TITLE DPPE - 128 lipids & 40 H2O/lipid REMARK THIS IS A SIMULATION BOX CRYST1 59.674 60.778 84.763 90.00 90.00 90.00 P 1 1 MODEL 1 ATOM 1 N DPP 1 40.340 20.620 57.470 1.00 0.00 ATOM 2 HN1 DPP 1 39.320 20.410 57.480 1.00 0.00 ATOM 3 HN2 DPP 1 40.830 19.850 56.960 1.00 0.00 ATOM 4 HN3 DPP 1 40.650 20.580 58.460 1.00 0.00 ATOM 5 C12 DPP 1 40.390 21.970 56.800 1.00 0.00 ATOM 6 H12A DPP 1 39.640 21.970 55.980 1.00 0.00 ATOM 7 H12B DPP 1 41.430 22.140 56.450 1.00 0.00 ATOM 8 C11 DPP 1 40.000 23.070 57.800 1.00 0.00 ATOM 9 H11A DPP 1 39.890 24.030 57.260 1.00 0.00 ATOM 10 H11B DPP 1 40.750 23.100 58.620 1.00 0.00 ATOM 11 P DPP 1 38.340 23.920 59.530 1.00 0.00 ATOM 12 O13 DPP 1 39.200 23.890 60.730 1.00 0.00 ATOM 13 O14 DPP 1 36.890 23.860 59.810 1.00 0.00 ATOM 14 O11 DPP 1 38.620 25.290 58.750 1.00 0.00 ATOM 15 O12 DPP 1 38.790 22.790 58.490 1.00 0.00 ATOM 16 C1 DPP 1 39.030 26.400 59.560 1.00 0.00 ATOM 17 HA DPP 1 39.220 27.280 58.910 1.00 0.00 ATOM 18 HB DPP 1 40.020 26.260 60.050 1.00 0.00 ATOM 19 C2 DPP 1 37.950 26.850 60.560 1.00 0.00 ATOM 20 HS DPP 1 37.790 26.050 61.310 1.00 0.00 ATOM 21 O21 DPP 1 36.750 27.070 59.820 1.00 0.00 ATOM 22 C21 DPP 1 35.650 26.990 60.580 1.00 0.00 ATOM 23 O22 DPP 1 35.680 26.650 61.760 1.00 0.00 ATOM 24 C22 DPP 1 34.400 27.070 59.730 1.00 0.00 ATOM 25 H2R DPP 1 33.750 27.810 60.250 1.00 0.00 ATOM 26 H2S DPP 1 33.820 26.120 59.670 1.00 0.00 ATOM 27 C3 DPP 1 38.560 28.050 61.300 1.00 0.00 ATOM 28 HX DPP 1 39.420 27.710 61.900 1.00 0.00 ATOM 29 HY DPP 1 37.790 28.340 62.060 1.00 0.00 ATOM 30 O31 DPP 1 38.950 29.140 60.460 1.00 0.00 ATOM 31 C31 DPP 1 38.000 29.950 59.990 1.00 0.00 ATOM 32 O32 DPP 1 36.840 29.970 60.370 1.00 0.00 ATOM 33 C32 DPP 1 38.550 30.900 58.930 1.00 0.00 ATOM 34 H2X DPP 1 39.620 30.600 58.850 1.00 0.00 ATOM 35 H2Y DPP 1 38.560 31.950 59.280 1.00 0.00 ATOM 36 C23 DPP 1 34.700 27.520 58.300 1.00 0.00 ATOM 37 H3R DPP 1 35.410 26.840 57.770 1.00 0.00 ATOM 38 H3S DPP 1 35.340 28.420 58.230 1.00 0.00 ATOM 39 C24 DPP 1 33.440 27.940 57.540 1.00 0.00 ATOM 40 H4R DPP 1 33.630 28.850 56.930 1.00 0.00 ATOM 41 H4S DPP 1 32.690 28.220 58.310 1.00 0.00 ATOM 42 C25 DPP 1 32.910 26.820 56.650 1.00 0.00 ATOM 43 H5R DPP 1 32.570 25.980 57.290 1.00 0.00 ATOM 44 H5S DPP 1 33.740 26.440 56.010 1.00 0.00 ATOM 45 C26 DPP 1 31.760 27.270 55.750 1.00 0.00 ATOM 46 H6R DPP 1 31.140 28.030 56.270 1.00 0.00 ATOM 47 H6S DPP 1 31.250 26.300 55.540 1.00 0.00 ATOM 48 C27 DPP 1 32.400 27.890 54.510 1.00 0.00 ATOM 49 H7R DPP 1 33.310 27.390 54.120 1.00 0.00 ATOM 50 H7S DPP 1 32.790 28.860 54.900 1.00 0.00 ATOM 51 C28 DPP 1 31.490 28.150 53.310 1.00 0.00 ATOM 52 H8R DPP 1 30.520 28.530 53.710 1.00 0.00 ATOM 53 H8S DPP 1 31.190 27.190 52.820 1.00 0.00 ATOM 54 C29 DPP 1 32.040 29.130 52.270 1.00 0.00 ATOM 55 H9R DPP 1 32.590 29.980 52.740 1.00 0.00 ATOM 56 H9S DPP 1 31.220 29.540 51.650 1.00 0.00 ATOM 57 0C21 DPP 1 32.990 28.480 51.260 1.00 0.00 ATOM 58 H10R DPP 1 32.800 27.390 51.160 1.00 0.00 ATOM 59 H10S DPP 1 34.040 28.600 51.600 1.00 0.00 ATOM 60 1C21 DPP 1 32.880 29.050 49.850 1.00 0.00 ATOM 61 H11R DPP 1 33.060 30.140 49.950 1.00 0.00 ATOM 62 H11S DPP 1 31.860 28.950 49.420 1.00 0.00 ATOM 63 2C21 DPP 1 33.960 28.470 48.930 1.00 0.00 ATOM 64 H12R DPP 1 33.670 27.410 48.780 1.00 0.00 ATOM 65 H12S DPP 1 34.930 28.350 49.450 1.00 0.00 ATOM 66 3C21 DPP 1 34.070 29.250 47.610 1.00 0.00 ATOM 67 H13R DPP 1 34.390 30.300 47.770 1.00 0.00 ATOM 68 H13S DPP 1 33.090 29.380 47.120 1.00 0.00 ATOM 69 4C21 DPP 1 35.030 28.660 46.570 1.00 0.00 ATOM 70 H14R DPP 1 36.010 28.590 47.090 1.00 0.00 ATOM 71 H14S DPP 1 35.040 29.290 45.650 1.00 0.00 ATOM 72 5C21 DPP 1 34.770 27.240 46.070 1.00 0.00 ATOM 73 H15R DPP 1 34.830 26.590 46.980 1.00 0.00 ATOM 74 H15S DPP 1 35.470 26.850 45.310 1.00 0.00 ATOM 75 6C21 DPP 1 33.320 26.930 45.710 1.00 0.00 ATOM 76 H16R DPP 1 33.140 25.840 45.760 1.00 0.00 ATOM 77 H16S DPP 1 33.040 27.290 44.690 1.00 0.00 ATOM 78 H16T DPP 1 32.670 27.350 46.510 1.00 0.00 ATOM 79 C33 DPP 1 37.650 30.750 57.710 1.00 0.00 ATOM 80 H3X DPP 1 38.000 31.560 57.040 1.00 0.00 ATOM 81 H3Y DPP 1 36.550 30.820 57.870 1.00 0.00 ATOM 82 C34 DPP 1 37.930 29.460 56.930 1.00 0.00 ATOM 83 H4X DPP 1 37.370 28.630 57.410 1.00 0.00 ATOM 84 H4Y DPP 1 39.030 29.330 57.050 1.00 0.00 ATOM 85 C35 DPP 1 37.600 29.530 55.440 1.00 0.00 ATOM 86 H5X DPP 1 37.980 28.570 55.030 1.00 0.00 ATOM 87 H5Y DPP 1 38.080 30.410 54.960 1.00 0.00 ATOM 88 C36 DPP 1 36.090 29.550 55.160 1.00 0.00 ATOM 89 H6X DPP 1 35.570 30.410 55.620 1.00 0.00 ATOM 90 H6Y DPP 1 35.750 28.560 55.540 1.00 0.00 ATOM 91 C37 DPP 1 35.760 29.530 53.670 1.00 0.00 ATOM 92 H7X DPP 1 34.670 29.660 53.470 1.00 0.00 ATOM 93 H7Y DPP 1 36.270 28.670 53.190 1.00 0.00 ATOM 94 C38 DPP 1 36.300 30.800 53.000 1.00 0.00 ATOM 95 H8X DPP 1 37.410 30.730 53.030 1.00 0.00 ATOM 96 H8Y DPP 1 35.900 31.620 53.630 1.00 0.00 ATOM 97 C39 DPP 1 35.890 30.900 51.530 1.00 0.00 ATOM 98 H9X DPP 1 34.810 31.070 51.360 1.00 0.00 ATOM 99 H9Y DPP 1 36.020 29.880 51.110 1.00 0.00 ATOM 100 0C31 DPP 1 36.700 31.930 50.730 1.00 0.00 ATOM 101 H10X DPP 1 37.720 31.490 50.710 1.00 0.00 ATOM 102 H10Y DPP 1 36.830 32.930 51.190 1.00 0.00 ATOM 103 1C31 DPP 1 36.220 31.970 49.280 1.00 0.00 ATOM 104 H11X DPP 1 35.330 32.620 49.260 1.00 0.00 ATOM 105 H11Y DPP 1 35.810 30.990 48.970 1.00 0.00 ATOM 106 2C31 DPP 1 37.260 32.530 48.300 1.00 0.00 ATOM 107 H12X DPP 1 38.050 31.780 48.070 1.00 0.00 ATOM 108 H12Y DPP 1 37.560 33.570 48.540 1.00 0.00 ATOM 109 3C31 DPP 1 36.600 32.650 46.920 1.00 0.00 ATOM 110 H13X DPP 1 35.720 33.320 47.030 1.00 0.00 ATOM 111 H13Y DPP 1 36.170 31.660 46.690 1.00 0.00 ATOM 112 4C31 DPP 1 37.580 33.140 45.850 1.00 0.00 ATOM 113 H14X DPP 1 38.470 32.470 45.760 1.00 0.00 ATOM 114 H14Y DPP 1 37.900 34.190 46.020 1.00 0.00 ATOM 115 5C31 DPP 1 36.980 32.990 44.460 1.00 0.00 ATOM 116 H15X DPP 1 35.920 32.650 44.550 1.00 0.00 ATOM 117 H15Y DPP 1 37.450 32.110 43.970 1.00 0.00 ATOM 118 6C31 DPP 1 37.030 34.220 43.550 1.00 0.00 ATOM 119 H16X DPP 1 36.580 33.950 42.570 1.00 0.00 ATOM 120 H16Y DPP 1 38.090 34.460 43.320 1.00 0.00 ATOM 121 H16Z DPP 1 36.470 35.040 44.040 1.00 0.00 ATOM 122 N DPP 2 54.820 47.410 64.030 1.00 0.00 ATOM 123 HN1 DPP 2 55.580 47.710 64.670 1.00 0.00 ATOM 124 HN2 DPP 2 54.810 46.380 63.910 1.00 0.00 ATOM 125 HN3 DPP 2 55.160 47.800 63.130 1.00 0.00 ATOM 126 C12 DPP 2 53.400 47.730 64.440 1.00 0.00 ATOM 127 H12A DPP 2 53.330 47.310 65.460 1.00 0.00 ATOM 128 H12B DPP 2 52.730 47.080 63.840 1.00 0.00 ATOM 129 C11 DPP 2 53.220 49.250 64.510 1.00 0.00 ATOM 130 H11A DPP 2 53.920 49.740 65.220 1.00 0.00 ATOM 131 H11B DPP 2 52.230 49.540 64.920 1.00 0.00 ATOM 132 P DPP 2 52.100 50.050 62.350 1.00 0.00 ATOM 133 O13 DPP 2 52.590 50.720 61.120 1.00 0.00 ATOM 134 O14 DPP 2 51.040 50.860 62.990 1.00 0.00 ATOM 135 O11 DPP 2 51.590 48.570 61.990 1.00 0.00 ATOM 136 O12 DPP 2 53.420 49.850 63.230 1.00 0.00 ATOM 137 C1 DPP 2 52.390 47.900 61.010 1.00 0.00 ATOM 138 HA DPP 2 52.410 46.820 61.290 1.00 0.00 ATOM 139 HB DPP 2 53.390 48.350 60.870 1.00 0.00 ATOM 140 C2 DPP 2 51.650 47.810 59.670 1.00 0.00 ATOM 141 HS DPP 2 51.580 48.810 59.190 1.00 0.00 ATOM 142 O21 DPP 2 50.360 47.290 60.010 1.00 0.00 ATOM 143 C21 DPP 2 49.430 47.760 59.180 1.00 0.00 ATOM 144 O22 DPP 2 49.540 48.820 58.570 1.00 0.00 ATOM 145 C22 DPP 2 48.240 46.820 59.290 1.00 0.00 ATOM 146 H2R DPP 2 47.300 47.340 59.570 1.00 0.00 ATOM 147 H2S DPP 2 48.370 46.100 60.120 1.00 0.00 ATOM 148 C3 DPP 2 52.360 46.750 58.800 1.00 0.00 ATOM 149 HX DPP 2 51.850 45.820 59.120 1.00 0.00 ATOM 150 HY DPP 2 53.460 46.810 58.860 1.00 0.00 ATOM 151 O31 DPP 2 52.100 46.930 57.410 1.00 0.00 ATOM 152 C31 DPP 2 52.450 48.030 56.760 1.00 0.00 ATOM 153 O32 DPP 2 53.070 48.950 57.290 1.00 0.00 ATOM 154 C32 DPP 2 52.020 47.840 55.310 1.00 0.00 ATOM 155 H2X DPP 2 50.920 47.720 55.260 1.00 0.00 ATOM 156 H2Y DPP 2 52.650 47.080 54.800 1.00 0.00 ATOM 157 C23 DPP 2 48.120 46.060 57.960 1.00 0.00 ATOM 158 H3R DPP 2 49.050 45.530 57.680 1.00 0.00 ATOM 159 H3S DPP 2 47.840 46.850 57.230 1.00 0.00 ATOM 160 C24 DPP 2 46.960 45.090 58.150 1.00 0.00 ATOM 161 H4R DPP 2 46.120 45.580 58.680 1.00 0.00 ATOM 162 H4S DPP 2 47.450 44.380 58.850 1.00 0.00 ATOM 163 C25 DPP 2 46.380 44.240 57.010 1.00 0.00 ATOM 164 H5R DPP 2 45.680 43.490 57.420 1.00 0.00 ATOM 165 H5S DPP 2 47.240 43.720 56.540 1.00 0.00 ATOM 166 C26 DPP 2 45.850 45.120 55.880 1.00 0.00 ATOM 167 H6R DPP 2 46.520 46.000 55.750 1.00 0.00 ATOM 168 H6S DPP 2 44.850 45.480 56.210 1.00 0.00 ATOM 169 C27 DPP 2 45.720 44.370 54.550 1.00 0.00 ATOM 170 H7R DPP 2 45.050 43.500 54.700 1.00 0.00 ATOM 171 H7S DPP 2 46.670 43.920 54.200 1.00 0.00 ATOM 172 C28 DPP 2 45.040 45.180 53.440 1.00 0.00 ATOM 173 H8R DPP 2 45.600 46.110 53.200 1.00 0.00 ATOM 174 H8S DPP 2 44.040 45.630 53.620 1.00 0.00 ATOM 175 C29 DPP 2 44.940 44.310 52.180 1.00 0.00 ATOM 176 H9R DPP 2 44.300 43.450 52.460 1.00 0.00 ATOM 177 H9S DPP 2 45.870 43.740 51.990 1.00 0.00 ATOM 178 0C21 DPP 2 44.390 45.050 50.950 1.00 0.00 ATOM 179 H10R DPP 2 45.080 45.880 50.700 1.00 0.00 ATOM 180 H10S DPP 2 43.420 45.470 51.320 1.00 0.00 ATOM 181 1C21 DPP 2 44.190 44.080 49.790 1.00 0.00 ATOM 182 H11R DPP 2 43.640 43.270 50.320 1.00 0.00 ATOM 183 H11S DPP 2 45.140 43.570 49.520 1.00 0.00 ATOM 184 2C21 DPP 2 43.300 44.620 48.670 1.00 0.00 ATOM 185 H12R DPP 2 43.820 45.320 47.990 1.00 0.00 ATOM 186 H12S DPP 2 42.440 45.070 49.210 1.00 0.00 ATOM 187 3C21 DPP 2 42.750 43.510 47.760 1.00 0.00 ATOM 188 H13R DPP 2 41.990 42.940 48.330 1.00 0.00 ATOM 189 H13S DPP 2 43.530 42.780 47.450 1.00 0.00 ATOM 190 4C21 DPP 2 42.110 44.050 46.480 1.00 0.00 ATOM 191 H14R DPP 2 41.790 43.180 45.860 1.00 0.00 ATOM 192 H14S DPP 2 42.830 44.660 45.890 1.00 0.00 ATOM 193 5C21 DPP 2 40.870 44.870 46.830 1.00 0.00 ATOM 194 H15R DPP 2 41.180 45.760 47.430 1.00 0.00 ATOM 195 H15S DPP 2 40.120 44.320 47.450 1.00 0.00 ATOM 196 6C21 DPP 2 40.080 45.170 45.560 1.00 0.00 ATOM 197 H16R DPP 2 40.350 46.200 45.250 1.00 0.00 ATOM 198 H16S DPP 2 39.050 45.360 45.920 1.00 0.00 ATOM 199 H16T DPP 2 40.210 44.330 44.850 1.00 0.00 ATOM 200 C33 DPP 2 52.210 49.140 54.520 1.00 0.00 ATOM 201 H3X DPP 2 53.300 49.260 54.340 1.00 0.00 ATOM 202 H3Y DPP 2 51.850 50.090 54.980 1.00 0.00 ATOM 203 C34 DPP 2 51.490 49.120 53.180 1.00 0.00 ATOM 204 H4X DPP 2 50.390 49.070 53.370 1.00 0.00 ATOM 205 H4Y DPP 2 51.820 48.220 52.620 1.00 0.00 ATOM 206 C35 DPP 2 51.680 50.410 52.380 1.00 0.00 ATOM 207 H5X DPP 2 52.730 50.770 52.450 1.00 0.00 ATOM 208 H5Y DPP 2 51.000 51.210 52.750 1.00 0.00 ATOM 209 C36 DPP 2 51.460 50.120 50.890 1.00 0.00 ATOM 210 H6X DPP 2 52.260 49.370 50.720 1.00 0.00 ATOM 211 H6Y DPP 2 51.800 50.960 50.250 1.00 0.00 ATOM 212 C37 DPP 2 50.200 49.450 50.370 1.00 0.00 ATOM 213 H7X DPP 2 49.230 49.990 50.470 1.00 0.00 ATOM 214 H7Y DPP 2 49.970 48.490 50.870 1.00 0.00 ATOM 215 C38 DPP 2 50.370 48.970 48.920 1.00 0.00 ATOM 216 H8X DPP 2 49.570 48.230 48.700 1.00 0.00 ATOM 217 H8Y DPP 2 51.400 48.560 48.970 1.00 0.00 ATOM 218 C39 DPP 2 50.440 49.970 47.770 1.00 0.00 ATOM 219 H9X DPP 2 50.990 50.890 48.050 1.00 0.00 ATOM 220 H9Y DPP 2 49.400 50.280 47.520 1.00 0.00 ATOM 221 0C31 DPP 2 50.880 49.340 46.440 1.00 0.00 ATOM 222 H10X DPP 2 50.650 50.030 45.590 1.00 0.00 ATOM 223 H10Y DPP 2 50.370 48.360 46.360 1.00 0.00 ATOM 224 1C31 DPP 2 52.400 49.210 46.370 1.00 0.00 ATOM 225 H11X DPP 2 52.690 48.450 47.130 1.00 0.00 ATOM 226 H11Y DPP 2 52.940 50.150 46.600 1.00 0.00 ATOM 227 2C31 DPP 2 52.740 48.640 44.990 1.00 0.00 ATOM 228 H12X DPP 2 52.620 49.440 44.220 1.00 0.00 ATOM 229 H12Y DPP 2 52.200 47.680 44.830 1.00 0.00 ATOM 230 3C31 DPP 2 54.190 48.150 44.950 1.00 0.00 ATOM 231 H13X DPP 2 54.190 47.200 45.520 1.00 0.00 ATOM 232 H13Y DPP 2 54.730 48.920 45.550 1.00 0.00 ATOM 233 4C31 DPP 2 54.660 47.980 43.510 1.00 0.00 ATOM 234 H14X DPP 2 54.530 48.970 43.030 1.00 0.00 ATOM 235 H14Y DPP 2 53.920 47.360 42.950 1.00 0.00 ATOM 236 5C31 DPP 2 56.070 47.410 43.320 1.00 0.00 ATOM 237 H15X DPP 2 56.070 46.310 43.500 1.00 0.00 ATOM 238 H15Y DPP 2 56.720 47.830 44.120 1.00 0.00 ATOM 239 6C31 DPP 2 56.590 47.790 41.940 1.00 0.00 ATOM 240 H16X DPP 2 57.610 48.200 42.070 1.00 0.00 ATOM 241 H16Y DPP 2 55.960 48.620 41.530 1.00 0.00 ATOM 242 H16Z DPP 2 56.660 46.910 41.270 1.00 0.00 ATOM 243 N DPP 3 19.670 2.660 66.520 1.00 0.00 ATOM 244 HN1 DPP 3 18.930 2.080 66.980 1.00 0.00 ATOM 245 HN2 DPP 3 19.660 3.590 66.980 1.00 0.00 ATOM 246 HN3 DPP 3 19.530 2.890 65.520 1.00 0.00 ATOM 247 C12 DPP 3 21.090 2.190 66.700 1.00 0.00 ATOM 248 H12A DPP 3 21.370 2.230 67.770 1.00 0.00 ATOM 249 H12B DPP 3 21.880 2.780 66.180 1.00 0.00 ATOM 250 C11 DPP 3 21.150 0.770 66.140 1.00 0.00 ATOM 251 H11A DPP 3 20.520 0.040 66.690 1.00 0.00 ATOM 252 H11B DPP 3 22.240 0.540 66.180 1.00 0.00 ATOM 253 P DPP 3 21.290 -0.340 63.790 1.00 0.00 ATOM 254 O13 DPP 3 21.280 -1.630 64.530 1.00 0.00 ATOM 255 O14 DPP 3 22.540 0.040 63.100 1.00 0.00 ATOM 256 O11 DPP 3 20.200 -0.460 62.630 1.00 0.00 ATOM 257 O12 DPP 3 20.770 0.820 64.760 1.00 0.00 ATOM 258 C1 DPP 3 18.820 -0.320 62.990 1.00 0.00 ATOM 259 HA DPP 3 18.520 0.730 62.820 1.00 0.00 ATOM 260 HB DPP 3 18.610 -0.540 64.060 1.00 0.00 ATOM 261 C2 DPP 3 17.980 -1.320 62.170 1.00 0.00 ATOM 262 HS DPP 3 18.470 -2.290 62.430 1.00 0.00 ATOM 263 O21 DPP 3 18.260 -1.080 60.790 1.00 0.00 ATOM 264 C21 DPP 3 17.640 -1.860 59.900 1.00 0.00 ATOM 265 O22 DPP 3 17.050 -2.890 60.190 1.00 0.00 ATOM 266 C22 DPP 3 17.700 -1.090 58.590 1.00 0.00 ATOM 267 H2R DPP 3 18.700 -1.300 58.150 1.00 0.00 ATOM 268 H2S DPP 3 17.700 0.000 58.770 1.00 0.00 ATOM 269 C3 DPP 3 16.500 -1.340 62.570 1.00 0.00 ATOM 270 HX DPP 3 16.340 -1.350 63.670 1.00 0.00 ATOM 271 HY DPP 3 15.960 -2.260 62.240 1.00 0.00 ATOM 272 O31 DPP 3 15.730 -0.220 62.110 1.00 0.00 ATOM 273 C31 DPP 3 15.530 0.850 62.880 1.00 0.00 ATOM 274 O32 DPP 3 15.970 1.040 64.000 1.00 0.00 ATOM 275 C32 DPP 3 14.550 1.760 62.160 1.00 0.00 ATOM 276 H2X DPP 3 13.850 2.090 62.950 1.00 0.00 ATOM 277 H2Y DPP 3 14.110 1.150 61.350 1.00 0.00 ATOM 278 C23 DPP 3 16.610 -1.480 57.590 1.00 0.00 ATOM 279 H3R DPP 3 15.590 -1.300 58.010 1.00 0.00 ATOM 280 H3S DPP 3 16.660 -2.580 57.430 1.00 0.00 ATOM 281 C24 DPP 3 16.640 -0.720 56.260 1.00 0.00 ATOM 282 H4R DPP 3 16.750 0.350 56.540 1.00 0.00 ATOM 283 H4S DPP 3 15.710 -0.940 55.700 1.00 0.00 ATOM 284 C25 DPP 3 17.790 -0.990 55.290 1.00 0.00 ATOM 285 H5R DPP 3 17.850 -2.100 55.290 1.00 0.00 ATOM 286 H5S DPP 3 18.730 -0.600 55.740 1.00 0.00 ATOM 287 C26 DPP 3 17.530 -0.380 53.920 1.00 0.00 ATOM 288 H6R DPP 3 18.450 -0.520 53.310 1.00 0.00 ATOM 289 H6S DPP 3 17.320 0.710 53.960 1.00 0.00 ATOM 290 C27 DPP 3 16.380 -1.000 53.120 1.00 0.00 ATOM 291 H7R DPP 3 16.450 -0.420 52.170 1.00 0.00 ATOM 292 H7S DPP 3 15.460 -0.750 53.700 1.00 0.00 ATOM 293 C28 DPP 3 16.530 -2.510 52.940 1.00 0.00 ATOM 294 H8R DPP 3 15.610 -2.920 52.490 1.00 0.00 ATOM 295 H8S DPP 3 16.610 -3.090 53.880 1.00 0.00 ATOM 296 C29 DPP 3 17.650 -3.040 52.030 1.00 0.00 ATOM 297 H9R DPP 3 18.650 -2.720 52.380 1.00 0.00 ATOM 298 H9S DPP 3 17.550 -2.660 51.000 1.00 0.00 ATOM 299 0C21 DPP 3 17.680 -4.570 52.030 1.00 0.00 ATOM 300 H10R DPP 3 16.770 -5.020 51.570 1.00 0.00 ATOM 301 H10S DPP 3 17.770 -4.880 53.100 1.00 0.00 ATOM 302 1C21 DPP 3 18.930 -5.070 51.300 1.00 0.00 ATOM 303 H11R DPP 3 19.900 -4.780 51.750 1.00 0.00 ATOM 304 H11S DPP 3 18.870 -4.660 50.270 1.00 0.00 ATOM 305 2C21 DPP 3 19.030 -6.600 51.350 1.00 0.00 ATOM 306 H12R DPP 3 18.170 -7.080 51.860 1.00 0.00 ATOM 307 H12S DPP 3 19.940 -6.960 51.860 1.00 0.00 ATOM 308 3C21 DPP 3 19.120 -7.230 49.960 1.00 0.00 ATOM 309 H13R DPP 3 19.180 -8.310 50.220 1.00 0.00 ATOM 310 H13S DPP 3 20.070 -6.830 49.550 1.00 0.00 ATOM 311 4C21 DPP 3 17.920 -7.070 49.020 1.00 0.00 ATOM 312 H14R DPP 3 17.710 -5.980 49.070 1.00 0.00 ATOM 313 H14S DPP 3 17.000 -7.570 49.410 1.00 0.00 ATOM 314 5C21 DPP 3 18.160 -7.580 47.600 1.00 0.00 ATOM 315 H15R DPP 3 17.220 -7.330 47.060 1.00 0.00 ATOM 316 H15S DPP 3 18.310 -8.680 47.570 1.00 0.00 ATOM 317 6C21 DPP 3 19.220 -6.870 46.750 1.00 0.00 ATOM 318 H16R DPP 3 19.950 -7.580 46.310 1.00 0.00 ATOM 319 H16S DPP 3 19.870 -6.180 47.330 1.00 0.00 ATOM 320 H16T DPP 3 18.730 -6.430 45.860 1.00 0.00 ATOM 321 C33 DPP 3 15.310 3.030 61.750 1.00 0.00 ATOM 322 H3X DPP 3 16.250 3.230 62.300 1.00 0.00 ATOM 323 H3Y DPP 3 14.580 3.830 62.040 1.00 0.00 ATOM 324 C34 DPP 3 15.660 3.020 60.270 1.00 0.00 ATOM 325 H4X DPP 3 16.270 2.120 60.020 1.00 0.00 ATOM 326 H4Y DPP 3 16.250 3.920 59.990 1.00 0.00 ATOM 327 C35 DPP 3 14.440 2.990 59.350 1.00 0.00 ATOM 328 H5X DPP 3 14.200 4.040 59.100 1.00 0.00 ATOM 329 H5Y DPP 3 13.550 2.560 59.870 1.00 0.00 ATOM 330 C36 DPP 3 14.670 2.100 58.120 1.00 0.00 ATOM 331 H6X DPP 3 14.780 1.000 58.290 1.00 0.00 ATOM 332 H6Y DPP 3 15.660 2.450 57.750 1.00 0.00 ATOM 333 C37 DPP 3 13.610 2.240 57.030 1.00 0.00 ATOM 334 H7X DPP 3 13.280 3.280 56.790 1.00 0.00 ATOM 335 H7Y DPP 3 12.770 1.620 57.400 1.00 0.00 ATOM 336 C38 DPP 3 13.980 1.690 55.650 1.00 0.00 ATOM 337 H8X DPP 3 14.540 0.740 55.720 1.00 0.00 ATOM 338 H8Y DPP 3 14.710 2.360 55.150 1.00 0.00 ATOM 339 C39 DPP 3 12.810 1.710 54.660 1.00 0.00 ATOM 340 H9X DPP 3 12.560 2.770 54.450 1.00 0.00 ATOM 341 H9Y DPP 3 11.920 1.220 55.110 1.00 0.00 ATOM 342 0C31 DPP 3 13.130 1.100 53.290 1.00 0.00 ATOM 343 H10X DPP 3 12.190 1.250 52.720 1.00 0.00 ATOM 344 H10Y DPP 3 13.340 0.010 53.350 1.00 0.00 ATOM 345 1C31 DPP 3 14.310 1.730 52.550 1.00 0.00 ATOM 346 H11X DPP 3 15.250 1.410 53.060 1.00 0.00 ATOM 347 H11Y DPP 3 14.140 2.820 52.650 1.00 0.00 ATOM 348 2C31 DPP 3 14.390 1.400 51.060 1.00 0.00 ATOM 349 H12X DPP 3 13.540 1.810 50.480 1.00 0.00 ATOM 350 H12Y DPP 3 14.440 0.290 51.050 1.00 0.00 ATOM 351 3C31 DPP 3 15.550 1.930 50.220 1.00 0.00 ATOM 352 H13X DPP 3 16.550 1.730 50.670 1.00 0.00 ATOM 353 H13Y DPP 3 15.490 3.020 50.030 1.00 0.00 ATOM 354 4C31 DPP 3 15.600 1.290 48.830 1.00 0.00 ATOM 355 H14X DPP 3 15.480 0.190 48.930 1.00 0.00 ATOM 356 H14Y DPP 3 16.620 1.480 48.430 1.00 0.00 ATOM 357 5C31 DPP 3 14.520 1.840 47.900 1.00 0.00 ATOM 358 H15X DPP 3 13.600 1.750 48.520 1.00 0.00 ATOM 359 H15Y DPP 3 14.590 1.240 46.970 1.00 0.00 ATOM 360 6C31 DPP 3 14.830 3.300 47.590 1.00 0.00 ATOM 361 H16X DPP 3 15.860 3.450 47.190 1.00 0.00 ATOM 362 H16Y DPP 3 14.620 3.950 48.460 1.00 0.00 ATOM 363 H16Z DPP 3 14.180 3.470 46.700 1.00 0.00 ATOM 364 N DPP 4 48.130 56.660 65.050 1.00 0.00 ATOM 365 HN1 DPP 4 49.040 57.170 65.140 1.00 0.00 ATOM 366 HN2 DPP 4 47.460 57.260 65.570 1.00 0.00 ATOM 367 HN3 DPP 4 48.170 55.750 65.550 1.00 0.00 ATOM 368 C12 DPP 4 47.600 56.700 63.640 1.00 0.00 ATOM 369 H12A DPP 4 48.430 56.380 62.970 1.00 0.00 ATOM 370 H12B DPP 4 47.260 57.750 63.550 1.00 0.00 ATOM 371 C11 DPP 4 46.450 55.720 63.380 1.00 0.00 ATOM 372 H11A DPP 4 46.400 55.530 62.290 1.00 0.00 ATOM 373 H11B DPP 4 45.450 56.120 63.620 1.00 0.00 ATOM 374 P DPP 4 47.760 53.490 63.550 1.00 0.00 ATOM 375 O13 DPP 4 47.450 52.110 64.000 1.00 0.00 ATOM 376 O14 DPP 4 49.130 54.000 63.810 1.00 0.00 ATOM 377 O11 DPP 4 47.570 53.520 61.960 1.00 0.00 ATOM 378 O12 DPP 4 46.600 54.460 64.050 1.00 0.00 ATOM 379 C1 DPP 4 48.510 52.760 61.200 1.00 0.00 ATOM 380 HA DPP 4 48.020 52.580 60.220 1.00 0.00 ATOM 381 HB DPP 4 48.810 51.770 61.600 1.00 0.00 ATOM 382 C2 DPP 4 49.800 53.560 60.950 1.00 0.00 ATOM 383 HS DPP 4 50.340 53.350 61.890 1.00 0.00 ATOM 384 O21 DPP 4 49.440 54.950 61.010 1.00 0.00 ATOM 385 C21 DPP 4 50.450 55.800 60.860 1.00 0.00 ATOM 386 O22 DPP 4 51.640 55.510 60.830 1.00 0.00 ATOM 387 C22 DPP 4 49.920 57.200 60.570 1.00 0.00 ATOM 388 H2R DPP 4 50.590 57.970 61.010 1.00 0.00 ATOM 389 H2S DPP 4 48.870 57.300 60.920 1.00 0.00 ATOM 390 C3 DPP 4 50.470 52.950 59.710 1.00 0.00 ATOM 391 HX DPP 4 50.200 51.870 59.780 1.00 0.00 ATOM 392 HY DPP 4 51.570 53.060 59.740 1.00 0.00 ATOM 393 O31 DPP 4 49.900 53.430 58.490 1.00 0.00 ATOM 394 C31 DPP 4 50.510 53.030 57.370 1.00 0.00 ATOM 395 O32 DPP 4 51.630 52.540 57.270 1.00 0.00 ATOM 396 C32 DPP 4 49.550 53.220 56.220 1.00 0.00 ATOM 397 H2X DPP 4 49.150 54.240 56.400 1.00 0.00 ATOM 398 H2Y DPP 4 48.710 52.520 56.420 1.00 0.00 ATOM 399 C23 DPP 4 49.910 57.330 59.050 1.00 0.00 ATOM 400 H3R DPP 4 50.780 56.810 58.590 1.00 0.00 ATOM 401 H3S DPP 4 50.170 58.380 58.800 1.00 0.00 ATOM 402 C24 DPP 4 48.580 56.960 58.380 1.00 0.00 ATOM 403 H4R DPP 4 47.640 57.250 58.900 1.00 0.00 ATOM 404 H4S DPP 4 48.460 55.900 58.100 1.00 0.00 ATOM 405 C25 DPP 4 48.470 57.690 57.040 1.00 0.00 ATOM 406 H5R DPP 4 49.310 57.420 56.370 1.00 0.00 ATOM 407 H5S DPP 4 48.760 58.760 57.160 1.00 0.00 ATOM 408 C26 DPP 4 47.120 57.840 56.340 1.00 0.00 ATOM 409 H6R DPP 4 46.460 58.190 57.170 1.00 0.00 ATOM 410 H6S DPP 4 46.820 56.830 56.010 1.00 0.00 ATOM 411 C27 DPP 4 47.210 58.850 55.190 1.00 0.00 ATOM 412 H7R DPP 4 48.190 59.060 54.700 1.00 0.00 ATOM 413 H7S DPP 4 46.950 59.840 55.610 1.00 0.00 ATOM 414 C28 DPP 4 46.200 58.500 54.100 1.00 0.00 ATOM 415 H8R DPP 4 45.250 58.130 54.540 1.00 0.00 ATOM 416 H8S DPP 4 46.660 57.720 53.460 1.00 0.00 ATOM 417 C29 DPP 4 45.910 59.810 53.360 1.00 0.00 ATOM 418 H9R DPP 4 46.850 60.390 53.270 1.00 0.00 ATOM 419 H9S DPP 4 45.290 60.300 54.140 1.00 0.00 ATOM 420 0C21 DPP 4 44.950 59.830 52.170 1.00 0.00 ATOM 421 H10R DPP 4 44.630 60.890 52.090 1.00 0.00 ATOM 422 H10S DPP 4 44.160 59.050 52.300 1.00 0.00 ATOM 423 1C21 DPP 4 45.590 59.210 50.920 1.00 0.00 ATOM 424 H11R DPP 4 46.090 58.220 50.960 1.00 0.00 ATOM 425 H11S DPP 4 46.380 59.980 50.750 1.00 0.00 ATOM 426 2C21 DPP 4 44.600 59.160 49.760 1.00 0.00 ATOM 427 H12R DPP 4 43.690 59.770 49.940 1.00 0.00 ATOM 428 H12S DPP 4 44.230 58.160 49.470 1.00 0.00 ATOM 429 3C21 DPP 4 45.200 59.810 48.500 1.00 0.00 ATOM 430 H13R DPP 4 45.950 59.010 48.340 1.00 0.00 ATOM 431 H13S DPP 4 45.660 60.800 48.660 1.00 0.00 ATOM 432 4C21 DPP 4 44.250 59.890 47.300 1.00 0.00 ATOM 433 H14R DPP 4 43.730 58.920 47.130 1.00 0.00 ATOM 434 H14S DPP 4 44.900 60.140 46.430 1.00 0.00 ATOM 435 5C21 DPP 4 43.230 61.020 47.450 1.00 0.00 ATOM 436 H15R DPP 4 42.620 60.780 48.350 1.00 0.00 ATOM 437 H15S DPP 4 42.530 61.110 46.590 1.00 0.00 ATOM 438 6C21 DPP 4 43.750 62.430 47.710 1.00 0.00 ATOM 439 H16R DPP 4 44.530 62.660 46.960 1.00 0.00 ATOM 440 H16S DPP 4 44.130 62.430 48.750 1.00 0.00 ATOM 441 H16T DPP 4 43.040 63.290 47.740 1.00 0.00 ATOM 442 C33 DPP 4 50.150 53.050 54.820 1.00 0.00 ATOM 443 H3X DPP 4 49.310 53.010 54.090 1.00 0.00 ATOM 444 H3Y DPP 4 50.700 52.080 54.840 1.00 0.00 ATOM 445 C34 DPP 4 51.090 54.180 54.410 1.00 0.00 ATOM 446 H4X DPP 4 51.650 53.830 53.520 1.00 0.00 ATOM 447 H4Y DPP 4 51.890 54.340 55.170 1.00 0.00 ATOM 448 C35 DPP 4 50.320 55.490 54.220 1.00 0.00 ATOM 449 H5X DPP 4 50.260 56.020 55.190 1.00 0.00 ATOM 450 H5Y DPP 4 49.390 55.350 53.620 1.00 0.00 ATOM 451 C36 DPP 4 51.280 56.350 53.400 1.00 0.00 ATOM 452 H6X DPP 4 51.650 55.880 52.470 1.00 0.00 ATOM 453 H6Y DPP 4 52.170 56.580 54.030 1.00 0.00 ATOM 454 C37 DPP 4 50.550 57.580 52.870 1.00 0.00 ATOM 455 H7X DPP 4 51.360 58.330 53.030 1.00 0.00 ATOM 456 H7Y DPP 4 49.670 57.910 53.460 1.00 0.00 ATOM 457 C38 DPP 4 50.150 57.460 51.400 1.00 0.00 ATOM 458 H8X DPP 4 49.240 56.830 51.430 1.00 0.00 ATOM 459 H8Y DPP 4 50.910 56.940 50.780 1.00 0.00 ATOM 460 C39 DPP 4 49.950 58.830 50.740 1.00 0.00 ATOM 461 H9X DPP 4 50.920 59.370 50.680 1.00 0.00 ATOM 462 H9Y DPP 4 49.300 59.420 51.410 1.00 0.00 ATOM 463 0C31 DPP 4 49.330 58.750 49.340 1.00 0.00 ATOM 464 H10X DPP 4 48.400 58.160 49.380 1.00 0.00 ATOM 465 H10Y DPP 4 50.130 58.260 48.750 1.00 0.00 ATOM 466 1C31 DPP 4 49.130 60.160 48.780 1.00 0.00 ATOM 467 H11X DPP 4 50.060 60.770 48.810 1.00 0.00 ATOM 468 H11Y DPP 4 48.360 60.600 49.450 1.00 0.00 ATOM 469 2C31 DPP 4 48.760 60.030 47.300 1.00 0.00 ATOM 470 H12X DPP 4 47.910 59.360 47.060 1.00 0.00 ATOM 471 H12Y DPP 4 49.630 59.470 46.880 1.00 0.00 ATOM 472 3C31 DPP 4 48.700 61.370 46.560 1.00 0.00 ATOM 473 H13X DPP 4 49.700 61.830 46.670 1.00 0.00 ATOM 474 H13Y DPP 4 47.990 61.960 47.160 1.00 0.00 ATOM 475 4C31 DPP 4 48.290 61.360 45.080 1.00 0.00 ATOM 476 H14X DPP 4 47.860 62.320 44.710 1.00 0.00 ATOM 477 H14Y DPP 4 47.520 60.560 44.970 1.00 0.00 ATOM 478 5C31 DPP 4 49.370 60.900 44.100 1.00 0.00 ATOM 479 H15X DPP 4 48.950 60.790 43.080 1.00 0.00 ATOM 480 H15Y DPP 4 49.770 59.940 44.480 1.00 0.00 ATOM 481 6C31 DPP 4 50.440 61.980 43.920 1.00 0.00 ATOM 482 H16X DPP 4 51.230 61.850 44.680 1.00 0.00 ATOM 483 H16Y DPP 4 50.050 63.010 43.760 1.00 0.00 ATOM 484 H16Z DPP 4 50.870 61.670 42.940 1.00 0.00 ATOM 485 N DPP 5 39.870 13.690 56.280 1.00 0.00 ATOM 486 HN1 DPP 5 39.930 14.440 55.550 1.00 0.00 ATOM 487 HN2 DPP 5 38.900 13.690 56.660 1.00 0.00 ATOM 488 HN3 DPP 5 40.480 13.970 57.070 1.00 0.00 ATOM 489 C12 DPP 5 40.260 12.330 55.760 1.00 0.00 ATOM 490 H12A DPP 5 39.310 11.930 55.340 1.00 0.00 ATOM 491 H12B DPP 5 40.990 12.510 54.950 1.00 0.00 ATOM 492 C11 DPP 5 40.890 11.390 56.800 1.00 0.00 ATOM 493 H11A DPP 5 41.400 10.580 56.240 1.00 0.00 ATOM 494 H11B DPP 5 40.010 10.930 57.290 1.00 0.00 ATOM 495 P DPP 5 42.550 11.330 58.680 1.00 0.00 ATOM 496 O13 DPP 5 41.700 10.520 59.580 1.00 0.00 ATOM 497 O14 DPP 5 43.490 12.240 59.380 1.00 0.00 ATOM 498 O11 DPP 5 43.410 10.350 57.760 1.00 0.00 ATOM 499 O12 DPP 5 41.570 12.200 57.760 1.00 0.00 ATOM 500 C1 DPP 5 44.060 9.320 58.500 1.00 0.00 ATOM 501 HA DPP 5 43.530 9.030 59.430 1.00 0.00 ATOM 502 HB DPP 5 45.050 9.680 58.840 1.00 0.00 ATOM 503 C2 DPP 5 44.340 8.100 57.590 1.00 0.00 ATOM 504 HS DPP 5 45.040 7.520 58.220 1.00 0.00 ATOM 505 O21 DPP 5 44.710 8.640 56.320 1.00 0.00 ATOM 506 C21 DPP 5 45.580 7.890 55.650 1.00 0.00 ATOM 507 O22 DPP 5 46.280 7.000 56.110 1.00 0.00 ATOM 508 C22 DPP 5 45.840 8.490 54.280 1.00 0.00 ATOM 509 H2R DPP 5 46.890 8.280 53.990 1.00 0.00 ATOM 510 H2S DPP 5 45.730 9.600 54.270 1.00 0.00 ATOM 511 C3 DPP 5 43.050 7.280 57.430 1.00 0.00 ATOM 512 HX DPP 5 42.390 7.770 56.690 1.00 0.00 ATOM 513 HY DPP 5 42.510 7.420 58.390 1.00 0.00 ATOM 514 O31 DPP 5 43.200 5.870 57.240 1.00 0.00 ATOM 515 C31 DPP 5 43.130 5.360 56.010 1.00 0.00 ATOM 516 O32 DPP 5 43.120 6.010 54.980 1.00 0.00 ATOM 517 C32 DPP 5 43.140 3.840 56.060 1.00 0.00 ATOM 518 H2X DPP 5 42.530 3.280 56.800 1.00 0.00 ATOM 519 H2Y DPP 5 44.190 3.520 56.220 1.00 0.00 ATOM 520 C23 DPP 5 44.850 7.860 53.300 1.00 0.00 ATOM 521 H3R DPP 5 43.810 8.070 53.620 1.00 0.00 ATOM 522 H3S DPP 5 44.930 6.750 53.210 1.00 0.00 ATOM 523 C24 DPP 5 45.030 8.410 51.890 1.00 0.00 ATOM 524 H4R DPP 5 45.920 7.960 51.400 1.00 0.00 ATOM 525 H4S DPP 5 45.060 9.520 51.880 1.00 0.00 ATOM 526 C25 DPP 5 43.900 7.860 51.000 1.00 0.00 ATOM 527 H5R DPP 5 42.940 7.920 51.550 1.00 0.00 ATOM 528 H5S DPP 5 44.190 6.830 50.690 1.00 0.00 ATOM 529 C26 DPP 5 43.690 8.730 49.760 1.00 0.00 ATOM 530 H6R DPP 5 44.330 8.340 48.930 1.00 0.00 ATOM 531 H6S DPP 5 44.050 9.770 49.910 1.00 0.00 ATOM 532 C27 DPP 5 42.240 8.600 49.290 1.00 0.00 ATOM 533 H7R DPP 5 41.700 9.440 49.780 1.00 0.00 ATOM 534 H7S DPP 5 41.960 7.680 49.850 1.00 0.00 ATOM 535 C28 DPP 5 41.920 8.470 47.800 1.00 0.00 ATOM 536 H8R DPP 5 40.810 8.390 47.780 1.00 0.00 ATOM 537 H8S DPP 5 42.460 7.640 47.300 1.00 0.00 ATOM 538 C29 DPP 5 42.240 9.730 47.000 1.00 0.00 ATOM 539 H9R DPP 5 43.340 9.830 46.870 1.00 0.00 ATOM 540 H9S DPP 5 42.020 10.650 47.590 1.00 0.00 ATOM 541 0C21 DPP 5 41.820 9.750 45.520 1.00 0.00 ATOM 542 H10R DPP 5 42.550 9.080 45.020 1.00 0.00 ATOM 543 H10S DPP 5 42.150 10.680 45.020 1.00 0.00 ATOM 544 1C21 DPP 5 40.330 9.620 45.200 1.00 0.00 ATOM 545 H11R DPP 5 39.710 10.480 45.540 1.00 0.00 ATOM 546 H11S DPP 5 40.010 8.660 45.650 1.00 0.00 ATOM 547 2C21 DPP 5 40.100 9.380 43.710 1.00 0.00 ATOM 548 H12R DPP 5 40.840 8.630 43.330 1.00 0.00 ATOM 549 H12S DPP 5 40.400 10.350 43.250 1.00 0.00 ATOM 550 3C21 DPP 5 38.700 8.870 43.390 1.00 0.00 ATOM 551 H13R DPP 5 37.930 9.560 43.810 1.00 0.00 ATOM 552 H13S DPP 5 38.640 7.830 43.760 1.00 0.00 ATOM 553 4C21 DPP 5 38.420 8.730 41.890 1.00 0.00 ATOM 554 H14R DPP 5 39.270 8.260 41.350 1.00 0.00 ATOM 555 H14S DPP 5 38.470 9.750 41.450 1.00 0.00 ATOM 556 5C21 DPP 5 37.130 8.050 41.420 1.00 0.00 ATOM 557 H15R DPP 5 37.270 6.960 41.320 1.00 0.00 ATOM 558 H15S DPP 5 36.880 8.470 40.420 1.00 0.00 ATOM 559 6C21 DPP 5 35.980 8.380 42.360 1.00 0.00 ATOM 560 H16R DPP 5 34.990 8.060 41.960 1.00 0.00 ATOM 561 H16S DPP 5 35.880 9.480 42.440 1.00 0.00 ATOM 562 H16T DPP 5 36.140 7.870 43.340 1.00 0.00 ATOM 563 C33 DPP 5 42.550 3.490 54.700 1.00 0.00 ATOM 564 H3X DPP 5 42.970 4.060 53.830 1.00 0.00 ATOM 565 H3Y DPP 5 41.460 3.690 54.730 1.00 0.00 ATOM 566 C34 DPP 5 42.570 2.030 54.250 1.00 0.00 ATOM 567 H4X DPP 5 42.080 1.340 54.970 1.00 0.00 ATOM 568 H4Y DPP 5 43.620 1.670 54.200 1.00 0.00 ATOM 569 C35 DPP 5 41.880 1.580 52.970 1.00 0.00 ATOM 570 H5X DPP 5 42.040 0.530 52.640 1.00 0.00 ATOM 571 H5Y DPP 5 42.490 2.150 52.230 1.00 0.00 ATOM 572 C36 DPP 5 40.460 2.090 52.710 1.00 0.00 ATOM 573 H6X DPP 5 40.300 3.060 53.210 1.00 0.00 ATOM 574 H6Y DPP 5 39.670 1.430 53.130 1.00 0.00 ATOM 575 C37 DPP 5 40.260 2.410 51.230 1.00 0.00 ATOM 576 H7X DPP 5 40.840 3.300 50.880 1.00 0.00 ATOM 577 H7Y DPP 5 39.270 2.860 51.020 1.00 0.00 ATOM 578 C38 DPP 5 40.570 1.340 50.170 1.00 0.00 ATOM 579 H8X DPP 5 41.590 0.950 50.350 1.00 0.00 ATOM 580 H8Y DPP 5 40.570 1.900 49.210 1.00 0.00 ATOM 581 C39 DPP 5 39.540 0.210 50.240 1.00 0.00 ATOM 582 H9X DPP 5 38.480 0.530 50.120 1.00 0.00 ATOM 583 H9Y DPP 5 39.460 -0.290 51.230 1.00 0.00 ATOM 584 0C31 DPP 5 39.880 -0.840 49.180 1.00 0.00 ATOM 585 H10X DPP 5 40.910 -1.160 49.440 1.00 0.00 ATOM 586 H10Y DPP 5 40.000 -0.080 48.380 1.00 0.00 ATOM 587 1C31 DPP 5 38.820 -1.900 48.880 1.00 0.00 ATOM 588 H11X DPP 5 37.820 -1.460 48.660 1.00 0.00 ATOM 589 H11Y DPP 5 38.650 -2.490 49.810 1.00 0.00 ATOM 590 2C31 DPP 5 39.070 -2.720 47.610 1.00 0.00 ATOM 591 H12X DPP 5 40.130 -3.040 47.550 1.00 0.00 ATOM 592 H12Y DPP 5 38.850 -2.030 46.770 1.00 0.00 ATOM 593 3C31 DPP 5 38.040 -3.860 47.630 1.00 0.00 ATOM 594 H13X DPP 5 37.060 -3.400 47.850 1.00 0.00 ATOM 595 H13Y DPP 5 38.210 -4.590 48.450 1.00 0.00 ATOM 596 4C31 DPP 5 37.930 -4.620 46.300 1.00 0.00 ATOM 597 H14X DPP 5 36.890 -5.010 46.180 1.00 0.00 ATOM 598 H14Y DPP 5 38.040 -3.880 45.490 1.00 0.00 ATOM 599 5C31 DPP 5 38.900 -5.800 46.280 1.00 0.00 ATOM 600 H15X DPP 5 38.770 -6.320 47.250 1.00 0.00 ATOM 601 H15Y DPP 5 39.950 -5.450 46.240 1.00 0.00 ATOM 602 6C31 DPP 5 38.710 -6.740 45.080 1.00 0.00 ATOM 603 H16X DPP 5 39.390 -7.620 45.090 1.00 0.00 ATOM 604 H16Y DPP 5 38.760 -6.160 44.140 1.00 0.00 ATOM 605 H16Z DPP 5 37.680 -7.140 45.130 1.00 0.00 ATOM 606 N DPP 6 40.900 24.170 62.820 1.00 0.00 ATOM 607 HN1 DPP 6 40.550 25.030 63.280 1.00 0.00 ATOM 608 HN2 DPP 6 40.370 24.010 61.950 1.00 0.00 ATOM 609 HN3 DPP 6 40.730 23.370 63.470 1.00 0.00 ATOM 610 C12 DPP 6 42.400 24.290 62.640 1.00 0.00 ATOM 611 H12A DPP 6 42.810 24.430 63.660 1.00 0.00 ATOM 612 H12B DPP 6 42.560 25.210 62.040 1.00 0.00 ATOM 613 C11 DPP 6 42.970 23.110 61.850 1.00 0.00 ATOM 614 H11A DPP 6 43.860 22.730 62.390 1.00 0.00 ATOM 615 H11B DPP 6 43.130 23.500 60.830 1.00 0.00 ATOM 616 P DPP 6 42.300 20.960 60.660 1.00 0.00 ATOM 617 O13 DPP 6 41.040 20.470 60.060 1.00 0.00 ATOM 618 O14 DPP 6 43.130 19.890 61.240 1.00 0.00 ATOM 619 O11 DPP 6 43.060 21.720 59.470 1.00 0.00 ATOM 620 O12 DPP 6 42.020 22.030 61.810 1.00 0.00 ATOM 621 C1 DPP 6 43.980 21.000 58.650 1.00 0.00 ATOM 622 HA DPP 6 43.960 21.420 57.620 1.00 0.00 ATOM 623 HB DPP 6 43.760 19.910 58.560 1.00 0.00 ATOM 624 C2 DPP 6 45.420 21.220 59.160 1.00 0.00 ATOM 625 HS DPP 6 45.550 20.650 60.100 1.00 0.00 ATOM 626 O21 DPP 6 45.430 22.590 59.570 1.00 0.00 ATOM 627 C21 DPP 6 46.560 23.010 60.140 1.00 0.00 ATOM 628 O22 DPP 6 47.530 22.360 60.500 1.00 0.00 ATOM 629 C22 DPP 6 46.390 24.510 60.300 1.00 0.00 ATOM 630 H2R DPP 6 47.190 24.950 60.930 1.00 0.00 ATOM 631 H2S DPP 6 45.450 24.720 60.870 1.00 0.00 ATOM 632 C3 DPP 6 46.450 20.800 58.090 1.00 0.00 ATOM 633 HX DPP 6 46.100 19.780 57.820 1.00 0.00 ATOM 634 HY DPP 6 47.450 20.790 58.560 1.00 0.00 ATOM 635 O31 DPP 6 46.440 21.680 56.970 1.00 0.00 ATOM 636 C31 DPP 6 47.040 21.040 55.970 1.00 0.00 ATOM 637 O32 DPP 6 47.770 20.070 56.100 1.00 0.00 ATOM 638 C32 DPP 6 46.710 21.730 54.660 1.00 0.00 ATOM 639 H2X DPP 6 47.620 22.320 54.390 1.00 0.00 ATOM 640 H2Y DPP 6 45.760 22.300 54.790 1.00 0.00 ATOM 641 C23 DPP 6 46.280 25.150 58.920 1.00 0.00 ATOM 642 H3R DPP 6 46.010 26.220 59.000 1.00 0.00 ATOM 643 H3S DPP 6 45.520 24.530 58.380 1.00 0.00 ATOM 644 C24 DPP 6 47.630 25.170 58.200 1.00 0.00 ATOM 645 H4R DPP 6 48.100 24.170 58.330 1.00 0.00 ATOM 646 H4S DPP 6 48.220 25.980 58.690 1.00 0.00 ATOM 647 C25 DPP 6 47.550 25.510 56.720 1.00 0.00 ATOM 648 H5R DPP 6 47.160 26.550 56.670 1.00 0.00 ATOM 649 H5S DPP 6 46.860 24.760 56.290 1.00 0.00 ATOM 650 C26 DPP 6 48.900 25.550 56.000 1.00 0.00 ATOM 651 H6R DPP 6 49.540 24.690 56.280 1.00 0.00 ATOM 652 H6S DPP 6 49.420 26.380 56.530 1.00 0.00 ATOM 653 C27 DPP 6 48.820 25.770 54.480 1.00 0.00 ATOM 654 H7R DPP 6 49.840 25.980 54.090 1.00 0.00 ATOM 655 H7S DPP 6 48.230 26.700 54.310 1.00 0.00 ATOM 656 C28 DPP 6 48.360 24.550 53.690 1.00 0.00 ATOM 657 H8R DPP 6 47.340 24.250 54.020 1.00 0.00 ATOM 658 H8S DPP 6 49.040 23.710 53.930 1.00 0.00 ATOM 659 C29 DPP 6 48.340 24.830 52.190 1.00 0.00 ATOM 660 H9R DPP 6 47.990 23.840 51.830 1.00 0.00 ATOM 661 H9S DPP 6 49.300 25.060 51.680 1.00 0.00 ATOM 662 0C21 DPP 6 47.310 25.790 51.590 1.00 0.00 ATOM 663 H10R DPP 6 47.820 26.780 51.640 1.00 0.00 ATOM 664 H10S DPP 6 46.460 25.920 52.290 1.00 0.00 ATOM 665 1C21 DPP 6 46.950 25.710 50.110 1.00 0.00 ATOM 666 H11R DPP 6 46.460 26.650 49.770 1.00 0.00 ATOM 667 H11S DPP 6 46.220 24.900 49.890 1.00 0.00 ATOM 668 2C21 DPP 6 48.180 25.660 49.200 1.00 0.00 ATOM 669 H12R DPP 6 47.880 25.630 48.130 1.00 0.00 ATOM 670 H12S DPP 6 48.810 24.770 49.410 1.00 0.00 ATOM 671 3C21 DPP 6 49.150 26.840 49.300 1.00 0.00 ATOM 672 H13R DPP 6 49.710 26.920 50.250 1.00 0.00 ATOM 673 H13S DPP 6 48.510 27.750 49.330 1.00 0.00 ATOM 674 4C21 DPP 6 50.210 26.820 48.200 1.00 0.00 ATOM 675 H14R DPP 6 50.730 25.840 48.130 1.00 0.00 ATOM 676 H14S DPP 6 50.860 27.670 48.490 1.00 0.00 ATOM 677 5C21 DPP 6 49.540 27.130 46.860 1.00 0.00 ATOM 678 H15R DPP 6 48.820 26.350 46.540 1.00 0.00 ATOM 679 H15S DPP 6 50.300 27.110 46.050 1.00 0.00 ATOM 680 6C21 DPP 6 48.860 28.500 46.810 1.00 0.00 ATOM 681 H16R DPP 6 47.960 28.580 47.450 1.00 0.00 ATOM 682 H16S DPP 6 48.610 28.590 45.730 1.00 0.00 ATOM 683 H16T DPP 6 49.470 29.380 47.110 1.00 0.00 ATOM 684 C33 DPP 6 46.440 20.750 53.510 1.00 0.00 ATOM 685 H3X DPP 6 45.680 20.040 53.890 1.00 0.00 ATOM 686 H3Y DPP 6 47.380 20.260 53.160 1.00 0.00 ATOM 687 C34 DPP 6 45.770 21.430 52.320 1.00 0.00 ATOM 688 H4X DPP 6 46.460 22.280 52.100 1.00 0.00 ATOM 689 H4Y DPP 6 44.820 21.850 52.700 1.00 0.00 ATOM 690 C35 DPP 6 45.500 20.590 51.070 1.00 0.00 ATOM 691 H5X DPP 6 44.730 19.830 51.330 1.00 0.00 ATOM 692 H5Y DPP 6 46.440 20.090 50.750 1.00 0.00 ATOM 693 C36 DPP 6 45.110 21.470 49.880 1.00 0.00 ATOM 694 H6X DPP 6 45.700 22.400 49.770 1.00 0.00 ATOM 695 H6Y DPP 6 44.040 21.720 50.020 1.00 0.00 ATOM 696 C37 DPP 6 45.390 20.750 48.560 1.00 0.00 ATOM 697 H7X DPP 6 45.260 19.650 48.680 1.00 0.00 ATOM 698 H7Y DPP 6 46.450 20.780 48.240 1.00 0.00 ATOM 699 C38 DPP 6 44.560 21.180 47.350 1.00 0.00 ATOM 700 H8X DPP 6 43.500 21.390 47.620 1.00 0.00 ATOM 701 H8Y DPP 6 44.420 20.360 46.610 1.00 0.00 ATOM 702 C39 DPP 6 45.000 22.530 46.780 1.00 0.00 ATOM 703 H9X DPP 6 45.970 22.390 46.240 1.00 0.00 ATOM 704 H9Y DPP 6 45.400 23.090 47.650 1.00 0.00 ATOM 705 0C31 DPP 6 43.950 23.180 45.870 1.00 0.00 ATOM 706 H10X DPP 6 44.340 24.210 45.760 1.00 0.00 ATOM 707 H10Y DPP 6 42.920 23.350 46.260 1.00 0.00 ATOM 708 1C31 DPP 6 43.700 22.330 44.620 1.00 0.00 ATOM 709 H11X DPP 6 43.270 21.370 44.970 1.00 0.00 ATOM 710 H11Y DPP 6 44.710 22.130 44.190 1.00 0.00 ATOM 711 2C31 DPP 6 42.770 23.100 43.680 1.00 0.00 ATOM 712 H12X DPP 6 41.860 23.400 44.250 1.00 0.00 ATOM 713 H12Y DPP 6 42.410 22.390 42.920 1.00 0.00 ATOM 714 3C31 DPP 6 43.400 24.340 43.030 1.00 0.00 ATOM 715 H13X DPP 6 44.410 24.210 42.580 1.00 0.00 ATOM 716 H13Y DPP 6 43.380 25.120 43.810 1.00 0.00 ATOM 717 4C31 DPP 6 42.500 24.830 41.890 1.00 0.00 ATOM 718 H14X DPP 6 42.660 25.920 41.710 1.00 0.00 ATOM 719 H14Y DPP 6 41.410 24.720 42.090 1.00 0.00 ATOM 720 5C31 DPP 6 42.760 24.010 40.620 1.00 0.00 ATOM 721 H15X DPP 6 41.920 24.350 39.980 1.00 0.00 ATOM 722 H15Y DPP 6 42.740 22.940 40.890 1.00 0.00 ATOM 723 6C31 DPP 6 44.120 24.210 39.960 1.00 0.00 ATOM 724 H16X DPP 6 44.360 25.280 39.800 1.00 0.00 ATOM 725 H16Y DPP 6 44.070 23.790 38.940 1.00 0.00 ATOM 726 H16Z DPP 6 44.920 23.680 40.530 1.00 0.00 ATOM 727 N DPP 7 24.800 27.560 64.630 1.00 0.00 ATOM 728 HN1 DPP 7 24.040 28.110 64.190 1.00 0.00 ATOM 729 HN2 DPP 7 24.500 27.350 65.610 1.00 0.00 ATOM 730 HN3 DPP 7 25.630 28.160 64.490 1.00 0.00 ATOM 731 C12 DPP 7 24.780 26.220 63.920 1.00 0.00 ATOM 732 H12A DPP 7 23.800 25.760 64.150 1.00 0.00 ATOM 733 H12B DPP 7 24.810 26.470 62.840 1.00 0.00 ATOM 734 C11 DPP 7 26.040 25.450 64.300 1.00 0.00 ATOM 735 H11A DPP 7 25.750 24.470 63.880 1.00 0.00 ATOM 736 H11B DPP 7 26.180 25.200 65.370 1.00 0.00 ATOM 737 P DPP 7 28.300 24.890 63.500 1.00 0.00 ATOM 738 O13 DPP 7 28.440 24.080 64.730 1.00 0.00 ATOM 739 O14 DPP 7 29.520 25.520 62.930 1.00 0.00 ATOM 740 O11 DPP 7 27.660 23.980 62.350 1.00 0.00 ATOM 741 O12 DPP 7 27.230 26.050 63.770 1.00 0.00 ATOM 742 C1 DPP 7 28.450 22.910 61.850 1.00 0.00 ATOM 743 HA DPP 7 28.540 22.100 62.610 1.00 0.00 ATOM 744 HB DPP 7 29.490 23.300 61.760 1.00 0.00 ATOM 745 C2 DPP 7 27.890 22.310 60.540 1.00 0.00 ATOM 746 HS DPP 7 28.530 21.420 60.330 1.00 0.00 ATOM 747 O21 DPP 7 28.020 23.270 59.490 1.00 0.00 ATOM 748 C21 DPP 7 29.130 23.210 58.760 1.00 0.00 ATOM 749 O22 DPP 7 29.970 22.330 58.890 1.00 0.00 ATOM 750 C22 DPP 7 29.200 24.270 57.660 1.00 0.00 ATOM 751 H2R DPP 7 29.700 25.190 58.030 1.00 0.00 ATOM 752 H2S DPP 7 28.150 24.510 57.380 1.00 0.00 ATOM 753 C3 DPP 7 26.440 21.870 60.800 1.00 0.00 ATOM 754 HX DPP 7 25.940 22.840 60.990 1.00 0.00 ATOM 755 HY DPP 7 26.440 21.140 61.640 1.00 0.00 ATOM 756 O31 DPP 7 25.960 21.160 59.660 1.00 0.00 ATOM 757 C31 DPP 7 25.160 21.800 58.810 1.00 0.00 ATOM 758 O32 DPP 7 24.840 22.980 58.860 1.00 0.00 ATOM 759 C32 DPP 7 24.630 20.810 57.780 1.00 0.00 ATOM 760 H2X DPP 7 23.540 20.890 57.620 1.00 0.00 ATOM 761 H2Y DPP 7 24.590 19.840 58.320 1.00 0.00 ATOM 762 C23 DPP 7 30.060 23.860 56.470 1.00 0.00 ATOM 763 H3R DPP 7 31.100 23.660 56.810 1.00 0.00 ATOM 764 H3S DPP 7 30.160 24.620 55.660 1.00 0.00 ATOM 765 C24 DPP 7 29.570 22.670 55.640 1.00 0.00 ATOM 766 H4R DPP 7 28.490 22.790 55.400 1.00 0.00 ATOM 767 H4S DPP 7 29.770 21.780 56.260 1.00 0.00 ATOM 768 C25 DPP 7 30.190 22.560 54.250 1.00 0.00 ATOM 769 H5R DPP 7 30.100 23.530 53.730 1.00 0.00 ATOM 770 H5S DPP 7 29.650 21.790 53.660 1.00 0.00 ATOM 771 C26 DPP 7 31.660 22.120 54.310 1.00 0.00 ATOM 772 H6R DPP 7 31.790 21.060 54.600 1.00 0.00 ATOM 773 H6S DPP 7 32.100 22.830 55.040 1.00 0.00 ATOM 774 C27 DPP 7 32.460 22.210 53.010 1.00 0.00 ATOM 775 H7R DPP 7 31.830 21.760 52.210 1.00 0.00 ATOM 776 H7S DPP 7 33.320 21.550 53.220 1.00 0.00 ATOM 777 C28 DPP 7 32.710 23.680 52.650 1.00 0.00 ATOM 778 H8R DPP 7 33.600 24.090 53.180 1.00 0.00 ATOM 779 H8S DPP 7 31.820 24.280 52.930 1.00 0.00 ATOM 780 C29 DPP 7 32.890 23.880 51.150 1.00 0.00 ATOM 781 H9R DPP 7 32.110 24.610 50.850 1.00 0.00 ATOM 782 H9S DPP 7 32.880 22.860 50.710 1.00 0.00 ATOM 783 0C21 DPP 7 34.310 24.400 50.920 1.00 0.00 ATOM 784 H10R DPP 7 34.960 23.670 51.450 1.00 0.00 ATOM 785 H10S DPP 7 34.290 25.420 51.370 1.00 0.00 ATOM 786 1C21 DPP 7 34.750 24.420 49.450 1.00 0.00 ATOM 787 H11R DPP 7 35.790 24.770 49.290 1.00 0.00 ATOM 788 H11S DPP 7 34.020 25.030 48.870 1.00 0.00 ATOM 789 2C21 DPP 7 34.810 23.060 48.760 1.00 0.00 ATOM 790 H12R DPP 7 33.750 22.770 48.580 1.00 0.00 ATOM 791 H12S DPP 7 35.180 22.250 49.420 1.00 0.00 ATOM 792 3C21 DPP 7 35.520 23.070 47.410 1.00 0.00 ATOM 793 H13R DPP 7 35.860 22.040 47.160 1.00 0.00 ATOM 794 H13S DPP 7 36.470 23.630 47.490 1.00 0.00 ATOM 795 4C21 DPP 7 34.720 23.740 46.280 1.00 0.00 ATOM 796 H14R DPP 7 34.390 24.670 46.780 1.00 0.00 ATOM 797 H14S DPP 7 33.870 23.050 46.120 1.00 0.00 ATOM 798 5C21 DPP 7 35.470 23.970 44.970 1.00 0.00 ATOM 799 H15R DPP 7 36.510 24.360 45.080 1.00 0.00 ATOM 800 H15S DPP 7 34.880 24.770 44.470 1.00 0.00 ATOM 801 6C21 DPP 7 35.630 22.740 44.080 1.00 0.00 ATOM 802 H16R DPP 7 34.640 22.240 44.010 1.00 0.00 ATOM 803 H16S DPP 7 36.370 22.100 44.600 1.00 0.00 ATOM 804 H16T DPP 7 36.090 23.050 43.110 1.00 0.00 ATOM 805 C33 DPP 7 25.440 20.880 56.490 1.00 0.00 ATOM 806 H3X DPP 7 25.340 19.910 55.960 1.00 0.00 ATOM 807 H3Y DPP 7 26.540 20.970 56.660 1.00 0.00 ATOM 808 C34 DPP 7 24.850 21.960 55.570 1.00 0.00 ATOM 809 H4X DPP 7 25.520 22.800 55.840 1.00 0.00 ATOM 810 H4Y DPP 7 23.750 22.050 55.730 1.00 0.00 ATOM 811 C35 DPP 7 25.120 21.680 54.090 1.00 0.00 ATOM 812 H5X DPP 7 25.100 20.580 53.920 1.00 0.00 ATOM 813 H5Y DPP 7 26.170 22.010 53.950 1.00 0.00 ATOM 814 C36 DPP 7 24.330 22.510 53.080 1.00 0.00 ATOM 815 H6X DPP 7 24.350 23.600 53.270 1.00 0.00 ATOM 816 H6Y DPP 7 23.250 22.250 53.140 1.00 0.00 ATOM 817 C37 DPP 7 24.820 22.130 51.680 1.00 0.00 ATOM 818 H7X DPP 7 24.840 21.030 51.530 1.00 0.00 ATOM 819 H7Y DPP 7 25.900 22.380 51.590 1.00 0.00 ATOM 820 C38 DPP 7 23.970 22.720 50.550 1.00 0.00 ATOM 821 H8X DPP 7 24.080 23.820 50.580 1.00 0.00 ATOM 822 H8Y DPP 7 22.890 22.550 50.750 1.00 0.00 ATOM 823 C39 DPP 7 24.510 22.230 49.210 1.00 0.00 ATOM 824 H9X DPP 7 24.450 21.130 49.360 1.00 0.00 ATOM 825 H9Y DPP 7 25.590 22.500 49.160 1.00 0.00 ATOM 826 0C31 DPP 7 23.600 22.710 48.070 1.00 0.00 ATOM 827 H10X DPP 7 23.520 23.820 48.110 1.00 0.00 ATOM 828 H10Y DPP 7 22.580 22.320 48.230 1.00 0.00 ATOM 829 1C31 DPP 7 23.990 22.330 46.650 1.00 0.00 ATOM 830 H11X DPP 7 24.110 21.220 46.630 1.00 0.00 ATOM 831 H11Y DPP 7 25.040 22.690 46.570 1.00 0.00 ATOM 832 2C31 DPP 7 23.110 22.940 45.560 1.00 0.00 ATOM 833 H12X DPP 7 22.970 24.030 45.710 1.00 0.00 ATOM 834 H12Y DPP 7 22.100 22.490 45.700 1.00 0.00 ATOM 835 3C31 DPP 7 23.590 22.680 44.130 1.00 0.00 ATOM 836 H13X DPP 7 24.640 23.000 43.970 1.00 0.00 ATOM 837 H13Y DPP 7 22.930 23.220 43.420 1.00 0.00 ATOM 838 4C31 DPP 7 23.500 21.180 43.850 1.00 0.00 ATOM 839 H14X DPP 7 22.620 20.720 44.350 1.00 0.00 ATOM 840 H14Y DPP 7 24.470 20.740 44.170 1.00 0.00 ATOM 841 5C31 DPP 7 23.340 20.830 42.370 1.00 0.00 ATOM 842 H15X DPP 7 22.490 21.410 41.960 1.00 0.00 ATOM 843 H15Y DPP 7 23.010 19.770 42.380 1.00 0.00 ATOM 844 6C31 DPP 7 24.540 21.070 41.440 1.00 0.00 ATOM 845 H16X DPP 7 25.450 20.430 41.530 1.00 0.00 ATOM 846 H16Y DPP 7 24.300 20.950 40.360 1.00 0.00 ATOM 847 H16Z DPP 7 24.930 22.100 41.560 1.00 0.00 ATOM 848 N DPP 8 32.670 39.790 64.290 1.00 0.00 ATOM 849 HN1 DPP 8 33.690 39.690 64.480 1.00 0.00 ATOM 850 HN2 DPP 8 32.130 40.030 65.140 1.00 0.00 ATOM 851 HN3 DPP 8 32.510 40.580 63.630 1.00 0.00 ATOM 852 C12 DPP 8 32.190 38.510 63.650 1.00 0.00 ATOM 853 H12A DPP 8 31.290 38.710 63.040 1.00 0.00 ATOM 854 H12B DPP 8 33.030 38.100 63.050 1.00 0.00 ATOM 855 C11 DPP 8 31.800 37.450 64.690 1.00 0.00 ATOM 856 H11A DPP 8 32.660 37.370 65.390 1.00 0.00 ATOM 857 H11B DPP 8 31.690 36.470 64.180 1.00 0.00 ATOM 858 P DPP 8 29.200 37.220 65.180 1.00 0.00 ATOM 859 O13 DPP 8 28.230 37.990 65.990 1.00 0.00 ATOM 860 O14 DPP 8 29.410 35.800 65.550 1.00 0.00 ATOM 861 O11 DPP 8 28.920 37.310 63.610 1.00 0.00 ATOM 862 O12 DPP 8 30.630 37.930 65.340 1.00 0.00 ATOM 863 C1 DPP 8 28.550 38.610 63.140 1.00 0.00 ATOM 864 HA DPP 8 28.940 38.740 62.110 1.00 0.00 ATOM 865 HB DPP 8 28.980 39.470 63.710 1.00 0.00 ATOM 866 C2 DPP 8 27.030 38.840 63.190 1.00 0.00 ATOM 867 HS DPP 8 26.810 38.860 64.280 1.00 0.00 ATOM 868 O21 DPP 8 26.300 37.770 62.580 1.00 0.00 ATOM 869 C21 DPP 8 25.670 36.910 63.380 1.00 0.00 ATOM 870 O22 DPP 8 25.610 37.050 64.590 1.00 0.00 ATOM 871 C22 DPP 8 24.960 35.860 62.530 1.00 0.00 ATOM 872 H2R DPP 8 23.860 35.840 62.690 1.00 0.00 ATOM 873 H2S DPP 8 25.430 34.880 62.780 1.00 0.00 ATOM 874 C3 DPP 8 26.600 40.160 62.540 1.00 0.00 ATOM 875 HX DPP 8 27.010 41.020 63.120 1.00 0.00 ATOM 876 HY DPP 8 25.510 40.170 62.790 1.00 0.00 ATOM 877 O31 DPP 8 26.860 40.260 61.140 1.00 0.00 ATOM 878 C31 DPP 8 26.670 41.500 60.670 1.00 0.00 ATOM 879 O32 DPP 8 26.090 42.370 61.310 1.00 0.00 ATOM 880 C32 DPP 8 27.090 41.580 59.220 1.00 0.00 ATOM 881 H2X DPP 8 28.210 41.580 59.230 1.00 0.00 ATOM 882 H2Y DPP 8 26.840 42.530 58.690 1.00 0.00 ATOM 883 C23 DPP 8 24.940 36.080 61.020 1.00 0.00 ATOM 884 H3R DPP 8 24.790 37.160 60.770 1.00 0.00 ATOM 885 H3S DPP 8 24.060 35.540 60.620 1.00 0.00 ATOM 886 C24 DPP 8 26.200 35.560 60.330 1.00 0.00 ATOM 887 H4R DPP 8 26.270 34.510 60.660 1.00 0.00 ATOM 888 H4S DPP 8 27.070 36.060 60.800 1.00 0.00 ATOM 889 C25 DPP 8 26.130 35.650 58.800 1.00 0.00 ATOM 890 H5R DPP 8 26.160 36.730 58.570 1.00 0.00 ATOM 891 H5S DPP 8 25.130 35.220 58.590 1.00 0.00 ATOM 892 C26 DPP 8 27.330 34.870 58.260 1.00 0.00 ATOM 893 H6R DPP 8 27.030 33.810 58.410 1.00 0.00 ATOM 894 H6S DPP 8 28.290 35.060 58.790 1.00 0.00 ATOM 895 C27 DPP 8 27.660 35.060 56.780 1.00 0.00 ATOM 896 H7R DPP 8 26.780 34.710 56.210 1.00 0.00 ATOM 897 H7S DPP 8 28.540 34.440 56.510 1.00 0.00 ATOM 898 C28 DPP 8 28.030 36.510 56.430 1.00 0.00 ATOM 899 H8R DPP 8 27.920 37.050 57.390 1.00 0.00 ATOM 900 H8S DPP 8 27.250 36.930 55.740 1.00 0.00 ATOM 901 C29 DPP 8 29.420 36.660 55.830 1.00 0.00 ATOM 902 H9R DPP 8 30.140 36.330 56.600 1.00 0.00 ATOM 903 H9S DPP 8 29.640 37.740 55.660 1.00 0.00 ATOM 904 0C21 DPP 8 29.650 36.010 54.460 1.00 0.00 ATOM 905 H10R DPP 8 29.660 34.920 54.690 1.00 0.00 ATOM 906 H10S DPP 8 30.690 36.240 54.140 1.00 0.00 ATOM 907 1C21 DPP 8 28.620 36.470 53.420 1.00 0.00 ATOM 908 H11R DPP 8 28.960 37.490 53.160 1.00 0.00 ATOM 909 H11S DPP 8 27.560 36.350 53.720 1.00 0.00 ATOM 910 2C21 DPP 8 28.720 35.550 52.210 1.00 0.00 ATOM 911 H12R DPP 8 28.500 34.500 52.510 1.00 0.00 ATOM 912 H12S DPP 8 29.730 35.750 51.780 1.00 0.00 ATOM 913 3C21 DPP 8 27.540 35.710 51.250 1.00 0.00 ATOM 914 H13R DPP 8 27.160 36.760 51.270 1.00 0.00 ATOM 915 H13S DPP 8 26.690 35.140 51.690 1.00 0.00 ATOM 916 4C21 DPP 8 27.790 35.240 49.820 1.00 0.00 ATOM 917 H14R DPP 8 28.290 34.240 49.830 1.00 0.00 ATOM 918 H14S DPP 8 28.500 35.970 49.390 1.00 0.00 ATOM 919 5C21 DPP 8 26.470 35.240 49.050 1.00 0.00 ATOM 920 H15R DPP 8 25.530 34.800 49.460 1.00 0.00 ATOM 921 H15S DPP 8 26.750 34.510 48.250 1.00 0.00 ATOM 922 6C21 DPP 8 26.160 36.490 48.230 1.00 0.00 ATOM 923 H16R DPP 8 26.130 37.380 48.900 1.00 0.00 ATOM 924 H16S DPP 8 25.180 36.410 47.700 1.00 0.00 ATOM 925 H16T DPP 8 26.860 36.600 47.370 1.00 0.00 ATOM 926 C33 DPP 8 26.610 40.320 58.490 1.00 0.00 ATOM 927 H3X DPP 8 25.560 40.150 58.810 1.00 0.00 ATOM 928 H3Y DPP 8 27.230 39.450 58.790 1.00 0.00 ATOM 929 C34 DPP 8 26.880 40.410 56.990 1.00 0.00 ATOM 930 H4X DPP 8 27.470 39.500 56.730 1.00 0.00 ATOM 931 H4Y DPP 8 27.510 41.280 56.690 1.00 0.00 ATOM 932 C35 DPP 8 25.590 40.400 56.160 1.00 0.00 ATOM 933 H5X DPP 8 25.150 41.420 56.110 1.00 0.00 ATOM 934 H5Y DPP 8 24.860 39.700 56.620 1.00 0.00 ATOM 935 C36 DPP 8 25.920 39.860 54.770 1.00 0.00 ATOM 936 H6X DPP 8 24.960 39.840 54.220 1.00 0.00 ATOM 937 H6Y DPP 8 26.350 38.830 54.850 1.00 0.00 ATOM 938 C37 DPP 8 26.820 40.860 54.040 1.00 0.00 ATOM 939 H7X DPP 8 27.770 40.930 54.610 1.00 0.00 ATOM 940 H7Y DPP 8 26.290 41.810 53.800 1.00 0.00 ATOM 941 C38 DPP 8 27.330 40.450 52.660 1.00 0.00 ATOM 942 H8X DPP 8 27.660 39.390 52.610 1.00 0.00 ATOM 943 H8Y DPP 8 28.040 41.170 52.200 1.00 0.00 ATOM 944 C39 DPP 8 26.150 40.520 51.690 1.00 0.00 ATOM 945 H9X DPP 8 25.790 41.540 51.460 1.00 0.00 ATOM 946 H9Y DPP 8 25.340 39.890 52.120 1.00 0.00 ATOM 947 0C31 DPP 8 26.400 39.930 50.300 1.00 0.00 ATOM 948 H10X DPP 8 25.420 39.910 49.770 1.00 0.00 ATOM 949 H10Y DPP 8 26.860 38.920 50.330 1.00 0.00 ATOM 950 1C31 DPP 8 27.470 40.810 49.660 1.00 0.00 ATOM 951 H11X DPP 8 28.500 40.710 50.060 1.00 0.00 ATOM 952 H11Y DPP 8 27.070 41.840 49.810 1.00 0.00 ATOM 953 2C31 DPP 8 27.660 40.510 48.170 1.00 0.00 ATOM 954 H12X DPP 8 28.120 39.500 48.050 1.00 0.00 ATOM 955 H12Y DPP 8 28.410 41.300 47.950 1.00 0.00 ATOM 956 3C31 DPP 8 26.440 40.850 47.310 1.00 0.00 ATOM 957 H13X DPP 8 25.820 41.630 47.820 1.00 0.00 ATOM 958 H13Y DPP 8 25.710 40.010 47.330 1.00 0.00 ATOM 959 4C31 DPP 8 26.890 41.360 45.940 1.00 0.00 ATOM 960 H14X DPP 8 27.660 40.660 45.530 1.00 0.00 ATOM 961 H14Y DPP 8 27.210 42.420 45.940 1.00 0.00 ATOM 962 5C31 DPP 8 25.760 41.490 44.920 1.00 0.00 ATOM 963 H15X DPP 8 26.170 41.770 43.930 1.00 0.00 ATOM 964 H15Y DPP 8 24.990 42.220 45.250 1.00 0.00 ATOM 965 6C31 DPP 8 24.930 40.220 44.700 1.00 0.00 ATOM 966 H16X DPP 8 24.370 39.980 45.630 1.00 0.00 ATOM 967 H16Y DPP 8 24.180 40.560 43.950 1.00 0.00 ATOM 968 H16Z DPP 8 25.550 39.360 44.370 1.00 0.00 ATOM 969 N DPP 9 24.760 48.140 65.670 1.00 0.00 ATOM 970 HN1 DPP 9 25.140 48.820 64.980 1.00 0.00 ATOM 971 HN2 DPP 9 25.280 47.260 65.500 1.00 0.00 ATOM 972 HN3 DPP 9 23.770 47.960 65.400 1.00 0.00 ATOM 973 C12 DPP 9 24.670 48.770 67.040 1.00 0.00 ATOM 974 H12A DPP 9 25.740 48.910 67.280 1.00 0.00 ATOM 975 H12B DPP 9 24.230 47.980 67.690 1.00 0.00 ATOM 976 C11 DPP 9 24.050 50.170 66.960 1.00 0.00 ATOM 977 H11A DPP 9 24.010 50.520 68.010 1.00 0.00 ATOM 978 H11B DPP 9 23.030 50.100 66.540 1.00 0.00 ATOM 979 P DPP 9 24.120 52.160 65.410 1.00 0.00 ATOM 980 O13 DPP 9 25.030 53.190 64.860 1.00 0.00 ATOM 981 O14 DPP 9 23.080 52.720 66.290 1.00 0.00 ATOM 982 O11 DPP 9 23.390 51.390 64.210 1.00 0.00 ATOM 983 O12 DPP 9 24.910 50.980 66.150 1.00 0.00 ATOM 984 C1 DPP 9 22.810 52.250 63.230 1.00 0.00 ATOM 985 HA DPP 9 23.480 52.900 62.630 1.00 0.00 ATOM 986 HB DPP 9 22.150 52.890 63.850 1.00 0.00 ATOM 987 C2 DPP 9 21.820 51.600 62.260 1.00 0.00 ATOM 988 HS DPP 9 20.860 51.390 62.780 1.00 0.00 ATOM 989 O21 DPP 9 22.510 50.440 61.770 1.00 0.00 ATOM 990 C21 DPP 9 22.210 49.360 62.500 1.00 0.00 ATOM 991 O22 DPP 9 21.350 49.390 63.360 1.00 0.00 ATOM 992 C22 DPP 9 23.130 48.250 62.020 1.00 0.00 ATOM 993 H2R DPP 9 23.610 47.880 62.960 1.00 0.00 ATOM 994 H2S DPP 9 23.960 48.620 61.390 1.00 0.00 ATOM 995 C3 DPP 9 21.510 52.540 61.080 1.00 0.00 ATOM 996 HX DPP 9 20.920 53.420 61.420 1.00 0.00 ATOM 997 HY DPP 9 20.830 51.960 60.420 1.00 0.00 ATOM 998 O31 DPP 9 22.670 53.000 60.380 1.00 0.00 ATOM 999 C31 DPP 9 22.690 52.960 59.040 1.00 0.00 ATOM 1000 O32 DPP 9 21.770 52.540 58.360 1.00 0.00 ATOM 1001 C32 DPP 9 23.910 53.700 58.520 1.00 0.00 ATOM 1002 H2X DPP 9 24.830 53.170 58.870 1.00 0.00 ATOM 1003 H2Y DPP 9 23.750 54.710 58.930 1.00 0.00 ATOM 1004 C23 DPP 9 22.430 47.080 61.330 1.00 0.00 ATOM 1005 H3R DPP 9 21.690 46.580 61.990 1.00 0.00 ATOM 1006 H3S DPP 9 23.210 46.400 60.930 1.00 0.00 ATOM 1007 C24 DPP 9 21.820 47.660 60.050 1.00 0.00 ATOM 1008 H4R DPP 9 21.340 48.630 60.280 1.00 0.00 ATOM 1009 H4S DPP 9 21.150 46.890 59.600 1.00 0.00 ATOM 1010 C25 DPP 9 22.800 48.180 59.000 1.00 0.00 ATOM 1011 H5R DPP 9 23.400 47.310 58.640 1.00 0.00 ATOM 1012 H5S DPP 9 23.480 48.960 59.400 1.00 0.00 ATOM 1013 C26 DPP 9 21.980 48.720 57.830 1.00 0.00 ATOM 1014 H6R DPP 9 21.570 49.740 57.950 1.00 0.00 ATOM 1015 H6S DPP 9 21.080 48.120 57.560 1.00 0.00 ATOM 1016 C27 DPP 9 22.740 48.590 56.510 1.00 0.00 ATOM 1017 H7R DPP 9 22.800 47.490 56.330 1.00 0.00 ATOM 1018 H7S DPP 9 23.750 49.010 56.660 1.00 0.00 ATOM 1019 C28 DPP 9 21.980 49.260 55.360 1.00 0.00 ATOM 1020 H8R DPP 9 22.000 50.360 55.530 1.00 0.00 ATOM 1021 H8S DPP 9 20.910 49.000 55.490 1.00 0.00 ATOM 1022 C29 DPP 9 22.620 48.900 54.020 1.00 0.00 ATOM 1023 H9R DPP 9 22.510 47.800 53.970 1.00 0.00 ATOM 1024 H9S DPP 9 23.660 49.250 53.890 1.00 0.00 ATOM 1025 0C21 DPP 9 21.910 49.530 52.820 1.00 0.00 ATOM 1026 H10R DPP 9 22.150 50.620 52.860 1.00 0.00 ATOM 1027 H10S DPP 9 20.810 49.370 52.820 1.00 0.00 ATOM 1028 1C21 DPP 9 22.530 49.110 51.490 1.00 0.00 ATOM 1029 H11R DPP 9 22.370 48.020 51.310 1.00 0.00 ATOM 1030 H11S DPP 9 23.580 49.470 51.410 1.00 0.00 ATOM 1031 2C21 DPP 9 21.780 49.810 50.360 1.00 0.00 ATOM 1032 H12R DPP 9 21.920 50.890 50.530 1.00 0.00 ATOM 1033 H12S DPP 9 20.680 49.610 50.420 1.00 0.00 ATOM 1034 3C21 DPP 9 22.370 49.490 48.980 1.00 0.00 ATOM 1035 H13R DPP 9 22.060 48.440 48.840 1.00 0.00 ATOM 1036 H13S DPP 9 23.480 49.520 48.970 1.00 0.00 ATOM 1037 4C21 DPP 9 21.790 50.400 47.890 1.00 0.00 ATOM 1038 H14R DPP 9 22.020 51.470 48.060 1.00 0.00 ATOM 1039 H14S DPP 9 20.710 50.230 47.710 1.00 0.00 ATOM 1040 5C21 DPP 9 22.430 49.870 46.600 1.00 0.00 ATOM 1041 H15R DPP 9 21.830 50.330 45.780 1.00 0.00 ATOM 1042 H15S DPP 9 22.330 48.760 46.520 1.00 0.00 ATOM 1043 6C21 DPP 9 23.880 50.250 46.350 1.00 0.00 ATOM 1044 H16R DPP 9 24.000 51.340 46.520 1.00 0.00 ATOM 1045 H16S DPP 9 24.010 49.940 45.280 1.00 0.00 ATOM 1046 H16T DPP 9 24.630 49.760 47.010 1.00 0.00 ATOM 1047 C33 DPP 9 23.950 53.850 57.000 1.00 0.00 ATOM 1048 H3X DPP 9 24.970 54.220 56.750 1.00 0.00 ATOM 1049 H3Y DPP 9 23.260 54.650 56.660 1.00 0.00 ATOM 1050 C34 DPP 9 23.750 52.680 56.030 1.00 0.00 ATOM 1051 H4X DPP 9 22.680 52.390 55.950 1.00 0.00 ATOM 1052 H4Y DPP 9 24.390 51.810 56.280 1.00 0.00 ATOM 1053 C35 DPP 9 24.000 53.300 54.650 1.00 0.00 ATOM 1054 H5X DPP 9 24.680 54.170 54.740 1.00 0.00 ATOM 1055 H5Y DPP 9 22.980 53.600 54.310 1.00 0.00 ATOM 1056 C36 DPP 9 24.580 52.400 53.560 1.00 0.00 ATOM 1057 H6X DPP 9 23.940 51.490 53.430 1.00 0.00 ATOM 1058 H6Y DPP 9 25.580 52.150 53.960 1.00 0.00 ATOM 1059 C37 DPP 9 24.930 53.190 52.300 1.00 0.00 ATOM 1060 H7X DPP 9 25.680 52.560 51.780 1.00 0.00 ATOM 1061 H7Y DPP 9 25.380 54.170 52.570 1.00 0.00 ATOM 1062 C38 DPP 9 23.690 53.380 51.410 1.00 0.00 ATOM 1063 H8X DPP 9 22.830 53.850 51.920 1.00 0.00 ATOM 1064 H8Y DPP 9 23.390 52.360 51.080 1.00 0.00 ATOM 1065 C39 DPP 9 23.920 54.350 50.250 1.00 0.00 ATOM 1066 H9X DPP 9 24.640 55.120 50.620 1.00 0.00 ATOM 1067 H9Y DPP 9 23.030 54.850 49.810 1.00 0.00 ATOM 1068 0C31 DPP 9 24.660 53.700 49.090 1.00 0.00 ATOM 1069 H10X DPP 9 24.230 52.700 48.830 1.00 0.00 ATOM 1070 H10Y DPP 9 25.600 53.400 49.590 1.00 0.00 ATOM 1071 1C31 DPP 9 24.640 54.600 47.850 1.00 0.00 ATOM 1072 H11X DPP 9 24.930 55.600 48.230 1.00 0.00 ATOM 1073 H11Y DPP 9 23.610 54.630 47.440 1.00 0.00 ATOM 1074 2C31 DPP 9 25.590 54.230 46.710 1.00 0.00 ATOM 1075 H12X DPP 9 25.300 53.180 46.500 1.00 0.00 ATOM 1076 H12Y DPP 9 26.590 54.290 47.200 1.00 0.00 ATOM 1077 3C31 DPP 9 25.610 55.130 45.470 1.00 0.00 ATOM 1078 H13X DPP 9 26.550 55.710 45.500 1.00 0.00 ATOM 1079 H13Y DPP 9 24.710 55.780 45.550 1.00 0.00 ATOM 1080 4C31 DPP 9 25.370 54.300 44.210 1.00 0.00 ATOM 1081 H14X DPP 9 25.230 54.910 43.290 1.00 0.00 ATOM 1082 H14Y DPP 9 24.460 53.660 44.340 1.00 0.00 ATOM 1083 5C31 DPP 9 26.560 53.430 43.810 1.00 0.00 ATOM 1084 H15X DPP 9 26.940 52.770 44.620 1.00 0.00 ATOM 1085 H15Y DPP 9 27.350 54.180 43.570 1.00 0.00 ATOM 1086 6C31 DPP 9 26.300 52.590 42.560 1.00 0.00 ATOM 1087 H16X DPP 9 27.270 52.240 42.160 1.00 0.00 ATOM 1088 H16Y DPP 9 25.780 53.280 41.860 1.00 0.00 ATOM 1089 H16Z DPP 9 25.590 51.760 42.740 1.00 0.00 ATOM 1090 N DPP 10 42.420 17.300 61.660 1.00 0.00 ATOM 1091 HN1 DPP 10 42.600 18.300 61.450 1.00 0.00 ATOM 1092 HN2 DPP 10 41.460 17.240 61.250 1.00 0.00 ATOM 1093 HN3 DPP 10 42.340 17.060 62.670 1.00 0.00 ATOM 1094 C12 DPP 10 43.180 16.200 60.960 1.00 0.00 ATOM 1095 H12A DPP 10 44.230 16.530 60.830 1.00 0.00 ATOM 1096 H12B DPP 10 43.160 15.270 61.570 1.00 0.00 ATOM 1097 C11 DPP 10 42.580 15.940 59.580 1.00 0.00 ATOM 1098 H11A DPP 10 41.740 15.200 59.590 1.00 0.00 ATOM 1099 H11B DPP 10 43.300 15.290 59.040 1.00 0.00 ATOM 1100 P DPP 10 41.500 16.900 57.540 1.00 0.00 ATOM 1101 O13 DPP 10 41.130 18.150 56.840 1.00 0.00 ATOM 1102 O14 DPP 10 40.360 15.960 57.670 1.00 0.00 ATOM 1103 O11 DPP 10 42.710 16.240 56.740 1.00 0.00 ATOM 1104 O12 DPP 10 42.150 17.160 58.970 1.00 0.00 ATOM 1105 C1 DPP 10 43.960 16.930 56.710 1.00 0.00 ATOM 1106 HA DPP 10 44.790 16.270 57.050 1.00 0.00 ATOM 1107 HB DPP 10 43.970 17.880 57.280 1.00 0.00 ATOM 1108 C2 DPP 10 44.450 17.310 55.310 1.00 0.00 ATOM 1109 HS DPP 10 45.230 18.100 55.240 1.00 0.00 ATOM 1110 O21 DPP 10 43.310 17.740 54.550 1.00 0.00 ATOM 1111 C21 DPP 10 42.900 18.980 54.820 1.00 0.00 ATOM 1112 O22 DPP 10 43.480 19.800 55.510 1.00 0.00 ATOM 1113 C22 DPP 10 41.650 19.320 54.030 1.00 0.00 ATOM 1114 H2R DPP 10 40.990 19.660 54.860 1.00 0.00 ATOM 1115 H2S DPP 10 41.300 18.530 53.330 1.00 0.00 ATOM 1116 C3 DPP 10 45.080 16.060 54.690 1.00 0.00 ATOM 1117 HX DPP 10 44.490 15.180 55.000 1.00 0.00 ATOM 1118 HY DPP 10 46.110 15.960 55.100 1.00 0.00 ATOM 1119 O31 DPP 10 45.170 15.930 53.260 1.00 0.00 ATOM 1120 C31 DPP 10 46.230 16.500 52.710 1.00 0.00 ATOM 1121 O32 DPP 10 47.060 17.180 53.300 1.00 0.00 ATOM 1122 C32 DPP 10 46.360 16.070 51.250 1.00 0.00 ATOM 1123 H2X DPP 10 45.470 16.550 50.800 1.00 0.00 ATOM 1124 H2Y DPP 10 46.250 14.970 51.260 1.00 0.00 ATOM 1125 C23 DPP 10 42.060 20.540 53.200 1.00 0.00 ATOM 1126 H3R DPP 10 42.740 20.280 52.370 1.00 0.00 ATOM 1127 H3S DPP 10 42.580 21.360 53.740 1.00 0.00 ATOM 1128 C24 DPP 10 40.840 21.320 52.700 1.00 0.00 ATOM 1129 H4R DPP 10 41.240 22.090 52.010 1.00 0.00 ATOM 1130 H4S DPP 10 40.250 21.770 53.530 1.00 0.00 ATOM 1131 C25 DPP 10 39.980 20.540 51.700 1.00 0.00 ATOM 1132 H5R DPP 10 39.300 19.910 52.310 1.00 0.00 ATOM 1133 H5S DPP 10 40.660 19.920 51.070 1.00 0.00 ATOM 1134 C26 DPP 10 39.120 21.470 50.850 1.00 0.00 ATOM 1135 H6R DPP 10 39.730 22.140 50.200 1.00 0.00 ATOM 1136 H6S DPP 10 38.530 22.160 51.490 1.00 0.00 ATOM 1137 C27 DPP 10 38.080 20.870 49.900 1.00 0.00 ATOM 1138 H7R DPP 10 37.500 21.680 49.410 1.00 0.00 ATOM 1139 H7S DPP 10 37.400 20.150 50.410 1.00 0.00 ATOM 1140 C28 DPP 10 38.730 20.040 48.800 1.00 0.00 ATOM 1141 H8R DPP 10 39.080 19.070 49.220 1.00 0.00 ATOM 1142 H8S DPP 10 39.660 20.550 48.460 1.00 0.00 ATOM 1143 C29 DPP 10 37.850 19.720 47.600 1.00 0.00 ATOM 1144 H9R DPP 10 37.580 20.640 47.040 1.00 0.00 ATOM 1145 H9S DPP 10 36.870 19.290 47.910 1.00 0.00 ATOM 1146 0C21 DPP 10 38.290 18.740 46.500 1.00 0.00 ATOM 1147 H10R DPP 10 38.640 17.860 47.090 1.00 0.00 ATOM 1148 H10S DPP 10 39.160 19.150 45.960 1.00 0.00 ATOM 1149 1C21 DPP 10 37.200 18.370 45.500 1.00 0.00 ATOM 1150 H11R DPP 10 37.140 19.160 44.720 1.00 0.00 ATOM 1151 H11S DPP 10 36.220 18.280 46.030 1.00 0.00 ATOM 1152 2C21 DPP 10 37.490 16.960 44.990 1.00 0.00 ATOM 1153 H12R DPP 10 37.620 16.330 45.900 1.00 0.00 ATOM 1154 H12S DPP 10 38.390 16.870 44.340 1.00 0.00 ATOM 1155 3C21 DPP 10 36.360 16.350 44.150 1.00 0.00 ATOM 1156 H13R DPP 10 35.460 16.600 44.750 1.00 0.00 ATOM 1157 H13S DPP 10 36.310 15.260 43.930 1.00 0.00 ATOM 1158 4C21 DPP 10 36.040 17.170 42.900 1.00 0.00 ATOM 1159 H14R DPP 10 36.320 18.210 43.170 1.00 0.00 ATOM 1160 H14S DPP 10 34.950 17.050 42.740 1.00 0.00 ATOM 1161 5C21 DPP 10 36.790 16.910 41.600 1.00 0.00 ATOM 1162 H15R DPP 10 36.330 15.990 41.190 1.00 0.00 ATOM 1163 H15S DPP 10 37.860 16.660 41.810 1.00 0.00 ATOM 1164 6C21 DPP 10 36.880 18.070 40.610 1.00 0.00 ATOM 1165 H16R DPP 10 37.440 17.980 39.650 1.00 0.00 ATOM 1166 H16S DPP 10 37.470 18.840 41.140 1.00 0.00 ATOM 1167 H16T DPP 10 35.880 18.500 40.390 1.00 0.00 ATOM 1168 C33 DPP 10 47.670 16.540 50.600 1.00 0.00 ATOM 1169 H3X DPP 10 47.800 17.600 50.920 1.00 0.00 ATOM 1170 H3Y DPP 10 47.610 16.420 49.500 1.00 0.00 ATOM 1171 C34 DPP 10 48.930 15.820 51.060 1.00 0.00 ATOM 1172 H4X DPP 10 48.840 14.710 51.080 1.00 0.00 ATOM 1173 H4Y DPP 10 49.110 16.130 52.110 1.00 0.00 ATOM 1174 C35 DPP 10 50.140 16.090 50.170 1.00 0.00 ATOM 1175 H5X DPP 10 49.960 15.670 49.160 1.00 0.00 ATOM 1176 H5Y DPP 10 51.040 15.540 50.520 1.00 0.00 ATOM 1177 C36 DPP 10 50.430 17.590 50.040 1.00 0.00 ATOM 1178 H6X DPP 10 49.580 18.070 49.500 1.00 0.00 ATOM 1179 H6Y DPP 10 50.670 18.040 51.030 1.00 0.00 ATOM 1180 C37 DPP 10 51.620 17.890 49.140 1.00 0.00 ATOM 1181 H7X DPP 10 52.370 17.110 49.390 1.00 0.00 ATOM 1182 H7Y DPP 10 51.980 18.920 49.380 1.00 0.00 ATOM 1183 C38 DPP 10 51.250 17.880 47.650 1.00 0.00 ATOM 1184 H8X DPP 10 50.710 16.950 47.390 1.00 0.00 ATOM 1185 H8Y DPP 10 50.560 18.740 47.490 1.00 0.00 ATOM 1186 C39 DPP 10 52.470 18.100 46.740 1.00 0.00 ATOM 1187 H9X DPP 10 53.320 17.410 46.960 1.00 0.00 ATOM 1188 H9Y DPP 10 52.790 19.130 46.970 1.00 0.00 ATOM 1189 0C31 DPP 10 52.090 17.950 45.270 1.00 0.00 ATOM 1190 H10X DPP 10 51.340 18.730 45.010 1.00 0.00 ATOM 1191 H10Y DPP 10 51.570 16.980 45.140 1.00 0.00 ATOM 1192 1C31 DPP 10 53.290 18.040 44.320 1.00 0.00 ATOM 1193 H11X DPP 10 54.080 17.340 44.680 1.00 0.00 ATOM 1194 H11Y DPP 10 53.690 19.030 44.620 1.00 0.00 ATOM 1195 2C31 DPP 10 52.880 17.920 42.850 1.00 0.00 ATOM 1196 H12X DPP 10 51.810 18.220 42.790 1.00 0.00 ATOM 1197 H12Y DPP 10 53.070 16.910 42.430 1.00 0.00 ATOM 1198 3C31 DPP 10 53.620 18.880 41.920 1.00 0.00 ATOM 1199 H13X DPP 10 53.550 19.870 42.420 1.00 0.00 ATOM 1200 H13Y DPP 10 53.100 19.040 40.960 1.00 0.00 ATOM 1201 4C31 DPP 10 55.060 18.490 41.580 1.00 0.00 ATOM 1202 H14X DPP 10 55.750 18.180 42.400 1.00 0.00 ATOM 1203 H14Y DPP 10 55.590 19.420 41.290 1.00 0.00 ATOM 1204 5C31 DPP 10 55.250 17.470 40.460 1.00 0.00 ATOM 1205 H15X DPP 10 54.820 16.500 40.780 1.00 0.00 ATOM 1206 H15Y DPP 10 56.320 17.240 40.230 1.00 0.00 ATOM 1207 6C31 DPP 10 54.620 17.880 39.130 1.00 0.00 ATOM 1208 H16X DPP 10 53.540 18.080 39.330 1.00 0.00 ATOM 1209 H16Y DPP 10 54.580 17.100 38.330 1.00 0.00 ATOM 1210 H16Z DPP 10 54.920 18.850 38.680 1.00 0.00 ATOM 1211 N DPP 11 54.400 14.010 64.710 1.00 0.00 ATOM 1212 HN1 DPP 11 54.040 14.720 65.380 1.00 0.00 ATOM 1213 HN2 DPP 11 55.150 13.440 65.150 1.00 0.00 ATOM 1214 HN3 DPP 11 54.850 14.530 63.930 1.00 0.00 ATOM 1215 C12 DPP 11 53.340 13.100 64.130 1.00 0.00 ATOM 1216 H12A DPP 11 52.860 12.630 65.020 1.00 0.00 ATOM 1217 H12B DPP 11 53.910 12.380 63.510 1.00 0.00 ATOM 1218 C11 DPP 11 52.170 13.790 63.410 1.00 0.00 ATOM 1219 H11A DPP 11 51.520 14.210 64.210 1.00 0.00 ATOM 1220 H11B DPP 11 51.640 13.000 62.830 1.00 0.00 ATOM 1221 P DPP 11 51.500 15.410 61.650 1.00 0.00 ATOM 1222 O13 DPP 11 51.900 16.660 60.970 1.00 0.00 ATOM 1223 O14 DPP 11 50.240 15.570 62.420 1.00 0.00 ATOM 1224 O11 DPP 11 51.440 14.170 60.640 1.00 0.00 ATOM 1225 O12 DPP 11 52.670 14.850 62.600 1.00 0.00 ATOM 1226 C1 DPP 11 52.630 13.550 60.170 1.00 0.00 ATOM 1227 HA DPP 11 52.470 12.450 60.190 1.00 0.00 ATOM 1228 HB DPP 11 53.560 13.700 60.760 1.00 0.00 ATOM 1229 C2 DPP 11 53.040 14.000 58.760 1.00 0.00 ATOM 1230 HS DPP 11 53.890 13.340 58.480 1.00 0.00 ATOM 1231 O21 DPP 11 53.360 15.390 58.650 1.00 0.00 ATOM 1232 C21 DPP 11 54.670 15.640 58.610 1.00 0.00 ATOM 1233 O22 DPP 11 55.600 14.870 58.790 1.00 0.00 ATOM 1234 C22 DPP 11 54.750 17.140 58.360 1.00 0.00 ATOM 1235 H2R DPP 11 54.830 17.700 59.320 1.00 0.00 ATOM 1236 H2S DPP 11 53.810 17.380 57.820 1.00 0.00 ATOM 1237 C3 DPP 11 51.890 13.760 57.760 1.00 0.00 ATOM 1238 HX DPP 11 50.920 14.250 57.980 1.00 0.00 ATOM 1239 HY DPP 11 51.710 12.680 57.980 1.00 0.00 ATOM 1240 O31 DPP 11 52.230 13.790 56.370 1.00 0.00 ATOM 1241 C31 DPP 11 52.040 15.000 55.860 1.00 0.00 ATOM 1242 O32 DPP 11 51.570 15.960 56.440 1.00 0.00 ATOM 1243 C32 DPP 11 52.380 15.050 54.380 1.00 0.00 ATOM 1244 H2X DPP 11 51.510 15.370 53.770 1.00 0.00 ATOM 1245 H2Y DPP 11 52.730 14.040 54.060 1.00 0.00 ATOM 1246 C23 DPP 11 55.900 17.560 57.450 1.00 0.00 ATOM 1247 H3R DPP 11 56.230 16.740 56.780 1.00 0.00 ATOM 1248 H3S DPP 11 56.820 17.810 58.030 1.00 0.00 ATOM 1249 C24 DPP 11 55.470 18.760 56.600 1.00 0.00 ATOM 1250 H4R DPP 11 54.890 19.450 57.260 1.00 0.00 ATOM 1251 H4S DPP 11 54.750 18.410 55.830 1.00 0.00 ATOM 1252 C25 DPP 11 56.640 19.450 55.890 1.00 0.00 ATOM 1253 H5R DPP 11 57.240 18.640 55.420 1.00 0.00 ATOM 1254 H5S DPP 11 57.240 20.000 56.650 1.00 0.00 ATOM 1255 C26 DPP 11 56.160 20.440 54.830 1.00 0.00 ATOM 1256 H6R DPP 11 55.390 21.090 55.270 1.00 0.00 ATOM 1257 H6S DPP 11 55.600 19.880 54.040 1.00 0.00 ATOM 1258 C27 DPP 11 57.180 21.450 54.290 1.00 0.00 ATOM 1259 H7R DPP 11 57.730 22.030 55.060 1.00 0.00 ATOM 1260 H7S DPP 11 56.710 22.210 53.630 1.00 0.00 ATOM 1261 C28 DPP 11 58.380 20.640 53.790 1.00 0.00 ATOM 1262 H8R DPP 11 57.890 19.830 53.210 1.00 0.00 ATOM 1263 H8S DPP 11 58.780 20.220 54.730 1.00 0.00 ATOM 1264 C29 DPP 11 59.350 21.530 53.010 1.00 0.00 ATOM 1265 H9R DPP 11 59.540 22.500 53.530 1.00 0.00 ATOM 1266 H9S DPP 11 58.920 21.830 52.030 1.00 0.00 ATOM 1267 0C21 DPP 11 60.710 20.910 52.710 1.00 0.00 ATOM 1268 H10R DPP 11 60.590 20.000 52.080 1.00 0.00 ATOM 1269 H10S DPP 11 61.070 20.440 53.650 1.00 0.00 ATOM 1270 1C21 DPP 11 61.790 21.810 52.110 1.00 0.00 ATOM 1271 H11R DPP 11 61.240 22.280 51.270 1.00 0.00 ATOM 1272 H11S DPP 11 62.630 21.260 51.630 1.00 0.00 ATOM 1273 2C21 DPP 11 62.320 22.940 53.000 1.00 0.00 ATOM 1274 H12R DPP 11 62.740 22.380 53.860 1.00 0.00 ATOM 1275 H12S DPP 11 61.610 23.730 53.340 1.00 0.00 ATOM 1276 3C21 DPP 11 63.570 23.670 52.510 1.00 0.00 ATOM 1277 H13R DPP 11 64.330 22.860 52.420 1.00 0.00 ATOM 1278 H13S DPP 11 63.890 24.460 53.220 1.00 0.00 ATOM 1279 4C21 DPP 11 63.240 24.450 51.230 1.00 0.00 ATOM 1280 H14R DPP 11 63.790 25.410 51.350 1.00 0.00 ATOM 1281 H14S DPP 11 62.130 24.430 51.190 1.00 0.00 ATOM 1282 5C21 DPP 11 63.790 23.810 49.950 1.00 0.00 ATOM 1283 H15R DPP 11 63.680 22.710 50.040 1.00 0.00 ATOM 1284 H15S DPP 11 64.810 24.050 49.590 1.00 0.00 ATOM 1285 6C21 DPP 11 62.970 24.170 48.710 1.00 0.00 ATOM 1286 H16R DPP 11 63.330 23.610 47.810 1.00 0.00 ATOM 1287 H16S DPP 11 63.060 25.240 48.420 1.00 0.00 ATOM 1288 H16T DPP 11 61.910 23.990 48.980 1.00 0.00 ATOM 1289 C33 DPP 11 53.480 16.110 54.260 1.00 0.00 ATOM 1290 H3X DPP 11 54.270 15.460 54.680 1.00 0.00 ATOM 1291 H3Y DPP 11 53.230 16.940 54.960 1.00 0.00 ATOM 1292 C34 DPP 11 53.590 16.610 52.820 1.00 0.00 ATOM 1293 H4X DPP 11 52.610 17.050 52.530 1.00 0.00 ATOM 1294 H4Y DPP 11 53.810 15.720 52.190 1.00 0.00 ATOM 1295 C35 DPP 11 54.530 17.800 52.620 1.00 0.00 ATOM 1296 H5X DPP 11 55.620 17.700 52.830 1.00 0.00 ATOM 1297 H5Y DPP 11 54.240 18.620 53.310 1.00 0.00 ATOM 1298 C36 DPP 11 54.400 18.450 51.240 1.00 0.00 ATOM 1299 H6X DPP 11 53.370 18.860 51.260 1.00 0.00 ATOM 1300 H6Y DPP 11 54.510 17.800 50.350 1.00 0.00 ATOM 1301 C37 DPP 11 55.310 19.670 51.150 1.00 0.00 ATOM 1302 H7X DPP 11 55.080 20.340 52.010 1.00 0.00 ATOM 1303 H7Y DPP 11 54.970 20.300 50.300 1.00 0.00 ATOM 1304 C38 DPP 11 56.810 19.490 50.910 1.00 0.00 ATOM 1305 H8X DPP 11 57.170 18.620 51.510 1.00 0.00 ATOM 1306 H8Y DPP 11 57.220 20.500 51.110 1.00 0.00 ATOM 1307 C39 DPP 11 57.080 19.120 49.450 1.00 0.00 ATOM 1308 H9X DPP 11 57.010 18.020 49.270 1.00 0.00 ATOM 1309 H9Y DPP 11 56.360 19.660 48.810 1.00 0.00 ATOM 1310 0C31 DPP 11 58.550 19.450 49.190 1.00 0.00 ATOM 1311 H10X DPP 11 59.020 19.010 50.100 1.00 0.00 ATOM 1312 H10Y DPP 11 58.930 20.490 49.110 1.00 0.00 ATOM 1313 1C31 DPP 11 59.050 18.670 47.980 1.00 0.00 ATOM 1314 H11X DPP 11 58.640 19.110 47.040 1.00 0.00 ATOM 1315 H11Y DPP 11 58.620 17.650 47.920 1.00 0.00 ATOM 1316 2C31 DPP 11 60.570 18.530 48.020 1.00 0.00 ATOM 1317 H12X DPP 11 60.830 17.740 47.290 1.00 0.00 ATOM 1318 H12Y DPP 11 60.810 18.220 49.060 1.00 0.00 ATOM 1319 3C31 DPP 11 61.470 19.750 47.780 1.00 0.00 ATOM 1320 H13X DPP 11 61.080 20.500 48.490 1.00 0.00 ATOM 1321 H13Y DPP 11 61.570 20.000 46.700 1.00 0.00 ATOM 1322 4C31 DPP 11 62.930 19.520 48.180 1.00 0.00 ATOM 1323 H14X DPP 11 63.140 18.430 48.080 1.00 0.00 ATOM 1324 H14Y DPP 11 62.980 19.910 49.220 1.00 0.00 ATOM 1325 5C31 DPP 11 63.830 20.350 47.270 1.00 0.00 ATOM 1326 H15X DPP 11 63.250 21.190 46.850 1.00 0.00 ATOM 1327 H15Y DPP 11 64.100 19.720 46.390 1.00 0.00 ATOM 1328 6C31 DPP 11 65.140 20.760 47.940 1.00 0.00 ATOM 1329 H16X DPP 11 64.880 21.320 48.870 1.00 0.00 ATOM 1330 H16Y DPP 11 65.770 21.460 47.350 1.00 0.00 ATOM 1331 H16Z DPP 11 65.670 19.850 48.300 1.00 0.00 ATOM 1332 N DPP 12 29.280 33.610 64.040 1.00 0.00 ATOM 1333 HN1 DPP 12 29.480 34.440 64.630 1.00 0.00 ATOM 1334 HN2 DPP 12 28.860 32.760 64.480 1.00 0.00 ATOM 1335 HN3 DPP 12 30.240 33.340 63.740 1.00 0.00 ATOM 1336 C12 DPP 12 28.550 33.780 62.730 1.00 0.00 ATOM 1337 H12A DPP 12 27.710 34.500 62.850 1.00 0.00 ATOM 1338 H12B DPP 12 29.230 34.310 62.030 1.00 0.00 ATOM 1339 C11 DPP 12 28.110 32.410 62.230 1.00 0.00 ATOM 1340 H11A DPP 12 27.390 32.560 61.390 1.00 0.00 ATOM 1341 H11B DPP 12 28.940 31.750 61.890 1.00 0.00 ATOM 1342 P DPP 12 27.320 30.220 63.270 1.00 0.00 ATOM 1343 O13 DPP 12 26.440 29.650 64.310 1.00 0.00 ATOM 1344 O14 DPP 12 28.710 29.710 63.290 1.00 0.00 ATOM 1345 O11 DPP 12 26.770 29.920 61.800 1.00 0.00 ATOM 1346 O12 DPP 12 27.360 31.820 63.300 1.00 0.00 ATOM 1347 C1 DPP 12 26.580 28.630 61.210 1.00 0.00 ATOM 1348 HA DPP 12 25.810 28.620 60.410 1.00 0.00 ATOM 1349 HB DPP 12 26.190 27.910 61.960 1.00 0.00 ATOM 1350 C2 DPP 12 27.940 28.240 60.620 1.00 0.00 ATOM 1351 HS DPP 12 28.660 28.010 61.430 1.00 0.00 ATOM 1352 O21 DPP 12 28.540 29.390 60.030 1.00 0.00 ATOM 1353 C21 DPP 12 29.850 29.200 59.850 1.00 0.00 ATOM 1354 O22 DPP 12 30.460 28.160 60.010 1.00 0.00 ATOM 1355 C22 DPP 12 30.550 30.440 59.320 1.00 0.00 ATOM 1356 H2R DPP 12 31.650 30.330 59.300 1.00 0.00 ATOM 1357 H2S DPP 12 30.320 31.350 59.920 1.00 0.00 ATOM 1358 C3 DPP 12 27.870 27.000 59.710 1.00 0.00 ATOM 1359 HX DPP 12 27.480 26.200 60.380 1.00 0.00 ATOM 1360 HY DPP 12 28.900 26.670 59.430 1.00 0.00 ATOM 1361 O31 DPP 12 27.040 26.930 58.550 1.00 0.00 ATOM 1362 C31 DPP 12 27.470 27.490 57.410 1.00 0.00 ATOM 1363 O32 DPP 12 28.550 28.000 57.190 1.00 0.00 ATOM 1364 C32 DPP 12 26.410 27.270 56.330 1.00 0.00 ATOM 1365 H2X DPP 12 25.910 28.230 56.100 1.00 0.00 ATOM 1366 H2Y DPP 12 25.610 26.570 56.660 1.00 0.00 ATOM 1367 C23 DPP 12 30.120 30.480 57.850 1.00 0.00 ATOM 1368 H3R DPP 12 29.010 30.480 57.920 1.00 0.00 ATOM 1369 H3S DPP 12 30.540 29.600 57.320 1.00 0.00 ATOM 1370 C24 DPP 12 30.630 31.700 57.080 1.00 0.00 ATOM 1371 H4R DPP 12 31.700 31.810 57.370 1.00 0.00 ATOM 1372 H4S DPP 12 29.920 32.480 57.410 1.00 0.00 ATOM 1373 C25 DPP 12 30.670 31.490 55.570 1.00 0.00 ATOM 1374 H5R DPP 12 31.140 30.550 55.210 1.00 0.00 ATOM 1375 H5S DPP 12 31.230 32.260 55.000 1.00 0.00 ATOM 1376 C26 DPP 12 29.260 31.430 54.980 1.00 0.00 ATOM 1377 H6R DPP 12 28.540 32.150 55.430 1.00 0.00 ATOM 1378 H6S DPP 12 28.810 30.420 55.040 1.00 0.00 ATOM 1379 C27 DPP 12 29.280 31.600 53.460 1.00 0.00 ATOM 1380 H7R DPP 12 30.300 31.360 53.090 1.00 0.00 ATOM 1381 H7S DPP 12 29.050 32.660 53.230 1.00 0.00 ATOM 1382 C28 DPP 12 28.130 30.870 52.770 1.00 0.00 ATOM 1383 H8R DPP 12 27.160 31.120 53.260 1.00 0.00 ATOM 1384 H8S DPP 12 28.210 29.770 52.920 1.00 0.00 ATOM 1385 C29 DPP 12 28.160 31.280 51.300 1.00 0.00 ATOM 1386 H9R DPP 12 29.250 31.320 51.120 1.00 0.00 ATOM 1387 H9S DPP 12 27.830 32.330 51.140 1.00 0.00 ATOM 1388 0C21 DPP 12 27.450 30.210 50.460 1.00 0.00 ATOM 1389 H10R DPP 12 26.470 30.000 50.950 1.00 0.00 ATOM 1390 H10S DPP 12 27.970 29.260 50.700 1.00 0.00 ATOM 1391 1C21 DPP 12 27.430 30.340 48.940 1.00 0.00 ATOM 1392 H11R DPP 12 26.690 31.120 48.650 1.00 0.00 ATOM 1393 H11S DPP 12 27.000 29.470 48.410 1.00 0.00 ATOM 1394 2C21 DPP 12 28.880 30.400 48.450 1.00 0.00 ATOM 1395 H12R DPP 12 29.510 29.690 49.030 1.00 0.00 ATOM 1396 H12S DPP 12 29.230 31.420 48.720 1.00 0.00 ATOM 1397 3C21 DPP 12 29.110 30.020 46.980 1.00 0.00 ATOM 1398 H13R DPP 12 28.840 28.940 46.910 1.00 0.00 ATOM 1399 H13S DPP 12 30.200 30.130 46.810 1.00 0.00 ATOM 1400 4C21 DPP 12 28.310 30.900 46.020 1.00 0.00 ATOM 1401 H14R DPP 12 28.800 31.900 46.030 1.00 0.00 ATOM 1402 H14S DPP 12 27.260 30.890 46.390 1.00 0.00 ATOM 1403 5C21 DPP 12 28.250 30.430 44.570 1.00 0.00 ATOM 1404 H15R DPP 12 27.660 31.190 44.030 1.00 0.00 ATOM 1405 H15S DPP 12 27.750 29.430 44.610 1.00 0.00 ATOM 1406 6C21 DPP 12 29.620 30.380 43.900 1.00 0.00 ATOM 1407 H16R DPP 12 30.080 29.440 44.300 1.00 0.00 ATOM 1408 H16S DPP 12 30.320 31.190 44.200 1.00 0.00 ATOM 1409 H16T DPP 12 29.560 30.370 42.790 1.00 0.00 ATOM 1410 C33 DPP 12 27.060 26.870 55.010 1.00 0.00 ATOM 1411 H3X DPP 12 27.750 26.010 55.140 1.00 0.00 ATOM 1412 H3Y DPP 12 27.660 27.680 54.530 1.00 0.00 ATOM 1413 C34 DPP 12 26.000 26.330 54.040 1.00 0.00 ATOM 1414 H4X DPP 12 25.370 27.220 53.860 1.00 0.00 ATOM 1415 H4Y DPP 12 25.330 25.590 54.530 1.00 0.00 ATOM 1416 C35 DPP 12 26.650 25.670 52.820 1.00 0.00 ATOM 1417 H5X DPP 12 25.870 25.370 52.080 1.00 0.00 ATOM 1418 H5Y DPP 12 27.070 24.720 53.200 1.00 0.00 ATOM 1419 C36 DPP 12 27.620 26.590 52.070 1.00 0.00 ATOM 1420 H6X DPP 12 28.580 26.770 52.580 1.00 0.00 ATOM 1421 H6Y DPP 12 27.090 27.540 51.830 1.00 0.00 ATOM 1422 C37 DPP 12 28.130 25.910 50.800 1.00 0.00 ATOM 1423 H7X DPP 12 28.660 26.730 50.270 1.00 0.00 ATOM 1424 H7Y DPP 12 27.170 25.690 50.270 1.00 0.00 ATOM 1425 C38 DPP 12 28.790 24.560 51.060 1.00 0.00 ATOM 1426 H8X DPP 12 27.950 23.940 51.430 1.00 0.00 ATOM 1427 H8Y DPP 12 29.620 24.690 51.790 1.00 0.00 ATOM 1428 C39 DPP 12 29.280 23.770 49.850 1.00 0.00 ATOM 1429 H9X DPP 12 28.420 23.210 49.430 1.00 0.00 ATOM 1430 H9Y DPP 12 29.910 22.920 50.210 1.00 0.00 ATOM 1431 0C31 DPP 12 30.030 24.620 48.810 1.00 0.00 ATOM 1432 H10X DPP 12 30.930 25.010 49.330 1.00 0.00 ATOM 1433 H10Y DPP 12 29.500 25.480 48.350 1.00 0.00 ATOM 1434 1C31 DPP 12 30.520 23.800 47.620 1.00 0.00 ATOM 1435 H11X DPP 12 30.580 22.750 47.980 1.00 0.00 ATOM 1436 H11Y DPP 12 31.560 24.080 47.340 1.00 0.00 ATOM 1437 2C31 DPP 12 29.790 23.900 46.280 1.00 0.00 ATOM 1438 H12X DPP 12 28.680 23.840 46.290 1.00 0.00 ATOM 1439 H12Y DPP 12 30.030 23.150 45.500 1.00 0.00 ATOM 1440 3C31 DPP 12 30.070 25.190 45.520 1.00 0.00 ATOM 1441 H13X DPP 12 30.700 25.940 46.040 1.00 0.00 ATOM 1442 H13Y DPP 12 29.060 25.610 45.290 1.00 0.00 ATOM 1443 4C31 DPP 12 30.740 25.000 44.160 1.00 0.00 ATOM 1444 H14X DPP 12 30.160 24.140 43.780 1.00 0.00 ATOM 1445 H14Y DPP 12 31.820 24.740 44.190 1.00 0.00 ATOM 1446 5C31 DPP 12 30.510 26.130 43.160 1.00 0.00 ATOM 1447 H15X DPP 12 30.870 27.060 43.640 1.00 0.00 ATOM 1448 H15Y DPP 12 29.450 26.360 42.910 1.00 0.00 ATOM 1449 6C31 DPP 12 31.340 25.920 41.900 1.00 0.00 ATOM 1450 H16X DPP 12 31.350 26.900 41.370 1.00 0.00 ATOM 1451 H16Y DPP 12 30.800 25.170 41.270 1.00 0.00 ATOM 1452 H16Z DPP 12 32.400 25.620 42.070 1.00 0.00 ATOM 1453 N DPP 13 37.040 43.730 65.170 1.00 0.00 ATOM 1454 HN1 DPP 13 37.100 44.110 64.210 1.00 0.00 ATOM 1455 HN2 DPP 13 36.760 44.520 65.780 1.00 0.00 ATOM 1456 HN3 DPP 13 37.920 43.310 65.530 1.00 0.00 ATOM 1457 C12 DPP 13 36.060 42.600 65.380 1.00 0.00 ATOM 1458 H12A DPP 13 36.280 42.200 66.390 1.00 0.00 ATOM 1459 H12B DPP 13 36.290 41.770 64.670 1.00 0.00 ATOM 1460 C11 DPP 13 34.610 43.070 65.290 1.00 0.00 ATOM 1461 H11A DPP 13 34.410 43.680 66.200 1.00 0.00 ATOM 1462 H11B DPP 13 34.030 42.120 65.310 1.00 0.00 ATOM 1463 P DPP 13 33.080 43.560 63.320 1.00 0.00 ATOM 1464 O13 DPP 13 32.080 44.390 64.040 1.00 0.00 ATOM 1465 O14 DPP 13 32.850 42.100 63.260 1.00 0.00 ATOM 1466 O11 DPP 13 33.340 44.040 61.810 1.00 0.00 ATOM 1467 O12 DPP 13 34.460 43.820 64.080 1.00 0.00 ATOM 1468 C1 DPP 13 34.630 44.290 61.240 1.00 0.00 ATOM 1469 HA DPP 13 35.430 43.990 61.950 1.00 0.00 ATOM 1470 HB DPP 13 34.690 45.310 60.810 1.00 0.00 ATOM 1471 C2 DPP 13 34.830 43.400 60.000 1.00 0.00 ATOM 1472 HS DPP 13 35.890 43.580 59.710 1.00 0.00 ATOM 1473 O21 DPP 13 33.870 43.790 59.010 1.00 0.00 ATOM 1474 C21 DPP 13 34.350 43.580 57.790 1.00 0.00 ATOM 1475 O22 DPP 13 35.510 43.350 57.480 1.00 0.00 ATOM 1476 C22 DPP 13 33.280 43.550 56.700 1.00 0.00 ATOM 1477 H2R DPP 13 32.630 44.430 56.900 1.00 0.00 ATOM 1478 H2S DPP 13 32.780 42.560 56.780 1.00 0.00 ATOM 1479 C3 DPP 13 34.720 41.910 60.370 1.00 0.00 ATOM 1480 HX DPP 13 33.660 41.880 60.710 1.00 0.00 ATOM 1481 HY DPP 13 35.390 41.710 61.230 1.00 0.00 ATOM 1482 O31 DPP 13 35.010 41.060 59.260 1.00 0.00 ATOM 1483 C31 DPP 13 36.230 40.510 59.220 1.00 0.00 ATOM 1484 O32 DPP 13 37.090 40.790 60.040 1.00 0.00 ATOM 1485 C32 DPP 13 36.390 39.660 57.970 1.00 0.00 ATOM 1486 H2X DPP 13 35.530 39.860 57.310 1.00 0.00 ATOM 1487 H2Y DPP 13 36.380 38.590 58.250 1.00 0.00 ATOM 1488 C23 DPP 13 33.820 43.640 55.270 1.00 0.00 ATOM 1489 H3R DPP 13 32.870 43.450 54.730 1.00 0.00 ATOM 1490 H3S DPP 13 34.450 42.750 55.050 1.00 0.00 ATOM 1491 C24 DPP 13 34.370 44.980 54.780 1.00 0.00 ATOM 1492 H4R DPP 13 35.220 45.260 55.450 1.00 0.00 ATOM 1493 H4S DPP 13 33.640 45.810 54.910 1.00 0.00 ATOM 1494 C25 DPP 13 34.960 45.050 53.370 1.00 0.00 ATOM 1495 H5R DPP 13 35.990 44.630 53.370 1.00 0.00 ATOM 1496 H5S DPP 13 35.000 46.090 52.990 1.00 0.00 ATOM 1497 C26 DPP 13 34.070 44.360 52.340 1.00 0.00 ATOM 1498 H6R DPP 13 33.010 44.570 52.610 1.00 0.00 ATOM 1499 H6S DPP 13 34.220 43.260 52.250 1.00 0.00 ATOM 1500 C27 DPP 13 34.490 44.720 50.910 1.00 0.00 ATOM 1501 H7R DPP 13 35.590 44.600 50.940 1.00 0.00 ATOM 1502 H7S DPP 13 34.220 45.790 50.830 1.00 0.00 ATOM 1503 C28 DPP 13 33.730 43.820 49.930 1.00 0.00 ATOM 1504 H8R DPP 13 32.660 43.690 50.170 1.00 0.00 ATOM 1505 H8S DPP 13 34.050 42.760 50.060 1.00 0.00 ATOM 1506 C29 DPP 13 34.050 44.070 48.460 1.00 0.00 ATOM 1507 H9R DPP 13 33.820 45.130 48.240 1.00 0.00 ATOM 1508 H9S DPP 13 33.480 43.450 47.730 1.00 0.00 ATOM 1509 0C21 DPP 13 35.540 43.780 48.290 1.00 0.00 ATOM 1510 H10R DPP 13 35.790 42.770 48.670 1.00 0.00 ATOM 1511 H10S DPP 13 36.200 44.490 48.840 1.00 0.00 ATOM 1512 1C21 DPP 13 35.790 43.810 46.780 1.00 0.00 ATOM 1513 H11R DPP 13 35.720 44.880 46.510 1.00 0.00 ATOM 1514 H11S DPP 13 35.040 43.240 46.200 1.00 0.00 ATOM 1515 2C21 DPP 13 37.160 43.210 46.440 1.00 0.00 ATOM 1516 H12R DPP 13 37.420 42.290 47.010 1.00 0.00 ATOM 1517 H12S DPP 13 37.900 43.960 46.790 1.00 0.00 ATOM 1518 3C21 DPP 13 37.240 42.810 44.960 1.00 0.00 ATOM 1519 H13R DPP 13 37.240 43.730 44.330 1.00 0.00 ATOM 1520 H13S DPP 13 36.280 42.330 44.660 1.00 0.00 ATOM 1521 4C21 DPP 13 38.460 41.960 44.610 1.00 0.00 ATOM 1522 H14R DPP 13 38.240 41.040 45.200 1.00 0.00 ATOM 1523 H14S DPP 13 39.310 42.480 45.100 1.00 0.00 ATOM 1524 5C21 DPP 13 38.590 41.670 43.110 1.00 0.00 ATOM 1525 H15R DPP 13 39.520 41.090 42.910 1.00 0.00 ATOM 1526 H15S DPP 13 38.770 42.640 42.590 1.00 0.00 ATOM 1527 6C21 DPP 13 37.550 40.950 42.270 1.00 0.00 ATOM 1528 H16R DPP 13 37.930 40.710 41.250 1.00 0.00 ATOM 1529 H16S DPP 13 36.640 41.590 42.180 1.00 0.00 ATOM 1530 H16T DPP 13 37.180 40.030 42.780 1.00 0.00 ATOM 1531 C33 DPP 13 37.640 40.100 57.200 1.00 0.00 ATOM 1532 H3X DPP 13 38.530 39.850 57.810 1.00 0.00 ATOM 1533 H3Y DPP 13 37.630 41.190 56.960 1.00 0.00 ATOM 1534 C34 DPP 13 37.690 39.410 55.840 1.00 0.00 ATOM 1535 H4X DPP 13 37.320 38.360 55.920 1.00 0.00 ATOM 1536 H4Y DPP 13 38.770 39.350 55.590 1.00 0.00 ATOM 1537 C35 DPP 13 36.840 40.080 54.760 1.00 0.00 ATOM 1538 H5X DPP 13 36.870 41.180 54.870 1.00 0.00 ATOM 1539 H5Y DPP 13 35.770 39.820 54.870 1.00 0.00 ATOM 1540 C36 DPP 13 37.250 39.540 53.380 1.00 0.00 ATOM 1541 H6X DPP 13 38.340 39.680 53.220 1.00 0.00 ATOM 1542 H6Y DPP 13 36.780 40.160 52.580 1.00 0.00 ATOM 1543 C37 DPP 13 36.760 38.100 53.220 1.00 0.00 ATOM 1544 H7X DPP 13 35.670 37.980 53.390 1.00 0.00 ATOM 1545 H7Y DPP 13 37.210 37.370 53.920 1.00 0.00 ATOM 1546 C38 DPP 13 37.000 37.700 51.760 1.00 0.00 ATOM 1547 H8X DPP 13 38.030 37.850 51.380 1.00 0.00 ATOM 1548 H8Y DPP 13 36.350 38.360 51.130 1.00 0.00 ATOM 1549 C39 DPP 13 36.440 36.370 51.250 1.00 0.00 ATOM 1550 H9X DPP 13 35.370 36.290 51.510 1.00 0.00 ATOM 1551 H9Y DPP 13 36.990 35.580 51.800 1.00 0.00 ATOM 1552 0C31 DPP 13 36.500 36.110 49.740 1.00 0.00 ATOM 1553 H10X DPP 13 36.140 35.070 49.660 1.00 0.00 ATOM 1554 H10Y DPP 13 37.560 36.030 49.430 1.00 0.00 ATOM 1555 1C31 DPP 13 35.630 37.000 48.840 1.00 0.00 ATOM 1556 H11X DPP 13 35.800 38.070 49.120 1.00 0.00 ATOM 1557 H11Y DPP 13 34.580 36.780 49.100 1.00 0.00 ATOM 1558 2C31 DPP 13 36.070 36.750 47.400 1.00 0.00 ATOM 1559 H12X DPP 13 35.930 35.660 47.310 1.00 0.00 ATOM 1560 H12Y DPP 13 37.160 36.930 47.280 1.00 0.00 ATOM 1561 3C31 DPP 13 35.240 37.400 46.290 1.00 0.00 ATOM 1562 H13X DPP 13 34.320 37.850 46.710 1.00 0.00 ATOM 1563 H13Y DPP 13 34.810 36.620 45.630 1.00 0.00 ATOM 1564 4C31 DPP 13 36.100 38.450 45.560 1.00 0.00 ATOM 1565 H14X DPP 13 36.860 37.990 44.900 1.00 0.00 ATOM 1566 H14Y DPP 13 36.630 39.040 46.330 1.00 0.00 ATOM 1567 5C31 DPP 13 35.210 39.440 44.820 1.00 0.00 ATOM 1568 H15X DPP 13 35.820 40.240 44.330 1.00 0.00 ATOM 1569 H15Y DPP 13 34.580 40.000 45.540 1.00 0.00 ATOM 1570 6C31 DPP 13 34.380 38.780 43.720 1.00 0.00 ATOM 1571 H16X DPP 13 34.170 39.480 42.880 1.00 0.00 ATOM 1572 H16Y DPP 13 33.390 38.370 44.010 1.00 0.00 ATOM 1573 H16Z DPP 13 35.010 37.910 43.450 1.00 0.00 ATOM 1574 N DPP 14 51.070 17.600 58.490 1.00 0.00 ATOM 1575 HN1 DPP 14 51.290 17.340 59.480 1.00 0.00 ATOM 1576 HN2 DPP 14 51.220 16.890 57.740 1.00 0.00 ATOM 1577 HN3 DPP 14 51.730 18.390 58.320 1.00 0.00 ATOM 1578 C12 DPP 14 49.690 18.200 58.400 1.00 0.00 ATOM 1579 H12A DPP 14 49.760 18.840 57.490 1.00 0.00 ATOM 1580 H12B DPP 14 49.460 18.910 59.220 1.00 0.00 ATOM 1581 C11 DPP 14 48.680 17.070 58.210 1.00 0.00 ATOM 1582 H11A DPP 14 48.860 16.700 57.180 1.00 0.00 ATOM 1583 H11B DPP 14 47.640 17.450 58.290 1.00 0.00 ATOM 1584 P DPP 14 47.490 15.440 59.740 1.00 0.00 ATOM 1585 O13 DPP 14 46.710 16.350 60.610 1.00 0.00 ATOM 1586 O14 DPP 14 47.860 14.110 60.280 1.00 0.00 ATOM 1587 O11 DPP 14 46.720 15.260 58.350 1.00 0.00 ATOM 1588 O12 DPP 14 48.840 16.190 59.320 1.00 0.00 ATOM 1589 C1 DPP 14 45.980 14.040 58.220 1.00 0.00 ATOM 1590 HA DPP 14 45.080 14.300 57.620 1.00 0.00 ATOM 1591 HB DPP 14 45.560 13.670 59.180 1.00 0.00 ATOM 1592 C2 DPP 14 46.890 13.090 57.410 1.00 0.00 ATOM 1593 HS DPP 14 47.670 12.790 58.140 1.00 0.00 ATOM 1594 O21 DPP 14 47.470 13.750 56.280 1.00 0.00 ATOM 1595 C21 DPP 14 48.560 13.180 55.770 1.00 0.00 ATOM 1596 O22 DPP 14 49.180 12.310 56.370 1.00 0.00 ATOM 1597 C22 DPP 14 48.970 13.870 54.480 1.00 0.00 ATOM 1598 H2R DPP 14 49.640 14.740 54.670 1.00 0.00 ATOM 1599 H2S DPP 14 48.060 14.200 53.930 1.00 0.00 ATOM 1600 C3 DPP 14 46.120 11.850 56.910 1.00 0.00 ATOM 1601 HX DPP 14 46.040 11.310 57.880 1.00 0.00 ATOM 1602 HY DPP 14 46.820 11.210 56.330 1.00 0.00 ATOM 1603 O31 DPP 14 44.910 12.160 56.220 1.00 0.00 ATOM 1604 C31 DPP 14 45.020 12.290 54.890 1.00 0.00 ATOM 1605 O32 DPP 14 46.090 12.380 54.310 1.00 0.00 ATOM 1606 C32 DPP 14 43.650 12.300 54.230 1.00 0.00 ATOM 1607 H2X DPP 14 43.090 12.980 54.910 1.00 0.00 ATOM 1608 H2Y DPP 14 43.210 11.290 54.360 1.00 0.00 ATOM 1609 C23 DPP 14 49.700 12.970 53.480 1.00 0.00 ATOM 1610 H3R DPP 14 50.590 12.580 54.010 1.00 0.00 ATOM 1611 H3S DPP 14 50.120 13.640 52.700 1.00 0.00 ATOM 1612 C24 DPP 14 48.990 11.760 52.860 1.00 0.00 ATOM 1613 H4R DPP 14 47.970 12.170 52.730 1.00 0.00 ATOM 1614 H4S DPP 14 48.990 10.940 53.610 1.00 0.00 ATOM 1615 C25 DPP 14 49.570 11.350 51.510 1.00 0.00 ATOM 1616 H5R DPP 14 50.610 11.020 51.730 1.00 0.00 ATOM 1617 H5S DPP 14 49.610 12.310 50.960 1.00 0.00 ATOM 1618 C26 DPP 14 48.900 10.230 50.710 1.00 0.00 ATOM 1619 H6R DPP 14 48.630 9.390 51.380 1.00 0.00 ATOM 1620 H6S DPP 14 49.770 9.920 50.100 1.00 0.00 ATOM 1621 C27 DPP 14 47.620 10.730 50.020 1.00 0.00 ATOM 1622 H7R DPP 14 46.890 10.940 50.820 1.00 0.00 ATOM 1623 H7S DPP 14 47.380 9.850 49.390 1.00 0.00 ATOM 1624 C28 DPP 14 47.820 11.990 49.180 1.00 0.00 ATOM 1625 H8R DPP 14 48.690 11.920 48.500 1.00 0.00 ATOM 1626 H8S DPP 14 47.970 12.870 49.840 1.00 0.00 ATOM 1627 C29 DPP 14 46.770 12.350 48.120 1.00 0.00 ATOM 1628 H9R DPP 14 45.770 12.400 48.590 1.00 0.00 ATOM 1629 H9S DPP 14 46.670 11.550 47.350 1.00 0.00 ATOM 1630 0C21 DPP 14 47.040 13.610 47.290 1.00 0.00 ATOM 1631 H10R DPP 14 47.820 13.420 46.520 1.00 0.00 ATOM 1632 H10S DPP 14 47.480 14.400 47.930 1.00 0.00 ATOM 1633 1C21 DPP 14 45.760 14.080 46.580 1.00 0.00 ATOM 1634 H11R DPP 14 46.140 14.910 45.950 1.00 0.00 ATOM 1635 H11S DPP 14 45.090 14.450 47.390 1.00 0.00 ATOM 1636 2C21 DPP 14 45.080 13.070 45.660 1.00 0.00 ATOM 1637 H12R DPP 14 44.130 13.410 45.190 1.00 0.00 ATOM 1638 H12S DPP 14 44.820 12.190 46.290 1.00 0.00 ATOM 1639 3C21 DPP 14 45.960 12.480 44.560 1.00 0.00 ATOM 1640 H13R DPP 14 46.920 12.120 44.990 1.00 0.00 ATOM 1641 H13S DPP 14 46.270 13.340 43.930 1.00 0.00 ATOM 1642 4C21 DPP 14 45.310 11.390 43.690 1.00 0.00 ATOM 1643 H14R DPP 14 44.350 11.830 43.330 1.00 0.00 ATOM 1644 H14S DPP 14 45.050 10.540 44.360 1.00 0.00 ATOM 1645 5C21 DPP 14 46.100 10.910 42.480 1.00 0.00 ATOM 1646 H15R DPP 14 47.040 10.350 42.700 1.00 0.00 ATOM 1647 H15S DPP 14 46.520 11.700 41.820 1.00 0.00 ATOM 1648 6C21 DPP 14 45.210 10.020 41.600 1.00 0.00 ATOM 1649 H16R DPP 14 45.650 9.850 40.590 1.00 0.00 ATOM 1650 H16S DPP 14 44.160 10.350 41.470 1.00 0.00 ATOM 1651 H16T DPP 14 45.280 9.020 42.090 1.00 0.00 ATOM 1652 C33 DPP 14 43.720 12.810 52.790 1.00 0.00 ATOM 1653 H3X DPP 14 44.490 12.200 52.280 1.00 0.00 ATOM 1654 H3Y DPP 14 44.270 13.770 52.760 1.00 0.00 ATOM 1655 C34 DPP 14 42.370 12.650 52.080 1.00 0.00 ATOM 1656 H4X DPP 14 41.630 13.410 52.420 1.00 0.00 ATOM 1657 H4Y DPP 14 41.940 11.670 52.380 1.00 0.00 ATOM 1658 C35 DPP 14 42.600 12.980 50.600 1.00 0.00 ATOM 1659 H5X DPP 14 43.590 12.590 50.300 1.00 0.00 ATOM 1660 H5Y DPP 14 42.690 14.090 50.550 1.00 0.00 ATOM 1661 C36 DPP 14 41.340 12.600 49.830 1.00 0.00 ATOM 1662 H6X DPP 14 40.550 13.010 50.500 1.00 0.00 ATOM 1663 H6Y DPP 14 41.300 11.490 49.760 1.00 0.00 ATOM 1664 C37 DPP 14 41.190 13.150 48.410 1.00 0.00 ATOM 1665 H7X DPP 14 42.150 13.080 47.860 1.00 0.00 ATOM 1666 H7Y DPP 14 40.910 14.220 48.490 1.00 0.00 ATOM 1667 C38 DPP 14 39.990 12.810 47.530 1.00 0.00 ATOM 1668 H8X DPP 14 39.100 13.000 48.160 1.00 0.00 ATOM 1669 H8Y DPP 14 40.070 11.700 47.420 1.00 0.00 ATOM 1670 C39 DPP 14 39.880 13.670 46.270 1.00 0.00 ATOM 1671 H9X DPP 14 39.600 14.720 46.470 1.00 0.00 ATOM 1672 H9Y DPP 14 38.990 13.250 45.750 1.00 0.00 ATOM 1673 0C31 DPP 14 41.170 13.620 45.440 1.00 0.00 ATOM 1674 H10X DPP 14 41.370 12.640 44.950 1.00 0.00 ATOM 1675 H10Y DPP 14 42.050 13.850 46.070 1.00 0.00 ATOM 1676 1C31 DPP 14 41.250 14.670 44.330 1.00 0.00 ATOM 1677 H11X DPP 14 40.450 14.510 43.570 1.00 0.00 ATOM 1678 H11Y DPP 14 42.230 14.640 43.810 1.00 0.00 ATOM 1679 2C31 DPP 14 41.160 16.120 44.800 1.00 0.00 ATOM 1680 H12X DPP 14 40.100 16.330 45.080 1.00 0.00 ATOM 1681 H12Y DPP 14 41.390 16.670 43.860 1.00 0.00 ATOM 1682 3C31 DPP 14 42.070 16.450 45.980 1.00 0.00 ATOM 1683 H13X DPP 14 43.110 16.150 45.720 1.00 0.00 ATOM 1684 H13Y DPP 14 41.640 15.900 46.840 1.00 0.00 ATOM 1685 4C31 DPP 14 42.000 17.890 46.490 1.00 0.00 ATOM 1686 H14X DPP 14 40.920 18.160 46.550 1.00 0.00 ATOM 1687 H14Y DPP 14 42.390 18.550 45.680 1.00 0.00 ATOM 1688 5C31 DPP 14 42.830 18.230 47.730 1.00 0.00 ATOM 1689 H15X DPP 14 42.710 19.330 47.820 1.00 0.00 ATOM 1690 H15Y DPP 14 43.910 17.990 47.650 1.00 0.00 ATOM 1691 6C31 DPP 14 42.240 17.470 48.930 1.00 0.00 ATOM 1692 H16X DPP 14 42.760 17.670 49.890 1.00 0.00 ATOM 1693 H16Y DPP 14 42.190 16.370 48.750 1.00 0.00 ATOM 1694 H16Z DPP 14 41.180 17.760 49.080 1.00 0.00 ATOM 1695 N DPP 15 32.470 9.190 58.620 1.00 0.00 ATOM 1696 HN1 DPP 15 31.930 10.060 58.830 1.00 0.00 ATOM 1697 HN2 DPP 15 32.220 8.500 59.360 1.00 0.00 ATOM 1698 HN3 DPP 15 33.450 9.490 58.770 1.00 0.00 ATOM 1699 C12 DPP 15 32.320 8.530 57.270 1.00 0.00 ATOM 1700 H12A DPP 15 31.270 8.220 57.090 1.00 0.00 ATOM 1701 H12B DPP 15 32.560 9.250 56.460 1.00 0.00 ATOM 1702 C11 DPP 15 33.180 7.280 57.060 1.00 0.00 ATOM 1703 H11A DPP 15 32.930 6.920 56.040 1.00 0.00 ATOM 1704 H11B DPP 15 32.840 6.480 57.750 1.00 0.00 ATOM 1705 P DPP 15 35.600 6.540 57.560 1.00 0.00 ATOM 1706 O13 DPP 15 35.120 5.870 58.790 1.00 0.00 ATOM 1707 O14 DPP 15 36.940 7.160 57.670 1.00 0.00 ATOM 1708 O11 DPP 15 35.460 5.600 56.270 1.00 0.00 ATOM 1709 O12 DPP 15 34.560 7.660 57.130 1.00 0.00 ATOM 1710 C1 DPP 15 36.240 4.410 56.340 1.00 0.00 ATOM 1711 HA DPP 15 35.580 3.720 55.780 1.00 0.00 ATOM 1712 HB DPP 15 36.360 4.110 57.410 1.00 0.00 ATOM 1713 C2 DPP 15 37.570 4.550 55.590 1.00 0.00 ATOM 1714 HS DPP 15 38.160 5.160 56.310 1.00 0.00 ATOM 1715 O21 DPP 15 37.300 5.210 54.350 1.00 0.00 ATOM 1716 C21 DPP 15 38.210 6.110 53.970 1.00 0.00 ATOM 1717 O22 DPP 15 39.290 6.360 54.470 1.00 0.00 ATOM 1718 C22 DPP 15 37.700 6.910 52.770 1.00 0.00 ATOM 1719 H2R DPP 15 38.400 7.700 52.410 1.00 0.00 ATOM 1720 H2S DPP 15 36.690 7.330 52.970 1.00 0.00 ATOM 1721 C3 DPP 15 38.240 3.170 55.440 1.00 0.00 ATOM 1722 HX DPP 15 39.240 3.350 54.990 1.00 0.00 ATOM 1723 HY DPP 15 37.570 2.640 54.730 1.00 0.00 ATOM 1724 O31 DPP 15 38.330 2.430 56.660 1.00 0.00 ATOM 1725 C31 DPP 15 39.250 2.810 57.540 1.00 0.00 ATOM 1726 O32 DPP 15 40.000 3.750 57.340 1.00 0.00 ATOM 1727 C32 DPP 15 39.210 1.920 58.780 1.00 0.00 ATOM 1728 H2X DPP 15 38.300 1.930 59.420 1.00 0.00 ATOM 1729 H2Y DPP 15 39.870 2.350 59.560 1.00 0.00 ATOM 1730 C23 DPP 15 37.620 5.920 51.610 1.00 0.00 ATOM 1731 H3R DPP 15 36.810 5.180 51.780 1.00 0.00 ATOM 1732 H3S DPP 15 38.630 5.470 51.530 1.00 0.00 ATOM 1733 C24 DPP 15 37.350 6.550 50.240 1.00 0.00 ATOM 1734 H4R DPP 15 38.200 7.160 49.860 1.00 0.00 ATOM 1735 H4S DPP 15 36.440 7.170 50.380 1.00 0.00 ATOM 1736 C25 DPP 15 37.070 5.640 49.040 1.00 0.00 ATOM 1737 H5R DPP 15 36.790 6.200 48.130 1.00 0.00 ATOM 1738 H5S DPP 15 36.170 5.000 49.160 1.00 0.00 ATOM 1739 C26 DPP 15 38.260 4.700 48.820 1.00 0.00 ATOM 1740 H6R DPP 15 37.720 3.840 48.380 1.00 0.00 ATOM 1741 H6S DPP 15 38.870 4.330 49.670 1.00 0.00 ATOM 1742 C27 DPP 15 39.300 5.420 47.950 1.00 0.00 ATOM 1743 H7R DPP 15 40.270 4.890 47.880 1.00 0.00 ATOM 1744 H7S DPP 15 39.600 6.340 48.510 1.00 0.00 ATOM 1745 C28 DPP 15 38.970 5.860 46.520 1.00 0.00 ATOM 1746 H8R DPP 15 39.760 6.550 46.160 1.00 0.00 ATOM 1747 H8S DPP 15 37.960 6.330 46.460 1.00 0.00 ATOM 1748 C29 DPP 15 38.780 4.640 45.610 1.00 0.00 ATOM 1749 H9R DPP 15 38.380 4.940 44.620 1.00 0.00 ATOM 1750 H9S DPP 15 38.110 3.910 46.100 1.00 0.00 ATOM 1751 0C21 DPP 15 40.000 3.800 45.220 1.00 0.00 ATOM 1752 H10R DPP 15 39.770 2.910 44.600 1.00 0.00 ATOM 1753 H10S DPP 15 40.220 3.350 46.220 1.00 0.00 ATOM 1754 1C21 DPP 15 41.220 4.530 44.660 1.00 0.00 ATOM 1755 H11R DPP 15 41.970 3.760 44.390 1.00 0.00 ATOM 1756 H11S DPP 15 41.670 5.230 45.400 1.00 0.00 ATOM 1757 2C21 DPP 15 40.910 5.170 43.310 1.00 0.00 ATOM 1758 H12R DPP 15 40.220 6.020 43.500 1.00 0.00 ATOM 1759 H12S DPP 15 40.400 4.440 42.640 1.00 0.00 ATOM 1760 3C21 DPP 15 42.170 5.670 42.610 1.00 0.00 ATOM 1761 H13R DPP 15 43.040 4.970 42.580 1.00 0.00 ATOM 1762 H13S DPP 15 42.320 6.620 43.160 1.00 0.00 ATOM 1763 4C21 DPP 15 41.920 6.120 41.170 1.00 0.00 ATOM 1764 H14R DPP 15 40.890 6.540 41.160 1.00 0.00 ATOM 1765 H14S DPP 15 41.940 5.300 40.430 1.00 0.00 ATOM 1766 5C21 DPP 15 43.030 7.020 40.610 1.00 0.00 ATOM 1767 H15R DPP 15 43.890 6.360 40.380 1.00 0.00 ATOM 1768 H15S DPP 15 43.370 7.650 41.460 1.00 0.00 ATOM 1769 6C21 DPP 15 42.640 7.830 39.370 1.00 0.00 ATOM 1770 H16R DPP 15 42.020 7.210 38.680 1.00 0.00 ATOM 1771 H16S DPP 15 43.540 8.040 38.750 1.00 0.00 ATOM 1772 H16T DPP 15 42.110 8.730 39.740 1.00 0.00 ATOM 1773 C33 DPP 15 39.590 0.470 58.470 1.00 0.00 ATOM 1774 H3X DPP 15 40.120 -0.040 59.300 1.00 0.00 ATOM 1775 H3Y DPP 15 40.330 0.430 57.650 1.00 0.00 ATOM 1776 C34 DPP 15 38.420 -0.470 58.170 1.00 0.00 ATOM 1777 H4X DPP 15 37.570 0.170 57.830 1.00 0.00 ATOM 1778 H4Y DPP 15 38.080 -0.980 59.090 1.00 0.00 ATOM 1779 C35 DPP 15 38.800 -1.550 57.160 1.00 0.00 ATOM 1780 H5X DPP 15 38.220 -2.500 57.160 1.00 0.00 ATOM 1781 H5Y DPP 15 39.860 -1.830 57.380 1.00 0.00 ATOM 1782 C36 DPP 15 38.780 -0.980 55.740 1.00 0.00 ATOM 1783 H6X DPP 15 39.400 -0.080 55.560 1.00 0.00 ATOM 1784 H6Y DPP 15 37.720 -0.740 55.500 1.00 0.00 ATOM 1785 C37 DPP 15 39.090 -2.000 54.650 1.00 0.00 ATOM 1786 H7X DPP 15 38.550 -1.710 53.720 1.00 0.00 ATOM 1787 H7Y DPP 15 38.750 -2.990 55.020 1.00 0.00 ATOM 1788 C38 DPP 15 40.600 -1.980 54.370 1.00 0.00 ATOM 1789 H8X DPP 15 41.190 -2.540 55.120 1.00 0.00 ATOM 1790 H8Y DPP 15 40.880 -0.910 54.390 1.00 0.00 ATOM 1791 C39 DPP 15 40.750 -2.680 53.020 1.00 0.00 ATOM 1792 H9X DPP 15 41.840 -2.770 52.800 1.00 0.00 ATOM 1793 H9Y DPP 15 40.140 -2.310 52.170 1.00 0.00 ATOM 1794 0C31 DPP 15 40.250 -4.120 52.910 1.00 0.00 ATOM 1795 H10X DPP 15 39.150 -4.060 52.910 1.00 0.00 ATOM 1796 H10Y DPP 15 40.600 -4.820 53.700 1.00 0.00 ATOM 1797 1C31 DPP 15 40.610 -4.830 51.600 1.00 0.00 ATOM 1798 H11X DPP 15 40.470 -4.160 50.720 1.00 0.00 ATOM 1799 H11Y DPP 15 39.950 -5.710 51.450 1.00 0.00 ATOM 1800 2C31 DPP 15 42.090 -5.180 51.490 1.00 0.00 ATOM 1801 H12X DPP 15 42.450 -5.500 52.490 1.00 0.00 ATOM 1802 H12Y DPP 15 42.750 -4.340 51.190 1.00 0.00 ATOM 1803 3C31 DPP 15 42.430 -6.210 50.400 1.00 0.00 ATOM 1804 H13X DPP 15 42.050 -7.240 50.560 1.00 0.00 ATOM 1805 H13Y DPP 15 43.540 -6.260 50.440 1.00 0.00 ATOM 1806 4C31 DPP 15 41.980 -5.780 49.000 1.00 0.00 ATOM 1807 H14X DPP 15 41.880 -4.680 48.910 1.00 0.00 ATOM 1808 H14Y DPP 15 41.000 -6.260 48.790 1.00 0.00 ATOM 1809 5C31 DPP 15 43.020 -6.170 47.950 1.00 0.00 ATOM 1810 H15X DPP 15 42.510 -6.140 46.960 1.00 0.00 ATOM 1811 H15Y DPP 15 43.430 -7.170 48.220 1.00 0.00 ATOM 1812 6C31 DPP 15 44.190 -5.200 47.800 1.00 0.00 ATOM 1813 H16X DPP 15 44.400 -4.830 48.830 1.00 0.00 ATOM 1814 H16Y DPP 15 45.050 -5.750 47.380 1.00 0.00 ATOM 1815 H16Z DPP 15 43.910 -4.410 47.060 1.00 0.00 ATOM 1816 N DPP 16 21.590 56.860 63.490 1.00 0.00 ATOM 1817 HN1 DPP 16 21.580 57.070 62.470 1.00 0.00 ATOM 1818 HN2 DPP 16 20.660 56.430 63.690 1.00 0.00 ATOM 1819 HN3 DPP 16 21.610 57.760 64.010 1.00 0.00 ATOM 1820 C12 DPP 16 22.710 55.950 63.930 1.00 0.00 ATOM 1821 H12A DPP 16 22.580 54.990 63.390 1.00 0.00 ATOM 1822 H12B DPP 16 22.650 55.710 65.010 1.00 0.00 ATOM 1823 C11 DPP 16 24.120 56.450 63.630 1.00 0.00 ATOM 1824 H11A DPP 16 24.840 55.620 63.780 1.00 0.00 ATOM 1825 H11B DPP 16 24.360 57.360 64.230 1.00 0.00 ATOM 1826 P DPP 16 25.550 57.490 61.850 1.00 0.00 ATOM 1827 O13 DPP 16 26.470 56.340 61.680 1.00 0.00 ATOM 1828 O14 DPP 16 25.860 58.490 62.890 1.00 0.00 ATOM 1829 O11 DPP 16 25.350 58.140 60.400 1.00 0.00 ATOM 1830 O12 DPP 16 24.120 56.910 62.280 1.00 0.00 ATOM 1831 C1 DPP 16 24.630 59.370 60.360 1.00 0.00 ATOM 1832 HA DPP 16 25.000 59.930 59.470 1.00 0.00 ATOM 1833 HB DPP 16 24.810 59.960 61.290 1.00 0.00 ATOM 1834 C2 DPP 16 23.110 59.220 60.180 1.00 0.00 ATOM 1835 HS DPP 16 22.890 59.030 61.250 1.00 0.00 ATOM 1836 O21 DPP 16 22.880 58.210 59.190 1.00 0.00 ATOM 1837 C21 DPP 16 22.030 57.310 59.700 1.00 0.00 ATOM 1838 O22 DPP 16 21.800 57.250 60.890 1.00 0.00 ATOM 1839 C22 DPP 16 21.470 56.340 58.670 1.00 0.00 ATOM 1840 H2R DPP 16 21.120 55.470 59.270 1.00 0.00 ATOM 1841 H2S DPP 16 22.170 55.990 57.890 1.00 0.00 ATOM 1842 C3 DPP 16 22.520 60.600 59.890 1.00 0.00 ATOM 1843 HX DPP 16 22.930 61.260 60.690 1.00 0.00 ATOM 1844 HY DPP 16 21.410 60.570 60.020 1.00 0.00 ATOM 1845 O31 DPP 16 22.950 61.170 58.650 1.00 0.00 ATOM 1846 C31 DPP 16 22.030 61.010 57.690 1.00 0.00 ATOM 1847 O32 DPP 16 20.890 60.620 57.870 1.00 0.00 ATOM 1848 C32 DPP 16 22.590 61.430 56.340 1.00 0.00 ATOM 1849 H2X DPP 16 23.550 60.910 56.150 1.00 0.00 ATOM 1850 H2Y DPP 16 22.820 62.510 56.300 1.00 0.00 ATOM 1851 C23 DPP 16 20.270 57.080 58.060 1.00 0.00 ATOM 1852 H3R DPP 16 20.600 57.940 57.440 1.00 0.00 ATOM 1853 H3S DPP 16 19.620 57.520 58.840 1.00 0.00 ATOM 1854 C24 DPP 16 19.460 56.160 57.150 1.00 0.00 ATOM 1855 H4R DPP 16 18.580 56.790 56.880 1.00 0.00 ATOM 1856 H4S DPP 16 19.260 55.200 57.690 1.00 0.00 ATOM 1857 C25 DPP 16 20.170 55.710 55.870 1.00 0.00 ATOM 1858 H5R DPP 16 19.630 54.880 55.370 1.00 0.00 ATOM 1859 H5S DPP 16 21.170 55.300 56.130 1.00 0.00 ATOM 1860 C26 DPP 16 20.430 56.790 54.820 1.00 0.00 ATOM 1861 H6R DPP 16 20.530 57.740 55.390 1.00 0.00 ATOM 1862 H6S DPP 16 19.480 56.850 54.250 1.00 0.00 ATOM 1863 C27 DPP 16 21.670 56.580 53.950 1.00 0.00 ATOM 1864 H7R DPP 16 21.440 57.030 52.960 1.00 0.00 ATOM 1865 H7S DPP 16 21.870 55.490 53.800 1.00 0.00 ATOM 1866 C28 DPP 16 22.890 57.160 54.650 1.00 0.00 ATOM 1867 H8R DPP 16 23.150 56.610 55.580 1.00 0.00 ATOM 1868 H8S DPP 16 22.760 58.210 55.010 1.00 0.00 ATOM 1869 C29 DPP 16 24.090 57.000 53.710 1.00 0.00 ATOM 1870 H9R DPP 16 23.770 57.310 52.690 1.00 0.00 ATOM 1871 H9S DPP 16 24.420 55.940 53.720 1.00 0.00 ATOM 1872 0C21 DPP 16 25.230 57.910 54.160 1.00 0.00 ATOM 1873 H10R DPP 16 25.710 57.560 55.100 1.00 0.00 ATOM 1874 H10S DPP 16 24.700 58.790 54.580 1.00 0.00 ATOM 1875 1C21 DPP 16 26.200 58.280 53.030 1.00 0.00 ATOM 1876 H11R DPP 16 26.690 59.220 53.370 1.00 0.00 ATOM 1877 H11S DPP 16 25.530 58.500 52.170 1.00 0.00 ATOM 1878 2C21 DPP 16 27.310 57.250 52.810 1.00 0.00 ATOM 1879 H12R DPP 16 26.770 56.280 52.800 1.00 0.00 ATOM 1880 H12S DPP 16 27.970 57.320 53.710 1.00 0.00 ATOM 1881 3C21 DPP 16 27.970 57.310 51.440 1.00 0.00 ATOM 1882 H13R DPP 16 28.430 56.310 51.320 1.00 0.00 ATOM 1883 H13S DPP 16 28.730 58.130 51.380 1.00 0.00 ATOM 1884 4C21 DPP 16 26.930 57.320 50.320 1.00 0.00 ATOM 1885 H14R DPP 16 26.660 58.380 50.100 1.00 0.00 ATOM 1886 H14S DPP 16 26.110 56.580 50.420 1.00 0.00 ATOM 1887 5C21 DPP 16 27.430 56.900 48.940 1.00 0.00 ATOM 1888 H15R DPP 16 26.580 57.050 48.240 1.00 0.00 ATOM 1889 H15S DPP 16 27.700 55.820 48.970 1.00 0.00 ATOM 1890 6C21 DPP 16 28.570 57.640 48.250 1.00 0.00 ATOM 1891 H16R DPP 16 28.760 57.170 47.260 1.00 0.00 ATOM 1892 H16S DPP 16 29.490 57.630 48.870 1.00 0.00 ATOM 1893 H16T DPP 16 28.230 58.690 48.090 1.00 0.00 ATOM 1894 C33 DPP 16 21.590 61.170 55.210 1.00 0.00 ATOM 1895 H3X DPP 16 20.760 61.890 55.380 1.00 0.00 ATOM 1896 H3Y DPP 16 21.120 60.170 55.320 1.00 0.00 ATOM 1897 C34 DPP 16 22.180 61.300 53.810 1.00 0.00 ATOM 1898 H4X DPP 16 22.760 60.370 53.640 1.00 0.00 ATOM 1899 H4Y DPP 16 22.680 62.270 53.610 1.00 0.00 ATOM 1900 C35 DPP 16 21.010 61.220 52.830 1.00 0.00 ATOM 1901 H5X DPP 16 20.240 61.940 53.190 1.00 0.00 ATOM 1902 H5Y DPP 16 20.430 60.270 52.910 1.00 0.00 ATOM 1903 C36 DPP 16 21.440 61.660 51.430 1.00 0.00 ATOM 1904 H6X DPP 16 22.360 61.100 51.180 1.00 0.00 ATOM 1905 H6Y DPP 16 21.690 62.740 51.320 1.00 0.00 ATOM 1906 C37 DPP 16 20.290 61.280 50.490 1.00 0.00 ATOM 1907 H7X DPP 16 19.980 62.250 50.060 1.00 0.00 ATOM 1908 H7Y DPP 16 19.370 60.970 51.040 1.00 0.00 ATOM 1909 C38 DPP 16 20.710 60.280 49.410 1.00 0.00 ATOM 1910 H8X DPP 16 21.630 60.580 48.850 1.00 0.00 ATOM 1911 H8Y DPP 16 19.950 60.150 48.620 1.00 0.00 ATOM 1912 C39 DPP 16 20.780 58.860 49.970 1.00 0.00 ATOM 1913 H9X DPP 16 19.780 58.390 50.070 1.00 0.00 ATOM 1914 H9Y DPP 16 21.280 58.780 50.960 1.00 0.00 ATOM 1915 0C31 DPP 16 21.620 58.000 49.040 1.00 0.00 ATOM 1916 H10X DPP 16 21.540 57.000 49.520 1.00 0.00 ATOM 1917 H10Y DPP 16 22.670 58.350 49.180 1.00 0.00 ATOM 1918 1C31 DPP 16 21.210 58.090 47.570 1.00 0.00 ATOM 1919 H11X DPP 16 21.570 59.070 47.200 1.00 0.00 ATOM 1920 H11Y DPP 16 20.110 57.950 47.510 1.00 0.00 ATOM 1921 2C31 DPP 16 21.880 57.010 46.710 1.00 0.00 ATOM 1922 H12X DPP 16 21.730 55.960 47.020 1.00 0.00 ATOM 1923 H12Y DPP 16 22.960 57.250 46.780 1.00 0.00 ATOM 1924 3C31 DPP 16 21.450 57.050 45.240 1.00 0.00 ATOM 1925 H13X DPP 16 21.900 57.980 44.840 1.00 0.00 ATOM 1926 H13Y DPP 16 20.350 57.120 45.320 1.00 0.00 ATOM 1927 4C31 DPP 16 21.790 55.730 44.540 1.00 0.00 ATOM 1928 H14X DPP 16 21.470 54.880 45.170 1.00 0.00 ATOM 1929 H14Y DPP 16 22.900 55.620 44.510 1.00 0.00 ATOM 1930 5C31 DPP 16 21.340 55.490 43.100 1.00 0.00 ATOM 1931 H15X DPP 16 21.590 54.480 42.710 1.00 0.00 ATOM 1932 H15Y DPP 16 21.800 56.290 42.480 1.00 0.00 ATOM 1933 6C31 DPP 16 19.820 55.540 42.950 1.00 0.00 ATOM 1934 H16X DPP 16 19.390 56.530 43.240 1.00 0.00 ATOM 1935 H16Y DPP 16 19.390 54.800 43.660 1.00 0.00 ATOM 1936 H16Z DPP 16 19.530 55.110 41.970 1.00 0.00 ATOM 1937 N DPP 17 52.100 30.720 66.700 1.00 0.00 ATOM 1938 HN1 DPP 17 52.830 31.320 67.110 1.00 0.00 ATOM 1939 HN2 DPP 17 51.210 31.240 66.810 1.00 0.00 ATOM 1940 HN3 DPP 17 52.090 29.890 67.330 1.00 0.00 ATOM 1941 C12 DPP 17 52.540 30.290 65.320 1.00 0.00 ATOM 1942 H12A DPP 17 52.700 31.220 64.720 1.00 0.00 ATOM 1943 H12B DPP 17 53.510 29.750 65.390 1.00 0.00 ATOM 1944 C11 DPP 17 51.530 29.380 64.640 1.00 0.00 ATOM 1945 H11A DPP 17 51.920 29.060 63.650 1.00 0.00 ATOM 1946 H11B DPP 17 50.610 29.980 64.470 1.00 0.00 ATOM 1947 P DPP 17 49.840 27.630 65.340 1.00 0.00 ATOM 1948 O13 DPP 17 48.970 28.600 66.030 1.00 0.00 ATOM 1949 O14 DPP 17 49.910 26.250 65.880 1.00 0.00 ATOM 1950 O11 DPP 17 49.570 27.600 63.770 1.00 0.00 ATOM 1951 O12 DPP 17 51.340 28.190 65.410 1.00 0.00 ATOM 1952 C1 DPP 17 50.300 26.550 63.130 1.00 0.00 ATOM 1953 HA DPP 17 49.710 25.610 63.240 1.00 0.00 ATOM 1954 HB DPP 17 51.320 26.520 63.570 1.00 0.00 ATOM 1955 C2 DPP 17 50.460 26.780 61.620 1.00 0.00 ATOM 1956 HS DPP 17 51.230 27.580 61.680 1.00 0.00 ATOM 1957 O21 DPP 17 49.190 27.220 61.120 1.00 0.00 ATOM 1958 C21 DPP 17 49.340 28.310 60.370 1.00 0.00 ATOM 1959 O22 DPP 17 50.370 28.900 60.100 1.00 0.00 ATOM 1960 C22 DPP 17 47.930 28.810 60.060 1.00 0.00 ATOM 1961 H2R DPP 17 47.530 29.190 61.020 1.00 0.00 ATOM 1962 H2S DPP 17 47.220 28.020 59.740 1.00 0.00 ATOM 1963 C3 DPP 17 50.970 25.550 60.850 1.00 0.00 ATOM 1964 HX DPP 17 50.440 24.580 60.970 1.00 0.00 ATOM 1965 HY DPP 17 51.930 25.250 61.320 1.00 0.00 ATOM 1966 O31 DPP 17 50.980 25.810 59.440 1.00 0.00 ATOM 1967 C31 DPP 17 52.230 25.960 59.010 1.00 0.00 ATOM 1968 O32 DPP 17 53.250 25.940 59.680 1.00 0.00 ATOM 1969 C32 DPP 17 52.280 26.130 57.500 1.00 0.00 ATOM 1970 H2X DPP 17 51.470 25.590 56.960 1.00 0.00 ATOM 1971 H2Y DPP 17 53.270 25.740 57.180 1.00 0.00 ATOM 1972 C23 DPP 17 47.990 29.970 59.070 1.00 0.00 ATOM 1973 H3R DPP 17 48.770 29.700 58.330 1.00 0.00 ATOM 1974 H3S DPP 17 48.460 30.760 59.690 1.00 0.00 ATOM 1975 C24 DPP 17 46.670 30.570 58.580 1.00 0.00 ATOM 1976 H4R DPP 17 46.770 31.670 58.410 1.00 0.00 ATOM 1977 H4S DPP 17 46.090 30.340 59.490 1.00 0.00 ATOM 1978 C25 DPP 17 46.130 29.860 57.330 1.00 0.00 ATOM 1979 H5R DPP 17 45.110 30.220 57.080 1.00 0.00 ATOM 1980 H5S DPP 17 45.960 28.780 57.510 1.00 0.00 ATOM 1981 C26 DPP 17 47.010 30.260 56.150 1.00 0.00 ATOM 1982 H6R DPP 17 48.020 29.930 56.500 1.00 0.00 ATOM 1983 H6S DPP 17 47.050 31.340 55.890 1.00 0.00 ATOM 1984 C27 DPP 17 46.860 29.470 54.850 1.00 0.00 ATOM 1985 H7R DPP 17 46.650 28.420 55.140 1.00 0.00 ATOM 1986 H7S DPP 17 47.750 29.560 54.190 1.00 0.00 ATOM 1987 C28 DPP 17 45.660 29.960 54.040 1.00 0.00 ATOM 1988 H8R DPP 17 45.930 30.910 53.530 1.00 0.00 ATOM 1989 H8S DPP 17 44.950 30.180 54.880 1.00 0.00 ATOM 1990 C29 DPP 17 45.040 28.960 53.070 1.00 0.00 ATOM 1991 H9R DPP 17 44.670 28.090 53.660 1.00 0.00 ATOM 1992 H9S DPP 17 45.910 28.590 52.480 1.00 0.00 ATOM 1993 0C21 DPP 17 43.990 29.550 52.130 1.00 0.00 ATOM 1994 H10R DPP 17 43.520 28.780 51.490 1.00 0.00 ATOM 1995 H10S DPP 17 44.560 30.250 51.470 1.00 0.00 ATOM 1996 1C21 DPP 17 42.800 30.330 52.710 1.00 0.00 ATOM 1997 H11R DPP 17 42.110 30.660 51.910 1.00 0.00 ATOM 1998 H11S DPP 17 43.180 31.230 53.230 1.00 0.00 ATOM 1999 2C21 DPP 17 42.030 29.550 53.770 1.00 0.00 ATOM 2000 H12R DPP 17 42.750 29.200 54.540 1.00 0.00 ATOM 2001 H12S DPP 17 41.580 28.700 53.200 1.00 0.00 ATOM 2002 3C21 DPP 17 40.820 30.200 54.450 1.00 0.00 ATOM 2003 H13R DPP 17 40.240 29.410 54.960 1.00 0.00 ATOM 2004 H13S DPP 17 40.190 30.470 53.570 1.00 0.00 ATOM 2005 4C21 DPP 17 41.000 31.520 55.210 1.00 0.00 ATOM 2006 H14R DPP 17 40.010 31.660 55.690 1.00 0.00 ATOM 2007 H14S DPP 17 41.280 32.380 54.570 1.00 0.00 ATOM 2008 5C21 DPP 17 41.940 31.430 56.420 1.00 0.00 ATOM 2009 H15R DPP 17 42.900 31.320 55.880 1.00 0.00 ATOM 2010 H15S DPP 17 41.760 30.460 56.910 1.00 0.00 ATOM 2011 6C21 DPP 17 41.770 32.610 57.380 1.00 0.00 ATOM 2012 H16R DPP 17 40.830 32.500 57.960 1.00 0.00 ATOM 2013 H16S DPP 17 41.600 33.560 56.830 1.00 0.00 ATOM 2014 H16T DPP 17 42.600 32.690 58.110 1.00 0.00 ATOM 2015 C33 DPP 17 52.310 27.630 57.230 1.00 0.00 ATOM 2016 H3X DPP 17 53.290 28.000 57.610 1.00 0.00 ATOM 2017 H3Y DPP 17 51.520 28.110 57.850 1.00 0.00 ATOM 2018 C34 DPP 17 52.160 28.120 55.780 1.00 0.00 ATOM 2019 H4X DPP 17 52.220 29.230 55.690 1.00 0.00 ATOM 2020 H4Y DPP 17 51.140 27.780 55.500 1.00 0.00 ATOM 2021 C35 DPP 17 53.140 27.410 54.840 1.00 0.00 ATOM 2022 H5X DPP 17 53.170 26.320 55.030 1.00 0.00 ATOM 2023 H5Y DPP 17 54.160 27.770 55.100 1.00 0.00 ATOM 2024 C36 DPP 17 52.840 27.660 53.360 1.00 0.00 ATOM 2025 H6X DPP 17 53.060 28.720 53.130 1.00 0.00 ATOM 2026 H6Y DPP 17 51.750 27.460 53.250 1.00 0.00 ATOM 2027 C37 DPP 17 53.350 26.700 52.280 1.00 0.00 ATOM 2028 H7X DPP 17 54.390 26.550 52.640 1.00 0.00 ATOM 2029 H7Y DPP 17 53.360 27.160 51.270 1.00 0.00 ATOM 2030 C38 DPP 17 52.640 25.360 52.060 1.00 0.00 ATOM 2031 H8X DPP 17 51.770 25.600 51.420 1.00 0.00 ATOM 2032 H8Y DPP 17 52.260 25.020 53.050 1.00 0.00 ATOM 2033 C39 DPP 17 53.560 24.250 51.560 1.00 0.00 ATOM 2034 H9X DPP 17 52.890 23.390 51.730 1.00 0.00 ATOM 2035 H9Y DPP 17 54.440 24.110 52.220 1.00 0.00 ATOM 2036 0C31 DPP 17 53.880 24.300 50.060 1.00 0.00 ATOM 2037 H10X DPP 17 54.720 25.000 49.890 1.00 0.00 ATOM 2038 H10Y DPP 17 52.920 24.630 49.610 1.00 0.00 ATOM 2039 1C31 DPP 17 54.320 22.960 49.460 1.00 0.00 ATOM 2040 H11X DPP 17 53.640 22.120 49.690 1.00 0.00 ATOM 2041 H11Y DPP 17 55.260 22.630 49.950 1.00 0.00 ATOM 2042 2C31 DPP 17 54.510 23.010 47.940 1.00 0.00 ATOM 2043 H12X DPP 17 55.290 23.770 47.750 1.00 0.00 ATOM 2044 H12Y DPP 17 53.580 23.200 47.370 1.00 0.00 ATOM 2045 3C31 DPP 17 55.110 21.760 47.290 1.00 0.00 ATOM 2046 H13X DPP 17 54.360 20.940 47.310 1.00 0.00 ATOM 2047 H13Y DPP 17 55.990 21.620 47.950 1.00 0.00 ATOM 2048 4C31 DPP 17 55.540 21.850 45.820 1.00 0.00 ATOM 2049 H14X DPP 17 56.090 22.770 45.550 1.00 0.00 ATOM 2050 H14Y DPP 17 54.600 21.690 45.250 1.00 0.00 ATOM 2051 5C31 DPP 17 56.290 20.550 45.530 1.00 0.00 ATOM 2052 H15X DPP 17 55.870 19.620 45.960 1.00 0.00 ATOM 2053 H15Y DPP 17 57.330 20.680 45.890 1.00 0.00 ATOM 2054 6C31 DPP 17 56.490 20.390 44.020 1.00 0.00 ATOM 2055 H16X DPP 17 57.270 19.610 43.840 1.00 0.00 ATOM 2056 H16Y DPP 17 56.960 21.310 43.630 1.00 0.00 ATOM 2057 H16Z DPP 17 55.520 20.200 43.510 1.00 0.00 ATOM 2058 N DPP 18 10.450 20.500 63.600 1.00 0.00 ATOM 2059 HN1 DPP 18 10.150 21.210 64.290 1.00 0.00 ATOM 2060 HN2 DPP 18 9.850 19.670 63.770 1.00 0.00 ATOM 2061 HN3 DPP 18 11.450 20.220 63.690 1.00 0.00 ATOM 2062 C12 DPP 18 10.200 21.060 62.220 1.00 0.00 ATOM 2063 H12A DPP 18 9.960 20.170 61.590 1.00 0.00 ATOM 2064 H12B DPP 18 9.240 21.600 62.240 1.00 0.00 ATOM 2065 C11 DPP 18 11.380 21.840 61.630 1.00 0.00 ATOM 2066 H11A DPP 18 11.000 22.420 60.760 1.00 0.00 ATOM 2067 H11B DPP 18 12.210 21.200 61.270 1.00 0.00 ATOM 2068 P DPP 18 11.660 24.290 62.640 1.00 0.00 ATOM 2069 O13 DPP 18 12.010 24.850 63.970 1.00 0.00 ATOM 2070 O14 DPP 18 10.310 24.550 62.090 1.00 0.00 ATOM 2071 O11 DPP 18 12.690 24.860 61.560 1.00 0.00 ATOM 2072 O12 DPP 18 11.910 22.710 62.630 1.00 0.00 ATOM 2073 C1 DPP 18 13.230 26.190 61.580 1.00 0.00 ATOM 2074 HA DPP 18 14.310 26.160 61.310 1.00 0.00 ATOM 2075 HB DPP 18 13.170 26.650 62.590 1.00 0.00 ATOM 2076 C2 DPP 18 12.500 27.180 60.650 1.00 0.00 ATOM 2077 HS DPP 18 11.450 26.960 60.920 1.00 0.00 ATOM 2078 O21 DPP 18 12.850 26.940 59.280 1.00 0.00 ATOM 2079 C21 DPP 18 11.710 26.970 58.580 1.00 0.00 ATOM 2080 O22 DPP 18 10.630 27.340 59.000 1.00 0.00 ATOM 2081 C22 DPP 18 11.930 26.520 57.140 1.00 0.00 ATOM 2082 H2R DPP 18 12.000 25.410 57.190 1.00 0.00 ATOM 2083 H2S DPP 18 12.930 26.940 56.890 1.00 0.00 ATOM 2084 C3 DPP 18 12.930 28.580 61.130 1.00 0.00 ATOM 2085 HX DPP 18 14.030 28.570 61.000 1.00 0.00 ATOM 2086 HY DPP 18 12.780 28.810 62.200 1.00 0.00 ATOM 2087 O31 DPP 18 12.380 29.590 60.270 1.00 0.00 ATOM 2088 C31 DPP 18 11.090 29.860 60.480 1.00 0.00 ATOM 2089 O32 DPP 18 10.460 29.330 61.380 1.00 0.00 ATOM 2090 C32 DPP 18 10.610 30.920 59.500 1.00 0.00 ATOM 2091 H2X DPP 18 11.410 31.120 58.760 1.00 0.00 ATOM 2092 H2Y DPP 18 10.310 31.890 59.950 1.00 0.00 ATOM 2093 C23 DPP 18 10.920 27.080 56.140 1.00 0.00 ATOM 2094 H3R DPP 18 10.110 27.580 56.710 1.00 0.00 ATOM 2095 H3S DPP 18 10.390 26.210 55.690 1.00 0.00 ATOM 2096 C24 DPP 18 11.560 28.040 55.140 1.00 0.00 ATOM 2097 H4R DPP 18 12.020 28.930 55.620 1.00 0.00 ATOM 2098 H4S DPP 18 10.800 28.430 54.440 1.00 0.00 ATOM 2099 C25 DPP 18 12.590 27.380 54.210 1.00 0.00 ATOM 2100 H5R DPP 18 13.440 27.240 54.900 1.00 0.00 ATOM 2101 H5S DPP 18 12.940 27.980 53.350 1.00 0.00 ATOM 2102 C26 DPP 18 12.200 26.010 53.650 1.00 0.00 ATOM 2103 H6R DPP 18 11.890 25.400 54.530 1.00 0.00 ATOM 2104 H6S DPP 18 13.110 25.540 53.230 1.00 0.00 ATOM 2105 C27 DPP 18 11.080 25.950 52.610 1.00 0.00 ATOM 2106 H7R DPP 18 10.240 26.460 53.120 1.00 0.00 ATOM 2107 H7S DPP 18 10.900 24.870 52.390 1.00 0.00 ATOM 2108 C28 DPP 18 11.330 26.860 51.410 1.00 0.00 ATOM 2109 H8R DPP 18 11.740 27.820 51.800 1.00 0.00 ATOM 2110 H8S DPP 18 10.360 27.020 50.900 1.00 0.00 ATOM 2111 C29 DPP 18 12.350 26.300 50.420 1.00 0.00 ATOM 2112 H9R DPP 18 11.900 25.690 49.600 1.00 0.00 ATOM 2113 H9S DPP 18 13.050 25.570 50.890 1.00 0.00 ATOM 2114 0C21 DPP 18 13.210 27.390 49.780 1.00 0.00 ATOM 2115 H10R DPP 18 14.050 27.700 50.450 1.00 0.00 ATOM 2116 H10S DPP 18 12.550 28.260 49.580 1.00 0.00 ATOM 2117 1C21 DPP 18 13.790 26.990 48.430 1.00 0.00 ATOM 2118 H11R DPP 18 13.870 25.890 48.310 1.00 0.00 ATOM 2119 H11S DPP 18 14.800 27.450 48.340 1.00 0.00 ATOM 2120 2C21 DPP 18 12.810 27.350 47.320 1.00 0.00 ATOM 2121 H12R DPP 18 12.750 28.460 47.180 1.00 0.00 ATOM 2122 H12S DPP 18 11.800 27.000 47.610 1.00 0.00 ATOM 2123 3C21 DPP 18 13.180 26.870 45.910 1.00 0.00 ATOM 2124 H13R DPP 18 13.310 25.770 45.910 1.00 0.00 ATOM 2125 H13S DPP 18 14.080 27.420 45.540 1.00 0.00 ATOM 2126 4C21 DPP 18 12.070 27.270 44.940 1.00 0.00 ATOM 2127 H14R DPP 18 11.210 26.560 44.940 1.00 0.00 ATOM 2128 H14S DPP 18 12.410 27.180 43.890 1.00 0.00 ATOM 2129 5C21 DPP 18 11.570 28.700 45.170 1.00 0.00 ATOM 2130 H15R DPP 18 12.460 29.350 45.320 1.00 0.00 ATOM 2131 H15S DPP 18 10.950 28.780 46.090 1.00 0.00 ATOM 2132 6C21 DPP 18 10.810 29.240 43.960 1.00 0.00 ATOM 2133 H16R DPP 18 10.120 28.460 43.570 1.00 0.00 ATOM 2134 H16S DPP 18 11.530 29.520 43.160 1.00 0.00 ATOM 2135 H16T DPP 18 10.230 30.120 44.310 1.00 0.00 ATOM 2136 C33 DPP 18 9.360 30.450 58.760 1.00 0.00 ATOM 2137 H3X DPP 18 8.560 30.180 59.490 1.00 0.00 ATOM 2138 H3Y DPP 18 9.530 29.490 58.220 1.00 0.00 ATOM 2139 C34 DPP 18 8.680 31.470 57.850 1.00 0.00 ATOM 2140 H4X DPP 18 8.230 32.300 58.430 1.00 0.00 ATOM 2141 H4Y DPP 18 8.010 30.840 57.220 1.00 0.00 ATOM 2142 C35 DPP 18 9.580 32.150 56.820 1.00 0.00 ATOM 2143 H5X DPP 18 10.240 31.380 56.360 1.00 0.00 ATOM 2144 H5Y DPP 18 10.220 32.900 57.330 1.00 0.00 ATOM 2145 C36 DPP 18 8.770 32.810 55.700 1.00 0.00 ATOM 2146 H6X DPP 18 7.880 33.330 56.140 1.00 0.00 ATOM 2147 H6Y DPP 18 8.430 31.920 55.130 1.00 0.00 ATOM 2148 C37 DPP 18 9.540 33.880 54.940 1.00 0.00 ATOM 2149 H7X DPP 18 10.380 33.310 54.490 1.00 0.00 ATOM 2150 H7Y DPP 18 9.910 34.720 55.580 1.00 0.00 ATOM 2151 C38 DPP 18 8.800 34.450 53.720 1.00 0.00 ATOM 2152 H8X DPP 18 9.610 34.770 53.040 1.00 0.00 ATOM 2153 H8Y DPP 18 8.100 35.260 54.010 1.00 0.00 ATOM 2154 C39 DPP 18 8.160 33.340 52.880 1.00 0.00 ATOM 2155 H9X DPP 18 7.170 33.190 53.360 1.00 0.00 ATOM 2156 H9Y DPP 18 8.710 32.390 53.080 1.00 0.00 ATOM 2157 0C31 DPP 18 7.950 33.550 51.390 1.00 0.00 ATOM 2158 H10X DPP 18 7.820 32.570 50.880 1.00 0.00 ATOM 2159 H10Y DPP 18 8.900 33.910 50.950 1.00 0.00 ATOM 2160 1C31 DPP 18 6.890 34.610 51.080 1.00 0.00 ATOM 2161 H11X DPP 18 7.020 35.620 51.530 1.00 0.00 ATOM 2162 H11Y DPP 18 5.980 34.260 51.620 1.00 0.00 ATOM 2163 2C31 DPP 18 6.660 34.890 49.590 1.00 0.00 ATOM 2164 H12X DPP 18 7.550 35.270 49.040 1.00 0.00 ATOM 2165 H12Y DPP 18 5.900 35.700 49.520 1.00 0.00 ATOM 2166 3C31 DPP 18 5.960 33.830 48.730 1.00 0.00 ATOM 2167 H13X DPP 18 6.580 32.930 48.540 1.00 0.00 ATOM 2168 H13Y DPP 18 5.690 34.190 47.720 1.00 0.00 ATOM 2169 4C31 DPP 18 4.770 33.250 49.500 1.00 0.00 ATOM 2170 H14X DPP 18 4.080 34.110 49.680 1.00 0.00 ATOM 2171 H14Y DPP 18 5.210 32.820 50.420 1.00 0.00 ATOM 2172 5C31 DPP 18 3.990 32.110 48.850 1.00 0.00 ATOM 2173 H15X DPP 18 3.400 32.630 48.060 1.00 0.00 ATOM 2174 H15Y DPP 18 3.470 31.640 49.710 1.00 0.00 ATOM 2175 6C31 DPP 18 4.850 31.000 48.270 1.00 0.00 ATOM 2176 H16X DPP 18 5.660 30.760 48.990 1.00 0.00 ATOM 2177 H16Y DPP 18 5.340 31.510 47.410 1.00 0.00 ATOM 2178 H16Z DPP 18 4.340 30.060 47.950 1.00 0.00 ATOM 2179 N DPP 19 18.660 14.200 62.080 1.00 0.00 ATOM 2180 HN1 DPP 19 18.450 15.090 62.560 1.00 0.00 ATOM 2181 HN2 DPP 19 18.980 13.620 62.880 1.00 0.00 ATOM 2182 HN3 DPP 19 19.490 14.310 61.450 1.00 0.00 ATOM 2183 C12 DPP 19 17.350 13.810 61.450 1.00 0.00 ATOM 2184 H12A DPP 19 17.510 12.810 60.980 1.00 0.00 ATOM 2185 H12B DPP 19 17.140 14.490 60.600 1.00 0.00 ATOM 2186 C11 DPP 19 16.270 13.750 62.530 1.00 0.00 ATOM 2187 H11A DPP 19 15.340 13.640 61.930 1.00 0.00 ATOM 2188 H11B DPP 19 16.260 14.750 63.000 1.00 0.00 ATOM 2189 P DPP 19 15.710 12.930 64.750 1.00 0.00 ATOM 2190 O13 DPP 19 16.370 13.820 65.730 1.00 0.00 ATOM 2191 O14 DPP 19 15.430 11.540 65.200 1.00 0.00 ATOM 2192 O11 DPP 19 14.330 13.610 64.310 1.00 0.00 ATOM 2193 O12 DPP 19 16.530 12.650 63.410 1.00 0.00 ATOM 2194 C1 DPP 19 12.990 13.140 64.450 1.00 0.00 ATOM 2195 HA DPP 19 12.380 13.960 64.010 1.00 0.00 ATOM 2196 HB DPP 19 12.650 13.230 65.500 1.00 0.00 ATOM 2197 C2 DPP 19 12.710 11.780 63.780 1.00 0.00 ATOM 2198 HS DPP 19 13.190 10.980 64.380 1.00 0.00 ATOM 2199 O21 DPP 19 13.070 11.930 62.400 1.00 0.00 ATOM 2200 C21 DPP 19 13.750 10.900 61.910 1.00 0.00 ATOM 2201 O22 DPP 19 13.860 9.840 62.510 1.00 0.00 ATOM 2202 C22 DPP 19 14.270 11.130 60.500 1.00 0.00 ATOM 2203 H2R DPP 19 15.380 11.150 60.470 1.00 0.00 ATOM 2204 H2S DPP 19 14.140 12.220 60.290 1.00 0.00 ATOM 2205 C3 DPP 19 11.210 11.440 63.850 1.00 0.00 ATOM 2206 HX DPP 19 10.780 11.460 64.870 1.00 0.00 ATOM 2207 HY DPP 19 11.030 10.370 63.610 1.00 0.00 ATOM 2208 O31 DPP 19 10.480 12.320 62.980 1.00 0.00 ATOM 2209 C31 DPP 19 9.230 11.930 62.760 1.00 0.00 ATOM 2210 O32 DPP 19 8.810 10.850 63.170 1.00 0.00 ATOM 2211 C32 DPP 19 8.500 12.890 61.830 1.00 0.00 ATOM 2212 H2X DPP 19 8.880 13.930 61.890 1.00 0.00 ATOM 2213 H2Y DPP 19 7.450 12.860 62.190 1.00 0.00 ATOM 2214 C23 DPP 19 13.630 10.230 59.440 1.00 0.00 ATOM 2215 H3R DPP 19 12.560 10.080 59.730 1.00 0.00 ATOM 2216 H3S DPP 19 14.100 9.230 59.390 1.00 0.00 ATOM 2217 C24 DPP 19 13.590 10.780 58.020 1.00 0.00 ATOM 2218 H4R DPP 19 12.910 10.070 57.500 1.00 0.00 ATOM 2219 H4S DPP 19 14.660 10.780 57.740 1.00 0.00 ATOM 2220 C25 DPP 19 13.090 12.210 57.770 1.00 0.00 ATOM 2221 H5R DPP 19 13.880 12.910 58.110 1.00 0.00 ATOM 2222 H5S DPP 19 12.160 12.410 58.350 1.00 0.00 ATOM 2223 C26 DPP 19 12.850 12.480 56.280 1.00 0.00 ATOM 2224 H6R DPP 19 12.010 13.180 56.100 1.00 0.00 ATOM 2225 H6S DPP 19 12.480 11.540 55.840 1.00 0.00 ATOM 2226 C27 DPP 19 14.130 12.850 55.520 1.00 0.00 ATOM 2227 H7R DPP 19 14.830 12.000 55.670 1.00 0.00 ATOM 2228 H7S DPP 19 14.540 13.740 56.040 1.00 0.00 ATOM 2229 C28 DPP 19 14.000 13.060 54.010 1.00 0.00 ATOM 2230 H8R DPP 19 15.000 13.290 53.580 1.00 0.00 ATOM 2231 H8S DPP 19 13.260 13.860 53.800 1.00 0.00 ATOM 2232 C29 DPP 19 13.490 11.800 53.310 1.00 0.00 ATOM 2233 H9R DPP 19 13.490 12.040 52.220 1.00 0.00 ATOM 2234 H9S DPP 19 12.440 11.510 53.510 1.00 0.00 ATOM 2235 0C21 DPP 19 14.390 10.570 53.440 1.00 0.00 ATOM 2236 H10R DPP 19 13.900 9.820 52.780 1.00 0.00 ATOM 2237 H10S DPP 19 14.430 10.240 54.500 1.00 0.00 ATOM 2238 1C21 DPP 19 15.840 10.720 52.960 1.00 0.00 ATOM 2239 H11R DPP 19 16.410 11.180 53.800 1.00 0.00 ATOM 2240 H11S DPP 19 15.720 11.450 52.130 1.00 0.00 ATOM 2241 2C21 DPP 19 16.510 9.430 52.490 1.00 0.00 ATOM 2242 H12R DPP 19 15.810 8.870 51.840 1.00 0.00 ATOM 2243 H12S DPP 19 16.600 8.770 53.370 1.00 0.00 ATOM 2244 3C21 DPP 19 17.830 9.640 51.750 1.00 0.00 ATOM 2245 H13R DPP 19 17.680 10.120 50.760 1.00 0.00 ATOM 2246 H13S DPP 19 18.270 8.620 51.720 1.00 0.00 ATOM 2247 4C21 DPP 19 18.820 10.580 52.460 1.00 0.00 ATOM 2248 H14R DPP 19 18.350 11.580 52.470 1.00 0.00 ATOM 2249 H14S DPP 19 19.800 10.680 51.940 1.00 0.00 ATOM 2250 5C21 DPP 19 19.190 10.090 53.860 1.00 0.00 ATOM 2251 H15R DPP 19 18.340 9.650 54.420 1.00 0.00 ATOM 2252 H15S DPP 19 19.390 11.010 54.450 1.00 0.00 ATOM 2253 6C21 DPP 19 20.390 9.130 53.840 1.00 0.00 ATOM 2254 H16R DPP 19 21.160 9.640 53.220 1.00 0.00 ATOM 2255 H16S DPP 19 20.110 8.150 53.420 1.00 0.00 ATOM 2256 H16T DPP 19 20.840 9.100 54.860 1.00 0.00 ATOM 2257 C33 DPP 19 8.380 12.340 60.410 1.00 0.00 ATOM 2258 H3X DPP 19 7.500 11.670 60.420 1.00 0.00 ATOM 2259 H3Y DPP 19 9.300 11.770 60.150 1.00 0.00 ATOM 2260 C34 DPP 19 8.260 13.480 59.400 1.00 0.00 ATOM 2261 H4X DPP 19 9.270 13.940 59.450 1.00 0.00 ATOM 2262 H4Y DPP 19 7.430 14.180 59.620 1.00 0.00 ATOM 2263 C35 DPP 19 8.150 12.970 57.960 1.00 0.00 ATOM 2264 H5X DPP 19 7.110 12.620 57.750 1.00 0.00 ATOM 2265 H5Y DPP 19 8.840 12.120 57.780 1.00 0.00 ATOM 2266 C36 DPP 19 8.380 14.050 56.910 1.00 0.00 ATOM 2267 H6X DPP 19 9.400 14.460 57.110 1.00 0.00 ATOM 2268 H6Y DPP 19 7.520 14.750 56.960 1.00 0.00 ATOM 2269 C37 DPP 19 8.360 13.600 55.450 1.00 0.00 ATOM 2270 H7X DPP 19 7.310 13.400 55.140 1.00 0.00 ATOM 2271 H7Y DPP 19 8.950 12.660 55.390 1.00 0.00 ATOM 2272 C38 DPP 19 8.970 14.570 54.440 1.00 0.00 ATOM 2273 H8X DPP 19 9.960 14.940 54.790 1.00 0.00 ATOM 2274 H8Y DPP 19 8.350 15.480 54.400 1.00 0.00 ATOM 2275 C39 DPP 19 9.170 14.040 53.010 1.00 0.00 ATOM 2276 H9X DPP 19 9.960 13.270 52.910 1.00 0.00 ATOM 2277 H9Y DPP 19 9.520 14.890 52.380 1.00 0.00 ATOM 2278 0C31 DPP 19 7.890 13.420 52.440 1.00 0.00 ATOM 2279 H10X DPP 19 7.080 14.170 52.360 1.00 0.00 ATOM 2280 H10Y DPP 19 7.420 12.670 53.110 1.00 0.00 ATOM 2281 1C31 DPP 19 8.240 12.590 51.200 1.00 0.00 ATOM 2282 H11X DPP 19 7.300 12.090 50.890 1.00 0.00 ATOM 2283 H11Y DPP 19 9.090 11.870 51.310 1.00 0.00 ATOM 2284 2C31 DPP 19 8.550 13.520 50.020 1.00 0.00 ATOM 2285 H12X DPP 19 9.490 14.110 49.970 1.00 0.00 ATOM 2286 H12Y DPP 19 7.830 14.340 49.820 1.00 0.00 ATOM 2287 3C31 DPP 19 8.490 12.570 48.820 1.00 0.00 ATOM 2288 H13X DPP 19 7.470 12.150 48.780 1.00 0.00 ATOM 2289 H13Y DPP 19 9.220 11.730 48.900 1.00 0.00 ATOM 2290 4C31 DPP 19 8.840 13.330 47.540 1.00 0.00 ATOM 2291 H14X DPP 19 9.930 13.550 47.570 1.00 0.00 ATOM 2292 H14Y DPP 19 8.300 14.300 47.460 1.00 0.00 ATOM 2293 5C31 DPP 19 8.580 12.590 46.230 1.00 0.00 ATOM 2294 H15X DPP 19 7.590 12.090 46.300 1.00 0.00 ATOM 2295 H15Y DPP 19 9.430 11.880 46.110 1.00 0.00 ATOM 2296 6C31 DPP 19 8.650 13.590 45.070 1.00 0.00 ATOM 2297 H16X DPP 19 7.840 14.340 44.980 1.00 0.00 ATOM 2298 H16Y DPP 19 8.660 13.120 44.060 1.00 0.00 ATOM 2299 H16Z DPP 19 9.600 14.160 45.150 1.00 0.00 ATOM 2300 N DPP 20 53.840 23.820 64.720 1.00 0.00 ATOM 2301 HN1 DPP 20 53.150 23.060 64.570 1.00 0.00 ATOM 2302 HN2 DPP 20 53.330 24.500 65.320 1.00 0.00 ATOM 2303 HN3 DPP 20 54.200 24.250 63.850 1.00 0.00 ATOM 2304 C12 DPP 20 55.110 23.300 65.360 1.00 0.00 ATOM 2305 H12A DPP 20 54.830 22.310 65.780 1.00 0.00 ATOM 2306 H12B DPP 20 55.460 24.010 66.130 1.00 0.00 ATOM 2307 C11 DPP 20 56.250 23.000 64.380 1.00 0.00 ATOM 2308 H11A DPP 20 56.080 22.070 63.800 1.00 0.00 ATOM 2309 H11B DPP 20 57.190 22.880 64.950 1.00 0.00 ATOM 2310 P DPP 20 57.260 23.850 62.200 1.00 0.00 ATOM 2311 O13 DPP 20 58.540 23.370 62.780 1.00 0.00 ATOM 2312 O14 DPP 20 57.230 25.120 61.440 1.00 0.00 ATOM 2313 O11 DPP 20 56.640 22.660 61.320 1.00 0.00 ATOM 2314 O12 DPP 20 56.270 24.080 63.440 1.00 0.00 ATOM 2315 C1 DPP 20 55.230 22.650 61.100 1.00 0.00 ATOM 2316 HA DPP 20 54.700 23.540 61.490 1.00 0.00 ATOM 2317 HB DPP 20 54.720 21.790 61.570 1.00 0.00 ATOM 2318 C2 DPP 20 54.910 22.540 59.590 1.00 0.00 ATOM 2319 HS DPP 20 55.260 21.550 59.230 1.00 0.00 ATOM 2320 O21 DPP 20 55.370 23.670 58.850 1.00 0.00 ATOM 2321 C21 DPP 20 55.970 23.280 57.730 1.00 0.00 ATOM 2322 O22 DPP 20 56.380 22.160 57.510 1.00 0.00 ATOM 2323 C22 DPP 20 55.980 24.410 56.700 1.00 0.00 ATOM 2324 H2R DPP 20 55.250 25.200 56.980 1.00 0.00 ATOM 2325 H2S DPP 20 55.760 24.010 55.680 1.00 0.00 ATOM 2326 C3 DPP 20 53.380 22.400 59.580 1.00 0.00 ATOM 2327 HX DPP 20 52.980 23.290 60.090 1.00 0.00 ATOM 2328 HY DPP 20 53.110 21.450 60.090 1.00 0.00 ATOM 2329 O31 DPP 20 52.900 22.400 58.230 1.00 0.00 ATOM 2330 C31 DPP 20 52.390 21.290 57.700 1.00 0.00 ATOM 2331 O32 DPP 20 52.420 20.170 58.200 1.00 0.00 ATOM 2332 C32 DPP 20 51.590 21.790 56.510 1.00 0.00 ATOM 2333 H2X DPP 20 51.970 22.780 56.200 1.00 0.00 ATOM 2334 H2Y DPP 20 50.500 21.800 56.730 1.00 0.00 ATOM 2335 C23 DPP 20 57.320 25.150 56.670 1.00 0.00 ATOM 2336 H3R DPP 20 58.200 24.500 56.530 1.00 0.00 ATOM 2337 H3S DPP 20 57.410 25.480 57.730 1.00 0.00 ATOM 2338 C24 DPP 20 57.390 26.470 55.890 1.00 0.00 ATOM 2339 H4R DPP 20 58.450 26.690 56.160 1.00 0.00 ATOM 2340 H4S DPP 20 56.670 27.080 56.470 1.00 0.00 ATOM 2341 C25 DPP 20 56.930 26.300 54.440 1.00 0.00 ATOM 2342 H5R DPP 20 57.350 27.250 54.060 1.00 0.00 ATOM 2343 H5S DPP 20 55.850 26.190 54.230 1.00 0.00 ATOM 2344 C26 DPP 20 57.740 25.240 53.690 1.00 0.00 ATOM 2345 H6R DPP 20 57.330 24.220 53.840 1.00 0.00 ATOM 2346 H6S DPP 20 58.760 25.350 54.100 1.00 0.00 ATOM 2347 C27 DPP 20 57.890 25.540 52.190 1.00 0.00 ATOM 2348 H7R DPP 20 58.060 26.620 52.020 1.00 0.00 ATOM 2349 H7S DPP 20 56.940 25.190 51.730 1.00 0.00 ATOM 2350 C28 DPP 20 59.080 24.900 51.470 1.00 0.00 ATOM 2351 H8R DPP 20 58.740 23.850 51.390 1.00 0.00 ATOM 2352 H8S DPP 20 59.930 25.030 52.170 1.00 0.00 ATOM 2353 C29 DPP 20 59.380 25.360 50.040 1.00 0.00 ATOM 2354 H9R DPP 20 59.950 24.600 49.460 1.00 0.00 ATOM 2355 H9S DPP 20 59.870 26.360 50.060 1.00 0.00 ATOM 2356 0C21 DPP 20 58.100 25.650 49.260 1.00 0.00 ATOM 2357 H10R DPP 20 57.650 26.620 49.560 1.00 0.00 ATOM 2358 H10S DPP 20 57.310 24.930 49.580 1.00 0.00 ATOM 2359 1C21 DPP 20 58.230 25.530 47.740 1.00 0.00 ATOM 2360 H11R DPP 20 59.180 26.040 47.490 1.00 0.00 ATOM 2361 H11S DPP 20 57.340 25.960 47.240 1.00 0.00 ATOM 2362 2C21 DPP 20 58.400 24.090 47.220 1.00 0.00 ATOM 2363 H12R DPP 20 57.450 23.600 47.530 1.00 0.00 ATOM 2364 H12S DPP 20 59.270 23.650 47.750 1.00 0.00 ATOM 2365 3C21 DPP 20 58.470 24.100 45.700 1.00 0.00 ATOM 2366 H13R DPP 20 57.740 24.800 45.240 1.00 0.00 ATOM 2367 H13S DPP 20 58.180 23.060 45.450 1.00 0.00 ATOM 2368 4C21 DPP 20 59.930 24.420 45.340 1.00 0.00 ATOM 2369 H14R DPP 20 60.570 23.670 45.840 1.00 0.00 ATOM 2370 H14S DPP 20 60.240 25.440 45.650 1.00 0.00 ATOM 2371 5C21 DPP 20 60.330 24.220 43.880 1.00 0.00 ATOM 2372 H15R DPP 20 60.220 23.130 43.680 1.00 0.00 ATOM 2373 H15S DPP 20 61.430 24.300 43.760 1.00 0.00 ATOM 2374 6C21 DPP 20 59.580 25.020 42.810 1.00 0.00 ATOM 2375 H16R DPP 20 58.510 24.760 42.870 1.00 0.00 ATOM 2376 H16S DPP 20 59.980 25.130 41.780 1.00 0.00 ATOM 2377 H16T DPP 20 59.480 26.050 43.210 1.00 0.00 ATOM 2378 C33 DPP 20 51.810 20.880 55.300 1.00 0.00 ATOM 2379 H3X DPP 20 51.680 19.790 55.490 1.00 0.00 ATOM 2380 H3Y DPP 20 52.890 20.960 55.090 1.00 0.00 ATOM 2381 C34 DPP 20 50.930 21.410 54.170 1.00 0.00 ATOM 2382 H4X DPP 20 51.230 22.470 54.040 1.00 0.00 ATOM 2383 H4Y DPP 20 49.870 21.300 54.480 1.00 0.00 ATOM 2384 C35 DPP 20 51.230 20.950 52.740 1.00 0.00 ATOM 2385 H5X DPP 20 51.430 19.870 52.900 1.00 0.00 ATOM 2386 H5Y DPP 20 52.150 21.440 52.330 1.00 0.00 ATOM 2387 C36 DPP 20 50.170 21.220 51.680 1.00 0.00 ATOM 2388 H6X DPP 20 49.290 21.800 52.030 1.00 0.00 ATOM 2389 H6Y DPP 20 49.720 20.260 51.340 1.00 0.00 ATOM 2390 C37 DPP 20 50.650 22.080 50.510 1.00 0.00 ATOM 2391 H7X DPP 20 51.680 21.850 50.140 1.00 0.00 ATOM 2392 H7Y DPP 20 50.620 23.150 50.770 1.00 0.00 ATOM 2393 C38 DPP 20 49.730 21.910 49.290 1.00 0.00 ATOM 2394 H8X DPP 20 48.670 22.070 49.580 1.00 0.00 ATOM 2395 H8Y DPP 20 49.720 20.830 49.030 1.00 0.00 ATOM 2396 C39 DPP 20 50.040 22.770 48.070 1.00 0.00 ATOM 2397 H9X DPP 20 50.660 23.640 48.380 1.00 0.00 ATOM 2398 H9Y DPP 20 49.100 23.190 47.660 1.00 0.00 ATOM 2399 0C31 DPP 20 50.650 22.010 46.880 1.00 0.00 ATOM 2400 H10X DPP 20 50.020 21.100 46.750 1.00 0.00 ATOM 2401 H10Y DPP 20 51.530 21.550 47.380 1.00 0.00 ATOM 2402 1C31 DPP 20 50.920 22.860 45.650 1.00 0.00 ATOM 2403 H11X DPP 20 51.520 23.750 45.940 1.00 0.00 ATOM 2404 H11Y DPP 20 49.960 23.280 45.280 1.00 0.00 ATOM 2405 2C31 DPP 20 51.560 22.170 44.440 1.00 0.00 ATOM 2406 H12X DPP 20 52.560 21.780 44.710 1.00 0.00 ATOM 2407 H12Y DPP 20 51.650 22.930 43.630 1.00 0.00 ATOM 2408 3C31 DPP 20 50.560 21.200 43.810 1.00 0.00 ATOM 2409 H13X DPP 20 50.370 20.370 44.530 1.00 0.00 ATOM 2410 H13Y DPP 20 51.140 20.780 42.950 1.00 0.00 ATOM 2411 4C31 DPP 20 49.330 21.900 43.240 1.00 0.00 ATOM 2412 H14X DPP 20 49.490 23.000 43.150 1.00 0.00 ATOM 2413 H14Y DPP 20 48.530 21.880 44.010 1.00 0.00 ATOM 2414 5C31 DPP 20 48.710 21.280 41.990 1.00 0.00 ATOM 2415 H15X DPP 20 49.030 20.230 42.120 1.00 0.00 ATOM 2416 H15Y DPP 20 49.360 21.710 41.200 1.00 0.00 ATOM 2417 6C31 DPP 20 47.240 21.650 41.790 1.00 0.00 ATOM 2418 H16X DPP 20 46.570 21.450 42.660 1.00 0.00 ATOM 2419 H16Y DPP 20 46.830 21.060 40.950 1.00 0.00 ATOM 2420 H16Z DPP 20 47.070 22.720 41.550 1.00 0.00 ATOM 2421 N DPP 21 16.900 9.310 64.830 1.00 0.00 ATOM 2422 HN1 DPP 21 15.920 9.670 64.820 1.00 0.00 ATOM 2423 HN2 DPP 21 17.490 10.080 65.210 1.00 0.00 ATOM 2424 HN3 DPP 21 17.060 8.480 65.440 1.00 0.00 ATOM 2425 C12 DPP 21 17.280 8.900 63.430 1.00 0.00 ATOM 2426 H12A DPP 21 17.590 9.800 62.850 1.00 0.00 ATOM 2427 H12B DPP 21 16.450 8.410 62.890 1.00 0.00 ATOM 2428 C11 DPP 21 18.420 7.890 63.460 1.00 0.00 ATOM 2429 H11A DPP 21 19.300 8.440 63.880 1.00 0.00 ATOM 2430 H11B DPP 21 18.800 7.660 62.440 1.00 0.00 ATOM 2431 P DPP 21 18.870 5.350 63.850 1.00 0.00 ATOM 2432 O13 DPP 21 18.470 4.390 64.890 1.00 0.00 ATOM 2433 O14 DPP 21 20.300 5.740 63.850 1.00 0.00 ATOM 2434 O11 DPP 21 18.350 4.990 62.380 1.00 0.00 ATOM 2435 O12 DPP 21 18.070 6.700 64.180 1.00 0.00 ATOM 2436 C1 DPP 21 18.840 3.730 61.910 1.00 0.00 ATOM 2437 HA DPP 21 18.130 3.590 61.070 1.00 0.00 ATOM 2438 HB DPP 21 18.750 2.950 62.700 1.00 0.00 ATOM 2439 C2 DPP 21 20.200 3.920 61.230 1.00 0.00 ATOM 2440 HS DPP 21 20.820 4.070 62.140 1.00 0.00 ATOM 2441 O21 DPP 21 20.170 5.070 60.390 1.00 0.00 ATOM 2442 C21 DPP 21 21.380 5.600 60.200 1.00 0.00 ATOM 2443 O22 DPP 21 22.440 5.110 60.560 1.00 0.00 ATOM 2444 C22 DPP 21 21.320 6.950 59.490 1.00 0.00 ATOM 2445 H2R DPP 21 21.200 7.800 60.190 1.00 0.00 ATOM 2446 H2S DPP 21 20.380 7.010 58.900 1.00 0.00 ATOM 2447 C3 DPP 21 20.530 2.620 60.470 1.00 0.00 ATOM 2448 HX DPP 21 20.410 1.740 61.140 1.00 0.00 ATOM 2449 HY DPP 21 21.550 2.560 60.040 1.00 0.00 ATOM 2450 O31 DPP 21 19.570 2.380 59.440 1.00 0.00 ATOM 2451 C31 DPP 21 19.710 2.980 58.260 1.00 0.00 ATOM 2452 O32 DPP 21 20.750 3.420 57.800 1.00 0.00 ATOM 2453 C32 DPP 21 18.390 2.760 57.540 1.00 0.00 ATOM 2454 H2X DPP 21 17.670 3.420 58.090 1.00 0.00 ATOM 2455 H2Y DPP 21 18.130 1.690 57.690 1.00 0.00 ATOM 2456 C23 DPP 21 22.470 7.120 58.500 1.00 0.00 ATOM 2457 H3R DPP 21 23.460 7.230 59.000 1.00 0.00 ATOM 2458 H3S DPP 21 22.360 8.070 57.930 1.00 0.00 ATOM 2459 C24 DPP 21 22.520 6.090 57.380 1.00 0.00 ATOM 2460 H4R DPP 21 21.480 6.090 57.000 1.00 0.00 ATOM 2461 H4S DPP 21 22.740 5.120 57.890 1.00 0.00 ATOM 2462 C25 DPP 21 23.620 6.320 56.340 1.00 0.00 ATOM 2463 H5R DPP 21 24.620 6.500 56.800 1.00 0.00 ATOM 2464 H5S DPP 21 23.270 7.220 55.770 1.00 0.00 ATOM 2465 C26 DPP 21 23.800 5.270 55.250 1.00 0.00 ATOM 2466 H6R DPP 21 24.240 4.320 55.630 1.00 0.00 ATOM 2467 H6S DPP 21 24.500 5.640 54.470 1.00 0.00 ATOM 2468 C27 DPP 21 22.480 4.970 54.530 1.00 0.00 ATOM 2469 H7R DPP 21 21.880 5.880 54.340 1.00 0.00 ATOM 2470 H7S DPP 21 21.800 4.390 55.190 1.00 0.00 ATOM 2471 C28 DPP 21 22.810 4.340 53.170 1.00 0.00 ATOM 2472 H8R DPP 21 21.900 3.830 52.790 1.00 0.00 ATOM 2473 H8S DPP 21 23.630 3.600 53.170 1.00 0.00 ATOM 2474 C29 DPP 21 23.250 5.230 52.010 1.00 0.00 ATOM 2475 H9R DPP 21 23.530 4.660 51.100 1.00 0.00 ATOM 2476 H9S DPP 21 24.080 5.800 52.470 1.00 0.00 ATOM 2477 0C21 DPP 21 22.320 6.380 51.610 1.00 0.00 ATOM 2478 H10R DPP 21 22.280 7.110 52.450 1.00 0.00 ATOM 2479 H10S DPP 21 21.280 6.050 51.410 1.00 0.00 ATOM 2480 1C21 DPP 21 22.670 7.240 50.400 1.00 0.00 ATOM 2481 H11R DPP 21 22.950 6.610 49.530 1.00 0.00 ATOM 2482 H11S DPP 21 23.460 7.990 50.620 1.00 0.00 ATOM 2483 2C21 DPP 21 21.420 7.960 49.880 1.00 0.00 ATOM 2484 H12R DPP 21 20.980 8.420 50.790 1.00 0.00 ATOM 2485 H12S DPP 21 20.730 7.200 49.470 1.00 0.00 ATOM 2486 3C21 DPP 21 21.720 8.930 48.730 1.00 0.00 ATOM 2487 H13R DPP 21 21.930 8.370 47.800 1.00 0.00 ATOM 2488 H13S DPP 21 22.630 9.490 49.030 1.00 0.00 ATOM 2489 4C21 DPP 21 20.570 9.900 48.450 1.00 0.00 ATOM 2490 H14R DPP 21 20.640 10.640 49.270 1.00 0.00 ATOM 2491 H14S DPP 21 20.600 10.360 47.440 1.00 0.00 ATOM 2492 5C21 DPP 21 19.140 9.410 48.640 1.00 0.00 ATOM 2493 H15R DPP 21 18.440 10.280 48.740 1.00 0.00 ATOM 2494 H15S DPP 21 19.080 8.740 49.520 1.00 0.00 ATOM 2495 6C21 DPP 21 18.540 8.710 47.420 1.00 0.00 ATOM 2496 H16R DPP 21 17.650 8.070 47.600 1.00 0.00 ATOM 2497 H16S DPP 21 19.300 7.930 47.220 1.00 0.00 ATOM 2498 H16T DPP 21 18.540 9.380 46.540 1.00 0.00 ATOM 2499 C33 DPP 21 18.370 3.180 56.070 1.00 0.00 ATOM 2500 H3X DPP 21 17.350 2.950 55.710 1.00 0.00 ATOM 2501 H3Y DPP 21 19.160 2.690 55.450 1.00 0.00 ATOM 2502 C34 DPP 21 18.470 4.690 55.870 1.00 0.00 ATOM 2503 H4X DPP 21 19.560 4.880 55.950 1.00 0.00 ATOM 2504 H4Y DPP 21 17.970 5.380 56.580 1.00 0.00 ATOM 2505 C35 DPP 21 18.070 5.170 54.470 1.00 0.00 ATOM 2506 H5X DPP 21 18.200 6.270 54.420 1.00 0.00 ATOM 2507 H5Y DPP 21 16.990 4.980 54.340 1.00 0.00 ATOM 2508 C36 DPP 21 18.780 4.580 53.240 1.00 0.00 ATOM 2509 H6X DPP 21 18.920 3.480 53.300 1.00 0.00 ATOM 2510 H6Y DPP 21 19.790 5.020 53.100 1.00 0.00 ATOM 2511 C37 DPP 21 17.990 4.870 51.970 1.00 0.00 ATOM 2512 H7X DPP 21 18.010 5.980 51.910 1.00 0.00 ATOM 2513 H7Y DPP 21 16.920 4.590 52.060 1.00 0.00 ATOM 2514 C38 DPP 21 18.820 4.290 50.820 1.00 0.00 ATOM 2515 H8X DPP 21 18.820 3.180 50.750 1.00 0.00 ATOM 2516 H8Y DPP 21 19.900 4.490 51.000 1.00 0.00 ATOM 2517 C39 DPP 21 18.440 4.910 49.480 1.00 0.00 ATOM 2518 H9X DPP 21 18.420 6.010 49.660 1.00 0.00 ATOM 2519 H9Y DPP 21 17.450 4.590 49.070 1.00 0.00 ATOM 2520 0C31 DPP 21 19.470 4.660 48.380 1.00 0.00 ATOM 2521 H10X DPP 21 19.760 3.610 48.190 1.00 0.00 ATOM 2522 H10Y DPP 21 20.360 5.300 48.570 1.00 0.00 ATOM 2523 1C31 DPP 21 18.880 5.140 47.040 1.00 0.00 ATOM 2524 H11X DPP 21 18.260 6.040 47.200 1.00 0.00 ATOM 2525 H11Y DPP 21 18.170 4.380 46.660 1.00 0.00 ATOM 2526 2C31 DPP 21 19.860 5.230 45.870 1.00 0.00 ATOM 2527 H12X DPP 21 20.530 6.090 46.080 1.00 0.00 ATOM 2528 H12Y DPP 21 19.190 5.640 45.090 1.00 0.00 ATOM 2529 3C31 DPP 21 20.710 4.050 45.390 1.00 0.00 ATOM 2530 H13X DPP 21 21.510 3.850 46.140 1.00 0.00 ATOM 2531 H13Y DPP 21 21.000 4.250 44.340 1.00 0.00 ATOM 2532 4C31 DPP 21 19.900 2.750 45.420 1.00 0.00 ATOM 2533 H14X DPP 21 18.910 2.990 44.970 1.00 0.00 ATOM 2534 H14Y DPP 21 19.720 2.350 46.440 1.00 0.00 ATOM 2535 5C31 DPP 21 20.720 1.730 44.630 1.00 0.00 ATOM 2536 H15X DPP 21 21.690 2.120 44.260 1.00 0.00 ATOM 2537 H15Y DPP 21 20.080 1.460 43.770 1.00 0.00 ATOM 2538 6C31 DPP 21 20.900 0.390 45.330 1.00 0.00 ATOM 2539 H16X DPP 21 21.260 -0.330 44.570 1.00 0.00 ATOM 2540 H16Y DPP 21 20.010 0.020 45.880 1.00 0.00 ATOM 2541 H16Z DPP 21 21.760 0.450 46.030 1.00 0.00 ATOM 2542 N DPP 22 54.090 39.850 65.600 1.00 0.00 ATOM 2543 HN1 DPP 22 54.370 40.290 66.490 1.00 0.00 ATOM 2544 HN2 DPP 22 54.180 38.850 65.860 1.00 0.00 ATOM 2545 HN3 DPP 22 54.810 40.040 64.870 1.00 0.00 ATOM 2546 C12 DPP 22 52.640 40.200 65.360 1.00 0.00 ATOM 2547 H12A DPP 22 52.200 40.260 66.380 1.00 0.00 ATOM 2548 H12B DPP 22 52.540 41.210 64.910 1.00 0.00 ATOM 2549 C11 DPP 22 51.980 39.180 64.420 1.00 0.00 ATOM 2550 H11A DPP 22 51.040 39.630 64.030 1.00 0.00 ATOM 2551 H11B DPP 22 51.810 38.360 65.150 1.00 0.00 ATOM 2552 P DPP 22 52.270 37.850 62.320 1.00 0.00 ATOM 2553 O13 DPP 22 50.870 37.530 62.660 1.00 0.00 ATOM 2554 O14 DPP 22 53.280 36.790 62.080 1.00 0.00 ATOM 2555 O11 DPP 22 52.230 38.730 60.990 1.00 0.00 ATOM 2556 O12 DPP 22 52.920 38.830 63.410 1.00 0.00 ATOM 2557 C1 DPP 22 53.350 39.590 60.720 1.00 0.00 ATOM 2558 HA DPP 22 53.520 39.560 59.620 1.00 0.00 ATOM 2559 HB DPP 22 54.280 39.150 61.150 1.00 0.00 ATOM 2560 C2 DPP 22 53.230 41.020 61.260 1.00 0.00 ATOM 2561 HS DPP 22 53.620 41.040 62.300 1.00 0.00 ATOM 2562 O21 DPP 22 51.870 41.480 61.260 1.00 0.00 ATOM 2563 C21 DPP 22 51.630 42.490 62.100 1.00 0.00 ATOM 2564 O22 DPP 22 52.410 43.030 62.860 1.00 0.00 ATOM 2565 C22 DPP 22 50.270 43.110 61.820 1.00 0.00 ATOM 2566 H2R DPP 22 50.460 44.110 61.380 1.00 0.00 ATOM 2567 H2S DPP 22 49.740 43.350 62.770 1.00 0.00 ATOM 2568 C3 DPP 22 53.980 41.980 60.330 1.00 0.00 ATOM 2569 HX DPP 22 55.040 41.710 60.520 1.00 0.00 ATOM 2570 HY DPP 22 53.800 43.060 60.530 1.00 0.00 ATOM 2571 O31 DPP 22 53.560 41.670 59.000 1.00 0.00 ATOM 2572 C31 DPP 22 52.700 42.490 58.390 1.00 0.00 ATOM 2573 O32 DPP 22 52.060 43.370 58.940 1.00 0.00 ATOM 2574 C32 DPP 22 52.720 42.200 56.890 1.00 0.00 ATOM 2575 H2X DPP 22 52.200 41.220 56.840 1.00 0.00 ATOM 2576 H2Y DPP 22 53.710 42.080 56.410 1.00 0.00 ATOM 2577 C23 DPP 22 49.430 42.430 60.740 1.00 0.00 ATOM 2578 H3R DPP 22 50.120 42.370 59.870 1.00 0.00 ATOM 2579 H3S DPP 22 48.520 43.030 60.530 1.00 0.00 ATOM 2580 C24 DPP 22 48.870 41.070 61.160 1.00 0.00 ATOM 2581 H4R DPP 22 48.240 41.120 62.070 1.00 0.00 ATOM 2582 H4S DPP 22 49.670 40.320 61.370 1.00 0.00 ATOM 2583 C25 DPP 22 48.070 40.480 60.000 1.00 0.00 ATOM 2584 H5R DPP 22 47.120 41.050 60.000 1.00 0.00 ATOM 2585 H5S DPP 22 47.730 39.480 60.350 1.00 0.00 ATOM 2586 C26 DPP 22 48.660 40.310 58.600 1.00 0.00 ATOM 2587 H6R DPP 22 49.440 39.520 58.600 1.00 0.00 ATOM 2588 H6S DPP 22 49.190 41.190 58.190 1.00 0.00 ATOM 2589 C27 DPP 22 47.700 39.870 57.490 1.00 0.00 ATOM 2590 H7R DPP 22 46.790 40.510 57.440 1.00 0.00 ATOM 2591 H7S DPP 22 47.410 38.800 57.540 1.00 0.00 ATOM 2592 C28 DPP 22 48.220 40.120 56.070 1.00 0.00 ATOM 2593 H8R DPP 22 49.210 39.750 55.750 1.00 0.00 ATOM 2594 H8S DPP 22 48.140 41.230 56.080 1.00 0.00 ATOM 2595 C29 DPP 22 47.190 39.640 55.050 1.00 0.00 ATOM 2596 H9R DPP 22 46.140 39.680 55.410 1.00 0.00 ATOM 2597 H9S DPP 22 47.350 38.550 54.930 1.00 0.00 ATOM 2598 0C21 DPP 22 47.420 40.260 53.670 1.00 0.00 ATOM 2599 H10R DPP 22 47.430 41.340 53.900 1.00 0.00 ATOM 2600 H10S DPP 22 46.660 40.090 52.880 1.00 0.00 ATOM 2601 1C21 DPP 22 48.660 39.840 52.870 1.00 0.00 ATOM 2602 H11R DPP 22 48.830 38.740 52.820 1.00 0.00 ATOM 2603 H11S DPP 22 49.510 40.390 53.330 1.00 0.00 ATOM 2604 2C21 DPP 22 48.600 40.280 51.410 1.00 0.00 ATOM 2605 H12R DPP 22 48.250 41.310 51.180 1.00 0.00 ATOM 2606 H12S DPP 22 47.860 39.640 50.890 1.00 0.00 ATOM 2607 3C21 DPP 22 49.940 40.260 50.670 1.00 0.00 ATOM 2608 H13R DPP 22 50.570 39.470 51.130 1.00 0.00 ATOM 2609 H13S DPP 22 50.340 41.270 50.880 1.00 0.00 ATOM 2610 4C21 DPP 22 50.020 40.110 49.150 1.00 0.00 ATOM 2611 H14R DPP 22 49.320 40.870 48.740 1.00 0.00 ATOM 2612 H14S DPP 22 49.410 39.210 48.900 1.00 0.00 ATOM 2613 5C21 DPP 22 51.340 40.070 48.380 1.00 0.00 ATOM 2614 H15R DPP 22 51.920 39.150 48.640 1.00 0.00 ATOM 2615 H15S DPP 22 51.920 40.980 48.650 1.00 0.00 ATOM 2616 6C21 DPP 22 51.190 40.100 46.860 1.00 0.00 ATOM 2617 H16R DPP 22 50.750 41.060 46.530 1.00 0.00 ATOM 2618 H16S DPP 22 50.560 39.280 46.440 1.00 0.00 ATOM 2619 H16T DPP 22 52.180 39.870 46.430 1.00 0.00 ATOM 2620 C33 DPP 22 51.880 43.300 56.240 1.00 0.00 ATOM 2621 H3X DPP 22 52.260 44.330 56.450 1.00 0.00 ATOM 2622 H3Y DPP 22 50.870 43.140 56.660 1.00 0.00 ATOM 2623 C34 DPP 22 51.870 43.230 54.710 1.00 0.00 ATOM 2624 H4X DPP 22 51.470 42.290 54.290 1.00 0.00 ATOM 2625 H4Y DPP 22 52.950 43.260 54.440 1.00 0.00 ATOM 2626 C35 DPP 22 50.980 44.310 54.110 1.00 0.00 ATOM 2627 H5X DPP 22 51.170 45.330 54.520 1.00 0.00 ATOM 2628 H5Y DPP 22 49.960 44.090 54.490 1.00 0.00 ATOM 2629 C36 DPP 22 50.660 44.400 52.620 1.00 0.00 ATOM 2630 H6X DPP 22 50.460 43.340 52.350 1.00 0.00 ATOM 2631 H6Y DPP 22 51.550 44.660 52.010 1.00 0.00 ATOM 2632 C37 DPP 22 49.440 45.320 52.440 1.00 0.00 ATOM 2633 H7X DPP 22 49.640 46.270 52.980 1.00 0.00 ATOM 2634 H7Y DPP 22 48.590 44.830 52.950 1.00 0.00 ATOM 2635 C38 DPP 22 49.180 45.560 50.950 1.00 0.00 ATOM 2636 H8X DPP 22 49.970 46.240 50.570 1.00 0.00 ATOM 2637 H8Y DPP 22 48.150 45.930 50.760 1.00 0.00 ATOM 2638 C39 DPP 22 49.110 44.220 50.200 1.00 0.00 ATOM 2639 H9X DPP 22 48.490 43.500 50.780 1.00 0.00 ATOM 2640 H9Y DPP 22 50.130 43.790 50.240 1.00 0.00 ATOM 2641 0C31 DPP 22 48.540 44.200 48.780 1.00 0.00 ATOM 2642 H10X DPP 22 47.570 44.730 48.840 1.00 0.00 ATOM 2643 H10Y DPP 22 48.290 43.170 48.440 1.00 0.00 ATOM 2644 1C31 DPP 22 49.470 44.950 47.820 1.00 0.00 ATOM 2645 H11X DPP 22 50.170 44.290 47.270 1.00 0.00 ATOM 2646 H11Y DPP 22 50.050 45.740 48.340 1.00 0.00 ATOM 2647 2C31 DPP 22 48.750 45.720 46.710 1.00 0.00 ATOM 2648 H12X DPP 22 49.520 46.340 46.210 1.00 0.00 ATOM 2649 H12Y DPP 22 48.130 46.510 47.180 1.00 0.00 ATOM 2650 3C31 DPP 22 48.030 44.810 45.710 1.00 0.00 ATOM 2651 H13X DPP 22 47.260 44.260 46.280 1.00 0.00 ATOM 2652 H13Y DPP 22 48.740 44.110 45.200 1.00 0.00 ATOM 2653 4C31 DPP 22 47.230 45.460 44.580 1.00 0.00 ATOM 2654 H14X DPP 22 47.970 45.990 43.940 1.00 0.00 ATOM 2655 H14Y DPP 22 46.540 46.140 45.130 1.00 0.00 ATOM 2656 5C31 DPP 22 46.420 44.450 43.770 1.00 0.00 ATOM 2657 H15X DPP 22 45.560 44.220 44.440 1.00 0.00 ATOM 2658 H15Y DPP 22 47.000 43.530 43.500 1.00 0.00 ATOM 2659 6C31 DPP 22 45.860 45.150 42.530 1.00 0.00 ATOM 2660 H16X DPP 22 45.220 45.980 42.880 1.00 0.00 ATOM 2661 H16Y DPP 22 45.230 44.390 42.020 1.00 0.00 ATOM 2662 H16Z DPP 22 46.670 45.510 41.870 1.00 0.00 ATOM 2663 N DPP 23 58.210 57.530 64.270 1.00 0.00 ATOM 2664 HN1 DPP 23 57.960 58.470 63.900 1.00 0.00 ATOM 2665 HN2 DPP 23 58.830 57.030 63.610 1.00 0.00 ATOM 2666 HN3 DPP 23 57.340 56.990 64.420 1.00 0.00 ATOM 2667 C12 DPP 23 59.120 57.770 65.460 1.00 0.00 ATOM 2668 H12A DPP 23 58.860 57.210 66.380 1.00 0.00 ATOM 2669 H12B DPP 23 58.850 58.820 65.710 1.00 0.00 ATOM 2670 C11 DPP 23 60.600 57.700 65.080 1.00 0.00 ATOM 2671 H11A DPP 23 60.850 56.620 65.170 1.00 0.00 ATOM 2672 H11B DPP 23 61.010 58.320 65.900 1.00 0.00 ATOM 2673 P DPP 23 61.610 57.260 62.840 1.00 0.00 ATOM 2674 O13 DPP 23 60.720 56.130 62.480 1.00 0.00 ATOM 2675 O14 DPP 23 62.950 56.940 63.370 1.00 0.00 ATOM 2676 O11 DPP 23 61.820 58.050 61.460 1.00 0.00 ATOM 2677 O12 DPP 23 60.770 58.250 63.770 1.00 0.00 ATOM 2678 C1 DPP 23 60.710 58.810 60.990 1.00 0.00 ATOM 2679 HA DPP 23 61.120 59.590 60.320 1.00 0.00 ATOM 2680 HB DPP 23 60.120 59.320 61.780 1.00 0.00 ATOM 2681 C2 DPP 23 59.750 58.040 60.070 1.00 0.00 ATOM 2682 HS DPP 23 59.020 57.530 60.730 1.00 0.00 ATOM 2683 O21 DPP 23 60.390 57.020 59.290 1.00 0.00 ATOM 2684 C21 DPP 23 59.810 55.840 59.130 1.00 0.00 ATOM 2685 O22 DPP 23 58.810 55.500 59.750 1.00 0.00 ATOM 2686 C22 DPP 23 60.460 54.900 58.120 1.00 0.00 ATOM 2687 H2R DPP 23 61.530 54.790 58.410 1.00 0.00 ATOM 2688 H2S DPP 23 60.460 55.370 57.120 1.00 0.00 ATOM 2689 C3 DPP 23 58.900 58.960 59.180 1.00 0.00 ATOM 2690 HX DPP 23 58.250 59.690 59.720 1.00 0.00 ATOM 2691 HY DPP 23 58.060 58.360 58.770 1.00 0.00 ATOM 2692 O31 DPP 23 59.720 59.700 58.270 1.00 0.00 ATOM 2693 C31 DPP 23 59.830 59.270 57.020 1.00 0.00 ATOM 2694 O32 DPP 23 59.190 58.340 56.540 1.00 0.00 ATOM 2695 C32 DPP 23 60.930 60.040 56.290 1.00 0.00 ATOM 2696 H2X DPP 23 61.850 59.830 56.870 1.00 0.00 ATOM 2697 H2Y DPP 23 60.880 61.150 56.250 1.00 0.00 ATOM 2698 C23 DPP 23 59.730 53.570 57.950 1.00 0.00 ATOM 2699 H3R DPP 23 58.640 53.740 58.120 1.00 0.00 ATOM 2700 H3S DPP 23 60.150 52.820 58.660 1.00 0.00 ATOM 2701 C24 DPP 23 59.760 53.060 56.510 1.00 0.00 ATOM 2702 H4R DPP 23 60.770 53.370 56.160 1.00 0.00 ATOM 2703 H4S DPP 23 58.980 53.480 55.840 1.00 0.00 ATOM 2704 C25 DPP 23 59.600 51.550 56.350 1.00 0.00 ATOM 2705 H5R DPP 23 60.450 51.040 56.850 1.00 0.00 ATOM 2706 H5S DPP 23 59.860 51.340 55.290 1.00 0.00 ATOM 2707 C26 DPP 23 58.260 51.000 56.830 1.00 0.00 ATOM 2708 H6R DPP 23 57.540 51.680 56.320 1.00 0.00 ATOM 2709 H6S DPP 23 58.060 51.070 57.920 1.00 0.00 ATOM 2710 C27 DPP 23 57.970 49.560 56.380 1.00 0.00 ATOM 2711 H7R DPP 23 56.860 49.530 56.440 1.00 0.00 ATOM 2712 H7S DPP 23 58.440 48.830 57.080 1.00 0.00 ATOM 2713 C28 DPP 23 58.250 49.380 54.890 1.00 0.00 ATOM 2714 H8R DPP 23 59.320 49.170 54.710 1.00 0.00 ATOM 2715 H8S DPP 23 58.160 50.340 54.340 1.00 0.00 ATOM 2716 C29 DPP 23 57.440 48.220 54.300 1.00 0.00 ATOM 2717 H9R DPP 23 57.410 47.420 55.070 1.00 0.00 ATOM 2718 H9S DPP 23 58.050 47.750 53.500 1.00 0.00 ATOM 2719 0C21 DPP 23 55.990 48.470 53.870 1.00 0.00 ATOM 2720 H10R DPP 23 56.060 49.330 53.160 1.00 0.00 ATOM 2721 H10S DPP 23 55.200 48.840 54.550 1.00 0.00 ATOM 2722 1C21 DPP 23 55.480 47.340 52.980 1.00 0.00 ATOM 2723 H11R DPP 23 54.830 46.650 53.560 1.00 0.00 ATOM 2724 H11S DPP 23 56.360 46.860 52.500 1.00 0.00 ATOM 2725 2C21 DPP 23 54.680 47.740 51.730 1.00 0.00 ATOM 2726 H12R DPP 23 55.140 48.610 51.220 1.00 0.00 ATOM 2727 H12S DPP 23 53.710 48.190 52.030 1.00 0.00 ATOM 2728 3C21 DPP 23 54.270 46.660 50.730 1.00 0.00 ATOM 2729 H13R DPP 23 53.880 45.800 51.310 1.00 0.00 ATOM 2730 H13S DPP 23 55.210 46.410 50.210 1.00 0.00 ATOM 2731 4C21 DPP 23 53.350 47.010 49.560 1.00 0.00 ATOM 2732 H14R DPP 23 53.540 48.050 49.220 1.00 0.00 ATOM 2733 H14S DPP 23 52.300 47.020 49.950 1.00 0.00 ATOM 2734 5C21 DPP 23 53.390 45.990 48.420 1.00 0.00 ATOM 2735 H15R DPP 23 54.340 46.170 47.880 1.00 0.00 ATOM 2736 H15S DPP 23 52.650 46.330 47.660 1.00 0.00 ATOM 2737 6C21 DPP 23 53.220 44.520 48.810 1.00 0.00 ATOM 2738 H16R DPP 23 52.200 44.250 49.160 1.00 0.00 ATOM 2739 H16S DPP 23 53.980 44.250 49.570 1.00 0.00 ATOM 2740 H16T DPP 23 53.600 43.880 47.990 1.00 0.00 ATOM 2741 C33 DPP 23 61.050 59.650 54.810 1.00 0.00 ATOM 2742 H3X DPP 23 60.580 60.460 54.220 1.00 0.00 ATOM 2743 H3Y DPP 23 60.530 58.690 54.610 1.00 0.00 ATOM 2744 C34 DPP 23 62.470 59.570 54.250 1.00 0.00 ATOM 2745 H4X DPP 23 63.160 59.030 54.940 1.00 0.00 ATOM 2746 H4Y DPP 23 62.890 60.600 54.200 1.00 0.00 ATOM 2747 C35 DPP 23 62.470 58.920 52.860 1.00 0.00 ATOM 2748 H5X DPP 23 62.070 59.610 52.090 1.00 0.00 ATOM 2749 H5Y DPP 23 61.800 58.040 52.960 1.00 0.00 ATOM 2750 C36 DPP 23 63.890 58.470 52.520 1.00 0.00 ATOM 2751 H6X DPP 23 64.180 57.870 53.420 1.00 0.00 ATOM 2752 H6Y DPP 23 64.530 59.380 52.520 1.00 0.00 ATOM 2753 C37 DPP 23 64.110 57.950 51.100 1.00 0.00 ATOM 2754 H7X DPP 23 63.730 58.690 50.370 1.00 0.00 ATOM 2755 H7Y DPP 23 63.480 57.050 50.940 1.00 0.00 ATOM 2756 C38 DPP 23 65.560 57.490 50.920 1.00 0.00 ATOM 2757 H8X DPP 23 65.820 56.650 51.600 1.00 0.00 ATOM 2758 H8Y DPP 23 66.190 58.360 51.190 1.00 0.00 ATOM 2759 C39 DPP 23 65.730 57.160 49.430 1.00 0.00 ATOM 2760 H9X DPP 23 65.420 58.050 48.850 1.00 0.00 ATOM 2761 H9Y DPP 23 65.130 56.280 49.110 1.00 0.00 ATOM 2762 0C31 DPP 23 67.210 56.850 49.230 1.00 0.00 ATOM 2763 H10X DPP 23 67.440 55.880 49.710 1.00 0.00 ATOM 2764 H10Y DPP 23 67.730 57.690 49.740 1.00 0.00 ATOM 2765 1C31 DPP 23 67.640 56.840 47.760 1.00 0.00 ATOM 2766 H11X DPP 23 68.750 56.830 47.820 1.00 0.00 ATOM 2767 H11Y DPP 23 67.270 57.720 47.190 1.00 0.00 ATOM 2768 2C31 DPP 23 67.070 55.580 47.120 1.00 0.00 ATOM 2769 H12X DPP 23 66.040 55.310 47.440 1.00 0.00 ATOM 2770 H12Y DPP 23 67.720 54.700 47.340 1.00 0.00 ATOM 2771 3C31 DPP 23 66.960 55.640 45.600 1.00 0.00 ATOM 2772 H13X DPP 23 67.920 56.100 45.300 1.00 0.00 ATOM 2773 H13Y DPP 23 66.110 56.290 45.280 1.00 0.00 ATOM 2774 4C31 DPP 23 66.610 54.240 45.090 1.00 0.00 ATOM 2775 H14X DPP 23 65.730 53.890 45.670 1.00 0.00 ATOM 2776 H14Y DPP 23 67.340 53.420 45.230 1.00 0.00 ATOM 2777 5C31 DPP 23 65.960 54.270 43.710 1.00 0.00 ATOM 2778 H15X DPP 23 66.810 54.460 43.020 1.00 0.00 ATOM 2779 H15Y DPP 23 65.420 55.230 43.580 1.00 0.00 ATOM 2780 6C31 DPP 23 65.180 53.020 43.300 1.00 0.00 ATOM 2781 H16X DPP 23 64.770 52.640 44.260 1.00 0.00 ATOM 2782 H16Y DPP 23 65.860 52.300 42.800 1.00 0.00 ATOM 2783 H16Z DPP 23 64.390 53.400 42.620 1.00 0.00 ATOM 2784 N DPP 24 16.490 42.130 66.720 1.00 0.00 ATOM 2785 HN1 DPP 24 17.080 42.010 65.870 1.00 0.00 ATOM 2786 HN2 DPP 24 16.170 41.230 67.120 1.00 0.00 ATOM 2787 HN3 DPP 24 15.660 42.640 66.360 1.00 0.00 ATOM 2788 C12 DPP 24 17.290 42.870 67.770 1.00 0.00 ATOM 2789 H12A DPP 24 16.540 43.290 68.470 1.00 0.00 ATOM 2790 H12B DPP 24 17.930 42.160 68.320 1.00 0.00 ATOM 2791 C11 DPP 24 18.160 43.950 67.120 1.00 0.00 ATOM 2792 H11A DPP 24 18.600 44.710 67.800 1.00 0.00 ATOM 2793 H11B DPP 24 17.590 44.570 66.400 1.00 0.00 ATOM 2794 P DPP 24 20.500 44.050 66.120 1.00 0.00 ATOM 2795 O13 DPP 24 21.410 43.680 67.230 1.00 0.00 ATOM 2796 O14 DPP 24 20.140 45.470 65.920 1.00 0.00 ATOM 2797 O11 DPP 24 21.070 43.470 64.750 1.00 0.00 ATOM 2798 O12 DPP 24 19.110 43.270 66.290 1.00 0.00 ATOM 2799 C1 DPP 24 21.730 42.200 64.830 1.00 0.00 ATOM 2800 HA DPP 24 21.450 41.560 65.690 1.00 0.00 ATOM 2801 HB DPP 24 22.830 42.340 64.930 1.00 0.00 ATOM 2802 C2 DPP 24 21.460 41.350 63.580 1.00 0.00 ATOM 2803 HS DPP 24 22.070 40.420 63.630 1.00 0.00 ATOM 2804 O21 DPP 24 21.730 42.070 62.380 1.00 0.00 ATOM 2805 C21 DPP 24 22.370 41.370 61.440 1.00 0.00 ATOM 2806 O22 DPP 24 22.770 40.220 61.490 1.00 0.00 ATOM 2807 C22 DPP 24 22.480 42.420 60.340 1.00 0.00 ATOM 2808 H2R DPP 24 23.320 43.120 60.530 1.00 0.00 ATOM 2809 H2S DPP 24 21.600 43.100 60.290 1.00 0.00 ATOM 2810 C3 DPP 24 20.000 40.860 63.640 1.00 0.00 ATOM 2811 HX DPP 24 19.290 41.710 63.640 1.00 0.00 ATOM 2812 HY DPP 24 19.780 40.340 64.600 1.00 0.00 ATOM 2813 O31 DPP 24 19.730 39.990 62.540 1.00 0.00 ATOM 2814 C31 DPP 24 20.020 38.700 62.710 1.00 0.00 ATOM 2815 O32 DPP 24 20.530 38.200 63.700 1.00 0.00 ATOM 2816 C32 DPP 24 19.640 37.790 61.550 1.00 0.00 ATOM 2817 H2X DPP 24 18.970 38.410 60.920 1.00 0.00 ATOM 2818 H2Y DPP 24 19.010 36.980 61.980 1.00 0.00 ATOM 2819 C23 DPP 24 22.600 41.810 58.940 1.00 0.00 ATOM 2820 H3R DPP 24 21.750 41.120 58.740 1.00 0.00 ATOM 2821 H3S DPP 24 23.470 41.130 58.830 1.00 0.00 ATOM 2822 C24 DPP 24 22.720 42.810 57.780 1.00 0.00 ATOM 2823 H4R DPP 24 21.870 43.530 57.730 1.00 0.00 ATOM 2824 H4S DPP 24 22.710 42.240 56.830 1.00 0.00 ATOM 2825 C25 DPP 24 23.960 43.690 57.710 1.00 0.00 ATOM 2826 H5R DPP 24 24.920 43.130 57.740 1.00 0.00 ATOM 2827 H5S DPP 24 24.050 44.170 58.700 1.00 0.00 ATOM 2828 C26 DPP 24 23.910 44.700 56.550 1.00 0.00 ATOM 2829 H6R DPP 24 24.660 45.490 56.740 1.00 0.00 ATOM 2830 H6S DPP 24 22.880 45.130 56.570 1.00 0.00 ATOM 2831 C27 DPP 24 24.160 44.070 55.180 1.00 0.00 ATOM 2832 H7R DPP 24 23.370 43.370 54.830 1.00 0.00 ATOM 2833 H7S DPP 24 25.180 43.630 55.240 1.00 0.00 ATOM 2834 C28 DPP 24 24.490 45.070 54.070 1.00 0.00 ATOM 2835 H8R DPP 24 25.450 45.590 54.310 1.00 0.00 ATOM 2836 H8S DPP 24 23.680 45.830 54.010 1.00 0.00 ATOM 2837 C29 DPP 24 24.750 44.470 52.690 1.00 0.00 ATOM 2838 H9R DPP 24 23.820 44.040 52.260 1.00 0.00 ATOM 2839 H9S DPP 24 25.480 43.630 52.800 1.00 0.00 ATOM 2840 0C21 DPP 24 25.210 45.570 51.740 1.00 0.00 ATOM 2841 H10R DPP 24 26.270 45.810 51.990 1.00 0.00 ATOM 2842 H10S DPP 24 24.490 46.400 51.890 1.00 0.00 ATOM 2843 1C21 DPP 24 25.160 45.120 50.280 1.00 0.00 ATOM 2844 H11R DPP 24 24.280 44.470 50.110 1.00 0.00 ATOM 2845 H11S DPP 24 26.120 44.580 50.130 1.00 0.00 ATOM 2846 2C21 DPP 24 25.160 46.270 49.260 1.00 0.00 ATOM 2847 H12R DPP 24 25.880 47.050 49.570 1.00 0.00 ATOM 2848 H12S DPP 24 24.170 46.770 49.370 1.00 0.00 ATOM 2849 3C21 DPP 24 25.510 45.960 47.810 1.00 0.00 ATOM 2850 H13R DPP 24 24.940 45.080 47.430 1.00 0.00 ATOM 2851 H13S DPP 24 26.580 45.690 47.740 1.00 0.00 ATOM 2852 4C21 DPP 24 25.280 47.130 46.850 1.00 0.00 ATOM 2853 H14R DPP 24 25.800 48.000 47.310 1.00 0.00 ATOM 2854 H14S DPP 24 24.200 47.380 46.960 1.00 0.00 ATOM 2855 5C21 DPP 24 25.690 46.910 45.400 1.00 0.00 ATOM 2856 H15R DPP 24 26.730 46.520 45.330 1.00 0.00 ATOM 2857 H15S DPP 24 25.590 47.810 44.760 1.00 0.00 ATOM 2858 6C21 DPP 24 24.960 45.710 44.790 1.00 0.00 ATOM 2859 H16R DPP 24 25.020 44.780 45.390 1.00 0.00 ATOM 2860 H16S DPP 24 25.310 45.520 43.750 1.00 0.00 ATOM 2861 H16T DPP 24 23.910 46.070 44.840 1.00 0.00 ATOM 2862 C33 DPP 24 20.930 37.220 60.980 1.00 0.00 ATOM 2863 H3X DPP 24 21.290 36.310 61.510 1.00 0.00 ATOM 2864 H3Y DPP 24 21.620 38.060 61.210 1.00 0.00 ATOM 2865 C34 DPP 24 20.850 36.960 59.470 1.00 0.00 ATOM 2866 H4X DPP 24 20.320 37.820 59.000 1.00 0.00 ATOM 2867 H4Y DPP 24 20.230 36.070 59.240 1.00 0.00 ATOM 2868 C35 DPP 24 22.130 36.710 58.670 1.00 0.00 ATOM 2869 H5X DPP 24 22.380 35.640 58.790 1.00 0.00 ATOM 2870 H5Y DPP 24 22.940 37.340 59.100 1.00 0.00 ATOM 2871 C36 DPP 24 22.000 37.060 57.180 1.00 0.00 ATOM 2872 H6X DPP 24 21.830 38.160 57.180 1.00 0.00 ATOM 2873 H6Y DPP 24 21.110 36.520 56.800 1.00 0.00 ATOM 2874 C37 DPP 24 23.320 36.740 56.470 1.00 0.00 ATOM 2875 H7X DPP 24 23.470 35.690 56.790 1.00 0.00 ATOM 2876 H7Y DPP 24 24.250 37.270 56.740 1.00 0.00 ATOM 2877 C38 DPP 24 23.070 36.770 54.960 1.00 0.00 ATOM 2878 H8X DPP 24 23.050 37.810 54.580 1.00 0.00 ATOM 2879 H8Y DPP 24 22.060 36.340 54.750 1.00 0.00 ATOM 2880 C39 DPP 24 24.040 35.960 54.090 1.00 0.00 ATOM 2881 H9X DPP 24 24.010 34.950 54.550 1.00 0.00 ATOM 2882 H9Y DPP 24 25.080 36.340 54.180 1.00 0.00 ATOM 2883 0C31 DPP 24 23.610 35.830 52.630 1.00 0.00 ATOM 2884 H10X DPP 24 22.740 35.140 52.550 1.00 0.00 ATOM 2885 H10Y DPP 24 24.370 35.310 52.010 1.00 0.00 ATOM 2886 1C31 DPP 24 23.280 37.150 51.930 1.00 0.00 ATOM 2887 H11X DPP 24 24.030 37.910 52.230 1.00 0.00 ATOM 2888 H11Y DPP 24 22.330 37.520 52.360 1.00 0.00 ATOM 2889 2C31 DPP 24 23.160 37.180 50.400 1.00 0.00 ATOM 2890 H12X DPP 24 22.550 36.340 50.020 1.00 0.00 ATOM 2891 H12Y DPP 24 24.150 36.970 49.940 1.00 0.00 ATOM 2892 3C31 DPP 24 22.600 38.500 49.850 1.00 0.00 ATOM 2893 H13X DPP 24 23.280 39.330 50.140 1.00 0.00 ATOM 2894 H13Y DPP 24 21.550 38.640 50.160 1.00 0.00 ATOM 2895 4C31 DPP 24 22.520 38.320 48.330 1.00 0.00 ATOM 2896 H14X DPP 24 21.880 37.450 48.060 1.00 0.00 ATOM 2897 H14Y DPP 24 23.580 38.240 48.000 1.00 0.00 ATOM 2898 5C31 DPP 24 22.000 39.590 47.650 1.00 0.00 ATOM 2899 H15X DPP 24 22.880 40.270 47.680 1.00 0.00 ATOM 2900 H15Y DPP 24 21.130 39.920 48.250 1.00 0.00 ATOM 2901 6C31 DPP 24 21.510 39.310 46.230 1.00 0.00 ATOM 2902 H16X DPP 24 20.800 40.050 45.800 1.00 0.00 ATOM 2903 H16Y DPP 24 21.030 38.310 46.240 1.00 0.00 ATOM 2904 H16Z DPP 24 22.360 39.180 45.520 1.00 0.00 ATOM 2905 N DPP 25 45.800 38.160 62.540 1.00 0.00 ATOM 2906 HN1 DPP 25 46.780 38.370 62.830 1.00 0.00 ATOM 2907 HN2 DPP 25 45.430 37.530 63.280 1.00 0.00 ATOM 2908 HN3 DPP 25 45.790 37.600 61.660 1.00 0.00 ATOM 2909 C12 DPP 25 44.950 39.320 62.090 1.00 0.00 ATOM 2910 H12A DPP 25 45.630 40.010 61.530 1.00 0.00 ATOM 2911 H12B DPP 25 44.680 39.900 63.000 1.00 0.00 ATOM 2912 C11 DPP 25 43.750 38.930 61.230 1.00 0.00 ATOM 2913 H11A DPP 25 44.230 38.510 60.320 1.00 0.00 ATOM 2914 H11B DPP 25 43.230 39.880 60.970 1.00 0.00 ATOM 2915 P DPP 25 41.890 38.490 62.870 1.00 0.00 ATOM 2916 O13 DPP 25 42.570 39.410 63.810 1.00 0.00 ATOM 2917 O14 DPP 25 41.190 37.310 63.420 1.00 0.00 ATOM 2918 O11 DPP 25 40.930 39.370 61.940 1.00 0.00 ATOM 2919 O12 DPP 25 42.940 37.900 61.800 1.00 0.00 ATOM 2920 C1 DPP 25 39.650 38.830 61.610 1.00 0.00 ATOM 2921 HA DPP 25 39.060 39.670 61.190 1.00 0.00 ATOM 2922 HB DPP 25 39.110 38.460 62.510 1.00 0.00 ATOM 2923 C2 DPP 25 39.740 37.670 60.600 1.00 0.00 ATOM 2924 HS DPP 25 40.150 36.750 61.060 1.00 0.00 ATOM 2925 O21 DPP 25 40.680 38.220 59.680 1.00 0.00 ATOM 2926 C21 DPP 25 41.220 37.260 58.930 1.00 0.00 ATOM 2927 O22 DPP 25 41.060 36.060 59.120 1.00 0.00 ATOM 2928 C22 DPP 25 42.170 37.800 57.880 1.00 0.00 ATOM 2929 H2R DPP 25 42.850 38.570 58.300 1.00 0.00 ATOM 2930 H2S DPP 25 41.420 38.090 57.110 1.00 0.00 ATOM 2931 C3 DPP 25 38.340 37.260 60.120 1.00 0.00 ATOM 2932 HX DPP 25 37.660 38.130 60.210 1.00 0.00 ATOM 2933 HY DPP 25 37.830 36.580 60.840 1.00 0.00 ATOM 2934 O31 DPP 25 38.370 36.720 58.790 1.00 0.00 ATOM 2935 C31 DPP 25 38.170 35.410 58.620 1.00 0.00 ATOM 2936 O32 DPP 25 38.060 34.570 59.500 1.00 0.00 ATOM 2937 C32 DPP 25 38.000 35.180 57.130 1.00 0.00 ATOM 2938 H2X DPP 25 36.950 35.490 56.920 1.00 0.00 ATOM 2939 H2Y DPP 25 38.060 34.080 56.990 1.00 0.00 ATOM 2940 C23 DPP 25 42.970 36.690 57.180 1.00 0.00 ATOM 2941 H3R DPP 25 42.220 35.890 56.990 1.00 0.00 ATOM 2942 H3S DPP 25 43.720 36.280 57.890 1.00 0.00 ATOM 2943 C24 DPP 25 43.610 37.140 55.870 1.00 0.00 ATOM 2944 H4R DPP 25 44.340 37.930 56.110 1.00 0.00 ATOM 2945 H4S DPP 25 42.800 37.550 55.220 1.00 0.00 ATOM 2946 C25 DPP 25 44.330 36.050 55.070 1.00 0.00 ATOM 2947 H5R DPP 25 43.700 35.150 55.280 1.00 0.00 ATOM 2948 H5S DPP 25 45.350 35.910 55.470 1.00 0.00 ATOM 2949 C26 DPP 25 44.250 36.240 53.550 1.00 0.00 ATOM 2950 H6R DPP 25 45.130 36.830 53.220 1.00 0.00 ATOM 2951 H6S DPP 25 43.360 36.810 53.250 1.00 0.00 ATOM 2952 C27 DPP 25 44.410 34.880 52.870 1.00 0.00 ATOM 2953 H7R DPP 25 43.560 34.200 53.120 1.00 0.00 ATOM 2954 H7S DPP 25 45.270 34.280 53.220 1.00 0.00 ATOM 2955 C28 DPP 25 44.560 35.060 51.360 1.00 0.00 ATOM 2956 H8R DPP 25 45.390 35.760 51.120 1.00 0.00 ATOM 2957 H8S DPP 25 43.590 35.530 51.070 1.00 0.00 ATOM 2958 C29 DPP 25 44.660 33.810 50.490 1.00 0.00 ATOM 2959 H9R DPP 25 44.520 34.120 49.430 1.00 0.00 ATOM 2960 H9S DPP 25 43.850 33.130 50.830 1.00 0.00 ATOM 2961 0C21 DPP 25 46.030 33.140 50.620 1.00 0.00 ATOM 2962 H10R DPP 25 46.110 32.680 51.630 1.00 0.00 ATOM 2963 H10S DPP 25 46.710 34.010 50.680 1.00 0.00 ATOM 2964 1C21 DPP 25 46.390 32.120 49.540 1.00 0.00 ATOM 2965 H11R DPP 25 46.350 32.710 48.600 1.00 0.00 ATOM 2966 H11S DPP 25 45.700 31.240 49.510 1.00 0.00 ATOM 2967 2C21 DPP 25 47.820 31.590 49.600 1.00 0.00 ATOM 2968 H12R DPP 25 48.440 32.500 49.750 1.00 0.00 ATOM 2969 H12S DPP 25 48.090 31.040 48.670 1.00 0.00 ATOM 2970 3C21 DPP 25 48.070 30.610 50.750 1.00 0.00 ATOM 2971 H13R DPP 25 47.550 29.640 50.590 1.00 0.00 ATOM 2972 H13S DPP 25 47.620 31.180 51.590 1.00 0.00 ATOM 2973 4C21 DPP 25 49.510 30.390 51.220 1.00 0.00 ATOM 2974 H14R DPP 25 50.130 30.240 50.310 1.00 0.00 ATOM 2975 H14S DPP 25 49.620 29.470 51.840 1.00 0.00 ATOM 2976 5C21 DPP 25 50.020 31.610 51.980 1.00 0.00 ATOM 2977 H15R DPP 25 49.440 31.830 52.900 1.00 0.00 ATOM 2978 H15S DPP 25 50.010 32.460 51.270 1.00 0.00 ATOM 2979 6C21 DPP 25 51.410 31.250 52.530 1.00 0.00 ATOM 2980 H16R DPP 25 51.770 32.190 53.000 1.00 0.00 ATOM 2981 H16S DPP 25 52.090 30.990 51.690 1.00 0.00 ATOM 2982 H16T DPP 25 51.350 30.440 53.280 1.00 0.00 ATOM 2983 C33 DPP 25 39.130 35.730 56.260 1.00 0.00 ATOM 2984 H3X DPP 25 40.110 35.400 56.650 1.00 0.00 ATOM 2985 H3Y DPP 25 39.140 36.840 56.290 1.00 0.00 ATOM 2986 C34 DPP 25 39.110 35.060 54.880 1.00 0.00 ATOM 2987 H4X DPP 25 38.040 34.970 54.590 1.00 0.00 ATOM 2988 H4Y DPP 25 39.350 33.990 55.070 1.00 0.00 ATOM 2989 C35 DPP 25 39.990 35.620 53.760 1.00 0.00 ATOM 2990 H5X DPP 25 41.000 35.960 54.080 1.00 0.00 ATOM 2991 H5Y DPP 25 39.540 36.550 53.360 1.00 0.00 ATOM 2992 C36 DPP 25 40.180 34.530 52.700 1.00 0.00 ATOM 2993 H6X DPP 25 39.220 33.970 52.690 1.00 0.00 ATOM 2994 H6Y DPP 25 41.030 33.890 53.020 1.00 0.00 ATOM 2995 C37 DPP 25 40.410 35.040 51.280 1.00 0.00 ATOM 2996 H7X DPP 25 41.120 35.890 51.300 1.00 0.00 ATOM 2997 H7Y DPP 25 39.500 35.610 50.960 1.00 0.00 ATOM 2998 C38 DPP 25 40.690 33.940 50.260 1.00 0.00 ATOM 2999 H8X DPP 25 39.880 33.180 50.270 1.00 0.00 ATOM 3000 H8Y DPP 25 41.630 33.450 50.600 1.00 0.00 ATOM 3001 C39 DPP 25 40.750 34.440 48.820 1.00 0.00 ATOM 3002 H9X DPP 25 41.600 35.110 48.560 1.00 0.00 ATOM 3003 H9Y DPP 25 39.800 34.910 48.490 1.00 0.00 ATOM 3004 0C31 DPP 25 40.970 33.250 47.890 1.00 0.00 ATOM 3005 H10X DPP 25 39.930 32.870 47.780 1.00 0.00 ATOM 3006 H10Y DPP 25 41.490 32.500 48.510 1.00 0.00 ATOM 3007 1C31 DPP 25 41.630 33.800 46.620 1.00 0.00 ATOM 3008 H11X DPP 25 42.610 34.250 46.860 1.00 0.00 ATOM 3009 H11Y DPP 25 41.050 34.670 46.230 1.00 0.00 ATOM 3010 2C31 DPP 25 42.000 32.760 45.550 1.00 0.00 ATOM 3011 H12X DPP 25 42.680 33.250 44.830 1.00 0.00 ATOM 3012 H12Y DPP 25 41.090 32.340 45.060 1.00 0.00 ATOM 3013 3C31 DPP 25 42.940 31.730 46.170 1.00 0.00 ATOM 3014 H13X DPP 25 42.470 31.230 47.050 1.00 0.00 ATOM 3015 H13Y DPP 25 43.890 32.140 46.570 1.00 0.00 ATOM 3016 4C31 DPP 25 43.400 30.740 45.100 1.00 0.00 ATOM 3017 H14X DPP 25 43.520 31.380 44.200 1.00 0.00 ATOM 3018 H14Y DPP 25 42.520 30.080 44.940 1.00 0.00 ATOM 3019 5C31 DPP 25 44.680 29.980 45.430 1.00 0.00 ATOM 3020 H15X DPP 25 44.630 29.540 46.450 1.00 0.00 ATOM 3021 H15Y DPP 25 45.540 30.670 45.610 1.00 0.00 ATOM 3022 6C31 DPP 25 44.970 28.900 44.390 1.00 0.00 ATOM 3023 H16X DPP 25 45.120 29.350 43.380 1.00 0.00 ATOM 3024 H16Y DPP 25 44.180 28.130 44.360 1.00 0.00 ATOM 3025 H16Z DPP 25 45.900 28.410 44.740 1.00 0.00 ATOM 3026 N DPP 26 31.540 2.340 60.710 1.00 0.00 ATOM 3027 HN1 DPP 26 32.140 2.960 60.130 1.00 0.00 ATOM 3028 HN2 DPP 26 32.090 1.530 61.030 1.00 0.00 ATOM 3029 HN3 DPP 26 30.750 2.130 60.060 1.00 0.00 ATOM 3030 C12 DPP 26 31.080 3.020 61.980 1.00 0.00 ATOM 3031 H12A DPP 26 31.930 3.360 62.610 1.00 0.00 ATOM 3032 H12B DPP 26 30.660 2.270 62.670 1.00 0.00 ATOM 3033 C11 DPP 26 30.150 4.190 61.620 1.00 0.00 ATOM 3034 H11A DPP 26 29.960 4.700 62.580 1.00 0.00 ATOM 3035 H11B DPP 26 29.260 3.780 61.090 1.00 0.00 ATOM 3036 P DPP 26 30.230 6.470 60.300 1.00 0.00 ATOM 3037 O13 DPP 26 31.350 7.370 60.680 1.00 0.00 ATOM 3038 O14 DPP 26 28.870 6.760 60.810 1.00 0.00 ATOM 3039 O11 DPP 26 30.150 6.420 58.710 1.00 0.00 ATOM 3040 O12 DPP 26 30.770 4.990 60.610 1.00 0.00 ATOM 3041 C1 DPP 26 29.350 5.400 58.110 1.00 0.00 ATOM 3042 HA DPP 26 28.520 5.880 57.550 1.00 0.00 ATOM 3043 HB DPP 26 28.800 4.730 58.810 1.00 0.00 ATOM 3044 C2 DPP 26 30.060 4.420 57.160 1.00 0.00 ATOM 3045 HS DPP 26 30.680 3.850 57.890 1.00 0.00 ATOM 3046 O21 DPP 26 30.850 5.120 56.200 1.00 0.00 ATOM 3047 C21 DPP 26 31.590 4.190 55.600 1.00 0.00 ATOM 3048 O22 DPP 26 31.820 3.010 55.850 1.00 0.00 ATOM 3049 C22 DPP 26 32.250 4.880 54.420 1.00 0.00 ATOM 3050 H2R DPP 26 33.300 5.050 54.750 1.00 0.00 ATOM 3051 H2S DPP 26 31.720 5.850 54.470 1.00 0.00 ATOM 3052 C3 DPP 26 29.000 3.460 56.610 1.00 0.00 ATOM 3053 HX DPP 26 28.240 3.440 57.420 1.00 0.00 ATOM 3054 HY DPP 26 29.290 2.400 56.420 1.00 0.00 ATOM 3055 O31 DPP 26 28.240 3.870 55.460 1.00 0.00 ATOM 3056 C31 DPP 26 27.300 2.990 55.120 1.00 0.00 ATOM 3057 O32 DPP 26 26.790 2.110 55.790 1.00 0.00 ATOM 3058 C32 DPP 26 26.800 3.370 53.730 1.00 0.00 ATOM 3059 H2X DPP 26 27.580 3.980 53.230 1.00 0.00 ATOM 3060 H2Y DPP 26 25.790 3.810 53.840 1.00 0.00 ATOM 3061 C23 DPP 26 32.160 4.170 53.060 1.00 0.00 ATOM 3062 H3R DPP 26 32.440 4.980 52.360 1.00 0.00 ATOM 3063 H3S DPP 26 31.080 4.040 52.840 1.00 0.00 ATOM 3064 C24 DPP 26 32.920 2.870 52.820 1.00 0.00 ATOM 3065 H4R DPP 26 32.340 2.370 52.020 1.00 0.00 ATOM 3066 H4S DPP 26 32.790 2.260 53.750 1.00 0.00 ATOM 3067 C25 DPP 26 34.400 3.130 52.530 1.00 0.00 ATOM 3068 H5R DPP 26 34.990 3.760 53.230 1.00 0.00 ATOM 3069 H5S DPP 26 34.490 3.580 51.520 1.00 0.00 ATOM 3070 C26 DPP 26 35.280 1.880 52.420 1.00 0.00 ATOM 3071 H6R DPP 26 35.360 1.400 53.410 1.00 0.00 ATOM 3072 H6S DPP 26 36.320 2.130 52.100 1.00 0.00 ATOM 3073 C27 DPP 26 34.560 0.800 51.610 1.00 0.00 ATOM 3074 H7R DPP 26 33.630 0.470 52.120 1.00 0.00 ATOM 3075 H7S DPP 26 35.200 -0.100 51.740 1.00 0.00 ATOM 3076 C28 DPP 26 34.330 1.040 50.120 1.00 0.00 ATOM 3077 H8R DPP 26 33.670 1.920 50.010 1.00 0.00 ATOM 3078 H8S DPP 26 33.920 0.160 49.580 1.00 0.00 ATOM 3079 C29 DPP 26 35.560 1.560 49.370 1.00 0.00 ATOM 3080 H9R DPP 26 36.370 0.810 49.470 1.00 0.00 ATOM 3081 H9S DPP 26 35.910 2.500 49.840 1.00 0.00 ATOM 3082 0C21 DPP 26 35.460 1.730 47.850 1.00 0.00 ATOM 3083 H10R DPP 26 36.290 2.390 47.520 1.00 0.00 ATOM 3084 H10S DPP 26 34.530 2.280 47.610 1.00 0.00 ATOM 3085 1C21 DPP 26 35.390 0.350 47.180 1.00 0.00 ATOM 3086 H11R DPP 26 34.360 -0.050 47.220 1.00 0.00 ATOM 3087 H11S DPP 26 36.150 -0.330 47.620 1.00 0.00 ATOM 3088 2C21 DPP 26 35.640 0.310 45.670 1.00 0.00 ATOM 3089 H12R DPP 26 36.700 0.620 45.560 1.00 0.00 ATOM 3090 H12S DPP 26 35.040 1.080 45.140 1.00 0.00 ATOM 3091 3C21 DPP 26 35.440 -1.070 45.040 1.00 0.00 ATOM 3092 H13R DPP 26 34.330 -1.170 45.100 1.00 0.00 ATOM 3093 H13S DPP 26 35.960 -1.770 45.720 1.00 0.00 ATOM 3094 4C21 DPP 26 36.080 -1.100 43.650 1.00 0.00 ATOM 3095 H14R DPP 26 37.180 -1.030 43.710 1.00 0.00 ATOM 3096 H14S DPP 26 35.790 -0.240 42.990 1.00 0.00 ATOM 3097 5C21 DPP 26 35.580 -2.300 42.850 1.00 0.00 ATOM 3098 H15R DPP 26 34.470 -2.230 42.880 1.00 0.00 ATOM 3099 H15S DPP 26 35.870 -3.250 43.350 1.00 0.00 ATOM 3100 6C21 DPP 26 35.930 -2.370 41.360 1.00 0.00 ATOM 3101 H16R DPP 26 35.260 -3.090 40.850 1.00 0.00 ATOM 3102 H16S DPP 26 36.970 -2.750 41.250 1.00 0.00 ATOM 3103 H16T DPP 26 35.900 -1.370 40.880 1.00 0.00 ATOM 3104 C33 DPP 26 26.490 2.090 52.950 1.00 0.00 ATOM 3105 H3X DPP 26 25.520 1.650 53.250 1.00 0.00 ATOM 3106 H3Y DPP 26 27.320 1.360 53.110 1.00 0.00 ATOM 3107 C34 DPP 26 26.390 2.290 51.440 1.00 0.00 ATOM 3108 H4X DPP 26 27.420 2.460 51.060 1.00 0.00 ATOM 3109 H4Y DPP 26 25.790 3.210 51.290 1.00 0.00 ATOM 3110 C35 DPP 26 25.630 1.090 50.870 1.00 0.00 ATOM 3111 H5X DPP 26 24.570 1.180 51.180 1.00 0.00 ATOM 3112 H5Y DPP 26 26.050 0.140 51.270 1.00 0.00 ATOM 3113 C36 DPP 26 25.670 0.940 49.350 1.00 0.00 ATOM 3114 H6X DPP 26 26.720 0.730 49.060 1.00 0.00 ATOM 3115 H6Y DPP 26 25.390 1.880 48.830 1.00 0.00 ATOM 3116 C37 DPP 26 24.720 -0.190 48.940 1.00 0.00 ATOM 3117 H7X DPP 26 23.670 -0.060 49.280 1.00 0.00 ATOM 3118 H7Y DPP 26 25.000 -1.190 49.330 1.00 0.00 ATOM 3119 C38 DPP 26 24.640 -0.230 47.410 1.00 0.00 ATOM 3120 H8X DPP 26 24.240 0.750 47.070 1.00 0.00 ATOM 3121 H8Y DPP 26 23.990 -1.090 47.140 1.00 0.00 ATOM 3122 C39 DPP 26 25.900 -0.690 46.680 1.00 0.00 ATOM 3123 H9X DPP 26 26.210 -1.610 47.210 1.00 0.00 ATOM 3124 H9Y DPP 26 26.630 0.140 46.840 1.00 0.00 ATOM 3125 0C31 DPP 26 25.840 -1.080 45.200 1.00 0.00 ATOM 3126 H10X DPP 26 25.970 -0.170 44.580 1.00 0.00 ATOM 3127 H10Y DPP 26 24.920 -1.620 44.890 1.00 0.00 ATOM 3128 1C31 DPP 26 26.990 -1.970 44.730 1.00 0.00 ATOM 3129 H11X DPP 26 26.860 -2.910 45.310 1.00 0.00 ATOM 3130 H11Y DPP 26 27.980 -1.510 44.910 1.00 0.00 ATOM 3131 2C31 DPP 26 27.100 -2.130 43.210 1.00 0.00 ATOM 3132 H12X DPP 26 27.840 -2.860 42.830 1.00 0.00 ATOM 3133 H12Y DPP 26 27.260 -1.140 42.730 1.00 0.00 ATOM 3134 3C31 DPP 26 25.730 -2.630 42.730 1.00 0.00 ATOM 3135 H13X DPP 26 24.880 -1.920 42.800 1.00 0.00 ATOM 3136 H13Y DPP 26 25.450 -3.450 43.430 1.00 0.00 ATOM 3137 4C31 DPP 26 25.650 -2.930 41.230 1.00 0.00 ATOM 3138 H14X DPP 26 26.380 -3.750 41.060 1.00 0.00 ATOM 3139 H14Y DPP 26 25.930 -2.100 40.550 1.00 0.00 ATOM 3140 5C31 DPP 26 24.290 -3.560 40.920 1.00 0.00 ATOM 3141 H15X DPP 26 23.620 -2.680 40.850 1.00 0.00 ATOM 3142 H15Y DPP 26 24.060 -4.170 41.810 1.00 0.00 ATOM 3143 6C31 DPP 26 24.170 -4.430 39.660 1.00 0.00 ATOM 3144 H16X DPP 26 24.300 -3.790 38.760 1.00 0.00 ATOM 3145 H16Y DPP 26 24.960 -5.210 39.700 1.00 0.00 ATOM 3146 H16Z DPP 26 23.160 -4.890 39.610 1.00 0.00 ATOM 3147 N DPP 27 6.600 26.030 62.950 1.00 0.00 ATOM 3148 HN1 DPP 27 7.530 26.070 63.390 1.00 0.00 ATOM 3149 HN2 DPP 27 5.940 26.530 63.580 1.00 0.00 ATOM 3150 HN3 DPP 27 6.440 25.010 62.920 1.00 0.00 ATOM 3151 C12 DPP 27 6.630 26.520 61.520 1.00 0.00 ATOM 3152 H12A DPP 27 7.710 26.540 61.280 1.00 0.00 ATOM 3153 H12B DPP 27 6.140 27.510 61.390 1.00 0.00 ATOM 3154 C11 DPP 27 5.910 25.560 60.570 1.00 0.00 ATOM 3155 H11A DPP 27 6.320 24.530 60.600 1.00 0.00 ATOM 3156 H11B DPP 27 6.020 25.940 59.530 1.00 0.00 ATOM 3157 P DPP 27 3.960 24.290 61.530 1.00 0.00 ATOM 3158 O13 DPP 27 2.500 24.300 61.750 1.00 0.00 ATOM 3159 O14 DPP 27 4.810 24.020 62.710 1.00 0.00 ATOM 3160 O11 DPP 27 4.120 23.110 60.460 1.00 0.00 ATOM 3161 O12 DPP 27 4.500 25.620 60.830 1.00 0.00 ATOM 3162 C1 DPP 27 4.590 21.790 60.780 1.00 0.00 ATOM 3163 HA DPP 27 4.200 21.020 60.070 1.00 0.00 ATOM 3164 HB DPP 27 4.200 21.510 61.780 1.00 0.00 ATOM 3165 C2 DPP 27 6.080 21.530 60.530 1.00 0.00 ATOM 3166 HS DPP 27 6.650 21.840 61.440 1.00 0.00 ATOM 3167 O21 DPP 27 6.380 22.270 59.350 1.00 0.00 ATOM 3168 C21 DPP 27 7.680 22.290 59.070 1.00 0.00 ATOM 3169 O22 DPP 27 8.560 21.790 59.750 1.00 0.00 ATOM 3170 C22 DPP 27 7.880 23.090 57.790 1.00 0.00 ATOM 3171 H2R DPP 27 8.950 23.370 57.710 1.00 0.00 ATOM 3172 H2S DPP 27 7.230 23.990 57.750 1.00 0.00 ATOM 3173 C3 DPP 27 6.460 20.050 60.360 1.00 0.00 ATOM 3174 HX DPP 27 5.830 19.340 60.930 1.00 0.00 ATOM 3175 HY DPP 27 7.500 19.950 60.760 1.00 0.00 ATOM 3176 O31 DPP 27 6.450 19.800 58.950 1.00 0.00 ATOM 3177 C31 DPP 27 5.380 19.170 58.470 1.00 0.00 ATOM 3178 O32 DPP 27 4.600 18.580 59.200 1.00 0.00 ATOM 3179 C32 DPP 27 5.110 19.490 57.010 1.00 0.00 ATOM 3180 H2X DPP 27 6.000 19.060 56.510 1.00 0.00 ATOM 3181 H2Y DPP 27 5.130 20.590 56.930 1.00 0.00 ATOM 3182 C23 DPP 27 7.720 22.200 56.550 1.00 0.00 ATOM 3183 H3R DPP 27 6.650 21.960 56.350 1.00 0.00 ATOM 3184 H3S DPP 27 8.230 21.220 56.710 1.00 0.00 ATOM 3185 C24 DPP 27 8.200 22.960 55.320 1.00 0.00 ATOM 3186 H4R DPP 27 9.210 23.370 55.560 1.00 0.00 ATOM 3187 H4S DPP 27 7.610 23.860 55.080 1.00 0.00 ATOM 3188 C25 DPP 27 8.080 22.160 54.020 1.00 0.00 ATOM 3189 H5R DPP 27 7.120 21.660 53.780 1.00 0.00 ATOM 3190 H5S DPP 27 8.900 21.430 54.130 1.00 0.00 ATOM 3191 C26 DPP 27 8.290 22.990 52.750 1.00 0.00 ATOM 3192 H6R DPP 27 9.380 23.220 52.720 1.00 0.00 ATOM 3193 H6S DPP 27 7.720 23.950 52.740 1.00 0.00 ATOM 3194 C27 DPP 27 8.130 22.270 51.410 1.00 0.00 ATOM 3195 H7R DPP 27 7.100 21.940 51.170 1.00 0.00 ATOM 3196 H7S DPP 27 8.800 21.380 51.400 1.00 0.00 ATOM 3197 C28 DPP 27 8.700 23.150 50.300 1.00 0.00 ATOM 3198 H8R DPP 27 9.740 23.470 50.530 1.00 0.00 ATOM 3199 H8S DPP 27 8.100 24.080 50.300 1.00 0.00 ATOM 3200 C29 DPP 27 8.800 22.490 48.920 1.00 0.00 ATOM 3201 H9R DPP 27 7.740 22.370 48.620 1.00 0.00 ATOM 3202 H9S DPP 27 9.150 21.440 48.970 1.00 0.00 ATOM 3203 0C21 DPP 27 9.570 23.290 47.860 1.00 0.00 ATOM 3204 H10R DPP 27 10.670 23.200 47.980 1.00 0.00 ATOM 3205 H10S DPP 27 9.270 24.360 47.910 1.00 0.00 ATOM 3206 1C21 DPP 27 9.050 22.970 46.450 1.00 0.00 ATOM 3207 H11R DPP 27 8.910 21.870 46.460 1.00 0.00 ATOM 3208 H11S DPP 27 9.790 23.310 45.690 1.00 0.00 ATOM 3209 2C21 DPP 27 7.680 23.590 46.150 1.00 0.00 ATOM 3210 H12R DPP 27 7.030 23.640 47.050 1.00 0.00 ATOM 3211 H12S DPP 27 7.220 22.970 45.360 1.00 0.00 ATOM 3212 3C21 DPP 27 7.830 25.000 45.590 1.00 0.00 ATOM 3213 H13R DPP 27 8.600 24.980 44.790 1.00 0.00 ATOM 3214 H13S DPP 27 8.210 25.680 46.390 1.00 0.00 ATOM 3215 4C21 DPP 27 6.500 25.530 45.050 1.00 0.00 ATOM 3216 H14R DPP 27 6.260 24.870 44.190 1.00 0.00 ATOM 3217 H14S DPP 27 6.560 26.570 44.650 1.00 0.00 ATOM 3218 5C21 DPP 27 5.350 25.570 46.050 1.00 0.00 ATOM 3219 H15R DPP 27 5.190 24.550 46.450 1.00 0.00 ATOM 3220 H15S DPP 27 5.560 26.200 46.940 1.00 0.00 ATOM 3221 6C21 DPP 27 4.040 26.150 45.510 1.00 0.00 ATOM 3222 H16R DPP 27 4.120 27.000 44.810 1.00 0.00 ATOM 3223 H16S DPP 27 3.380 26.380 46.380 1.00 0.00 ATOM 3224 H16T DPP 27 3.500 25.370 44.930 1.00 0.00 ATOM 3225 C33 DPP 27 3.730 18.890 56.710 1.00 0.00 ATOM 3226 H3X DPP 27 2.980 19.540 57.220 1.00 0.00 ATOM 3227 H3Y DPP 27 3.710 17.860 57.120 1.00 0.00 ATOM 3228 C34 DPP 27 3.330 18.860 55.230 1.00 0.00 ATOM 3229 H4X DPP 27 3.520 19.820 54.700 1.00 0.00 ATOM 3230 H4Y DPP 27 2.240 18.700 55.300 1.00 0.00 ATOM 3231 C35 DPP 27 3.950 17.680 54.490 1.00 0.00 ATOM 3232 H5X DPP 27 3.560 16.810 55.050 1.00 0.00 ATOM 3233 H5Y DPP 27 5.060 17.780 54.510 1.00 0.00 ATOM 3234 C36 DPP 27 3.630 17.670 52.990 1.00 0.00 ATOM 3235 H6X DPP 27 4.260 18.470 52.550 1.00 0.00 ATOM 3236 H6Y DPP 27 2.590 18.020 52.780 1.00 0.00 ATOM 3237 C37 DPP 27 3.960 16.410 52.190 1.00 0.00 ATOM 3238 H7X DPP 27 3.310 15.560 52.490 1.00 0.00 ATOM 3239 H7Y DPP 27 5.030 16.160 52.320 1.00 0.00 ATOM 3240 C38 DPP 27 3.600 16.630 50.710 1.00 0.00 ATOM 3241 H8X DPP 27 4.360 17.420 50.530 1.00 0.00 ATOM 3242 H8Y DPP 27 2.610 17.130 50.730 1.00 0.00 ATOM 3243 C39 DPP 27 3.610 15.440 49.750 1.00 0.00 ATOM 3244 H9X DPP 27 2.930 15.760 48.930 1.00 0.00 ATOM 3245 H9Y DPP 27 3.300 14.500 50.250 1.00 0.00 ATOM 3246 0C31 DPP 27 5.050 15.190 49.300 1.00 0.00 ATOM 3247 H10X DPP 27 5.720 15.160 50.190 1.00 0.00 ATOM 3248 H10Y DPP 27 5.500 16.020 48.730 1.00 0.00 ATOM 3249 1C31 DPP 27 5.210 13.950 48.420 1.00 0.00 ATOM 3250 H11X DPP 27 4.720 13.170 49.040 1.00 0.00 ATOM 3251 H11Y DPP 27 6.270 13.710 48.230 1.00 0.00 ATOM 3252 2C31 DPP 27 4.450 13.990 47.090 1.00 0.00 ATOM 3253 H12X DPP 27 3.400 13.900 47.420 1.00 0.00 ATOM 3254 H12Y DPP 27 4.680 13.160 46.390 1.00 0.00 ATOM 3255 3C31 DPP 27 4.360 15.320 46.340 1.00 0.00 ATOM 3256 H13X DPP 27 5.370 15.780 46.280 1.00 0.00 ATOM 3257 H13Y DPP 27 3.640 15.940 46.900 1.00 0.00 ATOM 3258 4C31 DPP 27 3.910 15.070 44.900 1.00 0.00 ATOM 3259 H14X DPP 27 3.220 14.200 44.930 1.00 0.00 ATOM 3260 H14Y DPP 27 4.780 14.950 44.210 1.00 0.00 ATOM 3261 5C31 DPP 27 3.120 16.190 44.220 1.00 0.00 ATOM 3262 H15X DPP 27 2.160 16.200 44.770 1.00 0.00 ATOM 3263 H15Y DPP 27 2.960 16.000 43.130 1.00 0.00 ATOM 3264 6C31 DPP 27 3.620 17.630 44.360 1.00 0.00 ATOM 3265 H16X DPP 27 4.670 17.640 44.010 1.00 0.00 ATOM 3266 H16Y DPP 27 3.750 18.000 45.400 1.00 0.00 ATOM 3267 H16Z DPP 27 2.970 18.370 43.850 1.00 0.00 ATOM 3268 N DPP 28 36.660 58.930 65.630 1.00 0.00 ATOM 3269 HN1 DPP 28 37.680 59.090 65.710 1.00 0.00 ATOM 3270 HN2 DPP 28 36.200 59.300 66.490 1.00 0.00 ATOM 3271 HN3 DPP 28 36.340 57.950 65.510 1.00 0.00 ATOM 3272 C12 DPP 28 36.140 59.600 64.380 1.00 0.00 ATOM 3273 H12A DPP 28 36.280 60.700 64.450 1.00 0.00 ATOM 3274 H12B DPP 28 35.030 59.500 64.490 1.00 0.00 ATOM 3275 C11 DPP 28 36.610 58.890 63.110 1.00 0.00 ATOM 3276 H11A DPP 28 36.510 59.530 62.210 1.00 0.00 ATOM 3277 H11B DPP 28 35.900 58.070 62.870 1.00 0.00 ATOM 3278 P DPP 28 39.020 58.780 62.170 1.00 0.00 ATOM 3279 O13 DPP 28 40.300 58.150 62.580 1.00 0.00 ATOM 3280 O14 DPP 28 39.070 60.240 61.950 1.00 0.00 ATOM 3281 O11 DPP 28 38.380 58.080 60.870 1.00 0.00 ATOM 3282 O12 DPP 28 37.930 58.350 63.250 1.00 0.00 ATOM 3283 C1 DPP 28 37.980 56.720 60.750 1.00 0.00 ATOM 3284 HA DPP 28 37.150 56.640 60.010 1.00 0.00 ATOM 3285 HB DPP 28 37.490 56.370 61.680 1.00 0.00 ATOM 3286 C2 DPP 28 39.170 55.800 60.410 1.00 0.00 ATOM 3287 HS DPP 28 39.810 55.820 61.320 1.00 0.00 ATOM 3288 O21 DPP 28 39.910 56.240 59.270 1.00 0.00 ATOM 3289 C21 DPP 28 41.110 55.640 59.250 1.00 0.00 ATOM 3290 O22 DPP 28 41.550 54.900 60.110 1.00 0.00 ATOM 3291 C22 DPP 28 41.830 56.090 57.980 1.00 0.00 ATOM 3292 H2R DPP 28 42.080 57.170 58.070 1.00 0.00 ATOM 3293 H2S DPP 28 41.190 55.960 57.080 1.00 0.00 ATOM 3294 C3 DPP 28 38.680 54.360 60.220 1.00 0.00 ATOM 3295 HX DPP 28 38.130 54.020 61.120 1.00 0.00 ATOM 3296 HY DPP 28 39.590 53.750 60.040 1.00 0.00 ATOM 3297 O31 DPP 28 37.920 54.370 59.000 1.00 0.00 ATOM 3298 C31 DPP 28 37.200 53.260 58.950 1.00 0.00 ATOM 3299 O32 DPP 28 37.110 52.450 59.870 1.00 0.00 ATOM 3300 C32 DPP 28 36.440 53.160 57.630 1.00 0.00 ATOM 3301 H2X DPP 28 37.180 52.550 57.060 1.00 0.00 ATOM 3302 H2Y DPP 28 36.200 54.160 57.200 1.00 0.00 ATOM 3303 C23 DPP 28 43.070 55.220 57.800 1.00 0.00 ATOM 3304 H3R DPP 28 42.820 54.170 58.060 1.00 0.00 ATOM 3305 H3S DPP 28 43.820 55.370 58.610 1.00 0.00 ATOM 3306 C24 DPP 28 43.680 55.280 56.400 1.00 0.00 ATOM 3307 H4R DPP 28 43.790 56.320 56.040 1.00 0.00 ATOM 3308 H4S DPP 28 42.940 54.870 55.670 1.00 0.00 ATOM 3309 C25 DPP 28 45.010 54.530 56.360 1.00 0.00 ATOM 3310 H5R DPP 28 44.800 53.520 56.780 1.00 0.00 ATOM 3311 H5S DPP 28 45.810 55.090 56.880 1.00 0.00 ATOM 3312 C26 DPP 28 45.600 54.320 54.960 1.00 0.00 ATOM 3313 H6R DPP 28 46.640 53.920 55.010 1.00 0.00 ATOM 3314 H6S DPP 28 45.750 55.320 54.490 1.00 0.00 ATOM 3315 C27 DPP 28 44.650 53.530 54.060 1.00 0.00 ATOM 3316 H7R DPP 28 43.690 54.080 54.020 1.00 0.00 ATOM 3317 H7S DPP 28 44.330 52.630 54.640 1.00 0.00 ATOM 3318 C28 DPP 28 45.200 53.230 52.670 1.00 0.00 ATOM 3319 H8R DPP 28 44.330 52.990 52.020 1.00 0.00 ATOM 3320 H8S DPP 28 45.810 52.320 52.830 1.00 0.00 ATOM 3321 C29 DPP 28 46.080 54.320 52.050 1.00 0.00 ATOM 3322 H9R DPP 28 46.900 54.580 52.750 1.00 0.00 ATOM 3323 H9S DPP 28 45.460 55.220 51.860 1.00 0.00 ATOM 3324 0C21 DPP 28 46.820 53.790 50.810 1.00 0.00 ATOM 3325 H10R DPP 28 46.100 53.570 50.000 1.00 0.00 ATOM 3326 H10S DPP 28 47.310 52.870 51.180 1.00 0.00 ATOM 3327 1C21 DPP 28 47.870 54.720 50.200 1.00 0.00 ATOM 3328 H11R DPP 28 48.630 55.010 50.960 1.00 0.00 ATOM 3329 H11S DPP 28 47.260 55.550 49.780 1.00 0.00 ATOM 3330 2C21 DPP 28 48.790 53.930 49.280 1.00 0.00 ATOM 3331 H12R DPP 28 48.220 53.350 48.520 1.00 0.00 ATOM 3332 H12S DPP 28 49.340 53.250 49.960 1.00 0.00 ATOM 3333 3C21 DPP 28 49.810 54.650 48.390 1.00 0.00 ATOM 3334 H13R DPP 28 50.420 55.120 49.200 1.00 0.00 ATOM 3335 H13S DPP 28 49.320 55.410 47.740 1.00 0.00 ATOM 3336 4C21 DPP 28 50.690 53.660 47.640 1.00 0.00 ATOM 3337 H14R DPP 28 51.290 53.150 48.420 1.00 0.00 ATOM 3338 H14S DPP 28 50.010 52.890 47.230 1.00 0.00 ATOM 3339 5C21 DPP 28 51.730 54.320 46.720 1.00 0.00 ATOM 3340 H15R DPP 28 52.320 55.080 47.260 1.00 0.00 ATOM 3341 H15S DPP 28 51.080 54.680 45.900 1.00 0.00 ATOM 3342 6C21 DPP 28 52.780 53.340 46.170 1.00 0.00 ATOM 3343 H16R DPP 28 53.580 53.020 46.850 1.00 0.00 ATOM 3344 H16S DPP 28 53.290 53.810 45.300 1.00 0.00 ATOM 3345 H16T DPP 28 52.300 52.420 45.780 1.00 0.00 ATOM 3346 C33 DPP 28 35.120 52.440 57.850 1.00 0.00 ATOM 3347 H3X DPP 28 34.610 52.620 58.820 1.00 0.00 ATOM 3348 H3Y DPP 28 35.190 51.330 57.780 1.00 0.00 ATOM 3349 C34 DPP 28 34.070 52.970 56.870 1.00 0.00 ATOM 3350 H4X DPP 28 34.110 54.070 56.980 1.00 0.00 ATOM 3351 H4Y DPP 28 33.020 52.730 57.140 1.00 0.00 ATOM 3352 C35 DPP 28 34.300 52.770 55.370 1.00 0.00 ATOM 3353 H5X DPP 28 33.290 52.800 54.900 1.00 0.00 ATOM 3354 H5Y DPP 28 34.720 51.780 55.110 1.00 0.00 ATOM 3355 C36 DPP 28 34.990 53.960 54.680 1.00 0.00 ATOM 3356 H6X DPP 28 35.130 54.790 55.410 1.00 0.00 ATOM 3357 H6Y DPP 28 34.290 54.330 53.910 1.00 0.00 ATOM 3358 C37 DPP 28 36.200 53.420 53.920 1.00 0.00 ATOM 3359 H7X DPP 28 35.980 52.390 53.560 1.00 0.00 ATOM 3360 H7Y DPP 28 37.020 53.510 54.650 1.00 0.00 ATOM 3361 C38 DPP 28 36.500 54.280 52.690 1.00 0.00 ATOM 3362 H8X DPP 28 36.750 55.310 53.030 1.00 0.00 ATOM 3363 H8Y DPP 28 35.520 54.320 52.170 1.00 0.00 ATOM 3364 C39 DPP 28 37.520 53.580 51.780 1.00 0.00 ATOM 3365 H9X DPP 28 37.270 52.520 52.010 1.00 0.00 ATOM 3366 H9Y DPP 28 38.500 53.810 52.240 1.00 0.00 ATOM 3367 0C31 DPP 28 37.320 53.960 50.320 1.00 0.00 ATOM 3368 H10X DPP 28 38.320 53.750 49.880 1.00 0.00 ATOM 3369 H10Y DPP 28 37.060 55.030 50.220 1.00 0.00 ATOM 3370 1C31 DPP 28 36.320 53.080 49.560 1.00 0.00 ATOM 3371 H11X DPP 28 35.360 53.420 49.990 1.00 0.00 ATOM 3372 H11Y DPP 28 36.450 52.050 49.940 1.00 0.00 ATOM 3373 2C31 DPP 28 36.170 53.240 48.040 1.00 0.00 ATOM 3374 H12X DPP 28 37.150 53.070 47.550 1.00 0.00 ATOM 3375 H12Y DPP 28 36.000 54.340 47.950 1.00 0.00 ATOM 3376 3C31 DPP 28 35.000 52.490 47.400 1.00 0.00 ATOM 3377 H13X DPP 28 34.080 52.900 47.880 1.00 0.00 ATOM 3378 H13Y DPP 28 34.850 51.400 47.540 1.00 0.00 ATOM 3379 4C31 DPP 28 34.980 52.740 45.890 1.00 0.00 ATOM 3380 H14X DPP 28 35.610 51.960 45.420 1.00 0.00 ATOM 3381 H14Y DPP 28 35.580 53.670 45.780 1.00 0.00 ATOM 3382 5C31 DPP 28 33.560 52.700 45.320 1.00 0.00 ATOM 3383 H15X DPP 28 33.050 53.610 45.700 1.00 0.00 ATOM 3384 H15Y DPP 28 33.120 51.730 45.630 1.00 0.00 ATOM 3385 6C31 DPP 28 33.540 52.830 43.800 1.00 0.00 ATOM 3386 H16X DPP 28 32.530 52.980 43.370 1.00 0.00 ATOM 3387 H16Y DPP 28 33.990 51.890 43.400 1.00 0.00 ATOM 3388 H16Z DPP 28 34.280 53.600 43.500 1.00 0.00 ATOM 3389 N DPP 29 27.600 17.450 61.370 1.00 0.00 ATOM 3390 HN1 DPP 29 27.890 18.440 61.450 1.00 0.00 ATOM 3391 HN2 DPP 29 26.940 17.220 62.130 1.00 0.00 ATOM 3392 HN3 DPP 29 28.480 16.890 61.430 1.00 0.00 ATOM 3393 C12 DPP 29 26.900 17.130 60.060 1.00 0.00 ATOM 3394 H12A DPP 29 26.380 18.020 59.650 1.00 0.00 ATOM 3395 H12B DPP 29 27.760 17.040 59.370 1.00 0.00 ATOM 3396 C11 DPP 29 25.950 15.970 60.350 1.00 0.00 ATOM 3397 H11A DPP 29 25.450 15.760 59.380 1.00 0.00 ATOM 3398 H11B DPP 29 25.180 16.310 61.080 1.00 0.00 ATOM 3399 P DPP 29 25.910 13.550 61.110 1.00 0.00 ATOM 3400 O13 DPP 29 24.630 13.930 61.740 1.00 0.00 ATOM 3401 O14 DPP 29 26.780 12.740 62.000 1.00 0.00 ATOM 3402 O11 DPP 29 25.670 12.800 59.720 1.00 0.00 ATOM 3403 O12 DPP 29 26.760 14.860 60.770 1.00 0.00 ATOM 3404 C1 DPP 29 26.580 12.860 58.620 1.00 0.00 ATOM 3405 HA DPP 29 27.090 13.840 58.630 1.00 0.00 ATOM 3406 HB DPP 29 26.020 12.940 57.660 1.00 0.00 ATOM 3407 C2 DPP 29 27.740 11.860 58.490 1.00 0.00 ATOM 3408 HS DPP 29 28.350 11.910 59.420 1.00 0.00 ATOM 3409 O21 DPP 29 28.570 12.230 57.390 1.00 0.00 ATOM 3410 C21 DPP 29 29.580 11.360 57.240 1.00 0.00 ATOM 3411 O22 DPP 29 29.920 10.500 58.030 1.00 0.00 ATOM 3412 C22 DPP 29 30.380 11.720 56.000 1.00 0.00 ATOM 3413 H2R DPP 29 31.420 11.930 56.310 1.00 0.00 ATOM 3414 H2S DPP 29 29.940 12.620 55.520 1.00 0.00 ATOM 3415 C3 DPP 29 27.030 10.520 58.260 1.00 0.00 ATOM 3416 HX DPP 29 26.180 10.440 58.970 1.00 0.00 ATOM 3417 HY DPP 29 27.750 9.790 58.700 1.00 0.00 ATOM 3418 O31 DPP 29 26.780 10.260 56.880 1.00 0.00 ATOM 3419 C31 DPP 29 26.670 8.950 56.650 1.00 0.00 ATOM 3420 O32 DPP 29 26.590 8.120 57.540 1.00 0.00 ATOM 3421 C32 DPP 29 26.860 8.610 55.180 1.00 0.00 ATOM 3422 H2X DPP 29 27.150 9.540 54.650 1.00 0.00 ATOM 3423 H2Y DPP 29 25.920 8.150 54.790 1.00 0.00 ATOM 3424 C23 DPP 29 30.550 10.610 54.970 1.00 0.00 ATOM 3425 H3R DPP 29 29.500 10.420 54.690 1.00 0.00 ATOM 3426 H3S DPP 29 30.880 9.600 55.320 1.00 0.00 ATOM 3427 C24 DPP 29 31.440 11.110 53.830 1.00 0.00 ATOM 3428 H4R DPP 29 32.450 11.340 54.230 1.00 0.00 ATOM 3429 H4S DPP 29 31.160 12.110 53.440 1.00 0.00 ATOM 3430 C25 DPP 29 31.440 10.110 52.670 1.00 0.00 ATOM 3431 H5R DPP 29 30.430 10.120 52.220 1.00 0.00 ATOM 3432 H5S DPP 29 31.380 9.100 53.130 1.00 0.00 ATOM 3433 C26 DPP 29 32.580 10.280 51.660 1.00 0.00 ATOM 3434 H6R DPP 29 33.520 10.370 52.240 1.00 0.00 ATOM 3435 H6S DPP 29 32.420 11.240 51.120 1.00 0.00 ATOM 3436 C27 DPP 29 32.640 9.160 50.620 1.00 0.00 ATOM 3437 H7R DPP 29 33.290 8.420 51.150 1.00 0.00 ATOM 3438 H7S DPP 29 33.130 9.540 49.700 1.00 0.00 ATOM 3439 C28 DPP 29 31.280 8.700 50.100 1.00 0.00 ATOM 3440 H8R DPP 29 30.600 9.490 49.730 1.00 0.00 ATOM 3441 H8S DPP 29 30.790 8.100 50.910 1.00 0.00 ATOM 3442 C29 DPP 29 31.430 7.700 48.950 1.00 0.00 ATOM 3443 H9R DPP 29 32.010 8.160 48.120 1.00 0.00 ATOM 3444 H9S DPP 29 30.450 7.450 48.470 1.00 0.00 ATOM 3445 0C21 DPP 29 32.020 6.360 49.370 1.00 0.00 ATOM 3446 H10R DPP 29 31.160 6.090 50.030 1.00 0.00 ATOM 3447 H10S DPP 29 32.970 6.410 49.940 1.00 0.00 ATOM 3448 1C21 DPP 29 32.060 5.350 48.220 1.00 0.00 ATOM 3449 H11R DPP 29 31.280 5.510 47.450 1.00 0.00 ATOM 3450 H11S DPP 29 31.880 4.280 48.490 1.00 0.00 ATOM 3451 2C21 DPP 29 33.390 5.320 47.480 1.00 0.00 ATOM 3452 H12R DPP 29 34.140 4.760 48.090 1.00 0.00 ATOM 3453 H12S DPP 29 33.840 6.310 47.240 1.00 0.00 ATOM 3454 3C21 DPP 29 33.310 4.510 46.180 1.00 0.00 ATOM 3455 H13R DPP 29 32.520 4.950 45.540 1.00 0.00 ATOM 3456 H13S DPP 29 32.950 3.490 46.430 1.00 0.00 ATOM 3457 4C21 DPP 29 34.600 4.540 45.350 1.00 0.00 ATOM 3458 H14R DPP 29 35.490 4.080 45.840 1.00 0.00 ATOM 3459 H14S DPP 29 34.970 5.540 45.040 1.00 0.00 ATOM 3460 5C21 DPP 29 34.480 3.960 43.940 1.00 0.00 ATOM 3461 H15R DPP 29 33.930 2.990 43.940 1.00 0.00 ATOM 3462 H15S DPP 29 35.430 3.670 43.460 1.00 0.00 ATOM 3463 6C21 DPP 29 33.820 4.950 42.980 1.00 0.00 ATOM 3464 H16R DPP 29 34.440 5.860 42.820 1.00 0.00 ATOM 3465 H16S DPP 29 32.800 5.220 43.310 1.00 0.00 ATOM 3466 H16T DPP 29 33.670 4.460 41.990 1.00 0.00 ATOM 3467 C33 DPP 29 27.950 7.550 55.020 1.00 0.00 ATOM 3468 H3X DPP 29 27.620 6.530 55.290 1.00 0.00 ATOM 3469 H3Y DPP 29 28.810 7.720 55.720 1.00 0.00 ATOM 3470 C34 DPP 29 28.660 7.390 53.680 1.00 0.00 ATOM 3471 H4X DPP 29 29.410 6.590 53.830 1.00 0.00 ATOM 3472 H4Y DPP 29 29.290 8.300 53.530 1.00 0.00 ATOM 3473 C35 DPP 29 27.620 7.130 52.580 1.00 0.00 ATOM 3474 H5X DPP 29 27.160 8.100 52.280 1.00 0.00 ATOM 3475 H5Y DPP 29 26.750 6.500 52.840 1.00 0.00 ATOM 3476 C36 DPP 29 28.220 6.560 51.290 1.00 0.00 ATOM 3477 H6X DPP 29 29.040 5.850 51.550 1.00 0.00 ATOM 3478 H6Y DPP 29 28.820 7.290 50.710 1.00 0.00 ATOM 3479 C37 DPP 29 27.270 5.910 50.290 1.00 0.00 ATOM 3480 H7X DPP 29 26.560 6.730 50.050 1.00 0.00 ATOM 3481 H7Y DPP 29 26.740 5.060 50.760 1.00 0.00 ATOM 3482 C38 DPP 29 27.910 5.370 49.000 1.00 0.00 ATOM 3483 H8X DPP 29 28.440 4.420 49.220 1.00 0.00 ATOM 3484 H8Y DPP 29 28.620 6.110 48.570 1.00 0.00 ATOM 3485 C39 DPP 29 26.840 5.040 47.960 1.00 0.00 ATOM 3486 H9X DPP 29 26.300 4.270 48.550 1.00 0.00 ATOM 3487 H9Y DPP 29 27.450 4.680 47.110 1.00 0.00 ATOM 3488 0C31 DPP 29 25.870 6.150 47.550 1.00 0.00 ATOM 3489 H10X DPP 29 26.520 7.040 47.400 1.00 0.00 ATOM 3490 H10Y DPP 29 25.220 6.580 48.340 1.00 0.00 ATOM 3491 1C31 DPP 29 24.970 5.750 46.380 1.00 0.00 ATOM 3492 H11X DPP 29 24.200 5.010 46.700 1.00 0.00 ATOM 3493 H11Y DPP 29 25.610 5.330 45.580 1.00 0.00 ATOM 3494 2C31 DPP 29 24.210 6.850 45.640 1.00 0.00 ATOM 3495 H12X DPP 29 24.960 7.500 45.140 1.00 0.00 ATOM 3496 H12Y DPP 29 23.650 7.460 46.380 1.00 0.00 ATOM 3497 3C31 DPP 29 23.200 6.630 44.510 1.00 0.00 ATOM 3498 H13X DPP 29 22.300 6.030 44.780 1.00 0.00 ATOM 3499 H13Y DPP 29 23.680 6.080 43.670 1.00 0.00 ATOM 3500 4C31 DPP 29 22.770 7.920 43.810 1.00 0.00 ATOM 3501 H14X DPP 29 23.710 8.490 43.640 1.00 0.00 ATOM 3502 H14Y DPP 29 22.190 8.470 44.590 1.00 0.00 ATOM 3503 5C31 DPP 29 21.870 7.830 42.580 1.00 0.00 ATOM 3504 H15X DPP 29 22.400 7.350 41.730 1.00 0.00 ATOM 3505 H15Y DPP 29 21.620 8.860 42.250 1.00 0.00 ATOM 3506 6C31 DPP 29 20.550 7.070 42.780 1.00 0.00 ATOM 3507 H16X DPP 29 20.750 5.980 42.820 1.00 0.00 ATOM 3508 H16Y DPP 29 19.860 7.380 41.970 1.00 0.00 ATOM 3509 H16Z DPP 29 20.110 7.300 43.770 1.00 0.00 ATOM 3510 N DPP 30 24.030 10.740 65.580 1.00 0.00 ATOM 3511 HN1 DPP 30 23.830 11.750 65.390 1.00 0.00 ATOM 3512 HN2 DPP 30 25.020 10.730 65.890 1.00 0.00 ATOM 3513 HN3 DPP 30 23.980 10.290 64.640 1.00 0.00 ATOM 3514 C12 DPP 30 22.950 10.130 66.440 1.00 0.00 ATOM 3515 H12A DPP 30 23.260 9.120 66.790 1.00 0.00 ATOM 3516 H12B DPP 30 22.800 10.820 67.300 1.00 0.00 ATOM 3517 C11 DPP 30 21.620 10.180 65.690 1.00 0.00 ATOM 3518 H11A DPP 30 20.810 9.820 66.350 1.00 0.00 ATOM 3519 H11B DPP 30 21.660 9.520 64.800 1.00 0.00 ATOM 3520 P DPP 30 19.950 11.770 64.550 1.00 0.00 ATOM 3521 O13 DPP 30 19.810 13.230 64.360 1.00 0.00 ATOM 3522 O14 DPP 30 18.850 11.150 65.320 1.00 0.00 ATOM 3523 O11 DPP 30 20.050 11.030 63.140 1.00 0.00 ATOM 3524 O12 DPP 30 21.360 11.520 65.260 1.00 0.00 ATOM 3525 C1 DPP 30 21.370 11.210 62.620 1.00 0.00 ATOM 3526 HA DPP 30 22.090 10.380 62.790 1.00 0.00 ATOM 3527 HB DPP 30 21.720 12.260 62.740 1.00 0.00 ATOM 3528 C2 DPP 30 21.260 11.050 61.100 1.00 0.00 ATOM 3529 HS DPP 30 20.890 12.040 60.750 1.00 0.00 ATOM 3530 O21 DPP 30 20.280 10.040 60.850 1.00 0.00 ATOM 3531 C21 DPP 30 19.420 10.290 59.870 1.00 0.00 ATOM 3532 O22 DPP 30 19.450 11.200 59.050 1.00 0.00 ATOM 3533 C22 DPP 30 18.430 9.130 59.880 1.00 0.00 ATOM 3534 H2R DPP 30 17.730 9.280 60.720 1.00 0.00 ATOM 3535 H2S DPP 30 18.950 8.160 59.970 1.00 0.00 ATOM 3536 C3 DPP 30 22.620 10.820 60.410 1.00 0.00 ATOM 3537 HX DPP 30 23.070 9.900 60.850 1.00 0.00 ATOM 3538 HY DPP 30 23.260 11.700 60.660 1.00 0.00 ATOM 3539 O31 DPP 30 22.510 10.510 59.020 1.00 0.00 ATOM 3540 C31 DPP 30 22.500 11.590 58.240 1.00 0.00 ATOM 3541 O32 DPP 30 22.500 12.720 58.700 1.00 0.00 ATOM 3542 C32 DPP 30 22.910 11.200 56.830 1.00 0.00 ATOM 3543 H2X DPP 30 22.500 10.190 56.640 1.00 0.00 ATOM 3544 H2Y DPP 30 24.010 11.060 56.880 1.00 0.00 ATOM 3545 C23 DPP 30 17.600 9.140 58.600 1.00 0.00 ATOM 3546 H3R DPP 30 18.280 9.150 57.720 1.00 0.00 ATOM 3547 H3S DPP 30 17.050 10.110 58.650 1.00 0.00 ATOM 3548 C24 DPP 30 16.670 7.920 58.640 1.00 0.00 ATOM 3549 H4R DPP 30 16.050 8.110 59.540 1.00 0.00 ATOM 3550 H4S DPP 30 17.250 7.010 58.880 1.00 0.00 ATOM 3551 C25 DPP 30 15.850 7.570 57.400 1.00 0.00 ATOM 3552 H5R DPP 30 16.520 7.040 56.680 1.00 0.00 ATOM 3553 H5S DPP 30 15.430 8.560 57.120 1.00 0.00 ATOM 3554 C26 DPP 30 14.710 6.580 57.620 1.00 0.00 ATOM 3555 H6R DPP 30 14.120 6.570 58.560 1.00 0.00 ATOM 3556 H6S DPP 30 15.130 5.550 57.590 1.00 0.00 ATOM 3557 C27 DPP 30 13.620 6.670 56.550 1.00 0.00 ATOM 3558 H7R DPP 30 13.170 7.680 56.440 1.00 0.00 ATOM 3559 H7S DPP 30 12.740 6.030 56.750 1.00 0.00 ATOM 3560 C28 DPP 30 14.110 6.490 55.110 1.00 0.00 ATOM 3561 H8R DPP 30 14.680 5.540 55.060 1.00 0.00 ATOM 3562 H8S DPP 30 14.860 7.260 54.840 1.00 0.00 ATOM 3563 C29 DPP 30 12.910 6.480 54.150 1.00 0.00 ATOM 3564 H9R DPP 30 12.120 7.220 54.380 1.00 0.00 ATOM 3565 H9S DPP 30 12.460 5.460 54.130 1.00 0.00 ATOM 3566 0C21 DPP 30 13.250 6.890 52.720 1.00 0.00 ATOM 3567 H10R DPP 30 13.900 7.780 52.790 1.00 0.00 ATOM 3568 H10S DPP 30 12.350 7.150 52.120 1.00 0.00 ATOM 3569 1C21 DPP 30 14.060 5.840 51.950 1.00 0.00 ATOM 3570 H11R DPP 30 13.370 5.060 51.580 1.00 0.00 ATOM 3571 H11S DPP 30 14.840 5.330 52.560 1.00 0.00 ATOM 3572 2C21 DPP 30 14.880 6.370 50.770 1.00 0.00 ATOM 3573 H12R DPP 30 15.390 5.540 50.220 1.00 0.00 ATOM 3574 H12S DPP 30 15.700 6.980 51.220 1.00 0.00 ATOM 3575 3C21 DPP 30 14.100 7.170 49.730 1.00 0.00 ATOM 3576 H13R DPP 30 13.690 8.100 50.190 1.00 0.00 ATOM 3577 H13S DPP 30 13.230 6.530 49.440 1.00 0.00 ATOM 3578 4C21 DPP 30 14.890 7.630 48.500 1.00 0.00 ATOM 3579 H14R DPP 30 15.450 6.780 48.060 1.00 0.00 ATOM 3580 H14S DPP 30 15.630 8.420 48.750 1.00 0.00 ATOM 3581 5C21 DPP 30 14.000 8.320 47.470 1.00 0.00 ATOM 3582 H15R DPP 30 13.370 9.110 47.930 1.00 0.00 ATOM 3583 H15S DPP 30 13.210 7.580 47.200 1.00 0.00 ATOM 3584 6C21 DPP 30 14.830 8.710 46.240 1.00 0.00 ATOM 3585 H16R DPP 30 14.130 9.260 45.570 1.00 0.00 ATOM 3586 H16S DPP 30 15.240 7.820 45.720 1.00 0.00 ATOM 3587 H16T DPP 30 15.650 9.450 46.360 1.00 0.00 ATOM 3588 C33 DPP 30 22.560 12.150 55.680 1.00 0.00 ATOM 3589 H3X DPP 30 22.930 13.140 56.040 1.00 0.00 ATOM 3590 H3Y DPP 30 21.450 12.250 55.660 1.00 0.00 ATOM 3591 C34 DPP 30 23.130 11.660 54.350 1.00 0.00 ATOM 3592 H4X DPP 30 22.950 10.570 54.240 1.00 0.00 ATOM 3593 H4Y DPP 30 24.240 11.730 54.450 1.00 0.00 ATOM 3594 C35 DPP 30 22.480 12.500 53.260 1.00 0.00 ATOM 3595 H5X DPP 30 22.670 13.590 53.380 1.00 0.00 ATOM 3596 H5Y DPP 30 21.380 12.350 53.350 1.00 0.00 ATOM 3597 C36 DPP 30 22.790 11.870 51.900 1.00 0.00 ATOM 3598 H6X DPP 30 22.410 10.830 51.920 1.00 0.00 ATOM 3599 H6Y DPP 30 23.850 11.900 51.570 1.00 0.00 ATOM 3600 C37 DPP 30 22.010 12.510 50.750 1.00 0.00 ATOM 3601 H7X DPP 30 20.940 12.330 50.990 1.00 0.00 ATOM 3602 H7Y DPP 30 22.160 11.990 49.780 1.00 0.00 ATOM 3603 C38 DPP 30 22.320 13.970 50.420 1.00 0.00 ATOM 3604 H8X DPP 30 23.380 14.080 50.110 1.00 0.00 ATOM 3605 H8Y DPP 30 22.170 14.520 51.380 1.00 0.00 ATOM 3606 C39 DPP 30 21.560 14.640 49.270 1.00 0.00 ATOM 3607 H9X DPP 30 21.790 15.720 49.280 1.00 0.00 ATOM 3608 H9Y DPP 30 20.490 14.510 49.540 1.00 0.00 ATOM 3609 0C31 DPP 30 21.920 14.120 47.880 1.00 0.00 ATOM 3610 H10X DPP 30 21.780 13.020 47.870 1.00 0.00 ATOM 3611 H10Y DPP 30 22.960 14.350 47.540 1.00 0.00 ATOM 3612 1C31 DPP 30 21.010 14.720 46.800 1.00 0.00 ATOM 3613 H11X DPP 30 21.160 15.810 46.630 1.00 0.00 ATOM 3614 H11Y DPP 30 19.950 14.630 47.100 1.00 0.00 ATOM 3615 2C31 DPP 30 21.140 14.110 45.410 1.00 0.00 ATOM 3616 H12X DPP 30 21.060 13.000 45.440 1.00 0.00 ATOM 3617 H12Y DPP 30 22.160 14.410 45.080 1.00 0.00 ATOM 3618 3C31 DPP 30 20.260 14.650 44.280 1.00 0.00 ATOM 3619 H13X DPP 30 20.620 14.110 43.380 1.00 0.00 ATOM 3620 H13Y DPP 30 20.520 15.730 44.370 1.00 0.00 ATOM 3621 4C31 DPP 30 18.780 14.340 44.460 1.00 0.00 ATOM 3622 H14X DPP 30 18.580 14.660 45.510 1.00 0.00 ATOM 3623 H14Y DPP 30 18.570 13.250 44.460 1.00 0.00 ATOM 3624 5C31 DPP 30 17.860 15.080 43.490 1.00 0.00 ATOM 3625 H15X DPP 30 18.110 15.000 42.410 1.00 0.00 ATOM 3626 H15Y DPP 30 17.980 16.140 43.780 1.00 0.00 ATOM 3627 6C31 DPP 30 16.380 14.770 43.700 1.00 0.00 ATOM 3628 H16X DPP 30 16.230 13.670 43.650 1.00 0.00 ATOM 3629 H16Y DPP 30 15.890 15.280 42.840 1.00 0.00 ATOM 3630 H16Z DPP 30 16.020 15.250 44.640 1.00 0.00 ATOM 3631 N DPP 31 5.510 34.880 62.620 1.00 0.00 ATOM 3632 HN1 DPP 31 4.740 35.580 62.690 1.00 0.00 ATOM 3633 HN2 DPP 31 4.980 33.990 62.750 1.00 0.00 ATOM 3634 HN3 DPP 31 6.100 35.000 63.470 1.00 0.00 ATOM 3635 C12 DPP 31 6.410 35.090 61.430 1.00 0.00 ATOM 3636 H12A DPP 31 7.170 34.290 61.440 1.00 0.00 ATOM 3637 H12B DPP 31 5.810 34.870 60.520 1.00 0.00 ATOM 3638 C11 DPP 31 7.000 36.500 61.370 1.00 0.00 ATOM 3639 H11A DPP 31 7.710 36.460 60.510 1.00 0.00 ATOM 3640 H11B DPP 31 7.580 36.570 62.310 1.00 0.00 ATOM 3641 P DPP 31 6.360 39.020 61.510 1.00 0.00 ATOM 3642 O13 DPP 31 6.410 39.340 62.960 1.00 0.00 ATOM 3643 O14 DPP 31 5.500 39.830 60.620 1.00 0.00 ATOM 3644 O11 DPP 31 7.850 39.080 60.940 1.00 0.00 ATOM 3645 O12 DPP 31 5.960 37.480 61.290 1.00 0.00 ATOM 3646 C1 DPP 31 8.650 40.150 61.450 1.00 0.00 ATOM 3647 HA DPP 31 9.620 39.750 61.800 1.00 0.00 ATOM 3648 HB DPP 31 8.260 40.610 62.380 1.00 0.00 ATOM 3649 C2 DPP 31 9.000 41.170 60.350 1.00 0.00 ATOM 3650 HS DPP 31 8.130 41.860 60.290 1.00 0.00 ATOM 3651 O21 DPP 31 9.220 40.390 59.170 1.00 0.00 ATOM 3652 C21 DPP 31 8.480 40.630 58.090 1.00 0.00 ATOM 3653 O22 DPP 31 7.870 41.650 57.840 1.00 0.00 ATOM 3654 C22 DPP 31 8.540 39.370 57.230 1.00 0.00 ATOM 3655 H2R DPP 31 7.460 39.130 57.170 1.00 0.00 ATOM 3656 H2S DPP 31 9.060 38.520 57.720 1.00 0.00 ATOM 3657 C3 DPP 31 10.290 41.880 60.790 1.00 0.00 ATOM 3658 HX DPP 31 11.200 41.230 60.770 1.00 0.00 ATOM 3659 HY DPP 31 10.250 42.290 61.820 1.00 0.00 ATOM 3660 O31 DPP 31 10.600 42.940 59.880 1.00 0.00 ATOM 3661 C31 DPP 31 9.860 44.030 60.110 1.00 0.00 ATOM 3662 O32 DPP 31 9.290 44.250 61.170 1.00 0.00 ATOM 3663 C32 DPP 31 9.810 44.920 58.880 1.00 0.00 ATOM 3664 H2X DPP 31 9.760 46.010 59.110 1.00 0.00 ATOM 3665 H2Y DPP 31 8.860 44.660 58.370 1.00 0.00 ATOM 3666 C23 DPP 31 9.180 39.640 55.860 1.00 0.00 ATOM 3667 H3R DPP 31 10.260 39.850 56.040 1.00 0.00 ATOM 3668 H3S DPP 31 8.720 40.580 55.510 1.00 0.00 ATOM 3669 C24 DPP 31 8.980 38.460 54.900 1.00 0.00 ATOM 3670 H4R DPP 31 7.930 38.110 54.930 1.00 0.00 ATOM 3671 H4S DPP 31 9.540 37.620 55.350 1.00 0.00 ATOM 3672 C25 DPP 31 9.420 38.830 53.480 1.00 0.00 ATOM 3673 H5R DPP 31 10.400 39.370 53.550 1.00 0.00 ATOM 3674 H5S DPP 31 8.750 39.570 53.000 1.00 0.00 ATOM 3675 C26 DPP 31 9.510 37.620 52.550 1.00 0.00 ATOM 3676 H6R DPP 31 8.440 37.370 52.400 1.00 0.00 ATOM 3677 H6S DPP 31 10.090 36.750 52.920 1.00 0.00 ATOM 3678 C27 DPP 31 10.110 37.930 51.180 1.00 0.00 ATOM 3679 H7R DPP 31 11.060 38.500 51.290 1.00 0.00 ATOM 3680 H7S DPP 31 9.420 38.610 50.650 1.00 0.00 ATOM 3681 C28 DPP 31 10.360 36.670 50.350 1.00 0.00 ATOM 3682 H8R DPP 31 9.460 36.030 50.460 1.00 0.00 ATOM 3683 H8S DPP 31 11.180 36.020 50.730 1.00 0.00 ATOM 3684 C29 DPP 31 10.560 37.050 48.880 1.00 0.00 ATOM 3685 H9R DPP 31 11.520 36.590 48.590 1.00 0.00 ATOM 3686 H9S DPP 31 10.650 38.160 48.870 1.00 0.00 ATOM 3687 0C21 DPP 31 9.570 36.420 47.910 1.00 0.00 ATOM 3688 H10R DPP 31 8.590 36.660 48.370 1.00 0.00 ATOM 3689 H10S DPP 31 9.830 35.350 48.070 1.00 0.00 ATOM 3690 1C21 DPP 31 9.620 36.870 46.450 1.00 0.00 ATOM 3691 H11R DPP 31 10.650 36.600 46.120 1.00 0.00 ATOM 3692 H11S DPP 31 9.510 37.970 46.420 1.00 0.00 ATOM 3693 2C21 DPP 31 8.440 36.200 45.730 1.00 0.00 ATOM 3694 H12R DPP 31 8.470 36.910 44.870 1.00 0.00 ATOM 3695 H12S DPP 31 7.560 36.310 46.390 1.00 0.00 ATOM 3696 3C21 DPP 31 8.580 34.820 45.090 1.00 0.00 ATOM 3697 H13R DPP 31 7.660 34.690 44.480 1.00 0.00 ATOM 3698 H13S DPP 31 8.490 34.020 45.850 1.00 0.00 ATOM 3699 4C21 DPP 31 9.840 34.560 44.250 1.00 0.00 ATOM 3700 H14R DPP 31 10.720 34.700 44.910 1.00 0.00 ATOM 3701 H14S DPP 31 10.030 35.200 43.370 1.00 0.00 ATOM 3702 5C21 DPP 31 9.980 33.090 43.840 1.00 0.00 ATOM 3703 H15R DPP 31 9.080 32.820 43.250 1.00 0.00 ATOM 3704 H15S DPP 31 9.960 32.460 44.760 1.00 0.00 ATOM 3705 6C21 DPP 31 11.240 32.700 43.080 1.00 0.00 ATOM 3706 H16R DPP 31 11.130 33.310 42.160 1.00 0.00 ATOM 3707 H16S DPP 31 11.130 31.620 42.850 1.00 0.00 ATOM 3708 H16T DPP 31 12.170 32.950 43.630 1.00 0.00 ATOM 3709 C33 DPP 31 10.920 44.600 57.870 1.00 0.00 ATOM 3710 H3X DPP 31 10.990 43.510 57.680 1.00 0.00 ATOM 3711 H3Y DPP 31 11.900 44.850 58.310 1.00 0.00 ATOM 3712 C34 DPP 31 10.590 45.240 56.520 1.00 0.00 ATOM 3713 H4X DPP 31 10.200 46.280 56.480 1.00 0.00 ATOM 3714 H4Y DPP 31 9.740 44.590 56.240 1.00 0.00 ATOM 3715 C35 DPP 31 11.750 45.050 55.540 1.00 0.00 ATOM 3716 H5X DPP 31 11.340 44.760 54.550 1.00 0.00 ATOM 3717 H5Y DPP 31 12.280 44.130 55.850 1.00 0.00 ATOM 3718 C36 DPP 31 12.700 46.250 55.390 1.00 0.00 ATOM 3719 H6X DPP 31 12.940 46.670 56.390 1.00 0.00 ATOM 3720 H6Y DPP 31 12.120 47.070 54.910 1.00 0.00 ATOM 3721 C37 DPP 31 13.990 45.910 54.640 1.00 0.00 ATOM 3722 H7X DPP 31 14.540 45.050 55.060 1.00 0.00 ATOM 3723 H7Y DPP 31 14.760 46.690 54.810 1.00 0.00 ATOM 3724 C38 DPP 31 13.820 45.720 53.130 1.00 0.00 ATOM 3725 H8X DPP 31 13.110 46.490 52.770 1.00 0.00 ATOM 3726 H8Y DPP 31 13.120 44.900 52.870 1.00 0.00 ATOM 3727 C39 DPP 31 15.130 45.680 52.330 1.00 0.00 ATOM 3728 H9X DPP 31 15.750 44.930 52.870 1.00 0.00 ATOM 3729 H9Y DPP 31 15.710 46.630 52.390 1.00 0.00 ATOM 3730 0C31 DPP 31 14.960 45.060 50.940 1.00 0.00 ATOM 3731 H10X DPP 31 14.620 44.010 51.080 1.00 0.00 ATOM 3732 H10Y DPP 31 15.940 44.940 50.440 1.00 0.00 ATOM 3733 1C31 DPP 31 13.990 45.860 50.070 1.00 0.00 ATOM 3734 H11X DPP 31 14.470 46.850 49.890 1.00 0.00 ATOM 3735 H11Y DPP 31 13.010 45.950 50.570 1.00 0.00 ATOM 3736 2C31 DPP 31 13.760 45.270 48.680 1.00 0.00 ATOM 3737 H12X DPP 31 13.020 44.440 48.600 1.00 0.00 ATOM 3738 H12Y DPP 31 14.690 44.760 48.340 1.00 0.00 ATOM 3739 3C31 DPP 31 13.350 46.340 47.660 1.00 0.00 ATOM 3740 H13X DPP 31 14.130 47.120 47.560 1.00 0.00 ATOM 3741 H13Y DPP 31 12.390 46.830 47.920 1.00 0.00 ATOM 3742 4C31 DPP 31 13.250 45.860 46.210 1.00 0.00 ATOM 3743 H14X DPP 31 12.790 44.890 45.910 1.00 0.00 ATOM 3744 H14Y DPP 31 14.290 45.740 45.840 1.00 0.00 ATOM 3745 5C31 DPP 31 12.750 47.030 45.360 1.00 0.00 ATOM 3746 H15X DPP 31 13.540 47.780 45.550 1.00 0.00 ATOM 3747 H15Y DPP 31 11.760 47.350 45.740 1.00 0.00 ATOM 3748 6C31 DPP 31 12.810 46.850 43.840 1.00 0.00 ATOM 3749 H16X DPP 31 13.860 46.600 43.590 1.00 0.00 ATOM 3750 H16Y DPP 31 12.510 47.770 43.300 1.00 0.00 ATOM 3751 H16Z DPP 31 12.230 46.000 43.420 1.00 0.00 ATOM 3752 N DPP 32 4.230 41.750 59.470 1.00 0.00 ATOM 3753 HN1 DPP 32 4.820 41.050 59.970 1.00 0.00 ATOM 3754 HN2 DPP 32 3.370 41.850 60.040 1.00 0.00 ATOM 3755 HN3 DPP 32 3.910 41.570 58.500 1.00 0.00 ATOM 3756 C12 DPP 32 5.010 43.040 59.490 1.00 0.00 ATOM 3757 H12A DPP 32 4.240 43.820 59.270 1.00 0.00 ATOM 3758 H12B DPP 32 5.710 42.980 58.630 1.00 0.00 ATOM 3759 C11 DPP 32 5.720 43.340 60.810 1.00 0.00 ATOM 3760 H11A DPP 32 6.450 42.530 61.030 1.00 0.00 ATOM 3761 H11B DPP 32 4.990 43.320 61.650 1.00 0.00 ATOM 3762 P DPP 32 5.480 45.890 60.960 1.00 0.00 ATOM 3763 O13 DPP 32 6.250 46.900 61.730 1.00 0.00 ATOM 3764 O14 DPP 32 4.200 45.470 61.570 1.00 0.00 ATOM 3765 O11 DPP 32 5.190 46.450 59.490 1.00 0.00 ATOM 3766 O12 DPP 32 6.390 44.590 60.740 1.00 0.00 ATOM 3767 C1 DPP 32 6.290 46.690 58.600 1.00 0.00 ATOM 3768 HA DPP 32 6.220 46.170 57.620 1.00 0.00 ATOM 3769 HB DPP 32 7.260 46.330 59.000 1.00 0.00 ATOM 3770 C2 DPP 32 6.440 48.170 58.220 1.00 0.00 ATOM 3771 HS DPP 32 6.290 48.770 59.150 1.00 0.00 ATOM 3772 O21 DPP 32 5.360 48.420 57.320 1.00 0.00 ATOM 3773 C21 DPP 32 4.690 49.540 57.610 1.00 0.00 ATOM 3774 O22 DPP 32 4.830 50.220 58.610 1.00 0.00 ATOM 3775 C22 DPP 32 3.600 49.770 56.570 1.00 0.00 ATOM 3776 H2R DPP 32 2.970 50.680 56.680 1.00 0.00 ATOM 3777 H2S DPP 32 2.840 48.970 56.700 1.00 0.00 ATOM 3778 C3 DPP 32 7.790 48.590 57.610 1.00 0.00 ATOM 3779 HX DPP 32 8.600 48.480 58.360 1.00 0.00 ATOM 3780 HY DPP 32 7.670 49.680 57.440 1.00 0.00 ATOM 3781 O31 DPP 32 8.130 47.930 56.380 1.00 0.00 ATOM 3782 C31 DPP 32 8.360 48.680 55.300 1.00 0.00 ATOM 3783 O32 DPP 32 8.510 49.880 55.380 1.00 0.00 ATOM 3784 C32 DPP 32 8.300 47.760 54.090 1.00 0.00 ATOM 3785 H2X DPP 32 7.270 47.390 53.940 1.00 0.00 ATOM 3786 H2Y DPP 32 9.050 46.950 54.140 1.00 0.00 ATOM 3787 C23 DPP 32 4.070 49.890 55.120 1.00 0.00 ATOM 3788 H3R DPP 32 4.900 49.210 54.860 1.00 0.00 ATOM 3789 H3S DPP 32 4.390 50.930 54.900 1.00 0.00 ATOM 3790 C24 DPP 32 2.920 49.530 54.180 1.00 0.00 ATOM 3791 H4R DPP 32 1.960 49.870 54.620 1.00 0.00 ATOM 3792 H4S DPP 32 2.780 48.440 54.070 1.00 0.00 ATOM 3793 C25 DPP 32 3.210 50.100 52.790 1.00 0.00 ATOM 3794 H5R DPP 32 4.190 49.690 52.440 1.00 0.00 ATOM 3795 H5S DPP 32 3.210 51.210 52.800 1.00 0.00 ATOM 3796 C26 DPP 32 2.120 49.620 51.830 1.00 0.00 ATOM 3797 H6R DPP 32 2.150 50.160 50.860 1.00 0.00 ATOM 3798 H6S DPP 32 1.150 49.840 52.330 1.00 0.00 ATOM 3799 C27 DPP 32 2.260 48.180 51.330 1.00 0.00 ATOM 3800 H7R DPP 32 2.240 47.450 52.170 1.00 0.00 ATOM 3801 H7S DPP 32 3.260 48.180 50.850 1.00 0.00 ATOM 3802 C28 DPP 32 1.210 47.750 50.300 1.00 0.00 ATOM 3803 H8R DPP 32 1.440 46.670 50.150 1.00 0.00 ATOM 3804 H8S DPP 32 1.360 48.430 49.440 1.00 0.00 ATOM 3805 C29 DPP 32 -0.230 47.890 50.780 1.00 0.00 ATOM 3806 H9R DPP 32 -0.450 48.980 50.880 1.00 0.00 ATOM 3807 H9S DPP 32 -0.210 47.370 51.760 1.00 0.00 ATOM 3808 0C21 DPP 32 -1.180 47.200 49.810 1.00 0.00 ATOM 3809 H10R DPP 32 -2.190 47.080 50.250 1.00 0.00 ATOM 3810 H10S DPP 32 -0.770 46.180 49.670 1.00 0.00 ATOM 3811 1C21 DPP 32 -1.310 47.920 48.460 1.00 0.00 ATOM 3812 H11R DPP 32 -0.290 47.910 48.020 1.00 0.00 ATOM 3813 H11S DPP 32 -1.600 48.990 48.620 1.00 0.00 ATOM 3814 2C21 DPP 32 -2.330 47.230 47.550 1.00 0.00 ATOM 3815 H12R DPP 32 -2.450 47.790 46.600 1.00 0.00 ATOM 3816 H12S DPP 32 -3.180 47.250 48.270 1.00 0.00 ATOM 3817 3C21 DPP 32 -2.030 45.810 47.080 1.00 0.00 ATOM 3818 H13R DPP 32 -3.060 45.670 46.680 1.00 0.00 ATOM 3819 H13S DPP 32 -1.760 45.160 47.940 1.00 0.00 ATOM 3820 4C21 DPP 32 -0.940 45.760 46.010 1.00 0.00 ATOM 3821 H14R DPP 32 0.040 45.930 46.510 1.00 0.00 ATOM 3822 H14S DPP 32 -1.260 46.480 45.230 1.00 0.00 ATOM 3823 5C21 DPP 32 -0.860 44.320 45.500 1.00 0.00 ATOM 3824 H15R DPP 32 -0.920 43.590 46.330 1.00 0.00 ATOM 3825 H15S DPP 32 0.100 44.040 45.030 1.00 0.00 ATOM 3826 6C21 DPP 32 -1.930 44.080 44.430 1.00 0.00 ATOM 3827 H16R DPP 32 -1.820 44.710 43.530 1.00 0.00 ATOM 3828 H16S DPP 32 -2.950 44.240 44.850 1.00 0.00 ATOM 3829 H16T DPP 32 -1.880 43.070 43.980 1.00 0.00 ATOM 3830 C33 DPP 32 8.430 48.660 52.850 1.00 0.00 ATOM 3831 H3X DPP 32 9.300 49.330 52.970 1.00 0.00 ATOM 3832 H3Y DPP 32 7.520 49.300 52.930 1.00 0.00 ATOM 3833 C34 DPP 32 8.510 48.020 51.460 1.00 0.00 ATOM 3834 H4X DPP 32 8.110 46.990 51.570 1.00 0.00 ATOM 3835 H4Y DPP 32 9.610 47.990 51.250 1.00 0.00 ATOM 3836 C35 DPP 32 7.720 48.720 50.360 1.00 0.00 ATOM 3837 H5X DPP 32 8.060 48.350 49.370 1.00 0.00 ATOM 3838 H5Y DPP 32 7.950 49.810 50.440 1.00 0.00 ATOM 3839 C36 DPP 32 6.230 48.390 50.470 1.00 0.00 ATOM 3840 H6X DPP 32 5.710 49.240 49.980 1.00 0.00 ATOM 3841 H6Y DPP 32 6.000 48.410 51.550 1.00 0.00 ATOM 3842 C37 DPP 32 5.820 47.010 49.950 1.00 0.00 ATOM 3843 H7X DPP 32 4.810 46.720 50.310 1.00 0.00 ATOM 3844 H7Y DPP 32 6.580 46.300 50.350 1.00 0.00 ATOM 3845 C38 DPP 32 5.720 46.950 48.420 1.00 0.00 ATOM 3846 H8X DPP 32 5.710 45.860 48.190 1.00 0.00 ATOM 3847 H8Y DPP 32 6.690 47.150 47.920 1.00 0.00 ATOM 3848 C39 DPP 32 4.610 47.810 47.830 1.00 0.00 ATOM 3849 H9X DPP 32 4.790 48.820 48.250 1.00 0.00 ATOM 3850 H9Y DPP 32 3.610 47.430 48.140 1.00 0.00 ATOM 3851 0C31 DPP 32 4.640 47.710 46.300 1.00 0.00 ATOM 3852 H10X DPP 32 4.950 46.650 46.170 1.00 0.00 ATOM 3853 H10Y DPP 32 5.500 48.260 45.870 1.00 0.00 ATOM 3854 1C31 DPP 32 3.300 48.120 45.680 1.00 0.00 ATOM 3855 H11X DPP 32 3.150 49.200 45.890 1.00 0.00 ATOM 3856 H11Y DPP 32 2.420 47.640 46.150 1.00 0.00 ATOM 3857 2C31 DPP 32 3.180 47.870 44.170 1.00 0.00 ATOM 3858 H12X DPP 32 3.890 47.070 43.910 1.00 0.00 ATOM 3859 H12Y DPP 32 3.580 48.680 43.520 1.00 0.00 ATOM 3860 3C31 DPP 32 1.800 47.380 43.740 1.00 0.00 ATOM 3861 H13X DPP 32 1.050 48.190 43.910 1.00 0.00 ATOM 3862 H13Y DPP 32 1.490 46.520 44.370 1.00 0.00 ATOM 3863 4C31 DPP 32 1.620 47.080 42.250 1.00 0.00 ATOM 3864 H14X DPP 32 2.550 47.460 41.750 1.00 0.00 ATOM 3865 H14Y DPP 32 0.790 47.710 41.880 1.00 0.00 ATOM 3866 5C31 DPP 32 1.340 45.610 41.950 1.00 0.00 ATOM 3867 H15X DPP 32 0.480 45.480 42.640 1.00 0.00 ATOM 3868 H15Y DPP 32 2.170 44.960 42.310 1.00 0.00 ATOM 3869 6C31 DPP 32 0.960 45.230 40.520 1.00 0.00 ATOM 3870 H16X DPP 32 0.230 44.390 40.420 1.00 0.00 ATOM 3871 H16Y DPP 32 1.850 44.830 39.990 1.00 0.00 ATOM 3872 H16Z DPP 32 0.470 46.040 39.930 1.00 0.00 ATOM 3873 N DPP 33 19.420 31.600 69.950 1.00 0.00 ATOM 3874 HN1 DPP 33 19.990 30.740 69.830 1.00 0.00 ATOM 3875 HN2 DPP 33 19.940 32.490 70.080 1.00 0.00 ATOM 3876 HN3 DPP 33 18.890 31.380 70.810 1.00 0.00 ATOM 3877 C12 DPP 33 18.430 31.700 68.810 1.00 0.00 ATOM 3878 H12A DPP 33 17.950 32.680 69.020 1.00 0.00 ATOM 3879 H12B DPP 33 17.670 30.890 68.830 1.00 0.00 ATOM 3880 C11 DPP 33 19.170 31.710 67.470 1.00 0.00 ATOM 3881 H11A DPP 33 19.330 32.760 67.170 1.00 0.00 ATOM 3882 H11B DPP 33 18.580 31.270 66.640 1.00 0.00 ATOM 3883 P DPP 33 21.370 31.130 66.290 1.00 0.00 ATOM 3884 O13 DPP 33 22.490 30.160 66.380 1.00 0.00 ATOM 3885 O14 DPP 33 21.680 32.570 66.240 1.00 0.00 ATOM 3886 O11 DPP 33 20.500 30.750 65.010 1.00 0.00 ATOM 3887 O12 DPP 33 20.380 30.950 67.540 1.00 0.00 ATOM 3888 C1 DPP 33 20.260 29.370 64.700 1.00 0.00 ATOM 3889 HA DPP 33 19.420 29.010 65.320 1.00 0.00 ATOM 3890 HB DPP 33 21.190 28.860 65.000 1.00 0.00 ATOM 3891 C2 DPP 33 20.240 29.060 63.190 1.00 0.00 ATOM 3892 HS DPP 33 20.600 28.030 63.020 1.00 0.00 ATOM 3893 O21 DPP 33 21.140 29.840 62.400 1.00 0.00 ATOM 3894 C21 DPP 33 22.450 29.750 62.650 1.00 0.00 ATOM 3895 O22 DPP 33 23.040 28.980 63.380 1.00 0.00 ATOM 3896 C22 DPP 33 23.250 30.640 61.710 1.00 0.00 ATOM 3897 H2R DPP 33 24.280 30.470 62.070 1.00 0.00 ATOM 3898 H2S DPP 33 22.940 31.690 61.940 1.00 0.00 ATOM 3899 C3 DPP 33 18.790 29.140 62.670 1.00 0.00 ATOM 3900 HX DPP 33 18.410 30.180 62.720 1.00 0.00 ATOM 3901 HY DPP 33 18.080 28.600 63.330 1.00 0.00 ATOM 3902 O31 DPP 33 18.670 28.840 61.280 1.00 0.00 ATOM 3903 C31 DPP 33 17.530 28.280 60.840 1.00 0.00 ATOM 3904 O32 DPP 33 16.610 27.890 61.530 1.00 0.00 ATOM 3905 C32 DPP 33 17.620 28.390 59.330 1.00 0.00 ATOM 3906 H2X DPP 33 18.500 27.880 58.880 1.00 0.00 ATOM 3907 H2Y DPP 33 17.780 29.430 58.980 1.00 0.00 ATOM 3908 C23 DPP 33 23.140 30.200 60.250 1.00 0.00 ATOM 3909 H3R DPP 33 22.050 30.130 60.020 1.00 0.00 ATOM 3910 H3S DPP 33 23.700 29.270 60.040 1.00 0.00 ATOM 3911 C24 DPP 33 23.850 31.300 59.450 1.00 0.00 ATOM 3912 H4R DPP 33 24.830 31.550 59.920 1.00 0.00 ATOM 3913 H4S DPP 33 23.200 32.160 59.680 1.00 0.00 ATOM 3914 C25 DPP 33 23.840 31.060 57.940 1.00 0.00 ATOM 3915 H5R DPP 33 22.780 31.000 57.610 1.00 0.00 ATOM 3916 H5S DPP 33 24.290 30.060 57.740 1.00 0.00 ATOM 3917 C26 DPP 33 24.490 32.160 57.100 1.00 0.00 ATOM 3918 H6R DPP 33 25.590 32.080 57.220 1.00 0.00 ATOM 3919 H6S DPP 33 24.020 33.150 57.310 1.00 0.00 ATOM 3920 C27 DPP 33 24.170 31.890 55.630 1.00 0.00 ATOM 3921 H7R DPP 33 24.560 32.730 55.010 1.00 0.00 ATOM 3922 H7S DPP 33 23.070 31.810 55.490 1.00 0.00 ATOM 3923 C28 DPP 33 24.780 30.650 54.980 1.00 0.00 ATOM 3924 H8R DPP 33 24.420 29.780 55.560 1.00 0.00 ATOM 3925 H8S DPP 33 25.890 30.640 55.010 1.00 0.00 ATOM 3926 C29 DPP 33 24.250 30.460 53.550 1.00 0.00 ATOM 3927 H9R DPP 33 23.170 30.250 53.750 1.00 0.00 ATOM 3928 H9S DPP 33 24.770 29.620 53.050 1.00 0.00 ATOM 3929 0C21 DPP 33 24.310 31.600 52.540 1.00 0.00 ATOM 3930 H10R DPP 33 25.220 32.230 52.640 1.00 0.00 ATOM 3931 H10S DPP 33 23.460 32.250 52.850 1.00 0.00 ATOM 3932 1C21 DPP 33 23.880 31.230 51.120 1.00 0.00 ATOM 3933 H11R DPP 33 23.170 30.380 51.170 1.00 0.00 ATOM 3934 H11S DPP 33 24.770 30.810 50.610 1.00 0.00 ATOM 3935 2C21 DPP 33 23.460 32.400 50.220 1.00 0.00 ATOM 3936 H12R DPP 33 24.420 32.860 49.890 1.00 0.00 ATOM 3937 H12S DPP 33 22.860 33.080 50.850 1.00 0.00 ATOM 3938 3C21 DPP 33 22.710 31.830 49.020 1.00 0.00 ATOM 3939 H13R DPP 33 22.090 32.660 48.610 1.00 0.00 ATOM 3940 H13S DPP 33 22.150 30.970 49.450 1.00 0.00 ATOM 3941 4C21 DPP 33 23.500 31.230 47.850 1.00 0.00 ATOM 3942 H14R DPP 33 22.670 30.900 47.190 1.00 0.00 ATOM 3943 H14S DPP 33 23.960 30.320 48.290 1.00 0.00 ATOM 3944 5C21 DPP 33 24.420 32.180 47.090 1.00 0.00 ATOM 3945 H15R DPP 33 25.010 31.580 46.360 1.00 0.00 ATOM 3946 H15S DPP 33 25.200 32.700 47.690 1.00 0.00 ATOM 3947 6C21 DPP 33 23.690 33.360 46.440 1.00 0.00 ATOM 3948 H16R DPP 33 22.640 33.070 46.210 1.00 0.00 ATOM 3949 H16S DPP 33 24.200 33.600 45.480 1.00 0.00 ATOM 3950 H16T DPP 33 23.690 34.260 47.090 1.00 0.00 ATOM 3951 C33 DPP 33 16.390 27.640 58.790 1.00 0.00 ATOM 3952 H3X DPP 33 15.530 28.230 59.160 1.00 0.00 ATOM 3953 H3Y DPP 33 16.370 26.640 59.290 1.00 0.00 ATOM 3954 C34 DPP 33 16.280 27.620 57.270 1.00 0.00 ATOM 3955 H4X DPP 33 16.440 28.660 56.910 1.00 0.00 ATOM 3956 H4Y DPP 33 15.270 27.260 56.980 1.00 0.00 ATOM 3957 C35 DPP 33 17.320 26.870 56.420 1.00 0.00 ATOM 3958 H5X DPP 33 18.320 27.270 56.710 1.00 0.00 ATOM 3959 H5Y DPP 33 17.150 27.230 55.380 1.00 0.00 ATOM 3960 C36 DPP 33 17.260 25.350 56.480 1.00 0.00 ATOM 3961 H6X DPP 33 17.010 24.960 57.500 1.00 0.00 ATOM 3962 H6Y DPP 33 18.190 24.830 56.180 1.00 0.00 ATOM 3963 C37 DPP 33 16.120 24.740 55.660 1.00 0.00 ATOM 3964 H7X DPP 33 15.140 25.110 56.050 1.00 0.00 ATOM 3965 H7Y DPP 33 15.970 23.660 55.850 1.00 0.00 ATOM 3966 C38 DPP 33 16.100 25.000 54.160 1.00 0.00 ATOM 3967 H8X DPP 33 15.790 26.040 53.940 1.00 0.00 ATOM 3968 H8Y DPP 33 15.400 24.290 53.670 1.00 0.00 ATOM 3969 C39 DPP 33 17.470 24.810 53.500 1.00 0.00 ATOM 3970 H9X DPP 33 17.800 23.760 53.680 1.00 0.00 ATOM 3971 H9Y DPP 33 18.280 25.470 53.890 1.00 0.00 ATOM 3972 0C31 DPP 33 17.280 25.000 52.000 1.00 0.00 ATOM 3973 H10X DPP 33 16.880 26.030 51.840 1.00 0.00 ATOM 3974 H10Y DPP 33 16.480 24.310 51.660 1.00 0.00 ATOM 3975 1C31 DPP 33 18.520 24.700 51.150 1.00 0.00 ATOM 3976 H11X DPP 33 19.040 23.790 51.520 1.00 0.00 ATOM 3977 H11Y DPP 33 19.230 25.550 51.310 1.00 0.00 ATOM 3978 2C31 DPP 33 18.220 24.520 49.660 1.00 0.00 ATOM 3979 H12X DPP 33 17.300 25.100 49.410 1.00 0.00 ATOM 3980 H12Y DPP 33 18.090 23.440 49.470 1.00 0.00 ATOM 3981 3C31 DPP 33 19.400 25.010 48.830 1.00 0.00 ATOM 3982 H13X DPP 33 19.400 26.120 48.950 1.00 0.00 ATOM 3983 H13Y DPP 33 20.420 24.730 49.180 1.00 0.00 ATOM 3984 4C31 DPP 33 19.270 24.830 47.320 1.00 0.00 ATOM 3985 H14X DPP 33 18.290 25.200 46.930 1.00 0.00 ATOM 3986 H14Y DPP 33 19.370 23.760 47.030 1.00 0.00 ATOM 3987 5C31 DPP 33 20.490 25.450 46.640 1.00 0.00 ATOM 3988 H15X DPP 33 20.380 24.910 45.680 1.00 0.00 ATOM 3989 H15Y DPP 33 21.300 25.040 47.270 1.00 0.00 ATOM 3990 6C31 DPP 33 20.510 26.970 46.490 1.00 0.00 ATOM 3991 H16X DPP 33 20.890 27.410 47.430 1.00 0.00 ATOM 3992 H16Y DPP 33 19.480 27.370 46.410 1.00 0.00 ATOM 3993 H16Z DPP 33 21.120 27.210 45.580 1.00 0.00 ATOM 3994 N DPP 34 38.070 48.900 62.020 1.00 0.00 ATOM 3995 HN1 DPP 34 37.130 49.340 62.010 1.00 0.00 ATOM 3996 HN2 DPP 34 38.050 47.880 61.840 1.00 0.00 ATOM 3997 HN3 DPP 34 38.620 49.020 62.900 1.00 0.00 ATOM 3998 C12 DPP 34 38.880 49.530 60.910 1.00 0.00 ATOM 3999 H12A DPP 34 38.240 49.220 60.050 1.00 0.00 ATOM 4000 H12B DPP 34 38.920 50.610 61.160 1.00 0.00 ATOM 4001 C11 DPP 34 40.330 49.070 60.810 1.00 0.00 ATOM 4002 H11A DPP 34 40.820 49.420 61.750 1.00 0.00 ATOM 4003 H11B DPP 34 40.940 49.550 60.020 1.00 0.00 ATOM 4004 P DPP 34 42.050 47.240 60.390 1.00 0.00 ATOM 4005 O13 DPP 34 42.300 45.830 60.760 1.00 0.00 ATOM 4006 O14 DPP 34 42.970 48.270 60.920 1.00 0.00 ATOM 4007 O11 DPP 34 42.120 47.380 58.800 1.00 0.00 ATOM 4008 O12 DPP 34 40.550 47.650 60.760 1.00 0.00 ATOM 4009 C1 DPP 34 43.350 47.900 58.270 1.00 0.00 ATOM 4010 HA DPP 34 43.540 47.290 57.360 1.00 0.00 ATOM 4011 HB DPP 34 44.230 47.730 58.930 1.00 0.00 ATOM 4012 C2 DPP 34 43.230 49.380 57.880 1.00 0.00 ATOM 4013 HS DPP 34 43.200 50.040 58.780 1.00 0.00 ATOM 4014 O21 DPP 34 42.000 49.610 57.180 1.00 0.00 ATOM 4015 C21 DPP 34 41.430 50.800 57.360 1.00 0.00 ATOM 4016 O22 DPP 34 41.950 51.700 58.000 1.00 0.00 ATOM 4017 C22 DPP 34 40.080 50.870 56.660 1.00 0.00 ATOM 4018 H2R DPP 34 39.350 51.130 57.450 1.00 0.00 ATOM 4019 H2S DPP 34 39.660 49.950 56.200 1.00 0.00 ATOM 4020 C3 DPP 34 44.430 49.880 57.060 1.00 0.00 ATOM 4021 HX DPP 34 45.300 49.680 57.710 1.00 0.00 ATOM 4022 HY DPP 34 44.410 50.990 56.950 1.00 0.00 ATOM 4023 O31 DPP 34 44.400 49.370 55.720 1.00 0.00 ATOM 4024 C31 DPP 34 45.590 49.580 55.160 1.00 0.00 ATOM 4025 O32 DPP 34 46.600 49.940 55.740 1.00 0.00 ATOM 4026 C32 DPP 34 45.410 49.110 53.730 1.00 0.00 ATOM 4027 H2X DPP 34 44.930 50.020 53.310 1.00 0.00 ATOM 4028 H2Y DPP 34 44.730 48.230 53.700 1.00 0.00 ATOM 4029 C23 DPP 34 40.070 52.150 55.830 1.00 0.00 ATOM 4030 H3R DPP 34 40.350 53.070 56.390 1.00 0.00 ATOM 4031 H3S DPP 34 39.010 52.220 55.500 1.00 0.00 ATOM 4032 C24 DPP 34 41.070 52.090 54.670 1.00 0.00 ATOM 4033 H4R DPP 34 42.120 52.230 55.030 1.00 0.00 ATOM 4034 H4S DPP 34 40.790 52.850 53.920 1.00 0.00 ATOM 4035 C25 DPP 34 40.960 50.760 53.910 1.00 0.00 ATOM 4036 H5R DPP 34 39.920 50.590 53.550 1.00 0.00 ATOM 4037 H5S DPP 34 41.320 49.840 54.420 1.00 0.00 ATOM 4038 C26 DPP 34 41.730 50.750 52.590 1.00 0.00 ATOM 4039 H6R DPP 34 42.620 50.090 52.680 1.00 0.00 ATOM 4040 H6S DPP 34 42.080 51.790 52.410 1.00 0.00 ATOM 4041 C27 DPP 34 40.980 50.310 51.330 1.00 0.00 ATOM 4042 H7R DPP 34 40.120 50.950 51.050 1.00 0.00 ATOM 4043 H7S DPP 34 40.590 49.310 51.610 1.00 0.00 ATOM 4044 C28 DPP 34 41.990 50.270 50.180 1.00 0.00 ATOM 4045 H8R DPP 34 42.250 49.200 50.110 1.00 0.00 ATOM 4046 H8S DPP 34 42.850 50.950 50.360 1.00 0.00 ATOM 4047 C29 DPP 34 41.210 50.800 48.980 1.00 0.00 ATOM 4048 H9R DPP 34 40.920 51.870 49.120 1.00 0.00 ATOM 4049 H9S DPP 34 40.300 50.230 48.710 1.00 0.00 ATOM 4050 0C21 DPP 34 42.140 50.680 47.770 1.00 0.00 ATOM 4051 H10R DPP 34 42.290 49.600 47.530 1.00 0.00 ATOM 4052 H10S DPP 34 43.090 51.210 47.990 1.00 0.00 ATOM 4053 1C21 DPP 34 41.340 51.230 46.590 1.00 0.00 ATOM 4054 H11R DPP 34 41.110 52.290 46.860 1.00 0.00 ATOM 4055 H11S DPP 34 40.350 50.770 46.380 1.00 0.00 ATOM 4056 2C21 DPP 34 42.160 51.250 45.310 1.00 0.00 ATOM 4057 H12R DPP 34 43.160 51.700 45.540 1.00 0.00 ATOM 4058 H12S DPP 34 41.870 52.100 44.650 1.00 0.00 ATOM 4059 3C21 DPP 34 42.270 49.890 44.610 1.00 0.00 ATOM 4060 H13R DPP 34 41.240 49.490 44.600 1.00 0.00 ATOM 4061 H13S DPP 34 42.810 49.160 45.250 1.00 0.00 ATOM 4062 4C21 DPP 34 42.970 50.020 43.260 1.00 0.00 ATOM 4063 H14R DPP 34 43.990 50.360 43.540 1.00 0.00 ATOM 4064 H14S DPP 34 42.590 50.820 42.590 1.00 0.00 ATOM 4065 5C21 DPP 34 42.980 48.670 42.530 1.00 0.00 ATOM 4066 H15R DPP 34 41.990 48.160 42.540 1.00 0.00 ATOM 4067 H15S DPP 34 43.660 48.030 43.120 1.00 0.00 ATOM 4068 6C21 DPP 34 43.540 48.650 41.110 1.00 0.00 ATOM 4069 H16R DPP 34 44.570 49.080 41.100 1.00 0.00 ATOM 4070 H16S DPP 34 42.910 49.320 40.490 1.00 0.00 ATOM 4071 H16T DPP 34 43.450 47.610 40.730 1.00 0.00 ATOM 4072 C33 DPP 34 46.800 48.690 53.240 1.00 0.00 ATOM 4073 H3X DPP 34 47.080 47.860 53.920 1.00 0.00 ATOM 4074 H3Y DPP 34 47.560 49.490 53.370 1.00 0.00 ATOM 4075 C34 DPP 34 46.890 48.240 51.780 1.00 0.00 ATOM 4076 H4X DPP 34 46.700 47.170 51.580 1.00 0.00 ATOM 4077 H4Y DPP 34 47.960 48.370 51.490 1.00 0.00 ATOM 4078 C35 DPP 34 45.870 48.700 50.740 1.00 0.00 ATOM 4079 H5X DPP 34 45.650 49.790 50.800 1.00 0.00 ATOM 4080 H5Y DPP 34 44.870 48.340 51.060 1.00 0.00 ATOM 4081 C36 DPP 34 46.260 48.380 49.300 1.00 0.00 ATOM 4082 H6X DPP 34 46.330 47.280 49.140 1.00 0.00 ATOM 4083 H6Y DPP 34 47.220 48.860 49.010 1.00 0.00 ATOM 4084 C37 DPP 34 45.210 48.920 48.330 1.00 0.00 ATOM 4085 H7X DPP 34 44.990 49.980 48.570 1.00 0.00 ATOM 4086 H7Y DPP 34 44.270 48.370 48.570 1.00 0.00 ATOM 4087 C38 DPP 34 45.630 48.890 46.850 1.00 0.00 ATOM 4088 H8X DPP 34 44.790 49.440 46.380 1.00 0.00 ATOM 4089 H8Y DPP 34 45.760 47.870 46.420 1.00 0.00 ATOM 4090 C39 DPP 34 46.920 49.640 46.570 1.00 0.00 ATOM 4091 H9X DPP 34 47.770 48.980 46.850 1.00 0.00 ATOM 4092 H9Y DPP 34 47.030 50.540 47.210 1.00 0.00 ATOM 4093 0C31 DPP 34 47.100 49.970 45.080 1.00 0.00 ATOM 4094 H10X DPP 34 46.460 49.410 44.370 1.00 0.00 ATOM 4095 H10Y DPP 34 48.150 49.660 44.910 1.00 0.00 ATOM 4096 1C31 DPP 34 47.120 51.460 44.710 1.00 0.00 ATOM 4097 H11X DPP 34 47.570 51.970 45.590 1.00 0.00 ATOM 4098 H11Y DPP 34 46.070 51.800 44.660 1.00 0.00 ATOM 4099 2C31 DPP 34 48.100 51.730 43.570 1.00 0.00 ATOM 4100 H12X DPP 34 49.080 51.260 43.770 1.00 0.00 ATOM 4101 H12Y DPP 34 47.800 51.210 42.640 1.00 0.00 ATOM 4102 3C31 DPP 34 48.320 53.220 43.300 1.00 0.00 ATOM 4103 H13X DPP 34 49.290 53.260 42.770 1.00 0.00 ATOM 4104 H13Y DPP 34 48.370 53.880 44.190 1.00 0.00 ATOM 4105 4C31 DPP 34 47.320 53.880 42.340 1.00 0.00 ATOM 4106 H14X DPP 34 46.310 53.830 42.810 1.00 0.00 ATOM 4107 H14Y DPP 34 47.210 53.290 41.410 1.00 0.00 ATOM 4108 5C31 DPP 34 47.670 55.260 41.790 1.00 0.00 ATOM 4109 H15X DPP 34 46.820 55.710 41.240 1.00 0.00 ATOM 4110 H15Y DPP 34 48.470 55.090 41.040 1.00 0.00 ATOM 4111 6C31 DPP 34 48.100 56.260 42.870 1.00 0.00 ATOM 4112 H16X DPP 34 47.450 56.260 43.770 1.00 0.00 ATOM 4113 H16Y DPP 34 48.170 57.330 42.570 1.00 0.00 ATOM 4114 H16Z DPP 34 49.060 55.840 43.240 1.00 0.00 ATOM 4115 N DPP 35 20.370 52.240 67.520 1.00 0.00 ATOM 4116 HN1 DPP 35 21.310 52.440 67.130 1.00 0.00 ATOM 4117 HN2 DPP 35 20.530 51.700 68.390 1.00 0.00 ATOM 4118 HN3 DPP 35 19.860 51.630 66.850 1.00 0.00 ATOM 4119 C12 DPP 35 19.560 53.490 67.760 1.00 0.00 ATOM 4120 H12A DPP 35 18.470 53.270 67.690 1.00 0.00 ATOM 4121 H12B DPP 35 19.860 54.010 68.690 1.00 0.00 ATOM 4122 C11 DPP 35 19.980 54.460 66.660 1.00 0.00 ATOM 4123 H11A DPP 35 20.930 55.030 66.720 1.00 0.00 ATOM 4124 H11B DPP 35 19.210 55.260 66.610 1.00 0.00 ATOM 4125 P DPP 35 18.850 54.320 64.400 1.00 0.00 ATOM 4126 O13 DPP 35 19.260 55.700 64.060 1.00 0.00 ATOM 4127 O14 DPP 35 17.490 54.100 64.930 1.00 0.00 ATOM 4128 O11 DPP 35 19.080 53.230 63.260 1.00 0.00 ATOM 4129 O12 DPP 35 19.960 53.770 65.400 1.00 0.00 ATOM 4130 C1 DPP 35 17.990 53.010 62.360 1.00 0.00 ATOM 4131 HA DPP 35 18.410 52.670 61.390 1.00 0.00 ATOM 4132 HB DPP 35 17.440 53.930 62.060 1.00 0.00 ATOM 4133 C2 DPP 35 17.080 51.860 62.810 1.00 0.00 ATOM 4134 HS DPP 35 17.040 51.950 63.920 1.00 0.00 ATOM 4135 O21 DPP 35 17.670 50.660 62.320 1.00 0.00 ATOM 4136 C21 DPP 35 17.040 49.610 62.840 1.00 0.00 ATOM 4137 O22 DPP 35 16.250 49.690 63.770 1.00 0.00 ATOM 4138 C22 DPP 35 17.560 48.330 62.190 1.00 0.00 ATOM 4139 H2R DPP 35 17.190 47.500 62.830 1.00 0.00 ATOM 4140 H2S DPP 35 18.660 48.400 62.240 1.00 0.00 ATOM 4141 C3 DPP 35 15.660 52.090 62.250 1.00 0.00 ATOM 4142 HX DPP 35 15.330 53.130 62.450 1.00 0.00 ATOM 4143 HY DPP 35 14.880 51.430 62.690 1.00 0.00 ATOM 4144 O31 DPP 35 15.580 51.730 60.870 1.00 0.00 ATOM 4145 C31 DPP 35 15.840 52.560 59.860 1.00 0.00 ATOM 4146 O32 DPP 35 15.970 53.770 59.940 1.00 0.00 ATOM 4147 C32 DPP 35 15.810 51.770 58.560 1.00 0.00 ATOM 4148 H2X DPP 35 14.970 51.050 58.610 1.00 0.00 ATOM 4149 H2Y DPP 35 16.780 51.230 58.560 1.00 0.00 ATOM 4150 C23 DPP 35 17.100 48.320 60.730 1.00 0.00 ATOM 4151 H3R DPP 35 16.570 49.290 60.590 1.00 0.00 ATOM 4152 H3S DPP 35 16.410 47.460 60.570 1.00 0.00 ATOM 4153 C24 DPP 35 18.200 48.050 59.710 1.00 0.00 ATOM 4154 H4R DPP 35 18.630 47.060 59.980 1.00 0.00 ATOM 4155 H4S DPP 35 18.920 48.880 59.900 1.00 0.00 ATOM 4156 C25 DPP 35 17.870 48.280 58.230 1.00 0.00 ATOM 4157 H5R DPP 35 18.750 48.190 57.570 1.00 0.00 ATOM 4158 H5S DPP 35 17.630 49.350 58.030 1.00 0.00 ATOM 4159 C26 DPP 35 16.700 47.380 57.810 1.00 0.00 ATOM 4160 H6R DPP 35 16.110 47.800 56.970 1.00 0.00 ATOM 4161 H6S DPP 35 15.990 47.270 58.650 1.00 0.00 ATOM 4162 C27 DPP 35 17.070 45.920 57.590 1.00 0.00 ATOM 4163 H7R DPP 35 16.070 45.430 57.580 1.00 0.00 ATOM 4164 H7S DPP 35 17.640 45.550 58.470 1.00 0.00 ATOM 4165 C28 DPP 35 17.720 45.550 56.260 1.00 0.00 ATOM 4166 H8R DPP 35 17.630 44.450 56.080 1.00 0.00 ATOM 4167 H8S DPP 35 17.050 46.080 55.550 1.00 0.00 ATOM 4168 C29 DPP 35 19.190 45.930 56.080 1.00 0.00 ATOM 4169 H9R DPP 35 19.590 45.700 57.090 1.00 0.00 ATOM 4170 H9S DPP 35 19.390 47.020 56.000 1.00 0.00 ATOM 4171 0C21 DPP 35 19.950 45.240 54.950 1.00 0.00 ATOM 4172 H10R DPP 35 19.610 44.180 54.920 1.00 0.00 ATOM 4173 H10S DPP 35 21.050 45.210 55.120 1.00 0.00 ATOM 4174 1C21 DPP 35 19.610 45.830 53.580 1.00 0.00 ATOM 4175 H11R DPP 35 19.580 46.930 53.420 1.00 0.00 ATOM 4176 H11S DPP 35 18.560 45.550 53.350 1.00 0.00 ATOM 4177 2C21 DPP 35 20.570 45.380 52.480 1.00 0.00 ATOM 4178 H12R DPP 35 20.810 44.300 52.390 1.00 0.00 ATOM 4179 H12S DPP 35 21.520 45.960 52.570 1.00 0.00 ATOM 4180 3C21 DPP 35 19.940 45.600 51.100 1.00 0.00 ATOM 4181 H13R DPP 35 19.580 46.660 51.130 1.00 0.00 ATOM 4182 H13S DPP 35 19.080 44.950 50.850 1.00 0.00 ATOM 4183 4C21 DPP 35 20.970 45.590 49.970 1.00 0.00 ATOM 4184 H14R DPP 35 22.000 45.850 50.300 1.00 0.00 ATOM 4185 H14S DPP 35 20.720 46.440 49.300 1.00 0.00 ATOM 4186 5C21 DPP 35 20.870 44.270 49.200 1.00 0.00 ATOM 4187 H15R DPP 35 19.860 44.180 48.770 1.00 0.00 ATOM 4188 H15S DPP 35 21.090 43.370 49.820 1.00 0.00 ATOM 4189 6C21 DPP 35 21.870 44.060 48.060 1.00 0.00 ATOM 4190 H16R DPP 35 21.690 43.140 47.470 1.00 0.00 ATOM 4191 H16S DPP 35 22.940 44.150 48.360 1.00 0.00 ATOM 4192 H16T DPP 35 21.740 44.920 47.360 1.00 0.00 ATOM 4193 C33 DPP 35 15.770 52.740 57.380 1.00 0.00 ATOM 4194 H3X DPP 35 15.080 53.610 57.450 1.00 0.00 ATOM 4195 H3Y DPP 35 15.240 52.210 56.560 1.00 0.00 ATOM 4196 C34 DPP 35 17.140 53.230 56.900 1.00 0.00 ATOM 4197 H4X DPP 35 17.690 53.640 57.770 1.00 0.00 ATOM 4198 H4Y DPP 35 17.010 54.040 56.150 1.00 0.00 ATOM 4199 C35 DPP 35 17.990 52.130 56.250 1.00 0.00 ATOM 4200 H5X DPP 35 18.290 51.310 56.930 1.00 0.00 ATOM 4201 H5Y DPP 35 18.980 52.610 56.080 1.00 0.00 ATOM 4202 C36 DPP 35 17.460 51.450 54.980 1.00 0.00 ATOM 4203 H6X DPP 35 17.470 52.300 54.270 1.00 0.00 ATOM 4204 H6Y DPP 35 16.390 51.150 55.050 1.00 0.00 ATOM 4205 C37 DPP 35 18.280 50.290 54.440 1.00 0.00 ATOM 4206 H7X DPP 35 18.640 49.640 55.270 1.00 0.00 ATOM 4207 H7Y DPP 35 19.240 50.740 54.100 1.00 0.00 ATOM 4208 C38 DPP 35 17.530 49.460 53.390 1.00 0.00 ATOM 4209 H8X DPP 35 16.470 49.340 53.700 1.00 0.00 ATOM 4210 H8Y DPP 35 17.830 48.390 53.440 1.00 0.00 ATOM 4211 C39 DPP 35 17.650 50.060 51.990 1.00 0.00 ATOM 4212 H9X DPP 35 18.680 50.250 51.630 1.00 0.00 ATOM 4213 H9Y DPP 35 16.980 50.940 52.060 1.00 0.00 ATOM 4214 0C31 DPP 35 16.980 49.250 50.880 1.00 0.00 ATOM 4215 H10X DPP 35 15.880 49.300 51.060 1.00 0.00 ATOM 4216 H10Y DPP 35 17.140 48.170 51.080 1.00 0.00 ATOM 4217 1C31 DPP 35 17.270 49.530 49.400 1.00 0.00 ATOM 4218 H11X DPP 35 18.350 49.400 49.190 1.00 0.00 ATOM 4219 H11Y DPP 35 17.070 50.590 49.130 1.00 0.00 ATOM 4220 2C31 DPP 35 16.530 48.610 48.440 1.00 0.00 ATOM 4221 H12X DPP 35 15.460 48.910 48.320 1.00 0.00 ATOM 4222 H12Y DPP 35 16.500 47.630 48.970 1.00 0.00 ATOM 4223 3C31 DPP 35 17.050 48.390 47.020 1.00 0.00 ATOM 4224 H13X DPP 35 17.140 49.440 46.670 1.00 0.00 ATOM 4225 H13Y DPP 35 16.340 47.850 46.340 1.00 0.00 ATOM 4226 4C31 DPP 35 18.400 47.700 46.820 1.00 0.00 ATOM 4227 H14X DPP 35 18.270 46.630 47.110 1.00 0.00 ATOM 4228 H14Y DPP 35 18.990 48.050 47.690 1.00 0.00 ATOM 4229 5C31 DPP 35 19.070 47.720 45.440 1.00 0.00 ATOM 4230 H15X DPP 35 19.780 46.890 45.250 1.00 0.00 ATOM 4231 H15Y DPP 35 19.700 48.630 45.370 1.00 0.00 ATOM 4232 6C31 DPP 35 18.040 47.820 44.320 1.00 0.00 ATOM 4233 H16X DPP 35 17.180 47.130 44.460 1.00 0.00 ATOM 4234 H16Y DPP 35 18.560 47.580 43.360 1.00 0.00 ATOM 4235 H16Z DPP 35 17.590 48.820 44.120 1.00 0.00 ATOM 4236 N DPP 36 30.650 27.910 63.890 1.00 0.00 ATOM 4237 HN1 DPP 36 30.280 26.950 63.970 1.00 0.00 ATOM 4238 HN2 DPP 36 30.710 28.290 64.860 1.00 0.00 ATOM 4239 HN3 DPP 36 29.950 28.450 63.350 1.00 0.00 ATOM 4240 C12 DPP 36 31.980 27.960 63.170 1.00 0.00 ATOM 4241 H12A DPP 36 32.540 27.140 63.660 1.00 0.00 ATOM 4242 H12B DPP 36 31.790 27.670 62.110 1.00 0.00 ATOM 4243 C11 DPP 36 32.830 29.210 63.380 1.00 0.00 ATOM 4244 H11A DPP 36 33.630 29.200 62.610 1.00 0.00 ATOM 4245 H11B DPP 36 33.290 29.160 64.400 1.00 0.00 ATOM 4246 P DPP 36 32.680 31.750 63.110 1.00 0.00 ATOM 4247 O13 DPP 36 34.050 31.870 63.660 1.00 0.00 ATOM 4248 O14 DPP 36 31.750 32.850 63.430 1.00 0.00 ATOM 4249 O11 DPP 36 32.720 31.680 61.510 1.00 0.00 ATOM 4250 O12 DPP 36 31.960 30.340 63.370 1.00 0.00 ATOM 4251 C1 DPP 36 33.920 32.060 60.840 1.00 0.00 ATOM 4252 HA DPP 36 33.990 31.690 59.800 1.00 0.00 ATOM 4253 HB DPP 36 34.840 31.640 61.290 1.00 0.00 ATOM 4254 C2 DPP 36 34.080 33.590 60.830 1.00 0.00 ATOM 4255 HS DPP 36 34.600 33.770 61.790 1.00 0.00 ATOM 4256 O21 DPP 36 32.770 34.180 60.750 1.00 0.00 ATOM 4257 C21 DPP 36 32.720 35.430 61.210 1.00 0.00 ATOM 4258 O22 DPP 36 33.520 35.930 61.970 1.00 0.00 ATOM 4259 C22 DPP 36 31.350 35.940 60.780 1.00 0.00 ATOM 4260 H2R DPP 36 30.600 35.670 61.550 1.00 0.00 ATOM 4261 H2S DPP 36 31.140 35.350 59.860 1.00 0.00 ATOM 4262 C3 DPP 36 34.840 34.030 59.570 1.00 0.00 ATOM 4263 HX DPP 36 35.870 33.630 59.670 1.00 0.00 ATOM 4264 HY DPP 36 35.040 35.120 59.540 1.00 0.00 ATOM 4265 O31 DPP 36 34.320 33.630 58.290 1.00 0.00 ATOM 4266 C31 DPP 36 33.550 34.540 57.690 1.00 0.00 ATOM 4267 O32 DPP 36 33.060 35.550 58.160 1.00 0.00 ATOM 4268 C32 DPP 36 33.350 34.110 56.240 1.00 0.00 ATOM 4269 H2X DPP 36 32.380 33.570 56.250 1.00 0.00 ATOM 4270 H2Y DPP 36 34.140 33.430 55.870 1.00 0.00 ATOM 4271 C23 DPP 36 31.250 37.440 60.480 1.00 0.00 ATOM 4272 H3R DPP 36 32.280 37.840 60.370 1.00 0.00 ATOM 4273 H3S DPP 36 30.680 37.860 61.340 1.00 0.00 ATOM 4274 C24 DPP 36 30.660 37.580 59.080 1.00 0.00 ATOM 4275 H4R DPP 36 29.720 36.990 58.980 1.00 0.00 ATOM 4276 H4S DPP 36 31.360 37.180 58.300 1.00 0.00 ATOM 4277 C25 DPP 36 30.280 39.050 58.930 1.00 0.00 ATOM 4278 H5R DPP 36 29.710 39.340 59.840 1.00 0.00 ATOM 4279 H5S DPP 36 29.520 39.130 58.120 1.00 0.00 ATOM 4280 C26 DPP 36 31.430 40.030 58.720 1.00 0.00 ATOM 4281 H6R DPP 36 32.140 40.020 59.570 1.00 0.00 ATOM 4282 H6S DPP 36 31.180 41.110 58.640 1.00 0.00 ATOM 4283 C27 DPP 36 32.200 39.880 57.400 1.00 0.00 ATOM 4284 H7R DPP 36 32.670 38.890 57.290 1.00 0.00 ATOM 4285 H7S DPP 36 33.030 40.610 57.430 1.00 0.00 ATOM 4286 C28 DPP 36 31.300 40.140 56.180 1.00 0.00 ATOM 4287 H8R DPP 36 31.040 41.220 56.260 1.00 0.00 ATOM 4288 H8S DPP 36 30.450 39.440 56.050 1.00 0.00 ATOM 4289 C29 DPP 36 32.090 40.020 54.870 1.00 0.00 ATOM 4290 H9R DPP 36 32.280 38.920 54.830 1.00 0.00 ATOM 4291 H9S DPP 36 32.960 40.700 54.880 1.00 0.00 ATOM 4292 0C21 DPP 36 31.150 40.330 53.710 1.00 0.00 ATOM 4293 H10R DPP 36 30.610 41.280 53.910 1.00 0.00 ATOM 4294 H10S DPP 36 30.380 39.520 53.710 1.00 0.00 ATOM 4295 1C21 DPP 36 31.790 40.580 52.340 1.00 0.00 ATOM 4296 H11R DPP 36 32.690 41.190 52.600 1.00 0.00 ATOM 4297 H11S DPP 36 31.170 41.200 51.660 1.00 0.00 ATOM 4298 2C21 DPP 36 32.310 39.340 51.610 1.00 0.00 ATOM 4299 H12R DPP 36 32.870 38.700 52.320 1.00 0.00 ATOM 4300 H12S DPP 36 33.040 39.620 50.820 1.00 0.00 ATOM 4301 3C21 DPP 36 31.180 38.500 51.010 1.00 0.00 ATOM 4302 H13R DPP 36 30.250 39.050 50.760 1.00 0.00 ATOM 4303 H13S DPP 36 30.990 37.840 51.880 1.00 0.00 ATOM 4304 4C21 DPP 36 31.820 37.730 49.850 1.00 0.00 ATOM 4305 H14R DPP 36 31.190 36.860 49.590 1.00 0.00 ATOM 4306 H14S DPP 36 32.770 37.240 50.130 1.00 0.00 ATOM 4307 5C21 DPP 36 32.050 38.500 48.550 1.00 0.00 ATOM 4308 H15R DPP 36 32.400 37.900 47.690 1.00 0.00 ATOM 4309 H15S DPP 36 32.770 39.320 48.780 1.00 0.00 ATOM 4310 6C21 DPP 36 30.820 39.180 47.960 1.00 0.00 ATOM 4311 H16R DPP 36 30.990 39.610 46.940 1.00 0.00 ATOM 4312 H16S DPP 36 30.640 40.180 48.410 1.00 0.00 ATOM 4313 H16T DPP 36 29.910 38.550 47.920 1.00 0.00 ATOM 4314 C33 DPP 36 33.300 35.300 55.270 1.00 0.00 ATOM 4315 H3X DPP 36 33.900 36.170 55.600 1.00 0.00 ATOM 4316 H3Y DPP 36 32.220 35.570 55.210 1.00 0.00 ATOM 4317 C34 DPP 36 33.820 35.010 53.860 1.00 0.00 ATOM 4318 H4X DPP 36 34.820 34.530 53.850 1.00 0.00 ATOM 4319 H4Y DPP 36 33.860 36.020 53.400 1.00 0.00 ATOM 4320 C35 DPP 36 32.870 34.200 52.980 1.00 0.00 ATOM 4321 H5X DPP 36 31.910 34.720 53.210 1.00 0.00 ATOM 4322 H5Y DPP 36 32.900 33.240 53.530 1.00 0.00 ATOM 4323 C36 DPP 36 33.440 34.110 51.560 1.00 0.00 ATOM 4324 H6X DPP 36 34.470 33.710 51.530 1.00 0.00 ATOM 4325 H6Y DPP 36 33.480 35.070 51.000 1.00 0.00 ATOM 4326 C37 DPP 36 32.610 33.090 50.780 1.00 0.00 ATOM 4327 H7X DPP 36 32.370 32.230 51.440 1.00 0.00 ATOM 4328 H7Y DPP 36 33.330 32.780 49.990 1.00 0.00 ATOM 4329 C38 DPP 36 31.350 33.580 50.070 1.00 0.00 ATOM 4330 H8X DPP 36 30.450 33.080 50.480 1.00 0.00 ATOM 4331 H8Y DPP 36 31.160 34.670 50.150 1.00 0.00 ATOM 4332 C39 DPP 36 31.280 33.360 48.550 1.00 0.00 ATOM 4333 H9X DPP 36 30.260 33.710 48.270 1.00 0.00 ATOM 4334 H9Y DPP 36 31.310 32.300 48.230 1.00 0.00 ATOM 4335 0C31 DPP 36 32.250 34.320 47.850 1.00 0.00 ATOM 4336 H10X DPP 36 33.290 33.980 48.060 1.00 0.00 ATOM 4337 H10Y DPP 36 32.030 35.370 48.130 1.00 0.00 ATOM 4338 1C31 DPP 36 32.350 34.330 46.330 1.00 0.00 ATOM 4339 H11X DPP 36 32.330 33.290 45.930 1.00 0.00 ATOM 4340 H11Y DPP 36 33.360 34.720 46.120 1.00 0.00 ATOM 4341 2C31 DPP 36 31.400 35.210 45.500 1.00 0.00 ATOM 4342 H12X DPP 36 31.410 34.870 44.440 1.00 0.00 ATOM 4343 H12Y DPP 36 31.740 36.260 45.420 1.00 0.00 ATOM 4344 3C31 DPP 36 29.930 35.110 45.900 1.00 0.00 ATOM 4345 H13X DPP 36 29.820 35.410 46.970 1.00 0.00 ATOM 4346 H13Y DPP 36 29.580 34.060 45.840 1.00 0.00 ATOM 4347 4C31 DPP 36 29.080 36.070 45.060 1.00 0.00 ATOM 4348 H14X DPP 36 29.750 36.950 44.900 1.00 0.00 ATOM 4349 H14Y DPP 36 28.180 36.380 45.620 1.00 0.00 ATOM 4350 5C31 DPP 36 28.760 35.460 43.700 1.00 0.00 ATOM 4351 H15X DPP 36 29.760 35.200 43.300 1.00 0.00 ATOM 4352 H15Y DPP 36 28.370 36.210 42.990 1.00 0.00 ATOM 4353 6C31 DPP 36 27.990 34.140 43.650 1.00 0.00 ATOM 4354 H16X DPP 36 28.580 33.380 44.190 1.00 0.00 ATOM 4355 H16Y DPP 36 27.810 33.700 42.650 1.00 0.00 ATOM 4356 H16Z DPP 36 27.000 34.220 44.150 1.00 0.00 ATOM 4357 N DPP 37 13.840 48.910 64.870 1.00 0.00 ATOM 4358 HN1 DPP 37 13.350 48.560 64.020 1.00 0.00 ATOM 4359 HN2 DPP 37 14.760 49.300 64.580 1.00 0.00 ATOM 4360 HN3 DPP 37 14.080 48.000 65.320 1.00 0.00 ATOM 4361 C12 DPP 37 13.000 49.810 65.740 1.00 0.00 ATOM 4362 H12A DPP 37 12.110 49.270 66.130 1.00 0.00 ATOM 4363 H12B DPP 37 13.610 50.100 66.620 1.00 0.00 ATOM 4364 C11 DPP 37 12.600 51.070 64.960 1.00 0.00 ATOM 4365 H11A DPP 37 13.320 51.870 65.280 1.00 0.00 ATOM 4366 H11B DPP 37 11.660 51.530 65.330 1.00 0.00 ATOM 4367 P DPP 37 11.140 50.390 63.060 1.00 0.00 ATOM 4368 O13 DPP 37 10.080 51.300 63.540 1.00 0.00 ATOM 4369 O14 DPP 37 11.070 48.980 63.510 1.00 0.00 ATOM 4370 O11 DPP 37 11.050 50.360 61.470 1.00 0.00 ATOM 4371 O12 DPP 37 12.550 50.960 63.540 1.00 0.00 ATOM 4372 C1 DPP 37 12.230 50.790 60.790 1.00 0.00 ATOM 4373 HA DPP 37 13.120 50.160 61.020 1.00 0.00 ATOM 4374 HB DPP 37 12.350 51.860 61.020 1.00 0.00 ATOM 4375 C2 DPP 37 11.930 50.720 59.280 1.00 0.00 ATOM 4376 HS DPP 37 12.820 51.020 58.700 1.00 0.00 ATOM 4377 O21 DPP 37 10.780 51.520 59.000 1.00 0.00 ATOM 4378 C21 DPP 37 11.040 52.620 58.290 1.00 0.00 ATOM 4379 O22 DPP 37 12.160 52.980 57.970 1.00 0.00 ATOM 4380 C22 DPP 37 9.700 53.310 58.030 1.00 0.00 ATOM 4381 H2R DPP 37 9.590 54.110 58.790 1.00 0.00 ATOM 4382 H2S DPP 37 8.810 52.650 58.030 1.00 0.00 ATOM 4383 C3 DPP 37 11.630 49.340 58.670 1.00 0.00 ATOM 4384 HX DPP 37 10.680 48.970 59.110 1.00 0.00 ATOM 4385 HY DPP 37 12.440 48.610 58.910 1.00 0.00 ATOM 4386 O31 DPP 37 11.460 49.340 57.250 1.00 0.00 ATOM 4387 C31 DPP 37 12.570 49.470 56.530 1.00 0.00 ATOM 4388 O32 DPP 37 13.720 49.380 56.930 1.00 0.00 ATOM 4389 C32 DPP 37 12.200 49.870 55.110 1.00 0.00 ATOM 4390 H2X DPP 37 11.720 50.880 55.150 1.00 0.00 ATOM 4391 H2Y DPP 37 11.430 49.210 54.660 1.00 0.00 ATOM 4392 C23 DPP 37 9.830 54.080 56.720 1.00 0.00 ATOM 4393 H3R DPP 37 10.650 54.830 56.660 1.00 0.00 ATOM 4394 H3S DPP 37 8.910 54.710 56.730 1.00 0.00 ATOM 4395 C24 DPP 37 9.690 53.150 55.520 1.00 0.00 ATOM 4396 H4R DPP 37 8.990 52.320 55.770 1.00 0.00 ATOM 4397 H4S DPP 37 10.710 52.730 55.370 1.00 0.00 ATOM 4398 C25 DPP 37 9.250 53.970 54.300 1.00 0.00 ATOM 4399 H5R DPP 37 9.980 54.760 54.030 1.00 0.00 ATOM 4400 H5S DPP 37 8.280 54.490 54.440 1.00 0.00 ATOM 4401 C26 DPP 37 8.950 53.110 53.080 1.00 0.00 ATOM 4402 H6R DPP 37 9.280 52.080 53.330 1.00 0.00 ATOM 4403 H6S DPP 37 9.730 53.410 52.340 1.00 0.00 ATOM 4404 C27 DPP 37 7.520 53.200 52.530 1.00 0.00 ATOM 4405 H7R DPP 37 7.390 54.290 52.360 1.00 0.00 ATOM 4406 H7S DPP 37 6.740 52.720 53.160 1.00 0.00 ATOM 4407 C28 DPP 37 7.510 52.830 51.050 1.00 0.00 ATOM 4408 H8R DPP 37 7.770 51.750 51.060 1.00 0.00 ATOM 4409 H8S DPP 37 8.350 53.310 50.500 1.00 0.00 ATOM 4410 C29 DPP 37 6.210 53.070 50.280 1.00 0.00 ATOM 4411 H9R DPP 37 5.960 54.140 50.130 1.00 0.00 ATOM 4412 H9S DPP 37 5.440 52.450 50.790 1.00 0.00 ATOM 4413 0C21 DPP 37 6.110 52.440 48.890 1.00 0.00 ATOM 4414 H10R DPP 37 6.220 51.340 49.010 1.00 0.00 ATOM 4415 H10S DPP 37 6.890 52.830 48.200 1.00 0.00 ATOM 4416 1C21 DPP 37 4.780 52.520 48.130 1.00 0.00 ATOM 4417 H11R DPP 37 5.050 52.100 47.140 1.00 0.00 ATOM 4418 H11S DPP 37 4.470 53.590 48.030 1.00 0.00 ATOM 4419 2C21 DPP 37 3.670 51.810 48.890 1.00 0.00 ATOM 4420 H12R DPP 37 3.310 52.430 49.740 1.00 0.00 ATOM 4421 H12S DPP 37 4.190 50.860 49.140 1.00 0.00 ATOM 4422 3C21 DPP 37 2.440 51.560 48.010 1.00 0.00 ATOM 4423 H13R DPP 37 1.600 51.200 48.640 1.00 0.00 ATOM 4424 H13S DPP 37 2.660 50.770 47.270 1.00 0.00 ATOM 4425 4C21 DPP 37 2.070 52.770 47.140 1.00 0.00 ATOM 4426 H14R DPP 37 3.010 53.150 46.690 1.00 0.00 ATOM 4427 H14S DPP 37 1.660 53.600 47.760 1.00 0.00 ATOM 4428 5C21 DPP 37 1.050 52.430 46.050 1.00 0.00 ATOM 4429 H15R DPP 37 0.220 51.900 46.560 1.00 0.00 ATOM 4430 H15S DPP 37 1.580 51.790 45.310 1.00 0.00 ATOM 4431 6C21 DPP 37 0.610 53.630 45.220 1.00 0.00 ATOM 4432 H16R DPP 37 -0.120 53.300 44.460 1.00 0.00 ATOM 4433 H16S DPP 37 1.450 54.140 44.700 1.00 0.00 ATOM 4434 H16T DPP 37 0.180 54.320 45.990 1.00 0.00 ATOM 4435 C33 DPP 37 13.450 49.810 54.240 1.00 0.00 ATOM 4436 H3X DPP 37 14.100 48.940 54.500 1.00 0.00 ATOM 4437 H3Y DPP 37 14.050 50.740 54.360 1.00 0.00 ATOM 4438 C34 DPP 37 13.180 49.630 52.740 1.00 0.00 ATOM 4439 H4X DPP 37 12.810 48.590 52.630 1.00 0.00 ATOM 4440 H4Y DPP 37 14.140 49.720 52.180 1.00 0.00 ATOM 4441 C35 DPP 37 12.280 50.700 52.140 1.00 0.00 ATOM 4442 H5X DPP 37 12.650 51.690 52.490 1.00 0.00 ATOM 4443 H5Y DPP 37 11.270 50.480 52.560 1.00 0.00 ATOM 4444 C36 DPP 37 12.130 50.630 50.620 1.00 0.00 ATOM 4445 H6X DPP 37 12.080 49.580 50.260 1.00 0.00 ATOM 4446 H6Y DPP 37 13.050 51.080 50.170 1.00 0.00 ATOM 4447 C37 DPP 37 10.800 51.170 50.110 1.00 0.00 ATOM 4448 H7X DPP 37 10.720 52.280 50.080 1.00 0.00 ATOM 4449 H7Y DPP 37 9.980 50.810 50.770 1.00 0.00 ATOM 4450 C38 DPP 37 10.610 50.810 48.640 1.00 0.00 ATOM 4451 H8X DPP 37 10.460 49.710 48.570 1.00 0.00 ATOM 4452 H8Y DPP 37 11.500 51.060 48.030 1.00 0.00 ATOM 4453 C39 DPP 37 9.420 51.560 48.040 1.00 0.00 ATOM 4454 H9X DPP 37 9.740 52.620 48.080 1.00 0.00 ATOM 4455 H9Y DPP 37 8.610 51.420 48.780 1.00 0.00 ATOM 4456 0C31 DPP 37 9.020 51.120 46.630 1.00 0.00 ATOM 4457 H10X DPP 37 7.940 51.400 46.570 1.00 0.00 ATOM 4458 H10Y DPP 37 8.940 50.020 46.460 1.00 0.00 ATOM 4459 1C31 DPP 37 9.950 51.660 45.550 1.00 0.00 ATOM 4460 H11X DPP 37 10.940 51.210 45.790 1.00 0.00 ATOM 4461 H11Y DPP 37 9.870 52.760 45.730 1.00 0.00 ATOM 4462 2C31 DPP 37 9.540 51.310 44.120 1.00 0.00 ATOM 4463 H12X DPP 37 8.480 50.980 44.210 1.00 0.00 ATOM 4464 H12Y DPP 37 10.070 50.370 43.840 1.00 0.00 ATOM 4465 3C31 DPP 37 9.800 52.420 43.100 1.00 0.00 ATOM 4466 H13X DPP 37 10.800 52.890 43.250 1.00 0.00 ATOM 4467 H13Y DPP 37 9.260 53.370 43.290 1.00 0.00 ATOM 4468 4C31 DPP 37 9.640 52.090 41.610 1.00 0.00 ATOM 4469 H14X DPP 37 8.690 51.550 41.390 1.00 0.00 ATOM 4470 H14Y DPP 37 10.440 51.340 41.470 1.00 0.00 ATOM 4471 5C31 DPP 37 9.910 53.250 40.650 1.00 0.00 ATOM 4472 H15X DPP 37 10.500 52.800 39.820 1.00 0.00 ATOM 4473 H15Y DPP 37 10.610 54.000 41.070 1.00 0.00 ATOM 4474 6C31 DPP 37 8.700 53.870 39.950 1.00 0.00 ATOM 4475 H16X DPP 37 7.930 54.100 40.710 1.00 0.00 ATOM 4476 H16Y DPP 37 8.290 53.110 39.260 1.00 0.00 ATOM 4477 H16Z DPP 37 8.900 54.900 39.560 1.00 0.00 ATOM 4478 N DPP 38 2.610 51.300 61.470 1.00 0.00 ATOM 4479 HN1 DPP 38 2.220 50.710 60.700 1.00 0.00 ATOM 4480 HN2 DPP 38 3.520 50.820 61.650 1.00 0.00 ATOM 4481 HN3 DPP 38 2.050 51.280 62.350 1.00 0.00 ATOM 4482 C12 DPP 38 2.810 52.690 60.930 1.00 0.00 ATOM 4483 H12A DPP 38 1.790 53.120 60.800 1.00 0.00 ATOM 4484 H12B DPP 38 3.330 52.740 59.950 1.00 0.00 ATOM 4485 C11 DPP 38 3.510 53.640 61.900 1.00 0.00 ATOM 4486 H11A DPP 38 2.700 53.790 62.650 1.00 0.00 ATOM 4487 H11B DPP 38 3.670 54.610 61.390 1.00 0.00 ATOM 4488 P DPP 38 6.120 53.420 61.860 1.00 0.00 ATOM 4489 O13 DPP 38 6.370 52.650 60.620 1.00 0.00 ATOM 4490 O14 DPP 38 7.170 53.410 62.900 1.00 0.00 ATOM 4491 O11 DPP 38 5.960 54.950 61.410 1.00 0.00 ATOM 4492 O12 DPP 38 4.690 53.070 62.480 1.00 0.00 ATOM 4493 C1 DPP 38 7.070 55.760 61.020 1.00 0.00 ATOM 4494 HA DPP 38 7.970 55.110 61.070 1.00 0.00 ATOM 4495 HB DPP 38 7.070 56.580 61.770 1.00 0.00 ATOM 4496 C2 DPP 38 6.960 56.220 59.560 1.00 0.00 ATOM 4497 HS DPP 38 6.070 56.890 59.560 1.00 0.00 ATOM 4498 O21 DPP 38 6.850 55.080 58.700 1.00 0.00 ATOM 4499 C21 DPP 38 5.580 54.790 58.440 1.00 0.00 ATOM 4500 O22 DPP 38 4.580 55.400 58.780 1.00 0.00 ATOM 4501 C22 DPP 38 5.490 53.530 57.580 1.00 0.00 ATOM 4502 H2R DPP 38 4.420 53.210 57.590 1.00 0.00 ATOM 4503 H2S DPP 38 6.010 52.720 58.130 1.00 0.00 ATOM 4504 C3 DPP 38 8.210 57.000 59.120 1.00 0.00 ATOM 4505 HX DPP 38 9.070 56.310 59.000 1.00 0.00 ATOM 4506 HY DPP 38 8.530 57.660 59.950 1.00 0.00 ATOM 4507 O31 DPP 38 8.190 57.760 57.900 1.00 0.00 ATOM 4508 C31 DPP 38 7.640 58.970 57.970 1.00 0.00 ATOM 4509 O32 DPP 38 7.130 59.540 58.920 1.00 0.00 ATOM 4510 C32 DPP 38 7.760 59.650 56.610 1.00 0.00 ATOM 4511 H2X DPP 38 8.860 59.660 56.450 1.00 0.00 ATOM 4512 H2Y DPP 38 7.410 60.700 56.690 1.00 0.00 ATOM 4513 C23 DPP 38 6.030 53.830 56.180 1.00 0.00 ATOM 4514 H3R DPP 38 6.110 52.850 55.660 1.00 0.00 ATOM 4515 H3S DPP 38 6.990 54.350 56.370 1.00 0.00 ATOM 4516 C24 DPP 38 5.040 54.610 55.300 1.00 0.00 ATOM 4517 H4R DPP 38 5.630 55.130 54.520 1.00 0.00 ATOM 4518 H4S DPP 38 4.570 55.310 56.030 1.00 0.00 ATOM 4519 C25 DPP 38 3.880 53.880 54.630 1.00 0.00 ATOM 4520 H5R DPP 38 3.260 53.380 55.400 1.00 0.00 ATOM 4521 H5S DPP 38 4.300 53.180 53.870 1.00 0.00 ATOM 4522 C26 DPP 38 2.920 54.810 53.870 1.00 0.00 ATOM 4523 H6R DPP 38 3.530 55.660 53.490 1.00 0.00 ATOM 4524 H6S DPP 38 2.170 55.110 54.630 1.00 0.00 ATOM 4525 C27 DPP 38 2.310 54.090 52.670 1.00 0.00 ATOM 4526 H7R DPP 38 1.950 53.100 53.040 1.00 0.00 ATOM 4527 H7S DPP 38 3.150 54.030 51.940 1.00 0.00 ATOM 4528 C28 DPP 38 1.100 54.810 52.070 1.00 0.00 ATOM 4529 H8R DPP 38 1.370 55.830 51.720 1.00 0.00 ATOM 4530 H8S DPP 38 0.260 54.960 52.780 1.00 0.00 ATOM 4531 C29 DPP 38 0.640 54.150 50.770 1.00 0.00 ATOM 4532 H9R DPP 38 1.420 53.460 50.410 1.00 0.00 ATOM 4533 H9S DPP 38 0.450 55.000 50.080 1.00 0.00 ATOM 4534 0C21 DPP 38 -0.790 53.590 50.830 1.00 0.00 ATOM 4535 H10R DPP 38 -1.500 54.380 51.160 1.00 0.00 ATOM 4536 H10S DPP 38 -0.830 52.810 51.620 1.00 0.00 ATOM 4537 1C21 DPP 38 -1.250 53.030 49.480 1.00 0.00 ATOM 4538 H11R DPP 38 -0.480 52.310 49.130 1.00 0.00 ATOM 4539 H11S DPP 38 -1.410 53.920 48.840 1.00 0.00 ATOM 4540 2C21 DPP 38 -2.400 52.030 49.570 1.00 0.00 ATOM 4541 H12R DPP 38 -3.340 52.560 49.850 1.00 0.00 ATOM 4542 H12S DPP 38 -2.180 51.290 50.370 1.00 0.00 ATOM 4543 3C21 DPP 38 -2.580 51.370 48.200 1.00 0.00 ATOM 4544 H13R DPP 38 -3.400 50.650 48.400 1.00 0.00 ATOM 4545 H13S DPP 38 -1.660 50.960 47.730 1.00 0.00 ATOM 4546 4C21 DPP 38 -3.140 52.300 47.130 1.00 0.00 ATOM 4547 H14R DPP 38 -2.420 53.100 46.860 1.00 0.00 ATOM 4548 H14S DPP 38 -4.100 52.780 47.420 1.00 0.00 ATOM 4549 5C21 DPP 38 -3.400 51.520 45.850 1.00 0.00 ATOM 4550 H15R DPP 38 -4.300 50.850 45.840 1.00 0.00 ATOM 4551 H15S DPP 38 -2.470 51.030 45.500 1.00 0.00 ATOM 4552 6C21 DPP 38 -3.800 52.310 44.610 1.00 0.00 ATOM 4553 H16R DPP 38 -2.970 52.990 44.320 1.00 0.00 ATOM 4554 H16S DPP 38 -4.660 52.980 44.860 1.00 0.00 ATOM 4555 H16T DPP 38 -4.120 51.670 43.760 1.00 0.00 ATOM 4556 C33 DPP 38 6.850 59.030 55.550 1.00 0.00 ATOM 4557 H3X DPP 38 6.730 59.870 54.820 1.00 0.00 ATOM 4558 H3Y DPP 38 5.810 58.830 55.890 1.00 0.00 ATOM 4559 C34 DPP 38 7.340 57.720 54.940 1.00 0.00 ATOM 4560 H4X DPP 38 6.560 57.270 54.280 1.00 0.00 ATOM 4561 H4Y DPP 38 7.530 56.980 55.750 1.00 0.00 ATOM 4562 C35 DPP 38 8.720 57.940 54.330 1.00 0.00 ATOM 4563 H5X DPP 38 8.980 56.940 53.930 1.00 0.00 ATOM 4564 H5Y DPP 38 9.530 58.280 55.010 1.00 0.00 ATOM 4565 C36 DPP 38 8.740 58.980 53.210 1.00 0.00 ATOM 4566 H6X DPP 38 9.130 59.940 53.610 1.00 0.00 ATOM 4567 H6Y DPP 38 7.680 59.100 52.870 1.00 0.00 ATOM 4568 C37 DPP 38 9.600 58.590 52.010 1.00 0.00 ATOM 4569 H7X DPP 38 9.260 59.260 51.190 1.00 0.00 ATOM 4570 H7Y DPP 38 9.240 57.540 51.860 1.00 0.00 ATOM 4571 C38 DPP 38 11.110 58.750 52.180 1.00 0.00 ATOM 4572 H8X DPP 38 11.360 58.190 53.110 1.00 0.00 ATOM 4573 H8Y DPP 38 11.180 59.820 52.470 1.00 0.00 ATOM 4574 C39 DPP 38 12.000 58.370 51.000 1.00 0.00 ATOM 4575 H9X DPP 38 12.020 57.260 50.900 1.00 0.00 ATOM 4576 H9Y DPP 38 13.010 58.760 51.230 1.00 0.00 ATOM 4577 0C31 DPP 38 11.400 58.890 49.690 1.00 0.00 ATOM 4578 H10X DPP 38 11.100 59.940 49.890 1.00 0.00 ATOM 4579 H10Y DPP 38 10.520 58.370 49.260 1.00 0.00 ATOM 4580 1C31 DPP 38 12.410 58.970 48.540 1.00 0.00 ATOM 4581 H11X DPP 38 13.260 59.590 48.880 1.00 0.00 ATOM 4582 H11Y DPP 38 11.920 59.600 47.770 1.00 0.00 ATOM 4583 2C31 DPP 38 12.700 57.670 47.790 1.00 0.00 ATOM 4584 H12X DPP 38 11.670 57.240 47.750 1.00 0.00 ATOM 4585 H12Y DPP 38 13.300 57.120 48.550 1.00 0.00 ATOM 4586 3C31 DPP 38 13.410 57.910 46.450 1.00 0.00 ATOM 4587 H13X DPP 38 12.750 58.610 45.890 1.00 0.00 ATOM 4588 H13Y DPP 38 13.460 56.960 45.870 1.00 0.00 ATOM 4589 4C31 DPP 38 14.780 58.550 46.640 1.00 0.00 ATOM 4590 H14X DPP 38 14.750 59.580 47.080 1.00 0.00 ATOM 4591 H14Y DPP 38 15.160 58.870 45.650 1.00 0.00 ATOM 4592 5C31 DPP 38 15.960 57.690 47.090 1.00 0.00 ATOM 4593 H15X DPP 38 15.880 56.770 46.470 1.00 0.00 ATOM 4594 H15Y DPP 38 15.700 57.430 48.140 1.00 0.00 ATOM 4595 6C31 DPP 38 17.380 58.220 46.950 1.00 0.00 ATOM 4596 H16X DPP 38 17.540 59.170 47.510 1.00 0.00 ATOM 4597 H16Y DPP 38 17.660 58.290 45.870 1.00 0.00 ATOM 4598 H16Z DPP 38 18.080 57.480 47.380 1.00 0.00 ATOM 4599 N DPP 39 31.400 19.850 58.640 1.00 0.00 ATOM 4600 HN1 DPP 39 31.280 20.610 59.350 1.00 0.00 ATOM 4601 HN2 DPP 39 30.450 19.840 58.210 1.00 0.00 ATOM 4602 HN3 DPP 39 31.500 18.900 59.050 1.00 0.00 ATOM 4603 C12 DPP 39 32.450 20.210 57.620 1.00 0.00 ATOM 4604 H12A DPP 39 31.880 20.150 56.670 1.00 0.00 ATOM 4605 H12B DPP 39 32.670 21.300 57.640 1.00 0.00 ATOM 4606 C11 DPP 39 33.690 19.310 57.540 1.00 0.00 ATOM 4607 H11A DPP 39 34.320 19.540 58.430 1.00 0.00 ATOM 4608 H11B DPP 39 34.340 19.470 56.650 1.00 0.00 ATOM 4609 P DPP 39 34.480 16.980 57.600 1.00 0.00 ATOM 4610 O13 DPP 39 33.940 15.670 58.020 1.00 0.00 ATOM 4611 O14 DPP 39 35.580 17.540 58.400 1.00 0.00 ATOM 4612 O11 DPP 39 34.970 17.070 56.080 1.00 0.00 ATOM 4613 O12 DPP 39 33.220 17.970 57.660 1.00 0.00 ATOM 4614 C1 DPP 39 36.250 16.470 55.870 1.00 0.00 ATOM 4615 HA DPP 39 36.240 15.920 54.900 1.00 0.00 ATOM 4616 HB DPP 39 36.420 15.580 56.510 1.00 0.00 ATOM 4617 C2 DPP 39 37.310 17.580 55.800 1.00 0.00 ATOM 4618 HS DPP 39 37.670 17.750 56.840 1.00 0.00 ATOM 4619 O21 DPP 39 36.720 18.730 55.180 1.00 0.00 ATOM 4620 C21 DPP 39 37.180 19.950 55.480 1.00 0.00 ATOM 4621 O22 DPP 39 38.190 20.090 56.150 1.00 0.00 ATOM 4622 C22 DPP 39 36.340 21.110 54.970 1.00 0.00 ATOM 4623 H2R DPP 39 35.280 20.800 55.070 1.00 0.00 ATOM 4624 H2S DPP 39 36.620 21.280 53.910 1.00 0.00 ATOM 4625 C3 DPP 39 38.480 17.030 54.970 1.00 0.00 ATOM 4626 HX DPP 39 38.830 16.150 55.550 1.00 0.00 ATOM 4627 HY DPP 39 39.230 17.850 54.940 1.00 0.00 ATOM 4628 O31 DPP 39 38.270 16.740 53.590 1.00 0.00 ATOM 4629 C31 DPP 39 39.200 15.880 53.150 1.00 0.00 ATOM 4630 O32 DPP 39 40.090 15.320 53.760 1.00 0.00 ATOM 4631 C32 DPP 39 39.260 15.780 51.630 1.00 0.00 ATOM 4632 H2X DPP 39 39.000 14.720 51.450 1.00 0.00 ATOM 4633 H2Y DPP 39 40.280 16.060 51.290 1.00 0.00 ATOM 4634 C23 DPP 39 36.700 22.370 55.750 1.00 0.00 ATOM 4635 H3R DPP 39 37.800 22.530 55.650 1.00 0.00 ATOM 4636 H3S DPP 39 36.420 22.260 56.820 1.00 0.00 ATOM 4637 C24 DPP 39 35.890 23.590 55.310 1.00 0.00 ATOM 4638 H4R DPP 39 35.930 24.390 56.070 1.00 0.00 ATOM 4639 H4S DPP 39 34.830 23.320 55.110 1.00 0.00 ATOM 4640 C25 DPP 39 36.310 24.390 54.080 1.00 0.00 ATOM 4641 H5R DPP 39 35.550 25.200 54.060 1.00 0.00 ATOM 4642 H5S DPP 39 36.280 23.730 53.190 1.00 0.00 ATOM 4643 C26 DPP 39 37.670 25.070 54.260 1.00 0.00 ATOM 4644 H6R DPP 39 38.580 24.430 54.280 1.00 0.00 ATOM 4645 H6S DPP 39 37.630 25.690 55.180 1.00 0.00 ATOM 4646 C27 DPP 39 37.950 26.130 53.190 1.00 0.00 ATOM 4647 H7R DPP 39 38.710 26.830 53.600 1.00 0.00 ATOM 4648 H7S DPP 39 37.020 26.740 53.080 1.00 0.00 ATOM 4649 C28 DPP 39 38.240 25.740 51.740 1.00 0.00 ATOM 4650 H8R DPP 39 37.280 25.430 51.280 1.00 0.00 ATOM 4651 H8S DPP 39 39.030 24.950 51.730 1.00 0.00 ATOM 4652 C29 DPP 39 38.680 26.930 50.900 1.00 0.00 ATOM 4653 H9R DPP 39 39.710 27.210 51.190 1.00 0.00 ATOM 4654 H9S DPP 39 37.940 27.760 50.860 1.00 0.00 ATOM 4655 0C21 DPP 39 38.710 26.440 49.450 1.00 0.00 ATOM 4656 H10R DPP 39 37.750 25.980 49.150 1.00 0.00 ATOM 4657 H10S DPP 39 39.380 25.550 49.430 1.00 0.00 ATOM 4658 1C21 DPP 39 39.170 27.500 48.450 1.00 0.00 ATOM 4659 H11R DPP 39 40.250 27.660 48.700 1.00 0.00 ATOM 4660 H11S DPP 39 38.760 28.500 48.680 1.00 0.00 ATOM 4661 2C21 DPP 39 38.990 27.150 46.970 1.00 0.00 ATOM 4662 H12R DPP 39 37.930 26.990 46.690 1.00 0.00 ATOM 4663 H12S DPP 39 39.550 26.200 46.840 1.00 0.00 ATOM 4664 3C21 DPP 39 39.600 28.140 45.970 1.00 0.00 ATOM 4665 H13R DPP 39 40.570 28.360 46.450 1.00 0.00 ATOM 4666 H13S DPP 39 39.070 29.120 45.980 1.00 0.00 ATOM 4667 4C21 DPP 39 39.760 27.680 44.520 1.00 0.00 ATOM 4668 H14R DPP 39 39.040 26.980 44.060 1.00 0.00 ATOM 4669 H14S DPP 39 40.750 27.170 44.470 1.00 0.00 ATOM 4670 5C21 DPP 39 39.870 28.910 43.620 1.00 0.00 ATOM 4671 H15R DPP 39 40.700 29.610 43.890 1.00 0.00 ATOM 4672 H15S DPP 39 38.960 29.510 43.820 1.00 0.00 ATOM 4673 6C21 DPP 39 40.110 28.570 42.150 1.00 0.00 ATOM 4674 H16R DPP 39 39.210 28.120 41.670 1.00 0.00 ATOM 4675 H16S DPP 39 40.970 27.870 42.170 1.00 0.00 ATOM 4676 H16T DPP 39 40.310 29.510 41.590 1.00 0.00 ATOM 4677 C33 DPP 39 38.170 16.690 51.050 1.00 0.00 ATOM 4678 H3X DPP 39 38.430 17.740 51.290 1.00 0.00 ATOM 4679 H3Y DPP 39 37.260 16.300 51.540 1.00 0.00 ATOM 4680 C34 DPP 39 37.860 16.670 49.550 1.00 0.00 ATOM 4681 H4X DPP 39 38.820 16.820 49.000 1.00 0.00 ATOM 4682 H4Y DPP 39 37.190 17.530 49.380 1.00 0.00 ATOM 4683 C35 DPP 39 37.270 15.350 49.040 1.00 0.00 ATOM 4684 H5X DPP 39 36.880 14.820 49.940 1.00 0.00 ATOM 4685 H5Y DPP 39 38.160 14.780 48.680 1.00 0.00 ATOM 4686 C36 DPP 39 36.070 15.370 48.090 1.00 0.00 ATOM 4687 H6X DPP 39 36.330 15.600 47.040 1.00 0.00 ATOM 4688 H6Y DPP 39 35.510 16.280 48.410 1.00 0.00 ATOM 4689 C37 DPP 39 35.110 14.190 48.260 1.00 0.00 ATOM 4690 H7X DPP 39 35.030 14.050 49.360 1.00 0.00 ATOM 4691 H7Y DPP 39 35.570 13.320 47.760 1.00 0.00 ATOM 4692 C38 DPP 39 33.770 14.510 47.580 1.00 0.00 ATOM 4693 H8X DPP 39 34.070 14.490 46.510 1.00 0.00 ATOM 4694 H8Y DPP 39 33.490 15.530 47.930 1.00 0.00 ATOM 4695 C39 DPP 39 32.710 13.440 47.810 1.00 0.00 ATOM 4696 H9X DPP 39 33.210 12.450 47.880 1.00 0.00 ATOM 4697 H9Y DPP 39 32.080 13.410 46.900 1.00 0.00 ATOM 4698 0C31 DPP 39 31.740 13.610 48.980 1.00 0.00 ATOM 4699 H10X DPP 39 32.150 13.510 50.000 1.00 0.00 ATOM 4700 H10Y DPP 39 30.950 12.830 48.910 1.00 0.00 ATOM 4701 1C31 DPP 39 30.910 14.900 48.870 1.00 0.00 ATOM 4702 H11X DPP 39 30.860 15.130 47.780 1.00 0.00 ATOM 4703 H11Y DPP 39 31.480 15.830 49.060 1.00 0.00 ATOM 4704 2C31 DPP 39 29.580 14.890 49.630 1.00 0.00 ATOM 4705 H12X DPP 39 28.850 14.220 49.130 1.00 0.00 ATOM 4706 H12Y DPP 39 29.080 15.870 49.430 1.00 0.00 ATOM 4707 3C31 DPP 39 29.700 14.610 51.130 1.00 0.00 ATOM 4708 H13X DPP 39 30.280 15.430 51.620 1.00 0.00 ATOM 4709 H13Y DPP 39 30.190 13.640 51.350 1.00 0.00 ATOM 4710 4C31 DPP 39 28.320 14.400 51.740 1.00 0.00 ATOM 4711 H14X DPP 39 27.560 14.670 50.980 1.00 0.00 ATOM 4712 H14Y DPP 39 28.250 14.840 52.760 1.00 0.00 ATOM 4713 5C31 DPP 39 28.190 12.960 52.230 1.00 0.00 ATOM 4714 H15X DPP 39 28.950 12.890 53.040 1.00 0.00 ATOM 4715 H15Y DPP 39 28.360 12.280 51.360 1.00 0.00 ATOM 4716 6C31 DPP 39 26.790 12.600 52.740 1.00 0.00 ATOM 4717 H16X DPP 39 26.700 11.490 52.790 1.00 0.00 ATOM 4718 H16Y DPP 39 26.640 12.920 53.790 1.00 0.00 ATOM 4719 H16Z DPP 39 26.010 12.980 52.040 1.00 0.00 ATOM 4720 N DPP 40 49.840 0.880 67.300 1.00 0.00 ATOM 4721 HN1 DPP 40 48.970 0.870 67.880 1.00 0.00 ATOM 4722 HN2 DPP 40 50.580 0.550 67.950 1.00 0.00 ATOM 4723 HN3 DPP 40 50.010 1.870 67.050 1.00 0.00 ATOM 4724 C12 DPP 40 49.640 -0.110 66.180 1.00 0.00 ATOM 4725 H12A DPP 40 50.650 -0.210 65.730 1.00 0.00 ATOM 4726 H12B DPP 40 49.300 -1.090 66.560 1.00 0.00 ATOM 4727 C11 DPP 40 48.710 0.510 65.130 1.00 0.00 ATOM 4728 H11A DPP 40 47.710 0.690 65.580 1.00 0.00 ATOM 4729 H11B DPP 40 48.680 -0.260 64.330 1.00 0.00 ATOM 4730 P DPP 40 48.860 2.180 63.260 1.00 0.00 ATOM 4731 O13 DPP 40 49.210 3.610 63.080 1.00 0.00 ATOM 4732 O14 DPP 40 47.430 1.810 63.160 1.00 0.00 ATOM 4733 O11 DPP 40 49.690 1.190 62.310 1.00 0.00 ATOM 4734 O12 DPP 40 49.330 1.730 64.710 1.00 0.00 ATOM 4735 C1 DPP 40 51.120 1.300 62.390 1.00 0.00 ATOM 4736 HA DPP 40 51.540 0.390 62.860 1.00 0.00 ATOM 4737 HB DPP 40 51.430 2.230 62.910 1.00 0.00 ATOM 4738 C2 DPP 40 51.630 1.310 60.940 1.00 0.00 ATOM 4739 HS DPP 40 52.730 1.340 60.850 1.00 0.00 ATOM 4740 O21 DPP 40 51.090 2.390 60.160 1.00 0.00 ATOM 4741 C21 DPP 40 51.730 3.530 60.400 1.00 0.00 ATOM 4742 O22 DPP 40 52.760 3.570 61.070 1.00 0.00 ATOM 4743 C22 DPP 40 51.170 4.630 59.510 1.00 0.00 ATOM 4744 H2R DPP 40 51.070 5.540 60.140 1.00 0.00 ATOM 4745 H2S DPP 40 50.130 4.300 59.300 1.00 0.00 ATOM 4746 C3 DPP 40 51.240 -0.040 60.310 1.00 0.00 ATOM 4747 HX DPP 40 50.150 -0.240 60.310 1.00 0.00 ATOM 4748 HY DPP 40 51.600 -0.850 60.980 1.00 0.00 ATOM 4749 O31 DPP 40 51.910 -0.210 59.050 1.00 0.00 ATOM 4750 C31 DPP 40 51.230 -0.020 57.920 1.00 0.00 ATOM 4751 O32 DPP 40 50.050 0.280 57.890 1.00 0.00 ATOM 4752 C32 DPP 40 52.200 0.050 56.750 1.00 0.00 ATOM 4753 H2X DPP 40 52.900 0.910 56.780 1.00 0.00 ATOM 4754 H2Y DPP 40 51.530 0.160 55.870 1.00 0.00 ATOM 4755 C23 DPP 40 52.090 4.940 58.330 1.00 0.00 ATOM 4756 H3R DPP 40 53.100 4.500 58.460 1.00 0.00 ATOM 4757 H3S DPP 40 52.170 6.040 58.200 1.00 0.00 ATOM 4758 C24 DPP 40 51.470 4.370 57.050 1.00 0.00 ATOM 4759 H4R DPP 40 50.650 5.060 56.770 1.00 0.00 ATOM 4760 H4S DPP 40 50.940 3.420 57.260 1.00 0.00 ATOM 4761 C25 DPP 40 52.400 4.190 55.850 1.00 0.00 ATOM 4762 H5R DPP 40 53.210 3.500 56.160 1.00 0.00 ATOM 4763 H5S DPP 40 52.780 5.210 55.620 1.00 0.00 ATOM 4764 C26 DPP 40 51.570 3.460 54.790 1.00 0.00 ATOM 4765 H6R DPP 40 50.700 4.060 54.440 1.00 0.00 ATOM 4766 H6S DPP 40 51.220 2.510 55.260 1.00 0.00 ATOM 4767 C27 DPP 40 52.410 2.940 53.620 1.00 0.00 ATOM 4768 H7R DPP 40 52.940 2.040 53.990 1.00 0.00 ATOM 4769 H7S DPP 40 53.180 3.660 53.280 1.00 0.00 ATOM 4770 C28 DPP 40 51.370 2.690 52.520 1.00 0.00 ATOM 4771 H8R DPP 40 50.750 3.600 52.380 1.00 0.00 ATOM 4772 H8S DPP 40 50.680 1.940 52.950 1.00 0.00 ATOM 4773 C29 DPP 40 51.910 2.130 51.200 1.00 0.00 ATOM 4774 H9R DPP 40 52.420 2.900 50.580 1.00 0.00 ATOM 4775 H9S DPP 40 50.950 1.990 50.650 1.00 0.00 ATOM 4776 0C21 DPP 40 52.860 0.940 51.330 1.00 0.00 ATOM 4777 H10R DPP 40 52.330 0.230 52.010 1.00 0.00 ATOM 4778 H10S DPP 40 53.810 1.200 51.840 1.00 0.00 ATOM 4779 1C21 DPP 40 53.170 0.160 50.060 1.00 0.00 ATOM 4780 H11R DPP 40 52.250 0.110 49.430 1.00 0.00 ATOM 4781 H11S DPP 40 53.520 -0.870 50.270 1.00 0.00 ATOM 4782 2C21 DPP 40 54.310 0.670 49.180 1.00 0.00 ATOM 4783 H12R DPP 40 55.280 0.690 49.720 1.00 0.00 ATOM 4784 H12S DPP 40 54.070 1.720 48.910 1.00 0.00 ATOM 4785 3C21 DPP 40 54.470 -0.040 47.830 1.00 0.00 ATOM 4786 H13R DPP 40 53.650 0.220 47.130 1.00 0.00 ATOM 4787 H13S DPP 40 54.470 -1.130 48.030 1.00 0.00 ATOM 4788 4C21 DPP 40 55.820 0.350 47.220 1.00 0.00 ATOM 4789 H14R DPP 40 55.940 -0.240 46.280 1.00 0.00 ATOM 4790 H14S DPP 40 56.590 0.060 47.950 1.00 0.00 ATOM 4791 5C21 DPP 40 55.930 1.840 46.880 1.00 0.00 ATOM 4792 H15R DPP 40 55.670 2.540 47.710 1.00 0.00 ATOM 4793 H15S DPP 40 55.210 2.090 46.070 1.00 0.00 ATOM 4794 6C21 DPP 40 57.370 2.190 46.510 1.00 0.00 ATOM 4795 H16R DPP 40 58.030 2.210 47.400 1.00 0.00 ATOM 4796 H16S DPP 40 57.360 3.220 46.090 1.00 0.00 ATOM 4797 H16T DPP 40 57.810 1.570 45.700 1.00 0.00 ATOM 4798 C33 DPP 40 53.140 -1.140 56.580 1.00 0.00 ATOM 4799 H3X DPP 40 52.630 -2.080 56.870 1.00 0.00 ATOM 4800 H3Y DPP 40 53.930 -1.100 57.360 1.00 0.00 ATOM 4801 C34 DPP 40 53.670 -1.360 55.160 1.00 0.00 ATOM 4802 H4X DPP 40 54.090 -0.350 54.990 1.00 0.00 ATOM 4803 H4Y DPP 40 52.830 -1.440 54.440 1.00 0.00 ATOM 4804 C35 DPP 40 54.790 -2.410 55.070 1.00 0.00 ATOM 4805 H5X DPP 40 54.310 -3.410 55.140 1.00 0.00 ATOM 4806 H5Y DPP 40 55.510 -2.250 55.890 1.00 0.00 ATOM 4807 C36 DPP 40 55.370 -2.450 53.650 1.00 0.00 ATOM 4808 H6X DPP 40 55.400 -1.450 53.170 1.00 0.00 ATOM 4809 H6Y DPP 40 54.680 -3.060 53.020 1.00 0.00 ATOM 4810 C37 DPP 40 56.810 -2.980 53.670 1.00 0.00 ATOM 4811 H7X DPP 40 56.890 -3.870 54.330 1.00 0.00 ATOM 4812 H7Y DPP 40 57.440 -2.200 54.140 1.00 0.00 ATOM 4813 C38 DPP 40 57.430 -3.360 52.330 1.00 0.00 ATOM 4814 H8X DPP 40 58.420 -3.830 52.500 1.00 0.00 ATOM 4815 H8Y DPP 40 56.820 -4.040 51.710 1.00 0.00 ATOM 4816 C39 DPP 40 57.690 -2.190 51.370 1.00 0.00 ATOM 4817 H9X DPP 40 58.360 -1.460 51.870 1.00 0.00 ATOM 4818 H9Y DPP 40 56.790 -1.600 51.110 1.00 0.00 ATOM 4819 0C31 DPP 40 58.400 -2.670 50.100 1.00 0.00 ATOM 4820 H10X DPP 40 57.930 -3.620 49.760 1.00 0.00 ATOM 4821 H10Y DPP 40 59.420 -3.000 50.360 1.00 0.00 ATOM 4822 1C31 DPP 40 58.430 -1.670 48.950 1.00 0.00 ATOM 4823 H11X DPP 40 58.840 -0.690 49.280 1.00 0.00 ATOM 4824 H11Y DPP 40 57.430 -1.450 48.520 1.00 0.00 ATOM 4825 2C31 DPP 40 59.310 -2.230 47.830 1.00 0.00 ATOM 4826 H12X DPP 40 58.660 -2.950 47.280 1.00 0.00 ATOM 4827 H12Y DPP 40 60.200 -2.770 48.200 1.00 0.00 ATOM 4828 3C31 DPP 40 59.790 -1.250 46.760 1.00 0.00 ATOM 4829 H13X DPP 40 60.030 -0.290 47.270 1.00 0.00 ATOM 4830 H13Y DPP 40 59.010 -0.930 46.030 1.00 0.00 ATOM 4831 4C31 DPP 40 61.050 -1.820 46.100 1.00 0.00 ATOM 4832 H14X DPP 40 61.710 -2.010 46.970 1.00 0.00 ATOM 4833 H14Y DPP 40 61.520 -1.020 45.480 1.00 0.00 ATOM 4834 5C31 DPP 40 60.860 -3.070 45.240 1.00 0.00 ATOM 4835 H15X DPP 40 60.080 -2.880 44.470 1.00 0.00 ATOM 4836 H15Y DPP 40 60.370 -3.940 45.750 1.00 0.00 ATOM 4837 6C31 DPP 40 62.050 -3.690 44.500 1.00 0.00 ATOM 4838 H16X DPP 40 62.270 -4.620 45.060 1.00 0.00 ATOM 4839 H16Y DPP 40 62.920 -3.020 44.370 1.00 0.00 ATOM 4840 H16Z DPP 40 61.700 -4.020 43.500 1.00 0.00 ATOM 4841 N DPP 41 0.310 25.190 60.600 1.00 0.00 ATOM 4842 HN1 DPP 41 0.240 24.310 60.050 1.00 0.00 ATOM 4843 HN2 DPP 41 1.190 25.030 61.140 1.00 0.00 ATOM 4844 HN3 DPP 41 -0.550 25.280 61.180 1.00 0.00 ATOM 4845 C12 DPP 41 0.370 26.470 59.800 1.00 0.00 ATOM 4846 H12A DPP 41 1.390 26.640 59.380 1.00 0.00 ATOM 4847 H12B DPP 41 -0.200 26.400 58.850 1.00 0.00 ATOM 4848 C11 DPP 41 -0.120 27.710 60.540 1.00 0.00 ATOM 4849 H11A DPP 41 -1.150 27.630 60.960 1.00 0.00 ATOM 4850 H11B DPP 41 -0.030 28.620 59.920 1.00 0.00 ATOM 4851 P DPP 41 1.820 29.100 61.540 1.00 0.00 ATOM 4852 O13 DPP 41 2.530 29.300 62.830 1.00 0.00 ATOM 4853 O14 DPP 41 1.220 30.300 60.910 1.00 0.00 ATOM 4854 O11 DPP 41 2.850 28.430 60.510 1.00 0.00 ATOM 4855 O12 DPP 41 0.750 27.910 61.660 1.00 0.00 ATOM 4856 C1 DPP 41 3.980 29.210 60.110 1.00 0.00 ATOM 4857 HA DPP 41 4.670 28.530 59.580 1.00 0.00 ATOM 4858 HB DPP 41 4.520 29.710 60.940 1.00 0.00 ATOM 4859 C2 DPP 41 3.620 30.160 58.950 1.00 0.00 ATOM 4860 HS DPP 41 3.020 31.020 59.320 1.00 0.00 ATOM 4861 O21 DPP 41 2.840 29.420 58.010 1.00 0.00 ATOM 4862 C21 DPP 41 1.800 30.060 57.460 1.00 0.00 ATOM 4863 O22 DPP 41 1.710 31.280 57.450 1.00 0.00 ATOM 4864 C22 DPP 41 0.730 29.130 56.900 1.00 0.00 ATOM 4865 H2R DPP 41 -0.130 29.250 57.600 1.00 0.00 ATOM 4866 H2S DPP 41 1.030 28.070 56.950 1.00 0.00 ATOM 4867 C3 DPP 41 4.920 30.490 58.210 1.00 0.00 ATOM 4868 HX DPP 41 5.530 29.560 58.150 1.00 0.00 ATOM 4869 HY DPP 41 5.480 31.170 58.890 1.00 0.00 ATOM 4870 O31 DPP 41 4.660 31.030 56.920 1.00 0.00 ATOM 4871 C31 DPP 41 4.670 32.360 56.880 1.00 0.00 ATOM 4872 O32 DPP 41 4.750 33.130 57.830 1.00 0.00 ATOM 4873 C32 DPP 41 4.600 32.820 55.420 1.00 0.00 ATOM 4874 H2X DPP 41 4.160 31.940 54.900 1.00 0.00 ATOM 4875 H2Y DPP 41 5.630 32.960 55.040 1.00 0.00 ATOM 4876 C23 DPP 41 0.210 29.620 55.550 1.00 0.00 ATOM 4877 H3R DPP 41 -0.270 30.570 55.860 1.00 0.00 ATOM 4878 H3S DPP 41 -0.680 29.000 55.320 1.00 0.00 ATOM 4879 C24 DPP 41 1.140 29.670 54.340 1.00 0.00 ATOM 4880 H4R DPP 41 1.780 30.570 54.500 1.00 0.00 ATOM 4881 H4S DPP 41 0.560 29.990 53.450 1.00 0.00 ATOM 4882 C25 DPP 41 1.750 28.310 53.990 1.00 0.00 ATOM 4883 H5R DPP 41 0.980 27.530 54.110 1.00 0.00 ATOM 4884 H5S DPP 41 2.390 28.020 54.860 1.00 0.00 ATOM 4885 C26 DPP 41 2.510 28.160 52.670 1.00 0.00 ATOM 4886 H6R DPP 41 2.820 27.100 52.560 1.00 0.00 ATOM 4887 H6S DPP 41 3.370 28.860 52.710 1.00 0.00 ATOM 4888 C27 DPP 41 1.690 28.400 51.400 1.00 0.00 ATOM 4889 H7R DPP 41 1.180 29.380 51.520 1.00 0.00 ATOM 4890 H7S DPP 41 0.900 27.620 51.390 1.00 0.00 ATOM 4891 C28 DPP 41 2.580 28.350 50.160 1.00 0.00 ATOM 4892 H8R DPP 41 3.320 27.550 50.380 1.00 0.00 ATOM 4893 H8S DPP 41 2.940 29.400 50.090 1.00 0.00 ATOM 4894 C29 DPP 41 1.860 28.120 48.830 1.00 0.00 ATOM 4895 H9R DPP 41 1.360 27.130 48.790 1.00 0.00 ATOM 4896 H9S DPP 41 2.640 28.180 48.050 1.00 0.00 ATOM 4897 0C21 DPP 41 0.650 29.020 48.550 1.00 0.00 ATOM 4898 H10R DPP 41 0.740 30.020 49.030 1.00 0.00 ATOM 4899 H10S DPP 41 -0.280 28.620 49.020 1.00 0.00 ATOM 4900 1C21 DPP 41 0.340 29.270 47.080 1.00 0.00 ATOM 4901 H11R DPP 41 -0.530 29.940 46.940 1.00 0.00 ATOM 4902 H11S DPP 41 0.030 28.240 46.790 1.00 0.00 ATOM 4903 2C21 DPP 41 1.470 29.740 46.150 1.00 0.00 ATOM 4904 H12R DPP 41 2.330 29.040 46.070 1.00 0.00 ATOM 4905 H12S DPP 41 1.970 30.640 46.540 1.00 0.00 ATOM 4906 3C21 DPP 41 1.080 30.150 44.730 1.00 0.00 ATOM 4907 H13R DPP 41 1.980 30.620 44.270 1.00 0.00 ATOM 4908 H13S DPP 41 0.300 30.940 44.800 1.00 0.00 ATOM 4909 4C21 DPP 41 0.540 28.970 43.910 1.00 0.00 ATOM 4910 H14R DPP 41 -0.510 28.770 44.190 1.00 0.00 ATOM 4911 H14S DPP 41 1.170 28.070 44.030 1.00 0.00 ATOM 4912 5C21 DPP 41 0.470 29.410 42.440 1.00 0.00 ATOM 4913 H15R DPP 41 1.490 29.650 42.070 1.00 0.00 ATOM 4914 H15S DPP 41 -0.210 30.270 42.230 1.00 0.00 ATOM 4915 6C21 DPP 41 -0.210 28.290 41.660 1.00 0.00 ATOM 4916 H16R DPP 41 0.280 27.320 41.900 1.00 0.00 ATOM 4917 H16S DPP 41 -0.060 28.530 40.590 1.00 0.00 ATOM 4918 H16T DPP 41 -1.320 28.300 41.710 1.00 0.00 ATOM 4919 C33 DPP 41 3.710 34.060 55.410 1.00 0.00 ATOM 4920 H3X DPP 41 4.190 34.860 56.020 1.00 0.00 ATOM 4921 H3Y DPP 41 2.830 33.610 55.920 1.00 0.00 ATOM 4922 C34 DPP 41 3.460 34.670 54.030 1.00 0.00 ATOM 4923 H4X DPP 41 4.490 34.960 53.720 1.00 0.00 ATOM 4924 H4Y DPP 41 3.000 35.650 54.280 1.00 0.00 ATOM 4925 C35 DPP 41 2.560 33.790 53.160 1.00 0.00 ATOM 4926 H5X DPP 41 3.140 32.840 53.150 1.00 0.00 ATOM 4927 H5Y DPP 41 2.720 34.210 52.140 1.00 0.00 ATOM 4928 C36 DPP 41 1.090 33.560 53.520 1.00 0.00 ATOM 4929 H6X DPP 41 0.770 34.540 53.920 1.00 0.00 ATOM 4930 H6Y DPP 41 1.220 32.840 54.360 1.00 0.00 ATOM 4931 C37 DPP 41 0.300 32.960 52.360 1.00 0.00 ATOM 4932 H7X DPP 41 -0.710 32.590 52.650 1.00 0.00 ATOM 4933 H7Y DPP 41 0.740 31.990 52.050 1.00 0.00 ATOM 4934 C38 DPP 41 0.180 33.890 51.150 1.00 0.00 ATOM 4935 H8X DPP 41 1.200 33.960 50.700 1.00 0.00 ATOM 4936 H8Y DPP 41 -0.160 34.950 51.230 1.00 0.00 ATOM 4937 C39 DPP 41 -0.650 33.340 49.980 1.00 0.00 ATOM 4938 H9X DPP 41 -1.650 33.030 50.340 1.00 0.00 ATOM 4939 H9Y DPP 41 -0.110 32.470 49.550 1.00 0.00 ATOM 4940 0C31 DPP 41 -0.870 34.330 48.840 1.00 0.00 ATOM 4941 H10X DPP 41 -0.090 34.090 48.080 1.00 0.00 ATOM 4942 H10Y DPP 41 -0.700 35.400 49.080 1.00 0.00 ATOM 4943 1C31 DPP 41 -2.230 34.140 48.150 1.00 0.00 ATOM 4944 H11X DPP 41 -2.960 34.340 48.950 1.00 0.00 ATOM 4945 H11Y DPP 41 -2.290 33.100 47.770 1.00 0.00 ATOM 4946 2C31 DPP 41 -2.480 34.960 46.880 1.00 0.00 ATOM 4947 H12X DPP 41 -2.000 35.950 47.060 1.00 0.00 ATOM 4948 H12Y DPP 41 -1.770 34.510 46.160 1.00 0.00 ATOM 4949 3C31 DPP 41 -3.900 34.930 46.310 1.00 0.00 ATOM 4950 H13X DPP 41 -4.430 33.970 46.470 1.00 0.00 ATOM 4951 H13Y DPP 41 -3.870 35.220 45.240 1.00 0.00 ATOM 4952 4C31 DPP 41 -4.890 35.950 46.880 1.00 0.00 ATOM 4953 H14X DPP 41 -5.430 35.580 47.780 1.00 0.00 ATOM 4954 H14Y DPP 41 -5.660 35.850 46.090 1.00 0.00 ATOM 4955 5C31 DPP 41 -4.360 37.380 47.030 1.00 0.00 ATOM 4956 H15X DPP 41 -3.550 37.460 47.780 1.00 0.00 ATOM 4957 H15Y DPP 41 -3.890 37.790 46.110 1.00 0.00 ATOM 4958 6C31 DPP 41 -5.480 38.370 47.350 1.00 0.00 ATOM 4959 H16X DPP 41 -6.350 38.200 46.680 1.00 0.00 ATOM 4960 H16Y DPP 41 -5.160 39.400 47.090 1.00 0.00 ATOM 4961 H16Z DPP 41 -5.790 38.270 48.410 1.00 0.00 ATOM 4962 N DPP 42 1.220 24.140 63.990 1.00 0.00 ATOM 4963 HN1 DPP 42 0.980 25.130 64.200 1.00 0.00 ATOM 4964 HN2 DPP 42 1.800 24.230 63.130 1.00 0.00 ATOM 4965 HN3 DPP 42 0.350 23.620 63.750 1.00 0.00 ATOM 4966 C12 DPP 42 2.080 23.450 65.010 1.00 0.00 ATOM 4967 H12A DPP 42 1.510 23.320 65.960 1.00 0.00 ATOM 4968 H12B DPP 42 2.970 24.070 65.250 1.00 0.00 ATOM 4969 C11 DPP 42 2.410 22.100 64.380 1.00 0.00 ATOM 4970 H11A DPP 42 3.000 21.560 65.150 1.00 0.00 ATOM 4971 H11B DPP 42 3.020 22.150 63.460 1.00 0.00 ATOM 4972 P DPP 42 1.570 20.010 63.220 1.00 0.00 ATOM 4973 O13 DPP 42 0.400 19.090 63.270 1.00 0.00 ATOM 4974 O14 DPP 42 2.820 19.440 63.770 1.00 0.00 ATOM 4975 O11 DPP 42 1.910 20.520 61.740 1.00 0.00 ATOM 4976 O12 DPP 42 1.240 21.360 64.000 1.00 0.00 ATOM 4977 C1 DPP 42 0.860 21.340 61.210 1.00 0.00 ATOM 4978 HA DPP 42 1.290 22.090 60.510 1.00 0.00 ATOM 4979 HB DPP 42 0.310 21.790 62.070 1.00 0.00 ATOM 4980 C2 DPP 42 -0.130 20.420 60.490 1.00 0.00 ATOM 4981 HS DPP 42 -0.870 20.130 61.270 1.00 0.00 ATOM 4982 O21 DPP 42 0.580 19.270 60.030 1.00 0.00 ATOM 4983 C21 DPP 42 -0.200 18.210 59.850 1.00 0.00 ATOM 4984 O22 DPP 42 -1.380 18.170 60.180 1.00 0.00 ATOM 4985 C22 DPP 42 0.620 17.180 59.090 1.00 0.00 ATOM 4986 H2R DPP 42 0.670 16.230 59.680 1.00 0.00 ATOM 4987 H2S DPP 42 1.650 17.570 58.920 1.00 0.00 ATOM 4988 C3 DPP 42 -0.860 21.060 59.290 1.00 0.00 ATOM 4989 HX DPP 42 -1.250 22.050 59.640 1.00 0.00 ATOM 4990 HY DPP 42 -1.690 20.350 59.050 1.00 0.00 ATOM 4991 O31 DPP 42 0.070 21.200 58.220 1.00 0.00 ATOM 4992 C31 DPP 42 0.480 22.410 57.850 1.00 0.00 ATOM 4993 O32 DPP 42 0.150 23.470 58.360 1.00 0.00 ATOM 4994 C32 DPP 42 1.480 22.280 56.710 1.00 0.00 ATOM 4995 H2X DPP 42 1.180 22.940 55.870 1.00 0.00 ATOM 4996 H2Y DPP 42 1.460 21.230 56.350 1.00 0.00 ATOM 4997 C23 DPP 42 0.030 16.940 57.700 1.00 0.00 ATOM 4998 H3R DPP 42 -0.170 17.930 57.230 1.00 0.00 ATOM 4999 H3S DPP 42 -0.960 16.440 57.710 1.00 0.00 ATOM 5000 C24 DPP 42 0.890 16.070 56.780 1.00 0.00 ATOM 5001 H4R DPP 42 1.230 15.220 57.410 1.00 0.00 ATOM 5002 H4S DPP 42 1.870 16.490 56.460 1.00 0.00 ATOM 5003 C25 DPP 42 0.250 15.450 55.540 1.00 0.00 ATOM 5004 H5R DPP 42 -0.760 15.100 55.860 1.00 0.00 ATOM 5005 H5S DPP 42 0.910 14.610 55.240 1.00 0.00 ATOM 5006 C26 DPP 42 0.220 16.480 54.420 1.00 0.00 ATOM 5007 H6R DPP 42 1.250 16.840 54.190 1.00 0.00 ATOM 5008 H6S DPP 42 -0.350 17.320 54.880 1.00 0.00 ATOM 5009 C27 DPP 42 -0.480 15.890 53.200 1.00 0.00 ATOM 5010 H7R DPP 42 -1.250 16.640 52.890 1.00 0.00 ATOM 5011 H7S DPP 42 -1.030 14.950 53.380 1.00 0.00 ATOM 5012 C28 DPP 42 0.400 15.540 52.000 1.00 0.00 ATOM 5013 H8R DPP 42 0.860 14.580 52.320 1.00 0.00 ATOM 5014 H8S DPP 42 1.230 16.270 51.920 1.00 0.00 ATOM 5015 C29 DPP 42 -0.470 15.400 50.750 1.00 0.00 ATOM 5016 H9R DPP 42 -1.280 14.690 51.040 1.00 0.00 ATOM 5017 H9S DPP 42 -0.860 16.360 50.360 1.00 0.00 ATOM 5018 0C21 DPP 42 0.210 14.840 49.500 1.00 0.00 ATOM 5019 H10R DPP 42 0.910 15.560 49.030 1.00 0.00 ATOM 5020 H10S DPP 42 0.640 13.870 49.840 1.00 0.00 ATOM 5021 1C21 DPP 42 -0.760 14.310 48.450 1.00 0.00 ATOM 5022 H11R DPP 42 -1.170 13.340 48.800 1.00 0.00 ATOM 5023 H11S DPP 42 -1.670 14.940 48.320 1.00 0.00 ATOM 5024 2C21 DPP 42 -0.210 14.020 47.060 1.00 0.00 ATOM 5025 H12R DPP 42 -1.000 13.380 46.610 1.00 0.00 ATOM 5026 H12S DPP 42 0.820 13.590 47.060 1.00 0.00 ATOM 5027 3C21 DPP 42 -0.080 15.180 46.080 1.00 0.00 ATOM 5028 H13R DPP 42 0.450 14.770 45.190 1.00 0.00 ATOM 5029 H13S DPP 42 0.550 15.920 46.630 1.00 0.00 ATOM 5030 4C21 DPP 42 -1.350 15.850 45.530 1.00 0.00 ATOM 5031 H14R DPP 42 -1.810 16.470 46.320 1.00 0.00 ATOM 5032 H14S DPP 42 -2.080 15.110 45.150 1.00 0.00 ATOM 5033 5C21 DPP 42 -1.090 16.730 44.320 1.00 0.00 ATOM 5034 H15R DPP 42 0.000 16.840 44.130 1.00 0.00 ATOM 5035 H15S DPP 42 -1.430 17.760 44.560 1.00 0.00 ATOM 5036 6C21 DPP 42 -1.870 16.460 43.030 1.00 0.00 ATOM 5037 H16R DPP 42 -2.940 16.480 43.340 1.00 0.00 ATOM 5038 H16S DPP 42 -1.670 15.520 42.460 1.00 0.00 ATOM 5039 H16T DPP 42 -1.640 17.230 42.270 1.00 0.00 ATOM 5040 C33 DPP 42 2.880 22.600 57.240 1.00 0.00 ATOM 5041 H3X DPP 42 3.570 22.040 56.570 1.00 0.00 ATOM 5042 H3Y DPP 42 3.020 22.050 58.200 1.00 0.00 ATOM 5043 C34 DPP 42 3.100 24.110 57.350 1.00 0.00 ATOM 5044 H4X DPP 42 2.880 24.500 58.370 1.00 0.00 ATOM 5045 H4Y DPP 42 2.350 24.700 56.780 1.00 0.00 ATOM 5046 C35 DPP 42 4.390 24.640 56.720 1.00 0.00 ATOM 5047 H5X DPP 42 4.610 24.090 55.780 1.00 0.00 ATOM 5048 H5Y DPP 42 5.140 24.490 57.530 1.00 0.00 ATOM 5049 C36 DPP 42 4.450 26.150 56.490 1.00 0.00 ATOM 5050 H6X DPP 42 3.820 26.590 57.290 1.00 0.00 ATOM 5051 H6Y DPP 42 3.820 26.270 55.580 1.00 0.00 ATOM 5052 C37 DPP 42 5.900 26.590 56.250 1.00 0.00 ATOM 5053 H7X DPP 42 6.570 25.880 55.720 1.00 0.00 ATOM 5054 H7Y DPP 42 6.290 26.740 57.280 1.00 0.00 ATOM 5055 C38 DPP 42 6.040 27.840 55.380 1.00 0.00 ATOM 5056 H8X DPP 42 5.640 28.770 55.840 1.00 0.00 ATOM 5057 H8Y DPP 42 5.480 27.540 54.470 1.00 0.00 ATOM 5058 C39 DPP 42 7.530 28.160 55.230 1.00 0.00 ATOM 5059 H9X DPP 42 8.000 27.240 54.800 1.00 0.00 ATOM 5060 H9Y DPP 42 8.020 28.350 56.200 1.00 0.00 ATOM 5061 0C31 DPP 42 7.600 29.350 54.280 1.00 0.00 ATOM 5062 H10X DPP 42 8.640 29.740 54.320 1.00 0.00 ATOM 5063 H10Y DPP 42 6.920 30.190 54.550 1.00 0.00 ATOM 5064 1C31 DPP 42 7.100 29.090 52.850 1.00 0.00 ATOM 5065 H11X DPP 42 7.540 29.890 52.220 1.00 0.00 ATOM 5066 H11Y DPP 42 5.990 29.220 52.890 1.00 0.00 ATOM 5067 2C31 DPP 42 7.560 27.760 52.270 1.00 0.00 ATOM 5068 H12X DPP 42 7.360 26.960 53.020 1.00 0.00 ATOM 5069 H12Y DPP 42 8.620 27.750 51.910 1.00 0.00 ATOM 5070 3C31 DPP 42 6.740 27.100 51.160 1.00 0.00 ATOM 5071 H13X DPP 42 5.680 26.900 51.420 1.00 0.00 ATOM 5072 H13Y DPP 42 7.270 26.160 50.920 1.00 0.00 ATOM 5073 4C31 DPP 42 6.690 27.910 49.860 1.00 0.00 ATOM 5074 H14X DPP 42 5.990 28.740 50.070 1.00 0.00 ATOM 5075 H14Y DPP 42 6.270 27.240 49.080 1.00 0.00 ATOM 5076 5C31 DPP 42 8.020 28.320 49.210 1.00 0.00 ATOM 5077 H15X DPP 42 8.710 27.450 49.240 1.00 0.00 ATOM 5078 H15Y DPP 42 8.580 29.040 49.840 1.00 0.00 ATOM 5079 6C31 DPP 42 8.000 28.800 47.760 1.00 0.00 ATOM 5080 H16X DPP 42 7.550 28.010 47.130 1.00 0.00 ATOM 5081 H16Y DPP 42 9.040 28.930 47.390 1.00 0.00 ATOM 5082 H16Z DPP 42 7.380 29.710 47.590 1.00 0.00 ATOM 5083 N DPP 43 43.950 12.510 62.000 1.00 0.00 ATOM 5084 HN1 DPP 43 43.130 12.110 62.500 1.00 0.00 ATOM 5085 HN2 DPP 43 43.860 12.510 60.970 1.00 0.00 ATOM 5086 HN3 DPP 43 43.920 13.510 62.270 1.00 0.00 ATOM 5087 C12 DPP 43 45.320 11.960 62.350 1.00 0.00 ATOM 5088 H12A DPP 43 45.610 12.190 63.400 1.00 0.00 ATOM 5089 H12B DPP 43 46.100 12.520 61.780 1.00 0.00 ATOM 5090 C11 DPP 43 45.380 10.440 62.320 1.00 0.00 ATOM 5091 H11A DPP 43 46.280 9.950 62.770 1.00 0.00 ATOM 5092 H11B DPP 43 45.380 10.140 61.250 1.00 0.00 ATOM 5093 P DPP 43 44.320 8.130 62.710 1.00 0.00 ATOM 5094 O13 DPP 43 42.990 7.480 62.660 1.00 0.00 ATOM 5095 O14 DPP 43 45.290 7.560 63.670 1.00 0.00 ATOM 5096 O11 DPP 43 44.960 7.920 61.250 1.00 0.00 ATOM 5097 O12 DPP 43 44.280 9.720 62.890 1.00 0.00 ATOM 5098 C1 DPP 43 45.480 6.650 60.850 1.00 0.00 ATOM 5099 HA DPP 43 45.110 6.400 59.830 1.00 0.00 ATOM 5100 HB DPP 43 45.230 5.840 61.560 1.00 0.00 ATOM 5101 C2 DPP 43 47.010 6.530 60.930 1.00 0.00 ATOM 5102 HS DPP 43 47.150 6.670 62.020 1.00 0.00 ATOM 5103 O21 DPP 43 47.570 7.610 60.180 1.00 0.00 ATOM 5104 C21 DPP 43 48.870 7.870 60.280 1.00 0.00 ATOM 5105 O22 DPP 43 49.580 7.330 61.110 1.00 0.00 ATOM 5106 C22 DPP 43 49.400 8.810 59.200 1.00 0.00 ATOM 5107 H2R DPP 43 50.460 9.060 59.390 1.00 0.00 ATOM 5108 H2S DPP 43 48.790 9.740 59.290 1.00 0.00 ATOM 5109 C3 DPP 43 47.480 5.130 60.500 1.00 0.00 ATOM 5110 HX DPP 43 46.850 4.410 61.080 1.00 0.00 ATOM 5111 HY DPP 43 48.590 5.120 60.640 1.00 0.00 ATOM 5112 O31 DPP 43 47.170 4.950 59.120 1.00 0.00 ATOM 5113 C31 DPP 43 47.290 3.680 58.720 1.00 0.00 ATOM 5114 O32 DPP 43 47.660 2.760 59.440 1.00 0.00 ATOM 5115 C32 DPP 43 46.960 3.600 57.240 1.00 0.00 ATOM 5116 H2X DPP 43 46.790 4.620 56.810 1.00 0.00 ATOM 5117 H2Y DPP 43 46.000 3.060 57.060 1.00 0.00 ATOM 5118 C23 DPP 43 49.230 8.230 57.800 1.00 0.00 ATOM 5119 H3R DPP 43 48.210 8.440 57.400 1.00 0.00 ATOM 5120 H3S DPP 43 49.430 7.140 57.870 1.00 0.00 ATOM 5121 C24 DPP 43 50.290 8.810 56.870 1.00 0.00 ATOM 5122 H4R DPP 43 51.220 8.240 57.100 1.00 0.00 ATOM 5123 H4S DPP 43 50.410 9.910 56.980 1.00 0.00 ATOM 5124 C25 DPP 43 50.140 8.550 55.370 1.00 0.00 ATOM 5125 H5R DPP 43 50.790 9.240 54.800 1.00 0.00 ATOM 5126 H5S DPP 43 49.080 8.810 55.150 1.00 0.00 ATOM 5127 C26 DPP 43 50.310 7.110 54.880 1.00 0.00 ATOM 5128 H6R DPP 43 49.660 6.470 55.520 1.00 0.00 ATOM 5129 H6S DPP 43 51.390 6.880 55.030 1.00 0.00 ATOM 5130 C27 DPP 43 49.830 6.940 53.440 1.00 0.00 ATOM 5131 H7R DPP 43 48.860 7.490 53.370 1.00 0.00 ATOM 5132 H7S DPP 43 49.690 5.840 53.340 1.00 0.00 ATOM 5133 C28 DPP 43 50.820 7.530 52.440 1.00 0.00 ATOM 5134 H8R DPP 43 51.030 8.580 52.730 1.00 0.00 ATOM 5135 H8S DPP 43 50.380 7.450 51.420 1.00 0.00 ATOM 5136 C29 DPP 43 52.160 6.780 52.350 1.00 0.00 ATOM 5137 H9R DPP 43 52.120 5.810 51.810 1.00 0.00 ATOM 5138 H9S DPP 43 52.650 6.660 53.340 1.00 0.00 ATOM 5139 0C21 DPP 43 53.050 7.650 51.460 1.00 0.00 ATOM 5140 H10R DPP 43 52.990 8.740 51.650 1.00 0.00 ATOM 5141 H10S DPP 43 52.530 7.500 50.490 1.00 0.00 ATOM 5142 1C21 DPP 43 54.530 7.260 51.440 1.00 0.00 ATOM 5143 H11R DPP 43 54.900 7.440 52.460 1.00 0.00 ATOM 5144 H11S DPP 43 54.600 6.180 51.200 1.00 0.00 ATOM 5145 2C21 DPP 43 55.340 8.180 50.530 1.00 0.00 ATOM 5146 H12R DPP 43 56.410 8.250 50.840 1.00 0.00 ATOM 5147 H12S DPP 43 55.090 9.260 50.640 1.00 0.00 ATOM 5148 3C21 DPP 43 55.240 7.850 49.040 1.00 0.00 ATOM 5149 H13R DPP 43 54.170 8.110 48.870 1.00 0.00 ATOM 5150 H13S DPP 43 55.330 6.750 48.920 1.00 0.00 ATOM 5151 4C21 DPP 43 56.150 8.610 48.080 1.00 0.00 ATOM 5152 H14R DPP 43 55.820 8.170 47.110 1.00 0.00 ATOM 5153 H14S DPP 43 57.200 8.410 48.370 1.00 0.00 ATOM 5154 5C21 DPP 43 55.830 10.110 48.030 1.00 0.00 ATOM 5155 H15R DPP 43 56.010 10.440 49.080 1.00 0.00 ATOM 5156 H15S DPP 43 54.750 10.140 47.780 1.00 0.00 ATOM 5157 6C21 DPP 43 56.740 10.940 47.140 1.00 0.00 ATOM 5158 H16R DPP 43 57.360 11.490 47.880 1.00 0.00 ATOM 5159 H16S DPP 43 56.260 11.720 46.520 1.00 0.00 ATOM 5160 H16T DPP 43 57.340 10.220 46.550 1.00 0.00 ATOM 5161 C33 DPP 43 48.110 2.970 56.460 1.00 0.00 ATOM 5162 H3X DPP 43 48.580 2.190 57.100 1.00 0.00 ATOM 5163 H3Y DPP 43 48.900 3.730 56.260 1.00 0.00 ATOM 5164 C34 DPP 43 47.620 2.340 55.150 1.00 0.00 ATOM 5165 H4X DPP 43 47.130 1.350 55.280 1.00 0.00 ATOM 5166 H4Y DPP 43 48.540 2.240 54.540 1.00 0.00 ATOM 5167 C35 DPP 43 46.790 3.320 54.310 1.00 0.00 ATOM 5168 H5X DPP 43 47.410 4.240 54.260 1.00 0.00 ATOM 5169 H5Y DPP 43 45.870 3.650 54.840 1.00 0.00 ATOM 5170 C36 DPP 43 46.460 2.770 52.920 1.00 0.00 ATOM 5171 H6X DPP 43 45.920 1.820 53.090 1.00 0.00 ATOM 5172 H6Y DPP 43 47.370 2.380 52.400 1.00 0.00 ATOM 5173 C37 DPP 43 45.760 3.830 52.070 1.00 0.00 ATOM 5174 H7X DPP 43 46.340 4.760 51.880 1.00 0.00 ATOM 5175 H7Y DPP 43 44.760 4.080 52.510 1.00 0.00 ATOM 5176 C38 DPP 43 45.480 3.230 50.700 1.00 0.00 ATOM 5177 H8X DPP 43 44.690 3.800 50.160 1.00 0.00 ATOM 5178 H8Y DPP 43 45.190 2.170 50.880 1.00 0.00 ATOM 5179 C39 DPP 43 46.780 3.190 49.880 1.00 0.00 ATOM 5180 H9X DPP 43 46.580 2.350 49.170 1.00 0.00 ATOM 5181 H9Y DPP 43 47.730 3.120 50.450 1.00 0.00 ATOM 5182 0C31 DPP 43 46.940 4.470 49.060 1.00 0.00 ATOM 5183 H10X DPP 43 47.100 5.360 49.700 1.00 0.00 ATOM 5184 H10Y DPP 43 45.980 4.650 48.530 1.00 0.00 ATOM 5185 1C31 DPP 43 48.090 4.370 48.050 1.00 0.00 ATOM 5186 H11X DPP 43 48.080 5.170 47.290 1.00 0.00 ATOM 5187 H11Y DPP 43 47.950 3.410 47.500 1.00 0.00 ATOM 5188 2C31 DPP 43 49.490 4.360 48.680 1.00 0.00 ATOM 5189 H12X DPP 43 49.600 3.410 49.240 1.00 0.00 ATOM 5190 H12Y DPP 43 49.670 5.230 49.360 1.00 0.00 ATOM 5191 3C31 DPP 43 50.590 4.490 47.630 1.00 0.00 ATOM 5192 H13X DPP 43 50.410 5.340 46.940 1.00 0.00 ATOM 5193 H13Y DPP 43 50.460 3.580 47.000 1.00 0.00 ATOM 5194 4C31 DPP 43 51.990 4.510 48.230 1.00 0.00 ATOM 5195 H14X DPP 43 52.210 3.530 48.710 1.00 0.00 ATOM 5196 H14Y DPP 43 51.990 5.190 49.100 1.00 0.00 ATOM 5197 5C31 DPP 43 53.100 4.890 47.240 1.00 0.00 ATOM 5198 H15X DPP 43 54.110 4.780 47.700 1.00 0.00 ATOM 5199 H15Y DPP 43 52.880 5.900 46.830 1.00 0.00 ATOM 5200 6C31 DPP 43 53.200 3.910 46.070 1.00 0.00 ATOM 5201 H16X DPP 43 53.210 2.860 46.450 1.00 0.00 ATOM 5202 H16Y DPP 43 54.030 4.070 45.360 1.00 0.00 ATOM 5203 H16Z DPP 43 52.300 4.140 45.460 1.00 0.00 ATOM 5204 N DPP 44 9.410 53.980 64.140 1.00 0.00 ATOM 5205 HN1 DPP 44 10.070 54.420 63.470 1.00 0.00 ATOM 5206 HN2 DPP 44 8.450 54.000 63.760 1.00 0.00 ATOM 5207 HN3 DPP 44 9.730 52.990 64.160 1.00 0.00 ATOM 5208 C12 DPP 44 9.490 54.640 65.500 1.00 0.00 ATOM 5209 H12A DPP 44 10.560 54.640 65.800 1.00 0.00 ATOM 5210 H12B DPP 44 8.930 54.090 66.300 1.00 0.00 ATOM 5211 C11 DPP 44 8.850 56.010 65.270 1.00 0.00 ATOM 5212 H11A DPP 44 8.570 56.480 66.230 1.00 0.00 ATOM 5213 H11B DPP 44 7.910 55.770 64.710 1.00 0.00 ATOM 5214 P DPP 44 8.910 58.300 64.250 1.00 0.00 ATOM 5215 O13 DPP 44 9.700 59.410 64.820 1.00 0.00 ATOM 5216 O14 DPP 44 7.480 58.180 64.640 1.00 0.00 ATOM 5217 O11 DPP 44 8.980 58.440 62.660 1.00 0.00 ATOM 5218 O12 DPP 44 9.630 56.890 64.460 1.00 0.00 ATOM 5219 C1 DPP 44 10.310 58.450 62.150 1.00 0.00 ATOM 5220 HA DPP 44 10.340 57.710 61.330 1.00 0.00 ATOM 5221 HB DPP 44 11.090 57.950 62.770 1.00 0.00 ATOM 5222 C2 DPP 44 10.810 59.800 61.600 1.00 0.00 ATOM 5223 HS DPP 44 11.000 60.480 62.460 1.00 0.00 ATOM 5224 O21 DPP 44 9.810 60.320 60.720 1.00 0.00 ATOM 5225 C21 DPP 44 9.930 61.620 60.460 1.00 0.00 ATOM 5226 O22 DPP 44 10.710 62.320 61.090 1.00 0.00 ATOM 5227 C22 DPP 44 8.960 62.130 59.410 1.00 0.00 ATOM 5228 H2R DPP 44 7.910 61.880 59.700 1.00 0.00 ATOM 5229 H2S DPP 44 9.160 61.490 58.520 1.00 0.00 ATOM 5230 C3 DPP 44 12.160 59.570 60.890 1.00 0.00 ATOM 5231 HX DPP 44 12.840 59.240 61.710 1.00 0.00 ATOM 5232 HY DPP 44 12.670 60.510 60.560 1.00 0.00 ATOM 5233 O31 DPP 44 12.120 58.600 59.850 1.00 0.00 ATOM 5234 C31 DPP 44 11.810 59.110 58.650 1.00 0.00 ATOM 5235 O32 DPP 44 11.460 60.250 58.410 1.00 0.00 ATOM 5236 C32 DPP 44 12.110 58.000 57.660 1.00 0.00 ATOM 5237 H2X DPP 44 11.090 57.670 57.350 1.00 0.00 ATOM 5238 H2Y DPP 44 12.720 57.280 58.250 1.00 0.00 ATOM 5239 C23 DPP 44 9.130 63.580 58.970 1.00 0.00 ATOM 5240 H3R DPP 44 10.130 64.040 59.140 1.00 0.00 ATOM 5241 H3S DPP 44 8.450 64.220 59.570 1.00 0.00 ATOM 5242 C24 DPP 44 8.860 63.820 57.480 1.00 0.00 ATOM 5243 H4R DPP 44 9.540 63.160 56.900 1.00 0.00 ATOM 5244 H4S DPP 44 7.820 63.430 57.430 1.00 0.00 ATOM 5245 C25 DPP 44 8.890 65.290 57.060 1.00 0.00 ATOM 5246 H5R DPP 44 9.900 65.600 57.390 1.00 0.00 ATOM 5247 H5S DPP 44 8.130 65.740 57.730 1.00 0.00 ATOM 5248 C26 DPP 44 8.500 65.570 55.600 1.00 0.00 ATOM 5249 H6R DPP 44 8.890 66.590 55.430 1.00 0.00 ATOM 5250 H6S DPP 44 7.400 65.620 55.520 1.00 0.00 ATOM 5251 C27 DPP 44 9.340 64.820 54.570 1.00 0.00 ATOM 5252 H7R DPP 44 9.250 63.730 54.730 1.00 0.00 ATOM 5253 H7S DPP 44 10.410 65.100 54.720 1.00 0.00 ATOM 5254 C28 DPP 44 9.160 65.170 53.090 1.00 0.00 ATOM 5255 H8R DPP 44 9.360 66.260 53.020 1.00 0.00 ATOM 5256 H8S DPP 44 8.110 65.030 52.750 1.00 0.00 ATOM 5257 C29 DPP 44 10.030 64.320 52.160 1.00 0.00 ATOM 5258 H9R DPP 44 9.720 63.270 52.360 1.00 0.00 ATOM 5259 H9S DPP 44 11.080 64.510 52.480 1.00 0.00 ATOM 5260 0C21 DPP 44 9.750 64.480 50.670 1.00 0.00 ATOM 5261 H10R DPP 44 10.200 65.400 50.240 1.00 0.00 ATOM 5262 H10S DPP 44 8.650 64.420 50.500 1.00 0.00 ATOM 5263 1C21 DPP 44 10.540 63.500 49.810 1.00 0.00 ATOM 5264 H11R DPP 44 10.520 62.470 50.240 1.00 0.00 ATOM 5265 H11S DPP 44 11.540 63.980 49.910 1.00 0.00 ATOM 5266 2C21 DPP 44 10.330 63.430 48.300 1.00 0.00 ATOM 5267 H12R DPP 44 9.300 63.020 48.180 1.00 0.00 ATOM 5268 H12S DPP 44 11.100 62.810 47.790 1.00 0.00 ATOM 5269 3C21 DPP 44 10.330 64.730 47.510 1.00 0.00 ATOM 5270 H13R DPP 44 11.250 65.350 47.640 1.00 0.00 ATOM 5271 H13S DPP 44 9.530 65.400 47.890 1.00 0.00 ATOM 5272 4C21 DPP 44 10.040 64.500 46.020 1.00 0.00 ATOM 5273 H14R DPP 44 9.140 63.870 45.870 1.00 0.00 ATOM 5274 H14S DPP 44 10.880 63.970 45.520 1.00 0.00 ATOM 5275 5C21 DPP 44 9.780 65.760 45.190 1.00 0.00 ATOM 5276 H15R DPP 44 9.110 66.450 45.750 1.00 0.00 ATOM 5277 H15S DPP 44 9.220 65.480 44.280 1.00 0.00 ATOM 5278 6C21 DPP 44 11.040 66.580 44.880 1.00 0.00 ATOM 5279 H16R DPP 44 11.010 67.630 45.230 1.00 0.00 ATOM 5280 H16S DPP 44 11.150 66.500 43.780 1.00 0.00 ATOM 5281 H16T DPP 44 11.920 66.140 45.400 1.00 0.00 ATOM 5282 C33 DPP 44 12.880 58.480 56.420 1.00 0.00 ATOM 5283 H3X DPP 44 13.540 59.270 56.820 1.00 0.00 ATOM 5284 H3Y DPP 44 12.180 59.010 55.740 1.00 0.00 ATOM 5285 C34 DPP 44 13.710 57.420 55.710 1.00 0.00 ATOM 5286 H4X DPP 44 14.420 56.970 56.440 1.00 0.00 ATOM 5287 H4Y DPP 44 14.110 57.900 54.790 1.00 0.00 ATOM 5288 C35 DPP 44 12.790 56.280 55.260 1.00 0.00 ATOM 5289 H5X DPP 44 12.150 56.540 54.380 1.00 0.00 ATOM 5290 H5Y DPP 44 12.070 55.960 56.040 1.00 0.00 ATOM 5291 C36 DPP 44 13.460 55.000 54.770 1.00 0.00 ATOM 5292 H6X DPP 44 14.270 54.700 55.470 1.00 0.00 ATOM 5293 H6Y DPP 44 12.730 54.170 54.720 1.00 0.00 ATOM 5294 C37 DPP 44 14.150 55.120 53.410 1.00 0.00 ATOM 5295 H7X DPP 44 14.810 54.230 53.510 1.00 0.00 ATOM 5296 H7Y DPP 44 14.780 56.030 53.330 1.00 0.00 ATOM 5297 C38 DPP 44 13.380 54.850 52.120 1.00 0.00 ATOM 5298 H8X DPP 44 12.620 55.590 51.790 1.00 0.00 ATOM 5299 H8Y DPP 44 12.960 53.820 52.250 1.00 0.00 ATOM 5300 C39 DPP 44 14.230 54.690 50.860 1.00 0.00 ATOM 5301 H9X DPP 44 14.970 53.920 51.170 1.00 0.00 ATOM 5302 H9Y DPP 44 14.700 55.690 50.740 1.00 0.00 ATOM 5303 0C31 DPP 44 13.450 54.340 49.590 1.00 0.00 ATOM 5304 H10X DPP 44 12.810 55.210 49.350 1.00 0.00 ATOM 5305 H10Y DPP 44 12.840 53.420 49.750 1.00 0.00 ATOM 5306 1C31 DPP 44 14.350 54.000 48.400 1.00 0.00 ATOM 5307 H11X DPP 44 14.930 53.180 48.860 1.00 0.00 ATOM 5308 H11Y DPP 44 15.100 54.750 48.050 1.00 0.00 ATOM 5309 2C31 DPP 44 13.590 53.600 47.130 1.00 0.00 ATOM 5310 H12X DPP 44 13.090 54.540 46.800 1.00 0.00 ATOM 5311 H12Y DPP 44 12.800 52.830 47.270 1.00 0.00 ATOM 5312 3C31 DPP 44 14.480 53.320 45.930 1.00 0.00 ATOM 5313 H13X DPP 44 15.210 54.140 45.730 1.00 0.00 ATOM 5314 H13Y DPP 44 13.840 53.250 45.030 1.00 0.00 ATOM 5315 4C31 DPP 44 15.190 51.960 45.980 1.00 0.00 ATOM 5316 H14X DPP 44 15.420 51.790 47.050 1.00 0.00 ATOM 5317 H14Y DPP 44 16.090 52.020 45.340 1.00 0.00 ATOM 5318 5C31 DPP 44 14.410 50.720 45.550 1.00 0.00 ATOM 5319 H15X DPP 44 13.530 50.570 46.220 1.00 0.00 ATOM 5320 H15Y DPP 44 15.040 49.820 45.740 1.00 0.00 ATOM 5321 6C31 DPP 44 13.990 50.690 44.080 1.00 0.00 ATOM 5322 H16X DPP 44 13.340 51.490 43.680 1.00 0.00 ATOM 5323 H16Y DPP 44 13.390 49.810 43.780 1.00 0.00 ATOM 5324 H16Z DPP 44 14.950 50.760 43.530 1.00 0.00 ATOM 5325 N DPP 45 0.300 12.010 61.590 1.00 0.00 ATOM 5326 HN1 DPP 45 0.050 11.160 61.040 1.00 0.00 ATOM 5327 HN2 DPP 45 1.050 12.460 61.040 1.00 0.00 ATOM 5328 HN3 DPP 45 0.640 11.650 62.510 1.00 0.00 ATOM 5329 C12 DPP 45 -0.930 12.850 61.830 1.00 0.00 ATOM 5330 H12A DPP 45 -0.610 13.770 62.360 1.00 0.00 ATOM 5331 H12B DPP 45 -1.270 13.090 60.800 1.00 0.00 ATOM 5332 C11 DPP 45 -1.970 12.100 62.680 1.00 0.00 ATOM 5333 H11A DPP 45 -2.940 12.560 62.390 1.00 0.00 ATOM 5334 H11B DPP 45 -1.820 12.430 63.730 1.00 0.00 ATOM 5335 P DPP 45 -3.310 10.050 62.820 1.00 0.00 ATOM 5336 O13 DPP 45 -3.730 10.400 64.190 1.00 0.00 ATOM 5337 O14 DPP 45 -3.060 8.620 62.510 1.00 0.00 ATOM 5338 O11 DPP 45 -4.390 10.740 61.850 1.00 0.00 ATOM 5339 O12 DPP 45 -1.890 10.690 62.490 1.00 0.00 ATOM 5340 C1 DPP 45 -5.460 10.020 61.240 1.00 0.00 ATOM 5341 HA DPP 45 -6.230 10.800 61.040 1.00 0.00 ATOM 5342 HB DPP 45 -5.860 9.250 61.940 1.00 0.00 ATOM 5343 C2 DPP 45 -5.070 9.370 59.900 1.00 0.00 ATOM 5344 HS DPP 45 -4.110 8.840 60.040 1.00 0.00 ATOM 5345 O21 DPP 45 -4.960 10.410 58.930 1.00 0.00 ATOM 5346 C21 DPP 45 -3.780 10.910 58.560 1.00 0.00 ATOM 5347 O22 DPP 45 -2.740 10.700 59.160 1.00 0.00 ATOM 5348 C22 DPP 45 -3.870 11.680 57.250 1.00 0.00 ATOM 5349 H2R DPP 45 -3.550 12.720 57.470 1.00 0.00 ATOM 5350 H2S DPP 45 -4.890 11.630 56.810 1.00 0.00 ATOM 5351 C3 DPP 45 -6.130 8.350 59.450 1.00 0.00 ATOM 5352 HX DPP 45 -7.060 8.940 59.320 1.00 0.00 ATOM 5353 HY DPP 45 -6.220 7.480 60.130 1.00 0.00 ATOM 5354 O31 DPP 45 -5.820 8.030 58.090 1.00 0.00 ATOM 5355 C31 DPP 45 -4.980 6.990 58.050 1.00 0.00 ATOM 5356 O32 DPP 45 -4.570 6.370 59.020 1.00 0.00 ATOM 5357 C32 DPP 45 -4.530 6.640 56.640 1.00 0.00 ATOM 5358 H2X DPP 45 -5.090 7.220 55.880 1.00 0.00 ATOM 5359 H2Y DPP 45 -4.630 5.540 56.530 1.00 0.00 ATOM 5360 C23 DPP 45 -2.790 11.140 56.320 1.00 0.00 ATOM 5361 H3R DPP 45 -2.840 10.030 56.230 1.00 0.00 ATOM 5362 H3S DPP 45 -1.760 11.260 56.730 1.00 0.00 ATOM 5363 C24 DPP 45 -2.700 11.850 54.960 1.00 0.00 ATOM 5364 H4R DPP 45 -1.710 11.640 54.510 1.00 0.00 ATOM 5365 H4S DPP 45 -2.690 12.950 55.070 1.00 0.00 ATOM 5366 C25 DPP 45 -3.810 11.670 53.920 1.00 0.00 ATOM 5367 H5R DPP 45 -4.750 12.120 54.330 1.00 0.00 ATOM 5368 H5S DPP 45 -4.080 10.600 53.800 1.00 0.00 ATOM 5369 C26 DPP 45 -3.540 12.450 52.630 1.00 0.00 ATOM 5370 H6R DPP 45 -2.720 11.900 52.120 1.00 0.00 ATOM 5371 H6S DPP 45 -3.310 13.520 52.830 1.00 0.00 ATOM 5372 C27 DPP 45 -4.750 12.340 51.710 1.00 0.00 ATOM 5373 H7R DPP 45 -5.680 12.660 52.230 1.00 0.00 ATOM 5374 H7S DPP 45 -4.920 11.280 51.430 1.00 0.00 ATOM 5375 C28 DPP 45 -4.570 13.080 50.380 1.00 0.00 ATOM 5376 H8R DPP 45 -3.640 12.670 49.930 1.00 0.00 ATOM 5377 H8S DPP 45 -4.220 14.120 50.550 1.00 0.00 ATOM 5378 C29 DPP 45 -5.840 13.040 49.530 1.00 0.00 ATOM 5379 H9R DPP 45 -6.620 13.690 49.980 1.00 0.00 ATOM 5380 H9S DPP 45 -6.180 11.990 49.470 1.00 0.00 ATOM 5381 0C21 DPP 45 -5.580 13.620 48.130 1.00 0.00 ATOM 5382 H10R DPP 45 -4.600 13.160 47.880 1.00 0.00 ATOM 5383 H10S DPP 45 -5.340 14.700 48.170 1.00 0.00 ATOM 5384 1C21 DPP 45 -6.680 13.310 47.100 1.00 0.00 ATOM 5385 H11R DPP 45 -7.680 13.650 47.450 1.00 0.00 ATOM 5386 H11S DPP 45 -6.850 12.220 46.990 1.00 0.00 ATOM 5387 2C21 DPP 45 -6.290 13.880 45.740 1.00 0.00 ATOM 5388 H12R DPP 45 -5.280 13.520 45.440 1.00 0.00 ATOM 5389 H12S DPP 45 -6.440 14.960 45.970 1.00 0.00 ATOM 5390 3C21 DPP 45 -7.250 13.290 44.700 1.00 0.00 ATOM 5391 H13R DPP 45 -6.950 12.280 44.350 1.00 0.00 ATOM 5392 H13S DPP 45 -7.200 13.950 43.810 1.00 0.00 ATOM 5393 4C21 DPP 45 -8.690 13.160 45.180 1.00 0.00 ATOM 5394 H14R DPP 45 -9.080 13.930 45.880 1.00 0.00 ATOM 5395 H14S DPP 45 -8.860 12.140 45.600 1.00 0.00 ATOM 5396 5C21 DPP 45 -9.670 13.340 44.010 1.00 0.00 ATOM 5397 H15R DPP 45 -10.550 12.680 44.190 1.00 0.00 ATOM 5398 H15S DPP 45 -9.160 13.110 43.060 1.00 0.00 ATOM 5399 6C21 DPP 45 -10.140 14.770 43.760 1.00 0.00 ATOM 5400 H16R DPP 45 -10.950 14.790 43.000 1.00 0.00 ATOM 5401 H16S DPP 45 -9.380 15.380 43.220 1.00 0.00 ATOM 5402 H16T DPP 45 -10.380 15.390 44.650 1.00 0.00 ATOM 5403 C33 DPP 45 -3.000 6.780 56.580 1.00 0.00 ATOM 5404 H3X DPP 45 -2.670 5.790 56.970 1.00 0.00 ATOM 5405 H3Y DPP 45 -2.690 7.660 57.170 1.00 0.00 ATOM 5406 C34 DPP 45 -2.440 7.000 55.180 1.00 0.00 ATOM 5407 H4X DPP 45 -2.810 7.980 54.790 1.00 0.00 ATOM 5408 H4Y DPP 45 -2.820 6.230 54.470 1.00 0.00 ATOM 5409 C35 DPP 45 -0.930 7.170 55.020 1.00 0.00 ATOM 5410 H5X DPP 45 -0.590 6.270 55.580 1.00 0.00 ATOM 5411 H5Y DPP 45 -0.400 8.030 55.490 1.00 0.00 ATOM 5412 C36 DPP 45 -0.400 7.160 53.590 1.00 0.00 ATOM 5413 H6X DPP 45 -0.750 6.210 53.140 1.00 0.00 ATOM 5414 H6Y DPP 45 0.700 7.060 53.770 1.00 0.00 ATOM 5415 C37 DPP 45 -0.800 8.370 52.740 1.00 0.00 ATOM 5416 H7X DPP 45 -0.430 9.320 53.180 1.00 0.00 ATOM 5417 H7Y DPP 45 -1.880 8.500 52.530 1.00 0.00 ATOM 5418 C38 DPP 45 0.080 8.280 51.490 1.00 0.00 ATOM 5419 H8X DPP 45 1.170 8.390 51.610 1.00 0.00 ATOM 5420 H8Y DPP 45 -0.170 9.210 50.930 1.00 0.00 ATOM 5421 C39 DPP 45 -0.330 7.100 50.600 1.00 0.00 ATOM 5422 H9X DPP 45 -1.420 7.030 50.800 1.00 0.00 ATOM 5423 H9Y DPP 45 0.130 6.170 51.000 1.00 0.00 ATOM 5424 0C31 DPP 45 -0.000 7.280 49.110 1.00 0.00 ATOM 5425 H10X DPP 45 1.090 7.120 49.020 1.00 0.00 ATOM 5426 H10Y DPP 45 -0.360 8.260 48.740 1.00 0.00 ATOM 5427 1C31 DPP 45 -0.680 6.230 48.240 1.00 0.00 ATOM 5428 H11X DPP 45 -1.760 6.480 48.280 1.00 0.00 ATOM 5429 H11Y DPP 45 -0.540 5.220 48.670 1.00 0.00 ATOM 5430 2C31 DPP 45 -0.090 6.140 46.830 1.00 0.00 ATOM 5431 H12X DPP 45 -0.590 5.300 46.290 1.00 0.00 ATOM 5432 H12Y DPP 45 0.990 5.890 46.850 1.00 0.00 ATOM 5433 3C31 DPP 45 -0.310 7.400 45.990 1.00 0.00 ATOM 5434 H13X DPP 45 0.390 8.210 46.290 1.00 0.00 ATOM 5435 H13Y DPP 45 -1.350 7.780 46.080 1.00 0.00 ATOM 5436 4C31 DPP 45 -0.170 7.240 44.470 1.00 0.00 ATOM 5437 H14X DPP 45 -0.830 6.400 44.160 1.00 0.00 ATOM 5438 H14Y DPP 45 0.880 6.930 44.250 1.00 0.00 ATOM 5439 5C31 DPP 45 -0.420 8.480 43.610 1.00 0.00 ATOM 5440 H15X DPP 45 -0.040 9.350 44.190 1.00 0.00 ATOM 5441 H15Y DPP 45 -1.510 8.620 43.470 1.00 0.00 ATOM 5442 6C31 DPP 45 0.380 8.520 42.310 1.00 0.00 ATOM 5443 H16X DPP 45 0.130 9.440 41.750 1.00 0.00 ATOM 5444 H16Y DPP 45 0.310 7.670 41.600 1.00 0.00 ATOM 5445 H16Z DPP 45 1.460 8.630 42.550 1.00 0.00 ATOM 5446 N DPP 46 24.880 3.870 60.480 1.00 0.00 ATOM 5447 HN1 DPP 46 24.050 4.480 60.610 1.00 0.00 ATOM 5448 HN2 DPP 46 24.700 3.030 61.080 1.00 0.00 ATOM 5449 HN3 DPP 46 25.740 4.350 60.790 1.00 0.00 ATOM 5450 C12 DPP 46 24.940 3.250 59.110 1.00 0.00 ATOM 5451 H12A DPP 46 23.900 2.850 59.040 1.00 0.00 ATOM 5452 H12B DPP 46 25.090 4.140 58.460 1.00 0.00 ATOM 5453 C11 DPP 46 25.970 2.120 59.120 1.00 0.00 ATOM 5454 H11A DPP 46 26.010 1.590 58.140 1.00 0.00 ATOM 5455 H11B DPP 46 25.480 1.480 59.880 1.00 0.00 ATOM 5456 P DPP 46 28.400 1.370 59.440 1.00 0.00 ATOM 5457 O13 DPP 46 28.410 0.970 60.870 1.00 0.00 ATOM 5458 O14 DPP 46 29.640 1.950 58.880 1.00 0.00 ATOM 5459 O11 DPP 46 27.840 0.150 58.560 1.00 0.00 ATOM 5460 O12 DPP 46 27.310 2.540 59.400 1.00 0.00 ATOM 5461 C1 DPP 46 28.570 -1.080 58.570 1.00 0.00 ATOM 5462 HA DPP 46 27.730 -1.740 58.240 1.00 0.00 ATOM 5463 HB DPP 46 28.960 -1.360 59.570 1.00 0.00 ATOM 5464 C2 DPP 46 29.710 -1.230 57.550 1.00 0.00 ATOM 5465 HS DPP 46 30.480 -0.540 57.950 1.00 0.00 ATOM 5466 O21 DPP 46 29.310 -0.890 56.220 1.00 0.00 ATOM 5467 C21 DPP 46 30.310 -0.490 55.440 1.00 0.00 ATOM 5468 O22 DPP 46 31.500 -0.540 55.700 1.00 0.00 ATOM 5469 C22 DPP 46 29.810 0.280 54.230 1.00 0.00 ATOM 5470 H2R DPP 46 29.910 1.360 54.420 1.00 0.00 ATOM 5471 H2S DPP 46 28.730 0.040 54.100 1.00 0.00 ATOM 5472 C3 DPP 46 30.170 -2.700 57.650 1.00 0.00 ATOM 5473 HX DPP 46 30.190 -2.870 58.750 1.00 0.00 ATOM 5474 HY DPP 46 31.190 -2.850 57.230 1.00 0.00 ATOM 5475 O31 DPP 46 29.290 -3.590 56.970 1.00 0.00 ATOM 5476 C31 DPP 46 29.750 -4.840 56.840 1.00 0.00 ATOM 5477 O32 DPP 46 30.870 -5.160 57.200 1.00 0.00 ATOM 5478 C32 DPP 46 28.780 -5.680 56.020 1.00 0.00 ATOM 5479 H2X DPP 46 28.230 -4.870 55.500 1.00 0.00 ATOM 5480 H2Y DPP 46 28.110 -6.290 56.670 1.00 0.00 ATOM 5481 C23 DPP 46 30.470 -0.180 52.920 1.00 0.00 ATOM 5482 H3R DPP 46 30.410 -1.260 52.690 1.00 0.00 ATOM 5483 H3S DPP 46 31.550 0.080 52.980 1.00 0.00 ATOM 5484 C24 DPP 46 29.830 0.530 51.730 1.00 0.00 ATOM 5485 H4R DPP 46 29.730 1.620 51.880 1.00 0.00 ATOM 5486 H4S DPP 46 28.760 0.230 51.690 1.00 0.00 ATOM 5487 C25 DPP 46 30.480 0.190 50.380 1.00 0.00 ATOM 5488 H5R DPP 46 29.900 -0.660 49.960 1.00 0.00 ATOM 5489 H5S DPP 46 31.560 -0.060 50.420 1.00 0.00 ATOM 5490 C26 DPP 46 30.270 1.290 49.340 1.00 0.00 ATOM 5491 H6R DPP 46 30.810 2.170 49.770 1.00 0.00 ATOM 5492 H6S DPP 46 29.180 1.480 49.270 1.00 0.00 ATOM 5493 C27 DPP 46 30.910 0.950 48.000 1.00 0.00 ATOM 5494 H7R DPP 46 31.880 0.410 48.070 1.00 0.00 ATOM 5495 H7S DPP 46 31.090 1.970 47.600 1.00 0.00 ATOM 5496 C28 DPP 46 29.980 0.130 47.100 1.00 0.00 ATOM 5497 H8R DPP 46 28.930 0.500 47.120 1.00 0.00 ATOM 5498 H8S DPP 46 30.040 -0.860 47.590 1.00 0.00 ATOM 5499 C29 DPP 46 30.610 0.030 45.710 1.00 0.00 ATOM 5500 H9R DPP 46 30.020 -0.790 45.260 1.00 0.00 ATOM 5501 H9S DPP 46 31.710 -0.140 45.710 1.00 0.00 ATOM 5502 0C21 DPP 46 30.480 1.280 44.840 1.00 0.00 ATOM 5503 H10R DPP 46 30.640 1.030 43.770 1.00 0.00 ATOM 5504 H10S DPP 46 31.190 2.020 45.260 1.00 0.00 ATOM 5505 1C21 DPP 46 29.130 2.000 44.990 1.00 0.00 ATOM 5506 H11R DPP 46 28.730 2.230 46.000 1.00 0.00 ATOM 5507 H11S DPP 46 28.500 1.220 44.520 1.00 0.00 ATOM 5508 2C21 DPP 46 29.220 3.350 44.270 1.00 0.00 ATOM 5509 H12R DPP 46 29.800 3.230 43.330 1.00 0.00 ATOM 5510 H12S DPP 46 29.830 4.040 44.900 1.00 0.00 ATOM 5511 3C21 DPP 46 27.870 4.000 43.950 1.00 0.00 ATOM 5512 H13R DPP 46 27.930 5.080 43.680 1.00 0.00 ATOM 5513 H13S DPP 46 27.250 3.970 44.870 1.00 0.00 ATOM 5514 4C21 DPP 46 27.150 3.220 42.850 1.00 0.00 ATOM 5515 H14R DPP 46 27.180 2.120 43.030 1.00 0.00 ATOM 5516 H14S DPP 46 27.620 3.300 41.850 1.00 0.00 ATOM 5517 5C21 DPP 46 25.660 3.570 42.880 1.00 0.00 ATOM 5518 H15R DPP 46 25.320 3.480 41.830 1.00 0.00 ATOM 5519 H15S DPP 46 25.540 4.640 43.180 1.00 0.00 ATOM 5520 6C21 DPP 46 24.720 2.790 43.800 1.00 0.00 ATOM 5521 H16R DPP 46 24.550 1.750 43.460 1.00 0.00 ATOM 5522 H16S DPP 46 23.720 3.260 43.880 1.00 0.00 ATOM 5523 H16T DPP 46 25.050 2.740 44.860 1.00 0.00 ATOM 5524 C33 DPP 46 29.560 -6.600 55.080 1.00 0.00 ATOM 5525 H3X DPP 46 30.400 -7.190 55.490 1.00 0.00 ATOM 5526 H3Y DPP 46 30.000 -5.860 54.380 1.00 0.00 ATOM 5527 C34 DPP 46 28.640 -7.600 54.380 1.00 0.00 ATOM 5528 H4X DPP 46 27.680 -7.170 54.040 1.00 0.00 ATOM 5529 H4Y DPP 46 28.510 -8.500 55.030 1.00 0.00 ATOM 5530 C35 DPP 46 29.220 -8.050 53.040 1.00 0.00 ATOM 5531 H5X DPP 46 28.560 -8.890 52.740 1.00 0.00 ATOM 5532 H5Y DPP 46 30.290 -8.310 53.200 1.00 0.00 ATOM 5533 C36 DPP 46 29.060 -7.050 51.890 1.00 0.00 ATOM 5534 H6X DPP 46 29.940 -6.380 51.860 1.00 0.00 ATOM 5535 H6Y DPP 46 28.140 -6.510 52.180 1.00 0.00 ATOM 5536 C37 DPP 46 28.860 -7.640 50.500 1.00 0.00 ATOM 5537 H7X DPP 46 27.900 -7.190 50.150 1.00 0.00 ATOM 5538 H7Y DPP 46 28.620 -8.720 50.480 1.00 0.00 ATOM 5539 C38 DPP 46 30.050 -7.560 49.540 1.00 0.00 ATOM 5540 H8X DPP 46 30.070 -6.530 49.130 1.00 0.00 ATOM 5541 H8Y DPP 46 29.790 -8.290 48.750 1.00 0.00 ATOM 5542 C39 DPP 46 31.380 -8.190 49.960 1.00 0.00 ATOM 5543 H9X DPP 46 31.820 -7.620 50.800 1.00 0.00 ATOM 5544 H9Y DPP 46 32.120 -8.130 49.130 1.00 0.00 ATOM 5545 0C31 DPP 46 31.310 -9.610 50.540 1.00 0.00 ATOM 5546 H10X DPP 46 30.950 -10.360 49.810 1.00 0.00 ATOM 5547 H10Y DPP 46 30.520 -9.670 51.320 1.00 0.00 ATOM 5548 1C31 DPP 46 32.620 -9.960 51.250 1.00 0.00 ATOM 5549 H11X DPP 46 33.450 -9.280 50.960 1.00 0.00 ATOM 5550 H11Y DPP 46 32.710 -11.010 50.890 1.00 0.00 ATOM 5551 2C31 DPP 46 32.700 -9.930 52.780 1.00 0.00 ATOM 5552 H12X DPP 46 32.290 -8.910 52.920 1.00 0.00 ATOM 5553 H12Y DPP 46 33.730 -10.150 53.120 1.00 0.00 ATOM 5554 3C31 DPP 46 31.840 -11.030 53.420 1.00 0.00 ATOM 5555 H13X DPP 46 32.260 -12.040 53.240 1.00 0.00 ATOM 5556 H13Y DPP 46 30.790 -11.050 53.060 1.00 0.00 ATOM 5557 4C31 DPP 46 31.970 -10.830 54.930 1.00 0.00 ATOM 5558 H14X DPP 46 31.510 -9.830 55.100 1.00 0.00 ATOM 5559 H14Y DPP 46 33.020 -10.760 55.300 1.00 0.00 ATOM 5560 5C31 DPP 46 31.200 -11.850 55.760 1.00 0.00 ATOM 5561 H15X DPP 46 30.100 -11.700 55.660 1.00 0.00 ATOM 5562 H15Y DPP 46 31.590 -11.660 56.790 1.00 0.00 ATOM 5563 6C31 DPP 46 31.520 -13.300 55.410 1.00 0.00 ATOM 5564 H16X DPP 46 31.170 -14.060 56.130 1.00 0.00 ATOM 5565 H16Y DPP 46 32.620 -13.410 55.350 1.00 0.00 ATOM 5566 H16Z DPP 46 31.040 -13.550 54.430 1.00 0.00 ATOM 5567 N DPP 47 53.560 51.190 58.730 1.00 0.00 ATOM 5568 HN1 DPP 47 52.950 51.960 58.380 1.00 0.00 ATOM 5569 HN2 DPP 47 53.490 50.400 58.050 1.00 0.00 ATOM 5570 HN3 DPP 47 53.100 50.900 59.620 1.00 0.00 ATOM 5571 C12 DPP 47 54.950 51.720 58.980 1.00 0.00 ATOM 5572 H12A DPP 47 55.480 51.920 58.020 1.00 0.00 ATOM 5573 H12B DPP 47 54.790 52.710 59.470 1.00 0.00 ATOM 5574 C11 DPP 47 55.720 50.690 59.800 1.00 0.00 ATOM 5575 H11A DPP 47 55.330 50.690 60.840 1.00 0.00 ATOM 5576 H11B DPP 47 56.800 50.930 59.920 1.00 0.00 ATOM 5577 P DPP 47 56.470 48.290 60.340 1.00 0.00 ATOM 5578 O13 DPP 47 56.050 48.400 61.750 1.00 0.00 ATOM 5579 O14 DPP 47 57.900 48.630 60.180 1.00 0.00 ATOM 5580 O11 DPP 47 56.110 46.860 59.720 1.00 0.00 ATOM 5581 O12 DPP 47 55.650 49.310 59.420 1.00 0.00 ATOM 5582 C1 DPP 47 56.380 45.680 60.490 1.00 0.00 ATOM 5583 HA DPP 47 55.760 44.840 60.110 1.00 0.00 ATOM 5584 HB DPP 47 56.130 45.850 61.560 1.00 0.00 ATOM 5585 C2 DPP 47 57.850 45.240 60.450 1.00 0.00 ATOM 5586 HS DPP 47 58.450 46.040 60.910 1.00 0.00 ATOM 5587 O21 DPP 47 58.310 45.130 59.100 1.00 0.00 ATOM 5588 C21 DPP 47 59.640 45.060 59.040 1.00 0.00 ATOM 5589 O22 DPP 47 60.370 45.130 60.020 1.00 0.00 ATOM 5590 C22 DPP 47 60.110 44.880 57.610 1.00 0.00 ATOM 5591 H2R DPP 47 59.520 45.460 56.870 1.00 0.00 ATOM 5592 H2S DPP 47 60.040 43.800 57.350 1.00 0.00 ATOM 5593 C3 DPP 47 58.000 43.940 61.260 1.00 0.00 ATOM 5594 HX DPP 47 57.410 44.030 62.200 1.00 0.00 ATOM 5595 HY DPP 47 59.020 43.720 61.660 1.00 0.00 ATOM 5596 O31 DPP 47 57.420 42.820 60.600 1.00 0.00 ATOM 5597 C31 DPP 47 58.160 42.070 59.790 1.00 0.00 ATOM 5598 O32 DPP 47 59.370 42.210 59.660 1.00 0.00 ATOM 5599 C32 DPP 47 57.210 41.240 58.940 1.00 0.00 ATOM 5600 H2X DPP 47 56.360 41.940 58.760 1.00 0.00 ATOM 5601 H2Y DPP 47 56.650 40.420 59.430 1.00 0.00 ATOM 5602 C23 DPP 47 61.530 45.430 57.470 1.00 0.00 ATOM 5603 H3R DPP 47 62.180 45.320 58.360 1.00 0.00 ATOM 5604 H3S DPP 47 61.510 46.530 57.310 1.00 0.00 ATOM 5605 C24 DPP 47 62.250 44.660 56.370 1.00 0.00 ATOM 5606 H4R DPP 47 61.650 44.580 55.440 1.00 0.00 ATOM 5607 H4S DPP 47 62.480 43.600 56.630 1.00 0.00 ATOM 5608 C25 DPP 47 63.590 45.290 55.980 1.00 0.00 ATOM 5609 H5R DPP 47 64.300 45.020 56.800 1.00 0.00 ATOM 5610 H5S DPP 47 63.480 46.390 55.990 1.00 0.00 ATOM 5611 C26 DPP 47 64.140 44.840 54.630 1.00 0.00 ATOM 5612 H6R DPP 47 64.680 45.670 54.120 1.00 0.00 ATOM 5613 H6S DPP 47 63.260 44.620 53.990 1.00 0.00 ATOM 5614 C27 DPP 47 64.790 43.470 54.780 1.00 0.00 ATOM 5615 H7R DPP 47 64.030 42.660 54.900 1.00 0.00 ATOM 5616 H7S DPP 47 65.450 43.630 55.660 1.00 0.00 ATOM 5617 C28 DPP 47 65.720 43.220 53.600 1.00 0.00 ATOM 5618 H8R DPP 47 66.020 44.200 53.170 1.00 0.00 ATOM 5619 H8S DPP 47 65.110 42.760 52.800 1.00 0.00 ATOM 5620 C29 DPP 47 66.930 42.380 54.010 1.00 0.00 ATOM 5621 H9R DPP 47 66.570 41.330 54.050 1.00 0.00 ATOM 5622 H9S DPP 47 67.170 42.640 55.070 1.00 0.00 ATOM 5623 0C21 DPP 47 68.020 42.500 52.940 1.00 0.00 ATOM 5624 H10R DPP 47 67.670 42.200 51.930 1.00 0.00 ATOM 5625 H10S DPP 47 68.830 41.780 53.190 1.00 0.00 ATOM 5626 1C21 DPP 47 68.700 43.870 52.950 1.00 0.00 ATOM 5627 H11R DPP 47 68.710 44.150 54.030 1.00 0.00 ATOM 5628 H11S DPP 47 68.090 44.710 52.560 1.00 0.00 ATOM 5629 2C21 DPP 47 70.100 43.900 52.340 1.00 0.00 ATOM 5630 H12R DPP 47 70.800 43.320 52.980 1.00 0.00 ATOM 5631 H12S DPP 47 70.410 44.950 52.500 1.00 0.00 ATOM 5632 3C21 DPP 47 70.260 43.570 50.860 1.00 0.00 ATOM 5633 H13R DPP 47 69.950 42.540 50.570 1.00 0.00 ATOM 5634 H13S DPP 47 71.350 43.680 50.670 1.00 0.00 ATOM 5635 4C21 DPP 47 69.530 44.530 49.910 1.00 0.00 ATOM 5636 H14R DPP 47 69.880 45.530 50.250 1.00 0.00 ATOM 5637 H14S DPP 47 68.480 44.480 50.280 1.00 0.00 ATOM 5638 5C21 DPP 47 69.550 44.340 48.390 1.00 0.00 ATOM 5639 H15R DPP 47 70.550 44.590 47.970 1.00 0.00 ATOM 5640 H15S DPP 47 68.760 45.030 48.040 1.00 0.00 ATOM 5641 6C21 DPP 47 69.430 42.890 47.900 1.00 0.00 ATOM 5642 H16R DPP 47 70.030 42.200 48.530 1.00 0.00 ATOM 5643 H16S DPP 47 69.790 42.870 46.850 1.00 0.00 ATOM 5644 H16T DPP 47 68.390 42.500 47.980 1.00 0.00 ATOM 5645 C33 DPP 47 57.800 40.660 57.650 1.00 0.00 ATOM 5646 H3X DPP 47 57.660 39.560 57.560 1.00 0.00 ATOM 5647 H3Y DPP 47 58.890 40.860 57.630 1.00 0.00 ATOM 5648 C34 DPP 47 57.200 41.330 56.420 1.00 0.00 ATOM 5649 H4X DPP 47 56.090 41.210 56.420 1.00 0.00 ATOM 5650 H4Y DPP 47 57.620 40.800 55.540 1.00 0.00 ATOM 5651 C35 DPP 47 57.500 42.810 56.140 1.00 0.00 ATOM 5652 H5X DPP 47 58.540 43.070 55.860 1.00 0.00 ATOM 5653 H5Y DPP 47 57.240 43.290 57.110 1.00 0.00 ATOM 5654 C36 DPP 47 56.600 43.290 55.000 1.00 0.00 ATOM 5655 H6X DPP 47 55.550 43.330 55.370 1.00 0.00 ATOM 5656 H6Y DPP 47 56.550 42.490 54.220 1.00 0.00 ATOM 5657 C37 DPP 47 57.030 44.590 54.320 1.00 0.00 ATOM 5658 H7X DPP 47 57.660 45.150 55.050 1.00 0.00 ATOM 5659 H7Y DPP 47 56.020 45.050 54.190 1.00 0.00 ATOM 5660 C38 DPP 47 57.680 44.340 52.960 1.00 0.00 ATOM 5661 H8X DPP 47 57.570 45.240 52.320 1.00 0.00 ATOM 5662 H8Y DPP 47 57.210 43.460 52.490 1.00 0.00 ATOM 5663 C39 DPP 47 59.170 44.020 53.080 1.00 0.00 ATOM 5664 H9X DPP 47 59.210 43.090 53.680 1.00 0.00 ATOM 5665 H9Y DPP 47 59.630 44.910 53.580 1.00 0.00 ATOM 5666 0C31 DPP 47 59.850 43.790 51.720 1.00 0.00 ATOM 5667 H10X DPP 47 59.840 44.780 51.220 1.00 0.00 ATOM 5668 H10Y DPP 47 59.390 43.100 50.980 1.00 0.00 ATOM 5669 1C31 DPP 47 61.330 43.430 51.750 1.00 0.00 ATOM 5670 H11X DPP 47 61.170 42.590 52.460 1.00 0.00 ATOM 5671 H11Y DPP 47 61.970 44.250 52.160 1.00 0.00 ATOM 5672 2C31 DPP 47 61.930 42.890 50.440 1.00 0.00 ATOM 5673 H12X DPP 47 61.360 42.020 50.050 1.00 0.00 ATOM 5674 H12Y DPP 47 62.960 42.550 50.680 1.00 0.00 ATOM 5675 3C31 DPP 47 62.100 43.970 49.370 1.00 0.00 ATOM 5676 H13X DPP 47 62.740 44.810 49.730 1.00 0.00 ATOM 5677 H13Y DPP 47 61.100 44.340 49.050 1.00 0.00 ATOM 5678 4C31 DPP 47 62.620 43.480 48.020 1.00 0.00 ATOM 5679 H14X DPP 47 62.040 42.600 47.660 1.00 0.00 ATOM 5680 H14Y DPP 47 63.710 43.320 47.940 1.00 0.00 ATOM 5681 5C31 DPP 47 62.490 44.530 46.920 1.00 0.00 ATOM 5682 H15X DPP 47 62.790 45.540 47.280 1.00 0.00 ATOM 5683 H15Y DPP 47 61.400 44.620 46.730 1.00 0.00 ATOM 5684 6C31 DPP 47 63.260 44.130 45.660 1.00 0.00 ATOM 5685 H16X DPP 47 62.750 43.230 45.260 1.00 0.00 ATOM 5686 H16Y DPP 47 63.260 44.970 44.940 1.00 0.00 ATOM 5687 H16Z DPP 47 64.310 43.930 45.940 1.00 0.00 ATOM 5688 N DPP 48 41.520 34.190 67.410 1.00 0.00 ATOM 5689 HN1 DPP 48 41.910 33.670 68.230 1.00 0.00 ATOM 5690 HN2 DPP 48 41.940 35.140 67.450 1.00 0.00 ATOM 5691 HN3 DPP 48 40.480 34.220 67.470 1.00 0.00 ATOM 5692 C12 DPP 48 41.960 33.510 66.140 1.00 0.00 ATOM 5693 H12A DPP 48 41.590 34.020 65.210 1.00 0.00 ATOM 5694 H12B DPP 48 41.420 32.550 66.230 1.00 0.00 ATOM 5695 C11 DPP 48 43.450 33.280 65.890 1.00 0.00 ATOM 5696 H11A DPP 48 43.620 32.610 65.020 1.00 0.00 ATOM 5697 H11B DPP 48 43.710 32.670 66.780 1.00 0.00 ATOM 5698 P DPP 48 45.170 34.930 64.730 1.00 0.00 ATOM 5699 O13 DPP 48 46.440 34.300 65.160 1.00 0.00 ATOM 5700 O14 DPP 48 45.170 36.370 64.410 1.00 0.00 ATOM 5701 O11 DPP 48 44.690 34.160 63.420 1.00 0.00 ATOM 5702 O12 DPP 48 44.110 34.550 65.870 1.00 0.00 ATOM 5703 C1 DPP 48 43.600 34.740 62.690 1.00 0.00 ATOM 5704 HA DPP 48 43.970 35.740 62.390 1.00 0.00 ATOM 5705 HB DPP 48 42.710 34.870 63.330 1.00 0.00 ATOM 5706 C2 DPP 48 43.170 34.040 61.390 1.00 0.00 ATOM 5707 HS DPP 48 42.070 34.160 61.240 1.00 0.00 ATOM 5708 O21 DPP 48 43.490 32.650 61.390 1.00 0.00 ATOM 5709 C21 DPP 48 42.770 31.970 62.280 1.00 0.00 ATOM 5710 O22 DPP 48 41.890 32.440 62.990 1.00 0.00 ATOM 5711 C22 DPP 48 43.130 30.500 62.120 1.00 0.00 ATOM 5712 H2R DPP 48 42.480 29.890 62.790 1.00 0.00 ATOM 5713 H2S DPP 48 44.200 30.430 62.410 1.00 0.00 ATOM 5714 C3 DPP 48 43.700 34.640 60.080 1.00 0.00 ATOM 5715 HX DPP 48 43.530 35.740 60.130 1.00 0.00 ATOM 5716 HY DPP 48 43.040 34.260 59.270 1.00 0.00 ATOM 5717 O31 DPP 48 45.040 34.270 59.750 1.00 0.00 ATOM 5718 C31 DPP 48 45.950 35.240 59.870 1.00 0.00 ATOM 5719 O32 DPP 48 45.750 36.340 60.360 1.00 0.00 ATOM 5720 C32 DPP 48 47.360 34.700 59.670 1.00 0.00 ATOM 5721 H2X DPP 48 47.390 33.850 58.960 1.00 0.00 ATOM 5722 H2Y DPP 48 47.730 34.280 60.630 1.00 0.00 ATOM 5723 C23 DPP 48 42.860 30.100 60.670 1.00 0.00 ATOM 5724 H3R DPP 48 43.460 30.760 60.000 1.00 0.00 ATOM 5725 H3S DPP 48 41.750 30.150 60.590 1.00 0.00 ATOM 5726 C24 DPP 48 43.060 28.610 60.390 1.00 0.00 ATOM 5727 H4R DPP 48 42.440 28.140 61.180 1.00 0.00 ATOM 5728 H4S DPP 48 44.090 28.280 60.630 1.00 0.00 ATOM 5729 C25 DPP 48 42.510 28.160 59.040 1.00 0.00 ATOM 5730 H5R DPP 48 42.980 28.860 58.320 1.00 0.00 ATOM 5731 H5S DPP 48 41.430 28.420 59.090 1.00 0.00 ATOM 5732 C26 DPP 48 42.970 26.730 58.750 1.00 0.00 ATOM 5733 H6R DPP 48 42.220 26.010 59.130 1.00 0.00 ATOM 5734 H6S DPP 48 43.930 26.620 59.310 1.00 0.00 ATOM 5735 C27 DPP 48 43.280 26.390 57.290 1.00 0.00 ATOM 5736 H7R DPP 48 43.550 25.310 57.260 1.00 0.00 ATOM 5737 H7S DPP 48 44.120 27.040 56.960 1.00 0.00 ATOM 5738 C28 DPP 48 42.070 26.580 56.370 1.00 0.00 ATOM 5739 H8R DPP 48 41.690 27.620 56.420 1.00 0.00 ATOM 5740 H8S DPP 48 41.190 26.030 56.780 1.00 0.00 ATOM 5741 C29 DPP 48 42.320 26.240 54.900 1.00 0.00 ATOM 5742 H9R DPP 48 43.250 26.770 54.580 1.00 0.00 ATOM 5743 H9S DPP 48 41.430 26.540 54.320 1.00 0.00 ATOM 5744 0C21 DPP 48 42.340 24.740 54.620 1.00 0.00 ATOM 5745 H10R DPP 48 41.280 24.420 54.730 1.00 0.00 ATOM 5746 H10S DPP 48 43.010 24.220 55.340 1.00 0.00 ATOM 5747 1C21 DPP 48 42.860 24.490 53.200 1.00 0.00 ATOM 5748 H11R DPP 48 43.280 23.470 53.110 1.00 0.00 ATOM 5749 H11S DPP 48 43.720 25.180 53.070 1.00 0.00 ATOM 5750 2C21 DPP 48 41.860 24.880 52.100 1.00 0.00 ATOM 5751 H12R DPP 48 41.770 25.990 52.010 1.00 0.00 ATOM 5752 H12S DPP 48 40.920 24.380 52.410 1.00 0.00 ATOM 5753 3C21 DPP 48 42.330 24.440 50.710 1.00 0.00 ATOM 5754 H13R DPP 48 41.440 24.310 50.060 1.00 0.00 ATOM 5755 H13S DPP 48 42.850 23.460 50.740 1.00 0.00 ATOM 5756 4C21 DPP 48 43.290 25.490 50.160 1.00 0.00 ATOM 5757 H14R DPP 48 44.320 25.420 50.580 1.00 0.00 ATOM 5758 H14S DPP 48 42.840 26.500 50.270 1.00 0.00 ATOM 5759 5C21 DPP 48 43.420 25.290 48.650 1.00 0.00 ATOM 5760 H15R DPP 48 42.470 25.160 48.080 1.00 0.00 ATOM 5761 H15S DPP 48 43.830 24.270 48.510 1.00 0.00 ATOM 5762 6C21 DPP 48 44.200 26.430 47.990 1.00 0.00 ATOM 5763 H16R DPP 48 44.190 26.250 46.900 1.00 0.00 ATOM 5764 H16S DPP 48 45.260 26.370 48.300 1.00 0.00 ATOM 5765 H16T DPP 48 43.850 27.460 48.200 1.00 0.00 ATOM 5766 C33 DPP 48 48.250 35.770 59.030 1.00 0.00 ATOM 5767 H3X DPP 48 49.240 35.310 59.280 1.00 0.00 ATOM 5768 H3Y DPP 48 48.110 36.690 59.640 1.00 0.00 ATOM 5769 C34 DPP 48 48.060 35.920 57.520 1.00 0.00 ATOM 5770 H4X DPP 48 48.640 36.760 57.070 1.00 0.00 ATOM 5771 H4Y DPP 48 47.000 36.120 57.250 1.00 0.00 ATOM 5772 C35 DPP 48 48.500 34.710 56.700 1.00 0.00 ATOM 5773 H5X DPP 48 47.970 33.820 57.090 1.00 0.00 ATOM 5774 H5Y DPP 48 49.590 34.490 56.780 1.00 0.00 ATOM 5775 C36 DPP 48 48.140 34.960 55.230 1.00 0.00 ATOM 5776 H6X DPP 48 47.060 35.260 55.220 1.00 0.00 ATOM 5777 H6Y DPP 48 48.150 34.010 54.660 1.00 0.00 ATOM 5778 C37 DPP 48 49.050 35.980 54.540 1.00 0.00 ATOM 5779 H7X DPP 48 50.100 35.770 54.820 1.00 0.00 ATOM 5780 H7Y DPP 48 48.840 37.050 54.750 1.00 0.00 ATOM 5781 C38 DPP 48 48.960 35.820 53.030 1.00 0.00 ATOM 5782 H8X DPP 48 48.080 36.350 52.610 1.00 0.00 ATOM 5783 H8Y DPP 48 48.820 34.750 52.730 1.00 0.00 ATOM 5784 C39 DPP 48 50.250 36.270 52.330 1.00 0.00 ATOM 5785 H9X DPP 48 51.120 35.760 52.790 1.00 0.00 ATOM 5786 H9Y DPP 48 50.420 37.360 52.480 1.00 0.00 ATOM 5787 0C31 DPP 48 50.230 36.010 50.830 1.00 0.00 ATOM 5788 H10X DPP 48 50.240 34.910 50.630 1.00 0.00 ATOM 5789 H10Y DPP 48 51.200 36.320 50.380 1.00 0.00 ATOM 5790 1C31 DPP 48 49.030 36.650 50.110 1.00 0.00 ATOM 5791 H11X DPP 48 48.830 37.690 50.450 1.00 0.00 ATOM 5792 H11Y DPP 48 48.020 36.260 50.350 1.00 0.00 ATOM 5793 2C31 DPP 48 49.090 36.460 48.590 1.00 0.00 ATOM 5794 H12X DPP 48 50.160 36.530 48.290 1.00 0.00 ATOM 5795 H12Y DPP 48 48.610 37.390 48.200 1.00 0.00 ATOM 5796 3C31 DPP 48 48.370 35.220 48.060 1.00 0.00 ATOM 5797 H13X DPP 48 47.330 35.250 48.440 1.00 0.00 ATOM 5798 H13Y DPP 48 48.880 34.240 48.200 1.00 0.00 ATOM 5799 4C31 DPP 48 48.140 35.430 46.560 1.00 0.00 ATOM 5800 H14X DPP 48 49.120 35.330 46.030 1.00 0.00 ATOM 5801 H14Y DPP 48 47.840 36.490 46.410 1.00 0.00 ATOM 5802 5C31 DPP 48 47.270 34.450 45.770 1.00 0.00 ATOM 5803 H15X DPP 48 47.340 34.740 44.700 1.00 0.00 ATOM 5804 H15Y DPP 48 46.190 34.590 45.990 1.00 0.00 ATOM 5805 6C31 DPP 48 47.730 33.010 46.010 1.00 0.00 ATOM 5806 H16X DPP 48 47.120 32.290 45.430 1.00 0.00 ATOM 5807 H16Y DPP 48 47.990 32.880 47.080 1.00 0.00 ATOM 5808 H16Z DPP 48 48.740 32.930 45.550 1.00 0.00 ATOM 5809 N DPP 49 16.040 22.810 64.400 1.00 0.00 ATOM 5810 HN1 DPP 49 16.370 23.350 65.220 1.00 0.00 ATOM 5811 HN2 DPP 49 15.110 22.460 64.720 1.00 0.00 ATOM 5812 HN3 DPP 49 16.600 21.980 64.120 1.00 0.00 ATOM 5813 C12 DPP 49 15.700 23.610 63.160 1.00 0.00 ATOM 5814 H12A DPP 49 14.870 24.330 63.340 1.00 0.00 ATOM 5815 H12B DPP 49 15.480 22.850 62.380 1.00 0.00 ATOM 5816 C11 DPP 49 16.880 24.470 62.710 1.00 0.00 ATOM 5817 H11A DPP 49 16.880 25.350 63.390 1.00 0.00 ATOM 5818 H11B DPP 49 16.730 24.850 61.670 1.00 0.00 ATOM 5819 P DPP 49 19.340 24.690 62.530 1.00 0.00 ATOM 5820 O13 DPP 49 20.530 23.810 62.450 1.00 0.00 ATOM 5821 O14 DPP 49 19.350 25.850 63.450 1.00 0.00 ATOM 5822 O11 DPP 49 19.080 25.110 61.010 1.00 0.00 ATOM 5823 O12 DPP 49 18.100 23.720 62.790 1.00 0.00 ATOM 5824 C1 DPP 49 19.580 24.260 59.980 1.00 0.00 ATOM 5825 HA DPP 49 18.930 24.230 59.080 1.00 0.00 ATOM 5826 HB DPP 49 19.570 23.210 60.350 1.00 0.00 ATOM 5827 C2 DPP 49 20.950 24.730 59.450 1.00 0.00 ATOM 5828 HS DPP 49 21.520 24.960 60.370 1.00 0.00 ATOM 5829 O21 DPP 49 20.700 25.930 58.710 1.00 0.00 ATOM 5830 C21 DPP 49 21.730 26.740 58.500 1.00 0.00 ATOM 5831 O22 DPP 49 22.850 26.570 58.940 1.00 0.00 ATOM 5832 C22 DPP 49 21.330 28.010 57.750 1.00 0.00 ATOM 5833 H2R DPP 49 21.470 28.980 58.290 1.00 0.00 ATOM 5834 H2S DPP 49 20.270 27.930 57.440 1.00 0.00 ATOM 5835 C3 DPP 49 21.740 23.680 58.640 1.00 0.00 ATOM 5836 HX DPP 49 21.880 22.810 59.320 1.00 0.00 ATOM 5837 HY DPP 49 22.700 24.100 58.270 1.00 0.00 ATOM 5838 O31 DPP 49 20.950 23.370 57.490 1.00 0.00 ATOM 5839 C31 DPP 49 20.840 22.110 57.050 1.00 0.00 ATOM 5840 O32 DPP 49 21.310 21.150 57.630 1.00 0.00 ATOM 5841 C32 DPP 49 19.960 22.060 55.810 1.00 0.00 ATOM 5842 H2X DPP 49 20.710 22.290 55.020 1.00 0.00 ATOM 5843 H2Y DPP 49 19.160 22.820 55.860 1.00 0.00 ATOM 5844 C23 DPP 49 22.280 28.040 56.550 1.00 0.00 ATOM 5845 H3R DPP 49 23.280 28.290 56.980 1.00 0.00 ATOM 5846 H3S DPP 49 22.010 28.920 55.940 1.00 0.00 ATOM 5847 C24 DPP 49 22.250 26.840 55.600 1.00 0.00 ATOM 5848 H4R DPP 49 21.350 26.230 55.840 1.00 0.00 ATOM 5849 H4S DPP 49 23.140 26.200 55.720 1.00 0.00 ATOM 5850 C25 DPP 49 22.230 27.210 54.120 1.00 0.00 ATOM 5851 H5R DPP 49 23.220 27.650 53.880 1.00 0.00 ATOM 5852 H5S DPP 49 21.440 27.900 53.760 1.00 0.00 ATOM 5853 C26 DPP 49 22.080 25.900 53.340 1.00 0.00 ATOM 5854 H6R DPP 49 21.360 25.280 53.920 1.00 0.00 ATOM 5855 H6S DPP 49 23.120 25.490 53.380 1.00 0.00 ATOM 5856 C27 DPP 49 21.780 26.090 51.860 1.00 0.00 ATOM 5857 H7R DPP 49 20.860 26.720 51.960 1.00 0.00 ATOM 5858 H7S DPP 49 21.460 25.110 51.440 1.00 0.00 ATOM 5859 C28 DPP 49 22.930 26.620 51.000 1.00 0.00 ATOM 5860 H8R DPP 49 23.790 25.950 51.240 1.00 0.00 ATOM 5861 H8S DPP 49 23.120 27.690 51.240 1.00 0.00 ATOM 5862 C29 DPP 49 22.600 26.590 49.510 1.00 0.00 ATOM 5863 H9R DPP 49 21.630 27.110 49.340 1.00 0.00 ATOM 5864 H9S DPP 49 22.530 25.550 49.130 1.00 0.00 ATOM 5865 0C21 DPP 49 23.820 27.200 48.820 1.00 0.00 ATOM 5866 H10R DPP 49 24.690 26.750 49.340 1.00 0.00 ATOM 5867 H10S DPP 49 23.840 28.310 48.870 1.00 0.00 ATOM 5868 1C21 DPP 49 24.010 26.780 47.360 1.00 0.00 ATOM 5869 H11R DPP 49 23.260 27.300 46.730 1.00 0.00 ATOM 5870 H11S DPP 49 23.920 25.680 47.270 1.00 0.00 ATOM 5871 2C21 DPP 49 25.340 27.270 46.770 1.00 0.00 ATOM 5872 H12R DPP 49 26.110 26.750 47.390 1.00 0.00 ATOM 5873 H12S DPP 49 25.360 28.370 46.880 1.00 0.00 ATOM 5874 3C21 DPP 49 25.620 26.960 45.300 1.00 0.00 ATOM 5875 H13R DPP 49 26.460 27.630 45.030 1.00 0.00 ATOM 5876 H13S DPP 49 24.820 27.300 44.610 1.00 0.00 ATOM 5877 4C21 DPP 49 26.000 25.520 44.940 1.00 0.00 ATOM 5878 H14R DPP 49 25.210 24.900 45.410 1.00 0.00 ATOM 5879 H14S DPP 49 27.010 25.280 45.350 1.00 0.00 ATOM 5880 5C21 DPP 49 26.130 25.290 43.440 1.00 0.00 ATOM 5881 H15R DPP 49 26.580 26.150 42.880 1.00 0.00 ATOM 5882 H15S DPP 49 25.140 25.030 43.010 1.00 0.00 ATOM 5883 6C21 DPP 49 26.970 24.040 43.150 1.00 0.00 ATOM 5884 H16R DPP 49 28.030 24.160 43.440 1.00 0.00 ATOM 5885 H16S DPP 49 26.980 23.640 42.110 1.00 0.00 ATOM 5886 H16T DPP 49 26.640 23.140 43.700 1.00 0.00 ATOM 5887 C33 DPP 49 19.370 20.650 55.710 1.00 0.00 ATOM 5888 H3X DPP 49 18.820 20.580 56.670 1.00 0.00 ATOM 5889 H3Y DPP 49 20.140 19.850 55.770 1.00 0.00 ATOM 5890 C34 DPP 49 18.300 20.460 54.630 1.00 0.00 ATOM 5891 H4X DPP 49 17.470 21.160 54.850 1.00 0.00 ATOM 5892 H4Y DPP 49 17.920 19.420 54.680 1.00 0.00 ATOM 5893 C35 DPP 49 18.730 20.730 53.190 1.00 0.00 ATOM 5894 H5X DPP 49 18.810 21.820 53.000 1.00 0.00 ATOM 5895 H5Y DPP 49 18.040 20.260 52.460 1.00 0.00 ATOM 5896 C36 DPP 49 20.070 20.060 52.860 1.00 0.00 ATOM 5897 H6X DPP 49 19.980 18.960 52.990 1.00 0.00 ATOM 5898 H6Y DPP 49 20.860 20.340 53.590 1.00 0.00 ATOM 5899 C37 DPP 49 20.520 20.420 51.440 1.00 0.00 ATOM 5900 H7X DPP 49 21.180 19.640 51.010 1.00 0.00 ATOM 5901 H7Y DPP 49 21.190 21.290 51.540 1.00 0.00 ATOM 5902 C38 DPP 49 19.450 20.550 50.350 1.00 0.00 ATOM 5903 H8X DPP 49 18.890 21.460 50.670 1.00 0.00 ATOM 5904 H8Y DPP 49 18.820 19.640 50.270 1.00 0.00 ATOM 5905 C39 DPP 49 20.100 20.770 48.990 1.00 0.00 ATOM 5906 H9X DPP 49 20.750 19.910 48.720 1.00 0.00 ATOM 5907 H9Y DPP 49 20.730 21.670 49.180 1.00 0.00 ATOM 5908 0C31 DPP 49 19.070 20.970 47.880 1.00 0.00 ATOM 5909 H10X DPP 49 18.570 21.940 48.090 1.00 0.00 ATOM 5910 H10Y DPP 49 18.280 20.190 47.920 1.00 0.00 ATOM 5911 1C31 DPP 49 19.590 20.850 46.440 1.00 0.00 ATOM 5912 H11X DPP 49 20.160 19.920 46.250 1.00 0.00 ATOM 5913 H11Y DPP 49 20.390 21.620 46.530 1.00 0.00 ATOM 5914 2C31 DPP 49 18.490 21.150 45.430 1.00 0.00 ATOM 5915 H12X DPP 49 18.070 22.150 45.690 1.00 0.00 ATOM 5916 H12Y DPP 49 17.590 20.500 45.460 1.00 0.00 ATOM 5917 3C31 DPP 49 18.930 21.190 43.960 1.00 0.00 ATOM 5918 H13X DPP 49 19.850 21.800 44.000 1.00 0.00 ATOM 5919 H13Y DPP 49 18.140 21.790 43.470 1.00 0.00 ATOM 5920 4C31 DPP 49 19.200 19.840 43.300 1.00 0.00 ATOM 5921 H14X DPP 49 18.210 19.350 43.330 1.00 0.00 ATOM 5922 H14Y DPP 49 19.860 19.400 44.080 1.00 0.00 ATOM 5923 5C31 DPP 49 19.790 19.670 41.890 1.00 0.00 ATOM 5924 H15X DPP 49 20.590 20.440 41.880 1.00 0.00 ATOM 5925 H15Y DPP 49 18.990 19.870 41.140 1.00 0.00 ATOM 5926 6C31 DPP 49 20.520 18.340 41.760 1.00 0.00 ATOM 5927 H16X DPP 49 21.420 18.310 42.420 1.00 0.00 ATOM 5928 H16Y DPP 49 20.890 18.100 40.740 1.00 0.00 ATOM 5929 H16Z DPP 49 19.910 17.450 42.030 1.00 0.00 ATOM 5930 N DPP 50 47.470 31.990 64.790 1.00 0.00 ATOM 5931 HN1 DPP 50 48.430 32.290 65.050 1.00 0.00 ATOM 5932 HN2 DPP 50 47.000 32.920 64.800 1.00 0.00 ATOM 5933 HN3 DPP 50 47.100 31.410 65.570 1.00 0.00 ATOM 5934 C12 DPP 50 47.400 31.360 63.430 1.00 0.00 ATOM 5935 H12A DPP 50 46.330 31.440 63.130 1.00 0.00 ATOM 5936 H12B DPP 50 47.500 30.250 63.380 1.00 0.00 ATOM 5937 C11 DPP 50 48.350 32.090 62.490 1.00 0.00 ATOM 5938 H11A DPP 50 48.270 33.150 62.810 1.00 0.00 ATOM 5939 H11B DPP 50 48.090 31.880 61.430 1.00 0.00 ATOM 5940 P DPP 50 50.700 32.810 62.320 1.00 0.00 ATOM 5941 O13 DPP 50 52.000 32.120 62.150 1.00 0.00 ATOM 5942 O14 DPP 50 50.630 33.850 63.370 1.00 0.00 ATOM 5943 O11 DPP 50 50.210 33.340 60.900 1.00 0.00 ATOM 5944 O12 DPP 50 49.690 31.630 62.700 1.00 0.00 ATOM 5945 C1 DPP 50 50.500 32.420 59.830 1.00 0.00 ATOM 5946 HA DPP 50 49.620 32.570 59.170 1.00 0.00 ATOM 5947 HB DPP 50 50.460 31.350 60.110 1.00 0.00 ATOM 5948 C2 DPP 50 51.790 32.790 59.080 1.00 0.00 ATOM 5949 HS DPP 50 52.630 32.540 59.770 1.00 0.00 ATOM 5950 O21 DPP 50 51.700 34.200 58.870 1.00 0.00 ATOM 5951 C21 DPP 50 52.850 34.860 58.850 1.00 0.00 ATOM 5952 O22 DPP 50 53.950 34.360 59.020 1.00 0.00 ATOM 5953 C22 DPP 50 52.550 36.340 58.660 1.00 0.00 ATOM 5954 H2R DPP 50 53.300 36.920 59.230 1.00 0.00 ATOM 5955 H2S DPP 50 51.540 36.690 58.970 1.00 0.00 ATOM 5956 C3 DPP 50 51.810 31.970 57.780 1.00 0.00 ATOM 5957 HX DPP 50 50.880 32.020 57.170 1.00 0.00 ATOM 5958 HY DPP 50 51.950 30.910 58.050 1.00 0.00 ATOM 5959 O31 DPP 50 52.820 32.470 56.900 1.00 0.00 ATOM 5960 C31 DPP 50 53.900 31.680 56.850 1.00 0.00 ATOM 5961 O32 DPP 50 54.030 30.660 57.510 1.00 0.00 ATOM 5962 C32 DPP 50 54.990 32.250 55.950 1.00 0.00 ATOM 5963 H2X DPP 50 55.120 33.310 56.270 1.00 0.00 ATOM 5964 H2Y DPP 50 54.620 32.080 54.920 1.00 0.00 ATOM 5965 C23 DPP 50 52.760 36.470 57.150 1.00 0.00 ATOM 5966 H3R DPP 50 52.050 35.840 56.580 1.00 0.00 ATOM 5967 H3S DPP 50 53.810 36.200 56.890 1.00 0.00 ATOM 5968 C24 DPP 50 52.450 37.850 56.550 1.00 0.00 ATOM 5969 H4R DPP 50 53.170 38.620 56.910 1.00 0.00 ATOM 5970 H4S DPP 50 51.420 38.210 56.750 1.00 0.00 ATOM 5971 C25 DPP 50 52.770 37.860 55.060 1.00 0.00 ATOM 5972 H5R DPP 50 51.980 37.330 54.480 1.00 0.00 ATOM 5973 H5S DPP 50 53.780 37.440 54.850 1.00 0.00 ATOM 5974 C26 DPP 50 52.850 39.250 54.420 1.00 0.00 ATOM 5975 H6R DPP 50 53.590 39.810 55.030 1.00 0.00 ATOM 5976 H6S DPP 50 51.910 39.810 54.620 1.00 0.00 ATOM 5977 C27 DPP 50 53.220 39.180 52.940 1.00 0.00 ATOM 5978 H7R DPP 50 52.390 38.730 52.350 1.00 0.00 ATOM 5979 H7S DPP 50 54.190 38.650 52.800 1.00 0.00 ATOM 5980 C28 DPP 50 53.700 40.570 52.490 1.00 0.00 ATOM 5981 H8R DPP 50 54.180 41.070 53.360 1.00 0.00 ATOM 5982 H8S DPP 50 52.790 41.170 52.290 1.00 0.00 ATOM 5983 C29 DPP 50 54.700 40.610 51.330 1.00 0.00 ATOM 5984 H9R DPP 50 54.760 41.660 51.000 1.00 0.00 ATOM 5985 H9S DPP 50 54.250 40.000 50.520 1.00 0.00 ATOM 5986 0C21 DPP 50 56.160 40.270 51.620 1.00 0.00 ATOM 5987 H10R DPP 50 56.360 39.260 52.040 1.00 0.00 ATOM 5988 H10S DPP 50 56.330 40.900 52.520 1.00 0.00 ATOM 5989 1C21 DPP 50 57.230 40.500 50.560 1.00 0.00 ATOM 5990 H11R DPP 50 58.270 40.290 50.900 1.00 0.00 ATOM 5991 H11S DPP 50 57.150 41.600 50.400 1.00 0.00 ATOM 5992 2C21 DPP 50 57.020 39.620 49.330 1.00 0.00 ATOM 5993 H12R DPP 50 55.970 39.550 48.950 1.00 0.00 ATOM 5994 H12S DPP 50 57.350 38.630 49.690 1.00 0.00 ATOM 5995 3C21 DPP 50 57.900 39.990 48.140 1.00 0.00 ATOM 5996 H13R DPP 50 58.510 40.850 48.460 1.00 0.00 ATOM 5997 H13S DPP 50 57.260 40.320 47.300 1.00 0.00 ATOM 5998 4C21 DPP 50 58.850 38.820 47.840 1.00 0.00 ATOM 5999 H14R DPP 50 58.990 38.820 46.740 1.00 0.00 ATOM 6000 H14S DPP 50 58.350 37.860 48.090 1.00 0.00 ATOM 6001 5C21 DPP 50 60.160 38.920 48.630 1.00 0.00 ATOM 6002 H15R DPP 50 60.060 39.240 49.690 1.00 0.00 ATOM 6003 H15S DPP 50 60.860 39.630 48.140 1.00 0.00 ATOM 6004 6C21 DPP 50 60.930 37.610 48.540 1.00 0.00 ATOM 6005 H16R DPP 50 61.220 37.360 47.490 1.00 0.00 ATOM 6006 H16S DPP 50 60.420 36.730 48.980 1.00 0.00 ATOM 6007 H16T DPP 50 61.840 37.700 49.170 1.00 0.00 ATOM 6008 C33 DPP 50 56.270 31.440 56.180 1.00 0.00 ATOM 6009 H3X DPP 50 56.460 31.370 57.280 1.00 0.00 ATOM 6010 H3Y DPP 50 57.080 32.080 55.770 1.00 0.00 ATOM 6011 C34 DPP 50 56.320 30.130 55.400 1.00 0.00 ATOM 6012 H4X DPP 50 55.340 29.610 55.390 1.00 0.00 ATOM 6013 H4Y DPP 50 57.030 29.470 55.950 1.00 0.00 ATOM 6014 C35 DPP 50 56.700 30.290 53.920 1.00 0.00 ATOM 6015 H5X DPP 50 57.800 30.170 53.800 1.00 0.00 ATOM 6016 H5Y DPP 50 56.620 31.370 53.690 1.00 0.00 ATOM 6017 C36 DPP 50 55.790 29.660 52.870 1.00 0.00 ATOM 6018 H6X DPP 50 54.830 30.220 52.930 1.00 0.00 ATOM 6019 H6Y DPP 50 55.600 28.610 53.170 1.00 0.00 ATOM 6020 C37 DPP 50 56.360 29.630 51.450 1.00 0.00 ATOM 6021 H7X DPP 50 57.400 29.270 51.590 1.00 0.00 ATOM 6022 H7Y DPP 50 56.230 30.700 51.200 1.00 0.00 ATOM 6023 C38 DPP 50 55.600 28.710 50.500 1.00 0.00 ATOM 6024 H8X DPP 50 54.550 29.030 50.690 1.00 0.00 ATOM 6025 H8Y DPP 50 55.820 27.640 50.690 1.00 0.00 ATOM 6026 C39 DPP 50 55.990 29.040 49.060 1.00 0.00 ATOM 6027 H9X DPP 50 57.090 28.940 48.930 1.00 0.00 ATOM 6028 H9Y DPP 50 55.720 30.120 48.930 1.00 0.00 ATOM 6029 0C31 DPP 50 55.250 28.050 48.160 1.00 0.00 ATOM 6030 H10X DPP 50 54.160 28.190 48.320 1.00 0.00 ATOM 6031 H10Y DPP 50 55.400 26.980 48.400 1.00 0.00 ATOM 6032 1C31 DPP 50 55.690 28.240 46.710 1.00 0.00 ATOM 6033 H11X DPP 50 56.800 28.300 46.730 1.00 0.00 ATOM 6034 H11Y DPP 50 55.250 29.200 46.360 1.00 0.00 ATOM 6035 2C31 DPP 50 55.240 27.190 45.690 1.00 0.00 ATOM 6036 H12X DPP 50 55.430 26.180 46.120 1.00 0.00 ATOM 6037 H12Y DPP 50 55.760 27.350 44.720 1.00 0.00 ATOM 6038 3C31 DPP 50 53.720 27.060 45.560 1.00 0.00 ATOM 6039 H13X DPP 50 53.220 27.630 44.750 1.00 0.00 ATOM 6040 H13Y DPP 50 53.230 27.460 46.470 1.00 0.00 ATOM 6041 4C31 DPP 50 53.290 25.610 45.330 1.00 0.00 ATOM 6042 H14X DPP 50 52.200 25.450 45.370 1.00 0.00 ATOM 6043 H14Y DPP 50 53.840 24.920 46.010 1.00 0.00 ATOM 6044 5C31 DPP 50 53.660 25.000 43.980 1.00 0.00 ATOM 6045 H15X DPP 50 53.380 23.960 43.700 1.00 0.00 ATOM 6046 H15Y DPP 50 54.760 24.930 43.830 1.00 0.00 ATOM 6047 6C31 DPP 50 53.270 25.900 42.810 1.00 0.00 ATOM 6048 H16X DPP 50 53.920 26.790 43.000 1.00 0.00 ATOM 6049 H16Y DPP 50 52.170 26.020 42.850 1.00 0.00 ATOM 6050 H16Z DPP 50 53.540 25.550 41.790 1.00 0.00 ATOM 6051 N DPP 51 15.900 35.720 68.960 1.00 0.00 ATOM 6052 HN1 DPP 51 15.810 34.910 69.610 1.00 0.00 ATOM 6053 HN2 DPP 51 15.800 36.670 69.360 1.00 0.00 ATOM 6054 HN3 DPP 51 15.130 35.530 68.290 1.00 0.00 ATOM 6055 C12 DPP 51 17.280 35.680 68.330 1.00 0.00 ATOM 6056 H12A DPP 51 17.450 34.740 67.780 1.00 0.00 ATOM 6057 H12B DPP 51 18.000 35.670 69.170 1.00 0.00 ATOM 6058 C11 DPP 51 17.620 36.960 67.560 1.00 0.00 ATOM 6059 H11A DPP 51 18.560 36.890 66.960 1.00 0.00 ATOM 6060 H11B DPP 51 17.830 37.750 68.310 1.00 0.00 ATOM 6061 P DPP 51 16.660 38.740 65.930 1.00 0.00 ATOM 6062 O13 DPP 51 17.700 39.500 66.660 1.00 0.00 ATOM 6063 O14 DPP 51 15.330 39.400 65.840 1.00 0.00 ATOM 6064 O11 DPP 51 17.220 38.420 64.470 1.00 0.00 ATOM 6065 O12 DPP 51 16.570 37.320 66.660 1.00 0.00 ATOM 6066 C1 DPP 51 16.340 37.860 63.500 1.00 0.00 ATOM 6067 HA DPP 51 16.840 38.140 62.550 1.00 0.00 ATOM 6068 HB DPP 51 15.310 38.280 63.560 1.00 0.00 ATOM 6069 C2 DPP 51 16.260 36.320 63.590 1.00 0.00 ATOM 6070 HS DPP 51 15.750 36.280 64.580 1.00 0.00 ATOM 6071 O21 DPP 51 17.580 35.790 63.630 1.00 0.00 ATOM 6072 C21 DPP 51 17.540 34.570 64.170 1.00 0.00 ATOM 6073 O22 DPP 51 16.520 34.030 64.580 1.00 0.00 ATOM 6074 C22 DPP 51 18.870 33.850 64.310 1.00 0.00 ATOM 6075 H2R DPP 51 18.580 32.790 64.470 1.00 0.00 ATOM 6076 H2S DPP 51 19.390 34.260 65.200 1.00 0.00 ATOM 6077 C3 DPP 51 15.370 35.770 62.460 1.00 0.00 ATOM 6078 HX DPP 51 14.480 36.440 62.430 1.00 0.00 ATOM 6079 HY DPP 51 14.920 34.790 62.700 1.00 0.00 ATOM 6080 O31 DPP 51 16.030 35.630 61.200 1.00 0.00 ATOM 6081 C31 DPP 51 15.950 36.680 60.380 1.00 0.00 ATOM 6082 O32 DPP 51 15.090 37.530 60.480 1.00 0.00 ATOM 6083 C32 DPP 51 17.050 36.700 59.330 1.00 0.00 ATOM 6084 H2X DPP 51 17.750 35.890 59.610 1.00 0.00 ATOM 6085 H2Y DPP 51 17.520 37.700 59.460 1.00 0.00 ATOM 6086 C23 DPP 51 19.840 33.900 63.140 1.00 0.00 ATOM 6087 H3R DPP 51 20.820 33.420 63.340 1.00 0.00 ATOM 6088 H3S DPP 51 20.070 34.960 62.880 1.00 0.00 ATOM 6089 C24 DPP 51 19.260 33.220 61.900 1.00 0.00 ATOM 6090 H4R DPP 51 18.420 33.830 61.500 1.00 0.00 ATOM 6091 H4S DPP 51 18.850 32.230 62.170 1.00 0.00 ATOM 6092 C25 DPP 51 20.180 32.910 60.710 1.00 0.00 ATOM 6093 H5R DPP 51 21.090 32.350 61.020 1.00 0.00 ATOM 6094 H5S DPP 51 20.500 33.770 60.080 1.00 0.00 ATOM 6095 C26 DPP 51 19.580 31.930 59.700 1.00 0.00 ATOM 6096 H6R DPP 51 18.530 31.850 60.050 1.00 0.00 ATOM 6097 H6S DPP 51 20.120 31.000 59.980 1.00 0.00 ATOM 6098 C27 DPP 51 19.690 32.400 58.250 1.00 0.00 ATOM 6099 H7R DPP 51 20.660 32.810 57.880 1.00 0.00 ATOM 6100 H7S DPP 51 19.080 33.310 58.090 1.00 0.00 ATOM 6101 C28 DPP 51 19.250 31.250 57.340 1.00 0.00 ATOM 6102 H8R DPP 51 18.170 31.040 57.490 1.00 0.00 ATOM 6103 H8S DPP 51 19.920 30.370 57.490 1.00 0.00 ATOM 6104 C29 DPP 51 19.420 31.650 55.870 1.00 0.00 ATOM 6105 H9R DPP 51 20.510 31.700 55.630 1.00 0.00 ATOM 6106 H9S DPP 51 19.090 32.690 55.650 1.00 0.00 ATOM 6107 0C21 DPP 51 18.530 30.690 55.080 1.00 0.00 ATOM 6108 H10R DPP 51 17.470 30.840 55.390 1.00 0.00 ATOM 6109 H10S DPP 51 18.880 29.660 55.270 1.00 0.00 ATOM 6110 1C21 DPP 51 18.660 31.010 53.590 1.00 0.00 ATOM 6111 H11R DPP 51 19.650 30.930 53.090 1.00 0.00 ATOM 6112 H11S DPP 51 18.480 32.110 53.570 1.00 0.00 ATOM 6113 2C21 DPP 51 17.520 30.410 52.760 1.00 0.00 ATOM 6114 H12R DPP 51 16.650 30.330 53.440 1.00 0.00 ATOM 6115 H12S DPP 51 17.830 29.410 52.370 1.00 0.00 ATOM 6116 3C21 DPP 51 17.160 31.220 51.520 1.00 0.00 ATOM 6117 H13R DPP 51 18.120 31.470 51.020 1.00 0.00 ATOM 6118 H13S DPP 51 16.520 32.090 51.800 1.00 0.00 ATOM 6119 4C21 DPP 51 16.220 30.480 50.570 1.00 0.00 ATOM 6120 H14R DPP 51 15.330 30.050 51.070 1.00 0.00 ATOM 6121 H14S DPP 51 16.720 29.570 50.180 1.00 0.00 ATOM 6122 5C21 DPP 51 15.940 31.410 49.380 1.00 0.00 ATOM 6123 H15R DPP 51 16.830 31.690 48.790 1.00 0.00 ATOM 6124 H15S DPP 51 15.350 32.300 49.690 1.00 0.00 ATOM 6125 6C21 DPP 51 15.040 30.580 48.460 1.00 0.00 ATOM 6126 H16R DPP 51 15.550 29.590 48.370 1.00 0.00 ATOM 6127 H16S DPP 51 14.810 31.060 47.490 1.00 0.00 ATOM 6128 H16T DPP 51 14.030 30.380 48.870 1.00 0.00 ATOM 6129 C33 DPP 51 16.320 36.250 58.060 1.00 0.00 ATOM 6130 H3X DPP 51 15.490 36.980 57.960 1.00 0.00 ATOM 6131 H3Y DPP 51 15.780 35.280 58.080 1.00 0.00 ATOM 6132 C34 DPP 51 17.280 36.370 56.880 1.00 0.00 ATOM 6133 H4X DPP 51 18.150 35.710 57.110 1.00 0.00 ATOM 6134 H4Y DPP 51 17.730 37.370 56.680 1.00 0.00 ATOM 6135 C35 DPP 51 16.600 36.010 55.560 1.00 0.00 ATOM 6136 H5X DPP 51 16.190 36.990 55.230 1.00 0.00 ATOM 6137 H5Y DPP 51 15.720 35.370 55.790 1.00 0.00 ATOM 6138 C36 DPP 51 17.510 35.480 54.450 1.00 0.00 ATOM 6139 H6X DPP 51 16.930 35.080 53.590 1.00 0.00 ATOM 6140 H6Y DPP 51 18.160 34.640 54.760 1.00 0.00 ATOM 6141 C37 DPP 51 18.370 36.590 53.840 1.00 0.00 ATOM 6142 H7X DPP 51 18.950 37.150 54.610 1.00 0.00 ATOM 6143 H7Y DPP 51 17.770 37.320 53.260 1.00 0.00 ATOM 6144 C38 DPP 51 19.340 36.060 52.780 1.00 0.00 ATOM 6145 H8X DPP 51 19.960 35.190 53.080 1.00 0.00 ATOM 6146 H8Y DPP 51 20.020 36.900 52.530 1.00 0.00 ATOM 6147 C39 DPP 51 18.630 35.790 51.450 1.00 0.00 ATOM 6148 H9X DPP 51 18.040 36.620 51.000 1.00 0.00 ATOM 6149 H9Y DPP 51 17.840 35.010 51.490 1.00 0.00 ATOM 6150 0C31 DPP 51 19.600 35.340 50.360 1.00 0.00 ATOM 6151 H10X DPP 51 20.100 34.370 50.600 1.00 0.00 ATOM 6152 H10Y DPP 51 20.440 36.070 50.250 1.00 0.00 ATOM 6153 1C31 DPP 51 19.050 35.280 48.940 1.00 0.00 ATOM 6154 H11X DPP 51 18.630 36.260 48.620 1.00 0.00 ATOM 6155 H11Y DPP 51 18.220 34.540 48.910 1.00 0.00 ATOM 6156 2C31 DPP 51 20.210 34.900 48.020 1.00 0.00 ATOM 6157 H12X DPP 51 20.880 34.130 48.450 1.00 0.00 ATOM 6158 H12Y DPP 51 20.740 35.870 47.920 1.00 0.00 ATOM 6159 3C31 DPP 51 19.790 34.520 46.600 1.00 0.00 ATOM 6160 H13X DPP 51 20.760 34.450 46.050 1.00 0.00 ATOM 6161 H13Y DPP 51 19.270 35.320 46.040 1.00 0.00 ATOM 6162 4C31 DPP 51 18.990 33.210 46.580 1.00 0.00 ATOM 6163 H14X DPP 51 17.890 33.390 46.520 1.00 0.00 ATOM 6164 H14Y DPP 51 19.200 32.560 47.450 1.00 0.00 ATOM 6165 5C31 DPP 51 19.320 32.380 45.340 1.00 0.00 ATOM 6166 H15X DPP 51 20.420 32.280 45.270 1.00 0.00 ATOM 6167 H15Y DPP 51 19.010 33.000 44.470 1.00 0.00 ATOM 6168 6C31 DPP 51 18.430 31.130 45.330 1.00 0.00 ATOM 6169 H16X DPP 51 17.370 31.380 45.120 1.00 0.00 ATOM 6170 H16Y DPP 51 18.360 30.570 46.290 1.00 0.00 ATOM 6171 H16Z DPP 51 18.720 30.430 44.520 1.00 0.00 ATOM 6172 N DPP 52 59.560 32.800 61.060 1.00 0.00 ATOM 6173 HN1 DPP 52 60.120 33.310 60.340 1.00 0.00 ATOM 6174 HN2 DPP 52 60.120 31.970 61.330 1.00 0.00 ATOM 6175 HN3 DPP 52 58.620 32.460 60.760 1.00 0.00 ATOM 6176 C12 DPP 52 59.420 33.640 62.310 1.00 0.00 ATOM 6177 H12A DPP 52 58.640 34.390 62.060 1.00 0.00 ATOM 6178 H12B DPP 52 59.050 33.050 63.180 1.00 0.00 ATOM 6179 C11 DPP 52 60.730 34.340 62.660 1.00 0.00 ATOM 6180 H11A DPP 52 61.600 33.660 62.640 1.00 0.00 ATOM 6181 H11B DPP 52 60.700 34.800 63.670 1.00 0.00 ATOM 6182 P DPP 52 61.620 36.600 62.210 1.00 0.00 ATOM 6183 O13 DPP 52 62.770 36.240 63.070 1.00 0.00 ATOM 6184 O14 DPP 52 60.490 37.320 62.840 1.00 0.00 ATOM 6185 O11 DPP 52 62.170 37.450 60.970 1.00 0.00 ATOM 6186 O12 DPP 52 61.000 35.260 61.600 1.00 0.00 ATOM 6187 C1 DPP 52 61.280 38.330 60.270 1.00 0.00 ATOM 6188 HA DPP 52 61.640 39.360 60.470 1.00 0.00 ATOM 6189 HB DPP 52 60.240 38.350 60.680 1.00 0.00 ATOM 6190 C2 DPP 52 61.300 38.170 58.740 1.00 0.00 ATOM 6191 HS DPP 52 60.730 38.990 58.260 1.00 0.00 ATOM 6192 O21 DPP 52 60.550 37.000 58.420 1.00 0.00 ATOM 6193 C21 DPP 52 59.900 37.060 57.250 1.00 0.00 ATOM 6194 O22 DPP 52 59.770 38.030 56.530 1.00 0.00 ATOM 6195 C22 DPP 52 59.360 35.640 57.080 1.00 0.00 ATOM 6196 H2R DPP 52 58.760 35.360 57.970 1.00 0.00 ATOM 6197 H2S DPP 52 60.220 34.940 57.030 1.00 0.00 ATOM 6198 C3 DPP 52 62.680 38.090 58.060 1.00 0.00 ATOM 6199 HX DPP 52 63.120 37.100 58.290 1.00 0.00 ATOM 6200 HY DPP 52 63.400 38.760 58.580 1.00 0.00 ATOM 6201 O31 DPP 52 62.740 38.340 56.660 1.00 0.00 ATOM 6202 C31 DPP 52 62.900 39.620 56.350 1.00 0.00 ATOM 6203 O32 DPP 52 63.080 40.550 57.120 1.00 0.00 ATOM 6204 C32 DPP 52 62.760 39.710 54.830 1.00 0.00 ATOM 6205 H2X DPP 52 62.750 40.790 54.590 1.00 0.00 ATOM 6206 H2Y DPP 52 61.770 39.360 54.500 1.00 0.00 ATOM 6207 C23 DPP 52 58.600 35.370 55.790 1.00 0.00 ATOM 6208 H3R DPP 52 58.350 34.290 55.650 1.00 0.00 ATOM 6209 H3S DPP 52 59.010 35.660 54.800 1.00 0.00 ATOM 6210 C24 DPP 52 57.230 36.050 55.870 1.00 0.00 ATOM 6211 H4R DPP 52 57.400 37.140 55.770 1.00 0.00 ATOM 6212 H4S DPP 52 56.680 35.770 56.790 1.00 0.00 ATOM 6213 C25 DPP 52 56.240 35.780 54.730 1.00 0.00 ATOM 6214 H5R DPP 52 55.280 36.220 55.060 1.00 0.00 ATOM 6215 H5S DPP 52 56.120 34.680 54.580 1.00 0.00 ATOM 6216 C26 DPP 52 56.610 36.360 53.370 1.00 0.00 ATOM 6217 H6R DPP 52 57.530 35.900 52.960 1.00 0.00 ATOM 6218 H6S DPP 52 56.750 37.440 53.580 1.00 0.00 ATOM 6219 C27 DPP 52 55.430 36.190 52.410 1.00 0.00 ATOM 6220 H7R DPP 52 55.580 36.730 51.450 1.00 0.00 ATOM 6221 H7S DPP 52 54.510 36.490 52.960 1.00 0.00 ATOM 6222 C28 DPP 52 55.080 34.740 52.070 1.00 0.00 ATOM 6223 H8R DPP 52 54.460 34.330 52.890 1.00 0.00 ATOM 6224 H8S DPP 52 56.020 34.140 51.980 1.00 0.00 ATOM 6225 C29 DPP 52 54.120 34.490 50.910 1.00 0.00 ATOM 6226 H9R DPP 52 54.530 35.100 50.080 1.00 0.00 ATOM 6227 H9S DPP 52 53.120 34.890 51.210 1.00 0.00 ATOM 6228 0C21 DPP 52 54.040 33.020 50.490 1.00 0.00 ATOM 6229 H10R DPP 52 53.630 32.330 51.270 1.00 0.00 ATOM 6230 H10S DPP 52 55.010 32.560 50.210 1.00 0.00 ATOM 6231 1C21 DPP 52 53.250 32.960 49.190 1.00 0.00 ATOM 6232 H11R DPP 52 53.610 33.620 48.370 1.00 0.00 ATOM 6233 H11S DPP 52 52.360 33.500 49.580 1.00 0.00 ATOM 6234 2C21 DPP 52 52.990 31.500 48.780 1.00 0.00 ATOM 6235 H12R DPP 52 52.880 30.950 49.730 1.00 0.00 ATOM 6236 H12S DPP 52 53.780 30.890 48.300 1.00 0.00 ATOM 6237 3C21 DPP 52 51.740 31.390 47.900 1.00 0.00 ATOM 6238 H13R DPP 52 51.020 32.230 48.010 1.00 0.00 ATOM 6239 H13S DPP 52 51.170 30.550 48.340 1.00 0.00 ATOM 6240 4C21 DPP 52 52.140 31.080 46.450 1.00 0.00 ATOM 6241 H14R DPP 52 51.330 30.500 45.960 1.00 0.00 ATOM 6242 H14S DPP 52 53.170 30.710 46.260 1.00 0.00 ATOM 6243 5C21 DPP 52 52.110 32.350 45.600 1.00 0.00 ATOM 6244 H15R DPP 52 52.620 33.190 46.110 1.00 0.00 ATOM 6245 H15S DPP 52 51.030 32.590 45.530 1.00 0.00 ATOM 6246 6C21 DPP 52 52.680 32.210 44.190 1.00 0.00 ATOM 6247 H16R DPP 52 51.970 31.510 43.690 1.00 0.00 ATOM 6248 H16S DPP 52 53.650 31.680 44.160 1.00 0.00 ATOM 6249 H16T DPP 52 52.580 33.150 43.600 1.00 0.00 ATOM 6250 C33 DPP 52 63.890 39.140 53.970 1.00 0.00 ATOM 6251 H3X DPP 52 63.720 38.040 53.970 1.00 0.00 ATOM 6252 H3Y DPP 52 64.810 39.350 54.560 1.00 0.00 ATOM 6253 C34 DPP 52 63.850 39.600 52.510 1.00 0.00 ATOM 6254 H4X DPP 52 63.860 40.710 52.540 1.00 0.00 ATOM 6255 H4Y DPP 52 62.900 39.150 52.170 1.00 0.00 ATOM 6256 C35 DPP 52 65.150 39.260 51.780 1.00 0.00 ATOM 6257 H5X DPP 52 65.070 38.160 51.610 1.00 0.00 ATOM 6258 H5Y DPP 52 66.030 39.600 52.370 1.00 0.00 ATOM 6259 C36 DPP 52 65.280 40.020 50.460 1.00 0.00 ATOM 6260 H6X DPP 52 65.300 41.120 50.560 1.00 0.00 ATOM 6261 H6Y DPP 52 64.430 39.740 49.790 1.00 0.00 ATOM 6262 C37 DPP 52 66.470 39.640 49.570 1.00 0.00 ATOM 6263 H7X DPP 52 66.980 38.650 49.550 1.00 0.00 ATOM 6264 H7Y DPP 52 67.230 40.390 49.880 1.00 0.00 ATOM 6265 C38 DPP 52 65.980 40.030 48.180 1.00 0.00 ATOM 6266 H8X DPP 52 65.200 40.820 48.160 1.00 0.00 ATOM 6267 H8Y DPP 52 66.900 40.330 47.630 1.00 0.00 ATOM 6268 C39 DPP 52 65.530 38.820 47.360 1.00 0.00 ATOM 6269 H9X DPP 52 64.690 38.390 47.940 1.00 0.00 ATOM 6270 H9Y DPP 52 66.400 38.140 47.240 1.00 0.00 ATOM 6271 0C31 DPP 52 64.930 39.060 45.970 1.00 0.00 ATOM 6272 H10X DPP 52 65.670 39.630 45.380 1.00 0.00 ATOM 6273 H10Y DPP 52 63.940 39.540 46.140 1.00 0.00 ATOM 6274 1C31 DPP 52 64.550 37.800 45.190 1.00 0.00 ATOM 6275 H11X DPP 52 65.350 37.540 44.470 1.00 0.00 ATOM 6276 H11Y DPP 52 63.690 38.140 44.570 1.00 0.00 ATOM 6277 2C31 DPP 52 64.180 36.590 46.050 1.00 0.00 ATOM 6278 H12X DPP 52 63.380 36.740 46.810 1.00 0.00 ATOM 6279 H12Y DPP 52 65.060 36.130 46.550 1.00 0.00 ATOM 6280 3C31 DPP 52 63.520 35.460 45.270 1.00 0.00 ATOM 6281 H13X DPP 52 63.320 34.660 46.020 1.00 0.00 ATOM 6282 H13Y DPP 52 64.230 34.900 44.620 1.00 0.00 ATOM 6283 4C31 DPP 52 62.290 35.600 44.380 1.00 0.00 ATOM 6284 H14X DPP 52 62.460 36.260 43.500 1.00 0.00 ATOM 6285 H14Y DPP 52 61.420 36.010 44.950 1.00 0.00 ATOM 6286 5C31 DPP 52 61.810 34.220 43.930 1.00 0.00 ATOM 6287 H15X DPP 52 62.540 33.560 43.410 1.00 0.00 ATOM 6288 H15Y DPP 52 61.660 33.570 44.820 1.00 0.00 ATOM 6289 6C31 DPP 52 60.630 34.230 42.950 1.00 0.00 ATOM 6290 H16X DPP 52 60.630 34.800 42.000 1.00 0.00 ATOM 6291 H16Y DPP 52 59.800 34.660 43.550 1.00 0.00 ATOM 6292 H16Z DPP 52 60.570 33.170 42.640 1.00 0.00 ATOM 6293 N DPP 53 20.770 21.100 62.310 1.00 0.00 ATOM 6294 HN1 DPP 53 21.720 21.020 61.910 1.00 0.00 ATOM 6295 HN2 DPP 53 20.090 20.890 61.560 1.00 0.00 ATOM 6296 HN3 DPP 53 20.630 22.110 62.500 1.00 0.00 ATOM 6297 C12 DPP 53 20.730 20.260 63.570 1.00 0.00 ATOM 6298 H12A DPP 53 21.430 20.690 64.320 1.00 0.00 ATOM 6299 H12B DPP 53 19.750 20.590 63.970 1.00 0.00 ATOM 6300 C11 DPP 53 20.880 18.740 63.490 1.00 0.00 ATOM 6301 H11A DPP 53 20.510 18.430 64.500 1.00 0.00 ATOM 6302 H11B DPP 53 21.930 18.440 63.330 1.00 0.00 ATOM 6303 P DPP 53 18.520 17.940 62.770 1.00 0.00 ATOM 6304 O13 DPP 53 17.900 19.050 63.530 1.00 0.00 ATOM 6305 O14 DPP 53 18.420 16.600 63.390 1.00 0.00 ATOM 6306 O11 DPP 53 17.890 17.900 61.310 1.00 0.00 ATOM 6307 O12 DPP 53 20.060 18.230 62.430 1.00 0.00 ATOM 6308 C1 DPP 53 18.600 17.310 60.220 1.00 0.00 ATOM 6309 HA DPP 53 17.870 16.790 59.560 1.00 0.00 ATOM 6310 HB DPP 53 19.230 16.470 60.580 1.00 0.00 ATOM 6311 C2 DPP 53 19.370 18.420 59.490 1.00 0.00 ATOM 6312 HS DPP 53 20.030 18.870 60.260 1.00 0.00 ATOM 6313 O21 DPP 53 18.380 19.220 58.840 1.00 0.00 ATOM 6314 C21 DPP 53 18.370 20.470 59.300 1.00 0.00 ATOM 6315 O22 DPP 53 19.060 20.850 60.230 1.00 0.00 ATOM 6316 C22 DPP 53 17.380 21.410 58.630 1.00 0.00 ATOM 6317 H2R DPP 53 16.980 20.950 57.700 1.00 0.00 ATOM 6318 H2S DPP 53 17.910 22.330 58.310 1.00 0.00 ATOM 6319 C3 DPP 53 20.240 17.790 58.390 1.00 0.00 ATOM 6320 HX DPP 53 21.130 17.260 58.790 1.00 0.00 ATOM 6321 HY DPP 53 20.690 18.650 57.840 1.00 0.00 ATOM 6322 O31 DPP 53 19.520 16.960 57.470 1.00 0.00 ATOM 6323 C31 DPP 53 20.260 16.140 56.720 1.00 0.00 ATOM 6324 O32 DPP 53 21.470 16.110 56.580 1.00 0.00 ATOM 6325 C32 DPP 53 19.250 15.300 55.950 1.00 0.00 ATOM 6326 H2X DPP 53 18.220 15.570 56.280 1.00 0.00 ATOM 6327 H2Y DPP 53 19.510 14.270 56.260 1.00 0.00 ATOM 6328 C23 DPP 53 16.350 21.750 59.700 1.00 0.00 ATOM 6329 H3R DPP 53 16.800 22.280 60.570 1.00 0.00 ATOM 6330 H3S DPP 53 15.870 20.780 59.970 1.00 0.00 ATOM 6331 C24 DPP 53 15.160 22.580 59.210 1.00 0.00 ATOM 6332 H4R DPP 53 15.520 23.420 58.590 1.00 0.00 ATOM 6333 H4S DPP 53 14.550 22.980 60.050 1.00 0.00 ATOM 6334 C25 DPP 53 14.160 21.870 58.300 1.00 0.00 ATOM 6335 H5R DPP 53 13.680 21.040 58.850 1.00 0.00 ATOM 6336 H5S DPP 53 14.630 21.510 57.360 1.00 0.00 ATOM 6337 C26 DPP 53 13.050 22.880 57.990 1.00 0.00 ATOM 6338 H6R DPP 53 13.410 23.890 57.690 1.00 0.00 ATOM 6339 H6S DPP 53 12.430 23.010 58.910 1.00 0.00 ATOM 6340 C27 DPP 53 12.040 22.600 56.880 1.00 0.00 ATOM 6341 H7R DPP 53 11.230 23.360 56.940 1.00 0.00 ATOM 6342 H7S DPP 53 11.640 21.570 57.020 1.00 0.00 ATOM 6343 C28 DPP 53 12.870 22.700 55.600 1.00 0.00 ATOM 6344 H8R DPP 53 13.750 22.020 55.550 1.00 0.00 ATOM 6345 H8S DPP 53 13.310 23.720 55.570 1.00 0.00 ATOM 6346 C29 DPP 53 12.040 22.340 54.360 1.00 0.00 ATOM 6347 H9R DPP 53 11.260 23.130 54.320 1.00 0.00 ATOM 6348 H9S DPP 53 11.510 21.370 54.490 1.00 0.00 ATOM 6349 0C21 DPP 53 12.860 22.210 53.090 1.00 0.00 ATOM 6350 H10R DPP 53 13.860 21.810 53.370 1.00 0.00 ATOM 6351 H10S DPP 53 13.140 23.120 52.510 1.00 0.00 ATOM 6352 1C21 DPP 53 12.200 21.240 52.120 1.00 0.00 ATOM 6353 H11R DPP 53 11.180 21.630 51.950 1.00 0.00 ATOM 6354 H11S DPP 53 12.050 20.300 52.690 1.00 0.00 ATOM 6355 2C21 DPP 53 12.790 21.010 50.720 1.00 0.00 ATOM 6356 H12R DPP 53 12.030 20.610 50.010 1.00 0.00 ATOM 6357 H12S DPP 53 13.740 20.480 50.920 1.00 0.00 ATOM 6358 3C21 DPP 53 13.220 22.280 49.980 1.00 0.00 ATOM 6359 H13R DPP 53 14.200 22.590 50.380 1.00 0.00 ATOM 6360 H13S DPP 53 12.490 23.110 50.110 1.00 0.00 ATOM 6361 4C21 DPP 53 13.450 22.000 48.490 1.00 0.00 ATOM 6362 H14R DPP 53 12.470 21.850 47.990 1.00 0.00 ATOM 6363 H14S DPP 53 14.020 21.070 48.300 1.00 0.00 ATOM 6364 5C21 DPP 53 14.180 23.160 47.820 1.00 0.00 ATOM 6365 H15R DPP 53 14.030 24.110 48.370 1.00 0.00 ATOM 6366 H15S DPP 53 13.730 23.290 46.810 1.00 0.00 ATOM 6367 6C21 DPP 53 15.660 22.810 47.630 1.00 0.00 ATOM 6368 H16R DPP 53 16.130 22.590 48.610 1.00 0.00 ATOM 6369 H16S DPP 53 16.240 23.680 47.260 1.00 0.00 ATOM 6370 H16T DPP 53 15.790 21.940 46.950 1.00 0.00 ATOM 6371 C33 DPP 53 19.430 15.600 54.460 1.00 0.00 ATOM 6372 H3X DPP 53 20.490 15.550 54.110 1.00 0.00 ATOM 6373 H3Y DPP 53 19.100 16.650 54.270 1.00 0.00 ATOM 6374 C34 DPP 53 18.640 14.700 53.510 1.00 0.00 ATOM 6375 H4X DPP 53 17.590 14.660 53.890 1.00 0.00 ATOM 6376 H4Y DPP 53 19.120 13.730 53.780 1.00 0.00 ATOM 6377 C35 DPP 53 18.740 15.050 52.030 1.00 0.00 ATOM 6378 H5X DPP 53 18.180 14.120 51.800 1.00 0.00 ATOM 6379 H5Y DPP 53 19.770 15.080 51.620 1.00 0.00 ATOM 6380 C36 DPP 53 17.960 16.250 51.490 1.00 0.00 ATOM 6381 H6X DPP 53 18.350 17.260 51.720 1.00 0.00 ATOM 6382 H6Y DPP 53 16.930 16.290 51.900 1.00 0.00 ATOM 6383 C37 DPP 53 17.910 16.330 49.970 1.00 0.00 ATOM 6384 H7X DPP 53 17.810 15.360 49.430 1.00 0.00 ATOM 6385 H7Y DPP 53 18.840 16.790 49.560 1.00 0.00 ATOM 6386 C38 DPP 53 16.800 17.290 49.550 1.00 0.00 ATOM 6387 H8X DPP 53 17.110 18.310 49.850 1.00 0.00 ATOM 6388 H8Y DPP 53 15.820 17.080 50.040 1.00 0.00 ATOM 6389 C39 DPP 53 16.550 17.300 48.040 1.00 0.00 ATOM 6390 H9X DPP 53 16.300 16.230 47.890 1.00 0.00 ATOM 6391 H9Y DPP 53 17.510 17.430 47.500 1.00 0.00 ATOM 6392 0C31 DPP 53 15.330 18.130 47.620 1.00 0.00 ATOM 6393 H10X DPP 53 15.540 19.170 47.940 1.00 0.00 ATOM 6394 H10Y DPP 53 14.400 17.650 47.980 1.00 0.00 ATOM 6395 1C31 DPP 53 15.120 18.080 46.100 1.00 0.00 ATOM 6396 H11X DPP 53 14.930 16.990 46.040 1.00 0.00 ATOM 6397 H11Y DPP 53 16.000 18.490 45.550 1.00 0.00 ATOM 6398 2C31 DPP 53 13.890 18.770 45.500 1.00 0.00 ATOM 6399 H12X DPP 53 12.970 18.580 46.090 1.00 0.00 ATOM 6400 H12Y DPP 53 13.710 18.240 44.540 1.00 0.00 ATOM 6401 3C31 DPP 53 14.170 20.260 45.290 1.00 0.00 ATOM 6402 H13X DPP 53 15.130 20.320 44.740 1.00 0.00 ATOM 6403 H13Y DPP 53 14.340 20.650 46.310 1.00 0.00 ATOM 6404 4C31 DPP 53 13.080 20.910 44.430 1.00 0.00 ATOM 6405 H14X DPP 53 12.100 21.010 44.940 1.00 0.00 ATOM 6406 H14Y DPP 53 12.930 20.260 43.550 1.00 0.00 ATOM 6407 5C31 DPP 53 13.590 22.280 43.990 1.00 0.00 ATOM 6408 H15X DPP 53 13.880 22.080 42.930 1.00 0.00 ATOM 6409 H15Y DPP 53 14.460 22.700 44.540 1.00 0.00 ATOM 6410 6C31 DPP 53 12.640 23.470 43.940 1.00 0.00 ATOM 6411 H16X DPP 53 12.680 23.880 44.970 1.00 0.00 ATOM 6412 H16Y DPP 53 11.560 23.210 43.870 1.00 0.00 ATOM 6413 H16Z DPP 53 12.940 24.220 43.170 1.00 0.00 ATOM 6414 N DPP 54 4.160 16.430 63.870 1.00 0.00 ATOM 6415 HN1 DPP 54 4.560 17.190 64.470 1.00 0.00 ATOM 6416 HN2 DPP 54 3.560 16.980 63.230 1.00 0.00 ATOM 6417 HN3 DPP 54 3.500 15.800 64.360 1.00 0.00 ATOM 6418 C12 DPP 54 5.150 15.570 63.120 1.00 0.00 ATOM 6419 H12A DPP 54 5.730 15.100 63.940 1.00 0.00 ATOM 6420 H12B DPP 54 4.520 14.840 62.570 1.00 0.00 ATOM 6421 C11 DPP 54 6.010 16.300 62.090 1.00 0.00 ATOM 6422 H11A DPP 54 5.320 16.640 61.300 1.00 0.00 ATOM 6423 H11B DPP 54 6.660 15.500 61.670 1.00 0.00 ATOM 6424 P DPP 54 8.090 17.240 63.480 1.00 0.00 ATOM 6425 O13 DPP 54 7.920 16.700 64.850 1.00 0.00 ATOM 6426 O14 DPP 54 8.760 18.550 63.380 1.00 0.00 ATOM 6427 O11 DPP 54 8.880 16.110 62.660 1.00 0.00 ATOM 6428 O12 DPP 54 6.710 17.390 62.690 1.00 0.00 ATOM 6429 C1 DPP 54 10.270 15.990 62.980 1.00 0.00 ATOM 6430 HA DPP 54 10.430 14.980 63.400 1.00 0.00 ATOM 6431 HB DPP 54 10.510 16.750 63.760 1.00 0.00 ATOM 6432 C2 DPP 54 11.220 16.330 61.820 1.00 0.00 ATOM 6433 HS DPP 54 12.030 16.980 62.200 1.00 0.00 ATOM 6434 O21 DPP 54 10.430 17.080 60.890 1.00 0.00 ATOM 6435 C21 DPP 54 10.920 18.050 60.120 1.00 0.00 ATOM 6436 O22 DPP 54 12.040 18.490 60.300 1.00 0.00 ATOM 6437 C22 DPP 54 9.730 18.650 59.370 1.00 0.00 ATOM 6438 H2R DPP 54 9.930 19.730 59.260 1.00 0.00 ATOM 6439 H2S DPP 54 8.830 18.540 60.010 1.00 0.00 ATOM 6440 C3 DPP 54 11.750 15.070 61.110 1.00 0.00 ATOM 6441 HX DPP 54 10.890 14.390 60.950 1.00 0.00 ATOM 6442 HY DPP 54 12.440 14.510 61.780 1.00 0.00 ATOM 6443 O31 DPP 54 12.420 15.200 59.850 1.00 0.00 ATOM 6444 C31 DPP 54 13.630 15.760 59.910 1.00 0.00 ATOM 6445 O32 DPP 54 14.240 16.110 60.910 1.00 0.00 ATOM 6446 C32 DPP 54 13.820 16.220 58.470 1.00 0.00 ATOM 6447 H2X DPP 54 14.090 15.370 57.810 1.00 0.00 ATOM 6448 H2Y DPP 54 12.920 16.690 58.010 1.00 0.00 ATOM 6449 C23 DPP 54 9.590 18.090 57.950 1.00 0.00 ATOM 6450 H3R DPP 54 8.580 18.400 57.600 1.00 0.00 ATOM 6451 H3S DPP 54 9.680 16.980 57.900 1.00 0.00 ATOM 6452 C24 DPP 54 10.640 18.760 57.070 1.00 0.00 ATOM 6453 H4R DPP 54 11.670 18.680 57.470 1.00 0.00 ATOM 6454 H4S DPP 54 10.470 19.850 56.940 1.00 0.00 ATOM 6455 C25 DPP 54 10.570 18.260 55.630 1.00 0.00 ATOM 6456 H5R DPP 54 10.920 17.210 55.530 1.00 0.00 ATOM 6457 H5S DPP 54 11.400 18.800 55.130 1.00 0.00 ATOM 6458 C26 DPP 54 9.280 18.470 54.830 1.00 0.00 ATOM 6459 H6R DPP 54 8.930 19.520 54.810 1.00 0.00 ATOM 6460 H6S DPP 54 8.540 17.880 55.420 1.00 0.00 ATOM 6461 C27 DPP 54 9.400 17.990 53.380 1.00 0.00 ATOM 6462 H7R DPP 54 9.760 16.940 53.320 1.00 0.00 ATOM 6463 H7S DPP 54 10.010 18.670 52.750 1.00 0.00 ATOM 6464 C28 DPP 54 8.020 18.170 52.740 1.00 0.00 ATOM 6465 H8R DPP 54 7.750 19.250 52.720 1.00 0.00 ATOM 6466 H8S DPP 54 7.260 17.650 53.350 1.00 0.00 ATOM 6467 C29 DPP 54 7.850 17.530 51.360 1.00 0.00 ATOM 6468 H9R DPP 54 6.790 17.530 51.030 1.00 0.00 ATOM 6469 H9S DPP 54 8.070 16.450 51.470 1.00 0.00 ATOM 6470 0C21 DPP 54 8.760 18.020 50.220 1.00 0.00 ATOM 6471 H10R DPP 54 9.810 17.680 50.300 1.00 0.00 ATOM 6472 H10S DPP 54 8.800 19.130 50.290 1.00 0.00 ATOM 6473 1C21 DPP 54 8.120 17.470 48.940 1.00 0.00 ATOM 6474 H11R DPP 54 7.020 17.660 48.930 1.00 0.00 ATOM 6475 H11S DPP 54 8.270 16.380 48.830 1.00 0.00 ATOM 6476 2C21 DPP 54 8.820 18.190 47.780 1.00 0.00 ATOM 6477 H12R DPP 54 9.880 17.890 47.660 1.00 0.00 ATOM 6478 H12S DPP 54 8.840 19.300 47.880 1.00 0.00 ATOM 6479 3C21 DPP 54 8.240 17.800 46.420 1.00 0.00 ATOM 6480 H13R DPP 54 7.130 17.860 46.370 1.00 0.00 ATOM 6481 H13S DPP 54 8.560 16.750 46.310 1.00 0.00 ATOM 6482 4C21 DPP 54 9.000 18.500 45.290 1.00 0.00 ATOM 6483 H14R DPP 54 10.080 18.250 45.350 1.00 0.00 ATOM 6484 H14S DPP 54 8.930 19.590 45.490 1.00 0.00 ATOM 6485 5C21 DPP 54 8.440 18.100 43.920 1.00 0.00 ATOM 6486 H15R DPP 54 7.500 18.680 43.780 1.00 0.00 ATOM 6487 H15S DPP 54 8.310 17.000 43.860 1.00 0.00 ATOM 6488 6C21 DPP 54 9.400 18.610 42.840 1.00 0.00 ATOM 6489 H16R DPP 54 10.470 18.340 42.910 1.00 0.00 ATOM 6490 H16S DPP 54 9.360 19.710 42.930 1.00 0.00 ATOM 6491 H16T DPP 54 8.980 18.450 41.810 1.00 0.00 ATOM 6492 C33 DPP 54 14.870 17.330 58.420 1.00 0.00 ATOM 6493 H3X DPP 54 15.580 17.140 59.260 1.00 0.00 ATOM 6494 H3Y DPP 54 14.350 18.300 58.550 1.00 0.00 ATOM 6495 C34 DPP 54 15.590 17.250 57.070 1.00 0.00 ATOM 6496 H4X DPP 54 16.060 16.240 57.070 1.00 0.00 ATOM 6497 H4Y DPP 54 16.390 18.020 57.050 1.00 0.00 ATOM 6498 C35 DPP 54 14.590 17.510 55.950 1.00 0.00 ATOM 6499 H5X DPP 54 14.040 18.470 56.000 1.00 0.00 ATOM 6500 H5Y DPP 54 13.870 16.670 55.900 1.00 0.00 ATOM 6501 C36 DPP 54 15.290 17.640 54.590 1.00 0.00 ATOM 6502 H6X DPP 54 15.890 16.710 54.440 1.00 0.00 ATOM 6503 H6Y DPP 54 16.010 18.440 54.870 1.00 0.00 ATOM 6504 C37 DPP 54 14.330 17.930 53.430 1.00 0.00 ATOM 6505 H7X DPP 54 14.910 18.280 52.550 1.00 0.00 ATOM 6506 H7Y DPP 54 13.620 18.690 53.810 1.00 0.00 ATOM 6507 C38 DPP 54 13.510 16.690 53.070 1.00 0.00 ATOM 6508 H8X DPP 54 12.760 16.490 53.870 1.00 0.00 ATOM 6509 H8Y DPP 54 14.030 15.720 52.950 1.00 0.00 ATOM 6510 C39 DPP 54 12.810 16.940 51.730 1.00 0.00 ATOM 6511 H9X DPP 54 13.560 17.210 50.970 1.00 0.00 ATOM 6512 H9Y DPP 54 12.050 17.730 51.940 1.00 0.00 ATOM 6513 0C31 DPP 54 12.000 15.710 51.310 1.00 0.00 ATOM 6514 H10X DPP 54 11.120 15.880 50.650 1.00 0.00 ATOM 6515 H10Y DPP 54 11.730 15.150 52.230 1.00 0.00 ATOM 6516 1C31 DPP 54 13.000 14.780 50.610 1.00 0.00 ATOM 6517 H11X DPP 54 13.730 14.230 51.240 1.00 0.00 ATOM 6518 H11Y DPP 54 13.360 15.500 49.850 1.00 0.00 ATOM 6519 2C31 DPP 54 12.250 13.700 49.830 1.00 0.00 ATOM 6520 H12X DPP 54 11.450 14.060 49.140 1.00 0.00 ATOM 6521 H12Y DPP 54 11.880 12.900 50.500 1.00 0.00 ATOM 6522 3C31 DPP 54 13.320 12.900 49.100 1.00 0.00 ATOM 6523 H13X DPP 54 12.870 12.030 48.580 1.00 0.00 ATOM 6524 H13Y DPP 54 14.110 12.490 49.770 1.00 0.00 ATOM 6525 4C31 DPP 54 13.950 13.720 47.970 1.00 0.00 ATOM 6526 H14X DPP 54 14.630 14.520 48.340 1.00 0.00 ATOM 6527 H14Y DPP 54 13.110 14.090 47.360 1.00 0.00 ATOM 6528 5C31 DPP 54 14.840 12.870 47.060 1.00 0.00 ATOM 6529 H15X DPP 54 15.240 13.710 46.450 1.00 0.00 ATOM 6530 H15Y DPP 54 14.300 12.230 46.340 1.00 0.00 ATOM 6531 6C31 DPP 54 15.910 12.070 47.800 1.00 0.00 ATOM 6532 H16X DPP 54 16.260 12.580 48.730 1.00 0.00 ATOM 6533 H16Y DPP 54 16.810 11.860 47.190 1.00 0.00 ATOM 6534 H16Z DPP 54 15.400 11.180 48.210 1.00 0.00 ATOM 6535 N DPP 55 26.700 53.720 62.720 1.00 0.00 ATOM 6536 HN1 DPP 55 26.710 54.700 62.370 1.00 0.00 ATOM 6537 HN2 DPP 55 26.160 53.670 63.600 1.00 0.00 ATOM 6538 HN3 DPP 55 27.680 53.480 62.960 1.00 0.00 ATOM 6539 C12 DPP 55 26.290 52.960 61.480 1.00 0.00 ATOM 6540 H12A DPP 55 27.040 53.050 60.670 1.00 0.00 ATOM 6541 H12B DPP 55 25.430 53.510 61.050 1.00 0.00 ATOM 6542 C11 DPP 55 26.020 51.470 61.750 1.00 0.00 ATOM 6543 H11A DPP 55 25.900 51.000 60.750 1.00 0.00 ATOM 6544 H11B DPP 55 25.070 51.350 62.310 1.00 0.00 ATOM 6545 P DPP 55 27.000 49.390 62.800 1.00 0.00 ATOM 6546 O13 DPP 55 25.680 49.080 63.400 1.00 0.00 ATOM 6547 O14 DPP 55 28.240 48.980 63.500 1.00 0.00 ATOM 6548 O11 DPP 55 27.100 48.880 61.290 1.00 0.00 ATOM 6549 O12 DPP 55 27.120 50.960 62.510 1.00 0.00 ATOM 6550 C1 DPP 55 27.100 47.460 61.160 1.00 0.00 ATOM 6551 HA DPP 55 26.490 47.250 60.260 1.00 0.00 ATOM 6552 HB DPP 55 26.550 46.930 61.970 1.00 0.00 ATOM 6553 C2 DPP 55 28.500 46.820 61.080 1.00 0.00 ATOM 6554 HS DPP 55 28.740 46.890 62.160 1.00 0.00 ATOM 6555 O21 DPP 55 29.380 47.640 60.310 1.00 0.00 ATOM 6556 C21 DPP 55 30.640 47.410 60.680 1.00 0.00 ATOM 6557 O22 DPP 55 31.030 46.940 61.740 1.00 0.00 ATOM 6558 C22 DPP 55 31.520 48.000 59.590 1.00 0.00 ATOM 6559 H2R DPP 55 31.080 48.950 59.220 1.00 0.00 ATOM 6560 H2S DPP 55 31.460 47.270 58.760 1.00 0.00 ATOM 6561 C3 DPP 55 28.490 45.400 60.480 1.00 0.00 ATOM 6562 HX DPP 55 27.700 44.840 61.000 1.00 0.00 ATOM 6563 HY DPP 55 29.470 44.900 60.640 1.00 0.00 ATOM 6564 O31 DPP 55 28.040 45.400 59.120 1.00 0.00 ATOM 6565 C31 DPP 55 28.980 45.020 58.240 1.00 0.00 ATOM 6566 O32 DPP 55 30.160 44.790 58.460 1.00 0.00 ATOM 6567 C32 DPP 55 28.320 44.970 56.870 1.00 0.00 ATOM 6568 H2X DPP 55 28.240 46.060 56.640 1.00 0.00 ATOM 6569 H2Y DPP 55 27.320 44.490 56.760 1.00 0.00 ATOM 6570 C23 DPP 55 32.980 48.190 60.030 1.00 0.00 ATOM 6571 H3R DPP 55 33.160 47.380 60.770 1.00 0.00 ATOM 6572 H3S DPP 55 33.020 49.230 60.410 1.00 0.00 ATOM 6573 C24 DPP 55 33.870 47.840 58.840 1.00 0.00 ATOM 6574 H4R DPP 55 33.490 48.400 57.950 1.00 0.00 ATOM 6575 H4S DPP 55 33.790 46.740 58.670 1.00 0.00 ATOM 6576 C25 DPP 55 35.370 48.130 58.890 1.00 0.00 ATOM 6577 H5R DPP 55 35.780 47.440 59.660 1.00 0.00 ATOM 6578 H5S DPP 55 35.630 49.160 59.220 1.00 0.00 ATOM 6579 C26 DPP 55 36.190 47.860 57.630 1.00 0.00 ATOM 6580 H6R DPP 55 36.000 46.810 57.290 1.00 0.00 ATOM 6581 H6S DPP 55 37.290 47.980 57.670 1.00 0.00 ATOM 6582 C27 DPP 55 35.890 48.660 56.360 1.00 0.00 ATOM 6583 H7R DPP 55 36.200 49.710 56.530 1.00 0.00 ATOM 6584 H7S DPP 55 34.860 48.850 56.000 1.00 0.00 ATOM 6585 C28 DPP 55 36.760 48.220 55.190 1.00 0.00 ATOM 6586 H8R DPP 55 36.450 47.320 54.630 1.00 0.00 ATOM 6587 H8S DPP 55 37.770 48.000 55.600 1.00 0.00 ATOM 6588 C29 DPP 55 36.870 49.340 54.150 1.00 0.00 ATOM 6589 H9R DPP 55 37.250 50.290 54.600 1.00 0.00 ATOM 6590 H9S DPP 55 35.860 49.420 53.700 1.00 0.00 ATOM 6591 0C21 DPP 55 37.850 49.070 53.010 1.00 0.00 ATOM 6592 H10R DPP 55 38.830 48.640 53.290 1.00 0.00 ATOM 6593 H10S DPP 55 37.890 50.090 52.570 1.00 0.00 ATOM 6594 1C21 DPP 55 37.370 48.330 51.760 1.00 0.00 ATOM 6595 H11R DPP 55 36.880 47.370 52.010 1.00 0.00 ATOM 6596 H11S DPP 55 38.210 48.140 51.060 1.00 0.00 ATOM 6597 2C21 DPP 55 36.170 48.910 50.990 1.00 0.00 ATOM 6598 H12R DPP 55 36.270 50.010 50.910 1.00 0.00 ATOM 6599 H12S DPP 55 35.280 48.860 51.650 1.00 0.00 ATOM 6600 3C21 DPP 55 35.890 48.350 49.590 1.00 0.00 ATOM 6601 H13R DPP 55 35.240 49.060 49.030 1.00 0.00 ATOM 6602 H13S DPP 55 35.260 47.460 49.750 1.00 0.00 ATOM 6603 4C21 DPP 55 37.060 47.880 48.730 1.00 0.00 ATOM 6604 H14R DPP 55 37.560 47.010 49.210 1.00 0.00 ATOM 6605 H14S DPP 55 37.760 48.730 48.610 1.00 0.00 ATOM 6606 5C21 DPP 55 36.570 47.530 47.320 1.00 0.00 ATOM 6607 H15R DPP 55 37.200 46.710 46.910 1.00 0.00 ATOM 6608 H15S DPP 55 35.510 47.230 47.430 1.00 0.00 ATOM 6609 6C21 DPP 55 36.790 48.700 46.360 1.00 0.00 ATOM 6610 H16R DPP 55 36.270 48.410 45.430 1.00 0.00 ATOM 6611 H16S DPP 55 37.840 49.060 46.290 1.00 0.00 ATOM 6612 H16T DPP 55 36.210 49.620 46.590 1.00 0.00 ATOM 6613 C33 DPP 55 29.260 44.290 55.880 1.00 0.00 ATOM 6614 H3X DPP 55 29.290 43.190 56.070 1.00 0.00 ATOM 6615 H3Y DPP 55 30.280 44.700 56.020 1.00 0.00 ATOM 6616 C34 DPP 55 28.900 44.520 54.410 1.00 0.00 ATOM 6617 H4X DPP 55 28.310 45.460 54.390 1.00 0.00 ATOM 6618 H4Y DPP 55 28.120 43.790 54.100 1.00 0.00 ATOM 6619 C35 DPP 55 30.140 44.490 53.510 1.00 0.00 ATOM 6620 H5X DPP 55 30.110 43.400 53.320 1.00 0.00 ATOM 6621 H5Y DPP 55 31.060 44.810 54.040 1.00 0.00 ATOM 6622 C36 DPP 55 29.840 45.170 52.170 1.00 0.00 ATOM 6623 H6X DPP 55 28.730 45.170 52.090 1.00 0.00 ATOM 6624 H6Y DPP 55 30.180 44.520 51.340 1.00 0.00 ATOM 6625 C37 DPP 55 30.270 46.630 52.070 1.00 0.00 ATOM 6626 H7X DPP 55 31.340 46.860 52.280 1.00 0.00 ATOM 6627 H7Y DPP 55 29.560 47.130 52.760 1.00 0.00 ATOM 6628 C38 DPP 55 29.880 47.220 50.710 1.00 0.00 ATOM 6629 H8X DPP 55 29.670 48.310 50.650 1.00 0.00 ATOM 6630 H8Y DPP 55 28.990 46.650 50.370 1.00 0.00 ATOM 6631 C39 DPP 55 30.940 46.800 49.680 1.00 0.00 ATOM 6632 H9X DPP 55 31.290 45.750 49.770 1.00 0.00 ATOM 6633 H9Y DPP 55 31.860 47.410 49.770 1.00 0.00 ATOM 6634 0C31 DPP 55 30.440 46.920 48.240 1.00 0.00 ATOM 6635 H10X DPP 55 30.030 47.950 48.110 1.00 0.00 ATOM 6636 H10Y DPP 55 29.610 46.190 48.140 1.00 0.00 ATOM 6637 1C31 DPP 55 31.460 46.720 47.120 1.00 0.00 ATOM 6638 H11X DPP 55 31.360 45.660 46.810 1.00 0.00 ATOM 6639 H11Y DPP 55 32.450 47.080 47.490 1.00 0.00 ATOM 6640 2C31 DPP 55 31.190 47.650 45.930 1.00 0.00 ATOM 6641 H12X DPP 55 31.200 48.650 46.420 1.00 0.00 ATOM 6642 H12Y DPP 55 30.210 47.290 45.550 1.00 0.00 ATOM 6643 3C31 DPP 55 32.290 47.830 44.880 1.00 0.00 ATOM 6644 H13X DPP 55 33.240 48.290 45.220 1.00 0.00 ATOM 6645 H13Y DPP 55 32.000 48.560 44.100 1.00 0.00 ATOM 6646 4C31 DPP 55 32.670 46.490 44.260 1.00 0.00 ATOM 6647 H14X DPP 55 31.770 45.960 43.880 1.00 0.00 ATOM 6648 H14Y DPP 55 33.200 45.870 45.020 1.00 0.00 ATOM 6649 5C31 DPP 55 33.690 46.580 43.120 1.00 0.00 ATOM 6650 H15X DPP 55 33.310 47.100 42.210 1.00 0.00 ATOM 6651 H15Y DPP 55 33.830 45.510 42.850 1.00 0.00 ATOM 6652 6C31 DPP 55 35.060 46.990 43.640 1.00 0.00 ATOM 6653 H16X DPP 55 35.040 48.100 43.750 1.00 0.00 ATOM 6654 H16Y DPP 55 35.870 46.770 42.910 1.00 0.00 ATOM 6655 H16Z DPP 55 35.300 46.530 44.620 1.00 0.00 ATOM 6656 N DPP 56 12.810 40.310 67.240 1.00 0.00 ATOM 6657 HN1 DPP 56 13.770 40.190 67.630 1.00 0.00 ATOM 6658 HN2 DPP 56 12.920 40.330 66.200 1.00 0.00 ATOM 6659 HN3 DPP 56 12.380 41.200 67.580 1.00 0.00 ATOM 6660 C12 DPP 56 11.880 39.300 67.860 1.00 0.00 ATOM 6661 H12A DPP 56 11.660 39.640 68.890 1.00 0.00 ATOM 6662 H12B DPP 56 10.920 39.450 67.310 1.00 0.00 ATOM 6663 C11 DPP 56 12.530 37.920 67.790 1.00 0.00 ATOM 6664 H11A DPP 56 11.870 37.270 68.400 1.00 0.00 ATOM 6665 H11B DPP 56 13.580 37.960 68.140 1.00 0.00 ATOM 6666 P DPP 56 12.940 35.880 66.300 1.00 0.00 ATOM 6667 O13 DPP 56 11.790 34.990 66.580 1.00 0.00 ATOM 6668 O14 DPP 56 14.190 35.570 67.030 1.00 0.00 ATOM 6669 O11 DPP 56 13.160 35.780 64.720 1.00 0.00 ATOM 6670 O12 DPP 56 12.500 37.410 66.450 1.00 0.00 ATOM 6671 C1 DPP 56 11.960 36.100 64.010 1.00 0.00 ATOM 6672 HA DPP 56 12.090 36.820 63.170 1.00 0.00 ATOM 6673 HB DPP 56 11.070 36.390 64.620 1.00 0.00 ATOM 6674 C2 DPP 56 11.510 34.800 63.320 1.00 0.00 ATOM 6675 HS DPP 56 11.070 34.130 64.090 1.00 0.00 ATOM 6676 O21 DPP 56 12.630 34.170 62.680 1.00 0.00 ATOM 6677 C21 DPP 56 12.560 32.830 62.670 1.00 0.00 ATOM 6678 O22 DPP 56 11.510 32.250 62.900 1.00 0.00 ATOM 6679 C22 DPP 56 13.870 32.170 62.270 1.00 0.00 ATOM 6680 H2R DPP 56 13.740 31.090 62.490 1.00 0.00 ATOM 6681 H2S DPP 56 14.730 32.510 62.880 1.00 0.00 ATOM 6682 C3 DPP 56 10.370 35.000 62.310 1.00 0.00 ATOM 6683 HX DPP 56 9.470 35.390 62.850 1.00 0.00 ATOM 6684 HY DPP 56 10.160 34.080 61.730 1.00 0.00 ATOM 6685 O31 DPP 56 10.800 36.000 61.380 1.00 0.00 ATOM 6686 C31 DPP 56 11.160 35.520 60.190 1.00 0.00 ATOM 6687 O32 DPP 56 11.390 34.380 59.820 1.00 0.00 ATOM 6688 C32 DPP 56 11.340 36.800 59.380 1.00 0.00 ATOM 6689 H2X DPP 56 11.720 37.600 60.040 1.00 0.00 ATOM 6690 H2Y DPP 56 10.310 37.150 59.120 1.00 0.00 ATOM 6691 C23 DPP 56 14.060 32.620 60.820 1.00 0.00 ATOM 6692 H3R DPP 56 14.080 33.710 60.640 1.00 0.00 ATOM 6693 H3S DPP 56 13.160 32.350 60.210 1.00 0.00 ATOM 6694 C24 DPP 56 15.310 31.950 60.260 1.00 0.00 ATOM 6695 H4R DPP 56 15.160 30.910 60.620 1.00 0.00 ATOM 6696 H4S DPP 56 16.300 32.210 60.710 1.00 0.00 ATOM 6697 C25 DPP 56 15.480 32.080 58.750 1.00 0.00 ATOM 6698 H5R DPP 56 16.290 31.440 58.320 1.00 0.00 ATOM 6699 H5S DPP 56 15.960 33.080 58.640 1.00 0.00 ATOM 6700 C26 DPP 56 14.210 31.950 57.900 1.00 0.00 ATOM 6701 H6R DPP 56 13.720 32.930 58.070 1.00 0.00 ATOM 6702 H6S DPP 56 13.490 31.190 58.250 1.00 0.00 ATOM 6703 C27 DPP 56 14.250 31.700 56.390 1.00 0.00 ATOM 6704 H7R DPP 56 13.220 31.400 56.110 1.00 0.00 ATOM 6705 H7S DPP 56 14.850 30.790 56.150 1.00 0.00 ATOM 6706 C28 DPP 56 14.610 32.900 55.530 1.00 0.00 ATOM 6707 H8R DPP 56 15.700 33.060 55.600 1.00 0.00 ATOM 6708 H8S DPP 56 14.190 33.860 55.900 1.00 0.00 ATOM 6709 C29 DPP 56 14.390 32.730 54.020 1.00 0.00 ATOM 6710 H9R DPP 56 14.870 31.750 53.790 1.00 0.00 ATOM 6711 H9S DPP 56 14.950 33.510 53.460 1.00 0.00 ATOM 6712 0C21 DPP 56 12.970 32.470 53.530 1.00 0.00 ATOM 6713 H10R DPP 56 12.510 33.480 53.440 1.00 0.00 ATOM 6714 H10S DPP 56 12.520 31.910 54.370 1.00 0.00 ATOM 6715 1C21 DPP 56 12.730 31.780 52.180 1.00 0.00 ATOM 6716 H11R DPP 56 13.090 30.730 52.160 1.00 0.00 ATOM 6717 H11S DPP 56 13.350 32.260 51.390 1.00 0.00 ATOM 6718 2C21 DPP 56 11.240 31.810 51.830 1.00 0.00 ATOM 6719 H12R DPP 56 10.790 32.810 52.020 1.00 0.00 ATOM 6720 H12S DPP 56 10.740 30.980 52.370 1.00 0.00 ATOM 6721 3C21 DPP 56 10.920 31.540 50.360 1.00 0.00 ATOM 6722 H13R DPP 56 9.850 31.250 50.340 1.00 0.00 ATOM 6723 H13S DPP 56 11.510 30.680 49.980 1.00 0.00 ATOM 6724 4C21 DPP 56 11.320 32.730 49.480 1.00 0.00 ATOM 6725 H14R DPP 56 12.400 32.940 49.540 1.00 0.00 ATOM 6726 H14S DPP 56 10.830 33.720 49.640 1.00 0.00 ATOM 6727 5C21 DPP 56 11.030 32.480 47.990 1.00 0.00 ATOM 6728 H15R DPP 56 11.710 31.660 47.670 1.00 0.00 ATOM 6729 H15S DPP 56 11.250 33.400 47.410 1.00 0.00 ATOM 6730 6C21 DPP 56 9.570 32.170 47.700 1.00 0.00 ATOM 6731 H16R DPP 56 8.870 32.980 48.010 1.00 0.00 ATOM 6732 H16S DPP 56 9.330 31.220 48.230 1.00 0.00 ATOM 6733 H16T DPP 56 9.390 31.980 46.620 1.00 0.00 ATOM 6734 C33 DPP 56 12.250 36.620 58.160 1.00 0.00 ATOM 6735 H3X DPP 56 11.930 35.800 57.490 1.00 0.00 ATOM 6736 H3Y DPP 56 13.280 36.340 58.460 1.00 0.00 ATOM 6737 C34 DPP 56 12.320 37.920 57.360 1.00 0.00 ATOM 6738 H4X DPP 56 12.600 38.740 58.070 1.00 0.00 ATOM 6739 H4Y DPP 56 11.240 38.120 57.210 1.00 0.00 ATOM 6740 C35 DPP 56 13.250 37.960 56.150 1.00 0.00 ATOM 6741 H5X DPP 56 14.300 37.720 56.440 1.00 0.00 ATOM 6742 H5Y DPP 56 13.340 39.050 55.950 1.00 0.00 ATOM 6743 C36 DPP 56 12.800 37.070 54.990 1.00 0.00 ATOM 6744 H6X DPP 56 11.710 37.180 54.820 1.00 0.00 ATOM 6745 H6Y DPP 56 13.090 36.020 55.190 1.00 0.00 ATOM 6746 C37 DPP 56 13.540 37.360 53.690 1.00 0.00 ATOM 6747 H7X DPP 56 14.560 37.580 54.070 1.00 0.00 ATOM 6748 H7Y DPP 56 13.130 38.280 53.230 1.00 0.00 ATOM 6749 C38 DPP 56 13.600 36.210 52.680 1.00 0.00 ATOM 6750 H8X DPP 56 12.620 35.850 52.290 1.00 0.00 ATOM 6751 H8Y DPP 56 13.990 35.360 53.280 1.00 0.00 ATOM 6752 C39 DPP 56 14.450 36.590 51.460 1.00 0.00 ATOM 6753 H9X DPP 56 15.480 36.770 51.820 1.00 0.00 ATOM 6754 H9Y DPP 56 14.020 37.540 51.070 1.00 0.00 ATOM 6755 0C31 DPP 56 14.420 35.690 50.230 1.00 0.00 ATOM 6756 H10X DPP 56 13.390 35.720 49.820 1.00 0.00 ATOM 6757 H10Y DPP 56 14.760 34.700 50.620 1.00 0.00 ATOM 6758 1C31 DPP 56 15.210 36.140 48.990 1.00 0.00 ATOM 6759 H11X DPP 56 16.240 36.450 49.270 1.00 0.00 ATOM 6760 H11Y DPP 56 14.740 36.970 48.420 1.00 0.00 ATOM 6761 2C31 DPP 56 15.620 34.960 48.110 1.00 0.00 ATOM 6762 H12X DPP 56 16.070 34.250 48.840 1.00 0.00 ATOM 6763 H12Y DPP 56 16.320 35.230 47.290 1.00 0.00 ATOM 6764 3C31 DPP 56 14.490 34.280 47.340 1.00 0.00 ATOM 6765 H13X DPP 56 13.790 33.930 48.130 1.00 0.00 ATOM 6766 H13Y DPP 56 14.940 33.400 46.840 1.00 0.00 ATOM 6767 4C31 DPP 56 13.630 35.200 46.460 1.00 0.00 ATOM 6768 H14X DPP 56 12.910 34.590 45.870 1.00 0.00 ATOM 6769 H14Y DPP 56 13.100 35.950 47.070 1.00 0.00 ATOM 6770 5C31 DPP 56 14.410 36.080 45.480 1.00 0.00 ATOM 6771 H15X DPP 56 15.000 36.810 46.080 1.00 0.00 ATOM 6772 H15Y DPP 56 13.790 36.700 44.800 1.00 0.00 ATOM 6773 6C31 DPP 56 15.340 35.300 44.550 1.00 0.00 ATOM 6774 H16X DPP 56 15.870 36.130 44.020 1.00 0.00 ATOM 6775 H16Y DPP 56 14.890 34.620 43.790 1.00 0.00 ATOM 6776 H16Z DPP 56 15.950 34.600 45.150 1.00 0.00 ATOM 6777 N DPP 57 9.770 47.190 64.950 1.00 0.00 ATOM 6778 HN1 DPP 57 8.760 47.440 64.900 1.00 0.00 ATOM 6779 HN2 DPP 57 10.190 47.210 65.900 1.00 0.00 ATOM 6780 HN3 DPP 57 10.360 47.900 64.470 1.00 0.00 ATOM 6781 C12 DPP 57 9.890 45.890 64.190 1.00 0.00 ATOM 6782 H12A DPP 57 9.350 46.060 63.230 1.00 0.00 ATOM 6783 H12B DPP 57 9.470 45.040 64.770 1.00 0.00 ATOM 6784 C11 DPP 57 11.340 45.480 63.930 1.00 0.00 ATOM 6785 H11A DPP 57 11.900 46.320 63.470 1.00 0.00 ATOM 6786 H11B DPP 57 11.180 44.630 63.230 1.00 0.00 ATOM 6787 P DPP 57 13.470 44.730 64.930 1.00 0.00 ATOM 6788 O13 DPP 57 13.960 43.670 65.840 1.00 0.00 ATOM 6789 O14 DPP 57 14.050 46.080 65.130 1.00 0.00 ATOM 6790 O11 DPP 57 13.750 44.410 63.390 1.00 0.00 ATOM 6791 O12 DPP 57 11.910 45.010 65.150 1.00 0.00 ATOM 6792 C1 DPP 57 14.030 43.040 63.080 1.00 0.00 ATOM 6793 HA DPP 57 13.030 42.610 62.900 1.00 0.00 ATOM 6794 HB DPP 57 14.640 42.590 63.900 1.00 0.00 ATOM 6795 C2 DPP 57 14.870 42.900 61.800 1.00 0.00 ATOM 6796 HS DPP 57 15.030 41.810 61.670 1.00 0.00 ATOM 6797 O21 DPP 57 16.040 43.720 61.800 1.00 0.00 ATOM 6798 C21 DPP 57 17.010 43.390 62.660 1.00 0.00 ATOM 6799 O22 DPP 57 16.860 42.670 63.630 1.00 0.00 ATOM 6800 C22 DPP 57 18.300 44.080 62.240 1.00 0.00 ATOM 6801 H2R DPP 57 19.110 43.600 62.840 1.00 0.00 ATOM 6802 H2S DPP 57 18.030 45.120 62.530 1.00 0.00 ATOM 6803 C3 DPP 57 13.980 43.350 60.630 1.00 0.00 ATOM 6804 HX DPP 57 13.760 44.440 60.610 1.00 0.00 ATOM 6805 HY DPP 57 12.970 42.920 60.780 1.00 0.00 ATOM 6806 O31 DPP 57 14.570 42.970 59.390 1.00 0.00 ATOM 6807 C31 DPP 57 14.130 41.840 58.830 1.00 0.00 ATOM 6808 O32 DPP 57 13.200 41.150 59.220 1.00 0.00 ATOM 6809 C32 DPP 57 14.860 41.470 57.540 1.00 0.00 ATOM 6810 H2X DPP 57 14.630 40.440 57.210 1.00 0.00 ATOM 6811 H2Y DPP 57 15.950 41.660 57.680 1.00 0.00 ATOM 6812 C23 DPP 57 18.640 44.010 60.750 1.00 0.00 ATOM 6813 H3R DPP 57 19.630 44.470 60.580 1.00 0.00 ATOM 6814 H3S DPP 57 17.820 44.570 60.240 1.00 0.00 ATOM 6815 C24 DPP 57 18.570 42.570 60.230 1.00 0.00 ATOM 6816 H4R DPP 57 17.610 42.080 60.510 1.00 0.00 ATOM 6817 H4S DPP 57 19.350 41.900 60.640 1.00 0.00 ATOM 6818 C25 DPP 57 18.580 42.650 58.700 1.00 0.00 ATOM 6819 H5R DPP 57 19.430 43.250 58.310 1.00 0.00 ATOM 6820 H5S DPP 57 17.620 43.130 58.410 1.00 0.00 ATOM 6821 C26 DPP 57 18.820 41.350 57.940 1.00 0.00 ATOM 6822 H6R DPP 57 17.930 40.700 58.040 1.00 0.00 ATOM 6823 H6S DPP 57 19.670 40.800 58.400 1.00 0.00 ATOM 6824 C27 DPP 57 19.060 41.540 56.440 1.00 0.00 ATOM 6825 H7R DPP 57 20.040 42.070 56.430 1.00 0.00 ATOM 6826 H7S DPP 57 18.240 42.180 56.040 1.00 0.00 ATOM 6827 C28 DPP 57 19.260 40.220 55.690 1.00 0.00 ATOM 6828 H8R DPP 57 18.630 39.480 56.220 1.00 0.00 ATOM 6829 H8S DPP 57 20.280 39.800 55.790 1.00 0.00 ATOM 6830 C29 DPP 57 18.790 40.270 54.230 1.00 0.00 ATOM 6831 H9R DPP 57 17.810 40.790 54.130 1.00 0.00 ATOM 6832 H9S DPP 57 18.870 39.200 53.950 1.00 0.00 ATOM 6833 0C21 DPP 57 19.800 41.060 53.390 1.00 0.00 ATOM 6834 H10R DPP 57 20.670 40.370 53.340 1.00 0.00 ATOM 6835 H10S DPP 57 20.090 41.980 53.940 1.00 0.00 ATOM 6836 1C21 DPP 57 19.210 41.360 52.010 1.00 0.00 ATOM 6837 H11R DPP 57 19.990 41.900 51.440 1.00 0.00 ATOM 6838 H11S DPP 57 18.340 42.030 52.200 1.00 0.00 ATOM 6839 2C21 DPP 57 18.760 40.160 51.160 1.00 0.00 ATOM 6840 H12R DPP 57 17.860 39.870 51.740 1.00 0.00 ATOM 6841 H12S DPP 57 19.440 39.290 51.310 1.00 0.00 ATOM 6842 3C21 DPP 57 18.670 40.570 49.690 1.00 0.00 ATOM 6843 H13R DPP 57 19.700 40.960 49.540 1.00 0.00 ATOM 6844 H13S DPP 57 17.960 41.420 49.600 1.00 0.00 ATOM 6845 4C21 DPP 57 18.370 39.420 48.730 1.00 0.00 ATOM 6846 H14R DPP 57 17.340 39.190 49.080 1.00 0.00 ATOM 6847 H14S DPP 57 19.100 38.590 48.790 1.00 0.00 ATOM 6848 5C21 DPP 57 18.030 39.870 47.300 1.00 0.00 ATOM 6849 H15R DPP 57 18.860 40.390 46.790 1.00 0.00 ATOM 6850 H15S DPP 57 17.150 40.540 47.240 1.00 0.00 ATOM 6851 6C21 DPP 57 17.720 38.670 46.400 1.00 0.00 ATOM 6852 H16R DPP 57 18.590 38.000 46.240 1.00 0.00 ATOM 6853 H16S DPP 57 17.470 39.060 45.390 1.00 0.00 ATOM 6854 H16T DPP 57 16.820 38.180 46.830 1.00 0.00 ATOM 6855 C33 DPP 57 14.410 42.230 56.300 1.00 0.00 ATOM 6856 H3X DPP 57 14.930 43.210 56.270 1.00 0.00 ATOM 6857 H3Y DPP 57 13.300 42.270 56.300 1.00 0.00 ATOM 6858 C34 DPP 57 14.830 41.580 54.980 1.00 0.00 ATOM 6859 H4X DPP 57 14.730 40.480 54.960 1.00 0.00 ATOM 6860 H4Y DPP 57 15.840 41.920 54.660 1.00 0.00 ATOM 6861 C35 DPP 57 13.920 41.840 53.780 1.00 0.00 ATOM 6862 H5X DPP 57 13.690 42.920 53.840 1.00 0.00 ATOM 6863 H5Y DPP 57 12.900 41.460 53.980 1.00 0.00 ATOM 6864 C36 DPP 57 14.520 41.270 52.490 1.00 0.00 ATOM 6865 H6X DPP 57 15.020 40.320 52.790 1.00 0.00 ATOM 6866 H6Y DPP 57 15.330 41.950 52.150 1.00 0.00 ATOM 6867 C37 DPP 57 13.420 41.170 51.430 1.00 0.00 ATOM 6868 H7X DPP 57 12.970 42.190 51.400 1.00 0.00 ATOM 6869 H7Y DPP 57 12.640 40.410 51.620 1.00 0.00 ATOM 6870 C38 DPP 57 13.950 40.720 50.070 1.00 0.00 ATOM 6871 H8X DPP 57 14.430 39.730 50.220 1.00 0.00 ATOM 6872 H8Y DPP 57 14.760 41.350 49.640 1.00 0.00 ATOM 6873 C39 DPP 57 12.980 40.650 48.880 1.00 0.00 ATOM 6874 H9X DPP 57 12.680 41.680 48.620 1.00 0.00 ATOM 6875 H9Y DPP 57 12.050 40.090 49.120 1.00 0.00 ATOM 6876 0C31 DPP 57 13.650 40.060 47.630 1.00 0.00 ATOM 6877 H10X DPP 57 14.240 39.230 48.080 1.00 0.00 ATOM 6878 H10Y DPP 57 14.310 40.830 47.190 1.00 0.00 ATOM 6879 1C31 DPP 57 12.600 39.460 46.700 1.00 0.00 ATOM 6880 H11X DPP 57 11.980 38.790 47.340 1.00 0.00 ATOM 6881 H11Y DPP 57 13.010 38.700 45.990 1.00 0.00 ATOM 6882 2C31 DPP 57 11.760 40.540 46.010 1.00 0.00 ATOM 6883 H12X DPP 57 12.350 41.080 45.230 1.00 0.00 ATOM 6884 H12Y DPP 57 11.550 41.370 46.710 1.00 0.00 ATOM 6885 3C31 DPP 57 10.470 40.040 45.360 1.00 0.00 ATOM 6886 H13X DPP 57 9.800 39.880 46.240 1.00 0.00 ATOM 6887 H13Y DPP 57 10.880 39.140 44.850 1.00 0.00 ATOM 6888 4C31 DPP 57 9.970 40.840 44.160 1.00 0.00 ATOM 6889 H14X DPP 57 10.700 40.950 43.330 1.00 0.00 ATOM 6890 H14Y DPP 57 9.710 41.860 44.500 1.00 0.00 ATOM 6891 5C31 DPP 57 8.740 40.220 43.500 1.00 0.00 ATOM 6892 H15X DPP 57 8.050 40.200 44.370 1.00 0.00 ATOM 6893 H15Y DPP 57 9.060 39.230 43.130 1.00 0.00 ATOM 6894 6C31 DPP 57 8.090 40.920 42.300 1.00 0.00 ATOM 6895 H16X DPP 57 7.920 42.010 42.500 1.00 0.00 ATOM 6896 H16Y DPP 57 7.130 40.420 42.060 1.00 0.00 ATOM 6897 H16Z DPP 57 8.660 40.760 41.370 1.00 0.00 ATOM 6898 N DPP 58 39.370 9.000 59.790 1.00 0.00 ATOM 6899 HN1 DPP 58 39.450 8.290 60.550 1.00 0.00 ATOM 6900 HN2 DPP 58 39.290 8.490 58.890 1.00 0.00 ATOM 6901 HN3 DPP 58 40.320 9.410 59.840 1.00 0.00 ATOM 6902 C12 DPP 58 38.270 9.970 60.160 1.00 0.00 ATOM 6903 H12A DPP 58 38.690 10.880 60.650 1.00 0.00 ATOM 6904 H12B DPP 58 37.730 9.480 60.990 1.00 0.00 ATOM 6905 C11 DPP 58 37.220 10.300 59.090 1.00 0.00 ATOM 6906 H11A DPP 58 36.190 10.500 59.430 1.00 0.00 ATOM 6907 H11B DPP 58 36.950 9.430 58.450 1.00 0.00 ATOM 6908 P DPP 58 36.850 12.430 57.910 1.00 0.00 ATOM 6909 O13 DPP 58 37.420 13.420 56.970 1.00 0.00 ATOM 6910 O14 DPP 58 36.630 13.000 59.260 1.00 0.00 ATOM 6911 O11 DPP 58 35.470 11.910 57.300 1.00 0.00 ATOM 6912 O12 DPP 58 37.780 11.140 58.070 1.00 0.00 ATOM 6913 C1 DPP 58 35.590 10.970 56.230 1.00 0.00 ATOM 6914 HA DPP 58 34.660 10.390 56.040 1.00 0.00 ATOM 6915 HB DPP 58 36.430 10.240 56.290 1.00 0.00 ATOM 6916 C2 DPP 58 35.690 11.690 54.880 1.00 0.00 ATOM 6917 HS DPP 58 36.730 12.080 54.830 1.00 0.00 ATOM 6918 O21 DPP 58 34.600 12.600 54.660 1.00 0.00 ATOM 6919 C21 DPP 58 34.840 13.490 53.690 1.00 0.00 ATOM 6920 O22 DPP 58 35.910 13.650 53.130 1.00 0.00 ATOM 6921 C22 DPP 58 33.580 14.310 53.490 1.00 0.00 ATOM 6922 H2R DPP 58 33.510 15.010 54.350 1.00 0.00 ATOM 6923 H2S DPP 58 32.800 13.520 53.420 1.00 0.00 ATOM 6924 C3 DPP 58 35.480 10.560 53.860 1.00 0.00 ATOM 6925 HX DPP 58 34.400 10.340 53.950 1.00 0.00 ATOM 6926 HY DPP 58 36.120 9.710 54.180 1.00 0.00 ATOM 6927 O31 DPP 58 35.720 10.980 52.510 1.00 0.00 ATOM 6928 C31 DPP 58 37.000 10.970 52.130 1.00 0.00 ATOM 6929 O32 DPP 58 37.900 10.500 52.810 1.00 0.00 ATOM 6930 C32 DPP 58 37.210 11.470 50.710 1.00 0.00 ATOM 6931 H2X DPP 58 38.260 11.610 50.380 1.00 0.00 ATOM 6932 H2Y DPP 58 36.550 12.350 50.570 1.00 0.00 ATOM 6933 C23 DPP 58 33.650 15.240 52.280 1.00 0.00 ATOM 6934 H3R DPP 58 32.710 15.800 52.090 1.00 0.00 ATOM 6935 H3S DPP 58 34.040 14.760 51.360 1.00 0.00 ATOM 6936 C24 DPP 58 34.410 16.510 52.680 1.00 0.00 ATOM 6937 H4R DPP 58 35.430 16.290 53.060 1.00 0.00 ATOM 6938 H4S DPP 58 33.810 16.900 53.540 1.00 0.00 ATOM 6939 C25 DPP 58 34.610 17.590 51.610 1.00 0.00 ATOM 6940 H5R DPP 58 35.180 17.160 50.770 1.00 0.00 ATOM 6941 H5S DPP 58 35.150 18.480 52.000 1.00 0.00 ATOM 6942 C26 DPP 58 33.370 18.080 50.840 1.00 0.00 ATOM 6943 H6R DPP 58 32.760 18.640 51.580 1.00 0.00 ATOM 6944 H6S DPP 58 32.830 17.160 50.520 1.00 0.00 ATOM 6945 C27 DPP 58 33.630 18.960 49.620 1.00 0.00 ATOM 6946 H7R DPP 58 34.310 18.620 48.810 1.00 0.00 ATOM 6947 H7S DPP 58 33.990 19.970 49.900 1.00 0.00 ATOM 6948 C28 DPP 58 32.380 19.290 48.800 1.00 0.00 ATOM 6949 H8R DPP 58 31.660 19.900 49.380 1.00 0.00 ATOM 6950 H8S DPP 58 31.810 18.360 48.600 1.00 0.00 ATOM 6951 C29 DPP 58 32.630 19.970 47.450 1.00 0.00 ATOM 6952 H9R DPP 58 33.490 20.650 47.640 1.00 0.00 ATOM 6953 H9S DPP 58 31.760 20.580 47.110 1.00 0.00 ATOM 6954 0C21 DPP 58 33.110 19.060 46.320 1.00 0.00 ATOM 6955 H10R DPP 58 34.130 18.730 46.580 1.00 0.00 ATOM 6956 H10S DPP 58 33.180 19.790 45.480 1.00 0.00 ATOM 6957 1C21 DPP 58 32.020 18.040 45.980 1.00 0.00 ATOM 6958 H11R DPP 58 31.030 18.520 45.810 1.00 0.00 ATOM 6959 H11S DPP 58 31.850 17.290 46.790 1.00 0.00 ATOM 6960 2C21 DPP 58 32.300 17.160 44.760 1.00 0.00 ATOM 6961 H12R DPP 58 32.810 16.180 44.940 1.00 0.00 ATOM 6962 H12S DPP 58 32.980 17.740 44.110 1.00 0.00 ATOM 6963 3C21 DPP 58 30.980 16.840 44.060 1.00 0.00 ATOM 6964 H13R DPP 58 31.210 16.830 42.970 1.00 0.00 ATOM 6965 H13S DPP 58 30.330 17.740 44.050 1.00 0.00 ATOM 6966 4C21 DPP 58 30.240 15.590 44.530 1.00 0.00 ATOM 6967 H14R DPP 58 30.970 15.010 45.150 1.00 0.00 ATOM 6968 H14S DPP 58 30.100 15.000 43.600 1.00 0.00 ATOM 6969 5C21 DPP 58 28.900 15.830 45.220 1.00 0.00 ATOM 6970 H15R DPP 58 28.200 16.130 44.400 1.00 0.00 ATOM 6971 H15S DPP 58 28.970 16.720 45.870 1.00 0.00 ATOM 6972 6C21 DPP 58 28.330 14.590 45.910 1.00 0.00 ATOM 6973 H16R DPP 58 27.300 14.790 46.290 1.00 0.00 ATOM 6974 H16S DPP 58 28.990 14.210 46.720 1.00 0.00 ATOM 6975 H16T DPP 58 28.240 13.740 45.200 1.00 0.00 ATOM 6976 C33 DPP 58 36.740 10.230 49.940 1.00 0.00 ATOM 6977 H3X DPP 58 35.780 9.730 50.200 1.00 0.00 ATOM 6978 H3Y DPP 58 37.510 9.460 50.170 1.00 0.00 ATOM 6979 C34 DPP 58 36.670 10.400 48.430 1.00 0.00 ATOM 6980 H4X DPP 58 37.630 10.870 48.140 1.00 0.00 ATOM 6981 H4Y DPP 58 35.920 11.200 48.220 1.00 0.00 ATOM 6982 C35 DPP 58 36.360 9.090 47.710 1.00 0.00 ATOM 6983 H5X DPP 58 35.450 8.540 48.040 1.00 0.00 ATOM 6984 H5Y DPP 58 37.190 8.430 48.030 1.00 0.00 ATOM 6985 C36 DPP 58 36.410 9.270 46.190 1.00 0.00 ATOM 6986 H6X DPP 58 36.450 8.220 45.820 1.00 0.00 ATOM 6987 H6Y DPP 58 37.350 9.690 45.780 1.00 0.00 ATOM 6988 C37 DPP 58 35.150 9.940 45.640 1.00 0.00 ATOM 6989 H7X DPP 58 35.250 10.040 44.530 1.00 0.00 ATOM 6990 H7Y DPP 58 35.130 10.990 45.990 1.00 0.00 ATOM 6991 C38 DPP 58 33.880 9.150 45.950 1.00 0.00 ATOM 6992 H8X DPP 58 33.590 9.460 46.980 1.00 0.00 ATOM 6993 H8Y DPP 58 34.280 8.120 46.050 1.00 0.00 ATOM 6994 C39 DPP 58 32.730 9.330 44.950 1.00 0.00 ATOM 6995 H9X DPP 58 31.880 8.620 45.080 1.00 0.00 ATOM 6996 H9Y DPP 58 33.170 9.200 43.940 1.00 0.00 ATOM 6997 0C31 DPP 58 32.270 10.790 45.010 1.00 0.00 ATOM 6998 H10X DPP 58 33.100 11.330 44.510 1.00 0.00 ATOM 6999 H10Y DPP 58 32.260 11.160 46.060 1.00 0.00 ATOM 7000 1C31 DPP 58 30.860 11.100 44.510 1.00 0.00 ATOM 7001 H11X DPP 58 30.620 10.700 43.500 1.00 0.00 ATOM 7002 H11Y DPP 58 30.650 12.190 44.410 1.00 0.00 ATOM 7003 2C31 DPP 58 29.710 10.720 45.440 1.00 0.00 ATOM 7004 H12X DPP 58 29.650 9.610 45.430 1.00 0.00 ATOM 7005 H12Y DPP 58 28.810 11.200 45.000 1.00 0.00 ATOM 7006 3C31 DPP 58 29.830 11.310 46.850 1.00 0.00 ATOM 7007 H13X DPP 58 29.910 12.420 46.800 1.00 0.00 ATOM 7008 H13Y DPP 58 30.800 11.090 47.350 1.00 0.00 ATOM 7009 4C31 DPP 58 28.650 11.140 47.810 1.00 0.00 ATOM 7010 H14X DPP 58 27.930 11.950 47.580 1.00 0.00 ATOM 7011 H14Y DPP 58 29.070 11.250 48.830 1.00 0.00 ATOM 7012 5C31 DPP 58 27.960 9.780 47.720 1.00 0.00 ATOM 7013 H15X DPP 58 28.770 9.030 47.640 1.00 0.00 ATOM 7014 H15Y DPP 58 27.350 9.680 46.800 1.00 0.00 ATOM 7015 6C31 DPP 58 27.230 9.520 49.040 1.00 0.00 ATOM 7016 H16X DPP 58 26.930 8.450 49.020 1.00 0.00 ATOM 7017 H16Y DPP 58 26.390 10.230 49.100 1.00 0.00 ATOM 7018 H16Z DPP 58 27.990 9.730 49.830 1.00 0.00 ATOM 7019 N DPP 59 1.590 2.500 62.750 1.00 0.00 ATOM 7020 HN1 DPP 59 1.340 3.350 63.290 1.00 0.00 ATOM 7021 HN2 DPP 59 2.540 2.710 62.370 1.00 0.00 ATOM 7022 HN3 DPP 59 0.850 2.510 62.010 1.00 0.00 ATOM 7023 C12 DPP 59 1.580 1.160 63.440 1.00 0.00 ATOM 7024 H12A DPP 59 2.570 0.920 63.870 1.00 0.00 ATOM 7025 H12B DPP 59 1.610 0.430 62.600 1.00 0.00 ATOM 7026 C11 DPP 59 0.520 0.880 64.500 1.00 0.00 ATOM 7027 H11A DPP 59 0.840 1.320 65.470 1.00 0.00 ATOM 7028 H11B DPP 59 0.470 -0.230 64.610 1.00 0.00 ATOM 7029 P DPP 59 -2.010 0.640 64.480 1.00 0.00 ATOM 7030 O13 DPP 59 -2.090 0.650 65.950 1.00 0.00 ATOM 7031 O14 DPP 59 -1.970 -0.700 63.860 1.00 0.00 ATOM 7032 O11 DPP 59 -3.200 1.600 64.000 1.00 0.00 ATOM 7033 O12 DPP 59 -0.700 1.400 63.950 1.00 0.00 ATOM 7034 C1 DPP 59 -3.380 2.030 62.650 1.00 0.00 ATOM 7035 HA DPP 59 -2.500 2.660 62.430 1.00 0.00 ATOM 7036 HB DPP 59 -4.220 2.760 62.600 1.00 0.00 ATOM 7037 C2 DPP 59 -3.580 0.930 61.600 1.00 0.00 ATOM 7038 HS DPP 59 -2.630 0.360 61.480 1.00 0.00 ATOM 7039 O21 DPP 59 -4.160 1.480 60.410 1.00 0.00 ATOM 7040 C21 DPP 59 -3.250 1.620 59.450 1.00 0.00 ATOM 7041 O22 DPP 59 -2.080 1.260 59.530 1.00 0.00 ATOM 7042 C22 DPP 59 -3.890 2.480 58.380 1.00 0.00 ATOM 7043 H2R DPP 59 -4.030 3.480 58.830 1.00 0.00 ATOM 7044 H2S DPP 59 -4.860 1.950 58.250 1.00 0.00 ATOM 7045 C3 DPP 59 -4.630 -0.070 62.120 1.00 0.00 ATOM 7046 HX DPP 59 -5.350 0.640 62.570 1.00 0.00 ATOM 7047 HY DPP 59 -4.380 -0.680 63.010 1.00 0.00 ATOM 7048 O31 DPP 59 -5.390 -0.870 61.210 1.00 0.00 ATOM 7049 C31 DPP 59 -4.680 -1.940 60.840 1.00 0.00 ATOM 7050 O32 DPP 59 -3.630 -2.340 61.330 1.00 0.00 ATOM 7051 C32 DPP 59 -5.470 -2.740 59.820 1.00 0.00 ATOM 7052 H2X DPP 59 -6.190 -2.020 59.380 1.00 0.00 ATOM 7053 H2Y DPP 59 -6.070 -3.510 60.360 1.00 0.00 ATOM 7054 C23 DPP 59 -3.130 2.580 57.050 1.00 0.00 ATOM 7055 H3R DPP 59 -2.090 2.920 57.240 1.00 0.00 ATOM 7056 H3S DPP 59 -3.600 3.340 56.400 1.00 0.00 ATOM 7057 C24 DPP 59 -3.220 1.250 56.300 1.00 0.00 ATOM 7058 H4R DPP 59 -4.230 0.930 55.970 1.00 0.00 ATOM 7059 H4S DPP 59 -2.910 0.500 57.060 1.00 0.00 ATOM 7060 C25 DPP 59 -2.180 1.210 55.190 1.00 0.00 ATOM 7061 H5R DPP 59 -1.910 0.150 54.950 1.00 0.00 ATOM 7062 H5S DPP 59 -1.190 1.600 55.530 1.00 0.00 ATOM 7063 C26 DPP 59 -2.650 1.890 53.910 1.00 0.00 ATOM 7064 H6R DPP 59 -2.610 2.990 54.080 1.00 0.00 ATOM 7065 H6S DPP 59 -3.680 1.530 53.690 1.00 0.00 ATOM 7066 C27 DPP 59 -1.760 1.660 52.680 1.00 0.00 ATOM 7067 H7R DPP 59 -1.890 0.650 52.240 1.00 0.00 ATOM 7068 H7S DPP 59 -0.720 1.580 53.050 1.00 0.00 ATOM 7069 C28 DPP 59 -1.880 2.740 51.610 1.00 0.00 ATOM 7070 H8R DPP 59 -1.680 3.760 52.010 1.00 0.00 ATOM 7071 H8S DPP 59 -2.920 2.670 51.210 1.00 0.00 ATOM 7072 C29 DPP 59 -0.960 2.540 50.410 1.00 0.00 ATOM 7073 H9R DPP 59 -1.330 3.100 49.520 1.00 0.00 ATOM 7074 H9S DPP 59 -1.120 1.520 49.990 1.00 0.00 ATOM 7075 0C21 DPP 59 0.480 2.850 50.810 1.00 0.00 ATOM 7076 H10R DPP 59 0.890 2.020 51.420 1.00 0.00 ATOM 7077 H10S DPP 59 0.600 3.780 51.420 1.00 0.00 ATOM 7078 1C21 DPP 59 1.420 2.910 49.600 1.00 0.00 ATOM 7079 H11R DPP 59 2.370 3.420 49.880 1.00 0.00 ATOM 7080 H11S DPP 59 1.110 3.710 48.890 1.00 0.00 ATOM 7081 2C21 DPP 59 1.650 1.670 48.740 1.00 0.00 ATOM 7082 H12R DPP 59 0.650 1.370 48.370 1.00 0.00 ATOM 7083 H12S DPP 59 1.950 0.820 49.390 1.00 0.00 ATOM 7084 3C21 DPP 59 2.380 1.940 47.420 1.00 0.00 ATOM 7085 H13R DPP 59 2.430 0.930 46.970 1.00 0.00 ATOM 7086 H13S DPP 59 3.420 2.270 47.650 1.00 0.00 ATOM 7087 4C21 DPP 59 1.600 2.860 46.480 1.00 0.00 ATOM 7088 H14R DPP 59 1.940 3.890 46.710 1.00 0.00 ATOM 7089 H14S DPP 59 0.500 2.780 46.550 1.00 0.00 ATOM 7090 5C21 DPP 59 1.840 2.440 45.020 1.00 0.00 ATOM 7091 H15R DPP 59 1.290 1.500 44.820 1.00 0.00 ATOM 7092 H15S DPP 59 2.920 2.230 44.910 1.00 0.00 ATOM 7093 6C21 DPP 59 1.430 3.510 44.000 1.00 0.00 ATOM 7094 H16R DPP 59 0.420 3.900 44.250 1.00 0.00 ATOM 7095 H16S DPP 59 1.530 2.980 43.030 1.00 0.00 ATOM 7096 H16T DPP 59 2.220 4.290 44.020 1.00 0.00 ATOM 7097 C33 DPP 59 -4.500 -3.490 58.910 1.00 0.00 ATOM 7098 H3X DPP 59 -3.880 -4.110 59.590 1.00 0.00 ATOM 7099 H3Y DPP 59 -3.840 -2.760 58.390 1.00 0.00 ATOM 7100 C34 DPP 59 -5.170 -4.470 57.950 1.00 0.00 ATOM 7101 H4X DPP 59 -5.910 -3.930 57.310 1.00 0.00 ATOM 7102 H4Y DPP 59 -5.770 -5.100 58.640 1.00 0.00 ATOM 7103 C35 DPP 59 -4.270 -5.310 57.040 1.00 0.00 ATOM 7104 H5X DPP 59 -3.600 -6.010 57.600 1.00 0.00 ATOM 7105 H5Y DPP 59 -3.630 -4.620 56.450 1.00 0.00 ATOM 7106 C36 DPP 59 -4.990 -6.150 55.990 1.00 0.00 ATOM 7107 H6X DPP 59 -5.490 -5.400 55.340 1.00 0.00 ATOM 7108 H6Y DPP 59 -5.740 -6.760 56.540 1.00 0.00 ATOM 7109 C37 DPP 59 -4.080 -7.030 55.140 1.00 0.00 ATOM 7110 H7X DPP 59 -3.840 -7.960 55.720 1.00 0.00 ATOM 7111 H7Y DPP 59 -3.190 -6.410 54.900 1.00 0.00 ATOM 7112 C38 DPP 59 -4.680 -7.330 53.770 1.00 0.00 ATOM 7113 H8X DPP 59 -5.720 -7.720 53.790 1.00 0.00 ATOM 7114 H8Y DPP 59 -4.000 -8.020 53.220 1.00 0.00 ATOM 7115 C39 DPP 59 -4.840 -6.100 52.870 1.00 0.00 ATOM 7116 H9X DPP 59 -3.830 -5.770 52.530 1.00 0.00 ATOM 7117 H9Y DPP 59 -5.420 -5.290 53.360 1.00 0.00 ATOM 7118 0C31 DPP 59 -5.700 -6.420 51.650 1.00 0.00 ATOM 7119 H10X DPP 59 -6.700 -6.540 52.130 1.00 0.00 ATOM 7120 H10Y DPP 59 -5.360 -7.370 51.170 1.00 0.00 ATOM 7121 1C31 DPP 59 -5.740 -5.270 50.640 1.00 0.00 ATOM 7122 H11X DPP 59 -5.520 -4.330 51.180 1.00 0.00 ATOM 7123 H11Y DPP 59 -6.740 -5.270 50.160 1.00 0.00 ATOM 7124 2C31 DPP 59 -4.780 -5.480 49.460 1.00 0.00 ATOM 7125 H12X DPP 59 -5.220 -6.340 48.920 1.00 0.00 ATOM 7126 H12Y DPP 59 -3.730 -5.640 49.810 1.00 0.00 ATOM 7127 3C31 DPP 59 -4.840 -4.300 48.490 1.00 0.00 ATOM 7128 H13X DPP 59 -4.440 -3.430 49.040 1.00 0.00 ATOM 7129 H13Y DPP 59 -5.920 -4.120 48.260 1.00 0.00 ATOM 7130 4C31 DPP 59 -4.070 -4.560 47.190 1.00 0.00 ATOM 7131 H14X DPP 59 -4.300 -5.590 46.850 1.00 0.00 ATOM 7132 H14Y DPP 59 -2.990 -4.600 47.450 1.00 0.00 ATOM 7133 5C31 DPP 59 -4.160 -3.570 46.020 1.00 0.00 ATOM 7134 H15X DPP 59 -3.440 -3.770 45.210 1.00 0.00 ATOM 7135 H15Y DPP 59 -3.940 -2.540 46.360 1.00 0.00 ATOM 7136 6C31 DPP 59 -5.530 -3.520 45.340 1.00 0.00 ATOM 7137 H16X DPP 59 -5.550 -2.820 44.480 1.00 0.00 ATOM 7138 H16Y DPP 59 -6.390 -3.220 45.960 1.00 0.00 ATOM 7139 H16Z DPP 59 -5.790 -4.530 44.940 1.00 0.00 ATOM 7140 N DPP 60 55.820 6.140 63.550 1.00 0.00 ATOM 7141 HN1 DPP 60 56.270 7.050 63.310 1.00 0.00 ATOM 7142 HN2 DPP 60 55.880 5.540 62.700 1.00 0.00 ATOM 7143 HN3 DPP 60 54.800 6.280 63.630 1.00 0.00 ATOM 7144 C12 DPP 60 56.280 5.410 64.790 1.00 0.00 ATOM 7145 H12A DPP 60 55.580 4.600 65.050 1.00 0.00 ATOM 7146 H12B DPP 60 56.170 6.210 65.550 1.00 0.00 ATOM 7147 C11 DPP 60 57.720 4.950 64.550 1.00 0.00 ATOM 7148 H11A DPP 60 57.810 4.040 63.920 1.00 0.00 ATOM 7149 H11B DPP 60 58.220 4.780 65.530 1.00 0.00 ATOM 7150 P DPP 60 60.070 5.960 64.080 1.00 0.00 ATOM 7151 O13 DPP 60 60.650 4.600 64.170 1.00 0.00 ATOM 7152 O14 DPP 60 60.120 6.740 65.330 1.00 0.00 ATOM 7153 O11 DPP 60 60.630 6.780 62.830 1.00 0.00 ATOM 7154 O12 DPP 60 58.500 5.850 63.760 1.00 0.00 ATOM 7155 C1 DPP 60 59.830 7.670 62.030 1.00 0.00 ATOM 7156 HA DPP 60 60.600 8.320 61.560 1.00 0.00 ATOM 7157 HB DPP 60 59.190 8.400 62.560 1.00 0.00 ATOM 7158 C2 DPP 60 59.120 6.980 60.860 1.00 0.00 ATOM 7159 HS DPP 60 58.350 6.370 61.370 1.00 0.00 ATOM 7160 O21 DPP 60 60.040 6.100 60.210 1.00 0.00 ATOM 7161 C21 DPP 60 59.450 5.370 59.260 1.00 0.00 ATOM 7162 O22 DPP 60 58.250 5.170 59.290 1.00 0.00 ATOM 7163 C22 DPP 60 60.500 5.000 58.220 1.00 0.00 ATOM 7164 H2R DPP 60 61.350 4.440 58.660 1.00 0.00 ATOM 7165 H2S DPP 60 60.930 5.980 57.920 1.00 0.00 ATOM 7166 C3 DPP 60 58.400 8.060 60.020 1.00 0.00 ATOM 7167 HX DPP 60 58.120 9.010 60.530 1.00 0.00 ATOM 7168 HY DPP 60 57.470 7.570 59.650 1.00 0.00 ATOM 7169 O31 DPP 60 59.200 8.240 58.860 1.00 0.00 ATOM 7170 C31 DPP 60 59.840 9.410 58.810 1.00 0.00 ATOM 7171 O32 DPP 60 60.120 10.130 59.760 1.00 0.00 ATOM 7172 C32 DPP 60 60.430 9.650 57.430 1.00 0.00 ATOM 7173 H2X DPP 60 59.580 9.730 56.720 1.00 0.00 ATOM 7174 H2Y DPP 60 60.960 8.730 57.110 1.00 0.00 ATOM 7175 C23 DPP 60 60.000 4.210 57.010 1.00 0.00 ATOM 7176 H3R DPP 60 59.060 4.610 56.550 1.00 0.00 ATOM 7177 H3S DPP 60 59.730 3.210 57.410 1.00 0.00 ATOM 7178 C24 DPP 60 61.000 4.000 55.870 1.00 0.00 ATOM 7179 H4R DPP 60 61.150 4.940 55.300 1.00 0.00 ATOM 7180 H4S DPP 60 60.550 3.220 55.220 1.00 0.00 ATOM 7181 C25 DPP 60 62.370 3.480 56.310 1.00 0.00 ATOM 7182 H5R DPP 60 62.170 2.640 57.000 1.00 0.00 ATOM 7183 H5S DPP 60 62.950 4.270 56.820 1.00 0.00 ATOM 7184 C26 DPP 60 63.290 3.010 55.170 1.00 0.00 ATOM 7185 H6R DPP 60 63.510 3.850 54.470 1.00 0.00 ATOM 7186 H6S DPP 60 62.810 2.200 54.580 1.00 0.00 ATOM 7187 C27 DPP 60 64.650 2.580 55.710 1.00 0.00 ATOM 7188 H7R DPP 60 64.660 2.020 56.670 1.00 0.00 ATOM 7189 H7S DPP 60 65.220 3.470 56.050 1.00 0.00 ATOM 7190 C28 DPP 60 65.490 1.830 54.670 1.00 0.00 ATOM 7191 H8R DPP 60 65.180 0.760 54.670 1.00 0.00 ATOM 7192 H8S DPP 60 66.540 2.020 54.970 1.00 0.00 ATOM 7193 C29 DPP 60 65.340 2.360 53.240 1.00 0.00 ATOM 7194 H9R DPP 60 65.730 3.400 53.260 1.00 0.00 ATOM 7195 H9S DPP 60 64.330 2.230 52.810 1.00 0.00 ATOM 7196 0C21 DPP 60 66.310 1.720 52.250 1.00 0.00 ATOM 7197 H10R DPP 60 66.200 0.610 52.300 1.00 0.00 ATOM 7198 H10S DPP 60 67.310 2.100 52.540 1.00 0.00 ATOM 7199 1C21 DPP 60 66.030 1.940 50.760 1.00 0.00 ATOM 7200 H11R DPP 60 66.340 2.910 50.330 1.00 0.00 ATOM 7201 H11S DPP 60 64.960 1.670 50.690 1.00 0.00 ATOM 7202 2C21 DPP 60 66.590 0.770 49.940 1.00 0.00 ATOM 7203 H12R DPP 60 66.100 -0.090 50.450 1.00 0.00 ATOM 7204 H12S DPP 60 67.680 0.590 50.020 1.00 0.00 ATOM 7205 3C21 DPP 60 66.300 1.000 48.460 1.00 0.00 ATOM 7206 H13R DPP 60 66.870 1.900 48.150 1.00 0.00 ATOM 7207 H13S DPP 60 65.190 1.050 48.370 1.00 0.00 ATOM 7208 4C21 DPP 60 66.790 -0.220 47.670 1.00 0.00 ATOM 7209 H14R DPP 60 66.340 -1.190 47.960 1.00 0.00 ATOM 7210 H14S DPP 60 67.820 -0.540 47.910 1.00 0.00 ATOM 7211 5C21 DPP 60 66.720 -0.150 46.150 1.00 0.00 ATOM 7212 H15R DPP 60 66.920 0.870 45.740 1.00 0.00 ATOM 7213 H15S DPP 60 67.370 -0.950 45.740 1.00 0.00 ATOM 7214 6C21 DPP 60 65.360 -0.570 45.600 1.00 0.00 ATOM 7215 H16R DPP 60 65.530 -0.670 44.510 1.00 0.00 ATOM 7216 H16S DPP 60 64.460 0.080 45.690 1.00 0.00 ATOM 7217 H16T DPP 60 65.110 -1.600 45.930 1.00 0.00 ATOM 7218 C33 DPP 60 61.430 10.800 57.520 1.00 0.00 ATOM 7219 H3X DPP 60 62.300 10.460 58.120 1.00 0.00 ATOM 7220 H3Y DPP 60 60.900 11.660 57.990 1.00 0.00 ATOM 7221 C34 DPP 60 61.940 11.230 56.150 1.00 0.00 ATOM 7222 H4X DPP 60 62.380 10.380 55.570 1.00 0.00 ATOM 7223 H4Y DPP 60 62.670 12.040 56.370 1.00 0.00 ATOM 7224 C35 DPP 60 60.870 11.730 55.170 1.00 0.00 ATOM 7225 H5X DPP 60 60.270 12.540 55.630 1.00 0.00 ATOM 7226 H5Y DPP 60 60.240 10.900 54.800 1.00 0.00 ATOM 7227 C36 DPP 60 61.480 12.330 53.900 1.00 0.00 ATOM 7228 H6X DPP 60 61.870 13.330 54.180 1.00 0.00 ATOM 7229 H6Y DPP 60 60.780 12.400 53.040 1.00 0.00 ATOM 7230 C37 DPP 60 62.670 11.570 53.310 1.00 0.00 ATOM 7231 H7X DPP 60 62.260 10.590 53.020 1.00 0.00 ATOM 7232 H7Y DPP 60 63.530 11.510 54.010 1.00 0.00 ATOM 7233 C38 DPP 60 63.080 12.190 51.970 1.00 0.00 ATOM 7234 H8X DPP 60 63.860 12.960 52.160 1.00 0.00 ATOM 7235 H8Y DPP 60 62.230 12.750 51.530 1.00 0.00 ATOM 7236 C39 DPP 60 63.760 11.150 51.080 1.00 0.00 ATOM 7237 H9X DPP 60 64.240 10.390 51.730 1.00 0.00 ATOM 7238 H9Y DPP 60 64.640 11.670 50.620 1.00 0.00 ATOM 7239 0C31 DPP 60 62.860 10.550 50.010 1.00 0.00 ATOM 7240 H10X DPP 60 62.150 11.300 49.590 1.00 0.00 ATOM 7241 H10Y DPP 60 62.140 9.870 50.520 1.00 0.00 ATOM 7242 1C31 DPP 60 63.780 10.170 48.850 1.00 0.00 ATOM 7243 H11X DPP 60 64.530 9.420 49.200 1.00 0.00 ATOM 7244 H11Y DPP 60 64.360 11.090 48.640 1.00 0.00 ATOM 7245 2C31 DPP 60 62.980 9.840 47.590 1.00 0.00 ATOM 7246 H12X DPP 60 62.450 10.730 47.190 1.00 0.00 ATOM 7247 H12Y DPP 60 62.300 9.100 48.060 1.00 0.00 ATOM 7248 3C31 DPP 60 63.590 9.120 46.390 1.00 0.00 ATOM 7249 H13X DPP 60 62.830 8.640 45.730 1.00 0.00 ATOM 7250 H13Y DPP 60 64.340 8.390 46.770 1.00 0.00 ATOM 7251 4C31 DPP 60 64.480 10.130 45.660 1.00 0.00 ATOM 7252 H14X DPP 60 65.390 10.340 46.270 1.00 0.00 ATOM 7253 H14Y DPP 60 63.950 11.070 45.410 1.00 0.00 ATOM 7254 5C31 DPP 60 65.110 9.670 44.340 1.00 0.00 ATOM 7255 H15X DPP 60 64.220 9.380 43.750 1.00 0.00 ATOM 7256 H15Y DPP 60 65.730 8.780 44.590 1.00 0.00 ATOM 7257 6C31 DPP 60 66.000 10.680 43.610 1.00 0.00 ATOM 7258 H16X DPP 60 65.550 11.690 43.540 1.00 0.00 ATOM 7259 H16Y DPP 60 66.250 10.390 42.570 1.00 0.00 ATOM 7260 H16Z DPP 60 66.870 10.870 44.270 1.00 0.00 ATOM 7261 N DPP 61 42.560 44.050 62.680 1.00 0.00 ATOM 7262 HN1 DPP 61 43.460 43.610 62.990 1.00 0.00 ATOM 7263 HN2 DPP 61 42.770 44.900 62.120 1.00 0.00 ATOM 7264 HN3 DPP 61 41.960 44.270 63.490 1.00 0.00 ATOM 7265 C12 DPP 61 41.700 43.120 61.850 1.00 0.00 ATOM 7266 H12A DPP 61 42.090 42.110 62.110 1.00 0.00 ATOM 7267 H12B DPP 61 41.900 43.390 60.790 1.00 0.00 ATOM 7268 C11 DPP 61 40.200 43.280 62.080 1.00 0.00 ATOM 7269 H11A DPP 61 39.940 42.980 63.120 1.00 0.00 ATOM 7270 H11B DPP 61 39.840 42.590 61.300 1.00 0.00 ATOM 7271 P DPP 61 38.280 44.890 61.570 1.00 0.00 ATOM 7272 O13 DPP 61 37.930 46.310 61.810 1.00 0.00 ATOM 7273 O14 DPP 61 37.590 43.950 62.470 1.00 0.00 ATOM 7274 O11 DPP 61 38.030 44.650 60.010 1.00 0.00 ATOM 7275 O12 DPP 61 39.850 44.630 61.750 1.00 0.00 ATOM 7276 C1 DPP 61 38.700 45.440 59.020 1.00 0.00 ATOM 7277 HA DPP 61 39.180 46.340 59.460 1.00 0.00 ATOM 7278 HB DPP 61 37.870 45.820 58.380 1.00 0.00 ATOM 7279 C2 DPP 61 39.750 44.790 58.110 1.00 0.00 ATOM 7280 HS DPP 61 40.630 44.530 58.730 1.00 0.00 ATOM 7281 O21 DPP 61 40.040 45.720 57.070 1.00 0.00 ATOM 7282 C21 DPP 61 41.270 45.520 56.600 1.00 0.00 ATOM 7283 O22 DPP 61 42.110 44.740 57.010 1.00 0.00 ATOM 7284 C22 DPP 61 41.560 46.510 55.480 1.00 0.00 ATOM 7285 H2R DPP 61 42.650 46.760 55.480 1.00 0.00 ATOM 7286 H2S DPP 61 41.050 47.490 55.580 1.00 0.00 ATOM 7287 C3 DPP 61 39.090 43.510 57.560 1.00 0.00 ATOM 7288 HX DPP 61 38.060 43.850 57.290 1.00 0.00 ATOM 7289 HY DPP 61 38.950 42.760 58.380 1.00 0.00 ATOM 7290 O31 DPP 61 39.750 42.820 56.500 1.00 0.00 ATOM 7291 C31 DPP 61 40.840 42.160 56.860 1.00 0.00 ATOM 7292 O32 DPP 61 41.140 41.840 58.000 1.00 0.00 ATOM 7293 C32 DPP 61 41.470 41.860 55.510 1.00 0.00 ATOM 7294 H2X DPP 61 42.270 42.590 55.260 1.00 0.00 ATOM 7295 H2Y DPP 61 40.730 42.040 54.710 1.00 0.00 ATOM 7296 C23 DPP 61 41.380 45.830 54.130 1.00 0.00 ATOM 7297 H3R DPP 61 41.940 44.870 54.230 1.00 0.00 ATOM 7298 H3S DPP 61 41.890 46.360 53.300 1.00 0.00 ATOM 7299 C24 DPP 61 39.900 45.480 53.890 1.00 0.00 ATOM 7300 H4R DPP 61 39.220 46.350 53.730 1.00 0.00 ATOM 7301 H4S DPP 61 39.520 45.030 54.830 1.00 0.00 ATOM 7302 C25 DPP 61 39.770 44.540 52.700 1.00 0.00 ATOM 7303 H5R DPP 61 38.980 43.790 52.960 1.00 0.00 ATOM 7304 H5S DPP 61 40.780 44.130 52.520 1.00 0.00 ATOM 7305 C26 DPP 61 39.220 45.270 51.470 1.00 0.00 ATOM 7306 H6R DPP 61 39.780 46.230 51.460 1.00 0.00 ATOM 7307 H6S DPP 61 38.200 45.590 51.760 1.00 0.00 ATOM 7308 C27 DPP 61 39.210 44.350 50.240 1.00 0.00 ATOM 7309 H7R DPP 61 40.270 44.030 50.100 1.00 0.00 ATOM 7310 H7S DPP 61 38.930 44.960 49.350 1.00 0.00 ATOM 7311 C28 DPP 61 38.360 43.090 50.330 1.00 0.00 ATOM 7312 H8R DPP 61 37.830 42.770 49.410 1.00 0.00 ATOM 7313 H8S DPP 61 37.630 43.400 51.100 1.00 0.00 ATOM 7314 C29 DPP 61 39.080 41.840 50.840 1.00 0.00 ATOM 7315 H9R DPP 61 38.930 41.810 51.940 1.00 0.00 ATOM 7316 H9S DPP 61 40.180 41.930 50.780 1.00 0.00 ATOM 7317 0C21 DPP 61 38.760 40.540 50.100 1.00 0.00 ATOM 7318 H10R DPP 61 37.710 40.220 49.940 1.00 0.00 ATOM 7319 H10S DPP 61 39.280 39.670 50.570 1.00 0.00 ATOM 7320 1C21 DPP 61 39.350 40.550 48.690 1.00 0.00 ATOM 7321 H11R DPP 61 40.450 40.660 48.720 1.00 0.00 ATOM 7322 H11S DPP 61 38.880 41.250 47.960 1.00 0.00 ATOM 7323 2C21 DPP 61 39.240 39.120 48.150 1.00 0.00 ATOM 7324 H12R DPP 61 38.280 38.870 47.660 1.00 0.00 ATOM 7325 H12S DPP 61 39.370 38.390 48.970 1.00 0.00 ATOM 7326 3C21 DPP 61 40.250 39.000 47.010 1.00 0.00 ATOM 7327 H13R DPP 61 41.290 39.100 47.410 1.00 0.00 ATOM 7328 H13S DPP 61 40.200 39.760 46.210 1.00 0.00 ATOM 7329 4C21 DPP 61 40.010 37.720 46.210 1.00 0.00 ATOM 7330 H14R DPP 61 38.930 37.450 46.240 1.00 0.00 ATOM 7331 H14S DPP 61 40.530 36.940 46.810 1.00 0.00 ATOM 7332 5C21 DPP 61 40.390 37.720 44.730 1.00 0.00 ATOM 7333 H15R DPP 61 41.490 37.670 44.630 1.00 0.00 ATOM 7334 H15S DPP 61 39.960 38.660 44.340 1.00 0.00 ATOM 7335 6C21 DPP 61 39.800 36.570 43.900 1.00 0.00 ATOM 7336 H16R DPP 61 38.700 36.570 44.060 1.00 0.00 ATOM 7337 H16S DPP 61 40.280 35.630 44.250 1.00 0.00 ATOM 7338 H16T DPP 61 40.060 36.790 42.840 1.00 0.00 ATOM 7339 C33 DPP 61 41.920 40.400 55.330 1.00 0.00 ATOM 7340 H3X DPP 61 40.950 39.860 55.350 1.00 0.00 ATOM 7341 H3Y DPP 61 42.510 40.080 56.220 1.00 0.00 ATOM 7342 C34 DPP 61 42.750 40.150 54.070 1.00 0.00 ATOM 7343 H4X DPP 61 43.230 39.150 54.090 1.00 0.00 ATOM 7344 H4Y DPP 61 43.430 41.030 53.990 1.00 0.00 ATOM 7345 C35 DPP 61 41.820 40.170 52.850 1.00 0.00 ATOM 7346 H5X DPP 61 41.210 41.100 52.770 1.00 0.00 ATOM 7347 H5Y DPP 61 41.130 39.310 53.000 1.00 0.00 ATOM 7348 C36 DPP 61 42.510 40.200 51.490 1.00 0.00 ATOM 7349 H6X DPP 61 43.050 41.170 51.400 1.00 0.00 ATOM 7350 H6Y DPP 61 41.790 40.200 50.650 1.00 0.00 ATOM 7351 C37 DPP 61 43.490 39.040 51.270 1.00 0.00 ATOM 7352 H7X DPP 61 42.890 38.120 51.420 1.00 0.00 ATOM 7353 H7Y DPP 61 44.420 39.070 51.870 1.00 0.00 ATOM 7354 C38 DPP 61 44.070 39.050 49.860 1.00 0.00 ATOM 7355 H8X DPP 61 43.220 38.790 49.190 1.00 0.00 ATOM 7356 H8Y DPP 61 44.810 38.230 49.810 1.00 0.00 ATOM 7357 C39 DPP 61 44.590 40.390 49.330 1.00 0.00 ATOM 7358 H9X DPP 61 45.310 40.770 50.090 1.00 0.00 ATOM 7359 H9Y DPP 61 43.870 41.230 49.280 1.00 0.00 ATOM 7360 0C31 DPP 61 45.290 40.310 47.970 1.00 0.00 ATOM 7361 H10X DPP 61 45.520 41.320 47.540 1.00 0.00 ATOM 7362 H10Y DPP 61 44.670 39.610 47.380 1.00 0.00 ATOM 7363 1C31 DPP 61 46.700 39.720 47.940 1.00 0.00 ATOM 7364 H11X DPP 61 46.720 38.750 48.470 1.00 0.00 ATOM 7365 H11Y DPP 61 47.310 40.360 48.620 1.00 0.00 ATOM 7366 2C31 DPP 61 47.390 39.720 46.570 1.00 0.00 ATOM 7367 H12X DPP 61 46.780 39.100 45.880 1.00 0.00 ATOM 7368 H12Y DPP 61 48.370 39.220 46.710 1.00 0.00 ATOM 7369 3C31 DPP 61 47.510 41.100 45.920 1.00 0.00 ATOM 7370 H13X DPP 61 48.060 41.820 46.550 1.00 0.00 ATOM 7371 H13Y DPP 61 46.530 41.600 45.730 1.00 0.00 ATOM 7372 4C31 DPP 61 48.420 41.090 44.690 1.00 0.00 ATOM 7373 H14X DPP 61 49.430 40.820 45.050 1.00 0.00 ATOM 7374 H14Y DPP 61 48.590 42.170 44.460 1.00 0.00 ATOM 7375 5C31 DPP 61 48.110 40.190 43.490 1.00 0.00 ATOM 7376 H15X DPP 61 47.020 40.400 43.400 1.00 0.00 ATOM 7377 H15Y DPP 61 48.340 39.110 43.560 1.00 0.00 ATOM 7378 6C31 DPP 61 48.680 40.850 42.240 1.00 0.00 ATOM 7379 H16X DPP 61 48.090 40.310 41.470 1.00 0.00 ATOM 7380 H16Y DPP 61 49.740 40.530 42.120 1.00 0.00 ATOM 7381 H16Z DPP 61 48.450 41.920 42.060 1.00 0.00 ATOM 7382 N DPP 62 30.720 50.370 64.150 1.00 0.00 ATOM 7383 HN1 DPP 62 29.710 50.130 64.170 1.00 0.00 ATOM 7384 HN2 DPP 62 31.060 49.420 64.420 1.00 0.00 ATOM 7385 HN3 DPP 62 30.930 51.000 64.950 1.00 0.00 ATOM 7386 C12 DPP 62 31.130 50.770 62.750 1.00 0.00 ATOM 7387 H12A DPP 62 30.900 49.890 62.110 1.00 0.00 ATOM 7388 H12B DPP 62 30.460 51.590 62.410 1.00 0.00 ATOM 7389 C11 DPP 62 32.600 51.180 62.710 1.00 0.00 ATOM 7390 H11A DPP 62 32.960 51.320 61.660 1.00 0.00 ATOM 7391 H11B DPP 62 33.250 50.400 63.160 1.00 0.00 ATOM 7392 P DPP 62 34.170 53.040 63.370 1.00 0.00 ATOM 7393 O13 DPP 62 35.170 52.080 63.910 1.00 0.00 ATOM 7394 O14 DPP 62 34.200 54.360 64.030 1.00 0.00 ATOM 7395 O11 DPP 62 34.460 53.210 61.810 1.00 0.00 ATOM 7396 O12 DPP 62 32.680 52.450 63.360 1.00 0.00 ATOM 7397 C1 DPP 62 34.220 54.510 61.260 1.00 0.00 ATOM 7398 HA DPP 62 34.990 54.610 60.470 1.00 0.00 ATOM 7399 HB DPP 62 34.490 55.330 61.950 1.00 0.00 ATOM 7400 C2 DPP 62 32.800 54.760 60.710 1.00 0.00 ATOM 7401 HS DPP 62 32.200 54.800 61.650 1.00 0.00 ATOM 7402 O21 DPP 62 32.390 53.760 59.770 1.00 0.00 ATOM 7403 C21 DPP 62 31.070 53.610 59.790 1.00 0.00 ATOM 7404 O22 DPP 62 30.310 54.380 60.360 1.00 0.00 ATOM 7405 C22 DPP 62 30.710 52.470 58.850 1.00 0.00 ATOM 7406 H2R DPP 62 31.140 51.460 59.010 1.00 0.00 ATOM 7407 H2S DPP 62 30.810 52.840 57.810 1.00 0.00 ATOM 7408 C3 DPP 62 32.810 56.130 60.010 1.00 0.00 ATOM 7409 HX DPP 62 32.950 56.860 60.830 1.00 0.00 ATOM 7410 HY DPP 62 31.790 56.240 59.580 1.00 0.00 ATOM 7411 O31 DPP 62 33.630 56.270 58.850 1.00 0.00 ATOM 7412 C31 DPP 62 34.250 57.440 58.710 1.00 0.00 ATOM 7413 O32 DPP 62 34.070 58.410 59.440 1.00 0.00 ATOM 7414 C32 DPP 62 35.180 57.430 57.510 1.00 0.00 ATOM 7415 H2X DPP 62 35.010 56.470 56.980 1.00 0.00 ATOM 7416 H2Y DPP 62 36.180 57.520 57.970 1.00 0.00 ATOM 7417 C23 DPP 62 29.200 52.220 58.930 1.00 0.00 ATOM 7418 H3R DPP 62 28.540 53.070 58.650 1.00 0.00 ATOM 7419 H3S DPP 62 29.000 52.040 60.010 1.00 0.00 ATOM 7420 C24 DPP 62 28.780 50.930 58.230 1.00 0.00 ATOM 7421 H4R DPP 62 28.990 50.040 58.870 1.00 0.00 ATOM 7422 H4S DPP 62 29.330 50.900 57.260 1.00 0.00 ATOM 7423 C25 DPP 62 27.250 50.940 58.130 1.00 0.00 ATOM 7424 H5R DPP 62 26.950 51.500 57.220 1.00 0.00 ATOM 7425 H5S DPP 62 26.950 51.450 59.070 1.00 0.00 ATOM 7426 C26 DPP 62 26.490 49.620 57.980 1.00 0.00 ATOM 7427 H6R DPP 62 25.430 49.930 57.860 1.00 0.00 ATOM 7428 H6S DPP 62 26.690 49.000 58.880 1.00 0.00 ATOM 7429 C27 DPP 62 26.820 48.660 56.840 1.00 0.00 ATOM 7430 H7R DPP 62 26.080 47.830 56.780 1.00 0.00 ATOM 7431 H7S DPP 62 27.830 48.220 57.010 1.00 0.00 ATOM 7432 C28 DPP 62 26.670 49.420 55.530 1.00 0.00 ATOM 7433 H8R DPP 62 27.510 50.150 55.560 1.00 0.00 ATOM 7434 H8S DPP 62 25.690 49.950 55.530 1.00 0.00 ATOM 7435 C29 DPP 62 26.920 48.660 54.230 1.00 0.00 ATOM 7436 H9R DPP 62 26.370 47.690 54.250 1.00 0.00 ATOM 7437 H9S DPP 62 28.000 48.410 54.240 1.00 0.00 ATOM 7438 0C21 DPP 62 26.470 49.370 52.950 1.00 0.00 ATOM 7439 H10R DPP 62 26.610 50.460 53.110 1.00 0.00 ATOM 7440 H10S DPP 62 25.440 49.100 52.650 1.00 0.00 ATOM 7441 1C21 DPP 62 27.390 49.160 51.750 1.00 0.00 ATOM 7442 H11R DPP 62 27.690 48.090 51.760 1.00 0.00 ATOM 7443 H11S DPP 62 28.300 49.760 51.940 1.00 0.00 ATOM 7444 2C21 DPP 62 26.780 49.760 50.470 1.00 0.00 ATOM 7445 H12R DPP 62 26.330 50.760 50.650 1.00 0.00 ATOM 7446 H12S DPP 62 25.840 49.240 50.190 1.00 0.00 ATOM 7447 3C21 DPP 62 27.810 49.730 49.340 1.00 0.00 ATOM 7448 H13R DPP 62 27.980 48.700 48.960 1.00 0.00 ATOM 7449 H13S DPP 62 28.800 50.090 49.690 1.00 0.00 ATOM 7450 4C21 DPP 62 27.150 50.510 48.200 1.00 0.00 ATOM 7451 H14R DPP 62 26.730 51.450 48.610 1.00 0.00 ATOM 7452 H14S DPP 62 26.210 49.990 47.940 1.00 0.00 ATOM 7453 5C21 DPP 62 28.120 50.790 47.050 1.00 0.00 ATOM 7454 H15R DPP 62 29.150 50.840 47.480 1.00 0.00 ATOM 7455 H15S DPP 62 27.720 51.730 46.610 1.00 0.00 ATOM 7456 6C21 DPP 62 28.120 49.690 45.990 1.00 0.00 ATOM 7457 H16R DPP 62 27.070 49.330 45.930 1.00 0.00 ATOM 7458 H16S DPP 62 28.640 48.810 46.420 1.00 0.00 ATOM 7459 H16T DPP 62 28.560 49.950 45.000 1.00 0.00 ATOM 7460 C33 DPP 62 35.090 58.510 56.420 1.00 0.00 ATOM 7461 H3X DPP 62 36.140 58.780 56.160 1.00 0.00 ATOM 7462 H3Y DPP 62 34.700 59.460 56.840 1.00 0.00 ATOM 7463 C34 DPP 62 34.430 58.070 55.120 1.00 0.00 ATOM 7464 H4X DPP 62 33.480 57.500 55.180 1.00 0.00 ATOM 7465 H4Y DPP 62 35.120 57.270 54.780 1.00 0.00 ATOM 7466 C35 DPP 62 34.430 58.970 53.880 1.00 0.00 ATOM 7467 H5X DPP 62 35.470 59.340 53.760 1.00 0.00 ATOM 7468 H5Y DPP 62 33.730 59.810 54.100 1.00 0.00 ATOM 7469 C36 DPP 62 33.900 58.300 52.610 1.00 0.00 ATOM 7470 H6X DPP 62 33.410 59.090 52.010 1.00 0.00 ATOM 7471 H6Y DPP 62 33.080 57.600 52.870 1.00 0.00 ATOM 7472 C37 DPP 62 35.050 57.630 51.860 1.00 0.00 ATOM 7473 H7X DPP 62 35.280 56.670 52.360 1.00 0.00 ATOM 7474 H7Y DPP 62 35.910 58.340 51.750 1.00 0.00 ATOM 7475 C38 DPP 62 34.640 57.380 50.400 1.00 0.00 ATOM 7476 H8X DPP 62 35.650 57.160 49.980 1.00 0.00 ATOM 7477 H8Y DPP 62 34.220 58.320 49.980 1.00 0.00 ATOM 7478 C39 DPP 62 33.720 56.170 50.330 1.00 0.00 ATOM 7479 H9X DPP 62 32.740 56.340 50.820 1.00 0.00 ATOM 7480 H9Y DPP 62 34.190 55.280 50.790 1.00 0.00 ATOM 7481 0C31 DPP 62 33.320 55.690 48.930 1.00 0.00 ATOM 7482 H10X DPP 62 32.520 54.930 49.040 1.00 0.00 ATOM 7483 H10Y DPP 62 34.190 55.190 48.450 1.00 0.00 ATOM 7484 1C31 DPP 62 32.770 56.850 48.100 1.00 0.00 ATOM 7485 H11X DPP 62 33.600 57.520 47.760 1.00 0.00 ATOM 7486 H11Y DPP 62 31.960 57.480 48.530 1.00 0.00 ATOM 7487 2C31 DPP 62 32.260 56.480 46.710 1.00 0.00 ATOM 7488 H12X DPP 62 31.360 55.860 46.900 1.00 0.00 ATOM 7489 H12Y DPP 62 33.030 55.830 46.250 1.00 0.00 ATOM 7490 3C31 DPP 62 31.870 57.600 45.740 1.00 0.00 ATOM 7491 H13X DPP 62 32.820 58.160 45.640 1.00 0.00 ATOM 7492 H13Y DPP 62 31.100 58.130 46.340 1.00 0.00 ATOM 7493 4C31 DPP 62 31.350 57.180 44.360 1.00 0.00 ATOM 7494 H14X DPP 62 31.150 58.110 43.790 1.00 0.00 ATOM 7495 H14Y DPP 62 32.110 56.640 43.760 1.00 0.00 ATOM 7496 5C31 DPP 62 30.210 56.160 44.370 1.00 0.00 ATOM 7497 H15X DPP 62 29.410 56.690 44.930 1.00 0.00 ATOM 7498 H15Y DPP 62 30.460 55.170 44.790 1.00 0.00 ATOM 7499 6C31 DPP 62 29.830 55.820 42.930 1.00 0.00 ATOM 7500 H16X DPP 62 30.480 55.040 42.480 1.00 0.00 ATOM 7501 H16Y DPP 62 29.780 56.730 42.290 1.00 0.00 ATOM 7502 H16Z DPP 62 28.840 55.300 42.950 1.00 0.00 ATOM 7503 N DPP 63 34.770 14.610 60.480 1.00 0.00 ATOM 7504 HN1 DPP 63 34.330 15.040 59.640 1.00 0.00 ATOM 7505 HN2 DPP 63 35.420 15.340 60.820 1.00 0.00 ATOM 7506 HN3 DPP 63 35.370 13.790 60.270 1.00 0.00 ATOM 7507 C12 DPP 63 33.810 14.070 61.520 1.00 0.00 ATOM 7508 H12A DPP 63 34.250 14.110 62.540 1.00 0.00 ATOM 7509 H12B DPP 63 33.620 13.030 61.180 1.00 0.00 ATOM 7510 C11 DPP 63 32.610 15.000 61.650 1.00 0.00 ATOM 7511 H11A DPP 63 32.880 16.000 62.060 1.00 0.00 ATOM 7512 H11B DPP 63 31.930 14.420 62.310 1.00 0.00 ATOM 7513 P DPP 63 30.570 15.970 60.400 1.00 0.00 ATOM 7514 O13 DPP 63 30.870 17.330 59.910 1.00 0.00 ATOM 7515 O14 DPP 63 29.790 15.740 61.640 1.00 0.00 ATOM 7516 O11 DPP 63 29.820 15.200 59.220 1.00 0.00 ATOM 7517 O12 DPP 63 31.950 15.160 60.380 1.00 0.00 ATOM 7518 C1 DPP 63 30.470 15.010 57.960 1.00 0.00 ATOM 7519 HA DPP 63 30.470 13.930 57.700 1.00 0.00 ATOM 7520 HB DPP 63 31.520 15.370 58.040 1.00 0.00 ATOM 7521 C2 DPP 63 29.880 15.920 56.860 1.00 0.00 ATOM 7522 HS DPP 63 29.650 16.890 57.360 1.00 0.00 ATOM 7523 O21 DPP 63 28.640 15.400 56.390 1.00 0.00 ATOM 7524 C21 DPP 63 27.620 16.260 56.260 1.00 0.00 ATOM 7525 O22 DPP 63 27.630 17.430 56.620 1.00 0.00 ATOM 7526 C22 DPP 63 26.440 15.610 55.560 1.00 0.00 ATOM 7527 H2R DPP 63 25.880 14.910 56.230 1.00 0.00 ATOM 7528 H2S DPP 63 26.880 15.190 54.640 1.00 0.00 ATOM 7529 C3 DPP 63 30.860 16.100 55.680 1.00 0.00 ATOM 7530 HX DPP 63 31.080 15.050 55.430 1.00 0.00 ATOM 7531 HY DPP 63 31.800 16.630 55.960 1.00 0.00 ATOM 7532 O31 DPP 63 30.320 16.620 54.470 1.00 0.00 ATOM 7533 C31 DPP 63 30.620 17.900 54.230 1.00 0.00 ATOM 7534 O32 DPP 63 31.270 18.560 55.030 1.00 0.00 ATOM 7535 C32 DPP 63 30.150 18.270 52.830 1.00 0.00 ATOM 7536 H2X DPP 63 30.510 17.600 52.020 1.00 0.00 ATOM 7537 H2Y DPP 63 30.630 19.230 52.540 1.00 0.00 ATOM 7538 C23 DPP 63 25.530 16.720 55.030 1.00 0.00 ATOM 7539 H3R DPP 63 26.090 17.460 54.410 1.00 0.00 ATOM 7540 H3S DPP 63 25.220 17.200 55.980 1.00 0.00 ATOM 7541 C24 DPP 63 24.310 16.320 54.210 1.00 0.00 ATOM 7542 H4R DPP 63 23.590 15.670 54.750 1.00 0.00 ATOM 7543 H4S DPP 63 24.580 15.540 53.470 1.00 0.00 ATOM 7544 C25 DPP 63 23.480 17.420 53.550 1.00 0.00 ATOM 7545 H5R DPP 63 23.140 18.130 54.330 1.00 0.00 ATOM 7546 H5S DPP 63 22.500 16.990 53.230 1.00 0.00 ATOM 7547 C26 DPP 63 24.140 18.140 52.370 1.00 0.00 ATOM 7548 H6R DPP 63 25.210 18.150 52.680 1.00 0.00 ATOM 7549 H6S DPP 63 23.640 19.120 52.230 1.00 0.00 ATOM 7550 C27 DPP 63 24.010 17.350 51.070 1.00 0.00 ATOM 7551 H7R DPP 63 22.940 17.150 50.810 1.00 0.00 ATOM 7552 H7S DPP 63 24.600 16.410 51.030 1.00 0.00 ATOM 7553 C28 DPP 63 24.720 18.150 49.980 1.00 0.00 ATOM 7554 H8R DPP 63 25.830 18.170 50.030 1.00 0.00 ATOM 7555 H8S DPP 63 24.460 19.210 50.160 1.00 0.00 ATOM 7556 C29 DPP 63 24.250 17.750 48.580 1.00 0.00 ATOM 7557 H9R DPP 63 23.250 17.280 48.690 1.00 0.00 ATOM 7558 H9S DPP 63 24.970 17.040 48.140 1.00 0.00 ATOM 7559 0C21 DPP 63 23.900 18.900 47.620 1.00 0.00 ATOM 7560 H10R DPP 63 24.820 19.460 47.360 1.00 0.00 ATOM 7561 H10S DPP 63 23.140 19.500 48.170 1.00 0.00 ATOM 7562 1C21 DPP 63 23.120 18.320 46.440 1.00 0.00 ATOM 7563 H11R DPP 63 22.640 19.160 45.900 1.00 0.00 ATOM 7564 H11S DPP 63 22.390 17.650 46.940 1.00 0.00 ATOM 7565 2C21 DPP 63 24.050 17.520 45.520 1.00 0.00 ATOM 7566 H12R DPP 63 24.230 16.570 46.060 1.00 0.00 ATOM 7567 H12S DPP 63 25.030 18.030 45.460 1.00 0.00 ATOM 7568 3C21 DPP 63 23.460 17.030 44.190 1.00 0.00 ATOM 7569 H13R DPP 63 23.330 17.880 43.490 1.00 0.00 ATOM 7570 H13S DPP 63 22.460 16.600 44.410 1.00 0.00 ATOM 7571 4C21 DPP 63 24.320 16.180 43.250 1.00 0.00 ATOM 7572 H14R DPP 63 23.830 16.100 42.250 1.00 0.00 ATOM 7573 H14S DPP 63 24.640 15.260 43.780 1.00 0.00 ATOM 7574 5C21 DPP 63 25.620 16.910 42.890 1.00 0.00 ATOM 7575 H15R DPP 63 26.250 16.810 43.800 1.00 0.00 ATOM 7576 H15S DPP 63 25.470 18.010 42.740 1.00 0.00 ATOM 7577 6C21 DPP 63 26.340 16.140 41.800 1.00 0.00 ATOM 7578 H16R DPP 63 26.140 16.490 40.760 1.00 0.00 ATOM 7579 H16S DPP 63 25.940 15.100 41.930 1.00 0.00 ATOM 7580 H16T DPP 63 27.430 16.270 41.940 1.00 0.00 ATOM 7581 C33 DPP 63 28.640 18.460 52.760 1.00 0.00 ATOM 7582 H3X DPP 63 28.330 19.100 53.620 1.00 0.00 ATOM 7583 H3Y DPP 63 28.060 17.520 52.830 1.00 0.00 ATOM 7584 C34 DPP 63 28.280 19.430 51.630 1.00 0.00 ATOM 7585 H4X DPP 63 28.750 20.420 51.830 1.00 0.00 ATOM 7586 H4Y DPP 63 27.190 19.600 51.740 1.00 0.00 ATOM 7587 C35 DPP 63 28.590 18.880 50.240 1.00 0.00 ATOM 7588 H5X DPP 63 28.200 17.870 50.040 1.00 0.00 ATOM 7589 H5Y DPP 63 29.670 18.630 50.120 1.00 0.00 ATOM 7590 C36 DPP 63 28.090 19.810 49.120 1.00 0.00 ATOM 7591 H6X DPP 63 28.440 20.810 49.450 1.00 0.00 ATOM 7592 H6Y DPP 63 26.980 19.800 49.070 1.00 0.00 ATOM 7593 C37 DPP 63 28.580 19.360 47.740 1.00 0.00 ATOM 7594 H7X DPP 63 28.090 18.400 47.480 1.00 0.00 ATOM 7595 H7Y DPP 63 29.690 19.350 47.720 1.00 0.00 ATOM 7596 C38 DPP 63 28.250 20.300 46.570 1.00 0.00 ATOM 7597 H8X DPP 63 28.780 21.250 46.740 1.00 0.00 ATOM 7598 H8Y DPP 63 27.160 20.550 46.590 1.00 0.00 ATOM 7599 C39 DPP 63 28.510 19.770 45.160 1.00 0.00 ATOM 7600 H9X DPP 63 28.230 18.700 45.100 1.00 0.00 ATOM 7601 H9Y DPP 63 29.610 19.700 45.270 1.00 0.00 ATOM 7602 0C31 DPP 63 28.100 20.770 44.070 1.00 0.00 ATOM 7603 H10X DPP 63 28.320 21.780 44.470 1.00 0.00 ATOM 7604 H10Y DPP 63 27.020 20.600 43.860 1.00 0.00 ATOM 7605 1C31 DPP 63 28.720 20.500 42.700 1.00 0.00 ATOM 7606 H11X DPP 63 29.770 20.290 43.000 1.00 0.00 ATOM 7607 H11Y DPP 63 28.620 21.430 42.110 1.00 0.00 ATOM 7608 2C31 DPP 63 28.140 19.330 41.910 1.00 0.00 ATOM 7609 H12X DPP 63 27.100 19.530 41.570 1.00 0.00 ATOM 7610 H12Y DPP 63 28.100 18.460 42.610 1.00 0.00 ATOM 7611 3C31 DPP 63 29.030 19.010 40.700 1.00 0.00 ATOM 7612 H13X DPP 63 28.680 18.150 40.080 1.00 0.00 ATOM 7613 H13Y DPP 63 30.020 18.830 41.170 1.00 0.00 ATOM 7614 4C31 DPP 63 29.100 20.020 39.560 1.00 0.00 ATOM 7615 H14X DPP 63 29.680 19.580 38.720 1.00 0.00 ATOM 7616 H14Y DPP 63 29.500 20.920 40.070 1.00 0.00 ATOM 7617 5C31 DPP 63 27.720 20.330 38.990 1.00 0.00 ATOM 7618 H15X DPP 63 26.970 20.520 39.790 1.00 0.00 ATOM 7619 H15Y DPP 63 27.360 19.430 38.450 1.00 0.00 ATOM 7620 6C31 DPP 63 27.910 21.480 38.000 1.00 0.00 ATOM 7621 H16X DPP 63 26.980 21.550 37.390 1.00 0.00 ATOM 7622 H16Y DPP 63 28.680 21.340 37.210 1.00 0.00 ATOM 7623 H16Z DPP 63 28.050 22.470 38.490 1.00 0.00 ATOM 7624 N DPP 64 5.240 58.830 63.240 1.00 0.00 ATOM 7625 HN1 DPP 64 6.150 58.780 63.750 1.00 0.00 ATOM 7626 HN2 DPP 64 4.580 59.360 63.850 1.00 0.00 ATOM 7627 HN3 DPP 64 4.820 57.880 63.120 1.00 0.00 ATOM 7628 C12 DPP 64 5.470 59.400 61.860 1.00 0.00 ATOM 7629 H12A DPP 64 4.530 59.350 61.270 1.00 0.00 ATOM 7630 H12B DPP 64 6.280 58.810 61.370 1.00 0.00 ATOM 7631 C11 DPP 64 5.850 60.870 62.050 1.00 0.00 ATOM 7632 H11A DPP 64 5.790 61.360 61.060 1.00 0.00 ATOM 7633 H11B DPP 64 6.890 60.810 62.440 1.00 0.00 ATOM 7634 P DPP 64 5.310 63.130 62.970 1.00 0.00 ATOM 7635 O13 DPP 64 5.390 63.610 64.370 1.00 0.00 ATOM 7636 O14 DPP 64 4.180 63.660 62.180 1.00 0.00 ATOM 7637 O11 DPP 64 6.750 63.280 62.280 1.00 0.00 ATOM 7638 O12 DPP 64 5.080 61.550 63.040 1.00 0.00 ATOM 7639 C1 DPP 64 7.660 64.210 62.870 1.00 0.00 ATOM 7640 HA DPP 64 8.620 64.080 62.310 1.00 0.00 ATOM 7641 HB DPP 64 7.850 63.960 63.930 1.00 0.00 ATOM 7642 C2 DPP 64 7.250 65.670 62.620 1.00 0.00 ATOM 7643 HS DPP 64 6.320 65.890 63.180 1.00 0.00 ATOM 7644 O21 DPP 64 6.940 65.720 61.230 1.00 0.00 ATOM 7645 C21 DPP 64 6.180 66.780 60.940 1.00 0.00 ATOM 7646 O22 DPP 64 5.680 67.570 61.720 1.00 0.00 ATOM 7647 C22 DPP 64 6.010 66.900 59.430 1.00 0.00 ATOM 7648 H2R DPP 64 5.670 65.900 59.080 1.00 0.00 ATOM 7649 H2S DPP 64 7.000 67.210 59.050 1.00 0.00 ATOM 7650 C3 DPP 64 8.380 66.620 63.050 1.00 0.00 ATOM 7651 HX DPP 64 8.610 66.380 64.110 1.00 0.00 ATOM 7652 HY DPP 64 8.120 67.690 62.870 1.00 0.00 ATOM 7653 O31 DPP 64 9.610 66.300 62.400 1.00 0.00 ATOM 7654 C31 DPP 64 10.500 67.260 62.620 1.00 0.00 ATOM 7655 O32 DPP 64 10.370 68.270 63.310 1.00 0.00 ATOM 7656 C32 DPP 64 11.690 67.100 61.690 1.00 0.00 ATOM 7657 H2X DPP 64 11.630 66.140 61.130 1.00 0.00 ATOM 7658 H2Y DPP 64 12.560 66.820 62.320 1.00 0.00 ATOM 7659 C23 DPP 64 4.960 67.900 58.950 1.00 0.00 ATOM 7660 H3R DPP 64 5.250 68.940 59.190 1.00 0.00 ATOM 7661 H3S DPP 64 4.120 67.800 59.680 1.00 0.00 ATOM 7662 C24 DPP 64 4.600 67.970 57.470 1.00 0.00 ATOM 7663 H4R DPP 64 3.950 68.840 57.270 1.00 0.00 ATOM 7664 H4S DPP 64 3.980 67.060 57.270 1.00 0.00 ATOM 7665 C25 DPP 64 5.770 68.100 56.490 1.00 0.00 ATOM 7666 H5R DPP 64 6.440 67.280 56.810 1.00 0.00 ATOM 7667 H5S DPP 64 6.420 68.970 56.690 1.00 0.00 ATOM 7668 C26 DPP 64 5.400 67.810 55.030 1.00 0.00 ATOM 7669 H6R DPP 64 4.920 66.810 55.040 1.00 0.00 ATOM 7670 H6S DPP 64 6.320 67.930 54.420 1.00 0.00 ATOM 7671 C27 DPP 64 4.430 68.790 54.380 1.00 0.00 ATOM 7672 H7R DPP 64 5.020 69.730 54.230 1.00 0.00 ATOM 7673 H7S DPP 64 3.630 69.030 55.110 1.00 0.00 ATOM 7674 C28 DPP 64 3.880 68.290 53.040 1.00 0.00 ATOM 7675 H8R DPP 64 3.240 69.070 52.580 1.00 0.00 ATOM 7676 H8S DPP 64 3.240 67.400 53.190 1.00 0.00 ATOM 7677 C29 DPP 64 4.990 67.950 52.040 1.00 0.00 ATOM 7678 H9R DPP 64 5.670 67.160 52.430 1.00 0.00 ATOM 7679 H9S DPP 64 5.560 68.860 51.790 1.00 0.00 ATOM 7680 0C21 DPP 64 4.300 67.380 50.800 1.00 0.00 ATOM 7681 H10R DPP 64 3.540 68.090 50.400 1.00 0.00 ATOM 7682 H10S DPP 64 3.830 66.410 51.070 1.00 0.00 ATOM 7683 1C21 DPP 64 5.340 67.120 49.700 1.00 0.00 ATOM 7684 H11R DPP 64 6.280 66.790 50.190 1.00 0.00 ATOM 7685 H11S DPP 64 5.570 68.030 49.110 1.00 0.00 ATOM 7686 2C21 DPP 64 4.870 66.060 48.700 1.00 0.00 ATOM 7687 H12R DPP 64 3.800 66.310 48.530 1.00 0.00 ATOM 7688 H12S DPP 64 4.960 65.090 49.220 1.00 0.00 ATOM 7689 3C21 DPP 64 5.750 65.960 47.450 1.00 0.00 ATOM 7690 H13R DPP 64 6.670 65.350 47.610 1.00 0.00 ATOM 7691 H13S DPP 64 6.040 67.000 47.180 1.00 0.00 ATOM 7692 4C21 DPP 64 5.030 65.340 46.250 1.00 0.00 ATOM 7693 H14R DPP 64 4.120 65.950 46.020 1.00 0.00 ATOM 7694 H14S DPP 64 4.740 64.280 46.390 1.00 0.00 ATOM 7695 5C21 DPP 64 5.810 65.460 44.940 1.00 0.00 ATOM 7696 H15R DPP 64 6.880 65.200 45.090 1.00 0.00 ATOM 7697 H15S DPP 64 5.830 66.540 44.660 1.00 0.00 ATOM 7698 6C21 DPP 64 5.240 64.700 43.750 1.00 0.00 ATOM 7699 H16R DPP 64 6.040 64.720 42.980 1.00 0.00 ATOM 7700 H16S DPP 64 4.300 65.040 43.270 1.00 0.00 ATOM 7701 H16T DPP 64 5.110 63.620 43.970 1.00 0.00 ATOM 7702 C33 DPP 64 11.960 68.330 60.810 1.00 0.00 ATOM 7703 H3X DPP 64 13.040 68.160 60.640 1.00 0.00 ATOM 7704 H3Y DPP 64 11.730 69.320 61.260 1.00 0.00 ATOM 7705 C34 DPP 64 11.240 68.190 59.470 1.00 0.00 ATOM 7706 H4X DPP 64 11.290 67.180 58.990 1.00 0.00 ATOM 7707 H4Y DPP 64 11.820 68.840 58.790 1.00 0.00 ATOM 7708 C35 DPP 64 9.820 68.750 59.490 1.00 0.00 ATOM 7709 H5X DPP 64 9.880 69.690 60.080 1.00 0.00 ATOM 7710 H5Y DPP 64 9.160 67.990 59.970 1.00 0.00 ATOM 7711 C36 DPP 64 9.110 69.090 58.170 1.00 0.00 ATOM 7712 H6X DPP 64 8.050 69.390 58.320 1.00 0.00 ATOM 7713 H6Y DPP 64 9.190 68.230 57.480 1.00 0.00 ATOM 7714 C37 DPP 64 9.840 70.220 57.440 1.00 0.00 ATOM 7715 H7X DPP 64 10.870 69.950 57.120 1.00 0.00 ATOM 7716 H7Y DPP 64 9.890 71.120 58.100 1.00 0.00 ATOM 7717 C38 DPP 64 9.090 70.600 56.160 1.00 0.00 ATOM 7718 H8X DPP 64 9.570 71.520 55.770 1.00 0.00 ATOM 7719 H8Y DPP 64 8.040 70.840 56.430 1.00 0.00 ATOM 7720 C39 DPP 64 9.000 69.660 54.960 1.00 0.00 ATOM 7721 H9X DPP 64 8.490 68.710 55.240 1.00 0.00 ATOM 7722 H9Y DPP 64 10.020 69.350 54.640 1.00 0.00 ATOM 7723 0C31 DPP 64 8.330 70.460 53.830 1.00 0.00 ATOM 7724 H10X DPP 64 8.880 71.420 53.760 1.00 0.00 ATOM 7725 H10Y DPP 64 7.330 70.740 54.210 1.00 0.00 ATOM 7726 1C31 DPP 64 8.140 69.820 52.450 1.00 0.00 ATOM 7727 H11X DPP 64 7.430 70.380 51.810 1.00 0.00 ATOM 7728 H11Y DPP 64 7.690 68.830 52.660 1.00 0.00 ATOM 7729 2C31 DPP 64 9.430 69.540 51.680 1.00 0.00 ATOM 7730 H12X DPP 64 10.170 69.350 52.490 1.00 0.00 ATOM 7731 H12Y DPP 64 9.920 70.360 51.110 1.00 0.00 ATOM 7732 3C31 DPP 64 9.430 68.330 50.750 1.00 0.00 ATOM 7733 H13X DPP 64 9.050 67.500 51.390 1.00 0.00 ATOM 7734 H13Y DPP 64 10.490 68.120 50.480 1.00 0.00 ATOM 7735 4C31 DPP 64 8.480 68.450 49.550 1.00 0.00 ATOM 7736 H14X DPP 64 7.480 68.820 49.870 1.00 0.00 ATOM 7737 H14Y DPP 64 8.350 67.490 49.020 1.00 0.00 ATOM 7738 5C31 DPP 64 8.910 69.370 48.410 1.00 0.00 ATOM 7739 H15X DPP 64 9.750 68.830 47.940 1.00 0.00 ATOM 7740 H15Y DPP 64 9.230 70.290 48.950 1.00 0.00 ATOM 7741 6C31 DPP 64 7.800 69.640 47.390 1.00 0.00 ATOM 7742 H16X DPP 64 7.580 68.640 46.960 1.00 0.00 ATOM 7743 H16Y DPP 64 8.090 70.370 46.610 1.00 0.00 ATOM 7744 H16Z DPP 64 6.870 70.000 47.880 1.00 0.00 ATOM 7745 N DPP 65 6.280 59.630 19.090 1.00 0.00 ATOM 7746 HN1 DPP 65 6.050 60.270 18.310 1.00 0.00 ATOM 7747 HN2 DPP 65 5.420 59.620 19.680 1.00 0.00 ATOM 7748 HN3 DPP 65 7.130 60.040 19.510 1.00 0.00 ATOM 7749 C12 DPP 65 6.660 58.250 18.610 1.00 0.00 ATOM 7750 H12A DPP 65 5.880 58.000 17.850 1.00 0.00 ATOM 7751 H12B DPP 65 7.670 58.370 18.170 1.00 0.00 ATOM 7752 C11 DPP 65 6.590 57.220 19.740 1.00 0.00 ATOM 7753 H11A DPP 65 7.140 56.320 19.400 1.00 0.00 ATOM 7754 H11B DPP 65 5.560 57.040 20.120 1.00 0.00 ATOM 7755 P DPP 65 8.060 56.950 21.990 1.00 0.00 ATOM 7756 O13 DPP 65 7.800 57.600 23.300 1.00 0.00 ATOM 7757 O14 DPP 65 9.500 56.880 21.670 1.00 0.00 ATOM 7758 O11 DPP 65 7.590 55.420 21.990 1.00 0.00 ATOM 7759 O12 DPP 65 7.330 57.770 20.830 1.00 0.00 ATOM 7760 C1 DPP 65 6.260 55.290 22.510 1.00 0.00 ATOM 7761 HA DPP 65 5.910 54.360 22.010 1.00 0.00 ATOM 7762 HB DPP 65 5.600 56.160 22.330 1.00 0.00 ATOM 7763 C2 DPP 65 6.350 55.040 24.020 1.00 0.00 ATOM 7764 HS DPP 65 7.110 55.760 24.410 1.00 0.00 ATOM 7765 O21 DPP 65 6.730 53.680 24.290 1.00 0.00 ATOM 7766 C21 DPP 65 7.950 53.470 24.800 1.00 0.00 ATOM 7767 O22 DPP 65 8.810 54.300 25.010 1.00 0.00 ATOM 7768 C22 DPP 65 8.070 51.970 25.010 1.00 0.00 ATOM 7769 H2R DPP 65 8.910 51.660 24.350 1.00 0.00 ATOM 7770 H2S DPP 65 7.210 51.420 24.570 1.00 0.00 ATOM 7771 C3 DPP 65 4.990 55.310 24.680 1.00 0.00 ATOM 7772 HX DPP 65 4.250 54.870 23.990 1.00 0.00 ATOM 7773 HY DPP 65 4.860 56.410 24.740 1.00 0.00 ATOM 7774 O31 DPP 65 4.890 54.840 26.030 1.00 0.00 ATOM 7775 C31 DPP 65 5.580 55.600 26.870 1.00 0.00 ATOM 7776 O32 DPP 65 6.060 56.680 26.560 1.00 0.00 ATOM 7777 C32 DPP 65 5.780 54.990 28.250 1.00 0.00 ATOM 7778 H2X DPP 65 6.850 54.770 28.440 1.00 0.00 ATOM 7779 H2Y DPP 65 5.150 54.080 28.220 1.00 0.00 ATOM 7780 C23 DPP 65 8.370 51.710 26.480 1.00 0.00 ATOM 7781 H3R DPP 65 7.970 50.690 26.680 1.00 0.00 ATOM 7782 H3S DPP 65 7.670 52.340 27.080 1.00 0.00 ATOM 7783 C24 DPP 65 9.860 51.650 26.810 1.00 0.00 ATOM 7784 H4R DPP 65 10.240 52.690 26.740 1.00 0.00 ATOM 7785 H4S DPP 65 10.400 51.030 26.060 1.00 0.00 ATOM 7786 C25 DPP 65 10.240 51.190 28.220 1.00 0.00 ATOM 7787 H5R DPP 65 11.350 51.150 28.360 1.00 0.00 ATOM 7788 H5S DPP 65 9.840 50.160 28.330 1.00 0.00 ATOM 7789 C26 DPP 65 9.710 52.170 29.270 1.00 0.00 ATOM 7790 H6R DPP 65 8.620 52.410 29.190 1.00 0.00 ATOM 7791 H6S DPP 65 10.130 53.180 29.100 1.00 0.00 ATOM 7792 C27 DPP 65 9.950 51.880 30.750 1.00 0.00 ATOM 7793 H7R DPP 65 9.140 51.220 31.120 1.00 0.00 ATOM 7794 H7S DPP 65 9.800 52.770 31.400 1.00 0.00 ATOM 7795 C28 DPP 65 11.320 51.340 31.180 1.00 0.00 ATOM 7796 H8R DPP 65 12.150 51.970 30.790 1.00 0.00 ATOM 7797 H8S DPP 65 11.430 50.320 30.760 1.00 0.00 ATOM 7798 C29 DPP 65 11.400 51.280 32.710 1.00 0.00 ATOM 7799 H9R DPP 65 10.640 50.560 33.090 1.00 0.00 ATOM 7800 H9S DPP 65 11.050 52.260 33.100 1.00 0.00 ATOM 7801 0C21 DPP 65 12.770 50.900 33.270 1.00 0.00 ATOM 7802 H10R DPP 65 13.430 51.780 33.100 1.00 0.00 ATOM 7803 H10S DPP 65 12.970 50.010 32.630 1.00 0.00 ATOM 7804 1C21 DPP 65 12.890 50.700 34.780 1.00 0.00 ATOM 7805 H11R DPP 65 13.940 50.410 35.020 1.00 0.00 ATOM 7806 H11S DPP 65 12.110 49.930 34.990 1.00 0.00 ATOM 7807 2C21 DPP 65 12.550 51.930 35.610 1.00 0.00 ATOM 7808 H12R DPP 65 11.470 52.190 35.630 1.00 0.00 ATOM 7809 H12S DPP 65 13.130 52.730 35.110 1.00 0.00 ATOM 7810 3C21 DPP 65 13.110 51.810 37.030 1.00 0.00 ATOM 7811 H13R DPP 65 14.190 51.540 36.920 1.00 0.00 ATOM 7812 H13S DPP 65 12.600 50.930 37.480 1.00 0.00 ATOM 7813 4C21 DPP 65 12.980 53.120 37.810 1.00 0.00 ATOM 7814 H14R DPP 65 11.930 53.470 37.800 1.00 0.00 ATOM 7815 H14S DPP 65 13.500 54.000 37.380 1.00 0.00 ATOM 7816 5C21 DPP 65 13.490 53.130 39.250 1.00 0.00 ATOM 7817 H15R DPP 65 14.510 52.690 39.180 1.00 0.00 ATOM 7818 H15S DPP 65 12.880 52.370 39.790 1.00 0.00 ATOM 7819 6C21 DPP 65 13.600 54.460 40.000 1.00 0.00 ATOM 7820 H16R DPP 65 14.300 55.150 39.490 1.00 0.00 ATOM 7821 H16S DPP 65 13.990 54.170 41.000 1.00 0.00 ATOM 7822 H16T DPP 65 12.640 55.010 40.020 1.00 0.00 ATOM 7823 C33 DPP 65 5.070 55.770 29.360 1.00 0.00 ATOM 7824 H3X DPP 65 4.080 56.220 29.120 1.00 0.00 ATOM 7825 H3Y DPP 65 5.670 56.660 29.640 1.00 0.00 ATOM 7826 C34 DPP 65 4.870 55.060 30.700 1.00 0.00 ATOM 7827 H4X DPP 65 4.540 54.010 30.570 1.00 0.00 ATOM 7828 H4Y DPP 65 4.030 55.620 31.180 1.00 0.00 ATOM 7829 C35 DPP 65 6.040 55.400 31.620 1.00 0.00 ATOM 7830 H5X DPP 65 6.170 56.500 31.720 1.00 0.00 ATOM 7831 H5Y DPP 65 6.990 54.910 31.350 1.00 0.00 ATOM 7832 C36 DPP 65 5.750 54.820 33.010 1.00 0.00 ATOM 7833 H6X DPP 65 5.720 53.710 32.970 1.00 0.00 ATOM 7834 H6Y DPP 65 4.780 55.200 33.400 1.00 0.00 ATOM 7835 C37 DPP 65 6.790 55.190 34.070 1.00 0.00 ATOM 7836 H7X DPP 65 6.730 56.280 34.270 1.00 0.00 ATOM 7837 H7Y DPP 65 7.750 54.990 33.540 1.00 0.00 ATOM 7838 C38 DPP 65 6.770 54.370 35.360 1.00 0.00 ATOM 7839 H8X DPP 65 7.610 54.630 36.040 1.00 0.00 ATOM 7840 H8Y DPP 65 6.790 53.340 34.940 1.00 0.00 ATOM 7841 C39 DPP 65 5.510 54.590 36.200 1.00 0.00 ATOM 7842 H9X DPP 65 4.790 54.170 35.470 1.00 0.00 ATOM 7843 H9Y DPP 65 5.400 55.670 36.400 1.00 0.00 ATOM 7844 0C31 DPP 65 5.430 53.850 37.540 1.00 0.00 ATOM 7845 H10X DPP 65 6.010 54.340 38.350 1.00 0.00 ATOM 7846 H10Y DPP 65 5.940 52.880 37.340 1.00 0.00 ATOM 7847 1C31 DPP 65 3.960 53.660 37.920 1.00 0.00 ATOM 7848 H11X DPP 65 3.480 53.050 37.120 1.00 0.00 ATOM 7849 H11Y DPP 65 3.620 54.710 37.830 1.00 0.00 ATOM 7850 2C31 DPP 65 3.810 53.090 39.330 1.00 0.00 ATOM 7851 H12X DPP 65 2.740 52.830 39.410 1.00 0.00 ATOM 7852 H12Y DPP 65 4.130 53.990 39.890 1.00 0.00 ATOM 7853 3C31 DPP 65 4.680 51.910 39.780 1.00 0.00 ATOM 7854 H13X DPP 65 4.990 52.240 40.800 1.00 0.00 ATOM 7855 H13Y DPP 65 5.660 51.890 39.270 1.00 0.00 ATOM 7856 4C31 DPP 65 4.070 50.510 39.750 1.00 0.00 ATOM 7857 H14X DPP 65 4.730 49.650 39.990 1.00 0.00 ATOM 7858 H14Y DPP 65 3.690 50.350 38.720 1.00 0.00 ATOM 7859 5C31 DPP 65 2.780 50.270 40.540 1.00 0.00 ATOM 7860 H15X DPP 65 2.790 49.160 40.660 1.00 0.00 ATOM 7861 H15Y DPP 65 1.900 50.490 39.910 1.00 0.00 ATOM 7862 6C31 DPP 65 2.740 51.060 41.850 1.00 0.00 ATOM 7863 H16X DPP 65 3.670 50.910 42.450 1.00 0.00 ATOM 7864 H16Y DPP 65 1.780 50.780 42.330 1.00 0.00 ATOM 7865 H16Z DPP 65 2.530 52.140 41.720 1.00 0.00 ATOM 7866 N DPP 66 15.030 42.990 20.170 1.00 0.00 ATOM 7867 HN1 DPP 66 15.010 44.030 20.170 1.00 0.00 ATOM 7868 HN2 DPP 66 14.350 42.550 19.520 1.00 0.00 ATOM 7869 HN3 DPP 66 15.010 42.720 21.180 1.00 0.00 ATOM 7870 C12 DPP 66 16.350 42.640 19.520 1.00 0.00 ATOM 7871 H12A DPP 66 16.270 41.540 19.340 1.00 0.00 ATOM 7872 H12B DPP 66 16.520 43.190 18.570 1.00 0.00 ATOM 7873 C11 DPP 66 17.420 43.070 20.520 1.00 0.00 ATOM 7874 H11A DPP 66 17.390 44.180 20.520 1.00 0.00 ATOM 7875 H11B DPP 66 18.460 42.970 20.140 1.00 0.00 ATOM 7876 P DPP 66 18.160 41.330 22.240 1.00 0.00 ATOM 7877 O13 DPP 66 18.970 40.840 21.100 1.00 0.00 ATOM 7878 O14 DPP 66 17.100 40.340 22.570 1.00 0.00 ATOM 7879 O11 DPP 66 18.990 41.800 23.520 1.00 0.00 ATOM 7880 O12 DPP 66 17.260 42.600 21.860 1.00 0.00 ATOM 7881 C1 DPP 66 19.440 43.150 23.690 1.00 0.00 ATOM 7882 HA DPP 66 19.110 43.770 22.830 1.00 0.00 ATOM 7883 HB DPP 66 20.540 43.050 23.550 1.00 0.00 ATOM 7884 C2 DPP 66 19.010 43.830 25.000 1.00 0.00 ATOM 7885 HS DPP 66 19.610 44.740 25.210 1.00 0.00 ATOM 7886 O21 DPP 66 19.050 42.900 26.100 1.00 0.00 ATOM 7887 C21 DPP 66 20.330 42.780 26.440 1.00 0.00 ATOM 7888 O22 DPP 66 21.240 43.410 25.920 1.00 0.00 ATOM 7889 C22 DPP 66 20.530 41.790 27.570 1.00 0.00 ATOM 7890 H2R DPP 66 21.410 41.220 27.210 1.00 0.00 ATOM 7891 H2S DPP 66 19.660 41.110 27.710 1.00 0.00 ATOM 7892 C3 DPP 66 17.540 44.280 24.930 1.00 0.00 ATOM 7893 HX DPP 66 16.900 43.380 24.880 1.00 0.00 ATOM 7894 HY DPP 66 17.470 44.840 23.970 1.00 0.00 ATOM 7895 O31 DPP 66 17.130 45.070 26.050 1.00 0.00 ATOM 7896 C31 DPP 66 17.550 46.330 26.130 1.00 0.00 ATOM 7897 O32 DPP 66 18.170 46.910 25.250 1.00 0.00 ATOM 7898 C32 DPP 66 17.220 46.890 27.500 1.00 0.00 ATOM 7899 H2X DPP 66 17.000 46.010 28.150 1.00 0.00 ATOM 7900 H2Y DPP 66 16.370 47.590 27.360 1.00 0.00 ATOM 7901 C23 DPP 66 20.760 42.570 28.870 1.00 0.00 ATOM 7902 H3R DPP 66 19.890 43.270 28.830 1.00 0.00 ATOM 7903 H3S DPP 66 21.670 43.190 28.710 1.00 0.00 ATOM 7904 C24 DPP 66 21.190 41.780 30.100 1.00 0.00 ATOM 7905 H4R DPP 66 21.460 42.520 30.880 1.00 0.00 ATOM 7906 H4S DPP 66 22.100 41.190 29.880 1.00 0.00 ATOM 7907 C25 DPP 66 20.060 40.860 30.590 1.00 0.00 ATOM 7908 H5R DPP 66 19.660 40.300 29.720 1.00 0.00 ATOM 7909 H5S DPP 66 19.270 41.630 30.760 1.00 0.00 ATOM 7910 C26 DPP 66 20.430 40.020 31.810 1.00 0.00 ATOM 7911 H6R DPP 66 21.110 39.220 31.450 1.00 0.00 ATOM 7912 H6S DPP 66 19.490 39.500 32.090 1.00 0.00 ATOM 7913 C27 DPP 66 20.960 40.780 33.030 1.00 0.00 ATOM 7914 H7R DPP 66 21.850 41.320 32.640 1.00 0.00 ATOM 7915 H7S DPP 66 21.300 40.040 33.780 1.00 0.00 ATOM 7916 C28 DPP 66 20.090 41.880 33.640 1.00 0.00 ATOM 7917 H8R DPP 66 19.130 41.420 33.960 1.00 0.00 ATOM 7918 H8S DPP 66 19.720 42.680 32.980 1.00 0.00 ATOM 7919 C29 DPP 66 20.710 42.510 34.890 1.00 0.00 ATOM 7920 H9R DPP 66 19.930 43.140 35.360 1.00 0.00 ATOM 7921 H9S DPP 66 21.590 43.060 34.510 1.00 0.00 ATOM 7922 0C21 DPP 66 21.210 41.500 35.930 1.00 0.00 ATOM 7923 H10R DPP 66 22.130 40.980 35.570 1.00 0.00 ATOM 7924 H10S DPP 66 20.430 40.740 36.130 1.00 0.00 ATOM 7925 1C21 DPP 66 21.740 42.280 37.130 1.00 0.00 ATOM 7926 H11R DPP 66 20.810 42.690 37.580 1.00 0.00 ATOM 7927 H11S DPP 66 22.380 43.090 36.710 1.00 0.00 ATOM 7928 2C21 DPP 66 22.510 41.470 38.170 1.00 0.00 ATOM 7929 H12R DPP 66 23.350 40.960 37.650 1.00 0.00 ATOM 7930 H12S DPP 66 21.980 40.620 38.650 1.00 0.00 ATOM 7931 3C21 DPP 66 23.130 42.280 39.310 1.00 0.00 ATOM 7932 H13R DPP 66 22.490 43.160 39.480 1.00 0.00 ATOM 7933 H13S DPP 66 24.030 42.760 38.880 1.00 0.00 ATOM 7934 4C21 DPP 66 23.620 41.580 40.590 1.00 0.00 ATOM 7935 H14R DPP 66 24.220 40.720 40.220 1.00 0.00 ATOM 7936 H14S DPP 66 22.840 41.180 41.270 1.00 0.00 ATOM 7937 5C21 DPP 66 24.580 42.460 41.390 1.00 0.00 ATOM 7938 H15R DPP 66 25.470 42.860 40.870 1.00 0.00 ATOM 7939 H15S DPP 66 25.110 41.850 42.160 1.00 0.00 ATOM 7940 6C21 DPP 66 24.000 43.690 42.100 1.00 0.00 ATOM 7941 H16R DPP 66 23.290 43.230 42.820 1.00 0.00 ATOM 7942 H16S DPP 66 23.500 44.380 41.390 1.00 0.00 ATOM 7943 H16T DPP 66 24.790 44.240 42.650 1.00 0.00 ATOM 7944 C33 DPP 66 18.350 47.720 28.100 1.00 0.00 ATOM 7945 H3X DPP 66 17.970 48.380 28.910 1.00 0.00 ATOM 7946 H3Y DPP 66 18.680 48.320 27.220 1.00 0.00 ATOM 7947 C34 DPP 66 19.580 47.010 28.660 1.00 0.00 ATOM 7948 H4X DPP 66 20.320 47.820 28.800 1.00 0.00 ATOM 7949 H4Y DPP 66 19.950 46.330 27.850 1.00 0.00 ATOM 7950 C35 DPP 66 19.340 46.200 29.940 1.00 0.00 ATOM 7951 H5X DPP 66 20.220 45.590 30.210 1.00 0.00 ATOM 7952 H5Y DPP 66 18.660 45.370 29.640 1.00 0.00 ATOM 7953 C36 DPP 66 18.830 46.910 31.190 1.00 0.00 ATOM 7954 H6X DPP 66 17.900 47.470 30.940 1.00 0.00 ATOM 7955 H6Y DPP 66 19.610 47.640 31.490 1.00 0.00 ATOM 7956 C37 DPP 66 18.360 45.920 32.260 1.00 0.00 ATOM 7957 H7X DPP 66 17.900 45.060 31.740 1.00 0.00 ATOM 7958 H7Y DPP 66 17.600 46.410 32.910 1.00 0.00 ATOM 7959 C38 DPP 66 19.490 45.460 33.190 1.00 0.00 ATOM 7960 H8X DPP 66 20.430 45.110 32.720 1.00 0.00 ATOM 7961 H8Y DPP 66 18.990 44.610 33.700 1.00 0.00 ATOM 7962 C39 DPP 66 19.770 46.590 34.190 1.00 0.00 ATOM 7963 H9X DPP 66 18.790 46.960 34.560 1.00 0.00 ATOM 7964 H9Y DPP 66 20.230 47.450 33.660 1.00 0.00 ATOM 7965 0C31 DPP 66 20.710 46.090 35.290 1.00 0.00 ATOM 7966 H10X DPP 66 21.510 45.520 34.780 1.00 0.00 ATOM 7967 H10Y DPP 66 20.050 45.430 35.900 1.00 0.00 ATOM 7968 1C31 DPP 66 21.350 47.230 36.090 1.00 0.00 ATOM 7969 H11X DPP 66 20.540 47.840 36.550 1.00 0.00 ATOM 7970 H11Y DPP 66 21.950 47.840 35.380 1.00 0.00 ATOM 7971 2C31 DPP 66 22.220 46.680 37.220 1.00 0.00 ATOM 7972 H12X DPP 66 23.290 46.940 37.080 1.00 0.00 ATOM 7973 H12Y DPP 66 22.210 45.590 37.400 1.00 0.00 ATOM 7974 3C31 DPP 66 21.790 47.270 38.560 1.00 0.00 ATOM 7975 H13X DPP 66 20.720 47.030 38.750 1.00 0.00 ATOM 7976 H13Y DPP 66 21.810 48.380 38.440 1.00 0.00 ATOM 7977 4C31 DPP 66 22.730 46.900 39.710 1.00 0.00 ATOM 7978 H14X DPP 66 23.780 46.950 39.330 1.00 0.00 ATOM 7979 H14Y DPP 66 22.510 45.880 40.080 1.00 0.00 ATOM 7980 5C31 DPP 66 22.510 47.810 40.930 1.00 0.00 ATOM 7981 H15X DPP 66 22.620 48.880 40.650 1.00 0.00 ATOM 7982 H15Y DPP 66 23.380 47.730 41.610 1.00 0.00 ATOM 7983 6C31 DPP 66 21.130 47.600 41.550 1.00 0.00 ATOM 7984 H16X DPP 66 20.980 46.520 41.790 1.00 0.00 ATOM 7985 H16Y DPP 66 20.210 47.900 41.000 1.00 0.00 ATOM 7986 H16Z DPP 66 21.150 48.120 42.530 1.00 0.00 ATOM 7987 N DPP 67 16.370 50.470 21.450 1.00 0.00 ATOM 7988 HN1 DPP 67 15.560 51.090 21.680 1.00 0.00 ATOM 7989 HN2 DPP 67 16.990 51.160 20.980 1.00 0.00 ATOM 7990 HN3 DPP 67 16.000 49.880 20.680 1.00 0.00 ATOM 7991 C12 DPP 67 16.640 49.440 22.520 1.00 0.00 ATOM 7992 H12A DPP 67 17.530 48.840 22.280 1.00 0.00 ATOM 7993 H12B DPP 67 16.920 49.980 23.450 1.00 0.00 ATOM 7994 C11 DPP 67 15.440 48.540 22.840 1.00 0.00 ATOM 7995 H11A DPP 67 14.630 49.220 23.160 1.00 0.00 ATOM 7996 H11B DPP 67 15.780 47.900 23.690 1.00 0.00 ATOM 7997 P DPP 67 15.220 46.230 21.830 1.00 0.00 ATOM 7998 O13 DPP 67 16.660 46.040 21.570 1.00 0.00 ATOM 7999 O14 DPP 67 14.290 45.570 20.890 1.00 0.00 ATOM 8000 O11 DPP 67 14.830 45.870 23.340 1.00 0.00 ATOM 8001 O12 DPP 67 14.930 47.800 21.730 1.00 0.00 ATOM 8002 C1 DPP 67 13.890 44.800 23.520 1.00 0.00 ATOM 8003 HA DPP 67 13.800 44.470 24.580 1.00 0.00 ATOM 8004 HB DPP 67 14.140 43.900 22.930 1.00 0.00 ATOM 8005 C2 DPP 67 12.430 45.220 23.290 1.00 0.00 ATOM 8006 HS DPP 67 12.340 45.570 22.240 1.00 0.00 ATOM 8007 O21 DPP 67 12.190 46.340 24.150 1.00 0.00 ATOM 8008 C21 DPP 67 11.170 47.130 23.830 1.00 0.00 ATOM 8009 O22 DPP 67 10.590 47.070 22.750 1.00 0.00 ATOM 8010 C22 DPP 67 10.890 48.060 25.000 1.00 0.00 ATOM 8011 H2R DPP 67 9.790 48.130 25.050 1.00 0.00 ATOM 8012 H2S DPP 67 11.230 49.100 24.790 1.00 0.00 ATOM 8013 C3 DPP 67 11.340 44.170 23.590 1.00 0.00 ATOM 8014 HX DPP 67 11.560 43.410 22.800 1.00 0.00 ATOM 8015 HY DPP 67 10.370 44.670 23.390 1.00 0.00 ATOM 8016 O31 DPP 67 11.500 43.670 24.920 1.00 0.00 ATOM 8017 C31 DPP 67 10.640 42.670 25.120 1.00 0.00 ATOM 8018 O32 DPP 67 9.640 42.460 24.440 1.00 0.00 ATOM 8019 C32 DPP 67 10.950 41.980 26.440 1.00 0.00 ATOM 8020 H2X DPP 67 11.960 41.520 26.440 1.00 0.00 ATOM 8021 H2Y DPP 67 10.260 41.120 26.530 1.00 0.00 ATOM 8022 C23 DPP 67 11.420 47.650 26.380 1.00 0.00 ATOM 8023 H3R DPP 67 11.120 46.650 26.740 1.00 0.00 ATOM 8024 H3S DPP 67 10.870 48.330 27.080 1.00 0.00 ATOM 8025 C24 DPP 67 12.920 47.850 26.570 1.00 0.00 ATOM 8026 H4R DPP 67 13.130 48.900 26.290 1.00 0.00 ATOM 8027 H4S DPP 67 13.580 47.150 26.020 1.00 0.00 ATOM 8028 C25 DPP 67 13.270 47.690 28.060 1.00 0.00 ATOM 8029 H5R DPP 67 12.740 48.570 28.470 1.00 0.00 ATOM 8030 H5S DPP 67 14.340 47.950 28.210 1.00 0.00 ATOM 8031 C26 DPP 67 12.960 46.340 28.710 1.00 0.00 ATOM 8032 H6R DPP 67 13.160 45.630 27.880 1.00 0.00 ATOM 8033 H6S DPP 67 11.890 46.380 29.010 1.00 0.00 ATOM 8034 C27 DPP 67 13.800 46.090 29.960 1.00 0.00 ATOM 8035 H7R DPP 67 14.830 45.840 29.630 1.00 0.00 ATOM 8036 H7S DPP 67 13.430 45.110 30.320 1.00 0.00 ATOM 8037 C28 DPP 67 13.710 47.020 31.170 1.00 0.00 ATOM 8038 H8R DPP 67 12.630 47.080 31.460 1.00 0.00 ATOM 8039 H8S DPP 67 14.080 48.040 30.940 1.00 0.00 ATOM 8040 C29 DPP 67 14.600 46.520 32.310 1.00 0.00 ATOM 8041 H9R DPP 67 15.630 46.540 31.880 1.00 0.00 ATOM 8042 H9S DPP 67 14.440 45.450 32.540 1.00 0.00 ATOM 8043 0C21 DPP 67 14.570 47.460 33.510 1.00 0.00 ATOM 8044 H10R DPP 67 13.480 47.650 33.640 1.00 0.00 ATOM 8045 H10S DPP 67 15.170 48.310 33.120 1.00 0.00 ATOM 8046 1C21 DPP 67 15.030 46.700 34.760 1.00 0.00 ATOM 8047 H11R DPP 67 16.090 46.380 34.640 1.00 0.00 ATOM 8048 H11S DPP 67 14.350 45.840 34.970 1.00 0.00 ATOM 8049 2C21 DPP 67 15.020 47.600 35.990 1.00 0.00 ATOM 8050 H12R DPP 67 13.980 47.990 35.950 1.00 0.00 ATOM 8051 H12S DPP 67 15.750 48.390 35.710 1.00 0.00 ATOM 8052 3C21 DPP 67 15.230 46.740 37.240 1.00 0.00 ATOM 8053 H13R DPP 67 16.330 46.560 37.190 1.00 0.00 ATOM 8054 H13S DPP 67 14.690 45.780 37.190 1.00 0.00 ATOM 8055 4C21 DPP 67 14.900 47.550 38.500 1.00 0.00 ATOM 8056 H14R DPP 67 15.790 48.170 38.710 1.00 0.00 ATOM 8057 H14S DPP 67 14.700 46.820 39.320 1.00 0.00 ATOM 8058 5C21 DPP 67 13.700 48.490 38.400 1.00 0.00 ATOM 8059 H15R DPP 67 12.880 47.830 38.060 1.00 0.00 ATOM 8060 H15S DPP 67 13.870 49.320 37.680 1.00 0.00 ATOM 8061 6C21 DPP 67 13.370 49.180 39.730 1.00 0.00 ATOM 8062 H16R DPP 67 14.090 50.000 39.860 1.00 0.00 ATOM 8063 H16S DPP 67 13.360 48.450 40.570 1.00 0.00 ATOM 8064 H16T DPP 67 12.380 49.680 39.660 1.00 0.00 ATOM 8065 C33 DPP 67 10.780 42.950 27.610 1.00 0.00 ATOM 8066 H3X DPP 67 9.690 43.130 27.720 1.00 0.00 ATOM 8067 H3Y DPP 67 11.410 43.850 27.440 1.00 0.00 ATOM 8068 C34 DPP 67 11.230 42.320 28.930 1.00 0.00 ATOM 8069 H4X DPP 67 12.300 42.030 28.960 1.00 0.00 ATOM 8070 H4Y DPP 67 10.710 41.350 29.020 1.00 0.00 ATOM 8071 C35 DPP 67 10.740 42.970 30.230 1.00 0.00 ATOM 8072 H5X DPP 67 9.730 43.360 29.980 1.00 0.00 ATOM 8073 H5Y DPP 67 11.230 43.940 30.460 1.00 0.00 ATOM 8074 C36 DPP 67 10.610 42.130 31.500 1.00 0.00 ATOM 8075 H6X DPP 67 10.520 41.110 31.080 1.00 0.00 ATOM 8076 H6Y DPP 67 9.750 42.470 32.130 1.00 0.00 ATOM 8077 C37 DPP 67 11.840 42.110 32.410 1.00 0.00 ATOM 8078 H7X DPP 67 11.930 43.100 32.920 1.00 0.00 ATOM 8079 H7Y DPP 67 12.780 41.990 31.840 1.00 0.00 ATOM 8080 C38 DPP 67 11.720 40.970 33.420 1.00 0.00 ATOM 8081 H8X DPP 67 12.310 40.130 33.000 1.00 0.00 ATOM 8082 H8Y DPP 67 10.680 40.590 33.540 1.00 0.00 ATOM 8083 C39 DPP 67 12.140 41.300 34.860 1.00 0.00 ATOM 8084 H9X DPP 67 11.710 42.260 35.220 1.00 0.00 ATOM 8085 H9Y DPP 67 13.240 41.370 34.990 1.00 0.00 ATOM 8086 0C31 DPP 67 11.720 40.270 35.910 1.00 0.00 ATOM 8087 H10X DPP 67 12.130 39.330 35.490 1.00 0.00 ATOM 8088 H10Y DPP 67 10.620 40.090 35.940 1.00 0.00 ATOM 8089 1C31 DPP 67 12.240 40.560 37.320 1.00 0.00 ATOM 8090 H11X DPP 67 11.710 41.470 37.650 1.00 0.00 ATOM 8091 H11Y DPP 67 13.320 40.790 37.230 1.00 0.00 ATOM 8092 2C31 DPP 67 12.050 39.380 38.270 1.00 0.00 ATOM 8093 H12X DPP 67 12.810 38.590 38.110 1.00 0.00 ATOM 8094 H12Y DPP 67 11.070 38.880 38.130 1.00 0.00 ATOM 8095 3C31 DPP 67 11.910 39.820 39.730 1.00 0.00 ATOM 8096 H13X DPP 67 11.310 40.750 39.790 1.00 0.00 ATOM 8097 H13Y DPP 67 12.850 40.320 40.060 1.00 0.00 ATOM 8098 4C31 DPP 67 11.230 38.860 40.720 1.00 0.00 ATOM 8099 H14X DPP 67 10.510 38.320 40.070 1.00 0.00 ATOM 8100 H14Y DPP 67 10.700 39.470 41.480 1.00 0.00 ATOM 8101 5C31 DPP 67 12.230 37.930 41.390 1.00 0.00 ATOM 8102 H15X DPP 67 13.140 38.440 41.770 1.00 0.00 ATOM 8103 H15Y DPP 67 12.480 37.090 40.700 1.00 0.00 ATOM 8104 6C31 DPP 67 11.690 37.200 42.620 1.00 0.00 ATOM 8105 H16X DPP 67 10.610 37.040 42.430 1.00 0.00 ATOM 8106 H16Y DPP 67 11.900 37.820 43.530 1.00 0.00 ATOM 8107 H16Z DPP 67 12.240 36.240 42.700 1.00 0.00 ATOM 8108 N DPP 68 55.930 46.520 19.500 1.00 0.00 ATOM 8109 HN1 DPP 68 55.460 47.420 19.310 1.00 0.00 ATOM 8110 HN2 DPP 68 56.720 46.470 18.830 1.00 0.00 ATOM 8111 HN3 DPP 68 55.290 45.700 19.370 1.00 0.00 ATOM 8112 C12 DPP 68 56.400 46.630 20.930 1.00 0.00 ATOM 8113 H12A DPP 68 57.040 47.520 20.740 1.00 0.00 ATOM 8114 H12B DPP 68 56.970 45.720 21.210 1.00 0.00 ATOM 8115 C11 DPP 68 55.230 47.050 21.820 1.00 0.00 ATOM 8116 H11A DPP 68 54.920 48.090 21.600 1.00 0.00 ATOM 8117 H11B DPP 68 55.540 47.090 22.890 1.00 0.00 ATOM 8118 P DPP 68 53.080 46.310 22.800 1.00 0.00 ATOM 8119 O13 DPP 68 51.890 45.480 22.500 1.00 0.00 ATOM 8120 O14 DPP 68 52.800 47.750 22.960 1.00 0.00 ATOM 8121 O11 DPP 68 53.920 45.700 24.020 1.00 0.00 ATOM 8122 O12 DPP 68 54.160 46.120 21.630 1.00 0.00 ATOM 8123 C1 DPP 68 54.340 44.340 23.970 1.00 0.00 ATOM 8124 HA DPP 68 55.440 44.330 24.180 1.00 0.00 ATOM 8125 HB DPP 68 54.210 43.920 22.950 1.00 0.00 ATOM 8126 C2 DPP 68 53.470 43.490 24.910 1.00 0.00 ATOM 8127 HS DPP 68 52.390 43.740 24.910 1.00 0.00 ATOM 8128 O21 DPP 68 54.060 43.720 26.190 1.00 0.00 ATOM 8129 C21 DPP 68 53.130 43.600 27.150 1.00 0.00 ATOM 8130 O22 DPP 68 51.920 43.560 27.000 1.00 0.00 ATOM 8131 C22 DPP 68 53.990 43.450 28.400 1.00 0.00 ATOM 8132 H2R DPP 68 54.420 44.400 28.770 1.00 0.00 ATOM 8133 H2S DPP 68 54.840 42.770 28.200 1.00 0.00 ATOM 8134 C3 DPP 68 53.680 42.050 24.420 1.00 0.00 ATOM 8135 HX DPP 68 54.750 41.790 24.490 1.00 0.00 ATOM 8136 HY DPP 68 53.300 41.940 23.370 1.00 0.00 ATOM 8137 O31 DPP 68 52.870 41.170 25.200 1.00 0.00 ATOM 8138 C31 DPP 68 53.220 39.880 25.170 1.00 0.00 ATOM 8139 O32 DPP 68 54.200 39.350 24.670 1.00 0.00 ATOM 8140 C32 DPP 68 52.140 39.130 25.930 1.00 0.00 ATOM 8141 H2X DPP 68 52.130 38.070 25.620 1.00 0.00 ATOM 8142 H2Y DPP 68 51.180 39.690 25.850 1.00 0.00 ATOM 8143 C23 DPP 68 53.150 43.000 29.590 1.00 0.00 ATOM 8144 H3R DPP 68 52.840 41.960 29.340 1.00 0.00 ATOM 8145 H3S DPP 68 52.160 43.500 29.660 1.00 0.00 ATOM 8146 C24 DPP 68 53.960 43.120 30.880 1.00 0.00 ATOM 8147 H4R DPP 68 54.270 44.180 30.810 1.00 0.00 ATOM 8148 H4S DPP 68 54.780 42.390 30.700 1.00 0.00 ATOM 8149 C25 DPP 68 53.170 42.880 32.170 1.00 0.00 ATOM 8150 H5R DPP 68 52.800 41.830 32.160 1.00 0.00 ATOM 8151 H5S DPP 68 52.260 43.510 32.230 1.00 0.00 ATOM 8152 C26 DPP 68 54.050 43.080 33.410 1.00 0.00 ATOM 8153 H6R DPP 68 54.600 44.030 33.230 1.00 0.00 ATOM 8154 H6S DPP 68 54.750 42.230 33.550 1.00 0.00 ATOM 8155 C27 DPP 68 53.190 43.250 34.670 1.00 0.00 ATOM 8156 H7R DPP 68 52.330 42.590 34.450 1.00 0.00 ATOM 8157 H7S DPP 68 52.670 44.220 34.520 1.00 0.00 ATOM 8158 C28 DPP 68 53.930 43.110 35.990 1.00 0.00 ATOM 8159 H8R DPP 68 54.570 43.990 36.220 1.00 0.00 ATOM 8160 H8S DPP 68 54.600 42.230 35.850 1.00 0.00 ATOM 8161 C29 DPP 68 53.010 43.120 37.210 1.00 0.00 ATOM 8162 H9R DPP 68 53.680 42.680 37.980 1.00 0.00 ATOM 8163 H9S DPP 68 52.130 42.480 37.010 1.00 0.00 ATOM 8164 0C21 DPP 68 52.600 44.510 37.720 1.00 0.00 ATOM 8165 H10R DPP 68 52.130 45.040 36.870 1.00 0.00 ATOM 8166 H10S DPP 68 53.580 44.990 37.960 1.00 0.00 ATOM 8167 1C21 DPP 68 51.540 44.480 38.820 1.00 0.00 ATOM 8168 H11R DPP 68 50.620 44.020 38.400 1.00 0.00 ATOM 8169 H11S DPP 68 51.340 45.550 39.040 1.00 0.00 ATOM 8170 2C21 DPP 68 51.900 43.800 40.150 1.00 0.00 ATOM 8171 H12R DPP 68 52.790 44.370 40.480 1.00 0.00 ATOM 8172 H12S DPP 68 52.110 42.710 40.050 1.00 0.00 ATOM 8173 3C21 DPP 68 50.850 44.010 41.240 1.00 0.00 ATOM 8174 H13R DPP 68 49.960 43.420 40.940 1.00 0.00 ATOM 8175 H13S DPP 68 50.580 45.080 41.300 1.00 0.00 ATOM 8176 4C21 DPP 68 51.210 43.540 42.650 1.00 0.00 ATOM 8177 H14R DPP 68 51.770 42.580 42.570 1.00 0.00 ATOM 8178 H14S DPP 68 50.260 43.220 43.120 1.00 0.00 ATOM 8179 5C21 DPP 68 51.940 44.480 43.610 1.00 0.00 ATOM 8180 H15R DPP 68 51.330 45.410 43.600 1.00 0.00 ATOM 8181 H15S DPP 68 52.950 44.750 43.220 1.00 0.00 ATOM 8182 6C21 DPP 68 51.990 44.020 45.060 1.00 0.00 ATOM 8183 H16R DPP 68 51.930 44.890 45.750 1.00 0.00 ATOM 8184 H16S DPP 68 52.940 43.450 45.180 1.00 0.00 ATOM 8185 H16T DPP 68 51.140 43.370 45.360 1.00 0.00 ATOM 8186 C33 DPP 68 52.540 39.130 27.410 1.00 0.00 ATOM 8187 H3X DPP 68 51.640 38.750 27.920 1.00 0.00 ATOM 8188 H3Y DPP 68 52.690 40.170 27.760 1.00 0.00 ATOM 8189 C34 DPP 68 53.720 38.230 27.800 1.00 0.00 ATOM 8190 H4X DPP 68 54.490 38.420 27.020 1.00 0.00 ATOM 8191 H4Y DPP 68 53.430 37.160 27.710 1.00 0.00 ATOM 8192 C35 DPP 68 54.230 38.490 29.210 1.00 0.00 ATOM 8193 H5X DPP 68 54.850 39.420 29.220 1.00 0.00 ATOM 8194 H5Y DPP 68 54.800 37.610 29.580 1.00 0.00 ATOM 8195 C36 DPP 68 53.070 38.580 30.200 1.00 0.00 ATOM 8196 H6X DPP 68 52.410 37.740 29.880 1.00 0.00 ATOM 8197 H6Y DPP 68 52.510 39.520 30.390 1.00 0.00 ATOM 8198 C37 DPP 68 53.470 38.260 31.640 1.00 0.00 ATOM 8199 H7X DPP 68 54.260 38.980 31.940 1.00 0.00 ATOM 8200 H7Y DPP 68 54.000 37.280 31.700 1.00 0.00 ATOM 8201 C38 DPP 68 52.220 38.290 32.510 1.00 0.00 ATOM 8202 H8X DPP 68 51.500 37.450 32.390 1.00 0.00 ATOM 8203 H8Y DPP 68 51.670 39.100 31.980 1.00 0.00 ATOM 8204 C39 DPP 68 52.420 38.630 33.990 1.00 0.00 ATOM 8205 H9X DPP 68 52.920 39.610 34.110 1.00 0.00 ATOM 8206 H9Y DPP 68 53.140 37.880 34.390 1.00 0.00 ATOM 8207 0C31 DPP 68 51.170 38.420 34.850 1.00 0.00 ATOM 8208 H10X DPP 68 50.890 37.340 34.820 1.00 0.00 ATOM 8209 H10Y DPP 68 50.350 39.050 34.450 1.00 0.00 ATOM 8210 1C31 DPP 68 51.550 38.710 36.300 1.00 0.00 ATOM 8211 H11X DPP 68 52.060 39.690 36.410 1.00 0.00 ATOM 8212 H11Y DPP 68 52.290 37.930 36.590 1.00 0.00 ATOM 8213 2C31 DPP 68 50.440 38.500 37.330 1.00 0.00 ATOM 8214 H12X DPP 68 50.090 37.450 37.220 1.00 0.00 ATOM 8215 H12Y DPP 68 49.640 39.200 37.030 1.00 0.00 ATOM 8216 3C31 DPP 68 51.010 38.720 38.740 1.00 0.00 ATOM 8217 H13X DPP 68 51.410 39.750 38.670 1.00 0.00 ATOM 8218 H13Y DPP 68 51.870 38.010 38.810 1.00 0.00 ATOM 8219 4C31 DPP 68 50.030 38.610 39.910 1.00 0.00 ATOM 8220 H14X DPP 68 49.350 39.490 39.820 1.00 0.00 ATOM 8221 H14Y DPP 68 50.680 38.790 40.780 1.00 0.00 ATOM 8222 5C31 DPP 68 49.080 37.410 39.930 1.00 0.00 ATOM 8223 H15X DPP 68 49.770 36.530 40.020 1.00 0.00 ATOM 8224 H15Y DPP 68 48.500 37.330 38.980 1.00 0.00 ATOM 8225 6C31 DPP 68 48.220 37.240 41.170 1.00 0.00 ATOM 8226 H16X DPP 68 48.890 37.130 42.060 1.00 0.00 ATOM 8227 H16Y DPP 68 47.590 36.330 41.130 1.00 0.00 ATOM 8228 H16Z DPP 68 47.570 38.130 41.320 1.00 0.00 ATOM 8229 N DPP 69 37.190 22.800 22.760 1.00 0.00 ATOM 8230 HN1 DPP 69 38.010 22.760 23.410 1.00 0.00 ATOM 8231 HN2 DPP 69 36.890 23.790 22.770 1.00 0.00 ATOM 8232 HN3 DPP 69 37.470 22.610 21.780 1.00 0.00 ATOM 8233 C12 DPP 69 36.020 21.920 23.120 1.00 0.00 ATOM 8234 H12A DPP 69 36.320 20.850 23.050 1.00 0.00 ATOM 8235 H12B DPP 69 35.840 22.140 24.190 1.00 0.00 ATOM 8236 C11 DPP 69 34.750 22.220 22.320 1.00 0.00 ATOM 8237 H11A DPP 69 34.080 21.340 22.440 1.00 0.00 ATOM 8238 H11B DPP 69 35.110 22.180 21.270 1.00 0.00 ATOM 8239 P DPP 69 33.010 24.250 22.120 1.00 0.00 ATOM 8240 O13 DPP 69 32.290 23.300 21.230 1.00 0.00 ATOM 8241 O14 DPP 69 33.590 25.430 21.450 1.00 0.00 ATOM 8242 O11 DPP 69 32.170 24.640 23.420 1.00 0.00 ATOM 8243 O12 DPP 69 34.260 23.490 22.760 1.00 0.00 ATOM 8244 C1 DPP 69 32.760 24.980 24.670 1.00 0.00 ATOM 8245 HA DPP 69 32.040 25.590 25.260 1.00 0.00 ATOM 8246 HB DPP 69 33.720 25.520 24.550 1.00 0.00 ATOM 8247 C2 DPP 69 33.020 23.760 25.570 1.00 0.00 ATOM 8248 HS DPP 69 33.670 23.010 25.070 1.00 0.00 ATOM 8249 O21 DPP 69 31.760 23.150 25.880 1.00 0.00 ATOM 8250 C21 DPP 69 31.690 21.950 26.470 1.00 0.00 ATOM 8251 O22 DPP 69 32.640 21.190 26.550 1.00 0.00 ATOM 8252 C22 DPP 69 30.350 21.770 27.170 1.00 0.00 ATOM 8253 H2R DPP 69 29.680 21.180 26.490 1.00 0.00 ATOM 8254 H2S DPP 69 29.800 22.710 27.380 1.00 0.00 ATOM 8255 C3 DPP 69 33.760 24.290 26.810 1.00 0.00 ATOM 8256 HX DPP 69 34.820 24.500 26.540 1.00 0.00 ATOM 8257 HY DPP 69 33.880 23.450 27.530 1.00 0.00 ATOM 8258 O31 DPP 69 33.090 25.400 27.400 1.00 0.00 ATOM 8259 C31 DPP 69 32.290 25.010 28.400 1.00 0.00 ATOM 8260 O32 DPP 69 32.110 23.860 28.770 1.00 0.00 ATOM 8261 C32 DPP 69 31.710 26.270 29.030 1.00 0.00 ATOM 8262 H2X DPP 69 30.650 25.960 29.140 1.00 0.00 ATOM 8263 H2Y DPP 69 31.760 27.110 28.300 1.00 0.00 ATOM 8264 C23 DPP 69 30.480 21.010 28.490 1.00 0.00 ATOM 8265 H3R DPP 69 31.090 21.630 29.180 1.00 0.00 ATOM 8266 H3S DPP 69 30.960 20.030 28.280 1.00 0.00 ATOM 8267 C24 DPP 69 29.130 20.680 29.110 1.00 0.00 ATOM 8268 H4R DPP 69 28.480 19.890 28.670 1.00 0.00 ATOM 8269 H4S DPP 69 28.560 21.600 29.350 1.00 0.00 ATOM 8270 C25 DPP 69 29.470 19.990 30.440 1.00 0.00 ATOM 8271 H5R DPP 69 30.050 20.670 31.090 1.00 0.00 ATOM 8272 H5S DPP 69 30.130 19.150 30.130 1.00 0.00 ATOM 8273 C26 DPP 69 28.300 19.350 31.190 1.00 0.00 ATOM 8274 H6R DPP 69 27.630 18.830 30.470 1.00 0.00 ATOM 8275 H6S DPP 69 27.560 19.980 31.720 1.00 0.00 ATOM 8276 C27 DPP 69 28.750 18.280 32.190 1.00 0.00 ATOM 8277 H7R DPP 69 29.570 17.730 31.690 1.00 0.00 ATOM 8278 H7S DPP 69 27.910 17.590 32.430 1.00 0.00 ATOM 8279 C28 DPP 69 29.190 18.990 33.470 1.00 0.00 ATOM 8280 H8R DPP 69 28.310 19.240 34.100 1.00 0.00 ATOM 8281 H8S DPP 69 29.780 19.910 33.230 1.00 0.00 ATOM 8282 C29 DPP 69 30.120 18.050 34.230 1.00 0.00 ATOM 8283 H9R DPP 69 31.170 18.080 33.860 1.00 0.00 ATOM 8284 H9S DPP 69 29.610 17.080 34.060 1.00 0.00 ATOM 8285 0C21 DPP 69 30.240 18.340 35.730 1.00 0.00 ATOM 8286 H10R DPP 69 29.220 18.630 36.050 1.00 0.00 ATOM 8287 H10S DPP 69 30.890 19.170 36.070 1.00 0.00 ATOM 8288 1C21 DPP 69 30.740 17.130 36.510 1.00 0.00 ATOM 8289 H11R DPP 69 31.720 16.800 36.100 1.00 0.00 ATOM 8290 H11S DPP 69 29.970 16.370 36.230 1.00 0.00 ATOM 8291 2C21 DPP 69 30.640 17.220 38.030 1.00 0.00 ATOM 8292 H12R DPP 69 29.590 17.410 38.360 1.00 0.00 ATOM 8293 H12S DPP 69 31.240 18.050 38.460 1.00 0.00 ATOM 8294 3C21 DPP 69 31.170 16.000 38.780 1.00 0.00 ATOM 8295 H13R DPP 69 30.890 15.110 38.180 1.00 0.00 ATOM 8296 H13S DPP 69 30.760 16.180 39.800 1.00 0.00 ATOM 8297 4C21 DPP 69 32.690 16.150 38.880 1.00 0.00 ATOM 8298 H14R DPP 69 33.060 17.170 39.150 1.00 0.00 ATOM 8299 H14S DPP 69 32.990 15.920 37.840 1.00 0.00 ATOM 8300 5C21 DPP 69 33.340 15.190 39.880 1.00 0.00 ATOM 8301 H15R DPP 69 34.450 15.290 39.810 1.00 0.00 ATOM 8302 H15S DPP 69 32.930 14.170 39.730 1.00 0.00 ATOM 8303 6C21 DPP 69 33.030 15.540 41.330 1.00 0.00 ATOM 8304 H16R DPP 69 33.670 14.850 41.930 1.00 0.00 ATOM 8305 H16S DPP 69 32.000 15.210 41.590 1.00 0.00 ATOM 8306 H16T DPP 69 33.260 16.580 41.660 1.00 0.00 ATOM 8307 C33 DPP 69 32.400 26.700 30.330 1.00 0.00 ATOM 8308 H3X DPP 69 32.260 27.770 30.560 1.00 0.00 ATOM 8309 H3Y DPP 69 33.500 26.640 30.160 1.00 0.00 ATOM 8310 C34 DPP 69 32.090 25.990 31.650 1.00 0.00 ATOM 8311 H4X DPP 69 32.970 25.640 32.240 1.00 0.00 ATOM 8312 H4Y DPP 69 31.350 25.170 31.560 1.00 0.00 ATOM 8313 C35 DPP 69 31.420 26.930 32.640 1.00 0.00 ATOM 8314 H5X DPP 69 30.330 26.750 32.570 1.00 0.00 ATOM 8315 H5Y DPP 69 31.520 28.030 32.470 1.00 0.00 ATOM 8316 C36 DPP 69 31.990 26.780 34.050 1.00 0.00 ATOM 8317 H6X DPP 69 33.070 26.950 33.850 1.00 0.00 ATOM 8318 H6Y DPP 69 31.910 25.720 34.380 1.00 0.00 ATOM 8319 C37 DPP 69 31.320 27.660 35.110 1.00 0.00 ATOM 8320 H7X DPP 69 30.320 27.210 35.310 1.00 0.00 ATOM 8321 H7Y DPP 69 31.320 28.720 34.790 1.00 0.00 ATOM 8322 C38 DPP 69 32.120 27.680 36.420 1.00 0.00 ATOM 8323 H8X DPP 69 33.150 28.020 36.200 1.00 0.00 ATOM 8324 H8Y DPP 69 32.090 26.630 36.780 1.00 0.00 ATOM 8325 C39 DPP 69 31.520 28.680 37.410 1.00 0.00 ATOM 8326 H9X DPP 69 30.450 28.390 37.460 1.00 0.00 ATOM 8327 H9Y DPP 69 31.630 29.760 37.150 1.00 0.00 ATOM 8328 0C31 DPP 69 32.160 28.430 38.770 1.00 0.00 ATOM 8329 H10X DPP 69 33.270 28.450 38.720 1.00 0.00 ATOM 8330 H10Y DPP 69 31.790 27.420 39.060 1.00 0.00 ATOM 8331 1C31 DPP 69 31.780 29.450 39.840 1.00 0.00 ATOM 8332 H11X DPP 69 31.430 28.890 40.730 1.00 0.00 ATOM 8333 H11Y DPP 69 30.790 29.810 39.480 1.00 0.00 ATOM 8334 2C31 DPP 69 32.830 30.540 40.080 1.00 0.00 ATOM 8335 H12X DPP 69 33.340 30.880 39.150 1.00 0.00 ATOM 8336 H12Y DPP 69 33.460 29.980 40.800 1.00 0.00 ATOM 8337 3C31 DPP 69 32.120 31.740 40.710 1.00 0.00 ATOM 8338 H13X DPP 69 31.500 31.510 41.600 1.00 0.00 ATOM 8339 H13Y DPP 69 31.460 32.230 39.970 1.00 0.00 ATOM 8340 4C31 DPP 69 33.140 32.810 41.110 1.00 0.00 ATOM 8341 H14X DPP 69 33.560 33.230 40.170 1.00 0.00 ATOM 8342 H14Y DPP 69 33.940 32.300 41.680 1.00 0.00 ATOM 8343 5C31 DPP 69 32.760 34.050 41.920 1.00 0.00 ATOM 8344 H15X DPP 69 32.180 33.730 42.810 1.00 0.00 ATOM 8345 H15Y DPP 69 32.190 34.780 41.310 1.00 0.00 ATOM 8346 6C31 DPP 69 33.960 34.860 42.420 1.00 0.00 ATOM 8347 H16X DPP 69 33.680 35.850 42.850 1.00 0.00 ATOM 8348 H16Y DPP 69 34.540 34.250 43.140 1.00 0.00 ATOM 8349 H16Z DPP 69 34.620 35.060 41.540 1.00 0.00 ATOM 8350 N DPP 70 21.340 30.030 20.370 1.00 0.00 ATOM 8351 HN1 DPP 70 21.240 31.060 20.380 1.00 0.00 ATOM 8352 HN2 DPP 70 21.350 29.810 21.390 1.00 0.00 ATOM 8353 HN3 DPP 70 22.260 29.740 19.990 1.00 0.00 ATOM 8354 C12 DPP 70 20.120 29.400 19.730 1.00 0.00 ATOM 8355 H12A DPP 70 19.280 30.110 19.850 1.00 0.00 ATOM 8356 H12B DPP 70 20.390 29.200 18.670 1.00 0.00 ATOM 8357 C11 DPP 70 19.870 28.010 20.320 1.00 0.00 ATOM 8358 H11A DPP 70 20.780 27.410 20.150 1.00 0.00 ATOM 8359 H11B DPP 70 18.970 27.620 19.800 1.00 0.00 ATOM 8360 P DPP 70 19.270 26.640 22.360 1.00 0.00 ATOM 8361 O13 DPP 70 20.530 25.850 22.320 1.00 0.00 ATOM 8362 O14 DPP 70 18.090 26.130 21.640 1.00 0.00 ATOM 8363 O11 DPP 70 19.100 27.110 23.880 1.00 0.00 ATOM 8364 O12 DPP 70 19.660 28.060 21.740 1.00 0.00 ATOM 8365 C1 DPP 70 17.850 27.660 24.330 1.00 0.00 ATOM 8366 HA DPP 70 17.080 26.860 24.290 1.00 0.00 ATOM 8367 HB DPP 70 17.440 28.540 23.800 1.00 0.00 ATOM 8368 C2 DPP 70 17.950 28.000 25.830 1.00 0.00 ATOM 8369 HS DPP 70 18.780 28.750 25.870 1.00 0.00 ATOM 8370 O21 DPP 70 18.340 26.730 26.360 1.00 0.00 ATOM 8371 C21 DPP 70 19.120 26.860 27.440 1.00 0.00 ATOM 8372 O22 DPP 70 19.460 27.920 27.940 1.00 0.00 ATOM 8373 C22 DPP 70 19.770 25.500 27.660 1.00 0.00 ATOM 8374 H2R DPP 70 19.720 24.860 26.750 1.00 0.00 ATOM 8375 H2S DPP 70 19.310 25.050 28.560 1.00 0.00 ATOM 8376 C3 DPP 70 16.590 28.470 26.360 1.00 0.00 ATOM 8377 HX DPP 70 15.800 27.690 26.280 1.00 0.00 ATOM 8378 HY DPP 70 16.270 29.360 25.780 1.00 0.00 ATOM 8379 O31 DPP 70 16.560 28.740 27.770 1.00 0.00 ATOM 8380 C31 DPP 70 16.980 29.950 28.130 1.00 0.00 ATOM 8381 O32 DPP 70 17.420 30.850 27.420 1.00 0.00 ATOM 8382 C32 DPP 70 17.190 30.040 29.640 1.00 0.00 ATOM 8383 H2X DPP 70 17.090 29.040 30.110 1.00 0.00 ATOM 8384 H2Y DPP 70 16.480 30.740 30.120 1.00 0.00 ATOM 8385 C23 DPP 70 21.210 25.780 28.090 1.00 0.00 ATOM 8386 H3R DPP 70 21.520 26.680 27.530 1.00 0.00 ATOM 8387 H3S DPP 70 21.920 24.930 27.940 1.00 0.00 ATOM 8388 C24 DPP 70 21.410 26.100 29.570 1.00 0.00 ATOM 8389 H4R DPP 70 20.870 25.320 30.150 1.00 0.00 ATOM 8390 H4S DPP 70 20.970 27.090 29.810 1.00 0.00 ATOM 8391 C25 DPP 70 22.870 26.120 30.030 1.00 0.00 ATOM 8392 H5R DPP 70 23.500 26.780 29.380 1.00 0.00 ATOM 8393 H5S DPP 70 23.290 25.120 29.800 1.00 0.00 ATOM 8394 C26 DPP 70 23.170 26.310 31.520 1.00 0.00 ATOM 8395 H6R DPP 70 24.280 26.310 31.510 1.00 0.00 ATOM 8396 H6S DPP 70 22.900 25.400 32.100 1.00 0.00 ATOM 8397 C27 DPP 70 22.480 27.530 32.130 1.00 0.00 ATOM 8398 H7R DPP 70 21.390 27.360 32.220 1.00 0.00 ATOM 8399 H7S DPP 70 22.560 28.340 31.380 1.00 0.00 ATOM 8400 C28 DPP 70 23.170 27.980 33.430 1.00 0.00 ATOM 8401 H8R DPP 70 24.270 27.920 33.250 1.00 0.00 ATOM 8402 H8S DPP 70 22.890 27.250 34.220 1.00 0.00 ATOM 8403 C29 DPP 70 22.890 29.470 33.620 1.00 0.00 ATOM 8404 H9R DPP 70 21.840 29.630 33.280 1.00 0.00 ATOM 8405 H9S DPP 70 23.500 30.130 32.980 1.00 0.00 ATOM 8406 0C21 DPP 70 22.870 29.980 35.070 1.00 0.00 ATOM 8407 H10R DPP 70 23.880 29.660 35.410 1.00 0.00 ATOM 8408 H10S DPP 70 22.100 29.350 35.560 1.00 0.00 ATOM 8409 1C21 DPP 70 22.590 31.480 35.160 1.00 0.00 ATOM 8410 H11R DPP 70 21.520 31.620 34.890 1.00 0.00 ATOM 8411 H11S DPP 70 23.130 32.050 34.360 1.00 0.00 ATOM 8412 2C21 DPP 70 22.730 32.190 36.500 1.00 0.00 ATOM 8413 H12R DPP 70 22.530 33.280 36.370 1.00 0.00 ATOM 8414 H12S DPP 70 23.780 32.150 36.840 1.00 0.00 ATOM 8415 3C21 DPP 70 21.910 31.570 37.640 1.00 0.00 ATOM 8416 H13R DPP 70 22.430 30.910 38.360 1.00 0.00 ATOM 8417 H13S DPP 70 20.990 31.170 37.160 1.00 0.00 ATOM 8418 4C21 DPP 70 21.430 32.630 38.640 1.00 0.00 ATOM 8419 H14R DPP 70 20.680 33.320 38.200 1.00 0.00 ATOM 8420 H14S DPP 70 22.320 33.160 39.040 1.00 0.00 ATOM 8421 5C21 DPP 70 20.650 31.950 39.770 1.00 0.00 ATOM 8422 H15R DPP 70 21.440 31.300 40.200 1.00 0.00 ATOM 8423 H15S DPP 70 19.850 31.270 39.430 1.00 0.00 ATOM 8424 6C21 DPP 70 20.070 32.950 40.760 1.00 0.00 ATOM 8425 H16R DPP 70 19.160 33.400 40.300 1.00 0.00 ATOM 8426 H16S DPP 70 20.790 33.770 40.990 1.00 0.00 ATOM 8427 H16T DPP 70 19.860 32.390 41.700 1.00 0.00 ATOM 8428 C33 DPP 70 18.570 30.650 29.900 1.00 0.00 ATOM 8429 H3X DPP 70 18.430 31.640 29.400 1.00 0.00 ATOM 8430 H3Y DPP 70 19.350 30.030 29.420 1.00 0.00 ATOM 8431 C34 DPP 70 18.980 30.860 31.360 1.00 0.00 ATOM 8432 H4X DPP 70 20.080 30.940 31.450 1.00 0.00 ATOM 8433 H4Y DPP 70 18.700 29.890 31.840 1.00 0.00 ATOM 8434 C35 DPP 70 18.220 32.030 31.990 1.00 0.00 ATOM 8435 H5X DPP 70 17.180 31.650 32.010 1.00 0.00 ATOM 8436 H5Y DPP 70 18.330 32.950 31.390 1.00 0.00 ATOM 8437 C36 DPP 70 18.650 32.450 33.400 1.00 0.00 ATOM 8438 H6X DPP 70 19.680 32.870 33.460 1.00 0.00 ATOM 8439 H6Y DPP 70 18.680 31.590 34.090 1.00 0.00 ATOM 8440 C37 DPP 70 17.630 33.500 33.870 1.00 0.00 ATOM 8441 H7X DPP 70 16.720 32.870 33.750 1.00 0.00 ATOM 8442 H7Y DPP 70 17.600 34.310 33.110 1.00 0.00 ATOM 8443 C38 DPP 70 17.920 33.990 35.290 1.00 0.00 ATOM 8444 H8X DPP 70 17.320 34.920 35.400 1.00 0.00 ATOM 8445 H8Y DPP 70 18.990 34.240 35.430 1.00 0.00 ATOM 8446 C39 DPP 70 17.350 33.030 36.330 1.00 0.00 ATOM 8447 H9X DPP 70 18.180 32.350 36.620 1.00 0.00 ATOM 8448 H9Y DPP 70 16.500 32.360 36.060 1.00 0.00 ATOM 8449 0C31 DPP 70 16.810 33.900 37.460 1.00 0.00 ATOM 8450 H10X DPP 70 15.990 34.610 37.220 1.00 0.00 ATOM 8451 H10Y DPP 70 17.670 34.460 37.880 1.00 0.00 ATOM 8452 1C31 DPP 70 16.190 33.200 38.680 1.00 0.00 ATOM 8453 H11X DPP 70 16.940 32.700 39.330 1.00 0.00 ATOM 8454 H11Y DPP 70 15.440 32.440 38.360 1.00 0.00 ATOM 8455 2C31 DPP 70 15.570 34.240 39.600 1.00 0.00 ATOM 8456 H12X DPP 70 14.790 34.900 39.150 1.00 0.00 ATOM 8457 H12Y DPP 70 16.450 34.780 40.010 1.00 0.00 ATOM 8458 3C31 DPP 70 14.840 33.560 40.760 1.00 0.00 ATOM 8459 H13X DPP 70 14.020 32.950 40.320 1.00 0.00 ATOM 8460 H13Y DPP 70 14.390 34.390 41.360 1.00 0.00 ATOM 8461 4C31 DPP 70 15.740 32.670 41.620 1.00 0.00 ATOM 8462 H14X DPP 70 16.620 33.250 41.970 1.00 0.00 ATOM 8463 H14Y DPP 70 16.050 31.830 40.950 1.00 0.00 ATOM 8464 5C31 DPP 70 15.110 31.860 42.750 1.00 0.00 ATOM 8465 H15X DPP 70 14.400 32.570 43.230 1.00 0.00 ATOM 8466 H15Y DPP 70 15.850 31.650 43.550 1.00 0.00 ATOM 8467 6C31 DPP 70 14.350 30.590 42.380 1.00 0.00 ATOM 8468 H16X DPP 70 13.540 30.840 41.650 1.00 0.00 ATOM 8469 H16Y DPP 70 15.100 29.930 41.900 1.00 0.00 ATOM 8470 H16Z DPP 70 13.940 30.070 43.270 1.00 0.00 ATOM 8471 N DPP 71 51.970 5.780 22.620 1.00 0.00 ATOM 8472 HN1 DPP 71 52.120 5.100 23.390 1.00 0.00 ATOM 8473 HN2 DPP 71 52.410 6.710 22.770 1.00 0.00 ATOM 8474 HN3 DPP 71 50.940 5.830 22.480 1.00 0.00 ATOM 8475 C12 DPP 71 52.550 5.170 21.370 1.00 0.00 ATOM 8476 H12A DPP 71 52.720 5.950 20.600 1.00 0.00 ATOM 8477 H12B DPP 71 51.870 4.390 20.970 1.00 0.00 ATOM 8478 C11 DPP 71 53.840 4.540 21.880 1.00 0.00 ATOM 8479 H11A DPP 71 54.360 4.040 21.040 1.00 0.00 ATOM 8480 H11B DPP 71 54.600 5.300 22.200 1.00 0.00 ATOM 8481 P DPP 71 54.790 2.750 23.330 1.00 0.00 ATOM 8482 O13 DPP 71 55.860 3.670 23.790 1.00 0.00 ATOM 8483 O14 DPP 71 55.190 1.940 22.150 1.00 0.00 ATOM 8484 O11 DPP 71 54.260 1.780 24.480 1.00 0.00 ATOM 8485 O12 DPP 71 53.510 3.610 22.910 1.00 0.00 ATOM 8486 C1 DPP 71 52.910 1.320 24.400 1.00 0.00 ATOM 8487 HA DPP 71 52.920 0.210 24.310 1.00 0.00 ATOM 8488 HB DPP 71 52.190 1.760 23.670 1.00 0.00 ATOM 8489 C2 DPP 71 52.300 1.500 25.800 1.00 0.00 ATOM 8490 HS DPP 71 52.250 2.590 25.960 1.00 0.00 ATOM 8491 O21 DPP 71 53.120 0.780 26.720 1.00 0.00 ATOM 8492 C21 DPP 71 53.140 1.340 27.920 1.00 0.00 ATOM 8493 O22 DPP 71 52.400 2.250 28.280 1.00 0.00 ATOM 8494 C22 DPP 71 54.070 0.560 28.840 1.00 0.00 ATOM 8495 H2R DPP 71 55.040 0.920 28.440 1.00 0.00 ATOM 8496 H2S DPP 71 53.980 -0.510 28.570 1.00 0.00 ATOM 8497 C3 DPP 71 50.900 0.860 25.680 1.00 0.00 ATOM 8498 HX DPP 71 51.110 -0.210 25.470 1.00 0.00 ATOM 8499 HY DPP 71 50.460 1.320 24.770 1.00 0.00 ATOM 8500 O31 DPP 71 50.100 0.950 26.860 1.00 0.00 ATOM 8501 C31 DPP 71 49.570 2.170 26.990 1.00 0.00 ATOM 8502 O32 DPP 71 49.700 3.100 26.220 1.00 0.00 ATOM 8503 C32 DPP 71 48.610 2.230 28.170 1.00 0.00 ATOM 8504 H2X DPP 71 47.870 1.410 28.160 1.00 0.00 ATOM 8505 H2Y DPP 71 48.060 3.190 28.290 1.00 0.00 ATOM 8506 C23 DPP 71 53.810 0.540 30.350 1.00 0.00 ATOM 8507 H3R DPP 71 53.460 1.520 30.720 1.00 0.00 ATOM 8508 H3S DPP 71 54.820 0.280 30.720 1.00 0.00 ATOM 8509 C24 DPP 71 52.810 -0.490 30.890 1.00 0.00 ATOM 8510 H4R DPP 71 53.200 -1.520 30.770 1.00 0.00 ATOM 8511 H4S DPP 71 51.830 -0.260 30.420 1.00 0.00 ATOM 8512 C25 DPP 71 52.570 -0.360 32.390 1.00 0.00 ATOM 8513 H5R DPP 71 51.710 -1.030 32.600 1.00 0.00 ATOM 8514 H5S DPP 71 52.250 0.680 32.620 1.00 0.00 ATOM 8515 C26 DPP 71 53.790 -0.790 33.210 1.00 0.00 ATOM 8516 H6R DPP 71 54.730 -0.240 33.040 1.00 0.00 ATOM 8517 H6S DPP 71 54.080 -1.850 33.070 1.00 0.00 ATOM 8518 C27 DPP 71 53.550 -0.680 34.720 1.00 0.00 ATOM 8519 H7R DPP 71 52.580 -1.170 34.940 1.00 0.00 ATOM 8520 H7S DPP 71 53.510 0.420 34.880 1.00 0.00 ATOM 8521 C28 DPP 71 54.640 -1.200 35.660 1.00 0.00 ATOM 8522 H8R DPP 71 55.420 -0.440 35.860 1.00 0.00 ATOM 8523 H8S DPP 71 55.100 -2.020 35.070 1.00 0.00 ATOM 8524 C29 DPP 71 54.130 -1.810 36.970 1.00 0.00 ATOM 8525 H9R DPP 71 53.430 -2.660 36.820 1.00 0.00 ATOM 8526 H9S DPP 71 53.630 -0.970 37.510 1.00 0.00 ATOM 8527 0C21 DPP 71 55.290 -2.320 37.820 1.00 0.00 ATOM 8528 H10R DPP 71 56.090 -2.890 37.300 1.00 0.00 ATOM 8529 H10S DPP 71 54.850 -3.160 38.410 1.00 0.00 ATOM 8530 1C21 DPP 71 55.930 -1.300 38.760 1.00 0.00 ATOM 8531 H11R DPP 71 55.050 -0.950 39.340 1.00 0.00 ATOM 8532 H11S DPP 71 56.100 -0.370 38.170 1.00 0.00 ATOM 8533 2C21 DPP 71 57.040 -1.900 39.640 1.00 0.00 ATOM 8534 H12R DPP 71 57.810 -2.400 39.020 1.00 0.00 ATOM 8535 H12S DPP 71 56.610 -2.670 40.310 1.00 0.00 ATOM 8536 3C21 DPP 71 57.600 -0.760 40.490 1.00 0.00 ATOM 8537 H13R DPP 71 56.830 0.010 40.720 1.00 0.00 ATOM 8538 H13S DPP 71 58.420 -0.220 39.970 1.00 0.00 ATOM 8539 4C21 DPP 71 58.120 -1.250 41.850 1.00 0.00 ATOM 8540 H14R DPP 71 58.880 -2.020 41.610 1.00 0.00 ATOM 8541 H14S DPP 71 57.280 -1.610 42.470 1.00 0.00 ATOM 8542 5C21 DPP 71 59.000 -0.250 42.600 1.00 0.00 ATOM 8543 H15R DPP 71 59.780 0.290 42.020 1.00 0.00 ATOM 8544 H15S DPP 71 59.530 -0.780 43.420 1.00 0.00 ATOM 8545 6C21 DPP 71 58.150 0.870 43.190 1.00 0.00 ATOM 8546 H16R DPP 71 58.780 1.460 43.890 1.00 0.00 ATOM 8547 H16S DPP 71 57.380 0.400 43.850 1.00 0.00 ATOM 8548 H16T DPP 71 57.720 1.510 42.390 1.00 0.00 ATOM 8549 C33 DPP 71 49.440 2.190 29.460 1.00 0.00 ATOM 8550 H3X DPP 71 50.370 2.800 29.380 1.00 0.00 ATOM 8551 H3Y DPP 71 49.690 1.110 29.560 1.00 0.00 ATOM 8552 C34 DPP 71 48.660 2.480 30.740 1.00 0.00 ATOM 8553 H4X DPP 71 48.540 3.590 30.830 1.00 0.00 ATOM 8554 H4Y DPP 71 47.710 1.920 30.660 1.00 0.00 ATOM 8555 C35 DPP 71 49.440 2.050 31.990 1.00 0.00 ATOM 8556 H5X DPP 71 50.440 2.520 32.050 1.00 0.00 ATOM 8557 H5Y DPP 71 49.640 0.970 31.850 1.00 0.00 ATOM 8558 C36 DPP 71 48.540 2.320 33.200 1.00 0.00 ATOM 8559 H6X DPP 71 47.720 1.580 33.190 1.00 0.00 ATOM 8560 H6Y DPP 71 48.150 3.340 32.960 1.00 0.00 ATOM 8561 C37 DPP 71 49.140 2.160 34.590 1.00 0.00 ATOM 8562 H7X DPP 71 49.620 1.160 34.650 1.00 0.00 ATOM 8563 H7Y DPP 71 48.340 2.230 35.360 1.00 0.00 ATOM 8564 C38 DPP 71 50.250 3.180 34.860 1.00 0.00 ATOM 8565 H8X DPP 71 49.790 4.190 34.920 1.00 0.00 ATOM 8566 H8Y DPP 71 50.930 3.370 34.000 1.00 0.00 ATOM 8567 C39 DPP 71 50.920 2.840 36.190 1.00 0.00 ATOM 8568 H9X DPP 71 51.360 1.820 36.070 1.00 0.00 ATOM 8569 H9Y DPP 71 50.050 2.840 36.890 1.00 0.00 ATOM 8570 0C31 DPP 71 51.900 3.910 36.660 1.00 0.00 ATOM 8571 H10X DPP 71 51.370 4.890 36.630 1.00 0.00 ATOM 8572 H10Y DPP 71 52.600 3.960 35.790 1.00 0.00 ATOM 8573 1C31 DPP 71 52.480 3.690 38.050 1.00 0.00 ATOM 8574 H11X DPP 71 53.350 4.380 38.090 1.00 0.00 ATOM 8575 H11Y DPP 71 52.870 2.670 38.230 1.00 0.00 ATOM 8576 2C31 DPP 71 51.550 4.180 39.160 1.00 0.00 ATOM 8577 H12X DPP 71 50.600 3.600 39.160 1.00 0.00 ATOM 8578 H12Y DPP 71 51.430 5.260 38.910 1.00 0.00 ATOM 8579 3C31 DPP 71 52.140 4.080 40.570 1.00 0.00 ATOM 8580 H13X DPP 71 51.450 4.500 41.330 1.00 0.00 ATOM 8581 H13Y DPP 71 53.140 4.560 40.650 1.00 0.00 ATOM 8582 4C31 DPP 71 52.450 2.630 40.940 1.00 0.00 ATOM 8583 H14X DPP 71 52.970 2.110 40.100 1.00 0.00 ATOM 8584 H14Y DPP 71 51.520 2.050 41.110 1.00 0.00 ATOM 8585 5C31 DPP 71 53.260 2.570 42.230 1.00 0.00 ATOM 8586 H15X DPP 71 52.740 2.910 43.150 1.00 0.00 ATOM 8587 H15Y DPP 71 54.210 3.140 42.090 1.00 0.00 ATOM 8588 6C31 DPP 71 53.680 1.130 42.550 1.00 0.00 ATOM 8589 H16X DPP 71 52.740 0.600 42.830 1.00 0.00 ATOM 8590 H16Y DPP 71 54.370 1.020 43.400 1.00 0.00 ATOM 8591 H16Z DPP 71 54.130 0.800 41.590 1.00 0.00 ATOM 8592 N DPP 72 50.060 8.700 25.490 1.00 0.00 ATOM 8593 HN1 DPP 72 49.100 8.520 25.120 1.00 0.00 ATOM 8594 HN2 DPP 72 50.370 9.560 25.000 1.00 0.00 ATOM 8595 HN3 DPP 72 50.580 7.900 25.080 1.00 0.00 ATOM 8596 C12 DPP 72 50.220 9.030 26.950 1.00 0.00 ATOM 8597 H12A DPP 72 50.050 8.140 27.610 1.00 0.00 ATOM 8598 H12B DPP 72 49.400 9.720 27.230 1.00 0.00 ATOM 8599 C11 DPP 72 51.630 9.570 27.210 1.00 0.00 ATOM 8600 H11A DPP 72 52.270 8.730 26.860 1.00 0.00 ATOM 8601 H11B DPP 72 51.860 9.730 28.280 1.00 0.00 ATOM 8602 P DPP 72 53.250 11.380 26.840 1.00 0.00 ATOM 8603 O13 DPP 72 53.500 12.430 25.820 1.00 0.00 ATOM 8604 O14 DPP 72 54.220 10.270 26.900 1.00 0.00 ATOM 8605 O11 DPP 72 53.040 11.980 28.300 1.00 0.00 ATOM 8606 O12 DPP 72 51.830 10.770 26.450 1.00 0.00 ATOM 8607 C1 DPP 72 51.720 12.330 28.750 1.00 0.00 ATOM 8608 HA DPP 72 51.030 11.500 29.000 1.00 0.00 ATOM 8609 HB DPP 72 51.170 13.030 28.090 1.00 0.00 ATOM 8610 C2 DPP 72 51.740 13.060 30.100 1.00 0.00 ATOM 8611 HS DPP 72 52.190 14.060 29.930 1.00 0.00 ATOM 8612 O21 DPP 72 52.380 12.160 31.020 1.00 0.00 ATOM 8613 C21 DPP 72 52.680 12.870 32.110 1.00 0.00 ATOM 8614 O22 DPP 72 52.310 13.990 32.420 1.00 0.00 ATOM 8615 C22 DPP 72 53.590 12.060 33.020 1.00 0.00 ATOM 8616 H2R DPP 72 54.570 11.910 32.510 1.00 0.00 ATOM 8617 H2S DPP 72 53.110 11.060 33.120 1.00 0.00 ATOM 8618 C3 DPP 72 50.270 13.290 30.480 1.00 0.00 ATOM 8619 HX DPP 72 49.770 13.680 29.570 1.00 0.00 ATOM 8620 HY DPP 72 50.080 14.160 31.150 1.00 0.00 ATOM 8621 O31 DPP 72 49.730 12.100 31.070 1.00 0.00 ATOM 8622 C31 DPP 72 48.430 11.930 30.790 1.00 0.00 ATOM 8623 O32 DPP 72 47.760 12.640 30.060 1.00 0.00 ATOM 8624 C32 DPP 72 48.020 10.610 31.430 1.00 0.00 ATOM 8625 H2X DPP 72 48.940 10.000 31.560 1.00 0.00 ATOM 8626 H2Y DPP 72 47.230 10.140 30.810 1.00 0.00 ATOM 8627 C23 DPP 72 53.710 12.650 34.420 1.00 0.00 ATOM 8628 H3R DPP 72 52.880 12.280 35.050 1.00 0.00 ATOM 8629 H3S DPP 72 53.810 13.760 34.350 1.00 0.00 ATOM 8630 C24 DPP 72 55.020 12.200 35.080 1.00 0.00 ATOM 8631 H4R DPP 72 55.810 12.770 34.540 1.00 0.00 ATOM 8632 H4S DPP 72 55.280 11.120 35.070 1.00 0.00 ATOM 8633 C25 DPP 72 55.000 12.680 36.530 1.00 0.00 ATOM 8634 H5R DPP 72 54.130 12.250 37.080 1.00 0.00 ATOM 8635 H5S DPP 72 54.710 13.750 36.400 1.00 0.00 ATOM 8636 C26 DPP 72 56.230 12.450 37.410 1.00 0.00 ATOM 8637 H6R DPP 72 56.090 12.560 38.500 1.00 0.00 ATOM 8638 H6S DPP 72 57.000 13.150 37.020 1.00 0.00 ATOM 8639 C27 DPP 72 56.860 11.080 37.150 1.00 0.00 ATOM 8640 H7R DPP 72 56.960 10.980 36.050 1.00 0.00 ATOM 8641 H7S DPP 72 56.220 10.250 37.490 1.00 0.00 ATOM 8642 C28 DPP 72 58.160 10.840 37.910 1.00 0.00 ATOM 8643 H8R DPP 72 57.820 10.820 38.970 1.00 0.00 ATOM 8644 H8S DPP 72 58.810 11.710 37.660 1.00 0.00 ATOM 8645 C29 DPP 72 58.750 9.480 37.520 1.00 0.00 ATOM 8646 H9R DPP 72 58.090 8.740 38.030 1.00 0.00 ATOM 8647 H9S DPP 72 58.780 9.120 36.470 1.00 0.00 ATOM 8648 0C21 DPP 72 60.170 9.350 38.070 1.00 0.00 ATOM 8649 H10R DPP 72 60.740 10.210 37.660 1.00 0.00 ATOM 8650 H10S DPP 72 60.120 9.450 39.180 1.00 0.00 ATOM 8651 1C21 DPP 72 60.840 8.030 37.700 1.00 0.00 ATOM 8652 H11R DPP 72 60.260 7.100 37.930 1.00 0.00 ATOM 8653 H11S DPP 72 60.860 8.070 36.590 1.00 0.00 ATOM 8654 2C21 DPP 72 62.290 7.980 38.170 1.00 0.00 ATOM 8655 H12R DPP 72 62.750 8.990 38.040 1.00 0.00 ATOM 8656 H12S DPP 72 62.760 7.280 37.450 1.00 0.00 ATOM 8657 3C21 DPP 72 62.410 7.440 39.600 1.00 0.00 ATOM 8658 H13R DPP 72 62.130 6.370 39.510 1.00 0.00 ATOM 8659 H13S DPP 72 61.660 7.850 40.310 1.00 0.00 ATOM 8660 4C21 DPP 72 63.760 7.540 40.300 1.00 0.00 ATOM 8661 H14R DPP 72 63.800 6.780 41.100 1.00 0.00 ATOM 8662 H14S DPP 72 63.820 8.510 40.850 1.00 0.00 ATOM 8663 5C21 DPP 72 64.970 7.190 39.430 1.00 0.00 ATOM 8664 H15R DPP 72 65.830 7.450 40.080 1.00 0.00 ATOM 8665 H15S DPP 72 65.000 7.830 38.520 1.00 0.00 ATOM 8666 6C21 DPP 72 65.020 5.760 38.890 1.00 0.00 ATOM 8667 H16R DPP 72 64.620 5.050 39.640 1.00 0.00 ATOM 8668 H16S DPP 72 64.590 5.560 37.880 1.00 0.00 ATOM 8669 H16T DPP 72 66.110 5.600 38.760 1.00 0.00 ATOM 8670 C33 DPP 72 47.330 11.000 32.740 1.00 0.00 ATOM 8671 H3X DPP 72 46.740 10.160 33.180 1.00 0.00 ATOM 8672 H3Y DPP 72 46.570 11.800 32.600 1.00 0.00 ATOM 8673 C34 DPP 72 48.200 11.520 33.880 1.00 0.00 ATOM 8674 H4X DPP 72 48.090 12.600 34.120 1.00 0.00 ATOM 8675 H4Y DPP 72 49.240 11.320 33.550 1.00 0.00 ATOM 8676 C35 DPP 72 47.950 10.730 35.170 1.00 0.00 ATOM 8677 H5X DPP 72 48.540 9.790 35.150 1.00 0.00 ATOM 8678 H5Y DPP 72 46.840 10.640 35.210 1.00 0.00 ATOM 8679 C36 DPP 72 48.360 11.540 36.400 1.00 0.00 ATOM 8680 H6X DPP 72 47.840 11.040 37.250 1.00 0.00 ATOM 8681 H6Y DPP 72 47.790 12.470 36.210 1.00 0.00 ATOM 8682 C37 DPP 72 49.850 11.730 36.700 1.00 0.00 ATOM 8683 H7X DPP 72 50.200 12.460 35.940 1.00 0.00 ATOM 8684 H7Y DPP 72 50.310 10.740 36.500 1.00 0.00 ATOM 8685 C38 DPP 72 49.900 12.380 38.090 1.00 0.00 ATOM 8686 H8X DPP 72 49.630 11.660 38.890 1.00 0.00 ATOM 8687 H8Y DPP 72 49.130 13.150 38.280 1.00 0.00 ATOM 8688 C39 DPP 72 51.300 12.940 38.370 1.00 0.00 ATOM 8689 H9X DPP 72 51.400 13.750 37.610 1.00 0.00 ATOM 8690 H9Y DPP 72 52.110 12.200 38.210 1.00 0.00 ATOM 8691 0C31 DPP 72 51.350 13.710 39.690 1.00 0.00 ATOM 8692 H10X DPP 72 51.200 13.010 40.530 1.00 0.00 ATOM 8693 H10Y DPP 72 50.440 14.330 39.590 1.00 0.00 ATOM 8694 1C31 DPP 72 52.630 14.540 39.870 1.00 0.00 ATOM 8695 H11X DPP 72 52.390 15.180 40.750 1.00 0.00 ATOM 8696 H11Y DPP 72 52.720 15.200 38.980 1.00 0.00 ATOM 8697 2C31 DPP 72 54.000 13.890 40.080 1.00 0.00 ATOM 8698 H12X DPP 72 54.730 14.700 39.850 1.00 0.00 ATOM 8699 H12Y DPP 72 54.120 13.070 39.340 1.00 0.00 ATOM 8700 3C31 DPP 72 54.280 13.550 41.540 1.00 0.00 ATOM 8701 H13X DPP 72 53.400 12.960 41.870 1.00 0.00 ATOM 8702 H13Y DPP 72 54.310 14.470 42.160 1.00 0.00 ATOM 8703 4C31 DPP 72 55.590 12.790 41.800 1.00 0.00 ATOM 8704 H14X DPP 72 56.440 13.390 41.410 1.00 0.00 ATOM 8705 H14Y DPP 72 55.490 11.800 41.320 1.00 0.00 ATOM 8706 5C31 DPP 72 55.920 12.670 43.290 1.00 0.00 ATOM 8707 H15X DPP 72 55.040 12.140 43.720 1.00 0.00 ATOM 8708 H15Y DPP 72 55.910 13.670 43.770 1.00 0.00 ATOM 8709 6C31 DPP 72 57.200 11.900 43.600 1.00 0.00 ATOM 8710 H16X DPP 72 57.180 11.690 44.690 1.00 0.00 ATOM 8711 H16Y DPP 72 58.180 12.370 43.380 1.00 0.00 ATOM 8712 H16Z DPP 72 57.200 10.980 42.980 1.00 0.00 ATOM 8713 N DPP 73 1.180 43.720 17.130 1.00 0.00 ATOM 8714 HN1 DPP 73 1.640 44.500 17.640 1.00 0.00 ATOM 8715 HN2 DPP 73 0.740 43.180 17.910 1.00 0.00 ATOM 8716 HN3 DPP 73 1.970 43.190 16.710 1.00 0.00 ATOM 8717 C12 DPP 73 0.080 44.010 16.130 1.00 0.00 ATOM 8718 H12A DPP 73 0.290 43.320 15.280 1.00 0.00 ATOM 8719 H12B DPP 73 -0.890 43.780 16.620 1.00 0.00 ATOM 8720 C11 DPP 73 0.160 45.410 15.520 1.00 0.00 ATOM 8721 H11A DPP 73 -0.760 45.680 14.960 1.00 0.00 ATOM 8722 H11B DPP 73 1.030 45.450 14.830 1.00 0.00 ATOM 8723 P DPP 73 -1.050 47.180 17.050 1.00 0.00 ATOM 8724 O13 DPP 73 -2.200 46.270 17.280 1.00 0.00 ATOM 8725 O14 DPP 73 -1.270 48.320 16.130 1.00 0.00 ATOM 8726 O11 DPP 73 -0.490 47.780 18.420 1.00 0.00 ATOM 8727 O12 DPP 73 0.240 46.360 16.590 1.00 0.00 ATOM 8728 C1 DPP 73 0.790 48.420 18.440 1.00 0.00 ATOM 8729 HA DPP 73 0.740 49.280 19.140 1.00 0.00 ATOM 8730 HB DPP 73 1.110 48.680 17.410 1.00 0.00 ATOM 8731 C2 DPP 73 1.880 47.570 19.120 1.00 0.00 ATOM 8732 HS DPP 73 2.110 46.770 18.380 1.00 0.00 ATOM 8733 O21 DPP 73 1.330 47.090 20.340 1.00 0.00 ATOM 8734 C21 DPP 73 1.520 45.790 20.560 1.00 0.00 ATOM 8735 O22 DPP 73 2.190 45.030 19.870 1.00 0.00 ATOM 8736 C22 DPP 73 1.000 45.370 21.920 1.00 0.00 ATOM 8737 H2R DPP 73 1.750 44.780 22.500 1.00 0.00 ATOM 8738 H2S DPP 73 0.130 44.700 21.730 1.00 0.00 ATOM 8739 C3 DPP 73 3.190 48.350 19.360 1.00 0.00 ATOM 8740 HX DPP 73 3.640 48.830 18.470 1.00 0.00 ATOM 8741 HY DPP 73 3.870 47.600 19.810 1.00 0.00 ATOM 8742 O31 DPP 73 2.910 49.420 20.270 1.00 0.00 ATOM 8743 C31 DPP 73 3.670 49.590 21.360 1.00 0.00 ATOM 8744 O32 DPP 73 4.620 48.860 21.560 1.00 0.00 ATOM 8745 C32 DPP 73 3.010 50.440 22.440 1.00 0.00 ATOM 8746 H2X DPP 73 2.310 49.720 22.920 1.00 0.00 ATOM 8747 H2Y DPP 73 2.450 51.310 22.050 1.00 0.00 ATOM 8748 C23 DPP 73 0.400 46.510 22.740 1.00 0.00 ATOM 8749 H3R DPP 73 -0.450 46.060 23.300 1.00 0.00 ATOM 8750 H3S DPP 73 -0.130 47.190 22.040 1.00 0.00 ATOM 8751 C24 DPP 73 1.310 47.170 23.780 1.00 0.00 ATOM 8752 H4R DPP 73 0.980 48.220 23.970 1.00 0.00 ATOM 8753 H4S DPP 73 2.340 47.110 23.390 1.00 0.00 ATOM 8754 C25 DPP 73 1.070 46.510 25.140 1.00 0.00 ATOM 8755 H5R DPP 73 1.190 45.410 25.050 1.00 0.00 ATOM 8756 H5S DPP 73 0.030 46.750 25.450 1.00 0.00 ATOM 8757 C26 DPP 73 1.950 47.100 26.240 1.00 0.00 ATOM 8758 H6R DPP 73 2.040 48.210 26.130 1.00 0.00 ATOM 8759 H6S DPP 73 2.940 46.620 26.080 1.00 0.00 ATOM 8760 C27 DPP 73 1.540 46.590 27.620 1.00 0.00 ATOM 8761 H7R DPP 73 1.530 45.480 27.620 1.00 0.00 ATOM 8762 H7S DPP 73 0.500 46.750 27.950 1.00 0.00 ATOM 8763 C28 DPP 73 2.420 47.190 28.710 1.00 0.00 ATOM 8764 H8R DPP 73 2.350 48.300 28.800 1.00 0.00 ATOM 8765 H8S DPP 73 3.430 46.820 28.450 1.00 0.00 ATOM 8766 C29 DPP 73 2.020 46.660 30.090 1.00 0.00 ATOM 8767 H9R DPP 73 1.950 45.560 30.160 1.00 0.00 ATOM 8768 H9S DPP 73 0.980 46.990 30.290 1.00 0.00 ATOM 8769 0C21 DPP 73 2.820 47.200 31.280 1.00 0.00 ATOM 8770 H10R DPP 73 2.560 48.280 31.370 1.00 0.00 ATOM 8771 H10S DPP 73 3.860 47.250 30.900 1.00 0.00 ATOM 8772 1C21 DPP 73 2.590 46.700 32.710 1.00 0.00 ATOM 8773 H11R DPP 73 2.630 45.600 32.590 1.00 0.00 ATOM 8774 H11S DPP 73 1.610 46.890 33.190 1.00 0.00 ATOM 8775 2C21 DPP 73 3.660 47.230 33.660 1.00 0.00 ATOM 8776 H12R DPP 73 3.440 48.240 34.070 1.00 0.00 ATOM 8777 H12S DPP 73 4.690 47.240 33.250 1.00 0.00 ATOM 8778 3C21 DPP 73 3.580 46.430 34.960 1.00 0.00 ATOM 8779 H13R DPP 73 3.600 45.380 34.600 1.00 0.00 ATOM 8780 H13S DPP 73 2.660 46.710 35.510 1.00 0.00 ATOM 8781 4C21 DPP 73 4.710 46.730 35.950 1.00 0.00 ATOM 8782 H14R DPP 73 4.800 47.830 36.080 1.00 0.00 ATOM 8783 H14S DPP 73 5.630 46.180 35.680 1.00 0.00 ATOM 8784 5C21 DPP 73 4.430 46.100 37.320 1.00 0.00 ATOM 8785 H15R DPP 73 5.360 46.180 37.920 1.00 0.00 ATOM 8786 H15S DPP 73 4.080 45.060 37.180 1.00 0.00 ATOM 8787 6C21 DPP 73 3.360 46.880 38.090 1.00 0.00 ATOM 8788 H16R DPP 73 3.120 47.850 37.620 1.00 0.00 ATOM 8789 H16S DPP 73 2.550 46.120 38.030 1.00 0.00 ATOM 8790 H16T DPP 73 3.530 46.920 39.190 1.00 0.00 ATOM 8791 C33 DPP 73 4.030 51.020 23.420 1.00 0.00 ATOM 8792 H3X DPP 73 3.980 52.130 23.380 1.00 0.00 ATOM 8793 H3Y DPP 73 5.100 50.820 23.200 1.00 0.00 ATOM 8794 C34 DPP 73 3.740 50.590 24.860 1.00 0.00 ATOM 8795 H4X DPP 73 3.700 49.480 24.890 1.00 0.00 ATOM 8796 H4Y DPP 73 2.690 50.930 24.990 1.00 0.00 ATOM 8797 C35 DPP 73 4.620 51.160 25.970 1.00 0.00 ATOM 8798 H5X DPP 73 4.530 52.270 26.020 1.00 0.00 ATOM 8799 H5Y DPP 73 5.700 50.960 25.830 1.00 0.00 ATOM 8800 C36 DPP 73 4.410 50.520 27.350 1.00 0.00 ATOM 8801 H6X DPP 73 4.630 49.440 27.220 1.00 0.00 ATOM 8802 H6Y DPP 73 3.400 50.670 27.790 1.00 0.00 ATOM 8803 C37 DPP 73 5.310 51.070 28.460 1.00 0.00 ATOM 8804 H7X DPP 73 5.260 52.180 28.560 1.00 0.00 ATOM 8805 H7Y DPP 73 6.360 50.800 28.230 1.00 0.00 ATOM 8806 C38 DPP 73 5.080 50.480 29.850 1.00 0.00 ATOM 8807 H8X DPP 73 5.230 49.380 29.770 1.00 0.00 ATOM 8808 H8Y DPP 73 4.050 50.650 30.230 1.00 0.00 ATOM 8809 C39 DPP 73 6.150 50.930 30.860 1.00 0.00 ATOM 8810 H9X DPP 73 6.200 52.040 30.850 1.00 0.00 ATOM 8811 H9Y DPP 73 7.140 50.500 30.580 1.00 0.00 ATOM 8812 0C31 DPP 73 5.800 50.480 32.280 1.00 0.00 ATOM 8813 H10X DPP 73 5.490 49.410 32.230 1.00 0.00 ATOM 8814 H10Y DPP 73 4.940 51.120 32.570 1.00 0.00 ATOM 8815 1C31 DPP 73 7.010 50.550 33.210 1.00 0.00 ATOM 8816 H11X DPP 73 7.170 51.640 33.360 1.00 0.00 ATOM 8817 H11Y DPP 73 7.850 50.100 32.630 1.00 0.00 ATOM 8818 2C31 DPP 73 6.810 50.030 34.630 1.00 0.00 ATOM 8819 H12X DPP 73 6.730 48.930 34.600 1.00 0.00 ATOM 8820 H12Y DPP 73 5.920 50.420 35.170 1.00 0.00 ATOM 8821 3C31 DPP 73 8.010 50.360 35.510 1.00 0.00 ATOM 8822 H13X DPP 73 8.300 51.400 35.230 1.00 0.00 ATOM 8823 H13Y DPP 73 8.890 49.770 35.170 1.00 0.00 ATOM 8824 4C31 DPP 73 7.700 50.160 37.000 1.00 0.00 ATOM 8825 H14X DPP 73 7.330 49.120 37.170 1.00 0.00 ATOM 8826 H14Y DPP 73 6.960 50.880 37.380 1.00 0.00 ATOM 8827 5C31 DPP 73 8.860 50.320 37.990 1.00 0.00 ATOM 8828 H15X DPP 73 8.590 50.630 39.020 1.00 0.00 ATOM 8829 H15Y DPP 73 9.460 51.180 37.630 1.00 0.00 ATOM 8830 6C31 DPP 73 9.630 49.000 37.980 1.00 0.00 ATOM 8831 H16X DPP 73 9.060 48.160 38.420 1.00 0.00 ATOM 8832 H16Y DPP 73 10.510 49.080 38.660 1.00 0.00 ATOM 8833 H16Z DPP 73 10.000 48.830 36.940 1.00 0.00 ATOM 8834 N DPP 74 9.840 20.300 20.070 1.00 0.00 ATOM 8835 HN1 DPP 74 8.860 20.110 20.350 1.00 0.00 ATOM 8836 HN2 DPP 74 9.800 21.270 19.680 1.00 0.00 ATOM 8837 HN3 DPP 74 10.340 19.590 19.500 1.00 0.00 ATOM 8838 C12 DPP 74 10.780 20.270 21.250 1.00 0.00 ATOM 8839 H12A DPP 74 11.770 20.170 20.760 1.00 0.00 ATOM 8840 H12B DPP 74 10.640 19.400 21.920 1.00 0.00 ATOM 8841 C11 DPP 74 10.690 21.510 22.140 1.00 0.00 ATOM 8842 H11A DPP 74 11.560 21.390 22.820 1.00 0.00 ATOM 8843 H11B DPP 74 9.780 21.340 22.760 1.00 0.00 ATOM 8844 P DPP 74 11.150 23.970 22.420 1.00 0.00 ATOM 8845 O13 DPP 74 10.620 25.250 21.910 1.00 0.00 ATOM 8846 O14 DPP 74 12.620 23.830 22.600 1.00 0.00 ATOM 8847 O11 DPP 74 10.410 23.710 23.810 1.00 0.00 ATOM 8848 O12 DPP 74 10.650 22.780 21.480 1.00 0.00 ATOM 8849 C1 DPP 74 9.060 24.160 23.940 1.00 0.00 ATOM 8850 HA DPP 74 8.410 23.410 24.440 1.00 0.00 ATOM 8851 HB DPP 74 8.500 24.150 22.980 1.00 0.00 ATOM 8852 C2 DPP 74 9.170 25.620 24.410 1.00 0.00 ATOM 8853 HS DPP 74 9.540 26.330 23.640 1.00 0.00 ATOM 8854 O21 DPP 74 10.030 25.620 25.550 1.00 0.00 ATOM 8855 C21 DPP 74 10.350 26.840 25.970 1.00 0.00 ATOM 8856 O22 DPP 74 9.990 27.900 25.490 1.00 0.00 ATOM 8857 C22 DPP 74 11.350 26.680 27.110 1.00 0.00 ATOM 8858 H2R DPP 74 12.290 26.220 26.720 1.00 0.00 ATOM 8859 H2S DPP 74 10.880 26.110 27.940 1.00 0.00 ATOM 8860 C3 DPP 74 7.710 25.990 24.740 1.00 0.00 ATOM 8861 HX DPP 74 7.070 25.900 23.840 1.00 0.00 ATOM 8862 HY DPP 74 7.680 27.080 24.950 1.00 0.00 ATOM 8863 O31 DPP 74 7.300 25.180 25.850 1.00 0.00 ATOM 8864 C31 DPP 74 6.040 24.760 25.860 1.00 0.00 ATOM 8865 O32 DPP 74 5.200 25.050 25.020 1.00 0.00 ATOM 8866 C32 DPP 74 5.760 23.820 27.030 1.00 0.00 ATOM 8867 H2X DPP 74 6.220 24.160 27.980 1.00 0.00 ATOM 8868 H2Y DPP 74 6.350 22.880 26.930 1.00 0.00 ATOM 8869 C23 DPP 74 11.800 28.010 27.710 1.00 0.00 ATOM 8870 H3R DPP 74 10.990 28.770 27.650 1.00 0.00 ATOM 8871 H3S DPP 74 12.620 28.320 27.030 1.00 0.00 ATOM 8872 C24 DPP 74 12.430 27.890 29.100 1.00 0.00 ATOM 8873 H4R DPP 74 13.410 27.390 28.990 1.00 0.00 ATOM 8874 H4S DPP 74 11.920 27.160 29.760 1.00 0.00 ATOM 8875 C25 DPP 74 12.610 29.180 29.900 1.00 0.00 ATOM 8876 H5R DPP 74 11.600 29.610 30.060 1.00 0.00 ATOM 8877 H5S DPP 74 13.160 29.990 29.360 1.00 0.00 ATOM 8878 C26 DPP 74 13.230 28.920 31.270 1.00 0.00 ATOM 8879 H6R DPP 74 14.140 28.310 31.080 1.00 0.00 ATOM 8880 H6S DPP 74 12.540 28.240 31.830 1.00 0.00 ATOM 8881 C27 DPP 74 13.520 30.080 32.220 1.00 0.00 ATOM 8882 H7R DPP 74 12.480 30.220 32.570 1.00 0.00 ATOM 8883 H7S DPP 74 13.850 31.000 31.680 1.00 0.00 ATOM 8884 C28 DPP 74 14.440 29.740 33.390 1.00 0.00 ATOM 8885 H8R DPP 74 15.460 29.590 32.970 1.00 0.00 ATOM 8886 H8S DPP 74 14.170 28.720 33.730 1.00 0.00 ATOM 8887 C29 DPP 74 14.510 30.750 34.540 1.00 0.00 ATOM 8888 H9R DPP 74 14.990 31.600 33.990 1.00 0.00 ATOM 8889 H9S DPP 74 15.240 30.390 35.300 1.00 0.00 ATOM 8890 0C21 DPP 74 13.180 31.110 35.190 1.00 0.00 ATOM 8891 H10R DPP 74 12.570 31.780 34.550 1.00 0.00 ATOM 8892 H10S DPP 74 13.410 31.650 36.140 1.00 0.00 ATOM 8893 1C21 DPP 74 12.320 29.920 35.610 1.00 0.00 ATOM 8894 H11R DPP 74 11.390 30.430 35.950 1.00 0.00 ATOM 8895 H11S DPP 74 12.150 29.200 34.780 1.00 0.00 ATOM 8896 2C21 DPP 74 12.870 29.050 36.750 1.00 0.00 ATOM 8897 H12R DPP 74 13.940 28.870 36.510 1.00 0.00 ATOM 8898 H12S DPP 74 12.420 28.040 36.770 1.00 0.00 ATOM 8899 3C21 DPP 74 12.800 29.700 38.130 1.00 0.00 ATOM 8900 H13R DPP 74 11.780 30.120 38.280 1.00 0.00 ATOM 8901 H13S DPP 74 13.520 30.550 38.110 1.00 0.00 ATOM 8902 4C21 DPP 74 13.210 28.770 39.270 1.00 0.00 ATOM 8903 H14R DPP 74 12.440 27.980 39.350 1.00 0.00 ATOM 8904 H14S DPP 74 13.190 29.290 40.250 1.00 0.00 ATOM 8905 5C21 DPP 74 14.550 28.060 39.030 1.00 0.00 ATOM 8906 H15R DPP 74 15.250 28.920 39.000 1.00 0.00 ATOM 8907 H15S DPP 74 14.560 27.610 38.010 1.00 0.00 ATOM 8908 6C21 DPP 74 15.080 27.150 40.130 1.00 0.00 ATOM 8909 H16R DPP 74 15.670 27.740 40.860 1.00 0.00 ATOM 8910 H16S DPP 74 15.860 26.530 39.630 1.00 0.00 ATOM 8911 H16T DPP 74 14.250 26.540 40.540 1.00 0.00 ATOM 8912 C33 DPP 74 4.280 23.500 27.210 1.00 0.00 ATOM 8913 H3X DPP 74 3.900 23.050 26.270 1.00 0.00 ATOM 8914 H3Y DPP 74 3.720 24.450 27.330 1.00 0.00 ATOM 8915 C34 DPP 74 4.110 22.420 28.290 1.00 0.00 ATOM 8916 H4X DPP 74 4.870 21.620 28.170 1.00 0.00 ATOM 8917 H4Y DPP 74 3.110 22.070 27.960 1.00 0.00 ATOM 8918 C35 DPP 74 3.950 22.990 29.690 1.00 0.00 ATOM 8919 H5X DPP 74 3.260 22.330 30.260 1.00 0.00 ATOM 8920 H5Y DPP 74 3.530 24.020 29.690 1.00 0.00 ATOM 8921 C36 DPP 74 5.220 22.880 30.540 1.00 0.00 ATOM 8922 H6X DPP 74 6.110 22.990 29.880 1.00 0.00 ATOM 8923 H6Y DPP 74 5.200 21.840 30.910 1.00 0.00 ATOM 8924 C37 DPP 74 5.280 23.820 31.750 1.00 0.00 ATOM 8925 H7X DPP 74 4.340 23.680 32.320 1.00 0.00 ATOM 8926 H7Y DPP 74 5.340 24.890 31.470 1.00 0.00 ATOM 8927 C38 DPP 74 6.460 23.470 32.650 1.00 0.00 ATOM 8928 H8X DPP 74 7.380 23.730 32.090 1.00 0.00 ATOM 8929 H8Y DPP 74 6.600 22.380 32.820 1.00 0.00 ATOM 8930 C39 DPP 74 6.530 24.270 33.960 1.00 0.00 ATOM 8931 H9X DPP 74 6.060 25.240 33.700 1.00 0.00 ATOM 8932 H9Y DPP 74 7.630 24.340 34.100 1.00 0.00 ATOM 8933 0C31 DPP 74 5.810 23.490 35.060 1.00 0.00 ATOM 8934 H10X DPP 74 4.840 23.120 34.670 1.00 0.00 ATOM 8935 H10Y DPP 74 5.490 24.220 35.830 1.00 0.00 ATOM 8936 1C31 DPP 74 6.730 22.560 35.850 1.00 0.00 ATOM 8937 H11X DPP 74 7.590 23.120 36.290 1.00 0.00 ATOM 8938 H11Y DPP 74 6.970 21.770 35.110 1.00 0.00 ATOM 8939 2C31 DPP 74 5.980 21.870 36.990 1.00 0.00 ATOM 8940 H12X DPP 74 6.540 21.010 37.410 1.00 0.00 ATOM 8941 H12Y DPP 74 5.010 21.600 36.520 1.00 0.00 ATOM 8942 3C31 DPP 74 5.660 22.790 38.170 1.00 0.00 ATOM 8943 H13X DPP 74 5.030 23.660 37.890 1.00 0.00 ATOM 8944 H13Y DPP 74 6.660 23.250 38.340 1.00 0.00 ATOM 8945 4C31 DPP 74 5.150 22.200 39.480 1.00 0.00 ATOM 8946 H14X DPP 74 5.490 21.140 39.480 1.00 0.00 ATOM 8947 H14Y DPP 74 4.050 22.100 39.470 1.00 0.00 ATOM 8948 5C31 DPP 74 5.640 22.960 40.720 1.00 0.00 ATOM 8949 H15X DPP 74 5.470 24.040 40.500 1.00 0.00 ATOM 8950 H15Y DPP 74 6.710 22.810 40.980 1.00 0.00 ATOM 8951 6C31 DPP 74 4.890 22.800 42.040 1.00 0.00 ATOM 8952 H16X DPP 74 5.200 23.600 42.740 1.00 0.00 ATOM 8953 H16Y DPP 74 5.250 21.940 42.650 1.00 0.00 ATOM 8954 H16Z DPP 74 3.790 22.770 41.880 1.00 0.00 ATOM 8955 N DPP 75 24.260 41.460 23.290 1.00 0.00 ATOM 8956 HN1 DPP 75 23.590 40.760 23.650 1.00 0.00 ATOM 8957 HN2 DPP 75 23.920 42.170 22.610 1.00 0.00 ATOM 8958 HN3 DPP 75 25.060 41.040 22.760 1.00 0.00 ATOM 8959 C12 DPP 75 24.850 42.240 24.440 1.00 0.00 ATOM 8960 H12A DPP 75 23.970 42.770 24.860 1.00 0.00 ATOM 8961 H12B DPP 75 25.300 41.550 25.180 1.00 0.00 ATOM 8962 C11 DPP 75 25.830 43.240 23.830 1.00 0.00 ATOM 8963 H11A DPP 75 26.760 42.730 23.490 1.00 0.00 ATOM 8964 H11B DPP 75 26.130 43.890 24.680 1.00 0.00 ATOM 8965 P DPP 75 26.300 45.010 22.110 1.00 0.00 ATOM 8966 O13 DPP 75 25.620 46.320 21.910 1.00 0.00 ATOM 8967 O14 DPP 75 26.670 44.300 20.870 1.00 0.00 ATOM 8968 O11 DPP 75 27.480 45.190 23.170 1.00 0.00 ATOM 8969 O12 DPP 75 25.220 44.090 22.850 1.00 0.00 ATOM 8970 C1 DPP 75 28.790 45.640 22.830 1.00 0.00 ATOM 8971 HA DPP 75 29.250 46.240 23.650 1.00 0.00 ATOM 8972 HB DPP 75 28.640 46.400 22.030 1.00 0.00 ATOM 8973 C2 DPP 75 29.750 44.560 22.320 1.00 0.00 ATOM 8974 HS DPP 75 29.340 44.170 21.360 1.00 0.00 ATOM 8975 O21 DPP 75 29.830 43.510 23.290 1.00 0.00 ATOM 8976 C21 DPP 75 30.180 42.300 22.840 1.00 0.00 ATOM 8977 O22 DPP 75 30.410 42.030 21.670 1.00 0.00 ATOM 8978 C22 DPP 75 30.290 41.330 24.010 1.00 0.00 ATOM 8979 H2R DPP 75 30.790 40.420 23.630 1.00 0.00 ATOM 8980 H2S DPP 75 29.260 41.090 24.350 1.00 0.00 ATOM 8981 C3 DPP 75 31.120 45.190 22.020 1.00 0.00 ATOM 8982 HX DPP 75 31.000 45.940 21.210 1.00 0.00 ATOM 8983 HY DPP 75 31.830 44.460 21.580 1.00 0.00 ATOM 8984 O31 DPP 75 31.630 45.810 23.210 1.00 0.00 ATOM 8985 C31 DPP 75 32.890 45.540 23.540 1.00 0.00 ATOM 8986 O32 DPP 75 33.710 44.840 22.970 1.00 0.00 ATOM 8987 C32 DPP 75 33.270 46.320 24.790 1.00 0.00 ATOM 8988 H2X DPP 75 32.460 46.090 25.510 1.00 0.00 ATOM 8989 H2Y DPP 75 33.330 47.410 24.570 1.00 0.00 ATOM 8990 C23 DPP 75 31.130 41.940 25.130 1.00 0.00 ATOM 8991 H3R DPP 75 31.890 42.610 24.660 1.00 0.00 ATOM 8992 H3S DPP 75 31.720 41.140 25.640 1.00 0.00 ATOM 8993 C24 DPP 75 30.170 42.650 26.080 1.00 0.00 ATOM 8994 H4R DPP 75 29.530 42.000 26.710 1.00 0.00 ATOM 8995 H4S DPP 75 29.450 43.260 25.500 1.00 0.00 ATOM 8996 C25 DPP 75 30.860 43.620 27.040 1.00 0.00 ATOM 8997 H5R DPP 75 30.110 43.940 27.790 1.00 0.00 ATOM 8998 H5S DPP 75 31.320 44.470 26.490 1.00 0.00 ATOM 8999 C26 DPP 75 31.870 42.920 27.950 1.00 0.00 ATOM 9000 H6R DPP 75 32.820 42.660 27.430 1.00 0.00 ATOM 9001 H6S DPP 75 31.510 41.900 28.220 1.00 0.00 ATOM 9002 C27 DPP 75 32.120 43.770 29.200 1.00 0.00 ATOM 9003 H7R DPP 75 31.940 44.830 28.950 1.00 0.00 ATOM 9004 H7S DPP 75 33.180 43.800 29.530 1.00 0.00 ATOM 9005 C28 DPP 75 31.380 43.300 30.460 1.00 0.00 ATOM 9006 H8R DPP 75 30.310 43.160 30.200 1.00 0.00 ATOM 9007 H8S DPP 75 31.300 44.110 31.210 1.00 0.00 ATOM 9008 C29 DPP 75 31.970 42.020 31.040 1.00 0.00 ATOM 9009 H9R DPP 75 33.050 42.260 31.100 1.00 0.00 ATOM 9010 H9S DPP 75 31.730 41.260 30.260 1.00 0.00 ATOM 9011 0C21 DPP 75 31.500 41.620 32.450 1.00 0.00 ATOM 9012 H10R DPP 75 31.380 42.520 33.090 1.00 0.00 ATOM 9013 H10S DPP 75 32.140 40.910 33.010 1.00 0.00 ATOM 9014 1C21 DPP 75 30.140 40.920 32.480 1.00 0.00 ATOM 9015 H11R DPP 75 30.200 39.940 31.960 1.00 0.00 ATOM 9016 H11S DPP 75 29.360 41.460 31.900 1.00 0.00 ATOM 9017 2C21 DPP 75 29.690 40.780 33.930 1.00 0.00 ATOM 9018 H12R DPP 75 30.080 41.550 34.620 1.00 0.00 ATOM 9019 H12S DPP 75 30.060 39.790 34.290 1.00 0.00 ATOM 9020 3C21 DPP 75 28.160 40.790 34.060 1.00 0.00 ATOM 9021 H13R DPP 75 27.910 41.750 33.580 1.00 0.00 ATOM 9022 H13S DPP 75 27.890 40.860 35.140 1.00 0.00 ATOM 9023 4C21 DPP 75 27.360 39.650 33.420 1.00 0.00 ATOM 9024 H14R DPP 75 27.640 38.710 33.940 1.00 0.00 ATOM 9025 H14S DPP 75 27.520 39.590 32.320 1.00 0.00 ATOM 9026 5C21 DPP 75 25.850 39.820 33.590 1.00 0.00 ATOM 9027 H15R DPP 75 25.500 40.600 32.880 1.00 0.00 ATOM 9028 H15S DPP 75 25.710 40.260 34.600 1.00 0.00 ATOM 9029 6C21 DPP 75 24.900 38.630 33.600 1.00 0.00 ATOM 9030 H16R DPP 75 25.270 37.890 34.340 1.00 0.00 ATOM 9031 H16S DPP 75 24.750 38.130 32.620 1.00 0.00 ATOM 9032 H16T DPP 75 23.910 39.000 33.950 1.00 0.00 ATOM 9033 C33 DPP 75 34.620 45.750 25.240 1.00 0.00 ATOM 9034 H3X DPP 75 35.310 45.830 24.370 1.00 0.00 ATOM 9035 H3Y DPP 75 34.360 44.690 25.430 1.00 0.00 ATOM 9036 C34 DPP 75 35.220 46.500 26.440 1.00 0.00 ATOM 9037 H4X DPP 75 35.280 47.600 26.270 1.00 0.00 ATOM 9038 H4Y DPP 75 36.240 46.090 26.590 1.00 0.00 ATOM 9039 C35 DPP 75 34.290 46.340 27.630 1.00 0.00 ATOM 9040 H5X DPP 75 34.110 45.240 27.700 1.00 0.00 ATOM 9041 H5Y DPP 75 33.340 46.880 27.420 1.00 0.00 ATOM 9042 C36 DPP 75 34.970 46.880 28.890 1.00 0.00 ATOM 9043 H6X DPP 75 35.180 47.950 28.700 1.00 0.00 ATOM 9044 H6Y DPP 75 35.930 46.320 28.870 1.00 0.00 ATOM 9045 C37 DPP 75 34.250 46.580 30.210 1.00 0.00 ATOM 9046 H7X DPP 75 34.040 45.510 30.390 1.00 0.00 ATOM 9047 H7Y DPP 75 33.300 47.160 30.160 1.00 0.00 ATOM 9048 C38 DPP 75 35.040 47.160 31.380 1.00 0.00 ATOM 9049 H8X DPP 75 35.110 48.270 31.240 1.00 0.00 ATOM 9050 H8Y DPP 75 36.040 46.690 31.280 1.00 0.00 ATOM 9051 C39 DPP 75 34.360 46.920 32.720 1.00 0.00 ATOM 9052 H9X DPP 75 34.190 45.820 32.780 1.00 0.00 ATOM 9053 H9Y DPP 75 33.340 47.360 32.830 1.00 0.00 ATOM 9054 0C31 DPP 75 35.170 47.410 33.920 1.00 0.00 ATOM 9055 H10X DPP 75 35.390 48.480 33.720 1.00 0.00 ATOM 9056 H10Y DPP 75 36.180 46.940 33.920 1.00 0.00 ATOM 9057 1C31 DPP 75 34.420 47.230 35.240 1.00 0.00 ATOM 9058 H11X DPP 75 34.190 46.170 35.470 1.00 0.00 ATOM 9059 H11Y DPP 75 33.560 47.900 35.050 1.00 0.00 ATOM 9060 2C31 DPP 75 35.230 47.750 36.420 1.00 0.00 ATOM 9061 H12X DPP 75 35.970 48.440 35.970 1.00 0.00 ATOM 9062 H12Y DPP 75 35.850 46.880 36.740 1.00 0.00 ATOM 9063 3C31 DPP 75 34.550 48.460 37.590 1.00 0.00 ATOM 9064 H13X DPP 75 34.160 49.380 37.110 1.00 0.00 ATOM 9065 H13Y DPP 75 35.320 48.770 38.320 1.00 0.00 ATOM 9066 4C31 DPP 75 33.460 47.600 38.250 1.00 0.00 ATOM 9067 H14X DPP 75 32.690 47.210 37.550 1.00 0.00 ATOM 9068 H14Y DPP 75 33.830 46.660 38.720 1.00 0.00 ATOM 9069 5C31 DPP 75 32.680 48.490 39.220 1.00 0.00 ATOM 9070 H15X DPP 75 32.150 49.300 38.690 1.00 0.00 ATOM 9071 H15Y DPP 75 33.440 48.920 39.900 1.00 0.00 ATOM 9072 6C31 DPP 75 31.630 47.820 40.100 1.00 0.00 ATOM 9073 H16X DPP 75 30.770 47.490 39.490 1.00 0.00 ATOM 9074 H16Y DPP 75 31.240 48.530 40.860 1.00 0.00 ATOM 9075 H16Z DPP 75 32.140 46.940 40.560 1.00 0.00 ATOM 9076 N DPP 76 21.000 33.960 25.610 1.00 0.00 ATOM 9077 HN1 DPP 76 20.140 33.430 25.360 1.00 0.00 ATOM 9078 HN2 DPP 76 21.230 33.380 26.450 1.00 0.00 ATOM 9079 HN3 DPP 76 20.710 34.850 26.050 1.00 0.00 ATOM 9080 C12 DPP 76 22.140 34.070 24.630 1.00 0.00 ATOM 9081 H12A DPP 76 21.850 34.840 23.880 1.00 0.00 ATOM 9082 H12B DPP 76 23.080 34.180 25.210 1.00 0.00 ATOM 9083 C11 DPP 76 22.160 32.780 23.800 1.00 0.00 ATOM 9084 H11A DPP 76 23.180 32.740 23.360 1.00 0.00 ATOM 9085 H11B DPP 76 21.330 32.920 23.070 1.00 0.00 ATOM 9086 P DPP 76 21.240 30.370 24.190 1.00 0.00 ATOM 9087 O13 DPP 76 21.900 29.850 22.980 1.00 0.00 ATOM 9088 O14 DPP 76 19.830 30.790 24.050 1.00 0.00 ATOM 9089 O11 DPP 76 21.470 29.460 25.490 1.00 0.00 ATOM 9090 O12 DPP 76 22.020 31.670 24.700 1.00 0.00 ATOM 9091 C1 DPP 76 22.780 29.330 26.050 1.00 0.00 ATOM 9092 HA DPP 76 23.660 29.500 25.400 1.00 0.00 ATOM 9093 HB DPP 76 22.960 28.330 26.510 1.00 0.00 ATOM 9094 C2 DPP 76 23.050 30.260 27.240 1.00 0.00 ATOM 9095 HS DPP 76 23.320 31.290 26.910 1.00 0.00 ATOM 9096 O21 DPP 76 24.040 29.600 28.030 1.00 0.00 ATOM 9097 C21 DPP 76 24.790 30.390 28.810 1.00 0.00 ATOM 9098 O22 DPP 76 24.660 31.600 28.890 1.00 0.00 ATOM 9099 C22 DPP 76 25.630 29.510 29.730 1.00 0.00 ATOM 9100 H2R DPP 76 26.480 29.130 29.140 1.00 0.00 ATOM 9101 H2S DPP 76 24.970 28.690 30.110 1.00 0.00 ATOM 9102 C3 DPP 76 21.750 30.350 28.060 1.00 0.00 ATOM 9103 HX DPP 76 21.630 29.340 28.510 1.00 0.00 ATOM 9104 HY DPP 76 20.820 30.500 27.470 1.00 0.00 ATOM 9105 O31 DPP 76 21.850 31.060 29.300 1.00 0.00 ATOM 9106 C31 DPP 76 21.760 32.370 29.040 1.00 0.00 ATOM 9107 O32 DPP 76 21.580 32.840 27.930 1.00 0.00 ATOM 9108 C32 DPP 76 21.890 33.100 30.370 1.00 0.00 ATOM 9109 H2X DPP 76 22.680 32.520 30.890 1.00 0.00 ATOM 9110 H2Y DPP 76 20.940 33.060 30.940 1.00 0.00 ATOM 9111 C23 DPP 76 26.020 30.320 30.970 1.00 0.00 ATOM 9112 H3R DPP 76 25.140 30.760 31.480 1.00 0.00 ATOM 9113 H3S DPP 76 26.640 31.160 30.590 1.00 0.00 ATOM 9114 C24 DPP 76 26.660 29.430 32.030 1.00 0.00 ATOM 9115 H4R DPP 76 27.710 29.300 31.680 1.00 0.00 ATOM 9116 H4S DPP 76 26.240 28.410 31.900 1.00 0.00 ATOM 9117 C25 DPP 76 26.790 30.030 33.430 1.00 0.00 ATOM 9118 H5R DPP 76 25.740 30.050 33.800 1.00 0.00 ATOM 9119 H5S DPP 76 27.170 31.070 33.380 1.00 0.00 ATOM 9120 C26 DPP 76 27.720 29.180 34.290 1.00 0.00 ATOM 9121 H6R DPP 76 28.670 29.020 33.740 1.00 0.00 ATOM 9122 H6S DPP 76 27.400 28.120 34.430 1.00 0.00 ATOM 9123 C27 DPP 76 28.060 29.830 35.630 1.00 0.00 ATOM 9124 H7R DPP 76 28.610 30.780 35.480 1.00 0.00 ATOM 9125 H7S DPP 76 28.790 29.170 36.160 1.00 0.00 ATOM 9126 C28 DPP 76 26.950 30.040 36.660 1.00 0.00 ATOM 9127 H8R DPP 76 26.260 29.180 36.510 1.00 0.00 ATOM 9128 H8S DPP 76 26.250 30.840 36.330 1.00 0.00 ATOM 9129 C29 DPP 76 27.350 30.180 38.130 1.00 0.00 ATOM 9130 H9R DPP 76 28.000 31.070 38.030 1.00 0.00 ATOM 9131 H9S DPP 76 27.910 29.360 38.630 1.00 0.00 ATOM 9132 0C21 DPP 76 26.190 30.600 39.020 1.00 0.00 ATOM 9133 H10R DPP 76 25.470 29.760 39.160 1.00 0.00 ATOM 9134 H10S DPP 76 25.640 31.370 38.430 1.00 0.00 ATOM 9135 1C21 DPP 76 26.690 31.150 40.360 1.00 0.00 ATOM 9136 H11R DPP 76 27.280 32.070 40.140 1.00 0.00 ATOM 9137 H11S DPP 76 27.330 30.400 40.870 1.00 0.00 ATOM 9138 2C21 DPP 76 25.530 31.570 41.270 1.00 0.00 ATOM 9139 H12R DPP 76 24.880 32.330 40.790 1.00 0.00 ATOM 9140 H12S DPP 76 25.940 32.180 42.100 1.00 0.00 ATOM 9141 3C21 DPP 76 24.730 30.460 41.940 1.00 0.00 ATOM 9142 H13R DPP 76 25.450 29.730 42.350 1.00 0.00 ATOM 9143 H13S DPP 76 24.040 29.890 41.280 1.00 0.00 ATOM 9144 4C21 DPP 76 24.000 31.060 43.140 1.00 0.00 ATOM 9145 H14R DPP 76 23.270 31.840 42.830 1.00 0.00 ATOM 9146 H14S DPP 76 24.740 31.510 43.840 1.00 0.00 ATOM 9147 5C21 DPP 76 23.090 30.140 43.960 1.00 0.00 ATOM 9148 H15R DPP 76 22.950 30.690 44.910 1.00 0.00 ATOM 9149 H15S DPP 76 23.680 29.200 44.080 1.00 0.00 ATOM 9150 6C21 DPP 76 21.770 29.750 43.290 1.00 0.00 ATOM 9151 H16R DPP 76 21.050 30.600 43.310 1.00 0.00 ATOM 9152 H16S DPP 76 21.280 28.930 43.850 1.00 0.00 ATOM 9153 H16T DPP 76 22.030 29.520 42.230 1.00 0.00 ATOM 9154 C33 DPP 76 22.290 34.550 30.080 1.00 0.00 ATOM 9155 H3X DPP 76 21.570 35.180 29.520 1.00 0.00 ATOM 9156 H3Y DPP 76 23.290 34.600 29.600 1.00 0.00 ATOM 9157 C34 DPP 76 22.640 35.160 31.440 1.00 0.00 ATOM 9158 H4X DPP 76 23.220 36.090 31.260 1.00 0.00 ATOM 9159 H4Y DPP 76 23.240 34.410 31.990 1.00 0.00 ATOM 9160 C35 DPP 76 21.530 35.870 32.220 1.00 0.00 ATOM 9161 H5X DPP 76 20.830 35.080 32.580 1.00 0.00 ATOM 9162 H5Y DPP 76 20.910 36.570 31.620 1.00 0.00 ATOM 9163 C36 DPP 76 22.100 36.570 33.460 1.00 0.00 ATOM 9164 H6X DPP 76 21.930 37.660 33.360 1.00 0.00 ATOM 9165 H6Y DPP 76 23.170 36.310 33.570 1.00 0.00 ATOM 9166 C37 DPP 76 21.580 36.040 34.800 1.00 0.00 ATOM 9167 H7X DPP 76 21.510 34.930 34.840 1.00 0.00 ATOM 9168 H7Y DPP 76 20.570 36.450 34.990 1.00 0.00 ATOM 9169 C38 DPP 76 22.380 36.570 35.990 1.00 0.00 ATOM 9170 H8X DPP 76 22.850 37.520 35.650 1.00 0.00 ATOM 9171 H8Y DPP 76 23.160 35.830 36.250 1.00 0.00 ATOM 9172 C39 DPP 76 21.530 36.740 37.250 1.00 0.00 ATOM 9173 H9X DPP 76 20.760 35.940 37.220 1.00 0.00 ATOM 9174 H9Y DPP 76 21.060 37.750 37.240 1.00 0.00 ATOM 9175 0C31 DPP 76 22.240 36.540 38.590 1.00 0.00 ATOM 9176 H10X DPP 76 22.820 35.600 38.430 1.00 0.00 ATOM 9177 H10Y DPP 76 21.440 36.370 39.340 1.00 0.00 ATOM 9178 1C31 DPP 76 23.230 37.620 39.000 1.00 0.00 ATOM 9179 H11X DPP 76 22.710 38.580 39.190 1.00 0.00 ATOM 9180 H11Y DPP 76 24.000 37.680 38.190 1.00 0.00 ATOM 9181 2C31 DPP 76 24.030 37.280 40.260 1.00 0.00 ATOM 9182 H12X DPP 76 24.820 38.040 40.460 1.00 0.00 ATOM 9183 H12Y DPP 76 24.480 36.280 40.110 1.00 0.00 ATOM 9184 3C31 DPP 76 23.240 37.250 41.570 1.00 0.00 ATOM 9185 H13X DPP 76 22.630 36.330 41.500 1.00 0.00 ATOM 9186 H13Y DPP 76 22.550 38.120 41.610 1.00 0.00 ATOM 9187 4C31 DPP 76 24.170 37.060 42.780 1.00 0.00 ATOM 9188 H14X DPP 76 24.820 36.170 42.660 1.00 0.00 ATOM 9189 H14Y DPP 76 24.920 37.840 43.020 1.00 0.00 ATOM 9190 5C31 DPP 76 23.340 36.880 44.050 1.00 0.00 ATOM 9191 H15X DPP 76 22.740 35.940 43.990 1.00 0.00 ATOM 9192 H15Y DPP 76 22.550 37.660 44.120 1.00 0.00 ATOM 9193 6C31 DPP 76 24.240 36.820 45.280 1.00 0.00 ATOM 9194 H16X DPP 76 25.090 36.120 45.120 1.00 0.00 ATOM 9195 H16Y DPP 76 23.660 36.390 46.130 1.00 0.00 ATOM 9196 H16Z DPP 76 24.660 37.790 45.600 1.00 0.00 ATOM 9197 N DPP 77 13.690 12.810 27.790 1.00 0.00 ATOM 9198 HN1 DPP 77 13.450 12.780 26.780 1.00 0.00 ATOM 9199 HN2 DPP 77 13.650 13.790 28.110 1.00 0.00 ATOM 9200 HN3 DPP 77 14.590 12.300 27.950 1.00 0.00 ATOM 9201 C12 DPP 77 12.660 12.050 28.590 1.00 0.00 ATOM 9202 H12A DPP 77 13.020 12.150 29.630 1.00 0.00 ATOM 9203 H12B DPP 77 12.750 10.980 28.290 1.00 0.00 ATOM 9204 C11 DPP 77 11.240 12.610 28.470 1.00 0.00 ATOM 9205 H11A DPP 77 10.510 12.130 29.150 1.00 0.00 ATOM 9206 H11B DPP 77 11.270 13.710 28.590 1.00 0.00 ATOM 9207 P DPP 77 9.610 12.920 26.560 1.00 0.00 ATOM 9208 O13 DPP 77 9.410 12.620 25.130 1.00 0.00 ATOM 9209 O14 DPP 77 9.420 14.360 26.870 1.00 0.00 ATOM 9210 O11 DPP 77 8.500 12.160 27.430 1.00 0.00 ATOM 9211 O12 DPP 77 10.950 12.250 27.120 1.00 0.00 ATOM 9212 C1 DPP 77 8.450 10.730 27.320 1.00 0.00 ATOM 9213 HA DPP 77 9.450 10.280 27.510 1.00 0.00 ATOM 9214 HB DPP 77 8.030 10.440 26.340 1.00 0.00 ATOM 9215 C2 DPP 77 7.490 10.150 28.370 1.00 0.00 ATOM 9216 HS DPP 77 6.580 9.770 27.850 1.00 0.00 ATOM 9217 O21 DPP 77 7.150 11.040 29.440 1.00 0.00 ATOM 9218 C21 DPP 77 6.400 12.080 29.070 1.00 0.00 ATOM 9219 O22 DPP 77 5.840 12.130 27.990 1.00 0.00 ATOM 9220 C22 DPP 77 6.380 13.210 30.090 1.00 0.00 ATOM 9221 H2R DPP 77 5.380 13.630 30.320 1.00 0.00 ATOM 9222 H2S DPP 77 7.100 14.010 29.800 1.00 0.00 ATOM 9223 C3 DPP 77 8.020 8.830 28.950 1.00 0.00 ATOM 9224 HX DPP 77 8.520 8.250 28.140 1.00 0.00 ATOM 9225 HY DPP 77 7.070 8.450 29.370 1.00 0.00 ATOM 9226 O31 DPP 77 8.970 8.950 30.010 1.00 0.00 ATOM 9227 C31 DPP 77 9.200 7.800 30.640 1.00 0.00 ATOM 9228 O32 DPP 77 8.650 6.740 30.400 1.00 0.00 ATOM 9229 C32 DPP 77 10.160 7.930 31.810 1.00 0.00 ATOM 9230 H2X DPP 77 11.170 7.790 31.360 1.00 0.00 ATOM 9231 H2Y DPP 77 10.010 7.010 32.420 1.00 0.00 ATOM 9232 C23 DPP 77 7.040 12.770 31.390 1.00 0.00 ATOM 9233 H3R DPP 77 8.080 12.440 31.180 1.00 0.00 ATOM 9234 H3S DPP 77 6.440 11.950 31.830 1.00 0.00 ATOM 9235 C24 DPP 77 7.080 13.950 32.370 1.00 0.00 ATOM 9236 H4R DPP 77 6.060 14.320 32.580 1.00 0.00 ATOM 9237 H4S DPP 77 7.770 14.750 32.020 1.00 0.00 ATOM 9238 C25 DPP 77 7.720 13.360 33.630 1.00 0.00 ATOM 9239 H5R DPP 77 8.580 12.700 33.360 1.00 0.00 ATOM 9240 H5S DPP 77 6.870 12.870 34.140 1.00 0.00 ATOM 9241 C26 DPP 77 8.390 14.420 34.500 1.00 0.00 ATOM 9242 H6R DPP 77 7.680 15.210 34.830 1.00 0.00 ATOM 9243 H6S DPP 77 9.270 14.770 33.920 1.00 0.00 ATOM 9244 C27 DPP 77 8.900 13.790 35.800 1.00 0.00 ATOM 9245 H7R DPP 77 9.740 13.110 35.580 1.00 0.00 ATOM 9246 H7S DPP 77 8.040 13.220 36.220 1.00 0.00 ATOM 9247 C28 DPP 77 9.520 14.860 36.700 1.00 0.00 ATOM 9248 H8R DPP 77 9.020 15.830 36.500 1.00 0.00 ATOM 9249 H8S DPP 77 10.550 14.950 36.300 1.00 0.00 ATOM 9250 C29 DPP 77 9.620 14.410 38.160 1.00 0.00 ATOM 9251 H9R DPP 77 9.940 13.350 38.080 1.00 0.00 ATOM 9252 H9S DPP 77 8.570 14.400 38.540 1.00 0.00 ATOM 9253 0C21 DPP 77 10.690 15.090 39.010 1.00 0.00 ATOM 9254 H10R DPP 77 10.310 16.080 39.360 1.00 0.00 ATOM 9255 H10S DPP 77 11.570 15.470 38.440 1.00 0.00 ATOM 9256 1C21 DPP 77 11.100 14.250 40.220 1.00 0.00 ATOM 9257 H11R DPP 77 11.440 13.240 39.900 1.00 0.00 ATOM 9258 H11S DPP 77 10.200 14.100 40.860 1.00 0.00 ATOM 9259 2C21 DPP 77 12.190 14.870 41.090 1.00 0.00 ATOM 9260 H12R DPP 77 12.250 14.230 41.990 1.00 0.00 ATOM 9261 H12S DPP 77 11.960 15.860 41.530 1.00 0.00 ATOM 9262 3C21 DPP 77 13.520 15.170 40.390 1.00 0.00 ATOM 9263 H13R DPP 77 13.530 15.060 39.290 1.00 0.00 ATOM 9264 H13S DPP 77 14.270 14.430 40.750 1.00 0.00 ATOM 9265 4C21 DPP 77 14.200 16.470 40.840 1.00 0.00 ATOM 9266 H14R DPP 77 14.230 16.530 41.950 1.00 0.00 ATOM 9267 H14S DPP 77 13.580 17.380 40.690 1.00 0.00 ATOM 9268 5C21 DPP 77 15.540 16.650 40.130 1.00 0.00 ATOM 9269 H15R DPP 77 15.330 16.830 39.050 1.00 0.00 ATOM 9270 H15S DPP 77 16.130 15.720 40.300 1.00 0.00 ATOM 9271 6C21 DPP 77 16.440 17.720 40.740 1.00 0.00 ATOM 9272 H16R DPP 77 15.940 18.700 40.570 1.00 0.00 ATOM 9273 H16S DPP 77 17.360 17.840 40.120 1.00 0.00 ATOM 9274 H16T DPP 77 16.660 17.660 41.830 1.00 0.00 ATOM 9275 C33 DPP 77 9.940 9.200 32.630 1.00 0.00 ATOM 9276 H3X DPP 77 8.880 9.350 32.920 1.00 0.00 ATOM 9277 H3Y DPP 77 10.280 10.060 32.010 1.00 0.00 ATOM 9278 C34 DPP 77 10.630 9.400 33.980 1.00 0.00 ATOM 9279 H4X DPP 77 10.320 10.320 34.530 1.00 0.00 ATOM 9280 H4Y DPP 77 10.220 8.530 34.530 1.00 0.00 ATOM 9281 C35 DPP 77 12.140 9.160 34.100 1.00 0.00 ATOM 9282 H5X DPP 77 12.660 9.920 33.490 1.00 0.00 ATOM 9283 H5Y DPP 77 12.160 8.160 33.620 1.00 0.00 ATOM 9284 C36 DPP 77 12.800 9.080 35.480 1.00 0.00 ATOM 9285 H6X DPP 77 13.880 8.870 35.340 1.00 0.00 ATOM 9286 H6Y DPP 77 12.450 8.240 36.110 1.00 0.00 ATOM 9287 C37 DPP 77 12.540 10.320 36.350 1.00 0.00 ATOM 9288 H7X DPP 77 11.460 10.520 36.500 1.00 0.00 ATOM 9289 H7Y DPP 77 12.870 11.300 35.950 1.00 0.00 ATOM 9290 C38 DPP 77 13.200 9.990 37.690 1.00 0.00 ATOM 9291 H8X DPP 77 14.220 9.760 37.330 1.00 0.00 ATOM 9292 H8Y DPP 77 12.870 9.050 38.180 1.00 0.00 ATOM 9293 C39 DPP 77 13.350 11.140 38.690 1.00 0.00 ATOM 9294 H9X DPP 77 12.300 11.250 39.040 1.00 0.00 ATOM 9295 H9Y DPP 77 13.800 11.980 38.110 1.00 0.00 ATOM 9296 0C31 DPP 77 14.150 10.610 39.880 1.00 0.00 ATOM 9297 H10X DPP 77 15.080 10.080 39.610 1.00 0.00 ATOM 9298 H10Y DPP 77 13.600 9.740 40.290 1.00 0.00 ATOM 9299 1C31 DPP 77 14.410 11.740 40.880 1.00 0.00 ATOM 9300 H11X DPP 77 13.390 12.180 41.030 1.00 0.00 ATOM 9301 H11Y DPP 77 15.090 12.500 40.440 1.00 0.00 ATOM 9302 2C31 DPP 77 14.910 11.340 42.270 1.00 0.00 ATOM 9303 H12X DPP 77 14.120 10.730 42.760 1.00 0.00 ATOM 9304 H12Y DPP 77 15.110 12.260 42.850 1.00 0.00 ATOM 9305 3C31 DPP 77 16.270 10.650 42.170 1.00 0.00 ATOM 9306 H13X DPP 77 16.080 9.660 41.690 1.00 0.00 ATOM 9307 H13Y DPP 77 16.640 10.400 43.180 1.00 0.00 ATOM 9308 4C31 DPP 77 17.400 11.520 41.600 1.00 0.00 ATOM 9309 H14X DPP 77 17.670 12.360 42.280 1.00 0.00 ATOM 9310 H14Y DPP 77 17.030 12.050 40.700 1.00 0.00 ATOM 9311 5C31 DPP 77 18.590 10.620 41.270 1.00 0.00 ATOM 9312 H15X DPP 77 18.260 9.800 40.590 1.00 0.00 ATOM 9313 H15Y DPP 77 18.770 10.040 42.200 1.00 0.00 ATOM 9314 6C31 DPP 77 19.920 11.210 40.840 1.00 0.00 ATOM 9315 H16X DPP 77 20.200 12.280 40.990 1.00 0.00 ATOM 9316 H16Y DPP 77 20.030 11.250 39.730 1.00 0.00 ATOM 9317 H16Z DPP 77 20.740 10.660 41.350 1.00 0.00 ATOM 9318 N DPP 78 6.700 59.660 24.460 1.00 0.00 ATOM 9319 HN1 DPP 78 7.010 58.670 24.340 1.00 0.00 ATOM 9320 HN2 DPP 78 6.260 59.990 23.570 1.00 0.00 ATOM 9321 HN3 DPP 78 7.560 60.240 24.410 1.00 0.00 ATOM 9322 C12 DPP 78 5.740 59.880 25.600 1.00 0.00 ATOM 9323 H12A DPP 78 6.070 59.250 26.450 1.00 0.00 ATOM 9324 H12B DPP 78 4.840 59.390 25.150 1.00 0.00 ATOM 9325 C11 DPP 78 5.490 61.350 25.930 1.00 0.00 ATOM 9326 H11A DPP 78 6.360 61.950 25.580 1.00 0.00 ATOM 9327 H11B DPP 78 5.340 61.540 27.020 1.00 0.00 ATOM 9328 P DPP 78 4.070 63.420 24.960 1.00 0.00 ATOM 9329 O13 DPP 78 2.630 63.660 24.720 1.00 0.00 ATOM 9330 O14 DPP 78 4.960 63.990 23.930 1.00 0.00 ATOM 9331 O11 DPP 78 4.450 64.040 26.390 1.00 0.00 ATOM 9332 O12 DPP 78 4.360 61.870 25.240 1.00 0.00 ATOM 9333 C1 DPP 78 3.470 63.810 27.410 1.00 0.00 ATOM 9334 HA DPP 78 3.010 62.800 27.370 1.00 0.00 ATOM 9335 HB DPP 78 2.600 64.470 27.220 1.00 0.00 ATOM 9336 C2 DPP 78 4.080 64.050 28.800 1.00 0.00 ATOM 9337 HS DPP 78 4.650 64.990 28.640 1.00 0.00 ATOM 9338 O21 DPP 78 4.980 62.950 29.000 1.00 0.00 ATOM 9339 C21 DPP 78 5.980 63.320 29.790 1.00 0.00 ATOM 9340 O22 DPP 78 6.130 64.420 30.300 1.00 0.00 ATOM 9341 C22 DPP 78 6.880 62.100 29.930 1.00 0.00 ATOM 9342 H2R DPP 78 7.790 62.320 29.330 1.00 0.00 ATOM 9343 H2S DPP 78 6.330 61.200 29.580 1.00 0.00 ATOM 9344 C3 DPP 78 3.000 64.390 29.840 1.00 0.00 ATOM 9345 HX DPP 78 2.580 65.310 29.390 1.00 0.00 ATOM 9346 HY DPP 78 3.430 64.850 30.760 1.00 0.00 ATOM 9347 O31 DPP 78 2.020 63.380 30.110 1.00 0.00 ATOM 9348 C31 DPP 78 0.770 63.840 30.140 1.00 0.00 ATOM 9349 O32 DPP 78 0.480 65.000 29.920 1.00 0.00 ATOM 9350 C32 DPP 78 -0.190 62.740 30.590 1.00 0.00 ATOM 9351 H2X DPP 78 0.250 62.310 31.520 1.00 0.00 ATOM 9352 H2Y DPP 78 -0.270 61.920 29.840 1.00 0.00 ATOM 9353 C23 DPP 78 7.430 61.950 31.350 1.00 0.00 ATOM 9354 H3R DPP 78 6.660 61.600 32.070 1.00 0.00 ATOM 9355 H3S DPP 78 7.770 62.930 31.760 1.00 0.00 ATOM 9356 C24 DPP 78 8.710 61.120 31.370 1.00 0.00 ATOM 9357 H4R DPP 78 9.630 61.630 31.020 1.00 0.00 ATOM 9358 H4S DPP 78 8.550 60.250 30.690 1.00 0.00 ATOM 9359 C25 DPP 78 9.000 60.660 32.800 1.00 0.00 ATOM 9360 H5R DPP 78 9.590 59.730 32.700 1.00 0.00 ATOM 9361 H5S DPP 78 8.050 60.590 33.370 1.00 0.00 ATOM 9362 C26 DPP 78 9.940 61.710 33.390 1.00 0.00 ATOM 9363 H6R DPP 78 9.460 62.700 33.260 1.00 0.00 ATOM 9364 H6S DPP 78 10.960 61.640 32.960 1.00 0.00 ATOM 9365 C27 DPP 78 10.200 61.550 34.890 1.00 0.00 ATOM 9366 H7R DPP 78 9.210 61.400 35.380 1.00 0.00 ATOM 9367 H7S DPP 78 10.700 62.490 35.220 1.00 0.00 ATOM 9368 C28 DPP 78 11.080 60.330 35.160 1.00 0.00 ATOM 9369 H8R DPP 78 11.950 60.300 34.480 1.00 0.00 ATOM 9370 H8S DPP 78 10.510 59.380 35.210 1.00 0.00 ATOM 9371 C29 DPP 78 11.500 60.450 36.630 1.00 0.00 ATOM 9372 H9R DPP 78 10.560 60.580 37.220 1.00 0.00 ATOM 9373 H9S DPP 78 12.320 61.190 36.760 1.00 0.00 ATOM 9374 0C21 DPP 78 12.290 59.270 37.210 1.00 0.00 ATOM 9375 H10R DPP 78 13.160 59.170 36.530 1.00 0.00 ATOM 9376 H10S DPP 78 11.570 58.440 37.050 1.00 0.00 ATOM 9377 1C21 DPP 78 12.770 59.400 38.650 1.00 0.00 ATOM 9378 H11R DPP 78 11.780 59.380 39.160 1.00 0.00 ATOM 9379 H11S DPP 78 13.100 60.420 38.940 1.00 0.00 ATOM 9380 2C21 DPP 78 13.780 58.430 39.250 1.00 0.00 ATOM 9381 H12R DPP 78 14.840 58.620 38.980 1.00 0.00 ATOM 9382 H12S DPP 78 13.560 57.360 39.020 1.00 0.00 ATOM 9383 3C21 DPP 78 13.850 58.490 40.780 1.00 0.00 ATOM 9384 H13R DPP 78 12.900 57.980 41.040 1.00 0.00 ATOM 9385 H13S DPP 78 13.910 59.570 41.020 1.00 0.00 ATOM 9386 4C21 DPP 78 15.120 57.900 41.380 1.00 0.00 ATOM 9387 H14R DPP 78 15.930 58.560 41.010 1.00 0.00 ATOM 9388 H14S DPP 78 15.410 56.920 40.920 1.00 0.00 ATOM 9389 5C21 DPP 78 15.290 57.950 42.900 1.00 0.00 ATOM 9390 H15R DPP 78 14.420 57.500 43.440 1.00 0.00 ATOM 9391 H15S DPP 78 15.300 59.030 43.150 1.00 0.00 ATOM 9392 6C21 DPP 78 16.580 57.240 43.320 1.00 0.00 ATOM 9393 H16R DPP 78 16.560 56.180 43.010 1.00 0.00 ATOM 9394 H16S DPP 78 16.660 57.360 44.420 1.00 0.00 ATOM 9395 H16T DPP 78 17.420 57.830 42.890 1.00 0.00 ATOM 9396 C33 DPP 78 -1.470 63.510 30.900 1.00 0.00 ATOM 9397 H3X DPP 78 -1.750 63.690 29.840 1.00 0.00 ATOM 9398 H3Y DPP 78 -1.370 64.500 31.390 1.00 0.00 ATOM 9399 C34 DPP 78 -2.600 62.820 31.670 1.00 0.00 ATOM 9400 H4X DPP 78 -2.270 62.470 32.670 1.00 0.00 ATOM 9401 H4Y DPP 78 -2.990 62.000 31.030 1.00 0.00 ATOM 9402 C35 DPP 78 -3.660 63.880 31.990 1.00 0.00 ATOM 9403 H5X DPP 78 -4.700 63.620 31.720 1.00 0.00 ATOM 9404 H5Y DPP 78 -3.590 64.770 31.340 1.00 0.00 ATOM 9405 C36 DPP 78 -3.650 64.380 33.440 1.00 0.00 ATOM 9406 H6X DPP 78 -4.400 65.160 33.690 1.00 0.00 ATOM 9407 H6Y DPP 78 -2.630 64.770 33.670 1.00 0.00 ATOM 9408 C37 DPP 78 -3.870 63.270 34.480 1.00 0.00 ATOM 9409 H7X DPP 78 -3.050 62.520 34.450 1.00 0.00 ATOM 9410 H7Y DPP 78 -4.810 62.740 34.230 1.00 0.00 ATOM 9411 C38 DPP 78 -4.010 63.660 35.950 1.00 0.00 ATOM 9412 H8X DPP 78 -4.040 62.820 36.670 1.00 0.00 ATOM 9413 H8Y DPP 78 -4.910 64.300 36.070 1.00 0.00 ATOM 9414 C39 DPP 78 -2.790 64.460 36.430 1.00 0.00 ATOM 9415 H9X DPP 78 -2.780 65.400 35.840 1.00 0.00 ATOM 9416 H9Y DPP 78 -1.780 64.000 36.340 1.00 0.00 ATOM 9417 0C31 DPP 78 -3.020 64.980 37.850 1.00 0.00 ATOM 9418 H10X DPP 78 -2.770 64.220 38.620 1.00 0.00 ATOM 9419 H10Y DPP 78 -4.090 65.290 37.840 1.00 0.00 ATOM 9420 1C31 DPP 78 -2.270 66.290 38.080 1.00 0.00 ATOM 9421 H11X DPP 78 -2.900 67.100 37.670 1.00 0.00 ATOM 9422 H11Y DPP 78 -1.370 66.340 37.420 1.00 0.00 ATOM 9423 2C31 DPP 78 -1.880 66.590 39.530 1.00 0.00 ATOM 9424 H12X DPP 78 -1.370 67.570 39.570 1.00 0.00 ATOM 9425 H12Y DPP 78 -1.110 65.860 39.850 1.00 0.00 ATOM 9426 3C31 DPP 78 -3.090 66.590 40.460 1.00 0.00 ATOM 9427 H13X DPP 78 -3.410 65.530 40.550 1.00 0.00 ATOM 9428 H13Y DPP 78 -3.910 67.170 39.970 1.00 0.00 ATOM 9429 4C31 DPP 78 -2.740 67.040 41.880 1.00 0.00 ATOM 9430 H14X DPP 78 -2.340 68.070 41.930 1.00 0.00 ATOM 9431 H14Y DPP 78 -1.990 66.270 42.180 1.00 0.00 ATOM 9432 5C31 DPP 78 -3.940 66.800 42.810 1.00 0.00 ATOM 9433 H15X DPP 78 -4.470 65.870 42.540 1.00 0.00 ATOM 9434 H15Y DPP 78 -4.680 67.620 42.650 1.00 0.00 ATOM 9435 6C31 DPP 78 -3.630 66.870 44.300 1.00 0.00 ATOM 9436 H16X DPP 78 -2.900 67.700 44.440 1.00 0.00 ATOM 9437 H16Y DPP 78 -3.140 65.940 44.670 1.00 0.00 ATOM 9438 H16Z DPP 78 -4.560 67.100 44.850 1.00 0.00 ATOM 9439 N DPP 79 42.940 30.560 21.070 1.00 0.00 ATOM 9440 HN1 DPP 79 42.690 29.670 20.590 1.00 0.00 ATOM 9441 HN2 DPP 79 43.090 31.260 20.310 1.00 0.00 ATOM 9442 HN3 DPP 79 43.900 30.440 21.460 1.00 0.00 ATOM 9443 C12 DPP 79 41.870 31.000 22.030 1.00 0.00 ATOM 9444 H12A DPP 79 42.360 31.800 22.630 1.00 0.00 ATOM 9445 H12B DPP 79 41.110 31.470 21.380 1.00 0.00 ATOM 9446 C11 DPP 79 41.390 29.850 22.920 1.00 0.00 ATOM 9447 H11A DPP 79 40.560 30.320 23.490 1.00 0.00 ATOM 9448 H11B DPP 79 42.200 29.550 23.620 1.00 0.00 ATOM 9449 P DPP 79 39.440 28.530 22.030 1.00 0.00 ATOM 9450 O13 DPP 79 39.280 27.310 21.200 1.00 0.00 ATOM 9451 O14 DPP 79 38.770 29.790 21.630 1.00 0.00 ATOM 9452 O11 DPP 79 39.190 28.230 23.580 1.00 0.00 ATOM 9453 O12 DPP 79 41.020 28.780 22.040 1.00 0.00 ATOM 9454 C1 DPP 79 39.760 26.980 23.980 1.00 0.00 ATOM 9455 HA DPP 79 40.840 27.130 24.150 1.00 0.00 ATOM 9456 HB DPP 79 39.640 26.140 23.260 1.00 0.00 ATOM 9457 C2 DPP 79 39.080 26.360 25.210 1.00 0.00 ATOM 9458 HS DPP 79 38.210 25.740 24.900 1.00 0.00 ATOM 9459 O21 DPP 79 38.590 27.330 26.140 1.00 0.00 ATOM 9460 C21 DPP 79 37.300 27.610 25.960 1.00 0.00 ATOM 9461 O22 DPP 79 36.610 27.290 25.000 1.00 0.00 ATOM 9462 C22 DPP 79 36.820 28.370 27.180 1.00 0.00 ATOM 9463 H2R DPP 79 36.820 29.460 26.940 1.00 0.00 ATOM 9464 H2S DPP 79 37.460 28.240 28.080 1.00 0.00 ATOM 9465 C3 DPP 79 40.010 25.300 25.810 1.00 0.00 ATOM 9466 HX DPP 79 40.990 25.720 26.130 1.00 0.00 ATOM 9467 HY DPP 79 40.150 24.730 24.860 1.00 0.00 ATOM 9468 O31 DPP 79 39.340 24.620 26.870 1.00 0.00 ATOM 9469 C31 DPP 79 38.500 23.610 26.620 1.00 0.00 ATOM 9470 O32 DPP 79 37.920 23.420 25.570 1.00 0.00 ATOM 9471 C32 DPP 79 38.280 22.870 27.930 1.00 0.00 ATOM 9472 H2X DPP 79 39.170 22.900 28.590 1.00 0.00 ATOM 9473 H2Y DPP 79 38.150 21.840 27.550 1.00 0.00 ATOM 9474 C23 DPP 79 35.350 28.120 27.560 1.00 0.00 ATOM 9475 H3R DPP 79 35.390 27.130 28.040 1.00 0.00 ATOM 9476 H3S DPP 79 34.800 28.080 26.590 1.00 0.00 ATOM 9477 C24 DPP 79 34.760 29.170 28.510 1.00 0.00 ATOM 9478 H4R DPP 79 33.690 28.920 28.650 1.00 0.00 ATOM 9479 H4S DPP 79 34.940 30.180 28.080 1.00 0.00 ATOM 9480 C25 DPP 79 35.430 29.330 29.880 1.00 0.00 ATOM 9481 H5R DPP 79 36.450 29.750 29.720 1.00 0.00 ATOM 9482 H5S DPP 79 35.590 28.270 30.190 1.00 0.00 ATOM 9483 C26 DPP 79 34.620 30.040 30.960 1.00 0.00 ATOM 9484 H6R DPP 79 33.600 29.610 31.060 1.00 0.00 ATOM 9485 H6S DPP 79 34.550 31.110 30.700 1.00 0.00 ATOM 9486 C27 DPP 79 35.340 30.000 32.320 1.00 0.00 ATOM 9487 H7R DPP 79 36.370 30.410 32.330 1.00 0.00 ATOM 9488 H7S DPP 79 35.410 28.910 32.480 1.00 0.00 ATOM 9489 C28 DPP 79 34.520 30.620 33.460 1.00 0.00 ATOM 9490 H8R DPP 79 33.470 30.280 33.400 1.00 0.00 ATOM 9491 H8S DPP 79 34.610 31.720 33.320 1.00 0.00 ATOM 9492 C29 DPP 79 34.950 30.140 34.850 1.00 0.00 ATOM 9493 H9R DPP 79 34.900 29.030 34.720 1.00 0.00 ATOM 9494 H9S DPP 79 34.160 30.290 35.620 1.00 0.00 ATOM 9495 0C21 DPP 79 36.340 30.530 35.340 1.00 0.00 ATOM 9496 H10R DPP 79 36.360 31.610 35.620 1.00 0.00 ATOM 9497 H10S DPP 79 37.080 30.310 34.540 1.00 0.00 ATOM 9498 1C21 DPP 79 36.730 29.600 36.490 1.00 0.00 ATOM 9499 H11R DPP 79 36.940 28.550 36.200 1.00 0.00 ATOM 9500 H11S DPP 79 35.980 29.730 37.300 1.00 0.00 ATOM 9501 2C21 DPP 79 38.130 29.810 37.070 1.00 0.00 ATOM 9502 H12R DPP 79 38.970 29.520 36.410 1.00 0.00 ATOM 9503 H12S DPP 79 38.090 29.130 37.950 1.00 0.00 ATOM 9504 3C21 DPP 79 38.450 31.230 37.550 1.00 0.00 ATOM 9505 H13R DPP 79 37.780 32.040 37.210 1.00 0.00 ATOM 9506 H13S DPP 79 39.510 31.420 37.300 1.00 0.00 ATOM 9507 4C21 DPP 79 38.380 31.320 39.080 1.00 0.00 ATOM 9508 H14R DPP 79 39.030 31.930 39.740 1.00 0.00 ATOM 9509 H14S DPP 79 38.480 30.280 39.470 1.00 0.00 ATOM 9510 5C21 DPP 79 37.010 31.760 39.600 1.00 0.00 ATOM 9511 H15R DPP 79 36.110 31.180 39.290 1.00 0.00 ATOM 9512 H15S DPP 79 36.880 32.830 39.310 1.00 0.00 ATOM 9513 6C21 DPP 79 37.110 31.690 41.120 1.00 0.00 ATOM 9514 H16R DPP 79 37.630 32.620 41.430 1.00 0.00 ATOM 9515 H16S DPP 79 37.460 30.720 41.520 1.00 0.00 ATOM 9516 H16T DPP 79 36.110 31.940 41.540 1.00 0.00 ATOM 9517 C33 DPP 79 36.960 23.340 28.560 1.00 0.00 ATOM 9518 H3X DPP 79 36.660 22.450 29.150 1.00 0.00 ATOM 9519 H3Y DPP 79 36.220 23.610 27.770 1.00 0.00 ATOM 9520 C34 DPP 79 37.110 24.610 29.410 1.00 0.00 ATOM 9521 H4X DPP 79 37.340 25.540 28.850 1.00 0.00 ATOM 9522 H4Y DPP 79 38.000 24.510 30.060 1.00 0.00 ATOM 9523 C35 DPP 79 35.880 24.940 30.250 1.00 0.00 ATOM 9524 H5X DPP 79 35.400 24.030 30.660 1.00 0.00 ATOM 9525 H5Y DPP 79 35.120 25.460 29.620 1.00 0.00 ATOM 9526 C36 DPP 79 36.340 25.770 31.450 1.00 0.00 ATOM 9527 H6X DPP 79 35.680 26.630 31.680 1.00 0.00 ATOM 9528 H6Y DPP 79 37.360 26.150 31.210 1.00 0.00 ATOM 9529 C37 DPP 79 36.350 24.800 32.640 1.00 0.00 ATOM 9530 H7X DPP 79 36.830 23.800 32.540 1.00 0.00 ATOM 9531 H7Y DPP 79 35.290 24.640 32.900 1.00 0.00 ATOM 9532 C38 DPP 79 36.990 25.530 33.820 1.00 0.00 ATOM 9533 H8X DPP 79 36.580 26.560 33.970 1.00 0.00 ATOM 9534 H8Y DPP 79 38.080 25.710 33.700 1.00 0.00 ATOM 9535 C39 DPP 79 36.840 24.740 35.120 1.00 0.00 ATOM 9536 H9X DPP 79 37.630 24.890 35.890 1.00 0.00 ATOM 9537 H9Y DPP 79 36.900 23.660 34.840 1.00 0.00 ATOM 9538 0C31 DPP 79 35.470 24.780 35.790 1.00 0.00 ATOM 9539 H10X DPP 79 35.400 23.850 36.390 1.00 0.00 ATOM 9540 H10Y DPP 79 34.730 24.490 35.010 1.00 0.00 ATOM 9541 1C31 DPP 79 35.300 26.010 36.690 1.00 0.00 ATOM 9542 H11X DPP 79 34.310 26.100 37.170 1.00 0.00 ATOM 9543 H11Y DPP 79 35.330 26.960 36.120 1.00 0.00 ATOM 9544 2C31 DPP 79 36.240 26.100 37.890 1.00 0.00 ATOM 9545 H12X DPP 79 37.220 26.560 37.650 1.00 0.00 ATOM 9546 H12Y DPP 79 36.500 25.060 38.170 1.00 0.00 ATOM 9547 3C31 DPP 79 35.560 26.770 39.080 1.00 0.00 ATOM 9548 H13X DPP 79 34.660 26.200 39.420 1.00 0.00 ATOM 9549 H13Y DPP 79 35.250 27.730 38.600 1.00 0.00 ATOM 9550 4C31 DPP 79 36.340 26.920 40.390 1.00 0.00 ATOM 9551 H14X DPP 79 37.160 27.630 40.130 1.00 0.00 ATOM 9552 H14Y DPP 79 36.640 25.910 40.730 1.00 0.00 ATOM 9553 5C31 DPP 79 35.600 27.520 41.590 1.00 0.00 ATOM 9554 H15X DPP 79 34.710 26.880 41.790 1.00 0.00 ATOM 9555 H15Y DPP 79 35.170 28.480 41.220 1.00 0.00 ATOM 9556 6C31 DPP 79 36.360 27.820 42.880 1.00 0.00 ATOM 9557 H16X DPP 79 35.690 28.310 43.620 1.00 0.00 ATOM 9558 H16Y DPP 79 37.200 28.540 42.870 1.00 0.00 ATOM 9559 H16Z DPP 79 36.650 26.830 43.280 1.00 0.00 ATOM 9560 N DPP 80 30.150 34.540 21.610 1.00 0.00 ATOM 9561 HN1 DPP 80 29.150 34.330 21.410 1.00 0.00 ATOM 9562 HN2 DPP 80 30.500 34.950 20.720 1.00 0.00 ATOM 9563 HN3 DPP 80 30.620 33.650 21.880 1.00 0.00 ATOM 9564 C12 DPP 80 30.250 35.530 22.740 1.00 0.00 ATOM 9565 H12A DPP 80 31.310 35.850 22.640 1.00 0.00 ATOM 9566 H12B DPP 80 30.020 35.030 23.710 1.00 0.00 ATOM 9567 C11 DPP 80 29.370 36.750 22.480 1.00 0.00 ATOM 9568 H11A DPP 80 29.600 37.330 21.550 1.00 0.00 ATOM 9569 H11B DPP 80 29.520 37.490 23.300 1.00 0.00 ATOM 9570 P DPP 80 27.070 36.600 23.640 1.00 0.00 ATOM 9571 O13 DPP 80 25.800 35.870 23.450 1.00 0.00 ATOM 9572 O14 DPP 80 27.010 38.050 23.910 1.00 0.00 ATOM 9573 O11 DPP 80 27.730 35.850 24.890 1.00 0.00 ATOM 9574 O12 DPP 80 28.010 36.340 22.370 1.00 0.00 ATOM 9575 C1 DPP 80 27.670 34.420 24.880 1.00 0.00 ATOM 9576 HA DPP 80 28.660 33.980 25.130 1.00 0.00 ATOM 9577 HB DPP 80 27.450 34.130 23.830 1.00 0.00 ATOM 9578 C2 DPP 80 26.480 33.900 25.710 1.00 0.00 ATOM 9579 HS DPP 80 25.590 34.480 25.390 1.00 0.00 ATOM 9580 O21 DPP 80 26.890 34.200 27.040 1.00 0.00 ATOM 9581 C21 DPP 80 25.920 34.440 27.940 1.00 0.00 ATOM 9582 O22 DPP 80 24.800 34.740 27.570 1.00 0.00 ATOM 9583 C22 DPP 80 26.360 34.220 29.380 1.00 0.00 ATOM 9584 H2R DPP 80 27.130 33.420 29.300 1.00 0.00 ATOM 9585 H2S DPP 80 25.530 33.840 30.000 1.00 0.00 ATOM 9586 C3 DPP 80 26.120 32.430 25.430 1.00 0.00 ATOM 9587 HX DPP 80 26.010 32.200 24.350 1.00 0.00 ATOM 9588 HY DPP 80 25.140 32.160 25.880 1.00 0.00 ATOM 9589 O31 DPP 80 27.090 31.510 25.950 1.00 0.00 ATOM 9590 C31 DPP 80 27.940 30.900 25.120 1.00 0.00 ATOM 9591 O32 DPP 80 28.130 31.290 23.970 1.00 0.00 ATOM 9592 C32 DPP 80 28.780 29.930 25.940 1.00 0.00 ATOM 9593 H2X DPP 80 29.820 29.850 25.570 1.00 0.00 ATOM 9594 H2Y DPP 80 28.290 28.940 25.830 1.00 0.00 ATOM 9595 C23 DPP 80 27.000 35.530 29.860 1.00 0.00 ATOM 9596 H3R DPP 80 26.100 36.170 29.960 1.00 0.00 ATOM 9597 H3S DPP 80 27.760 35.850 29.120 1.00 0.00 ATOM 9598 C24 DPP 80 27.640 35.390 31.240 1.00 0.00 ATOM 9599 H4R DPP 80 28.100 36.380 31.430 1.00 0.00 ATOM 9600 H4S DPP 80 28.410 34.590 31.220 1.00 0.00 ATOM 9601 C25 DPP 80 26.530 35.040 32.240 1.00 0.00 ATOM 9602 H5R DPP 80 26.120 34.030 32.040 1.00 0.00 ATOM 9603 H5S DPP 80 25.700 35.770 32.110 1.00 0.00 ATOM 9604 C26 DPP 80 27.040 35.190 33.670 1.00 0.00 ATOM 9605 H6R DPP 80 27.230 36.270 33.840 1.00 0.00 ATOM 9606 H6S DPP 80 27.990 34.630 33.730 1.00 0.00 ATOM 9607 C27 DPP 80 26.030 34.960 34.800 1.00 0.00 ATOM 9608 H7R DPP 80 25.800 33.880 34.700 1.00 0.00 ATOM 9609 H7S DPP 80 25.010 35.420 34.760 1.00 0.00 ATOM 9610 C28 DPP 80 26.570 35.140 36.220 1.00 0.00 ATOM 9611 H8R DPP 80 27.550 34.630 36.290 1.00 0.00 ATOM 9612 H8S DPP 80 25.940 34.700 37.020 1.00 0.00 ATOM 9613 C29 DPP 80 26.650 36.580 36.710 1.00 0.00 ATOM 9614 H9R DPP 80 25.600 36.930 36.790 1.00 0.00 ATOM 9615 H9S DPP 80 27.300 37.250 36.100 1.00 0.00 ATOM 9616 0C21 DPP 80 27.250 36.660 38.110 1.00 0.00 ATOM 9617 H10R DPP 80 28.190 36.060 38.190 1.00 0.00 ATOM 9618 H10S DPP 80 26.610 36.000 38.730 1.00 0.00 ATOM 9619 1C21 DPP 80 27.430 38.050 38.730 1.00 0.00 ATOM 9620 H11R DPP 80 26.430 38.460 38.440 1.00 0.00 ATOM 9621 H11S DPP 80 28.140 38.710 38.190 1.00 0.00 ATOM 9622 2C21 DPP 80 27.570 38.030 40.250 1.00 0.00 ATOM 9623 H12R DPP 80 28.600 37.710 40.540 1.00 0.00 ATOM 9624 H12S DPP 80 26.850 37.370 40.770 1.00 0.00 ATOM 9625 3C21 DPP 80 27.200 39.450 40.700 1.00 0.00 ATOM 9626 H13R DPP 80 26.790 39.430 41.730 1.00 0.00 ATOM 9627 H13S DPP 80 26.360 39.730 40.020 1.00 0.00 ATOM 9628 4C21 DPP 80 28.350 40.440 40.550 1.00 0.00 ATOM 9629 H14R DPP 80 28.010 41.480 40.730 1.00 0.00 ATOM 9630 H14S DPP 80 28.800 40.470 39.540 1.00 0.00 ATOM 9631 5C21 DPP 80 29.420 40.270 41.640 1.00 0.00 ATOM 9632 H15R DPP 80 30.040 41.180 41.770 1.00 0.00 ATOM 9633 H15S DPP 80 30.030 39.410 41.290 1.00 0.00 ATOM 9634 6C21 DPP 80 28.880 40.050 43.050 1.00 0.00 ATOM 9635 H16R DPP 80 28.220 40.860 43.420 1.00 0.00 ATOM 9636 H16S DPP 80 29.770 39.950 43.700 1.00 0.00 ATOM 9637 H16T DPP 80 28.230 39.150 43.000 1.00 0.00 ATOM 9638 C33 DPP 80 28.920 30.290 27.430 1.00 0.00 ATOM 9639 H3X DPP 80 27.950 30.090 27.930 1.00 0.00 ATOM 9640 H3Y DPP 80 29.200 31.350 27.580 1.00 0.00 ATOM 9641 C34 DPP 80 29.780 29.330 28.250 1.00 0.00 ATOM 9642 H4X DPP 80 30.790 29.330 27.790 1.00 0.00 ATOM 9643 H4Y DPP 80 29.320 28.320 28.320 1.00 0.00 ATOM 9644 C35 DPP 80 29.890 29.720 29.730 1.00 0.00 ATOM 9645 H5X DPP 80 30.440 28.880 30.210 1.00 0.00 ATOM 9646 H5Y DPP 80 28.870 29.830 30.150 1.00 0.00 ATOM 9647 C36 DPP 80 30.710 31.000 29.940 1.00 0.00 ATOM 9648 H6X DPP 80 30.350 31.740 29.200 1.00 0.00 ATOM 9649 H6Y DPP 80 31.770 30.710 29.750 1.00 0.00 ATOM 9650 C37 DPP 80 30.500 31.460 31.380 1.00 0.00 ATOM 9651 H7X DPP 80 31.050 30.750 32.030 1.00 0.00 ATOM 9652 H7Y DPP 80 29.430 31.570 31.660 1.00 0.00 ATOM 9653 C38 DPP 80 30.950 32.910 31.530 1.00 0.00 ATOM 9654 H8X DPP 80 30.200 33.540 30.990 1.00 0.00 ATOM 9655 H8Y DPP 80 32.000 33.160 31.250 1.00 0.00 ATOM 9656 C39 DPP 80 30.600 33.460 32.910 1.00 0.00 ATOM 9657 H9X DPP 80 29.570 33.220 33.270 1.00 0.00 ATOM 9658 H9Y DPP 80 30.700 34.560 32.840 1.00 0.00 ATOM 9659 0C31 DPP 80 31.700 32.920 33.820 1.00 0.00 ATOM 9660 H10X DPP 80 32.610 33.390 33.410 1.00 0.00 ATOM 9661 H10Y DPP 80 31.820 31.820 33.740 1.00 0.00 ATOM 9662 1C31 DPP 80 31.430 33.210 35.300 1.00 0.00 ATOM 9663 H11X DPP 80 32.390 32.880 35.750 1.00 0.00 ATOM 9664 H11Y DPP 80 30.510 32.740 35.720 1.00 0.00 ATOM 9665 2C31 DPP 80 31.210 34.690 35.640 1.00 0.00 ATOM 9666 H12X DPP 80 30.310 35.010 35.080 1.00 0.00 ATOM 9667 H12Y DPP 80 32.110 35.250 35.300 1.00 0.00 ATOM 9668 3C31 DPP 80 30.970 34.900 37.130 1.00 0.00 ATOM 9669 H13X DPP 80 31.690 34.230 37.650 1.00 0.00 ATOM 9670 H13Y DPP 80 29.940 34.550 37.330 1.00 0.00 ATOM 9671 4C31 DPP 80 31.030 36.390 37.470 1.00 0.00 ATOM 9672 H14X DPP 80 30.060 36.810 37.120 1.00 0.00 ATOM 9673 H14Y DPP 80 31.840 36.800 36.830 1.00 0.00 ATOM 9674 5C31 DPP 80 31.350 36.570 38.950 1.00 0.00 ATOM 9675 H15X DPP 80 32.360 36.110 39.000 1.00 0.00 ATOM 9676 H15Y DPP 80 30.640 36.000 39.600 1.00 0.00 ATOM 9677 6C31 DPP 80 31.420 37.980 39.540 1.00 0.00 ATOM 9678 H16X DPP 80 31.460 38.070 40.650 1.00 0.00 ATOM 9679 H16Y DPP 80 30.480 38.450 39.190 1.00 0.00 ATOM 9680 H16Z DPP 80 32.220 38.630 39.130 1.00 0.00 ATOM 9681 N DPP 81 45.050 7.100 20.640 1.00 0.00 ATOM 9682 HN1 DPP 81 45.560 6.520 19.940 1.00 0.00 ATOM 9683 HN2 DPP 81 44.610 7.950 20.240 1.00 0.00 ATOM 9684 HN3 DPP 81 45.760 7.550 21.250 1.00 0.00 ATOM 9685 C12 DPP 81 44.140 6.320 21.550 1.00 0.00 ATOM 9686 H12A DPP 81 43.240 6.930 21.780 1.00 0.00 ATOM 9687 H12B DPP 81 43.840 5.410 20.970 1.00 0.00 ATOM 9688 C11 DPP 81 44.710 5.740 22.840 1.00 0.00 ATOM 9689 H11A DPP 81 45.590 5.110 22.570 1.00 0.00 ATOM 9690 H11B DPP 81 43.990 5.150 23.440 1.00 0.00 ATOM 9691 P DPP 81 46.510 6.650 24.480 1.00 0.00 ATOM 9692 O13 DPP 81 46.770 8.010 24.990 1.00 0.00 ATOM 9693 O14 DPP 81 47.590 5.860 23.840 1.00 0.00 ATOM 9694 O11 DPP 81 45.860 5.740 25.630 1.00 0.00 ATOM 9695 O12 DPP 81 45.230 6.870 23.540 1.00 0.00 ATOM 9696 C1 DPP 81 44.560 5.960 26.160 1.00 0.00 ATOM 9697 HA DPP 81 44.150 4.970 26.470 1.00 0.00 ATOM 9698 HB DPP 81 43.860 6.390 25.410 1.00 0.00 ATOM 9699 C2 DPP 81 44.540 6.870 27.400 1.00 0.00 ATOM 9700 HS DPP 81 45.000 7.810 27.040 1.00 0.00 ATOM 9701 O21 DPP 81 45.240 6.140 28.420 1.00 0.00 ATOM 9702 C21 DPP 81 46.090 6.840 29.170 1.00 0.00 ATOM 9703 O22 DPP 81 46.360 8.020 29.000 1.00 0.00 ATOM 9704 C22 DPP 81 46.990 5.780 29.800 1.00 0.00 ATOM 9705 H2R DPP 81 47.980 5.930 29.320 1.00 0.00 ATOM 9706 H2S DPP 81 46.670 4.750 29.530 1.00 0.00 ATOM 9707 C3 DPP 81 43.140 7.180 27.940 1.00 0.00 ATOM 9708 HX DPP 81 42.540 6.280 27.700 1.00 0.00 ATOM 9709 HY DPP 81 42.900 8.080 27.330 1.00 0.00 ATOM 9710 O31 DPP 81 43.150 7.400 29.360 1.00 0.00 ATOM 9711 C31 DPP 81 43.310 8.690 29.680 1.00 0.00 ATOM 9712 O32 DPP 81 43.370 9.620 28.890 1.00 0.00 ATOM 9713 C32 DPP 81 43.370 8.710 31.200 1.00 0.00 ATOM 9714 H2X DPP 81 44.140 8.010 31.600 1.00 0.00 ATOM 9715 H2Y DPP 81 42.330 8.430 31.450 1.00 0.00 ATOM 9716 C23 DPP 81 47.110 6.030 31.310 1.00 0.00 ATOM 9717 H3R DPP 81 47.410 7.080 31.520 1.00 0.00 ATOM 9718 H3S DPP 81 47.980 5.360 31.440 1.00 0.00 ATOM 9719 C24 DPP 81 45.900 5.550 32.110 1.00 0.00 ATOM 9720 H4R DPP 81 45.720 4.450 32.020 1.00 0.00 ATOM 9721 H4S DPP 81 44.940 5.940 31.710 1.00 0.00 ATOM 9722 C25 DPP 81 46.130 5.730 33.610 1.00 0.00 ATOM 9723 H5R DPP 81 47.110 5.340 33.980 1.00 0.00 ATOM 9724 H5S DPP 81 45.360 5.020 33.990 1.00 0.00 ATOM 9725 C26 DPP 81 45.820 7.170 34.000 1.00 0.00 ATOM 9726 H6R DPP 81 44.800 7.510 33.730 1.00 0.00 ATOM 9727 H6S DPP 81 46.650 7.730 33.510 1.00 0.00 ATOM 9728 C27 DPP 81 45.840 7.370 35.520 1.00 0.00 ATOM 9729 H7R DPP 81 44.990 6.740 35.870 1.00 0.00 ATOM 9730 H7S DPP 81 45.680 8.460 35.670 1.00 0.00 ATOM 9731 C28 DPP 81 47.150 7.000 36.220 1.00 0.00 ATOM 9732 H8R DPP 81 47.980 7.680 35.900 1.00 0.00 ATOM 9733 H8S DPP 81 47.520 5.970 36.070 1.00 0.00 ATOM 9734 C29 DPP 81 47.040 7.270 37.720 1.00 0.00 ATOM 9735 H9R DPP 81 46.370 6.480 38.120 1.00 0.00 ATOM 9736 H9S DPP 81 46.650 8.280 37.930 1.00 0.00 ATOM 9737 0C21 DPP 81 48.370 7.170 38.460 1.00 0.00 ATOM 9738 H10R DPP 81 49.040 7.850 37.890 1.00 0.00 ATOM 9739 H10S DPP 81 48.760 6.140 38.320 1.00 0.00 ATOM 9740 1C21 DPP 81 48.410 7.580 39.930 1.00 0.00 ATOM 9741 H11R DPP 81 47.740 8.460 40.060 1.00 0.00 ATOM 9742 H11S DPP 81 49.490 7.750 40.120 1.00 0.00 ATOM 9743 2C21 DPP 81 47.940 6.540 40.940 1.00 0.00 ATOM 9744 H12R DPP 81 48.050 5.520 40.510 1.00 0.00 ATOM 9745 H12S DPP 81 46.830 6.640 41.030 1.00 0.00 ATOM 9746 3C21 DPP 81 48.660 6.670 42.290 1.00 0.00 ATOM 9747 H13R DPP 81 48.680 7.760 42.490 1.00 0.00 ATOM 9748 H13S DPP 81 49.720 6.350 42.270 1.00 0.00 ATOM 9749 4C21 DPP 81 47.960 5.990 43.460 1.00 0.00 ATOM 9750 H14R DPP 81 48.600 6.100 44.370 1.00 0.00 ATOM 9751 H14S DPP 81 48.100 4.880 43.420 1.00 0.00 ATOM 9752 5C21 DPP 81 46.590 6.500 43.900 1.00 0.00 ATOM 9753 H15R DPP 81 45.980 6.530 42.970 1.00 0.00 ATOM 9754 H15S DPP 81 46.780 7.570 44.110 1.00 0.00 ATOM 9755 6C21 DPP 81 45.950 5.740 45.060 1.00 0.00 ATOM 9756 H16R DPP 81 45.550 4.750 44.730 1.00 0.00 ATOM 9757 H16S DPP 81 45.260 6.350 45.680 1.00 0.00 ATOM 9758 H16T DPP 81 46.790 5.390 45.700 1.00 0.00 ATOM 9759 C33 DPP 81 43.810 10.120 31.600 1.00 0.00 ATOM 9760 H3X DPP 81 43.000 10.800 31.260 1.00 0.00 ATOM 9761 H3Y DPP 81 44.750 10.460 31.110 1.00 0.00 ATOM 9762 C34 DPP 81 43.780 10.310 33.120 1.00 0.00 ATOM 9763 H4X DPP 81 44.370 11.230 33.290 1.00 0.00 ATOM 9764 H4Y DPP 81 44.230 9.410 33.600 1.00 0.00 ATOM 9765 C35 DPP 81 42.450 10.430 33.860 1.00 0.00 ATOM 9766 H5X DPP 81 41.740 9.710 33.380 1.00 0.00 ATOM 9767 H5Y DPP 81 42.010 11.430 33.640 1.00 0.00 ATOM 9768 C36 DPP 81 42.580 10.160 35.360 1.00 0.00 ATOM 9769 H6X DPP 81 42.800 9.070 35.460 1.00 0.00 ATOM 9770 H6Y DPP 81 41.640 10.290 35.940 1.00 0.00 ATOM 9771 C37 DPP 81 43.610 10.960 36.150 1.00 0.00 ATOM 9772 H7X DPP 81 44.310 11.500 35.490 1.00 0.00 ATOM 9773 H7Y DPP 81 44.180 10.260 36.810 1.00 0.00 ATOM 9774 C38 DPP 81 43.050 11.970 37.160 1.00 0.00 ATOM 9775 H8X DPP 81 42.450 12.690 36.570 1.00 0.00 ATOM 9776 H8Y DPP 81 43.840 12.460 37.770 1.00 0.00 ATOM 9777 C39 DPP 81 42.190 11.440 38.310 1.00 0.00 ATOM 9778 H9X DPP 81 42.830 10.840 38.990 1.00 0.00 ATOM 9779 H9Y DPP 81 41.360 10.790 37.950 1.00 0.00 ATOM 9780 0C31 DPP 81 41.670 12.660 39.060 1.00 0.00 ATOM 9781 H10X DPP 81 41.150 13.330 38.340 1.00 0.00 ATOM 9782 H10Y DPP 81 42.530 13.230 39.480 1.00 0.00 ATOM 9783 1C31 DPP 81 40.770 12.350 40.260 1.00 0.00 ATOM 9784 H11X DPP 81 41.430 12.330 41.150 1.00 0.00 ATOM 9785 H11Y DPP 81 40.220 11.390 40.120 1.00 0.00 ATOM 9786 2C31 DPP 81 39.820 13.540 40.410 1.00 0.00 ATOM 9787 H12X DPP 81 39.430 13.730 39.390 1.00 0.00 ATOM 9788 H12Y DPP 81 40.270 14.500 40.730 1.00 0.00 ATOM 9789 3C31 DPP 81 38.590 13.270 41.290 1.00 0.00 ATOM 9790 H13X DPP 81 38.210 14.310 41.360 1.00 0.00 ATOM 9791 H13Y DPP 81 38.880 12.870 42.280 1.00 0.00 ATOM 9792 4C31 DPP 81 37.450 12.470 40.670 1.00 0.00 ATOM 9793 H14X DPP 81 37.850 11.440 40.520 1.00 0.00 ATOM 9794 H14Y DPP 81 37.250 12.850 39.640 1.00 0.00 ATOM 9795 5C31 DPP 81 36.180 12.440 41.510 1.00 0.00 ATOM 9796 H15X DPP 81 35.980 13.500 41.770 1.00 0.00 ATOM 9797 H15Y DPP 81 36.380 11.870 42.440 1.00 0.00 ATOM 9798 6C31 DPP 81 35.010 11.760 40.790 1.00 0.00 ATOM 9799 H16X DPP 81 35.310 10.720 40.560 1.00 0.00 ATOM 9800 H16Y DPP 81 34.850 12.200 39.780 1.00 0.00 ATOM 9801 H16Z DPP 81 34.100 11.920 41.410 1.00 0.00 ATOM 9802 N DPP 82 14.530 23.060 21.070 1.00 0.00 ATOM 9803 HN1 DPP 82 13.800 23.080 21.820 1.00 0.00 ATOM 9804 HN2 DPP 82 15.410 23.490 21.430 1.00 0.00 ATOM 9805 HN3 DPP 82 14.170 23.790 20.420 1.00 0.00 ATOM 9806 C12 DPP 82 14.670 21.660 20.550 1.00 0.00 ATOM 9807 H12A DPP 82 15.650 21.630 20.010 1.00 0.00 ATOM 9808 H12B DPP 82 13.830 21.500 19.840 1.00 0.00 ATOM 9809 C11 DPP 82 14.870 20.610 21.640 1.00 0.00 ATOM 9810 H11A DPP 82 15.830 20.730 22.180 1.00 0.00 ATOM 9811 H11B DPP 82 14.910 19.650 21.070 1.00 0.00 ATOM 9812 P DPP 82 14.170 20.020 24.000 1.00 0.00 ATOM 9813 O13 DPP 82 15.490 20.470 24.480 1.00 0.00 ATOM 9814 O14 DPP 82 13.990 18.550 23.930 1.00 0.00 ATOM 9815 O11 DPP 82 13.070 20.550 25.030 1.00 0.00 ATOM 9816 O12 DPP 82 13.790 20.660 22.580 1.00 0.00 ATOM 9817 C1 DPP 82 13.270 21.850 25.590 1.00 0.00 ATOM 9818 HA DPP 82 12.270 22.280 25.810 1.00 0.00 ATOM 9819 HB DPP 82 13.680 22.440 24.740 1.00 0.00 ATOM 9820 C2 DPP 82 14.080 21.990 26.890 1.00 0.00 ATOM 9821 HS DPP 82 15.130 21.670 26.710 1.00 0.00 ATOM 9822 O21 DPP 82 13.440 21.090 27.790 1.00 0.00 ATOM 9823 C21 DPP 82 14.320 20.420 28.540 1.00 0.00 ATOM 9824 O22 DPP 82 15.530 20.580 28.580 1.00 0.00 ATOM 9825 C22 DPP 82 13.600 19.270 29.240 1.00 0.00 ATOM 9826 H2R DPP 82 13.210 18.630 28.420 1.00 0.00 ATOM 9827 H2S DPP 82 12.690 19.650 29.750 1.00 0.00 ATOM 9828 C3 DPP 82 13.870 23.340 27.590 1.00 0.00 ATOM 9829 HX DPP 82 12.780 23.560 27.700 1.00 0.00 ATOM 9830 HY DPP 82 14.400 24.120 27.010 1.00 0.00 ATOM 9831 O31 DPP 82 14.480 23.360 28.890 1.00 0.00 ATOM 9832 C31 DPP 82 15.750 23.780 28.940 1.00 0.00 ATOM 9833 O32 DPP 82 16.600 23.780 28.070 1.00 0.00 ATOM 9834 C32 DPP 82 16.050 24.170 30.380 1.00 0.00 ATOM 9835 H2X DPP 82 15.130 24.270 30.990 1.00 0.00 ATOM 9836 H2Y DPP 82 16.720 23.430 30.860 1.00 0.00 ATOM 9837 C23 DPP 82 14.560 18.600 30.220 1.00 0.00 ATOM 9838 H3R DPP 82 15.360 18.090 29.640 1.00 0.00 ATOM 9839 H3S DPP 82 14.090 17.710 30.700 1.00 0.00 ATOM 9840 C24 DPP 82 15.130 19.460 31.350 1.00 0.00 ATOM 9841 H4R DPP 82 15.900 20.050 30.810 1.00 0.00 ATOM 9842 H4S DPP 82 15.660 18.780 32.060 1.00 0.00 ATOM 9843 C25 DPP 82 14.290 20.600 31.910 1.00 0.00 ATOM 9844 H5R DPP 82 13.460 20.030 32.380 1.00 0.00 ATOM 9845 H5S DPP 82 13.930 21.160 31.020 1.00 0.00 ATOM 9846 C26 DPP 82 14.860 21.640 32.880 1.00 0.00 ATOM 9847 H6R DPP 82 13.960 22.110 33.310 1.00 0.00 ATOM 9848 H6S DPP 82 15.490 22.450 32.470 1.00 0.00 ATOM 9849 C27 DPP 82 15.440 21.030 34.160 1.00 0.00 ATOM 9850 H7R DPP 82 15.560 21.920 34.820 1.00 0.00 ATOM 9851 H7S DPP 82 16.440 20.630 33.870 1.00 0.00 ATOM 9852 C28 DPP 82 14.590 19.890 34.730 1.00 0.00 ATOM 9853 H8R DPP 82 14.810 18.970 34.150 1.00 0.00 ATOM 9854 H8S DPP 82 13.520 20.200 34.710 1.00 0.00 ATOM 9855 C29 DPP 82 15.160 19.460 36.080 1.00 0.00 ATOM 9856 H9R DPP 82 15.210 20.350 36.730 1.00 0.00 ATOM 9857 H9S DPP 82 16.200 19.120 35.870 1.00 0.00 ATOM 9858 0C21 DPP 82 14.310 18.320 36.620 1.00 0.00 ATOM 9859 H10R DPP 82 13.230 18.480 36.410 1.00 0.00 ATOM 9860 H10S DPP 82 14.310 18.380 37.730 1.00 0.00 ATOM 9861 1C21 DPP 82 14.570 16.920 36.050 1.00 0.00 ATOM 9862 H11R DPP 82 15.460 16.420 36.480 1.00 0.00 ATOM 9863 H11S DPP 82 14.870 16.950 34.980 1.00 0.00 ATOM 9864 2C21 DPP 82 13.360 15.980 36.050 1.00 0.00 ATOM 9865 H12R DPP 82 12.510 16.490 35.560 1.00 0.00 ATOM 9866 H12S DPP 82 13.040 15.880 37.110 1.00 0.00 ATOM 9867 3C21 DPP 82 13.640 14.640 35.350 1.00 0.00 ATOM 9868 H13R DPP 82 12.830 13.890 35.500 1.00 0.00 ATOM 9869 H13S DPP 82 14.490 14.080 35.800 1.00 0.00 ATOM 9870 4C21 DPP 82 13.810 14.750 33.840 1.00 0.00 ATOM 9871 H14R DPP 82 14.320 13.810 33.530 1.00 0.00 ATOM 9872 H14S DPP 82 14.470 15.550 33.440 1.00 0.00 ATOM 9873 5C21 DPP 82 12.530 14.730 33.010 1.00 0.00 ATOM 9874 H15R DPP 82 12.890 15.050 32.010 1.00 0.00 ATOM 9875 H15S DPP 82 11.810 15.440 33.460 1.00 0.00 ATOM 9876 6C21 DPP 82 11.850 13.360 32.920 1.00 0.00 ATOM 9877 H16R DPP 82 11.270 13.110 33.830 1.00 0.00 ATOM 9878 H16S DPP 82 12.650 12.590 32.890 1.00 0.00 ATOM 9879 H16T DPP 82 11.310 13.330 31.950 1.00 0.00 ATOM 9880 C33 DPP 82 16.990 25.370 30.400 1.00 0.00 ATOM 9881 H3X DPP 82 17.960 24.850 30.560 1.00 0.00 ATOM 9882 H3Y DPP 82 16.990 26.010 29.490 1.00 0.00 ATOM 9883 C34 DPP 82 16.590 26.240 31.600 1.00 0.00 ATOM 9884 H4X DPP 82 15.930 25.700 32.300 1.00 0.00 ATOM 9885 H4Y DPP 82 16.030 27.150 31.320 1.00 0.00 ATOM 9886 C35 DPP 82 17.740 26.620 32.540 1.00 0.00 ATOM 9887 H5X DPP 82 18.190 27.530 32.100 1.00 0.00 ATOM 9888 H5Y DPP 82 18.490 25.800 32.580 1.00 0.00 ATOM 9889 C36 DPP 82 17.370 26.840 34.010 1.00 0.00 ATOM 9890 H6X DPP 82 17.270 25.870 34.540 1.00 0.00 ATOM 9891 H6Y DPP 82 16.370 27.320 34.030 1.00 0.00 ATOM 9892 C37 DPP 82 18.530 27.550 34.710 1.00 0.00 ATOM 9893 H7X DPP 82 18.720 28.590 34.370 1.00 0.00 ATOM 9894 H7Y DPP 82 19.380 26.880 34.450 1.00 0.00 ATOM 9895 C38 DPP 82 18.290 27.470 36.220 1.00 0.00 ATOM 9896 H8X DPP 82 17.920 26.450 36.460 1.00 0.00 ATOM 9897 H8Y DPP 82 17.470 28.220 36.310 1.00 0.00 ATOM 9898 C39 DPP 82 19.560 27.900 36.960 1.00 0.00 ATOM 9899 H9X DPP 82 19.990 28.830 36.520 1.00 0.00 ATOM 9900 H9Y DPP 82 20.210 27.010 36.980 1.00 0.00 ATOM 9901 0C31 DPP 82 19.410 28.240 38.440 1.00 0.00 ATOM 9902 H10X DPP 82 18.670 29.070 38.450 1.00 0.00 ATOM 9903 H10Y DPP 82 20.350 28.530 38.960 1.00 0.00 ATOM 9904 1C31 DPP 82 18.860 27.020 39.180 1.00 0.00 ATOM 9905 H11X DPP 82 19.580 26.180 39.160 1.00 0.00 ATOM 9906 H11Y DPP 82 17.900 26.710 38.700 1.00 0.00 ATOM 9907 2C31 DPP 82 18.540 27.220 40.660 1.00 0.00 ATOM 9908 H12X DPP 82 17.650 27.830 40.950 1.00 0.00 ATOM 9909 H12Y DPP 82 19.380 27.900 40.950 1.00 0.00 ATOM 9910 3C31 DPP 82 18.390 26.000 41.570 1.00 0.00 ATOM 9911 H13X DPP 82 19.340 25.420 41.560 1.00 0.00 ATOM 9912 H13Y DPP 82 17.640 25.270 41.220 1.00 0.00 ATOM 9913 4C31 DPP 82 18.140 26.340 43.040 1.00 0.00 ATOM 9914 H14X DPP 82 18.580 27.360 43.110 1.00 0.00 ATOM 9915 H14Y DPP 82 18.730 25.690 43.720 1.00 0.00 ATOM 9916 5C31 DPP 82 16.710 26.210 43.550 1.00 0.00 ATOM 9917 H15X DPP 82 16.070 26.800 42.870 1.00 0.00 ATOM 9918 H15Y DPP 82 16.760 26.680 44.560 1.00 0.00 ATOM 9919 6C31 DPP 82 16.140 24.800 43.690 1.00 0.00 ATOM 9920 H16X DPP 82 15.290 24.850 44.420 1.00 0.00 ATOM 9921 H16Y DPP 82 16.850 24.000 43.980 1.00 0.00 ATOM 9922 H16Z DPP 82 15.690 24.440 42.740 1.00 0.00 ATOM 9923 N DPP 83 43.640 21.290 22.880 1.00 0.00 ATOM 9924 HN1 DPP 83 44.350 20.910 22.210 1.00 0.00 ATOM 9925 HN2 DPP 83 43.050 22.030 22.440 1.00 0.00 ATOM 9926 HN3 DPP 83 44.220 21.680 23.650 1.00 0.00 ATOM 9927 C12 DPP 83 43.010 20.070 23.490 1.00 0.00 ATOM 9928 H12A DPP 83 42.530 20.380 24.440 1.00 0.00 ATOM 9929 H12B DPP 83 42.260 19.690 22.770 1.00 0.00 ATOM 9930 C11 DPP 83 44.010 18.920 23.660 1.00 0.00 ATOM 9931 H11A DPP 83 44.320 18.650 22.620 1.00 0.00 ATOM 9932 H11B DPP 83 43.430 18.130 24.190 1.00 0.00 ATOM 9933 P DPP 83 46.170 18.040 24.550 1.00 0.00 ATOM 9934 O13 DPP 83 46.980 18.350 23.340 1.00 0.00 ATOM 9935 O14 DPP 83 45.580 16.700 24.730 1.00 0.00 ATOM 9936 O11 DPP 83 47.050 18.430 25.820 1.00 0.00 ATOM 9937 O12 DPP 83 45.070 19.200 24.570 1.00 0.00 ATOM 9938 C1 DPP 83 48.200 17.690 26.260 1.00 0.00 ATOM 9939 HA DPP 83 49.120 18.320 26.210 1.00 0.00 ATOM 9940 HB DPP 83 48.220 16.790 25.610 1.00 0.00 ATOM 9941 C2 DPP 83 48.040 17.260 27.720 1.00 0.00 ATOM 9942 HS DPP 83 48.640 16.340 27.920 1.00 0.00 ATOM 9943 O21 DPP 83 46.680 17.040 28.110 1.00 0.00 ATOM 9944 C21 DPP 83 46.310 15.830 27.680 1.00 0.00 ATOM 9945 O22 DPP 83 47.000 14.930 27.230 1.00 0.00 ATOM 9946 C22 DPP 83 44.830 15.670 28.010 1.00 0.00 ATOM 9947 H2R DPP 83 44.440 14.670 27.750 1.00 0.00 ATOM 9948 H2S DPP 83 44.220 16.490 27.570 1.00 0.00 ATOM 9949 C3 DPP 83 48.550 18.400 28.620 1.00 0.00 ATOM 9950 HX DPP 83 48.160 19.320 28.160 1.00 0.00 ATOM 9951 HY DPP 83 49.660 18.500 28.660 1.00 0.00 ATOM 9952 O31 DPP 83 48.100 18.230 29.970 1.00 0.00 ATOM 9953 C31 DPP 83 48.820 17.400 30.720 1.00 0.00 ATOM 9954 O32 DPP 83 49.600 16.530 30.370 1.00 0.00 ATOM 9955 C32 DPP 83 48.280 17.460 32.140 1.00 0.00 ATOM 9956 H2X DPP 83 47.470 18.220 32.190 1.00 0.00 ATOM 9957 H2Y DPP 83 49.010 17.760 32.920 1.00 0.00 ATOM 9958 C23 DPP 83 44.670 15.760 29.530 1.00 0.00 ATOM 9959 H3R DPP 83 44.780 16.830 29.770 1.00 0.00 ATOM 9960 H3S DPP 83 45.490 15.280 30.100 1.00 0.00 ATOM 9961 C24 DPP 83 43.340 15.160 29.980 1.00 0.00 ATOM 9962 H4R DPP 83 43.280 14.110 29.600 1.00 0.00 ATOM 9963 H4S DPP 83 42.550 15.740 29.470 1.00 0.00 ATOM 9964 C25 DPP 83 43.010 15.310 31.470 1.00 0.00 ATOM 9965 H5R DPP 83 42.990 16.400 31.710 1.00 0.00 ATOM 9966 H5S DPP 83 43.770 14.780 32.080 1.00 0.00 ATOM 9967 C26 DPP 83 41.580 14.910 31.800 1.00 0.00 ATOM 9968 H6R DPP 83 41.260 13.930 31.380 1.00 0.00 ATOM 9969 H6S DPP 83 40.890 15.740 31.530 1.00 0.00 ATOM 9970 C27 DPP 83 41.360 14.700 33.300 1.00 0.00 ATOM 9971 H7R DPP 83 41.710 13.670 33.530 1.00 0.00 ATOM 9972 H7S DPP 83 40.250 14.640 33.350 1.00 0.00 ATOM 9973 C28 DPP 83 41.880 15.770 34.260 1.00 0.00 ATOM 9974 H8R DPP 83 41.690 16.790 33.850 1.00 0.00 ATOM 9975 H8S DPP 83 42.960 15.490 34.300 1.00 0.00 ATOM 9976 C29 DPP 83 41.330 15.700 35.680 1.00 0.00 ATOM 9977 H9R DPP 83 42.060 16.150 36.380 1.00 0.00 ATOM 9978 H9S DPP 83 41.300 14.610 35.890 1.00 0.00 ATOM 9979 0C21 DPP 83 39.930 16.260 35.950 1.00 0.00 ATOM 9980 H10R DPP 83 39.440 15.460 35.340 1.00 0.00 ATOM 9981 H10S DPP 83 39.810 17.300 35.580 1.00 0.00 ATOM 9982 1C21 DPP 83 39.450 16.170 37.400 1.00 0.00 ATOM 9983 H11R DPP 83 39.680 17.150 37.850 1.00 0.00 ATOM 9984 H11S DPP 83 40.000 15.360 37.910 1.00 0.00 ATOM 9985 2C21 DPP 83 37.940 15.900 37.370 1.00 0.00 ATOM 9986 H12R DPP 83 37.730 15.780 38.460 1.00 0.00 ATOM 9987 H12S DPP 83 37.670 14.950 36.860 1.00 0.00 ATOM 9988 3C21 DPP 83 37.150 17.030 36.720 1.00 0.00 ATOM 9989 H13R DPP 83 37.360 17.070 35.630 1.00 0.00 ATOM 9990 H13S DPP 83 37.520 17.980 37.160 1.00 0.00 ATOM 9991 4C21 DPP 83 35.660 16.820 37.000 1.00 0.00 ATOM 9992 H14R DPP 83 35.440 16.930 38.090 1.00 0.00 ATOM 9993 H14S DPP 83 35.480 15.730 36.900 1.00 0.00 ATOM 9994 5C21 DPP 83 34.750 17.780 36.230 1.00 0.00 ATOM 9995 H15R DPP 83 35.080 18.840 36.280 1.00 0.00 ATOM 9996 H15S DPP 83 33.740 17.820 36.710 1.00 0.00 ATOM 9997 6C21 DPP 83 34.670 17.490 34.740 1.00 0.00 ATOM 9998 H16R DPP 83 34.290 16.460 34.560 1.00 0.00 ATOM 9999 H16S DPP 83 35.690 17.500 34.300 1.00 0.00 ATOM 10000 H16T DPP 83 33.980 18.190 34.200 1.00 0.00 ATOM 10001 C33 DPP 83 47.450 16.240 32.540 1.00 0.00 ATOM 10002 H3X DPP 83 47.950 15.300 32.230 1.00 0.00 ATOM 10003 H3Y DPP 83 46.490 16.240 31.980 1.00 0.00 ATOM 10004 C34 DPP 83 47.150 16.230 34.040 1.00 0.00 ATOM 10005 H4X DPP 83 48.170 16.180 34.480 1.00 0.00 ATOM 10006 H4Y DPP 83 46.620 15.250 34.120 1.00 0.00 ATOM 10007 C35 DPP 83 46.280 17.370 34.570 1.00 0.00 ATOM 10008 H5X DPP 83 45.280 17.490 34.110 1.00 0.00 ATOM 10009 H5Y DPP 83 46.850 18.320 34.420 1.00 0.00 ATOM 10010 C36 DPP 83 46.100 17.140 36.070 1.00 0.00 ATOM 10011 H6X DPP 83 45.610 18.040 36.490 1.00 0.00 ATOM 10012 H6Y DPP 83 47.050 16.940 36.610 1.00 0.00 ATOM 10013 C37 DPP 83 45.210 15.920 36.340 1.00 0.00 ATOM 10014 H7X DPP 83 45.650 15.050 35.820 1.00 0.00 ATOM 10015 H7Y DPP 83 44.180 15.990 35.930 1.00 0.00 ATOM 10016 C38 DPP 83 45.010 15.690 37.840 1.00 0.00 ATOM 10017 H8X DPP 83 44.300 14.830 37.840 1.00 0.00 ATOM 10018 H8Y DPP 83 44.550 16.520 38.400 1.00 0.00 ATOM 10019 C39 DPP 83 46.310 15.290 38.540 1.00 0.00 ATOM 10020 H9X DPP 83 47.100 16.040 38.350 1.00 0.00 ATOM 10021 H9Y DPP 83 46.700 14.400 38.000 1.00 0.00 ATOM 10022 0C31 DPP 83 46.220 15.050 40.050 1.00 0.00 ATOM 10023 H10X DPP 83 47.210 14.590 40.210 1.00 0.00 ATOM 10024 H10Y DPP 83 45.390 14.330 40.210 1.00 0.00 ATOM 10025 1C31 DPP 83 45.970 16.330 40.840 1.00 0.00 ATOM 10026 H11X DPP 83 44.870 16.450 40.750 1.00 0.00 ATOM 10027 H11Y DPP 83 46.550 17.230 40.530 1.00 0.00 ATOM 10028 2C31 DPP 83 46.300 16.200 42.330 1.00 0.00 ATOM 10029 H12X DPP 83 47.320 15.760 42.280 1.00 0.00 ATOM 10030 H12Y DPP 83 45.660 15.400 42.760 1.00 0.00 ATOM 10031 3C31 DPP 83 46.340 17.510 43.120 1.00 0.00 ATOM 10032 H13X DPP 83 45.300 17.740 43.430 1.00 0.00 ATOM 10033 H13Y DPP 83 46.700 18.330 42.470 1.00 0.00 ATOM 10034 4C31 DPP 83 47.180 17.350 44.390 1.00 0.00 ATOM 10035 H14X DPP 83 48.280 17.230 44.210 1.00 0.00 ATOM 10036 H14Y DPP 83 46.850 16.380 44.810 1.00 0.00 ATOM 10037 5C31 DPP 83 46.930 18.370 45.500 1.00 0.00 ATOM 10038 H15X DPP 83 45.860 18.470 45.780 1.00 0.00 ATOM 10039 H15Y DPP 83 47.430 19.280 45.100 1.00 0.00 ATOM 10040 6C31 DPP 83 47.680 18.000 46.780 1.00 0.00 ATOM 10041 H16X DPP 83 47.800 18.870 47.460 1.00 0.00 ATOM 10042 H16Y DPP 83 48.680 17.670 46.420 1.00 0.00 ATOM 10043 H16Z DPP 83 47.130 17.190 47.300 1.00 0.00 ATOM 10044 N DPP 84 56.310 8.990 26.090 1.00 0.00 ATOM 10045 HN1 DPP 84 55.620 8.210 26.130 1.00 0.00 ATOM 10046 HN2 DPP 84 55.820 9.800 26.510 1.00 0.00 ATOM 10047 HN3 DPP 84 56.430 9.060 25.060 1.00 0.00 ATOM 10048 C12 DPP 84 57.480 8.380 26.830 1.00 0.00 ATOM 10049 H12A DPP 84 57.990 7.700 26.110 1.00 0.00 ATOM 10050 H12B DPP 84 57.000 7.720 27.580 1.00 0.00 ATOM 10051 C11 DPP 84 58.420 9.320 27.580 1.00 0.00 ATOM 10052 H11A DPP 84 59.130 8.740 28.220 1.00 0.00 ATOM 10053 H11B DPP 84 57.820 10.030 28.180 1.00 0.00 ATOM 10054 P DPP 84 60.380 9.590 25.900 1.00 0.00 ATOM 10055 O13 DPP 84 60.180 10.030 24.500 1.00 0.00 ATOM 10056 O14 DPP 84 60.580 8.150 26.170 1.00 0.00 ATOM 10057 O11 DPP 84 61.640 10.440 26.390 1.00 0.00 ATOM 10058 O12 DPP 84 59.170 10.210 26.740 1.00 0.00 ATOM 10059 C1 DPP 84 61.540 11.790 26.870 1.00 0.00 ATOM 10060 HA DPP 84 60.650 12.340 26.490 1.00 0.00 ATOM 10061 HB DPP 84 62.430 12.290 26.440 1.00 0.00 ATOM 10062 C2 DPP 84 61.620 11.900 28.400 1.00 0.00 ATOM 10063 HS DPP 84 62.720 12.040 28.480 1.00 0.00 ATOM 10064 O21 DPP 84 61.260 10.670 29.030 1.00 0.00 ATOM 10065 C21 DPP 84 61.980 10.330 30.100 1.00 0.00 ATOM 10066 O22 DPP 84 62.960 10.940 30.480 1.00 0.00 ATOM 10067 C22 DPP 84 61.350 9.100 30.740 1.00 0.00 ATOM 10068 H2R DPP 84 60.360 8.970 30.250 1.00 0.00 ATOM 10069 H2S DPP 84 61.220 9.240 31.830 1.00 0.00 ATOM 10070 C3 DPP 84 60.720 13.000 28.980 1.00 0.00 ATOM 10071 HX DPP 84 59.690 12.590 28.890 1.00 0.00 ATOM 10072 HY DPP 84 60.790 13.890 28.310 1.00 0.00 ATOM 10073 O31 DPP 84 61.020 13.380 30.330 1.00 0.00 ATOM 10074 C31 DPP 84 61.880 14.390 30.420 1.00 0.00 ATOM 10075 O32 DPP 84 62.450 15.000 29.520 1.00 0.00 ATOM 10076 C32 DPP 84 62.170 14.510 31.910 1.00 0.00 ATOM 10077 H2X DPP 84 62.750 13.600 32.180 1.00 0.00 ATOM 10078 H2Y DPP 84 61.230 14.350 32.480 1.00 0.00 ATOM 10079 C23 DPP 84 62.120 7.840 30.340 1.00 0.00 ATOM 10080 H3R DPP 84 62.610 8.120 29.390 1.00 0.00 ATOM 10081 H3S DPP 84 61.500 6.950 30.120 1.00 0.00 ATOM 10082 C24 DPP 84 63.020 7.420 31.510 1.00 0.00 ATOM 10083 H4R DPP 84 63.080 6.320 31.420 1.00 0.00 ATOM 10084 H4S DPP 84 62.420 7.710 32.400 1.00 0.00 ATOM 10085 C25 DPP 84 64.420 8.050 31.450 1.00 0.00 ATOM 10086 H5R DPP 84 64.180 8.920 30.810 1.00 0.00 ATOM 10087 H5S DPP 84 65.120 7.430 30.840 1.00 0.00 ATOM 10088 C26 DPP 84 65.010 8.390 32.820 1.00 0.00 ATOM 10089 H6R DPP 84 66.110 8.340 32.690 1.00 0.00 ATOM 10090 H6S DPP 84 64.670 7.730 33.650 1.00 0.00 ATOM 10091 C27 DPP 84 64.630 9.790 33.300 1.00 0.00 ATOM 10092 H7R DPP 84 63.570 9.930 32.970 1.00 0.00 ATOM 10093 H7S DPP 84 65.260 10.510 32.730 1.00 0.00 ATOM 10094 C28 DPP 84 64.720 10.080 34.790 1.00 0.00 ATOM 10095 H8R DPP 84 64.020 9.610 35.510 1.00 0.00 ATOM 10096 H8S DPP 84 64.390 11.120 35.020 1.00 0.00 ATOM 10097 C29 DPP 84 66.200 9.970 35.190 1.00 0.00 ATOM 10098 H9R DPP 84 66.820 10.610 34.530 1.00 0.00 ATOM 10099 H9S DPP 84 66.420 8.880 35.150 1.00 0.00 ATOM 10100 0C21 DPP 84 66.350 10.480 36.630 1.00 0.00 ATOM 10101 H10R DPP 84 65.550 10.070 37.280 1.00 0.00 ATOM 10102 H10S DPP 84 66.300 11.590 36.630 1.00 0.00 ATOM 10103 1C21 DPP 84 67.580 9.940 37.350 1.00 0.00 ATOM 10104 H11R DPP 84 68.440 10.390 36.810 1.00 0.00 ATOM 10105 H11S DPP 84 67.560 8.830 37.250 1.00 0.00 ATOM 10106 2C21 DPP 84 67.630 10.260 38.850 1.00 0.00 ATOM 10107 H12R DPP 84 66.760 9.790 39.350 1.00 0.00 ATOM 10108 H12S DPP 84 67.700 11.370 38.830 1.00 0.00 ATOM 10109 3C21 DPP 84 68.960 9.790 39.440 1.00 0.00 ATOM 10110 H13R DPP 84 69.760 10.410 38.970 1.00 0.00 ATOM 10111 H13S DPP 84 69.230 8.840 38.930 1.00 0.00 ATOM 10112 4C21 DPP 84 68.980 9.890 40.960 1.00 0.00 ATOM 10113 H14R DPP 84 68.100 9.270 41.260 1.00 0.00 ATOM 10114 H14S DPP 84 68.640 10.930 41.140 1.00 0.00 ATOM 10115 5C21 DPP 84 70.340 9.670 41.620 1.00 0.00 ATOM 10116 H15R DPP 84 70.250 10.150 42.620 1.00 0.00 ATOM 10117 H15S DPP 84 71.120 10.240 41.070 1.00 0.00 ATOM 10118 6C21 DPP 84 70.790 8.210 41.740 1.00 0.00 ATOM 10119 H16R DPP 84 70.550 7.660 42.680 1.00 0.00 ATOM 10120 H16S DPP 84 71.900 8.250 41.780 1.00 0.00 ATOM 10121 H16T DPP 84 70.430 7.630 40.870 1.00 0.00 ATOM 10122 C33 DPP 84 62.960 15.760 32.320 1.00 0.00 ATOM 10123 H3X DPP 84 62.320 16.630 32.070 1.00 0.00 ATOM 10124 H3Y DPP 84 63.880 15.980 31.740 1.00 0.00 ATOM 10125 C34 DPP 84 63.220 15.820 33.830 1.00 0.00 ATOM 10126 H4X DPP 84 63.880 14.930 33.910 1.00 0.00 ATOM 10127 H4Y DPP 84 62.260 15.620 34.350 1.00 0.00 ATOM 10128 C35 DPP 84 63.960 17.070 34.330 1.00 0.00 ATOM 10129 H5X DPP 84 63.190 17.860 34.430 1.00 0.00 ATOM 10130 H5Y DPP 84 64.670 17.300 33.510 1.00 0.00 ATOM 10131 C36 DPP 84 64.670 16.950 35.680 1.00 0.00 ATOM 10132 H6X DPP 84 65.630 16.400 35.720 1.00 0.00 ATOM 10133 H6Y DPP 84 63.980 16.490 36.420 1.00 0.00 ATOM 10134 C37 DPP 84 65.020 18.300 36.320 1.00 0.00 ATOM 10135 H7X DPP 84 64.580 19.140 35.750 1.00 0.00 ATOM 10136 H7Y DPP 84 66.120 18.370 36.180 1.00 0.00 ATOM 10137 C38 DPP 84 64.840 18.300 37.840 1.00 0.00 ATOM 10138 H8X DPP 84 65.430 19.170 38.180 1.00 0.00 ATOM 10139 H8Y DPP 84 65.310 17.400 38.290 1.00 0.00 ATOM 10140 C39 DPP 84 63.390 18.550 38.250 1.00 0.00 ATOM 10141 H9X DPP 84 62.710 17.740 37.900 1.00 0.00 ATOM 10142 H9Y DPP 84 63.010 19.520 37.860 1.00 0.00 ATOM 10143 0C31 DPP 84 63.300 18.530 39.780 1.00 0.00 ATOM 10144 H10X DPP 84 63.840 19.410 40.190 1.00 0.00 ATOM 10145 H10Y DPP 84 63.730 17.590 40.190 1.00 0.00 ATOM 10146 1C31 DPP 84 61.920 18.720 40.420 1.00 0.00 ATOM 10147 H11X DPP 84 61.860 18.310 41.450 1.00 0.00 ATOM 10148 H11Y DPP 84 61.200 18.080 39.850 1.00 0.00 ATOM 10149 2C31 DPP 84 61.380 20.130 40.630 1.00 0.00 ATOM 10150 H12X DPP 84 61.310 20.560 39.610 1.00 0.00 ATOM 10151 H12Y DPP 84 62.190 20.650 41.190 1.00 0.00 ATOM 10152 3C31 DPP 84 59.970 20.100 41.220 1.00 0.00 ATOM 10153 H13X DPP 84 59.720 21.140 41.530 1.00 0.00 ATOM 10154 H13Y DPP 84 60.010 19.460 42.120 1.00 0.00 ATOM 10155 4C31 DPP 84 58.820 19.730 40.280 1.00 0.00 ATOM 10156 H14X DPP 84 57.880 19.660 40.870 1.00 0.00 ATOM 10157 H14Y DPP 84 58.990 18.720 39.850 1.00 0.00 ATOM 10158 5C31 DPP 84 58.640 20.820 39.220 1.00 0.00 ATOM 10159 H15X DPP 84 59.410 20.600 38.450 1.00 0.00 ATOM 10160 H15Y DPP 84 58.680 21.870 39.580 1.00 0.00 ATOM 10161 6C31 DPP 84 57.320 20.630 38.480 1.00 0.00 ATOM 10162 H16X DPP 84 56.490 21.260 38.850 1.00 0.00 ATOM 10163 H16Y DPP 84 57.040 19.550 38.400 1.00 0.00 ATOM 10164 H16Z DPP 84 57.420 21.070 37.460 1.00 0.00 ATOM 10165 N DPP 85 10.260 32.720 19.200 1.00 0.00 ATOM 10166 HN1 DPP 85 11.250 32.800 19.530 1.00 0.00 ATOM 10167 HN2 DPP 85 9.820 31.960 19.760 1.00 0.00 ATOM 10168 HN3 DPP 85 10.230 32.440 18.200 1.00 0.00 ATOM 10169 C12 DPP 85 9.400 33.930 19.450 1.00 0.00 ATOM 10170 H12A DPP 85 8.430 33.860 18.910 1.00 0.00 ATOM 10171 H12B DPP 85 9.980 34.750 18.960 1.00 0.00 ATOM 10172 C11 DPP 85 9.380 34.240 20.940 1.00 0.00 ATOM 10173 H11A DPP 85 8.740 33.500 21.470 1.00 0.00 ATOM 10174 H11B DPP 85 8.830 35.200 21.100 1.00 0.00 ATOM 10175 P DPP 85 11.520 35.690 21.420 1.00 0.00 ATOM 10176 O13 DPP 85 10.660 36.750 20.840 1.00 0.00 ATOM 10177 O14 DPP 85 12.790 35.410 20.710 1.00 0.00 ATOM 10178 O11 DPP 85 11.710 36.000 22.970 1.00 0.00 ATOM 10179 O12 DPP 85 10.700 34.320 21.480 1.00 0.00 ATOM 10180 C1 DPP 85 12.900 35.510 23.600 1.00 0.00 ATOM 10181 HA DPP 85 13.080 36.170 24.480 1.00 0.00 ATOM 10182 HB DPP 85 13.850 35.560 23.040 1.00 0.00 ATOM 10183 C2 DPP 85 12.690 34.060 24.080 1.00 0.00 ATOM 10184 HS DPP 85 12.100 33.560 23.280 1.00 0.00 ATOM 10185 O21 DPP 85 11.890 34.070 25.260 1.00 0.00 ATOM 10186 C21 DPP 85 11.280 32.920 25.560 1.00 0.00 ATOM 10187 O22 DPP 85 11.250 31.930 24.850 1.00 0.00 ATOM 10188 C22 DPP 85 10.730 33.030 26.980 1.00 0.00 ATOM 10189 H2R DPP 85 9.700 33.440 26.900 1.00 0.00 ATOM 10190 H2S DPP 85 11.380 33.640 27.640 1.00 0.00 ATOM 10191 C3 DPP 85 14.010 33.330 24.350 1.00 0.00 ATOM 10192 HX DPP 85 14.790 33.460 23.570 1.00 0.00 ATOM 10193 HY DPP 85 13.900 32.220 24.370 1.00 0.00 ATOM 10194 O31 DPP 85 14.620 33.910 25.510 1.00 0.00 ATOM 10195 C31 DPP 85 14.540 33.200 26.630 1.00 0.00 ATOM 10196 O32 DPP 85 13.950 32.130 26.670 1.00 0.00 ATOM 10197 C32 DPP 85 15.340 33.850 27.740 1.00 0.00 ATOM 10198 H2X DPP 85 15.540 34.910 27.460 1.00 0.00 ATOM 10199 H2Y DPP 85 16.310 33.310 27.730 1.00 0.00 ATOM 10200 C23 DPP 85 10.730 31.640 27.620 1.00 0.00 ATOM 10201 H3R DPP 85 11.760 31.320 27.880 1.00 0.00 ATOM 10202 H3S DPP 85 10.250 30.980 26.860 1.00 0.00 ATOM 10203 C24 DPP 85 9.900 31.580 28.900 1.00 0.00 ATOM 10204 H4R DPP 85 9.910 30.530 29.270 1.00 0.00 ATOM 10205 H4S DPP 85 8.870 31.950 28.720 1.00 0.00 ATOM 10206 C25 DPP 85 10.540 32.470 29.970 1.00 0.00 ATOM 10207 H5R DPP 85 10.410 33.520 29.630 1.00 0.00 ATOM 10208 H5S DPP 85 11.630 32.260 29.960 1.00 0.00 ATOM 10209 C26 DPP 85 9.780 32.250 31.280 1.00 0.00 ATOM 10210 H6R DPP 85 9.650 31.160 31.440 1.00 0.00 ATOM 10211 H6S DPP 85 8.740 32.610 31.120 1.00 0.00 ATOM 10212 C27 DPP 85 10.400 32.990 32.470 1.00 0.00 ATOM 10213 H7R DPP 85 10.420 34.070 32.190 1.00 0.00 ATOM 10214 H7S DPP 85 11.470 32.690 32.510 1.00 0.00 ATOM 10215 C28 DPP 85 9.890 32.590 33.860 1.00 0.00 ATOM 10216 H8R DPP 85 10.770 32.840 34.490 1.00 0.00 ATOM 10217 H8S DPP 85 9.800 31.490 33.970 1.00 0.00 ATOM 10218 C29 DPP 85 8.620 33.240 34.410 1.00 0.00 ATOM 10219 H9R DPP 85 8.080 33.710 33.560 1.00 0.00 ATOM 10220 H9S DPP 85 9.020 33.990 35.120 1.00 0.00 ATOM 10221 0C21 DPP 85 7.840 32.280 35.310 1.00 0.00 ATOM 10222 H10R DPP 85 8.500 31.930 36.130 1.00 0.00 ATOM 10223 H10S DPP 85 7.350 31.420 34.810 1.00 0.00 ATOM 10224 1C21 DPP 85 6.800 32.970 36.190 1.00 0.00 ATOM 10225 H11R DPP 85 7.230 33.870 36.670 1.00 0.00 ATOM 10226 H11S DPP 85 6.420 32.180 36.890 1.00 0.00 ATOM 10227 2C21 DPP 85 5.580 33.480 35.420 1.00 0.00 ATOM 10228 H12R DPP 85 4.860 32.680 35.110 1.00 0.00 ATOM 10229 H12S DPP 85 5.830 33.770 34.380 1.00 0.00 ATOM 10230 3C21 DPP 85 4.910 34.600 36.210 1.00 0.00 ATOM 10231 H13R DPP 85 5.560 35.500 36.260 1.00 0.00 ATOM 10232 H13S DPP 85 4.680 34.320 37.260 1.00 0.00 ATOM 10233 4C21 DPP 85 3.610 35.040 35.530 1.00 0.00 ATOM 10234 H14R DPP 85 3.250 34.290 34.790 1.00 0.00 ATOM 10235 H14S DPP 85 2.790 35.270 36.240 1.00 0.00 ATOM 10236 5C21 DPP 85 3.870 36.350 34.780 1.00 0.00 ATOM 10237 H15R DPP 85 4.600 36.140 33.960 1.00 0.00 ATOM 10238 H15S DPP 85 4.340 37.160 35.370 1.00 0.00 ATOM 10239 6C21 DPP 85 2.680 37.030 34.110 1.00 0.00 ATOM 10240 H16R DPP 85 1.990 37.390 34.900 1.00 0.00 ATOM 10241 H16S DPP 85 2.050 36.330 33.530 1.00 0.00 ATOM 10242 H16T DPP 85 2.960 37.860 33.420 1.00 0.00 ATOM 10243 C33 DPP 85 14.500 33.630 29.000 1.00 0.00 ATOM 10244 H3X DPP 85 14.470 32.540 29.200 1.00 0.00 ATOM 10245 H3Y DPP 85 13.540 34.150 28.800 1.00 0.00 ATOM 10246 C34 DPP 85 15.060 34.230 30.290 1.00 0.00 ATOM 10247 H4X DPP 85 15.610 35.170 30.050 1.00 0.00 ATOM 10248 H4Y DPP 85 15.780 33.580 30.820 1.00 0.00 ATOM 10249 C35 DPP 85 14.030 34.720 31.310 1.00 0.00 ATOM 10250 H5X DPP 85 13.310 33.880 31.380 1.00 0.00 ATOM 10251 H5Y DPP 85 13.500 35.630 30.940 1.00 0.00 ATOM 10252 C36 DPP 85 14.630 34.970 32.700 1.00 0.00 ATOM 10253 H6X DPP 85 15.620 35.480 32.690 1.00 0.00 ATOM 10254 H6Y DPP 85 14.670 33.950 33.140 1.00 0.00 ATOM 10255 C37 DPP 85 13.640 35.790 33.520 1.00 0.00 ATOM 10256 H7X DPP 85 12.630 35.360 33.630 1.00 0.00 ATOM 10257 H7Y DPP 85 13.540 36.830 33.130 1.00 0.00 ATOM 10258 C38 DPP 85 14.150 36.030 34.940 1.00 0.00 ATOM 10259 H8X DPP 85 14.390 37.110 34.880 1.00 0.00 ATOM 10260 H8Y DPP 85 14.950 35.350 35.310 1.00 0.00 ATOM 10261 C39 DPP 85 13.060 35.850 35.990 1.00 0.00 ATOM 10262 H9X DPP 85 12.170 36.420 35.650 1.00 0.00 ATOM 10263 H9Y DPP 85 13.420 36.220 36.980 1.00 0.00 ATOM 10264 0C31 DPP 85 12.700 34.370 36.150 1.00 0.00 ATOM 10265 H10X DPP 85 13.580 33.820 36.570 1.00 0.00 ATOM 10266 H10Y DPP 85 12.450 33.970 35.150 1.00 0.00 ATOM 10267 1C31 DPP 85 11.380 34.080 36.870 1.00 0.00 ATOM 10268 H11X DPP 85 11.160 33.000 36.740 1.00 0.00 ATOM 10269 H11Y DPP 85 10.600 34.720 36.410 1.00 0.00 ATOM 10270 2C31 DPP 85 11.470 34.500 38.330 1.00 0.00 ATOM 10271 H12X DPP 85 11.470 35.610 38.320 1.00 0.00 ATOM 10272 H12Y DPP 85 12.350 34.130 38.910 1.00 0.00 ATOM 10273 3C31 DPP 85 10.310 34.060 39.230 1.00 0.00 ATOM 10274 H13X DPP 85 9.410 34.660 38.990 1.00 0.00 ATOM 10275 H13Y DPP 85 10.570 34.450 40.230 1.00 0.00 ATOM 10276 4C31 DPP 85 9.870 32.590 39.290 1.00 0.00 ATOM 10277 H14X DPP 85 10.580 31.910 39.810 1.00 0.00 ATOM 10278 H14Y DPP 85 9.670 32.240 38.260 1.00 0.00 ATOM 10279 5C31 DPP 85 8.470 32.430 39.890 1.00 0.00 ATOM 10280 H15X DPP 85 7.740 33.110 39.410 1.00 0.00 ATOM 10281 H15Y DPP 85 8.430 32.780 40.940 1.00 0.00 ATOM 10282 6C31 DPP 85 7.800 31.060 39.890 1.00 0.00 ATOM 10283 H16X DPP 85 7.780 30.740 38.820 1.00 0.00 ATOM 10284 H16Y DPP 85 6.780 31.260 40.290 1.00 0.00 ATOM 10285 H16Z DPP 85 8.340 30.430 40.620 1.00 0.00 ATOM 10286 N DPP 86 20.270 9.080 21.700 1.00 0.00 ATOM 10287 HN1 DPP 86 19.430 9.450 21.200 1.00 0.00 ATOM 10288 HN2 DPP 86 20.550 9.970 22.170 1.00 0.00 ATOM 10289 HN3 DPP 86 19.950 8.520 22.510 1.00 0.00 ATOM 10290 C12 DPP 86 21.210 8.510 20.670 1.00 0.00 ATOM 10291 H12A DPP 86 21.430 9.360 19.990 1.00 0.00 ATOM 10292 H12B DPP 86 20.660 7.710 20.130 1.00 0.00 ATOM 10293 C11 DPP 86 22.500 8.030 21.340 1.00 0.00 ATOM 10294 H11A DPP 86 23.210 7.630 20.580 1.00 0.00 ATOM 10295 H11B DPP 86 22.140 7.170 21.940 1.00 0.00 ATOM 10296 P DPP 86 24.230 8.540 23.010 1.00 0.00 ATOM 10297 O13 DPP 86 25.320 9.480 22.660 1.00 0.00 ATOM 10298 O14 DPP 86 24.470 7.100 22.780 1.00 0.00 ATOM 10299 O11 DPP 86 23.900 8.820 24.550 1.00 0.00 ATOM 10300 O12 DPP 86 23.010 9.100 22.150 1.00 0.00 ATOM 10301 C1 DPP 86 22.680 8.270 25.040 1.00 0.00 ATOM 10302 HA DPP 86 22.630 7.180 24.830 1.00 0.00 ATOM 10303 HB DPP 86 21.740 8.790 24.750 1.00 0.00 ATOM 10304 C2 DPP 86 22.570 8.220 26.580 1.00 0.00 ATOM 10305 HS DPP 86 22.550 9.260 26.960 1.00 0.00 ATOM 10306 O21 DPP 86 23.660 7.410 27.040 1.00 0.00 ATOM 10307 C21 DPP 86 24.700 8.130 27.430 1.00 0.00 ATOM 10308 O22 DPP 86 24.740 9.350 27.430 1.00 0.00 ATOM 10309 C22 DPP 86 25.890 7.290 27.870 1.00 0.00 ATOM 10310 H2R DPP 86 26.370 6.870 26.960 1.00 0.00 ATOM 10311 H2S DPP 86 25.490 6.520 28.570 1.00 0.00 ATOM 10312 C3 DPP 86 21.200 7.640 26.950 1.00 0.00 ATOM 10313 HX DPP 86 21.190 6.540 27.050 1.00 0.00 ATOM 10314 HY DPP 86 20.450 8.030 26.220 1.00 0.00 ATOM 10315 O31 DPP 86 20.860 8.200 28.220 1.00 0.00 ATOM 10316 C31 DPP 86 19.710 7.690 28.670 1.00 0.00 ATOM 10317 O32 DPP 86 18.830 7.130 28.030 1.00 0.00 ATOM 10318 C32 DPP 86 19.610 7.970 30.160 1.00 0.00 ATOM 10319 H2X DPP 86 18.760 7.430 30.630 1.00 0.00 ATOM 10320 H2Y DPP 86 19.440 9.060 30.350 1.00 0.00 ATOM 10321 C23 DPP 86 27.010 8.180 28.410 1.00 0.00 ATOM 10322 H3R DPP 86 26.600 8.530 29.380 1.00 0.00 ATOM 10323 H3S DPP 86 27.360 9.010 27.760 1.00 0.00 ATOM 10324 C24 DPP 86 28.230 7.330 28.750 1.00 0.00 ATOM 10325 H4R DPP 86 28.960 7.310 27.910 1.00 0.00 ATOM 10326 H4S DPP 86 27.900 6.320 29.090 1.00 0.00 ATOM 10327 C25 DPP 86 29.110 7.860 29.890 1.00 0.00 ATOM 10328 H5R DPP 86 29.370 8.900 29.600 1.00 0.00 ATOM 10329 H5S DPP 86 30.050 7.290 29.950 1.00 0.00 ATOM 10330 C26 DPP 86 28.450 7.920 31.270 1.00 0.00 ATOM 10331 H6R DPP 86 27.690 8.720 31.150 1.00 0.00 ATOM 10332 H6S DPP 86 29.120 8.420 32.000 1.00 0.00 ATOM 10333 C27 DPP 86 27.880 6.620 31.840 1.00 0.00 ATOM 10334 H7R DPP 86 28.750 6.040 32.200 1.00 0.00 ATOM 10335 H7S DPP 86 27.280 6.100 31.060 1.00 0.00 ATOM 10336 C28 DPP 86 27.090 6.990 33.090 1.00 0.00 ATOM 10337 H8R DPP 86 26.180 7.610 32.960 1.00 0.00 ATOM 10338 H8S DPP 86 27.750 7.510 33.820 1.00 0.00 ATOM 10339 C29 DPP 86 26.520 5.690 33.670 1.00 0.00 ATOM 10340 H9R DPP 86 27.400 5.050 33.850 1.00 0.00 ATOM 10341 H9S DPP 86 25.870 5.190 32.920 1.00 0.00 ATOM 10342 0C21 DPP 86 25.720 5.920 34.950 1.00 0.00 ATOM 10343 H10R DPP 86 24.920 6.670 34.790 1.00 0.00 ATOM 10344 H10S DPP 86 26.280 6.490 35.730 1.00 0.00 ATOM 10345 1C21 DPP 86 24.980 4.700 35.510 1.00 0.00 ATOM 10346 H11R DPP 86 24.620 4.100 34.650 1.00 0.00 ATOM 10347 H11S DPP 86 25.700 4.040 36.050 1.00 0.00 ATOM 10348 2C21 DPP 86 23.810 5.180 36.370 1.00 0.00 ATOM 10349 H12R DPP 86 23.150 5.620 35.590 1.00 0.00 ATOM 10350 H12S DPP 86 24.150 5.940 37.110 1.00 0.00 ATOM 10351 3C21 DPP 86 23.130 4.030 37.110 1.00 0.00 ATOM 10352 H13R DPP 86 23.860 3.490 37.750 1.00 0.00 ATOM 10353 H13S DPP 86 22.570 3.430 36.360 1.00 0.00 ATOM 10354 4C21 DPP 86 22.110 4.540 38.140 1.00 0.00 ATOM 10355 H14R DPP 86 21.320 5.090 37.590 1.00 0.00 ATOM 10356 H14S DPP 86 22.640 5.280 38.770 1.00 0.00 ATOM 10357 5C21 DPP 86 21.440 3.380 38.880 1.00 0.00 ATOM 10358 H15R DPP 86 22.220 2.670 39.230 1.00 0.00 ATOM 10359 H15S DPP 86 20.730 2.830 38.230 1.00 0.00 ATOM 10360 6C21 DPP 86 20.670 3.860 40.110 1.00 0.00 ATOM 10361 H16R DPP 86 21.260 4.440 40.850 1.00 0.00 ATOM 10362 H16S DPP 86 20.260 2.980 40.650 1.00 0.00 ATOM 10363 H16T DPP 86 19.820 4.460 39.730 1.00 0.00 ATOM 10364 C33 DPP 86 20.860 7.500 30.900 1.00 0.00 ATOM 10365 H3X DPP 86 21.680 8.170 30.560 1.00 0.00 ATOM 10366 H3Y DPP 86 21.120 6.460 30.600 1.00 0.00 ATOM 10367 C34 DPP 86 20.870 7.580 32.430 1.00 0.00 ATOM 10368 H4X DPP 86 21.890 7.300 32.760 1.00 0.00 ATOM 10369 H4Y DPP 86 20.080 6.890 32.800 1.00 0.00 ATOM 10370 C35 DPP 86 20.620 9.010 32.940 1.00 0.00 ATOM 10371 H5X DPP 86 19.560 9.300 32.840 1.00 0.00 ATOM 10372 H5Y DPP 86 21.330 9.730 32.490 1.00 0.00 ATOM 10373 C36 DPP 86 20.950 9.230 34.420 1.00 0.00 ATOM 10374 H6X DPP 86 20.430 8.470 35.050 1.00 0.00 ATOM 10375 H6Y DPP 86 20.640 10.270 34.670 1.00 0.00 ATOM 10376 C37 DPP 86 22.430 9.120 34.790 1.00 0.00 ATOM 10377 H7X DPP 86 23.020 9.760 34.100 1.00 0.00 ATOM 10378 H7Y DPP 86 22.800 8.080 34.720 1.00 0.00 ATOM 10379 C38 DPP 86 22.840 9.350 36.250 1.00 0.00 ATOM 10380 H8X DPP 86 22.810 10.440 36.450 1.00 0.00 ATOM 10381 H8Y DPP 86 23.870 8.950 36.380 1.00 0.00 ATOM 10382 C39 DPP 86 21.980 8.670 37.310 1.00 0.00 ATOM 10383 H9X DPP 86 21.690 7.660 36.930 1.00 0.00 ATOM 10384 H9Y DPP 86 21.020 9.210 37.410 1.00 0.00 ATOM 10385 0C31 DPP 86 22.650 8.520 38.680 1.00 0.00 ATOM 10386 H10X DPP 86 23.410 7.730 38.520 1.00 0.00 ATOM 10387 H10Y DPP 86 21.880 8.190 39.410 1.00 0.00 ATOM 10388 1C31 DPP 86 23.270 9.830 39.180 1.00 0.00 ATOM 10389 H11X DPP 86 22.510 10.630 39.050 1.00 0.00 ATOM 10390 H11Y DPP 86 24.150 10.020 38.540 1.00 0.00 ATOM 10391 2C31 DPP 86 23.890 9.910 40.570 1.00 0.00 ATOM 10392 H12X DPP 86 24.540 9.030 40.800 1.00 0.00 ATOM 10393 H12Y DPP 86 23.090 9.960 41.350 1.00 0.00 ATOM 10394 3C31 DPP 86 24.930 11.000 40.830 1.00 0.00 ATOM 10395 H13X DPP 86 24.550 12.020 40.620 1.00 0.00 ATOM 10396 H13Y DPP 86 25.820 10.740 40.210 1.00 0.00 ATOM 10397 4C31 DPP 86 25.420 11.020 42.280 1.00 0.00 ATOM 10398 H14X DPP 86 26.400 11.500 42.470 1.00 0.00 ATOM 10399 H14Y DPP 86 25.670 9.990 42.620 1.00 0.00 ATOM 10400 5C31 DPP 86 24.500 11.710 43.290 1.00 0.00 ATOM 10401 H15X DPP 86 23.580 11.130 43.500 1.00 0.00 ATOM 10402 H15Y DPP 86 24.290 12.660 42.750 1.00 0.00 ATOM 10403 6C31 DPP 86 25.070 11.960 44.680 1.00 0.00 ATOM 10404 H16X DPP 86 25.020 10.990 45.220 1.00 0.00 ATOM 10405 H16Y DPP 86 24.650 12.740 45.360 1.00 0.00 ATOM 10406 H16Z DPP 86 26.110 12.360 44.620 1.00 0.00 ATOM 10407 N DPP 87 40.960 38.580 22.210 1.00 0.00 ATOM 10408 HN1 DPP 87 40.630 37.860 22.880 1.00 0.00 ATOM 10409 HN2 DPP 87 40.110 39.070 21.850 1.00 0.00 ATOM 10410 HN3 DPP 87 41.410 38.060 21.430 1.00 0.00 ATOM 10411 C12 DPP 87 42.070 39.290 22.950 1.00 0.00 ATOM 10412 H12A DPP 87 42.920 38.570 23.020 1.00 0.00 ATOM 10413 H12B DPP 87 41.710 39.520 23.970 1.00 0.00 ATOM 10414 C11 DPP 87 42.450 40.580 22.220 1.00 0.00 ATOM 10415 H11A DPP 87 42.870 40.390 21.210 1.00 0.00 ATOM 10416 H11B DPP 87 43.340 41.000 22.730 1.00 0.00 ATOM 10417 P DPP 87 41.700 42.900 21.500 1.00 0.00 ATOM 10418 O13 DPP 87 40.490 43.740 21.390 1.00 0.00 ATOM 10419 O14 DPP 87 42.450 42.740 20.230 1.00 0.00 ATOM 10420 O11 DPP 87 42.790 43.430 22.550 1.00 0.00 ATOM 10421 O12 DPP 87 41.340 41.470 22.110 1.00 0.00 ATOM 10422 C1 DPP 87 42.310 44.360 23.530 1.00 0.00 ATOM 10423 HA DPP 87 42.750 44.250 24.540 1.00 0.00 ATOM 10424 HB DPP 87 41.240 44.160 23.740 1.00 0.00 ATOM 10425 C2 DPP 87 42.710 45.830 23.290 1.00 0.00 ATOM 10426 HS DPP 87 42.920 46.020 22.210 1.00 0.00 ATOM 10427 O21 DPP 87 43.950 45.890 24.000 1.00 0.00 ATOM 10428 C21 DPP 87 44.620 47.000 23.660 1.00 0.00 ATOM 10429 O22 DPP 87 44.330 47.760 22.760 1.00 0.00 ATOM 10430 C22 DPP 87 46.000 47.020 24.320 1.00 0.00 ATOM 10431 H2R DPP 87 46.590 47.840 23.860 1.00 0.00 ATOM 10432 H2S DPP 87 46.560 46.090 24.100 1.00 0.00 ATOM 10433 C3 DPP 87 41.740 46.860 23.890 1.00 0.00 ATOM 10434 HX DPP 87 40.720 46.580 23.530 1.00 0.00 ATOM 10435 HY DPP 87 41.980 47.900 23.590 1.00 0.00 ATOM 10436 O31 DPP 87 41.690 46.750 25.310 1.00 0.00 ATOM 10437 C31 DPP 87 40.540 47.270 25.750 1.00 0.00 ATOM 10438 O32 DPP 87 39.700 47.820 25.060 1.00 0.00 ATOM 10439 C32 DPP 87 40.410 47.270 27.270 1.00 0.00 ATOM 10440 H2X DPP 87 40.950 48.180 27.590 1.00 0.00 ATOM 10441 H2Y DPP 87 40.950 46.420 27.740 1.00 0.00 ATOM 10442 C23 DPP 87 45.930 47.230 25.830 1.00 0.00 ATOM 10443 H3R DPP 87 45.540 46.340 26.360 1.00 0.00 ATOM 10444 H3S DPP 87 45.330 48.140 26.020 1.00 0.00 ATOM 10445 C24 DPP 87 47.330 47.640 26.310 1.00 0.00 ATOM 10446 H4R DPP 87 47.510 48.520 25.650 1.00 0.00 ATOM 10447 H4S DPP 87 48.070 46.860 26.030 1.00 0.00 ATOM 10448 C25 DPP 87 47.430 47.990 27.790 1.00 0.00 ATOM 10449 H5R DPP 87 47.090 47.110 28.380 1.00 0.00 ATOM 10450 H5S DPP 87 46.650 48.770 27.910 1.00 0.00 ATOM 10451 C26 DPP 87 48.800 48.480 28.280 1.00 0.00 ATOM 10452 H6R DPP 87 48.690 49.000 29.260 1.00 0.00 ATOM 10453 H6S DPP 87 49.220 49.100 27.460 1.00 0.00 ATOM 10454 C27 DPP 87 49.770 47.390 28.730 1.00 0.00 ATOM 10455 H7R DPP 87 50.360 47.780 29.590 1.00 0.00 ATOM 10456 H7S DPP 87 50.560 47.010 28.050 1.00 0.00 ATOM 10457 C28 DPP 87 49.060 46.190 29.380 1.00 0.00 ATOM 10458 H8R DPP 87 48.470 45.620 28.630 1.00 0.00 ATOM 10459 H8S DPP 87 48.290 46.450 30.130 1.00 0.00 ATOM 10460 C29 DPP 87 50.010 45.390 30.260 1.00 0.00 ATOM 10461 H9R DPP 87 50.970 45.440 29.700 1.00 0.00 ATOM 10462 H9S DPP 87 49.680 44.330 30.330 1.00 0.00 ATOM 10463 0C21 DPP 87 50.260 45.840 31.700 1.00 0.00 ATOM 10464 H10R DPP 87 50.540 46.910 31.640 1.00 0.00 ATOM 10465 H10S DPP 87 51.190 45.340 32.050 1.00 0.00 ATOM 10466 1C21 DPP 87 49.090 45.720 32.670 1.00 0.00 ATOM 10467 H11R DPP 87 48.560 44.770 32.430 1.00 0.00 ATOM 10468 H11S DPP 87 48.500 46.660 32.610 1.00 0.00 ATOM 10469 2C21 DPP 87 49.550 45.460 34.110 1.00 0.00 ATOM 10470 H12R DPP 87 50.110 46.310 34.540 1.00 0.00 ATOM 10471 H12S DPP 87 50.230 44.580 34.130 1.00 0.00 ATOM 10472 3C21 DPP 87 48.370 45.070 35.010 1.00 0.00 ATOM 10473 H13R DPP 87 47.810 44.240 34.540 1.00 0.00 ATOM 10474 H13S DPP 87 47.700 45.940 35.130 1.00 0.00 ATOM 10475 4C21 DPP 87 48.740 44.550 36.400 1.00 0.00 ATOM 10476 H14R DPP 87 49.500 45.250 36.820 1.00 0.00 ATOM 10477 H14S DPP 87 49.240 43.560 36.340 1.00 0.00 ATOM 10478 5C21 DPP 87 47.490 44.340 37.260 1.00 0.00 ATOM 10479 H15R DPP 87 46.870 43.570 36.750 1.00 0.00 ATOM 10480 H15S DPP 87 46.900 45.280 37.350 1.00 0.00 ATOM 10481 6C21 DPP 87 47.750 43.890 38.690 1.00 0.00 ATOM 10482 H16R DPP 87 48.110 42.840 38.690 1.00 0.00 ATOM 10483 H16S DPP 87 46.830 43.980 39.310 1.00 0.00 ATOM 10484 H16T DPP 87 48.430 44.560 39.260 1.00 0.00 ATOM 10485 C33 DPP 87 38.970 47.300 27.790 1.00 0.00 ATOM 10486 H3X DPP 87 38.340 46.480 27.370 1.00 0.00 ATOM 10487 H3Y DPP 87 38.520 48.230 27.390 1.00 0.00 ATOM 10488 C34 DPP 87 38.850 47.350 29.310 1.00 0.00 ATOM 10489 H4X DPP 87 37.800 47.280 29.660 1.00 0.00 ATOM 10490 H4Y DPP 87 39.240 48.310 29.710 1.00 0.00 ATOM 10491 C35 DPP 87 39.620 46.230 30.030 1.00 0.00 ATOM 10492 H5X DPP 87 40.680 46.410 30.310 1.00 0.00 ATOM 10493 H5Y DPP 87 39.700 45.390 29.310 1.00 0.00 ATOM 10494 C36 DPP 87 38.870 45.980 31.340 1.00 0.00 ATOM 10495 H6X DPP 87 39.430 45.250 31.970 1.00 0.00 ATOM 10496 H6Y DPP 87 37.820 45.610 31.230 1.00 0.00 ATOM 10497 C37 DPP 87 38.880 47.150 32.320 1.00 0.00 ATOM 10498 H7X DPP 87 38.120 46.880 33.080 1.00 0.00 ATOM 10499 H7Y DPP 87 38.370 48.100 32.030 1.00 0.00 ATOM 10500 C38 DPP 87 40.140 47.220 33.180 1.00 0.00 ATOM 10501 H8X DPP 87 40.880 47.800 32.580 1.00 0.00 ATOM 10502 H8Y DPP 87 40.460 46.200 33.490 1.00 0.00 ATOM 10503 C39 DPP 87 39.910 48.110 34.390 1.00 0.00 ATOM 10504 H9X DPP 87 39.020 48.730 34.140 1.00 0.00 ATOM 10505 H9Y DPP 87 40.670 48.920 34.480 1.00 0.00 ATOM 10506 0C31 DPP 87 39.740 47.350 35.710 1.00 0.00 ATOM 10507 H10X DPP 87 40.400 46.460 35.600 1.00 0.00 ATOM 10508 H10Y DPP 87 38.710 46.930 35.700 1.00 0.00 ATOM 10509 1C31 DPP 87 39.900 48.080 37.040 1.00 0.00 ATOM 10510 H11X DPP 87 39.020 48.740 37.180 1.00 0.00 ATOM 10511 H11Y DPP 87 40.900 48.570 37.000 1.00 0.00 ATOM 10512 2C31 DPP 87 39.970 47.010 38.140 1.00 0.00 ATOM 10513 H12X DPP 87 40.780 47.190 38.870 1.00 0.00 ATOM 10514 H12Y DPP 87 40.290 46.150 37.510 1.00 0.00 ATOM 10515 3C31 DPP 87 38.580 46.580 38.620 1.00 0.00 ATOM 10516 H13X DPP 87 37.900 46.410 37.750 1.00 0.00 ATOM 10517 H13Y DPP 87 38.090 47.360 39.230 1.00 0.00 ATOM 10518 4C31 DPP 87 38.590 45.310 39.480 1.00 0.00 ATOM 10519 H14X DPP 87 39.620 45.000 39.760 1.00 0.00 ATOM 10520 H14Y DPP 87 38.050 44.500 38.960 1.00 0.00 ATOM 10521 5C31 DPP 87 37.810 45.510 40.780 1.00 0.00 ATOM 10522 H15X DPP 87 37.680 44.510 41.240 1.00 0.00 ATOM 10523 H15Y DPP 87 36.850 45.980 40.500 1.00 0.00 ATOM 10524 6C31 DPP 87 38.620 46.430 41.700 1.00 0.00 ATOM 10525 H16X DPP 87 38.830 47.430 41.270 1.00 0.00 ATOM 10526 H16Y DPP 87 39.550 45.990 42.110 1.00 0.00 ATOM 10527 H16Z DPP 87 37.920 46.500 42.560 1.00 0.00 ATOM 10528 N DPP 88 48.310 55.650 22.290 1.00 0.00 ATOM 10529 HN1 DPP 88 48.630 54.890 21.660 1.00 0.00 ATOM 10530 HN2 DPP 88 47.290 55.540 22.500 1.00 0.00 ATOM 10531 HN3 DPP 88 48.390 56.530 21.740 1.00 0.00 ATOM 10532 C12 DPP 88 49.270 55.610 23.460 1.00 0.00 ATOM 10533 H12A DPP 88 49.320 56.630 23.890 1.00 0.00 ATOM 10534 H12B DPP 88 48.780 54.890 24.140 1.00 0.00 ATOM 10535 C11 DPP 88 50.610 55.030 23.010 1.00 0.00 ATOM 10536 H11A DPP 88 51.320 55.110 23.860 1.00 0.00 ATOM 10537 H11B DPP 88 51.100 55.680 22.250 1.00 0.00 ATOM 10538 P DPP 88 51.790 53.090 21.900 1.00 0.00 ATOM 10539 O13 DPP 88 52.140 53.990 20.780 1.00 0.00 ATOM 10540 O14 DPP 88 51.590 51.660 21.610 1.00 0.00 ATOM 10541 O11 DPP 88 52.860 53.230 23.090 1.00 0.00 ATOM 10542 O12 DPP 88 50.450 53.690 22.550 1.00 0.00 ATOM 10543 C1 DPP 88 53.780 52.200 23.470 1.00 0.00 ATOM 10544 HA DPP 88 54.760 52.650 23.750 1.00 0.00 ATOM 10545 HB DPP 88 54.000 51.540 22.610 1.00 0.00 ATOM 10546 C2 DPP 88 53.260 51.210 24.510 1.00 0.00 ATOM 10547 HS DPP 88 52.340 50.740 24.090 1.00 0.00 ATOM 10548 O21 DPP 88 53.010 51.970 25.700 1.00 0.00 ATOM 10549 C21 DPP 88 52.050 51.450 26.470 1.00 0.00 ATOM 10550 O22 DPP 88 51.330 50.520 26.130 1.00 0.00 ATOM 10551 C22 DPP 88 51.980 52.200 27.790 1.00 0.00 ATOM 10552 H2R DPP 88 51.350 53.110 27.640 1.00 0.00 ATOM 10553 H2S DPP 88 53.030 52.400 28.070 1.00 0.00 ATOM 10554 C3 DPP 88 54.270 50.080 24.780 1.00 0.00 ATOM 10555 HX DPP 88 55.230 50.610 24.970 1.00 0.00 ATOM 10556 HY DPP 88 54.460 49.490 23.860 1.00 0.00 ATOM 10557 O31 DPP 88 53.840 49.190 25.800 1.00 0.00 ATOM 10558 C31 DPP 88 54.540 48.060 25.970 1.00 0.00 ATOM 10559 O32 DPP 88 55.580 47.870 25.360 1.00 0.00 ATOM 10560 C32 DPP 88 53.900 47.140 27.000 1.00 0.00 ATOM 10561 H2X DPP 88 54.650 46.370 27.310 1.00 0.00 ATOM 10562 H2Y DPP 88 52.940 46.690 26.690 1.00 0.00 ATOM 10563 C23 DPP 88 51.440 51.300 28.900 1.00 0.00 ATOM 10564 H3R DPP 88 51.940 50.310 28.950 1.00 0.00 ATOM 10565 H3S DPP 88 50.380 51.060 28.660 1.00 0.00 ATOM 10566 C24 DPP 88 51.590 51.970 30.270 1.00 0.00 ATOM 10567 H4R DPP 88 50.970 52.890 30.360 1.00 0.00 ATOM 10568 H4S DPP 88 52.640 52.310 30.360 1.00 0.00 ATOM 10569 C25 DPP 88 51.160 51.190 31.510 1.00 0.00 ATOM 10570 H5R DPP 88 51.920 50.370 31.560 1.00 0.00 ATOM 10571 H5S DPP 88 50.180 50.740 31.250 1.00 0.00 ATOM 10572 C26 DPP 88 51.170 51.910 32.860 1.00 0.00 ATOM 10573 H6R DPP 88 50.160 52.310 33.090 1.00 0.00 ATOM 10574 H6S DPP 88 51.930 52.720 32.750 1.00 0.00 ATOM 10575 C27 DPP 88 51.610 50.970 33.980 1.00 0.00 ATOM 10576 H7R DPP 88 51.920 51.440 34.930 1.00 0.00 ATOM 10577 H7S DPP 88 52.550 50.540 33.560 1.00 0.00 ATOM 10578 C28 DPP 88 50.560 49.950 34.410 1.00 0.00 ATOM 10579 H8R DPP 88 50.930 49.360 35.280 1.00 0.00 ATOM 10580 H8S DPP 88 50.380 49.220 33.590 1.00 0.00 ATOM 10581 C29 DPP 88 49.170 50.550 34.660 1.00 0.00 ATOM 10582 H9R DPP 88 48.710 50.800 33.680 1.00 0.00 ATOM 10583 H9S DPP 88 49.170 51.460 35.290 1.00 0.00 ATOM 10584 0C21 DPP 88 48.320 49.560 35.460 1.00 0.00 ATOM 10585 H10R DPP 88 48.260 48.690 34.770 1.00 0.00 ATOM 10586 H10S DPP 88 47.300 49.980 35.600 1.00 0.00 ATOM 10587 1C21 DPP 88 48.820 49.060 36.810 1.00 0.00 ATOM 10588 H11R DPP 88 49.330 49.840 37.420 1.00 0.00 ATOM 10589 H11S DPP 88 49.520 48.210 36.640 1.00 0.00 ATOM 10590 2C21 DPP 88 47.710 48.660 37.780 1.00 0.00 ATOM 10591 H12R DPP 88 47.150 47.780 37.410 1.00 0.00 ATOM 10592 H12S DPP 88 46.970 49.500 37.760 1.00 0.00 ATOM 10593 3C21 DPP 88 48.320 48.380 39.150 1.00 0.00 ATOM 10594 H13R DPP 88 48.760 49.340 39.510 1.00 0.00 ATOM 10595 H13S DPP 88 49.140 47.640 39.020 1.00 0.00 ATOM 10596 4C21 DPP 88 47.370 47.790 40.190 1.00 0.00 ATOM 10597 H14R DPP 88 47.250 46.690 40.050 1.00 0.00 ATOM 10598 H14S DPP 88 46.380 48.280 40.080 1.00 0.00 ATOM 10599 5C21 DPP 88 47.690 48.070 41.660 1.00 0.00 ATOM 10600 H15R DPP 88 46.910 47.720 42.370 1.00 0.00 ATOM 10601 H15S DPP 88 47.630 49.170 41.830 1.00 0.00 ATOM 10602 6C21 DPP 88 49.010 47.470 42.140 1.00 0.00 ATOM 10603 H16R DPP 88 49.260 47.760 43.180 1.00 0.00 ATOM 10604 H16S DPP 88 49.840 47.800 41.500 1.00 0.00 ATOM 10605 H16T DPP 88 49.000 46.350 42.110 1.00 0.00 ATOM 10606 C33 DPP 88 53.600 47.990 28.230 1.00 0.00 ATOM 10607 H3X DPP 88 52.600 48.480 28.230 1.00 0.00 ATOM 10608 H3Y DPP 88 54.330 48.810 28.390 1.00 0.00 ATOM 10609 C34 DPP 88 53.650 47.060 29.450 1.00 0.00 ATOM 10610 H4X DPP 88 54.670 46.640 29.510 1.00 0.00 ATOM 10611 H4Y DPP 88 52.820 46.330 29.510 1.00 0.00 ATOM 10612 C35 DPP 88 53.420 47.690 30.820 1.00 0.00 ATOM 10613 H5X DPP 88 52.930 46.910 31.450 1.00 0.00 ATOM 10614 H5Y DPP 88 52.670 48.500 30.710 1.00 0.00 ATOM 10615 C36 DPP 88 54.760 48.130 31.420 1.00 0.00 ATOM 10616 H6X DPP 88 55.110 48.920 30.730 1.00 0.00 ATOM 10617 H6Y DPP 88 55.480 47.280 31.390 1.00 0.00 ATOM 10618 C37 DPP 88 54.630 48.800 32.790 1.00 0.00 ATOM 10619 H7X DPP 88 54.130 48.060 33.450 1.00 0.00 ATOM 10620 H7Y DPP 88 53.910 49.630 32.620 1.00 0.00 ATOM 10621 C38 DPP 88 55.880 49.320 33.500 1.00 0.00 ATOM 10622 H8X DPP 88 56.220 50.110 32.800 1.00 0.00 ATOM 10623 H8Y DPP 88 56.640 48.510 33.550 1.00 0.00 ATOM 10624 C39 DPP 88 55.440 49.800 34.880 1.00 0.00 ATOM 10625 H9X DPP 88 54.500 50.350 34.660 1.00 0.00 ATOM 10626 H9Y DPP 88 56.310 50.300 35.330 1.00 0.00 ATOM 10627 0C31 DPP 88 55.070 48.670 35.850 1.00 0.00 ATOM 10628 H10X DPP 88 55.870 47.900 35.960 1.00 0.00 ATOM 10629 H10Y DPP 88 54.240 48.060 35.430 1.00 0.00 ATOM 10630 1C31 DPP 88 54.620 49.160 37.230 1.00 0.00 ATOM 10631 H11X DPP 88 53.800 49.900 37.100 1.00 0.00 ATOM 10632 H11Y DPP 88 55.570 49.640 37.540 1.00 0.00 ATOM 10633 2C31 DPP 88 54.080 48.070 38.160 1.00 0.00 ATOM 10634 H12X DPP 88 55.000 47.690 38.650 1.00 0.00 ATOM 10635 H12Y DPP 88 53.760 47.270 37.450 1.00 0.00 ATOM 10636 3C31 DPP 88 52.980 48.430 39.160 1.00 0.00 ATOM 10637 H13X DPP 88 52.790 47.510 39.740 1.00 0.00 ATOM 10638 H13Y DPP 88 52.090 48.690 38.540 1.00 0.00 ATOM 10639 4C31 DPP 88 53.270 49.620 40.080 1.00 0.00 ATOM 10640 H14X DPP 88 53.610 50.540 39.550 1.00 0.00 ATOM 10641 H14Y DPP 88 54.140 49.350 40.710 1.00 0.00 ATOM 10642 5C31 DPP 88 52.060 49.890 40.980 1.00 0.00 ATOM 10643 H15X DPP 88 51.930 48.930 41.510 1.00 0.00 ATOM 10644 H15Y DPP 88 51.220 50.070 40.280 1.00 0.00 ATOM 10645 6C31 DPP 88 52.250 51.120 41.870 1.00 0.00 ATOM 10646 H16X DPP 88 51.400 51.200 42.590 1.00 0.00 ATOM 10647 H16Y DPP 88 52.270 52.040 41.250 1.00 0.00 ATOM 10648 H16Z DPP 88 53.200 51.040 42.440 1.00 0.00 ATOM 10649 N DPP 89 56.000 37.270 24.320 1.00 0.00 ATOM 10650 HN1 DPP 89 56.700 37.860 23.830 1.00 0.00 ATOM 10651 HN2 DPP 89 55.160 37.870 24.340 1.00 0.00 ATOM 10652 HN3 DPP 89 56.340 37.240 25.300 1.00 0.00 ATOM 10653 C12 DPP 89 55.750 35.790 24.090 1.00 0.00 ATOM 10654 H12A DPP 89 55.970 35.630 23.010 1.00 0.00 ATOM 10655 H12B DPP 89 56.490 35.330 24.780 1.00 0.00 ATOM 10656 C11 DPP 89 54.290 35.530 24.440 1.00 0.00 ATOM 10657 H11A DPP 89 54.170 35.850 25.490 1.00 0.00 ATOM 10658 H11B DPP 89 54.080 34.440 24.470 1.00 0.00 ATOM 10659 P DPP 89 52.690 35.500 22.430 1.00 0.00 ATOM 10660 O13 DPP 89 53.650 34.440 22.050 1.00 0.00 ATOM 10661 O14 DPP 89 52.340 36.420 21.330 1.00 0.00 ATOM 10662 O11 DPP 89 51.420 34.800 23.100 1.00 0.00 ATOM 10663 O12 DPP 89 53.320 36.270 23.680 1.00 0.00 ATOM 10664 C1 DPP 89 50.440 34.190 22.250 1.00 0.00 ATOM 10665 HA DPP 89 50.080 33.220 22.650 1.00 0.00 ATOM 10666 HB DPP 89 50.920 33.830 21.310 1.00 0.00 ATOM 10667 C2 DPP 89 49.400 35.170 21.700 1.00 0.00 ATOM 10668 HS DPP 89 49.800 35.800 20.880 1.00 0.00 ATOM 10669 O21 DPP 89 49.210 36.070 22.780 1.00 0.00 ATOM 10670 C21 DPP 89 48.420 37.090 22.430 1.00 0.00 ATOM 10671 O22 DPP 89 48.090 37.370 21.290 1.00 0.00 ATOM 10672 C22 DPP 89 48.100 37.930 23.650 1.00 0.00 ATOM 10673 H2R DPP 89 49.050 38.360 24.040 1.00 0.00 ATOM 10674 H2S DPP 89 47.620 37.240 24.380 1.00 0.00 ATOM 10675 C3 DPP 89 48.070 34.450 21.410 1.00 0.00 ATOM 10676 HX DPP 89 48.360 33.790 20.560 1.00 0.00 ATOM 10677 HY DPP 89 47.290 35.120 20.990 1.00 0.00 ATOM 10678 O31 DPP 89 47.600 33.650 22.500 1.00 0.00 ATOM 10679 C31 DPP 89 46.580 34.170 23.190 1.00 0.00 ATOM 10680 O32 DPP 89 46.160 35.290 22.990 1.00 0.00 ATOM 10681 C32 DPP 89 46.160 33.250 24.330 1.00 0.00 ATOM 10682 H2X DPP 89 46.270 32.200 24.000 1.00 0.00 ATOM 10683 H2Y DPP 89 45.100 33.420 24.620 1.00 0.00 ATOM 10684 C23 DPP 89 47.230 39.150 23.360 1.00 0.00 ATOM 10685 H3R DPP 89 46.160 38.840 23.350 1.00 0.00 ATOM 10686 H3S DPP 89 47.540 39.590 22.390 1.00 0.00 ATOM 10687 C24 DPP 89 47.390 40.280 24.390 1.00 0.00 ATOM 10688 H4R DPP 89 48.480 40.510 24.470 1.00 0.00 ATOM 10689 H4S DPP 89 47.140 39.860 25.380 1.00 0.00 ATOM 10690 C25 DPP 89 46.640 41.570 24.050 1.00 0.00 ATOM 10691 H5R DPP 89 45.560 41.300 23.990 1.00 0.00 ATOM 10692 H5S DPP 89 46.860 41.910 23.020 1.00 0.00 ATOM 10693 C26 DPP 89 46.760 42.650 25.120 1.00 0.00 ATOM 10694 H6R DPP 89 46.270 43.510 24.610 1.00 0.00 ATOM 10695 H6S DPP 89 47.840 42.930 25.110 1.00 0.00 ATOM 10696 C27 DPP 89 46.190 42.410 26.520 1.00 0.00 ATOM 10697 H7R DPP 89 46.690 41.580 27.060 1.00 0.00 ATOM 10698 H7S DPP 89 45.110 42.140 26.510 1.00 0.00 ATOM 10699 C28 DPP 89 46.470 43.560 27.490 1.00 0.00 ATOM 10700 H8R DPP 89 46.370 44.520 26.940 1.00 0.00 ATOM 10701 H8S DPP 89 47.550 43.470 27.760 1.00 0.00 ATOM 10702 C29 DPP 89 45.540 43.650 28.690 1.00 0.00 ATOM 10703 H9R DPP 89 45.380 42.620 29.070 1.00 0.00 ATOM 10704 H9S DPP 89 44.620 44.110 28.270 1.00 0.00 ATOM 10705 0C21 DPP 89 45.990 44.610 29.790 1.00 0.00 ATOM 10706 H10R DPP 89 46.340 45.500 29.220 1.00 0.00 ATOM 10707 H10S DPP 89 46.890 44.090 30.180 1.00 0.00 ATOM 10708 1C21 DPP 89 44.990 44.950 30.890 1.00 0.00 ATOM 10709 H11R DPP 89 45.600 45.310 31.750 1.00 0.00 ATOM 10710 H11S DPP 89 44.500 44.000 31.190 1.00 0.00 ATOM 10711 2C21 DPP 89 43.950 46.020 30.530 1.00 0.00 ATOM 10712 H12R DPP 89 43.240 45.960 31.390 1.00 0.00 ATOM 10713 H12S DPP 89 43.410 45.590 29.660 1.00 0.00 ATOM 10714 3C21 DPP 89 44.360 47.410 30.070 1.00 0.00 ATOM 10715 H13R DPP 89 43.410 47.990 30.100 1.00 0.00 ATOM 10716 H13S DPP 89 44.770 47.430 29.040 1.00 0.00 ATOM 10717 4C21 DPP 89 45.330 48.040 31.070 1.00 0.00 ATOM 10718 H14R DPP 89 45.650 49.010 30.620 1.00 0.00 ATOM 10719 H14S DPP 89 46.280 47.490 31.280 1.00 0.00 ATOM 10720 5C21 DPP 89 44.720 48.320 32.440 1.00 0.00 ATOM 10721 H15R DPP 89 44.430 47.360 32.910 1.00 0.00 ATOM 10722 H15S DPP 89 43.770 48.840 32.200 1.00 0.00 ATOM 10723 6C21 DPP 89 45.400 49.270 33.430 1.00 0.00 ATOM 10724 H16R DPP 89 46.210 48.710 33.950 1.00 0.00 ATOM 10725 H16S DPP 89 44.630 49.610 34.150 1.00 0.00 ATOM 10726 H16T DPP 89 45.920 50.100 32.910 1.00 0.00 ATOM 10727 C33 DPP 89 47.040 33.350 25.580 1.00 0.00 ATOM 10728 H3X DPP 89 46.560 34.220 26.070 1.00 0.00 ATOM 10729 H3Y DPP 89 48.090 33.600 25.310 1.00 0.00 ATOM 10730 C34 DPP 89 46.970 32.140 26.520 1.00 0.00 ATOM 10731 H4X DPP 89 47.660 31.380 26.100 1.00 0.00 ATOM 10732 H4Y DPP 89 46.050 31.520 26.430 1.00 0.00 ATOM 10733 C35 DPP 89 47.450 32.560 27.910 1.00 0.00 ATOM 10734 H5X DPP 89 48.120 33.450 27.850 1.00 0.00 ATOM 10735 H5Y DPP 89 48.190 31.840 28.330 1.00 0.00 ATOM 10736 C36 DPP 89 46.340 32.870 28.910 1.00 0.00 ATOM 10737 H6X DPP 89 45.680 33.660 28.500 1.00 0.00 ATOM 10738 H6Y DPP 89 46.770 33.310 29.840 1.00 0.00 ATOM 10739 C37 DPP 89 45.640 31.640 29.490 1.00 0.00 ATOM 10740 H7X DPP 89 46.440 31.030 29.950 1.00 0.00 ATOM 10741 H7Y DPP 89 45.130 31.080 28.670 1.00 0.00 ATOM 10742 C38 DPP 89 44.530 32.000 30.480 1.00 0.00 ATOM 10743 H8X DPP 89 44.970 32.510 31.360 1.00 0.00 ATOM 10744 H8Y DPP 89 44.300 31.020 30.950 1.00 0.00 ATOM 10745 C39 DPP 89 43.370 32.550 29.650 1.00 0.00 ATOM 10746 H9X DPP 89 43.090 31.880 28.810 1.00 0.00 ATOM 10747 H9Y DPP 89 43.660 33.510 29.180 1.00 0.00 ATOM 10748 0C31 DPP 89 42.100 32.800 30.470 1.00 0.00 ATOM 10749 H10X DPP 89 42.420 33.450 31.310 1.00 0.00 ATOM 10750 H10Y DPP 89 41.710 31.830 30.860 1.00 0.00 ATOM 10751 1C31 DPP 89 40.920 33.540 29.820 1.00 0.00 ATOM 10752 H11X DPP 89 41.270 34.580 29.640 1.00 0.00 ATOM 10753 H11Y DPP 89 40.070 33.550 30.530 1.00 0.00 ATOM 10754 2C31 DPP 89 40.670 33.030 28.400 1.00 0.00 ATOM 10755 H12X DPP 89 41.620 32.880 27.840 1.00 0.00 ATOM 10756 H12Y DPP 89 40.060 33.710 27.750 1.00 0.00 ATOM 10757 3C31 DPP 89 39.870 31.730 28.320 1.00 0.00 ATOM 10758 H13X DPP 89 38.900 31.870 28.840 1.00 0.00 ATOM 10759 H13Y DPP 89 40.460 31.030 28.940 1.00 0.00 ATOM 10760 4C31 DPP 89 39.550 31.240 26.900 1.00 0.00 ATOM 10761 H14X DPP 89 39.350 30.160 26.970 1.00 0.00 ATOM 10762 H14Y DPP 89 40.380 31.470 26.190 1.00 0.00 ATOM 10763 5C31 DPP 89 38.280 31.780 26.230 1.00 0.00 ATOM 10764 H15X DPP 89 38.330 32.890 26.190 1.00 0.00 ATOM 10765 H15Y DPP 89 37.400 31.510 26.850 1.00 0.00 ATOM 10766 6C31 DPP 89 38.030 31.170 24.850 1.00 0.00 ATOM 10767 H16X DPP 89 38.790 31.670 24.210 1.00 0.00 ATOM 10768 H16Y DPP 89 37.040 31.520 24.490 1.00 0.00 ATOM 10769 H16Z DPP 89 38.080 30.060 24.740 1.00 0.00 ATOM 10770 N DPP 90 47.680 29.510 19.570 1.00 0.00 ATOM 10771 HN1 DPP 90 48.700 29.390 19.390 1.00 0.00 ATOM 10772 HN2 DPP 90 47.230 28.570 19.620 1.00 0.00 ATOM 10773 HN3 DPP 90 47.260 29.960 18.740 1.00 0.00 ATOM 10774 C12 DPP 90 47.610 30.400 20.790 1.00 0.00 ATOM 10775 H12A DPP 90 48.330 31.210 20.580 1.00 0.00 ATOM 10776 H12B DPP 90 46.550 30.710 20.960 1.00 0.00 ATOM 10777 C11 DPP 90 47.950 29.710 22.110 1.00 0.00 ATOM 10778 H11A DPP 90 47.790 30.470 22.900 1.00 0.00 ATOM 10779 H11B DPP 90 48.980 29.310 22.030 1.00 0.00 ATOM 10780 P DPP 90 45.720 29.050 23.140 1.00 0.00 ATOM 10781 O13 DPP 90 44.880 27.830 23.210 1.00 0.00 ATOM 10782 O14 DPP 90 45.020 30.210 22.520 1.00 0.00 ATOM 10783 O11 DPP 90 46.380 29.440 24.540 1.00 0.00 ATOM 10784 O12 DPP 90 47.010 28.650 22.290 1.00 0.00 ATOM 10785 C1 DPP 90 47.090 28.410 25.230 1.00 0.00 ATOM 10786 HA DPP 90 47.740 28.880 26.010 1.00 0.00 ATOM 10787 HB DPP 90 47.780 27.820 24.580 1.00 0.00 ATOM 10788 C2 DPP 90 46.100 27.440 25.900 1.00 0.00 ATOM 10789 HS DPP 90 45.790 26.870 24.990 1.00 0.00 ATOM 10790 O21 DPP 90 45.090 28.190 26.580 1.00 0.00 ATOM 10791 C21 DPP 90 43.980 27.480 26.780 1.00 0.00 ATOM 10792 O22 DPP 90 43.730 26.340 26.420 1.00 0.00 ATOM 10793 C22 DPP 90 43.060 28.330 27.640 1.00 0.00 ATOM 10794 H2R DPP 90 42.390 28.790 26.880 1.00 0.00 ATOM 10795 H2S DPP 90 43.670 28.970 28.310 1.00 0.00 ATOM 10796 C3 DPP 90 46.820 26.480 26.850 1.00 0.00 ATOM 10797 HX DPP 90 47.780 26.170 26.380 1.00 0.00 ATOM 10798 HY DPP 90 46.150 25.610 26.970 1.00 0.00 ATOM 10799 O31 DPP 90 47.140 27.110 28.100 1.00 0.00 ATOM 10800 C31 DPP 90 47.830 26.340 28.940 1.00 0.00 ATOM 10801 O32 DPP 90 47.890 25.130 28.820 1.00 0.00 ATOM 10802 C32 DPP 90 48.200 27.190 30.150 1.00 0.00 ATOM 10803 H2X DPP 90 47.880 28.220 29.870 1.00 0.00 ATOM 10804 H2Y DPP 90 49.310 27.250 30.220 1.00 0.00 ATOM 10805 C23 DPP 90 42.240 27.490 28.610 1.00 0.00 ATOM 10806 H3R DPP 90 42.810 26.960 29.410 1.00 0.00 ATOM 10807 H3S DPP 90 41.660 26.700 28.080 1.00 0.00 ATOM 10808 C24 DPP 90 41.210 28.360 29.330 1.00 0.00 ATOM 10809 H4R DPP 90 40.600 28.950 28.600 1.00 0.00 ATOM 10810 H4S DPP 90 41.920 29.080 29.780 1.00 0.00 ATOM 10811 C25 DPP 90 40.140 27.750 30.240 1.00 0.00 ATOM 10812 H5R DPP 90 40.590 27.090 31.010 1.00 0.00 ATOM 10813 H5S DPP 90 39.460 27.050 29.700 1.00 0.00 ATOM 10814 C26 DPP 90 39.380 28.830 31.020 1.00 0.00 ATOM 10815 H6R DPP 90 38.360 28.980 30.590 1.00 0.00 ATOM 10816 H6S DPP 90 39.910 29.800 30.920 1.00 0.00 ATOM 10817 C27 DPP 90 39.040 28.500 32.480 1.00 0.00 ATOM 10818 H7R DPP 90 38.660 27.460 32.470 1.00 0.00 ATOM 10819 H7S DPP 90 38.300 29.220 32.890 1.00 0.00 ATOM 10820 C28 DPP 90 40.160 28.610 33.510 1.00 0.00 ATOM 10821 H8R DPP 90 40.940 27.830 33.410 1.00 0.00 ATOM 10822 H8S DPP 90 39.690 28.490 34.510 1.00 0.00 ATOM 10823 C29 DPP 90 40.730 30.030 33.560 1.00 0.00 ATOM 10824 H9R DPP 90 39.860 30.720 33.670 1.00 0.00 ATOM 10825 H9S DPP 90 41.200 30.290 32.590 1.00 0.00 ATOM 10826 0C21 DPP 90 41.710 30.160 34.730 1.00 0.00 ATOM 10827 H10R DPP 90 42.370 29.270 34.740 1.00 0.00 ATOM 10828 H10S DPP 90 41.160 30.140 35.700 1.00 0.00 ATOM 10829 1C21 DPP 90 42.490 31.480 34.670 1.00 0.00 ATOM 10830 H11R DPP 90 41.810 32.350 34.580 1.00 0.00 ATOM 10831 H11S DPP 90 43.050 31.420 33.710 1.00 0.00 ATOM 10832 2C21 DPP 90 43.380 31.700 35.890 1.00 0.00 ATOM 10833 H12R DPP 90 44.000 30.780 35.820 1.00 0.00 ATOM 10834 H12S DPP 90 42.700 31.720 36.770 1.00 0.00 ATOM 10835 3C21 DPP 90 44.250 32.950 35.790 1.00 0.00 ATOM 10836 H13R DPP 90 43.580 33.790 35.520 1.00 0.00 ATOM 10837 H13S DPP 90 45.020 32.780 35.010 1.00 0.00 ATOM 10838 4C21 DPP 90 44.920 33.120 37.160 1.00 0.00 ATOM 10839 H14R DPP 90 45.430 32.170 37.430 1.00 0.00 ATOM 10840 H14S DPP 90 44.060 33.320 37.830 1.00 0.00 ATOM 10841 5C21 DPP 90 45.920 34.270 36.970 1.00 0.00 ATOM 10842 H15R DPP 90 45.370 35.230 36.880 1.00 0.00 ATOM 10843 H15S DPP 90 46.570 34.070 36.090 1.00 0.00 ATOM 10844 6C21 DPP 90 46.790 34.530 38.190 1.00 0.00 ATOM 10845 H16R DPP 90 47.630 35.240 38.000 1.00 0.00 ATOM 10846 H16S DPP 90 47.370 33.620 38.470 1.00 0.00 ATOM 10847 H16T DPP 90 46.130 34.880 39.010 1.00 0.00 ATOM 10848 C33 DPP 90 47.660 26.490 31.400 1.00 0.00 ATOM 10849 H3X DPP 90 48.360 26.830 32.190 1.00 0.00 ATOM 10850 H3Y DPP 90 47.730 25.390 31.310 1.00 0.00 ATOM 10851 C34 DPP 90 46.190 26.760 31.710 1.00 0.00 ATOM 10852 H4X DPP 90 45.910 26.160 32.600 1.00 0.00 ATOM 10853 H4Y DPP 90 45.520 26.350 30.930 1.00 0.00 ATOM 10854 C35 DPP 90 45.800 28.240 31.870 1.00 0.00 ATOM 10855 H5X DPP 90 44.760 28.310 32.250 1.00 0.00 ATOM 10856 H5Y DPP 90 45.850 28.750 30.890 1.00 0.00 ATOM 10857 C36 DPP 90 46.570 29.110 32.860 1.00 0.00 ATOM 10858 H6X DPP 90 46.390 30.200 32.750 1.00 0.00 ATOM 10859 H6Y DPP 90 47.680 29.130 32.750 1.00 0.00 ATOM 10860 C37 DPP 90 46.350 28.680 34.310 1.00 0.00 ATOM 10861 H7X DPP 90 46.670 27.630 34.430 1.00 0.00 ATOM 10862 H7Y DPP 90 45.250 28.770 34.470 1.00 0.00 ATOM 10863 C38 DPP 90 47.090 29.420 35.440 1.00 0.00 ATOM 10864 H8X DPP 90 47.110 30.460 35.050 1.00 0.00 ATOM 10865 H8Y DPP 90 48.050 28.880 35.530 1.00 0.00 ATOM 10866 C39 DPP 90 46.380 29.340 36.790 1.00 0.00 ATOM 10867 H9X DPP 90 46.050 28.290 36.950 1.00 0.00 ATOM 10868 H9Y DPP 90 45.510 30.030 36.880 1.00 0.00 ATOM 10869 0C31 DPP 90 47.320 29.980 37.820 1.00 0.00 ATOM 10870 H10X DPP 90 47.600 31.020 37.590 1.00 0.00 ATOM 10871 H10Y DPP 90 48.210 29.320 37.900 1.00 0.00 ATOM 10872 1C31 DPP 90 46.590 30.130 39.160 1.00 0.00 ATOM 10873 H11X DPP 90 46.090 29.170 39.410 1.00 0.00 ATOM 10874 H11Y DPP 90 45.880 30.980 39.060 1.00 0.00 ATOM 10875 2C31 DPP 90 47.620 30.420 40.250 1.00 0.00 ATOM 10876 H12X DPP 90 48.510 29.770 40.110 1.00 0.00 ATOM 10877 H12Y DPP 90 47.160 30.200 41.240 1.00 0.00 ATOM 10878 3C31 DPP 90 48.010 31.900 40.260 1.00 0.00 ATOM 10879 H13X DPP 90 47.060 32.450 40.100 1.00 0.00 ATOM 10880 H13Y DPP 90 48.700 32.080 39.410 1.00 0.00 ATOM 10881 4C31 DPP 90 48.630 32.360 41.590 1.00 0.00 ATOM 10882 H14X DPP 90 49.500 31.730 41.840 1.00 0.00 ATOM 10883 H14Y DPP 90 47.960 32.270 42.480 1.00 0.00 ATOM 10884 5C31 DPP 90 49.120 33.810 41.600 1.00 0.00 ATOM 10885 H15X DPP 90 48.250 34.440 41.870 1.00 0.00 ATOM 10886 H15Y DPP 90 49.480 34.090 40.590 1.00 0.00 ATOM 10887 6C31 DPP 90 50.230 34.060 42.630 1.00 0.00 ATOM 10888 H16X DPP 90 50.660 35.080 42.490 1.00 0.00 ATOM 10889 H16Y DPP 90 50.910 33.190 42.590 1.00 0.00 ATOM 10890 H16Z DPP 90 49.830 33.950 43.660 1.00 0.00 ATOM 10891 N DPP 91 13.460 60.640 22.570 1.00 0.00 ATOM 10892 HN1 DPP 91 13.420 59.870 23.260 1.00 0.00 ATOM 10893 HN2 DPP 91 14.270 60.550 21.930 1.00 0.00 ATOM 10894 HN3 DPP 91 13.720 61.440 23.180 1.00 0.00 ATOM 10895 C12 DPP 91 12.210 60.840 21.740 1.00 0.00 ATOM 10896 H12A DPP 91 12.030 59.980 21.070 1.00 0.00 ATOM 10897 H12B DPP 91 12.340 61.850 21.290 1.00 0.00 ATOM 10898 C11 DPP 91 11.010 60.860 22.700 1.00 0.00 ATOM 10899 H11A DPP 91 10.800 59.850 23.110 1.00 0.00 ATOM 10900 H11B DPP 91 10.110 61.210 22.150 1.00 0.00 ATOM 10901 P DPP 91 10.100 61.850 24.870 1.00 0.00 ATOM 10902 O13 DPP 91 8.780 61.660 24.240 1.00 0.00 ATOM 10903 O14 DPP 91 10.280 63.100 25.640 1.00 0.00 ATOM 10904 O11 DPP 91 10.500 60.670 25.870 1.00 0.00 ATOM 10905 O12 DPP 91 11.270 61.760 23.780 1.00 0.00 ATOM 10906 C1 DPP 91 9.880 60.630 27.150 1.00 0.00 ATOM 10907 HA DPP 91 8.900 60.120 27.110 1.00 0.00 ATOM 10908 HB DPP 91 9.660 61.610 27.630 1.00 0.00 ATOM 10909 C2 DPP 91 10.580 59.820 28.270 1.00 0.00 ATOM 10910 HS DPP 91 9.990 59.810 29.210 1.00 0.00 ATOM 10911 O21 DPP 91 11.870 60.370 28.520 1.00 0.00 ATOM 10912 C21 DPP 91 12.320 60.130 29.750 1.00 0.00 ATOM 10913 O22 DPP 91 11.640 59.690 30.670 1.00 0.00 ATOM 10914 C22 DPP 91 13.830 60.240 29.860 1.00 0.00 ATOM 10915 H2R DPP 91 14.270 60.180 28.840 1.00 0.00 ATOM 10916 H2S DPP 91 14.230 59.360 30.400 1.00 0.00 ATOM 10917 C3 DPP 91 10.690 58.370 27.780 1.00 0.00 ATOM 10918 HX DPP 91 11.410 58.480 26.940 1.00 0.00 ATOM 10919 HY DPP 91 9.710 57.970 27.470 1.00 0.00 ATOM 10920 O31 DPP 91 11.250 57.540 28.800 1.00 0.00 ATOM 10921 C31 DPP 91 10.430 56.810 29.560 1.00 0.00 ATOM 10922 O32 DPP 91 9.210 56.770 29.470 1.00 0.00 ATOM 10923 C32 DPP 91 11.160 56.010 30.620 1.00 0.00 ATOM 10924 H2X DPP 91 12.140 56.530 30.770 1.00 0.00 ATOM 10925 H2Y DPP 91 11.320 55.000 30.180 1.00 0.00 ATOM 10926 C23 DPP 91 14.230 61.510 30.610 1.00 0.00 ATOM 10927 H3R DPP 91 13.800 61.510 31.630 1.00 0.00 ATOM 10928 H3S DPP 91 13.780 62.460 30.240 1.00 0.00 ATOM 10929 C24 DPP 91 15.730 61.810 30.710 1.00 0.00 ATOM 10930 H4R DPP 91 15.900 62.830 31.110 1.00 0.00 ATOM 10931 H4S DPP 91 16.190 61.730 29.700 1.00 0.00 ATOM 10932 C25 DPP 91 16.450 60.840 31.640 1.00 0.00 ATOM 10933 H5R DPP 91 17.490 60.920 31.250 1.00 0.00 ATOM 10934 H5S DPP 91 16.070 59.800 31.530 1.00 0.00 ATOM 10935 C26 DPP 91 16.350 61.220 33.120 1.00 0.00 ATOM 10936 H6R DPP 91 15.370 60.810 33.430 1.00 0.00 ATOM 10937 H6S DPP 91 16.510 62.320 33.180 1.00 0.00 ATOM 10938 C27 DPP 91 17.470 60.600 33.940 1.00 0.00 ATOM 10939 H7R DPP 91 18.510 60.590 33.530 1.00 0.00 ATOM 10940 H7S DPP 91 17.220 59.520 33.910 1.00 0.00 ATOM 10941 C28 DPP 91 17.460 61.030 35.400 1.00 0.00 ATOM 10942 H8R DPP 91 17.490 62.140 35.370 1.00 0.00 ATOM 10943 H8S DPP 91 18.430 60.710 35.850 1.00 0.00 ATOM 10944 C29 DPP 91 16.320 60.550 36.300 1.00 0.00 ATOM 10945 H9R DPP 91 16.270 59.440 36.210 1.00 0.00 ATOM 10946 H9S DPP 91 15.380 60.980 35.900 1.00 0.00 ATOM 10947 0C21 DPP 91 16.480 60.950 37.770 1.00 0.00 ATOM 10948 H10R DPP 91 17.170 60.160 38.140 1.00 0.00 ATOM 10949 H10S DPP 91 15.550 60.960 38.380 1.00 0.00 ATOM 10950 1C21 DPP 91 17.000 62.370 38.000 1.00 0.00 ATOM 10951 H11R DPP 91 16.720 63.120 37.230 1.00 0.00 ATOM 10952 H11S DPP 91 18.090 62.230 37.850 1.00 0.00 ATOM 10953 2C21 DPP 91 16.670 62.960 39.380 1.00 0.00 ATOM 10954 H12R DPP 91 15.610 63.310 39.330 1.00 0.00 ATOM 10955 H12S DPP 91 17.430 63.750 39.510 1.00 0.00 ATOM 10956 3C21 DPP 91 16.690 61.980 40.550 1.00 0.00 ATOM 10957 H13R DPP 91 17.620 61.370 40.450 1.00 0.00 ATOM 10958 H13S DPP 91 15.810 61.290 40.590 1.00 0.00 ATOM 10959 4C21 DPP 91 16.740 62.610 41.940 1.00 0.00 ATOM 10960 H14R DPP 91 16.100 63.520 41.930 1.00 0.00 ATOM 10961 H14S DPP 91 17.780 62.910 42.180 1.00 0.00 ATOM 10962 5C21 DPP 91 16.350 61.680 43.080 1.00 0.00 ATOM 10963 H15R DPP 91 16.950 60.760 42.910 1.00 0.00 ATOM 10964 H15S DPP 91 15.320 61.290 42.920 1.00 0.00 ATOM 10965 6C21 DPP 91 16.590 62.180 44.500 1.00 0.00 ATOM 10966 H16R DPP 91 16.010 61.550 45.220 1.00 0.00 ATOM 10967 H16S DPP 91 16.290 63.250 44.590 1.00 0.00 ATOM 10968 H16T DPP 91 17.650 62.170 44.840 1.00 0.00 ATOM 10969 C33 DPP 91 10.510 55.990 32.000 1.00 0.00 ATOM 10970 H3X DPP 91 9.520 55.480 31.910 1.00 0.00 ATOM 10971 H3Y DPP 91 10.430 57.050 32.340 1.00 0.00 ATOM 10972 C34 DPP 91 11.370 55.320 33.080 1.00 0.00 ATOM 10973 H4X DPP 91 12.310 55.900 33.140 1.00 0.00 ATOM 10974 H4Y DPP 91 11.750 54.330 32.740 1.00 0.00 ATOM 10975 C35 DPP 91 10.630 55.150 34.410 1.00 0.00 ATOM 10976 H5X DPP 91 11.340 54.670 35.110 1.00 0.00 ATOM 10977 H5Y DPP 91 9.720 54.530 34.290 1.00 0.00 ATOM 10978 C36 DPP 91 10.230 56.470 35.070 1.00 0.00 ATOM 10979 H6X DPP 91 9.510 57.060 34.470 1.00 0.00 ATOM 10980 H6Y DPP 91 11.170 57.080 35.060 1.00 0.00 ATOM 10981 C37 DPP 91 9.660 56.370 36.480 1.00 0.00 ATOM 10982 H7X DPP 91 10.490 56.450 37.220 1.00 0.00 ATOM 10983 H7Y DPP 91 9.200 55.380 36.720 1.00 0.00 ATOM 10984 C38 DPP 91 8.620 57.430 36.830 1.00 0.00 ATOM 10985 H8X DPP 91 8.030 57.460 35.890 1.00 0.00 ATOM 10986 H8Y DPP 91 9.150 58.380 37.080 1.00 0.00 ATOM 10987 C39 DPP 91 7.570 57.140 37.910 1.00 0.00 ATOM 10988 H9X DPP 91 7.190 56.100 37.870 1.00 0.00 ATOM 10989 H9Y DPP 91 6.650 57.740 37.720 1.00 0.00 ATOM 10990 0C31 DPP 91 8.110 57.540 39.280 1.00 0.00 ATOM 10991 H10X DPP 91 8.370 58.620 39.280 1.00 0.00 ATOM 10992 H10Y DPP 91 9.090 57.090 39.550 1.00 0.00 ATOM 10993 1C31 DPP 91 7.050 57.240 40.340 1.00 0.00 ATOM 10994 H11X DPP 91 7.500 57.260 41.360 1.00 0.00 ATOM 10995 H11Y DPP 91 6.840 56.150 40.260 1.00 0.00 ATOM 10996 2C31 DPP 91 5.820 58.150 40.260 1.00 0.00 ATOM 10997 H12X DPP 91 5.150 57.890 39.420 1.00 0.00 ATOM 10998 H12Y DPP 91 6.070 59.210 40.060 1.00 0.00 ATOM 10999 3C31 DPP 91 4.990 58.060 41.550 1.00 0.00 ATOM 11000 H13X DPP 91 5.630 58.460 42.370 1.00 0.00 ATOM 11001 H13Y DPP 91 4.870 57.000 41.860 1.00 0.00 ATOM 11002 4C31 DPP 91 3.610 58.720 41.500 1.00 0.00 ATOM 11003 H14X DPP 91 3.910 59.680 41.020 1.00 0.00 ATOM 11004 H14Y DPP 91 3.370 58.940 42.560 1.00 0.00 ATOM 11005 5C31 DPP 91 2.410 58.030 40.840 1.00 0.00 ATOM 11006 H15X DPP 91 1.550 58.540 41.320 1.00 0.00 ATOM 11007 H15Y DPP 91 2.370 57.000 41.230 1.00 0.00 ATOM 11008 6C31 DPP 91 2.350 58.060 39.320 1.00 0.00 ATOM 11009 H16X DPP 91 3.060 57.350 38.860 1.00 0.00 ATOM 11010 H16Y DPP 91 2.560 59.030 38.810 1.00 0.00 ATOM 11011 H16Z DPP 91 1.410 57.530 39.040 1.00 0.00 ATOM 11012 N DPP 92 1.430 23.010 23.290 1.00 0.00 ATOM 11013 HN1 DPP 92 2.090 22.250 23.020 1.00 0.00 ATOM 11014 HN2 DPP 92 0.770 22.540 23.940 1.00 0.00 ATOM 11015 HN3 DPP 92 1.030 23.390 22.410 1.00 0.00 ATOM 11016 C12 DPP 92 2.230 24.070 24.010 1.00 0.00 ATOM 11017 H12A DPP 92 2.660 23.510 24.870 1.00 0.00 ATOM 11018 H12B DPP 92 2.980 24.450 23.290 1.00 0.00 ATOM 11019 C11 DPP 92 1.320 25.200 24.500 1.00 0.00 ATOM 11020 H11A DPP 92 1.980 25.970 24.970 1.00 0.00 ATOM 11021 H11B DPP 92 0.670 24.750 25.280 1.00 0.00 ATOM 11022 P DPP 92 -0.360 26.960 24.010 1.00 0.00 ATOM 11023 O13 DPP 92 -1.610 27.050 23.230 1.00 0.00 ATOM 11024 O14 DPP 92 0.470 28.180 23.960 1.00 0.00 ATOM 11025 O11 DPP 92 -0.820 26.690 25.520 1.00 0.00 ATOM 11026 O12 DPP 92 0.520 25.740 23.450 1.00 0.00 ATOM 11027 C1 DPP 92 -1.560 27.660 26.270 1.00 0.00 ATOM 11028 HA DPP 92 -2.190 27.100 27.000 1.00 0.00 ATOM 11029 HB DPP 92 -2.230 28.250 25.610 1.00 0.00 ATOM 11030 C2 DPP 92 -0.520 28.460 27.070 1.00 0.00 ATOM 11031 HS DPP 92 0.090 28.930 26.280 1.00 0.00 ATOM 11032 O21 DPP 92 0.240 27.470 27.760 1.00 0.00 ATOM 11033 C21 DPP 92 1.560 27.610 27.640 1.00 0.00 ATOM 11034 O22 DPP 92 2.150 28.410 26.940 1.00 0.00 ATOM 11035 C22 DPP 92 2.430 26.710 28.520 1.00 0.00 ATOM 11036 H2R DPP 92 3.350 26.500 27.950 1.00 0.00 ATOM 11037 H2S DPP 92 2.040 25.720 28.820 1.00 0.00 ATOM 11038 C3 DPP 92 -1.190 29.430 28.060 1.00 0.00 ATOM 11039 HX DPP 92 -1.990 30.030 27.580 1.00 0.00 ATOM 11040 HY DPP 92 -0.360 30.010 28.510 1.00 0.00 ATOM 11041 O31 DPP 92 -1.880 28.670 29.050 1.00 0.00 ATOM 11042 C31 DPP 92 -1.360 28.700 30.290 1.00 0.00 ATOM 11043 O32 DPP 92 -0.350 29.310 30.580 1.00 0.00 ATOM 11044 C32 DPP 92 -2.410 28.270 31.300 1.00 0.00 ATOM 11045 H2X DPP 92 -2.440 27.190 31.550 1.00 0.00 ATOM 11046 H2Y DPP 92 -3.450 28.480 30.940 1.00 0.00 ATOM 11047 C23 DPP 92 2.770 27.610 29.720 1.00 0.00 ATOM 11048 H3R DPP 92 2.770 28.670 29.400 1.00 0.00 ATOM 11049 H3S DPP 92 3.820 27.310 29.950 1.00 0.00 ATOM 11050 C24 DPP 92 2.100 27.270 31.050 1.00 0.00 ATOM 11051 H4R DPP 92 2.100 26.160 31.040 1.00 0.00 ATOM 11052 H4S DPP 92 1.060 27.670 31.060 1.00 0.00 ATOM 11053 C25 DPP 92 2.940 27.550 32.290 1.00 0.00 ATOM 11054 H5R DPP 92 3.250 28.610 32.170 1.00 0.00 ATOM 11055 H5S DPP 92 3.870 26.950 32.220 1.00 0.00 ATOM 11056 C26 DPP 92 2.400 27.290 33.700 1.00 0.00 ATOM 11057 H6R DPP 92 2.040 26.260 33.880 1.00 0.00 ATOM 11058 H6S DPP 92 1.450 27.860 33.780 1.00 0.00 ATOM 11059 C27 DPP 92 3.280 27.590 34.920 1.00 0.00 ATOM 11060 H7R DPP 92 4.060 26.800 35.060 1.00 0.00 ATOM 11061 H7S DPP 92 2.550 27.670 35.740 1.00 0.00 ATOM 11062 C28 DPP 92 3.970 28.950 34.840 1.00 0.00 ATOM 11063 H8R DPP 92 4.640 29.150 33.980 1.00 0.00 ATOM 11064 H8S DPP 92 4.580 29.170 35.740 1.00 0.00 ATOM 11065 C29 DPP 92 2.970 30.100 34.730 1.00 0.00 ATOM 11066 H9R DPP 92 2.380 29.780 33.840 1.00 0.00 ATOM 11067 H9S DPP 92 3.570 31.000 34.510 1.00 0.00 ATOM 11068 0C21 DPP 92 2.140 30.500 35.950 1.00 0.00 ATOM 11069 H10R DPP 92 2.070 29.560 36.540 1.00 0.00 ATOM 11070 H10S DPP 92 1.210 30.980 35.580 1.00 0.00 ATOM 11071 1C21 DPP 92 2.720 31.560 36.890 1.00 0.00 ATOM 11072 H11R DPP 92 2.900 32.560 36.440 1.00 0.00 ATOM 11073 H11S DPP 92 3.660 31.080 37.230 1.00 0.00 ATOM 11074 2C21 DPP 92 1.800 31.890 38.080 1.00 0.00 ATOM 11075 H12R DPP 92 1.810 30.960 38.680 1.00 0.00 ATOM 11076 H12S DPP 92 0.760 32.100 37.760 1.00 0.00 ATOM 11077 3C21 DPP 92 2.320 33.070 38.910 1.00 0.00 ATOM 11078 H13R DPP 92 1.640 33.410 39.710 1.00 0.00 ATOM 11079 H13S DPP 92 2.510 33.870 38.170 1.00 0.00 ATOM 11080 4C21 DPP 92 3.640 32.910 39.680 1.00 0.00 ATOM 11081 H14R DPP 92 4.420 32.640 38.940 1.00 0.00 ATOM 11082 H14S DPP 92 3.590 31.990 40.290 1.00 0.00 ATOM 11083 5C21 DPP 92 4.150 34.170 40.370 1.00 0.00 ATOM 11084 H15R DPP 92 3.260 34.560 40.900 1.00 0.00 ATOM 11085 H15S DPP 92 4.410 34.890 39.560 1.00 0.00 ATOM 11086 6C21 DPP 92 5.320 33.820 41.290 1.00 0.00 ATOM 11087 H16R DPP 92 5.570 34.690 41.940 1.00 0.00 ATOM 11088 H16S DPP 92 6.240 33.770 40.660 1.00 0.00 ATOM 11089 H16T DPP 92 5.100 32.900 41.860 1.00 0.00 ATOM 11090 C33 DPP 92 -2.040 29.140 32.510 1.00 0.00 ATOM 11091 H3X DPP 92 -2.080 30.240 32.320 1.00 0.00 ATOM 11092 H3Y DPP 92 -1.010 28.990 32.900 1.00 0.00 ATOM 11093 C34 DPP 92 -2.990 28.870 33.670 1.00 0.00 ATOM 11094 H4X DPP 92 -2.820 27.830 34.000 1.00 0.00 ATOM 11095 H4Y DPP 92 -4.040 29.020 33.340 1.00 0.00 ATOM 11096 C35 DPP 92 -2.960 29.600 35.020 1.00 0.00 ATOM 11097 H5X DPP 92 -3.730 29.200 35.710 1.00 0.00 ATOM 11098 H5Y DPP 92 -3.220 30.660 34.830 1.00 0.00 ATOM 11099 C36 DPP 92 -1.590 29.550 35.690 1.00 0.00 ATOM 11100 H6X DPP 92 -1.660 30.280 36.520 1.00 0.00 ATOM 11101 H6Y DPP 92 -0.890 29.910 34.910 1.00 0.00 ATOM 11102 C37 DPP 92 -1.340 28.200 36.390 1.00 0.00 ATOM 11103 H7X DPP 92 -0.360 28.170 36.900 1.00 0.00 ATOM 11104 H7Y DPP 92 -1.340 27.410 35.600 1.00 0.00 ATOM 11105 C38 DPP 92 -2.340 27.640 37.400 1.00 0.00 ATOM 11106 H8X DPP 92 -3.350 27.520 36.960 1.00 0.00 ATOM 11107 H8Y DPP 92 -2.360 28.420 38.200 1.00 0.00 ATOM 11108 C39 DPP 92 -1.910 26.290 37.970 1.00 0.00 ATOM 11109 H9X DPP 92 -0.910 26.310 38.470 1.00 0.00 ATOM 11110 H9Y DPP 92 -1.860 25.650 37.070 1.00 0.00 ATOM 11111 0C31 DPP 92 -2.850 25.700 39.020 1.00 0.00 ATOM 11112 H10X DPP 92 -3.840 25.510 38.530 1.00 0.00 ATOM 11113 H10Y DPP 92 -2.920 26.460 39.820 1.00 0.00 ATOM 11114 1C31 DPP 92 -2.200 24.430 39.570 1.00 0.00 ATOM 11115 H11X DPP 92 -2.130 23.670 38.760 1.00 0.00 ATOM 11116 H11Y DPP 92 -1.200 24.790 39.900 1.00 0.00 ATOM 11117 2C31 DPP 92 -2.940 23.810 40.760 1.00 0.00 ATOM 11118 H12X DPP 92 -3.200 24.500 41.590 1.00 0.00 ATOM 11119 H12Y DPP 92 -2.320 22.980 41.180 1.00 0.00 ATOM 11120 3C31 DPP 92 -4.350 23.370 40.350 1.00 0.00 ATOM 11121 H13X DPP 92 -4.290 22.820 39.390 1.00 0.00 ATOM 11122 H13Y DPP 92 -4.900 24.320 40.220 1.00 0.00 ATOM 11123 4C31 DPP 92 -5.160 22.570 41.370 1.00 0.00 ATOM 11124 H14X DPP 92 -4.970 23.130 42.320 1.00 0.00 ATOM 11125 H14Y DPP 92 -4.730 21.550 41.440 1.00 0.00 ATOM 11126 5C31 DPP 92 -6.670 22.630 41.130 1.00 0.00 ATOM 11127 H15X DPP 92 -7.030 23.680 41.090 1.00 0.00 ATOM 11128 H15Y DPP 92 -7.270 22.220 41.960 1.00 0.00 ATOM 11129 6C31 DPP 92 -7.140 21.970 39.840 1.00 0.00 ATOM 11130 H16X DPP 92 -6.590 22.440 39.000 1.00 0.00 ATOM 11131 H16Y DPP 92 -8.220 22.180 39.660 1.00 0.00 ATOM 11132 H16Z DPP 92 -7.120 20.860 39.730 1.00 0.00 ATOM 11133 N DPP 93 55.770 25.320 24.220 1.00 0.00 ATOM 11134 HN1 DPP 93 55.700 24.410 23.710 1.00 0.00 ATOM 11135 HN2 DPP 93 55.150 25.970 23.680 1.00 0.00 ATOM 11136 HN3 DPP 93 56.730 25.700 24.170 1.00 0.00 ATOM 11137 C12 DPP 93 55.170 25.080 25.580 1.00 0.00 ATOM 11138 H12A DPP 93 55.050 26.020 26.160 1.00 0.00 ATOM 11139 H12B DPP 93 55.770 24.300 26.090 1.00 0.00 ATOM 11140 C11 DPP 93 53.750 24.530 25.410 1.00 0.00 ATOM 11141 H11A DPP 93 53.070 25.250 24.890 1.00 0.00 ATOM 11142 H11B DPP 93 53.270 24.450 26.410 1.00 0.00 ATOM 11143 P DPP 93 52.880 22.190 24.750 1.00 0.00 ATOM 11144 O13 DPP 93 53.400 21.040 23.990 1.00 0.00 ATOM 11145 O14 DPP 93 51.550 22.730 24.360 1.00 0.00 ATOM 11146 O11 DPP 93 53.030 21.880 26.310 1.00 0.00 ATOM 11147 O12 DPP 93 53.870 23.420 24.510 1.00 0.00 ATOM 11148 C1 DPP 93 54.170 21.100 26.690 1.00 0.00 ATOM 11149 HA DPP 93 55.070 21.750 26.630 1.00 0.00 ATOM 11150 HB DPP 93 54.320 20.330 25.910 1.00 0.00 ATOM 11151 C2 DPP 93 53.960 20.610 28.130 1.00 0.00 ATOM 11152 HS DPP 93 53.430 19.640 28.000 1.00 0.00 ATOM 11153 O21 DPP 93 53.230 21.520 28.960 1.00 0.00 ATOM 11154 C21 DPP 93 51.930 21.250 28.930 1.00 0.00 ATOM 11155 O22 DPP 93 51.380 20.600 28.050 1.00 0.00 ATOM 11156 C22 DPP 93 51.230 21.890 30.120 1.00 0.00 ATOM 11157 H2R DPP 93 51.340 22.990 30.090 1.00 0.00 ATOM 11158 H2S DPP 93 51.780 21.580 31.030 1.00 0.00 ATOM 11159 C3 DPP 93 55.280 20.290 28.850 1.00 0.00 ATOM 11160 HX DPP 93 55.940 21.150 28.640 1.00 0.00 ATOM 11161 HY DPP 93 55.760 19.390 28.410 1.00 0.00 ATOM 11162 O31 DPP 93 55.090 20.130 30.260 1.00 0.00 ATOM 11163 C31 DPP 93 56.070 20.410 31.130 1.00 0.00 ATOM 11164 O32 DPP 93 57.200 20.730 30.820 1.00 0.00 ATOM 11165 C32 DPP 93 55.420 20.140 32.480 1.00 0.00 ATOM 11166 H2X DPP 93 56.170 19.610 33.100 1.00 0.00 ATOM 11167 H2Y DPP 93 54.490 19.550 32.380 1.00 0.00 ATOM 11168 C23 DPP 93 49.770 21.400 30.140 1.00 0.00 ATOM 11169 H3R DPP 93 49.800 20.300 30.270 1.00 0.00 ATOM 11170 H3S DPP 93 49.290 21.520 29.150 1.00 0.00 ATOM 11171 C24 DPP 93 49.050 22.100 31.290 1.00 0.00 ATOM 11172 H4R DPP 93 48.790 23.160 31.090 1.00 0.00 ATOM 11173 H4S DPP 93 49.780 22.200 32.130 1.00 0.00 ATOM 11174 C25 DPP 93 47.770 21.390 31.770 1.00 0.00 ATOM 11175 H5R DPP 93 48.130 20.400 32.120 1.00 0.00 ATOM 11176 H5S DPP 93 47.180 21.160 30.860 1.00 0.00 ATOM 11177 C26 DPP 93 47.100 22.220 32.870 1.00 0.00 ATOM 11178 H6R DPP 93 47.340 23.300 32.800 1.00 0.00 ATOM 11179 H6S DPP 93 47.570 21.850 33.810 1.00 0.00 ATOM 11180 C27 DPP 93 45.580 22.020 32.870 1.00 0.00 ATOM 11181 H7R DPP 93 45.090 22.280 31.910 1.00 0.00 ATOM 11182 H7S DPP 93 45.230 22.770 33.610 1.00 0.00 ATOM 11183 C28 DPP 93 45.110 20.620 33.260 1.00 0.00 ATOM 11184 H8R DPP 93 45.700 20.290 34.140 1.00 0.00 ATOM 11185 H8S DPP 93 45.340 20.010 32.360 1.00 0.00 ATOM 11186 C29 DPP 93 43.610 20.350 33.390 1.00 0.00 ATOM 11187 H9R DPP 93 43.390 19.260 33.400 1.00 0.00 ATOM 11188 H9S DPP 93 43.090 20.700 32.470 1.00 0.00 ATOM 11189 0C21 DPP 93 43.000 20.870 34.690 1.00 0.00 ATOM 11190 H10R DPP 93 41.900 20.780 34.510 1.00 0.00 ATOM 11191 H10S DPP 93 43.300 21.940 34.770 1.00 0.00 ATOM 11192 1C21 DPP 93 43.310 20.020 35.920 1.00 0.00 ATOM 11193 H11R DPP 93 44.400 19.860 36.020 1.00 0.00 ATOM 11194 H11S DPP 93 42.980 18.990 35.680 1.00 0.00 ATOM 11195 2C21 DPP 93 42.870 20.600 37.260 1.00 0.00 ATOM 11196 H12R DPP 93 41.770 20.500 37.300 1.00 0.00 ATOM 11197 H12S DPP 93 43.050 21.700 37.280 1.00 0.00 ATOM 11198 3C21 DPP 93 43.400 19.830 38.480 1.00 0.00 ATOM 11199 H13R DPP 93 44.510 19.810 38.470 1.00 0.00 ATOM 11200 H13S DPP 93 43.030 18.790 38.440 1.00 0.00 ATOM 11201 4C21 DPP 93 42.920 20.330 39.850 1.00 0.00 ATOM 11202 H14R DPP 93 41.820 20.390 39.930 1.00 0.00 ATOM 11203 H14S DPP 93 43.400 21.330 39.810 1.00 0.00 ATOM 11204 5C21 DPP 93 43.330 19.440 41.030 1.00 0.00 ATOM 11205 H15R DPP 93 43.040 19.920 41.980 1.00 0.00 ATOM 11206 H15S DPP 93 44.440 19.340 41.070 1.00 0.00 ATOM 11207 6C21 DPP 93 42.680 18.060 40.980 1.00 0.00 ATOM 11208 H16R DPP 93 42.700 17.530 41.950 1.00 0.00 ATOM 11209 H16S DPP 93 43.150 17.340 40.270 1.00 0.00 ATOM 11210 H16T DPP 93 41.610 18.140 40.670 1.00 0.00 ATOM 11211 C33 DPP 93 55.020 21.450 33.170 1.00 0.00 ATOM 11212 H3X DPP 93 53.940 21.580 32.940 1.00 0.00 ATOM 11213 H3Y DPP 93 55.680 22.260 32.780 1.00 0.00 ATOM 11214 C34 DPP 93 55.270 21.410 34.680 1.00 0.00 ATOM 11215 H4X DPP 93 54.940 22.370 35.130 1.00 0.00 ATOM 11216 H4Y DPP 93 56.380 21.400 34.700 1.00 0.00 ATOM 11217 C35 DPP 93 54.630 20.280 35.480 1.00 0.00 ATOM 11218 H5X DPP 93 55.190 20.570 36.390 1.00 0.00 ATOM 11219 H5Y DPP 93 55.010 19.300 35.100 1.00 0.00 ATOM 11220 C36 DPP 93 53.100 20.200 35.600 1.00 0.00 ATOM 11221 H6X DPP 93 52.670 19.940 34.620 1.00 0.00 ATOM 11222 H6Y DPP 93 52.660 21.170 35.920 1.00 0.00 ATOM 11223 C37 DPP 93 52.810 19.190 36.710 1.00 0.00 ATOM 11224 H7X DPP 93 53.120 19.630 37.680 1.00 0.00 ATOM 11225 H7Y DPP 93 53.360 18.230 36.640 1.00 0.00 ATOM 11226 C38 DPP 93 51.330 18.840 36.880 1.00 0.00 ATOM 11227 H8X DPP 93 51.170 18.270 37.820 1.00 0.00 ATOM 11228 H8Y DPP 93 51.050 18.190 36.020 1.00 0.00 ATOM 11229 C39 DPP 93 50.380 20.040 37.020 1.00 0.00 ATOM 11230 H9X DPP 93 50.490 20.570 36.050 1.00 0.00 ATOM 11231 H9Y DPP 93 50.930 20.650 37.760 1.00 0.00 ATOM 11232 0C31 DPP 93 48.950 19.590 37.320 1.00 0.00 ATOM 11233 H10X DPP 93 48.810 19.300 38.380 1.00 0.00 ATOM 11234 H10Y DPP 93 48.710 18.690 36.710 1.00 0.00 ATOM 11235 1C31 DPP 93 47.820 20.600 37.080 1.00 0.00 ATOM 11236 H11X DPP 93 46.920 20.260 37.630 1.00 0.00 ATOM 11237 H11Y DPP 93 47.490 20.710 36.030 1.00 0.00 ATOM 11238 2C31 DPP 93 48.100 21.970 37.700 1.00 0.00 ATOM 11239 H12X DPP 93 49.020 22.330 37.180 1.00 0.00 ATOM 11240 H12Y DPP 93 48.150 21.790 38.790 1.00 0.00 ATOM 11241 3C31 DPP 93 46.920 22.920 37.470 1.00 0.00 ATOM 11242 H13X DPP 93 47.130 23.840 38.060 1.00 0.00 ATOM 11243 H13Y DPP 93 46.000 22.410 37.790 1.00 0.00 ATOM 11244 4C31 DPP 93 46.720 23.450 36.040 1.00 0.00 ATOM 11245 H14X DPP 93 45.920 23.010 35.400 1.00 0.00 ATOM 11246 H14Y DPP 93 47.650 23.200 35.480 1.00 0.00 ATOM 11247 5C31 DPP 93 46.490 24.960 36.020 1.00 0.00 ATOM 11248 H15X DPP 93 46.670 25.400 35.020 1.00 0.00 ATOM 11249 H15Y DPP 93 47.240 25.520 36.620 1.00 0.00 ATOM 11250 6C31 DPP 93 45.130 25.380 36.560 1.00 0.00 ATOM 11251 H16X DPP 93 45.160 25.550 37.650 1.00 0.00 ATOM 11252 H16Y DPP 93 44.410 24.570 36.310 1.00 0.00 ATOM 11253 H16Z DPP 93 44.760 26.310 36.070 1.00 0.00 ATOM 11254 N DPP 94 22.240 57.810 19.270 1.00 0.00 ATOM 11255 HN1 DPP 94 23.210 58.150 19.070 1.00 0.00 ATOM 11256 HN2 DPP 94 22.320 56.770 19.260 1.00 0.00 ATOM 11257 HN3 DPP 94 21.690 58.190 18.470 1.00 0.00 ATOM 11258 C12 DPP 94 21.660 58.260 20.590 1.00 0.00 ATOM 11259 H12A DPP 94 22.210 59.140 20.990 1.00 0.00 ATOM 11260 H12B DPP 94 20.620 58.620 20.430 1.00 0.00 ATOM 11261 C11 DPP 94 21.570 57.110 21.600 1.00 0.00 ATOM 11262 H11A DPP 94 20.820 56.370 21.240 1.00 0.00 ATOM 11263 H11B DPP 94 21.050 57.440 22.530 1.00 0.00 ATOM 11264 P DPP 94 22.940 55.450 22.970 1.00 0.00 ATOM 11265 O13 DPP 94 24.320 54.900 23.010 1.00 0.00 ATOM 11266 O14 DPP 94 21.820 54.500 22.800 1.00 0.00 ATOM 11267 O11 DPP 94 22.750 56.460 24.200 1.00 0.00 ATOM 11268 O12 DPP 94 22.860 56.520 21.790 1.00 0.00 ATOM 11269 C1 DPP 94 23.810 57.430 24.290 1.00 0.00 ATOM 11270 HA DPP 94 23.310 58.320 24.720 1.00 0.00 ATOM 11271 HB DPP 94 24.130 57.810 23.300 1.00 0.00 ATOM 11272 C2 DPP 94 24.900 57.030 25.300 1.00 0.00 ATOM 11273 HS DPP 94 25.490 56.130 25.000 1.00 0.00 ATOM 11274 O21 DPP 94 24.380 56.810 26.610 1.00 0.00 ATOM 11275 C21 DPP 94 24.170 55.600 27.130 1.00 0.00 ATOM 11276 O22 DPP 94 24.350 54.520 26.580 1.00 0.00 ATOM 11277 C22 DPP 94 23.540 55.670 28.510 1.00 0.00 ATOM 11278 H2R DPP 94 22.450 55.480 28.440 1.00 0.00 ATOM 11279 H2S DPP 94 23.700 56.610 29.090 1.00 0.00 ATOM 11280 C3 DPP 94 25.860 58.230 25.440 1.00 0.00 ATOM 11281 HX DPP 94 25.100 59.030 25.510 1.00 0.00 ATOM 11282 HY DPP 94 26.360 58.460 24.480 1.00 0.00 ATOM 11283 O31 DPP 94 26.650 58.000 26.610 1.00 0.00 ATOM 11284 C31 DPP 94 27.770 58.720 26.590 1.00 0.00 ATOM 11285 O32 DPP 94 28.100 59.450 25.670 1.00 0.00 ATOM 11286 C32 DPP 94 28.640 58.320 27.780 1.00 0.00 ATOM 11287 H2X DPP 94 29.410 57.670 27.300 1.00 0.00 ATOM 11288 H2Y DPP 94 28.000 57.660 28.410 1.00 0.00 ATOM 11289 C23 DPP 94 24.150 54.550 29.350 1.00 0.00 ATOM 11290 H3R DPP 94 24.270 53.550 28.870 1.00 0.00 ATOM 11291 H3S DPP 94 23.510 54.330 30.230 1.00 0.00 ATOM 11292 C24 DPP 94 25.490 54.880 30.010 1.00 0.00 ATOM 11293 H4R DPP 94 25.400 55.920 30.400 1.00 0.00 ATOM 11294 H4S DPP 94 26.100 55.090 29.110 1.00 0.00 ATOM 11295 C25 DPP 94 26.070 53.790 30.900 1.00 0.00 ATOM 11296 H5R DPP 94 27.050 53.990 31.380 1.00 0.00 ATOM 11297 H5S DPP 94 26.370 52.880 30.330 1.00 0.00 ATOM 11298 C26 DPP 94 25.090 53.220 31.930 1.00 0.00 ATOM 11299 H6R DPP 94 24.340 52.530 31.480 1.00 0.00 ATOM 11300 H6S DPP 94 24.500 54.050 32.350 1.00 0.00 ATOM 11301 C27 DPP 94 25.870 52.470 33.020 1.00 0.00 ATOM 11302 H7R DPP 94 25.300 52.180 33.930 1.00 0.00 ATOM 11303 H7S DPP 94 26.650 53.170 33.380 1.00 0.00 ATOM 11304 C28 DPP 94 26.430 51.150 32.490 1.00 0.00 ATOM 11305 H8R DPP 94 27.340 51.270 31.880 1.00 0.00 ATOM 11306 H8S DPP 94 25.540 50.820 31.900 1.00 0.00 ATOM 11307 C29 DPP 94 26.690 50.100 33.580 1.00 0.00 ATOM 11308 H9R DPP 94 26.890 49.110 33.120 1.00 0.00 ATOM 11309 H9S DPP 94 25.710 49.840 34.040 1.00 0.00 ATOM 11310 0C21 DPP 94 27.650 50.460 34.710 1.00 0.00 ATOM 11311 H10R DPP 94 27.320 51.410 35.170 1.00 0.00 ATOM 11312 H10S DPP 94 28.710 50.630 34.420 1.00 0.00 ATOM 11313 1C21 DPP 94 27.700 49.360 35.770 1.00 0.00 ATOM 11314 H11R DPP 94 28.140 48.410 35.400 1.00 0.00 ATOM 11315 H11S DPP 94 26.710 49.040 36.160 1.00 0.00 ATOM 11316 2C21 DPP 94 28.510 49.750 37.010 1.00 0.00 ATOM 11317 H12R DPP 94 29.180 50.600 36.760 1.00 0.00 ATOM 11318 H12S DPP 94 29.200 48.910 37.220 1.00 0.00 ATOM 11319 3C21 DPP 94 27.630 49.980 38.240 1.00 0.00 ATOM 11320 H13R DPP 94 26.890 50.810 38.220 1.00 0.00 ATOM 11321 H13S DPP 94 28.340 50.240 39.060 1.00 0.00 ATOM 11322 4C21 DPP 94 26.820 48.750 38.650 1.00 0.00 ATOM 11323 H14R DPP 94 27.190 47.830 38.160 1.00 0.00 ATOM 11324 H14S DPP 94 25.810 48.900 38.220 1.00 0.00 ATOM 11325 5C21 DPP 94 26.830 48.630 40.180 1.00 0.00 ATOM 11326 H15R DPP 94 27.850 48.480 40.570 1.00 0.00 ATOM 11327 H15S DPP 94 26.260 47.690 40.380 1.00 0.00 ATOM 11328 6C21 DPP 94 26.230 49.770 40.990 1.00 0.00 ATOM 11329 H16R DPP 94 26.480 49.670 42.070 1.00 0.00 ATOM 11330 H16S DPP 94 25.140 49.900 40.800 1.00 0.00 ATOM 11331 H16T DPP 94 26.740 50.700 40.660 1.00 0.00 ATOM 11332 C33 DPP 94 28.980 59.610 28.520 1.00 0.00 ATOM 11333 H3X DPP 94 27.970 59.950 28.830 1.00 0.00 ATOM 11334 H3Y DPP 94 29.470 60.300 27.800 1.00 0.00 ATOM 11335 C34 DPP 94 29.860 59.270 29.720 1.00 0.00 ATOM 11336 H4X DPP 94 29.830 60.160 30.380 1.00 0.00 ATOM 11337 H4Y DPP 94 30.920 59.100 29.430 1.00 0.00 ATOM 11338 C35 DPP 94 29.410 58.090 30.580 1.00 0.00 ATOM 11339 H5X DPP 94 29.940 57.270 30.040 1.00 0.00 ATOM 11340 H5Y DPP 94 28.320 57.950 30.410 1.00 0.00 ATOM 11341 C36 DPP 94 29.840 58.330 32.020 1.00 0.00 ATOM 11342 H6X DPP 94 29.390 59.190 32.550 1.00 0.00 ATOM 11343 H6Y DPP 94 30.950 58.380 31.930 1.00 0.00 ATOM 11344 C37 DPP 94 29.420 57.070 32.780 1.00 0.00 ATOM 11345 H7X DPP 94 29.770 56.180 32.200 1.00 0.00 ATOM 11346 H7Y DPP 94 28.330 56.870 32.850 1.00 0.00 ATOM 11347 C38 DPP 94 30.050 56.930 34.170 1.00 0.00 ATOM 11348 H8X DPP 94 31.060 56.520 33.960 1.00 0.00 ATOM 11349 H8Y DPP 94 29.470 56.150 34.700 1.00 0.00 ATOM 11350 C39 DPP 94 29.960 58.220 34.980 1.00 0.00 ATOM 11351 H9X DPP 94 28.880 58.470 34.920 1.00 0.00 ATOM 11352 H9Y DPP 94 30.480 59.040 34.440 1.00 0.00 ATOM 11353 0C31 DPP 94 30.670 58.200 36.340 1.00 0.00 ATOM 11354 H10X DPP 94 31.750 58.020 36.170 1.00 0.00 ATOM 11355 H10Y DPP 94 30.380 57.420 37.080 1.00 0.00 ATOM 11356 1C31 DPP 94 30.480 59.530 37.050 1.00 0.00 ATOM 11357 H11X DPP 94 29.390 59.720 37.120 1.00 0.00 ATOM 11358 H11Y DPP 94 30.780 60.350 36.360 1.00 0.00 ATOM 11359 2C31 DPP 94 31.100 59.660 38.450 1.00 0.00 ATOM 11360 H12X DPP 94 32.040 59.090 38.610 1.00 0.00 ATOM 11361 H12Y DPP 94 30.470 59.210 39.250 1.00 0.00 ATOM 11362 3C31 DPP 94 31.380 61.100 38.880 1.00 0.00 ATOM 11363 H13X DPP 94 30.370 61.570 38.910 1.00 0.00 ATOM 11364 H13Y DPP 94 32.010 61.500 38.060 1.00 0.00 ATOM 11365 4C31 DPP 94 32.150 61.200 40.200 1.00 0.00 ATOM 11366 H14X DPP 94 33.150 60.720 40.120 1.00 0.00 ATOM 11367 H14Y DPP 94 31.600 60.670 41.000 1.00 0.00 ATOM 11368 5C31 DPP 94 32.400 62.600 40.780 1.00 0.00 ATOM 11369 H15X DPP 94 33.020 63.130 40.030 1.00 0.00 ATOM 11370 H15Y DPP 94 32.990 62.430 41.710 1.00 0.00 ATOM 11371 6C31 DPP 94 31.140 63.330 41.250 1.00 0.00 ATOM 11372 H16X DPP 94 31.450 64.250 41.780 1.00 0.00 ATOM 11373 H16Y DPP 94 30.530 62.620 41.850 1.00 0.00 ATOM 11374 H16Z DPP 94 30.490 63.630 40.410 1.00 0.00 ATOM 11375 N DPP 95 0.360 30.660 22.570 1.00 0.00 ATOM 11376 HN1 DPP 95 1.350 30.960 22.690 1.00 0.00 ATOM 11377 HN2 DPP 95 0.190 29.740 23.010 1.00 0.00 ATOM 11378 HN3 DPP 95 0.290 30.590 21.530 1.00 0.00 ATOM 11379 C12 DPP 95 -0.560 31.800 22.970 1.00 0.00 ATOM 11380 H12A DPP 95 -1.530 31.250 22.970 1.00 0.00 ATOM 11381 H12B DPP 95 -0.600 32.640 22.240 1.00 0.00 ATOM 11382 C11 DPP 95 -0.210 32.380 24.340 1.00 0.00 ATOM 11383 H11A DPP 95 -0.020 31.470 24.950 1.00 0.00 ATOM 11384 H11B DPP 95 -1.060 33.000 24.700 1.00 0.00 ATOM 11385 P DPP 95 0.780 34.690 23.990 1.00 0.00 ATOM 11386 O13 DPP 95 -0.080 35.030 22.830 1.00 0.00 ATOM 11387 O14 DPP 95 2.090 35.400 24.030 1.00 0.00 ATOM 11388 O11 DPP 95 0.110 35.280 25.320 1.00 0.00 ATOM 11389 O12 DPP 95 1.000 33.130 24.240 1.00 0.00 ATOM 11390 C1 DPP 95 0.330 34.690 26.600 1.00 0.00 ATOM 11391 HA DPP 95 1.170 35.270 27.020 1.00 0.00 ATOM 11392 HB DPP 95 0.370 33.580 26.520 1.00 0.00 ATOM 11393 C2 DPP 95 -0.810 35.040 27.570 1.00 0.00 ATOM 11394 HS DPP 95 -1.820 34.900 27.110 1.00 0.00 ATOM 11395 O21 DPP 95 -0.720 36.420 27.940 1.00 0.00 ATOM 11396 C21 DPP 95 -1.810 37.150 27.720 1.00 0.00 ATOM 11397 O22 DPP 95 -2.780 36.880 27.040 1.00 0.00 ATOM 11398 C22 DPP 95 -1.630 38.510 28.390 1.00 0.00 ATOM 11399 H2R DPP 95 -2.260 39.260 27.860 1.00 0.00 ATOM 11400 H2S DPP 95 -0.580 38.850 28.380 1.00 0.00 ATOM 11401 C3 DPP 95 -0.660 34.140 28.810 1.00 0.00 ATOM 11402 HX DPP 95 0.390 34.200 29.180 1.00 0.00 ATOM 11403 HY DPP 95 -0.800 33.080 28.510 1.00 0.00 ATOM 11404 O31 DPP 95 -1.530 34.510 29.880 1.00 0.00 ATOM 11405 C31 DPP 95 -2.580 33.690 30.020 1.00 0.00 ATOM 11406 O32 DPP 95 -2.820 32.630 29.470 1.00 0.00 ATOM 11407 C32 DPP 95 -3.430 34.340 31.110 1.00 0.00 ATOM 11408 H2X DPP 95 -4.280 34.830 30.580 1.00 0.00 ATOM 11409 H2Y DPP 95 -2.790 35.090 31.630 1.00 0.00 ATOM 11410 C23 DPP 95 -2.040 38.270 29.840 1.00 0.00 ATOM 11411 H3R DPP 95 -1.270 37.580 30.250 1.00 0.00 ATOM 11412 H3S DPP 95 -2.900 37.600 30.050 1.00 0.00 ATOM 11413 C24 DPP 95 -2.020 39.530 30.710 1.00 0.00 ATOM 11414 H4R DPP 95 -2.770 40.290 30.410 1.00 0.00 ATOM 11415 H4S DPP 95 -0.980 39.920 30.680 1.00 0.00 ATOM 11416 C25 DPP 95 -2.340 39.060 32.130 1.00 0.00 ATOM 11417 H5R DPP 95 -1.660 38.210 32.350 1.00 0.00 ATOM 11418 H5S DPP 95 -3.370 38.640 32.100 1.00 0.00 ATOM 11419 C26 DPP 95 -2.200 40.190 33.150 1.00 0.00 ATOM 11420 H6R DPP 95 -2.850 41.050 32.860 1.00 0.00 ATOM 11421 H6S DPP 95 -1.220 40.700 33.100 1.00 0.00 ATOM 11422 C27 DPP 95 -2.480 39.870 34.630 1.00 0.00 ATOM 11423 H7R DPP 95 -2.220 40.770 35.230 1.00 0.00 ATOM 11424 H7S DPP 95 -1.730 39.120 34.960 1.00 0.00 ATOM 11425 C28 DPP 95 -3.870 39.430 35.050 1.00 0.00 ATOM 11426 H8R DPP 95 -4.060 38.350 34.820 1.00 0.00 ATOM 11427 H8S DPP 95 -4.670 40.100 34.680 1.00 0.00 ATOM 11428 C29 DPP 95 -4.120 39.550 36.560 1.00 0.00 ATOM 11429 H9R DPP 95 -5.210 39.530 36.760 1.00 0.00 ATOM 11430 H9S DPP 95 -3.820 40.560 36.880 1.00 0.00 ATOM 11431 0C21 DPP 95 -3.550 38.320 37.270 1.00 0.00 ATOM 11432 H10R DPP 95 -2.640 37.970 36.760 1.00 0.00 ATOM 11433 H10S DPP 95 -4.140 37.390 37.060 1.00 0.00 ATOM 11434 1C21 DPP 95 -3.190 38.510 38.750 1.00 0.00 ATOM 11435 H11R DPP 95 -4.140 38.490 39.320 1.00 0.00 ATOM 11436 H11S DPP 95 -2.680 39.500 38.840 1.00 0.00 ATOM 11437 2C21 DPP 95 -2.210 37.520 39.380 1.00 0.00 ATOM 11438 H12R DPP 95 -1.240 37.870 38.980 1.00 0.00 ATOM 11439 H12S DPP 95 -2.460 36.510 39.000 1.00 0.00 ATOM 11440 3C21 DPP 95 -2.290 37.570 40.910 1.00 0.00 ATOM 11441 H13R DPP 95 -3.140 36.910 41.190 1.00 0.00 ATOM 11442 H13S DPP 95 -2.500 38.640 41.130 1.00 0.00 ATOM 11443 4C21 DPP 95 -0.980 37.160 41.570 1.00 0.00 ATOM 11444 H14R DPP 95 -0.320 37.660 40.830 1.00 0.00 ATOM 11445 H14S DPP 95 -0.890 36.050 41.580 1.00 0.00 ATOM 11446 5C21 DPP 95 -0.620 37.630 42.990 1.00 0.00 ATOM 11447 H15R DPP 95 -0.880 38.710 42.910 1.00 0.00 ATOM 11448 H15S DPP 95 0.410 37.300 43.210 1.00 0.00 ATOM 11449 6C21 DPP 95 -1.420 37.070 44.160 1.00 0.00 ATOM 11450 H16R DPP 95 -1.670 36.000 44.000 1.00 0.00 ATOM 11451 H16S DPP 95 -2.370 37.640 44.110 1.00 0.00 ATOM 11452 H16T DPP 95 -0.930 37.220 45.150 1.00 0.00 ATOM 11453 C33 DPP 95 -4.110 33.350 32.050 1.00 0.00 ATOM 11454 H3X DPP 95 -3.360 32.950 32.770 1.00 0.00 ATOM 11455 H3Y DPP 95 -4.590 32.510 31.500 1.00 0.00 ATOM 11456 C34 DPP 95 -5.250 33.910 32.890 1.00 0.00 ATOM 11457 H4X DPP 95 -6.100 33.920 32.180 1.00 0.00 ATOM 11458 H4Y DPP 95 -5.050 34.910 33.340 1.00 0.00 ATOM 11459 C35 DPP 95 -5.640 33.020 34.070 1.00 0.00 ATOM 11460 H5X DPP 95 -4.790 32.850 34.760 1.00 0.00 ATOM 11461 H5Y DPP 95 -6.050 32.030 33.790 1.00 0.00 ATOM 11462 C36 DPP 95 -6.850 33.470 34.900 1.00 0.00 ATOM 11463 H6X DPP 95 -6.940 32.550 35.520 1.00 0.00 ATOM 11464 H6Y DPP 95 -7.770 33.540 34.280 1.00 0.00 ATOM 11465 C37 DPP 95 -6.730 34.710 35.790 1.00 0.00 ATOM 11466 H7X DPP 95 -6.500 35.600 35.170 1.00 0.00 ATOM 11467 H7Y DPP 95 -5.840 34.560 36.450 1.00 0.00 ATOM 11468 C38 DPP 95 -7.940 34.960 36.690 1.00 0.00 ATOM 11469 H8X DPP 95 -8.820 35.130 36.040 1.00 0.00 ATOM 11470 H8Y DPP 95 -7.680 35.890 37.230 1.00 0.00 ATOM 11471 C39 DPP 95 -8.290 33.830 37.660 1.00 0.00 ATOM 11472 H9X DPP 95 -8.600 32.870 37.180 1.00 0.00 ATOM 11473 H9Y DPP 95 -9.210 34.050 38.250 1.00 0.00 ATOM 11474 0C31 DPP 95 -7.180 33.560 38.680 1.00 0.00 ATOM 11475 H10X DPP 95 -6.200 33.500 38.160 1.00 0.00 ATOM 11476 H10Y DPP 95 -7.440 32.700 39.340 1.00 0.00 ATOM 11477 1C31 DPP 95 -6.970 34.730 39.650 1.00 0.00 ATOM 11478 H11X DPP 95 -7.840 34.920 40.310 1.00 0.00 ATOM 11479 H11Y DPP 95 -6.860 35.700 39.110 1.00 0.00 ATOM 11480 2C31 DPP 95 -5.880 34.560 40.700 1.00 0.00 ATOM 11481 H12X DPP 95 -4.910 34.710 40.170 1.00 0.00 ATOM 11482 H12Y DPP 95 -6.060 33.550 41.120 1.00 0.00 ATOM 11483 3C31 DPP 95 -5.980 35.620 41.810 1.00 0.00 ATOM 11484 H13X DPP 95 -5.030 35.420 42.350 1.00 0.00 ATOM 11485 H13Y DPP 95 -6.890 35.420 42.400 1.00 0.00 ATOM 11486 4C31 DPP 95 -6.080 37.050 41.290 1.00 0.00 ATOM 11487 H14X DPP 95 -6.910 37.250 40.580 1.00 0.00 ATOM 11488 H14Y DPP 95 -5.220 37.230 40.600 1.00 0.00 ATOM 11489 5C31 DPP 95 -6.060 38.220 42.280 1.00 0.00 ATOM 11490 H15X DPP 95 -6.960 38.020 42.900 1.00 0.00 ATOM 11491 H15Y DPP 95 -6.220 39.130 41.660 1.00 0.00 ATOM 11492 6C31 DPP 95 -4.850 38.270 43.200 1.00 0.00 ATOM 11493 H16X DPP 95 -4.970 39.000 44.020 1.00 0.00 ATOM 11494 H16Y DPP 95 -4.610 37.210 43.430 1.00 0.00 ATOM 11495 H16Z DPP 95 -4.010 38.700 42.610 1.00 0.00 ATOM 11496 N DPP 96 11.430 13.010 23.420 1.00 0.00 ATOM 11497 HN1 DPP 96 10.620 13.130 24.070 1.00 0.00 ATOM 11498 HN2 DPP 96 12.250 13.070 24.060 1.00 0.00 ATOM 11499 HN3 DPP 96 11.480 13.870 22.840 1.00 0.00 ATOM 11500 C12 DPP 96 11.310 11.650 22.790 1.00 0.00 ATOM 11501 H12A DPP 96 11.970 11.700 21.900 1.00 0.00 ATOM 11502 H12B DPP 96 10.270 11.450 22.440 1.00 0.00 ATOM 11503 C11 DPP 96 11.850 10.460 23.580 1.00 0.00 ATOM 11504 H11A DPP 96 12.150 9.690 22.830 1.00 0.00 ATOM 11505 H11B DPP 96 11.040 10.020 24.210 1.00 0.00 ATOM 11506 P DPP 96 13.620 9.880 25.270 1.00 0.00 ATOM 11507 O13 DPP 96 14.500 10.690 26.140 1.00 0.00 ATOM 11508 O14 DPP 96 14.200 8.920 24.310 1.00 0.00 ATOM 11509 O11 DPP 96 12.360 9.320 26.080 1.00 0.00 ATOM 11510 O12 DPP 96 12.890 11.000 24.390 1.00 0.00 ATOM 11511 C1 DPP 96 12.290 7.910 26.320 1.00 0.00 ATOM 11512 HA DPP 96 13.020 7.300 25.760 1.00 0.00 ATOM 11513 HB DPP 96 11.270 7.520 26.100 1.00 0.00 ATOM 11514 C2 DPP 96 12.610 7.680 27.810 1.00 0.00 ATOM 11515 HS DPP 96 11.810 8.160 28.410 1.00 0.00 ATOM 11516 O21 DPP 96 13.940 8.080 28.150 1.00 0.00 ATOM 11517 C21 DPP 96 14.010 8.500 29.410 1.00 0.00 ATOM 11518 O22 DPP 96 13.050 8.690 30.150 1.00 0.00 ATOM 11519 C22 DPP 96 15.480 8.790 29.660 1.00 0.00 ATOM 11520 H2R DPP 96 15.760 9.570 28.920 1.00 0.00 ATOM 11521 H2S DPP 96 16.210 7.960 29.550 1.00 0.00 ATOM 11522 C3 DPP 96 12.490 6.160 28.050 1.00 0.00 ATOM 11523 HX DPP 96 13.400 5.630 27.700 1.00 0.00 ATOM 11524 HY DPP 96 11.650 5.770 27.450 1.00 0.00 ATOM 11525 O31 DPP 96 12.240 5.840 29.420 1.00 0.00 ATOM 11526 C31 DPP 96 13.120 5.080 30.090 1.00 0.00 ATOM 11527 O32 DPP 96 14.020 4.400 29.640 1.00 0.00 ATOM 11528 C32 DPP 96 12.780 5.290 31.560 1.00 0.00 ATOM 11529 H2X DPP 96 11.710 5.270 31.850 1.00 0.00 ATOM 11530 H2Y DPP 96 13.150 6.300 31.820 1.00 0.00 ATOM 11531 C23 DPP 96 15.670 9.390 31.050 1.00 0.00 ATOM 11532 H3R DPP 96 14.760 9.980 31.290 1.00 0.00 ATOM 11533 H3S DPP 96 16.420 10.180 30.790 1.00 0.00 ATOM 11534 C24 DPP 96 16.140 8.580 32.260 1.00 0.00 ATOM 11535 H4R DPP 96 17.230 8.360 32.230 1.00 0.00 ATOM 11536 H4S DPP 96 15.710 7.550 32.280 1.00 0.00 ATOM 11537 C25 DPP 96 15.720 9.370 33.500 1.00 0.00 ATOM 11538 H5R DPP 96 15.640 8.610 34.300 1.00 0.00 ATOM 11539 H5S DPP 96 14.730 9.750 33.190 1.00 0.00 ATOM 11540 C26 DPP 96 16.620 10.560 33.850 1.00 0.00 ATOM 11541 H6R DPP 96 16.720 11.210 32.960 1.00 0.00 ATOM 11542 H6S DPP 96 17.640 10.180 34.120 1.00 0.00 ATOM 11543 C27 DPP 96 16.180 11.360 35.070 1.00 0.00 ATOM 11544 H7R DPP 96 15.580 10.760 35.790 1.00 0.00 ATOM 11545 H7S DPP 96 15.570 12.170 34.620 1.00 0.00 ATOM 11546 C28 DPP 96 17.350 11.700 36.000 1.00 0.00 ATOM 11547 H8R DPP 96 17.950 10.780 36.180 1.00 0.00 ATOM 11548 H8S DPP 96 16.790 12.030 36.910 1.00 0.00 ATOM 11549 C29 DPP 96 18.170 12.850 35.430 1.00 0.00 ATOM 11550 H9R DPP 96 17.800 13.280 34.480 1.00 0.00 ATOM 11551 H9S DPP 96 19.090 12.300 35.140 1.00 0.00 ATOM 11552 0C21 DPP 96 18.430 13.930 36.490 1.00 0.00 ATOM 11553 H10R DPP 96 17.420 14.350 36.660 1.00 0.00 ATOM 11554 H10S DPP 96 19.250 14.550 36.070 1.00 0.00 ATOM 11555 1C21 DPP 96 18.920 13.430 37.850 1.00 0.00 ATOM 11556 H11R DPP 96 19.910 12.930 37.710 1.00 0.00 ATOM 11557 H11S DPP 96 18.140 12.760 38.280 1.00 0.00 ATOM 11558 2C21 DPP 96 18.980 14.500 38.940 1.00 0.00 ATOM 11559 H12R DPP 96 19.600 14.070 39.750 1.00 0.00 ATOM 11560 H12S DPP 96 17.990 14.810 39.350 1.00 0.00 ATOM 11561 3C21 DPP 96 19.750 15.740 38.480 1.00 0.00 ATOM 11562 H13R DPP 96 20.620 15.510 37.830 1.00 0.00 ATOM 11563 H13S DPP 96 20.270 16.160 39.370 1.00 0.00 ATOM 11564 4C21 DPP 96 18.950 16.940 37.970 1.00 0.00 ATOM 11565 H14R DPP 96 17.960 16.880 38.460 1.00 0.00 ATOM 11566 H14S DPP 96 18.840 16.890 36.860 1.00 0.00 ATOM 11567 5C21 DPP 96 19.490 18.340 38.310 1.00 0.00 ATOM 11568 H15R DPP 96 20.500 18.390 37.860 1.00 0.00 ATOM 11569 H15S DPP 96 19.610 18.310 39.410 1.00 0.00 ATOM 11570 6C21 DPP 96 18.570 19.470 37.850 1.00 0.00 ATOM 11571 H16R DPP 96 18.550 20.380 38.490 1.00 0.00 ATOM 11572 H16S DPP 96 17.500 19.200 37.900 1.00 0.00 ATOM 11573 H16T DPP 96 18.880 19.870 36.860 1.00 0.00 ATOM 11574 C33 DPP 96 13.520 4.330 32.490 1.00 0.00 ATOM 11575 H3X DPP 96 14.570 4.240 32.130 1.00 0.00 ATOM 11576 H3Y DPP 96 13.010 3.350 32.590 1.00 0.00 ATOM 11577 C34 DPP 96 13.620 4.840 33.930 1.00 0.00 ATOM 11578 H4X DPP 96 12.660 5.380 34.110 1.00 0.00 ATOM 11579 H4Y DPP 96 14.370 5.600 34.230 1.00 0.00 ATOM 11580 C35 DPP 96 13.580 3.690 34.930 1.00 0.00 ATOM 11581 H5X DPP 96 14.450 3.000 34.820 1.00 0.00 ATOM 11582 H5Y DPP 96 12.720 3.020 34.690 1.00 0.00 ATOM 11583 C36 DPP 96 13.350 4.160 36.370 1.00 0.00 ATOM 11584 H6X DPP 96 12.450 4.800 36.350 1.00 0.00 ATOM 11585 H6Y DPP 96 14.160 4.760 36.830 1.00 0.00 ATOM 11586 C37 DPP 96 12.950 3.010 37.300 1.00 0.00 ATOM 11587 H7X DPP 96 13.690 2.200 37.160 1.00 0.00 ATOM 11588 H7Y DPP 96 12.070 2.480 36.850 1.00 0.00 ATOM 11589 C38 DPP 96 12.670 3.380 38.760 1.00 0.00 ATOM 11590 H8X DPP 96 11.580 3.590 38.780 1.00 0.00 ATOM 11591 H8Y DPP 96 13.160 4.340 39.030 1.00 0.00 ATOM 11592 C39 DPP 96 12.780 2.280 39.820 1.00 0.00 ATOM 11593 H9X DPP 96 13.750 1.740 39.730 1.00 0.00 ATOM 11594 H9Y DPP 96 12.090 1.430 39.630 1.00 0.00 ATOM 11595 0C31 DPP 96 12.590 2.930 41.200 1.00 0.00 ATOM 11596 H10X DPP 96 11.630 3.480 41.220 1.00 0.00 ATOM 11597 H10Y DPP 96 13.450 3.640 41.230 1.00 0.00 ATOM 11598 1C31 DPP 96 12.870 1.810 42.210 1.00 0.00 ATOM 11599 H11X DPP 96 13.270 2.310 43.110 1.00 0.00 ATOM 11600 H11Y DPP 96 13.600 1.120 41.740 1.00 0.00 ATOM 11601 2C31 DPP 96 11.620 1.000 42.570 1.00 0.00 ATOM 11602 H12X DPP 96 11.410 0.360 41.690 1.00 0.00 ATOM 11603 H12Y DPP 96 10.790 1.680 42.850 1.00 0.00 ATOM 11604 3C31 DPP 96 11.850 0.110 43.790 1.00 0.00 ATOM 11605 H13X DPP 96 11.800 0.790 44.670 1.00 0.00 ATOM 11606 H13Y DPP 96 12.810 -0.440 43.740 1.00 0.00 ATOM 11607 4C31 DPP 96 10.650 -0.840 43.850 1.00 0.00 ATOM 11608 H14X DPP 96 9.710 -0.240 43.850 1.00 0.00 ATOM 11609 H14Y DPP 96 10.590 -1.150 44.910 1.00 0.00 ATOM 11610 5C31 DPP 96 10.610 -2.030 42.890 1.00 0.00 ATOM 11611 H15X DPP 96 10.930 -1.690 41.880 1.00 0.00 ATOM 11612 H15Y DPP 96 9.560 -2.410 42.960 1.00 0.00 ATOM 11613 6C31 DPP 96 11.630 -3.080 43.340 1.00 0.00 ATOM 11614 H16X DPP 96 11.520 -3.950 42.660 1.00 0.00 ATOM 11615 H16Y DPP 96 11.390 -3.400 44.380 1.00 0.00 ATOM 11616 H16Z DPP 96 12.650 -2.650 43.290 1.00 0.00 ATOM 11617 N DPP 97 1.000 19.450 25.080 1.00 0.00 ATOM 11618 HN1 DPP 97 1.160 18.960 24.180 1.00 0.00 ATOM 11619 HN2 DPP 97 0.830 18.590 25.630 1.00 0.00 ATOM 11620 HN3 DPP 97 0.150 20.030 24.970 1.00 0.00 ATOM 11621 C12 DPP 97 2.010 20.300 25.830 1.00 0.00 ATOM 11622 H12A DPP 97 1.620 20.270 26.880 1.00 0.00 ATOM 11623 H12B DPP 97 2.060 21.310 25.380 1.00 0.00 ATOM 11624 C11 DPP 97 3.330 19.520 25.760 1.00 0.00 ATOM 11625 H11A DPP 97 3.100 18.610 26.350 1.00 0.00 ATOM 11626 H11B DPP 97 4.110 20.090 26.310 1.00 0.00 ATOM 11627 P DPP 97 4.490 20.290 23.610 1.00 0.00 ATOM 11628 O13 DPP 97 3.390 21.030 22.950 1.00 0.00 ATOM 11629 O14 DPP 97 5.270 19.490 22.640 1.00 0.00 ATOM 11630 O11 DPP 97 5.380 21.150 24.620 1.00 0.00 ATOM 11631 O12 DPP 97 3.820 19.120 24.470 1.00 0.00 ATOM 11632 C1 DPP 97 6.780 20.930 24.460 1.00 0.00 ATOM 11633 HA DPP 97 7.270 21.660 25.140 1.00 0.00 ATOM 11634 HB DPP 97 7.120 21.220 23.440 1.00 0.00 ATOM 11635 C2 DPP 97 7.140 19.570 25.060 1.00 0.00 ATOM 11636 HS DPP 97 6.820 18.790 24.330 1.00 0.00 ATOM 11637 O21 DPP 97 6.430 19.440 26.300 1.00 0.00 ATOM 11638 C21 DPP 97 6.440 18.160 26.680 1.00 0.00 ATOM 11639 O22 DPP 97 6.650 17.180 25.990 1.00 0.00 ATOM 11640 C22 DPP 97 6.220 18.110 28.180 1.00 0.00 ATOM 11641 H2R DPP 97 5.120 18.040 28.330 1.00 0.00 ATOM 11642 H2S DPP 97 6.700 18.990 28.670 1.00 0.00 ATOM 11643 C3 DPP 97 8.660 19.400 25.190 1.00 0.00 ATOM 11644 HX DPP 97 9.200 19.490 24.230 1.00 0.00 ATOM 11645 HY DPP 97 8.950 18.390 25.580 1.00 0.00 ATOM 11646 O31 DPP 97 9.330 20.380 25.990 1.00 0.00 ATOM 11647 C31 DPP 97 9.460 20.100 27.290 1.00 0.00 ATOM 11648 O32 DPP 97 9.270 19.020 27.810 1.00 0.00 ATOM 11649 C32 DPP 97 9.930 21.320 28.070 1.00 0.00 ATOM 11650 H2X DPP 97 10.170 22.130 27.350 1.00 0.00 ATOM 11651 H2Y DPP 97 10.730 21.150 28.820 1.00 0.00 ATOM 11652 C23 DPP 97 6.830 16.810 28.710 1.00 0.00 ATOM 11653 H3R DPP 97 7.880 16.630 28.400 1.00 0.00 ATOM 11654 H3S DPP 97 6.270 15.920 28.340 1.00 0.00 ATOM 11655 C24 DPP 97 6.930 16.920 30.230 1.00 0.00 ATOM 11656 H4R DPP 97 6.970 15.900 30.670 1.00 0.00 ATOM 11657 H4S DPP 97 5.960 17.310 30.590 1.00 0.00 ATOM 11658 C25 DPP 97 7.980 17.830 30.880 1.00 0.00 ATOM 11659 H5R DPP 97 7.700 17.850 31.960 1.00 0.00 ATOM 11660 H5S DPP 97 8.060 18.810 30.380 1.00 0.00 ATOM 11661 C26 DPP 97 9.340 17.130 30.810 1.00 0.00 ATOM 11662 H6R DPP 97 9.690 16.910 29.780 1.00 0.00 ATOM 11663 H6S DPP 97 9.340 16.220 31.440 1.00 0.00 ATOM 11664 C27 DPP 97 10.480 17.910 31.460 1.00 0.00 ATOM 11665 H7R DPP 97 10.900 18.630 30.730 1.00 0.00 ATOM 11666 H7S DPP 97 11.240 17.170 31.770 1.00 0.00 ATOM 11667 C28 DPP 97 10.040 18.590 32.760 1.00 0.00 ATOM 11668 H8R DPP 97 9.330 17.870 33.220 1.00 0.00 ATOM 11669 H8S DPP 97 9.560 19.510 32.360 1.00 0.00 ATOM 11670 C29 DPP 97 11.090 18.950 33.820 1.00 0.00 ATOM 11671 H9R DPP 97 12.000 19.140 33.220 1.00 0.00 ATOM 11672 H9S DPP 97 11.250 18.010 34.400 1.00 0.00 ATOM 11673 0C21 DPP 97 10.720 19.930 34.930 1.00 0.00 ATOM 11674 H10R DPP 97 10.650 20.980 34.590 1.00 0.00 ATOM 11675 H10S DPP 97 11.620 19.980 35.580 1.00 0.00 ATOM 11676 1C21 DPP 97 9.580 19.430 35.820 1.00 0.00 ATOM 11677 H11R DPP 97 9.420 18.330 35.900 1.00 0.00 ATOM 11678 H11S DPP 97 8.700 19.950 35.410 1.00 0.00 ATOM 11679 2C21 DPP 97 9.560 20.020 37.230 1.00 0.00 ATOM 11680 H12R DPP 97 10.270 19.400 37.820 1.00 0.00 ATOM 11681 H12S DPP 97 8.500 19.920 37.560 1.00 0.00 ATOM 11682 3C21 DPP 97 9.930 21.510 37.230 1.00 0.00 ATOM 11683 H13R DPP 97 9.220 22.000 36.540 1.00 0.00 ATOM 11684 H13S DPP 97 10.890 21.680 36.690 1.00 0.00 ATOM 11685 4C21 DPP 97 9.990 22.190 38.600 1.00 0.00 ATOM 11686 H14R DPP 97 8.970 22.220 39.050 1.00 0.00 ATOM 11687 H14S DPP 97 10.230 23.240 38.320 1.00 0.00 ATOM 11688 5C21 DPP 97 11.060 21.460 39.410 1.00 0.00 ATOM 11689 H15R DPP 97 11.880 21.130 38.750 1.00 0.00 ATOM 11690 H15S DPP 97 10.610 20.530 39.820 1.00 0.00 ATOM 11691 6C21 DPP 97 11.550 22.050 40.730 1.00 0.00 ATOM 11692 H16R DPP 97 10.800 22.230 41.530 1.00 0.00 ATOM 11693 H16S DPP 97 12.020 23.030 40.520 1.00 0.00 ATOM 11694 H16T DPP 97 12.270 21.380 41.260 1.00 0.00 ATOM 11695 C33 DPP 97 8.790 21.820 28.980 1.00 0.00 ATOM 11696 H3X DPP 97 8.620 21.010 29.720 1.00 0.00 ATOM 11697 H3Y DPP 97 7.910 22.020 28.340 1.00 0.00 ATOM 11698 C34 DPP 97 9.250 23.110 29.670 1.00 0.00 ATOM 11699 H4X DPP 97 8.310 23.330 30.230 1.00 0.00 ATOM 11700 H4Y DPP 97 9.270 24.010 29.020 1.00 0.00 ATOM 11701 C35 DPP 97 10.560 23.070 30.440 1.00 0.00 ATOM 11702 H5X DPP 97 11.430 23.030 29.750 1.00 0.00 ATOM 11703 H5Y DPP 97 10.470 22.180 31.090 1.00 0.00 ATOM 11704 C36 DPP 97 10.830 24.230 31.410 1.00 0.00 ATOM 11705 H6X DPP 97 9.960 24.290 32.100 1.00 0.00 ATOM 11706 H6Y DPP 97 10.950 25.170 30.840 1.00 0.00 ATOM 11707 C37 DPP 97 12.070 23.880 32.240 1.00 0.00 ATOM 11708 H7X DPP 97 12.900 23.550 31.570 1.00 0.00 ATOM 11709 H7Y DPP 97 11.840 22.990 32.860 1.00 0.00 ATOM 11710 C38 DPP 97 12.460 25.220 32.880 1.00 0.00 ATOM 11711 H8X DPP 97 11.530 25.540 33.410 1.00 0.00 ATOM 11712 H8Y DPP 97 12.630 25.970 32.080 1.00 0.00 ATOM 11713 C39 DPP 97 13.480 25.340 34.010 1.00 0.00 ATOM 11714 H9X DPP 97 13.520 26.400 34.350 1.00 0.00 ATOM 11715 H9Y DPP 97 14.460 25.070 33.560 1.00 0.00 ATOM 11716 0C31 DPP 97 13.360 24.420 35.220 1.00 0.00 ATOM 11717 H10X DPP 97 13.400 23.350 34.910 1.00 0.00 ATOM 11718 H10Y DPP 97 12.320 24.480 35.620 1.00 0.00 ATOM 11719 1C31 DPP 97 14.470 24.780 36.210 1.00 0.00 ATOM 11720 H11X DPP 97 14.560 25.880 36.310 1.00 0.00 ATOM 11721 H11Y DPP 97 15.410 24.390 35.770 1.00 0.00 ATOM 11722 2C31 DPP 97 14.390 24.200 37.620 1.00 0.00 ATOM 11723 H12X DPP 97 13.520 23.510 37.670 1.00 0.00 ATOM 11724 H12Y DPP 97 14.150 25.010 38.350 1.00 0.00 ATOM 11725 3C31 DPP 97 15.600 23.350 38.040 1.00 0.00 ATOM 11726 H13X DPP 97 16.470 24.030 38.130 1.00 0.00 ATOM 11727 H13Y DPP 97 15.830 22.610 37.250 1.00 0.00 ATOM 11728 4C31 DPP 97 15.230 22.680 39.360 1.00 0.00 ATOM 11729 H14X DPP 97 14.310 22.060 39.400 1.00 0.00 ATOM 11730 H14Y DPP 97 14.910 23.510 40.030 1.00 0.00 ATOM 11731 5C31 DPP 97 16.310 21.780 39.960 1.00 0.00 ATOM 11732 H15X DPP 97 17.180 22.470 40.050 1.00 0.00 ATOM 11733 H15Y DPP 97 16.770 21.020 39.300 1.00 0.00 ATOM 11734 6C31 DPP 97 16.030 21.270 41.380 1.00 0.00 ATOM 11735 H16X DPP 97 15.270 20.470 41.480 1.00 0.00 ATOM 11736 H16Y DPP 97 15.610 22.070 42.030 1.00 0.00 ATOM 11737 H16Z DPP 97 17.000 20.920 41.770 1.00 0.00 ATOM 11738 N DPP 98 25.240 11.340 24.860 1.00 0.00 ATOM 11739 HN1 DPP 98 25.840 11.870 24.200 1.00 0.00 ATOM 11740 HN2 DPP 98 25.850 10.670 25.370 1.00 0.00 ATOM 11741 HN3 DPP 98 24.610 10.740 24.280 1.00 0.00 ATOM 11742 C12 DPP 98 24.360 12.160 25.770 1.00 0.00 ATOM 11743 H12A DPP 98 23.670 11.500 26.330 1.00 0.00 ATOM 11744 H12B DPP 98 25.040 12.800 26.390 1.00 0.00 ATOM 11745 C11 DPP 98 23.590 13.100 24.850 1.00 0.00 ATOM 11746 H11A DPP 98 24.270 13.880 24.470 1.00 0.00 ATOM 11747 H11B DPP 98 22.880 13.630 25.520 1.00 0.00 ATOM 11748 P DPP 98 21.380 12.320 23.930 1.00 0.00 ATOM 11749 O13 DPP 98 20.750 11.410 22.950 1.00 0.00 ATOM 11750 O14 DPP 98 20.890 13.700 23.710 1.00 0.00 ATOM 11751 O11 DPP 98 21.160 11.810 25.430 1.00 0.00 ATOM 11752 O12 DPP 98 22.970 12.370 23.780 1.00 0.00 ATOM 11753 C1 DPP 98 19.840 11.640 25.960 1.00 0.00 ATOM 11754 HA DPP 98 19.900 11.120 26.940 1.00 0.00 ATOM 11755 HB DPP 98 19.210 10.970 25.330 1.00 0.00 ATOM 11756 C2 DPP 98 19.060 12.910 26.330 1.00 0.00 ATOM 11757 HS DPP 98 18.660 13.270 25.350 1.00 0.00 ATOM 11758 O21 DPP 98 20.060 13.800 26.820 1.00 0.00 ATOM 11759 C21 DPP 98 19.550 14.990 27.140 1.00 0.00 ATOM 11760 O22 DPP 98 18.460 15.390 26.780 1.00 0.00 ATOM 11761 C22 DPP 98 20.470 15.770 28.080 1.00 0.00 ATOM 11762 H2R DPP 98 21.530 15.600 27.820 1.00 0.00 ATOM 11763 H2S DPP 98 20.310 15.370 29.100 1.00 0.00 ATOM 11764 C3 DPP 98 17.970 12.540 27.350 1.00 0.00 ATOM 11765 HX DPP 98 17.720 11.490 27.110 1.00 0.00 ATOM 11766 HY DPP 98 17.140 13.240 27.120 1.00 0.00 ATOM 11767 O31 DPP 98 18.450 12.620 28.690 1.00 0.00 ATOM 11768 C31 DPP 98 17.420 12.580 29.540 1.00 0.00 ATOM 11769 O32 DPP 98 16.260 12.330 29.280 1.00 0.00 ATOM 11770 C32 DPP 98 18.060 12.840 30.890 1.00 0.00 ATOM 11771 H2X DPP 98 19.160 13.050 30.870 1.00 0.00 ATOM 11772 H2Y DPP 98 18.090 12.010 31.630 1.00 0.00 ATOM 11773 C23 DPP 98 20.380 17.290 28.160 1.00 0.00 ATOM 11774 H3R DPP 98 19.400 17.430 28.660 1.00 0.00 ATOM 11775 H3S DPP 98 20.110 17.790 27.200 1.00 0.00 ATOM 11776 C24 DPP 98 21.400 18.050 29.010 1.00 0.00 ATOM 11777 H4R DPP 98 21.070 19.100 29.130 1.00 0.00 ATOM 11778 H4S DPP 98 22.220 17.940 28.270 1.00 0.00 ATOM 11779 C25 DPP 98 21.690 17.330 30.330 1.00 0.00 ATOM 11780 H5R DPP 98 22.250 16.400 30.100 1.00 0.00 ATOM 11781 H5S DPP 98 20.700 16.920 30.630 1.00 0.00 ATOM 11782 C26 DPP 98 22.410 18.140 31.410 1.00 0.00 ATOM 11783 H6R DPP 98 21.740 19.030 31.490 1.00 0.00 ATOM 11784 H6S DPP 98 23.340 18.560 30.970 1.00 0.00 ATOM 11785 C27 DPP 98 22.610 17.460 32.770 1.00 0.00 ATOM 11786 H7R DPP 98 21.650 17.470 33.320 1.00 0.00 ATOM 11787 H7S DPP 98 23.310 18.130 33.300 1.00 0.00 ATOM 11788 C28 DPP 98 22.860 15.950 32.750 1.00 0.00 ATOM 11789 H8R DPP 98 23.440 15.670 31.850 1.00 0.00 ATOM 11790 H8S DPP 98 21.920 15.370 32.650 1.00 0.00 ATOM 11791 C29 DPP 98 23.740 15.470 33.910 1.00 0.00 ATOM 11792 H9R DPP 98 23.630 14.380 34.050 1.00 0.00 ATOM 11793 H9S DPP 98 23.490 16.040 34.830 1.00 0.00 ATOM 11794 0C21 DPP 98 25.190 15.780 33.550 1.00 0.00 ATOM 11795 H10R DPP 98 25.260 16.850 33.280 1.00 0.00 ATOM 11796 H10S DPP 98 25.550 15.250 32.640 1.00 0.00 ATOM 11797 1C21 DPP 98 26.170 15.410 34.670 1.00 0.00 ATOM 11798 H11R DPP 98 27.200 15.510 34.270 1.00 0.00 ATOM 11799 H11S DPP 98 26.020 14.340 34.900 1.00 0.00 ATOM 11800 2C21 DPP 98 25.980 16.280 35.910 1.00 0.00 ATOM 11801 H12R DPP 98 24.970 16.130 36.350 1.00 0.00 ATOM 11802 H12S DPP 98 26.030 17.360 35.670 1.00 0.00 ATOM 11803 3C21 DPP 98 27.040 16.060 37.000 1.00 0.00 ATOM 11804 H13R DPP 98 27.160 17.000 37.580 1.00 0.00 ATOM 11805 H13S DPP 98 28.030 15.880 36.530 1.00 0.00 ATOM 11806 4C21 DPP 98 26.830 14.900 37.970 1.00 0.00 ATOM 11807 H14R DPP 98 26.700 13.980 37.350 1.00 0.00 ATOM 11808 H14S DPP 98 25.980 15.210 38.610 1.00 0.00 ATOM 11809 5C21 DPP 98 28.060 14.610 38.830 1.00 0.00 ATOM 11810 H15R DPP 98 28.390 15.480 39.430 1.00 0.00 ATOM 11811 H15S DPP 98 28.860 14.290 38.140 1.00 0.00 ATOM 11812 6C21 DPP 98 27.970 13.400 39.770 1.00 0.00 ATOM 11813 H16R DPP 98 28.940 13.350 40.310 1.00 0.00 ATOM 11814 H16S DPP 98 28.030 12.460 39.180 1.00 0.00 ATOM 11815 H16T DPP 98 27.110 13.410 40.460 1.00 0.00 ATOM 11816 C33 DPP 98 17.370 14.030 31.560 1.00 0.00 ATOM 11817 H3X DPP 98 16.740 13.540 32.340 1.00 0.00 ATOM 11818 H3Y DPP 98 16.650 14.470 30.840 1.00 0.00 ATOM 11819 C34 DPP 98 18.410 15.020 32.070 1.00 0.00 ATOM 11820 H4X DPP 98 19.110 15.240 31.230 1.00 0.00 ATOM 11821 H4Y DPP 98 19.170 14.640 32.790 1.00 0.00 ATOM 11822 C35 DPP 98 17.840 16.280 32.730 1.00 0.00 ATOM 11823 H5X DPP 98 17.280 15.890 33.610 1.00 0.00 ATOM 11824 H5Y DPP 98 17.150 16.730 31.970 1.00 0.00 ATOM 11825 C36 DPP 98 18.990 17.200 33.130 1.00 0.00 ATOM 11826 H6X DPP 98 19.510 17.540 32.220 1.00 0.00 ATOM 11827 H6Y DPP 98 19.700 16.680 33.810 1.00 0.00 ATOM 11828 C37 DPP 98 18.380 18.400 33.870 1.00 0.00 ATOM 11829 H7X DPP 98 18.220 18.100 34.930 1.00 0.00 ATOM 11830 H7Y DPP 98 17.390 18.670 33.440 1.00 0.00 ATOM 11831 C38 DPP 98 19.230 19.670 33.860 1.00 0.00 ATOM 11832 H8X DPP 98 20.320 19.590 34.050 1.00 0.00 ATOM 11833 H8Y DPP 98 18.770 20.270 34.670 1.00 0.00 ATOM 11834 C39 DPP 98 19.200 20.470 32.560 1.00 0.00 ATOM 11835 H9X DPP 98 18.140 20.750 32.390 1.00 0.00 ATOM 11836 H9Y DPP 98 19.640 19.790 31.790 1.00 0.00 ATOM 11837 0C31 DPP 98 19.950 21.770 32.290 1.00 0.00 ATOM 11838 H10X DPP 98 20.010 22.000 31.200 1.00 0.00 ATOM 11839 H10Y DPP 98 20.980 21.860 32.680 1.00 0.00 ATOM 11840 1C31 DPP 98 19.290 23.030 32.860 1.00 0.00 ATOM 11841 H11X DPP 98 18.350 23.280 32.320 1.00 0.00 ATOM 11842 H11Y DPP 98 20.020 23.820 32.550 1.00 0.00 ATOM 11843 2C31 DPP 98 18.970 23.050 34.360 1.00 0.00 ATOM 11844 H12X DPP 98 18.350 22.190 34.690 1.00 0.00 ATOM 11845 H12Y DPP 98 18.460 24.010 34.580 1.00 0.00 ATOM 11846 3C31 DPP 98 20.210 22.920 35.250 1.00 0.00 ATOM 11847 H13X DPP 98 20.960 23.680 34.960 1.00 0.00 ATOM 11848 H13Y DPP 98 20.600 21.880 35.180 1.00 0.00 ATOM 11849 4C31 DPP 98 20.030 23.230 36.740 1.00 0.00 ATOM 11850 H14X DPP 98 19.270 22.540 37.170 1.00 0.00 ATOM 11851 H14Y DPP 98 19.690 24.280 36.830 1.00 0.00 ATOM 11852 5C31 DPP 98 21.310 23.050 37.560 1.00 0.00 ATOM 11853 H15X DPP 98 22.030 23.880 37.370 1.00 0.00 ATOM 11854 H15Y DPP 98 21.750 22.090 37.210 1.00 0.00 ATOM 11855 6C31 DPP 98 21.020 23.130 39.060 1.00 0.00 ATOM 11856 H16X DPP 98 20.530 23.980 39.580 1.00 0.00 ATOM 11857 H16Y DPP 98 21.900 22.880 39.680 1.00 0.00 ATOM 11858 H16Z DPP 98 20.230 22.360 39.230 1.00 0.00 ATOM 11859 N DPP 99 49.790 24.800 24.220 1.00 0.00 ATOM 11860 HN1 DPP 99 48.820 24.500 24.420 1.00 0.00 ATOM 11861 HN2 DPP 99 50.360 23.940 24.320 1.00 0.00 ATOM 11862 HN3 DPP 99 50.030 25.310 25.090 1.00 0.00 ATOM 11863 C12 DPP 99 50.000 25.520 22.910 1.00 0.00 ATOM 11864 H12A DPP 99 50.490 24.790 22.230 1.00 0.00 ATOM 11865 H12B DPP 99 49.040 25.870 22.460 1.00 0.00 ATOM 11866 C11 DPP 99 50.920 26.750 22.940 1.00 0.00 ATOM 11867 H11A DPP 99 51.890 26.400 23.340 1.00 0.00 ATOM 11868 H11B DPP 99 51.160 27.120 21.920 1.00 0.00 ATOM 11869 P DPP 99 50.930 27.930 25.210 1.00 0.00 ATOM 11870 O13 DPP 99 52.410 27.980 25.210 1.00 0.00 ATOM 11871 O14 DPP 99 50.350 26.840 26.020 1.00 0.00 ATOM 11872 O11 DPP 99 50.390 29.340 25.740 1.00 0.00 ATOM 11873 O12 DPP 99 50.420 27.850 23.700 1.00 0.00 ATOM 11874 C1 DPP 99 50.910 30.570 25.210 1.00 0.00 ATOM 11875 HA DPP 99 50.160 31.370 25.390 1.00 0.00 ATOM 11876 HB DPP 99 51.140 30.440 24.130 1.00 0.00 ATOM 11877 C2 DPP 99 52.170 30.950 25.990 1.00 0.00 ATOM 11878 HS DPP 99 52.960 30.190 25.790 1.00 0.00 ATOM 11879 O21 DPP 99 51.960 30.920 27.400 1.00 0.00 ATOM 11880 C21 DPP 99 53.110 30.860 28.070 1.00 0.00 ATOM 11881 O22 DPP 99 54.220 30.740 27.590 1.00 0.00 ATOM 11882 C22 DPP 99 52.790 30.950 29.560 1.00 0.00 ATOM 11883 H2R DPP 99 52.400 31.940 29.870 1.00 0.00 ATOM 11884 H2S DPP 99 53.730 30.880 30.140 1.00 0.00 ATOM 11885 C3 DPP 99 52.720 32.300 25.520 1.00 0.00 ATOM 11886 HX DPP 99 53.210 32.160 24.530 1.00 0.00 ATOM 11887 HY DPP 99 53.570 32.580 26.180 1.00 0.00 ATOM 11888 O31 DPP 99 51.680 33.280 25.510 1.00 0.00 ATOM 11889 C31 DPP 99 51.750 34.330 26.330 1.00 0.00 ATOM 11890 O32 DPP 99 52.570 34.530 27.210 1.00 0.00 ATOM 11891 C32 DPP 99 50.650 35.290 25.930 1.00 0.00 ATOM 11892 H2X DPP 99 49.970 34.790 25.210 1.00 0.00 ATOM 11893 H2Y DPP 99 51.030 36.220 25.450 1.00 0.00 ATOM 11894 C23 DPP 99 51.810 29.860 30.000 1.00 0.00 ATOM 11895 H3R DPP 99 52.020 28.790 29.770 1.00 0.00 ATOM 11896 H3S DPP 99 50.900 30.110 29.410 1.00 0.00 ATOM 11897 C24 DPP 99 51.370 29.870 31.460 1.00 0.00 ATOM 11898 H4R DPP 99 50.630 29.050 31.530 1.00 0.00 ATOM 11899 H4S DPP 99 50.880 30.830 31.750 1.00 0.00 ATOM 11900 C25 DPP 99 52.420 29.570 32.530 1.00 0.00 ATOM 11901 H5R DPP 99 53.170 30.390 32.400 1.00 0.00 ATOM 11902 H5S DPP 99 53.130 28.760 32.270 1.00 0.00 ATOM 11903 C26 DPP 99 51.860 29.660 33.950 1.00 0.00 ATOM 11904 H6R DPP 99 50.950 29.040 34.160 1.00 0.00 ATOM 11905 H6S DPP 99 51.680 30.750 34.000 1.00 0.00 ATOM 11906 C27 DPP 99 52.930 29.470 35.030 1.00 0.00 ATOM 11907 H7R DPP 99 53.720 30.230 34.830 1.00 0.00 ATOM 11908 H7S DPP 99 53.390 28.460 35.040 1.00 0.00 ATOM 11909 C28 DPP 99 52.320 29.600 36.420 1.00 0.00 ATOM 11910 H8R DPP 99 51.520 28.840 36.540 1.00 0.00 ATOM 11911 H8S DPP 99 51.800 30.580 36.480 1.00 0.00 ATOM 11912 C29 DPP 99 53.260 29.500 37.630 1.00 0.00 ATOM 11913 H9R DPP 99 54.060 30.220 37.340 1.00 0.00 ATOM 11914 H9S DPP 99 53.710 28.490 37.700 1.00 0.00 ATOM 11915 0C21 DPP 99 52.680 29.720 39.030 1.00 0.00 ATOM 11916 H10R DPP 99 51.940 28.930 39.290 1.00 0.00 ATOM 11917 H10S DPP 99 52.050 30.630 38.900 1.00 0.00 ATOM 11918 1C21 DPP 99 53.780 29.980 40.050 1.00 0.00 ATOM 11919 H11R DPP 99 53.510 30.680 40.870 1.00 0.00 ATOM 11920 H11S DPP 99 54.660 30.360 39.480 1.00 0.00 ATOM 11921 2C21 DPP 99 54.240 28.690 40.730 1.00 0.00 ATOM 11922 H12R DPP 99 54.480 27.960 39.930 1.00 0.00 ATOM 11923 H12S DPP 99 53.340 28.250 41.230 1.00 0.00 ATOM 11924 3C21 DPP 99 55.420 28.910 41.680 1.00 0.00 ATOM 11925 H13R DPP 99 56.370 29.070 41.140 1.00 0.00 ATOM 11926 H13S DPP 99 55.630 27.950 42.200 1.00 0.00 ATOM 11927 4C21 DPP 99 55.190 29.930 42.800 1.00 0.00 ATOM 11928 H14R DPP 99 54.320 29.750 43.470 1.00 0.00 ATOM 11929 H14S DPP 99 55.040 30.910 42.300 1.00 0.00 ATOM 11930 5C21 DPP 99 56.480 30.090 43.610 1.00 0.00 ATOM 11931 H15R DPP 99 57.360 29.930 42.960 1.00 0.00 ATOM 11932 H15S DPP 99 56.550 29.260 44.350 1.00 0.00 ATOM 11933 6C21 DPP 99 56.500 31.330 44.500 1.00 0.00 ATOM 11934 H16R DPP 99 56.220 32.150 43.810 1.00 0.00 ATOM 11935 H16S DPP 99 57.560 31.390 44.830 1.00 0.00 ATOM 11936 H16T DPP 99 55.800 31.280 45.370 1.00 0.00 ATOM 11937 C33 DPP 99 50.130 35.840 27.260 1.00 0.00 ATOM 11938 H3X DPP 99 50.910 36.540 27.640 1.00 0.00 ATOM 11939 H3Y DPP 99 49.930 35.040 28.000 1.00 0.00 ATOM 11940 C34 DPP 99 48.910 36.740 27.080 1.00 0.00 ATOM 11941 H4X DPP 99 48.110 36.200 26.550 1.00 0.00 ATOM 11942 H4Y DPP 99 49.330 37.520 26.410 1.00 0.00 ATOM 11943 C35 DPP 99 48.260 37.310 28.350 1.00 0.00 ATOM 11944 H5X DPP 99 48.030 36.680 29.230 1.00 0.00 ATOM 11945 H5Y DPP 99 47.300 37.760 28.030 1.00 0.00 ATOM 11946 C36 DPP 99 49.090 38.470 28.910 1.00 0.00 ATOM 11947 H6X DPP 99 49.260 39.020 27.960 1.00 0.00 ATOM 11948 H6Y DPP 99 50.040 38.180 29.390 1.00 0.00 ATOM 11949 C37 DPP 99 48.140 39.370 29.700 1.00 0.00 ATOM 11950 H7X DPP 99 47.870 38.710 30.560 1.00 0.00 ATOM 11951 H7Y DPP 99 47.260 39.560 29.050 1.00 0.00 ATOM 11952 C38 DPP 99 48.750 40.700 30.120 1.00 0.00 ATOM 11953 H8X DPP 99 48.440 41.500 29.410 1.00 0.00 ATOM 11954 H8Y DPP 99 49.860 40.620 30.100 1.00 0.00 ATOM 11955 C39 DPP 99 48.230 41.310 31.420 1.00 0.00 ATOM 11956 H9X DPP 99 47.150 41.530 31.310 1.00 0.00 ATOM 11957 H9Y DPP 99 48.610 42.350 31.510 1.00 0.00 ATOM 11958 0C31 DPP 99 48.300 40.450 32.690 1.00 0.00 ATOM 11959 H10X DPP 99 49.330 40.540 33.070 1.00 0.00 ATOM 11960 H10Y DPP 99 48.090 39.380 32.430 1.00 0.00 ATOM 11961 1C31 DPP 99 47.270 40.880 33.730 1.00 0.00 ATOM 11962 H11X DPP 99 46.280 40.680 33.270 1.00 0.00 ATOM 11963 H11Y DPP 99 47.420 41.920 34.070 1.00 0.00 ATOM 11964 2C31 DPP 99 47.320 40.060 35.030 1.00 0.00 ATOM 11965 H12X DPP 99 48.200 40.440 35.590 1.00 0.00 ATOM 11966 H12Y DPP 99 47.540 39.020 34.720 1.00 0.00 ATOM 11967 3C31 DPP 99 46.010 40.120 35.820 1.00 0.00 ATOM 11968 H13X DPP 99 45.060 39.700 35.430 1.00 0.00 ATOM 11969 H13Y DPP 99 45.950 41.180 36.140 1.00 0.00 ATOM 11970 4C31 DPP 99 46.380 39.470 37.150 1.00 0.00 ATOM 11971 H14X DPP 99 47.200 39.970 37.720 1.00 0.00 ATOM 11972 H14Y DPP 99 46.890 38.540 36.820 1.00 0.00 ATOM 11973 5C31 DPP 99 45.200 39.340 38.110 1.00 0.00 ATOM 11974 H15X DPP 99 44.640 40.300 38.210 1.00 0.00 ATOM 11975 H15Y DPP 99 45.650 38.950 39.050 1.00 0.00 ATOM 11976 6C31 DPP 99 44.200 38.250 37.700 1.00 0.00 ATOM 11977 H16X DPP 99 43.340 38.410 38.380 1.00 0.00 ATOM 11978 H16Y DPP 99 44.600 37.230 37.890 1.00 0.00 ATOM 11979 H16Z DPP 99 43.840 38.270 36.650 1.00 0.00 ATOM 11980 N DPP 100 39.660 44.020 18.620 1.00 0.00 ATOM 11981 HN1 DPP 100 40.220 44.760 18.150 1.00 0.00 ATOM 11982 HN2 DPP 100 38.690 44.390 18.710 1.00 0.00 ATOM 11983 HN3 DPP 100 40.120 44.050 19.550 1.00 0.00 ATOM 11984 C12 DPP 100 39.830 42.630 18.050 1.00 0.00 ATOM 11985 H12A DPP 100 40.890 42.390 18.260 1.00 0.00 ATOM 11986 H12B DPP 100 39.660 42.640 16.950 1.00 0.00 ATOM 11987 C11 DPP 100 38.800 41.670 18.640 1.00 0.00 ATOM 11988 H11A DPP 100 38.950 40.610 18.340 1.00 0.00 ATOM 11989 H11B DPP 100 37.810 41.910 18.200 1.00 0.00 ATOM 11990 P DPP 100 37.900 40.640 20.820 1.00 0.00 ATOM 11991 O13 DPP 100 38.730 39.830 21.740 1.00 0.00 ATOM 11992 O14 DPP 100 37.140 39.710 19.960 1.00 0.00 ATOM 11993 O11 DPP 100 36.870 41.470 21.720 1.00 0.00 ATOM 11994 O12 DPP 100 38.750 41.770 20.070 1.00 0.00 ATOM 11995 C1 DPP 100 37.060 42.770 22.270 1.00 0.00 ATOM 11996 HA DPP 100 36.310 43.420 21.770 1.00 0.00 ATOM 11997 HB DPP 100 38.070 43.120 21.980 1.00 0.00 ATOM 11998 C2 DPP 100 36.830 42.800 23.800 1.00 0.00 ATOM 11999 HS DPP 100 36.730 43.870 24.070 1.00 0.00 ATOM 12000 O21 DPP 100 37.970 42.280 24.470 1.00 0.00 ATOM 12001 C21 DPP 100 38.760 43.160 25.100 1.00 0.00 ATOM 12002 O22 DPP 100 38.550 44.350 25.240 1.00 0.00 ATOM 12003 C22 DPP 100 40.000 42.530 25.710 1.00 0.00 ATOM 12004 H2R DPP 100 40.610 42.190 24.850 1.00 0.00 ATOM 12005 H2S DPP 100 39.670 41.580 26.190 1.00 0.00 ATOM 12006 C3 DPP 100 35.590 42.030 24.270 1.00 0.00 ATOM 12007 HX DPP 100 35.720 40.990 23.900 1.00 0.00 ATOM 12008 HY DPP 100 34.700 42.500 23.800 1.00 0.00 ATOM 12009 O31 DPP 100 35.410 42.100 25.690 1.00 0.00 ATOM 12010 C31 DPP 100 36.040 41.240 26.500 1.00 0.00 ATOM 12011 O32 DPP 100 36.590 40.200 26.170 1.00 0.00 ATOM 12012 C32 DPP 100 36.110 41.700 27.950 1.00 0.00 ATOM 12013 H2X DPP 100 35.080 41.740 28.350 1.00 0.00 ATOM 12014 H2Y DPP 100 36.460 42.750 28.020 1.00 0.00 ATOM 12015 C23 DPP 100 40.570 43.490 26.760 1.00 0.00 ATOM 12016 H3R DPP 100 39.890 43.730 27.600 1.00 0.00 ATOM 12017 H3S DPP 100 40.860 44.420 26.220 1.00 0.00 ATOM 12018 C24 DPP 100 41.860 42.860 27.290 1.00 0.00 ATOM 12019 H4R DPP 100 42.400 43.440 28.060 1.00 0.00 ATOM 12020 H4S DPP 100 42.650 42.750 26.510 1.00 0.00 ATOM 12021 C25 DPP 100 41.730 41.480 27.940 1.00 0.00 ATOM 12022 H5R DPP 100 42.760 41.070 27.940 1.00 0.00 ATOM 12023 H5S DPP 100 41.160 40.820 27.240 1.00 0.00 ATOM 12024 C26 DPP 100 41.080 41.550 29.320 1.00 0.00 ATOM 12025 H6R DPP 100 40.420 40.700 29.580 1.00 0.00 ATOM 12026 H6S DPP 100 40.560 42.530 29.360 1.00 0.00 ATOM 12027 C27 DPP 100 42.140 41.610 30.430 1.00 0.00 ATOM 12028 H7R DPP 100 42.750 42.410 29.950 1.00 0.00 ATOM 12029 H7S DPP 100 42.720 40.670 30.510 1.00 0.00 ATOM 12030 C28 DPP 100 41.550 41.990 31.790 1.00 0.00 ATOM 12031 H8R DPP 100 40.830 41.270 32.220 1.00 0.00 ATOM 12032 H8S DPP 100 40.980 42.940 31.660 1.00 0.00 ATOM 12033 C29 DPP 100 42.690 42.220 32.780 1.00 0.00 ATOM 12034 H9R DPP 100 43.560 42.640 32.240 1.00 0.00 ATOM 12035 H9S DPP 100 42.980 41.210 33.130 1.00 0.00 ATOM 12036 0C21 DPP 100 42.330 43.210 33.890 1.00 0.00 ATOM 12037 H10R DPP 100 41.560 42.770 34.550 1.00 0.00 ATOM 12038 H10S DPP 100 41.710 44.070 33.540 1.00 0.00 ATOM 12039 1C21 DPP 100 43.520 43.790 34.670 1.00 0.00 ATOM 12040 H11R DPP 100 44.220 44.320 34.000 1.00 0.00 ATOM 12041 H11S DPP 100 44.100 42.910 35.020 1.00 0.00 ATOM 12042 2C21 DPP 100 43.170 44.660 35.880 1.00 0.00 ATOM 12043 H12R DPP 100 43.180 43.860 36.660 1.00 0.00 ATOM 12044 H12S DPP 100 42.090 44.900 35.730 1.00 0.00 ATOM 12045 3C21 DPP 100 44.190 45.790 35.980 1.00 0.00 ATOM 12046 H13R DPP 100 44.160 46.450 35.090 1.00 0.00 ATOM 12047 H13S DPP 100 45.200 45.330 36.070 1.00 0.00 ATOM 12048 4C21 DPP 100 43.900 46.760 37.120 1.00 0.00 ATOM 12049 H14R DPP 100 44.530 46.480 37.990 1.00 0.00 ATOM 12050 H14S DPP 100 42.840 46.590 37.410 1.00 0.00 ATOM 12051 5C21 DPP 100 44.090 48.220 36.690 1.00 0.00 ATOM 12052 H15R DPP 100 43.330 48.500 35.930 1.00 0.00 ATOM 12053 H15S DPP 100 45.060 48.370 36.170 1.00 0.00 ATOM 12054 6C21 DPP 100 44.130 49.260 37.800 1.00 0.00 ATOM 12055 H16R DPP 100 44.320 50.250 37.330 1.00 0.00 ATOM 12056 H16S DPP 100 44.860 49.050 38.610 1.00 0.00 ATOM 12057 H16T DPP 100 43.130 49.250 38.290 1.00 0.00 ATOM 12058 C33 DPP 100 36.970 40.840 28.870 1.00 0.00 ATOM 12059 H3X DPP 100 37.900 40.580 28.330 1.00 0.00 ATOM 12060 H3Y DPP 100 36.520 39.830 28.980 1.00 0.00 ATOM 12061 C34 DPP 100 37.240 41.630 30.160 1.00 0.00 ATOM 12062 H4X DPP 100 37.670 42.620 29.910 1.00 0.00 ATOM 12063 H4Y DPP 100 37.880 41.000 30.820 1.00 0.00 ATOM 12064 C35 DPP 100 36.000 41.780 31.050 1.00 0.00 ATOM 12065 H5X DPP 100 35.410 40.860 31.250 1.00 0.00 ATOM 12066 H5Y DPP 100 35.300 42.440 30.500 1.00 0.00 ATOM 12067 C36 DPP 100 36.720 42.480 32.200 1.00 0.00 ATOM 12068 H6X DPP 100 37.240 43.390 31.850 1.00 0.00 ATOM 12069 H6Y DPP 100 37.610 41.980 32.640 1.00 0.00 ATOM 12070 C37 DPP 100 35.730 42.950 33.270 1.00 0.00 ATOM 12071 H7X DPP 100 34.970 43.510 32.680 1.00 0.00 ATOM 12072 H7Y DPP 100 36.320 43.650 33.900 1.00 0.00 ATOM 12073 C38 DPP 100 35.000 41.830 34.020 1.00 0.00 ATOM 12074 H8X DPP 100 35.790 41.180 34.460 1.00 0.00 ATOM 12075 H8Y DPP 100 34.380 41.240 33.310 1.00 0.00 ATOM 12076 C39 DPP 100 34.070 42.260 35.150 1.00 0.00 ATOM 12077 H9X DPP 100 33.740 41.310 35.610 1.00 0.00 ATOM 12078 H9Y DPP 100 33.200 42.800 34.710 1.00 0.00 ATOM 12079 0C31 DPP 100 34.700 43.110 36.250 1.00 0.00 ATOM 12080 H10X DPP 100 33.830 43.430 36.870 1.00 0.00 ATOM 12081 H10Y DPP 100 35.050 44.010 35.690 1.00 0.00 ATOM 12082 1C31 DPP 100 35.740 42.480 37.180 1.00 0.00 ATOM 12083 H11X DPP 100 36.270 43.420 37.450 1.00 0.00 ATOM 12084 H11Y DPP 100 36.440 41.860 36.590 1.00 0.00 ATOM 12085 2C31 DPP 100 35.250 41.710 38.410 1.00 0.00 ATOM 12086 H12X DPP 100 36.160 41.370 38.950 1.00 0.00 ATOM 12087 H12Y DPP 100 34.750 40.760 38.130 1.00 0.00 ATOM 12088 3C31 DPP 100 34.410 42.450 39.460 1.00 0.00 ATOM 12089 H13X DPP 100 33.480 42.850 39.000 1.00 0.00 ATOM 12090 H13Y DPP 100 35.030 43.280 39.870 1.00 0.00 ATOM 12091 4C31 DPP 100 34.060 41.550 40.650 1.00 0.00 ATOM 12092 H14X DPP 100 34.910 40.840 40.780 1.00 0.00 ATOM 12093 H14Y DPP 100 33.260 40.830 40.390 1.00 0.00 ATOM 12094 5C31 DPP 100 33.660 42.230 41.970 1.00 0.00 ATOM 12095 H15X DPP 100 34.600 42.730 42.260 1.00 0.00 ATOM 12096 H15Y DPP 100 33.580 41.490 42.790 1.00 0.00 ATOM 12097 6C31 DPP 100 32.420 43.110 42.010 1.00 0.00 ATOM 12098 H16X DPP 100 32.350 43.870 41.210 1.00 0.00 ATOM 12099 H16Y DPP 100 32.290 43.630 42.990 1.00 0.00 ATOM 12100 H16Z DPP 100 31.490 42.520 41.880 1.00 0.00 ATOM 12101 N DPP 101 36.210 57.670 21.300 1.00 0.00 ATOM 12102 HN1 DPP 101 35.630 57.790 22.150 1.00 0.00 ATOM 12103 HN2 DPP 101 35.850 56.740 21.000 1.00 0.00 ATOM 12104 HN3 DPP 101 37.150 57.710 21.750 1.00 0.00 ATOM 12105 C12 DPP 101 35.860 58.690 20.240 1.00 0.00 ATOM 12106 H12A DPP 101 34.770 58.570 20.020 1.00 0.00 ATOM 12107 H12B DPP 101 36.440 58.330 19.370 1.00 0.00 ATOM 12108 C11 DPP 101 36.200 60.140 20.580 1.00 0.00 ATOM 12109 H11A DPP 101 35.470 60.670 19.930 1.00 0.00 ATOM 12110 H11B DPP 101 37.270 60.280 20.310 1.00 0.00 ATOM 12111 P DPP 101 35.710 62.020 21.980 1.00 0.00 ATOM 12112 O13 DPP 101 34.290 62.180 21.580 1.00 0.00 ATOM 12113 O14 DPP 101 36.740 62.760 21.210 1.00 0.00 ATOM 12114 O11 DPP 101 35.890 62.400 23.530 1.00 0.00 ATOM 12115 O12 DPP 101 36.010 60.450 21.970 1.00 0.00 ATOM 12116 C1 DPP 101 35.650 61.450 24.570 1.00 0.00 ATOM 12117 HA DPP 101 36.380 61.470 25.410 1.00 0.00 ATOM 12118 HB DPP 101 35.740 60.370 24.340 1.00 0.00 ATOM 12119 C2 DPP 101 34.230 61.660 25.120 1.00 0.00 ATOM 12120 HS DPP 101 33.500 61.490 24.310 1.00 0.00 ATOM 12121 O21 DPP 101 34.160 62.990 25.650 1.00 0.00 ATOM 12122 C21 DPP 101 32.910 63.430 25.790 1.00 0.00 ATOM 12123 O22 DPP 101 31.910 62.730 25.670 1.00 0.00 ATOM 12124 C22 DPP 101 32.930 64.900 26.160 1.00 0.00 ATOM 12125 H2R DPP 101 32.090 65.510 25.740 1.00 0.00 ATOM 12126 H2S DPP 101 33.860 65.300 25.710 1.00 0.00 ATOM 12127 C3 DPP 101 33.900 60.580 26.160 1.00 0.00 ATOM 12128 HX DPP 101 33.860 59.530 25.790 1.00 0.00 ATOM 12129 HY DPP 101 32.940 60.860 26.640 1.00 0.00 ATOM 12130 O31 DPP 101 34.910 60.620 27.180 1.00 0.00 ATOM 12131 C31 DPP 101 35.800 59.630 27.210 1.00 0.00 ATOM 12132 O32 DPP 101 36.000 58.710 26.430 1.00 0.00 ATOM 12133 C32 DPP 101 36.610 59.950 28.460 1.00 0.00 ATOM 12134 H2X DPP 101 36.230 60.920 28.840 1.00 0.00 ATOM 12135 H2Y DPP 101 37.690 60.100 28.240 1.00 0.00 ATOM 12136 C23 DPP 101 33.140 65.160 27.650 1.00 0.00 ATOM 12137 H3R DPP 101 33.130 66.270 27.730 1.00 0.00 ATOM 12138 H3S DPP 101 34.040 64.590 27.990 1.00 0.00 ATOM 12139 C24 DPP 101 31.930 64.810 28.520 1.00 0.00 ATOM 12140 H4R DPP 101 31.940 63.700 28.590 1.00 0.00 ATOM 12141 H4S DPP 101 30.980 65.030 27.980 1.00 0.00 ATOM 12142 C25 DPP 101 32.080 65.300 29.960 1.00 0.00 ATOM 12143 H5R DPP 101 32.240 66.400 29.880 1.00 0.00 ATOM 12144 H5S DPP 101 32.940 64.830 30.470 1.00 0.00 ATOM 12145 C26 DPP 101 30.760 65.080 30.720 1.00 0.00 ATOM 12146 H6R DPP 101 29.980 65.440 30.020 1.00 0.00 ATOM 12147 H6S DPP 101 30.760 65.730 31.610 1.00 0.00 ATOM 12148 C27 DPP 101 30.400 63.660 31.160 1.00 0.00 ATOM 12149 H7R DPP 101 31.230 63.130 31.660 1.00 0.00 ATOM 12150 H7S DPP 101 30.040 63.000 30.350 1.00 0.00 ATOM 12151 C28 DPP 101 29.140 63.770 32.030 1.00 0.00 ATOM 12152 H8R DPP 101 28.380 64.370 31.490 1.00 0.00 ATOM 12153 H8S DPP 101 29.400 64.340 32.950 1.00 0.00 ATOM 12154 C29 DPP 101 28.590 62.440 32.560 1.00 0.00 ATOM 12155 H9R DPP 101 29.370 61.820 33.040 1.00 0.00 ATOM 12156 H9S DPP 101 28.340 61.800 31.680 1.00 0.00 ATOM 12157 0C21 DPP 101 27.500 62.640 33.610 1.00 0.00 ATOM 12158 H10R DPP 101 26.680 63.100 33.020 1.00 0.00 ATOM 12159 H10S DPP 101 27.790 63.310 34.440 1.00 0.00 ATOM 12160 1C21 DPP 101 27.030 61.250 34.040 1.00 0.00 ATOM 12161 H11R DPP 101 27.850 60.850 34.670 1.00 0.00 ATOM 12162 H11S DPP 101 26.950 60.510 33.210 1.00 0.00 ATOM 12163 2C21 DPP 101 25.770 61.160 34.900 1.00 0.00 ATOM 12164 H12R DPP 101 25.530 60.120 35.210 1.00 0.00 ATOM 12165 H12S DPP 101 24.980 61.560 34.230 1.00 0.00 ATOM 12166 3C21 DPP 101 25.740 61.870 36.260 1.00 0.00 ATOM 12167 H13R DPP 101 24.670 61.860 36.560 1.00 0.00 ATOM 12168 H13S DPP 101 25.860 62.960 36.070 1.00 0.00 ATOM 12169 4C21 DPP 101 26.720 61.290 37.300 1.00 0.00 ATOM 12170 H14R DPP 101 27.780 61.400 37.000 1.00 0.00 ATOM 12171 H14S DPP 101 26.530 60.200 37.370 1.00 0.00 ATOM 12172 5C21 DPP 101 26.490 62.030 38.620 1.00 0.00 ATOM 12173 H15R DPP 101 26.440 63.100 38.350 1.00 0.00 ATOM 12174 H15S DPP 101 25.500 61.670 38.960 1.00 0.00 ATOM 12175 6C21 DPP 101 27.420 61.870 39.820 1.00 0.00 ATOM 12176 H16R DPP 101 27.520 62.810 40.410 1.00 0.00 ATOM 12177 H16S DPP 101 28.490 61.730 39.540 1.00 0.00 ATOM 12178 H16T DPP 101 27.050 61.060 40.490 1.00 0.00 ATOM 12179 C33 DPP 101 36.380 58.830 29.480 1.00 0.00 ATOM 12180 H3X DPP 101 36.590 57.780 29.180 1.00 0.00 ATOM 12181 H3Y DPP 101 35.310 58.900 29.750 1.00 0.00 ATOM 12182 C34 DPP 101 37.060 59.000 30.840 1.00 0.00 ATOM 12183 H4X DPP 101 37.100 58.060 31.430 1.00 0.00 ATOM 12184 H4Y DPP 101 36.430 59.730 31.390 1.00 0.00 ATOM 12185 C35 DPP 101 38.500 59.510 30.800 1.00 0.00 ATOM 12186 H5X DPP 101 38.690 60.320 30.060 1.00 0.00 ATOM 12187 H5Y DPP 101 39.170 58.670 30.520 1.00 0.00 ATOM 12188 C36 DPP 101 39.110 59.950 32.140 1.00 0.00 ATOM 12189 H6X DPP 101 40.180 60.140 31.920 1.00 0.00 ATOM 12190 H6Y DPP 101 39.000 59.140 32.890 1.00 0.00 ATOM 12191 C37 DPP 101 38.730 61.320 32.710 1.00 0.00 ATOM 12192 H7X DPP 101 37.750 61.250 33.240 1.00 0.00 ATOM 12193 H7Y DPP 101 38.600 62.060 31.890 1.00 0.00 ATOM 12194 C38 DPP 101 39.840 61.860 33.610 1.00 0.00 ATOM 12195 H8X DPP 101 39.590 62.900 33.900 1.00 0.00 ATOM 12196 H8Y DPP 101 40.860 61.920 33.160 1.00 0.00 ATOM 12197 C39 DPP 101 40.000 60.990 34.860 1.00 0.00 ATOM 12198 H9X DPP 101 40.510 60.040 34.570 1.00 0.00 ATOM 12199 H9Y DPP 101 39.000 60.760 35.290 1.00 0.00 ATOM 12200 0C31 DPP 101 40.710 61.590 36.080 1.00 0.00 ATOM 12201 H10X DPP 101 40.730 62.690 36.190 1.00 0.00 ATOM 12202 H10Y DPP 101 41.730 61.150 36.040 1.00 0.00 ATOM 12203 1C31 DPP 101 40.020 61.210 37.390 1.00 0.00 ATOM 12204 H11X DPP 101 40.070 60.100 37.390 1.00 0.00 ATOM 12205 H11Y DPP 101 38.970 61.560 37.410 1.00 0.00 ATOM 12206 2C31 DPP 101 40.830 61.710 38.590 1.00 0.00 ATOM 12207 H12X DPP 101 40.820 62.800 38.770 1.00 0.00 ATOM 12208 H12Y DPP 101 41.880 61.440 38.330 1.00 0.00 ATOM 12209 3C31 DPP 101 40.570 60.940 39.890 1.00 0.00 ATOM 12210 H13X DPP 101 41.380 61.160 40.600 1.00 0.00 ATOM 12211 H13Y DPP 101 40.650 59.840 39.750 1.00 0.00 ATOM 12212 4C31 DPP 101 39.230 61.270 40.560 1.00 0.00 ATOM 12213 H14X DPP 101 38.900 60.440 41.220 1.00 0.00 ATOM 12214 H14Y DPP 101 38.440 61.260 39.770 1.00 0.00 ATOM 12215 5C31 DPP 101 39.200 62.670 41.150 1.00 0.00 ATOM 12216 H15X DPP 101 39.160 63.460 40.370 1.00 0.00 ATOM 12217 H15Y DPP 101 40.160 62.840 41.700 1.00 0.00 ATOM 12218 6C31 DPP 101 38.010 62.990 42.050 1.00 0.00 ATOM 12219 H16X DPP 101 38.300 62.860 43.110 1.00 0.00 ATOM 12220 H16Y DPP 101 37.110 62.360 41.860 1.00 0.00 ATOM 12221 H16Z DPP 101 37.740 64.070 42.040 1.00 0.00 ATOM 12222 N DPP 102 31.970 12.550 21.680 1.00 0.00 ATOM 12223 HN1 DPP 102 31.290 12.080 21.040 1.00 0.00 ATOM 12224 HN2 DPP 102 31.860 13.560 21.450 1.00 0.00 ATOM 12225 HN3 DPP 102 32.910 12.260 21.330 1.00 0.00 ATOM 12226 C12 DPP 102 31.990 12.400 23.180 1.00 0.00 ATOM 12227 H12A DPP 102 32.810 13.000 23.630 1.00 0.00 ATOM 12228 H12B DPP 102 32.220 11.350 23.470 1.00 0.00 ATOM 12229 C11 DPP 102 30.810 12.990 23.960 1.00 0.00 ATOM 12230 H11A DPP 102 30.900 14.090 23.870 1.00 0.00 ATOM 12231 H11B DPP 102 30.910 12.780 25.050 1.00 0.00 ATOM 12232 P DPP 102 28.270 13.410 23.410 1.00 0.00 ATOM 12233 O13 DPP 102 27.140 12.460 23.270 1.00 0.00 ATOM 12234 O14 DPP 102 28.370 14.520 22.440 1.00 0.00 ATOM 12235 O11 DPP 102 28.190 14.060 24.870 1.00 0.00 ATOM 12236 O12 DPP 102 29.570 12.480 23.460 1.00 0.00 ATOM 12237 C1 DPP 102 27.160 14.980 25.240 1.00 0.00 ATOM 12238 HA DPP 102 26.730 14.600 26.200 1.00 0.00 ATOM 12239 HB DPP 102 26.300 14.960 24.550 1.00 0.00 ATOM 12240 C2 DPP 102 27.790 16.340 25.550 1.00 0.00 ATOM 12241 HS DPP 102 28.390 16.750 24.700 1.00 0.00 ATOM 12242 O21 DPP 102 28.690 16.110 26.640 1.00 0.00 ATOM 12243 C21 DPP 102 29.510 17.110 26.950 1.00 0.00 ATOM 12244 O22 DPP 102 29.600 18.130 26.290 1.00 0.00 ATOM 12245 C22 DPP 102 30.330 16.870 28.210 1.00 0.00 ATOM 12246 H2R DPP 102 29.960 15.940 28.700 1.00 0.00 ATOM 12247 H2S DPP 102 29.960 17.580 28.980 1.00 0.00 ATOM 12248 C3 DPP 102 26.670 17.350 25.840 1.00 0.00 ATOM 12249 HX DPP 102 25.910 17.320 25.020 1.00 0.00 ATOM 12250 HY DPP 102 27.110 18.360 25.690 1.00 0.00 ATOM 12251 O31 DPP 102 25.990 17.230 27.090 1.00 0.00 ATOM 12252 C31 DPP 102 24.940 16.420 27.270 1.00 0.00 ATOM 12253 O32 DPP 102 24.460 15.800 26.340 1.00 0.00 ATOM 12254 C32 DPP 102 24.520 16.390 28.740 1.00 0.00 ATOM 12255 H2X DPP 102 23.550 15.870 28.890 1.00 0.00 ATOM 12256 H2Y DPP 102 24.340 17.420 29.110 1.00 0.00 ATOM 12257 C23 DPP 102 31.840 16.760 27.980 1.00 0.00 ATOM 12258 H3R DPP 102 32.320 17.750 27.840 1.00 0.00 ATOM 12259 H3S DPP 102 31.940 16.100 27.090 1.00 0.00 ATOM 12260 C24 DPP 102 32.480 15.970 29.120 1.00 0.00 ATOM 12261 H4R DPP 102 31.850 15.070 29.260 1.00 0.00 ATOM 12262 H4S DPP 102 32.510 16.610 30.020 1.00 0.00 ATOM 12263 C25 DPP 102 33.830 15.330 28.790 1.00 0.00 ATOM 12264 H5R DPP 102 34.560 16.120 28.500 1.00 0.00 ATOM 12265 H5S DPP 102 33.780 14.490 28.070 1.00 0.00 ATOM 12266 C26 DPP 102 34.460 14.660 30.010 1.00 0.00 ATOM 12267 H6R DPP 102 34.450 13.560 29.870 1.00 0.00 ATOM 12268 H6S DPP 102 33.750 14.900 30.840 1.00 0.00 ATOM 12269 C27 DPP 102 35.950 14.930 30.190 1.00 0.00 ATOM 12270 H7R DPP 102 36.170 16.020 30.310 1.00 0.00 ATOM 12271 H7S DPP 102 36.460 14.580 29.270 1.00 0.00 ATOM 12272 C28 DPP 102 36.660 14.430 31.450 1.00 0.00 ATOM 12273 H8R DPP 102 37.670 14.890 31.410 1.00 0.00 ATOM 12274 H8S DPP 102 36.860 13.340 31.380 1.00 0.00 ATOM 12275 C29 DPP 102 35.930 14.930 32.700 1.00 0.00 ATOM 12276 H9R DPP 102 34.840 14.740 32.750 1.00 0.00 ATOM 12277 H9S DPP 102 36.050 16.030 32.710 1.00 0.00 ATOM 12278 0C21 DPP 102 36.740 14.450 33.900 1.00 0.00 ATOM 12279 H10R DPP 102 36.310 14.940 34.810 1.00 0.00 ATOM 12280 H10S DPP 102 37.800 14.740 33.760 1.00 0.00 ATOM 12281 1C21 DPP 102 36.750 12.920 34.020 1.00 0.00 ATOM 12282 H11R DPP 102 37.430 12.380 33.340 1.00 0.00 ATOM 12283 H11S DPP 102 35.720 12.710 33.670 1.00 0.00 ATOM 12284 2C21 DPP 102 37.070 12.470 35.450 1.00 0.00 ATOM 12285 H12R DPP 102 36.400 12.860 36.240 1.00 0.00 ATOM 12286 H12S DPP 102 38.020 12.940 35.770 1.00 0.00 ATOM 12287 3C21 DPP 102 37.250 10.970 35.710 1.00 0.00 ATOM 12288 H13R DPP 102 37.760 10.600 34.790 1.00 0.00 ATOM 12289 H13S DPP 102 36.310 10.390 35.760 1.00 0.00 ATOM 12290 4C21 DPP 102 38.100 10.610 36.930 1.00 0.00 ATOM 12291 H14R DPP 102 37.460 10.510 37.830 1.00 0.00 ATOM 12292 H14S DPP 102 38.900 11.380 36.950 1.00 0.00 ATOM 12293 5C21 DPP 102 38.740 9.220 36.790 1.00 0.00 ATOM 12294 H15R DPP 102 39.410 9.080 37.670 1.00 0.00 ATOM 12295 H15S DPP 102 39.280 9.250 35.820 1.00 0.00 ATOM 12296 6C21 DPP 102 37.740 8.070 36.780 1.00 0.00 ATOM 12297 H16R DPP 102 37.230 8.060 37.760 1.00 0.00 ATOM 12298 H16S DPP 102 38.230 7.080 36.600 1.00 0.00 ATOM 12299 H16T DPP 102 37.000 8.130 35.950 1.00 0.00 ATOM 12300 C33 DPP 102 25.610 15.710 29.570 1.00 0.00 ATOM 12301 H3X DPP 102 25.510 16.010 30.630 1.00 0.00 ATOM 12302 H3Y DPP 102 26.600 16.040 29.190 1.00 0.00 ATOM 12303 C34 DPP 102 25.590 14.180 29.440 1.00 0.00 ATOM 12304 H4X DPP 102 26.540 13.810 29.890 1.00 0.00 ATOM 12305 H4Y DPP 102 25.610 13.850 28.390 1.00 0.00 ATOM 12306 C35 DPP 102 24.430 13.430 30.090 1.00 0.00 ATOM 12307 H5X DPP 102 23.460 13.780 29.690 1.00 0.00 ATOM 12308 H5Y DPP 102 24.430 13.580 31.190 1.00 0.00 ATOM 12309 C36 DPP 102 24.530 11.920 29.850 1.00 0.00 ATOM 12310 H6X DPP 102 24.450 11.760 28.750 1.00 0.00 ATOM 12311 H6Y DPP 102 23.680 11.460 30.390 1.00 0.00 ATOM 12312 C37 DPP 102 25.800 11.270 30.400 1.00 0.00 ATOM 12313 H7X DPP 102 26.660 11.580 29.770 1.00 0.00 ATOM 12314 H7Y DPP 102 25.540 10.190 30.270 1.00 0.00 ATOM 12315 C38 DPP 102 26.140 11.580 31.860 1.00 0.00 ATOM 12316 H8X DPP 102 26.280 12.640 32.140 1.00 0.00 ATOM 12317 H8Y DPP 102 27.150 11.140 31.970 1.00 0.00 ATOM 12318 C39 DPP 102 25.150 10.990 32.870 1.00 0.00 ATOM 12319 H9X DPP 102 25.010 9.900 32.710 1.00 0.00 ATOM 12320 H9Y DPP 102 24.210 11.540 32.630 1.00 0.00 ATOM 12321 0C31 DPP 102 25.540 11.400 34.290 1.00 0.00 ATOM 12322 H10X DPP 102 24.560 11.640 34.770 1.00 0.00 ATOM 12323 H10Y DPP 102 26.160 12.310 34.150 1.00 0.00 ATOM 12324 1C31 DPP 102 26.230 10.310 35.110 1.00 0.00 ATOM 12325 H11X DPP 102 27.020 9.910 34.440 1.00 0.00 ATOM 12326 H11Y DPP 102 25.540 9.440 35.170 1.00 0.00 ATOM 12327 2C31 DPP 102 27.040 10.650 36.360 1.00 0.00 ATOM 12328 H12X DPP 102 26.450 11.270 37.070 1.00 0.00 ATOM 12329 H12Y DPP 102 28.000 11.150 36.100 1.00 0.00 ATOM 12330 3C31 DPP 102 27.460 9.380 37.100 1.00 0.00 ATOM 12331 H13X DPP 102 28.120 8.850 36.380 1.00 0.00 ATOM 12332 H13Y DPP 102 26.540 8.780 37.280 1.00 0.00 ATOM 12333 4C31 DPP 102 28.170 9.590 38.440 1.00 0.00 ATOM 12334 H14X DPP 102 28.220 8.650 39.030 1.00 0.00 ATOM 12335 H14Y DPP 102 27.620 10.350 39.040 1.00 0.00 ATOM 12336 5C31 DPP 102 29.630 10.040 38.350 1.00 0.00 ATOM 12337 H15X DPP 102 29.580 11.050 37.890 1.00 0.00 ATOM 12338 H15Y DPP 102 30.200 9.330 37.710 1.00 0.00 ATOM 12339 6C31 DPP 102 30.260 10.180 39.740 1.00 0.00 ATOM 12340 H16X DPP 102 30.560 9.150 40.010 1.00 0.00 ATOM 12341 H16Y DPP 102 31.150 10.840 39.720 1.00 0.00 ATOM 12342 H16Z DPP 102 29.450 10.530 40.420 1.00 0.00 ATOM 12343 N DPP 103 42.410 56.630 19.760 1.00 0.00 ATOM 12344 HN1 DPP 103 42.050 57.600 19.660 1.00 0.00 ATOM 12345 HN2 DPP 103 42.420 56.090 18.870 1.00 0.00 ATOM 12346 HN3 DPP 103 41.810 56.140 20.450 1.00 0.00 ATOM 12347 C12 DPP 103 43.760 56.510 20.420 1.00 0.00 ATOM 12348 H12A DPP 103 43.770 57.000 21.410 1.00 0.00 ATOM 12349 H12B DPP 103 43.950 55.420 20.480 1.00 0.00 ATOM 12350 C11 DPP 103 44.840 57.220 19.600 1.00 0.00 ATOM 12351 H11A DPP 103 44.550 58.290 19.670 1.00 0.00 ATOM 12352 H11B DPP 103 44.870 57.030 18.510 1.00 0.00 ATOM 12353 P DPP 103 47.170 58.060 19.960 1.00 0.00 ATOM 12354 O13 DPP 103 47.480 58.070 18.510 1.00 0.00 ATOM 12355 O14 DPP 103 48.350 57.810 20.820 1.00 0.00 ATOM 12356 O11 DPP 103 46.410 59.380 20.440 1.00 0.00 ATOM 12357 O12 DPP 103 46.060 56.960 20.310 1.00 0.00 ATOM 12358 C1 DPP 103 47.100 60.630 20.390 1.00 0.00 ATOM 12359 HA DPP 103 46.730 61.250 19.540 1.00 0.00 ATOM 12360 HB DPP 103 48.190 60.450 20.260 1.00 0.00 ATOM 12361 C2 DPP 103 46.830 61.380 21.710 1.00 0.00 ATOM 12362 HS DPP 103 47.700 62.070 21.740 1.00 0.00 ATOM 12363 O21 DPP 103 46.770 60.540 22.860 1.00 0.00 ATOM 12364 C21 DPP 103 47.960 60.200 23.370 1.00 0.00 ATOM 12365 O22 DPP 103 49.030 60.580 22.930 1.00 0.00 ATOM 12366 C22 DPP 103 47.710 59.090 24.380 1.00 0.00 ATOM 12367 H2R DPP 103 48.740 58.830 24.730 1.00 0.00 ATOM 12368 H2S DPP 103 47.230 58.240 23.860 1.00 0.00 ATOM 12369 C3 DPP 103 45.540 62.220 21.630 1.00 0.00 ATOM 12370 HX DPP 103 44.780 61.430 21.420 1.00 0.00 ATOM 12371 HY DPP 103 45.520 62.940 20.790 1.00 0.00 ATOM 12372 O31 DPP 103 45.390 62.950 22.850 1.00 0.00 ATOM 12373 C31 DPP 103 44.730 62.450 23.890 1.00 0.00 ATOM 12374 O32 DPP 103 43.850 61.620 23.820 1.00 0.00 ATOM 12375 C32 DPP 103 45.290 63.050 25.170 1.00 0.00 ATOM 12376 H2X DPP 103 45.180 64.140 24.970 1.00 0.00 ATOM 12377 H2Y DPP 103 46.350 62.810 25.420 1.00 0.00 ATOM 12378 C23 DPP 103 46.990 59.770 25.550 1.00 0.00 ATOM 12379 H3R DPP 103 45.980 60.050 25.200 1.00 0.00 ATOM 12380 H3S DPP 103 47.500 60.710 25.870 1.00 0.00 ATOM 12381 C24 DPP 103 46.930 58.890 26.810 1.00 0.00 ATOM 12382 H4R DPP 103 46.680 57.890 26.410 1.00 0.00 ATOM 12383 H4S DPP 103 46.100 59.330 27.400 1.00 0.00 ATOM 12384 C25 DPP 103 48.260 58.880 27.570 1.00 0.00 ATOM 12385 H5R DPP 103 48.530 59.930 27.800 1.00 0.00 ATOM 12386 H5S DPP 103 49.140 58.450 27.050 1.00 0.00 ATOM 12387 C26 DPP 103 48.210 58.110 28.890 1.00 0.00 ATOM 12388 H6R DPP 103 49.280 58.060 29.200 1.00 0.00 ATOM 12389 H6S DPP 103 47.720 57.170 28.560 1.00 0.00 ATOM 12390 C27 DPP 103 47.410 58.690 30.060 1.00 0.00 ATOM 12391 H7R DPP 103 46.370 58.830 29.690 1.00 0.00 ATOM 12392 H7S DPP 103 47.820 59.690 30.290 1.00 0.00 ATOM 12393 C28 DPP 103 47.560 57.940 31.380 1.00 0.00 ATOM 12394 H8R DPP 103 48.340 57.170 31.200 1.00 0.00 ATOM 12395 H8S DPP 103 46.570 57.490 31.620 1.00 0.00 ATOM 12396 C29 DPP 103 47.970 58.770 32.600 1.00 0.00 ATOM 12397 H9R DPP 103 47.370 59.690 32.700 1.00 0.00 ATOM 12398 H9S DPP 103 49.020 59.090 32.430 1.00 0.00 ATOM 12399 0C21 DPP 103 47.980 57.870 33.840 1.00 0.00 ATOM 12400 H10R DPP 103 48.650 57.060 33.480 1.00 0.00 ATOM 12401 H10S DPP 103 46.970 57.430 33.970 1.00 0.00 ATOM 12402 1C21 DPP 103 48.530 58.460 35.150 1.00 0.00 ATOM 12403 H11R DPP 103 49.210 59.310 34.940 1.00 0.00 ATOM 12404 H11S DPP 103 49.210 57.660 35.500 1.00 0.00 ATOM 12405 2C21 DPP 103 47.480 59.000 36.120 1.00 0.00 ATOM 12406 H12R DPP 103 47.040 58.120 36.620 1.00 0.00 ATOM 12407 H12S DPP 103 46.620 59.300 35.480 1.00 0.00 ATOM 12408 3C21 DPP 103 47.920 60.010 37.180 1.00 0.00 ATOM 12409 H13R DPP 103 47.020 60.320 37.750 1.00 0.00 ATOM 12410 H13S DPP 103 48.310 60.900 36.630 1.00 0.00 ATOM 12411 4C21 DPP 103 49.200 59.720 37.960 1.00 0.00 ATOM 12412 H14R DPP 103 49.480 60.660 38.480 1.00 0.00 ATOM 12413 H14S DPP 103 50.080 59.460 37.330 1.00 0.00 ATOM 12414 5C21 DPP 103 49.170 58.570 38.980 1.00 0.00 ATOM 12415 H15R DPP 103 50.200 58.370 39.340 1.00 0.00 ATOM 12416 H15S DPP 103 48.900 57.710 38.330 1.00 0.00 ATOM 12417 6C21 DPP 103 48.110 58.880 40.030 1.00 0.00 ATOM 12418 H16R DPP 103 48.520 59.490 40.860 1.00 0.00 ATOM 12419 H16S DPP 103 47.750 57.980 40.580 1.00 0.00 ATOM 12420 H16T DPP 103 47.330 59.540 39.590 1.00 0.00 ATOM 12421 C33 DPP 103 44.440 62.410 26.280 1.00 0.00 ATOM 12422 H3X DPP 103 44.670 61.330 26.300 1.00 0.00 ATOM 12423 H3Y DPP 103 43.370 62.540 26.000 1.00 0.00 ATOM 12424 C34 DPP 103 44.720 63.000 27.660 1.00 0.00 ATOM 12425 H4X DPP 103 44.260 64.010 27.610 1.00 0.00 ATOM 12426 H4Y DPP 103 45.810 63.210 27.770 1.00 0.00 ATOM 12427 C35 DPP 103 44.170 62.100 28.770 1.00 0.00 ATOM 12428 H5X DPP 103 44.600 61.080 28.720 1.00 0.00 ATOM 12429 H5Y DPP 103 43.070 62.150 28.670 1.00 0.00 ATOM 12430 C36 DPP 103 44.450 62.690 30.150 1.00 0.00 ATOM 12431 H6X DPP 103 43.850 63.590 30.440 1.00 0.00 ATOM 12432 H6Y DPP 103 45.520 62.980 30.120 1.00 0.00 ATOM 12433 C37 DPP 103 44.160 61.690 31.270 1.00 0.00 ATOM 12434 H7X DPP 103 44.960 60.920 31.120 1.00 0.00 ATOM 12435 H7Y DPP 103 43.150 61.250 31.130 1.00 0.00 ATOM 12436 C38 DPP 103 44.340 62.350 32.640 1.00 0.00 ATOM 12437 H8X DPP 103 43.370 62.880 32.790 1.00 0.00 ATOM 12438 H8Y DPP 103 45.040 63.200 32.530 1.00 0.00 ATOM 12439 C39 DPP 103 44.710 61.450 33.820 1.00 0.00 ATOM 12440 H9X DPP 103 45.780 61.130 33.820 1.00 0.00 ATOM 12441 H9Y DPP 103 44.110 60.520 33.810 1.00 0.00 ATOM 12442 0C31 DPP 103 44.410 62.280 35.070 1.00 0.00 ATOM 12443 H10X DPP 103 43.330 62.520 35.200 1.00 0.00 ATOM 12444 H10Y DPP 103 44.870 63.280 34.940 1.00 0.00 ATOM 12445 1C31 DPP 103 44.900 61.700 36.400 1.00 0.00 ATOM 12446 H11X DPP 103 46.010 61.630 36.460 1.00 0.00 ATOM 12447 H11Y DPP 103 44.530 60.660 36.280 1.00 0.00 ATOM 12448 2C31 DPP 103 44.230 62.350 37.610 1.00 0.00 ATOM 12449 H12X DPP 103 43.370 62.960 37.250 1.00 0.00 ATOM 12450 H12Y DPP 103 43.910 61.690 38.440 1.00 0.00 ATOM 12451 3C31 DPP 103 45.100 63.410 38.280 1.00 0.00 ATOM 12452 H13X DPP 103 44.400 64.000 38.910 1.00 0.00 ATOM 12453 H13Y DPP 103 45.550 64.060 37.500 1.00 0.00 ATOM 12454 4C31 DPP 103 46.120 62.800 39.250 1.00 0.00 ATOM 12455 H14X DPP 103 46.940 62.240 38.750 1.00 0.00 ATOM 12456 H14Y DPP 103 45.590 62.250 40.060 1.00 0.00 ATOM 12457 5C31 DPP 103 46.880 63.920 39.970 1.00 0.00 ATOM 12458 H15X DPP 103 46.190 64.650 40.430 1.00 0.00 ATOM 12459 H15Y DPP 103 47.360 64.360 39.070 1.00 0.00 ATOM 12460 6C31 DPP 103 47.940 63.450 40.960 1.00 0.00 ATOM 12461 H16X DPP 103 48.490 62.520 40.670 1.00 0.00 ATOM 12462 H16Y DPP 103 47.480 63.160 41.930 1.00 0.00 ATOM 12463 H16Z DPP 103 48.710 64.240 41.070 1.00 0.00 ATOM 12464 N DPP 104 36.090 37.210 20.820 1.00 0.00 ATOM 12465 HN1 DPP 104 35.140 37.180 20.420 1.00 0.00 ATOM 12466 HN2 DPP 104 36.100 37.000 21.840 1.00 0.00 ATOM 12467 HN3 DPP 104 36.570 38.130 20.720 1.00 0.00 ATOM 12468 C12 DPP 104 37.060 36.300 20.110 1.00 0.00 ATOM 12469 H12A DPP 104 36.620 35.270 20.100 1.00 0.00 ATOM 12470 H12B DPP 104 37.090 36.620 19.050 1.00 0.00 ATOM 12471 C11 DPP 104 38.530 36.330 20.560 1.00 0.00 ATOM 12472 H11A DPP 104 38.980 37.330 20.390 1.00 0.00 ATOM 12473 H11B DPP 104 39.080 35.690 19.840 1.00 0.00 ATOM 12474 P DPP 104 39.100 34.600 22.160 1.00 0.00 ATOM 12475 O13 DPP 104 40.550 34.550 21.840 1.00 0.00 ATOM 12476 O14 DPP 104 38.230 33.710 21.350 1.00 0.00 ATOM 12477 O11 DPP 104 38.970 34.330 23.730 1.00 0.00 ATOM 12478 O12 DPP 104 38.550 36.090 21.970 1.00 0.00 ATOM 12479 C1 DPP 104 37.990 35.130 24.390 1.00 0.00 ATOM 12480 HA DPP 104 37.490 34.440 25.110 1.00 0.00 ATOM 12481 HB DPP 104 37.220 35.500 23.690 1.00 0.00 ATOM 12482 C2 DPP 104 38.670 36.210 25.250 1.00 0.00 ATOM 12483 HS DPP 104 38.910 37.060 24.580 1.00 0.00 ATOM 12484 O21 DPP 104 39.800 35.690 25.970 1.00 0.00 ATOM 12485 C21 DPP 104 40.950 36.050 25.400 1.00 0.00 ATOM 12486 O22 DPP 104 41.080 36.710 24.380 1.00 0.00 ATOM 12487 C22 DPP 104 42.110 35.530 26.230 1.00 0.00 ATOM 12488 H2R DPP 104 42.350 34.470 25.970 1.00 0.00 ATOM 12489 H2S DPP 104 41.880 35.670 27.310 1.00 0.00 ATOM 12490 C3 DPP 104 37.760 36.690 26.390 1.00 0.00 ATOM 12491 HX DPP 104 37.350 35.770 26.860 1.00 0.00 ATOM 12492 HY DPP 104 36.830 37.150 25.990 1.00 0.00 ATOM 12493 O31 DPP 104 38.440 37.580 27.290 1.00 0.00 ATOM 12494 C31 DPP 104 37.850 37.610 28.480 1.00 0.00 ATOM 12495 O32 DPP 104 36.700 37.300 28.760 1.00 0.00 ATOM 12496 C32 DPP 104 38.950 38.150 29.380 1.00 0.00 ATOM 12497 H2X DPP 104 38.660 38.990 30.050 1.00 0.00 ATOM 12498 H2Y DPP 104 39.860 38.350 28.790 1.00 0.00 ATOM 12499 C23 DPP 104 43.350 36.350 25.860 1.00 0.00 ATOM 12500 H3R DPP 104 43.370 36.550 24.770 1.00 0.00 ATOM 12501 H3S DPP 104 44.280 35.850 26.200 1.00 0.00 ATOM 12502 C24 DPP 104 43.460 37.730 26.500 1.00 0.00 ATOM 12503 H4R DPP 104 42.780 38.400 25.930 1.00 0.00 ATOM 12504 H4S DPP 104 44.410 38.250 26.240 1.00 0.00 ATOM 12505 C25 DPP 104 43.300 37.760 28.020 1.00 0.00 ATOM 12506 H5R DPP 104 42.210 37.560 28.150 1.00 0.00 ATOM 12507 H5S DPP 104 43.560 38.780 28.370 1.00 0.00 ATOM 12508 C26 DPP 104 44.170 36.720 28.730 1.00 0.00 ATOM 12509 H6R DPP 104 45.270 36.870 28.660 1.00 0.00 ATOM 12510 H6S DPP 104 43.800 35.720 28.400 1.00 0.00 ATOM 12511 C27 DPP 104 43.850 36.690 30.220 1.00 0.00 ATOM 12512 H7R DPP 104 44.130 35.710 30.660 1.00 0.00 ATOM 12513 H7S DPP 104 42.750 36.660 30.290 1.00 0.00 ATOM 12514 C28 DPP 104 44.510 37.770 31.100 1.00 0.00 ATOM 12515 H8R DPP 104 44.030 38.730 30.840 1.00 0.00 ATOM 12516 H8S DPP 104 45.590 37.900 30.910 1.00 0.00 ATOM 12517 C29 DPP 104 44.360 37.510 32.600 1.00 0.00 ATOM 12518 H9R DPP 104 43.270 37.530 32.820 1.00 0.00 ATOM 12519 H9S DPP 104 44.820 38.370 33.130 1.00 0.00 ATOM 12520 0C21 DPP 104 44.970 36.190 33.060 1.00 0.00 ATOM 12521 H10R DPP 104 44.290 35.330 32.880 1.00 0.00 ATOM 12522 H10S DPP 104 45.160 36.240 34.150 1.00 0.00 ATOM 12523 1C21 DPP 104 46.400 35.900 32.580 1.00 0.00 ATOM 12524 H11R DPP 104 47.100 36.590 33.090 1.00 0.00 ATOM 12525 H11S DPP 104 46.510 36.140 31.500 1.00 0.00 ATOM 12526 2C21 DPP 104 46.830 34.440 32.710 1.00 0.00 ATOM 12527 H12R DPP 104 46.360 33.920 31.840 1.00 0.00 ATOM 12528 H12S DPP 104 46.430 34.040 33.660 1.00 0.00 ATOM 12529 3C21 DPP 104 48.350 34.220 32.670 1.00 0.00 ATOM 12530 H13R DPP 104 48.590 33.140 32.770 1.00 0.00 ATOM 12531 H13S DPP 104 48.720 34.700 33.600 1.00 0.00 ATOM 12532 4C21 DPP 104 49.110 34.730 31.450 1.00 0.00 ATOM 12533 H14R DPP 104 48.860 35.780 31.180 1.00 0.00 ATOM 12534 H14S DPP 104 48.710 34.120 30.620 1.00 0.00 ATOM 12535 5C21 DPP 104 50.620 34.540 31.640 1.00 0.00 ATOM 12536 H15R DPP 104 50.830 33.460 31.780 1.00 0.00 ATOM 12537 H15S DPP 104 50.970 35.050 32.570 1.00 0.00 ATOM 12538 6C21 DPP 104 51.510 34.940 30.470 1.00 0.00 ATOM 12539 H16R DPP 104 52.370 35.490 30.900 1.00 0.00 ATOM 12540 H16S DPP 104 50.910 35.700 29.930 1.00 0.00 ATOM 12541 H16T DPP 104 51.740 34.160 29.700 1.00 0.00 ATOM 12542 C33 DPP 104 39.330 37.080 30.410 1.00 0.00 ATOM 12543 H3X DPP 104 39.670 36.180 29.860 1.00 0.00 ATOM 12544 H3Y DPP 104 38.400 36.770 30.920 1.00 0.00 ATOM 12545 C34 DPP 104 40.390 37.520 31.430 1.00 0.00 ATOM 12546 H4X DPP 104 41.340 37.950 31.050 1.00 0.00 ATOM 12547 H4Y DPP 104 40.740 36.580 31.920 1.00 0.00 ATOM 12548 C35 DPP 104 39.950 38.440 32.570 1.00 0.00 ATOM 12549 H5X DPP 104 39.020 39.040 32.420 1.00 0.00 ATOM 12550 H5Y DPP 104 40.790 39.170 32.630 1.00 0.00 ATOM 12551 C36 DPP 104 39.760 37.810 33.950 1.00 0.00 ATOM 12552 H6X DPP 104 40.740 37.290 33.960 1.00 0.00 ATOM 12553 H6Y DPP 104 38.930 37.080 33.900 1.00 0.00 ATOM 12554 C37 DPP 104 39.670 38.850 35.070 1.00 0.00 ATOM 12555 H7X DPP 104 39.300 38.290 35.960 1.00 0.00 ATOM 12556 H7Y DPP 104 38.890 39.590 34.820 1.00 0.00 ATOM 12557 C38 DPP 104 40.990 39.520 35.470 1.00 0.00 ATOM 12558 H8X DPP 104 41.510 40.090 34.670 1.00 0.00 ATOM 12559 H8Y DPP 104 41.770 38.820 35.840 1.00 0.00 ATOM 12560 C39 DPP 104 40.900 40.480 36.660 1.00 0.00 ATOM 12561 H9X DPP 104 40.110 41.230 36.430 1.00 0.00 ATOM 12562 H9Y DPP 104 41.880 40.990 36.720 1.00 0.00 ATOM 12563 0C31 DPP 104 40.470 39.940 38.020 1.00 0.00 ATOM 12564 H10X DPP 104 41.210 39.230 38.450 1.00 0.00 ATOM 12565 H10Y DPP 104 39.450 39.510 38.040 1.00 0.00 ATOM 12566 1C31 DPP 104 40.270 41.080 39.020 1.00 0.00 ATOM 12567 H11X DPP 104 39.920 40.560 39.930 1.00 0.00 ATOM 12568 H11Y DPP 104 39.500 41.770 38.610 1.00 0.00 ATOM 12569 2C31 DPP 104 41.420 41.940 39.570 1.00 0.00 ATOM 12570 H12X DPP 104 41.730 42.520 38.670 1.00 0.00 ATOM 12571 H12Y DPP 104 41.030 42.740 40.230 1.00 0.00 ATOM 12572 3C31 DPP 104 42.650 41.200 40.080 1.00 0.00 ATOM 12573 H13X DPP 104 43.450 41.980 40.040 1.00 0.00 ATOM 12574 H13Y DPP 104 42.920 40.480 39.270 1.00 0.00 ATOM 12575 4C31 DPP 104 42.460 40.600 41.470 1.00 0.00 ATOM 12576 H14X DPP 104 41.700 39.790 41.490 1.00 0.00 ATOM 12577 H14Y DPP 104 42.070 41.420 42.110 1.00 0.00 ATOM 12578 5C31 DPP 104 43.810 40.140 42.020 1.00 0.00 ATOM 12579 H15X DPP 104 44.700 40.720 41.700 1.00 0.00 ATOM 12580 H15Y DPP 104 44.030 39.150 41.560 1.00 0.00 ATOM 12581 6C31 DPP 104 43.830 39.990 43.540 1.00 0.00 ATOM 12582 H16X DPP 104 44.820 39.700 43.940 1.00 0.00 ATOM 12583 H16Y DPP 104 43.050 39.300 43.940 1.00 0.00 ATOM 12584 H16Z DPP 104 43.450 40.960 43.910 1.00 0.00 ATOM 12585 N DPP 105 36.140 30.210 21.460 1.00 0.00 ATOM 12586 HN1 DPP 105 37.170 30.330 21.500 1.00 0.00 ATOM 12587 HN2 DPP 105 35.920 29.740 20.570 1.00 0.00 ATOM 12588 HN3 DPP 105 35.900 31.200 21.240 1.00 0.00 ATOM 12589 C12 DPP 105 35.620 29.590 22.740 1.00 0.00 ATOM 12590 H12A DPP 105 36.000 30.170 23.600 1.00 0.00 ATOM 12591 H12B DPP 105 35.960 28.530 22.700 1.00 0.00 ATOM 12592 C11 DPP 105 34.100 29.690 22.840 1.00 0.00 ATOM 12593 H11A DPP 105 33.900 29.260 23.840 1.00 0.00 ATOM 12594 H11B DPP 105 33.580 29.010 22.140 1.00 0.00 ATOM 12595 P DPP 105 32.010 31.110 22.910 1.00 0.00 ATOM 12596 O13 DPP 105 31.360 29.920 22.320 1.00 0.00 ATOM 12597 O14 DPP 105 31.610 32.400 22.310 1.00 0.00 ATOM 12598 O11 DPP 105 31.980 31.080 24.510 1.00 0.00 ATOM 12599 O12 DPP 105 33.590 31.020 22.680 1.00 0.00 ATOM 12600 C1 DPP 105 31.790 32.350 25.130 1.00 0.00 ATOM 12601 HA DPP 105 31.380 32.150 26.140 1.00 0.00 ATOM 12602 HB DPP 105 31.110 32.930 24.460 1.00 0.00 ATOM 12603 C2 DPP 105 33.100 33.110 25.380 1.00 0.00 ATOM 12604 HS DPP 105 33.870 32.880 24.610 1.00 0.00 ATOM 12605 O21 DPP 105 33.560 32.700 26.670 1.00 0.00 ATOM 12606 C21 DPP 105 34.710 33.270 27.030 1.00 0.00 ATOM 12607 O22 DPP 105 35.510 33.920 26.380 1.00 0.00 ATOM 12608 C22 DPP 105 34.850 33.020 28.520 1.00 0.00 ATOM 12609 H2R DPP 105 35.540 32.220 28.860 1.00 0.00 ATOM 12610 H2S DPP 105 33.820 32.730 28.840 1.00 0.00 ATOM 12611 C3 DPP 105 32.820 34.620 25.290 1.00 0.00 ATOM 12612 HX DPP 105 32.280 34.750 24.320 1.00 0.00 ATOM 12613 HY DPP 105 33.730 35.250 25.370 1.00 0.00 ATOM 12614 O31 DPP 105 31.910 35.090 26.300 1.00 0.00 ATOM 12615 C31 DPP 105 31.500 36.340 26.120 1.00 0.00 ATOM 12616 O32 DPP 105 31.920 37.090 25.250 1.00 0.00 ATOM 12617 C32 DPP 105 30.510 36.740 27.210 1.00 0.00 ATOM 12618 H2X DPP 105 29.800 35.890 27.300 1.00 0.00 ATOM 12619 H2Y DPP 105 29.940 37.590 26.790 1.00 0.00 ATOM 12620 C23 DPP 105 35.220 34.380 29.120 1.00 0.00 ATOM 12621 H3R DPP 105 34.360 35.080 29.000 1.00 0.00 ATOM 12622 H3S DPP 105 36.140 34.860 28.730 1.00 0.00 ATOM 12623 C24 DPP 105 35.450 34.330 30.630 1.00 0.00 ATOM 12624 H4R DPP 105 34.620 33.700 31.020 1.00 0.00 ATOM 12625 H4S DPP 105 35.350 35.350 31.040 1.00 0.00 ATOM 12626 C25 DPP 105 36.760 33.760 31.200 1.00 0.00 ATOM 12627 H5R DPP 105 37.570 34.180 30.570 1.00 0.00 ATOM 12628 H5S DPP 105 36.820 32.660 31.040 1.00 0.00 ATOM 12629 C26 DPP 105 36.920 34.070 32.690 1.00 0.00 ATOM 12630 H6R DPP 105 35.990 33.740 33.190 1.00 0.00 ATOM 12631 H6S DPP 105 37.030 35.170 32.830 1.00 0.00 ATOM 12632 C27 DPP 105 38.070 33.400 33.440 1.00 0.00 ATOM 12633 H7R DPP 105 39.040 33.440 32.900 1.00 0.00 ATOM 12634 H7S DPP 105 37.910 32.300 33.480 1.00 0.00 ATOM 12635 C28 DPP 105 38.160 34.070 34.810 1.00 0.00 ATOM 12636 H8R DPP 105 37.280 33.760 35.410 1.00 0.00 ATOM 12637 H8S DPP 105 38.180 35.180 34.680 1.00 0.00 ATOM 12638 C29 DPP 105 39.480 33.720 35.510 1.00 0.00 ATOM 12639 H9R DPP 105 40.310 33.980 34.810 1.00 0.00 ATOM 12640 H9S DPP 105 39.480 32.620 35.650 1.00 0.00 ATOM 12641 0C21 DPP 105 39.740 34.520 36.780 1.00 0.00 ATOM 12642 H10R DPP 105 38.790 34.650 37.350 1.00 0.00 ATOM 12643 H10S DPP 105 40.130 35.540 36.560 1.00 0.00 ATOM 12644 1C21 DPP 105 40.810 34.040 37.760 1.00 0.00 ATOM 12645 H11R DPP 105 41.730 33.780 37.190 1.00 0.00 ATOM 12646 H11S DPP 105 40.380 33.140 38.260 1.00 0.00 ATOM 12647 2C21 DPP 105 41.230 35.050 38.820 1.00 0.00 ATOM 12648 H12R DPP 105 40.300 35.300 39.390 1.00 0.00 ATOM 12649 H12S DPP 105 41.670 35.940 38.320 1.00 0.00 ATOM 12650 3C21 DPP 105 42.170 34.460 39.860 1.00 0.00 ATOM 12651 H13R DPP 105 43.150 34.120 39.460 1.00 0.00 ATOM 12652 H13S DPP 105 41.710 33.510 40.210 1.00 0.00 ATOM 12653 4C21 DPP 105 42.400 35.360 41.070 1.00 0.00 ATOM 12654 H14R DPP 105 41.430 35.800 41.380 1.00 0.00 ATOM 12655 H14S DPP 105 42.980 36.260 40.780 1.00 0.00 ATOM 12656 5C21 DPP 105 43.180 34.670 42.190 1.00 0.00 ATOM 12657 H15R DPP 105 43.900 33.940 41.770 1.00 0.00 ATOM 12658 H15S DPP 105 42.400 34.020 42.650 1.00 0.00 ATOM 12659 6C21 DPP 105 43.950 35.470 43.240 1.00 0.00 ATOM 12660 H16R DPP 105 44.830 35.990 42.800 1.00 0.00 ATOM 12661 H16S DPP 105 44.350 34.820 44.050 1.00 0.00 ATOM 12662 H16T DPP 105 43.410 36.310 43.730 1.00 0.00 ATOM 12663 C33 DPP 105 31.270 36.920 28.530 1.00 0.00 ATOM 12664 H3X DPP 105 31.920 37.820 28.450 1.00 0.00 ATOM 12665 H3Y DPP 105 31.870 36.000 28.710 1.00 0.00 ATOM 12666 C34 DPP 105 30.370 37.070 29.750 1.00 0.00 ATOM 12667 H4X DPP 105 29.940 36.080 30.040 1.00 0.00 ATOM 12668 H4Y DPP 105 29.570 37.830 29.640 1.00 0.00 ATOM 12669 C35 DPP 105 31.300 37.440 30.910 1.00 0.00 ATOM 12670 H5X DPP 105 30.690 37.410 31.840 1.00 0.00 ATOM 12671 H5Y DPP 105 31.510 38.520 30.730 1.00 0.00 ATOM 12672 C36 DPP 105 32.550 36.580 31.020 1.00 0.00 ATOM 12673 H6X DPP 105 33.310 36.920 30.290 1.00 0.00 ATOM 12674 H6Y DPP 105 32.350 35.520 30.760 1.00 0.00 ATOM 12675 C37 DPP 105 33.220 36.510 32.400 1.00 0.00 ATOM 12676 H7X DPP 105 33.830 35.590 32.430 1.00 0.00 ATOM 12677 H7Y DPP 105 32.570 36.320 33.280 1.00 0.00 ATOM 12678 C38 DPP 105 34.000 37.790 32.710 1.00 0.00 ATOM 12679 H8X DPP 105 33.440 38.640 32.250 1.00 0.00 ATOM 12680 H8Y DPP 105 35.040 37.810 32.330 1.00 0.00 ATOM 12681 C39 DPP 105 34.300 37.950 34.200 1.00 0.00 ATOM 12682 H9X DPP 105 33.390 37.920 34.830 1.00 0.00 ATOM 12683 H9Y DPP 105 34.730 38.970 34.220 1.00 0.00 ATOM 12684 0C31 DPP 105 35.390 37.040 34.760 1.00 0.00 ATOM 12685 H10X DPP 105 36.310 37.090 34.130 1.00 0.00 ATOM 12686 H10Y DPP 105 34.960 36.020 34.670 1.00 0.00 ATOM 12687 1C31 DPP 105 35.650 37.420 36.220 1.00 0.00 ATOM 12688 H11X DPP 105 34.950 38.140 36.700 1.00 0.00 ATOM 12689 H11Y DPP 105 36.570 38.050 36.180 1.00 0.00 ATOM 12690 2C31 DPP 105 35.880 36.180 37.070 1.00 0.00 ATOM 12691 H12X DPP 105 36.830 35.750 36.670 1.00 0.00 ATOM 12692 H12Y DPP 105 34.990 35.530 36.890 1.00 0.00 ATOM 12693 3C31 DPP 105 35.940 36.480 38.570 1.00 0.00 ATOM 12694 H13X DPP 105 35.780 35.560 39.170 1.00 0.00 ATOM 12695 H13Y DPP 105 35.110 37.190 38.750 1.00 0.00 ATOM 12696 4C31 DPP 105 37.220 37.250 38.930 1.00 0.00 ATOM 12697 H14X DPP 105 37.320 38.050 38.170 1.00 0.00 ATOM 12698 H14Y DPP 105 38.120 36.610 38.770 1.00 0.00 ATOM 12699 5C31 DPP 105 37.360 37.520 40.430 1.00 0.00 ATOM 12700 H15X DPP 105 37.220 36.640 41.090 1.00 0.00 ATOM 12701 H15Y DPP 105 36.580 38.280 40.640 1.00 0.00 ATOM 12702 6C31 DPP 105 38.740 38.040 40.850 1.00 0.00 ATOM 12703 H16X DPP 105 39.090 38.860 40.180 1.00 0.00 ATOM 12704 H16Y DPP 105 39.490 37.220 40.870 1.00 0.00 ATOM 12705 H16Z DPP 105 38.680 38.460 41.870 1.00 0.00 ATOM 12706 N DPP 106 40.750 1.160 23.340 1.00 0.00 ATOM 12707 HN1 DPP 106 40.130 1.640 22.660 1.00 0.00 ATOM 12708 HN2 DPP 106 41.670 1.630 23.420 1.00 0.00 ATOM 12709 HN3 DPP 106 40.870 0.200 22.950 1.00 0.00 ATOM 12710 C12 DPP 106 40.000 1.140 24.660 1.00 0.00 ATOM 12711 H12A DPP 106 39.120 1.780 24.450 1.00 0.00 ATOM 12712 H12B DPP 106 40.580 1.620 25.470 1.00 0.00 ATOM 12713 C11 DPP 106 39.700 -0.270 25.180 1.00 0.00 ATOM 12714 H11A DPP 106 39.070 -0.180 26.090 1.00 0.00 ATOM 12715 H11B DPP 106 40.630 -0.810 25.450 1.00 0.00 ATOM 12716 P DPP 106 39.580 -2.070 23.220 1.00 0.00 ATOM 12717 O13 DPP 106 40.840 -1.440 22.760 1.00 0.00 ATOM 12718 O14 DPP 106 38.710 -2.720 22.210 1.00 0.00 ATOM 12719 O11 DPP 106 40.020 -3.200 24.270 1.00 0.00 ATOM 12720 O12 DPP 106 38.930 -1.040 24.250 1.00 0.00 ATOM 12721 C1 DPP 106 38.970 -3.990 24.840 1.00 0.00 ATOM 12722 HA DPP 106 39.320 -5.030 24.670 1.00 0.00 ATOM 12723 HB DPP 106 37.980 -3.830 24.350 1.00 0.00 ATOM 12724 C2 DPP 106 38.800 -3.920 26.360 1.00 0.00 ATOM 12725 HS DPP 106 38.510 -2.870 26.570 1.00 0.00 ATOM 12726 O21 DPP 106 40.070 -4.220 26.950 1.00 0.00 ATOM 12727 C21 DPP 106 40.810 -3.200 27.400 1.00 0.00 ATOM 12728 O22 DPP 106 40.350 -2.120 27.730 1.00 0.00 ATOM 12729 C22 DPP 106 42.270 -3.600 27.230 1.00 0.00 ATOM 12730 H2R DPP 106 42.590 -3.100 26.290 1.00 0.00 ATOM 12731 H2S DPP 106 42.370 -4.700 27.100 1.00 0.00 ATOM 12732 C3 DPP 106 37.650 -4.800 26.880 1.00 0.00 ATOM 12733 HX DPP 106 37.710 -5.880 26.590 1.00 0.00 ATOM 12734 HY DPP 106 36.670 -4.430 26.520 1.00 0.00 ATOM 12735 O31 DPP 106 37.570 -4.940 28.300 1.00 0.00 ATOM 12736 C31 DPP 106 38.320 -5.870 28.880 1.00 0.00 ATOM 12737 O32 DPP 106 38.960 -6.750 28.320 1.00 0.00 ATOM 12738 C32 DPP 106 38.260 -5.660 30.390 1.00 0.00 ATOM 12739 H2X DPP 106 37.560 -6.390 30.830 1.00 0.00 ATOM 12740 H2Y DPP 106 38.010 -4.600 30.590 1.00 0.00 ATOM 12741 C23 DPP 106 43.150 -3.020 28.340 1.00 0.00 ATOM 12742 H3R DPP 106 43.020 -1.950 28.620 1.00 0.00 ATOM 12743 H3S DPP 106 44.180 -3.110 27.940 1.00 0.00 ATOM 12744 C24 DPP 106 42.920 -3.700 29.690 1.00 0.00 ATOM 12745 H4R DPP 106 43.190 -4.780 29.680 1.00 0.00 ATOM 12746 H4S DPP 106 41.870 -3.870 30.010 1.00 0.00 ATOM 12747 C25 DPP 106 43.530 -3.020 30.920 1.00 0.00 ATOM 12748 H5R DPP 106 43.160 -1.980 31.060 1.00 0.00 ATOM 12749 H5S DPP 106 44.620 -2.970 30.690 1.00 0.00 ATOM 12750 C26 DPP 106 43.330 -3.850 32.190 1.00 0.00 ATOM 12751 H6R DPP 106 44.100 -4.640 32.320 1.00 0.00 ATOM 12752 H6S DPP 106 42.300 -4.270 32.140 1.00 0.00 ATOM 12753 C27 DPP 106 43.410 -3.000 33.450 1.00 0.00 ATOM 12754 H7R DPP 106 42.710 -2.150 33.320 1.00 0.00 ATOM 12755 H7S DPP 106 44.430 -2.550 33.520 1.00 0.00 ATOM 12756 C28 DPP 106 43.040 -3.770 34.720 1.00 0.00 ATOM 12757 H8R DPP 106 43.890 -4.420 35.000 1.00 0.00 ATOM 12758 H8S DPP 106 42.130 -4.380 34.530 1.00 0.00 ATOM 12759 C29 DPP 106 42.710 -2.950 35.970 1.00 0.00 ATOM 12760 H9R DPP 106 41.830 -2.300 35.800 1.00 0.00 ATOM 12761 H9S DPP 106 43.430 -2.130 36.190 1.00 0.00 ATOM 12762 0C21 DPP 106 42.700 -3.810 37.230 1.00 0.00 ATOM 12763 H10R DPP 106 42.260 -4.800 36.980 1.00 0.00 ATOM 12764 H10S DPP 106 42.090 -3.360 38.050 1.00 0.00 ATOM 12765 1C21 DPP 106 44.130 -3.990 37.740 1.00 0.00 ATOM 12766 H11R DPP 106 44.870 -4.450 37.050 1.00 0.00 ATOM 12767 H11S DPP 106 44.090 -4.650 38.640 1.00 0.00 ATOM 12768 2C21 DPP 106 44.860 -2.720 38.180 1.00 0.00 ATOM 12769 H12R DPP 106 45.120 -2.030 37.350 1.00 0.00 ATOM 12770 H12S DPP 106 45.870 -3.010 38.550 1.00 0.00 ATOM 12771 3C21 DPP 106 44.300 -1.890 39.340 1.00 0.00 ATOM 12772 H13R DPP 106 43.480 -1.180 39.110 1.00 0.00 ATOM 12773 H13S DPP 106 45.240 -1.320 39.500 1.00 0.00 ATOM 12774 4C21 DPP 106 43.990 -2.630 40.640 1.00 0.00 ATOM 12775 H14R DPP 106 44.730 -3.430 40.890 1.00 0.00 ATOM 12776 H14S DPP 106 42.980 -3.090 40.710 1.00 0.00 ATOM 12777 5C21 DPP 106 44.070 -1.720 41.870 1.00 0.00 ATOM 12778 H15R DPP 106 43.930 -2.420 42.720 1.00 0.00 ATOM 12779 H15S DPP 106 43.270 -0.940 41.910 1.00 0.00 ATOM 12780 6C21 DPP 106 45.450 -1.130 42.150 1.00 0.00 ATOM 12781 H16R DPP 106 46.210 -1.930 42.260 1.00 0.00 ATOM 12782 H16S DPP 106 45.330 -0.730 43.180 1.00 0.00 ATOM 12783 H16T DPP 106 45.730 -0.410 41.350 1.00 0.00 ATOM 12784 C33 DPP 106 39.630 -6.080 30.940 1.00 0.00 ATOM 12785 H3X DPP 106 40.380 -5.410 30.470 1.00 0.00 ATOM 12786 H3Y DPP 106 39.840 -7.130 30.630 1.00 0.00 ATOM 12787 C34 DPP 106 39.740 -6.000 32.460 1.00 0.00 ATOM 12788 H4X DPP 106 40.820 -6.220 32.630 1.00 0.00 ATOM 12789 H4Y DPP 106 39.150 -6.770 33.010 1.00 0.00 ATOM 12790 C35 DPP 106 39.400 -4.620 33.020 1.00 0.00 ATOM 12791 H5X DPP 106 38.370 -4.320 32.730 1.00 0.00 ATOM 12792 H5Y DPP 106 40.170 -3.880 32.730 1.00 0.00 ATOM 12793 C36 DPP 106 39.400 -4.840 34.540 1.00 0.00 ATOM 12794 H6X DPP 106 39.680 -3.900 35.050 1.00 0.00 ATOM 12795 H6Y DPP 106 40.260 -5.500 34.760 1.00 0.00 ATOM 12796 C37 DPP 106 38.040 -5.200 35.150 1.00 0.00 ATOM 12797 H7X DPP 106 37.690 -6.090 34.580 1.00 0.00 ATOM 12798 H7Y DPP 106 37.360 -4.340 35.350 1.00 0.00 ATOM 12799 C38 DPP 106 38.120 -5.580 36.630 1.00 0.00 ATOM 12800 H8X DPP 106 38.750 -6.490 36.580 1.00 0.00 ATOM 12801 H8Y DPP 106 37.080 -5.770 36.990 1.00 0.00 ATOM 12802 C39 DPP 106 38.580 -4.580 37.690 1.00 0.00 ATOM 12803 H9X DPP 106 37.870 -3.730 37.800 1.00 0.00 ATOM 12804 H9Y DPP 106 39.590 -4.160 37.500 1.00 0.00 ATOM 12805 0C31 DPP 106 38.670 -5.120 39.120 1.00 0.00 ATOM 12806 H10X DPP 106 39.110 -6.140 39.180 1.00 0.00 ATOM 12807 H10Y DPP 106 37.620 -5.350 39.380 1.00 0.00 ATOM 12808 1C31 DPP 106 39.450 -4.250 40.110 1.00 0.00 ATOM 12809 H11X DPP 106 39.130 -3.190 40.050 1.00 0.00 ATOM 12810 H11Y DPP 106 40.550 -4.260 39.970 1.00 0.00 ATOM 12811 2C31 DPP 106 39.290 -4.720 41.560 1.00 0.00 ATOM 12812 H12X DPP 106 39.370 -5.830 41.610 1.00 0.00 ATOM 12813 H12Y DPP 106 38.250 -4.420 41.800 1.00 0.00 ATOM 12814 3C31 DPP 106 40.280 -4.160 42.590 1.00 0.00 ATOM 12815 H13X DPP 106 41.260 -4.070 42.090 1.00 0.00 ATOM 12816 H13Y DPP 106 40.170 -4.850 43.460 1.00 0.00 ATOM 12817 4C31 DPP 106 39.770 -2.810 43.110 1.00 0.00 ATOM 12818 H14X DPP 106 38.780 -2.410 43.370 1.00 0.00 ATOM 12819 H14Y DPP 106 39.990 -2.160 42.230 1.00 0.00 ATOM 12820 5C31 DPP 106 40.720 -2.190 44.130 1.00 0.00 ATOM 12821 H15X DPP 106 41.780 -2.240 43.810 1.00 0.00 ATOM 12822 H15Y DPP 106 40.690 -2.780 45.070 1.00 0.00 ATOM 12823 6C31 DPP 106 40.440 -0.710 44.430 1.00 0.00 ATOM 12824 H16X DPP 106 40.970 -0.350 45.340 1.00 0.00 ATOM 12825 H16Y DPP 106 39.340 -0.700 44.610 1.00 0.00 ATOM 12826 H16Z DPP 106 40.620 -0.150 43.490 1.00 0.00 ATOM 12827 N DPP 107 47.560 54.910 15.030 1.00 0.00 ATOM 12828 HN1 DPP 107 46.680 54.560 15.470 1.00 0.00 ATOM 12829 HN2 DPP 107 48.020 55.620 15.620 1.00 0.00 ATOM 12830 HN3 DPP 107 47.350 55.410 14.150 1.00 0.00 ATOM 12831 C12 DPP 107 48.480 53.760 14.710 1.00 0.00 ATOM 12832 H12A DPP 107 49.540 54.080 14.620 1.00 0.00 ATOM 12833 H12B DPP 107 48.110 53.220 13.810 1.00 0.00 ATOM 12834 C11 DPP 107 48.520 52.850 15.940 1.00 0.00 ATOM 12835 H11A DPP 107 49.280 53.330 16.610 1.00 0.00 ATOM 12836 H11B DPP 107 48.930 51.880 15.600 1.00 0.00 ATOM 12837 P DPP 107 47.110 51.510 17.410 1.00 0.00 ATOM 12838 O13 DPP 107 48.260 51.600 18.340 1.00 0.00 ATOM 12839 O14 DPP 107 47.150 50.250 16.630 1.00 0.00 ATOM 12840 O11 DPP 107 45.760 51.740 18.240 1.00 0.00 ATOM 12841 O12 DPP 107 47.230 52.850 16.550 1.00 0.00 ATOM 12842 C1 DPP 107 45.670 52.810 19.180 1.00 0.00 ATOM 12843 HA DPP 107 44.730 53.320 18.880 1.00 0.00 ATOM 12844 HB DPP 107 46.500 53.540 19.080 1.00 0.00 ATOM 12845 C2 DPP 107 45.350 52.360 20.620 1.00 0.00 ATOM 12846 HS DPP 107 45.360 53.250 21.280 1.00 0.00 ATOM 12847 O21 DPP 107 46.230 51.350 21.130 1.00 0.00 ATOM 12848 C21 DPP 107 47.370 51.910 21.540 1.00 0.00 ATOM 12849 O22 DPP 107 47.580 53.110 21.610 1.00 0.00 ATOM 12850 C22 DPP 107 48.290 50.830 22.080 1.00 0.00 ATOM 12851 H2R DPP 107 49.340 51.100 21.820 1.00 0.00 ATOM 12852 H2S DPP 107 48.010 49.870 21.600 1.00 0.00 ATOM 12853 C3 DPP 107 43.900 51.820 20.590 1.00 0.00 ATOM 12854 HX DPP 107 43.650 51.050 19.840 1.00 0.00 ATOM 12855 HY DPP 107 43.190 52.640 20.360 1.00 0.00 ATOM 12856 O31 DPP 107 43.450 51.250 21.820 1.00 0.00 ATOM 12857 C31 DPP 107 43.220 52.010 22.890 1.00 0.00 ATOM 12858 O32 DPP 107 43.400 53.210 23.000 1.00 0.00 ATOM 12859 C32 DPP 107 42.700 51.160 24.050 1.00 0.00 ATOM 12860 H2X DPP 107 42.250 50.190 23.750 1.00 0.00 ATOM 12861 H2Y DPP 107 41.840 51.620 24.580 1.00 0.00 ATOM 12862 C23 DPP 107 48.010 50.540 23.560 1.00 0.00 ATOM 12863 H3R DPP 107 48.740 49.730 23.760 1.00 0.00 ATOM 12864 H3S DPP 107 46.960 50.170 23.560 1.00 0.00 ATOM 12865 C24 DPP 107 48.110 51.800 24.420 1.00 0.00 ATOM 12866 H4R DPP 107 47.340 52.540 24.130 1.00 0.00 ATOM 12867 H4S DPP 107 49.120 52.250 24.380 1.00 0.00 ATOM 12868 C25 DPP 107 47.860 51.450 25.880 1.00 0.00 ATOM 12869 H5R DPP 107 48.480 50.550 26.120 1.00 0.00 ATOM 12870 H5S DPP 107 46.840 51.120 26.160 1.00 0.00 ATOM 12871 C26 DPP 107 48.150 52.580 26.880 1.00 0.00 ATOM 12872 H6R DPP 107 47.520 53.470 26.660 1.00 0.00 ATOM 12873 H6S DPP 107 49.190 52.960 26.790 1.00 0.00 ATOM 12874 C27 DPP 107 47.660 52.170 28.270 1.00 0.00 ATOM 12875 H7R DPP 107 48.400 51.550 28.810 1.00 0.00 ATOM 12876 H7S DPP 107 46.740 51.550 28.160 1.00 0.00 ATOM 12877 C28 DPP 107 47.410 53.460 29.060 1.00 0.00 ATOM 12878 H8R DPP 107 46.600 54.030 28.560 1.00 0.00 ATOM 12879 H8S DPP 107 48.370 54.010 29.090 1.00 0.00 ATOM 12880 C29 DPP 107 46.950 53.040 30.460 1.00 0.00 ATOM 12881 H9R DPP 107 47.310 52.040 30.790 1.00 0.00 ATOM 12882 H9S DPP 107 45.840 52.980 30.370 1.00 0.00 ATOM 12883 0C21 DPP 107 47.270 54.040 31.560 1.00 0.00 ATOM 12884 H10R DPP 107 46.870 55.040 31.300 1.00 0.00 ATOM 12885 H10S DPP 107 48.380 54.040 31.620 1.00 0.00 ATOM 12886 1C21 DPP 107 46.720 53.600 32.920 1.00 0.00 ATOM 12887 H11R DPP 107 46.970 52.530 33.050 1.00 0.00 ATOM 12888 H11S DPP 107 45.610 53.720 32.830 1.00 0.00 ATOM 12889 2C21 DPP 107 47.350 54.360 34.090 1.00 0.00 ATOM 12890 H12R DPP 107 47.040 55.420 33.960 1.00 0.00 ATOM 12891 H12S DPP 107 48.440 54.510 33.950 1.00 0.00 ATOM 12892 3C21 DPP 107 47.050 53.820 35.490 1.00 0.00 ATOM 12893 H13R DPP 107 47.360 52.750 35.470 1.00 0.00 ATOM 12894 H13S DPP 107 45.950 53.790 35.660 1.00 0.00 ATOM 12895 4C21 DPP 107 47.850 54.510 36.590 1.00 0.00 ATOM 12896 H14R DPP 107 47.650 55.600 36.680 1.00 0.00 ATOM 12897 H14S DPP 107 48.910 54.250 36.350 1.00 0.00 ATOM 12898 5C21 DPP 107 47.710 53.860 37.960 1.00 0.00 ATOM 12899 H15R DPP 107 48.510 54.300 38.590 1.00 0.00 ATOM 12900 H15S DPP 107 47.910 52.770 37.840 1.00 0.00 ATOM 12901 6C21 DPP 107 46.370 54.240 38.600 1.00 0.00 ATOM 12902 H16R DPP 107 46.290 53.630 39.520 1.00 0.00 ATOM 12903 H16S DPP 107 45.560 54.130 37.840 1.00 0.00 ATOM 12904 H16T DPP 107 46.320 55.270 39.000 1.00 0.00 ATOM 12905 C33 DPP 107 43.890 50.860 24.960 1.00 0.00 ATOM 12906 H3X DPP 107 44.320 51.860 25.170 1.00 0.00 ATOM 12907 H3Y DPP 107 44.650 50.260 24.420 1.00 0.00 ATOM 12908 C34 DPP 107 43.560 50.220 26.310 1.00 0.00 ATOM 12909 H4X DPP 107 44.510 50.040 26.850 1.00 0.00 ATOM 12910 H4Y DPP 107 43.090 49.230 26.170 1.00 0.00 ATOM 12911 C35 DPP 107 42.700 51.110 27.210 1.00 0.00 ATOM 12912 H5X DPP 107 41.710 51.180 26.710 1.00 0.00 ATOM 12913 H5Y DPP 107 43.120 52.130 27.080 1.00 0.00 ATOM 12914 C36 DPP 107 42.680 50.750 28.700 1.00 0.00 ATOM 12915 H6X DPP 107 43.700 50.900 29.120 1.00 0.00 ATOM 12916 H6Y DPP 107 42.760 49.650 28.640 1.00 0.00 ATOM 12917 C37 DPP 107 41.560 51.240 29.620 1.00 0.00 ATOM 12918 H7X DPP 107 40.640 51.130 29.000 1.00 0.00 ATOM 12919 H7Y DPP 107 41.780 52.310 29.810 1.00 0.00 ATOM 12920 C38 DPP 107 41.410 50.520 30.960 1.00 0.00 ATOM 12921 H8X DPP 107 42.120 49.660 31.010 1.00 0.00 ATOM 12922 H8Y DPP 107 40.350 50.210 31.040 1.00 0.00 ATOM 12923 C39 DPP 107 41.500 51.370 32.230 1.00 0.00 ATOM 12924 H9X DPP 107 41.280 50.620 33.020 1.00 0.00 ATOM 12925 H9Y DPP 107 40.640 52.070 32.370 1.00 0.00 ATOM 12926 0C31 DPP 107 42.790 52.140 32.490 1.00 0.00 ATOM 12927 H10X DPP 107 42.620 53.130 32.020 1.00 0.00 ATOM 12928 H10Y DPP 107 43.680 51.590 32.110 1.00 0.00 ATOM 12929 1C31 DPP 107 43.090 52.210 33.990 1.00 0.00 ATOM 12930 H11X DPP 107 44.010 52.740 34.310 1.00 0.00 ATOM 12931 H11Y DPP 107 43.210 51.150 34.310 1.00 0.00 ATOM 12932 2C31 DPP 107 42.000 52.930 34.790 1.00 0.00 ATOM 12933 H12X DPP 107 40.990 52.660 34.400 1.00 0.00 ATOM 12934 H12Y DPP 107 41.870 54.030 34.820 1.00 0.00 ATOM 12935 3C31 DPP 107 42.150 52.530 36.260 1.00 0.00 ATOM 12936 H13X DPP 107 43.180 52.860 36.510 1.00 0.00 ATOM 12937 H13Y DPP 107 42.160 51.440 36.440 1.00 0.00 ATOM 12938 4C31 DPP 107 41.090 53.070 37.220 1.00 0.00 ATOM 12939 H14X DPP 107 40.110 52.660 36.880 1.00 0.00 ATOM 12940 H14Y DPP 107 40.990 54.150 36.970 1.00 0.00 ATOM 12941 5C31 DPP 107 41.440 52.670 38.650 1.00 0.00 ATOM 12942 H15X DPP 107 41.380 51.590 38.870 1.00 0.00 ATOM 12943 H15Y DPP 107 40.890 53.300 39.380 1.00 0.00 ATOM 12944 6C31 DPP 107 42.870 53.060 39.050 1.00 0.00 ATOM 12945 H16X DPP 107 43.080 54.040 38.580 1.00 0.00 ATOM 12946 H16Y DPP 107 43.490 52.280 38.550 1.00 0.00 ATOM 12947 H16Z DPP 107 42.980 53.040 40.150 1.00 0.00 ATOM 12948 N DPP 108 30.090 8.870 16.390 1.00 0.00 ATOM 12949 HN1 DPP 108 30.970 9.350 16.120 1.00 0.00 ATOM 12950 HN2 DPP 108 29.320 9.200 15.770 1.00 0.00 ATOM 12951 HN3 DPP 108 29.860 9.080 17.380 1.00 0.00 ATOM 12952 C12 DPP 108 30.350 7.390 16.250 1.00 0.00 ATOM 12953 H12A DPP 108 29.420 6.780 16.310 1.00 0.00 ATOM 12954 H12B DPP 108 30.810 7.230 15.260 1.00 0.00 ATOM 12955 C11 DPP 108 31.420 7.040 17.290 1.00 0.00 ATOM 12956 H11A DPP 108 31.750 5.990 17.140 1.00 0.00 ATOM 12957 H11B DPP 108 30.870 7.110 18.260 1.00 0.00 ATOM 12958 P DPP 108 33.880 7.350 17.810 1.00 0.00 ATOM 12959 O13 DPP 108 34.840 8.460 18.030 1.00 0.00 ATOM 12960 O14 DPP 108 34.280 6.180 16.990 1.00 0.00 ATOM 12961 O11 DPP 108 33.460 6.820 19.250 1.00 0.00 ATOM 12962 O12 DPP 108 32.510 7.960 17.260 1.00 0.00 ATOM 12963 C1 DPP 108 32.980 7.720 20.260 1.00 0.00 ATOM 12964 HA DPP 108 32.030 7.310 20.640 1.00 0.00 ATOM 12965 HB DPP 108 32.730 8.730 19.870 1.00 0.00 ATOM 12966 C2 DPP 108 33.920 7.870 21.470 1.00 0.00 ATOM 12967 HS DPP 108 34.700 8.650 21.290 1.00 0.00 ATOM 12968 O21 DPP 108 34.470 6.640 21.940 1.00 0.00 ATOM 12969 C21 DPP 108 35.810 6.600 21.870 1.00 0.00 ATOM 12970 O22 DPP 108 36.520 7.520 21.520 1.00 0.00 ATOM 12971 C22 DPP 108 36.410 5.240 22.190 1.00 0.00 ATOM 12972 H2R DPP 108 37.520 5.230 22.080 1.00 0.00 ATOM 12973 H2S DPP 108 35.960 4.490 21.510 1.00 0.00 ATOM 12974 C3 DPP 108 33.100 8.420 22.650 1.00 0.00 ATOM 12975 HX DPP 108 32.290 7.660 22.750 1.00 0.00 ATOM 12976 HY DPP 108 32.610 9.400 22.520 1.00 0.00 ATOM 12977 O31 DPP 108 34.000 8.560 23.760 1.00 0.00 ATOM 12978 C31 DPP 108 33.680 7.860 24.840 1.00 0.00 ATOM 12979 O32 DPP 108 32.780 7.040 24.950 1.00 0.00 ATOM 12980 C32 DPP 108 34.490 8.430 26.000 1.00 0.00 ATOM 12981 H2X DPP 108 35.120 9.270 25.620 1.00 0.00 ATOM 12982 H2Y DPP 108 35.140 7.660 26.460 1.00 0.00 ATOM 12983 C23 DPP 108 36.280 5.000 23.700 1.00 0.00 ATOM 12984 H3R DPP 108 36.890 4.070 23.790 1.00 0.00 ATOM 12985 H3S DPP 108 35.200 4.830 23.900 1.00 0.00 ATOM 12986 C24 DPP 108 37.040 5.880 24.690 1.00 0.00 ATOM 12987 H4R DPP 108 36.670 6.920 24.540 1.00 0.00 ATOM 12988 H4S DPP 108 38.150 5.830 24.620 1.00 0.00 ATOM 12989 C25 DPP 108 36.900 5.530 26.170 1.00 0.00 ATOM 12990 H5R DPP 108 35.810 5.430 26.390 1.00 0.00 ATOM 12991 H5S DPP 108 37.230 6.470 26.660 1.00 0.00 ATOM 12992 C26 DPP 108 37.750 4.370 26.680 1.00 0.00 ATOM 12993 H6R DPP 108 38.810 4.660 26.540 1.00 0.00 ATOM 12994 H6S DPP 108 37.610 3.450 26.080 1.00 0.00 ATOM 12995 C27 DPP 108 37.230 4.000 28.070 1.00 0.00 ATOM 12996 H7R DPP 108 36.120 3.900 27.980 1.00 0.00 ATOM 12997 H7S DPP 108 37.290 4.910 28.700 1.00 0.00 ATOM 12998 C28 DPP 108 37.900 2.860 28.850 1.00 0.00 ATOM 12999 H8R DPP 108 37.700 1.880 28.370 1.00 0.00 ATOM 13000 H8S DPP 108 37.360 2.900 29.820 1.00 0.00 ATOM 13001 C29 DPP 108 39.420 2.940 29.000 1.00 0.00 ATOM 13002 H9R DPP 108 39.920 2.900 28.000 1.00 0.00 ATOM 13003 H9S DPP 108 39.740 2.070 29.620 1.00 0.00 ATOM 13004 0C21 DPP 108 39.870 4.140 29.820 1.00 0.00 ATOM 13005 H10R DPP 108 39.200 4.130 30.710 1.00 0.00 ATOM 13006 H10S DPP 108 39.690 5.110 29.310 1.00 0.00 ATOM 13007 1C21 DPP 108 41.360 4.060 30.160 1.00 0.00 ATOM 13008 H11R DPP 108 41.940 4.120 29.220 1.00 0.00 ATOM 13009 H11S DPP 108 41.510 3.050 30.590 1.00 0.00 ATOM 13010 2C21 DPP 108 41.790 5.180 31.120 1.00 0.00 ATOM 13011 H12R DPP 108 41.360 6.150 30.790 1.00 0.00 ATOM 13012 H12S DPP 108 42.900 5.180 31.030 1.00 0.00 ATOM 13013 3C21 DPP 108 41.310 5.120 32.570 1.00 0.00 ATOM 13014 H13R DPP 108 41.360 4.140 33.080 1.00 0.00 ATOM 13015 H13S DPP 108 40.330 5.580 32.790 1.00 0.00 ATOM 13016 4C21 DPP 108 42.240 5.920 33.500 1.00 0.00 ATOM 13017 H14R DPP 108 42.470 6.950 33.150 1.00 0.00 ATOM 13018 H14S DPP 108 43.240 5.450 33.410 1.00 0.00 ATOM 13019 5C21 DPP 108 41.870 5.930 34.980 1.00 0.00 ATOM 13020 H15R DPP 108 40.770 5.760 35.020 1.00 0.00 ATOM 13021 H15S DPP 108 42.080 6.970 35.330 1.00 0.00 ATOM 13022 6C21 DPP 108 42.670 4.990 35.870 1.00 0.00 ATOM 13023 H16R DPP 108 43.630 5.470 36.160 1.00 0.00 ATOM 13024 H16S DPP 108 42.960 4.090 35.280 1.00 0.00 ATOM 13025 H16T DPP 108 42.040 4.680 36.730 1.00 0.00 ATOM 13026 C33 DPP 108 33.550 9.030 27.040 1.00 0.00 ATOM 13027 H3X DPP 108 33.190 8.170 27.650 1.00 0.00 ATOM 13028 H3Y DPP 108 32.630 9.400 26.540 1.00 0.00 ATOM 13029 C34 DPP 108 34.210 10.100 27.910 1.00 0.00 ATOM 13030 H4X DPP 108 33.930 11.080 27.480 1.00 0.00 ATOM 13031 H4Y DPP 108 35.320 10.080 27.900 1.00 0.00 ATOM 13032 C35 DPP 108 33.730 10.080 29.360 1.00 0.00 ATOM 13033 H5X DPP 108 32.780 9.520 29.260 1.00 0.00 ATOM 13034 H5Y DPP 108 33.380 11.100 29.630 1.00 0.00 ATOM 13035 C36 DPP 108 34.870 9.650 30.280 1.00 0.00 ATOM 13036 H6X DPP 108 35.690 10.410 30.270 1.00 0.00 ATOM 13037 H6Y DPP 108 35.220 8.710 29.810 1.00 0.00 ATOM 13038 C37 DPP 108 34.490 9.580 31.760 1.00 0.00 ATOM 13039 H7X DPP 108 34.160 10.610 32.030 1.00 0.00 ATOM 13040 H7Y DPP 108 35.420 9.350 32.320 1.00 0.00 ATOM 13041 C38 DPP 108 33.350 8.580 32.010 1.00 0.00 ATOM 13042 H8X DPP 108 33.620 7.560 31.670 1.00 0.00 ATOM 13043 H8Y DPP 108 32.410 8.920 31.520 1.00 0.00 ATOM 13044 C39 DPP 108 33.070 8.500 33.510 1.00 0.00 ATOM 13045 H9X DPP 108 32.610 9.400 33.960 1.00 0.00 ATOM 13046 H9Y DPP 108 33.980 8.050 33.960 1.00 0.00 ATOM 13047 0C31 DPP 108 32.130 7.330 33.830 1.00 0.00 ATOM 13048 H10X DPP 108 32.550 6.390 33.410 1.00 0.00 ATOM 13049 H10Y DPP 108 31.120 7.440 33.390 1.00 0.00 ATOM 13050 1C31 DPP 108 31.670 7.130 35.270 1.00 0.00 ATOM 13051 H11X DPP 108 31.320 8.060 35.770 1.00 0.00 ATOM 13052 H11Y DPP 108 32.580 6.810 35.810 1.00 0.00 ATOM 13053 2C31 DPP 108 30.480 6.180 35.440 1.00 0.00 ATOM 13054 H12X DPP 108 30.860 5.210 35.050 1.00 0.00 ATOM 13055 H12Y DPP 108 29.640 6.410 34.750 1.00 0.00 ATOM 13056 3C31 DPP 108 29.940 6.290 36.870 1.00 0.00 ATOM 13057 H13X DPP 108 29.310 7.200 36.960 1.00 0.00 ATOM 13058 H13Y DPP 108 30.820 6.440 37.540 1.00 0.00 ATOM 13059 4C31 DPP 108 29.080 5.080 37.220 1.00 0.00 ATOM 13060 H14X DPP 108 29.800 4.380 37.680 1.00 0.00 ATOM 13061 H14Y DPP 108 28.690 4.470 36.370 1.00 0.00 ATOM 13062 5C31 DPP 108 27.910 5.260 38.180 1.00 0.00 ATOM 13063 H15X DPP 108 27.340 4.340 38.450 1.00 0.00 ATOM 13064 H15Y DPP 108 27.110 5.980 37.900 1.00 0.00 ATOM 13065 6C31 DPP 108 28.380 5.760 39.550 1.00 0.00 ATOM 13066 H16X DPP 108 27.530 5.710 40.260 1.00 0.00 ATOM 13067 H16Y DPP 108 28.780 6.790 39.450 1.00 0.00 ATOM 13068 H16Z DPP 108 29.180 5.060 39.860 1.00 0.00 ATOM 13069 N DPP 109 16.070 37.950 21.410 1.00 0.00 ATOM 13070 HN1 DPP 109 16.250 38.870 21.870 1.00 0.00 ATOM 13071 HN2 DPP 109 15.970 37.170 22.080 1.00 0.00 ATOM 13072 HN3 DPP 109 16.900 37.700 20.850 1.00 0.00 ATOM 13073 C12 DPP 109 14.840 38.010 20.530 1.00 0.00 ATOM 13074 H12A DPP 109 14.370 37.030 20.760 1.00 0.00 ATOM 13075 H12B DPP 109 15.190 38.000 19.480 1.00 0.00 ATOM 13076 C11 DPP 109 13.870 39.180 20.720 1.00 0.00 ATOM 13077 H11A DPP 109 13.080 38.920 19.980 1.00 0.00 ATOM 13078 H11B DPP 109 14.410 40.120 20.470 1.00 0.00 ATOM 13079 P DPP 109 12.500 40.520 22.450 1.00 0.00 ATOM 13080 O13 DPP 109 11.050 40.310 22.240 1.00 0.00 ATOM 13081 O14 DPP 109 13.140 41.720 21.870 1.00 0.00 ATOM 13082 O11 DPP 109 12.690 40.600 24.040 1.00 0.00 ATOM 13083 O12 DPP 109 13.350 39.220 22.060 1.00 0.00 ATOM 13084 C1 DPP 109 14.000 40.970 24.470 1.00 0.00 ATOM 13085 HA DPP 109 13.840 41.870 25.100 1.00 0.00 ATOM 13086 HB DPP 109 14.660 41.290 23.630 1.00 0.00 ATOM 13087 C2 DPP 109 14.690 39.820 25.210 1.00 0.00 ATOM 13088 HS DPP 109 14.780 39.060 24.410 1.00 0.00 ATOM 13089 O21 DPP 109 13.800 39.370 26.230 1.00 0.00 ATOM 13090 C21 DPP 109 14.020 38.080 26.500 1.00 0.00 ATOM 13091 O22 DPP 109 14.750 37.330 25.890 1.00 0.00 ATOM 13092 C22 DPP 109 13.310 37.650 27.780 1.00 0.00 ATOM 13093 H2R DPP 109 14.070 37.620 28.590 1.00 0.00 ATOM 13094 H2S DPP 109 13.110 36.560 27.690 1.00 0.00 ATOM 13095 C3 DPP 109 16.020 40.340 25.800 1.00 0.00 ATOM 13096 HX DPP 109 16.560 40.740 24.910 1.00 0.00 ATOM 13097 HY DPP 109 16.640 39.500 26.170 1.00 0.00 ATOM 13098 O31 DPP 109 15.920 41.500 26.630 1.00 0.00 ATOM 13099 C31 DPP 109 15.830 41.050 27.890 1.00 0.00 ATOM 13100 O32 DPP 109 15.610 39.900 28.250 1.00 0.00 ATOM 13101 C32 DPP 109 16.010 42.210 28.850 1.00 0.00 ATOM 13102 H2X DPP 109 15.240 43.010 28.840 1.00 0.00 ATOM 13103 H2Y DPP 109 17.000 42.690 28.670 1.00 0.00 ATOM 13104 C23 DPP 109 12.070 38.450 28.180 1.00 0.00 ATOM 13105 H3R DPP 109 11.280 38.200 27.440 1.00 0.00 ATOM 13106 H3S DPP 109 12.300 39.530 28.100 1.00 0.00 ATOM 13107 C24 DPP 109 11.750 38.060 29.630 1.00 0.00 ATOM 13108 H4R DPP 109 11.090 38.850 30.050 1.00 0.00 ATOM 13109 H4S DPP 109 12.650 37.930 30.260 1.00 0.00 ATOM 13110 C25 DPP 109 11.010 36.720 29.670 1.00 0.00 ATOM 13111 H5R DPP 109 11.680 35.900 29.320 1.00 0.00 ATOM 13112 H5S DPP 109 10.270 36.860 28.850 1.00 0.00 ATOM 13113 C26 DPP 109 10.290 36.470 30.990 1.00 0.00 ATOM 13114 H6R DPP 109 11.080 36.390 31.760 1.00 0.00 ATOM 13115 H6S DPP 109 9.750 35.490 30.990 1.00 0.00 ATOM 13116 C27 DPP 109 9.400 37.650 31.400 1.00 0.00 ATOM 13117 H7R DPP 109 8.700 37.930 30.590 1.00 0.00 ATOM 13118 H7S DPP 109 9.940 38.590 31.600 1.00 0.00 ATOM 13119 C28 DPP 109 8.630 37.260 32.670 1.00 0.00 ATOM 13120 H8R DPP 109 8.220 36.260 32.460 1.00 0.00 ATOM 13121 H8S DPP 109 7.740 37.920 32.770 1.00 0.00 ATOM 13122 C29 DPP 109 9.380 37.240 34.010 1.00 0.00 ATOM 13123 H9R DPP 109 9.890 38.200 34.210 1.00 0.00 ATOM 13124 H9S DPP 109 10.190 36.490 33.890 1.00 0.00 ATOM 13125 0C21 DPP 109 8.410 36.950 35.150 1.00 0.00 ATOM 13126 H10R DPP 109 8.290 35.840 35.110 1.00 0.00 ATOM 13127 H10S DPP 109 7.510 37.590 35.080 1.00 0.00 ATOM 13128 1C21 DPP 109 9.050 37.270 36.500 1.00 0.00 ATOM 13129 H11R DPP 109 9.150 38.370 36.630 1.00 0.00 ATOM 13130 H11S DPP 109 9.990 36.680 36.610 1.00 0.00 ATOM 13131 2C21 DPP 109 8.280 36.820 37.740 1.00 0.00 ATOM 13132 H12R DPP 109 9.160 36.830 38.430 1.00 0.00 ATOM 13133 H12S DPP 109 8.050 35.750 37.570 1.00 0.00 ATOM 13134 3C21 DPP 109 7.080 37.650 38.200 1.00 0.00 ATOM 13135 H13R DPP 109 6.230 37.510 37.500 1.00 0.00 ATOM 13136 H13S DPP 109 7.400 38.710 38.270 1.00 0.00 ATOM 13137 4C21 DPP 109 6.650 37.220 39.610 1.00 0.00 ATOM 13138 H14R DPP 109 6.480 36.120 39.560 1.00 0.00 ATOM 13139 H14S DPP 109 5.640 37.650 39.790 1.00 0.00 ATOM 13140 5C21 DPP 109 7.620 37.440 40.770 1.00 0.00 ATOM 13141 H15R DPP 109 7.930 38.480 40.960 1.00 0.00 ATOM 13142 H15S DPP 109 8.550 36.940 40.430 1.00 0.00 ATOM 13143 6C21 DPP 109 7.210 36.780 42.090 1.00 0.00 ATOM 13144 H16R DPP 109 7.640 37.460 42.850 1.00 0.00 ATOM 13145 H16S DPP 109 7.500 35.720 42.230 1.00 0.00 ATOM 13146 H16T DPP 109 6.120 36.810 42.260 1.00 0.00 ATOM 13147 C33 DPP 109 16.010 41.640 30.270 1.00 0.00 ATOM 13148 H3X DPP 109 16.720 40.810 30.440 1.00 0.00 ATOM 13149 H3Y DPP 109 15.050 41.100 30.460 1.00 0.00 ATOM 13150 C34 DPP 109 16.210 42.710 31.350 1.00 0.00 ATOM 13151 H4X DPP 109 15.340 43.400 31.250 1.00 0.00 ATOM 13152 H4Y DPP 109 17.180 43.210 31.140 1.00 0.00 ATOM 13153 C35 DPP 109 16.220 42.090 32.740 1.00 0.00 ATOM 13154 H5X DPP 109 17.170 41.540 32.930 1.00 0.00 ATOM 13155 H5Y DPP 109 15.410 41.330 32.790 1.00 0.00 ATOM 13156 C36 DPP 109 16.180 43.140 33.850 1.00 0.00 ATOM 13157 H6X DPP 109 15.260 43.750 33.850 1.00 0.00 ATOM 13158 H6Y DPP 109 16.970 43.890 33.620 1.00 0.00 ATOM 13159 C37 DPP 109 16.330 42.490 35.230 1.00 0.00 ATOM 13160 H7X DPP 109 17.160 41.760 35.250 1.00 0.00 ATOM 13161 H7Y DPP 109 15.380 41.930 35.410 1.00 0.00 ATOM 13162 C38 DPP 109 16.380 43.440 36.420 1.00 0.00 ATOM 13163 H8X DPP 109 15.430 44.010 36.430 1.00 0.00 ATOM 13164 H8Y DPP 109 17.200 44.170 36.260 1.00 0.00 ATOM 13165 C39 DPP 109 16.320 42.880 37.840 1.00 0.00 ATOM 13166 H9X DPP 109 17.000 42.000 37.830 1.00 0.00 ATOM 13167 H9Y DPP 109 15.310 42.530 38.170 1.00 0.00 ATOM 13168 0C31 DPP 109 16.700 43.820 38.990 1.00 0.00 ATOM 13169 H10X DPP 109 16.580 43.240 39.930 1.00 0.00 ATOM 13170 H10Y DPP 109 16.150 44.780 38.970 1.00 0.00 ATOM 13171 1C31 DPP 109 18.180 44.190 38.970 1.00 0.00 ATOM 13172 H11X DPP 109 18.270 45.200 39.420 1.00 0.00 ATOM 13173 H11Y DPP 109 18.610 44.360 37.960 1.00 0.00 ATOM 13174 2C31 DPP 109 19.110 43.340 39.840 1.00 0.00 ATOM 13175 H12X DPP 109 20.080 43.870 39.810 1.00 0.00 ATOM 13176 H12Y DPP 109 19.140 42.290 39.470 1.00 0.00 ATOM 13177 3C31 DPP 109 18.820 43.420 41.340 1.00 0.00 ATOM 13178 H13X DPP 109 18.000 42.690 41.550 1.00 0.00 ATOM 13179 H13Y DPP 109 18.460 44.410 41.680 1.00 0.00 ATOM 13180 4C31 DPP 109 20.010 43.130 42.250 1.00 0.00 ATOM 13181 H14X DPP 109 20.900 43.630 41.810 1.00 0.00 ATOM 13182 H14Y DPP 109 20.180 42.060 42.480 1.00 0.00 ATOM 13183 5C31 DPP 109 19.750 43.790 43.610 1.00 0.00 ATOM 13184 H15X DPP 109 18.700 43.480 43.760 1.00 0.00 ATOM 13185 H15Y DPP 109 19.740 44.890 43.430 1.00 0.00 ATOM 13186 6C31 DPP 109 20.600 43.280 44.770 1.00 0.00 ATOM 13187 H16X DPP 109 21.700 43.420 44.680 1.00 0.00 ATOM 13188 H16Y DPP 109 20.250 42.250 44.990 1.00 0.00 ATOM 13189 H16Z DPP 109 20.350 43.920 45.650 1.00 0.00 ATOM 13190 N DPP 110 55.160 19.250 23.290 1.00 0.00 ATOM 13191 HN1 DPP 110 55.540 18.870 24.190 1.00 0.00 ATOM 13192 HN2 DPP 110 54.250 19.730 23.410 1.00 0.00 ATOM 13193 HN3 DPP 110 54.820 18.420 22.770 1.00 0.00 ATOM 13194 C12 DPP 110 56.210 19.980 22.490 1.00 0.00 ATOM 13195 H12A DPP 110 55.940 19.930 21.420 1.00 0.00 ATOM 13196 H12B DPP 110 57.110 19.330 22.500 1.00 0.00 ATOM 13197 C11 DPP 110 56.570 21.330 23.110 1.00 0.00 ATOM 13198 H11A DPP 110 55.710 22.040 23.040 1.00 0.00 ATOM 13199 H11B DPP 110 57.380 21.600 22.390 1.00 0.00 ATOM 13200 P DPP 110 57.980 22.370 24.910 1.00 0.00 ATOM 13201 O13 DPP 110 57.700 23.580 24.100 1.00 0.00 ATOM 13202 O14 DPP 110 59.360 21.850 24.940 1.00 0.00 ATOM 13203 O11 DPP 110 57.490 22.600 26.420 1.00 0.00 ATOM 13204 O12 DPP 110 57.100 21.120 24.420 1.00 0.00 ATOM 13205 C1 DPP 110 58.320 23.560 27.080 1.00 0.00 ATOM 13206 HA DPP 110 58.200 24.460 26.440 1.00 0.00 ATOM 13207 HB DPP 110 59.350 23.140 27.080 1.00 0.00 ATOM 13208 C2 DPP 110 57.820 23.890 28.500 1.00 0.00 ATOM 13209 HS DPP 110 57.900 22.900 29.020 1.00 0.00 ATOM 13210 O21 DPP 110 56.480 24.390 28.510 1.00 0.00 ATOM 13211 C21 DPP 110 55.890 24.230 29.700 1.00 0.00 ATOM 13212 O22 DPP 110 56.260 23.540 30.630 1.00 0.00 ATOM 13213 C22 DPP 110 54.670 25.140 29.750 1.00 0.00 ATOM 13214 H2R DPP 110 53.890 24.890 28.990 1.00 0.00 ATOM 13215 H2S DPP 110 55.060 26.160 29.580 1.00 0.00 ATOM 13216 C3 DPP 110 58.720 24.950 29.160 1.00 0.00 ATOM 13217 HX DPP 110 58.300 25.910 28.800 1.00 0.00 ATOM 13218 HY DPP 110 59.760 24.750 28.830 1.00 0.00 ATOM 13219 O31 DPP 110 58.640 24.850 30.590 1.00 0.00 ATOM 13220 C31 DPP 110 59.320 23.870 31.190 1.00 0.00 ATOM 13221 O32 DPP 110 60.070 23.110 30.600 1.00 0.00 ATOM 13222 C32 DPP 110 58.980 23.850 32.670 1.00 0.00 ATOM 13223 H2X DPP 110 57.880 23.790 32.760 1.00 0.00 ATOM 13224 H2Y DPP 110 59.300 24.790 33.180 1.00 0.00 ATOM 13225 C23 DPP 110 54.140 25.040 31.180 1.00 0.00 ATOM 13226 H3R DPP 110 54.880 25.380 31.930 1.00 0.00 ATOM 13227 H3S DPP 110 53.900 23.960 31.290 1.00 0.00 ATOM 13228 C24 DPP 110 52.840 25.780 31.480 1.00 0.00 ATOM 13229 H4R DPP 110 52.070 25.380 30.780 1.00 0.00 ATOM 13230 H4S DPP 110 52.980 26.870 31.360 1.00 0.00 ATOM 13231 C25 DPP 110 52.230 25.640 32.880 1.00 0.00 ATOM 13232 H5R DPP 110 51.310 26.250 32.840 1.00 0.00 ATOM 13233 H5S DPP 110 52.900 26.180 33.580 1.00 0.00 ATOM 13234 C26 DPP 110 51.900 24.210 33.300 1.00 0.00 ATOM 13235 H6R DPP 110 52.830 23.620 33.460 1.00 0.00 ATOM 13236 H6S DPP 110 51.170 23.790 32.570 1.00 0.00 ATOM 13237 C27 DPP 110 51.210 24.090 34.660 1.00 0.00 ATOM 13238 H7R DPP 110 51.010 23.010 34.810 1.00 0.00 ATOM 13239 H7S DPP 110 50.380 24.820 34.570 1.00 0.00 ATOM 13240 C28 DPP 110 52.130 24.440 35.830 1.00 0.00 ATOM 13241 H8R DPP 110 52.450 25.480 35.630 1.00 0.00 ATOM 13242 H8S DPP 110 53.010 23.770 35.740 1.00 0.00 ATOM 13243 C29 DPP 110 51.500 24.280 37.210 1.00 0.00 ATOM 13244 H9R DPP 110 52.270 24.420 38.000 1.00 0.00 ATOM 13245 H9S DPP 110 51.010 23.280 37.270 1.00 0.00 ATOM 13246 0C21 DPP 110 50.340 25.250 37.460 1.00 0.00 ATOM 13247 H10R DPP 110 49.440 25.170 36.820 1.00 0.00 ATOM 13248 H10S DPP 110 50.720 26.240 37.110 1.00 0.00 ATOM 13249 1C21 DPP 110 49.810 25.130 38.890 1.00 0.00 ATOM 13250 H11R DPP 110 50.760 24.960 39.440 1.00 0.00 ATOM 13251 H11S DPP 110 49.110 24.280 39.020 1.00 0.00 ATOM 13252 2C21 DPP 110 49.160 26.450 39.320 1.00 0.00 ATOM 13253 H12R DPP 110 48.330 26.820 38.680 1.00 0.00 ATOM 13254 H12S DPP 110 49.890 27.290 39.280 1.00 0.00 ATOM 13255 3C21 DPP 110 48.490 26.460 40.700 1.00 0.00 ATOM 13256 H13R DPP 110 47.560 25.870 40.620 1.00 0.00 ATOM 13257 H13S DPP 110 48.140 27.490 40.900 1.00 0.00 ATOM 13258 4C21 DPP 110 49.340 25.950 41.870 1.00 0.00 ATOM 13259 H14R DPP 110 50.310 26.490 41.920 1.00 0.00 ATOM 13260 H14S DPP 110 49.720 24.910 41.880 1.00 0.00 ATOM 13261 5C21 DPP 110 48.610 26.210 43.190 1.00 0.00 ATOM 13262 H15R DPP 110 48.300 27.280 43.260 1.00 0.00 ATOM 13263 H15S DPP 110 49.360 26.120 44.010 1.00 0.00 ATOM 13264 6C21 DPP 110 47.500 25.190 43.430 1.00 0.00 ATOM 13265 H16R DPP 110 46.950 24.880 42.520 1.00 0.00 ATOM 13266 H16S DPP 110 46.650 25.560 44.030 1.00 0.00 ATOM 13267 H16T DPP 110 47.960 24.250 43.810 1.00 0.00 ATOM 13268 C33 DPP 110 59.800 22.800 33.420 1.00 0.00 ATOM 13269 H3X DPP 110 60.820 23.110 33.140 1.00 0.00 ATOM 13270 H3Y DPP 110 59.690 21.770 33.000 1.00 0.00 ATOM 13271 C34 DPP 110 59.670 22.900 34.940 1.00 0.00 ATOM 13272 H4X DPP 110 58.670 22.590 35.330 1.00 0.00 ATOM 13273 H4Y DPP 110 59.630 24.000 35.070 1.00 0.00 ATOM 13274 C35 DPP 110 60.810 22.320 35.780 1.00 0.00 ATOM 13275 H5X DPP 110 61.780 22.680 35.370 1.00 0.00 ATOM 13276 H5Y DPP 110 60.580 21.240 35.870 1.00 0.00 ATOM 13277 C36 DPP 110 60.900 23.010 37.150 1.00 0.00 ATOM 13278 H6X DPP 110 61.260 22.380 37.990 1.00 0.00 ATOM 13279 H6Y DPP 110 59.860 23.270 37.460 1.00 0.00 ATOM 13280 C37 DPP 110 61.690 24.320 37.160 1.00 0.00 ATOM 13281 H7X DPP 110 61.160 25.030 36.490 1.00 0.00 ATOM 13282 H7Y DPP 110 62.680 24.130 36.700 1.00 0.00 ATOM 13283 C38 DPP 110 61.870 24.920 38.550 1.00 0.00 ATOM 13284 H8X DPP 110 62.480 24.220 39.160 1.00 0.00 ATOM 13285 H8Y DPP 110 60.880 25.030 39.030 1.00 0.00 ATOM 13286 C39 DPP 110 62.530 26.300 38.510 1.00 0.00 ATOM 13287 H9X DPP 110 61.670 26.950 38.230 1.00 0.00 ATOM 13288 H9Y DPP 110 63.400 26.420 37.830 1.00 0.00 ATOM 13289 0C31 DPP 110 62.990 26.590 39.940 1.00 0.00 ATOM 13290 H10X DPP 110 63.530 25.760 40.450 1.00 0.00 ATOM 13291 H10Y DPP 110 62.150 26.890 40.610 1.00 0.00 ATOM 13292 1C31 DPP 110 63.850 27.850 40.090 1.00 0.00 ATOM 13293 H11X DPP 110 63.420 28.810 39.750 1.00 0.00 ATOM 13294 H11Y DPP 110 64.820 27.700 39.550 1.00 0.00 ATOM 13295 2C31 DPP 110 64.250 28.120 41.550 1.00 0.00 ATOM 13296 H12X DPP 110 64.430 27.080 41.910 1.00 0.00 ATOM 13297 H12Y DPP 110 63.360 28.540 42.070 1.00 0.00 ATOM 13298 3C31 DPP 110 65.310 29.200 41.770 1.00 0.00 ATOM 13299 H13X DPP 110 65.070 29.960 40.990 1.00 0.00 ATOM 13300 H13Y DPP 110 66.340 28.850 41.560 1.00 0.00 ATOM 13301 4C31 DPP 110 65.180 29.790 43.170 1.00 0.00 ATOM 13302 H14X DPP 110 64.980 29.030 43.960 1.00 0.00 ATOM 13303 H14Y DPP 110 64.360 30.550 43.170 1.00 0.00 ATOM 13304 5C31 DPP 110 66.430 30.560 43.600 1.00 0.00 ATOM 13305 H15X DPP 110 66.710 31.270 42.800 1.00 0.00 ATOM 13306 H15Y DPP 110 67.300 29.870 43.630 1.00 0.00 ATOM 13307 6C31 DPP 110 66.320 31.300 44.930 1.00 0.00 ATOM 13308 H16X DPP 110 65.760 30.620 45.610 1.00 0.00 ATOM 13309 H16Y DPP 110 65.690 32.210 44.830 1.00 0.00 ATOM 13310 H16Z DPP 110 67.290 31.710 45.290 1.00 0.00 ATOM 13311 N DPP 111 32.640 51.210 19.380 1.00 0.00 ATOM 13312 HN1 DPP 111 32.760 51.170 18.350 1.00 0.00 ATOM 13313 HN2 DPP 111 32.170 52.130 19.460 1.00 0.00 ATOM 13314 HN3 DPP 111 31.970 50.500 19.760 1.00 0.00 ATOM 13315 C12 DPP 111 33.970 51.190 20.090 1.00 0.00 ATOM 13316 H12A DPP 111 33.800 51.010 21.180 1.00 0.00 ATOM 13317 H12B DPP 111 34.500 50.360 19.590 1.00 0.00 ATOM 13318 C11 DPP 111 34.670 52.540 19.940 1.00 0.00 ATOM 13319 H11A DPP 111 35.070 52.530 18.900 1.00 0.00 ATOM 13320 H11B DPP 111 35.550 52.620 20.610 1.00 0.00 ATOM 13321 P DPP 111 33.900 54.550 21.360 1.00 0.00 ATOM 13322 O13 DPP 111 33.280 55.880 21.150 1.00 0.00 ATOM 13323 O14 DPP 111 35.300 54.650 21.800 1.00 0.00 ATOM 13324 O11 DPP 111 33.200 53.940 22.660 1.00 0.00 ATOM 13325 O12 DPP 111 33.710 53.590 20.080 1.00 0.00 ATOM 13326 C1 DPP 111 31.770 54.030 22.710 1.00 0.00 ATOM 13327 HA DPP 111 31.310 53.100 23.100 1.00 0.00 ATOM 13328 HB DPP 111 31.210 54.250 21.780 1.00 0.00 ATOM 13329 C2 DPP 111 31.350 55.140 23.690 1.00 0.00 ATOM 13330 HS DPP 111 31.540 56.080 23.120 1.00 0.00 ATOM 13331 O21 DPP 111 32.220 55.010 24.810 1.00 0.00 ATOM 13332 C21 DPP 111 32.210 56.030 25.670 1.00 0.00 ATOM 13333 O22 DPP 111 31.690 57.120 25.450 1.00 0.00 ATOM 13334 C22 DPP 111 33.100 55.750 26.870 1.00 0.00 ATOM 13335 H2R DPP 111 34.110 56.000 26.490 1.00 0.00 ATOM 13336 H2S DPP 111 33.070 54.670 27.130 1.00 0.00 ATOM 13337 C3 DPP 111 29.830 55.140 23.940 1.00 0.00 ATOM 13338 HX DPP 111 29.550 54.970 22.880 1.00 0.00 ATOM 13339 HY DPP 111 29.410 56.080 24.360 1.00 0.00 ATOM 13340 O31 DPP 111 29.430 53.980 24.670 1.00 0.00 ATOM 13341 C31 DPP 111 29.270 54.210 25.970 1.00 0.00 ATOM 13342 O32 DPP 111 29.740 55.170 26.560 1.00 0.00 ATOM 13343 C32 DPP 111 28.550 53.050 26.640 1.00 0.00 ATOM 13344 H2X DPP 111 29.010 52.050 26.510 1.00 0.00 ATOM 13345 H2Y DPP 111 27.480 53.100 26.320 1.00 0.00 ATOM 13346 C23 DPP 111 32.590 56.480 28.120 1.00 0.00 ATOM 13347 H3R DPP 111 31.500 56.290 28.240 1.00 0.00 ATOM 13348 H3S DPP 111 32.820 57.550 27.960 1.00 0.00 ATOM 13349 C24 DPP 111 33.390 56.060 29.350 1.00 0.00 ATOM 13350 H4R DPP 111 34.390 56.410 29.020 1.00 0.00 ATOM 13351 H4S DPP 111 33.470 54.950 29.420 1.00 0.00 ATOM 13352 C25 DPP 111 33.050 56.640 30.720 1.00 0.00 ATOM 13353 H5R DPP 111 32.270 55.990 31.160 1.00 0.00 ATOM 13354 H5S DPP 111 32.660 57.680 30.700 1.00 0.00 ATOM 13355 C26 DPP 111 34.200 56.670 31.740 1.00 0.00 ATOM 13356 H6R DPP 111 35.010 57.110 31.130 1.00 0.00 ATOM 13357 H6S DPP 111 34.630 55.730 32.140 1.00 0.00 ATOM 13358 C27 DPP 111 33.880 57.680 32.850 1.00 0.00 ATOM 13359 H7R DPP 111 32.950 57.430 33.400 1.00 0.00 ATOM 13360 H7S DPP 111 33.700 58.700 32.440 1.00 0.00 ATOM 13361 C28 DPP 111 35.030 57.580 33.850 1.00 0.00 ATOM 13362 H8R DPP 111 35.990 57.890 33.380 1.00 0.00 ATOM 13363 H8S DPP 111 35.290 56.570 34.230 1.00 0.00 ATOM 13364 C29 DPP 111 34.750 58.260 35.190 1.00 0.00 ATOM 13365 H9R DPP 111 33.850 57.800 35.630 1.00 0.00 ATOM 13366 H9S DPP 111 34.410 59.270 34.880 1.00 0.00 ATOM 13367 0C21 DPP 111 35.860 58.430 36.230 1.00 0.00 ATOM 13368 H10R DPP 111 36.850 58.760 35.850 1.00 0.00 ATOM 13369 H10S DPP 111 36.010 57.440 36.730 1.00 0.00 ATOM 13370 1C21 DPP 111 35.600 59.480 37.310 1.00 0.00 ATOM 13371 H11R DPP 111 36.060 59.110 38.250 1.00 0.00 ATOM 13372 H11S DPP 111 34.510 59.510 37.550 1.00 0.00 ATOM 13373 2C21 DPP 111 36.150 60.860 36.950 1.00 0.00 ATOM 13374 H12R DPP 111 35.760 61.250 35.980 1.00 0.00 ATOM 13375 H12S DPP 111 37.250 60.790 36.800 1.00 0.00 ATOM 13376 3C21 DPP 111 35.690 61.890 37.980 1.00 0.00 ATOM 13377 H13R DPP 111 36.010 61.550 38.990 1.00 0.00 ATOM 13378 H13S DPP 111 34.580 61.940 37.880 1.00 0.00 ATOM 13379 4C21 DPP 111 36.180 63.330 37.830 1.00 0.00 ATOM 13380 H14R DPP 111 36.080 63.680 36.780 1.00 0.00 ATOM 13381 H14S DPP 111 37.240 63.340 38.140 1.00 0.00 ATOM 13382 5C21 DPP 111 35.600 64.390 38.780 1.00 0.00 ATOM 13383 H15R DPP 111 35.720 63.940 39.790 1.00 0.00 ATOM 13384 H15S DPP 111 34.500 64.480 38.650 1.00 0.00 ATOM 13385 6C21 DPP 111 36.240 65.770 38.690 1.00 0.00 ATOM 13386 H16R DPP 111 35.580 66.460 39.260 1.00 0.00 ATOM 13387 H16S DPP 111 36.320 66.150 37.650 1.00 0.00 ATOM 13388 H16T DPP 111 37.210 65.950 39.210 1.00 0.00 ATOM 13389 C33 DPP 111 28.500 53.300 28.140 1.00 0.00 ATOM 13390 H3X DPP 111 27.620 52.720 28.490 1.00 0.00 ATOM 13391 H3Y DPP 111 28.300 54.380 28.320 1.00 0.00 ATOM 13392 C34 DPP 111 29.830 52.800 28.700 1.00 0.00 ATOM 13393 H4X DPP 111 30.770 53.280 28.350 1.00 0.00 ATOM 13394 H4Y DPP 111 29.820 51.700 28.570 1.00 0.00 ATOM 13395 C35 DPP 111 29.870 53.100 30.200 1.00 0.00 ATOM 13396 H5X DPP 111 29.010 52.570 30.680 1.00 0.00 ATOM 13397 H5Y DPP 111 29.690 54.180 30.380 1.00 0.00 ATOM 13398 C36 DPP 111 31.210 52.720 30.840 1.00 0.00 ATOM 13399 H6X DPP 111 31.840 53.330 30.160 1.00 0.00 ATOM 13400 H6Y DPP 111 31.400 51.630 30.700 1.00 0.00 ATOM 13401 C37 DPP 111 31.510 53.270 32.230 1.00 0.00 ATOM 13402 H7X DPP 111 30.610 52.920 32.780 1.00 0.00 ATOM 13403 H7Y DPP 111 31.530 54.380 32.240 1.00 0.00 ATOM 13404 C38 DPP 111 32.750 52.700 32.920 1.00 0.00 ATOM 13405 H8X DPP 111 33.660 53.100 32.420 1.00 0.00 ATOM 13406 H8Y DPP 111 32.670 51.660 32.540 1.00 0.00 ATOM 13407 C39 DPP 111 32.880 52.590 34.440 1.00 0.00 ATOM 13408 H9X DPP 111 33.750 51.960 34.710 1.00 0.00 ATOM 13409 H9Y DPP 111 31.990 52.010 34.770 1.00 0.00 ATOM 13410 0C31 DPP 111 33.020 53.960 35.110 1.00 0.00 ATOM 13411 H10X DPP 111 32.180 54.600 34.740 1.00 0.00 ATOM 13412 H10Y DPP 111 33.990 54.450 34.860 1.00 0.00 ATOM 13413 1C31 DPP 111 32.970 53.790 36.630 1.00 0.00 ATOM 13414 H11X DPP 111 33.800 53.060 36.760 1.00 0.00 ATOM 13415 H11Y DPP 111 32.090 53.310 37.100 1.00 0.00 ATOM 13416 2C31 DPP 111 33.140 55.050 37.470 1.00 0.00 ATOM 13417 H12X DPP 111 32.190 55.630 37.470 1.00 0.00 ATOM 13418 H12Y DPP 111 33.800 55.790 36.960 1.00 0.00 ATOM 13419 3C31 DPP 111 33.750 54.850 38.860 1.00 0.00 ATOM 13420 H13X DPP 111 34.840 54.700 38.710 1.00 0.00 ATOM 13421 H13Y DPP 111 33.440 53.830 39.200 1.00 0.00 ATOM 13422 4C31 DPP 111 33.220 55.870 39.870 1.00 0.00 ATOM 13423 H14X DPP 111 32.120 55.970 39.780 1.00 0.00 ATOM 13424 H14Y DPP 111 33.610 56.900 39.730 1.00 0.00 ATOM 13425 5C31 DPP 111 33.570 55.470 41.300 1.00 0.00 ATOM 13426 H15X DPP 111 32.890 54.650 41.610 1.00 0.00 ATOM 13427 H15Y DPP 111 33.430 56.270 42.060 1.00 0.00 ATOM 13428 6C31 DPP 111 35.040 55.080 41.470 1.00 0.00 ATOM 13429 H16X DPP 111 35.210 55.020 42.560 1.00 0.00 ATOM 13430 H16Y DPP 111 35.380 54.150 40.960 1.00 0.00 ATOM 13431 H16Z DPP 111 35.670 55.870 41.020 1.00 0.00 ATOM 13432 N DPP 112 13.470 53.950 19.260 1.00 0.00 ATOM 13433 HN1 DPP 112 13.500 54.490 18.360 1.00 0.00 ATOM 13434 HN2 DPP 112 12.890 53.100 19.210 1.00 0.00 ATOM 13435 HN3 DPP 112 13.130 54.630 19.970 1.00 0.00 ATOM 13436 C12 DPP 112 14.840 53.500 19.720 1.00 0.00 ATOM 13437 H12A DPP 112 14.790 52.390 19.840 1.00 0.00 ATOM 13438 H12B DPP 112 15.560 53.590 18.880 1.00 0.00 ATOM 13439 C11 DPP 112 15.260 54.290 20.960 1.00 0.00 ATOM 13440 H11A DPP 112 15.340 55.390 20.830 1.00 0.00 ATOM 13441 H11B DPP 112 16.190 53.830 21.360 1.00 0.00 ATOM 13442 P DPP 112 14.160 52.930 22.970 1.00 0.00 ATOM 13443 O13 DPP 112 15.400 53.110 23.760 1.00 0.00 ATOM 13444 O14 DPP 112 14.100 51.640 22.240 1.00 0.00 ATOM 13445 O11 DPP 112 12.900 53.080 23.950 1.00 0.00 ATOM 13446 O12 DPP 112 14.200 54.120 21.910 1.00 0.00 ATOM 13447 C1 DPP 112 12.680 54.350 24.580 1.00 0.00 ATOM 13448 HA DPP 112 11.680 54.100 25.010 1.00 0.00 ATOM 13449 HB DPP 112 12.530 55.160 23.840 1.00 0.00 ATOM 13450 C2 DPP 112 13.580 54.670 25.780 1.00 0.00 ATOM 13451 HS DPP 112 14.570 55.020 25.410 1.00 0.00 ATOM 13452 O21 DPP 112 13.690 53.500 26.610 1.00 0.00 ATOM 13453 C21 DPP 112 14.970 53.170 26.770 1.00 0.00 ATOM 13454 O22 DPP 112 15.950 53.880 26.630 1.00 0.00 ATOM 13455 C22 DPP 112 15.120 51.660 26.950 1.00 0.00 ATOM 13456 H2R DPP 112 15.280 51.210 25.950 1.00 0.00 ATOM 13457 H2S DPP 112 14.200 51.220 27.370 1.00 0.00 ATOM 13458 C3 DPP 112 12.880 55.770 26.590 1.00 0.00 ATOM 13459 HX DPP 112 11.830 55.410 26.590 1.00 0.00 ATOM 13460 HY DPP 112 12.900 56.700 25.980 1.00 0.00 ATOM 13461 O31 DPP 112 13.440 55.960 27.890 1.00 0.00 ATOM 13462 C31 DPP 112 14.590 56.630 27.850 1.00 0.00 ATOM 13463 O32 DPP 112 14.930 57.330 26.910 1.00 0.00 ATOM 13464 C32 DPP 112 15.390 56.560 29.150 1.00 0.00 ATOM 13465 H2X DPP 112 15.110 57.290 29.940 1.00 0.00 ATOM 13466 H2Y DPP 112 16.370 56.860 28.720 1.00 0.00 ATOM 13467 C23 DPP 112 16.240 51.300 27.930 1.00 0.00 ATOM 13468 H3R DPP 112 17.220 51.810 27.830 1.00 0.00 ATOM 13469 H3S DPP 112 16.390 50.200 27.820 1.00 0.00 ATOM 13470 C24 DPP 112 15.740 51.410 29.370 1.00 0.00 ATOM 13471 H4R DPP 112 14.750 50.950 29.550 1.00 0.00 ATOM 13472 H4S DPP 112 15.640 52.470 29.680 1.00 0.00 ATOM 13473 C25 DPP 112 16.810 50.790 30.270 1.00 0.00 ATOM 13474 H5R DPP 112 17.830 51.160 30.060 1.00 0.00 ATOM 13475 H5S DPP 112 16.700 49.700 30.070 1.00 0.00 ATOM 13476 C26 DPP 112 16.560 51.040 31.750 1.00 0.00 ATOM 13477 H6R DPP 112 15.530 50.640 31.890 1.00 0.00 ATOM 13478 H6S DPP 112 16.720 52.140 31.820 1.00 0.00 ATOM 13479 C27 DPP 112 17.570 50.330 32.650 1.00 0.00 ATOM 13480 H7R DPP 112 18.630 50.620 32.480 1.00 0.00 ATOM 13481 H7S DPP 112 17.550 49.260 32.350 1.00 0.00 ATOM 13482 C28 DPP 112 17.210 50.340 34.140 1.00 0.00 ATOM 13483 H8R DPP 112 17.810 49.680 34.790 1.00 0.00 ATOM 13484 H8S DPP 112 16.200 49.880 34.090 1.00 0.00 ATOM 13485 C29 DPP 112 17.150 51.730 34.770 1.00 0.00 ATOM 13486 H9R DPP 112 16.310 52.330 34.340 1.00 0.00 ATOM 13487 H9S DPP 112 18.040 52.330 34.480 1.00 0.00 ATOM 13488 0C21 DPP 112 17.000 51.630 36.290 1.00 0.00 ATOM 13489 H10R DPP 112 16.390 50.740 36.520 1.00 0.00 ATOM 13490 H10S DPP 112 16.670 52.630 36.650 1.00 0.00 ATOM 13491 1C21 DPP 112 18.390 51.480 36.920 1.00 0.00 ATOM 13492 H11R DPP 112 18.930 52.390 36.570 1.00 0.00 ATOM 13493 H11S DPP 112 18.940 50.530 36.750 1.00 0.00 ATOM 13494 2C21 DPP 112 18.270 51.510 38.440 1.00 0.00 ATOM 13495 H12R DPP 112 17.760 50.550 38.660 1.00 0.00 ATOM 13496 H12S DPP 112 17.750 52.430 38.790 1.00 0.00 ATOM 13497 3C21 DPP 112 19.640 51.550 39.110 1.00 0.00 ATOM 13498 H13R DPP 112 20.110 52.440 38.640 1.00 0.00 ATOM 13499 H13S DPP 112 20.180 50.640 38.740 1.00 0.00 ATOM 13500 4C21 DPP 112 19.610 51.600 40.640 1.00 0.00 ATOM 13501 H14R DPP 112 19.050 50.700 41.000 1.00 0.00 ATOM 13502 H14S DPP 112 19.040 52.480 41.010 1.00 0.00 ATOM 13503 5C21 DPP 112 21.030 51.710 41.190 1.00 0.00 ATOM 13504 H15R DPP 112 21.570 52.560 40.710 1.00 0.00 ATOM 13505 H15S DPP 112 21.600 50.850 40.780 1.00 0.00 ATOM 13506 6C21 DPP 112 21.140 51.590 42.710 1.00 0.00 ATOM 13507 H16R DPP 112 20.640 52.470 43.160 1.00 0.00 ATOM 13508 H16S DPP 112 22.110 51.240 43.150 1.00 0.00 ATOM 13509 H16T DPP 112 20.510 50.710 42.990 1.00 0.00 ATOM 13510 C33 DPP 112 15.560 55.150 29.710 1.00 0.00 ATOM 13511 H3X DPP 112 16.020 54.400 29.030 1.00 0.00 ATOM 13512 H3Y DPP 112 14.640 54.560 29.890 1.00 0.00 ATOM 13513 C34 DPP 112 16.280 55.130 31.060 1.00 0.00 ATOM 13514 H4X DPP 112 17.360 55.320 31.250 1.00 0.00 ATOM 13515 H4Y DPP 112 16.140 54.060 31.340 1.00 0.00 ATOM 13516 C35 DPP 112 15.460 55.830 32.140 1.00 0.00 ATOM 13517 H5X DPP 112 14.410 55.640 31.850 1.00 0.00 ATOM 13518 H5Y DPP 112 15.510 56.940 32.110 1.00 0.00 ATOM 13519 C36 DPP 112 15.730 55.290 33.550 1.00 0.00 ATOM 13520 H6X DPP 112 16.800 55.020 33.450 1.00 0.00 ATOM 13521 H6Y DPP 112 15.150 54.340 33.610 1.00 0.00 ATOM 13522 C37 DPP 112 15.390 56.360 34.590 1.00 0.00 ATOM 13523 H7X DPP 112 14.320 56.640 34.500 1.00 0.00 ATOM 13524 H7Y DPP 112 15.920 57.280 34.230 1.00 0.00 ATOM 13525 C38 DPP 112 15.750 56.040 36.040 1.00 0.00 ATOM 13526 H8X DPP 112 15.250 55.110 36.390 1.00 0.00 ATOM 13527 H8Y DPP 112 15.490 56.910 36.680 1.00 0.00 ATOM 13528 C39 DPP 112 17.260 55.880 36.180 1.00 0.00 ATOM 13529 H9X DPP 112 17.740 56.820 35.830 1.00 0.00 ATOM 13530 H9Y DPP 112 17.760 55.050 35.630 1.00 0.00 ATOM 13531 0C31 DPP 112 17.680 55.710 37.640 1.00 0.00 ATOM 13532 H10X DPP 112 17.120 54.840 38.050 1.00 0.00 ATOM 13533 H10Y DPP 112 17.410 56.640 38.180 1.00 0.00 ATOM 13534 1C31 DPP 112 19.140 55.260 37.750 1.00 0.00 ATOM 13535 H11X DPP 112 19.730 55.550 36.860 1.00 0.00 ATOM 13536 H11Y DPP 112 19.090 54.150 37.830 1.00 0.00 ATOM 13537 2C31 DPP 112 19.740 56.000 38.940 1.00 0.00 ATOM 13538 H12X DPP 112 20.700 55.520 39.230 1.00 0.00 ATOM 13539 H12Y DPP 112 19.110 55.850 39.840 1.00 0.00 ATOM 13540 3C31 DPP 112 20.040 57.490 38.770 1.00 0.00 ATOM 13541 H13X DPP 112 19.310 58.000 38.100 1.00 0.00 ATOM 13542 H13Y DPP 112 20.990 57.680 38.230 1.00 0.00 ATOM 13543 4C31 DPP 112 20.250 58.300 40.060 1.00 0.00 ATOM 13544 H14X DPP 112 20.960 57.730 40.710 1.00 0.00 ATOM 13545 H14Y DPP 112 19.280 58.240 40.600 1.00 0.00 ATOM 13546 5C31 DPP 112 20.840 59.690 39.810 1.00 0.00 ATOM 13547 H15X DPP 112 20.150 60.200 39.110 1.00 0.00 ATOM 13548 H15Y DPP 112 21.860 59.700 39.360 1.00 0.00 ATOM 13549 6C31 DPP 112 20.920 60.530 41.080 1.00 0.00 ATOM 13550 H16X DPP 112 20.140 60.190 41.780 1.00 0.00 ATOM 13551 H16Y DPP 112 20.610 61.590 40.940 1.00 0.00 ATOM 13552 H16Z DPP 112 21.890 60.630 41.600 1.00 0.00 ATOM 13553 N DPP 113 9.500 38.320 22.780 1.00 0.00 ATOM 13554 HN1 DPP 113 8.530 38.310 22.400 1.00 0.00 ATOM 13555 HN2 DPP 113 9.960 39.230 22.560 1.00 0.00 ATOM 13556 HN3 DPP 113 10.090 37.660 22.240 1.00 0.00 ATOM 13557 C12 DPP 113 9.530 38.120 24.270 1.00 0.00 ATOM 13558 H12A DPP 113 10.480 37.600 24.550 1.00 0.00 ATOM 13559 H12B DPP 113 9.650 39.100 24.780 1.00 0.00 ATOM 13560 C11 DPP 113 8.280 37.340 24.650 1.00 0.00 ATOM 13561 H11A DPP 113 7.350 37.940 24.730 1.00 0.00 ATOM 13562 H11B DPP 113 8.470 36.960 25.680 1.00 0.00 ATOM 13563 P DPP 113 6.920 35.210 24.310 1.00 0.00 ATOM 13564 O13 DPP 113 6.190 34.640 23.150 1.00 0.00 ATOM 13565 O14 DPP 113 6.040 35.930 25.260 1.00 0.00 ATOM 13566 O11 DPP 113 7.770 34.160 25.160 1.00 0.00 ATOM 13567 O12 DPP 113 8.040 36.220 23.790 1.00 0.00 ATOM 13568 C1 DPP 113 7.360 32.790 25.040 1.00 0.00 ATOM 13569 HA DPP 113 7.950 32.240 25.800 1.00 0.00 ATOM 13570 HB DPP 113 7.530 32.440 24.000 1.00 0.00 ATOM 13571 C2 DPP 113 5.930 32.450 25.470 1.00 0.00 ATOM 13572 HS DPP 113 5.220 32.840 24.710 1.00 0.00 ATOM 13573 O21 DPP 113 5.650 33.060 26.730 1.00 0.00 ATOM 13574 C21 DPP 113 4.360 33.270 27.010 1.00 0.00 ATOM 13575 O22 DPP 113 3.410 33.030 26.280 1.00 0.00 ATOM 13576 C22 DPP 113 4.150 33.940 28.360 1.00 0.00 ATOM 13577 H2R DPP 113 3.050 34.100 28.420 1.00 0.00 ATOM 13578 H2S DPP 113 4.670 34.920 28.310 1.00 0.00 ATOM 13579 C3 DPP 113 5.710 30.930 25.560 1.00 0.00 ATOM 13580 HX DPP 113 6.150 30.450 24.660 1.00 0.00 ATOM 13581 HY DPP 113 4.620 30.690 25.500 1.00 0.00 ATOM 13582 O31 DPP 113 6.200 30.310 26.750 1.00 0.00 ATOM 13583 C31 DPP 113 5.890 29.010 26.880 1.00 0.00 ATOM 13584 O32 DPP 113 5.330 28.340 26.030 1.00 0.00 ATOM 13585 C32 DPP 113 6.370 28.650 28.270 1.00 0.00 ATOM 13586 H2X DPP 113 5.540 28.770 29.000 1.00 0.00 ATOM 13587 H2Y DPP 113 7.250 29.280 28.540 1.00 0.00 ATOM 13588 C23 DPP 113 4.680 33.190 29.590 1.00 0.00 ATOM 13589 H3R DPP 113 4.790 33.930 30.410 1.00 0.00 ATOM 13590 H3S DPP 113 5.680 32.760 29.380 1.00 0.00 ATOM 13591 C24 DPP 113 3.690 32.230 30.250 1.00 0.00 ATOM 13592 H4R DPP 113 4.300 31.400 30.670 1.00 0.00 ATOM 13593 H4S DPP 113 3.260 31.720 29.360 1.00 0.00 ATOM 13594 C25 DPP 113 2.640 32.890 31.140 1.00 0.00 ATOM 13595 H5R DPP 113 2.110 33.600 30.470 1.00 0.00 ATOM 13596 H5S DPP 113 3.120 33.490 31.950 1.00 0.00 ATOM 13597 C26 DPP 113 1.700 31.760 31.590 1.00 0.00 ATOM 13598 H6R DPP 113 2.370 31.080 32.150 1.00 0.00 ATOM 13599 H6S DPP 113 1.450 31.180 30.680 1.00 0.00 ATOM 13600 C27 DPP 113 0.410 32.150 32.330 1.00 0.00 ATOM 13601 H7R DPP 113 0.160 31.240 32.910 1.00 0.00 ATOM 13602 H7S DPP 113 -0.390 32.390 31.610 1.00 0.00 ATOM 13603 C28 DPP 113 0.670 33.360 33.230 1.00 0.00 ATOM 13604 H8R DPP 113 1.120 34.300 32.840 1.00 0.00 ATOM 13605 H8S DPP 113 1.410 33.020 33.980 1.00 0.00 ATOM 13606 C29 DPP 113 -0.610 33.780 33.950 1.00 0.00 ATOM 13607 H9R DPP 113 -1.000 32.870 34.450 1.00 0.00 ATOM 13608 H9S DPP 113 -1.350 34.090 33.180 1.00 0.00 ATOM 13609 0C21 DPP 113 -0.490 35.050 34.800 1.00 0.00 ATOM 13610 H10R DPP 113 0.050 35.700 34.070 1.00 0.00 ATOM 13611 H10S DPP 113 0.230 34.930 35.640 1.00 0.00 ATOM 13612 1C21 DPP 113 -1.760 35.580 35.470 1.00 0.00 ATOM 13613 H11R DPP 113 -2.340 36.190 34.740 1.00 0.00 ATOM 13614 H11S DPP 113 -1.390 36.260 36.270 1.00 0.00 ATOM 13615 2C21 DPP 113 -2.670 34.490 36.040 1.00 0.00 ATOM 13616 H12R DPP 113 -3.010 33.740 35.300 1.00 0.00 ATOM 13617 H12S DPP 113 -3.570 35.050 36.360 1.00 0.00 ATOM 13618 3C21 DPP 113 -2.000 33.840 37.260 1.00 0.00 ATOM 13619 H13R DPP 113 -1.590 34.570 37.990 1.00 0.00 ATOM 13620 H13S DPP 113 -1.120 33.260 36.890 1.00 0.00 ATOM 13621 4C21 DPP 113 -2.890 32.740 37.840 1.00 0.00 ATOM 13622 H14R DPP 113 -3.210 32.230 36.900 1.00 0.00 ATOM 13623 H14S DPP 113 -3.850 33.150 38.200 1.00 0.00 ATOM 13624 5C21 DPP 113 -2.280 31.730 38.810 1.00 0.00 ATOM 13625 H15R DPP 113 -1.200 31.550 38.660 1.00 0.00 ATOM 13626 H15S DPP 113 -2.610 30.670 38.730 1.00 0.00 ATOM 13627 6C21 DPP 113 -2.340 32.380 40.190 1.00 0.00 ATOM 13628 H16R DPP 113 -1.560 33.150 40.350 1.00 0.00 ATOM 13629 H16S DPP 113 -2.220 31.580 40.960 1.00 0.00 ATOM 13630 H16T DPP 113 -3.310 32.900 40.330 1.00 0.00 ATOM 13631 C33 DPP 113 6.760 27.180 28.420 1.00 0.00 ATOM 13632 H3X DPP 113 7.200 26.750 27.490 1.00 0.00 ATOM 13633 H3Y DPP 113 5.880 26.630 28.800 1.00 0.00 ATOM 13634 C34 DPP 113 7.670 26.900 29.620 1.00 0.00 ATOM 13635 H4X DPP 113 8.700 27.140 29.290 1.00 0.00 ATOM 13636 H4Y DPP 113 7.640 25.810 29.790 1.00 0.00 ATOM 13637 C35 DPP 113 7.140 27.610 30.860 1.00 0.00 ATOM 13638 H5X DPP 113 6.130 27.280 31.210 1.00 0.00 ATOM 13639 H5Y DPP 113 7.120 28.720 30.840 1.00 0.00 ATOM 13640 C36 DPP 113 8.240 27.370 31.900 1.00 0.00 ATOM 13641 H6X DPP 113 9.130 27.490 31.250 1.00 0.00 ATOM 13642 H6Y DPP 113 8.230 26.370 32.370 1.00 0.00 ATOM 13643 C37 DPP 113 8.200 28.450 32.990 1.00 0.00 ATOM 13644 H7X DPP 113 7.420 28.170 33.740 1.00 0.00 ATOM 13645 H7Y DPP 113 8.030 29.420 32.490 1.00 0.00 ATOM 13646 C38 DPP 113 9.540 28.380 33.720 1.00 0.00 ATOM 13647 H8X DPP 113 9.400 29.200 34.470 1.00 0.00 ATOM 13648 H8Y DPP 113 10.420 28.510 33.060 1.00 0.00 ATOM 13649 C39 DPP 113 9.720 27.190 34.660 1.00 0.00 ATOM 13650 H9X DPP 113 10.670 27.300 35.230 1.00 0.00 ATOM 13651 H9Y DPP 113 9.810 26.340 33.940 1.00 0.00 ATOM 13652 0C31 DPP 113 8.710 26.760 35.720 1.00 0.00 ATOM 13653 H10X DPP 113 9.130 25.890 36.260 1.00 0.00 ATOM 13654 H10Y DPP 113 7.780 26.430 35.200 1.00 0.00 ATOM 13655 1C31 DPP 113 8.440 27.860 36.740 1.00 0.00 ATOM 13656 H11X DPP 113 7.710 28.500 36.200 1.00 0.00 ATOM 13657 H11Y DPP 113 9.300 28.540 36.890 1.00 0.00 ATOM 13658 2C31 DPP 113 7.560 27.350 37.880 1.00 0.00 ATOM 13659 H12X DPP 113 6.820 26.650 37.420 1.00 0.00 ATOM 13660 H12Y DPP 113 6.910 28.140 38.310 1.00 0.00 ATOM 13661 3C31 DPP 113 8.250 26.470 38.920 1.00 0.00 ATOM 13662 H13X DPP 113 8.560 25.490 38.510 1.00 0.00 ATOM 13663 H13Y DPP 113 7.560 26.410 39.790 1.00 0.00 ATOM 13664 4C31 DPP 113 9.510 27.070 39.550 1.00 0.00 ATOM 13665 H14X DPP 113 9.150 28.020 40.000 1.00 0.00 ATOM 13666 H14Y DPP 113 10.200 27.290 38.710 1.00 0.00 ATOM 13667 5C31 DPP 113 10.200 26.270 40.660 1.00 0.00 ATOM 13668 H15X DPP 113 10.640 27.060 41.300 1.00 0.00 ATOM 13669 H15Y DPP 113 10.950 25.670 40.110 1.00 0.00 ATOM 13670 6C31 DPP 113 9.360 25.200 41.360 1.00 0.00 ATOM 13671 H16X DPP 113 9.980 24.700 42.140 1.00 0.00 ATOM 13672 H16Y DPP 113 9.070 24.380 40.680 1.00 0.00 ATOM 13673 H16Z DPP 113 8.410 25.570 41.810 1.00 0.00 ATOM 13674 N DPP 114 3.880 42.810 20.500 1.00 0.00 ATOM 13675 HN1 DPP 114 3.350 43.550 20.000 1.00 0.00 ATOM 13676 HN2 DPP 114 3.240 42.250 21.090 1.00 0.00 ATOM 13677 HN3 DPP 114 4.630 43.280 21.050 1.00 0.00 ATOM 13678 C12 DPP 114 4.490 41.840 19.510 1.00 0.00 ATOM 13679 H12A DPP 114 3.560 41.340 19.160 1.00 0.00 ATOM 13680 H12B DPP 114 5.100 42.340 18.730 1.00 0.00 ATOM 13681 C11 DPP 114 5.420 40.800 20.140 1.00 0.00 ATOM 13682 H11A DPP 114 5.450 39.930 19.460 1.00 0.00 ATOM 13683 H11B DPP 114 6.430 41.260 20.200 1.00 0.00 ATOM 13684 P DPP 114 5.780 39.300 22.070 1.00 0.00 ATOM 13685 O13 DPP 114 7.170 39.170 21.590 1.00 0.00 ATOM 13686 O14 DPP 114 4.990 38.050 22.100 1.00 0.00 ATOM 13687 O11 DPP 114 5.830 39.710 23.620 1.00 0.00 ATOM 13688 O12 DPP 114 4.840 40.410 21.390 1.00 0.00 ATOM 13689 C1 DPP 114 5.760 41.110 23.870 1.00 0.00 ATOM 13690 HA DPP 114 4.700 41.430 23.960 1.00 0.00 ATOM 13691 HB DPP 114 6.100 41.700 22.990 1.00 0.00 ATOM 13692 C2 DPP 114 6.640 41.550 25.050 1.00 0.00 ATOM 13693 HS DPP 114 7.700 41.230 24.930 1.00 0.00 ATOM 13694 O21 DPP 114 6.010 41.090 26.250 1.00 0.00 ATOM 13695 C21 DPP 114 6.800 40.320 27.000 1.00 0.00 ATOM 13696 O22 DPP 114 7.920 39.970 26.660 1.00 0.00 ATOM 13697 C22 DPP 114 6.070 39.840 28.250 1.00 0.00 ATOM 13698 H2R DPP 114 5.890 38.750 28.180 1.00 0.00 ATOM 13699 H2S DPP 114 5.130 40.420 28.340 1.00 0.00 ATOM 13700 C3 DPP 114 6.630 43.070 25.280 1.00 0.00 ATOM 13701 HX DPP 114 5.560 43.300 25.080 1.00 0.00 ATOM 13702 HY DPP 114 7.270 43.470 24.460 1.00 0.00 ATOM 13703 O31 DPP 114 7.140 43.440 26.570 1.00 0.00 ATOM 13704 C31 DPP 114 6.440 44.410 27.160 1.00 0.00 ATOM 13705 O32 DPP 114 5.740 45.270 26.650 1.00 0.00 ATOM 13706 C32 DPP 114 6.850 44.370 28.620 1.00 0.00 ATOM 13707 H2X DPP 114 7.960 44.470 28.670 1.00 0.00 ATOM 13708 H2Y DPP 114 6.520 43.370 28.960 1.00 0.00 ATOM 13709 C23 DPP 114 6.970 40.180 29.440 1.00 0.00 ATOM 13710 H3R DPP 114 7.220 41.270 29.370 1.00 0.00 ATOM 13711 H3S DPP 114 7.920 39.610 29.380 1.00 0.00 ATOM 13712 C24 DPP 114 6.340 39.900 30.800 1.00 0.00 ATOM 13713 H4R DPP 114 6.180 38.820 31.000 1.00 0.00 ATOM 13714 H4S DPP 114 5.350 40.410 30.730 1.00 0.00 ATOM 13715 C25 DPP 114 7.160 40.530 31.930 1.00 0.00 ATOM 13716 H5R DPP 114 7.420 41.580 31.660 1.00 0.00 ATOM 13717 H5S DPP 114 8.130 40.010 32.070 1.00 0.00 ATOM 13718 C26 DPP 114 6.340 40.390 33.210 1.00 0.00 ATOM 13719 H6R DPP 114 6.000 39.340 33.360 1.00 0.00 ATOM 13720 H6S DPP 114 5.440 41.010 33.000 1.00 0.00 ATOM 13721 C27 DPP 114 7.040 41.050 34.390 1.00 0.00 ATOM 13722 H7R DPP 114 7.090 42.080 33.960 1.00 0.00 ATOM 13723 H7S DPP 114 8.040 40.580 34.490 1.00 0.00 ATOM 13724 C28 DPP 114 6.300 41.010 35.730 1.00 0.00 ATOM 13725 H8R DPP 114 6.130 40.030 36.240 1.00 0.00 ATOM 13726 H8S DPP 114 5.260 41.370 35.560 1.00 0.00 ATOM 13727 C29 DPP 114 6.960 41.850 36.820 1.00 0.00 ATOM 13728 H9R DPP 114 7.120 42.870 36.390 1.00 0.00 ATOM 13729 H9S DPP 114 8.000 41.490 37.010 1.00 0.00 ATOM 13730 0C21 DPP 114 6.160 41.820 38.120 1.00 0.00 ATOM 13731 H10R DPP 114 5.690 40.840 38.350 1.00 0.00 ATOM 13732 H10S DPP 114 5.230 42.420 37.990 1.00 0.00 ATOM 13733 1C21 DPP 114 6.750 42.290 39.450 1.00 0.00 ATOM 13734 H11R DPP 114 7.490 41.510 39.720 1.00 0.00 ATOM 13735 H11S DPP 114 6.100 42.240 40.350 1.00 0.00 ATOM 13736 2C21 DPP 114 7.480 43.640 39.450 1.00 0.00 ATOM 13737 H12R DPP 114 6.910 44.420 38.900 1.00 0.00 ATOM 13738 H12S DPP 114 8.490 43.540 39.000 1.00 0.00 ATOM 13739 3C21 DPP 114 7.700 44.120 40.890 1.00 0.00 ATOM 13740 H13R DPP 114 8.520 43.530 41.340 1.00 0.00 ATOM 13741 H13S DPP 114 6.780 44.060 41.510 1.00 0.00 ATOM 13742 4C21 DPP 114 8.190 45.570 40.960 1.00 0.00 ATOM 13743 H14R DPP 114 7.430 46.100 40.350 1.00 0.00 ATOM 13744 H14S DPP 114 9.150 45.580 40.400 1.00 0.00 ATOM 13745 5C21 DPP 114 8.280 46.230 42.340 1.00 0.00 ATOM 13746 H15R DPP 114 7.280 46.200 42.810 1.00 0.00 ATOM 13747 H15S DPP 114 8.470 47.280 42.030 1.00 0.00 ATOM 13748 6C21 DPP 114 9.330 45.670 43.300 1.00 0.00 ATOM 13749 H16R DPP 114 8.800 44.850 43.830 1.00 0.00 ATOM 13750 H16S DPP 114 9.790 46.430 43.980 1.00 0.00 ATOM 13751 H16T DPP 114 10.140 45.180 42.730 1.00 0.00 ATOM 13752 C33 DPP 114 6.100 45.410 29.450 1.00 0.00 ATOM 13753 H3X DPP 114 6.150 45.080 30.510 1.00 0.00 ATOM 13754 H3Y DPP 114 5.020 45.380 29.170 1.00 0.00 ATOM 13755 C34 DPP 114 6.720 46.810 29.330 1.00 0.00 ATOM 13756 H4X DPP 114 6.100 47.450 29.990 1.00 0.00 ATOM 13757 H4Y DPP 114 6.680 47.170 28.280 1.00 0.00 ATOM 13758 C35 DPP 114 8.170 47.050 29.740 1.00 0.00 ATOM 13759 H5X DPP 114 8.390 48.100 29.480 1.00 0.00 ATOM 13760 H5Y DPP 114 8.820 46.500 29.020 1.00 0.00 ATOM 13761 C36 DPP 114 8.480 47.120 31.240 1.00 0.00 ATOM 13762 H6X DPP 114 8.110 46.150 31.640 1.00 0.00 ATOM 13763 H6Y DPP 114 7.840 47.960 31.580 1.00 0.00 ATOM 13764 C37 DPP 114 9.940 47.440 31.570 1.00 0.00 ATOM 13765 H7X DPP 114 10.120 48.440 31.140 1.00 0.00 ATOM 13766 H7Y DPP 114 10.680 46.830 31.010 1.00 0.00 ATOM 13767 C38 DPP 114 10.300 47.600 33.040 1.00 0.00 ATOM 13768 H8X DPP 114 9.670 48.340 33.560 1.00 0.00 ATOM 13769 H8Y DPP 114 11.360 47.940 33.010 1.00 0.00 ATOM 13770 C39 DPP 114 10.060 46.270 33.760 1.00 0.00 ATOM 13771 H9X DPP 114 10.130 45.320 33.200 1.00 0.00 ATOM 13772 H9Y DPP 114 9.030 46.410 34.170 1.00 0.00 ATOM 13773 0C31 DPP 114 11.080 46.080 34.890 1.00 0.00 ATOM 13774 H10X DPP 114 11.180 47.090 35.330 1.00 0.00 ATOM 13775 H10Y DPP 114 12.070 45.690 34.580 1.00 0.00 ATOM 13776 1C31 DPP 114 10.620 45.120 36.000 1.00 0.00 ATOM 13777 H11X DPP 114 10.540 44.060 35.660 1.00 0.00 ATOM 13778 H11Y DPP 114 9.610 45.310 36.410 1.00 0.00 ATOM 13779 2C31 DPP 114 11.730 45.080 37.060 1.00 0.00 ATOM 13780 H12X DPP 114 12.090 46.100 37.290 1.00 0.00 ATOM 13781 H12Y DPP 114 12.660 44.640 36.640 1.00 0.00 ATOM 13782 3C31 DPP 114 11.420 44.390 38.390 1.00 0.00 ATOM 13783 H13X DPP 114 11.070 43.340 38.250 1.00 0.00 ATOM 13784 H13Y DPP 114 10.620 45.010 38.850 1.00 0.00 ATOM 13785 4C31 DPP 114 12.660 44.420 39.290 1.00 0.00 ATOM 13786 H14X DPP 114 12.920 45.470 39.540 1.00 0.00 ATOM 13787 H14Y DPP 114 13.450 43.940 38.690 1.00 0.00 ATOM 13788 5C31 DPP 114 12.430 43.650 40.600 1.00 0.00 ATOM 13789 H15X DPP 114 12.230 42.600 40.280 1.00 0.00 ATOM 13790 H15Y DPP 114 11.490 44.130 40.940 1.00 0.00 ATOM 13791 6C31 DPP 114 13.430 43.490 41.740 1.00 0.00 ATOM 13792 H16X DPP 114 13.090 42.810 42.560 1.00 0.00 ATOM 13793 H16Y DPP 114 13.730 44.470 42.180 1.00 0.00 ATOM 13794 H16Z DPP 114 14.320 42.960 41.350 1.00 0.00 ATOM 13795 N DPP 115 54.680 0.010 20.230 1.00 0.00 ATOM 13796 HN1 DPP 115 53.670 0.080 20.010 1.00 0.00 ATOM 13797 HN2 DPP 115 54.930 0.730 20.940 1.00 0.00 ATOM 13798 HN3 DPP 115 55.140 0.270 19.340 1.00 0.00 ATOM 13799 C12 DPP 115 54.900 -1.460 20.510 1.00 0.00 ATOM 13800 H12A DPP 115 54.580 -2.100 19.660 1.00 0.00 ATOM 13801 H12B DPP 115 54.160 -1.770 21.280 1.00 0.00 ATOM 13802 C11 DPP 115 56.370 -1.790 20.770 1.00 0.00 ATOM 13803 H11A DPP 115 56.970 -1.890 19.830 1.00 0.00 ATOM 13804 H11B DPP 115 56.530 -2.750 21.300 1.00 0.00 ATOM 13805 P DPP 115 58.370 -0.880 22.000 1.00 0.00 ATOM 13806 O13 DPP 115 59.150 0.360 22.140 1.00 0.00 ATOM 13807 O14 DPP 115 59.000 -2.090 21.420 1.00 0.00 ATOM 13808 O11 DPP 115 57.910 -1.290 23.480 1.00 0.00 ATOM 13809 O12 DPP 115 56.900 -0.630 21.430 1.00 0.00 ATOM 13810 C1 DPP 115 57.230 -0.280 24.230 1.00 0.00 ATOM 13811 HA DPP 115 56.690 0.470 23.620 1.00 0.00 ATOM 13812 HB DPP 115 57.950 0.320 24.840 1.00 0.00 ATOM 13813 C2 DPP 115 56.130 -0.880 25.120 1.00 0.00 ATOM 13814 HS DPP 115 55.550 -0.020 25.520 1.00 0.00 ATOM 13815 O21 DPP 115 56.790 -1.710 26.080 1.00 0.00 ATOM 13816 C21 DPP 115 57.290 -0.980 27.080 1.00 0.00 ATOM 13817 O22 DPP 115 57.060 0.200 27.310 1.00 0.00 ATOM 13818 C22 DPP 115 58.250 -1.760 27.970 1.00 0.00 ATOM 13819 H2R DPP 115 59.290 -1.360 27.950 1.00 0.00 ATOM 13820 H2S DPP 115 58.290 -2.830 27.680 1.00 0.00 ATOM 13821 C3 DPP 115 55.170 -1.750 24.300 1.00 0.00 ATOM 13822 HX DPP 115 55.650 -2.670 23.920 1.00 0.00 ATOM 13823 HY DPP 115 54.890 -1.070 23.460 1.00 0.00 ATOM 13824 O31 DPP 115 53.980 -2.030 25.040 1.00 0.00 ATOM 13825 C31 DPP 115 53.200 -3.040 24.650 1.00 0.00 ATOM 13826 O32 DPP 115 53.340 -3.820 23.710 1.00 0.00 ATOM 13827 C32 DPP 115 52.090 -3.160 25.680 1.00 0.00 ATOM 13828 H2X DPP 115 51.130 -3.490 25.240 1.00 0.00 ATOM 13829 H2Y DPP 115 51.960 -2.190 26.190 1.00 0.00 ATOM 13830 C23 DPP 115 57.700 -1.740 29.400 1.00 0.00 ATOM 13831 H3R DPP 115 56.630 -1.920 29.190 1.00 0.00 ATOM 13832 H3S DPP 115 57.770 -0.740 29.880 1.00 0.00 ATOM 13833 C24 DPP 115 58.200 -2.880 30.300 1.00 0.00 ATOM 13834 H4R DPP 115 59.250 -2.780 30.640 1.00 0.00 ATOM 13835 H4S DPP 115 58.100 -3.830 29.740 1.00 0.00 ATOM 13836 C25 DPP 115 57.210 -3.080 31.450 1.00 0.00 ATOM 13837 H5R DPP 115 57.490 -4.010 31.970 1.00 0.00 ATOM 13838 H5S DPP 115 56.180 -3.100 31.030 1.00 0.00 ATOM 13839 C26 DPP 115 57.280 -1.940 32.460 1.00 0.00 ATOM 13840 H6R DPP 115 56.490 -2.150 33.210 1.00 0.00 ATOM 13841 H6S DPP 115 56.920 -0.990 32.010 1.00 0.00 ATOM 13842 C27 DPP 115 58.570 -1.950 33.280 1.00 0.00 ATOM 13843 H7R DPP 115 59.290 -1.780 32.450 1.00 0.00 ATOM 13844 H7S DPP 115 58.630 -2.970 33.720 1.00 0.00 ATOM 13845 C28 DPP 115 58.650 -0.840 34.330 1.00 0.00 ATOM 13846 H8R DPP 115 58.110 -1.250 35.220 1.00 0.00 ATOM 13847 H8S DPP 115 58.190 0.120 34.030 1.00 0.00 ATOM 13848 C29 DPP 115 60.080 -0.650 34.840 1.00 0.00 ATOM 13849 H9R DPP 115 60.730 -0.470 33.960 1.00 0.00 ATOM 13850 H9S DPP 115 60.510 -1.440 35.500 1.00 0.00 ATOM 13851 0C21 DPP 115 60.200 0.620 35.680 1.00 0.00 ATOM 13852 H10R DPP 115 60.010 1.520 35.060 1.00 0.00 ATOM 13853 H10S DPP 115 61.260 0.640 36.030 1.00 0.00 ATOM 13854 1C21 DPP 115 59.270 0.720 36.890 1.00 0.00 ATOM 13855 H11R DPP 115 59.210 -0.240 37.450 1.00 0.00 ATOM 13856 H11S DPP 115 58.260 1.000 36.530 1.00 0.00 ATOM 13857 2C21 DPP 115 59.840 1.720 37.890 1.00 0.00 ATOM 13858 H12R DPP 115 59.020 1.930 38.600 1.00 0.00 ATOM 13859 H12S DPP 115 60.070 2.690 37.400 1.00 0.00 ATOM 13860 3C21 DPP 115 61.050 1.200 38.670 1.00 0.00 ATOM 13861 H13R DPP 115 62.000 1.050 38.110 1.00 0.00 ATOM 13862 H13S DPP 115 60.860 0.200 39.120 1.00 0.00 ATOM 13863 4C21 DPP 115 61.520 2.300 39.620 1.00 0.00 ATOM 13864 H14R DPP 115 60.930 2.240 40.550 1.00 0.00 ATOM 13865 H14S DPP 115 61.310 3.330 39.240 1.00 0.00 ATOM 13866 5C21 DPP 115 63.020 2.240 39.930 1.00 0.00 ATOM 13867 H15R DPP 115 63.560 2.360 38.970 1.00 0.00 ATOM 13868 H15S DPP 115 63.250 1.240 40.360 1.00 0.00 ATOM 13869 6C21 DPP 115 63.410 3.280 40.970 1.00 0.00 ATOM 13870 H16R DPP 115 62.910 4.250 40.750 1.00 0.00 ATOM 13871 H16S DPP 115 64.510 3.380 41.060 1.00 0.00 ATOM 13872 H16T DPP 115 63.200 2.980 42.020 1.00 0.00 ATOM 13873 C33 DPP 115 52.470 -4.250 26.690 1.00 0.00 ATOM 13874 H3X DPP 115 53.540 -4.170 26.980 1.00 0.00 ATOM 13875 H3Y DPP 115 52.350 -5.270 26.280 1.00 0.00 ATOM 13876 C34 DPP 115 51.700 -4.080 28.010 1.00 0.00 ATOM 13877 H4X DPP 115 50.770 -4.670 27.910 1.00 0.00 ATOM 13878 H4Y DPP 115 51.510 -2.990 28.160 1.00 0.00 ATOM 13879 C35 DPP 115 52.440 -4.690 29.200 1.00 0.00 ATOM 13880 H5X DPP 115 53.410 -4.230 29.470 1.00 0.00 ATOM 13881 H5Y DPP 115 52.590 -5.780 29.080 1.00 0.00 ATOM 13882 C36 DPP 115 51.510 -4.590 30.410 1.00 0.00 ATOM 13883 H6X DPP 115 50.610 -5.240 30.310 1.00 0.00 ATOM 13884 H6Y DPP 115 51.250 -3.520 30.530 1.00 0.00 ATOM 13885 C37 DPP 115 52.270 -4.970 31.680 1.00 0.00 ATOM 13886 H7X DPP 115 53.140 -4.270 31.710 1.00 0.00 ATOM 13887 H7Y DPP 115 52.660 -6.000 31.580 1.00 0.00 ATOM 13888 C38 DPP 115 51.440 -4.710 32.940 1.00 0.00 ATOM 13889 H8X DPP 115 50.390 -5.050 32.800 1.00 0.00 ATOM 13890 H8Y DPP 115 51.150 -3.640 33.030 1.00 0.00 ATOM 13891 C39 DPP 115 52.050 -5.260 34.230 1.00 0.00 ATOM 13892 H9X DPP 115 53.010 -4.750 34.460 1.00 0.00 ATOM 13893 H9Y DPP 115 52.380 -6.310 34.070 1.00 0.00 ATOM 13894 0C31 DPP 115 51.190 -4.970 35.460 1.00 0.00 ATOM 13895 H10X DPP 115 50.180 -5.430 35.300 1.00 0.00 ATOM 13896 H10Y DPP 115 51.050 -3.870 35.370 1.00 0.00 ATOM 13897 1C31 DPP 115 51.830 -5.290 36.810 1.00 0.00 ATOM 13898 H11X DPP 115 52.890 -4.990 36.670 1.00 0.00 ATOM 13899 H11Y DPP 115 51.680 -6.390 36.930 1.00 0.00 ATOM 13900 2C31 DPP 115 51.300 -4.670 38.100 1.00 0.00 ATOM 13901 H12X DPP 115 50.200 -4.730 38.100 1.00 0.00 ATOM 13902 H12Y DPP 115 51.510 -3.580 38.150 1.00 0.00 ATOM 13903 3C31 DPP 115 51.860 -5.460 39.290 1.00 0.00 ATOM 13904 H13X DPP 115 52.960 -5.450 39.400 1.00 0.00 ATOM 13905 H13Y DPP 115 51.650 -6.540 39.160 1.00 0.00 ATOM 13906 4C31 DPP 115 51.270 -4.970 40.620 1.00 0.00 ATOM 13907 H14X DPP 115 51.050 -5.770 41.360 1.00 0.00 ATOM 13908 H14Y DPP 115 50.290 -4.510 40.400 1.00 0.00 ATOM 13909 5C31 DPP 115 52.260 -3.990 41.250 1.00 0.00 ATOM 13910 H15X DPP 115 52.460 -3.220 40.480 1.00 0.00 ATOM 13911 H15Y DPP 115 53.220 -4.490 41.510 1.00 0.00 ATOM 13912 6C31 DPP 115 51.830 -3.190 42.470 1.00 0.00 ATOM 13913 H16X DPP 115 51.020 -2.460 42.260 1.00 0.00 ATOM 13914 H16Y DPP 115 52.730 -2.640 42.810 1.00 0.00 ATOM 13915 H16Z DPP 115 51.440 -3.890 43.250 1.00 0.00 ATOM 13916 N DPP 116 15.790 4.470 25.160 1.00 0.00 ATOM 13917 HN1 DPP 116 14.900 4.180 25.620 1.00 0.00 ATOM 13918 HN2 DPP 116 16.330 3.620 24.900 1.00 0.00 ATOM 13919 HN3 DPP 116 16.240 4.980 25.950 1.00 0.00 ATOM 13920 C12 DPP 116 15.680 5.460 24.030 1.00 0.00 ATOM 13921 H12A DPP 116 15.200 5.000 23.130 1.00 0.00 ATOM 13922 H12B DPP 116 15.000 6.310 24.240 1.00 0.00 ATOM 13923 C11 DPP 116 17.070 5.660 23.420 1.00 0.00 ATOM 13924 H11A DPP 116 17.100 6.640 22.910 1.00 0.00 ATOM 13925 H11B DPP 116 17.160 4.790 22.730 1.00 0.00 ATOM 13926 P DPP 116 19.520 5.920 23.860 1.00 0.00 ATOM 13927 O13 DPP 116 19.720 7.370 23.710 1.00 0.00 ATOM 13928 O14 DPP 116 19.750 5.200 22.590 1.00 0.00 ATOM 13929 O11 DPP 116 20.520 5.400 24.990 1.00 0.00 ATOM 13930 O12 DPP 116 18.060 5.640 24.460 1.00 0.00 ATOM 13931 C1 DPP 116 21.010 4.060 25.090 1.00 0.00 ATOM 13932 HA DPP 116 22.020 3.960 25.540 1.00 0.00 ATOM 13933 HB DPP 116 21.100 3.560 24.100 1.00 0.00 ATOM 13934 C2 DPP 116 20.070 3.200 25.950 1.00 0.00 ATOM 13935 HS DPP 116 19.050 3.160 25.500 1.00 0.00 ATOM 13936 O21 DPP 116 19.980 3.870 27.220 1.00 0.00 ATOM 13937 C21 DPP 116 19.030 3.460 28.060 1.00 0.00 ATOM 13938 O22 DPP 116 18.060 2.770 27.760 1.00 0.00 ATOM 13939 C22 DPP 116 19.220 4.040 29.450 1.00 0.00 ATOM 13940 H2R DPP 116 18.750 5.040 29.530 1.00 0.00 ATOM 13941 H2S DPP 116 20.310 3.990 29.640 1.00 0.00 ATOM 13942 C3 DPP 116 20.550 1.750 26.120 1.00 0.00 ATOM 13943 HX DPP 116 20.880 1.510 25.080 1.00 0.00 ATOM 13944 HY DPP 116 19.680 1.150 26.450 1.00 0.00 ATOM 13945 O31 DPP 116 21.580 1.720 27.120 1.00 0.00 ATOM 13946 C31 DPP 116 22.240 0.570 27.040 1.00 0.00 ATOM 13947 O32 DPP 116 21.840 -0.320 26.300 1.00 0.00 ATOM 13948 C32 DPP 116 23.520 0.630 27.870 1.00 0.00 ATOM 13949 H2X DPP 116 23.390 1.330 28.730 1.00 0.00 ATOM 13950 H2Y DPP 116 24.370 0.910 27.220 1.00 0.00 ATOM 13951 C23 DPP 116 18.280 3.210 30.340 1.00 0.00 ATOM 13952 H3R DPP 116 18.440 2.150 30.080 1.00 0.00 ATOM 13953 H3S DPP 116 17.220 3.490 30.190 1.00 0.00 ATOM 13954 C24 DPP 116 18.570 3.420 31.830 1.00 0.00 ATOM 13955 H4R DPP 116 19.670 3.550 31.900 1.00 0.00 ATOM 13956 H4S DPP 116 18.480 2.440 32.350 1.00 0.00 ATOM 13957 C25 DPP 116 17.910 4.650 32.470 1.00 0.00 ATOM 13958 H5R DPP 116 16.820 4.500 32.440 1.00 0.00 ATOM 13959 H5S DPP 116 18.150 5.530 31.820 1.00 0.00 ATOM 13960 C26 DPP 116 18.400 4.970 33.880 1.00 0.00 ATOM 13961 H6R DPP 116 19.490 5.180 33.940 1.00 0.00 ATOM 13962 H6S DPP 116 18.100 4.090 34.500 1.00 0.00 ATOM 13963 C27 DPP 116 17.720 6.210 34.460 1.00 0.00 ATOM 13964 H7R DPP 116 16.630 6.160 34.230 1.00 0.00 ATOM 13965 H7S DPP 116 18.170 7.060 33.900 1.00 0.00 ATOM 13966 C28 DPP 116 17.980 6.320 35.960 1.00 0.00 ATOM 13967 H8R DPP 116 19.050 6.560 36.150 1.00 0.00 ATOM 13968 H8S DPP 116 17.740 5.370 36.470 1.00 0.00 ATOM 13969 C29 DPP 116 17.100 7.480 36.450 1.00 0.00 ATOM 13970 H9R DPP 116 16.060 7.410 36.070 1.00 0.00 ATOM 13971 H9S DPP 116 17.470 8.450 36.060 1.00 0.00 ATOM 13972 0C21 DPP 116 16.940 7.610 37.970 1.00 0.00 ATOM 13973 H10R DPP 116 16.420 8.600 37.990 1.00 0.00 ATOM 13974 H10S DPP 116 17.870 7.760 38.560 1.00 0.00 ATOM 13975 1C21 DPP 116 16.220 6.520 38.750 1.00 0.00 ATOM 13976 H11R DPP 116 16.770 5.570 38.610 1.00 0.00 ATOM 13977 H11S DPP 116 15.300 6.290 38.180 1.00 0.00 ATOM 13978 2C21 DPP 116 15.860 6.710 40.230 1.00 0.00 ATOM 13979 H12R DPP 116 15.330 5.800 40.590 1.00 0.00 ATOM 13980 H12S DPP 116 15.250 7.630 40.260 1.00 0.00 ATOM 13981 3C21 DPP 116 17.090 6.790 41.140 1.00 0.00 ATOM 13982 H13R DPP 116 17.810 7.590 40.840 1.00 0.00 ATOM 13983 H13S DPP 116 17.570 5.800 41.030 1.00 0.00 ATOM 13984 4C21 DPP 116 16.760 6.840 42.630 1.00 0.00 ATOM 13985 H14R DPP 116 16.270 7.810 42.860 1.00 0.00 ATOM 13986 H14S DPP 116 17.750 6.720 43.110 1.00 0.00 ATOM 13987 5C21 DPP 116 15.760 5.730 42.990 1.00 0.00 ATOM 13988 H15R DPP 116 16.150 4.830 42.470 1.00 0.00 ATOM 13989 H15S DPP 116 14.770 6.030 42.580 1.00 0.00 ATOM 13990 6C21 DPP 116 15.600 5.450 44.480 1.00 0.00 ATOM 13991 H16R DPP 116 16.640 5.430 44.870 1.00 0.00 ATOM 13992 H16S DPP 116 15.130 4.460 44.670 1.00 0.00 ATOM 13993 H16T DPP 116 15.050 6.280 44.970 1.00 0.00 ATOM 13994 C33 DPP 116 23.720 -0.720 28.550 1.00 0.00 ATOM 13995 H3X DPP 116 24.170 -1.460 27.850 1.00 0.00 ATOM 13996 H3Y DPP 116 22.710 -1.060 28.860 1.00 0.00 ATOM 13997 C34 DPP 116 24.450 -0.650 29.890 1.00 0.00 ATOM 13998 H4X DPP 116 23.860 0.030 30.550 1.00 0.00 ATOM 13999 H4Y DPP 116 25.420 -0.120 29.760 1.00 0.00 ATOM 14000 C35 DPP 116 24.550 -2.000 30.610 1.00 0.00 ATOM 14001 H5X DPP 116 25.260 -2.730 30.170 1.00 0.00 ATOM 14002 H5Y DPP 116 23.520 -2.360 30.450 1.00 0.00 ATOM 14003 C36 DPP 116 24.820 -2.000 32.120 1.00 0.00 ATOM 14004 H6X DPP 116 23.800 -1.770 32.510 1.00 0.00 ATOM 14005 H6Y DPP 116 25.500 -1.270 32.590 1.00 0.00 ATOM 14006 C37 DPP 116 25.350 -3.360 32.560 1.00 0.00 ATOM 14007 H7X DPP 116 26.300 -3.550 32.020 1.00 0.00 ATOM 14008 H7Y DPP 116 24.600 -4.140 32.320 1.00 0.00 ATOM 14009 C38 DPP 116 25.740 -3.420 34.040 1.00 0.00 ATOM 14010 H8X DPP 116 24.890 -2.900 34.520 1.00 0.00 ATOM 14011 H8Y DPP 116 26.680 -2.830 34.100 1.00 0.00 ATOM 14012 C39 DPP 116 26.070 -4.800 34.620 1.00 0.00 ATOM 14013 H9X DPP 116 26.830 -5.240 33.940 1.00 0.00 ATOM 14014 H9Y DPP 116 25.150 -5.410 34.710 1.00 0.00 ATOM 14015 0C31 DPP 116 26.530 -4.430 36.030 1.00 0.00 ATOM 14016 H10X DPP 116 25.650 -4.170 36.660 1.00 0.00 ATOM 14017 H10Y DPP 116 27.250 -3.590 36.020 1.00 0.00 ATOM 14018 1C31 DPP 116 27.360 -5.490 36.760 1.00 0.00 ATOM 14019 H11X DPP 116 28.210 -5.790 36.100 1.00 0.00 ATOM 14020 H11Y DPP 116 26.730 -6.380 36.920 1.00 0.00 ATOM 14021 2C31 DPP 116 27.920 -5.000 38.090 1.00 0.00 ATOM 14022 H12X DPP 116 27.120 -4.850 38.850 1.00 0.00 ATOM 14023 H12Y DPP 116 28.410 -4.010 37.930 1.00 0.00 ATOM 14024 3C31 DPP 116 28.940 -5.900 38.800 1.00 0.00 ATOM 14025 H13X DPP 116 29.330 -5.350 39.680 1.00 0.00 ATOM 14026 H13Y DPP 116 29.800 -6.180 38.160 1.00 0.00 ATOM 14027 4C31 DPP 116 28.290 -7.050 39.570 1.00 0.00 ATOM 14028 H14X DPP 116 27.900 -7.760 38.800 1.00 0.00 ATOM 14029 H14Y DPP 116 27.370 -6.610 40.020 1.00 0.00 ATOM 14030 5C31 DPP 116 29.270 -7.870 40.410 1.00 0.00 ATOM 14031 H15X DPP 116 28.880 -8.760 40.950 1.00 0.00 ATOM 14032 H15Y DPP 116 29.430 -7.150 41.240 1.00 0.00 ATOM 14033 6C31 DPP 116 30.600 -8.170 39.740 1.00 0.00 ATOM 14034 H16X DPP 116 30.430 -8.830 38.860 1.00 0.00 ATOM 14035 H16Y DPP 116 31.320 -8.590 40.470 1.00 0.00 ATOM 14036 H16Z DPP 116 31.040 -7.170 39.520 1.00 0.00 ATOM 14037 N DPP 117 49.180 20.030 23.610 1.00 0.00 ATOM 14038 HN1 DPP 117 50.010 19.470 23.320 1.00 0.00 ATOM 14039 HN2 DPP 117 49.290 20.240 24.620 1.00 0.00 ATOM 14040 HN3 DPP 117 48.380 19.410 23.370 1.00 0.00 ATOM 14041 C12 DPP 117 49.120 21.280 22.770 1.00 0.00 ATOM 14042 H12A DPP 117 50.040 21.830 23.040 1.00 0.00 ATOM 14043 H12B DPP 117 49.100 20.930 21.710 1.00 0.00 ATOM 14044 C11 DPP 117 47.760 21.960 23.010 1.00 0.00 ATOM 14045 H11A DPP 117 46.920 21.380 22.580 1.00 0.00 ATOM 14046 H11B DPP 117 47.820 22.890 22.410 1.00 0.00 ATOM 14047 P DPP 117 46.610 23.220 24.860 1.00 0.00 ATOM 14048 O13 DPP 117 45.260 22.760 24.450 1.00 0.00 ATOM 14049 O14 DPP 117 47.040 24.560 24.400 1.00 0.00 ATOM 14050 O11 DPP 117 46.620 23.030 26.450 1.00 0.00 ATOM 14051 O12 DPP 117 47.680 22.110 24.420 1.00 0.00 ATOM 14052 C1 DPP 117 46.450 21.720 26.980 1.00 0.00 ATOM 14053 HA DPP 117 47.320 21.630 27.670 1.00 0.00 ATOM 14054 HB DPP 117 46.530 20.950 26.180 1.00 0.00 ATOM 14055 C2 DPP 117 45.130 21.590 27.760 1.00 0.00 ATOM 14056 HS DPP 117 44.320 21.620 27.000 1.00 0.00 ATOM 14057 O21 DPP 117 44.970 22.670 28.680 1.00 0.00 ATOM 14058 C21 DPP 117 43.720 23.140 28.720 1.00 0.00 ATOM 14059 O22 DPP 117 42.710 22.730 28.160 1.00 0.00 ATOM 14060 C22 DPP 117 43.660 24.380 29.600 1.00 0.00 ATOM 14061 H2R DPP 117 43.430 25.260 28.970 1.00 0.00 ATOM 14062 H2S DPP 117 44.680 24.520 30.010 1.00 0.00 ATOM 14063 C3 DPP 117 45.070 20.220 28.460 1.00 0.00 ATOM 14064 HX DPP 117 45.960 20.150 29.120 1.00 0.00 ATOM 14065 HY DPP 117 45.080 19.390 27.730 1.00 0.00 ATOM 14066 O31 DPP 117 43.930 20.030 29.310 1.00 0.00 ATOM 14067 C31 DPP 117 42.900 19.450 28.680 1.00 0.00 ATOM 14068 O32 DPP 117 42.730 19.360 27.480 1.00 0.00 ATOM 14069 C32 DPP 117 41.890 18.920 29.690 1.00 0.00 ATOM 14070 H2X DPP 117 42.420 18.550 30.600 1.00 0.00 ATOM 14071 H2Y DPP 117 41.250 18.150 29.220 1.00 0.00 ATOM 14072 C23 DPP 117 42.660 24.200 30.740 1.00 0.00 ATOM 14073 H3R DPP 117 42.640 23.100 30.830 1.00 0.00 ATOM 14074 H3S DPP 117 41.700 24.700 30.460 1.00 0.00 ATOM 14075 C24 DPP 117 43.160 24.940 31.980 1.00 0.00 ATOM 14076 H4R DPP 117 43.190 26.050 32.010 1.00 0.00 ATOM 14077 H4S DPP 117 44.230 24.700 32.130 1.00 0.00 ATOM 14078 C25 DPP 117 42.410 24.340 33.170 1.00 0.00 ATOM 14079 H5R DPP 117 42.840 24.740 34.110 1.00 0.00 ATOM 14080 H5S DPP 117 42.310 23.240 33.210 1.00 0.00 ATOM 14081 C26 DPP 117 40.940 24.770 33.240 1.00 0.00 ATOM 14082 H6R DPP 117 40.400 24.640 32.280 1.00 0.00 ATOM 14083 H6S DPP 117 40.960 25.810 33.620 1.00 0.00 ATOM 14084 C27 DPP 117 40.240 23.910 34.300 1.00 0.00 ATOM 14085 H7R DPP 117 40.490 22.830 34.170 1.00 0.00 ATOM 14086 H7S DPP 117 39.150 24.110 34.230 1.00 0.00 ATOM 14087 C28 DPP 117 40.510 24.310 35.750 1.00 0.00 ATOM 14088 H8R DPP 117 41.590 24.280 36.000 1.00 0.00 ATOM 14089 H8S DPP 117 40.030 23.530 36.390 1.00 0.00 ATOM 14090 C29 DPP 117 40.050 25.730 36.090 1.00 0.00 ATOM 14091 H9R DPP 117 39.350 25.770 36.950 1.00 0.00 ATOM 14092 H9S DPP 117 39.390 26.140 35.300 1.00 0.00 ATOM 14093 0C21 DPP 117 41.090 26.810 36.390 1.00 0.00 ATOM 14094 H10R DPP 117 40.510 27.760 36.460 1.00 0.00 ATOM 14095 H10S DPP 117 41.610 27.030 35.430 1.00 0.00 ATOM 14096 1C21 DPP 117 42.070 26.790 37.560 1.00 0.00 ATOM 14097 H11R DPP 117 42.840 26.030 37.290 1.00 0.00 ATOM 14098 H11S DPP 117 41.620 26.570 38.550 1.00 0.00 ATOM 14099 2C21 DPP 117 42.740 28.140 37.810 1.00 0.00 ATOM 14100 H12R DPP 117 42.970 28.710 36.890 1.00 0.00 ATOM 14101 H12S DPP 117 43.690 27.830 38.290 1.00 0.00 ATOM 14102 3C21 DPP 117 41.910 28.930 38.820 1.00 0.00 ATOM 14103 H13R DPP 117 41.540 28.270 39.630 1.00 0.00 ATOM 14104 H13S DPP 117 40.940 29.180 38.330 1.00 0.00 ATOM 14105 4C21 DPP 117 42.680 30.190 39.210 1.00 0.00 ATOM 14106 H14R DPP 117 42.040 31.050 39.500 1.00 0.00 ATOM 14107 H14S DPP 117 43.330 30.490 38.360 1.00 0.00 ATOM 14108 5C21 DPP 117 43.490 29.870 40.470 1.00 0.00 ATOM 14109 H15R DPP 117 44.290 29.130 40.240 1.00 0.00 ATOM 14110 H15S DPP 117 42.830 29.410 41.240 1.00 0.00 ATOM 14111 6C21 DPP 117 44.090 31.100 41.150 1.00 0.00 ATOM 14112 H16R DPP 117 44.690 30.860 42.060 1.00 0.00 ATOM 14113 H16S DPP 117 43.280 31.780 41.480 1.00 0.00 ATOM 14114 H16T DPP 117 44.610 31.720 40.390 1.00 0.00 ATOM 14115 C33 DPP 117 40.820 19.990 29.930 1.00 0.00 ATOM 14116 H3X DPP 117 40.490 20.200 28.890 1.00 0.00 ATOM 14117 H3Y DPP 117 41.270 20.890 30.410 1.00 0.00 ATOM 14118 C34 DPP 117 39.610 19.500 30.720 1.00 0.00 ATOM 14119 H4X DPP 117 38.850 18.890 30.180 1.00 0.00 ATOM 14120 H4Y DPP 117 39.070 20.440 30.970 1.00 0.00 ATOM 14121 C35 DPP 117 39.940 18.840 32.060 1.00 0.00 ATOM 14122 H5X DPP 117 40.430 19.520 32.780 1.00 0.00 ATOM 14123 H5Y DPP 117 40.700 18.040 31.900 1.00 0.00 ATOM 14124 C36 DPP 117 38.690 18.310 32.760 1.00 0.00 ATOM 14125 H6X DPP 117 38.980 17.980 33.780 1.00 0.00 ATOM 14126 H6Y DPP 117 38.320 17.390 32.260 1.00 0.00 ATOM 14127 C37 DPP 117 37.610 19.380 32.920 1.00 0.00 ATOM 14128 H7X DPP 117 36.620 18.940 33.170 1.00 0.00 ATOM 14129 H7Y DPP 117 37.370 19.870 31.950 1.00 0.00 ATOM 14130 C38 DPP 117 37.870 20.570 33.840 1.00 0.00 ATOM 14131 H8X DPP 117 37.090 21.350 33.700 1.00 0.00 ATOM 14132 H8Y DPP 117 38.910 20.960 33.770 1.00 0.00 ATOM 14133 C39 DPP 117 37.800 20.120 35.300 1.00 0.00 ATOM 14134 H9X DPP 117 38.450 19.230 35.490 1.00 0.00 ATOM 14135 H9Y DPP 117 36.760 19.840 35.550 1.00 0.00 ATOM 14136 0C31 DPP 117 38.240 21.200 36.290 1.00 0.00 ATOM 14137 H10X DPP 117 37.700 22.170 36.250 1.00 0.00 ATOM 14138 H10Y DPP 117 39.300 21.450 36.080 1.00 0.00 ATOM 14139 1C31 DPP 117 38.230 20.610 37.700 1.00 0.00 ATOM 14140 H11X DPP 117 38.800 19.660 37.700 1.00 0.00 ATOM 14141 H11Y DPP 117 37.160 20.440 37.970 1.00 0.00 ATOM 14142 2C31 DPP 117 38.680 21.720 38.660 1.00 0.00 ATOM 14143 H12X DPP 117 38.000 22.600 38.660 1.00 0.00 ATOM 14144 H12Y DPP 117 39.730 22.030 38.510 1.00 0.00 ATOM 14145 3C31 DPP 117 38.600 21.140 40.070 1.00 0.00 ATOM 14146 H13X DPP 117 39.170 20.190 39.930 1.00 0.00 ATOM 14147 H13Y DPP 117 37.530 20.880 40.200 1.00 0.00 ATOM 14148 4C31 DPP 117 39.290 21.970 41.150 1.00 0.00 ATOM 14149 H14X DPP 117 38.850 22.980 41.000 1.00 0.00 ATOM 14150 H14Y DPP 117 40.400 21.890 41.050 1.00 0.00 ATOM 14151 5C31 DPP 117 38.980 21.570 42.600 1.00 0.00 ATOM 14152 H15X DPP 117 37.900 21.480 42.820 1.00 0.00 ATOM 14153 H15Y DPP 117 39.390 22.410 43.200 1.00 0.00 ATOM 14154 6C31 DPP 117 39.750 20.350 43.120 1.00 0.00 ATOM 14155 H16X DPP 117 39.180 19.900 43.960 1.00 0.00 ATOM 14156 H16Y DPP 117 40.730 20.640 43.560 1.00 0.00 ATOM 14157 H16Z DPP 117 39.890 19.590 42.330 1.00 0.00 ATOM 14158 N DPP 118 25.450 11.710 21.380 1.00 0.00 ATOM 14159 HN1 DPP 118 25.920 12.440 21.950 1.00 0.00 ATOM 14160 HN2 DPP 118 24.410 11.730 21.430 1.00 0.00 ATOM 14161 HN3 DPP 118 25.760 10.830 21.850 1.00 0.00 ATOM 14162 C12 DPP 118 26.050 11.510 20.010 1.00 0.00 ATOM 14163 H12A DPP 118 25.590 12.290 19.360 1.00 0.00 ATOM 14164 H12B DPP 118 25.690 10.500 19.720 1.00 0.00 ATOM 14165 C11 DPP 118 27.580 11.530 20.070 1.00 0.00 ATOM 14166 H11A DPP 118 27.820 12.550 20.440 1.00 0.00 ATOM 14167 H11B DPP 118 27.910 11.450 19.010 1.00 0.00 ATOM 14168 P DPP 118 29.510 10.020 20.260 1.00 0.00 ATOM 14169 O13 DPP 118 30.310 11.260 20.220 1.00 0.00 ATOM 14170 O14 DPP 118 29.230 9.300 18.990 1.00 0.00 ATOM 14171 O11 DPP 118 30.100 9.010 21.350 1.00 0.00 ATOM 14172 O12 DPP 118 28.110 10.480 20.880 1.00 0.00 ATOM 14173 C1 DPP 118 29.200 8.090 21.950 1.00 0.00 ATOM 14174 HA DPP 118 29.850 7.260 22.310 1.00 0.00 ATOM 14175 HB DPP 118 28.390 7.730 21.280 1.00 0.00 ATOM 14176 C2 DPP 118 28.480 8.570 23.220 1.00 0.00 ATOM 14177 HS DPP 118 27.800 9.420 22.990 1.00 0.00 ATOM 14178 O21 DPP 118 29.450 8.910 24.220 1.00 0.00 ATOM 14179 C21 DPP 118 28.930 9.680 25.180 1.00 0.00 ATOM 14180 O22 DPP 118 27.750 9.920 25.400 1.00 0.00 ATOM 14181 C22 DPP 118 30.070 10.240 26.010 1.00 0.00 ATOM 14182 H2R DPP 118 30.990 10.570 25.480 1.00 0.00 ATOM 14183 H2S DPP 118 30.360 9.280 26.490 1.00 0.00 ATOM 14184 C3 DPP 118 27.590 7.440 23.750 1.00 0.00 ATOM 14185 HX DPP 118 26.980 7.070 22.890 1.00 0.00 ATOM 14186 HY DPP 118 26.850 7.970 24.390 1.00 0.00 ATOM 14187 O31 DPP 118 28.280 6.400 24.450 1.00 0.00 ATOM 14188 C31 DPP 118 28.160 5.160 23.950 1.00 0.00 ATOM 14189 O32 DPP 118 27.840 4.930 22.800 1.00 0.00 ATOM 14190 C32 DPP 118 28.520 4.100 24.990 1.00 0.00 ATOM 14191 H2X DPP 118 29.620 4.080 25.190 1.00 0.00 ATOM 14192 H2Y DPP 118 28.160 3.160 24.520 1.00 0.00 ATOM 14193 C23 DPP 118 29.560 11.260 27.020 1.00 0.00 ATOM 14194 H3R DPP 118 28.590 10.990 27.500 1.00 0.00 ATOM 14195 H3S DPP 118 29.330 12.170 26.420 1.00 0.00 ATOM 14196 C24 DPP 118 30.570 11.650 28.100 1.00 0.00 ATOM 14197 H4R DPP 118 31.500 12.050 27.640 1.00 0.00 ATOM 14198 H4S DPP 118 30.880 10.640 28.450 1.00 0.00 ATOM 14199 C25 DPP 118 29.770 12.530 29.070 1.00 0.00 ATOM 14200 H5R DPP 118 28.740 12.170 29.290 1.00 0.00 ATOM 14201 H5S DPP 118 29.600 13.480 28.530 1.00 0.00 ATOM 14202 C26 DPP 118 30.340 12.850 30.440 1.00 0.00 ATOM 14203 H6R DPP 118 31.380 13.080 30.130 1.00 0.00 ATOM 14204 H6S DPP 118 30.450 11.900 31.000 1.00 0.00 ATOM 14205 C27 DPP 118 29.450 13.740 31.310 1.00 0.00 ATOM 14206 H7R DPP 118 28.580 13.110 31.590 1.00 0.00 ATOM 14207 H7S DPP 118 29.170 14.710 30.850 1.00 0.00 ATOM 14208 C28 DPP 118 29.990 14.130 32.690 1.00 0.00 ATOM 14209 H8R DPP 118 29.300 14.880 33.140 1.00 0.00 ATOM 14210 H8S DPP 118 31.020 14.530 32.590 1.00 0.00 ATOM 14211 C29 DPP 118 30.140 12.910 33.610 1.00 0.00 ATOM 14212 H9R DPP 118 30.670 12.100 33.050 1.00 0.00 ATOM 14213 H9S DPP 118 29.180 12.570 34.050 1.00 0.00 ATOM 14214 0C21 DPP 118 30.910 13.220 34.890 1.00 0.00 ATOM 14215 H10R DPP 118 30.290 13.680 35.680 1.00 0.00 ATOM 14216 H10S DPP 118 31.720 13.910 34.540 1.00 0.00 ATOM 14217 1C21 DPP 118 31.700 12.030 35.450 1.00 0.00 ATOM 14218 H11R DPP 118 32.310 11.670 34.590 1.00 0.00 ATOM 14219 H11S DPP 118 31.000 11.310 35.920 1.00 0.00 ATOM 14220 2C21 DPP 118 32.760 12.570 36.410 1.00 0.00 ATOM 14221 H12R DPP 118 32.230 12.900 37.330 1.00 0.00 ATOM 14222 H12S DPP 118 33.430 13.340 35.970 1.00 0.00 ATOM 14223 3C21 DPP 118 33.790 11.480 36.730 1.00 0.00 ATOM 14224 H13R DPP 118 34.520 11.920 37.450 1.00 0.00 ATOM 14225 H13S DPP 118 34.370 11.260 35.810 1.00 0.00 ATOM 14226 4C21 DPP 118 33.140 10.200 37.240 1.00 0.00 ATOM 14227 H14R DPP 118 32.670 9.630 36.400 1.00 0.00 ATOM 14228 H14S DPP 118 32.410 10.400 38.050 1.00 0.00 ATOM 14229 5C21 DPP 118 34.120 9.150 37.760 1.00 0.00 ATOM 14230 H15R DPP 118 34.900 9.760 38.270 1.00 0.00 ATOM 14231 H15S DPP 118 34.610 8.670 36.890 1.00 0.00 ATOM 14232 6C21 DPP 118 33.510 8.180 38.770 1.00 0.00 ATOM 14233 H16R DPP 118 34.290 7.390 38.900 1.00 0.00 ATOM 14234 H16S DPP 118 32.590 7.710 38.370 1.00 0.00 ATOM 14235 H16T DPP 118 33.420 8.740 39.730 1.00 0.00 ATOM 14236 C33 DPP 118 27.830 4.270 26.340 1.00 0.00 ATOM 14237 H3X DPP 118 26.910 4.890 26.310 1.00 0.00 ATOM 14238 H3Y DPP 118 28.610 4.810 26.920 1.00 0.00 ATOM 14239 C34 DPP 118 27.720 2.940 27.090 1.00 0.00 ATOM 14240 H4X DPP 118 28.720 2.450 27.160 1.00 0.00 ATOM 14241 H4Y DPP 118 26.970 2.420 26.460 1.00 0.00 ATOM 14242 C35 DPP 118 27.210 3.080 28.520 1.00 0.00 ATOM 14243 H5X DPP 118 27.820 3.930 28.880 1.00 0.00 ATOM 14244 H5Y DPP 118 27.440 2.180 29.130 1.00 0.00 ATOM 14245 C36 DPP 118 25.720 3.390 28.710 1.00 0.00 ATOM 14246 H6X DPP 118 25.220 2.490 28.280 1.00 0.00 ATOM 14247 H6Y DPP 118 25.370 4.120 27.950 1.00 0.00 ATOM 14248 C37 DPP 118 25.270 3.590 30.150 1.00 0.00 ATOM 14249 H7X DPP 118 25.990 4.250 30.670 1.00 0.00 ATOM 14250 H7Y DPP 118 25.330 2.650 30.750 1.00 0.00 ATOM 14251 C38 DPP 118 23.800 4.040 30.210 1.00 0.00 ATOM 14252 H8X DPP 118 23.240 3.310 29.590 1.00 0.00 ATOM 14253 H8Y DPP 118 23.750 5.060 29.770 1.00 0.00 ATOM 14254 C39 DPP 118 23.150 3.930 31.590 1.00 0.00 ATOM 14255 H9X DPP 118 22.240 4.560 31.660 1.00 0.00 ATOM 14256 H9Y DPP 118 23.920 4.240 32.330 1.00 0.00 ATOM 14257 0C31 DPP 118 22.700 2.500 31.870 1.00 0.00 ATOM 14258 H10X DPP 118 23.470 1.740 31.620 1.00 0.00 ATOM 14259 H10Y DPP 118 21.780 2.350 31.260 1.00 0.00 ATOM 14260 1C31 DPP 118 22.170 2.250 33.280 1.00 0.00 ATOM 14261 H11X DPP 118 21.220 2.830 33.330 1.00 0.00 ATOM 14262 H11Y DPP 118 22.960 2.580 34.000 1.00 0.00 ATOM 14263 2C31 DPP 118 21.920 0.760 33.530 1.00 0.00 ATOM 14264 H12X DPP 118 22.980 0.450 33.460 1.00 0.00 ATOM 14265 H12Y DPP 118 21.280 0.200 32.810 1.00 0.00 ATOM 14266 3C31 DPP 118 21.310 0.570 34.920 1.00 0.00 ATOM 14267 H13X DPP 118 20.250 0.910 34.970 1.00 0.00 ATOM 14268 H13Y DPP 118 21.900 1.050 35.730 1.00 0.00 ATOM 14269 4C31 DPP 118 21.290 -0.880 35.390 1.00 0.00 ATOM 14270 H14X DPP 118 20.580 -1.500 34.800 1.00 0.00 ATOM 14271 H14Y DPP 118 20.920 -0.960 36.430 1.00 0.00 ATOM 14272 5C31 DPP 118 22.700 -1.480 35.330 1.00 0.00 ATOM 14273 H15X DPP 118 23.420 -0.770 35.790 1.00 0.00 ATOM 14274 H15Y DPP 118 23.010 -1.820 34.320 1.00 0.00 ATOM 14275 6C31 DPP 118 22.830 -2.730 36.190 1.00 0.00 ATOM 14276 H16X DPP 118 23.820 -3.220 36.260 1.00 0.00 ATOM 14277 H16Y DPP 118 22.070 -3.550 36.180 1.00 0.00 ATOM 14278 H16Z DPP 118 22.800 -2.410 37.250 1.00 0.00 ATOM 14279 N DPP 119 50.800 50.600 19.140 1.00 0.00 ATOM 14280 HN1 DPP 119 49.800 50.890 19.170 1.00 0.00 ATOM 14281 HN2 DPP 119 50.860 49.560 19.100 1.00 0.00 ATOM 14282 HN3 DPP 119 51.300 50.960 19.980 1.00 0.00 ATOM 14283 C12 DPP 119 51.180 51.200 17.800 1.00 0.00 ATOM 14284 H12A DPP 119 50.590 50.750 16.980 1.00 0.00 ATOM 14285 H12B DPP 119 51.120 52.310 17.830 1.00 0.00 ATOM 14286 C11 DPP 119 52.670 50.970 17.550 1.00 0.00 ATOM 14287 H11A DPP 119 53.090 51.450 16.640 1.00 0.00 ATOM 14288 H11B DPP 119 52.880 49.910 17.300 1.00 0.00 ATOM 14289 P DPP 119 54.790 50.260 18.660 1.00 0.00 ATOM 14290 O13 DPP 119 55.600 50.690 17.500 1.00 0.00 ATOM 14291 O14 DPP 119 54.540 48.810 18.810 1.00 0.00 ATOM 14292 O11 DPP 119 55.620 50.710 19.950 1.00 0.00 ATOM 14293 O12 DPP 119 53.460 51.150 18.720 1.00 0.00 ATOM 14294 C1 DPP 119 56.120 52.020 20.220 1.00 0.00 ATOM 14295 HA DPP 119 55.430 52.660 20.800 1.00 0.00 ATOM 14296 HB DPP 119 56.430 52.570 19.310 1.00 0.00 ATOM 14297 C2 DPP 119 57.440 51.890 21.010 1.00 0.00 ATOM 14298 HS DPP 119 58.090 51.230 20.400 1.00 0.00 ATOM 14299 O21 DPP 119 57.310 51.180 22.240 1.00 0.00 ATOM 14300 C21 DPP 119 58.430 50.810 22.860 1.00 0.00 ATOM 14301 O22 DPP 119 59.560 51.050 22.450 1.00 0.00 ATOM 14302 C22 DPP 119 58.100 49.950 24.070 1.00 0.00 ATOM 14303 H2R DPP 119 58.470 48.900 24.050 1.00 0.00 ATOM 14304 H2S DPP 119 57.010 50.050 24.220 1.00 0.00 ATOM 14305 C3 DPP 119 58.130 53.260 21.110 1.00 0.00 ATOM 14306 HX DPP 119 58.390 53.600 20.090 1.00 0.00 ATOM 14307 HY DPP 119 59.140 53.170 21.580 1.00 0.00 ATOM 14308 O31 DPP 119 57.240 54.210 21.700 1.00 0.00 ATOM 14309 C31 DPP 119 57.410 54.260 23.030 1.00 0.00 ATOM 14310 O32 DPP 119 58.070 53.480 23.700 1.00 0.00 ATOM 14311 C32 DPP 119 56.580 55.400 23.610 1.00 0.00 ATOM 14312 H2X DPP 119 55.510 55.110 23.510 1.00 0.00 ATOM 14313 H2Y DPP 119 56.670 56.380 23.100 1.00 0.00 ATOM 14314 C23 DPP 119 58.940 50.340 25.290 1.00 0.00 ATOM 14315 H3R DPP 119 58.840 51.420 25.540 1.00 0.00 ATOM 14316 H3S DPP 119 60.000 50.000 25.260 1.00 0.00 ATOM 14317 C24 DPP 119 58.190 49.740 26.470 1.00 0.00 ATOM 14318 H4R DPP 119 58.060 48.650 26.300 1.00 0.00 ATOM 14319 H4S DPP 119 57.160 50.140 26.570 1.00 0.00 ATOM 14320 C25 DPP 119 58.810 49.950 27.860 1.00 0.00 ATOM 14321 H5R DPP 119 59.160 51.000 27.940 1.00 0.00 ATOM 14322 H5S DPP 119 59.700 49.320 28.050 1.00 0.00 ATOM 14323 C26 DPP 119 57.830 49.570 28.970 1.00 0.00 ATOM 14324 H6R DPP 119 58.040 48.500 29.190 1.00 0.00 ATOM 14325 H6S DPP 119 56.750 49.720 28.750 1.00 0.00 ATOM 14326 C27 DPP 119 58.030 50.400 30.240 1.00 0.00 ATOM 14327 H7R DPP 119 57.450 49.900 31.040 1.00 0.00 ATOM 14328 H7S DPP 119 57.540 51.380 30.020 1.00 0.00 ATOM 14329 C28 DPP 119 59.480 50.410 30.720 1.00 0.00 ATOM 14330 H8R DPP 119 60.110 50.920 29.970 1.00 0.00 ATOM 14331 H8S DPP 119 59.830 49.360 30.660 1.00 0.00 ATOM 14332 C29 DPP 119 59.710 50.900 32.150 1.00 0.00 ATOM 14333 H9R DPP 119 58.930 50.410 32.770 1.00 0.00 ATOM 14334 H9S DPP 119 59.390 51.970 32.110 1.00 0.00 ATOM 14335 0C21 DPP 119 61.110 50.550 32.660 1.00 0.00 ATOM 14336 H10R DPP 119 61.800 51.150 32.020 1.00 0.00 ATOM 14337 H10S DPP 119 61.090 49.450 32.540 1.00 0.00 ATOM 14338 1C21 DPP 119 61.470 50.890 34.100 1.00 0.00 ATOM 14339 H11R DPP 119 61.690 51.980 34.180 1.00 0.00 ATOM 14340 H11S DPP 119 62.450 50.390 34.220 1.00 0.00 ATOM 14341 2C21 DPP 119 60.380 50.330 35.020 1.00 0.00 ATOM 14342 H12R DPP 119 60.150 49.330 34.590 1.00 0.00 ATOM 14343 H12S DPP 119 59.490 50.990 35.080 1.00 0.00 ATOM 14344 3C21 DPP 119 60.880 50.140 36.450 1.00 0.00 ATOM 14345 H13R DPP 119 61.360 51.060 36.850 1.00 0.00 ATOM 14346 H13S DPP 119 61.750 49.440 36.440 1.00 0.00 ATOM 14347 4C21 DPP 119 59.760 49.650 37.370 1.00 0.00 ATOM 14348 H14R DPP 119 60.320 49.210 38.230 1.00 0.00 ATOM 14349 H14S DPP 119 59.100 48.840 36.990 1.00 0.00 ATOM 14350 5C21 DPP 119 58.930 50.800 37.920 1.00 0.00 ATOM 14351 H15R DPP 119 58.380 51.450 37.200 1.00 0.00 ATOM 14352 H15S DPP 119 59.680 51.370 38.510 1.00 0.00 ATOM 14353 6C21 DPP 119 58.060 50.420 39.120 1.00 0.00 ATOM 14354 H16R DPP 119 57.510 49.510 38.780 1.00 0.00 ATOM 14355 H16S DPP 119 57.420 51.260 39.450 1.00 0.00 ATOM 14356 H16T DPP 119 58.700 50.070 39.960 1.00 0.00 ATOM 14357 C33 DPP 119 56.930 55.410 25.100 1.00 0.00 ATOM 14358 H3X DPP 119 56.630 56.440 25.390 1.00 0.00 ATOM 14359 H3Y DPP 119 58.000 55.220 25.310 1.00 0.00 ATOM 14360 C34 DPP 119 56.140 54.390 25.930 1.00 0.00 ATOM 14361 H4X DPP 119 56.240 53.440 25.350 1.00 0.00 ATOM 14362 H4Y DPP 119 55.060 54.600 26.070 1.00 0.00 ATOM 14363 C35 DPP 119 56.980 54.250 27.200 1.00 0.00 ATOM 14364 H5X DPP 119 57.250 55.280 27.540 1.00 0.00 ATOM 14365 H5Y DPP 119 57.890 53.620 27.080 1.00 0.00 ATOM 14366 C36 DPP 119 56.110 53.670 28.320 1.00 0.00 ATOM 14367 H6X DPP 119 56.070 52.570 28.210 1.00 0.00 ATOM 14368 H6Y DPP 119 55.090 54.120 28.310 1.00 0.00 ATOM 14369 C37 DPP 119 56.520 53.970 29.760 1.00 0.00 ATOM 14370 H7X DPP 119 56.820 55.040 29.820 1.00 0.00 ATOM 14371 H7Y DPP 119 57.480 53.440 29.920 1.00 0.00 ATOM 14372 C38 DPP 119 55.530 53.620 30.880 1.00 0.00 ATOM 14373 H8X DPP 119 54.880 52.830 30.450 1.00 0.00 ATOM 14374 H8Y DPP 119 54.850 54.480 31.050 1.00 0.00 ATOM 14375 C39 DPP 119 56.160 53.270 32.230 1.00 0.00 ATOM 14376 H9X DPP 119 56.800 54.130 32.520 1.00 0.00 ATOM 14377 H9Y DPP 119 56.850 52.400 32.160 1.00 0.00 ATOM 14378 0C31 DPP 119 55.210 53.170 33.420 1.00 0.00 ATOM 14379 H10X DPP 119 54.800 52.170 33.690 1.00 0.00 ATOM 14380 H10Y DPP 119 54.360 53.860 33.280 1.00 0.00 ATOM 14381 1C31 DPP 119 55.880 53.630 34.720 1.00 0.00 ATOM 14382 H11X DPP 119 56.250 54.670 34.610 1.00 0.00 ATOM 14383 H11Y DPP 119 56.760 52.950 34.690 1.00 0.00 ATOM 14384 2C31 DPP 119 55.070 53.450 36.000 1.00 0.00 ATOM 14385 H12X DPP 119 55.050 52.350 36.170 1.00 0.00 ATOM 14386 H12Y DPP 119 54.010 53.790 35.980 1.00 0.00 ATOM 14387 3C31 DPP 119 55.710 53.990 37.280 1.00 0.00 ATOM 14388 H13X DPP 119 55.470 55.070 37.410 1.00 0.00 ATOM 14389 H13Y DPP 119 56.760 53.640 37.280 1.00 0.00 ATOM 14390 4C31 DPP 119 55.110 53.240 38.480 1.00 0.00 ATOM 14391 H14X DPP 119 54.960 52.150 38.330 1.00 0.00 ATOM 14392 H14Y DPP 119 54.110 53.680 38.650 1.00 0.00 ATOM 14393 5C31 DPP 119 55.850 53.520 39.790 1.00 0.00 ATOM 14394 H15X DPP 119 55.620 54.540 40.160 1.00 0.00 ATOM 14395 H15Y DPP 119 56.950 53.540 39.630 1.00 0.00 ATOM 14396 6C31 DPP 119 55.550 52.490 40.870 1.00 0.00 ATOM 14397 H16X DPP 119 55.600 51.430 40.540 1.00 0.00 ATOM 14398 H16Y DPP 119 54.490 52.770 41.040 1.00 0.00 ATOM 14399 H16Z DPP 119 56.260 52.710 41.700 1.00 0.00 ATOM 14400 N DPP 120 57.520 3.530 26.020 1.00 0.00 ATOM 14401 HN1 DPP 120 58.130 4.370 25.990 1.00 0.00 ATOM 14402 HN2 DPP 120 58.210 2.760 25.890 1.00 0.00 ATOM 14403 HN3 DPP 120 56.770 3.580 25.310 1.00 0.00 ATOM 14404 C12 DPP 120 57.040 3.560 27.450 1.00 0.00 ATOM 14405 H12A DPP 120 56.680 2.540 27.710 1.00 0.00 ATOM 14406 H12B DPP 120 57.930 3.810 28.070 1.00 0.00 ATOM 14407 C11 DPP 120 55.910 4.570 27.660 1.00 0.00 ATOM 14408 H11A DPP 120 56.400 5.570 27.600 1.00 0.00 ATOM 14409 H11B DPP 120 55.510 4.510 28.690 1.00 0.00 ATOM 14410 P DPP 120 54.230 5.640 26.130 1.00 0.00 ATOM 14411 O13 DPP 120 53.040 5.200 25.360 1.00 0.00 ATOM 14412 O14 DPP 120 55.090 6.620 25.440 1.00 0.00 ATOM 14413 O11 DPP 120 53.840 6.340 27.510 1.00 0.00 ATOM 14414 O12 DPP 120 54.980 4.310 26.610 1.00 0.00 ATOM 14415 C1 DPP 120 52.690 5.880 28.240 1.00 0.00 ATOM 14416 HA DPP 120 52.730 4.770 28.230 1.00 0.00 ATOM 14417 HB DPP 120 51.760 6.190 27.730 1.00 0.00 ATOM 14418 C2 DPP 120 52.830 6.330 29.700 1.00 0.00 ATOM 14419 HS DPP 120 52.300 7.300 29.690 1.00 0.00 ATOM 14420 O21 DPP 120 54.240 6.290 29.960 1.00 0.00 ATOM 14421 C21 DPP 120 54.600 7.380 30.640 1.00 0.00 ATOM 14422 O22 DPP 120 53.880 8.230 31.140 1.00 0.00 ATOM 14423 C22 DPP 120 56.110 7.310 30.840 1.00 0.00 ATOM 14424 H2R DPP 120 56.640 8.020 30.170 1.00 0.00 ATOM 14425 H2S DPP 120 56.520 6.310 30.570 1.00 0.00 ATOM 14426 C3 DPP 120 52.050 5.330 30.580 1.00 0.00 ATOM 14427 HX DPP 120 52.590 4.360 30.590 1.00 0.00 ATOM 14428 HY DPP 120 51.040 5.190 30.130 1.00 0.00 ATOM 14429 O31 DPP 120 51.960 5.780 31.930 1.00 0.00 ATOM 14430 C31 DPP 120 50.880 6.510 32.220 1.00 0.00 ATOM 14431 O32 DPP 120 50.140 6.960 31.360 1.00 0.00 ATOM 14432 C32 DPP 120 50.770 6.910 33.690 1.00 0.00 ATOM 14433 H2X DPP 120 50.010 6.230 34.130 1.00 0.00 ATOM 14434 H2Y DPP 120 50.650 8.010 33.800 1.00 0.00 ATOM 14435 C23 DPP 120 56.470 7.430 32.320 1.00 0.00 ATOM 14436 H3R DPP 120 55.830 6.830 32.990 1.00 0.00 ATOM 14437 H3S DPP 120 56.340 8.510 32.580 1.00 0.00 ATOM 14438 C24 DPP 120 57.880 6.870 32.500 1.00 0.00 ATOM 14439 H4R DPP 120 58.570 7.230 31.700 1.00 0.00 ATOM 14440 H4S DPP 120 57.720 5.790 32.310 1.00 0.00 ATOM 14441 C25 DPP 120 58.590 6.990 33.850 1.00 0.00 ATOM 14442 H5R DPP 120 57.970 6.630 34.700 1.00 0.00 ATOM 14443 H5S DPP 120 58.840 8.030 34.120 1.00 0.00 ATOM 14444 C26 DPP 120 59.940 6.280 33.990 1.00 0.00 ATOM 14445 H6R DPP 120 60.470 6.860 34.780 1.00 0.00 ATOM 14446 H6S DPP 120 60.410 6.610 33.040 1.00 0.00 ATOM 14447 C27 DPP 120 59.970 4.760 34.190 1.00 0.00 ATOM 14448 H7R DPP 120 59.190 4.230 33.610 1.00 0.00 ATOM 14449 H7S DPP 120 59.850 4.520 35.260 1.00 0.00 ATOM 14450 C28 DPP 120 61.280 4.100 33.760 1.00 0.00 ATOM 14451 H8R DPP 120 61.140 3.040 34.050 1.00 0.00 ATOM 14452 H8S DPP 120 61.290 4.200 32.650 1.00 0.00 ATOM 14453 C29 DPP 120 62.600 4.440 34.460 1.00 0.00 ATOM 14454 H9R DPP 120 62.360 4.490 35.540 1.00 0.00 ATOM 14455 H9S DPP 120 62.730 5.490 34.130 1.00 0.00 ATOM 14456 0C21 DPP 120 63.680 3.480 33.950 1.00 0.00 ATOM 14457 H10R DPP 120 63.990 3.700 32.900 1.00 0.00 ATOM 14458 H10S DPP 120 63.280 2.470 34.150 1.00 0.00 ATOM 14459 1C21 DPP 120 64.990 3.500 34.740 1.00 0.00 ATOM 14460 H11R DPP 120 65.710 2.820 34.250 1.00 0.00 ATOM 14461 H11S DPP 120 64.800 3.080 35.750 1.00 0.00 ATOM 14462 2C21 DPP 120 65.640 4.870 34.910 1.00 0.00 ATOM 14463 H12R DPP 120 65.050 5.630 35.480 1.00 0.00 ATOM 14464 H12S DPP 120 65.720 5.210 33.860 1.00 0.00 ATOM 14465 3C21 DPP 120 67.100 4.810 35.370 1.00 0.00 ATOM 14466 H13R DPP 120 67.460 4.070 34.630 1.00 0.00 ATOM 14467 H13S DPP 120 67.140 4.270 36.340 1.00 0.00 ATOM 14468 4C21 DPP 120 67.910 6.110 35.260 1.00 0.00 ATOM 14469 H14R DPP 120 67.410 6.970 35.770 1.00 0.00 ATOM 14470 H14S DPP 120 67.810 6.330 34.180 1.00 0.00 ATOM 14471 5C21 DPP 120 69.330 5.780 35.720 1.00 0.00 ATOM 14472 H15R DPP 120 70.070 6.590 35.510 1.00 0.00 ATOM 14473 H15S DPP 120 69.650 4.770 35.380 1.00 0.00 ATOM 14474 6C21 DPP 120 69.410 5.880 37.240 1.00 0.00 ATOM 14475 H16R DPP 120 70.470 5.670 37.520 1.00 0.00 ATOM 14476 H16S DPP 120 68.610 5.330 37.760 1.00 0.00 ATOM 14477 H16T DPP 120 69.310 6.950 37.530 1.00 0.00 ATOM 14478 C33 DPP 120 51.980 6.570 34.550 1.00 0.00 ATOM 14479 H3X DPP 120 52.470 5.590 34.370 1.00 0.00 ATOM 14480 H3Y DPP 120 51.610 6.540 35.600 1.00 0.00 ATOM 14481 C34 DPP 120 53.030 7.680 34.480 1.00 0.00 ATOM 14482 H4X DPP 120 52.710 8.740 34.590 1.00 0.00 ATOM 14483 H4Y DPP 120 53.460 7.590 33.460 1.00 0.00 ATOM 14484 C35 DPP 120 54.200 7.420 35.430 1.00 0.00 ATOM 14485 H5X DPP 120 55.030 8.080 35.080 1.00 0.00 ATOM 14486 H5Y DPP 120 54.470 6.350 35.350 1.00 0.00 ATOM 14487 C36 DPP 120 53.780 7.630 36.890 1.00 0.00 ATOM 14488 H6X DPP 120 54.720 7.450 37.460 1.00 0.00 ATOM 14489 H6Y DPP 120 53.030 6.860 37.160 1.00 0.00 ATOM 14490 C37 DPP 120 53.310 9.030 37.310 1.00 0.00 ATOM 14491 H7X DPP 120 52.630 9.580 36.640 1.00 0.00 ATOM 14492 H7Y DPP 120 54.100 9.800 37.370 1.00 0.00 ATOM 14493 C38 DPP 120 52.610 9.100 38.670 1.00 0.00 ATOM 14494 H8X DPP 120 52.020 8.170 38.800 1.00 0.00 ATOM 14495 H8Y DPP 120 51.830 9.900 38.670 1.00 0.00 ATOM 14496 C39 DPP 120 53.560 9.430 39.820 1.00 0.00 ATOM 14497 H9X DPP 120 53.750 10.530 39.820 1.00 0.00 ATOM 14498 H9Y DPP 120 54.510 8.870 39.660 1.00 0.00 ATOM 14499 0C31 DPP 120 52.990 9.020 41.170 1.00 0.00 ATOM 14500 H10X DPP 120 53.730 9.120 42.000 1.00 0.00 ATOM 14501 H10Y DPP 120 52.790 7.930 41.130 1.00 0.00 ATOM 14502 1C31 DPP 120 51.610 9.590 41.510 1.00 0.00 ATOM 14503 H11X DPP 120 50.910 9.390 40.670 1.00 0.00 ATOM 14504 H11Y DPP 120 51.650 10.700 41.600 1.00 0.00 ATOM 14505 2C31 DPP 120 50.990 9.030 42.780 1.00 0.00 ATOM 14506 H12X DPP 120 50.920 7.920 42.680 1.00 0.00 ATOM 14507 H12Y DPP 120 49.970 9.440 42.950 1.00 0.00 ATOM 14508 3C31 DPP 120 51.710 9.260 44.110 1.00 0.00 ATOM 14509 H13X DPP 120 51.730 10.370 44.060 1.00 0.00 ATOM 14510 H13Y DPP 120 52.740 8.860 43.990 1.00 0.00 ATOM 14511 4C31 DPP 120 50.860 8.730 45.280 1.00 0.00 ATOM 14512 H14X DPP 120 50.730 7.630 45.200 1.00 0.00 ATOM 14513 H14Y DPP 120 49.840 9.170 45.370 1.00 0.00 ATOM 14514 5C31 DPP 120 51.670 8.930 46.560 1.00 0.00 ATOM 14515 H15X DPP 120 51.900 10.020 46.570 1.00 0.00 ATOM 14516 H15Y DPP 120 52.650 8.420 46.500 1.00 0.00 ATOM 14517 6C31 DPP 120 50.890 8.520 47.810 1.00 0.00 ATOM 14518 H16X DPP 120 49.830 8.840 47.690 1.00 0.00 ATOM 14519 H16Y DPP 120 51.280 8.990 48.740 1.00 0.00 ATOM 14520 H16Z DPP 120 50.880 7.420 47.960 1.00 0.00 ATOM 14521 N DPP 121 22.880 26.810 22.860 1.00 0.00 ATOM 14522 HN1 DPP 121 21.960 26.340 22.760 1.00 0.00 ATOM 14523 HN2 DPP 121 22.770 27.730 23.340 1.00 0.00 ATOM 14524 HN3 DPP 121 23.300 26.910 21.910 1.00 0.00 ATOM 14525 C12 DPP 121 23.680 25.860 23.720 1.00 0.00 ATOM 14526 H12A DPP 121 23.690 26.310 24.730 1.00 0.00 ATOM 14527 H12B DPP 121 23.050 24.940 23.720 1.00 0.00 ATOM 14528 C11 DPP 121 25.120 25.690 23.240 1.00 0.00 ATOM 14529 H11A DPP 121 25.630 24.980 23.930 1.00 0.00 ATOM 14530 H11B DPP 121 25.670 26.640 23.420 1.00 0.00 ATOM 14531 P DPP 121 26.650 24.720 21.590 1.00 0.00 ATOM 14532 O13 DPP 121 27.060 25.240 20.270 1.00 0.00 ATOM 14533 O14 DPP 121 26.690 23.240 21.690 1.00 0.00 ATOM 14534 O11 DPP 121 27.670 25.410 22.620 1.00 0.00 ATOM 14535 O12 DPP 121 25.190 25.300 21.860 1.00 0.00 ATOM 14536 C1 DPP 121 28.850 24.730 23.050 1.00 0.00 ATOM 14537 HA DPP 121 29.750 25.380 23.070 1.00 0.00 ATOM 14538 HB DPP 121 29.120 23.820 22.460 1.00 0.00 ATOM 14539 C2 DPP 121 28.710 24.260 24.510 1.00 0.00 ATOM 14540 HS DPP 121 29.650 23.740 24.800 1.00 0.00 ATOM 14541 O21 DPP 121 27.580 23.390 24.640 1.00 0.00 ATOM 14542 C21 DPP 121 27.800 22.090 24.460 1.00 0.00 ATOM 14543 O22 DPP 121 28.860 21.600 24.090 1.00 0.00 ATOM 14544 C22 DPP 121 26.530 21.270 24.650 1.00 0.00 ATOM 14545 H2R DPP 121 26.720 20.170 24.650 1.00 0.00 ATOM 14546 H2S DPP 121 25.860 21.530 23.810 1.00 0.00 ATOM 14547 C3 DPP 121 28.710 25.410 25.530 1.00 0.00 ATOM 14548 HX DPP 121 28.480 26.350 24.980 1.00 0.00 ATOM 14549 HY DPP 121 29.720 25.630 25.910 1.00 0.00 ATOM 14550 O31 DPP 121 27.950 25.090 26.700 1.00 0.00 ATOM 14551 C31 DPP 121 26.880 25.850 26.930 1.00 0.00 ATOM 14552 O32 DPP 121 26.600 26.870 26.320 1.00 0.00 ATOM 14553 C32 DPP 121 25.990 25.100 27.900 1.00 0.00 ATOM 14554 H2X DPP 121 26.050 24.010 27.680 1.00 0.00 ATOM 14555 H2Y DPP 121 24.920 25.400 27.760 1.00 0.00 ATOM 14556 C23 DPP 121 25.960 21.490 26.050 1.00 0.00 ATOM 14557 H3R DPP 121 25.300 22.380 26.040 1.00 0.00 ATOM 14558 H3S DPP 121 26.750 21.700 26.800 1.00 0.00 ATOM 14559 C24 DPP 121 25.130 20.350 26.650 1.00 0.00 ATOM 14560 H4R DPP 121 25.770 19.540 27.060 1.00 0.00 ATOM 14561 H4S DPP 121 24.530 19.790 25.900 1.00 0.00 ATOM 14562 C25 DPP 121 24.150 20.930 27.680 1.00 0.00 ATOM 14563 H5R DPP 121 23.290 20.240 27.840 1.00 0.00 ATOM 14564 H5S DPP 121 23.650 21.800 27.210 1.00 0.00 ATOM 14565 C26 DPP 121 24.880 21.260 28.980 1.00 0.00 ATOM 14566 H6R DPP 121 25.490 22.170 28.840 1.00 0.00 ATOM 14567 H6S DPP 121 25.540 20.410 29.240 1.00 0.00 ATOM 14568 C27 DPP 121 23.920 21.700 30.090 1.00 0.00 ATOM 14569 H7R DPP 121 23.020 21.060 30.060 1.00 0.00 ATOM 14570 H7S DPP 121 23.610 22.750 29.870 1.00 0.00 ATOM 14571 C28 DPP 121 24.550 21.740 31.490 1.00 0.00 ATOM 14572 H8R DPP 121 25.190 22.650 31.450 1.00 0.00 ATOM 14573 H8S DPP 121 25.210 20.870 31.700 1.00 0.00 ATOM 14574 C29 DPP 121 23.570 22.040 32.620 1.00 0.00 ATOM 14575 H9R DPP 121 22.980 21.120 32.770 1.00 0.00 ATOM 14576 H9S DPP 121 22.950 22.810 32.120 1.00 0.00 ATOM 14577 0C21 DPP 121 24.110 22.610 33.940 1.00 0.00 ATOM 14578 H10R DPP 121 23.290 22.660 34.690 1.00 0.00 ATOM 14579 H10S DPP 121 24.380 23.640 33.610 1.00 0.00 ATOM 14580 1C21 DPP 121 25.400 22.020 34.490 1.00 0.00 ATOM 14581 H11R DPP 121 25.720 22.700 35.320 1.00 0.00 ATOM 14582 H11S DPP 121 26.170 22.160 33.700 1.00 0.00 ATOM 14583 2C21 DPP 121 25.220 20.610 35.050 1.00 0.00 ATOM 14584 H12R DPP 121 26.240 20.210 35.200 1.00 0.00 ATOM 14585 H12S DPP 121 24.640 20.080 34.260 1.00 0.00 ATOM 14586 3C21 DPP 121 24.490 20.580 36.400 1.00 0.00 ATOM 14587 H13R DPP 121 23.470 21.020 36.270 1.00 0.00 ATOM 14588 H13S DPP 121 24.980 21.190 37.180 1.00 0.00 ATOM 14589 4C21 DPP 121 24.290 19.170 36.940 1.00 0.00 ATOM 14590 H14R DPP 121 25.320 18.780 37.070 1.00 0.00 ATOM 14591 H14S DPP 121 23.860 18.650 36.060 1.00 0.00 ATOM 14592 5C21 DPP 121 23.460 18.970 38.210 1.00 0.00 ATOM 14593 H15R DPP 121 22.470 19.330 37.860 1.00 0.00 ATOM 14594 H15S DPP 121 23.640 19.750 38.970 1.00 0.00 ATOM 14595 6C21 DPP 121 23.430 17.560 38.810 1.00 0.00 ATOM 14596 H16R DPP 121 24.380 17.450 39.370 1.00 0.00 ATOM 14597 H16S DPP 121 23.290 16.770 38.040 1.00 0.00 ATOM 14598 H16T DPP 121 22.580 17.420 39.500 1.00 0.00 ATOM 14599 C33 DPP 121 26.590 25.420 29.270 1.00 0.00 ATOM 14600 H3X DPP 121 25.750 25.440 30.000 1.00 0.00 ATOM 14601 H3Y DPP 121 27.220 26.330 29.230 1.00 0.00 ATOM 14602 C34 DPP 121 27.490 24.300 29.790 1.00 0.00 ATOM 14603 H4X DPP 121 28.460 24.110 29.280 1.00 0.00 ATOM 14604 H4Y DPP 121 26.930 23.340 29.850 1.00 0.00 ATOM 14605 C35 DPP 121 27.990 24.560 31.220 1.00 0.00 ATOM 14606 H5X DPP 121 27.190 24.830 31.950 1.00 0.00 ATOM 14607 H5Y DPP 121 28.730 25.380 31.190 1.00 0.00 ATOM 14608 C36 DPP 121 28.720 23.300 31.710 1.00 0.00 ATOM 14609 H6X DPP 121 29.430 22.990 30.910 1.00 0.00 ATOM 14610 H6Y DPP 121 27.920 22.530 31.790 1.00 0.00 ATOM 14611 C37 DPP 121 29.410 23.390 33.070 1.00 0.00 ATOM 14612 H7X DPP 121 30.430 23.790 32.880 1.00 0.00 ATOM 14613 H7Y DPP 121 29.530 22.410 33.570 1.00 0.00 ATOM 14614 C38 DPP 121 28.740 24.210 34.170 1.00 0.00 ATOM 14615 H8X DPP 121 27.690 23.860 34.290 1.00 0.00 ATOM 14616 H8Y DPP 121 28.790 25.280 33.850 1.00 0.00 ATOM 14617 C39 DPP 121 29.370 24.200 35.570 1.00 0.00 ATOM 14618 H9X DPP 121 30.430 24.530 35.450 1.00 0.00 ATOM 14619 H9Y DPP 121 29.250 23.250 36.130 1.00 0.00 ATOM 14620 0C31 DPP 121 28.770 25.180 36.570 1.00 0.00 ATOM 14621 H10X DPP 121 28.890 26.230 36.220 1.00 0.00 ATOM 14622 H10Y DPP 121 29.250 25.050 37.560 1.00 0.00 ATOM 14623 1C31 DPP 121 27.280 24.940 36.810 1.00 0.00 ATOM 14624 H11X DPP 121 27.110 23.970 37.330 1.00 0.00 ATOM 14625 H11Y DPP 121 26.790 24.860 35.820 1.00 0.00 ATOM 14626 2C31 DPP 121 26.620 25.930 37.770 1.00 0.00 ATOM 14627 H12X DPP 121 26.510 26.980 37.420 1.00 0.00 ATOM 14628 H12Y DPP 121 27.230 26.120 38.670 1.00 0.00 ATOM 14629 3C31 DPP 121 25.310 25.420 38.390 1.00 0.00 ATOM 14630 H13X DPP 121 25.610 24.520 38.970 1.00 0.00 ATOM 14631 H13Y DPP 121 24.620 25.190 37.560 1.00 0.00 ATOM 14632 4C31 DPP 121 24.610 26.500 39.220 1.00 0.00 ATOM 14633 H14X DPP 121 24.410 27.420 38.630 1.00 0.00 ATOM 14634 H14Y DPP 121 25.250 26.760 40.090 1.00 0.00 ATOM 14635 5C31 DPP 121 23.290 25.930 39.750 1.00 0.00 ATOM 14636 H15X DPP 121 23.540 25.010 40.320 1.00 0.00 ATOM 14637 H15Y DPP 121 22.530 25.610 39.010 1.00 0.00 ATOM 14638 6C31 DPP 121 22.570 26.900 40.670 1.00 0.00 ATOM 14639 H16X DPP 121 22.130 27.760 40.110 1.00 0.00 ATOM 14640 H16Y DPP 121 23.260 27.280 41.460 1.00 0.00 ATOM 14641 H16Z DPP 121 21.700 26.460 41.200 1.00 0.00 ATOM 14642 N DPP 122 20.920 3.420 20.970 1.00 0.00 ATOM 14643 HN1 DPP 122 21.840 3.420 21.460 1.00 0.00 ATOM 14644 HN2 DPP 122 20.240 3.910 21.580 1.00 0.00 ATOM 14645 HN3 DPP 122 21.110 3.960 20.110 1.00 0.00 ATOM 14646 C12 DPP 122 20.380 2.050 20.620 1.00 0.00 ATOM 14647 H12A DPP 122 19.600 2.200 19.840 1.00 0.00 ATOM 14648 H12B DPP 122 21.170 1.430 20.160 1.00 0.00 ATOM 14649 C11 DPP 122 19.920 1.390 21.920 1.00 0.00 ATOM 14650 H11A DPP 122 20.650 1.410 22.760 1.00 0.00 ATOM 14651 H11B DPP 122 19.690 0.310 21.800 1.00 0.00 ATOM 14652 P DPP 122 17.550 1.240 23.000 1.00 0.00 ATOM 14653 O13 DPP 122 16.770 0.640 21.900 1.00 0.00 ATOM 14654 O14 DPP 122 16.780 2.130 23.910 1.00 0.00 ATOM 14655 O11 DPP 122 18.180 0.010 23.810 1.00 0.00 ATOM 14656 O12 DPP 122 18.740 2.080 22.350 1.00 0.00 ATOM 14657 C1 DPP 122 17.290 -0.960 24.370 1.00 0.00 ATOM 14658 HA DPP 122 16.700 -1.350 23.510 1.00 0.00 ATOM 14659 HB DPP 122 16.610 -0.460 25.100 1.00 0.00 ATOM 14660 C2 DPP 122 18.040 -1.990 25.230 1.00 0.00 ATOM 14661 HS DPP 122 17.280 -2.730 25.540 1.00 0.00 ATOM 14662 O21 DPP 122 18.500 -1.170 26.310 1.00 0.00 ATOM 14663 C21 DPP 122 18.540 -1.890 27.430 1.00 0.00 ATOM 14664 O22 DPP 122 18.250 -3.060 27.580 1.00 0.00 ATOM 14665 C22 DPP 122 18.850 -1.000 28.630 1.00 0.00 ATOM 14666 H2R DPP 122 17.950 -0.970 29.290 1.00 0.00 ATOM 14667 H2S DPP 122 19.040 0.030 28.290 1.00 0.00 ATOM 14668 C3 DPP 122 19.190 -2.690 24.480 1.00 0.00 ATOM 14669 HX DPP 122 19.700 -1.890 23.900 1.00 0.00 ATOM 14670 HY DPP 122 18.800 -3.330 23.670 1.00 0.00 ATOM 14671 O31 DPP 122 20.050 -3.470 25.310 1.00 0.00 ATOM 14672 C31 DPP 122 19.600 -4.700 25.560 1.00 0.00 ATOM 14673 O32 DPP 122 18.760 -5.250 24.870 1.00 0.00 ATOM 14674 C32 DPP 122 20.310 -5.310 26.760 1.00 0.00 ATOM 14675 H2X DPP 122 20.630 -4.540 27.480 1.00 0.00 ATOM 14676 H2Y DPP 122 21.260 -5.750 26.400 1.00 0.00 ATOM 14677 C23 DPP 122 19.950 -1.560 29.530 1.00 0.00 ATOM 14678 H3R DPP 122 20.390 -0.640 29.980 1.00 0.00 ATOM 14679 H3S DPP 122 20.710 -1.980 28.830 1.00 0.00 ATOM 14680 C24 DPP 122 19.450 -2.670 30.450 1.00 0.00 ATOM 14681 H4R DPP 122 19.060 -3.640 30.040 1.00 0.00 ATOM 14682 H4S DPP 122 18.580 -2.290 31.030 1.00 0.00 ATOM 14683 C25 DPP 122 20.520 -2.920 31.510 1.00 0.00 ATOM 14684 H5R DPP 122 20.180 -2.300 32.370 1.00 0.00 ATOM 14685 H5S DPP 122 21.500 -2.450 31.270 1.00 0.00 ATOM 14686 C26 DPP 122 20.710 -4.390 31.900 1.00 0.00 ATOM 14687 H6R DPP 122 21.040 -5.060 31.080 1.00 0.00 ATOM 14688 H6S DPP 122 19.650 -4.700 32.040 1.00 0.00 ATOM 14689 C27 DPP 122 21.400 -4.740 33.210 1.00 0.00 ATOM 14690 H7R DPP 122 21.480 -3.890 33.940 1.00 0.00 ATOM 14691 H7S DPP 122 22.470 -4.790 32.910 1.00 0.00 ATOM 14692 C28 DPP 122 20.820 -5.940 33.950 1.00 0.00 ATOM 14693 H8R DPP 122 19.720 -5.830 34.070 1.00 0.00 ATOM 14694 H8S DPP 122 21.400 -6.070 34.890 1.00 0.00 ATOM 14695 C29 DPP 122 21.160 -7.140 33.060 1.00 0.00 ATOM 14696 H9R DPP 122 22.220 -7.010 32.760 1.00 0.00 ATOM 14697 H9S DPP 122 20.590 -7.320 32.130 1.00 0.00 ATOM 14698 0C21 DPP 122 21.100 -8.470 33.820 1.00 0.00 ATOM 14699 H10R DPP 122 21.250 -9.290 33.090 1.00 0.00 ATOM 14700 H10S DPP 122 20.080 -8.590 34.250 1.00 0.00 ATOM 14701 1C21 DPP 122 22.280 -8.510 34.790 1.00 0.00 ATOM 14702 H11R DPP 122 21.900 -7.950 35.680 1.00 0.00 ATOM 14703 H11S DPP 122 23.150 -7.950 34.370 1.00 0.00 ATOM 14704 2C21 DPP 122 22.640 -9.920 35.250 1.00 0.00 ATOM 14705 H12R DPP 122 23.310 -10.470 34.570 1.00 0.00 ATOM 14706 H12S DPP 122 21.690 -10.480 35.090 1.00 0.00 ATOM 14707 3C21 DPP 122 23.090 -9.950 36.710 1.00 0.00 ATOM 14708 H13R DPP 122 23.250 -11.020 36.950 1.00 0.00 ATOM 14709 H13S DPP 122 22.360 -9.530 37.450 1.00 0.00 ATOM 14710 4C21 DPP 122 24.400 -9.180 36.900 1.00 0.00 ATOM 14711 H14R DPP 122 24.460 -8.460 36.060 1.00 0.00 ATOM 14712 H14S DPP 122 25.270 -9.870 36.780 1.00 0.00 ATOM 14713 5C21 DPP 122 24.510 -8.370 38.190 1.00 0.00 ATOM 14714 H15R DPP 122 25.460 -7.800 38.250 1.00 0.00 ATOM 14715 H15S DPP 122 24.500 -8.920 39.160 1.00 0.00 ATOM 14716 6C21 DPP 122 23.370 -7.360 38.270 1.00 0.00 ATOM 14717 H16R DPP 122 23.330 -6.790 39.220 1.00 0.00 ATOM 14718 H16S DPP 122 22.380 -7.870 38.300 1.00 0.00 ATOM 14719 H16T DPP 122 23.270 -6.660 37.410 1.00 0.00 ATOM 14720 C33 DPP 122 19.300 -6.160 27.540 1.00 0.00 ATOM 14721 H3X DPP 122 18.630 -6.780 26.910 1.00 0.00 ATOM 14722 H3Y DPP 122 18.530 -5.430 27.840 1.00 0.00 ATOM 14723 C34 DPP 122 19.890 -7.070 28.630 1.00 0.00 ATOM 14724 H4X DPP 122 19.060 -7.620 29.120 1.00 0.00 ATOM 14725 H4Y DPP 122 20.470 -6.500 29.390 1.00 0.00 ATOM 14726 C35 DPP 122 20.870 -8.120 28.120 1.00 0.00 ATOM 14727 H5X DPP 122 21.660 -7.620 27.510 1.00 0.00 ATOM 14728 H5Y DPP 122 20.310 -8.840 27.490 1.00 0.00 ATOM 14729 C36 DPP 122 21.570 -8.870 29.260 1.00 0.00 ATOM 14730 H6X DPP 122 20.870 -9.260 30.030 1.00 0.00 ATOM 14731 H6Y DPP 122 22.140 -8.120 29.850 1.00 0.00 ATOM 14732 C37 DPP 122 22.370 -10.050 28.690 1.00 0.00 ATOM 14733 H7X DPP 122 23.010 -9.680 27.870 1.00 0.00 ATOM 14734 H7Y DPP 122 21.630 -10.760 28.250 1.00 0.00 ATOM 14735 C38 DPP 122 23.130 -10.800 29.790 1.00 0.00 ATOM 14736 H8X DPP 122 23.860 -10.150 30.310 1.00 0.00 ATOM 14737 H8Y DPP 122 23.720 -11.590 29.280 1.00 0.00 ATOM 14738 C39 DPP 122 22.200 -11.360 30.870 1.00 0.00 ATOM 14739 H9X DPP 122 21.370 -11.920 30.390 1.00 0.00 ATOM 14740 H9Y DPP 122 21.800 -10.560 31.520 1.00 0.00 ATOM 14741 0C31 DPP 122 22.970 -12.210 31.890 1.00 0.00 ATOM 14742 H10X DPP 122 22.250 -12.360 32.720 1.00 0.00 ATOM 14743 H10Y DPP 122 23.770 -11.630 32.400 1.00 0.00 ATOM 14744 1C31 DPP 122 23.560 -13.550 31.440 1.00 0.00 ATOM 14745 H11X DPP 122 24.350 -13.250 30.720 1.00 0.00 ATOM 14746 H11Y DPP 122 22.830 -14.150 30.870 1.00 0.00 ATOM 14747 2C31 DPP 122 23.870 -14.490 32.610 1.00 0.00 ATOM 14748 H12X DPP 122 23.710 -15.510 32.190 1.00 0.00 ATOM 14749 H12Y DPP 122 23.080 -14.280 33.360 1.00 0.00 ATOM 14750 3C31 DPP 122 25.290 -14.250 33.130 1.00 0.00 ATOM 14751 H13X DPP 122 25.160 -13.250 33.600 1.00 0.00 ATOM 14752 H13Y DPP 122 25.970 -14.340 32.260 1.00 0.00 ATOM 14753 4C31 DPP 122 25.840 -15.200 34.200 1.00 0.00 ATOM 14754 H14X DPP 122 26.480 -14.770 35.000 1.00 0.00 ATOM 14755 H14Y DPP 122 26.540 -15.880 33.680 1.00 0.00 ATOM 14756 5C31 DPP 122 24.840 -16.160 34.850 1.00 0.00 ATOM 14757 H15X DPP 122 24.240 -16.640 34.060 1.00 0.00 ATOM 14758 H15Y DPP 122 24.210 -15.600 35.580 1.00 0.00 ATOM 14759 6C31 DPP 122 25.510 -17.260 35.670 1.00 0.00 ATOM 14760 H16X DPP 122 24.660 -17.670 36.250 1.00 0.00 ATOM 14761 H16Y DPP 122 25.760 -18.190 35.110 1.00 0.00 ATOM 14762 H16Z DPP 122 26.260 -16.840 36.370 1.00 0.00 ATOM 14763 N DPP 123 1.920 11.890 23.070 1.00 0.00 ATOM 14764 HN1 DPP 123 1.430 11.200 23.670 1.00 0.00 ATOM 14765 HN2 DPP 123 2.320 11.410 22.240 1.00 0.00 ATOM 14766 HN3 DPP 123 2.620 12.470 23.580 1.00 0.00 ATOM 14767 C12 DPP 123 0.730 12.630 22.510 1.00 0.00 ATOM 14768 H12A DPP 123 0.080 11.850 22.040 1.00 0.00 ATOM 14769 H12B DPP 123 1.070 13.440 21.830 1.00 0.00 ATOM 14770 C11 DPP 123 -0.050 13.340 23.620 1.00 0.00 ATOM 14771 H11A DPP 123 -0.370 12.690 24.460 1.00 0.00 ATOM 14772 H11B DPP 123 -0.930 13.710 23.050 1.00 0.00 ATOM 14773 P DPP 123 -0.100 15.350 25.230 1.00 0.00 ATOM 14774 O13 DPP 123 -1.290 15.930 24.570 1.00 0.00 ATOM 14775 O14 DPP 123 0.900 16.340 25.700 1.00 0.00 ATOM 14776 O11 DPP 123 -0.360 14.270 26.390 1.00 0.00 ATOM 14777 O12 DPP 123 0.680 14.440 24.160 1.00 0.00 ATOM 14778 C1 DPP 123 -1.710 13.870 26.640 1.00 0.00 ATOM 14779 HA DPP 123 -1.750 12.850 27.080 1.00 0.00 ATOM 14780 HB DPP 123 -2.260 13.640 25.710 1.00 0.00 ATOM 14781 C2 DPP 123 -2.490 14.880 27.510 1.00 0.00 ATOM 14782 HS DPP 123 -2.680 15.850 27.000 1.00 0.00 ATOM 14783 O21 DPP 123 -1.620 15.200 28.590 1.00 0.00 ATOM 14784 C21 DPP 123 -2.020 16.230 29.340 1.00 0.00 ATOM 14785 O22 DPP 123 -3.070 16.830 29.180 1.00 0.00 ATOM 14786 C22 DPP 123 -1.010 16.600 30.420 1.00 0.00 ATOM 14787 H2R DPP 123 -1.120 17.710 30.530 1.00 0.00 ATOM 14788 H2S DPP 123 0.030 16.460 30.060 1.00 0.00 ATOM 14789 C3 DPP 123 -3.840 14.250 27.900 1.00 0.00 ATOM 14790 HX DPP 123 -4.330 14.010 26.940 1.00 0.00 ATOM 14791 HY DPP 123 -4.470 14.970 28.460 1.00 0.00 ATOM 14792 O31 DPP 123 -3.530 13.030 28.580 1.00 0.00 ATOM 14793 C31 DPP 123 -3.750 13.130 29.890 1.00 0.00 ATOM 14794 O32 DPP 123 -4.140 14.130 30.480 1.00 0.00 ATOM 14795 C32 DPP 123 -3.370 11.780 30.490 1.00 0.00 ATOM 14796 H2X DPP 123 -3.030 11.170 29.630 1.00 0.00 ATOM 14797 H2Y DPP 123 -4.280 11.290 30.900 1.00 0.00 ATOM 14798 C23 DPP 123 -1.300 15.870 31.740 1.00 0.00 ATOM 14799 H3R DPP 123 -1.010 14.820 31.550 1.00 0.00 ATOM 14800 H3S DPP 123 -2.390 15.990 31.890 1.00 0.00 ATOM 14801 C24 DPP 123 -0.550 16.460 32.940 1.00 0.00 ATOM 14802 H4R DPP 123 0.530 16.620 32.750 1.00 0.00 ATOM 14803 H4S DPP 123 -0.500 15.730 33.780 1.00 0.00 ATOM 14804 C25 DPP 123 -1.290 17.660 33.520 1.00 0.00 ATOM 14805 H5R DPP 123 -2.290 17.340 33.850 1.00 0.00 ATOM 14806 H5S DPP 123 -1.370 18.410 32.700 1.00 0.00 ATOM 14807 C26 DPP 123 -0.600 18.450 34.640 1.00 0.00 ATOM 14808 H6R DPP 123 -1.330 19.130 35.130 1.00 0.00 ATOM 14809 H6S DPP 123 0.200 19.050 34.150 1.00 0.00 ATOM 14810 C27 DPP 123 0.060 17.600 35.720 1.00 0.00 ATOM 14811 H7R DPP 123 0.830 18.160 36.310 1.00 0.00 ATOM 14812 H7S DPP 123 0.600 16.790 35.180 1.00 0.00 ATOM 14813 C28 DPP 123 -0.880 17.000 36.770 1.00 0.00 ATOM 14814 H8R DPP 123 -1.700 16.330 36.420 1.00 0.00 ATOM 14815 H8S DPP 123 -1.350 17.890 37.220 1.00 0.00 ATOM 14816 C29 DPP 123 0.020 16.320 37.810 1.00 0.00 ATOM 14817 H9R DPP 123 0.820 17.040 38.030 1.00 0.00 ATOM 14818 H9S DPP 123 0.570 15.470 37.340 1.00 0.00 ATOM 14819 0C21 DPP 123 -0.820 15.840 39.000 1.00 0.00 ATOM 14820 H10R DPP 123 -1.880 15.750 38.680 1.00 0.00 ATOM 14821 H10S DPP 123 -0.980 16.520 39.860 1.00 0.00 ATOM 14822 1C21 DPP 123 -0.510 14.460 39.580 1.00 0.00 ATOM 14823 H11R DPP 123 -0.140 13.820 38.750 1.00 0.00 ATOM 14824 H11S DPP 123 -1.350 14.030 40.170 1.00 0.00 ATOM 14825 2C21 DPP 123 0.520 14.550 40.700 1.00 0.00 ATOM 14826 H12R DPP 123 0.060 15.190 41.490 1.00 0.00 ATOM 14827 H12S DPP 123 1.510 14.870 40.320 1.00 0.00 ATOM 14828 3C21 DPP 123 0.910 13.200 41.320 1.00 0.00 ATOM 14829 H13R DPP 123 1.790 12.780 40.770 1.00 0.00 ATOM 14830 H13S DPP 123 -0.010 12.600 41.160 1.00 0.00 ATOM 14831 4C21 DPP 123 1.290 13.270 42.800 1.00 0.00 ATOM 14832 H14R DPP 123 0.370 13.600 43.330 1.00 0.00 ATOM 14833 H14S DPP 123 2.200 13.910 42.860 1.00 0.00 ATOM 14834 5C21 DPP 123 1.630 11.870 43.330 1.00 0.00 ATOM 14835 H15R DPP 123 2.690 11.540 43.250 1.00 0.00 ATOM 14836 H15S DPP 123 0.830 11.270 42.850 1.00 0.00 ATOM 14837 6C21 DPP 123 1.470 11.840 44.850 1.00 0.00 ATOM 14838 H16R DPP 123 1.970 12.680 45.380 1.00 0.00 ATOM 14839 H16S DPP 123 1.950 10.900 45.200 1.00 0.00 ATOM 14840 H16T DPP 123 0.430 11.750 45.210 1.00 0.00 ATOM 14841 C33 DPP 123 -2.360 12.050 31.600 1.00 0.00 ATOM 14842 H3X DPP 123 -2.700 12.840 32.300 1.00 0.00 ATOM 14843 H3Y DPP 123 -1.330 12.350 31.300 1.00 0.00 ATOM 14844 C34 DPP 123 -2.070 10.780 32.410 1.00 0.00 ATOM 14845 H4X DPP 123 -1.960 9.930 31.700 1.00 0.00 ATOM 14846 H4Y DPP 123 -3.040 10.630 32.940 1.00 0.00 ATOM 14847 C35 DPP 123 -0.850 10.800 33.350 1.00 0.00 ATOM 14848 H5X DPP 123 -0.060 10.160 32.920 1.00 0.00 ATOM 14849 H5Y DPP 123 -1.290 10.260 34.210 1.00 0.00 ATOM 14850 C36 DPP 123 -0.380 12.200 33.760 1.00 0.00 ATOM 14851 H6X DPP 123 -1.210 12.800 34.180 1.00 0.00 ATOM 14852 H6Y DPP 123 0.080 12.770 32.920 1.00 0.00 ATOM 14853 C37 DPP 123 0.660 12.040 34.870 1.00 0.00 ATOM 14854 H7X DPP 123 1.510 11.690 34.250 1.00 0.00 ATOM 14855 H7Y DPP 123 0.330 11.250 35.570 1.00 0.00 ATOM 14856 C38 DPP 123 0.910 13.350 35.630 1.00 0.00 ATOM 14857 H8X DPP 123 0.250 13.460 36.510 1.00 0.00 ATOM 14858 H8Y DPP 123 0.680 14.140 34.880 1.00 0.00 ATOM 14859 C39 DPP 123 2.400 13.440 35.940 1.00 0.00 ATOM 14860 H9X DPP 123 2.510 14.450 36.400 1.00 0.00 ATOM 14861 H9Y DPP 123 3.120 13.290 35.110 1.00 0.00 ATOM 14862 0C31 DPP 123 2.690 12.410 37.030 1.00 0.00 ATOM 14863 H10X DPP 123 3.050 11.480 36.530 1.00 0.00 ATOM 14864 H10Y DPP 123 1.780 12.140 37.620 1.00 0.00 ATOM 14865 1C31 DPP 123 3.780 12.990 37.930 1.00 0.00 ATOM 14866 H11X DPP 123 3.260 13.810 38.480 1.00 0.00 ATOM 14867 H11Y DPP 123 4.620 13.460 37.360 1.00 0.00 ATOM 14868 2C31 DPP 123 4.370 12.060 38.990 1.00 0.00 ATOM 14869 H12X DPP 123 4.690 11.080 38.600 1.00 0.00 ATOM 14870 H12Y DPP 123 3.540 11.720 39.640 1.00 0.00 ATOM 14871 3C31 DPP 123 5.530 12.740 39.730 1.00 0.00 ATOM 14872 H13X DPP 123 6.330 12.760 38.960 1.00 0.00 ATOM 14873 H13Y DPP 123 5.890 12.040 40.510 1.00 0.00 ATOM 14874 4C31 DPP 123 5.260 14.100 40.390 1.00 0.00 ATOM 14875 H14X DPP 123 4.480 14.030 41.180 1.00 0.00 ATOM 14876 H14Y DPP 123 5.000 14.900 39.670 1.00 0.00 ATOM 14877 5C31 DPP 123 6.490 14.610 41.140 1.00 0.00 ATOM 14878 H15X DPP 123 7.350 14.430 40.450 1.00 0.00 ATOM 14879 H15Y DPP 123 6.720 14.120 42.110 1.00 0.00 ATOM 14880 6C31 DPP 123 6.350 16.080 41.520 1.00 0.00 ATOM 14881 H16X DPP 123 7.250 16.410 42.080 1.00 0.00 ATOM 14882 H16Y DPP 123 5.470 15.960 42.190 1.00 0.00 ATOM 14883 H16Z DPP 123 6.150 16.700 40.620 1.00 0.00 ATOM 14884 N DPP 124 26.020 48.760 20.450 1.00 0.00 ATOM 14885 HN1 DPP 124 25.270 49.230 19.910 1.00 0.00 ATOM 14886 HN2 DPP 124 26.820 48.640 19.800 1.00 0.00 ATOM 14887 HN3 DPP 124 25.700 47.790 20.680 1.00 0.00 ATOM 14888 C12 DPP 124 26.260 49.530 21.730 1.00 0.00 ATOM 14889 H12A DPP 124 25.290 49.500 22.280 1.00 0.00 ATOM 14890 H12B DPP 124 26.510 50.570 21.430 1.00 0.00 ATOM 14891 C11 DPP 124 27.480 49.020 22.490 1.00 0.00 ATOM 14892 H11A DPP 124 27.080 48.040 22.830 1.00 0.00 ATOM 14893 H11B DPP 124 27.710 49.670 23.370 1.00 0.00 ATOM 14894 P DPP 124 29.670 50.070 21.800 1.00 0.00 ATOM 14895 O13 DPP 124 28.990 51.350 21.460 1.00 0.00 ATOM 14896 O14 DPP 124 30.900 49.840 21.020 1.00 0.00 ATOM 14897 O11 DPP 124 30.080 50.260 23.340 1.00 0.00 ATOM 14898 O12 DPP 124 28.640 48.850 21.680 1.00 0.00 ATOM 14899 C1 DPP 124 31.310 49.630 23.680 1.00 0.00 ATOM 14900 HA DPP 124 32.180 49.750 23.000 1.00 0.00 ATOM 14901 HB DPP 124 31.110 48.540 23.610 1.00 0.00 ATOM 14902 C2 DPP 124 31.670 49.880 25.150 1.00 0.00 ATOM 14903 HS DPP 124 32.640 49.340 25.300 1.00 0.00 ATOM 14904 O21 DPP 124 30.650 49.390 26.020 1.00 0.00 ATOM 14905 C21 DPP 124 31.060 49.110 27.250 1.00 0.00 ATOM 14906 O22 DPP 124 32.250 49.020 27.490 1.00 0.00 ATOM 14907 C22 DPP 124 29.910 48.850 28.210 1.00 0.00 ATOM 14908 H2R DPP 124 29.520 47.830 27.970 1.00 0.00 ATOM 14909 H2S DPP 124 29.040 49.530 28.060 1.00 0.00 ATOM 14910 C3 DPP 124 32.030 51.370 25.270 1.00 0.00 ATOM 14911 HX DPP 124 31.130 51.910 24.930 1.00 0.00 ATOM 14912 HY DPP 124 32.800 51.740 24.550 1.00 0.00 ATOM 14913 O31 DPP 124 32.360 51.820 26.590 1.00 0.00 ATOM 14914 C31 DPP 124 33.620 51.570 26.950 1.00 0.00 ATOM 14915 O32 DPP 124 34.450 51.130 26.170 1.00 0.00 ATOM 14916 C32 DPP 124 33.870 52.140 28.330 1.00 0.00 ATOM 14917 H2X DPP 124 32.870 52.080 28.810 1.00 0.00 ATOM 14918 H2Y DPP 124 34.320 53.160 28.270 1.00 0.00 ATOM 14919 C23 DPP 124 30.500 48.900 29.620 1.00 0.00 ATOM 14920 H3R DPP 124 31.170 49.790 29.650 1.00 0.00 ATOM 14921 H3S DPP 124 31.150 48.020 29.770 1.00 0.00 ATOM 14922 C24 DPP 124 29.540 48.850 30.810 1.00 0.00 ATOM 14923 H4R DPP 124 28.830 49.630 30.460 1.00 0.00 ATOM 14924 H4S DPP 124 29.980 49.250 31.750 1.00 0.00 ATOM 14925 C25 DPP 124 28.800 47.530 31.080 1.00 0.00 ATOM 14926 H5R DPP 124 28.480 47.130 30.100 1.00 0.00 ATOM 14927 H5S DPP 124 27.990 47.820 31.780 1.00 0.00 ATOM 14928 C26 DPP 124 29.660 46.490 31.810 1.00 0.00 ATOM 14929 H6R DPP 124 30.530 46.520 31.120 1.00 0.00 ATOM 14930 H6S DPP 124 29.050 45.570 31.690 1.00 0.00 ATOM 14931 C27 DPP 124 29.960 46.880 33.250 1.00 0.00 ATOM 14932 H7R DPP 124 29.070 47.360 33.710 1.00 0.00 ATOM 14933 H7S DPP 124 30.780 47.630 33.240 1.00 0.00 ATOM 14934 C28 DPP 124 30.350 45.670 34.100 1.00 0.00 ATOM 14935 H8R DPP 124 31.260 45.180 33.700 1.00 0.00 ATOM 14936 H8S DPP 124 29.520 44.950 34.240 1.00 0.00 ATOM 14937 C29 DPP 124 30.750 46.120 35.510 1.00 0.00 ATOM 14938 H9R DPP 124 29.850 46.540 36.010 1.00 0.00 ATOM 14939 H9S DPP 124 31.480 46.960 35.440 1.00 0.00 ATOM 14940 0C21 DPP 124 31.370 44.980 36.310 1.00 0.00 ATOM 14941 H10R DPP 124 30.780 44.150 35.870 1.00 0.00 ATOM 14942 H10S DPP 124 32.430 44.990 35.990 1.00 0.00 ATOM 14943 1C21 DPP 124 31.180 44.910 37.830 1.00 0.00 ATOM 14944 H11R DPP 124 31.430 45.860 38.340 1.00 0.00 ATOM 14945 H11S DPP 124 31.890 44.140 38.220 1.00 0.00 ATOM 14946 2C21 DPP 124 29.780 44.380 38.150 1.00 0.00 ATOM 14947 H12R DPP 124 29.790 43.410 37.600 1.00 0.00 ATOM 14948 H12S DPP 124 29.040 45.040 37.640 1.00 0.00 ATOM 14949 3C21 DPP 124 29.310 44.180 39.590 1.00 0.00 ATOM 14950 H13R DPP 124 29.840 43.310 40.040 1.00 0.00 ATOM 14951 H13S DPP 124 28.210 44.050 39.530 1.00 0.00 ATOM 14952 4C21 DPP 124 29.510 45.290 40.620 1.00 0.00 ATOM 14953 H14R DPP 124 28.890 46.090 40.160 1.00 0.00 ATOM 14954 H14S DPP 124 30.590 45.520 40.600 1.00 0.00 ATOM 14955 5C21 DPP 124 28.990 44.920 42.010 1.00 0.00 ATOM 14956 H15R DPP 124 29.600 45.600 42.640 1.00 0.00 ATOM 14957 H15S DPP 124 29.330 43.870 42.120 1.00 0.00 ATOM 14958 6C21 DPP 124 27.480 45.100 42.230 1.00 0.00 ATOM 14959 H16R DPP 124 27.110 44.540 43.120 1.00 0.00 ATOM 14960 H16S DPP 124 26.810 44.890 41.370 1.00 0.00 ATOM 14961 H16T DPP 124 27.330 46.190 42.390 1.00 0.00 ATOM 14962 C33 DPP 124 34.700 51.270 29.270 1.00 0.00 ATOM 14963 H3X DPP 124 34.740 50.240 28.850 1.00 0.00 ATOM 14964 H3Y DPP 124 34.180 51.220 30.250 1.00 0.00 ATOM 14965 C34 DPP 124 36.170 51.680 29.280 1.00 0.00 ATOM 14966 H4X DPP 124 36.180 52.790 29.380 1.00 0.00 ATOM 14967 H4Y DPP 124 36.740 51.290 28.410 1.00 0.00 ATOM 14968 C35 DPP 124 36.980 51.030 30.400 1.00 0.00 ATOM 14969 H5X DPP 124 38.000 51.420 30.220 1.00 0.00 ATOM 14970 H5Y DPP 124 37.100 49.940 30.240 1.00 0.00 ATOM 14971 C36 DPP 124 36.480 51.380 31.810 1.00 0.00 ATOM 14972 H6X DPP 124 35.490 50.960 32.090 1.00 0.00 ATOM 14973 H6Y DPP 124 36.340 52.480 31.830 1.00 0.00 ATOM 14974 C37 DPP 124 37.350 50.930 32.980 1.00 0.00 ATOM 14975 H7X DPP 124 38.370 51.370 33.030 1.00 0.00 ATOM 14976 H7Y DPP 124 37.500 49.840 32.850 1.00 0.00 ATOM 14977 C38 DPP 124 36.670 51.320 34.300 1.00 0.00 ATOM 14978 H8X DPP 124 35.740 50.720 34.210 1.00 0.00 ATOM 14979 H8Y DPP 124 36.540 52.420 34.310 1.00 0.00 ATOM 14980 C39 DPP 124 37.340 50.860 35.590 1.00 0.00 ATOM 14981 H9X DPP 124 38.380 51.220 35.460 1.00 0.00 ATOM 14982 H9Y DPP 124 37.460 49.760 35.670 1.00 0.00 ATOM 14983 0C31 DPP 124 36.620 51.360 36.850 1.00 0.00 ATOM 14984 H10X DPP 124 35.540 51.110 36.760 1.00 0.00 ATOM 14985 H10Y DPP 124 36.600 52.460 36.960 1.00 0.00 ATOM 14986 1C31 DPP 124 37.310 50.890 38.140 1.00 0.00 ATOM 14987 H11X DPP 124 38.170 51.460 38.550 1.00 0.00 ATOM 14988 H11Y DPP 124 37.550 49.810 38.040 1.00 0.00 ATOM 14989 2C31 DPP 124 36.360 51.020 39.330 1.00 0.00 ATOM 14990 H12X DPP 124 35.320 50.790 39.030 1.00 0.00 ATOM 14991 H12Y DPP 124 36.280 52.050 39.750 1.00 0.00 ATOM 14992 3C31 DPP 124 36.750 50.120 40.500 1.00 0.00 ATOM 14993 H13X DPP 124 36.610 49.050 40.230 1.00 0.00 ATOM 14994 H13Y DPP 124 36.010 50.190 41.320 1.00 0.00 ATOM 14995 4C31 DPP 124 38.140 50.470 41.040 1.00 0.00 ATOM 14996 H14X DPP 124 38.970 50.500 40.310 1.00 0.00 ATOM 14997 H14Y DPP 124 38.350 49.690 41.800 1.00 0.00 ATOM 14998 5C31 DPP 124 38.180 51.830 41.730 1.00 0.00 ATOM 14999 H15X DPP 124 37.630 51.810 42.700 1.00 0.00 ATOM 15000 H15Y DPP 124 37.950 52.690 41.070 1.00 0.00 ATOM 15001 6C31 DPP 124 39.620 52.140 42.130 1.00 0.00 ATOM 15002 H16X DPP 124 40.010 51.400 42.880 1.00 0.00 ATOM 15003 H16Y DPP 124 39.500 53.000 42.820 1.00 0.00 ATOM 15004 H16Z DPP 124 40.340 52.220 41.290 1.00 0.00 ATOM 15005 N DPP 125 3.860 37.300 24.640 1.00 0.00 ATOM 15006 HN1 DPP 125 4.760 36.970 25.040 1.00 0.00 ATOM 15007 HN2 DPP 125 3.170 36.530 24.520 1.00 0.00 ATOM 15008 HN3 DPP 125 4.130 37.450 23.640 1.00 0.00 ATOM 15009 C12 DPP 125 3.010 38.340 25.320 1.00 0.00 ATOM 15010 H12A DPP 125 3.670 39.190 25.600 1.00 0.00 ATOM 15011 H12B DPP 125 2.610 37.890 26.250 1.00 0.00 ATOM 15012 C11 DPP 125 1.900 38.880 24.420 1.00 0.00 ATOM 15013 H11A DPP 125 1.150 39.330 25.110 1.00 0.00 ATOM 15014 H11B DPP 125 1.340 38.050 23.950 1.00 0.00 ATOM 15015 P DPP 125 1.300 40.650 22.690 1.00 0.00 ATOM 15016 O13 DPP 125 0.180 39.820 22.200 1.00 0.00 ATOM 15017 O14 DPP 125 1.970 41.690 21.870 1.00 0.00 ATOM 15018 O11 DPP 125 0.730 41.430 23.960 1.00 0.00 ATOM 15019 O12 DPP 125 2.380 39.660 23.330 1.00 0.00 ATOM 15020 C1 DPP 125 1.620 42.360 24.590 1.00 0.00 ATOM 15021 HA DPP 125 1.510 43.400 24.200 1.00 0.00 ATOM 15022 HB DPP 125 2.650 41.990 24.400 1.00 0.00 ATOM 15023 C2 DPP 125 1.430 42.320 26.110 1.00 0.00 ATOM 15024 HS DPP 125 1.020 41.350 26.440 1.00 0.00 ATOM 15025 O21 DPP 125 0.540 43.380 26.480 1.00 0.00 ATOM 15026 C21 DPP 125 -0.740 43.020 26.440 1.00 0.00 ATOM 15027 O22 DPP 125 -1.150 41.910 26.130 1.00 0.00 ATOM 15028 C22 DPP 125 -1.630 44.170 26.880 1.00 0.00 ATOM 15029 H2R DPP 125 -2.500 44.230 26.180 1.00 0.00 ATOM 15030 H2S DPP 125 -1.000 45.080 26.800 1.00 0.00 ATOM 15031 C3 DPP 125 2.650 42.720 26.960 1.00 0.00 ATOM 15032 HX DPP 125 2.900 43.790 26.800 1.00 0.00 ATOM 15033 HY DPP 125 3.470 42.030 26.650 1.00 0.00 ATOM 15034 O31 DPP 125 2.490 42.540 28.370 1.00 0.00 ATOM 15035 C31 DPP 125 2.470 41.250 28.700 1.00 0.00 ATOM 15036 O32 DPP 125 2.450 40.300 27.940 1.00 0.00 ATOM 15037 C32 DPP 125 2.730 41.060 30.190 1.00 0.00 ATOM 15038 H2X DPP 125 3.230 42.010 30.500 1.00 0.00 ATOM 15039 H2Y DPP 125 3.310 40.140 30.420 1.00 0.00 ATOM 15040 C23 DPP 125 -2.050 44.040 28.350 1.00 0.00 ATOM 15041 H3R DPP 125 -2.080 42.950 28.600 1.00 0.00 ATOM 15042 H3S DPP 125 -3.090 44.420 28.460 1.00 0.00 ATOM 15043 C24 DPP 125 -1.290 44.790 29.440 1.00 0.00 ATOM 15044 H4R DPP 125 -1.500 45.880 29.380 1.00 0.00 ATOM 15045 H4S DPP 125 -0.180 44.660 29.430 1.00 0.00 ATOM 15046 C25 DPP 125 -1.670 44.220 30.810 1.00 0.00 ATOM 15047 H5R DPP 125 -0.920 43.470 31.130 1.00 0.00 ATOM 15048 H5S DPP 125 -2.690 43.770 30.790 1.00 0.00 ATOM 15049 C26 DPP 125 -1.670 45.320 31.870 1.00 0.00 ATOM 15050 H6R DPP 125 -2.390 46.110 31.560 1.00 0.00 ATOM 15051 H6S DPP 125 -0.630 45.730 31.840 1.00 0.00 ATOM 15052 C27 DPP 125 -2.070 44.750 33.230 1.00 0.00 ATOM 15053 H7R DPP 125 -1.530 43.790 33.390 1.00 0.00 ATOM 15054 H7S DPP 125 -3.160 44.540 33.190 1.00 0.00 ATOM 15055 C28 DPP 125 -1.740 45.710 34.370 1.00 0.00 ATOM 15056 H8R DPP 125 -2.190 46.680 34.100 1.00 0.00 ATOM 15057 H8S DPP 125 -0.640 45.760 34.540 1.00 0.00 ATOM 15058 C29 DPP 125 -2.360 45.340 35.730 1.00 0.00 ATOM 15059 H9R DPP 125 -3.370 45.000 35.420 1.00 0.00 ATOM 15060 H9S DPP 125 -2.610 46.220 36.350 1.00 0.00 ATOM 15061 0C21 DPP 125 -1.570 44.300 36.520 1.00 0.00 ATOM 15062 H10R DPP 125 -0.730 44.800 37.050 1.00 0.00 ATOM 15063 H10S DPP 125 -0.940 43.680 35.840 1.00 0.00 ATOM 15064 1C21 DPP 125 -2.500 43.430 37.370 1.00 0.00 ATOM 15065 H11R DPP 125 -3.280 42.840 36.850 1.00 0.00 ATOM 15066 H11S DPP 125 -3.020 44.220 37.950 1.00 0.00 ATOM 15067 2C21 DPP 125 -1.560 42.520 38.170 1.00 0.00 ATOM 15068 H12R DPP 125 -0.740 43.140 38.570 1.00 0.00 ATOM 15069 H12S DPP 125 -1.140 41.720 37.520 1.00 0.00 ATOM 15070 3C21 DPP 125 -2.170 41.900 39.430 1.00 0.00 ATOM 15071 H13R DPP 125 -1.480 41.090 39.750 1.00 0.00 ATOM 15072 H13S DPP 125 -3.050 41.410 38.960 1.00 0.00 ATOM 15073 4C21 DPP 125 -2.730 42.890 40.450 1.00 0.00 ATOM 15074 H14R DPP 125 -3.380 43.640 39.940 1.00 0.00 ATOM 15075 H14S DPP 125 -1.990 43.590 40.890 1.00 0.00 ATOM 15076 5C21 DPP 125 -3.470 42.180 41.590 1.00 0.00 ATOM 15077 H15R DPP 125 -3.890 42.970 42.250 1.00 0.00 ATOM 15078 H15S DPP 125 -2.810 41.410 42.030 1.00 0.00 ATOM 15079 6C21 DPP 125 -4.710 41.380 41.200 1.00 0.00 ATOM 15080 H16R DPP 125 -4.470 40.630 40.420 1.00 0.00 ATOM 15081 H16S DPP 125 -5.450 42.140 40.860 1.00 0.00 ATOM 15082 H16T DPP 125 -5.140 41.020 42.160 1.00 0.00 ATOM 15083 C33 DPP 125 1.360 41.080 30.870 1.00 0.00 ATOM 15084 H3X DPP 125 0.890 40.150 30.480 1.00 0.00 ATOM 15085 H3Y DPP 125 0.650 41.810 30.420 1.00 0.00 ATOM 15086 C34 DPP 125 1.500 41.060 32.390 1.00 0.00 ATOM 15087 H4X DPP 125 2.420 40.470 32.580 1.00 0.00 ATOM 15088 H4Y DPP 125 0.600 40.490 32.700 1.00 0.00 ATOM 15089 C35 DPP 125 1.490 42.410 33.100 1.00 0.00 ATOM 15090 H5X DPP 125 0.470 42.860 33.080 1.00 0.00 ATOM 15091 H5Y DPP 125 2.020 43.210 32.530 1.00 0.00 ATOM 15092 C36 DPP 125 1.880 42.280 34.570 1.00 0.00 ATOM 15093 H6X DPP 125 1.690 43.240 35.090 1.00 0.00 ATOM 15094 H6Y DPP 125 2.970 42.130 34.750 1.00 0.00 ATOM 15095 C37 DPP 125 1.310 41.090 35.350 1.00 0.00 ATOM 15096 H7X DPP 125 1.770 40.180 34.920 1.00 0.00 ATOM 15097 H7Y DPP 125 0.230 41.240 35.150 1.00 0.00 ATOM 15098 C38 DPP 125 1.670 41.170 36.830 1.00 0.00 ATOM 15099 H8X DPP 125 1.500 42.180 37.260 1.00 0.00 ATOM 15100 H8Y DPP 125 2.780 41.120 36.830 1.00 0.00 ATOM 15101 C39 DPP 125 0.950 40.150 37.720 1.00 0.00 ATOM 15102 H9X DPP 125 -0.150 40.200 37.560 1.00 0.00 ATOM 15103 H9Y DPP 125 1.100 40.490 38.760 1.00 0.00 ATOM 15104 0C31 DPP 125 1.530 38.730 37.740 1.00 0.00 ATOM 15105 H10X DPP 125 1.410 38.340 36.710 1.00 0.00 ATOM 15106 H10Y DPP 125 0.850 38.110 38.370 1.00 0.00 ATOM 15107 1C31 DPP 125 2.970 38.530 38.220 1.00 0.00 ATOM 15108 H11X DPP 125 3.700 38.730 37.400 1.00 0.00 ATOM 15109 H11Y DPP 125 3.090 37.440 38.410 1.00 0.00 ATOM 15110 2C31 DPP 125 3.290 39.340 39.470 1.00 0.00 ATOM 15111 H12X DPP 125 3.110 40.420 39.270 1.00 0.00 ATOM 15112 H12Y DPP 125 4.400 39.360 39.560 1.00 0.00 ATOM 15113 3C31 DPP 125 2.620 38.990 40.800 1.00 0.00 ATOM 15114 H13X DPP 125 2.740 37.890 40.910 1.00 0.00 ATOM 15115 H13Y DPP 125 1.550 39.240 40.730 1.00 0.00 ATOM 15116 4C31 DPP 125 3.260 39.720 41.990 1.00 0.00 ATOM 15117 H14X DPP 125 3.790 40.640 41.650 1.00 0.00 ATOM 15118 H14Y DPP 125 4.080 39.050 42.310 1.00 0.00 ATOM 15119 5C31 DPP 125 2.320 39.980 43.170 1.00 0.00 ATOM 15120 H15X DPP 125 2.970 40.390 43.970 1.00 0.00 ATOM 15121 H15Y DPP 125 1.940 39.050 43.640 1.00 0.00 ATOM 15122 6C31 DPP 125 1.160 40.930 42.870 1.00 0.00 ATOM 15123 H16X DPP 125 1.410 41.860 42.310 1.00 0.00 ATOM 15124 H16Y DPP 125 0.550 40.360 42.140 1.00 0.00 ATOM 15125 H16Z DPP 125 0.660 41.200 43.830 1.00 0.00 ATOM 15126 N DPP 126 25.680 38.850 19.390 1.00 0.00 ATOM 15127 HN1 DPP 126 24.850 38.810 18.780 1.00 0.00 ATOM 15128 HN2 DPP 126 26.180 39.760 19.360 1.00 0.00 ATOM 15129 HN3 DPP 126 26.360 38.080 19.210 1.00 0.00 ATOM 15130 C12 DPP 126 25.060 38.560 20.740 1.00 0.00 ATOM 15131 H12A DPP 126 25.850 38.650 21.520 1.00 0.00 ATOM 15132 H12B DPP 126 24.230 39.270 20.960 1.00 0.00 ATOM 15133 C11 DPP 126 24.460 37.170 20.900 1.00 0.00 ATOM 15134 H11A DPP 126 24.230 37.110 21.980 1.00 0.00 ATOM 15135 H11B DPP 126 25.170 36.390 20.550 1.00 0.00 ATOM 15136 P DPP 126 21.960 36.450 20.640 1.00 0.00 ATOM 15137 O13 DPP 126 22.320 35.030 20.460 1.00 0.00 ATOM 15138 O14 DPP 126 20.810 36.890 19.830 1.00 0.00 ATOM 15139 O11 DPP 126 21.890 36.870 22.180 1.00 0.00 ATOM 15140 O12 DPP 126 23.260 37.230 20.120 1.00 0.00 ATOM 15141 C1 DPP 126 21.410 38.190 22.460 1.00 0.00 ATOM 15142 HA DPP 126 20.620 38.530 21.750 1.00 0.00 ATOM 15143 HB DPP 126 22.260 38.870 22.230 1.00 0.00 ATOM 15144 C2 DPP 126 20.900 38.300 23.910 1.00 0.00 ATOM 15145 HS DPP 126 20.680 39.350 24.200 1.00 0.00 ATOM 15146 O21 DPP 126 21.860 37.660 24.760 1.00 0.00 ATOM 15147 C21 DPP 126 22.940 38.400 24.990 1.00 0.00 ATOM 15148 O22 DPP 126 22.980 39.550 24.570 1.00 0.00 ATOM 15149 C22 DPP 126 23.900 37.710 25.940 1.00 0.00 ATOM 15150 H2R DPP 126 24.940 37.680 25.560 1.00 0.00 ATOM 15151 H2S DPP 126 23.620 36.670 26.200 1.00 0.00 ATOM 15152 C3 DPP 126 19.570 37.550 24.100 1.00 0.00 ATOM 15153 HX DPP 126 19.720 36.460 23.930 1.00 0.00 ATOM 15154 HY DPP 126 18.870 37.690 23.240 1.00 0.00 ATOM 15155 O31 DPP 126 18.810 37.980 25.230 1.00 0.00 ATOM 15156 C31 DPP 126 18.890 37.110 26.230 1.00 0.00 ATOM 15157 O32 DPP 126 19.540 36.080 26.260 1.00 0.00 ATOM 15158 C32 DPP 126 18.100 37.670 27.410 1.00 0.00 ATOM 15159 H2X DPP 126 17.020 37.590 27.170 1.00 0.00 ATOM 15160 H2Y DPP 126 18.380 38.730 27.590 1.00 0.00 ATOM 15161 C23 DPP 126 23.890 38.630 27.170 1.00 0.00 ATOM 15162 H3R DPP 126 23.140 38.340 27.940 1.00 0.00 ATOM 15163 H3S DPP 126 23.740 39.730 27.050 1.00 0.00 ATOM 15164 C24 DPP 126 25.180 38.320 27.930 1.00 0.00 ATOM 15165 H4R DPP 126 25.430 37.260 27.710 1.00 0.00 ATOM 15166 H4S DPP 126 24.950 38.420 29.010 1.00 0.00 ATOM 15167 C25 DPP 126 26.300 39.280 27.560 1.00 0.00 ATOM 15168 H5R DPP 126 26.240 39.780 26.560 1.00 0.00 ATOM 15169 H5S DPP 126 27.130 38.550 27.670 1.00 0.00 ATOM 15170 C26 DPP 126 26.560 40.370 28.600 1.00 0.00 ATOM 15171 H6R DPP 126 27.600 40.750 28.480 1.00 0.00 ATOM 15172 H6S DPP 126 26.620 39.760 29.530 1.00 0.00 ATOM 15173 C27 DPP 126 25.620 41.570 28.690 1.00 0.00 ATOM 15174 H7R DPP 126 24.600 41.130 28.760 1.00 0.00 ATOM 15175 H7S DPP 126 25.700 42.260 27.820 1.00 0.00 ATOM 15176 C28 DPP 126 25.810 42.310 30.010 1.00 0.00 ATOM 15177 H8R DPP 126 26.840 42.740 29.930 1.00 0.00 ATOM 15178 H8S DPP 126 25.950 41.500 30.760 1.00 0.00 ATOM 15179 C29 DPP 126 24.850 43.470 30.270 1.00 0.00 ATOM 15180 H9R DPP 126 25.210 43.950 31.210 1.00 0.00 ATOM 15181 H9S DPP 126 23.870 43.010 30.500 1.00 0.00 ATOM 15182 0C21 DPP 126 24.680 44.530 29.180 1.00 0.00 ATOM 15183 H10R DPP 126 23.950 45.360 29.290 1.00 0.00 ATOM 15184 H10S DPP 126 24.200 43.900 28.400 1.00 0.00 ATOM 15185 1C21 DPP 126 25.940 45.100 28.540 1.00 0.00 ATOM 15186 H11R DPP 126 26.520 44.280 28.060 1.00 0.00 ATOM 15187 H11S DPP 126 26.730 45.490 29.210 1.00 0.00 ATOM 15188 2C21 DPP 126 25.690 46.160 27.450 1.00 0.00 ATOM 15189 H12R DPP 126 24.970 46.790 28.000 1.00 0.00 ATOM 15190 H12S DPP 126 25.320 45.710 26.510 1.00 0.00 ATOM 15191 3C21 DPP 126 26.990 46.920 27.190 1.00 0.00 ATOM 15192 H13R DPP 126 27.770 46.150 26.990 1.00 0.00 ATOM 15193 H13S DPP 126 27.250 47.460 28.130 1.00 0.00 ATOM 15194 4C21 DPP 126 26.890 47.850 25.990 1.00 0.00 ATOM 15195 H14R DPP 126 26.740 47.250 25.060 1.00 0.00 ATOM 15196 H14S DPP 126 27.860 48.380 25.880 1.00 0.00 ATOM 15197 5C21 DPP 126 25.730 48.840 26.120 1.00 0.00 ATOM 15198 H15R DPP 126 24.760 48.360 26.390 1.00 0.00 ATOM 15199 H15S DPP 126 25.640 49.400 25.170 1.00 0.00 ATOM 15200 6C21 DPP 126 25.950 49.860 27.240 1.00 0.00 ATOM 15201 H16R DPP 126 26.950 50.270 27.020 1.00 0.00 ATOM 15202 H16S DPP 126 26.070 49.250 28.160 1.00 0.00 ATOM 15203 H16T DPP 126 25.080 50.550 27.340 1.00 0.00 ATOM 15204 C33 DPP 126 18.350 36.930 28.720 1.00 0.00 ATOM 15205 H3X DPP 126 19.440 37.030 28.890 1.00 0.00 ATOM 15206 H3Y DPP 126 18.200 35.830 28.620 1.00 0.00 ATOM 15207 C34 DPP 126 17.510 37.600 29.810 1.00 0.00 ATOM 15208 H4X DPP 126 16.430 37.520 29.560 1.00 0.00 ATOM 15209 H4Y DPP 126 17.660 38.700 29.760 1.00 0.00 ATOM 15210 C35 DPP 126 17.780 37.040 31.210 1.00 0.00 ATOM 15211 H5X DPP 126 18.840 37.180 31.530 1.00 0.00 ATOM 15212 H5Y DPP 126 17.560 35.950 31.330 1.00 0.00 ATOM 15213 C36 DPP 126 16.930 37.910 32.130 1.00 0.00 ATOM 15214 H6X DPP 126 15.890 37.530 32.090 1.00 0.00 ATOM 15215 H6Y DPP 126 16.970 39.010 32.000 1.00 0.00 ATOM 15216 C37 DPP 126 17.260 37.770 33.620 1.00 0.00 ATOM 15217 H7X DPP 126 18.320 37.460 33.730 1.00 0.00 ATOM 15218 H7Y DPP 126 16.690 36.920 34.060 1.00 0.00 ATOM 15219 C38 DPP 126 16.830 38.970 34.460 1.00 0.00 ATOM 15220 H8X DPP 126 15.780 39.260 34.230 1.00 0.00 ATOM 15221 H8Y DPP 126 17.380 39.760 33.890 1.00 0.00 ATOM 15222 C39 DPP 126 17.040 38.950 35.970 1.00 0.00 ATOM 15223 H9X DPP 126 17.280 39.950 36.370 1.00 0.00 ATOM 15224 H9Y DPP 126 17.910 38.270 36.050 1.00 0.00 ATOM 15225 0C31 DPP 126 15.820 38.440 36.740 1.00 0.00 ATOM 15226 H10X DPP 126 15.820 37.340 36.600 1.00 0.00 ATOM 15227 H10Y DPP 126 14.930 38.860 36.220 1.00 0.00 ATOM 15228 1C31 DPP 126 15.760 38.770 38.240 1.00 0.00 ATOM 15229 H11X DPP 126 14.940 38.140 38.650 1.00 0.00 ATOM 15230 H11Y DPP 126 15.500 39.820 38.500 1.00 0.00 ATOM 15231 2C31 DPP 126 17.040 38.410 38.990 1.00 0.00 ATOM 15232 H12X DPP 126 17.900 38.850 38.450 1.00 0.00 ATOM 15233 H12Y DPP 126 17.350 37.350 38.830 1.00 0.00 ATOM 15234 3C31 DPP 126 17.020 38.840 40.450 1.00 0.00 ATOM 15235 H13X DPP 126 16.490 38.110 41.110 1.00 0.00 ATOM 15236 H13Y DPP 126 16.500 39.800 40.640 1.00 0.00 ATOM 15237 4C31 DPP 126 18.370 38.870 41.170 1.00 0.00 ATOM 15238 H14X DPP 126 19.000 39.620 40.640 1.00 0.00 ATOM 15239 H14Y DPP 126 18.850 37.870 41.070 1.00 0.00 ATOM 15240 5C31 DPP 126 18.110 39.330 42.600 1.00 0.00 ATOM 15241 H15X DPP 126 17.460 38.590 43.100 1.00 0.00 ATOM 15242 H15Y DPP 126 17.650 40.350 42.580 1.00 0.00 ATOM 15243 6C31 DPP 126 19.330 39.310 43.520 1.00 0.00 ATOM 15244 H16X DPP 126 19.150 39.740 44.530 1.00 0.00 ATOM 15245 H16Y DPP 126 20.170 39.860 43.040 1.00 0.00 ATOM 15246 H16Z DPP 126 19.480 38.230 43.680 1.00 0.00 ATOM 15247 N DPP 127 1.150 2.650 22.570 1.00 0.00 ATOM 15248 HN1 DPP 127 0.480 1.870 22.440 1.00 0.00 ATOM 15249 HN2 DPP 127 1.640 2.600 23.490 1.00 0.00 ATOM 15250 HN3 DPP 127 0.600 3.530 22.480 1.00 0.00 ATOM 15251 C12 DPP 127 2.060 2.510 21.380 1.00 0.00 ATOM 15252 H12A DPP 127 2.990 3.040 21.700 1.00 0.00 ATOM 15253 H12B DPP 127 1.550 3.030 20.550 1.00 0.00 ATOM 15254 C11 DPP 127 2.240 1.040 20.970 1.00 0.00 ATOM 15255 H11A DPP 127 2.820 1.020 20.030 1.00 0.00 ATOM 15256 H11B DPP 127 1.340 0.420 20.800 1.00 0.00 ATOM 15257 P DPP 127 4.130 -0.500 21.870 1.00 0.00 ATOM 15258 O13 DPP 127 5.400 0.120 22.320 1.00 0.00 ATOM 15259 O14 DPP 127 4.060 -1.040 20.500 1.00 0.00 ATOM 15260 O11 DPP 127 3.880 -1.620 22.980 1.00 0.00 ATOM 15261 O12 DPP 127 2.860 0.450 22.110 1.00 0.00 ATOM 15262 C1 DPP 127 2.750 -2.480 22.880 1.00 0.00 ATOM 15263 HA DPP 127 3.080 -3.530 23.030 1.00 0.00 ATOM 15264 HB DPP 127 2.280 -2.360 21.880 1.00 0.00 ATOM 15265 C2 DPP 127 1.730 -2.260 24.010 1.00 0.00 ATOM 15266 HS DPP 127 1.110 -1.400 23.650 1.00 0.00 ATOM 15267 O21 DPP 127 2.390 -1.950 25.230 1.00 0.00 ATOM 15268 C21 DPP 127 1.750 -1.130 26.070 1.00 0.00 ATOM 15269 O22 DPP 127 0.750 -0.470 25.830 1.00 0.00 ATOM 15270 C22 DPP 127 2.650 -1.040 27.290 1.00 0.00 ATOM 15271 H2R DPP 127 2.220 -0.300 27.990 1.00 0.00 ATOM 15272 H2S DPP 127 3.640 -0.610 27.030 1.00 0.00 ATOM 15273 C3 DPP 127 0.650 -3.350 24.190 1.00 0.00 ATOM 15274 HX DPP 127 0.240 -3.710 23.220 1.00 0.00 ATOM 15275 HY DPP 127 -0.170 -2.770 24.660 1.00 0.00 ATOM 15276 O31 DPP 127 0.930 -4.440 25.070 1.00 0.00 ATOM 15277 C31 DPP 127 1.250 -5.590 24.480 1.00 0.00 ATOM 15278 O32 DPP 127 1.590 -5.630 23.310 1.00 0.00 ATOM 15279 C32 DPP 127 1.300 -6.670 25.550 1.00 0.00 ATOM 15280 H2X DPP 127 2.200 -7.290 25.390 1.00 0.00 ATOM 15281 H2Y DPP 127 0.410 -7.330 25.450 1.00 0.00 ATOM 15282 C23 DPP 127 3.040 -2.360 27.960 1.00 0.00 ATOM 15283 H3R DPP 127 4.150 -2.370 28.070 1.00 0.00 ATOM 15284 H3S DPP 127 2.600 -3.230 27.420 1.00 0.00 ATOM 15285 C24 DPP 127 2.530 -2.370 29.400 1.00 0.00 ATOM 15286 H4R DPP 127 2.590 -3.390 29.850 1.00 0.00 ATOM 15287 H4S DPP 127 1.500 -2.010 29.610 1.00 0.00 ATOM 15288 C25 DPP 127 3.400 -1.490 30.290 1.00 0.00 ATOM 15289 H5R DPP 127 3.310 -0.450 29.910 1.00 0.00 ATOM 15290 H5S DPP 127 4.440 -1.820 30.070 1.00 0.00 ATOM 15291 C26 DPP 127 3.130 -1.630 31.790 1.00 0.00 ATOM 15292 H6R DPP 127 3.130 -2.720 31.990 1.00 0.00 ATOM 15293 H6S DPP 127 2.100 -1.340 32.110 1.00 0.00 ATOM 15294 C27 DPP 127 4.190 -1.110 32.760 1.00 0.00 ATOM 15295 H7R DPP 127 4.110 -0.010 32.630 1.00 0.00 ATOM 15296 H7S DPP 127 5.250 -1.260 32.450 1.00 0.00 ATOM 15297 C28 DPP 127 3.990 -1.670 34.170 1.00 0.00 ATOM 15298 H8R DPP 127 3.880 -2.770 34.020 1.00 0.00 ATOM 15299 H8S DPP 127 3.030 -1.370 34.640 1.00 0.00 ATOM 15300 C29 DPP 127 5.130 -1.540 35.180 1.00 0.00 ATOM 15301 H9R DPP 127 6.110 -1.980 34.900 1.00 0.00 ATOM 15302 H9S DPP 127 4.750 -2.010 36.110 1.00 0.00 ATOM 15303 0C21 DPP 127 5.560 -0.120 35.560 1.00 0.00 ATOM 15304 H10R DPP 127 4.660 0.430 35.920 1.00 0.00 ATOM 15305 H10S DPP 127 6.010 0.220 34.600 1.00 0.00 ATOM 15306 1C21 DPP 127 6.600 -0.100 36.680 1.00 0.00 ATOM 15307 H11R DPP 127 7.570 -0.420 36.250 1.00 0.00 ATOM 15308 H11S DPP 127 6.400 -0.960 37.360 1.00 0.00 ATOM 15309 2C21 DPP 127 6.640 1.190 37.500 1.00 0.00 ATOM 15310 H12R DPP 127 5.620 1.570 37.730 1.00 0.00 ATOM 15311 H12S DPP 127 7.120 2.060 37.000 1.00 0.00 ATOM 15312 3C21 DPP 127 7.380 1.030 38.830 1.00 0.00 ATOM 15313 H13R DPP 127 8.250 0.380 38.600 1.00 0.00 ATOM 15314 H13S DPP 127 6.650 0.480 39.460 1.00 0.00 ATOM 15315 4C21 DPP 127 7.690 2.380 39.490 1.00 0.00 ATOM 15316 H14R DPP 127 6.730 2.930 39.610 1.00 0.00 ATOM 15317 H14S DPP 127 8.220 3.080 38.800 1.00 0.00 ATOM 15318 5C21 DPP 127 8.440 2.280 40.820 1.00 0.00 ATOM 15319 H15R DPP 127 8.790 3.270 41.190 1.00 0.00 ATOM 15320 H15S DPP 127 9.350 1.650 40.680 1.00 0.00 ATOM 15321 6C21 DPP 127 7.670 1.510 41.890 1.00 0.00 ATOM 15322 H16R DPP 127 8.110 1.620 42.900 1.00 0.00 ATOM 15323 H16S DPP 127 7.620 0.470 41.500 1.00 0.00 ATOM 15324 H16T DPP 127 6.650 1.950 41.920 1.00 0.00 ATOM 15325 C33 DPP 127 1.220 -6.140 26.990 1.00 0.00 ATOM 15326 H3X DPP 127 0.330 -5.500 27.140 1.00 0.00 ATOM 15327 H3Y DPP 127 1.980 -5.370 27.240 1.00 0.00 ATOM 15328 C34 DPP 127 1.230 -7.340 27.930 1.00 0.00 ATOM 15329 H4X DPP 127 1.960 -8.060 27.480 1.00 0.00 ATOM 15330 H4Y DPP 127 0.290 -7.930 27.920 1.00 0.00 ATOM 15331 C35 DPP 127 1.730 -7.090 29.360 1.00 0.00 ATOM 15332 H5X DPP 127 2.530 -6.320 29.330 1.00 0.00 ATOM 15333 H5Y DPP 127 2.210 -7.990 29.790 1.00 0.00 ATOM 15334 C36 DPP 127 0.640 -6.600 30.310 1.00 0.00 ATOM 15335 H6X DPP 127 -0.070 -7.440 30.450 1.00 0.00 ATOM 15336 H6Y DPP 127 0.140 -5.660 29.980 1.00 0.00 ATOM 15337 C37 DPP 127 1.290 -6.260 31.660 1.00 0.00 ATOM 15338 H7X DPP 127 1.870 -5.330 31.470 1.00 0.00 ATOM 15339 H7Y DPP 127 1.830 -7.190 31.940 1.00 0.00 ATOM 15340 C38 DPP 127 0.300 -5.870 32.750 1.00 0.00 ATOM 15341 H8X DPP 127 -0.400 -6.740 32.760 1.00 0.00 ATOM 15342 H8Y DPP 127 -0.210 -4.940 32.420 1.00 0.00 ATOM 15343 C39 DPP 127 0.980 -5.780 34.110 1.00 0.00 ATOM 15344 H9X DPP 127 1.640 -4.880 34.180 1.00 0.00 ATOM 15345 H9Y DPP 127 1.580 -6.680 34.340 1.00 0.00 ATOM 15346 0C31 DPP 127 -0.000 -5.620 35.270 1.00 0.00 ATOM 15347 H10X DPP 127 -0.790 -6.390 35.120 1.00 0.00 ATOM 15348 H10Y DPP 127 -0.430 -4.600 35.280 1.00 0.00 ATOM 15349 1C31 DPP 127 0.600 -5.950 36.640 1.00 0.00 ATOM 15350 H11X DPP 127 1.600 -5.500 36.790 1.00 0.00 ATOM 15351 H11Y DPP 127 0.590 -7.050 36.780 1.00 0.00 ATOM 15352 2C31 DPP 127 -0.310 -5.320 37.700 1.00 0.00 ATOM 15353 H12X DPP 127 -1.350 -5.530 37.400 1.00 0.00 ATOM 15354 H12Y DPP 127 -0.240 -4.210 37.760 1.00 0.00 ATOM 15355 3C31 DPP 127 0.010 -5.760 39.130 1.00 0.00 ATOM 15356 H13X DPP 127 1.100 -5.600 39.310 1.00 0.00 ATOM 15357 H13Y DPP 127 -0.280 -6.820 38.960 1.00 0.00 ATOM 15358 4C31 DPP 127 -0.790 -5.140 40.270 1.00 0.00 ATOM 15359 H14X DPP 127 -1.750 -4.880 39.780 1.00 0.00 ATOM 15360 H14Y DPP 127 -0.400 -4.110 40.440 1.00 0.00 ATOM 15361 5C31 DPP 127 -0.970 -5.950 41.560 1.00 0.00 ATOM 15362 H15X DPP 127 0.040 -5.960 42.030 1.00 0.00 ATOM 15363 H15Y DPP 127 -1.310 -7.000 41.480 1.00 0.00 ATOM 15364 6C31 DPP 127 -1.850 -5.170 42.530 1.00 0.00 ATOM 15365 H16X DPP 127 -2.920 -5.350 42.310 1.00 0.00 ATOM 15366 H16Y DPP 127 -1.580 -4.100 42.670 1.00 0.00 ATOM 15367 H16Z DPP 127 -1.610 -5.420 43.580 1.00 0.00 ATOM 15368 N DPP 128 34.570 17.390 23.020 1.00 0.00 ATOM 15369 HN1 DPP 128 34.890 18.050 22.280 1.00 0.00 ATOM 15370 HN2 DPP 128 33.620 17.080 22.740 1.00 0.00 ATOM 15371 HN3 DPP 128 34.420 17.850 23.940 1.00 0.00 ATOM 15372 C12 DPP 128 35.550 16.260 23.250 1.00 0.00 ATOM 15373 H12A DPP 128 35.880 15.870 22.270 1.00 0.00 ATOM 15374 H12B DPP 128 34.970 15.390 23.650 1.00 0.00 ATOM 15375 C11 DPP 128 36.780 16.580 24.090 1.00 0.00 ATOM 15376 H11A DPP 128 37.540 15.780 24.180 1.00 0.00 ATOM 15377 H11B DPP 128 36.350 16.780 25.100 1.00 0.00 ATOM 15378 P DPP 128 38.830 17.710 22.990 1.00 0.00 ATOM 15379 O13 DPP 128 39.190 19.150 22.930 1.00 0.00 ATOM 15380 O14 DPP 128 38.840 16.890 21.760 1.00 0.00 ATOM 15381 O11 DPP 128 39.730 16.910 24.050 1.00 0.00 ATOM 15382 O12 DPP 128 37.340 17.790 23.570 1.00 0.00 ATOM 15383 C1 DPP 128 40.560 17.680 24.930 1.00 0.00 ATOM 15384 HA DPP 128 40.760 18.740 24.690 1.00 0.00 ATOM 15385 HB DPP 128 41.530 17.130 24.940 1.00 0.00 ATOM 15386 C2 DPP 128 40.000 17.690 26.360 1.00 0.00 ATOM 15387 HS DPP 128 40.830 17.870 27.080 1.00 0.00 ATOM 15388 O21 DPP 128 39.340 16.480 26.720 1.00 0.00 ATOM 15389 C21 DPP 128 40.180 15.480 26.980 1.00 0.00 ATOM 15390 O22 DPP 128 41.390 15.510 26.850 1.00 0.00 ATOM 15391 C22 DPP 128 39.250 14.340 27.380 1.00 0.00 ATOM 15392 H2R DPP 128 39.110 13.730 26.460 1.00 0.00 ATOM 15393 H2S DPP 128 38.210 14.540 27.700 1.00 0.00 ATOM 15394 C3 DPP 128 39.160 18.950 26.680 1.00 0.00 ATOM 15395 HX DPP 128 38.650 18.900 25.690 1.00 0.00 ATOM 15396 HY DPP 128 39.600 19.960 26.650 1.00 0.00 ATOM 15397 O31 DPP 128 38.280 18.730 27.780 1.00 0.00 ATOM 15398 C31 DPP 128 37.060 19.250 27.600 1.00 0.00 ATOM 15399 O32 DPP 128 36.650 19.570 26.500 1.00 0.00 ATOM 15400 C32 DPP 128 36.390 19.370 28.960 1.00 0.00 ATOM 15401 H2X DPP 128 36.900 20.080 29.650 1.00 0.00 ATOM 15402 H2Y DPP 128 36.430 18.390 29.460 1.00 0.00 ATOM 15403 C23 DPP 128 40.070 13.550 28.400 1.00 0.00 ATOM 15404 H3R DPP 128 40.280 14.240 29.250 1.00 0.00 ATOM 15405 H3S DPP 128 41.030 13.110 28.080 1.00 0.00 ATOM 15406 C24 DPP 128 39.370 12.360 29.050 1.00 0.00 ATOM 15407 H4R DPP 128 38.920 11.700 28.270 1.00 0.00 ATOM 15408 H4S DPP 128 38.690 12.870 29.760 1.00 0.00 ATOM 15409 C25 DPP 128 40.260 11.570 30.020 1.00 0.00 ATOM 15410 H5R DPP 128 40.880 12.390 30.430 1.00 0.00 ATOM 15411 H5S DPP 128 41.030 11.100 29.380 1.00 0.00 ATOM 15412 C26 DPP 128 39.550 10.700 31.060 1.00 0.00 ATOM 15413 H6R DPP 128 38.690 11.230 31.500 1.00 0.00 ATOM 15414 H6S DPP 128 40.350 10.370 31.750 1.00 0.00 ATOM 15415 C27 DPP 128 38.980 9.410 30.450 1.00 0.00 ATOM 15416 H7R DPP 128 39.730 9.020 29.730 1.00 0.00 ATOM 15417 H7S DPP 128 38.180 9.630 29.720 1.00 0.00 ATOM 15418 C28 DPP 128 38.510 8.450 31.540 1.00 0.00 ATOM 15419 H8R DPP 128 37.750 9.050 32.080 1.00 0.00 ATOM 15420 H8S DPP 128 39.350 8.220 32.240 1.00 0.00 ATOM 15421 C29 DPP 128 37.850 7.160 31.080 1.00 0.00 ATOM 15422 H9R DPP 128 38.620 6.590 30.510 1.00 0.00 ATOM 15423 H9S DPP 128 36.900 7.320 30.520 1.00 0.00 ATOM 15424 0C21 DPP 128 37.370 6.400 32.320 1.00 0.00 ATOM 15425 H10R DPP 128 36.940 7.080 33.100 1.00 0.00 ATOM 15426 H10S DPP 128 38.320 6.040 32.760 1.00 0.00 ATOM 15427 1C21 DPP 128 36.410 5.220 32.190 1.00 0.00 ATOM 15428 H11R DPP 128 37.000 4.320 31.890 1.00 0.00 ATOM 15429 H11S DPP 128 35.650 5.480 31.440 1.00 0.00 ATOM 15430 2C21 DPP 128 35.540 4.850 33.400 1.00 0.00 ATOM 15431 H12R DPP 128 34.950 5.730 33.740 1.00 0.00 ATOM 15432 H12S DPP 128 36.190 4.410 34.180 1.00 0.00 ATOM 15433 3C21 DPP 128 34.480 3.760 33.250 1.00 0.00 ATOM 15434 H13R DPP 128 35.090 2.900 32.910 1.00 0.00 ATOM 15435 H13S DPP 128 33.830 4.090 32.410 1.00 0.00 ATOM 15436 4C21 DPP 128 33.750 3.510 34.570 1.00 0.00 ATOM 15437 H14R DPP 128 33.290 4.490 34.830 1.00 0.00 ATOM 15438 H14S DPP 128 34.420 3.180 35.390 1.00 0.00 ATOM 15439 5C21 DPP 128 32.540 2.610 34.340 1.00 0.00 ATOM 15440 H15R DPP 128 32.810 1.650 33.850 1.00 0.00 ATOM 15441 H15S DPP 128 31.860 3.180 33.670 1.00 0.00 ATOM 15442 6C21 DPP 128 31.700 2.190 35.540 1.00 0.00 ATOM 15443 H16R DPP 128 30.850 1.520 35.290 1.00 0.00 ATOM 15444 H16S DPP 128 31.200 3.020 36.070 1.00 0.00 ATOM 15445 H16T DPP 128 32.290 1.640 36.300 1.00 0.00 ATOM 15446 C33 DPP 128 34.910 19.720 28.770 1.00 0.00 ATOM 15447 H3X DPP 128 34.420 18.870 28.240 1.00 0.00 ATOM 15448 H3Y DPP 128 34.790 20.540 28.030 1.00 0.00 ATOM 15449 C34 DPP 128 34.170 20.050 30.070 1.00 0.00 ATOM 15450 H4X DPP 128 34.670 19.420 30.840 1.00 0.00 ATOM 15451 H4Y DPP 128 33.120 19.730 29.930 1.00 0.00 ATOM 15452 C35 DPP 128 34.390 21.510 30.470 1.00 0.00 ATOM 15453 H5X DPP 128 34.120 22.160 29.610 1.00 0.00 ATOM 15454 H5Y DPP 128 35.450 21.600 30.780 1.00 0.00 ATOM 15455 C36 DPP 128 33.390 21.800 31.590 1.00 0.00 ATOM 15456 H6X DPP 128 32.360 21.420 31.430 1.00 0.00 ATOM 15457 H6Y DPP 128 33.450 22.910 31.620 1.00 0.00 ATOM 15458 C37 DPP 128 33.810 21.320 32.990 1.00 0.00 ATOM 15459 H7X DPP 128 34.820 21.690 33.220 1.00 0.00 ATOM 15460 H7Y DPP 128 33.850 20.210 32.920 1.00 0.00 ATOM 15461 C38 DPP 128 32.780 21.800 34.020 1.00 0.00 ATOM 15462 H8X DPP 128 31.830 21.240 33.920 1.00 0.00 ATOM 15463 H8Y DPP 128 32.600 22.880 33.870 1.00 0.00 ATOM 15464 C39 DPP 128 33.390 21.730 35.420 1.00 0.00 ATOM 15465 H9X DPP 128 34.370 22.230 35.490 1.00 0.00 ATOM 15466 H9Y DPP 128 33.680 20.670 35.610 1.00 0.00 ATOM 15467 0C31 DPP 128 32.500 22.400 36.470 1.00 0.00 ATOM 15468 H10X DPP 128 31.610 21.780 36.720 1.00 0.00 ATOM 15469 H10Y DPP 128 32.170 23.400 36.110 1.00 0.00 ATOM 15470 1C31 DPP 128 33.240 22.670 37.780 1.00 0.00 ATOM 15471 H11X DPP 128 33.900 23.570 37.750 1.00 0.00 ATOM 15472 H11Y DPP 128 34.060 21.950 37.980 1.00 0.00 ATOM 15473 2C31 DPP 128 32.340 22.820 39.010 1.00 0.00 ATOM 15474 H12X DPP 128 31.590 22.000 39.100 1.00 0.00 ATOM 15475 H12Y DPP 128 31.810 23.760 38.740 1.00 0.00 ATOM 15476 3C31 DPP 128 33.150 22.880 40.300 1.00 0.00 ATOM 15477 H13X DPP 128 32.700 23.270 41.240 1.00 0.00 ATOM 15478 H13Y DPP 128 34.020 23.530 40.050 1.00 0.00 ATOM 15479 4C31 DPP 128 33.780 21.520 40.610 1.00 0.00 ATOM 15480 H14X DPP 128 34.270 21.430 41.600 1.00 0.00 ATOM 15481 H14Y DPP 128 34.640 21.290 39.950 1.00 0.00 ATOM 15482 5C31 DPP 128 32.840 20.320 40.500 1.00 0.00 ATOM 15483 H15X DPP 128 32.740 20.160 39.400 1.00 0.00 ATOM 15484 H15Y DPP 128 31.810 20.640 40.760 1.00 0.00 ATOM 15485 6C31 DPP 128 33.070 18.990 41.210 1.00 0.00 ATOM 15486 H16X DPP 128 33.000 18.950 42.320 1.00 0.00 ATOM 15487 H16Y DPP 128 32.270 18.300 40.860 1.00 0.00 ATOM 15488 H16Z DPP 128 33.970 18.540 40.740 1.00 0.00 ATOM 15489 OH2 SOL 129 46.020 27.210 5.760 1.00 0.00 ATOM 15490 H1 SOL 129 46.230 27.340 4.830 1.00 0.00 ATOM 15491 H2 SOL 129 46.630 27.780 6.230 1.00 0.00 ATOM 15492 OH2 SOL 130 32.330 31.900 13.230 1.00 0.00 ATOM 15493 H1 SOL 130 33.260 32.100 13.140 1.00 0.00 ATOM 15494 H2 SOL 130 31.900 32.750 13.240 1.00 0.00 ATOM 15495 OH2 SOL 131 24.880 42.750 9.180 1.00 0.00 ATOM 15496 H1 SOL 131 25.250 42.640 8.300 1.00 0.00 ATOM 15497 H2 SOL 131 25.630 43.000 9.720 1.00 0.00 ATOM 15498 OH2 SOL 132 7.270 3.490 66.480 1.00 0.00 ATOM 15499 H1 SOL 132 6.950 4.370 66.690 1.00 0.00 ATOM 15500 H2 SOL 132 6.610 3.140 65.870 1.00 0.00 ATOM 15501 OH2 SOL 133 29.380 2.040 10.720 1.00 0.00 ATOM 15502 H1 SOL 133 28.650 2.470 10.280 1.00 0.00 ATOM 15503 H2 SOL 133 29.290 1.120 10.490 1.00 0.00 ATOM 15504 OH2 SOL 134 48.690 59.650 14.710 1.00 0.00 ATOM 15505 H1 SOL 134 48.640 59.090 13.930 1.00 0.00 ATOM 15506 H2 SOL 134 48.540 60.540 14.380 1.00 0.00 ATOM 15507 OH2 SOL 135 24.970 45.260 16.110 1.00 0.00 ATOM 15508 H1 SOL 135 24.820 44.690 16.860 1.00 0.00 ATOM 15509 H2 SOL 135 24.290 45.020 15.480 1.00 0.00 ATOM 15510 OH2 SOL 136 14.520 19.940 17.320 1.00 0.00 ATOM 15511 H1 SOL 136 13.990 20.320 18.020 1.00 0.00 ATOM 15512 H2 SOL 136 13.890 19.480 16.760 1.00 0.00 ATOM 15513 OH2 SOL 137 9.100 44.620 16.910 1.00 0.00 ATOM 15514 H1 SOL 137 9.210 44.690 15.960 1.00 0.00 ATOM 15515 H2 SOL 137 8.850 45.510 17.180 1.00 0.00 ATOM 15516 OH2 SOL 138 32.580 47.500 84.080 1.00 0.00 ATOM 15517 H1 SOL 138 32.820 46.970 84.850 1.00 0.00 ATOM 15518 H2 SOL 138 33.330 47.430 83.500 1.00 0.00 ATOM 15519 OH2 SOL 139 41.870 6.290 3.780 1.00 0.00 ATOM 15520 H1 SOL 139 40.970 6.050 4.020 1.00 0.00 ATOM 15521 H2 SOL 139 42.200 6.770 4.540 1.00 0.00 ATOM 15522 OH2 SOL 140 42.590 21.780 11.230 1.00 0.00 ATOM 15523 H1 SOL 140 41.780 21.920 11.720 1.00 0.00 ATOM 15524 H2 SOL 140 43.200 22.440 11.570 1.00 0.00 ATOM 15525 OH2 SOL 141 27.910 9.980 15.240 1.00 0.00 ATOM 15526 H1 SOL 141 27.430 9.160 15.300 1.00 0.00 ATOM 15527 H2 SOL 141 27.300 10.600 14.840 1.00 0.00 ATOM 15528 OH2 SOL 142 57.510 21.170 8.050 1.00 0.00 ATOM 15529 H1 SOL 142 58.400 21.240 8.410 1.00 0.00 ATOM 15530 H2 SOL 142 57.410 21.950 7.500 1.00 0.00 ATOM 15531 OH2 SOL 143 6.940 46.530 2.590 1.00 0.00 ATOM 15532 H1 SOL 143 7.100 47.380 2.200 1.00 0.00 ATOM 15533 H2 SOL 143 7.260 46.600 3.490 1.00 0.00 ATOM 15534 OH2 SOL 144 8.170 15.350 2.490 1.00 0.00 ATOM 15535 H1 SOL 144 8.860 14.750 2.180 1.00 0.00 ATOM 15536 H2 SOL 144 7.360 14.950 2.190 1.00 0.00 ATOM 15537 OH2 SOL 145 35.730 14.420 2.680 1.00 0.00 ATOM 15538 H1 SOL 145 35.810 14.330 3.630 1.00 0.00 ATOM 15539 H2 SOL 145 35.020 13.840 2.440 1.00 0.00 ATOM 15540 OH2 SOL 146 21.170 45.240 78.420 1.00 0.00 ATOM 15541 H1 SOL 146 21.820 45.680 78.970 1.00 0.00 ATOM 15542 H2 SOL 146 21.200 44.320 78.690 1.00 0.00 ATOM 15543 OH2 SOL 147 25.720 33.630 65.210 1.00 0.00 ATOM 15544 H1 SOL 147 25.420 32.750 65.430 1.00 0.00 ATOM 15545 H2 SOL 147 24.920 34.090 64.930 1.00 0.00 ATOM 15546 OH2 SOL 148 55.390 16.420 9.470 1.00 0.00 ATOM 15547 H1 SOL 148 55.560 17.360 9.470 1.00 0.00 ATOM 15548 H2 SOL 148 55.220 16.210 10.390 1.00 0.00 ATOM 15549 OH2 SOL 149 3.410 32.530 65.920 1.00 0.00 ATOM 15550 H1 SOL 149 2.650 32.180 65.460 1.00 0.00 ATOM 15551 H2 SOL 149 3.760 31.800 66.420 1.00 0.00 ATOM 15552 OH2 SOL 150 8.100 15.330 77.750 1.00 0.00 ATOM 15553 H1 SOL 150 7.400 15.580 77.150 1.00 0.00 ATOM 15554 H2 SOL 150 7.900 14.420 77.980 1.00 0.00 ATOM 15555 OH2 SOL 151 15.020 28.730 17.500 1.00 0.00 ATOM 15556 H1 SOL 151 14.160 28.400 17.740 1.00 0.00 ATOM 15557 H2 SOL 151 15.470 28.840 18.340 1.00 0.00 ATOM 15558 OH2 SOL 152 13.390 20.310 13.070 1.00 0.00 ATOM 15559 H1 SOL 152 13.060 19.800 12.330 1.00 0.00 ATOM 15560 H2 SOL 152 14.220 20.660 12.760 1.00 0.00 ATOM 15561 OH2 SOL 153 57.010 26.910 67.360 1.00 0.00 ATOM 15562 H1 SOL 153 56.850 27.740 66.920 1.00 0.00 ATOM 15563 H2 SOL 153 56.190 26.720 67.820 1.00 0.00 ATOM 15564 OH2 SOL 154 57.900 1.740 4.120 1.00 0.00 ATOM 15565 H1 SOL 154 57.230 2.390 3.920 1.00 0.00 ATOM 15566 H2 SOL 154 58.290 1.520 3.280 1.00 0.00 ATOM 15567 OH2 SOL 155 47.410 22.020 9.690 1.00 0.00 ATOM 15568 H1 SOL 155 47.370 21.600 8.830 1.00 0.00 ATOM 15569 H2 SOL 155 46.490 22.120 9.950 1.00 0.00 ATOM 15570 OH2 SOL 156 56.060 5.130 5.250 1.00 0.00 ATOM 15571 H1 SOL 156 56.770 5.680 5.590 1.00 0.00 ATOM 15572 H2 SOL 156 55.760 4.630 6.000 1.00 0.00 ATOM 15573 OH2 SOL 157 10.370 56.570 83.990 1.00 0.00 ATOM 15574 H1 SOL 157 10.990 57.100 83.500 1.00 0.00 ATOM 15575 H2 SOL 157 9.980 55.980 83.340 1.00 0.00 ATOM 15576 OH2 SOL 158 5.330 12.400 83.950 1.00 0.00 ATOM 15577 H1 SOL 158 6.280 12.330 83.820 1.00 0.00 ATOM 15578 H2 SOL 158 5.000 11.520 83.780 1.00 0.00 ATOM 15579 OH2 SOL 159 16.960 33.920 16.610 1.00 0.00 ATOM 15580 H1 SOL 159 16.550 33.150 16.210 1.00 0.00 ATOM 15581 H2 SOL 159 16.430 34.650 16.310 1.00 0.00 ATOM 15582 OH2 SOL 160 50.930 16.940 67.650 1.00 0.00 ATOM 15583 H1 SOL 160 51.180 16.320 68.340 1.00 0.00 ATOM 15584 H2 SOL 160 51.000 17.800 68.060 1.00 0.00 ATOM 15585 OH2 SOL 161 28.620 40.740 2.290 1.00 0.00 ATOM 15586 H1 SOL 161 28.560 41.270 1.500 1.00 0.00 ATOM 15587 H2 SOL 161 29.500 40.920 2.640 1.00 0.00 ATOM 15588 OH2 SOL 162 24.970 23.440 11.280 1.00 0.00 ATOM 15589 H1 SOL 162 25.650 23.440 11.960 1.00 0.00 ATOM 15590 H2 SOL 162 24.370 24.130 11.560 1.00 0.00 ATOM 15591 OH2 SOL 163 45.560 58.560 72.850 1.00 0.00 ATOM 15592 H1 SOL 163 45.780 58.710 73.770 1.00 0.00 ATOM 15593 H2 SOL 163 45.520 59.430 72.470 1.00 0.00 ATOM 15594 OH2 SOL 164 58.640 58.950 11.930 1.00 0.00 ATOM 15595 H1 SOL 164 57.880 58.920 12.520 1.00 0.00 ATOM 15596 H2 SOL 164 59.240 58.300 12.280 1.00 0.00 ATOM 15597 OH2 SOL 165 23.130 10.420 3.880 1.00 0.00 ATOM 15598 H1 SOL 165 22.320 10.790 4.220 1.00 0.00 ATOM 15599 H2 SOL 165 22.940 9.490 3.770 1.00 0.00 ATOM 15600 OH2 SOL 166 58.530 52.970 82.690 1.00 0.00 ATOM 15601 H1 SOL 166 57.950 53.240 83.400 1.00 0.00 ATOM 15602 H2 SOL 166 58.300 53.550 81.960 1.00 0.00 ATOM 15603 OH2 SOL 167 42.190 58.660 73.000 1.00 0.00 ATOM 15604 H1 SOL 167 41.810 58.060 72.360 1.00 0.00 ATOM 15605 H2 SOL 167 41.450 58.930 73.540 1.00 0.00 ATOM 15606 OH2 SOL 168 17.030 30.850 18.950 1.00 0.00 ATOM 15607 H1 SOL 168 17.380 29.980 19.130 1.00 0.00 ATOM 15608 H2 SOL 168 16.420 30.720 18.220 1.00 0.00 ATOM 15609 OH2 SOL 169 54.040 12.450 4.720 1.00 0.00 ATOM 15610 H1 SOL 169 53.720 13.320 4.450 1.00 0.00 ATOM 15611 H2 SOL 169 54.840 12.320 4.210 1.00 0.00 ATOM 15612 OH2 SOL 170 22.760 6.570 5.910 1.00 0.00 ATOM 15613 H1 SOL 170 22.120 7.180 6.260 1.00 0.00 ATOM 15614 H2 SOL 170 22.540 5.720 6.300 1.00 0.00 ATOM 15615 OH2 SOL 171 40.560 27.370 75.380 1.00 0.00 ATOM 15616 H1 SOL 171 40.050 27.680 76.130 1.00 0.00 ATOM 15617 H2 SOL 171 40.320 27.970 74.670 1.00 0.00 ATOM 15618 OH2 SOL 172 25.750 46.390 18.590 1.00 0.00 ATOM 15619 H1 SOL 172 25.600 46.360 17.650 1.00 0.00 ATOM 15620 H2 SOL 172 24.910 46.160 18.980 1.00 0.00 ATOM 15621 OH2 SOL 173 50.090 11.740 72.590 1.00 0.00 ATOM 15622 H1 SOL 173 49.290 11.350 72.950 1.00 0.00 ATOM 15623 H2 SOL 173 50.680 11.830 73.340 1.00 0.00 ATOM 15624 OH2 SOL 174 4.230 12.830 8.040 1.00 0.00 ATOM 15625 H1 SOL 174 3.340 12.960 7.730 1.00 0.00 ATOM 15626 H2 SOL 174 4.760 13.440 7.530 1.00 0.00 ATOM 15627 OH2 SOL 175 20.300 59.110 71.940 1.00 0.00 ATOM 15628 H1 SOL 175 20.980 59.540 72.450 1.00 0.00 ATOM 15629 H2 SOL 175 20.220 59.640 71.150 1.00 0.00 ATOM 15630 OH2 SOL 176 45.380 17.800 2.660 1.00 0.00 ATOM 15631 H1 SOL 176 45.510 17.100 3.300 1.00 0.00 ATOM 15632 H2 SOL 176 45.940 17.560 1.920 1.00 0.00 ATOM 15633 OH2 SOL 177 56.110 16.710 3.740 1.00 0.00 ATOM 15634 H1 SOL 177 56.240 16.590 4.690 1.00 0.00 ATOM 15635 H2 SOL 177 55.500 17.440 3.670 1.00 0.00 ATOM 15636 OH2 SOL 178 14.020 2.040 24.190 1.00 0.00 ATOM 15637 H1 SOL 178 13.690 1.690 25.010 1.00 0.00 ATOM 15638 H2 SOL 178 14.970 1.920 24.250 1.00 0.00 ATOM 15639 OH2 SOL 179 29.600 10.530 80.230 1.00 0.00 ATOM 15640 H1 SOL 179 29.200 11.050 80.930 1.00 0.00 ATOM 15641 H2 SOL 179 30.440 10.960 80.070 1.00 0.00 ATOM 15642 OH2 SOL 180 34.010 22.740 81.950 1.00 0.00 ATOM 15643 H1 SOL 180 33.750 23.610 81.650 1.00 0.00 ATOM 15644 H2 SOL 180 33.360 22.150 81.580 1.00 0.00 ATOM 15645 OH2 SOL 181 29.030 18.690 -0.030 1.00 0.00 ATOM 15646 H1 SOL 181 29.590 17.910 -0.020 1.00 0.00 ATOM 15647 H2 SOL 181 28.290 18.460 0.530 1.00 0.00 ATOM 15648 OH2 SOL 182 -0.180 39.640 11.110 1.00 0.00 ATOM 15649 H1 SOL 182 0.070 38.890 11.670 1.00 0.00 ATOM 15650 H2 SOL 182 0.460 39.620 10.400 1.00 0.00 ATOM 15651 OH2 SOL 183 32.830 21.340 16.070 1.00 0.00 ATOM 15652 H1 SOL 183 33.170 20.590 15.580 1.00 0.00 ATOM 15653 H2 SOL 183 33.600 21.900 16.200 1.00 0.00 ATOM 15654 OH2 SOL 184 20.630 6.100 1.960 1.00 0.00 ATOM 15655 H1 SOL 184 21.180 6.650 1.400 1.00 0.00 ATOM 15656 H2 SOL 184 20.200 5.500 1.350 1.00 0.00 ATOM 15657 OH2 SOL 185 43.860 23.230 82.290 1.00 0.00 ATOM 15658 H1 SOL 185 43.180 23.550 82.880 1.00 0.00 ATOM 15659 H2 SOL 185 43.610 22.330 82.100 1.00 0.00 ATOM 15660 OH2 SOL 186 29.650 9.230 69.470 1.00 0.00 ATOM 15661 H1 SOL 186 29.950 8.420 69.060 1.00 0.00 ATOM 15662 H2 SOL 186 30.160 9.920 69.040 1.00 0.00 ATOM 15663 OH2 SOL 187 56.970 50.390 63.830 1.00 0.00 ATOM 15664 H1 SOL 187 56.330 49.940 63.280 1.00 0.00 ATOM 15665 H2 SOL 187 57.290 49.720 64.430 1.00 0.00 ATOM 15666 OH2 SOL 188 56.220 30.750 21.010 1.00 0.00 ATOM 15667 H1 SOL 188 56.060 31.690 21.100 1.00 0.00 ATOM 15668 H2 SOL 188 56.220 30.600 20.070 1.00 0.00 ATOM 15669 OH2 SOL 189 40.350 59.720 16.830 1.00 0.00 ATOM 15670 H1 SOL 189 39.690 59.150 16.420 1.00 0.00 ATOM 15671 H2 SOL 189 40.350 59.460 17.750 1.00 0.00 ATOM 15672 OH2 SOL 190 5.790 54.320 1.680 1.00 0.00 ATOM 15673 H1 SOL 190 5.680 54.200 0.740 1.00 0.00 ATOM 15674 H2 SOL 190 5.240 53.640 2.070 1.00 0.00 ATOM 15675 OH2 SOL 191 53.440 33.500 2.250 1.00 0.00 ATOM 15676 H1 SOL 191 54.250 33.480 2.770 1.00 0.00 ATOM 15677 H2 SOL 191 53.020 32.660 2.430 1.00 0.00 ATOM 15678 OH2 SOL 192 7.050 3.830 79.670 1.00 0.00 ATOM 15679 H1 SOL 192 7.490 3.670 80.500 1.00 0.00 ATOM 15680 H2 SOL 192 7.360 4.700 79.400 1.00 0.00 ATOM 15681 OH2 SOL 193 19.770 50.360 65.310 1.00 0.00 ATOM 15682 H1 SOL 193 20.400 50.280 64.590 1.00 0.00 ATOM 15683 H2 SOL 193 19.100 49.700 65.110 1.00 0.00 ATOM 15684 OH2 SOL 194 59.040 8.530 10.760 1.00 0.00 ATOM 15685 H1 SOL 194 59.140 9.480 10.700 1.00 0.00 ATOM 15686 H2 SOL 194 58.110 8.390 10.920 1.00 0.00 ATOM 15687 OH2 SOL 195 30.370 16.240 -0.020 1.00 0.00 ATOM 15688 H1 SOL 195 31.260 15.920 0.090 1.00 0.00 ATOM 15689 H2 SOL 195 29.830 15.610 0.470 1.00 0.00 ATOM 15690 OH2 SOL 196 5.640 21.740 8.210 1.00 0.00 ATOM 15691 H1 SOL 196 5.510 20.810 7.980 1.00 0.00 ATOM 15692 H2 SOL 196 5.110 22.210 7.570 1.00 0.00 ATOM 15693 OH2 SOL 197 30.380 34.660 6.810 1.00 0.00 ATOM 15694 H1 SOL 197 30.750 34.310 7.620 1.00 0.00 ATOM 15695 H2 SOL 197 30.230 35.590 6.990 1.00 0.00 ATOM 15696 OH2 SOL 198 8.280 18.060 3.320 1.00 0.00 ATOM 15697 H1 SOL 198 8.200 17.130 3.120 1.00 0.00 ATOM 15698 H2 SOL 198 9.210 18.250 3.230 1.00 0.00 ATOM 15699 OH2 SOL 199 6.680 19.900 71.210 1.00 0.00 ATOM 15700 H1 SOL 199 7.310 19.180 71.150 1.00 0.00 ATOM 15701 H2 SOL 199 5.830 19.470 71.270 1.00 0.00 ATOM 15702 OH2 SOL 200 57.510 29.610 83.150 1.00 0.00 ATOM 15703 H1 SOL 200 57.470 28.690 82.900 1.00 0.00 ATOM 15704 H2 SOL 200 56.790 29.730 83.760 1.00 0.00 ATOM 15705 OH2 SOL 201 38.960 9.610 54.980 1.00 0.00 ATOM 15706 H1 SOL 201 39.790 9.160 54.820 1.00 0.00 ATOM 15707 H2 SOL 201 38.680 9.900 54.110 1.00 0.00 ATOM 15708 OH2 SOL 202 48.730 12.830 26.600 1.00 0.00 ATOM 15709 H1 SOL 202 47.930 13.310 26.790 1.00 0.00 ATOM 15710 H2 SOL 202 48.590 11.970 27.010 1.00 0.00 ATOM 15711 OH2 SOL 203 44.960 34.410 18.320 1.00 0.00 ATOM 15712 H1 SOL 203 44.860 35.310 18.610 1.00 0.00 ATOM 15713 H2 SOL 203 45.890 34.210 18.470 1.00 0.00 ATOM 15714 OH2 SOL 204 44.850 4.000 6.170 1.00 0.00 ATOM 15715 H1 SOL 204 45.180 3.730 5.310 1.00 0.00 ATOM 15716 H2 SOL 204 44.670 4.930 6.080 1.00 0.00 ATOM 15717 OH2 SOL 205 50.210 10.030 79.870 1.00 0.00 ATOM 15718 H1 SOL 205 50.360 10.980 79.820 1.00 0.00 ATOM 15719 H2 SOL 205 50.580 9.780 80.720 1.00 0.00 ATOM 15720 OH2 SOL 206 15.720 12.640 25.140 1.00 0.00 ATOM 15721 H1 SOL 206 16.060 12.440 24.270 1.00 0.00 ATOM 15722 H2 SOL 206 15.310 11.820 25.420 1.00 0.00 ATOM 15723 OH2 SOL 207 39.350 10.800 1.410 1.00 0.00 ATOM 15724 H1 SOL 207 38.460 10.820 1.770 1.00 0.00 ATOM 15725 H2 SOL 207 39.880 10.400 2.100 1.00 0.00 ATOM 15726 OH2 SOL 208 39.280 57.110 79.530 1.00 0.00 ATOM 15727 H1 SOL 208 38.360 57.110 79.240 1.00 0.00 ATOM 15728 H2 SOL 208 39.760 57.520 78.810 1.00 0.00 ATOM 15729 OH2 SOL 209 22.310 38.750 84.440 1.00 0.00 ATOM 15730 H1 SOL 209 22.140 37.890 84.060 1.00 0.00 ATOM 15731 H2 SOL 209 23.140 39.030 84.030 1.00 0.00 ATOM 15732 OH2 SOL 210 58.730 17.080 1.140 1.00 0.00 ATOM 15733 H1 SOL 210 58.550 16.320 1.690 1.00 0.00 ATOM 15734 H2 SOL 210 58.690 16.740 0.240 1.00 0.00 ATOM 15735 OH2 SOL 211 10.800 11.150 76.380 1.00 0.00 ATOM 15736 H1 SOL 211 11.570 11.570 76.770 1.00 0.00 ATOM 15737 H2 SOL 211 11.100 10.840 75.530 1.00 0.00 ATOM 15738 OH2 SOL 212 35.230 3.190 3.030 1.00 0.00 ATOM 15739 H1 SOL 212 35.530 2.670 2.280 1.00 0.00 ATOM 15740 H2 SOL 212 36.020 3.310 3.560 1.00 0.00 ATOM 15741 OH2 SOL 213 1.270 12.330 0.630 1.00 0.00 ATOM 15742 H1 SOL 213 1.780 12.480 -0.170 1.00 0.00 ATOM 15743 H2 SOL 213 0.430 12.760 0.470 1.00 0.00 ATOM 15744 OH2 SOL 214 22.530 24.500 12.520 1.00 0.00 ATOM 15745 H1 SOL 214 21.660 24.180 12.760 1.00 0.00 ATOM 15746 H2 SOL 214 23.010 24.540 13.340 1.00 0.00 ATOM 15747 OH2 SOL 215 28.540 33.030 15.080 1.00 0.00 ATOM 15748 H1 SOL 215 27.930 32.330 14.860 1.00 0.00 ATOM 15749 H2 SOL 215 29.050 32.690 15.820 1.00 0.00 ATOM 15750 OH2 SOL 216 4.320 24.630 77.850 1.00 0.00 ATOM 15751 H1 SOL 216 4.140 24.890 78.760 1.00 0.00 ATOM 15752 H2 SOL 216 4.590 23.710 77.920 1.00 0.00 ATOM 15753 OH2 SOL 217 50.630 29.820 5.940 1.00 0.00 ATOM 15754 H1 SOL 217 50.930 30.670 6.260 1.00 0.00 ATOM 15755 H2 SOL 217 50.470 29.300 6.730 1.00 0.00 ATOM 15756 OH2 SOL 218 13.270 3.860 67.380 1.00 0.00 ATOM 15757 H1 SOL 218 13.570 3.650 68.270 1.00 0.00 ATOM 15758 H2 SOL 218 12.330 4.010 67.470 1.00 0.00 ATOM 15759 OH2 SOL 219 29.030 2.270 19.120 1.00 0.00 ATOM 15760 H1 SOL 219 29.360 2.710 19.900 1.00 0.00 ATOM 15761 H2 SOL 219 28.950 2.970 18.470 1.00 0.00 ATOM 15762 OH2 SOL 220 23.750 49.830 76.790 1.00 0.00 ATOM 15763 H1 SOL 220 23.740 50.350 77.600 1.00 0.00 ATOM 15764 H2 SOL 220 24.230 49.040 77.020 1.00 0.00 ATOM 15765 OH2 SOL 221 9.240 43.080 69.240 1.00 0.00 ATOM 15766 H1 SOL 221 9.980 42.490 69.420 1.00 0.00 ATOM 15767 H2 SOL 221 9.010 43.450 70.100 1.00 0.00 ATOM 15768 OH2 SOL 222 43.880 17.810 70.360 1.00 0.00 ATOM 15769 H1 SOL 222 43.270 17.600 71.070 1.00 0.00 ATOM 15770 H2 SOL 222 43.420 18.490 69.860 1.00 0.00 ATOM 15771 OH2 SOL 223 1.590 9.300 77.700 1.00 0.00 ATOM 15772 H1 SOL 223 2.390 9.100 78.170 1.00 0.00 ATOM 15773 H2 SOL 223 1.310 8.470 77.320 1.00 0.00 ATOM 15774 OH2 SOL 224 50.180 23.640 65.490 1.00 0.00 ATOM 15775 H1 SOL 224 50.090 23.310 64.590 1.00 0.00 ATOM 15776 H2 SOL 224 50.100 24.590 65.400 1.00 0.00 ATOM 15777 OH2 SOL 225 57.230 47.180 83.960 1.00 0.00 ATOM 15778 H1 SOL 225 56.650 47.700 83.400 1.00 0.00 ATOM 15779 H2 SOL 225 56.970 46.270 83.800 1.00 0.00 ATOM 15780 OH2 SOL 226 9.010 53.560 71.530 1.00 0.00 ATOM 15781 H1 SOL 226 9.240 52.860 72.130 1.00 0.00 ATOM 15782 H2 SOL 226 9.840 53.830 71.140 1.00 0.00 ATOM 15783 OH2 SOL 227 10.200 21.540 12.540 1.00 0.00 ATOM 15784 H1 SOL 227 10.100 20.610 12.740 1.00 0.00 ATOM 15785 H2 SOL 227 9.890 21.620 11.640 1.00 0.00 ATOM 15786 OH2 SOL 228 50.500 48.410 7.150 1.00 0.00 ATOM 15787 H1 SOL 228 50.930 48.440 6.290 1.00 0.00 ATOM 15788 H2 SOL 228 51.060 47.830 7.670 1.00 0.00 ATOM 15789 OH2 SOL 229 13.240 40.130 83.940 1.00 0.00 ATOM 15790 H1 SOL 229 13.600 40.810 83.370 1.00 0.00 ATOM 15791 H2 SOL 229 13.860 40.060 84.660 1.00 0.00 ATOM 15792 OH2 SOL 230 3.420 5.040 4.340 1.00 0.00 ATOM 15793 H1 SOL 230 2.930 5.610 4.930 1.00 0.00 ATOM 15794 H2 SOL 230 2.800 4.850 3.630 1.00 0.00 ATOM 15795 OH2 SOL 231 12.940 0.290 13.100 1.00 0.00 ATOM 15796 H1 SOL 231 12.160 -0.250 13.210 1.00 0.00 ATOM 15797 H2 SOL 231 13.520 0.040 13.820 1.00 0.00 ATOM 15798 OH2 SOL 232 39.570 35.340 62.860 1.00 0.00 ATOM 15799 H1 SOL 232 40.080 36.100 63.140 1.00 0.00 ATOM 15800 H2 SOL 232 40.000 34.600 63.280 1.00 0.00 ATOM 15801 OH2 SOL 233 36.760 25.360 13.920 1.00 0.00 ATOM 15802 H1 SOL 233 36.780 25.350 14.880 1.00 0.00 ATOM 15803 H2 SOL 233 35.820 25.330 13.710 1.00 0.00 ATOM 15804 OH2 SOL 234 54.710 49.350 67.860 1.00 0.00 ATOM 15805 H1 SOL 234 54.090 50.040 67.620 1.00 0.00 ATOM 15806 H2 SOL 234 55.570 49.730 67.690 1.00 0.00 ATOM 15807 OH2 SOL 235 47.500 45.940 14.610 1.00 0.00 ATOM 15808 H1 SOL 235 48.190 46.530 14.290 1.00 0.00 ATOM 15809 H2 SOL 235 47.610 45.950 15.560 1.00 0.00 ATOM 15810 OH2 SOL 236 41.010 55.950 63.830 1.00 0.00 ATOM 15811 H1 SOL 236 41.700 56.230 64.430 1.00 0.00 ATOM 15812 H2 SOL 236 40.660 56.760 63.460 1.00 0.00 ATOM 15813 OH2 SOL 237 13.000 2.700 11.720 1.00 0.00 ATOM 15814 H1 SOL 237 12.810 1.900 12.220 1.00 0.00 ATOM 15815 H2 SOL 237 13.840 2.990 12.050 1.00 0.00 ATOM 15816 OH2 SOL 238 53.280 59.400 64.610 1.00 0.00 ATOM 15817 H1 SOL 238 53.270 60.340 64.790 1.00 0.00 ATOM 15818 H2 SOL 238 53.110 58.980 65.450 1.00 0.00 ATOM 15819 OH2 SOL 239 7.020 53.280 18.210 1.00 0.00 ATOM 15820 H1 SOL 239 7.880 53.290 18.630 1.00 0.00 ATOM 15821 H2 SOL 239 7.090 53.930 17.510 1.00 0.00 ATOM 15822 OH2 SOL 240 19.820 13.120 79.050 1.00 0.00 ATOM 15823 H1 SOL 240 19.470 13.050 78.170 1.00 0.00 ATOM 15824 H2 SOL 240 20.630 13.610 78.950 1.00 0.00 ATOM 15825 OH2 SOL 241 1.290 27.670 66.490 1.00 0.00 ATOM 15826 H1 SOL 241 1.510 28.400 67.070 1.00 0.00 ATOM 15827 H2 SOL 241 0.350 27.520 66.640 1.00 0.00 ATOM 15828 OH2 SOL 242 49.500 54.630 19.470 1.00 0.00 ATOM 15829 H1 SOL 242 50.360 54.280 19.700 1.00 0.00 ATOM 15830 H2 SOL 242 48.940 53.860 19.390 1.00 0.00 ATOM 15831 OH2 SOL 243 12.980 2.570 0.390 1.00 0.00 ATOM 15832 H1 SOL 243 13.590 3.150 0.850 1.00 0.00 ATOM 15833 H2 SOL 243 13.460 1.760 0.270 1.00 0.00 ATOM 15834 OH2 SOL 244 36.030 48.400 70.470 1.00 0.00 ATOM 15835 H1 SOL 244 36.280 47.830 71.200 1.00 0.00 ATOM 15836 H2 SOL 244 36.570 49.180 70.590 1.00 0.00 ATOM 15837 OH2 SOL 245 39.440 12.610 8.370 1.00 0.00 ATOM 15838 H1 SOL 245 40.150 13.090 8.800 1.00 0.00 ATOM 15839 H2 SOL 245 38.840 13.290 8.060 1.00 0.00 ATOM 15840 OH2 SOL 246 24.170 2.390 66.710 1.00 0.00 ATOM 15841 H1 SOL 246 24.150 1.650 67.330 1.00 0.00 ATOM 15842 H2 SOL 246 25.030 2.340 66.310 1.00 0.00 ATOM 15843 OH2 SOL 247 51.510 18.630 76.580 1.00 0.00 ATOM 15844 H1 SOL 247 51.860 18.300 75.750 1.00 0.00 ATOM 15845 H2 SOL 247 50.610 18.300 76.620 1.00 0.00 ATOM 15846 OH2 SOL 248 42.650 4.480 11.600 1.00 0.00 ATOM 15847 H1 SOL 248 42.080 3.830 11.180 1.00 0.00 ATOM 15848 H2 SOL 248 42.150 4.780 12.360 1.00 0.00 ATOM 15849 OH2 SOL 249 16.960 7.000 66.600 1.00 0.00 ATOM 15850 H1 SOL 249 17.750 6.600 66.940 1.00 0.00 ATOM 15851 H2 SOL 249 16.540 6.310 66.080 1.00 0.00 ATOM 15852 OH2 SOL 250 28.080 30.350 13.880 1.00 0.00 ATOM 15853 H1 SOL 250 28.480 29.510 13.640 1.00 0.00 ATOM 15854 H2 SOL 250 27.620 30.170 14.700 1.00 0.00 ATOM 15855 OH2 SOL 251 8.690 59.840 77.970 1.00 0.00 ATOM 15856 H1 SOL 251 7.830 59.830 78.390 1.00 0.00 ATOM 15857 H2 SOL 251 8.760 60.710 77.580 1.00 0.00 ATOM 15858 OH2 SOL 252 18.290 28.840 16.810 1.00 0.00 ATOM 15859 H1 SOL 252 18.910 28.890 16.090 1.00 0.00 ATOM 15860 H2 SOL 252 17.870 27.990 16.710 1.00 0.00 ATOM 15861 OH2 SOL 253 15.340 1.590 68.120 1.00 0.00 ATOM 15862 H1 SOL 253 15.070 2.410 68.530 1.00 0.00 ATOM 15863 H2 SOL 253 16.300 1.620 68.160 1.00 0.00 ATOM 15864 OH2 SOL 254 33.510 44.890 3.810 1.00 0.00 ATOM 15865 H1 SOL 254 33.500 45.540 4.510 1.00 0.00 ATOM 15866 H2 SOL 254 34.090 44.190 4.130 1.00 0.00 ATOM 15867 OH2 SOL 255 36.010 50.890 2.310 1.00 0.00 ATOM 15868 H1 SOL 255 35.510 51.700 2.320 1.00 0.00 ATOM 15869 H2 SOL 255 35.820 50.480 3.150 1.00 0.00 ATOM 15870 OH2 SOL 256 31.120 42.280 10.100 1.00 0.00 ATOM 15871 H1 SOL 256 30.310 42.530 10.550 1.00 0.00 ATOM 15872 H2 SOL 256 30.900 42.300 9.170 1.00 0.00 ATOM 15873 OH2 SOL 257 2.830 18.120 67.620 1.00 0.00 ATOM 15874 H1 SOL 257 2.650 17.620 66.820 1.00 0.00 ATOM 15875 H2 SOL 257 3.390 17.540 68.140 1.00 0.00 ATOM 15876 OH2 SOL 258 39.430 31.340 69.970 1.00 0.00 ATOM 15877 H1 SOL 258 39.000 31.380 69.110 1.00 0.00 ATOM 15878 H2 SOL 258 38.780 30.920 70.540 1.00 0.00 ATOM 15879 OH2 SOL 259 16.000 19.610 6.710 1.00 0.00 ATOM 15880 H1 SOL 259 16.550 19.980 7.410 1.00 0.00 ATOM 15881 H2 SOL 259 15.110 19.820 6.970 1.00 0.00 ATOM 15882 OH2 SOL 260 16.260 14.410 3.110 1.00 0.00 ATOM 15883 H1 SOL 260 15.550 14.840 3.580 1.00 0.00 ATOM 15884 H2 SOL 260 16.150 14.690 2.200 1.00 0.00 ATOM 15885 OH2 SOL 261 33.520 49.980 71.660 1.00 0.00 ATOM 15886 H1 SOL 261 32.640 49.620 71.800 1.00 0.00 ATOM 15887 H2 SOL 261 33.830 49.550 70.870 1.00 0.00 ATOM 15888 OH2 SOL 262 37.300 2.640 65.760 1.00 0.00 ATOM 15889 H1 SOL 262 37.570 2.550 66.680 1.00 0.00 ATOM 15890 H2 SOL 262 37.980 3.200 65.370 1.00 0.00 ATOM 15891 OH2 SOL 263 11.280 54.580 62.180 1.00 0.00 ATOM 15892 H1 SOL 263 12.060 54.620 62.730 1.00 0.00 ATOM 15893 H2 SOL 263 11.570 54.860 61.320 1.00 0.00 ATOM 15894 OH2 SOL 264 42.810 46.450 6.320 1.00 0.00 ATOM 15895 H1 SOL 264 42.400 47.290 6.510 1.00 0.00 ATOM 15896 H2 SOL 264 42.070 45.830 6.270 1.00 0.00 ATOM 15897 OH2 SOL 265 28.560 60.020 62.960 1.00 0.00 ATOM 15898 H1 SOL 265 27.750 59.530 62.820 1.00 0.00 ATOM 15899 H2 SOL 265 28.610 60.610 62.210 1.00 0.00 ATOM 15900 OH2 SOL 266 46.550 10.300 8.120 1.00 0.00 ATOM 15901 H1 SOL 266 45.980 10.890 7.620 1.00 0.00 ATOM 15902 H2 SOL 266 47.400 10.380 7.690 1.00 0.00 ATOM 15903 OH2 SOL 267 56.170 5.170 61.090 1.00 0.00 ATOM 15904 H1 SOL 267 57.010 5.120 60.640 1.00 0.00 ATOM 15905 H2 SOL 267 55.560 5.510 60.430 1.00 0.00 ATOM 15906 OH2 SOL 268 19.780 44.400 4.450 1.00 0.00 ATOM 15907 H1 SOL 268 20.380 44.200 5.170 1.00 0.00 ATOM 15908 H2 SOL 268 19.590 43.550 4.050 1.00 0.00 ATOM 15909 OH2 SOL 269 36.290 23.810 72.950 1.00 0.00 ATOM 15910 H1 SOL 269 35.950 24.680 72.750 1.00 0.00 ATOM 15911 H2 SOL 269 37.040 23.970 73.510 1.00 0.00 ATOM 15912 OH2 SOL 270 46.680 0.800 7.770 1.00 0.00 ATOM 15913 H1 SOL 270 47.450 1.150 7.310 1.00 0.00 ATOM 15914 H2 SOL 270 46.870 0.940 8.700 1.00 0.00 ATOM 15915 OH2 SOL 271 27.170 49.520 13.610 1.00 0.00 ATOM 15916 H1 SOL 271 27.980 49.540 13.110 1.00 0.00 ATOM 15917 H2 SOL 271 26.480 49.450 12.950 1.00 0.00 ATOM 15918 OH2 SOL 272 1.090 15.980 72.360 1.00 0.00 ATOM 15919 H1 SOL 272 0.890 15.080 72.110 1.00 0.00 ATOM 15920 H2 SOL 272 1.340 16.400 71.540 1.00 0.00 ATOM 15921 OH2 SOL 273 7.230 53.690 83.740 1.00 0.00 ATOM 15922 H1 SOL 273 7.820 54.200 83.190 1.00 0.00 ATOM 15923 H2 SOL 273 7.750 53.500 84.530 1.00 0.00 ATOM 15924 OH2 SOL 274 3.190 29.900 7.540 1.00 0.00 ATOM 15925 H1 SOL 274 2.410 29.410 7.270 1.00 0.00 ATOM 15926 H2 SOL 274 2.970 30.250 8.400 1.00 0.00 ATOM 15927 OH2 SOL 275 13.700 38.880 79.900 1.00 0.00 ATOM 15928 H1 SOL 275 13.590 37.930 79.880 1.00 0.00 ATOM 15929 H2 SOL 275 13.570 39.160 78.990 1.00 0.00 ATOM 15930 OH2 SOL 276 44.480 5.420 73.620 1.00 0.00 ATOM 15931 H1 SOL 276 43.550 5.230 73.470 1.00 0.00 ATOM 15932 H2 SOL 276 44.670 6.170 73.060 1.00 0.00 ATOM 15933 OH2 SOL 277 33.800 0.900 82.600 1.00 0.00 ATOM 15934 H1 SOL 277 34.310 0.110 82.810 1.00 0.00 ATOM 15935 H2 SOL 277 32.900 0.580 82.500 1.00 0.00 ATOM 15936 OH2 SOL 278 56.500 14.390 75.650 1.00 0.00 ATOM 15937 H1 SOL 278 56.940 15.110 76.110 1.00 0.00 ATOM 15938 H2 SOL 278 55.740 14.800 75.230 1.00 0.00 ATOM 15939 OH2 SOL 279 40.390 25.480 81.200 1.00 0.00 ATOM 15940 H1 SOL 279 40.630 24.620 80.840 1.00 0.00 ATOM 15941 H2 SOL 279 39.820 25.280 81.950 1.00 0.00 ATOM 15942 OH2 SOL 280 31.630 41.570 16.980 1.00 0.00 ATOM 15943 H1 SOL 280 30.700 41.480 16.770 1.00 0.00 ATOM 15944 H2 SOL 280 32.070 40.990 16.360 1.00 0.00 ATOM 15945 OH2 SOL 281 23.080 19.800 76.780 1.00 0.00 ATOM 15946 H1 SOL 281 22.400 20.470 76.830 1.00 0.00 ATOM 15947 H2 SOL 281 23.540 19.860 77.610 1.00 0.00 ATOM 15948 OH2 SOL 282 10.780 16.480 27.480 1.00 0.00 ATOM 15949 H1 SOL 282 10.180 16.980 28.040 1.00 0.00 ATOM 15950 H2 SOL 282 10.330 15.650 27.330 1.00 0.00 ATOM 15951 OH2 SOL 283 0.420 44.490 11.200 1.00 0.00 ATOM 15952 H1 SOL 283 0.770 45.120 11.830 1.00 0.00 ATOM 15953 H2 SOL 283 0.270 43.690 11.720 1.00 0.00 ATOM 15954 OH2 SOL 284 54.940 34.270 73.450 1.00 0.00 ATOM 15955 H1 SOL 284 55.120 33.680 72.720 1.00 0.00 ATOM 15956 H2 SOL 284 55.470 35.040 73.270 1.00 0.00 ATOM 15957 OH2 SOL 285 10.770 47.260 11.930 1.00 0.00 ATOM 15958 H1 SOL 285 11.160 46.530 12.420 1.00 0.00 ATOM 15959 H2 SOL 285 10.840 48.000 12.530 1.00 0.00 ATOM 15960 OH2 SOL 286 19.060 4.050 6.770 1.00 0.00 ATOM 15961 H1 SOL 286 19.290 3.230 7.200 1.00 0.00 ATOM 15962 H2 SOL 286 19.760 4.200 6.140 1.00 0.00 ATOM 15963 OH2 SOL 287 16.520 16.190 6.220 1.00 0.00 ATOM 15964 H1 SOL 287 16.630 16.770 5.460 1.00 0.00 ATOM 15965 H2 SOL 287 17.390 15.800 6.350 1.00 0.00 ATOM 15966 OH2 SOL 288 2.520 39.060 1.650 1.00 0.00 ATOM 15967 H1 SOL 288 3.210 39.680 1.410 1.00 0.00 ATOM 15968 H2 SOL 288 1.910 39.580 2.180 1.00 0.00 ATOM 15969 OH2 SOL 289 18.350 9.670 67.530 1.00 0.00 ATOM 15970 H1 SOL 289 19.110 9.860 68.090 1.00 0.00 ATOM 15971 H2 SOL 289 18.510 10.190 66.740 1.00 0.00 ATOM 15972 OH2 SOL 290 35.640 7.490 75.460 1.00 0.00 ATOM 15973 H1 SOL 290 35.850 7.360 76.390 1.00 0.00 ATOM 15974 H2 SOL 290 35.520 8.430 75.370 1.00 0.00 ATOM 15975 OH2 SOL 291 32.180 12.080 59.240 1.00 0.00 ATOM 15976 H1 SOL 291 32.240 12.460 58.360 1.00 0.00 ATOM 15977 H2 SOL 291 31.770 12.760 59.770 1.00 0.00 ATOM 15978 OH2 SOL 292 43.020 55.950 3.470 1.00 0.00 ATOM 15979 H1 SOL 292 43.410 55.170 3.070 1.00 0.00 ATOM 15980 H2 SOL 292 43.480 56.680 3.060 1.00 0.00 ATOM 15981 OH2 SOL 293 39.400 48.280 72.340 1.00 0.00 ATOM 15982 H1 SOL 293 40.120 48.640 72.870 1.00 0.00 ATOM 15983 H2 SOL 293 39.030 49.040 71.890 1.00 0.00 ATOM 15984 OH2 SOL 294 57.430 55.910 9.090 1.00 0.00 ATOM 15985 H1 SOL 294 57.190 55.480 9.910 1.00 0.00 ATOM 15986 H2 SOL 294 56.670 55.800 8.530 1.00 0.00 ATOM 15987 OH2 SOL 295 19.010 1.000 81.440 1.00 0.00 ATOM 15988 H1 SOL 295 18.470 1.290 82.170 1.00 0.00 ATOM 15989 H2 SOL 295 18.630 1.440 80.680 1.00 0.00 ATOM 15990 OH2 SOL 296 41.610 58.120 9.990 1.00 0.00 ATOM 15991 H1 SOL 296 41.770 59.050 9.810 1.00 0.00 ATOM 15992 H2 SOL 296 41.810 57.680 9.160 1.00 0.00 ATOM 15993 OH2 SOL 297 17.310 46.070 75.760 1.00 0.00 ATOM 15994 H1 SOL 297 17.490 46.260 74.840 1.00 0.00 ATOM 15995 H2 SOL 297 17.990 45.450 76.010 1.00 0.00 ATOM 15996 OH2 SOL 298 36.590 25.540 22.970 1.00 0.00 ATOM 15997 H1 SOL 298 36.280 25.950 22.150 1.00 0.00 ATOM 15998 H2 SOL 298 36.590 26.260 23.600 1.00 0.00 ATOM 15999 OH2 SOL 299 13.620 9.300 82.350 1.00 0.00 ATOM 16000 H1 SOL 299 13.510 8.570 82.970 1.00 0.00 ATOM 16001 H2 SOL 299 12.980 9.130 81.660 1.00 0.00 ATOM 16002 OH2 SOL 300 52.540 0.870 67.970 1.00 0.00 ATOM 16003 H1 SOL 300 53.450 0.850 67.680 1.00 0.00 ATOM 16004 H2 SOL 300 52.570 0.550 68.870 1.00 0.00 ATOM 16005 OH2 SOL 301 23.480 17.360 13.360 1.00 0.00 ATOM 16006 H1 SOL 301 23.590 18.230 13.740 1.00 0.00 ATOM 16007 H2 SOL 301 23.950 17.410 12.530 1.00 0.00 ATOM 16008 OH2 SOL 302 33.280 57.030 63.550 1.00 0.00 ATOM 16009 H1 SOL 302 33.420 56.140 63.890 1.00 0.00 ATOM 16010 H2 SOL 302 32.340 57.070 63.370 1.00 0.00 ATOM 16011 OH2 SOL 303 26.880 15.230 4.530 1.00 0.00 ATOM 16012 H1 SOL 303 27.380 14.740 3.880 1.00 0.00 ATOM 16013 H2 SOL 303 27.530 15.490 5.180 1.00 0.00 ATOM 16014 OH2 SOL 304 3.800 33.710 22.740 1.00 0.00 ATOM 16015 H1 SOL 304 4.610 34.210 22.820 1.00 0.00 ATOM 16016 H2 SOL 304 3.120 34.330 23.000 1.00 0.00 ATOM 16017 OH2 SOL 305 10.810 17.730 69.600 1.00 0.00 ATOM 16018 H1 SOL 305 11.060 17.960 68.700 1.00 0.00 ATOM 16019 H2 SOL 305 11.570 17.970 70.130 1.00 0.00 ATOM 16020 OH2 SOL 306 54.740 32.000 61.710 1.00 0.00 ATOM 16021 H1 SOL 306 54.930 32.810 62.190 1.00 0.00 ATOM 16022 H2 SOL 306 53.780 31.970 61.670 1.00 0.00 ATOM 16023 OH2 SOL 307 40.770 24.190 76.260 1.00 0.00 ATOM 16024 H1 SOL 307 40.530 23.280 76.430 1.00 0.00 ATOM 16025 H2 SOL 307 40.090 24.510 75.670 1.00 0.00 ATOM 16026 OH2 SOL 308 26.090 27.060 15.220 1.00 0.00 ATOM 16027 H1 SOL 308 25.540 27.310 15.970 1.00 0.00 ATOM 16028 H2 SOL 308 26.210 27.870 14.730 1.00 0.00 ATOM 16029 OH2 SOL 309 58.100 31.990 78.870 1.00 0.00 ATOM 16030 H1 SOL 309 58.450 32.120 77.990 1.00 0.00 ATOM 16031 H2 SOL 309 57.990 31.040 78.950 1.00 0.00 ATOM 16032 OH2 SOL 310 54.810 2.960 7.070 1.00 0.00 ATOM 16033 H1 SOL 310 54.780 2.610 7.960 1.00 0.00 ATOM 16034 H2 SOL 310 54.010 2.640 6.650 1.00 0.00 ATOM 16035 OH2 SOL 311 33.890 54.910 4.590 1.00 0.00 ATOM 16036 H1 SOL 311 33.290 55.620 4.850 1.00 0.00 ATOM 16037 H2 SOL 311 34.630 55.000 5.190 1.00 0.00 ATOM 16038 OH2 SOL 312 7.080 52.030 6.480 1.00 0.00 ATOM 16039 H1 SOL 312 7.480 52.640 5.860 1.00 0.00 ATOM 16040 H2 SOL 312 6.520 51.480 5.930 1.00 0.00 ATOM 16041 OH2 SOL 313 46.910 53.700 75.420 1.00 0.00 ATOM 16042 H1 SOL 313 46.080 53.540 74.960 1.00 0.00 ATOM 16043 H2 SOL 313 46.750 54.480 75.940 1.00 0.00 ATOM 16044 OH2 SOL 314 12.660 31.370 19.510 1.00 0.00 ATOM 16045 H1 SOL 314 12.800 30.490 19.860 1.00 0.00 ATOM 16046 H2 SOL 314 13.220 31.940 20.040 1.00 0.00 ATOM 16047 OH2 SOL 315 20.740 34.250 70.480 1.00 0.00 ATOM 16048 H1 SOL 315 20.690 35.040 71.020 1.00 0.00 ATOM 16049 H2 SOL 315 21.390 34.450 69.810 1.00 0.00 ATOM 16050 OH2 SOL 316 7.620 53.570 4.420 1.00 0.00 ATOM 16051 H1 SOL 316 6.840 53.910 3.970 1.00 0.00 ATOM 16052 H2 SOL 316 8.310 54.200 4.230 1.00 0.00 ATOM 16053 OH2 SOL 317 41.500 1.070 12.100 1.00 0.00 ATOM 16054 H1 SOL 317 41.630 0.850 13.020 1.00 0.00 ATOM 16055 H2 SOL 317 42.150 0.540 11.630 1.00 0.00 ATOM 16056 OH2 SOL 318 19.370 48.550 4.040 1.00 0.00 ATOM 16057 H1 SOL 318 19.380 49.440 3.680 1.00 0.00 ATOM 16058 H2 SOL 318 20.280 48.270 4.030 1.00 0.00 ATOM 16059 OH2 SOL 319 34.610 2.720 13.820 1.00 0.00 ATOM 16060 H1 SOL 319 34.600 3.670 13.940 1.00 0.00 ATOM 16061 H2 SOL 319 34.700 2.370 14.710 1.00 0.00 ATOM 16062 OH2 SOL 320 24.270 34.010 19.030 1.00 0.00 ATOM 16063 H1 SOL 320 23.500 34.420 19.430 1.00 0.00 ATOM 16064 H2 SOL 320 24.580 33.390 19.690 1.00 0.00 ATOM 16065 OH2 SOL 321 48.710 40.860 64.910 1.00 0.00 ATOM 16066 H1 SOL 321 47.980 41.400 64.590 1.00 0.00 ATOM 16067 H2 SOL 321 48.490 40.680 65.820 1.00 0.00 ATOM 16068 OH2 SOL 322 37.760 27.600 8.430 1.00 0.00 ATOM 16069 H1 SOL 322 36.860 27.680 8.770 1.00 0.00 ATOM 16070 H2 SOL 322 37.660 27.670 7.480 1.00 0.00 ATOM 16071 OH2 SOL 323 40.920 34.700 72.790 1.00 0.00 ATOM 16072 H1 SOL 323 40.340 34.420 72.080 1.00 0.00 ATOM 16073 H2 SOL 323 41.360 35.480 72.450 1.00 0.00 ATOM 16074 OH2 SOL 324 22.700 0.280 23.640 1.00 0.00 ATOM 16075 H1 SOL 324 23.590 0.470 23.940 1.00 0.00 ATOM 16076 H2 SOL 324 22.370 -0.360 24.270 1.00 0.00 ATOM 16077 OH2 SOL 325 35.980 14.440 75.200 1.00 0.00 ATOM 16078 H1 SOL 325 35.760 14.860 76.030 1.00 0.00 ATOM 16079 H2 SOL 325 35.130 14.310 74.770 1.00 0.00 ATOM 16080 OH2 SOL 326 4.430 21.600 83.710 1.00 0.00 ATOM 16081 H1 SOL 326 4.540 20.670 83.550 1.00 0.00 ATOM 16082 H2 SOL 326 5.080 21.820 84.380 1.00 0.00 ATOM 16083 OH2 SOL 327 6.600 59.240 4.060 1.00 0.00 ATOM 16084 H1 SOL 327 6.220 59.620 3.270 1.00 0.00 ATOM 16085 H2 SOL 327 6.000 58.530 4.290 1.00 0.00 ATOM 16086 OH2 SOL 328 14.780 13.370 17.580 1.00 0.00 ATOM 16087 H1 SOL 328 15.430 13.150 18.250 1.00 0.00 ATOM 16088 H2 SOL 328 13.970 12.960 17.890 1.00 0.00 ATOM 16089 OH2 SOL 329 34.310 15.230 72.490 1.00 0.00 ATOM 16090 H1 SOL 329 34.830 16.030 72.480 1.00 0.00 ATOM 16091 H2 SOL 329 33.550 15.440 73.030 1.00 0.00 ATOM 16092 OH2 SOL 330 46.290 21.380 75.210 1.00 0.00 ATOM 16093 H1 SOL 330 46.420 21.140 74.290 1.00 0.00 ATOM 16094 H2 SOL 330 45.540 21.980 75.190 1.00 0.00 ATOM 16095 OH2 SOL 331 22.770 29.680 73.000 1.00 0.00 ATOM 16096 H1 SOL 331 22.250 30.170 72.360 1.00 0.00 ATOM 16097 H2 SOL 331 22.190 28.970 73.280 1.00 0.00 ATOM 16098 OH2 SOL 332 20.160 42.910 9.620 1.00 0.00 ATOM 16099 H1 SOL 332 19.690 42.170 10.010 1.00 0.00 ATOM 16100 H2 SOL 332 21.090 42.710 9.760 1.00 0.00 ATOM 16101 OH2 SOL 333 16.390 6.180 0.510 1.00 0.00 ATOM 16102 H1 SOL 333 16.180 5.450 -0.080 1.00 0.00 ATOM 16103 H2 SOL 333 16.830 6.820 -0.040 1.00 0.00 ATOM 16104 OH2 SOL 334 19.730 37.310 70.740 1.00 0.00 ATOM 16105 H1 SOL 334 20.590 37.140 71.150 1.00 0.00 ATOM 16106 H2 SOL 334 19.140 37.420 71.480 1.00 0.00 ATOM 16107 OH2 SOL 335 51.340 37.780 4.310 1.00 0.00 ATOM 16108 H1 SOL 335 50.400 37.640 4.210 1.00 0.00 ATOM 16109 H2 SOL 335 51.740 37.160 3.700 1.00 0.00 ATOM 16110 OH2 SOL 336 0.110 22.960 9.590 1.00 0.00 ATOM 16111 H1 SOL 336 1.040 22.870 9.780 1.00 0.00 ATOM 16112 H2 SOL 336 -0.250 23.410 10.360 1.00 0.00 ATOM 16113 OH2 SOL 337 6.060 35.040 76.280 1.00 0.00 ATOM 16114 H1 SOL 337 5.910 34.990 77.220 1.00 0.00 ATOM 16115 H2 SOL 337 5.270 34.680 75.880 1.00 0.00 ATOM 16116 OH2 SOL 338 23.950 55.010 70.430 1.00 0.00 ATOM 16117 H1 SOL 338 24.650 55.580 70.750 1.00 0.00 ATOM 16118 H2 SOL 338 23.170 55.580 70.440 1.00 0.00 ATOM 16119 OH2 SOL 339 31.600 59.130 75.590 1.00 0.00 ATOM 16120 H1 SOL 339 31.090 59.550 74.900 1.00 0.00 ATOM 16121 H2 SOL 339 31.340 58.210 75.540 1.00 0.00 ATOM 16122 OH2 SOL 340 30.360 53.040 19.700 1.00 0.00 ATOM 16123 H1 SOL 340 29.660 53.620 19.420 1.00 0.00 ATOM 16124 H2 SOL 340 30.000 52.570 20.450 1.00 0.00 ATOM 16125 OH2 SOL 341 6.290 48.420 23.560 1.00 0.00 ATOM 16126 H1 SOL 341 5.510 48.490 23.010 1.00 0.00 ATOM 16127 H2 SOL 341 6.960 48.050 22.990 1.00 0.00 ATOM 16128 OH2 SOL 342 22.390 52.210 79.000 1.00 0.00 ATOM 16129 H1 SOL 342 21.650 52.670 79.400 1.00 0.00 ATOM 16130 H2 SOL 342 21.980 51.490 78.520 1.00 0.00 ATOM 16131 OH2 SOL 343 19.350 14.240 67.420 1.00 0.00 ATOM 16132 H1 SOL 343 19.630 14.730 66.650 1.00 0.00 ATOM 16133 H2 SOL 343 18.460 13.950 67.210 1.00 0.00 ATOM 16134 OH2 SOL 344 2.740 31.910 77.780 1.00 0.00 ATOM 16135 H1 SOL 344 1.920 31.420 77.660 1.00 0.00 ATOM 16136 H2 SOL 344 2.820 32.440 76.990 1.00 0.00 ATOM 16137 OH2 SOL 345 18.430 33.230 10.880 1.00 0.00 ATOM 16138 H1 SOL 345 19.380 33.320 10.920 1.00 0.00 ATOM 16139 H2 SOL 345 18.150 33.840 10.190 1.00 0.00 ATOM 16140 OH2 SOL 346 48.770 14.480 71.420 1.00 0.00 ATOM 16141 H1 SOL 346 48.060 14.480 70.780 1.00 0.00 ATOM 16142 H2 SOL 346 48.850 13.560 71.690 1.00 0.00 ATOM 16143 OH2 SOL 347 21.090 0.010 17.910 1.00 0.00 ATOM 16144 H1 SOL 347 20.910 0.940 17.800 1.00 0.00 ATOM 16145 H2 SOL 347 20.460 -0.420 17.340 1.00 0.00 ATOM 16146 OH2 SOL 348 26.130 36.500 82.580 1.00 0.00 ATOM 16147 H1 SOL 348 25.860 35.590 82.640 1.00 0.00 ATOM 16148 H2 SOL 348 26.460 36.710 83.460 1.00 0.00 ATOM 16149 OH2 SOL 349 58.880 10.810 70.850 1.00 0.00 ATOM 16150 H1 SOL 349 59.090 10.480 71.720 1.00 0.00 ATOM 16151 H2 SOL 349 59.710 10.780 70.370 1.00 0.00 ATOM 16152 OH2 SOL 350 4.120 50.350 79.730 1.00 0.00 ATOM 16153 H1 SOL 350 4.340 51.100 79.180 1.00 0.00 ATOM 16154 H2 SOL 350 3.510 49.830 79.210 1.00 0.00 ATOM 16155 OH2 SOL 351 53.390 52.150 6.380 1.00 0.00 ATOM 16156 H1 SOL 351 53.580 52.860 5.760 1.00 0.00 ATOM 16157 H2 SOL 351 54.240 51.930 6.760 1.00 0.00 ATOM 16158 OH2 SOL 352 49.070 51.750 11.330 1.00 0.00 ATOM 16159 H1 SOL 352 49.680 52.410 11.660 1.00 0.00 ATOM 16160 H2 SOL 352 49.340 50.940 11.760 1.00 0.00 ATOM 16161 OH2 SOL 353 11.880 59.200 7.590 1.00 0.00 ATOM 16162 H1 SOL 353 12.810 59.280 7.380 1.00 0.00 ATOM 16163 H2 SOL 353 11.760 59.760 8.350 1.00 0.00 ATOM 16164 OH2 SOL 354 5.420 10.630 22.790 1.00 0.00 ATOM 16165 H1 SOL 354 6.120 10.890 23.390 1.00 0.00 ATOM 16166 H2 SOL 354 4.930 9.970 23.280 1.00 0.00 ATOM 16167 OH2 SOL 355 9.580 57.660 9.880 1.00 0.00 ATOM 16168 H1 SOL 355 10.270 57.610 9.230 1.00 0.00 ATOM 16169 H2 SOL 355 8.830 58.030 9.410 1.00 0.00 ATOM 16170 OH2 SOL 356 58.040 26.460 71.730 1.00 0.00 ATOM 16171 H1 SOL 356 58.240 26.410 70.790 1.00 0.00 ATOM 16172 H2 SOL 356 58.900 26.500 72.150 1.00 0.00 ATOM 16173 OH2 SOL 357 39.010 31.830 19.890 1.00 0.00 ATOM 16174 H1 SOL 357 38.670 32.510 20.470 1.00 0.00 ATOM 16175 H2 SOL 357 39.180 31.080 20.460 1.00 0.00 ATOM 16176 OH2 SOL 358 28.870 60.950 65.500 1.00 0.00 ATOM 16177 H1 SOL 358 28.550 60.580 64.680 1.00 0.00 ATOM 16178 H2 SOL 358 28.160 60.800 66.120 1.00 0.00 ATOM 16179 OH2 SOL 359 28.900 52.880 15.030 1.00 0.00 ATOM 16180 H1 SOL 359 28.050 53.310 15.080 1.00 0.00 ATOM 16181 H2 SOL 359 29.520 53.570 14.800 1.00 0.00 ATOM 16182 OH2 SOL 360 53.280 13.050 78.370 1.00 0.00 ATOM 16183 H1 SOL 360 54.110 13.540 78.370 1.00 0.00 ATOM 16184 H2 SOL 360 53.540 12.140 78.500 1.00 0.00 ATOM 16185 OH2 SOL 361 14.340 16.870 26.240 1.00 0.00 ATOM 16186 H1 SOL 361 14.340 17.590 25.610 1.00 0.00 ATOM 16187 H2 SOL 361 15.250 16.810 26.540 1.00 0.00 ATOM 16188 OH2 SOL 362 42.430 36.270 21.100 1.00 0.00 ATOM 16189 H1 SOL 362 43.310 35.960 21.310 1.00 0.00 ATOM 16190 H2 SOL 362 41.850 35.570 21.400 1.00 0.00 ATOM 16191 OH2 SOL 363 50.430 23.820 27.470 1.00 0.00 ATOM 16192 H1 SOL 363 50.700 24.520 28.060 1.00 0.00 ATOM 16193 H2 SOL 363 49.470 23.850 27.490 1.00 0.00 ATOM 16194 OH2 SOL 364 10.280 23.030 1.030 1.00 0.00 ATOM 16195 H1 SOL 364 10.020 23.430 1.860 1.00 0.00 ATOM 16196 H2 SOL 364 10.070 23.690 0.370 1.00 0.00 ATOM 16197 OH2 SOL 365 12.860 11.880 6.150 1.00 0.00 ATOM 16198 H1 SOL 365 12.260 11.640 6.850 1.00 0.00 ATOM 16199 H2 SOL 365 13.420 11.100 6.040 1.00 0.00 ATOM 16200 OH2 SOL 366 10.950 35.500 16.580 1.00 0.00 ATOM 16201 H1 SOL 366 10.260 34.850 16.700 1.00 0.00 ATOM 16202 H2 SOL 366 11.630 35.030 16.090 1.00 0.00 ATOM 16203 OH2 SOL 367 45.760 14.320 83.290 1.00 0.00 ATOM 16204 H1 SOL 367 46.270 14.830 82.660 1.00 0.00 ATOM 16205 H2 SOL 367 44.910 14.780 83.330 1.00 0.00 ATOM 16206 OH2 SOL 368 51.060 55.700 63.890 1.00 0.00 ATOM 16207 H1 SOL 368 50.280 55.140 63.850 1.00 0.00 ATOM 16208 H2 SOL 368 51.490 55.450 64.700 1.00 0.00 ATOM 16209 OH2 SOL 369 8.300 37.780 64.540 1.00 0.00 ATOM 16210 H1 SOL 369 8.780 37.940 65.360 1.00 0.00 ATOM 16211 H2 SOL 369 7.970 38.640 64.290 1.00 0.00 ATOM 16212 OH2 SOL 370 24.020 17.360 83.780 1.00 0.00 ATOM 16213 H1 SOL 370 24.440 18.200 83.590 1.00 0.00 ATOM 16214 H2 SOL 370 24.740 16.720 83.790 1.00 0.00 ATOM 16215 OH2 SOL 371 10.140 20.300 2.590 1.00 0.00 ATOM 16216 H1 SOL 371 10.210 21.210 2.290 1.00 0.00 ATOM 16217 H2 SOL 371 9.700 19.850 1.870 1.00 0.00 ATOM 16218 OH2 SOL 372 18.780 57.950 7.390 1.00 0.00 ATOM 16219 H1 SOL 372 18.140 58.380 7.970 1.00 0.00 ATOM 16220 H2 SOL 372 18.340 57.160 7.080 1.00 0.00 ATOM 16221 OH2 SOL 373 20.180 16.490 6.080 1.00 0.00 ATOM 16222 H1 SOL 373 20.040 17.430 6.140 1.00 0.00 ATOM 16223 H2 SOL 373 20.460 16.340 5.180 1.00 0.00 ATOM 16224 OH2 SOL 374 18.410 52.160 20.550 1.00 0.00 ATOM 16225 H1 SOL 374 19.340 51.960 20.670 1.00 0.00 ATOM 16226 H2 SOL 374 18.360 53.110 20.570 1.00 0.00 ATOM 16227 OH2 SOL 375 30.850 1.140 74.140 1.00 0.00 ATOM 16228 H1 SOL 375 31.280 2.000 74.170 1.00 0.00 ATOM 16229 H2 SOL 375 30.810 0.920 73.210 1.00 0.00 ATOM 16230 OH2 SOL 376 29.210 28.010 7.850 1.00 0.00 ATOM 16231 H1 SOL 376 29.190 28.160 6.900 1.00 0.00 ATOM 16232 H2 SOL 376 29.220 27.050 7.940 1.00 0.00 ATOM 16233 OH2 SOL 377 38.510 24.030 12.220 1.00 0.00 ATOM 16234 H1 SOL 377 37.760 23.770 11.690 1.00 0.00 ATOM 16235 H2 SOL 377 38.130 24.350 13.040 1.00 0.00 ATOM 16236 OH2 SOL 378 50.120 51.650 8.720 1.00 0.00 ATOM 16237 H1 SOL 378 50.680 50.890 8.900 1.00 0.00 ATOM 16238 H2 SOL 378 49.620 51.780 9.530 1.00 0.00 ATOM 16239 OH2 SOL 379 41.160 43.870 13.740 1.00 0.00 ATOM 16240 H1 SOL 379 41.870 43.720 13.110 1.00 0.00 ATOM 16241 H2 SOL 379 41.310 43.240 14.430 1.00 0.00 ATOM 16242 OH2 SOL 380 35.940 56.190 65.230 1.00 0.00 ATOM 16243 H1 SOL 380 35.420 55.550 64.750 1.00 0.00 ATOM 16244 H2 SOL 380 36.840 56.010 64.960 1.00 0.00 ATOM 16245 OH2 SOL 381 24.510 15.160 21.680 1.00 0.00 ATOM 16246 H1 SOL 381 24.430 15.150 20.730 1.00 0.00 ATOM 16247 H2 SOL 381 25.370 15.540 21.850 1.00 0.00 ATOM 16248 OH2 SOL 382 26.620 25.280 71.600 1.00 0.00 ATOM 16249 H1 SOL 382 26.810 25.790 70.820 1.00 0.00 ATOM 16250 H2 SOL 382 25.870 25.720 72.000 1.00 0.00 ATOM 16251 OH2 SOL 383 10.500 49.780 81.210 1.00 0.00 ATOM 16252 H1 SOL 383 9.770 50.290 81.560 1.00 0.00 ATOM 16253 H2 SOL 383 10.630 50.120 80.330 1.00 0.00 ATOM 16254 OH2 SOL 384 48.520 16.260 8.160 1.00 0.00 ATOM 16255 H1 SOL 384 49.360 16.020 7.790 1.00 0.00 ATOM 16256 H2 SOL 384 48.060 16.700 7.440 1.00 0.00 ATOM 16257 OH2 SOL 385 18.770 38.820 1.170 1.00 0.00 ATOM 16258 H1 SOL 385 18.600 37.890 1.030 1.00 0.00 ATOM 16259 H2 SOL 385 18.330 39.260 0.440 1.00 0.00 ATOM 16260 OH2 SOL 386 42.080 39.130 15.320 1.00 0.00 ATOM 16261 H1 SOL 386 42.710 38.720 14.720 1.00 0.00 ATOM 16262 H2 SOL 386 42.470 39.980 15.540 1.00 0.00 ATOM 16263 OH2 SOL 387 47.300 48.640 72.950 1.00 0.00 ATOM 16264 H1 SOL 387 47.990 49.090 72.460 1.00 0.00 ATOM 16265 H2 SOL 387 47.650 47.770 73.120 1.00 0.00 ATOM 16266 OH2 SOL 388 5.870 23.550 17.290 1.00 0.00 ATOM 16267 H1 SOL 388 6.060 24.480 17.400 1.00 0.00 ATOM 16268 H2 SOL 388 6.530 23.240 16.670 1.00 0.00 ATOM 16269 OH2 SOL 389 7.430 53.880 76.280 1.00 0.00 ATOM 16270 H1 SOL 389 8.370 54.020 76.160 1.00 0.00 ATOM 16271 H2 SOL 389 7.010 54.510 75.690 1.00 0.00 ATOM 16272 OH2 SOL 390 35.380 22.010 65.080 1.00 0.00 ATOM 16273 H1 SOL 390 35.110 21.330 64.460 1.00 0.00 ATOM 16274 H2 SOL 390 35.990 22.560 64.590 1.00 0.00 ATOM 16275 OH2 SOL 391 13.030 42.580 73.500 1.00 0.00 ATOM 16276 H1 SOL 391 13.470 41.840 73.920 1.00 0.00 ATOM 16277 H2 SOL 391 12.480 42.950 74.190 1.00 0.00 ATOM 16278 OH2 SOL 392 35.050 10.170 74.680 1.00 0.00 ATOM 16279 H1 SOL 392 34.180 10.460 74.410 1.00 0.00 ATOM 16280 H2 SOL 392 35.390 9.690 73.920 1.00 0.00 ATOM 16281 OH2 SOL 393 7.940 44.210 71.440 1.00 0.00 ATOM 16282 H1 SOL 393 7.050 44.530 71.640 1.00 0.00 ATOM 16283 H2 SOL 393 8.510 44.720 72.020 1.00 0.00 ATOM 16284 OH2 SOL 394 40.760 27.010 5.780 1.00 0.00 ATOM 16285 H1 SOL 394 41.690 26.830 5.620 1.00 0.00 ATOM 16286 H2 SOL 394 40.640 26.880 6.720 1.00 0.00 ATOM 16287 OH2 SOL 395 41.080 4.150 67.550 1.00 0.00 ATOM 16288 H1 SOL 395 41.530 3.820 68.330 1.00 0.00 ATOM 16289 H2 SOL 395 41.000 3.380 66.980 1.00 0.00 ATOM 16290 OH2 SOL 396 50.480 47.440 82.090 1.00 0.00 ATOM 16291 H1 SOL 396 50.790 46.580 81.830 1.00 0.00 ATOM 16292 H2 SOL 396 49.600 47.290 82.440 1.00 0.00 ATOM 16293 OH2 SOL 397 52.130 0.630 15.340 1.00 0.00 ATOM 16294 H1 SOL 397 51.450 1.220 15.690 1.00 0.00 ATOM 16295 H2 SOL 397 51.640 -0.140 15.050 1.00 0.00 ATOM 16296 OH2 SOL 398 25.070 46.600 1.100 1.00 0.00 ATOM 16297 H1 SOL 398 25.240 47.480 1.440 1.00 0.00 ATOM 16298 H2 SOL 398 25.720 46.490 0.400 1.00 0.00 ATOM 16299 OH2 SOL 399 27.610 57.590 3.170 1.00 0.00 ATOM 16300 H1 SOL 399 27.110 57.960 3.900 1.00 0.00 ATOM 16301 H2 SOL 399 28.530 57.670 3.440 1.00 0.00 ATOM 16302 OH2 SOL 400 33.960 53.820 77.580 1.00 0.00 ATOM 16303 H1 SOL 400 34.410 54.040 78.390 1.00 0.00 ATOM 16304 H2 SOL 400 33.270 53.210 77.850 1.00 0.00 ATOM 16305 OH2 SOL 401 30.320 60.340 19.030 1.00 0.00 ATOM 16306 H1 SOL 401 31.080 60.530 19.580 1.00 0.00 ATOM 16307 H2 SOL 401 29.870 61.180 18.930 1.00 0.00 ATOM 16308 OH2 SOL 402 7.680 35.300 27.850 1.00 0.00 ATOM 16309 H1 SOL 402 7.070 35.870 27.370 1.00 0.00 ATOM 16310 H2 SOL 402 7.710 34.500 27.340 1.00 0.00 ATOM 16311 OH2 SOL 403 41.040 46.330 18.040 1.00 0.00 ATOM 16312 H1 SOL 403 40.600 46.860 17.370 1.00 0.00 ATOM 16313 H2 SOL 403 41.490 46.970 18.590 1.00 0.00 ATOM 16314 OH2 SOL 404 55.030 18.400 76.280 1.00 0.00 ATOM 16315 H1 SOL 404 55.840 18.010 76.620 1.00 0.00 ATOM 16316 H2 SOL 404 54.660 17.730 75.710 1.00 0.00 ATOM 16317 OH2 SOL 405 17.900 27.680 81.930 1.00 0.00 ATOM 16318 H1 SOL 405 17.170 27.160 81.590 1.00 0.00 ATOM 16319 H2 SOL 405 17.520 28.170 82.660 1.00 0.00 ATOM 16320 OH2 SOL 406 29.190 5.850 10.810 1.00 0.00 ATOM 16321 H1 SOL 406 28.680 6.150 11.560 1.00 0.00 ATOM 16322 H2 SOL 406 28.650 5.170 10.400 1.00 0.00 ATOM 16323 OH2 SOL 407 44.150 37.300 18.570 1.00 0.00 ATOM 16324 H1 SOL 407 44.260 37.140 19.510 1.00 0.00 ATOM 16325 H2 SOL 407 43.260 37.620 18.480 1.00 0.00 ATOM 16326 OH2 SOL 408 4.450 53.280 19.120 1.00 0.00 ATOM 16327 H1 SOL 408 5.380 53.180 18.950 1.00 0.00 ATOM 16328 H2 SOL 408 4.210 54.110 18.710 1.00 0.00 ATOM 16329 OH2 SOL 409 9.860 30.360 20.690 1.00 0.00 ATOM 16330 H1 SOL 409 9.930 29.510 21.120 1.00 0.00 ATOM 16331 H2 SOL 409 8.940 30.590 20.740 1.00 0.00 ATOM 16332 OH2 SOL 410 31.750 26.630 5.770 1.00 0.00 ATOM 16333 H1 SOL 410 32.450 25.990 5.620 1.00 0.00 ATOM 16334 H2 SOL 410 32.210 27.470 5.810 1.00 0.00 ATOM 16335 OH2 SOL 411 32.310 18.550 62.010 1.00 0.00 ATOM 16336 H1 SOL 411 32.040 18.050 61.240 1.00 0.00 ATOM 16337 H2 SOL 411 32.130 17.970 62.750 1.00 0.00 ATOM 16338 OH2 SOL 412 58.900 35.910 16.000 1.00 0.00 ATOM 16339 H1 SOL 412 59.500 35.360 16.500 1.00 0.00 ATOM 16340 H2 SOL 412 58.750 35.430 15.190 1.00 0.00 ATOM 16341 OH2 SOL 413 28.870 56.630 60.790 1.00 0.00 ATOM 16342 H1 SOL 413 28.120 56.640 61.380 1.00 0.00 ATOM 16343 H2 SOL 413 28.970 55.710 60.540 1.00 0.00 ATOM 16344 OH2 SOL 414 40.380 55.840 74.640 1.00 0.00 ATOM 16345 H1 SOL 414 40.310 55.350 75.460 1.00 0.00 ATOM 16346 H2 SOL 414 39.480 56.040 74.400 1.00 0.00 ATOM 16347 OH2 SOL 415 46.440 9.020 22.150 1.00 0.00 ATOM 16348 H1 SOL 415 46.120 9.910 22.260 1.00 0.00 ATOM 16349 H2 SOL 415 47.180 8.950 22.760 1.00 0.00 ATOM 16350 OH2 SOL 416 32.560 45.030 11.000 1.00 0.00 ATOM 16351 H1 SOL 416 32.410 45.920 10.700 1.00 0.00 ATOM 16352 H2 SOL 416 32.600 44.500 10.200 1.00 0.00 ATOM 16353 OH2 SOL 417 16.310 17.870 14.800 1.00 0.00 ATOM 16354 H1 SOL 417 16.590 17.220 14.160 1.00 0.00 ATOM 16355 H2 SOL 417 15.360 17.800 14.820 1.00 0.00 ATOM 16356 OH2 SOL 418 27.280 2.660 16.520 1.00 0.00 ATOM 16357 H1 SOL 418 26.430 2.530 16.940 1.00 0.00 ATOM 16358 H2 SOL 418 27.350 1.930 15.910 1.00 0.00 ATOM 16359 OH2 SOL 419 10.460 32.480 65.900 1.00 0.00 ATOM 16360 H1 SOL 419 10.660 32.350 64.970 1.00 0.00 ATOM 16361 H2 SOL 419 11.220 32.940 66.240 1.00 0.00 ATOM 16362 OH2 SOL 420 50.960 50.240 81.610 1.00 0.00 ATOM 16363 H1 SOL 420 50.580 50.710 82.350 1.00 0.00 ATOM 16364 H2 SOL 420 50.730 49.320 81.760 1.00 0.00 ATOM 16365 OH2 SOL 421 3.330 2.830 81.640 1.00 0.00 ATOM 16366 H1 SOL 421 2.580 3.420 81.550 1.00 0.00 ATOM 16367 H2 SOL 421 3.030 2.140 82.240 1.00 0.00 ATOM 16368 OH2 SOL 422 26.210 54.910 15.030 1.00 0.00 ATOM 16369 H1 SOL 422 25.620 54.470 15.640 1.00 0.00 ATOM 16370 H2 SOL 422 26.480 55.700 15.490 1.00 0.00 ATOM 16371 OH2 SOL 423 25.780 37.860 67.230 1.00 0.00 ATOM 16372 H1 SOL 423 25.820 37.590 66.310 1.00 0.00 ATOM 16373 H2 SOL 423 26.690 37.830 67.520 1.00 0.00 ATOM 16374 OH2 SOL 424 57.500 6.740 0.450 1.00 0.00 ATOM 16375 H1 SOL 424 57.750 6.000 1.000 1.00 0.00 ATOM 16376 H2 SOL 424 58.190 7.390 0.600 1.00 0.00 ATOM 16377 OH2 SOL 425 30.490 22.740 19.380 1.00 0.00 ATOM 16378 H1 SOL 425 30.130 23.560 19.040 1.00 0.00 ATOM 16379 H2 SOL 425 31.220 23.020 19.940 1.00 0.00 ATOM 16380 OH2 SOL 426 42.830 22.070 71.310 1.00 0.00 ATOM 16381 H1 SOL 426 42.660 21.310 70.750 1.00 0.00 ATOM 16382 H2 SOL 426 42.270 22.760 70.940 1.00 0.00 ATOM 16383 OH2 SOL 427 48.160 42.060 20.360 1.00 0.00 ATOM 16384 H1 SOL 427 47.250 41.810 20.210 1.00 0.00 ATOM 16385 H2 SOL 427 48.220 42.960 20.050 1.00 0.00 ATOM 16386 OH2 SOL 428 23.930 29.280 75.840 1.00 0.00 ATOM 16387 H1 SOL 428 24.840 29.570 75.720 1.00 0.00 ATOM 16388 H2 SOL 428 23.740 29.460 76.760 1.00 0.00 ATOM 16389 OH2 SOL 429 15.370 24.750 19.050 1.00 0.00 ATOM 16390 H1 SOL 429 16.170 24.310 18.760 1.00 0.00 ATOM 16391 H2 SOL 429 15.400 25.600 18.610 1.00 0.00 ATOM 16392 OH2 SOL 430 20.560 34.560 0.640 1.00 0.00 ATOM 16393 H1 SOL 430 21.380 34.200 0.950 1.00 0.00 ATOM 16394 H2 SOL 430 20.280 33.970 -0.060 1.00 0.00 ATOM 16395 OH2 SOL 431 45.380 52.910 11.430 1.00 0.00 ATOM 16396 H1 SOL 431 45.880 52.480 10.730 1.00 0.00 ATOM 16397 H2 SOL 431 45.610 53.830 11.360 1.00 0.00 ATOM 16398 OH2 SOL 432 26.600 11.090 75.190 1.00 0.00 ATOM 16399 H1 SOL 432 25.910 11.360 75.800 1.00 0.00 ATOM 16400 H2 SOL 432 27.280 11.760 75.280 1.00 0.00 ATOM 16401 OH2 SOL 433 48.610 36.370 65.290 1.00 0.00 ATOM 16402 H1 SOL 433 47.930 35.770 64.990 1.00 0.00 ATOM 16403 H2 SOL 433 48.870 36.860 64.510 1.00 0.00 ATOM 16404 OH2 SOL 434 54.630 39.880 68.530 1.00 0.00 ATOM 16405 H1 SOL 434 54.000 39.590 69.190 1.00 0.00 ATOM 16406 H2 SOL 434 54.970 40.710 68.890 1.00 0.00 ATOM 16407 OH2 SOL 435 34.560 19.020 20.680 1.00 0.00 ATOM 16408 H1 SOL 435 35.390 19.460 20.480 1.00 0.00 ATOM 16409 H2 SOL 435 33.910 19.490 20.150 1.00 0.00 ATOM 16410 OH2 SOL 436 57.610 17.860 11.360 1.00 0.00 ATOM 16411 H1 SOL 436 57.590 16.920 11.510 1.00 0.00 ATOM 16412 H2 SOL 436 57.800 18.240 12.210 1.00 0.00 ATOM 16413 OH2 SOL 437 5.790 32.690 15.370 1.00 0.00 ATOM 16414 H1 SOL 437 5.550 33.410 14.790 1.00 0.00 ATOM 16415 H2 SOL 437 5.730 33.060 16.250 1.00 0.00 ATOM 16416 OH2 SOL 438 55.170 48.030 82.250 1.00 0.00 ATOM 16417 H1 SOL 438 54.830 47.190 81.940 1.00 0.00 ATOM 16418 H2 SOL 438 54.430 48.630 82.180 1.00 0.00 ATOM 16419 OH2 SOL 439 3.880 4.370 12.120 1.00 0.00 ATOM 16420 H1 SOL 439 4.700 3.930 12.370 1.00 0.00 ATOM 16421 H2 SOL 439 3.350 3.680 11.710 1.00 0.00 ATOM 16422 OH2 SOL 440 58.410 47.910 1.460 1.00 0.00 ATOM 16423 H1 SOL 440 58.080 47.580 0.620 1.00 0.00 ATOM 16424 H2 SOL 440 58.350 48.860 1.370 1.00 0.00 ATOM 16425 OH2 SOL 441 50.090 14.220 67.540 1.00 0.00 ATOM 16426 H1 SOL 441 49.970 15.140 67.280 1.00 0.00 ATOM 16427 H2 SOL 441 50.050 14.240 68.500 1.00 0.00 ATOM 16428 OH2 SOL 442 22.290 29.510 12.620 1.00 0.00 ATOM 16429 H1 SOL 442 23.170 29.300 12.290 1.00 0.00 ATOM 16430 H2 SOL 442 21.830 29.880 11.870 1.00 0.00 ATOM 16431 OH2 SOL 443 49.110 27.030 81.180 1.00 0.00 ATOM 16432 H1 SOL 443 48.180 27.120 81.420 1.00 0.00 ATOM 16433 H2 SOL 443 49.210 27.580 80.410 1.00 0.00 ATOM 16434 OH2 SOL 444 2.850 13.800 83.680 1.00 0.00 ATOM 16435 H1 SOL 444 3.540 13.280 84.080 1.00 0.00 ATOM 16436 H2 SOL 444 3.100 13.860 82.760 1.00 0.00 ATOM 16437 OH2 SOL 445 40.210 7.960 66.650 1.00 0.00 ATOM 16438 H1 SOL 445 41.130 7.710 66.760 1.00 0.00 ATOM 16439 H2 SOL 445 40.240 8.820 66.230 1.00 0.00 ATOM 16440 OH2 SOL 446 36.820 26.700 67.060 1.00 0.00 ATOM 16441 H1 SOL 446 37.310 26.180 66.420 1.00 0.00 ATOM 16442 H2 SOL 446 36.000 26.910 66.610 1.00 0.00 ATOM 16443 OH2 SOL 447 31.490 39.150 76.190 1.00 0.00 ATOM 16444 H1 SOL 447 31.320 38.840 77.080 1.00 0.00 ATOM 16445 H2 SOL 447 32.180 38.570 75.860 1.00 0.00 ATOM 16446 OH2 SOL 448 25.080 19.760 13.940 1.00 0.00 ATOM 16447 H1 SOL 448 25.010 19.380 13.070 1.00 0.00 ATOM 16448 H2 SOL 448 24.370 20.400 13.980 1.00 0.00 ATOM 16449 OH2 SOL 449 28.270 4.410 74.310 1.00 0.00 ATOM 16450 H1 SOL 449 28.780 4.470 75.120 1.00 0.00 ATOM 16451 H2 SOL 449 28.800 4.890 73.670 1.00 0.00 ATOM 16452 OH2 SOL 450 31.130 20.320 18.130 1.00 0.00 ATOM 16453 H1 SOL 450 30.840 21.090 18.630 1.00 0.00 ATOM 16454 H2 SOL 450 31.950 20.600 17.720 1.00 0.00 ATOM 16455 OH2 SOL 451 44.180 35.210 72.480 1.00 0.00 ATOM 16456 H1 SOL 451 44.670 36.030 72.550 1.00 0.00 ATOM 16457 H2 SOL 451 43.310 35.420 72.810 1.00 0.00 ATOM 16458 OH2 SOL 452 28.420 19.420 58.050 1.00 0.00 ATOM 16459 H1 SOL 452 28.200 20.090 57.400 1.00 0.00 ATOM 16460 H2 SOL 452 28.080 18.610 57.680 1.00 0.00 ATOM 16461 OH2 SOL 453 6.460 12.600 16.830 1.00 0.00 ATOM 16462 H1 SOL 453 6.300 11.870 17.440 1.00 0.00 ATOM 16463 H2 SOL 453 6.790 12.170 16.040 1.00 0.00 ATOM 16464 OH2 SOL 454 35.720 52.120 9.650 1.00 0.00 ATOM 16465 H1 SOL 454 35.240 51.450 10.140 1.00 0.00 ATOM 16466 H2 SOL 454 36.580 51.730 9.510 1.00 0.00 ATOM 16467 OH2 SOL 455 4.050 50.750 0.960 1.00 0.00 ATOM 16468 H1 SOL 455 4.310 49.840 1.130 1.00 0.00 ATOM 16469 H2 SOL 455 3.510 50.700 0.170 1.00 0.00 ATOM 16470 OH2 SOL 456 0.400 48.400 68.040 1.00 0.00 ATOM 16471 H1 SOL 456 1.110 48.810 68.530 1.00 0.00 ATOM 16472 H2 SOL 456 0.690 48.420 67.130 1.00 0.00 ATOM 16473 OH2 SOL 457 1.720 33.390 59.050 1.00 0.00 ATOM 16474 H1 SOL 457 1.640 32.620 58.480 1.00 0.00 ATOM 16475 H2 SOL 457 2.630 33.660 58.950 1.00 0.00 ATOM 16476 OH2 SOL 458 33.170 40.600 3.390 1.00 0.00 ATOM 16477 H1 SOL 458 32.290 40.920 3.180 1.00 0.00 ATOM 16478 H2 SOL 458 33.650 41.380 3.670 1.00 0.00 ATOM 16479 OH2 SOL 459 18.190 10.470 15.980 1.00 0.00 ATOM 16480 H1 SOL 459 17.440 10.350 15.400 1.00 0.00 ATOM 16481 H2 SOL 459 17.920 11.170 16.570 1.00 0.00 ATOM 16482 OH2 SOL 460 14.100 53.650 81.230 1.00 0.00 ATOM 16483 H1 SOL 460 13.510 53.130 80.690 1.00 0.00 ATOM 16484 H2 SOL 460 14.640 53.000 81.690 1.00 0.00 ATOM 16485 OH2 SOL 461 23.200 6.560 81.510 1.00 0.00 ATOM 16486 H1 SOL 461 23.060 5.720 81.080 1.00 0.00 ATOM 16487 H2 SOL 461 22.430 6.680 82.070 1.00 0.00 ATOM 16488 OH2 SOL 462 39.300 49.870 84.010 1.00 0.00 ATOM 16489 H1 SOL 462 39.190 49.420 83.180 1.00 0.00 ATOM 16490 H2 SOL 462 40.030 50.480 83.860 1.00 0.00 ATOM 16491 OH2 SOL 463 26.400 22.010 3.830 1.00 0.00 ATOM 16492 H1 SOL 463 26.790 22.890 3.820 1.00 0.00 ATOM 16493 H2 SOL 463 25.470 22.160 3.940 1.00 0.00 ATOM 16494 OH2 SOL 464 31.900 12.370 70.850 1.00 0.00 ATOM 16495 H1 SOL 464 31.500 12.010 70.060 1.00 0.00 ATOM 16496 H2 SOL 464 31.240 12.240 71.540 1.00 0.00 ATOM 16497 OH2 SOL 465 20.460 29.490 10.270 1.00 0.00 ATOM 16498 H1 SOL 465 19.850 28.800 10.550 1.00 0.00 ATOM 16499 H2 SOL 465 19.990 29.970 9.590 1.00 0.00 ATOM 16500 OH2 SOL 466 43.780 10.490 6.020 1.00 0.00 ATOM 16501 H1 SOL 466 42.970 10.390 5.520 1.00 0.00 ATOM 16502 H2 SOL 466 43.490 10.580 6.930 1.00 0.00 ATOM 16503 OH2 SOL 467 37.910 14.460 20.560 1.00 0.00 ATOM 16504 H1 SOL 467 38.130 15.210 21.120 1.00 0.00 ATOM 16505 H2 SOL 467 38.330 14.650 19.720 1.00 0.00 ATOM 16506 OH2 SOL 468 38.370 17.890 19.310 1.00 0.00 ATOM 16507 H1 SOL 468 38.470 17.580 20.210 1.00 0.00 ATOM 16508 H2 SOL 468 37.650 17.370 18.960 1.00 0.00 ATOM 16509 OH2 SOL 469 13.870 33.000 17.500 1.00 0.00 ATOM 16510 H1 SOL 469 13.450 33.050 16.640 1.00 0.00 ATOM 16511 H2 SOL 469 13.460 32.250 17.930 1.00 0.00 ATOM 16512 OH2 SOL 470 35.220 32.120 13.520 1.00 0.00 ATOM 16513 H1 SOL 470 35.780 32.370 12.790 1.00 0.00 ATOM 16514 H2 SOL 470 35.810 31.680 14.140 1.00 0.00 ATOM 16515 OH2 SOL 471 33.750 11.190 20.100 1.00 0.00 ATOM 16516 H1 SOL 471 34.130 10.520 19.530 1.00 0.00 ATOM 16517 H2 SOL 471 34.350 11.930 20.030 1.00 0.00 ATOM 16518 OH2 SOL 472 38.400 16.170 75.050 1.00 0.00 ATOM 16519 H1 SOL 472 38.510 16.830 74.360 1.00 0.00 ATOM 16520 H2 SOL 472 37.570 15.750 74.850 1.00 0.00 ATOM 16521 OH2 SOL 473 24.820 26.360 82.650 1.00 0.00 ATOM 16522 H1 SOL 473 25.700 26.000 82.550 1.00 0.00 ATOM 16523 H2 SOL 473 24.900 27.010 83.350 1.00 0.00 ATOM 16524 OH2 SOL 474 8.770 39.340 17.230 1.00 0.00 ATOM 16525 H1 SOL 474 8.670 38.590 17.810 1.00 0.00 ATOM 16526 H2 SOL 474 7.880 39.530 16.920 1.00 0.00 ATOM 16527 OH2 SOL 475 47.180 43.930 0.590 1.00 0.00 ATOM 16528 H1 SOL 475 47.570 43.900 1.470 1.00 0.00 ATOM 16529 H2 SOL 475 46.550 43.210 0.590 1.00 0.00 ATOM 16530 OH2 SOL 476 7.120 40.070 9.580 1.00 0.00 ATOM 16531 H1 SOL 476 7.630 40.190 10.380 1.00 0.00 ATOM 16532 H2 SOL 476 7.160 39.130 9.400 1.00 0.00 ATOM 16533 OH2 SOL 477 38.370 59.970 3.890 1.00 0.00 ATOM 16534 H1 SOL 477 38.960 59.590 3.240 1.00 0.00 ATOM 16535 H2 SOL 477 38.910 60.590 4.370 1.00 0.00 ATOM 16536 OH2 SOL 478 57.610 43.990 70.660 1.00 0.00 ATOM 16537 H1 SOL 478 57.960 44.160 71.530 1.00 0.00 ATOM 16538 H2 SOL 478 58.190 44.490 70.080 1.00 0.00 ATOM 16539 OH2 SOL 479 23.600 4.900 23.700 1.00 0.00 ATOM 16540 H1 SOL 479 23.660 4.210 23.040 1.00 0.00 ATOM 16541 H2 SOL 479 23.880 5.690 23.250 1.00 0.00 ATOM 16542 OH2 SOL 480 49.770 20.230 16.800 1.00 0.00 ATOM 16543 H1 SOL 480 49.110 20.900 16.630 1.00 0.00 ATOM 16544 H2 SOL 480 49.730 20.090 17.750 1.00 0.00 ATOM 16545 OH2 SOL 481 35.660 4.830 67.900 1.00 0.00 ATOM 16546 H1 SOL 481 35.910 3.910 67.790 1.00 0.00 ATOM 16547 H2 SOL 481 36.430 5.320 67.610 1.00 0.00 ATOM 16548 OH2 SOL 482 20.670 11.090 77.040 1.00 0.00 ATOM 16549 H1 SOL 482 20.860 10.950 77.970 1.00 0.00 ATOM 16550 H2 SOL 482 21.210 11.840 76.790 1.00 0.00 ATOM 16551 OH2 SOL 483 28.580 26.660 76.240 1.00 0.00 ATOM 16552 H1 SOL 483 27.880 27.260 75.970 1.00 0.00 ATOM 16553 H2 SOL 483 29.110 26.550 75.450 1.00 0.00 ATOM 16554 OH2 SOL 484 18.740 15.630 13.240 1.00 0.00 ATOM 16555 H1 SOL 484 19.690 15.590 13.340 1.00 0.00 ATOM 16556 H2 SOL 484 18.580 15.400 12.320 1.00 0.00 ATOM 16557 OH2 SOL 485 18.160 60.200 77.920 1.00 0.00 ATOM 16558 H1 SOL 485 17.850 60.930 78.450 1.00 0.00 ATOM 16559 H2 SOL 485 17.820 59.420 78.350 1.00 0.00 ATOM 16560 OH2 SOL 486 20.640 45.150 73.870 1.00 0.00 ATOM 16561 H1 SOL 486 20.610 46.080 73.660 1.00 0.00 ATOM 16562 H2 SOL 486 21.560 44.900 73.740 1.00 0.00 ATOM 16563 OH2 SOL 487 10.330 25.010 80.720 1.00 0.00 ATOM 16564 H1 SOL 487 9.580 25.110 80.140 1.00 0.00 ATOM 16565 H2 SOL 487 10.910 25.730 80.490 1.00 0.00 ATOM 16566 OH2 SOL 488 6.190 14.360 1.060 1.00 0.00 ATOM 16567 H1 SOL 488 5.640 13.960 1.740 1.00 0.00 ATOM 16568 H2 SOL 488 6.130 13.760 0.320 1.00 0.00 ATOM 16569 OH2 SOL 489 8.520 10.020 73.870 1.00 0.00 ATOM 16570 H1 SOL 489 8.060 10.830 74.120 1.00 0.00 ATOM 16571 H2 SOL 489 9.430 10.290 73.790 1.00 0.00 ATOM 16572 OH2 SOL 490 12.720 42.540 68.760 1.00 0.00 ATOM 16573 H1 SOL 490 13.150 43.260 68.290 1.00 0.00 ATOM 16574 H2 SOL 490 13.090 42.580 69.640 1.00 0.00 ATOM 16575 OH2 SOL 491 50.090 19.100 65.320 1.00 0.00 ATOM 16576 H1 SOL 491 49.380 19.440 64.790 1.00 0.00 ATOM 16577 H2 SOL 491 49.850 18.190 65.490 1.00 0.00 ATOM 16578 OH2 SOL 492 14.040 35.760 18.620 1.00 0.00 ATOM 16579 H1 SOL 492 13.970 34.860 18.290 1.00 0.00 ATOM 16580 H2 SOL 492 13.520 35.760 19.430 1.00 0.00 ATOM 16581 OH2 SOL 493 35.210 2.470 73.040 1.00 0.00 ATOM 16582 H1 SOL 493 34.820 2.860 72.250 1.00 0.00 ATOM 16583 H2 SOL 493 35.240 3.190 73.670 1.00 0.00 ATOM 16584 OH2 SOL 494 0.440 22.590 7.070 1.00 0.00 ATOM 16585 H1 SOL 494 0.350 22.600 8.020 1.00 0.00 ATOM 16586 H2 SOL 494 0.370 23.510 6.810 1.00 0.00 ATOM 16587 OH2 SOL 495 4.220 43.100 78.370 1.00 0.00 ATOM 16588 H1 SOL 495 4.780 42.510 78.870 1.00 0.00 ATOM 16589 H2 SOL 495 3.760 43.610 79.040 1.00 0.00 ATOM 16590 OH2 SOL 496 6.700 55.860 74.250 1.00 0.00 ATOM 16591 H1 SOL 496 6.170 56.630 74.440 1.00 0.00 ATOM 16592 H2 SOL 496 6.460 55.610 73.360 1.00 0.00 ATOM 16593 OH2 SOL 497 30.900 20.050 10.250 1.00 0.00 ATOM 16594 H1 SOL 497 31.510 20.610 10.740 1.00 0.00 ATOM 16595 H2 SOL 497 30.130 19.980 10.820 1.00 0.00 ATOM 16596 OH2 SOL 498 38.160 52.600 72.850 1.00 0.00 ATOM 16597 H1 SOL 498 38.330 53.020 72.010 1.00 0.00 ATOM 16598 H2 SOL 498 37.220 52.390 72.830 1.00 0.00 ATOM 16599 OH2 SOL 499 36.810 3.150 5.640 1.00 0.00 ATOM 16600 H1 SOL 499 36.170 3.490 6.260 1.00 0.00 ATOM 16601 H2 SOL 499 36.610 2.220 5.580 1.00 0.00 ATOM 16602 OH2 SOL 500 59.940 5.390 84.090 1.00 0.00 ATOM 16603 H1 SOL 500 59.740 6.240 84.460 1.00 0.00 ATOM 16604 H2 SOL 500 59.190 4.840 84.340 1.00 0.00 ATOM 16605 OH2 SOL 501 38.590 20.560 61.750 1.00 0.00 ATOM 16606 H1 SOL 501 39.390 20.690 61.240 1.00 0.00 ATOM 16607 H2 SOL 501 38.380 19.630 61.640 1.00 0.00 ATOM 16608 OH2 SOL 502 38.190 19.420 65.230 1.00 0.00 ATOM 16609 H1 SOL 502 38.520 18.620 64.810 1.00 0.00 ATOM 16610 H2 SOL 502 37.260 19.250 65.360 1.00 0.00 ATOM 16611 OH2 SOL 503 34.970 57.620 67.510 1.00 0.00 ATOM 16612 H1 SOL 503 35.210 57.260 68.370 1.00 0.00 ATOM 16613 H2 SOL 503 35.410 57.060 66.880 1.00 0.00 ATOM 16614 OH2 SOL 504 4.780 11.600 20.110 1.00 0.00 ATOM 16615 H1 SOL 504 4.030 11.010 20.100 1.00 0.00 ATOM 16616 H2 SOL 504 5.260 11.380 20.910 1.00 0.00 ATOM 16617 OH2 SOL 505 39.880 42.060 84.340 1.00 0.00 ATOM 16618 H1 SOL 505 39.120 41.820 84.870 1.00 0.00 ATOM 16619 H2 SOL 505 40.440 42.550 84.930 1.00 0.00 ATOM 16620 OH2 SOL 506 14.100 12.170 74.450 1.00 0.00 ATOM 16621 H1 SOL 506 14.450 11.900 73.600 1.00 0.00 ATOM 16622 H2 SOL 506 14.340 13.100 74.530 1.00 0.00 ATOM 16623 OH2 SOL 507 50.520 13.390 8.290 1.00 0.00 ATOM 16624 H1 SOL 507 50.790 14.300 8.190 1.00 0.00 ATOM 16625 H2 SOL 507 50.760 12.980 7.460 1.00 0.00 ATOM 16626 OH2 SOL 508 48.190 46.790 76.380 1.00 0.00 ATOM 16627 H1 SOL 508 48.070 47.060 77.290 1.00 0.00 ATOM 16628 H2 SOL 508 48.600 47.550 75.960 1.00 0.00 ATOM 16629 OH2 SOL 509 24.280 37.350 71.400 1.00 0.00 ATOM 16630 H1 SOL 509 24.240 38.290 71.220 1.00 0.00 ATOM 16631 H2 SOL 509 24.710 36.970 70.640 1.00 0.00 ATOM 16632 OH2 SOL 510 12.760 59.330 1.940 1.00 0.00 ATOM 16633 H1 SOL 510 13.170 58.560 1.550 1.00 0.00 ATOM 16634 H2 SOL 510 12.880 59.210 2.880 1.00 0.00 ATOM 16635 OH2 SOL 511 59.820 21.050 4.060 1.00 0.00 ATOM 16636 H1 SOL 511 59.540 21.440 3.230 1.00 0.00 ATOM 16637 H2 SOL 511 59.110 21.270 4.670 1.00 0.00 ATOM 16638 OH2 SOL 512 18.950 31.660 79.950 1.00 0.00 ATOM 16639 H1 SOL 512 18.850 31.840 80.880 1.00 0.00 ATOM 16640 H2 SOL 512 18.580 30.780 79.840 1.00 0.00 ATOM 16641 OH2 SOL 513 16.330 28.760 5.250 1.00 0.00 ATOM 16642 H1 SOL 513 16.200 28.760 6.200 1.00 0.00 ATOM 16643 H2 SOL 513 16.990 28.090 5.100 1.00 0.00 ATOM 16644 OH2 SOL 514 41.020 57.270 68.280 1.00 0.00 ATOM 16645 H1 SOL 514 41.080 56.680 69.020 1.00 0.00 ATOM 16646 H2 SOL 514 40.090 57.270 68.050 1.00 0.00 ATOM 16647 OH2 SOL 515 31.160 53.670 12.460 1.00 0.00 ATOM 16648 H1 SOL 515 30.930 54.330 13.110 1.00 0.00 ATOM 16649 H2 SOL 515 30.370 53.540 11.940 1.00 0.00 ATOM 16650 OH2 SOL 516 55.380 16.340 79.030 1.00 0.00 ATOM 16651 H1 SOL 516 55.640 15.420 79.110 1.00 0.00 ATOM 16652 H2 SOL 516 55.920 16.680 78.320 1.00 0.00 ATOM 16653 OH2 SOL 517 42.830 13.690 74.770 1.00 0.00 ATOM 16654 H1 SOL 517 42.690 14.410 74.150 1.00 0.00 ATOM 16655 H2 SOL 517 41.990 13.610 75.230 1.00 0.00 ATOM 16656 OH2 SOL 518 6.610 15.380 81.170 1.00 0.00 ATOM 16657 H1 SOL 518 6.450 14.880 81.970 1.00 0.00 ATOM 16658 H2 SOL 518 7.360 15.940 81.380 1.00 0.00 ATOM 16659 OH2 SOL 519 8.170 40.310 11.970 1.00 0.00 ATOM 16660 H1 SOL 519 8.770 40.270 12.710 1.00 0.00 ATOM 16661 H2 SOL 519 8.020 41.250 11.830 1.00 0.00 ATOM 16662 OH2 SOL 520 46.560 35.690 15.930 1.00 0.00 ATOM 16663 H1 SOL 520 46.690 36.070 15.060 1.00 0.00 ATOM 16664 H2 SOL 520 45.610 35.650 16.030 1.00 0.00 ATOM 16665 OH2 SOL 521 54.500 55.600 67.930 1.00 0.00 ATOM 16666 H1 SOL 521 54.750 55.040 67.200 1.00 0.00 ATOM 16667 H2 SOL 521 55.110 56.330 67.900 1.00 0.00 ATOM 16668 OH2 SOL 522 22.640 51.830 22.880 1.00 0.00 ATOM 16669 H1 SOL 522 23.570 52.040 22.960 1.00 0.00 ATOM 16670 H2 SOL 522 22.190 52.640 23.130 1.00 0.00 ATOM 16671 OH2 SOL 523 38.890 18.390 10.730 1.00 0.00 ATOM 16672 H1 SOL 523 39.780 18.620 10.450 1.00 0.00 ATOM 16673 H2 SOL 523 39.020 17.840 11.500 1.00 0.00 ATOM 16674 OH2 SOL 524 21.730 58.360 67.120 1.00 0.00 ATOM 16675 H1 SOL 524 21.670 58.880 66.330 1.00 0.00 ATOM 16676 H2 SOL 524 22.650 58.090 67.170 1.00 0.00 ATOM 16677 OH2 SOL 525 49.250 14.580 76.330 1.00 0.00 ATOM 16678 H1 SOL 525 49.200 15.180 75.590 1.00 0.00 ATOM 16679 H2 SOL 525 48.490 14.810 76.870 1.00 0.00 ATOM 16680 OH2 SOL 526 59.220 47.090 76.550 1.00 0.00 ATOM 16681 H1 SOL 526 58.270 47.060 76.680 1.00 0.00 ATOM 16682 H2 SOL 526 59.360 47.890 76.030 1.00 0.00 ATOM 16683 OH2 SOL 527 26.520 15.960 83.980 1.00 0.00 ATOM 16684 H1 SOL 527 26.880 15.160 84.360 1.00 0.00 ATOM 16685 H2 SOL 527 26.920 16.010 83.100 1.00 0.00 ATOM 16686 OH2 SOL 528 2.160 10.520 70.460 1.00 0.00 ATOM 16687 H1 SOL 528 3.020 10.170 70.680 1.00 0.00 ATOM 16688 H2 SOL 528 1.730 10.650 71.310 1.00 0.00 ATOM 16689 OH2 SOL 529 49.180 35.840 83.280 1.00 0.00 ATOM 16690 H1 SOL 529 48.360 36.000 83.750 1.00 0.00 ATOM 16691 H2 SOL 529 49.020 36.160 82.390 1.00 0.00 ATOM 16692 OH2 SOL 530 49.480 12.100 77.500 1.00 0.00 ATOM 16693 H1 SOL 530 48.890 11.490 77.050 1.00 0.00 ATOM 16694 H2 SOL 530 49.210 12.970 77.180 1.00 0.00 ATOM 16695 OH2 SOL 531 58.100 49.680 72.820 1.00 0.00 ATOM 16696 H1 SOL 531 58.330 48.750 72.870 1.00 0.00 ATOM 16697 H2 SOL 531 58.600 50.020 72.080 1.00 0.00 ATOM 16698 OH2 SOL 532 34.050 20.470 8.730 1.00 0.00 ATOM 16699 H1 SOL 532 33.510 20.920 8.080 1.00 0.00 ATOM 16700 H2 SOL 532 34.020 21.030 9.500 1.00 0.00 ATOM 16701 OH2 SOL 533 21.630 34.300 81.410 1.00 0.00 ATOM 16702 H1 SOL 533 21.470 34.140 80.480 1.00 0.00 ATOM 16703 H2 SOL 533 22.570 34.140 81.520 1.00 0.00 ATOM 16704 OH2 SOL 534 19.240 49.500 73.970 1.00 0.00 ATOM 16705 H1 SOL 534 19.800 50.270 73.860 1.00 0.00 ATOM 16706 H2 SOL 534 18.530 49.790 74.540 1.00 0.00 ATOM 16707 OH2 SOL 535 39.460 44.530 82.950 1.00 0.00 ATOM 16708 H1 SOL 535 39.640 43.620 83.200 1.00 0.00 ATOM 16709 H2 SOL 535 40.190 45.030 83.320 1.00 0.00 ATOM 16710 OH2 SOL 536 19.230 51.900 75.980 1.00 0.00 ATOM 16711 H1 SOL 536 20.000 52.370 75.660 1.00 0.00 ATOM 16712 H2 SOL 536 19.540 51.430 76.760 1.00 0.00 ATOM 16713 OH2 SOL 537 49.950 0.680 11.690 1.00 0.00 ATOM 16714 H1 SOL 537 49.500 1.490 11.950 1.00 0.00 ATOM 16715 H2 SOL 537 50.870 0.920 11.660 1.00 0.00 ATOM 16716 OH2 SOL 538 52.720 27.480 74.690 1.00 0.00 ATOM 16717 H1 SOL 538 51.950 27.000 74.990 1.00 0.00 ATOM 16718 H2 SOL 538 52.360 28.260 74.250 1.00 0.00 ATOM 16719 OH2 SOL 539 7.870 19.850 9.760 1.00 0.00 ATOM 16720 H1 SOL 539 7.480 20.200 8.950 1.00 0.00 ATOM 16721 H2 SOL 539 7.740 18.910 9.700 1.00 0.00 ATOM 16722 OH2 SOL 540 56.580 28.290 74.400 1.00 0.00 ATOM 16723 H1 SOL 540 56.070 27.550 74.750 1.00 0.00 ATOM 16724 H2 SOL 540 57.490 28.040 74.550 1.00 0.00 ATOM 16725 OH2 SOL 541 45.960 30.830 66.880 1.00 0.00 ATOM 16726 H1 SOL 541 45.560 30.000 67.160 1.00 0.00 ATOM 16727 H2 SOL 541 46.210 31.250 67.700 1.00 0.00 ATOM 16728 OH2 SOL 542 3.280 22.370 81.430 1.00 0.00 ATOM 16729 H1 SOL 542 3.570 22.150 82.310 1.00 0.00 ATOM 16730 H2 SOL 542 3.730 21.730 80.870 1.00 0.00 ATOM 16731 OH2 SOL 543 42.410 14.330 6.540 1.00 0.00 ATOM 16732 H1 SOL 543 42.740 15.220 6.420 1.00 0.00 ATOM 16733 H2 SOL 543 41.840 14.390 7.300 1.00 0.00 ATOM 16734 OH2 SOL 544 28.760 32.040 1.530 1.00 0.00 ATOM 16735 H1 SOL 544 27.980 32.560 1.330 1.00 0.00 ATOM 16736 H2 SOL 544 28.520 31.540 2.310 1.00 0.00 ATOM 16737 OH2 SOL 545 21.170 13.550 69.330 1.00 0.00 ATOM 16738 H1 SOL 545 20.490 13.760 68.690 1.00 0.00 ATOM 16739 H2 SOL 545 21.210 14.330 69.890 1.00 0.00 ATOM 16740 OH2 SOL 546 30.700 21.910 70.870 1.00 0.00 ATOM 16741 H1 SOL 546 30.490 21.890 71.800 1.00 0.00 ATOM 16742 H2 SOL 546 30.360 21.080 70.530 1.00 0.00 ATOM 16743 OH2 SOL 547 20.680 22.750 80.750 1.00 0.00 ATOM 16744 H1 SOL 547 20.260 23.560 80.460 1.00 0.00 ATOM 16745 H2 SOL 547 20.930 22.930 81.660 1.00 0.00 ATOM 16746 OH2 SOL 548 23.060 8.880 17.820 1.00 0.00 ATOM 16747 H1 SOL 548 23.920 8.920 18.240 1.00 0.00 ATOM 16748 H2 SOL 548 22.900 9.780 17.520 1.00 0.00 ATOM 16749 OH2 SOL 549 27.660 49.720 68.780 1.00 0.00 ATOM 16750 H1 SOL 549 27.010 50.420 68.660 1.00 0.00 ATOM 16751 H2 SOL 549 28.490 50.110 68.510 1.00 0.00 ATOM 16752 OH2 SOL 550 28.300 13.920 75.780 1.00 0.00 ATOM 16753 H1 SOL 550 27.610 14.400 75.330 1.00 0.00 ATOM 16754 H2 SOL 550 28.200 14.160 76.700 1.00 0.00 ATOM 16755 OH2 SOL 551 2.850 24.750 7.560 1.00 0.00 ATOM 16756 H1 SOL 551 1.940 25.000 7.430 1.00 0.00 ATOM 16757 H2 SOL 551 2.940 24.700 8.510 1.00 0.00 ATOM 16758 OH2 SOL 552 1.250 39.040 83.370 1.00 0.00 ATOM 16759 H1 SOL 552 1.720 39.280 82.570 1.00 0.00 ATOM 16760 H2 SOL 552 1.810 39.370 84.080 1.00 0.00 ATOM 16761 OH2 SOL 553 53.500 22.620 10.770 1.00 0.00 ATOM 16762 H1 SOL 553 52.940 22.540 11.550 1.00 0.00 ATOM 16763 H2 SOL 553 54.330 22.220 11.030 1.00 0.00 ATOM 16764 OH2 SOL 554 47.300 11.000 65.560 1.00 0.00 ATOM 16765 H1 SOL 554 47.670 11.220 64.700 1.00 0.00 ATOM 16766 H2 SOL 554 48.070 10.860 66.120 1.00 0.00 ATOM 16767 OH2 SOL 555 11.620 10.630 73.310 1.00 0.00 ATOM 16768 H1 SOL 555 11.310 11.520 73.480 1.00 0.00 ATOM 16769 H2 SOL 555 12.390 10.750 72.750 1.00 0.00 ATOM 16770 OH2 SOL 556 35.310 27.270 2.740 1.00 0.00 ATOM 16771 H1 SOL 556 35.700 28.140 2.730 1.00 0.00 ATOM 16772 H2 SOL 556 34.470 27.390 2.280 1.00 0.00 ATOM 16773 OH2 SOL 557 38.760 15.520 5.230 1.00 0.00 ATOM 16774 H1 SOL 557 39.080 15.440 4.330 1.00 0.00 ATOM 16775 H2 SOL 557 38.340 16.380 5.270 1.00 0.00 ATOM 16776 OH2 SOL 558 51.790 58.090 4.350 1.00 0.00 ATOM 16777 H1 SOL 558 51.700 58.400 5.250 1.00 0.00 ATOM 16778 H2 SOL 558 51.170 57.360 4.280 1.00 0.00 ATOM 16779 OH2 SOL 559 58.610 45.640 80.560 1.00 0.00 ATOM 16780 H1 SOL 559 58.250 46.380 81.040 1.00 0.00 ATOM 16781 H2 SOL 559 59.530 45.880 80.410 1.00 0.00 ATOM 16782 OH2 SOL 560 15.590 14.520 15.350 1.00 0.00 ATOM 16783 H1 SOL 560 15.110 14.000 16.000 1.00 0.00 ATOM 16784 H2 SOL 560 16.440 14.670 15.750 1.00 0.00 ATOM 16785 OH2 SOL 561 26.720 58.050 0.340 1.00 0.00 ATOM 16786 H1 SOL 561 27.030 58.200 1.230 1.00 0.00 ATOM 16787 H2 SOL 561 26.860 57.110 0.190 1.00 0.00 ATOM 16788 OH2 SOL 562 3.670 16.820 19.770 1.00 0.00 ATOM 16789 H1 SOL 562 3.710 16.590 18.840 1.00 0.00 ATOM 16790 H2 SOL 562 3.960 16.030 20.230 1.00 0.00 ATOM 16791 OH2 SOL 563 27.970 33.760 66.720 1.00 0.00 ATOM 16792 H1 SOL 563 28.480 34.470 66.320 1.00 0.00 ATOM 16793 H2 SOL 563 27.090 33.860 66.350 1.00 0.00 ATOM 16794 OH2 SOL 564 58.290 39.640 7.430 1.00 0.00 ATOM 16795 H1 SOL 564 58.760 38.970 7.930 1.00 0.00 ATOM 16796 H2 SOL 564 57.660 39.150 6.910 1.00 0.00 ATOM 16797 OH2 SOL 565 6.310 38.090 14.580 1.00 0.00 ATOM 16798 H1 SOL 565 7.210 37.770 14.560 1.00 0.00 ATOM 16799 H2 SOL 565 6.000 37.990 13.670 1.00 0.00 ATOM 16800 OH2 SOL 566 2.380 19.690 16.580 1.00 0.00 ATOM 16801 H1 SOL 566 1.630 19.100 16.600 1.00 0.00 ATOM 16802 H2 SOL 566 2.190 20.340 17.260 1.00 0.00 ATOM 16803 OH2 SOL 567 9.920 29.670 9.630 1.00 0.00 ATOM 16804 H1 SOL 567 9.680 29.780 8.710 1.00 0.00 ATOM 16805 H2 SOL 567 9.560 28.820 9.880 1.00 0.00 ATOM 16806 OH2 SOL 568 57.190 20.880 67.380 1.00 0.00 ATOM 16807 H1 SOL 568 56.310 21.170 67.610 1.00 0.00 ATOM 16808 H2 SOL 568 57.760 21.600 67.650 1.00 0.00 ATOM 16809 OH2 SOL 569 9.200 30.200 24.300 1.00 0.00 ATOM 16810 H1 SOL 569 9.840 30.910 24.420 1.00 0.00 ATOM 16811 H2 SOL 569 9.500 29.510 24.890 1.00 0.00 ATOM 16812 OH2 SOL 570 4.710 9.800 75.640 1.00 0.00 ATOM 16813 H1 SOL 570 4.070 9.260 75.170 1.00 0.00 ATOM 16814 H2 SOL 570 4.280 10.640 75.750 1.00 0.00 ATOM 16815 OH2 SOL 571 32.370 22.880 2.660 1.00 0.00 ATOM 16816 H1 SOL 571 31.960 23.210 1.860 1.00 0.00 ATOM 16817 H2 SOL 571 32.010 22.000 2.770 1.00 0.00 ATOM 16818 OH2 SOL 572 31.280 36.630 13.680 1.00 0.00 ATOM 16819 H1 SOL 572 32.230 36.520 13.690 1.00 0.00 ATOM 16820 H2 SOL 572 30.930 35.740 13.640 1.00 0.00 ATOM 16821 OH2 SOL 573 48.180 45.970 11.050 1.00 0.00 ATOM 16822 H1 SOL 573 47.630 45.370 10.540 1.00 0.00 ATOM 16823 H2 SOL 573 48.970 45.460 11.240 1.00 0.00 ATOM 16824 OH2 SOL 574 16.370 18.930 69.550 1.00 0.00 ATOM 16825 H1 SOL 574 16.830 18.460 68.850 1.00 0.00 ATOM 16826 H2 SOL 574 16.210 19.800 69.190 1.00 0.00 ATOM 16827 OH2 SOL 575 18.980 54.720 22.150 1.00 0.00 ATOM 16828 H1 SOL 575 19.830 54.310 22.290 1.00 0.00 ATOM 16829 H2 SOL 575 18.540 54.650 23.000 1.00 0.00 ATOM 16830 OH2 SOL 576 25.210 45.260 6.000 1.00 0.00 ATOM 16831 H1 SOL 576 25.810 46.010 5.980 1.00 0.00 ATOM 16832 H2 SOL 576 25.690 44.580 6.460 1.00 0.00 ATOM 16833 OH2 SOL 577 10.460 4.520 66.820 1.00 0.00 ATOM 16834 H1 SOL 577 10.310 4.770 67.730 1.00 0.00 ATOM 16835 H2 SOL 577 9.620 4.160 66.530 1.00 0.00 ATOM 16836 OH2 SOL 578 9.040 13.580 13.740 1.00 0.00 ATOM 16837 H1 SOL 578 8.840 14.000 12.910 1.00 0.00 ATOM 16838 H2 SOL 578 8.300 12.990 13.900 1.00 0.00 ATOM 16839 OH2 SOL 579 36.590 56.040 78.160 1.00 0.00 ATOM 16840 H1 SOL 579 35.740 56.420 78.350 1.00 0.00 ATOM 16841 H2 SOL 579 36.550 55.160 78.530 1.00 0.00 ATOM 16842 OH2 SOL 580 4.710 18.570 65.430 1.00 0.00 ATOM 16843 H1 SOL 580 4.910 19.180 66.150 1.00 0.00 ATOM 16844 H2 SOL 580 4.130 19.060 64.850 1.00 0.00 ATOM 16845 OH2 SOL 581 35.340 21.730 13.510 1.00 0.00 ATOM 16846 H1 SOL 581 35.310 22.430 14.160 1.00 0.00 ATOM 16847 H2 SOL 581 35.090 20.940 14.000 1.00 0.00 ATOM 16848 OH2 SOL 582 35.770 40.640 11.320 1.00 0.00 ATOM 16849 H1 SOL 582 35.630 41.410 10.770 1.00 0.00 ATOM 16850 H2 SOL 582 35.370 39.920 10.840 1.00 0.00 ATOM 16851 OH2 SOL 583 56.140 19.420 65.070 1.00 0.00 ATOM 16852 H1 SOL 583 56.740 19.890 65.650 1.00 0.00 ATOM 16853 H2 SOL 583 56.710 18.940 64.480 1.00 0.00 ATOM 16854 OH2 SOL 584 39.410 1.770 63.240 1.00 0.00 ATOM 16855 H1 SOL 584 38.720 2.280 62.800 1.00 0.00 ATOM 16856 H2 SOL 584 39.340 0.890 62.870 1.00 0.00 ATOM 16857 OH2 SOL 585 33.490 47.680 75.320 1.00 0.00 ATOM 16858 H1 SOL 585 34.040 48.070 74.640 1.00 0.00 ATOM 16859 H2 SOL 585 32.840 47.170 74.850 1.00 0.00 ATOM 16860 OH2 SOL 586 51.350 34.150 77.010 1.00 0.00 ATOM 16861 H1 SOL 586 52.130 34.600 76.680 1.00 0.00 ATOM 16862 H2 SOL 586 50.670 34.320 76.350 1.00 0.00 ATOM 16863 OH2 SOL 587 4.990 46.270 9.720 1.00 0.00 ATOM 16864 H1 SOL 587 5.340 45.530 9.220 1.00 0.00 ATOM 16865 H2 SOL 587 4.840 46.950 9.070 1.00 0.00 ATOM 16866 OH2 SOL 588 35.370 26.610 72.490 1.00 0.00 ATOM 16867 H1 SOL 588 34.630 26.630 73.100 1.00 0.00 ATOM 16868 H2 SOL 588 35.040 27.030 71.700 1.00 0.00 ATOM 16869 OH2 SOL 589 36.150 25.110 6.800 1.00 0.00 ATOM 16870 H1 SOL 589 36.240 24.800 5.900 1.00 0.00 ATOM 16871 H2 SOL 589 37.040 25.240 7.110 1.00 0.00 ATOM 16872 OH2 SOL 590 24.450 12.070 83.950 1.00 0.00 ATOM 16873 H1 SOL 590 23.970 12.580 84.600 1.00 0.00 ATOM 16874 H2 SOL 590 24.490 11.180 84.310 1.00 0.00 ATOM 16875 OH2 SOL 591 16.480 22.030 67.210 1.00 0.00 ATOM 16876 H1 SOL 591 17.110 22.300 67.880 1.00 0.00 ATOM 16877 H2 SOL 591 16.940 21.380 66.690 1.00 0.00 ATOM 16878 OH2 SOL 592 50.990 19.890 61.440 1.00 0.00 ATOM 16879 H1 SOL 592 51.790 19.370 61.510 1.00 0.00 ATOM 16880 H2 SOL 592 50.280 19.260 61.570 1.00 0.00 ATOM 16881 OH2 SOL 593 37.600 1.930 71.490 1.00 0.00 ATOM 16882 H1 SOL 593 38.450 2.280 71.770 1.00 0.00 ATOM 16883 H2 SOL 593 36.970 2.310 72.100 1.00 0.00 ATOM 16884 OH2 SOL 594 3.420 32.750 19.980 1.00 0.00 ATOM 16885 H1 SOL 594 3.090 33.540 20.400 1.00 0.00 ATOM 16886 H2 SOL 594 3.240 32.050 20.600 1.00 0.00 ATOM 16887 OH2 SOL 595 33.200 24.440 69.500 1.00 0.00 ATOM 16888 H1 SOL 595 33.260 23.490 69.470 1.00 0.00 ATOM 16889 H2 SOL 595 34.090 24.750 69.330 1.00 0.00 ATOM 16890 OH2 SOL 596 35.700 58.280 16.990 1.00 0.00 ATOM 16891 H1 SOL 596 34.840 58.630 17.200 1.00 0.00 ATOM 16892 H2 SOL 596 35.980 58.780 16.220 1.00 0.00 ATOM 16893 OH2 SOL 597 30.990 33.750 79.940 1.00 0.00 ATOM 16894 H1 SOL 597 30.650 34.540 80.370 1.00 0.00 ATOM 16895 H2 SOL 597 30.560 33.030 80.390 1.00 0.00 ATOM 16896 OH2 SOL 598 40.380 13.040 78.160 1.00 0.00 ATOM 16897 H1 SOL 598 40.370 13.710 77.470 1.00 0.00 ATOM 16898 H2 SOL 598 41.160 13.250 78.680 1.00 0.00 ATOM 16899 OH2 SOL 599 22.630 16.050 61.510 1.00 0.00 ATOM 16900 H1 SOL 599 21.960 16.130 62.190 1.00 0.00 ATOM 16901 H2 SOL 599 23.060 15.210 61.690 1.00 0.00 ATOM 16902 OH2 SOL 600 7.110 60.710 16.560 1.00 0.00 ATOM 16903 H1 SOL 600 6.550 60.550 15.800 1.00 0.00 ATOM 16904 H2 SOL 600 7.910 60.230 16.370 1.00 0.00 ATOM 16905 OH2 SOL 601 10.180 52.000 3.900 1.00 0.00 ATOM 16906 H1 SOL 601 9.560 52.660 3.590 1.00 0.00 ATOM 16907 H2 SOL 601 9.660 51.450 4.490 1.00 0.00 ATOM 16908 OH2 SOL 602 37.780 24.670 78.030 1.00 0.00 ATOM 16909 H1 SOL 602 38.620 24.290 77.770 1.00 0.00 ATOM 16910 H2 SOL 602 38.020 25.350 78.660 1.00 0.00 ATOM 16911 OH2 SOL 603 19.950 39.220 15.330 1.00 0.00 ATOM 16912 H1 SOL 603 19.270 38.540 15.280 1.00 0.00 ATOM 16913 H2 SOL 603 20.600 38.870 15.940 1.00 0.00 ATOM 16914 OH2 SOL 604 33.500 40.450 78.820 1.00 0.00 ATOM 16915 H1 SOL 604 33.970 41.210 79.160 1.00 0.00 ATOM 16916 H2 SOL 604 32.640 40.500 79.230 1.00 0.00 ATOM 16917 OH2 SOL 605 0.540 31.220 5.620 1.00 0.00 ATOM 16918 H1 SOL 605 0.360 30.460 6.170 1.00 0.00 ATOM 16919 H2 SOL 605 0.420 30.910 4.730 1.00 0.00 ATOM 16920 OH2 SOL 606 35.740 6.760 61.110 1.00 0.00 ATOM 16921 H1 SOL 606 34.850 6.960 61.400 1.00 0.00 ATOM 16922 H2 SOL 606 35.650 6.560 60.180 1.00 0.00 ATOM 16923 OH2 SOL 607 21.540 15.330 21.660 1.00 0.00 ATOM 16924 H1 SOL 607 22.490 15.430 21.630 1.00 0.00 ATOM 16925 H2 SOL 607 21.400 14.630 22.310 1.00 0.00 ATOM 16926 OH2 SOL 608 33.360 5.230 65.840 1.00 0.00 ATOM 16927 H1 SOL 608 33.170 5.800 66.590 1.00 0.00 ATOM 16928 H2 SOL 608 33.580 4.380 66.230 1.00 0.00 ATOM 16929 OH2 SOL 609 27.780 48.610 7.940 1.00 0.00 ATOM 16930 H1 SOL 609 26.820 48.630 7.920 1.00 0.00 ATOM 16931 H2 SOL 609 28.040 49.500 7.710 1.00 0.00 ATOM 16932 OH2 SOL 610 19.130 24.760 70.140 1.00 0.00 ATOM 16933 H1 SOL 610 18.220 24.590 69.890 1.00 0.00 ATOM 16934 H2 SOL 610 19.620 24.030 69.760 1.00 0.00 ATOM 16935 OH2 SOL 611 15.390 53.250 65.970 1.00 0.00 ATOM 16936 H1 SOL 611 15.700 52.920 66.810 1.00 0.00 ATOM 16937 H2 SOL 611 16.180 53.620 65.550 1.00 0.00 ATOM 16938 OH2 SOL 612 13.040 37.120 3.860 1.00 0.00 ATOM 16939 H1 SOL 612 13.970 37.080 3.640 1.00 0.00 ATOM 16940 H2 SOL 612 12.610 37.470 3.080 1.00 0.00 ATOM 16941 OH2 SOL 613 34.080 18.190 11.340 1.00 0.00 ATOM 16942 H1 SOL 613 33.670 19.050 11.290 1.00 0.00 ATOM 16943 H2 SOL 613 34.170 17.920 10.420 1.00 0.00 ATOM 16944 OH2 SOL 614 47.450 25.200 0.560 1.00 0.00 ATOM 16945 H1 SOL 614 47.260 26.130 0.510 1.00 0.00 ATOM 16946 H2 SOL 614 48.370 25.150 0.790 1.00 0.00 ATOM 16947 OH2 SOL 615 52.220 22.760 67.400 1.00 0.00 ATOM 16948 H1 SOL 615 51.650 23.350 66.910 1.00 0.00 ATOM 16949 H2 SOL 615 51.680 21.990 67.580 1.00 0.00 ATOM 16950 OH2 SOL 616 3.060 18.850 29.920 1.00 0.00 ATOM 16951 H1 SOL 616 2.900 18.450 29.070 1.00 0.00 ATOM 16952 H2 SOL 616 2.180 19.040 30.260 1.00 0.00 ATOM 16953 OH2 SOL 617 2.100 49.730 6.250 1.00 0.00 ATOM 16954 H1 SOL 617 1.350 49.690 6.850 1.00 0.00 ATOM 16955 H2 SOL 617 1.940 50.510 5.730 1.00 0.00 ATOM 16956 OH2 SOL 618 29.870 29.450 72.770 1.00 0.00 ATOM 16957 H1 SOL 618 29.870 30.220 73.330 1.00 0.00 ATOM 16958 H2 SOL 618 30.790 29.230 72.650 1.00 0.00 ATOM 16959 OH2 SOL 619 25.510 5.450 63.850 1.00 0.00 ATOM 16960 H1 SOL 619 24.570 5.240 63.860 1.00 0.00 ATOM 16961 H2 SOL 619 25.700 5.700 64.760 1.00 0.00 ATOM 16962 OH2 SOL 620 22.670 13.160 71.910 1.00 0.00 ATOM 16963 H1 SOL 620 22.400 13.200 70.990 1.00 0.00 ATOM 16964 H2 SOL 620 22.240 12.380 72.250 1.00 0.00 ATOM 16965 OH2 SOL 621 24.200 56.480 2.300 1.00 0.00 ATOM 16966 H1 SOL 621 24.790 57.050 2.790 1.00 0.00 ATOM 16967 H2 SOL 621 23.330 56.700 2.630 1.00 0.00 ATOM 16968 OH2 SOL 622 44.140 5.700 84.880 1.00 0.00 ATOM 16969 H1 SOL 622 44.310 6.390 84.230 1.00 0.00 ATOM 16970 H2 SOL 622 44.980 5.250 84.980 1.00 0.00 ATOM 16971 OH2 SOL 623 20.260 7.130 13.080 1.00 0.00 ATOM 16972 H1 SOL 623 20.990 7.000 13.680 1.00 0.00 ATOM 16973 H2 SOL 623 19.980 8.030 13.220 1.00 0.00 ATOM 16974 OH2 SOL 624 5.250 50.280 61.410 1.00 0.00 ATOM 16975 H1 SOL 624 5.570 50.940 60.790 1.00 0.00 ATOM 16976 H2 SOL 624 6.000 50.130 62.000 1.00 0.00 ATOM 16977 OH2 SOL 625 49.400 3.600 8.880 1.00 0.00 ATOM 16978 H1 SOL 625 49.040 2.940 8.290 1.00 0.00 ATOM 16979 H2 SOL 625 49.780 4.260 8.310 1.00 0.00 ATOM 16980 OH2 SOL 626 23.710 19.000 1.460 1.00 0.00 ATOM 16981 H1 SOL 626 23.840 19.910 1.220 1.00 0.00 ATOM 16982 H2 SOL 626 23.600 18.530 0.630 1.00 0.00 ATOM 16983 OH2 SOL 627 49.690 59.580 76.180 1.00 0.00 ATOM 16984 H1 SOL 627 50.000 60.450 75.930 1.00 0.00 ATOM 16985 H2 SOL 627 49.590 59.110 75.350 1.00 0.00 ATOM 16986 OH2 SOL 628 15.730 36.230 74.850 1.00 0.00 ATOM 16987 H1 SOL 628 15.850 35.280 74.890 1.00 0.00 ATOM 16988 H2 SOL 628 14.940 36.350 74.320 1.00 0.00 ATOM 16989 OH2 SOL 629 57.760 14.550 2.410 1.00 0.00 ATOM 16990 H1 SOL 629 58.170 14.800 3.240 1.00 0.00 ATOM 16991 H2 SOL 629 56.820 14.560 2.600 1.00 0.00 ATOM 16992 OH2 SOL 630 35.500 19.330 67.800 1.00 0.00 ATOM 16993 H1 SOL 630 34.820 19.370 68.480 1.00 0.00 ATOM 16994 H2 SOL 630 35.150 19.850 67.080 1.00 0.00 ATOM 16995 OH2 SOL 631 7.930 0.220 20.820 1.00 0.00 ATOM 16996 H1 SOL 631 7.080 0.170 21.260 1.00 0.00 ATOM 16997 H2 SOL 631 8.000 1.150 20.570 1.00 0.00 ATOM 16998 OH2 SOL 632 25.010 0.910 71.370 1.00 0.00 ATOM 16999 H1 SOL 632 25.940 0.710 71.410 1.00 0.00 ATOM 17000 H2 SOL 632 24.620 0.370 72.050 1.00 0.00 ATOM 17001 OH2 SOL 633 53.420 49.250 70.940 1.00 0.00 ATOM 17002 H1 SOL 633 53.160 50.140 70.700 1.00 0.00 ATOM 17003 H2 SOL 633 54.340 49.330 71.190 1.00 0.00 ATOM 17004 OH2 SOL 634 2.910 58.560 80.960 1.00 0.00 ATOM 17005 H1 SOL 634 3.410 58.020 81.580 1.00 0.00 ATOM 17006 H2 SOL 634 2.020 58.550 81.290 1.00 0.00 ATOM 17007 OH2 SOL 635 25.080 54.380 4.580 1.00 0.00 ATOM 17008 H1 SOL 635 24.170 54.640 4.420 1.00 0.00 ATOM 17009 H2 SOL 635 25.040 53.860 5.380 1.00 0.00 ATOM 17010 OH2 SOL 636 0.690 30.910 71.630 1.00 0.00 ATOM 17011 H1 SOL 636 0.180 31.620 72.010 1.00 0.00 ATOM 17012 H2 SOL 636 0.710 31.110 70.690 1.00 0.00 ATOM 17013 OH2 SOL 637 54.750 46.550 6.620 1.00 0.00 ATOM 17014 H1 SOL 637 55.600 46.110 6.550 1.00 0.00 ATOM 17015 H2 SOL 637 54.800 47.260 5.980 1.00 0.00 ATOM 17016 OH2 SOL 638 31.670 39.770 10.550 1.00 0.00 ATOM 17017 H1 SOL 638 31.460 40.710 10.490 1.00 0.00 ATOM 17018 H2 SOL 638 31.580 39.570 11.480 1.00 0.00 ATOM 17019 OH2 SOL 639 42.430 32.390 9.610 1.00 0.00 ATOM 17020 H1 SOL 639 42.960 32.690 8.860 1.00 0.00 ATOM 17021 H2 SOL 639 42.700 31.480 9.740 1.00 0.00 ATOM 17022 OH2 SOL 640 13.190 22.240 10.000 1.00 0.00 ATOM 17023 H1 SOL 640 14.120 22.320 10.180 1.00 0.00 ATOM 17024 H2 SOL 640 12.790 22.960 10.480 1.00 0.00 ATOM 17025 OH2 SOL 641 48.880 48.180 12.310 1.00 0.00 ATOM 17026 H1 SOL 641 49.790 47.940 12.520 1.00 0.00 ATOM 17027 H2 SOL 641 48.600 47.520 11.680 1.00 0.00 ATOM 17028 OH2 SOL 642 47.850 52.720 7.530 1.00 0.00 ATOM 17029 H1 SOL 642 48.490 52.080 7.860 1.00 0.00 ATOM 17030 H2 SOL 642 47.000 52.330 7.730 1.00 0.00 ATOM 17031 OH2 SOL 643 24.410 53.450 75.240 1.00 0.00 ATOM 17032 H1 SOL 643 24.040 52.660 74.830 1.00 0.00 ATOM 17033 H2 SOL 643 24.080 53.440 76.140 1.00 0.00 ATOM 17034 OH2 SOL 644 7.200 3.750 17.840 1.00 0.00 ATOM 17035 H1 SOL 644 6.260 3.680 18.000 1.00 0.00 ATOM 17036 H2 SOL 644 7.600 3.240 18.550 1.00 0.00 ATOM 17037 OH2 SOL 645 44.610 0.190 64.300 1.00 0.00 ATOM 17038 H1 SOL 645 44.840 0.840 63.630 1.00 0.00 ATOM 17039 H2 SOL 645 44.040 -0.420 63.850 1.00 0.00 ATOM 17040 OH2 SOL 646 38.530 37.970 70.920 1.00 0.00 ATOM 17041 H1 SOL 646 38.820 38.050 70.010 1.00 0.00 ATOM 17042 H2 SOL 646 39.310 38.130 71.440 1.00 0.00 ATOM 17043 OH2 SOL 647 44.420 12.760 14.510 1.00 0.00 ATOM 17044 H1 SOL 647 44.220 12.880 13.590 1.00 0.00 ATOM 17045 H2 SOL 647 43.570 12.790 14.950 1.00 0.00 ATOM 17046 OH2 SOL 648 38.450 7.810 2.420 1.00 0.00 ATOM 17047 H1 SOL 648 38.370 7.320 3.240 1.00 0.00 ATOM 17048 H2 SOL 648 39.300 8.240 2.480 1.00 0.00 ATOM 17049 OH2 SOL 649 28.090 8.600 8.180 1.00 0.00 ATOM 17050 H1 SOL 649 29.020 8.700 7.960 1.00 0.00 ATOM 17051 H2 SOL 649 28.050 7.790 8.690 1.00 0.00 ATOM 17052 OH2 SOL 650 42.670 49.090 84.000 1.00 0.00 ATOM 17053 H1 SOL 650 43.290 48.940 84.710 1.00 0.00 ATOM 17054 H2 SOL 650 43.200 49.090 83.210 1.00 0.00 ATOM 17055 OH2 SOL 651 11.750 18.580 66.470 1.00 0.00 ATOM 17056 H1 SOL 651 12.610 18.370 66.100 1.00 0.00 ATOM 17057 H2 SOL 651 11.200 17.830 66.230 1.00 0.00 ATOM 17058 OH2 SOL 652 1.520 22.220 84.910 1.00 0.00 ATOM 17059 H1 SOL 652 1.040 21.630 84.340 1.00 0.00 ATOM 17060 H2 SOL 652 2.440 22.020 84.740 1.00 0.00 ATOM 17061 OH2 SOL 653 34.970 10.890 17.010 1.00 0.00 ATOM 17062 H1 SOL 653 35.780 11.140 16.560 1.00 0.00 ATOM 17063 H2 SOL 653 35.200 10.100 17.490 1.00 0.00 ATOM 17064 OH2 SOL 654 16.150 30.670 78.130 1.00 0.00 ATOM 17065 H1 SOL 654 16.660 30.060 77.610 1.00 0.00 ATOM 17066 H2 SOL 654 15.440 30.950 77.550 1.00 0.00 ATOM 17067 OH2 SOL 655 56.870 11.610 22.320 1.00 0.00 ATOM 17068 H1 SOL 655 56.460 12.140 23.000 1.00 0.00 ATOM 17069 H2 SOL 655 57.440 11.010 22.790 1.00 0.00 ATOM 17070 OH2 SOL 656 51.330 26.410 28.490 1.00 0.00 ATOM 17071 H1 SOL 656 52.150 26.910 28.440 1.00 0.00 ATOM 17072 H2 SOL 656 51.010 26.390 27.590 1.00 0.00 ATOM 17073 OH2 SOL 657 32.010 2.670 70.430 1.00 0.00 ATOM 17074 H1 SOL 657 31.320 3.000 71.010 1.00 0.00 ATOM 17075 H2 SOL 657 32.680 3.350 70.430 1.00 0.00 ATOM 17076 OH2 SOL 658 54.080 55.470 62.810 1.00 0.00 ATOM 17077 H1 SOL 658 53.380 55.250 62.200 1.00 0.00 ATOM 17078 H2 SOL 658 54.890 55.270 62.330 1.00 0.00 ATOM 17079 OH2 SOL 659 14.920 10.970 77.060 1.00 0.00 ATOM 17080 H1 SOL 659 14.550 10.090 77.090 1.00 0.00 ATOM 17081 H2 SOL 659 14.510 11.380 76.300 1.00 0.00 ATOM 17082 OH2 SOL 660 32.400 3.040 2.390 1.00 0.00 ATOM 17083 H1 SOL 660 32.240 3.090 3.330 1.00 0.00 ATOM 17084 H2 SOL 660 33.350 3.080 2.300 1.00 0.00 ATOM 17085 OH2 SOL 661 40.940 48.300 68.710 1.00 0.00 ATOM 17086 H1 SOL 661 41.360 47.580 68.240 1.00 0.00 ATOM 17087 H2 SOL 661 40.000 48.100 68.660 1.00 0.00 ATOM 17088 OH2 SOL 662 51.250 16.580 32.460 1.00 0.00 ATOM 17089 H1 SOL 662 51.800 15.790 32.520 1.00 0.00 ATOM 17090 H2 SOL 662 50.940 16.590 31.560 1.00 0.00 ATOM 17091 OH2 SOL 663 9.740 51.310 68.820 1.00 0.00 ATOM 17092 H1 SOL 663 9.480 50.890 68.000 1.00 0.00 ATOM 17093 H2 SOL 663 9.780 50.590 69.450 1.00 0.00 ATOM 17094 OH2 SOL 664 28.640 49.820 81.710 1.00 0.00 ATOM 17095 H1 SOL 664 29.270 49.250 82.140 1.00 0.00 ATOM 17096 H2 SOL 664 28.790 50.690 82.090 1.00 0.00 ATOM 17097 OH2 SOL 665 15.800 59.490 66.010 1.00 0.00 ATOM 17098 H1 SOL 665 15.030 59.590 66.560 1.00 0.00 ATOM 17099 H2 SOL 665 15.820 60.290 65.480 1.00 0.00 ATOM 17100 OH2 SOL 666 7.210 7.370 73.250 1.00 0.00 ATOM 17101 H1 SOL 666 7.380 8.310 73.290 1.00 0.00 ATOM 17102 H2 SOL 666 7.850 7.030 72.620 1.00 0.00 ATOM 17103 OH2 SOL 667 52.650 21.580 84.780 1.00 0.00 ATOM 17104 H1 SOL 667 53.000 20.730 85.050 1.00 0.00 ATOM 17105 H2 SOL 667 51.980 21.360 84.130 1.00 0.00 ATOM 17106 OH2 SOL 668 48.020 23.400 75.780 1.00 0.00 ATOM 17107 H1 SOL 668 47.260 22.810 75.710 1.00 0.00 ATOM 17108 H2 SOL 668 48.760 22.820 75.910 1.00 0.00 ATOM 17109 OH2 SOL 669 28.250 45.200 15.290 1.00 0.00 ATOM 17110 H1 SOL 669 27.780 44.840 14.540 1.00 0.00 ATOM 17111 H2 SOL 669 27.610 45.750 15.740 1.00 0.00 ATOM 17112 OH2 SOL 670 17.870 34.950 14.010 1.00 0.00 ATOM 17113 H1 SOL 670 18.600 35.350 13.550 1.00 0.00 ATOM 17114 H2 SOL 670 18.170 34.890 14.920 1.00 0.00 ATOM 17115 OH2 SOL 671 13.920 42.640 1.930 1.00 0.00 ATOM 17116 H1 SOL 671 13.820 41.690 1.950 1.00 0.00 ATOM 17117 H2 SOL 671 14.630 42.790 1.310 1.00 0.00 ATOM 17118 OH2 SOL 672 50.360 2.490 16.260 1.00 0.00 ATOM 17119 H1 SOL 672 50.090 2.260 17.150 1.00 0.00 ATOM 17120 H2 SOL 672 49.570 2.380 15.730 1.00 0.00 ATOM 17121 OH2 SOL 673 53.630 18.690 61.590 1.00 0.00 ATOM 17122 H1 SOL 673 53.320 17.820 61.330 1.00 0.00 ATOM 17123 H2 SOL 673 53.970 18.560 62.480 1.00 0.00 ATOM 17124 OH2 SOL 674 31.340 43.400 83.500 1.00 0.00 ATOM 17125 H1 SOL 674 30.870 43.800 84.240 1.00 0.00 ATOM 17126 H2 SOL 674 32.250 43.370 83.790 1.00 0.00 ATOM 17127 OH2 SOL 675 48.530 22.790 5.230 1.00 0.00 ATOM 17128 H1 SOL 675 48.560 23.560 4.650 1.00 0.00 ATOM 17129 H2 SOL 675 48.020 23.080 5.990 1.00 0.00 ATOM 17130 OH2 SOL 676 13.140 40.480 10.070 1.00 0.00 ATOM 17131 H1 SOL 676 12.940 41.370 9.770 1.00 0.00 ATOM 17132 H2 SOL 676 13.490 40.600 10.960 1.00 0.00 ATOM 17133 OH2 SOL 677 5.510 57.180 83.420 1.00 0.00 ATOM 17134 H1 SOL 677 5.870 57.300 84.300 1.00 0.00 ATOM 17135 H2 SOL 677 4.590 56.960 83.570 1.00 0.00 ATOM 17136 OH2 SOL 678 3.490 33.490 75.580 1.00 0.00 ATOM 17137 H1 SOL 678 3.390 34.440 75.540 1.00 0.00 ATOM 17138 H2 SOL 678 3.370 33.210 74.670 1.00 0.00 ATOM 17139 OH2 SOL 679 43.130 49.790 63.210 1.00 0.00 ATOM 17140 H1 SOL 679 43.160 49.030 62.620 1.00 0.00 ATOM 17141 H2 SOL 679 42.620 50.440 62.730 1.00 0.00 ATOM 17142 OH2 SOL 680 32.650 36.610 77.200 1.00 0.00 ATOM 17143 H1 SOL 680 33.080 36.800 78.030 1.00 0.00 ATOM 17144 H2 SOL 680 32.210 35.770 77.340 1.00 0.00 ATOM 17145 OH2 SOL 681 55.620 0.480 72.020 1.00 0.00 ATOM 17146 H1 SOL 681 56.140 0.790 71.290 1.00 0.00 ATOM 17147 H2 SOL 681 55.950 -0.400 72.200 1.00 0.00 ATOM 17148 OH2 SOL 682 58.890 30.230 67.390 1.00 0.00 ATOM 17149 H1 SOL 682 59.680 30.210 67.930 1.00 0.00 ATOM 17150 H2 SOL 682 58.910 31.080 66.960 1.00 0.00 ATOM 17151 OH2 SOL 683 30.170 55.370 14.130 1.00 0.00 ATOM 17152 H1 SOL 683 29.930 56.200 13.730 1.00 0.00 ATOM 17153 H2 SOL 683 29.990 55.490 15.060 1.00 0.00 ATOM 17154 OH2 SOL 684 27.060 40.280 22.860 1.00 0.00 ATOM 17155 H1 SOL 684 27.740 40.040 22.230 1.00 0.00 ATOM 17156 H2 SOL 684 27.000 39.530 23.450 1.00 0.00 ATOM 17157 OH2 SOL 685 54.650 17.170 30.890 1.00 0.00 ATOM 17158 H1 SOL 685 55.430 17.430 30.390 1.00 0.00 ATOM 17159 H2 SOL 685 54.660 16.220 30.880 1.00 0.00 ATOM 17160 OH2 SOL 686 14.300 34.910 9.740 1.00 0.00 ATOM 17161 H1 SOL 686 14.360 35.090 8.800 1.00 0.00 ATOM 17162 H2 SOL 686 13.560 34.300 9.810 1.00 0.00 ATOM 17163 OH2 SOL 687 59.710 23.250 16.440 1.00 0.00 ATOM 17164 H1 SOL 687 59.500 23.100 15.520 1.00 0.00 ATOM 17165 H2 SOL 687 58.950 22.940 16.920 1.00 0.00 ATOM 17166 OH2 SOL 688 34.960 40.270 76.480 1.00 0.00 ATOM 17167 H1 SOL 688 34.320 40.090 77.180 1.00 0.00 ATOM 17168 H2 SOL 688 35.380 39.420 76.330 1.00 0.00 ATOM 17169 OH2 SOL 689 56.720 45.240 5.230 1.00 0.00 ATOM 17170 H1 SOL 689 57.610 44.940 5.060 1.00 0.00 ATOM 17171 H2 SOL 689 56.560 45.910 4.570 1.00 0.00 ATOM 17172 OH2 SOL 690 43.280 59.770 17.480 1.00 0.00 ATOM 17173 H1 SOL 690 43.120 58.860 17.220 1.00 0.00 ATOM 17174 H2 SOL 690 42.650 59.930 18.180 1.00 0.00 ATOM 17175 OH2 SOL 691 35.380 23.050 76.400 1.00 0.00 ATOM 17176 H1 SOL 691 35.850 23.090 77.230 1.00 0.00 ATOM 17177 H2 SOL 691 36.050 23.130 75.730 1.00 0.00 ATOM 17178 OH2 SOL 692 10.990 3.280 5.920 1.00 0.00 ATOM 17179 H1 SOL 692 11.340 3.900 6.560 1.00 0.00 ATOM 17180 H2 SOL 692 10.510 2.640 6.440 1.00 0.00 ATOM 17181 OH2 SOL 693 5.090 1.870 79.840 1.00 0.00 ATOM 17182 H1 SOL 693 5.700 2.590 79.680 1.00 0.00 ATOM 17183 H2 SOL 693 4.480 2.210 80.500 1.00 0.00 ATOM 17184 OH2 SOL 694 52.750 5.680 79.150 1.00 0.00 ATOM 17185 H1 SOL 694 52.210 5.550 78.370 1.00 0.00 ATOM 17186 H2 SOL 694 53.150 4.830 79.300 1.00 0.00 ATOM 17187 OH2 SOL 695 4.170 4.060 67.890 1.00 0.00 ATOM 17188 H1 SOL 695 3.590 4.790 67.670 1.00 0.00 ATOM 17189 H2 SOL 695 5.020 4.460 68.050 1.00 0.00 ATOM 17190 OH2 SOL 696 59.200 37.360 13.040 1.00 0.00 ATOM 17191 H1 SOL 696 58.560 37.070 12.390 1.00 0.00 ATOM 17192 H2 SOL 696 58.690 37.860 13.680 1.00 0.00 ATOM 17193 OH2 SOL 697 38.630 51.230 8.850 1.00 0.00 ATOM 17194 H1 SOL 697 38.940 50.390 8.520 1.00 0.00 ATOM 17195 H2 SOL 697 39.110 51.360 9.670 1.00 0.00 ATOM 17196 OH2 SOL 698 17.180 10.160 7.870 1.00 0.00 ATOM 17197 H1 SOL 698 17.540 9.940 8.730 1.00 0.00 ATOM 17198 H2 SOL 698 17.450 9.430 7.310 1.00 0.00 ATOM 17199 OH2 SOL 699 7.490 29.080 6.250 1.00 0.00 ATOM 17200 H1 SOL 699 7.710 28.460 5.560 1.00 0.00 ATOM 17201 H2 SOL 699 6.930 29.730 5.830 1.00 0.00 ATOM 17202 OH2 SOL 700 48.910 59.370 78.820 1.00 0.00 ATOM 17203 H1 SOL 700 49.250 59.570 77.950 1.00 0.00 ATOM 17204 H2 SOL 700 49.690 59.200 79.350 1.00 0.00 ATOM 17205 OH2 SOL 701 56.590 8.840 70.850 1.00 0.00 ATOM 17206 H1 SOL 701 55.980 9.000 70.130 1.00 0.00 ATOM 17207 H2 SOL 701 57.370 9.340 70.620 1.00 0.00 ATOM 17208 OH2 SOL 702 50.540 52.260 65.340 1.00 0.00 ATOM 17209 H1 SOL 702 50.680 51.740 64.550 1.00 0.00 ATOM 17210 H2 SOL 702 49.920 52.930 65.070 1.00 0.00 ATOM 17211 OH2 SOL 703 26.800 36.420 3.070 1.00 0.00 ATOM 17212 H1 SOL 703 26.060 35.850 2.880 1.00 0.00 ATOM 17213 H2 SOL 703 27.100 36.140 3.940 1.00 0.00 ATOM 17214 OH2 SOL 704 46.130 56.530 76.540 1.00 0.00 ATOM 17215 H1 SOL 704 45.260 56.680 76.170 1.00 0.00 ATOM 17216 H2 SOL 704 45.960 56.120 77.390 1.00 0.00 ATOM 17217 OH2 SOL 705 4.610 10.500 69.350 1.00 0.00 ATOM 17218 H1 SOL 705 4.910 11.410 69.420 1.00 0.00 ATOM 17219 H2 SOL 705 5.410 9.980 69.370 1.00 0.00 ATOM 17220 OH2 SOL 706 21.040 26.910 12.990 1.00 0.00 ATOM 17221 H1 SOL 706 21.550 26.110 12.890 1.00 0.00 ATOM 17222 H2 SOL 706 21.690 27.600 13.080 1.00 0.00 ATOM 17223 OH2 SOL 707 43.890 43.330 78.350 1.00 0.00 ATOM 17224 H1 SOL 707 44.390 44.030 77.920 1.00 0.00 ATOM 17225 H2 SOL 707 44.390 42.530 78.160 1.00 0.00 ATOM 17226 OH2 SOL 708 18.680 34.470 81.270 1.00 0.00 ATOM 17227 H1 SOL 708 19.600 34.280 81.090 1.00 0.00 ATOM 17228 H2 SOL 708 18.700 35.230 81.850 1.00 0.00 ATOM 17229 OH2 SOL 709 37.250 38.840 23.650 1.00 0.00 ATOM 17230 H1 SOL 709 37.390 39.360 24.440 1.00 0.00 ATOM 17231 H2 SOL 709 37.950 39.110 23.060 1.00 0.00 ATOM 17232 OH2 SOL 710 13.270 15.740 28.290 1.00 0.00 ATOM 17233 H1 SOL 710 13.720 16.090 27.530 1.00 0.00 ATOM 17234 H2 SOL 710 12.370 16.070 28.210 1.00 0.00 ATOM 17235 OH2 SOL 711 34.680 44.390 76.610 1.00 0.00 ATOM 17236 H1 SOL 711 34.950 43.660 77.170 1.00 0.00 ATOM 17237 H2 SOL 711 34.200 43.970 75.890 1.00 0.00 ATOM 17238 OH2 SOL 712 49.080 40.660 9.910 1.00 0.00 ATOM 17239 H1 SOL 712 49.160 40.860 10.840 1.00 0.00 ATOM 17240 H2 SOL 712 49.690 39.940 9.770 1.00 0.00 ATOM 17241 OH2 SOL 713 5.540 31.420 75.870 1.00 0.00 ATOM 17242 H1 SOL 713 5.280 30.840 76.590 1.00 0.00 ATOM 17243 H2 SOL 713 4.970 32.180 75.950 1.00 0.00 ATOM 17244 OH2 SOL 714 32.600 55.370 10.360 1.00 0.00 ATOM 17245 H1 SOL 714 32.760 55.700 11.240 1.00 0.00 ATOM 17246 H2 SOL 714 31.940 54.680 10.480 1.00 0.00 ATOM 17247 OH2 SOL 715 5.570 25.890 71.450 1.00 0.00 ATOM 17248 H1 SOL 715 5.690 26.230 70.560 1.00 0.00 ATOM 17249 H2 SOL 715 6.460 25.790 71.790 1.00 0.00 ATOM 17250 OH2 SOL 716 15.220 21.260 79.060 1.00 0.00 ATOM 17251 H1 SOL 716 15.400 21.340 78.120 1.00 0.00 ATOM 17252 H2 SOL 716 16.060 21.460 79.480 1.00 0.00 ATOM 17253 OH2 SOL 717 13.100 47.830 74.780 1.00 0.00 ATOM 17254 H1 SOL 717 13.540 48.630 75.060 1.00 0.00 ATOM 17255 H2 SOL 717 13.770 47.150 74.860 1.00 0.00 ATOM 17256 OH2 SOL 718 12.090 1.820 76.310 1.00 0.00 ATOM 17257 H1 SOL 718 12.810 1.270 76.610 1.00 0.00 ATOM 17258 H2 SOL 718 11.560 1.240 75.770 1.00 0.00 ATOM 17259 OH2 SOL 719 31.960 34.260 9.520 1.00 0.00 ATOM 17260 H1 SOL 719 32.130 33.430 9.080 1.00 0.00 ATOM 17261 H2 SOL 719 31.400 34.030 10.260 1.00 0.00 ATOM 17262 OH2 SOL 720 2.880 39.510 17.550 1.00 0.00 ATOM 17263 H1 SOL 720 1.960 39.780 17.580 1.00 0.00 ATOM 17264 H2 SOL 720 2.950 38.980 16.760 1.00 0.00 ATOM 17265 OH2 SOL 721 9.640 8.030 76.260 1.00 0.00 ATOM 17266 H1 SOL 721 9.410 7.290 76.820 1.00 0.00 ATOM 17267 H2 SOL 721 8.800 8.450 76.080 1.00 0.00 ATOM 17268 OH2 SOL 722 55.950 12.230 12.070 1.00 0.00 ATOM 17269 H1 SOL 722 56.610 11.840 12.650 1.00 0.00 ATOM 17270 H2 SOL 722 55.430 11.480 11.770 1.00 0.00 ATOM 17271 OH2 SOL 723 42.670 13.720 64.560 1.00 0.00 ATOM 17272 H1 SOL 723 43.020 13.550 65.430 1.00 0.00 ATOM 17273 H2 SOL 723 41.970 13.090 64.440 1.00 0.00 ATOM 17274 OH2 SOL 724 43.740 19.470 12.060 1.00 0.00 ATOM 17275 H1 SOL 724 43.220 19.310 12.850 1.00 0.00 ATOM 17276 H2 SOL 724 43.630 20.410 11.900 1.00 0.00 ATOM 17277 OH2 SOL 725 23.450 2.710 21.910 1.00 0.00 ATOM 17278 H1 SOL 725 23.250 1.940 22.440 1.00 0.00 ATOM 17279 H2 SOL 725 24.350 2.570 21.600 1.00 0.00 ATOM 17280 OH2 SOL 726 38.340 54.840 67.470 1.00 0.00 ATOM 17281 H1 SOL 726 38.570 55.710 67.140 1.00 0.00 ATOM 17282 H2 SOL 726 37.390 54.810 67.460 1.00 0.00 ATOM 17283 OH2 SOL 727 48.580 13.360 15.980 1.00 0.00 ATOM 17284 H1 SOL 727 48.930 13.290 15.090 1.00 0.00 ATOM 17285 H2 SOL 727 47.810 12.790 15.970 1.00 0.00 ATOM 17286 OH2 SOL 728 43.470 27.640 79.730 1.00 0.00 ATOM 17287 H1 SOL 728 43.270 27.600 80.660 1.00 0.00 ATOM 17288 H2 SOL 728 42.800 27.100 79.310 1.00 0.00 ATOM 17289 OH2 SOL 729 45.190 42.740 3.910 1.00 0.00 ATOM 17290 H1 SOL 729 44.280 42.570 4.150 1.00 0.00 ATOM 17291 H2 SOL 729 45.380 42.120 3.200 1.00 0.00 ATOM 17292 OH2 SOL 730 21.280 47.790 73.510 1.00 0.00 ATOM 17293 H1 SOL 730 22.000 48.420 73.550 1.00 0.00 ATOM 17294 H2 SOL 730 20.490 48.310 73.640 1.00 0.00 ATOM 17295 OH2 SOL 731 18.160 40.640 71.350 1.00 0.00 ATOM 17296 H1 SOL 731 18.280 39.820 70.860 1.00 0.00 ATOM 17297 H2 SOL 731 19.050 40.970 71.480 1.00 0.00 ATOM 17298 OH2 SOL 732 2.860 40.360 71.690 1.00 0.00 ATOM 17299 H1 SOL 732 3.100 40.400 70.760 1.00 0.00 ATOM 17300 H2 SOL 732 2.250 41.080 71.800 1.00 0.00 ATOM 17301 OH2 SOL 733 40.990 15.000 67.900 1.00 0.00 ATOM 17302 H1 SOL 733 41.600 14.700 68.570 1.00 0.00 ATOM 17303 H2 SOL 733 41.010 14.310 67.240 1.00 0.00 ATOM 17304 OH2 SOL 734 57.710 41.530 16.880 1.00 0.00 ATOM 17305 H1 SOL 734 57.250 40.950 17.480 1.00 0.00 ATOM 17306 H2 SOL 734 57.230 42.360 16.930 1.00 0.00 ATOM 17307 OH2 SOL 735 57.720 1.740 70.740 1.00 0.00 ATOM 17308 H1 SOL 735 58.410 1.620 70.090 1.00 0.00 ATOM 17309 H2 SOL 735 58.110 2.330 71.390 1.00 0.00 ATOM 17310 OH2 SOL 736 29.070 8.500 78.440 1.00 0.00 ATOM 17311 H1 SOL 736 29.270 9.410 78.680 1.00 0.00 ATOM 17312 H2 SOL 736 29.880 8.020 78.610 1.00 0.00 ATOM 17313 OH2 SOL 737 52.600 9.570 0.270 1.00 0.00 ATOM 17314 H1 SOL 737 52.620 9.270 1.170 1.00 0.00 ATOM 17315 H2 SOL 737 52.840 10.500 0.320 1.00 0.00 ATOM 17316 OH2 SOL 738 26.600 14.020 64.960 1.00 0.00 ATOM 17317 H1 SOL 738 27.400 14.040 64.440 1.00 0.00 ATOM 17318 H2 SOL 738 25.970 13.540 64.420 1.00 0.00 ATOM 17319 OH2 SOL 739 13.900 36.800 77.990 1.00 0.00 ATOM 17320 H1 SOL 739 13.350 36.130 77.580 1.00 0.00 ATOM 17321 H2 SOL 739 13.500 37.630 77.710 1.00 0.00 ATOM 17322 OH2 SOL 740 37.690 36.910 2.860 1.00 0.00 ATOM 17323 H1 SOL 740 37.390 37.690 3.330 1.00 0.00 ATOM 17324 H2 SOL 740 38.290 36.480 3.480 1.00 0.00 ATOM 17325 OH2 SOL 741 10.940 26.210 75.490 1.00 0.00 ATOM 17326 H1 SOL 741 11.140 26.710 76.270 1.00 0.00 ATOM 17327 H2 SOL 741 11.450 25.400 75.580 1.00 0.00 ATOM 17328 OH2 SOL 742 27.780 1.650 72.310 1.00 0.00 ATOM 17329 H1 SOL 742 27.340 2.490 72.180 1.00 0.00 ATOM 17330 H2 SOL 742 28.520 1.660 71.700 1.00 0.00 ATOM 17331 OH2 SOL 743 8.240 21.950 7.240 1.00 0.00 ATOM 17332 H1 SOL 743 7.360 22.010 7.620 1.00 0.00 ATOM 17333 H2 SOL 743 8.090 21.750 6.310 1.00 0.00 ATOM 17334 OH2 SOL 744 27.280 6.460 84.770 1.00 0.00 ATOM 17335 H1 SOL 744 27.840 5.790 84.380 1.00 0.00 ATOM 17336 H2 SOL 744 26.400 6.250 84.460 1.00 0.00 ATOM 17337 OH2 SOL 745 9.270 59.250 16.570 1.00 0.00 ATOM 17338 H1 SOL 745 10.000 59.820 16.330 1.00 0.00 ATOM 17339 H2 SOL 745 9.660 58.590 17.150 1.00 0.00 ATOM 17340 OH2 SOL 746 1.850 13.790 3.250 1.00 0.00 ATOM 17341 H1 SOL 746 1.150 13.380 3.750 1.00 0.00 ATOM 17342 H2 SOL 746 1.760 13.420 2.370 1.00 0.00 ATOM 17343 OH2 SOL 747 35.640 56.700 69.740 1.00 0.00 ATOM 17344 H1 SOL 747 35.140 56.940 70.520 1.00 0.00 ATOM 17345 H2 SOL 747 35.680 55.740 69.760 1.00 0.00 ATOM 17346 OH2 SOL 748 14.260 60.570 76.300 1.00 0.00 ATOM 17347 H1 SOL 748 14.380 59.950 75.580 1.00 0.00 ATOM 17348 H2 SOL 748 14.780 60.190 77.020 1.00 0.00 ATOM 17349 OH2 SOL 749 40.140 51.390 77.010 1.00 0.00 ATOM 17350 H1 SOL 749 40.380 50.490 76.830 1.00 0.00 ATOM 17351 H2 SOL 749 39.280 51.340 77.420 1.00 0.00 ATOM 17352 OH2 SOL 750 32.080 35.860 1.990 1.00 0.00 ATOM 17353 H1 SOL 750 32.670 36.390 2.520 1.00 0.00 ATOM 17354 H2 SOL 750 31.630 35.290 2.620 1.00 0.00 ATOM 17355 OH2 SOL 751 58.160 29.210 79.610 1.00 0.00 ATOM 17356 H1 SOL 751 57.760 28.390 79.310 1.00 0.00 ATOM 17357 H2 SOL 751 58.600 28.980 80.420 1.00 0.00 ATOM 17358 OH2 SOL 752 4.260 18.980 83.130 1.00 0.00 ATOM 17359 H1 SOL 752 3.640 18.270 82.980 1.00 0.00 ATOM 17360 H2 SOL 752 5.080 18.540 83.370 1.00 0.00 ATOM 17361 OH2 SOL 753 0.010 19.940 75.380 1.00 0.00 ATOM 17362 H1 SOL 753 -0.680 20.550 75.110 1.00 0.00 ATOM 17363 H2 SOL 753 0.780 20.220 74.870 1.00 0.00 ATOM 17364 OH2 SOL 754 22.500 55.160 18.930 1.00 0.00 ATOM 17365 H1 SOL 754 22.080 54.300 18.920 1.00 0.00 ATOM 17366 H2 SOL 754 23.300 55.040 19.430 1.00 0.00 ATOM 17367 OH2 SOL 755 41.130 19.510 84.360 1.00 0.00 ATOM 17368 H1 SOL 755 42.000 19.500 84.750 1.00 0.00 ATOM 17369 H2 SOL 755 40.840 18.600 84.390 1.00 0.00 ATOM 17370 OH2 SOL 756 16.180 22.860 74.330 1.00 0.00 ATOM 17371 H1 SOL 756 15.690 22.740 75.150 1.00 0.00 ATOM 17372 H2 SOL 756 16.640 23.690 74.450 1.00 0.00 ATOM 17373 OH2 SOL 757 12.130 52.190 11.040 1.00 0.00 ATOM 17374 H1 SOL 757 11.580 51.470 10.710 1.00 0.00 ATOM 17375 H2 SOL 757 11.990 52.900 10.420 1.00 0.00 ATOM 17376 OH2 SOL 758 17.300 26.110 73.660 1.00 0.00 ATOM 17377 H1 SOL 758 17.880 25.440 74.020 1.00 0.00 ATOM 17378 H2 SOL 758 17.730 26.940 73.880 1.00 0.00 ATOM 17379 OH2 SOL 759 4.450 29.860 66.820 1.00 0.00 ATOM 17380 H1 SOL 759 5.370 30.120 66.750 1.00 0.00 ATOM 17381 H2 SOL 759 4.420 29.320 67.610 1.00 0.00 ATOM 17382 OH2 SOL 760 11.120 16.330 83.560 1.00 0.00 ATOM 17383 H1 SOL 760 11.720 15.590 83.650 1.00 0.00 ATOM 17384 H2 SOL 760 11.230 16.820 84.370 1.00 0.00 ATOM 17385 OH2 SOL 761 50.350 9.400 16.750 1.00 0.00 ATOM 17386 H1 SOL 761 50.780 9.450 15.900 1.00 0.00 ATOM 17387 H2 SOL 761 49.410 9.390 16.550 1.00 0.00 ATOM 17388 OH2 SOL 762 22.890 60.170 81.060 1.00 0.00 ATOM 17389 H1 SOL 762 22.350 59.620 80.490 1.00 0.00 ATOM 17390 H2 SOL 762 23.550 59.580 81.420 1.00 0.00 ATOM 17391 OH2 SOL 763 52.350 32.030 72.590 1.00 0.00 ATOM 17392 H1 SOL 763 53.150 32.150 72.080 1.00 0.00 ATOM 17393 H2 SOL 763 52.630 32.080 73.500 1.00 0.00 ATOM 17394 OH2 SOL 764 43.990 32.320 3.690 1.00 0.00 ATOM 17395 H1 SOL 764 44.710 32.840 3.350 1.00 0.00 ATOM 17396 H2 SOL 764 43.270 32.460 3.070 1.00 0.00 ATOM 17397 OH2 SOL 765 23.000 48.680 15.460 1.00 0.00 ATOM 17398 H1 SOL 765 23.320 48.130 14.740 1.00 0.00 ATOM 17399 H2 SOL 765 22.660 48.060 16.100 1.00 0.00 ATOM 17400 OH2 SOL 766 46.840 6.180 65.580 1.00 0.00 ATOM 17401 H1 SOL 766 46.490 6.770 64.920 1.00 0.00 ATOM 17402 H2 SOL 766 46.560 5.310 65.290 1.00 0.00 ATOM 17403 OH2 SOL 767 30.670 58.490 61.730 1.00 0.00 ATOM 17404 H1 SOL 767 30.060 58.990 62.280 1.00 0.00 ATOM 17405 H2 SOL 767 30.130 57.780 61.380 1.00 0.00 ATOM 17406 OH2 SOL 768 41.100 34.180 78.050 1.00 0.00 ATOM 17407 H1 SOL 768 41.680 33.690 77.470 1.00 0.00 ATOM 17408 H2 SOL 768 41.580 34.990 78.240 1.00 0.00 ATOM 17409 OH2 SOL 769 45.680 2.070 10.660 1.00 0.00 ATOM 17410 H1 SOL 769 44.820 1.820 10.330 1.00 0.00 ATOM 17411 H2 SOL 769 45.820 2.950 10.300 1.00 0.00 ATOM 17412 OH2 SOL 770 55.190 27.440 69.660 1.00 0.00 ATOM 17413 H1 SOL 770 54.860 27.700 70.520 1.00 0.00 ATOM 17414 H2 SOL 770 55.830 28.110 69.440 1.00 0.00 ATOM 17415 OH2 SOL 771 2.240 9.660 0.840 1.00 0.00 ATOM 17416 H1 SOL 771 2.240 10.020 1.730 1.00 0.00 ATOM 17417 H2 SOL 771 2.120 10.430 0.280 1.00 0.00 ATOM 17418 OH2 SOL 772 26.600 8.370 18.120 1.00 0.00 ATOM 17419 H1 SOL 772 26.940 7.770 17.460 1.00 0.00 ATOM 17420 H2 SOL 772 27.370 8.800 18.480 1.00 0.00 ATOM 17421 OH2 SOL 773 17.350 53.810 70.540 1.00 0.00 ATOM 17422 H1 SOL 773 16.540 53.560 70.090 1.00 0.00 ATOM 17423 H2 SOL 773 17.390 54.760 70.430 1.00 0.00 ATOM 17424 OH2 SOL 774 34.590 8.680 12.900 1.00 0.00 ATOM 17425 H1 SOL 774 34.500 9.620 13.030 1.00 0.00 ATOM 17426 H2 SOL 774 35.450 8.470 13.250 1.00 0.00 ATOM 17427 OH2 SOL 775 3.050 6.410 71.960 1.00 0.00 ATOM 17428 H1 SOL 775 2.880 5.470 72.030 1.00 0.00 ATOM 17429 H2 SOL 775 3.040 6.580 71.020 1.00 0.00 ATOM 17430 OH2 SOL 776 12.630 56.050 65.700 1.00 0.00 ATOM 17431 H1 SOL 776 12.400 56.960 65.870 1.00 0.00 ATOM 17432 H2 SOL 776 13.000 56.060 64.810 1.00 0.00 ATOM 17433 OH2 SOL 777 34.520 23.510 58.360 1.00 0.00 ATOM 17434 H1 SOL 777 35.240 23.620 58.980 1.00 0.00 ATOM 17435 H2 SOL 777 34.020 24.320 58.420 1.00 0.00 ATOM 17436 OH2 SOL 778 55.660 26.340 84.480 1.00 0.00 ATOM 17437 H1 SOL 778 55.290 25.610 83.970 1.00 0.00 ATOM 17438 H2 SOL 778 55.600 26.050 85.390 1.00 0.00 ATOM 17439 OH2 SOL 779 28.020 37.130 72.570 1.00 0.00 ATOM 17440 H1 SOL 779 27.690 37.240 73.460 1.00 0.00 ATOM 17441 H2 SOL 779 27.990 36.190 72.410 1.00 0.00 ATOM 17442 OH2 SOL 780 21.800 48.140 6.180 1.00 0.00 ATOM 17443 H1 SOL 780 21.490 47.280 6.470 1.00 0.00 ATOM 17444 H2 SOL 780 21.070 48.730 6.350 1.00 0.00 ATOM 17445 OH2 SOL 781 38.780 14.670 59.810 1.00 0.00 ATOM 17446 H1 SOL 781 39.110 14.910 58.940 1.00 0.00 ATOM 17447 H2 SOL 781 37.860 14.450 59.650 1.00 0.00 ATOM 17448 OH2 SOL 782 29.170 33.600 75.860 1.00 0.00 ATOM 17449 H1 SOL 782 29.030 32.680 76.090 1.00 0.00 ATOM 17450 H2 SOL 782 28.530 33.770 75.160 1.00 0.00 ATOM 17451 OH2 SOL 783 12.510 47.480 6.730 1.00 0.00 ATOM 17452 H1 SOL 783 11.940 46.820 7.120 1.00 0.00 ATOM 17453 H2 SOL 783 12.790 47.090 5.900 1.00 0.00 ATOM 17454 OH2 SOL 784 45.140 26.860 9.720 1.00 0.00 ATOM 17455 H1 SOL 784 44.410 26.350 10.080 1.00 0.00 ATOM 17456 H2 SOL 784 45.130 27.680 10.200 1.00 0.00 ATOM 17457 OH2 SOL 785 56.360 31.170 18.180 1.00 0.00 ATOM 17458 H1 SOL 785 56.810 30.320 18.120 1.00 0.00 ATOM 17459 H2 SOL 785 57.050 31.820 18.100 1.00 0.00 ATOM 17460 OH2 SOL 786 50.020 21.100 84.210 1.00 0.00 ATOM 17461 H1 SOL 786 49.820 22.030 84.320 1.00 0.00 ATOM 17462 H2 SOL 786 49.340 20.640 84.700 1.00 0.00 ATOM 17463 OH2 SOL 787 7.850 26.040 21.240 1.00 0.00 ATOM 17464 H1 SOL 787 8.760 25.800 21.080 1.00 0.00 ATOM 17465 H2 SOL 787 7.870 26.960 21.460 1.00 0.00 ATOM 17466 OH2 SOL 788 42.350 56.990 7.770 1.00 0.00 ATOM 17467 H1 SOL 788 42.030 57.150 6.880 1.00 0.00 ATOM 17468 H2 SOL 788 43.230 56.640 7.650 1.00 0.00 ATOM 17469 OH2 SOL 789 18.460 6.590 4.040 1.00 0.00 ATOM 17470 H1 SOL 789 19.190 6.870 3.480 1.00 0.00 ATOM 17471 H2 SOL 789 18.750 5.760 4.410 1.00 0.00 ATOM 17472 OH2 SOL 790 25.120 6.680 11.200 1.00 0.00 ATOM 17473 H1 SOL 790 24.180 6.840 11.130 1.00 0.00 ATOM 17474 H2 SOL 790 25.340 6.170 10.410 1.00 0.00 ATOM 17475 OH2 SOL 791 19.900 23.650 2.600 1.00 0.00 ATOM 17476 H1 SOL 791 19.810 23.880 1.680 1.00 0.00 ATOM 17477 H2 SOL 791 19.830 22.700 2.620 1.00 0.00 ATOM 17478 OH2 SOL 792 13.950 1.990 6.030 1.00 0.00 ATOM 17479 H1 SOL 792 14.300 2.820 5.720 1.00 0.00 ATOM 17480 H2 SOL 792 13.050 1.980 5.720 1.00 0.00 ATOM 17481 OH2 SOL 793 50.950 27.230 13.470 1.00 0.00 ATOM 17482 H1 SOL 793 50.030 27.340 13.690 1.00 0.00 ATOM 17483 H2 SOL 793 51.410 27.880 14.000 1.00 0.00 ATOM 17484 OH2 SOL 794 29.550 14.110 63.570 1.00 0.00 ATOM 17485 H1 SOL 794 29.470 14.520 62.710 1.00 0.00 ATOM 17486 H2 SOL 794 29.230 13.220 63.440 1.00 0.00 ATOM 17487 OH2 SOL 795 22.500 34.210 68.430 1.00 0.00 ATOM 17488 H1 SOL 795 22.010 33.710 67.780 1.00 0.00 ATOM 17489 H2 SOL 795 23.290 33.700 68.590 1.00 0.00 ATOM 17490 OH2 SOL 796 40.400 7.690 26.470 1.00 0.00 ATOM 17491 H1 SOL 796 40.900 8.420 26.100 1.00 0.00 ATOM 17492 H2 SOL 796 39.770 8.110 27.060 1.00 0.00 ATOM 17493 OH2 SOL 797 52.560 9.940 81.420 1.00 0.00 ATOM 17494 H1 SOL 797 52.260 10.770 81.790 1.00 0.00 ATOM 17495 H2 SOL 797 53.250 10.190 80.810 1.00 0.00 ATOM 17496 OH2 SOL 798 31.740 51.390 75.330 1.00 0.00 ATOM 17497 H1 SOL 798 31.640 50.680 74.690 1.00 0.00 ATOM 17498 H2 SOL 798 31.050 51.230 75.980 1.00 0.00 ATOM 17499 OH2 SOL 799 46.800 56.740 80.240 1.00 0.00 ATOM 17500 H1 SOL 799 47.550 57.210 79.880 1.00 0.00 ATOM 17501 H2 SOL 799 46.730 55.940 79.710 1.00 0.00 ATOM 17502 OH2 SOL 800 41.770 53.220 84.230 1.00 0.00 ATOM 17503 H1 SOL 800 42.260 52.680 84.850 1.00 0.00 ATOM 17504 H2 SOL 800 41.520 52.610 83.530 1.00 0.00 ATOM 17505 OH2 SOL 801 46.460 44.910 68.870 1.00 0.00 ATOM 17506 H1 SOL 801 45.970 45.650 69.210 1.00 0.00 ATOM 17507 H2 SOL 801 45.920 44.560 68.160 1.00 0.00 ATOM 17508 OH2 SOL 802 32.050 16.090 22.420 1.00 0.00 ATOM 17509 H1 SOL 802 31.730 16.070 21.520 1.00 0.00 ATOM 17510 H2 SOL 802 31.350 16.520 22.910 1.00 0.00 ATOM 17511 OH2 SOL 803 22.000 47.280 65.100 1.00 0.00 ATOM 17512 H1 SOL 803 21.340 46.670 65.430 1.00 0.00 ATOM 17513 H2 SOL 803 21.500 47.990 64.700 1.00 0.00 ATOM 17514 OH2 SOL 804 45.470 48.850 61.310 1.00 0.00 ATOM 17515 H1 SOL 804 44.550 48.740 61.070 1.00 0.00 ATOM 17516 H2 SOL 804 45.670 49.760 61.100 1.00 0.00 ATOM 17517 OH2 SOL 805 30.780 56.350 83.380 1.00 0.00 ATOM 17518 H1 SOL 805 30.320 56.090 84.180 1.00 0.00 ATOM 17519 H2 SOL 805 31.490 55.720 83.290 1.00 0.00 ATOM 17520 OH2 SOL 806 7.070 48.610 8.990 1.00 0.00 ATOM 17521 H1 SOL 806 6.250 48.770 8.530 1.00 0.00 ATOM 17522 H2 SOL 806 6.890 48.870 9.890 1.00 0.00 ATOM 17523 OH2 SOL 807 18.390 45.440 79.490 1.00 0.00 ATOM 17524 H1 SOL 807 18.150 46.210 78.980 1.00 0.00 ATOM 17525 H2 SOL 807 19.340 45.370 79.380 1.00 0.00 ATOM 17526 OH2 SOL 808 55.610 36.350 13.010 1.00 0.00 ATOM 17527 H1 SOL 808 56.070 35.610 13.400 1.00 0.00 ATOM 17528 H2 SOL 808 56.180 36.650 12.300 1.00 0.00 ATOM 17529 OH2 SOL 809 38.490 11.230 5.970 1.00 0.00 ATOM 17530 H1 SOL 809 38.060 12.010 5.610 1.00 0.00 ATOM 17531 H2 SOL 809 38.900 11.530 6.780 1.00 0.00 ATOM 17532 OH2 SOL 810 36.410 35.690 11.040 1.00 0.00 ATOM 17533 H1 SOL 810 36.730 36.430 11.550 1.00 0.00 ATOM 17534 H2 SOL 810 35.480 35.870 10.910 1.00 0.00 ATOM 17535 OH2 SOL 811 13.800 55.970 70.770 1.00 0.00 ATOM 17536 H1 SOL 811 14.040 56.180 69.870 1.00 0.00 ATOM 17537 H2 SOL 811 12.860 56.160 70.820 1.00 0.00 ATOM 17538 OH2 SOL 812 12.770 44.690 6.620 1.00 0.00 ATOM 17539 H1 SOL 812 12.400 44.210 5.880 1.00 0.00 ATOM 17540 H2 SOL 812 13.660 44.920 6.340 1.00 0.00 ATOM 17541 OH2 SOL 813 23.650 32.840 74.190 1.00 0.00 ATOM 17542 H1 SOL 813 23.910 33.700 73.860 1.00 0.00 ATOM 17543 H2 SOL 813 24.220 32.220 73.720 1.00 0.00 ATOM 17544 OH2 SOL 814 6.330 15.180 66.210 1.00 0.00 ATOM 17545 H1 SOL 814 6.880 14.400 66.310 1.00 0.00 ATOM 17546 H2 SOL 814 6.800 15.720 65.580 1.00 0.00 ATOM 17547 OH2 SOL 815 21.780 38.740 13.170 1.00 0.00 ATOM 17548 H1 SOL 815 21.370 38.510 12.330 1.00 0.00 ATOM 17549 H2 SOL 815 21.060 38.730 13.800 1.00 0.00 ATOM 17550 OH2 SOL 816 34.180 58.340 80.500 1.00 0.00 ATOM 17551 H1 SOL 816 33.230 58.280 80.490 1.00 0.00 ATOM 17552 H2 SOL 816 34.390 58.930 79.770 1.00 0.00 ATOM 17553 OH2 SOL 817 47.920 22.090 81.400 1.00 0.00 ATOM 17554 H1 SOL 817 47.610 22.270 80.510 1.00 0.00 ATOM 17555 H2 SOL 817 47.650 22.860 81.910 1.00 0.00 ATOM 17556 OH2 SOL 818 56.680 30.560 5.260 1.00 0.00 ATOM 17557 H1 SOL 818 55.870 30.970 4.970 1.00 0.00 ATOM 17558 H2 SOL 818 56.450 30.160 6.100 1.00 0.00 ATOM 17559 OH2 SOL 819 19.840 20.280 69.990 1.00 0.00 ATOM 17560 H1 SOL 819 19.860 19.380 70.340 1.00 0.00 ATOM 17561 H2 SOL 819 19.220 20.740 70.540 1.00 0.00 ATOM 17562 OH2 SOL 820 16.300 56.070 18.350 1.00 0.00 ATOM 17563 H1 SOL 820 15.900 56.920 18.470 1.00 0.00 ATOM 17564 H2 SOL 820 17.060 56.080 18.930 1.00 0.00 ATOM 17565 OH2 SOL 821 10.670 42.880 14.860 1.00 0.00 ATOM 17566 H1 SOL 821 10.610 42.600 15.770 1.00 0.00 ATOM 17567 H2 SOL 821 10.320 42.150 14.360 1.00 0.00 ATOM 17568 OH2 SOL 822 46.700 51.910 79.380 1.00 0.00 ATOM 17569 H1 SOL 822 46.590 51.070 79.840 1.00 0.00 ATOM 17570 H2 SOL 822 47.060 51.670 78.530 1.00 0.00 ATOM 17571 OH2 SOL 823 48.470 13.310 10.460 1.00 0.00 ATOM 17572 H1 SOL 823 48.780 14.180 10.720 1.00 0.00 ATOM 17573 H2 SOL 823 48.990 13.090 9.690 1.00 0.00 ATOM 17574 OH2 SOL 824 22.830 33.470 1.420 1.00 0.00 ATOM 17575 H1 SOL 824 23.410 32.770 1.120 1.00 0.00 ATOM 17576 H2 SOL 824 23.210 33.770 2.240 1.00 0.00 ATOM 17577 OH2 SOL 825 30.610 32.510 73.700 1.00 0.00 ATOM 17578 H1 SOL 825 30.210 33.100 74.340 1.00 0.00 ATOM 17579 H2 SOL 825 31.360 32.130 74.150 1.00 0.00 ATOM 17580 OH2 SOL 826 30.610 43.350 69.770 1.00 0.00 ATOM 17581 H1 SOL 826 30.260 44.080 70.290 1.00 0.00 ATOM 17582 H2 SOL 826 31.060 43.780 69.040 1.00 0.00 ATOM 17583 OH2 SOL 827 0.860 23.060 80.490 1.00 0.00 ATOM 17584 H1 SOL 827 1.630 22.790 81.000 1.00 0.00 ATOM 17585 H2 SOL 827 1.100 23.930 80.160 1.00 0.00 ATOM 17586 OH2 SOL 828 5.020 6.470 79.900 1.00 0.00 ATOM 17587 H1 SOL 828 5.810 6.650 80.410 1.00 0.00 ATOM 17588 H2 SOL 828 4.570 5.790 80.390 1.00 0.00 ATOM 17589 OH2 SOL 829 29.160 52.240 76.900 1.00 0.00 ATOM 17590 H1 SOL 829 28.660 51.430 76.750 1.00 0.00 ATOM 17591 H2 SOL 829 28.620 52.920 76.510 1.00 0.00 ATOM 17592 OH2 SOL 830 58.190 44.270 78.000 1.00 0.00 ATOM 17593 H1 SOL 830 58.460 44.650 78.830 1.00 0.00 ATOM 17594 H2 SOL 830 57.480 44.840 77.700 1.00 0.00 ATOM 17595 OH2 SOL 831 9.440 19.140 7.230 1.00 0.00 ATOM 17596 H1 SOL 831 9.850 19.510 6.450 1.00 0.00 ATOM 17597 H2 SOL 831 9.730 19.700 7.950 1.00 0.00 ATOM 17598 OH2 SOL 832 18.410 14.480 22.850 1.00 0.00 ATOM 17599 H1 SOL 832 18.410 15.370 23.190 1.00 0.00 ATOM 17600 H2 SOL 832 19.290 14.150 23.040 1.00 0.00 ATOM 17601 OH2 SOL 833 29.540 50.850 12.070 1.00 0.00 ATOM 17602 H1 SOL 833 30.300 50.380 12.400 1.00 0.00 ATOM 17603 H2 SOL 833 29.470 51.630 12.630 1.00 0.00 ATOM 17604 OH2 SOL 834 33.300 8.430 77.870 1.00 0.00 ATOM 17605 H1 SOL 834 32.900 7.620 78.160 1.00 0.00 ATOM 17606 H2 SOL 834 32.870 8.640 77.050 1.00 0.00 ATOM 17607 OH2 SOL 835 8.180 23.700 63.150 1.00 0.00 ATOM 17608 H1 SOL 835 8.680 23.350 63.890 1.00 0.00 ATOM 17609 H2 SOL 835 8.840 23.900 62.490 1.00 0.00 ATOM 17610 OH2 SOL 836 40.420 33.580 13.520 1.00 0.00 ATOM 17611 H1 SOL 836 40.820 34.450 13.440 1.00 0.00 ATOM 17612 H2 SOL 836 40.390 33.260 12.620 1.00 0.00 ATOM 17613 OH2 SOL 837 18.020 36.570 73.240 1.00 0.00 ATOM 17614 H1 SOL 837 17.670 36.070 73.980 1.00 0.00 ATOM 17615 H2 SOL 837 18.250 37.420 73.610 1.00 0.00 ATOM 17616 OH2 SOL 838 6.770 53.950 8.980 1.00 0.00 ATOM 17617 H1 SOL 838 7.320 54.120 8.210 1.00 0.00 ATOM 17618 H2 SOL 838 6.350 53.110 8.790 1.00 0.00 ATOM 17619 OH2 SOL 839 49.180 49.340 3.150 1.00 0.00 ATOM 17620 H1 SOL 839 49.880 49.990 3.120 1.00 0.00 ATOM 17621 H2 SOL 839 48.950 49.280 4.080 1.00 0.00 ATOM 17622 OH2 SOL 840 43.500 9.660 13.480 1.00 0.00 ATOM 17623 H1 SOL 840 44.190 10.090 12.970 1.00 0.00 ATOM 17624 H2 SOL 840 43.820 9.660 14.380 1.00 0.00 ATOM 17625 OH2 SOL 841 29.400 43.740 78.330 1.00 0.00 ATOM 17626 H1 SOL 841 28.900 43.520 77.540 1.00 0.00 ATOM 17627 H2 SOL 841 29.700 42.900 78.670 1.00 0.00 ATOM 17628 OH2 SOL 842 38.620 53.500 70.240 1.00 0.00 ATOM 17629 H1 SOL 842 38.230 53.740 69.400 1.00 0.00 ATOM 17630 H2 SOL 842 39.490 53.900 70.230 1.00 0.00 ATOM 17631 OH2 SOL 843 17.310 57.240 84.540 1.00 0.00 ATOM 17632 H1 SOL 843 16.790 56.680 83.960 1.00 0.00 ATOM 17633 H2 SOL 843 17.740 57.860 83.960 1.00 0.00 ATOM 17634 OH2 SOL 844 36.680 29.340 18.910 1.00 0.00 ATOM 17635 H1 SOL 844 37.440 29.470 18.340 1.00 0.00 ATOM 17636 H2 SOL 844 36.220 28.590 18.540 1.00 0.00 ATOM 17637 OH2 SOL 845 23.940 44.870 79.090 1.00 0.00 ATOM 17638 H1 SOL 845 24.270 44.790 78.190 1.00 0.00 ATOM 17639 H2 SOL 845 24.560 45.460 79.510 1.00 0.00 ATOM 17640 OH2 SOL 846 41.110 15.970 20.660 1.00 0.00 ATOM 17641 H1 SOL 846 40.920 16.140 19.740 1.00 0.00 ATOM 17642 H2 SOL 846 40.270 16.120 21.110 1.00 0.00 ATOM 17643 OH2 SOL 847 38.640 39.500 65.230 1.00 0.00 ATOM 17644 H1 SOL 847 39.290 40.020 65.690 1.00 0.00 ATOM 17645 H2 SOL 847 38.500 39.960 64.400 1.00 0.00 ATOM 17646 OH2 SOL 848 26.470 29.160 17.350 1.00 0.00 ATOM 17647 H1 SOL 848 26.090 28.980 18.210 1.00 0.00 ATOM 17648 H2 SOL 848 27.410 29.080 17.480 1.00 0.00 ATOM 17649 OH2 SOL 849 58.190 59.460 81.900 1.00 0.00 ATOM 17650 H1 SOL 849 57.470 59.230 81.320 1.00 0.00 ATOM 17651 H2 SOL 849 58.960 59.040 81.520 1.00 0.00 ATOM 17652 OH2 SOL 850 24.000 30.790 20.000 1.00 0.00 ATOM 17653 H1 SOL 850 24.910 30.910 20.270 1.00 0.00 ATOM 17654 H2 SOL 850 24.020 30.060 19.380 1.00 0.00 ATOM 17655 OH2 SOL 851 33.100 13.450 56.990 1.00 0.00 ATOM 17656 H1 SOL 851 33.920 12.980 56.850 1.00 0.00 ATOM 17657 H2 SOL 851 33.360 14.270 57.410 1.00 0.00 ATOM 17658 OH2 SOL 852 15.280 44.520 9.600 1.00 0.00 ATOM 17659 H1 SOL 852 16.130 44.250 9.950 1.00 0.00 ATOM 17660 H2 SOL 852 15.290 45.480 9.680 1.00 0.00 ATOM 17661 OH2 SOL 853 0.240 2.140 60.360 1.00 0.00 ATOM 17662 H1 SOL 853 -0.600 1.800 60.030 1.00 0.00 ATOM 17663 H2 SOL 853 0.890 1.760 59.780 1.00 0.00 ATOM 17664 OH2 SOL 854 17.760 23.090 80.380 1.00 0.00 ATOM 17665 H1 SOL 854 17.090 23.000 81.060 1.00 0.00 ATOM 17666 H2 SOL 854 18.310 23.810 80.680 1.00 0.00 ATOM 17667 OH2 SOL 855 40.050 13.610 13.440 1.00 0.00 ATOM 17668 H1 SOL 855 40.300 12.920 12.820 1.00 0.00 ATOM 17669 H2 SOL 855 40.490 14.400 13.110 1.00 0.00 ATOM 17670 OH2 SOL 856 35.900 38.280 78.520 1.00 0.00 ATOM 17671 H1 SOL 856 35.900 37.330 78.630 1.00 0.00 ATOM 17672 H2 SOL 856 35.130 38.580 79.020 1.00 0.00 ATOM 17673 OH2 SOL 857 28.190 29.310 66.480 1.00 0.00 ATOM 17674 H1 SOL 857 27.480 29.330 65.840 1.00 0.00 ATOM 17675 H2 SOL 857 28.240 28.390 66.750 1.00 0.00 ATOM 17676 OH2 SOL 858 42.290 13.880 69.840 1.00 0.00 ATOM 17677 H1 SOL 858 41.950 13.000 70.020 1.00 0.00 ATOM 17678 H2 SOL 858 42.620 14.190 70.680 1.00 0.00 ATOM 17679 OH2 SOL 859 7.160 17.840 67.030 1.00 0.00 ATOM 17680 H1 SOL 859 7.620 17.260 66.430 1.00 0.00 ATOM 17681 H2 SOL 859 6.330 18.040 66.600 1.00 0.00 ATOM 17682 OH2 SOL 860 12.580 41.940 19.400 1.00 0.00 ATOM 17683 H1 SOL 860 11.740 41.530 19.210 1.00 0.00 ATOM 17684 H2 SOL 860 12.660 41.880 20.360 1.00 0.00 ATOM 17685 OH2 SOL 861 18.220 57.810 79.480 1.00 0.00 ATOM 17686 H1 SOL 861 17.980 57.420 78.630 1.00 0.00 ATOM 17687 H2 SOL 861 17.390 57.880 79.950 1.00 0.00 ATOM 17688 OH2 SOL 862 39.980 19.700 20.090 1.00 0.00 ATOM 17689 H1 SOL 862 39.840 19.580 21.030 1.00 0.00 ATOM 17690 H2 SOL 862 39.320 19.150 19.680 1.00 0.00 ATOM 17691 OH2 SOL 863 45.320 44.940 76.570 1.00 0.00 ATOM 17692 H1 SOL 863 45.110 44.560 75.720 1.00 0.00 ATOM 17693 H2 SOL 863 46.170 44.570 76.800 1.00 0.00 ATOM 17694 OH2 SOL 864 27.150 15.640 71.810 1.00 0.00 ATOM 17695 H1 SOL 864 27.710 16.150 72.400 1.00 0.00 ATOM 17696 H2 SOL 864 26.550 15.180 72.390 1.00 0.00 ATOM 17697 OH2 SOL 865 57.130 23.520 82.600 1.00 0.00 ATOM 17698 H1 SOL 865 57.200 22.740 82.060 1.00 0.00 ATOM 17699 H2 SOL 865 56.490 23.280 83.280 1.00 0.00 ATOM 17700 OH2 SOL 866 29.060 11.270 1.410 1.00 0.00 ATOM 17701 H1 SOL 866 29.180 10.380 1.730 1.00 0.00 ATOM 17702 H2 SOL 866 28.240 11.560 1.800 1.00 0.00 ATOM 17703 OH2 SOL 867 57.330 49.630 77.090 1.00 0.00 ATOM 17704 H1 SOL 867 57.140 49.210 77.930 1.00 0.00 ATOM 17705 H2 SOL 867 58.180 50.050 77.220 1.00 0.00 ATOM 17706 OH2 SOL 868 41.340 31.600 73.070 1.00 0.00 ATOM 17707 H1 SOL 868 42.000 30.920 72.980 1.00 0.00 ATOM 17708 H2 SOL 868 41.680 32.350 72.590 1.00 0.00 ATOM 17709 OH2 SOL 869 2.430 38.790 66.310 1.00 0.00 ATOM 17710 H1 SOL 869 3.120 38.590 65.680 1.00 0.00 ATOM 17711 H2 SOL 869 1.650 38.950 65.770 1.00 0.00 ATOM 17712 OH2 SOL 870 57.890 42.640 75.530 1.00 0.00 ATOM 17713 H1 SOL 870 57.030 42.280 75.320 1.00 0.00 ATOM 17714 H2 SOL 870 57.800 42.970 76.420 1.00 0.00 ATOM 17715 OH2 SOL 871 28.570 23.490 76.130 1.00 0.00 ATOM 17716 H1 SOL 871 28.510 23.380 75.180 1.00 0.00 ATOM 17717 H2 SOL 871 28.560 24.430 76.270 1.00 0.00 ATOM 17718 OH2 SOL 872 34.790 42.880 80.710 1.00 0.00 ATOM 17719 H1 SOL 872 35.250 42.820 79.880 1.00 0.00 ATOM 17720 H2 SOL 872 35.420 42.580 81.360 1.00 0.00 ATOM 17721 OH2 SOL 873 18.790 15.760 10.130 1.00 0.00 ATOM 17722 H1 SOL 873 18.930 15.410 9.250 1.00 0.00 ATOM 17723 H2 SOL 873 17.910 16.140 10.100 1.00 0.00 ATOM 17724 OH2 SOL 874 7.180 19.830 5.040 1.00 0.00 ATOM 17725 H1 SOL 874 7.700 19.200 4.520 1.00 0.00 ATOM 17726 H2 SOL 874 6.820 20.430 4.390 1.00 0.00 ATOM 17727 OH2 SOL 875 17.570 23.020 17.180 1.00 0.00 ATOM 17728 H1 SOL 875 17.980 23.260 18.010 1.00 0.00 ATOM 17729 H2 SOL 875 17.250 23.840 16.820 1.00 0.00 ATOM 17730 OH2 SOL 876 45.690 49.410 6.700 1.00 0.00 ATOM 17731 H1 SOL 876 46.510 49.410 6.210 1.00 0.00 ATOM 17732 H2 SOL 876 45.790 48.690 7.330 1.00 0.00 ATOM 17733 OH2 SOL 877 55.850 33.900 64.810 1.00 0.00 ATOM 17734 H1 SOL 877 56.230 34.700 64.460 1.00 0.00 ATOM 17735 H2 SOL 877 54.940 33.910 64.520 1.00 0.00 ATOM 17736 OH2 SOL 878 47.750 36.990 10.750 1.00 0.00 ATOM 17737 H1 SOL 878 48.520 36.580 10.350 1.00 0.00 ATOM 17738 H2 SOL 878 47.660 37.830 10.290 1.00 0.00 ATOM 17739 OH2 SOL 879 20.840 55.390 3.390 1.00 0.00 ATOM 17740 H1 SOL 879 20.380 56.060 2.880 1.00 0.00 ATOM 17741 H2 SOL 879 21.520 55.870 3.860 1.00 0.00 ATOM 17742 OH2 SOL 880 56.690 37.850 5.620 1.00 0.00 ATOM 17743 H1 SOL 880 56.050 37.160 5.770 1.00 0.00 ATOM 17744 H2 SOL 880 56.190 38.590 5.280 1.00 0.00 ATOM 17745 OH2 SOL 881 41.220 36.330 15.810 1.00 0.00 ATOM 17746 H1 SOL 881 40.570 36.990 16.060 1.00 0.00 ATOM 17747 H2 SOL 881 41.100 35.620 16.440 1.00 0.00 ATOM 17748 OH2 SOL 882 48.570 38.470 77.520 1.00 0.00 ATOM 17749 H1 SOL 882 48.530 37.930 76.730 1.00 0.00 ATOM 17750 H2 SOL 882 49.360 39.000 77.400 1.00 0.00 ATOM 17751 OH2 SOL 883 0.390 52.480 7.600 1.00 0.00 ATOM 17752 H1 SOL 883 -0.250 51.770 7.630 1.00 0.00 ATOM 17753 H2 SOL 883 -0.090 53.210 7.200 1.00 0.00 ATOM 17754 OH2 SOL 884 22.460 41.860 16.700 1.00 0.00 ATOM 17755 H1 SOL 884 23.040 41.160 17.020 1.00 0.00 ATOM 17756 H2 SOL 884 22.630 41.900 15.760 1.00 0.00 ATOM 17757 OH2 SOL 885 42.530 48.160 19.540 1.00 0.00 ATOM 17758 H1 SOL 885 42.660 48.570 20.400 1.00 0.00 ATOM 17759 H2 SOL 885 43.280 48.450 19.030 1.00 0.00 ATOM 17760 OH2 SOL 886 50.550 25.780 75.180 1.00 0.00 ATOM 17761 H1 SOL 886 50.800 24.850 75.210 1.00 0.00 ATOM 17762 H2 SOL 886 49.710 25.790 74.710 1.00 0.00 ATOM 17763 OH2 SOL 887 15.270 51.650 68.350 1.00 0.00 ATOM 17764 H1 SOL 887 14.590 51.240 68.890 1.00 0.00 ATOM 17765 H2 SOL 887 15.790 50.910 68.030 1.00 0.00 ATOM 17766 OH2 SOL 888 53.570 58.300 7.770 1.00 0.00 ATOM 17767 H1 SOL 888 54.130 58.120 8.530 1.00 0.00 ATOM 17768 H2 SOL 888 53.450 59.250 7.790 1.00 0.00 ATOM 17769 OH2 SOL 889 47.230 59.720 61.520 1.00 0.00 ATOM 17770 H1 SOL 889 47.080 60.650 61.730 1.00 0.00 ATOM 17771 H2 SOL 889 47.670 59.730 60.680 1.00 0.00 ATOM 17772 OH2 SOL 890 56.170 24.810 72.840 1.00 0.00 ATOM 17773 H1 SOL 890 56.750 25.500 72.510 1.00 0.00 ATOM 17774 H2 SOL 890 56.680 24.010 72.780 1.00 0.00 ATOM 17775 OH2 SOL 891 56.540 45.880 12.670 1.00 0.00 ATOM 17776 H1 SOL 891 56.010 46.400 13.280 1.00 0.00 ATOM 17777 H2 SOL 891 56.530 45.000 13.050 1.00 0.00 ATOM 17778 OH2 SOL 892 47.700 1.550 72.430 1.00 0.00 ATOM 17779 H1 SOL 892 47.430 2.390 72.800 1.00 0.00 ATOM 17780 H2 SOL 892 47.760 0.960 73.180 1.00 0.00 ATOM 17781 OH2 SOL 893 44.860 9.090 79.610 1.00 0.00 ATOM 17782 H1 SOL 893 44.740 8.230 80.010 1.00 0.00 ATOM 17783 H2 SOL 893 45.800 9.260 79.670 1.00 0.00 ATOM 17784 OH2 SOL 894 31.960 28.480 81.700 1.00 0.00 ATOM 17785 H1 SOL 894 31.770 28.970 80.900 1.00 0.00 ATOM 17786 H2 SOL 894 32.910 28.520 81.790 1.00 0.00 ATOM 17787 OH2 SOL 895 48.340 31.590 84.650 1.00 0.00 ATOM 17788 H1 SOL 895 48.680 32.430 84.360 1.00 0.00 ATOM 17789 H2 SOL 895 49.040 30.970 84.420 1.00 0.00 ATOM 17790 OH2 SOL 896 23.290 51.960 12.860 1.00 0.00 ATOM 17791 H1 SOL 896 23.860 51.460 12.280 1.00 0.00 ATOM 17792 H2 SOL 896 23.780 52.750 13.060 1.00 0.00 ATOM 17793 OH2 SOL 897 38.460 55.970 84.030 1.00 0.00 ATOM 17794 H1 SOL 897 38.110 56.370 84.830 1.00 0.00 ATOM 17795 H2 SOL 897 38.960 55.220 84.350 1.00 0.00 ATOM 17796 OH2 SOL 898 25.670 45.200 65.620 1.00 0.00 ATOM 17797 H1 SOL 898 26.610 45.000 65.580 1.00 0.00 ATOM 17798 H2 SOL 898 25.330 44.630 66.310 1.00 0.00 ATOM 17799 OH2 SOL 899 26.940 1.230 80.950 1.00 0.00 ATOM 17800 H1 SOL 899 27.540 0.490 81.040 1.00 0.00 ATOM 17801 H2 SOL 899 26.980 1.460 80.020 1.00 0.00 ATOM 17802 OH2 SOL 900 45.430 13.790 8.540 1.00 0.00 ATOM 17803 H1 SOL 900 45.540 12.960 8.080 1.00 0.00 ATOM 17804 H2 SOL 900 46.320 14.140 8.620 1.00 0.00 ATOM 17805 OH2 SOL 901 14.090 29.780 15.260 1.00 0.00 ATOM 17806 H1 SOL 901 14.070 29.100 15.930 1.00 0.00 ATOM 17807 H2 SOL 901 13.380 30.370 15.510 1.00 0.00 ATOM 17808 OH2 SOL 902 36.280 24.110 20.100 1.00 0.00 ATOM 17809 H1 SOL 902 35.460 24.410 20.490 1.00 0.00 ATOM 17810 H2 SOL 902 36.600 24.870 19.610 1.00 0.00 ATOM 17811 OH2 SOL 903 57.350 24.860 9.050 1.00 0.00 ATOM 17812 H1 SOL 903 56.990 24.510 9.870 1.00 0.00 ATOM 17813 H2 SOL 903 56.890 24.400 8.360 1.00 0.00 ATOM 17814 OH2 SOL 904 36.530 5.080 0.060 1.00 0.00 ATOM 17815 H1 SOL 904 35.710 5.220 0.550 1.00 0.00 ATOM 17816 H2 SOL 904 36.960 5.940 0.070 1.00 0.00 ATOM 17817 OH2 SOL 905 52.660 19.290 6.030 1.00 0.00 ATOM 17818 H1 SOL 905 52.930 18.890 6.860 1.00 0.00 ATOM 17819 H2 SOL 905 51.740 19.060 5.940 1.00 0.00 ATOM 17820 OH2 SOL 906 58.480 23.160 68.590 1.00 0.00 ATOM 17821 H1 SOL 906 58.590 23.700 67.810 1.00 0.00 ATOM 17822 H2 SOL 906 59.370 22.900 68.830 1.00 0.00 ATOM 17823 OH2 SOL 907 0.330 18.120 16.010 1.00 0.00 ATOM 17824 H1 SOL 907 0.570 18.270 15.100 1.00 0.00 ATOM 17825 H2 SOL 907 0.500 17.190 16.150 1.00 0.00 ATOM 17826 OH2 SOL 908 16.130 46.210 69.010 1.00 0.00 ATOM 17827 H1 SOL 908 15.800 45.660 69.730 1.00 0.00 ATOM 17828 H2 SOL 908 16.470 46.990 69.440 1.00 0.00 ATOM 17829 OH2 SOL 909 49.900 41.790 27.050 1.00 0.00 ATOM 17830 H1 SOL 909 49.400 42.600 27.000 1.00 0.00 ATOM 17831 H2 SOL 909 50.800 42.040 26.820 1.00 0.00 ATOM 17832 OH2 SOL 910 15.410 41.100 15.700 1.00 0.00 ATOM 17833 H1 SOL 910 14.540 41.340 15.370 1.00 0.00 ATOM 17834 H2 SOL 910 15.920 40.930 14.910 1.00 0.00 ATOM 17835 OH2 SOL 911 46.030 17.980 11.280 1.00 0.00 ATOM 17836 H1 SOL 911 46.140 17.100 11.640 1.00 0.00 ATOM 17837 H2 SOL 911 45.510 18.450 11.930 1.00 0.00 ATOM 17838 OH2 SOL 912 9.480 21.440 72.580 1.00 0.00 ATOM 17839 H1 SOL 912 8.670 21.390 73.080 1.00 0.00 ATOM 17840 H2 SOL 912 9.240 21.940 71.790 1.00 0.00 ATOM 17841 OH2 SOL 913 42.920 10.020 -0.190 1.00 0.00 ATOM 17842 H1 SOL 913 42.200 10.400 0.300 1.00 0.00 ATOM 17843 H2 SOL 913 43.240 9.310 0.360 1.00 0.00 ATOM 17844 OH2 SOL 914 6.140 19.870 77.390 1.00 0.00 ATOM 17845 H1 SOL 914 5.380 20.120 77.910 1.00 0.00 ATOM 17846 H2 SOL 914 6.530 19.140 77.880 1.00 0.00 ATOM 17847 OH2 SOL 915 51.180 57.550 71.550 1.00 0.00 ATOM 17848 H1 SOL 915 51.310 57.040 72.350 1.00 0.00 ATOM 17849 H2 SOL 915 52.060 57.730 71.230 1.00 0.00 ATOM 17850 OH2 SOL 916 23.730 35.610 11.440 1.00 0.00 ATOM 17851 H1 SOL 916 23.640 35.660 12.390 1.00 0.00 ATOM 17852 H2 SOL 916 24.370 36.280 11.220 1.00 0.00 ATOM 17853 OH2 SOL 917 42.580 38.890 79.460 1.00 0.00 ATOM 17854 H1 SOL 917 41.840 39.130 80.020 1.00 0.00 ATOM 17855 H2 SOL 917 42.550 39.510 78.740 1.00 0.00 ATOM 17856 OH2 SOL 918 57.190 48.210 65.680 1.00 0.00 ATOM 17857 H1 SOL 918 56.940 47.410 66.130 1.00 0.00 ATOM 17858 H2 SOL 918 58.090 48.370 65.950 1.00 0.00 ATOM 17859 OH2 SOL 919 49.860 1.150 70.760 1.00 0.00 ATOM 17860 H1 SOL 919 49.070 1.400 71.230 1.00 0.00 ATOM 17861 H2 SOL 919 49.830 0.190 70.740 1.00 0.00 ATOM 17862 OH2 SOL 920 32.330 60.690 0.700 1.00 0.00 ATOM 17863 H1 SOL 920 32.960 61.410 0.590 1.00 0.00 ATOM 17864 H2 SOL 920 32.810 59.910 0.420 1.00 0.00 ATOM 17865 OH2 SOL 921 30.180 60.710 2.790 1.00 0.00 ATOM 17866 H1 SOL 921 30.000 59.790 2.970 1.00 0.00 ATOM 17867 H2 SOL 921 31.000 60.700 2.290 1.00 0.00 ATOM 17868 OH2 SOL 922 1.260 2.340 3.460 1.00 0.00 ATOM 17869 H1 SOL 922 0.530 1.770 3.220 1.00 0.00 ATOM 17870 H2 SOL 922 1.580 1.980 4.290 1.00 0.00 ATOM 17871 OH2 SOL 923 24.920 60.740 64.230 1.00 0.00 ATOM 17872 H1 SOL 923 24.040 60.740 63.850 1.00 0.00 ATOM 17873 H2 SOL 923 25.330 59.960 63.870 1.00 0.00 ATOM 17874 OH2 SOL 924 14.580 7.790 15.440 1.00 0.00 ATOM 17875 H1 SOL 924 15.030 7.460 14.660 1.00 0.00 ATOM 17876 H2 SOL 924 14.160 8.590 15.150 1.00 0.00 ATOM 17877 OH2 SOL 925 54.770 49.010 75.200 1.00 0.00 ATOM 17878 H1 SOL 925 54.020 48.450 75.440 1.00 0.00 ATOM 17879 H2 SOL 925 55.300 49.040 76.000 1.00 0.00 ATOM 17880 OH2 SOL 926 38.630 28.730 5.670 1.00 0.00 ATOM 17881 H1 SOL 926 39.440 28.210 5.700 1.00 0.00 ATOM 17882 H2 SOL 926 38.380 28.720 4.740 1.00 0.00 ATOM 17883 OH2 SOL 927 13.100 8.180 68.000 1.00 0.00 ATOM 17884 H1 SOL 927 12.700 7.870 67.190 1.00 0.00 ATOM 17885 H2 SOL 927 13.450 9.040 67.770 1.00 0.00 ATOM 17886 OH2 SOL 928 57.630 13.110 20.330 1.00 0.00 ATOM 17887 H1 SOL 928 57.560 13.930 20.830 1.00 0.00 ATOM 17888 H2 SOL 928 57.350 12.430 20.940 1.00 0.00 ATOM 17889 OH2 SOL 929 38.600 44.670 80.540 1.00 0.00 ATOM 17890 H1 SOL 929 38.870 44.400 81.410 1.00 0.00 ATOM 17891 H2 SOL 929 39.340 44.460 79.980 1.00 0.00 ATOM 17892 OH2 SOL 930 17.590 9.220 24.400 1.00 0.00 ATOM 17893 H1 SOL 930 18.280 8.570 24.260 1.00 0.00 ATOM 17894 H2 SOL 930 16.820 8.850 23.980 1.00 0.00 ATOM 17895 OH2 SOL 931 25.870 4.040 73.230 1.00 0.00 ATOM 17896 H1 SOL 931 26.380 3.680 73.960 1.00 0.00 ATOM 17897 H2 SOL 931 24.990 3.710 73.370 1.00 0.00 ATOM 17898 OH2 SOL 932 41.190 36.860 5.960 1.00 0.00 ATOM 17899 H1 SOL 932 40.410 36.390 5.660 1.00 0.00 ATOM 17900 H2 SOL 932 41.700 36.190 6.420 1.00 0.00 ATOM 17901 OH2 SOL 933 43.370 21.870 78.570 1.00 0.00 ATOM 17902 H1 SOL 933 43.230 22.310 79.410 1.00 0.00 ATOM 17903 H2 SOL 933 44.220 21.430 78.670 1.00 0.00 ATOM 17904 OH2 SOL 934 52.940 23.860 70.150 1.00 0.00 ATOM 17905 H1 SOL 934 52.440 23.800 69.330 1.00 0.00 ATOM 17906 H2 SOL 934 53.840 23.650 69.890 1.00 0.00 ATOM 17907 OH2 SOL 935 58.610 16.580 74.670 1.00 0.00 ATOM 17908 H1 SOL 935 59.480 16.280 74.430 1.00 0.00 ATOM 17909 H2 SOL 935 58.310 17.090 73.920 1.00 0.00 ATOM 17910 OH2 SOL 936 39.580 8.670 79.940 1.00 0.00 ATOM 17911 H1 SOL 936 39.270 9.570 79.970 1.00 0.00 ATOM 17912 H2 SOL 936 39.700 8.420 80.850 1.00 0.00 ATOM 17913 OH2 SOL 937 48.110 33.390 12.040 1.00 0.00 ATOM 17914 H1 SOL 937 48.770 32.940 12.570 1.00 0.00 ATOM 17915 H2 SOL 937 48.460 34.270 11.910 1.00 0.00 ATOM 17916 OH2 SOL 938 28.240 18.640 11.060 1.00 0.00 ATOM 17917 H1 SOL 938 28.920 18.140 10.610 1.00 0.00 ATOM 17918 H2 SOL 938 28.720 19.140 11.730 1.00 0.00 ATOM 17919 OH2 SOL 939 2.850 6.240 27.150 1.00 0.00 ATOM 17920 H1 SOL 939 2.390 6.630 26.410 1.00 0.00 ATOM 17921 H2 SOL 939 2.480 6.670 27.920 1.00 0.00 ATOM 17922 OH2 SOL 940 29.150 39.940 20.700 1.00 0.00 ATOM 17923 H1 SOL 940 28.630 40.190 19.930 1.00 0.00 ATOM 17924 H2 SOL 940 29.680 40.720 20.890 1.00 0.00 ATOM 17925 OH2 SOL 941 44.420 24.310 21.060 1.00 0.00 ATOM 17926 H1 SOL 941 45.250 24.600 21.440 1.00 0.00 ATOM 17927 H2 SOL 941 43.850 25.090 21.100 1.00 0.00 ATOM 17928 OH2 SOL 942 3.600 5.340 64.560 1.00 0.00 ATOM 17929 H1 SOL 942 2.690 5.050 64.600 1.00 0.00 ATOM 17930 H2 SOL 942 4.090 4.560 64.290 1.00 0.00 ATOM 17931 OH2 SOL 943 17.030 23.660 21.860 1.00 0.00 ATOM 17932 H1 SOL 943 17.240 24.540 22.150 1.00 0.00 ATOM 17933 H2 SOL 943 17.430 23.090 22.520 1.00 0.00 ATOM 17934 OH2 SOL 944 10.520 38.360 80.550 1.00 0.00 ATOM 17935 H1 SOL 944 11.240 38.670 80.000 1.00 0.00 ATOM 17936 H2 SOL 944 10.890 38.310 81.430 1.00 0.00 ATOM 17937 OH2 SOL 945 11.620 3.460 80.870 1.00 0.00 ATOM 17938 H1 SOL 945 12.080 4.300 80.930 1.00 0.00 ATOM 17939 H2 SOL 945 10.780 3.610 81.290 1.00 0.00 ATOM 17940 OH2 SOL 946 16.210 33.690 73.430 1.00 0.00 ATOM 17941 H1 SOL 946 15.330 33.320 73.420 1.00 0.00 ATOM 17942 H2 SOL 946 16.740 33.050 73.900 1.00 0.00 ATOM 17943 OH2 SOL 947 37.330 3.190 19.040 1.00 0.00 ATOM 17944 H1 SOL 947 36.430 3.350 18.760 1.00 0.00 ATOM 17945 H2 SOL 947 37.240 2.780 19.900 1.00 0.00 ATOM 17946 OH2 SOL 948 48.540 51.820 76.810 1.00 0.00 ATOM 17947 H1 SOL 948 48.070 51.050 76.470 1.00 0.00 ATOM 17948 H2 SOL 948 48.130 52.560 76.360 1.00 0.00 ATOM 17949 OH2 SOL 949 5.030 49.150 67.600 1.00 0.00 ATOM 17950 H1 SOL 949 5.790 48.710 67.970 1.00 0.00 ATOM 17951 H2 SOL 949 5.200 49.150 66.650 1.00 0.00 ATOM 17952 OH2 SOL 950 41.820 29.820 69.590 1.00 0.00 ATOM 17953 H1 SOL 950 41.100 30.460 69.580 1.00 0.00 ATOM 17954 H2 SOL 950 42.000 29.650 68.670 1.00 0.00 ATOM 17955 OH2 SOL 951 27.530 20.170 15.400 1.00 0.00 ATOM 17956 H1 SOL 951 26.690 20.000 14.980 1.00 0.00 ATOM 17957 H2 SOL 951 27.610 19.470 16.050 1.00 0.00 ATOM 17958 OH2 SOL 952 27.770 34.420 72.850 1.00 0.00 ATOM 17959 H1 SOL 952 26.840 34.450 73.040 1.00 0.00 ATOM 17960 H2 SOL 952 27.920 33.540 72.500 1.00 0.00 ATOM 17961 OH2 SOL 953 42.540 2.040 20.110 1.00 0.00 ATOM 17962 H1 SOL 953 42.180 2.490 19.340 1.00 0.00 ATOM 17963 H2 SOL 953 42.350 2.640 20.830 1.00 0.00 ATOM 17964 OH2 SOL 954 37.310 2.320 68.650 1.00 0.00 ATOM 17965 H1 SOL 954 37.120 1.490 68.200 1.00 0.00 ATOM 17966 H2 SOL 954 37.340 2.070 69.580 1.00 0.00 ATOM 17967 OH2 SOL 955 0.230 56.520 12.570 1.00 0.00 ATOM 17968 H1 SOL 955 -0.210 55.710 12.280 1.00 0.00 ATOM 17969 H2 SOL 955 1.010 56.210 13.030 1.00 0.00 ATOM 17970 OH2 SOL 956 37.820 6.560 67.240 1.00 0.00 ATOM 17971 H1 SOL 956 38.650 6.990 67.030 1.00 0.00 ATOM 17972 H2 SOL 956 37.790 5.800 66.670 1.00 0.00 ATOM 17973 OH2 SOL 957 20.430 34.610 7.500 1.00 0.00 ATOM 17974 H1 SOL 957 19.540 34.770 7.820 1.00 0.00 ATOM 17975 H2 SOL 957 20.970 34.600 8.290 1.00 0.00 ATOM 17976 OH2 SOL 958 9.850 25.980 2.640 1.00 0.00 ATOM 17977 H1 SOL 958 10.500 26.470 2.140 1.00 0.00 ATOM 17978 H2 SOL 958 10.070 26.170 3.550 1.00 0.00 ATOM 17979 OH2 SOL 959 9.030 19.600 76.100 1.00 0.00 ATOM 17980 H1 SOL 959 8.190 19.400 75.690 1.00 0.00 ATOM 17981 H2 SOL 959 9.050 20.560 76.140 1.00 0.00 ATOM 17982 OH2 SOL 960 30.570 26.270 74.170 1.00 0.00 ATOM 17983 H1 SOL 960 31.410 26.640 73.910 1.00 0.00 ATOM 17984 H2 SOL 960 30.190 25.930 73.360 1.00 0.00 ATOM 17985 OH2 SOL 961 59.290 32.580 8.150 1.00 0.00 ATOM 17986 H1 SOL 961 59.010 32.040 7.420 1.00 0.00 ATOM 17987 H2 SOL 961 60.220 32.390 8.250 1.00 0.00 ATOM 17988 OH2 SOL 962 42.910 4.400 15.340 1.00 0.00 ATOM 17989 H1 SOL 962 43.060 3.470 15.500 1.00 0.00 ATOM 17990 H2 SOL 962 43.780 4.750 15.140 1.00 0.00 ATOM 17991 OH2 SOL 963 49.340 5.960 21.640 1.00 0.00 ATOM 17992 H1 SOL 963 49.100 6.760 21.170 1.00 0.00 ATOM 17993 H2 SOL 963 48.860 6.010 22.470 1.00 0.00 ATOM 17994 OH2 SOL 964 37.150 36.300 72.770 1.00 0.00 ATOM 17995 H1 SOL 964 37.800 36.840 72.320 1.00 0.00 ATOM 17996 H2 SOL 964 36.310 36.590 72.410 1.00 0.00 ATOM 17997 OH2 SOL 965 41.510 10.240 74.510 1.00 0.00 ATOM 17998 H1 SOL 965 42.400 10.040 74.220 1.00 0.00 ATOM 17999 H2 SOL 965 41.570 10.290 75.460 1.00 0.00 ATOM 18000 OH2 SOL 966 38.810 35.380 5.160 1.00 0.00 ATOM 18001 H1 SOL 966 38.020 35.560 5.670 1.00 0.00 ATOM 18002 H2 SOL 966 39.360 34.860 5.750 1.00 0.00 ATOM 18003 OH2 SOL 967 7.510 4.640 25.990 1.00 0.00 ATOM 18004 H1 SOL 967 7.750 3.870 25.480 1.00 0.00 ATOM 18005 H2 SOL 967 7.750 4.430 26.890 1.00 0.00 ATOM 18006 OH2 SOL 968 22.340 32.400 76.520 1.00 0.00 ATOM 18007 H1 SOL 968 22.750 32.350 75.660 1.00 0.00 ATOM 18008 H2 SOL 968 21.420 32.180 76.370 1.00 0.00 ATOM 18009 OH2 SOL 969 13.290 3.680 74.000 1.00 0.00 ATOM 18010 H1 SOL 969 13.330 4.150 74.830 1.00 0.00 ATOM 18011 H2 SOL 969 12.700 4.200 73.450 1.00 0.00 ATOM 18012 OH2 SOL 970 44.070 50.000 81.670 1.00 0.00 ATOM 18013 H1 SOL 970 44.610 49.380 81.180 1.00 0.00 ATOM 18014 H2 SOL 970 44.680 50.660 81.990 1.00 0.00 ATOM 18015 OH2 SOL 971 48.170 27.790 74.090 1.00 0.00 ATOM 18016 H1 SOL 971 48.820 27.700 73.390 1.00 0.00 ATOM 18017 H2 SOL 971 48.500 28.510 74.630 1.00 0.00 ATOM 18018 OH2 SOL 972 49.330 4.130 2.880 1.00 0.00 ATOM 18019 H1 SOL 972 48.990 3.950 2.000 1.00 0.00 ATOM 18020 H2 SOL 972 49.550 5.060 2.860 1.00 0.00 ATOM 18021 OH2 SOL 973 49.470 15.840 10.700 1.00 0.00 ATOM 18022 H1 SOL 973 50.380 16.030 10.500 1.00 0.00 ATOM 18023 H2 SOL 973 49.000 16.020 9.890 1.00 0.00 ATOM 18024 OH2 SOL 974 2.260 28.210 72.650 1.00 0.00 ATOM 18025 H1 SOL 974 1.640 28.890 72.390 1.00 0.00 ATOM 18026 H2 SOL 974 3.120 28.550 72.390 1.00 0.00 ATOM 18027 OH2 SOL 975 49.240 55.190 67.180 1.00 0.00 ATOM 18028 H1 SOL 975 50.160 55.040 66.970 1.00 0.00 ATOM 18029 H2 SOL 975 48.990 54.440 67.720 1.00 0.00 ATOM 18030 OH2 SOL 976 24.380 39.500 77.320 1.00 0.00 ATOM 18031 H1 SOL 976 23.450 39.340 77.490 1.00 0.00 ATOM 18032 H2 SOL 976 24.410 40.400 76.980 1.00 0.00 ATOM 18033 OH2 SOL 977 30.940 30.360 4.750 1.00 0.00 ATOM 18034 H1 SOL 977 30.650 30.340 5.660 1.00 0.00 ATOM 18035 H2 SOL 977 30.140 30.210 4.240 1.00 0.00 ATOM 18036 OH2 SOL 978 33.030 52.580 8.590 1.00 0.00 ATOM 18037 H1 SOL 978 32.980 53.520 8.440 1.00 0.00 ATOM 18038 H2 SOL 978 33.950 52.420 8.820 1.00 0.00 ATOM 18039 OH2 SOL 979 55.400 41.460 76.330 1.00 0.00 ATOM 18040 H1 SOL 979 54.880 41.280 75.550 1.00 0.00 ATOM 18041 H2 SOL 979 55.830 40.630 76.530 1.00 0.00 ATOM 18042 OH2 SOL 980 48.310 44.750 74.920 1.00 0.00 ATOM 18043 H1 SOL 980 48.160 45.400 75.620 1.00 0.00 ATOM 18044 H2 SOL 980 49.090 45.060 74.470 1.00 0.00 ATOM 18045 OH2 SOL 981 55.490 7.210 68.150 1.00 0.00 ATOM 18046 H1 SOL 981 55.840 6.340 67.970 1.00 0.00 ATOM 18047 H2 SOL 981 55.510 7.660 67.310 1.00 0.00 ATOM 18048 OH2 SOL 982 4.360 40.770 64.330 1.00 0.00 ATOM 18049 H1 SOL 982 4.680 41.620 64.620 1.00 0.00 ATOM 18050 H2 SOL 982 5.150 40.220 64.290 1.00 0.00 ATOM 18051 OH2 SOL 983 3.920 21.510 74.950 1.00 0.00 ATOM 18052 H1 SOL 983 3.920 20.640 74.550 1.00 0.00 ATOM 18053 H2 SOL 983 3.880 21.340 75.890 1.00 0.00 ATOM 18054 OH2 SOL 984 58.270 2.800 67.330 1.00 0.00 ATOM 18055 H1 SOL 984 59.220 2.720 67.420 1.00 0.00 ATOM 18056 H2 SOL 984 57.980 1.920 67.080 1.00 0.00 ATOM 18057 OH2 SOL 985 20.580 14.470 59.950 1.00 0.00 ATOM 18058 H1 SOL 985 21.150 14.140 59.240 1.00 0.00 ATOM 18059 H2 SOL 985 21.090 15.160 60.360 1.00 0.00 ATOM 18060 OH2 SOL 986 51.750 24.270 16.790 1.00 0.00 ATOM 18061 H1 SOL 986 51.270 23.700 16.190 1.00 0.00 ATOM 18062 H2 SOL 986 52.640 24.280 16.440 1.00 0.00 ATOM 18063 OH2 SOL 987 14.270 49.390 14.200 1.00 0.00 ATOM 18064 H1 SOL 987 13.750 48.620 13.960 1.00 0.00 ATOM 18065 H2 SOL 987 14.650 49.690 13.380 1.00 0.00 ATOM 18066 OH2 SOL 988 47.370 16.150 21.420 1.00 0.00 ATOM 18067 H1 SOL 988 47.080 15.430 21.980 1.00 0.00 ATOM 18068 H2 SOL 988 46.940 16.920 21.760 1.00 0.00 ATOM 18069 OH2 SOL 989 50.220 60.530 7.960 1.00 0.00 ATOM 18070 H1 SOL 989 50.230 60.720 8.900 1.00 0.00 ATOM 18071 H2 SOL 989 50.530 59.630 7.890 1.00 0.00 ATOM 18072 OH2 SOL 990 20.780 54.860 7.680 1.00 0.00 ATOM 18073 H1 SOL 990 19.830 54.970 7.680 1.00 0.00 ATOM 18074 H2 SOL 990 20.940 54.120 8.270 1.00 0.00 ATOM 18075 OH2 SOL 991 35.550 1.410 16.170 1.00 0.00 ATOM 18076 H1 SOL 991 35.120 2.140 16.610 1.00 0.00 ATOM 18077 H2 SOL 991 36.430 1.400 16.550 1.00 0.00 ATOM 18078 OH2 SOL 992 26.310 6.600 81.800 1.00 0.00 ATOM 18079 H1 SOL 992 26.480 5.660 81.710 1.00 0.00 ATOM 18080 H2 SOL 992 25.360 6.680 81.710 1.00 0.00 ATOM 18081 OH2 SOL 993 37.720 48.100 1.090 1.00 0.00 ATOM 18082 H1 SOL 993 38.470 48.170 0.500 1.00 0.00 ATOM 18083 H2 SOL 993 36.970 48.370 0.560 1.00 0.00 ATOM 18084 OH2 SOL 994 19.600 44.410 18.690 1.00 0.00 ATOM 18085 H1 SOL 994 20.350 44.700 18.160 1.00 0.00 ATOM 18086 H2 SOL 994 19.430 43.510 18.400 1.00 0.00 ATOM 18087 OH2 SOL 995 50.920 3.460 66.800 1.00 0.00 ATOM 18088 H1 SOL 995 51.060 3.510 65.860 1.00 0.00 ATOM 18089 H2 SOL 995 51.560 4.080 67.170 1.00 0.00 ATOM 18090 OH2 SOL 996 34.760 11.370 13.300 1.00 0.00 ATOM 18091 H1 SOL 996 34.300 12.150 13.590 1.00 0.00 ATOM 18092 H2 SOL 996 35.680 11.560 13.480 1.00 0.00 ATOM 18093 OH2 SOL 997 36.210 44.450 16.750 1.00 0.00 ATOM 18094 H1 SOL 997 36.160 43.490 16.720 1.00 0.00 ATOM 18095 H2 SOL 997 35.340 44.750 16.480 1.00 0.00 ATOM 18096 OH2 SOL 998 8.690 12.050 70.890 1.00 0.00 ATOM 18097 H1 SOL 998 8.710 11.930 71.830 1.00 0.00 ATOM 18098 H2 SOL 998 8.790 12.990 70.760 1.00 0.00 ATOM 18099 OH2 SOL 999 34.160 18.990 0.670 1.00 0.00 ATOM 18100 H1 SOL 999 33.970 18.060 0.820 1.00 0.00 ATOM 18101 H2 SOL 999 34.130 19.100 -0.280 1.00 0.00 ATOM 18102 OH2 SOL 1000 46.180 24.510 6.210 1.00 0.00 ATOM 18103 H1 SOL 1000 45.960 24.110 5.370 1.00 0.00 ATOM 18104 H2 SOL 1000 46.130 25.450 6.060 1.00 0.00 ATOM 18105 OH2 SOL 1001 56.970 11.410 80.200 1.00 0.00 ATOM 18106 H1 SOL 1001 56.630 11.400 81.090 1.00 0.00 ATOM 18107 H2 SOL 1001 57.850 11.050 80.280 1.00 0.00 ATOM 18108 OH2 SOL 1002 13.120 1.060 81.340 1.00 0.00 ATOM 18109 H1 SOL 1002 13.360 1.770 81.940 1.00 0.00 ATOM 18110 H2 SOL 1002 12.310 1.360 80.930 1.00 0.00 ATOM 18111 OH2 SOL 1003 38.100 35.930 0.530 1.00 0.00 ATOM 18112 H1 SOL 1003 37.860 36.350 1.350 1.00 0.00 ATOM 18113 H2 SOL 1003 38.880 36.400 0.230 1.00 0.00 ATOM 18114 OH2 SOL 1004 45.270 21.630 5.270 1.00 0.00 ATOM 18115 H1 SOL 1004 45.160 22.560 5.080 1.00 0.00 ATOM 18116 H2 SOL 1004 45.580 21.250 4.450 1.00 0.00 ATOM 18117 OH2 SOL 1005 12.370 39.290 13.500 1.00 0.00 ATOM 18118 H1 SOL 1005 12.040 39.990 12.950 1.00 0.00 ATOM 18119 H2 SOL 1005 11.940 38.500 13.180 1.00 0.00 ATOM 18120 OH2 SOL 1006 56.280 58.590 9.020 1.00 0.00 ATOM 18121 H1 SOL 1006 56.670 57.720 9.060 1.00 0.00 ATOM 18122 H2 SOL 1006 56.780 59.050 8.350 1.00 0.00 ATOM 18123 OH2 SOL 1007 39.180 1.780 21.090 1.00 0.00 ATOM 18124 H1 SOL 1007 38.230 1.860 21.170 1.00 0.00 ATOM 18125 H2 SOL 1007 39.360 1.870 20.160 1.00 0.00 ATOM 18126 OH2 SOL 1008 2.380 52.830 83.260 1.00 0.00 ATOM 18127 H1 SOL 1008 1.560 52.830 82.770 1.00 0.00 ATOM 18128 H2 SOL 1008 2.730 51.950 83.150 1.00 0.00 ATOM 18129 OH2 SOL 1009 41.380 50.840 15.680 1.00 0.00 ATOM 18130 H1 SOL 1009 40.550 50.360 15.750 1.00 0.00 ATOM 18131 H2 SOL 1009 42.010 50.200 15.350 1.00 0.00 ATOM 18132 OH2 SOL 1010 38.740 4.790 65.200 1.00 0.00 ATOM 18133 H1 SOL 1010 39.640 5.050 65.390 1.00 0.00 ATOM 18134 H2 SOL 1010 38.600 5.080 64.290 1.00 0.00 ATOM 18135 OH2 SOL 1011 22.890 53.010 69.150 1.00 0.00 ATOM 18136 H1 SOL 1011 23.020 53.170 68.210 1.00 0.00 ATOM 18137 H2 SOL 1011 23.270 53.790 69.570 1.00 0.00 ATOM 18138 OH2 SOL 1012 3.480 14.510 73.880 1.00 0.00 ATOM 18139 H1 SOL 1012 2.860 14.980 74.450 1.00 0.00 ATOM 18140 H2 SOL 1012 3.870 13.850 74.450 1.00 0.00 ATOM 18141 OH2 SOL 1013 7.960 30.870 12.130 1.00 0.00 ATOM 18142 H1 SOL 1013 7.380 30.170 12.420 1.00 0.00 ATOM 18143 H2 SOL 1013 8.030 30.750 11.190 1.00 0.00 ATOM 18144 OH2 SOL 1014 27.220 38.120 8.560 1.00 0.00 ATOM 18145 H1 SOL 1014 28.010 38.290 9.080 1.00 0.00 ATOM 18146 H2 SOL 1014 27.430 38.460 7.690 1.00 0.00 ATOM 18147 OH2 SOL 1015 39.650 33.850 70.580 1.00 0.00 ATOM 18148 H1 SOL 1015 39.200 34.060 69.760 1.00 0.00 ATOM 18149 H2 SOL 1015 39.730 32.890 70.570 1.00 0.00 ATOM 18150 OH2 SOL 1016 35.470 14.800 68.510 1.00 0.00 ATOM 18151 H1 SOL 1016 35.210 14.480 67.650 1.00 0.00 ATOM 18152 H2 SOL 1016 36.400 15.000 68.430 1.00 0.00 ATOM 18153 OH2 SOL 1017 33.110 9.790 4.660 1.00 0.00 ATOM 18154 H1 SOL 1017 32.360 10.060 4.130 1.00 0.00 ATOM 18155 H2 SOL 1017 33.030 10.290 5.470 1.00 0.00 ATOM 18156 OH2 SOL 1018 4.230 33.280 80.850 1.00 0.00 ATOM 18157 H1 SOL 1018 4.410 32.560 80.230 1.00 0.00 ATOM 18158 H2 SOL 1018 3.280 33.390 80.810 1.00 0.00 ATOM 18159 OH2 SOL 1019 33.780 57.020 1.920 1.00 0.00 ATOM 18160 H1 SOL 1019 34.630 56.690 1.630 1.00 0.00 ATOM 18161 H2 SOL 1019 33.990 57.730 2.540 1.00 0.00 ATOM 18162 OH2 SOL 1020 48.720 31.320 4.290 1.00 0.00 ATOM 18163 H1 SOL 1020 49.330 31.530 3.590 1.00 0.00 ATOM 18164 H2 SOL 1020 49.270 31.000 5.000 1.00 0.00 ATOM 18165 OH2 SOL 1021 46.510 26.510 81.930 1.00 0.00 ATOM 18166 H1 SOL 1021 46.340 26.420 80.990 1.00 0.00 ATOM 18167 H2 SOL 1021 46.920 25.690 82.180 1.00 0.00 ATOM 18168 OH2 SOL 1022 15.180 9.070 10.630 1.00 0.00 ATOM 18169 H1 SOL 1022 16.050 9.460 10.590 1.00 0.00 ATOM 18170 H2 SOL 1022 14.580 9.800 10.480 1.00 0.00 ATOM 18171 OH2 SOL 1023 56.310 54.920 61.610 1.00 0.00 ATOM 18172 H1 SOL 1023 56.480 54.910 60.670 1.00 0.00 ATOM 18173 H2 SOL 1023 57.150 55.150 62.010 1.00 0.00 ATOM 18174 OH2 SOL 1024 13.930 15.520 66.230 1.00 0.00 ATOM 18175 H1 SOL 1024 14.880 15.440 66.360 1.00 0.00 ATOM 18176 H2 SOL 1024 13.780 15.180 65.350 1.00 0.00 ATOM 18177 OH2 SOL 1025 16.000 17.290 8.910 1.00 0.00 ATOM 18178 H1 SOL 1025 16.450 17.430 8.080 1.00 0.00 ATOM 18179 H2 SOL 1025 15.210 16.790 8.680 1.00 0.00 ATOM 18180 OH2 SOL 1026 20.040 23.960 8.860 1.00 0.00 ATOM 18181 H1 SOL 1026 20.100 23.410 8.080 1.00 0.00 ATOM 18182 H2 SOL 1026 20.950 24.220 9.030 1.00 0.00 ATOM 18183 OH2 SOL 1027 29.430 25.580 19.260 1.00 0.00 ATOM 18184 H1 SOL 1027 28.680 25.240 19.750 1.00 0.00 ATOM 18185 H2 SOL 1027 29.080 25.810 18.410 1.00 0.00 ATOM 18186 OH2 SOL 1028 58.430 0.410 15.130 1.00 0.00 ATOM 18187 H1 SOL 1028 59.230 0.380 15.660 1.00 0.00 ATOM 18188 H2 SOL 1028 58.540 1.190 14.580 1.00 0.00 ATOM 18189 OH2 SOL 1029 45.430 27.560 63.270 1.00 0.00 ATOM 18190 H1 SOL 1029 44.700 27.890 63.790 1.00 0.00 ATOM 18191 H2 SOL 1029 45.750 26.800 63.760 1.00 0.00 ATOM 18192 OH2 SOL 1030 49.060 35.710 62.710 1.00 0.00 ATOM 18193 H1 SOL 1030 49.630 36.480 62.700 1.00 0.00 ATOM 18194 H2 SOL 1030 49.660 34.970 62.810 1.00 0.00 ATOM 18195 OH2 SOL 1031 23.250 23.570 62.850 1.00 0.00 ATOM 18196 H1 SOL 1031 22.330 23.830 62.870 1.00 0.00 ATOM 18197 H2 SOL 1031 23.600 24.030 62.090 1.00 0.00 ATOM 18198 OH2 SOL 1032 53.280 41.250 74.380 1.00 0.00 ATOM 18199 H1 SOL 1032 52.710 40.950 75.080 1.00 0.00 ATOM 18200 H2 SOL 1032 53.560 40.450 73.930 1.00 0.00 ATOM 18201 OH2 SOL 1033 35.950 52.060 66.910 1.00 0.00 ATOM 18202 H1 SOL 1033 35.900 52.030 65.960 1.00 0.00 ATOM 18203 H2 SOL 1033 35.600 51.220 67.200 1.00 0.00 ATOM 18204 OH2 SOL 1034 35.850 26.680 10.650 1.00 0.00 ATOM 18205 H1 SOL 1034 35.010 27.140 10.680 1.00 0.00 ATOM 18206 H2 SOL 1034 35.630 25.770 10.870 1.00 0.00 ATOM 18207 OH2 SOL 1035 27.240 55.760 6.300 1.00 0.00 ATOM 18208 H1 SOL 1035 27.010 55.310 7.110 1.00 0.00 ATOM 18209 H2 SOL 1035 27.650 55.090 5.760 1.00 0.00 ATOM 18210 OH2 SOL 1036 7.280 13.250 20.170 1.00 0.00 ATOM 18211 H1 SOL 1036 6.370 13.480 20.350 1.00 0.00 ATOM 18212 H2 SOL 1036 7.730 13.370 21.010 1.00 0.00 ATOM 18213 OH2 SOL 1037 21.480 2.560 17.230 1.00 0.00 ATOM 18214 H1 SOL 1037 20.790 3.170 17.470 1.00 0.00 ATOM 18215 H2 SOL 1037 22.280 2.940 17.610 1.00 0.00 ATOM 18216 OH2 SOL 1038 57.630 24.440 21.830 1.00 0.00 ATOM 18217 H1 SOL 1038 57.730 23.960 22.650 1.00 0.00 ATOM 18218 H2 SOL 1038 58.520 24.510 21.480 1.00 0.00 ATOM 18219 OH2 SOL 1039 28.940 22.620 6.330 1.00 0.00 ATOM 18220 H1 SOL 1039 28.060 22.960 6.510 1.00 0.00 ATOM 18221 H2 SOL 1039 29.530 23.290 6.660 1.00 0.00 ATOM 18222 OH2 SOL 1040 51.140 24.070 72.460 1.00 0.00 ATOM 18223 H1 SOL 1040 51.900 24.030 71.880 1.00 0.00 ATOM 18224 H2 SOL 1040 51.520 24.130 73.340 1.00 0.00 ATOM 18225 OH2 SOL 1041 17.100 58.810 13.730 1.00 0.00 ATOM 18226 H1 SOL 1041 17.610 58.060 14.050 1.00 0.00 ATOM 18227 H2 SOL 1041 17.760 59.440 13.440 1.00 0.00 ATOM 18228 OH2 SOL 1042 38.320 23.040 2.300 1.00 0.00 ATOM 18229 H1 SOL 1042 37.620 22.850 2.930 1.00 0.00 ATOM 18230 H2 SOL 1042 39.050 23.340 2.840 1.00 0.00 ATOM 18231 OH2 SOL 1043 31.000 25.630 67.890 1.00 0.00 ATOM 18232 H1 SOL 1043 30.310 25.650 68.560 1.00 0.00 ATOM 18233 H2 SOL 1043 31.600 24.960 68.190 1.00 0.00 ATOM 18234 OH2 SOL 1044 14.620 46.480 79.630 1.00 0.00 ATOM 18235 H1 SOL 1044 13.730 46.210 79.410 1.00 0.00 ATOM 18236 H2 SOL 1044 14.830 45.980 80.420 1.00 0.00 ATOM 18237 OH2 SOL 1045 36.020 32.460 16.850 1.00 0.00 ATOM 18238 H1 SOL 1045 36.890 32.100 16.660 1.00 0.00 ATOM 18239 H2 SOL 1045 35.820 32.160 17.740 1.00 0.00 ATOM 18240 OH2 SOL 1046 51.130 8.880 74.850 1.00 0.00 ATOM 18241 H1 SOL 1046 50.380 8.770 74.260 1.00 0.00 ATOM 18242 H2 SOL 1046 51.860 9.090 74.270 1.00 0.00 ATOM 18243 OH2 SOL 1047 9.470 30.540 7.160 1.00 0.00 ATOM 18244 H1 SOL 1047 8.930 31.290 6.920 1.00 0.00 ATOM 18245 H2 SOL 1047 8.860 29.810 7.230 1.00 0.00 ATOM 18246 OH2 SOL 1048 48.190 30.130 81.040 1.00 0.00 ATOM 18247 H1 SOL 1048 48.100 29.990 80.100 1.00 0.00 ATOM 18248 H2 SOL 1048 47.350 30.490 81.320 1.00 0.00 ATOM 18249 OH2 SOL 1049 25.740 1.170 84.330 1.00 0.00 ATOM 18250 H1 SOL 1049 24.880 1.200 83.900 1.00 0.00 ATOM 18251 H2 SOL 1049 25.960 0.240 84.350 1.00 0.00 ATOM 18252 OH2 SOL 1050 13.870 5.770 71.850 1.00 0.00 ATOM 18253 H1 SOL 1050 14.100 6.430 71.190 1.00 0.00 ATOM 18254 H2 SOL 1050 12.960 5.550 71.660 1.00 0.00 ATOM 18255 OH2 SOL 1051 52.810 1.270 64.840 1.00 0.00 ATOM 18256 H1 SOL 1051 52.870 2.220 64.930 1.00 0.00 ATOM 18257 H2 SOL 1051 52.410 0.970 65.660 1.00 0.00 ATOM 18258 OH2 SOL 1052 41.110 10.470 5.390 1.00 0.00 ATOM 18259 H1 SOL 1052 40.190 10.720 5.520 1.00 0.00 ATOM 18260 H2 SOL 1052 41.200 9.660 5.890 1.00 0.00 ATOM 18261 OH2 SOL 1053 43.330 58.800 23.970 1.00 0.00 ATOM 18262 H1 SOL 1053 42.630 58.640 23.340 1.00 0.00 ATOM 18263 H2 SOL 1053 43.320 59.750 24.110 1.00 0.00 ATOM 18264 OH2 SOL 1054 54.250 3.170 17.760 1.00 0.00 ATOM 18265 H1 SOL 1054 54.080 3.470 16.870 1.00 0.00 ATOM 18266 H2 SOL 1054 55.200 3.210 17.850 1.00 0.00 ATOM 18267 OH2 SOL 1055 24.320 19.010 21.130 1.00 0.00 ATOM 18268 H1 SOL 1055 24.900 18.470 20.580 1.00 0.00 ATOM 18269 H2 SOL 1055 24.590 19.910 20.940 1.00 0.00 ATOM 18270 OH2 SOL 1056 21.780 58.390 16.050 1.00 0.00 ATOM 18271 H1 SOL 1056 21.020 57.980 15.630 1.00 0.00 ATOM 18272 H2 SOL 1056 22.370 57.660 16.220 1.00 0.00 ATOM 18273 OH2 SOL 1057 54.670 2.010 0.600 1.00 0.00 ATOM 18274 H1 SOL 1057 53.810 1.860 0.200 1.00 0.00 ATOM 18275 H2 SOL 1057 55.200 1.280 0.290 1.00 0.00 ATOM 18276 OH2 SOL 1058 4.710 41.140 9.960 1.00 0.00 ATOM 18277 H1 SOL 1058 5.400 40.500 9.780 1.00 0.00 ATOM 18278 H2 SOL 1058 4.980 41.920 9.470 1.00 0.00 ATOM 18279 OH2 SOL 1059 23.990 7.320 15.150 1.00 0.00 ATOM 18280 H1 SOL 1059 24.600 7.590 15.840 1.00 0.00 ATOM 18281 H2 SOL 1059 23.410 8.070 15.030 1.00 0.00 ATOM 18282 OH2 SOL 1060 35.300 53.790 80.080 1.00 0.00 ATOM 18283 H1 SOL 1060 35.990 54.380 80.380 1.00 0.00 ATOM 18284 H2 SOL 1060 35.730 52.940 79.990 1.00 0.00 ATOM 18285 OH2 SOL 1061 31.880 29.550 76.460 1.00 0.00 ATOM 18286 H1 SOL 1061 31.710 28.750 75.960 1.00 0.00 ATOM 18287 H2 SOL 1061 32.260 30.160 75.830 1.00 0.00 ATOM 18288 OH2 SOL 1062 53.380 28.940 81.350 1.00 0.00 ATOM 18289 H1 SOL 1062 54.100 29.000 81.980 1.00 0.00 ATOM 18290 H2 SOL 1062 52.590 28.950 81.890 1.00 0.00 ATOM 18291 OH2 SOL 1063 53.590 17.820 14.470 1.00 0.00 ATOM 18292 H1 SOL 1063 54.160 17.160 14.870 1.00 0.00 ATOM 18293 H2 SOL 1063 52.850 17.900 15.080 1.00 0.00 ATOM 18294 OH2 SOL 1064 0.970 12.190 81.490 1.00 0.00 ATOM 18295 H1 SOL 1064 1.000 11.340 81.910 1.00 0.00 ATOM 18296 H2 SOL 1064 0.350 12.080 80.770 1.00 0.00 ATOM 18297 OH2 SOL 1065 24.210 49.340 71.450 1.00 0.00 ATOM 18298 H1 SOL 1065 23.760 48.510 71.570 1.00 0.00 ATOM 18299 H2 SOL 1065 24.080 49.810 72.270 1.00 0.00 ATOM 18300 OH2 SOL 1066 13.610 14.820 81.930 1.00 0.00 ATOM 18301 H1 SOL 1066 12.960 14.430 82.520 1.00 0.00 ATOM 18302 H2 SOL 1066 14.260 14.140 81.800 1.00 0.00 ATOM 18303 OH2 SOL 1067 56.950 53.810 -0.110 1.00 0.00 ATOM 18304 H1 SOL 1067 56.000 53.680 -0.050 1.00 0.00 ATOM 18305 H2 SOL 1067 57.230 53.870 0.810 1.00 0.00 ATOM 18306 OH2 SOL 1068 5.480 27.150 20.010 1.00 0.00 ATOM 18307 H1 SOL 1068 5.420 27.170 19.050 1.00 0.00 ATOM 18308 H2 SOL 1068 5.310 26.240 20.240 1.00 0.00 ATOM 18309 OH2 SOL 1069 57.610 48.110 81.040 1.00 0.00 ATOM 18310 H1 SOL 1069 58.130 48.620 81.660 1.00 0.00 ATOM 18311 H2 SOL 1069 56.700 48.320 81.250 1.00 0.00 ATOM 18312 OH2 SOL 1070 45.030 17.770 8.730 1.00 0.00 ATOM 18313 H1 SOL 1070 45.340 17.810 9.630 1.00 0.00 ATOM 18314 H2 SOL 1070 44.910 18.680 8.470 1.00 0.00 ATOM 18315 OH2 SOL 1071 46.750 59.560 12.420 1.00 0.00 ATOM 18316 H1 SOL 1071 46.070 58.910 12.210 1.00 0.00 ATOM 18317 H2 SOL 1071 47.500 59.300 11.880 1.00 0.00 ATOM 18318 OH2 SOL 1072 52.740 32.150 15.730 1.00 0.00 ATOM 18319 H1 SOL 1072 53.170 32.970 15.960 1.00 0.00 ATOM 18320 H2 SOL 1072 52.940 32.030 14.800 1.00 0.00 ATOM 18321 OH2 SOL 1073 44.720 8.260 66.340 1.00 0.00 ATOM 18322 H1 SOL 1073 44.000 7.660 66.490 1.00 0.00 ATOM 18323 H2 SOL 1073 44.930 8.160 65.410 1.00 0.00 ATOM 18324 OH2 SOL 1074 0.110 20.260 21.750 1.00 0.00 ATOM 18325 H1 SOL 1074 -0.580 20.350 21.090 1.00 0.00 ATOM 18326 H2 SOL 1074 0.800 19.760 21.310 1.00 0.00 ATOM 18327 OH2 SOL 1075 39.540 14.650 18.280 1.00 0.00 ATOM 18328 H1 SOL 1075 39.550 13.710 18.130 1.00 0.00 ATOM 18329 H2 SOL 1075 38.900 14.990 17.650 1.00 0.00 ATOM 18330 OH2 SOL 1076 28.610 14.350 18.700 1.00 0.00 ATOM 18331 H1 SOL 1076 27.860 14.580 18.150 1.00 0.00 ATOM 18332 H2 SOL 1076 29.030 13.630 18.230 1.00 0.00 ATOM 18333 OH2 SOL 1077 10.720 58.660 79.640 1.00 0.00 ATOM 18334 H1 SOL 1077 10.620 59.020 80.520 1.00 0.00 ATOM 18335 H2 SOL 1077 10.100 59.140 79.110 1.00 0.00 ATOM 18336 OH2 SOL 1078 49.870 45.210 25.960 1.00 0.00 ATOM 18337 H1 SOL 1078 50.610 44.700 26.290 1.00 0.00 ATOM 18338 H2 SOL 1078 50.170 46.120 25.990 1.00 0.00 ATOM 18339 OH2 SOL 1079 46.160 55.260 1.660 1.00 0.00 ATOM 18340 H1 SOL 1079 45.780 55.770 0.940 1.00 0.00 ATOM 18341 H2 SOL 1079 47.010 55.670 1.820 1.00 0.00 ATOM 18342 OH2 SOL 1080 21.990 2.820 2.090 1.00 0.00 ATOM 18343 H1 SOL 1080 22.660 3.390 1.710 1.00 0.00 ATOM 18344 H2 SOL 1080 21.180 3.100 1.670 1.00 0.00 ATOM 18345 OH2 SOL 1081 0.760 31.710 15.600 1.00 0.00 ATOM 18346 H1 SOL 1081 0.450 32.220 16.360 1.00 0.00 ATOM 18347 H2 SOL 1081 0.960 32.370 14.940 1.00 0.00 ATOM 18348 OH2 SOL 1082 32.380 11.110 63.370 1.00 0.00 ATOM 18349 H1 SOL 1082 31.640 11.230 63.960 1.00 0.00 ATOM 18350 H2 SOL 1082 33.130 11.460 63.850 1.00 0.00 ATOM 18351 OH2 SOL 1083 39.520 25.930 69.530 1.00 0.00 ATOM 18352 H1 SOL 1083 39.150 26.730 69.900 1.00 0.00 ATOM 18353 H2 SOL 1083 39.090 25.840 68.680 1.00 0.00 ATOM 18354 OH2 SOL 1084 6.910 34.510 73.390 1.00 0.00 ATOM 18355 H1 SOL 1084 6.210 34.940 73.880 1.00 0.00 ATOM 18356 H2 SOL 1084 6.780 33.570 73.560 1.00 0.00 ATOM 18357 OH2 SOL 1085 54.040 7.110 70.480 1.00 0.00 ATOM 18358 H1 SOL 1085 54.540 6.880 71.270 1.00 0.00 ATOM 18359 H2 SOL 1085 54.700 7.190 69.800 1.00 0.00 ATOM 18360 OH2 SOL 1086 19.910 29.370 2.460 1.00 0.00 ATOM 18361 H1 SOL 1086 20.700 28.840 2.540 1.00 0.00 ATOM 18362 H2 SOL 1086 20.110 30.190 2.910 1.00 0.00 ATOM 18363 OH2 SOL 1087 57.080 25.160 17.590 1.00 0.00 ATOM 18364 H1 SOL 1087 57.010 24.430 18.210 1.00 0.00 ATOM 18365 H2 SOL 1087 56.220 25.580 17.630 1.00 0.00 ATOM 18366 OH2 SOL 1088 0.720 55.260 76.980 1.00 0.00 ATOM 18367 H1 SOL 1088 0.920 55.230 77.920 1.00 0.00 ATOM 18368 H2 SOL 1088 0.460 56.160 76.820 1.00 0.00 ATOM 18369 OH2 SOL 1089 53.020 13.860 70.530 1.00 0.00 ATOM 18370 H1 SOL 1089 53.470 13.690 71.360 1.00 0.00 ATOM 18371 H2 SOL 1089 53.550 13.400 69.870 1.00 0.00 ATOM 18372 OH2 SOL 1090 7.440 9.270 69.200 1.00 0.00 ATOM 18373 H1 SOL 1090 6.870 8.950 69.900 1.00 0.00 ATOM 18374 H2 SOL 1090 8.300 9.320 69.600 1.00 0.00 ATOM 18375 OH2 SOL 1091 27.230 53.060 22.360 1.00 0.00 ATOM 18376 H1 SOL 1091 27.840 52.360 22.120 1.00 0.00 ATOM 18377 H2 SOL 1091 26.570 52.620 22.910 1.00 0.00 ATOM 18378 OH2 SOL 1092 27.280 53.830 75.840 1.00 0.00 ATOM 18379 H1 SOL 1092 26.470 53.530 75.440 1.00 0.00 ATOM 18380 H2 SOL 1092 27.010 54.310 76.620 1.00 0.00 ATOM 18381 OH2 SOL 1093 45.570 34.810 12.330 1.00 0.00 ATOM 18382 H1 SOL 1093 46.440 34.440 12.250 1.00 0.00 ATOM 18383 H2 SOL 1093 45.720 35.710 12.640 1.00 0.00 ATOM 18384 OH2 SOL 1094 38.380 40.430 10.690 1.00 0.00 ATOM 18385 H1 SOL 1094 37.450 40.330 10.870 1.00 0.00 ATOM 18386 H2 SOL 1094 38.760 40.740 11.510 1.00 0.00 ATOM 18387 OH2 SOL 1095 44.770 47.390 65.470 1.00 0.00 ATOM 18388 H1 SOL 1095 44.500 48.150 65.980 1.00 0.00 ATOM 18389 H2 SOL 1095 45.680 47.580 65.220 1.00 0.00 ATOM 18390 OH2 SOL 1096 6.910 43.070 67.970 1.00 0.00 ATOM 18391 H1 SOL 1096 7.490 42.710 68.640 1.00 0.00 ATOM 18392 H2 SOL 1096 7.440 43.720 67.520 1.00 0.00 ATOM 18393 OH2 SOL 1097 57.110 18.700 14.240 1.00 0.00 ATOM 18394 H1 SOL 1097 56.670 19.560 14.200 1.00 0.00 ATOM 18395 H2 SOL 1097 57.430 18.640 15.140 1.00 0.00 ATOM 18396 OH2 SOL 1098 8.670 50.960 20.540 1.00 0.00 ATOM 18397 H1 SOL 1098 8.080 51.670 20.790 1.00 0.00 ATOM 18398 H2 SOL 1098 8.180 50.450 19.900 1.00 0.00 ATOM 18399 OH2 SOL 1099 19.840 42.260 16.700 1.00 0.00 ATOM 18400 H1 SOL 1099 20.790 42.240 16.650 1.00 0.00 ATOM 18401 H2 SOL 1099 19.570 41.360 16.510 1.00 0.00 ATOM 18402 OH2 SOL 1100 30.860 6.870 84.630 1.00 0.00 ATOM 18403 H1 SOL 1100 30.260 6.950 83.890 1.00 0.00 ATOM 18404 H2 SOL 1100 30.870 7.730 85.040 1.00 0.00 ATOM 18405 OH2 SOL 1101 12.440 6.070 81.780 1.00 0.00 ATOM 18406 H1 SOL 1101 12.640 6.770 81.150 1.00 0.00 ATOM 18407 H2 SOL 1101 12.400 6.520 82.630 1.00 0.00 ATOM 18408 OH2 SOL 1102 19.500 50.350 24.800 1.00 0.00 ATOM 18409 H1 SOL 1102 20.290 50.880 24.720 1.00 0.00 ATOM 18410 H2 SOL 1102 18.780 50.950 24.570 1.00 0.00 ATOM 18411 OH2 SOL 1103 1.200 38.080 5.420 1.00 0.00 ATOM 18412 H1 SOL 1103 0.490 37.760 4.860 1.00 0.00 ATOM 18413 H2 SOL 1103 1.820 37.350 5.470 1.00 0.00 ATOM 18414 OH2 SOL 1104 21.630 41.090 0.990 1.00 0.00 ATOM 18415 H1 SOL 1104 21.960 40.280 0.600 1.00 0.00 ATOM 18416 H2 SOL 1104 20.780 41.240 0.560 1.00 0.00 ATOM 18417 OH2 SOL 1105 21.040 41.570 3.680 1.00 0.00 ATOM 18418 H1 SOL 1105 21.670 42.270 3.880 1.00 0.00 ATOM 18419 H2 SOL 1105 21.120 41.460 2.730 1.00 0.00 ATOM 18420 OH2 SOL 1106 52.570 8.410 23.970 1.00 0.00 ATOM 18421 H1 SOL 1106 53.370 8.360 24.490 1.00 0.00 ATOM 18422 H2 SOL 1106 52.590 9.270 23.570 1.00 0.00 ATOM 18423 OH2 SOL 1107 9.600 5.600 82.700 1.00 0.00 ATOM 18424 H1 SOL 1107 10.440 5.850 82.310 1.00 0.00 ATOM 18425 H2 SOL 1107 9.170 6.430 82.880 1.00 0.00 ATOM 18426 OH2 SOL 1108 6.470 7.030 18.430 1.00 0.00 ATOM 18427 H1 SOL 1108 6.900 7.590 19.090 1.00 0.00 ATOM 18428 H2 SOL 1108 7.200 6.630 17.960 1.00 0.00 ATOM 18429 OH2 SOL 1109 23.600 45.270 63.590 1.00 0.00 ATOM 18430 H1 SOL 1109 24.140 45.340 64.390 1.00 0.00 ATOM 18431 H2 SOL 1109 22.790 45.720 63.810 1.00 0.00 ATOM 18432 OH2 SOL 1110 35.980 17.720 17.850 1.00 0.00 ATOM 18433 H1 SOL 1110 36.240 18.470 17.310 1.00 0.00 ATOM 18434 H2 SOL 1110 35.030 17.690 17.780 1.00 0.00 ATOM 18435 OH2 SOL 1111 41.200 8.680 12.780 1.00 0.00 ATOM 18436 H1 SOL 1111 41.280 7.780 13.090 1.00 0.00 ATOM 18437 H2 SOL 1111 42.100 9.010 12.780 1.00 0.00 ATOM 18438 OH2 SOL 1112 49.210 22.930 62.740 1.00 0.00 ATOM 18439 H1 SOL 1112 48.690 23.220 62.000 1.00 0.00 ATOM 18440 H2 SOL 1112 48.680 22.250 63.170 1.00 0.00 ATOM 18441 OH2 SOL 1113 44.120 15.940 0.030 1.00 0.00 ATOM 18442 H1 SOL 1113 43.400 15.530 -0.450 1.00 0.00 ATOM 18443 H2 SOL 1113 43.720 16.230 0.850 1.00 0.00 ATOM 18444 OH2 SOL 1114 16.190 13.490 77.700 1.00 0.00 ATOM 18445 H1 SOL 1114 15.350 13.700 78.110 1.00 0.00 ATOM 18446 H2 SOL 1114 16.020 12.700 77.190 1.00 0.00 ATOM 18447 OH2 SOL 1115 46.470 58.830 16.240 1.00 0.00 ATOM 18448 H1 SOL 1115 47.280 59.080 15.810 1.00 0.00 ATOM 18449 H2 SOL 1115 46.740 58.420 17.060 1.00 0.00 ATOM 18450 OH2 SOL 1116 46.660 45.930 80.080 1.00 0.00 ATOM 18451 H1 SOL 1116 47.160 45.500 79.390 1.00 0.00 ATOM 18452 H2 SOL 1116 46.860 45.430 80.870 1.00 0.00 ATOM 18453 OH2 SOL 1117 14.280 25.020 4.410 1.00 0.00 ATOM 18454 H1 SOL 1117 13.730 24.920 3.640 1.00 0.00 ATOM 18455 H2 SOL 1117 14.920 25.690 4.160 1.00 0.00 ATOM 18456 OH2 SOL 1118 14.210 15.930 71.840 1.00 0.00 ATOM 18457 H1 SOL 1118 14.910 16.570 71.880 1.00 0.00 ATOM 18458 H2 SOL 1118 14.070 15.770 70.910 1.00 0.00 ATOM 18459 OH2 SOL 1119 18.850 32.660 83.710 1.00 0.00 ATOM 18460 H1 SOL 1119 18.100 32.090 83.570 1.00 0.00 ATOM 18461 H2 SOL 1119 18.960 33.110 82.870 1.00 0.00 ATOM 18462 OH2 SOL 1120 56.920 16.740 6.370 1.00 0.00 ATOM 18463 H1 SOL 1120 56.940 15.940 6.900 1.00 0.00 ATOM 18464 H2 SOL 1120 56.960 17.450 7.010 1.00 0.00 ATOM 18465 OH2 SOL 1121 49.070 7.500 70.450 1.00 0.00 ATOM 18466 H1 SOL 1121 48.310 7.790 69.930 1.00 0.00 ATOM 18467 H2 SOL 1121 49.780 8.060 70.160 1.00 0.00 ATOM 18468 OH2 SOL 1122 51.460 45.110 64.870 1.00 0.00 ATOM 18469 H1 SOL 1122 51.650 44.270 64.460 1.00 0.00 ATOM 18470 H2 SOL 1122 50.880 45.550 64.250 1.00 0.00 ATOM 18471 OH2 SOL 1123 33.070 59.200 17.400 1.00 0.00 ATOM 18472 H1 SOL 1123 32.670 58.450 17.850 1.00 0.00 ATOM 18473 H2 SOL 1123 32.500 59.940 17.600 1.00 0.00 ATOM 18474 OH2 SOL 1124 48.320 8.700 1.950 1.00 0.00 ATOM 18475 H1 SOL 1124 48.940 9.100 2.560 1.00 0.00 ATOM 18476 H2 SOL 1124 48.710 8.840 1.090 1.00 0.00 ATOM 18477 OH2 SOL 1125 0.270 38.950 19.410 1.00 0.00 ATOM 18478 H1 SOL 1125 -0.450 39.030 20.040 1.00 0.00 ATOM 18479 H2 SOL 1125 1.000 38.610 19.930 1.00 0.00 ATOM 18480 OH2 SOL 1126 46.760 17.440 14.280 1.00 0.00 ATOM 18481 H1 SOL 1126 47.580 17.100 13.920 1.00 0.00 ATOM 18482 H2 SOL 1126 46.570 16.860 15.020 1.00 0.00 ATOM 18483 OH2 SOL 1127 14.220 4.360 4.850 1.00 0.00 ATOM 18484 H1 SOL 1127 13.350 4.250 4.470 1.00 0.00 ATOM 18485 H2 SOL 1127 14.170 5.190 5.330 1.00 0.00 ATOM 18486 OH2 SOL 1128 1.450 52.640 19.630 1.00 0.00 ATOM 18487 H1 SOL 1128 1.370 51.730 19.910 1.00 0.00 ATOM 18488 H2 SOL 1128 2.290 52.690 19.180 1.00 0.00 ATOM 18489 OH2 SOL 1129 50.060 16.370 85.010 1.00 0.00 ATOM 18490 H1 SOL 1129 50.380 15.670 84.440 1.00 0.00 ATOM 18491 H2 SOL 1129 49.430 16.840 84.470 1.00 0.00 ATOM 18492 OH2 SOL 1130 26.630 49.560 83.780 1.00 0.00 ATOM 18493 H1 SOL 1130 27.220 49.810 83.060 1.00 0.00 ATOM 18494 H2 SOL 1130 25.930 49.070 83.350 1.00 0.00 ATOM 18495 OH2 SOL 1131 24.500 41.490 1.550 1.00 0.00 ATOM 18496 H1 SOL 1131 24.910 40.770 1.070 1.00 0.00 ATOM 18497 H2 SOL 1131 23.620 41.550 1.180 1.00 0.00 ATOM 18498 OH2 SOL 1132 16.120 24.500 25.140 1.00 0.00 ATOM 18499 H1 SOL 1132 16.650 24.140 25.840 1.00 0.00 ATOM 18500 H2 SOL 1132 16.430 24.060 24.350 1.00 0.00 ATOM 18501 OH2 SOL 1133 11.930 13.550 83.640 1.00 0.00 ATOM 18502 H1 SOL 1133 12.320 12.920 84.240 1.00 0.00 ATOM 18503 H2 SOL 1133 11.590 13.020 82.920 1.00 0.00 ATOM 18504 OH2 SOL 1134 11.090 47.520 61.290 1.00 0.00 ATOM 18505 H1 SOL 1134 10.990 48.010 62.110 1.00 0.00 ATOM 18506 H2 SOL 1134 10.200 47.360 60.990 1.00 0.00 ATOM 18507 OH2 SOL 1135 42.390 58.860 63.680 1.00 0.00 ATOM 18508 H1 SOL 1135 43.030 59.010 62.990 1.00 0.00 ATOM 18509 H2 SOL 1135 41.580 58.670 63.210 1.00 0.00 ATOM 18510 OH2 SOL 1136 30.120 15.500 15.570 1.00 0.00 ATOM 18511 H1 SOL 1136 29.680 16.340 15.730 1.00 0.00 ATOM 18512 H2 SOL 1136 29.570 15.060 14.920 1.00 0.00 ATOM 18513 OH2 SOL 1137 1.610 51.150 12.040 1.00 0.00 ATOM 18514 H1 SOL 1137 1.920 52.020 12.320 1.00 0.00 ATOM 18515 H2 SOL 1137 0.890 50.950 12.640 1.00 0.00 ATOM 18516 OH2 SOL 1138 27.070 31.050 80.320 1.00 0.00 ATOM 18517 H1 SOL 1138 28.030 31.050 80.300 1.00 0.00 ATOM 18518 H2 SOL 1138 26.820 30.130 80.190 1.00 0.00 ATOM 18519 OH2 SOL 1139 17.500 46.940 82.060 1.00 0.00 ATOM 18520 H1 SOL 1139 17.370 46.440 81.250 1.00 0.00 ATOM 18521 H2 SOL 1139 18.360 46.680 82.370 1.00 0.00 ATOM 18522 OH2 SOL 1140 30.790 60.520 7.320 1.00 0.00 ATOM 18523 H1 SOL 1140 31.340 59.960 6.780 1.00 0.00 ATOM 18524 H2 SOL 1140 30.110 60.830 6.730 1.00 0.00 ATOM 18525 OH2 SOL 1141 31.300 38.720 19.680 1.00 0.00 ATOM 18526 H1 SOL 1141 31.980 38.890 20.330 1.00 0.00 ATOM 18527 H2 SOL 1141 30.490 39.020 20.090 1.00 0.00 ATOM 18528 OH2 SOL 1142 35.150 18.960 3.250 1.00 0.00 ATOM 18529 H1 SOL 1142 35.470 19.770 3.630 1.00 0.00 ATOM 18530 H2 SOL 1142 34.720 19.230 2.440 1.00 0.00 ATOM 18531 OH2 SOL 1143 8.730 8.660 65.040 1.00 0.00 ATOM 18532 H1 SOL 1143 8.090 9.320 64.770 1.00 0.00 ATOM 18533 H2 SOL 1143 9.080 8.310 64.220 1.00 0.00 ATOM 18534 OH2 SOL 1144 53.830 56.130 21.200 1.00 0.00 ATOM 18535 H1 SOL 1144 52.970 55.760 21.020 1.00 0.00 ATOM 18536 H2 SOL 1144 53.740 56.510 22.080 1.00 0.00 ATOM 18537 OH2 SOL 1145 29.350 37.460 15.710 1.00 0.00 ATOM 18538 H1 SOL 1145 28.630 36.830 15.760 1.00 0.00 ATOM 18539 H2 SOL 1145 29.810 37.210 14.900 1.00 0.00 ATOM 18540 OH2 SOL 1146 50.380 32.470 2.260 1.00 0.00 ATOM 18541 H1 SOL 1146 50.690 32.230 1.390 1.00 0.00 ATOM 18542 H2 SOL 1146 50.070 33.370 2.160 1.00 0.00 ATOM 18543 OH2 SOL 1147 32.680 39.140 22.050 1.00 0.00 ATOM 18544 H1 SOL 1147 32.590 39.600 22.880 1.00 0.00 ATOM 18545 H2 SOL 1147 33.340 39.640 21.560 1.00 0.00 ATOM 18546 OH2 SOL 1148 58.300 14.910 64.750 1.00 0.00 ATOM 18547 H1 SOL 1148 58.820 14.470 65.420 1.00 0.00 ATOM 18548 H2 SOL 1148 57.480 15.140 65.200 1.00 0.00 ATOM 18549 OH2 SOL 1149 25.550 2.040 76.180 1.00 0.00 ATOM 18550 H1 SOL 1149 25.760 1.330 75.570 1.00 0.00 ATOM 18551 H2 SOL 1149 24.640 1.890 76.430 1.00 0.00 ATOM 18552 OH2 SOL 1150 41.700 44.970 64.940 1.00 0.00 ATOM 18553 H1 SOL 1150 41.810 44.460 65.750 1.00 0.00 ATOM 18554 H2 SOL 1150 41.940 45.870 65.190 1.00 0.00 ATOM 18555 OH2 SOL 1151 32.890 31.970 8.300 1.00 0.00 ATOM 18556 H1 SOL 1151 33.100 31.760 7.390 1.00 0.00 ATOM 18557 H2 SOL 1151 33.610 31.590 8.800 1.00 0.00 ATOM 18558 OH2 SOL 1152 21.470 20.930 17.900 1.00 0.00 ATOM 18559 H1 SOL 1152 22.280 21.400 17.690 1.00 0.00 ATOM 18560 H2 SOL 1152 21.770 20.050 18.140 1.00 0.00 ATOM 18561 OH2 SOL 1153 25.940 15.130 11.420 1.00 0.00 ATOM 18562 H1 SOL 1153 25.820 15.620 10.610 1.00 0.00 ATOM 18563 H2 SOL 1153 26.330 14.300 11.140 1.00 0.00 ATOM 18564 OH2 SOL 1154 45.270 42.700 61.610 1.00 0.00 ATOM 18565 H1 SOL 1154 44.780 42.580 60.800 1.00 0.00 ATOM 18566 H2 SOL 1154 45.320 43.640 61.730 1.00 0.00 ATOM 18567 OH2 SOL 1155 22.630 12.120 79.050 1.00 0.00 ATOM 18568 H1 SOL 1155 22.800 11.180 79.050 1.00 0.00 ATOM 18569 H2 SOL 1155 23.170 12.460 79.760 1.00 0.00 ATOM 18570 OH2 SOL 1156 45.500 41.940 84.660 1.00 0.00 ATOM 18571 H1 SOL 1156 45.120 41.380 85.340 1.00 0.00 ATOM 18572 H2 SOL 1156 44.830 41.960 83.970 1.00 0.00 ATOM 18573 OH2 SOL 1157 36.740 44.220 84.110 1.00 0.00 ATOM 18574 H1 SOL 1157 37.590 44.630 84.250 1.00 0.00 ATOM 18575 H2 SOL 1157 36.920 43.460 83.560 1.00 0.00 ATOM 18576 OH2 SOL 1158 7.640 32.310 6.080 1.00 0.00 ATOM 18577 H1 SOL 1158 7.550 33.130 5.600 1.00 0.00 ATOM 18578 H2 SOL 1158 6.800 31.860 5.950 1.00 0.00 ATOM 18579 OH2 SOL 1159 41.850 12.280 15.020 1.00 0.00 ATOM 18580 H1 SOL 1159 41.210 12.880 14.630 1.00 0.00 ATOM 18581 H2 SOL 1159 41.380 11.870 15.740 1.00 0.00 ATOM 18582 OH2 SOL 1160 53.050 53.570 8.820 1.00 0.00 ATOM 18583 H1 SOL 1160 52.790 52.760 8.380 1.00 0.00 ATOM 18584 H2 SOL 1160 53.650 54.000 8.210 1.00 0.00 ATOM 18585 OH2 SOL 1161 43.110 12.770 84.750 1.00 0.00 ATOM 18586 H1 SOL 1161 44.000 12.440 84.880 1.00 0.00 ATOM 18587 H2 SOL 1161 42.810 12.340 83.950 1.00 0.00 ATOM 18588 OH2 SOL 1162 59.790 25.130 6.540 1.00 0.00 ATOM 18589 H1 SOL 1162 59.610 25.580 5.720 1.00 0.00 ATOM 18590 H2 SOL 1162 59.160 25.490 7.160 1.00 0.00 ATOM 18591 OH2 SOL 1163 28.560 12.230 67.580 1.00 0.00 ATOM 18592 H1 SOL 1163 29.440 11.850 67.610 1.00 0.00 ATOM 18593 H2 SOL 1163 28.450 12.640 68.440 1.00 0.00 ATOM 18594 OH2 SOL 1164 42.740 54.240 13.700 1.00 0.00 ATOM 18595 H1 SOL 1164 42.830 54.870 12.990 1.00 0.00 ATOM 18596 H2 SOL 1164 41.810 54.000 13.680 1.00 0.00 ATOM 18597 OH2 SOL 1165 0.070 43.300 67.990 1.00 0.00 ATOM 18598 H1 SOL 1165 -0.560 44.010 67.840 1.00 0.00 ATOM 18599 H2 SOL 1165 0.820 43.530 67.440 1.00 0.00 ATOM 18600 OH2 SOL 1166 57.780 10.470 1.480 1.00 0.00 ATOM 18601 H1 SOL 1166 58.080 11.180 0.920 1.00 0.00 ATOM 18602 H2 SOL 1166 58.490 10.350 2.120 1.00 0.00 ATOM 18603 OH2 SOL 1167 1.550 31.370 64.280 1.00 0.00 ATOM 18604 H1 SOL 1167 0.600 31.420 64.220 1.00 0.00 ATOM 18605 H2 SOL 1167 1.780 30.570 63.800 1.00 0.00 ATOM 18606 OH2 SOL 1168 58.040 54.040 15.480 1.00 0.00 ATOM 18607 H1 SOL 1168 57.230 53.890 15.960 1.00 0.00 ATOM 18608 H2 SOL 1168 58.730 53.710 16.050 1.00 0.00 ATOM 18609 OH2 SOL 1169 14.200 55.830 13.790 1.00 0.00 ATOM 18610 H1 SOL 1169 13.720 55.010 13.700 1.00 0.00 ATOM 18611 H2 SOL 1169 14.830 55.660 14.490 1.00 0.00 ATOM 18612 OH2 SOL 1170 45.390 44.150 73.540 1.00 0.00 ATOM 18613 H1 SOL 1170 44.630 43.570 73.620 1.00 0.00 ATOM 18614 H2 SOL 1170 45.900 43.770 72.830 1.00 0.00 ATOM 18615 OH2 SOL 1171 49.280 15.850 74.120 1.00 0.00 ATOM 18616 H1 SOL 1171 50.070 16.390 74.170 1.00 0.00 ATOM 18617 H2 SOL 1171 49.010 15.890 73.200 1.00 0.00 ATOM 18618 OH2 SOL 1172 57.860 3.310 80.720 1.00 0.00 ATOM 18619 H1 SOL 1172 57.190 3.920 80.420 1.00 0.00 ATOM 18620 H2 SOL 1172 57.480 2.900 81.500 1.00 0.00 ATOM 18621 OH2 SOL 1173 24.720 22.630 74.450 1.00 0.00 ATOM 18622 H1 SOL 1173 24.790 23.520 74.090 1.00 0.00 ATOM 18623 H2 SOL 1173 25.090 22.070 73.780 1.00 0.00 ATOM 18624 OH2 SOL 1174 25.190 29.200 12.800 1.00 0.00 ATOM 18625 H1 SOL 1174 25.380 28.980 11.880 1.00 0.00 ATOM 18626 H2 SOL 1174 25.580 30.070 12.920 1.00 0.00 ATOM 18627 OH2 SOL 1175 14.260 21.900 3.180 1.00 0.00 ATOM 18628 H1 SOL 1175 15.050 22.440 3.210 1.00 0.00 ATOM 18629 H2 SOL 1175 13.660 22.390 2.610 1.00 0.00 ATOM 18630 OH2 SOL 1176 59.110 11.190 10.660 1.00 0.00 ATOM 18631 H1 SOL 1176 60.060 11.200 10.790 1.00 0.00 ATOM 18632 H2 SOL 1176 58.740 11.440 11.510 1.00 0.00 ATOM 18633 OH2 SOL 1177 35.840 60.790 68.060 1.00 0.00 ATOM 18634 H1 SOL 1177 36.270 60.430 68.830 1.00 0.00 ATOM 18635 H2 SOL 1177 34.920 60.590 68.180 1.00 0.00 ATOM 18636 OH2 SOL 1178 1.470 29.250 69.060 1.00 0.00 ATOM 18637 H1 SOL 1178 2.270 29.710 69.310 1.00 0.00 ATOM 18638 H2 SOL 1178 1.080 28.980 69.890 1.00 0.00 ATOM 18639 OH2 SOL 1179 17.360 36.740 82.980 1.00 0.00 ATOM 18640 H1 SOL 1179 17.320 37.630 83.330 1.00 0.00 ATOM 18641 H2 SOL 1179 16.450 36.460 82.940 1.00 0.00 ATOM 18642 OH2 SOL 1180 12.610 37.630 17.550 1.00 0.00 ATOM 18643 H1 SOL 1180 11.740 37.260 17.390 1.00 0.00 ATOM 18644 H2 SOL 1180 13.090 36.930 17.990 1.00 0.00 ATOM 18645 OH2 SOL 1181 0.770 41.940 19.210 1.00 0.00 ATOM 18646 H1 SOL 1181 0.280 41.120 19.210 1.00 0.00 ATOM 18647 H2 SOL 1181 0.820 42.190 20.130 1.00 0.00 ATOM 18648 OH2 SOL 1182 10.660 7.580 7.440 1.00 0.00 ATOM 18649 H1 SOL 1182 10.130 7.270 8.160 1.00 0.00 ATOM 18650 H2 SOL 1182 11.560 7.510 7.750 1.00 0.00 ATOM 18651 OH2 SOL 1183 0.160 33.630 74.350 1.00 0.00 ATOM 18652 H1 SOL 1183 -0.430 34.210 73.870 1.00 0.00 ATOM 18653 H2 SOL 1183 0.340 34.080 75.170 1.00 0.00 ATOM 18654 OH2 SOL 1184 8.380 37.870 19.740 1.00 0.00 ATOM 18655 H1 SOL 1184 7.850 37.950 20.540 1.00 0.00 ATOM 18656 H2 SOL 1184 9.210 37.510 20.040 1.00 0.00 ATOM 18657 OH2 SOL 1185 15.220 2.310 75.260 1.00 0.00 ATOM 18658 H1 SOL 1185 14.640 2.690 74.600 1.00 0.00 ATOM 18659 H2 SOL 1185 14.750 1.550 75.590 1.00 0.00 ATOM 18660 OH2 SOL 1186 55.870 20.480 71.160 1.00 0.00 ATOM 18661 H1 SOL 1186 55.010 20.350 70.760 1.00 0.00 ATOM 18662 H2 SOL 1186 56.420 19.800 70.770 1.00 0.00 ATOM 18663 OH2 SOL 1187 7.580 60.630 71.830 1.00 0.00 ATOM 18664 H1 SOL 1187 7.230 60.210 71.040 1.00 0.00 ATOM 18665 H2 SOL 1187 6.810 60.980 72.280 1.00 0.00 ATOM 18666 OH2 SOL 1188 20.110 46.010 82.920 1.00 0.00 ATOM 18667 H1 SOL 1188 20.790 45.910 83.580 1.00 0.00 ATOM 18668 H2 SOL 1188 20.560 46.410 82.180 1.00 0.00 ATOM 18669 OH2 SOL 1189 44.940 60.910 81.190 1.00 0.00 ATOM 18670 H1 SOL 1189 44.860 60.310 80.450 1.00 0.00 ATOM 18671 H2 SOL 1189 45.880 61.070 81.270 1.00 0.00 ATOM 18672 OH2 SOL 1190 11.460 34.880 80.300 1.00 0.00 ATOM 18673 H1 SOL 1190 12.030 34.310 79.780 1.00 0.00 ATOM 18674 H2 SOL 1190 10.580 34.650 80.020 1.00 0.00 ATOM 18675 OH2 SOL 1191 54.750 16.800 70.570 1.00 0.00 ATOM 18676 H1 SOL 1191 55.560 16.490 70.190 1.00 0.00 ATOM 18677 H2 SOL 1191 54.150 16.900 69.830 1.00 0.00 ATOM 18678 OH2 SOL 1192 48.230 19.270 8.920 1.00 0.00 ATOM 18679 H1 SOL 1192 47.300 19.390 9.110 1.00 0.00 ATOM 18680 H2 SOL 1192 48.530 18.640 9.580 1.00 0.00 ATOM 18681 OH2 SOL 1193 26.280 36.230 76.360 1.00 0.00 ATOM 18682 H1 SOL 1193 26.120 35.410 76.830 1.00 0.00 ATOM 18683 H2 SOL 1193 26.800 36.750 76.960 1.00 0.00 ATOM 18684 OH2 SOL 1194 7.210 7.560 23.070 1.00 0.00 ATOM 18685 H1 SOL 1194 7.490 7.600 23.990 1.00 0.00 ATOM 18686 H2 SOL 1194 6.500 8.200 23.010 1.00 0.00 ATOM 18687 OH2 SOL 1195 45.770 51.150 59.940 1.00 0.00 ATOM 18688 H1 SOL 1195 45.760 52.100 60.030 1.00 0.00 ATOM 18689 H2 SOL 1195 46.530 50.960 59.390 1.00 0.00 ATOM 18690 OH2 SOL 1196 55.940 30.730 75.200 1.00 0.00 ATOM 18691 H1 SOL 1196 56.130 29.810 75.030 1.00 0.00 ATOM 18692 H2 SOL 1196 55.920 31.130 74.330 1.00 0.00 ATOM 18693 OH2 SOL 1197 58.950 44.230 73.390 1.00 0.00 ATOM 18694 H1 SOL 1197 58.320 44.230 74.110 1.00 0.00 ATOM 18695 H2 SOL 1197 59.290 43.340 73.370 1.00 0.00 ATOM 18696 OH2 SOL 1198 11.250 3.110 27.750 1.00 0.00 ATOM 18697 H1 SOL 1198 10.830 2.760 26.970 1.00 0.00 ATOM 18698 H2 SOL 1198 10.610 3.710 28.130 1.00 0.00 ATOM 18699 OH2 SOL 1199 11.840 44.570 70.700 1.00 0.00 ATOM 18700 H1 SOL 1199 12.530 45.150 71.010 1.00 0.00 ATOM 18701 H2 SOL 1199 11.910 43.790 71.250 1.00 0.00 ATOM 18702 OH2 SOL 1200 2.060 47.430 12.370 1.00 0.00 ATOM 18703 H1 SOL 1200 2.560 47.840 13.070 1.00 0.00 ATOM 18704 H2 SOL 1200 2.500 46.590 12.220 1.00 0.00 ATOM 18705 OH2 SOL 1201 3.080 35.460 15.820 1.00 0.00 ATOM 18706 H1 SOL 1201 3.880 35.320 15.320 1.00 0.00 ATOM 18707 H2 SOL 1201 3.380 35.780 16.670 1.00 0.00 ATOM 18708 OH2 SOL 1202 18.280 56.110 13.230 1.00 0.00 ATOM 18709 H1 SOL 1202 19.050 56.140 12.660 1.00 0.00 ATOM 18710 H2 SOL 1202 17.730 55.430 12.870 1.00 0.00 ATOM 18711 OH2 SOL 1203 54.320 1.090 74.390 1.00 0.00 ATOM 18712 H1 SOL 1203 54.790 0.890 73.580 1.00 0.00 ATOM 18713 H2 SOL 1203 53.470 1.410 74.100 1.00 0.00 ATOM 18714 OH2 SOL 1204 48.840 60.140 17.650 1.00 0.00 ATOM 18715 H1 SOL 1204 48.200 59.560 18.080 1.00 0.00 ATOM 18716 H2 SOL 1204 48.860 59.850 16.740 1.00 0.00 ATOM 18717 OH2 SOL 1205 36.150 34.850 75.740 1.00 0.00 ATOM 18718 H1 SOL 1205 37.030 34.530 75.920 1.00 0.00 ATOM 18719 H2 SOL 1205 35.860 34.360 74.980 1.00 0.00 ATOM 18720 OH2 SOL 1206 9.070 24.940 10.950 1.00 0.00 ATOM 18721 H1 SOL 1206 9.100 24.080 10.550 1.00 0.00 ATOM 18722 H2 SOL 1206 9.970 25.270 10.900 1.00 0.00 ATOM 18723 OH2 SOL 1207 58.380 10.870 67.400 1.00 0.00 ATOM 18724 H1 SOL 1207 59.310 10.760 67.610 1.00 0.00 ATOM 18725 H2 SOL 1207 58.110 10.020 67.050 1.00 0.00 ATOM 18726 OH2 SOL 1208 7.840 27.210 12.630 1.00 0.00 ATOM 18727 H1 SOL 1208 8.200 26.730 11.890 1.00 0.00 ATOM 18728 H2 SOL 1208 6.930 27.380 12.380 1.00 0.00 ATOM 18729 OH2 SOL 1209 43.210 25.590 18.080 1.00 0.00 ATOM 18730 H1 SOL 1209 43.030 24.850 18.660 1.00 0.00 ATOM 18731 H2 SOL 1209 43.960 25.300 17.560 1.00 0.00 ATOM 18732 OH2 SOL 1210 40.840 57.750 5.390 1.00 0.00 ATOM 18733 H1 SOL 1210 41.000 58.490 5.980 1.00 0.00 ATOM 18734 H2 SOL 1210 40.600 58.160 4.560 1.00 0.00 ATOM 18735 OH2 SOL 1211 54.790 29.390 83.950 1.00 0.00 ATOM 18736 H1 SOL 1211 54.950 28.520 84.320 1.00 0.00 ATOM 18737 H2 SOL 1211 53.890 29.600 84.200 1.00 0.00 ATOM 18738 OH2 SOL 1212 15.840 15.380 0.780 1.00 0.00 ATOM 18739 H1 SOL 1212 16.630 15.210 0.270 1.00 0.00 ATOM 18740 H2 SOL 1212 15.300 15.930 0.220 1.00 0.00 ATOM 18741 OH2 SOL 1213 41.080 12.970 4.240 1.00 0.00 ATOM 18742 H1 SOL 1213 41.020 12.070 4.540 1.00 0.00 ATOM 18743 H2 SOL 1213 41.490 13.440 4.970 1.00 0.00 ATOM 18744 OH2 SOL 1214 36.230 39.310 81.950 1.00 0.00 ATOM 18745 H1 SOL 1214 36.700 38.800 82.610 1.00 0.00 ATOM 18746 H2 SOL 1214 35.340 38.980 81.990 1.00 0.00 ATOM 18747 OH2 SOL 1215 27.120 53.000 2.850 1.00 0.00 ATOM 18748 H1 SOL 1215 27.880 53.510 3.130 1.00 0.00 ATOM 18749 H2 SOL 1215 26.400 53.340 3.370 1.00 0.00 ATOM 18750 OH2 SOL 1216 51.820 2.000 83.440 1.00 0.00 ATOM 18751 H1 SOL 1216 51.520 1.090 83.460 1.00 0.00 ATOM 18752 H2 SOL 1216 51.170 2.480 83.960 1.00 0.00 ATOM 18753 OH2 SOL 1217 18.470 3.060 69.350 1.00 0.00 ATOM 18754 H1 SOL 1217 18.250 3.020 70.280 1.00 0.00 ATOM 18755 H2 SOL 1217 17.650 3.280 68.920 1.00 0.00 ATOM 18756 OH2 SOL 1218 43.590 23.510 68.690 1.00 0.00 ATOM 18757 H1 SOL 1218 42.640 23.560 68.800 1.00 0.00 ATOM 18758 H2 SOL 1218 43.710 23.060 67.850 1.00 0.00 ATOM 18759 OH2 SOL 1219 29.110 38.890 79.110 1.00 0.00 ATOM 18760 H1 SOL 1219 28.440 38.810 79.790 1.00 0.00 ATOM 18761 H2 SOL 1219 28.620 38.900 78.290 1.00 0.00 ATOM 18762 OH2 SOL 1220 58.980 22.270 14.040 1.00 0.00 ATOM 18763 H1 SOL 1220 58.220 22.070 14.580 1.00 0.00 ATOM 18764 H2 SOL 1220 59.440 21.440 13.950 1.00 0.00 ATOM 18765 OH2 SOL 1221 44.980 44.490 19.470 1.00 0.00 ATOM 18766 H1 SOL 1221 44.100 44.170 19.680 1.00 0.00 ATOM 18767 H2 SOL 1221 45.310 44.830 20.300 1.00 0.00 ATOM 18768 OH2 SOL 1222 36.930 13.210 25.090 1.00 0.00 ATOM 18769 H1 SOL 1222 37.670 13.330 24.500 1.00 0.00 ATOM 18770 H2 SOL 1222 36.220 12.900 24.530 1.00 0.00 ATOM 18771 OH2 SOL 1223 33.370 29.060 8.950 1.00 0.00 ATOM 18772 H1 SOL 1223 33.810 28.440 8.370 1.00 0.00 ATOM 18773 H2 SOL 1223 32.840 28.520 9.540 1.00 0.00 ATOM 18774 OH2 SOL 1224 5.140 14.970 76.350 1.00 0.00 ATOM 18775 H1 SOL 1224 4.670 15.740 76.030 1.00 0.00 ATOM 18776 H2 SOL 1224 5.070 15.030 77.300 1.00 0.00 ATOM 18777 OH2 SOL 1225 40.830 9.130 2.790 1.00 0.00 ATOM 18778 H1 SOL 1225 41.610 8.630 2.550 1.00 0.00 ATOM 18779 H2 SOL 1225 41.050 9.550 3.620 1.00 0.00 ATOM 18780 OH2 SOL 1226 28.510 46.120 83.580 1.00 0.00 ATOM 18781 H1 SOL 1226 27.640 46.230 83.200 1.00 0.00 ATOM 18782 H2 SOL 1226 28.850 47.010 83.690 1.00 0.00 ATOM 18783 OH2 SOL 1227 20.970 50.180 11.030 1.00 0.00 ATOM 18784 H1 SOL 1227 21.420 49.450 11.440 1.00 0.00 ATOM 18785 H2 SOL 1227 20.800 50.790 11.740 1.00 0.00 ATOM 18786 OH2 SOL 1228 47.300 45.990 72.160 1.00 0.00 ATOM 18787 H1 SOL 1228 46.740 45.670 72.870 1.00 0.00 ATOM 18788 H2 SOL 1228 47.330 45.260 71.540 1.00 0.00 ATOM 18789 OH2 SOL 1229 10.570 13.810 67.450 1.00 0.00 ATOM 18790 H1 SOL 1229 11.340 13.240 67.500 1.00 0.00 ATOM 18791 H2 SOL 1229 10.220 13.790 68.340 1.00 0.00 ATOM 18792 OH2 SOL 1230 46.210 58.860 65.770 1.00 0.00 ATOM 18793 H1 SOL 1230 46.170 59.480 65.040 1.00 0.00 ATOM 18794 H2 SOL 1230 45.520 59.150 66.370 1.00 0.00 ATOM 18795 OH2 SOL 1231 41.220 29.860 81.210 1.00 0.00 ATOM 18796 H1 SOL 1231 41.410 30.390 81.990 1.00 0.00 ATOM 18797 H2 SOL 1231 40.280 29.950 81.090 1.00 0.00 ATOM 18798 OH2 SOL 1232 43.310 57.230 75.480 1.00 0.00 ATOM 18799 H1 SOL 1232 43.010 57.160 74.580 1.00 0.00 ATOM 18800 H2 SOL 1232 43.160 58.150 75.720 1.00 0.00 ATOM 18801 OH2 SOL 1233 19.870 9.860 13.370 1.00 0.00 ATOM 18802 H1 SOL 1233 19.390 10.190 14.130 1.00 0.00 ATOM 18803 H2 SOL 1233 20.700 10.340 13.390 1.00 0.00 ATOM 18804 OH2 SOL 1234 21.460 2.930 9.910 1.00 0.00 ATOM 18805 H1 SOL 1234 21.020 3.770 9.780 1.00 0.00 ATOM 18806 H2 SOL 1234 21.980 2.800 9.110 1.00 0.00 ATOM 18807 OH2 SOL 1235 26.250 40.590 12.690 1.00 0.00 ATOM 18808 H1 SOL 1235 26.200 39.880 13.320 1.00 0.00 ATOM 18809 H2 SOL 1235 27.180 40.690 12.510 1.00 0.00 ATOM 18810 OH2 SOL 1236 23.000 32.100 14.400 1.00 0.00 ATOM 18811 H1 SOL 1236 22.690 31.370 13.880 1.00 0.00 ATOM 18812 H2 SOL 1236 22.630 31.960 15.270 1.00 0.00 ATOM 18813 OH2 SOL 1237 20.950 54.760 84.730 1.00 0.00 ATOM 18814 H1 SOL 1237 21.730 54.200 84.800 1.00 0.00 ATOM 18815 H2 SOL 1237 21.300 55.650 84.660 1.00 0.00 ATOM 18816 OH2 SOL 1238 49.250 12.850 84.200 1.00 0.00 ATOM 18817 H1 SOL 1238 48.310 12.660 84.240 1.00 0.00 ATOM 18818 H2 SOL 1238 49.380 13.510 84.880 1.00 0.00 ATOM 18819 OH2 SOL 1239 49.360 37.600 0.550 1.00 0.00 ATOM 18820 H1 SOL 1239 48.790 38.310 0.850 1.00 0.00 ATOM 18821 H2 SOL 1239 49.390 37.720 -0.400 1.00 0.00 ATOM 18822 OH2 SOL 1240 5.280 34.480 11.720 1.00 0.00 ATOM 18823 H1 SOL 1240 4.400 34.550 11.330 1.00 0.00 ATOM 18824 H2 SOL 1240 5.630 33.660 11.370 1.00 0.00 ATOM 18825 OH2 SOL 1241 40.440 53.290 62.470 1.00 0.00 ATOM 18826 H1 SOL 1241 40.590 54.230 62.560 1.00 0.00 ATOM 18827 H2 SOL 1241 41.310 52.930 62.260 1.00 0.00 ATOM 18828 OH2 SOL 1242 30.700 44.500 15.940 1.00 0.00 ATOM 18829 H1 SOL 1242 30.430 43.870 16.610 1.00 0.00 ATOM 18830 H2 SOL 1242 29.890 44.820 15.560 1.00 0.00 ATOM 18831 OH2 SOL 1243 13.200 17.300 74.830 1.00 0.00 ATOM 18832 H1 SOL 1243 13.440 16.380 74.860 1.00 0.00 ATOM 18833 H2 SOL 1243 12.470 17.380 75.450 1.00 0.00 ATOM 18834 OH2 SOL 1244 41.330 40.840 65.420 1.00 0.00 ATOM 18835 H1 SOL 1244 41.300 40.500 66.310 1.00 0.00 ATOM 18836 H2 SOL 1244 41.800 40.170 64.920 1.00 0.00 ATOM 18837 OH2 SOL 1245 39.890 20.930 7.640 1.00 0.00 ATOM 18838 H1 SOL 1245 40.240 21.820 7.630 1.00 0.00 ATOM 18839 H2 SOL 1245 38.990 21.020 7.340 1.00 0.00 ATOM 18840 OH2 SOL 1246 28.780 18.740 80.920 1.00 0.00 ATOM 18841 H1 SOL 1246 29.640 19.150 80.840 1.00 0.00 ATOM 18842 H2 SOL 1246 28.920 18.020 81.530 1.00 0.00 ATOM 18843 OH2 SOL 1247 44.350 33.640 8.270 1.00 0.00 ATOM 18844 H1 SOL 1247 44.430 34.420 8.820 1.00 0.00 ATOM 18845 H2 SOL 1247 45.170 33.160 8.420 1.00 0.00 ATOM 18846 OH2 SOL 1248 11.710 17.320 24.600 1.00 0.00 ATOM 18847 H1 SOL 1248 11.750 16.820 25.410 1.00 0.00 ATOM 18848 H2 SOL 1248 12.500 17.870 24.620 1.00 0.00 ATOM 18849 OH2 SOL 1249 7.350 39.240 74.200 1.00 0.00 ATOM 18850 H1 SOL 1249 7.310 39.990 74.800 1.00 0.00 ATOM 18851 H2 SOL 1249 6.620 39.380 73.600 1.00 0.00 ATOM 18852 OH2 SOL 1250 4.420 19.290 1.170 1.00 0.00 ATOM 18853 H1 SOL 1250 5.300 19.090 0.850 1.00 0.00 ATOM 18854 H2 SOL 1250 3.830 18.940 0.500 1.00 0.00 ATOM 18855 OH2 SOL 1251 56.430 4.670 68.030 1.00 0.00 ATOM 18856 H1 SOL 1251 57.040 4.060 67.610 1.00 0.00 ATOM 18857 H2 SOL 1251 55.820 4.110 68.500 1.00 0.00 ATOM 18858 OH2 SOL 1252 40.240 48.580 76.440 1.00 0.00 ATOM 18859 H1 SOL 1252 40.150 47.870 75.810 1.00 0.00 ATOM 18860 H2 SOL 1252 40.960 48.310 77.010 1.00 0.00 ATOM 18861 OH2 SOL 1253 52.710 14.650 24.680 1.00 0.00 ATOM 18862 H1 SOL 1253 52.940 13.780 25.020 1.00 0.00 ATOM 18863 H2 SOL 1253 53.410 15.220 25.000 1.00 0.00 ATOM 18864 OH2 SOL 1254 53.150 13.080 10.980 1.00 0.00 ATOM 18865 H1 SOL 1254 52.930 13.280 10.060 1.00 0.00 ATOM 18866 H2 SOL 1254 53.570 13.880 11.300 1.00 0.00 ATOM 18867 OH2 SOL 1255 6.340 45.640 6.450 1.00 0.00 ATOM 18868 H1 SOL 1255 6.240 46.510 6.840 1.00 0.00 ATOM 18869 H2 SOL 1255 7.120 45.710 5.910 1.00 0.00 ATOM 18870 OH2 SOL 1256 32.280 29.480 19.910 1.00 0.00 ATOM 18871 H1 SOL 1256 32.650 28.650 20.210 1.00 0.00 ATOM 18872 H2 SOL 1256 31.640 29.710 20.580 1.00 0.00 ATOM 18873 OH2 SOL 1257 39.210 31.500 63.590 1.00 0.00 ATOM 18874 H1 SOL 1257 39.940 32.110 63.690 1.00 0.00 ATOM 18875 H2 SOL 1257 38.430 32.050 63.670 1.00 0.00 ATOM 18876 OH2 SOL 1258 47.140 46.950 62.250 1.00 0.00 ATOM 18877 H1 SOL 1258 46.810 47.630 61.660 1.00 0.00 ATOM 18878 H2 SOL 1258 47.310 47.410 63.070 1.00 0.00 ATOM 18879 OH2 SOL 1259 39.870 54.180 13.430 1.00 0.00 ATOM 18880 H1 SOL 1259 39.260 53.920 14.130 1.00 0.00 ATOM 18881 H2 SOL 1259 39.420 54.900 12.980 1.00 0.00 ATOM 18882 OH2 SOL 1260 18.580 18.920 72.710 1.00 0.00 ATOM 18883 H1 SOL 1260 17.750 19.380 72.800 1.00 0.00 ATOM 18884 H2 SOL 1260 19.110 19.210 73.450 1.00 0.00 ATOM 18885 OH2 SOL 1261 43.500 46.010 72.550 1.00 0.00 ATOM 18886 H1 SOL 1261 43.880 46.810 72.190 1.00 0.00 ATOM 18887 H2 SOL 1261 44.200 45.620 73.070 1.00 0.00 ATOM 18888 OH2 SOL 1262 10.010 45.340 10.130 1.00 0.00 ATOM 18889 H1 SOL 1262 10.190 46.180 10.560 1.00 0.00 ATOM 18890 H2 SOL 1262 10.850 44.890 10.140 1.00 0.00 ATOM 18891 OH2 SOL 1263 16.510 60.340 72.560 1.00 0.00 ATOM 18892 H1 SOL 1263 15.940 59.590 72.730 1.00 0.00 ATOM 18893 H2 SOL 1263 16.790 60.630 73.420 1.00 0.00 ATOM 18894 OH2 SOL 1264 46.830 32.890 15.670 1.00 0.00 ATOM 18895 H1 SOL 1264 47.690 32.640 16.000 1.00 0.00 ATOM 18896 H2 SOL 1264 46.870 33.850 15.620 1.00 0.00 ATOM 18897 OH2 SOL 1265 17.240 19.750 81.670 1.00 0.00 ATOM 18898 H1 SOL 1265 16.970 18.880 81.370 1.00 0.00 ATOM 18899 H2 SOL 1265 18.150 19.830 81.390 1.00 0.00 ATOM 18900 OH2 SOL 1266 14.970 41.380 82.040 1.00 0.00 ATOM 18901 H1 SOL 1266 14.850 41.280 81.100 1.00 0.00 ATOM 18902 H2 SOL 1266 15.910 41.240 82.190 1.00 0.00 ATOM 18903 OH2 SOL 1267 20.440 59.130 10.000 1.00 0.00 ATOM 18904 H1 SOL 1267 20.690 59.660 9.250 1.00 0.00 ATOM 18905 H2 SOL 1267 19.500 58.980 9.890 1.00 0.00 ATOM 18906 OH2 SOL 1268 1.420 6.300 6.280 1.00 0.00 ATOM 18907 H1 SOL 1268 1.680 7.160 6.610 1.00 0.00 ATOM 18908 H2 SOL 1268 0.740 6.010 6.890 1.00 0.00 ATOM 18909 OH2 SOL 1269 27.760 40.570 18.460 1.00 0.00 ATOM 18910 H1 SOL 1269 27.480 41.490 18.490 1.00 0.00 ATOM 18911 H2 SOL 1269 28.050 40.430 17.560 1.00 0.00 ATOM 18912 OH2 SOL 1270 15.150 17.050 83.280 1.00 0.00 ATOM 18913 H1 SOL 1270 14.350 16.980 82.770 1.00 0.00 ATOM 18914 H2 SOL 1270 15.830 16.660 82.730 1.00 0.00 ATOM 18915 OH2 SOL 1271 9.510 26.610 69.830 1.00 0.00 ATOM 18916 H1 SOL 1271 10.420 26.340 69.700 1.00 0.00 ATOM 18917 H2 SOL 1271 9.360 27.280 69.160 1.00 0.00 ATOM 18918 OH2 SOL 1272 40.370 16.590 7.700 1.00 0.00 ATOM 18919 H1 SOL 1272 41.300 16.750 7.530 1.00 0.00 ATOM 18920 H2 SOL 1272 40.080 16.070 6.950 1.00 0.00 ATOM 18921 OH2 SOL 1273 50.640 26.880 16.660 1.00 0.00 ATOM 18922 H1 SOL 1273 51.280 26.170 16.570 1.00 0.00 ATOM 18923 H2 SOL 1273 49.960 26.670 16.020 1.00 0.00 ATOM 18924 OH2 SOL 1274 14.240 57.270 22.140 1.00 0.00 ATOM 18925 H1 SOL 1274 13.470 57.110 22.700 1.00 0.00 ATOM 18926 H2 SOL 1274 14.950 56.810 22.580 1.00 0.00 ATOM 18927 OH2 SOL 1275 13.750 47.840 61.730 1.00 0.00 ATOM 18928 H1 SOL 1275 12.920 47.530 61.360 1.00 0.00 ATOM 18929 H2 SOL 1275 14.320 47.080 61.680 1.00 0.00 ATOM 18930 OH2 SOL 1276 21.440 45.090 16.950 1.00 0.00 ATOM 18931 H1 SOL 1276 21.750 45.940 17.240 1.00 0.00 ATOM 18932 H2 SOL 1276 21.940 44.900 16.150 1.00 0.00 ATOM 18933 OH2 SOL 1277 3.420 1.130 69.620 1.00 0.00 ATOM 18934 H1 SOL 1277 3.780 1.890 70.070 1.00 0.00 ATOM 18935 H2 SOL 1277 3.950 1.040 68.830 1.00 0.00 ATOM 18936 OH2 SOL 1278 11.230 7.840 74.070 1.00 0.00 ATOM 18937 H1 SOL 1278 10.560 8.000 74.730 1.00 0.00 ATOM 18938 H2 SOL 1278 11.490 8.710 73.780 1.00 0.00 ATOM 18939 OH2 SOL 1279 41.990 43.510 7.680 1.00 0.00 ATOM 18940 H1 SOL 1279 42.910 43.250 7.700 1.00 0.00 ATOM 18941 H2 SOL 1279 41.540 42.790 8.140 1.00 0.00 ATOM 18942 OH2 SOL 1280 39.440 24.580 18.280 1.00 0.00 ATOM 18943 H1 SOL 1280 40.290 24.660 18.730 1.00 0.00 ATOM 18944 H2 SOL 1280 38.810 24.390 18.980 1.00 0.00 ATOM 18945 OH2 SOL 1281 30.960 34.930 67.310 1.00 0.00 ATOM 18946 H1 SOL 1281 31.580 34.590 66.660 1.00 0.00 ATOM 18947 H2 SOL 1281 30.160 35.100 66.820 1.00 0.00 ATOM 18948 OH2 SOL 1282 24.550 58.050 67.360 1.00 0.00 ATOM 18949 H1 SOL 1282 25.000 57.840 68.180 1.00 0.00 ATOM 18950 H2 SOL 1282 24.900 58.900 67.100 1.00 0.00 ATOM 18951 OH2 SOL 1283 28.300 42.340 84.810 1.00 0.00 ATOM 18952 H1 SOL 1283 28.860 43.110 84.750 1.00 0.00 ATOM 18953 H2 SOL 1283 27.790 42.340 84.000 1.00 0.00 ATOM 18954 OH2 SOL 1284 17.580 43.500 16.400 1.00 0.00 ATOM 18955 H1 SOL 1284 17.020 42.730 16.300 1.00 0.00 ATOM 18956 H2 SOL 1284 18.470 43.130 16.470 1.00 0.00 ATOM 18957 OH2 SOL 1285 44.010 56.810 0.180 1.00 0.00 ATOM 18958 H1 SOL 1285 44.330 57.380 0.880 1.00 0.00 ATOM 18959 H2 SOL 1285 43.260 57.270 -0.180 1.00 0.00 ATOM 18960 OH2 SOL 1286 5.890 38.120 66.920 1.00 0.00 ATOM 18961 H1 SOL 1286 5.320 38.070 66.160 1.00 0.00 ATOM 18962 H2 SOL 1286 5.760 39.000 67.270 1.00 0.00 ATOM 18963 OH2 SOL 1287 44.680 7.890 82.880 1.00 0.00 ATOM 18964 H1 SOL 1287 45.560 7.830 82.510 1.00 0.00 ATOM 18965 H2 SOL 1287 44.550 8.830 83.030 1.00 0.00 ATOM 18966 OH2 SOL 1288 1.300 31.190 26.990 1.00 0.00 ATOM 18967 H1 SOL 1288 1.870 31.790 26.510 1.00 0.00 ATOM 18968 H2 SOL 1288 1.690 30.330 26.840 1.00 0.00 ATOM 18969 OH2 SOL 1289 45.420 8.780 76.720 1.00 0.00 ATOM 18970 H1 SOL 1289 45.160 9.200 77.540 1.00 0.00 ATOM 18971 H2 SOL 1289 45.250 7.850 76.870 1.00 0.00 ATOM 18972 OH2 SOL 1290 10.540 0.770 6.610 1.00 0.00 ATOM 18973 H1 SOL 1290 11.080 0.110 7.050 1.00 0.00 ATOM 18974 H2 SOL 1290 10.430 0.430 5.720 1.00 0.00 ATOM 18975 OH2 SOL 1291 16.000 0.430 10.530 1.00 0.00 ATOM 18976 H1 SOL 1291 15.670 1.180 10.030 1.00 0.00 ATOM 18977 H2 SOL 1291 15.360 0.310 11.230 1.00 0.00 ATOM 18978 OH2 SOL 1292 44.490 39.080 9.200 1.00 0.00 ATOM 18979 H1 SOL 1292 43.610 38.720 9.300 1.00 0.00 ATOM 18980 H2 SOL 1292 44.460 39.920 9.650 1.00 0.00 ATOM 18981 OH2 SOL 1293 44.580 55.750 72.450 1.00 0.00 ATOM 18982 H1 SOL 1293 44.230 55.440 71.620 1.00 0.00 ATOM 18983 H2 SOL 1293 44.440 56.690 72.440 1.00 0.00 ATOM 18984 OH2 SOL 1294 2.670 26.950 19.150 1.00 0.00 ATOM 18985 H1 SOL 1294 3.350 27.500 18.750 1.00 0.00 ATOM 18986 H2 SOL 1294 2.830 27.020 20.090 1.00 0.00 ATOM 18987 OH2 SOL 1295 50.220 32.220 13.930 1.00 0.00 ATOM 18988 H1 SOL 1295 50.420 32.540 14.810 1.00 0.00 ATOM 18989 H2 SOL 1295 51.040 32.280 13.450 1.00 0.00 ATOM 18990 OH2 SOL 1296 27.480 46.860 69.150 1.00 0.00 ATOM 18991 H1 SOL 1296 27.790 46.620 70.020 1.00 0.00 ATOM 18992 H2 SOL 1296 27.620 47.800 69.090 1.00 0.00 ATOM 18993 OH2 SOL 1297 21.020 23.120 66.050 1.00 0.00 ATOM 18994 H1 SOL 1297 21.230 23.760 65.370 1.00 0.00 ATOM 18995 H2 SOL 1297 21.860 22.720 66.270 1.00 0.00 ATOM 18996 OH2 SOL 1298 37.530 37.190 13.130 1.00 0.00 ATOM 18997 H1 SOL 1298 38.040 37.730 13.740 1.00 0.00 ATOM 18998 H2 SOL 1298 37.420 36.360 13.600 1.00 0.00 ATOM 18999 OH2 SOL 1299 6.580 17.930 84.570 1.00 0.00 ATOM 19000 H1 SOL 1299 6.710 17.070 84.180 1.00 0.00 ATOM 19001 H2 SOL 1299 7.420 18.130 84.990 1.00 0.00 ATOM 19002 OH2 SOL 1300 19.780 20.240 80.970 1.00 0.00 ATOM 19003 H1 SOL 1300 20.460 19.880 81.540 1.00 0.00 ATOM 19004 H2 SOL 1300 20.060 21.130 80.790 1.00 0.00 ATOM 19005 OH2 SOL 1301 58.500 32.830 18.480 1.00 0.00 ATOM 19006 H1 SOL 1301 58.250 33.480 19.140 1.00 0.00 ATOM 19007 H2 SOL 1301 59.210 33.250 18.000 1.00 0.00 ATOM 19008 OH2 SOL 1302 59.490 50.360 14.630 1.00 0.00 ATOM 19009 H1 SOL 1302 60.020 50.850 15.270 1.00 0.00 ATOM 19010 H2 SOL 1302 59.090 49.660 15.140 1.00 0.00 ATOM 19011 OH2 SOL 1303 53.470 28.850 71.600 1.00 0.00 ATOM 19012 H1 SOL 1303 52.870 29.440 72.040 1.00 0.00 ATOM 19013 H2 SOL 1303 53.160 27.970 71.830 1.00 0.00 ATOM 19014 OH2 SOL 1304 57.920 34.830 5.450 1.00 0.00 ATOM 19015 H1 SOL 1304 57.770 35.780 5.510 1.00 0.00 ATOM 19016 H2 SOL 1304 58.640 34.750 4.820 1.00 0.00 ATOM 19017 OH2 SOL 1305 4.210 17.420 75.440 1.00 0.00 ATOM 19018 H1 SOL 1305 4.960 17.720 74.920 1.00 0.00 ATOM 19019 H2 SOL 1305 3.470 17.440 74.830 1.00 0.00 ATOM 19020 OH2 SOL 1306 0.440 32.480 1.020 1.00 0.00 ATOM 19021 H1 SOL 1306 0.160 33.390 0.980 1.00 0.00 ATOM 19022 H2 SOL 1306 0.430 32.180 0.110 1.00 0.00 ATOM 19023 OH2 SOL 1307 1.800 27.890 14.360 1.00 0.00 ATOM 19024 H1 SOL 1307 1.420 28.700 14.010 1.00 0.00 ATOM 19025 H2 SOL 1307 2.580 28.160 14.820 1.00 0.00 ATOM 19026 OH2 SOL 1308 50.770 40.240 15.420 1.00 0.00 ATOM 19027 H1 SOL 1308 51.240 39.660 16.020 1.00 0.00 ATOM 19028 H2 SOL 1308 50.320 40.860 15.990 1.00 0.00 ATOM 19029 OH2 SOL 1309 37.930 15.620 79.080 1.00 0.00 ATOM 19030 H1 SOL 1309 38.870 15.750 78.930 1.00 0.00 ATOM 19031 H2 SOL 1309 37.880 14.900 79.700 1.00 0.00 ATOM 19032 OH2 SOL 1310 58.970 41.410 78.950 1.00 0.00 ATOM 19033 H1 SOL 1310 58.170 41.390 78.430 1.00 0.00 ATOM 19034 H2 SOL 1310 58.750 41.980 79.690 1.00 0.00 ATOM 19035 OH2 SOL 1311 42.800 55.790 77.780 1.00 0.00 ATOM 19036 H1 SOL 1311 42.180 55.110 77.530 1.00 0.00 ATOM 19037 H2 SOL 1311 43.100 56.160 76.950 1.00 0.00 ATOM 19038 OH2 SOL 1312 17.440 55.950 6.220 1.00 0.00 ATOM 19039 H1 SOL 1312 17.240 55.050 6.500 1.00 0.00 ATOM 19040 H2 SOL 1312 16.860 56.100 5.470 1.00 0.00 ATOM 19041 OH2 SOL 1313 32.000 51.440 0.730 1.00 0.00 ATOM 19042 H1 SOL 1313 32.160 52.360 0.540 1.00 0.00 ATOM 19043 H2 SOL 1313 32.830 51.010 0.510 1.00 0.00 ATOM 19044 OH2 SOL 1314 20.390 9.900 9.880 1.00 0.00 ATOM 19045 H1 SOL 1314 20.790 10.330 9.120 1.00 0.00 ATOM 19046 H2 SOL 1314 20.670 10.430 10.620 1.00 0.00 ATOM 19047 OH2 SOL 1315 50.260 28.500 70.910 1.00 0.00 ATOM 19048 H1 SOL 1315 49.820 27.680 71.120 1.00 0.00 ATOM 19049 H2 SOL 1315 50.700 28.740 71.730 1.00 0.00 ATOM 19050 OH2 SOL 1316 34.870 43.090 9.630 1.00 0.00 ATOM 19051 H1 SOL 1316 34.020 43.350 9.990 1.00 0.00 ATOM 19052 H2 SOL 1316 34.650 42.540 8.880 1.00 0.00 ATOM 19053 OH2 SOL 1317 8.530 23.990 66.630 1.00 0.00 ATOM 19054 H1 SOL 1317 7.640 23.670 66.510 1.00 0.00 ATOM 19055 H2 SOL 1317 8.640 24.040 67.580 1.00 0.00 ATOM 19056 OH2 SOL 1318 42.310 4.160 1.310 1.00 0.00 ATOM 19057 H1 SOL 1318 42.840 4.800 0.820 1.00 0.00 ATOM 19058 H2 SOL 1318 42.220 4.550 2.180 1.00 0.00 ATOM 19059 OH2 SOL 1319 48.220 10.640 74.070 1.00 0.00 ATOM 19060 H1 SOL 1319 48.340 9.880 73.500 1.00 0.00 ATOM 19061 H2 SOL 1319 47.290 10.870 73.960 1.00 0.00 ATOM 19062 OH2 SOL 1320 35.480 58.940 11.080 1.00 0.00 ATOM 19063 H1 SOL 1320 35.010 59.470 11.720 1.00 0.00 ATOM 19064 H2 SOL 1320 36.180 59.510 10.750 1.00 0.00 ATOM 19065 OH2 SOL 1321 32.720 29.080 13.250 1.00 0.00 ATOM 19066 H1 SOL 1321 33.430 29.460 13.760 1.00 0.00 ATOM 19067 H2 SOL 1321 32.160 29.820 13.030 1.00 0.00 ATOM 19068 OH2 SOL 1322 56.720 8.270 73.630 1.00 0.00 ATOM 19069 H1 SOL 1322 57.050 7.380 73.530 1.00 0.00 ATOM 19070 H2 SOL 1322 56.760 8.640 72.740 1.00 0.00 ATOM 19071 OH2 SOL 1323 50.080 42.510 78.880 1.00 0.00 ATOM 19072 H1 SOL 1323 50.520 41.740 79.240 1.00 0.00 ATOM 19073 H2 SOL 1323 50.780 43.070 78.550 1.00 0.00 ATOM 19074 OH2 SOL 1324 30.230 17.680 23.640 1.00 0.00 ATOM 19075 H1 SOL 1324 30.360 18.390 23.020 1.00 0.00 ATOM 19076 H2 SOL 1324 30.120 18.110 24.490 1.00 0.00 ATOM 19077 OH2 SOL 1325 17.330 53.800 12.340 1.00 0.00 ATOM 19078 H1 SOL 1325 16.410 53.850 12.070 1.00 0.00 ATOM 19079 H2 SOL 1325 17.410 52.940 12.750 1.00 0.00 ATOM 19080 OH2 SOL 1326 30.900 41.200 79.740 1.00 0.00 ATOM 19081 H1 SOL 1326 30.300 40.500 79.510 1.00 0.00 ATOM 19082 H2 SOL 1326 30.470 41.660 80.460 1.00 0.00 ATOM 19083 OH2 SOL 1327 32.590 33.440 0.410 1.00 0.00 ATOM 19084 H1 SOL 1327 32.080 33.010 1.090 1.00 0.00 ATOM 19085 H2 SOL 1327 32.920 34.240 0.830 1.00 0.00 ATOM 19086 OH2 SOL 1328 4.560 53.010 77.990 1.00 0.00 ATOM 19087 H1 SOL 1328 4.710 53.180 78.920 1.00 0.00 ATOM 19088 H2 SOL 1328 5.430 53.030 77.590 1.00 0.00 ATOM 19089 OH2 SOL 1329 31.150 3.600 67.790 1.00 0.00 ATOM 19090 H1 SOL 1329 30.480 3.520 67.110 1.00 0.00 ATOM 19091 H2 SOL 1329 31.870 3.040 67.480 1.00 0.00 ATOM 19092 OH2 SOL 1330 1.300 18.490 0.610 1.00 0.00 ATOM 19093 H1 SOL 1330 0.500 18.460 1.140 1.00 0.00 ATOM 19094 H2 SOL 1330 1.170 19.240 0.020 1.00 0.00 ATOM 19095 OH2 SOL 1331 1.480 35.280 19.970 1.00 0.00 ATOM 19096 H1 SOL 1331 0.890 35.300 20.720 1.00 0.00 ATOM 19097 H2 SOL 1331 1.890 36.150 19.950 1.00 0.00 ATOM 19098 OH2 SOL 1332 9.120 3.220 82.000 1.00 0.00 ATOM 19099 H1 SOL 1332 9.170 4.100 82.370 1.00 0.00 ATOM 19100 H2 SOL 1332 8.500 2.760 82.570 1.00 0.00 ATOM 19101 OH2 SOL 1333 29.460 15.650 65.730 1.00 0.00 ATOM 19102 H1 SOL 1333 29.530 15.100 64.950 1.00 0.00 ATOM 19103 H2 SOL 1333 28.680 15.320 66.190 1.00 0.00 ATOM 19104 OH2 SOL 1334 56.570 39.030 14.170 1.00 0.00 ATOM 19105 H1 SOL 1334 55.930 38.310 14.150 1.00 0.00 ATOM 19106 H2 SOL 1334 56.840 39.080 15.080 1.00 0.00 ATOM 19107 OH2 SOL 1335 40.960 25.550 20.370 1.00 0.00 ATOM 19108 H1 SOL 1335 40.220 26.140 20.550 1.00 0.00 ATOM 19109 H2 SOL 1335 41.640 25.830 20.990 1.00 0.00 ATOM 19110 OH2 SOL 1336 47.920 2.460 76.400 1.00 0.00 ATOM 19111 H1 SOL 1336 48.640 1.830 76.470 1.00 0.00 ATOM 19112 H2 SOL 1336 47.840 2.830 77.280 1.00 0.00 ATOM 19113 OH2 SOL 1337 45.200 3.300 75.950 1.00 0.00 ATOM 19114 H1 SOL 1337 45.080 3.170 75.010 1.00 0.00 ATOM 19115 H2 SOL 1337 46.140 3.150 76.100 1.00 0.00 ATOM 19116 OH2 SOL 1338 29.070 2.640 2.640 1.00 0.00 ATOM 19117 H1 SOL 1338 29.730 2.050 2.290 1.00 0.00 ATOM 19118 H2 SOL 1338 28.370 2.630 1.980 1.00 0.00 ATOM 19119 OH2 SOL 1339 28.450 45.460 5.730 1.00 0.00 ATOM 19120 H1 SOL 1339 28.210 45.400 4.810 1.00 0.00 ATOM 19121 H2 SOL 1339 28.880 46.310 5.810 1.00 0.00 ATOM 19122 OH2 SOL 1340 24.630 6.140 18.590 1.00 0.00 ATOM 19123 H1 SOL 1340 24.780 7.090 18.560 1.00 0.00 ATOM 19124 H2 SOL 1340 25.230 5.820 19.260 1.00 0.00 ATOM 19125 OH2 SOL 1341 5.880 44.900 18.030 1.00 0.00 ATOM 19126 H1 SOL 1341 6.450 45.670 18.130 1.00 0.00 ATOM 19127 H2 SOL 1341 6.400 44.170 18.350 1.00 0.00 ATOM 19128 OH2 SOL 1342 1.270 32.280 69.170 1.00 0.00 ATOM 19129 H1 SOL 1342 1.330 33.060 68.620 1.00 0.00 ATOM 19130 H2 SOL 1342 2.000 31.730 68.880 1.00 0.00 ATOM 19131 OH2 SOL 1343 6.660 29.810 9.490 1.00 0.00 ATOM 19132 H1 SOL 1343 7.290 29.250 9.030 1.00 0.00 ATOM 19133 H2 SOL 1343 5.880 29.270 9.580 1.00 0.00 ATOM 19134 OH2 SOL 1344 46.270 10.350 18.820 1.00 0.00 ATOM 19135 H1 SOL 1344 46.420 9.910 17.980 1.00 0.00 ATOM 19136 H2 SOL 1344 45.410 10.050 19.100 1.00 0.00 ATOM 19137 OH2 SOL 1345 42.840 19.360 77.310 1.00 0.00 ATOM 19138 H1 SOL 1345 43.730 19.240 77.650 1.00 0.00 ATOM 19139 H2 SOL 1345 42.590 20.230 77.600 1.00 0.00 ATOM 19140 OH2 SOL 1346 56.550 8.910 13.770 1.00 0.00 ATOM 19141 H1 SOL 1346 56.900 8.180 13.260 1.00 0.00 ATOM 19142 H2 SOL 1346 57.160 9.010 14.500 1.00 0.00 ATOM 19143 OH2 SOL 1347 48.540 4.920 11.100 1.00 0.00 ATOM 19144 H1 SOL 1347 48.800 4.500 10.280 1.00 0.00 ATOM 19145 H2 SOL 1347 48.530 5.860 10.900 1.00 0.00 ATOM 19146 OH2 SOL 1348 21.580 18.090 71.280 1.00 0.00 ATOM 19147 H1 SOL 1348 22.440 18.520 71.260 1.00 0.00 ATOM 19148 H2 SOL 1348 21.180 18.380 72.100 1.00 0.00 ATOM 19149 OH2 SOL 1349 29.830 3.350 21.380 1.00 0.00 ATOM 19150 H1 SOL 1349 30.220 2.870 22.110 1.00 0.00 ATOM 19151 H2 SOL 1349 29.700 4.240 21.720 1.00 0.00 ATOM 19152 OH2 SOL 1350 48.020 33.440 76.960 1.00 0.00 ATOM 19153 H1 SOL 1350 48.740 32.810 77.050 1.00 0.00 ATOM 19154 H2 SOL 1350 47.980 33.630 76.030 1.00 0.00 ATOM 19155 OH2 SOL 1351 25.860 17.690 18.730 1.00 0.00 ATOM 19156 H1 SOL 1351 26.600 17.110 18.910 1.00 0.00 ATOM 19157 H2 SOL 1351 26.260 18.480 18.360 1.00 0.00 ATOM 19158 OH2 SOL 1352 48.130 46.160 3.020 1.00 0.00 ATOM 19159 H1 SOL 1352 48.440 46.250 2.120 1.00 0.00 ATOM 19160 H2 SOL 1352 48.390 46.980 3.450 1.00 0.00 ATOM 19161 OH2 SOL 1353 30.910 32.930 82.600 1.00 0.00 ATOM 19162 H1 SOL 1353 31.350 33.410 83.300 1.00 0.00 ATOM 19163 H2 SOL 1353 30.820 32.040 82.950 1.00 0.00 ATOM 19164 OH2 SOL 1354 13.180 57.130 79.750 1.00 0.00 ATOM 19165 H1 SOL 1354 12.630 57.890 79.550 1.00 0.00 ATOM 19166 H2 SOL 1354 12.620 56.370 79.600 1.00 0.00 ATOM 19167 OH2 SOL 1355 34.230 34.680 14.070 1.00 0.00 ATOM 19168 H1 SOL 1355 34.440 33.880 13.590 1.00 0.00 ATOM 19169 H2 SOL 1355 35.060 34.950 14.450 1.00 0.00 ATOM 19170 OH2 SOL 1356 26.730 0.570 14.550 1.00 0.00 ATOM 19171 H1 SOL 1356 27.650 0.750 14.380 1.00 0.00 ATOM 19172 H2 SOL 1356 26.290 0.730 13.720 1.00 0.00 ATOM 19173 OH2 SOL 1357 51.280 11.800 70.050 1.00 0.00 ATOM 19174 H1 SOL 1357 51.750 12.590 70.320 1.00 0.00 ATOM 19175 H2 SOL 1357 50.920 11.450 70.860 1.00 0.00 ATOM 19176 OH2 SOL 1358 1.530 54.950 0.400 1.00 0.00 ATOM 19177 H1 SOL 1358 2.190 54.380 0.010 1.00 0.00 ATOM 19178 H2 SOL 1358 1.880 55.830 0.280 1.00 0.00 ATOM 19179 OH2 SOL 1359 5.650 42.870 11.880 1.00 0.00 ATOM 19180 H1 SOL 1359 5.310 42.150 11.350 1.00 0.00 ATOM 19181 H2 SOL 1359 5.260 42.730 12.740 1.00 0.00 ATOM 19182 OH2 SOL 1360 8.380 4.590 74.030 1.00 0.00 ATOM 19183 H1 SOL 1360 7.690 5.240 73.970 1.00 0.00 ATOM 19184 H2 SOL 1360 8.890 4.850 74.800 1.00 0.00 ATOM 19185 OH2 SOL 1361 7.140 53.950 79.670 1.00 0.00 ATOM 19186 H1 SOL 1361 7.680 54.550 79.170 1.00 0.00 ATOM 19187 H2 SOL 1361 6.650 54.500 80.280 1.00 0.00 ATOM 19188 OH2 SOL 1362 51.490 45.090 19.970 1.00 0.00 ATOM 19189 H1 SOL 1362 51.450 45.420 20.870 1.00 0.00 ATOM 19190 H2 SOL 1362 52.120 45.670 19.530 1.00 0.00 ATOM 19191 OH2 SOL 1363 1.600 17.410 3.790 1.00 0.00 ATOM 19192 H1 SOL 1363 1.480 16.470 3.620 1.00 0.00 ATOM 19193 H2 SOL 1363 1.180 17.840 3.040 1.00 0.00 ATOM 19194 OH2 SOL 1364 34.600 36.890 72.220 1.00 0.00 ATOM 19195 H1 SOL 1364 34.340 37.670 72.720 1.00 0.00 ATOM 19196 H2 SOL 1364 34.020 36.200 72.550 1.00 0.00 ATOM 19197 OH2 SOL 1365 39.380 55.720 6.330 1.00 0.00 ATOM 19198 H1 SOL 1365 39.640 56.640 6.450 1.00 0.00 ATOM 19199 H2 SOL 1365 39.490 55.560 5.390 1.00 0.00 ATOM 19200 OH2 SOL 1366 11.640 16.390 80.410 1.00 0.00 ATOM 19201 H1 SOL 1366 12.090 15.870 81.080 1.00 0.00 ATOM 19202 H2 SOL 1366 10.990 16.900 80.900 1.00 0.00 ATOM 19203 OH2 SOL 1367 52.800 46.050 15.890 1.00 0.00 ATOM 19204 H1 SOL 1367 53.650 46.370 15.580 1.00 0.00 ATOM 19205 H2 SOL 1367 52.150 46.590 15.440 1.00 0.00 ATOM 19206 OH2 SOL 1368 19.290 47.830 69.320 1.00 0.00 ATOM 19207 H1 SOL 1368 19.510 46.990 69.730 1.00 0.00 ATOM 19208 H2 SOL 1368 19.170 47.620 68.400 1.00 0.00 ATOM 19209 OH2 SOL 1369 56.660 59.120 14.300 1.00 0.00 ATOM 19210 H1 SOL 1369 57.010 58.330 14.710 1.00 0.00 ATOM 19211 H2 SOL 1369 57.200 59.830 14.660 1.00 0.00 ATOM 19212 OH2 SOL 1370 20.750 17.550 68.580 1.00 0.00 ATOM 19213 H1 SOL 1370 21.560 17.400 68.080 1.00 0.00 ATOM 19214 H2 SOL 1370 21.050 17.630 69.490 1.00 0.00 ATOM 19215 OH2 SOL 1371 33.680 16.460 0.960 1.00 0.00 ATOM 19216 H1 SOL 1371 34.380 15.970 1.390 1.00 0.00 ATOM 19217 H2 SOL 1371 33.600 16.050 0.100 1.00 0.00 ATOM 19218 OH2 SOL 1372 42.540 43.550 75.270 1.00 0.00 ATOM 19219 H1 SOL 1372 42.550 43.680 76.220 1.00 0.00 ATOM 19220 H2 SOL 1372 41.820 44.100 74.960 1.00 0.00 ATOM 19221 OH2 SOL 1373 55.740 1.420 79.270 1.00 0.00 ATOM 19222 H1 SOL 1373 55.520 1.020 80.110 1.00 0.00 ATOM 19223 H2 SOL 1373 55.500 0.760 78.620 1.00 0.00 ATOM 19224 OH2 SOL 1374 35.490 45.520 73.930 1.00 0.00 ATOM 19225 H1 SOL 1374 36.140 45.750 74.590 1.00 0.00 ATOM 19226 H2 SOL 1374 34.670 45.920 74.240 1.00 0.00 ATOM 19227 OH2 SOL 1375 38.340 15.300 2.120 1.00 0.00 ATOM 19228 H1 SOL 1375 38.370 16.250 2.050 1.00 0.00 ATOM 19229 H2 SOL 1375 37.440 15.100 2.380 1.00 0.00 ATOM 19230 OH2 SOL 1376 18.020 26.830 65.270 1.00 0.00 ATOM 19231 H1 SOL 1376 18.610 26.460 64.610 1.00 0.00 ATOM 19232 H2 SOL 1376 17.310 27.220 64.760 1.00 0.00 ATOM 19233 OH2 SOL 1377 37.780 0.980 17.420 1.00 0.00 ATOM 19234 H1 SOL 1377 37.790 1.790 17.940 1.00 0.00 ATOM 19235 H2 SOL 1377 38.500 0.460 17.780 1.00 0.00 ATOM 19236 OH2 SOL 1378 23.100 41.430 74.830 1.00 0.00 ATOM 19237 H1 SOL 1378 23.440 42.320 74.960 1.00 0.00 ATOM 19238 H2 SOL 1378 23.700 41.040 74.190 1.00 0.00 ATOM 19239 OH2 SOL 1379 6.980 18.530 15.140 1.00 0.00 ATOM 19240 H1 SOL 1379 7.030 19.380 15.570 1.00 0.00 ATOM 19241 H2 SOL 1379 6.060 18.290 15.170 1.00 0.00 ATOM 19242 OH2 SOL 1380 57.830 2.440 1.220 1.00 0.00 ATOM 19243 H1 SOL 1380 57.390 1.610 1.030 1.00 0.00 ATOM 19244 H2 SOL 1380 57.470 3.060 0.590 1.00 0.00 ATOM 19245 OH2 SOL 1381 46.110 19.930 84.080 1.00 0.00 ATOM 19246 H1 SOL 1381 46.610 20.590 84.570 1.00 0.00 ATOM 19247 H2 SOL 1381 45.270 19.880 84.520 1.00 0.00 ATOM 19248 OH2 SOL 1382 23.380 44.320 73.350 1.00 0.00 ATOM 19249 H1 SOL 1382 24.180 44.330 73.870 1.00 0.00 ATOM 19250 H2 SOL 1382 23.670 44.120 72.460 1.00 0.00 ATOM 19251 OH2 SOL 1383 38.730 11.760 20.900 1.00 0.00 ATOM 19252 H1 SOL 1383 38.440 11.880 20.000 1.00 0.00 ATOM 19253 H2 SOL 1383 38.790 12.650 21.250 1.00 0.00 ATOM 19254 OH2 SOL 1384 2.620 8.670 74.240 1.00 0.00 ATOM 19255 H1 SOL 1384 2.180 8.160 74.920 1.00 0.00 ATOM 19256 H2 SOL 1384 2.880 8.020 73.580 1.00 0.00 ATOM 19257 OH2 SOL 1385 17.020 40.380 3.120 1.00 0.00 ATOM 19258 H1 SOL 1385 17.790 40.060 2.660 1.00 0.00 ATOM 19259 H2 SOL 1385 17.090 40.010 4.000 1.00 0.00 ATOM 19260 OH2 SOL 1386 38.730 50.550 67.440 1.00 0.00 ATOM 19261 H1 SOL 1386 39.560 50.980 67.210 1.00 0.00 ATOM 19262 H2 SOL 1386 38.060 51.180 67.160 1.00 0.00 ATOM 19263 OH2 SOL 1387 5.940 24.300 21.540 1.00 0.00 ATOM 19264 H1 SOL 1387 6.640 24.930 21.380 1.00 0.00 ATOM 19265 H2 SOL 1387 6.390 23.470 21.720 1.00 0.00 ATOM 19266 OH2 SOL 1388 36.340 33.600 78.670 1.00 0.00 ATOM 19267 H1 SOL 1388 35.880 33.610 77.830 1.00 0.00 ATOM 19268 H2 SOL 1388 35.680 33.870 79.310 1.00 0.00 ATOM 19269 OH2 SOL 1389 45.580 48.880 15.150 1.00 0.00 ATOM 19270 H1 SOL 1389 46.130 49.550 15.550 1.00 0.00 ATOM 19271 H2 SOL 1389 45.990 48.710 14.300 1.00 0.00 ATOM 19272 OH2 SOL 1390 25.950 9.350 84.090 1.00 0.00 ATOM 19273 H1 SOL 1390 25.260 8.880 83.630 1.00 0.00 ATOM 19274 H2 SOL 1390 26.240 8.750 84.770 1.00 0.00 ATOM 19275 OH2 SOL 1391 40.590 26.340 13.990 1.00 0.00 ATOM 19276 H1 SOL 1391 39.920 26.840 14.450 1.00 0.00 ATOM 19277 H2 SOL 1391 40.220 26.180 13.120 1.00 0.00 ATOM 19278 OH2 SOL 1392 35.000 25.910 16.560 1.00 0.00 ATOM 19279 H1 SOL 1392 34.750 26.280 15.720 1.00 0.00 ATOM 19280 H2 SOL 1392 35.880 26.250 16.730 1.00 0.00 ATOM 19281 OH2 SOL 1393 3.460 16.050 24.690 1.00 0.00 ATOM 19282 H1 SOL 1393 2.530 16.270 24.770 1.00 0.00 ATOM 19283 H2 SOL 1393 3.800 16.110 25.580 1.00 0.00 ATOM 19284 OH2 SOL 1394 39.500 58.130 82.160 1.00 0.00 ATOM 19285 H1 SOL 1394 39.420 57.730 81.290 1.00 0.00 ATOM 19286 H2 SOL 1394 39.590 57.390 82.760 1.00 0.00 ATOM 19287 OH2 SOL 1395 55.600 8.130 81.820 1.00 0.00 ATOM 19288 H1 SOL 1395 54.780 7.690 82.030 1.00 0.00 ATOM 19289 H2 SOL 1395 55.970 8.370 82.670 1.00 0.00 ATOM 19290 OH2 SOL 1396 38.730 39.090 5.660 1.00 0.00 ATOM 19291 H1 SOL 1396 39.470 38.640 6.060 1.00 0.00 ATOM 19292 H2 SOL 1396 38.840 40.010 5.910 1.00 0.00 ATOM 19293 OH2 SOL 1397 15.860 17.060 75.890 1.00 0.00 ATOM 19294 H1 SOL 1397 16.620 17.600 76.110 1.00 0.00 ATOM 19295 H2 SOL 1397 15.140 17.690 75.770 1.00 0.00 ATOM 19296 OH2 SOL 1398 1.620 8.700 12.670 1.00 0.00 ATOM 19297 H1 SOL 1398 2.170 8.010 13.050 1.00 0.00 ATOM 19298 H2 SOL 1398 1.150 8.270 11.960 1.00 0.00 ATOM 19299 OH2 SOL 1399 46.290 35.800 6.040 1.00 0.00 ATOM 19300 H1 SOL 1399 46.790 34.990 5.970 1.00 0.00 ATOM 19301 H2 SOL 1399 46.310 36.020 6.970 1.00 0.00 ATOM 19302 OH2 SOL 1400 29.680 17.360 2.810 1.00 0.00 ATOM 19303 H1 SOL 1400 30.610 17.140 2.700 1.00 0.00 ATOM 19304 H2 SOL 1400 29.220 16.630 2.400 1.00 0.00 ATOM 19305 OH2 SOL 1401 13.860 39.400 76.960 1.00 0.00 ATOM 19306 H1 SOL 1401 13.620 39.340 76.040 1.00 0.00 ATOM 19307 H2 SOL 1401 14.760 39.730 76.950 1.00 0.00 ATOM 19308 OH2 SOL 1402 -0.200 36.970 74.210 1.00 0.00 ATOM 19309 H1 SOL 1402 0.680 37.020 73.840 1.00 0.00 ATOM 19310 H2 SOL 1402 -0.180 37.550 74.970 1.00 0.00 ATOM 19311 OH2 SOL 1403 22.830 0.850 4.730 1.00 0.00 ATOM 19312 H1 SOL 1403 23.600 0.760 5.290 1.00 0.00 ATOM 19313 H2 SOL 1403 23.090 0.470 3.890 1.00 0.00 ATOM 19314 OH2 SOL 1404 33.020 38.350 17.600 1.00 0.00 ATOM 19315 H1 SOL 1404 33.740 38.090 18.170 1.00 0.00 ATOM 19316 H2 SOL 1404 32.280 38.450 18.190 1.00 0.00 ATOM 19317 OH2 SOL 1405 1.050 2.750 68.350 1.00 0.00 ATOM 19318 H1 SOL 1405 1.550 2.580 69.150 1.00 0.00 ATOM 19319 H2 SOL 1405 1.170 3.680 68.190 1.00 0.00 ATOM 19320 OH2 SOL 1406 19.470 25.250 80.620 1.00 0.00 ATOM 19321 H1 SOL 1406 19.780 26.050 81.050 1.00 0.00 ATOM 19322 H2 SOL 1406 19.370 25.490 79.700 1.00 0.00 ATOM 19323 OH2 SOL 1407 6.770 45.580 74.990 1.00 0.00 ATOM 19324 H1 SOL 1407 6.380 45.090 74.270 1.00 0.00 ATOM 19325 H2 SOL 1407 6.040 45.810 75.560 1.00 0.00 ATOM 19326 OH2 SOL 1408 3.130 48.500 60.690 1.00 0.00 ATOM 19327 H1 SOL 1408 4.030 48.650 60.970 1.00 0.00 ATOM 19328 H2 SOL 1408 3.160 47.670 60.210 1.00 0.00 ATOM 19329 OH2 SOL 1409 58.520 52.770 61.050 1.00 0.00 ATOM 19330 H1 SOL 1409 57.740 52.760 61.610 1.00 0.00 ATOM 19331 H2 SOL 1409 58.540 53.660 60.690 1.00 0.00 ATOM 19332 OH2 SOL 1410 29.710 41.200 74.220 1.00 0.00 ATOM 19333 H1 SOL 1410 29.400 40.710 73.450 1.00 0.00 ATOM 19334 H2 SOL 1410 29.970 40.520 74.840 1.00 0.00 ATOM 19335 OH2 SOL 1411 9.990 8.490 14.960 1.00 0.00 ATOM 19336 H1 SOL 1411 10.330 7.840 15.580 1.00 0.00 ATOM 19337 H2 SOL 1411 9.240 8.880 15.420 1.00 0.00 ATOM 19338 OH2 SOL 1412 38.750 44.190 75.960 1.00 0.00 ATOM 19339 H1 SOL 1412 38.240 44.990 76.060 1.00 0.00 ATOM 19340 H2 SOL 1412 38.120 43.490 76.100 1.00 0.00 ATOM 19341 OH2 SOL 1413 23.530 31.080 82.460 1.00 0.00 ATOM 19342 H1 SOL 1413 23.940 31.660 81.820 1.00 0.00 ATOM 19343 H2 SOL 1413 23.520 31.580 83.280 1.00 0.00 ATOM 19344 OH2 SOL 1414 20.030 40.400 6.950 1.00 0.00 ATOM 19345 H1 SOL 1414 20.380 40.260 6.070 1.00 0.00 ATOM 19346 H2 SOL 1414 20.680 40.020 7.530 1.00 0.00 ATOM 19347 OH2 SOL 1415 59.180 43.310 2.300 1.00 0.00 ATOM 19348 H1 SOL 1415 58.710 42.660 2.830 1.00 0.00 ATOM 19349 H2 SOL 1415 60.020 42.890 2.100 1.00 0.00 ATOM 19350 OH2 SOL 1416 35.630 25.730 69.360 1.00 0.00 ATOM 19351 H1 SOL 1416 35.970 25.950 68.490 1.00 0.00 ATOM 19352 H2 SOL 1416 35.340 26.560 69.730 1.00 0.00 ATOM 19353 OH2 SOL 1417 21.160 28.590 75.160 1.00 0.00 ATOM 19354 H1 SOL 1417 21.910 29.070 75.500 1.00 0.00 ATOM 19355 H2 SOL 1417 21.040 27.860 75.770 1.00 0.00 ATOM 19356 OH2 SOL 1418 0.080 38.850 76.070 1.00 0.00 ATOM 19357 H1 SOL 1418 0.660 39.610 76.070 1.00 0.00 ATOM 19358 H2 SOL 1418 -0.410 38.910 76.880 1.00 0.00 ATOM 19359 OH2 SOL 1419 26.950 13.090 84.690 1.00 0.00 ATOM 19360 H1 SOL 1419 27.290 12.400 84.110 1.00 0.00 ATOM 19361 H2 SOL 1419 26.030 13.180 84.430 1.00 0.00 ATOM 19362 OH2 SOL 1420 2.580 37.810 20.290 1.00 0.00 ATOM 19363 H1 SOL 1420 2.840 38.470 19.650 1.00 0.00 ATOM 19364 H2 SOL 1420 3.170 37.950 21.030 1.00 0.00 ATOM 19365 OH2 SOL 1421 23.750 23.720 7.550 1.00 0.00 ATOM 19366 H1 SOL 1421 23.180 24.290 8.060 1.00 0.00 ATOM 19367 H2 SOL 1421 23.690 22.870 7.990 1.00 0.00 ATOM 19368 OH2 SOL 1422 6.780 39.390 2.070 1.00 0.00 ATOM 19369 H1 SOL 1422 6.860 39.770 1.190 1.00 0.00 ATOM 19370 H2 SOL 1422 6.000 39.810 2.440 1.00 0.00 ATOM 19371 OH2 SOL 1423 56.130 29.360 59.160 1.00 0.00 ATOM 19372 H1 SOL 1423 55.350 29.790 58.800 1.00 0.00 ATOM 19373 H2 SOL 1423 55.870 28.450 59.300 1.00 0.00 ATOM 19374 OH2 SOL 1424 29.110 25.760 69.670 1.00 0.00 ATOM 19375 H1 SOL 1424 28.350 26.340 69.680 1.00 0.00 ATOM 19376 H2 SOL 1424 28.740 24.880 69.700 1.00 0.00 ATOM 19377 OH2 SOL 1425 8.910 40.740 80.730 1.00 0.00 ATOM 19378 H1 SOL 1425 9.680 41.290 80.580 1.00 0.00 ATOM 19379 H2 SOL 1425 9.210 39.850 80.560 1.00 0.00 ATOM 19380 OH2 SOL 1426 35.000 47.210 15.540 1.00 0.00 ATOM 19381 H1 SOL 1426 34.190 46.860 15.920 1.00 0.00 ATOM 19382 H2 SOL 1426 35.510 46.430 15.310 1.00 0.00 ATOM 19383 OH2 SOL 1427 9.180 59.150 3.260 1.00 0.00 ATOM 19384 H1 SOL 1427 8.360 59.210 3.740 1.00 0.00 ATOM 19385 H2 SOL 1427 9.030 59.670 2.470 1.00 0.00 ATOM 19386 OH2 SOL 1428 53.230 52.280 73.500 1.00 0.00 ATOM 19387 H1 SOL 1428 52.790 51.450 73.320 1.00 0.00 ATOM 19388 H2 SOL 1428 53.870 52.380 72.790 1.00 0.00 ATOM 19389 OH2 SOL 1429 28.350 15.220 8.460 1.00 0.00 ATOM 19390 H1 SOL 1429 27.430 15.470 8.440 1.00 0.00 ATOM 19391 H2 SOL 1429 28.350 14.310 8.730 1.00 0.00 ATOM 19392 OH2 SOL 1430 3.920 1.460 66.110 1.00 0.00 ATOM 19393 H1 SOL 1430 4.250 1.930 65.340 1.00 0.00 ATOM 19394 H2 SOL 1430 3.690 2.140 66.730 1.00 0.00 ATOM 19395 OH2 SOL 1431 37.940 16.150 16.750 1.00 0.00 ATOM 19396 H1 SOL 1431 38.120 16.540 15.890 1.00 0.00 ATOM 19397 H2 SOL 1431 37.220 16.670 17.110 1.00 0.00 ATOM 19398 OH2 SOL 1432 34.840 37.660 23.600 1.00 0.00 ATOM 19399 H1 SOL 1432 34.030 38.130 23.790 1.00 0.00 ATOM 19400 H2 SOL 1432 35.540 38.270 23.830 1.00 0.00 ATOM 19401 OH2 SOL 1433 25.800 51.900 0.560 1.00 0.00 ATOM 19402 H1 SOL 1433 26.390 51.290 0.120 1.00 0.00 ATOM 19403 H2 SOL 1433 26.350 52.330 1.220 1.00 0.00 ATOM 19404 OH2 SOL 1434 49.560 34.500 74.540 1.00 0.00 ATOM 19405 H1 SOL 1434 48.720 34.290 74.140 1.00 0.00 ATOM 19406 H2 SOL 1434 50.200 34.370 73.830 1.00 0.00 ATOM 19407 OH2 SOL 1435 50.430 27.480 7.920 1.00 0.00 ATOM 19408 H1 SOL 1435 50.490 26.540 8.040 1.00 0.00 ATOM 19409 H2 SOL 1435 50.480 27.840 8.810 1.00 0.00 ATOM 19410 OH2 SOL 1436 1.690 40.810 63.460 1.00 0.00 ATOM 19411 H1 SOL 1436 1.880 40.420 62.610 1.00 0.00 ATOM 19412 H2 SOL 1436 2.550 40.960 63.850 1.00 0.00 ATOM 19413 OH2 SOL 1437 6.170 45.190 80.430 1.00 0.00 ATOM 19414 H1 SOL 1437 5.540 44.950 79.750 1.00 0.00 ATOM 19415 H2 SOL 1437 6.120 44.490 81.070 1.00 0.00 ATOM 19416 OH2 SOL 1438 30.790 34.930 71.810 1.00 0.00 ATOM 19417 H1 SOL 1438 30.860 35.110 72.750 1.00 0.00 ATOM 19418 H2 SOL 1438 30.120 34.240 71.750 1.00 0.00 ATOM 19419 OH2 SOL 1439 30.310 30.200 7.430 1.00 0.00 ATOM 19420 H1 SOL 1439 30.130 29.350 7.840 1.00 0.00 ATOM 19421 H2 SOL 1439 31.220 30.390 7.670 1.00 0.00 ATOM 19422 OH2 SOL 1440 19.150 46.400 22.490 1.00 0.00 ATOM 19423 H1 SOL 1440 18.380 46.200 21.950 1.00 0.00 ATOM 19424 H2 SOL 1440 18.780 46.700 23.320 1.00 0.00 ATOM 19425 OH2 SOL 1441 30.160 46.230 9.880 1.00 0.00 ATOM 19426 H1 SOL 1441 29.390 46.180 10.450 1.00 0.00 ATOM 19427 H2 SOL 1441 30.550 47.080 10.060 1.00 0.00 ATOM 19428 OH2 SOL 1442 18.940 28.240 73.550 1.00 0.00 ATOM 19429 H1 SOL 1442 19.760 28.370 74.040 1.00 0.00 ATOM 19430 H2 SOL 1442 19.220 28.150 72.640 1.00 0.00 ATOM 19431 OH2 SOL 1443 53.290 16.290 66.280 1.00 0.00 ATOM 19432 H1 SOL 1443 53.260 17.100 65.770 1.00 0.00 ATOM 19433 H2 SOL 1443 52.620 16.400 66.950 1.00 0.00 ATOM 19434 OH2 SOL 1444 52.870 32.200 12.830 1.00 0.00 ATOM 19435 H1 SOL 1444 52.920 31.270 12.580 1.00 0.00 ATOM 19436 H2 SOL 1444 53.590 32.610 12.370 1.00 0.00 ATOM 19437 OH2 SOL 1445 54.840 23.510 3.670 1.00 0.00 ATOM 19438 H1 SOL 1445 54.920 22.580 3.900 1.00 0.00 ATOM 19439 H2 SOL 1445 54.010 23.570 3.210 1.00 0.00 ATOM 19440 OH2 SOL 1446 57.160 29.330 12.310 1.00 0.00 ATOM 19441 H1 SOL 1446 57.120 28.950 13.190 1.00 0.00 ATOM 19442 H2 SOL 1446 57.840 28.820 11.860 1.00 0.00 ATOM 19443 OH2 SOL 1447 20.560 15.480 71.330 1.00 0.00 ATOM 19444 H1 SOL 1447 19.640 15.390 71.550 1.00 0.00 ATOM 19445 H2 SOL 1447 20.710 16.420 71.270 1.00 0.00 ATOM 19446 OH2 SOL 1448 18.440 52.730 -0.200 1.00 0.00 ATOM 19447 H1 SOL 1448 17.940 52.280 0.480 1.00 0.00 ATOM 19448 H2 SOL 1448 19.140 53.170 0.280 1.00 0.00 ATOM 19449 OH2 SOL 1449 22.880 25.850 18.640 1.00 0.00 ATOM 19450 H1 SOL 1449 23.800 25.750 18.400 1.00 0.00 ATOM 19451 H2 SOL 1449 22.750 25.240 19.360 1.00 0.00 ATOM 19452 OH2 SOL 1450 39.040 10.060 9.910 1.00 0.00 ATOM 19453 H1 SOL 1450 39.050 10.760 9.250 1.00 0.00 ATOM 19454 H2 SOL 1450 38.110 9.900 10.060 1.00 0.00 ATOM 19455 OH2 SOL 1451 30.920 58.220 70.260 1.00 0.00 ATOM 19456 H1 SOL 1451 30.860 58.670 69.420 1.00 0.00 ATOM 19457 H2 SOL 1451 30.860 57.290 70.040 1.00 0.00 ATOM 19458 OH2 SOL 1452 7.470 40.310 5.760 1.00 0.00 ATOM 19459 H1 SOL 1452 7.540 41.250 5.590 1.00 0.00 ATOM 19460 H2 SOL 1452 8.130 40.150 6.450 1.00 0.00 ATOM 19461 OH2 SOL 1453 9.700 53.760 18.960 1.00 0.00 ATOM 19462 H1 SOL 1453 9.840 54.680 19.180 1.00 0.00 ATOM 19463 H2 SOL 1453 9.920 53.290 19.770 1.00 0.00 ATOM 19464 OH2 SOL 1454 29.410 51.670 68.080 1.00 0.00 ATOM 19465 H1 SOL 1454 30.040 51.810 67.380 1.00 0.00 ATOM 19466 H2 SOL 1454 28.680 52.250 67.860 1.00 0.00 ATOM 19467 OH2 SOL 1455 46.430 41.670 10.440 1.00 0.00 ATOM 19468 H1 SOL 1455 46.480 42.320 9.740 1.00 0.00 ATOM 19469 H2 SOL 1455 47.130 41.050 10.230 1.00 0.00 ATOM 19470 OH2 SOL 1456 0.620 16.700 79.120 1.00 0.00 ATOM 19471 H1 SOL 1456 0.150 17.530 79.040 1.00 0.00 ATOM 19472 H2 SOL 1456 1.410 16.820 78.580 1.00 0.00 ATOM 19473 OH2 SOL 1457 8.640 5.770 16.530 1.00 0.00 ATOM 19474 H1 SOL 1457 9.580 5.740 16.360 1.00 0.00 ATOM 19475 H2 SOL 1457 8.500 5.090 17.190 1.00 0.00 ATOM 19476 OH2 SOL 1458 48.980 46.170 0.560 1.00 0.00 ATOM 19477 H1 SOL 1458 49.630 46.120 -0.140 1.00 0.00 ATOM 19478 H2 SOL 1458 48.310 45.530 0.310 1.00 0.00 ATOM 19479 OH2 SOL 1459 58.930 39.160 63.240 1.00 0.00 ATOM 19480 H1 SOL 1459 59.640 38.530 63.200 1.00 0.00 ATOM 19481 H2 SOL 1459 59.300 39.970 62.880 1.00 0.00 ATOM 19482 OH2 SOL 1460 9.880 44.920 73.230 1.00 0.00 ATOM 19483 H1 SOL 1460 9.540 44.650 74.080 1.00 0.00 ATOM 19484 H2 SOL 1460 10.830 44.840 73.310 1.00 0.00 ATOM 19485 OH2 SOL 1461 16.880 17.550 27.310 1.00 0.00 ATOM 19486 H1 SOL 1461 17.350 16.740 27.110 1.00 0.00 ATOM 19487 H2 SOL 1461 17.200 18.190 26.680 1.00 0.00 ATOM 19488 OH2 SOL 1462 21.740 22.100 0.220 1.00 0.00 ATOM 19489 H1 SOL 1462 21.610 22.840 -0.360 1.00 0.00 ATOM 19490 H2 SOL 1462 22.520 22.320 0.730 1.00 0.00 ATOM 19491 OH2 SOL 1463 58.530 44.210 8.840 1.00 0.00 ATOM 19492 H1 SOL 1463 59.030 44.240 9.650 1.00 0.00 ATOM 19493 H2 SOL 1463 58.270 45.120 8.690 1.00 0.00 ATOM 19494 OH2 SOL 1464 1.690 52.070 80.280 1.00 0.00 ATOM 19495 H1 SOL 1464 1.980 51.220 80.630 1.00 0.00 ATOM 19496 H2 SOL 1464 2.440 52.650 80.420 1.00 0.00 ATOM 19497 OH2 SOL 1465 21.930 58.330 2.740 1.00 0.00 ATOM 19498 H1 SOL 1465 21.900 59.290 2.740 1.00 0.00 ATOM 19499 H2 SOL 1465 21.180 58.070 3.270 1.00 0.00 ATOM 19500 OH2 SOL 1466 10.300 44.020 81.080 1.00 0.00 ATOM 19501 H1 SOL 1466 11.000 44.320 81.670 1.00 0.00 ATOM 19502 H2 SOL 1466 10.700 43.310 80.570 1.00 0.00 ATOM 19503 OH2 SOL 1467 11.330 4.670 13.490 1.00 0.00 ATOM 19504 H1 SOL 1467 11.480 4.670 14.430 1.00 0.00 ATOM 19505 H2 SOL 1467 10.570 4.100 13.360 1.00 0.00 ATOM 19506 OH2 SOL 1468 43.490 33.240 12.050 1.00 0.00 ATOM 19507 H1 SOL 1468 43.000 33.110 11.240 1.00 0.00 ATOM 19508 H2 SOL 1468 44.120 33.930 11.850 1.00 0.00 ATOM 19509 OH2 SOL 1469 30.910 25.490 60.610 1.00 0.00 ATOM 19510 H1 SOL 1469 30.550 25.380 61.490 1.00 0.00 ATOM 19511 H2 SOL 1469 30.840 26.430 60.440 1.00 0.00 ATOM 19512 OH2 SOL 1470 12.530 10.010 14.640 1.00 0.00 ATOM 19513 H1 SOL 1470 12.330 10.900 14.920 1.00 0.00 ATOM 19514 H2 SOL 1470 11.680 9.590 14.520 1.00 0.00 ATOM 19515 OH2 SOL 1471 17.920 11.300 0.860 1.00 0.00 ATOM 19516 H1 SOL 1471 18.000 12.110 0.360 1.00 0.00 ATOM 19517 H2 SOL 1471 17.080 11.380 1.310 1.00 0.00 ATOM 19518 OH2 SOL 1472 44.930 28.470 67.620 1.00 0.00 ATOM 19519 H1 SOL 1472 45.730 27.950 67.710 1.00 0.00 ATOM 19520 H2 SOL 1472 44.420 28.260 68.400 1.00 0.00 ATOM 19521 OH2 SOL 1473 34.100 10.100 60.830 1.00 0.00 ATOM 19522 H1 SOL 1473 34.930 10.430 61.180 1.00 0.00 ATOM 19523 H2 SOL 1473 33.430 10.680 61.200 1.00 0.00 ATOM 19524 OH2 SOL 1474 52.120 4.560 12.260 1.00 0.00 ATOM 19525 H1 SOL 1474 52.970 4.400 11.840 1.00 0.00 ATOM 19526 H2 SOL 1474 52.140 5.480 12.500 1.00 0.00 ATOM 19527 OH2 SOL 1475 13.380 39.410 74.490 1.00 0.00 ATOM 19528 H1 SOL 1475 13.590 38.850 73.740 1.00 0.00 ATOM 19529 H2 SOL 1475 12.450 39.620 74.380 1.00 0.00 ATOM 19530 OH2 SOL 1476 38.390 3.220 84.710 1.00 0.00 ATOM 19531 H1 SOL 1476 37.830 3.950 84.970 1.00 0.00 ATOM 19532 H2 SOL 1476 38.650 3.420 83.810 1.00 0.00 ATOM 19533 OH2 SOL 1477 14.550 2.580 9.450 1.00 0.00 ATOM 19534 H1 SOL 1477 13.660 2.700 9.780 1.00 0.00 ATOM 19535 H2 SOL 1477 14.480 2.680 8.500 1.00 0.00 ATOM 19536 OH2 SOL 1478 18.340 17.060 77.880 1.00 0.00 ATOM 19537 H1 SOL 1478 18.240 16.250 77.370 1.00 0.00 ATOM 19538 H2 SOL 1478 19.090 16.890 78.440 1.00 0.00 ATOM 19539 OH2 SOL 1479 4.150 13.750 15.700 1.00 0.00 ATOM 19540 H1 SOL 1479 4.890 13.250 16.050 1.00 0.00 ATOM 19541 H2 SOL 1479 3.450 13.110 15.610 1.00 0.00 ATOM 19542 OH2 SOL 1480 31.260 28.230 66.790 1.00 0.00 ATOM 19543 H1 SOL 1480 30.840 28.800 67.440 1.00 0.00 ATOM 19544 H2 SOL 1480 31.420 27.410 67.260 1.00 0.00 ATOM 19545 OH2 SOL 1481 36.210 45.470 79.630 1.00 0.00 ATOM 19546 H1 SOL 1481 36.950 45.410 80.230 1.00 0.00 ATOM 19547 H2 SOL 1481 35.620 44.760 79.910 1.00 0.00 ATOM 19548 OH2 SOL 1482 39.530 52.530 5.180 1.00 0.00 ATOM 19549 H1 SOL 1482 40.070 52.960 5.840 1.00 0.00 ATOM 19550 H2 SOL 1482 39.050 53.250 4.760 1.00 0.00 ATOM 19551 OH2 SOL 1483 10.640 51.520 0.490 1.00 0.00 ATOM 19552 H1 SOL 1483 10.980 51.020 1.230 1.00 0.00 ATOM 19553 H2 SOL 1483 9.690 51.520 0.620 1.00 0.00 ATOM 19554 OH2 SOL 1484 13.020 7.590 2.230 1.00 0.00 ATOM 19555 H1 SOL 1484 13.840 7.310 2.630 1.00 0.00 ATOM 19556 H2 SOL 1484 12.350 7.320 2.860 1.00 0.00 ATOM 19557 OH2 SOL 1485 22.160 25.610 15.620 1.00 0.00 ATOM 19558 H1 SOL 1485 22.270 25.850 16.540 1.00 0.00 ATOM 19559 H2 SOL 1485 21.250 25.830 15.420 1.00 0.00 ATOM 19560 OH2 SOL 1486 51.580 53.480 75.300 1.00 0.00 ATOM 19561 H1 SOL 1486 50.830 54.010 75.020 1.00 0.00 ATOM 19562 H2 SOL 1486 52.000 53.210 74.490 1.00 0.00 ATOM 19563 OH2 SOL 1487 51.440 11.350 6.570 1.00 0.00 ATOM 19564 H1 SOL 1487 50.620 10.890 6.410 1.00 0.00 ATOM 19565 H2 SOL 1487 52.050 10.670 6.840 1.00 0.00 ATOM 19566 OH2 SOL 1488 9.500 42.870 66.410 1.00 0.00 ATOM 19567 H1 SOL 1488 9.600 43.180 67.310 1.00 0.00 ATOM 19568 H2 SOL 1488 10.390 42.860 66.060 1.00 0.00 ATOM 19569 OH2 SOL 1489 24.640 43.380 76.230 1.00 0.00 ATOM 19570 H1 SOL 1489 24.150 42.940 76.920 1.00 0.00 ATOM 19571 H2 SOL 1489 25.490 43.570 76.620 1.00 0.00 ATOM 19572 OH2 SOL 1490 20.320 11.020 4.850 1.00 0.00 ATOM 19573 H1 SOL 1490 20.430 10.850 5.790 1.00 0.00 ATOM 19574 H2 SOL 1490 20.090 11.950 4.800 1.00 0.00 ATOM 19575 OH2 SOL 1491 54.480 31.480 77.380 1.00 0.00 ATOM 19576 H1 SOL 1491 54.650 30.740 77.960 1.00 0.00 ATOM 19577 H2 SOL 1491 55.070 31.350 76.630 1.00 0.00 ATOM 19578 OH2 SOL 1492 29.780 58.170 17.360 1.00 0.00 ATOM 19579 H1 SOL 1492 30.250 58.440 18.150 1.00 0.00 ATOM 19580 H2 SOL 1492 30.110 58.740 16.670 1.00 0.00 ATOM 19581 OH2 SOL 1493 16.130 6.160 69.260 1.00 0.00 ATOM 19582 H1 SOL 1493 16.610 6.520 70.010 1.00 0.00 ATOM 19583 H2 SOL 1493 16.440 6.670 68.520 1.00 0.00 ATOM 19584 OH2 SOL 1494 26.290 7.070 70.850 1.00 0.00 ATOM 19585 H1 SOL 1494 26.640 7.610 71.560 1.00 0.00 ATOM 19586 H2 SOL 1494 25.360 6.960 71.070 1.00 0.00 ATOM 19587 OH2 SOL 1495 43.050 40.970 5.000 1.00 0.00 ATOM 19588 H1 SOL 1495 42.530 41.370 5.700 1.00 0.00 ATOM 19589 H2 SOL 1495 43.280 40.100 5.340 1.00 0.00 ATOM 19590 OH2 SOL 1496 3.150 0.620 2.350 1.00 0.00 ATOM 19591 H1 SOL 1496 2.730 1.450 2.570 1.00 0.00 ATOM 19592 H2 SOL 1496 3.040 0.080 3.130 1.00 0.00 ATOM 19593 OH2 SOL 1497 50.500 45.320 67.370 1.00 0.00 ATOM 19594 H1 SOL 1497 50.030 46.140 67.500 1.00 0.00 ATOM 19595 H2 SOL 1497 51.050 45.480 66.600 1.00 0.00 ATOM 19596 OH2 SOL 1498 4.160 21.770 2.100 1.00 0.00 ATOM 19597 H1 SOL 1498 4.150 20.940 1.620 1.00 0.00 ATOM 19598 H2 SOL 1498 3.770 21.560 2.950 1.00 0.00 ATOM 19599 OH2 SOL 1499 42.710 55.030 17.600 1.00 0.00 ATOM 19600 H1 SOL 1499 43.220 55.330 16.850 1.00 0.00 ATOM 19601 H2 SOL 1499 42.420 54.150 17.360 1.00 0.00 ATOM 19602 OH2 SOL 1500 4.010 38.990 11.960 1.00 0.00 ATOM 19603 H1 SOL 1500 4.860 38.670 11.630 1.00 0.00 ATOM 19604 H2 SOL 1500 3.490 39.110 11.170 1.00 0.00 ATOM 19605 OH2 SOL 1501 29.440 19.510 62.000 1.00 0.00 ATOM 19606 H1 SOL 1501 29.140 19.550 62.910 1.00 0.00 ATOM 19607 H2 SOL 1501 30.390 19.430 62.070 1.00 0.00 ATOM 19608 OH2 SOL 1502 33.200 39.490 24.980 1.00 0.00 ATOM 19609 H1 SOL 1502 33.640 39.250 25.790 1.00 0.00 ATOM 19610 H2 SOL 1502 32.510 38.840 24.880 1.00 0.00 ATOM 19611 OH2 SOL 1503 10.160 8.650 84.520 1.00 0.00 ATOM 19612 H1 SOL 1503 9.290 8.370 84.820 1.00 0.00 ATOM 19613 H2 SOL 1503 10.270 9.530 84.890 1.00 0.00 ATOM 19614 OH2 SOL 1504 28.570 40.210 15.430 1.00 0.00 ATOM 19615 H1 SOL 1504 27.650 40.000 15.270 1.00 0.00 ATOM 19616 H2 SOL 1504 28.980 39.370 15.620 1.00 0.00 ATOM 19617 OH2 SOL 1505 54.170 3.660 78.500 1.00 0.00 ATOM 19618 H1 SOL 1505 54.820 3.010 78.770 1.00 0.00 ATOM 19619 H2 SOL 1505 54.610 4.170 77.810 1.00 0.00 ATOM 19620 OH2 SOL 1506 39.160 35.350 10.420 1.00 0.00 ATOM 19621 H1 SOL 1506 38.230 35.240 10.650 1.00 0.00 ATOM 19622 H2 SOL 1506 39.580 35.590 11.250 1.00 0.00 ATOM 19623 OH2 SOL 1507 40.700 11.250 23.070 1.00 0.00 ATOM 19624 H1 SOL 1507 40.910 12.150 22.820 1.00 0.00 ATOM 19625 H2 SOL 1507 39.810 11.110 22.750 1.00 0.00 ATOM 19626 OH2 SOL 1508 22.120 14.570 10.390 1.00 0.00 ATOM 19627 H1 SOL 1508 21.640 15.340 10.090 1.00 0.00 ATOM 19628 H2 SOL 1508 23.030 14.860 10.470 1.00 0.00 ATOM 19629 OH2 SOL 1509 24.380 1.380 9.200 1.00 0.00 ATOM 19630 H1 SOL 1509 24.170 0.700 9.850 1.00 0.00 ATOM 19631 H2 SOL 1509 24.840 0.900 8.510 1.00 0.00 ATOM 19632 OH2 SOL 1510 0.770 57.950 77.520 1.00 0.00 ATOM 19633 H1 SOL 1510 0.350 58.720 77.130 1.00 0.00 ATOM 19634 H2 SOL 1510 1.700 58.070 77.330 1.00 0.00 ATOM 19635 OH2 SOL 1511 21.030 35.420 15.640 1.00 0.00 ATOM 19636 H1 SOL 1511 20.670 34.730 16.200 1.00 0.00 ATOM 19637 H2 SOL 1511 20.480 36.190 15.810 1.00 0.00 ATOM 19638 OH2 SOL 1512 37.840 41.180 62.660 1.00 0.00 ATOM 19639 H1 SOL 1512 37.680 41.000 61.730 1.00 0.00 ATOM 19640 H2 SOL 1512 37.930 42.130 62.700 1.00 0.00 ATOM 19641 OH2 SOL 1513 37.730 27.960 82.130 1.00 0.00 ATOM 19642 H1 SOL 1513 37.760 28.490 81.330 1.00 0.00 ATOM 19643 H2 SOL 1513 37.570 28.580 82.830 1.00 0.00 ATOM 19644 OH2 SOL 1514 45.790 55.930 23.670 1.00 0.00 ATOM 19645 H1 SOL 1514 45.370 56.790 23.760 1.00 0.00 ATOM 19646 H2 SOL 1514 45.410 55.400 24.370 1.00 0.00 ATOM 19647 OH2 SOL 1515 0.760 56.690 17.050 1.00 0.00 ATOM 19648 H1 SOL 1515 0.120 56.790 17.750 1.00 0.00 ATOM 19649 H2 SOL 1515 1.060 55.780 17.130 1.00 0.00 ATOM 19650 OH2 SOL 1516 31.120 34.280 3.960 1.00 0.00 ATOM 19651 H1 SOL 1516 30.600 33.550 3.610 1.00 0.00 ATOM 19652 H2 SOL 1516 30.850 34.340 4.870 1.00 0.00 ATOM 19653 OH2 SOL 1517 28.780 7.050 75.870 1.00 0.00 ATOM 19654 H1 SOL 1517 28.700 7.500 76.720 1.00 0.00 ATOM 19655 H2 SOL 1517 28.880 6.130 76.090 1.00 0.00 ATOM 19656 OH2 SOL 1518 57.240 36.250 63.640 1.00 0.00 ATOM 19657 H1 SOL 1518 58.060 36.680 63.410 1.00 0.00 ATOM 19658 H2 SOL 1518 56.630 36.500 62.940 1.00 0.00 ATOM 19659 OH2 SOL 1519 27.960 48.680 10.700 1.00 0.00 ATOM 19660 H1 SOL 1519 28.390 49.520 10.860 1.00 0.00 ATOM 19661 H2 SOL 1519 28.110 48.500 9.770 1.00 0.00 ATOM 19662 OH2 SOL 1520 36.480 32.350 64.070 1.00 0.00 ATOM 19663 H1 SOL 1520 36.580 32.980 63.360 1.00 0.00 ATOM 19664 H2 SOL 1520 35.560 32.090 64.030 1.00 0.00 ATOM 19665 OH2 SOL 1521 47.160 45.670 21.290 1.00 0.00 ATOM 19666 H1 SOL 1521 47.770 45.800 22.010 1.00 0.00 ATOM 19667 H2 SOL 1521 47.650 45.140 20.650 1.00 0.00 ATOM 19668 OH2 SOL 1522 44.160 9.500 74.360 1.00 0.00 ATOM 19669 H1 SOL 1522 44.720 9.040 74.990 1.00 0.00 ATOM 19670 H2 SOL 1522 44.680 10.260 74.080 1.00 0.00 ATOM 19671 OH2 SOL 1523 32.890 33.940 65.570 1.00 0.00 ATOM 19672 H1 SOL 1523 32.560 33.720 64.700 1.00 0.00 ATOM 19673 H2 SOL 1523 33.550 34.610 65.410 1.00 0.00 ATOM 19674 OH2 SOL 1524 1.460 10.550 67.420 1.00 0.00 ATOM 19675 H1 SOL 1524 2.140 10.590 68.100 1.00 0.00 ATOM 19676 H2 SOL 1524 1.790 9.920 66.780 1.00 0.00 ATOM 19677 OH2 SOL 1525 38.420 22.290 20.290 1.00 0.00 ATOM 19678 H1 SOL 1525 37.560 22.260 19.860 1.00 0.00 ATOM 19679 H2 SOL 1525 38.760 21.400 20.230 1.00 0.00 ATOM 19680 OH2 SOL 1526 22.900 3.890 80.710 1.00 0.00 ATOM 19681 H1 SOL 1526 22.210 3.380 80.280 1.00 0.00 ATOM 19682 H2 SOL 1526 23.460 3.240 81.130 1.00 0.00 ATOM 19683 OH2 SOL 1527 46.190 48.510 12.730 1.00 0.00 ATOM 19684 H1 SOL 1527 45.920 48.390 11.820 1.00 0.00 ATOM 19685 H2 SOL 1527 47.120 48.280 12.740 1.00 0.00 ATOM 19686 OH2 SOL 1528 39.440 3.740 15.900 1.00 0.00 ATOM 19687 H1 SOL 1528 38.780 3.920 15.240 1.00 0.00 ATOM 19688 H2 SOL 1528 39.460 2.790 15.960 1.00 0.00 ATOM 19689 OH2 SOL 1529 48.450 27.810 14.260 1.00 0.00 ATOM 19690 H1 SOL 1529 47.840 27.720 14.990 1.00 0.00 ATOM 19691 H2 SOL 1529 48.290 28.690 13.920 1.00 0.00 ATOM 19692 OH2 SOL 1530 28.210 9.180 61.200 1.00 0.00 ATOM 19693 H1 SOL 1530 28.320 8.230 61.230 1.00 0.00 ATOM 19694 H2 SOL 1530 29.050 9.500 60.870 1.00 0.00 ATOM 19695 OH2 SOL 1531 23.530 38.040 15.100 1.00 0.00 ATOM 19696 H1 SOL 1531 23.730 37.110 14.980 1.00 0.00 ATOM 19697 H2 SOL 1531 22.910 38.250 14.400 1.00 0.00 ATOM 19698 OH2 SOL 1532 17.630 19.740 25.790 1.00 0.00 ATOM 19699 H1 SOL 1532 17.870 20.590 26.160 1.00 0.00 ATOM 19700 H2 SOL 1532 16.820 19.900 25.310 1.00 0.00 ATOM 19701 OH2 SOL 1533 39.770 41.280 75.540 1.00 0.00 ATOM 19702 H1 SOL 1533 40.160 41.700 74.770 1.00 0.00 ATOM 19703 H2 SOL 1533 38.930 41.720 75.650 1.00 0.00 ATOM 19704 OH2 SOL 1534 41.630 50.780 68.430 1.00 0.00 ATOM 19705 H1 SOL 1534 42.390 50.600 67.870 1.00 0.00 ATOM 19706 H2 SOL 1534 41.250 49.920 68.600 1.00 0.00 ATOM 19707 OH2 SOL 1535 20.700 60.470 77.540 1.00 0.00 ATOM 19708 H1 SOL 1535 20.940 59.670 78.010 1.00 0.00 ATOM 19709 H2 SOL 1535 19.740 60.420 77.480 1.00 0.00 ATOM 19710 OH2 SOL 1536 30.410 22.440 14.840 1.00 0.00 ATOM 19711 H1 SOL 1536 29.650 22.560 15.410 1.00 0.00 ATOM 19712 H2 SOL 1536 31.140 22.310 15.440 1.00 0.00 ATOM 19713 OH2 SOL 1537 47.680 25.980 8.550 1.00 0.00 ATOM 19714 H1 SOL 1537 46.970 26.470 8.960 1.00 0.00 ATOM 19715 H2 SOL 1537 47.380 25.850 7.650 1.00 0.00 ATOM 19716 OH2 SOL 1538 21.300 29.040 79.410 1.00 0.00 ATOM 19717 H1 SOL 1538 21.920 29.740 79.190 1.00 0.00 ATOM 19718 H2 SOL 1538 21.670 28.640 80.200 1.00 0.00 ATOM 19719 OH2 SOL 1539 40.000 46.510 5.330 1.00 0.00 ATOM 19720 H1 SOL 1539 39.520 46.270 6.120 1.00 0.00 ATOM 19721 H2 SOL 1539 39.550 47.280 4.990 1.00 0.00 ATOM 19722 OH2 SOL 1540 51.460 35.400 2.880 1.00 0.00 ATOM 19723 H1 SOL 1540 51.790 35.910 2.140 1.00 0.00 ATOM 19724 H2 SOL 1540 52.150 34.760 3.050 1.00 0.00 ATOM 19725 OH2 SOL 1541 28.770 6.190 69.930 1.00 0.00 ATOM 19726 H1 SOL 1541 27.830 6.350 69.940 1.00 0.00 ATOM 19727 H2 SOL 1541 29.130 6.790 70.580 1.00 0.00 ATOM 19728 OH2 SOL 1542 51.630 9.070 20.990 1.00 0.00 ATOM 19729 H1 SOL 1542 51.840 10.000 21.020 1.00 0.00 ATOM 19730 H2 SOL 1542 51.980 8.770 20.150 1.00 0.00 ATOM 19731 OH2 SOL 1543 18.860 58.090 65.340 1.00 0.00 ATOM 19732 H1 SOL 1543 18.920 57.240 64.920 1.00 0.00 ATOM 19733 H2 SOL 1543 19.750 58.430 65.330 1.00 0.00 ATOM 19734 OH2 SOL 1544 18.340 44.110 13.400 1.00 0.00 ATOM 19735 H1 SOL 1544 18.040 44.520 14.210 1.00 0.00 ATOM 19736 H2 SOL 1544 17.920 44.620 12.700 1.00 0.00 ATOM 19737 OH2 SOL 1545 32.070 54.420 2.510 1.00 0.00 ATOM 19738 H1 SOL 1545 32.520 55.070 1.970 1.00 0.00 ATOM 19739 H2 SOL 1545 32.550 54.430 3.340 1.00 0.00 ATOM 19740 OH2 SOL 1546 2.180 41.080 74.870 1.00 0.00 ATOM 19741 H1 SOL 1546 2.460 41.980 75.040 1.00 0.00 ATOM 19742 H2 SOL 1546 2.960 40.550 74.980 1.00 0.00 ATOM 19743 OH2 SOL 1547 17.790 50.040 10.310 1.00 0.00 ATOM 19744 H1 SOL 1547 17.380 49.400 9.740 1.00 0.00 ATOM 19745 H2 SOL 1547 18.730 49.980 10.120 1.00 0.00 ATOM 19746 OH2 SOL 1548 42.680 24.690 24.540 1.00 0.00 ATOM 19747 H1 SOL 1548 43.410 24.140 24.230 1.00 0.00 ATOM 19748 H2 SOL 1548 43.020 25.110 25.330 1.00 0.00 ATOM 19749 OH2 SOL 1549 12.680 55.380 74.530 1.00 0.00 ATOM 19750 H1 SOL 1549 12.950 54.530 74.880 1.00 0.00 ATOM 19751 H2 SOL 1549 11.780 55.490 74.850 1.00 0.00 ATOM 19752 OH2 SOL 1550 27.630 26.800 5.030 1.00 0.00 ATOM 19753 H1 SOL 1550 26.890 27.110 5.550 1.00 0.00 ATOM 19754 H2 SOL 1550 27.240 26.420 4.250 1.00 0.00 ATOM 19755 OH2 SOL 1551 22.720 56.710 8.370 1.00 0.00 ATOM 19756 H1 SOL 1551 21.850 56.370 8.180 1.00 0.00 ATOM 19757 H2 SOL 1551 22.820 57.460 7.790 1.00 0.00 ATOM 19758 OH2 SOL 1552 59.120 24.360 84.470 1.00 0.00 ATOM 19759 H1 SOL 1552 59.780 23.680 84.470 1.00 0.00 ATOM 19760 H2 SOL 1552 58.570 24.160 83.710 1.00 0.00 ATOM 19761 OH2 SOL 1553 8.420 12.990 65.820 1.00 0.00 ATOM 19762 H1 SOL 1553 8.260 12.100 66.140 1.00 0.00 ATOM 19763 H2 SOL 1553 9.180 13.300 66.320 1.00 0.00 ATOM 19764 OH2 SOL 1554 33.090 53.380 69.550 1.00 0.00 ATOM 19765 H1 SOL 1554 32.830 53.950 70.280 1.00 0.00 ATOM 19766 H2 SOL 1554 32.290 53.310 69.020 1.00 0.00 ATOM 19767 OH2 SOL 1555 21.050 20.610 11.960 1.00 0.00 ATOM 19768 H1 SOL 1555 21.120 21.330 12.590 1.00 0.00 ATOM 19769 H2 SOL 1555 21.770 20.750 11.350 1.00 0.00 ATOM 19770 OH2 SOL 1556 33.060 39.840 15.470 1.00 0.00 ATOM 19771 H1 SOL 1556 33.870 39.800 14.960 1.00 0.00 ATOM 19772 H2 SOL 1556 33.200 39.240 16.200 1.00 0.00 ATOM 19773 OH2 SOL 1557 10.730 33.900 7.630 1.00 0.00 ATOM 19774 H1 SOL 1557 9.950 34.270 7.220 1.00 0.00 ATOM 19775 H2 SOL 1557 11.040 33.250 7.000 1.00 0.00 ATOM 19776 OH2 SOL 1558 52.390 9.190 66.400 1.00 0.00 ATOM 19777 H1 SOL 1558 52.000 8.420 66.810 1.00 0.00 ATOM 19778 H2 SOL 1558 51.710 9.860 66.440 1.00 0.00 ATOM 19779 OH2 SOL 1559 22.870 47.260 70.710 1.00 0.00 ATOM 19780 H1 SOL 1559 22.660 47.130 69.780 1.00 0.00 ATOM 19781 H2 SOL 1559 22.370 46.590 71.170 1.00 0.00 ATOM 19782 OH2 SOL 1560 29.610 42.970 81.350 1.00 0.00 ATOM 19783 H1 SOL 1560 30.270 43.330 81.940 1.00 0.00 ATOM 19784 H2 SOL 1560 29.100 43.720 81.060 1.00 0.00 ATOM 19785 OH2 SOL 1561 36.850 7.180 70.180 1.00 0.00 ATOM 19786 H1 SOL 1561 37.380 7.980 70.220 1.00 0.00 ATOM 19787 H2 SOL 1561 37.000 6.830 69.300 1.00 0.00 ATOM 19788 OH2 SOL 1562 47.280 50.310 69.610 1.00 0.00 ATOM 19789 H1 SOL 1562 46.480 49.950 69.220 1.00 0.00 ATOM 19790 H2 SOL 1562 47.830 50.540 68.860 1.00 0.00 ATOM 19791 OH2 SOL 1563 32.890 58.240 84.360 1.00 0.00 ATOM 19792 H1 SOL 1563 32.060 58.000 83.960 1.00 0.00 ATOM 19793 H2 SOL 1563 33.030 57.600 85.050 1.00 0.00 ATOM 19794 OH2 SOL 1564 8.180 28.520 22.670 1.00 0.00 ATOM 19795 H1 SOL 1564 7.380 28.860 22.280 1.00 0.00 ATOM 19796 H2 SOL 1564 8.510 29.240 23.220 1.00 0.00 ATOM 19797 OH2 SOL 1565 24.430 29.240 22.790 1.00 0.00 ATOM 19798 H1 SOL 1565 23.560 29.630 22.780 1.00 0.00 ATOM 19799 H2 SOL 1565 24.990 29.860 22.320 1.00 0.00 ATOM 19800 OH2 SOL 1566 31.640 28.190 70.560 1.00 0.00 ATOM 19801 H1 SOL 1566 30.900 27.620 70.770 1.00 0.00 ATOM 19802 H2 SOL 1566 31.410 28.590 69.720 1.00 0.00 ATOM 19803 OH2 SOL 1567 49.280 20.070 81.830 1.00 0.00 ATOM 19804 H1 SOL 1567 49.840 20.360 82.550 1.00 0.00 ATOM 19805 H2 SOL 1567 48.690 20.810 81.680 1.00 0.00 ATOM 19806 OH2 SOL 1568 3.360 47.600 71.580 1.00 0.00 ATOM 19807 H1 SOL 1568 3.740 47.050 70.890 1.00 0.00 ATOM 19808 H2 SOL 1568 2.410 47.470 71.500 1.00 0.00 ATOM 19809 OH2 SOL 1569 44.240 58.440 2.670 1.00 0.00 ATOM 19810 H1 SOL 1569 43.610 59.130 2.900 1.00 0.00 ATOM 19811 H2 SOL 1569 45.080 58.750 3.000 1.00 0.00 ATOM 19812 OH2 SOL 1570 29.970 55.500 71.020 1.00 0.00 ATOM 19813 H1 SOL 1570 29.260 55.670 70.400 1.00 0.00 ATOM 19814 H2 SOL 1570 29.670 54.740 71.520 1.00 0.00 ATOM 19815 OH2 SOL 1571 31.530 40.500 5.660 1.00 0.00 ATOM 19816 H1 SOL 1571 32.320 40.220 5.190 1.00 0.00 ATOM 19817 H2 SOL 1571 30.990 39.720 5.710 1.00 0.00 ATOM 19818 OH2 SOL 1572 52.750 29.790 61.350 1.00 0.00 ATOM 19819 H1 SOL 1572 52.500 30.640 61.710 1.00 0.00 ATOM 19820 H2 SOL 1572 51.950 29.440 60.980 1.00 0.00 ATOM 19821 OH2 SOL 1573 12.770 11.620 79.550 1.00 0.00 ATOM 19822 H1 SOL 1573 12.960 12.550 79.480 1.00 0.00 ATOM 19823 H2 SOL 1573 13.510 11.180 79.140 1.00 0.00 ATOM 19824 OH2 SOL 1574 2.690 37.530 71.930 1.00 0.00 ATOM 19825 H1 SOL 1574 3.320 37.320 71.240 1.00 0.00 ATOM 19826 H2 SOL 1574 2.710 38.490 71.980 1.00 0.00 ATOM 19827 OH2 SOL 1575 10.700 3.220 78.290 1.00 0.00 ATOM 19828 H1 SOL 1575 11.230 3.210 79.080 1.00 0.00 ATOM 19829 H2 SOL 1575 11.270 2.870 77.610 1.00 0.00 ATOM 19830 OH2 SOL 1576 54.730 52.970 75.920 1.00 0.00 ATOM 19831 H1 SOL 1576 53.820 52.820 75.660 1.00 0.00 ATOM 19832 H2 SOL 1576 55.070 53.590 75.280 1.00 0.00 ATOM 19833 OH2 SOL 1577 42.570 5.070 61.180 1.00 0.00 ATOM 19834 H1 SOL 1577 41.900 5.240 60.530 1.00 0.00 ATOM 19835 H2 SOL 1577 42.860 5.940 61.460 1.00 0.00 ATOM 19836 OH2 SOL 1578 20.590 41.750 72.060 1.00 0.00 ATOM 19837 H1 SOL 1578 20.560 42.170 71.210 1.00 0.00 ATOM 19838 H2 SOL 1578 21.490 41.880 72.370 1.00 0.00 ATOM 19839 OH2 SOL 1579 27.520 11.070 82.700 1.00 0.00 ATOM 19840 H1 SOL 1579 27.270 10.990 81.770 1.00 0.00 ATOM 19841 H2 SOL 1579 27.310 10.220 83.080 1.00 0.00 ATOM 19842 OH2 SOL 1580 8.620 16.830 22.070 1.00 0.00 ATOM 19843 H1 SOL 1580 8.110 17.440 21.530 1.00 0.00 ATOM 19844 H2 SOL 1580 7.990 16.450 22.680 1.00 0.00 ATOM 19845 OH2 SOL 1581 34.870 4.960 63.650 1.00 0.00 ATOM 19846 H1 SOL 1581 35.240 5.780 63.320 1.00 0.00 ATOM 19847 H2 SOL 1581 34.380 5.220 64.440 1.00 0.00 ATOM 19848 OH2 SOL 1582 52.100 21.400 77.790 1.00 0.00 ATOM 19849 H1 SOL 1582 51.840 21.550 78.700 1.00 0.00 ATOM 19850 H2 SOL 1582 52.080 20.450 77.680 1.00 0.00 ATOM 19851 OH2 SOL 1583 4.590 36.230 73.520 1.00 0.00 ATOM 19852 H1 SOL 1583 3.660 36.370 73.320 1.00 0.00 ATOM 19853 H2 SOL 1583 5.030 36.340 72.680 1.00 0.00 ATOM 19854 OH2 SOL 1584 14.560 42.920 71.330 1.00 0.00 ATOM 19855 H1 SOL 1584 15.190 43.640 71.260 1.00 0.00 ATOM 19856 H2 SOL 1584 14.050 43.120 72.120 1.00 0.00 ATOM 19857 OH2 SOL 1585 24.430 1.520 81.800 1.00 0.00 ATOM 19858 H1 SOL 1585 23.830 0.860 81.460 1.00 0.00 ATOM 19859 H2 SOL 1585 25.280 1.270 81.440 1.00 0.00 ATOM 19860 OH2 SOL 1586 38.160 5.150 62.700 1.00 0.00 ATOM 19861 H1 SOL 1586 38.870 4.880 62.120 1.00 0.00 ATOM 19862 H2 SOL 1586 37.390 4.680 62.370 1.00 0.00 ATOM 19863 OH2 SOL 1587 47.700 -0.200 58.730 1.00 0.00 ATOM 19864 H1 SOL 1587 48.500 -0.040 58.240 1.00 0.00 ATOM 19865 H2 SOL 1587 47.490 0.650 59.140 1.00 0.00 ATOM 19866 OH2 SOL 1588 3.730 51.900 7.790 1.00 0.00 ATOM 19867 H1 SOL 1588 4.190 51.630 8.600 1.00 0.00 ATOM 19868 H2 SOL 1588 3.160 51.160 7.590 1.00 0.00 ATOM 19869 OH2 SOL 1589 48.220 29.480 9.220 1.00 0.00 ATOM 19870 H1 SOL 1589 47.370 29.580 9.640 1.00 0.00 ATOM 19871 H2 SOL 1589 48.530 28.610 9.500 1.00 0.00 ATOM 19872 OH2 SOL 1590 5.320 17.150 3.150 1.00 0.00 ATOM 19873 H1 SOL 1590 5.100 17.560 2.320 1.00 0.00 ATOM 19874 H2 SOL 1590 6.170 17.530 3.390 1.00 0.00 ATOM 19875 OH2 SOL 1591 51.910 39.110 69.110 1.00 0.00 ATOM 19876 H1 SOL 1591 51.210 38.480 68.910 1.00 0.00 ATOM 19877 H2 SOL 1591 51.450 39.860 69.490 1.00 0.00 ATOM 19878 OH2 SOL 1592 8.860 26.160 64.760 1.00 0.00 ATOM 19879 H1 SOL 1592 9.640 26.270 64.220 1.00 0.00 ATOM 19880 H2 SOL 1592 9.030 25.390 65.290 1.00 0.00 ATOM 19881 OH2 SOL 1593 1.690 46.800 80.100 1.00 0.00 ATOM 19882 H1 SOL 1593 2.510 47.020 79.660 1.00 0.00 ATOM 19883 H2 SOL 1593 1.230 47.630 80.180 1.00 0.00 ATOM 19884 OH2 SOL 1594 38.730 56.430 65.350 1.00 0.00 ATOM 19885 H1 SOL 1594 39.510 56.050 64.960 1.00 0.00 ATOM 19886 H2 SOL 1594 39.040 57.220 65.800 1.00 0.00 ATOM 19887 OH2 SOL 1595 34.170 39.190 9.560 1.00 0.00 ATOM 19888 H1 SOL 1595 33.970 38.910 8.660 1.00 0.00 ATOM 19889 H2 SOL 1595 33.320 39.180 10.000 1.00 0.00 ATOM 19890 OH2 SOL 1596 39.130 25.330 83.860 1.00 0.00 ATOM 19891 H1 SOL 1596 38.660 26.160 83.780 1.00 0.00 ATOM 19892 H2 SOL 1596 38.690 24.880 84.580 1.00 0.00 ATOM 19893 OH2 SOL 1597 47.890 14.960 63.560 1.00 0.00 ATOM 19894 H1 SOL 1597 48.590 15.380 63.060 1.00 0.00 ATOM 19895 H2 SOL 1597 47.150 15.550 63.470 1.00 0.00 ATOM 19896 OH2 SOL 1598 19.670 32.370 6.190 1.00 0.00 ATOM 19897 H1 SOL 1598 19.240 32.770 5.430 1.00 0.00 ATOM 19898 H2 SOL 1598 19.900 33.100 6.750 1.00 0.00 ATOM 19899 OH2 SOL 1599 16.720 30.440 64.510 1.00 0.00 ATOM 19900 H1 SOL 1599 16.110 30.690 65.210 1.00 0.00 ATOM 19901 H2 SOL 1599 16.520 29.520 64.330 1.00 0.00 ATOM 19902 OH2 SOL 1600 13.840 55.150 63.110 1.00 0.00 ATOM 19903 H1 SOL 1600 13.950 55.650 62.300 1.00 0.00 ATOM 19904 H2 SOL 1600 14.650 55.300 63.600 1.00 0.00 ATOM 19905 OH2 SOL 1601 32.620 43.800 79.000 1.00 0.00 ATOM 19906 H1 SOL 1601 32.040 43.070 78.790 1.00 0.00 ATOM 19907 H2 SOL 1601 33.120 43.500 79.760 1.00 0.00 ATOM 19908 OH2 SOL 1602 34.380 28.740 4.780 1.00 0.00 ATOM 19909 H1 SOL 1602 33.910 28.030 4.360 1.00 0.00 ATOM 19910 H2 SOL 1602 34.920 29.120 4.090 1.00 0.00 ATOM 19911 OH2 SOL 1603 42.580 32.180 14.450 1.00 0.00 ATOM 19912 H1 SOL 1603 41.950 32.880 14.590 1.00 0.00 ATOM 19913 H2 SOL 1603 43.080 32.460 13.670 1.00 0.00 ATOM 19914 OH2 SOL 1604 3.870 17.070 5.560 1.00 0.00 ATOM 19915 H1 SOL 1604 4.320 17.180 4.710 1.00 0.00 ATOM 19916 H2 SOL 1604 2.950 16.950 5.330 1.00 0.00 ATOM 19917 OH2 SOL 1605 18.340 22.180 26.810 1.00 0.00 ATOM 19918 H1 SOL 1605 17.790 22.960 26.900 1.00 0.00 ATOM 19919 H2 SOL 1605 18.230 21.720 27.640 1.00 0.00 ATOM 19920 OH2 SOL 1606 52.230 15.930 10.250 1.00 0.00 ATOM 19921 H1 SOL 1606 52.720 16.690 9.930 1.00 0.00 ATOM 19922 H2 SOL 1606 52.720 15.640 11.020 1.00 0.00 ATOM 19923 OH2 SOL 1607 45.640 7.420 3.340 1.00 0.00 ATOM 19924 H1 SOL 1607 46.570 7.300 3.150 1.00 0.00 ATOM 19925 H2 SOL 1607 45.610 7.590 4.280 1.00 0.00 ATOM 19926 OH2 SOL 1608 30.580 57.640 3.750 1.00 0.00 ATOM 19927 H1 SOL 1608 31.510 57.840 3.800 1.00 0.00 ATOM 19928 H2 SOL 1608 30.330 57.390 4.640 1.00 0.00 ATOM 19929 OH2 SOL 1609 52.260 29.000 0.890 1.00 0.00 ATOM 19930 H1 SOL 1609 51.920 29.130 1.770 1.00 0.00 ATOM 19931 H2 SOL 1609 52.130 28.070 0.720 1.00 0.00 ATOM 19932 OH2 SOL 1610 55.980 57.760 67.640 1.00 0.00 ATOM 19933 H1 SOL 1610 55.730 58.030 66.760 1.00 0.00 ATOM 19934 H2 SOL 1610 56.480 58.500 67.990 1.00 0.00 ATOM 19935 OH2 SOL 1611 30.960 23.260 0.500 1.00 0.00 ATOM 19936 H1 SOL 1611 30.000 23.290 0.450 1.00 0.00 ATOM 19937 H2 SOL 1611 31.250 23.740 -0.280 1.00 0.00 ATOM 19938 OH2 SOL 1612 16.460 49.530 83.310 1.00 0.00 ATOM 19939 H1 SOL 1612 16.750 49.070 82.520 1.00 0.00 ATOM 19940 H2 SOL 1612 17.200 49.470 83.910 1.00 0.00 ATOM 19941 OH2 SOL 1613 44.530 4.850 3.390 1.00 0.00 ATOM 19942 H1 SOL 1613 44.360 4.760 2.460 1.00 0.00 ATOM 19943 H2 SOL 1613 44.640 5.790 3.520 1.00 0.00 ATOM 19944 OH2 SOL 1614 19.170 1.080 7.120 1.00 0.00 ATOM 19945 H1 SOL 1614 18.290 0.750 7.320 1.00 0.00 ATOM 19946 H2 SOL 1614 19.350 0.760 6.240 1.00 0.00 ATOM 19947 OH2 SOL 1615 33.460 34.190 71.550 1.00 0.00 ATOM 19948 H1 SOL 1615 32.550 34.460 71.510 1.00 0.00 ATOM 19949 H2 SOL 1615 33.730 34.110 70.630 1.00 0.00 ATOM 19950 OH2 SOL 1616 36.010 50.850 61.690 1.00 0.00 ATOM 19951 H1 SOL 1616 35.770 51.280 62.510 1.00 0.00 ATOM 19952 H2 SOL 1616 36.240 51.570 61.100 1.00 0.00 ATOM 19953 OH2 SOL 1617 46.330 45.080 5.660 1.00 0.00 ATOM 19954 H1 SOL 1617 46.040 44.230 5.320 1.00 0.00 ATOM 19955 H2 SOL 1617 46.990 45.380 5.020 1.00 0.00 ATOM 19956 OH2 SOL 1618 10.870 56.020 70.410 1.00 0.00 ATOM 19957 H1 SOL 1618 10.340 56.050 71.210 1.00 0.00 ATOM 19958 H2 SOL 1618 10.520 55.280 69.920 1.00 0.00 ATOM 19959 OH2 SOL 1619 35.770 9.270 66.610 1.00 0.00 ATOM 19960 H1 SOL 1619 35.890 8.440 66.150 1.00 0.00 ATOM 19961 H2 SOL 1619 35.640 9.020 67.520 1.00 0.00 ATOM 19962 OH2 SOL 1620 44.140 2.780 59.770 1.00 0.00 ATOM 19963 H1 SOL 1620 43.710 1.930 59.630 1.00 0.00 ATOM 19964 H2 SOL 1620 43.510 3.290 60.270 1.00 0.00 ATOM 19965 OH2 SOL 1621 29.130 18.360 17.580 1.00 0.00 ATOM 19966 H1 SOL 1621 28.640 18.620 18.360 1.00 0.00 ATOM 19967 H2 SOL 1621 29.920 18.900 17.600 1.00 0.00 ATOM 19968 OH2 SOL 1622 16.170 7.500 12.720 1.00 0.00 ATOM 19969 H1 SOL 1622 15.830 8.000 11.980 1.00 0.00 ATOM 19970 H2 SOL 1622 16.980 7.960 12.960 1.00 0.00 ATOM 19971 OH2 SOL 1623 50.640 42.200 7.800 1.00 0.00 ATOM 19972 H1 SOL 1623 50.370 42.420 8.690 1.00 0.00 ATOM 19973 H2 SOL 1623 51.570 42.010 7.880 1.00 0.00 ATOM 19974 OH2 SOL 1624 19.210 20.630 74.730 1.00 0.00 ATOM 19975 H1 SOL 1624 18.390 20.170 74.920 1.00 0.00 ATOM 19976 H2 SOL 1624 19.030 21.530 74.990 1.00 0.00 ATOM 19977 OH2 SOL 1625 45.220 46.970 2.380 1.00 0.00 ATOM 19978 H1 SOL 1625 45.950 46.360 2.530 1.00 0.00 ATOM 19979 H2 SOL 1625 44.530 46.680 2.980 1.00 0.00 ATOM 19980 OH2 SOL 1626 5.900 12.980 25.570 1.00 0.00 ATOM 19981 H1 SOL 1626 6.810 13.260 25.460 1.00 0.00 ATOM 19982 H2 SOL 1626 5.860 12.660 26.470 1.00 0.00 ATOM 19983 OH2 SOL 1627 1.100 42.200 8.890 1.00 0.00 ATOM 19984 H1 SOL 1627 0.460 42.910 8.870 1.00 0.00 ATOM 19985 H2 SOL 1627 1.800 42.500 8.300 1.00 0.00 ATOM 19986 OH2 SOL 1628 35.250 54.340 72.440 1.00 0.00 ATOM 19987 H1 SOL 1628 34.470 54.060 71.970 1.00 0.00 ATOM 19988 H2 SOL 1628 35.790 53.560 72.520 1.00 0.00 ATOM 19989 OH2 SOL 1629 35.510 7.830 72.550 1.00 0.00 ATOM 19990 H1 SOL 1629 35.540 7.600 73.480 1.00 0.00 ATOM 19991 H2 SOL 1629 36.340 7.500 72.190 1.00 0.00 ATOM 19992 OH2 SOL 1630 22.030 16.340 82.050 1.00 0.00 ATOM 19993 H1 SOL 1630 22.510 15.820 81.400 1.00 0.00 ATOM 19994 H2 SOL 1630 22.700 16.910 82.430 1.00 0.00 ATOM 19995 OH2 SOL 1631 10.480 10.280 69.990 1.00 0.00 ATOM 19996 H1 SOL 1631 11.260 10.540 70.480 1.00 0.00 ATOM 19997 H2 SOL 1631 9.820 10.930 70.220 1.00 0.00 ATOM 19998 OH2 SOL 1632 53.410 24.120 77.870 1.00 0.00 ATOM 19999 H1 SOL 1632 52.700 24.760 77.880 1.00 0.00 ATOM 20000 H2 SOL 1632 52.960 23.280 77.990 1.00 0.00 ATOM 20001 OH2 SOL 1633 10.400 18.890 12.630 1.00 0.00 ATOM 20002 H1 SOL 1633 9.970 18.040 12.610 1.00 0.00 ATOM 20003 H2 SOL 1633 11.110 18.820 11.990 1.00 0.00 ATOM 20004 OH2 SOL 1634 30.310 57.620 65.370 1.00 0.00 ATOM 20005 H1 SOL 1634 29.900 58.150 64.680 1.00 0.00 ATOM 20006 H2 SOL 1634 30.570 58.250 66.040 1.00 0.00 ATOM 20007 OH2 SOL 1635 19.450 44.630 76.270 1.00 0.00 ATOM 20008 H1 SOL 1635 19.900 44.810 75.450 1.00 0.00 ATOM 20009 H2 SOL 1635 20.120 44.710 76.950 1.00 0.00 ATOM 20010 OH2 SOL 1636 2.430 3.860 71.770 1.00 0.00 ATOM 20011 H1 SOL 1636 3.240 3.420 71.500 1.00 0.00 ATOM 20012 H2 SOL 1636 2.010 3.240 72.370 1.00 0.00 ATOM 20013 OH2 SOL 1637 53.280 29.660 11.460 1.00 0.00 ATOM 20014 H1 SOL 1637 53.320 28.720 11.280 1.00 0.00 ATOM 20015 H2 SOL 1637 53.040 30.060 10.620 1.00 0.00 ATOM 20016 OH2 SOL 1638 14.210 49.730 69.970 1.00 0.00 ATOM 20017 H1 SOL 1638 13.870 50.280 70.680 1.00 0.00 ATOM 20018 H2 SOL 1638 14.950 49.260 70.360 1.00 0.00 ATOM 20019 OH2 SOL 1639 48.290 42.950 69.160 1.00 0.00 ATOM 20020 H1 SOL 1639 47.750 43.740 69.170 1.00 0.00 ATOM 20021 H2 SOL 1639 49.040 43.170 68.610 1.00 0.00 ATOM 20022 OH2 SOL 1640 32.960 14.960 82.930 1.00 0.00 ATOM 20023 H1 SOL 1640 32.630 15.250 82.080 1.00 0.00 ATOM 20024 H2 SOL 1640 33.480 14.180 82.740 1.00 0.00 ATOM 20025 OH2 SOL 1641 2.850 0.730 13.530 1.00 0.00 ATOM 20026 H1 SOL 1641 2.110 1.120 14.000 1.00 0.00 ATOM 20027 H2 SOL 1641 2.970 1.300 12.770 1.00 0.00 ATOM 20028 OH2 SOL 1642 17.270 42.210 0.850 1.00 0.00 ATOM 20029 H1 SOL 1642 16.910 41.530 1.420 1.00 0.00 ATOM 20030 H2 SOL 1642 17.290 43.000 1.390 1.00 0.00 ATOM 20031 OH2 SOL 1643 4.310 32.090 12.990 1.00 0.00 ATOM 20032 H1 SOL 1643 5.190 31.720 12.960 1.00 0.00 ATOM 20033 H2 SOL 1643 4.040 31.980 13.900 1.00 0.00 ATOM 20034 OH2 SOL 1644 4.370 15.530 68.380 1.00 0.00 ATOM 20035 H1 SOL 1644 4.540 14.600 68.220 1.00 0.00 ATOM 20036 H2 SOL 1644 5.230 15.940 68.410 1.00 0.00 ATOM 20037 OH2 SOL 1645 34.570 50.740 84.400 1.00 0.00 ATOM 20038 H1 SOL 1645 35.090 50.700 85.200 1.00 0.00 ATOM 20039 H2 SOL 1645 34.810 51.570 84.000 1.00 0.00 ATOM 20040 OH2 SOL 1646 49.880 10.010 84.370 1.00 0.00 ATOM 20041 H1 SOL 1646 49.890 10.970 84.390 1.00 0.00 ATOM 20042 H2 SOL 1646 50.780 9.750 84.540 1.00 0.00 ATOM 20043 OH2 SOL 1647 21.030 1.620 71.240 1.00 0.00 ATOM 20044 H1 SOL 1647 20.970 1.970 70.350 1.00 0.00 ATOM 20045 H2 SOL 1647 20.200 1.880 71.650 1.00 0.00 ATOM 20046 OH2 SOL 1648 56.170 38.720 16.950 1.00 0.00 ATOM 20047 H1 SOL 1648 56.530 37.870 17.170 1.00 0.00 ATOM 20048 H2 SOL 1648 55.570 38.920 17.670 1.00 0.00 ATOM 20049 OH2 SOL 1649 8.030 50.650 82.460 1.00 0.00 ATOM 20050 H1 SOL 1649 7.640 50.900 83.300 1.00 0.00 ATOM 20051 H2 SOL 1649 7.530 49.890 82.180 1.00 0.00 ATOM 20052 OH2 SOL 1650 37.750 13.800 81.060 1.00 0.00 ATOM 20053 H1 SOL 1650 36.810 13.850 81.190 1.00 0.00 ATOM 20054 H2 SOL 1650 38.110 13.680 81.940 1.00 0.00 ATOM 20055 OH2 SOL 1651 19.430 26.880 10.780 1.00 0.00 ATOM 20056 H1 SOL 1651 20.060 26.750 11.490 1.00 0.00 ATOM 20057 H2 SOL 1651 18.970 26.050 10.710 1.00 0.00 ATOM 20058 OH2 SOL 1652 33.700 26.720 74.770 1.00 0.00 ATOM 20059 H1 SOL 1652 33.640 25.770 74.870 1.00 0.00 ATOM 20060 H2 SOL 1652 33.480 27.070 75.640 1.00 0.00 ATOM 20061 OH2 SOL 1653 15.940 28.740 12.890 1.00 0.00 ATOM 20062 H1 SOL 1653 15.060 29.110 12.810 1.00 0.00 ATOM 20063 H2 SOL 1653 16.510 29.500 12.970 1.00 0.00 ATOM 20064 OH2 SOL 1654 38.230 25.010 65.520 1.00 0.00 ATOM 20065 H1 SOL 1654 37.650 24.320 65.210 1.00 0.00 ATOM 20066 H2 SOL 1654 39.020 24.550 65.820 1.00 0.00 ATOM 20067 OH2 SOL 1655 54.070 10.610 79.250 1.00 0.00 ATOM 20068 H1 SOL 1655 54.000 9.750 78.830 1.00 0.00 ATOM 20069 H2 SOL 1655 54.780 11.050 78.780 1.00 0.00 ATOM 20070 OH2 SOL 1656 36.300 0.590 5.710 1.00 0.00 ATOM 20071 H1 SOL 1656 36.410 -0.160 6.300 1.00 0.00 ATOM 20072 H2 SOL 1656 35.980 0.210 4.900 1.00 0.00 ATOM 20073 OH2 SOL 1657 34.360 15.110 6.880 1.00 0.00 ATOM 20074 H1 SOL 1657 34.450 15.890 7.420 1.00 0.00 ATOM 20075 H2 SOL 1657 34.090 15.450 6.020 1.00 0.00 ATOM 20076 OH2 SOL 1658 1.870 36.630 78.650 1.00 0.00 ATOM 20077 H1 SOL 1658 2.750 37.020 78.640 1.00 0.00 ATOM 20078 H2 SOL 1658 1.290 37.350 78.880 1.00 0.00 ATOM 20079 OH2 SOL 1659 1.670 26.030 80.330 1.00 0.00 ATOM 20080 H1 SOL 1659 1.620 26.820 79.800 1.00 0.00 ATOM 20081 H2 SOL 1659 2.600 25.810 80.350 1.00 0.00 ATOM 20082 OH2 SOL 1660 17.200 56.460 76.880 1.00 0.00 ATOM 20083 H1 SOL 1660 16.510 56.840 76.320 1.00 0.00 ATOM 20084 H2 SOL 1660 17.730 55.930 76.280 1.00 0.00 ATOM 20085 OH2 SOL 1661 4.790 37.640 8.970 1.00 0.00 ATOM 20086 H1 SOL 1661 5.320 37.790 8.180 1.00 0.00 ATOM 20087 H2 SOL 1661 4.020 38.190 8.860 1.00 0.00 ATOM 20088 OH2 SOL 1662 8.460 55.340 7.180 1.00 0.00 ATOM 20089 H1 SOL 1662 8.460 55.290 6.230 1.00 0.00 ATOM 20090 H2 SOL 1662 8.950 56.130 7.380 1.00 0.00 ATOM 20091 OH2 SOL 1663 7.030 7.760 66.900 1.00 0.00 ATOM 20092 H1 SOL 1663 7.280 8.270 67.670 1.00 0.00 ATOM 20093 H2 SOL 1663 7.580 8.110 66.200 1.00 0.00 ATOM 20094 OH2 SOL 1664 18.560 14.260 4.430 1.00 0.00 ATOM 20095 H1 SOL 1664 19.180 14.710 3.860 1.00 0.00 ATOM 20096 H2 SOL 1664 17.720 14.310 3.970 1.00 0.00 ATOM 20097 OH2 SOL 1665 33.270 6.410 68.400 1.00 0.00 ATOM 20098 H1 SOL 1665 34.020 5.820 68.340 1.00 0.00 ATOM 20099 H2 SOL 1665 33.640 7.240 68.680 1.00 0.00 ATOM 20100 OH2 SOL 1666 44.790 60.090 67.890 1.00 0.00 ATOM 20101 H1 SOL 1666 44.190 59.850 68.590 1.00 0.00 ATOM 20102 H2 SOL 1666 44.810 61.050 67.910 1.00 0.00 ATOM 20103 OH2 SOL 1667 9.870 57.700 6.240 1.00 0.00 ATOM 20104 H1 SOL 1667 9.850 57.760 5.280 1.00 0.00 ATOM 20105 H2 SOL 1667 10.600 58.250 6.500 1.00 0.00 ATOM 20106 OH2 SOL 1668 44.380 30.130 5.320 1.00 0.00 ATOM 20107 H1 SOL 1668 45.290 29.820 5.280 1.00 0.00 ATOM 20108 H2 SOL 1668 44.330 30.810 4.650 1.00 0.00 ATOM 20109 OH2 SOL 1669 23.880 54.020 7.730 1.00 0.00 ATOM 20110 H1 SOL 1669 23.280 54.640 7.330 1.00 0.00 ATOM 20111 H2 SOL 1669 24.510 54.560 8.200 1.00 0.00 ATOM 20112 OH2 SOL 1670 29.980 12.270 6.070 1.00 0.00 ATOM 20113 H1 SOL 1670 30.110 11.350 6.290 1.00 0.00 ATOM 20114 H2 SOL 1670 29.090 12.460 6.370 1.00 0.00 ATOM 20115 OH2 SOL 1671 16.660 8.980 26.890 1.00 0.00 ATOM 20116 H1 SOL 1671 17.160 9.110 26.080 1.00 0.00 ATOM 20117 H2 SOL 1671 15.880 9.520 26.790 1.00 0.00 ATOM 20118 OH2 SOL 1672 56.440 16.130 66.160 1.00 0.00 ATOM 20119 H1 SOL 1672 55.600 16.590 66.270 1.00 0.00 ATOM 20120 H2 SOL 1672 56.680 15.840 67.040 1.00 0.00 ATOM 20121 OH2 SOL 1673 54.920 53.480 3.260 1.00 0.00 ATOM 20122 H1 SOL 1673 54.250 53.890 3.820 1.00 0.00 ATOM 20123 H2 SOL 1673 54.570 53.580 2.370 1.00 0.00 ATOM 20124 OH2 SOL 1674 54.790 35.400 9.160 1.00 0.00 ATOM 20125 H1 SOL 1674 54.650 34.850 9.930 1.00 0.00 ATOM 20126 H2 SOL 1674 55.570 35.030 8.740 1.00 0.00 ATOM 20127 OH2 SOL 1675 55.940 42.300 69.300 1.00 0.00 ATOM 20128 H1 SOL 1675 56.430 43.020 69.700 1.00 0.00 ATOM 20129 H2 SOL 1675 55.630 41.790 70.040 1.00 0.00 ATOM 20130 OH2 SOL 1676 36.820 43.720 7.550 1.00 0.00 ATOM 20131 H1 SOL 1676 36.960 43.490 8.470 1.00 0.00 ATOM 20132 H2 SOL 1676 35.960 44.140 7.540 1.00 0.00 ATOM 20133 OH2 SOL 1677 51.790 45.420 6.730 1.00 0.00 ATOM 20134 H1 SOL 1677 52.170 44.570 6.520 1.00 0.00 ATOM 20135 H2 SOL 1677 52.530 46.030 6.680 1.00 0.00 ATOM 20136 OH2 SOL 1678 4.840 9.420 13.960 1.00 0.00 ATOM 20137 H1 SOL 1678 5.220 8.700 13.480 1.00 0.00 ATOM 20138 H2 SOL 1678 4.100 9.030 14.430 1.00 0.00 ATOM 20139 OH2 SOL 1679 26.960 60.490 73.880 1.00 0.00 ATOM 20140 H1 SOL 1679 27.280 61.330 73.550 1.00 0.00 ATOM 20141 H2 SOL 1679 27.590 60.250 74.560 1.00 0.00 ATOM 20142 OH2 SOL 1680 31.020 60.480 71.870 1.00 0.00 ATOM 20143 H1 SOL 1680 30.830 59.610 71.530 1.00 0.00 ATOM 20144 H2 SOL 1680 30.890 61.060 71.120 1.00 0.00 ATOM 20145 OH2 SOL 1681 35.720 12.870 71.660 1.00 0.00 ATOM 20146 H1 SOL 1681 36.140 12.670 72.490 1.00 0.00 ATOM 20147 H2 SOL 1681 35.200 13.660 71.840 1.00 0.00 ATOM 20148 OH2 SOL 1682 19.000 26.000 4.040 1.00 0.00 ATOM 20149 H1 SOL 1682 18.780 25.610 4.890 1.00 0.00 ATOM 20150 H2 SOL 1682 19.260 25.260 3.500 1.00 0.00 ATOM 20151 OH2 SOL 1683 42.220 25.170 8.700 1.00 0.00 ATOM 20152 H1 SOL 1683 42.290 26.060 8.340 1.00 0.00 ATOM 20153 H2 SOL 1683 41.590 25.260 9.410 1.00 0.00 ATOM 20154 OH2 SOL 1684 31.530 18.060 82.970 1.00 0.00 ATOM 20155 H1 SOL 1684 31.450 17.360 83.610 1.00 0.00 ATOM 20156 H2 SOL 1684 30.940 18.750 83.290 1.00 0.00 ATOM 20157 OH2 SOL 1685 30.550 45.700 81.570 1.00 0.00 ATOM 20158 H1 SOL 1685 29.980 45.950 80.840 1.00 0.00 ATOM 20159 H2 SOL 1685 30.120 46.060 82.350 1.00 0.00 ATOM 20160 OH2 SOL 1686 11.450 3.940 3.520 1.00 0.00 ATOM 20161 H1 SOL 1686 11.090 3.640 4.360 1.00 0.00 ATOM 20162 H2 SOL 1686 10.820 3.630 2.870 1.00 0.00 ATOM 20163 OH2 SOL 1687 6.840 27.200 67.760 1.00 0.00 ATOM 20164 H1 SOL 1687 6.690 26.700 66.960 1.00 0.00 ATOM 20165 H2 SOL 1687 5.980 27.280 68.170 1.00 0.00 ATOM 20166 OH2 SOL 1688 41.910 13.400 25.420 1.00 0.00 ATOM 20167 H1 SOL 1688 42.170 14.160 25.940 1.00 0.00 ATOM 20168 H2 SOL 1688 42.120 12.650 25.970 1.00 0.00 ATOM 20169 OH2 SOL 1689 12.460 5.570 75.690 1.00 0.00 ATOM 20170 H1 SOL 1689 12.320 6.260 75.050 1.00 0.00 ATOM 20171 H2 SOL 1689 11.900 5.820 76.430 1.00 0.00 ATOM 20172 OH2 SOL 1690 48.100 49.890 83.010 1.00 0.00 ATOM 20173 H1 SOL 1690 48.030 50.790 82.700 1.00 0.00 ATOM 20174 H2 SOL 1690 47.960 49.950 83.960 1.00 0.00 ATOM 20175 OH2 SOL 1691 56.490 46.900 78.430 1.00 0.00 ATOM 20176 H1 SOL 1691 57.040 47.160 79.170 1.00 0.00 ATOM 20177 H2 SOL 1691 55.780 47.550 78.440 1.00 0.00 ATOM 20178 OH2 SOL 1692 18.340 25.520 6.890 1.00 0.00 ATOM 20179 H1 SOL 1692 18.480 26.320 7.410 1.00 0.00 ATOM 20180 H2 SOL 1692 18.300 24.820 7.530 1.00 0.00 ATOM 20181 OH2 SOL 1693 2.220 16.660 82.200 1.00 0.00 ATOM 20182 H1 SOL 1693 1.380 16.410 81.820 1.00 0.00 ATOM 20183 H2 SOL 1693 2.570 15.840 82.560 1.00 0.00 ATOM 20184 OH2 SOL 1694 33.340 45.140 81.670 1.00 0.00 ATOM 20185 H1 SOL 1694 33.920 44.550 81.180 1.00 0.00 ATOM 20186 H2 SOL 1694 32.480 45.020 81.270 1.00 0.00 ATOM 20187 OH2 SOL 1695 0.170 48.060 65.080 1.00 0.00 ATOM 20188 H1 SOL 1695 -0.100 47.280 64.600 1.00 0.00 ATOM 20189 H2 SOL 1695 0.180 48.760 64.430 1.00 0.00 ATOM 20190 OH2 SOL 1696 51.890 2.180 72.960 1.00 0.00 ATOM 20191 H1 SOL 1696 51.690 3.110 72.910 1.00 0.00 ATOM 20192 H2 SOL 1696 51.520 1.810 72.160 1.00 0.00 ATOM 20193 OH2 SOL 1697 44.390 58.070 78.690 1.00 0.00 ATOM 20194 H1 SOL 1697 44.690 57.740 79.530 1.00 0.00 ATOM 20195 H2 SOL 1697 43.600 57.570 78.500 1.00 0.00 ATOM 20196 OH2 SOL 1698 47.100 14.130 69.310 1.00 0.00 ATOM 20197 H1 SOL 1698 46.660 14.830 68.820 1.00 0.00 ATOM 20198 H2 SOL 1698 47.150 13.410 68.680 1.00 0.00 ATOM 20199 OH2 SOL 1699 14.660 27.180 68.420 1.00 0.00 ATOM 20200 H1 SOL 1699 13.850 27.570 68.740 1.00 0.00 ATOM 20201 H2 SOL 1699 14.640 26.280 68.730 1.00 0.00 ATOM 20202 OH2 SOL 1700 44.560 2.060 78.450 1.00 0.00 ATOM 20203 H1 SOL 1700 44.620 2.590 77.650 1.00 0.00 ATOM 20204 H2 SOL 1700 44.850 1.190 78.180 1.00 0.00 ATOM 20205 OH2 SOL 1701 51.500 15.540 14.960 1.00 0.00 ATOM 20206 H1 SOL 1701 51.890 14.730 14.640 1.00 0.00 ATOM 20207 H2 SOL 1701 52.130 15.880 15.590 1.00 0.00 ATOM 20208 OH2 SOL 1702 55.310 43.030 82.990 1.00 0.00 ATOM 20209 H1 SOL 1702 56.210 42.740 83.120 1.00 0.00 ATOM 20210 H2 SOL 1702 54.780 42.260 83.200 1.00 0.00 ATOM 20211 OH2 SOL 1703 46.170 60.520 78.060 1.00 0.00 ATOM 20212 H1 SOL 1703 45.790 59.650 78.000 1.00 0.00 ATOM 20213 H2 SOL 1703 47.050 60.370 78.420 1.00 0.00 ATOM 20214 OH2 SOL 1704 41.960 1.050 78.500 1.00 0.00 ATOM 20215 H1 SOL 1704 42.800 1.410 78.800 1.00 0.00 ATOM 20216 H2 SOL 1704 41.780 0.320 79.090 1.00 0.00 ATOM 20217 OH2 SOL 1705 0.850 17.650 22.700 1.00 0.00 ATOM 20218 H1 SOL 1705 0.750 17.870 21.770 1.00 0.00 ATOM 20219 H2 SOL 1705 0.880 16.690 22.710 1.00 0.00 ATOM 20220 OH2 SOL 1706 26.890 29.600 3.310 1.00 0.00 ATOM 20221 H1 SOL 1706 26.250 29.970 2.700 1.00 0.00 ATOM 20222 H2 SOL 1706 26.400 29.470 4.120 1.00 0.00 ATOM 20223 OH2 SOL 1707 27.310 1.980 68.400 1.00 0.00 ATOM 20224 H1 SOL 1707 27.680 2.020 67.520 1.00 0.00 ATOM 20225 H2 SOL 1707 27.990 2.350 68.970 1.00 0.00 ATOM 20226 OH2 SOL 1708 53.400 12.170 0.770 1.00 0.00 ATOM 20227 H1 SOL 1708 53.250 13.080 1.020 1.00 0.00 ATOM 20228 H2 SOL 1708 54.200 11.920 1.220 1.00 0.00 ATOM 20229 OH2 SOL 1709 47.570 36.590 79.130 1.00 0.00 ATOM 20230 H1 SOL 1709 48.400 36.200 79.380 1.00 0.00 ATOM 20231 H2 SOL 1709 47.790 37.210 78.430 1.00 0.00 ATOM 20232 OH2 SOL 1710 1.180 25.800 16.690 1.00 0.00 ATOM 20233 H1 SOL 1710 2.020 25.680 16.260 1.00 0.00 ATOM 20234 H2 SOL 1710 0.750 24.950 16.630 1.00 0.00 ATOM 20235 OH2 SOL 1711 30.580 27.840 23.700 1.00 0.00 ATOM 20236 H1 SOL 1711 30.830 27.100 23.140 1.00 0.00 ATOM 20237 H2 SOL 1711 30.800 28.610 23.190 1.00 0.00 ATOM 20238 OH2 SOL 1712 15.860 29.910 80.790 1.00 0.00 ATOM 20239 H1 SOL 1712 16.090 28.990 80.700 1.00 0.00 ATOM 20240 H2 SOL 1712 15.850 30.250 79.900 1.00 0.00 ATOM 20241 OH2 SOL 1713 36.450 51.210 81.720 1.00 0.00 ATOM 20242 H1 SOL 1713 36.510 50.750 80.880 1.00 0.00 ATOM 20243 H2 SOL 1713 35.960 50.610 82.280 1.00 0.00 ATOM 20244 OH2 SOL 1714 34.870 53.370 2.550 1.00 0.00 ATOM 20245 H1 SOL 1714 35.430 54.070 2.230 1.00 0.00 ATOM 20246 H2 SOL 1714 34.400 53.760 3.290 1.00 0.00 ATOM 20247 OH2 SOL 1715 59.770 31.460 83.310 1.00 0.00 ATOM 20248 H1 SOL 1715 59.040 30.870 83.130 1.00 0.00 ATOM 20249 H2 SOL 1715 59.960 31.870 82.470 1.00 0.00 ATOM 20250 OH2 SOL 1716 16.190 33.210 6.150 1.00 0.00 ATOM 20251 H1 SOL 1716 15.760 33.910 5.650 1.00 0.00 ATOM 20252 H2 SOL 1716 15.470 32.630 6.410 1.00 0.00 ATOM 20253 OH2 SOL 1717 53.710 30.650 2.590 1.00 0.00 ATOM 20254 H1 SOL 1717 53.250 29.900 2.960 1.00 0.00 ATOM 20255 H2 SOL 1717 54.100 30.320 1.780 1.00 0.00 ATOM 20256 OH2 SOL 1718 57.990 53.660 66.390 1.00 0.00 ATOM 20257 H1 SOL 1718 57.140 54.040 66.170 1.00 0.00 ATOM 20258 H2 SOL 1718 58.340 53.350 65.550 1.00 0.00 ATOM 20259 OH2 SOL 1719 51.580 47.650 4.660 1.00 0.00 ATOM 20260 H1 SOL 1719 51.460 47.370 3.750 1.00 0.00 ATOM 20261 H2 SOL 1719 51.620 46.840 5.150 1.00 0.00 ATOM 20262 OH2 SOL 1720 16.370 36.750 23.820 1.00 0.00 ATOM 20263 H1 SOL 1720 15.730 36.920 24.510 1.00 0.00 ATOM 20264 H2 SOL 1720 16.730 35.890 24.030 1.00 0.00 ATOM 20265 OH2 SOL 1721 57.980 32.460 65.580 1.00 0.00 ATOM 20266 H1 SOL 1721 58.200 32.110 64.720 1.00 0.00 ATOM 20267 H2 SOL 1721 57.150 32.920 65.450 1.00 0.00 ATOM 20268 OH2 SOL 1722 4.630 8.530 20.690 1.00 0.00 ATOM 20269 H1 SOL 1722 4.030 8.540 21.440 1.00 0.00 ATOM 20270 H2 SOL 1722 4.960 7.630 20.650 1.00 0.00 ATOM 20271 OH2 SOL 1723 6.360 8.810 77.620 1.00 0.00 ATOM 20272 H1 SOL 1723 7.290 9.050 77.580 1.00 0.00 ATOM 20273 H2 SOL 1723 5.970 9.210 76.840 1.00 0.00 ATOM 20274 OH2 SOL 1724 16.010 28.940 75.950 1.00 0.00 ATOM 20275 H1 SOL 1724 16.150 29.270 75.070 1.00 0.00 ATOM 20276 H2 SOL 1724 15.480 28.140 75.830 1.00 0.00 ATOM 20277 OH2 SOL 1725 49.290 48.060 19.540 1.00 0.00 ATOM 20278 H1 SOL 1725 49.850 48.120 20.310 1.00 0.00 ATOM 20279 H2 SOL 1725 48.390 48.090 19.880 1.00 0.00 ATOM 20280 OH2 SOL 1726 29.810 16.500 10.400 1.00 0.00 ATOM 20281 H1 SOL 1726 29.480 15.980 9.670 1.00 0.00 ATOM 20282 H2 SOL 1726 30.000 15.860 11.090 1.00 0.00 ATOM 20283 OH2 SOL 1727 37.460 7.770 84.200 1.00 0.00 ATOM 20284 H1 SOL 1727 37.810 8.310 83.490 1.00 0.00 ATOM 20285 H2 SOL 1727 38.150 7.780 84.870 1.00 0.00 ATOM 20286 OH2 SOL 1728 45.770 15.520 12.350 1.00 0.00 ATOM 20287 H1 SOL 1728 45.890 15.220 11.450 1.00 0.00 ATOM 20288 H2 SOL 1728 45.710 14.720 12.870 1.00 0.00 ATOM 20289 OH2 SOL 1729 29.370 55.460 68.280 1.00 0.00 ATOM 20290 H1 SOL 1729 30.240 55.570 67.890 1.00 0.00 ATOM 20291 H2 SOL 1729 29.040 54.650 67.900 1.00 0.00 ATOM 20292 OH2 SOL 1730 41.140 10.050 77.530 1.00 0.00 ATOM 20293 H1 SOL 1730 41.160 10.960 77.810 1.00 0.00 ATOM 20294 H2 SOL 1730 40.220 9.790 77.620 1.00 0.00 ATOM 20295 OH2 SOL 1731 8.510 45.670 84.250 1.00 0.00 ATOM 20296 H1 SOL 1731 9.170 45.240 83.700 1.00 0.00 ATOM 20297 H2 SOL 1731 8.960 46.430 84.620 1.00 0.00 ATOM 20298 OH2 SOL 1732 55.920 33.410 21.570 1.00 0.00 ATOM 20299 H1 SOL 1732 55.110 33.910 21.670 1.00 0.00 ATOM 20300 H2 SOL 1732 56.060 33.010 22.430 1.00 0.00 ATOM 20301 OH2 SOL 1733 52.990 24.810 9.060 1.00 0.00 ATOM 20302 H1 SOL 1733 52.170 25.080 9.490 1.00 0.00 ATOM 20303 H2 SOL 1733 53.450 24.300 9.730 1.00 0.00 ATOM 20304 OH2 SOL 1734 12.480 54.870 9.990 1.00 0.00 ATOM 20305 H1 SOL 1734 11.590 54.740 9.680 1.00 0.00 ATOM 20306 H2 SOL 1734 12.920 55.330 9.270 1.00 0.00 ATOM 20307 OH2 SOL 1735 4.520 51.280 15.550 1.00 0.00 ATOM 20308 H1 SOL 1735 5.110 50.930 16.230 1.00 0.00 ATOM 20309 H2 SOL 1735 5.030 51.960 15.120 1.00 0.00 ATOM 20310 OH2 SOL 1736 58.880 4.530 22.660 1.00 0.00 ATOM 20311 H1 SOL 1736 58.250 5.160 23.000 1.00 0.00 ATOM 20312 H2 SOL 1736 58.370 3.950 22.100 1.00 0.00 ATOM 20313 OH2 SOL 1737 52.930 53.270 64.310 1.00 0.00 ATOM 20314 H1 SOL 1737 52.810 53.660 63.440 1.00 0.00 ATOM 20315 H2 SOL 1737 52.080 52.870 64.510 1.00 0.00 ATOM 20316 OH2 SOL 1738 45.200 39.310 16.970 1.00 0.00 ATOM 20317 H1 SOL 1738 44.740 38.550 17.340 1.00 0.00 ATOM 20318 H2 SOL 1738 44.770 40.070 17.360 1.00 0.00 ATOM 20319 OH2 SOL 1739 39.660 21.700 23.810 1.00 0.00 ATOM 20320 H1 SOL 1739 39.630 20.770 23.580 1.00 0.00 ATOM 20321 H2 SOL 1739 40.270 21.740 24.550 1.00 0.00 ATOM 20322 OH2 SOL 1740 24.050 9.320 80.250 1.00 0.00 ATOM 20323 H1 SOL 1740 24.690 9.190 79.550 1.00 0.00 ATOM 20324 H2 SOL 1740 24.190 8.600 80.850 1.00 0.00 ATOM 20325 OH2 SOL 1741 41.660 5.660 64.480 1.00 0.00 ATOM 20326 H1 SOL 1741 41.900 6.270 63.780 1.00 0.00 ATOM 20327 H2 SOL 1741 42.100 4.840 64.250 1.00 0.00 ATOM 20328 OH2 SOL 1742 41.630 2.390 75.590 1.00 0.00 ATOM 20329 H1 SOL 1742 40.780 2.000 75.790 1.00 0.00 ATOM 20330 H2 SOL 1742 42.120 2.330 76.410 1.00 0.00 ATOM 20331 OH2 SOL 1743 37.640 31.090 14.680 1.00 0.00 ATOM 20332 H1 SOL 1743 38.200 31.590 15.270 1.00 0.00 ATOM 20333 H2 SOL 1743 37.720 30.180 14.970 1.00 0.00 ATOM 20334 OH2 SOL 1744 54.570 36.770 3.190 1.00 0.00 ATOM 20335 H1 SOL 1744 54.290 35.860 3.020 1.00 0.00 ATOM 20336 H2 SOL 1744 55.380 36.870 2.690 1.00 0.00 ATOM 20337 OH2 SOL 1745 5.770 11.890 11.820 1.00 0.00 ATOM 20338 H1 SOL 1745 5.640 12.720 11.360 1.00 0.00 ATOM 20339 H2 SOL 1745 5.450 11.230 11.200 1.00 0.00 ATOM 20340 OH2 SOL 1746 2.960 32.610 8.220 1.00 0.00 ATOM 20341 H1 SOL 1746 3.210 31.930 8.840 1.00 0.00 ATOM 20342 H2 SOL 1746 3.140 33.430 8.680 1.00 0.00 ATOM 20343 OH2 SOL 1747 1.410 22.400 74.600 1.00 0.00 ATOM 20344 H1 SOL 1747 1.320 22.750 75.490 1.00 0.00 ATOM 20345 H2 SOL 1747 2.320 22.110 74.550 1.00 0.00 ATOM 20346 OH2 SOL 1748 40.400 13.540 72.740 1.00 0.00 ATOM 20347 H1 SOL 1748 39.760 13.410 72.040 1.00 0.00 ATOM 20348 H2 SOL 1748 39.990 13.170 73.520 1.00 0.00 ATOM 20349 OH2 SOL 1749 1.230 44.720 76.130 1.00 0.00 ATOM 20350 H1 SOL 1749 0.550 44.130 76.450 1.00 0.00 ATOM 20351 H2 SOL 1749 0.780 45.550 75.990 1.00 0.00 ATOM 20352 OH2 SOL 1750 0.140 35.410 80.790 1.00 0.00 ATOM 20353 H1 SOL 1750 0.550 35.840 80.050 1.00 0.00 ATOM 20354 H2 SOL 1750 -0.330 36.110 81.240 1.00 0.00 ATOM 20355 OH2 SOL 1751 41.280 21.740 25.920 1.00 0.00 ATOM 20356 H1 SOL 1751 41.610 22.520 26.370 1.00 0.00 ATOM 20357 H2 SOL 1751 41.850 21.030 26.220 1.00 0.00 ATOM 20358 OH2 SOL 1752 27.790 15.110 78.620 1.00 0.00 ATOM 20359 H1 SOL 1752 28.340 15.110 79.400 1.00 0.00 ATOM 20360 H2 SOL 1752 27.640 16.040 78.430 1.00 0.00 ATOM 20361 OH2 SOL 1753 36.150 44.140 13.200 1.00 0.00 ATOM 20362 H1 SOL 1753 36.220 43.380 13.770 1.00 0.00 ATOM 20363 H2 SOL 1753 37.050 44.440 13.090 1.00 0.00 ATOM 20364 OH2 SOL 1754 45.250 24.560 15.300 1.00 0.00 ATOM 20365 H1 SOL 1754 45.740 23.760 15.130 1.00 0.00 ATOM 20366 H2 SOL 1754 44.460 24.480 14.760 1.00 0.00 ATOM 20367 OH2 SOL 1755 36.690 47.610 9.560 1.00 0.00 ATOM 20368 H1 SOL 1755 37.460 47.920 10.030 1.00 0.00 ATOM 20369 H2 SOL 1755 37.020 46.930 8.970 1.00 0.00 ATOM 20370 OH2 SOL 1756 4.220 18.400 15.290 1.00 0.00 ATOM 20371 H1 SOL 1756 3.780 18.630 14.470 1.00 0.00 ATOM 20372 H2 SOL 1756 3.830 18.980 15.950 1.00 0.00 ATOM 20373 OH2 SOL 1757 14.810 11.770 82.220 1.00 0.00 ATOM 20374 H1 SOL 1757 15.620 11.290 82.040 1.00 0.00 ATOM 20375 H2 SOL 1757 14.130 11.100 82.190 1.00 0.00 ATOM 20376 OH2 SOL 1758 29.370 47.110 73.410 1.00 0.00 ATOM 20377 H1 SOL 1758 29.240 47.090 72.460 1.00 0.00 ATOM 20378 H2 SOL 1758 28.700 46.520 73.760 1.00 0.00 ATOM 20379 OH2 SOL 1759 50.070 34.950 5.690 1.00 0.00 ATOM 20380 H1 SOL 1759 50.100 34.880 4.740 1.00 0.00 ATOM 20381 H2 SOL 1759 50.410 35.820 5.880 1.00 0.00 ATOM 20382 OH2 SOL 1760 26.760 10.720 66.180 1.00 0.00 ATOM 20383 H1 SOL 1760 27.120 9.850 66.360 1.00 0.00 ATOM 20384 H2 SOL 1760 27.360 11.330 66.600 1.00 0.00 ATOM 20385 OH2 SOL 1761 11.830 31.980 5.350 1.00 0.00 ATOM 20386 H1 SOL 1761 12.020 31.080 5.610 1.00 0.00 ATOM 20387 H2 SOL 1761 12.130 32.050 4.450 1.00 0.00 ATOM 20388 OH2 SOL 1762 53.860 40.570 82.890 1.00 0.00 ATOM 20389 H1 SOL 1762 54.080 40.040 83.660 1.00 0.00 ATOM 20390 H2 SOL 1762 53.950 39.970 82.160 1.00 0.00 ATOM 20391 OH2 SOL 1763 53.320 32.650 74.940 1.00 0.00 ATOM 20392 H1 SOL 1763 53.520 32.310 75.810 1.00 0.00 ATOM 20393 H2 SOL 1763 54.120 33.120 74.680 1.00 0.00 ATOM 20394 OH2 SOL 1764 15.320 26.020 0.650 1.00 0.00 ATOM 20395 H1 SOL 1764 15.590 26.810 0.180 1.00 0.00 ATOM 20396 H2 SOL 1764 15.400 26.250 1.580 1.00 0.00 ATOM 20397 OH2 SOL 1765 30.420 12.270 17.830 1.00 0.00 ATOM 20398 H1 SOL 1765 31.290 12.350 17.430 1.00 0.00 ATOM 20399 H2 SOL 1765 30.570 11.730 18.610 1.00 0.00 ATOM 20400 OH2 SOL 1766 54.170 44.440 18.770 1.00 0.00 ATOM 20401 H1 SOL 1766 53.320 44.060 19.000 1.00 0.00 ATOM 20402 H2 SOL 1766 54.810 43.840 19.150 1.00 0.00 ATOM 20403 OH2 SOL 1767 43.880 54.270 82.590 1.00 0.00 ATOM 20404 H1 SOL 1767 44.190 53.510 82.090 1.00 0.00 ATOM 20405 H2 SOL 1767 43.130 53.940 83.100 1.00 0.00 ATOM 20406 OH2 SOL 1768 56.620 5.960 79.950 1.00 0.00 ATOM 20407 H1 SOL 1768 56.090 6.670 80.320 1.00 0.00 ATOM 20408 H2 SOL 1768 56.910 6.290 79.100 1.00 0.00 ATOM 20409 OH2 SOL 1769 50.290 40.620 70.990 1.00 0.00 ATOM 20410 H1 SOL 1769 49.830 41.190 70.380 1.00 0.00 ATOM 20411 H2 SOL 1769 50.920 41.210 71.420 1.00 0.00 ATOM 20412 OH2 SOL 1770 16.720 45.430 2.160 1.00 0.00 ATOM 20413 H1 SOL 1770 16.460 45.930 1.380 1.00 0.00 ATOM 20414 H2 SOL 1770 17.130 46.080 2.730 1.00 0.00 ATOM 20415 OH2 SOL 1771 54.880 48.640 8.740 1.00 0.00 ATOM 20416 H1 SOL 1771 54.800 48.050 7.980 1.00 0.00 ATOM 20417 H2 SOL 1771 55.410 48.150 9.370 1.00 0.00 ATOM 20418 OH2 SOL 1772 20.240 35.900 12.760 1.00 0.00 ATOM 20419 H1 SOL 1772 20.810 35.670 12.030 1.00 0.00 ATOM 20420 H2 SOL 1772 20.630 35.450 13.510 1.00 0.00 ATOM 20421 OH2 SOL 1773 34.560 10.860 70.280 1.00 0.00 ATOM 20422 H1 SOL 1773 33.660 10.890 70.590 1.00 0.00 ATOM 20423 H2 SOL 1773 34.960 11.660 70.620 1.00 0.00 ATOM 20424 OH2 SOL 1774 10.640 49.260 2.260 1.00 0.00 ATOM 20425 H1 SOL 1774 11.270 48.700 2.710 1.00 0.00 ATOM 20426 H2 SOL 1774 9.940 49.400 2.900 1.00 0.00 ATOM 20427 OH2 SOL 1775 28.930 53.400 10.950 1.00 0.00 ATOM 20428 H1 SOL 1775 28.050 53.790 10.990 1.00 0.00 ATOM 20429 H2 SOL 1775 28.780 52.460 11.080 1.00 0.00 ATOM 20430 OH2 SOL 1776 1.010 58.970 15.750 1.00 0.00 ATOM 20431 H1 SOL 1776 0.790 58.160 16.210 1.00 0.00 ATOM 20432 H2 SOL 1776 1.790 59.300 16.200 1.00 0.00 ATOM 20433 OH2 SOL 1777 29.920 12.790 72.760 1.00 0.00 ATOM 20434 H1 SOL 1777 30.410 13.020 73.540 1.00 0.00 ATOM 20435 H2 SOL 1777 29.330 12.090 73.040 1.00 0.00 ATOM 20436 OH2 SOL 1778 55.250 51.900 82.300 1.00 0.00 ATOM 20437 H1 SOL 1778 55.090 52.820 82.460 1.00 0.00 ATOM 20438 H2 SOL 1778 55.550 51.860 81.390 1.00 0.00 ATOM 20439 OH2 SOL 1779 25.690 47.240 14.250 1.00 0.00 ATOM 20440 H1 SOL 1779 25.700 46.730 15.050 1.00 0.00 ATOM 20441 H2 SOL 1779 26.260 47.990 14.440 1.00 0.00 ATOM 20442 OH2 SOL 1780 23.050 26.460 80.010 1.00 0.00 ATOM 20443 H1 SOL 1780 23.620 25.900 80.530 1.00 0.00 ATOM 20444 H2 SOL 1780 22.870 27.220 80.570 1.00 0.00 ATOM 20445 OH2 SOL 1781 54.750 44.660 63.480 1.00 0.00 ATOM 20446 H1 SOL 1781 54.070 44.150 63.050 1.00 0.00 ATOM 20447 H2 SOL 1781 55.370 44.010 63.800 1.00 0.00 ATOM 20448 OH2 SOL 1782 35.870 19.880 80.140 1.00 0.00 ATOM 20449 H1 SOL 1782 35.060 20.260 79.790 1.00 0.00 ATOM 20450 H2 SOL 1782 35.880 18.980 79.820 1.00 0.00 ATOM 20451 OH2 SOL 1783 16.950 59.870 1.320 1.00 0.00 ATOM 20452 H1 SOL 1783 17.140 59.190 0.670 1.00 0.00 ATOM 20453 H2 SOL 1783 17.610 60.540 1.160 1.00 0.00 ATOM 20454 OH2 SOL 1784 56.130 13.780 79.240 1.00 0.00 ATOM 20455 H1 SOL 1784 56.280 12.850 79.430 1.00 0.00 ATOM 20456 H2 SOL 1784 57.000 14.130 79.060 1.00 0.00 ATOM 20457 OH2 SOL 1785 10.640 18.270 18.090 1.00 0.00 ATOM 20458 H1 SOL 1785 10.420 18.570 17.210 1.00 0.00 ATOM 20459 H2 SOL 1785 11.210 17.510 17.960 1.00 0.00 ATOM 20460 OH2 SOL 1786 22.550 7.690 10.970 1.00 0.00 ATOM 20461 H1 SOL 1786 22.170 8.520 10.690 1.00 0.00 ATOM 20462 H2 SOL 1786 21.800 7.110 11.090 1.00 0.00 ATOM 20463 OH2 SOL 1787 4.400 48.540 4.860 1.00 0.00 ATOM 20464 H1 SOL 1787 4.110 47.880 4.230 1.00 0.00 ATOM 20465 H2 SOL 1787 3.660 49.140 4.920 1.00 0.00 ATOM 20466 OH2 SOL 1788 23.170 22.700 5.060 1.00 0.00 ATOM 20467 H1 SOL 1788 22.880 21.850 5.380 1.00 0.00 ATOM 20468 H2 SOL 1788 23.660 23.080 5.790 1.00 0.00 ATOM 20469 OH2 SOL 1789 37.530 60.460 83.280 1.00 0.00 ATOM 20470 H1 SOL 1789 37.840 59.670 82.830 1.00 0.00 ATOM 20471 H2 SOL 1789 36.590 60.310 83.400 1.00 0.00 ATOM 20472 OH2 SOL 1790 28.320 26.810 66.940 1.00 0.00 ATOM 20473 H1 SOL 1790 28.170 26.170 66.240 1.00 0.00 ATOM 20474 H2 SOL 1790 28.710 26.300 67.650 1.00 0.00 ATOM 20475 OH2 SOL 1791 43.420 19.360 66.540 1.00 0.00 ATOM 20476 H1 SOL 1791 44.150 18.750 66.510 1.00 0.00 ATOM 20477 H2 SOL 1791 43.210 19.420 67.480 1.00 0.00 ATOM 20478 OH2 SOL 1792 58.370 46.990 72.800 1.00 0.00 ATOM 20479 H1 SOL 1792 57.630 46.890 72.210 1.00 0.00 ATOM 20480 H2 SOL 1792 58.900 46.200 72.660 1.00 0.00 ATOM 20481 OH2 SOL 1793 12.170 25.510 70.100 1.00 0.00 ATOM 20482 H1 SOL 1793 12.980 25.480 70.610 1.00 0.00 ATOM 20483 H2 SOL 1793 12.040 24.610 69.800 1.00 0.00 ATOM 20484 OH2 SOL 1794 3.270 60.200 78.800 1.00 0.00 ATOM 20485 H1 SOL 1794 4.150 60.480 79.070 1.00 0.00 ATOM 20486 H2 SOL 1794 2.910 59.780 79.580 1.00 0.00 ATOM 20487 OH2 SOL 1795 31.190 26.670 21.030 1.00 0.00 ATOM 20488 H1 SOL 1795 30.690 26.170 20.380 1.00 0.00 ATOM 20489 H2 SOL 1795 32.070 26.300 20.990 1.00 0.00 ATOM 20490 OH2 SOL 1796 41.070 59.690 80.770 1.00 0.00 ATOM 20491 H1 SOL 1796 40.520 59.090 81.280 1.00 0.00 ATOM 20492 H2 SOL 1796 41.870 59.770 81.280 1.00 0.00 ATOM 20493 OH2 SOL 1797 21.010 17.660 84.550 1.00 0.00 ATOM 20494 H1 SOL 1797 21.870 17.460 84.170 1.00 0.00 ATOM 20495 H2 SOL 1797 20.600 18.260 83.930 1.00 0.00 ATOM 20496 OH2 SOL 1798 8.900 56.220 81.170 1.00 0.00 ATOM 20497 H1 SOL 1798 9.070 57.110 81.490 1.00 0.00 ATOM 20498 H2 SOL 1798 8.600 56.340 80.270 1.00 0.00 ATOM 20499 OH2 SOL 1799 3.930 2.640 16.160 1.00 0.00 ATOM 20500 H1 SOL 1799 4.300 3.400 16.620 1.00 0.00 ATOM 20501 H2 SOL 1799 3.970 2.890 15.240 1.00 0.00 ATOM 20502 OH2 SOL 1800 31.400 57.930 79.940 1.00 0.00 ATOM 20503 H1 SOL 1800 30.720 57.830 80.600 1.00 0.00 ATOM 20504 H2 SOL 1800 31.040 58.570 79.320 1.00 0.00 ATOM 20505 OH2 SOL 1801 45.460 4.640 9.870 1.00 0.00 ATOM 20506 H1 SOL 1801 45.780 5.200 10.580 1.00 0.00 ATOM 20507 H2 SOL 1801 44.580 4.970 9.690 1.00 0.00 ATOM 20508 OH2 SOL 1802 26.030 24.400 2.040 1.00 0.00 ATOM 20509 H1 SOL 1802 26.840 23.950 1.810 1.00 0.00 ATOM 20510 H2 SOL 1802 26.040 25.190 1.490 1.00 0.00 ATOM 20511 OH2 SOL 1803 32.270 58.730 67.590 1.00 0.00 ATOM 20512 H1 SOL 1803 32.200 59.450 66.960 1.00 0.00 ATOM 20513 H2 SOL 1803 33.210 58.660 67.780 1.00 0.00 ATOM 20514 OH2 SOL 1804 49.400 38.270 67.460 1.00 0.00 ATOM 20515 H1 SOL 1804 49.000 37.700 66.800 1.00 0.00 ATOM 20516 H2 SOL 1804 48.820 39.030 67.490 1.00 0.00 ATOM 20517 OH2 SOL 1805 38.550 8.470 63.290 1.00 0.00 ATOM 20518 H1 SOL 1805 38.850 8.510 64.200 1.00 0.00 ATOM 20519 H2 SOL 1805 39.300 8.160 62.790 1.00 0.00 ATOM 20520 OH2 SOL 1806 46.430 5.830 18.560 1.00 0.00 ATOM 20521 H1 SOL 1806 47.090 6.200 17.980 1.00 0.00 ATOM 20522 H2 SOL 1806 46.290 4.940 18.240 1.00 0.00 ATOM 20523 OH2 SOL 1807 42.510 10.200 80.320 1.00 0.00 ATOM 20524 H1 SOL 1807 43.400 9.990 80.050 1.00 0.00 ATOM 20525 H2 SOL 1807 41.960 9.610 79.810 1.00 0.00 ATOM 20526 OH2 SOL 1808 52.620 58.150 17.430 1.00 0.00 ATOM 20527 H1 SOL 1808 52.660 58.860 18.070 1.00 0.00 ATOM 20528 H2 SOL 1808 53.180 58.450 16.710 1.00 0.00 ATOM 20529 OH2 SOL 1809 58.670 54.890 62.950 1.00 0.00 ATOM 20530 H1 SOL 1809 58.870 54.130 63.490 1.00 0.00 ATOM 20531 H2 SOL 1809 59.520 55.240 62.690 1.00 0.00 ATOM 20532 OH2 SOL 1810 18.710 33.620 21.650 1.00 0.00 ATOM 20533 H1 SOL 1810 17.990 33.700 21.020 1.00 0.00 ATOM 20534 H2 SOL 1810 19.500 33.540 21.110 1.00 0.00 ATOM 20535 OH2 SOL 1811 50.900 7.110 3.910 1.00 0.00 ATOM 20536 H1 SOL 1811 51.550 7.240 3.220 1.00 0.00 ATOM 20537 H2 SOL 1811 50.510 7.980 4.030 1.00 0.00 ATOM 20538 OH2 SOL 1812 11.110 31.130 12.030 1.00 0.00 ATOM 20539 H1 SOL 1812 10.350 30.840 11.530 1.00 0.00 ATOM 20540 H2 SOL 1812 10.780 31.280 12.910 1.00 0.00 ATOM 20541 OH2 SOL 1813 16.100 10.260 72.470 1.00 0.00 ATOM 20542 H1 SOL 1813 16.510 9.870 71.700 1.00 0.00 ATOM 20543 H2 SOL 1813 16.450 11.150 72.510 1.00 0.00 ATOM 20544 OH2 SOL 1814 2.110 10.800 20.260 1.00 0.00 ATOM 20545 H1 SOL 1814 1.480 11.190 19.660 1.00 0.00 ATOM 20546 H2 SOL 1814 1.650 10.050 20.640 1.00 0.00 ATOM 20547 OH2 SOL 1815 52.770 0.990 5.050 1.00 0.00 ATOM 20548 H1 SOL 1815 51.990 0.800 4.520 1.00 0.00 ATOM 20549 H2 SOL 1815 53.100 1.820 4.700 1.00 0.00 ATOM 20550 OH2 SOL 1816 3.730 29.040 15.850 1.00 0.00 ATOM 20551 H1 SOL 1816 3.410 29.720 16.450 1.00 0.00 ATOM 20552 H2 SOL 1816 4.400 28.580 16.360 1.00 0.00 ATOM 20553 OH2 SOL 1817 28.960 6.460 64.170 1.00 0.00 ATOM 20554 H1 SOL 1817 28.860 6.860 65.030 1.00 0.00 ATOM 20555 H2 SOL 1817 29.860 6.680 63.910 1.00 0.00 ATOM 20556 OH2 SOL 1818 52.360 20.610 74.450 1.00 0.00 ATOM 20557 H1 SOL 1818 53.130 20.120 74.140 1.00 0.00 ATOM 20558 H2 SOL 1818 52.250 20.340 75.360 1.00 0.00 ATOM 20559 OH2 SOL 1819 54.330 3.590 10.810 1.00 0.00 ATOM 20560 H1 SOL 1819 54.450 2.650 10.700 1.00 0.00 ATOM 20561 H2 SOL 1819 55.070 3.980 10.330 1.00 0.00 ATOM 20562 OH2 SOL 1820 28.380 42.140 5.000 1.00 0.00 ATOM 20563 H1 SOL 1820 28.250 41.610 4.210 1.00 0.00 ATOM 20564 H2 SOL 1820 28.150 43.030 4.730 1.00 0.00 ATOM 20565 OH2 SOL 1821 57.280 42.540 7.140 1.00 0.00 ATOM 20566 H1 SOL 1821 57.540 43.150 7.830 1.00 0.00 ATOM 20567 H2 SOL 1821 57.360 41.670 7.540 1.00 0.00 ATOM 20568 OH2 SOL 1822 34.760 30.230 81.600 1.00 0.00 ATOM 20569 H1 SOL 1822 35.390 30.640 81.010 1.00 0.00 ATOM 20570 H2 SOL 1822 34.940 30.620 82.460 1.00 0.00 ATOM 20571 OH2 SOL 1823 43.760 41.650 15.210 1.00 0.00 ATOM 20572 H1 SOL 1823 44.550 41.990 15.610 1.00 0.00 ATOM 20573 H2 SOL 1823 43.970 41.600 14.270 1.00 0.00 ATOM 20574 OH2 SOL 1824 54.460 32.160 7.880 1.00 0.00 ATOM 20575 H1 SOL 1824 54.340 32.350 6.950 1.00 0.00 ATOM 20576 H2 SOL 1824 54.790 31.260 7.900 1.00 0.00 ATOM 20577 OH2 SOL 1825 42.120 59.450 19.870 1.00 0.00 ATOM 20578 H1 SOL 1825 41.300 59.300 20.330 1.00 0.00 ATOM 20579 H2 SOL 1825 42.270 60.390 19.930 1.00 0.00 ATOM 20580 OH2 SOL 1826 23.040 28.390 81.970 1.00 0.00 ATOM 20581 H1 SOL 1826 23.800 27.960 82.360 1.00 0.00 ATOM 20582 H2 SOL 1826 23.190 29.320 82.120 1.00 0.00 ATOM 20583 OH2 SOL 1827 6.770 55.020 16.120 1.00 0.00 ATOM 20584 H1 SOL 1827 7.020 55.940 16.070 1.00 0.00 ATOM 20585 H2 SOL 1827 6.950 54.670 15.240 1.00 0.00 ATOM 20586 OH2 SOL 1828 11.070 26.540 5.140 1.00 0.00 ATOM 20587 H1 SOL 1828 11.730 27.150 4.790 1.00 0.00 ATOM 20588 H2 SOL 1828 11.580 25.800 5.470 1.00 0.00 ATOM 20589 OH2 SOL 1829 19.240 5.420 68.040 1.00 0.00 ATOM 20590 H1 SOL 1829 19.950 5.520 68.670 1.00 0.00 ATOM 20591 H2 SOL 1829 18.700 4.710 68.380 1.00 0.00 ATOM 20592 OH2 SOL 1830 58.590 2.660 9.260 1.00 0.00 ATOM 20593 H1 SOL 1830 59.550 2.590 9.240 1.00 0.00 ATOM 20594 H2 SOL 1830 58.340 2.600 8.340 1.00 0.00 ATOM 20595 OH2 SOL 1831 16.410 7.050 19.650 1.00 0.00 ATOM 20596 H1 SOL 1831 16.180 7.370 20.520 1.00 0.00 ATOM 20597 H2 SOL 1831 17.000 7.720 19.290 1.00 0.00 ATOM 20598 OH2 SOL 1832 6.610 42.140 14.960 1.00 0.00 ATOM 20599 H1 SOL 1832 7.330 41.800 14.430 1.00 0.00 ATOM 20600 H2 SOL 1832 6.640 41.620 15.770 1.00 0.00 ATOM 20601 OH2 SOL 1833 41.360 55.570 80.170 1.00 0.00 ATOM 20602 H1 SOL 1833 42.100 55.960 79.710 1.00 0.00 ATOM 20603 H2 SOL 1833 40.600 56.070 79.860 1.00 0.00 ATOM 20604 OH2 SOL 1834 34.370 28.280 78.080 1.00 0.00 ATOM 20605 H1 SOL 1834 35.090 28.910 78.000 1.00 0.00 ATOM 20606 H2 SOL 1834 33.630 28.730 77.680 1.00 0.00 ATOM 20607 OH2 SOL 1835 3.870 21.270 78.020 1.00 0.00 ATOM 20608 H1 SOL 1835 2.990 21.610 78.180 1.00 0.00 ATOM 20609 H2 SOL 1835 4.230 21.140 78.900 1.00 0.00 ATOM 20610 OH2 SOL 1836 32.480 55.010 71.560 1.00 0.00 ATOM 20611 H1 SOL 1836 32.720 55.820 72.010 1.00 0.00 ATOM 20612 H2 SOL 1836 31.580 55.170 71.270 1.00 0.00 ATOM 20613 OH2 SOL 1837 16.440 17.370 71.680 1.00 0.00 ATOM 20614 H1 SOL 1837 16.320 17.850 70.860 1.00 0.00 ATOM 20615 H2 SOL 1837 17.120 17.860 72.140 1.00 0.00 ATOM 20616 OH2 SOL 1838 59.440 40.380 15.190 1.00 0.00 ATOM 20617 H1 SOL 1838 59.740 39.570 15.600 1.00 0.00 ATOM 20618 H2 SOL 1838 58.850 40.770 15.830 1.00 0.00 ATOM 20619 OH2 SOL 1839 19.560 4.110 17.800 1.00 0.00 ATOM 20620 H1 SOL 1839 19.200 4.730 18.430 1.00 0.00 ATOM 20621 H2 SOL 1839 19.100 4.310 16.980 1.00 0.00 ATOM 20622 OH2 SOL 1840 57.520 5.630 70.550 1.00 0.00 ATOM 20623 H1 SOL 1840 57.480 5.290 69.650 1.00 0.00 ATOM 20624 H2 SOL 1840 57.770 6.550 70.450 1.00 0.00 ATOM 20625 OH2 SOL 1841 55.970 53.340 17.030 1.00 0.00 ATOM 20626 H1 SOL 1841 55.310 53.780 17.560 1.00 0.00 ATOM 20627 H2 SOL 1841 55.760 52.410 17.090 1.00 0.00 ATOM 20628 OH2 SOL 1842 16.670 13.030 8.070 1.00 0.00 ATOM 20629 H1 SOL 1842 17.560 13.320 8.280 1.00 0.00 ATOM 20630 H2 SOL 1842 16.750 12.090 7.950 1.00 0.00 ATOM 20631 OH2 SOL 1843 39.820 13.500 61.870 1.00 0.00 ATOM 20632 H1 SOL 1843 39.610 14.030 61.100 1.00 0.00 ATOM 20633 H2 SOL 1843 38.990 13.130 62.150 1.00 0.00 ATOM 20634 OH2 SOL 1844 39.320 34.230 82.450 1.00 0.00 ATOM 20635 H1 SOL 1844 39.140 33.680 83.210 1.00 0.00 ATOM 20636 H2 SOL 1844 39.280 33.630 81.700 1.00 0.00 ATOM 20637 OH2 SOL 1845 49.110 25.990 71.860 1.00 0.00 ATOM 20638 H1 SOL 1845 49.890 25.450 72.000 1.00 0.00 ATOM 20639 H2 SOL 1845 48.370 25.380 71.950 1.00 0.00 ATOM 20640 OH2 SOL 1846 54.480 40.870 11.710 1.00 0.00 ATOM 20641 H1 SOL 1846 54.270 41.790 11.550 1.00 0.00 ATOM 20642 H2 SOL 1846 55.440 40.840 11.710 1.00 0.00 ATOM 20643 OH2 SOL 1847 8.670 1.580 77.130 1.00 0.00 ATOM 20644 H1 SOL 1847 9.150 2.410 77.170 1.00 0.00 ATOM 20645 H2 SOL 1847 7.760 1.840 77.280 1.00 0.00 ATOM 20646 OH2 SOL 1848 56.900 6.040 23.630 1.00 0.00 ATOM 20647 H1 SOL 1848 56.270 6.480 24.210 1.00 0.00 ATOM 20648 H2 SOL 1848 56.680 5.120 23.690 1.00 0.00 ATOM 20649 OH2 SOL 1849 6.120 39.640 16.650 1.00 0.00 ATOM 20650 H1 SOL 1849 6.120 39.110 15.850 1.00 0.00 ATOM 20651 H2 SOL 1849 5.200 39.680 16.910 1.00 0.00 ATOM 20652 OH2 SOL 1850 34.670 6.390 6.370 1.00 0.00 ATOM 20653 H1 SOL 1850 35.350 6.810 5.830 1.00 0.00 ATOM 20654 H2 SOL 1850 35.070 6.320 7.240 1.00 0.00 ATOM 20655 OH2 SOL 1851 33.660 54.260 66.560 1.00 0.00 ATOM 20656 H1 SOL 1851 34.470 54.070 67.040 1.00 0.00 ATOM 20657 H2 SOL 1851 33.950 54.340 65.650 1.00 0.00 ATOM 20658 OH2 SOL 1852 8.360 33.370 82.220 1.00 0.00 ATOM 20659 H1 SOL 1852 8.010 33.560 83.100 1.00 0.00 ATOM 20660 H2 SOL 1852 8.700 34.210 81.920 1.00 0.00 ATOM 20661 OH2 SOL 1853 41.670 29.580 5.350 1.00 0.00 ATOM 20662 H1 SOL 1853 41.830 28.810 5.890 1.00 0.00 ATOM 20663 H2 SOL 1853 42.470 30.100 5.430 1.00 0.00 ATOM 20664 OH2 SOL 1854 21.900 5.850 14.860 1.00 0.00 ATOM 20665 H1 SOL 1854 22.180 4.950 14.720 1.00 0.00 ATOM 20666 H2 SOL 1854 22.720 6.340 14.970 1.00 0.00 ATOM 20667 OH2 SOL 1855 52.050 56.700 78.680 1.00 0.00 ATOM 20668 H1 SOL 1855 52.500 56.860 77.850 1.00 0.00 ATOM 20669 H2 SOL 1855 51.480 55.950 78.520 1.00 0.00 ATOM 20670 OH2 SOL 1856 9.790 49.770 72.920 1.00 0.00 ATOM 20671 H1 SOL 1856 9.640 50.600 73.370 1.00 0.00 ATOM 20672 H2 SOL 1856 9.140 49.170 73.290 1.00 0.00 ATOM 20673 OH2 SOL 1857 16.550 18.280 4.250 1.00 0.00 ATOM 20674 H1 SOL 1857 15.750 18.260 3.710 1.00 0.00 ATOM 20675 H2 SOL 1857 16.450 19.070 4.780 1.00 0.00 ATOM 20676 OH2 SOL 1858 14.980 60.600 79.570 1.00 0.00 ATOM 20677 H1 SOL 1858 14.660 61.090 80.320 1.00 0.00 ATOM 20678 H2 SOL 1858 15.270 59.760 79.930 1.00 0.00 ATOM 20679 OH2 SOL 1859 43.050 22.280 65.950 1.00 0.00 ATOM 20680 H1 SOL 1859 43.890 22.550 65.570 1.00 0.00 ATOM 20681 H2 SOL 1859 43.150 21.330 66.060 1.00 0.00 ATOM 20682 OH2 SOL 1860 45.550 27.710 75.920 1.00 0.00 ATOM 20683 H1 SOL 1860 45.410 28.660 75.920 1.00 0.00 ATOM 20684 H2 SOL 1860 45.510 27.460 75.000 1.00 0.00 ATOM 20685 OH2 SOL 1861 40.420 47.650 10.930 1.00 0.00 ATOM 20686 H1 SOL 1861 40.870 46.830 10.720 1.00 0.00 ATOM 20687 H2 SOL 1861 40.870 48.310 10.410 1.00 0.00 ATOM 20688 OH2 SOL 1862 32.010 6.010 77.200 1.00 0.00 ATOM 20689 H1 SOL 1862 32.870 5.600 77.280 1.00 0.00 ATOM 20690 H2 SOL 1862 31.420 5.460 77.710 1.00 0.00 ATOM 20691 OH2 SOL 1863 18.650 56.980 19.600 1.00 0.00 ATOM 20692 H1 SOL 1863 18.920 56.440 20.350 1.00 0.00 ATOM 20693 H2 SOL 1863 18.180 57.720 20.000 1.00 0.00 ATOM 20694 OH2 SOL 1864 9.280 60.760 68.450 1.00 0.00 ATOM 20695 H1 SOL 1864 9.480 59.830 68.560 1.00 0.00 ATOM 20696 H2 SOL 1864 8.330 60.810 68.460 1.00 0.00 ATOM 20697 OH2 SOL 1865 13.840 17.620 15.640 1.00 0.00 ATOM 20698 H1 SOL 1865 13.280 17.250 14.950 1.00 0.00 ATOM 20699 H2 SOL 1865 13.430 17.350 16.460 1.00 0.00 ATOM 20700 OH2 SOL 1866 54.380 59.650 76.020 1.00 0.00 ATOM 20701 H1 SOL 1866 54.320 60.440 75.480 1.00 0.00 ATOM 20702 H2 SOL 1866 53.760 59.040 75.610 1.00 0.00 ATOM 20703 OH2 SOL 1867 48.160 17.820 83.040 1.00 0.00 ATOM 20704 H1 SOL 1867 48.740 18.270 82.430 1.00 0.00 ATOM 20705 H2 SOL 1867 47.280 18.030 82.730 1.00 0.00 ATOM 20706 OH2 SOL 1868 45.100 48.590 10.260 1.00 0.00 ATOM 20707 H1 SOL 1868 45.240 48.150 9.420 1.00 0.00 ATOM 20708 H2 SOL 1868 44.260 49.030 10.170 1.00 0.00 ATOM 20709 OH2 SOL 1869 13.220 19.690 63.870 1.00 0.00 ATOM 20710 H1 SOL 1869 13.860 20.390 63.990 1.00 0.00 ATOM 20711 H2 SOL 1869 13.710 18.880 64.000 1.00 0.00 ATOM 20712 OH2 SOL 1870 49.100 19.290 72.790 1.00 0.00 ATOM 20713 H1 SOL 1870 48.200 19.250 72.470 1.00 0.00 ATOM 20714 H2 SOL 1870 49.470 20.070 72.360 1.00 0.00 ATOM 20715 OH2 SOL 1871 33.040 21.130 11.610 1.00 0.00 ATOM 20716 H1 SOL 1871 33.740 21.220 12.260 1.00 0.00 ATOM 20717 H2 SOL 1871 33.080 21.930 11.090 1.00 0.00 ATOM 20718 OH2 SOL 1872 12.540 50.130 3.850 1.00 0.00 ATOM 20719 H1 SOL 1872 12.380 49.190 3.920 1.00 0.00 ATOM 20720 H2 SOL 1872 11.860 50.450 3.250 1.00 0.00 ATOM 20721 OH2 SOL 1873 17.350 47.640 7.270 1.00 0.00 ATOM 20722 H1 SOL 1873 16.840 47.400 6.490 1.00 0.00 ATOM 20723 H2 SOL 1873 17.850 48.410 7.000 1.00 0.00 ATOM 20724 OH2 SOL 1874 45.040 33.910 83.160 1.00 0.00 ATOM 20725 H1 SOL 1874 45.180 33.560 82.280 1.00 0.00 ATOM 20726 H2 SOL 1874 45.200 34.850 83.070 1.00 0.00 ATOM 20727 OH2 SOL 1875 54.560 1.050 82.100 1.00 0.00 ATOM 20728 H1 SOL 1875 54.380 1.930 82.450 1.00 0.00 ATOM 20729 H2 SOL 1875 55.010 0.610 82.810 1.00 0.00 ATOM 20730 OH2 SOL 1876 19.660 54.320 82.270 1.00 0.00 ATOM 20731 H1 SOL 1876 18.740 54.530 82.460 1.00 0.00 ATOM 20732 H2 SOL 1876 20.050 54.150 83.130 1.00 0.00 ATOM 20733 OH2 SOL 1877 12.100 53.710 76.500 1.00 0.00 ATOM 20734 H1 SOL 1877 11.640 54.530 76.350 1.00 0.00 ATOM 20735 H2 SOL 1877 12.130 53.620 77.450 1.00 0.00 ATOM 20736 OH2 SOL 1878 35.100 50.800 13.280 1.00 0.00 ATOM 20737 H1 SOL 1878 35.770 51.490 13.330 1.00 0.00 ATOM 20738 H2 SOL 1878 35.230 50.280 14.070 1.00 0.00 ATOM 20739 OH2 SOL 1879 33.080 32.400 75.530 1.00 0.00 ATOM 20740 H1 SOL 1879 33.820 32.870 75.160 1.00 0.00 ATOM 20741 H2 SOL 1879 32.750 32.980 76.220 1.00 0.00 ATOM 20742 OH2 SOL 1880 53.090 37.610 71.980 1.00 0.00 ATOM 20743 H1 SOL 1880 53.580 38.030 72.690 1.00 0.00 ATOM 20744 H2 SOL 1880 52.720 38.340 71.480 1.00 0.00 ATOM 20745 OH2 SOL 1881 38.030 9.750 73.000 1.00 0.00 ATOM 20746 H1 SOL 1881 37.770 10.470 73.580 1.00 0.00 ATOM 20747 H2 SOL 1881 38.920 9.960 72.740 1.00 0.00 ATOM 20748 OH2 SOL 1882 41.860 1.440 61.920 1.00 0.00 ATOM 20749 H1 SOL 1882 41.050 1.180 62.360 1.00 0.00 ATOM 20750 H2 SOL 1882 41.810 1.020 61.060 1.00 0.00 ATOM 20751 OH2 SOL 1883 4.660 60.170 58.650 1.00 0.00 ATOM 20752 H1 SOL 1883 4.240 59.310 58.720 1.00 0.00 ATOM 20753 H2 SOL 1883 5.510 60.050 59.070 1.00 0.00 ATOM 20754 OH2 SOL 1884 43.440 26.910 69.280 1.00 0.00 ATOM 20755 H1 SOL 1884 44.350 27.040 69.520 1.00 0.00 ATOM 20756 H2 SOL 1884 42.950 27.190 70.050 1.00 0.00 ATOM 20757 OH2 SOL 1885 16.690 16.280 81.240 1.00 0.00 ATOM 20758 H1 SOL 1885 17.200 15.470 81.280 1.00 0.00 ATOM 20759 H2 SOL 1885 16.340 16.280 80.340 1.00 0.00 ATOM 20760 OH2 SOL 1886 58.060 8.780 77.840 1.00 0.00 ATOM 20761 H1 SOL 1886 58.010 8.840 78.800 1.00 0.00 ATOM 20762 H2 SOL 1886 58.860 9.240 77.610 1.00 0.00 ATOM 20763 OH2 SOL 1887 59.760 57.530 80.720 1.00 0.00 ATOM 20764 H1 SOL 1887 59.500 56.620 80.540 1.00 0.00 ATOM 20765 H2 SOL 1887 59.740 57.950 79.860 1.00 0.00 ATOM 20766 OH2 SOL 1888 4.990 25.020 12.970 1.00 0.00 ATOM 20767 H1 SOL 1888 5.850 24.600 13.020 1.00 0.00 ATOM 20768 H2 SOL 1888 5.170 25.880 12.570 1.00 0.00 ATOM 20769 OH2 SOL 1889 54.130 10.430 10.890 1.00 0.00 ATOM 20770 H1 SOL 1889 53.830 11.300 10.650 1.00 0.00 ATOM 20771 H2 SOL 1889 54.200 9.960 10.050 1.00 0.00 ATOM 20772 OH2 SOL 1890 23.860 13.490 64.100 1.00 0.00 ATOM 20773 H1 SOL 1890 23.050 13.950 64.300 1.00 0.00 ATOM 20774 H2 SOL 1890 24.040 13.670 63.180 1.00 0.00 ATOM 20775 OH2 SOL 1891 42.590 35.550 3.030 1.00 0.00 ATOM 20776 H1 SOL 1891 42.510 35.510 3.980 1.00 0.00 ATOM 20777 H2 SOL 1891 43.520 35.740 2.880 1.00 0.00 ATOM 20778 OH2 SOL 1892 30.250 29.770 68.620 1.00 0.00 ATOM 20779 H1 SOL 1892 29.420 29.830 69.110 1.00 0.00 ATOM 20780 H2 SOL 1892 30.720 30.570 68.860 1.00 0.00 ATOM 20781 OH2 SOL 1893 26.540 1.820 65.340 1.00 0.00 ATOM 20782 H1 SOL 1893 26.090 0.990 65.170 1.00 0.00 ATOM 20783 H2 SOL 1893 27.000 2.020 64.530 1.00 0.00 ATOM 20784 OH2 SOL 1894 4.610 3.680 74.060 1.00 0.00 ATOM 20785 H1 SOL 1894 4.510 3.590 73.120 1.00 0.00 ATOM 20786 H2 SOL 1894 5.360 3.120 74.280 1.00 0.00 ATOM 20787 OH2 SOL 1895 52.260 43.310 4.820 1.00 0.00 ATOM 20788 H1 SOL 1895 53.010 43.100 5.380 1.00 0.00 ATOM 20789 H2 SOL 1895 52.660 43.630 4.010 1.00 0.00 ATOM 20790 OH2 SOL 1896 34.460 10.120 7.620 1.00 0.00 ATOM 20791 H1 SOL 1896 34.060 9.330 8.000 1.00 0.00 ATOM 20792 H2 SOL 1896 35.290 9.810 7.260 1.00 0.00 ATOM 20793 OH2 SOL 1897 35.670 46.840 77.560 1.00 0.00 ATOM 20794 H1 SOL 1897 35.890 46.570 78.450 1.00 0.00 ATOM 20795 H2 SOL 1897 35.490 46.020 77.100 1.00 0.00 ATOM 20796 OH2 SOL 1898 25.620 33.410 77.190 1.00 0.00 ATOM 20797 H1 SOL 1898 25.470 33.230 78.120 1.00 0.00 ATOM 20798 H2 SOL 1898 24.800 33.780 76.870 1.00 0.00 ATOM 20799 OH2 SOL 1899 37.170 53.790 14.850 1.00 0.00 ATOM 20800 H1 SOL 1899 36.670 53.910 14.040 1.00 0.00 ATOM 20801 H2 SOL 1899 36.880 54.500 15.420 1.00 0.00 ATOM 20802 OH2 SOL 1900 24.390 20.040 83.220 1.00 0.00 ATOM 20803 H1 SOL 1900 24.860 20.380 83.980 1.00 0.00 ATOM 20804 H2 SOL 1900 24.750 20.520 82.480 1.00 0.00 ATOM 20805 OH2 SOL 1901 26.970 58.040 72.310 1.00 0.00 ATOM 20806 H1 SOL 1901 27.540 57.740 73.010 1.00 0.00 ATOM 20807 H2 SOL 1901 26.550 58.830 72.660 1.00 0.00 ATOM 20808 OH2 SOL 1902 4.520 14.320 3.110 1.00 0.00 ATOM 20809 H1 SOL 1902 4.740 15.240 2.980 1.00 0.00 ATOM 20810 H2 SOL 1902 3.590 14.320 3.320 1.00 0.00 ATOM 20811 OH2 SOL 1903 51.040 20.290 12.220 1.00 0.00 ATOM 20812 H1 SOL 1903 50.290 19.770 12.510 1.00 0.00 ATOM 20813 H2 SOL 1903 50.860 20.500 11.310 1.00 0.00 ATOM 20814 OH2 SOL 1904 31.870 54.380 17.550 1.00 0.00 ATOM 20815 H1 SOL 1904 31.430 53.980 18.300 1.00 0.00 ATOM 20816 H2 SOL 1904 31.160 54.770 17.040 1.00 0.00 ATOM 20817 OH2 SOL 1905 4.300 11.950 79.140 1.00 0.00 ATOM 20818 H1 SOL 1905 4.140 11.040 79.400 1.00 0.00 ATOM 20819 H2 SOL 1905 3.590 12.160 78.540 1.00 0.00 ATOM 20820 OH2 SOL 1906 49.190 3.740 0.140 1.00 0.00 ATOM 20821 H1 SOL 1906 48.920 4.600 -0.180 1.00 0.00 ATOM 20822 H2 SOL 1906 48.400 3.200 0.100 1.00 0.00 ATOM 20823 OH2 SOL 1907 34.910 3.950 18.070 1.00 0.00 ATOM 20824 H1 SOL 1907 34.440 3.900 18.900 1.00 0.00 ATOM 20825 H2 SOL 1907 34.560 4.720 17.640 1.00 0.00 ATOM 20826 OH2 SOL 1908 54.640 45.640 73.480 1.00 0.00 ATOM 20827 H1 SOL 1908 55.370 45.540 74.090 1.00 0.00 ATOM 20828 H2 SOL 1908 53.920 45.160 73.890 1.00 0.00 ATOM 20829 OH2 SOL 1909 14.760 59.480 14.810 1.00 0.00 ATOM 20830 H1 SOL 1909 15.090 60.020 15.530 1.00 0.00 ATOM 20831 H2 SOL 1909 15.550 59.160 14.380 1.00 0.00 ATOM 20832 OH2 SOL 1910 54.190 37.990 8.630 1.00 0.00 ATOM 20833 H1 SOL 1910 54.990 38.400 8.960 1.00 0.00 ATOM 20834 H2 SOL 1910 54.310 37.060 8.840 1.00 0.00 ATOM 20835 OH2 SOL 1911 53.520 13.280 13.950 1.00 0.00 ATOM 20836 H1 SOL 1911 54.400 13.190 14.290 1.00 0.00 ATOM 20837 H2 SOL 1911 53.470 12.650 13.220 1.00 0.00 ATOM 20838 OH2 SOL 1912 28.430 23.570 67.200 1.00 0.00 ATOM 20839 H1 SOL 1912 29.270 23.110 67.230 1.00 0.00 ATOM 20840 H2 SOL 1912 28.300 23.780 66.280 1.00 0.00 ATOM 20841 OH2 SOL 1913 33.570 0.280 75.470 1.00 0.00 ATOM 20842 H1 SOL 1913 32.830 -0.310 75.480 1.00 0.00 ATOM 20843 H2 SOL 1913 33.190 1.150 75.580 1.00 0.00 ATOM 20844 OH2 SOL 1914 28.160 50.460 79.230 1.00 0.00 ATOM 20845 H1 SOL 1914 28.380 49.960 80.020 1.00 0.00 ATOM 20846 H2 SOL 1914 28.970 50.920 79.010 1.00 0.00 ATOM 20847 OH2 SOL 1915 27.930 0.770 23.920 1.00 0.00 ATOM 20848 H1 SOL 1915 28.830 1.080 23.770 1.00 0.00 ATOM 20849 H2 SOL 1915 28.010 0.160 24.650 1.00 0.00 ATOM 20850 OH2 SOL 1916 48.800 58.930 10.820 1.00 0.00 ATOM 20851 H1 SOL 1916 48.580 58.990 9.890 1.00 0.00 ATOM 20852 H2 SOL 1916 49.190 59.790 11.030 1.00 0.00 ATOM 20853 OH2 SOL 1917 7.340 21.520 84.270 1.00 0.00 ATOM 20854 H1 SOL 1917 6.890 22.320 84.560 1.00 0.00 ATOM 20855 H2 SOL 1917 7.860 21.790 83.520 1.00 0.00 ATOM 20856 OH2 SOL 1918 43.070 49.490 5.400 1.00 0.00 ATOM 20857 H1 SOL 1918 43.860 48.970 5.560 1.00 0.00 ATOM 20858 H2 SOL 1918 43.400 50.380 5.290 1.00 0.00 ATOM 20859 OH2 SOL 1919 35.790 3.490 61.210 1.00 0.00 ATOM 20860 H1 SOL 1919 36.400 2.770 61.340 1.00 0.00 ATOM 20861 H2 SOL 1919 35.350 3.590 62.060 1.00 0.00 ATOM 20862 OH2 SOL 1920 5.140 36.400 82.230 1.00 0.00 ATOM 20863 H1 SOL 1920 5.330 36.120 83.130 1.00 0.00 ATOM 20864 H2 SOL 1920 4.620 35.690 81.860 1.00 0.00 ATOM 20865 OH2 SOL 1921 53.040 3.870 15.420 1.00 0.00 ATOM 20866 H1 SOL 1921 52.530 4.630 15.140 1.00 0.00 ATOM 20867 H2 SOL 1921 52.390 3.220 15.680 1.00 0.00 ATOM 20868 OH2 SOL 1922 9.400 30.040 72.130 1.00 0.00 ATOM 20869 H1 SOL 1922 8.680 29.850 71.530 1.00 0.00 ATOM 20870 H2 SOL 1922 10.170 30.140 71.560 1.00 0.00 ATOM 20871 OH2 SOL 1923 24.840 30.310 10.120 1.00 0.00 ATOM 20872 H1 SOL 1923 24.570 31.200 10.340 1.00 0.00 ATOM 20873 H2 SOL 1923 24.600 30.210 9.200 1.00 0.00 ATOM 20874 OH2 SOL 1924 6.930 31.360 65.590 1.00 0.00 ATOM 20875 H1 SOL 1924 7.310 32.000 66.180 1.00 0.00 ATOM 20876 H2 SOL 1924 7.650 30.750 65.400 1.00 0.00 ATOM 20877 OH2 SOL 1925 23.720 18.130 9.190 1.00 0.00 ATOM 20878 H1 SOL 1925 23.370 17.920 8.330 1.00 0.00 ATOM 20879 H2 SOL 1925 22.950 18.280 9.740 1.00 0.00 ATOM 20880 OH2 SOL 1926 23.650 47.910 12.320 1.00 0.00 ATOM 20881 H1 SOL 1926 24.490 47.740 12.750 1.00 0.00 ATOM 20882 H2 SOL 1926 23.890 48.230 11.450 1.00 0.00 ATOM 20883 OH2 SOL 1927 56.430 29.350 67.050 1.00 0.00 ATOM 20884 H1 SOL 1927 56.150 29.980 67.720 1.00 0.00 ATOM 20885 H2 SOL 1927 57.380 29.440 67.020 1.00 0.00 ATOM 20886 OH2 SOL 1928 41.100 47.550 1.720 1.00 0.00 ATOM 20887 H1 SOL 1928 40.570 48.130 2.270 1.00 0.00 ATOM 20888 H2 SOL 1928 41.600 48.150 1.160 1.00 0.00 ATOM 20889 OH2 SOL 1929 39.760 1.300 82.720 1.00 0.00 ATOM 20890 H1 SOL 1929 39.930 0.500 82.220 1.00 0.00 ATOM 20891 H2 SOL 1929 38.810 1.320 82.830 1.00 0.00 ATOM 20892 OH2 SOL 1930 23.260 35.120 77.290 1.00 0.00 ATOM 20893 H1 SOL 1930 22.510 34.590 77.020 1.00 0.00 ATOM 20894 H2 SOL 1930 23.470 35.660 76.530 1.00 0.00 ATOM 20895 OH2 SOL 1931 11.580 52.540 6.110 1.00 0.00 ATOM 20896 H1 SOL 1931 11.580 51.710 6.590 1.00 0.00 ATOM 20897 H2 SOL 1931 11.390 52.310 5.210 1.00 0.00 ATOM 20898 OH2 SOL 1932 4.680 27.560 4.680 1.00 0.00 ATOM 20899 H1 SOL 1932 4.890 26.940 5.370 1.00 0.00 ATOM 20900 H2 SOL 1932 4.110 28.210 5.100 1.00 0.00 ATOM 20901 OH2 SOL 1933 19.820 22.290 21.470 1.00 0.00 ATOM 20902 H1 SOL 1933 20.580 21.940 21.940 1.00 0.00 ATOM 20903 H2 SOL 1933 19.530 21.570 20.910 1.00 0.00 ATOM 20904 OH2 SOL 1934 27.430 59.360 18.390 1.00 0.00 ATOM 20905 H1 SOL 1934 27.740 59.610 17.510 1.00 0.00 ATOM 20906 H2 SOL 1934 28.220 59.030 18.830 1.00 0.00 ATOM 20907 OH2 SOL 1935 45.900 27.290 70.500 1.00 0.00 ATOM 20908 H1 SOL 1935 46.020 26.490 71.010 1.00 0.00 ATOM 20909 H2 SOL 1935 46.680 27.320 69.930 1.00 0.00 ATOM 20910 OH2 SOL 1936 14.410 0.300 0.560 1.00 0.00 ATOM 20911 H1 SOL 1936 13.770 -0.270 0.990 1.00 0.00 ATOM 20912 H2 SOL 1936 15.250 0.070 0.970 1.00 0.00 ATOM 20913 OH2 SOL 1937 56.600 36.210 76.290 1.00 0.00 ATOM 20914 H1 SOL 1937 57.370 35.790 76.660 1.00 0.00 ATOM 20915 H2 SOL 1937 55.870 35.650 76.540 1.00 0.00 ATOM 20916 OH2 SOL 1938 52.080 26.540 19.450 1.00 0.00 ATOM 20917 H1 SOL 1938 51.280 26.800 19.000 1.00 0.00 ATOM 20918 H2 SOL 1938 52.530 27.360 19.640 1.00 0.00 ATOM 20919 OH2 SOL 1939 16.920 2.030 1.020 1.00 0.00 ATOM 20920 H1 SOL 1939 17.240 1.670 1.850 1.00 0.00 ATOM 20921 H2 SOL 1939 16.380 2.780 1.280 1.00 0.00 ATOM 20922 OH2 SOL 1940 42.810 18.320 82.460 1.00 0.00 ATOM 20923 H1 SOL 1940 42.230 17.590 82.280 1.00 0.00 ATOM 20924 H2 SOL 1940 43.620 17.910 82.760 1.00 0.00 ATOM 20925 OH2 SOL 1941 32.380 13.460 67.760 1.00 0.00 ATOM 20926 H1 SOL 1941 31.620 14.040 67.760 1.00 0.00 ATOM 20927 H2 SOL 1941 32.800 13.610 68.610 1.00 0.00 ATOM 20928 OH2 SOL 1942 43.980 16.120 63.910 1.00 0.00 ATOM 20929 H1 SOL 1942 43.450 16.720 64.430 1.00 0.00 ATOM 20930 H2 SOL 1942 43.760 15.250 64.230 1.00 0.00 ATOM 20931 OH2 SOL 1943 38.490 58.360 15.570 1.00 0.00 ATOM 20932 H1 SOL 1943 37.780 57.830 15.940 1.00 0.00 ATOM 20933 H2 SOL 1943 38.040 59.030 15.060 1.00 0.00 ATOM 20934 OH2 SOL 1944 28.180 54.680 18.910 1.00 0.00 ATOM 20935 H1 SOL 1944 27.950 55.340 19.560 1.00 0.00 ATOM 20936 H2 SOL 1944 27.350 54.450 18.490 1.00 0.00 ATOM 20937 OH2 SOL 1945 5.340 31.700 82.770 1.00 0.00 ATOM 20938 H1 SOL 1945 4.750 31.290 83.390 1.00 0.00 ATOM 20939 H2 SOL 1945 4.830 32.400 82.370 1.00 0.00 ATOM 20940 OH2 SOL 1946 27.240 33.470 69.400 1.00 0.00 ATOM 20941 H1 SOL 1946 27.530 33.570 68.490 1.00 0.00 ATOM 20942 H2 SOL 1946 27.900 32.910 69.800 1.00 0.00 ATOM 20943 OH2 SOL 1947 56.030 44.530 80.940 1.00 0.00 ATOM 20944 H1 SOL 1947 55.830 43.980 81.700 1.00 0.00 ATOM 20945 H2 SOL 1947 56.880 44.920 81.150 1.00 0.00 ATOM 20946 OH2 SOL 1948 28.800 4.480 83.370 1.00 0.00 ATOM 20947 H1 SOL 1948 29.640 4.330 83.800 1.00 0.00 ATOM 20948 H2 SOL 1948 28.920 4.160 82.480 1.00 0.00 ATOM 20949 OH2 SOL 1949 15.650 28.410 84.380 1.00 0.00 ATOM 20950 H1 SOL 1949 14.920 29.010 84.240 1.00 0.00 ATOM 20951 H2 SOL 1949 16.160 28.800 85.090 1.00 0.00 ATOM 20952 OH2 SOL 1950 1.800 26.840 83.360 1.00 0.00 ATOM 20953 H1 SOL 1950 1.540 26.490 82.510 1.00 0.00 ATOM 20954 H2 SOL 1950 1.000 26.840 83.880 1.00 0.00 ATOM 20955 OH2 SOL 1951 43.140 39.000 84.040 1.00 0.00 ATOM 20956 H1 SOL 1951 43.510 38.560 83.280 1.00 0.00 ATOM 20957 H2 SOL 1951 42.420 38.430 84.320 1.00 0.00 ATOM 20958 OH2 SOL 1952 11.260 49.600 10.020 1.00 0.00 ATOM 20959 H1 SOL 1952 10.460 49.870 9.580 1.00 0.00 ATOM 20960 H2 SOL 1952 11.380 48.690 9.750 1.00 0.00 ATOM 20961 OH2 SOL 1953 5.800 35.200 67.100 1.00 0.00 ATOM 20962 H1 SOL 1953 6.680 34.990 67.400 1.00 0.00 ATOM 20963 H2 SOL 1953 5.800 36.150 66.980 1.00 0.00 ATOM 20964 OH2 SOL 1954 58.140 34.880 20.700 1.00 0.00 ATOM 20965 H1 SOL 1954 57.310 34.510 21.010 1.00 0.00 ATOM 20966 H2 SOL 1954 58.580 35.180 21.500 1.00 0.00 ATOM 20967 OH2 SOL 1955 35.700 17.870 65.240 1.00 0.00 ATOM 20968 H1 SOL 1955 35.490 18.190 66.110 1.00 0.00 ATOM 20969 H2 SOL 1955 35.030 18.250 64.670 1.00 0.00 ATOM 20970 OH2 SOL 1956 3.160 42.760 6.830 1.00 0.00 ATOM 20971 H1 SOL 1956 3.910 42.530 7.380 1.00 0.00 ATOM 20972 H2 SOL 1956 2.970 41.970 6.330 1.00 0.00 ATOM 20973 OH2 SOL 1957 5.900 27.900 73.180 1.00 0.00 ATOM 20974 H1 SOL 1957 6.630 27.420 73.570 1.00 0.00 ATOM 20975 H2 SOL 1957 5.600 27.350 72.460 1.00 0.00 ATOM 20976 OH2 SOL 1958 3.160 40.160 5.780 1.00 0.00 ATOM 20977 H1 SOL 1958 3.890 39.590 6.040 1.00 0.00 ATOM 20978 H2 SOL 1958 2.430 39.560 5.620 1.00 0.00 ATOM 20979 OH2 SOL 1959 33.390 0.900 63.400 1.00 0.00 ATOM 20980 H1 SOL 1959 34.310 1.130 63.510 1.00 0.00 ATOM 20981 H2 SOL 1959 33.380 0.290 62.670 1.00 0.00 ATOM 20982 OH2 SOL 1960 19.680 14.690 81.560 1.00 0.00 ATOM 20983 H1 SOL 1960 20.050 13.900 81.970 1.00 0.00 ATOM 20984 H2 SOL 1960 19.780 14.540 80.620 1.00 0.00 ATOM 20985 OH2 SOL 1961 35.610 24.580 79.600 1.00 0.00 ATOM 20986 H1 SOL 1961 36.350 24.310 79.060 1.00 0.00 ATOM 20987 H2 SOL 1961 35.940 24.600 80.490 1.00 0.00 ATOM 20988 OH2 SOL 1962 35.410 37.580 75.460 1.00 0.00 ATOM 20989 H1 SOL 1962 34.590 37.300 75.850 1.00 0.00 ATOM 20990 H2 SOL 1962 35.950 36.790 75.440 1.00 0.00 ATOM 20991 OH2 SOL 1963 34.340 28.470 67.620 1.00 0.00 ATOM 20992 H1 SOL 1963 33.610 28.760 67.080 1.00 0.00 ATOM 20993 H2 SOL 1963 35.120 28.690 67.110 1.00 0.00 ATOM 20994 OH2 SOL 1964 28.840 30.100 84.380 1.00 0.00 ATOM 20995 H1 SOL 1964 29.630 29.660 84.680 1.00 0.00 ATOM 20996 H2 SOL 1964 28.620 30.710 85.090 1.00 0.00 ATOM 20997 OH2 SOL 1965 18.650 39.580 18.660 1.00 0.00 ATOM 20998 H1 SOL 1965 17.850 39.780 18.180 1.00 0.00 ATOM 20999 H2 SOL 1965 18.550 40.020 19.500 1.00 0.00 ATOM 21000 OH2 SOL 1966 45.740 19.950 62.190 1.00 0.00 ATOM 21001 H1 SOL 1966 44.850 19.990 61.820 1.00 0.00 ATOM 21002 H2 SOL 1966 45.860 19.020 62.400 1.00 0.00 ATOM 21003 OH2 SOL 1967 3.680 15.730 13.620 1.00 0.00 ATOM 21004 H1 SOL 1967 3.830 16.630 13.920 1.00 0.00 ATOM 21005 H2 SOL 1967 3.600 15.220 14.420 1.00 0.00 ATOM 21006 OH2 SOL 1968 8.330 15.800 24.500 1.00 0.00 ATOM 21007 H1 SOL 1968 8.940 15.450 25.150 1.00 0.00 ATOM 21008 H2 SOL 1968 7.650 16.220 25.020 1.00 0.00 ATOM 21009 OH2 SOL 1969 36.490 11.110 3.220 1.00 0.00 ATOM 21010 H1 SOL 1969 37.300 11.550 2.960 1.00 0.00 ATOM 21011 H2 SOL 1969 36.210 11.570 4.010 1.00 0.00 ATOM 21012 OH2 SOL 1970 48.320 44.160 66.110 1.00 0.00 ATOM 21013 H1 SOL 1970 48.590 43.910 65.220 1.00 0.00 ATOM 21014 H2 SOL 1970 49.140 44.190 66.610 1.00 0.00 ATOM 21015 OH2 SOL 1971 36.320 45.580 67.170 1.00 0.00 ATOM 21016 H1 SOL 1971 36.410 46.290 66.540 1.00 0.00 ATOM 21017 H2 SOL 1971 35.370 45.510 67.310 1.00 0.00 ATOM 21018 OH2 SOL 1972 25.500 18.080 11.570 1.00 0.00 ATOM 21019 H1 SOL 1972 24.960 18.300 10.810 1.00 0.00 ATOM 21020 H2 SOL 1972 26.380 17.950 11.220 1.00 0.00 ATOM 21021 OH2 SOL 1973 56.660 17.950 25.500 1.00 0.00 ATOM 21022 H1 SOL 1973 57.310 18.420 26.030 1.00 0.00 ATOM 21023 H2 SOL 1973 57.150 17.280 25.050 1.00 0.00 ATOM 21024 OH2 SOL 1974 1.310 11.910 78.090 1.00 0.00 ATOM 21025 H1 SOL 1974 0.720 12.390 77.510 1.00 0.00 ATOM 21026 H2 SOL 1974 1.220 11.000 77.840 1.00 0.00 ATOM 21027 OH2 SOL 1975 18.850 1.670 9.840 1.00 0.00 ATOM 21028 H1 SOL 1975 19.700 2.110 9.830 1.00 0.00 ATOM 21029 H2 SOL 1975 18.680 1.470 8.920 1.00 0.00 ATOM 21030 OH2 SOL 1976 31.320 37.620 72.340 1.00 0.00 ATOM 21031 H1 SOL 1976 31.220 37.480 73.280 1.00 0.00 ATOM 21032 H2 SOL 1976 31.440 36.750 71.970 1.00 0.00 ATOM 21033 OH2 SOL 1977 54.860 33.200 10.720 1.00 0.00 ATOM 21034 H1 SOL 1977 54.820 32.490 10.080 1.00 0.00 ATOM 21035 H2 SOL 1977 55.560 32.940 11.320 1.00 0.00 ATOM 21036 OH2 SOL 1978 19.970 54.770 78.120 1.00 0.00 ATOM 21037 H1 SOL 1978 19.810 54.090 78.780 1.00 0.00 ATOM 21038 H2 SOL 1978 19.750 55.580 78.570 1.00 0.00 ATOM 21039 OH2 SOL 1979 7.800 47.360 80.080 1.00 0.00 ATOM 21040 H1 SOL 1979 7.450 46.480 80.190 1.00 0.00 ATOM 21041 H2 SOL 1979 8.710 47.230 79.820 1.00 0.00 ATOM 21042 OH2 SOL 1980 9.910 32.470 16.450 1.00 0.00 ATOM 21043 H1 SOL 1980 10.270 31.590 16.330 1.00 0.00 ATOM 21044 H2 SOL 1980 9.530 32.690 15.590 1.00 0.00 ATOM 21045 OH2 SOL 1981 48.880 7.830 73.270 1.00 0.00 ATOM 21046 H1 SOL 1981 48.160 7.290 73.600 1.00 0.00 ATOM 21047 H2 SOL 1981 49.050 7.480 72.390 1.00 0.00 ATOM 21048 OH2 SOL 1982 38.430 55.050 18.950 1.00 0.00 ATOM 21049 H1 SOL 1982 38.570 54.190 18.560 1.00 0.00 ATOM 21050 H2 SOL 1982 38.230 54.870 19.870 1.00 0.00 ATOM 21051 OH2 SOL 1983 17.020 6.140 8.020 1.00 0.00 ATOM 21052 H1 SOL 1983 16.800 5.790 8.880 1.00 0.00 ATOM 21053 H2 SOL 1983 17.380 5.390 7.550 1.00 0.00 ATOM 21054 OH2 SOL 1984 46.540 10.180 13.340 1.00 0.00 ATOM 21055 H1 SOL 1984 47.230 10.630 13.830 1.00 0.00 ATOM 21056 H2 SOL 1984 46.470 10.660 12.520 1.00 0.00 ATOM 21057 OH2 SOL 1985 21.460 36.470 65.390 1.00 0.00 ATOM 21058 H1 SOL 1985 20.950 36.740 66.150 1.00 0.00 ATOM 21059 H2 SOL 1985 21.200 37.080 64.700 1.00 0.00 ATOM 21060 OH2 SOL 1986 37.470 26.630 19.550 1.00 0.00 ATOM 21061 H1 SOL 1986 38.170 26.660 20.200 1.00 0.00 ATOM 21062 H2 SOL 1986 36.720 27.030 19.990 1.00 0.00 ATOM 21063 OH2 SOL 1987 49.710 41.380 76.200 1.00 0.00 ATOM 21064 H1 SOL 1987 49.280 41.710 76.990 1.00 0.00 ATOM 21065 H2 SOL 1987 50.530 41.000 76.520 1.00 0.00 ATOM 21066 OH2 SOL 1988 40.560 27.710 8.700 1.00 0.00 ATOM 21067 H1 SOL 1988 40.930 28.250 9.400 1.00 0.00 ATOM 21068 H2 SOL 1988 39.630 27.950 8.700 1.00 0.00 ATOM 21069 OH2 SOL 1989 58.800 6.250 28.740 1.00 0.00 ATOM 21070 H1 SOL 1989 59.320 6.140 27.940 1.00 0.00 ATOM 21071 H2 SOL 1989 59.240 5.710 29.390 1.00 0.00 ATOM 21072 OH2 SOL 1990 28.750 28.880 21.550 1.00 0.00 ATOM 21073 H1 SOL 1990 29.060 27.990 21.730 1.00 0.00 ATOM 21074 H2 SOL 1990 29.430 29.450 21.930 1.00 0.00 ATOM 21075 OH2 SOL 1991 43.570 54.580 70.090 1.00 0.00 ATOM 21076 H1 SOL 1991 44.010 53.780 69.810 1.00 0.00 ATOM 21077 H2 SOL 1991 42.640 54.350 70.100 1.00 0.00 ATOM 21078 OH2 SOL 1992 49.460 12.370 60.950 1.00 0.00 ATOM 21079 H1 SOL 1992 48.740 12.980 60.790 1.00 0.00 ATOM 21080 H2 SOL 1992 50.250 12.870 60.720 1.00 0.00 ATOM 21081 OH2 SOL 1993 22.560 41.980 10.690 1.00 0.00 ATOM 21082 H1 SOL 1993 23.270 42.350 10.180 1.00 0.00 ATOM 21083 H2 SOL 1993 22.960 41.760 11.540 1.00 0.00 ATOM 21084 OH2 SOL 1994 29.460 54.020 63.020 1.00 0.00 ATOM 21085 H1 SOL 1994 29.450 54.710 62.360 1.00 0.00 ATOM 21086 H2 SOL 1994 29.900 54.410 63.770 1.00 0.00 ATOM 21087 OH2 SOL 1995 52.360 54.300 69.840 1.00 0.00 ATOM 21088 H1 SOL 1995 52.900 54.790 69.210 1.00 0.00 ATOM 21089 H2 SOL 1995 52.690 54.580 70.690 1.00 0.00 ATOM 21090 OH2 SOL 1996 31.520 45.440 68.330 1.00 0.00 ATOM 21091 H1 SOL 1996 31.340 45.020 67.480 1.00 0.00 ATOM 21092 H2 SOL 1996 32.470 45.480 68.380 1.00 0.00 ATOM 21093 OH2 SOL 1997 16.140 52.470 82.850 1.00 0.00 ATOM 21094 H1 SOL 1997 16.800 53.020 83.270 1.00 0.00 ATOM 21095 H2 SOL 1997 16.130 51.670 83.370 1.00 0.00 ATOM 21096 OH2 SOL 1998 26.210 41.080 83.280 1.00 0.00 ATOM 21097 H1 SOL 1998 26.260 40.620 82.440 1.00 0.00 ATOM 21098 H2 SOL 1998 26.760 40.560 83.870 1.00 0.00 ATOM 21099 OH2 SOL 1999 31.530 32.050 69.550 1.00 0.00 ATOM 21100 H1 SOL 1999 32.410 31.810 69.850 1.00 0.00 ATOM 21101 H2 SOL 1999 31.680 32.650 68.820 1.00 0.00 ATOM 21102 OH2 SOL 2000 11.700 0.380 4.280 1.00 0.00 ATOM 21103 H1 SOL 2000 11.520 1.060 3.630 1.00 0.00 ATOM 21104 H2 SOL 2000 11.760 -0.430 3.770 1.00 0.00 ATOM 21105 OH2 SOL 2001 28.870 53.660 82.680 1.00 0.00 ATOM 21106 H1 SOL 2001 27.930 53.740 82.780 1.00 0.00 ATOM 21107 H2 SOL 2001 29.140 53.040 83.360 1.00 0.00 ATOM 21108 OH2 SOL 2002 50.480 59.740 84.690 1.00 0.00 ATOM 21109 H1 SOL 2002 49.900 59.770 83.930 1.00 0.00 ATOM 21110 H2 SOL 2002 49.900 59.800 85.440 1.00 0.00 ATOM 21111 OH2 SOL 2003 25.300 51.130 15.020 1.00 0.00 ATOM 21112 H1 SOL 2003 25.800 50.450 14.570 1.00 0.00 ATOM 21113 H2 SOL 2003 24.510 51.240 14.490 1.00 0.00 ATOM 21114 OH2 SOL 2004 41.740 44.210 79.890 1.00 0.00 ATOM 21115 H1 SOL 2004 42.520 43.690 79.710 1.00 0.00 ATOM 21116 H2 SOL 2004 41.180 44.070 79.130 1.00 0.00 ATOM 21117 OH2 SOL 2005 35.640 44.790 71.020 1.00 0.00 ATOM 21118 H1 SOL 2005 36.410 45.350 70.900 1.00 0.00 ATOM 21119 H2 SOL 2005 35.420 44.890 71.950 1.00 0.00 ATOM 21120 OH2 SOL 2006 31.020 0.830 82.610 1.00 0.00 ATOM 21121 H1 SOL 2006 30.890 1.720 82.950 1.00 0.00 ATOM 21122 H2 SOL 2006 30.530 0.270 83.220 1.00 0.00 ATOM 21123 OH2 SOL 2007 51.910 5.200 7.920 1.00 0.00 ATOM 21124 H1 SOL 2007 52.110 4.350 8.320 1.00 0.00 ATOM 21125 H2 SOL 2007 52.050 5.060 6.980 1.00 0.00 ATOM 21126 OH2 SOL 2008 20.730 26.980 82.770 1.00 0.00 ATOM 21127 H1 SOL 2008 19.940 27.520 82.710 1.00 0.00 ATOM 21128 H2 SOL 2008 21.450 27.610 82.720 1.00 0.00 ATOM 21129 OH2 SOL 2009 26.140 3.950 82.180 1.00 0.00 ATOM 21130 H1 SOL 2009 25.480 3.310 82.450 1.00 0.00 ATOM 21131 H2 SOL 2009 26.980 3.500 82.310 1.00 0.00 ATOM 21132 OH2 SOL 2010 47.140 14.200 78.370 1.00 0.00 ATOM 21133 H1 SOL 2010 46.680 14.450 79.170 1.00 0.00 ATOM 21134 H2 SOL 2010 47.200 13.240 78.410 1.00 0.00 ATOM 21135 OH2 SOL 2011 35.760 17.230 79.020 1.00 0.00 ATOM 21136 H1 SOL 2011 36.590 16.840 78.740 1.00 0.00 ATOM 21137 H2 SOL 2011 35.490 16.710 79.780 1.00 0.00 ATOM 21138 OH2 SOL 2012 33.420 32.740 16.420 1.00 0.00 ATOM 21139 H1 SOL 2012 33.250 33.070 15.540 1.00 0.00 ATOM 21140 H2 SOL 2012 34.370 32.600 16.440 1.00 0.00 ATOM 21141 OH2 SOL 2013 41.630 13.820 9.420 1.00 0.00 ATOM 21142 H1 SOL 2013 41.960 14.720 9.400 1.00 0.00 ATOM 21143 H2 SOL 2013 42.220 13.370 10.030 1.00 0.00 ATOM 21144 OH2 SOL 2014 29.230 39.460 67.690 1.00 0.00 ATOM 21145 H1 SOL 2014 28.860 38.940 66.980 1.00 0.00 ATOM 21146 H2 SOL 2014 29.710 38.820 68.220 1.00 0.00 ATOM 21147 OH2 SOL 2015 11.600 38.650 1.690 1.00 0.00 ATOM 21148 H1 SOL 2015 10.690 38.670 1.970 1.00 0.00 ATOM 21149 H2 SOL 2015 11.890 39.560 1.700 1.00 0.00 ATOM 21150 OH2 SOL 2016 46.460 25.790 22.190 1.00 0.00 ATOM 21151 H1 SOL 2016 46.570 25.280 22.990 1.00 0.00 ATOM 21152 H2 SOL 2016 46.050 26.600 22.480 1.00 0.00 ATOM 21153 OH2 SOL 2017 13.550 31.540 69.420 1.00 0.00 ATOM 21154 H1 SOL 2017 12.990 31.940 68.750 1.00 0.00 ATOM 21155 H2 SOL 2017 12.960 31.020 69.950 1.00 0.00 ATOM 21156 OH2 SOL 2018 27.220 28.860 72.460 1.00 0.00 ATOM 21157 H1 SOL 2018 26.990 28.500 71.600 1.00 0.00 ATOM 21158 H2 SOL 2018 28.180 28.840 72.480 1.00 0.00 ATOM 21159 OH2 SOL 2019 37.060 45.080 19.360 1.00 0.00 ATOM 21160 H1 SOL 2019 36.930 45.620 18.570 1.00 0.00 ATOM 21161 H2 SOL 2019 36.180 44.760 19.570 1.00 0.00 ATOM 21162 OH2 SOL 2020 5.150 25.330 75.140 1.00 0.00 ATOM 21163 H1 SOL 2020 4.810 24.900 75.920 1.00 0.00 ATOM 21164 H2 SOL 2020 4.520 25.120 74.450 1.00 0.00 ATOM 21165 OH2 SOL 2021 13.740 45.490 15.290 1.00 0.00 ATOM 21166 H1 SOL 2021 13.520 44.880 15.990 1.00 0.00 ATOM 21167 H2 SOL 2021 14.600 45.840 15.540 1.00 0.00 ATOM 21168 OH2 SOL 2022 24.600 40.930 65.400 1.00 0.00 ATOM 21169 H1 SOL 2022 24.040 40.250 65.030 1.00 0.00 ATOM 21170 H2 SOL 2022 24.760 41.530 64.680 1.00 0.00 ATOM 21171 OH2 SOL 2023 22.850 50.320 81.060 1.00 0.00 ATOM 21172 H1 SOL 2023 22.010 50.080 81.450 1.00 0.00 ATOM 21173 H2 SOL 2023 22.630 51.000 80.420 1.00 0.00 ATOM 21174 OH2 SOL 2024 57.900 25.130 80.220 1.00 0.00 ATOM 21175 H1 SOL 2024 58.830 24.970 80.370 1.00 0.00 ATOM 21176 H2 SOL 2024 57.460 24.720 80.960 1.00 0.00 ATOM 21177 OH2 SOL 2025 39.590 12.360 66.090 1.00 0.00 ATOM 21178 H1 SOL 2025 39.500 11.830 66.880 1.00 0.00 ATOM 21179 H2 SOL 2025 38.870 12.980 66.130 1.00 0.00 ATOM 21180 OH2 SOL 2026 26.940 0.720 19.700 1.00 0.00 ATOM 21181 H1 SOL 2026 27.030 -0.090 19.190 1.00 0.00 ATOM 21182 H2 SOL 2026 27.730 1.220 19.480 1.00 0.00 ATOM 21183 OH2 SOL 2027 52.840 16.040 75.710 1.00 0.00 ATOM 21184 H1 SOL 2027 52.610 15.240 75.240 1.00 0.00 ATOM 21185 H2 SOL 2027 52.440 15.950 76.570 1.00 0.00 ATOM 21186 OH2 SOL 2028 8.650 37.650 67.400 1.00 0.00 ATOM 21187 H1 SOL 2028 7.700 37.730 67.320 1.00 0.00 ATOM 21188 H2 SOL 2028 8.870 38.180 68.170 1.00 0.00 ATOM 21189 OH2 SOL 2029 0.180 5.340 25.930 1.00 0.00 ATOM 21190 H1 SOL 2029 0.800 4.750 25.480 1.00 0.00 ATOM 21191 H2 SOL 2029 0.400 6.210 25.600 1.00 0.00 ATOM 21192 OH2 SOL 2030 40.030 25.370 10.430 1.00 0.00 ATOM 21193 H1 SOL 2030 39.420 24.930 11.030 1.00 0.00 ATOM 21194 H2 SOL 2030 39.800 26.290 10.500 1.00 0.00 ATOM 21195 OH2 SOL 2031 40.730 42.030 9.700 1.00 0.00 ATOM 21196 H1 SOL 2031 39.950 41.480 9.730 1.00 0.00 ATOM 21197 H2 SOL 2031 41.270 41.730 10.420 1.00 0.00 ATOM 21198 OH2 SOL 2032 16.310 55.770 23.370 1.00 0.00 ATOM 21199 H1 SOL 2032 16.070 54.840 23.320 1.00 0.00 ATOM 21200 H2 SOL 2032 17.090 55.780 23.920 1.00 0.00 ATOM 21201 OH2 SOL 2033 47.180 18.040 77.080 1.00 0.00 ATOM 21202 H1 SOL 2033 48.020 18.180 77.510 1.00 0.00 ATOM 21203 H2 SOL 2033 46.650 18.800 77.320 1.00 0.00 ATOM 21204 OH2 SOL 2034 33.620 21.040 79.240 1.00 0.00 ATOM 21205 H1 SOL 2034 33.660 21.990 79.280 1.00 0.00 ATOM 21206 H2 SOL 2034 33.590 20.830 78.300 1.00 0.00 ATOM 21207 OH2 SOL 2035 2.450 56.800 74.680 1.00 0.00 ATOM 21208 H1 SOL 2035 1.690 56.230 74.560 1.00 0.00 ATOM 21209 H2 SOL 2035 2.810 56.910 73.810 1.00 0.00 ATOM 21210 OH2 SOL 2036 40.720 23.280 79.250 1.00 0.00 ATOM 21211 H1 SOL 2036 40.580 22.920 78.370 1.00 0.00 ATOM 21212 H2 SOL 2036 40.300 22.650 79.830 1.00 0.00 ATOM 21213 OH2 SOL 2037 45.480 54.580 78.390 1.00 0.00 ATOM 21214 H1 SOL 2037 44.600 54.280 78.160 1.00 0.00 ATOM 21215 H2 SOL 2037 45.980 53.770 78.520 1.00 0.00 ATOM 21216 OH2 SOL 2038 16.150 52.610 72.660 1.00 0.00 ATOM 21217 H1 SOL 2038 16.950 52.750 72.150 1.00 0.00 ATOM 21218 H2 SOL 2038 15.440 52.710 72.030 1.00 0.00 ATOM 21219 OH2 SOL 2039 12.740 48.660 19.060 1.00 0.00 ATOM 21220 H1 SOL 2039 13.660 48.660 19.290 1.00 0.00 ATOM 21221 H2 SOL 2039 12.630 47.920 18.460 1.00 0.00 ATOM 21222 OH2 SOL 2040 3.810 38.820 77.960 1.00 0.00 ATOM 21223 H1 SOL 2040 3.340 39.660 78.020 1.00 0.00 ATOM 21224 H2 SOL 2040 4.210 38.820 77.100 1.00 0.00 ATOM 21225 OH2 SOL 2041 39.690 20.950 80.770 1.00 0.00 ATOM 21226 H1 SOL 2041 39.440 20.140 80.320 1.00 0.00 ATOM 21227 H2 SOL 2041 39.310 20.850 81.650 1.00 0.00 ATOM 21228 OH2 SOL 2042 15.520 47.380 9.190 1.00 0.00 ATOM 21229 H1 SOL 2042 14.830 48.030 9.320 1.00 0.00 ATOM 21230 H2 SOL 2042 16.050 47.730 8.470 1.00 0.00 ATOM 21231 OH2 SOL 2043 55.070 0.280 67.050 1.00 0.00 ATOM 21232 H1 SOL 2043 55.820 0.690 66.620 1.00 0.00 ATOM 21233 H2 SOL 2043 55.090 0.610 67.940 1.00 0.00 ATOM 21234 OH2 SOL 2044 47.950 5.710 13.870 1.00 0.00 ATOM 21235 H1 SOL 2044 48.400 4.870 13.820 1.00 0.00 ATOM 21236 H2 SOL 2044 48.000 6.060 12.980 1.00 0.00 ATOM 21237 OH2 SOL 2045 0.600 40.380 3.030 1.00 0.00 ATOM 21238 H1 SOL 2045 0.080 41.000 3.530 1.00 0.00 ATOM 21239 H2 SOL 2045 0.580 39.570 3.540 1.00 0.00 ATOM 21240 OH2 SOL 2046 51.160 17.860 16.620 1.00 0.00 ATOM 21241 H1 SOL 2046 50.640 18.660 16.690 1.00 0.00 ATOM 21242 H2 SOL 2046 50.520 17.150 16.670 1.00 0.00 ATOM 21243 OH2 SOL 2047 16.760 37.610 6.790 1.00 0.00 ATOM 21244 H1 SOL 2047 16.370 38.030 7.560 1.00 0.00 ATOM 21245 H2 SOL 2047 17.040 38.340 6.240 1.00 0.00 ATOM 21246 OH2 SOL 2048 11.430 6.060 16.580 1.00 0.00 ATOM 21247 H1 SOL 2048 11.920 6.780 16.990 1.00 0.00 ATOM 21248 H2 SOL 2048 12.080 5.360 16.480 1.00 0.00 ATOM 21249 OH2 SOL 2049 31.580 20.430 0.170 1.00 0.00 ATOM 21250 H1 SOL 2049 32.450 20.250 -0.180 1.00 0.00 ATOM 21251 H2 SOL 2049 31.550 21.380 0.250 1.00 0.00 ATOM 21252 OH2 SOL 2050 44.510 38.570 3.770 1.00 0.00 ATOM 21253 H1 SOL 2050 44.620 38.500 4.720 1.00 0.00 ATOM 21254 H2 SOL 2050 44.780 37.720 3.430 1.00 0.00 ATOM 21255 OH2 SOL 2051 2.870 10.840 3.360 1.00 0.00 ATOM 21256 H1 SOL 2051 2.700 11.090 4.270 1.00 0.00 ATOM 21257 H2 SOL 2051 2.870 11.670 2.880 1.00 0.00 ATOM 21258 OH2 SOL 2052 25.590 37.350 10.790 1.00 0.00 ATOM 21259 H1 SOL 2052 25.340 38.280 10.780 1.00 0.00 ATOM 21260 H2 SOL 2052 26.540 37.370 10.650 1.00 0.00 ATOM 21261 OH2 SOL 2053 55.100 18.560 18.880 1.00 0.00 ATOM 21262 H1 SOL 2053 55.740 18.440 18.180 1.00 0.00 ATOM 21263 H2 SOL 2053 54.620 19.350 18.630 1.00 0.00 ATOM 21264 OH2 SOL 2054 27.790 41.330 8.500 1.00 0.00 ATOM 21265 H1 SOL 2054 27.480 41.950 7.840 1.00 0.00 ATOM 21266 H2 SOL 2054 28.380 40.750 8.020 1.00 0.00 ATOM 21267 OH2 SOL 2055 52.260 22.690 2.670 1.00 0.00 ATOM 21268 H1 SOL 2055 51.470 22.410 3.130 1.00 0.00 ATOM 21269 H2 SOL 2055 52.220 22.240 1.830 1.00 0.00 ATOM 21270 OH2 SOL 2056 48.790 18.960 19.900 1.00 0.00 ATOM 21271 H1 SOL 2056 48.130 18.520 19.370 1.00 0.00 ATOM 21272 H2 SOL 2056 49.080 18.290 20.520 1.00 0.00 ATOM 21273 OH2 SOL 2057 42.730 49.420 9.530 1.00 0.00 ATOM 21274 H1 SOL 2057 43.210 50.230 9.350 1.00 0.00 ATOM 21275 H2 SOL 2057 41.980 49.450 8.940 1.00 0.00 ATOM 21276 OH2 SOL 2058 13.440 25.730 24.060 1.00 0.00 ATOM 21277 H1 SOL 2058 13.170 24.980 23.530 1.00 0.00 ATOM 21278 H2 SOL 2058 14.290 25.460 24.430 1.00 0.00 ATOM 21279 OH2 SOL 2059 13.090 11.170 9.420 1.00 0.00 ATOM 21280 H1 SOL 2059 12.310 11.620 9.080 1.00 0.00 ATOM 21281 H2 SOL 2059 13.570 11.840 9.890 1.00 0.00 ATOM 21282 OH2 SOL 2060 56.190 43.990 16.750 1.00 0.00 ATOM 21283 H1 SOL 2060 56.730 44.770 16.870 1.00 0.00 ATOM 21284 H2 SOL 2060 55.470 44.100 17.370 1.00 0.00 ATOM 21285 OH2 SOL 2061 19.280 22.390 6.620 1.00 0.00 ATOM 21286 H1 SOL 2061 18.380 22.570 6.330 1.00 0.00 ATOM 21287 H2 SOL 2061 19.800 22.420 5.810 1.00 0.00 ATOM 21288 OH2 SOL 2062 48.300 8.110 20.290 1.00 0.00 ATOM 21289 H1 SOL 2062 48.520 8.780 19.630 1.00 0.00 ATOM 21290 H2 SOL 2062 47.830 8.580 20.970 1.00 0.00 ATOM 21291 OH2 SOL 2063 19.540 40.130 68.440 1.00 0.00 ATOM 21292 H1 SOL 2063 19.170 40.020 67.570 1.00 0.00 ATOM 21293 H2 SOL 2063 19.580 39.250 68.800 1.00 0.00 ATOM 21294 OH2 SOL 2064 25.930 20.650 0.780 1.00 0.00 ATOM 21295 H1 SOL 2064 26.140 21.270 1.470 1.00 0.00 ATOM 21296 H2 SOL 2064 26.090 19.790 1.170 1.00 0.00 ATOM 21297 OH2 SOL 2065 54.630 39.030 73.660 1.00 0.00 ATOM 21298 H1 SOL 2065 55.560 39.230 73.750 1.00 0.00 ATOM 21299 H2 SOL 2065 54.450 38.420 74.370 1.00 0.00 ATOM 21300 OH2 SOL 2066 23.650 11.500 8.080 1.00 0.00 ATOM 21301 H1 SOL 2066 24.430 11.600 8.610 1.00 0.00 ATOM 21302 H2 SOL 2066 23.950 11.040 7.290 1.00 0.00 ATOM 21303 OH2 SOL 2067 12.390 44.990 82.540 1.00 0.00 ATOM 21304 H1 SOL 2067 13.340 44.890 82.580 1.00 0.00 ATOM 21305 H2 SOL 2067 12.240 45.930 82.660 1.00 0.00 ATOM 21306 OH2 SOL 2068 44.870 41.390 70.330 1.00 0.00 ATOM 21307 H1 SOL 2068 45.770 41.480 70.630 1.00 0.00 ATOM 21308 H2 SOL 2068 44.930 41.410 69.370 1.00 0.00 ATOM 21309 OH2 SOL 2069 11.800 33.560 68.770 1.00 0.00 ATOM 21310 H1 SOL 2069 11.110 34.010 69.260 1.00 0.00 ATOM 21311 H2 SOL 2069 11.820 33.990 67.920 1.00 0.00 ATOM 21312 OH2 SOL 2070 17.660 31.400 22.800 1.00 0.00 ATOM 21313 H1 SOL 2070 17.980 32.160 22.320 1.00 0.00 ATOM 21314 H2 SOL 2070 18.450 31.010 23.190 1.00 0.00 ATOM 21315 OH2 SOL 2071 12.990 15.850 9.790 1.00 0.00 ATOM 21316 H1 SOL 2071 12.250 15.270 9.960 1.00 0.00 ATOM 21317 H2 SOL 2071 13.540 15.360 9.180 1.00 0.00 ATOM 21318 OH2 SOL 2072 52.850 3.100 69.850 1.00 0.00 ATOM 21319 H1 SOL 2072 52.730 4.030 69.670 1.00 0.00 ATOM 21320 H2 SOL 2072 52.280 2.650 69.240 1.00 0.00 ATOM 21321 OH2 SOL 2073 1.280 46.370 9.290 1.00 0.00 ATOM 21322 H1 SOL 2073 2.190 46.420 9.580 1.00 0.00 ATOM 21323 H2 SOL 2073 0.930 45.600 9.750 1.00 0.00 ATOM 21324 OH2 SOL 2074 11.900 58.890 66.100 1.00 0.00 ATOM 21325 H1 SOL 2074 12.310 59.690 66.420 1.00 0.00 ATOM 21326 H2 SOL 2074 11.090 59.180 65.680 1.00 0.00 ATOM 21327 OH2 SOL 2075 37.030 33.990 62.080 1.00 0.00 ATOM 21328 H1 SOL 2075 37.600 34.680 62.430 1.00 0.00 ATOM 21329 H2 SOL 2075 37.370 33.830 61.200 1.00 0.00 ATOM 21330 OH2 SOL 2076 44.630 51.300 8.210 1.00 0.00 ATOM 21331 H1 SOL 2076 45.490 51.350 8.630 1.00 0.00 ATOM 21332 H2 SOL 2076 44.760 50.710 7.470 1.00 0.00 ATOM 21333 OH2 SOL 2077 56.130 7.030 77.520 1.00 0.00 ATOM 21334 H1 SOL 2077 55.280 7.450 77.660 1.00 0.00 ATOM 21335 H2 SOL 2077 56.760 7.750 77.520 1.00 0.00 ATOM 21336 OH2 SOL 2078 53.740 58.960 71.470 1.00 0.00 ATOM 21337 H1 SOL 2078 53.790 59.910 71.330 1.00 0.00 ATOM 21338 H2 SOL 2078 54.120 58.840 72.350 1.00 0.00 ATOM 21339 OH2 SOL 2079 6.750 47.260 64.230 1.00 0.00 ATOM 21340 H1 SOL 2079 6.190 48.020 64.360 1.00 0.00 ATOM 21341 H2 SOL 2079 6.740 47.110 63.290 1.00 0.00 ATOM 21342 OH2 SOL 2080 37.220 28.460 71.990 1.00 0.00 ATOM 21343 H1 SOL 2080 37.260 28.510 71.030 1.00 0.00 ATOM 21344 H2 SOL 2080 36.780 27.630 72.160 1.00 0.00 ATOM 21345 OH2 SOL 2081 56.790 7.050 11.750 1.00 0.00 ATOM 21346 H1 SOL 2081 55.910 6.960 12.110 1.00 0.00 ATOM 21347 H2 SOL 2081 57.070 6.160 11.550 1.00 0.00 ATOM 21348 OH2 SOL 2082 46.840 51.050 9.740 1.00 0.00 ATOM 21349 H1 SOL 2082 46.520 50.350 10.310 1.00 0.00 ATOM 21350 H2 SOL 2082 47.570 51.440 10.220 1.00 0.00 ATOM 21351 OH2 SOL 2083 24.590 34.230 21.890 1.00 0.00 ATOM 21352 H1 SOL 2083 24.780 34.910 22.530 1.00 0.00 ATOM 21353 H2 SOL 2083 23.770 34.500 21.470 1.00 0.00 ATOM 21354 OH2 SOL 2084 36.290 16.780 60.870 1.00 0.00 ATOM 21355 H1 SOL 2084 36.150 16.980 59.950 1.00 0.00 ATOM 21356 H2 SOL 2084 36.770 17.530 61.210 1.00 0.00 ATOM 21357 OH2 SOL 2085 48.930 7.180 79.720 1.00 0.00 ATOM 21358 H1 SOL 2085 48.520 6.910 80.540 1.00 0.00 ATOM 21359 H2 SOL 2085 48.950 8.140 79.780 1.00 0.00 ATOM 21360 OH2 SOL 2086 3.410 58.460 18.370 1.00 0.00 ATOM 21361 H1 SOL 2086 3.560 58.800 19.250 1.00 0.00 ATOM 21362 H2 SOL 2086 3.570 59.210 17.790 1.00 0.00 ATOM 21363 OH2 SOL 2087 33.410 43.780 15.470 1.00 0.00 ATOM 21364 H1 SOL 2087 33.170 43.920 14.560 1.00 0.00 ATOM 21365 H2 SOL 2087 32.580 43.610 15.910 1.00 0.00 ATOM 21366 OH2 SOL 2088 0.190 8.290 84.630 1.00 0.00 ATOM 21367 H1 SOL 2088 0.870 8.290 85.300 1.00 0.00 ATOM 21368 H2 SOL 2088 0.420 9.010 84.040 1.00 0.00 ATOM 21369 OH2 SOL 2089 33.700 21.870 6.070 1.00 0.00 ATOM 21370 H1 SOL 2089 33.480 21.000 5.750 1.00 0.00 ATOM 21371 H2 SOL 2089 32.970 22.420 5.780 1.00 0.00 ATOM 21372 OH2 SOL 2090 36.940 21.850 78.570 1.00 0.00 ATOM 21373 H1 SOL 2090 37.460 22.340 79.210 1.00 0.00 ATOM 21374 H2 SOL 2090 36.530 21.150 79.080 1.00 0.00 ATOM 21375 OH2 SOL 2091 32.590 46.270 17.050 1.00 0.00 ATOM 21376 H1 SOL 2091 32.080 46.790 17.670 1.00 0.00 ATOM 21377 H2 SOL 2091 32.140 45.430 17.010 1.00 0.00 ATOM 21378 OH2 SOL 2092 18.880 28.690 14.150 1.00 0.00 ATOM 21379 H1 SOL 2092 19.580 28.340 13.610 1.00 0.00 ATOM 21380 H2 SOL 2092 18.250 27.970 14.230 1.00 0.00 ATOM 21381 OH2 SOL 2093 53.950 38.130 76.160 1.00 0.00 ATOM 21382 H1 SOL 2093 53.710 37.310 75.740 1.00 0.00 ATOM 21383 H2 SOL 2093 54.580 37.870 76.840 1.00 0.00 ATOM 21384 OH2 SOL 2094 11.780 23.010 69.440 1.00 0.00 ATOM 21385 H1 SOL 2094 10.840 23.000 69.250 1.00 0.00 ATOM 21386 H2 SOL 2094 11.920 22.220 69.970 1.00 0.00 ATOM 21387 OH2 SOL 2095 12.190 23.570 82.310 1.00 0.00 ATOM 21388 H1 SOL 2095 11.580 23.580 83.040 1.00 0.00 ATOM 21389 H2 SOL 2095 11.720 23.980 81.590 1.00 0.00 ATOM 21390 OH2 SOL 2096 25.170 36.230 17.710 1.00 0.00 ATOM 21391 H1 SOL 2096 24.500 35.660 18.100 1.00 0.00 ATOM 21392 H2 SOL 2096 25.830 35.620 17.380 1.00 0.00 ATOM 21393 OH2 SOL 2097 0.510 23.790 20.820 1.00 0.00 ATOM 21394 H1 SOL 2097 1.280 23.370 20.430 1.00 0.00 ATOM 21395 H2 SOL 2097 0.410 24.610 20.320 1.00 0.00 ATOM 21396 OH2 SOL 2098 5.630 30.750 17.990 1.00 0.00 ATOM 21397 H1 SOL 2098 4.770 30.880 17.600 1.00 0.00 ATOM 21398 H2 SOL 2098 5.950 29.930 17.610 1.00 0.00 ATOM 21399 OH2 SOL 2099 21.930 22.510 76.080 1.00 0.00 ATOM 21400 H1 SOL 2099 22.350 22.840 76.870 1.00 0.00 ATOM 21401 H2 SOL 2099 22.600 22.570 75.410 1.00 0.00 ATOM 21402 OH2 SOL 2100 54.370 37.060 65.960 1.00 0.00 ATOM 21403 H1 SOL 2100 54.240 36.650 66.820 1.00 0.00 ATOM 21404 H2 SOL 2100 54.270 36.340 65.340 1.00 0.00 ATOM 21405 OH2 SOL 2101 10.970 27.980 77.640 1.00 0.00 ATOM 21406 H1 SOL 2101 10.320 28.640 77.390 1.00 0.00 ATOM 21407 H2 SOL 2101 11.440 28.380 78.380 1.00 0.00 ATOM 21408 OH2 SOL 2102 25.270 51.710 70.400 1.00 0.00 ATOM 21409 H1 SOL 2102 24.610 52.330 70.100 1.00 0.00 ATOM 21410 H2 SOL 2102 24.770 51.020 70.830 1.00 0.00 ATOM 21411 OH2 SOL 2103 15.880 57.080 72.060 1.00 0.00 ATOM 21412 H1 SOL 2103 15.140 56.680 71.610 1.00 0.00 ATOM 21413 H2 SOL 2103 16.640 56.820 71.550 1.00 0.00 ATOM 21414 OH2 SOL 2104 25.950 51.740 79.960 1.00 0.00 ATOM 21415 H1 SOL 2104 25.670 52.180 79.160 1.00 0.00 ATOM 21416 H2 SOL 2104 26.830 51.410 79.760 1.00 0.00 ATOM 21417 OH2 SOL 2105 55.790 36.960 61.350 1.00 0.00 ATOM 21418 H1 SOL 2105 56.140 36.090 61.170 1.00 0.00 ATOM 21419 H2 SOL 2105 54.850 36.830 61.440 1.00 0.00 ATOM 21420 OH2 SOL 2106 32.870 7.050 72.460 1.00 0.00 ATOM 21421 H1 SOL 2106 33.770 7.370 72.400 1.00 0.00 ATOM 21422 H2 SOL 2106 32.330 7.850 72.470 1.00 0.00 ATOM 21423 OH2 SOL 2107 33.310 53.000 14.080 1.00 0.00 ATOM 21424 H1 SOL 2107 32.680 53.250 13.410 1.00 0.00 ATOM 21425 H2 SOL 2107 33.610 52.130 13.820 1.00 0.00 ATOM 21426 OH2 SOL 2108 51.020 15.590 70.180 1.00 0.00 ATOM 21427 H1 SOL 2108 50.320 15.320 70.780 1.00 0.00 ATOM 21428 H2 SOL 2108 51.680 14.900 70.260 1.00 0.00 ATOM 21429 OH2 SOL 2109 10.670 15.590 23.030 1.00 0.00 ATOM 21430 H1 SOL 2109 11.120 16.210 23.600 1.00 0.00 ATOM 21431 H2 SOL 2109 9.780 15.940 22.930 1.00 0.00 ATOM 21432 OH2 SOL 2110 0.480 13.050 66.090 1.00 0.00 ATOM 21433 H1 SOL 2110 0.860 12.340 65.570 1.00 0.00 ATOM 21434 H2 SOL 2110 0.490 12.720 66.980 1.00 0.00 ATOM 21435 OH2 SOL 2111 41.130 39.450 67.710 1.00 0.00 ATOM 21436 H1 SOL 2111 40.470 39.810 68.310 1.00 0.00 ATOM 21437 H2 SOL 2111 41.880 39.250 68.270 1.00 0.00 ATOM 21438 OH2 SOL 2112 32.880 42.200 75.360 1.00 0.00 ATOM 21439 H1 SOL 2112 32.350 42.940 75.660 1.00 0.00 ATOM 21440 H2 SOL 2112 32.850 41.570 76.080 1.00 0.00 ATOM 21441 OH2 SOL 2113 17.950 46.840 72.790 1.00 0.00 ATOM 21442 H1 SOL 2113 18.530 46.590 72.070 1.00 0.00 ATOM 21443 H2 SOL 2113 18.270 47.700 73.060 1.00 0.00 ATOM 21444 OH2 SOL 2114 44.650 44.420 14.610 1.00 0.00 ATOM 21445 H1 SOL 2114 44.000 44.990 15.030 1.00 0.00 ATOM 21446 H2 SOL 2114 45.370 45.020 14.380 1.00 0.00 ATOM 21447 OH2 SOL 2115 9.430 37.080 10.990 1.00 0.00 ATOM 21448 H1 SOL 2115 9.670 36.910 11.910 1.00 0.00 ATOM 21449 H2 SOL 2115 10.170 37.560 10.630 1.00 0.00 ATOM 21450 OH2 SOL 2116 55.980 33.600 3.560 1.00 0.00 ATOM 21451 H1 SOL 2116 56.700 33.960 4.080 1.00 0.00 ATOM 21452 H2 SOL 2116 56.330 32.790 3.190 1.00 0.00 ATOM 21453 OH2 SOL 2117 6.490 49.060 11.670 1.00 0.00 ATOM 21454 H1 SOL 2117 6.060 48.280 12.030 1.00 0.00 ATOM 21455 H2 SOL 2117 7.340 49.080 12.100 1.00 0.00 ATOM 21456 OH2 SOL 2118 56.350 32.590 26.590 1.00 0.00 ATOM 21457 H1 SOL 2118 55.880 33.400 26.820 1.00 0.00 ATOM 21458 H2 SOL 2118 56.030 31.950 27.220 1.00 0.00 ATOM 21459 OH2 SOL 2119 43.800 36.200 14.490 1.00 0.00 ATOM 21460 H1 SOL 2119 42.980 36.360 14.950 1.00 0.00 ATOM 21461 H2 SOL 2119 43.710 35.310 14.140 1.00 0.00 ATOM 21462 OH2 SOL 2120 34.920 22.870 16.650 1.00 0.00 ATOM 21463 H1 SOL 2120 34.950 23.730 17.060 1.00 0.00 ATOM 21464 H2 SOL 2120 35.830 22.570 16.660 1.00 0.00 ATOM 21465 OH2 SOL 2121 56.600 50.890 3.030 1.00 0.00 ATOM 21466 H1 SOL 2121 56.320 50.780 2.130 1.00 0.00 ATOM 21467 H2 SOL 2121 56.340 51.790 3.260 1.00 0.00 ATOM 21468 OH2 SOL 2122 10.120 3.960 69.790 1.00 0.00 ATOM 21469 H1 SOL 2122 10.670 3.360 69.290 1.00 0.00 ATOM 21470 H2 SOL 2122 9.400 3.410 70.090 1.00 0.00 ATOM 21471 OH2 SOL 2123 35.870 34.770 7.770 1.00 0.00 ATOM 21472 H1 SOL 2123 36.720 35.220 7.820 1.00 0.00 ATOM 21473 H2 SOL 2123 36.030 33.910 8.150 1.00 0.00 ATOM 21474 OH2 SOL 2124 35.960 17.280 13.200 1.00 0.00 ATOM 21475 H1 SOL 2124 35.620 17.640 12.380 1.00 0.00 ATOM 21476 H2 SOL 2124 35.670 16.370 13.200 1.00 0.00 ATOM 21477 OH2 SOL 2125 18.700 36.870 16.170 1.00 0.00 ATOM 21478 H1 SOL 2125 17.760 36.950 16.340 1.00 0.00 ATOM 21479 H2 SOL 2125 19.040 36.430 16.950 1.00 0.00 ATOM 21480 OH2 SOL 2126 23.970 30.140 7.210 1.00 0.00 ATOM 21481 H1 SOL 2126 24.610 30.530 6.610 1.00 0.00 ATOM 21482 H2 SOL 2126 23.190 30.020 6.670 1.00 0.00 ATOM 21483 OH2 SOL 2127 4.460 18.600 12.120 1.00 0.00 ATOM 21484 H1 SOL 2127 3.530 18.450 11.950 1.00 0.00 ATOM 21485 H2 SOL 2127 4.520 19.540 12.310 1.00 0.00 ATOM 21486 OH2 SOL 2128 28.190 22.960 1.910 1.00 0.00 ATOM 21487 H1 SOL 2128 28.810 23.540 2.360 1.00 0.00 ATOM 21488 H2 SOL 2128 28.120 22.200 2.490 1.00 0.00 ATOM 21489 OH2 SOL 2129 21.070 51.150 20.750 1.00 0.00 ATOM 21490 H1 SOL 2129 21.130 50.340 21.250 1.00 0.00 ATOM 21491 H2 SOL 2129 21.720 51.730 21.150 1.00 0.00 ATOM 21492 OH2 SOL 2130 28.230 22.540 16.710 1.00 0.00 ATOM 21493 H1 SOL 2130 28.330 22.220 17.600 1.00 0.00 ATOM 21494 H2 SOL 2130 27.840 21.810 16.230 1.00 0.00 ATOM 21495 OH2 SOL 2131 24.860 48.580 6.980 1.00 0.00 ATOM 21496 H1 SOL 2131 25.340 48.180 6.250 1.00 0.00 ATOM 21497 H2 SOL 2131 24.060 48.060 7.040 1.00 0.00 ATOM 21498 OH2 SOL 2132 29.640 38.420 4.170 1.00 0.00 ATOM 21499 H1 SOL 2132 30.040 37.630 3.810 1.00 0.00 ATOM 21500 H2 SOL 2132 29.490 38.990 3.420 1.00 0.00 ATOM 21501 OH2 SOL 2133 17.620 22.020 23.900 1.00 0.00 ATOM 21502 H1 SOL 2133 16.860 21.470 24.080 1.00 0.00 ATOM 21503 H2 SOL 2133 18.240 21.800 24.590 1.00 0.00 ATOM 21504 OH2 SOL 2134 21.780 12.370 14.200 1.00 0.00 ATOM 21505 H1 SOL 2134 22.450 12.790 14.740 1.00 0.00 ATOM 21506 H2 SOL 2134 21.060 12.190 14.810 1.00 0.00 ATOM 21507 OH2 SOL 2135 9.540 10.190 6.270 1.00 0.00 ATOM 21508 H1 SOL 2135 9.460 10.120 5.320 1.00 0.00 ATOM 21509 H2 SOL 2135 10.080 9.450 6.530 1.00 0.00 ATOM 21510 OH2 SOL 2136 19.160 2.410 72.990 1.00 0.00 ATOM 21511 H1 SOL 2136 18.630 1.740 73.430 1.00 0.00 ATOM 21512 H2 SOL 2136 19.150 3.150 73.610 1.00 0.00 ATOM 21513 OH2 SOL 2137 54.260 56.180 15.640 1.00 0.00 ATOM 21514 H1 SOL 2137 54.060 56.130 16.580 1.00 0.00 ATOM 21515 H2 SOL 2137 54.250 57.120 15.450 1.00 0.00 ATOM 21516 OH2 SOL 2138 34.280 10.010 82.830 1.00 0.00 ATOM 21517 H1 SOL 2138 34.300 9.310 83.480 1.00 0.00 ATOM 21518 H2 SOL 2138 34.110 9.570 82.000 1.00 0.00 ATOM 21519 OH2 SOL 2139 37.590 28.280 69.340 1.00 0.00 ATOM 21520 H1 SOL 2139 37.290 27.660 68.680 1.00 0.00 ATOM 21521 H2 SOL 2139 37.660 29.110 68.870 1.00 0.00 ATOM 21522 OH2 SOL 2140 39.220 12.260 83.190 1.00 0.00 ATOM 21523 H1 SOL 2140 38.430 12.290 83.740 1.00 0.00 ATOM 21524 H2 SOL 2140 39.540 11.360 83.290 1.00 0.00 ATOM 21525 OH2 SOL 2141 28.720 13.720 81.250 1.00 0.00 ATOM 21526 H1 SOL 2141 27.980 13.290 80.820 1.00 0.00 ATOM 21527 H2 SOL 2141 28.880 13.200 82.040 1.00 0.00 ATOM 21528 OH2 SOL 2142 19.180 57.370 2.060 1.00 0.00 ATOM 21529 H1 SOL 2142 19.060 57.990 1.350 1.00 0.00 ATOM 21530 H2 SOL 2142 18.320 56.990 2.200 1.00 0.00 ATOM 21531 OH2 SOL 2143 52.170 44.190 77.660 1.00 0.00 ATOM 21532 H1 SOL 2143 53.080 44.140 77.970 1.00 0.00 ATOM 21533 H2 SOL 2143 52.240 44.610 76.800 1.00 0.00 ATOM 21534 OH2 SOL 2144 47.330 24.020 72.730 1.00 0.00 ATOM 21535 H1 SOL 2144 47.190 23.950 73.670 1.00 0.00 ATOM 21536 H2 SOL 2144 46.460 24.210 72.370 1.00 0.00 ATOM 21537 OH2 SOL 2145 4.070 49.770 73.390 1.00 0.00 ATOM 21538 H1 SOL 2145 3.390 50.430 73.430 1.00 0.00 ATOM 21539 H2 SOL 2145 3.880 49.270 72.590 1.00 0.00 ATOM 21540 OH2 SOL 2146 55.380 30.550 69.510 1.00 0.00 ATOM 21541 H1 SOL 2146 55.260 30.000 70.280 1.00 0.00 ATOM 21542 H2 SOL 2146 54.780 31.280 69.640 1.00 0.00 ATOM 21543 OH2 SOL 2147 30.080 15.140 68.380 1.00 0.00 ATOM 21544 H1 SOL 2147 29.200 15.100 68.740 1.00 0.00 ATOM 21545 H2 SOL 2147 29.960 15.450 67.480 1.00 0.00 ATOM 21546 OH2 SOL 2148 14.490 15.020 7.580 1.00 0.00 ATOM 21547 H1 SOL 2148 15.000 14.220 7.700 1.00 0.00 ATOM 21548 H2 SOL 2148 15.010 15.570 6.990 1.00 0.00 ATOM 21549 OH2 SOL 2149 52.690 51.350 67.270 1.00 0.00 ATOM 21550 H1 SOL 2149 52.260 52.020 66.750 1.00 0.00 ATOM 21551 H2 SOL 2149 52.690 51.700 68.160 1.00 0.00 ATOM 21552 OH2 SOL 2150 19.790 34.440 74.470 1.00 0.00 ATOM 21553 H1 SOL 2150 19.350 35.120 73.960 1.00 0.00 ATOM 21554 H2 SOL 2150 20.670 34.380 74.080 1.00 0.00 ATOM 21555 OH2 SOL 2151 56.300 8.700 23.200 1.00 0.00 ATOM 21556 H1 SOL 2151 55.700 8.600 22.460 1.00 0.00 ATOM 21557 H2 SOL 2151 56.890 7.950 23.130 1.00 0.00 ATOM 21558 OH2 SOL 2152 11.760 25.470 19.370 1.00 0.00 ATOM 21559 H1 SOL 2152 11.560 25.770 20.250 1.00 0.00 ATOM 21560 H2 SOL 2152 10.910 25.360 18.950 1.00 0.00 ATOM 21561 OH2 SOL 2153 1.460 55.610 20.690 1.00 0.00 ATOM 21562 H1 SOL 2153 0.530 55.840 20.660 1.00 0.00 ATOM 21563 H2 SOL 2153 1.580 55.200 21.550 1.00 0.00 ATOM 21564 OH2 SOL 2154 38.440 26.250 3.370 1.00 0.00 ATOM 21565 H1 SOL 2154 38.920 26.840 2.800 1.00 0.00 ATOM 21566 H2 SOL 2154 39.110 25.820 3.900 1.00 0.00 ATOM 21567 OH2 SOL 2155 55.510 33.990 16.570 1.00 0.00 ATOM 21568 H1 SOL 2155 54.820 34.540 16.190 1.00 0.00 ATOM 21569 H2 SOL 2155 55.410 34.100 17.520 1.00 0.00 ATOM 21570 OH2 SOL 2156 49.230 37.400 18.340 1.00 0.00 ATOM 21571 H1 SOL 2156 48.590 38.100 18.370 1.00 0.00 ATOM 21572 H2 SOL 2156 49.910 37.660 18.960 1.00 0.00 ATOM 21573 OH2 SOL 2157 17.160 29.870 1.540 1.00 0.00 ATOM 21574 H1 SOL 2157 18.060 29.580 1.640 1.00 0.00 ATOM 21575 H2 SOL 2157 17.060 30.570 2.190 1.00 0.00 ATOM 21576 OH2 SOL 2158 51.670 38.100 16.800 1.00 0.00 ATOM 21577 H1 SOL 2158 50.830 37.750 17.080 1.00 0.00 ATOM 21578 H2 SOL 2158 52.230 38.040 17.580 1.00 0.00 ATOM 21579 OH2 SOL 2159 7.190 60.380 0.250 1.00 0.00 ATOM 21580 H1 SOL 2159 8.090 60.070 0.140 1.00 0.00 ATOM 21581 H2 SOL 2159 6.720 59.630 0.610 1.00 0.00 ATOM 21582 OH2 SOL 2160 53.080 6.740 64.010 1.00 0.00 ATOM 21583 H1 SOL 2160 52.420 7.380 63.760 1.00 0.00 ATOM 21584 H2 SOL 2160 52.590 6.010 64.370 1.00 0.00 ATOM 21585 OH2 SOL 2161 11.230 13.010 15.120 1.00 0.00 ATOM 21586 H1 SOL 2161 10.550 13.450 14.610 1.00 0.00 ATOM 21587 H2 SOL 2161 10.870 12.960 16.000 1.00 0.00 ATOM 21588 OH2 SOL 2162 19.210 41.630 13.000 1.00 0.00 ATOM 21589 H1 SOL 2162 18.840 42.470 13.260 1.00 0.00 ATOM 21590 H2 SOL 2162 18.530 40.990 13.220 1.00 0.00 ATOM 21591 OH2 SOL 2163 17.500 14.020 83.410 1.00 0.00 ATOM 21592 H1 SOL 2163 18.210 14.230 82.800 1.00 0.00 ATOM 21593 H2 SOL 2163 16.840 13.580 82.870 1.00 0.00 ATOM 21594 OH2 SOL 2164 20.270 16.720 16.650 1.00 0.00 ATOM 21595 H1 SOL 2164 19.880 16.490 15.810 1.00 0.00 ATOM 21596 H2 SOL 2164 19.590 17.240 17.090 1.00 0.00 ATOM 21597 OH2 SOL 2165 7.690 53.670 68.950 1.00 0.00 ATOM 21598 H1 SOL 2165 7.930 52.900 68.430 1.00 0.00 ATOM 21599 H2 SOL 2165 8.350 53.690 69.650 1.00 0.00 ATOM 21600 OH2 SOL 2166 3.740 7.370 69.340 1.00 0.00 ATOM 21601 H1 SOL 2166 3.960 8.300 69.320 1.00 0.00 ATOM 21602 H2 SOL 2166 3.840 7.080 68.440 1.00 0.00 ATOM 21603 OH2 SOL 2167 13.110 12.560 3.020 1.00 0.00 ATOM 21604 H1 SOL 2167 14.050 12.440 2.880 1.00 0.00 ATOM 21605 H2 SOL 2167 13.060 13.120 3.800 1.00 0.00 ATOM 21606 OH2 SOL 2168 48.410 19.190 11.650 1.00 0.00 ATOM 21607 H1 SOL 2168 47.530 18.820 11.520 1.00 0.00 ATOM 21608 H2 SOL 2168 48.820 18.590 12.270 1.00 0.00 ATOM 21609 OH2 SOL 2169 32.440 22.570 63.060 1.00 0.00 ATOM 21610 H1 SOL 2169 32.490 22.770 62.120 1.00 0.00 ATOM 21611 H2 SOL 2169 33.220 22.980 63.440 1.00 0.00 ATOM 21612 OH2 SOL 2170 54.550 25.860 75.810 1.00 0.00 ATOM 21613 H1 SOL 2170 54.200 25.300 76.510 1.00 0.00 ATOM 21614 H2 SOL 2170 53.780 26.300 75.440 1.00 0.00 ATOM 21615 OH2 SOL 2171 31.420 34.050 77.190 1.00 0.00 ATOM 21616 H1 SOL 2171 30.620 33.960 76.680 1.00 0.00 ATOM 21617 H2 SOL 2171 31.140 33.970 78.100 1.00 0.00 ATOM 21618 OH2 SOL 2172 53.660 41.550 20.570 1.00 0.00 ATOM 21619 H1 SOL 2172 53.760 40.630 20.820 1.00 0.00 ATOM 21620 H2 SOL 2172 52.800 41.600 20.160 1.00 0.00 ATOM 21621 OH2 SOL 2173 8.890 29.480 76.810 1.00 0.00 ATOM 21622 H1 SOL 2173 8.480 28.990 77.530 1.00 0.00 ATOM 21623 H2 SOL 2173 8.210 30.080 76.510 1.00 0.00 ATOM 21624 OH2 SOL 2174 25.390 41.960 20.430 1.00 0.00 ATOM 21625 H1 SOL 2174 24.490 42.240 20.280 1.00 0.00 ATOM 21626 H2 SOL 2174 25.810 42.740 20.810 1.00 0.00 ATOM 21627 OH2 SOL 2175 16.720 6.890 77.550 1.00 0.00 ATOM 21628 H1 SOL 2175 16.470 6.010 77.240 1.00 0.00 ATOM 21629 H2 SOL 2175 17.430 7.150 76.960 1.00 0.00 ATOM 21630 OH2 SOL 2176 15.840 30.450 70.360 1.00 0.00 ATOM 21631 H1 SOL 2176 15.240 30.990 69.850 1.00 0.00 ATOM 21632 H2 SOL 2176 15.760 29.570 69.980 1.00 0.00 ATOM 21633 OH2 SOL 2177 52.390 3.960 64.060 1.00 0.00 ATOM 21634 H1 SOL 2177 52.520 3.320 63.360 1.00 0.00 ATOM 21635 H2 SOL 2177 51.840 4.640 63.670 1.00 0.00 ATOM 21636 OH2 SOL 2178 51.110 4.670 72.810 1.00 0.00 ATOM 21637 H1 SOL 2178 50.220 4.530 72.470 1.00 0.00 ATOM 21638 H2 SOL 2178 51.180 5.620 72.910 1.00 0.00 ATOM 21639 OH2 SOL 2179 14.540 59.180 20.030 1.00 0.00 ATOM 21640 H1 SOL 2179 13.990 58.670 19.430 1.00 0.00 ATOM 21641 H2 SOL 2179 14.890 58.540 20.650 1.00 0.00 ATOM 21642 OH2 SOL 2180 8.240 14.420 17.720 1.00 0.00 ATOM 21643 H1 SOL 2180 8.000 14.130 18.600 1.00 0.00 ATOM 21644 H2 SOL 2180 7.800 13.820 17.130 1.00 0.00 ATOM 21645 OH2 SOL 2181 27.780 50.940 18.960 1.00 0.00 ATOM 21646 H1 SOL 2181 28.240 51.160 19.770 1.00 0.00 ATOM 21647 H2 SOL 2181 28.070 51.610 18.340 1.00 0.00 ATOM 21648 OH2 SOL 2182 46.660 15.960 81.030 1.00 0.00 ATOM 21649 H1 SOL 2182 45.890 16.030 80.470 1.00 0.00 ATOM 21650 H2 SOL 2182 46.930 16.870 81.180 1.00 0.00 ATOM 21651 OH2 SOL 2183 18.130 0.880 14.550 1.00 0.00 ATOM 21652 H1 SOL 2183 18.050 0.540 13.650 1.00 0.00 ATOM 21653 H2 SOL 2183 18.820 1.540 14.500 1.00 0.00 ATOM 21654 OH2 SOL 2184 42.020 15.550 13.060 1.00 0.00 ATOM 21655 H1 SOL 2184 42.530 15.780 12.290 1.00 0.00 ATOM 21656 H2 SOL 2184 42.660 15.560 13.780 1.00 0.00 ATOM 21657 OH2 SOL 2185 57.670 18.590 73.130 1.00 0.00 ATOM 21658 H1 SOL 2185 58.520 18.940 72.870 1.00 0.00 ATOM 21659 H2 SOL 2185 57.270 19.300 73.650 1.00 0.00 ATOM 21660 OH2 SOL 2186 20.030 53.500 5.240 1.00 0.00 ATOM 21661 H1 SOL 2186 20.370 54.030 5.970 1.00 0.00 ATOM 21662 H2 SOL 2186 20.130 54.050 4.470 1.00 0.00 ATOM 21663 OH2 SOL 2187 9.320 29.740 64.190 1.00 0.00 ATOM 21664 H1 SOL 2187 8.930 28.880 64.040 1.00 0.00 ATOM 21665 H2 SOL 2187 9.820 29.920 63.400 1.00 0.00 ATOM 21666 OH2 SOL 2188 57.580 2.510 6.750 1.00 0.00 ATOM 21667 H1 SOL 2188 57.740 2.220 5.850 1.00 0.00 ATOM 21668 H2 SOL 2188 56.690 2.850 6.750 1.00 0.00 ATOM 21669 OH2 SOL 2189 22.820 42.070 77.880 1.00 0.00 ATOM 21670 H1 SOL 2189 22.110 41.870 77.270 1.00 0.00 ATOM 21671 H2 SOL 2189 22.740 41.400 78.560 1.00 0.00 ATOM 21672 OH2 SOL 2190 46.590 37.220 13.560 1.00 0.00 ATOM 21673 H1 SOL 2190 46.600 38.110 13.930 1.00 0.00 ATOM 21674 H2 SOL 2190 47.360 37.190 13.000 1.00 0.00 ATOM 21675 OH2 SOL 2191 42.530 8.230 70.130 1.00 0.00 ATOM 21676 H1 SOL 2191 42.840 7.680 69.410 1.00 0.00 ATOM 21677 H2 SOL 2191 41.820 7.740 70.520 1.00 0.00 ATOM 21678 OH2 SOL 2192 3.330 13.610 81.030 1.00 0.00 ATOM 21679 H1 SOL 2192 2.430 13.310 81.150 1.00 0.00 ATOM 21680 H2 SOL 2192 3.750 12.910 80.520 1.00 0.00 ATOM 21681 OH2 SOL 2193 23.480 22.880 2.040 1.00 0.00 ATOM 21682 H1 SOL 2193 23.130 22.910 2.930 1.00 0.00 ATOM 21683 H2 SOL 2193 24.360 23.260 2.110 1.00 0.00 ATOM 21684 OH2 SOL 2194 50.720 22.780 8.030 1.00 0.00 ATOM 21685 H1 SOL 2194 51.510 23.310 7.970 1.00 0.00 ATOM 21686 H2 SOL 2194 50.060 23.370 8.400 1.00 0.00 ATOM 21687 OH2 SOL 2195 38.850 18.010 72.040 1.00 0.00 ATOM 21688 H1 SOL 2195 38.080 17.450 72.000 1.00 0.00 ATOM 21689 H2 SOL 2195 38.590 18.810 71.580 1.00 0.00 ATOM 21690 OH2 SOL 2196 38.400 1.510 76.230 1.00 0.00 ATOM 21691 H1 SOL 2196 38.150 2.410 76.020 1.00 0.00 ATOM 21692 H2 SOL 2196 38.470 1.490 77.180 1.00 0.00 ATOM 21693 OH2 SOL 2197 41.270 23.930 70.360 1.00 0.00 ATOM 21694 H1 SOL 2197 40.660 24.010 71.090 1.00 0.00 ATOM 21695 H2 SOL 2197 41.210 24.750 69.890 1.00 0.00 ATOM 21696 OH2 SOL 2198 39.510 59.170 66.320 1.00 0.00 ATOM 21697 H1 SOL 2198 39.510 59.350 67.260 1.00 0.00 ATOM 21698 H2 SOL 2198 40.300 59.600 65.990 1.00 0.00 ATOM 21699 OH2 SOL 2199 47.810 21.200 1.060 1.00 0.00 ATOM 21700 H1 SOL 2199 47.330 20.750 1.760 1.00 0.00 ATOM 21701 H2 SOL 2199 47.330 22.020 0.930 1.00 0.00 ATOM 21702 OH2 SOL 2200 3.250 22.670 69.680 1.00 0.00 ATOM 21703 H1 SOL 2200 3.370 21.770 69.970 1.00 0.00 ATOM 21704 H2 SOL 2200 2.490 22.980 70.170 1.00 0.00 ATOM 21705 OH2 SOL 2201 23.620 19.190 4.130 1.00 0.00 ATOM 21706 H1 SOL 2201 23.470 19.070 3.190 1.00 0.00 ATOM 21707 H2 SOL 2201 24.570 19.270 4.210 1.00 0.00 ATOM 21708 OH2 SOL 2202 43.010 45.820 3.250 1.00 0.00 ATOM 21709 H1 SOL 2202 42.870 45.530 4.160 1.00 0.00 ATOM 21710 H2 SOL 2202 42.150 46.130 2.970 1.00 0.00 ATOM 21711 OH2 SOL 2203 13.420 47.980 68.160 1.00 0.00 ATOM 21712 H1 SOL 2203 13.790 48.770 68.550 1.00 0.00 ATOM 21713 H2 SOL 2203 13.300 47.380 68.900 1.00 0.00 ATOM 21714 OH2 SOL 2204 55.290 41.930 63.710 1.00 0.00 ATOM 21715 H1 SOL 2204 55.970 42.150 64.350 1.00 0.00 ATOM 21716 H2 SOL 2204 55.550 41.090 63.360 1.00 0.00 ATOM 21717 OH2 SOL 2205 46.190 3.140 17.500 1.00 0.00 ATOM 21718 H1 SOL 2205 45.900 2.320 17.100 1.00 0.00 ATOM 21719 H2 SOL 2205 47.070 2.950 17.820 1.00 0.00 ATOM 21720 OH2 SOL 2206 26.970 38.430 80.740 1.00 0.00 ATOM 21721 H1 SOL 2206 26.740 37.810 81.430 1.00 0.00 ATOM 21722 H2 SOL 2206 26.150 38.870 80.520 1.00 0.00 ATOM 21723 OH2 SOL 2207 39.790 18.240 60.420 1.00 0.00 ATOM 21724 H1 SOL 2207 39.110 18.360 59.760 1.00 0.00 ATOM 21725 H2 SOL 2207 40.420 18.940 60.240 1.00 0.00 ATOM 21726 OH2 SOL 2208 28.040 44.270 3.180 1.00 0.00 ATOM 21727 H1 SOL 2208 27.230 44.240 2.660 1.00 0.00 ATOM 21728 H2 SOL 2208 28.680 43.780 2.660 1.00 0.00 ATOM 21729 OH2 SOL 2209 7.580 46.910 18.180 1.00 0.00 ATOM 21730 H1 SOL 2209 7.460 47.580 18.850 1.00 0.00 ATOM 21731 H2 SOL 2209 7.330 47.340 17.360 1.00 0.00 ATOM 21732 OH2 SOL 2210 41.470 54.900 72.370 1.00 0.00 ATOM 21733 H1 SOL 2210 42.360 55.100 72.670 1.00 0.00 ATOM 21734 H2 SOL 2210 40.970 54.770 73.180 1.00 0.00 ATOM 21735 OH2 SOL 2211 9.790 42.840 8.600 1.00 0.00 ATOM 21736 H1 SOL 2211 9.960 43.550 9.210 1.00 0.00 ATOM 21737 H2 SOL 2211 9.700 42.060 9.160 1.00 0.00 ATOM 21738 OH2 SOL 2212 59.690 48.960 62.350 1.00 0.00 ATOM 21739 H1 SOL 2212 60.220 48.910 61.560 1.00 0.00 ATOM 21740 H2 SOL 2212 58.790 49.020 62.040 1.00 0.00 ATOM 21741 OH2 SOL 2213 47.770 6.170 84.340 1.00 0.00 ATOM 21742 H1 SOL 2213 48.200 6.970 84.660 1.00 0.00 ATOM 21743 H2 SOL 2213 47.530 6.370 83.430 1.00 0.00 ATOM 21744 OH2 SOL 2214 27.200 6.150 12.750 1.00 0.00 ATOM 21745 H1 SOL 2214 26.430 6.410 12.250 1.00 0.00 ATOM 21746 H2 SOL 2214 26.890 5.460 13.330 1.00 0.00 ATOM 21747 OH2 SOL 2215 1.970 42.320 60.880 1.00 0.00 ATOM 21748 H1 SOL 2215 2.070 43.220 61.200 1.00 0.00 ATOM 21749 H2 SOL 2215 1.070 42.280 60.560 1.00 0.00 ATOM 21750 OH2 SOL 2216 16.790 46.330 12.120 1.00 0.00 ATOM 21751 H1 SOL 2216 17.100 46.760 11.320 1.00 0.00 ATOM 21752 H2 SOL 2216 17.070 46.920 12.820 1.00 0.00 ATOM 21753 OH2 SOL 2217 53.660 27.960 27.880 1.00 0.00 ATOM 21754 H1 SOL 2217 54.510 28.400 27.920 1.00 0.00 ATOM 21755 H2 SOL 2217 53.350 28.120 26.990 1.00 0.00 ATOM 21756 OH2 SOL 2218 14.070 56.070 7.630 1.00 0.00 ATOM 21757 H1 SOL 2218 14.330 56.840 7.120 1.00 0.00 ATOM 21758 H2 SOL 2218 14.900 55.690 7.920 1.00 0.00 ATOM 21759 OH2 SOL 2219 44.450 25.530 72.830 1.00 0.00 ATOM 21760 H1 SOL 2219 44.050 25.740 73.680 1.00 0.00 ATOM 21761 H2 SOL 2219 43.750 25.120 72.330 1.00 0.00 ATOM 21762 OH2 SOL 2220 14.590 31.360 10.020 1.00 0.00 ATOM 21763 H1 SOL 2220 13.900 31.250 9.370 1.00 0.00 ATOM 21764 H2 SOL 2220 14.350 32.160 10.490 1.00 0.00 ATOM 21765 OH2 SOL 2221 12.340 54.120 2.390 1.00 0.00 ATOM 21766 H1 SOL 2221 11.430 54.010 2.670 1.00 0.00 ATOM 21767 H2 SOL 2221 12.320 54.870 1.800 1.00 0.00 ATOM 21768 OH2 SOL 2222 10.740 22.470 65.570 1.00 0.00 ATOM 21769 H1 SOL 2222 10.840 21.840 66.290 1.00 0.00 ATOM 21770 H2 SOL 2222 10.170 23.150 65.930 1.00 0.00 ATOM 21771 OH2 SOL 2223 2.630 39.500 9.540 1.00 0.00 ATOM 21772 H1 SOL 2223 3.460 39.980 9.590 1.00 0.00 ATOM 21773 H2 SOL 2223 2.100 40.000 8.930 1.00 0.00 ATOM 21774 OH2 SOL 2224 7.930 57.420 1.070 1.00 0.00 ATOM 21775 H1 SOL 2224 8.520 57.550 1.810 1.00 0.00 ATOM 21776 H2 SOL 2224 8.510 57.130 0.360 1.00 0.00 ATOM 21777 OH2 SOL 2225 8.030 25.670 72.250 1.00 0.00 ATOM 21778 H1 SOL 2225 8.430 25.570 73.110 1.00 0.00 ATOM 21779 H2 SOL 2225 8.650 26.210 71.760 1.00 0.00 ATOM 21780 OH2 SOL 2226 22.730 1.710 76.720 1.00 0.00 ATOM 21781 H1 SOL 2226 22.220 0.900 76.730 1.00 0.00 ATOM 21782 H2 SOL 2226 22.240 2.300 77.300 1.00 0.00 ATOM 21783 OH2 SOL 2227 39.310 3.560 4.800 1.00 0.00 ATOM 21784 H1 SOL 2227 38.530 3.190 5.200 1.00 0.00 ATOM 21785 H2 SOL 2227 39.260 3.280 3.880 1.00 0.00 ATOM 21786 OH2 SOL 2228 54.710 29.020 78.650 1.00 0.00 ATOM 21787 H1 SOL 2228 55.570 28.640 78.460 1.00 0.00 ATOM 21788 H2 SOL 2228 54.720 29.180 79.600 1.00 0.00 ATOM 21789 OH2 SOL 2229 59.150 26.450 63.560 1.00 0.00 ATOM 21790 H1 SOL 2229 58.630 27.150 63.940 1.00 0.00 ATOM 21791 H2 SOL 2229 59.850 26.900 63.080 1.00 0.00 ATOM 21792 OH2 SOL 2230 23.980 37.010 75.380 1.00 0.00 ATOM 21793 H1 SOL 2230 23.930 37.960 75.400 1.00 0.00 ATOM 21794 H2 SOL 2230 24.880 36.810 75.670 1.00 0.00 ATOM 21795 OH2 SOL 2231 54.390 35.830 19.030 1.00 0.00 ATOM 21796 H1 SOL 2231 53.470 35.960 18.820 1.00 0.00 ATOM 21797 H2 SOL 2231 54.420 35.760 19.980 1.00 0.00 ATOM 21798 OH2 SOL 2232 55.080 1.250 9.210 1.00 0.00 ATOM 21799 H1 SOL 2232 55.650 0.510 9.430 1.00 0.00 ATOM 21800 H2 SOL 2232 54.200 0.870 9.180 1.00 0.00 ATOM 21801 OH2 SOL 2233 22.710 22.890 72.290 1.00 0.00 ATOM 21802 H1 SOL 2233 22.790 22.920 73.250 1.00 0.00 ATOM 21803 H2 SOL 2233 21.930 23.420 72.100 1.00 0.00 ATOM 21804 OH2 SOL 2234 37.540 46.690 75.610 1.00 0.00 ATOM 21805 H1 SOL 2234 36.940 46.930 76.320 1.00 0.00 ATOM 21806 H2 SOL 2234 37.770 47.530 75.210 1.00 0.00 ATOM 21807 OH2 SOL 2235 49.000 48.280 16.900 1.00 0.00 ATOM 21808 H1 SOL 2235 48.780 48.060 17.800 1.00 0.00 ATOM 21809 H2 SOL 2235 48.400 48.980 16.660 1.00 0.00 ATOM 21810 OH2 SOL 2236 35.980 21.700 3.950 1.00 0.00 ATOM 21811 H1 SOL 2236 35.570 22.160 4.680 1.00 0.00 ATOM 21812 H2 SOL 2236 35.630 22.130 3.170 1.00 0.00 ATOM 21813 OH2 SOL 2237 53.830 4.890 74.930 1.00 0.00 ATOM 21814 H1 SOL 2237 53.020 5.300 75.230 1.00 0.00 ATOM 21815 H2 SOL 2237 53.660 4.670 74.010 1.00 0.00 ATOM 21816 OH2 SOL 2238 42.940 26.310 22.370 1.00 0.00 ATOM 21817 H1 SOL 2238 42.800 25.760 23.140 1.00 0.00 ATOM 21818 H2 SOL 2238 43.600 26.940 22.650 1.00 0.00 ATOM 21819 OH2 SOL 2239 46.630 6.180 81.410 1.00 0.00 ATOM 21820 H1 SOL 2239 46.570 5.250 81.640 1.00 0.00 ATOM 21821 H2 SOL 2239 45.810 6.370 80.950 1.00 0.00 ATOM 21822 OH2 SOL 2240 45.100 5.830 77.280 1.00 0.00 ATOM 21823 H1 SOL 2240 44.960 5.050 76.730 1.00 0.00 ATOM 21824 H2 SOL 2240 46.040 5.830 77.460 1.00 0.00 ATOM 21825 OH2 SOL 2241 33.930 43.200 0.310 1.00 0.00 ATOM 21826 H1 SOL 2241 34.840 43.490 0.250 1.00 0.00 ATOM 21827 H2 SOL 2241 33.990 42.240 0.340 1.00 0.00 ATOM 21828 OH2 SOL 2242 12.350 57.680 82.430 1.00 0.00 ATOM 21829 H1 SOL 2242 12.890 58.450 82.590 1.00 0.00 ATOM 21830 H2 SOL 2242 12.440 57.510 81.500 1.00 0.00 ATOM 21831 OH2 SOL 2243 0.840 15.370 16.180 1.00 0.00 ATOM 21832 H1 SOL 2243 0.410 14.780 16.800 1.00 0.00 ATOM 21833 H2 SOL 2243 1.730 15.470 16.510 1.00 0.00 ATOM 21834 OH2 SOL 2244 34.330 47.460 19.720 1.00 0.00 ATOM 21835 H1 SOL 2244 33.600 47.410 19.110 1.00 0.00 ATOM 21836 H2 SOL 2244 34.290 46.630 20.200 1.00 0.00 ATOM 21837 OH2 SOL 2245 45.940 18.170 66.150 1.00 0.00 ATOM 21838 H1 SOL 2245 46.630 18.700 66.550 1.00 0.00 ATOM 21839 H2 SOL 2245 46.410 17.480 65.690 1.00 0.00 ATOM 21840 OH2 SOL 2246 3.230 33.790 84.560 1.00 0.00 ATOM 21841 H1 SOL 2246 3.650 34.150 85.340 1.00 0.00 ATOM 21842 H2 SOL 2246 2.770 34.540 84.170 1.00 0.00 ATOM 21843 OH2 SOL 2247 35.470 51.870 72.550 1.00 0.00 ATOM 21844 H1 SOL 2247 34.860 51.330 72.060 1.00 0.00 ATOM 21845 H2 SOL 2247 35.070 51.970 73.410 1.00 0.00 ATOM 21846 OH2 SOL 2248 17.600 5.380 15.890 1.00 0.00 ATOM 21847 H1 SOL 2248 17.720 6.190 16.380 1.00 0.00 ATOM 21848 H2 SOL 2248 16.760 5.030 16.190 1.00 0.00 ATOM 21849 OH2 SOL 2249 38.090 24.920 75.280 1.00 0.00 ATOM 21850 H1 SOL 2249 37.530 24.960 76.050 1.00 0.00 ATOM 21851 H2 SOL 2249 38.380 25.820 75.150 1.00 0.00 ATOM 21852 OH2 SOL 2250 15.720 4.990 65.070 1.00 0.00 ATOM 21853 H1 SOL 2250 16.340 4.610 64.460 1.00 0.00 ATOM 21854 H2 SOL 2250 14.870 4.920 64.640 1.00 0.00 ATOM 21855 OH2 SOL 2251 50.860 47.600 14.760 1.00 0.00 ATOM 21856 H1 SOL 2251 50.850 48.540 14.580 1.00 0.00 ATOM 21857 H2 SOL 2251 50.250 47.490 15.490 1.00 0.00 ATOM 21858 OH2 SOL 2252 13.980 28.420 72.520 1.00 0.00 ATOM 21859 H1 SOL 2252 14.050 28.760 71.620 1.00 0.00 ATOM 21860 H2 SOL 2252 13.050 28.430 72.710 1.00 0.00 ATOM 21861 OH2 SOL 2253 41.260 1.180 15.440 1.00 0.00 ATOM 21862 H1 SOL 2253 42.150 1.330 15.120 1.00 0.00 ATOM 21863 H2 SOL 2253 41.260 0.280 15.770 1.00 0.00 ATOM 21864 OH2 SOL 2254 42.330 36.680 65.980 1.00 0.00 ATOM 21865 H1 SOL 2254 41.840 36.660 65.160 1.00 0.00 ATOM 21866 H2 SOL 2254 43.250 36.610 65.710 1.00 0.00 ATOM 21867 OH2 SOL 2255 30.290 49.710 2.080 1.00 0.00 ATOM 21868 H1 SOL 2255 31.080 50.150 1.750 1.00 0.00 ATOM 21869 H2 SOL 2255 30.620 49.020 2.640 1.00 0.00 ATOM 21870 OH2 SOL 2256 38.040 27.770 13.430 1.00 0.00 ATOM 21871 H1 SOL 2256 37.780 26.860 13.540 1.00 0.00 ATOM 21872 H2 SOL 2256 37.360 28.150 12.880 1.00 0.00 ATOM 21873 OH2 SOL 2257 57.280 40.840 12.170 1.00 0.00 ATOM 21874 H1 SOL 2257 57.240 40.330 12.980 1.00 0.00 ATOM 21875 H2 SOL 2257 57.930 40.400 11.630 1.00 0.00 ATOM 21876 OH2 SOL 2258 31.830 3.600 73.540 1.00 0.00 ATOM 21877 H1 SOL 2258 31.770 4.550 73.440 1.00 0.00 ATOM 21878 H2 SOL 2258 32.770 3.420 73.540 1.00 0.00 ATOM 21879 OH2 SOL 2259 10.280 3.200 0.830 1.00 0.00 ATOM 21880 H1 SOL 2259 11.210 3.170 0.620 1.00 0.00 ATOM 21881 H2 SOL 2259 9.850 3.490 0.020 1.00 0.00 ATOM 21882 OH2 SOL 2260 38.600 4.840 11.340 1.00 0.00 ATOM 21883 H1 SOL 2260 38.900 5.750 11.400 1.00 0.00 ATOM 21884 H2 SOL 2260 39.400 4.340 11.180 1.00 0.00 ATOM 21885 OH2 SOL 2261 30.760 59.840 78.100 1.00 0.00 ATOM 21886 H1 SOL 2261 29.820 59.950 78.020 1.00 0.00 ATOM 21887 H2 SOL 2261 31.040 59.480 77.250 1.00 0.00 ATOM 21888 OH2 SOL 2262 42.620 17.120 6.250 1.00 0.00 ATOM 21889 H1 SOL 2262 42.770 18.020 6.550 1.00 0.00 ATOM 21890 H2 SOL 2262 41.960 17.210 5.560 1.00 0.00 ATOM 21891 OH2 SOL 2263 4.150 6.950 66.620 1.00 0.00 ATOM 21892 H1 SOL 2263 5.070 7.160 66.490 1.00 0.00 ATOM 21893 H2 SOL 2263 3.920 6.390 65.880 1.00 0.00 ATOM 21894 OH2 SOL 2264 38.770 44.870 12.660 1.00 0.00 ATOM 21895 H1 SOL 2264 39.590 44.770 13.160 1.00 0.00 ATOM 21896 H2 SOL 2264 38.670 45.810 12.550 1.00 0.00 ATOM 21897 OH2 SOL 2265 45.100 20.400 20.480 1.00 0.00 ATOM 21898 H1 SOL 2265 46.040 20.340 20.670 1.00 0.00 ATOM 21899 H2 SOL 2265 45.030 20.220 19.550 1.00 0.00 ATOM 21900 OH2 SOL 2266 22.890 5.710 77.350 1.00 0.00 ATOM 21901 H1 SOL 2266 22.340 6.500 77.320 1.00 0.00 ATOM 21902 H2 SOL 2266 22.260 4.990 77.330 1.00 0.00 ATOM 21903 OH2 SOL 2267 40.680 23.670 65.720 1.00 0.00 ATOM 21904 H1 SOL 2267 40.110 22.920 65.840 1.00 0.00 ATOM 21905 H2 SOL 2267 41.570 23.310 65.760 1.00 0.00 ATOM 21906 OH2 SOL 2268 40.230 34.300 17.300 1.00 0.00 ATOM 21907 H1 SOL 2268 39.550 33.630 17.400 1.00 0.00 ATOM 21908 H2 SOL 2268 40.940 34.010 17.870 1.00 0.00 ATOM 21909 OH2 SOL 2269 44.840 41.270 67.390 1.00 0.00 ATOM 21910 H1 SOL 2269 44.740 40.480 66.860 1.00 0.00 ATOM 21911 H2 SOL 2269 44.490 41.970 66.840 1.00 0.00 ATOM 21912 OH2 SOL 2270 15.700 35.780 5.410 1.00 0.00 ATOM 21913 H1 SOL 2270 16.190 36.470 5.870 1.00 0.00 ATOM 21914 H2 SOL 2270 15.480 36.170 4.570 1.00 0.00 ATOM 21915 OH2 SOL 2271 13.890 11.850 84.810 1.00 0.00 ATOM 21916 H1 SOL 2271 14.320 12.010 83.980 1.00 0.00 ATOM 21917 H2 SOL 2271 14.130 10.940 85.030 1.00 0.00 ATOM 21918 OH2 SOL 2272 33.110 51.660 16.600 1.00 0.00 ATOM 21919 H1 SOL 2272 33.960 51.460 16.200 1.00 0.00 ATOM 21920 H2 SOL 2272 32.920 52.560 16.330 1.00 0.00 ATOM 21921 OH2 SOL 2273 48.040 40.650 67.500 1.00 0.00 ATOM 21922 H1 SOL 2273 47.140 40.590 67.160 1.00 0.00 ATOM 21923 H2 SOL 2273 48.020 41.400 68.090 1.00 0.00 ATOM 21924 OH2 SOL 2274 54.620 35.480 68.420 1.00 0.00 ATOM 21925 H1 SOL 2274 55.480 35.440 68.830 1.00 0.00 ATOM 21926 H2 SOL 2274 54.020 35.740 69.120 1.00 0.00 ATOM 21927 OH2 SOL 2275 21.900 7.470 62.710 1.00 0.00 ATOM 21928 H1 SOL 2275 21.420 6.830 63.230 1.00 0.00 ATOM 21929 H2 SOL 2275 22.670 7.000 62.400 1.00 0.00 ATOM 21930 OH2 SOL 2276 14.800 18.680 61.060 1.00 0.00 ATOM 21931 H1 SOL 2276 13.880 18.870 60.920 1.00 0.00 ATOM 21932 H2 SOL 2276 14.890 17.740 60.900 1.00 0.00 ATOM 21933 OH2 SOL 2277 2.710 39.870 80.900 1.00 0.00 ATOM 21934 H1 SOL 2277 3.630 39.690 80.710 1.00 0.00 ATOM 21935 H2 SOL 2277 2.360 40.220 80.080 1.00 0.00 ATOM 21936 OH2 SOL 2278 7.090 48.710 77.670 1.00 0.00 ATOM 21937 H1 SOL 2278 7.670 48.430 78.380 1.00 0.00 ATOM 21938 H2 SOL 2278 6.880 49.620 77.870 1.00 0.00 ATOM 21939 OH2 SOL 2279 24.200 21.030 78.910 1.00 0.00 ATOM 21940 H1 SOL 2279 24.450 21.410 79.760 1.00 0.00 ATOM 21941 H2 SOL 2279 24.090 21.790 78.340 1.00 0.00 ATOM 21942 OH2 SOL 2280 17.630 12.540 57.260 1.00 0.00 ATOM 21943 H1 SOL 2280 18.290 12.580 57.950 1.00 0.00 ATOM 21944 H2 SOL 2280 17.190 11.700 57.390 1.00 0.00 ATOM 21945 OH2 SOL 2281 33.240 36.430 7.510 1.00 0.00 ATOM 21946 H1 SOL 2281 33.310 35.490 7.680 1.00 0.00 ATOM 21947 H2 SOL 2281 33.870 36.590 6.810 1.00 0.00 ATOM 21948 OH2 SOL 2282 25.170 43.690 67.860 1.00 0.00 ATOM 21949 H1 SOL 2282 25.170 42.890 67.350 1.00 0.00 ATOM 21950 H2 SOL 2282 25.760 43.520 68.600 1.00 0.00 ATOM 21951 OH2 SOL 2283 50.800 7.480 8.540 1.00 0.00 ATOM 21952 H1 SOL 2283 50.060 7.340 7.950 1.00 0.00 ATOM 21953 H2 SOL 2283 51.410 6.770 8.340 1.00 0.00 ATOM 21954 OH2 SOL 2284 4.520 24.210 67.310 1.00 0.00 ATOM 21955 H1 SOL 2284 4.960 23.860 66.530 1.00 0.00 ATOM 21956 H2 SOL 2284 4.230 23.440 67.790 1.00 0.00 ATOM 21957 OH2 SOL 2285 56.870 4.460 83.590 1.00 0.00 ATOM 21958 H1 SOL 2285 56.170 4.390 82.940 1.00 0.00 ATOM 21959 H2 SOL 2285 56.770 5.350 83.940 1.00 0.00 ATOM 21960 OH2 SOL 2286 31.990 0.990 16.810 1.00 0.00 ATOM 21961 H1 SOL 2286 32.020 0.870 17.760 1.00 0.00 ATOM 21962 H2 SOL 2286 32.890 1.220 16.570 1.00 0.00 ATOM 21963 OH2 SOL 2287 49.810 39.800 82.260 1.00 0.00 ATOM 21964 H1 SOL 2287 48.870 39.720 82.090 1.00 0.00 ATOM 21965 H2 SOL 2287 49.910 40.670 82.650 1.00 0.00 ATOM 21966 OH2 SOL 2288 57.200 28.600 15.770 1.00 0.00 ATOM 21967 H1 SOL 2288 57.690 27.860 15.410 1.00 0.00 ATOM 21968 H2 SOL 2288 57.550 28.710 16.660 1.00 0.00 ATOM 21969 OH2 SOL 2289 16.880 6.720 72.010 1.00 0.00 ATOM 21970 H1 SOL 2289 16.050 7.150 72.230 1.00 0.00 ATOM 21971 H2 SOL 2289 16.940 5.990 72.630 1.00 0.00 ATOM 21972 OH2 SOL 2290 18.510 24.040 84.140 1.00 0.00 ATOM 21973 H1 SOL 2290 17.960 24.480 83.490 1.00 0.00 ATOM 21974 H2 SOL 2290 18.110 23.180 84.250 1.00 0.00 ATOM 21975 OH2 SOL 2291 14.360 10.570 67.610 1.00 0.00 ATOM 21976 H1 SOL 2291 14.650 10.940 66.780 1.00 0.00 ATOM 21977 H2 SOL 2291 13.450 10.880 67.700 1.00 0.00 ATOM 21978 OH2 SOL 2292 45.830 56.340 67.840 1.00 0.00 ATOM 21979 H1 SOL 2292 45.410 56.280 68.700 1.00 0.00 ATOM 21980 H2 SOL 2292 45.540 55.550 67.380 1.00 0.00 ATOM 21981 OH2 SOL 2293 24.900 14.830 13.950 1.00 0.00 ATOM 21982 H1 SOL 2293 24.700 15.760 13.960 1.00 0.00 ATOM 21983 H2 SOL 2293 25.220 14.660 13.060 1.00 0.00 ATOM 21984 OH2 SOL 2294 53.490 36.110 84.190 1.00 0.00 ATOM 21985 H1 SOL 2294 53.060 36.630 84.860 1.00 0.00 ATOM 21986 H2 SOL 2294 54.190 36.670 83.860 1.00 0.00 ATOM 21987 OH2 SOL 2295 10.720 54.010 68.760 1.00 0.00 ATOM 21988 H1 SOL 2295 10.480 53.090 68.680 1.00 0.00 ATOM 21989 H2 SOL 2295 11.540 54.090 68.270 1.00 0.00 ATOM 21990 OH2 SOL 2296 25.710 46.330 83.100 1.00 0.00 ATOM 21991 H1 SOL 2296 25.380 45.940 82.290 1.00 0.00 ATOM 21992 H2 SOL 2296 25.110 47.050 83.290 1.00 0.00 ATOM 21993 OH2 SOL 2297 38.890 26.810 79.470 1.00 0.00 ATOM 21994 H1 SOL 2297 39.110 26.420 80.310 1.00 0.00 ATOM 21995 H2 SOL 2297 39.700 27.250 79.190 1.00 0.00 ATOM 21996 OH2 SOL 2298 12.430 28.280 69.610 1.00 0.00 ATOM 21997 H1 SOL 2298 12.320 27.510 70.160 1.00 0.00 ATOM 21998 H2 SOL 2298 11.640 28.810 69.760 1.00 0.00 ATOM 21999 OH2 SOL 2299 19.740 37.150 9.400 1.00 0.00 ATOM 22000 H1 SOL 2299 18.820 37.390 9.340 1.00 0.00 ATOM 22001 H2 SOL 2299 20.210 37.980 9.490 1.00 0.00 ATOM 22002 OH2 SOL 2300 0.520 20.230 83.260 1.00 0.00 ATOM 22003 H1 SOL 2300 1.040 19.870 82.550 1.00 0.00 ATOM 22004 H2 SOL 2300 -0.370 19.910 83.110 1.00 0.00 ATOM 22005 OH2 SOL 2301 18.330 18.720 11.920 1.00 0.00 ATOM 22006 H1 SOL 2301 17.390 18.550 11.880 1.00 0.00 ATOM 22007 H2 SOL 2301 18.660 18.080 12.550 1.00 0.00 ATOM 22008 OH2 SOL 2302 21.440 -0.060 8.060 1.00 0.00 ATOM 22009 H1 SOL 2302 20.670 0.200 7.560 1.00 0.00 ATOM 22010 H2 SOL 2302 21.990 0.730 8.090 1.00 0.00 ATOM 22011 OH2 SOL 2303 51.780 17.010 2.720 1.00 0.00 ATOM 22012 H1 SOL 2303 51.440 16.160 3.010 1.00 0.00 ATOM 22013 H2 SOL 2303 51.380 17.160 1.870 1.00 0.00 ATOM 22014 OH2 SOL 2304 17.840 54.630 73.980 1.00 0.00 ATOM 22015 H1 SOL 2304 17.320 55.430 73.920 1.00 0.00 ATOM 22016 H2 SOL 2304 17.230 53.930 73.760 1.00 0.00 ATOM 22017 OH2 SOL 2305 37.790 23.440 81.350 1.00 0.00 ATOM 22018 H1 SOL 2305 37.890 24.030 82.100 1.00 0.00 ATOM 22019 H2 SOL 2305 38.070 22.580 81.680 1.00 0.00 ATOM 22020 OH2 SOL 2306 6.850 17.230 7.710 1.00 0.00 ATOM 22021 H1 SOL 2306 6.860 17.400 8.650 1.00 0.00 ATOM 22022 H2 SOL 2306 7.430 17.900 7.340 1.00 0.00 ATOM 22023 OH2 SOL 2307 4.990 54.170 69.270 1.00 0.00 ATOM 22024 H1 SOL 2307 5.220 54.420 70.170 1.00 0.00 ATOM 22025 H2 SOL 2307 5.670 53.560 69.010 1.00 0.00 ATOM 22026 OH2 SOL 2308 11.040 14.010 5.380 1.00 0.00 ATOM 22027 H1 SOL 2308 11.680 13.310 5.560 1.00 0.00 ATOM 22028 H2 SOL 2308 11.400 14.780 5.830 1.00 0.00 ATOM 22029 OH2 SOL 2309 43.280 4.190 69.730 1.00 0.00 ATOM 22030 H1 SOL 2309 43.800 4.930 70.030 1.00 0.00 ATOM 22031 H2 SOL 2309 43.430 3.500 70.370 1.00 0.00 ATOM 22032 OH2 SOL 2310 33.360 58.770 9.550 1.00 0.00 ATOM 22033 H1 SOL 2310 32.660 58.870 10.200 1.00 0.00 ATOM 22034 H2 SOL 2310 34.170 58.740 10.070 1.00 0.00 ATOM 22035 OH2 SOL 2311 36.850 49.810 20.590 1.00 0.00 ATOM 22036 H1 SOL 2311 36.200 49.360 21.130 1.00 0.00 ATOM 22037 H2 SOL 2311 37.600 49.220 20.580 1.00 0.00 ATOM 22038 OH2 SOL 2312 12.460 22.300 78.650 1.00 0.00 ATOM 22039 H1 SOL 2312 12.960 22.960 79.140 1.00 0.00 ATOM 22040 H2 SOL 2312 12.750 21.470 79.010 1.00 0.00 ATOM 22041 OH2 SOL 2313 4.870 50.250 9.840 1.00 0.00 ATOM 22042 H1 SOL 2313 5.290 50.090 10.690 1.00 0.00 ATOM 22043 H2 SOL 2313 4.080 49.700 9.860 1.00 0.00 ATOM 22044 OH2 SOL 2314 26.490 30.940 21.770 1.00 0.00 ATOM 22045 H1 SOL 2314 26.980 30.140 21.560 1.00 0.00 ATOM 22046 H2 SOL 2314 26.900 31.270 22.560 1.00 0.00 ATOM 22047 OH2 SOL 2315 38.070 18.430 14.690 1.00 0.00 ATOM 22048 H1 SOL 2315 38.780 17.890 14.370 1.00 0.00 ATOM 22049 H2 SOL 2315 37.500 18.560 13.930 1.00 0.00 ATOM 22050 OH2 SOL 2316 34.770 36.500 83.770 1.00 0.00 ATOM 22051 H1 SOL 2316 35.140 36.680 84.640 1.00 0.00 ATOM 22052 H2 SOL 2316 35.470 36.040 83.300 1.00 0.00 ATOM 22053 OH2 SOL 2317 14.780 37.390 10.830 1.00 0.00 ATOM 22054 H1 SOL 2317 14.200 37.390 11.590 1.00 0.00 ATOM 22055 H2 SOL 2317 14.820 36.480 10.560 1.00 0.00 ATOM 22056 OH2 SOL 2318 14.470 4.490 82.730 1.00 0.00 ATOM 22057 H1 SOL 2318 14.310 4.340 83.660 1.00 0.00 ATOM 22058 H2 SOL 2318 13.600 4.610 82.350 1.00 0.00 ATOM 22059 OH2 SOL 2319 25.780 10.140 61.630 1.00 0.00 ATOM 22060 H1 SOL 2319 26.190 10.990 61.820 1.00 0.00 ATOM 22061 H2 SOL 2319 26.520 9.530 61.560 1.00 0.00 ATOM 22062 OH2 SOL 2320 23.770 19.540 71.590 1.00 0.00 ATOM 22063 H1 SOL 2320 23.530 20.450 71.400 1.00 0.00 ATOM 22064 H2 SOL 2320 24.150 19.580 72.470 1.00 0.00 ATOM 22065 OH2 SOL 2321 2.900 36.180 5.960 1.00 0.00 ATOM 22066 H1 SOL 2321 3.730 36.280 6.430 1.00 0.00 ATOM 22067 H2 SOL 2321 2.690 35.250 6.050 1.00 0.00 ATOM 22068 OH2 SOL 2322 6.270 41.810 81.380 1.00 0.00 ATOM 22069 H1 SOL 2322 5.660 41.080 81.470 1.00 0.00 ATOM 22070 H2 SOL 2322 7.140 41.420 81.500 1.00 0.00 ATOM 22071 OH2 SOL 2323 28.240 58.980 21.990 1.00 0.00 ATOM 22072 H1 SOL 2323 28.910 58.540 22.520 1.00 0.00 ATOM 22073 H2 SOL 2323 28.470 59.910 22.040 1.00 0.00 ATOM 22074 OH2 SOL 2324 24.540 25.000 60.760 1.00 0.00 ATOM 22075 H1 SOL 2324 24.370 25.650 60.080 1.00 0.00 ATOM 22076 H2 SOL 2324 24.820 24.220 60.280 1.00 0.00 ATOM 22077 OH2 SOL 2325 28.650 23.390 11.580 1.00 0.00 ATOM 22078 H1 SOL 2325 27.920 23.300 10.960 1.00 0.00 ATOM 22079 H2 SOL 2325 28.760 22.510 11.950 1.00 0.00 ATOM 22080 OH2 SOL 2326 32.970 35.210 17.290 1.00 0.00 ATOM 22081 H1 SOL 2326 32.930 34.400 16.790 1.00 0.00 ATOM 22082 H2 SOL 2326 32.970 35.910 16.640 1.00 0.00 ATOM 22083 OH2 SOL 2327 27.400 36.190 0.220 1.00 0.00 ATOM 22084 H1 SOL 2327 27.140 36.160 1.140 1.00 0.00 ATOM 22085 H2 SOL 2327 28.200 36.710 0.220 1.00 0.00 ATOM 22086 OH2 SOL 2328 28.660 19.540 72.290 1.00 0.00 ATOM 22087 H1 SOL 2328 29.330 19.630 72.960 1.00 0.00 ATOM 22088 H2 SOL 2328 27.980 19.000 72.690 1.00 0.00 ATOM 22089 OH2 SOL 2329 57.250 21.840 2.620 1.00 0.00 ATOM 22090 H1 SOL 2329 57.350 20.920 2.410 1.00 0.00 ATOM 22091 H2 SOL 2329 56.330 21.930 2.870 1.00 0.00 ATOM 22092 OH2 SOL 2330 48.680 23.890 11.460 1.00 0.00 ATOM 22093 H1 SOL 2330 48.310 23.070 11.130 1.00 0.00 ATOM 22094 H2 SOL 2330 47.920 24.450 11.620 1.00 0.00 ATOM 22095 OH2 SOL 2331 47.480 29.180 78.350 1.00 0.00 ATOM 22096 H1 SOL 2331 46.940 29.790 77.840 1.00 0.00 ATOM 22097 H2 SOL 2331 47.020 28.340 78.300 1.00 0.00 ATOM 22098 OH2 SOL 2332 16.920 51.010 75.190 1.00 0.00 ATOM 22099 H1 SOL 2332 16.660 51.740 74.630 1.00 0.00 ATOM 22100 H2 SOL 2332 17.470 51.410 75.870 1.00 0.00 ATOM 22101 OH2 SOL 2333 27.170 57.480 65.020 1.00 0.00 ATOM 22102 H1 SOL 2333 26.650 56.680 65.140 1.00 0.00 ATOM 22103 H2 SOL 2333 26.620 58.050 64.490 1.00 0.00 ATOM 22104 OH2 SOL 2334 34.950 33.190 73.900 1.00 0.00 ATOM 22105 H1 SOL 2334 35.570 32.650 73.410 1.00 0.00 ATOM 22106 H2 SOL 2334 34.520 33.730 73.240 1.00 0.00 ATOM 22107 OH2 SOL 2335 9.070 6.040 1.630 1.00 0.00 ATOM 22108 H1 SOL 2335 9.570 6.610 2.200 1.00 0.00 ATOM 22109 H2 SOL 2335 8.710 5.370 2.210 1.00 0.00 ATOM 22110 OH2 SOL 2336 43.160 13.830 2.400 1.00 0.00 ATOM 22111 H1 SOL 2336 43.180 13.510 1.500 1.00 0.00 ATOM 22112 H2 SOL 2336 42.270 13.670 2.700 1.00 0.00 ATOM 22113 OH2 SOL 2337 13.750 19.230 2.960 1.00 0.00 ATOM 22114 H1 SOL 2337 14.020 19.080 2.050 1.00 0.00 ATOM 22115 H2 SOL 2337 13.730 20.190 3.040 1.00 0.00 ATOM 22116 OH2 SOL 2338 44.870 45.500 61.870 1.00 0.00 ATOM 22117 H1 SOL 2338 45.670 46.010 61.880 1.00 0.00 ATOM 22118 H2 SOL 2338 44.190 46.110 61.580 1.00 0.00 ATOM 22119 OH2 SOL 2339 35.600 -0.230 73.710 1.00 0.00 ATOM 22120 H1 SOL 2339 34.920 -0.190 74.380 1.00 0.00 ATOM 22121 H2 SOL 2339 35.600 0.640 73.310 1.00 0.00 ATOM 22122 OH2 SOL 2340 17.020 9.280 69.990 1.00 0.00 ATOM 22123 H1 SOL 2340 17.290 9.210 69.070 1.00 0.00 ATOM 22124 H2 SOL 2340 17.820 9.110 70.480 1.00 0.00 ATOM 22125 OH2 SOL 2341 2.020 11.450 13.910 1.00 0.00 ATOM 22126 H1 SOL 2341 2.210 10.560 13.600 1.00 0.00 ATOM 22127 H2 SOL 2341 2.550 12.010 13.340 1.00 0.00 ATOM 22128 OH2 SOL 2342 31.840 8.980 66.430 1.00 0.00 ATOM 22129 H1 SOL 2342 31.740 8.040 66.610 1.00 0.00 ATOM 22130 H2 SOL 2342 31.160 9.160 65.780 1.00 0.00 ATOM 22131 OH2 SOL 2343 5.320 38.010 75.700 1.00 0.00 ATOM 22132 H1 SOL 2343 6.180 38.400 75.570 1.00 0.00 ATOM 22133 H2 SOL 2343 5.340 37.210 75.180 1.00 0.00 ATOM 22134 OH2 SOL 2344 42.530 -0.040 82.600 1.00 0.00 ATOM 22135 H1 SOL 2344 43.360 -0.170 82.140 1.00 0.00 ATOM 22136 H2 SOL 2344 42.670 0.750 83.120 1.00 0.00 ATOM 22137 OH2 SOL 2345 49.990 21.570 59.700 1.00 0.00 ATOM 22138 H1 SOL 2345 50.330 20.820 60.180 1.00 0.00 ATOM 22139 H2 SOL 2345 49.230 21.860 60.210 1.00 0.00 ATOM 22140 OH2 SOL 2346 31.250 48.840 10.330 1.00 0.00 ATOM 22141 H1 SOL 2346 31.060 49.630 9.830 1.00 0.00 ATOM 22142 H2 SOL 2346 31.280 49.130 11.240 1.00 0.00 ATOM 22143 OH2 SOL 2347 42.900 29.750 72.190 1.00 0.00 ATOM 22144 H1 SOL 2347 42.310 29.510 71.470 1.00 0.00 ATOM 22145 H2 SOL 2347 43.770 29.750 71.780 1.00 0.00 ATOM 22146 OH2 SOL 2348 22.120 57.210 0.230 1.00 0.00 ATOM 22147 H1 SOL 2348 21.760 57.550 1.050 1.00 0.00 ATOM 22148 H2 SOL 2348 23.060 57.150 0.390 1.00 0.00 ATOM 22149 OH2 SOL 2349 16.170 0.600 6.900 1.00 0.00 ATOM 22150 H1 SOL 2349 15.560 1.220 6.500 1.00 0.00 ATOM 22151 H2 SOL 2349 15.630 0.040 7.450 1.00 0.00 ATOM 22152 OH2 SOL 2350 29.170 32.360 71.280 1.00 0.00 ATOM 22153 H1 SOL 2350 29.880 32.230 70.660 1.00 0.00 ATOM 22154 H2 SOL 2350 29.600 32.600 72.090 1.00 0.00 ATOM 22155 OH2 SOL 2351 1.490 51.280 74.450 1.00 0.00 ATOM 22156 H1 SOL 2351 1.280 51.590 73.570 1.00 0.00 ATOM 22157 H2 SOL 2351 1.890 52.040 74.880 1.00 0.00 ATOM 22158 OH2 SOL 2352 21.500 32.400 11.140 1.00 0.00 ATOM 22159 H1 SOL 2352 21.370 33.250 10.730 1.00 0.00 ATOM 22160 H2 SOL 2352 22.300 32.510 11.660 1.00 0.00 ATOM 22161 OH2 SOL 2353 30.560 52.330 3.690 1.00 0.00 ATOM 22162 H1 SOL 2353 30.080 51.640 3.240 1.00 0.00 ATOM 22163 H2 SOL 2353 30.820 52.940 3.000 1.00 0.00 ATOM 22164 OH2 SOL 2354 33.060 4.900 15.120 1.00 0.00 ATOM 22165 H1 SOL 2354 33.410 5.580 15.690 1.00 0.00 ATOM 22166 H2 SOL 2354 32.860 5.350 14.300 1.00 0.00 ATOM 22167 OH2 SOL 2355 25.250 50.480 4.070 1.00 0.00 ATOM 22168 H1 SOL 2355 25.120 50.400 3.130 1.00 0.00 ATOM 22169 H2 SOL 2355 25.480 49.590 4.350 1.00 0.00 ATOM 22170 OH2 SOL 2356 5.030 46.760 76.590 1.00 0.00 ATOM 22171 H1 SOL 2356 5.040 47.430 77.280 1.00 0.00 ATOM 22172 H2 SOL 2356 4.440 47.110 75.930 1.00 0.00 ATOM 22173 OH2 SOL 2357 50.630 45.950 73.540 1.00 0.00 ATOM 22174 H1 SOL 2357 51.270 46.650 73.480 1.00 0.00 ATOM 22175 H2 SOL 2357 50.240 45.890 72.660 1.00 0.00 ATOM 22176 OH2 SOL 2358 32.450 30.680 80.160 1.00 0.00 ATOM 22177 H1 SOL 2358 33.080 30.680 80.890 1.00 0.00 ATOM 22178 H2 SOL 2358 32.960 30.360 79.410 1.00 0.00 ATOM 22179 OH2 SOL 2359 58.710 50.070 82.550 1.00 0.00 ATOM 22180 H1 SOL 2359 58.620 50.060 83.500 1.00 0.00 ATOM 22181 H2 SOL 2359 58.490 50.960 82.290 1.00 0.00 ATOM 22182 OH2 SOL 2360 50.700 52.330 5.930 1.00 0.00 ATOM 22183 H1 SOL 2360 51.580 52.260 6.280 1.00 0.00 ATOM 22184 H2 SOL 2360 50.130 52.380 6.700 1.00 0.00 ATOM 22185 OH2 SOL 2361 26.460 12.130 70.850 1.00 0.00 ATOM 22186 H1 SOL 2361 25.830 11.720 70.260 1.00 0.00 ATOM 22187 H2 SOL 2361 26.750 11.430 71.430 1.00 0.00 ATOM 22188 OH2 SOL 2362 33.600 4.040 22.050 1.00 0.00 ATOM 22189 H1 SOL 2362 33.260 4.380 21.230 1.00 0.00 ATOM 22190 H2 SOL 2362 33.880 3.150 21.860 1.00 0.00 ATOM 22191 OH2 SOL 2363 46.000 31.110 76.530 1.00 0.00 ATOM 22192 H1 SOL 2363 45.130 31.510 76.490 1.00 0.00 ATOM 22193 H2 SOL 2363 46.600 31.860 76.570 1.00 0.00 ATOM 22194 OH2 SOL 2364 43.870 54.820 5.870 1.00 0.00 ATOM 22195 H1 SOL 2364 43.390 55.340 5.220 1.00 0.00 ATOM 22196 H2 SOL 2364 43.430 53.970 5.870 1.00 0.00 ATOM 22197 OH2 SOL 2365 36.820 18.960 6.890 1.00 0.00 ATOM 22198 H1 SOL 2365 36.300 19.670 7.240 1.00 0.00 ATOM 22199 H2 SOL 2365 36.930 18.360 7.630 1.00 0.00 ATOM 22200 OH2 SOL 2366 27.120 27.820 10.390 1.00 0.00 ATOM 22201 H1 SOL 2366 27.480 28.510 9.830 1.00 0.00 ATOM 22202 H2 SOL 2366 27.700 27.070 10.250 1.00 0.00 ATOM 22203 OH2 SOL 2367 13.680 21.230 7.360 1.00 0.00 ATOM 22204 H1 SOL 2367 13.050 21.730 6.850 1.00 0.00 ATOM 22205 H2 SOL 2367 13.540 21.510 8.260 1.00 0.00 ATOM 22206 OH2 SOL 2368 7.580 43.520 2.540 1.00 0.00 ATOM 22207 H1 SOL 2368 7.020 43.750 1.800 1.00 0.00 ATOM 22208 H2 SOL 2368 8.450 43.410 2.160 1.00 0.00 ATOM 22209 OH2 SOL 2369 15.960 25.610 77.190 1.00 0.00 ATOM 22210 H1 SOL 2369 15.290 25.740 77.870 1.00 0.00 ATOM 22211 H2 SOL 2369 15.530 25.890 76.380 1.00 0.00 ATOM 22212 OH2 SOL 2370 38.630 6.990 73.380 1.00 0.00 ATOM 22213 H1 SOL 2370 39.450 7.220 73.810 1.00 0.00 ATOM 22214 H2 SOL 2370 38.230 7.820 73.140 1.00 0.00 ATOM 22215 OH2 SOL 2371 10.860 6.840 4.000 1.00 0.00 ATOM 22216 H1 SOL 2371 10.770 6.070 3.440 1.00 0.00 ATOM 22217 H2 SOL 2371 11.490 6.580 4.670 1.00 0.00 ATOM 22218 OH2 SOL 2372 6.670 10.220 81.510 1.00 0.00 ATOM 22219 H1 SOL 2372 7.540 10.020 81.850 1.00 0.00 ATOM 22220 H2 SOL 2372 6.760 10.110 80.560 1.00 0.00 ATOM 22221 OH2 SOL 2373 3.290 52.480 71.330 1.00 0.00 ATOM 22222 H1 SOL 2373 3.500 52.850 72.190 1.00 0.00 ATOM 22223 H2 SOL 2373 3.810 53.000 70.720 1.00 0.00 ATOM 22224 OH2 SOL 2374 45.780 36.980 74.040 1.00 0.00 ATOM 22225 H1 SOL 2374 46.570 37.200 74.540 1.00 0.00 ATOM 22226 H2 SOL 2374 45.200 36.570 74.680 1.00 0.00 ATOM 22227 OH2 SOL 2375 8.590 2.530 15.940 1.00 0.00 ATOM 22228 H1 SOL 2375 8.160 3.080 16.590 1.00 0.00 ATOM 22229 H2 SOL 2375 8.250 1.650 16.100 1.00 0.00 ATOM 22230 OH2 SOL 2376 9.990 24.660 83.540 1.00 0.00 ATOM 22231 H1 SOL 2376 9.950 24.630 82.580 1.00 0.00 ATOM 22232 H2 SOL 2376 9.490 25.440 83.770 1.00 0.00 ATOM 22233 OH2 SOL 2377 59.270 8.630 14.470 1.00 0.00 ATOM 22234 H1 SOL 2377 59.630 8.140 15.210 1.00 0.00 ATOM 22235 H2 SOL 2377 60.030 8.820 13.920 1.00 0.00 ATOM 22236 OH2 SOL 2378 48.220 34.630 1.350 1.00 0.00 ATOM 22237 H1 SOL 2378 48.830 34.200 0.750 1.00 0.00 ATOM 22238 H2 SOL 2378 48.540 35.530 1.400 1.00 0.00 ATOM 22239 OH2 SOL 2379 0.240 30.390 3.100 1.00 0.00 ATOM 22240 H1 SOL 2379 0.730 29.830 2.500 1.00 0.00 ATOM 22241 H2 SOL 2379 0.060 31.180 2.590 1.00 0.00 ATOM 22242 OH2 SOL 2380 35.420 12.170 22.860 1.00 0.00 ATOM 22243 H1 SOL 2380 35.440 12.760 22.110 1.00 0.00 ATOM 22244 H2 SOL 2380 35.970 11.430 22.600 1.00 0.00 ATOM 22245 OH2 SOL 2381 45.580 36.430 8.460 1.00 0.00 ATOM 22246 H1 SOL 2381 45.070 37.180 8.770 1.00 0.00 ATOM 22247 H2 SOL 2381 46.260 36.310 9.130 1.00 0.00 ATOM 22248 OH2 SOL 2382 46.470 20.260 3.150 1.00 0.00 ATOM 22249 H1 SOL 2382 45.940 19.620 2.660 1.00 0.00 ATOM 22250 H2 SOL 2382 47.060 19.730 3.670 1.00 0.00 ATOM 22251 OH2 SOL 2383 31.300 8.400 75.850 1.00 0.00 ATOM 22252 H1 SOL 2383 31.730 8.180 75.020 1.00 0.00 ATOM 22253 H2 SOL 2383 31.110 7.550 76.250 1.00 0.00 ATOM 22254 OH2 SOL 2384 45.400 8.370 5.750 1.00 0.00 ATOM 22255 H1 SOL 2384 45.130 9.240 6.050 1.00 0.00 ATOM 22256 H2 SOL 2384 45.820 7.970 6.510 1.00 0.00 ATOM 22257 OH2 SOL 2385 12.270 24.110 12.660 1.00 0.00 ATOM 22258 H1 SOL 2385 12.960 23.730 13.200 1.00 0.00 ATOM 22259 H2 SOL 2385 11.840 23.350 12.260 1.00 0.00 ATOM 22260 OH2 SOL 2386 31.540 20.270 65.030 1.00 0.00 ATOM 22261 H1 SOL 2386 31.900 19.560 64.490 1.00 0.00 ATOM 22262 H2 SOL 2386 31.480 21.020 64.440 1.00 0.00 ATOM 22263 OH2 SOL 2387 42.960 41.490 83.130 1.00 0.00 ATOM 22264 H1 SOL 2387 42.010 41.600 83.020 1.00 0.00 ATOM 22265 H2 SOL 2387 43.060 40.650 83.570 1.00 0.00 ATOM 22266 OH2 SOL 2388 59.340 60.270 76.450 1.00 0.00 ATOM 22267 H1 SOL 2388 58.980 60.120 75.580 1.00 0.00 ATOM 22268 H2 SOL 2388 59.300 61.220 76.560 1.00 0.00 ATOM 22269 OH2 SOL 2389 11.500 15.750 72.390 1.00 0.00 ATOM 22270 H1 SOL 2389 12.340 15.750 71.930 1.00 0.00 ATOM 22271 H2 SOL 2389 11.490 16.580 72.870 1.00 0.00 ATOM 22272 OH2 SOL 2390 6.950 12.830 78.040 1.00 0.00 ATOM 22273 H1 SOL 2390 6.000 12.760 78.020 1.00 0.00 ATOM 22274 H2 SOL 2390 7.250 11.930 78.220 1.00 0.00 ATOM 22275 OH2 SOL 2391 17.350 19.380 76.520 1.00 0.00 ATOM 22276 H1 SOL 2391 17.690 18.650 77.030 1.00 0.00 ATOM 22277 H2 SOL 2391 18.010 20.070 76.620 1.00 0.00 ATOM 22278 OH2 SOL 2392 55.920 37.680 80.190 1.00 0.00 ATOM 22279 H1 SOL 2392 55.090 37.360 80.540 1.00 0.00 ATOM 22280 H2 SOL 2392 56.420 36.880 79.980 1.00 0.00 ATOM 22281 OH2 SOL 2393 24.330 3.980 11.480 1.00 0.00 ATOM 22282 H1 SOL 2393 24.460 4.310 10.590 1.00 0.00 ATOM 22283 H2 SOL 2393 23.540 3.440 11.420 1.00 0.00 ATOM 22284 OH2 SOL 2394 29.740 11.870 11.770 1.00 0.00 ATOM 22285 H1 SOL 2394 30.530 11.780 11.230 1.00 0.00 ATOM 22286 H2 SOL 2394 30.060 12.100 12.640 1.00 0.00 ATOM 22287 OH2 SOL 2395 20.820 16.190 24.580 1.00 0.00 ATOM 22288 H1 SOL 2395 21.750 16.330 24.410 1.00 0.00 ATOM 22289 H2 SOL 2395 20.660 15.290 24.300 1.00 0.00 ATOM 22290 OH2 SOL 2396 14.310 38.310 15.120 1.00 0.00 ATOM 22291 H1 SOL 2396 13.890 38.500 15.960 1.00 0.00 ATOM 22292 H2 SOL 2396 13.610 38.400 14.470 1.00 0.00 ATOM 22293 OH2 SOL 2397 18.280 50.130 80.070 1.00 0.00 ATOM 22294 H1 SOL 2397 17.970 49.540 79.380 1.00 0.00 ATOM 22295 H2 SOL 2397 17.690 50.880 80.030 1.00 0.00 ATOM 22296 OH2 SOL 2398 18.520 28.950 79.260 1.00 0.00 ATOM 22297 H1 SOL 2398 18.220 28.630 80.110 1.00 0.00 ATOM 22298 H2 SOL 2398 19.450 28.730 79.230 1.00 0.00 ATOM 22299 OH2 SOL 2399 43.830 23.020 18.630 1.00 0.00 ATOM 22300 H1 SOL 2399 44.080 23.200 19.540 1.00 0.00 ATOM 22301 H2 SOL 2399 44.260 22.180 18.440 1.00 0.00 ATOM 22302 OH2 SOL 2400 1.840 12.010 6.660 1.00 0.00 ATOM 22303 H1 SOL 2400 1.280 12.020 5.880 1.00 0.00 ATOM 22304 H2 SOL 2400 1.340 12.500 7.310 1.00 0.00 ATOM 22305 OH2 SOL 2401 52.550 1.530 11.620 1.00 0.00 ATOM 22306 H1 SOL 2401 52.490 2.420 11.970 1.00 0.00 ATOM 22307 H2 SOL 2401 53.270 1.130 12.110 1.00 0.00 ATOM 22308 OH2 SOL 2402 4.230 33.190 3.990 1.00 0.00 ATOM 22309 H1 SOL 2402 3.530 33.290 4.640 1.00 0.00 ATOM 22310 H2 SOL 2402 4.150 32.280 3.700 1.00 0.00 ATOM 22311 OH2 SOL 2403 7.210 20.810 64.130 1.00 0.00 ATOM 22312 H1 SOL 2403 7.930 20.190 63.980 1.00 0.00 ATOM 22313 H2 SOL 2403 6.420 20.270 64.060 1.00 0.00 ATOM 22314 OH2 SOL 2404 8.490 23.890 69.190 1.00 0.00 ATOM 22315 H1 SOL 2404 8.450 24.800 69.490 1.00 0.00 ATOM 22316 H2 SOL 2404 7.840 23.430 69.730 1.00 0.00 ATOM 22317 OH2 SOL 2405 33.940 39.210 73.450 1.00 0.00 ATOM 22318 H1 SOL 2405 33.080 39.490 73.140 1.00 0.00 ATOM 22319 H2 SOL 2405 34.040 39.610 74.310 1.00 0.00 ATOM 22320 OH2 SOL 2406 49.030 58.340 73.820 1.00 0.00 ATOM 22321 H1 SOL 2406 48.080 58.240 73.920 1.00 0.00 ATOM 22322 H2 SOL 2406 49.200 58.090 72.910 1.00 0.00 ATOM 22323 OH2 SOL 2407 17.410 58.870 9.840 1.00 0.00 ATOM 22324 H1 SOL 2407 17.060 59.760 9.920 1.00 0.00 ATOM 22325 H2 SOL 2407 16.750 58.320 10.260 1.00 0.00 ATOM 22326 OH2 SOL 2408 48.350 38.480 63.490 1.00 0.00 ATOM 22327 H1 SOL 2408 48.320 39.230 64.080 1.00 0.00 ATOM 22328 H2 SOL 2408 49.260 38.440 63.200 1.00 0.00 ATOM 22329 OH2 SOL 2409 28.540 46.470 79.820 1.00 0.00 ATOM 22330 H1 SOL 2409 28.620 47.360 79.480 1.00 0.00 ATOM 22331 H2 SOL 2409 28.860 45.910 79.120 1.00 0.00 ATOM 22332 OH2 SOL 2410 57.210 34.400 8.280 1.00 0.00 ATOM 22333 H1 SOL 2410 56.990 34.510 7.350 1.00 0.00 ATOM 22334 H2 SOL 2410 57.970 33.820 8.270 1.00 0.00 ATOM 22335 OH2 SOL 2411 58.320 50.130 6.840 1.00 0.00 ATOM 22336 H1 SOL 2411 58.480 49.680 6.010 1.00 0.00 ATOM 22337 H2 SOL 2411 58.850 49.650 7.480 1.00 0.00 ATOM 22338 OH2 SOL 2412 6.340 10.540 63.930 1.00 0.00 ATOM 22339 H1 SOL 2412 6.050 9.780 63.430 1.00 0.00 ATOM 22340 H2 SOL 2412 7.230 10.710 63.610 1.00 0.00 ATOM 22341 OH2 SOL 2413 37.220 14.110 65.800 1.00 0.00 ATOM 22342 H1 SOL 2413 36.290 14.190 65.580 1.00 0.00 ATOM 22343 H2 SOL 2413 37.240 13.500 66.530 1.00 0.00 ATOM 22344 OH2 SOL 2414 17.830 18.610 84.710 1.00 0.00 ATOM 22345 H1 SOL 2414 16.960 18.450 85.080 1.00 0.00 ATOM 22346 H2 SOL 2414 17.720 18.440 83.770 1.00 0.00 ATOM 22347 OH2 SOL 2415 42.050 7.190 9.140 1.00 0.00 ATOM 22348 H1 SOL 2415 42.890 7.630 9.280 1.00 0.00 ATOM 22349 H2 SOL 2415 42.280 6.280 8.970 1.00 0.00 ATOM 22350 OH2 SOL 2416 33.620 4.810 71.060 1.00 0.00 ATOM 22351 H1 SOL 2416 33.360 5.580 71.580 1.00 0.00 ATOM 22352 H2 SOL 2416 33.780 5.160 70.190 1.00 0.00 ATOM 22353 OH2 SOL 2417 5.920 56.120 6.120 1.00 0.00 ATOM 22354 H1 SOL 2417 5.520 56.500 5.340 1.00 0.00 ATOM 22355 H2 SOL 2417 5.210 55.620 6.530 1.00 0.00 ATOM 22356 OH2 SOL 2418 53.500 13.260 8.010 1.00 0.00 ATOM 22357 H1 SOL 2418 53.410 14.110 7.570 1.00 0.00 ATOM 22358 H2 SOL 2418 53.610 12.640 7.290 1.00 0.00 ATOM 22359 OH2 SOL 2419 21.960 36.120 83.460 1.00 0.00 ATOM 22360 H1 SOL 2419 22.020 35.540 84.210 1.00 0.00 ATOM 22361 H2 SOL 2419 21.540 35.600 82.780 1.00 0.00 ATOM 22362 OH2 SOL 2420 54.000 29.510 14.240 1.00 0.00 ATOM 22363 H1 SOL 2420 54.450 30.290 14.550 1.00 0.00 ATOM 22364 H2 SOL 2420 54.000 29.600 13.290 1.00 0.00 ATOM 22365 OH2 SOL 2421 25.110 52.560 20.460 1.00 0.00 ATOM 22366 H1 SOL 2421 25.650 52.400 21.230 1.00 0.00 ATOM 22367 H2 SOL 2421 25.390 53.420 20.140 1.00 0.00 ATOM 22368 OH2 SOL 2422 32.240 2.020 10.350 1.00 0.00 ATOM 22369 H1 SOL 2422 32.600 1.480 9.640 1.00 0.00 ATOM 22370 H2 SOL 2422 31.310 1.820 10.360 1.00 0.00 ATOM 22371 OH2 SOL 2423 45.580 5.600 68.020 1.00 0.00 ATOM 22372 H1 SOL 2423 45.000 6.360 68.060 1.00 0.00 ATOM 22373 H2 SOL 2423 46.130 5.760 67.260 1.00 0.00 ATOM 22374 OH2 SOL 2424 12.900 54.680 83.810 1.00 0.00 ATOM 22375 H1 SOL 2424 12.020 54.300 83.860 1.00 0.00 ATOM 22376 H2 SOL 2424 13.020 54.880 82.890 1.00 0.00 ATOM 22377 OH2 SOL 2425 40.850 19.630 71.480 1.00 0.00 ATOM 22378 H1 SOL 2425 40.190 18.930 71.430 1.00 0.00 ATOM 22379 H2 SOL 2425 40.360 20.400 71.750 1.00 0.00 ATOM 22380 OH2 SOL 2426 51.150 43.090 72.100 1.00 0.00 ATOM 22381 H1 SOL 2426 52.080 43.210 71.900 1.00 0.00 ATOM 22382 H2 SOL 2426 50.700 43.780 71.620 1.00 0.00 ATOM 22383 OH2 SOL 2427 26.030 -0.190 56.520 1.00 0.00 ATOM 22384 H1 SOL 2427 26.020 0.640 56.040 1.00 0.00 ATOM 22385 H2 SOL 2427 26.860 -0.180 57.000 1.00 0.00 ATOM 22386 OH2 SOL 2428 20.210 54.990 72.990 1.00 0.00 ATOM 22387 H1 SOL 2428 20.640 55.060 73.850 1.00 0.00 ATOM 22388 H2 SOL 2428 19.320 54.710 73.200 1.00 0.00 ATOM 22389 OH2 SOL 2429 41.390 7.820 54.160 1.00 0.00 ATOM 22390 H1 SOL 2429 40.650 7.240 54.340 1.00 0.00 ATOM 22391 H2 SOL 2429 42.160 7.280 54.300 1.00 0.00 ATOM 22392 OH2 SOL 2430 11.110 1.890 68.670 1.00 0.00 ATOM 22393 H1 SOL 2430 10.400 1.270 68.860 1.00 0.00 ATOM 22394 H2 SOL 2430 11.770 1.360 68.220 1.00 0.00 ATOM 22395 OH2 SOL 2431 55.000 34.430 77.850 1.00 0.00 ATOM 22396 H1 SOL 2431 55.090 33.510 77.620 1.00 0.00 ATOM 22397 H2 SOL 2431 54.370 34.440 78.570 1.00 0.00 ATOM 22398 OH2 SOL 2432 54.090 12.710 72.960 1.00 0.00 ATOM 22399 H1 SOL 2432 53.330 12.720 73.540 1.00 0.00 ATOM 22400 H2 SOL 2432 54.030 11.890 72.480 1.00 0.00 ATOM 22401 OH2 SOL 2433 55.410 45.420 76.220 1.00 0.00 ATOM 22402 H1 SOL 2433 54.920 44.740 76.680 1.00 0.00 ATOM 22403 H2 SOL 2433 55.620 46.060 76.910 1.00 0.00 ATOM 22404 OH2 SOL 2434 52.310 23.570 19.430 1.00 0.00 ATOM 22405 H1 SOL 2434 51.590 23.480 18.800 1.00 0.00 ATOM 22406 H2 SOL 2434 52.440 24.520 19.510 1.00 0.00 ATOM 22407 OH2 SOL 2435 49.470 5.340 75.300 1.00 0.00 ATOM 22408 H1 SOL 2435 48.690 5.740 74.910 1.00 0.00 ATOM 22409 H2 SOL 2435 49.320 4.400 75.230 1.00 0.00 ATOM 22410 OH2 SOL 2436 15.420 49.510 73.100 1.00 0.00 ATOM 22411 H1 SOL 2436 15.750 50.330 73.460 1.00 0.00 ATOM 22412 H2 SOL 2436 14.480 49.650 73.020 1.00 0.00 ATOM 22413 OH2 SOL 2437 56.380 43.340 14.030 1.00 0.00 ATOM 22414 H1 SOL 2437 56.740 42.480 13.830 1.00 0.00 ATOM 22415 H2 SOL 2437 56.050 43.260 14.920 1.00 0.00 ATOM 22416 OH2 SOL 2438 45.490 8.130 9.250 1.00 0.00 ATOM 22417 H1 SOL 2438 45.850 8.930 8.870 1.00 0.00 ATOM 22418 H2 SOL 2438 45.730 8.170 10.170 1.00 0.00 ATOM 22419 OH2 SOL 2439 29.160 3.430 69.890 1.00 0.00 ATOM 22420 H1 SOL 2439 28.830 4.290 69.620 1.00 0.00 ATOM 22421 H2 SOL 2439 30.110 3.520 69.860 1.00 0.00 ATOM 22422 OH2 SOL 2440 39.250 60.420 10.890 1.00 0.00 ATOM 22423 H1 SOL 2440 39.730 60.870 11.590 1.00 0.00 ATOM 22424 H2 SOL 2440 39.320 61.010 10.140 1.00 0.00 ATOM 22425 OH2 SOL 2441 3.670 57.930 59.410 1.00 0.00 ATOM 22426 H1 SOL 2441 3.050 57.740 60.110 1.00 0.00 ATOM 22427 H2 SOL 2441 3.820 57.090 58.980 1.00 0.00 ATOM 22428 OH2 SOL 2442 51.170 19.340 32.630 1.00 0.00 ATOM 22429 H1 SOL 2442 50.990 18.420 32.850 1.00 0.00 ATOM 22430 H2 SOL 2442 51.270 19.770 33.480 1.00 0.00 ATOM 22431 OH2 SOL 2443 24.720 31.790 0.130 1.00 0.00 ATOM 22432 H1 SOL 2443 25.460 31.420 -0.360 1.00 0.00 ATOM 22433 H2 SOL 2443 24.540 31.130 0.800 1.00 0.00 ATOM 22434 OH2 SOL 2444 37.140 25.270 0.880 1.00 0.00 ATOM 22435 H1 SOL 2444 37.190 25.900 1.600 1.00 0.00 ATOM 22436 H2 SOL 2444 37.270 24.420 1.290 1.00 0.00 ATOM 22437 OH2 SOL 2445 30.210 48.240 78.320 1.00 0.00 ATOM 22438 H1 SOL 2445 30.480 48.530 77.450 1.00 0.00 ATOM 22439 H2 SOL 2445 30.910 48.540 78.900 1.00 0.00 ATOM 22440 OH2 SOL 2446 49.270 41.980 17.100 1.00 0.00 ATOM 22441 H1 SOL 2446 49.690 42.830 16.980 1.00 0.00 ATOM 22442 H2 SOL 2446 49.330 41.810 18.040 1.00 0.00 ATOM 22443 OH2 SOL 2447 33.360 24.520 4.700 1.00 0.00 ATOM 22444 H1 SOL 2447 34.310 24.580 4.560 1.00 0.00 ATOM 22445 H2 SOL 2447 33.030 24.110 3.900 1.00 0.00 ATOM 22446 OH2 SOL 2448 28.360 15.050 1.670 1.00 0.00 ATOM 22447 H1 SOL 2448 28.020 14.310 1.160 1.00 0.00 ATOM 22448 H2 SOL 2448 28.540 14.670 2.530 1.00 0.00 ATOM 22449 OH2 SOL 2449 48.560 60.150 4.380 1.00 0.00 ATOM 22450 H1 SOL 2449 49.060 60.370 5.160 1.00 0.00 ATOM 22451 H2 SOL 2449 49.020 60.580 3.670 1.00 0.00 ATOM 22452 OH2 SOL 2450 48.790 7.080 6.740 1.00 0.00 ATOM 22453 H1 SOL 2450 47.890 6.870 7.000 1.00 0.00 ATOM 22454 H2 SOL 2450 48.880 6.690 5.870 1.00 0.00 ATOM 22455 OH2 SOL 2451 24.630 5.790 84.350 1.00 0.00 ATOM 22456 H1 SOL 2451 24.400 5.560 83.450 1.00 0.00 ATOM 22457 H2 SOL 2451 23.820 5.670 84.840 1.00 0.00 ATOM 22458 OH2 SOL 2452 10.320 22.960 14.890 1.00 0.00 ATOM 22459 H1 SOL 2452 11.260 22.890 15.050 1.00 0.00 ATOM 22460 H2 SOL 2452 10.200 22.590 14.010 1.00 0.00 ATOM 22461 OH2 SOL 2453 20.490 52.350 13.330 1.00 0.00 ATOM 22462 H1 SOL 2453 20.250 53.130 13.830 1.00 0.00 ATOM 22463 H2 SOL 2453 21.440 52.280 13.440 1.00 0.00 ATOM 22464 OH2 SOL 2454 16.880 43.220 79.230 1.00 0.00 ATOM 22465 H1 SOL 2454 17.220 43.170 78.340 1.00 0.00 ATOM 22466 H2 SOL 2454 17.210 44.050 79.570 1.00 0.00 ATOM 22467 OH2 SOL 2455 29.730 30.290 80.230 1.00 0.00 ATOM 22468 H1 SOL 2455 29.720 29.330 80.320 1.00 0.00 ATOM 22469 H2 SOL 2455 30.610 30.500 79.920 1.00 0.00 ATOM 22470 OH2 SOL 2456 27.960 2.400 63.000 1.00 0.00 ATOM 22471 H1 SOL 2456 28.300 1.800 62.340 1.00 0.00 ATOM 22472 H2 SOL 2456 28.000 3.260 62.580 1.00 0.00 ATOM 22473 OH2 SOL 2457 1.120 16.900 7.640 1.00 0.00 ATOM 22474 H1 SOL 2457 0.750 16.710 8.500 1.00 0.00 ATOM 22475 H2 SOL 2457 1.230 17.850 7.630 1.00 0.00 ATOM 22476 OH2 SOL 2458 26.990 59.400 8.050 1.00 0.00 ATOM 22477 H1 SOL 2458 27.600 59.650 8.750 1.00 0.00 ATOM 22478 H2 SOL 2458 27.500 58.840 7.480 1.00 0.00 ATOM 22479 OH2 SOL 2459 53.200 41.010 1.460 1.00 0.00 ATOM 22480 H1 SOL 2459 52.690 40.770 0.680 1.00 0.00 ATOM 22481 H2 SOL 2459 52.570 40.940 2.180 1.00 0.00 ATOM 22482 OH2 SOL 2460 21.960 18.610 19.210 1.00 0.00 ATOM 22483 H1 SOL 2460 22.750 18.790 19.700 1.00 0.00 ATOM 22484 H2 SOL 2460 21.260 18.590 19.860 1.00 0.00 ATOM 22485 OH2 SOL 2461 57.370 19.520 1.290 1.00 0.00 ATOM 22486 H1 SOL 2461 57.790 18.700 1.550 1.00 0.00 ATOM 22487 H2 SOL 2461 57.560 19.610 0.360 1.00 0.00 ATOM 22488 OH2 SOL 2462 4.300 32.410 62.470 1.00 0.00 ATOM 22489 H1 SOL 2462 3.810 32.150 63.250 1.00 0.00 ATOM 22490 H2 SOL 2462 5.090 31.860 62.490 1.00 0.00 ATOM 22491 OH2 SOL 2463 58.240 45.490 64.470 1.00 0.00 ATOM 22492 H1 SOL 2463 57.600 45.210 65.120 1.00 0.00 ATOM 22493 H2 SOL 2463 58.910 44.800 64.490 1.00 0.00 ATOM 22494 OH2 SOL 2464 11.730 45.270 13.520 1.00 0.00 ATOM 22495 H1 SOL 2464 11.410 44.390 13.750 1.00 0.00 ATOM 22496 H2 SOL 2464 12.510 45.400 14.060 1.00 0.00 ATOM 22497 OH2 SOL 2465 21.470 1.520 79.940 1.00 0.00 ATOM 22498 H1 SOL 2465 21.480 0.740 79.400 1.00 0.00 ATOM 22499 H2 SOL 2465 20.890 1.300 80.670 1.00 0.00 ATOM 22500 OH2 SOL 2466 55.950 54.410 74.040 1.00 0.00 ATOM 22501 H1 SOL 2466 56.900 54.320 74.140 1.00 0.00 ATOM 22502 H2 SOL 2466 55.770 54.060 73.170 1.00 0.00 ATOM 22503 OH2 SOL 2467 24.590 29.840 2.000 1.00 0.00 ATOM 22504 H1 SOL 2467 24.180 30.190 2.790 1.00 0.00 ATOM 22505 H2 SOL 2467 24.270 28.940 1.940 1.00 0.00 ATOM 22506 OH2 SOL 2468 30.830 48.270 67.910 1.00 0.00 ATOM 22507 H1 SOL 2468 30.750 47.440 68.390 1.00 0.00 ATOM 22508 H2 SOL 2468 30.590 48.050 67.010 1.00 0.00 ATOM 22509 OH2 SOL 2469 6.370 56.510 68.920 1.00 0.00 ATOM 22510 H1 SOL 2469 6.340 56.390 67.970 1.00 0.00 ATOM 22511 H2 SOL 2469 5.860 55.780 69.270 1.00 0.00 ATOM 22512 OH2 SOL 2470 9.070 25.340 59.680 1.00 0.00 ATOM 22513 H1 SOL 2470 9.420 24.940 60.480 1.00 0.00 ATOM 22514 H2 SOL 2470 9.490 26.200 59.640 1.00 0.00 ATOM 22515 OH2 SOL 2471 3.260 56.560 79.240 1.00 0.00 ATOM 22516 H1 SOL 2471 3.420 57.400 79.680 1.00 0.00 ATOM 22517 H2 SOL 2471 2.670 56.090 79.830 1.00 0.00 ATOM 22518 OH2 SOL 2472 44.740 23.880 3.850 1.00 0.00 ATOM 22519 H1 SOL 2472 44.660 24.740 3.450 1.00 0.00 ATOM 22520 H2 SOL 2472 44.680 23.270 3.120 1.00 0.00 ATOM 22521 OH2 SOL 2473 21.570 52.620 72.770 1.00 0.00 ATOM 22522 H1 SOL 2473 21.240 53.400 73.220 1.00 0.00 ATOM 22523 H2 SOL 2473 21.620 52.870 71.850 1.00 0.00 ATOM 22524 OH2 SOL 2474 2.410 24.570 1.350 1.00 0.00 ATOM 22525 H1 SOL 2474 2.320 23.920 0.650 1.00 0.00 ATOM 22526 H2 SOL 2474 2.590 24.060 2.140 1.00 0.00 ATOM 22527 OH2 SOL 2475 36.320 53.610 11.930 1.00 0.00 ATOM 22528 H1 SOL 2475 36.020 53.240 11.100 1.00 0.00 ATOM 22529 H2 SOL 2475 36.330 54.560 11.780 1.00 0.00 ATOM 22530 OH2 SOL 2476 50.040 21.130 26.140 1.00 0.00 ATOM 22531 H1 SOL 2476 50.430 21.970 25.890 1.00 0.00 ATOM 22532 H2 SOL 2476 50.440 20.920 26.990 1.00 0.00 ATOM 22533 OH2 SOL 2477 21.620 16.630 66.020 1.00 0.00 ATOM 22534 H1 SOL 2477 20.950 16.570 66.700 1.00 0.00 ATOM 22535 H2 SOL 2477 22.440 16.420 66.480 1.00 0.00 ATOM 22536 OH2 SOL 2478 37.710 34.240 14.320 1.00 0.00 ATOM 22537 H1 SOL 2478 37.460 33.530 13.730 1.00 0.00 ATOM 22538 H2 SOL 2478 38.620 34.040 14.560 1.00 0.00 ATOM 22539 OH2 SOL 2479 35.710 37.670 61.530 1.00 0.00 ATOM 22540 H1 SOL 2479 35.710 38.560 61.890 1.00 0.00 ATOM 22541 H2 SOL 2479 34.890 37.280 61.860 1.00 0.00 ATOM 22542 OH2 SOL 2480 26.530 55.350 58.910 1.00 0.00 ATOM 22543 H1 SOL 2480 26.280 55.950 58.210 1.00 0.00 ATOM 22544 H2 SOL 2480 26.600 55.900 59.690 1.00 0.00 ATOM 22545 OH2 SOL 2481 15.250 45.060 5.410 1.00 0.00 ATOM 22546 H1 SOL 2481 15.900 44.620 5.960 1.00 0.00 ATOM 22547 H2 SOL 2481 15.740 45.730 4.950 1.00 0.00 ATOM 22548 OH2 SOL 2482 23.530 45.850 20.360 1.00 0.00 ATOM 22549 H1 SOL 2482 22.890 45.410 20.920 1.00 0.00 ATOM 22550 H2 SOL 2482 24.310 45.940 20.900 1.00 0.00 ATOM 22551 OH2 SOL 2483 5.050 26.080 6.860 1.00 0.00 ATOM 22552 H1 SOL 2483 5.400 25.910 7.730 1.00 0.00 ATOM 22553 H2 SOL 2483 4.240 25.570 6.820 1.00 0.00 ATOM 22554 OH2 SOL 2484 1.110 28.800 10.430 1.00 0.00 ATOM 22555 H1 SOL 2484 1.460 29.100 11.280 1.00 0.00 ATOM 22556 H2 SOL 2484 1.020 27.860 10.530 1.00 0.00 ATOM 22557 OH2 SOL 2485 41.940 48.280 15.180 1.00 0.00 ATOM 22558 H1 SOL 2485 42.170 47.520 15.710 1.00 0.00 ATOM 22559 H2 SOL 2485 42.300 48.090 14.310 1.00 0.00 ATOM 22560 OH2 SOL 2486 39.010 44.470 68.520 1.00 0.00 ATOM 22561 H1 SOL 2486 38.740 44.360 69.440 1.00 0.00 ATOM 22562 H2 SOL 2486 38.210 44.740 68.070 1.00 0.00 ATOM 22563 OH2 SOL 2487 7.820 9.640 16.060 1.00 0.00 ATOM 22564 H1 SOL 2487 7.670 9.950 16.960 1.00 0.00 ATOM 22565 H2 SOL 2487 7.350 8.810 16.010 1.00 0.00 ATOM 22566 OH2 SOL 2488 10.720 7.650 69.900 1.00 0.00 ATOM 22567 H1 SOL 2488 10.690 8.600 69.790 1.00 0.00 ATOM 22568 H2 SOL 2488 11.600 7.400 69.620 1.00 0.00 ATOM 22569 OH2 SOL 2489 10.400 40.430 7.160 1.00 0.00 ATOM 22570 H1 SOL 2489 10.500 39.680 6.570 1.00 0.00 ATOM 22571 H2 SOL 2489 10.980 41.090 6.800 1.00 0.00 ATOM 22572 OH2 SOL 2490 38.650 24.520 7.960 1.00 0.00 ATOM 22573 H1 SOL 2490 39.490 24.160 7.680 1.00 0.00 ATOM 22574 H2 SOL 2490 38.840 24.960 8.790 1.00 0.00 ATOM 22575 OH2 SOL 2491 1.160 1.600 72.970 1.00 0.00 ATOM 22576 H1 SOL 2491 0.560 1.120 72.400 1.00 0.00 ATOM 22577 H2 SOL 2491 0.610 1.930 73.680 1.00 0.00 ATOM 22578 OH2 SOL 2492 56.800 44.310 1.710 1.00 0.00 ATOM 22579 H1 SOL 2492 56.610 45.130 2.170 1.00 0.00 ATOM 22580 H2 SOL 2492 57.680 44.060 2.010 1.00 0.00 ATOM 22581 OH2 SOL 2493 58.540 32.260 76.210 1.00 0.00 ATOM 22582 H1 SOL 2493 57.880 32.060 75.550 1.00 0.00 ATOM 22583 H2 SOL 2493 59.300 32.560 75.700 1.00 0.00 ATOM 22584 OH2 SOL 2494 39.780 32.700 10.440 1.00 0.00 ATOM 22585 H1 SOL 2494 40.650 32.580 10.050 1.00 0.00 ATOM 22586 H2 SOL 2494 39.620 33.640 10.390 1.00 0.00 ATOM 22587 OH2 SOL 2495 20.970 38.480 17.880 1.00 0.00 ATOM 22588 H1 SOL 2495 20.100 38.890 17.920 1.00 0.00 ATOM 22589 H2 SOL 2495 20.940 37.800 18.550 1.00 0.00 ATOM 22590 OH2 SOL 2496 31.700 46.700 14.330 1.00 0.00 ATOM 22591 H1 SOL 2496 32.070 46.370 15.150 1.00 0.00 ATOM 22592 H2 SOL 2496 32.090 46.140 13.650 1.00 0.00 ATOM 22593 OH2 SOL 2497 22.850 58.210 12.830 1.00 0.00 ATOM 22594 H1 SOL 2497 22.800 58.750 13.620 1.00 0.00 ATOM 22595 H2 SOL 2497 22.040 57.700 12.830 1.00 0.00 ATOM 22596 OH2 SOL 2498 12.660 3.830 22.640 1.00 0.00 ATOM 22597 H1 SOL 2498 13.210 3.230 23.150 1.00 0.00 ATOM 22598 H2 SOL 2498 12.030 4.180 23.260 1.00 0.00 ATOM 22599 OH2 SOL 2499 48.740 13.270 22.500 1.00 0.00 ATOM 22600 H1 SOL 2499 48.460 13.990 23.060 1.00 0.00 ATOM 22601 H2 SOL 2499 48.140 13.290 21.760 1.00 0.00 ATOM 22602 OH2 SOL 2500 3.900 0.090 17.380 1.00 0.00 ATOM 22603 H1 SOL 2500 3.210 0.730 17.590 1.00 0.00 ATOM 22604 H2 SOL 2500 4.510 0.570 16.810 1.00 0.00 ATOM 22605 OH2 SOL 2501 0.740 28.560 7.200 1.00 0.00 ATOM 22606 H1 SOL 2501 0.120 28.140 6.600 1.00 0.00 ATOM 22607 H2 SOL 2501 0.520 28.200 8.060 1.00 0.00 ATOM 22608 OH2 SOL 2502 41.450 10.850 62.210 1.00 0.00 ATOM 22609 H1 SOL 2502 41.600 10.190 61.530 1.00 0.00 ATOM 22610 H2 SOL 2502 41.050 11.590 61.740 1.00 0.00 ATOM 22611 OH2 SOL 2503 57.180 12.180 73.630 1.00 0.00 ATOM 22612 H1 SOL 2503 56.230 12.310 73.600 1.00 0.00 ATOM 22613 H2 SOL 2503 57.500 12.930 74.140 1.00 0.00 ATOM 22614 OH2 SOL 2504 45.130 13.170 76.350 1.00 0.00 ATOM 22615 H1 SOL 2504 45.770 13.880 76.350 1.00 0.00 ATOM 22616 H2 SOL 2504 44.480 13.440 75.700 1.00 0.00 ATOM 22617 OH2 SOL 2505 7.650 51.210 16.190 1.00 0.00 ATOM 22618 H1 SOL 2505 8.490 51.450 15.790 1.00 0.00 ATOM 22619 H2 SOL 2505 7.390 51.980 16.700 1.00 0.00 ATOM 22620 OH2 SOL 2506 3.400 35.170 9.680 1.00 0.00 ATOM 22621 H1 SOL 2506 3.760 36.060 9.730 1.00 0.00 ATOM 22622 H2 SOL 2506 2.470 35.280 9.850 1.00 0.00 ATOM 22623 OH2 SOL 2507 19.160 49.370 -0.210 1.00 0.00 ATOM 22624 H1 SOL 2507 19.670 50.070 0.200 1.00 0.00 ATOM 22625 H2 SOL 2507 19.310 48.620 0.370 1.00 0.00 ATOM 22626 OH2 SOL 2508 44.800 54.850 8.730 1.00 0.00 ATOM 22627 H1 SOL 2508 45.120 55.700 9.040 1.00 0.00 ATOM 22628 H2 SOL 2508 44.730 54.950 7.780 1.00 0.00 ATOM 22629 OH2 SOL 2509 21.520 29.700 6.130 1.00 0.00 ATOM 22630 H1 SOL 2509 20.670 30.120 6.000 1.00 0.00 ATOM 22631 H2 SOL 2509 21.310 28.870 6.570 1.00 0.00 ATOM 22632 OH2 SOL 2510 24.760 39.830 68.980 1.00 0.00 ATOM 22633 H1 SOL 2510 24.950 38.930 68.720 1.00 0.00 ATOM 22634 H2 SOL 2510 23.930 40.040 68.570 1.00 0.00 ATOM 22635 OH2 SOL 2511 15.860 27.820 63.980 1.00 0.00 ATOM 22636 H1 SOL 2511 14.910 27.770 64.090 1.00 0.00 ATOM 22637 H2 SOL 2511 16.000 27.600 63.060 1.00 0.00 ATOM 22638 OH2 SOL 2512 8.550 36.500 7.870 1.00 0.00 ATOM 22639 H1 SOL 2512 7.990 35.840 8.280 1.00 0.00 ATOM 22640 H2 SOL 2512 9.220 36.680 8.530 1.00 0.00 ATOM 22641 OH2 SOL 2513 24.890 14.640 78.060 1.00 0.00 ATOM 22642 H1 SOL 2513 25.750 14.470 78.440 1.00 0.00 ATOM 22643 H2 SOL 2513 25.020 14.580 77.120 1.00 0.00 ATOM 22644 OH2 SOL 2514 6.240 45.080 66.110 1.00 0.00 ATOM 22645 H1 SOL 2514 6.660 45.870 65.780 1.00 0.00 ATOM 22646 H2 SOL 2514 6.550 44.380 65.530 1.00 0.00 ATOM 22647 OH2 SOL 2515 28.610 31.020 17.020 1.00 0.00 ATOM 22648 H1 SOL 2515 28.510 31.380 17.910 1.00 0.00 ATOM 22649 H2 SOL 2515 29.040 30.170 17.160 1.00 0.00 ATOM 22650 OH2 SOL 2516 56.560 5.550 73.130 1.00 0.00 ATOM 22651 H1 SOL 2516 57.030 5.430 72.300 1.00 0.00 ATOM 22652 H2 SOL 2516 55.820 4.960 73.080 1.00 0.00 ATOM 22653 OH2 SOL 2517 25.450 58.860 15.250 1.00 0.00 ATOM 22654 H1 SOL 2517 25.330 58.350 14.450 1.00 0.00 ATOM 22655 H2 SOL 2517 25.840 59.680 14.950 1.00 0.00 ATOM 22656 OH2 SOL 2518 15.180 12.520 70.370 1.00 0.00 ATOM 22657 H1 SOL 2518 15.790 12.820 71.040 1.00 0.00 ATOM 22658 H2 SOL 2518 15.590 12.780 69.540 1.00 0.00 ATOM 22659 OH2 SOL 2519 8.450 44.410 21.690 1.00 0.00 ATOM 22660 H1 SOL 2519 9.050 44.290 20.950 1.00 0.00 ATOM 22661 H2 SOL 2519 8.270 43.520 21.990 1.00 0.00 ATOM 22662 OH2 SOL 2520 9.220 16.450 5.650 1.00 0.00 ATOM 22663 H1 SOL 2520 9.270 17.210 6.220 1.00 0.00 ATOM 22664 H2 SOL 2520 9.780 16.670 4.900 1.00 0.00 ATOM 22665 OH2 SOL 2521 10.850 37.100 76.510 1.00 0.00 ATOM 22666 H1 SOL 2521 10.360 36.530 77.100 1.00 0.00 ATOM 22667 H2 SOL 2521 10.850 36.640 75.670 1.00 0.00 ATOM 22668 OH2 SOL 2522 49.270 45.300 23.130 1.00 0.00 ATOM 22669 H1 SOL 2522 50.150 45.460 22.790 1.00 0.00 ATOM 22670 H2 SOL 2522 49.400 45.110 24.060 1.00 0.00 ATOM 22671 OH2 SOL 2523 35.830 29.920 2.830 1.00 0.00 ATOM 22672 H1 SOL 2523 35.240 30.510 2.370 1.00 0.00 ATOM 22673 H2 SOL 2523 36.600 30.460 3.010 1.00 0.00 ATOM 22674 OH2 SOL 2524 52.350 58.440 66.940 1.00 0.00 ATOM 22675 H1 SOL 2524 51.840 58.940 67.570 1.00 0.00 ATOM 22676 H2 SOL 2524 52.930 57.900 67.480 1.00 0.00 ATOM 22677 OH2 SOL 2525 1.780 35.700 83.050 1.00 0.00 ATOM 22678 H1 SOL 2525 1.450 35.650 82.150 1.00 0.00 ATOM 22679 H2 SOL 2525 1.280 36.410 83.450 1.00 0.00 ATOM 22680 OH2 SOL 2526 55.080 1.820 69.200 1.00 0.00 ATOM 22681 H1 SOL 2526 54.440 2.420 69.600 1.00 0.00 ATOM 22682 H2 SOL 2526 55.930 2.170 69.460 1.00 0.00 ATOM 22683 OH2 SOL 2527 48.410 47.820 78.950 1.00 0.00 ATOM 22684 H1 SOL 2527 48.270 48.730 79.190 1.00 0.00 ATOM 22685 H2 SOL 2527 48.060 47.320 79.690 1.00 0.00 ATOM 22686 OH2 SOL 2528 28.480 11.340 63.220 1.00 0.00 ATOM 22687 H1 SOL 2528 27.750 11.620 62.670 1.00 0.00 ATOM 22688 H2 SOL 2528 28.870 10.600 62.750 1.00 0.00 ATOM 22689 OH2 SOL 2529 35.690 54.880 24.550 1.00 0.00 ATOM 22690 H1 SOL 2529 35.390 54.580 23.690 1.00 0.00 ATOM 22691 H2 SOL 2529 36.180 54.140 24.900 1.00 0.00 ATOM 22692 OH2 SOL 2530 22.380 0.160 2.080 1.00 0.00 ATOM 22693 H1 SOL 2530 22.410 0.020 1.140 1.00 0.00 ATOM 22694 H2 SOL 2530 22.270 1.110 2.190 1.00 0.00 ATOM 22695 OH2 SOL 2531 56.210 12.370 66.080 1.00 0.00 ATOM 22696 H1 SOL 2531 56.910 12.100 66.680 1.00 0.00 ATOM 22697 H2 SOL 2531 55.980 11.580 65.600 1.00 0.00 ATOM 22698 OH2 SOL 2532 47.050 44.410 17.510 1.00 0.00 ATOM 22699 H1 SOL 2532 46.310 44.390 18.100 1.00 0.00 ATOM 22700 H2 SOL 2532 46.790 43.850 16.780 1.00 0.00 ATOM 22701 OH2 SOL 2533 9.250 19.710 84.820 1.00 0.00 ATOM 22702 H1 SOL 2533 8.680 20.470 84.930 1.00 0.00 ATOM 22703 H2 SOL 2533 9.760 19.900 84.040 1.00 0.00 ATOM 22704 OH2 SOL 2534 43.700 12.160 17.690 1.00 0.00 ATOM 22705 H1 SOL 2534 43.740 13.000 18.140 1.00 0.00 ATOM 22706 H2 SOL 2534 42.840 11.800 17.920 1.00 0.00 ATOM 22707 OH2 SOL 2535 4.870 5.890 23.320 1.00 0.00 ATOM 22708 H1 SOL 2535 4.940 4.970 23.580 1.00 0.00 ATOM 22709 H2 SOL 2535 5.760 6.130 23.060 1.00 0.00 ATOM 22710 OH2 SOL 2536 49.110 16.390 79.130 1.00 0.00 ATOM 22711 H1 SOL 2536 48.680 17.200 79.400 1.00 0.00 ATOM 22712 H2 SOL 2536 48.400 15.750 79.080 1.00 0.00 ATOM 22713 OH2 SOL 2537 57.400 51.590 13.320 1.00 0.00 ATOM 22714 H1 SOL 2537 56.700 51.140 13.800 1.00 0.00 ATOM 22715 H2 SOL 2537 58.180 51.480 13.870 1.00 0.00 ATOM 22716 OH2 SOL 2538 31.050 47.490 19.200 1.00 0.00 ATOM 22717 H1 SOL 2538 30.100 47.410 19.290 1.00 0.00 ATOM 22718 H2 SOL 2538 31.280 48.230 19.760 1.00 0.00 ATOM 22719 OH2 SOL 2539 18.000 27.810 67.780 1.00 0.00 ATOM 22720 H1 SOL 2539 18.150 27.450 66.900 1.00 0.00 ATOM 22721 H2 SOL 2539 17.200 28.320 67.680 1.00 0.00 ATOM 22722 OH2 SOL 2540 4.660 20.990 66.990 1.00 0.00 ATOM 22723 H1 SOL 2540 5.450 21.310 67.430 1.00 0.00 ATOM 22724 H2 SOL 2540 4.130 20.600 67.690 1.00 0.00 ATOM 22725 OH2 SOL 2541 56.790 58.150 77.690 1.00 0.00 ATOM 22726 H1 SOL 2541 57.430 57.490 77.430 1.00 0.00 ATOM 22727 H2 SOL 2541 56.860 58.830 77.020 1.00 0.00 ATOM 22728 OH2 SOL 2542 15.140 56.490 74.570 1.00 0.00 ATOM 22729 H1 SOL 2542 14.320 56.050 74.350 1.00 0.00 ATOM 22730 H2 SOL 2542 15.540 56.710 73.730 1.00 0.00 ATOM 22731 OH2 SOL 2543 45.040 27.830 84.110 1.00 0.00 ATOM 22732 H1 SOL 2543 45.930 28.090 84.340 1.00 0.00 ATOM 22733 H2 SOL 2543 45.130 27.440 83.240 1.00 0.00 ATOM 22734 OH2 SOL 2544 16.920 21.580 83.530 1.00 0.00 ATOM 22735 H1 SOL 2544 16.840 20.880 82.890 1.00 0.00 ATOM 22736 H2 SOL 2544 16.630 21.190 84.360 1.00 0.00 ATOM 22737 OH2 SOL 2545 3.140 44.190 80.850 1.00 0.00 ATOM 22738 H1 SOL 2545 3.400 44.190 81.770 1.00 0.00 ATOM 22739 H2 SOL 2545 2.200 44.340 80.860 1.00 0.00 ATOM 22740 OH2 SOL 2546 36.960 11.720 77.380 1.00 0.00 ATOM 22741 H1 SOL 2546 36.450 11.120 77.930 1.00 0.00 ATOM 22742 H2 SOL 2546 36.840 12.580 77.780 1.00 0.00 ATOM 22743 OH2 SOL 2547 47.560 9.170 83.090 1.00 0.00 ATOM 22744 H1 SOL 2547 47.050 9.810 82.600 1.00 0.00 ATOM 22745 H2 SOL 2547 48.440 9.540 83.130 1.00 0.00 ATOM 22746 OH2 SOL 2548 51.080 49.950 0.790 1.00 0.00 ATOM 22747 H1 SOL 2548 51.500 49.420 1.470 1.00 0.00 ATOM 22748 H2 SOL 2548 50.180 49.640 0.780 1.00 0.00 ATOM 22749 OH2 SOL 2549 4.940 28.870 1.330 1.00 0.00 ATOM 22750 H1 SOL 2549 4.270 29.260 0.760 1.00 0.00 ATOM 22751 H2 SOL 2549 5.770 29.090 0.910 1.00 0.00 ATOM 22752 OH2 SOL 2550 57.560 14.720 8.780 1.00 0.00 ATOM 22753 H1 SOL 2550 56.660 15.010 8.620 1.00 0.00 ATOM 22754 H2 SOL 2550 57.710 14.880 9.710 1.00 0.00 ATOM 22755 OH2 SOL 2551 14.080 33.260 20.810 1.00 0.00 ATOM 22756 H1 SOL 2551 13.590 34.060 20.970 1.00 0.00 ATOM 22757 H2 SOL 2551 14.950 33.560 20.530 1.00 0.00 ATOM 22758 OH2 SOL 2552 40.700 24.230 3.770 1.00 0.00 ATOM 22759 H1 SOL 2552 41.130 25.000 3.400 1.00 0.00 ATOM 22760 H2 SOL 2552 40.910 23.520 3.170 1.00 0.00 ATOM 22761 OH2 SOL 2553 30.320 46.160 70.800 1.00 0.00 ATOM 22762 H1 SOL 2553 30.400 45.890 69.880 1.00 0.00 ATOM 22763 H2 SOL 2553 31.140 45.880 71.210 1.00 0.00 ATOM 22764 OH2 SOL 2554 9.650 47.950 84.710 1.00 0.00 ATOM 22765 H1 SOL 2554 10.050 48.500 85.380 1.00 0.00 ATOM 22766 H2 SOL 2554 10.370 47.750 84.110 1.00 0.00 ATOM 22767 OH2 SOL 2555 34.060 12.630 81.890 1.00 0.00 ATOM 22768 H1 SOL 2555 33.770 11.940 82.490 1.00 0.00 ATOM 22769 H2 SOL 2555 34.920 12.330 81.590 1.00 0.00 ATOM 22770 OH2 SOL 2556 47.710 35.680 72.250 1.00 0.00 ATOM 22771 H1 SOL 2556 47.740 36.000 71.340 1.00 0.00 ATOM 22772 H2 SOL 2556 47.310 36.390 72.740 1.00 0.00 ATOM 22773 OH2 SOL 2557 5.390 49.580 64.670 1.00 0.00 ATOM 22774 H1 SOL 2557 4.510 49.730 64.310 1.00 0.00 ATOM 22775 H2 SOL 2557 5.970 50.090 64.100 1.00 0.00 ATOM 22776 OH2 SOL 2558 36.360 51.300 78.480 1.00 0.00 ATOM 22777 H1 SOL 2558 35.850 50.550 78.160 1.00 0.00 ATOM 22778 H2 SOL 2558 36.690 51.710 77.680 1.00 0.00 ATOM 22779 OH2 SOL 2559 46.900 40.430 82.820 1.00 0.00 ATOM 22780 H1 SOL 2559 46.770 40.920 83.640 1.00 0.00 ATOM 22781 H2 SOL 2559 46.270 40.800 82.210 1.00 0.00 ATOM 22782 OH2 SOL 2560 42.050 48.540 78.350 1.00 0.00 ATOM 22783 H1 SOL 2560 42.750 49.200 78.260 1.00 0.00 ATOM 22784 H2 SOL 2560 42.500 47.760 78.670 1.00 0.00 ATOM 22785 OH2 SOL 2561 46.790 2.590 0.980 1.00 0.00 ATOM 22786 H1 SOL 2561 46.150 2.240 0.360 1.00 0.00 ATOM 22787 H2 SOL 2561 46.440 2.360 1.840 1.00 0.00 ATOM 22788 OH2 SOL 2562 17.170 30.740 82.970 1.00 0.00 ATOM 22789 H1 SOL 2562 16.910 30.380 82.130 1.00 0.00 ATOM 22790 H2 SOL 2562 16.420 30.610 83.540 1.00 0.00 ATOM 22791 OH2 SOL 2563 47.110 31.460 69.210 1.00 0.00 ATOM 22792 H1 SOL 2563 47.390 32.000 69.950 1.00 0.00 ATOM 22793 H2 SOL 2563 47.920 31.070 68.880 1.00 0.00 ATOM 22794 OH2 SOL 2564 2.820 20.490 4.080 1.00 0.00 ATOM 22795 H1 SOL 2564 2.810 19.680 3.580 1.00 0.00 ATOM 22796 H2 SOL 2564 1.900 20.780 4.090 1.00 0.00 ATOM 22797 OH2 SOL 2565 51.870 15.720 78.450 1.00 0.00 ATOM 22798 H1 SOL 2565 50.980 15.860 78.770 1.00 0.00 ATOM 22799 H2 SOL 2565 51.990 14.770 78.500 1.00 0.00 ATOM 22800 OH2 SOL 2566 57.770 56.590 69.640 1.00 0.00 ATOM 22801 H1 SOL 2566 58.520 56.210 69.190 1.00 0.00 ATOM 22802 H2 SOL 2566 57.390 57.190 69.000 1.00 0.00 ATOM 22803 OH2 SOL 2567 14.980 9.460 1.070 1.00 0.00 ATOM 22804 H1 SOL 2567 15.390 10.070 1.680 1.00 0.00 ATOM 22805 H2 SOL 2567 14.180 9.180 1.510 1.00 0.00 ATOM 22806 OH2 SOL 2568 33.960 21.960 69.450 1.00 0.00 ATOM 22807 H1 SOL 2568 33.570 21.170 69.830 1.00 0.00 ATOM 22808 H2 SOL 2568 33.860 21.840 68.510 1.00 0.00 ATOM 22809 OH2 SOL 2569 46.170 29.100 11.050 1.00 0.00 ATOM 22810 H1 SOL 2569 45.840 30.000 11.050 1.00 0.00 ATOM 22811 H2 SOL 2569 46.380 28.930 11.970 1.00 0.00 ATOM 22812 OH2 SOL 2570 58.800 37.190 3.820 1.00 0.00 ATOM 22813 H1 SOL 2570 58.220 37.490 4.530 1.00 0.00 ATOM 22814 H2 SOL 2570 58.200 36.910 3.130 1.00 0.00 ATOM 22815 OH2 SOL 2571 3.190 60.550 74.600 1.00 0.00 ATOM 22816 H1 SOL 2571 2.620 59.840 74.320 1.00 0.00 ATOM 22817 H2 SOL 2571 2.600 61.280 74.790 1.00 0.00 ATOM 22818 OH2 SOL 2572 32.910 31.200 66.870 1.00 0.00 ATOM 22819 H1 SOL 2572 32.000 31.360 66.640 1.00 0.00 ATOM 22820 H2 SOL 2572 33.390 31.360 66.060 1.00 0.00 ATOM 22821 OH2 SOL 2573 47.460 28.460 0.380 1.00 0.00 ATOM 22822 H1 SOL 2573 48.270 28.200 -0.060 1.00 0.00 ATOM 22823 H2 SOL 2573 47.660 29.290 0.800 1.00 0.00 ATOM 22824 OH2 SOL 2574 39.730 29.030 73.610 1.00 0.00 ATOM 22825 H1 SOL 2574 39.100 28.790 72.940 1.00 0.00 ATOM 22826 H2 SOL 2574 40.170 29.800 73.260 1.00 0.00 ATOM 22827 OH2 SOL 2575 42.020 49.420 73.010 1.00 0.00 ATOM 22828 H1 SOL 2575 42.780 49.880 73.370 1.00 0.00 ATOM 22829 H2 SOL 2575 41.520 50.100 72.560 1.00 0.00 ATOM 22830 OH2 SOL 2576 18.250 30.600 72.330 1.00 0.00 ATOM 22831 H1 SOL 2576 17.610 30.110 71.820 1.00 0.00 ATOM 22832 H2 SOL 2576 18.500 30.010 73.040 1.00 0.00 ATOM 22833 OH2 SOL 2577 30.340 19.190 69.630 1.00 0.00 ATOM 22834 H1 SOL 2577 29.770 18.570 70.090 1.00 0.00 ATOM 22835 H2 SOL 2577 30.060 19.150 68.720 1.00 0.00 ATOM 22836 OH2 SOL 2578 57.360 36.520 18.070 1.00 0.00 ATOM 22837 H1 SOL 2578 57.920 36.390 17.310 1.00 0.00 ATOM 22838 H2 SOL 2578 57.660 35.850 18.700 1.00 0.00 ATOM 22839 OH2 SOL 2579 17.020 3.530 67.060 1.00 0.00 ATOM 22840 H1 SOL 2579 17.400 3.950 66.290 1.00 0.00 ATOM 22841 H2 SOL 2579 16.280 4.100 67.300 1.00 0.00 ATOM 22842 OH2 SOL 2580 37.410 7.430 12.270 1.00 0.00 ATOM 22843 H1 SOL 2580 38.050 7.510 11.570 1.00 0.00 ATOM 22844 H2 SOL 2580 37.010 6.560 12.130 1.00 0.00 ATOM 22845 OH2 SOL 2581 6.420 39.830 84.210 1.00 0.00 ATOM 22846 H1 SOL 2581 5.590 40.310 84.130 1.00 0.00 ATOM 22847 H2 SOL 2581 6.520 39.380 83.370 1.00 0.00 ATOM 22848 OH2 SOL 2582 38.350 7.260 15.360 1.00 0.00 ATOM 22849 H1 SOL 2582 38.230 7.500 14.440 1.00 0.00 ATOM 22850 H2 SOL 2582 37.700 6.590 15.520 1.00 0.00 ATOM 22851 OH2 SOL 2583 7.180 59.040 81.670 1.00 0.00 ATOM 22852 H1 SOL 2583 6.910 59.730 82.280 1.00 0.00 ATOM 22853 H2 SOL 2583 6.970 58.220 82.120 1.00 0.00 ATOM 22854 OH2 SOL 2584 8.580 32.490 67.770 1.00 0.00 ATOM 22855 H1 SOL 2584 8.640 33.430 67.600 1.00 0.00 ATOM 22856 H2 SOL 2584 9.430 32.150 67.490 1.00 0.00 ATOM 22857 OH2 SOL 2585 6.680 16.550 73.530 1.00 0.00 ATOM 22858 H1 SOL 2585 7.440 15.970 73.640 1.00 0.00 ATOM 22859 H2 SOL 2585 6.940 17.360 73.960 1.00 0.00 ATOM 22860 OH2 SOL 2586 15.090 44.370 12.500 1.00 0.00 ATOM 22861 H1 SOL 2586 15.560 45.040 13.000 1.00 0.00 ATOM 22862 H2 SOL 2586 15.060 44.700 11.610 1.00 0.00 ATOM 22863 OH2 SOL 2587 53.700 38.890 21.460 1.00 0.00 ATOM 22864 H1 SOL 2587 53.610 38.910 22.420 1.00 0.00 ATOM 22865 H2 SOL 2587 53.350 38.030 21.210 1.00 0.00 ATOM 22866 OH2 SOL 2588 5.290 29.000 77.590 1.00 0.00 ATOM 22867 H1 SOL 2588 5.800 28.210 77.380 1.00 0.00 ATOM 22868 H2 SOL 2588 4.580 28.680 78.150 1.00 0.00 ATOM 22869 OH2 SOL 2589 45.600 31.500 12.460 1.00 0.00 ATOM 22870 H1 SOL 2589 44.900 32.140 12.500 1.00 0.00 ATOM 22871 H2 SOL 2589 46.400 32.010 12.610 1.00 0.00 ATOM 22872 OH2 SOL 2590 50.280 10.890 12.080 1.00 0.00 ATOM 22873 H1 SOL 2590 50.900 11.040 12.790 1.00 0.00 ATOM 22874 H2 SOL 2590 50.640 10.150 11.590 1.00 0.00 ATOM 22875 OH2 SOL 2591 18.360 50.240 7.220 1.00 0.00 ATOM 22876 H1 SOL 2591 19.240 50.520 6.980 1.00 0.00 ATOM 22877 H2 SOL 2591 18.140 50.760 7.990 1.00 0.00 ATOM 22878 OH2 SOL 2592 48.300 55.550 6.900 1.00 0.00 ATOM 22879 H1 SOL 2592 47.500 56.070 6.840 1.00 0.00 ATOM 22880 H2 SOL 2592 48.030 54.720 7.290 1.00 0.00 ATOM 22881 OH2 SOL 2593 25.730 42.130 6.770 1.00 0.00 ATOM 22882 H1 SOL 2593 25.240 41.360 6.480 1.00 0.00 ATOM 22883 H2 SOL 2593 26.280 42.360 6.020 1.00 0.00 ATOM 22884 OH2 SOL 2594 20.090 23.280 12.740 1.00 0.00 ATOM 22885 H1 SOL 2594 19.550 23.590 12.020 1.00 0.00 ATOM 22886 H2 SOL 2594 19.470 22.930 13.380 1.00 0.00 ATOM 22887 OH2 SOL 2595 4.560 3.420 6.060 1.00 0.00 ATOM 22888 H1 SOL 2595 4.080 3.730 5.290 1.00 0.00 ATOM 22889 H2 SOL 2595 5.080 4.170 6.330 1.00 0.00 ATOM 22890 OH2 SOL 2596 57.150 31.580 2.210 1.00 0.00 ATOM 22891 H1 SOL 2596 57.750 31.710 1.480 1.00 0.00 ATOM 22892 H2 SOL 2596 57.620 31.000 2.810 1.00 0.00 ATOM 22893 OH2 SOL 2597 45.130 22.860 11.100 1.00 0.00 ATOM 22894 H1 SOL 2597 45.490 23.670 11.470 1.00 0.00 ATOM 22895 H2 SOL 2597 44.800 23.120 10.240 1.00 0.00 ATOM 22896 OH2 SOL 2598 4.490 48.270 7.510 1.00 0.00 ATOM 22897 H1 SOL 2598 3.760 48.760 7.890 1.00 0.00 ATOM 22898 H2 SOL 2598 4.420 48.430 6.570 1.00 0.00 ATOM 22899 OH2 SOL 2599 24.470 22.160 18.010 1.00 0.00 ATOM 22900 H1 SOL 2599 24.290 21.900 18.920 1.00 0.00 ATOM 22901 H2 SOL 2599 24.680 23.090 18.060 1.00 0.00 ATOM 22902 OH2 SOL 2600 43.110 38.680 69.580 1.00 0.00 ATOM 22903 H1 SOL 2600 43.840 38.080 69.750 1.00 0.00 ATOM 22904 H2 SOL 2600 43.470 39.550 69.720 1.00 0.00 ATOM 22905 OH2 SOL 2601 57.600 56.090 75.750 1.00 0.00 ATOM 22906 H1 SOL 2601 58.180 56.600 75.190 1.00 0.00 ATOM 22907 H2 SOL 2601 56.780 56.020 75.260 1.00 0.00 ATOM 22908 OH2 SOL 2602 50.000 35.140 79.870 1.00 0.00 ATOM 22909 H1 SOL 2602 50.570 34.960 79.120 1.00 0.00 ATOM 22910 H2 SOL 2602 49.780 34.270 80.210 1.00 0.00 ATOM 22911 OH2 SOL 2603 23.040 50.950 16.980 1.00 0.00 ATOM 22912 H1 SOL 2603 22.950 51.670 16.350 1.00 0.00 ATOM 22913 H2 SOL 2603 23.240 50.190 16.450 1.00 0.00 ATOM 22914 OH2 SOL 2604 51.310 15.870 7.060 1.00 0.00 ATOM 22915 H1 SOL 2604 51.150 16.390 6.270 1.00 0.00 ATOM 22916 H2 SOL 2604 52.250 15.900 7.190 1.00 0.00 ATOM 22917 OH2 SOL 2605 47.950 38.950 71.850 1.00 0.00 ATOM 22918 H1 SOL 2605 48.740 38.430 72.000 1.00 0.00 ATOM 22919 H2 SOL 2605 47.980 39.620 72.540 1.00 0.00 ATOM 22920 OH2 SOL 2606 16.180 54.920 79.000 1.00 0.00 ATOM 22921 H1 SOL 2606 16.560 55.270 78.200 1.00 0.00 ATOM 22922 H2 SOL 2606 15.310 55.310 79.050 1.00 0.00 ATOM 22923 OH2 SOL 2607 5.150 9.130 2.410 1.00 0.00 ATOM 22924 H1 SOL 2607 4.370 9.670 2.530 1.00 0.00 ATOM 22925 H2 SOL 2607 5.490 9.000 3.290 1.00 0.00 ATOM 22926 OH2 SOL 2608 11.190 0.910 15.550 1.00 0.00 ATOM 22927 H1 SOL 2608 10.490 1.530 15.740 1.00 0.00 ATOM 22928 H2 SOL 2608 11.810 1.410 15.010 1.00 0.00 ATOM 22929 OH2 SOL 2609 48.560 7.610 10.750 1.00 0.00 ATOM 22930 H1 SOL 2609 47.800 8.190 10.810 1.00 0.00 ATOM 22931 H2 SOL 2609 49.050 7.930 10.000 1.00 0.00 ATOM 22932 OH2 SOL 2610 26.520 58.940 11.910 1.00 0.00 ATOM 22933 H1 SOL 2610 26.850 59.840 11.940 1.00 0.00 ATOM 22934 H2 SOL 2610 25.640 59.030 11.560 1.00 0.00 ATOM 22935 OH2 SOL 2611 59.250 50.910 78.700 1.00 0.00 ATOM 22936 H1 SOL 2611 59.210 51.590 78.030 1.00 0.00 ATOM 22937 H2 SOL 2611 59.910 51.220 79.320 1.00 0.00 ATOM 22938 OH2 SOL 2612 49.020 9.730 7.150 1.00 0.00 ATOM 22939 H1 SOL 2612 49.100 8.820 6.880 1.00 0.00 ATOM 22940 H2 SOL 2612 49.630 9.820 7.880 1.00 0.00 ATOM 22941 OH2 SOL 2613 10.150 43.710 19.280 1.00 0.00 ATOM 22942 H1 SOL 2613 10.070 44.250 18.490 1.00 0.00 ATOM 22943 H2 SOL 2613 10.950 44.030 19.700 1.00 0.00 ATOM 22944 OH2 SOL 2614 39.940 17.400 13.190 1.00 0.00 ATOM 22945 H1 SOL 2614 40.430 18.210 13.290 1.00 0.00 ATOM 22946 H2 SOL 2614 40.580 16.710 13.360 1.00 0.00 ATOM 22947 OH2 SOL 2615 50.400 1.370 75.700 1.00 0.00 ATOM 22948 H1 SOL 2615 50.790 1.720 76.500 1.00 0.00 ATOM 22949 H2 SOL 2615 50.870 1.820 74.990 1.00 0.00 ATOM 22950 OH2 SOL 2616 14.500 59.420 8.390 1.00 0.00 ATOM 22951 H1 SOL 2616 13.930 59.900 9.000 1.00 0.00 ATOM 22952 H2 SOL 2616 14.830 58.680 8.900 1.00 0.00 ATOM 22953 OH2 SOL 2617 7.470 17.710 79.040 1.00 0.00 ATOM 22954 H1 SOL 2617 8.330 18.070 79.260 1.00 0.00 ATOM 22955 H2 SOL 2617 7.660 16.820 78.740 1.00 0.00 ATOM 22956 OH2 SOL 2618 34.560 49.410 77.290 1.00 0.00 ATOM 22957 H1 SOL 2618 34.020 49.110 76.570 1.00 0.00 ATOM 22958 H2 SOL 2618 34.990 48.620 77.620 1.00 0.00 ATOM 22959 OH2 SOL 2619 41.840 44.080 1.520 1.00 0.00 ATOM 22960 H1 SOL 2619 42.600 44.430 1.980 1.00 0.00 ATOM 22961 H2 SOL 2619 41.480 43.420 2.120 1.00 0.00 ATOM 22962 OH2 SOL 2620 4.870 7.110 0.420 1.00 0.00 ATOM 22963 H1 SOL 2620 4.970 6.330 0.960 1.00 0.00 ATOM 22964 H2 SOL 2620 4.640 7.800 1.040 1.00 0.00 ATOM 22965 OH2 SOL 2621 6.880 22.620 74.180 1.00 0.00 ATOM 22966 H1 SOL 2621 6.870 23.360 73.560 1.00 0.00 ATOM 22967 H2 SOL 2621 5.980 22.540 74.480 1.00 0.00 ATOM 22968 OH2 SOL 2622 37.060 58.580 7.180 1.00 0.00 ATOM 22969 H1 SOL 2622 37.590 58.600 7.980 1.00 0.00 ATOM 22970 H2 SOL 2622 36.970 57.640 6.980 1.00 0.00 ATOM 22971 OH2 SOL 2623 7.740 57.970 8.100 1.00 0.00 ATOM 22972 H1 SOL 2623 8.160 58.270 7.290 1.00 0.00 ATOM 22973 H2 SOL 2623 7.060 57.360 7.800 1.00 0.00 ATOM 22974 OH2 SOL 2624 23.290 3.570 14.540 1.00 0.00 ATOM 22975 H1 SOL 2624 23.310 2.760 15.040 1.00 0.00 ATOM 22976 H2 SOL 2624 24.110 3.580 14.050 1.00 0.00 ATOM 22977 OH2 SOL 2625 52.020 8.220 18.490 1.00 0.00 ATOM 22978 H1 SOL 2625 52.100 7.280 18.350 1.00 0.00 ATOM 22979 H2 SOL 2625 51.230 8.470 18.000 1.00 0.00 ATOM 22980 OH2 SOL 2626 27.070 41.690 66.400 1.00 0.00 ATOM 22981 H1 SOL 2626 26.260 41.400 65.990 1.00 0.00 ATOM 22982 H2 SOL 2626 27.430 40.900 66.800 1.00 0.00 ATOM 22983 OH2 SOL 2627 57.250 39.850 74.080 1.00 0.00 ATOM 22984 H1 SOL 2627 57.930 40.350 74.540 1.00 0.00 ATOM 22985 H2 SOL 2627 57.640 39.650 73.230 1.00 0.00 ATOM 22986 OH2 SOL 2628 55.050 21.060 4.910 1.00 0.00 ATOM 22987 H1 SOL 2628 55.230 21.100 5.850 1.00 0.00 ATOM 22988 H2 SOL 2628 54.820 20.140 4.750 1.00 0.00 ATOM 22989 OH2 SOL 2629 51.300 37.880 80.460 1.00 0.00 ATOM 22990 H1 SOL 2629 50.470 38.320 80.610 1.00 0.00 ATOM 22991 H2 SOL 2629 51.060 37.010 80.150 1.00 0.00 ATOM 22992 OH2 SOL 2630 31.220 25.210 76.990 1.00 0.00 ATOM 22993 H1 SOL 2630 32.170 25.330 76.970 1.00 0.00 ATOM 22994 H2 SOL 2630 30.990 24.930 76.110 1.00 0.00 ATOM 22995 OH2 SOL 2631 44.240 49.150 69.340 1.00 0.00 ATOM 22996 H1 SOL 2631 43.350 48.800 69.430 1.00 0.00 ATOM 22997 H2 SOL 2631 44.500 49.360 70.240 1.00 0.00 ATOM 22998 OH2 SOL 2632 49.320 53.650 69.360 1.00 0.00 ATOM 22999 H1 SOL 2632 48.600 53.830 69.950 1.00 0.00 ATOM 23000 H2 SOL 2632 50.110 53.820 69.880 1.00 0.00 ATOM 23001 OH2 SOL 2633 10.200 53.620 83.200 1.00 0.00 ATOM 23002 H1 SOL 2633 9.920 53.000 82.530 1.00 0.00 ATOM 23003 H2 SOL 2633 10.490 53.070 83.930 1.00 0.00 ATOM 23004 OH2 SOL 2634 29.380 60.040 9.590 1.00 0.00 ATOM 23005 H1 SOL 2634 29.920 59.280 9.800 1.00 0.00 ATOM 23006 H2 SOL 2634 29.660 60.310 8.720 1.00 0.00 ATOM 23007 OH2 SOL 2635 1.570 51.440 64.340 1.00 0.00 ATOM 23008 H1 SOL 2635 1.890 50.540 64.290 1.00 0.00 ATOM 23009 H2 SOL 2635 1.540 51.630 65.280 1.00 0.00 ATOM 23010 OH2 SOL 2636 36.270 32.830 69.270 1.00 0.00 ATOM 23011 H1 SOL 2636 36.270 33.160 70.170 1.00 0.00 ATOM 23012 H2 SOL 2636 35.610 33.370 68.830 1.00 0.00 ATOM 23013 OH2 SOL 2637 0.880 54.900 80.070 1.00 0.00 ATOM 23014 H1 SOL 2637 -0.040 54.760 80.330 1.00 0.00 ATOM 23015 H2 SOL 2637 1.120 54.090 79.630 1.00 0.00 ATOM 23016 OH2 SOL 2638 21.790 19.920 74.130 1.00 0.00 ATOM 23017 H1 SOL 2638 21.000 20.400 74.380 1.00 0.00 ATOM 23018 H2 SOL 2638 22.260 19.800 74.950 1.00 0.00 ATOM 23019 OH2 SOL 2639 3.950 30.360 69.540 1.00 0.00 ATOM 23020 H1 SOL 2639 4.180 30.470 70.460 1.00 0.00 ATOM 23021 H2 SOL 2639 4.550 30.930 69.070 1.00 0.00 ATOM 23022 OH2 SOL 2640 18.790 31.410 14.410 1.00 0.00 ATOM 23023 H1 SOL 2640 19.060 30.490 14.360 1.00 0.00 ATOM 23024 H2 SOL 2640 19.200 31.830 13.650 1.00 0.00 ATOM 23025 OH2 SOL 2641 3.440 6.760 13.590 1.00 0.00 ATOM 23026 H1 SOL 2641 3.810 6.320 12.820 1.00 0.00 ATOM 23027 H2 SOL 2641 3.330 6.050 14.230 1.00 0.00 ATOM 23028 OH2 SOL 2642 2.870 57.010 83.180 1.00 0.00 ATOM 23029 H1 SOL 2642 2.180 56.530 82.720 1.00 0.00 ATOM 23030 H2 SOL 2642 2.410 57.540 83.830 1.00 0.00 ATOM 23031 OH2 SOL 2643 41.290 3.830 22.170 1.00 0.00 ATOM 23032 H1 SOL 2643 40.710 4.100 21.470 1.00 0.00 ATOM 23033 H2 SOL 2643 41.290 4.570 22.780 1.00 0.00 ATOM 23034 OH2 SOL 2644 23.940 15.320 57.700 1.00 0.00 ATOM 23035 H1 SOL 2644 23.200 15.850 57.390 1.00 0.00 ATOM 23036 H2 SOL 2644 23.530 14.520 58.010 1.00 0.00 ATOM 23037 OH2 SOL 2645 9.810 12.190 3.770 1.00 0.00 ATOM 23038 H1 SOL 2645 9.010 12.050 4.280 1.00 0.00 ATOM 23039 H2 SOL 2645 10.250 12.920 4.200 1.00 0.00 ATOM 23040 OH2 SOL 2646 41.520 29.830 66.900 1.00 0.00 ATOM 23041 H1 SOL 2646 41.870 28.930 66.930 1.00 0.00 ATOM 23042 H2 SOL 2646 40.640 29.730 66.550 1.00 0.00 ATOM 23043 OH2 SOL 2647 19.400 35.070 18.340 1.00 0.00 ATOM 23044 H1 SOL 2647 18.680 34.690 18.850 1.00 0.00 ATOM 23045 H2 SOL 2647 19.800 35.700 18.930 1.00 0.00 ATOM 23046 OH2 SOL 2648 40.660 27.230 17.420 1.00 0.00 ATOM 23047 H1 SOL 2648 40.310 26.800 18.200 1.00 0.00 ATOM 23048 H2 SOL 2648 41.490 26.770 17.260 1.00 0.00 ATOM 23049 OH2 SOL 2649 44.290 49.330 17.630 1.00 0.00 ATOM 23050 H1 SOL 2649 44.140 48.960 16.760 1.00 0.00 ATOM 23051 H2 SOL 2649 45.240 49.290 17.750 1.00 0.00 ATOM 23052 OH2 SOL 2650 26.280 38.640 14.630 1.00 0.00 ATOM 23053 H1 SOL 2650 25.380 38.430 14.860 1.00 0.00 ATOM 23054 H2 SOL 2650 26.690 37.780 14.480 1.00 0.00 ATOM 23055 OH2 SOL 2651 45.600 33.980 1.580 1.00 0.00 ATOM 23056 H1 SOL 2651 46.560 34.060 1.600 1.00 0.00 ATOM 23057 H2 SOL 2651 45.410 33.600 0.730 1.00 0.00 ATOM 23058 OH2 SOL 2652 54.160 8.420 74.950 1.00 0.00 ATOM 23059 H1 SOL 2652 54.230 7.470 75.020 1.00 0.00 ATOM 23060 H2 SOL 2652 54.980 8.700 74.550 1.00 0.00 ATOM 23061 OH2 SOL 2653 26.160 16.550 63.660 1.00 0.00 ATOM 23062 H1 SOL 2653 25.980 15.620 63.840 1.00 0.00 ATOM 23063 H2 SOL 2653 25.650 17.020 64.320 1.00 0.00 ATOM 23064 OH2 SOL 2654 31.590 17.320 19.370 1.00 0.00 ATOM 23065 H1 SOL 2654 31.090 17.790 18.710 1.00 0.00 ATOM 23066 H2 SOL 2654 31.200 16.450 19.400 1.00 0.00 ATOM 23067 OH2 SOL 2655 53.000 9.370 8.260 1.00 0.00 ATOM 23068 H1 SOL 2655 52.400 9.840 8.840 1.00 0.00 ATOM 23069 H2 SOL 2655 52.730 8.450 8.340 1.00 0.00 ATOM 23070 OH2 SOL 2656 11.380 21.280 74.500 1.00 0.00 ATOM 23071 H1 SOL 2656 10.760 21.390 73.780 1.00 0.00 ATOM 23072 H2 SOL 2656 11.030 21.840 75.200 1.00 0.00 ATOM 23073 OH2 SOL 2657 52.430 26.420 0.160 1.00 0.00 ATOM 23074 H1 SOL 2657 53.000 25.880 -0.390 1.00 0.00 ATOM 23075 H2 SOL 2657 52.880 26.460 1.010 1.00 0.00 ATOM 23076 OH2 SOL 2658 40.330 44.590 73.350 1.00 0.00 ATOM 23077 H1 SOL 2658 39.780 44.720 74.120 1.00 0.00 ATOM 23078 H2 SOL 2658 40.660 45.460 73.140 1.00 0.00 ATOM 23079 OH2 SOL 2659 33.860 0.420 12.260 1.00 0.00 ATOM 23080 H1 SOL 2659 33.540 0.880 11.480 1.00 0.00 ATOM 23081 H2 SOL 2659 34.090 1.130 12.860 1.00 0.00 ATOM 23082 OH2 SOL 2660 42.800 36.320 78.800 1.00 0.00 ATOM 23083 H1 SOL 2660 42.720 37.260 78.950 1.00 0.00 ATOM 23084 H2 SOL 2660 42.890 35.940 79.670 1.00 0.00 ATOM 23085 OH2 SOL 2661 29.930 56.040 76.810 1.00 0.00 ATOM 23086 H1 SOL 2661 30.580 55.570 76.290 1.00 0.00 ATOM 23087 H2 SOL 2661 30.450 56.530 77.450 1.00 0.00 ATOM 23088 OH2 SOL 2662 35.070 33.600 5.080 1.00 0.00 ATOM 23089 H1 SOL 2662 34.640 32.860 4.650 1.00 0.00 ATOM 23090 H2 SOL 2662 35.630 33.200 5.740 1.00 0.00 ATOM 23091 OH2 SOL 2663 26.250 58.750 77.840 1.00 0.00 ATOM 23092 H1 SOL 2663 25.400 58.550 77.460 1.00 0.00 ATOM 23093 H2 SOL 2663 26.670 57.900 77.950 1.00 0.00 ATOM 23094 OH2 SOL 2664 48.980 15.730 13.750 1.00 0.00 ATOM 23095 H1 SOL 2664 49.160 15.520 12.840 1.00 0.00 ATOM 23096 H2 SOL 2664 49.810 15.570 14.200 1.00 0.00 ATOM 23097 OH2 SOL 2665 46.230 17.200 62.900 1.00 0.00 ATOM 23098 H1 SOL 2665 46.350 16.930 61.990 1.00 0.00 ATOM 23099 H2 SOL 2665 45.500 16.660 63.210 1.00 0.00 ATOM 23100 OH2 SOL 2666 25.020 28.650 84.080 1.00 0.00 ATOM 23101 H1 SOL 2666 25.750 29.210 83.810 1.00 0.00 ATOM 23102 H2 SOL 2666 24.510 29.190 84.680 1.00 0.00 ATOM 23103 OH2 SOL 2667 54.400 48.630 78.770 1.00 0.00 ATOM 23104 H1 SOL 2667 53.930 49.450 78.890 1.00 0.00 ATOM 23105 H2 SOL 2667 53.780 47.950 79.040 1.00 0.00 ATOM 23106 OH2 SOL 2668 31.990 9.310 1.490 1.00 0.00 ATOM 23107 H1 SOL 2668 31.480 9.680 2.200 1.00 0.00 ATOM 23108 H2 SOL 2668 32.570 8.670 1.910 1.00 0.00 ATOM 23109 OH2 SOL 2669 23.460 53.450 84.750 1.00 0.00 ATOM 23110 H1 SOL 2669 23.530 53.680 83.830 1.00 0.00 ATOM 23111 H2 SOL 2669 24.350 53.180 85.000 1.00 0.00 ATOM 23112 OH2 SOL 2670 36.050 7.650 63.800 1.00 0.00 ATOM 23113 H1 SOL 2670 35.630 7.520 62.940 1.00 0.00 ATOM 23114 H2 SOL 2670 36.910 8.010 63.590 1.00 0.00 ATOM 23115 OH2 SOL 2671 43.220 51.590 60.700 1.00 0.00 ATOM 23116 H1 SOL 2671 44.150 51.480 60.510 1.00 0.00 ATOM 23117 H2 SOL 2671 42.880 52.090 59.950 1.00 0.00 ATOM 23118 OH2 SOL 2672 19.880 57.020 68.810 1.00 0.00 ATOM 23119 H1 SOL 2672 19.000 57.320 68.580 1.00 0.00 ATOM 23120 H2 SOL 2672 20.450 57.450 68.170 1.00 0.00 ATOM 23121 OH2 SOL 2673 37.410 12.170 13.570 1.00 0.00 ATOM 23122 H1 SOL 2673 37.780 11.310 13.370 1.00 0.00 ATOM 23123 H2 SOL 2673 38.130 12.780 13.400 1.00 0.00 ATOM 23124 OH2 SOL 2674 1.740 44.650 62.550 1.00 0.00 ATOM 23125 H1 SOL 2674 2.690 44.750 62.460 1.00 0.00 ATOM 23126 H2 SOL 2674 1.380 45.180 61.840 1.00 0.00 ATOM 23127 OH2 SOL 2675 48.380 57.460 68.350 1.00 0.00 ATOM 23128 H1 SOL 2675 48.640 56.680 67.850 1.00 0.00 ATOM 23129 H2 SOL 2675 47.430 57.370 68.460 1.00 0.00 ATOM 23130 OH2 SOL 2676 46.140 33.970 79.070 1.00 0.00 ATOM 23131 H1 SOL 2676 46.810 33.480 78.590 1.00 0.00 ATOM 23132 H2 SOL 2676 46.450 34.870 79.070 1.00 0.00 ATOM 23133 OH2 SOL 2677 37.750 16.510 9.000 1.00 0.00 ATOM 23134 H1 SOL 2677 38.690 16.300 9.040 1.00 0.00 ATOM 23135 H2 SOL 2677 37.650 17.280 9.550 1.00 0.00 ATOM 23136 OH2 SOL 2678 51.200 12.870 21.670 1.00 0.00 ATOM 23137 H1 SOL 2678 51.470 13.240 20.830 1.00 0.00 ATOM 23138 H2 SOL 2678 50.320 13.220 21.820 1.00 0.00 ATOM 23139 OH2 SOL 2679 5.650 29.230 21.920 1.00 0.00 ATOM 23140 H1 SOL 2679 5.690 28.870 21.030 1.00 0.00 ATOM 23141 H2 SOL 2679 5.200 28.550 22.430 1.00 0.00 ATOM 23142 OH2 SOL 2680 46.160 20.550 78.100 1.00 0.00 ATOM 23143 H1 SOL 2680 46.540 21.320 78.520 1.00 0.00 ATOM 23144 H2 SOL 2680 46.100 20.790 77.180 1.00 0.00 ATOM 23145 OH2 SOL 2681 4.840 15.420 79.320 1.00 0.00 ATOM 23146 H1 SOL 2681 4.220 14.820 79.740 1.00 0.00 ATOM 23147 H2 SOL 2681 5.630 15.360 79.860 1.00 0.00 ATOM 23148 OH2 SOL 2682 59.500 11.930 4.740 1.00 0.00 ATOM 23149 H1 SOL 2682 59.190 11.110 4.360 1.00 0.00 ATOM 23150 H2 SOL 2682 58.740 12.500 4.750 1.00 0.00 ATOM 23151 OH2 SOL 2683 7.600 12.440 75.060 1.00 0.00 ATOM 23152 H1 SOL 2683 8.180 13.000 75.580 1.00 0.00 ATOM 23153 H2 SOL 2683 6.730 12.600 75.410 1.00 0.00 ATOM 23154 OH2 SOL 2684 37.440 2.020 80.610 1.00 0.00 ATOM 23155 H1 SOL 2684 37.250 2.900 80.960 1.00 0.00 ATOM 23156 H2 SOL 2684 36.570 1.650 80.420 1.00 0.00 ATOM 23157 OH2 SOL 2685 55.930 47.090 71.490 1.00 0.00 ATOM 23158 H1 SOL 2685 55.910 47.910 71.980 1.00 0.00 ATOM 23159 H2 SOL 2685 55.440 46.470 72.030 1.00 0.00 ATOM 23160 OH2 SOL 2686 2.450 49.290 10.390 1.00 0.00 ATOM 23161 H1 SOL 2686 2.270 49.870 11.130 1.00 0.00 ATOM 23162 H2 SOL 2686 2.020 48.460 10.620 1.00 0.00 ATOM 23163 OH2 SOL 2687 13.730 28.910 4.680 1.00 0.00 ATOM 23164 H1 SOL 2687 14.600 28.990 5.070 1.00 0.00 ATOM 23165 H2 SOL 2687 13.820 29.290 3.810 1.00 0.00 ATOM 23166 OH2 SOL 2688 31.680 6.160 2.930 1.00 0.00 ATOM 23167 H1 SOL 2688 31.790 5.250 2.640 1.00 0.00 ATOM 23168 H2 SOL 2688 30.810 6.400 2.640 1.00 0.00 ATOM 23169 OH2 SOL 2689 17.740 59.270 20.380 1.00 0.00 ATOM 23170 H1 SOL 2689 17.750 59.720 19.530 1.00 0.00 ATOM 23171 H2 SOL 2689 17.520 59.960 21.000 1.00 0.00 ATOM 23172 OH2 SOL 2690 28.490 52.820 7.620 1.00 0.00 ATOM 23173 H1 SOL 2690 29.240 52.260 7.420 1.00 0.00 ATOM 23174 H2 SOL 2690 27.810 52.530 7.020 1.00 0.00 ATOM 23175 OH2 SOL 2691 21.690 15.580 73.690 1.00 0.00 ATOM 23176 H1 SOL 2691 21.310 15.220 72.890 1.00 0.00 ATOM 23177 H2 SOL 2691 22.540 15.930 73.410 1.00 0.00 ATOM 23178 OH2 SOL 2692 43.690 1.410 1.880 1.00 0.00 ATOM 23179 H1 SOL 2692 43.390 2.240 2.250 1.00 0.00 ATOM 23180 H2 SOL 2692 43.860 1.620 0.960 1.00 0.00 ATOM 23181 OH2 SOL 2693 0.440 24.080 76.970 1.00 0.00 ATOM 23182 H1 SOL 2693 -0.460 24.310 76.710 1.00 0.00 ATOM 23183 H2 SOL 2693 0.920 24.900 76.870 1.00 0.00 ATOM 23184 OH2 SOL 2694 48.700 5.080 71.490 1.00 0.00 ATOM 23185 H1 SOL 2694 48.120 4.480 71.030 1.00 0.00 ATOM 23186 H2 SOL 2694 48.700 5.870 70.950 1.00 0.00 ATOM 23187 OH2 SOL 2695 24.710 10.800 69.070 1.00 0.00 ATOM 23188 H1 SOL 2695 23.760 10.760 69.190 1.00 0.00 ATOM 23189 H2 SOL 2695 25.000 9.890 69.160 1.00 0.00 ATOM 23190 OH2 SOL 2696 40.390 57.000 12.340 1.00 0.00 ATOM 23191 H1 SOL 2696 40.540 57.120 13.280 1.00 0.00 ATOM 23192 H2 SOL 2696 41.140 57.430 11.920 1.00 0.00 ATOM 23193 OH2 SOL 2697 33.160 13.000 16.670 1.00 0.00 ATOM 23194 H1 SOL 2697 33.470 13.640 16.020 1.00 0.00 ATOM 23195 H2 SOL 2697 33.820 12.300 16.650 1.00 0.00 ATOM 23196 OH2 SOL 2698 2.500 49.580 69.190 1.00 0.00 ATOM 23197 H1 SOL 2698 3.010 50.100 69.810 1.00 0.00 ATOM 23198 H2 SOL 2698 3.120 48.950 68.830 1.00 0.00 ATOM 23199 OH2 SOL 2699 15.390 17.810 64.320 1.00 0.00 ATOM 23200 H1 SOL 2699 16.050 18.380 63.940 1.00 0.00 ATOM 23201 H2 SOL 2699 15.890 17.150 64.810 1.00 0.00 ATOM 23202 OH2 SOL 2700 43.020 27.600 11.490 1.00 0.00 ATOM 23203 H1 SOL 2700 43.350 28.090 12.250 1.00 0.00 ATOM 23204 H2 SOL 2700 42.080 27.760 11.490 1.00 0.00 ATOM 23205 OH2 SOL 2701 16.000 55.310 15.900 1.00 0.00 ATOM 23206 H1 SOL 2701 16.650 55.810 15.410 1.00 0.00 ATOM 23207 H2 SOL 2701 16.180 55.510 16.820 1.00 0.00 ATOM 23208 OH2 SOL 2702 53.030 35.300 16.070 1.00 0.00 ATOM 23209 H1 SOL 2702 52.150 35.400 16.420 1.00 0.00 ATOM 23210 H2 SOL 2702 53.010 35.770 15.230 1.00 0.00 ATOM 23211 OH2 SOL 2703 49.850 32.530 80.930 1.00 0.00 ATOM 23212 H1 SOL 2703 49.460 31.770 80.480 1.00 0.00 ATOM 23213 H2 SOL 2703 50.640 32.180 81.340 1.00 0.00 ATOM 23214 OH2 SOL 2704 31.820 47.600 3.890 1.00 0.00 ATOM 23215 H1 SOL 2704 32.780 47.560 3.920 1.00 0.00 ATOM 23216 H2 SOL 2704 31.540 47.500 4.800 1.00 0.00 ATOM 23217 OH2 SOL 2705 7.030 33.160 2.040 1.00 0.00 ATOM 23218 H1 SOL 2705 6.390 33.770 1.680 1.00 0.00 ATOM 23219 H2 SOL 2705 7.190 33.480 2.930 1.00 0.00 ATOM 23220 OH2 SOL 2706 55.870 54.770 7.310 1.00 0.00 ATOM 23221 H1 SOL 2706 56.480 54.060 7.120 1.00 0.00 ATOM 23222 H2 SOL 2706 55.370 54.870 6.490 1.00 0.00 ATOM 23223 OH2 SOL 2707 3.630 41.690 1.520 1.00 0.00 ATOM 23224 H1 SOL 2707 4.110 41.430 2.310 1.00 0.00 ATOM 23225 H2 SOL 2707 3.270 42.550 1.730 1.00 0.00 ATOM 23226 OH2 SOL 2708 4.030 24.820 80.480 1.00 0.00 ATOM 23227 H1 SOL 2708 3.910 23.910 80.760 1.00 0.00 ATOM 23228 H2 SOL 2708 4.450 25.240 81.230 1.00 0.00 ATOM 23229 OH2 SOL 2709 12.460 7.030 65.750 1.00 0.00 ATOM 23230 H1 SOL 2709 12.190 6.450 65.030 1.00 0.00 ATOM 23231 H2 SOL 2709 13.280 6.660 66.070 1.00 0.00 ATOM 23232 OH2 SOL 2710 20.770 47.620 24.940 1.00 0.00 ATOM 23233 H1 SOL 2710 20.890 48.570 24.970 1.00 0.00 ATOM 23234 H2 SOL 2710 19.840 47.480 25.140 1.00 0.00 ATOM 23235 OH2 SOL 2711 53.020 18.670 9.240 1.00 0.00 ATOM 23236 H1 SOL 2711 53.540 19.330 9.690 1.00 0.00 ATOM 23237 H2 SOL 2711 52.250 19.140 8.920 1.00 0.00 ATOM 23238 OH2 SOL 2712 29.460 24.640 79.000 1.00 0.00 ATOM 23239 H1 SOL 2712 28.650 24.170 78.800 1.00 0.00 ATOM 23240 H2 SOL 2712 29.850 24.820 78.140 1.00 0.00 ATOM 23241 OH2 SOL 2713 16.480 24.240 69.520 1.00 0.00 ATOM 23242 H1 SOL 2713 15.900 23.640 69.040 1.00 0.00 ATOM 23243 H2 SOL 2713 15.920 24.630 70.190 1.00 0.00 ATOM 23244 OH2 SOL 2714 26.560 0.750 4.500 1.00 0.00 ATOM 23245 H1 SOL 2714 27.040 0.550 3.690 1.00 0.00 ATOM 23246 H2 SOL 2714 26.370 1.690 4.440 1.00 0.00 ATOM 23247 OH2 SOL 2715 24.290 37.940 7.930 1.00 0.00 ATOM 23248 H1 SOL 2715 25.150 38.200 8.270 1.00 0.00 ATOM 23249 H2 SOL 2715 23.670 38.480 8.430 1.00 0.00 ATOM 23250 OH2 SOL 2716 33.300 17.430 66.980 1.00 0.00 ATOM 23251 H1 SOL 2716 33.520 17.430 67.910 1.00 0.00 ATOM 23252 H2 SOL 2716 32.620 18.090 66.890 1.00 0.00 ATOM 23253 OH2 SOL 2717 7.200 27.350 3.630 1.00 0.00 ATOM 23254 H1 SOL 2717 7.190 26.400 3.730 1.00 0.00 ATOM 23255 H2 SOL 2717 6.290 27.620 3.770 1.00 0.00 ATOM 23256 OH2 SOL 2718 33.970 -0.140 4.210 1.00 0.00 ATOM 23257 H1 SOL 2718 33.360 0.550 4.450 1.00 0.00 ATOM 23258 H2 SOL 2718 34.300 0.120 3.350 1.00 0.00 ATOM 23259 OH2 SOL 2719 54.150 15.400 81.990 1.00 0.00 ATOM 23260 H1 SOL 2719 54.930 14.860 82.120 1.00 0.00 ATOM 23261 H2 SOL 2719 54.140 15.570 81.050 1.00 0.00 ATOM 23262 OH2 SOL 2720 9.380 35.030 67.220 1.00 0.00 ATOM 23263 H1 SOL 2720 10.290 34.920 66.950 1.00 0.00 ATOM 23264 H2 SOL 2720 9.220 35.970 67.130 1.00 0.00 ATOM 23265 OH2 SOL 2721 15.070 54.310 0.720 1.00 0.00 ATOM 23266 H1 SOL 2721 14.570 53.710 1.270 1.00 0.00 ATOM 23267 H2 SOL 2721 14.480 54.530 -0.000 1.00 0.00 ATOM 23268 OH2 SOL 2722 50.730 39.830 23.100 1.00 0.00 ATOM 23269 H1 SOL 2722 50.360 39.820 22.210 1.00 0.00 ATOM 23270 H2 SOL 2722 50.890 40.760 23.280 1.00 0.00 ATOM 23271 OH2 SOL 2723 10.120 30.610 83.930 1.00 0.00 ATOM 23272 H1 SOL 2723 9.210 30.850 84.090 1.00 0.00 ATOM 23273 H2 SOL 2723 10.450 30.350 84.790 1.00 0.00 ATOM 23274 OH2 SOL 2724 40.370 50.310 79.840 1.00 0.00 ATOM 23275 H1 SOL 2724 40.880 49.750 79.250 1.00 0.00 ATOM 23276 H2 SOL 2724 40.110 49.730 80.560 1.00 0.00 ATOM 23277 OH2 SOL 2725 6.740 17.570 10.700 1.00 0.00 ATOM 23278 H1 SOL 2725 6.930 16.780 11.220 1.00 0.00 ATOM 23279 H2 SOL 2725 6.110 18.060 11.230 1.00 0.00 ATOM 23280 OH2 SOL 2726 37.330 29.400 -0.210 1.00 0.00 ATOM 23281 H1 SOL 2726 38.110 29.170 0.290 1.00 0.00 ATOM 23282 H2 SOL 2726 36.800 29.930 0.390 1.00 0.00 ATOM 23283 OH2 SOL 2727 0.720 34.280 67.510 1.00 0.00 ATOM 23284 H1 SOL 2727 1.230 34.460 66.720 1.00 0.00 ATOM 23285 H2 SOL 2727 -0.150 34.630 67.330 1.00 0.00 ATOM 23286 OH2 SOL 2728 35.920 49.090 17.510 1.00 0.00 ATOM 23287 H1 SOL 2728 35.560 48.880 18.370 1.00 0.00 ATOM 23288 H2 SOL 2728 35.880 48.270 17.020 1.00 0.00 ATOM 23289 OH2 SOL 2729 42.440 6.400 66.940 1.00 0.00 ATOM 23290 H1 SOL 2729 42.130 6.200 66.060 1.00 0.00 ATOM 23291 H2 SOL 2729 42.100 5.700 67.490 1.00 0.00 ATOM 23292 OH2 SOL 2730 24.530 25.570 73.670 1.00 0.00 ATOM 23293 H1 SOL 2730 24.730 26.200 74.360 1.00 0.00 ATOM 23294 H2 SOL 2730 23.580 25.590 73.590 1.00 0.00 ATOM 23295 OH2 SOL 2731 7.010 11.700 14.150 1.00 0.00 ATOM 23296 H1 SOL 2731 6.560 11.590 13.320 1.00 0.00 ATOM 23297 H2 SOL 2731 7.140 10.810 14.470 1.00 0.00 ATOM 23298 OH2 SOL 2732 36.140 57.910 4.070 1.00 0.00 ATOM 23299 H1 SOL 2732 36.650 58.710 4.010 1.00 0.00 ATOM 23300 H2 SOL 2732 36.510 57.340 3.400 1.00 0.00 ATOM 23301 OH2 SOL 2733 24.750 39.890 10.590 1.00 0.00 ATOM 23302 H1 SOL 2733 24.780 40.740 10.160 1.00 0.00 ATOM 23303 H2 SOL 2733 25.240 40.000 11.400 1.00 0.00 ATOM 23304 OH2 SOL 2734 12.180 27.130 80.500 1.00 0.00 ATOM 23305 H1 SOL 2734 12.730 27.650 79.910 1.00 0.00 ATOM 23306 H2 SOL 2734 11.740 27.780 81.050 1.00 0.00 ATOM 23307 OH2 SOL 2735 16.460 39.390 13.610 1.00 0.00 ATOM 23308 H1 SOL 2735 16.770 38.680 13.050 1.00 0.00 ATOM 23309 H2 SOL 2735 15.810 38.980 14.180 1.00 0.00 ATOM 23310 OH2 SOL 2736 26.190 2.350 21.560 1.00 0.00 ATOM 23311 H1 SOL 2736 26.490 1.980 20.730 1.00 0.00 ATOM 23312 H2 SOL 2736 26.950 2.840 21.880 1.00 0.00 ATOM 23313 OH2 SOL 2737 21.380 25.900 65.040 1.00 0.00 ATOM 23314 H1 SOL 2737 21.160 26.660 65.580 1.00 0.00 ATOM 23315 H2 SOL 2737 20.700 25.880 64.370 1.00 0.00 ATOM 23316 OH2 SOL 2738 2.250 7.450 81.130 1.00 0.00 ATOM 23317 H1 SOL 2738 1.730 6.680 80.900 1.00 0.00 ATOM 23318 H2 SOL 2738 2.800 7.150 81.860 1.00 0.00 ATOM 23319 OH2 SOL 2739 23.680 42.800 71.220 1.00 0.00 ATOM 23320 H1 SOL 2739 24.420 42.340 70.820 1.00 0.00 ATOM 23321 H2 SOL 2739 23.150 43.100 70.480 1.00 0.00 ATOM 23322 OH2 SOL 2740 26.410 26.950 0.840 1.00 0.00 ATOM 23323 H1 SOL 2740 27.360 26.940 0.690 1.00 0.00 ATOM 23324 H2 SOL 2740 26.140 27.830 0.600 1.00 0.00 ATOM 23325 OH2 SOL 2741 53.110 59.910 84.200 1.00 0.00 ATOM 23326 H1 SOL 2741 53.360 60.030 85.120 1.00 0.00 ATOM 23327 H2 SOL 2741 52.160 59.830 84.220 1.00 0.00 ATOM 23328 OH2 SOL 2742 16.130 56.850 64.750 1.00 0.00 ATOM 23329 H1 SOL 2742 16.600 57.620 65.070 1.00 0.00 ATOM 23330 H2 SOL 2742 16.540 56.110 65.210 1.00 0.00 ATOM 23331 OH2 SOL 2743 26.530 55.290 82.800 1.00 0.00 ATOM 23332 H1 SOL 2743 26.340 55.180 83.730 1.00 0.00 ATOM 23333 H2 SOL 2743 27.200 55.980 82.780 1.00 0.00 ATOM 23334 OH2 SOL 2744 35.610 2.340 63.740 1.00 0.00 ATOM 23335 H1 SOL 2744 35.260 3.230 63.840 1.00 0.00 ATOM 23336 H2 SOL 2744 36.310 2.290 64.390 1.00 0.00 ATOM 23337 OH2 SOL 2745 14.750 53.390 10.960 1.00 0.00 ATOM 23338 H1 SOL 2745 13.910 53.760 10.700 1.00 0.00 ATOM 23339 H2 SOL 2745 14.540 52.530 11.310 1.00 0.00 ATOM 23340 OH2 SOL 2746 4.610 56.960 72.900 1.00 0.00 ATOM 23341 H1 SOL 2746 4.520 57.830 72.510 1.00 0.00 ATOM 23342 H2 SOL 2746 5.230 56.500 72.330 1.00 0.00 ATOM 23343 OH2 SOL 2747 4.270 37.960 64.350 1.00 0.00 ATOM 23344 H1 SOL 2747 4.430 38.710 63.770 1.00 0.00 ATOM 23345 H2 SOL 2747 4.090 37.230 63.760 1.00 0.00 ATOM 23346 OH2 SOL 2748 41.370 19.750 13.600 1.00 0.00 ATOM 23347 H1 SOL 2748 41.510 19.740 14.550 1.00 0.00 ATOM 23348 H2 SOL 2748 40.880 20.560 13.440 1.00 0.00 ATOM 23349 OH2 SOL 2749 23.150 37.040 79.250 1.00 0.00 ATOM 23350 H1 SOL 2749 22.600 36.640 79.930 1.00 0.00 ATOM 23351 H2 SOL 2749 23.030 36.470 78.490 1.00 0.00 ATOM 23352 OH2 SOL 2750 1.260 43.890 83.690 1.00 0.00 ATOM 23353 H1 SOL 2750 2.180 43.820 83.950 1.00 0.00 ATOM 23354 H2 SOL 2750 1.150 44.820 83.480 1.00 0.00 ATOM 23355 OH2 SOL 2751 16.620 33.490 19.620 1.00 0.00 ATOM 23356 H1 SOL 2751 16.870 32.560 19.650 1.00 0.00 ATOM 23357 H2 SOL 2751 16.440 33.650 18.690 1.00 0.00 ATOM 23358 OH2 SOL 2752 42.760 53.340 9.710 1.00 0.00 ATOM 23359 H1 SOL 2752 42.490 53.380 8.800 1.00 0.00 ATOM 23360 H2 SOL 2752 43.560 53.860 9.750 1.00 0.00 ATOM 23361 OH2 SOL 2753 22.290 45.310 24.320 1.00 0.00 ATOM 23362 H1 SOL 2753 21.970 44.660 24.940 1.00 0.00 ATOM 23363 H2 SOL 2753 21.910 46.140 24.610 1.00 0.00 ATOM 23364 OH2 SOL 2754 52.770 51.750 70.490 1.00 0.00 ATOM 23365 H1 SOL 2754 52.070 51.740 71.150 1.00 0.00 ATOM 23366 H2 SOL 2754 52.850 52.670 70.240 1.00 0.00 ATOM 23367 OH2 SOL 2755 26.040 6.570 59.630 1.00 0.00 ATOM 23368 H1 SOL 2755 26.070 7.210 58.920 1.00 0.00 ATOM 23369 H2 SOL 2755 26.940 6.490 59.920 1.00 0.00 ATOM 23370 OH2 SOL 2756 25.620 16.030 8.560 1.00 0.00 ATOM 23371 H1 SOL 2756 25.110 15.440 8.000 1.00 0.00 ATOM 23372 H2 SOL 2756 25.150 16.860 8.520 1.00 0.00 ATOM 23373 OH2 SOL 2757 35.120 39.510 13.850 1.00 0.00 ATOM 23374 H1 SOL 2757 34.940 38.660 13.450 1.00 0.00 ATOM 23375 H2 SOL 2757 35.290 40.100 13.120 1.00 0.00 ATOM 23376 OH2 SOL 2758 51.100 58.620 80.270 1.00 0.00 ATOM 23377 H1 SOL 2758 51.190 57.930 79.610 1.00 0.00 ATOM 23378 H2 SOL 2758 51.940 58.640 80.710 1.00 0.00 ATOM 23379 OH2 SOL 2759 54.530 27.770 16.240 1.00 0.00 ATOM 23380 H1 SOL 2759 53.960 28.410 15.820 1.00 0.00 ATOM 23381 H2 SOL 2759 55.410 28.140 16.150 1.00 0.00 ATOM 23382 OH2 SOL 2760 35.840 53.850 68.880 1.00 0.00 ATOM 23383 H1 SOL 2760 36.030 53.160 68.250 1.00 0.00 ATOM 23384 H2 SOL 2760 34.880 53.840 68.960 1.00 0.00 ATOM 23385 OH2 SOL 2761 46.470 12.960 0.610 1.00 0.00 ATOM 23386 H1 SOL 2761 46.060 13.540 -0.030 1.00 0.00 ATOM 23387 H2 SOL 2761 46.940 13.550 1.200 1.00 0.00 ATOM 23388 OH2 SOL 2762 21.720 20.070 83.000 1.00 0.00 ATOM 23389 H1 SOL 2762 22.670 19.990 83.130 1.00 0.00 ATOM 23390 H2 SOL 2762 21.460 20.770 83.600 1.00 0.00 ATOM 23391 OH2 SOL 2763 13.910 7.030 5.360 1.00 0.00 ATOM 23392 H1 SOL 2763 14.150 7.750 5.950 1.00 0.00 ATOM 23393 H2 SOL 2763 14.520 7.100 4.630 1.00 0.00 ATOM 23394 OH2 SOL 2764 5.870 40.260 71.960 1.00 0.00 ATOM 23395 H1 SOL 2764 5.910 41.050 71.430 1.00 0.00 ATOM 23396 H2 SOL 2764 4.960 39.970 71.910 1.00 0.00 ATOM 23397 OH2 SOL 2765 38.640 11.500 18.060 1.00 0.00 ATOM 23398 H1 SOL 2765 38.200 10.720 18.390 1.00 0.00 ATOM 23399 H2 SOL 2765 38.800 11.310 17.130 1.00 0.00 ATOM 23400 OH2 SOL 2766 13.520 14.020 79.120 1.00 0.00 ATOM 23401 H1 SOL 2766 12.870 14.440 78.560 1.00 0.00 ATOM 23402 H2 SOL 2766 13.580 14.600 79.880 1.00 0.00 ATOM 23403 OH2 SOL 2767 47.820 44.160 78.410 1.00 0.00 ATOM 23404 H1 SOL 2767 48.700 44.000 78.050 1.00 0.00 ATOM 23405 H2 SOL 2767 47.490 43.280 78.610 1.00 0.00 ATOM 23406 OH2 SOL 2768 39.610 58.000 19.460 1.00 0.00 ATOM 23407 H1 SOL 2768 39.260 58.050 20.350 1.00 0.00 ATOM 23408 H2 SOL 2768 39.110 57.300 19.050 1.00 0.00 ATOM 23409 OH2 SOL 2769 47.250 51.310 2.710 1.00 0.00 ATOM 23410 H1 SOL 2769 47.460 50.410 2.950 1.00 0.00 ATOM 23411 H2 SOL 2769 47.940 51.840 3.110 1.00 0.00 ATOM 23412 OH2 SOL 2770 39.000 60.760 0.860 1.00 0.00 ATOM 23413 H1 SOL 2770 38.440 60.840 0.090 1.00 0.00 ATOM 23414 H2 SOL 2770 39.850 60.490 0.520 1.00 0.00 ATOM 23415 OH2 SOL 2771 0.300 43.090 64.440 1.00 0.00 ATOM 23416 H1 SOL 2771 0.400 42.170 64.210 1.00 0.00 ATOM 23417 H2 SOL 2771 0.860 43.550 63.810 1.00 0.00 ATOM 23418 OH2 SOL 2772 11.340 52.100 74.410 1.00 0.00 ATOM 23419 H1 SOL 2772 11.260 51.270 74.880 1.00 0.00 ATOM 23420 H2 SOL 2772 11.510 52.750 75.100 1.00 0.00 ATOM 23421 OH2 SOL 2773 55.200 54.650 82.220 1.00 0.00 ATOM 23422 H1 SOL 2773 55.890 55.120 82.690 1.00 0.00 ATOM 23423 H2 SOL 2773 54.850 55.300 81.610 1.00 0.00 ATOM 23424 OH2 SOL 2774 57.000 28.820 71.800 1.00 0.00 ATOM 23425 H1 SOL 2774 56.490 28.670 72.600 1.00 0.00 ATOM 23426 H2 SOL 2774 57.370 27.970 71.590 1.00 0.00 ATOM 23427 OH2 SOL 2775 33.360 31.160 5.540 1.00 0.00 ATOM 23428 H1 SOL 2775 32.500 31.080 5.130 1.00 0.00 ATOM 23429 H2 SOL 2775 33.740 30.290 5.470 1.00 0.00 ATOM 23430 OH2 SOL 2776 16.000 4.540 80.160 1.00 0.00 ATOM 23431 H1 SOL 2776 15.570 4.400 79.320 1.00 0.00 ATOM 23432 H2 SOL 2776 15.280 4.530 80.800 1.00 0.00 ATOM 23433 OH2 SOL 2777 56.580 26.940 78.570 1.00 0.00 ATOM 23434 H1 SOL 2777 56.500 26.400 77.780 1.00 0.00 ATOM 23435 H2 SOL 2777 56.950 26.360 79.230 1.00 0.00 ATOM 23436 OH2 SOL 2778 17.800 9.840 74.670 1.00 0.00 ATOM 23437 H1 SOL 2778 17.020 10.060 74.160 1.00 0.00 ATOM 23438 H2 SOL 2778 18.040 8.960 74.370 1.00 0.00 ATOM 23439 OH2 SOL 2779 28.350 47.130 18.870 1.00 0.00 ATOM 23440 H1 SOL 2779 28.460 47.300 17.930 1.00 0.00 ATOM 23441 H2 SOL 2779 27.500 46.700 18.940 1.00 0.00 ATOM 23442 OH2 SOL 2780 4.470 21.350 12.730 1.00 0.00 ATOM 23443 H1 SOL 2780 4.180 22.090 13.260 1.00 0.00 ATOM 23444 H2 SOL 2780 5.410 21.290 12.900 1.00 0.00 ATOM 23445 OH2 SOL 2781 36.770 39.950 73.160 1.00 0.00 ATOM 23446 H1 SOL 2781 35.890 39.580 73.190 1.00 0.00 ATOM 23447 H2 SOL 2781 36.750 40.560 72.420 1.00 0.00 ATOM 23448 OH2 SOL 2782 23.300 35.050 14.210 1.00 0.00 ATOM 23449 H1 SOL 2782 22.680 35.000 14.930 1.00 0.00 ATOM 23450 H2 SOL 2782 24.010 34.460 14.470 1.00 0.00 ATOM 23451 OH2 SOL 2783 3.760 3.260 59.500 1.00 0.00 ATOM 23452 H1 SOL 2783 4.030 3.130 60.410 1.00 0.00 ATOM 23453 H2 SOL 2783 3.220 2.490 59.310 1.00 0.00 ATOM 23454 OH2 SOL 2784 39.250 6.340 5.310 1.00 0.00 ATOM 23455 H1 SOL 2784 38.310 6.490 5.410 1.00 0.00 ATOM 23456 H2 SOL 2784 39.360 5.400 5.420 1.00 0.00 ATOM 23457 OH2 SOL 2785 7.120 6.880 81.670 1.00 0.00 ATOM 23458 H1 SOL 2785 7.270 7.520 82.370 1.00 0.00 ATOM 23459 H2 SOL 2785 6.680 6.150 82.100 1.00 0.00 ATOM 23460 OH2 SOL 2786 11.320 2.920 63.180 1.00 0.00 ATOM 23461 H1 SOL 2786 11.070 2.320 62.470 1.00 0.00 ATOM 23462 H2 SOL 2786 10.820 2.630 63.930 1.00 0.00 ATOM 23463 OH2 SOL 2787 42.650 56.850 65.620 1.00 0.00 ATOM 23464 H1 SOL 2787 42.220 56.940 66.470 1.00 0.00 ATOM 23465 H2 SOL 2787 43.000 57.730 65.440 1.00 0.00 ATOM 23466 OH2 SOL 2788 10.440 8.450 12.350 1.00 0.00 ATOM 23467 H1 SOL 2788 10.330 8.200 13.260 1.00 0.00 ATOM 23468 H2 SOL 2788 10.780 9.350 12.380 1.00 0.00 ATOM 23469 OH2 SOL 2789 56.590 21.650 80.610 1.00 0.00 ATOM 23470 H1 SOL 2789 56.320 22.410 80.110 1.00 0.00 ATOM 23471 H2 SOL 2789 56.290 20.900 80.090 1.00 0.00 ATOM 23472 OH2 SOL 2790 6.380 54.550 71.760 1.00 0.00 ATOM 23473 H1 SOL 2790 7.300 54.730 71.530 1.00 0.00 ATOM 23474 H2 SOL 2790 6.410 53.720 72.240 1.00 0.00 ATOM 23475 OH2 SOL 2791 29.980 6.130 73.600 1.00 0.00 ATOM 23476 H1 SOL 2791 29.920 6.580 72.760 1.00 0.00 ATOM 23477 H2 SOL 2791 29.560 6.730 74.220 1.00 0.00 ATOM 23478 OH2 SOL 2792 0.590 61.000 5.400 1.00 0.00 ATOM 23479 H1 SOL 2792 1.260 60.600 5.960 1.00 0.00 ATOM 23480 H2 SOL 2792 -0.140 60.380 5.410 1.00 0.00 ATOM 23481 OH2 SOL 2793 44.480 57.320 81.390 1.00 0.00 ATOM 23482 H1 SOL 2793 44.170 56.660 82.010 1.00 0.00 ATOM 23483 H2 SOL 2793 45.220 56.910 80.940 1.00 0.00 ATOM 23484 OH2 SOL 2794 28.680 36.080 11.480 1.00 0.00 ATOM 23485 H1 SOL 2794 28.330 35.690 10.680 1.00 0.00 ATOM 23486 H2 SOL 2794 29.050 36.920 11.190 1.00 0.00 ATOM 23487 OH2 SOL 2795 21.830 24.360 78.690 1.00 0.00 ATOM 23488 H1 SOL 2795 21.860 23.730 79.410 1.00 0.00 ATOM 23489 H2 SOL 2795 22.260 25.140 79.030 1.00 0.00 ATOM 23490 OH2 SOL 2796 16.430 26.910 10.550 1.00 0.00 ATOM 23491 H1 SOL 2796 16.010 27.340 11.300 1.00 0.00 ATOM 23492 H2 SOL 2796 17.360 27.090 10.660 1.00 0.00 ATOM 23493 OH2 SOL 2797 13.550 13.140 13.920 1.00 0.00 ATOM 23494 H1 SOL 2797 14.070 13.830 14.320 1.00 0.00 ATOM 23495 H2 SOL 2797 12.680 13.240 14.310 1.00 0.00 ATOM 23496 OH2 SOL 2798 1.800 10.820 73.020 1.00 0.00 ATOM 23497 H1 SOL 2798 1.010 10.620 73.530 1.00 0.00 ATOM 23498 H2 SOL 2798 2.420 10.130 73.270 1.00 0.00 ATOM 23499 OH2 SOL 2799 54.460 26.410 21.740 1.00 0.00 ATOM 23500 H1 SOL 2799 55.080 27.050 21.390 1.00 0.00 ATOM 23501 H2 SOL 2799 53.780 26.350 21.070 1.00 0.00 ATOM 23502 OH2 SOL 2800 40.410 22.160 12.950 1.00 0.00 ATOM 23503 H1 SOL 2800 39.520 22.410 12.680 1.00 0.00 ATOM 23504 H2 SOL 2800 40.770 22.960 13.340 1.00 0.00 ATOM 23505 OH2 SOL 2801 24.640 26.590 9.840 1.00 0.00 ATOM 23506 H1 SOL 2801 25.340 27.210 10.040 1.00 0.00 ATOM 23507 H2 SOL 2801 23.980 27.110 9.380 1.00 0.00 ATOM 23508 OH2 SOL 2802 0.090 26.210 19.530 1.00 0.00 ATOM 23509 H1 SOL 2802 -0.230 26.270 18.630 1.00 0.00 ATOM 23510 H2 SOL 2802 1.000 26.510 19.480 1.00 0.00 ATOM 23511 OH2 SOL 2803 59.080 49.050 11.850 1.00 0.00 ATOM 23512 H1 SOL 2803 59.150 49.340 12.760 1.00 0.00 ATOM 23513 H2 SOL 2803 59.920 48.610 11.680 1.00 0.00 ATOM 23514 OH2 SOL 2804 11.070 20.090 82.580 1.00 0.00 ATOM 23515 H1 SOL 2804 11.800 20.510 83.040 1.00 0.00 ATOM 23516 H2 SOL 2804 11.260 20.230 81.650 1.00 0.00 ATOM 23517 OH2 SOL 2805 2.990 54.360 9.510 1.00 0.00 ATOM 23518 H1 SOL 2805 3.060 53.940 10.370 1.00 0.00 ATOM 23519 H2 SOL 2805 2.640 53.680 8.940 1.00 0.00 ATOM 23520 OH2 SOL 2806 57.720 21.700 72.650 1.00 0.00 ATOM 23521 H1 SOL 2806 57.270 21.670 73.500 1.00 0.00 ATOM 23522 H2 SOL 2806 57.100 21.300 72.040 1.00 0.00 ATOM 23523 OH2 SOL 2807 8.690 35.400 77.250 1.00 0.00 ATOM 23524 H1 SOL 2807 8.440 35.860 78.050 1.00 0.00 ATOM 23525 H2 SOL 2807 7.900 35.390 76.720 1.00 0.00 ATOM 23526 OH2 SOL 2808 45.270 41.830 13.120 1.00 0.00 ATOM 23527 H1 SOL 2808 45.850 42.580 13.250 1.00 0.00 ATOM 23528 H2 SOL 2808 45.390 41.590 12.200 1.00 0.00 ATOM 23529 OH2 SOL 2809 51.210 42.830 68.860 1.00 0.00 ATOM 23530 H1 SOL 2809 51.860 42.380 68.320 1.00 0.00 ATOM 23531 H2 SOL 2809 51.250 43.750 68.580 1.00 0.00 ATOM 23532 OH2 SOL 2810 52.270 47.710 76.250 1.00 0.00 ATOM 23533 H1 SOL 2810 51.500 47.320 75.830 1.00 0.00 ATOM 23534 H2 SOL 2810 51.930 48.080 77.070 1.00 0.00 ATOM 23535 OH2 SOL 2811 23.160 13.650 0.830 1.00 0.00 ATOM 23536 H1 SOL 2811 22.290 14.020 0.720 1.00 0.00 ATOM 23537 H2 SOL 2811 23.570 14.200 1.510 1.00 0.00 ATOM 23538 OH2 SOL 2812 43.060 15.220 82.170 1.00 0.00 ATOM 23539 H1 SOL 2812 42.150 15.530 82.130 1.00 0.00 ATOM 23540 H2 SOL 2812 43.000 14.290 81.990 1.00 0.00 ATOM 23541 OH2 SOL 2813 3.620 43.910 75.580 1.00 0.00 ATOM 23542 H1 SOL 2813 3.990 43.940 76.460 1.00 0.00 ATOM 23543 H2 SOL 2813 2.720 44.240 75.690 1.00 0.00 ATOM 23544 OH2 SOL 2814 17.870 52.920 24.610 1.00 0.00 ATOM 23545 H1 SOL 2814 16.920 52.870 24.500 1.00 0.00 ATOM 23546 H2 SOL 2814 18.000 53.540 25.330 1.00 0.00 ATOM 23547 OH2 SOL 2815 46.030 22.700 69.920 1.00 0.00 ATOM 23548 H1 SOL 2815 46.440 22.560 69.070 1.00 0.00 ATOM 23549 H2 SOL 2815 45.120 22.900 69.710 1.00 0.00 ATOM 23550 OH2 SOL 2816 3.640 30.630 3.360 1.00 0.00 ATOM 23551 H1 SOL 2816 4.090 30.070 2.720 1.00 0.00 ATOM 23552 H2 SOL 2816 2.950 30.070 3.710 1.00 0.00 ATOM 23553 OH2 SOL 2817 37.600 30.830 67.790 1.00 0.00 ATOM 23554 H1 SOL 2817 37.080 30.510 67.050 1.00 0.00 ATOM 23555 H2 SOL 2817 37.100 31.570 68.140 1.00 0.00 ATOM 23556 OH2 SOL 2818 29.820 33.590 18.470 1.00 0.00 ATOM 23557 H1 SOL 2818 30.590 34.100 18.210 1.00 0.00 ATOM 23558 H2 SOL 2818 30.180 32.760 18.790 1.00 0.00 ATOM 23559 OH2 SOL 2819 47.870 20.380 70.410 1.00 0.00 ATOM 23560 H1 SOL 2819 47.230 21.060 70.210 1.00 0.00 ATOM 23561 H2 SOL 2819 47.390 19.560 70.310 1.00 0.00 ATOM 23562 OH2 SOL 2820 13.200 30.780 80.650 1.00 0.00 ATOM 23563 H1 SOL 2820 12.550 31.090 81.280 1.00 0.00 ATOM 23564 H2 SOL 2820 14.020 30.780 81.140 1.00 0.00 ATOM 23565 OH2 SOL 2821 55.350 57.110 64.340 1.00 0.00 ATOM 23566 H1 SOL 2821 55.200 57.950 63.930 1.00 0.00 ATOM 23567 H2 SOL 2821 54.880 56.480 63.800 1.00 0.00 ATOM 23568 OH2 SOL 2822 51.970 36.800 7.100 1.00 0.00 ATOM 23569 H1 SOL 2822 52.040 37.280 6.280 1.00 0.00 ATOM 23570 H2 SOL 2822 52.620 37.210 7.670 1.00 0.00 ATOM 23571 OH2 SOL 2823 13.920 39.650 61.630 1.00 0.00 ATOM 23572 H1 SOL 2823 13.700 40.260 60.930 1.00 0.00 ATOM 23573 H2 SOL 2823 14.280 38.880 61.180 1.00 0.00 ATOM 23574 OH2 SOL 2824 59.010 39.060 71.710 1.00 0.00 ATOM 23575 H1 SOL 2824 58.930 39.280 70.790 1.00 0.00 ATOM 23576 H2 SOL 2824 58.990 38.100 71.720 1.00 0.00 ATOM 23577 OH2 SOL 2825 48.040 39.520 2.690 1.00 0.00 ATOM 23578 H1 SOL 2825 48.990 39.450 2.770 1.00 0.00 ATOM 23579 H2 SOL 2825 47.860 40.460 2.790 1.00 0.00 ATOM 23580 OH2 SOL 2826 48.780 17.940 62.930 1.00 0.00 ATOM 23581 H1 SOL 2826 47.910 17.560 63.070 1.00 0.00 ATOM 23582 H2 SOL 2826 49.340 17.190 62.750 1.00 0.00 ATOM 23583 OH2 SOL 2827 37.860 17.980 67.970 1.00 0.00 ATOM 23584 H1 SOL 2827 37.020 18.430 68.050 1.00 0.00 ATOM 23585 H2 SOL 2827 37.870 17.670 67.060 1.00 0.00 ATOM 23586 OH2 SOL 2828 31.970 11.820 10.440 1.00 0.00 ATOM 23587 H1 SOL 2828 32.360 12.180 9.650 1.00 0.00 ATOM 23588 H2 SOL 2828 32.430 10.980 10.570 1.00 0.00 ATOM 23589 OH2 SOL 2829 58.050 56.780 15.000 1.00 0.00 ATOM 23590 H1 SOL 2829 58.020 55.850 15.240 1.00 0.00 ATOM 23591 H2 SOL 2829 58.860 56.860 14.490 1.00 0.00 ATOM 23592 OH2 SOL 2830 30.190 48.810 83.960 1.00 0.00 ATOM 23593 H1 SOL 2830 31.020 48.390 84.190 1.00 0.00 ATOM 23594 H2 SOL 2830 29.780 49.010 84.800 1.00 0.00 ATOM 23595 OH2 SOL 2831 43.320 13.200 67.100 1.00 0.00 ATOM 23596 H1 SOL 2831 43.840 12.410 67.220 1.00 0.00 ATOM 23597 H2 SOL 2831 43.290 13.610 67.960 1.00 0.00 ATOM 23598 OH2 SOL 2832 34.080 24.810 84.740 1.00 0.00 ATOM 23599 H1 SOL 2832 33.290 24.570 84.250 1.00 0.00 ATOM 23600 H2 SOL 2832 34.600 25.320 84.130 1.00 0.00 ATOM 23601 OH2 SOL 2833 16.310 46.800 66.190 1.00 0.00 ATOM 23602 H1 SOL 2833 16.290 46.530 67.110 1.00 0.00 ATOM 23603 H2 SOL 2833 15.570 46.340 65.790 1.00 0.00 ATOM 23604 OH2 SOL 2834 16.290 23.180 5.640 1.00 0.00 ATOM 23605 H1 SOL 2834 15.710 22.430 5.800 1.00 0.00 ATOM 23606 H2 SOL 2834 15.770 23.770 5.100 1.00 0.00 ATOM 23607 OH2 SOL 2835 5.900 32.390 9.940 1.00 0.00 ATOM 23608 H1 SOL 2835 6.400 31.580 10.000 1.00 0.00 ATOM 23609 H2 SOL 2835 5.020 32.100 9.690 1.00 0.00 ATOM 23610 OH2 SOL 2836 51.830 37.970 19.430 1.00 0.00 ATOM 23611 H1 SOL 2836 51.600 38.790 19.870 1.00 0.00 ATOM 23612 H2 SOL 2836 51.990 37.360 20.150 1.00 0.00 ATOM 23613 OH2 SOL 2837 13.250 39.610 64.270 1.00 0.00 ATOM 23614 H1 SOL 2837 14.130 39.570 64.630 1.00 0.00 ATOM 23615 H2 SOL 2837 13.370 39.490 63.330 1.00 0.00 ATOM 23616 OH2 SOL 2838 43.900 41.720 72.910 1.00 0.00 ATOM 23617 H1 SOL 2838 43.790 41.380 72.020 1.00 0.00 ATOM 23618 H2 SOL 2838 44.520 41.120 73.320 1.00 0.00 ATOM 23619 OH2 SOL 2839 50.740 5.680 62.890 1.00 0.00 ATOM 23620 H1 SOL 2839 50.470 6.200 62.130 1.00 0.00 ATOM 23621 H2 SOL 2839 50.030 5.070 63.030 1.00 0.00 ATOM 23622 OH2 SOL 2840 29.070 41.080 12.210 1.00 0.00 ATOM 23623 H1 SOL 2840 29.530 40.520 12.840 1.00 0.00 ATOM 23624 H2 SOL 2840 29.540 41.910 12.230 1.00 0.00 ATOM 23625 OH2 SOL 2841 44.100 38.990 65.820 1.00 0.00 ATOM 23626 H1 SOL 2841 43.660 38.960 64.970 1.00 0.00 ATOM 23627 H2 SOL 2841 43.440 38.680 66.440 1.00 0.00 ATOM 23628 OH2 SOL 2842 13.360 42.590 14.550 1.00 0.00 ATOM 23629 H1 SOL 2842 12.600 42.370 15.090 1.00 0.00 ATOM 23630 H2 SOL 2842 13.630 43.460 14.850 1.00 0.00 ATOM 23631 OH2 SOL 2843 33.910 39.840 67.430 1.00 0.00 ATOM 23632 H1 SOL 2843 34.660 40.430 67.480 1.00 0.00 ATOM 23633 H2 SOL 2843 33.380 40.050 68.200 1.00 0.00 ATOM 23634 OH2 SOL 2844 12.850 51.400 78.810 1.00 0.00 ATOM 23635 H1 SOL 2844 12.810 51.030 79.690 1.00 0.00 ATOM 23636 H2 SOL 2844 11.980 51.270 78.440 1.00 0.00 ATOM 23637 OH2 SOL 2845 39.020 0.890 78.660 1.00 0.00 ATOM 23638 H1 SOL 2845 39.860 0.810 79.110 1.00 0.00 ATOM 23639 H2 SOL 2845 38.380 1.010 79.360 1.00 0.00 ATOM 23640 OH2 SOL 2846 49.730 46.100 63.050 1.00 0.00 ATOM 23641 H1 SOL 2846 48.830 46.110 62.740 1.00 0.00 ATOM 23642 H2 SOL 2846 50.120 46.890 62.690 1.00 0.00 ATOM 23643 OH2 SOL 2847 37.280 37.610 7.330 1.00 0.00 ATOM 23644 H1 SOL 2847 37.600 38.170 6.620 1.00 0.00 ATOM 23645 H2 SOL 2847 36.630 37.040 6.920 1.00 0.00 ATOM 23646 OH2 SOL 2848 38.220 15.220 68.690 1.00 0.00 ATOM 23647 H1 SOL 2848 38.130 16.130 68.400 1.00 0.00 ATOM 23648 H2 SOL 2848 39.160 15.050 68.630 1.00 0.00 ATOM 23649 OH2 SOL 2849 8.660 28.980 14.520 1.00 0.00 ATOM 23650 H1 SOL 2849 9.610 28.960 14.380 1.00 0.00 ATOM 23651 H2 SOL 2849 8.310 28.400 13.840 1.00 0.00 ATOM 23652 OH2 SOL 2850 40.740 51.770 65.660 1.00 0.00 ATOM 23653 H1 SOL 2850 41.000 52.690 65.660 1.00 0.00 ATOM 23654 H2 SOL 2850 41.540 51.300 65.430 1.00 0.00 ATOM 23655 OH2 SOL 2851 38.610 4.090 75.140 1.00 0.00 ATOM 23656 H1 SOL 2851 38.940 4.990 75.070 1.00 0.00 ATOM 23657 H2 SOL 2851 39.030 3.620 74.420 1.00 0.00 ATOM 23658 OH2 SOL 2852 53.660 58.750 12.380 1.00 0.00 ATOM 23659 H1 SOL 2852 53.920 57.830 12.350 1.00 0.00 ATOM 23660 H2 SOL 2852 52.820 58.770 11.920 1.00 0.00 ATOM 23661 OH2 SOL 2853 13.680 21.380 82.910 1.00 0.00 ATOM 23662 H1 SOL 2853 13.500 22.290 82.660 1.00 0.00 ATOM 23663 H2 SOL 2853 13.960 20.970 82.090 1.00 0.00 ATOM 23664 OH2 SOL 2854 41.790 39.740 76.590 1.00 0.00 ATOM 23665 H1 SOL 2854 41.060 40.160 76.150 1.00 0.00 ATOM 23666 H2 SOL 2854 42.550 40.270 76.350 1.00 0.00 ATOM 23667 OH2 SOL 2855 49.130 2.040 6.650 1.00 0.00 ATOM 23668 H1 SOL 2855 49.610 1.300 7.020 1.00 0.00 ATOM 23669 H2 SOL 2855 49.790 2.540 6.170 1.00 0.00 ATOM 23670 OH2 SOL 2856 12.860 53.810 67.250 1.00 0.00 ATOM 23671 H1 SOL 2856 13.640 53.430 66.870 1.00 0.00 ATOM 23672 H2 SOL 2856 12.830 54.700 66.910 1.00 0.00 ATOM 23673 OH2 SOL 2857 37.510 49.300 75.560 1.00 0.00 ATOM 23674 H1 SOL 2857 37.310 49.200 76.490 1.00 0.00 ATOM 23675 H2 SOL 2857 38.240 49.920 75.550 1.00 0.00 ATOM 23676 OH2 SOL 2858 33.670 42.470 72.430 1.00 0.00 ATOM 23677 H1 SOL 2858 33.380 42.110 73.270 1.00 0.00 ATOM 23678 H2 SOL 2858 33.540 43.420 72.510 1.00 0.00 ATOM 23679 OH2 SOL 2859 17.090 42.730 72.950 1.00 0.00 ATOM 23680 H1 SOL 2859 16.930 42.120 73.680 1.00 0.00 ATOM 23681 H2 SOL 2859 17.450 42.180 72.250 1.00 0.00 ATOM 23682 OH2 SOL 2860 44.860 51.730 68.620 1.00 0.00 ATOM 23683 H1 SOL 2860 44.350 50.950 68.840 1.00 0.00 ATOM 23684 H2 SOL 2860 45.450 51.840 69.370 1.00 0.00 ATOM 23685 OH2 SOL 2861 23.150 3.950 70.570 1.00 0.00 ATOM 23686 H1 SOL 2861 22.820 4.280 71.400 1.00 0.00 ATOM 23687 H2 SOL 2861 24.050 3.660 70.770 1.00 0.00 ATOM 23688 OH2 SOL 2862 41.850 37.960 8.630 1.00 0.00 ATOM 23689 H1 SOL 2862 41.820 37.490 7.800 1.00 0.00 ATOM 23690 H2 SOL 2862 40.940 38.190 8.810 1.00 0.00 ATOM 23691 OH2 SOL 2863 37.210 21.030 73.950 1.00 0.00 ATOM 23692 H1 SOL 2863 37.600 20.650 73.170 1.00 0.00 ATOM 23693 H2 SOL 2863 36.590 21.680 73.620 1.00 0.00 ATOM 23694 OH2 SOL 2864 24.720 55.420 10.240 1.00 0.00 ATOM 23695 H1 SOL 2864 23.980 55.010 10.680 1.00 0.00 ATOM 23696 H2 SOL 2864 24.360 56.220 9.850 1.00 0.00 ATOM 23697 OH2 SOL 2865 40.010 52.540 10.600 1.00 0.00 ATOM 23698 H1 SOL 2865 39.980 52.820 11.510 1.00 0.00 ATOM 23699 H2 SOL 2865 40.920 52.670 10.330 1.00 0.00 ATOM 23700 OH2 SOL 2866 51.800 22.190 63.180 1.00 0.00 ATOM 23701 H1 SOL 2866 50.920 22.200 62.800 1.00 0.00 ATOM 23702 H2 SOL 2866 52.080 21.280 63.090 1.00 0.00 ATOM 23703 OH2 SOL 2867 48.720 12.260 63.510 1.00 0.00 ATOM 23704 H1 SOL 2867 48.300 13.120 63.500 1.00 0.00 ATOM 23705 H2 SOL 2867 48.960 12.100 62.600 1.00 0.00 ATOM 23706 OH2 SOL 2868 33.550 41.730 7.360 1.00 0.00 ATOM 23707 H1 SOL 2868 34.100 40.950 7.300 1.00 0.00 ATOM 23708 H2 SOL 2868 32.840 41.580 6.730 1.00 0.00 ATOM 23709 OH2 SOL 2869 29.040 51.710 84.540 1.00 0.00 ATOM 23710 H1 SOL 2869 29.960 51.610 84.290 1.00 0.00 ATOM 23711 H2 SOL 2869 28.970 51.260 85.390 1.00 0.00 ATOM 23712 OH2 SOL 2870 16.830 31.250 3.960 1.00 0.00 ATOM 23713 H1 SOL 2870 17.010 31.910 4.630 1.00 0.00 ATOM 23714 H2 SOL 2870 16.770 30.420 4.440 1.00 0.00 ATOM 23715 OH2 SOL 2871 0.370 20.130 72.330 1.00 0.00 ATOM 23716 H1 SOL 2871 -0.480 20.570 72.390 1.00 0.00 ATOM 23717 H2 SOL 2871 0.600 20.180 71.400 1.00 0.00 ATOM 23718 OH2 SOL 2872 10.270 6.490 10.190 1.00 0.00 ATOM 23719 H1 SOL 2872 10.950 5.810 10.220 1.00 0.00 ATOM 23720 H2 SOL 2872 10.660 7.240 10.640 1.00 0.00 ATOM 23721 OH2 SOL 2873 9.290 49.700 5.560 1.00 0.00 ATOM 23722 H1 SOL 2873 8.570 49.420 4.990 1.00 0.00 ATOM 23723 H2 SOL 2873 9.440 48.950 6.140 1.00 0.00 ATOM 23724 OH2 SOL 2874 30.870 13.780 8.380 1.00 0.00 ATOM 23725 H1 SOL 2874 31.800 14.000 8.320 1.00 0.00 ATOM 23726 H2 SOL 2874 30.620 13.520 7.490 1.00 0.00 ATOM 23727 OH2 SOL 2875 52.590 25.490 66.570 1.00 0.00 ATOM 23728 H1 SOL 2875 52.750 26.230 67.160 1.00 0.00 ATOM 23729 H2 SOL 2875 51.900 25.800 65.980 1.00 0.00 ATOM 23730 OH2 SOL 2876 43.230 12.890 21.030 1.00 0.00 ATOM 23731 H1 SOL 2876 43.320 13.840 21.110 1.00 0.00 ATOM 23732 H2 SOL 2876 43.810 12.540 21.710 1.00 0.00 ATOM 23733 OH2 SOL 2877 42.990 52.350 76.880 1.00 0.00 ATOM 23734 H1 SOL 2877 42.820 52.700 77.760 1.00 0.00 ATOM 23735 H2 SOL 2877 42.120 52.160 76.530 1.00 0.00 ATOM 23736 OH2 SOL 2878 55.390 38.670 84.390 1.00 0.00 ATOM 23737 H1 SOL 2878 55.540 38.920 85.300 1.00 0.00 ATOM 23738 H2 SOL 2878 56.250 38.730 83.970 1.00 0.00 ATOM 23739 OH2 SOL 2879 5.230 46.300 69.920 1.00 0.00 ATOM 23740 H1 SOL 2879 6.030 46.190 69.420 1.00 0.00 ATOM 23741 H2 SOL 2879 4.650 45.610 69.610 1.00 0.00 ATOM 23742 OH2 SOL 2880 51.410 31.480 19.420 1.00 0.00 ATOM 23743 H1 SOL 2880 51.800 31.780 20.250 1.00 0.00 ATOM 23744 H2 SOL 2880 52.160 31.310 18.850 1.00 0.00 ATOM 23745 OH2 SOL 2881 8.910 45.940 5.130 1.00 0.00 ATOM 23746 H1 SOL 2881 9.040 45.030 4.850 1.00 0.00 ATOM 23747 H2 SOL 2881 9.350 46.000 5.980 1.00 0.00 ATOM 23748 OH2 SOL 2882 24.540 20.050 68.700 1.00 0.00 ATOM 23749 H1 SOL 2882 24.300 19.520 69.460 1.00 0.00 ATOM 23750 H2 SOL 2882 25.500 20.110 68.750 1.00 0.00 ATOM 23751 OH2 SOL 2883 35.040 59.460 82.860 1.00 0.00 ATOM 23752 H1 SOL 2883 34.820 58.900 82.120 1.00 0.00 ATOM 23753 H2 SOL 2883 34.500 59.130 83.580 1.00 0.00 ATOM 23754 OH2 SOL 2884 14.700 42.390 7.540 1.00 0.00 ATOM 23755 H1 SOL 2884 15.370 43.070 7.620 1.00 0.00 ATOM 23756 H2 SOL 2884 13.890 42.870 7.380 1.00 0.00 ATOM 23757 OH2 SOL 2885 45.790 1.240 13.370 1.00 0.00 ATOM 23758 H1 SOL 2885 46.330 0.460 13.250 1.00 0.00 ATOM 23759 H2 SOL 2885 45.540 1.490 12.480 1.00 0.00 ATOM 23760 OH2 SOL 2886 8.120 45.010 14.450 1.00 0.00 ATOM 23761 H1 SOL 2886 7.720 44.300 14.950 1.00 0.00 ATOM 23762 H2 SOL 2886 8.370 44.600 13.620 1.00 0.00 ATOM 23763 OH2 SOL 2887 57.140 31.310 60.930 1.00 0.00 ATOM 23764 H1 SOL 2887 56.260 31.640 61.110 1.00 0.00 ATOM 23765 H2 SOL 2887 57.010 30.490 60.450 1.00 0.00 ATOM 23766 OH2 SOL 2888 58.590 37.520 22.520 1.00 0.00 ATOM 23767 H1 SOL 2888 59.160 38.290 22.580 1.00 0.00 ATOM 23768 H2 SOL 2888 59.180 36.780 22.670 1.00 0.00 ATOM 23769 OH2 SOL 2889 1.090 20.260 13.760 1.00 0.00 ATOM 23770 H1 SOL 2889 1.810 20.610 14.290 1.00 0.00 ATOM 23771 H2 SOL 2889 1.520 19.870 12.990 1.00 0.00 ATOM 23772 OH2 SOL 2890 5.540 0.150 14.090 1.00 0.00 ATOM 23773 H1 SOL 2890 4.660 0.270 13.720 1.00 0.00 ATOM 23774 H2 SOL 2890 6.050 -0.210 13.370 1.00 0.00 ATOM 23775 OH2 SOL 2891 13.080 44.450 3.820 1.00 0.00 ATOM 23776 H1 SOL 2891 13.280 43.750 3.200 1.00 0.00 ATOM 23777 H2 SOL 2891 13.940 44.800 4.060 1.00 0.00 ATOM 23778 OH2 SOL 2892 32.710 46.410 78.110 1.00 0.00 ATOM 23779 H1 SOL 2892 33.000 46.530 77.200 1.00 0.00 ATOM 23780 H2 SOL 2892 32.790 45.470 78.260 1.00 0.00 ATOM 23781 OH2 SOL 2893 55.610 29.780 8.070 1.00 0.00 ATOM 23782 H1 SOL 2893 54.870 29.200 8.240 1.00 0.00 ATOM 23783 H2 SOL 2893 56.280 29.510 8.700 1.00 0.00 ATOM 23784 OH2 SOL 2894 13.740 35.110 7.120 1.00 0.00 ATOM 23785 H1 SOL 2894 12.960 35.560 6.790 1.00 0.00 ATOM 23786 H2 SOL 2894 14.420 35.290 6.470 1.00 0.00 ATOM 23787 OH2 SOL 2895 36.300 55.660 6.210 1.00 0.00 ATOM 23788 H1 SOL 2895 37.140 55.260 6.430 1.00 0.00 ATOM 23789 H2 SOL 2895 35.770 55.570 7.000 1.00 0.00 ATOM 23790 OH2 SOL 2896 11.140 50.030 15.990 1.00 0.00 ATOM 23791 H1 SOL 2896 10.400 49.610 15.540 1.00 0.00 ATOM 23792 H2 SOL 2896 11.830 49.380 15.980 1.00 0.00 ATOM 23793 OH2 SOL 2897 40.790 28.560 78.180 1.00 0.00 ATOM 23794 H1 SOL 2897 41.590 28.380 78.680 1.00 0.00 ATOM 23795 H2 SOL 2897 41.080 29.160 77.490 1.00 0.00 ATOM 23796 OH2 SOL 2898 33.980 31.100 69.510 1.00 0.00 ATOM 23797 H1 SOL 2898 33.600 31.130 68.630 1.00 0.00 ATOM 23798 H2 SOL 2898 34.810 31.560 69.420 1.00 0.00 ATOM 23799 OH2 SOL 2899 1.120 21.690 78.220 1.00 0.00 ATOM 23800 H1 SOL 2899 0.700 22.070 77.450 1.00 0.00 ATOM 23801 H2 SOL 2899 0.770 22.200 78.960 1.00 0.00 ATOM 23802 OH2 SOL 2900 52.240 47.750 84.160 1.00 0.00 ATOM 23803 H1 SOL 2900 51.580 47.400 83.550 1.00 0.00 ATOM 23804 H2 SOL 2900 52.410 48.640 83.840 1.00 0.00 ATOM 23805 OH2 SOL 2901 13.590 14.270 24.990 1.00 0.00 ATOM 23806 H1 SOL 2901 13.630 15.180 25.270 1.00 0.00 ATOM 23807 H2 SOL 2901 14.470 14.080 24.650 1.00 0.00 ATOM 23808 OH2 SOL 2902 30.900 42.390 3.260 1.00 0.00 ATOM 23809 H1 SOL 2902 30.960 43.290 3.570 1.00 0.00 ATOM 23810 H2 SOL 2902 30.960 41.860 4.060 1.00 0.00 ATOM 23811 OH2 SOL 2903 52.510 30.660 9.040 1.00 0.00 ATOM 23812 H1 SOL 2903 51.730 31.150 9.290 1.00 0.00 ATOM 23813 H2 SOL 2903 52.880 31.150 8.300 1.00 0.00 ATOM 23814 OH2 SOL 2904 57.460 22.030 17.890 1.00 0.00 ATOM 23815 H1 SOL 2904 56.750 22.250 18.490 1.00 0.00 ATOM 23816 H2 SOL 2904 58.000 21.400 18.380 1.00 0.00 ATOM 23817 OH2 SOL 2905 16.220 27.450 19.950 1.00 0.00 ATOM 23818 H1 SOL 2905 15.710 28.160 20.340 1.00 0.00 ATOM 23819 H2 SOL 2905 16.660 27.030 20.700 1.00 0.00 ATOM 23820 OH2 SOL 2906 46.930 36.430 69.300 1.00 0.00 ATOM 23821 H1 SOL 2906 46.960 37.100 68.620 1.00 0.00 ATOM 23822 H2 SOL 2906 46.090 36.550 69.720 1.00 0.00 ATOM 23823 OH2 SOL 2907 10.250 15.680 16.360 1.00 0.00 ATOM 23824 H1 SOL 2907 9.760 15.000 16.820 1.00 0.00 ATOM 23825 H2 SOL 2907 11.160 15.540 16.620 1.00 0.00 ATOM 23826 OH2 SOL 2908 8.200 21.770 80.880 1.00 0.00 ATOM 23827 H1 SOL 2908 8.830 21.290 81.410 1.00 0.00 ATOM 23828 H2 SOL 2908 7.960 22.520 81.420 1.00 0.00 ATOM 23829 OH2 SOL 2909 35.930 22.680 84.200 1.00 0.00 ATOM 23830 H1 SOL 2909 35.480 22.420 83.390 1.00 0.00 ATOM 23831 H2 SOL 2909 36.030 23.630 84.130 1.00 0.00 ATOM 23832 OH2 SOL 2910 38.710 9.870 76.500 1.00 0.00 ATOM 23833 H1 SOL 2910 38.150 10.640 76.610 1.00 0.00 ATOM 23834 H2 SOL 2910 39.010 9.920 75.600 1.00 0.00 ATOM 23835 OH2 SOL 2911 32.900 26.550 1.780 1.00 0.00 ATOM 23836 H1 SOL 2911 33.140 25.880 1.150 1.00 0.00 ATOM 23837 H2 SOL 2911 32.460 26.080 2.490 1.00 0.00 ATOM 23838 OH2 SOL 2912 55.610 26.880 60.330 1.00 0.00 ATOM 23839 H1 SOL 2912 54.790 26.430 60.140 1.00 0.00 ATOM 23840 H2 SOL 2912 56.160 26.220 60.730 1.00 0.00 ATOM 23841 OH2 SOL 2913 44.840 14.410 4.620 1.00 0.00 ATOM 23842 H1 SOL 2913 44.510 14.150 3.760 1.00 0.00 ATOM 23843 H2 SOL 2913 44.570 13.700 5.200 1.00 0.00 ATOM 23844 OH2 SOL 2914 32.090 26.960 10.250 1.00 0.00 ATOM 23845 H1 SOL 2914 31.970 26.080 10.610 1.00 0.00 ATOM 23846 H2 SOL 2914 32.260 27.510 11.010 1.00 0.00 ATOM 23847 OH2 SOL 2915 44.000 41.040 58.760 1.00 0.00 ATOM 23848 H1 SOL 2915 43.840 41.980 58.690 1.00 0.00 ATOM 23849 H2 SOL 2915 43.120 40.650 58.750 1.00 0.00 ATOM 23850 OH2 SOL 2916 46.090 22.150 13.850 1.00 0.00 ATOM 23851 H1 SOL 2916 45.740 22.270 12.970 1.00 0.00 ATOM 23852 H2 SOL 2916 45.870 21.240 14.070 1.00 0.00 ATOM 23853 OH2 SOL 2917 27.230 2.440 78.510 1.00 0.00 ATOM 23854 H1 SOL 2917 26.850 3.310 78.660 1.00 0.00 ATOM 23855 H2 SOL 2917 27.020 2.250 77.600 1.00 0.00 ATOM 23856 OH2 SOL 2918 57.010 58.050 16.990 1.00 0.00 ATOM 23857 H1 SOL 2918 57.460 57.730 17.780 1.00 0.00 ATOM 23858 H2 SOL 2918 57.430 57.580 16.270 1.00 0.00 ATOM 23859 OH2 SOL 2919 56.240 39.440 62.860 1.00 0.00 ATOM 23860 H1 SOL 2919 56.010 38.560 62.560 1.00 0.00 ATOM 23861 H2 SOL 2919 57.100 39.350 63.260 1.00 0.00 ATOM 23862 OH2 SOL 2920 37.050 42.190 75.230 1.00 0.00 ATOM 23863 H1 SOL 2920 36.110 42.300 75.420 1.00 0.00 ATOM 23864 H2 SOL 2920 37.090 41.430 74.650 1.00 0.00 ATOM 23865 OH2 SOL 2921 13.780 26.540 65.100 1.00 0.00 ATOM 23866 H1 SOL 2921 13.460 26.730 65.990 1.00 0.00 ATOM 23867 H2 SOL 2921 13.050 26.080 64.680 1.00 0.00 ATOM 23868 OH2 SOL 2922 6.950 30.770 70.690 1.00 0.00 ATOM 23869 H1 SOL 2922 6.320 30.710 71.400 1.00 0.00 ATOM 23870 H2 SOL 2922 6.580 31.430 70.090 1.00 0.00 ATOM 23871 OH2 SOL 2923 5.750 2.540 21.200 1.00 0.00 ATOM 23872 H1 SOL 2923 5.500 1.820 21.770 1.00 0.00 ATOM 23873 H2 SOL 2923 5.870 3.280 21.800 1.00 0.00 ATOM 23874 OH2 SOL 2924 27.190 18.350 66.560 1.00 0.00 ATOM 23875 H1 SOL 2924 27.060 18.840 67.370 1.00 0.00 ATOM 23876 H2 SOL 2924 27.050 17.440 66.810 1.00 0.00 ATOM 23877 OH2 SOL 2925 17.640 2.030 76.510 1.00 0.00 ATOM 23878 H1 SOL 2925 18.230 1.560 75.910 1.00 0.00 ATOM 23879 H2 SOL 2925 16.800 2.030 76.060 1.00 0.00 ATOM 23880 OH2 SOL 2926 46.330 11.130 2.780 1.00 0.00 ATOM 23881 H1 SOL 2926 46.350 11.610 1.950 1.00 0.00 ATOM 23882 H2 SOL 2926 46.200 10.220 2.530 1.00 0.00 ATOM 23883 OH2 SOL 2927 34.440 14.510 80.140 1.00 0.00 ATOM 23884 H1 SOL 2927 34.090 13.780 80.640 1.00 0.00 ATOM 23885 H2 SOL 2927 33.760 15.180 80.190 1.00 0.00 ATOM 23886 OH2 SOL 2928 18.500 17.690 24.300 1.00 0.00 ATOM 23887 H1 SOL 2928 19.390 17.340 24.400 1.00 0.00 ATOM 23888 H2 SOL 2928 18.430 18.380 24.960 1.00 0.00 ATOM 23889 OH2 SOL 2929 56.580 35.150 84.240 1.00 0.00 ATOM 23890 H1 SOL 2929 55.770 34.730 83.950 1.00 0.00 ATOM 23891 H2 SOL 2929 57.230 34.890 83.590 1.00 0.00 ATOM 23892 OH2 SOL 2930 3.740 25.160 15.300 1.00 0.00 ATOM 23893 H1 SOL 2930 4.070 25.420 14.450 1.00 0.00 ATOM 23894 H2 SOL 2930 3.960 24.230 15.380 1.00 0.00 ATOM 23895 OH2 SOL 2931 48.460 49.930 5.780 1.00 0.00 ATOM 23896 H1 SOL 2931 48.610 49.410 6.570 1.00 0.00 ATOM 23897 H2 SOL 2931 48.570 50.840 6.050 1.00 0.00 ATOM 23898 OH2 SOL 2932 9.120 8.910 81.980 1.00 0.00 ATOM 23899 H1 SOL 2932 9.470 9.150 82.830 1.00 0.00 ATOM 23900 H2 SOL 2932 9.890 8.670 81.460 1.00 0.00 ATOM 23901 OH2 SOL 2933 26.290 23.010 13.560 1.00 0.00 ATOM 23902 H1 SOL 2933 26.480 22.190 14.020 1.00 0.00 ATOM 23903 H2 SOL 2933 25.650 23.460 14.120 1.00 0.00 ATOM 23904 OH2 SOL 2934 48.810 43.340 2.960 1.00 0.00 ATOM 23905 H1 SOL 2934 48.750 44.300 3.000 1.00 0.00 ATOM 23906 H2 SOL 2934 49.050 43.080 3.850 1.00 0.00 ATOM 23907 OH2 SOL 2935 22.700 11.810 21.010 1.00 0.00 ATOM 23908 H1 SOL 2935 21.910 11.690 21.530 1.00 0.00 ATOM 23909 H2 SOL 2935 22.470 11.490 20.140 1.00 0.00 ATOM 23910 OH2 SOL 2936 47.430 43.470 13.220 1.00 0.00 ATOM 23911 H1 SOL 2936 47.490 44.420 13.240 1.00 0.00 ATOM 23912 H2 SOL 2936 48.070 43.200 12.560 1.00 0.00 ATOM 23913 OH2 SOL 2937 47.810 18.440 79.980 1.00 0.00 ATOM 23914 H1 SOL 2937 47.010 18.920 80.200 1.00 0.00 ATOM 23915 H2 SOL 2937 48.510 18.890 80.460 1.00 0.00 ATOM 23916 OH2 SOL 2938 35.310 36.970 1.710 1.00 0.00 ATOM 23917 H1 SOL 2938 34.690 37.280 2.370 1.00 0.00 ATOM 23918 H2 SOL 2938 36.140 36.900 2.170 1.00 0.00 ATOM 23919 OH2 SOL 2939 26.490 58.630 80.920 1.00 0.00 ATOM 23920 H1 SOL 2939 26.260 58.780 80.000 1.00 0.00 ATOM 23921 H2 SOL 2939 27.240 58.050 80.890 1.00 0.00 ATOM 23922 OH2 SOL 2940 26.680 11.550 2.810 1.00 0.00 ATOM 23923 H1 SOL 2940 26.260 11.070 2.090 1.00 0.00 ATOM 23924 H2 SOL 2940 26.010 12.170 3.100 1.00 0.00 ATOM 23925 OH2 SOL 2941 46.930 52.310 82.170 1.00 0.00 ATOM 23926 H1 SOL 2941 46.910 53.240 82.380 1.00 0.00 ATOM 23927 H2 SOL 2941 46.750 52.270 81.230 1.00 0.00 ATOM 23928 OH2 SOL 2942 29.760 41.680 61.810 1.00 0.00 ATOM 23929 H1 SOL 2942 30.710 41.650 61.680 1.00 0.00 ATOM 23930 H2 SOL 2942 29.610 42.510 62.270 1.00 0.00 ATOM 23931 OH2 SOL 2943 7.710 35.250 64.640 1.00 0.00 ATOM 23932 H1 SOL 2943 8.130 34.940 65.450 1.00 0.00 ATOM 23933 H2 SOL 2943 7.870 36.190 64.630 1.00 0.00 ATOM 23934 OH2 SOL 2944 11.960 26.590 10.890 1.00 0.00 ATOM 23935 H1 SOL 2944 11.920 27.520 11.130 1.00 0.00 ATOM 23936 H2 SOL 2944 12.650 26.240 11.440 1.00 0.00 ATOM 23937 OH2 SOL 2945 15.590 30.090 67.230 1.00 0.00 ATOM 23938 H1 SOL 2945 14.890 29.440 67.300 1.00 0.00 ATOM 23939 H2 SOL 2945 15.130 30.920 67.050 1.00 0.00 ATOM 23940 OH2 SOL 2946 4.290 18.240 71.280 1.00 0.00 ATOM 23941 H1 SOL 2946 3.740 17.730 71.880 1.00 0.00 ATOM 23942 H2 SOL 2946 4.860 17.600 70.870 1.00 0.00 ATOM 23943 OH2 SOL 2947 26.590 48.730 17.220 1.00 0.00 ATOM 23944 H1 SOL 2947 27.450 48.430 16.920 1.00 0.00 ATOM 23945 H2 SOL 2947 26.760 49.580 17.620 1.00 0.00 ATOM 23946 OH2 SOL 2948 44.640 14.840 18.570 1.00 0.00 ATOM 23947 H1 SOL 2948 45.220 15.470 18.130 1.00 0.00 ATOM 23948 H2 SOL 2948 44.450 15.250 19.410 1.00 0.00 ATOM 23949 OH2 SOL 2949 29.480 3.730 80.890 1.00 0.00 ATOM 23950 H1 SOL 2949 28.750 3.980 80.320 1.00 0.00 ATOM 23951 H2 SOL 2949 30.250 3.760 80.320 1.00 0.00 ATOM 23952 OH2 SOL 2950 54.090 32.100 4.940 1.00 0.00 ATOM 23953 H1 SOL 2950 54.690 32.790 4.640 1.00 0.00 ATOM 23954 H2 SOL 2950 53.760 31.710 4.130 1.00 0.00 ATOM 23955 OH2 SOL 2951 22.750 32.030 17.500 1.00 0.00 ATOM 23956 H1 SOL 2951 23.220 32.700 17.980 1.00 0.00 ATOM 23957 H2 SOL 2951 21.830 32.310 17.540 1.00 0.00 ATOM 23958 OH2 SOL 2952 37.180 4.690 78.370 1.00 0.00 ATOM 23959 H1 SOL 2952 38.020 4.670 78.840 1.00 0.00 ATOM 23960 H2 SOL 2952 36.840 5.580 78.520 1.00 0.00 ATOM 23961 OH2 SOL 2953 40.870 10.260 82.550 1.00 0.00 ATOM 23962 H1 SOL 2953 41.250 9.450 82.890 1.00 0.00 ATOM 23963 H2 SOL 2953 41.240 10.350 81.680 1.00 0.00 ATOM 23964 OH2 SOL 2954 50.250 37.680 73.360 1.00 0.00 ATOM 23965 H1 SOL 2954 50.480 36.880 72.900 1.00 0.00 ATOM 23966 H2 SOL 2954 50.830 38.350 72.970 1.00 0.00 ATOM 23967 OH2 SOL 2955 3.010 16.760 77.830 1.00 0.00 ATOM 23968 H1 SOL 2955 3.520 17.250 77.180 1.00 0.00 ATOM 23969 H2 SOL 2955 3.660 16.400 78.430 1.00 0.00 ATOM 23970 OH2 SOL 2956 18.210 19.820 28.780 1.00 0.00 ATOM 23971 H1 SOL 2956 17.310 20.040 29.010 1.00 0.00 ATOM 23972 H2 SOL 2956 18.140 19.000 28.300 1.00 0.00 ATOM 23973 OH2 SOL 2957 46.570 42.470 75.450 1.00 0.00 ATOM 23974 H1 SOL 2957 47.410 42.030 75.580 1.00 0.00 ATOM 23975 H2 SOL 2957 46.800 43.320 75.080 1.00 0.00 ATOM 23976 OH2 SOL 2958 33.910 27.680 18.220 1.00 0.00 ATOM 23977 H1 SOL 2958 33.210 28.260 17.910 1.00 0.00 ATOM 23978 H2 SOL 2958 33.860 26.920 17.640 1.00 0.00 ATOM 23979 OH2 SOL 2959 15.900 20.410 63.000 1.00 0.00 ATOM 23980 H1 SOL 2959 16.790 20.090 63.130 1.00 0.00 ATOM 23981 H2 SOL 2959 15.560 19.870 62.280 1.00 0.00 ATOM 23982 OH2 SOL 2960 55.970 42.840 19.950 1.00 0.00 ATOM 23983 H1 SOL 2960 56.570 42.320 20.490 1.00 0.00 ATOM 23984 H2 SOL 2960 55.150 42.340 19.960 1.00 0.00 ATOM 23985 OH2 SOL 2961 58.990 52.840 76.510 1.00 0.00 ATOM 23986 H1 SOL 2961 58.470 52.510 75.780 1.00 0.00 ATOM 23987 H2 SOL 2961 59.220 53.730 76.260 1.00 0.00 ATOM 23988 OH2 SOL 2962 26.660 34.200 5.930 1.00 0.00 ATOM 23989 H1 SOL 2962 25.990 34.810 5.630 1.00 0.00 ATOM 23990 H2 SOL 2962 26.400 33.970 6.820 1.00 0.00 ATOM 23991 OH2 SOL 2963 39.770 52.650 17.770 1.00 0.00 ATOM 23992 H1 SOL 2963 40.600 52.780 17.320 1.00 0.00 ATOM 23993 H2 SOL 2963 39.490 51.770 17.520 1.00 0.00 ATOM 23994 OH2 SOL 2964 32.740 11.100 73.380 1.00 0.00 ATOM 23995 H1 SOL 2964 32.240 11.610 74.010 1.00 0.00 ATOM 23996 H2 SOL 2964 32.560 11.520 72.530 1.00 0.00 ATOM 23997 OH2 SOL 2965 50.100 15.120 25.840 1.00 0.00 ATOM 23998 H1 SOL 2965 50.760 14.740 25.270 1.00 0.00 ATOM 23999 H2 SOL 2965 49.560 14.380 26.110 1.00 0.00 ATOM 24000 OH2 SOL 2966 28.400 18.430 20.630 1.00 0.00 ATOM 24001 H1 SOL 2966 28.590 19.370 20.670 1.00 0.00 ATOM 24002 H2 SOL 2966 29.250 18.010 20.770 1.00 0.00 ATOM 24003 OH2 SOL 2967 55.360 49.940 72.680 1.00 0.00 ATOM 24004 H1 SOL 2967 56.270 50.240 72.700 1.00 0.00 ATOM 24005 H2 SOL 2967 55.030 50.130 73.560 1.00 0.00 ATOM 24006 OH2 SOL 2968 6.270 17.310 69.450 1.00 0.00 ATOM 24007 H1 SOL 2968 6.670 17.490 68.600 1.00 0.00 ATOM 24008 H2 SOL 2968 6.900 17.630 70.080 1.00 0.00 ATOM 24009 OH2 SOL 2969 11.970 45.690 19.930 1.00 0.00 ATOM 24010 H1 SOL 2969 12.900 45.530 20.100 1.00 0.00 ATOM 24011 H2 SOL 2969 11.820 46.580 20.250 1.00 0.00 ATOM 24012 OH2 SOL 2970 15.320 24.730 82.470 1.00 0.00 ATOM 24013 H1 SOL 2970 15.880 25.440 82.800 1.00 0.00 ATOM 24014 H2 SOL 2970 14.880 24.390 83.250 1.00 0.00 ATOM 24015 OH2 SOL 2971 36.080 21.510 60.840 1.00 0.00 ATOM 24016 H1 SOL 2971 36.870 21.250 61.320 1.00 0.00 ATOM 24017 H2 SOL 2971 36.230 22.430 60.620 1.00 0.00 ATOM 24018 OH2 SOL 2972 11.010 3.760 20.600 1.00 0.00 ATOM 24019 H1 SOL 2972 11.520 3.290 19.940 1.00 0.00 ATOM 24020 H2 SOL 2972 11.590 3.800 21.360 1.00 0.00 ATOM 24021 OH2 SOL 2973 8.360 43.670 78.800 1.00 0.00 ATOM 24022 H1 SOL 2973 8.740 43.930 79.640 1.00 0.00 ATOM 24023 H2 SOL 2973 7.780 42.940 79.020 1.00 0.00 ATOM 24024 OH2 SOL 2974 50.100 44.790 81.250 1.00 0.00 ATOM 24025 H1 SOL 2974 49.290 44.740 81.760 1.00 0.00 ATOM 24026 H2 SOL 2974 49.900 44.290 80.450 1.00 0.00 ATOM 24027 OH2 SOL 2975 19.570 9.010 0.180 1.00 0.00 ATOM 24028 H1 SOL 2975 18.650 9.280 0.260 1.00 0.00 ATOM 24029 H2 SOL 2975 19.920 9.100 1.070 1.00 0.00 ATOM 24030 OH2 SOL 2976 39.620 13.560 23.610 1.00 0.00 ATOM 24031 H1 SOL 2976 40.180 13.410 24.380 1.00 0.00 ATOM 24032 H2 SOL 2976 39.730 14.500 23.430 1.00 0.00 ATOM 24033 OH2 SOL 2977 29.030 55.170 8.640 1.00 0.00 ATOM 24034 H1 SOL 2977 28.940 54.230 8.470 1.00 0.00 ATOM 24035 H2 SOL 2977 28.850 55.260 9.580 1.00 0.00 ATOM 24036 OH2 SOL 2978 43.070 11.710 27.150 1.00 0.00 ATOM 24037 H1 SOL 2978 43.720 11.770 27.850 1.00 0.00 ATOM 24038 H2 SOL 2978 42.560 10.930 27.350 1.00 0.00 ATOM 24039 OH2 SOL 2979 8.510 10.410 77.490 1.00 0.00 ATOM 24040 H1 SOL 2979 9.270 9.850 77.660 1.00 0.00 ATOM 24041 H2 SOL 2979 8.850 11.080 76.890 1.00 0.00 ATOM 24042 OH2 SOL 2980 0.180 1.940 25.610 1.00 0.00 ATOM 24043 H1 SOL 2980 1.060 2.260 25.420 1.00 0.00 ATOM 24044 H2 SOL 2980 0.300 1.010 25.800 1.00 0.00 ATOM 24045 OH2 SOL 2981 20.660 27.220 67.710 1.00 0.00 ATOM 24046 H1 SOL 2981 19.850 27.660 67.990 1.00 0.00 ATOM 24047 H2 SOL 2981 20.380 26.330 67.490 1.00 0.00 ATOM 24048 OH2 SOL 2982 57.620 18.290 62.970 1.00 0.00 ATOM 24049 H1 SOL 2982 58.510 18.570 63.220 1.00 0.00 ATOM 24050 H2 SOL 2982 57.670 18.160 62.030 1.00 0.00 ATOM 24051 OH2 SOL 2983 1.980 52.730 2.040 1.00 0.00 ATOM 24052 H1 SOL 2983 1.750 53.370 1.380 1.00 0.00 ATOM 24053 H2 SOL 2983 2.270 51.960 1.540 1.00 0.00 ATOM 24054 OH2 SOL 2984 55.820 4.380 76.650 1.00 0.00 ATOM 24055 H1 SOL 2984 56.210 5.210 76.930 1.00 0.00 ATOM 24056 H2 SOL 2984 55.240 4.610 75.930 1.00 0.00 ATOM 24057 OH2 SOL 2985 20.920 7.100 17.210 1.00 0.00 ATOM 24058 H1 SOL 2985 21.590 7.760 17.080 1.00 0.00 ATOM 24059 H2 SOL 2985 20.850 6.660 16.370 1.00 0.00 ATOM 24060 OH2 SOL 2986 50.440 58.300 64.270 1.00 0.00 ATOM 24061 H1 SOL 2986 51.290 58.470 64.680 1.00 0.00 ATOM 24062 H2 SOL 2986 50.570 57.510 63.750 1.00 0.00 ATOM 24063 OH2 SOL 2987 11.270 38.600 9.210 1.00 0.00 ATOM 24064 H1 SOL 2987 11.030 38.840 8.320 1.00 0.00 ATOM 24065 H2 SOL 2987 11.990 39.190 9.440 1.00 0.00 ATOM 24066 OH2 SOL 2988 -0.060 55.280 68.030 1.00 0.00 ATOM 24067 H1 SOL 2988 -0.500 54.590 67.540 1.00 0.00 ATOM 24068 H2 SOL 2988 0.790 55.370 67.600 1.00 0.00 ATOM 24069 OH2 SOL 2989 50.700 43.370 10.620 1.00 0.00 ATOM 24070 H1 SOL 2989 51.110 44.110 11.080 1.00 0.00 ATOM 24071 H2 SOL 2989 50.690 42.660 11.260 1.00 0.00 ATOM 24072 OH2 SOL 2990 39.110 0.910 8.470 1.00 0.00 ATOM 24073 H1 SOL 2990 39.930 1.230 8.100 1.00 0.00 ATOM 24074 H2 SOL 2990 38.670 0.460 7.750 1.00 0.00 ATOM 24075 OH2 SOL 2991 45.680 4.900 15.280 1.00 0.00 ATOM 24076 H1 SOL 2991 46.030 4.170 15.770 1.00 0.00 ATOM 24077 H2 SOL 2991 46.450 5.350 14.930 1.00 0.00 ATOM 24078 OH2 SOL 2992 25.530 33.680 14.050 1.00 0.00 ATOM 24079 H1 SOL 2992 25.830 33.130 14.770 1.00 0.00 ATOM 24080 H2 SOL 2992 24.990 33.100 13.510 1.00 0.00 ATOM 24081 OH2 SOL 2993 3.310 11.540 62.040 1.00 0.00 ATOM 24082 H1 SOL 2993 3.840 11.710 62.820 1.00 0.00 ATOM 24083 H2 SOL 2993 3.590 10.680 61.730 1.00 0.00 ATOM 24084 OH2 SOL 2994 34.460 52.480 75.220 1.00 0.00 ATOM 24085 H1 SOL 2994 33.550 52.200 75.290 1.00 0.00 ATOM 24086 H2 SOL 2994 34.650 52.890 76.070 1.00 0.00 ATOM 24087 OH2 SOL 2995 57.460 18.920 69.540 1.00 0.00 ATOM 24088 H1 SOL 2995 58.390 18.940 69.730 1.00 0.00 ATOM 24089 H2 SOL 2995 57.370 19.430 68.730 1.00 0.00 ATOM 24090 OH2 SOL 2996 49.750 15.600 17.460 1.00 0.00 ATOM 24091 H1 SOL 2996 48.980 16.110 17.710 1.00 0.00 ATOM 24092 H2 SOL 2996 49.400 14.890 16.930 1.00 0.00 ATOM 24093 OH2 SOL 2997 57.300 36.980 10.820 1.00 0.00 ATOM 24094 H1 SOL 2997 56.960 37.830 10.520 1.00 0.00 ATOM 24095 H2 SOL 2997 57.600 36.550 10.020 1.00 0.00 ATOM 24096 OH2 SOL 2998 31.400 44.450 75.940 1.00 0.00 ATOM 24097 H1 SOL 2998 31.550 44.970 76.730 1.00 0.00 ATOM 24098 H2 SOL 2998 30.450 44.310 75.920 1.00 0.00 ATOM 24099 OH2 SOL 2999 12.390 55.440 59.980 1.00 0.00 ATOM 24100 H1 SOL 2999 13.090 56.080 60.090 1.00 0.00 ATOM 24101 H2 SOL 2999 12.700 54.870 59.270 1.00 0.00 ATOM 24102 OH2 SOL 3000 29.320 20.430 13.140 1.00 0.00 ATOM 24103 H1 SOL 3000 29.930 21.000 13.610 1.00 0.00 ATOM 24104 H2 SOL 3000 28.610 20.270 13.760 1.00 0.00 ATOM 24105 OH2 SOL 3001 6.950 31.670 73.640 1.00 0.00 ATOM 24106 H1 SOL 3001 6.500 31.320 74.410 1.00 0.00 ATOM 24107 H2 SOL 3001 7.400 30.920 73.250 1.00 0.00 ATOM 24108 OH2 SOL 3002 27.280 48.140 77.850 1.00 0.00 ATOM 24109 H1 SOL 3002 27.020 48.960 78.270 1.00 0.00 ATOM 24110 H2 SOL 3002 28.230 48.190 77.780 1.00 0.00 ATOM 24111 OH2 SOL 3003 53.940 15.920 12.280 1.00 0.00 ATOM 24112 H1 SOL 3003 53.610 16.520 12.940 1.00 0.00 ATOM 24113 H2 SOL 3003 54.660 15.450 12.710 1.00 0.00 ATOM 24114 OH2 SOL 3004 24.200 33.910 83.100 1.00 0.00 ATOM 24115 H1 SOL 3004 24.220 33.340 83.870 1.00 0.00 ATOM 24116 H2 SOL 3004 23.810 34.720 83.410 1.00 0.00 ATOM 24117 OH2 SOL 3005 50.240 35.480 12.890 1.00 0.00 ATOM 24118 H1 SOL 3005 51.170 35.700 13.000 1.00 0.00 ATOM 24119 H2 SOL 3005 49.810 36.310 12.710 1.00 0.00 ATOM 24120 OH2 SOL 3006 7.090 7.780 12.430 1.00 0.00 ATOM 24121 H1 SOL 3006 7.290 6.860 12.270 1.00 0.00 ATOM 24122 H2 SOL 3006 7.910 8.240 12.200 1.00 0.00 ATOM 24123 OH2 SOL 3007 26.700 27.410 69.870 1.00 0.00 ATOM 24124 H1 SOL 3007 25.750 27.260 69.790 1.00 0.00 ATOM 24125 H2 SOL 3007 26.820 28.300 69.540 1.00 0.00 ATOM 24126 OH2 SOL 3008 44.860 38.470 6.500 1.00 0.00 ATOM 24127 H1 SOL 3008 44.420 38.620 7.330 1.00 0.00 ATOM 24128 H2 SOL 3008 45.300 37.630 6.610 1.00 0.00 ATOM 24129 OH2 SOL 3009 53.720 8.230 78.040 1.00 0.00 ATOM 24130 H1 SOL 3009 53.390 7.530 78.610 1.00 0.00 ATOM 24131 H2 SOL 3009 53.290 8.080 77.200 1.00 0.00 ATOM 24132 OH2 SOL 3010 11.450 42.750 75.560 1.00 0.00 ATOM 24133 H1 SOL 3010 11.930 42.960 76.360 1.00 0.00 ATOM 24134 H2 SOL 3010 10.530 42.870 75.790 1.00 0.00 ATOM 24135 OH2 SOL 3011 59.390 2.210 76.040 1.00 0.00 ATOM 24136 H1 SOL 3011 59.040 2.330 76.920 1.00 0.00 ATOM 24137 H2 SOL 3011 59.990 2.950 75.910 1.00 0.00 ATOM 24138 OH2 SOL 3012 1.910 8.920 6.650 1.00 0.00 ATOM 24139 H1 SOL 3012 2.820 8.730 6.420 1.00 0.00 ATOM 24140 H2 SOL 3012 1.940 9.820 7.000 1.00 0.00 ATOM 24141 OH2 SOL 3013 2.100 18.180 73.650 1.00 0.00 ATOM 24142 H1 SOL 3013 1.580 17.450 73.330 1.00 0.00 ATOM 24143 H2 SOL 3013 1.590 18.960 73.420 1.00 0.00 ATOM 24144 OH2 SOL 3014 27.700 13.130 10.340 1.00 0.00 ATOM 24145 H1 SOL 3014 28.540 12.750 10.560 1.00 0.00 ATOM 24146 H2 SOL 3014 27.170 12.390 10.030 1.00 0.00 ATOM 24147 OH2 SOL 3015 11.690 11.350 67.350 1.00 0.00 ATOM 24148 H1 SOL 3015 11.630 10.490 66.920 1.00 0.00 ATOM 24149 H2 SOL 3015 11.330 11.200 68.220 1.00 0.00 ATOM 24150 OH2 SOL 3016 46.960 30.700 2.150 1.00 0.00 ATOM 24151 H1 SOL 3016 47.630 30.810 2.820 1.00 0.00 ATOM 24152 H2 SOL 3016 47.310 31.150 1.380 1.00 0.00 ATOM 24153 OH2 SOL 3017 25.970 33.490 8.570 1.00 0.00 ATOM 24154 H1 SOL 3017 26.650 32.860 8.770 1.00 0.00 ATOM 24155 H2 SOL 3017 25.320 33.370 9.260 1.00 0.00 ATOM 24156 OH2 SOL 3018 24.200 26.600 77.040 1.00 0.00 ATOM 24157 H1 SOL 3018 23.860 27.080 77.790 1.00 0.00 ATOM 24158 H2 SOL 3018 24.360 27.270 76.370 1.00 0.00 ATOM 24159 OH2 SOL 3019 54.570 49.170 1.200 1.00 0.00 ATOM 24160 H1 SOL 3019 54.060 48.600 0.620 1.00 0.00 ATOM 24161 H2 SOL 3019 54.220 48.990 2.080 1.00 0.00 ATOM 24162 OH2 SOL 3020 58.040 41.240 4.400 1.00 0.00 ATOM 24163 H1 SOL 3020 58.140 41.720 5.230 1.00 0.00 ATOM 24164 H2 SOL 3020 57.130 41.370 4.150 1.00 0.00 ATOM 24165 OH2 SOL 3021 55.520 54.400 65.530 1.00 0.00 ATOM 24166 H1 SOL 3021 55.590 55.160 64.960 1.00 0.00 ATOM 24167 H2 SOL 3021 54.810 53.880 65.150 1.00 0.00 ATOM 24168 OH2 SOL 3022 32.810 23.770 79.310 1.00 0.00 ATOM 24169 H1 SOL 3022 32.020 24.130 78.930 1.00 0.00 ATOM 24170 H2 SOL 3022 33.520 24.260 78.910 1.00 0.00 ATOM 24171 OH2 SOL 3023 11.320 3.410 9.820 1.00 0.00 ATOM 24172 H1 SOL 3023 11.220 2.470 9.660 1.00 0.00 ATOM 24173 H2 SOL 3023 11.760 3.460 10.680 1.00 0.00 ATOM 24174 OH2 SOL 3024 53.420 55.900 10.210 1.00 0.00 ATOM 24175 H1 SOL 3024 54.060 55.690 10.890 1.00 0.00 ATOM 24176 H2 SOL 3024 53.220 55.050 9.800 1.00 0.00 ATOM 24177 OH2 SOL 3025 21.330 8.010 77.630 1.00 0.00 ATOM 24178 H1 SOL 3025 21.930 8.590 77.160 1.00 0.00 ATOM 24179 H2 SOL 3025 21.210 8.440 78.480 1.00 0.00 ATOM 24180 OH2 SOL 3026 2.990 49.270 14.610 1.00 0.00 ATOM 24181 H1 SOL 3026 2.380 49.930 14.270 1.00 0.00 ATOM 24182 H2 SOL 3026 3.630 49.770 15.110 1.00 0.00 ATOM 24183 OH2 SOL 3027 53.990 14.020 22.000 1.00 0.00 ATOM 24184 H1 SOL 3027 53.090 13.900 22.280 1.00 0.00 ATOM 24185 H2 SOL 3027 54.140 13.340 21.350 1.00 0.00 ATOM 24186 OH2 SOL 3028 15.800 21.930 12.050 1.00 0.00 ATOM 24187 H1 SOL 3028 16.040 21.740 12.960 1.00 0.00 ATOM 24188 H2 SOL 3028 16.580 21.720 11.540 1.00 0.00 ATOM 24189 OH2 SOL 3029 50.240 9.780 4.140 1.00 0.00 ATOM 24190 H1 SOL 3029 51.040 10.150 4.520 1.00 0.00 ATOM 24191 H2 SOL 3029 49.830 10.510 3.680 1.00 0.00 ATOM 24192 OH2 SOL 3030 18.830 5.410 20.060 1.00 0.00 ATOM 24193 H1 SOL 3030 19.070 5.450 20.990 1.00 0.00 ATOM 24194 H2 SOL 3030 18.060 5.970 19.990 1.00 0.00 ATOM 24195 OH2 SOL 3031 42.990 26.030 75.040 1.00 0.00 ATOM 24196 H1 SOL 3031 42.060 26.240 75.140 1.00 0.00 ATOM 24197 H2 SOL 3031 43.440 26.860 75.200 1.00 0.00 ATOM 24198 OH2 SOL 3032 26.830 23.520 9.400 1.00 0.00 ATOM 24199 H1 SOL 3032 26.690 22.860 8.730 1.00 0.00 ATOM 24200 H2 SOL 3032 26.010 23.550 9.890 1.00 0.00 ATOM 24201 OH2 SOL 3033 6.640 36.820 0.690 1.00 0.00 ATOM 24202 H1 SOL 3033 6.700 37.680 1.100 1.00 0.00 ATOM 24203 H2 SOL 3033 5.920 36.380 1.150 1.00 0.00 ATOM 24204 OH2 SOL 3034 56.490 9.010 84.230 1.00 0.00 ATOM 24205 H1 SOL 3034 56.680 9.690 84.880 1.00 0.00 ATOM 24206 H2 SOL 3034 56.680 8.190 84.690 1.00 0.00 ATOM 24207 OH2 SOL 3035 7.850 28.420 0.600 1.00 0.00 ATOM 24208 H1 SOL 3035 8.430 29.170 0.750 1.00 0.00 ATOM 24209 H2 SOL 3035 7.620 28.130 1.480 1.00 0.00 ATOM 24210 OH2 SOL 3036 7.470 19.090 20.890 1.00 0.00 ATOM 24211 H1 SOL 3036 7.020 18.540 20.240 1.00 0.00 ATOM 24212 H2 SOL 3036 6.840 19.180 21.610 1.00 0.00 ATOM 24213 OH2 SOL 3037 33.420 6.030 0.330 1.00 0.00 ATOM 24214 H1 SOL 3037 34.030 6.750 0.180 1.00 0.00 ATOM 24215 H2 SOL 3037 32.550 6.440 0.350 1.00 0.00 ATOM 24216 OH2 SOL 3038 21.520 57.530 82.320 1.00 0.00 ATOM 24217 H1 SOL 3038 21.540 57.480 83.270 1.00 0.00 ATOM 24218 H2 SOL 3038 21.630 56.630 82.030 1.00 0.00 ATOM 24219 OH2 SOL 3039 54.030 10.100 13.430 1.00 0.00 ATOM 24220 H1 SOL 3039 53.990 10.270 12.490 1.00 0.00 ATOM 24221 H2 SOL 3039 54.930 9.810 13.590 1.00 0.00 ATOM 24222 OH2 SOL 3040 57.560 6.220 16.700 1.00 0.00 ATOM 24223 H1 SOL 3040 57.740 7.160 16.740 1.00 0.00 ATOM 24224 H2 SOL 3040 56.930 6.120 15.990 1.00 0.00 ATOM 24225 OH2 SOL 3041 38.680 42.030 5.620 1.00 0.00 ATOM 24226 H1 SOL 3041 39.230 42.560 5.040 1.00 0.00 ATOM 24227 H2 SOL 3041 37.990 42.630 5.910 1.00 0.00 ATOM 24228 OH2 SOL 3042 13.230 58.130 12.670 1.00 0.00 ATOM 24229 H1 SOL 3042 13.830 58.730 13.120 1.00 0.00 ATOM 24230 H2 SOL 3042 13.400 57.280 13.080 1.00 0.00 ATOM 24231 OH2 SOL 3043 4.100 26.650 68.070 1.00 0.00 ATOM 24232 H1 SOL 3043 3.150 26.510 68.050 1.00 0.00 ATOM 24233 H2 SOL 3043 4.470 25.810 67.800 1.00 0.00 ATOM 24234 OH2 SOL 3044 34.240 7.930 3.070 1.00 0.00 ATOM 24235 H1 SOL 3044 34.250 8.630 3.720 1.00 0.00 ATOM 24236 H2 SOL 3044 33.390 7.500 3.200 1.00 0.00 ATOM 24237 OH2 SOL 3045 49.970 45.640 70.170 1.00 0.00 ATOM 24238 H1 SOL 3045 50.010 45.140 69.360 1.00 0.00 ATOM 24239 H2 SOL 3045 50.510 46.420 70.000 1.00 0.00 ATOM 24240 OH2 SOL 3046 15.880 11.630 2.650 1.00 0.00 ATOM 24241 H1 SOL 3046 16.230 11.330 3.480 1.00 0.00 ATOM 24242 H2 SOL 3046 16.070 12.570 2.640 1.00 0.00 ATOM 24243 OH2 SOL 3047 3.690 55.790 18.400 1.00 0.00 ATOM 24244 H1 SOL 3047 3.610 56.730 18.230 1.00 0.00 ATOM 24245 H2 SOL 3047 2.910 55.570 18.910 1.00 0.00 ATOM 24246 OH2 SOL 3048 27.290 4.800 61.930 1.00 0.00 ATOM 24247 H1 SOL 3048 26.750 5.030 62.680 1.00 0.00 ATOM 24248 H2 SOL 3048 27.840 5.560 61.780 1.00 0.00 ATOM 24249 OH2 SOL 3049 32.040 45.900 73.550 1.00 0.00 ATOM 24250 H1 SOL 3049 31.830 45.370 74.320 1.00 0.00 ATOM 24251 H2 SOL 3049 31.210 46.280 73.290 1.00 0.00 ATOM 24252 OH2 SOL 3050 13.930 19.490 80.660 1.00 0.00 ATOM 24253 H1 SOL 3050 14.470 19.880 79.970 1.00 0.00 ATOM 24254 H2 SOL 3050 13.030 19.570 80.330 1.00 0.00 ATOM 24255 OH2 SOL 3051 48.280 53.260 0.370 1.00 0.00 ATOM 24256 H1 SOL 3051 47.760 53.300 -0.430 1.00 0.00 ATOM 24257 H2 SOL 3051 47.840 52.610 0.920 1.00 0.00 ATOM 24258 OH2 SOL 3052 36.360 18.650 75.490 1.00 0.00 ATOM 24259 H1 SOL 3052 37.030 18.490 76.150 1.00 0.00 ATOM 24260 H2 SOL 3052 36.620 19.470 75.060 1.00 0.00 ATOM 24261 OH2 SOL 3053 56.410 39.290 9.640 1.00 0.00 ATOM 24262 H1 SOL 3053 56.960 39.310 8.860 1.00 0.00 ATOM 24263 H2 SOL 3053 56.680 40.060 10.150 1.00 0.00 ATOM 24264 OH2 SOL 3054 49.560 27.690 83.790 1.00 0.00 ATOM 24265 H1 SOL 3054 49.480 26.800 84.120 1.00 0.00 ATOM 24266 H2 SOL 3054 49.350 27.630 82.860 1.00 0.00 ATOM 24267 OH2 SOL 3055 46.480 13.360 20.240 1.00 0.00 ATOM 24268 H1 SOL 3055 45.860 13.880 19.730 1.00 0.00 ATOM 24269 H2 SOL 3055 46.640 12.590 19.690 1.00 0.00 ATOM 24270 OH2 SOL 3056 23.440 27.810 20.380 1.00 0.00 ATOM 24271 H1 SOL 3056 23.230 27.420 19.530 1.00 0.00 ATOM 24272 H2 SOL 3056 24.380 28.000 20.330 1.00 0.00 ATOM 24273 OH2 SOL 3057 4.980 31.150 5.930 1.00 0.00 ATOM 24274 H1 SOL 3057 4.550 31.320 5.100 1.00 0.00 ATOM 24275 H2 SOL 3057 4.270 30.940 6.540 1.00 0.00 ATOM 24276 OH2 SOL 3058 58.630 56.580 4.700 1.00 0.00 ATOM 24277 H1 SOL 3058 59.200 55.830 4.870 1.00 0.00 ATOM 24278 H2 SOL 3058 58.660 57.090 5.500 1.00 0.00 ATOM 24279 OH2 SOL 3059 37.330 19.450 59.380 1.00 0.00 ATOM 24280 H1 SOL 3059 36.700 18.920 58.900 1.00 0.00 ATOM 24281 H2 SOL 3059 36.830 20.190 59.700 1.00 0.00 ATOM 24282 OH2 SOL 3060 33.250 24.100 73.810 1.00 0.00 ATOM 24283 H1 SOL 3060 33.480 23.240 73.450 1.00 0.00 ATOM 24284 H2 SOL 3060 32.810 24.550 73.090 1.00 0.00 ATOM 24285 OH2 SOL 3061 46.370 51.370 13.510 1.00 0.00 ATOM 24286 H1 SOL 3061 46.520 50.540 13.060 1.00 0.00 ATOM 24287 H2 SOL 3061 46.040 51.960 12.830 1.00 0.00 ATOM 24288 OH2 SOL 3062 21.430 46.240 2.760 1.00 0.00 ATOM 24289 H1 SOL 3062 20.660 46.020 3.290 1.00 0.00 ATOM 24290 H2 SOL 3062 22.120 45.670 3.100 1.00 0.00 ATOM 24291 OH2 SOL 3063 25.670 35.910 79.740 1.00 0.00 ATOM 24292 H1 SOL 3063 25.000 36.510 79.400 1.00 0.00 ATOM 24293 H2 SOL 3063 25.770 36.150 80.660 1.00 0.00 ATOM 24294 OH2 SOL 3064 40.550 38.980 72.760 1.00 0.00 ATOM 24295 H1 SOL 3064 39.980 38.710 73.480 1.00 0.00 ATOM 24296 H2 SOL 3064 40.870 39.840 73.010 1.00 0.00 ATOM 24297 OH2 SOL 3065 33.710 11.090 65.730 1.00 0.00 ATOM 24298 H1 SOL 3065 34.360 10.400 65.810 1.00 0.00 ATOM 24299 H2 SOL 3065 32.870 10.620 65.690 1.00 0.00 ATOM 24300 OH2 SOL 3066 8.850 46.670 76.950 1.00 0.00 ATOM 24301 H1 SOL 3066 8.530 46.030 76.310 1.00 0.00 ATOM 24302 H2 SOL 3066 8.220 47.390 76.910 1.00 0.00 ATOM 24303 OH2 SOL 3067 31.740 17.520 73.710 1.00 0.00 ATOM 24304 H1 SOL 3067 32.210 18.290 73.400 1.00 0.00 ATOM 24305 H2 SOL 3067 30.990 17.870 74.200 1.00 0.00 ATOM 24306 OH2 SOL 3068 49.230 38.200 14.420 1.00 0.00 ATOM 24307 H1 SOL 3068 49.920 38.810 14.690 1.00 0.00 ATOM 24308 H2 SOL 3068 48.420 38.680 14.550 1.00 0.00 ATOM 24309 OH2 SOL 3069 19.980 23.680 23.930 1.00 0.00 ATOM 24310 H1 SOL 3069 19.620 23.280 23.140 1.00 0.00 ATOM 24311 H2 SOL 3069 20.220 24.570 23.670 1.00 0.00 ATOM 24312 OH2 SOL 3070 18.520 34.320 3.920 1.00 0.00 ATOM 24313 H1 SOL 3070 18.990 35.130 4.130 1.00 0.00 ATOM 24314 H2 SOL 3070 17.690 34.600 3.550 1.00 0.00 ATOM 24315 OH2 SOL 3071 30.830 10.760 77.270 1.00 0.00 ATOM 24316 H1 SOL 3071 31.200 10.980 78.130 1.00 0.00 ATOM 24317 H2 SOL 3071 31.120 9.850 77.120 1.00 0.00 ATOM 24318 OH2 SOL 3072 31.980 3.740 79.330 1.00 0.00 ATOM 24319 H1 SOL 3072 31.780 2.810 79.220 1.00 0.00 ATOM 24320 H2 SOL 3072 32.930 3.790 79.320 1.00 0.00 ATOM 24321 OH2 SOL 3073 53.670 45.640 81.660 1.00 0.00 ATOM 24322 H1 SOL 3073 52.990 45.550 81.000 1.00 0.00 ATOM 24323 H2 SOL 3073 54.290 44.940 81.470 1.00 0.00 ATOM 24324 OH2 SOL 3074 0.580 9.030 21.760 1.00 0.00 ATOM 24325 H1 SOL 3074 -0.250 8.600 21.520 1.00 0.00 ATOM 24326 H2 SOL 3074 0.500 9.180 22.700 1.00 0.00 ATOM 24327 OH2 SOL 3075 40.790 30.100 2.830 1.00 0.00 ATOM 24328 H1 SOL 3075 41.430 30.590 2.320 1.00 0.00 ATOM 24329 H2 SOL 3075 41.270 29.820 3.610 1.00 0.00 ATOM 24330 OH2 SOL 3076 5.110 20.420 80.470 1.00 0.00 ATOM 24331 H1 SOL 3076 6.060 20.510 80.520 1.00 0.00 ATOM 24332 H2 SOL 3076 4.920 19.600 80.920 1.00 0.00 ATOM 24333 OH2 SOL 3077 47.280 39.190 18.700 1.00 0.00 ATOM 24334 H1 SOL 3077 46.760 39.530 19.430 1.00 0.00 ATOM 24335 H2 SOL 3077 46.650 39.060 17.990 1.00 0.00 ATOM 24336 OH2 SOL 3078 9.300 5.250 23.330 1.00 0.00 ATOM 24337 H1 SOL 3078 8.560 4.660 23.450 1.00 0.00 ATOM 24338 H2 SOL 3078 9.040 5.840 22.630 1.00 0.00 ATOM 24339 OH2 SOL 3079 39.010 33.320 79.910 1.00 0.00 ATOM 24340 H1 SOL 3079 39.670 33.820 79.430 1.00 0.00 ATOM 24341 H2 SOL 3079 38.220 33.400 79.380 1.00 0.00 ATOM 24342 OH2 SOL 3080 45.500 44.330 65.570 1.00 0.00 ATOM 24343 H1 SOL 3080 45.480 45.290 65.480 1.00 0.00 ATOM 24344 H2 SOL 3080 46.390 44.140 65.860 1.00 0.00 ATOM 24345 OH2 SOL 3081 20.720 41.870 19.440 1.00 0.00 ATOM 24346 H1 SOL 3081 20.390 41.580 18.590 1.00 0.00 ATOM 24347 H2 SOL 3081 20.180 41.400 20.080 1.00 0.00 ATOM 24348 OH2 SOL 3082 21.690 22.360 25.590 1.00 0.00 ATOM 24349 H1 SOL 3082 21.320 23.000 24.970 1.00 0.00 ATOM 24350 H2 SOL 3082 20.930 22.070 26.100 1.00 0.00 ATOM 24351 OH2 SOL 3083 11.560 21.680 17.960 1.00 0.00 ATOM 24352 H1 SOL 3083 12.140 22.250 17.460 1.00 0.00 ATOM 24353 H2 SOL 3083 11.360 20.960 17.360 1.00 0.00 ATOM 24354 OH2 SOL 3084 41.530 18.870 10.330 1.00 0.00 ATOM 24355 H1 SOL 3084 41.950 19.520 9.770 1.00 0.00 ATOM 24356 H2 SOL 3084 42.000 18.920 11.170 1.00 0.00 ATOM 24357 OH2 SOL 3085 3.720 12.660 67.200 1.00 0.00 ATOM 24358 H1 SOL 3085 4.080 12.110 67.890 1.00 0.00 ATOM 24359 H2 SOL 3085 2.890 12.250 66.960 1.00 0.00 ATOM 24360 OH2 SOL 3086 2.300 36.500 13.000 1.00 0.00 ATOM 24361 H1 SOL 3086 2.960 37.180 12.860 1.00 0.00 ATOM 24362 H2 SOL 3086 1.470 36.930 12.790 1.00 0.00 ATOM 24363 OH2 SOL 3087 17.840 1.410 3.480 1.00 0.00 ATOM 24364 H1 SOL 3087 17.450 1.500 4.350 1.00 0.00 ATOM 24365 H2 SOL 3087 18.770 1.280 3.650 1.00 0.00 ATOM 24366 OH2 SOL 3088 49.700 35.430 15.630 1.00 0.00 ATOM 24367 H1 SOL 3088 49.280 36.180 16.060 1.00 0.00 ATOM 24368 H2 SOL 3088 49.550 35.570 14.700 1.00 0.00 ATOM 24369 OH2 SOL 3089 40.990 7.900 6.500 1.00 0.00 ATOM 24370 H1 SOL 3089 41.380 7.420 7.240 1.00 0.00 ATOM 24371 H2 SOL 3089 40.180 7.430 6.310 1.00 0.00 ATOM 24372 OH2 SOL 3090 1.570 6.910 76.310 1.00 0.00 ATOM 24373 H1 SOL 3090 0.860 6.340 76.610 1.00 0.00 ATOM 24374 H2 SOL 3090 2.280 6.740 76.920 1.00 0.00 ATOM 24375 OH2 SOL 3091 46.810 44.080 82.540 1.00 0.00 ATOM 24376 H1 SOL 3091 46.620 44.270 83.460 1.00 0.00 ATOM 24377 H2 SOL 3091 45.960 44.090 82.110 1.00 0.00 ATOM 24378 OH2 SOL 3092 42.470 20.540 16.290 1.00 0.00 ATOM 24379 H1 SOL 3092 42.500 19.610 16.500 1.00 0.00 ATOM 24380 H2 SOL 3092 42.880 20.970 17.040 1.00 0.00 ATOM 24381 OH2 SOL 3093 41.790 30.590 76.240 1.00 0.00 ATOM 24382 H1 SOL 3093 42.290 31.000 76.950 1.00 0.00 ATOM 24383 H2 SOL 3093 41.520 31.320 75.690 1.00 0.00 ATOM 24384 OH2 SOL 3094 1.420 0.860 82.460 1.00 0.00 ATOM 24385 H1 SOL 3094 0.810 0.590 83.140 1.00 0.00 ATOM 24386 H2 SOL 3094 1.130 0.390 81.680 1.00 0.00 ATOM 24387 OH2 SOL 3095 44.650 50.280 77.410 1.00 0.00 ATOM 24388 H1 SOL 3095 44.140 50.970 76.980 1.00 0.00 ATOM 24389 H2 SOL 3095 45.290 50.010 76.760 1.00 0.00 ATOM 24390 OH2 SOL 3096 49.500 8.800 76.950 1.00 0.00 ATOM 24391 H1 SOL 3096 50.120 8.720 76.230 1.00 0.00 ATOM 24392 H2 SOL 3096 50.050 8.820 77.730 1.00 0.00 ATOM 24393 OH2 SOL 3097 23.920 38.620 3.450 1.00 0.00 ATOM 24394 H1 SOL 3097 23.990 37.990 4.170 1.00 0.00 ATOM 24395 H2 SOL 3097 23.290 38.230 2.850 1.00 0.00 ATOM 24396 OH2 SOL 3098 7.130 2.180 74.580 1.00 0.00 ATOM 24397 H1 SOL 3098 7.630 2.950 74.320 1.00 0.00 ATOM 24398 H2 SOL 3098 6.900 2.340 75.500 1.00 0.00 ATOM 24399 OH2 SOL 3099 55.210 28.970 62.540 1.00 0.00 ATOM 24400 H1 SOL 3099 55.760 28.650 61.820 1.00 0.00 ATOM 24401 H2 SOL 3099 54.650 29.630 62.140 1.00 0.00 ATOM 24402 OH2 SOL 3100 23.240 9.990 0.980 1.00 0.00 ATOM 24403 H1 SOL 3100 22.540 10.640 1.020 1.00 0.00 ATOM 24404 H2 SOL 3100 23.310 9.660 1.880 1.00 0.00 ATOM 24405 OH2 SOL 3101 10.790 36.540 13.390 1.00 0.00 ATOM 24406 H1 SOL 3101 10.390 36.270 14.220 1.00 0.00 ATOM 24407 H2 SOL 3101 11.640 36.110 13.370 1.00 0.00 ATOM 24408 OH2 SOL 3102 41.980 2.550 83.860 1.00 0.00 ATOM 24409 H1 SOL 3102 41.780 3.050 84.650 1.00 0.00 ATOM 24410 H2 SOL 3102 41.130 2.330 83.490 1.00 0.00 ATOM 24411 OH2 SOL 3103 13.570 23.270 14.850 1.00 0.00 ATOM 24412 H1 SOL 3103 14.010 22.440 14.660 1.00 0.00 ATOM 24413 H2 SOL 3103 13.740 23.430 15.780 1.00 0.00 ATOM 24414 OH2 SOL 3104 45.870 52.270 71.390 1.00 0.00 ATOM 24415 H1 SOL 3104 45.080 52.100 71.900 1.00 0.00 ATOM 24416 H2 SOL 3104 46.290 51.420 71.300 1.00 0.00 ATOM 24417 OH2 SOL 3105 47.500 1.030 81.050 1.00 0.00 ATOM 24418 H1 SOL 3105 48.430 1.140 81.230 1.00 0.00 ATOM 24419 H2 SOL 3105 47.140 1.920 81.100 1.00 0.00 ATOM 24420 OH2 SOL 3106 14.910 39.890 1.530 1.00 0.00 ATOM 24421 H1 SOL 3106 15.490 40.030 2.280 1.00 0.00 ATOM 24422 H2 SOL 3106 14.930 38.940 1.390 1.00 0.00 ATOM 24423 OH2 SOL 3107 50.140 55.240 1.090 1.00 0.00 ATOM 24424 H1 SOL 3107 50.570 55.250 0.230 1.00 0.00 ATOM 24425 H2 SOL 3107 49.480 54.540 1.010 1.00 0.00 ATOM 24426 OH2 SOL 3108 15.280 25.870 71.920 1.00 0.00 ATOM 24427 H1 SOL 3108 16.020 25.770 72.510 1.00 0.00 ATOM 24428 H2 SOL 3108 14.980 26.770 72.060 1.00 0.00 ATOM 24429 OH2 SOL 3109 52.000 21.010 14.940 1.00 0.00 ATOM 24430 H1 SOL 3109 51.740 20.960 14.020 1.00 0.00 ATOM 24431 H2 SOL 3109 51.260 20.620 15.420 1.00 0.00 ATOM 24432 OH2 SOL 3110 26.530 6.150 7.330 1.00 0.00 ATOM 24433 H1 SOL 3110 26.780 7.070 7.240 1.00 0.00 ATOM 24434 H2 SOL 3110 26.040 5.960 6.520 1.00 0.00 ATOM 24435 OH2 SOL 3111 59.720 20.490 29.770 1.00 0.00 ATOM 24436 H1 SOL 3111 58.800 20.460 30.030 1.00 0.00 ATOM 24437 H2 SOL 3111 60.050 21.310 30.150 1.00 0.00 ATOM 24438 OH2 SOL 3112 6.810 7.130 15.180 1.00 0.00 ATOM 24439 H1 SOL 3112 7.040 7.490 14.330 1.00 0.00 ATOM 24440 H2 SOL 3112 7.600 6.690 15.480 1.00 0.00 ATOM 24441 OH2 SOL 3113 38.750 45.510 21.700 1.00 0.00 ATOM 24442 H1 SOL 3113 38.220 45.380 20.920 1.00 0.00 ATOM 24443 H2 SOL 3113 39.350 44.760 21.710 1.00 0.00 ATOM 24444 OH2 SOL 3114 50.550 4.070 5.180 1.00 0.00 ATOM 24445 H1 SOL 3114 51.380 4.520 5.040 1.00 0.00 ATOM 24446 H2 SOL 3114 50.120 4.090 4.320 1.00 0.00 ATOM 24447 OH2 SOL 3115 43.560 28.470 64.830 1.00 0.00 ATOM 24448 H1 SOL 3115 43.420 27.900 65.590 1.00 0.00 ATOM 24449 H2 SOL 3115 43.140 29.300 65.070 1.00 0.00 ATOM 24450 OH2 SOL 3116 24.510 14.750 6.310 1.00 0.00 ATOM 24451 H1 SOL 3116 25.310 14.770 5.790 1.00 0.00 ATOM 24452 H2 SOL 3116 24.020 14.000 5.970 1.00 0.00 ATOM 24453 OH2 SOL 3117 29.680 35.860 81.960 1.00 0.00 ATOM 24454 H1 SOL 3117 29.870 34.990 82.310 1.00 0.00 ATOM 24455 H2 SOL 3117 28.910 36.150 82.440 1.00 0.00 ATOM 24456 OH2 SOL 3118 46.310 23.000 78.810 1.00 0.00 ATOM 24457 H1 SOL 3118 45.570 23.590 78.990 1.00 0.00 ATOM 24458 H2 SOL 3118 47.010 23.580 78.520 1.00 0.00 ATOM 24459 OH2 SOL 3119 17.100 47.720 78.570 1.00 0.00 ATOM 24460 H1 SOL 3119 16.320 47.580 79.110 1.00 0.00 ATOM 24461 H2 SOL 3119 16.820 47.480 77.680 1.00 0.00 ATOM 24462 OH2 SOL 3120 35.900 51.390 16.000 1.00 0.00 ATOM 24463 H1 SOL 3120 36.670 51.950 15.970 1.00 0.00 ATOM 24464 H2 SOL 3120 36.120 50.700 16.630 1.00 0.00 ATOM 24465 OH2 SOL 3121 45.870 57.250 9.160 1.00 0.00 ATOM 24466 H1 SOL 3121 45.570 57.640 9.980 1.00 0.00 ATOM 24467 H2 SOL 3121 46.640 57.760 8.920 1.00 0.00 ATOM 24468 OH2 SOL 3122 11.120 35.300 4.840 1.00 0.00 ATOM 24469 H1 SOL 3122 11.890 35.750 4.510 1.00 0.00 ATOM 24470 H2 SOL 3122 11.360 34.370 4.850 1.00 0.00 ATOM 24471 OH2 SOL 3123 46.450 59.070 75.360 1.00 0.00 ATOM 24472 H1 SOL 3123 46.450 59.620 76.140 1.00 0.00 ATOM 24473 H2 SOL 3123 46.580 58.180 75.690 1.00 0.00 ATOM 24474 OH2 SOL 3124 21.840 50.430 0.500 1.00 0.00 ATOM 24475 H1 SOL 3124 21.850 50.870 -0.350 1.00 0.00 ATOM 24476 H2 SOL 3124 21.550 51.110 1.120 1.00 0.00 ATOM 24477 OH2 SOL 3125 37.090 41.980 15.030 1.00 0.00 ATOM 24478 H1 SOL 3125 37.320 41.050 15.110 1.00 0.00 ATOM 24479 H2 SOL 3125 36.190 42.040 15.370 1.00 0.00 ATOM 24480 OH2 SOL 3126 32.570 16.880 13.140 1.00 0.00 ATOM 24481 H1 SOL 3126 32.940 17.270 12.350 1.00 0.00 ATOM 24482 H2 SOL 3126 31.980 16.190 12.830 1.00 0.00 ATOM 24483 OH2 SOL 3127 10.170 30.810 1.890 1.00 0.00 ATOM 24484 H1 SOL 3127 10.160 30.470 2.790 1.00 0.00 ATOM 24485 H2 SOL 3127 9.440 31.430 1.870 1.00 0.00 ATOM 24486 OH2 SOL 3128 34.440 12.100 1.500 1.00 0.00 ATOM 24487 H1 SOL 3128 33.810 11.480 1.130 1.00 0.00 ATOM 24488 H2 SOL 3128 34.970 11.570 2.090 1.00 0.00 ATOM 24489 OH2 SOL 3129 5.630 56.610 3.270 1.00 0.00 ATOM 24490 H1 SOL 3129 6.460 56.840 2.850 1.00 0.00 ATOM 24491 H2 SOL 3129 5.310 55.860 2.760 1.00 0.00 ATOM 24492 OH2 SOL 3130 11.090 9.150 65.890 1.00 0.00 ATOM 24493 H1 SOL 3130 11.640 8.400 65.660 1.00 0.00 ATOM 24494 H2 SOL 3130 10.240 8.940 65.510 1.00 0.00 ATOM 24495 OH2 SOL 3131 12.040 49.830 22.590 1.00 0.00 ATOM 24496 H1 SOL 3131 11.630 49.470 21.800 1.00 0.00 ATOM 24497 H2 SOL 3131 12.830 50.260 22.270 1.00 0.00 ATOM 24498 OH2 SOL 3132 22.840 44.900 68.850 1.00 0.00 ATOM 24499 H1 SOL 3132 23.690 44.510 68.620 1.00 0.00 ATOM 24500 H2 SOL 3132 22.240 44.600 68.170 1.00 0.00 ATOM 24501 OH2 SOL 3133 2.160 8.540 65.860 1.00 0.00 ATOM 24502 H1 SOL 3133 3.040 8.220 66.050 1.00 0.00 ATOM 24503 H2 SOL 3133 1.630 7.750 65.790 1.00 0.00 ATOM 24504 OH2 SOL 3134 40.840 16.930 17.570 1.00 0.00 ATOM 24505 H1 SOL 3134 40.320 16.130 17.650 1.00 0.00 ATOM 24506 H2 SOL 3134 40.190 17.630 17.520 1.00 0.00 ATOM 24507 OH2 SOL 3135 8.790 35.980 80.280 1.00 0.00 ATOM 24508 H1 SOL 3135 8.340 36.340 81.050 1.00 0.00 ATOM 24509 H2 SOL 3135 9.430 36.650 80.050 1.00 0.00 ATOM 24510 OH2 SOL 3136 10.310 6.780 21.070 1.00 0.00 ATOM 24511 H1 SOL 3136 10.210 5.930 20.640 1.00 0.00 ATOM 24512 H2 SOL 3136 10.930 6.620 21.780 1.00 0.00 ATOM 24513 OH2 SOL 3137 41.690 40.390 11.740 1.00 0.00 ATOM 24514 H1 SOL 3137 40.920 39.810 11.660 1.00 0.00 ATOM 24515 H2 SOL 3137 42.250 39.950 12.370 1.00 0.00 ATOM 24516 OH2 SOL 3138 51.850 5.600 81.850 1.00 0.00 ATOM 24517 H1 SOL 3138 52.210 6.380 82.270 1.00 0.00 ATOM 24518 H2 SOL 3138 51.830 5.810 80.920 1.00 0.00 ATOM 24519 OH2 SOL 3139 38.560 32.200 84.300 1.00 0.00 ATOM 24520 H1 SOL 3139 38.240 31.660 83.580 1.00 0.00 ATOM 24521 H2 SOL 3139 39.400 31.810 84.540 1.00 0.00 ATOM 24522 OH2 SOL 3140 46.710 49.390 75.830 1.00 0.00 ATOM 24523 H1 SOL 3140 46.170 48.600 75.790 1.00 0.00 ATOM 24524 H2 SOL 3140 47.260 49.350 75.050 1.00 0.00 ATOM 24525 OH2 SOL 3141 46.690 24.010 82.910 1.00 0.00 ATOM 24526 H1 SOL 3141 45.740 23.870 82.890 1.00 0.00 ATOM 24527 H2 SOL 3141 46.860 24.310 83.800 1.00 0.00 ATOM 24528 OH2 SOL 3142 40.280 14.650 75.890 1.00 0.00 ATOM 24529 H1 SOL 3142 40.980 15.290 75.770 1.00 0.00 ATOM 24530 H2 SOL 3142 39.470 15.160 75.790 1.00 0.00 ATOM 24531 OH2 SOL 3143 14.420 8.490 73.570 1.00 0.00 ATOM 24532 H1 SOL 3143 15.020 9.120 73.170 1.00 0.00 ATOM 24533 H2 SOL 3143 13.780 8.300 72.890 1.00 0.00 ATOM 24534 OH2 SOL 3144 14.550 49.570 76.180 1.00 0.00 ATOM 24535 H1 SOL 3144 15.320 50.130 76.160 1.00 0.00 ATOM 24536 H2 SOL 3144 13.920 50.050 76.730 1.00 0.00 ATOM 24537 OH2 SOL 3145 28.100 57.940 74.910 1.00 0.00 ATOM 24538 H1 SOL 3145 28.460 57.110 75.220 1.00 0.00 ATOM 24539 H2 SOL 3145 27.300 58.060 75.430 1.00 0.00 ATOM 24540 OH2 SOL 3146 23.110 4.550 67.810 1.00 0.00 ATOM 24541 H1 SOL 3146 22.920 4.220 68.690 1.00 0.00 ATOM 24542 H2 SOL 3146 23.350 3.770 67.310 1.00 0.00 ATOM 24543 OH2 SOL 3147 47.720 29.110 6.500 1.00 0.00 ATOM 24544 H1 SOL 3147 47.890 29.460 7.380 1.00 0.00 ATOM 24545 H2 SOL 3147 48.590 28.980 6.120 1.00 0.00 ATOM 24546 OH2 SOL 3148 40.810 54.770 21.180 1.00 0.00 ATOM 24547 H1 SOL 3148 39.930 54.670 21.550 1.00 0.00 ATOM 24548 H2 SOL 3148 41.050 53.890 20.900 1.00 0.00 ATOM 24549 OH2 SOL 3149 58.570 0.790 18.730 1.00 0.00 ATOM 24550 H1 SOL 3149 57.840 0.220 18.470 1.00 0.00 ATOM 24551 H2 SOL 3149 59.240 0.180 19.030 1.00 0.00 ATOM 24552 OH2 SOL 3150 1.410 11.190 64.090 1.00 0.00 ATOM 24553 H1 SOL 3150 2.240 11.660 64.050 1.00 0.00 ATOM 24554 H2 SOL 3150 1.650 10.310 64.390 1.00 0.00 ATOM 24555 OH2 SOL 3151 28.650 54.870 3.860 1.00 0.00 ATOM 24556 H1 SOL 3151 28.390 55.680 3.410 1.00 0.00 ATOM 24557 H2 SOL 3151 29.510 55.060 4.220 1.00 0.00 ATOM 24558 OH2 SOL 3152 49.350 47.830 67.500 1.00 0.00 ATOM 24559 H1 SOL 3152 48.920 48.570 67.080 1.00 0.00 ATOM 24560 H2 SOL 3152 48.980 47.800 68.380 1.00 0.00 ATOM 24561 OH2 SOL 3153 22.420 39.840 79.220 1.00 0.00 ATOM 24562 H1 SOL 3153 22.970 39.240 79.720 1.00 0.00 ATOM 24563 H2 SOL 3153 21.530 39.520 79.350 1.00 0.00 ATOM 24564 OH2 SOL 3154 35.790 17.910 72.950 1.00 0.00 ATOM 24565 H1 SOL 3154 35.210 18.650 72.820 1.00 0.00 ATOM 24566 H2 SOL 3154 35.850 17.810 73.900 1.00 0.00 ATOM 24567 OH2 SOL 3155 49.650 39.560 20.680 1.00 0.00 ATOM 24568 H1 SOL 3155 49.090 40.320 20.500 1.00 0.00 ATOM 24569 H2 SOL 3155 49.050 38.820 20.700 1.00 0.00 ATOM 24570 OH2 SOL 3156 3.520 19.860 69.400 1.00 0.00 ATOM 24571 H1 SOL 3156 3.810 19.280 70.100 1.00 0.00 ATOM 24572 H2 SOL 3156 3.180 19.280 68.720 1.00 0.00 ATOM 24573 OH2 SOL 3157 12.630 53.660 13.330 1.00 0.00 ATOM 24574 H1 SOL 3157 11.830 53.410 13.790 1.00 0.00 ATOM 24575 H2 SOL 3157 12.620 53.130 12.530 1.00 0.00 ATOM 24576 OH2 SOL 3158 2.690 60.130 7.300 1.00 0.00 ATOM 24577 H1 SOL 3158 2.500 60.900 7.850 1.00 0.00 ATOM 24578 H2 SOL 3158 3.300 59.610 7.830 1.00 0.00 ATOM 24579 OH2 SOL 3159 41.710 43.670 67.510 1.00 0.00 ATOM 24580 H1 SOL 3159 40.810 43.970 67.670 1.00 0.00 ATOM 24581 H2 SOL 3159 42.120 43.690 68.370 1.00 0.00 ATOM 24582 OH2 SOL 3160 26.730 39.040 1.080 1.00 0.00 ATOM 24583 H1 SOL 3160 26.700 38.320 1.700 1.00 0.00 ATOM 24584 H2 SOL 3160 27.150 39.760 1.560 1.00 0.00 ATOM 24585 OH2 SOL 3161 9.020 39.550 3.550 1.00 0.00 ATOM 24586 H1 SOL 3161 8.090 39.490 3.360 1.00 0.00 ATOM 24587 H2 SOL 3161 9.130 39.080 4.380 1.00 0.00 ATOM 24588 OH2 SOL 3162 24.100 12.400 81.240 1.00 0.00 ATOM 24589 H1 SOL 3162 23.630 11.570 81.310 1.00 0.00 ATOM 24590 H2 SOL 3162 24.480 12.540 82.110 1.00 0.00 ATOM 24591 OH2 SOL 3163 24.540 21.000 8.190 1.00 0.00 ATOM 24592 H1 SOL 3163 25.360 20.520 8.100 1.00 0.00 ATOM 24593 H2 SOL 3163 23.920 20.520 7.650 1.00 0.00 ATOM 24594 OH2 SOL 3164 28.120 46.370 12.120 1.00 0.00 ATOM 24595 H1 SOL 3164 27.510 46.200 12.830 1.00 0.00 ATOM 24596 H2 SOL 3164 27.650 46.980 11.540 1.00 0.00 ATOM 24597 OH2 SOL 3165 57.450 34.570 67.520 1.00 0.00 ATOM 24598 H1 SOL 3165 57.390 33.930 68.220 1.00 0.00 ATOM 24599 H2 SOL 3165 57.340 34.060 66.720 1.00 0.00 ATOM 24600 OH2 SOL 3166 20.500 50.460 18.010 1.00 0.00 ATOM 24601 H1 SOL 3166 21.380 50.550 17.650 1.00 0.00 ATOM 24602 H2 SOL 3166 20.570 50.780 18.910 1.00 0.00 ATOM 24603 OH2 SOL 3167 29.630 15.560 72.970 1.00 0.00 ATOM 24604 H1 SOL 3167 29.500 14.790 72.420 1.00 0.00 ATOM 24605 H2 SOL 3167 30.560 15.780 72.860 1.00 0.00 ATOM 24606 OH2 SOL 3168 3.420 15.780 8.780 1.00 0.00 ATOM 24607 H1 SOL 3168 2.820 16.340 8.290 1.00 0.00 ATOM 24608 H2 SOL 3168 4.110 15.570 8.150 1.00 0.00 ATOM 24609 OH2 SOL 3169 17.980 20.260 8.270 1.00 0.00 ATOM 24610 H1 SOL 3169 18.480 20.960 7.850 1.00 0.00 ATOM 24611 H2 SOL 3169 18.020 20.460 9.200 1.00 0.00 ATOM 24612 OH2 SOL 3170 16.090 4.460 73.550 1.00 0.00 ATOM 24613 H1 SOL 3170 16.120 3.710 74.140 1.00 0.00 ATOM 24614 H2 SOL 3170 15.340 4.980 73.870 1.00 0.00 ATOM 24615 OH2 SOL 3171 4.030 44.190 83.750 1.00 0.00 ATOM 24616 H1 SOL 3171 4.140 43.240 83.830 1.00 0.00 ATOM 24617 H2 SOL 3171 4.780 44.570 84.200 1.00 0.00 ATOM 24618 OH2 SOL 3172 29.080 26.260 16.590 1.00 0.00 ATOM 24619 H1 SOL 3172 28.420 26.640 16.000 1.00 0.00 ATOM 24620 H2 SOL 3172 29.550 25.630 16.040 1.00 0.00 ATOM 24621 OH2 SOL 3173 27.290 12.390 7.380 1.00 0.00 ATOM 24622 H1 SOL 3173 26.450 12.350 6.920 1.00 0.00 ATOM 24623 H2 SOL 3173 27.080 12.150 8.280 1.00 0.00 ATOM 24624 OH2 SOL 3174 38.830 52.770 79.610 1.00 0.00 ATOM 24625 H1 SOL 3174 38.820 53.110 80.510 1.00 0.00 ATOM 24626 H2 SOL 3174 39.390 52.000 79.650 1.00 0.00 ATOM 24627 OH2 SOL 3175 41.690 45.670 9.800 1.00 0.00 ATOM 24628 H1 SOL 3175 42.340 45.210 10.340 1.00 0.00 ATOM 24629 H2 SOL 3175 41.690 45.200 8.970 1.00 0.00 ATOM 24630 OH2 SOL 3176 50.170 35.620 8.860 1.00 0.00 ATOM 24631 H1 SOL 3176 50.570 35.860 8.030 1.00 0.00 ATOM 24632 H2 SOL 3176 50.630 34.830 9.130 1.00 0.00 ATOM 24633 OH2 SOL 3177 45.300 40.280 74.710 1.00 0.00 ATOM 24634 H1 SOL 3177 45.700 41.130 74.860 1.00 0.00 ATOM 24635 H2 SOL 3177 45.660 39.720 75.400 1.00 0.00 ATOM 24636 OH2 SOL 3178 40.510 9.480 72.130 1.00 0.00 ATOM 24637 H1 SOL 3178 41.320 9.590 71.640 1.00 0.00 ATOM 24638 H2 SOL 3178 40.780 9.500 73.050 1.00 0.00 ATOM 24639 OH2 SOL 3179 30.410 36.930 8.120 1.00 0.00 ATOM 24640 H1 SOL 3179 30.030 37.030 8.990 1.00 0.00 ATOM 24641 H2 SOL 3179 31.320 36.690 8.280 1.00 0.00 ATOM 24642 OH2 SOL 3180 15.900 49.030 18.980 1.00 0.00 ATOM 24643 H1 SOL 3180 16.610 48.400 19.130 1.00 0.00 ATOM 24644 H2 SOL 3180 15.680 48.940 18.060 1.00 0.00 ATOM 24645 OH2 SOL 3181 7.910 14.680 11.290 1.00 0.00 ATOM 24646 H1 SOL 3181 6.960 14.580 11.240 1.00 0.00 ATOM 24647 H2 SOL 3181 8.240 14.360 10.450 1.00 0.00 ATOM 24648 OH2 SOL 3182 10.250 50.920 78.270 1.00 0.00 ATOM 24649 H1 SOL 3182 10.330 50.360 77.500 1.00 0.00 ATOM 24650 H2 SOL 3182 9.440 51.410 78.130 1.00 0.00 ATOM 24651 OH2 SOL 3183 30.170 43.830 12.320 1.00 0.00 ATOM 24652 H1 SOL 3183 29.640 44.580 12.570 1.00 0.00 ATOM 24653 H2 SOL 3183 31.010 44.200 12.040 1.00 0.00 ATOM 24654 OH2 SOL 3184 14.370 8.470 70.580 1.00 0.00 ATOM 24655 H1 SOL 3184 15.300 8.650 70.420 1.00 0.00 ATOM 24656 H2 SOL 3184 14.050 8.100 69.750 1.00 0.00 ATOM 24657 OH2 SOL 3185 10.940 12.140 12.010 1.00 0.00 ATOM 24658 H1 SOL 3185 11.580 11.650 11.510 1.00 0.00 ATOM 24659 H2 SOL 3185 11.220 12.050 12.920 1.00 0.00 ATOM 24660 OH2 SOL 3186 14.010 53.070 70.800 1.00 0.00 ATOM 24661 H1 SOL 3186 14.180 52.960 69.870 1.00 0.00 ATOM 24662 H2 SOL 3186 13.600 53.930 70.870 1.00 0.00 ATOM 24663 OH2 SOL 3187 34.150 44.590 20.250 1.00 0.00 ATOM 24664 H1 SOL 3187 34.210 44.490 21.200 1.00 0.00 ATOM 24665 H2 SOL 3187 33.640 43.840 19.950 1.00 0.00 ATOM 24666 OH2 SOL 3188 48.110 30.340 13.950 1.00 0.00 ATOM 24667 H1 SOL 3188 48.870 30.920 14.030 1.00 0.00 ATOM 24668 H2 SOL 3188 47.380 30.890 14.240 1.00 0.00 ATOM 24669 OH2 SOL 3189 1.890 14.740 61.260 1.00 0.00 ATOM 24670 H1 SOL 3189 2.440 15.520 61.350 1.00 0.00 ATOM 24671 H2 SOL 3189 1.070 14.980 61.690 1.00 0.00 ATOM 24672 OH2 SOL 3190 46.560 48.270 20.110 1.00 0.00 ATOM 24673 H1 SOL 3190 46.680 47.370 20.400 1.00 0.00 ATOM 24674 H2 SOL 3190 45.890 48.630 20.680 1.00 0.00 ATOM 24675 OH2 SOL 3191 1.720 5.320 67.630 1.00 0.00 ATOM 24676 H1 SOL 3191 1.900 5.990 68.290 1.00 0.00 ATOM 24677 H2 SOL 3191 1.220 5.780 66.960 1.00 0.00 ATOM 24678 OH2 SOL 3192 35.800 42.140 78.220 1.00 0.00 ATOM 24679 H1 SOL 3192 36.560 41.910 78.760 1.00 0.00 ATOM 24680 H2 SOL 3192 35.750 41.450 77.560 1.00 0.00 ATOM 24681 OH2 SOL 3193 0.610 59.290 19.280 1.00 0.00 ATOM 24682 H1 SOL 3193 1.250 58.690 18.900 1.00 0.00 ATOM 24683 H2 SOL 3193 0.210 58.790 19.990 1.00 0.00 ATOM 24684 OH2 SOL 3194 38.860 31.500 17.180 1.00 0.00 ATOM 24685 H1 SOL 3194 39.680 31.130 16.880 1.00 0.00 ATOM 24686 H2 SOL 3194 38.960 31.590 18.130 1.00 0.00 ATOM 24687 OH2 SOL 3195 8.870 50.510 8.820 1.00 0.00 ATOM 24688 H1 SOL 3195 8.510 51.150 8.200 1.00 0.00 ATOM 24689 H2 SOL 3195 8.170 49.870 8.940 1.00 0.00 ATOM 24690 OH2 SOL 3196 5.460 35.720 20.830 1.00 0.00 ATOM 24691 H1 SOL 3196 5.140 36.450 21.360 1.00 0.00 ATOM 24692 H2 SOL 3196 5.850 35.120 21.460 1.00 0.00 ATOM 24693 OH2 SOL 3197 29.580 53.660 74.360 1.00 0.00 ATOM 24694 H1 SOL 3197 28.810 53.980 74.840 1.00 0.00 ATOM 24695 H2 SOL 3197 30.070 53.140 75.000 1.00 0.00 ATOM 24696 OH2 SOL 3198 58.550 5.010 2.370 1.00 0.00 ATOM 24697 H1 SOL 3198 59.220 5.150 3.040 1.00 0.00 ATOM 24698 H2 SOL 3198 58.460 4.050 2.320 1.00 0.00 ATOM 24699 OH2 SOL 3199 34.470 50.190 10.890 1.00 0.00 ATOM 24700 H1 SOL 3199 34.610 50.380 11.820 1.00 0.00 ATOM 24701 H2 SOL 3199 34.110 49.300 10.890 1.00 0.00 ATOM 24702 OH2 SOL 3200 45.900 3.990 64.590 1.00 0.00 ATOM 24703 H1 SOL 3200 46.280 3.140 64.370 1.00 0.00 ATOM 24704 H2 SOL 3200 44.990 3.940 64.280 1.00 0.00 ATOM 24705 OH2 SOL 3201 38.680 40.750 68.030 1.00 0.00 ATOM 24706 H1 SOL 3201 39.110 41.260 68.720 1.00 0.00 ATOM 24707 H2 SOL 3201 37.770 40.660 68.320 1.00 0.00 ATOM 24708 OH2 SOL 3202 29.180 26.050 9.960 1.00 0.00 ATOM 24709 H1 SOL 3202 30.060 26.410 9.880 1.00 0.00 ATOM 24710 H2 SOL 3202 29.310 25.110 10.060 1.00 0.00 ATOM 24711 OH2 SOL 3203 13.170 0.610 66.670 1.00 0.00 ATOM 24712 H1 SOL 3203 13.850 1.230 66.930 1.00 0.00 ATOM 24713 H2 SOL 3203 12.600 1.110 66.080 1.00 0.00 ATOM 24714 OH2 SOL 3204 1.360 16.580 10.660 1.00 0.00 ATOM 24715 H1 SOL 3204 1.420 15.750 11.120 1.00 0.00 ATOM 24716 H2 SOL 3204 2.180 16.640 10.160 1.00 0.00 ATOM 24717 OH2 SOL 3205 26.030 41.820 70.200 1.00 0.00 ATOM 24718 H1 SOL 3205 25.550 41.080 69.840 1.00 0.00 ATOM 24719 H2 SOL 3205 26.950 41.550 70.160 1.00 0.00 ATOM 24720 OH2 SOL 3206 43.650 31.120 83.140 1.00 0.00 ATOM 24721 H1 SOL 3206 43.960 30.220 83.040 1.00 0.00 ATOM 24722 H2 SOL 3206 44.130 31.610 82.470 1.00 0.00 ATOM 24723 OH2 SOL 3207 14.000 42.390 79.190 1.00 0.00 ATOM 24724 H1 SOL 3207 14.930 42.620 79.190 1.00 0.00 ATOM 24725 H2 SOL 3207 13.640 42.820 78.420 1.00 0.00 ATOM 24726 OH2 SOL 3208 54.880 12.650 68.730 1.00 0.00 ATOM 24727 H1 SOL 3208 55.810 12.860 68.790 1.00 0.00 ATOM 24728 H2 SOL 3208 54.580 13.110 67.940 1.00 0.00 ATOM 24729 OH2 SOL 3209 27.060 55.530 23.180 1.00 0.00 ATOM 24730 H1 SOL 3209 27.460 54.690 23.420 1.00 0.00 ATOM 24731 H2 SOL 3209 26.120 55.360 23.170 1.00 0.00 ATOM 24732 OH2 SOL 3210 57.070 2.920 17.880 1.00 0.00 ATOM 24733 H1 SOL 3210 57.600 2.390 18.470 1.00 0.00 ATOM 24734 H2 SOL 3210 57.640 3.080 17.120 1.00 0.00 ATOM 24735 OH2 SOL 3211 55.870 58.970 73.760 1.00 0.00 ATOM 24736 H1 SOL 3211 56.800 59.060 73.950 1.00 0.00 ATOM 24737 H2 SOL 3211 55.430 59.130 74.590 1.00 0.00 ATOM 24738 OH2 SOL 3212 34.720 27.570 7.380 1.00 0.00 ATOM 24739 H1 SOL 3212 34.680 28.190 6.650 1.00 0.00 ATOM 24740 H2 SOL 3212 35.260 26.850 7.050 1.00 0.00 ATOM 24741 OH2 SOL 3213 20.540 13.200 16.700 1.00 0.00 ATOM 24742 H1 SOL 3213 20.860 13.970 17.170 1.00 0.00 ATOM 24743 H2 SOL 3213 19.590 13.310 16.690 1.00 0.00 ATOM 24744 OH2 SOL 3214 31.480 12.950 75.090 1.00 0.00 ATOM 24745 H1 SOL 3214 31.970 13.680 75.460 1.00 0.00 ATOM 24746 H2 SOL 3214 30.980 12.600 75.830 1.00 0.00 ATOM 24747 OH2 SOL 3215 46.470 17.930 70.330 1.00 0.00 ATOM 24748 H1 SOL 3215 46.560 17.310 69.610 1.00 0.00 ATOM 24749 H2 SOL 3215 45.540 17.920 70.550 1.00 0.00 ATOM 24750 OH2 SOL 3216 18.530 25.420 78.070 1.00 0.00 ATOM 24751 H1 SOL 3216 17.810 25.910 77.670 1.00 0.00 ATOM 24752 H2 SOL 3216 18.200 24.520 78.140 1.00 0.00 ATOM 24753 OH2 SOL 3217 27.400 3.030 0.610 1.00 0.00 ATOM 24754 H1 SOL 3217 26.880 2.290 0.270 1.00 0.00 ATOM 24755 H2 SOL 3217 27.800 3.420 -0.160 1.00 0.00 ATOM 24756 OH2 SOL 3218 12.060 33.560 10.670 1.00 0.00 ATOM 24757 H1 SOL 3218 11.440 34.190 10.290 1.00 0.00 ATOM 24758 H2 SOL 3218 11.520 33.010 11.230 1.00 0.00 ATOM 24759 OH2 SOL 3219 51.360 6.670 15.060 1.00 0.00 ATOM 24760 H1 SOL 3219 50.440 6.920 15.000 1.00 0.00 ATOM 24761 H2 SOL 3219 51.840 7.440 14.760 1.00 0.00 ATOM 24762 OH2 SOL 3220 46.340 37.730 66.560 1.00 0.00 ATOM 24763 H1 SOL 3220 45.570 38.010 66.080 1.00 0.00 ATOM 24764 H2 SOL 3220 46.890 37.290 65.910 1.00 0.00 ATOM 24765 OH2 SOL 3221 40.620 7.290 61.710 1.00 0.00 ATOM 24766 H1 SOL 3221 40.330 6.560 62.260 1.00 0.00 ATOM 24767 H2 SOL 3221 41.490 7.520 62.050 1.00 0.00 ATOM 24768 OH2 SOL 3222 51.190 40.600 3.590 1.00 0.00 ATOM 24769 H1 SOL 3222 50.930 41.470 3.880 1.00 0.00 ATOM 24770 H2 SOL 3222 51.100 40.050 4.370 1.00 0.00 ATOM 24771 OH2 SOL 3223 48.830 41.380 73.520 1.00 0.00 ATOM 24772 H1 SOL 3223 49.610 41.830 73.200 1.00 0.00 ATOM 24773 H2 SOL 3223 49.060 41.110 74.410 1.00 0.00 ATOM 24774 OH2 SOL 3224 18.980 20.870 19.140 1.00 0.00 ATOM 24775 H1 SOL 3224 18.740 20.480 18.310 1.00 0.00 ATOM 24776 H2 SOL 3224 19.940 20.920 19.120 1.00 0.00 ATOM 24777 OH2 SOL 3225 21.530 44.910 21.810 1.00 0.00 ATOM 24778 H1 SOL 3225 20.650 45.280 21.830 1.00 0.00 ATOM 24779 H2 SOL 3225 21.760 44.790 22.740 1.00 0.00 ATOM 24780 OH2 SOL 3226 44.220 21.430 0.820 1.00 0.00 ATOM 24781 H1 SOL 3226 43.660 20.830 1.300 1.00 0.00 ATOM 24782 H2 SOL 3226 43.660 21.800 0.140 1.00 0.00 ATOM 24783 OH2 SOL 3227 45.300 19.720 14.970 1.00 0.00 ATOM 24784 H1 SOL 3227 45.830 19.110 14.450 1.00 0.00 ATOM 24785 H2 SOL 3227 44.490 19.240 15.150 1.00 0.00 ATOM 24786 OH2 SOL 3228 28.260 20.680 83.100 1.00 0.00 ATOM 24787 H1 SOL 3228 27.800 19.990 82.620 1.00 0.00 ATOM 24788 H2 SOL 3228 28.620 20.240 83.870 1.00 0.00 ATOM 24789 OH2 SOL 3229 41.680 45.560 84.000 1.00 0.00 ATOM 24790 H1 SOL 3229 41.740 46.450 84.350 1.00 0.00 ATOM 24791 H2 SOL 3229 41.980 45.000 84.710 1.00 0.00 ATOM 24792 OH2 SOL 3230 28.940 41.110 69.980 1.00 0.00 ATOM 24793 H1 SOL 3230 29.460 41.910 69.920 1.00 0.00 ATOM 24794 H2 SOL 3230 29.110 40.650 69.160 1.00 0.00 ATOM 24795 OH2 SOL 3231 53.860 16.540 17.510 1.00 0.00 ATOM 24796 H1 SOL 3231 54.350 17.070 18.130 1.00 0.00 ATOM 24797 H2 SOL 3231 53.000 16.940 17.470 1.00 0.00 ATOM 24798 OH2 SOL 3232 39.090 4.270 69.580 1.00 0.00 ATOM 24799 H1 SOL 3232 39.590 4.340 68.770 1.00 0.00 ATOM 24800 H2 SOL 3232 38.330 3.730 69.360 1.00 0.00 ATOM 24801 OH2 SOL 3233 4.780 34.960 1.850 1.00 0.00 ATOM 24802 H1 SOL 3233 4.260 35.740 2.020 1.00 0.00 ATOM 24803 H2 SOL 3233 4.530 34.350 2.550 1.00 0.00 ATOM 24804 OH2 SOL 3234 57.330 39.280 2.020 1.00 0.00 ATOM 24805 H1 SOL 3234 56.820 40.080 2.080 1.00 0.00 ATOM 24806 H2 SOL 3234 57.920 39.310 2.780 1.00 0.00 ATOM 24807 OH2 SOL 3235 37.780 17.930 4.550 1.00 0.00 ATOM 24808 H1 SOL 3235 37.040 18.100 3.970 1.00 0.00 ATOM 24809 H2 SOL 3235 37.490 18.260 5.400 1.00 0.00 ATOM 24810 OH2 SOL 3236 18.210 2.400 78.920 1.00 0.00 ATOM 24811 H1 SOL 3236 17.800 3.230 79.150 1.00 0.00 ATOM 24812 H2 SOL 3236 17.930 2.220 78.030 1.00 0.00 ATOM 24813 OH2 SOL 3237 17.450 34.410 24.110 1.00 0.00 ATOM 24814 H1 SOL 3237 17.510 33.720 24.770 1.00 0.00 ATOM 24815 H2 SOL 3237 17.810 34.020 23.310 1.00 0.00 ATOM 24816 OH2 SOL 3238 44.690 43.160 7.210 1.00 0.00 ATOM 24817 H1 SOL 3238 45.370 43.830 7.070 1.00 0.00 ATOM 24818 H2 SOL 3238 45.020 42.380 6.770 1.00 0.00 ATOM 24819 OH2 SOL 3239 30.010 12.960 84.070 1.00 0.00 ATOM 24820 H1 SOL 3239 29.560 12.280 84.570 1.00 0.00 ATOM 24821 H2 SOL 3239 30.940 12.740 84.150 1.00 0.00 ATOM 24822 OH2 SOL 3240 59.650 42.050 13.090 1.00 0.00 ATOM 24823 H1 SOL 3240 59.750 41.520 13.880 1.00 0.00 ATOM 24824 H2 SOL 3240 58.830 41.750 12.700 1.00 0.00 ATOM 24825 OH2 SOL 3241 40.290 16.920 81.230 1.00 0.00 ATOM 24826 H1 SOL 3241 40.090 16.940 82.160 1.00 0.00 ATOM 24827 H2 SOL 3241 39.810 17.670 80.870 1.00 0.00 ATOM 24828 OH2 SOL 3242 35.190 39.620 6.530 1.00 0.00 ATOM 24829 H1 SOL 3242 35.460 39.480 5.620 1.00 0.00 ATOM 24830 H2 SOL 3242 35.930 39.330 7.050 1.00 0.00 ATOM 24831 OH2 SOL 3243 56.390 1.870 75.900 1.00 0.00 ATOM 24832 H1 SOL 3243 56.170 2.720 76.280 1.00 0.00 ATOM 24833 H2 SOL 3243 55.590 1.590 75.450 1.00 0.00 ATOM 24834 OH2 SOL 3244 1.590 17.080 28.090 1.00 0.00 ATOM 24835 H1 SOL 3244 2.290 16.520 28.440 1.00 0.00 ATOM 24836 H2 SOL 3244 1.440 16.740 27.210 1.00 0.00 ATOM 24837 OH2 SOL 3245 59.300 44.570 4.820 1.00 0.00 ATOM 24838 H1 SOL 3245 59.480 44.140 3.980 1.00 0.00 ATOM 24839 H2 SOL 3245 59.630 45.460 4.700 1.00 0.00 ATOM 24840 OH2 SOL 3246 21.510 6.880 65.860 1.00 0.00 ATOM 24841 H1 SOL 3246 20.990 6.810 66.660 1.00 0.00 ATOM 24842 H2 SOL 3246 20.960 6.490 65.180 1.00 0.00 ATOM 24843 OH2 SOL 3247 46.540 25.550 64.890 1.00 0.00 ATOM 24844 H1 SOL 3247 47.310 26.080 64.680 1.00 0.00 ATOM 24845 H2 SOL 3247 46.460 25.610 65.840 1.00 0.00 ATOM 24846 OH2 SOL 3248 47.220 22.610 67.280 1.00 0.00 ATOM 24847 H1 SOL 3248 47.320 23.500 67.600 1.00 0.00 ATOM 24848 H2 SOL 3248 48.040 22.420 66.820 1.00 0.00 ATOM 24849 OH2 SOL 3249 14.200 32.320 72.000 1.00 0.00 ATOM 24850 H1 SOL 3249 13.890 31.870 71.210 1.00 0.00 ATOM 24851 H2 SOL 3249 13.640 32.000 72.700 1.00 0.00 ATOM 24852 OH2 SOL 3250 58.010 34.220 10.730 1.00 0.00 ATOM 24853 H1 SOL 3250 57.320 33.850 11.300 1.00 0.00 ATOM 24854 H2 SOL 3250 57.600 34.290 9.870 1.00 0.00 ATOM 24855 OH2 SOL 3251 51.860 52.720 12.840 1.00 0.00 ATOM 24856 H1 SOL 3251 51.500 53.600 12.920 1.00 0.00 ATOM 24857 H2 SOL 3251 52.750 52.790 13.170 1.00 0.00 ATOM 24858 OH2 SOL 3252 8.460 17.860 71.120 1.00 0.00 ATOM 24859 H1 SOL 3252 9.190 18.050 70.530 1.00 0.00 ATOM 24860 H2 SOL 3252 8.880 17.490 71.900 1.00 0.00 ATOM 24861 OH2 SOL 3253 35.240 23.220 2.090 1.00 0.00 ATOM 24862 H1 SOL 3253 35.510 23.260 1.180 1.00 0.00 ATOM 24863 H2 SOL 3253 34.290 23.130 2.060 1.00 0.00 ATOM 24864 OH2 SOL 3254 21.440 15.640 13.570 1.00 0.00 ATOM 24865 H1 SOL 3254 22.160 16.200 13.290 1.00 0.00 ATOM 24866 H2 SOL 3254 21.870 14.920 14.030 1.00 0.00 ATOM 24867 OH2 SOL 3255 26.550 9.700 78.420 1.00 0.00 ATOM 24868 H1 SOL 3255 26.500 9.440 77.500 1.00 0.00 ATOM 24869 H2 SOL 3255 27.370 9.320 78.730 1.00 0.00 ATOM 24870 OH2 SOL 3256 0.080 6.410 8.950 1.00 0.00 ATOM 24871 H1 SOL 3256 0.950 6.210 9.280 1.00 0.00 ATOM 24872 H2 SOL 3256 -0.100 7.300 9.260 1.00 0.00 ATOM 24873 OH2 SOL 3257 19.130 28.610 5.040 1.00 0.00 ATOM 24874 H1 SOL 3257 19.390 29.120 4.270 1.00 0.00 ATOM 24875 H2 SOL 3257 19.400 27.710 4.820 1.00 0.00 ATOM 24876 OH2 SOL 3258 47.060 44.580 8.740 1.00 0.00 ATOM 24877 H1 SOL 3258 47.980 44.850 8.700 1.00 0.00 ATOM 24878 H2 SOL 3258 46.970 43.930 8.050 1.00 0.00 ATOM 24879 OH2 SOL 3259 5.220 44.590 15.590 1.00 0.00 ATOM 24880 H1 SOL 3259 5.600 43.740 15.340 1.00 0.00 ATOM 24881 H2 SOL 3259 5.510 44.730 16.490 1.00 0.00 ATOM 24882 OH2 SOL 3260 27.020 18.990 74.400 1.00 0.00 ATOM 24883 H1 SOL 3260 26.780 19.780 74.880 1.00 0.00 ATOM 24884 H2 SOL 3260 26.340 18.360 74.630 1.00 0.00 ATOM 24885 OH2 SOL 3261 57.470 50.920 9.860 1.00 0.00 ATOM 24886 H1 SOL 3261 58.260 50.890 10.400 1.00 0.00 ATOM 24887 H2 SOL 3261 57.160 50.010 9.850 1.00 0.00 ATOM 24888 OH2 SOL 3262 11.420 27.880 73.110 1.00 0.00 ATOM 24889 H1 SOL 3262 10.640 28.370 72.840 1.00 0.00 ATOM 24890 H2 SOL 3262 11.180 27.490 73.950 1.00 0.00 ATOM 24891 OH2 SOL 3263 28.580 39.710 72.270 1.00 0.00 ATOM 24892 H1 SOL 3263 28.580 38.760 72.350 1.00 0.00 ATOM 24893 H2 SOL 3263 28.620 39.870 71.330 1.00 0.00 ATOM 24894 OH2 SOL 3264 20.570 5.730 70.700 1.00 0.00 ATOM 24895 H1 SOL 3264 20.900 4.830 70.760 1.00 0.00 ATOM 24896 H2 SOL 3264 20.210 5.910 71.570 1.00 0.00 ATOM 24897 OH2 SOL 3265 15.960 10.930 21.050 1.00 0.00 ATOM 24898 H1 SOL 3265 15.570 11.760 21.340 1.00 0.00 ATOM 24899 H2 SOL 3265 16.710 10.800 21.640 1.00 0.00 ATOM 24900 OH2 SOL 3266 33.130 2.680 5.100 1.00 0.00 ATOM 24901 H1 SOL 3266 32.710 3.540 5.020 1.00 0.00 ATOM 24902 H2 SOL 3266 34.020 2.830 4.790 1.00 0.00 ATOM 24903 OH2 SOL 3267 44.470 29.210 2.420 1.00 0.00 ATOM 24904 H1 SOL 3267 45.280 29.620 2.120 1.00 0.00 ATOM 24905 H2 SOL 3267 43.780 29.810 2.110 1.00 0.00 ATOM 24906 OH2 SOL 3268 18.030 8.360 17.660 1.00 0.00 ATOM 24907 H1 SOL 3268 18.530 7.610 17.330 1.00 0.00 ATOM 24908 H2 SOL 3268 17.850 8.890 16.890 1.00 0.00 ATOM 24909 OH2 SOL 3269 22.940 20.000 6.510 1.00 0.00 ATOM 24910 H1 SOL 3269 23.180 19.660 5.650 1.00 0.00 ATOM 24911 H2 SOL 3269 22.020 19.760 6.630 1.00 0.00 ATOM 24912 OH2 SOL 3270 27.090 7.520 15.360 1.00 0.00 ATOM 24913 H1 SOL 3270 27.110 6.670 15.820 1.00 0.00 ATOM 24914 H2 SOL 3270 26.770 7.310 14.480 1.00 0.00 ATOM 24915 OH2 SOL 3271 9.200 14.760 70.140 1.00 0.00 ATOM 24916 H1 SOL 3271 8.510 15.380 69.920 1.00 0.00 ATOM 24917 H2 SOL 3271 9.770 15.250 70.750 1.00 0.00 ATOM 24918 OH2 SOL 3272 17.750 15.930 65.700 1.00 0.00 ATOM 24919 H1 SOL 3272 17.880 16.170 64.790 1.00 0.00 ATOM 24920 H2 SOL 3272 17.360 15.060 65.670 1.00 0.00 ATOM 24921 OH2 SOL 3273 20.840 33.640 78.750 1.00 0.00 ATOM 24922 H1 SOL 3273 20.110 33.020 78.680 1.00 0.00 ATOM 24923 H2 SOL 3273 21.580 33.180 78.350 1.00 0.00 ATOM 24924 OH2 SOL 3274 57.850 12.820 69.170 1.00 0.00 ATOM 24925 H1 SOL 3274 58.040 12.530 70.070 1.00 0.00 ATOM 24926 H2 SOL 3274 58.230 12.130 68.620 1.00 0.00 ATOM 24927 OH2 SOL 3275 34.210 47.280 11.420 1.00 0.00 ATOM 24928 H1 SOL 3275 34.230 46.390 11.760 1.00 0.00 ATOM 24929 H2 SOL 3275 35.030 47.380 10.940 1.00 0.00 ATOM 24930 OH2 SOL 3276 21.950 25.880 73.510 1.00 0.00 ATOM 24931 H1 SOL 3276 21.140 26.140 73.950 1.00 0.00 ATOM 24932 H2 SOL 3276 21.840 26.200 72.610 1.00 0.00 ATOM 24933 OH2 SOL 3277 51.040 48.310 78.560 1.00 0.00 ATOM 24934 H1 SOL 3277 50.430 47.650 78.250 1.00 0.00 ATOM 24935 H2 SOL 3277 50.500 49.070 78.760 1.00 0.00 ATOM 24936 OH2 SOL 3278 34.450 27.840 70.400 1.00 0.00 ATOM 24937 H1 SOL 3278 33.510 27.790 70.570 1.00 0.00 ATOM 24938 H2 SOL 3278 34.540 28.600 69.810 1.00 0.00 ATOM 24939 OH2 SOL 3279 24.710 6.820 75.480 1.00 0.00 ATOM 24940 H1 SOL 3279 24.260 6.490 76.260 1.00 0.00 ATOM 24941 H2 SOL 3279 25.220 6.080 75.170 1.00 0.00 ATOM 24942 OH2 SOL 3280 10.870 40.010 74.020 1.00 0.00 ATOM 24943 H1 SOL 3280 10.570 40.920 74.070 1.00 0.00 ATOM 24944 H2 SOL 3280 10.230 39.580 73.450 1.00 0.00 ATOM 24945 OH2 SOL 3281 22.910 50.140 73.670 1.00 0.00 ATOM 24946 H1 SOL 3281 23.090 50.090 74.600 1.00 0.00 ATOM 24947 H2 SOL 3281 22.740 51.070 73.500 1.00 0.00 ATOM 24948 OH2 SOL 3282 41.970 21.470 73.770 1.00 0.00 ATOM 24949 H1 SOL 3282 42.430 21.620 72.940 1.00 0.00 ATOM 24950 H2 SOL 3282 42.410 22.060 74.380 1.00 0.00 ATOM 24951 OH2 SOL 3283 30.920 21.110 4.600 1.00 0.00 ATOM 24952 H1 SOL 3283 30.340 21.640 5.150 1.00 0.00 ATOM 24953 H2 SOL 3283 30.340 20.750 3.930 1.00 0.00 ATOM 24954 OH2 SOL 3284 55.010 49.560 5.790 1.00 0.00 ATOM 24955 H1 SOL 3284 54.420 50.210 6.170 1.00 0.00 ATOM 24956 H2 SOL 3284 55.870 49.980 5.780 1.00 0.00 ATOM 24957 OH2 SOL 3285 54.200 48.060 3.710 1.00 0.00 ATOM 24958 H1 SOL 3285 54.560 48.650 4.370 1.00 0.00 ATOM 24959 H2 SOL 3285 53.260 48.080 3.860 1.00 0.00 ATOM 24960 OH2 SOL 3286 47.830 59.060 81.870 1.00 0.00 ATOM 24961 H1 SOL 3286 47.490 59.010 80.980 1.00 0.00 ATOM 24962 H2 SOL 3286 47.950 60.000 82.030 1.00 0.00 ATOM 24963 OH2 SOL 3287 48.580 24.820 68.010 1.00 0.00 ATOM 24964 H1 SOL 3287 49.350 24.910 67.450 1.00 0.00 ATOM 24965 H2 SOL 3287 48.870 24.250 68.730 1.00 0.00 ATOM 24966 OH2 SOL 3288 52.930 12.050 16.410 1.00 0.00 ATOM 24967 H1 SOL 3288 52.820 12.700 15.710 1.00 0.00 ATOM 24968 H2 SOL 3288 52.090 12.030 16.860 1.00 0.00 ATOM 24969 OH2 SOL 3289 15.430 48.600 16.450 1.00 0.00 ATOM 24970 H1 SOL 3289 15.870 47.760 16.330 1.00 0.00 ATOM 24971 H2 SOL 3289 15.240 48.900 15.560 1.00 0.00 ATOM 24972 OH2 SOL 3290 40.880 59.020 2.630 1.00 0.00 ATOM 24973 H1 SOL 3290 41.610 59.600 2.870 1.00 0.00 ATOM 24974 H2 SOL 3290 40.940 58.950 1.680 1.00 0.00 ATOM 24975 OH2 SOL 3291 3.370 44.910 5.200 1.00 0.00 ATOM 24976 H1 SOL 3291 3.070 44.170 5.730 1.00 0.00 ATOM 24977 H2 SOL 3291 4.260 45.080 5.520 1.00 0.00 ATOM 24978 OH2 SOL 3292 25.530 24.860 17.950 1.00 0.00 ATOM 24979 H1 SOL 3292 26.100 25.020 17.190 1.00 0.00 ATOM 24980 H2 SOL 3292 26.110 24.930 18.700 1.00 0.00 ATOM 24981 OH2 SOL 3293 7.980 58.350 70.160 1.00 0.00 ATOM 24982 H1 SOL 3293 7.270 57.730 70.020 1.00 0.00 ATOM 24983 H2 SOL 3293 8.740 57.940 69.740 1.00 0.00 ATOM 24984 OH2 SOL 3294 36.060 46.520 2.660 1.00 0.00 ATOM 24985 H1 SOL 3294 36.650 46.410 1.910 1.00 0.00 ATOM 24986 H2 SOL 3294 35.190 46.630 2.270 1.00 0.00 ATOM 24987 OH2 SOL 3295 15.400 13.370 22.380 1.00 0.00 ATOM 24988 H1 SOL 3295 14.700 13.780 21.860 1.00 0.00 ATOM 24989 H2 SOL 3295 15.970 14.090 22.630 1.00 0.00 ATOM 24990 OH2 SOL 3296 18.240 24.290 19.470 1.00 0.00 ATOM 24991 H1 SOL 3296 17.930 25.020 20.000 1.00 0.00 ATOM 24992 H2 SOL 3296 18.360 23.570 20.090 1.00 0.00 ATOM 24993 OH2 SOL 3297 0.310 19.760 69.770 1.00 0.00 ATOM 24994 H1 SOL 3297 -0.120 20.220 69.040 1.00 0.00 ATOM 24995 H2 SOL 3297 1.210 19.640 69.480 1.00 0.00 ATOM 24996 OH2 SOL 3298 35.360 48.650 73.400 1.00 0.00 ATOM 24997 H1 SOL 3298 35.140 49.120 72.590 1.00 0.00 ATOM 24998 H2 SOL 3298 35.960 49.230 73.860 1.00 0.00 ATOM 24999 OH2 SOL 3299 49.630 3.240 81.160 1.00 0.00 ATOM 25000 H1 SOL 3299 50.190 3.990 81.370 1.00 0.00 ATOM 25001 H2 SOL 3299 50.160 2.470 81.370 1.00 0.00 ATOM 25002 OH2 SOL 3300 14.850 34.680 80.990 1.00 0.00 ATOM 25003 H1 SOL 3300 15.680 34.470 80.560 1.00 0.00 ATOM 25004 H2 SOL 3300 14.180 34.230 80.470 1.00 0.00 ATOM 25005 OH2 SOL 3301 24.140 21.320 63.730 1.00 0.00 ATOM 25006 H1 SOL 3301 23.670 22.070 63.370 1.00 0.00 ATOM 25007 H2 SOL 3301 24.770 21.700 64.350 1.00 0.00 ATOM 25008 OH2 SOL 3302 10.280 30.730 74.800 1.00 0.00 ATOM 25009 H1 SOL 3302 10.040 30.530 75.710 1.00 0.00 ATOM 25010 H2 SOL 3302 9.700 30.190 74.270 1.00 0.00 ATOM 25011 OH2 SOL 3303 59.610 53.370 17.340 1.00 0.00 ATOM 25012 H1 SOL 3303 60.020 53.550 18.190 1.00 0.00 ATOM 25013 H2 SOL 3303 59.130 52.550 17.480 1.00 0.00 ATOM 25014 OH2 SOL 3304 22.830 4.700 64.100 1.00 0.00 ATOM 25015 H1 SOL 3304 22.870 4.690 65.060 1.00 0.00 ATOM 25016 H2 SOL 3304 21.920 4.920 63.900 1.00 0.00 ATOM 25017 OH2 SOL 3305 56.980 18.530 8.210 1.00 0.00 ATOM 25018 H1 SOL 3305 56.890 19.460 8.040 1.00 0.00 ATOM 25019 H2 SOL 3305 57.390 18.470 9.070 1.00 0.00 ATOM 25020 OH2 SOL 3306 11.120 2.010 73.140 1.00 0.00 ATOM 25021 H1 SOL 3306 11.860 2.300 73.660 1.00 0.00 ATOM 25022 H2 SOL 3306 10.860 2.780 72.630 1.00 0.00 ATOM 25023 OH2 SOL 3307 1.950 19.120 11.500 1.00 0.00 ATOM 25024 H1 SOL 3307 1.290 18.440 11.340 1.00 0.00 ATOM 25025 H2 SOL 3307 2.110 19.510 10.640 1.00 0.00 ATOM 25026 OH2 SOL 3308 53.820 15.910 85.020 1.00 0.00 ATOM 25027 H1 SOL 3308 53.900 16.850 84.880 1.00 0.00 ATOM 25028 H2 SOL 3308 53.470 15.570 84.190 1.00 0.00 ATOM 25029 OH2 SOL 3309 13.850 49.190 83.920 1.00 0.00 ATOM 25030 H1 SOL 3309 14.790 49.140 84.110 1.00 0.00 ATOM 25031 H2 SOL 3309 13.690 50.130 83.790 1.00 0.00 ATOM 25032 OH2 SOL 3310 5.450 0.800 73.050 1.00 0.00 ATOM 25033 H1 SOL 3310 4.640 0.440 73.400 1.00 0.00 ATOM 25034 H2 SOL 3310 5.920 1.130 73.820 1.00 0.00 ATOM 25035 OH2 SOL 3311 54.950 0.390 12.380 1.00 0.00 ATOM 25036 H1 SOL 3311 54.680 -0.450 12.760 1.00 0.00 ATOM 25037 H2 SOL 3311 55.860 0.240 12.110 1.00 0.00 ATOM 25038 OH2 SOL 3312 24.210 50.320 19.170 1.00 0.00 ATOM 25039 H1 SOL 3312 24.280 51.090 19.720 1.00 0.00 ATOM 25040 H2 SOL 3312 23.860 50.640 18.340 1.00 0.00 ATOM 25041 OH2 SOL 3313 11.790 0.080 10.160 1.00 0.00 ATOM 25042 H1 SOL 3313 12.540 0.370 10.670 1.00 0.00 ATOM 25043 H2 SOL 3313 11.230 -0.370 10.790 1.00 0.00 ATOM 25044 OH2 SOL 3314 39.970 6.830 77.950 1.00 0.00 ATOM 25045 H1 SOL 3314 40.340 6.130 78.490 1.00 0.00 ATOM 25046 H2 SOL 3314 39.930 7.590 78.530 1.00 0.00 ATOM 25047 OH2 SOL 3315 49.890 32.050 9.730 1.00 0.00 ATOM 25048 H1 SOL 3315 49.300 31.310 9.860 1.00 0.00 ATOM 25049 H2 SOL 3315 49.370 32.810 9.990 1.00 0.00 ATOM 25050 OH2 SOL 3316 37.230 15.910 71.480 1.00 0.00 ATOM 25051 H1 SOL 3316 36.470 16.350 71.860 1.00 0.00 ATOM 25052 H2 SOL 3316 36.930 15.610 70.620 1.00 0.00 ATOM 25053 OH2 SOL 3317 38.960 48.440 81.680 1.00 0.00 ATOM 25054 H1 SOL 3317 39.250 47.610 81.300 1.00 0.00 ATOM 25055 H2 SOL 3317 38.040 48.500 81.440 1.00 0.00 ATOM 25056 OH2 SOL 3318 4.880 2.710 71.320 1.00 0.00 ATOM 25057 H1 SOL 3318 5.570 2.810 70.660 1.00 0.00 ATOM 25058 H2 SOL 3318 5.160 1.970 71.850 1.00 0.00 ATOM 25059 OH2 SOL 3319 55.280 43.200 10.370 1.00 0.00 ATOM 25060 H1 SOL 3319 56.110 43.330 9.910 1.00 0.00 ATOM 25061 H2 SOL 3319 54.850 44.050 10.320 1.00 0.00 ATOM 25062 OH2 SOL 3320 27.350 30.100 68.980 1.00 0.00 ATOM 25063 H1 SOL 3320 27.320 31.060 69.050 1.00 0.00 ATOM 25064 H2 SOL 3320 27.580 29.940 68.060 1.00 0.00 ATOM 25065 OH2 SOL 3321 56.020 55.950 19.620 1.00 0.00 ATOM 25066 H1 SOL 3321 55.320 56.280 20.170 1.00 0.00 ATOM 25067 H2 SOL 3321 55.610 55.290 19.060 1.00 0.00 ATOM 25068 OH2 SOL 3322 21.790 15.370 78.320 1.00 0.00 ATOM 25069 H1 SOL 3322 22.690 15.490 78.620 1.00 0.00 ATOM 25070 H2 SOL 3322 21.370 16.210 78.510 1.00 0.00 ATOM 25071 OH2 SOL 3323 25.400 30.760 73.470 1.00 0.00 ATOM 25072 H1 SOL 3323 24.690 30.120 73.510 1.00 0.00 ATOM 25073 H2 SOL 3323 26.050 30.350 72.890 1.00 0.00 ATOM 25074 OH2 SOL 3324 58.440 57.920 1.230 1.00 0.00 ATOM 25075 H1 SOL 3324 58.190 57.000 1.370 1.00 0.00 ATOM 25076 H2 SOL 3324 57.620 58.360 1.030 1.00 0.00 ATOM 25077 OH2 SOL 3325 12.540 18.310 10.980 1.00 0.00 ATOM 25078 H1 SOL 3325 12.980 18.760 10.260 1.00 0.00 ATOM 25079 H2 SOL 3325 12.680 17.380 10.810 1.00 0.00 ATOM 25080 OH2 SOL 3326 25.440 27.570 6.560 1.00 0.00 ATOM 25081 H1 SOL 3326 25.720 27.470 7.470 1.00 0.00 ATOM 25082 H2 SOL 3326 24.490 27.710 6.630 1.00 0.00 ATOM 25083 OH2 SOL 3327 7.870 8.310 20.270 1.00 0.00 ATOM 25084 H1 SOL 3327 8.640 7.830 20.560 1.00 0.00 ATOM 25085 H2 SOL 3327 7.310 8.340 21.050 1.00 0.00 ATOM 25086 OH2 SOL 3328 35.950 55.490 8.970 1.00 0.00 ATOM 25087 H1 SOL 3328 36.870 55.330 9.200 1.00 0.00 ATOM 25088 H2 SOL 3328 35.550 55.780 9.790 1.00 0.00 ATOM 25089 OH2 SOL 3329 33.040 57.870 22.930 1.00 0.00 ATOM 25090 H1 SOL 3329 32.990 57.080 22.390 1.00 0.00 ATOM 25091 H2 SOL 3329 33.880 57.820 23.370 1.00 0.00 ATOM 25092 OH2 SOL 3330 45.960 49.130 79.850 1.00 0.00 ATOM 25093 H1 SOL 3330 46.200 48.200 79.840 1.00 0.00 ATOM 25094 H2 SOL 3330 45.620 49.300 78.980 1.00 0.00 ATOM 25095 OH2 SOL 3331 42.060 52.780 79.640 1.00 0.00 ATOM 25096 H1 SOL 3331 41.440 53.440 79.960 1.00 0.00 ATOM 25097 H2 SOL 3331 41.580 51.960 79.680 1.00 0.00 ATOM 25098 OH2 SOL 3332 58.460 26.300 15.260 1.00 0.00 ATOM 25099 H1 SOL 3332 58.350 25.870 16.110 1.00 0.00 ATOM 25100 H2 SOL 3332 59.400 26.270 15.090 1.00 0.00 ATOM 25101 OH2 SOL 3333 38.600 2.350 2.670 1.00 0.00 ATOM 25102 H1 SOL 3333 38.520 2.910 1.890 1.00 0.00 ATOM 25103 H2 SOL 3333 38.580 1.460 2.320 1.00 0.00 ATOM 25104 OH2 SOL 3334 56.790 51.560 79.910 1.00 0.00 ATOM 25105 H1 SOL 3334 56.350 51.300 79.100 1.00 0.00 ATOM 25106 H2 SOL 3334 57.580 51.020 79.940 1.00 0.00 ATOM 25107 OH2 SOL 3335 33.960 56.770 76.700 1.00 0.00 ATOM 25108 H1 SOL 3335 34.090 56.650 75.760 1.00 0.00 ATOM 25109 H2 SOL 3335 33.770 55.890 77.030 1.00 0.00 ATOM 25110 OH2 SOL 3336 17.190 13.160 12.960 1.00 0.00 ATOM 25111 H1 SOL 3336 18.050 12.990 12.590 1.00 0.00 ATOM 25112 H2 SOL 3336 17.350 13.810 13.640 1.00 0.00 ATOM 25113 OH2 SOL 3337 33.900 15.350 19.150 1.00 0.00 ATOM 25114 H1 SOL 3337 33.930 15.190 18.200 1.00 0.00 ATOM 25115 H2 SOL 3337 33.320 16.100 19.250 1.00 0.00 ATOM 25116 OH2 SOL 3338 14.530 33.070 66.490 1.00 0.00 ATOM 25117 H1 SOL 3338 14.270 33.930 66.820 1.00 0.00 ATOM 25118 H2 SOL 3338 15.300 33.250 65.940 1.00 0.00 ATOM 25119 OH2 SOL 3339 42.100 60.360 65.760 1.00 0.00 ATOM 25120 H1 SOL 3339 42.390 59.810 65.030 1.00 0.00 ATOM 25121 H2 SOL 3339 42.910 60.580 66.230 1.00 0.00 ATOM 25122 OH2 SOL 3340 51.720 47.820 69.340 1.00 0.00 ATOM 25123 H1 SOL 3340 52.400 48.150 69.930 1.00 0.00 ATOM 25124 H2 SOL 3340 51.720 48.420 68.600 1.00 0.00 ATOM 25125 OH2 SOL 3341 56.610 11.110 9.520 1.00 0.00 ATOM 25126 H1 SOL 3341 57.510 11.050 9.840 1.00 0.00 ATOM 25127 H2 SOL 3341 56.240 11.860 9.990 1.00 0.00 ATOM 25128 OH2 SOL 3342 20.180 57.080 11.770 1.00 0.00 ATOM 25129 H1 SOL 3342 20.470 57.860 11.300 1.00 0.00 ATOM 25130 H2 SOL 3342 19.840 56.500 11.090 1.00 0.00 ATOM 25131 OH2 SOL 3343 14.800 40.010 72.310 1.00 0.00 ATOM 25132 H1 SOL 3343 14.720 40.940 72.120 1.00 0.00 ATOM 25133 H2 SOL 3343 15.170 39.970 73.190 1.00 0.00 ATOM 25134 OH2 SOL 3344 46.710 11.120 10.740 1.00 0.00 ATOM 25135 H1 SOL 3344 46.810 10.700 9.890 1.00 0.00 ATOM 25136 H2 SOL 3344 47.380 11.800 10.760 1.00 0.00 ATOM 25137 OH2 SOL 3345 42.040 37.010 71.770 1.00 0.00 ATOM 25138 H1 SOL 3345 41.480 37.680 72.160 1.00 0.00 ATOM 25139 H2 SOL 3345 42.380 37.420 70.980 1.00 0.00 ATOM 25140 OH2 SOL 3346 12.730 28.500 20.410 1.00 0.00 ATOM 25141 H1 SOL 3346 12.070 28.130 20.990 1.00 0.00 ATOM 25142 H2 SOL 3346 13.410 28.830 20.990 1.00 0.00 ATOM 25143 OH2 SOL 3347 29.860 44.650 0.820 1.00 0.00 ATOM 25144 H1 SOL 3347 29.970 45.300 1.520 1.00 0.00 ATOM 25145 H2 SOL 3347 29.320 45.090 0.160 1.00 0.00 ATOM 25146 OH2 SOL 3348 8.540 43.680 76.050 1.00 0.00 ATOM 25147 H1 SOL 3348 8.380 43.730 77.000 1.00 0.00 ATOM 25148 H2 SOL 3348 7.810 44.160 75.660 1.00 0.00 ATOM 25149 OH2 SOL 3349 50.490 53.210 78.370 1.00 0.00 ATOM 25150 H1 SOL 3349 49.870 52.700 77.860 1.00 0.00 ATOM 25151 H2 SOL 3349 51.270 53.280 77.820 1.00 0.00 ATOM 25152 OH2 SOL 3350 45.760 11.900 73.750 1.00 0.00 ATOM 25153 H1 SOL 3350 45.400 12.480 74.420 1.00 0.00 ATOM 25154 H2 SOL 3350 45.460 12.270 72.920 1.00 0.00 ATOM 25155 OH2 SOL 3351 14.090 37.000 72.820 1.00 0.00 ATOM 25156 H1 SOL 3351 13.540 36.250 73.070 1.00 0.00 ATOM 25157 H2 SOL 3351 14.200 36.900 71.870 1.00 0.00 ATOM 25158 OH2 SOL 3352 44.580 51.150 74.160 1.00 0.00 ATOM 25159 H1 SOL 3352 44.550 52.110 74.180 1.00 0.00 ATOM 25160 H2 SOL 3352 45.060 50.900 74.940 1.00 0.00 ATOM 25161 OH2 SOL 3353 40.250 60.290 69.650 1.00 0.00 ATOM 25162 H1 SOL 3353 40.450 61.220 69.610 1.00 0.00 ATOM 25163 H2 SOL 3353 39.480 60.240 70.220 1.00 0.00 ATOM 25164 OH2 SOL 3354 17.420 50.800 16.050 1.00 0.00 ATOM 25165 H1 SOL 3354 17.900 50.130 16.530 1.00 0.00 ATOM 25166 H2 SOL 3354 16.500 50.620 16.240 1.00 0.00 ATOM 25167 OH2 SOL 3355 28.890 26.470 83.460 1.00 0.00 ATOM 25168 H1 SOL 3355 28.600 25.560 83.340 1.00 0.00 ATOM 25169 H2 SOL 3355 29.500 26.620 82.740 1.00 0.00 ATOM 25170 OH2 SOL 3356 33.230 45.780 1.280 1.00 0.00 ATOM 25171 H1 SOL 3356 33.350 44.970 0.790 1.00 0.00 ATOM 25172 H2 SOL 3356 33.000 45.490 2.170 1.00 0.00 ATOM 25173 OH2 SOL 3357 56.600 44.340 66.320 1.00 0.00 ATOM 25174 H1 SOL 3357 55.700 44.480 66.610 1.00 0.00 ATOM 25175 H2 SOL 3357 56.710 43.390 66.370 1.00 0.00 ATOM 25176 OH2 SOL 3358 1.270 37.910 15.580 1.00 0.00 ATOM 25177 H1 SOL 3358 0.420 37.520 15.750 1.00 0.00 ATOM 25178 H2 SOL 3358 1.770 37.210 15.150 1.00 0.00 ATOM 25179 OH2 SOL 3359 28.620 23.660 83.810 1.00 0.00 ATOM 25180 H1 SOL 3359 28.240 23.000 83.230 1.00 0.00 ATOM 25181 H2 SOL 3359 28.210 23.500 84.660 1.00 0.00 ATOM 25182 OH2 SOL 3360 13.310 7.400 18.330 1.00 0.00 ATOM 25183 H1 SOL 3360 13.620 7.870 17.550 1.00 0.00 ATOM 25184 H2 SOL 3360 14.070 6.920 18.640 1.00 0.00 ATOM 25185 OH2 SOL 3361 17.840 9.850 10.370 1.00 0.00 ATOM 25186 H1 SOL 3361 18.780 9.710 10.390 1.00 0.00 ATOM 25187 H2 SOL 3361 17.700 10.630 10.910 1.00 0.00 ATOM 25188 OH2 SOL 3362 9.980 11.410 19.930 1.00 0.00 ATOM 25189 H1 SOL 3362 9.120 11.020 19.740 1.00 0.00 ATOM 25190 H2 SOL 3362 10.600 10.710 19.730 1.00 0.00 ATOM 25191 OH2 SOL 3363 1.140 46.420 82.720 1.00 0.00 ATOM 25192 H1 SOL 3363 1.230 47.330 83.000 1.00 0.00 ATOM 25193 H2 SOL 3363 1.520 46.400 81.840 1.00 0.00 ATOM 25194 OH2 SOL 3364 25.010 22.700 66.770 1.00 0.00 ATOM 25195 H1 SOL 3364 24.210 22.170 66.750 1.00 0.00 ATOM 25196 H2 SOL 3364 24.710 23.580 67.010 1.00 0.00 ATOM 25197 OH2 SOL 3365 35.930 33.000 20.640 1.00 0.00 ATOM 25198 H1 SOL 3365 35.660 33.360 21.490 1.00 0.00 ATOM 25199 H2 SOL 3365 36.850 33.250 20.560 1.00 0.00 ATOM 25200 OH2 SOL 3366 33.370 58.130 4.480 1.00 0.00 ATOM 25201 H1 SOL 3366 33.460 59.030 4.160 1.00 0.00 ATOM 25202 H2 SOL 3366 34.270 57.860 4.650 1.00 0.00 ATOM 25203 OH2 SOL 3367 40.670 10.090 64.860 1.00 0.00 ATOM 25204 H1 SOL 3367 40.870 10.790 65.480 1.00 0.00 ATOM 25205 H2 SOL 3367 41.190 10.310 64.080 1.00 0.00 ATOM 25206 OH2 SOL 3368 52.870 48.190 11.510 1.00 0.00 ATOM 25207 H1 SOL 3368 52.520 48.790 10.860 1.00 0.00 ATOM 25208 H2 SOL 3368 53.810 48.310 11.470 1.00 0.00 ATOM 25209 OH2 SOL 3369 27.600 53.460 67.220 1.00 0.00 ATOM 25210 H1 SOL 3369 27.260 54.100 66.600 1.00 0.00 ATOM 25211 H2 SOL 3369 27.060 53.580 68.000 1.00 0.00 ATOM 25212 OH2 SOL 3370 16.000 17.120 22.930 1.00 0.00 ATOM 25213 H1 SOL 3370 16.780 17.230 23.470 1.00 0.00 ATOM 25214 H2 SOL 3370 15.270 17.330 23.510 1.00 0.00 ATOM 25215 OH2 SOL 3371 1.140 26.340 12.130 1.00 0.00 ATOM 25216 H1 SOL 3371 0.380 25.760 12.170 1.00 0.00 ATOM 25217 H2 SOL 3371 1.370 26.500 13.040 1.00 0.00 ATOM 25218 OH2 SOL 3372 57.700 54.220 80.190 1.00 0.00 ATOM 25219 H1 SOL 3372 57.130 54.790 79.680 1.00 0.00 ATOM 25220 H2 SOL 3372 57.300 53.350 80.110 1.00 0.00 ATOM 25221 OH2 SOL 3373 2.170 21.950 18.010 1.00 0.00 ATOM 25222 H1 SOL 3373 2.650 22.440 18.680 1.00 0.00 ATOM 25223 H2 SOL 3373 1.400 22.480 17.830 1.00 0.00 ATOM 25224 OH2 SOL 3374 36.270 40.580 68.900 1.00 0.00 ATOM 25225 H1 SOL 3374 36.300 41.150 69.660 1.00 0.00 ATOM 25226 H2 SOL 3374 35.890 39.770 69.220 1.00 0.00 ATOM 25227 OH2 SOL 3375 25.680 59.860 21.830 1.00 0.00 ATOM 25228 H1 SOL 3375 25.760 60.820 21.810 1.00 0.00 ATOM 25229 H2 SOL 3375 26.550 59.560 22.080 1.00 0.00 ATOM 25230 OH2 SOL 3376 4.010 22.750 5.620 1.00 0.00 ATOM 25231 H1 SOL 3376 3.240 23.310 5.660 1.00 0.00 ATOM 25232 H2 SOL 3376 3.660 21.860 5.580 1.00 0.00 ATOM 25233 OH2 SOL 3377 2.620 35.440 65.560 1.00 0.00 ATOM 25234 H1 SOL 3377 3.130 34.640 65.680 1.00 0.00 ATOM 25235 H2 SOL 3377 3.010 35.870 64.810 1.00 0.00 ATOM 25236 OH2 SOL 3378 26.430 24.660 78.820 1.00 0.00 ATOM 25237 H1 SOL 3378 25.610 24.380 78.410 1.00 0.00 ATOM 25238 H2 SOL 3378 26.500 25.590 78.610 1.00 0.00 ATOM 25239 OH2 SOL 3379 17.100 42.740 76.510 1.00 0.00 ATOM 25240 H1 SOL 3379 16.880 42.280 75.700 1.00 0.00 ATOM 25241 H2 SOL 3379 17.860 43.270 76.290 1.00 0.00 ATOM 25242 OH2 SOL 3380 46.280 25.330 11.730 1.00 0.00 ATOM 25243 H1 SOL 3380 45.980 26.180 11.400 1.00 0.00 ATOM 25244 H2 SOL 3380 45.810 25.210 12.550 1.00 0.00 ATOM 25245 OH2 SOL 3381 24.060 59.320 10.280 1.00 0.00 ATOM 25246 H1 SOL 3381 23.720 58.990 9.440 1.00 0.00 ATOM 25247 H2 SOL 3381 23.370 59.110 10.910 1.00 0.00 ATOM 25248 OH2 SOL 3382 44.840 57.250 14.290 1.00 0.00 ATOM 25249 H1 SOL 3382 43.890 57.330 14.420 1.00 0.00 ATOM 25250 H2 SOL 3382 45.210 57.570 15.120 1.00 0.00 ATOM 25251 OH2 SOL 3383 12.770 24.450 2.050 1.00 0.00 ATOM 25252 H1 SOL 3383 13.050 24.790 1.200 1.00 0.00 ATOM 25253 H2 SOL 3383 11.830 24.660 2.090 1.00 0.00 ATOM 25254 OH2 SOL 3384 53.720 18.790 3.770 1.00 0.00 ATOM 25255 H1 SOL 3384 53.030 18.330 3.290 1.00 0.00 ATOM 25256 H2 SOL 3384 53.280 19.120 4.550 1.00 0.00 ATOM 25257 OH2 SOL 3385 1.650 13.300 68.960 1.00 0.00 ATOM 25258 H1 SOL 3385 2.590 13.450 68.920 1.00 0.00 ATOM 25259 H2 SOL 3385 1.460 13.200 69.890 1.00 0.00 ATOM 25260 OH2 SOL 3386 15.730 58.170 80.780 1.00 0.00 ATOM 25261 H1 SOL 3386 15.000 57.740 80.340 1.00 0.00 ATOM 25262 H2 SOL 3386 15.360 58.500 81.600 1.00 0.00 ATOM 25263 OH2 SOL 3387 10.110 59.960 82.260 1.00 0.00 ATOM 25264 H1 SOL 3387 10.290 59.970 83.200 1.00 0.00 ATOM 25265 H2 SOL 3387 9.660 60.790 82.100 1.00 0.00 ATOM 25266 OH2 SOL 3388 58.480 24.890 66.010 1.00 0.00 ATOM 25267 H1 SOL 3388 57.820 25.380 66.510 1.00 0.00 ATOM 25268 H2 SOL 3388 58.450 25.260 65.130 1.00 0.00 ATOM 25269 OH2 SOL 3389 49.210 29.850 68.480 1.00 0.00 ATOM 25270 H1 SOL 3389 49.070 29.290 67.720 1.00 0.00 ATOM 25271 H2 SOL 3389 49.660 29.280 69.110 1.00 0.00 ATOM 25272 OH2 SOL 3390 36.810 9.270 6.820 1.00 0.00 ATOM 25273 H1 SOL 3390 36.780 8.670 6.080 1.00 0.00 ATOM 25274 H2 SOL 3390 37.500 9.900 6.590 1.00 0.00 ATOM 25275 OH2 SOL 3391 31.940 11.720 80.230 1.00 0.00 ATOM 25276 H1 SOL 3391 32.260 12.420 80.800 1.00 0.00 ATOM 25277 H2 SOL 3391 32.480 10.960 80.450 1.00 0.00 ATOM 25278 OH2 SOL 3392 23.520 36.860 68.510 1.00 0.00 ATOM 25279 H1 SOL 3392 24.380 37.060 68.150 1.00 0.00 ATOM 25280 H2 SOL 3392 23.270 36.040 68.070 1.00 0.00 ATOM 25281 OH2 SOL 3393 45.540 46.870 7.880 1.00 0.00 ATOM 25282 H1 SOL 3393 46.080 46.080 7.900 1.00 0.00 ATOM 25283 H2 SOL 3393 44.920 46.720 7.160 1.00 0.00 ATOM 25284 OH2 SOL 3394 34.310 19.000 14.510 1.00 0.00 ATOM 25285 H1 SOL 3394 33.580 18.510 14.140 1.00 0.00 ATOM 25286 H2 SOL 3394 35.080 18.480 14.320 1.00 0.00 ATOM 25287 OH2 SOL 3395 47.910 47.370 82.340 1.00 0.00 ATOM 25288 H1 SOL 3395 47.040 47.350 82.730 1.00 0.00 ATOM 25289 H2 SOL 3395 48.150 48.300 82.320 1.00 0.00 ATOM 25290 OH2 SOL 3396 24.580 6.830 61.910 1.00 0.00 ATOM 25291 H1 SOL 3396 25.160 6.790 61.150 1.00 0.00 ATOM 25292 H2 SOL 3396 25.130 6.510 62.630 1.00 0.00 ATOM 25293 OH2 SOL 3397 50.980 47.710 25.480 1.00 0.00 ATOM 25294 H1 SOL 3397 51.340 47.730 24.590 1.00 0.00 ATOM 25295 H2 SOL 3397 50.980 48.620 25.770 1.00 0.00 ATOM 25296 OH2 SOL 3398 27.700 47.990 1.070 1.00 0.00 ATOM 25297 H1 SOL 3398 27.100 48.400 0.450 1.00 0.00 ATOM 25298 H2 SOL 3398 28.070 48.730 1.560 1.00 0.00 ATOM 25299 OH2 SOL 3399 10.960 13.950 9.880 1.00 0.00 ATOM 25300 H1 SOL 3399 10.500 13.670 10.660 1.00 0.00 ATOM 25301 H2 SOL 3399 10.350 13.790 9.160 1.00 0.00 ATOM 25302 OH2 SOL 3400 18.310 37.390 20.020 1.00 0.00 ATOM 25303 H1 SOL 3400 18.040 37.840 19.220 1.00 0.00 ATOM 25304 H2 SOL 3400 19.270 37.350 19.960 1.00 0.00 ATOM 25305 OH2 SOL 3401 39.360 7.410 10.280 1.00 0.00 ATOM 25306 H1 SOL 3401 39.120 8.240 9.870 1.00 0.00 ATOM 25307 H2 SOL 3401 40.320 7.380 10.200 1.00 0.00 ATOM 25308 OH2 SOL 3402 52.520 44.700 74.980 1.00 0.00 ATOM 25309 H1 SOL 3402 51.810 45.130 74.490 1.00 0.00 ATOM 25310 H2 SOL 3402 52.360 43.760 74.840 1.00 0.00 ATOM 25311 OH2 SOL 3403 32.690 29.890 73.480 1.00 0.00 ATOM 25312 H1 SOL 3403 32.900 30.770 73.200 1.00 0.00 ATOM 25313 H2 SOL 3403 33.500 29.390 73.360 1.00 0.00 ATOM 25314 OH2 SOL 3404 36.130 25.890 83.210 1.00 0.00 ATOM 25315 H1 SOL 3404 36.360 26.780 82.940 1.00 0.00 ATOM 25316 H2 SOL 3404 36.580 25.780 84.050 1.00 0.00 ATOM 25317 OH2 SOL 3405 43.670 46.330 79.920 1.00 0.00 ATOM 25318 H1 SOL 3405 44.520 45.880 79.930 1.00 0.00 ATOM 25319 H2 SOL 3405 43.040 45.680 80.230 1.00 0.00 ATOM 25320 OH2 SOL 3406 18.590 48.680 17.360 1.00 0.00 ATOM 25321 H1 SOL 3406 19.310 49.210 17.690 1.00 0.00 ATOM 25322 H2 SOL 3406 18.400 48.060 18.070 1.00 0.00 ATOM 25323 OH2 SOL 3407 8.730 4.240 9.680 1.00 0.00 ATOM 25324 H1 SOL 3407 9.040 5.140 9.630 1.00 0.00 ATOM 25325 H2 SOL 3407 9.520 3.710 9.700 1.00 0.00 ATOM 25326 OH2 SOL 3408 13.480 54.620 16.540 1.00 0.00 ATOM 25327 H1 SOL 3408 14.390 54.760 16.300 1.00 0.00 ATOM 25328 H2 SOL 3408 13.310 53.700 16.320 1.00 0.00 ATOM 25329 OH2 SOL 3409 8.680 29.190 68.290 1.00 0.00 ATOM 25330 H1 SOL 3409 8.270 29.810 67.680 1.00 0.00 ATOM 25331 H2 SOL 3409 8.210 28.370 68.150 1.00 0.00 ATOM 25332 OH2 SOL 3410 49.440 54.760 74.250 1.00 0.00 ATOM 25333 H1 SOL 3410 49.110 54.510 73.390 1.00 0.00 ATOM 25334 H2 SOL 3410 48.770 54.450 74.860 1.00 0.00 ATOM 25335 OH2 SOL 3411 17.950 59.160 82.850 1.00 0.00 ATOM 25336 H1 SOL 3411 18.860 59.410 82.680 1.00 0.00 ATOM 25337 H2 SOL 3411 17.530 59.160 81.990 1.00 0.00 ATOM 25338 OH2 SOL 3412 20.010 5.990 10.730 1.00 0.00 ATOM 25339 H1 SOL 3412 19.190 6.480 10.650 1.00 0.00 ATOM 25340 H2 SOL 3412 20.170 5.960 11.680 1.00 0.00 ATOM 25341 OH2 SOL 3413 49.620 49.030 71.270 1.00 0.00 ATOM 25342 H1 SOL 3413 50.300 48.710 70.680 1.00 0.00 ATOM 25343 H2 SOL 3413 48.840 49.120 70.720 1.00 0.00 ATOM 25344 OH2 SOL 3414 16.570 15.930 68.710 1.00 0.00 ATOM 25345 H1 SOL 3414 17.350 16.340 68.350 1.00 0.00 ATOM 25346 H2 SOL 3414 16.760 14.990 68.680 1.00 0.00 ATOM 25347 OH2 SOL 3415 30.660 7.990 11.790 1.00 0.00 ATOM 25348 H1 SOL 3415 30.220 7.670 12.570 1.00 0.00 ATOM 25349 H2 SOL 3415 30.460 7.340 11.120 1.00 0.00 ATOM 25350 OH2 SOL 3416 42.910 51.850 2.220 1.00 0.00 ATOM 25351 H1 SOL 3416 43.790 51.990 1.870 1.00 0.00 ATOM 25352 H2 SOL 3416 43.040 51.830 3.170 1.00 0.00 ATOM 25353 OH2 SOL 3417 47.350 27.230 67.850 1.00 0.00 ATOM 25354 H1 SOL 3417 47.850 27.750 67.230 1.00 0.00 ATOM 25355 H2 SOL 3417 47.770 26.360 67.840 1.00 0.00 ATOM 25356 OH2 SOL 3418 43.210 7.910 1.860 1.00 0.00 ATOM 25357 H1 SOL 3418 44.070 7.710 2.240 1.00 0.00 ATOM 25358 H2 SOL 3418 43.040 7.190 1.260 1.00 0.00 ATOM 25359 OH2 SOL 3419 6.820 12.360 3.610 1.00 0.00 ATOM 25360 H1 SOL 3419 7.340 12.690 4.340 1.00 0.00 ATOM 25361 H2 SOL 3419 6.070 12.950 3.560 1.00 0.00 ATOM 25362 OH2 SOL 3420 41.560 56.390 83.400 1.00 0.00 ATOM 25363 H1 SOL 3420 42.330 55.840 83.290 1.00 0.00 ATOM 25364 H2 SOL 3420 41.000 56.160 82.660 1.00 0.00 ATOM 25365 OH2 SOL 3421 53.230 8.900 2.770 1.00 0.00 ATOM 25366 H1 SOL 3421 53.590 8.040 2.990 1.00 0.00 ATOM 25367 H2 SOL 3421 53.230 9.380 3.600 1.00 0.00 ATOM 25368 OH2 SOL 3422 11.390 4.620 24.880 1.00 0.00 ATOM 25369 H1 SOL 3422 10.990 3.830 25.250 1.00 0.00 ATOM 25370 H2 SOL 3422 10.650 5.110 24.510 1.00 0.00 ATOM 25371 OH2 SOL 3423 34.530 47.900 4.250 1.00 0.00 ATOM 25372 H1 SOL 3423 34.880 48.790 4.350 1.00 0.00 ATOM 25373 H2 SOL 3423 35.270 47.390 3.920 1.00 0.00 ATOM 25374 OH2 SOL 3424 46.100 -0.050 3.000 1.00 0.00 ATOM 25375 H1 SOL 3424 46.930 -0.100 3.490 1.00 0.00 ATOM 25376 H2 SOL 3424 45.850 0.870 3.050 1.00 0.00 ATOM 25377 OH2 SOL 3425 36.870 22.230 7.820 1.00 0.00 ATOM 25378 H1 SOL 3425 37.180 23.040 7.420 1.00 0.00 ATOM 25379 H2 SOL 3425 36.920 22.390 8.760 1.00 0.00 ATOM 25380 OH2 SOL 3426 43.910 22.980 75.740 1.00 0.00 ATOM 25381 H1 SOL 3426 43.370 22.720 76.490 1.00 0.00 ATOM 25382 H2 SOL 3426 43.800 23.930 75.680 1.00 0.00 ATOM 25383 OH2 SOL 3427 32.040 15.780 3.150 1.00 0.00 ATOM 25384 H1 SOL 3427 32.660 15.900 2.430 1.00 0.00 ATOM 25385 H2 SOL 3427 32.490 16.140 3.910 1.00 0.00 ATOM 25386 OH2 SOL 3428 54.780 44.040 78.670 1.00 0.00 ATOM 25387 H1 SOL 3428 55.090 43.130 78.720 1.00 0.00 ATOM 25388 H2 SOL 3428 55.280 44.500 79.340 1.00 0.00 ATOM 25389 OH2 SOL 3429 31.160 3.000 15.180 1.00 0.00 ATOM 25390 H1 SOL 3429 31.530 2.260 15.650 1.00 0.00 ATOM 25391 H2 SOL 3429 31.920 3.530 14.930 1.00 0.00 ATOM 25392 OH2 SOL 3430 59.280 37.530 69.270 1.00 0.00 ATOM 25393 H1 SOL 3430 58.770 37.180 68.540 1.00 0.00 ATOM 25394 H2 SOL 3430 59.680 38.320 68.920 1.00 0.00 ATOM 25395 OH2 SOL 3431 53.780 43.690 71.470 1.00 0.00 ATOM 25396 H1 SOL 3431 54.350 43.710 70.700 1.00 0.00 ATOM 25397 H2 SOL 3431 54.270 44.150 72.150 1.00 0.00 ATOM 25398 OH2 SOL 3432 36.350 49.680 4.690 1.00 0.00 ATOM 25399 H1 SOL 3432 36.410 49.770 5.640 1.00 0.00 ATOM 25400 H2 SOL 3432 37.220 49.900 4.370 1.00 0.00 ATOM 25401 OH2 SOL 3433 24.030 16.370 80.010 1.00 0.00 ATOM 25402 H1 SOL 3433 24.790 16.880 80.260 1.00 0.00 ATOM 25403 H2 SOL 3433 24.350 15.780 79.320 1.00 0.00 ATOM 25404 OH2 SOL 3434 42.930 47.580 12.660 1.00 0.00 ATOM 25405 H1 SOL 3434 43.460 46.820 12.890 1.00 0.00 ATOM 25406 H2 SOL 3434 42.610 47.380 11.780 1.00 0.00 ATOM 25407 OH2 SOL 3435 53.520 49.960 82.420 1.00 0.00 ATOM 25408 H1 SOL 3435 54.060 50.730 82.240 1.00 0.00 ATOM 25409 H2 SOL 3435 52.640 50.230 82.160 1.00 0.00 ATOM 25410 OH2 SOL 3436 28.340 37.550 18.630 1.00 0.00 ATOM 25411 H1 SOL 3436 28.190 36.810 18.050 1.00 0.00 ATOM 25412 H2 SOL 3436 28.910 38.140 18.140 1.00 0.00 ATOM 25413 OH2 SOL 3437 50.650 31.650 76.820 1.00 0.00 ATOM 25414 H1 SOL 3437 51.080 32.500 76.750 1.00 0.00 ATOM 25415 H2 SOL 3437 51.130 31.190 77.500 1.00 0.00 ATOM 25416 OH2 SOL 3438 41.870 26.460 2.420 1.00 0.00 ATOM 25417 H1 SOL 3438 42.180 27.030 1.710 1.00 0.00 ATOM 25418 H2 SOL 3438 42.230 26.850 3.220 1.00 0.00 ATOM 25419 OH2 SOL 3439 39.900 23.320 73.120 1.00 0.00 ATOM 25420 H1 SOL 3439 39.580 23.600 73.990 1.00 0.00 ATOM 25421 H2 SOL 3439 40.610 22.710 73.310 1.00 0.00 ATOM 25422 OH2 SOL 3440 6.160 29.940 14.340 1.00 0.00 ATOM 25423 H1 SOL 3440 7.070 29.680 14.480 1.00 0.00 ATOM 25424 H2 SOL 3440 6.090 30.800 14.770 1.00 0.00 ATOM 25425 OH2 SOL 3441 41.310 43.900 70.660 1.00 0.00 ATOM 25426 H1 SOL 3441 40.500 44.270 70.980 1.00 0.00 ATOM 25427 H2 SOL 3441 41.980 44.160 71.290 1.00 0.00 ATOM 25428 OH2 SOL 3442 13.820 8.480 76.330 1.00 0.00 ATOM 25429 H1 SOL 3442 14.170 8.100 75.530 1.00 0.00 ATOM 25430 H2 SOL 3442 12.910 8.700 76.120 1.00 0.00 ATOM 25431 OH2 SOL 3443 41.300 22.890 22.010 1.00 0.00 ATOM 25432 H1 SOL 3443 40.850 23.510 21.430 1.00 0.00 ATOM 25433 H2 SOL 3443 40.610 22.560 22.590 1.00 0.00 ATOM 25434 OH2 SOL 3444 45.580 25.120 67.530 1.00 0.00 ATOM 25435 H1 SOL 3444 45.230 26.000 67.680 1.00 0.00 ATOM 25436 H2 SOL 3444 44.970 24.550 68.000 1.00 0.00 ATOM 25437 OH2 SOL 3445 15.070 3.730 69.720 1.00 0.00 ATOM 25438 H1 SOL 3445 14.850 3.790 70.650 1.00 0.00 ATOM 25439 H2 SOL 3445 15.380 4.610 69.500 1.00 0.00 ATOM 25440 OH2 SOL 3446 23.550 16.520 18.850 1.00 0.00 ATOM 25441 H1 SOL 3446 22.930 17.240 18.960 1.00 0.00 ATOM 25442 H2 SOL 3446 24.400 16.940 18.730 1.00 0.00 ATOM 25443 OH2 SOL 3447 29.410 30.680 76.900 1.00 0.00 ATOM 25444 H1 SOL 3447 29.240 30.670 77.840 1.00 0.00 ATOM 25445 H2 SOL 3447 30.350 30.520 76.820 1.00 0.00 ATOM 25446 OH2 SOL 3448 32.070 11.160 84.200 1.00 0.00 ATOM 25447 H1 SOL 3448 31.540 10.760 84.880 1.00 0.00 ATOM 25448 H2 SOL 3448 32.370 10.430 83.660 1.00 0.00 ATOM 25449 OH2 SOL 3449 37.720 9.740 82.400 1.00 0.00 ATOM 25450 H1 SOL 3449 37.440 10.570 82.790 1.00 0.00 ATOM 25451 H2 SOL 3449 37.890 9.940 81.480 1.00 0.00 ATOM 25452 OH2 SOL 3450 37.010 33.180 72.040 1.00 0.00 ATOM 25453 H1 SOL 3450 37.770 32.770 72.440 1.00 0.00 ATOM 25454 H2 SOL 3450 37.240 34.100 71.970 1.00 0.00 ATOM 25455 OH2 SOL 3451 14.750 36.450 82.780 1.00 0.00 ATOM 25456 H1 SOL 3451 14.640 35.690 82.200 1.00 0.00 ATOM 25457 H2 SOL 3451 15.170 37.110 82.230 1.00 0.00 ATOM 25458 OH2 SOL 3452 28.850 20.150 2.320 1.00 0.00 ATOM 25459 H1 SOL 3452 29.020 19.410 2.900 1.00 0.00 ATOM 25460 H2 SOL 3452 29.280 19.900 1.500 1.00 0.00 ATOM 25461 OH2 SOL 3453 57.570 39.980 67.230 1.00 0.00 ATOM 25462 H1 SOL 3453 56.960 39.770 67.940 1.00 0.00 ATOM 25463 H2 SOL 3453 57.530 39.230 66.640 1.00 0.00 ATOM 25464 OH2 SOL 3454 29.340 4.650 76.870 1.00 0.00 ATOM 25465 H1 SOL 3454 29.770 3.820 77.070 1.00 0.00 ATOM 25466 H2 SOL 3454 28.790 4.820 77.640 1.00 0.00 ATOM 25467 OH2 SOL 3455 39.600 34.900 7.820 1.00 0.00 ATOM 25468 H1 SOL 3455 39.550 35.250 8.710 1.00 0.00 ATOM 25469 H2 SOL 3455 39.590 33.950 7.930 1.00 0.00 ATOM 25470 OH2 SOL 3456 50.490 54.790 11.790 1.00 0.00 ATOM 25471 H1 SOL 3456 51.190 55.370 12.100 1.00 0.00 ATOM 25472 H2 SOL 3456 50.550 54.830 10.840 1.00 0.00 ATOM 25473 OH2 SOL 3457 8.510 57.900 76.010 1.00 0.00 ATOM 25474 H1 SOL 3457 7.990 58.400 75.380 1.00 0.00 ATOM 25475 H2 SOL 3457 8.690 58.520 76.710 1.00 0.00 ATOM 25476 OH2 SOL 3458 25.030 3.150 17.850 1.00 0.00 ATOM 25477 H1 SOL 3458 25.130 2.740 18.710 1.00 0.00 ATOM 25478 H2 SOL 3458 24.490 3.930 18.020 1.00 0.00 ATOM 25479 OH2 SOL 3459 3.560 50.310 82.730 1.00 0.00 ATOM 25480 H1 SOL 3459 4.030 49.500 82.530 1.00 0.00 ATOM 25481 H2 SOL 3459 4.120 51.000 82.380 1.00 0.00 ATOM 25482 OH2 SOL 3460 29.140 27.900 12.610 1.00 0.00 ATOM 25483 H1 SOL 3460 29.260 27.010 12.920 1.00 0.00 ATOM 25484 H2 SOL 3460 28.530 27.830 11.880 1.00 0.00 ATOM 25485 OH2 SOL 3461 7.240 41.420 75.680 1.00 0.00 ATOM 25486 H1 SOL 3461 7.800 42.200 75.690 1.00 0.00 ATOM 25487 H2 SOL 3461 7.000 41.290 76.600 1.00 0.00 ATOM 25488 OH2 SOL 3462 14.640 19.110 85.120 1.00 0.00 ATOM 25489 H1 SOL 3462 14.510 18.380 84.510 1.00 0.00 ATOM 25490 H2 SOL 3462 14.400 19.890 84.610 1.00 0.00 ATOM 25491 OH2 SOL 3463 5.330 42.380 70.200 1.00 0.00 ATOM 25492 H1 SOL 3463 5.820 42.810 69.500 1.00 0.00 ATOM 25493 H2 SOL 3463 4.640 43.010 70.420 1.00 0.00 ATOM 25494 OH2 SOL 3464 28.860 57.270 12.400 1.00 0.00 ATOM 25495 H1 SOL 3464 29.340 57.270 11.580 1.00 0.00 ATOM 25496 H2 SOL 3464 28.050 57.760 12.210 1.00 0.00 ATOM 25497 OH2 SOL 3465 30.310 14.690 20.630 1.00 0.00 ATOM 25498 H1 SOL 3465 29.940 14.350 19.810 1.00 0.00 ATOM 25499 H2 SOL 3465 29.580 14.630 21.250 1.00 0.00 ATOM 25500 OH2 SOL 3466 19.410 20.940 1.520 1.00 0.00 ATOM 25501 H1 SOL 3466 20.350 20.910 1.350 1.00 0.00 ATOM 25502 H2 SOL 3466 19.030 20.290 0.920 1.00 0.00 ATOM 25503 OH2 SOL 3467 59.430 26.350 9.430 1.00 0.00 ATOM 25504 H1 SOL 3467 58.740 25.680 9.360 1.00 0.00 ATOM 25505 H2 SOL 3467 60.000 26.030 10.140 1.00 0.00 ATOM 25506 OH2 SOL 3468 8.760 41.620 72.360 1.00 0.00 ATOM 25507 H1 SOL 3468 8.660 42.410 71.820 1.00 0.00 ATOM 25508 H2 SOL 3468 7.920 41.520 72.800 1.00 0.00 ATOM 25509 OH2 SOL 3469 57.000 34.510 14.270 1.00 0.00 ATOM 25510 H1 SOL 3469 56.470 34.380 15.050 1.00 0.00 ATOM 25511 H2 SOL 3469 56.840 33.740 13.740 1.00 0.00 ATOM 25512 OH2 SOL 3470 35.280 27.350 64.320 1.00 0.00 ATOM 25513 H1 SOL 3470 35.460 26.710 63.630 1.00 0.00 ATOM 25514 H2 SOL 3470 34.450 27.050 64.710 1.00 0.00 ATOM 25515 OH2 SOL 3471 30.340 27.720 78.810 1.00 0.00 ATOM 25516 H1 SOL 3471 30.760 27.650 77.950 1.00 0.00 ATOM 25517 H2 SOL 3471 29.600 27.120 78.760 1.00 0.00 ATOM 25518 OH2 SOL 3472 45.410 20.740 17.680 1.00 0.00 ATOM 25519 H1 SOL 3472 45.420 19.970 17.120 1.00 0.00 ATOM 25520 H2 SOL 3472 46.120 21.290 17.350 1.00 0.00 ATOM 25521 OH2 SOL 3473 2.960 6.480 83.300 1.00 0.00 ATOM 25522 H1 SOL 3473 3.640 6.620 83.970 1.00 0.00 ATOM 25523 H2 SOL 3473 2.350 5.870 83.710 1.00 0.00 ATOM 25524 OH2 SOL 3474 31.590 47.560 64.310 1.00 0.00 ATOM 25525 H1 SOL 3474 31.290 47.330 63.430 1.00 0.00 ATOM 25526 H2 SOL 3474 30.870 47.300 64.880 1.00 0.00 ATOM 25527 OH2 SOL 3475 51.730 18.710 70.350 1.00 0.00 ATOM 25528 H1 SOL 3475 51.300 17.880 70.530 1.00 0.00 ATOM 25529 H2 SOL 3475 52.490 18.730 70.930 1.00 0.00 ATOM 25530 OH2 SOL 3476 26.080 55.630 80.100 1.00 0.00 ATOM 25531 H1 SOL 3476 25.340 56.240 80.140 1.00 0.00 ATOM 25532 H2 SOL 3476 26.210 55.350 81.010 1.00 0.00 ATOM 25533 OH2 SOL 3477 46.260 41.210 6.150 1.00 0.00 ATOM 25534 H1 SOL 3477 45.970 40.350 6.460 1.00 0.00 ATOM 25535 H2 SOL 3477 46.030 41.230 5.220 1.00 0.00 ATOM 25536 OH2 SOL 3478 23.420 38.650 64.980 1.00 0.00 ATOM 25537 H1 SOL 3478 24.180 38.230 65.370 1.00 0.00 ATOM 25538 H2 SOL 3478 22.760 37.960 64.930 1.00 0.00 ATOM 25539 OH2 SOL 3479 49.980 21.120 3.540 1.00 0.00 ATOM 25540 H1 SOL 3479 49.710 21.810 4.140 1.00 0.00 ATOM 25541 H2 SOL 3479 49.230 20.990 2.960 1.00 0.00 ATOM 25542 OH2 SOL 3480 27.030 39.130 77.390 1.00 0.00 ATOM 25543 H1 SOL 3480 27.110 39.350 76.460 1.00 0.00 ATOM 25544 H2 SOL 3480 26.110 38.870 77.490 1.00 0.00 ATOM 25545 OH2 SOL 3481 51.670 60.160 19.520 1.00 0.00 ATOM 25546 H1 SOL 3481 51.330 59.330 19.870 1.00 0.00 ATOM 25547 H2 SOL 3481 51.110 60.340 18.770 1.00 0.00 ATOM 25548 OH2 SOL 3482 2.840 49.070 63.710 1.00 0.00 ATOM 25549 H1 SOL 3482 2.530 48.690 62.890 1.00 0.00 ATOM 25550 H2 SOL 3482 3.030 48.320 64.270 1.00 0.00 ATOM 25551 OH2 SOL 3483 39.790 54.120 0.960 1.00 0.00 ATOM 25552 H1 SOL 3483 40.610 53.740 0.640 1.00 0.00 ATOM 25553 H2 SOL 3483 39.290 53.380 1.290 1.00 0.00 ATOM 25554 OH2 SOL 3484 35.170 35.810 64.880 1.00 0.00 ATOM 25555 H1 SOL 3484 35.100 36.040 63.950 1.00 0.00 ATOM 25556 H2 SOL 3484 35.620 36.560 65.270 1.00 0.00 ATOM 25557 OH2 SOL 3485 57.640 40.990 21.150 1.00 0.00 ATOM 25558 H1 SOL 3485 57.180 40.170 21.030 1.00 0.00 ATOM 25559 H2 SOL 3485 58.510 40.740 21.450 1.00 0.00 ATOM 25560 OH2 SOL 3486 42.300 57.530 15.370 1.00 0.00 ATOM 25561 H1 SOL 3486 42.020 56.670 15.700 1.00 0.00 ATOM 25562 H2 SOL 3486 41.530 58.090 15.470 1.00 0.00 ATOM 25563 OH2 SOL 3487 14.880 -0.210 4.090 1.00 0.00 ATOM 25564 H1 SOL 3487 14.220 0.190 4.660 1.00 0.00 ATOM 25565 H2 SOL 3487 15.090 0.460 3.440 1.00 0.00 ATOM 25566 OH2 SOL 3488 11.590 41.700 80.210 1.00 0.00 ATOM 25567 H1 SOL 3488 11.230 40.990 79.680 1.00 0.00 ATOM 25568 H2 SOL 3488 12.490 41.800 79.890 1.00 0.00 ATOM 25569 OH2 SOL 3489 14.050 16.340 19.390 1.00 0.00 ATOM 25570 H1 SOL 3489 14.890 16.130 19.810 1.00 0.00 ATOM 25571 H2 SOL 3489 13.920 17.270 19.580 1.00 0.00 ATOM 25572 OH2 SOL 3490 5.260 12.870 70.330 1.00 0.00 ATOM 25573 H1 SOL 3490 5.180 12.290 71.090 1.00 0.00 ATOM 25574 H2 SOL 3490 4.900 13.710 70.630 1.00 0.00 ATOM 25575 OH2 SOL 3491 16.460 12.840 68.080 1.00 0.00 ATOM 25576 H1 SOL 3491 16.390 13.330 67.260 1.00 0.00 ATOM 25577 H2 SOL 3491 16.240 11.940 67.840 1.00 0.00 ATOM 25578 OH2 SOL 3492 7.760 19.940 17.650 1.00 0.00 ATOM 25579 H1 SOL 3492 6.870 19.710 17.910 1.00 0.00 ATOM 25580 H2 SOL 3492 8.280 19.160 17.860 1.00 0.00 ATOM 25581 OH2 SOL 3493 15.570 26.990 80.610 1.00 0.00 ATOM 25582 H1 SOL 3493 14.930 27.370 80.010 1.00 0.00 ATOM 25583 H2 SOL 3493 15.130 26.230 80.980 1.00 0.00 ATOM 25584 OH2 SOL 3494 58.290 11.420 13.530 1.00 0.00 ATOM 25585 H1 SOL 3494 58.770 10.650 13.850 1.00 0.00 ATOM 25586 H2 SOL 3494 58.460 12.100 14.180 1.00 0.00 ATOM 25587 OH2 SOL 3495 0.930 34.350 17.530 1.00 0.00 ATOM 25588 H1 SOL 3495 1.210 34.590 18.410 1.00 0.00 ATOM 25589 H2 SOL 3495 1.550 34.790 16.950 1.00 0.00 ATOM 25590 OH2 SOL 3496 28.370 48.590 4.910 1.00 0.00 ATOM 25591 H1 SOL 3496 28.270 48.360 5.840 1.00 0.00 ATOM 25592 H2 SOL 3496 29.070 49.240 4.900 1.00 0.00 ATOM 25593 OH2 SOL 3497 46.740 14.420 23.880 1.00 0.00 ATOM 25594 H1 SOL 3497 46.390 15.250 24.220 1.00 0.00 ATOM 25595 H2 SOL 3497 46.850 13.870 24.660 1.00 0.00 ATOM 25596 OH2 SOL 3498 17.250 13.570 80.220 1.00 0.00 ATOM 25597 H1 SOL 3498 18.150 13.350 80.010 1.00 0.00 ATOM 25598 H2 SOL 3498 16.780 13.460 79.390 1.00 0.00 ATOM 25599 OH2 SOL 3499 29.300 28.570 18.100 1.00 0.00 ATOM 25600 H1 SOL 3499 29.980 28.390 18.740 1.00 0.00 ATOM 25601 H2 SOL 3499 29.250 27.770 17.570 1.00 0.00 ATOM 25602 OH2 SOL 3500 2.940 1.430 76.690 1.00 0.00 ATOM 25603 H1 SOL 3500 3.430 0.860 76.100 1.00 0.00 ATOM 25604 H2 SOL 3500 2.830 0.910 77.490 1.00 0.00 ATOM 25605 OH2 SOL 3501 58.530 1.630 78.580 1.00 0.00 ATOM 25606 H1 SOL 3501 58.290 2.270 79.260 1.00 0.00 ATOM 25607 H2 SOL 3501 57.710 1.220 78.330 1.00 0.00 ATOM 25608 OH2 SOL 3502 25.420 4.820 78.920 1.00 0.00 ATOM 25609 H1 SOL 3502 24.790 5.280 78.380 1.00 0.00 ATOM 25610 H2 SOL 3502 24.960 4.030 79.220 1.00 0.00 ATOM 25611 OH2 SOL 3503 18.150 15.500 72.800 1.00 0.00 ATOM 25612 H1 SOL 3503 18.310 15.920 73.640 1.00 0.00 ATOM 25613 H2 SOL 3503 17.490 16.050 72.380 1.00 0.00 ATOM 25614 OH2 SOL 3504 8.020 10.940 1.400 1.00 0.00 ATOM 25615 H1 SOL 3504 7.130 10.570 1.370 1.00 0.00 ATOM 25616 H2 SOL 3504 8.090 11.310 2.280 1.00 0.00 ATOM 25617 OH2 SOL 3505 21.920 4.050 73.090 1.00 0.00 ATOM 25618 H1 SOL 3505 21.210 4.250 73.700 1.00 0.00 ATOM 25619 H2 SOL 3505 22.360 3.290 73.480 1.00 0.00 ATOM 25620 OH2 SOL 3506 16.870 47.510 4.490 1.00 0.00 ATOM 25621 H1 SOL 3506 17.770 47.840 4.470 1.00 0.00 ATOM 25622 H2 SOL 3506 16.390 48.100 3.910 1.00 0.00 ATOM 25623 OH2 SOL 3507 31.000 12.440 65.410 1.00 0.00 ATOM 25624 H1 SOL 3507 31.570 12.920 66.010 1.00 0.00 ATOM 25625 H2 SOL 3507 30.200 12.980 65.360 1.00 0.00 ATOM 25626 OH2 SOL 3508 54.680 16.830 22.290 1.00 0.00 ATOM 25627 H1 SOL 3508 54.560 15.880 22.340 1.00 0.00 ATOM 25628 H2 SOL 3508 54.000 17.120 21.680 1.00 0.00 ATOM 25629 OH2 SOL 3509 21.310 12.070 11.440 1.00 0.00 ATOM 25630 H1 SOL 3509 21.800 12.150 12.260 1.00 0.00 ATOM 25631 H2 SOL 3509 21.680 12.740 10.880 1.00 0.00 ATOM 25632 OH2 SOL 3510 22.250 40.030 67.920 1.00 0.00 ATOM 25633 H1 SOL 3510 22.290 40.420 67.050 1.00 0.00 ATOM 25634 H2 SOL 3510 21.330 40.050 68.160 1.00 0.00 ATOM 25635 OH2 SOL 3511 0.730 34.990 70.510 1.00 0.00 ATOM 25636 H1 SOL 3511 0.340 35.830 70.260 1.00 0.00 ATOM 25637 H2 SOL 3511 1.080 34.640 69.690 1.00 0.00 ATOM 25638 OH2 SOL 3512 40.630 37.110 1.040 1.00 0.00 ATOM 25639 H1 SOL 3512 40.880 36.330 1.520 1.00 0.00 ATOM 25640 H2 SOL 3512 40.800 37.830 1.650 1.00 0.00 ATOM 25641 OH2 SOL 3513 35.630 38.240 70.020 1.00 0.00 ATOM 25642 H1 SOL 3513 35.220 37.960 70.840 1.00 0.00 ATOM 25643 H2 SOL 3513 36.570 38.260 70.220 1.00 0.00 ATOM 25644 OH2 SOL 3514 7.980 26.240 79.620 1.00 0.00 ATOM 25645 H1 SOL 3514 8.110 27.150 79.360 1.00 0.00 ATOM 25646 H2 SOL 3514 7.950 26.260 80.580 1.00 0.00 ATOM 25647 OH2 SOL 3515 3.120 29.280 81.970 1.00 0.00 ATOM 25648 H1 SOL 3515 3.250 29.970 82.620 1.00 0.00 ATOM 25649 H2 SOL 3515 2.700 28.570 82.460 1.00 0.00 ATOM 25650 OH2 SOL 3516 20.930 32.890 19.950 1.00 0.00 ATOM 25651 H1 SOL 3516 20.520 33.080 19.100 1.00 0.00 ATOM 25652 H2 SOL 3516 21.400 33.690 20.170 1.00 0.00 ATOM 25653 OH2 SOL 3517 33.120 0.780 7.950 1.00 0.00 ATOM 25654 H1 SOL 3517 33.670 0.200 7.410 1.00 0.00 ATOM 25655 H2 SOL 3517 32.230 0.430 7.840 1.00 0.00 ATOM 25656 OH2 SOL 3518 46.990 4.000 73.440 1.00 0.00 ATOM 25657 H1 SOL 3518 47.710 4.610 73.250 1.00 0.00 ATOM 25658 H2 SOL 3518 46.200 4.510 73.280 1.00 0.00 ATOM 25659 OH2 SOL 3519 33.770 17.770 8.020 1.00 0.00 ATOM 25660 H1 SOL 3519 32.930 17.730 7.570 1.00 0.00 ATOM 25661 H2 SOL 3519 34.030 18.690 7.960 1.00 0.00 ATOM 25662 OH2 SOL 3520 20.090 56.410 15.140 1.00 0.00 ATOM 25663 H1 SOL 3520 20.930 56.120 14.790 1.00 0.00 ATOM 25664 H2 SOL 3520 19.480 56.320 14.400 1.00 0.00 ATOM 25665 OH2 SOL 3521 2.430 44.330 2.720 1.00 0.00 ATOM 25666 H1 SOL 3521 2.870 44.500 3.550 1.00 0.00 ATOM 25667 H2 SOL 3521 2.200 45.190 2.390 1.00 0.00 ATOM 25668 OH2 SOL 3522 -0.120 19.200 77.960 1.00 0.00 ATOM 25669 H1 SOL 3522 0.070 19.440 77.050 1.00 0.00 ATOM 25670 H2 SOL 3522 0.420 19.800 78.480 1.00 0.00 ATOM 25671 OH2 SOL 3523 37.310 28.410 78.040 1.00 0.00 ATOM 25672 H1 SOL 3523 37.840 27.730 78.470 1.00 0.00 ATOM 25673 H2 SOL 3523 37.220 28.090 77.140 1.00 0.00 ATOM 25674 OH2 SOL 3524 16.950 10.360 81.530 1.00 0.00 ATOM 25675 H1 SOL 3524 17.800 10.740 81.320 1.00 0.00 ATOM 25676 H2 SOL 3524 16.960 9.510 81.100 1.00 0.00 ATOM 25677 OH2 SOL 3525 13.110 51.630 16.410 1.00 0.00 ATOM 25678 H1 SOL 3525 12.260 51.200 16.410 1.00 0.00 ATOM 25679 H2 SOL 3525 13.500 51.390 15.560 1.00 0.00 ATOM 25680 OH2 SOL 3526 3.950 44.480 68.300 1.00 0.00 ATOM 25681 H1 SOL 3526 4.670 44.160 67.770 1.00 0.00 ATOM 25682 H2 SOL 3526 3.340 44.860 67.660 1.00 0.00 ATOM 25683 OH2 SOL 3527 18.550 47.750 65.250 1.00 0.00 ATOM 25684 H1 SOL 3527 19.120 46.990 65.290 1.00 0.00 ATOM 25685 H2 SOL 3527 17.700 47.440 65.560 1.00 0.00 ATOM 25686 OH2 SOL 3528 45.110 36.370 77.180 1.00 0.00 ATOM 25687 H1 SOL 3528 45.570 36.350 78.020 1.00 0.00 ATOM 25688 H2 SOL 3528 44.190 36.480 77.410 1.00 0.00 ATOM 25689 OH2 SOL 3529 22.980 55.360 81.350 1.00 0.00 ATOM 25690 H1 SOL 3529 23.510 55.790 82.020 1.00 0.00 ATOM 25691 H2 SOL 3529 23.320 54.470 81.310 1.00 0.00 ATOM 25692 OH2 SOL 3530 28.620 32.150 8.170 1.00 0.00 ATOM 25693 H1 SOL 3530 28.710 33.030 7.800 1.00 0.00 ATOM 25694 H2 SOL 3530 29.340 31.650 7.780 1.00 0.00 ATOM 25695 OH2 SOL 3531 6.410 42.830 5.020 1.00 0.00 ATOM 25696 H1 SOL 3531 7.310 42.950 5.330 1.00 0.00 ATOM 25697 H2 SOL 3531 6.380 43.250 4.170 1.00 0.00 ATOM 25698 OH2 SOL 3532 38.550 31.220 81.450 1.00 0.00 ATOM 25699 H1 SOL 3532 37.780 31.020 80.920 1.00 0.00 ATOM 25700 H2 SOL 3532 38.880 32.050 81.100 1.00 0.00 ATOM 25701 OH2 SOL 3533 23.940 0.800 13.010 1.00 0.00 ATOM 25702 H1 SOL 3533 23.190 0.380 12.590 1.00 0.00 ATOM 25703 H2 SOL 3533 23.690 0.880 13.930 1.00 0.00 ATOM 25704 OH2 SOL 3534 4.820 27.990 9.760 1.00 0.00 ATOM 25705 H1 SOL 3534 4.560 27.250 10.320 1.00 0.00 ATOM 25706 H2 SOL 3534 4.330 27.850 8.950 1.00 0.00 ATOM 25707 OH2 SOL 3535 27.730 7.390 67.080 1.00 0.00 ATOM 25708 H1 SOL 3535 28.540 7.320 67.580 1.00 0.00 ATOM 25709 H2 SOL 3535 27.530 6.490 66.820 1.00 0.00 ATOM 25710 OH2 SOL 3536 17.880 13.610 17.350 1.00 0.00 ATOM 25711 H1 SOL 3536 17.910 13.450 18.290 1.00 0.00 ATOM 25712 H2 SOL 3536 17.570 14.520 17.270 1.00 0.00 ATOM 25713 OH2 SOL 3537 38.130 54.530 21.870 1.00 0.00 ATOM 25714 H1 SOL 3537 38.280 53.590 21.760 1.00 0.00 ATOM 25715 H2 SOL 3537 37.190 54.610 21.980 1.00 0.00 ATOM 25716 OH2 SOL 3538 47.600 9.350 16.440 1.00 0.00 ATOM 25717 H1 SOL 3538 47.480 10.230 16.080 1.00 0.00 ATOM 25718 H2 SOL 3538 47.220 8.770 15.780 1.00 0.00 ATOM 25719 OH2 SOL 3539 34.320 32.910 83.080 1.00 0.00 ATOM 25720 H1 SOL 3539 35.080 33.320 83.480 1.00 0.00 ATOM 25721 H2 SOL 3539 33.590 33.170 83.640 1.00 0.00 ATOM 25722 OH2 SOL 3540 11.420 17.660 3.630 1.00 0.00 ATOM 25723 H1 SOL 3540 11.880 18.370 3.160 1.00 0.00 ATOM 25724 H2 SOL 3540 11.870 17.610 4.470 1.00 0.00 ATOM 25725 OH2 SOL 3541 56.110 32.220 23.990 1.00 0.00 ATOM 25726 H1 SOL 3541 56.140 31.290 23.770 1.00 0.00 ATOM 25727 H2 SOL 3541 56.100 32.250 24.950 1.00 0.00 ATOM 25728 OH2 SOL 3542 32.130 21.940 75.570 1.00 0.00 ATOM 25729 H1 SOL 3542 32.530 21.640 76.380 1.00 0.00 ATOM 25730 H2 SOL 3542 32.460 22.830 75.460 1.00 0.00 ATOM 25731 OH2 SOL 3543 6.180 1.270 68.550 1.00 0.00 ATOM 25732 H1 SOL 3543 6.170 1.000 67.630 1.00 0.00 ATOM 25733 H2 SOL 3543 6.760 2.030 68.580 1.00 0.00 ATOM 25734 OH2 SOL 3544 23.760 13.240 68.390 1.00 0.00 ATOM 25735 H1 SOL 3544 22.900 12.810 68.380 1.00 0.00 ATOM 25736 H2 SOL 3544 24.350 12.560 68.730 1.00 0.00 ATOM 25737 OH2 SOL 3545 8.690 36.860 5.060 1.00 0.00 ATOM 25738 H1 SOL 3545 8.530 36.760 6.000 1.00 0.00 ATOM 25739 H2 SOL 3545 9.380 36.230 4.870 1.00 0.00 ATOM 25740 OH2 SOL 3546 18.130 56.720 70.650 1.00 0.00 ATOM 25741 H1 SOL 3546 18.580 57.090 71.410 1.00 0.00 ATOM 25742 H2 SOL 3546 18.820 56.610 69.990 1.00 0.00 ATOM 25743 OH2 SOL 3547 56.880 26.550 12.790 1.00 0.00 ATOM 25744 H1 SOL 3547 57.290 25.790 12.390 1.00 0.00 ATOM 25745 H2 SOL 3547 56.940 26.390 13.740 1.00 0.00 ATOM 25746 OH2 SOL 3548 32.920 19.540 70.320 1.00 0.00 ATOM 25747 H1 SOL 3548 32.020 19.450 70.010 1.00 0.00 ATOM 25748 H2 SOL 3548 33.230 18.640 70.450 1.00 0.00 ATOM 25749 OH2 SOL 3549 38.660 51.710 1.480 1.00 0.00 ATOM 25750 H1 SOL 3549 37.730 51.560 1.660 1.00 0.00 ATOM 25751 H2 SOL 3549 38.890 51.050 0.830 1.00 0.00 ATOM 25752 OH2 SOL 3550 10.020 55.650 75.840 1.00 0.00 ATOM 25753 H1 SOL 3550 9.890 56.510 76.240 1.00 0.00 ATOM 25754 H2 SOL 3550 9.620 55.730 74.980 1.00 0.00 ATOM 25755 OH2 SOL 3551 34.440 4.170 77.630 1.00 0.00 ATOM 25756 H1 SOL 3551 35.360 4.190 77.920 1.00 0.00 ATOM 25757 H2 SOL 3551 34.480 3.840 76.730 1.00 0.00 ATOM 25758 OH2 SOL 3552 10.190 46.640 70.720 1.00 0.00 ATOM 25759 H1 SOL 3552 10.870 46.030 70.410 1.00 0.00 ATOM 25760 H2 SOL 3552 10.040 46.370 71.630 1.00 0.00 ATOM 25761 OH2 SOL 3553 31.460 8.470 8.570 1.00 0.00 ATOM 25762 H1 SOL 3553 31.670 7.540 8.660 1.00 0.00 ATOM 25763 H2 SOL 3553 32.190 8.920 9.000 1.00 0.00 ATOM 25764 OH2 SOL 3554 12.540 59.150 69.910 1.00 0.00 ATOM 25765 H1 SOL 3554 11.650 59.480 69.770 1.00 0.00 ATOM 25766 H2 SOL 3554 12.690 59.230 70.850 1.00 0.00 ATOM 25767 OH2 SOL 3555 35.830 4.790 74.600 1.00 0.00 ATOM 25768 H1 SOL 3555 36.690 4.640 74.990 1.00 0.00 ATOM 25769 H2 SOL 3555 35.660 5.720 74.720 1.00 0.00 ATOM 25770 OH2 SOL 3556 22.600 55.730 74.780 1.00 0.00 ATOM 25771 H1 SOL 3556 23.230 55.020 74.900 1.00 0.00 ATOM 25772 H2 SOL 3556 23.100 56.410 74.340 1.00 0.00 ATOM 25773 OH2 SOL 3557 32.340 40.590 83.040 1.00 0.00 ATOM 25774 H1 SOL 3557 31.730 39.940 82.690 1.00 0.00 ATOM 25775 H2 SOL 3557 31.810 41.370 83.200 1.00 0.00 ATOM 25776 OH2 SOL 3558 56.830 22.890 76.520 1.00 0.00 ATOM 25777 H1 SOL 3558 56.360 23.050 75.700 1.00 0.00 ATOM 25778 H2 SOL 3558 56.190 22.480 77.100 1.00 0.00 ATOM 25779 OH2 SOL 3559 58.030 59.870 67.970 1.00 0.00 ATOM 25780 H1 SOL 3559 57.730 60.450 67.260 1.00 0.00 ATOM 25781 H2 SOL 3559 58.920 60.160 68.150 1.00 0.00 ATOM 25782 OH2 SOL 3560 28.910 16.230 82.160 1.00 0.00 ATOM 25783 H1 SOL 3560 29.530 15.860 82.800 1.00 0.00 ATOM 25784 H2 SOL 3560 28.540 15.470 81.720 1.00 0.00 ATOM 25785 OH2 SOL 3561 51.530 11.970 82.880 1.00 0.00 ATOM 25786 H1 SOL 3561 52.030 12.150 83.680 1.00 0.00 ATOM 25787 H2 SOL 3561 50.760 12.530 82.960 1.00 0.00 ATOM 25788 OH2 SOL 3562 34.780 5.930 11.760 1.00 0.00 ATOM 25789 H1 SOL 3562 33.880 5.620 11.890 1.00 0.00 ATOM 25790 H2 SOL 3562 34.820 6.760 12.240 1.00 0.00 ATOM 25791 OH2 SOL 3563 24.870 19.160 62.210 1.00 0.00 ATOM 25792 H1 SOL 3563 24.900 18.490 62.890 1.00 0.00 ATOM 25793 H2 SOL 3563 24.530 19.940 62.640 1.00 0.00 ATOM 25794 OH2 SOL 3564 28.880 42.580 16.690 1.00 0.00 ATOM 25795 H1 SOL 3564 28.470 43.200 17.300 1.00 0.00 ATOM 25796 H2 SOL 3564 28.160 42.100 16.300 1.00 0.00 ATOM 25797 OH2 SOL 3565 25.050 60.840 6.880 1.00 0.00 ATOM 25798 H1 SOL 3565 25.690 61.090 6.210 1.00 0.00 ATOM 25799 H2 SOL 3565 25.540 60.270 7.470 1.00 0.00 ATOM 25800 OH2 SOL 3566 12.200 27.850 17.840 1.00 0.00 ATOM 25801 H1 SOL 3566 12.470 28.030 18.740 1.00 0.00 ATOM 25802 H2 SOL 3566 11.740 27.010 17.890 1.00 0.00 ATOM 25803 OH2 SOL 3567 15.790 3.520 12.370 1.00 0.00 ATOM 25804 H1 SOL 3567 15.750 3.290 11.450 1.00 0.00 ATOM 25805 H2 SOL 3567 16.680 3.860 12.490 1.00 0.00 ATOM 25806 OH2 SOL 3568 36.220 49.690 64.450 1.00 0.00 ATOM 25807 H1 SOL 3568 35.780 49.110 63.840 1.00 0.00 ATOM 25808 H2 SOL 3568 36.030 50.570 64.120 1.00 0.00 ATOM 25809 OH2 SOL 3569 18.570 47.140 9.910 1.00 0.00 ATOM 25810 H1 SOL 3569 19.500 47.110 9.680 1.00 0.00 ATOM 25811 H2 SOL 3569 18.110 47.140 9.060 1.00 0.00 ATOM 25812 OH2 SOL 3570 43.930 44.300 82.340 1.00 0.00 ATOM 25813 H1 SOL 3570 43.180 44.810 82.650 1.00 0.00 ATOM 25814 H2 SOL 3570 43.570 43.430 82.160 1.00 0.00 ATOM 25815 OH2 SOL 3571 37.700 50.200 25.340 1.00 0.00 ATOM 25816 H1 SOL 3571 37.020 50.000 24.710 1.00 0.00 ATOM 25817 H2 SOL 3571 38.140 49.360 25.500 1.00 0.00 ATOM 25818 OH2 SOL 3572 47.030 10.140 27.050 1.00 0.00 ATOM 25819 H1 SOL 3572 47.070 9.350 26.500 1.00 0.00 ATOM 25820 H2 SOL 3572 47.040 9.810 27.950 1.00 0.00 ATOM 25821 OH2 SOL 3573 5.080 26.710 65.220 1.00 0.00 ATOM 25822 H1 SOL 3573 4.730 26.760 66.110 1.00 0.00 ATOM 25823 H2 SOL 3573 4.460 27.200 64.690 1.00 0.00 ATOM 25824 OH2 SOL 3574 38.270 57.220 2.050 1.00 0.00 ATOM 25825 H1 SOL 3574 38.640 56.550 2.630 1.00 0.00 ATOM 25826 H2 SOL 3574 38.940 57.900 2.010 1.00 0.00 ATOM 25827 OH2 SOL 3575 20.420 14.760 0.200 1.00 0.00 ATOM 25828 H1 SOL 3575 19.850 14.720 0.970 1.00 0.00 ATOM 25829 H2 SOL 3575 20.170 15.570 -0.240 1.00 0.00 ATOM 25830 OH2 SOL 3576 43.120 59.750 70.380 1.00 0.00 ATOM 25831 H1 SOL 3576 43.100 60.180 71.240 1.00 0.00 ATOM 25832 H2 SOL 3576 42.200 59.710 70.110 1.00 0.00 ATOM 25833 OH2 SOL 3577 24.660 49.400 1.250 1.00 0.00 ATOM 25834 H1 SOL 3577 24.900 50.290 1.000 1.00 0.00 ATOM 25835 H2 SOL 3577 23.850 49.230 0.760 1.00 0.00 ATOM 25836 OH2 SOL 3578 46.110 50.600 65.680 1.00 0.00 ATOM 25837 H1 SOL 3578 46.550 51.000 64.930 1.00 0.00 ATOM 25838 H2 SOL 3578 46.660 49.860 65.910 1.00 0.00 ATOM 25839 OH2 SOL 3579 36.160 35.290 16.240 1.00 0.00 ATOM 25840 H1 SOL 3579 35.870 34.710 16.940 1.00 0.00 ATOM 25841 H2 SOL 3579 36.660 34.720 15.650 1.00 0.00 ATOM 25842 OH2 SOL 3580 32.610 44.720 8.140 1.00 0.00 ATOM 25843 H1 SOL 3580 31.750 45.130 8.060 1.00 0.00 ATOM 25844 H2 SOL 3580 32.430 43.780 8.060 1.00 0.00 ATOM 25845 OH2 SOL 3581 29.460 20.780 76.750 1.00 0.00 ATOM 25846 H1 SOL 3581 29.220 21.700 76.690 1.00 0.00 ATOM 25847 H2 SOL 3581 28.670 20.310 76.450 1.00 0.00 ATOM 25848 OH2 SOL 3582 41.780 9.650 25.140 1.00 0.00 ATOM 25849 H1 SOL 3582 41.640 10.330 24.470 1.00 0.00 ATOM 25850 H2 SOL 3582 42.730 9.530 25.150 1.00 0.00 ATOM 25851 OH2 SOL 3583 43.060 2.720 8.170 1.00 0.00 ATOM 25852 H1 SOL 3583 42.310 2.910 7.600 1.00 0.00 ATOM 25853 H2 SOL 3583 43.820 2.920 7.630 1.00 0.00 ATOM 25854 OH2 SOL 3584 19.230 30.660 76.770 1.00 0.00 ATOM 25855 H1 SOL 3584 19.000 30.380 77.660 1.00 0.00 ATOM 25856 H2 SOL 3584 19.410 29.850 76.300 1.00 0.00 ATOM 25857 OH2 SOL 3585 14.700 41.090 12.580 1.00 0.00 ATOM 25858 H1 SOL 3585 14.600 41.760 13.250 1.00 0.00 ATOM 25859 H2 SOL 3585 15.250 40.420 13.000 1.00 0.00 ATOM 25860 OH2 SOL 3586 11.810 42.070 5.230 1.00 0.00 ATOM 25861 H1 SOL 3586 12.760 42.010 5.110 1.00 0.00 ATOM 25862 H2 SOL 3586 11.440 41.800 4.390 1.00 0.00 ATOM 25863 OH2 SOL 3587 26.360 20.840 76.140 1.00 0.00 ATOM 25864 H1 SOL 3587 26.340 21.740 76.460 1.00 0.00 ATOM 25865 H2 SOL 3587 25.830 20.350 76.780 1.00 0.00 ATOM 25866 OH2 SOL 3588 53.430 24.610 83.030 1.00 0.00 ATOM 25867 H1 SOL 3588 53.590 25.190 82.280 1.00 0.00 ATOM 25868 H2 SOL 3588 53.260 23.760 82.650 1.00 0.00 ATOM 25869 OH2 SOL 3589 33.870 14.080 13.730 1.00 0.00 ATOM 25870 H1 SOL 3589 33.370 14.810 14.100 1.00 0.00 ATOM 25871 H2 SOL 3589 34.040 14.350 12.820 1.00 0.00 ATOM 25872 OH2 SOL 3590 58.540 59.980 73.720 1.00 0.00 ATOM 25873 H1 SOL 3590 58.520 59.770 72.780 1.00 0.00 ATOM 25874 H2 SOL 3590 58.330 60.910 73.760 1.00 0.00 ATOM 25875 OH2 SOL 3591 24.790 58.820 19.710 1.00 0.00 ATOM 25876 H1 SOL 3591 25.400 59.320 19.170 1.00 0.00 ATOM 25877 H2 SOL 3591 24.850 59.230 20.580 1.00 0.00 ATOM 25878 OH2 SOL 3592 6.110 60.300 79.570 1.00 0.00 ATOM 25879 H1 SOL 3592 5.800 61.200 79.700 1.00 0.00 ATOM 25880 H2 SOL 3592 6.390 60.020 80.440 1.00 0.00 ATOM 25881 OH2 SOL 3593 52.350 50.290 9.850 1.00 0.00 ATOM 25882 H1 SOL 3593 53.100 49.900 9.400 1.00 0.00 ATOM 25883 H2 SOL 3593 52.710 51.070 10.270 1.00 0.00 ATOM 25884 OH2 SOL 3594 49.070 50.720 67.480 1.00 0.00 ATOM 25885 H1 SOL 3594 49.120 50.800 66.530 1.00 0.00 ATOM 25886 H2 SOL 3594 49.350 51.570 67.810 1.00 0.00 ATOM 25887 OH2 SOL 3595 54.770 7.120 7.480 1.00 0.00 ATOM 25888 H1 SOL 3595 55.520 6.820 6.970 1.00 0.00 ATOM 25889 H2 SOL 3595 54.900 8.060 7.580 1.00 0.00 ATOM 25890 OH2 SOL 3596 44.460 60.740 5.940 1.00 0.00 ATOM 25891 H1 SOL 3596 44.920 61.500 6.300 1.00 0.00 ATOM 25892 H2 SOL 3596 44.640 60.040 6.560 1.00 0.00 ATOM 25893 OH2 SOL 3597 34.150 56.510 73.910 1.00 0.00 ATOM 25894 H1 SOL 3597 34.440 56.010 73.150 1.00 0.00 ATOM 25895 H2 SOL 3597 34.350 57.420 73.700 1.00 0.00 ATOM 25896 OH2 SOL 3598 26.240 19.310 4.130 1.00 0.00 ATOM 25897 H1 SOL 3598 27.010 19.050 4.630 1.00 0.00 ATOM 25898 H2 SOL 3598 26.430 20.190 3.820 1.00 0.00 ATOM 25899 OH2 SOL 3599 42.750 31.010 1.300 1.00 0.00 ATOM 25900 H1 SOL 3599 42.830 31.690 0.630 1.00 0.00 ATOM 25901 H2 SOL 3599 43.030 30.210 0.850 1.00 0.00 ATOM 25902 OH2 SOL 3600 53.240 5.100 5.450 1.00 0.00 ATOM 25903 H1 SOL 3600 54.100 5.280 5.820 1.00 0.00 ATOM 25904 H2 SOL 3600 52.940 5.950 5.110 1.00 0.00 ATOM 25905 OH2 SOL 3601 19.670 40.210 10.720 1.00 0.00 ATOM 25906 H1 SOL 3601 19.860 40.700 11.520 1.00 0.00 ATOM 25907 H2 SOL 3601 18.730 40.340 10.580 1.00 0.00 ATOM 25908 OH2 SOL 3602 36.040 38.290 16.500 1.00 0.00 ATOM 25909 H1 SOL 3602 35.520 38.930 16.010 1.00 0.00 ATOM 25910 H2 SOL 3602 35.780 37.440 16.150 1.00 0.00 ATOM 25911 OH2 SOL 3603 29.040 47.950 16.410 1.00 0.00 ATOM 25912 H1 SOL 3603 29.830 47.500 16.110 1.00 0.00 ATOM 25913 H2 SOL 3603 29.160 48.860 16.140 1.00 0.00 ATOM 25914 OH2 SOL 3604 22.140 54.700 11.290 1.00 0.00 ATOM 25915 H1 SOL 3604 21.430 55.330 11.130 1.00 0.00 ATOM 25916 H2 SOL 3604 21.850 53.900 10.860 1.00 0.00 ATOM 25917 OH2 SOL 3605 6.940 34.500 4.560 1.00 0.00 ATOM 25918 H1 SOL 3605 6.030 34.440 4.280 1.00 0.00 ATOM 25919 H2 SOL 3605 7.150 35.440 4.510 1.00 0.00 ATOM 25920 OH2 SOL 3606 26.940 45.720 74.840 1.00 0.00 ATOM 25921 H1 SOL 3606 26.480 45.330 75.580 1.00 0.00 ATOM 25922 H2 SOL 3606 26.280 46.240 74.390 1.00 0.00 ATOM 25923 OH2 SOL 3607 57.310 25.580 76.180 1.00 0.00 ATOM 25924 H1 SOL 3607 57.420 24.640 76.360 1.00 0.00 ATOM 25925 H2 SOL 3607 56.400 25.660 75.880 1.00 0.00 ATOM 25926 OH2 SOL 3608 59.000 15.400 4.690 1.00 0.00 ATOM 25927 H1 SOL 3608 59.730 15.970 4.920 1.00 0.00 ATOM 25928 H2 SOL 3608 58.260 15.740 5.200 1.00 0.00 ATOM 25929 OH2 SOL 3609 57.470 41.940 65.340 1.00 0.00 ATOM 25930 H1 SOL 3609 58.260 42.260 64.900 1.00 0.00 ATOM 25931 H2 SOL 3609 57.800 41.340 66.010 1.00 0.00 ATOM 25932 OH2 SOL 3610 13.100 4.430 64.390 1.00 0.00 ATOM 25933 H1 SOL 3610 12.510 3.880 63.880 1.00 0.00 ATOM 25934 H2 SOL 3610 12.920 4.200 65.300 1.00 0.00 ATOM 25935 OH2 SOL 3611 57.090 15.590 22.100 1.00 0.00 ATOM 25936 H1 SOL 3611 56.550 16.370 21.980 1.00 0.00 ATOM 25937 H2 SOL 3611 57.480 15.710 22.960 1.00 0.00 ATOM 25938 OH2 SOL 3612 21.280 0.610 11.900 1.00 0.00 ATOM 25939 H1 SOL 3612 21.350 1.200 11.150 1.00 0.00 ATOM 25940 H2 SOL 3612 20.740 -0.120 11.590 1.00 0.00 ATOM 25941 OH2 SOL 3613 5.130 37.490 70.480 1.00 0.00 ATOM 25942 H1 SOL 3613 5.070 37.530 69.530 1.00 0.00 ATOM 25943 H2 SOL 3613 5.710 38.220 70.720 1.00 0.00 ATOM 25944 OH2 SOL 3614 39.480 28.280 1.350 1.00 0.00 ATOM 25945 H1 SOL 3614 40.010 28.940 1.800 1.00 0.00 ATOM 25946 H2 SOL 3614 40.110 27.820 0.790 1.00 0.00 ATOM 25947 OH2 SOL 3615 57.670 39.410 25.250 1.00 0.00 ATOM 25948 H1 SOL 3615 57.550 40.240 25.710 1.00 0.00 ATOM 25949 H2 SOL 3615 58.440 39.550 24.710 1.00 0.00 ATOM 25950 OH2 SOL 3616 55.170 8.480 65.870 1.00 0.00 ATOM 25951 H1 SOL 3616 55.470 9.280 65.430 1.00 0.00 ATOM 25952 H2 SOL 3616 54.240 8.410 65.630 1.00 0.00 ATOM 25953 OH2 SOL 3617 1.190 7.450 16.190 1.00 0.00 ATOM 25954 H1 SOL 3617 1.260 6.520 16.370 1.00 0.00 ATOM 25955 H2 SOL 3617 1.970 7.840 16.600 1.00 0.00 ATOM 25956 OH2 SOL 3618 48.500 15.370 4.280 1.00 0.00 ATOM 25957 H1 SOL 3618 48.630 16.200 4.750 1.00 0.00 ATOM 25958 H2 SOL 3618 47.610 15.110 4.480 1.00 0.00 ATOM 25959 OH2 SOL 3619 46.310 11.110 81.480 1.00 0.00 ATOM 25960 H1 SOL 3619 46.800 10.780 80.730 1.00 0.00 ATOM 25961 H2 SOL 3619 46.570 12.030 81.560 1.00 0.00 ATOM 25962 OH2 SOL 3620 26.910 20.210 18.410 1.00 0.00 ATOM 25963 H1 SOL 3620 26.170 20.810 18.430 1.00 0.00 ATOM 25964 H2 SOL 3620 27.480 20.510 19.120 1.00 0.00 ATOM 25965 OH2 SOL 3621 26.860 4.730 66.590 1.00 0.00 ATOM 25966 H1 SOL 3621 25.970 4.770 66.940 1.00 0.00 ATOM 25967 H2 SOL 3621 26.920 3.870 66.190 1.00 0.00 ATOM 25968 OH2 SOL 3622 30.920 0.550 68.930 1.00 0.00 ATOM 25969 H1 SOL 3622 30.610 0.700 68.040 1.00 0.00 ATOM 25970 H2 SOL 3622 31.370 1.360 69.170 1.00 0.00 ATOM 25971 OH2 SOL 3623 12.680 32.630 2.800 1.00 0.00 ATOM 25972 H1 SOL 3623 13.140 31.820 2.620 1.00 0.00 ATOM 25973 H2 SOL 3623 12.180 32.810 2.000 1.00 0.00 ATOM 25974 OH2 SOL 3624 41.080 51.160 82.430 1.00 0.00 ATOM 25975 H1 SOL 3624 40.790 50.790 81.590 1.00 0.00 ATOM 25976 H2 SOL 3624 41.840 50.630 82.670 1.00 0.00 ATOM 25977 OH2 SOL 3625 37.940 20.340 2.760 1.00 0.00 ATOM 25978 H1 SOL 3625 37.510 20.820 2.050 1.00 0.00 ATOM 25979 H2 SOL 3625 37.580 20.730 3.560 1.00 0.00 ATOM 25980 OH2 SOL 3626 27.980 35.600 9.010 1.00 0.00 ATOM 25981 H1 SOL 3626 27.450 34.820 8.890 1.00 0.00 ATOM 25982 H2 SOL 3626 27.410 36.330 8.760 1.00 0.00 ATOM 25983 OH2 SOL 3627 50.170 25.000 83.960 1.00 0.00 ATOM 25984 H1 SOL 3627 50.210 24.430 83.200 1.00 0.00 ATOM 25985 H2 SOL 3627 51.090 25.130 84.210 1.00 0.00 ATOM 25986 OH2 SOL 3628 15.220 29.970 21.210 1.00 0.00 ATOM 25987 H1 SOL 3628 14.880 29.690 22.060 1.00 0.00 ATOM 25988 H2 SOL 3628 15.910 30.600 21.420 1.00 0.00 ATOM 25989 OH2 SOL 3629 19.420 6.800 73.030 1.00 0.00 ATOM 25990 H1 SOL 3629 18.690 6.970 72.440 1.00 0.00 ATOM 25991 H2 SOL 3629 19.850 7.650 73.120 1.00 0.00 ATOM 25992 OH2 SOL 3630 11.960 58.350 15.640 1.00 0.00 ATOM 25993 H1 SOL 3630 12.110 57.450 15.350 1.00 0.00 ATOM 25994 H2 SOL 3630 12.830 58.760 15.590 1.00 0.00 ATOM 25995 OH2 SOL 3631 18.460 48.680 13.270 1.00 0.00 ATOM 25996 H1 SOL 3631 19.320 48.370 12.980 1.00 0.00 ATOM 25997 H2 SOL 3631 18.430 49.590 12.990 1.00 0.00 ATOM 25998 OH2 SOL 3632 21.760 5.440 8.540 1.00 0.00 ATOM 25999 H1 SOL 3632 20.880 5.280 8.870 1.00 0.00 ATOM 26000 H2 SOL 3632 22.020 6.280 8.930 1.00 0.00 ATOM 26001 OH2 SOL 3633 30.700 10.640 3.680 1.00 0.00 ATOM 26002 H1 SOL 3633 30.610 10.690 4.630 1.00 0.00 ATOM 26003 H2 SOL 3633 30.130 11.330 3.340 1.00 0.00 ATOM 26004 OH2 SOL 3634 10.220 40.490 19.450 1.00 0.00 ATOM 26005 H1 SOL 3634 9.430 40.100 19.070 1.00 0.00 ATOM 26006 H2 SOL 3634 10.130 40.370 20.390 1.00 0.00 ATOM 26007 OH2 SOL 3635 46.440 31.140 17.720 1.00 0.00 ATOM 26008 H1 SOL 3635 46.710 31.820 17.110 1.00 0.00 ATOM 26009 H2 SOL 3635 45.490 31.250 17.790 1.00 0.00 ATOM 26010 OH2 SOL 3636 17.880 20.210 66.010 1.00 0.00 ATOM 26011 H1 SOL 3636 17.870 19.390 66.510 1.00 0.00 ATOM 26012 H2 SOL 3636 17.980 19.940 65.100 1.00 0.00 ATOM 26013 OH2 SOL 3637 3.230 45.240 11.450 1.00 0.00 ATOM 26014 H1 SOL 3637 4.090 45.330 11.050 1.00 0.00 ATOM 26015 H2 SOL 3637 3.350 44.580 12.130 1.00 0.00 ATOM 26016 OH2 SOL 3638 53.410 33.330 84.180 1.00 0.00 ATOM 26017 H1 SOL 3638 53.290 34.270 84.030 1.00 0.00 ATOM 26018 H2 SOL 3638 53.570 33.260 85.130 1.00 0.00 ATOM 26019 OH2 SOL 3639 32.000 57.570 7.460 1.00 0.00 ATOM 26020 H1 SOL 3639 32.580 57.700 8.210 1.00 0.00 ATOM 26021 H2 SOL 3639 32.580 57.500 6.710 1.00 0.00 ATOM 26022 OH2 SOL 3640 16.440 46.080 16.140 1.00 0.00 ATOM 26023 H1 SOL 3640 17.230 46.570 15.920 1.00 0.00 ATOM 26024 H2 SOL 3640 16.750 45.200 16.310 1.00 0.00 ATOM 26025 OH2 SOL 3641 16.270 51.010 5.560 1.00 0.00 ATOM 26026 H1 SOL 3641 15.510 50.460 5.770 1.00 0.00 ATOM 26027 H2 SOL 3641 17.020 50.540 5.930 1.00 0.00 ATOM 26028 OH2 SOL 3642 3.810 13.410 59.700 1.00 0.00 ATOM 26029 H1 SOL 3642 3.630 12.550 60.080 1.00 0.00 ATOM 26030 H2 SOL 3642 3.190 14.000 60.130 1.00 0.00 ATOM 26031 OH2 SOL 3643 10.150 16.180 66.130 1.00 0.00 ATOM 26032 H1 SOL 3643 9.270 16.050 65.760 1.00 0.00 ATOM 26033 H2 SOL 3643 10.300 15.390 66.650 1.00 0.00 ATOM 26034 OH2 SOL 3644 2.730 2.220 10.820 1.00 0.00 ATOM 26035 H1 SOL 3644 3.040 2.650 10.020 1.00 0.00 ATOM 26036 H2 SOL 3644 2.770 1.290 10.630 1.00 0.00 ATOM 26037 OH2 SOL 3645 28.340 21.380 20.590 1.00 0.00 ATOM 26038 H1 SOL 3645 27.590 21.810 20.990 1.00 0.00 ATOM 26039 H2 SOL 3645 29.020 22.060 20.560 1.00 0.00 ATOM 26040 OH2 SOL 3646 46.250 27.490 16.720 1.00 0.00 ATOM 26041 H1 SOL 3646 46.070 26.660 16.290 1.00 0.00 ATOM 26042 H2 SOL 3646 45.950 27.370 17.620 1.00 0.00 ATOM 26043 OH2 SOL 3647 52.430 55.790 13.840 1.00 0.00 ATOM 26044 H1 SOL 3647 53.290 55.800 14.270 1.00 0.00 ATOM 26045 H2 SOL 3647 51.920 56.450 14.300 1.00 0.00 ATOM 26046 OH2 SOL 3648 48.160 57.190 1.860 1.00 0.00 ATOM 26047 H1 SOL 3648 48.940 56.800 1.470 1.00 0.00 ATOM 26048 H2 SOL 3648 47.980 57.950 1.300 1.00 0.00 ATOM 26049 OH2 SOL 3649 22.470 20.650 60.220 1.00 0.00 ATOM 26050 H1 SOL 3649 22.150 20.830 59.330 1.00 0.00 ATOM 26051 H2 SOL 3649 22.810 19.760 60.180 1.00 0.00 ATOM 26052 OH2 SOL 3650 21.830 31.850 8.510 1.00 0.00 ATOM 26053 H1 SOL 3650 21.070 31.320 8.290 1.00 0.00 ATOM 26054 H2 SOL 3650 21.860 31.850 9.470 1.00 0.00 ATOM 26055 OH2 SOL 3651 7.020 55.060 13.230 1.00 0.00 ATOM 26056 H1 SOL 3651 7.520 54.940 12.430 1.00 0.00 ATOM 26057 H2 SOL 3651 6.510 55.850 13.090 1.00 0.00 ATOM 26058 OH2 SOL 3652 40.320 36.540 76.000 1.00 0.00 ATOM 26059 H1 SOL 3652 39.910 36.970 75.250 1.00 0.00 ATOM 26060 H2 SOL 3652 40.360 37.220 76.670 1.00 0.00 ATOM 26061 OH2 SOL 3653 36.680 11.990 67.430 1.00 0.00 ATOM 26062 H1 SOL 3653 36.460 11.140 67.030 1.00 0.00 ATOM 26063 H2 SOL 3653 36.130 12.040 68.210 1.00 0.00 ATOM 26064 OH2 SOL 3654 34.100 16.900 69.700 1.00 0.00 ATOM 26065 H1 SOL 3654 34.860 16.380 69.440 1.00 0.00 ATOM 26066 H2 SOL 3654 33.510 16.270 70.120 1.00 0.00 ATOM 26067 OH2 SOL 3655 8.740 33.330 13.980 1.00 0.00 ATOM 26068 H1 SOL 3655 8.010 32.730 13.840 1.00 0.00 ATOM 26069 H2 SOL 3655 8.780 33.850 13.180 1.00 0.00 ATOM 26070 OH2 SOL 3656 39.650 55.400 3.330 1.00 0.00 ATOM 26071 H1 SOL 3656 39.770 54.960 2.480 1.00 0.00 ATOM 26072 H2 SOL 3656 40.480 55.860 3.470 1.00 0.00 ATOM 26073 OH2 SOL 3657 18.900 6.580 80.320 1.00 0.00 ATOM 26074 H1 SOL 3657 18.930 7.010 79.470 1.00 0.00 ATOM 26075 H2 SOL 3657 17.970 6.400 80.470 1.00 0.00 ATOM 26076 OH2 SOL 3658 13.630 6.900 9.160 1.00 0.00 ATOM 26077 H1 SOL 3658 13.580 6.660 10.090 1.00 0.00 ATOM 26078 H2 SOL 3658 14.330 7.550 9.120 1.00 0.00 ATOM 26079 OH2 SOL 3659 5.220 38.510 6.340 1.00 0.00 ATOM 26080 H1 SOL 3659 5.810 39.260 6.250 1.00 0.00 ATOM 26081 H2 SOL 3659 5.380 37.990 5.550 1.00 0.00 ATOM 26082 OH2 SOL 3660 46.930 57.890 5.520 1.00 0.00 ATOM 26083 H1 SOL 3660 46.110 58.220 5.170 1.00 0.00 ATOM 26084 H2 SOL 3660 47.600 58.190 4.900 1.00 0.00 ATOM 26085 OH2 SOL 3661 39.910 32.080 7.000 1.00 0.00 ATOM 26086 H1 SOL 3661 40.830 31.920 6.800 1.00 0.00 ATOM 26087 H2 SOL 3661 39.430 31.560 6.360 1.00 0.00 ATOM 26088 OH2 SOL 3662 33.460 7.840 62.070 1.00 0.00 ATOM 26089 H1 SOL 3662 33.650 8.740 61.820 1.00 0.00 ATOM 26090 H2 SOL 3662 32.980 7.470 61.330 1.00 0.00 ATOM 26091 OH2 SOL 3663 26.820 16.670 22.490 1.00 0.00 ATOM 26092 H1 SOL 3663 27.470 15.970 22.520 1.00 0.00 ATOM 26093 H2 SOL 3663 27.260 17.370 22.010 1.00 0.00 ATOM 26094 OH2 SOL 3664 47.060 39.520 14.750 1.00 0.00 ATOM 26095 H1 SOL 3664 46.510 39.440 15.530 1.00 0.00 ATOM 26096 H2 SOL 3664 46.850 40.380 14.390 1.00 0.00 ATOM 26097 OH2 SOL 3665 34.690 8.460 69.320 1.00 0.00 ATOM 26098 H1 SOL 3665 34.730 9.360 69.630 1.00 0.00 ATOM 26099 H2 SOL 3665 35.520 8.070 69.610 1.00 0.00 ATOM 26100 OH2 SOL 3666 27.170 39.730 74.490 1.00 0.00 ATOM 26101 H1 SOL 3666 27.280 40.680 74.530 1.00 0.00 ATOM 26102 H2 SOL 3666 27.460 39.490 73.610 1.00 0.00 ATOM 26103 OH2 SOL 3667 40.110 39.740 80.750 1.00 0.00 ATOM 26104 H1 SOL 3667 39.610 38.960 80.990 1.00 0.00 ATOM 26105 H2 SOL 3667 39.490 40.280 80.260 1.00 0.00 ATOM 26106 OH2 SOL 3668 37.360 32.300 8.940 1.00 0.00 ATOM 26107 H1 SOL 3668 37.370 31.590 8.300 1.00 0.00 ATOM 26108 H2 SOL 3668 38.180 32.190 9.430 1.00 0.00 ATOM 26109 OH2 SOL 3669 25.110 35.040 73.130 1.00 0.00 ATOM 26110 H1 SOL 3669 25.030 35.760 72.510 1.00 0.00 ATOM 26111 H2 SOL 3669 25.060 35.470 73.990 1.00 0.00 ATOM 26112 OH2 SOL 3670 34.600 53.250 82.810 1.00 0.00 ATOM 26113 H1 SOL 3670 35.300 52.610 82.630 1.00 0.00 ATOM 26114 H2 SOL 3670 34.440 53.660 81.970 1.00 0.00 ATOM 26115 OH2 SOL 3671 13.940 26.420 75.410 1.00 0.00 ATOM 26116 H1 SOL 3671 13.210 25.860 75.160 1.00 0.00 ATOM 26117 H2 SOL 3671 14.010 27.060 74.700 1.00 0.00 ATOM 26118 OH2 SOL 3672 7.590 48.150 73.660 1.00 0.00 ATOM 26119 H1 SOL 3672 6.890 48.720 73.990 1.00 0.00 ATOM 26120 H2 SOL 3672 7.520 47.360 74.200 1.00 0.00 ATOM 26121 OH2 SOL 3673 56.860 37.110 73.130 1.00 0.00 ATOM 26122 H1 SOL 3673 57.790 37.330 73.160 1.00 0.00 ATOM 26123 H2 SOL 3673 56.600 37.010 74.050 1.00 0.00 ATOM 26124 OH2 SOL 3674 26.550 5.340 16.600 1.00 0.00 ATOM 26125 H1 SOL 3674 26.720 4.550 16.090 1.00 0.00 ATOM 26126 H2 SOL 3674 25.730 5.160 17.060 1.00 0.00 ATOM 26127 OH2 SOL 3675 16.680 6.170 27.090 1.00 0.00 ATOM 26128 H1 SOL 3675 17.510 6.620 27.260 1.00 0.00 ATOM 26129 H2 SOL 3675 16.010 6.820 27.280 1.00 0.00 ATOM 26130 OH2 SOL 3676 28.070 9.910 11.570 1.00 0.00 ATOM 26131 H1 SOL 3676 28.420 10.770 11.780 1.00 0.00 ATOM 26132 H2 SOL 3676 28.840 9.370 11.420 1.00 0.00 ATOM 26133 OH2 SOL 3677 38.120 43.500 3.050 1.00 0.00 ATOM 26134 H1 SOL 3677 37.780 44.040 3.760 1.00 0.00 ATOM 26135 H2 SOL 3677 38.350 44.120 2.360 1.00 0.00 ATOM 26136 OH2 SOL 3678 27.150 21.750 65.200 1.00 0.00 ATOM 26137 H1 SOL 3678 26.470 22.010 65.820 1.00 0.00 ATOM 26138 H2 SOL 3678 27.660 22.550 65.060 1.00 0.00 ATOM 26139 OH2 SOL 3679 45.220 10.790 67.380 1.00 0.00 ATOM 26140 H1 SOL 3679 44.860 9.970 67.030 1.00 0.00 ATOM 26141 H2 SOL 3679 45.950 10.990 66.790 1.00 0.00 ATOM 26142 OH2 SOL 3680 2.510 15.230 65.830 1.00 0.00 ATOM 26143 H1 SOL 3680 2.980 14.810 66.560 1.00 0.00 ATOM 26144 H2 SOL 3680 1.750 14.670 65.690 1.00 0.00 ATOM 26145 OH2 SOL 3681 24.030 47.650 23.550 1.00 0.00 ATOM 26146 H1 SOL 3681 23.760 47.020 24.220 1.00 0.00 ATOM 26147 H2 SOL 3681 24.570 47.130 22.950 1.00 0.00 ATOM 26148 OH2 SOL 3682 9.300 15.650 74.070 1.00 0.00 ATOM 26149 H1 SOL 3682 9.840 16.080 74.730 1.00 0.00 ATOM 26150 H2 SOL 3682 9.900 15.460 73.350 1.00 0.00 ATOM 26151 OH2 SOL 3683 50.700 38.420 9.570 1.00 0.00 ATOM 26152 H1 SOL 3683 50.990 37.650 9.090 1.00 0.00 ATOM 26153 H2 SOL 3683 51.470 38.710 10.050 1.00 0.00 ATOM 26154 OH2 SOL 3684 7.250 48.460 69.110 1.00 0.00 ATOM 26155 H1 SOL 3684 6.920 48.190 69.970 1.00 0.00 ATOM 26156 H2 SOL 3684 7.990 49.030 69.310 1.00 0.00 ATOM 26157 OH2 SOL 3685 53.810 30.490 17.960 1.00 0.00 ATOM 26158 H1 SOL 3685 53.540 30.860 17.120 1.00 0.00 ATOM 26159 H2 SOL 3685 54.660 30.890 18.130 1.00 0.00 ATOM 26160 OH2 SOL 3686 5.050 14.690 57.670 1.00 0.00 ATOM 26161 H1 SOL 3686 4.840 14.000 57.040 1.00 0.00 ATOM 26162 H2 SOL 3686 4.680 14.380 58.500 1.00 0.00 ATOM 26163 OH2 SOL 3687 56.130 33.080 82.260 1.00 0.00 ATOM 26164 H1 SOL 3687 55.250 33.020 82.610 1.00 0.00 ATOM 26165 H2 SOL 3687 56.360 32.170 82.040 1.00 0.00 ATOM 26166 OH2 SOL 3688 12.270 47.140 3.200 1.00 0.00 ATOM 26167 H1 SOL 3688 12.800 46.410 3.530 1.00 0.00 ATOM 26168 H2 SOL 3688 12.230 47.000 2.250 1.00 0.00 ATOM 26169 OH2 SOL 3689 38.300 6.000 59.850 1.00 0.00 ATOM 26170 H1 SOL 3689 38.100 6.300 58.970 1.00 0.00 ATOM 26171 H2 SOL 3689 37.520 6.220 60.360 1.00 0.00 ATOM 26172 OH2 SOL 3690 38.600 32.180 74.070 1.00 0.00 ATOM 26173 H1 SOL 3690 39.480 31.810 74.070 1.00 0.00 ATOM 26174 H2 SOL 3690 38.650 32.920 74.670 1.00 0.00 ATOM 26175 OH2 SOL 3691 31.130 48.870 71.630 1.00 0.00 ATOM 26176 H1 SOL 3691 30.450 48.980 72.300 1.00 0.00 ATOM 26177 H2 SOL 3691 30.730 48.290 70.980 1.00 0.00 ATOM 26178 OH2 SOL 3692 50.880 20.270 8.580 1.00 0.00 ATOM 26179 H1 SOL 3692 50.970 21.190 8.350 1.00 0.00 ATOM 26180 H2 SOL 3692 49.930 20.120 8.630 1.00 0.00 ATOM 26181 OH2 SOL 3693 23.330 24.120 69.600 1.00 0.00 ATOM 26182 H1 SOL 3693 22.380 24.010 69.560 1.00 0.00 ATOM 26183 H2 SOL 3693 23.570 23.890 70.490 1.00 0.00 ATOM 26184 OH2 SOL 3694 25.980 5.290 21.040 1.00 0.00 ATOM 26185 H1 SOL 3694 26.830 5.180 21.450 1.00 0.00 ATOM 26186 H2 SOL 3694 25.520 5.930 21.580 1.00 0.00 ATOM 26187 OH2 SOL 3695 43.640 41.320 17.990 1.00 0.00 ATOM 26188 H1 SOL 3695 43.460 41.670 17.110 1.00 0.00 ATOM 26189 H2 SOL 3695 43.150 41.900 18.570 1.00 0.00 ATOM 26190 OH2 SOL 3696 41.160 53.460 69.210 1.00 0.00 ATOM 26191 H1 SOL 3696 41.480 53.810 68.380 1.00 0.00 ATOM 26192 H2 SOL 3696 41.070 52.520 69.060 1.00 0.00 ATOM 26193 OH2 SOL 3697 47.350 16.720 18.420 1.00 0.00 ATOM 26194 H1 SOL 3697 46.590 17.270 18.590 1.00 0.00 ATOM 26195 H2 SOL 3697 47.420 16.160 19.200 1.00 0.00 ATOM 26196 OH2 SOL 3698 4.990 31.180 78.970 1.00 0.00 ATOM 26197 H1 SOL 3698 5.110 30.400 78.420 1.00 0.00 ATOM 26198 H2 SOL 3698 4.090 31.450 78.810 1.00 0.00 ATOM 26199 OH2 SOL 3699 51.930 5.650 17.600 1.00 0.00 ATOM 26200 H1 SOL 3699 51.900 5.700 16.640 1.00 0.00 ATOM 26201 H2 SOL 3699 52.500 4.900 17.780 1.00 0.00 ATOM 26202 OH2 SOL 3700 7.780 4.350 3.390 1.00 0.00 ATOM 26203 H1 SOL 3700 7.760 3.490 3.790 1.00 0.00 ATOM 26204 H2 SOL 3700 7.830 4.960 4.120 1.00 0.00 ATOM 26205 OH2 SOL 3701 15.300 2.570 14.840 1.00 0.00 ATOM 26206 H1 SOL 3701 16.050 1.980 14.910 1.00 0.00 ATOM 26207 H2 SOL 3701 15.400 2.990 13.990 1.00 0.00 ATOM 26208 OH2 SOL 3702 47.950 34.470 67.500 1.00 0.00 ATOM 26209 H1 SOL 3702 47.220 34.380 66.890 1.00 0.00 ATOM 26210 H2 SOL 3702 47.550 34.830 68.300 1.00 0.00 ATOM 26211 OH2 SOL 3703 37.680 12.840 63.480 1.00 0.00 ATOM 26212 H1 SOL 3703 37.490 13.470 64.180 1.00 0.00 ATOM 26213 H2 SOL 3703 38.030 12.070 63.940 1.00 0.00 ATOM 26214 OH2 SOL 3704 37.860 53.730 63.730 1.00 0.00 ATOM 26215 H1 SOL 3704 38.050 53.980 64.640 1.00 0.00 ATOM 26216 H2 SOL 3704 38.650 53.290 63.430 1.00 0.00 ATOM 26217 OH2 SOL 3705 11.080 49.700 76.080 1.00 0.00 ATOM 26218 H1 SOL 3705 10.840 48.930 75.570 1.00 0.00 ATOM 26219 H2 SOL 3705 11.890 49.460 76.520 1.00 0.00 ATOM 26220 OH2 SOL 3706 48.180 1.700 14.680 1.00 0.00 ATOM 26221 H1 SOL 3706 47.220 1.710 14.590 1.00 0.00 ATOM 26222 H2 SOL 3706 48.490 2.160 13.900 1.00 0.00 ATOM 26223 OH2 SOL 3707 3.340 59.640 65.520 1.00 0.00 ATOM 26224 H1 SOL 3707 3.870 59.120 66.120 1.00 0.00 ATOM 26225 H2 SOL 3707 3.410 60.540 65.840 1.00 0.00 ATOM 26226 OH2 SOL 3708 52.170 24.610 13.080 1.00 0.00 ATOM 26227 H1 SOL 3708 51.700 25.440 13.100 1.00 0.00 ATOM 26228 H2 SOL 3708 53.060 24.840 12.810 1.00 0.00 ATOM 26229 OH2 SOL 3709 7.640 1.250 6.840 1.00 0.00 ATOM 26230 H1 SOL 3709 8.520 1.060 7.170 1.00 0.00 ATOM 26231 H2 SOL 3709 7.170 1.580 7.610 1.00 0.00 ATOM 26232 OH2 SOL 3710 29.330 57.850 6.720 1.00 0.00 ATOM 26233 H1 SOL 3710 29.090 56.990 7.070 1.00 0.00 ATOM 26234 H2 SOL 3710 30.270 57.930 6.910 1.00 0.00 ATOM 26235 OH2 SOL 3711 40.460 41.230 70.130 1.00 0.00 ATOM 26236 H1 SOL 3711 40.590 41.050 71.070 1.00 0.00 ATOM 26237 H2 SOL 3711 40.980 42.020 69.970 1.00 0.00 ATOM 26238 OH2 SOL 3712 58.210 37.420 66.390 1.00 0.00 ATOM 26239 H1 SOL 3712 59.000 37.280 65.870 1.00 0.00 ATOM 26240 H2 SOL 3712 57.560 36.820 66.020 1.00 0.00 ATOM 26241 OH2 SOL 3713 13.980 59.480 25.390 1.00 0.00 ATOM 26242 H1 SOL 3713 14.380 58.820 25.950 1.00 0.00 ATOM 26243 H2 SOL 3713 13.740 60.190 25.980 1.00 0.00 ATOM 26244 OH2 SOL 3714 39.080 41.830 13.030 1.00 0.00 ATOM 26245 H1 SOL 3714 39.420 42.720 12.910 1.00 0.00 ATOM 26246 H2 SOL 3714 38.270 41.960 13.540 1.00 0.00 ATOM 26247 OH2 SOL 3715 11.130 39.580 77.990 1.00 0.00 ATOM 26248 H1 SOL 3715 11.510 39.860 77.150 1.00 0.00 ATOM 26249 H2 SOL 3715 10.540 38.860 77.750 1.00 0.00 ATOM 26250 OH2 SOL 3716 29.150 39.330 6.820 1.00 0.00 ATOM 26251 H1 SOL 3716 29.070 38.950 5.940 1.00 0.00 ATOM 26252 H2 SOL 3716 29.780 38.770 7.270 1.00 0.00 ATOM 26253 OH2 SOL 3717 52.540 47.110 18.700 1.00 0.00 ATOM 26254 H1 SOL 3717 52.590 46.760 17.810 1.00 0.00 ATOM 26255 H2 SOL 3717 53.290 47.700 18.770 1.00 0.00 ATOM 26256 OH2 SOL 3718 53.840 27.870 8.570 1.00 0.00 ATOM 26257 H1 SOL 3718 52.910 27.970 8.750 1.00 0.00 ATOM 26258 H2 SOL 3718 53.930 26.950 8.310 1.00 0.00 ATOM 26259 OH2 SOL 3719 36.130 55.830 1.330 1.00 0.00 ATOM 26260 H1 SOL 3719 36.970 56.280 1.460 1.00 0.00 ATOM 26261 H2 SOL 3719 35.930 55.950 0.400 1.00 0.00 ATOM 26262 OH2 SOL 3720 43.980 29.100 16.050 1.00 0.00 ATOM 26263 H1 SOL 3720 43.800 29.890 16.560 1.00 0.00 ATOM 26264 H2 SOL 3720 44.800 28.760 16.430 1.00 0.00 ATOM 26265 OH2 SOL 3721 31.200 40.940 66.420 1.00 0.00 ATOM 26266 H1 SOL 3721 30.760 40.120 66.650 1.00 0.00 ATOM 26267 H2 SOL 3721 31.510 41.290 67.260 1.00 0.00 ATOM 26268 OH2 SOL 3722 22.450 7.340 69.230 1.00 0.00 ATOM 26269 H1 SOL 3722 23.220 6.920 68.840 1.00 0.00 ATOM 26270 H2 SOL 3722 21.950 6.620 69.620 1.00 0.00 ATOM 26271 OH2 SOL 3723 8.690 60.910 13.430 1.00 0.00 ATOM 26272 H1 SOL 3723 9.600 60.610 13.530 1.00 0.00 ATOM 26273 H2 SOL 3723 8.270 60.220 12.910 1.00 0.00 ATOM 26274 OH2 SOL 3724 16.620 2.740 18.010 1.00 0.00 ATOM 26275 H1 SOL 3724 17.380 2.420 17.520 1.00 0.00 ATOM 26276 H2 SOL 3724 16.500 2.100 18.710 1.00 0.00 ATOM 26277 OH2 SOL 3725 48.920 14.540 1.830 1.00 0.00 ATOM 26278 H1 SOL 3725 48.810 14.920 2.700 1.00 0.00 ATOM 26279 H2 SOL 3725 49.050 15.300 1.260 1.00 0.00 ATOM 26280 OH2 SOL 3726 25.010 51.180 8.300 1.00 0.00 ATOM 26281 H1 SOL 3726 25.140 51.990 7.800 1.00 0.00 ATOM 26282 H2 SOL 3726 24.800 50.530 7.630 1.00 0.00 ATOM 26283 OH2 SOL 3727 23.070 43.320 4.230 1.00 0.00 ATOM 26284 H1 SOL 3727 23.690 42.610 4.380 1.00 0.00 ATOM 26285 H2 SOL 3727 23.370 44.030 4.800 1.00 0.00 ATOM 26286 OH2 SOL 3728 45.770 20.090 80.980 1.00 0.00 ATOM 26287 H1 SOL 3728 46.320 20.840 81.190 1.00 0.00 ATOM 26288 H2 SOL 3728 44.990 20.200 81.520 1.00 0.00 ATOM 26289 OH2 SOL 3729 10.560 29.370 81.660 1.00 0.00 ATOM 26290 H1 SOL 3729 10.440 29.530 82.600 1.00 0.00 ATOM 26291 H2 SOL 3729 10.470 30.230 81.260 1.00 0.00 ATOM 26292 OH2 SOL 3730 10.690 12.190 81.530 1.00 0.00 ATOM 26293 H1 SOL 3730 11.390 11.940 80.920 1.00 0.00 ATOM 26294 H2 SOL 3730 9.880 11.900 81.100 1.00 0.00 ATOM 26295 OH2 SOL 3731 40.640 6.190 23.770 1.00 0.00 ATOM 26296 H1 SOL 3731 40.450 6.730 24.540 1.00 0.00 ATOM 26297 H2 SOL 3731 40.790 6.810 23.060 1.00 0.00 ATOM 26298 OH2 SOL 3732 23.310 30.830 4.050 1.00 0.00 ATOM 26299 H1 SOL 3732 22.580 30.260 4.290 1.00 0.00 ATOM 26300 H2 SOL 3732 23.240 31.570 4.660 1.00 0.00 ATOM 26301 OH2 SOL 3733 19.970 17.880 21.490 1.00 0.00 ATOM 26302 H1 SOL 3733 20.210 18.220 22.360 1.00 0.00 ATOM 26303 H2 SOL 3733 20.420 17.040 21.440 1.00 0.00 ATOM 26304 OH2 SOL 3734 5.420 38.840 80.890 1.00 0.00 ATOM 26305 H1 SOL 3734 5.640 38.090 81.440 1.00 0.00 ATOM 26306 H2 SOL 3734 5.260 38.470 80.030 1.00 0.00 ATOM 26307 OH2 SOL 3735 5.510 6.080 75.120 1.00 0.00 ATOM 26308 H1 SOL 3735 4.840 5.580 74.650 1.00 0.00 ATOM 26309 H2 SOL 3735 5.970 6.570 74.440 1.00 0.00 ATOM 26310 OH2 SOL 3736 39.060 30.350 11.540 1.00 0.00 ATOM 26311 H1 SOL 3736 38.770 30.920 12.250 1.00 0.00 ATOM 26312 H2 SOL 3736 39.210 30.940 10.800 1.00 0.00 ATOM 26313 OH2 SOL 3737 52.090 40.190 76.760 1.00 0.00 ATOM 26314 H1 SOL 3737 52.740 39.490 76.690 1.00 0.00 ATOM 26315 H2 SOL 3737 52.140 40.480 77.670 1.00 0.00 ATOM 26316 OH2 SOL 3738 2.910 36.670 2.460 1.00 0.00 ATOM 26317 H1 SOL 3738 2.640 36.700 3.380 1.00 0.00 ATOM 26318 H2 SOL 3738 2.860 37.580 2.160 1.00 0.00 ATOM 26319 OH2 SOL 3739 53.560 37.070 81.580 1.00 0.00 ATOM 26320 H1 SOL 3739 52.690 37.400 81.370 1.00 0.00 ATOM 26321 H2 SOL 3739 53.420 36.500 82.340 1.00 0.00 ATOM 26322 OH2 SOL 3740 54.420 6.350 2.990 1.00 0.00 ATOM 26323 H1 SOL 3740 54.380 6.000 2.110 1.00 0.00 ATOM 26324 H2 SOL 3740 55.120 5.860 3.420 1.00 0.00 ATOM 26325 OH2 SOL 3741 23.020 30.310 68.950 1.00 0.00 ATOM 26326 H1 SOL 3741 23.600 31.070 69.030 1.00 0.00 ATOM 26327 H2 SOL 3741 22.880 30.220 68.010 1.00 0.00 ATOM 26328 OH2 SOL 3742 55.860 41.490 1.880 1.00 0.00 ATOM 26329 H1 SOL 3742 56.120 42.390 1.670 1.00 0.00 ATOM 26330 H2 SOL 3742 54.920 41.470 1.730 1.00 0.00 ATOM 26331 OH2 SOL 3743 41.170 41.810 73.050 1.00 0.00 ATOM 26332 H1 SOL 3743 42.100 41.980 73.200 1.00 0.00 ATOM 26333 H2 SOL 3743 40.790 42.680 72.890 1.00 0.00 ATOM 26334 OH2 SOL 3744 3.750 54.520 12.540 1.00 0.00 ATOM 26335 H1 SOL 3744 3.850 54.820 13.440 1.00 0.00 ATOM 26336 H2 SOL 3744 4.480 53.910 12.400 1.00 0.00 ATOM 26337 OH2 SOL 3745 5.440 40.730 67.580 1.00 0.00 ATOM 26338 H1 SOL 3745 5.070 41.100 68.380 1.00 0.00 ATOM 26339 H2 SOL 3745 6.110 41.360 67.310 1.00 0.00 ATOM 26340 OH2 SOL 3746 22.140 54.940 14.030 1.00 0.00 ATOM 26341 H1 SOL 3746 22.560 54.760 13.190 1.00 0.00 ATOM 26342 H2 SOL 3746 22.820 55.350 14.560 1.00 0.00 ATOM 26343 OH2 SOL 3747 25.070 21.660 81.370 1.00 0.00 ATOM 26344 H1 SOL 3747 24.520 22.210 81.930 1.00 0.00 ATOM 26345 H2 SOL 3747 25.790 22.230 81.100 1.00 0.00 ATOM 26346 OH2 SOL 3748 37.290 52.080 76.030 1.00 0.00 ATOM 26347 H1 SOL 3748 37.940 52.510 75.470 1.00 0.00 ATOM 26348 H2 SOL 3748 36.440 52.350 75.670 1.00 0.00 ATOM 26349 OH2 SOL 3749 14.090 30.190 2.480 1.00 0.00 ATOM 26350 H1 SOL 3749 15.010 30.440 2.430 1.00 0.00 ATOM 26351 H2 SOL 3749 13.820 30.100 1.560 1.00 0.00 ATOM 26352 OH2 SOL 3750 56.650 38.810 77.760 1.00 0.00 ATOM 26353 H1 SOL 3750 56.740 37.920 77.440 1.00 0.00 ATOM 26354 H2 SOL 3750 56.910 38.770 78.680 1.00 0.00 ATOM 26355 OH2 SOL 3751 26.660 12.060 79.790 1.00 0.00 ATOM 26356 H1 SOL 3751 26.950 11.590 79.000 1.00 0.00 ATOM 26357 H2 SOL 3751 25.730 11.860 79.850 1.00 0.00 ATOM 26358 OH2 SOL 3752 45.290 57.930 70.210 1.00 0.00 ATOM 26359 H1 SOL 3752 45.420 58.220 71.110 1.00 0.00 ATOM 26360 H2 SOL 3752 44.600 58.500 69.870 1.00 0.00 ATOM 26361 OH2 SOL 3753 35.300 30.300 72.280 1.00 0.00 ATOM 26362 H1 SOL 3753 34.810 30.340 71.450 1.00 0.00 ATOM 26363 H2 SOL 3753 35.950 29.610 72.140 1.00 0.00 ATOM 26364 OH2 SOL 3754 22.430 24.970 9.740 1.00 0.00 ATOM 26365 H1 SOL 3754 23.360 25.210 9.690 1.00 0.00 ATOM 26366 H2 SOL 3754 22.230 24.980 10.680 1.00 0.00 ATOM 26367 OH2 SOL 3755 56.230 28.890 23.010 1.00 0.00 ATOM 26368 H1 SOL 3755 56.610 29.320 22.250 1.00 0.00 ATOM 26369 H2 SOL 3755 56.740 28.090 23.120 1.00 0.00 ATOM 26370 OH2 SOL 3756 34.120 19.170 82.850 1.00 0.00 ATOM 26371 H1 SOL 3756 34.570 19.420 82.040 1.00 0.00 ATOM 26372 H2 SOL 3756 33.310 18.760 82.550 1.00 0.00 ATOM 26373 OH2 SOL 3757 4.380 58.490 1.030 1.00 0.00 ATOM 26374 H1 SOL 3757 4.250 59.430 0.890 1.00 0.00 ATOM 26375 H2 SOL 3757 4.040 58.340 1.920 1.00 0.00 ATOM 26376 OH2 SOL 3758 10.660 30.740 69.270 1.00 0.00 ATOM 26377 H1 SOL 3758 10.260 31.610 69.220 1.00 0.00 ATOM 26378 H2 SOL 3758 10.090 30.190 68.720 1.00 0.00 ATOM 26379 OH2 SOL 3759 18.780 51.080 3.950 1.00 0.00 ATOM 26380 H1 SOL 3759 19.460 51.680 4.250 1.00 0.00 ATOM 26381 H2 SOL 3759 18.110 51.120 4.630 1.00 0.00 ATOM 26382 OH2 SOL 3760 8.130 47.000 22.090 1.00 0.00 ATOM 26383 H1 SOL 3760 8.060 46.050 22.140 1.00 0.00 ATOM 26384 H2 SOL 3760 9.020 47.200 22.370 1.00 0.00 ATOM 26385 OH2 SOL 3761 57.180 38.300 20.420 1.00 0.00 ATOM 26386 H1 SOL 3761 57.830 37.950 21.030 1.00 0.00 ATOM 26387 H2 SOL 3761 57.100 37.630 19.740 1.00 0.00 ATOM 26388 OH2 SOL 3762 33.460 21.190 67.020 1.00 0.00 ATOM 26389 H1 SOL 3762 32.990 20.800 66.280 1.00 0.00 ATOM 26390 H2 SOL 3762 34.100 21.780 66.610 1.00 0.00 ATOM 26391 OH2 SOL 3763 9.280 25.260 18.300 1.00 0.00 ATOM 26392 H1 SOL 3763 8.630 25.900 18.020 1.00 0.00 ATOM 26393 H2 SOL 3763 8.810 24.430 18.320 1.00 0.00 ATOM 26394 OH2 SOL 3764 3.350 30.830 0.060 1.00 0.00 ATOM 26395 H1 SOL 3764 3.390 31.780 -0.030 1.00 0.00 ATOM 26396 H2 SOL 3764 2.470 30.660 0.400 1.00 0.00 ATOM 26397 OH2 SOL 3765 25.710 4.700 1.940 1.00 0.00 ATOM 26398 H1 SOL 3765 25.560 5.350 1.250 1.00 0.00 ATOM 26399 H2 SOL 3765 26.270 4.040 1.540 1.00 0.00 ATOM 26400 OH2 SOL 3766 0.570 29.830 13.100 1.00 0.00 ATOM 26401 H1 SOL 3766 0.100 30.070 12.310 1.00 0.00 ATOM 26402 H2 SOL 3766 0.050 30.190 13.820 1.00 0.00 ATOM 26403 OH2 SOL 3767 47.870 47.410 69.800 1.00 0.00 ATOM 26404 H1 SOL 3767 47.760 46.550 69.410 1.00 0.00 ATOM 26405 H2 SOL 3767 47.680 47.280 70.730 1.00 0.00 ATOM 26406 OH2 SOL 3768 20.100 10.550 82.650 1.00 0.00 ATOM 26407 H1 SOL 3768 20.340 9.910 83.330 1.00 0.00 ATOM 26408 H2 SOL 3768 20.570 11.340 82.890 1.00 0.00 ATOM 26409 OH2 SOL 3769 39.030 20.870 83.490 1.00 0.00 ATOM 26410 H1 SOL 3769 38.240 20.540 83.920 1.00 0.00 ATOM 26411 H2 SOL 3769 39.750 20.420 83.930 1.00 0.00 ATOM 26412 OH2 SOL 3770 24.800 32.300 68.400 1.00 0.00 ATOM 26413 H1 SOL 3770 25.540 32.850 68.640 1.00 0.00 ATOM 26414 H2 SOL 3770 24.980 32.020 67.510 1.00 0.00 ATOM 26415 OH2 SOL 3771 0.700 19.810 6.650 1.00 0.00 ATOM 26416 H1 SOL 3771 0.750 20.730 6.900 1.00 0.00 ATOM 26417 H2 SOL 3771 0.630 19.830 5.690 1.00 0.00 ATOM 26418 OH2 SOL 3772 26.630 30.520 83.100 1.00 0.00 ATOM 26419 H1 SOL 3772 26.820 30.940 82.260 1.00 0.00 ATOM 26420 H2 SOL 3772 27.490 30.270 83.440 1.00 0.00 ATOM 26421 OH2 SOL 3773 50.220 29.160 18.340 1.00 0.00 ATOM 26422 H1 SOL 3773 50.240 29.090 17.390 1.00 0.00 ATOM 26423 H2 SOL 3773 50.660 29.990 18.530 1.00 0.00 ATOM 26424 OH2 SOL 3774 27.120 43.650 18.510 1.00 0.00 ATOM 26425 H1 SOL 3774 26.970 43.790 19.440 1.00 0.00 ATOM 26426 H2 SOL 3774 26.520 44.260 18.070 1.00 0.00 ATOM 26427 OH2 SOL 3775 24.160 11.850 76.550 1.00 0.00 ATOM 26428 H1 SOL 3775 23.900 12.440 75.840 1.00 0.00 ATOM 26429 H2 SOL 3775 24.010 12.350 77.350 1.00 0.00 ATOM 26430 OH2 SOL 3776 32.910 50.350 67.130 1.00 0.00 ATOM 26431 H1 SOL 3776 33.690 50.370 67.680 1.00 0.00 ATOM 26432 H2 SOL 3776 32.340 49.700 67.550 1.00 0.00 ATOM 26433 OH2 SOL 3777 59.250 11.260 19.150 1.00 0.00 ATOM 26434 H1 SOL 3777 58.670 10.560 18.870 1.00 0.00 ATOM 26435 H2 SOL 3777 58.660 11.970 19.410 1.00 0.00 ATOM 26436 OH2 SOL 3778 26.320 56.720 70.010 1.00 0.00 ATOM 26437 H1 SOL 3778 26.600 57.180 70.810 1.00 0.00 ATOM 26438 H2 SOL 3778 26.860 57.100 69.320 1.00 0.00 ATOM 26439 OH2 SOL 3779 45.710 15.990 75.920 1.00 0.00 ATOM 26440 H1 SOL 3779 46.190 16.760 76.220 1.00 0.00 ATOM 26441 H2 SOL 3779 45.860 15.970 74.970 1.00 0.00 ATOM 26442 OH2 SOL 3780 30.540 50.920 6.190 1.00 0.00 ATOM 26443 H1 SOL 3780 31.400 51.100 6.580 1.00 0.00 ATOM 26444 H2 SOL 3780 30.550 51.410 5.360 1.00 0.00 ATOM 26445 OH2 SOL 3781 29.350 55.570 16.780 1.00 0.00 ATOM 26446 H1 SOL 3781 28.580 55.220 17.240 1.00 0.00 ATOM 26447 H2 SOL 3781 29.390 56.490 17.050 1.00 0.00 ATOM 26448 OH2 SOL 3782 14.430 49.360 6.740 1.00 0.00 ATOM 26449 H1 SOL 3782 14.490 49.470 7.690 1.00 0.00 ATOM 26450 H2 SOL 3782 13.660 48.800 6.620 1.00 0.00 ATOM 26451 OH2 SOL 3783 17.110 58.600 4.400 1.00 0.00 ATOM 26452 H1 SOL 3783 17.000 58.190 3.540 1.00 0.00 ATOM 26453 H2 SOL 3783 16.730 59.470 4.310 1.00 0.00 ATOM 26454 OH2 SOL 3784 39.640 16.250 62.830 1.00 0.00 ATOM 26455 H1 SOL 3784 39.560 15.380 62.430 1.00 0.00 ATOM 26456 H2 SOL 3784 39.540 16.860 62.100 1.00 0.00 ATOM 26457 OH2 SOL 3785 43.360 27.130 4.430 1.00 0.00 ATOM 26458 H1 SOL 3785 43.560 27.850 3.820 1.00 0.00 ATOM 26459 H2 SOL 3785 44.210 26.860 4.770 1.00 0.00 ATOM 26460 OH2 SOL 3786 43.860 46.410 16.240 1.00 0.00 ATOM 26461 H1 SOL 3786 44.370 46.190 17.020 1.00 0.00 ATOM 26462 H2 SOL 3786 44.400 47.030 15.760 1.00 0.00 ATOM 26463 OH2 SOL 3787 21.340 53.670 75.970 1.00 0.00 ATOM 26464 H1 SOL 3787 21.730 54.490 75.700 1.00 0.00 ATOM 26465 H2 SOL 3787 20.710 53.910 76.650 1.00 0.00 ATOM 26466 OH2 SOL 3788 36.720 44.600 4.910 1.00 0.00 ATOM 26467 H1 SOL 3788 37.130 44.840 5.740 1.00 0.00 ATOM 26468 H2 SOL 3788 36.550 45.440 4.480 1.00 0.00 ATOM 26469 OH2 SOL 3789 33.840 23.300 10.120 1.00 0.00 ATOM 26470 H1 SOL 3789 34.770 23.050 10.130 1.00 0.00 ATOM 26471 H2 SOL 3789 33.720 23.740 9.280 1.00 0.00 ATOM 26472 OH2 SOL 3790 18.040 44.000 82.780 1.00 0.00 ATOM 26473 H1 SOL 3790 17.880 43.890 83.710 1.00 0.00 ATOM 26474 H2 SOL 3790 18.610 44.770 82.730 1.00 0.00 ATOM 26475 OH2 SOL 3791 57.610 18.600 17.070 1.00 0.00 ATOM 26476 H1 SOL 3791 58.460 18.320 16.710 1.00 0.00 ATOM 26477 H2 SOL 3791 57.830 19.090 17.850 1.00 0.00 ATOM 26478 OH2 SOL 3792 6.910 59.500 11.780 1.00 0.00 ATOM 26479 H1 SOL 3792 6.340 59.850 11.090 1.00 0.00 ATOM 26480 H2 SOL 3792 6.650 58.580 11.860 1.00 0.00 ATOM 26481 OH2 SOL 3793 42.720 10.330 8.480 1.00 0.00 ATOM 26482 H1 SOL 3793 43.350 9.770 8.920 1.00 0.00 ATOM 26483 H2 SOL 3793 42.260 10.780 9.190 1.00 0.00 ATOM 26484 OH2 SOL 3794 5.000 27.290 17.280 1.00 0.00 ATOM 26485 H1 SOL 3794 5.870 27.210 16.880 1.00 0.00 ATOM 26486 H2 SOL 3794 4.540 26.500 16.990 1.00 0.00 ATOM 26487 OH2 SOL 3795 0.940 4.680 81.040 1.00 0.00 ATOM 26488 H1 SOL 3795 0.290 4.110 80.630 1.00 0.00 ATOM 26489 H2 SOL 3795 0.650 4.750 81.950 1.00 0.00 ATOM 26490 OH2 SOL 3796 11.290 55.080 79.920 1.00 0.00 ATOM 26491 H1 SOL 3796 10.710 54.590 80.500 1.00 0.00 ATOM 26492 H2 SOL 3796 10.710 55.530 79.310 1.00 0.00 ATOM 26493 OH2 SOL 3797 26.120 41.660 16.330 1.00 0.00 ATOM 26494 H1 SOL 3797 25.630 42.460 16.530 1.00 0.00 ATOM 26495 H2 SOL 3797 25.790 41.380 15.480 1.00 0.00 ATOM 26496 OH2 SOL 3798 50.340 12.070 65.630 1.00 0.00 ATOM 26497 H1 SOL 3798 50.000 12.180 64.740 1.00 0.00 ATOM 26498 H2 SOL 3798 50.170 12.920 66.060 1.00 0.00 ATOM 26499 OH2 SOL 3799 12.280 6.650 22.720 1.00 0.00 ATOM 26500 H1 SOL 3799 12.870 5.920 22.540 1.00 0.00 ATOM 26501 H2 SOL 3799 12.850 7.420 22.740 1.00 0.00 ATOM 26502 OH2 SOL 3800 37.280 9.050 18.450 1.00 0.00 ATOM 26503 H1 SOL 3800 37.730 8.670 17.710 1.00 0.00 ATOM 26504 H2 SOL 3800 36.370 8.780 18.350 1.00 0.00 ATOM 26505 OH2 SOL 3801 5.680 4.480 82.200 1.00 0.00 ATOM 26506 H1 SOL 3801 5.850 4.490 83.140 1.00 0.00 ATOM 26507 H2 SOL 3801 4.840 4.030 82.120 1.00 0.00 ATOM 26508 OH2 SOL 3802 20.380 32.040 3.420 1.00 0.00 ATOM 26509 H1 SOL 3802 19.690 32.660 3.160 1.00 0.00 ATOM 26510 H2 SOL 3802 21.190 32.450 3.110 1.00 0.00 ATOM 26511 OH2 SOL 3803 51.230 34.880 72.560 1.00 0.00 ATOM 26512 H1 SOL 3803 51.870 35.450 72.140 1.00 0.00 ATOM 26513 H2 SOL 3803 51.390 34.020 72.180 1.00 0.00 ATOM 26514 OH2 SOL 3804 0.110 30.940 19.800 1.00 0.00 ATOM 26515 H1 SOL 3804 0.640 30.480 19.140 1.00 0.00 ATOM 26516 H2 SOL 3804 -0.220 31.710 19.340 1.00 0.00 ATOM 26517 OH2 SOL 3805 5.110 19.550 6.720 1.00 0.00 ATOM 26518 H1 SOL 3805 4.710 18.720 6.470 1.00 0.00 ATOM 26519 H2 SOL 3805 5.940 19.570 6.240 1.00 0.00 ATOM 26520 OH2 SOL 3806 14.850 54.790 4.490 1.00 0.00 ATOM 26521 H1 SOL 3806 14.770 54.120 3.820 1.00 0.00 ATOM 26522 H2 SOL 3806 13.950 54.930 4.800 1.00 0.00 ATOM 26523 OH2 SOL 3807 24.660 21.660 20.760 1.00 0.00 ATOM 26524 H1 SOL 3807 23.890 21.700 21.330 1.00 0.00 ATOM 26525 H2 SOL 3807 25.240 22.340 21.090 1.00 0.00 ATOM 26526 OH2 SOL 3808 35.650 5.600 9.000 1.00 0.00 ATOM 26527 H1 SOL 3808 35.950 4.690 8.940 1.00 0.00 ATOM 26528 H2 SOL 3808 35.390 5.700 9.920 1.00 0.00 ATOM 26529 OH2 SOL 3809 14.590 45.560 75.050 1.00 0.00 ATOM 26530 H1 SOL 3809 15.270 45.980 75.570 1.00 0.00 ATOM 26531 H2 SOL 3809 15.050 44.940 74.500 1.00 0.00 ATOM 26532 OH2 SOL 3810 56.330 46.680 2.970 1.00 0.00 ATOM 26533 H1 SOL 3810 56.770 47.360 2.460 1.00 0.00 ATOM 26534 H2 SOL 3810 55.460 47.030 3.150 1.00 0.00 ATOM 26535 OH2 SOL 3811 22.310 7.240 0.250 1.00 0.00 ATOM 26536 H1 SOL 3811 21.630 7.370 -0.410 1.00 0.00 ATOM 26537 H2 SOL 3811 22.670 8.120 0.400 1.00 0.00 ATOM 26538 OH2 SOL 3812 14.970 4.150 1.950 1.00 0.00 ATOM 26539 H1 SOL 3812 15.500 4.940 1.800 1.00 0.00 ATOM 26540 H2 SOL 3812 14.750 4.190 2.880 1.00 0.00 ATOM 26541 OH2 SOL 3813 8.510 12.790 83.730 1.00 0.00 ATOM 26542 H1 SOL 3813 8.750 12.750 84.660 1.00 0.00 ATOM 26543 H2 SOL 3813 9.340 12.700 83.270 1.00 0.00 ATOM 26544 OH2 SOL 3814 10.700 11.690 8.040 1.00 0.00 ATOM 26545 H1 SOL 3814 10.250 11.510 7.210 1.00 0.00 ATOM 26546 H2 SOL 3814 10.070 11.420 8.710 1.00 0.00 ATOM 26547 OH2 SOL 3815 7.140 35.900 17.610 1.00 0.00 ATOM 26548 H1 SOL 3815 7.240 36.480 18.360 1.00 0.00 ATOM 26549 H2 SOL 3815 6.870 35.060 17.990 1.00 0.00 ATOM 26550 OH2 SOL 3816 43.550 12.190 81.900 1.00 0.00 ATOM 26551 H1 SOL 3816 44.420 11.850 82.090 1.00 0.00 ATOM 26552 H2 SOL 3816 43.230 11.650 81.170 1.00 0.00 ATOM 26553 OH2 SOL 3817 43.380 17.660 16.850 1.00 0.00 ATOM 26554 H1 SOL 3817 43.720 16.950 16.310 1.00 0.00 ATOM 26555 H2 SOL 3817 42.490 17.390 17.070 1.00 0.00 ATOM 26556 OH2 SOL 3818 21.510 3.590 4.980 1.00 0.00 ATOM 26557 H1 SOL 3818 21.890 2.740 4.750 1.00 0.00 ATOM 26558 H2 SOL 3818 21.680 4.150 4.230 1.00 0.00 ATOM 26559 OH2 SOL 3819 31.360 5.310 23.200 1.00 0.00 ATOM 26560 H1 SOL 3819 31.640 6.150 23.560 1.00 0.00 ATOM 26561 H2 SOL 3819 32.180 4.860 22.990 1.00 0.00 ATOM 26562 OH2 SOL 3820 36.780 27.580 75.010 1.00 0.00 ATOM 26563 H1 SOL 3820 36.020 27.090 74.720 1.00 0.00 ATOM 26564 H2 SOL 3820 36.650 28.460 74.670 1.00 0.00 ATOM 26565 OH2 SOL 3821 59.780 32.640 80.830 1.00 0.00 ATOM 26566 H1 SOL 3821 59.270 32.370 80.070 1.00 0.00 ATOM 26567 H2 SOL 3821 59.640 33.590 80.880 1.00 0.00 ATOM 26568 OH2 SOL 3822 43.770 1.710 14.900 1.00 0.00 ATOM 26569 H1 SOL 3822 44.360 1.480 14.190 1.00 0.00 ATOM 26570 H2 SOL 3822 44.130 1.270 15.670 1.00 0.00 ATOM 26571 OH2 SOL 3823 35.760 6.110 14.560 1.00 0.00 ATOM 26572 H1 SOL 3823 35.970 5.210 14.320 1.00 0.00 ATOM 26573 H2 SOL 3823 35.300 6.040 15.390 1.00 0.00 ATOM 26574 OH2 SOL 3824 10.820 27.930 22.160 1.00 0.00 ATOM 26575 H1 SOL 3824 10.560 28.230 23.030 1.00 0.00 ATOM 26576 H2 SOL 3824 10.650 26.980 22.170 1.00 0.00 ATOM 26577 OH2 SOL 3825 20.360 41.080 81.800 1.00 0.00 ATOM 26578 H1 SOL 3825 21.070 41.670 81.520 1.00 0.00 ATOM 26579 H2 SOL 3825 19.560 41.530 81.530 1.00 0.00 ATOM 26580 OH2 SOL 3826 20.570 39.090 4.130 1.00 0.00 ATOM 26581 H1 SOL 3826 20.920 39.940 3.870 1.00 0.00 ATOM 26582 H2 SOL 3826 21.120 38.460 3.670 1.00 0.00 ATOM 26583 OH2 SOL 3827 46.000 8.040 11.760 1.00 0.00 ATOM 26584 H1 SOL 3827 46.060 7.240 12.280 1.00 0.00 ATOM 26585 H2 SOL 3827 46.180 8.740 12.390 1.00 0.00 ATOM 26586 OH2 SOL 3828 20.710 26.150 76.610 1.00 0.00 ATOM 26587 H1 SOL 3828 21.300 25.410 76.690 1.00 0.00 ATOM 26588 H2 SOL 3828 19.960 25.920 77.150 1.00 0.00 ATOM 26589 OH2 SOL 3829 46.060 12.450 25.510 1.00 0.00 ATOM 26590 H1 SOL 3829 46.260 11.830 26.210 1.00 0.00 ATOM 26591 H2 SOL 3829 45.170 12.740 25.700 1.00 0.00 ATOM 26592 OH2 SOL 3830 47.840 19.450 67.470 1.00 0.00 ATOM 26593 H1 SOL 3830 48.790 19.560 67.370 1.00 0.00 ATOM 26594 H2 SOL 3830 47.620 19.900 68.280 1.00 0.00 ATOM 26595 OH2 SOL 3831 47.080 8.870 68.880 1.00 0.00 ATOM 26596 H1 SOL 3831 46.590 9.650 68.640 1.00 0.00 ATOM 26597 H2 SOL 3831 46.800 8.200 68.250 1.00 0.00 ATOM 26598 OH2 SOL 3832 15.310 55.740 68.530 1.00 0.00 ATOM 26599 H1 SOL 3832 15.600 55.060 67.920 1.00 0.00 ATOM 26600 H2 SOL 3832 15.830 56.510 68.310 1.00 0.00 ATOM 26601 OH2 SOL 3833 49.640 22.940 69.760 1.00 0.00 ATOM 26602 H1 SOL 3833 48.860 22.790 70.300 1.00 0.00 ATOM 26603 H2 SOL 3833 50.330 23.140 70.390 1.00 0.00 ATOM 26604 OH2 SOL 3834 56.170 23.420 19.770 1.00 0.00 ATOM 26605 H1 SOL 3834 55.370 23.490 20.290 1.00 0.00 ATOM 26606 H2 SOL 3834 56.870 23.740 20.350 1.00 0.00 ATOM 26607 OH2 SOL 3835 22.500 11.320 17.380 1.00 0.00 ATOM 26608 H1 SOL 3835 23.130 11.960 17.060 1.00 0.00 ATOM 26609 H2 SOL 3835 21.650 11.720 17.220 1.00 0.00 ATOM 26610 OH2 SOL 3836 13.080 29.390 11.750 1.00 0.00 ATOM 26611 H1 SOL 3836 12.450 30.110 11.740 1.00 0.00 ATOM 26612 H2 SOL 3836 13.780 29.670 11.160 1.00 0.00 ATOM 26613 OH2 SOL 3837 30.750 38.490 81.550 1.00 0.00 ATOM 26614 H1 SOL 3837 30.220 37.710 81.740 1.00 0.00 ATOM 26615 H2 SOL 3837 30.580 38.680 80.620 1.00 0.00 ATOM 26616 OH2 SOL 3838 8.370 27.180 74.610 1.00 0.00 ATOM 26617 H1 SOL 3838 7.730 27.210 75.320 1.00 0.00 ATOM 26618 H2 SOL 3838 9.200 26.940 75.040 1.00 0.00 ATOM 26619 OH2 SOL 3839 30.420 2.090 76.960 1.00 0.00 ATOM 26620 H1 SOL 3839 30.100 1.530 77.660 1.00 0.00 ATOM 26621 H2 SOL 3839 30.490 1.510 76.200 1.00 0.00 ATOM 26622 OH2 SOL 3840 46.090 39.040 76.980 1.00 0.00 ATOM 26623 H1 SOL 3840 47.030 38.970 77.090 1.00 0.00 ATOM 26624 H2 SOL 3840 45.790 38.130 76.880 1.00 0.00 ATOM 26625 OH2 SOL 3841 1.680 52.080 67.200 1.00 0.00 ATOM 26626 H1 SOL 3841 1.960 51.470 67.880 1.00 0.00 ATOM 26627 H2 SOL 3841 1.890 52.950 67.550 1.00 0.00 ATOM 26628 OH2 SOL 3842 51.300 17.800 73.670 1.00 0.00 ATOM 26629 H1 SOL 3842 50.540 18.350 73.490 1.00 0.00 ATOM 26630 H2 SOL 3842 52.050 18.360 73.470 1.00 0.00 ATOM 26631 OH2 SOL 3843 9.190 46.970 7.820 1.00 0.00 ATOM 26632 H1 SOL 3843 8.510 47.600 8.070 1.00 0.00 ATOM 26633 H2 SOL 3843 9.250 46.370 8.560 1.00 0.00 ATOM 26634 OH2 SOL 3844 47.760 18.940 5.190 1.00 0.00 ATOM 26635 H1 SOL 3844 47.180 18.240 5.500 1.00 0.00 ATOM 26636 H2 SOL 3844 47.250 19.740 5.310 1.00 0.00 ATOM 26637 OH2 SOL 3845 0.590 60.540 79.920 1.00 0.00 ATOM 26638 H1 SOL 3845 0.070 61.170 79.420 1.00 0.00 ATOM 26639 H2 SOL 3845 1.130 60.090 79.270 1.00 0.00 ATOM 26640 OH2 SOL 3846 9.970 34.700 70.210 1.00 0.00 ATOM 26641 H1 SOL 3846 9.230 35.200 69.850 1.00 0.00 ATOM 26642 H2 SOL 3846 9.690 34.470 71.100 1.00 0.00 ATOM 26643 OH2 SOL 3847 36.460 33.040 11.520 1.00 0.00 ATOM 26644 H1 SOL 3847 36.570 33.970 11.370 1.00 0.00 ATOM 26645 H2 SOL 3847 36.610 32.630 10.670 1.00 0.00 ATOM 26646 OH2 SOL 3848 51.360 15.100 19.400 1.00 0.00 ATOM 26647 H1 SOL 3848 50.600 15.220 18.820 1.00 0.00 ATOM 26648 H2 SOL 3848 51.990 14.620 18.870 1.00 0.00 ATOM 26649 OH2 SOL 3849 10.620 17.080 75.910 1.00 0.00 ATOM 26650 H1 SOL 3849 10.370 18.000 76.000 1.00 0.00 ATOM 26651 H2 SOL 3849 10.400 16.690 76.760 1.00 0.00 ATOM 26652 OH2 SOL 3850 2.230 33.460 5.830 1.00 0.00 ATOM 26653 H1 SOL 3850 1.460 33.030 5.460 1.00 0.00 ATOM 26654 H2 SOL 3850 2.510 32.890 6.540 1.00 0.00 ATOM 26655 OH2 SOL 3851 41.550 38.270 17.930 1.00 0.00 ATOM 26656 H1 SOL 3851 41.030 37.480 17.790 1.00 0.00 ATOM 26657 H2 SOL 3851 41.890 38.490 17.060 1.00 0.00 ATOM 26658 OH2 SOL 3852 7.320 31.330 20.290 1.00 0.00 ATOM 26659 H1 SOL 3852 6.820 31.540 21.080 1.00 0.00 ATOM 26660 H2 SOL 3852 6.800 30.680 19.840 1.00 0.00 ATOM 26661 OH2 SOL 3853 30.910 36.370 74.890 1.00 0.00 ATOM 26662 H1 SOL 3853 31.450 36.700 75.610 1.00 0.00 ATOM 26663 H2 SOL 3853 30.200 35.890 75.310 1.00 0.00 ATOM 26664 OH2 SOL 3854 50.330 33.760 84.470 1.00 0.00 ATOM 26665 H1 SOL 3854 51.200 33.670 84.090 1.00 0.00 ATOM 26666 H2 SOL 3854 49.870 34.370 83.890 1.00 0.00 ATOM 26667 OH2 SOL 3855 52.280 58.810 74.250 1.00 0.00 ATOM 26668 H1 SOL 3855 51.980 57.910 74.350 1.00 0.00 ATOM 26669 H2 SOL 3855 51.490 59.320 74.110 1.00 0.00 ATOM 26670 OH2 SOL 3856 26.950 28.910 75.690 1.00 0.00 ATOM 26671 H1 SOL 3856 27.550 29.620 75.930 1.00 0.00 ATOM 26672 H2 SOL 3856 26.780 29.060 74.760 1.00 0.00 ATOM 26673 OH2 SOL 3857 29.960 58.390 23.890 1.00 0.00 ATOM 26674 H1 SOL 3857 29.490 58.540 24.700 1.00 0.00 ATOM 26675 H2 SOL 3857 30.800 58.020 24.160 1.00 0.00 ATOM 26676 OH2 SOL 3858 25.140 49.200 79.870 1.00 0.00 ATOM 26677 H1 SOL 3858 25.600 50.010 80.080 1.00 0.00 ATOM 26678 H2 SOL 3858 24.240 49.340 80.150 1.00 0.00 ATOM 26679 OH2 SOL 3859 53.090 23.820 5.980 1.00 0.00 ATOM 26680 H1 SOL 3859 53.450 23.280 5.280 1.00 0.00 ATOM 26681 H2 SOL 3859 53.290 23.330 6.780 1.00 0.00 ATOM 26682 OH2 SOL 3860 38.890 34.760 68.010 1.00 0.00 ATOM 26683 H1 SOL 3860 38.280 34.450 67.340 1.00 0.00 ATOM 26684 H2 SOL 3860 38.990 35.690 67.840 1.00 0.00 ATOM 26685 OH2 SOL 3861 41.640 11.230 19.100 1.00 0.00 ATOM 26686 H1 SOL 3861 42.150 11.650 19.790 1.00 0.00 ATOM 26687 H2 SOL 3861 40.800 11.030 19.520 1.00 0.00 ATOM 26688 OH2 SOL 3862 17.880 44.260 10.100 1.00 0.00 ATOM 26689 H1 SOL 3862 18.010 45.210 10.130 1.00 0.00 ATOM 26690 H2 SOL 3862 18.750 43.900 9.970 1.00 0.00 ATOM 26691 OH2 SOL 3863 8.390 25.990 6.870 1.00 0.00 ATOM 26692 H1 SOL 3863 7.440 26.060 6.770 1.00 0.00 ATOM 26693 H2 SOL 3863 8.680 25.520 6.090 1.00 0.00 ATOM 26694 OH2 SOL 3864 52.510 55.120 2.500 1.00 0.00 ATOM 26695 H1 SOL 3864 51.740 55.000 1.940 1.00 0.00 ATOM 26696 H2 SOL 3864 52.240 55.770 3.150 1.00 0.00 ATOM 26697 OH2 SOL 3865 -0.090 14.940 81.850 1.00 0.00 ATOM 26698 H1 SOL 3865 -0.100 15.070 80.900 1.00 0.00 ATOM 26699 H2 SOL 3865 0.260 14.050 81.970 1.00 0.00 ATOM 26700 OH2 SOL 3866 36.260 39.450 3.830 1.00 0.00 ATOM 26701 H1 SOL 3866 37.160 39.690 3.630 1.00 0.00 ATOM 26702 H2 SOL 3866 35.760 40.260 3.740 1.00 0.00 ATOM 26703 OH2 SOL 3867 4.410 36.480 18.330 1.00 0.00 ATOM 26704 H1 SOL 3867 4.670 36.250 19.220 1.00 0.00 ATOM 26705 H2 SOL 3867 5.220 36.750 17.900 1.00 0.00 ATOM 26706 OH2 SOL 3868 50.450 51.600 71.900 1.00 0.00 ATOM 26707 H1 SOL 3868 50.390 50.650 71.920 1.00 0.00 ATOM 26708 H2 SOL 3868 49.630 51.900 72.300 1.00 0.00 ATOM 26709 OH2 SOL 3869 0.170 37.560 8.140 1.00 0.00 ATOM 26710 H1 SOL 3869 0.730 37.590 7.370 1.00 0.00 ATOM 26711 H2 SOL 3869 0.650 37.030 8.770 1.00 0.00 ATOM 26712 OH2 SOL 3870 55.550 12.840 24.260 1.00 0.00 ATOM 26713 H1 SOL 3870 54.880 12.610 24.900 1.00 0.00 ATOM 26714 H2 SOL 3870 55.080 13.280 23.560 1.00 0.00 ATOM 26715 OH2 SOL 3871 23.930 43.900 18.300 1.00 0.00 ATOM 26716 H1 SOL 3871 23.270 43.230 18.160 1.00 0.00 ATOM 26717 H2 SOL 3871 23.570 44.460 18.980 1.00 0.00 ATOM 26718 OH2 SOL 3872 38.970 16.730 65.340 1.00 0.00 ATOM 26719 H1 SOL 3872 39.280 16.630 64.440 1.00 0.00 ATOM 26720 H2 SOL 3872 38.560 15.890 65.550 1.00 0.00 ATOM 26721 OH2 SOL 3873 16.370 15.720 20.770 1.00 0.00 ATOM 26722 H1 SOL 3873 16.250 16.370 21.460 1.00 0.00 ATOM 26723 H2 SOL 3873 17.210 15.300 20.970 1.00 0.00 ATOM 26724 OH2 SOL 3874 34.430 40.000 20.110 1.00 0.00 ATOM 26725 H1 SOL 3874 35.340 40.000 19.790 1.00 0.00 ATOM 26726 H2 SOL 3874 34.040 40.780 19.700 1.00 0.00 ATOM 26727 OH2 SOL 3875 21.600 35.510 5.090 1.00 0.00 ATOM 26728 H1 SOL 3875 20.970 36.190 4.860 1.00 0.00 ATOM 26729 H2 SOL 3875 21.200 35.060 5.830 1.00 0.00 ATOM 26730 OH2 SOL 3876 5.000 23.280 10.200 1.00 0.00 ATOM 26731 H1 SOL 3876 5.330 22.960 11.040 1.00 0.00 ATOM 26732 H2 SOL 3876 5.330 22.660 9.550 1.00 0.00 ATOM 26733 OH2 SOL 3877 18.630 32.430 25.790 1.00 0.00 ATOM 26734 H1 SOL 3877 18.960 31.800 25.140 1.00 0.00 ATOM 26735 H2 SOL 3877 18.170 31.890 26.430 1.00 0.00 ATOM 26736 OH2 SOL 3878 57.300 9.120 18.700 1.00 0.00 ATOM 26737 H1 SOL 3878 56.560 9.390 19.250 1.00 0.00 ATOM 26738 H2 SOL 3878 57.700 8.390 19.180 1.00 0.00 ATOM 26739 OH2 SOL 3879 11.470 47.660 82.870 1.00 0.00 ATOM 26740 H1 SOL 3879 11.050 48.110 82.150 1.00 0.00 ATOM 26741 H2 SOL 3879 12.300 48.120 83.000 1.00 0.00 ATOM 26742 OH2 SOL 3880 33.610 21.920 19.000 1.00 0.00 ATOM 26743 H1 SOL 3880 33.460 22.350 18.150 1.00 0.00 ATOM 26744 H2 SOL 3880 33.050 22.390 19.610 1.00 0.00 ATOM 26745 OH2 SOL 3881 32.850 45.530 71.170 1.00 0.00 ATOM 26746 H1 SOL 3881 33.500 44.830 71.070 1.00 0.00 ATOM 26747 H2 SOL 3881 33.030 45.900 72.030 1.00 0.00 ATOM 26748 OH2 SOL 3882 8.720 36.720 15.350 1.00 0.00 ATOM 26749 H1 SOL 3882 9.530 36.810 15.850 1.00 0.00 ATOM 26750 H2 SOL 3882 8.140 36.200 15.920 1.00 0.00 ATOM 26751 OH2 SOL 3883 10.600 33.750 77.680 1.00 0.00 ATOM 26752 H1 SOL 3883 10.560 33.510 76.760 1.00 0.00 ATOM 26753 H2 SOL 3883 10.000 34.490 77.760 1.00 0.00 ATOM 26754 OH2 SOL 3884 20.340 2.500 13.750 1.00 0.00 ATOM 26755 H1 SOL 3884 21.070 2.250 14.320 1.00 0.00 ATOM 26756 H2 SOL 3884 20.560 2.140 12.900 1.00 0.00 ATOM 26757 OH2 SOL 3885 4.840 0.840 5.630 1.00 0.00 ATOM 26758 H1 SOL 3885 4.650 1.770 5.690 1.00 0.00 ATOM 26759 H2 SOL 3885 5.660 0.720 6.110 1.00 0.00 ATOM 26760 OH2 SOL 3886 21.710 38.780 9.900 1.00 0.00 ATOM 26761 H1 SOL 3886 21.160 39.550 10.050 1.00 0.00 ATOM 26762 H2 SOL 3886 22.270 38.730 10.670 1.00 0.00 ATOM 26763 OH2 SOL 3887 30.230 9.670 6.250 1.00 0.00 ATOM 26764 H1 SOL 3887 29.690 9.000 5.830 1.00 0.00 ATOM 26765 H2 SOL 3887 30.840 9.180 6.800 1.00 0.00 ATOM 26766 OH2 SOL 3888 37.970 20.620 71.240 1.00 0.00 ATOM 26767 H1 SOL 3888 37.890 21.400 71.790 1.00 0.00 ATOM 26768 H2 SOL 3888 37.530 20.860 70.420 1.00 0.00 ATOM 26769 OH2 SOL 3889 41.020 2.050 69.820 1.00 0.00 ATOM 26770 H1 SOL 3889 41.900 2.150 70.180 1.00 0.00 ATOM 26771 H2 SOL 3889 40.550 2.840 70.100 1.00 0.00 ATOM 26772 OH2 SOL 3890 42.750 28.350 19.260 1.00 0.00 ATOM 26773 H1 SOL 3890 41.960 28.170 18.750 1.00 0.00 ATOM 26774 H2 SOL 3890 43.190 27.500 19.330 1.00 0.00 ATOM 26775 OH2 SOL 3891 12.560 17.110 21.720 1.00 0.00 ATOM 26776 H1 SOL 3891 11.920 16.460 22.020 1.00 0.00 ATOM 26777 H2 SOL 3891 12.920 17.470 22.530 1.00 0.00 ATOM 26778 OH2 SOL 3892 40.800 14.230 84.270 1.00 0.00 ATOM 26779 H1 SOL 3892 41.500 13.650 84.580 1.00 0.00 ATOM 26780 H2 SOL 3892 40.200 13.650 83.800 1.00 0.00 ATOM 26781 OH2 SOL 3893 43.080 51.910 17.380 1.00 0.00 ATOM 26782 H1 SOL 3893 42.410 51.690 16.730 1.00 0.00 ATOM 26783 H2 SOL 3893 43.650 51.140 17.400 1.00 0.00 ATOM 26784 OH2 SOL 3894 25.860 52.760 17.220 1.00 0.00 ATOM 26785 H1 SOL 3894 26.030 52.230 18.000 1.00 0.00 ATOM 26786 H2 SOL 3894 25.670 52.110 16.540 1.00 0.00 ATOM 26787 OH2 SOL 3895 51.920 6.330 76.030 1.00 0.00 ATOM 26788 H1 SOL 3895 51.130 5.900 75.690 1.00 0.00 ATOM 26789 H2 SOL 3895 51.860 7.230 75.710 1.00 0.00 ATOM 26790 OH2 SOL 3896 11.590 10.500 1.310 1.00 0.00 ATOM 26791 H1 SOL 3896 12.310 11.030 0.960 1.00 0.00 ATOM 26792 H2 SOL 3896 11.380 10.900 2.150 1.00 0.00 ATOM 26793 OH2 SOL 3897 15.300 45.090 81.920 1.00 0.00 ATOM 26794 H1 SOL 3897 15.650 44.200 81.800 1.00 0.00 ATOM 26795 H2 SOL 3897 15.640 45.370 82.770 1.00 0.00 ATOM 26796 OH2 SOL 3898 11.270 40.460 16.710 1.00 0.00 ATOM 26797 H1 SOL 3898 10.670 40.570 17.450 1.00 0.00 ATOM 26798 H2 SOL 3898 11.760 39.670 16.910 1.00 0.00 ATOM 26799 OH2 SOL 3899 11.650 57.410 23.500 1.00 0.00 ATOM 26800 H1 SOL 3899 11.070 57.550 24.240 1.00 0.00 ATOM 26801 H2 SOL 3899 11.130 56.890 22.880 1.00 0.00 ATOM 26802 OH2 SOL 3900 38.480 55.320 10.140 1.00 0.00 ATOM 26803 H1 SOL 3900 39.140 54.770 9.730 1.00 0.00 ATOM 26804 H2 SOL 3900 38.610 55.210 11.080 1.00 0.00 ATOM 26805 OH2 SOL 3901 22.890 42.750 80.870 1.00 0.00 ATOM 26806 H1 SOL 3901 23.210 43.430 80.280 1.00 0.00 ATOM 26807 H2 SOL 3901 23.010 43.120 81.740 1.00 0.00 ATOM 26808 OH2 SOL 3902 35.390 60.530 1.680 1.00 0.00 ATOM 26809 H1 SOL 3902 36.130 59.930 1.560 1.00 0.00 ATOM 26810 H2 SOL 3902 35.480 61.170 0.970 1.00 0.00 ATOM 26811 OH2 SOL 3903 10.740 32.210 81.220 1.00 0.00 ATOM 26812 H1 SOL 3903 9.790 32.300 81.250 1.00 0.00 ATOM 26813 H2 SOL 3903 11.030 32.420 82.110 1.00 0.00 ATOM 26814 OH2 SOL 3904 40.310 6.710 70.990 1.00 0.00 ATOM 26815 H1 SOL 3904 39.870 6.210 70.300 1.00 0.00 ATOM 26816 H2 SOL 3904 39.720 6.650 71.740 1.00 0.00 ATOM 26817 OH2 SOL 3905 47.440 60.530 68.350 1.00 0.00 ATOM 26818 H1 SOL 3905 47.820 59.770 68.800 1.00 0.00 ATOM 26819 H2 SOL 3905 46.560 60.240 68.110 1.00 0.00 ATOM 26820 OH2 SOL 3906 52.590 0.740 80.450 1.00 0.00 ATOM 26821 H1 SOL 3906 52.950 0.110 79.820 1.00 0.00 ATOM 26822 H2 SOL 3906 53.330 0.990 81.000 1.00 0.00 ATOM 26823 OH2 SOL 3907 8.780 52.610 13.590 1.00 0.00 ATOM 26824 H1 SOL 3907 8.390 53.380 13.160 1.00 0.00 ATOM 26825 H2 SOL 3907 8.970 52.900 14.480 1.00 0.00 ATOM 26826 OH2 SOL 3908 3.250 15.520 17.490 1.00 0.00 ATOM 26827 H1 SOL 3908 3.990 15.230 16.960 1.00 0.00 ATOM 26828 H2 SOL 3908 3.070 14.790 18.080 1.00 0.00 ATOM 26829 OH2 SOL 3909 31.920 3.840 19.650 1.00 0.00 ATOM 26830 H1 SOL 3909 31.520 4.210 18.870 1.00 0.00 ATOM 26831 H2 SOL 3909 31.190 3.430 20.120 1.00 0.00 ATOM 26832 OH2 SOL 3910 30.450 26.010 81.280 1.00 0.00 ATOM 26833 H1 SOL 3910 31.100 26.580 80.850 1.00 0.00 ATOM 26834 H2 SOL 3910 30.150 25.430 80.580 1.00 0.00 ATOM 26835 OH2 SOL 3911 27.760 14.150 69.560 1.00 0.00 ATOM 26836 H1 SOL 3911 27.860 14.610 70.400 1.00 0.00 ATOM 26837 H2 SOL 3911 27.150 13.440 69.750 1.00 0.00 ATOM 26838 OH2 SOL 3912 16.210 31.540 15.440 1.00 0.00 ATOM 26839 H1 SOL 3912 15.610 30.790 15.470 1.00 0.00 ATOM 26840 H2 SOL 3912 17.050 31.160 15.180 1.00 0.00 ATOM 26841 OH2 SOL 3913 3.810 46.260 64.610 1.00 0.00 ATOM 26842 H1 SOL 3913 4.710 46.250 64.920 1.00 0.00 ATOM 26843 H2 SOL 3913 3.750 45.510 64.020 1.00 0.00 ATOM 26844 OH2 SOL 3914 47.690 22.270 16.260 1.00 0.00 ATOM 26845 H1 SOL 3914 48.430 22.840 16.050 1.00 0.00 ATOM 26846 H2 SOL 3914 47.190 22.200 15.450 1.00 0.00 ATOM 26847 OH2 SOL 3915 41.280 7.470 19.500 1.00 0.00 ATOM 26848 H1 SOL 3915 41.220 6.770 18.850 1.00 0.00 ATOM 26849 H2 SOL 3915 40.380 7.580 19.810 1.00 0.00 ATOM 26850 OH2 SOL 3916 19.590 13.950 7.030 1.00 0.00 ATOM 26851 H1 SOL 3916 18.830 13.860 6.460 1.00 0.00 ATOM 26852 H2 SOL 3916 19.890 14.850 6.890 1.00 0.00 ATOM 26853 OH2 SOL 3917 9.140 2.840 13.360 1.00 0.00 ATOM 26854 H1 SOL 3917 8.860 2.830 14.270 1.00 0.00 ATOM 26855 H2 SOL 3917 9.210 1.920 13.120 1.00 0.00 ATOM 26856 OH2 SOL 3918 51.210 58.760 22.820 1.00 0.00 ATOM 26857 H1 SOL 3918 50.600 59.500 22.800 1.00 0.00 ATOM 26858 H2 SOL 3918 51.160 58.390 21.930 1.00 0.00 ATOM 26859 OH2 SOL 3919 36.170 20.860 18.990 1.00 0.00 ATOM 26860 H1 SOL 3919 35.270 21.190 18.920 1.00 0.00 ATOM 26861 H2 SOL 3919 36.320 20.410 18.160 1.00 0.00 ATOM 26862 OH2 SOL 3920 42.890 16.490 10.380 1.00 0.00 ATOM 26863 H1 SOL 3920 42.210 17.110 10.110 1.00 0.00 ATOM 26864 H2 SOL 3920 43.580 16.590 9.720 1.00 0.00 ATOM 26865 OH2 SOL 3921 53.910 19.000 72.360 1.00 0.00 ATOM 26866 H1 SOL 3921 54.660 19.500 72.680 1.00 0.00 ATOM 26867 H2 SOL 3921 54.280 18.220 71.950 1.00 0.00 ATOM 26868 OH2 SOL 3922 25.030 52.710 24.220 1.00 0.00 ATOM 26869 H1 SOL 3922 24.660 53.470 23.780 1.00 0.00 ATOM 26870 H2 SOL 3922 24.910 52.890 25.150 1.00 0.00 ATOM 26871 OH2 SOL 3923 52.280 49.770 73.780 1.00 0.00 ATOM 26872 H1 SOL 3923 52.900 49.390 73.170 1.00 0.00 ATOM 26873 H2 SOL 3923 52.710 49.720 74.630 1.00 0.00 ATOM 26874 OH2 SOL 3924 33.700 47.910 80.240 1.00 0.00 ATOM 26875 H1 SOL 3924 33.480 47.100 80.690 1.00 0.00 ATOM 26876 H2 SOL 3924 33.380 47.780 79.340 1.00 0.00 ATOM 26877 OH2 SOL 3925 53.510 44.410 2.660 1.00 0.00 ATOM 26878 H1 SOL 3925 54.440 44.530 2.860 1.00 0.00 ATOM 26879 H2 SOL 3925 53.490 44.190 1.730 1.00 0.00 ATOM 26880 OH2 SOL 3926 10.280 58.070 68.500 1.00 0.00 ATOM 26881 H1 SOL 3926 10.590 57.280 68.940 1.00 0.00 ATOM 26882 H2 SOL 3926 10.950 58.260 67.840 1.00 0.00 ATOM 26883 OH2 SOL 3927 32.590 6.210 80.150 1.00 0.00 ATOM 26884 H1 SOL 3927 32.900 5.690 80.890 1.00 0.00 ATOM 26885 H2 SOL 3927 31.860 5.710 79.790 1.00 0.00 ATOM 26886 OH2 SOL 3928 54.550 9.330 19.270 1.00 0.00 ATOM 26887 H1 SOL 3928 53.970 8.600 19.080 1.00 0.00 ATOM 26888 H2 SOL 3928 54.730 9.720 18.410 1.00 0.00 ATOM 26889 OH2 SOL 3929 31.710 18.720 5.800 1.00 0.00 ATOM 26890 H1 SOL 3929 31.410 18.640 6.710 1.00 0.00 ATOM 26891 H2 SOL 3929 31.180 19.440 5.440 1.00 0.00 ATOM 26892 OH2 SOL 3930 20.970 18.370 10.310 1.00 0.00 ATOM 26893 H1 SOL 3930 20.050 18.130 10.180 1.00 0.00 ATOM 26894 H2 SOL 3930 20.940 19.170 10.830 1.00 0.00 ATOM 26895 OH2 SOL 3931 42.890 29.660 9.620 1.00 0.00 ATOM 26896 H1 SOL 3931 43.060 29.450 8.700 1.00 0.00 ATOM 26897 H2 SOL 3931 43.200 28.890 10.100 1.00 0.00 ATOM 26898 OH2 SOL 3932 39.290 38.760 8.790 1.00 0.00 ATOM 26899 H1 SOL 3932 38.960 39.370 9.450 1.00 0.00 ATOM 26900 H2 SOL 3932 38.520 38.270 8.510 1.00 0.00 ATOM 26901 OH2 SOL 3933 13.360 19.580 73.310 1.00 0.00 ATOM 26902 H1 SOL 3933 13.490 18.740 73.740 1.00 0.00 ATOM 26903 H2 SOL 3933 12.900 20.120 73.960 1.00 0.00 ATOM 26904 OH2 SOL 3934 45.020 12.580 29.190 1.00 0.00 ATOM 26905 H1 SOL 3934 45.150 11.720 29.580 1.00 0.00 ATOM 26906 H2 SOL 3934 45.890 12.980 29.210 1.00 0.00 ATOM 26907 OH2 SOL 3935 5.030 40.640 3.480 1.00 0.00 ATOM 26908 H1 SOL 3935 4.500 40.530 4.270 1.00 0.00 ATOM 26909 H2 SOL 3935 5.850 41.020 3.800 1.00 0.00 ATOM 26910 OH2 SOL 3936 43.920 15.770 20.980 1.00 0.00 ATOM 26911 H1 SOL 3936 44.160 15.730 21.900 1.00 0.00 ATOM 26912 H2 SOL 3936 42.960 15.750 20.970 1.00 0.00 ATOM 26913 OH2 SOL 3937 16.050 37.660 70.770 1.00 0.00 ATOM 26914 H1 SOL 3937 16.800 37.200 71.140 1.00 0.00 ATOM 26915 H2 SOL 3937 15.730 38.210 71.480 1.00 0.00 ATOM 26916 OH2 SOL 3938 14.180 52.220 2.720 1.00 0.00 ATOM 26917 H1 SOL 3938 13.560 52.940 2.580 1.00 0.00 ATOM 26918 H2 SOL 3938 13.720 51.630 3.320 1.00 0.00 ATOM 26919 OH2 SOL 3939 7.610 43.470 64.390 1.00 0.00 ATOM 26920 H1 SOL 3939 8.340 43.350 65.000 1.00 0.00 ATOM 26921 H2 SOL 3939 8.030 43.630 63.550 1.00 0.00 ATOM 26922 OH2 SOL 3940 54.550 39.300 4.140 1.00 0.00 ATOM 26923 H1 SOL 3940 54.180 38.480 3.810 1.00 0.00 ATOM 26924 H2 SOL 3940 54.550 39.880 3.380 1.00 0.00 ATOM 26925 OH2 SOL 3941 45.490 40.800 20.050 1.00 0.00 ATOM 26926 H1 SOL 3941 45.090 41.360 19.390 1.00 0.00 ATOM 26927 H2 SOL 3941 44.760 40.280 20.390 1.00 0.00 ATOM 26928 OH2 SOL 3942 55.070 34.840 27.670 1.00 0.00 ATOM 26929 H1 SOL 3942 54.120 34.930 27.610 1.00 0.00 ATOM 26930 H2 SOL 3942 55.410 35.720 27.520 1.00 0.00 ATOM 26931 OH2 SOL 3943 8.900 42.880 5.920 1.00 0.00 ATOM 26932 H1 SOL 3943 9.750 42.710 5.510 1.00 0.00 ATOM 26933 H2 SOL 3943 9.080 42.900 6.860 1.00 0.00 ATOM 26934 OH2 SOL 3944 46.530 2.990 3.920 1.00 0.00 ATOM 26935 H1 SOL 3944 47.480 3.080 3.950 1.00 0.00 ATOM 26936 H2 SOL 3944 46.230 3.790 3.480 1.00 0.00 ATOM 26937 OH2 SOL 3945 12.470 7.350 84.290 1.00 0.00 ATOM 26938 H1 SOL 3945 12.840 7.410 85.170 1.00 0.00 ATOM 26939 H2 SOL 3945 11.710 7.930 84.310 1.00 0.00 ATOM 26940 OH2 SOL 3946 19.490 16.710 1.710 1.00 0.00 ATOM 26941 H1 SOL 3946 20.150 17.120 1.150 1.00 0.00 ATOM 26942 H2 SOL 3946 18.660 17.120 1.450 1.00 0.00 ATOM 26943 OH2 SOL 3947 11.340 23.440 76.280 1.00 0.00 ATOM 26944 H1 SOL 3947 11.950 23.040 76.900 1.00 0.00 ATOM 26945 H2 SOL 3947 10.560 23.630 76.790 1.00 0.00 ATOM 26946 OH2 SOL 3948 53.600 34.630 63.310 1.00 0.00 ATOM 26947 H1 SOL 3948 52.690 34.420 63.510 1.00 0.00 ATOM 26948 H2 SOL 3948 53.560 35.410 62.760 1.00 0.00 ATOM 26949 OH2 SOL 3949 1.470 23.130 71.800 1.00 0.00 ATOM 26950 H1 SOL 3949 0.590 23.480 71.920 1.00 0.00 ATOM 26951 H2 SOL 3949 1.620 22.560 72.550 1.00 0.00 ATOM 26952 OH2 SOL 3950 58.640 56.560 19.180 1.00 0.00 ATOM 26953 H1 SOL 3950 57.750 56.260 19.390 1.00 0.00 ATOM 26954 H2 SOL 3950 58.880 57.130 19.920 1.00 0.00 ATOM 26955 OH2 SOL 3951 57.940 1.900 73.670 1.00 0.00 ATOM 26956 H1 SOL 3951 58.310 2.190 74.500 1.00 0.00 ATOM 26957 H2 SOL 3951 57.000 1.840 73.830 1.00 0.00 ATOM 26958 OH2 SOL 3952 32.710 1.320 19.490 1.00 0.00 ATOM 26959 H1 SOL 3952 32.620 2.280 19.460 1.00 0.00 ATOM 26960 H2 SOL 3952 32.980 1.130 20.390 1.00 0.00 ATOM 26961 OH2 SOL 3953 0.440 20.650 67.110 1.00 0.00 ATOM 26962 H1 SOL 3953 1.170 20.640 66.490 1.00 0.00 ATOM 26963 H2 SOL 3953 -0.090 19.890 66.870 1.00 0.00 ATOM 26964 OH2 SOL 3954 33.250 56.420 12.870 1.00 0.00 ATOM 26965 H1 SOL 3954 33.620 56.240 13.740 1.00 0.00 ATOM 26966 H2 SOL 3954 32.830 57.280 12.970 1.00 0.00 ATOM 26967 OH2 SOL 3955 27.620 56.720 20.810 1.00 0.00 ATOM 26968 H1 SOL 3955 27.380 56.240 21.600 1.00 0.00 ATOM 26969 H2 SOL 3955 27.780 57.620 21.100 1.00 0.00 ATOM 26970 OH2 SOL 3956 21.960 5.310 19.010 1.00 0.00 ATOM 26971 H1 SOL 3956 22.820 5.620 18.740 1.00 0.00 ATOM 26972 H2 SOL 3956 21.340 5.810 18.470 1.00 0.00 ATOM 26973 OH2 SOL 3957 5.900 34.820 79.140 1.00 0.00 ATOM 26974 H1 SOL 3957 5.220 34.340 79.620 1.00 0.00 ATOM 26975 H2 SOL 3957 6.470 35.170 79.820 1.00 0.00 ATOM 26976 OH2 SOL 3958 30.120 48.900 75.340 1.00 0.00 ATOM 26977 H1 SOL 3958 29.900 48.050 74.960 1.00 0.00 ATOM 26978 H2 SOL 3958 29.920 49.540 74.650 1.00 0.00 ATOM 26979 OH2 SOL 3959 51.400 49.150 21.420 1.00 0.00 ATOM 26980 H1 SOL 3959 51.990 48.680 22.010 1.00 0.00 ATOM 26981 H2 SOL 3959 51.520 50.070 21.640 1.00 0.00 ATOM 26982 OH2 SOL 3960 2.110 26.860 64.080 1.00 0.00 ATOM 26983 H1 SOL 3960 2.320 27.640 63.570 1.00 0.00 ATOM 26984 H2 SOL 3960 2.000 27.180 64.970 1.00 0.00 ATOM 26985 OH2 SOL 3961 0.420 48.970 8.570 1.00 0.00 ATOM 26986 H1 SOL 3961 0.500 48.020 8.580 1.00 0.00 ATOM 26987 H2 SOL 3961 1.150 49.290 9.100 1.00 0.00 ATOM 26988 OH2 SOL 3962 30.680 51.330 9.180 1.00 0.00 ATOM 26989 H1 SOL 3962 31.480 51.690 8.800 1.00 0.00 ATOM 26990 H2 SOL 3962 30.630 51.710 10.050 1.00 0.00 ATOM 26991 OH2 SOL 3963 20.810 58.340 79.640 1.00 0.00 ATOM 26992 H1 SOL 3963 19.890 58.610 79.670 1.00 0.00 ATOM 26993 H2 SOL 3963 21.020 58.100 80.540 1.00 0.00 ATOM 26994 OH2 SOL 3964 54.710 21.110 76.840 1.00 0.00 ATOM 26995 H1 SOL 3964 53.880 21.410 77.220 1.00 0.00 ATOM 26996 H2 SOL 3964 54.640 20.160 76.840 1.00 0.00 ATOM 26997 OH2 SOL 3965 11.350 43.060 0.540 1.00 0.00 ATOM 26998 H1 SOL 3965 12.290 43.100 0.720 1.00 0.00 ATOM 26999 H2 SOL 3965 11.260 43.380 -0.360 1.00 0.00 ATOM 27000 OH2 SOL 3966 48.980 9.110 22.800 1.00 0.00 ATOM 27001 H1 SOL 3966 49.630 8.810 22.170 1.00 0.00 ATOM 27002 H2 SOL 3966 49.360 9.910 23.170 1.00 0.00 ATOM 27003 OH2 SOL 3967 49.880 32.570 66.340 1.00 0.00 ATOM 27004 H1 SOL 3967 49.310 32.920 67.020 1.00 0.00 ATOM 27005 H2 SOL 3967 50.380 33.320 66.030 1.00 0.00 ATOM 27006 OH2 SOL 3968 52.670 11.010 23.210 1.00 0.00 ATOM 27007 H1 SOL 3968 52.010 11.460 22.670 1.00 0.00 ATOM 27008 H2 SOL 3968 52.760 11.550 23.990 1.00 0.00 ATOM 27009 OH2 SOL 3969 33.540 12.650 8.060 1.00 0.00 ATOM 27010 H1 SOL 3969 33.990 11.850 7.800 1.00 0.00 ATOM 27011 H2 SOL 3969 33.980 13.350 7.570 1.00 0.00 ATOM 27012 OH2 SOL 3970 2.520 48.400 77.910 1.00 0.00 ATOM 27013 H1 SOL 3970 2.980 48.360 77.070 1.00 0.00 ATOM 27014 H2 SOL 3970 1.690 47.960 77.750 1.00 0.00 ATOM 27015 OH2 SOL 3971 3.360 59.820 4.420 1.00 0.00 ATOM 27016 H1 SOL 3971 2.970 59.320 5.140 1.00 0.00 ATOM 27017 H2 SOL 3971 3.890 60.490 4.860 1.00 0.00 ATOM 27018 OH2 SOL 3972 31.710 38.970 69.920 1.00 0.00 ATOM 27019 H1 SOL 3972 31.560 38.960 70.870 1.00 0.00 ATOM 27020 H2 SOL 3972 31.270 38.180 69.610 1.00 0.00 ATOM 27021 OH2 SOL 3973 37.590 14.260 7.220 1.00 0.00 ATOM 27022 H1 SOL 3973 37.410 15.090 7.660 1.00 0.00 ATOM 27023 H2 SOL 3973 37.900 14.520 6.350 1.00 0.00 ATOM 27024 OH2 SOL 3974 31.870 15.390 70.580 1.00 0.00 ATOM 27025 H1 SOL 3974 32.310 14.550 70.650 1.00 0.00 ATOM 27026 H2 SOL 3974 31.400 15.350 69.750 1.00 0.00 ATOM 27027 OH2 SOL 3975 48.870 56.280 17.130 1.00 0.00 ATOM 27028 H1 SOL 3975 49.050 55.740 17.900 1.00 0.00 ATOM 27029 H2 SOL 3975 48.430 57.050 17.470 1.00 0.00 ATOM 27030 OH2 SOL 3976 34.400 47.740 63.190 1.00 0.00 ATOM 27031 H1 SOL 3976 34.740 46.980 63.660 1.00 0.00 ATOM 27032 H2 SOL 3976 33.450 47.640 63.220 1.00 0.00 ATOM 27033 OH2 SOL 3977 42.990 60.470 3.590 1.00 0.00 ATOM 27034 H1 SOL 3977 43.490 60.700 4.380 1.00 0.00 ATOM 27035 H2 SOL 3977 43.320 61.080 2.920 1.00 0.00 ATOM 27036 OH2 SOL 3978 26.840 52.280 12.760 1.00 0.00 ATOM 27037 H1 SOL 3978 27.150 52.240 13.670 1.00 0.00 ATOM 27038 H2 SOL 3978 26.620 53.200 12.630 1.00 0.00 ATOM 27039 OH2 SOL 3979 16.690 5.620 10.580 1.00 0.00 ATOM 27040 H1 SOL 3979 15.890 5.140 10.770 1.00 0.00 ATOM 27041 H2 SOL 3979 16.910 6.070 11.400 1.00 0.00 ATOM 27042 OH2 SOL 3980 12.440 23.600 6.760 1.00 0.00 ATOM 27043 H1 SOL 3980 13.040 23.850 6.050 1.00 0.00 ATOM 27044 H2 SOL 3980 12.540 24.300 7.410 1.00 0.00 ATOM 27045 OH2 SOL 3981 44.780 23.710 8.410 1.00 0.00 ATOM 27046 H1 SOL 3981 44.060 24.330 8.440 1.00 0.00 ATOM 27047 H2 SOL 3981 45.290 23.980 7.640 1.00 0.00 ATOM 27048 OH2 SOL 3982 53.700 26.050 71.870 1.00 0.00 ATOM 27049 H1 SOL 3982 53.950 25.590 71.070 1.00 0.00 ATOM 27050 H2 SOL 3982 54.230 25.650 72.560 1.00 0.00 ATOM 27051 OH2 SOL 3983 27.090 15.510 66.980 1.00 0.00 ATOM 27052 H1 SOL 3983 26.890 14.960 67.740 1.00 0.00 ATOM 27053 H2 SOL 3983 26.770 15.000 66.230 1.00 0.00 ATOM 27054 OH2 SOL 3984 25.770 46.450 80.330 1.00 0.00 ATOM 27055 H1 SOL 3984 26.700 46.230 80.240 1.00 0.00 ATOM 27056 H2 SOL 3984 25.750 47.410 80.360 1.00 0.00 ATOM 27057 OH2 SOL 3985 8.900 50.710 65.840 1.00 0.00 ATOM 27058 H1 SOL 3985 8.130 50.270 65.500 1.00 0.00 ATOM 27059 H2 SOL 3985 9.350 51.050 65.070 1.00 0.00 ATOM 27060 OH2 SOL 3986 7.920 13.860 5.570 1.00 0.00 ATOM 27061 H1 SOL 3986 8.760 14.110 5.950 1.00 0.00 ATOM 27062 H2 SOL 3986 7.580 14.670 5.180 1.00 0.00 ATOM 27063 OH2 SOL 3987 29.730 55.050 80.460 1.00 0.00 ATOM 27064 H1 SOL 3987 29.940 54.250 79.980 1.00 0.00 ATOM 27065 H2 SOL 3987 29.520 54.760 81.350 1.00 0.00 ATOM 27066 OH2 SOL 3988 43.910 59.060 61.420 1.00 0.00 ATOM 27067 H1 SOL 3988 44.160 59.970 61.230 1.00 0.00 ATOM 27068 H2 SOL 3988 44.740 58.580 61.460 1.00 0.00 ATOM 27069 OH2 SOL 3989 50.680 12.170 17.670 1.00 0.00 ATOM 27070 H1 SOL 3989 49.800 12.520 17.560 1.00 0.00 ATOM 27071 H2 SOL 3989 50.540 11.270 17.970 1.00 0.00 ATOM 27072 OH2 SOL 3990 48.200 58.100 8.220 1.00 0.00 ATOM 27073 H1 SOL 3990 48.110 58.510 7.360 1.00 0.00 ATOM 27074 H2 SOL 3990 48.740 57.330 8.060 1.00 0.00 ATOM 27075 OH2 SOL 3991 16.830 12.870 72.690 1.00 0.00 ATOM 27076 H1 SOL 3991 16.530 13.680 73.110 1.00 0.00 ATOM 27077 H2 SOL 3991 17.660 13.110 72.290 1.00 0.00 ATOM 27078 OH2 SOL 3992 50.590 30.260 83.800 1.00 0.00 ATOM 27079 H1 SOL 3992 51.050 29.860 84.540 1.00 0.00 ATOM 27080 H2 SOL 3992 50.000 29.580 83.480 1.00 0.00 ATOM 27081 OH2 SOL 3993 39.960 26.470 64.130 1.00 0.00 ATOM 27082 H1 SOL 3993 39.250 26.290 64.750 1.00 0.00 ATOM 27083 H2 SOL 3993 40.690 26.760 64.670 1.00 0.00 ATOM 27084 OH2 SOL 3994 24.760 5.000 9.010 1.00 0.00 ATOM 27085 H1 SOL 3994 25.190 5.680 8.480 1.00 0.00 ATOM 27086 H2 SOL 3994 24.050 4.680 8.460 1.00 0.00 ATOM 27087 OH2 SOL 3995 28.760 4.580 4.520 1.00 0.00 ATOM 27088 H1 SOL 3995 28.760 4.070 3.710 1.00 0.00 ATOM 27089 H2 SOL 3995 29.270 4.070 5.140 1.00 0.00 ATOM 27090 OH2 SOL 3996 59.140 13.060 76.200 1.00 0.00 ATOM 27091 H1 SOL 3996 58.460 13.280 75.560 1.00 0.00 ATOM 27092 H2 SOL 3996 59.730 13.810 76.190 1.00 0.00 ATOM 27093 OH2 SOL 3997 58.200 9.220 6.480 1.00 0.00 ATOM 27094 H1 SOL 3997 57.440 9.700 6.810 1.00 0.00 ATOM 27095 H2 SOL 3997 58.950 9.740 6.760 1.00 0.00 ATOM 27096 OH2 SOL 3998 38.540 9.700 13.310 1.00 0.00 ATOM 27097 H1 SOL 3998 38.070 8.940 12.960 1.00 0.00 ATOM 27098 H2 SOL 3998 39.470 9.450 13.240 1.00 0.00 ATOM 27099 OH2 SOL 3999 42.300 27.560 82.290 1.00 0.00 ATOM 27100 H1 SOL 3999 41.700 26.820 82.210 1.00 0.00 ATOM 27101 H2 SOL 3999 41.810 28.300 81.930 1.00 0.00 ATOM 27102 OH2 SOL 4000 25.320 1.670 24.730 1.00 0.00 ATOM 27103 H1 SOL 4000 25.460 2.490 25.190 1.00 0.00 ATOM 27104 H2 SOL 4000 26.030 1.620 24.090 1.00 0.00 ATOM 27105 OH2 SOL 4001 43.680 31.840 18.310 1.00 0.00 ATOM 27106 H1 SOL 4001 44.110 32.690 18.220 1.00 0.00 ATOM 27107 H2 SOL 4001 42.750 32.040 18.300 1.00 0.00 ATOM 27108 OH2 SOL 4002 25.040 40.430 80.620 1.00 0.00 ATOM 27109 H1 SOL 4002 25.390 40.540 79.740 1.00 0.00 ATOM 27110 H2 SOL 4002 24.300 41.050 80.660 1.00 0.00 ATOM 27111 OH2 SOL 4003 49.910 36.360 69.820 1.00 0.00 ATOM 27112 H1 SOL 4003 49.400 37.130 69.580 1.00 0.00 ATOM 27113 H2 SOL 4003 49.660 35.700 69.170 1.00 0.00 ATOM 27114 OH2 SOL 4004 36.220 41.880 82.900 1.00 0.00 ATOM 27115 H1 SOL 4004 36.430 41.090 82.410 1.00 0.00 ATOM 27116 H2 SOL 4004 35.780 41.570 83.680 1.00 0.00 ATOM 27117 OH2 SOL 4005 23.450 18.100 59.970 1.00 0.00 ATOM 27118 H1 SOL 4005 23.290 17.170 60.140 1.00 0.00 ATOM 27119 H2 SOL 4005 24.090 18.360 60.630 1.00 0.00 ATOM 27120 OH2 SOL 4006 3.280 3.050 8.380 1.00 0.00 ATOM 27121 H1 SOL 4006 2.460 3.020 7.890 1.00 0.00 ATOM 27122 H2 SOL 4006 3.940 3.300 7.730 1.00 0.00 ATOM 27123 OH2 SOL 4007 55.220 11.350 82.400 1.00 0.00 ATOM 27124 H1 SOL 4007 55.110 10.470 82.770 1.00 0.00 ATOM 27125 H2 SOL 4007 54.360 11.560 82.050 1.00 0.00 ATOM 27126 OH2 SOL 4008 54.130 19.090 0.940 1.00 0.00 ATOM 27127 H1 SOL 4008 53.890 18.970 1.860 1.00 0.00 ATOM 27128 H2 SOL 4008 55.080 18.990 0.930 1.00 0.00 ATOM 27129 OH2 SOL 4009 10.090 13.680 1.620 1.00 0.00 ATOM 27130 H1 SOL 4009 9.920 13.130 2.390 1.00 0.00 ATOM 27131 H2 SOL 4009 11.020 13.530 1.430 1.00 0.00 ATOM 27132 OH2 SOL 4010 12.270 30.910 8.770 1.00 0.00 ATOM 27133 H1 SOL 4010 12.100 31.820 8.510 1.00 0.00 ATOM 27134 H2 SOL 4010 11.420 30.590 9.080 1.00 0.00 ATOM 27135 OH2 SOL 4011 32.220 32.200 18.720 1.00 0.00 ATOM 27136 H1 SOL 4011 32.390 31.300 18.970 1.00 0.00 ATOM 27137 H2 SOL 4011 32.820 32.370 17.990 1.00 0.00 ATOM 27138 OH2 SOL 4012 33.140 50.170 81.850 1.00 0.00 ATOM 27139 H1 SOL 4012 33.410 49.310 81.530 1.00 0.00 ATOM 27140 H2 SOL 4012 33.690 50.330 82.620 1.00 0.00 ATOM 27141 OH2 SOL 4013 33.610 55.290 15.460 1.00 0.00 ATOM 27142 H1 SOL 4013 33.360 55.220 16.380 1.00 0.00 ATOM 27143 H2 SOL 4013 33.300 54.480 15.060 1.00 0.00 ATOM 27144 OH2 SOL 4014 21.080 15.300 18.700 1.00 0.00 ATOM 27145 H1 SOL 4014 21.990 15.560 18.860 1.00 0.00 ATOM 27146 H2 SOL 4014 20.760 15.940 18.060 1.00 0.00 ATOM 27147 OH2 SOL 4015 12.180 34.560 72.990 1.00 0.00 ATOM 27148 H1 SOL 4015 12.520 34.280 72.140 1.00 0.00 ATOM 27149 H2 SOL 4015 11.240 34.680 72.860 1.00 0.00 ATOM 27150 OH2 SOL 4016 50.660 43.030 22.370 1.00 0.00 ATOM 27151 H1 SOL 4016 49.820 43.460 22.190 1.00 0.00 ATOM 27152 H2 SOL 4016 51.310 43.730 22.290 1.00 0.00 ATOM 27153 OH2 SOL 4017 1.720 14.540 76.800 1.00 0.00 ATOM 27154 H1 SOL 4017 2.180 15.360 76.980 1.00 0.00 ATOM 27155 H2 SOL 4017 2.050 13.930 77.460 1.00 0.00 ATOM 27156 OH2 SOL 4018 11.030 41.260 71.180 1.00 0.00 ATOM 27157 H1 SOL 4018 10.210 41.400 71.650 1.00 0.00 ATOM 27158 H2 SOL 4018 11.670 41.070 71.870 1.00 0.00 ATOM 27159 OH2 SOL 4019 9.040 47.510 14.640 1.00 0.00 ATOM 27160 H1 SOL 4019 9.310 47.650 13.740 1.00 0.00 ATOM 27161 H2 SOL 4019 8.740 46.600 14.670 1.00 0.00 ATOM 27162 OH2 SOL 4020 50.940 22.090 80.130 1.00 0.00 ATOM 27163 H1 SOL 4020 50.440 21.330 80.410 1.00 0.00 ATOM 27164 H2 SOL 4020 50.430 22.840 80.440 1.00 0.00 ATOM 27165 OH2 SOL 4021 31.820 36.700 5.010 1.00 0.00 ATOM 27166 H1 SOL 4021 31.720 35.780 4.780 1.00 0.00 ATOM 27167 H2 SOL 4021 31.840 36.710 5.960 1.00 0.00 ATOM 27168 OH2 SOL 4022 55.320 52.910 71.860 1.00 0.00 ATOM 27169 H1 SOL 4022 55.650 52.010 71.860 1.00 0.00 ATOM 27170 H2 SOL 4022 55.840 53.350 71.190 1.00 0.00 ATOM 27171 OH2 SOL 4023 27.240 43.420 10.170 1.00 0.00 ATOM 27172 H1 SOL 4023 27.660 42.680 9.730 1.00 0.00 ATOM 27173 H2 SOL 4023 27.940 44.060 10.270 1.00 0.00 ATOM 27174 OH2 SOL 4024 17.950 8.160 6.280 1.00 0.00 ATOM 27175 H1 SOL 4024 17.660 7.420 6.810 1.00 0.00 ATOM 27176 H2 SOL 4024 17.570 8.020 5.420 1.00 0.00 ATOM 27177 OH2 SOL 4025 3.880 22.340 15.520 1.00 0.00 ATOM 27178 H1 SOL 4025 4.520 22.300 16.240 1.00 0.00 ATOM 27179 H2 SOL 4025 3.310 21.590 15.670 1.00 0.00 ATOM 27180 OH2 SOL 4026 2.160 0.800 58.820 1.00 0.00 ATOM 27181 H1 SOL 4026 1.600 0.020 58.850 1.00 0.00 ATOM 27182 H2 SOL 4026 2.970 0.490 58.410 1.00 0.00 ATOM 27183 OH2 SOL 4027 37.100 10.220 70.580 1.00 0.00 ATOM 27184 H1 SOL 4027 36.170 10.190 70.810 1.00 0.00 ATOM 27185 H2 SOL 4027 37.560 10.030 71.400 1.00 0.00 ATOM 27186 OH2 SOL 4028 56.910 31.350 72.650 1.00 0.00 ATOM 27187 H1 SOL 4028 56.970 30.570 72.110 1.00 0.00 ATOM 27188 H2 SOL 4028 57.440 32.000 72.200 1.00 0.00 ATOM 27189 OH2 SOL 4029 6.800 31.040 62.250 1.00 0.00 ATOM 27190 H1 SOL 4029 7.690 30.880 62.550 1.00 0.00 ATOM 27191 H2 SOL 4029 6.280 30.350 62.680 1.00 0.00 ATOM 27192 OH2 SOL 4030 38.680 45.910 7.930 1.00 0.00 ATOM 27193 H1 SOL 4030 37.870 45.400 7.900 1.00 0.00 ATOM 27194 H2 SOL 4030 39.150 45.570 8.680 1.00 0.00 ATOM 27195 OH2 SOL 4031 56.530 23.620 11.690 1.00 0.00 ATOM 27196 H1 SOL 4031 56.000 23.680 12.490 1.00 0.00 ATOM 27197 H2 SOL 4031 56.230 22.810 11.270 1.00 0.00 ATOM 27198 OH2 SOL 4032 5.540 5.130 2.130 1.00 0.00 ATOM 27199 H1 SOL 4032 4.860 5.000 2.790 1.00 0.00 ATOM 27200 H2 SOL 4032 6.350 4.890 2.570 1.00 0.00 ATOM 27201 OH2 SOL 4033 29.540 13.480 3.770 1.00 0.00 ATOM 27202 H1 SOL 4033 30.310 14.040 3.770 1.00 0.00 ATOM 27203 H2 SOL 4033 29.480 13.150 4.670 1.00 0.00 ATOM 27204 OH2 SOL 4034 0.920 0.870 0.450 1.00 0.00 ATOM 27205 H1 SOL 4034 0.160 0.590 0.950 1.00 0.00 ATOM 27206 H2 SOL 4034 1.670 0.660 1.010 1.00 0.00 ATOM 27207 OH2 SOL 4035 22.130 50.870 3.900 1.00 0.00 ATOM 27208 H1 SOL 4035 21.940 51.700 3.470 1.00 0.00 ATOM 27209 H2 SOL 4035 23.080 50.840 3.960 1.00 0.00 ATOM 27210 OH2 SOL 4036 33.440 37.950 3.300 1.00 0.00 ATOM 27211 H1 SOL 4036 32.720 37.710 3.890 1.00 0.00 ATOM 27212 H2 SOL 4036 33.400 38.900 3.250 1.00 0.00 ATOM 27213 OH2 SOL 4037 22.820 60.490 83.850 1.00 0.00 ATOM 27214 H1 SOL 4037 23.540 59.860 83.790 1.00 0.00 ATOM 27215 H2 SOL 4037 22.600 60.690 82.940 1.00 0.00 ATOM 27216 OH2 SOL 4038 11.840 27.620 2.030 1.00 0.00 ATOM 27217 H1 SOL 4038 12.760 27.490 1.810 1.00 0.00 ATOM 27218 H2 SOL 4038 11.780 28.550 2.290 1.00 0.00 ATOM 27219 OH2 SOL 4039 7.130 58.780 28.520 1.00 0.00 ATOM 27220 H1 SOL 4039 7.810 58.450 29.100 1.00 0.00 ATOM 27221 H2 SOL 4039 7.020 58.100 27.860 1.00 0.00 ATOM 27222 OH2 SOL 4040 31.960 24.610 83.040 1.00 0.00 ATOM 27223 H1 SOL 4040 32.110 23.760 82.640 1.00 0.00 ATOM 27224 H2 SOL 4040 31.400 25.080 82.420 1.00 0.00 ATOM 27225 OH2 SOL 4041 5.930 57.810 78.800 1.00 0.00 ATOM 27226 H1 SOL 4041 5.650 58.720 78.870 1.00 0.00 ATOM 27227 H2 SOL 4041 5.350 57.430 78.140 1.00 0.00 ATOM 27228 OH2 SOL 4042 19.610 4.150 0.360 1.00 0.00 ATOM 27229 H1 SOL 4042 18.860 3.630 0.660 1.00 0.00 ATOM 27230 H2 SOL 4042 19.630 4.030 -0.590 1.00 0.00 ATOM 27231 OH2 SOL 4043 25.740 57.670 57.630 1.00 0.00 ATOM 27232 H1 SOL 4043 25.720 58.390 57.000 1.00 0.00 ATOM 27233 H2 SOL 4043 25.850 58.090 58.480 1.00 0.00 ATOM 27234 OH2 SOL 4044 53.670 19.610 12.460 1.00 0.00 ATOM 27235 H1 SOL 4044 52.750 19.870 12.360 1.00 0.00 ATOM 27236 H2 SOL 4044 53.700 19.160 13.300 1.00 0.00 ATOM 27237 OH2 SOL 4045 6.090 45.070 0.550 1.00 0.00 ATOM 27238 H1 SOL 4045 6.770 45.350 -0.070 1.00 0.00 ATOM 27239 H2 SOL 4045 6.220 45.650 1.310 1.00 0.00 ATOM 27240 OH2 SOL 4046 7.390 2.180 84.030 1.00 0.00 ATOM 27241 H1 SOL 4046 7.430 1.240 84.180 1.00 0.00 ATOM 27242 H2 SOL 4046 6.500 2.430 84.290 1.00 0.00 ATOM 27243 OH2 SOL 4047 22.340 46.480 -0.130 1.00 0.00 ATOM 27244 H1 SOL 4047 22.270 46.570 0.820 1.00 0.00 ATOM 27245 H2 SOL 4047 23.200 46.070 -0.260 1.00 0.00 ATOM 27246 OH2 SOL 4048 3.070 58.630 13.500 1.00 0.00 ATOM 27247 H1 SOL 4048 2.880 59.570 13.380 1.00 0.00 ATOM 27248 H2 SOL 4048 2.700 58.420 14.350 1.00 0.00 ATOM 27249 OH2 SOL 4049 24.970 42.920 63.500 1.00 0.00 ATOM 27250 H1 SOL 4049 25.360 42.700 62.660 1.00 0.00 ATOM 27251 H2 SOL 4049 24.520 43.750 63.350 1.00 0.00 ATOM 27252 OH2 SOL 4050 47.610 33.140 71.260 1.00 0.00 ATOM 27253 H1 SOL 4050 47.610 34.090 71.360 1.00 0.00 ATOM 27254 H2 SOL 4050 47.840 32.800 72.120 1.00 0.00 ATOM 27255 OH2 SOL 4051 20.780 42.410 69.520 1.00 0.00 ATOM 27256 H1 SOL 4051 20.990 42.970 68.770 1.00 0.00 ATOM 27257 H2 SOL 4051 20.220 41.720 69.150 1.00 0.00 ATOM 27258 OH2 SOL 4052 39.260 49.030 3.140 1.00 0.00 ATOM 27259 H1 SOL 4052 39.450 49.910 2.810 1.00 0.00 ATOM 27260 H2 SOL 4052 38.600 48.690 2.540 1.00 0.00 ATOM 27261 OH2 SOL 4053 45.750 3.460 80.760 1.00 0.00 ATOM 27262 H1 SOL 4053 46.510 3.810 80.300 1.00 0.00 ATOM 27263 H2 SOL 4053 45.290 2.940 80.100 1.00 0.00 ATOM 27264 OH2 SOL 4054 58.690 46.160 68.610 1.00 0.00 ATOM 27265 H1 SOL 4054 59.110 46.970 68.330 1.00 0.00 ATOM 27266 H2 SOL 4054 57.790 46.420 68.820 1.00 0.00 ATOM 27267 OH2 SOL 4055 24.020 35.380 6.930 1.00 0.00 ATOM 27268 H1 SOL 4055 23.200 35.380 6.440 1.00 0.00 ATOM 27269 H2 SOL 4055 24.090 36.260 7.290 1.00 0.00 ATOM 27270 OH2 SOL 4056 48.750 44.750 19.500 1.00 0.00 ATOM 27271 H1 SOL 4056 49.630 45.090 19.340 1.00 0.00 ATOM 27272 H2 SOL 4056 48.330 44.740 18.640 1.00 0.00 ATOM 27273 OH2 SOL 4057 46.490 27.420 3.220 1.00 0.00 ATOM 27274 H1 SOL 4057 47.290 27.470 2.690 1.00 0.00 ATOM 27275 H2 SOL 4057 45.880 28.000 2.770 1.00 0.00 ATOM 27276 OH2 SOL 4058 23.920 57.980 76.820 1.00 0.00 ATOM 27277 H1 SOL 4058 23.450 57.990 75.980 1.00 0.00 ATOM 27278 H2 SOL 4058 23.550 57.230 77.290 1.00 0.00 ATOM 27279 OH2 SOL 4059 4.860 27.700 12.600 1.00 0.00 ATOM 27280 H1 SOL 4059 4.170 28.230 12.220 1.00 0.00 ATOM 27281 H2 SOL 4059 5.250 28.270 13.280 1.00 0.00 ATOM 27282 OH2 SOL 4060 37.880 17.820 1.310 1.00 0.00 ATOM 27283 H1 SOL 4060 37.580 17.990 0.420 1.00 0.00 ATOM 27284 H2 SOL 4060 37.490 18.530 1.830 1.00 0.00 ATOM 27285 OH2 SOL 4061 39.940 9.330 16.510 1.00 0.00 ATOM 27286 H1 SOL 4061 39.610 8.510 16.130 1.00 0.00 ATOM 27287 H2 SOL 4061 40.900 9.250 16.430 1.00 0.00 ATOM 27288 OH2 SOL 4062 38.450 46.120 16.720 1.00 0.00 ATOM 27289 H1 SOL 4062 38.890 46.310 15.900 1.00 0.00 ATOM 27290 H2 SOL 4062 37.840 45.410 16.510 1.00 0.00 ATOM 27291 OH2 SOL 4063 52.610 35.800 70.220 1.00 0.00 ATOM 27292 H1 SOL 4063 53.020 36.530 70.700 1.00 0.00 ATOM 27293 H2 SOL 4063 51.750 36.140 69.960 1.00 0.00 ATOM 27294 OH2 SOL 4064 6.640 37.930 11.740 1.00 0.00 ATOM 27295 H1 SOL 4064 7.000 38.800 11.900 1.00 0.00 ATOM 27296 H2 SOL 4064 7.400 37.370 11.620 1.00 0.00 ATOM 27297 OH2 SOL 4065 24.020 34.540 3.880 1.00 0.00 ATOM 27298 H1 SOL 4065 23.230 34.860 4.330 1.00 0.00 ATOM 27299 H2 SOL 4065 24.310 33.800 4.410 1.00 0.00 ATOM 27300 OH2 SOL 4066 56.040 51.900 7.610 1.00 0.00 ATOM 27301 H1 SOL 4066 56.320 52.060 8.510 1.00 0.00 ATOM 27302 H2 SOL 4066 56.690 51.310 7.240 1.00 0.00 ATOM 27303 OH2 SOL 4067 15.480 8.250 22.030 1.00 0.00 ATOM 27304 H1 SOL 4067 15.540 9.110 21.610 1.00 0.00 ATOM 27305 H2 SOL 4067 14.940 8.410 22.810 1.00 0.00 ATOM 27306 OH2 SOL 4068 28.340 32.490 4.550 1.00 0.00 ATOM 27307 H1 SOL 4068 27.960 31.680 4.890 1.00 0.00 ATOM 27308 H2 SOL 4068 27.820 33.190 4.930 1.00 0.00 ATOM 27309 OH2 SOL 4069 20.050 18.900 6.840 1.00 0.00 ATOM 27310 H1 SOL 4069 20.030 19.520 6.120 1.00 0.00 ATOM 27311 H2 SOL 4069 19.590 19.350 7.550 1.00 0.00 ATOM 27312 OH2 SOL 4070 36.660 22.360 69.050 1.00 0.00 ATOM 27313 H1 SOL 4070 36.930 23.210 69.410 1.00 0.00 ATOM 27314 H2 SOL 4070 35.740 22.280 69.290 1.00 0.00 ATOM 27315 OH2 SOL 4071 55.390 46.750 15.080 1.00 0.00 ATOM 27316 H1 SOL 4071 56.180 47.280 14.990 1.00 0.00 ATOM 27317 H2 SOL 4071 55.440 46.380 15.960 1.00 0.00 ATOM 27318 OH2 SOL 4072 42.060 4.570 80.420 1.00 0.00 ATOM 27319 H1 SOL 4072 42.720 4.010 80.000 1.00 0.00 ATOM 27320 H2 SOL 4072 41.250 4.070 80.360 1.00 0.00 ATOM 27321 OH2 SOL 4073 32.080 0.120 65.530 1.00 0.00 ATOM 27322 H1 SOL 4073 32.520 0.450 64.750 1.00 0.00 ATOM 27323 H2 SOL 4073 31.160 0.340 65.390 1.00 0.00 ATOM 27324 OH2 SOL 4074 6.840 28.960 81.830 1.00 0.00 ATOM 27325 H1 SOL 4074 7.280 29.810 81.810 1.00 0.00 ATOM 27326 H2 SOL 4074 5.920 29.160 81.620 1.00 0.00 ATOM 27327 OH2 SOL 4075 15.530 32.540 1.660 1.00 0.00 ATOM 27328 H1 SOL 4075 15.930 32.500 2.530 1.00 0.00 ATOM 27329 H2 SOL 4075 15.930 33.310 1.260 1.00 0.00 ATOM 27330 OH2 SOL 4076 16.700 40.430 74.330 1.00 0.00 ATOM 27331 H1 SOL 4076 16.700 39.850 75.080 1.00 0.00 ATOM 27332 H2 SOL 4076 17.170 39.950 73.650 1.00 0.00 ATOM 27333 OH2 SOL 4077 21.040 9.760 79.920 1.00 0.00 ATOM 27334 H1 SOL 4077 20.390 9.870 80.600 1.00 0.00 ATOM 27335 H2 SOL 4077 21.880 9.830 80.370 1.00 0.00 ATOM 27336 OH2 SOL 4078 23.700 48.190 82.950 1.00 0.00 ATOM 27337 H1 SOL 4078 23.500 49.030 82.530 1.00 0.00 ATOM 27338 H2 SOL 4078 22.860 47.870 83.270 1.00 0.00 ATOM 27339 OH2 SOL 4079 57.820 44.350 83.640 1.00 0.00 ATOM 27340 H1 SOL 4079 58.690 44.210 84.020 1.00 0.00 ATOM 27341 H2 SOL 4079 57.230 44.410 84.390 1.00 0.00 ATOM 27342 OH2 SOL 4080 24.100 18.140 64.770 1.00 0.00 ATOM 27343 H1 SOL 4080 23.170 17.990 64.970 1.00 0.00 ATOM 27344 H2 SOL 4080 24.250 19.050 65.010 1.00 0.00 ATOM 27345 OH2 SOL 4081 30.620 6.900 68.250 1.00 0.00 ATOM 27346 H1 SOL 4081 29.880 6.470 68.680 1.00 0.00 ATOM 27347 H2 SOL 4081 31.310 6.230 68.240 1.00 0.00 ATOM 27348 OH2 SOL 4082 54.080 3.940 72.370 1.00 0.00 ATOM 27349 H1 SOL 4082 53.420 3.780 71.690 1.00 0.00 ATOM 27350 H2 SOL 4082 54.600 3.140 72.400 1.00 0.00 ATOM 27351 OH2 SOL 4083 9.260 4.960 76.990 1.00 0.00 ATOM 27352 H1 SOL 4083 8.700 5.350 77.660 1.00 0.00 ATOM 27353 H2 SOL 4083 9.700 4.240 77.440 1.00 0.00 ATOM 27354 OH2 SOL 4084 15.460 33.900 12.870 1.00 0.00 ATOM 27355 H1 SOL 4084 15.860 33.250 12.290 1.00 0.00 ATOM 27356 H2 SOL 4084 16.190 34.420 13.190 1.00 0.00 ATOM 27357 OH2 SOL 4085 58.350 59.100 71.000 1.00 0.00 ATOM 27358 H1 SOL 4085 57.850 58.310 71.190 1.00 0.00 ATOM 27359 H2 SOL 4085 58.370 59.150 70.040 1.00 0.00 ATOM 27360 OH2 SOL 4086 32.990 15.580 75.240 1.00 0.00 ATOM 27361 H1 SOL 4086 33.020 16.050 76.070 1.00 0.00 ATOM 27362 H2 SOL 4086 32.370 16.070 74.710 1.00 0.00 ATOM 27363 OH2 SOL 4087 12.950 24.390 73.950 1.00 0.00 ATOM 27364 H1 SOL 4087 13.480 23.670 73.610 1.00 0.00 ATOM 27365 H2 SOL 4087 12.060 24.180 73.680 1.00 0.00 ATOM 27366 OH2 SOL 4088 50.560 20.420 68.430 1.00 0.00 ATOM 27367 H1 SOL 4088 51.020 19.980 69.150 1.00 0.00 ATOM 27368 H2 SOL 4088 50.130 21.170 68.850 1.00 0.00 ATOM 27369 OH2 SOL 4089 14.300 49.860 9.310 1.00 0.00 ATOM 27370 H1 SOL 4089 14.780 50.630 9.600 1.00 0.00 ATOM 27371 H2 SOL 4089 13.460 49.910 9.760 1.00 0.00 ATOM 27372 OH2 SOL 4090 13.350 1.210 26.820 1.00 0.00 ATOM 27373 H1 SOL 4090 12.500 1.580 27.060 1.00 0.00 ATOM 27374 H2 SOL 4090 13.990 1.760 27.280 1.00 0.00 ATOM 27375 OH2 SOL 4091 4.250 10.130 83.710 1.00 0.00 ATOM 27376 H1 SOL 4091 3.790 9.440 84.190 1.00 0.00 ATOM 27377 H2 SOL 4091 4.990 9.690 83.290 1.00 0.00 ATOM 27378 OH2 SOL 4092 18.630 22.770 76.550 1.00 0.00 ATOM 27379 H1 SOL 4092 19.570 22.970 76.540 1.00 0.00 ATOM 27380 H2 SOL 4092 18.500 22.300 77.370 1.00 0.00 ATOM 27381 OH2 SOL 4093 41.220 59.300 84.660 1.00 0.00 ATOM 27382 H1 SOL 4093 41.450 58.420 84.370 1.00 0.00 ATOM 27383 H2 SOL 4093 41.580 59.870 83.980 1.00 0.00 ATOM 27384 OH2 SOL 4094 34.130 20.060 76.830 1.00 0.00 ATOM 27385 H1 SOL 4094 34.510 19.240 76.530 1.00 0.00 ATOM 27386 H2 SOL 4094 34.540 20.730 76.280 1.00 0.00 ATOM 27387 OH2 SOL 4095 12.410 16.380 6.510 1.00 0.00 ATOM 27388 H1 SOL 4095 13.010 15.720 6.850 1.00 0.00 ATOM 27389 H2 SOL 4095 11.770 16.520 7.210 1.00 0.00 ATOM 27390 OH2 SOL 4096 30.100 27.240 1.160 1.00 0.00 ATOM 27391 H1 SOL 4096 29.880 26.550 0.530 1.00 0.00 ATOM 27392 H2 SOL 4096 30.660 27.840 0.680 1.00 0.00 ATOM 27393 OH2 SOL 4097 1.410 46.720 5.180 1.00 0.00 ATOM 27394 H1 SOL 4097 2.170 46.150 5.280 1.00 0.00 ATOM 27395 H2 SOL 4097 1.670 47.550 5.600 1.00 0.00 ATOM 27396 OH2 SOL 4098 30.880 36.200 19.120 1.00 0.00 ATOM 27397 H1 SOL 4098 31.360 36.200 18.290 1.00 0.00 ATOM 27398 H2 SOL 4098 30.570 37.100 19.210 1.00 0.00 ATOM 27399 OH2 SOL 4099 25.900 14.910 75.270 1.00 0.00 ATOM 27400 H1 SOL 4099 25.770 14.410 74.460 1.00 0.00 ATOM 27401 H2 SOL 4099 25.390 15.710 75.140 1.00 0.00 ATOM 27402 OH2 SOL 4100 41.400 33.170 19.410 1.00 0.00 ATOM 27403 H1 SOL 4100 40.470 32.960 19.360 1.00 0.00 ATOM 27404 H2 SOL 4100 41.470 33.790 20.130 1.00 0.00 ATOM 27405 OH2 SOL 4101 22.980 49.910 24.940 1.00 0.00 ATOM 27406 H1 SOL 4101 23.180 49.160 24.380 1.00 0.00 ATOM 27407 H2 SOL 4101 22.710 50.600 24.340 1.00 0.00 ATOM 27408 OH2 SOL 4102 3.020 42.320 15.750 1.00 0.00 ATOM 27409 H1 SOL 4102 3.400 42.050 16.590 1.00 0.00 ATOM 27410 H2 SOL 4102 3.170 41.580 15.170 1.00 0.00 ATOM 27411 OH2 SOL 4103 13.290 44.120 17.610 1.00 0.00 ATOM 27412 H1 SOL 4103 12.770 43.350 17.840 1.00 0.00 ATOM 27413 H2 SOL 4103 12.900 44.830 18.110 1.00 0.00 ATOM 27414 OH2 SOL 4104 26.420 58.050 5.460 1.00 0.00 ATOM 27415 H1 SOL 4104 25.490 58.020 5.690 1.00 0.00 ATOM 27416 H2 SOL 4104 26.700 57.130 5.440 1.00 0.00 ATOM 27417 OH2 SOL 4105 17.210 39.450 83.670 1.00 0.00 ATOM 27418 H1 SOL 4105 16.360 39.470 83.210 1.00 0.00 ATOM 27419 H2 SOL 4105 17.620 40.280 83.440 1.00 0.00 ATOM 27420 OH2 SOL 4106 36.250 22.380 11.200 1.00 0.00 ATOM 27421 H1 SOL 4106 35.880 22.030 12.020 1.00 0.00 ATOM 27422 H2 SOL 4106 36.910 21.740 10.950 1.00 0.00 ATOM 27423 OH2 SOL 4107 29.010 0.870 5.420 1.00 0.00 ATOM 27424 H1 SOL 4107 29.390 0.580 4.580 1.00 0.00 ATOM 27425 H2 SOL 4107 28.140 0.460 5.430 1.00 0.00 ATOM 27426 OH2 SOL 4108 16.800 33.830 79.430 1.00 0.00 ATOM 27427 H1 SOL 4108 17.170 32.980 79.220 1.00 0.00 ATOM 27428 H2 SOL 4108 17.350 34.180 80.130 1.00 0.00 ATOM 27429 OH2 SOL 4109 43.390 38.440 12.890 1.00 0.00 ATOM 27430 H1 SOL 4109 43.880 37.770 13.360 1.00 0.00 ATOM 27431 H2 SOL 4109 43.950 38.670 12.150 1.00 0.00 ATOM 27432 OH2 SOL 4110 11.410 29.840 16.290 1.00 0.00 ATOM 27433 H1 SOL 4110 11.780 29.130 16.820 1.00 0.00 ATOM 27434 H2 SOL 4110 11.370 29.470 15.400 1.00 0.00 ATOM 27435 OH2 SOL 4111 46.140 26.810 79.190 1.00 0.00 ATOM 27436 H1 SOL 4111 45.210 27.010 79.110 1.00 0.00 ATOM 27437 H2 SOL 4111 46.310 26.180 78.490 1.00 0.00 ATOM 27438 OH2 SOL 4112 42.830 34.150 6.160 1.00 0.00 ATOM 27439 H1 SOL 4112 43.160 34.090 7.060 1.00 0.00 ATOM 27440 H2 SOL 4112 43.370 33.530 5.660 1.00 0.00 ATOM 27441 OH2 SOL 4113 6.110 48.930 81.440 1.00 0.00 ATOM 27442 H1 SOL 4113 6.780 48.430 80.980 1.00 0.00 ATOM 27443 H2 SOL 4113 5.610 49.360 80.750 1.00 0.00 ATOM 27444 OH2 SOL 4114 29.620 19.280 67.070 1.00 0.00 ATOM 27445 H1 SOL 4114 28.960 18.680 66.720 1.00 0.00 ATOM 27446 H2 SOL 4114 29.600 20.020 66.470 1.00 0.00 ATOM 27447 OH2 SOL 4115 2.850 36.550 68.090 1.00 0.00 ATOM 27448 H1 SOL 4115 2.640 37.370 67.650 1.00 0.00 ATOM 27449 H2 SOL 4115 2.850 35.900 67.390 1.00 0.00 ATOM 27450 OH2 SOL 4116 7.280 49.020 3.740 1.00 0.00 ATOM 27451 H1 SOL 4116 7.100 49.840 3.270 1.00 0.00 ATOM 27452 H2 SOL 4116 6.440 48.800 4.150 1.00 0.00 ATOM 27453 OH2 SOL 4117 36.360 8.650 9.790 1.00 0.00 ATOM 27454 H1 SOL 4117 36.220 7.740 9.540 1.00 0.00 ATOM 27455 H2 SOL 4117 35.480 9.030 9.800 1.00 0.00 ATOM 27456 OH2 SOL 4118 44.610 53.740 74.250 1.00 0.00 ATOM 27457 H1 SOL 4118 44.520 54.280 73.470 1.00 0.00 ATOM 27458 H2 SOL 4118 44.210 54.260 74.950 1.00 0.00 ATOM 27459 OH2 SOL 4119 43.420 43.840 12.180 1.00 0.00 ATOM 27460 H1 SOL 4119 43.900 43.940 13.000 1.00 0.00 ATOM 27461 H2 SOL 4119 44.030 44.130 11.500 1.00 0.00 ATOM 27462 OH2 SOL 4120 12.740 15.460 17.290 1.00 0.00 ATOM 27463 H1 SOL 4120 13.410 14.840 17.000 1.00 0.00 ATOM 27464 H2 SOL 4120 12.940 15.620 18.210 1.00 0.00 ATOM 27465 OH2 SOL 4121 11.480 41.090 2.600 1.00 0.00 ATOM 27466 H1 SOL 4121 10.650 40.670 2.840 1.00 0.00 ATOM 27467 H2 SOL 4121 11.230 41.770 1.980 1.00 0.00 ATOM 27468 OH2 SOL 4122 28.670 43.450 75.400 1.00 0.00 ATOM 27469 H1 SOL 4122 28.130 44.090 74.940 1.00 0.00 ATOM 27470 H2 SOL 4122 28.960 42.840 74.720 1.00 0.00 ATOM 27471 OH2 SOL 4123 53.050 0.180 7.580 1.00 0.00 ATOM 27472 H1 SOL 4123 52.480 0.840 7.970 1.00 0.00 ATOM 27473 H2 SOL 4123 53.070 0.390 6.650 1.00 0.00 ATOM 27474 OH2 SOL 4124 45.210 16.210 68.410 1.00 0.00 ATOM 27475 H1 SOL 4124 45.340 16.770 67.640 1.00 0.00 ATOM 27476 H2 SOL 4124 44.270 16.220 68.560 1.00 0.00 ATOM 27477 OH2 SOL 4125 23.140 31.020 79.090 1.00 0.00 ATOM 27478 H1 SOL 4125 23.690 31.590 79.630 1.00 0.00 ATOM 27479 H2 SOL 4125 22.810 31.590 78.390 1.00 0.00 ATOM 27480 OH2 SOL 4126 2.950 39.980 14.380 1.00 0.00 ATOM 27481 H1 SOL 4126 3.540 39.620 13.720 1.00 0.00 ATOM 27482 H2 SOL 4126 2.190 39.400 14.370 1.00 0.00 ATOM 27483 OH2 SOL 4127 7.200 23.280 12.910 1.00 0.00 ATOM 27484 H1 SOL 4127 7.870 23.710 12.380 1.00 0.00 ATOM 27485 H2 SOL 4127 7.260 22.350 12.670 1.00 0.00 ATOM 27486 OH2 SOL 4128 31.100 52.090 82.020 1.00 0.00 ATOM 27487 H1 SOL 4128 30.910 52.400 81.130 1.00 0.00 ATOM 27488 H2 SOL 4128 31.600 51.280 81.900 1.00 0.00 ATOM 27489 OH2 SOL 4129 54.070 53.960 0.620 1.00 0.00 ATOM 27490 H1 SOL 4129 53.420 53.580 0.020 1.00 0.00 ATOM 27491 H2 SOL 4129 53.600 54.670 1.060 1.00 0.00 ATOM 27492 OH2 SOL 4130 48.060 57.500 71.330 1.00 0.00 ATOM 27493 H1 SOL 4130 48.470 57.300 70.490 1.00 0.00 ATOM 27494 H2 SOL 4130 47.140 57.670 71.110 1.00 0.00 ATOM 27495 OH2 SOL 4131 24.820 3.040 6.450 1.00 0.00 ATOM 27496 H1 SOL 4131 25.680 2.870 6.840 1.00 0.00 ATOM 27497 H2 SOL 4131 24.990 3.660 5.740 1.00 0.00 ATOM 27498 OH2 SOL 4132 8.130 4.750 28.780 1.00 0.00 ATOM 27499 H1 SOL 4132 7.490 4.410 29.420 1.00 0.00 ATOM 27500 H2 SOL 4132 8.450 5.560 29.170 1.00 0.00 ATOM 27501 OH2 SOL 4133 47.500 25.910 76.940 1.00 0.00 ATOM 27502 H1 SOL 4133 47.690 25.140 76.420 1.00 0.00 ATOM 27503 H2 SOL 4133 46.790 26.360 76.480 1.00 0.00 ATOM 27504 OH2 SOL 4134 19.660 16.870 75.150 1.00 0.00 ATOM 27505 H1 SOL 4134 20.510 16.550 74.840 1.00 0.00 ATOM 27506 H2 SOL 4134 19.360 16.190 75.760 1.00 0.00 ATOM 27507 OH2 SOL 4135 40.170 3.110 18.600 1.00 0.00 ATOM 27508 H1 SOL 4135 39.380 3.640 18.670 1.00 0.00 ATOM 27509 H2 SOL 4135 40.460 3.220 17.690 1.00 0.00 ATOM 27510 OH2 SOL 4136 53.700 5.340 0.490 1.00 0.00 ATOM 27511 H1 SOL 4136 53.080 5.880 0.000 1.00 0.00 ATOM 27512 H2 SOL 4136 53.960 4.650 -0.130 1.00 0.00 ATOM 27513 OH2 SOL 4137 48.800 49.960 64.290 1.00 0.00 ATOM 27514 H1 SOL 4137 48.260 50.750 64.320 1.00 0.00 ATOM 27515 H2 SOL 4137 49.510 50.170 63.690 1.00 0.00 ATOM 27516 OH2 SOL 4138 36.040 41.860 71.090 1.00 0.00 ATOM 27517 H1 SOL 4138 35.220 42.250 71.410 1.00 0.00 ATOM 27518 H2 SOL 4138 36.730 42.420 71.450 1.00 0.00 ATOM 27519 OH2 SOL 4139 53.380 33.840 79.660 1.00 0.00 ATOM 27520 H1 SOL 4139 52.800 33.080 79.640 1.00 0.00 ATOM 27521 H2 SOL 4139 53.700 33.870 80.560 1.00 0.00 ATOM 27522 OH2 SOL 4140 5.740 16.700 22.660 1.00 0.00 ATOM 27523 H1 SOL 4140 5.300 16.470 23.480 1.00 0.00 ATOM 27524 H2 SOL 4140 5.450 17.600 22.480 1.00 0.00 ATOM 27525 OH2 SOL 4141 0.070 26.590 3.200 1.00 0.00 ATOM 27526 H1 SOL 4141 -0.410 25.860 2.800 1.00 0.00 ATOM 27527 H2 SOL 4141 0.930 26.570 2.790 1.00 0.00 ATOM 27528 OH2 SOL 4142 29.180 10.070 73.810 1.00 0.00 ATOM 27529 H1 SOL 4142 29.790 9.910 74.530 1.00 0.00 ATOM 27530 H2 SOL 4142 28.380 9.630 74.070 1.00 0.00 ATOM 27531 OH2 SOL 4143 34.470 31.620 1.380 1.00 0.00 ATOM 27532 H1 SOL 4143 33.540 31.820 1.490 1.00 0.00 ATOM 27533 H2 SOL 4143 34.720 32.050 0.570 1.00 0.00 ATOM 27534 OH2 SOL 4144 8.480 22.320 76.240 1.00 0.00 ATOM 27535 H1 SOL 4144 7.930 22.590 76.980 1.00 0.00 ATOM 27536 H2 SOL 4144 8.150 22.830 75.500 1.00 0.00 ATOM 27537 OH2 SOL 4145 32.220 58.910 12.990 1.00 0.00 ATOM 27538 H1 SOL 4145 32.450 59.810 12.770 1.00 0.00 ATOM 27539 H2 SOL 4145 31.530 58.990 13.640 1.00 0.00 ATOM 27540 OH2 SOL 4146 27.200 3.210 9.610 1.00 0.00 ATOM 27541 H1 SOL 4146 27.510 3.070 8.720 1.00 0.00 ATOM 27542 H2 SOL 4146 26.280 3.440 9.520 1.00 0.00 ATOM 27543 OH2 SOL 4147 37.200 11.990 74.370 1.00 0.00 ATOM 27544 H1 SOL 4147 36.420 11.510 74.660 1.00 0.00 ATOM 27545 H2 SOL 4147 37.310 12.690 75.020 1.00 0.00 ATOM 27546 OH2 SOL 4148 19.520 38.990 76.010 1.00 0.00 ATOM 27547 H1 SOL 4148 19.460 39.910 76.280 1.00 0.00 ATOM 27548 H2 SOL 4148 19.690 38.520 76.830 1.00 0.00 ATOM 27549 OH2 SOL 4149 38.150 58.300 9.420 1.00 0.00 ATOM 27550 H1 SOL 4149 38.600 58.920 10.000 1.00 0.00 ATOM 27551 H2 SOL 4149 38.290 57.440 9.830 1.00 0.00 ATOM 27552 OH2 SOL 4150 27.860 19.410 64.030 1.00 0.00 ATOM 27553 H1 SOL 4150 27.480 18.920 64.770 1.00 0.00 ATOM 27554 H2 SOL 4150 27.700 20.330 64.250 1.00 0.00 ATOM 27555 OH2 SOL 4151 48.580 37.210 4.110 1.00 0.00 ATOM 27556 H1 SOL 4151 47.880 36.850 4.650 1.00 0.00 ATOM 27557 H2 SOL 4151 48.200 38.010 3.740 1.00 0.00 ATOM 27558 OH2 SOL 4152 16.580 26.190 16.960 1.00 0.00 ATOM 27559 H1 SOL 4152 16.470 26.230 16.010 1.00 0.00 ATOM 27560 H2 SOL 4152 16.260 27.030 17.280 1.00 0.00 ATOM 27561 OH2 SOL 4153 5.130 14.510 21.250 1.00 0.00 ATOM 27562 H1 SOL 4153 5.420 15.280 21.730 1.00 0.00 ATOM 27563 H2 SOL 4153 4.770 13.920 21.910 1.00 0.00 ATOM 27564 OH2 SOL 4154 49.660 11.260 24.240 1.00 0.00 ATOM 27565 H1 SOL 4154 49.320 11.880 24.890 1.00 0.00 ATOM 27566 H2 SOL 4154 49.840 11.790 23.470 1.00 0.00 ATOM 27567 OH2 SOL 4155 4.620 30.070 72.240 1.00 0.00 ATOM 27568 H1 SOL 4155 5.160 29.400 72.660 1.00 0.00 ATOM 27569 H2 SOL 4155 4.370 30.660 72.950 1.00 0.00 ATOM 27570 OH2 SOL 4156 8.720 11.640 10.420 1.00 0.00 ATOM 27571 H1 SOL 4156 7.970 11.540 11.010 1.00 0.00 ATOM 27572 H2 SOL 4156 9.450 11.850 10.990 1.00 0.00 ATOM 27573 OH2 SOL 4157 55.390 40.290 80.410 1.00 0.00 ATOM 27574 H1 SOL 4157 55.580 39.370 80.240 1.00 0.00 ATOM 27575 H2 SOL 4157 55.810 40.470 81.250 1.00 0.00 ATOM 27576 OH2 SOL 4158 33.420 24.300 7.680 1.00 0.00 ATOM 27577 H1 SOL 4158 33.650 23.580 7.100 1.00 0.00 ATOM 27578 H2 SOL 4158 34.070 24.980 7.490 1.00 0.00 ATOM 27579 OH2 SOL 4159 51.930 55.430 66.390 1.00 0.00 ATOM 27580 H1 SOL 4159 52.450 56.150 66.050 1.00 0.00 ATOM 27581 H2 SOL 4159 52.570 54.830 66.780 1.00 0.00 ATOM 27582 OH2 SOL 4160 16.470 8.980 79.200 1.00 0.00 ATOM 27583 H1 SOL 4160 16.440 8.290 78.530 1.00 0.00 ATOM 27584 H2 SOL 4160 16.170 9.760 78.750 1.00 0.00 ATOM 27585 OH2 SOL 4161 19.450 9.330 71.200 1.00 0.00 ATOM 27586 H1 SOL 4161 20.250 9.490 70.700 1.00 0.00 ATOM 27587 H2 SOL 4161 19.590 9.800 72.020 1.00 0.00 ATOM 27588 OH2 SOL 4162 32.290 55.290 79.370 1.00 0.00 ATOM 27589 H1 SOL 4162 31.520 55.420 79.930 1.00 0.00 ATOM 27590 H2 SOL 4162 32.530 56.170 79.090 1.00 0.00 ATOM 27591 OH2 SOL 4163 50.200 60.850 81.760 1.00 0.00 ATOM 27592 H1 SOL 4163 51.050 61.060 81.380 1.00 0.00 ATOM 27593 H2 SOL 4163 50.050 59.940 81.540 1.00 0.00 ATOM 27594 OH2 SOL 4164 23.450 39.610 17.610 1.00 0.00 ATOM 27595 H1 SOL 4164 23.610 39.090 16.820 1.00 0.00 ATOM 27596 H2 SOL 4164 22.620 39.280 17.950 1.00 0.00 ATOM 27597 OH2 SOL 4165 54.750 22.400 13.440 1.00 0.00 ATOM 27598 H1 SOL 4165 54.390 21.510 13.430 1.00 0.00 ATOM 27599 H2 SOL 4165 54.050 22.930 13.820 1.00 0.00 ATOM 27600 OH2 SOL 4166 5.420 52.200 82.440 1.00 0.00 ATOM 27601 H1 SOL 4166 5.760 52.790 83.120 1.00 0.00 ATOM 27602 H2 SOL 4166 6.170 52.040 81.870 1.00 0.00 ATOM 27603 OH2 SOL 4167 31.440 31.640 2.070 1.00 0.00 ATOM 27604 H1 SOL 4167 30.520 31.350 2.060 1.00 0.00 ATOM 27605 H2 SOL 4167 31.800 31.260 2.880 1.00 0.00 ATOM 27606 OH2 SOL 4168 8.390 39.130 69.730 1.00 0.00 ATOM 27607 H1 SOL 4168 7.850 39.260 70.510 1.00 0.00 ATOM 27608 H2 SOL 4168 9.290 39.220 70.050 1.00 0.00 ATOM 27609 OH2 SOL 4169 53.480 10.210 71.910 1.00 0.00 ATOM 27610 H1 SOL 4169 53.260 9.280 71.880 1.00 0.00 ATOM 27611 H2 SOL 4169 53.910 10.380 71.060 1.00 0.00 ATOM 27612 OH2 SOL 4170 27.510 56.360 77.910 1.00 0.00 ATOM 27613 H1 SOL 4170 28.380 55.970 77.910 1.00 0.00 ATOM 27614 H2 SOL 4170 27.060 55.940 78.640 1.00 0.00 ATOM 27615 OH2 SOL 4171 35.380 57.540 24.220 1.00 0.00 ATOM 27616 H1 SOL 4171 35.710 57.900 25.040 1.00 0.00 ATOM 27617 H2 SOL 4171 35.420 56.590 24.350 1.00 0.00 ATOM 27618 OH2 SOL 4172 23.490 21.070 10.690 1.00 0.00 ATOM 27619 H1 SOL 4172 23.770 21.010 9.770 1.00 0.00 ATOM 27620 H2 SOL 4172 24.010 21.800 11.050 1.00 0.00 ATOM 27621 OH2 SOL 4173 2.850 19.750 20.360 1.00 0.00 ATOM 27622 H1 SOL 4173 3.420 19.060 20.690 1.00 0.00 ATOM 27623 H2 SOL 4173 2.750 20.360 21.090 1.00 0.00 ATOM 27624 OH2 SOL 4174 18.240 18.050 67.500 1.00 0.00 ATOM 27625 H1 SOL 4174 19.090 17.690 67.760 1.00 0.00 ATOM 27626 H2 SOL 4174 18.000 17.550 66.720 1.00 0.00 ATOM 27627 OH2 SOL 4175 57.710 15.540 68.530 1.00 0.00 ATOM 27628 H1 SOL 4175 58.510 16.010 68.760 1.00 0.00 ATOM 27629 H2 SOL 4175 57.910 14.620 68.720 1.00 0.00 ATOM 27630 OH2 SOL 4176 22.040 11.630 74.220 1.00 0.00 ATOM 27631 H1 SOL 4176 22.080 12.480 74.660 1.00 0.00 ATOM 27632 H2 SOL 4176 22.370 11.010 74.860 1.00 0.00 ATOM 27633 OH2 SOL 4177 35.060 30.940 76.880 1.00 0.00 ATOM 27634 H1 SOL 4177 34.250 31.240 76.450 1.00 0.00 ATOM 27635 H2 SOL 4177 35.730 31.040 76.210 1.00 0.00 ATOM 27636 OH2 SOL 4178 19.050 37.950 78.720 1.00 0.00 ATOM 27637 H1 SOL 4178 18.190 37.530 78.650 1.00 0.00 ATOM 27638 H2 SOL 4178 19.130 38.170 79.650 1.00 0.00 ATOM 27639 OH2 SOL 4179 11.330 4.830 72.170 1.00 0.00 ATOM 27640 H1 SOL 4179 10.760 5.500 72.560 1.00 0.00 ATOM 27641 H2 SOL 4179 10.960 4.660 71.310 1.00 0.00 ATOM 27642 OH2 SOL 4180 44.580 47.470 75.160 1.00 0.00 ATOM 27643 H1 SOL 4180 44.070 47.620 75.960 1.00 0.00 ATOM 27644 H2 SOL 4180 45.100 46.690 75.350 1.00 0.00 ATOM 27645 OH2 SOL 4181 0.450 41.390 72.830 1.00 0.00 ATOM 27646 H1 SOL 4181 1.190 41.360 73.440 1.00 0.00 ATOM 27647 H2 SOL 4181 0.260 40.470 72.640 1.00 0.00 ATOM 27648 OH2 SOL 4182 46.200 36.820 84.170 1.00 0.00 ATOM 27649 H1 SOL 4182 45.880 37.050 85.050 1.00 0.00 ATOM 27650 H2 SOL 4182 46.040 37.600 83.640 1.00 0.00 ATOM 27651 OH2 SOL 4183 44.750 38.030 81.400 1.00 0.00 ATOM 27652 H1 SOL 4183 44.240 38.170 80.600 1.00 0.00 ATOM 27653 H2 SOL 4183 45.440 37.410 81.140 1.00 0.00 ATOM 27654 OH2 SOL 4184 17.140 26.820 14.260 1.00 0.00 ATOM 27655 H1 SOL 4184 16.650 27.460 13.750 1.00 0.00 ATOM 27656 H2 SOL 4184 16.790 25.970 13.980 1.00 0.00 ATOM 27657 OH2 SOL 4185 11.330 34.480 82.870 1.00 0.00 ATOM 27658 H1 SOL 4185 11.400 34.530 81.920 1.00 0.00 ATOM 27659 H2 SOL 4185 10.860 35.280 83.120 1.00 0.00 ATOM 27660 OH2 SOL 4186 7.700 42.700 18.650 1.00 0.00 ATOM 27661 H1 SOL 4186 8.080 43.120 17.870 1.00 0.00 ATOM 27662 H2 SOL 4186 8.390 42.760 19.310 1.00 0.00 ATOM 27663 OH2 SOL 4187 41.190 41.590 2.670 1.00 0.00 ATOM 27664 H1 SOL 4187 41.900 41.000 2.420 1.00 0.00 ATOM 27665 H2 SOL 4187 41.570 42.160 3.340 1.00 0.00 ATOM 27666 OH2 SOL 4188 13.110 35.120 12.590 1.00 0.00 ATOM 27667 H1 SOL 4188 12.990 34.960 11.650 1.00 0.00 ATOM 27668 H2 SOL 4188 14.020 34.880 12.770 1.00 0.00 ATOM 27669 OH2 SOL 4189 45.770 11.790 22.290 1.00 0.00 ATOM 27670 H1 SOL 4189 46.220 12.350 22.920 1.00 0.00 ATOM 27671 H2 SOL 4189 45.710 12.310 21.500 1.00 0.00 ATOM 27672 OH2 SOL 4190 44.130 40.180 1.560 1.00 0.00 ATOM 27673 H1 SOL 4190 43.930 39.580 0.840 1.00 0.00 ATOM 27674 H2 SOL 4190 44.360 39.610 2.290 1.00 0.00 ATOM 27675 OH2 SOL 4191 31.600 24.670 13.300 1.00 0.00 ATOM 27676 H1 SOL 4191 31.540 23.930 13.890 1.00 0.00 ATOM 27677 H2 SOL 4191 30.700 24.980 13.210 1.00 0.00 ATOM 27678 OH2 SOL 4192 47.780 49.070 0.780 1.00 0.00 ATOM 27679 H1 SOL 4192 48.180 49.230 1.640 1.00 0.00 ATOM 27680 H2 SOL 4192 47.880 48.130 0.640 1.00 0.00 ATOM 27681 OH2 SOL 4193 18.770 55.170 10.250 1.00 0.00 ATOM 27682 H1 SOL 4193 18.000 55.220 9.680 1.00 0.00 ATOM 27683 H2 SOL 4193 18.540 54.520 10.910 1.00 0.00 ATOM 27684 OH2 SOL 4194 13.770 34.490 70.460 1.00 0.00 ATOM 27685 H1 SOL 4194 13.180 34.190 69.770 1.00 0.00 ATOM 27686 H2 SOL 4194 14.100 33.680 70.860 1.00 0.00 ATOM 27687 OH2 SOL 4195 23.880 27.100 1.910 1.00 0.00 ATOM 27688 H1 SOL 4195 23.720 26.380 2.520 1.00 0.00 ATOM 27689 H2 SOL 4195 24.610 26.790 1.370 1.00 0.00 ATOM 27690 OH2 SOL 4196 33.910 25.630 77.370 1.00 0.00 ATOM 27691 H1 SOL 4196 34.180 26.340 77.950 1.00 0.00 ATOM 27692 H2 SOL 4196 34.700 25.110 77.240 1.00 0.00 ATOM 27693 OH2 SOL 4197 24.640 25.040 14.500 1.00 0.00 ATOM 27694 H1 SOL 4197 23.940 25.250 15.120 1.00 0.00 ATOM 27695 H2 SOL 4197 25.210 25.800 14.510 1.00 0.00 ATOM 27696 OH2 SOL 4198 25.110 8.180 68.270 1.00 0.00 ATOM 27697 H1 SOL 4198 25.910 7.800 68.620 1.00 0.00 ATOM 27698 H2 SOL 4198 24.960 7.720 67.440 1.00 0.00 ATOM 27699 OH2 SOL 4199 23.170 27.590 66.690 1.00 0.00 ATOM 27700 H1 SOL 4199 22.400 27.370 67.220 1.00 0.00 ATOM 27701 H2 SOL 4199 22.940 28.410 66.260 1.00 0.00 ATOM 27702 OH2 SOL 4200 19.960 52.900 80.080 1.00 0.00 ATOM 27703 H1 SOL 4200 19.040 52.640 79.980 1.00 0.00 ATOM 27704 H2 SOL 4200 19.980 53.400 80.900 1.00 0.00 ATOM 27705 OH2 SOL 4201 36.020 56.510 12.220 1.00 0.00 ATOM 27706 H1 SOL 4201 35.160 56.400 12.620 1.00 0.00 ATOM 27707 H2 SOL 4201 35.970 57.360 11.770 1.00 0.00 ATOM 27708 OH2 SOL 4202 0.830 57.030 71.710 1.00 0.00 ATOM 27709 H1 SOL 4202 0.780 56.120 71.410 1.00 0.00 ATOM 27710 H2 SOL 4202 0.630 57.560 70.940 1.00 0.00 ATOM 27711 OH2 SOL 4203 43.650 61.010 73.570 1.00 0.00 ATOM 27712 H1 SOL 4203 43.340 60.170 73.240 1.00 0.00 ATOM 27713 H2 SOL 4203 44.000 60.810 74.440 1.00 0.00 ATOM 27714 OH2 SOL 4204 59.050 18.430 65.900 1.00 0.00 ATOM 27715 H1 SOL 4204 58.490 17.670 66.070 1.00 0.00 ATOM 27716 H2 SOL 4204 59.200 18.400 64.950 1.00 0.00 ATOM 27717 OH2 SOL 4205 40.700 19.740 75.800 1.00 0.00 ATOM 27718 H1 SOL 4205 41.510 19.670 76.310 1.00 0.00 ATOM 27719 H2 SOL 4205 40.980 20.000 74.930 1.00 0.00 ATOM 27720 OH2 SOL 4206 44.870 33.760 70.230 1.00 0.00 ATOM 27721 H1 SOL 4206 44.650 34.110 71.090 1.00 0.00 ATOM 27722 H2 SOL 4206 45.690 33.290 70.370 1.00 0.00 ATOM 27723 OH2 SOL 4207 44.120 13.290 11.090 1.00 0.00 ATOM 27724 H1 SOL 4207 44.890 12.730 11.200 1.00 0.00 ATOM 27725 H2 SOL 4207 44.200 13.640 10.200 1.00 0.00 ATOM 27726 OH2 SOL 4208 45.570 30.130 71.080 1.00 0.00 ATOM 27727 H1 SOL 4208 45.940 29.330 70.710 1.00 0.00 ATOM 27728 H2 SOL 4208 45.880 30.830 70.510 1.00 0.00 ATOM 27729 OH2 SOL 4209 56.920 28.270 64.340 1.00 0.00 ATOM 27730 H1 SOL 4209 56.460 28.660 65.090 1.00 0.00 ATOM 27731 H2 SOL 4209 56.310 28.380 63.610 1.00 0.00 ATOM 27732 OH2 SOL 4210 6.070 23.300 65.170 1.00 0.00 ATOM 27733 H1 SOL 4210 5.810 23.780 64.380 1.00 0.00 ATOM 27734 H2 SOL 4210 6.290 22.420 64.850 1.00 0.00 ATOM 27735 OH2 SOL 4211 27.020 32.250 75.180 1.00 0.00 ATOM 27736 H1 SOL 4211 26.440 31.690 74.660 1.00 0.00 ATOM 27737 H2 SOL 4211 26.540 32.400 76.000 1.00 0.00 ATOM 27738 OH2 SOL 4212 23.560 56.060 16.270 1.00 0.00 ATOM 27739 H1 SOL 4212 24.210 56.640 16.660 1.00 0.00 ATOM 27740 H2 SOL 4212 23.350 55.430 16.950 1.00 0.00 ATOM 27741 OH2 SOL 4213 16.480 38.560 76.270 1.00 0.00 ATOM 27742 H1 SOL 4213 17.150 38.190 76.850 1.00 0.00 ATOM 27743 H2 SOL 4213 16.060 37.800 75.880 1.00 0.00 ATOM 27744 OH2 SOL 4214 11.590 25.840 14.510 1.00 0.00 ATOM 27745 H1 SOL 4214 10.830 25.540 15.000 1.00 0.00 ATOM 27746 H2 SOL 4214 11.570 25.330 13.700 1.00 0.00 ATOM 27747 OH2 SOL 4215 56.010 58.420 80.380 1.00 0.00 ATOM 27748 H1 SOL 4215 55.700 57.520 80.490 1.00 0.00 ATOM 27749 H2 SOL 4215 56.440 58.410 79.520 1.00 0.00 ATOM 27750 OH2 SOL 4216 56.200 60.510 17.790 1.00 0.00 ATOM 27751 H1 SOL 4216 56.050 61.140 17.090 1.00 0.00 ATOM 27752 H2 SOL 4216 56.450 59.710 17.350 1.00 0.00 ATOM 27753 OH2 SOL 4217 32.700 56.740 18.700 1.00 0.00 ATOM 27754 H1 SOL 4217 32.510 55.870 18.320 1.00 0.00 ATOM 27755 H2 SOL 4217 32.860 56.560 19.620 1.00 0.00 ATOM 27756 OH2 SOL 4218 38.910 11.160 80.160 1.00 0.00 ATOM 27757 H1 SOL 4218 39.220 11.590 80.950 1.00 0.00 ATOM 27758 H2 SOL 4218 39.070 11.790 79.460 1.00 0.00 ATOM 27759 OH2 SOL 4219 58.390 7.280 20.790 1.00 0.00 ATOM 27760 H1 SOL 4219 58.930 6.730 21.360 1.00 0.00 ATOM 27761 H2 SOL 4219 57.970 6.660 20.190 1.00 0.00 ATOM 27762 OH2 SOL 4220 45.350 52.570 1.490 1.00 0.00 ATOM 27763 H1 SOL 4220 45.800 53.420 1.500 1.00 0.00 ATOM 27764 H2 SOL 4220 45.850 52.030 2.100 1.00 0.00 ATOM 27765 OH2 SOL 4221 26.700 43.390 13.450 1.00 0.00 ATOM 27766 H1 SOL 4221 26.550 42.460 13.320 1.00 0.00 ATOM 27767 H2 SOL 4221 26.550 43.780 12.590 1.00 0.00 ATOM 27768 OH2 SOL 4222 56.910 5.120 19.460 1.00 0.00 ATOM 27769 H1 SOL 4222 57.250 5.550 18.680 1.00 0.00 ATOM 27770 H2 SOL 4222 56.640 4.250 19.160 1.00 0.00 ATOM 27771 OH2 SOL 4223 48.220 16.230 65.980 1.00 0.00 ATOM 27772 H1 SOL 4223 48.420 15.370 65.600 1.00 0.00 ATOM 27773 H2 SOL 4223 49.080 16.630 66.130 1.00 0.00 ATOM 27774 OH2 SOL 4224 8.330 43.730 11.900 1.00 0.00 ATOM 27775 H1 SOL 4224 8.870 44.050 11.170 1.00 0.00 ATOM 27776 H2 SOL 4224 7.430 43.800 11.580 1.00 0.00 ATOM 27777 OH2 SOL 4225 44.490 57.910 11.670 1.00 0.00 ATOM 27778 H1 SOL 4225 44.820 57.690 12.540 1.00 0.00 ATOM 27779 H2 SOL 4225 43.950 57.160 11.420 1.00 0.00 ATOM 27780 OH2 SOL 4226 25.120 55.400 20.270 1.00 0.00 ATOM 27781 H1 SOL 4226 25.640 56.210 20.290 1.00 0.00 ATOM 27782 H2 SOL 4226 25.040 55.150 21.190 1.00 0.00 ATOM 27783 OH2 SOL 4227 2.370 3.760 0.240 1.00 0.00 ATOM 27784 H1 SOL 4227 1.960 3.020 0.700 1.00 0.00 ATOM 27785 H2 SOL 4227 1.630 4.270 -0.090 1.00 0.00 ATOM 27786 OH2 SOL 4228 9.270 9.210 3.670 1.00 0.00 ATOM 27787 H1 SOL 4228 9.670 8.340 3.580 1.00 0.00 ATOM 27788 H2 SOL 4228 9.590 9.700 2.920 1.00 0.00 ATOM 27789 OH2 SOL 4229 40.270 54.340 76.830 1.00 0.00 ATOM 27790 H1 SOL 4229 40.190 53.390 76.750 1.00 0.00 ATOM 27791 H2 SOL 4229 39.650 54.580 77.520 1.00 0.00 ATOM 27792 OH2 SOL 4230 37.150 1.080 61.340 1.00 0.00 ATOM 27793 H1 SOL 4230 36.540 0.580 60.810 1.00 0.00 ATOM 27794 H2 SOL 4230 37.760 0.430 61.690 1.00 0.00 ATOM 27795 OH2 SOL 4231 17.560 41.740 81.560 1.00 0.00 ATOM 27796 H1 SOL 4231 17.530 42.520 82.120 1.00 0.00 ATOM 27797 H2 SOL 4231 17.270 42.060 80.700 1.00 0.00 ATOM 27798 OH2 SOL 4232 58.340 48.850 4.340 1.00 0.00 ATOM 27799 H1 SOL 4232 58.980 48.630 3.660 1.00 0.00 ATOM 27800 H2 SOL 4232 57.720 49.440 3.910 1.00 0.00 ATOM 27801 OH2 SOL 4233 16.880 8.530 84.020 1.00 0.00 ATOM 27802 H1 SOL 4233 16.870 9.200 83.330 1.00 0.00 ATOM 27803 H2 SOL 4233 16.130 8.750 84.580 1.00 0.00 ATOM 27804 OH2 SOL 4234 41.470 10.770 10.860 1.00 0.00 ATOM 27805 H1 SOL 4234 40.590 10.580 10.540 1.00 0.00 ATOM 27806 H2 SOL 4234 41.620 10.130 11.550 1.00 0.00 ATOM 27807 OH2 SOL 4235 2.710 12.640 11.000 1.00 0.00 ATOM 27808 H1 SOL 4235 3.460 12.180 11.380 1.00 0.00 ATOM 27809 H2 SOL 4235 3.090 13.180 10.310 1.00 0.00 ATOM 27810 OH2 SOL 4236 7.930 57.330 15.160 1.00 0.00 ATOM 27811 H1 SOL 4236 8.210 58.100 15.660 1.00 0.00 ATOM 27812 H2 SOL 4236 8.710 57.050 14.690 1.00 0.00 ATOM 27813 OH2 SOL 4237 52.190 21.060 21.080 1.00 0.00 ATOM 27814 H1 SOL 4237 52.690 21.190 21.890 1.00 0.00 ATOM 27815 H2 SOL 4237 51.960 21.950 20.800 1.00 0.00 ATOM 27816 OH2 SOL 4238 42.630 16.760 76.690 1.00 0.00 ATOM 27817 H1 SOL 4238 42.670 17.690 76.860 1.00 0.00 ATOM 27818 H2 SOL 4238 43.050 16.650 75.830 1.00 0.00 ATOM 27819 OH2 SOL 4239 45.180 21.410 72.440 1.00 0.00 ATOM 27820 H1 SOL 4239 45.690 21.850 71.770 1.00 0.00 ATOM 27821 H2 SOL 4239 44.310 21.290 72.040 1.00 0.00 ATOM 27822 OH2 SOL 4240 7.920 26.650 82.740 1.00 0.00 ATOM 27823 H1 SOL 4240 7.460 27.330 82.240 1.00 0.00 ATOM 27824 H2 SOL 4240 7.950 26.990 83.630 1.00 0.00 ATOM 27825 OH2 SOL 4241 18.450 61.020 74.770 1.00 0.00 ATOM 27826 H1 SOL 4241 18.400 60.510 75.580 1.00 0.00 ATOM 27827 H2 SOL 4241 19.250 60.700 74.340 1.00 0.00 ATOM 27828 OH2 SOL 4242 5.160 15.040 6.840 1.00 0.00 ATOM 27829 H1 SOL 4242 4.720 15.660 6.250 1.00 0.00 ATOM 27830 H2 SOL 4242 5.920 15.530 7.160 1.00 0.00 ATOM 27831 OH2 SOL 4243 33.900 36.350 79.680 1.00 0.00 ATOM 27832 H1 SOL 4243 34.080 36.720 80.550 1.00 0.00 ATOM 27833 H2 SOL 4243 33.860 35.410 79.820 1.00 0.00 ATOM 27834 OH2 SOL 4244 31.470 24.740 71.580 1.00 0.00 ATOM 27835 H1 SOL 4244 30.980 23.920 71.570 1.00 0.00 ATOM 27836 H2 SOL 4244 32.020 24.710 70.790 1.00 0.00 ATOM 27837 OH2 SOL 4245 53.420 58.690 81.750 1.00 0.00 ATOM 27838 H1 SOL 4245 54.250 58.690 81.270 1.00 0.00 ATOM 27839 H2 SOL 4245 53.540 59.330 82.440 1.00 0.00 ATOM 27840 OH2 SOL 4246 49.990 23.190 14.520 1.00 0.00 ATOM 27841 H1 SOL 4246 49.800 22.460 13.930 1.00 0.00 ATOM 27842 H2 SOL 4246 50.600 23.740 14.020 1.00 0.00 ATOM 27843 OH2 SOL 4247 37.680 56.660 75.270 1.00 0.00 ATOM 27844 H1 SOL 4247 37.620 57.380 75.910 1.00 0.00 ATOM 27845 H2 SOL 4247 37.170 55.950 75.660 1.00 0.00 ATOM 27846 OH2 SOL 4248 0.860 35.360 10.730 1.00 0.00 ATOM 27847 H1 SOL 4248 -0.070 35.250 10.540 1.00 0.00 ATOM 27848 H2 SOL 4248 0.950 35.080 11.640 1.00 0.00 ATOM 27849 OH2 SOL 4249 9.640 1.250 2.520 1.00 0.00 ATOM 27850 H1 SOL 4249 9.080 1.330 3.300 1.00 0.00 ATOM 27851 H2 SOL 4249 9.380 2.000 1.970 1.00 0.00 ATOM 27852 OH2 SOL 4250 34.830 1.260 80.110 1.00 0.00 ATOM 27853 H1 SOL 4250 34.610 1.320 81.030 1.00 0.00 ATOM 27854 H2 SOL 4250 34.010 1.040 79.680 1.00 0.00 ATOM 27855 OH2 SOL 4251 30.400 50.650 15.670 1.00 0.00 ATOM 27856 H1 SOL 4251 29.820 51.410 15.720 1.00 0.00 ATOM 27857 H2 SOL 4251 31.280 51.020 15.730 1.00 0.00 ATOM 27858 OH2 SOL 4252 2.220 27.800 22.050 1.00 0.00 ATOM 27859 H1 SOL 4252 1.470 28.030 22.590 1.00 0.00 ATOM 27860 H2 SOL 4252 2.910 27.580 22.670 1.00 0.00 ATOM 27861 OH2 SOL 4253 12.800 56.910 19.100 1.00 0.00 ATOM 27862 H1 SOL 4253 12.000 57.400 18.920 1.00 0.00 ATOM 27863 H2 SOL 4253 12.760 56.710 20.040 1.00 0.00 ATOM 27864 OH2 SOL 4254 7.270 22.200 20.930 1.00 0.00 ATOM 27865 H1 SOL 4254 6.530 21.710 20.580 1.00 0.00 ATOM 27866 H2 SOL 4254 7.580 22.730 20.200 1.00 0.00 ATOM 27867 OH2 SOL 4255 28.650 57.070 81.880 1.00 0.00 ATOM 27868 H1 SOL 4255 29.040 56.480 81.230 1.00 0.00 ATOM 27869 H2 SOL 4255 29.230 57.010 82.640 1.00 0.00 ATOM 27870 OH2 SOL 4256 16.890 55.480 2.400 1.00 0.00 ATOM 27871 H1 SOL 4256 16.500 55.060 1.630 1.00 0.00 ATOM 27872 H2 SOL 4256 16.420 55.100 3.140 1.00 0.00 ATOM 27873 OH2 SOL 4257 8.820 55.260 10.960 1.00 0.00 ATOM 27874 H1 SOL 4257 8.850 56.160 10.620 1.00 0.00 ATOM 27875 H2 SOL 4257 8.350 54.770 10.290 1.00 0.00 ATOM 27876 OH2 SOL 4258 58.720 30.570 63.440 1.00 0.00 ATOM 27877 H1 SOL 4258 58.390 29.780 63.880 1.00 0.00 ATOM 27878 H2 SOL 4258 58.130 30.700 62.700 1.00 0.00 ATOM 27879 OH2 SOL 4259 34.940 41.840 16.450 1.00 0.00 ATOM 27880 H1 SOL 4259 34.270 42.410 16.080 1.00 0.00 ATOM 27881 H2 SOL 4259 34.450 41.150 16.900 1.00 0.00 ATOM 27882 OH2 SOL 4260 18.070 46.700 19.150 1.00 0.00 ATOM 27883 H1 SOL 4260 18.460 45.830 19.140 1.00 0.00 ATOM 27884 H2 SOL 4260 17.700 46.790 20.030 1.00 0.00 ATOM 27885 OH2 SOL 4261 29.320 29.440 2.740 1.00 0.00 ATOM 27886 H1 SOL 4261 28.360 29.420 2.810 1.00 0.00 ATOM 27887 H2 SOL 4261 29.540 28.580 2.370 1.00 0.00 ATOM 27888 OH2 SOL 4262 55.720 23.400 7.030 1.00 0.00 ATOM 27889 H1 SOL 4262 55.010 22.830 7.320 1.00 0.00 ATOM 27890 H2 SOL 4262 55.380 23.830 6.250 1.00 0.00 ATOM 27891 OH2 SOL 4263 54.540 25.620 18.020 1.00 0.00 ATOM 27892 H1 SOL 4263 54.050 25.680 18.840 1.00 0.00 ATOM 27893 H2 SOL 4263 54.490 26.490 17.640 1.00 0.00 ATOM 27894 OH2 SOL 4264 36.870 10.200 22.030 1.00 0.00 ATOM 27895 H1 SOL 4264 36.970 9.290 21.770 1.00 0.00 ATOM 27896 H2 SOL 4264 37.580 10.660 21.580 1.00 0.00 ATOM 27897 OH2 SOL 4265 21.010 47.400 12.560 1.00 0.00 ATOM 27898 H1 SOL 4265 21.000 46.460 12.720 1.00 0.00 ATOM 27899 H2 SOL 4265 21.910 47.670 12.710 1.00 0.00 ATOM 27900 OH2 SOL 4266 59.590 5.730 13.420 1.00 0.00 ATOM 27901 H1 SOL 4266 59.190 5.490 12.580 1.00 0.00 ATOM 27902 H2 SOL 4266 59.630 6.680 13.400 1.00 0.00 ATOM 27903 OH2 SOL 4267 12.950 10.780 70.690 1.00 0.00 ATOM 27904 H1 SOL 4267 13.500 11.550 70.580 1.00 0.00 ATOM 27905 H2 SOL 4267 13.560 10.040 70.610 1.00 0.00 ATOM 27906 OH2 SOL 4268 5.220 7.520 9.870 1.00 0.00 ATOM 27907 H1 SOL 4268 5.600 7.270 10.710 1.00 0.00 ATOM 27908 H2 SOL 4268 5.450 8.440 9.770 1.00 0.00 ATOM 27909 OH2 SOL 4269 13.140 14.190 20.730 1.00 0.00 ATOM 27910 H1 SOL 4269 13.570 14.820 20.160 1.00 0.00 ATOM 27911 H2 SOL 4269 12.200 14.320 20.570 1.00 0.00 ATOM 27912 OH2 SOL 4270 40.240 56.080 16.460 1.00 0.00 ATOM 27913 H1 SOL 4270 39.650 56.790 16.200 1.00 0.00 ATOM 27914 H2 SOL 4270 39.800 55.670 17.210 1.00 0.00 ATOM 27915 OH2 SOL 4271 21.140 45.260 6.690 1.00 0.00 ATOM 27916 H1 SOL 4271 20.900 45.340 7.610 1.00 0.00 ATOM 27917 H2 SOL 4271 20.300 45.270 6.220 1.00 0.00 ATOM 27918 OH2 SOL 4272 43.780 9.550 16.120 1.00 0.00 ATOM 27919 H1 SOL 4272 43.820 10.460 16.400 1.00 0.00 ATOM 27920 H2 SOL 4272 43.740 9.050 16.930 1.00 0.00 ATOM 27921 OH2 SOL 4273 53.800 18.410 64.240 1.00 0.00 ATOM 27922 H1 SOL 4273 53.240 19.070 64.640 1.00 0.00 ATOM 27923 H2 SOL 4273 54.650 18.530 64.670 1.00 0.00 ATOM 27924 OH2 SOL 4274 39.280 37.210 66.970 1.00 0.00 ATOM 27925 H1 SOL 4274 38.820 37.530 66.190 1.00 0.00 ATOM 27926 H2 SOL 4274 39.960 37.870 67.140 1.00 0.00 ATOM 27927 OH2 SOL 4275 27.340 19.730 69.760 1.00 0.00 ATOM 27928 H1 SOL 4275 27.950 19.500 70.460 1.00 0.00 ATOM 27929 H2 SOL 4275 27.080 20.630 69.950 1.00 0.00 ATOM 27930 OH2 SOL 4276 8.690 28.920 79.610 1.00 0.00 ATOM 27931 H1 SOL 4276 9.490 29.000 80.130 1.00 0.00 ATOM 27932 H2 SOL 4276 8.090 29.580 79.970 1.00 0.00 ATOM 27933 OH2 SOL 4277 44.960 1.930 83.900 1.00 0.00 ATOM 27934 H1 SOL 4277 44.120 2.380 83.780 1.00 0.00 ATOM 27935 H2 SOL 4277 45.160 1.550 83.050 1.00 0.00 ATOM 27936 OH2 SOL 4278 30.630 57.560 10.470 1.00 0.00 ATOM 27937 H1 SOL 4278 31.350 57.200 11.000 1.00 0.00 ATOM 27938 H2 SOL 4278 30.770 57.200 9.600 1.00 0.00 ATOM 27939 OH2 SOL 4279 13.670 28.680 78.890 1.00 0.00 ATOM 27940 H1 SOL 4279 13.450 29.450 79.410 1.00 0.00 ATOM 27941 H2 SOL 4279 13.790 29.010 78.000 1.00 0.00 ATOM 27942 OH2 SOL 4280 36.370 48.090 80.860 1.00 0.00 ATOM 27943 H1 SOL 4280 36.340 47.310 81.410 1.00 0.00 ATOM 27944 H2 SOL 4280 35.470 48.210 80.560 1.00 0.00 ATOM 27945 OH2 SOL 4281 49.790 48.770 75.160 1.00 0.00 ATOM 27946 H1 SOL 4281 50.230 48.920 74.320 1.00 0.00 ATOM 27947 H2 SOL 4281 50.440 48.990 75.820 1.00 0.00 ATOM 27948 OH2 SOL 4282 2.830 43.860 70.870 1.00 0.00 ATOM 27949 H1 SOL 4282 2.960 43.980 69.930 1.00 0.00 ATOM 27950 H2 SOL 4282 2.150 44.500 71.090 1.00 0.00 ATOM 27951 OH2 SOL 4283 36.550 20.100 0.060 1.00 0.00 ATOM 27952 H1 SOL 4283 36.390 20.930 -0.390 1.00 0.00 ATOM 27953 H2 SOL 4283 35.690 19.830 0.380 1.00 0.00 ATOM 27954 OH2 SOL 4284 5.190 14.710 10.960 1.00 0.00 ATOM 27955 H1 SOL 4284 4.630 15.090 11.630 1.00 0.00 ATOM 27956 H2 SOL 4284 4.810 14.980 10.130 1.00 0.00 ATOM 27957 OH2 SOL 4285 15.550 0.990 19.700 1.00 0.00 ATOM 27958 H1 SOL 4285 15.160 0.150 19.480 1.00 0.00 ATOM 27959 H2 SOL 4285 16.030 0.830 20.510 1.00 0.00 ATOM 27960 OH2 SOL 4286 44.980 60.100 58.180 1.00 0.00 ATOM 27961 H1 SOL 4286 45.890 60.280 58.430 1.00 0.00 ATOM 27962 H2 SOL 4286 44.990 59.190 57.870 1.00 0.00 ATOM 27963 OH2 SOL 4287 14.310 30.560 84.310 1.00 0.00 ATOM 27964 H1 SOL 4287 14.880 31.160 84.790 1.00 0.00 ATOM 27965 H2 SOL 4287 13.890 31.110 83.640 1.00 0.00 ATOM 27966 OH2 SOL 4288 45.670 53.900 60.200 1.00 0.00 ATOM 27967 H1 SOL 4288 46.540 54.000 60.580 1.00 0.00 ATOM 27968 H2 SOL 4288 45.240 54.740 60.330 1.00 0.00 ATOM 27969 OH2 SOL 4289 52.990 7.770 82.860 1.00 0.00 ATOM 27970 H1 SOL 4289 52.920 8.480 82.220 1.00 0.00 ATOM 27971 H2 SOL 4289 53.000 8.210 83.710 1.00 0.00 ATOM 27972 OH2 SOL 4290 32.920 60.420 61.220 1.00 0.00 ATOM 27973 H1 SOL 4290 32.700 59.570 60.840 1.00 0.00 ATOM 27974 H2 SOL 4290 33.660 60.730 60.700 1.00 0.00 ATOM 27975 OH2 SOL 4291 29.610 8.240 71.830 1.00 0.00 ATOM 27976 H1 SOL 4291 29.670 8.510 70.910 1.00 0.00 ATOM 27977 H2 SOL 4291 29.530 9.070 72.310 1.00 0.00 ATOM 27978 OH2 SOL 4292 7.680 7.670 -0.170 1.00 0.00 ATOM 27979 H1 SOL 4292 6.760 7.590 0.080 1.00 0.00 ATOM 27980 H2 SOL 4292 8.140 7.050 0.400 1.00 0.00 ATOM 27981 OH2 SOL 4293 3.070 31.530 17.410 1.00 0.00 ATOM 27982 H1 SOL 4293 3.010 31.980 18.250 1.00 0.00 ATOM 27983 H2 SOL 4293 2.310 31.830 16.910 1.00 0.00 ATOM 27984 OH2 SOL 4294 45.010 49.070 0.740 1.00 0.00 ATOM 27985 H1 SOL 4294 45.130 48.270 1.250 1.00 0.00 ATOM 27986 H2 SOL 4294 45.890 49.410 0.610 1.00 0.00 ATOM 27987 OH2 SOL 4295 33.810 33.800 68.410 1.00 0.00 ATOM 27988 H1 SOL 4295 33.700 33.640 67.480 1.00 0.00 ATOM 27989 H2 SOL 4295 33.850 34.760 68.490 1.00 0.00 ATOM 27990 OH2 SOL 4296 43.580 2.430 71.820 1.00 0.00 ATOM 27991 H1 SOL 4296 43.380 1.950 72.620 1.00 0.00 ATOM 27992 H2 SOL 4296 44.320 1.960 71.430 1.00 0.00 ATOM 27993 OH2 SOL 4297 55.450 19.260 80.110 1.00 0.00 ATOM 27994 H1 SOL 4297 55.820 18.380 80.100 1.00 0.00 ATOM 27995 H2 SOL 4297 54.510 19.130 79.950 1.00 0.00 ATOM 27996 OH2 SOL 4298 55.600 58.210 0.900 1.00 0.00 ATOM 27997 H1 SOL 4298 55.700 57.610 1.640 1.00 0.00 ATOM 27998 H2 SOL 4298 54.820 57.900 0.440 1.00 0.00 ATOM 27999 OH2 SOL 4299 22.540 28.030 8.760 1.00 0.00 ATOM 28000 H1 SOL 4299 22.700 28.920 8.440 1.00 0.00 ATOM 28001 H2 SOL 4299 21.700 28.090 9.220 1.00 0.00 ATOM 28002 OH2 SOL 4300 26.220 21.590 72.440 1.00 0.00 ATOM 28003 H1 SOL 4300 25.980 21.820 71.540 1.00 0.00 ATOM 28004 H2 SOL 4300 26.730 20.780 72.350 1.00 0.00 ATOM 28005 OH2 SOL 4301 22.910 32.560 5.860 1.00 0.00 ATOM 28006 H1 SOL 4301 21.960 32.520 5.960 1.00 0.00 ATOM 28007 H2 SOL 4301 23.250 32.440 6.750 1.00 0.00 ATOM 28008 OH2 SOL 4302 53.540 20.920 17.780 1.00 0.00 ATOM 28009 H1 SOL 4302 52.870 21.170 18.410 1.00 0.00 ATOM 28010 H2 SOL 4302 53.070 20.790 16.960 1.00 0.00 ATOM 28011 OH2 SOL 4303 49.070 8.490 65.540 1.00 0.00 ATOM 28012 H1 SOL 4303 48.450 7.920 65.100 1.00 0.00 ATOM 28013 H2 SOL 4303 48.530 9.120 66.010 1.00 0.00 ATOM 28014 OH2 SOL 4304 57.430 40.260 82.860 1.00 0.00 ATOM 28015 H1 SOL 4304 57.450 40.530 83.770 1.00 0.00 ATOM 28016 H2 SOL 4304 58.180 40.700 82.460 1.00 0.00 ATOM 28017 OH2 SOL 4305 32.260 5.720 8.860 1.00 0.00 ATOM 28018 H1 SOL 4305 33.120 5.510 8.490 1.00 0.00 ATOM 28019 H2 SOL 4305 31.860 4.860 9.040 1.00 0.00 ATOM 28020 OH2 SOL 4306 0.720 51.580 72.010 1.00 0.00 ATOM 28021 H1 SOL 4306 0.210 51.100 71.350 1.00 0.00 ATOM 28022 H2 SOL 4306 1.460 51.940 71.530 1.00 0.00 ATOM 28023 OH2 SOL 4307 4.290 58.810 70.920 1.00 0.00 ATOM 28024 H1 SOL 4307 4.050 59.420 70.220 1.00 0.00 ATOM 28025 H2 SOL 4307 5.230 58.930 71.030 1.00 0.00 ATOM 28026 OH2 SOL 4308 1.500 28.580 1.670 1.00 0.00 ATOM 28027 H1 SOL 4308 0.760 28.060 1.370 1.00 0.00 ATOM 28028 H2 SOL 4308 2.270 28.100 1.370 1.00 0.00 ATOM 28029 OH2 SOL 4309 54.890 24.410 15.730 1.00 0.00 ATOM 28030 H1 SOL 4309 54.810 24.880 16.570 1.00 0.00 ATOM 28031 H2 SOL 4309 55.810 24.140 15.700 1.00 0.00 ATOM 28032 OH2 SOL 4310 44.660 54.320 15.670 1.00 0.00 ATOM 28033 H1 SOL 4310 44.740 53.420 16.000 1.00 0.00 ATOM 28034 H2 SOL 4310 44.330 54.210 14.780 1.00 0.00 ATOM 28035 OH2 SOL 4311 5.660 3.090 13.720 1.00 0.00 ATOM 28036 H1 SOL 4311 6.350 3.740 13.790 1.00 0.00 ATOM 28037 H2 SOL 4311 5.990 2.330 14.190 1.00 0.00 ATOM 28038 OH2 SOL 4312 11.390 38.280 5.790 1.00 0.00 ATOM 28039 H1 SOL 4312 11.960 38.010 5.070 1.00 0.00 ATOM 28040 H2 SOL 4312 10.830 37.520 5.960 1.00 0.00 ATOM 28041 OH2 SOL 4313 36.990 4.350 81.950 1.00 0.00 ATOM 28042 H1 SOL 4313 36.190 4.860 81.800 1.00 0.00 ATOM 28043 H2 SOL 4313 37.190 4.490 82.880 1.00 0.00 ATOM 28044 OH2 SOL 4314 20.350 50.590 78.180 1.00 0.00 ATOM 28045 H1 SOL 4314 19.820 50.620 78.980 1.00 0.00 ATOM 28046 H2 SOL 4314 20.400 49.670 77.950 1.00 0.00 ATOM 28047 OH2 SOL 4315 58.430 28.090 5.320 1.00 0.00 ATOM 28048 H1 SOL 4315 57.770 28.690 4.990 1.00 0.00 ATOM 28049 H2 SOL 4315 58.750 27.640 4.540 1.00 0.00 ATOM 28050 OH2 SOL 4316 27.370 33.720 21.290 1.00 0.00 ATOM 28051 H1 SOL 4316 26.520 34.140 21.410 1.00 0.00 ATOM 28052 H2 SOL 4316 27.150 32.820 21.030 1.00 0.00 ATOM 28053 OH2 SOL 4317 42.550 54.300 66.600 1.00 0.00 ATOM 28054 H1 SOL 4317 43.410 53.860 66.600 1.00 0.00 ATOM 28055 H2 SOL 4317 42.710 55.130 66.150 1.00 0.00 ATOM 28056 OH2 SOL 4318 23.010 21.030 66.730 1.00 0.00 ATOM 28057 H1 SOL 4318 22.100 20.840 66.970 1.00 0.00 ATOM 28058 H2 SOL 4318 23.530 20.700 67.460 1.00 0.00 ATOM 28059 OH2 SOL 4319 24.590 25.360 67.490 1.00 0.00 ATOM 28060 H1 SOL 4319 24.110 26.160 67.290 1.00 0.00 ATOM 28061 H2 SOL 4319 24.260 25.090 68.350 1.00 0.00 ATOM 28062 OH2 SOL 4320 24.390 32.860 10.910 1.00 0.00 ATOM 28063 H1 SOL 4320 24.070 33.750 10.750 1.00 0.00 ATOM 28064 H2 SOL 4320 25.260 32.980 11.280 1.00 0.00 ATOM 28065 OH2 SOL 4321 47.240 3.650 69.910 1.00 0.00 ATOM 28066 H1 SOL 4321 47.080 2.810 69.470 1.00 0.00 ATOM 28067 H2 SOL 4321 46.950 4.310 69.290 1.00 0.00 ATOM 28068 OH2 SOL 4322 17.320 10.870 4.840 1.00 0.00 ATOM 28069 H1 SOL 4322 16.840 10.670 5.640 1.00 0.00 ATOM 28070 H2 SOL 4322 18.240 10.910 5.110 1.00 0.00 ATOM 28071 OH2 SOL 4323 15.620 33.900 76.720 1.00 0.00 ATOM 28072 H1 SOL 4323 15.760 33.810 77.660 1.00 0.00 ATOM 28073 H2 SOL 4323 16.350 33.420 76.320 1.00 0.00 ATOM 28074 OH2 SOL 4324 25.440 9.540 11.550 1.00 0.00 ATOM 28075 H1 SOL 4324 25.390 8.600 11.400 1.00 0.00 ATOM 28076 H2 SOL 4324 26.380 9.720 11.610 1.00 0.00 ATOM 28077 OH2 SOL 4325 53.780 42.710 67.510 1.00 0.00 ATOM 28078 H1 SOL 4325 54.630 42.710 67.950 1.00 0.00 ATOM 28079 H2 SOL 4325 53.480 43.610 67.560 1.00 0.00 ATOM 28080 OH2 SOL 4326 19.790 22.020 15.660 1.00 0.00 ATOM 28081 H1 SOL 4326 18.910 22.090 16.010 1.00 0.00 ATOM 28082 H2 SOL 4326 20.320 21.740 16.400 1.00 0.00 ATOM 28083 OH2 SOL 4327 50.960 57.670 19.920 1.00 0.00 ATOM 28084 H1 SOL 4327 51.070 57.310 19.040 1.00 0.00 ATOM 28085 H2 SOL 4327 50.070 57.430 20.170 1.00 0.00 ATOM 28086 OH2 SOL 4328 28.620 7.290 4.140 1.00 0.00 ATOM 28087 H1 SOL 4328 27.690 7.450 4.310 1.00 0.00 ATOM 28088 H2 SOL 4328 28.770 6.390 4.440 1.00 0.00 ATOM 28089 OH2 SOL 4329 15.240 40.360 68.980 1.00 0.00 ATOM 28090 H1 SOL 4329 15.620 39.630 69.470 1.00 0.00 ATOM 28091 H2 SOL 4329 15.260 41.090 69.590 1.00 0.00 ATOM 28092 OH2 SOL 4330 36.360 33.950 84.550 1.00 0.00 ATOM 28093 H1 SOL 4330 36.990 33.330 84.900 1.00 0.00 ATOM 28094 H2 SOL 4330 36.800 34.800 84.600 1.00 0.00 ATOM 28095 OH2 SOL 4331 42.660 60.850 59.440 1.00 0.00 ATOM 28096 H1 SOL 4331 43.310 60.560 58.800 1.00 0.00 ATOM 28097 H2 SOL 4331 42.270 60.040 59.770 1.00 0.00 ATOM 28098 OH2 SOL 4332 30.400 37.080 68.930 1.00 0.00 ATOM 28099 H1 SOL 4332 30.630 36.380 68.310 1.00 0.00 ATOM 28100 H2 SOL 4332 30.330 36.630 69.770 1.00 0.00 ATOM 28101 OH2 SOL 4333 9.580 49.120 70.270 1.00 0.00 ATOM 28102 H1 SOL 4333 9.760 48.180 70.240 1.00 0.00 ATOM 28103 H2 SOL 4333 9.610 49.330 71.210 1.00 0.00 ATOM 28104 OH2 SOL 4334 50.940 57.820 7.310 1.00 0.00 ATOM 28105 H1 SOL 4334 51.070 57.080 6.720 1.00 0.00 ATOM 28106 H2 SOL 4334 51.810 57.990 7.680 1.00 0.00 ATOM 28107 OH2 SOL 4335 14.160 37.240 0.860 1.00 0.00 ATOM 28108 H1 SOL 4335 14.380 36.860 0.010 1.00 0.00 ATOM 28109 H2 SOL 4335 13.350 37.720 0.710 1.00 0.00 ATOM 28110 OH2 SOL 4336 37.120 19.920 16.560 1.00 0.00 ATOM 28111 H1 SOL 4336 37.470 19.220 16.010 1.00 0.00 ATOM 28112 H2 SOL 4336 37.840 20.550 16.640 1.00 0.00 ATOM 28113 OH2 SOL 4337 35.520 49.400 67.880 1.00 0.00 ATOM 28114 H1 SOL 4337 35.440 48.990 67.020 1.00 0.00 ATOM 28115 H2 SOL 4337 35.750 48.680 68.470 1.00 0.00 ATOM 28116 OH2 SOL 4338 7.230 58.540 73.720 1.00 0.00 ATOM 28117 H1 SOL 4338 6.520 58.950 74.220 1.00 0.00 ATOM 28118 H2 SOL 4338 7.660 59.270 73.270 1.00 0.00 ATOM 28119 OH2 SOL 4339 5.240 45.870 24.180 1.00 0.00 ATOM 28120 H1 SOL 4339 5.490 46.790 24.110 1.00 0.00 ATOM 28121 H2 SOL 4339 5.360 45.650 25.100 1.00 0.00 ATOM 28122 OH2 SOL 4340 3.260 25.640 10.400 1.00 0.00 ATOM 28123 H1 SOL 4340 3.730 24.820 10.550 1.00 0.00 ATOM 28124 H2 SOL 4340 2.690 25.740 11.160 1.00 0.00 ATOM 28125 OH2 SOL 4341 21.070 46.760 9.020 1.00 0.00 ATOM 28126 H1 SOL 4341 21.610 47.510 8.760 1.00 0.00 ATOM 28127 H2 SOL 4341 21.700 46.080 9.250 1.00 0.00 ATOM 28128 OH2 SOL 4342 31.530 52.380 66.270 1.00 0.00 ATOM 28129 H1 SOL 4342 32.200 51.740 66.500 1.00 0.00 ATOM 28130 H2 SOL 4342 31.930 53.230 66.450 1.00 0.00 ATOM 28131 OH2 SOL 4343 31.270 55.200 64.690 1.00 0.00 ATOM 28132 H1 SOL 4343 30.870 56.050 64.890 1.00 0.00 ATOM 28133 H2 SOL 4343 32.070 55.180 65.220 1.00 0.00 ATOM 28134 OH2 SOL 4344 3.610 24.500 72.840 1.00 0.00 ATOM 28135 H1 SOL 4344 3.300 23.830 72.230 1.00 0.00 ATOM 28136 H2 SOL 4344 3.880 25.230 72.280 1.00 0.00 ATOM 28137 OH2 SOL 4345 57.420 35.600 79.360 1.00 0.00 ATOM 28138 H1 SOL 4345 58.120 34.990 79.580 1.00 0.00 ATOM 28139 H2 SOL 4345 56.650 35.050 79.240 1.00 0.00 ATOM 28140 OH2 SOL 4346 14.490 59.120 73.850 1.00 0.00 ATOM 28141 H1 SOL 4346 14.440 58.180 74.040 1.00 0.00 ATOM 28142 H2 SOL 4346 13.850 59.250 73.150 1.00 0.00 ATOM 28143 OH2 SOL 4347 15.330 48.890 2.320 1.00 0.00 ATOM 28144 H1 SOL 4347 14.490 49.310 2.480 1.00 0.00 ATOM 28145 H2 SOL 4347 15.920 49.600 2.050 1.00 0.00 ATOM 28146 OH2 SOL 4348 22.740 55.640 78.290 1.00 0.00 ATOM 28147 H1 SOL 4348 21.950 55.160 78.070 1.00 0.00 ATOM 28148 H2 SOL 4348 22.850 55.510 79.230 1.00 0.00 ATOM 28149 OH2 SOL 4349 40.870 23.450 7.220 1.00 0.00 ATOM 28150 H1 SOL 4349 41.610 23.680 7.780 1.00 0.00 ATOM 28151 H2 SOL 4349 41.230 23.480 6.330 1.00 0.00 ATOM 28152 OH2 SOL 4350 39.220 47.460 13.860 1.00 0.00 ATOM 28153 H1 SOL 4350 38.850 48.200 14.340 1.00 0.00 ATOM 28154 H2 SOL 4350 40.110 47.730 13.650 1.00 0.00 ATOM 28155 OH2 SOL 4351 45.310 18.120 59.260 1.00 0.00 ATOM 28156 H1 SOL 4351 45.740 17.630 59.960 1.00 0.00 ATOM 28157 H2 SOL 4351 44.370 18.030 59.450 1.00 0.00 ATOM 28158 OH2 SOL 4352 56.070 31.440 15.200 1.00 0.00 ATOM 28159 H1 SOL 4352 56.250 30.810 15.890 1.00 0.00 ATOM 28160 H2 SOL 4352 56.010 32.280 15.640 1.00 0.00 ATOM 28161 OH2 SOL 4353 51.910 28.540 3.560 1.00 0.00 ATOM 28162 H1 SOL 4353 52.240 27.750 3.980 1.00 0.00 ATOM 28163 H2 SOL 4353 51.360 28.960 4.220 1.00 0.00 ATOM 28164 OH2 SOL 4354 24.590 53.230 77.980 1.00 0.00 ATOM 28165 H1 SOL 4354 24.680 54.180 78.060 1.00 0.00 ATOM 28166 H2 SOL 4354 23.740 53.030 78.370 1.00 0.00 ATOM 28167 OH2 SOL 4355 21.090 8.270 7.100 1.00 0.00 ATOM 28168 H1 SOL 4355 21.240 9.150 7.450 1.00 0.00 ATOM 28169 H2 SOL 4355 20.410 7.900 7.660 1.00 0.00 ATOM 28170 OH2 SOL 4356 20.600 17.570 79.650 1.00 0.00 ATOM 28171 H1 SOL 4356 20.870 17.360 80.540 1.00 0.00 ATOM 28172 H2 SOL 4356 20.430 18.510 79.670 1.00 0.00 ATOM 28173 OH2 SOL 4357 57.130 50.610 67.590 1.00 0.00 ATOM 28174 H1 SOL 4357 56.830 50.560 66.680 1.00 0.00 ATOM 28175 H2 SOL 4357 57.820 51.270 67.580 1.00 0.00 ATOM 28176 OH2 SOL 4358 11.350 9.050 19.680 1.00 0.00 ATOM 28177 H1 SOL 4358 12.190 8.800 19.300 1.00 0.00 ATOM 28178 H2 SOL 4358 11.040 8.250 20.100 1.00 0.00 ATOM 28179 OH2 SOL 4359 58.930 14.350 79.160 1.00 0.00 ATOM 28180 H1 SOL 4359 59.530 15.090 79.230 1.00 0.00 ATOM 28181 H2 SOL 4359 59.250 13.860 78.410 1.00 0.00 ATOM 28182 OH2 SOL 4360 52.470 19.990 65.970 1.00 0.00 ATOM 28183 H1 SOL 4360 51.530 19.820 66.020 1.00 0.00 ATOM 28184 H2 SOL 4360 52.630 20.640 66.660 1.00 0.00 ATOM 28185 OH2 SOL 4361 46.930 55.090 83.350 1.00 0.00 ATOM 28186 H1 SOL 4361 46.080 55.170 83.770 1.00 0.00 ATOM 28187 H2 SOL 4361 47.160 55.990 83.090 1.00 0.00 ATOM 28188 OH2 SOL 4362 16.340 10.500 13.760 1.00 0.00 ATOM 28189 H1 SOL 4362 15.450 10.420 13.400 1.00 0.00 ATOM 28190 H2 SOL 4362 16.620 11.370 13.510 1.00 0.00 ATOM 28191 OH2 SOL 4363 52.040 37.590 1.200 1.00 0.00 ATOM 28192 H1 SOL 4363 51.170 37.290 0.950 1.00 0.00 ATOM 28193 H2 SOL 4363 51.910 38.490 1.480 1.00 0.00 ATOM 28194 OH2 SOL 4364 24.450 23.880 77.000 1.00 0.00 ATOM 28195 H1 SOL 4364 24.350 23.530 76.120 1.00 0.00 ATOM 28196 H2 SOL 4364 24.280 24.820 76.910 1.00 0.00 ATOM 28197 OH2 SOL 4365 45.060 44.990 10.440 1.00 0.00 ATOM 28198 H1 SOL 4365 45.030 45.950 10.450 1.00 0.00 ATOM 28199 H2 SOL 4365 45.320 44.770 9.550 1.00 0.00 ATOM 28200 OH2 SOL 4366 21.940 36.470 72.100 1.00 0.00 ATOM 28201 H1 SOL 4366 22.190 36.520 73.030 1.00 0.00 ATOM 28202 H2 SOL 4366 22.740 36.690 71.630 1.00 0.00 ATOM 28203 OH2 SOL 4367 49.890 28.610 79.160 1.00 0.00 ATOM 28204 H1 SOL 4367 50.640 29.190 78.980 1.00 0.00 ATOM 28205 H2 SOL 4367 49.150 29.030 78.710 1.00 0.00 ATOM 28206 OH2 SOL 4368 59.020 9.220 3.670 1.00 0.00 ATOM 28207 H1 SOL 4368 58.620 8.670 4.340 1.00 0.00 ATOM 28208 H2 SOL 4368 59.790 8.730 3.380 1.00 0.00 ATOM 28209 OH2 SOL 4369 17.670 51.630 13.600 1.00 0.00 ATOM 28210 H1 SOL 4369 18.610 51.670 13.450 1.00 0.00 ATOM 28211 H2 SOL 4369 17.580 51.310 14.500 1.00 0.00 ATOM 28212 OH2 SOL 4370 14.920 57.600 10.580 1.00 0.00 ATOM 28213 H1 SOL 4370 15.120 56.670 10.440 1.00 0.00 ATOM 28214 H2 SOL 4370 14.180 57.600 11.190 1.00 0.00 ATOM 28215 OH2 SOL 4371 22.310 19.020 23.110 1.00 0.00 ATOM 28216 H1 SOL 4371 23.020 18.850 22.500 1.00 0.00 ATOM 28217 H2 SOL 4371 22.400 18.350 23.780 1.00 0.00 ATOM 28218 OH2 SOL 4372 51.510 8.930 69.600 1.00 0.00 ATOM 28219 H1 SOL 4372 52.070 9.660 69.350 1.00 0.00 ATOM 28220 H2 SOL 4372 52.070 8.380 70.160 1.00 0.00 ATOM 28221 OH2 SOL 4373 35.420 60.760 59.630 1.00 0.00 ATOM 28222 H1 SOL 4373 35.180 59.910 59.270 1.00 0.00 ATOM 28223 H2 SOL 4373 35.220 61.390 58.940 1.00 0.00 ATOM 28224 OH2 SOL 4374 23.120 9.880 72.350 1.00 0.00 ATOM 28225 H1 SOL 4374 22.830 10.230 73.200 1.00 0.00 ATOM 28226 H2 SOL 4374 24.030 9.630 72.490 1.00 0.00 ATOM 28227 OH2 SOL 4375 8.340 56.160 78.400 1.00 0.00 ATOM 28228 H1 SOL 4375 8.260 56.100 77.450 1.00 0.00 ATOM 28229 H2 SOL 4375 7.650 56.780 78.660 1.00 0.00 ATOM 28230 OH2 SOL 4376 13.420 6.140 11.930 1.00 0.00 ATOM 28231 H1 SOL 4376 14.120 6.250 12.570 1.00 0.00 ATOM 28232 H2 SOL 4376 12.710 5.720 12.430 1.00 0.00 ATOM 28233 OH2 SOL 4377 23.000 17.050 6.910 1.00 0.00 ATOM 28234 H1 SOL 4377 22.120 16.660 6.830 1.00 0.00 ATOM 28235 H2 SOL 4377 23.590 16.350 6.630 1.00 0.00 ATOM 28236 OH2 SOL 4378 14.660 14.890 74.300 1.00 0.00 ATOM 28237 H1 SOL 4378 15.210 15.470 74.820 1.00 0.00 ATOM 28238 H2 SOL 4378 14.630 15.300 73.430 1.00 0.00 ATOM 28239 OH2 SOL 4379 19.990 0.370 4.440 1.00 0.00 ATOM 28240 H1 SOL 4379 20.030 -0.550 4.180 1.00 0.00 ATOM 28241 H2 SOL 4379 20.900 0.670 4.400 1.00 0.00 ATOM 28242 OH2 SOL 4380 40.230 16.970 -0.160 1.00 0.00 ATOM 28243 H1 SOL 4380 40.460 16.060 -0.330 1.00 0.00 ATOM 28244 H2 SOL 4380 39.570 16.930 0.540 1.00 0.00 ATOM 28245 OH2 SOL 4381 23.360 2.010 74.010 1.00 0.00 ATOM 28246 H1 SOL 4381 23.010 1.230 73.590 1.00 0.00 ATOM 28247 H2 SOL 4381 23.380 1.780 74.950 1.00 0.00 ATOM 28248 OH2 SOL 4382 22.820 21.590 23.010 1.00 0.00 ATOM 28249 H1 SOL 4382 22.460 20.700 23.030 1.00 0.00 ATOM 28250 H2 SOL 4382 22.700 21.920 23.900 1.00 0.00 ATOM 28251 OH2 SOL 4383 36.130 24.870 4.060 1.00 0.00 ATOM 28252 H1 SOL 4383 36.500 25.710 3.790 1.00 0.00 ATOM 28253 H2 SOL 4383 35.770 24.490 3.260 1.00 0.00 ATOM 28254 OH2 SOL 4384 27.480 3.490 7.080 1.00 0.00 ATOM 28255 H1 SOL 4384 27.490 4.450 7.050 1.00 0.00 ATOM 28256 H2 SOL 4384 28.350 3.230 6.800 1.00 0.00 ATOM 28257 OH2 SOL 4385 57.890 6.520 6.840 1.00 0.00 ATOM 28258 H1 SOL 4385 58.000 7.470 6.910 1.00 0.00 ATOM 28259 H2 SOL 4385 58.610 6.150 7.360 1.00 0.00 ATOM 28260 OH2 SOL 4386 4.970 25.890 1.120 1.00 0.00 ATOM 28261 H1 SOL 4386 4.030 25.760 1.180 1.00 0.00 ATOM 28262 H2 SOL 4386 5.090 26.840 1.090 1.00 0.00 ATOM 28263 OH2 SOL 4387 1.210 33.640 13.540 1.00 0.00 ATOM 28264 H1 SOL 4387 1.570 33.040 12.890 1.00 0.00 ATOM 28265 H2 SOL 4387 1.840 34.360 13.580 1.00 0.00 ATOM 28266 OH2 SOL 4388 1.540 13.160 71.860 1.00 0.00 ATOM 28267 H1 SOL 4388 1.790 12.280 72.160 1.00 0.00 ATOM 28268 H2 SOL 4388 1.890 13.750 72.520 1.00 0.00 ATOM 28269 OH2 SOL 4389 22.450 56.620 5.160 1.00 0.00 ATOM 28270 H1 SOL 4389 22.310 57.570 5.150 1.00 0.00 ATOM 28271 H2 SOL 4389 22.150 56.350 6.030 1.00 0.00 ATOM 28272 OH2 SOL 4390 41.600 22.890 84.080 1.00 0.00 ATOM 28273 H1 SOL 4390 41.210 23.500 84.710 1.00 0.00 ATOM 28274 H2 SOL 4390 40.860 22.380 83.760 1.00 0.00 ATOM 28275 OH2 SOL 4391 30.850 48.000 6.470 1.00 0.00 ATOM 28276 H1 SOL 4391 31.160 48.840 6.790 1.00 0.00 ATOM 28277 H2 SOL 4391 30.420 47.590 7.220 1.00 0.00 ATOM 28278 OH2 SOL 4392 57.860 32.610 69.040 1.00 0.00 ATOM 28279 H1 SOL 4392 58.760 32.390 68.790 1.00 0.00 ATOM 28280 H2 SOL 4392 57.370 31.800 68.890 1.00 0.00 ATOM 28281 OH2 SOL 4393 39.640 48.710 19.930 1.00 0.00 ATOM 28282 H1 SOL 4393 39.170 48.510 20.740 1.00 0.00 ATOM 28283 H2 SOL 4393 40.460 48.210 20.000 1.00 0.00 ATOM 28284 OH2 SOL 4394 9.100 37.600 72.840 1.00 0.00 ATOM 28285 H1 SOL 4394 8.440 37.050 72.420 1.00 0.00 ATOM 28286 H2 SOL 4394 8.590 38.170 73.420 1.00 0.00 ATOM 28287 OH2 SOL 4395 38.910 21.630 66.840 1.00 0.00 ATOM 28288 H1 SOL 4395 38.380 21.660 67.640 1.00 0.00 ATOM 28289 H2 SOL 4395 38.710 20.780 66.460 1.00 0.00 ATOM 28290 OH2 SOL 4396 51.910 2.360 9.010 1.00 0.00 ATOM 28291 H1 SOL 4396 50.980 2.590 9.080 1.00 0.00 ATOM 28292 H2 SOL 4396 52.190 2.260 9.920 1.00 0.00 ATOM 28293 OH2 SOL 4397 2.330 40.000 69.140 1.00 0.00 ATOM 28294 H1 SOL 4397 2.270 39.770 68.210 1.00 0.00 ATOM 28295 H2 SOL 4397 1.490 40.420 69.330 1.00 0.00 ATOM 28296 OH2 SOL 4398 50.710 6.040 25.550 1.00 0.00 ATOM 28297 H1 SOL 4398 50.040 5.360 25.640 1.00 0.00 ATOM 28298 H2 SOL 4398 51.540 5.580 25.620 1.00 0.00 ATOM 28299 OH2 SOL 4399 51.260 34.840 65.720 1.00 0.00 ATOM 28300 H1 SOL 4399 50.870 35.700 65.840 1.00 0.00 ATOM 28301 H2 SOL 4399 50.910 34.540 64.880 1.00 0.00 ATOM 28302 OH2 SOL 4400 24.130 8.970 63.470 1.00 0.00 ATOM 28303 H1 SOL 4400 24.810 9.280 62.870 1.00 0.00 ATOM 28304 H2 SOL 4400 23.550 8.440 62.930 1.00 0.00 ATOM 28305 OH2 SOL 4401 13.570 24.650 79.650 1.00 0.00 ATOM 28306 H1 SOL 4401 13.040 25.370 79.300 1.00 0.00 ATOM 28307 H2 SOL 4401 13.450 24.700 80.600 1.00 0.00 ATOM 28308 OH2 SOL 4402 7.810 6.800 5.630 1.00 0.00 ATOM 28309 H1 SOL 4402 7.580 7.700 5.420 1.00 0.00 ATOM 28310 H2 SOL 4402 8.740 6.730 5.390 1.00 0.00 ATOM 28311 OH2 SOL 4403 7.870 24.690 4.480 1.00 0.00 ATOM 28312 H1 SOL 4403 7.340 23.910 4.310 1.00 0.00 ATOM 28313 H2 SOL 4403 8.770 24.390 4.360 1.00 0.00 ATOM 28314 OH2 SOL 4404 55.740 15.420 62.670 1.00 0.00 ATOM 28315 H1 SOL 4404 56.140 16.110 63.200 1.00 0.00 ATOM 28316 H2 SOL 4404 56.360 15.280 61.960 1.00 0.00 ATOM 28317 OH2 SOL 4405 42.070 26.620 66.590 1.00 0.00 ATOM 28318 H1 SOL 4405 42.170 26.710 67.540 1.00 0.00 ATOM 28319 H2 SOL 4405 41.700 25.740 66.480 1.00 0.00 ATOM 28320 OH2 SOL 4406 7.730 29.190 17.190 1.00 0.00 ATOM 28321 H1 SOL 4406 8.010 29.420 16.300 1.00 0.00 ATOM 28322 H2 SOL 4406 8.480 28.730 17.560 1.00 0.00 ATOM 28323 OH2 SOL 4407 16.370 20.630 72.790 1.00 0.00 ATOM 28324 H1 SOL 4407 15.470 20.290 72.890 1.00 0.00 ATOM 28325 H2 SOL 4407 16.450 21.310 73.460 1.00 0.00 ATOM 28326 OH2 SOL 4408 3.070 17.550 61.030 1.00 0.00 ATOM 28327 H1 SOL 4408 3.610 17.920 60.330 1.00 0.00 ATOM 28328 H2 SOL 4408 2.370 18.190 61.160 1.00 0.00 ATOM 28329 OH2 SOL 4409 14.380 28.220 23.150 1.00 0.00 ATOM 28330 H1 SOL 4409 14.080 27.350 23.420 1.00 0.00 ATOM 28331 H2 SOL 4409 14.020 28.810 23.810 1.00 0.00 ATOM 28332 OH2 SOL 4410 19.810 0.260 84.760 1.00 0.00 ATOM 28333 H1 SOL 4410 20.730 0.280 84.510 1.00 0.00 ATOM 28334 H2 SOL 4410 19.340 0.190 83.930 1.00 0.00 ATOM 28335 OH2 SOL 4411 32.070 0.720 79.540 1.00 0.00 ATOM 28336 H1 SOL 4411 31.520 0.710 80.320 1.00 0.00 ATOM 28337 H2 SOL 4411 31.750 -0.010 79.000 1.00 0.00 ATOM 28338 OH2 SOL 4412 1.420 51.370 4.370 1.00 0.00 ATOM 28339 H1 SOL 4412 0.560 50.960 4.220 1.00 0.00 ATOM 28340 H2 SOL 4412 1.540 51.950 3.610 1.00 0.00 ATOM 28341 OH2 SOL 4413 28.210 8.270 1.830 1.00 0.00 ATOM 28342 H1 SOL 4413 28.540 7.910 2.650 1.00 0.00 ATOM 28343 H2 SOL 4413 28.290 7.550 1.200 1.00 0.00 ATOM 28344 OH2 SOL 4414 19.180 30.310 7.940 1.00 0.00 ATOM 28345 H1 SOL 4414 18.340 29.850 7.880 1.00 0.00 ATOM 28346 H2 SOL 4414 19.090 31.060 7.350 1.00 0.00 ATOM 28347 OH2 SOL 4415 28.120 44.030 65.470 1.00 0.00 ATOM 28348 H1 SOL 4415 28.990 43.880 65.820 1.00 0.00 ATOM 28349 H2 SOL 4415 27.570 43.380 65.910 1.00 0.00 ATOM 28350 OH2 SOL 4416 3.320 23.190 20.800 1.00 0.00 ATOM 28351 H1 SOL 4416 3.980 23.860 20.650 1.00 0.00 ATOM 28352 H2 SOL 4416 3.720 22.600 21.440 1.00 0.00 ATOM 28353 OH2 SOL 4417 42.020 17.980 64.700 1.00 0.00 ATOM 28354 H1 SOL 4417 42.590 18.550 65.210 1.00 0.00 ATOM 28355 H2 SOL 4417 41.140 18.180 65.020 1.00 0.00 ATOM 28356 OH2 SOL 4418 23.400 45.330 8.650 1.00 0.00 ATOM 28357 H1 SOL 4418 23.200 45.090 7.740 1.00 0.00 ATOM 28358 H2 SOL 4418 24.190 44.830 8.860 1.00 0.00 ATOM 28359 OH2 SOL 4419 53.320 40.770 8.380 1.00 0.00 ATOM 28360 H1 SOL 4419 54.110 41.240 8.640 1.00 0.00 ATOM 28361 H2 SOL 4419 53.520 39.850 8.540 1.00 0.00 ATOM 28362 OH2 SOL 4420 9.470 19.950 66.290 1.00 0.00 ATOM 28363 H1 SOL 4420 8.780 19.470 66.760 1.00 0.00 ATOM 28364 H2 SOL 4420 10.280 19.550 66.590 1.00 0.00 ATOM 28365 OH2 SOL 4421 52.290 32.010 82.170 1.00 0.00 ATOM 28366 H1 SOL 4421 52.790 32.480 82.850 1.00 0.00 ATOM 28367 H2 SOL 4421 51.800 31.350 82.650 1.00 0.00 ATOM 28368 OH2 SOL 4422 45.140 38.160 71.400 1.00 0.00 ATOM 28369 H1 SOL 4422 45.550 38.090 72.260 1.00 0.00 ATOM 28370 H2 SOL 4422 45.200 39.100 71.190 1.00 0.00 ATOM 28371 OH2 SOL 4423 35.550 46.410 82.650 1.00 0.00 ATOM 28372 H1 SOL 4423 34.640 46.170 82.440 1.00 0.00 ATOM 28373 H2 SOL 4423 35.890 45.650 83.120 1.00 0.00 ATOM 28374 OH2 SOL 4424 0.970 29.000 17.380 1.00 0.00 ATOM 28375 H1 SOL 4424 1.370 29.660 16.810 1.00 0.00 ATOM 28376 H2 SOL 4424 1.240 28.160 17.000 1.00 0.00 ATOM 28377 OH2 SOL 4425 22.530 60.630 72.670 1.00 0.00 ATOM 28378 H1 SOL 4425 22.240 61.400 72.170 1.00 0.00 ATOM 28379 H2 SOL 4425 22.930 60.060 72.030 1.00 0.00 ATOM 28380 OH2 SOL 4426 39.090 49.390 64.330 1.00 0.00 ATOM 28381 H1 SOL 4426 39.880 49.620 64.820 1.00 0.00 ATOM 28382 H2 SOL 4426 38.420 49.990 64.670 1.00 0.00 ATOM 28383 OH2 SOL 4427 6.320 5.740 68.550 1.00 0.00 ATOM 28384 H1 SOL 4427 6.740 6.410 68.010 1.00 0.00 ATOM 28385 H2 SOL 4427 6.270 6.140 69.420 1.00 0.00 ATOM 28386 OH2 SOL 4428 44.540 9.550 24.610 1.00 0.00 ATOM 28387 H1 SOL 4428 44.730 10.130 23.870 1.00 0.00 ATOM 28388 H2 SOL 4428 45.380 9.180 24.860 1.00 0.00 ATOM 28389 OH2 SOL 4429 39.540 21.920 77.240 1.00 0.00 ATOM 28390 H1 SOL 4429 39.760 21.190 76.650 1.00 0.00 ATOM 28391 H2 SOL 4429 38.820 21.590 77.760 1.00 0.00 ATOM 28392 OH2 SOL 4430 0.400 14.580 18.840 1.00 0.00 ATOM 28393 H1 SOL 4430 1.210 14.550 19.340 1.00 0.00 ATOM 28394 H2 SOL 4430 -0.110 13.840 19.170 1.00 0.00 ATOM 28395 OH2 SOL 4431 1.570 9.860 82.590 1.00 0.00 ATOM 28396 H1 SOL 4431 2.440 10.200 82.780 1.00 0.00 ATOM 28397 H2 SOL 4431 1.730 9.030 82.150 1.00 0.00 ATOM 28398 OH2 SOL 4432 9.670 32.820 72.630 1.00 0.00 ATOM 28399 H1 SOL 4432 8.840 33.260 72.820 1.00 0.00 ATOM 28400 H2 SOL 4432 9.460 31.890 72.670 1.00 0.00 ATOM 28401 OH2 SOL 4433 42.150 19.520 69.000 1.00 0.00 ATOM 28402 H1 SOL 4433 41.580 19.740 69.740 1.00 0.00 ATOM 28403 H2 SOL 4433 41.580 19.020 68.410 1.00 0.00 ATOM 28404 OH2 SOL 4434 42.320 19.740 6.660 1.00 0.00 ATOM 28405 H1 SOL 4434 42.550 20.560 6.240 1.00 0.00 ATOM 28406 H2 SOL 4434 41.490 19.910 7.100 1.00 0.00 ATOM 28407 OH2 SOL 4435 25.650 4.780 4.510 1.00 0.00 ATOM 28408 H1 SOL 4435 26.570 5.060 4.500 1.00 0.00 ATOM 28409 H2 SOL 4435 25.410 4.720 3.580 1.00 0.00 ATOM 28410 OH2 SOL 4436 5.960 51.520 2.750 1.00 0.00 ATOM 28411 H1 SOL 4436 5.120 51.280 2.360 1.00 0.00 ATOM 28412 H2 SOL 4436 5.730 51.900 3.600 1.00 0.00 ATOM 28413 OH2 SOL 4437 39.500 33.800 2.720 1.00 0.00 ATOM 28414 H1 SOL 4437 39.480 34.400 3.460 1.00 0.00 ATOM 28415 H2 SOL 4437 39.360 34.370 1.950 1.00 0.00 ATOM 28416 OH2 SOL 4438 51.550 13.270 74.950 1.00 0.00 ATOM 28417 H1 SOL 4438 51.390 12.630 75.640 1.00 0.00 ATOM 28418 H2 SOL 4438 50.680 13.560 74.680 1.00 0.00 ATOM 28419 OH2 SOL 4439 22.600 42.560 21.040 1.00 0.00 ATOM 28420 H1 SOL 4439 22.290 43.420 21.310 1.00 0.00 ATOM 28421 H2 SOL 4439 22.020 42.300 20.320 1.00 0.00 ATOM 28422 OH2 SOL 4440 30.980 9.930 61.230 1.00 0.00 ATOM 28423 H1 SOL 4440 31.460 10.310 61.960 1.00 0.00 ATOM 28424 H2 SOL 4440 31.260 9.010 61.210 1.00 0.00 ATOM 28425 OH2 SOL 4441 12.760 58.100 4.430 1.00 0.00 ATOM 28426 H1 SOL 4441 12.670 57.180 4.660 1.00 0.00 ATOM 28427 H2 SOL 4441 13.420 58.440 5.030 1.00 0.00 ATOM 28428 OH2 SOL 4442 8.080 14.880 8.490 1.00 0.00 ATOM 28429 H1 SOL 4442 7.890 14.140 7.920 1.00 0.00 ATOM 28430 H2 SOL 4442 7.560 15.600 8.140 1.00 0.00 ATOM 28431 OH2 SOL 4443 50.560 40.330 0.260 1.00 0.00 ATOM 28432 H1 SOL 4443 49.780 40.840 0.490 1.00 0.00 ATOM 28433 H2 SOL 4443 50.470 40.180 -0.680 1.00 0.00 ATOM 28434 OH2 SOL 4444 20.630 20.400 67.580 1.00 0.00 ATOM 28435 H1 SOL 4444 20.240 20.160 68.420 1.00 0.00 ATOM 28436 H2 SOL 4444 19.930 20.240 66.940 1.00 0.00 ATOM 28437 OH2 SOL 4445 15.950 36.520 16.480 1.00 0.00 ATOM 28438 H1 SOL 4445 15.430 36.220 17.230 1.00 0.00 ATOM 28439 H2 SOL 4445 15.300 36.710 15.800 1.00 0.00 ATOM 28440 OH2 SOL 4446 10.210 29.540 4.510 1.00 0.00 ATOM 28441 H1 SOL 4446 10.190 29.850 5.410 1.00 0.00 ATOM 28442 H2 SOL 4446 9.630 28.780 4.500 1.00 0.00 ATOM 28443 OH2 SOL 4447 11.190 46.100 78.150 1.00 0.00 ATOM 28444 H1 SOL 4447 10.460 46.440 77.640 1.00 0.00 ATOM 28445 H2 SOL 4447 10.790 45.540 78.810 1.00 0.00 ATOM 28446 OH2 SOL 4448 18.550 21.270 78.620 1.00 0.00 ATOM 28447 H1 SOL 4448 18.290 22.020 79.150 1.00 0.00 ATOM 28448 H2 SOL 4448 18.810 20.600 79.250 1.00 0.00 ATOM 28449 OH2 SOL 4449 7.530 34.060 9.040 1.00 0.00 ATOM 28450 H1 SOL 4449 6.750 33.560 9.270 1.00 0.00 ATOM 28451 H2 SOL 4449 8.110 33.430 8.630 1.00 0.00 ATOM 28452 OH2 SOL 4450 58.210 28.940 18.250 1.00 0.00 ATOM 28453 H1 SOL 4450 59.130 29.180 18.150 1.00 0.00 ATOM 28454 H2 SOL 4450 58.110 28.760 19.180 1.00 0.00 ATOM 28455 OH2 SOL 4451 40.280 3.250 7.360 1.00 0.00 ATOM 28456 H1 SOL 4451 40.060 3.330 6.430 1.00 0.00 ATOM 28457 H2 SOL 4451 39.950 4.060 7.760 1.00 0.00 ATOM 28458 OH2 SOL 4452 21.950 56.780 70.910 1.00 0.00 ATOM 28459 H1 SOL 4452 21.680 56.300 71.690 1.00 0.00 ATOM 28460 H2 SOL 4452 21.220 56.670 70.300 1.00 0.00 ATOM 28461 OH2 SOL 4453 30.080 34.220 13.060 1.00 0.00 ATOM 28462 H1 SOL 4453 29.540 33.720 13.660 1.00 0.00 ATOM 28463 H2 SOL 4453 29.460 34.790 12.600 1.00 0.00 ATOM 28464 OH2 SOL 4454 59.360 55.240 7.390 1.00 0.00 ATOM 28465 H1 SOL 4454 58.650 55.610 7.900 1.00 0.00 ATOM 28466 H2 SOL 4454 59.980 54.910 8.040 1.00 0.00 ATOM 28467 OH2 SOL 4455 50.400 24.630 81.090 1.00 0.00 ATOM 28468 H1 SOL 4455 51.270 25.010 81.140 1.00 0.00 ATOM 28469 H2 SOL 4455 49.830 25.360 80.830 1.00 0.00 ATOM 28470 OH2 SOL 4456 19.670 38.840 73.270 1.00 0.00 ATOM 28471 H1 SOL 4456 20.160 39.590 72.930 1.00 0.00 ATOM 28472 H2 SOL 4456 19.810 38.860 74.210 1.00 0.00 ATOM 28473 OH2 SOL 4457 13.340 33.090 14.700 1.00 0.00 ATOM 28474 H1 SOL 4457 13.090 33.630 13.950 1.00 0.00 ATOM 28475 H2 SOL 4457 14.240 32.840 14.530 1.00 0.00 ATOM 28476 OH2 SOL 4458 40.040 48.950 7.950 1.00 0.00 ATOM 28477 H1 SOL 4458 40.270 48.050 7.740 1.00 0.00 ATOM 28478 H2 SOL 4458 40.260 49.450 7.160 1.00 0.00 ATOM 28479 OH2 SOL 4459 53.520 29.760 23.150 1.00 0.00 ATOM 28480 H1 SOL 4459 53.270 29.080 23.790 1.00 0.00 ATOM 28481 H2 SOL 4459 54.420 29.550 22.920 1.00 0.00 ATOM 28482 OH2 SOL 4460 25.120 40.980 4.240 1.00 0.00 ATOM 28483 H1 SOL 4460 25.660 41.050 3.450 1.00 0.00 ATOM 28484 H2 SOL 4460 24.500 40.280 4.040 1.00 0.00 ATOM 28485 OH2 SOL 4461 17.380 19.550 16.850 1.00 0.00 ATOM 28486 H1 SOL 4461 16.570 19.780 17.290 1.00 0.00 ATOM 28487 H2 SOL 4461 17.130 18.940 16.160 1.00 0.00 ATOM 28488 OH2 SOL 4462 54.830 55.920 79.950 1.00 0.00 ATOM 28489 H1 SOL 4462 53.890 56.000 79.800 1.00 0.00 ATOM 28490 H2 SOL 4462 55.180 55.580 79.130 1.00 0.00 ATOM 28491 OH2 SOL 4463 21.670 52.740 9.290 1.00 0.00 ATOM 28492 H1 SOL 4463 22.610 52.580 9.210 1.00 0.00 ATOM 28493 H2 SOL 4463 21.320 51.920 9.640 1.00 0.00 ATOM 28494 OH2 SOL 4464 14.500 9.650 7.250 1.00 0.00 ATOM 28495 H1 SOL 4464 14.220 10.330 7.860 1.00 0.00 ATOM 28496 H2 SOL 4464 15.440 9.580 7.390 1.00 0.00 ATOM 28497 OH2 SOL 4465 49.300 10.570 67.640 1.00 0.00 ATOM 28498 H1 SOL 4465 49.760 10.930 66.880 1.00 0.00 ATOM 28499 H2 SOL 4465 49.930 10.630 68.360 1.00 0.00 ATOM 28500 OH2 SOL 4466 11.370 55.340 20.840 1.00 0.00 ATOM 28501 H1 SOL 4466 11.160 54.470 21.170 1.00 0.00 ATOM 28502 H2 SOL 4466 10.610 55.870 21.060 1.00 0.00 ATOM 28503 OH2 SOL 4467 45.400 0.520 16.990 1.00 0.00 ATOM 28504 H1 SOL 4467 45.700 -0.280 16.550 1.00 0.00 ATOM 28505 H2 SOL 4467 44.600 0.260 17.430 1.00 0.00 ATOM 28506 OH2 SOL 4468 47.840 33.530 6.110 1.00 0.00 ATOM 28507 H1 SOL 4468 47.900 32.880 5.410 1.00 0.00 ATOM 28508 H2 SOL 4468 48.720 33.910 6.160 1.00 0.00 ATOM 28509 OH2 SOL 4469 0.680 2.830 6.910 1.00 0.00 ATOM 28510 H1 SOL 4469 -0.040 3.470 6.940 1.00 0.00 ATOM 28511 H2 SOL 4469 0.300 2.060 6.490 1.00 0.00 ATOM 28512 OH2 SOL 4470 55.390 1.470 15.630 1.00 0.00 ATOM 28513 H1 SOL 4470 54.500 1.640 15.320 1.00 0.00 ATOM 28514 H2 SOL 4470 55.930 1.540 14.840 1.00 0.00 ATOM 28515 OH2 SOL 4471 35.370 56.510 83.400 1.00 0.00 ATOM 28516 H1 SOL 4471 36.180 57.000 83.240 1.00 0.00 ATOM 28517 H2 SOL 4471 35.260 55.970 82.610 1.00 0.00 ATOM 28518 OH2 SOL 4472 2.580 28.440 79.320 1.00 0.00 ATOM 28519 H1 SOL 4472 1.970 29.040 78.890 1.00 0.00 ATOM 28520 H2 SOL 4472 2.660 28.770 80.210 1.00 0.00 ATOM 28521 OH2 SOL 4473 38.090 51.870 22.300 1.00 0.00 ATOM 28522 H1 SOL 4473 37.870 51.490 23.150 1.00 0.00 ATOM 28523 H2 SOL 4473 37.670 51.300 21.670 1.00 0.00 ATOM 28524 OH2 SOL 4474 14.570 22.610 76.460 1.00 0.00 ATOM 28525 H1 SOL 4474 13.830 23.050 76.040 1.00 0.00 ATOM 28526 H2 SOL 4474 14.470 22.820 77.390 1.00 0.00 ATOM 28527 OH2 SOL 4475 38.390 18.650 80.160 1.00 0.00 ATOM 28528 H1 SOL 4475 37.660 19.260 80.010 1.00 0.00 ATOM 28529 H2 SOL 4475 38.390 18.090 79.390 1.00 0.00 ATOM 28530 OH2 SOL 4476 43.300 50.200 65.840 1.00 0.00 ATOM 28531 H1 SOL 4476 44.160 50.620 65.820 1.00 0.00 ATOM 28532 H2 SOL 4476 43.160 49.900 64.940 1.00 0.00 ATOM 28533 OH2 SOL 4477 2.290 41.260 78.680 1.00 0.00 ATOM 28534 H1 SOL 4477 1.370 41.550 78.660 1.00 0.00 ATOM 28535 H2 SOL 4477 2.750 41.910 78.150 1.00 0.00 ATOM 28536 OH2 SOL 4478 29.600 31.120 11.400 1.00 0.00 ATOM 28537 H1 SOL 4478 30.350 30.670 11.010 1.00 0.00 ATOM 28538 H2 SOL 4478 29.440 30.660 12.220 1.00 0.00 ATOM 28539 OH2 SOL 4479 35.680 11.170 62.700 1.00 0.00 ATOM 28540 H1 SOL 4479 35.690 10.570 63.440 1.00 0.00 ATOM 28541 H2 SOL 4479 36.390 11.790 62.880 1.00 0.00 ATOM 28542 OH2 SOL 4480 3.480 34.640 70.170 1.00 0.00 ATOM 28543 H1 SOL 4480 2.820 34.860 70.830 1.00 0.00 ATOM 28544 H2 SOL 4480 3.290 35.230 69.440 1.00 0.00 ATOM 28545 OH2 SOL 4481 47.720 35.180 18.470 1.00 0.00 ATOM 28546 H1 SOL 4481 47.330 35.370 17.620 1.00 0.00 ATOM 28547 H2 SOL 4481 48.240 35.960 18.670 1.00 0.00 ATOM 28548 OH2 SOL 4482 47.320 43.000 71.680 1.00 0.00 ATOM 28549 H1 SOL 4482 47.930 42.600 72.290 1.00 0.00 ATOM 28550 H2 SOL 4482 47.610 42.710 70.820 1.00 0.00 ATOM 28551 OH2 SOL 4483 38.860 37.520 16.910 1.00 0.00 ATOM 28552 H1 SOL 4483 38.330 38.300 17.100 1.00 0.00 ATOM 28553 H2 SOL 4483 38.260 36.790 17.050 1.00 0.00 ATOM 28554 OH2 SOL 4484 10.250 55.840 13.660 1.00 0.00 ATOM 28555 H1 SOL 4484 9.620 55.990 12.960 1.00 0.00 ATOM 28556 H2 SOL 4484 11.090 55.750 13.210 1.00 0.00 ATOM 28557 OH2 SOL 4485 12.330 55.170 5.660 1.00 0.00 ATOM 28558 H1 SOL 4485 12.770 55.520 6.430 1.00 0.00 ATOM 28559 H2 SOL 4485 12.120 54.260 5.890 1.00 0.00 ATOM 28560 OH2 SOL 4486 49.980 25.050 9.370 1.00 0.00 ATOM 28561 H1 SOL 4486 49.860 24.690 10.250 1.00 0.00 ATOM 28562 H2 SOL 4486 49.100 25.310 9.100 1.00 0.00 ATOM 28563 OH2 SOL 4487 6.800 26.910 76.710 1.00 0.00 ATOM 28564 H1 SOL 4487 6.840 26.500 77.580 1.00 0.00 ATOM 28565 H2 SOL 4487 6.140 26.400 76.240 1.00 0.00 ATOM 28566 OH2 SOL 4488 58.240 50.930 17.850 1.00 0.00 ATOM 28567 H1 SOL 4488 57.330 50.760 17.610 1.00 0.00 ATOM 28568 H2 SOL 4488 58.650 50.060 17.820 1.00 0.00 ATOM 28569 OH2 SOL 4489 4.000 56.890 9.500 1.00 0.00 ATOM 28570 H1 SOL 4489 3.990 55.960 9.700 1.00 0.00 ATOM 28571 H2 SOL 4489 3.130 57.060 9.130 1.00 0.00 ATOM 28572 OH2 SOL 4490 26.090 8.250 5.290 1.00 0.00 ATOM 28573 H1 SOL 4490 26.120 9.210 5.320 1.00 0.00 ATOM 28574 H2 SOL 4490 25.320 8.050 4.760 1.00 0.00 ATOM 28575 OH2 SOL 4491 40.510 50.120 5.780 1.00 0.00 ATOM 28576 H1 SOL 4491 40.160 51.000 5.610 1.00 0.00 ATOM 28577 H2 SOL 4491 41.310 50.080 5.250 1.00 0.00 ATOM 28578 OH2 SOL 4492 25.450 11.010 5.240 1.00 0.00 ATOM 28579 H1 SOL 4492 26.160 10.910 4.610 1.00 0.00 ATOM 28580 H2 SOL 4492 24.670 10.710 4.770 1.00 0.00 ATOM 28581 OH2 SOL 4493 7.100 48.550 15.880 1.00 0.00 ATOM 28582 H1 SOL 4493 7.250 49.490 15.810 1.00 0.00 ATOM 28583 H2 SOL 4493 7.810 48.150 15.380 1.00 0.00 ATOM 28584 OH2 SOL 4494 5.230 35.330 14.220 1.00 0.00 ATOM 28585 H1 SOL 4494 6.010 35.870 14.370 1.00 0.00 ATOM 28586 H2 SOL 4494 5.260 35.120 13.290 1.00 0.00 ATOM 28587 OH2 SOL 4495 16.670 36.610 78.440 1.00 0.00 ATOM 28588 H1 SOL 4495 15.780 36.710 78.100 1.00 0.00 ATOM 28589 H2 SOL 4495 16.810 35.660 78.460 1.00 0.00 ATOM 28590 OH2 SOL 4496 25.700 9.310 72.990 1.00 0.00 ATOM 28591 H1 SOL 4496 25.670 9.780 73.830 1.00 0.00 ATOM 28592 H2 SOL 4496 25.840 8.400 73.240 1.00 0.00 ATOM 28593 OH2 SOL 4497 9.660 17.940 81.770 1.00 0.00 ATOM 28594 H1 SOL 4497 10.090 18.760 82.000 1.00 0.00 ATOM 28595 H2 SOL 4497 10.040 17.290 82.370 1.00 0.00 ATOM 28596 OH2 SOL 4498 13.240 44.170 77.240 1.00 0.00 ATOM 28597 H1 SOL 4498 13.630 44.700 76.540 1.00 0.00 ATOM 28598 H2 SOL 4498 12.720 44.790 77.750 1.00 0.00 ATOM 28599 OH2 SOL 4499 42.530 20.060 19.500 1.00 0.00 ATOM 28600 H1 SOL 4499 42.710 20.860 19.990 1.00 0.00 ATOM 28601 H2 SOL 4499 41.660 19.790 19.790 1.00 0.00 ATOM 28602 OH2 SOL 4500 7.860 51.420 0.960 1.00 0.00 ATOM 28603 H1 SOL 4500 7.500 50.600 0.640 1.00 0.00 ATOM 28604 H2 SOL 4500 7.360 51.610 1.750 1.00 0.00 ATOM 28605 OH2 SOL 4501 36.300 38.220 66.110 1.00 0.00 ATOM 28606 H1 SOL 4501 36.000 38.250 67.020 1.00 0.00 ATOM 28607 H2 SOL 4501 37.100 38.740 66.100 1.00 0.00 ATOM 28608 OH2 SOL 4502 52.410 18.480 21.930 1.00 0.00 ATOM 28609 H1 SOL 4502 51.740 18.000 21.450 1.00 0.00 ATOM 28610 H2 SOL 4502 52.300 19.390 21.650 1.00 0.00 ATOM 28611 OH2 SOL 4503 58.950 57.390 73.930 1.00 0.00 ATOM 28612 H1 SOL 4503 59.610 57.210 73.260 1.00 0.00 ATOM 28613 H2 SOL 4503 58.810 58.340 73.880 1.00 0.00 ATOM 28614 OH2 SOL 4504 7.610 31.330 80.320 1.00 0.00 ATOM 28615 H1 SOL 4504 7.610 32.100 80.890 1.00 0.00 ATOM 28616 H2 SOL 4504 6.760 31.370 79.870 1.00 0.00 ATOM 28617 OH2 SOL 4505 48.700 2.080 18.350 1.00 0.00 ATOM 28618 H1 SOL 4505 48.840 2.170 19.290 1.00 0.00 ATOM 28619 H2 SOL 4505 48.760 1.140 18.180 1.00 0.00 ATOM 28620 OH2 SOL 4506 13.610 33.030 82.850 1.00 0.00 ATOM 28621 H1 SOL 4506 12.730 33.390 82.950 1.00 0.00 ATOM 28622 H2 SOL 4506 14.130 33.750 82.510 1.00 0.00 ATOM 28623 OH2 SOL 4507 15.020 12.040 11.590 1.00 0.00 ATOM 28624 H1 SOL 4507 15.750 12.660 11.650 1.00 0.00 ATOM 28625 H2 SOL 4507 14.520 12.180 12.390 1.00 0.00 ATOM 28626 OH2 SOL 4508 10.450 53.800 8.530 1.00 0.00 ATOM 28627 H1 SOL 4508 9.760 54.400 8.250 1.00 0.00 ATOM 28628 H2 SOL 4508 10.380 53.050 7.940 1.00 0.00 ATOM 28629 OH2 SOL 4509 47.750 6.460 77.450 1.00 0.00 ATOM 28630 H1 SOL 4509 48.000 7.080 76.760 1.00 0.00 ATOM 28631 H2 SOL 4509 48.270 6.730 78.210 1.00 0.00 ATOM 28632 OH2 SOL 4510 49.780 50.560 79.330 1.00 0.00 ATOM 28633 H1 SOL 4510 49.490 51.450 79.150 1.00 0.00 ATOM 28634 H2 SOL 4510 50.390 50.660 80.070 1.00 0.00 ATOM 28635 OH2 SOL 4511 52.500 31.940 21.740 1.00 0.00 ATOM 28636 H1 SOL 4511 52.670 32.840 22.010 1.00 0.00 ATOM 28637 H2 SOL 4511 52.970 31.400 22.380 1.00 0.00 ATOM 28638 OH2 SOL 4512 5.380 46.820 13.780 1.00 0.00 ATOM 28639 H1 SOL 4512 5.560 45.980 14.210 1.00 0.00 ATOM 28640 H2 SOL 4512 5.690 47.480 14.410 1.00 0.00 ATOM 28641 OH2 SOL 4513 58.670 13.980 14.920 1.00 0.00 ATOM 28642 H1 SOL 4513 59.380 14.460 15.330 1.00 0.00 ATOM 28643 H2 SOL 4513 57.960 13.990 15.570 1.00 0.00 ATOM 28644 OH2 SOL 4514 44.240 28.980 13.290 1.00 0.00 ATOM 28645 H1 SOL 4514 44.670 29.820 13.140 1.00 0.00 ATOM 28646 H2 SOL 4514 44.210 28.880 14.240 1.00 0.00 ATOM 28647 OH2 SOL 4515 16.860 24.620 66.450 1.00 0.00 ATOM 28648 H1 SOL 4515 16.390 24.790 67.260 1.00 0.00 ATOM 28649 H2 SOL 4515 17.300 25.450 66.250 1.00 0.00 ATOM 28650 OH2 SOL 4516 37.420 33.940 65.980 1.00 0.00 ATOM 28651 H1 SOL 4516 37.420 33.260 65.300 1.00 0.00 ATOM 28652 H2 SOL 4516 36.700 34.520 65.740 1.00 0.00 ATOM 28653 OH2 SOL 4517 8.090 13.590 23.000 1.00 0.00 ATOM 28654 H1 SOL 4517 8.440 12.930 23.580 1.00 0.00 ATOM 28655 H2 SOL 4517 8.270 14.420 23.440 1.00 0.00 ATOM 28656 OH2 SOL 4518 21.540 15.090 63.840 1.00 0.00 ATOM 28657 H1 SOL 4518 20.820 14.470 64.020 1.00 0.00 ATOM 28658 H2 SOL 4518 21.510 15.700 64.570 1.00 0.00 ATOM 28659 OH2 SOL 4519 48.120 13.150 80.820 1.00 0.00 ATOM 28660 H1 SOL 4519 49.010 13.200 80.460 1.00 0.00 ATOM 28661 H2 SOL 4519 48.020 13.960 81.310 1.00 0.00 ATOM 28662 OH2 SOL 4520 1.280 49.390 81.330 1.00 0.00 ATOM 28663 H1 SOL 4520 0.400 49.560 81.670 1.00 0.00 ATOM 28664 H2 SOL 4520 1.860 49.860 81.930 1.00 0.00 ATOM 28665 OH2 SOL 4521 8.660 22.570 18.120 1.00 0.00 ATOM 28666 H1 SOL 4521 8.030 21.980 17.720 1.00 0.00 ATOM 28667 H2 SOL 4521 9.390 22.600 17.500 1.00 0.00 ATOM 28668 OH2 SOL 4522 51.800 56.030 74.060 1.00 0.00 ATOM 28669 H1 SOL 4522 50.880 55.800 73.990 1.00 0.00 ATOM 28670 H2 SOL 4522 52.200 55.290 74.510 1.00 0.00 ATOM 28671 OH2 SOL 4523 56.260 49.970 14.980 1.00 0.00 ATOM 28672 H1 SOL 4523 56.960 49.410 15.320 1.00 0.00 ATOM 28673 H2 SOL 4523 55.950 50.450 15.750 1.00 0.00 ATOM 28674 OH2 SOL 4524 12.370 4.750 7.760 1.00 0.00 ATOM 28675 H1 SOL 4524 12.070 4.350 8.570 1.00 0.00 ATOM 28676 H2 SOL 4524 13.010 5.400 8.040 1.00 0.00 ATOM 28677 OH2 SOL 4525 12.480 44.090 9.150 1.00 0.00 ATOM 28678 H1 SOL 4525 13.360 44.070 9.510 1.00 0.00 ATOM 28679 H2 SOL 4525 12.600 44.350 8.240 1.00 0.00 ATOM 28680 OH2 SOL 4526 18.580 60.480 11.960 1.00 0.00 ATOM 28681 H1 SOL 4526 18.200 59.660 11.640 1.00 0.00 ATOM 28682 H2 SOL 4526 18.360 61.130 11.280 1.00 0.00 ATOM 28683 OH2 SOL 4527 51.050 42.350 19.650 1.00 0.00 ATOM 28684 H1 SOL 4527 51.140 43.250 19.340 1.00 0.00 ATOM 28685 H2 SOL 4527 50.810 42.440 20.580 1.00 0.00 ATOM 28686 OH2 SOL 4528 36.330 59.760 14.750 1.00 0.00 ATOM 28687 H1 SOL 4528 36.550 60.660 14.970 1.00 0.00 ATOM 28688 H2 SOL 4528 35.680 59.830 14.060 1.00 0.00 ATOM 28689 OH2 SOL 4529 40.880 8.330 22.270 1.00 0.00 ATOM 28690 H1 SOL 4529 40.080 8.290 21.750 1.00 0.00 ATOM 28691 H2 SOL 4529 41.010 9.260 22.450 1.00 0.00 ATOM 28692 OH2 SOL 4530 8.010 17.150 18.660 1.00 0.00 ATOM 28693 H1 SOL 4530 8.910 17.460 18.670 1.00 0.00 ATOM 28694 H2 SOL 4530 8.000 16.450 18.010 1.00 0.00 ATOM 28695 OH2 SOL 4531 52.920 26.240 80.680 1.00 0.00 ATOM 28696 H1 SOL 4531 53.230 27.070 81.030 1.00 0.00 ATOM 28697 H2 SOL 4531 52.730 26.420 79.760 1.00 0.00 ATOM 28698 OH2 SOL 4532 30.000 16.150 75.670 1.00 0.00 ATOM 28699 H1 SOL 4532 29.770 16.180 74.740 1.00 0.00 ATOM 28700 H2 SOL 4532 29.740 15.270 75.950 1.00 0.00 ATOM 28701 OH2 SOL 4533 4.080 48.010 1.840 1.00 0.00 ATOM 28702 H1 SOL 4533 4.340 47.650 0.990 1.00 0.00 ATOM 28703 H2 SOL 4533 3.190 47.660 1.980 1.00 0.00 ATOM 28704 OH2 SOL 4534 56.360 14.100 82.390 1.00 0.00 ATOM 28705 H1 SOL 4534 56.840 14.030 81.570 1.00 0.00 ATOM 28706 H2 SOL 4534 56.090 13.200 82.590 1.00 0.00 ATOM 28707 OH2 SOL 4535 4.150 56.820 76.800 1.00 0.00 ATOM 28708 H1 SOL 4535 3.530 56.670 76.080 1.00 0.00 ATOM 28709 H2 SOL 4535 3.760 56.390 77.560 1.00 0.00 ATOM 28710 OH2 SOL 4536 16.670 48.300 70.650 1.00 0.00 ATOM 28711 H1 SOL 4536 16.680 48.750 71.500 1.00 0.00 ATOM 28712 H2 SOL 4536 17.580 48.330 70.350 1.00 0.00 ATOM 28713 OH2 SOL 4537 57.910 16.260 83.480 1.00 0.00 ATOM 28714 H1 SOL 4537 57.030 15.880 83.420 1.00 0.00 ATOM 28715 H2 SOL 4537 58.500 15.550 83.220 1.00 0.00 ATOM 28716 OH2 SOL 4538 42.540 27.950 84.890 1.00 0.00 ATOM 28717 H1 SOL 4538 42.380 27.740 83.970 1.00 0.00 ATOM 28718 H2 SOL 4538 43.490 28.040 84.950 1.00 0.00 ATOM 28719 OH2 SOL 4539 1.190 57.720 9.830 1.00 0.00 ATOM 28720 H1 SOL 4539 0.290 57.870 9.530 1.00 0.00 ATOM 28721 H2 SOL 4539 1.080 57.310 10.690 1.00 0.00 ATOM 28722 OH2 SOL 4540 52.520 26.610 5.450 1.00 0.00 ATOM 28723 H1 SOL 4540 51.860 26.900 6.070 1.00 0.00 ATOM 28724 H2 SOL 4540 52.690 25.700 5.690 1.00 0.00 ATOM 28725 OH2 SOL 4541 48.500 37.130 75.260 1.00 0.00 ATOM 28726 H1 SOL 4541 48.680 36.260 75.620 1.00 0.00 ATOM 28727 H2 SOL 4541 49.260 37.320 74.710 1.00 0.00 ATOM 28728 OH2 SOL 4542 19.610 38.370 81.240 1.00 0.00 ATOM 28729 H1 SOL 4542 19.910 39.200 81.600 1.00 0.00 ATOM 28730 H2 SOL 4542 18.980 38.040 81.880 1.00 0.00 ATOM 28731 OH2 SOL 4543 2.220 45.710 66.690 1.00 0.00 ATOM 28732 H1 SOL 4543 1.330 45.880 66.380 1.00 0.00 ATOM 28733 H2 SOL 4543 2.790 46.030 65.990 1.00 0.00 ATOM 28734 OH2 SOL 4544 26.050 45.820 77.510 1.00 0.00 ATOM 28735 H1 SOL 4544 26.470 46.620 77.180 1.00 0.00 ATOM 28736 H2 SOL 4544 25.890 46.010 78.440 1.00 0.00 ATOM 28737 OH2 SOL 4545 31.220 11.020 68.220 1.00 0.00 ATOM 28738 H1 SOL 4545 31.690 11.830 68.020 1.00 0.00 ATOM 28739 H2 SOL 4545 31.730 10.330 67.790 1.00 0.00 ATOM 28740 OH2 SOL 4546 2.960 13.720 19.630 1.00 0.00 ATOM 28741 H1 SOL 4546 3.120 12.780 19.540 1.00 0.00 ATOM 28742 H2 SOL 4546 3.690 14.040 20.160 1.00 0.00 ATOM 28743 OH2 SOL 4547 7.500 3.060 23.290 1.00 0.00 ATOM 28744 H1 SOL 4547 6.620 2.930 23.660 1.00 0.00 ATOM 28745 H2 SOL 4547 8.020 2.350 23.660 1.00 0.00 ATOM 28746 OH2 SOL 4548 26.210 56.930 17.280 1.00 0.00 ATOM 28747 H1 SOL 4548 26.330 57.670 16.690 1.00 0.00 ATOM 28748 H2 SOL 4548 26.520 57.240 18.120 1.00 0.00 ATOM 28749 OH2 SOL 4549 59.730 50.510 60.060 1.00 0.00 ATOM 28750 H1 SOL 4549 59.130 49.770 60.120 1.00 0.00 ATOM 28751 H2 SOL 4549 59.200 51.260 60.330 1.00 0.00 ATOM 28752 OH2 SOL 4550 43.500 15.980 73.550 1.00 0.00 ATOM 28753 H1 SOL 4550 44.230 16.390 73.080 1.00 0.00 ATOM 28754 H2 SOL 4550 42.710 16.350 73.130 1.00 0.00 ATOM 28755 OH2 SOL 4551 43.700 56.040 61.420 1.00 0.00 ATOM 28756 H1 SOL 4551 42.850 55.890 61.020 1.00 0.00 ATOM 28757 H2 SOL 4551 43.500 56.300 62.320 1.00 0.00 ATOM 28758 OH2 SOL 4552 10.330 58.690 19.840 1.00 0.00 ATOM 28759 H1 SOL 4552 10.120 58.000 20.470 1.00 0.00 ATOM 28760 H2 SOL 4552 10.250 59.500 20.350 1.00 0.00 ATOM 28761 OH2 SOL 4553 25.810 45.160 71.640 1.00 0.00 ATOM 28762 H1 SOL 4553 25.580 45.530 70.790 1.00 0.00 ATOM 28763 H2 SOL 4553 26.260 45.870 72.100 1.00 0.00 ATOM 28764 OH2 SOL 4554 29.210 47.880 65.610 1.00 0.00 ATOM 28765 H1 SOL 4554 28.650 47.190 65.970 1.00 0.00 ATOM 28766 H2 SOL 4554 28.750 48.180 64.830 1.00 0.00 ATOM 28767 OH2 SOL 4555 18.980 12.400 75.210 1.00 0.00 ATOM 28768 H1 SOL 4555 19.460 11.660 75.590 1.00 0.00 ATOM 28769 H2 SOL 4555 18.130 12.040 74.970 1.00 0.00 ATOM 28770 OH2 SOL 4556 34.520 59.350 7.150 1.00 0.00 ATOM 28771 H1 SOL 4556 34.130 59.030 7.960 1.00 0.00 ATOM 28772 H2 SOL 4556 35.390 58.960 7.130 1.00 0.00 ATOM 28773 OH2 SOL 4557 47.920 38.420 8.210 1.00 0.00 ATOM 28774 H1 SOL 4557 48.420 39.130 8.620 1.00 0.00 ATOM 28775 H2 SOL 4557 48.480 38.110 7.500 1.00 0.00 ATOM 28776 OH2 SOL 4558 51.930 26.900 10.950 1.00 0.00 ATOM 28777 H1 SOL 4558 52.670 26.460 11.370 1.00 0.00 ATOM 28778 H2 SOL 4558 51.350 27.140 11.680 1.00 0.00 ATOM 28779 OH2 SOL 4559 41.450 46.970 74.370 1.00 0.00 ATOM 28780 H1 SOL 4559 42.200 46.500 74.010 1.00 0.00 ATOM 28781 H2 SOL 4559 41.440 47.800 73.890 1.00 0.00 ATOM 28782 OH2 SOL 4560 56.320 51.000 84.910 1.00 0.00 ATOM 28783 H1 SOL 4560 55.560 50.460 85.150 1.00 0.00 ATOM 28784 H2 SOL 4560 56.010 51.530 84.170 1.00 0.00 ATOM 28785 OH2 SOL 4561 14.140 23.900 68.020 1.00 0.00 ATOM 28786 H1 SOL 4561 14.000 23.590 67.130 1.00 0.00 ATOM 28787 H2 SOL 4561 13.550 23.370 68.560 1.00 0.00 ATOM 28788 OH2 SOL 4562 24.970 0.650 68.570 1.00 0.00 ATOM 28789 H1 SOL 4562 25.740 1.220 68.550 1.00 0.00 ATOM 28790 H2 SOL 4562 24.640 0.740 69.460 1.00 0.00 ATOM 28791 OH2 SOL 4563 23.980 7.840 3.760 1.00 0.00 ATOM 28792 H1 SOL 4563 23.600 7.510 4.570 1.00 0.00 ATOM 28793 H2 SOL 4563 24.000 7.080 3.180 1.00 0.00 ATOM 28794 OH2 SOL 4564 31.310 21.790 81.800 1.00 0.00 ATOM 28795 H1 SOL 4564 30.440 21.710 82.210 1.00 0.00 ATOM 28796 H2 SOL 4564 31.250 21.240 81.020 1.00 0.00 ATOM 28797 OH2 SOL 4565 21.440 37.450 2.100 1.00 0.00 ATOM 28798 H1 SOL 4565 20.720 36.820 2.030 1.00 0.00 ATOM 28799 H2 SOL 4565 21.540 37.800 1.220 1.00 0.00 ATOM 28800 OH2 SOL 4566 58.950 54.780 2.060 1.00 0.00 ATOM 28801 H1 SOL 4566 59.630 55.070 1.460 1.00 0.00 ATOM 28802 H2 SOL 4566 58.780 55.540 2.620 1.00 0.00 ATOM 28803 OH2 SOL 4567 54.920 43.320 5.910 1.00 0.00 ATOM 28804 H1 SOL 4567 55.560 43.880 5.460 1.00 0.00 ATOM 28805 H2 SOL 4567 55.250 43.250 6.800 1.00 0.00 ATOM 28806 OH2 SOL 4568 18.620 14.650 76.600 1.00 0.00 ATOM 28807 H1 SOL 4568 18.000 14.260 77.220 1.00 0.00 ATOM 28808 H2 SOL 4568 18.760 13.980 75.940 1.00 0.00 ATOM 28809 OH2 SOL 4569 4.170 15.110 27.140 1.00 0.00 ATOM 28810 H1 SOL 4569 4.910 14.560 26.900 1.00 0.00 ATOM 28811 H2 SOL 4569 4.140 15.080 28.100 1.00 0.00 ATOM 28812 OH2 SOL 4570 55.980 23.170 69.500 1.00 0.00 ATOM 28813 H1 SOL 4570 56.840 23.300 69.110 1.00 0.00 ATOM 28814 H2 SOL 4570 56.150 23.080 70.440 1.00 0.00 ATOM 28815 OH2 SOL 4571 0.710 14.150 8.100 1.00 0.00 ATOM 28816 H1 SOL 4571 -0.080 14.160 8.630 1.00 0.00 ATOM 28817 H2 SOL 4571 0.760 15.020 7.710 1.00 0.00 ATOM 28818 OH2 SOL 4572 43.730 60.490 11.390 1.00 0.00 ATOM 28819 H1 SOL 4572 44.650 60.700 11.570 1.00 0.00 ATOM 28820 H2 SOL 4572 43.680 59.540 11.460 1.00 0.00 ATOM 28821 OH2 SOL 4573 15.180 0.470 16.590 1.00 0.00 ATOM 28822 H1 SOL 4573 14.910 1.380 16.470 1.00 0.00 ATOM 28823 H2 SOL 4573 15.930 0.510 17.170 1.00 0.00 ATOM 28824 OH2 SOL 4574 42.830 55.960 11.000 1.00 0.00 ATOM 28825 H1 SOL 4574 42.250 56.560 10.550 1.00 0.00 ATOM 28826 H2 SOL 4574 42.560 55.090 10.710 1.00 0.00 ATOM 28827 OH2 SOL 4575 56.810 47.800 10.700 1.00 0.00 ATOM 28828 H1 SOL 4575 56.600 46.980 11.150 1.00 0.00 ATOM 28829 H2 SOL 4575 57.500 48.200 11.230 1.00 0.00 ATOM 28830 OH2 SOL 4576 38.690 13.350 70.890 1.00 0.00 ATOM 28831 H1 SOL 4576 38.340 14.240 70.770 1.00 0.00 ATOM 28832 H2 SOL 4576 37.920 12.800 71.000 1.00 0.00 ATOM 28833 OH2 SOL 4577 27.130 32.550 11.750 1.00 0.00 ATOM 28834 H1 SOL 4577 27.550 32.020 12.430 1.00 0.00 ATOM 28835 H2 SOL 4577 27.780 32.610 11.060 1.00 0.00 ATOM 28836 OH2 SOL 4578 33.880 37.200 13.090 1.00 0.00 ATOM 28837 H1 SOL 4578 34.120 36.280 13.200 1.00 0.00 ATOM 28838 H2 SOL 4578 33.820 37.320 12.140 1.00 0.00 ATOM 28839 OH2 SOL 4579 55.070 15.260 15.270 1.00 0.00 ATOM 28840 H1 SOL 4579 56.020 15.120 15.320 1.00 0.00 ATOM 28841 H2 SOL 4579 54.830 15.570 16.140 1.00 0.00 ATOM 28842 OH2 SOL 4580 23.810 2.440 62.530 1.00 0.00 ATOM 28843 H1 SOL 4580 23.470 1.590 62.810 1.00 0.00 ATOM 28844 H2 SOL 4580 23.720 3.000 63.300 1.00 0.00 ATOM 28845 OH2 SOL 4581 50.210 17.790 5.240 1.00 0.00 ATOM 28846 H1 SOL 4581 49.590 18.510 5.370 1.00 0.00 ATOM 28847 H2 SOL 4581 50.480 17.870 4.330 1.00 0.00 ATOM 28848 OH2 SOL 4582 56.250 56.280 3.030 1.00 0.00 ATOM 28849 H1 SOL 4582 56.470 56.280 3.960 1.00 0.00 ATOM 28850 H2 SOL 4582 56.060 55.360 2.830 1.00 0.00 ATOM 28851 OH2 SOL 4583 58.610 51.080 69.930 1.00 0.00 ATOM 28852 H1 SOL 4583 58.550 52.000 69.670 1.00 0.00 ATOM 28853 H2 SOL 4583 58.070 50.610 69.290 1.00 0.00 ATOM 28854 OH2 SOL 4584 18.110 4.730 13.270 1.00 0.00 ATOM 28855 H1 SOL 4584 18.900 4.250 13.040 1.00 0.00 ATOM 28856 H2 SOL 4584 18.240 5.000 14.180 1.00 0.00 ATOM 28857 OH2 SOL 4585 10.110 60.150 0.340 1.00 0.00 ATOM 28858 H1 SOL 4585 10.740 59.620 0.830 1.00 0.00 ATOM 28859 H2 SOL 4585 10.050 60.970 0.830 1.00 0.00 ATOM 28860 OH2 SOL 4586 57.180 14.050 17.110 1.00 0.00 ATOM 28861 H1 SOL 4586 57.260 13.450 17.850 1.00 0.00 ATOM 28862 H2 SOL 4586 57.240 14.920 17.510 1.00 0.00 ATOM 28863 OH2 SOL 4587 16.300 55.560 82.180 1.00 0.00 ATOM 28864 H1 SOL 4587 15.790 54.850 81.790 1.00 0.00 ATOM 28865 H2 SOL 4587 15.940 56.350 81.790 1.00 0.00 ATOM 28866 OH2 SOL 4588 31.830 55.270 75.060 1.00 0.00 ATOM 28867 H1 SOL 4588 32.720 55.380 74.740 1.00 0.00 ATOM 28868 H2 SOL 4588 31.370 54.840 74.340 1.00 0.00 ATOM 28869 OH2 SOL 4589 0.380 14.100 12.490 1.00 0.00 ATOM 28870 H1 SOL 4589 0.040 13.640 13.250 1.00 0.00 ATOM 28871 H2 SOL 4589 1.030 13.510 12.120 1.00 0.00 ATOM 28872 OH2 SOL 4590 20.170 3.600 82.580 1.00 0.00 ATOM 28873 H1 SOL 4590 20.060 4.490 82.260 1.00 0.00 ATOM 28874 H2 SOL 4590 21.110 3.440 82.510 1.00 0.00 ATOM 28875 OH2 SOL 4591 46.020 11.750 5.500 1.00 0.00 ATOM 28876 H1 SOL 4591 46.270 11.500 4.610 1.00 0.00 ATOM 28877 H2 SOL 4591 45.270 11.180 5.700 1.00 0.00 ATOM 28878 OH2 SOL 4592 41.960 25.760 78.350 1.00 0.00 ATOM 28879 H1 SOL 4592 41.260 25.180 78.660 1.00 0.00 ATOM 28880 H2 SOL 4592 42.010 25.590 77.410 1.00 0.00 ATOM 28881 OH2 SOL 4593 6.310 42.960 8.370 1.00 0.00 ATOM 28882 H1 SOL 4593 7.160 42.520 8.330 1.00 0.00 ATOM 28883 H2 SOL 4593 6.340 43.590 7.650 1.00 0.00 ATOM 28884 OH2 SOL 4594 15.410 2.780 27.780 1.00 0.00 ATOM 28885 H1 SOL 4594 16.360 2.700 27.850 1.00 0.00 ATOM 28886 H2 SOL 4594 15.170 3.360 28.510 1.00 0.00 ATOM 28887 OH2 SOL 4595 30.700 55.070 6.010 1.00 0.00 ATOM 28888 H1 SOL 4595 30.030 55.260 6.670 1.00 0.00 ATOM 28889 H2 SOL 4595 31.330 54.520 6.460 1.00 0.00 ATOM 28890 OH2 SOL 4596 41.380 16.590 72.230 1.00 0.00 ATOM 28891 H1 SOL 4596 41.330 15.630 72.270 1.00 0.00 ATOM 28892 H2 SOL 4596 40.470 16.870 72.090 1.00 0.00 ATOM 28893 OH2 SOL 4597 5.240 21.160 18.920 1.00 0.00 ATOM 28894 H1 SOL 4597 5.210 21.910 18.330 1.00 0.00 ATOM 28895 H2 SOL 4597 4.340 20.830 18.940 1.00 0.00 ATOM 28896 OH2 SOL 4598 46.820 6.910 74.620 1.00 0.00 ATOM 28897 H1 SOL 4598 46.560 7.590 75.240 1.00 0.00 ATOM 28898 H2 SOL 4598 46.210 6.190 74.800 1.00 0.00 ATOM 28899 OH2 SOL 4599 54.110 58.880 15.330 1.00 0.00 ATOM 28900 H1 SOL 4599 54.990 58.670 15.030 1.00 0.00 ATOM 28901 H2 SOL 4599 53.900 59.710 14.910 1.00 0.00 ATOM 28902 OH2 SOL 4600 6.860 48.400 20.180 1.00 0.00 ATOM 28903 H1 SOL 4600 7.250 47.780 20.800 1.00 0.00 ATOM 28904 H2 SOL 4600 6.100 48.750 20.650 1.00 0.00 ATOM 28905 OH2 SOL 4601 13.430 46.230 72.040 1.00 0.00 ATOM 28906 H1 SOL 4601 14.350 46.470 71.910 1.00 0.00 ATOM 28907 H2 SOL 4601 13.220 46.520 72.920 1.00 0.00 ATOM 28908 OH2 SOL 4602 42.560 35.470 81.330 1.00 0.00 ATOM 28909 H1 SOL 4602 42.670 34.600 81.720 1.00 0.00 ATOM 28910 H2 SOL 4602 42.110 35.980 82.010 1.00 0.00 ATOM 28911 OH2 SOL 4603 9.080 20.020 79.010 1.00 0.00 ATOM 28912 H1 SOL 4603 8.860 20.930 79.210 1.00 0.00 ATOM 28913 H2 SOL 4603 8.630 19.840 78.190 1.00 0.00 ATOM 28914 OH2 SOL 4604 10.880 59.400 13.150 1.00 0.00 ATOM 28915 H1 SOL 4604 11.450 58.770 12.710 1.00 0.00 ATOM 28916 H2 SOL 4604 10.740 59.040 14.020 1.00 0.00 ATOM 28917 OH2 SOL 4605 54.260 26.380 12.810 1.00 0.00 ATOM 28918 H1 SOL 4605 54.300 26.530 13.750 1.00 0.00 ATOM 28919 H2 SOL 4605 55.110 26.660 12.480 1.00 0.00 ATOM 28920 OH2 SOL 4606 38.360 48.010 68.060 1.00 0.00 ATOM 28921 H1 SOL 4606 37.860 48.030 68.870 1.00 0.00 ATOM 28922 H2 SOL 4606 38.350 48.910 67.740 1.00 0.00 ATOM 28923 OH2 SOL 4607 8.720 34.140 11.550 1.00 0.00 ATOM 28924 H1 SOL 4607 8.170 33.890 10.810 1.00 0.00 ATOM 28925 H2 SOL 4607 8.740 35.100 11.530 1.00 0.00 ATOM 28926 OH2 SOL 4608 12.320 28.320 6.930 1.00 0.00 ATOM 28927 H1 SOL 4608 12.980 28.680 6.330 1.00 0.00 ATOM 28928 H2 SOL 4608 11.820 29.080 7.220 1.00 0.00 ATOM 28929 OH2 SOL 4609 26.840 6.880 73.500 1.00 0.00 ATOM 28930 H1 SOL 4609 27.580 6.530 74.000 1.00 0.00 ATOM 28931 H2 SOL 4609 26.480 6.110 73.040 1.00 0.00 ATOM 28932 OH2 SOL 4610 19.870 4.630 74.850 1.00 0.00 ATOM 28933 H1 SOL 4610 19.840 5.530 74.520 1.00 0.00 ATOM 28934 H2 SOL 4610 19.960 4.730 75.800 1.00 0.00 ATOM 28935 OH2 SOL 4611 30.570 22.060 67.560 1.00 0.00 ATOM 28936 H1 SOL 4611 31.010 22.250 68.390 1.00 0.00 ATOM 28937 H2 SOL 4611 30.830 21.170 67.350 1.00 0.00 ATOM 28938 OH2 SOL 4612 38.660 40.320 2.550 1.00 0.00 ATOM 28939 H1 SOL 4612 39.540 40.240 2.190 1.00 0.00 ATOM 28940 H2 SOL 4612 38.670 41.130 3.040 1.00 0.00 ATOM 28941 OH2 SOL 4613 53.720 45.140 84.790 1.00 0.00 ATOM 28942 H1 SOL 4613 53.860 44.560 84.040 1.00 0.00 ATOM 28943 H2 SOL 4613 53.780 46.020 84.420 1.00 0.00 ATOM 28944 OH2 SOL 4614 18.870 36.890 4.850 1.00 0.00 ATOM 28945 H1 SOL 4614 18.610 36.800 5.770 1.00 0.00 ATOM 28946 H2 SOL 4614 19.120 37.810 4.760 1.00 0.00 ATOM 28947 OH2 SOL 4615 14.200 31.760 76.610 1.00 0.00 ATOM 28948 H1 SOL 4615 14.560 32.650 76.550 1.00 0.00 ATOM 28949 H2 SOL 4615 13.600 31.710 75.870 1.00 0.00 ATOM 28950 OH2 SOL 4616 35.620 39.690 63.620 1.00 0.00 ATOM 28951 H1 SOL 4616 35.860 39.150 64.370 1.00 0.00 ATOM 28952 H2 SOL 4616 36.400 40.210 63.440 1.00 0.00 ATOM 28953 OH2 SOL 4617 3.750 6.130 77.430 1.00 0.00 ATOM 28954 H1 SOL 4617 4.400 6.070 76.730 1.00 0.00 ATOM 28955 H2 SOL 4617 4.260 6.090 78.240 1.00 0.00 ATOM 28956 OH2 SOL 4618 16.230 54.740 8.990 1.00 0.00 ATOM 28957 H1 SOL 4618 15.680 54.380 9.690 1.00 0.00 ATOM 28958 H2 SOL 4618 16.100 54.140 8.260 1.00 0.00 ATOM 28959 OH2 SOL 4619 30.500 1.450 23.170 1.00 0.00 ATOM 28960 H1 SOL 4619 31.100 0.760 22.920 1.00 0.00 ATOM 28961 H2 SOL 4619 30.960 1.920 23.870 1.00 0.00 ATOM 28962 OH2 SOL 4620 33.090 9.320 10.650 1.00 0.00 ATOM 28963 H1 SOL 4620 33.730 9.100 11.330 1.00 0.00 ATOM 28964 H2 SOL 4620 32.270 8.930 10.970 1.00 0.00 ATOM 28965 OH2 SOL 4621 49.310 26.890 2.100 1.00 0.00 ATOM 28966 H1 SOL 4621 49.420 26.310 2.850 1.00 0.00 ATOM 28967 H2 SOL 4621 50.200 27.010 1.760 1.00 0.00 ATOM 28968 OH2 SOL 4622 17.020 1.440 83.080 1.00 0.00 ATOM 28969 H1 SOL 4622 16.290 0.820 83.160 1.00 0.00 ATOM 28970 H2 SOL 4622 17.120 1.800 83.960 1.00 0.00 ATOM 28971 OH2 SOL 4623 37.400 58.640 72.880 1.00 0.00 ATOM 28972 H1 SOL 4623 36.790 59.240 73.310 1.00 0.00 ATOM 28973 H2 SOL 4623 37.480 57.900 73.480 1.00 0.00 ATOM 28974 OH2 SOL 4624 8.150 10.620 67.020 1.00 0.00 ATOM 28975 H1 SOL 4624 7.970 10.350 67.920 1.00 0.00 ATOM 28976 H2 SOL 4624 8.780 9.980 66.700 1.00 0.00 ATOM 28977 OH2 SOL 4625 4.180 11.840 64.420 1.00 0.00 ATOM 28978 H1 SOL 4625 4.430 12.480 65.090 1.00 0.00 ATOM 28979 H2 SOL 4625 4.870 11.180 64.450 1.00 0.00 ATOM 28980 OH2 SOL 4626 29.320 1.710 13.490 1.00 0.00 ATOM 28981 H1 SOL 4626 30.080 2.090 13.930 1.00 0.00 ATOM 28982 H2 SOL 4626 29.490 1.850 12.560 1.00 0.00 ATOM 28983 OH2 SOL 4627 47.940 4.030 78.810 1.00 0.00 ATOM 28984 H1 SOL 4627 47.960 4.960 78.560 1.00 0.00 ATOM 28985 H2 SOL 4627 48.790 3.880 79.220 1.00 0.00 ATOM 28986 OH2 SOL 4628 54.340 26.550 3.330 1.00 0.00 ATOM 28987 H1 SOL 4628 54.660 25.650 3.430 1.00 0.00 ATOM 28988 H2 SOL 4628 53.790 26.700 4.100 1.00 0.00 ATOM 28989 OH2 SOL 4629 16.520 26.980 2.980 1.00 0.00 ATOM 28990 H1 SOL 4629 17.280 26.610 3.420 1.00 0.00 ATOM 28991 H2 SOL 4629 16.630 27.920 3.050 1.00 0.00 ATOM 28992 OH2 SOL 4630 11.340 8.950 80.140 1.00 0.00 ATOM 28993 H1 SOL 4630 11.470 9.870 79.900 1.00 0.00 ATOM 28994 H2 SOL 4630 11.890 8.460 79.530 1.00 0.00 ATOM 28995 OH2 SOL 4631 39.160 45.790 1.730 1.00 0.00 ATOM 28996 H1 SOL 4631 38.640 46.580 1.620 1.00 0.00 ATOM 28997 H2 SOL 4631 40.060 46.080 1.610 1.00 0.00 ATOM 28998 OH2 SOL 4632 20.890 11.490 7.530 1.00 0.00 ATOM 28999 H1 SOL 4632 20.350 12.280 7.600 1.00 0.00 ATOM 29000 H2 SOL 4632 21.720 11.730 7.940 1.00 0.00 ATOM 29001 OH2 SOL 4633 7.760 5.130 12.360 1.00 0.00 ATOM 29002 H1 SOL 4633 7.750 4.740 11.490 1.00 0.00 ATOM 29003 H2 SOL 4633 8.360 4.580 12.860 1.00 0.00 ATOM 29004 OH2 SOL 4634 30.230 31.360 66.400 1.00 0.00 ATOM 29005 H1 SOL 4634 29.860 30.480 66.450 1.00 0.00 ATOM 29006 H2 SOL 4634 29.580 31.910 66.850 1.00 0.00 ATOM 29007 OH2 SOL 4635 25.450 11.560 14.030 1.00 0.00 ATOM 29008 H1 SOL 4635 24.740 10.930 13.960 1.00 0.00 ATOM 29009 H2 SOL 4635 25.020 12.370 14.290 1.00 0.00 ATOM 29010 OH2 SOL 4636 30.730 20.370 22.950 1.00 0.00 ATOM 29011 H1 SOL 4636 31.030 20.990 22.290 1.00 0.00 ATOM 29012 H2 SOL 4636 30.070 20.860 23.450 1.00 0.00 ATOM 29013 OH2 SOL 4637 26.720 28.660 78.780 1.00 0.00 ATOM 29014 H1 SOL 4637 25.780 28.560 78.640 1.00 0.00 ATOM 29015 H2 SOL 4637 27.090 28.630 77.900 1.00 0.00 ATOM 29016 OH2 SOL 4638 21.500 26.650 70.820 1.00 0.00 ATOM 29017 H1 SOL 4638 21.530 25.980 70.150 1.00 0.00 ATOM 29018 H2 SOL 4638 20.840 27.270 70.520 1.00 0.00 ATOM 29019 OH2 SOL 4639 40.350 18.630 3.410 1.00 0.00 ATOM 29020 H1 SOL 4639 39.760 18.250 4.050 1.00 0.00 ATOM 29021 H2 SOL 4639 39.790 19.130 2.820 1.00 0.00 ATOM 29022 OH2 SOL 4640 51.110 46.060 12.110 1.00 0.00 ATOM 29023 H1 SOL 4640 51.750 46.660 11.720 1.00 0.00 ATOM 29024 H2 SOL 4640 51.350 46.020 13.040 1.00 0.00 ATOM 29025 OH2 SOL 4641 31.370 3.430 84.410 1.00 0.00 ATOM 29026 H1 SOL 4641 31.590 3.310 85.330 1.00 0.00 ATOM 29027 H2 SOL 4641 31.710 4.300 84.190 1.00 0.00 ATOM 29028 OH2 SOL 4642 7.230 24.270 1.190 1.00 0.00 ATOM 29029 H1 SOL 4642 6.550 24.930 1.270 1.00 0.00 ATOM 29030 H2 SOL 4642 7.980 24.640 1.670 1.00 0.00 ATOM 29031 OH2 SOL 4643 43.700 9.220 19.110 1.00 0.00 ATOM 29032 H1 SOL 4643 43.380 10.120 19.200 1.00 0.00 ATOM 29033 H2 SOL 4643 42.900 8.690 19.030 1.00 0.00 ATOM 29034 OH2 SOL 4644 12.370 25.980 8.330 1.00 0.00 ATOM 29035 H1 SOL 4644 12.500 26.860 7.990 1.00 0.00 ATOM 29036 H2 SOL 4644 12.140 26.110 9.250 1.00 0.00 ATOM 29037 OH2 SOL 4645 36.320 11.820 83.810 1.00 0.00 ATOM 29038 H1 SOL 4645 36.020 12.010 84.700 1.00 0.00 ATOM 29039 H2 SOL 4645 35.690 11.200 83.460 1.00 0.00 ATOM 29040 OH2 SOL 4646 47.710 50.770 58.170 1.00 0.00 ATOM 29041 H1 SOL 4646 47.350 50.570 57.310 1.00 0.00 ATOM 29042 H2 SOL 4646 48.550 50.310 58.190 1.00 0.00 ATOM 29043 OH2 SOL 4647 27.350 43.120 72.720 1.00 0.00 ATOM 29044 H1 SOL 4647 26.730 43.770 72.380 1.00 0.00 ATOM 29045 H2 SOL 4647 27.200 42.340 72.190 1.00 0.00 ATOM 29046 OH2 SOL 4648 53.500 28.780 20.230 1.00 0.00 ATOM 29047 H1 SOL 4648 53.400 29.310 21.020 1.00 0.00 ATOM 29048 H2 SOL 4648 53.660 29.420 19.540 1.00 0.00 ATOM 29049 OH2 SOL 4649 46.550 33.460 74.210 1.00 0.00 ATOM 29050 H1 SOL 4649 45.940 32.760 73.980 1.00 0.00 ATOM 29051 H2 SOL 4649 46.250 34.210 73.700 1.00 0.00 ATOM 29052 OH2 SOL 4650 18.960 7.780 76.520 1.00 0.00 ATOM 29053 H1 SOL 4650 19.840 7.770 76.890 1.00 0.00 ATOM 29054 H2 SOL 4650 18.900 8.610 76.060 1.00 0.00 ATOM 29055 OH2 SOL 4651 6.990 60.530 66.300 1.00 0.00 ATOM 29056 H1 SOL 4651 7.860 60.490 65.890 1.00 0.00 ATOM 29057 H2 SOL 4651 6.480 59.850 65.860 1.00 0.00 ATOM 29058 OH2 SOL 4652 56.280 21.160 15.450 1.00 0.00 ATOM 29059 H1 SOL 4652 56.500 20.900 16.350 1.00 0.00 ATOM 29060 H2 SOL 4652 55.490 21.690 15.540 1.00 0.00 ATOM 29061 OH2 SOL 4653 31.950 55.880 67.910 1.00 0.00 ATOM 29062 H1 SOL 4653 31.970 56.830 67.800 1.00 0.00 ATOM 29063 H2 SOL 4653 32.760 55.570 67.510 1.00 0.00 ATOM 29064 OH2 SOL 4654 7.480 31.120 -0.050 1.00 0.00 ATOM 29065 H1 SOL 4654 6.870 31.430 -0.720 1.00 0.00 ATOM 29066 H2 SOL 4654 7.150 31.500 0.770 1.00 0.00 ATOM 29067 OH2 SOL 4655 53.460 45.380 67.850 1.00 0.00 ATOM 29068 H1 SOL 4655 52.600 45.800 67.820 1.00 0.00 ATOM 29069 H2 SOL 4655 54.060 46.090 68.080 1.00 0.00 ATOM 29070 OH2 SOL 4656 17.120 16.190 17.520 1.00 0.00 ATOM 29071 H1 SOL 4656 16.860 16.520 18.370 1.00 0.00 ATOM 29072 H2 SOL 4656 16.770 16.820 16.890 1.00 0.00 ATOM 29073 OH2 SOL 4657 33.520 16.980 5.060 1.00 0.00 ATOM 29074 H1 SOL 4657 34.290 17.550 5.000 1.00 0.00 ATOM 29075 H2 SOL 4657 32.800 17.570 5.280 1.00 0.00 ATOM 29076 OH2 SOL 4658 14.680 23.230 71.800 1.00 0.00 ATOM 29077 H1 SOL 4658 14.880 24.140 71.610 1.00 0.00 ATOM 29078 H2 SOL 4658 15.230 23.020 72.560 1.00 0.00 ATOM 29079 OH2 SOL 4659 2.500 32.590 73.100 1.00 0.00 ATOM 29080 H1 SOL 4659 2.190 31.860 72.560 1.00 0.00 ATOM 29081 H2 SOL 4659 1.760 33.190 73.150 1.00 0.00 ATOM 29082 OH2 SOL 4660 30.960 39.400 13.310 1.00 0.00 ATOM 29083 H1 SOL 4660 30.700 38.480 13.390 1.00 0.00 ATOM 29084 H2 SOL 4660 31.450 39.590 14.110 1.00 0.00 ATOM 29085 OH2 SOL 4661 22.150 41.320 13.780 1.00 0.00 ATOM 29086 H1 SOL 4661 21.220 41.380 13.570 1.00 0.00 ATOM 29087 H2 SOL 4661 22.420 40.470 13.430 1.00 0.00 ATOM 29088 OH2 SOL 4662 46.290 6.060 7.090 1.00 0.00 ATOM 29089 H1 SOL 4662 46.230 6.290 8.020 1.00 0.00 ATOM 29090 H2 SOL 4662 46.090 5.130 7.060 1.00 0.00 ATOM 29091 OH2 SOL 4663 52.210 5.450 68.800 1.00 0.00 ATOM 29092 H1 SOL 4663 52.910 5.950 69.210 1.00 0.00 ATOM 29093 H2 SOL 4663 51.740 6.100 68.270 1.00 0.00 ATOM 29094 OH2 SOL 4664 59.140 31.710 11.380 1.00 0.00 ATOM 29095 H1 SOL 4664 59.140 32.650 11.190 1.00 0.00 ATOM 29096 H2 SOL 4664 59.060 31.300 10.520 1.00 0.00 ATOM 29097 OH2 SOL 4665 5.590 6.540 26.330 1.00 0.00 ATOM 29098 H1 SOL 4665 4.860 6.160 26.820 1.00 0.00 ATOM 29099 H2 SOL 4665 6.050 5.780 25.980 1.00 0.00 ATOM 29100 OH2 SOL 4666 4.500 25.430 83.100 1.00 0.00 ATOM 29101 H1 SOL 4666 5.060 25.380 83.880 1.00 0.00 ATOM 29102 H2 SOL 4666 3.630 25.600 83.450 1.00 0.00 ATOM 29103 OH2 SOL 4667 53.400 10.010 5.260 1.00 0.00 ATOM 29104 H1 SOL 4667 54.220 9.920 5.750 1.00 0.00 ATOM 29105 H2 SOL 4667 53.380 10.930 4.990 1.00 0.00 ATOM 29106 OH2 SOL 4668 7.510 50.780 63.270 1.00 0.00 ATOM 29107 H1 SOL 4668 7.260 51.650 62.970 1.00 0.00 ATOM 29108 H2 SOL 4668 8.460 50.820 63.360 1.00 0.00 ATOM 29109 OH2 SOL 4669 40.800 36.050 12.670 1.00 0.00 ATOM 29110 H1 SOL 4669 40.730 36.520 13.500 1.00 0.00 ATOM 29111 H2 SOL 4669 41.170 36.700 12.060 1.00 0.00 ATOM 29112 OH2 SOL 4670 16.190 44.950 71.800 1.00 0.00 ATOM 29113 H1 SOL 4670 16.650 45.730 72.110 1.00 0.00 ATOM 29114 H2 SOL 4670 16.650 44.220 72.230 1.00 0.00 ATOM 29115 OH2 SOL 4671 34.840 8.050 0.330 1.00 0.00 ATOM 29116 H1 SOL 4671 35.790 7.900 0.410 1.00 0.00 ATOM 29117 H2 SOL 4671 34.540 8.160 1.230 1.00 0.00 ATOM 29118 OH2 SOL 4672 33.600 36.780 68.450 1.00 0.00 ATOM 29119 H1 SOL 4672 34.180 37.360 68.940 1.00 0.00 ATOM 29120 H2 SOL 4672 32.730 37.190 68.530 1.00 0.00 ATOM 29121 OH2 SOL 4673 40.190 27.910 11.530 1.00 0.00 ATOM 29122 H1 SOL 4673 39.520 27.760 12.200 1.00 0.00 ATOM 29123 H2 SOL 4673 40.020 28.800 11.230 1.00 0.00 ATOM 29124 OH2 SOL 4674 20.490 7.130 82.700 1.00 0.00 ATOM 29125 H1 SOL 4674 19.980 7.470 83.430 1.00 0.00 ATOM 29126 H2 SOL 4674 19.890 7.120 81.960 1.00 0.00 ATOM 29127 OH2 SOL 4675 20.660 9.090 73.560 1.00 0.00 ATOM 29128 H1 SOL 4675 21.550 9.010 73.210 1.00 0.00 ATOM 29129 H2 SOL 4675 20.650 9.950 73.990 1.00 0.00 ATOM 29130 OH2 SOL 4676 29.700 9.630 64.880 1.00 0.00 ATOM 29131 H1 SOL 4676 28.970 9.550 64.270 1.00 0.00 ATOM 29132 H2 SOL 4676 29.490 10.400 65.400 1.00 0.00 ATOM 29133 OH2 SOL 4677 38.680 33.860 76.200 1.00 0.00 ATOM 29134 H1 SOL 4677 39.430 34.370 75.880 1.00 0.00 ATOM 29135 H2 SOL 4677 38.860 33.740 77.130 1.00 0.00 ATOM 29136 OH2 SOL 4678 19.450 23.860 72.880 1.00 0.00 ATOM 29137 H1 SOL 4678 19.130 22.970 72.720 1.00 0.00 ATOM 29138 H2 SOL 4678 19.310 24.320 72.060 1.00 0.00 ATOM 29139 OH2 SOL 4679 26.160 18.050 79.940 1.00 0.00 ATOM 29140 H1 SOL 4679 27.010 18.340 80.290 1.00 0.00 ATOM 29141 H2 SOL 4679 25.790 18.840 79.550 1.00 0.00 ATOM 29142 OH2 SOL 4680 4.890 29.410 63.640 1.00 0.00 ATOM 29143 H1 SOL 4680 4.110 29.360 63.090 1.00 0.00 ATOM 29144 H2 SOL 4680 4.590 29.800 64.450 1.00 0.00 ATOM 29145 OH2 SOL 4681 53.410 33.540 66.910 1.00 0.00 ATOM 29146 H1 SOL 4681 54.050 34.160 67.240 1.00 0.00 ATOM 29147 H2 SOL 4681 52.800 34.060 66.390 1.00 0.00 ATOM 29148 OH2 SOL 4682 43.770 41.850 64.220 1.00 0.00 ATOM 29149 H1 SOL 4682 43.040 42.120 64.780 1.00 0.00 ATOM 29150 H2 SOL 4682 43.690 40.900 64.150 1.00 0.00 ATOM 29151 OH2 SOL 4683 12.150 60.360 72.530 1.00 0.00 ATOM 29152 H1 SOL 4683 11.350 59.870 72.710 1.00 0.00 ATOM 29153 H2 SOL 4683 11.890 61.280 72.570 1.00 0.00 ATOM 29154 OH2 SOL 4684 27.030 23.230 80.950 1.00 0.00 ATOM 29155 H1 SOL 4684 26.880 23.740 80.150 1.00 0.00 ATOM 29156 H2 SOL 4684 27.970 23.350 81.130 1.00 0.00 ATOM 29157 OH2 SOL 4685 45.840 16.960 5.850 1.00 0.00 ATOM 29158 H1 SOL 4685 45.110 17.220 6.410 1.00 0.00 ATOM 29159 H2 SOL 4685 45.750 16.020 5.750 1.00 0.00 ATOM 29160 OH2 SOL 4686 55.810 21.040 10.920 1.00 0.00 ATOM 29161 H1 SOL 4686 56.570 20.540 10.630 1.00 0.00 ATOM 29162 H2 SOL 4686 55.300 20.430 11.450 1.00 0.00 ATOM 29163 OH2 SOL 4687 46.270 57.710 83.990 1.00 0.00 ATOM 29164 H1 SOL 4687 45.340 57.500 83.990 1.00 0.00 ATOM 29165 H2 SOL 4687 46.440 58.020 83.100 1.00 0.00 ATOM 29166 OH2 SOL 4688 42.940 19.690 2.530 1.00 0.00 ATOM 29167 H1 SOL 4688 42.230 19.070 2.710 1.00 0.00 ATOM 29168 H2 SOL 4688 43.700 19.320 2.980 1.00 0.00 ATOM 29169 OH2 SOL 4689 34.440 15.110 11.010 1.00 0.00 ATOM 29170 H1 SOL 4689 35.250 15.540 10.730 1.00 0.00 ATOM 29171 H2 SOL 4689 34.310 14.390 10.390 1.00 0.00 ATOM 29172 OH2 SOL 4690 33.790 33.540 80.190 1.00 0.00 ATOM 29173 H1 SOL 4690 33.990 33.380 81.110 1.00 0.00 ATOM 29174 H2 SOL 4690 32.870 33.310 80.100 1.00 0.00 ATOM 29175 OH2 SOL 4691 33.470 1.290 57.060 1.00 0.00 ATOM 29176 H1 SOL 4691 33.320 0.470 56.590 1.00 0.00 ATOM 29177 H2 SOL 4691 32.840 1.900 56.670 1.00 0.00 ATOM 29178 OH2 SOL 4692 53.120 59.810 2.360 1.00 0.00 ATOM 29179 H1 SOL 4692 53.790 59.930 3.030 1.00 0.00 ATOM 29180 H2 SOL 4692 52.650 59.020 2.630 1.00 0.00 ATOM 29181 OH2 SOL 4693 28.890 16.290 5.940 1.00 0.00 ATOM 29182 H1 SOL 4693 29.550 16.970 5.790 1.00 0.00 ATOM 29183 H2 SOL 4693 28.860 16.200 6.900 1.00 0.00 ATOM 29184 OH2 SOL 4694 55.440 9.980 7.460 1.00 0.00 ATOM 29185 H1 SOL 4694 55.620 10.510 8.240 1.00 0.00 ATOM 29186 H2 SOL 4694 54.490 9.870 7.460 1.00 0.00 ATOM 29187 OH2 SOL 4695 36.770 30.660 79.550 1.00 0.00 ATOM 29188 H1 SOL 4695 36.700 31.420 78.970 1.00 0.00 ATOM 29189 H2 SOL 4695 36.980 29.930 78.980 1.00 0.00 ATOM 29190 OH2 SOL 4696 17.650 34.410 8.260 1.00 0.00 ATOM 29191 H1 SOL 4696 17.230 33.890 7.580 1.00 0.00 ATOM 29192 H2 SOL 4696 16.930 34.730 8.790 1.00 0.00 ATOM 29193 OH2 SOL 4697 15.660 24.830 13.220 1.00 0.00 ATOM 29194 H1 SOL 4697 16.000 24.120 12.670 1.00 0.00 ATOM 29195 H2 SOL 4697 14.820 24.510 13.530 1.00 0.00 ATOM 29196 OH2 SOL 4698 39.670 11.910 68.840 1.00 0.00 ATOM 29197 H1 SOL 4698 39.430 12.560 69.500 1.00 0.00 ATOM 29198 H2 SOL 4698 39.170 11.130 69.100 1.00 0.00 ATOM 29199 OH2 SOL 4699 45.410 23.000 65.190 1.00 0.00 ATOM 29200 H1 SOL 4699 46.060 22.720 65.840 1.00 0.00 ATOM 29201 H2 SOL 4699 45.760 23.820 64.830 1.00 0.00 ATOM 29202 OH2 SOL 4700 6.020 10.070 9.390 1.00 0.00 ATOM 29203 H1 SOL 4700 6.920 9.940 9.100 1.00 0.00 ATOM 29204 H2 SOL 4700 5.760 10.890 8.980 1.00 0.00 ATOM 29205 OH2 SOL 4701 56.590 3.210 13.400 1.00 0.00 ATOM 29206 H1 SOL 4701 57.310 2.830 12.880 1.00 0.00 ATOM 29207 H2 SOL 4701 56.220 3.890 12.830 1.00 0.00 ATOM 29208 OH2 SOL 4702 23.250 43.860 83.520 1.00 0.00 ATOM 29209 H1 SOL 4702 24.180 43.690 83.630 1.00 0.00 ATOM 29210 H2 SOL 4702 22.830 43.440 84.270 1.00 0.00 ATOM 29211 OH2 SOL 4703 34.960 42.100 4.700 1.00 0.00 ATOM 29212 H1 SOL 4703 35.680 42.700 4.520 1.00 0.00 ATOM 29213 H2 SOL 4703 34.940 42.020 5.650 1.00 0.00 ATOM 29214 OH2 SOL 4704 43.630 43.990 59.070 1.00 0.00 ATOM 29215 H1 SOL 4704 43.540 44.380 58.200 1.00 0.00 ATOM 29216 H2 SOL 4704 43.060 44.530 59.630 1.00 0.00 ATOM 29217 OH2 SOL 4705 14.950 38.790 8.450 1.00 0.00 ATOM 29218 H1 SOL 4705 14.410 39.520 8.750 1.00 0.00 ATOM 29219 H2 SOL 4705 15.080 38.250 9.230 1.00 0.00 ATOM 29220 OH2 SOL 4706 57.110 36.490 1.800 1.00 0.00 ATOM 29221 H1 SOL 4706 56.730 36.190 0.970 1.00 0.00 ATOM 29222 H2 SOL 4706 57.690 37.210 1.550 1.00 0.00 ATOM 29223 OH2 SOL 4707 23.190 0.480 15.480 1.00 0.00 ATOM 29224 H1 SOL 4707 23.260 -0.470 15.600 1.00 0.00 ATOM 29225 H2 SOL 4707 22.660 0.780 16.230 1.00 0.00 ATOM 29226 OH2 SOL 4708 37.460 7.580 77.710 1.00 0.00 ATOM 29227 H1 SOL 4708 38.240 7.040 77.740 1.00 0.00 ATOM 29228 H2 SOL 4708 37.780 8.450 77.440 1.00 0.00 ATOM 29229 OH2 SOL 4709 50.610 59.090 69.040 1.00 0.00 ATOM 29230 H1 SOL 4709 50.230 58.360 68.550 1.00 0.00 ATOM 29231 H2 SOL 4709 50.630 58.780 69.950 1.00 0.00 ATOM 29232 OH2 SOL 4710 54.010 59.650 78.810 1.00 0.00 ATOM 29233 H1 SOL 4710 53.930 59.570 77.860 1.00 0.00 ATOM 29234 H2 SOL 4710 54.540 58.900 79.070 1.00 0.00 ATOM 29235 OH2 SOL 4711 24.290 57.420 73.290 1.00 0.00 ATOM 29236 H1 SOL 4711 23.770 58.030 72.770 1.00 0.00 ATOM 29237 H2 SOL 4711 25.180 57.750 73.220 1.00 0.00 ATOM 29238 OH2 SOL 4712 29.650 44.150 62.940 1.00 0.00 ATOM 29239 H1 SOL 4712 29.070 44.280 63.690 1.00 0.00 ATOM 29240 H2 SOL 4712 30.510 44.450 63.250 1.00 0.00 ATOM 29241 OH2 SOL 4713 55.020 60.340 4.680 1.00 0.00 ATOM 29242 H1 SOL 4713 55.560 60.970 4.230 1.00 0.00 ATOM 29243 H2 SOL 4713 54.190 60.790 4.830 1.00 0.00 ATOM 29244 OH2 SOL 4714 34.260 20.450 72.570 1.00 0.00 ATOM 29245 H1 SOL 4714 34.330 21.400 72.550 1.00 0.00 ATOM 29246 H2 SOL 4714 33.650 20.240 71.860 1.00 0.00 ATOM 29247 OH2 SOL 4715 39.300 21.940 64.010 1.00 0.00 ATOM 29248 H1 SOL 4715 39.100 21.380 63.260 1.00 0.00 ATOM 29249 H2 SOL 4715 38.890 21.500 64.760 1.00 0.00 ATOM 29250 OH2 SOL 4716 9.050 56.670 72.580 1.00 0.00 ATOM 29251 H1 SOL 4716 8.230 57.130 72.760 1.00 0.00 ATOM 29252 H2 SOL 4716 9.720 57.340 72.690 1.00 0.00 ATOM 29253 OH2 SOL 4717 33.680 36.520 19.600 1.00 0.00 ATOM 29254 H1 SOL 4717 32.880 36.280 20.070 1.00 0.00 ATOM 29255 H2 SOL 4717 33.690 35.950 18.830 1.00 0.00 ATOM 29256 OH2 SOL 4718 34.840 38.420 27.000 1.00 0.00 ATOM 29257 H1 SOL 4718 35.100 38.130 27.880 1.00 0.00 ATOM 29258 H2 SOL 4718 35.630 38.830 26.650 1.00 0.00 ATOM 29259 OH2 SOL 4719 26.980 36.120 13.760 1.00 0.00 ATOM 29260 H1 SOL 4719 27.500 36.160 12.960 1.00 0.00 ATOM 29261 H2 SOL 4719 26.540 35.270 13.720 1.00 0.00 ATOM 29262 OH2 SOL 4720 57.490 15.520 60.660 1.00 0.00 ATOM 29263 H1 SOL 4720 57.590 16.450 60.460 1.00 0.00 ATOM 29264 H2 SOL 4720 56.870 15.190 60.010 1.00 0.00 ATOM 29265 OH2 SOL 4721 54.600 23.090 74.350 1.00 0.00 ATOM 29266 H1 SOL 4721 53.670 22.990 74.560 1.00 0.00 ATOM 29267 H2 SOL 4721 54.640 23.870 73.800 1.00 0.00 ATOM 29268 OH2 SOL 4722 49.250 33.190 17.290 1.00 0.00 ATOM 29269 H1 SOL 4722 49.320 34.140 17.160 1.00 0.00 ATOM 29270 H2 SOL 4722 49.900 33.000 17.970 1.00 0.00 ATOM 29271 OH2 SOL 4723 31.430 14.650 12.180 1.00 0.00 ATOM 29272 H1 SOL 4723 31.460 14.050 12.920 1.00 0.00 ATOM 29273 H2 SOL 4723 31.730 14.120 11.440 1.00 0.00 ATOM 29274 OH2 SOL 4724 40.660 6.670 75.190 1.00 0.00 ATOM 29275 H1 SOL 4724 41.500 7.080 74.950 1.00 0.00 ATOM 29276 H2 SOL 4724 40.480 6.990 76.070 1.00 0.00 ATOM 29277 OH2 SOL 4725 51.780 8.600 11.400 1.00 0.00 ATOM 29278 H1 SOL 4725 51.410 8.040 10.720 1.00 0.00 ATOM 29279 H2 SOL 4725 52.730 8.480 11.330 1.00 0.00 ATOM 29280 OH2 SOL 4726 8.720 36.090 83.740 1.00 0.00 ATOM 29281 H1 SOL 4726 7.820 36.020 84.060 1.00 0.00 ATOM 29282 H2 SOL 4726 8.990 36.990 83.960 1.00 0.00 ATOM 29283 OH2 SOL 4727 59.610 4.650 15.780 1.00 0.00 ATOM 29284 H1 SOL 4727 59.670 4.960 14.870 1.00 0.00 ATOM 29285 H2 SOL 4727 58.910 5.180 16.170 1.00 0.00 ATOM 29286 OH2 SOL 4728 24.250 7.210 65.900 1.00 0.00 ATOM 29287 H1 SOL 4728 23.300 7.100 65.910 1.00 0.00 ATOM 29288 H2 SOL 4728 24.440 7.590 65.040 1.00 0.00 ATOM 29289 OH2 SOL 4729 42.540 32.570 69.620 1.00 0.00 ATOM 29290 H1 SOL 4729 43.250 33.070 70.030 1.00 0.00 ATOM 29291 H2 SOL 4729 42.530 31.740 70.090 1.00 0.00 ATOM 29292 OH2 SOL 4730 35.110 59.670 77.470 1.00 0.00 ATOM 29293 H1 SOL 4730 34.680 60.430 77.080 1.00 0.00 ATOM 29294 H2 SOL 4730 34.610 58.920 77.140 1.00 0.00 ATOM 29295 OH2 SOL 4731 51.470 26.680 77.690 1.00 0.00 ATOM 29296 H1 SOL 4731 51.060 26.690 76.830 1.00 0.00 ATOM 29297 H2 SOL 4731 50.840 27.110 78.260 1.00 0.00 ATOM 29298 OH2 SOL 4732 34.000 43.830 68.820 1.00 0.00 ATOM 29299 H1 SOL 4732 33.650 42.950 69.000 1.00 0.00 ATOM 29300 H2 SOL 4732 34.380 44.110 69.650 1.00 0.00 ATOM 29301 OH2 SOL 4733 18.830 12.490 10.980 1.00 0.00 ATOM 29302 H1 SOL 4733 19.720 12.300 11.250 1.00 0.00 ATOM 29303 H2 SOL 4733 18.890 13.300 10.480 1.00 0.00 ATOM 29304 OH2 SOL 4734 16.840 51.060 1.900 1.00 0.00 ATOM 29305 H1 SOL 4734 17.410 50.990 2.660 1.00 0.00 ATOM 29306 H2 SOL 4734 16.140 51.660 2.180 1.00 0.00 ATOM 29307 OH2 SOL 4735 24.000 27.500 69.420 1.00 0.00 ATOM 29308 H1 SOL 4735 24.000 28.450 69.280 1.00 0.00 ATOM 29309 H2 SOL 4735 23.210 27.340 69.930 1.00 0.00 ATOM 29310 OH2 SOL 4736 19.650 32.720 16.480 1.00 0.00 ATOM 29311 H1 SOL 4736 18.790 33.030 16.770 1.00 0.00 ATOM 29312 H2 SOL 4736 19.450 32.070 15.800 1.00 0.00 ATOM 29313 OH2 SOL 4737 2.540 54.900 67.110 1.00 0.00 ATOM 29314 H1 SOL 4737 3.140 54.550 67.770 1.00 0.00 ATOM 29315 H2 SOL 4737 3.090 55.030 66.340 1.00 0.00 ATOM 29316 OH2 SOL 4738 26.490 17.900 1.200 1.00 0.00 ATOM 29317 H1 SOL 4738 26.270 17.430 2.000 1.00 0.00 ATOM 29318 H2 SOL 4738 26.260 17.290 0.500 1.00 0.00 ATOM 29319 OH2 SOL 4739 47.430 47.930 64.960 1.00 0.00 ATOM 29320 H1 SOL 4739 47.950 47.330 65.480 1.00 0.00 ATOM 29321 H2 SOL 4739 48.010 48.670 64.790 1.00 0.00 ATOM 29322 OH2 SOL 4740 46.680 16.730 0.510 1.00 0.00 ATOM 29323 H1 SOL 4740 45.770 16.560 0.280 1.00 0.00 ATOM 29324 H2 SOL 4740 47.040 17.200 -0.240 1.00 0.00 ATOM 29325 OH2 SOL 4741 37.750 26.930 16.590 1.00 0.00 ATOM 29326 H1 SOL 4741 38.680 27.010 16.400 1.00 0.00 ATOM 29327 H2 SOL 4741 37.710 26.660 17.510 1.00 0.00 ATOM 29328 OH2 SOL 4742 21.050 15.850 3.680 1.00 0.00 ATOM 29329 H1 SOL 4742 20.600 16.360 3.000 1.00 0.00 ATOM 29330 H2 SOL 4742 21.960 15.840 3.390 1.00 0.00 ATOM 29331 OH2 SOL 4743 10.450 14.460 19.900 1.00 0.00 ATOM 29332 H1 SOL 4743 10.240 13.530 19.820 1.00 0.00 ATOM 29333 H2 SOL 4743 9.730 14.830 20.420 1.00 0.00 ATOM 29334 OH2 SOL 4744 20.530 45.700 70.660 1.00 0.00 ATOM 29335 H1 SOL 4744 20.390 44.990 71.290 1.00 0.00 ATOM 29336 H2 SOL 4744 21.040 45.300 69.960 1.00 0.00 ATOM 29337 OH2 SOL 4745 11.810 42.420 12.130 1.00 0.00 ATOM 29338 H1 SOL 4745 12.230 43.170 11.720 1.00 0.00 ATOM 29339 H2 SOL 4745 12.370 42.210 12.880 1.00 0.00 ATOM 29340 OH2 SOL 4746 38.830 50.050 17.900 1.00 0.00 ATOM 29341 H1 SOL 4746 39.290 49.790 18.690 1.00 0.00 ATOM 29342 H2 SOL 4746 37.910 49.800 18.060 1.00 0.00 ATOM 29343 OH2 SOL 4747 44.750 5.610 12.780 1.00 0.00 ATOM 29344 H1 SOL 4747 44.890 5.050 13.540 1.00 0.00 ATOM 29345 H2 SOL 4747 44.190 5.100 12.200 1.00 0.00 ATOM 29346 OH2 SOL 4748 23.650 16.330 2.950 1.00 0.00 ATOM 29347 H1 SOL 4748 23.420 17.210 2.650 1.00 0.00 ATOM 29348 H2 SOL 4748 24.500 16.450 3.380 1.00 0.00 ATOM 29349 OH2 SOL 4749 51.660 15.020 82.740 1.00 0.00 ATOM 29350 H1 SOL 4749 51.110 15.140 81.970 1.00 0.00 ATOM 29351 H2 SOL 4749 52.550 15.130 82.410 1.00 0.00 ATOM 29352 OH2 SOL 4750 18.990 13.920 19.920 1.00 0.00 ATOM 29353 H1 SOL 4750 18.980 13.950 20.880 1.00 0.00 ATOM 29354 H2 SOL 4750 19.820 14.330 19.670 1.00 0.00 ATOM 29355 OH2 SOL 4751 23.460 16.360 24.030 1.00 0.00 ATOM 29356 H1 SOL 4751 23.890 15.970 24.790 1.00 0.00 ATOM 29357 H2 SOL 4751 23.830 15.900 23.280 1.00 0.00 ATOM 29358 OH2 SOL 4752 40.750 5.130 59.460 1.00 0.00 ATOM 29359 H1 SOL 4752 39.830 5.410 59.510 1.00 0.00 ATOM 29360 H2 SOL 4752 40.800 4.590 58.670 1.00 0.00 ATOM 29361 OH2 SOL 4753 58.320 8.410 66.200 1.00 0.00 ATOM 29362 H1 SOL 4753 57.820 8.510 65.390 1.00 0.00 ATOM 29363 H2 SOL 4753 58.960 7.720 66.010 1.00 0.00 ATOM 29364 OH2 SOL 4754 6.730 9.500 4.660 1.00 0.00 ATOM 29365 H1 SOL 4754 7.630 9.500 4.340 1.00 0.00 ATOM 29366 H2 SOL 4754 6.370 10.330 4.350 1.00 0.00 ATOM 29367 OH2 SOL 4755 42.540 11.240 70.020 1.00 0.00 ATOM 29368 H1 SOL 4755 41.820 11.450 69.430 1.00 0.00 ATOM 29369 H2 SOL 4755 42.620 10.290 69.970 1.00 0.00 ATOM 29370 OH2 SOL 4756 45.250 36.700 20.820 1.00 0.00 ATOM 29371 H1 SOL 4756 46.080 37.120 20.570 1.00 0.00 ATOM 29372 H2 SOL 4756 45.480 36.150 21.560 1.00 0.00 ATOM 29373 OH2 SOL 4757 1.720 3.900 75.960 1.00 0.00 ATOM 29374 H1 SOL 4757 2.320 4.590 75.680 1.00 0.00 ATOM 29375 H2 SOL 4757 2.290 3.230 76.340 1.00 0.00 ATOM 29376 OH2 SOL 4758 38.610 18.390 77.320 1.00 0.00 ATOM 29377 H1 SOL 4758 39.010 17.570 77.590 1.00 0.00 ATOM 29378 H2 SOL 4758 39.280 18.840 76.800 1.00 0.00 ATOM 29379 OH2 SOL 4759 3.900 9.020 79.060 1.00 0.00 ATOM 29380 H1 SOL 4759 3.810 8.300 79.680 1.00 0.00 ATOM 29381 H2 SOL 4759 4.620 8.760 78.490 1.00 0.00 ATOM 29382 OH2 SOL 4760 24.990 31.070 65.920 1.00 0.00 ATOM 29383 H1 SOL 4760 24.090 30.750 65.980 1.00 0.00 ATOM 29384 H2 SOL 4760 25.380 30.580 65.200 1.00 0.00 ATOM 29385 OH2 SOL 4761 45.000 20.200 7.610 1.00 0.00 ATOM 29386 H1 SOL 4761 44.570 20.710 8.290 1.00 0.00 ATOM 29387 H2 SOL 4761 45.000 20.770 6.840 1.00 0.00 ATOM 29388 OH2 SOL 4762 7.510 26.250 16.100 1.00 0.00 ATOM 29389 H1 SOL 4762 7.480 25.510 15.490 1.00 0.00 ATOM 29390 H2 SOL 4762 8.400 26.580 16.040 1.00 0.00 ATOM 29391 OH2 SOL 4763 58.980 26.780 69.100 1.00 0.00 ATOM 29392 H1 SOL 4763 59.670 27.260 68.650 1.00 0.00 ATOM 29393 H2 SOL 4763 58.290 26.680 68.450 1.00 0.00 ATOM 29394 OH2 SOL 4764 32.150 54.110 83.690 1.00 0.00 ATOM 29395 H1 SOL 4764 33.060 53.870 83.530 1.00 0.00 ATOM 29396 H2 SOL 4764 31.660 53.670 82.990 1.00 0.00 ATOM 29397 OH2 SOL 4765 5.280 57.140 12.160 1.00 0.00 ATOM 29398 H1 SOL 4765 4.810 56.720 11.440 1.00 0.00 ATOM 29399 H2 SOL 4765 4.650 57.760 12.520 1.00 0.00 ATOM 29400 OH2 SOL 4766 14.780 56.250 60.620 1.00 0.00 ATOM 29401 H1 SOL 4766 15.220 55.420 60.420 1.00 0.00 ATOM 29402 H2 SOL 4766 15.460 56.910 60.510 1.00 0.00 ATOM 29403 OH2 SOL 4767 1.270 2.030 15.550 1.00 0.00 ATOM 29404 H1 SOL 4767 0.710 2.770 15.820 1.00 0.00 ATOM 29405 H2 SOL 4767 2.110 2.190 15.980 1.00 0.00 ATOM 29406 OH2 SOL 4768 37.230 52.780 25.850 1.00 0.00 ATOM 29407 H1 SOL 4768 37.170 51.830 25.750 1.00 0.00 ATOM 29408 H2 SOL 4768 37.940 52.910 26.490 1.00 0.00 ATOM 29409 OH2 SOL 4769 29.520 25.020 3.100 1.00 0.00 ATOM 29410 H1 SOL 4769 29.400 25.890 2.740 1.00 0.00 ATOM 29411 H2 SOL 4769 29.620 25.160 4.040 1.00 0.00 ATOM 29412 OH2 SOL 4770 41.390 43.940 4.940 1.00 0.00 ATOM 29413 H1 SOL 4770 40.650 44.540 5.070 1.00 0.00 ATOM 29414 H2 SOL 4770 41.860 43.960 5.770 1.00 0.00 ATOM 29415 OH2 SOL 4771 25.830 44.050 2.120 1.00 0.00 ATOM 29416 H1 SOL 4771 25.280 43.280 2.320 1.00 0.00 ATOM 29417 H2 SOL 4771 25.210 44.720 1.830 1.00 0.00 ATOM 29418 OH2 SOL 4772 11.200 28.350 13.720 1.00 0.00 ATOM 29419 H1 SOL 4772 11.860 28.790 13.180 1.00 0.00 ATOM 29420 H2 SOL 4772 11.490 27.440 13.780 1.00 0.00 ATOM 29421 OH2 SOL 4773 15.950 21.080 14.640 1.00 0.00 ATOM 29422 H1 SOL 4773 15.510 20.310 15.000 1.00 0.00 ATOM 29423 H2 SOL 4773 16.580 21.330 15.300 1.00 0.00 ATOM 29424 OH2 SOL 4774 0.110 60.420 2.750 1.00 0.00 ATOM 29425 H1 SOL 4774 0.060 60.440 3.700 1.00 0.00 ATOM 29426 H2 SOL 4774 -0.010 59.500 2.510 1.00 0.00 ATOM 29427 OH2 SOL 4775 8.710 6.250 71.220 1.00 0.00 ATOM 29428 H1 SOL 4775 8.560 5.420 70.780 1.00 0.00 ATOM 29429 H2 SOL 4775 9.370 6.700 70.700 1.00 0.00 ATOM 29430 OH2 SOL 4776 57.430 14.870 11.570 1.00 0.00 ATOM 29431 H1 SOL 4776 57.030 14.000 11.540 1.00 0.00 ATOM 29432 H2 SOL 4776 58.170 14.770 12.170 1.00 0.00 ATOM 29433 OH2 SOL 4777 44.750 16.100 78.910 1.00 0.00 ATOM 29434 H1 SOL 4777 45.070 16.380 78.060 1.00 0.00 ATOM 29435 H2 SOL 4777 43.850 15.820 78.760 1.00 0.00 ATOM 29436 OH2 SOL 4778 39.630 7.540 57.200 1.00 0.00 ATOM 29437 H1 SOL 4778 39.870 7.150 56.360 1.00 0.00 ATOM 29438 H2 SOL 4778 38.680 7.450 57.240 1.00 0.00 ATOM 29439 OH2 SOL 4779 43.170 25.170 13.400 1.00 0.00 ATOM 29440 H1 SOL 4779 43.160 25.920 12.800 1.00 0.00 ATOM 29441 H2 SOL 4779 42.590 25.420 14.110 1.00 0.00 ATOM 29442 OH2 SOL 4780 51.540 9.280 14.270 1.00 0.00 ATOM 29443 H1 SOL 4780 52.460 9.430 14.040 1.00 0.00 ATOM 29444 H2 SOL 4780 51.070 9.330 13.430 1.00 0.00 ATOM 29445 OH2 SOL 4781 55.350 11.290 2.500 1.00 0.00 ATOM 29446 H1 SOL 4781 56.180 10.850 2.310 1.00 0.00 ATOM 29447 H2 SOL 4781 54.710 10.580 2.540 1.00 0.00 ATOM 29448 OH2 SOL 4782 46.790 42.350 15.690 1.00 0.00 ATOM 29449 H1 SOL 4782 47.390 41.710 16.070 1.00 0.00 ATOM 29450 H2 SOL 4782 47.210 42.610 14.870 1.00 0.00 ATOM 29451 OH2 SOL 4783 35.180 34.880 22.540 1.00 0.00 ATOM 29452 H1 SOL 4783 34.400 34.750 22.000 1.00 0.00 ATOM 29453 H2 SOL 4783 34.930 35.580 23.150 1.00 0.00 ATOM 29454 OH2 SOL 4784 26.200 35.660 70.340 1.00 0.00 ATOM 29455 H1 SOL 4784 26.810 35.930 71.030 1.00 0.00 ATOM 29456 H2 SOL 4784 26.550 34.810 70.040 1.00 0.00 ATOM 29457 OH2 SOL 4785 0.720 -0.020 68.730 1.00 0.00 ATOM 29458 H1 SOL 4785 1.550 -0.340 68.370 1.00 0.00 ATOM 29459 H2 SOL 4785 0.840 0.930 68.780 1.00 0.00 ATOM 29460 OH2 SOL 4786 17.220 60.430 70.130 1.00 0.00 ATOM 29461 H1 SOL 4786 16.560 59.970 69.610 1.00 0.00 ATOM 29462 H2 SOL 4786 16.920 60.350 71.040 1.00 0.00 ATOM 29463 OH2 SOL 4787 40.490 16.450 78.440 1.00 0.00 ATOM 29464 H1 SOL 4787 41.250 16.160 77.930 1.00 0.00 ATOM 29465 H2 SOL 4787 40.860 16.720 79.280 1.00 0.00 ATOM 29466 OH2 SOL 4788 59.040 27.590 75.370 1.00 0.00 ATOM 29467 H1 SOL 4788 58.450 27.250 76.050 1.00 0.00 ATOM 29468 H2 SOL 4788 59.440 26.810 74.990 1.00 0.00 ATOM 29469 OH2 SOL 4789 45.380 1.200 61.740 1.00 0.00 ATOM 29470 H1 SOL 4789 46.210 1.420 62.160 1.00 0.00 ATOM 29471 H2 SOL 4789 45.230 1.920 61.120 1.00 0.00 ATOM 29472 OH2 SOL 4790 36.780 23.710 63.480 1.00 0.00 ATOM 29473 H1 SOL 4790 37.680 23.530 63.200 1.00 0.00 ATOM 29474 H2 SOL 4790 36.530 24.500 63.000 1.00 0.00 ATOM 29475 OH2 SOL 4791 43.330 12.120 72.450 1.00 0.00 ATOM 29476 H1 SOL 4791 42.530 12.260 72.960 1.00 0.00 ATOM 29477 H2 SOL 4791 43.030 11.660 71.660 1.00 0.00 ATOM 29478 OH2 SOL 4792 23.400 44.560 14.180 1.00 0.00 ATOM 29479 H1 SOL 4792 22.550 44.780 13.800 1.00 0.00 ATOM 29480 H2 SOL 4792 23.530 43.640 13.960 1.00 0.00 ATOM 29481 OH2 SOL 4793 23.740 23.590 82.750 1.00 0.00 ATOM 29482 H1 SOL 4793 24.270 24.380 82.750 1.00 0.00 ATOM 29483 H2 SOL 4793 22.920 23.860 83.170 1.00 0.00 ATOM 29484 OH2 SOL 4794 45.010 17.840 18.990 1.00 0.00 ATOM 29485 H1 SOL 4794 44.320 17.870 18.330 1.00 0.00 ATOM 29486 H2 SOL 4794 44.610 17.420 19.750 1.00 0.00 ATOM 29487 OH2 SOL 4795 8.220 7.450 25.500 1.00 0.00 ATOM 29488 H1 SOL 4795 8.800 6.710 25.290 1.00 0.00 ATOM 29489 H2 SOL 4795 7.460 7.050 25.910 1.00 0.00 ATOM 29490 OH2 SOL 4796 51.930 23.290 75.120 1.00 0.00 ATOM 29491 H1 SOL 4796 51.780 22.630 74.440 1.00 0.00 ATOM 29492 H2 SOL 4796 52.050 22.780 75.920 1.00 0.00 ATOM 29493 OH2 SOL 4797 41.570 2.230 65.390 1.00 0.00 ATOM 29494 H1 SOL 4797 41.770 1.310 65.560 1.00 0.00 ATOM 29495 H2 SOL 4797 40.990 2.220 64.640 1.00 0.00 ATOM 29496 OH2 SOL 4798 26.690 22.550 69.130 1.00 0.00 ATOM 29497 H1 SOL 4798 27.460 23.050 68.860 1.00 0.00 ATOM 29498 H2 SOL 4798 26.250 22.330 68.320 1.00 0.00 ATOM 29499 OH2 SOL 4799 9.600 22.630 9.620 1.00 0.00 ATOM 29500 H1 SOL 4799 10.230 22.480 8.920 1.00 0.00 ATOM 29501 H2 SOL 4799 8.760 22.330 9.270 1.00 0.00 ATOM 29502 OH2 SOL 4800 11.840 12.520 18.150 1.00 0.00 ATOM 29503 H1 SOL 4800 11.390 13.340 18.360 1.00 0.00 ATOM 29504 H2 SOL 4800 11.390 11.860 18.690 1.00 0.00 ATOM 29505 OH2 SOL 4801 43.230 55.270 24.830 1.00 0.00 ATOM 29506 H1 SOL 4801 43.190 54.490 24.270 1.00 0.00 ATOM 29507 H2 SOL 4801 42.400 55.720 24.660 1.00 0.00 ATOM 29508 OH2 SOL 4802 24.850 50.370 10.870 1.00 0.00 ATOM 29509 H1 SOL 4802 24.820 50.400 9.910 1.00 0.00 ATOM 29510 H2 SOL 4802 25.730 50.670 11.100 1.00 0.00 ATOM 29511 OH2 SOL 4803 52.940 18.290 79.200 1.00 0.00 ATOM 29512 H1 SOL 4803 53.390 17.470 79.390 1.00 0.00 ATOM 29513 H2 SOL 4803 52.410 18.100 78.430 1.00 0.00 ATOM 29514 OH2 SOL 4804 52.470 40.840 79.670 1.00 0.00 ATOM 29515 H1 SOL 4804 52.160 40.060 80.130 1.00 0.00 ATOM 29516 H2 SOL 4804 53.330 41.020 80.060 1.00 0.00 ATOM 29517 OH2 SOL 4805 44.280 15.750 14.900 1.00 0.00 ATOM 29518 H1 SOL 4805 44.860 15.030 15.160 1.00 0.00 ATOM 29519 H2 SOL 4805 44.800 16.260 14.280 1.00 0.00 ATOM 29520 OH2 SOL 4806 49.110 3.550 23.670 1.00 0.00 ATOM 29521 H1 SOL 4806 49.280 3.160 24.530 1.00 0.00 ATOM 29522 H2 SOL 4806 48.570 4.320 23.860 1.00 0.00 ATOM 29523 OH2 SOL 4807 1.630 51.930 15.830 1.00 0.00 ATOM 29524 H1 SOL 4807 2.590 51.880 15.730 1.00 0.00 ATOM 29525 H2 SOL 4807 1.490 52.630 16.470 1.00 0.00 ATOM 29526 OH2 SOL 4808 18.570 27.710 70.830 1.00 0.00 ATOM 29527 H1 SOL 4808 18.360 27.710 69.900 1.00 0.00 ATOM 29528 H2 SOL 4808 17.960 27.080 71.220 1.00 0.00 ATOM 29529 OH2 SOL 4809 0.600 30.000 77.870 1.00 0.00 ATOM 29530 H1 SOL 4809 -0.230 29.690 78.220 1.00 0.00 ATOM 29531 H2 SOL 4809 0.620 29.690 76.970 1.00 0.00 ATOM 29532 OH2 SOL 4810 12.360 16.110 13.700 1.00 0.00 ATOM 29533 H1 SOL 4810 12.560 15.250 13.340 1.00 0.00 ATOM 29534 H2 SOL 4810 11.480 16.010 14.080 1.00 0.00 ATOM 29535 OH2 SOL 4811 3.930 53.610 80.610 1.00 0.00 ATOM 29536 H1 SOL 4811 4.310 54.480 80.720 1.00 0.00 ATOM 29537 H2 SOL 4811 4.220 53.120 81.380 1.00 0.00 ATOM 29538 OH2 SOL 4812 38.630 47.940 22.520 1.00 0.00 ATOM 29539 H1 SOL 4812 38.700 47.040 22.230 1.00 0.00 ATOM 29540 H2 SOL 4812 38.980 47.930 23.420 1.00 0.00 ATOM 29541 OH2 SOL 4813 6.130 52.100 73.680 1.00 0.00 ATOM 29542 H1 SOL 4813 5.580 51.380 73.980 1.00 0.00 ATOM 29543 H2 SOL 4813 6.130 52.720 74.400 1.00 0.00 ATOM 29544 OH2 SOL 4814 35.430 9.740 78.760 1.00 0.00 ATOM 29545 H1 SOL 4814 34.660 9.380 78.310 1.00 0.00 ATOM 29546 H2 SOL 4814 36.100 9.070 78.650 1.00 0.00 ATOM 29547 OH2 SOL 4815 45.610 0.980 70.880 1.00 0.00 ATOM 29548 H1 SOL 4815 45.760 1.400 70.030 1.00 0.00 ATOM 29549 H2 SOL 4815 46.440 1.100 71.350 1.00 0.00 ATOM 29550 OH2 SOL 4816 49.640 44.680 8.020 1.00 0.00 ATOM 29551 H1 SOL 4816 49.900 43.760 7.940 1.00 0.00 ATOM 29552 H2 SOL 4816 50.300 45.160 7.520 1.00 0.00 ATOM 29553 OH2 SOL 4817 17.970 0.790 67.560 1.00 0.00 ATOM 29554 H1 SOL 4817 17.960 0.680 68.510 1.00 0.00 ATOM 29555 H2 SOL 4817 17.250 0.240 67.250 1.00 0.00 ATOM 29556 OH2 SOL 4818 5.070 3.370 0.110 1.00 0.00 ATOM 29557 H1 SOL 4818 5.420 3.740 0.920 1.00 0.00 ATOM 29558 H2 SOL 4818 4.120 3.340 0.260 1.00 0.00 ATOM 29559 OH2 SOL 4819 38.650 37.560 81.150 1.00 0.00 ATOM 29560 H1 SOL 4819 37.900 37.970 80.710 1.00 0.00 ATOM 29561 H2 SOL 4819 38.600 36.640 80.910 1.00 0.00 ATOM 29562 OH2 SOL 4820 48.180 25.370 17.770 1.00 0.00 ATOM 29563 H1 SOL 4820 48.060 25.220 16.840 1.00 0.00 ATOM 29564 H2 SOL 4820 49.070 25.720 17.850 1.00 0.00 ATOM 29565 OH2 SOL 4821 50.850 32.350 6.930 1.00 0.00 ATOM 29566 H1 SOL 4821 50.290 32.400 7.710 1.00 0.00 ATOM 29567 H2 SOL 4821 50.860 33.240 6.590 1.00 0.00 ATOM 29568 OH2 SOL 4822 43.250 28.750 74.720 1.00 0.00 ATOM 29569 H1 SOL 4822 42.570 29.360 75.000 1.00 0.00 ATOM 29570 H2 SOL 4822 43.290 28.860 73.770 1.00 0.00 ATOM 29571 OH2 SOL 4823 27.870 50.660 71.300 1.00 0.00 ATOM 29572 H1 SOL 4823 27.330 51.420 71.110 1.00 0.00 ATOM 29573 H2 SOL 4823 27.930 50.200 70.470 1.00 0.00 ATOM 29574 OH2 SOL 4824 15.780 17.950 11.570 1.00 0.00 ATOM 29575 H1 SOL 4824 15.110 17.350 11.870 1.00 0.00 ATOM 29576 H2 SOL 4824 15.910 17.740 10.640 1.00 0.00 ATOM 29577 OH2 SOL 4825 22.390 21.030 14.680 1.00 0.00 ATOM 29578 H1 SOL 4825 22.130 21.840 15.110 1.00 0.00 ATOM 29579 H2 SOL 4825 21.570 20.620 14.410 1.00 0.00 ATOM 29580 OH2 SOL 4826 50.800 44.580 17.040 1.00 0.00 ATOM 29581 H1 SOL 4826 51.680 44.810 16.730 1.00 0.00 ATOM 29582 H2 SOL 4826 50.710 45.050 17.870 1.00 0.00 ATOM 29583 OH2 SOL 4827 37.890 59.410 76.310 1.00 0.00 ATOM 29584 H1 SOL 4827 37.130 59.440 76.890 1.00 0.00 ATOM 29585 H2 SOL 4827 38.190 60.310 76.260 1.00 0.00 ATOM 29586 OH2 SOL 4828 35.010 2.670 8.420 1.00 0.00 ATOM 29587 H1 SOL 4828 34.870 1.890 7.890 1.00 0.00 ATOM 29588 H2 SOL 4828 34.540 2.500 9.240 1.00 0.00 ATOM 29589 OH2 SOL 4829 29.300 2.850 65.830 1.00 0.00 ATOM 29590 H1 SOL 4829 28.820 3.330 65.150 1.00 0.00 ATOM 29591 H2 SOL 4829 29.090 1.930 65.660 1.00 0.00 ATOM 29592 OH2 SOL 4830 6.510 37.330 3.630 1.00 0.00 ATOM 29593 H1 SOL 4830 7.370 37.380 4.040 1.00 0.00 ATOM 29594 H2 SOL 4830 6.490 38.060 3.010 1.00 0.00 ATOM 29595 OH2 SOL 4831 37.880 43.450 72.470 1.00 0.00 ATOM 29596 H1 SOL 4831 38.510 44.160 72.330 1.00 0.00 ATOM 29597 H2 SOL 4831 37.410 43.710 73.260 1.00 0.00 ATOM 29598 OH2 SOL 4832 51.280 8.920 62.890 1.00 0.00 ATOM 29599 H1 SOL 4832 51.370 9.340 63.750 1.00 0.00 ATOM 29600 H2 SOL 4832 50.430 8.480 62.930 1.00 0.00 ATOM 29601 OH2 SOL 4833 35.060 27.220 20.630 1.00 0.00 ATOM 29602 H1 SOL 4833 34.490 26.490 20.890 1.00 0.00 ATOM 29603 H2 SOL 4833 34.750 27.470 19.760 1.00 0.00 ATOM 29604 OH2 SOL 4834 56.610 34.220 59.970 1.00 0.00 ATOM 29605 H1 SOL 4834 56.570 33.290 59.790 1.00 0.00 ATOM 29606 H2 SOL 4834 55.790 34.570 59.630 1.00 0.00 ATOM 29607 OH2 SOL 4835 6.930 10.450 18.620 1.00 0.00 ATOM 29608 H1 SOL 4835 6.210 10.850 19.120 1.00 0.00 ATOM 29609 H2 SOL 4835 7.260 9.760 19.190 1.00 0.00 ATOM 29610 OH2 SOL 4836 50.990 56.740 83.130 1.00 0.00 ATOM 29611 H1 SOL 4836 50.410 57.390 82.750 1.00 0.00 ATOM 29612 H2 SOL 4836 51.870 57.000 82.830 1.00 0.00 ATOM 29613 OH2 SOL 4837 14.930 58.160 5.950 1.00 0.00 ATOM 29614 H1 SOL 4837 15.720 58.350 5.430 1.00 0.00 ATOM 29615 H2 SOL 4837 14.880 58.890 6.570 1.00 0.00 ATOM 29616 OH2 SOL 4838 55.630 11.180 76.960 1.00 0.00 ATOM 29617 H1 SOL 4838 55.320 10.820 76.130 1.00 0.00 ATOM 29618 H2 SOL 4838 56.560 10.980 76.970 1.00 0.00 ATOM 29619 OH2 SOL 4839 3.520 54.330 6.410 1.00 0.00 ATOM 29620 H1 SOL 4839 2.630 54.580 6.670 1.00 0.00 ATOM 29621 H2 SOL 4839 3.780 53.670 7.060 1.00 0.00 ATOM 29622 OH2 SOL 4840 17.900 32.810 75.700 1.00 0.00 ATOM 29623 H1 SOL 4840 18.620 33.440 75.630 1.00 0.00 ATOM 29624 H2 SOL 4840 18.320 32.000 75.990 1.00 0.00 ATOM 29625 OH2 SOL 4841 37.110 55.210 81.570 1.00 0.00 ATOM 29626 H1 SOL 4841 37.470 54.350 81.790 1.00 0.00 ATOM 29627 H2 SOL 4841 37.580 55.820 82.140 1.00 0.00 ATOM 29628 OH2 SOL 4842 18.930 46.610 15.090 1.00 0.00 ATOM 29629 H1 SOL 4842 18.880 47.440 14.620 1.00 0.00 ATOM 29630 H2 SOL 4842 19.540 46.770 15.810 1.00 0.00 ATOM 29631 OH2 SOL 4843 17.180 18.500 19.790 1.00 0.00 ATOM 29632 H1 SOL 4843 17.920 18.530 20.400 1.00 0.00 ATOM 29633 H2 SOL 4843 17.420 19.120 19.100 1.00 0.00 ATOM 29634 OH2 SOL 4844 55.490 5.100 14.740 1.00 0.00 ATOM 29635 H1 SOL 4844 54.760 4.650 15.170 1.00 0.00 ATOM 29636 H2 SOL 4844 56.110 4.400 14.530 1.00 0.00 ATOM 29637 OH2 SOL 4845 6.010 40.670 78.270 1.00 0.00 ATOM 29638 H1 SOL 4845 6.750 40.360 78.790 1.00 0.00 ATOM 29639 H2 SOL 4845 5.310 40.040 78.450 1.00 0.00 ATOM 29640 OH2 SOL 4846 45.290 35.860 3.450 1.00 0.00 ATOM 29641 H1 SOL 4846 45.670 35.570 4.270 1.00 0.00 ATOM 29642 H2 SOL 4846 45.640 35.250 2.800 1.00 0.00 ATOM 29643 OH2 SOL 4847 44.800 32.360 80.750 1.00 0.00 ATOM 29644 H1 SOL 4847 44.230 31.840 80.180 1.00 0.00 ATOM 29645 H2 SOL 4847 45.390 32.820 80.150 1.00 0.00 ATOM 29646 OH2 SOL 4848 52.440 39.150 12.620 1.00 0.00 ATOM 29647 H1 SOL 4848 52.440 39.520 13.500 1.00 0.00 ATOM 29648 H2 SOL 4848 53.160 39.600 12.180 1.00 0.00 ATOM 29649 OH2 SOL 4849 9.930 55.110 4.040 1.00 0.00 ATOM 29650 H1 SOL 4849 10.320 55.520 3.270 1.00 0.00 ATOM 29651 H2 SOL 4849 10.570 55.250 4.740 1.00 0.00 ATOM 29652 OH2 SOL 4850 43.520 15.120 23.680 1.00 0.00 ATOM 29653 H1 SOL 4850 44.150 15.540 24.270 1.00 0.00 ATOM 29654 H2 SOL 4850 43.160 14.390 24.180 1.00 0.00 ATOM 29655 OH2 SOL 4851 50.380 51.950 83.710 1.00 0.00 ATOM 29656 H1 SOL 4851 49.770 52.490 84.210 1.00 0.00 ATOM 29657 H2 SOL 4851 50.970 51.580 84.360 1.00 0.00 ATOM 29658 OH2 SOL 4852 15.880 38.520 81.390 1.00 0.00 ATOM 29659 H1 SOL 4852 16.360 37.990 80.760 1.00 0.00 ATOM 29660 H2 SOL 4852 15.140 38.870 80.900 1.00 0.00 ATOM 29661 OH2 SOL 4853 56.380 60.740 84.660 1.00 0.00 ATOM 29662 H1 SOL 4853 56.970 60.550 83.920 1.00 0.00 ATOM 29663 H2 SOL 4853 56.160 59.870 85.010 1.00 0.00 ATOM 29664 OH2 SOL 4854 13.850 15.670 4.190 1.00 0.00 ATOM 29665 H1 SOL 4854 13.130 15.990 4.730 1.00 0.00 ATOM 29666 H2 SOL 4854 14.110 16.430 3.670 1.00 0.00 ATOM 29667 OH2 SOL 4855 51.520 58.090 10.630 1.00 0.00 ATOM 29668 H1 SOL 4855 50.680 57.840 10.260 1.00 0.00 ATOM 29669 H2 SOL 4855 52.120 57.390 10.360 1.00 0.00 ATOM 29670 OH2 SOL 4856 41.090 5.220 13.590 1.00 0.00 ATOM 29671 H1 SOL 4856 40.160 5.240 13.830 1.00 0.00 ATOM 29672 H2 SOL 4856 41.490 4.650 14.240 1.00 0.00 ATOM 29673 OH2 SOL 4857 52.360 28.590 68.600 1.00 0.00 ATOM 29674 H1 SOL 4857 53.070 28.040 68.930 1.00 0.00 ATOM 29675 H2 SOL 4857 51.690 28.560 69.280 1.00 0.00 ATOM 29676 OH2 SOL 4858 50.220 18.380 13.920 1.00 0.00 ATOM 29677 H1 SOL 4858 51.080 18.050 13.640 1.00 0.00 ATOM 29678 H2 SOL 4858 49.830 17.650 14.390 1.00 0.00 ATOM 29679 OH2 SOL 4859 25.080 32.790 80.260 1.00 0.00 ATOM 29680 H1 SOL 4859 25.500 33.600 79.980 1.00 0.00 ATOM 29681 H2 SOL 4859 25.800 32.240 80.580 1.00 0.00 ATOM 29682 OH2 SOL 4860 54.290 12.290 19.250 1.00 0.00 ATOM 29683 H1 SOL 4860 53.820 12.090 18.450 1.00 0.00 ATOM 29684 H2 SOL 4860 54.750 11.480 19.470 1.00 0.00 ATOM 29685 OH2 SOL 4861 38.130 40.510 78.720 1.00 0.00 ATOM 29686 H1 SOL 4861 37.460 39.850 78.540 1.00 0.00 ATOM 29687 H2 SOL 4861 38.780 40.370 78.030 1.00 0.00 ATOM 29688 OH2 SOL 4862 8.120 6.740 78.830 1.00 0.00 ATOM 29689 H1 SOL 4862 7.350 7.190 78.510 1.00 0.00 ATOM 29690 H2 SOL 4862 8.150 6.940 79.770 1.00 0.00 ATOM 29691 OH2 SOL 4863 39.680 3.370 79.600 1.00 0.00 ATOM 29692 H1 SOL 4863 39.030 3.160 80.280 1.00 0.00 ATOM 29693 H2 SOL 4863 39.620 2.640 78.980 1.00 0.00 ATOM 29694 OH2 SOL 4864 54.990 50.410 11.330 1.00 0.00 ATOM 29695 H1 SOL 4864 55.830 50.730 11.020 1.00 0.00 ATOM 29696 H2 SOL 4864 55.190 49.930 12.140 1.00 0.00 ATOM 29697 OH2 SOL 4865 48.920 29.750 75.570 1.00 0.00 ATOM 29698 H1 SOL 4865 49.350 30.510 75.970 1.00 0.00 ATOM 29699 H2 SOL 4865 47.980 29.950 75.630 1.00 0.00 ATOM 29700 OH2 SOL 4866 3.610 46.940 16.120 1.00 0.00 ATOM 29701 H1 SOL 4866 3.950 46.150 15.720 1.00 0.00 ATOM 29702 H2 SOL 4866 3.480 47.550 15.390 1.00 0.00 ATOM 29703 OH2 SOL 4867 5.440 44.410 72.720 1.00 0.00 ATOM 29704 H1 SOL 4867 4.810 44.630 72.040 1.00 0.00 ATOM 29705 H2 SOL 4867 4.970 43.810 73.290 1.00 0.00 ATOM 29706 OH2 SOL 4868 41.600 36.950 83.180 1.00 0.00 ATOM 29707 H1 SOL 4868 40.940 37.250 82.550 1.00 0.00 ATOM 29708 H2 SOL 4868 41.090 36.570 83.900 1.00 0.00 ATOM 29709 OH2 SOL 4869 45.190 49.490 71.900 1.00 0.00 ATOM 29710 H1 SOL 4869 44.710 49.840 72.650 1.00 0.00 ATOM 29711 H2 SOL 4869 46.060 49.290 72.250 1.00 0.00 ATOM 29712 OH2 SOL 4870 30.490 60.070 15.140 1.00 0.00 ATOM 29713 H1 SOL 4870 30.000 60.610 14.520 1.00 0.00 ATOM 29714 H2 SOL 4870 30.800 60.680 15.810 1.00 0.00 ATOM 29715 OH2 SOL 4871 12.600 31.910 74.140 1.00 0.00 ATOM 29716 H1 SOL 4871 11.960 31.250 74.410 1.00 0.00 ATOM 29717 H2 SOL 4871 12.080 32.710 74.010 1.00 0.00 ATOM 29718 OH2 SOL 4872 4.550 8.240 5.900 1.00 0.00 ATOM 29719 H1 SOL 4872 4.780 7.510 6.470 1.00 0.00 ATOM 29720 H2 SOL 4872 5.390 8.660 5.700 1.00 0.00 ATOM 29721 OH2 SOL 4873 39.780 3.680 72.150 1.00 0.00 ATOM 29722 H1 SOL 4873 39.520 4.230 71.420 1.00 0.00 ATOM 29723 H2 SOL 4873 40.690 3.940 72.340 1.00 0.00 ATOM 29724 OH2 SOL 4874 40.430 52.050 20.500 1.00 0.00 ATOM 29725 H1 SOL 4874 40.460 51.880 19.560 1.00 0.00 ATOM 29726 H2 SOL 4874 39.750 51.460 20.830 1.00 0.00 ATOM 29727 OH2 SOL 4875 0.850 16.450 69.450 1.00 0.00 ATOM 29728 H1 SOL 4875 1.270 15.700 69.030 1.00 0.00 ATOM 29729 H2 SOL 4875 1.120 17.200 68.930 1.00 0.00 ATOM 29730 OH2 SOL 4876 4.330 55.140 65.110 1.00 0.00 ATOM 29731 H1 SOL 4876 4.500 54.290 64.700 1.00 0.00 ATOM 29732 H2 SOL 4876 3.950 55.670 64.410 1.00 0.00 ATOM 29733 OH2 SOL 4877 49.990 25.080 3.950 1.00 0.00 ATOM 29734 H1 SOL 4877 50.310 25.390 4.800 1.00 0.00 ATOM 29735 H2 SOL 4877 50.580 24.360 3.730 1.00 0.00 ATOM 29736 OH2 SOL 4878 34.400 20.250 63.110 1.00 0.00 ATOM 29737 H1 SOL 4878 33.660 19.730 62.790 1.00 0.00 ATOM 29738 H2 SOL 4878 34.780 20.640 62.320 1.00 0.00 ATOM 29739 OH2 SOL 4879 17.270 52.700 80.190 1.00 0.00 ATOM 29740 H1 SOL 4879 16.910 53.510 79.830 1.00 0.00 ATOM 29741 H2 SOL 4879 16.950 52.680 81.090 1.00 0.00 ATOM 29742 OH2 SOL 4880 18.520 24.050 10.800 1.00 0.00 ATOM 29743 H1 SOL 4880 19.120 24.070 10.060 1.00 0.00 ATOM 29744 H2 SOL 4880 17.700 23.710 10.440 1.00 0.00 ATOM 29745 OH2 SOL 4881 4.550 47.360 83.760 1.00 0.00 ATOM 29746 H1 SOL 4881 4.420 47.460 82.820 1.00 0.00 ATOM 29747 H2 SOL 4881 4.760 46.430 83.880 1.00 0.00 ATOM 29748 OH2 SOL 4882 42.740 20.920 81.510 1.00 0.00 ATOM 29749 H1 SOL 4882 42.830 19.980 81.660 1.00 0.00 ATOM 29750 H2 SOL 4882 41.800 21.060 81.380 1.00 0.00 ATOM 29751 OH2 SOL 4883 48.100 12.380 13.140 1.00 0.00 ATOM 29752 H1 SOL 4883 47.910 13.050 12.470 1.00 0.00 ATOM 29753 H2 SOL 4883 48.950 12.020 12.880 1.00 0.00 ATOM 29754 OH2 SOL 4884 30.150 36.820 0.240 1.00 0.00 ATOM 29755 H1 SOL 4884 30.700 37.100 -0.490 1.00 0.00 ATOM 29756 H2 SOL 4884 30.750 36.370 0.840 1.00 0.00 ATOM 29757 OH2 SOL 4885 24.520 17.460 74.950 1.00 0.00 ATOM 29758 H1 SOL 4885 24.100 17.310 74.100 1.00 0.00 ATOM 29759 H2 SOL 4885 23.830 17.820 75.500 1.00 0.00 ATOM 29760 OH2 SOL 4886 28.290 14.330 13.790 1.00 0.00 ATOM 29761 H1 SOL 4886 28.410 13.860 12.970 1.00 0.00 ATOM 29762 H2 SOL 4886 27.430 14.740 13.710 1.00 0.00 ATOM 29763 OH2 SOL 4887 30.280 42.600 7.220 1.00 0.00 ATOM 29764 H1 SOL 4887 29.570 42.760 6.600 1.00 0.00 ATOM 29765 H2 SOL 4887 30.550 41.700 7.050 1.00 0.00 ATOM 29766 OH2 SOL 4888 36.610 7.710 4.540 1.00 0.00 ATOM 29767 H1 SOL 4888 36.790 8.270 3.780 1.00 0.00 ATOM 29768 H2 SOL 4888 35.910 7.130 4.240 1.00 0.00 ATOM 29769 OH2 SOL 4889 7.560 1.660 4.180 1.00 0.00 ATOM 29770 H1 SOL 4889 7.490 1.480 5.120 1.00 0.00 ATOM 29771 H2 SOL 4889 6.730 1.340 3.810 1.00 0.00 ATOM 29772 OH2 SOL 4890 18.900 17.540 82.150 1.00 0.00 ATOM 29773 H1 SOL 4890 19.590 16.890 82.010 1.00 0.00 ATOM 29774 H2 SOL 4890 18.110 17.120 81.820 1.00 0.00 ATOM 29775 OH2 SOL 4891 36.390 29.640 65.480 1.00 0.00 ATOM 29776 H1 SOL 4891 36.560 30.210 64.720 1.00 0.00 ATOM 29777 H2 SOL 4891 36.170 28.790 65.100 1.00 0.00 ATOM 29778 OH2 SOL 4892 35.750 13.290 5.240 1.00 0.00 ATOM 29779 H1 SOL 4892 35.050 13.500 5.860 1.00 0.00 ATOM 29780 H2 SOL 4892 36.560 13.490 5.710 1.00 0.00 ATOM 29781 OH2 SOL 4893 1.080 26.050 74.100 1.00 0.00 ATOM 29782 H1 SOL 4893 1.670 25.330 73.890 1.00 0.00 ATOM 29783 H2 SOL 4893 1.430 26.800 73.610 1.00 0.00 ATOM 29784 OH2 SOL 4894 38.860 53.050 82.360 1.00 0.00 ATOM 29785 H1 SOL 4894 39.760 53.310 82.570 1.00 0.00 ATOM 29786 H2 SOL 4894 38.760 52.190 82.770 1.00 0.00 ATOM 29787 OH2 SOL 4895 51.590 50.270 13.780 1.00 0.00 ATOM 29788 H1 SOL 4895 51.620 51.090 13.280 1.00 0.00 ATOM 29789 H2 SOL 4895 52.310 49.740 13.420 1.00 0.00 ATOM 29790 OH2 SOL 4896 16.230 39.620 17.530 1.00 0.00 ATOM 29791 H1 SOL 4896 15.900 40.310 16.960 1.00 0.00 ATOM 29792 H2 SOL 4896 15.790 38.830 17.230 1.00 0.00 ATOM 29793 OH2 SOL 4897 55.850 54.820 77.740 1.00 0.00 ATOM 29794 H1 SOL 4897 55.230 54.260 77.270 1.00 0.00 ATOM 29795 H2 SOL 4897 56.510 55.050 77.090 1.00 0.00 ATOM 29796 OH2 SOL 4898 25.830 3.890 13.750 1.00 0.00 ATOM 29797 H1 SOL 4898 26.240 3.030 13.850 1.00 0.00 ATOM 29798 H2 SOL 4898 25.550 3.910 12.830 1.00 0.00 ATOM 29799 OH2 SOL 4899 57.640 2.680 21.170 1.00 0.00 ATOM 29800 H1 SOL 4899 58.100 1.950 21.580 1.00 0.00 ATOM 29801 H2 SOL 4899 56.710 2.510 21.330 1.00 0.00 ATOM 29802 OH2 SOL 4900 50.620 6.820 67.020 1.00 0.00 ATOM 29803 H1 SOL 4900 50.110 7.470 66.530 1.00 0.00 ATOM 29804 H2 SOL 4900 50.340 5.980 66.680 1.00 0.00 ATOM 29805 OH2 SOL 4901 39.070 29.600 65.590 1.00 0.00 ATOM 29806 H1 SOL 4901 38.220 29.590 66.020 1.00 0.00 ATOM 29807 H2 SOL 4901 38.920 30.110 64.790 1.00 0.00 ATOM 29808 OH2 SOL 4902 26.130 53.760 69.190 1.00 0.00 ATOM 29809 H1 SOL 4902 25.780 53.000 69.650 1.00 0.00 ATOM 29810 H2 SOL 4902 25.570 54.490 69.460 1.00 0.00 ATOM 29811 OH2 SOL 4903 47.620 59.590 0.610 1.00 0.00 ATOM 29812 H1 SOL 4903 47.080 58.960 0.120 1.00 0.00 ATOM 29813 H2 SOL 4903 46.990 60.190 1.010 1.00 0.00 ATOM 29814 OH2 SOL 4904 34.460 14.250 66.160 1.00 0.00 ATOM 29815 H1 SOL 4904 34.110 13.390 65.940 1.00 0.00 ATOM 29816 H2 SOL 4904 33.700 14.750 66.460 1.00 0.00 ATOM 29817 OH2 SOL 4905 52.300 33.780 9.460 1.00 0.00 ATOM 29818 H1 SOL 4905 53.180 33.890 9.090 1.00 0.00 ATOM 29819 H2 SOL 4905 52.450 33.690 10.400 1.00 0.00 ATOM 29820 OH2 SOL 4906 52.860 36.580 13.480 1.00 0.00 ATOM 29821 H1 SOL 4906 52.490 37.210 12.870 1.00 0.00 ATOM 29822 H2 SOL 4906 53.800 36.580 13.290 1.00 0.00 ATOM 29823 OH2 SOL 4907 53.520 21.920 7.820 1.00 0.00 ATOM 29824 H1 SOL 4907 53.770 22.000 8.740 1.00 0.00 ATOM 29825 H2 SOL 4907 52.690 21.450 7.840 1.00 0.00 ATOM 29826 OH2 SOL 4908 10.260 0.230 75.180 1.00 0.00 ATOM 29827 H1 SOL 4908 9.640 0.580 75.820 1.00 0.00 ATOM 29828 H2 SOL 4908 10.210 0.840 74.450 1.00 0.00 ATOM 29829 OH2 SOL 4909 4.610 5.220 16.940 1.00 0.00 ATOM 29830 H1 SOL 4909 4.850 5.720 17.720 1.00 0.00 ATOM 29831 H2 SOL 4909 5.310 5.400 16.310 1.00 0.00 ATOM 29832 OH2 SOL 4910 53.920 3.960 82.750 1.00 0.00 ATOM 29833 H1 SOL 4910 53.360 3.190 82.830 1.00 0.00 ATOM 29834 H2 SOL 4910 53.330 4.670 82.510 1.00 0.00 ATOM 29835 OH2 SOL 4911 54.130 7.060 12.860 1.00 0.00 ATOM 29836 H1 SOL 4911 54.000 7.850 13.390 1.00 0.00 ATOM 29837 H2 SOL 4911 54.560 6.440 13.450 1.00 0.00 ATOM 29838 OH2 SOL 4912 56.370 34.740 70.470 1.00 0.00 ATOM 29839 H1 SOL 4912 56.800 35.440 70.970 1.00 0.00 ATOM 29840 H2 SOL 4912 57.070 34.360 69.940 1.00 0.00 ATOM 29841 OH2 SOL 4913 58.790 37.910 82.150 1.00 0.00 ATOM 29842 H1 SOL 4913 59.500 38.320 82.640 1.00 0.00 ATOM 29843 H2 SOL 4913 58.150 38.600 82.020 1.00 0.00 ATOM 29844 OH2 SOL 4914 39.400 42.460 65.990 1.00 0.00 ATOM 29845 H1 SOL 4914 40.340 42.300 65.870 1.00 0.00 ATOM 29846 H2 SOL 4914 39.120 41.780 66.600 1.00 0.00 ATOM 29847 OH2 SOL 4915 47.450 9.930 79.350 1.00 0.00 ATOM 29848 H1 SOL 4915 47.280 10.210 78.450 1.00 0.00 ATOM 29849 H2 SOL 4915 48.370 10.150 79.500 1.00 0.00 ATOM 29850 OH2 SOL 4916 18.410 21.040 10.730 1.00 0.00 ATOM 29851 H1 SOL 4916 18.340 20.150 11.080 1.00 0.00 ATOM 29852 H2 SOL 4916 19.330 21.280 10.870 1.00 0.00 ATOM 29853 OH2 SOL 4917 26.240 10.870 9.390 1.00 0.00 ATOM 29854 H1 SOL 4917 25.970 10.290 10.100 1.00 0.00 ATOM 29855 H2 SOL 4917 26.970 10.420 8.960 1.00 0.00 ATOM 29856 OH2 SOL 4918 13.350 51.770 84.270 1.00 0.00 ATOM 29857 H1 SOL 4918 12.420 51.600 84.440 1.00 0.00 ATOM 29858 H2 SOL 4918 13.390 52.690 84.010 1.00 0.00 ATOM 29859 OH2 SOL 4919 25.770 55.400 66.160 1.00 0.00 ATOM 29860 H1 SOL 4919 25.410 54.530 66.000 1.00 0.00 ATOM 29861 H2 SOL 4919 25.410 55.660 67.010 1.00 0.00 ATOM 29862 OH2 SOL 4920 58.870 52.470 64.120 1.00 0.00 ATOM 29863 H1 SOL 4920 58.220 51.770 64.050 1.00 0.00 ATOM 29864 H2 SOL 4920 59.710 52.020 64.070 1.00 0.00 ATOM 29865 OH2 SOL 4921 51.850 46.990 1.870 1.00 0.00 ATOM 29866 H1 SOL 4921 52.350 46.200 1.690 1.00 0.00 ATOM 29867 H2 SOL 4921 51.710 47.390 1.010 1.00 0.00 ATOM 29868 OH2 SOL 4922 28.880 7.640 82.900 1.00 0.00 ATOM 29869 H1 SOL 4922 28.790 7.970 82.000 1.00 0.00 ATOM 29870 H2 SOL 4922 27.990 7.450 83.180 1.00 0.00 ATOM 29871 OH2 SOL 4923 54.620 9.880 16.510 1.00 0.00 ATOM 29872 H1 SOL 4923 53.890 10.470 16.330 1.00 0.00 ATOM 29873 H2 SOL 4923 55.220 10.010 15.770 1.00 0.00 ATOM 29874 OH2 SOL 4924 32.750 22.630 60.460 1.00 0.00 ATOM 29875 H1 SOL 4924 33.580 22.630 59.970 1.00 0.00 ATOM 29876 H2 SOL 4924 32.240 23.340 60.070 1.00 0.00 ATOM 29877 OH2 SOL 4925 4.550 27.220 23.790 1.00 0.00 ATOM 29878 H1 SOL 4925 4.940 27.710 24.510 1.00 0.00 ATOM 29879 H2 SOL 4925 4.540 26.320 24.100 1.00 0.00 ATOM 29880 OH2 SOL 4926 26.860 51.970 5.680 1.00 0.00 ATOM 29881 H1 SOL 4926 27.260 52.290 4.870 1.00 0.00 ATOM 29882 H2 SOL 4926 26.220 51.320 5.390 1.00 0.00 ATOM 29883 OH2 SOL 4927 49.060 3.150 21.030 1.00 0.00 ATOM 29884 H1 SOL 4927 49.150 3.210 21.990 1.00 0.00 ATOM 29885 H2 SOL 4927 49.060 4.060 20.740 1.00 0.00 ATOM 29886 OH2 SOL 4928 58.900 10.040 73.820 1.00 0.00 ATOM 29887 H1 SOL 4928 58.480 9.220 74.060 1.00 0.00 ATOM 29888 H2 SOL 4928 58.230 10.710 73.970 1.00 0.00 ATOM 29889 OH2 SOL 4929 21.380 35.070 10.160 1.00 0.00 ATOM 29890 H1 SOL 4929 22.210 35.310 10.560 1.00 0.00 ATOM 29891 H2 SOL 4929 20.970 35.910 9.930 1.00 0.00 ATOM 29892 OH2 SOL 4930 59.170 42.290 82.040 1.00 0.00 ATOM 29893 H1 SOL 4930 58.800 43.150 82.240 1.00 0.00 ATOM 29894 H2 SOL 4930 60.060 42.330 82.410 1.00 0.00 ATOM 29895 OH2 SOL 4931 50.530 17.430 24.190 1.00 0.00 ATOM 29896 H1 SOL 4931 50.270 16.620 24.630 1.00 0.00 ATOM 29897 H2 SOL 4931 51.470 17.490 24.310 1.00 0.00 ATOM 29898 OH2 SOL 4932 13.770 56.980 0.960 1.00 0.00 ATOM 29899 H1 SOL 4932 13.410 56.770 0.100 1.00 0.00 ATOM 29900 H2 SOL 4932 14.670 56.640 0.940 1.00 0.00 ATOM 29901 OH2 SOL 4933 37.470 59.990 70.490 1.00 0.00 ATOM 29902 H1 SOL 4933 37.340 60.820 70.940 1.00 0.00 ATOM 29903 H2 SOL 4933 37.150 59.330 71.100 1.00 0.00 ATOM 29904 OH2 SOL 4934 2.660 5.830 9.860 1.00 0.00 ATOM 29905 H1 SOL 4934 3.020 5.190 10.480 1.00 0.00 ATOM 29906 H2 SOL 4934 3.400 6.370 9.610 1.00 0.00 ATOM 29907 OH2 SOL 4935 7.160 20.420 12.460 1.00 0.00 ATOM 29908 H1 SOL 4935 7.120 19.470 12.610 1.00 0.00 ATOM 29909 H2 SOL 4935 7.690 20.510 11.680 1.00 0.00 ATOM 29910 OH2 SOL 4936 45.350 53.420 66.580 1.00 0.00 ATOM 29911 H1 SOL 4936 45.290 52.830 67.330 1.00 0.00 ATOM 29912 H2 SOL 4936 45.880 52.950 65.940 1.00 0.00 ATOM 29913 OH2 SOL 4937 44.240 24.530 79.790 1.00 0.00 ATOM 29914 H1 SOL 4937 44.030 24.100 80.620 1.00 0.00 ATOM 29915 H2 SOL 4937 43.430 24.990 79.550 1.00 0.00 ATOM 29916 OH2 SOL 4938 31.750 49.390 12.970 1.00 0.00 ATOM 29917 H1 SOL 4938 32.630 49.070 13.170 1.00 0.00 ATOM 29918 H2 SOL 4938 31.170 48.810 13.470 1.00 0.00 ATOM 29919 OH2 SOL 4939 23.520 9.360 75.900 1.00 0.00 ATOM 29920 H1 SOL 4939 24.220 9.940 76.170 1.00 0.00 ATOM 29921 H2 SOL 4939 23.950 8.510 75.760 1.00 0.00 ATOM 29922 OH2 SOL 4940 49.060 11.710 2.920 1.00 0.00 ATOM 29923 H1 SOL 4940 49.130 12.660 2.840 1.00 0.00 ATOM 29924 H2 SOL 4940 48.120 11.530 2.850 1.00 0.00 ATOM 29925 OH2 SOL 4941 21.880 27.760 3.720 1.00 0.00 ATOM 29926 H1 SOL 4941 21.430 26.930 3.880 1.00 0.00 ATOM 29927 H2 SOL 4941 22.710 27.500 3.320 1.00 0.00 ATOM 29928 OH2 SOL 4942 20.740 3.370 78.010 1.00 0.00 ATOM 29929 H1 SOL 4942 21.120 3.030 78.820 1.00 0.00 ATOM 29930 H2 SOL 4942 19.800 3.200 78.090 1.00 0.00 ATOM 29931 OH2 SOL 4943 33.490 37.930 81.940 1.00 0.00 ATOM 29932 H1 SOL 4943 32.630 38.220 82.220 1.00 0.00 ATOM 29933 H2 SOL 4943 33.820 37.410 82.670 1.00 0.00 ATOM 29934 OH2 SOL 4944 7.880 40.760 64.910 1.00 0.00 ATOM 29935 H1 SOL 4944 7.360 41.560 64.850 1.00 0.00 ATOM 29936 H2 SOL 4944 7.570 40.220 64.180 1.00 0.00 ATOM 29937 OH2 SOL 4945 2.630 60.270 10.290 1.00 0.00 ATOM 29938 H1 SOL 4945 1.850 59.900 10.700 1.00 0.00 ATOM 29939 H2 SOL 4945 3.290 59.590 10.380 1.00 0.00 ATOM 29940 OH2 SOL 4946 32.270 5.370 5.410 1.00 0.00 ATOM 29941 H1 SOL 4946 32.940 5.810 5.940 1.00 0.00 ATOM 29942 H2 SOL 4946 32.150 5.950 4.660 1.00 0.00 ATOM 29943 OH2 SOL 4947 39.430 39.440 14.470 1.00 0.00 ATOM 29944 H1 SOL 4947 40.250 39.380 14.970 1.00 0.00 ATOM 29945 H2 SOL 4947 39.490 40.290 14.020 1.00 0.00 ATOM 29946 OH2 SOL 4948 57.300 59.950 6.690 1.00 0.00 ATOM 29947 H1 SOL 4948 57.300 60.870 6.970 1.00 0.00 ATOM 29948 H2 SOL 4948 56.610 59.910 6.020 1.00 0.00 ATOM 29949 OH2 SOL 4949 54.800 14.570 2.850 1.00 0.00 ATOM 29950 H1 SOL 4949 55.140 15.400 3.170 1.00 0.00 ATOM 29951 H2 SOL 4949 54.300 14.810 2.060 1.00 0.00 ATOM 29952 OH2 SOL 4950 33.460 60.550 69.460 1.00 0.00 ATOM 29953 H1 SOL 4950 32.690 60.050 69.170 1.00 0.00 ATOM 29954 H2 SOL 4950 33.100 61.320 69.900 1.00 0.00 ATOM 29955 OH2 SOL 4951 23.150 34.330 65.070 1.00 0.00 ATOM 29956 H1 SOL 4951 22.590 33.580 65.230 1.00 0.00 ATOM 29957 H2 SOL 4951 22.600 35.090 65.270 1.00 0.00 ATOM 29958 OH2 SOL 4952 57.650 4.860 10.650 1.00 0.00 ATOM 29959 H1 SOL 4952 57.780 4.020 10.200 1.00 0.00 ATOM 29960 H2 SOL 4952 58.150 5.480 10.130 1.00 0.00 ATOM 29961 OH2 SOL 4953 30.840 43.630 66.280 1.00 0.00 ATOM 29962 H1 SOL 4953 31.300 43.920 65.500 1.00 0.00 ATOM 29963 H2 SOL 4953 30.890 42.670 66.240 1.00 0.00 ATOM 29964 OH2 SOL 4954 18.180 11.690 22.440 1.00 0.00 ATOM 29965 H1 SOL 4954 19.110 11.480 22.300 1.00 0.00 ATOM 29966 H2 SOL 4954 18.180 12.620 22.670 1.00 0.00 ATOM 29967 OH2 SOL 4955 57.920 19.000 82.740 1.00 0.00 ATOM 29968 H1 SOL 4955 57.220 19.000 82.090 1.00 0.00 ATOM 29969 H2 SOL 4955 58.000 18.080 83.010 1.00 0.00 ATOM 29970 OH2 SOL 4956 1.390 58.470 0.110 1.00 0.00 ATOM 29971 H1 SOL 4956 0.560 58.260 0.540 1.00 0.00 ATOM 29972 H2 SOL 4956 1.450 59.420 0.150 1.00 0.00 ATOM 29973 OH2 SOL 4957 13.750 7.610 79.420 1.00 0.00 ATOM 29974 H1 SOL 4957 14.670 7.380 79.560 1.00 0.00 ATOM 29975 H2 SOL 4957 13.680 7.790 78.490 1.00 0.00 ATOM 29976 OH2 SOL 4958 37.770 23.690 16.430 1.00 0.00 ATOM 29977 H1 SOL 4958 38.230 24.190 17.100 1.00 0.00 ATOM 29978 H2 SOL 4958 38.420 23.070 16.100 1.00 0.00 ATOM 29979 OH2 SOL 4959 33.000 9.160 80.560 1.00 0.00 ATOM 29980 H1 SOL 4959 32.220 8.660 80.800 1.00 0.00 ATOM 29981 H2 SOL 4959 33.390 8.680 79.840 1.00 0.00 ATOM 29982 OH2 SOL 4960 41.260 60.430 6.460 1.00 0.00 ATOM 29983 H1 SOL 4960 41.470 60.260 7.380 1.00 0.00 ATOM 29984 H2 SOL 4960 42.080 60.730 6.080 1.00 0.00 ATOM 29985 OH2 SOL 4961 23.060 59.080 6.630 1.00 0.00 ATOM 29986 H1 SOL 4961 23.850 59.620 6.660 1.00 0.00 ATOM 29987 H2 SOL 4961 22.370 59.630 6.980 1.00 0.00 ATOM 29988 OH2 SOL 4962 53.770 2.790 3.300 1.00 0.00 ATOM 29989 H1 SOL 4962 54.030 2.750 2.380 1.00 0.00 ATOM 29990 H2 SOL 4962 53.790 3.720 3.520 1.00 0.00 ATOM 29991 OH2 SOL 4963 10.730 52.860 21.580 1.00 0.00 ATOM 29992 H1 SOL 4963 10.930 52.510 22.450 1.00 0.00 ATOM 29993 H2 SOL 4963 10.810 52.110 21.000 1.00 0.00 ATOM 29994 OH2 SOL 4964 46.380 17.130 73.290 1.00 0.00 ATOM 29995 H1 SOL 4964 46.510 17.080 72.340 1.00 0.00 ATOM 29996 H2 SOL 4964 47.240 17.330 73.640 1.00 0.00 ATOM 29997 OH2 SOL 4965 54.280 53.470 14.060 1.00 0.00 ATOM 29998 H1 SOL 4965 54.600 53.210 14.920 1.00 0.00 ATOM 29999 H2 SOL 4965 54.660 54.340 13.920 1.00 0.00 ATOM 30000 OH2 SOL 4966 50.350 11.020 9.450 1.00 0.00 ATOM 30001 H1 SOL 4966 50.580 11.870 9.060 1.00 0.00 ATOM 30002 H2 SOL 4966 50.140 11.230 10.360 1.00 0.00 ATOM 30003 OH2 SOL 4967 44.040 6.620 80.140 1.00 0.00 ATOM 30004 H1 SOL 4967 44.210 6.430 79.220 1.00 0.00 ATOM 30005 H2 SOL 4967 43.540 5.870 80.460 1.00 0.00 ATOM 30006 OH2 SOL 4968 50.110 16.900 21.140 1.00 0.00 ATOM 30007 H1 SOL 4968 50.470 16.120 20.720 1.00 0.00 ATOM 30008 H2 SOL 4968 49.640 16.570 21.900 1.00 0.00 ATOM 30009 OH2 SOL 4969 38.670 46.020 71.130 1.00 0.00 ATOM 30010 H1 SOL 4969 38.800 46.830 71.630 1.00 0.00 ATOM 30011 H2 SOL 4969 39.080 46.190 70.280 1.00 0.00 ATOM 30012 OH2 SOL 4970 25.710 31.870 16.200 1.00 0.00 ATOM 30013 H1 SOL 4970 25.240 32.040 17.020 1.00 0.00 ATOM 30014 H2 SOL 4970 26.070 30.990 16.310 1.00 0.00 ATOM 30015 OH2 SOL 4971 37.970 20.890 10.120 1.00 0.00 ATOM 30016 H1 SOL 4971 38.580 21.040 9.390 1.00 0.00 ATOM 30017 H2 SOL 4971 38.150 19.990 10.400 1.00 0.00 ATOM 30018 OH2 SOL 4972 4.080 54.890 15.900 1.00 0.00 ATOM 30019 H1 SOL 4972 3.830 55.060 16.810 1.00 0.00 ATOM 30020 H2 SOL 4972 5.040 54.910 15.900 1.00 0.00 ATOM 30021 OH2 SOL 4973 40.890 21.870 2.430 1.00 0.00 ATOM 30022 H1 SOL 4973 41.530 21.200 2.190 1.00 0.00 ATOM 30023 H2 SOL 4973 40.140 21.380 2.780 1.00 0.00 ATOM 30024 OH2 SOL 4974 7.100 49.010 84.750 1.00 0.00 ATOM 30025 H1 SOL 4974 7.890 48.510 84.570 1.00 0.00 ATOM 30026 H2 SOL 4974 6.390 48.470 84.390 1.00 0.00 ATOM 30027 OH2 SOL 4975 31.420 24.370 65.100 1.00 0.00 ATOM 30028 H1 SOL 4975 30.470 24.290 65.140 1.00 0.00 ATOM 30029 H2 SOL 4975 31.700 23.590 64.630 1.00 0.00 ATOM 30030 OH2 SOL 4976 44.740 2.180 67.900 1.00 0.00 ATOM 30031 H1 SOL 4976 44.930 2.240 66.960 1.00 0.00 ATOM 30032 H2 SOL 4976 44.260 2.980 68.100 1.00 0.00 ATOM 30033 OH2 SOL 4977 14.020 59.780 82.760 1.00 0.00 ATOM 30034 H1 SOL 4977 13.530 60.330 82.150 1.00 0.00 ATOM 30035 H2 SOL 4977 14.130 60.330 83.540 1.00 0.00 ATOM 30036 OH2 SOL 4978 21.860 47.410 18.110 1.00 0.00 ATOM 30037 H1 SOL 4978 21.350 48.210 18.240 1.00 0.00 ATOM 30038 H2 SOL 4978 22.340 47.290 18.930 1.00 0.00 ATOM 30039 OH2 SOL 4979 17.640 39.780 5.740 1.00 0.00 ATOM 30040 H1 SOL 4979 16.980 40.290 6.210 1.00 0.00 ATOM 30041 H2 SOL 4979 18.470 40.080 6.110 1.00 0.00 ATOM 30042 OH2 SOL 4980 41.060 30.230 16.110 1.00 0.00 ATOM 30043 H1 SOL 4980 41.710 30.650 15.550 1.00 0.00 ATOM 30044 H2 SOL 4980 41.430 29.370 16.320 1.00 0.00 ATOM 30045 OH2 SOL 4981 46.290 41.690 78.030 1.00 0.00 ATOM 30046 H1 SOL 4981 46.080 40.810 77.730 1.00 0.00 ATOM 30047 H2 SOL 4981 46.210 42.230 77.250 1.00 0.00 ATOM 30048 OH2 SOL 4982 27.000 55.260 11.680 1.00 0.00 ATOM 30049 H1 SOL 4982 26.300 55.530 11.080 1.00 0.00 ATOM 30050 H2 SOL 4982 26.760 55.640 12.520 1.00 0.00 ATOM 30051 OH2 SOL 4983 17.560 37.220 12.430 1.00 0.00 ATOM 30052 H1 SOL 4983 17.080 36.400 12.340 1.00 0.00 ATOM 30053 H2 SOL 4983 18.460 37.000 12.160 1.00 0.00 ATOM 30054 OH2 SOL 4984 26.320 23.580 6.400 1.00 0.00 ATOM 30055 H1 SOL 4984 26.100 24.420 6.800 1.00 0.00 ATOM 30056 H2 SOL 4984 25.650 22.980 6.750 1.00 0.00 ATOM 30057 OH2 SOL 4985 15.630 5.380 17.610 1.00 0.00 ATOM 30058 H1 SOL 4985 15.990 5.940 18.290 1.00 0.00 ATOM 30059 H2 SOL 4985 15.730 4.490 17.950 1.00 0.00 ATOM 30060 OH2 SOL 4986 10.470 13.200 73.320 1.00 0.00 ATOM 30061 H1 SOL 4986 10.180 13.800 74.010 1.00 0.00 ATOM 30062 H2 SOL 4986 10.920 13.750 72.690 1.00 0.00 ATOM 30063 OH2 SOL 4987 40.390 53.380 7.740 1.00 0.00 ATOM 30064 H1 SOL 4987 39.650 52.980 8.190 1.00 0.00 ATOM 30065 H2 SOL 4987 40.050 54.200 7.390 1.00 0.00 ATOM 30066 OH2 SOL 4988 32.350 42.400 19.830 1.00 0.00 ATOM 30067 H1 SOL 4988 31.940 42.140 19.000 1.00 0.00 ATOM 30068 H2 SOL 4988 31.760 42.090 20.510 1.00 0.00 ATOM 30069 OH2 SOL 4989 6.880 19.350 74.670 1.00 0.00 ATOM 30070 H1 SOL 4989 6.600 19.560 75.560 1.00 0.00 ATOM 30071 H2 SOL 4989 6.610 20.100 74.140 1.00 0.00 ATOM 30072 OH2 SOL 4990 44.390 7.670 72.310 1.00 0.00 ATOM 30073 H1 SOL 4990 44.200 8.390 72.910 1.00 0.00 ATOM 30074 H2 SOL 4990 44.000 7.950 71.480 1.00 0.00 ATOM 30075 OH2 SOL 4991 57.030 51.710 75.210 1.00 0.00 ATOM 30076 H1 SOL 4991 57.160 50.870 75.650 1.00 0.00 ATOM 30077 H2 SOL 4991 56.100 51.900 75.320 1.00 0.00 ATOM 30078 OH2 SOL 4992 37.410 31.210 5.810 1.00 0.00 ATOM 30079 H1 SOL 4992 37.560 31.360 4.880 1.00 0.00 ATOM 30080 H2 SOL 4992 37.530 30.270 5.920 1.00 0.00 ATOM 30081 OH2 SOL 4993 52.160 18.420 30.200 1.00 0.00 ATOM 30082 H1 SOL 4993 51.770 18.950 30.900 1.00 0.00 ATOM 30083 H2 SOL 4993 52.920 18.010 30.600 1.00 0.00 ATOM 30084 OH2 SOL 4994 32.680 41.520 69.810 1.00 0.00 ATOM 30085 H1 SOL 4994 32.480 40.590 69.800 1.00 0.00 ATOM 30086 H2 SOL 4994 31.870 41.940 70.080 1.00 0.00 ATOM 30087 OH2 SOL 4995 55.520 56.320 12.160 1.00 0.00 ATOM 30088 H1 SOL 4995 56.370 55.880 12.220 1.00 0.00 ATOM 30089 H2 SOL 4995 55.690 57.210 12.460 1.00 0.00 ATOM 30090 OH2 SOL 4996 59.150 24.130 11.950 1.00 0.00 ATOM 30091 H1 SOL 4996 58.230 23.890 11.820 1.00 0.00 ATOM 30092 H2 SOL 4996 59.390 23.690 12.770 1.00 0.00 ATOM 30093 OH2 SOL 4997 10.400 1.330 65.190 1.00 0.00 ATOM 30094 H1 SOL 4997 10.130 0.450 64.930 1.00 0.00 ATOM 30095 H2 SOL 4997 9.830 1.540 65.930 1.00 0.00 ATOM 30096 OH2 SOL 4998 38.170 57.520 68.710 1.00 0.00 ATOM 30097 H1 SOL 4998 37.370 57.080 68.970 1.00 0.00 ATOM 30098 H2 SOL 4998 38.430 58.030 69.480 1.00 0.00 ATOM 30099 OH2 SOL 4999 52.610 16.850 27.830 1.00 0.00 ATOM 30100 H1 SOL 4999 51.760 16.600 27.480 1.00 0.00 ATOM 30101 H2 SOL 4999 52.410 17.250 28.680 1.00 0.00 ATOM 30102 OH2 SOL 5000 30.470 17.160 63.830 1.00 0.00 ATOM 30103 H1 SOL 5000 30.020 16.830 64.610 1.00 0.00 ATOM 30104 H2 SOL 5000 30.160 16.610 63.120 1.00 0.00 ATOM 30105 OH2 SOL 5001 22.360 2.280 7.350 1.00 0.00 ATOM 30106 H1 SOL 5001 23.280 2.510 7.440 1.00 0.00 ATOM 30107 H2 SOL 5001 22.110 2.580 6.480 1.00 0.00 ATOM 30108 OH2 SOL 5002 17.000 44.000 7.510 1.00 0.00 ATOM 30109 H1 SOL 5002 17.870 43.720 7.790 1.00 0.00 ATOM 30110 H2 SOL 5002 16.630 44.430 8.280 1.00 0.00 ATOM 30111 OH2 SOL 5003 1.040 17.910 19.380 1.00 0.00 ATOM 30112 H1 SOL 5003 1.890 18.290 19.600 1.00 0.00 ATOM 30113 H2 SOL 5003 1.230 16.980 19.230 1.00 0.00 ATOM 30114 OH2 SOL 5004 54.250 16.510 25.830 1.00 0.00 ATOM 30115 H1 SOL 5004 53.520 16.620 26.440 1.00 0.00 ATOM 30116 H2 SOL 5004 54.820 17.260 25.990 1.00 0.00 ATOM 30117 OH2 SOL 5005 55.640 46.900 68.740 1.00 0.00 ATOM 30118 H1 SOL 5005 55.400 47.830 68.660 1.00 0.00 ATOM 30119 H2 SOL 5005 55.770 46.780 69.680 1.00 0.00 ATOM 30120 OH2 SOL 5006 41.240 5.590 17.380 1.00 0.00 ATOM 30121 H1 SOL 5006 40.560 5.140 16.870 1.00 0.00 ATOM 30122 H2 SOL 5006 42.060 5.360 16.930 1.00 0.00 ATOM 30123 OH2 SOL 5007 21.820 52.930 2.440 1.00 0.00 ATOM 30124 H1 SOL 5007 21.490 53.600 3.040 1.00 0.00 ATOM 30125 H2 SOL 5007 22.340 53.410 1.800 1.00 0.00 ATOM 30126 OH2 SOL 5008 21.900 9.920 69.840 1.00 0.00 ATOM 30127 H1 SOL 5008 22.200 9.090 69.470 1.00 0.00 ATOM 30128 H2 SOL 5008 22.250 9.920 70.730 1.00 0.00 ATOM 30129 OH2 SOL 5009 27.880 35.150 16.880 1.00 0.00 ATOM 30130 H1 SOL 5009 27.750 34.890 15.960 1.00 0.00 ATOM 30131 H2 SOL 5009 28.470 34.480 17.230 1.00 0.00 ATOM 30132 OH2 SOL 5010 0.130 49.090 75.010 1.00 0.00 ATOM 30133 H1 SOL 5010 -0.650 49.390 74.550 1.00 0.00 ATOM 30134 H2 SOL 5010 0.720 49.850 75.000 1.00 0.00 ATOM 30135 OH2 SOL 5011 6.770 23.200 78.480 1.00 0.00 ATOM 30136 H1 SOL 5011 6.620 22.520 79.140 1.00 0.00 ATOM 30137 H2 SOL 5011 7.430 23.770 78.890 1.00 0.00 ATOM 30138 OH2 SOL 5012 10.840 15.280 78.160 1.00 0.00 ATOM 30139 H1 SOL 5012 11.110 15.820 78.910 1.00 0.00 ATOM 30140 H2 SOL 5012 9.990 14.930 78.420 1.00 0.00 ATOM 30141 OH2 SOL 5013 9.250 49.850 12.570 1.00 0.00 ATOM 30142 H1 SOL 5013 9.900 49.920 11.880 1.00 0.00 ATOM 30143 H2 SOL 5013 8.850 50.720 12.620 1.00 0.00 ATOM 30144 OH2 SOL 5014 30.700 12.520 14.330 1.00 0.00 ATOM 30145 H1 SOL 5014 29.900 12.860 14.710 1.00 0.00 ATOM 30146 H2 SOL 5014 31.150 12.080 15.050 1.00 0.00 ATOM 30147 OH2 SOL 5015 9.710 40.010 14.130 1.00 0.00 ATOM 30148 H1 SOL 5015 10.630 39.750 14.150 1.00 0.00 ATOM 30149 H2 SOL 5015 9.400 39.900 15.030 1.00 0.00 ATOM 30150 OH2 SOL 5016 13.410 22.650 65.340 1.00 0.00 ATOM 30151 H1 SOL 5016 12.740 21.980 65.450 1.00 0.00 ATOM 30152 H2 SOL 5016 12.970 23.350 64.840 1.00 0.00 ATOM 30153 OH2 SOL 5017 29.410 54.870 0.920 1.00 0.00 ATOM 30154 H1 SOL 5017 29.980 54.640 1.650 1.00 0.00 ATOM 30155 H2 SOL 5017 29.370 54.080 0.390 1.00 0.00 ATOM 30156 OH2 SOL 5018 53.520 55.130 5.450 1.00 0.00 ATOM 30157 H1 SOL 5018 52.630 55.400 5.670 1.00 0.00 ATOM 30158 H2 SOL 5018 54.000 55.950 5.330 1.00 0.00 ATOM 30159 OH2 SOL 5019 20.990 24.450 83.670 1.00 0.00 ATOM 30160 H1 SOL 5019 20.090 24.460 84.000 1.00 0.00 ATOM 30161 H2 SOL 5019 21.080 25.260 83.170 1.00 0.00 ATOM 30162 OH2 SOL 5020 2.540 53.350 75.990 1.00 0.00 ATOM 30163 H1 SOL 5020 3.120 53.260 76.740 1.00 0.00 ATOM 30164 H2 SOL 5020 1.810 53.880 76.310 1.00 0.00 ATOM 30165 OH2 SOL 5021 26.330 55.090 0.790 1.00 0.00 ATOM 30166 H1 SOL 5021 25.710 55.440 1.440 1.00 0.00 ATOM 30167 H2 SOL 5021 26.990 54.620 1.310 1.00 0.00 ATOM 30168 OH2 SOL 5022 8.520 47.940 61.000 1.00 0.00 ATOM 30169 H1 SOL 5022 8.030 48.710 60.710 1.00 0.00 ATOM 30170 H2 SOL 5022 7.850 47.310 61.260 1.00 0.00 ATOM 30171 OH2 SOL 5023 31.600 28.960 84.520 1.00 0.00 ATOM 30172 H1 SOL 5023 31.600 28.730 83.590 1.00 0.00 ATOM 30173 H2 SOL 5023 32.280 29.630 84.610 1.00 0.00 ATOM 30174 OH2 SOL 5024 8.300 15.630 83.330 1.00 0.00 ATOM 30175 H1 SOL 5024 8.100 14.700 83.390 1.00 0.00 ATOM 30176 H2 SOL 5024 9.240 15.680 83.500 1.00 0.00 ATOM 30177 OH2 SOL 5025 58.870 50.520 0.690 1.00 0.00 ATOM 30178 H1 SOL 5025 59.000 51.370 1.130 1.00 0.00 ATOM 30179 H2 SOL 5025 57.980 50.560 0.350 1.00 0.00 ATOM 30180 OH2 SOL 5026 3.020 48.120 75.230 1.00 0.00 ATOM 30181 H1 SOL 5026 2.090 48.150 75.000 1.00 0.00 ATOM 30182 H2 SOL 5026 3.440 48.700 74.610 1.00 0.00 ATOM 30183 OH2 SOL 5027 1.380 46.800 2.060 1.00 0.00 ATOM 30184 H1 SOL 5027 0.620 47.100 2.560 1.00 0.00 ATOM 30185 H2 SOL 5027 1.050 46.690 1.160 1.00 0.00 ATOM 30186 OH2 SOL 5028 31.620 6.460 63.810 1.00 0.00 ATOM 30187 H1 SOL 5028 32.400 6.830 63.400 1.00 0.00 ATOM 30188 H2 SOL 5028 31.950 6.000 64.580 1.00 0.00 ATOM 30189 OH2 SOL 5029 20.500 49.850 81.970 1.00 0.00 ATOM 30190 H1 SOL 5029 19.720 50.180 81.520 1.00 0.00 ATOM 30191 H2 SOL 5029 20.180 49.580 82.830 1.00 0.00 ATOM 30192 OH2 SOL 5030 2.410 22.610 11.210 1.00 0.00 ATOM 30193 H1 SOL 5030 3.340 22.420 11.180 1.00 0.00 ATOM 30194 H2 SOL 5030 2.110 22.250 12.040 1.00 0.00 ATOM 30195 OH2 SOL 5031 27.530 57.710 67.710 1.00 0.00 ATOM 30196 H1 SOL 5031 28.380 57.330 67.910 1.00 0.00 ATOM 30197 H2 SOL 5031 27.430 57.590 66.760 1.00 0.00 ATOM 30198 OH2 SOL 5032 1.140 7.100 3.510 1.00 0.00 ATOM 30199 H1 SOL 5032 1.970 7.270 3.050 1.00 0.00 ATOM 30200 H2 SOL 5032 1.410 6.760 4.360 1.00 0.00 ATOM 30201 OH2 SOL 5033 4.160 53.060 4.150 1.00 0.00 ATOM 30202 H1 SOL 5033 3.930 53.570 4.920 1.00 0.00 ATOM 30203 H2 SOL 5033 3.360 52.580 3.920 1.00 0.00 ATOM 30204 OH2 SOL 5034 14.740 40.280 5.970 1.00 0.00 ATOM 30205 H1 SOL 5034 14.520 39.500 6.480 1.00 0.00 ATOM 30206 H2 SOL 5034 14.560 41.010 6.560 1.00 0.00 ATOM 30207 OH2 SOL 5035 34.300 24.780 12.760 1.00 0.00 ATOM 30208 H1 SOL 5035 34.490 24.490 11.870 1.00 0.00 ATOM 30209 H2 SOL 5035 33.360 24.680 12.850 1.00 0.00 ATOM 30210 OH2 SOL 5036 15.690 24.340 9.300 1.00 0.00 ATOM 30211 H1 SOL 5036 15.890 24.880 10.060 1.00 0.00 ATOM 30212 H2 SOL 5036 15.600 24.970 8.580 1.00 0.00 ATOM 30213 OH2 SOL 5037 10.740 56.720 1.930 1.00 0.00 ATOM 30214 H1 SOL 5037 11.550 57.200 2.110 1.00 0.00 ATOM 30215 H2 SOL 5037 10.590 56.840 0.990 1.00 0.00 ATOM 30216 OH2 SOL 5038 38.500 13.000 3.470 1.00 0.00 ATOM 30217 H1 SOL 5038 38.480 13.690 2.810 1.00 0.00 ATOM 30218 H2 SOL 5038 39.380 13.050 3.840 1.00 0.00 ATOM 30219 OH2 SOL 5039 5.480 59.020 9.360 1.00 0.00 ATOM 30220 H1 SOL 5039 4.810 58.340 9.450 1.00 0.00 ATOM 30221 H2 SOL 5039 6.250 58.560 9.020 1.00 0.00 ATOM 30222 OH2 SOL 5040 24.430 29.430 15.380 1.00 0.00 ATOM 30223 H1 SOL 5040 24.560 29.370 14.430 1.00 0.00 ATOM 30224 H2 SOL 5040 24.370 30.370 15.550 1.00 0.00 ATOM 30225 OH2 SOL 5041 9.310 56.910 25.340 1.00 0.00 ATOM 30226 H1 SOL 5041 9.280 55.960 25.230 1.00 0.00 ATOM 30227 H2 SOL 5041 8.830 57.260 24.600 1.00 0.00 ATOM 30228 OH2 SOL 5042 26.620 30.580 6.040 1.00 0.00 ATOM 30229 H1 SOL 5042 26.270 29.830 6.530 1.00 0.00 ATOM 30230 H2 SOL 5042 27.250 30.990 6.640 1.00 0.00 ATOM 30231 OH2 SOL 5043 29.480 50.750 73.290 1.00 0.00 ATOM 30232 H1 SOL 5043 29.730 51.680 73.310 1.00 0.00 ATOM 30233 H2 SOL 5043 28.870 50.690 72.560 1.00 0.00 ATOM 30234 OH2 SOL 5044 48.830 42.420 83.290 1.00 0.00 ATOM 30235 H1 SOL 5044 48.270 42.810 82.610 1.00 0.00 ATOM 30236 H2 SOL 5044 48.670 42.950 84.070 1.00 0.00 ATOM 30237 OH2 SOL 5045 58.220 53.050 73.260 1.00 0.00 ATOM 30238 H1 SOL 5045 58.950 52.570 72.850 1.00 0.00 ATOM 30239 H2 SOL 5045 57.730 52.390 73.730 1.00 0.00 ATOM 30240 OH2 SOL 5046 21.990 24.320 20.590 1.00 0.00 ATOM 30241 H1 SOL 5046 21.530 25.110 20.860 1.00 0.00 ATOM 30242 H2 SOL 5046 21.320 23.750 20.220 1.00 0.00 ATOM 30243 OH2 SOL 5047 48.330 56.050 12.580 1.00 0.00 ATOM 30244 H1 SOL 5047 49.100 55.520 12.370 1.00 0.00 ATOM 30245 H2 SOL 5047 48.410 56.820 12.020 1.00 0.00 ATOM 30246 OH2 SOL 5048 59.720 38.580 79.390 1.00 0.00 ATOM 30247 H1 SOL 5048 59.310 38.120 80.130 1.00 0.00 ATOM 30248 H2 SOL 5048 59.410 39.480 79.470 1.00 0.00 ATOM 30249 OH2 SOL 5049 32.480 16.320 80.560 1.00 0.00 ATOM 30250 H1 SOL 5049 32.340 17.240 80.800 1.00 0.00 ATOM 30251 H2 SOL 5049 31.710 16.100 80.040 1.00 0.00 ATOM 30252 OH2 SOL 5050 7.430 36.020 71.110 1.00 0.00 ATOM 30253 H1 SOL 5050 7.310 35.190 71.580 1.00 0.00 ATOM 30254 H2 SOL 5050 6.540 36.340 70.950 1.00 0.00 ATOM 30255 OH2 SOL 5051 54.000 54.100 18.770 1.00 0.00 ATOM 30256 H1 SOL 5051 53.430 54.610 19.340 1.00 0.00 ATOM 30257 H2 SOL 5051 53.610 53.230 18.760 1.00 0.00 ATOM 30258 OH2 SOL 5052 34.090 19.230 25.450 1.00 0.00 ATOM 30259 H1 SOL 5052 34.900 19.680 25.700 1.00 0.00 ATOM 30260 H2 SOL 5052 33.390 19.820 25.720 1.00 0.00 ATOM 30261 OH2 SOL 5053 33.350 2.040 67.160 1.00 0.00 ATOM 30262 H1 SOL 5053 33.320 1.400 66.440 1.00 0.00 ATOM 30263 H2 SOL 5053 34.260 2.020 67.460 1.00 0.00 ATOM 30264 OH2 SOL 5054 4.830 15.280 71.780 1.00 0.00 ATOM 30265 H1 SOL 5054 4.200 14.890 72.390 1.00 0.00 ATOM 30266 H2 SOL 5054 5.580 15.510 72.320 1.00 0.00 ATOM 30267 OH2 SOL 5055 3.710 8.230 17.610 1.00 0.00 ATOM 30268 H1 SOL 5055 4.610 7.890 17.600 1.00 0.00 ATOM 30269 H2 SOL 5055 3.630 8.660 18.460 1.00 0.00 ATOM 30270 OH2 SOL 5056 10.640 18.440 73.040 1.00 0.00 ATOM 30271 H1 SOL 5056 11.580 18.610 72.940 1.00 0.00 ATOM 30272 H2 SOL 5056 10.340 19.150 73.620 1.00 0.00 ATOM 30273 OH2 SOL 5057 59.090 26.940 0.220 1.00 0.00 ATOM 30274 H1 SOL 5057 58.270 27.210 0.620 1.00 0.00 ATOM 30275 H2 SOL 5057 59.040 25.980 0.200 1.00 0.00 ATOM 30276 OH2 SOL 5058 37.370 44.440 10.230 1.00 0.00 ATOM 30277 H1 SOL 5058 37.870 44.170 11.010 1.00 0.00 ATOM 30278 H2 SOL 5058 36.490 44.100 10.390 1.00 0.00 ATOM 30279 OH2 SOL 5059 51.060 57.670 15.270 1.00 0.00 ATOM 30280 H1 SOL 5059 51.420 57.940 16.110 1.00 0.00 ATOM 30281 H2 SOL 5059 50.120 57.590 15.430 1.00 0.00 ATOM 30282 OH2 SOL 5060 13.450 4.050 16.470 1.00 0.00 ATOM 30283 H1 SOL 5060 13.920 4.750 16.920 1.00 0.00 ATOM 30284 H2 SOL 5060 14.110 3.670 15.880 1.00 0.00 ATOM 30285 OH2 SOL 5061 42.090 59.630 76.000 1.00 0.00 ATOM 30286 H1 SOL 5061 41.200 59.290 75.890 1.00 0.00 ATOM 30287 H2 SOL 5061 41.970 60.570 76.170 1.00 0.00 ATOM 30288 OH2 SOL 5062 5.730 44.140 22.220 1.00 0.00 ATOM 30289 H1 SOL 5062 6.630 44.350 21.950 1.00 0.00 ATOM 30290 H2 SOL 5062 5.560 44.720 22.960 1.00 0.00 ATOM 30291 OH2 SOL 5063 46.880 11.120 77.050 1.00 0.00 ATOM 30292 H1 SOL 5063 46.630 10.360 76.530 1.00 0.00 ATOM 30293 H2 SOL 5063 46.240 11.790 76.800 1.00 0.00 ATOM 30294 OH2 SOL 5064 13.380 29.910 25.120 1.00 0.00 ATOM 30295 H1 SOL 5064 13.680 30.280 25.950 1.00 0.00 ATOM 30296 H2 SOL 5064 12.960 30.640 24.670 1.00 0.00 ATOM 30297 OH2 SOL 5065 15.660 6.820 3.140 1.00 0.00 ATOM 30298 H1 SOL 5065 15.790 6.880 2.190 1.00 0.00 ATOM 30299 H2 SOL 5065 16.530 6.620 3.490 1.00 0.00 ATOM 30300 OH2 SOL 5066 33.580 26.020 65.880 1.00 0.00 ATOM 30301 H1 SOL 5066 32.850 25.460 65.610 1.00 0.00 ATOM 30302 H2 SOL 5066 33.580 25.970 66.840 1.00 0.00 ATOM 30303 OH2 SOL 5067 5.930 8.400 71.160 1.00 0.00 ATOM 30304 H1 SOL 5067 5.030 8.130 70.990 1.00 0.00 ATOM 30305 H2 SOL 5067 6.180 7.930 71.950 1.00 0.00 ATOM 30306 OH2 SOL 5068 43.750 28.480 7.270 1.00 0.00 ATOM 30307 H1 SOL 5068 44.410 27.790 7.370 1.00 0.00 ATOM 30308 H2 SOL 5068 43.860 28.790 6.380 1.00 0.00 ATOM 30309 OH2 SOL 5069 16.120 36.090 2.560 1.00 0.00 ATOM 30310 H1 SOL 5069 15.590 36.320 1.800 1.00 0.00 ATOM 30311 H2 SOL 5069 17.020 36.040 2.220 1.00 0.00 ATOM 30312 OH2 SOL 5070 36.130 56.020 15.870 1.00 0.00 ATOM 30313 H1 SOL 5070 36.010 56.830 16.360 1.00 0.00 ATOM 30314 H2 SOL 5070 35.240 55.730 15.670 1.00 0.00 ATOM 30315 OH2 SOL 5071 52.190 29.890 78.770 1.00 0.00 ATOM 30316 H1 SOL 5071 52.600 29.470 79.530 1.00 0.00 ATOM 30317 H2 SOL 5071 52.860 29.870 78.090 1.00 0.00 ATOM 30318 OH2 SOL 5072 42.170 34.630 75.170 1.00 0.00 ATOM 30319 H1 SOL 5072 41.800 35.410 75.580 1.00 0.00 ATOM 30320 H2 SOL 5072 41.670 34.520 74.360 1.00 0.00 ATOM 30321 OH2 SOL 5073 27.360 19.430 7.860 1.00 0.00 ATOM 30322 H1 SOL 5073 27.710 18.680 7.390 1.00 0.00 ATOM 30323 H2 SOL 5073 27.560 19.260 8.780 1.00 0.00 ATOM 30324 OH2 SOL 5074 19.750 58.520 4.950 1.00 0.00 ATOM 30325 H1 SOL 5074 18.990 58.370 4.380 1.00 0.00 ATOM 30326 H2 SOL 5074 19.430 58.340 5.830 1.00 0.00 ATOM 30327 OH2 SOL 5075 8.530 41.660 21.850 1.00 0.00 ATOM 30328 H1 SOL 5075 8.140 40.790 21.980 1.00 0.00 ATOM 30329 H2 SOL 5075 9.470 41.510 21.930 1.00 0.00 ATOM 30330 OH2 SOL 5076 16.660 49.710 66.710 1.00 0.00 ATOM 30331 H1 SOL 5076 16.770 48.770 66.650 1.00 0.00 ATOM 30332 H2 SOL 5076 16.730 50.030 65.810 1.00 0.00 ATOM 30333 OH2 SOL 5077 35.420 13.300 20.250 1.00 0.00 ATOM 30334 H1 SOL 5077 34.930 14.020 19.870 1.00 0.00 ATOM 30335 H2 SOL 5077 36.340 13.580 20.200 1.00 0.00 ATOM 30336 OH2 SOL 5078 40.550 17.860 67.960 1.00 0.00 ATOM 30337 H1 SOL 5078 40.810 16.940 67.960 1.00 0.00 ATOM 30338 H2 SOL 5078 39.610 17.840 68.160 1.00 0.00 ATOM 30339 OH2 SOL 5079 58.060 24.700 2.690 1.00 0.00 ATOM 30340 H1 SOL 5079 58.000 23.770 2.450 1.00 0.00 ATOM 30341 H2 SOL 5079 57.240 24.880 3.150 1.00 0.00 ATOM 30342 OH2 SOL 5080 57.980 13.010 84.580 1.00 0.00 ATOM 30343 H1 SOL 5080 57.960 13.640 85.300 1.00 0.00 ATOM 30344 H2 SOL 5080 57.390 13.380 83.920 1.00 0.00 ATOM 30345 OH2 SOL 5081 20.790 22.840 69.060 1.00 0.00 ATOM 30346 H1 SOL 5081 20.650 21.910 68.880 1.00 0.00 ATOM 30347 H2 SOL 5081 20.990 23.220 68.200 1.00 0.00 ATOM 30348 OH2 SOL 5082 47.870 53.970 71.780 1.00 0.00 ATOM 30349 H1 SOL 5082 47.700 54.910 71.890 1.00 0.00 ATOM 30350 H2 SOL 5082 47.010 53.560 71.790 1.00 0.00 ATOM 30351 OH2 SOL 5083 27.910 5.410 79.570 1.00 0.00 ATOM 30352 H1 SOL 5083 26.990 5.200 79.420 1.00 0.00 ATOM 30353 H2 SOL 5083 27.920 6.350 79.730 1.00 0.00 ATOM 30354 OH2 SOL 5084 49.630 42.820 5.410 1.00 0.00 ATOM 30355 H1 SOL 5084 49.710 42.500 6.310 1.00 0.00 ATOM 30356 H2 SOL 5084 50.500 43.160 5.200 1.00 0.00 ATOM 30357 OH2 SOL 5085 50.680 55.490 5.750 1.00 0.00 ATOM 30358 H1 SOL 5085 50.960 54.580 5.660 1.00 0.00 ATOM 30359 H2 SOL 5085 49.730 55.450 5.750 1.00 0.00 ATOM 30360 OH2 SOL 5086 32.080 60.460 22.000 1.00 0.00 ATOM 30361 H1 SOL 5086 32.230 59.560 22.270 1.00 0.00 ATOM 30362 H2 SOL 5086 32.960 60.830 21.910 1.00 0.00 ATOM 30363 OH2 SOL 5087 2.590 20.010 9.110 1.00 0.00 ATOM 30364 H1 SOL 5087 2.000 19.960 8.350 1.00 0.00 ATOM 30365 H2 SOL 5087 3.410 20.330 8.750 1.00 0.00 ATOM 30366 OH2 SOL 5088 3.160 31.060 22.400 1.00 0.00 ATOM 30367 H1 SOL 5088 3.310 31.960 22.700 1.00 0.00 ATOM 30368 H2 SOL 5088 4.030 30.690 22.270 1.00 0.00 ATOM 30369 OH2 SOL 5089 30.530 24.520 7.360 1.00 0.00 ATOM 30370 H1 SOL 5089 31.390 24.460 7.790 1.00 0.00 ATOM 30371 H2 SOL 5089 30.640 25.220 6.710 1.00 0.00 ATOM 30372 OH2 SOL 5090 46.830 26.760 19.570 1.00 0.00 ATOM 30373 H1 SOL 5090 46.860 26.370 20.450 1.00 0.00 ATOM 30374 H2 SOL 5090 47.160 26.080 18.990 1.00 0.00 ATOM 30375 OH2 SOL 5091 21.520 47.470 80.290 1.00 0.00 ATOM 30376 H1 SOL 5091 22.470 47.540 80.370 1.00 0.00 ATOM 30377 H2 SOL 5091 21.260 48.240 79.780 1.00 0.00 ATOM 30378 OH2 SOL 5092 51.580 2.240 78.230 1.00 0.00 ATOM 30379 H1 SOL 5092 51.620 1.490 78.830 1.00 0.00 ATOM 30380 H2 SOL 5092 52.240 2.850 78.570 1.00 0.00 ATOM 30381 OH2 SOL 5093 27.670 23.720 73.590 1.00 0.00 ATOM 30382 H1 SOL 5093 27.430 24.350 72.910 1.00 0.00 ATOM 30383 H2 SOL 5093 27.240 22.900 73.320 1.00 0.00 ATOM 30384 OH2 SOL 5094 59.230 20.400 18.900 1.00 0.00 ATOM 30385 H1 SOL 5094 59.610 19.530 18.980 1.00 0.00 ATOM 30386 H2 SOL 5094 59.950 21.000 19.100 1.00 0.00 ATOM 30387 OH2 SOL 5095 20.820 50.180 69.400 1.00 0.00 ATOM 30388 H1 SOL 5095 20.150 49.520 69.580 1.00 0.00 ATOM 30389 H2 SOL 5095 21.550 49.940 69.980 1.00 0.00 ATOM 30390 OH2 SOL 5096 3.690 53.820 73.590 1.00 0.00 ATOM 30391 H1 SOL 5096 3.280 53.610 74.430 1.00 0.00 ATOM 30392 H2 SOL 5096 4.020 54.720 73.700 1.00 0.00 ATOM 30393 OH2 SOL 5097 1.180 45.730 72.140 1.00 0.00 ATOM 30394 H1 SOL 5097 0.650 45.040 72.550 1.00 0.00 ATOM 30395 H2 SOL 5097 2.020 45.690 72.600 1.00 0.00 ATOM 30396 OH2 SOL 5098 49.280 18.220 54.610 1.00 0.00 ATOM 30397 H1 SOL 5098 48.650 17.910 53.960 1.00 0.00 ATOM 30398 H2 SOL 5098 48.770 18.820 55.160 1.00 0.00 ATOM 30399 OH2 SOL 5099 6.250 22.580 3.870 1.00 0.00 ATOM 30400 H1 SOL 5099 5.970 22.590 2.960 1.00 0.00 ATOM 30401 H2 SOL 5099 5.440 22.700 4.370 1.00 0.00 ATOM 30402 OH2 SOL 5100 54.910 41.070 71.380 1.00 0.00 ATOM 30403 H1 SOL 5100 54.960 40.620 72.220 1.00 0.00 ATOM 30404 H2 SOL 5100 54.270 41.770 71.530 1.00 0.00 ATOM 30405 OH2 SOL 5101 57.080 54.080 70.150 1.00 0.00 ATOM 30406 H1 SOL 5101 56.950 53.820 69.240 1.00 0.00 ATOM 30407 H2 SOL 5101 57.260 55.020 70.100 1.00 0.00 ATOM 30408 OH2 SOL 5102 14.800 4.250 77.650 1.00 0.00 ATOM 30409 H1 SOL 5102 14.210 4.610 76.990 1.00 0.00 ATOM 30410 H2 SOL 5102 15.230 3.520 77.200 1.00 0.00 ATOM 30411 OH2 SOL 5103 37.030 46.640 64.280 1.00 0.00 ATOM 30412 H1 SOL 5103 37.320 46.260 63.450 1.00 0.00 ATOM 30413 H2 SOL 5103 37.630 47.370 64.430 1.00 0.00 ATOM 30414 OH2 SOL 5104 21.380 13.170 83.080 1.00 0.00 ATOM 30415 H1 SOL 5104 22.260 13.470 82.880 1.00 0.00 ATOM 30416 H2 SOL 5104 21.090 13.740 83.790 1.00 0.00 ATOM 30417 OH2 SOL 5105 20.940 44.630 12.810 1.00 0.00 ATOM 30418 H1 SOL 5105 20.760 43.860 12.270 1.00 0.00 ATOM 30419 H2 SOL 5105 20.200 44.670 13.420 1.00 0.00 ATOM 30420 OH2 SOL 5106 21.560 48.670 22.290 1.00 0.00 ATOM 30421 H1 SOL 5106 20.820 48.170 22.650 1.00 0.00 ATOM 30422 H2 SOL 5106 22.330 48.140 22.500 1.00 0.00 ATOM 30423 OH2 SOL 5107 57.480 54.350 12.790 1.00 0.00 ATOM 30424 H1 SOL 5107 57.700 54.410 13.720 1.00 0.00 ATOM 30425 H2 SOL 5107 57.300 53.420 12.650 1.00 0.00 ATOM 30426 OH2 SOL 5108 8.130 50.520 60.010 1.00 0.00 ATOM 30427 H1 SOL 5108 9.070 50.680 59.960 1.00 0.00 ATOM 30428 H2 SOL 5108 7.750 51.390 60.150 1.00 0.00 ATOM 30429 OH2 SOL 5109 44.180 33.230 76.660 1.00 0.00 ATOM 30430 H1 SOL 5109 43.700 33.710 75.980 1.00 0.00 ATOM 30431 H2 SOL 5109 44.460 33.910 77.270 1.00 0.00 ATOM 30432 OH2 SOL 5110 3.800 8.230 62.270 1.00 0.00 ATOM 30433 H1 SOL 5110 4.420 7.550 62.000 1.00 0.00 ATOM 30434 H2 SOL 5110 2.940 7.860 62.080 1.00 0.00 ATOM 30435 OH2 SOL 5111 23.550 58.840 71.000 1.00 0.00 ATOM 30436 H1 SOL 5111 23.050 58.040 70.850 1.00 0.00 ATOM 30437 H2 SOL 5111 23.790 59.140 70.120 1.00 0.00 ATOM 30438 OH2 SOL 5112 49.580 3.180 12.970 1.00 0.00 ATOM 30439 H1 SOL 5112 49.080 3.640 12.290 1.00 0.00 ATOM 30440 H2 SOL 5112 50.470 3.520 12.880 1.00 0.00 ATOM 30441 OH2 SOL 5113 24.360 47.580 4.290 1.00 0.00 ATOM 30442 H1 SOL 5113 23.440 47.780 4.130 1.00 0.00 ATOM 30443 H2 SOL 5113 24.400 46.620 4.320 1.00 0.00 ATOM 30444 OH2 SOL 5114 30.910 18.120 8.230 1.00 0.00 ATOM 30445 H1 SOL 5114 31.070 18.920 8.740 1.00 0.00 ATOM 30446 H2 SOL 5114 30.840 17.430 8.890 1.00 0.00 ATOM 30447 OH2 SOL 5115 15.000 59.720 68.690 1.00 0.00 ATOM 30448 H1 SOL 5115 15.070 60.670 68.690 1.00 0.00 ATOM 30449 H2 SOL 5115 14.060 59.550 68.760 1.00 0.00 ATOM 30450 OH2 SOL 5116 30.910 20.060 74.330 1.00 0.00 ATOM 30451 H1 SOL 5116 30.470 19.760 75.120 1.00 0.00 ATOM 30452 H2 SOL 5116 31.490 20.760 74.630 1.00 0.00 ATOM 30453 OH2 SOL 5117 16.380 23.950 2.720 1.00 0.00 ATOM 30454 H1 SOL 5117 17.280 23.680 2.540 1.00 0.00 ATOM 30455 H2 SOL 5117 15.980 24.060 1.860 1.00 0.00 ATOM 30456 OH2 SOL 5118 16.940 58.020 68.020 1.00 0.00 ATOM 30457 H1 SOL 5118 16.340 58.460 68.620 1.00 0.00 ATOM 30458 H2 SOL 5118 16.810 58.460 67.180 1.00 0.00 ATOM 30459 OH2 SOL 5119 9.410 53.510 16.020 1.00 0.00 ATOM 30460 H1 SOL 5119 9.760 53.380 16.900 1.00 0.00 ATOM 30461 H2 SOL 5119 9.950 54.210 15.650 1.00 0.00 ATOM 30462 OH2 SOL 5120 18.270 35.740 0.810 1.00 0.00 ATOM 30463 H1 SOL 5120 19.150 35.380 0.780 1.00 0.00 ATOM 30464 H2 SOL 5120 18.000 35.790 -0.110 1.00 0.00 ATOM 30465 OH2 SOL 5121 23.060 9.250 13.250 1.00 0.00 ATOM 30466 H1 SOL 5121 23.190 8.320 13.440 1.00 0.00 ATOM 30467 H2 SOL 5121 23.370 9.360 12.350 1.00 0.00 ATOM 30468 OH2 SOL 5122 58.380 1.390 11.770 1.00 0.00 ATOM 30469 H1 SOL 5122 58.470 1.970 11.010 1.00 0.00 ATOM 30470 H2 SOL 5122 58.630 0.530 11.450 1.00 0.00 ATOM 30471 OH2 SOL 5123 12.080 20.040 15.740 1.00 0.00 ATOM 30472 H1 SOL 5123 11.290 19.650 15.360 1.00 0.00 ATOM 30473 H2 SOL 5123 12.570 20.370 15.000 1.00 0.00 ATOM 30474 OH2 SOL 5124 53.920 26.250 63.270 1.00 0.00 ATOM 30475 H1 SOL 5124 54.760 26.310 62.830 1.00 0.00 ATOM 30476 H2 SOL 5124 53.500 27.100 63.130 1.00 0.00 ATOM 30477 OH2 SOL 5125 43.040 52.120 6.120 1.00 0.00 ATOM 30478 H1 SOL 5125 42.170 52.320 6.470 1.00 0.00 ATOM 30479 H2 SOL 5125 43.550 51.850 6.880 1.00 0.00 ATOM 30480 OH2 SOL 5126 54.100 10.090 69.260 1.00 0.00 ATOM 30481 H1 SOL 5126 54.140 9.690 68.400 1.00 0.00 ATOM 30482 H2 SOL 5126 54.190 11.030 69.090 1.00 0.00 ATOM 30483 OH2 SOL 5127 25.210 13.860 72.890 1.00 0.00 ATOM 30484 H1 SOL 5127 25.520 13.450 72.080 1.00 0.00 ATOM 30485 H2 SOL 5127 24.260 13.830 72.830 1.00 0.00 ATOM 30486 OH2 SOL 5128 24.230 52.860 81.680 1.00 0.00 ATOM 30487 H1 SOL 5128 23.910 51.980 81.850 1.00 0.00 ATOM 30488 H2 SOL 5128 25.040 52.740 81.190 1.00 0.00 ATOM 30489 OH2 SOL 5129 39.680 59.100 74.140 1.00 0.00 ATOM 30490 H1 SOL 5129 38.970 59.480 74.650 1.00 0.00 ATOM 30491 H2 SOL 5129 39.250 58.710 73.380 1.00 0.00 ATOM 30492 OH2 SOL 5130 33.000 51.030 78.650 1.00 0.00 ATOM 30493 H1 SOL 5130 33.010 50.780 79.570 1.00 0.00 ATOM 30494 H2 SOL 5130 33.770 50.600 78.280 1.00 0.00 ATOM 30495 OH2 SOL 5131 43.270 30.490 79.430 1.00 0.00 ATOM 30496 H1 SOL 5131 43.730 29.650 79.330 1.00 0.00 ATOM 30497 H2 SOL 5131 42.650 30.340 80.140 1.00 0.00 ATOM 30498 OH2 SOL 5132 34.540 40.510 84.450 1.00 0.00 ATOM 30499 H1 SOL 5132 33.700 40.510 83.990 1.00 0.00 ATOM 30500 H2 SOL 5132 34.590 39.640 84.840 1.00 0.00 ATOM 30501 OH2 SOL 5133 5.930 33.650 18.550 1.00 0.00 ATOM 30502 H1 SOL 5133 6.220 32.760 18.750 1.00 0.00 ATOM 30503 H2 SOL 5133 5.130 33.770 19.060 1.00 0.00 ATOM 30504 OH2 SOL 5134 37.770 50.470 70.550 1.00 0.00 ATOM 30505 H1 SOL 5134 37.610 51.180 71.180 1.00 0.00 ATOM 30506 H2 SOL 5134 38.030 50.920 69.750 1.00 0.00 ATOM 30507 OH2 SOL 5135 26.710 47.750 71.940 1.00 0.00 ATOM 30508 H1 SOL 5135 25.820 48.020 71.700 1.00 0.00 ATOM 30509 H2 SOL 5135 27.200 48.560 72.020 1.00 0.00 ATOM 30510 OH2 SOL 5136 35.620 1.870 84.810 1.00 0.00 ATOM 30511 H1 SOL 5136 35.040 2.250 84.150 1.00 0.00 ATOM 30512 H2 SOL 5136 36.500 2.120 84.530 1.00 0.00 ATOM 30513 OH2 SOL 5137 11.110 37.960 83.610 1.00 0.00 ATOM 30514 H1 SOL 5137 11.970 38.350 83.420 1.00 0.00 ATOM 30515 H2 SOL 5137 11.080 37.920 84.570 1.00 0.00 ATOM 30516 OH2 SOL 5138 10.920 20.240 5.050 1.00 0.00 ATOM 30517 H1 SOL 5138 11.840 20.340 4.790 1.00 0.00 ATOM 30518 H2 SOL 5138 10.430 20.330 4.240 1.00 0.00 ATOM 30519 OH2 SOL 5139 5.170 32.690 68.800 1.00 0.00 ATOM 30520 H1 SOL 5139 4.660 33.220 69.410 1.00 0.00 ATOM 30521 H2 SOL 5139 5.120 33.170 67.970 1.00 0.00 ATOM 30522 OH2 SOL 5140 50.330 1.020 2.840 1.00 0.00 ATOM 30523 H1 SOL 5140 50.030 1.920 2.780 1.00 0.00 ATOM 30524 H2 SOL 5140 50.970 0.930 2.130 1.00 0.00 ATOM 30525 OH2 SOL 5141 5.170 57.680 65.860 1.00 0.00 ATOM 30526 H1 SOL 5141 4.960 56.780 65.620 1.00 0.00 ATOM 30527 H2 SOL 5141 6.120 57.750 65.730 1.00 0.00 ATOM 30528 OH2 SOL 5142 31.980 4.770 11.620 1.00 0.00 ATOM 30529 H1 SOL 5142 31.130 5.130 11.360 1.00 0.00 ATOM 30530 H2 SOL 5142 31.890 3.830 11.500 1.00 0.00 ATOM 30531 OH2 SOL 5143 46.660 32.700 8.250 1.00 0.00 ATOM 30532 H1 SOL 5143 46.970 33.280 7.560 1.00 0.00 ATOM 30533 H2 SOL 5143 47.270 31.960 8.220 1.00 0.00 ATOM 30534 OH2 SOL 5144 3.620 30.970 10.490 1.00 0.00 ATOM 30535 H1 SOL 5144 3.710 30.030 10.640 1.00 0.00 ATOM 30536 H2 SOL 5144 3.620 31.350 11.370 1.00 0.00 ATOM 30537 OH2 SOL 5145 43.440 3.720 63.170 1.00 0.00 ATOM 30538 H1 SOL 5145 43.180 2.800 63.070 1.00 0.00 ATOM 30539 H2 SOL 5145 43.190 4.130 62.340 1.00 0.00 ATOM 30540 OH2 SOL 5146 58.850 9.200 80.900 1.00 0.00 ATOM 30541 H1 SOL 5146 58.040 8.920 81.330 1.00 0.00 ATOM 30542 H2 SOL 5146 59.520 9.150 81.590 1.00 0.00 ATOM 30543 OH2 SOL 5147 0.210 16.310 62.700 1.00 0.00 ATOM 30544 H1 SOL 5147 0.470 17.170 63.040 1.00 0.00 ATOM 30545 H2 SOL 5147 -0.360 15.950 63.380 1.00 0.00 ATOM 30546 OH2 SOL 5148 56.500 32.220 12.590 1.00 0.00 ATOM 30547 H1 SOL 5148 56.930 31.450 12.200 1.00 0.00 ATOM 30548 H2 SOL 5148 56.040 31.870 13.360 1.00 0.00 ATOM 30549 OH2 SOL 5149 20.580 41.660 75.710 1.00 0.00 ATOM 30550 H1 SOL 5149 20.240 42.300 75.090 1.00 0.00 ATOM 30551 H2 SOL 5149 21.410 41.360 75.320 1.00 0.00 ATOM 30552 OH2 SOL 5150 5.450 5.870 7.090 1.00 0.00 ATOM 30553 H1 SOL 5150 5.150 5.710 7.990 1.00 0.00 ATOM 30554 H2 SOL 5150 6.400 5.970 7.170 1.00 0.00 ATOM 30555 OH2 SOL 5151 24.200 16.410 72.140 1.00 0.00 ATOM 30556 H1 SOL 5151 24.690 16.740 71.390 1.00 0.00 ATOM 30557 H2 SOL 5151 24.260 15.460 72.070 1.00 0.00 ATOM 30558 OH2 SOL 5152 32.910 15.850 16.010 1.00 0.00 ATOM 30559 H1 SOL 5152 32.070 15.390 16.090 1.00 0.00 ATOM 30560 H2 SOL 5152 32.770 16.490 15.310 1.00 0.00 ATOM 30561 OH2 SOL 5153 46.580 30.050 73.570 1.00 0.00 ATOM 30562 H1 SOL 5153 46.950 29.170 73.640 1.00 0.00 ATOM 30563 H2 SOL 5153 46.060 30.020 72.770 1.00 0.00 ATOM 30564 OH2 SOL 5154 7.810 23.620 15.520 1.00 0.00 ATOM 30565 H1 SOL 5154 7.520 23.400 14.630 1.00 0.00 ATOM 30566 H2 SOL 5154 8.710 23.280 15.570 1.00 0.00 ATOM 30567 OH2 SOL 5155 52.970 35.890 74.870 1.00 0.00 ATOM 30568 H1 SOL 5155 52.140 35.840 74.410 1.00 0.00 ATOM 30569 H2 SOL 5155 53.550 35.290 74.410 1.00 0.00 ATOM 30570 OH2 SOL 5156 23.560 16.260 67.820 1.00 0.00 ATOM 30571 H1 SOL 5156 24.390 16.520 67.420 1.00 0.00 ATOM 30572 H2 SOL 5156 23.680 15.330 68.020 1.00 0.00 ATOM 30573 OH2 SOL 5157 22.480 13.900 75.610 1.00 0.00 ATOM 30574 H1 SOL 5157 22.310 13.960 76.550 1.00 0.00 ATOM 30575 H2 SOL 5157 22.020 14.650 75.230 1.00 0.00 ATOM 30576 OH2 SOL 5158 10.480 47.560 67.570 1.00 0.00 ATOM 30577 H1 SOL 5158 11.410 47.760 67.700 1.00 0.00 ATOM 30578 H2 SOL 5158 10.140 47.410 68.450 1.00 0.00 ATOM 30579 OH2 SOL 5159 33.830 3.680 59.480 1.00 0.00 ATOM 30580 H1 SOL 5159 34.120 4.380 58.890 1.00 0.00 ATOM 30581 H2 SOL 5159 34.610 3.480 60.000 1.00 0.00 ATOM 30582 OH2 SOL 5160 3.950 13.640 23.770 1.00 0.00 ATOM 30583 H1 SOL 5160 3.770 14.560 23.920 1.00 0.00 ATOM 30584 H2 SOL 5160 4.590 13.400 24.440 1.00 0.00 ATOM 30585 OH2 SOL 5161 20.970 50.820 6.480 1.00 0.00 ATOM 30586 H1 SOL 5161 21.280 50.850 5.570 1.00 0.00 ATOM 30587 H2 SOL 5161 21.420 51.550 6.910 1.00 0.00 ATOM 30588 OH2 SOL 5162 36.640 30.540 74.700 1.00 0.00 ATOM 30589 H1 SOL 5162 36.090 30.630 73.920 1.00 0.00 ATOM 30590 H2 SOL 5162 37.520 30.740 74.390 1.00 0.00 ATOM 30591 OH2 SOL 5163 40.320 3.110 10.520 1.00 0.00 ATOM 30592 H1 SOL 5163 40.210 2.760 9.630 1.00 0.00 ATOM 30593 H2 SOL 5163 40.600 2.360 11.040 1.00 0.00 ATOM 30594 OH2 SOL 5164 55.890 20.590 74.360 1.00 0.00 ATOM 30595 H1 SOL 5164 55.820 19.890 75.000 1.00 0.00 ATOM 30596 H2 SOL 5164 55.380 21.310 74.730 1.00 0.00 ATOM 30597 OH2 SOL 5165 49.590 52.410 3.510 1.00 0.00 ATOM 30598 H1 SOL 5165 49.920 52.490 4.410 1.00 0.00 ATOM 30599 H2 SOL 5165 49.990 53.140 3.040 1.00 0.00 ATOM 30600 OH2 SOL 5166 6.140 2.740 77.230 1.00 0.00 ATOM 30601 H1 SOL 5166 6.390 3.160 78.060 1.00 0.00 ATOM 30602 H2 SOL 5166 5.190 2.730 77.250 1.00 0.00 ATOM 30603 OH2 SOL 5167 3.690 8.330 23.820 1.00 0.00 ATOM 30604 H1 SOL 5167 2.780 8.170 24.040 1.00 0.00 ATOM 30605 H2 SOL 5167 4.160 7.600 24.220 1.00 0.00 ATOM 30606 OH2 SOL 5168 26.430 27.750 19.840 1.00 0.00 ATOM 30607 H1 SOL 5168 27.220 28.150 20.210 1.00 0.00 ATOM 30608 H2 SOL 5168 26.630 26.820 19.810 1.00 0.00 ATOM 30609 OH2 SOL 5169 57.330 17.260 77.110 1.00 0.00 ATOM 30610 H1 SOL 5169 57.880 17.130 76.330 1.00 0.00 ATOM 30611 H2 SOL 5169 57.950 17.470 77.800 1.00 0.00 ATOM 30612 OH2 SOL 5170 20.450 10.940 1.890 1.00 0.00 ATOM 30613 H1 SOL 5170 20.260 11.060 2.820 1.00 0.00 ATOM 30614 H2 SOL 5170 19.590 10.940 1.470 1.00 0.00 ATOM 30615 OH2 SOL 5171 13.810 16.110 68.960 1.00 0.00 ATOM 30616 H1 SOL 5171 13.580 15.930 68.050 1.00 0.00 ATOM 30617 H2 SOL 5171 14.700 16.470 68.930 1.00 0.00 ATOM 30618 OH2 SOL 5172 16.320 28.970 8.000 1.00 0.00 ATOM 30619 H1 SOL 5172 16.290 28.300 8.680 1.00 0.00 ATOM 30620 H2 SOL 5172 16.250 29.800 8.480 1.00 0.00 ATOM 30621 OH2 SOL 5173 15.920 46.430 84.270 1.00 0.00 ATOM 30622 H1 SOL 5173 16.520 46.800 83.620 1.00 0.00 ATOM 30623 H2 SOL 5173 15.270 47.120 84.410 1.00 0.00 ATOM 30624 OH2 SOL 5174 23.570 29.320 17.930 1.00 0.00 ATOM 30625 H1 SOL 5174 23.920 29.000 17.100 1.00 0.00 ATOM 30626 H2 SOL 5174 23.210 30.180 17.730 1.00 0.00 ATOM 30627 OH2 SOL 5175 35.500 36.620 5.410 1.00 0.00 ATOM 30628 H1 SOL 5175 35.380 35.750 5.050 1.00 0.00 ATOM 30629 H2 SOL 5175 34.890 37.170 4.910 1.00 0.00 ATOM 30630 OH2 SOL 5176 38.470 38.210 74.380 1.00 0.00 ATOM 30631 H1 SOL 5176 37.920 37.440 74.260 1.00 0.00 ATOM 30632 H2 SOL 5176 37.930 38.950 74.110 1.00 0.00 ATOM 30633 OH2 SOL 5177 31.280 19.870 79.660 1.00 0.00 ATOM 30634 H1 SOL 5177 32.200 20.130 79.600 1.00 0.00 ATOM 30635 H2 SOL 5177 30.930 19.980 78.780 1.00 0.00 ATOM 30636 OH2 SOL 5178 28.270 60.490 77.630 1.00 0.00 ATOM 30637 H1 SOL 5178 27.620 59.780 77.540 1.00 0.00 ATOM 30638 H2 SOL 5178 28.100 61.060 76.880 1.00 0.00 ATOM 30639 OH2 SOL 5179 38.800 7.980 20.590 1.00 0.00 ATOM 30640 H1 SOL 5179 38.080 7.720 21.160 1.00 0.00 ATOM 30641 H2 SOL 5179 38.370 8.390 19.830 1.00 0.00 ATOM 30642 OH2 SOL 5180 7.320 23.720 82.470 1.00 0.00 ATOM 30643 H1 SOL 5180 6.370 23.630 82.550 1.00 0.00 ATOM 30644 H2 SOL 5180 7.470 24.660 82.550 1.00 0.00 ATOM 30645 OH2 SOL 5181 41.780 4.410 73.740 1.00 0.00 ATOM 30646 H1 SOL 5181 41.840 3.690 74.360 1.00 0.00 ATOM 30647 H2 SOL 5181 41.380 5.130 74.230 1.00 0.00 ATOM 30648 OH2 SOL 5182 33.030 33.890 20.750 1.00 0.00 ATOM 30649 H1 SOL 5182 32.590 33.350 21.410 1.00 0.00 ATOM 30650 H2 SOL 5182 32.830 33.460 19.920 1.00 0.00 ATOM 30651 OH2 SOL 5183 10.500 58.640 73.990 1.00 0.00 ATOM 30652 H1 SOL 5183 10.400 59.490 74.410 1.00 0.00 ATOM 30653 H2 SOL 5183 10.070 58.020 74.580 1.00 0.00 ATOM 30654 OH2 SOL 5184 8.830 16.880 12.880 1.00 0.00 ATOM 30655 H1 SOL 5184 8.620 16.510 13.740 1.00 0.00 ATOM 30656 H2 SOL 5184 8.590 16.190 12.260 1.00 0.00 ATOM 30657 OH2 SOL 5185 23.860 25.640 4.330 1.00 0.00 ATOM 30658 H1 SOL 5185 24.670 25.410 4.780 1.00 0.00 ATOM 30659 H2 SOL 5185 23.200 25.040 4.700 1.00 0.00 ATOM 30660 OH2 SOL 5186 6.360 22.470 70.060 1.00 0.00 ATOM 30661 H1 SOL 5186 5.490 22.800 69.850 1.00 0.00 ATOM 30662 H2 SOL 5186 6.190 21.610 70.460 1.00 0.00 ATOM 30663 OH2 SOL 5187 48.080 20.560 63.300 1.00 0.00 ATOM 30664 H1 SOL 5187 47.150 20.500 63.080 1.00 0.00 ATOM 30665 H2 SOL 5187 48.420 19.670 63.150 1.00 0.00 ATOM 30666 OH2 SOL 5188 33.840 36.170 10.490 1.00 0.00 ATOM 30667 H1 SOL 5188 33.040 35.650 10.420 1.00 0.00 ATOM 30668 H2 SOL 5188 34.080 36.360 9.580 1.00 0.00 ATOM 30669 OH2 SOL 5189 59.340 18.680 27.490 1.00 0.00 ATOM 30670 H1 SOL 5189 59.330 19.360 28.150 1.00 0.00 ATOM 30671 H2 SOL 5189 59.980 18.040 27.800 1.00 0.00 ATOM 30672 OH2 SOL 5190 35.480 46.570 7.030 1.00 0.00 ATOM 30673 H1 SOL 5190 35.800 47.350 7.480 1.00 0.00 ATOM 30674 H2 SOL 5190 34.730 46.880 6.520 1.00 0.00 ATOM 30675 OH2 SOL 5191 50.670 12.800 79.830 1.00 0.00 ATOM 30676 H1 SOL 5191 51.600 12.850 80.060 1.00 0.00 ATOM 30677 H2 SOL 5191 50.660 12.490 78.930 1.00 0.00 ATOM 30678 OH2 SOL 5192 37.580 3.740 13.640 1.00 0.00 ATOM 30679 H1 SOL 5192 37.780 4.130 12.780 1.00 0.00 ATOM 30680 H2 SOL 5192 36.970 3.040 13.440 1.00 0.00 ATOM 30681 OH2 SOL 5193 10.400 23.370 4.510 1.00 0.00 ATOM 30682 H1 SOL 5193 10.920 23.690 5.250 1.00 0.00 ATOM 30683 H2 SOL 5193 10.200 22.460 4.730 1.00 0.00 ATOM 30684 OH2 SOL 5194 36.350 50.070 7.310 1.00 0.00 ATOM 30685 H1 SOL 5194 37.070 50.500 7.770 1.00 0.00 ATOM 30686 H2 SOL 5194 35.730 49.840 7.990 1.00 0.00 ATOM 30687 OH2 SOL 5195 0.560 35.240 76.340 1.00 0.00 ATOM 30688 H1 SOL 5195 0.210 36.120 76.180 1.00 0.00 ATOM 30689 H2 SOL 5195 1.260 35.370 76.980 1.00 0.00 ATOM 30690 OH2 SOL 5196 18.100 60.350 17.400 1.00 0.00 ATOM 30691 H1 SOL 5196 18.050 59.400 17.520 1.00 0.00 ATOM 30692 H2 SOL 5196 18.180 60.470 16.460 1.00 0.00 ATOM 30693 OH2 SOL 5197 13.470 33.060 79.290 1.00 0.00 ATOM 30694 H1 SOL 5197 13.430 32.290 79.850 1.00 0.00 ATOM 30695 H2 SOL 5197 13.130 32.760 78.440 1.00 0.00 ATOM 30696 OH2 SOL 5198 26.370 1.290 11.880 1.00 0.00 ATOM 30697 H1 SOL 5198 25.430 1.210 12.010 1.00 0.00 ATOM 30698 H2 SOL 5198 26.470 1.620 10.990 1.00 0.00 ATOM 30699 OH2 SOL 5199 30.610 52.270 79.320 1.00 0.00 ATOM 30700 H1 SOL 5199 31.500 51.960 79.140 1.00 0.00 ATOM 30701 H2 SOL 5199 30.190 52.320 78.460 1.00 0.00 ATOM 30702 OH2 SOL 5200 13.160 23.810 17.690 1.00 0.00 ATOM 30703 H1 SOL 5200 12.490 24.340 18.130 1.00 0.00 ATOM 30704 H2 SOL 5200 13.950 23.960 18.210 1.00 0.00 ATOM 30705 OH2 SOL 5201 19.870 47.830 77.680 1.00 0.00 ATOM 30706 H1 SOL 5201 18.970 47.610 77.460 1.00 0.00 ATOM 30707 H2 SOL 5201 20.280 47.000 77.900 1.00 0.00 ATOM 30708 OH2 SOL 5202 42.990 0.050 8.620 1.00 0.00 ATOM 30709 H1 SOL 5202 42.900 0.970 8.370 1.00 0.00 ATOM 30710 H2 SOL 5202 43.200 0.080 9.550 1.00 0.00 ATOM 30711 OH2 SOL 5203 30.470 3.540 6.390 1.00 0.00 ATOM 30712 H1 SOL 5203 31.020 2.800 6.170 1.00 0.00 ATOM 30713 H2 SOL 5203 31.030 4.310 6.240 1.00 0.00 ATOM 30714 OH2 SOL 5204 59.330 40.970 69.200 1.00 0.00 ATOM 30715 H1 SOL 5204 58.690 40.600 68.590 1.00 0.00 ATOM 30716 H2 SOL 5204 59.540 41.830 68.840 1.00 0.00 ATOM 30717 OH2 SOL 5205 47.040 42.750 63.760 1.00 0.00 ATOM 30718 H1 SOL 5205 46.850 42.600 62.840 1.00 0.00 ATOM 30719 H2 SOL 5205 46.230 43.100 64.120 1.00 0.00 ATOM 30720 OH2 SOL 5206 28.830 25.290 13.420 1.00 0.00 ATOM 30721 H1 SOL 5206 28.910 24.570 12.790 1.00 0.00 ATOM 30722 H2 SOL 5206 27.920 25.230 13.720 1.00 0.00 ATOM 30723 OH2 SOL 5207 16.530 33.550 70.670 1.00 0.00 ATOM 30724 H1 SOL 5207 16.140 32.700 70.870 1.00 0.00 ATOM 30725 H2 SOL 5207 16.680 33.960 71.530 1.00 0.00 ATOM 30726 OH2 SOL 5208 33.740 46.310 65.960 1.00 0.00 ATOM 30727 H1 SOL 5208 33.540 47.240 65.850 1.00 0.00 ATOM 30728 H2 SOL 5208 33.340 45.890 65.210 1.00 0.00 ATOM 30729 OH2 SOL 5209 54.280 33.090 70.590 1.00 0.00 ATOM 30730 H1 SOL 5209 53.740 33.510 69.910 1.00 0.00 ATOM 30731 H2 SOL 5209 55.060 33.640 70.650 1.00 0.00 ATOM 30732 OH2 SOL 5210 55.030 57.310 5.320 1.00 0.00 ATOM 30733 H1 SOL 5210 54.990 57.590 6.240 1.00 0.00 ATOM 30734 H2 SOL 5210 55.030 58.130 4.830 1.00 0.00 ATOM 30735 OH2 SOL 5211 2.860 42.410 12.310 1.00 0.00 ATOM 30736 H1 SOL 5211 2.830 41.600 11.820 1.00 0.00 ATOM 30737 H2 SOL 5211 2.030 42.440 12.780 1.00 0.00 ATOM 30738 OH2 SOL 5212 25.310 59.160 83.340 1.00 0.00 ATOM 30739 H1 SOL 5212 25.850 58.970 82.570 1.00 0.00 ATOM 30740 H2 SOL 5212 25.790 58.790 84.070 1.00 0.00 ATOM 30741 OH2 SOL 5213 38.260 31.290 3.100 1.00 0.00 ATOM 30742 H1 SOL 5213 38.440 32.200 2.870 1.00 0.00 ATOM 30743 H2 SOL 5213 39.130 30.890 3.210 1.00 0.00 ATOM 30744 OH2 SOL 5214 7.370 51.780 78.090 1.00 0.00 ATOM 30745 H1 SOL 5214 7.490 52.360 77.340 1.00 0.00 ATOM 30746 H2 SOL 5214 7.280 52.380 78.840 1.00 0.00 ATOM 30747 OH2 SOL 5215 39.210 5.700 8.370 1.00 0.00 ATOM 30748 H1 SOL 5215 39.900 6.300 8.630 1.00 0.00 ATOM 30749 H2 SOL 5215 38.440 5.980 8.870 1.00 0.00 ATOM 30750 OH2 SOL 5216 18.330 9.990 19.840 1.00 0.00 ATOM 30751 H1 SOL 5216 18.310 9.480 19.030 1.00 0.00 ATOM 30752 H2 SOL 5216 17.440 10.320 19.950 1.00 0.00 ATOM 30753 OH2 SOL 5217 53.940 16.000 7.280 1.00 0.00 ATOM 30754 H1 SOL 5217 54.360 16.020 8.140 1.00 0.00 ATOM 30755 H2 SOL 5217 54.360 16.700 6.790 1.00 0.00 ATOM 30756 OH2 SOL 5218 50.520 41.330 12.350 1.00 0.00 ATOM 30757 H1 SOL 5218 50.350 41.440 13.280 1.00 0.00 ATOM 30758 H2 SOL 5218 51.180 40.640 12.310 1.00 0.00 ATOM 30759 OH2 SOL 5219 18.250 52.970 17.760 1.00 0.00 ATOM 30760 H1 SOL 5219 17.970 52.490 16.980 1.00 0.00 ATOM 30761 H2 SOL 5219 18.440 52.290 18.410 1.00 0.00 ATOM 30762 OH2 SOL 5220 7.930 2.820 71.130 1.00 0.00 ATOM 30763 H1 SOL 5220 7.850 1.870 71.180 1.00 0.00 ATOM 30764 H2 SOL 5220 7.970 3.110 72.040 1.00 0.00 ATOM 30765 OH2 SOL 5221 16.010 53.440 6.560 1.00 0.00 ATOM 30766 H1 SOL 5221 16.120 52.580 6.150 1.00 0.00 ATOM 30767 H2 SOL 5221 15.670 54.000 5.850 1.00 0.00 ATOM 30768 OH2 SOL 5222 29.040 38.750 10.260 1.00 0.00 ATOM 30769 H1 SOL 5222 29.950 38.980 10.080 1.00 0.00 ATOM 30770 H2 SOL 5222 28.650 39.550 10.610 1.00 0.00 ATOM 30771 OH2 SOL 5223 12.420 50.310 72.580 1.00 0.00 ATOM 30772 H1 SOL 5223 11.570 49.890 72.500 1.00 0.00 ATOM 30773 H2 SOL 5223 12.220 51.220 72.820 1.00 0.00 ATOM 30774 OH2 SOL 5224 20.810 37.510 67.990 1.00 0.00 ATOM 30775 H1 SOL 5224 20.750 37.080 68.850 1.00 0.00 ATOM 30776 H2 SOL 5224 21.740 37.670 67.860 1.00 0.00 ATOM 30777 OH2 SOL 5225 35.460 50.610 23.780 1.00 0.00 ATOM 30778 H1 SOL 5225 35.120 50.760 24.660 1.00 0.00 ATOM 30779 H2 SOL 5225 35.330 51.440 23.330 1.00 0.00 ATOM 30780 OH2 SOL 5226 17.550 21.850 70.830 1.00 0.00 ATOM 30781 H1 SOL 5226 17.040 21.160 71.250 1.00 0.00 ATOM 30782 H2 SOL 5226 16.900 22.390 70.370 1.00 0.00 ATOM 30783 OH2 SOL 5227 18.510 57.680 17.050 1.00 0.00 ATOM 30784 H1 SOL 5227 19.210 57.380 16.460 1.00 0.00 ATOM 30785 H2 SOL 5227 18.710 57.270 17.890 1.00 0.00 ATOM 30786 OH2 SOL 5228 8.640 2.750 20.060 1.00 0.00 ATOM 30787 H1 SOL 5228 9.490 3.180 19.960 1.00 0.00 ATOM 30788 H2 SOL 5228 8.310 3.060 20.900 1.00 0.00 ATOM 30789 OH2 SOL 5229 33.440 57.760 71.500 1.00 0.00 ATOM 30790 H1 SOL 5229 32.640 57.920 70.990 1.00 0.00 ATOM 30791 H2 SOL 5229 33.660 58.620 71.860 1.00 0.00 ATOM 30792 OH2 SOL 5230 11.670 20.580 71.110 1.00 0.00 ATOM 30793 H1 SOL 5230 12.450 20.330 71.590 1.00 0.00 ATOM 30794 H2 SOL 5230 10.970 20.570 71.760 1.00 0.00 ATOM 30795 OH2 SOL 5231 16.970 40.610 10.310 1.00 0.00 ATOM 30796 H1 SOL 5231 16.070 40.570 10.630 1.00 0.00 ATOM 30797 H2 SOL 5231 17.010 41.420 9.800 1.00 0.00 ATOM 30798 OH2 SOL 5232 32.500 10.180 15.230 1.00 0.00 ATOM 30799 H1 SOL 5232 33.330 10.200 15.700 1.00 0.00 ATOM 30800 H2 SOL 5232 32.750 10.240 14.300 1.00 0.00 ATOM 30801 OH2 SOL 5233 51.160 29.580 73.760 1.00 0.00 ATOM 30802 H1 SOL 5233 50.550 29.410 74.480 1.00 0.00 ATOM 30803 H2 SOL 5233 51.060 30.510 73.570 1.00 0.00 ATOM 30804 OH2 SOL 5234 40.990 51.910 72.080 1.00 0.00 ATOM 30805 H1 SOL 5234 40.080 52.210 72.070 1.00 0.00 ATOM 30806 H2 SOL 5234 41.500 52.720 72.140 1.00 0.00 ATOM 30807 OH2 SOL 5235 39.560 21.130 16.860 1.00 0.00 ATOM 30808 H1 SOL 5235 40.450 20.860 16.640 1.00 0.00 ATOM 30809 H2 SOL 5235 39.670 21.770 17.560 1.00 0.00 ATOM 30810 OH2 SOL 5236 5.730 55.930 81.000 1.00 0.00 ATOM 30811 H1 SOL 5236 5.570 56.420 81.810 1.00 0.00 ATOM 30812 H2 SOL 5236 5.800 56.610 80.330 1.00 0.00 ATOM 30813 OH2 SOL 5237 11.630 19.560 79.630 1.00 0.00 ATOM 30814 H1 SOL 5237 10.700 19.720 79.450 1.00 0.00 ATOM 30815 H2 SOL 5237 11.740 18.620 79.480 1.00 0.00 ATOM 30816 OH2 SOL 5238 8.460 27.220 9.300 1.00 0.00 ATOM 30817 H1 SOL 5238 8.520 27.070 8.360 1.00 0.00 ATOM 30818 H2 SOL 5238 8.530 26.350 9.690 1.00 0.00 ATOM 30819 OH2 SOL 5239 12.180 47.680 15.550 1.00 0.00 ATOM 30820 H1 SOL 5239 12.600 46.820 15.610 1.00 0.00 ATOM 30821 H2 SOL 5239 11.250 47.490 15.470 1.00 0.00 ATOM 30822 OH2 SOL 5240 11.720 51.000 19.540 1.00 0.00 ATOM 30823 H1 SOL 5240 12.280 50.230 19.450 1.00 0.00 ATOM 30824 H2 SOL 5240 10.830 50.680 19.380 1.00 0.00 ATOM 30825 OH2 SOL 5241 9.730 18.520 15.540 1.00 0.00 ATOM 30826 H1 SOL 5241 9.990 18.510 14.620 1.00 0.00 ATOM 30827 H2 SOL 5241 8.780 18.480 15.520 1.00 0.00 ATOM 30828 OH2 SOL 5242 15.610 50.630 12.110 1.00 0.00 ATOM 30829 H1 SOL 5242 16.070 50.980 12.870 1.00 0.00 ATOM 30830 H2 SOL 5242 16.300 50.310 11.540 1.00 0.00 ATOM 30831 OH2 SOL 5243 58.010 27.750 20.770 1.00 0.00 ATOM 30832 H1 SOL 5243 57.690 27.280 21.540 1.00 0.00 ATOM 30833 H2 SOL 5243 58.660 27.170 20.390 1.00 0.00 ATOM 30834 OH2 SOL 5244 23.700 13.550 16.110 1.00 0.00 ATOM 30835 H1 SOL 5244 24.170 13.930 15.370 1.00 0.00 ATOM 30836 H2 SOL 5244 23.470 14.300 16.660 1.00 0.00 ATOM 30837 OH2 SOL 5245 10.640 41.430 64.090 1.00 0.00 ATOM 30838 H1 SOL 5245 9.840 41.330 64.600 1.00 0.00 ATOM 30839 H2 SOL 5245 11.120 40.610 64.230 1.00 0.00 ATOM 30840 OH2 SOL 5246 29.830 4.090 17.210 1.00 0.00 ATOM 30841 H1 SOL 5246 30.310 3.480 16.660 1.00 0.00 ATOM 30842 H2 SOL 5246 28.910 3.940 16.990 1.00 0.00 ATOM 30843 OH2 SOL 5247 20.170 20.060 4.190 1.00 0.00 ATOM 30844 H1 SOL 5247 19.490 20.270 3.550 1.00 0.00 ATOM 30845 H2 SOL 5247 20.820 19.570 3.690 1.00 0.00 ATOM 30846 OH2 SOL 5248 46.310 11.850 16.060 1.00 0.00 ATOM 30847 H1 SOL 5248 45.710 12.150 15.380 1.00 0.00 ATOM 30848 H2 SOL 5248 45.790 11.850 16.860 1.00 0.00 TER ENDMDL