOL 5062 35.370 0.550 9.210 1.00 0.00 ATOM 30803 OH2 SOL 5063 60.180 19.660 78.270 1.00 0.00 ATOM 30804 H1 SOL 5063 60.710 20.300 78.750 1.00 0.00 ATOM 30805 H2 SOL 5063 59.460 20.160 77.900 1.00 0.00 ATOM 30806 OH2 SOL 5064 14.850 56.160 6.990 1.00 0.00 ATOM 30807 H1 SOL 5064 13.970 56.370 7.280 1.00 0.00 ATOM 30808 H2 SOL 5064 14.760 55.360 6.480 1.00 0.00 ATOM 30809 OH2 SOL 5065 50.190 2.160 19.080 1.00 0.00 ATOM 30810 H1 SOL 5065 50.760 2.620 19.700 1.00 0.00 ATOM 30811 H2 SOL 5065 50.630 1.330 18.920 1.00 0.00 ATOM 30812 OH2 SOL 5066 53.490 18.190 11.070 1.00 0.00 ATOM 30813 H1 SOL 5066 52.730 18.510 10.590 1.00 0.00 ATOM 30814 H2 SOL 5066 53.290 18.370 11.990 1.00 0.00 ATOM 30815 OH2 SOL 5067 54.660 47.600 2.000 1.00 0.00 ATOM 30816 H1 SOL 5067 54.720 47.430 1.060 1.00 0.00 ATOM 30817 H2 SOL 5067 55.340 47.050 2.390 1.00 0.00 ATOM 30818 OH2 SOL 5068 60.860 2.620 11.880 1.00 0.00 ATOM 30819 H1 SOL 5068 60.180 2.460 11.230 1.00 0.00 ATOM 30820 H2 SOL 5068 60.490 2.300 12.700 1.00 0.00 ATOM 30821 OH2 SOL 5069 52.430 53.510 10.810 1.00 0.00 ATOM 30822 H1 SOL 5069 51.830 54.230 11.000 1.00 0.00 ATOM 30823 H2 SOL 5069 52.400 52.960 11.590 1.00 0.00 ATOM 30824 OH2 SOL 5070 21.710 33.440 15.050 1.00 0.00 ATOM 30825 H1 SOL 5070 21.770 32.590 15.490 1.00 0.00 ATOM 30826 H2 SOL 5070 21.640 33.230 14.120 1.00 0.00 ATOM 30827 OH2 SOL 5071 48.020 2.170 76.500 1.00 0.00 ATOM 30828 H1 SOL 5071 48.270 2.000 75.590 1.00 0.00 ATOM 30829 H2 SOL 5071 47.300 1.560 76.660 1.00 0.00 ATOM 30830 OH2 SOL 5072 3.180 36.570 15.160 1.00 0.00 ATOM 30831 H1 SOL 5072 3.150 37.520 15.250 1.00 0.00 ATOM 30832 H2 SOL 5072 2.420 36.260 15.660 1.00 0.00 ATOM 30833 OH2 SOL 5073 40.690 47.440 17.340 1.00 0.00 ATOM 30834 H1 SOL 5073 40.610 47.900 18.180 1.00 0.00 ATOM 30835 H2 SOL 5073 40.000 46.780 17.360 1.00 0.00 ATOM 30836 OH2 SOL 5074 61.170 22.040 70.510 1.00 0.00 ATOM 30837 H1 SOL 5074 61.370 21.400 71.190 1.00 0.00 ATOM 30838 H2 SOL 5074 61.920 22.010 69.920 1.00 0.00 ATOM 30839 OH2 SOL 5075 13.300 13.820 0.830 1.00 0.00 ATOM 30840 H1 SOL 5075 12.400 13.530 1.000 1.00 0.00 ATOM 30841 H2 SOL 5075 13.340 14.710 1.170 1.00 0.00 ATOM 30842 OH2 SOL 5076 16.360 37.940 77.440 1.00 0.00 ATOM 30843 H1 SOL 5076 16.260 38.670 76.840 1.00 0.00 ATOM 30844 H2 SOL 5076 17.170 38.120 77.920 1.00 0.00 ATOM 30845 OH2 SOL 5077 2.750 23.980 9.030 1.00 0.00 ATOM 30846 H1 SOL 5077 2.780 23.230 9.630 1.00 0.00 ATOM 30847 H2 SOL 5077 2.880 23.600 8.160 1.00 0.00 ATOM 30848 OH2 SOL 5078 14.800 7.160 70.000 1.00 0.00 ATOM 30849 H1 SOL 5078 14.640 6.340 69.530 1.00 0.00 ATOM 30850 H2 SOL 5078 14.590 6.960 70.910 1.00 0.00 ATOM 30851 OH2 SOL 5079 14.340 6.770 75.400 1.00 0.00 ATOM 30852 H1 SOL 5079 13.700 6.080 75.580 1.00 0.00 ATOM 30853 H2 SOL 5079 14.810 6.880 76.230 1.00 0.00 ATOM 30854 OH2 SOL 5080 32.070 35.120 15.720 1.00 0.00 ATOM 30855 H1 SOL 5080 32.290 34.190 15.650 1.00 0.00 ATOM 30856 H2 SOL 5080 32.500 35.520 14.970 1.00 0.00 ATOM 30857 OH2 SOL 5081 58.030 0.340 25.350 1.00 0.00 ATOM 30858 H1 SOL 5081 58.590 -0.140 24.740 1.00 0.00 ATOM 30859 H2 SOL 5081 57.180 -0.100 25.290 1.00 0.00 ATOM 30860 OH2 SOL 5082 58.590 43.330 4.140 1.00 0.00 ATOM 30861 H1 SOL 5082 59.220 42.780 4.600 1.00 0.00 ATOM 30862 H2 SOL 5082 59.130 43.850 3.540 1.00 0.00 ATOM 30863 OH2 SOL 5083 12.100 33.640 21.100 1.00 0.00 ATOM 30864 H1 SOL 5083 12.040 32.730 20.830 1.00 0.00 ATOM 30865 H2 SOL 5083 11.340 33.770 21.680 1.00 0.00 ATOM 30866 OH2 SOL 5084 49.490 41.570 12.530 1.00 0.00 ATOM 30867 H1 SOL 5084 49.010 40.810 12.210 1.00 0.00 ATOM 30868 H2 SOL 5084 48.870 42.030 13.090 1.00 0.00 ATOM 30869 OH2 SOL 5085 32.600 11.010 6.580 1.00 0.00 ATOM 30870 H1 SOL 5085 32.120 11.090 7.400 1.00 0.00 ATOM 30871 H2 SOL 5085 32.350 10.150 6.240 1.00 0.00 ATOM 30872 OH2 SOL 5086 21.080 34.420 1.320 1.00 0.00 ATOM 30873 H1 SOL 5086 21.120 33.530 0.970 1.00 0.00 ATOM 30874 H2 SOL 5086 21.990 34.710 1.360 1.00 0.00 ATOM 30875 OH2 SOL 5087 35.850 23.080 4.350 1.00 0.00 ATOM 30876 H1 SOL 5087 36.420 23.610 4.900 1.00 0.00 ATOM 30877 H2 SOL 5087 36.090 23.310 3.450 1.00 0.00 ATOM 30878 OH2 SOL 5088 54.730 6.200 26.500 1.00 0.00 ATOM 30879 H1 SOL 5088 55.400 6.000 25.850 1.00 0.00 ATOM 30880 H2 SOL 5088 54.430 5.340 26.800 1.00 0.00 ATOM 30881 OH2 SOL 5089 9.860 24.070 16.030 1.00 0.00 ATOM 30882 H1 SOL 5089 9.980 24.920 15.600 1.00 0.00 ATOM 30883 H2 SOL 5089 8.910 23.940 16.060 1.00 0.00 ATOM 30884 OH2 SOL 5090 32.280 33.770 19.690 1.00 0.00 ATOM 30885 H1 SOL 5090 31.860 34.390 20.290 1.00 0.00 ATOM 30886 H2 SOL 5090 31.600 33.530 19.060 1.00 0.00 ATOM 30887 OH2 SOL 5091 11.230 18.290 16.450 1.00 0.00 ATOM 30888 H1 SOL 5091 11.580 19.090 16.060 1.00 0.00 ATOM 30889 H2 SOL 5091 11.190 17.670 15.720 1.00 0.00 ATOM 30890 OH2 SOL 5092 55.920 13.650 3.940 1.00 0.00 ATOM 30891 H1 SOL 5092 56.560 13.840 3.250 1.00 0.00 ATOM 30892 H2 SOL 5092 55.600 14.510 4.210 1.00 0.00 ATOM 30893 OH2 SOL 5093 40.750 49.740 18.720 1.00 0.00 ATOM 30894 H1 SOL 5093 40.380 49.390 19.530 1.00 0.00 ATOM 30895 H2 SOL 5093 39.980 49.970 18.190 1.00 0.00 ATOM 30896 OH2 SOL 5094 13.680 27.000 10.620 1.00 0.00 ATOM 30897 H1 SOL 5094 13.330 26.920 9.730 1.00 0.00 ATOM 30898 H2 SOL 5094 13.500 27.910 10.870 1.00 0.00 ATOM 30899 OH2 SOL 5095 41.180 53.260 14.950 1.00 0.00 ATOM 30900 H1 SOL 5095 41.500 54.070 15.340 1.00 0.00 ATOM 30901 H2 SOL 5095 40.240 53.260 15.130 1.00 0.00 ATOM 30902 OH2 SOL 5096 41.650 42.990 81.780 1.00 0.00 ATOM 30903 H1 SOL 5096 41.420 42.310 81.150 1.00 0.00 ATOM 30904 H2 SOL 5096 42.530 42.780 82.070 1.00 0.00 ATOM 30905 OH2 SOL 5097 0.640 48.360 68.160 1.00 0.00 ATOM 30906 H1 SOL 5097 0.640 47.550 67.650 1.00 0.00 ATOM 30907 H2 SOL 5097 -0.190 48.790 67.940 1.00 0.00 ATOM 30908 OH2 SOL 5098 48.850 15.820 68.350 1.00 0.00 ATOM 30909 H1 SOL 5098 49.130 16.550 68.910 1.00 0.00 ATOM 30910 H2 SOL 5098 48.010 16.120 67.980 1.00 0.00 ATOM 30911 OH2 SOL 5099 10.480 51.310 67.120 1.00 0.00 ATOM 30912 H1 SOL 5099 10.590 50.690 66.410 1.00 0.00 ATOM 30913 H2 SOL 5099 10.380 50.770 67.900 1.00 0.00 ATOM 30914 OH2 SOL 5100 22.570 41.470 68.810 1.00 0.00 ATOM 30915 H1 SOL 5100 21.890 41.320 69.460 1.00 0.00 ATOM 30916 H2 SOL 5100 22.120 41.330 67.970 1.00 0.00 ATOM 30917 OH2 SOL 5101 36.530 39.640 69.830 1.00 0.00 ATOM 30918 H1 SOL 5101 35.630 39.310 69.830 1.00 0.00 ATOM 30919 H2 SOL 5101 36.850 39.470 68.940 1.00 0.00 ATOM 30920 OH2 SOL 5102 42.790 54.550 0.870 1.00 0.00 ATOM 30921 H1 SOL 5102 42.630 54.300 -0.040 1.00 0.00 ATOM 30922 H2 SOL 5102 41.920 54.660 1.250 1.00 0.00 ATOM 30923 OH2 SOL 5103 28.840 3.590 72.430 1.00 0.00 ATOM 30924 H1 SOL 5103 28.510 4.410 72.050 1.00 0.00 ATOM 30925 H2 SOL 5103 29.790 3.640 72.310 1.00 0.00 ATOM 30926 OH2 SOL 5104 6.720 19.110 76.520 1.00 0.00 ATOM 30927 H1 SOL 5104 6.600 18.390 77.140 1.00 0.00 ATOM 30928 H2 SOL 5104 7.530 18.890 76.060 1.00 0.00 ATOM 30929 OH2 SOL 5105 2.370 8.960 11.470 1.00 0.00 ATOM 30930 H1 SOL 5105 2.470 9.810 11.020 1.00 0.00 ATOM 30931 H2 SOL 5105 2.080 8.360 10.780 1.00 0.00 ATOM 30932 OH2 SOL 5106 16.430 9.200 71.340 1.00 0.00 ATOM 30933 H1 SOL 5106 16.050 8.340 71.230 1.00 0.00 ATOM 30934 H2 SOL 5106 16.430 9.580 70.460 1.00 0.00 ATOM 30935 OH2 SOL 5107 47.990 30.590 82.040 1.00 0.00 ATOM 30936 H1 SOL 5107 48.380 30.790 82.890 1.00 0.00 ATOM 30937 H2 SOL 5107 47.460 29.810 82.190 1.00 0.00 ATOM 30938 OH2 SOL 5108 17.400 29.110 20.140 1.00 0.00 ATOM 30939 H1 SOL 5108 16.470 28.960 20.330 1.00 0.00 ATOM 30940 H2 SOL 5108 17.660 28.350 19.630 1.00 0.00 ATOM 30941 OH2 SOL 5109 16.560 0.950 76.830 1.00 0.00 ATOM 30942 H1 SOL 5109 16.200 1.810 77.040 1.00 0.00 ATOM 30943 H2 SOL 5109 15.930 0.580 76.210 1.00 0.00 ATOM 30944 OH2 SOL 5110 15.380 26.260 71.760 1.00 0.00 ATOM 30945 H1 SOL 5110 15.670 26.500 72.640 1.00 0.00 ATOM 30946 H2 SOL 5110 14.680 25.620 71.910 1.00 0.00 ATOM 30947 OH2 SOL 5111 35.060 48.460 19.860 1.00 0.00 ATOM 30948 H1 SOL 5111 35.930 48.540 19.470 1.00 0.00 ATOM 30949 H2 SOL 5111 34.670 49.330 19.760 1.00 0.00 ATOM 30950 OH2 SOL 5112 55.200 4.850 8.830 1.00 0.00 ATOM 30951 H1 SOL 5112 55.390 5.450 9.540 1.00 0.00 ATOM 30952 H2 SOL 5112 54.330 4.500 9.040 1.00 0.00 ATOM 30953 OH2 SOL 5113 30.050 25.400 17.500 1.00 0.00 ATOM 30954 H1 SOL 5113 30.300 24.560 17.880 1.00 0.00 ATOM 30955 H2 SOL 5113 29.370 25.740 18.090 1.00 0.00 ATOM 30956 OH2 SOL 5114 41.560 6.690 13.570 1.00 0.00 ATOM 30957 H1 SOL 5114 42.440 6.820 13.930 1.00 0.00 ATOM 30958 H2 SOL 5114 41.000 6.570 14.340 1.00 0.00 ATOM 30959 OH2 SOL 5115 11.840 12.160 11.690 1.00 0.00 ATOM 30960 H1 SOL 5115 12.450 11.990 10.970 1.00 0.00 ATOM 30961 H2 SOL 5115 11.760 11.320 12.140 1.00 0.00 ATOM 30962 OH2 SOL 5116 60.680 1.970 75.640 1.00 0.00 ATOM 30963 H1 SOL 5116 61.100 1.190 76.000 1.00 0.00 ATOM 30964 H2 SOL 5116 61.390 2.440 75.200 1.00 0.00 ATOM 30965 OH2 SOL 5117 56.260 26.230 14.620 1.00 0.00 ATOM 30966 H1 SOL 5117 56.870 26.630 15.240 1.00 0.00 ATOM 30967 H2 SOL 5117 56.300 25.290 14.810 1.00 0.00 ATOM 30968 OH2 SOL 5118 29.750 45.440 12.420 1.00 0.00 ATOM 30969 H1 SOL 5118 29.750 45.510 11.470 1.00 0.00 ATOM 30970 H2 SOL 5118 30.120 46.270 12.720 1.00 0.00 ATOM 30971 OH2 SOL 5119 11.240 25.300 19.680 1.00 0.00 ATOM 30972 H1 SOL 5119 10.290 25.200 19.540 1.00 0.00 ATOM 30973 H2 SOL 5119 11.400 26.230 19.560 1.00 0.00 ATOM 30974 OH2 SOL 5120 28.350 0.600 11.630 1.00 0.00 ATOM 30975 H1 SOL 5120 28.310 1.160 12.410 1.00 0.00 ATOM 30976 H2 SOL 5120 28.520 -0.280 11.980 1.00 0.00 ATOM 30977 OH2 SOL 5121 49.230 29.080 9.700 1.00 0.00 ATOM 30978 H1 SOL 5121 50.010 29.070 10.250 1.00 0.00 ATOM 30979 H2 SOL 5121 49.120 30.000 9.450 1.00 0.00 ATOM 30980 OH2 SOL 5122 12.770 0.950 70.070 1.00 0.00 ATOM 30981 H1 SOL 5122 12.090 0.300 69.900 1.00 0.00 ATOM 30982 H2 SOL 5122 13.510 0.660 69.530 1.00 0.00 ATOM 30983 OH2 SOL 5123 6.370 40.650 77.560 1.00 0.00 ATOM 30984 H1 SOL 5123 6.250 40.030 78.280 1.00 0.00 ATOM 30985 H2 SOL 5123 6.430 41.500 77.990 1.00 0.00 ATOM 30986 OH2 SOL 5124 26.870 33.970 81.350 1.00 0.00 ATOM 30987 H1 SOL 5124 27.770 33.710 81.530 1.00 0.00 ATOM 30988 H2 SOL 5124 26.940 34.750 80.800 1.00 0.00 ATOM 30989 OH2 SOL 5125 43.210 50.610 83.130 1.00 0.00 ATOM 30990 H1 SOL 5125 42.670 51.180 83.670 1.00 0.00 ATOM 30991 H2 SOL 5125 43.750 51.220 82.620 1.00 0.00 ATOM 30992 OH2 SOL 5126 33.890 19.930 5.650 1.00 0.00 ATOM 30993 H1 SOL 5126 33.340 19.940 4.870 1.00 0.00 ATOM 30994 H2 SOL 5126 33.850 20.830 5.980 1.00 0.00 ATOM 30995 OH2 SOL 5127 1.940 17.110 21.940 1.00 0.00 ATOM 30996 H1 SOL 5127 1.200 17.480 22.420 1.00 0.00 ATOM 30997 H2 SOL 5127 1.930 16.180 22.160 1.00 0.00 ATOM 30998 OH2 SOL 5128 34.590 40.410 0.220 1.00 0.00 ATOM 30999 H1 SOL 5128 34.250 40.030 1.040 1.00 0.00 ATOM 31000 H2 SOL 5128 34.050 40.010 -0.460 1.00 0.00 ATOM 31001 OH2 SOL 5129 6.130 23.330 82.880 1.00 0.00 ATOM 31002 H1 SOL 5129 6.280 22.450 83.210 1.00 0.00 ATOM 31003 H2 SOL 5129 6.380 23.900 83.620 1.00 0.00 ATOM 31004 OH2 SOL 5130 15.130 21.510 15.030 1.00 0.00 ATOM 31005 H1 SOL 5130 15.380 21.370 15.950 1.00 0.00 ATOM 31006 H2 SOL 5130 14.830 22.410 15.000 1.00 0.00 ATOM 31007 OH2 SOL 5131 8.530 22.180 69.880 1.00 0.00 ATOM 31008 H1 SOL 5131 8.030 22.430 69.100 1.00 0.00 ATOM 31009 H2 SOL 5131 8.120 22.670 70.600 1.00 0.00 ATOM 31010 OH2 SOL 5132 35.980 33.070 71.940 1.00 0.00 ATOM 31011 H1 SOL 5132 35.140 32.640 71.750 1.00 0.00 ATOM 31012 H2 SOL 5132 36.280 32.660 72.760 1.00 0.00 ATOM 31013 OH2 SOL 5133 23.310 31.720 74.340 1.00 0.00 ATOM 31014 H1 SOL 5133 22.830 32.500 74.640 1.00 0.00 ATOM 31015 H2 SOL 5133 22.820 31.420 73.580 1.00 0.00 ATOM 31016 OH2 SOL 5134 21.520 1.900 72.920 1.00 0.00 ATOM 31017 H1 SOL 5134 21.100 2.680 72.540 1.00 0.00 ATOM 31018 H2 SOL 5134 22.460 2.070 72.830 1.00 0.00 ATOM 31019 OH2 SOL 5135 56.070 28.560 63.910 1.00 0.00 ATOM 31020 H1 SOL 5135 56.600 28.360 63.150 1.00 0.00 ATOM 31021 H2 SOL 5135 55.790 27.710 64.250 1.00 0.00 ATOM 31022 OH2 SOL 5136 34.940 7.280 16.010 1.00 0.00 ATOM 31023 H1 SOL 5136 34.210 6.660 16.010 1.00 0.00 ATOM 31024 H2 SOL 5136 34.860 7.740 15.180 1.00 0.00 ATOM 31025 OH2 SOL 5137 56.350 16.020 13.990 1.00 0.00 ATOM 31026 H1 SOL 5137 55.980 15.270 14.460 1.00 0.00 ATOM 31027 H2 SOL 5137 56.910 15.630 13.310 1.00 0.00 ATOM 31028 OH2 SOL 5138 15.340 23.250 8.130 1.00 0.00 ATOM 31029 H1 SOL 5138 14.700 23.030 8.800 1.00 0.00 ATOM 31030 H2 SOL 5138 16.100 22.700 8.330 1.00 0.00 ATOM 31031 OH2 SOL 5139 9.020 42.080 8.850 1.00 0.00 ATOM 31032 H1 SOL 5139 9.250 43.000 8.740 1.00 0.00 ATOM 31033 H2 SOL 5139 8.720 41.800 7.980 1.00 0.00 ATOM 31034 OH2 SOL 5140 51.170 50.560 63.830 1.00 0.00 ATOM 31035 H1 SOL 5140 51.030 50.900 62.950 1.00 0.00 ATOM 31036 H2 SOL 5140 50.290 50.340 64.150 1.00 0.00 ATOM 31037 OH2 SOL 5141 2.430 37.800 66.040 1.00 0.00 ATOM 31038 H1 SOL 5141 2.680 36.970 66.450 1.00 0.00 ATOM 31039 H2 SOL 5141 1.660 37.590 65.520 1.00 0.00 ATOM 31040 OH2 SOL 5142 48.920 32.000 19.560 1.00 0.00 ATOM 31041 H1 SOL 5142 48.450 32.720 19.980 1.00 0.00 ATOM 31042 H2 SOL 5142 48.370 31.750 18.820 1.00 0.00 ATOM 31043 OH2 SOL 5143 12.310 30.590 22.250 1.00 0.00 ATOM 31044 H1 SOL 5143 13.240 30.760 22.100 1.00 0.00 ATOM 31045 H2 SOL 5143 12.050 31.250 22.900 1.00 0.00 ATOM 31046 OH2 SOL 5144 0.300 12.310 81.730 1.00 0.00 ATOM 31047 H1 SOL 5144 0.220 11.680 81.010 1.00 0.00 ATOM 31048 H2 SOL 5144 0.310 11.760 82.510 1.00 0.00 ATOM 31049 OH2 SOL 5145 20.770 18.630 12.150 1.00 0.00 ATOM 31050 H1 SOL 5145 20.520 17.920 12.740 1.00 0.00 ATOM 31051 H2 SOL 5145 21.730 18.660 12.200 1.00 0.00 ATOM 31052 OH2 SOL 5146 23.740 0.930 15.920 1.00 0.00 ATOM 31053 H1 SOL 5146 24.060 1.730 16.340 1.00 0.00 ATOM 31054 H2 SOL 5146 24.370 0.750 15.230 1.00 0.00 ATOM 31055 OH2 SOL 5147 12.900 2.720 13.280 1.00 0.00 ATOM 31056 H1 SOL 5147 13.550 2.370 12.670 1.00 0.00 ATOM 31057 H2 SOL 5147 12.190 2.080 13.270 1.00 0.00 ATOM 31058 OH2 SOL 5148 61.100 5.950 16.300 1.00 0.00 ATOM 31059 H1 SOL 5148 61.340 6.780 15.890 1.00 0.00 ATOM 31060 H2 SOL 5148 60.350 6.170 16.850 1.00 0.00 ATOM 31061 OH2 SOL 5149 60.940 27.150 1.890 1.00 0.00 ATOM 31062 H1 SOL 5149 60.220 26.510 1.930 1.00 0.00 ATOM 31063 H2 SOL 5149 60.650 27.880 2.430 1.00 0.00 ATOM 31064 OH2 SOL 5150 15.810 49.590 20.120 1.00 0.00 ATOM 31065 H1 SOL 5150 15.370 48.780 20.370 1.00 0.00 ATOM 31066 H2 SOL 5150 16.610 49.600 20.630 1.00 0.00 ATOM 31067 OH2 SOL 5151 11.680 16.820 0.380 1.00 0.00 ATOM 31068 H1 SOL 5151 12.400 17.150 0.920 1.00 0.00 ATOM 31069 H2 SOL 5151 11.100 16.380 1.000 1.00 0.00 ATOM 31070 OH2 SOL 5152 35.200 14.160 4.770 1.00 0.00 ATOM 31071 H1 SOL 5152 35.850 14.840 4.940 1.00 0.00 ATOM 31072 H2 SOL 5152 34.370 14.620 4.760 1.00 0.00 ATOM 31073 OH2 SOL 5153 60.990 16.960 66.690 1.00 0.00 ATOM 31074 H1 SOL 5153 60.840 16.180 66.160 1.00 0.00 ATOM 31075 H2 SOL 5153 61.590 17.490 66.160 1.00 0.00 ATOM 31076 OH2 SOL 5154 32.030 47.570 16.020 1.00 0.00 ATOM 31077 H1 SOL 5154 32.650 46.930 15.680 1.00 0.00 ATOM 31078 H2 SOL 5154 32.040 47.440 16.970 1.00 0.00 ATOM 31079 OH2 SOL 5155 8.320 36.760 77.710 1.00 0.00 ATOM 31080 H1 SOL 5155 8.910 36.530 78.420 1.00 0.00 ATOM 31081 H2 SOL 5155 8.620 37.620 77.410 1.00 0.00 ATOM 31082 OH2 SOL 5156 33.550 55.800 26.340 1.00 0.00 ATOM 31083 H1 SOL 5156 34.270 55.880 26.970 1.00 0.00 ATOM 31084 H2 SOL 5156 33.780 56.410 25.640 1.00 0.00 ATOM 31085 OH2 SOL 5157 42.420 33.570 8.620 1.00 0.00 ATOM 31086 H1 SOL 5157 41.480 33.580 8.750 1.00 0.00 ATOM 31087 H2 SOL 5157 42.590 32.780 8.110 1.00 0.00 ATOM 31088 OH2 SOL 5158 60.540 50.010 64.130 1.00 0.00 ATOM 31089 H1 SOL 5158 59.680 50.360 64.360 1.00 0.00 ATOM 31090 H2 SOL 5158 60.480 49.820 63.200 1.00 0.00 ATOM 31091 OH2 SOL 5159 51.290 21.230 11.820 1.00 0.00 ATOM 31092 H1 SOL 5159 51.450 21.070 10.890 1.00 0.00 ATOM 31093 H2 SOL 5159 50.710 20.510 12.090 1.00 0.00 ATOM 31094 OH2 SOL 5160 54.690 10.670 20.500 1.00 0.00 ATOM 31095 H1 SOL 5160 53.940 10.460 21.040 1.00 0.00 ATOM 31096 H2 SOL 5160 55.140 11.380 20.970 1.00 0.00 ATOM 31097 OH2 SOL 5161 20.330 43.560 83.260 1.00 0.00 ATOM 31098 H1 SOL 5161 20.830 43.140 83.960 1.00 0.00 ATOM 31099 H2 SOL 5161 20.820 43.350 82.460 1.00 0.00 ATOM 31100 OH2 SOL 5162 42.310 9.870 13.120 1.00 0.00 ATOM 31101 H1 SOL 5162 42.910 9.520 12.470 1.00 0.00 ATOM 31102 H2 SOL 5162 42.310 9.220 13.820 1.00 0.00 ATOM 31103 OH2 SOL 5163 9.680 56.670 64.520 1.00 0.00 ATOM 31104 H1 SOL 5163 10.550 57.020 64.700 1.00 0.00 ATOM 31105 H2 SOL 5163 9.830 55.970 63.880 1.00 0.00 ATOM 31106 OH2 SOL 5164 15.000 22.130 17.860 1.00 0.00 ATOM 31107 H1 SOL 5164 15.800 22.550 18.170 1.00 0.00 ATOM 31108 H2 SOL 5164 14.300 22.750 18.060 1.00 0.00 ATOM 31109 OH2 SOL 5165 11.200 25.290 10.280 1.00 0.00 ATOM 31110 H1 SOL 5165 11.330 25.450 11.210 1.00 0.00 ATOM 31111 H2 SOL 5165 10.300 25.570 10.100 1.00 0.00 ATOM 31112 OH2 SOL 5166 33.840 16.770 24.050 1.00 0.00 ATOM 31113 H1 SOL 5166 34.450 16.060 23.820 1.00 0.00 ATOM 31114 H2 SOL 5166 34.370 17.560 23.990 1.00 0.00 ATOM 31115 OH2 SOL 5167 40.850 6.280 16.540 1.00 0.00 ATOM 31116 H1 SOL 5167 40.870 6.030 17.460 1.00 0.00 ATOM 31117 H2 SOL 5167 40.710 5.460 16.060 1.00 0.00 ATOM 31118 OH2 SOL 5168 22.790 52.070 20.720 1.00 0.00 ATOM 31119 H1 SOL 5168 22.000 52.080 20.180 1.00 0.00 ATOM 31120 H2 SOL 5168 23.370 51.430 20.300 1.00 0.00 ATOM 31121 OH2 SOL 5169 20.130 49.970 4.070 1.00 0.00 ATOM 31122 H1 SOL 5169 19.510 49.250 4.140 1.00 0.00 ATOM 31123 H2 SOL 5169 19.820 50.500 3.340 1.00 0.00 ATOM 31124 OH2 SOL 5170 39.190 29.040 70.130 1.00 0.00 ATOM 31125 H1 SOL 5170 39.260 29.650 69.400 1.00 0.00 ATOM 31126 H2 SOL 5170 40.070 29.030 70.520 1.00 0.00 ATOM 31127 OH2 SOL 5171 58.050 38.760 17.350 1.00 0.00 ATOM 31128 H1 SOL 5171 58.350 39.520 17.840 1.00 0.00 ATOM 31129 H2 SOL 5171 57.180 38.570 17.720 1.00 0.00 ATOM 31130 OH2 SOL 5172 26.170 30.350 20.780 1.00 0.00 ATOM 31131 H1 SOL 5172 25.760 29.510 21.000 1.00 0.00 ATOM 31132 H2 SOL 5172 25.940 30.490 19.860 1.00 0.00 ATOM 31133 OH2 SOL 5173 52.520 50.480 80.660 1.00 0.00 ATOM 31134 H1 SOL 5173 52.280 50.210 81.550 1.00 0.00 ATOM 31135 H2 SOL 5173 52.080 51.330 80.550 1.00 0.00 ATOM 31136 OH2 SOL 5174 59.240 8.950 70.840 1.00 0.00 ATOM 31137 H1 SOL 5174 58.400 9.410 70.830 1.00 0.00 ATOM 31138 H2 SOL 5174 59.850 9.560 70.410 1.00 0.00 ATOM 31139 OH2 SOL 5175 1.670 8.960 14.770 1.00 0.00 ATOM 31140 H1 SOL 5175 0.750 8.780 14.950 1.00 0.00 ATOM 31141 H2 SOL 5175 1.760 8.780 13.830 1.00 0.00 ATOM 31142 OH2 SOL 5176 30.460 9.740 78.620 1.00 0.00 ATOM 31143 H1 SOL 5176 29.660 10.180 78.880 1.00 0.00 ATOM 31144 H2 SOL 5176 31.090 10.440 78.470 1.00 0.00 ATOM 31145 OH2 SOL 5177 16.380 33.670 8.240 1.00 0.00 ATOM 31146 H1 SOL 5177 16.110 34.280 7.560 1.00 0.00 ATOM 31147 H2 SOL 5177 15.660 33.040 8.300 1.00 0.00 ATOM 31148 OH2 SOL 5178 24.000 30.010 10.900 1.00 0.00 ATOM 31149 H1 SOL 5178 23.940 29.050 10.910 1.00 0.00 ATOM 31150 H2 SOL 5178 24.860 30.210 11.250 1.00 0.00 ATOM 31151 OH2 SOL 5179 59.740 31.350 15.800 1.00 0.00 ATOM 31152 H1 SOL 5179 59.580 31.080 16.710 1.00 0.00 ATOM 31153 H2 SOL 5179 59.540 32.290 15.800 1.00 0.00 ATOM 31154 OH2 SOL 5180 46.700 42.790 19.590 1.00 0.00 ATOM 31155 H1 SOL 5180 46.300 43.660 19.600 1.00 0.00 ATOM 31156 H2 SOL 5180 46.100 42.250 20.110 1.00 0.00 ATOM 31157 OH2 SOL 5181 25.180 58.010 4.710 1.00 0.00 ATOM 31158 H1 SOL 5181 25.900 57.420 4.470 1.00 0.00 ATOM 31159 H2 SOL 5181 25.620 58.810 5.030 1.00 0.00 ATOM 31160 OH2 SOL 5182 24.840 40.110 12.240 1.00 0.00 ATOM 31161 H1 SOL 5182 25.030 39.830 13.140 1.00 0.00 ATOM 31162 H2 SOL 5182 23.930 39.830 12.090 1.00 0.00 ATOM 31163 OH2 SOL 5183 60.020 38.190 1.740 1.00 0.00 ATOM 31164 H1 SOL 5183 60.760 38.370 1.150 1.00 0.00 ATOM 31165 H2 SOL 5183 60.420 38.120 2.610 1.00 0.00 ATOM 31166 OH2 SOL 5184 37.810 56.970 21.220 1.00 0.00 ATOM 31167 H1 SOL 5184 38.600 57.490 21.320 1.00 0.00 ATOM 31168 H2 SOL 5184 38.130 56.100 20.980 1.00 0.00 ATOM 31169 OH2 SOL 5185 11.410 58.520 79.510 1.00 0.00 ATOM 31170 H1 SOL 5185 11.660 57.810 80.100 1.00 0.00 ATOM 31171 H2 SOL 5185 12.110 59.170 79.600 1.00 0.00 ATOM 31172 OH2 SOL 5186 4.530 57.700 14.410 1.00 0.00 ATOM 31173 H1 SOL 5186 3.580 57.700 14.470 1.00 0.00 ATOM 31174 H2 SOL 5186 4.760 58.630 14.300 1.00 0.00 ATOM 31175 OH2 SOL 5187 5.430 40.840 7.780 1.00 0.00 ATOM 31176 H1 SOL 5187 6.110 41.190 7.210 1.00 0.00 ATOM 31177 H2 SOL 5187 4.700 40.640 7.190 1.00 0.00 ATOM 31178 OH2 SOL 5188 14.220 20.220 72.450 1.00 0.00 ATOM 31179 H1 SOL 5188 13.830 20.650 73.210 1.00 0.00 ATOM 31180 H2 SOL 5188 14.980 19.760 72.800 1.00 0.00 ATOM 31181 OH2 SOL 5189 34.070 30.420 7.770 1.00 0.00 ATOM 31182 H1 SOL 5189 33.650 30.260 8.610 1.00 0.00 ATOM 31183 H2 SOL 5189 33.350 30.390 7.140 1.00 0.00 ATOM 31184 OH2 SOL 5190 44.740 30.030 73.230 1.00 0.00 ATOM 31185 H1 SOL 5190 44.860 30.310 72.320 1.00 0.00 ATOM 31186 H2 SOL 5190 45.500 30.390 73.690 1.00 0.00 ATOM 31187 OH2 SOL 5191 54.110 52.880 15.310 1.00 0.00 ATOM 31188 H1 SOL 5191 54.480 52.580 14.480 1.00 0.00 ATOM 31189 H2 SOL 5191 54.440 53.770 15.420 1.00 0.00 ATOM 31190 OH2 SOL 5192 26.050 29.620 23.740 1.00 0.00 ATOM 31191 H1 SOL 5192 26.260 29.860 22.830 1.00 0.00 ATOM 31192 H2 SOL 5192 26.060 28.660 23.750 1.00 0.00 ATOM 31193 OH2 SOL 5193 5.120 27.470 0.730 1.00 0.00 ATOM 31194 H1 SOL 5193 4.730 27.350 1.600 1.00 0.00 ATOM 31195 H2 SOL 5193 4.820 26.720 0.220 1.00 0.00 ATOM 31196 OH2 SOL 5194 36.730 9.030 74.400 1.00 0.00 ATOM 31197 H1 SOL 5194 36.140 9.120 75.150 1.00 0.00 ATOM 31198 H2 SOL 5194 37.100 8.160 74.490 1.00 0.00 ATOM 31199 OH2 SOL 5195 14.010 42.120 11.560 1.00 0.00 ATOM 31200 H1 SOL 5195 14.430 42.280 10.710 1.00 0.00 ATOM 31201 H2 SOL 5195 13.480 41.340 11.430 1.00 0.00 ATOM 31202 OH2 SOL 5196 44.520 30.310 82.230 1.00 0.00 ATOM 31203 H1 SOL 5196 44.980 29.530 82.550 1.00 0.00 ATOM 31204 H2 SOL 5196 44.700 30.980 82.880 1.00 0.00 ATOM 31205 OH2 SOL 5197 14.340 45.950 5.850 1.00 0.00 ATOM 31206 H1 SOL 5197 13.650 45.400 6.220 1.00 0.00 ATOM 31207 H2 SOL 5197 15.130 45.690 6.320 1.00 0.00 ATOM 31208 OH2 SOL 5198 19.990 26.770 67.370 1.00 0.00 ATOM 31209 H1 SOL 5198 19.300 27.370 67.070 1.00 0.00 ATOM 31210 H2 SOL 5198 20.810 27.170 67.070 1.00 0.00 ATOM 31211 OH2 SOL 5199 48.760 48.270 12.620 1.00 0.00 ATOM 31212 H1 SOL 5199 49.220 47.520 12.250 1.00 0.00 ATOM 31213 H2 SOL 5199 48.640 48.870 11.880 1.00 0.00 ATOM 31214 OH2 SOL 5200 50.770 8.070 13.300 1.00 0.00 ATOM 31215 H1 SOL 5200 50.460 7.360 13.860 1.00 0.00 ATOM 31216 H2 SOL 5200 50.700 8.860 13.850 1.00 0.00 ATOM 31217 OH2 SOL 5201 6.630 39.390 79.880 1.00 0.00 ATOM 31218 H1 SOL 5201 6.280 38.500 80.030 1.00 0.00 ATOM 31219 H2 SOL 5201 7.220 39.530 80.620 1.00 0.00 ATOM 31220 OH2 SOL 5202 53.190 1.190 4.170 1.00 0.00 ATOM 31221 H1 SOL 5202 52.470 0.730 4.600 1.00 0.00 ATOM 31222 H2 SOL 5202 52.760 1.770 3.540 1.00 0.00 ATOM 31223 OH2 SOL 5203 27.260 20.310 21.090 1.00 0.00 ATOM 31224 H1 SOL 5203 27.910 19.730 21.480 1.00 0.00 ATOM 31225 H2 SOL 5203 26.460 20.140 21.590 1.00 0.00 ATOM 31226 OH2 SOL 5204 18.510 39.410 82.440 1.00 0.00 ATOM 31227 H1 SOL 5204 18.300 40.040 83.130 1.00 0.00 ATOM 31228 H2 SOL 5204 17.850 38.720 82.540 1.00 0.00 ATOM 31229 OH2 SOL 5205 1.730 21.670 13.180 1.00 0.00 ATOM 31230 H1 SOL 5205 2.520 21.400 13.660 1.00 0.00 ATOM 31231 H2 SOL 5205 1.100 20.970 13.340 1.00 0.00 ATOM 31232 OH2 SOL 5206 21.330 26.740 9.390 1.00 0.00 ATOM 31233 H1 SOL 5206 21.280 25.790 9.390 1.00 0.00 ATOM 31234 H2 SOL 5206 20.420 27.030 9.300 1.00 0.00 ATOM 31235 OH2 SOL 5207 60.200 51.460 69.930 1.00 0.00 ATOM 31236 H1 SOL 5207 60.380 50.840 70.640 1.00 0.00 ATOM 31237 H2 SOL 5207 60.210 50.920 69.140 1.00 0.00 ATOM 31238 OH2 SOL 5208 3.430 30.630 76.400 1.00 0.00 ATOM 31239 H1 SOL 5208 3.210 31.550 76.250 1.00 0.00 ATOM 31240 H2 SOL 5208 3.660 30.590 77.330 1.00 0.00 ATOM 31241 OH2 SOL 5209 39.470 3.580 11.060 1.00 0.00 ATOM 31242 H1 SOL 5209 39.890 3.650 10.200 1.00 0.00 ATOM 31243 H2 SOL 5209 40.010 4.130 11.630 1.00 0.00 ATOM 31244 OH2 SOL 5210 22.320 45.780 4.500 1.00 0.00 ATOM 31245 H1 SOL 5210 23.080 46.250 4.170 1.00 0.00 ATOM 31246 H2 SOL 5210 22.110 45.140 3.820 1.00 0.00 ATOM 31247 OH2 SOL 5211 14.300 21.300 21.780 1.00 0.00 ATOM 31248 H1 SOL 5211 14.600 21.840 22.510 1.00 0.00 ATOM 31249 H2 SOL 5211 15.100 21.060 21.310 1.00 0.00 ATOM 31250 OH2 SOL 5212 49.120 45.680 11.310 1.00 0.00 ATOM 31251 H1 SOL 5212 48.680 45.300 10.550 1.00 0.00 ATOM 31252 H2 SOL 5212 49.850 45.080 11.480 1.00 0.00 ATOM 31253 OH2 SOL 5213 27.860 31.020 65.130 1.00 0.00 ATOM 31254 H1 SOL 5213 27.120 30.850 65.710 1.00 0.00 ATOM 31255 H2 SOL 5213 28.240 31.840 65.460 1.00 0.00 ATOM 31256 OH2 SOL 5214 30.370 49.190 19.430 1.00 0.00 ATOM 31257 H1 SOL 5214 31.130 48.930 18.920 1.00 0.00 ATOM 31258 H2 SOL 5214 29.750 48.460 19.320 1.00 0.00 ATOM 31259 OH2 SOL 5215 23.740 41.210 20.860 1.00 0.00 ATOM 31260 H1 SOL 5215 23.650 40.720 21.680 1.00 0.00 ATOM 31261 H2 SOL 5215 23.550 42.120 21.110 1.00 0.00 ATOM 31262 OH2 SOL 5216 14.410 58.540 68.030 1.00 0.00 ATOM 31263 H1 SOL 5216 14.820 58.240 67.230 1.00 0.00 ATOM 31264 H2 SOL 5216 13.980 57.770 68.400 1.00 0.00 ATOM 31265 OH2 SOL 5217 7.310 43.920 20.690 1.00 0.00 ATOM 31266 H1 SOL 5217 8.250 43.750 20.800 1.00 0.00 ATOM 31267 H2 SOL 5217 6.890 43.090 20.940 1.00 0.00 ATOM 31268 OH2 SOL 5218 44.440 2.140 77.260 1.00 0.00 ATOM 31269 H1 SOL 5218 44.700 2.010 78.180 1.00 0.00 ATOM 31270 H2 SOL 5218 44.980 1.510 76.780 1.00 0.00 ATOM 31271 OH2 SOL 5219 31.450 32.260 25.040 1.00 0.00 ATOM 31272 H1 SOL 5219 31.930 33.050 25.270 1.00 0.00 ATOM 31273 H2 SOL 5219 31.800 31.580 25.620 1.00 0.00 ATOM 31274 OH2 SOL 5220 48.090 18.080 14.420 1.00 0.00 ATOM 31275 H1 SOL 5220 47.230 18.380 14.120 1.00 0.00 ATOM 31276 H2 SOL 5220 48.360 18.750 15.060 1.00 0.00 ATOM 31277 OH2 SOL 5221 30.180 58.130 13.880 1.00 0.00 ATOM 31278 H1 SOL 5221 30.630 58.820 13.380 1.00 0.00 ATOM 31279 H2 SOL 5221 30.470 58.270 14.790 1.00 0.00 ATOM 31280 OH2 SOL 5222 57.640 32.450 79.210 1.00 0.00 ATOM 31281 H1 SOL 5222 57.830 32.020 78.380 1.00 0.00 ATOM 31282 H2 SOL 5222 56.820 32.930 79.050 1.00 0.00 ATOM 31283 OH2 SOL 5223 6.260 57.810 71.920 1.00 0.00 ATOM 31284 H1 SOL 5223 6.680 57.770 71.060 1.00 0.00 ATOM 31285 H2 SOL 5223 6.800 57.240 72.470 1.00 0.00 ATOM 31286 OH2 SOL 5224 40.160 58.370 71.960 1.00 0.00 ATOM 31287 H1 SOL 5224 39.460 58.750 72.500 1.00 0.00 ATOM 31288 H2 SOL 5224 39.840 58.470 71.060 1.00 0.00 ATOM 31289 OH2 SOL 5225 49.700 14.070 79.210 1.00 0.00 ATOM 31290 H1 SOL 5225 50.030 14.770 79.770 1.00 0.00 ATOM 31291 H2 SOL 5225 49.750 14.420 78.320 1.00 0.00 ATOM 31292 OH2 SOL 5226 50.260 21.080 17.170 1.00 0.00 ATOM 31293 H1 SOL 5226 49.890 21.700 17.810 1.00 0.00 ATOM 31294 H2 SOL 5226 51.130 21.420 17.000 1.00 0.00 ATOM 31295 OH2 SOL 5227 33.290 21.910 8.510 1.00 0.00 ATOM 31296 H1 SOL 5227 32.820 22.480 9.120 1.00 0.00 ATOM 31297 H2 SOL 5227 33.280 22.380 7.680 1.00 0.00 ATOM 31298 OH2 SOL 5228 30.230 47.910 65.980 1.00 0.00 ATOM 31299 H1 SOL 5228 30.880 47.360 65.550 1.00 0.00 ATOM 31300 H2 SOL 5228 29.930 48.510 65.300 1.00 0.00 ATOM 31301 OH2 SOL 5229 41.260 31.920 77.570 1.00 0.00 ATOM 31302 H1 SOL 5229 41.550 31.830 78.480 1.00 0.00 ATOM 31303 H2 SOL 5229 42.080 31.980 77.070 1.00 0.00 ATOM 31304 OH2 SOL 5230 39.650 51.920 5.250 1.00 0.00 ATOM 31305 H1 SOL 5230 40.500 51.680 5.620 1.00 0.00 ATOM 31306 H2 SOL 5230 39.020 51.380 5.730 1.00 0.00 ATOM 31307 OH2 SOL 5231 21.320 46.020 11.280 1.00 0.00 ATOM 31308 H1 SOL 5231 21.360 45.260 11.860 1.00 0.00 ATOM 31309 H2 SOL 5231 20.580 45.850 10.700 1.00 0.00 ATOM 31310 OH2 SOL 5232 23.820 11.190 69.110 1.00 0.00 ATOM 31311 H1 SOL 5232 24.250 10.760 69.840 1.00 0.00 ATOM 31312 H2 SOL 5232 23.770 10.520 68.430 1.00 0.00 ATOM 31313 OH2 SOL 5233 30.120 55.870 4.840 1.00 0.00 ATOM 31314 H1 SOL 5233 29.550 55.160 5.140 1.00 0.00 ATOM 31315 H2 SOL 5233 29.560 56.640 4.830 1.00 0.00 ATOM 31316 OH2 SOL 5234 14.810 30.440 80.550 1.00 0.00 ATOM 31317 H1 SOL 5234 15.660 30.840 80.760 1.00 0.00 ATOM 31318 H2 SOL 5234 14.780 29.650 81.090 1.00 0.00 ATOM 31319 OH2 SOL 5235 57.850 5.380 74.140 1.00 0.00 ATOM 31320 H1 SOL 5235 58.440 6.100 73.920 1.00 0.00 ATOM 31321 H2 SOL 5235 57.830 5.360 75.090 1.00 0.00 ATOM 31322 OH2 SOL 5236 1.740 50.120 12.920 1.00 0.00 ATOM 31323 H1 SOL 5236 0.940 50.530 13.240 1.00 0.00 ATOM 31324 H2 SOL 5236 1.710 50.260 11.970 1.00 0.00 ATOM 31325 OH2 SOL 5237 4.080 6.140 68.110 1.00 0.00 ATOM 31326 H1 SOL 5237 3.190 6.020 67.780 1.00 0.00 ATOM 31327 H2 SOL 5237 4.610 5.510 67.610 1.00 0.00 ATOM 31328 OH2 SOL 5238 55.660 44.490 76.990 1.00 0.00 ATOM 31329 H1 SOL 5238 56.330 43.840 77.200 1.00 0.00 ATOM 31330 H2 SOL 5238 55.400 44.290 76.090 1.00 0.00 ATOM 31331 OH2 SOL 5239 20.110 1.900 7.300 1.00 0.00 ATOM 31332 H1 SOL 5239 19.510 2.550 6.940 1.00 0.00 ATOM 31333 H2 SOL 5239 20.840 2.410 7.640 1.00 0.00 ATOM 31334 OH2 SOL 5240 0.740 32.510 5.900 1.00 0.00 ATOM 31335 H1 SOL 5240 0.180 32.610 6.670 1.00 0.00 ATOM 31336 H2 SOL 5240 0.250 31.920 5.330 1.00 0.00 ATOM 31337 OH2 SOL 5241 17.040 21.700 20.860 1.00 0.00 ATOM 31338 H1 SOL 5241 16.920 20.980 21.480 1.00 0.00 ATOM 31339 H2 SOL 5241 17.980 21.690 20.660 1.00 0.00 ATOM 31340 OH2 SOL 5242 38.080 50.180 6.380 1.00 0.00 ATOM 31341 H1 SOL 5242 37.690 49.310 6.480 1.00 0.00 ATOM 31342 H2 SOL 5242 37.750 50.670 7.140 1.00 0.00 ATOM 31343 OH2 SOL 5243 56.490 10.060 63.280 1.00 0.00 ATOM 31344 H1 SOL 5243 56.920 10.840 62.930 1.00 0.00 ATOM 31345 H2 SOL 5243 57.170 9.620 63.780 1.00 0.00 ATOM 31346 OH2 SOL 5244 6.790 37.760 64.410 1.00 0.00 ATOM 31347 H1 SOL 5244 6.780 36.820 64.570 1.00 0.00 ATOM 31348 H2 SOL 5244 6.280 38.140 65.120 1.00 0.00 ATOM 31349 OH2 SOL 5245 47.740 44.320 9.260 1.00 0.00 ATOM 31350 H1 SOL 5245 48.190 44.200 8.430 1.00 0.00 ATOM 31351 H2 SOL 5245 47.410 43.440 9.480 1.00 0.00 ATOM 31352 OH2 SOL 5246 23.010 51.980 10.250 1.00 0.00 ATOM 31353 H1 SOL 5246 22.890 51.060 10.520 1.00 0.00 ATOM 31354 H2 SOL 5246 22.780 52.480 11.040 1.00 0.00 ATOM 31355 OH2 SOL 5247 52.200 49.520 72.410 1.00 0.00 ATOM 31356 H1 SOL 5247 51.350 49.520 71.970 1.00 0.00 ATOM 31357 H2 SOL 5247 52.800 49.100 71.790 1.00 0.00 ATOM 31358 OH2 SOL 5248 6.990 27.460 17.730 1.00 0.00 ATOM 31359 H1 SOL 5248 6.100 27.280 18.040 1.00 0.00 ATOM 31360 H2 SOL 5248 7.510 27.580 18.520 1.00 0.00 TER ENDMDL