Skip to content

GitLab

Commit 1878512f authored by Peter Eastman's avatar Peter Eastman
Browse files

Modeller supports SPC/E water

parent 4412050a
Hide whitespace changes
Inline Side-by-side
Showing with 2693 additions and 3 deletions
wrappers/python/simtk/openmm/app/data/spce.pdb 0 → 100644
View file @ 1878512f
CRYST1 30.000 30.000 30.000 90.00 90.00 90.00 P 1 1
ATOM 1 O HOH A 1 27.552 11.051 7.172 1.00 0.00
ATOM 2 H1 HOH A 1 27.900 10.721 8.050 1.00 0.00
ATOM 3 H2 HOH A 1 26.606 11.355 7.281 1.00 0.00
ATOM 4 O HOH A 2 15.041 22.415 5.577 1.00 0.00
ATOM 5 H1 HOH A 2 15.438 21.792 6.251 1.00 0.00
ATOM 6 H2 HOH A 2 15.775 22.861 5.063 1.00 0.00
ATOM 7 O HOH A 3 16.570 7.058 12.532 1.00 0.00
ATOM 8 H1 HOH A 3 17.286 7.621 12.945 1.00 0.00
ATOM 9 H2 HOH A 3 15.824 6.935 13.186 1.00 0.00
ATOM 10 O HOH A 4 18.632 3.856 7.343 1.00 0.00
ATOM 11 H1 HOH A 4 18.247 4.776 7.417 1.00 0.00
ATOM 12 H2 HOH A 4 17.897 3.181 7.407 1.00 0.00
ATOM 13 O HOH A 5 15.429 8.723 -0.026 1.00 0.00
ATOM 14 H1 HOH A 5 14.510 9.076 0.149 1.00 0.00
ATOM 15 H2 HOH A 5 15.661 8.039 0.665 1.00 0.00
ATOM 16 O HOH A 6 4.086 3.612 5.853 1.00 0.00
ATOM 17 H1 HOH A 6 4.690 3.401 5.085 1.00 0.00
ATOM 18 H2 HOH A 6 3.319 4.167 5.531 1.00 0.00
ATOM 19 O HOH A 7 5.132 9.354 19.087 1.00 0.00
ATOM 20 H1 HOH A 7 4.251 8.881 19.080 1.00 0.00
ATOM 21 H2 HOH A 7 5.858 8.709 18.847 1.00 0.00
ATOM 22 O HOH A 8 10.500 8.563 6.716 1.00 0.00
ATOM 23 H1 HOH A 8 10.011 9.041 7.446 1.00 0.00
ATOM 24 H2 HOH A 8 11.170 7.939 7.117 1.00 0.00
ATOM 25 O HOH A 9 5.917 11.816 14.357 1.00 0.00
ATOM 26 H1 HOH A 9 6.466 12.546 13.949 1.00 0.00
ATOM 27 H2 HOH A 9 5.492 11.274 13.632 1.00 0.00
ATOM 28 O HOH A 10 29.602 15.772 8.031 1.00 0.00
ATOM 29 H1 HOH A 10 30.111 16.628 8.120 1.00 0.00
ATOM 30 H2 HOH A 10 29.869 15.148 8.765 1.00 0.00
ATOM 31 O HOH A 11 17.544 18.177 18.588 1.00 0.00
ATOM 32 H1 HOH A 11 17.846 18.431 17.669 1.00 0.00
ATOM 33 H2 HOH A 11 18.269 17.664 19.048 1.00 0.00
ATOM 34 O HOH A 12 5.874 5.936 18.518 1.00 0.00
ATOM 35 H1 HOH A 12 5.618 5.943 17.551 1.00 0.00
ATOM 36 H2 HOH A 12 6.857 5.775 18.601 1.00 0.00
ATOM 37 O HOH A 13 12.115 2.866 7.013 1.00 0.00
ATOM 38 H1 HOH A 13 11.843 3.807 6.810 1.00 0.00
ATOM 39 H2 HOH A 13 11.816 2.625 7.937 1.00 0.00
ATOM 40 O HOH A 14 17.139 18.684 12.192 1.00 0.00
ATOM 41 H1 HOH A 14 16.285 19.078 12.532 1.00 0.00
ATOM 42 H2 HOH A 14 16.984 17.734 11.921 1.00 0.00
ATOM 43 O HOH A 15 4.623 21.685 6.355 1.00 0.00
ATOM 44 H1 HOH A 15 5.282 22.363 6.679 1.00 0.00
ATOM 45 H2 HOH A 15 3.791 22.148 6.051 1.00 0.00
ATOM 46 O HOH A 16 25.298 5.749 10.195 1.00 0.00
ATOM 47 H1 HOH A 16 25.103 5.992 11.145 1.00 0.00
ATOM 48 H2 HOH A 16 26.282 5.812 10.030 1.00 0.00
ATOM 49 O HOH A 17 29.059 11.821 13.263 1.00 0.00
ATOM 50 H1 HOH A 17 28.711 11.121 13.887 1.00 0.00
ATOM 51 H2 HOH A 17 29.841 12.283 13.682 1.00 0.00
ATOM 52 O HOH A 18 8.030 12.127 28.585 1.00 0.00
ATOM 53 H1 HOH A 18 7.148 12.485 28.893 1.00 0.00
ATOM 54 H2 HOH A 18 8.110 12.244 27.595 1.00 0.00
ATOM 55 O HOH A 19 20.565 29.419 17.668 1.00 0.00
ATOM 56 H1 HOH A 19 20.498 28.741 16.936 1.00 0.00
ATOM 57 H2 HOH A 19 20.928 30.274 17.299 1.00 0.00
ATOM 58 O HOH A 20 24.680 4.157 6.710 1.00 0.00
ATOM 59 H1 HOH A 20 24.399 4.991 7.185 1.00 0.00
ATOM 60 H2 HOH A 20 24.590 4.289 5.723 1.00 0.00
ATOM 61 O HOH A 21 17.076 12.558 4.862 1.00 0.00
ATOM 62 H1 HOH A 21 18.061 12.650 4.714 1.00 0.00
ATOM 63 H2 HOH A 21 16.879 12.617 5.841 1.00 0.00
ATOM 64 O HOH A 22 16.293 10.723 15.329 1.00 0.00
ATOM 65 H1 HOH A 22 15.698 11.471 15.036 1.00 0.00
ATOM 66 H2 HOH A 22 15.920 10.305 16.157 1.00 0.00
ATOM 67 O HOH A 23 21.503 10.423 0.539 1.00 0.00
ATOM 68 H1 HOH A 23 22.231 10.703 1.165 1.00 0.00
ATOM 69 H2 HOH A 23 20.663 10.917 0.762 1.00 0.00
ATOM 70 O HOH A 24 1.452 10.018 10.804 1.00 0.00
ATOM 71 H1 HOH A 24 1.298 10.898 11.253 1.00 0.00
ATOM 72 H2 HOH A 24 2.382 9.987 10.439 1.00 0.00
ATOM 73 O HOH A 25 11.018 12.606 5.398 1.00 0.00
ATOM 74 H1 HOH A 25 10.779 11.693 5.068 1.00 0.00
ATOM 75 H2 HOH A 25 10.346 13.268 5.067 1.00 0.00
ATOM 76 O HOH A 26 13.699 16.402 20.204 1.00 0.00
ATOM 77 H1 HOH A 26 13.404 17.348 20.068 1.00 0.00
ATOM 78 H2 HOH A 26 13.087 15.788 19.706 1.00 0.00
ATOM 79 O HOH A 27 10.986 0.924 11.295 1.00 0.00
ATOM 80 H1 HOH A 27 11.979 0.836 11.366 1.00 0.00
ATOM 81 H2 HOH A 27 10.569 0.712 12.179 1.00 0.00
ATOM 82 O HOH A 28 14.277 3.972 5.505 1.00 0.00
ATOM 83 H1 HOH A 28 14.449 4.892 5.858 1.00 0.00
ATOM 84 H2 HOH A 28 13.911 3.398 6.238 1.00 0.00
ATOM 85 O HOH A 29 9.481 18.461 11.196 1.00 0.00
ATOM 86 H1 HOH A 29 10.300 19.022 11.317 1.00 0.00
ATOM 87 H2 HOH A 29 8.689 19.053 11.051 1.00 0.00
ATOM 88 O HOH A 30 4.183 4.889 20.289 1.00 0.00
ATOM 89 H1 HOH A 30 4.740 5.118 19.491 1.00 0.00
ATOM 90 H2 HOH A 30 3.728 4.011 20.139 1.00 0.00
ATOM 91 O HOH A 31 17.261 16.069 11.435 1.00 0.00
ATOM 92 H1 HOH A 31 16.754 15.265 11.747 1.00 0.00
ATOM 93 H2 HOH A 31 18.004 15.781 10.831 1.00 0.00
ATOM 94 O HOH A 32 16.516 24.393 4.133 1.00 0.00
ATOM 95 H1 HOH A 32 16.811 25.334 4.298 1.00 0.00
ATOM 96 H2 HOH A 32 16.478 24.224 3.148 1.00 0.00
ATOM 97 O HOH A 33 9.005 7.290 4.390 1.00 0.00
ATOM 98 H1 HOH A 33 9.506 7.788 5.097 1.00 0.00
ATOM 99 H2 HOH A 33 8.169 7.788 4.160 1.00 0.00
ATOM 100 O HOH A 34 7.867 3.770 6.144 1.00 0.00
ATOM 101 H1 HOH A 34 8.644 3.766 5.514 1.00 0.00
ATOM 102 H2 HOH A 34 7.023 3.922 5.630 1.00 0.00
ATOM 103 O HOH A 35 17.912 15.030 6.104 1.00 0.00
ATOM 104 H1 HOH A 35 18.081 16.006 6.240 1.00 0.00
ATOM 105 H2 HOH A 35 18.302 14.744 5.229 1.00 0.00
ATOM 106 O HOH A 36 5.724 2.759 11.297 1.00 0.00
ATOM 107 H1 HOH A 36 6.084 2.117 10.620 1.00 0.00
ATOM 108 H2 HOH A 36 6.463 3.346 11.627 1.00 0.00
ATOM 109 O HOH A 37 20.439 4.704 16.258 1.00 0.00
ATOM 110 H1 HOH A 37 20.753 4.306 15.397 1.00 0.00
ATOM 111 H2 HOH A 37 20.553 4.038 16.995 1.00 0.00
ATOM 112 O HOH A 38 9.483 2.706 13.859 1.00 0.00
ATOM 113 H1 HOH A 38 10.393 3.071 14.059 1.00 0.00
ATOM 114 H2 HOH A 38 9.314 1.902 14.429 1.00 0.00
ATOM 115 O HOH A 39 1.079 28.139 12.952 1.00 0.00
ATOM 116 H1 HOH A 39 1.223 27.412 13.623 1.00 0.00
ATOM 117 H2 HOH A 39 0.859 28.991 13.425 1.00 0.00
ATOM 118 O HOH A 40 11.894 12.981 12.325 1.00 0.00
ATOM 119 H1 HOH A 40 12.511 13.768 12.322 1.00 0.00
ATOM 120 H2 HOH A 40 11.024 13.237 11.904 1.00 0.00
ATOM 121 O HOH A 41 24.672 15.539 12.116 1.00 0.00
ATOM 122 H1 HOH A 41 24.392 16.442 11.789 1.00 0.00
ATOM 123 H2 HOH A 41 24.497 15.471 13.098 1.00 0.00
ATOM 124 O HOH A 42 9.854 6.206 0.084 1.00 0.00
ATOM 125 H1 HOH A 42 8.881 6.410 -0.026 1.00 0.00
ATOM 126 H2 HOH A 42 10.004 5.765 0.969 1.00 0.00
ATOM 127 O HOH A 43 15.123 6.628 15.837 1.00 0.00
ATOM 128 H1 HOH A 43 14.514 6.379 16.590 1.00 0.00
ATOM 129 H2 HOH A 43 15.998 6.156 15.946 1.00 0.00
ATOM 130 O HOH A 44 15.864 6.146 10.159 1.00 0.00
ATOM 131 H1 HOH A 44 16.280 6.053 11.063 1.00 0.00
ATOM 132 H2 HOH A 44 15.159 6.855 10.188 1.00 0.00
ATOM 133 O HOH A 45 1.957 27.652 8.312 1.00 0.00
ATOM 134 H1 HOH A 45 1.108 27.943 7.870 1.00 0.00
ATOM 135 H2 HOH A 45 2.735 28.083 7.855 1.00 0.00
ATOM 136 O HOH A 46 9.050 14.319 7.733 1.00 0.00
ATOM 137 H1 HOH A 46 9.213 15.223 8.129 1.00 0.00
ATOM 138 H2 HOH A 46 9.845 14.044 7.193 1.00 0.00
ATOM 139 O HOH A 47 0.260 20.523 6.007 1.00 0.00
ATOM 140 H1 HOH A 47 0.380 20.736 6.976 1.00 0.00
ATOM 141 H2 HOH A 47 0.162 19.535 5.892 1.00 0.00
ATOM 142 O HOH A 48 24.094 8.900 5.467 1.00 0.00
ATOM 143 H1 HOH A 48 23.098 8.940 5.544 1.00 0.00
ATOM 144 H2 HOH A 48 24.357 8.070 4.974 1.00 0.00
ATOM 145 O HOH A 49 8.514 16.211 12.890 1.00 0.00
ATOM 146 H1 HOH A 49 8.663 16.829 12.119 1.00 0.00
ATOM 147 H2 HOH A 49 9.394 15.973 13.301 1.00 0.00
ATOM 148 O HOH A 50 14.448 10.813 11.256 1.00 0.00
ATOM 149 H1 HOH A 50 15.372 10.682 11.614 1.00 0.00
ATOM 150 H2 HOH A 50 14.295 11.785 11.075 1.00 0.00
ATOM 151 O HOH A 51 2.873 7.454 19.331 1.00 0.00
ATOM 152 H1 HOH A 51 2.290 6.835 18.805 1.00 0.00
ATOM 153 H2 HOH A 51 3.082 7.042 20.218 1.00 0.00
ATOM 154 O HOH A 52 12.942 14.852 6.490 1.00 0.00
ATOM 155 H1 HOH A 52 12.716 15.577 5.839 1.00 0.00
ATOM 156 H2 HOH A 52 12.524 13.994 6.191 1.00 0.00
ATOM 157 O HOH A 53 2.694 27.433 10.984 1.00 0.00
ATOM 158 H1 HOH A 53 2.299 27.500 10.067 1.00 0.00
ATOM 159 H2 HOH A 53 2.022 27.738 11.659 1.00 0.00
ATOM 160 O HOH A 54 22.196 13.327 5.375 1.00 0.00
ATOM 161 H1 HOH A 54 22.575 12.651 4.743 1.00 0.00
ATOM 162 H2 HOH A 54 22.235 14.234 4.957 1.00 0.00
ATOM 163 O HOH A 55 9.926 12.004 0.729 1.00 0.00
ATOM 164 H1 HOH A 55 10.417 12.848 0.946 1.00 0.00
ATOM 165 H2 HOH A 55 9.333 12.157 -0.061 1.00 0.00
ATOM 166 O HOH A 56 13.525 1.010 28.224 1.00 0.00
ATOM 167 H1 HOH A 56 12.977 1.697 27.748 1.00 0.00
ATOM 168 H2 HOH A 56 13.456 1.153 29.211 1.00 0.00
ATOM 169 O HOH A 57 5.363 18.292 9.528 1.00 0.00
ATOM 170 H1 HOH A 57 4.959 17.462 9.914 1.00 0.00
ATOM 171 H2 HOH A 57 6.065 18.041 8.862 1.00 0.00
ATOM 172 O HOH A 58 5.495 6.720 3.167 1.00 0.00
ATOM 173 H1 HOH A 58 5.967 6.965 4.013 1.00 0.00
ATOM 174 H2 HOH A 58 6.148 6.319 2.525 1.00 0.00
ATOM 175 O HOH A 59 11.530 3.519 18.929 1.00 0.00
ATOM 176 H1 HOH A 59 11.289 3.877 19.831 1.00 0.00
ATOM 177 H2 HOH A 59 12.449 3.125 18.961 1.00 0.00
ATOM 178 O HOH A 60 3.526 4.561 28.508 1.00 0.00
ATOM 179 H1 HOH A 60 2.957 4.387 27.704 1.00 0.00
ATOM 180 H2 HOH A 60 3.240 5.417 28.939 1.00 0.00
ATOM 181 O HOH A 61 7.275 28.129 16.975 1.00 0.00
ATOM 182 H1 HOH A 61 7.687 27.483 17.618 1.00 0.00
ATOM 183 H2 HOH A 61 7.296 27.740 16.054 1.00 0.00
ATOM 184 O HOH A 62 2.078 12.664 8.879 1.00 0.00
ATOM 185 H1 HOH A 62 2.360 13.495 8.400 1.00 0.00
ATOM 186 H2 HOH A 62 2.018 11.908 8.228 1.00 0.00
ATOM 187 O HOH A 63 11.196 11.549 16.861 1.00 0.00
ATOM 188 H1 HOH A 63 11.878 11.485 16.133 1.00 0.00
ATOM 189 H2 HOH A 63 10.647 12.374 16.732 1.00 0.00
ATOM 190 O HOH A 64 2.625 13.210 3.858 1.00 0.00
ATOM 191 H1 HOH A 64 3.244 12.845 4.554 1.00 0.00
ATOM 192 H2 HOH A 64 2.180 12.454 3.378 1.00 0.00
ATOM 193 O HOH A 65 3.975 1.643 7.884 1.00 0.00
ATOM 194 H1 HOH A 65 4.596 1.834 8.644 1.00 0.00
ATOM 195 H2 HOH A 65 3.937 2.437 7.277 1.00 0.00
ATOM 196 O HOH A 66 18.234 0.021 8.250 1.00 0.00
ATOM 197 H1 HOH A 66 17.301 0.145 8.589 1.00 0.00
ATOM 198 H2 HOH A 66 18.231 0.047 7.251 1.00 0.00
ATOM 199 O HOH A 67 18.495 10.313 7.632 1.00 0.00
ATOM 200 H1 HOH A 67 17.877 10.804 8.245 1.00 0.00
ATOM 201 H2 HOH A 67 17.961 9.760 6.992 1.00 0.00
ATOM 202 O HOH A 68 9.428 26.628 3.312 1.00 0.00
ATOM 203 H1 HOH A 68 9.087 27.567 3.370 1.00 0.00
ATOM 204 H2 HOH A 68 10.121 26.569 2.593 1.00 0.00
ATOM 205 O HOH A 69 6.409 1.292 9.309 1.00 0.00
ATOM 206 H1 HOH A 69 6.433 0.292 9.288 1.00 0.00
ATOM 207 H2 HOH A 69 7.169 1.654 8.769 1.00 0.00
ATOM 208 O HOH A 70 5.985 7.196 10.501 1.00 0.00
ATOM 209 H1 HOH A 70 6.571 6.595 9.958 1.00 0.00
ATOM 210 H2 HOH A 70 6.376 7.304 11.416 1.00 0.00
ATOM 211 O HOH A 71 1.860 7.952 7.959 1.00 0.00
ATOM 212 H1 HOH A 71 2.258 7.235 8.530 1.00 0.00
ATOM 213 H2 HOH A 71 0.972 7.648 7.612 1.00 0.00
ATOM 214 O HOH A 72 11.564 18.566 7.534 1.00 0.00
ATOM 215 H1 HOH A 72 12.536 18.711 7.347 1.00 0.00
ATOM 216 H2 HOH A 72 11.448 17.720 8.053 1.00 0.00
ATOM 217 O HOH A 73 13.427 4.879 28.756 1.00 0.00
ATOM 218 H1 HOH A 73 13.141 4.652 29.687 1.00 0.00
ATOM 219 H2 HOH A 73 12.812 4.438 28.102 1.00 0.00
ATOM 220 O HOH A 74 0.513 7.896 14.350 1.00 0.00
ATOM 221 H1 HOH A 74 -0.474 8.047 14.297 1.00 0.00
ATOM 222 H2 HOH A 74 0.879 7.753 13.430 1.00 0.00
ATOM 223 O HOH A 75 1.499 2.777 8.788 1.00 0.00
ATOM 224 H1 HOH A 75 1.658 2.618 9.763 1.00 0.00
ATOM 225 H2 HOH A 75 2.142 2.230 8.252 1.00 0.00
ATOM 226 O HOH A 76 4.116 28.755 7.175 1.00 0.00
ATOM 227 H1 HOH A 76 5.066 28.588 6.911 1.00 0.00
ATOM 228 H2 HOH A 76 3.965 29.739 7.271 1.00 0.00
ATOM 229 O HOH A 77 10.417 5.404 9.110 1.00 0.00
ATOM 230 H1 HOH A 77 9.451 5.622 9.256 1.00 0.00
ATOM 231 H2 HOH A 77 10.550 4.416 9.177 1.00 0.00
ATOM 232 O HOH A 78 12.598 15.669 8.899 1.00 0.00
ATOM 233 H1 HOH A 78 12.638 15.327 7.960 1.00 0.00
ATOM 234 H2 HOH A 78 13.424 16.197 9.096 1.00 0.00
ATOM 235 O HOH A 79 12.659 12.068 8.670 1.00 0.00
ATOM 236 H1 HOH A 79 12.273 12.982 8.799 1.00 0.00
ATOM 237 H2 HOH A 79 11.967 11.381 8.890 1.00 0.00
ATOM 238 O HOH A 80 28.233 16.045 4.281 1.00 0.00
ATOM 239 H1 HOH A 80 27.360 15.759 4.676 1.00 0.00
ATOM 240 H2 HOH A 80 28.830 15.250 4.180 1.00 0.00
ATOM 241 O HOH A 81 1.694 10.567 29.714 1.00 0.00
ATOM 242 H1 HOH A 81 2.419 9.925 29.463 1.00 0.00
ATOM 243 H2 HOH A 81 1.132 10.765 28.911 1.00 0.00
ATOM 244 O HOH A 82 14.496 6.794 6.004 1.00 0.00
ATOM 245 H1 HOH A 82 15.353 7.253 6.237 1.00 0.00
ATOM 246 H2 HOH A 82 13.939 6.690 6.828 1.00 0.00
ATOM 247 O HOH A 83 15.241 27.439 6.857 1.00 0.00
ATOM 248 H1 HOH A 83 15.782 27.418 6.016 1.00 0.00
ATOM 249 H2 HOH A 83 15.151 28.383 7.172 1.00 0.00
ATOM 250 O HOH A 84 7.766 28.719 27.805 1.00 0.00
ATOM 251 H1 HOH A 84 6.953 29.285 27.674 1.00 0.00
ATOM 252 H2 HOH A 84 7.634 28.123 28.597 1.00 0.00
ATOM 253 O HOH A 85 14.274 14.291 17.338 1.00 0.00
ATOM 254 H1 HOH A 85 13.377 14.535 17.706 1.00 0.00
ATOM 255 H2 HOH A 85 14.908 15.052 17.475 1.00 0.00
ATOM 256 O HOH A 86 8.289 8.879 14.231 1.00 0.00
ATOM 257 H1 HOH A 86 8.225 9.728 13.706 1.00 0.00
ATOM 258 H2 HOH A 86 9.247 8.693 14.447 1.00 0.00
ATOM 259 O HOH A 87 18.966 20.366 16.895 1.00 0.00
ATOM 260 H1 HOH A 87 19.029 21.285 16.507 1.00 0.00
ATOM 261 H2 HOH A 87 18.813 19.704 16.160 1.00 0.00
ATOM 262 O HOH A 88 13.461 17.990 13.186 1.00 0.00
ATOM 263 H1 HOH A 88 14.032 18.686 13.622 1.00 0.00
ATOM 264 H2 HOH A 88 13.926 17.106 13.223 1.00 0.00
ATOM 265 O HOH A 89 13.202 15.244 11.934 1.00 0.00
ATOM 266 H1 HOH A 89 13.705 14.562 11.403 1.00 0.00
ATOM 267 H2 HOH A 89 12.873 15.965 11.324 1.00 0.00
ATOM 268 O HOH A 90 10.393 2.722 9.338 1.00 0.00
ATOM 269 H1 HOH A 90 10.425 2.107 10.126 1.00 0.00
ATOM 270 H2 HOH A 90 9.672 2.424 8.713 1.00 0.00
ATOM 271 O HOH A 91 7.007 6.830 13.027 1.00 0.00
ATOM 272 H1 HOH A 91 7.272 6.033 13.569 1.00 0.00
ATOM 273 H2 HOH A 91 7.584 7.608 13.274 1.00 0.00
ATOM 274 O HOH A 92 14.100 8.220 9.903 1.00 0.00
ATOM 275 H1 HOH A 92 14.065 8.729 9.043 1.00 0.00
ATOM 276 H2 HOH A 92 14.081 8.860 10.670 1.00 0.00
ATOM 277 O HOH A 93 5.237 0.881 2.388 1.00 0.00
ATOM 278 H1 HOH A 93 4.990 0.528 1.486 1.00 0.00
ATOM 279 H2 HOH A 93 5.695 0.164 2.913 1.00 0.00
ATOM 280 O HOH A 94 7.194 27.538 7.570 1.00 0.00
ATOM 281 H1 HOH A 94 7.523 28.041 6.771 1.00 0.00
ATOM 282 H2 HOH A 94 7.403 28.057 8.399 1.00 0.00
ATOM 283 O HOH A 95 27.966 12.122 10.869 1.00 0.00
ATOM 284 H1 HOH A 95 26.979 12.242 10.971 1.00 0.00
ATOM 285 H2 HOH A 95 28.403 12.179 11.767 1.00 0.00
ATOM 286 O HOH A 96 4.964 11.680 2.333 1.00 0.00
ATOM 287 H1 HOH A 96 5.614 12.402 2.569 1.00 0.00
ATOM 288 H2 HOH A 96 4.315 12.024 1.653 1.00 0.00
ATOM 289 O HOH A 97 5.470 28.691 4.411 1.00 0.00
ATOM 290 H1 HOH A 97 4.775 29.328 4.745 1.00 0.00
ATOM 291 H2 HOH A 97 5.051 27.797 4.250 1.00 0.00
ATOM 292 O HOH A 98 14.393 13.572 10.080 1.00 0.00
ATOM 293 H1 HOH A 98 15.046 14.231 9.707 1.00 0.00
ATOM 294 H2 HOH A 98 14.060 12.981 9.346 1.00 0.00
ATOM 295 O HOH A 99 16.422 13.503 12.300 1.00 0.00
ATOM 296 H1 HOH A 99 16.931 12.646 12.220 1.00 0.00
ATOM 297 H2 HOH A 99 15.875 13.490 13.137 1.00 0.00
ATOM 298 O HOH A 100 17.540 6.326 7.680 1.00 0.00
ATOM 299 H1 HOH A 100 16.903 6.343 8.451 1.00 0.00
ATOM 300 H2 HOH A 100 17.689 7.258 7.351 1.00 0.00
ATOM 301 O HOH A 101 26.832 16.007 10.762 1.00 0.00
ATOM 302 H1 HOH A 101 26.727 15.669 9.827 1.00 0.00
ATOM 303 H2 HOH A 101 26.004 15.805 11.284 1.00 0.00
ATOM 304 O HOH A 102 0.856 9.868 18.984 1.00 0.00
ATOM 305 H1 HOH A 102 0.918 9.515 19.918 1.00 0.00
ATOM 306 H2 HOH A 102 1.231 9.194 18.348 1.00 0.00
ATOM 307 O HOH A 103 15.474 9.957 17.759 1.00 0.00
ATOM 308 H1 HOH A 103 15.215 10.604 18.476 1.00 0.00
ATOM 309 H2 HOH A 103 16.216 9.373 18.089 1.00 0.00
ATOM 310 O HOH A 104 10.010 29.551 13.518 1.00 0.00
ATOM 311 H1 HOH A 104 9.506 28.693 13.421 1.00 0.00
ATOM 312 H2 HOH A 104 9.735 30.005 14.365 1.00 0.00
ATOM 313 O HOH A 105 8.751 1.608 7.418 1.00 0.00
ATOM 314 H1 HOH A 105 8.658 0.787 6.855 1.00 0.00
ATOM 315 H2 HOH A 105 8.318 2.381 6.954 1.00 0.00
ATOM 316 O HOH A 106 4.116 8.611 6.541 1.00 0.00
ATOM 317 H1 HOH A 106 3.444 8.284 7.206 1.00 0.00
ATOM 318 H2 HOH A 106 3.709 8.608 5.628 1.00 0.00
ATOM 319 O HOH A 107 4.961 4.394 8.463 1.00 0.00
ATOM 320 H1 HOH A 107 5.013 4.163 7.491 1.00 0.00
ATOM 321 H2 HOH A 107 4.206 5.032 8.614 1.00 0.00
ATOM 322 O HOH A 108 10.165 3.908 4.270 1.00 0.00
ATOM 323 H1 HOH A 108 10.548 4.709 3.811 1.00 0.00
ATOM 324 H2 HOH A 108 10.869 3.479 4.836 1.00 0.00
ATOM 325 O HOH A 109 27.157 29.366 9.292 1.00 0.00
ATOM 326 H1 HOH A 109 27.728 29.053 10.052 1.00 0.00
ATOM 327 H2 HOH A 109 27.487 30.253 8.971 1.00 0.00
ATOM 328 O HOH A 110 25.853 12.190 14.651 1.00 0.00
ATOM 329 H1 HOH A 110 26.486 12.716 14.082 1.00 0.00
ATOM 330 H2 HOH A 110 26.345 11.436 15.086 1.00 0.00
ATOM 331 O HOH A 111 6.804 7.584 7.286 1.00 0.00
ATOM 332 H1 HOH A 111 5.832 7.626 7.055 1.00 0.00
ATOM 333 H2 HOH A 111 7.048 6.647 7.534 1.00 0.00
ATOM 334 O HOH A 112 21.235 7.107 17.015 1.00 0.00
ATOM 335 H1 HOH A 112 20.717 6.277 16.806 1.00 0.00
ATOM 336 H2 HOH A 112 22.204 6.878 17.115 1.00 0.00
ATOM 337 O HOH A 113 6.599 2.049 29.517 1.00 0.00
ATOM 338 H1 HOH A 113 7.571 1.897 29.699 1.00 0.00
ATOM 339 H2 HOH A 113 6.460 2.992 29.215 1.00 0.00
ATOM 340 O HOH A 114 26.014 11.887 2.925 1.00 0.00
ATOM 341 H1 HOH A 114 26.509 11.031 2.775 1.00 0.00
ATOM 342 H2 HOH A 114 25.546 11.851 3.808 1.00 0.00
ATOM 343 O HOH A 115 11.249 10.520 11.316 1.00 0.00
ATOM 344 H1 HOH A 115 11.831 11.290 11.577 1.00 0.00
ATOM 345 H2 HOH A 115 11.450 9.736 11.904 1.00 0.00
ATOM 346 O HOH A 116 10.198 20.038 20.554 1.00 0.00
ATOM 347 H1 HOH A 116 10.085 19.203 21.092 1.00 0.00
ATOM 348 H2 HOH A 116 10.114 19.822 19.581 1.00 0.00
ATOM 349 O HOH A 117 19.826 17.244 19.720 1.00 0.00
ATOM 350 H1 HOH A 117 20.489 17.212 20.467 1.00 0.00
ATOM 351 H2 HOH A 117 20.298 17.110 18.849 1.00 0.00
ATOM 352 O HOH A 118 4.346 10.170 12.414 1.00 0.00
ATOM 353 H1 HOH A 118 4.349 9.443 13.101 1.00 0.00
ATOM 354 H2 HOH A 118 4.691 9.812 11.547 1.00 0.00
ATOM 355 O HOH A 119 8.526 1.802 2.005 1.00 0.00
ATOM 356 H1 HOH A 119 9.141 2.161 1.303 1.00 0.00
ATOM 357 H2 HOH A 119 7.865 2.508 2.261 1.00 0.00
ATOM 358 O HOH A 120 8.759 10.738 2.785 1.00 0.00
ATOM 359 H1 HOH A 120 9.477 10.492 3.437 1.00 0.00
ATOM 360 H2 HOH A 120 9.175 10.991 1.912 1.00 0.00
ATOM 361 O HOH A 121 10.103 16.509 9.237 1.00 0.00
ATOM 362 H1 HOH A 121 11.077 16.409 9.444 1.00 0.00
ATOM 363 H2 HOH A 121 9.681 17.123 9.904 1.00 0.00
ATOM 364 O HOH A 122 1.553 10.993 6.671 1.00 0.00
ATOM 365 H1 HOH A 122 1.220 10.128 7.046 1.00 0.00
ATOM 366 H2 HOH A 122 2.502 10.884 6.375 1.00 0.00
ATOM 367 O HOH A 123 28.384 26.152 10.863 1.00 0.00
ATOM 368 H1 HOH A 123 27.500 25.693 10.775 1.00 0.00
ATOM 369 H2 HOH A 123 28.250 27.059 11.261 1.00 0.00
ATOM 370 O HOH A 124 5.543 5.916 15.837 1.00 0.00
ATOM 371 H1 HOH A 124 6.362 5.412 15.562 1.00 0.00
ATOM 372 H2 HOH A 124 4.765 5.612 15.286 1.00 0.00
ATOM 373 O HOH A 125 12.235 5.497 17.130 1.00 0.00
ATOM 374 H1 HOH A 125 11.928 4.871 17.846 1.00 0.00
ATOM 375 H2 HOH A 125 12.388 6.404 17.523 1.00 0.00
ATOM 376 O HOH A 126 12.870 3.968 15.019 1.00 0.00
ATOM 377 H1 HOH A 126 12.732 4.564 15.811 1.00 0.00
ATOM 378 H2 HOH A 126 12.769 3.014 15.298 1.00 0.00
ATOM 379 O HOH A 127 28.471 18.224 10.289 1.00 0.00
ATOM 380 H1 HOH A 127 28.304 17.394 10.821 1.00 0.00
ATOM 381 H2 HOH A 127 29.241 18.073 9.669 1.00 0.00
ATOM 382 O HOH A 128 1.679 13.094 15.630 1.00 0.00
ATOM 383 H1 HOH A 128 1.898 12.140 15.426 1.00 0.00
ATOM 384 H2 HOH A 128 1.080 13.135 16.429 1.00 0.00
ATOM 385 O HOH A 129 2.137 5.554 9.161 1.00 0.00
ATOM 386 H1 HOH A 129 1.886 4.587 9.184 1.00 0.00
ATOM 387 H2 HOH A 129 2.557 5.811 10.032 1.00 0.00
ATOM 388 O HOH A 130 1.557 7.619 11.830 1.00 0.00
ATOM 389 H1 HOH A 130 1.537 8.481 11.324 1.00 0.00
ATOM 390 H2 HOH A 130 2.467 7.211 11.757 1.00 0.00
ATOM 391 O HOH A 131 5.508 2.547 21.638 1.00 0.00
ATOM 392 H1 HOH A 131 5.439 3.544 21.683 1.00 0.00
ATOM 393 H2 HOH A 131 6.052 2.286 20.840 1.00 0.00
ATOM 394 O HOH A 132 11.921 14.289 18.974 1.00 0.00
ATOM 395 H1 HOH A 132 11.364 13.661 19.518 1.00 0.00
ATOM 396 H2 HOH A 132 11.397 14.598 18.181 1.00 0.00
ATOM 397 O HOH A 133 9.327 28.056 0.084 1.00 0.00
ATOM 398 H1 HOH A 133 10.097 27.471 0.338 1.00 0.00
ATOM 399 H2 HOH A 133 8.481 27.524 0.112 1.00 0.00
ATOM 400 O HOH A 134 18.551 15.810 15.869 1.00 0.00
ATOM 401 H1 HOH A 134 19.169 15.424 16.554 1.00 0.00
ATOM 402 H2 HOH A 134 18.911 15.628 14.954 1.00 0.00
ATOM 403 O HOH A 135 11.742 19.999 12.488 1.00 0.00
ATOM 404 H1 HOH A 135 12.276 19.159 12.579 1.00 0.00
ATOM 405 H2 HOH A 135 12.337 20.739 12.173 1.00 0.00
ATOM 406 O HOH A 136 2.603 23.091 9.124 1.00 0.00
ATOM 407 H1 HOH A 136 2.813 23.898 8.572 1.00 0.00
ATOM 408 H2 HOH A 136 3.453 22.685 9.458 1.00 0.00
ATOM 409 O HOH A 137 9.819 13.787 10.585 1.00 0.00
ATOM 410 H1 HOH A 137 9.577 14.653 10.148 1.00 0.00
ATOM 411 H2 HOH A 137 9.892 13.072 9.891 1.00 0.00
ATOM 412 O HOH A 138 3.175 29.191 29.496 1.00 0.00
ATOM 413 H1 HOH A 138 3.511 28.538 30.175 1.00 0.00
ATOM 414 H2 HOH A 138 2.759 29.972 29.962 1.00 0.00
ATOM 415 O HOH A 139 24.144 9.685 10.503 1.00 0.00
ATOM 416 H1 HOH A 139 24.424 9.099 9.742 1.00 0.00
ATOM 417 H2 HOH A 139 23.464 10.345 10.183 1.00 0.00
ATOM 418 O HOH A 140 9.214 13.209 14.900 1.00 0.00
ATOM 419 H1 HOH A 140 9.443 12.251 15.072 1.00 0.00
ATOM 420 H2 HOH A 140 8.297 13.267 14.506 1.00 0.00
ATOM 421 O HOH A 141 13.671 7.153 3.447 1.00 0.00
ATOM 422 H1 HOH A 141 13.937 6.844 4.360 1.00 0.00
ATOM 423 H2 HOH A 141 14.460 7.103 2.835 1.00 0.00
ATOM 424 O HOH A 142 14.925 12.968 15.025 1.00 0.00
ATOM 425 H1 HOH A 142 14.218 12.355 14.670 1.00 0.00
ATOM 426 H2 HOH A 142 14.525 13.575 15.712 1.00 0.00
ATOM 427 O HOH A 143 16.191 19.746 9.685 1.00 0.00
ATOM 428 H1 HOH A 143 15.250 19.482 9.473 1.00 0.00
ATOM 429 H2 HOH A 143 16.511 19.229 10.479 1.00 0.00
ATOM 430 O HOH A 144 29.863 13.990 10.101 1.00 0.00
ATOM 431 H1 HOH A 144 29.066 13.387 10.118 1.00 0.00
ATOM 432 H2 HOH A 144 30.669 13.470 9.817 1.00 0.00
ATOM 433 O HOH A 145 3.477 13.722 17.677 1.00 0.00
ATOM 434 H1 HOH A 145 4.169 13.039 17.911 1.00 0.00
ATOM 435 H2 HOH A 145 3.041 13.472 16.813 1.00 0.00
ATOM 436 O HOH A 146 11.949 28.233 27.575 1.00 0.00
ATOM 437 H1 HOH A 146 11.718 28.682 26.712 1.00 0.00
ATOM 438 H2 HOH A 146 12.087 28.925 28.284 1.00 0.00
ATOM 439 O HOH A 147 16.418 2.445 4.707 1.00 0.00
ATOM 440 H1 HOH A 147 15.717 3.148 4.585 1.00 0.00
ATOM 441 H2 HOH A 147 16.277 1.982 5.583 1.00 0.00
ATOM 442 O HOH A 148 10.965 21.002 6.494 1.00 0.00
ATOM 443 H1 HOH A 148 11.553 21.073 5.688 1.00 0.00
ATOM 444 H2 HOH A 148 10.903 20.044 6.777 1.00 0.00
ATOM 445 O HOH A 149 10.836 15.276 13.827 1.00 0.00
ATOM 446 H1 HOH A 149 11.588 15.112 13.188 1.00 0.00
ATOM 447 H2 HOH A 149 10.318 14.431 13.956 1.00 0.00
ATOM 448 O HOH A 150 3.668 6.009 11.170 1.00 0.00
ATOM 449 H1 HOH A 150 4.505 6.535 11.322 1.00 0.00
ATOM 450 H2 HOH A 150 3.808 5.065 11.467 1.00 0.00
ATOM 451 O HOH A 151 10.924 11.443 28.064 1.00 0.00
ATOM 452 H1 HOH A 151 10.685 10.479 27.948 1.00 0.00
ATOM 453 H2 HOH A 151 10.138 11.940 28.431 1.00 0.00
ATOM 454 O HOH A 152 20.847 26.973 15.815 1.00 0.00
ATOM 455 H1 HOH A 152 21.055 26.107 15.360 1.00 0.00
ATOM 456 H2 HOH A 152 19.925 26.933 16.201 1.00 0.00
ATOM 457 O HOH A 153 13.425 29.504 8.787 1.00 0.00
ATOM 458 H1 HOH A 153 13.020 28.632 9.059 1.00 0.00
ATOM 459 H2 HOH A 153 12.912 30.255 9.204 1.00 0.00
ATOM 460 O HOH A 154 10.734 10.272 4.586 1.00 0.00
ATOM 461 H1 HOH A 154 10.770 9.862 5.497 1.00 0.00
ATOM 462 H2 HOH A 154 11.617 10.150 4.131 1.00 0.00
ATOM 463 O HOH A 155 2.750 12.475 11.563 1.00 0.00
ATOM 464 H1 HOH A 155 2.720 12.403 10.566 1.00 0.00
ATOM 465 H2 HOH A 155 3.484 11.894 11.916 1.00 0.00
ATOM 466 O HOH A 156 7.319 9.272 29.498 1.00 0.00
ATOM 467 H1 HOH A 156 7.706 10.142 29.192 1.00 0.00
ATOM 468 H2 HOH A 156 6.873 9.399 30.384 1.00 0.00
ATOM 469 O HOH A 157 10.795 16.685 28.195 1.00 0.00
ATOM 470 H1 HOH A 157 10.263 17.456 28.547 1.00 0.00
ATOM 471 H2 HOH A 157 10.240 16.168 27.544 1.00 0.00
ATOM 472 O HOH A 158 2.601 10.843 14.757 1.00 0.00
ATOM 473 H1 HOH A 158 2.599 10.063 15.382 1.00 0.00
ATOM 474 H2 HOH A 158 3.039 10.580 13.897 1.00 0.00
ATOM 475 O HOH A 159 22.549 11.614 9.285 1.00 0.00
ATOM 476 H1 HOH A 159 22.466 12.553 9.618 1.00 0.00
ATOM 477 H2 HOH A 159 22.178 11.554 8.359 1.00 0.00
ATOM 478 O HOH A 160 8.219 9.687 8.331 1.00 0.00
ATOM 479 H1 HOH A 160 7.541 10.396 8.134 1.00 0.00
ATOM 480 H2 HOH A 160 7.839 8.790 8.104 1.00 0.00
ATOM 481 O HOH A 161 12.209 28.553 3.033 1.00 0.00
ATOM 482 H1 HOH A 161 11.875 29.078 3.816 1.00 0.00
ATOM 483 H2 HOH A 161 12.159 27.576 3.240 1.00 0.00
ATOM 484 O HOH A 162 5.982 10.761 5.977 1.00 0.00
ATOM 485 H1 HOH A 162 5.325 11.515 5.964 1.00 0.00
ATOM 486 H2 HOH A 162 5.503 9.904 6.168 1.00 0.00
ATOM 487 O HOH A 163 17.454 8.164 14.996 1.00 0.00
ATOM 488 H1 HOH A 163 16.580 8.632 14.864 1.00 0.00
ATOM 489 H2 HOH A 163 18.187 8.841 15.069 1.00 0.00
ATOM 490 O HOH A 164 4.280 11.149 27.555 1.00 0.00
ATOM 491 H1 HOH A 164 4.167 12.093 27.866 1.00 0.00
ATOM 492 H2 HOH A 164 4.254 11.122 26.556 1.00 0.00
ATOM 493 O HOH A 165 4.329 7.664 13.698 1.00 0.00
ATOM 494 H1 HOH A 165 5.127 7.093 13.504 1.00 0.00
ATOM 495 H2 HOH A 165 4.205 7.738 14.687 1.00 0.00
ATOM 496 O HOH A 166 7.200 27.621 14.229 1.00 0.00
ATOM 497 H1 HOH A 166 6.938 28.485 13.800 1.00 0.00
ATOM 498 H2 HOH A 166 7.450 26.960 13.521 1.00 0.00
ATOM 499 O HOH A 167 8.765 11.165 12.660 1.00 0.00
ATOM 500 H1 HOH A 167 8.012 11.311 12.018 1.00 0.00
ATOM 501 H2 HOH A 167 9.602 10.965 12.152 1.00 0.00
ATOM 502 O HOH A 168 15.551 14.001 7.409 1.00 0.00
ATOM 503 H1 HOH A 168 14.726 14.428 7.038 1.00 0.00
ATOM 504 H2 HOH A 168 16.356 14.385 6.958 1.00 0.00
ATOM 505 O HOH A 169 12.009 18.747 17.093 1.00 0.00
ATOM 506 H1 HOH A 169 11.545 17.944 16.719 1.00 0.00
ATOM 507 H2 HOH A 169 12.987 18.689 16.894 1.00 0.00
ATOM 508 O HOH A 170 12.196 21.817 8.835 1.00 0.00
ATOM 509 H1 HOH A 170 12.784 22.533 8.459 1.00 0.00
ATOM 510 H2 HOH A 170 11.775 21.306 8.086 1.00 0.00
ATOM 511 O HOH A 171 3.403 3.661 12.187 1.00 0.00
ATOM 512 H1 HOH A 171 2.799 2.946 11.834 1.00 0.00
ATOM 513 H2 HOH A 171 4.340 3.484 11.886 1.00 0.00
ATOM 514 O HOH A 172 8.884 14.009 17.563 1.00 0.00
ATOM 515 H1 HOH A 172 8.843 14.041 16.564 1.00 0.00
ATOM 516 H2 HOH A 172 7.987 13.758 17.926 1.00 0.00
ATOM 517 O HOH A 173 28.775 9.801 9.667 1.00 0.00
ATOM 518 H1 HOH A 173 29.721 9.591 9.912 1.00 0.00
ATOM 519 H2 HOH A 173 28.499 10.656 10.106 1.00 0.00
ATOM 520 O HOH A 174 10.835 16.555 16.328 1.00 0.00
ATOM 521 H1 HOH A 174 9.840 16.615 16.408 1.00 0.00
ATOM 522 H2 HOH A 174 11.073 16.034 15.509 1.00 0.00
ATOM 523 O HOH A 175 11.138 26.428 1.234 1.00 0.00
ATOM 524 H1 HOH A 175 11.988 26.231 1.723 1.00 0.00
ATOM 525 H2 HOH A 175 10.873 25.632 0.691 1.00 0.00
ATOM 526 O HOH A 176 12.321 0.506 0.842 1.00 0.00
ATOM 527 H1 HOH A 176 11.522 0.377 0.254 1.00 0.00
ATOM 528 H2 HOH A 176 12.191 0.003 1.696 1.00 0.00
ATOM 529 O HOH A 177 13.930 7.865 18.558 1.00 0.00
ATOM 530 H1 HOH A 177 13.596 8.042 19.484 1.00 0.00
ATOM 531 H2 HOH A 177 14.090 8.734 18.089 1.00 0.00
ATOM 532 O HOH A 178 12.686 11.146 14.476 1.00 0.00
ATOM 533 H1 HOH A 178 12.661 10.232 14.070 1.00 0.00
ATOM 534 H2 HOH A 178 12.412 11.822 13.792 1.00 0.00
ATOM 535 O HOH A 179 7.008 11.991 8.265 1.00 0.00
ATOM 536 H1 HOH A 179 7.866 12.500 8.187 1.00 0.00
ATOM 537 H2 HOH A 179 6.665 11.773 7.352 1.00 0.00
ATOM 538 O HOH A 180 25.900 18.093 14.204 1.00 0.00
ATOM 539 H1 HOH A 180 26.675 17.462 14.165 1.00 0.00
ATOM 540 H2 HOH A 180 25.817 18.573 13.331 1.00 0.00
ATOM 541 O HOH A 181 15.364 23.018 13.280 1.00 0.00
ATOM 542 H1 HOH A 181 15.780 23.298 12.415 1.00 0.00
ATOM 543 H2 HOH A 181 15.912 23.366 14.041 1.00 0.00
ATOM 544 O HOH A 182 7.465 5.201 9.440 1.00 0.00
ATOM 545 H1 HOH A 182 6.550 4.830 9.286 1.00 0.00
ATOM 546 H2 HOH A 182 7.913 4.689 10.173 1.00 0.00
ATOM 547 O HOH A 183 13.710 9.419 7.545 1.00 0.00
ATOM 548 H1 HOH A 183 13.379 10.332 7.783 1.00 0.00
ATOM 549 H2 HOH A 183 13.896 9.378 6.563 1.00 0.00
ATOM 550 O HOH A 184 16.776 11.966 9.107 1.00 0.00
ATOM 551 H1 HOH A 184 16.566 12.764 8.543 1.00 0.00
ATOM 552 H2 HOH A 184 15.953 11.407 9.213 1.00 0.00
ATOM 553 O HOH A 185 5.280 11.392 16.857 1.00 0.00
ATOM 554 H1 HOH A 185 5.439 11.767 15.944 1.00 0.00
ATOM 555 H2 HOH A 185 5.188 10.398 16.798 1.00 0.00
ATOM 556 O HOH A 186 0.962 15.057 6.020 1.00 0.00
ATOM 557 H1 HOH A 186 0.434 15.103 6.869 1.00 0.00
ATOM 558 H2 HOH A 186 1.938 15.094 6.232 1.00 0.00
ATOM 559 O HOH A 187 6.663 11.801 11.143 1.00 0.00
ATOM 560 H1 HOH A 187 6.678 12.686 11.609 1.00 0.00
ATOM 561 H2 HOH A 187 6.657 11.946 10.153 1.00 0.00
ATOM 562 O HOH A 188 28.540 1.938 8.397 1.00 0.00
ATOM 563 H1 HOH A 188 29.445 2.353 8.491 1.00 0.00
ATOM 564 H2 HOH A 188 28.025 2.418 7.687 1.00 0.00
ATOM 565 O HOH A 189 19.056 11.676 11.098 1.00 0.00
ATOM 566 H1 HOH A 189 19.524 10.853 10.776 1.00 0.00
ATOM 567 H2 HOH A 189 18.068 11.518 11.099 1.00 0.00
ATOM 568 O HOH A 190 8.603 4.122 11.643 1.00 0.00
ATOM 569 H1 HOH A 190 8.755 3.451 12.368 1.00 0.00
ATOM 570 H2 HOH A 190 9.093 4.966 11.861 1.00 0.00
ATOM 571 O HOH A 191 4.279 13.226 6.238 1.00 0.00
ATOM 572 H1 HOH A 191 3.722 13.892 6.734 1.00 0.00
ATOM 573 H2 HOH A 191 5.062 13.689 5.822 1.00 0.00
ATOM 574 O HOH A 192 10.642 7.189 15.431 1.00 0.00
ATOM 575 H1 HOH A 192 10.445 7.714 16.259 1.00 0.00
ATOM 576 H2 HOH A 192 11.247 6.425 15.656 1.00 0.00
ATOM 577 O HOH A 193 13.651 0.105 11.850 1.00 0.00
ATOM 578 H1 HOH A 193 13.944 1.020 11.575 1.00 0.00
ATOM 579 H2 HOH A 193 14.345 -0.562 11.578 1.00 0.00
ATOM 580 O HOH A 194 12.323 16.789 4.726 1.00 0.00
ATOM 581 H1 HOH A 194 11.664 17.127 4.053 1.00 0.00
ATOM 582 H2 HOH A 194 13.243 16.821 4.336 1.00 0.00
ATOM 583 O HOH A 195 1.698 17.541 11.138 1.00 0.00
ATOM 584 H1 HOH A 195 1.038 16.827 11.370 1.00 0.00
ATOM 585 H2 HOH A 195 1.721 18.224 11.868 1.00 0.00
ATOM 586 O HOH A 196 20.404 24.095 3.569 1.00 0.00
ATOM 587 H1 HOH A 196 21.391 24.220 3.670 1.00 0.00
ATOM 588 H2 HOH A 196 20.122 24.399 2.659 1.00 0.00
ATOM 589 O HOH A 197 12.837 6.436 8.123 1.00 0.00
ATOM 590 H1 HOH A 197 11.953 6.135 8.480 1.00 0.00
ATOM 591 H2 HOH A 197 13.343 6.913 8.842 1.00 0.00
ATOM 592 O HOH A 198 15.839 0.269 9.330 1.00 0.00
ATOM 593 H1 HOH A 198 16.272 0.043 10.203 1.00 0.00
ATOM 594 H2 HOH A 198 14.892 -0.051 9.335 1.00 0.00
ATOM 595 O HOH A 199 -0.107 6.302 6.937 1.00 0.00
ATOM 596 H1 HOH A 199 0.301 5.800 7.700 1.00 0.00
ATOM 597 H2 HOH A 199 0.338 6.032 6.084 1.00 0.00
ATOM 598 O HOH A 200 10.905 14.322 1.527 1.00 0.00
ATOM 599 H1 HOH A 200 10.286 15.077 1.309 1.00 0.00
ATOM 600 H2 HOH A 200 11.842 14.667 1.591 1.00 0.00
ATOM 601 O HOH A 201 9.400 16.483 1.169 1.00 0.00
ATOM 602 H1 HOH A 201 8.535 16.081 0.872 1.00 0.00
ATOM 603 H2 HOH A 201 9.482 17.409 0.798 1.00 0.00
ATOM 604 O HOH A 202 17.542 5.682 26.946 1.00 0.00
ATOM 605 H1 HOH A 202 18.048 5.465 26.111 1.00 0.00
ATOM 606 H2 HOH A 202 17.141 6.595 26.865 1.00 0.00
ATOM 607 O HOH A 203 12.000 7.260 29.237 1.00 0.00
ATOM 608 H1 HOH A 203 11.146 6.861 29.570 1.00 0.00
ATOM 609 H2 HOH A 203 12.691 6.543 29.149 1.00 0.00
ATOM 610 O HOH A 204 17.185 6.840 21.302 1.00 0.00
ATOM 611 H1 HOH A 204 17.180 7.159 20.354 1.00 0.00
ATOM 612 H2 HOH A 204 16.388 6.259 21.463 1.00 0.00
ATOM 613 O HOH A 205 11.081 6.181 3.095 1.00 0.00
ATOM 614 H1 HOH A 205 11.842 6.798 3.291 1.00 0.00
ATOM 615 H2 HOH A 205 10.234 6.572 3.456 1.00 0.00
ATOM 616 O HOH A 206 10.094 7.993 22.684 1.00 0.00
ATOM 617 H1 HOH A 206 10.323 8.642 23.409 1.00 0.00
ATOM 618 H2 HOH A 206 10.055 7.069 23.064 1.00 0.00
ATOM 619 O HOH A 207 15.347 9.334 25.058 1.00 0.00
ATOM 620 H1 HOH A 207 14.573 9.602 24.485 1.00 0.00
ATOM 621 H2 HOH A 207 16.129 9.105 24.478 1.00 0.00
ATOM 622 O HOH A 208 0.937 17.943 28.150 1.00 0.00
ATOM 623 H1 HOH A 208 1.401 17.527 28.932 1.00 0.00
ATOM 624 H2 HOH A 208 0.543 17.226 27.576 1.00 0.00
ATOM 625 O HOH A 209 3.962 9.163 29.244 1.00 0.00
ATOM 626 H1 HOH A 209 4.417 9.212 30.133 1.00 0.00
ATOM 627 H2 HOH A 209 4.391 9.811 28.614 1.00 0.00
ATOM 628 O HOH A 210 2.284 11.595 21.950 1.00 0.00
ATOM 629 H1 HOH A 210 2.367 10.601 22.019 1.00 0.00
ATOM 630 H2 HOH A 210 2.346 11.999 22.863 1.00 0.00
ATOM 631 O HOH A 211 7.192 10.313 22.042 1.00 0.00
ATOM 632 H1 HOH A 211 7.562 9.512 21.571 1.00 0.00
ATOM 633 H2 HOH A 211 6.681 10.875 21.391 1.00 0.00
ATOM 634 O HOH A 212 15.188 16.217 22.515 1.00 0.00
ATOM 635 H1 HOH A 212 14.536 16.164 21.759 1.00 0.00
ATOM 636 H2 HOH A 212 15.448 15.293 22.797 1.00 0.00
ATOM 637 O HOH A 213 17.384 11.782 22.373 1.00 0.00
ATOM 638 H1 HOH A 213 17.449 10.963 22.944 1.00 0.00
ATOM 639 H2 HOH A 213 17.566 11.539 21.420 1.00 0.00
ATOM 640 O HOH A 214 19.300 13.641 23.213 1.00 0.00
ATOM 641 H1 HOH A 214 18.674 12.963 22.828 1.00 0.00
ATOM 642 H2 HOH A 214 19.519 13.394 24.157 1.00 0.00
ATOM 643 O HOH A 215 5.514 6.934 21.304 1.00 0.00
ATOM 644 H1 HOH A 215 5.523 6.722 22.282 1.00 0.00
ATOM 645 H2 HOH A 215 5.136 6.158 20.799 1.00 0.00
ATOM 646 O HOH A 216 7.927 25.921 21.843 1.00 0.00
ATOM 647 H1 HOH A 216 8.163 26.014 22.810 1.00 0.00
ATOM 648 H2 HOH A 216 7.209 26.577 21.610 1.00 0.00
ATOM 649 O HOH A 217 17.359 8.987 23.288 1.00 0.00
ATOM 650 H1 HOH A 217 18.315 9.093 23.562 1.00 0.00
ATOM 651 H2 HOH A 217 17.312 8.462 22.438 1.00 0.00
ATOM 652 O HOH A 218 17.273 12.969 29.341 1.00 0.00
ATOM 653 H1 HOH A 218 16.329 13.292 29.277 1.00 0.00
ATOM 654 H2 HOH A 218 17.820 13.636 29.846 1.00 0.00
ATOM 655 O HOH A 219 19.511 16.979 26.719 1.00 0.00
ATOM 656 H1 HOH A 219 19.002 16.139 26.534 1.00 0.00
ATOM 657 H2 HOH A 219 19.210 17.366 27.591 1.00 0.00
ATOM 658 O HOH A 220 6.206 12.872 18.842 1.00 0.00
ATOM 659 H1 HOH A 220 5.955 12.429 17.981 1.00 0.00
ATOM 660 H2 HOH A 220 5.711 12.440 19.596 1.00 0.00
ATOM 661 O HOH A 221 15.718 3.807 27.869 1.00 0.00
ATOM 662 H1 HOH A 221 16.363 4.477 27.502 1.00 0.00
ATOM 663 H2 HOH A 221 14.844 4.255 28.059 1.00 0.00
ATOM 664 O HOH A 222 11.260 14.945 24.382 1.00 0.00
ATOM 665 H1 HOH A 222 10.643 15.009 23.598 1.00 0.00
ATOM 666 H2 HOH A 222 10.730 14.995 25.228 1.00 0.00
ATOM 667 O HOH A 223 10.950 10.245 24.297 1.00 0.00
ATOM 668 H1 HOH A 223 10.882 10.474 25.268 1.00 0.00
ATOM 669 H2 HOH A 223 11.902 10.328 24.000 1.00 0.00
ATOM 670 O HOH A 224 14.064 2.257 18.249 1.00 0.00
ATOM 671 H1 HOH A 224 14.788 2.916 18.043 1.00 0.00
ATOM 672 H2 HOH A 224 13.768 1.812 17.403 1.00 0.00
ATOM 673 O HOH A 225 7.549 19.928 22.936 1.00 0.00
ATOM 674 H1 HOH A 225 7.424 19.778 21.955 1.00 0.00
ATOM 675 H2 HOH A 225 8.372 20.475 23.087 1.00 0.00
ATOM 676 O HOH A 226 15.996 20.711 30.289 1.00 0.00
ATOM 677 H1 HOH A 226 15.320 20.543 29.572 1.00 0.00
ATOM 678 H2 HOH A 226 16.905 20.460 29.957 1.00 0.00
ATOM 679 O HOH A 227 12.449 18.759 19.847 1.00 0.00
ATOM 680 H1 HOH A 227 12.341 18.709 18.854 1.00 0.00
ATOM 681 H2 HOH A 227 11.834 19.457 20.215 1.00 0.00
ATOM 682 O HOH A 228 4.683 19.104 0.676 1.00 0.00
ATOM 683 H1 HOH A 228 4.469 19.804 -0.006 1.00 0.00
ATOM 684 H2 HOH A 228 5.385 19.449 1.298 1.00 0.00
ATOM 685 O HOH A 229 17.654 10.128 29.581 1.00 0.00
ATOM 686 H1 HOH A 229 16.800 9.609 29.609 1.00 0.00
ATOM 687 H2 HOH A 229 17.452 11.106 29.630 1.00 0.00
ATOM 688 O HOH A 230 7.999 12.304 25.947 1.00 0.00
ATOM 689 H1 HOH A 230 8.567 12.116 25.146 1.00 0.00
ATOM 690 H2 HOH A 230 7.099 11.885 25.823 1.00 0.00
ATOM 691 O HOH A 231 5.965 22.680 20.079 1.00 0.00
ATOM 692 H1 HOH A 231 5.397 22.691 19.257 1.00 0.00
ATOM 693 H2 HOH A 231 6.928 22.614 19.818 1.00 0.00
ATOM 694 O HOH A 232 13.219 16.957 24.421 1.00 0.00
ATOM 695 H1 HOH A 232 14.054 16.616 23.989 1.00 0.00
ATOM 696 H2 HOH A 232 12.472 16.311 24.259 1.00 0.00
ATOM 697 O HOH A 233 1.525 14.179 13.273 1.00 0.00
ATOM 698 H1 HOH A 233 1.957 13.508 12.670 1.00 0.00
ATOM 699 H2 HOH A 233 1.477 13.810 14.201 1.00 0.00
ATOM 700 O HOH A 234 16.213 3.907 18.060 1.00 0.00
ATOM 701 H1 HOH A 234 16.904 3.468 18.634 1.00 0.00
ATOM 702 H2 HOH A 234 16.663 4.446 17.348 1.00 0.00
ATOM 703 O HOH A 235 6.942 18.305 27.603 1.00 0.00
ATOM 704 H1 HOH A 235 6.075 17.807 27.616 1.00 0.00
ATOM 705 H2 HOH A 235 7.306 18.315 26.672 1.00 0.00
ATOM 706 O HOH A 236 9.067 14.950 26.463 1.00 0.00
ATOM 707 H1 HOH A 236 8.812 13.991 26.588 1.00 0.00
ATOM 708 H2 HOH A 236 8.424 15.386 25.834 1.00 0.00
ATOM 709 O HOH A 237 10.869 8.838 27.323 1.00 0.00
ATOM 710 H1 HOH A 237 9.939 8.511 27.156 1.00 0.00
ATOM 711 H2 HOH A 237 11.344 8.198 27.927 1.00 0.00
ATOM 712 O HOH A 238 8.140 4.266 23.582 1.00 0.00
ATOM 713 H1 HOH A 238 7.938 3.321 23.842 1.00 0.00
ATOM 714 H2 HOH A 238 7.969 4.870 24.361 1.00 0.00
ATOM 715 O HOH A 239 9.986 19.272 25.524 1.00 0.00
ATOM 716 H1 HOH A 239 9.444 18.475 25.257 1.00 0.00
ATOM 717 H2 HOH A 239 9.961 19.952 24.792 1.00 0.00
ATOM 718 O HOH A 240 8.104 8.430 27.130 1.00 0.00
ATOM 719 H1 HOH A 240 7.670 8.970 26.409 1.00 0.00
ATOM 720 H2 HOH A 240 7.734 8.701 28.019 1.00 0.00
ATOM 721 O HOH A 241 11.061 6.007 24.406 1.00 0.00
ATOM 722 H1 HOH A 241 11.750 6.649 24.743 1.00 0.00
ATOM 723 H2 HOH A 241 10.363 5.868 25.109 1.00 0.00
ATOM 724 O HOH A 242 12.741 10.993 20.865 1.00 0.00
ATOM 725 H1 HOH A 242 13.514 11.439 20.413 1.00 0.00
ATOM 726 H2 HOH A 242 11.912 11.531 20.716 1.00 0.00
ATOM 727 O HOH A 243 9.753 27.164 26.823 1.00 0.00
ATOM 728 H1 HOH A 243 8.975 27.706 27.141 1.00 0.00
ATOM 729 H2 HOH A 243 10.584 27.469 27.289 1.00 0.00
ATOM 730 O HOH A 244 13.565 12.276 27.531 1.00 0.00
ATOM 731 H1 HOH A 244 13.550 12.559 26.571 1.00 0.00
ATOM 732 H2 HOH A 244 12.667 11.921 27.787 1.00 0.00
ATOM 733 O HOH A 245 8.203 2.971 17.757 1.00 0.00
ATOM 734 H1 HOH A 245 8.914 3.656 17.913 1.00 0.00
ATOM 735 H2 HOH A 245 8.037 2.879 16.775 1.00 0.00
ATOM 736 O HOH A 246 9.657 21.647 23.678 1.00 0.00
ATOM 737 H1 HOH A 246 10.540 22.087 23.839 1.00 0.00
ATOM 738 H2 HOH A 246 9.068 22.262 23.154 1.00 0.00
ATOM 739 O HOH A 247 10.096 6.378 12.392 1.00 0.00
ATOM 740 H1 HOH A 247 9.745 6.918 11.627 1.00 0.00
ATOM 741 H2 HOH A 247 10.663 6.958 12.977 1.00 0.00
ATOM 742 O HOH A 248 11.911 2.864 27.315 1.00 0.00
ATOM 743 H1 HOH A 248 12.700 3.012 26.718 1.00 0.00
ATOM 744 H2 HOH A 248 11.188 2.401 26.802 1.00 0.00
ATOM 745 O HOH A 249 9.178 29.293 2.669 1.00 0.00
ATOM 746 H1 HOH A 249 9.117 30.285 2.558 1.00 0.00
ATOM 747 H2 HOH A 249 9.429 28.875 1.797 1.00 0.00
ATOM 748 O HOH A 250 13.410 12.995 24.938 1.00 0.00
ATOM 749 H1 HOH A 250 14.353 13.079 24.616 1.00 0.00
ATOM 750 H2 HOH A 250 12.934 13.865 24.804 1.00 0.00
ATOM 751 O HOH A 251 14.270 5.871 22.099 1.00 0.00
ATOM 752 H1 HOH A 251 14.201 5.422 21.208 1.00 0.00
ATOM 753 H2 HOH A 251 13.896 6.796 22.036 1.00 0.00
ATOM 754 O HOH A 252 16.330 11.811 26.257 1.00 0.00
ATOM 755 H1 HOH A 252 15.644 12.149 26.901 1.00 0.00
ATOM 756 H2 HOH A 252 15.991 10.981 25.814 1.00 0.00
ATOM 757 O HOH A 253 6.813 14.086 13.123 1.00 0.00
ATOM 758 H1 HOH A 253 5.881 14.384 13.331 1.00 0.00
ATOM 759 H2 HOH A 253 7.411 14.884 13.058 1.00 0.00
ATOM 760 O HOH A 254 12.592 19.466 24.141 1.00 0.00
ATOM 761 H1 HOH A 254 12.039 19.558 24.969 1.00 0.00
ATOM 762 H2 HOH A 254 12.940 18.530 24.076 1.00 0.00
ATOM 763 O HOH A 255 10.694 7.427 18.824 1.00 0.00
ATOM 764 H1 HOH A 255 11.236 7.789 19.582 1.00 0.00
ATOM 765 H2 HOH A 255 10.498 8.160 18.173 1.00 0.00
ATOM 766 O HOH A 256 7.898 22.897 25.661 1.00 0.00
ATOM 767 H1 HOH A 256 8.454 23.353 26.355 1.00 0.00
ATOM 768 H2 HOH A 256 8.473 22.656 24.879 1.00 0.00
ATOM 769 O HOH A 257 14.866 10.439 5.185 1.00 0.00
ATOM 770 H1 HOH A 257 14.120 10.187 4.568 1.00 0.00
ATOM 771 H2 HOH A 257 15.475 11.085 4.724 1.00 0.00
ATOM 772 O HOH A 258 18.770 8.500 3.356 1.00 0.00
ATOM 773 H1 HOH A 258 19.563 7.989 3.686 1.00 0.00
ATOM 774 H2 HOH A 258 18.685 8.380 2.367 1.00 0.00
ATOM 775 O HOH A 259 6.366 8.742 16.296 1.00 0.00
ATOM 776 H1 HOH A 259 6.279 7.763 16.113 1.00 0.00
ATOM 777 H2 HOH A 259 6.884 9.174 15.558 1.00 0.00
ATOM 778 O HOH A 260 6.766 9.871 24.892 1.00 0.00
ATOM 779 H1 HOH A 260 7.061 10.027 23.949 1.00 0.00
ATOM 780 H2 HOH A 260 5.803 9.602 24.900 1.00 0.00
ATOM 781 O HOH A 261 -0.130 7.435 2.552 1.00 0.00
ATOM 782 H1 HOH A 261 0.760 7.101 2.863 1.00 0.00
ATOM 783 H2 HOH A 261 -0.256 7.201 1.588 1.00 0.00
ATOM 784 O HOH A 262 13.531 21.713 11.424 1.00 0.00
ATOM 785 H1 HOH A 262 12.875 22.393 11.097 1.00 0.00
ATOM 786 H2 HOH A 262 14.454 22.097 11.389 1.00 0.00
ATOM 787 O HOH A 263 13.691 10.627 23.427 1.00 0.00
ATOM 788 H1 HOH A 263 13.872 11.538 23.799 1.00 0.00
ATOM 789 H2 HOH A 263 13.364 10.711 22.486 1.00 0.00
ATOM 790 O HOH A 264 7.625 18.014 24.859 1.00 0.00
ATOM 791 H1 HOH A 264 7.481 18.711 24.156 1.00 0.00
ATOM 792 H2 HOH A 264 7.179 17.163 24.580 1.00 0.00
ATOM 793 O HOH A 265 14.521 2.447 25.705 1.00 0.00
ATOM 794 H1 HOH A 265 15.024 2.897 26.443 1.00 0.00
ATOM 795 H2 HOH A 265 14.077 3.138 25.135 1.00 0.00
ATOM 796 O HOH A 266 7.829 4.253 3.077 1.00 0.00
ATOM 797 H1 HOH A 266 7.915 4.857 2.285 1.00 0.00
ATOM 798 H2 HOH A 266 8.737 4.062 3.451 1.00 0.00
ATOM 799 O HOH A 267 1.306 5.284 26.804 1.00 0.00
ATOM 800 H1 HOH A 267 0.656 6.043 26.858 1.00 0.00
ATOM 801 H2 HOH A 267 0.851 4.436 27.074 1.00 0.00
ATOM 802 O HOH A 268 13.434 0.011 23.398 1.00 0.00
ATOM 803 H1 HOH A 268 13.996 -0.058 22.574 1.00 0.00
ATOM 804 H2 HOH A 268 13.979 0.397 24.142 1.00 0.00
ATOM 805 O HOH A 269 10.085 11.402 9.209 1.00 0.00
ATOM 806 H1 HOH A 269 9.320 10.924 8.778 1.00 0.00
ATOM 807 H2 HOH A 269 10.422 10.864 9.982 1.00 0.00
ATOM 808 O HOH A 270 14.838 1.005 21.153 1.00 0.00
ATOM 809 H1 HOH A 270 14.510 1.152 20.220 1.00 0.00
ATOM 810 H2 HOH A 270 15.605 0.364 21.139 1.00 0.00
ATOM 811 O HOH A 271 9.841 9.395 17.164 1.00 0.00
ATOM 812 H1 HOH A 271 10.473 10.160 17.045 1.00 0.00
ATOM 813 H2 HOH A 271 9.038 9.702 17.676 1.00 0.00
ATOM 814 O HOH A 272 11.406 20.872 15.336 1.00 0.00
ATOM 815 H1 HOH A 272 11.710 20.400 14.509 1.00 0.00
ATOM 816 H2 HOH A 272 11.536 20.275 16.128 1.00 0.00
ATOM 817 O HOH A 273 4.398 6.373 23.888 1.00 0.00
ATOM 818 H1 HOH A 273 4.765 6.560 24.799 1.00 0.00
ATOM 819 H2 HOH A 273 3.447 6.075 23.967 1.00 0.00
ATOM 820 O HOH A 274 6.820 26.385 26.237 1.00 0.00
ATOM 821 H1 HOH A 274 7.431 26.480 25.451 1.00 0.00
ATOM 822 H2 HOH A 274 6.905 27.190 26.824 1.00 0.00
ATOM 823 O HOH A 275 3.215 12.985 0.632 1.00 0.00
ATOM 824 H1 HOH A 275 2.437 13.454 1.051 1.00 0.00
ATOM 825 H2 HOH A 275 2.882 12.267 0.022 1.00 0.00
ATOM 826 O HOH A 276 9.057 18.529 29.376 1.00 0.00
ATOM 827 H1 HOH A 276 8.212 18.397 28.859 1.00 0.00
ATOM 828 H2 HOH A 276 9.360 19.477 29.283 1.00 0.00
ATOM 829 O HOH A 277 13.006 7.596 25.304 1.00 0.00
ATOM 830 H1 HOH A 277 13.960 7.575 25.006 1.00 0.00
ATOM 831 H2 HOH A 277 12.880 8.333 25.968 1.00 0.00
ATOM 832 O HOH A 278 2.892 8.971 22.409 1.00 0.00
ATOM 833 H1 HOH A 278 2.236 8.232 22.255 1.00 0.00
ATOM 834 H2 HOH A 278 3.796 8.686 22.091 1.00 0.00
ATOM 835 O HOH A 279 9.253 15.298 22.715 1.00 0.00
ATOM 836 H1 HOH A 279 8.790 14.680 22.079 1.00 0.00
ATOM 837 H2 HOH A 279 9.329 16.206 22.302 1.00 0.00
ATOM 838 O HOH A 280 20.992 15.865 4.492 1.00 0.00
ATOM 839 H1 HOH A 280 21.584 16.544 4.059 1.00 0.00
ATOM 840 H2 HOH A 280 20.502 16.288 5.254 1.00 0.00
ATOM 841 O HOH A 281 1.443 13.013 27.325 1.00 0.00
ATOM 842 H1 HOH A 281 0.907 13.730 27.772 1.00 0.00
ATOM 843 H2 HOH A 281 0.959 12.141 27.397 1.00 0.00
ATOM 844 O HOH A 282 11.380 29.216 25.072 1.00 0.00
ATOM 845 H1 HOH A 282 12.157 29.459 24.491 1.00 0.00
ATOM 846 H2 HOH A 282 10.796 28.561 24.592 1.00 0.00
ATOM 847 O HOH A 283 20.792 2.984 18.246 1.00 0.00
ATOM 848 H1 HOH A 283 21.519 2.484 17.776 1.00 0.00
ATOM 849 H2 HOH A 283 21.141 3.348 19.109 1.00 0.00
ATOM 850 O HOH A 284 17.147 20.062 20.608 1.00 0.00
ATOM 851 H1 HOH A 284 17.128 19.377 19.880 1.00 0.00
ATOM 852 H2 HOH A 284 16.853 19.644 21.467 1.00 0.00
ATOM 853 O HOH A 285 10.390 12.345 20.374 1.00 0.00
ATOM 854 H1 HOH A 285 9.841 12.397 21.208 1.00 0.00
ATOM 855 H2 HOH A 285 9.835 11.971 19.631 1.00 0.00
ATOM 856 O HOH A 286 7.229 19.564 20.205 1.00 0.00
ATOM 857 H1 HOH A 286 7.349 20.101 19.370 1.00 0.00
ATOM 858 H2 HOH A 286 6.553 18.845 20.045 1.00 0.00
ATOM 859 O HOH A 287 16.752 -0.214 3.505 1.00 0.00
ATOM 860 H1 HOH A 287 15.948 -0.069 2.928 1.00 0.00
ATOM 861 H2 HOH A 287 17.005 0.648 3.946 1.00 0.00
ATOM 862 O HOH A 288 12.255 8.331 20.918 1.00 0.00
ATOM 863 H1 HOH A 288 11.569 8.068 21.596 1.00 0.00
ATOM 864 H2 HOH A 288 12.459 9.305 21.009 1.00 0.00
ATOM 865 O HOH A 289 7.813 10.118 18.854 1.00 0.00
ATOM 866 H1 HOH A 289 6.841 10.068 18.621 1.00 0.00
ATOM 867 H2 HOH A 289 8.073 9.304 19.374 1.00 0.00
ATOM 868 O HOH A 290 16.015 20.748 16.295 1.00 0.00
ATOM 869 H1 HOH A 290 16.706 20.433 16.945 1.00 0.00
ATOM 870 H2 HOH A 290 15.231 21.118 16.794 1.00 0.00
ATOM 871 O HOH A 291 9.562 19.093 18.186 1.00 0.00
ATOM 872 H1 HOH A 291 9.080 18.219 18.247 1.00 0.00
ATOM 873 H2 HOH A 291 10.413 18.969 17.675 1.00 0.00
ATOM 874 O HOH A 292 12.851 4.523 1.459 1.00 0.00
ATOM 875 H1 HOH A 292 12.208 5.231 1.748 1.00 0.00
ATOM 876 H2 HOH A 292 12.492 3.624 1.710 1.00 0.00
ATOM 877 O HOH A 293 8.481 16.491 19.335 1.00 0.00
ATOM 878 H1 HOH A 293 8.290 16.295 18.373 1.00 0.00
ATOM 879 H2 HOH A 293 7.962 15.861 19.912 1.00 0.00
ATOM 880 O HOH A 294 5.101 14.534 26.613 1.00 0.00
ATOM 881 H1 HOH A 294 5.439 14.044 27.417 1.00 0.00
ATOM 882 H2 HOH A 294 5.076 15.515 26.807 1.00 0.00
ATOM 883 O HOH A 295 9.425 17.684 21.562 1.00 0.00
ATOM 884 H1 HOH A 295 8.549 17.979 21.946 1.00 0.00
ATOM 885 H2 HOH A 295 9.306 17.457 20.596 1.00 0.00
ATOM 886 O HOH A 296 21.970 16.154 26.103 1.00 0.00
ATOM 887 H1 HOH A 296 22.592 16.844 25.734 1.00 0.00
ATOM 888 H2 HOH A 296 21.055 16.548 26.199 1.00 0.00
ATOM 889 O HOH A 297 12.376 2.663 21.731 1.00 0.00
ATOM 890 H1 HOH A 297 12.647 2.903 22.663 1.00 0.00
ATOM 891 H2 HOH A 297 13.052 2.039 21.337 1.00 0.00
ATOM 892 O HOH A 298 9.093 11.802 22.971 1.00 0.00
ATOM 893 H1 HOH A 298 8.209 11.457 22.656 1.00 0.00
ATOM 894 H2 HOH A 298 9.678 11.033 23.231 1.00 0.00
ATOM 895 O HOH A 299 14.625 18.464 16.759 1.00 0.00
ATOM 896 H1 HOH A 299 15.062 17.705 17.241 1.00 0.00
ATOM 897 H2 HOH A 299 15.327 19.065 16.377 1.00 0.00
ATOM 898 O HOH A 300 7.109 16.687 4.387 1.00 0.00
ATOM 899 H1 HOH A 300 7.767 17.440 4.414 1.00 0.00
ATOM 900 H2 HOH A 300 6.508 16.799 3.595 1.00 0.00
ATOM 901 O HOH A 301 8.209 8.218 20.824 1.00 0.00
ATOM 902 H1 HOH A 301 8.858 7.981 21.547 1.00 0.00
ATOM 903 H2 HOH A 301 7.412 7.617 20.881 1.00 0.00
ATOM 904 O HOH A 302 7.147 4.068 14.475 1.00 0.00
ATOM 905 H1 HOH A 302 8.111 3.821 14.373 1.00 0.00
ATOM 906 H2 HOH A 302 6.598 3.237 14.564 1.00 0.00
ATOM 907 O HOH A 303 17.597 15.112 25.869 1.00 0.00
ATOM 908 H1 HOH A 303 17.024 15.926 25.965 1.00 0.00
ATOM 909 H2 HOH A 303 17.260 14.394 26.478 1.00 0.00
ATOM 910 O HOH A 304 28.251 9.110 17.734 1.00 0.00
ATOM 911 H1 HOH A 304 27.708 9.301 18.552 1.00 0.00
ATOM 912 H2 HOH A 304 29.183 9.446 17.867 1.00 0.00
ATOM 913 O HOH A 305 24.623 28.830 24.716 1.00 0.00
ATOM 914 H1 HOH A 305 23.655 28.706 24.502 1.00 0.00
ATOM 915 H2 HOH A 305 25.139 28.957 23.869 1.00 0.00
ATOM 916 O HOH A 306 4.677 2.878 25.163 1.00 0.00
ATOM 917 H1 HOH A 306 4.305 2.755 24.243 1.00 0.00
ATOM 918 H2 HOH A 306 4.198 2.272 25.799 1.00 0.00
ATOM 919 O HOH A 307 6.244 15.732 23.852 1.00 0.00
ATOM 920 H1 HOH A 307 6.082 15.416 22.917 1.00 0.00
ATOM 921 H2 HOH A 307 5.977 15.017 24.497 1.00 0.00
ATOM 922 O HOH A 308 4.230 20.455 21.940 1.00 0.00
ATOM 923 H1 HOH A 308 4.492 19.558 22.294 1.00 0.00
ATOM 924 H2 HOH A 308 5.037 20.918 21.574 1.00 0.00
ATOM 925 O HOH A 309 22.954 26.633 17.653 1.00 0.00
ATOM 926 H1 HOH A 309 22.940 25.662 17.890 1.00 0.00
ATOM 927 H2 HOH A 309 22.212 26.830 17.012 1.00 0.00
ATOM 928 O HOH A 310 15.611 29.300 28.925 1.00 0.00
ATOM 929 H1 HOH A 310 15.966 29.959 29.589 1.00 0.00
ATOM 930 H2 HOH A 310 14.779 29.663 28.507 1.00 0.00
ATOM 931 O HOH A 311 21.404 3.675 27.036 1.00 0.00
ATOM 932 H1 HOH A 311 21.309 3.923 28.000 1.00 0.00
ATOM 933 H2 HOH A 311 20.640 4.057 26.517 1.00 0.00
ATOM 934 O HOH A 312 24.005 17.319 20.335 1.00 0.00
ATOM 935 H1 HOH A 312 24.983 17.353 20.538 1.00 0.00
ATOM 936 H2 HOH A 312 23.765 16.407 20.002 1.00 0.00
ATOM 937 O HOH A 313 8.086 16.884 15.934 1.00 0.00
ATOM 938 H1 HOH A 313 7.779 17.781 16.252 1.00 0.00
ATOM 939 H2 HOH A 313 7.600 16.643 15.094 1.00 0.00
ATOM 940 O HOH A 314 13.941 24.981 9.696 1.00 0.00
ATOM 941 H1 HOH A 314 13.947 24.579 8.781 1.00 0.00
ATOM 942 H2 HOH A 314 14.736 24.656 10.208 1.00 0.00
ATOM 943 O HOH A 315 16.885 25.844 8.361 1.00 0.00
ATOM 944 H1 HOH A 315 17.032 25.046 7.776 1.00 0.00
ATOM 945 H2 HOH A 315 16.194 26.437 7.949 1.00 0.00
ATOM 946 O HOH A 316 19.301 29.091 27.453 1.00 0.00
ATOM 947 H1 HOH A 316 18.413 29.227 27.014 1.00 0.00
ATOM 948 H2 HOH A 316 19.941 29.792 27.137 1.00 0.00
ATOM 949 O HOH A 317 7.289 28.857 10.086 1.00 0.00
ATOM 950 H1 HOH A 317 8.126 28.611 10.573 1.00 0.00
ATOM 951 H2 HOH A 317 6.500 28.460 10.556 1.00 0.00
ATOM 952 O HOH A 318 9.473 25.502 17.298 1.00 0.00
ATOM 953 H1 HOH A 318 10.384 25.906 17.224 1.00 0.00
ATOM 954 H2 HOH A 318 9.533 24.515 17.151 1.00 0.00
ATOM 955 O HOH A 319 6.777 24.997 3.898 1.00 0.00
ATOM 956 H1 HOH A 319 7.709 25.339 3.776 1.00 0.00
ATOM 957 H2 HOH A 319 6.431 25.287 4.790 1.00 0.00
ATOM 958 O HOH A 320 26.308 19.407 11.798 1.00 0.00
ATOM 959 H1 HOH A 320 26.256 20.273 11.301 1.00 0.00
ATOM 960 H2 HOH A 320 26.899 18.772 11.300 1.00 0.00
ATOM 961 O HOH A 321 15.057 16.733 8.842 1.00 0.00
ATOM 962 H1 HOH A 321 14.877 17.517 8.247 1.00 0.00
ATOM 963 H2 HOH A 321 15.996 16.419 8.704 1.00 0.00
ATOM 964 O HOH A 322 2.837 25.200 7.393 1.00 0.00
ATOM 965 H1 HOH A 322 2.417 25.183 6.486 1.00 0.00
ATOM 966 H2 HOH A 322 2.610 26.060 7.850 1.00 0.00
ATOM 967 O HOH A 323 9.625 3.358 30.073 1.00 0.00
ATOM 968 H1 HOH A 323 9.843 2.734 29.323 1.00 0.00
ATOM 969 H2 HOH A 323 9.817 4.298 29.791 1.00 0.00
ATOM 970 O HOH A 324 13.461 19.381 9.800 1.00 0.00
ATOM 971 H1 HOH A 324 13.482 20.210 10.359 1.00 0.00
ATOM 972 H2 HOH A 324 12.553 19.275 9.395 1.00 0.00
ATOM 973 O HOH A 325 24.695 28.743 10.477 1.00 0.00
ATOM 974 H1 HOH A 325 25.533 29.009 10.001 1.00 0.00
ATOM 975 H2 HOH A 325 23.979 28.545 9.808 1.00 0.00
ATOM 976 O HOH A 326 22.593 23.283 7.067 1.00 0.00
ATOM 977 H1 HOH A 326 22.519 24.237 6.774 1.00 0.00
ATOM 978 H2 HOH A 326 22.321 23.207 8.026 1.00 0.00
ATOM 979 O HOH A 327 8.866 0.891 15.551 1.00 0.00
ATOM 980 H1 HOH A 327 7.913 0.594 15.604 1.00 0.00
ATOM 981 H2 HOH A 327 9.343 0.633 16.391 1.00 0.00
ATOM 982 O HOH A 328 8.714 19.200 3.928 1.00 0.00
ATOM 983 H1 HOH A 328 9.496 19.330 3.318 1.00 0.00
ATOM 984 H2 HOH A 328 8.566 20.033 4.462 1.00 0.00
ATOM 985 O HOH A 329 25.278 1.682 1.797 1.00 0.00
ATOM 986 H1 HOH A 329 24.942 0.759 1.611 1.00 0.00
ATOM 987 H2 HOH A 329 26.228 1.636 2.104 1.00 0.00
ATOM 988 O HOH A 330 2.054 21.896 13.950 1.00 0.00
ATOM 989 H1 HOH A 330 1.511 22.720 13.789 1.00 0.00
ATOM 990 H2 HOH A 330 1.813 21.201 13.272 1.00 0.00
ATOM 991 O HOH A 331 8.384 21.789 4.797 1.00 0.00
ATOM 992 H1 HOH A 331 7.943 22.196 5.597 1.00 0.00
ATOM 993 H2 HOH A 331 9.148 22.365 4.508 1.00 0.00
ATOM 994 O HOH A 332 7.943 29.076 5.451 1.00 0.00
ATOM 995 H1 HOH A 332 8.510 29.265 4.648 1.00 0.00
ATOM 996 H2 HOH A 332 6.981 29.045 5.180 1.00 0.00
ATOM 997 O HOH A 333 9.626 22.228 12.970 1.00 0.00
ATOM 998 H1 HOH A 333 10.050 21.326 13.055 1.00 0.00
ATOM 999 H2 HOH A 333 10.050 22.726 12.213 1.00 0.00
ATOM 1000 O HOH A 334 12.212 23.999 18.192 1.00 0.00
ATOM 1001 H1 HOH A 334 12.369 24.878 18.642 1.00 0.00
ATOM 1002 H2 HOH A 334 11.458 23.523 18.645 1.00 0.00
ATOM 1003 O HOH A 335 16.398 26.813 15.645 1.00 0.00
ATOM 1004 H1 HOH A 335 15.448 26.632 15.900 1.00 0.00
ATOM 1005 H2 HOH A 335 16.422 27.478 14.899 1.00 0.00
ATOM 1006 O HOH A 336 8.753 26.239 12.192 1.00 0.00
ATOM 1007 H1 HOH A 336 9.260 26.831 11.566 1.00 0.00
ATOM 1008 H2 HOH A 336 8.124 25.663 11.671 1.00 0.00
ATOM 1009 O HOH A 337 9.544 14.765 4.496 1.00 0.00
ATOM 1010 H1 HOH A 337 9.860 14.793 3.547 1.00 0.00
ATOM 1011 H2 HOH A 337 8.660 15.227 4.567 1.00 0.00
ATOM 1012 O HOH A 338 7.019 17.482 7.235 1.00 0.00
ATOM 1013 H1 HOH A 338 7.996 17.666 7.130 1.00 0.00
ATOM 1014 H2 HOH A 338 6.693 16.956 6.450 1.00 0.00
ATOM 1015 O HOH A 339 23.361 28.099 19.927 1.00 0.00
ATOM 1016 H1 HOH A 339 23.205 27.613 19.067 1.00 0.00
ATOM 1017 H2 HOH A 339 24.273 27.878 20.274 1.00 0.00
ATOM 1018 O HOH A 340 1.033 20.868 8.497 1.00 0.00
ATOM 1019 H1 HOH A 340 0.313 20.902 9.190 1.00 0.00
ATOM 1020 H2 HOH A 340 1.613 21.679 8.578 1.00 0.00
ATOM 1021 O HOH A 341 18.351 27.765 9.688 1.00 0.00
ATOM 1022 H1 HOH A 341 18.011 27.055 9.071 1.00 0.00
ATOM 1023 H2 HOH A 341 18.669 28.547 9.152 1.00 0.00
ATOM 1024 O HOH A 342 11.708 0.014 5.622 1.00 0.00
ATOM 1025 H1 HOH A 342 12.041 0.921 5.878 1.00 0.00
ATOM 1026 H2 HOH A 342 11.026 -0.291 6.286 1.00 0.00
ATOM 1027 O HOH A 343 15.025 17.004 4.178 1.00 0.00
ATOM 1028 H1 HOH A 343 15.607 16.192 4.222 1.00 0.00
ATOM 1029 H2 HOH A 343 15.259 17.539 3.366 1.00 0.00
ATOM 1030 O HOH A 344 5.431 24.235 0.180 1.00 0.00
ATOM 1031 H1 HOH A 344 4.960 23.523 0.700 1.00 0.00
ATOM 1032 H2 HOH A 344 5.137 24.199 -0.775 1.00 0.00
ATOM 1033 O HOH A 345 6.786 19.069 16.797 1.00 0.00
ATOM 1034 H1 HOH A 345 5.848 18.837 17.054 1.00 0.00
ATOM 1035 H2 HOH A 345 7.025 19.962 17.179 1.00 0.00
ATOM 1036 O HOH A 346 11.926 19.987 27.368 1.00 0.00
ATOM 1037 H1 HOH A 346 11.201 19.725 26.732 1.00 0.00
ATOM 1038 H2 HOH A 346 11.520 20.389 28.189 1.00 0.00
ATOM 1039 O HOH A 347 4.730 11.596 20.673 1.00 0.00
ATOM 1040 H1 HOH A 347 4.772 10.699 20.233 1.00 0.00
ATOM 1041 H2 HOH A 347 3.844 11.704 21.124 1.00 0.00
ATOM 1042 O HOH A 348 15.946 2.721 14.440 1.00 0.00
ATOM 1043 H1 HOH A 348 15.249 3.289 14.878 1.00 0.00
ATOM 1044 H2 HOH A 348 16.200 3.123 13.561 1.00 0.00
ATOM 1045 O HOH A 349 11.035 24.107 29.757 1.00 0.00
ATOM 1046 H1 HOH A 349 11.888 24.052 29.239 1.00 0.00
ATOM 1047 H2 HOH A 349 11.097 23.521 30.565 1.00 0.00
ATOM 1048 O HOH A 350 7.116 19.742 10.870 1.00 0.00
ATOM 1049 H1 HOH A 350 6.478 19.051 10.530 1.00 0.00
ATOM 1050 H2 HOH A 350 6.795 20.089 11.751 1.00 0.00
ATOM 1051 O HOH A 351 7.307 12.902 3.130 1.00 0.00
ATOM 1052 H1 HOH A 351 7.674 11.989 2.951 1.00 0.00
ATOM 1053 H2 HOH A 351 7.454 13.137 4.091 1.00 0.00
ATOM 1054 O HOH A 352 17.268 27.142 4.744 1.00 0.00
ATOM 1055 H1 HOH A 352 18.057 26.710 5.181 1.00 0.00
ATOM 1056 H2 HOH A 352 17.485 28.094 4.530 1.00 0.00
ATOM 1057 O HOH A 353 9.936 28.275 10.626 1.00 0.00
ATOM 1058 H1 HOH A 353 10.408 27.960 9.802 1.00 0.00
ATOM 1059 H2 HOH A 353 10.460 29.015 11.048 1.00 0.00
ATOM 1060 O HOH A 354 13.739 23.249 1.344 1.00 0.00
ATOM 1061 H1 HOH A 354 14.688 23.204 1.658 1.00 0.00
ATOM 1062 H2 HOH A 354 13.721 23.442 0.363 1.00 0.00
ATOM 1063 O HOH A 355 5.294 19.539 13.380 1.00 0.00
ATOM 1064 H1 HOH A 355 4.607 19.949 12.781 1.00 0.00
ATOM 1065 H2 HOH A 355 4.937 18.687 13.763 1.00 0.00
ATOM 1066 O HOH A 356 2.240 22.534 5.760 1.00 0.00
ATOM 1067 H1 HOH A 356 1.870 23.153 5.067 1.00 0.00
ATOM 1068 H2 HOH A 356 1.581 21.805 5.942 1.00 0.00
ATOM 1069 O HOH A 357 6.975 14.314 5.710 1.00 0.00
ATOM 1070 H1 HOH A 357 7.101 15.094 5.097 1.00 0.00
ATOM 1071 H2 HOH A 357 7.477 14.473 6.560 1.00 0.00
ATOM 1072 O HOH A 358 13.595 23.846 7.225 1.00 0.00
ATOM 1073 H1 HOH A 358 13.504 24.752 6.811 1.00 0.00
ATOM 1074 H2 HOH A 358 13.998 23.215 6.561 1.00 0.00
ATOM 1075 O HOH A 359 17.170 27.301 12.017 1.00 0.00
ATOM 1076 H1 HOH A 359 17.481 27.632 11.126 1.00 0.00
ATOM 1077 H2 HOH A 359 16.171 27.259 12.027 1.00 0.00
ATOM 1078 O HOH A 360 17.635 22.210 9.562 1.00 0.00
ATOM 1079 H1 HOH A 360 16.788 21.680 9.611 1.00 0.00
ATOM 1080 H2 HOH A 360 18.393 21.659 9.909 1.00 0.00
ATOM 1081 O HOH A 361 19.820 25.007 1.128 1.00 0.00
ATOM 1082 H1 HOH A 361 20.297 24.250 0.682 1.00 0.00
ATOM 1083 H2 HOH A 361 19.493 25.650 0.436 1.00 0.00
ATOM 1084 O HOH A 362 5.499 16.883 2.343 1.00 0.00
ATOM 1085 H1 HOH A 362 5.449 17.634 1.684 1.00 0.00
ATOM 1086 H2 HOH A 362 4.577 16.654 2.657 1.00 0.00
ATOM 1087 O HOH A 363 13.907 2.490 10.851 1.00 0.00
ATOM 1088 H1 HOH A 363 13.111 2.893 11.302 1.00 0.00
ATOM 1089 H2 HOH A 363 14.127 3.017 10.030 1.00 0.00
ATOM 1090 O HOH A 364 7.979 21.200 18.244 1.00 0.00
ATOM 1091 H1 HOH A 364 8.327 21.961 17.696 1.00 0.00
ATOM 1092 H2 HOH A 364 8.734 20.590 18.484 1.00 0.00
ATOM 1093 O HOH A 365 1.748 24.819 11.912 1.00 0.00
ATOM 1094 H1 HOH A 365 1.960 25.668 11.428 1.00 0.00
ATOM 1095 H2 HOH A 365 2.591 24.424 12.276 1.00 0.00
ATOM 1096 O HOH A 366 13.724 25.456 15.957 1.00 0.00
ATOM 1097 H1 HOH A 366 13.513 25.903 16.827 1.00 0.00
ATOM 1098 H2 HOH A 366 13.110 24.678 15.825 1.00 0.00
ATOM 1099 O HOH A 367 28.595 22.047 4.346 1.00 0.00
ATOM 1100 H1 HOH A 367 29.131 21.656 5.094 1.00 0.00
ATOM 1101 H2 HOH A 367 29.092 22.818 3.947 1.00 0.00
ATOM 1102 O HOH A 368 13.355 20.840 3.981 1.00 0.00
ATOM 1103 H1 HOH A 368 13.895 20.398 3.265 1.00 0.00
ATOM 1104 H2 HOH A 368 13.942 21.449 4.514 1.00 0.00
ATOM 1105 O HOH A 369 3.654 25.277 15.766 1.00 0.00
ATOM 1106 H1 HOH A 369 3.223 24.376 15.797 1.00 0.00
ATOM 1107 H2 HOH A 369 4.614 25.197 16.035 1.00 0.00
ATOM 1108 O HOH A 370 18.349 26.621 20.199 1.00 0.00
ATOM 1109 H1 HOH A 370 18.003 25.876 19.628 1.00 0.00
ATOM 1110 H2 HOH A 370 18.373 26.325 21.154 1.00 0.00
ATOM 1111 O HOH A 371 3.744 15.611 10.438 1.00 0.00
ATOM 1112 H1 HOH A 371 3.924 14.979 11.192 1.00 0.00
ATOM 1113 H2 HOH A 371 2.913 16.133 10.630 1.00 0.00
ATOM 1114 O HOH A 372 4.754 22.348 17.641 1.00 0.00
ATOM 1115 H1 HOH A 372 3.782 22.575 17.578 1.00 0.00
ATOM 1116 H2 HOH A 372 5.065 21.969 16.770 1.00 0.00
ATOM 1117 O HOH A 373 7.283 22.765 2.488 1.00 0.00
ATOM 1118 H1 HOH A 373 7.661 22.223 3.238 1.00 0.00
ATOM 1119 H2 HOH A 373 7.051 23.679 2.821 1.00 0.00
ATOM 1120 O HOH A 374 16.572 0.324 12.127 1.00 0.00
ATOM 1121 H1 HOH A 374 16.669 1.315 12.224 1.00 0.00
ATOM 1122 H2 HOH A 374 17.209 -0.135 12.745 1.00 0.00
ATOM 1123 O HOH A 375 12.423 25.828 26.029 1.00 0.00
ATOM 1124 H1 HOH A 375 12.189 26.616 26.598 1.00 0.00
ATOM 1125 H2 HOH A 375 13.278 25.424 26.354 1.00 0.00
ATOM 1126 O HOH A 376 29.865 15.922 12.234 1.00 0.00
ATOM 1127 H1 HOH A 376 30.563 15.336 12.646 1.00 0.00
ATOM 1128 H2 HOH A 376 29.297 15.380 11.614 1.00 0.00
ATOM 1129 O HOH A 377 28.960 5.827 20.373 1.00 0.00
ATOM 1130 H1 HOH A 377 28.053 5.789 19.954 1.00 0.00
ATOM 1131 H2 HOH A 377 29.657 5.846 19.657 1.00 0.00
ATOM 1132 O HOH A 378 0.902 20.006 12.181 1.00 0.00
ATOM 1133 H1 HOH A 378 0.398 19.633 12.960 1.00 0.00
ATOM 1134 H2 HOH A 378 0.256 20.320 11.486 1.00 0.00
ATOM 1135 O HOH A 379 28.176 2.975 15.485 1.00 0.00
ATOM 1136 H1 HOH A 379 28.041 3.252 14.534 1.00 0.00
ATOM 1137 H2 HOH A 379 27.887 2.024 15.600 1.00 0.00
ATOM 1138 O HOH A 380 0.903 18.259 8.606 1.00 0.00
ATOM 1139 H1 HOH A 380 1.348 18.070 9.481 1.00 0.00
ATOM 1140 H2 HOH A 380 0.945 19.240 8.416 1.00 0.00
ATOM 1141 O HOH A 381 12.528 17.796 0.524 1.00 0.00
ATOM 1142 H1 HOH A 381 12.582 16.983 1.104 1.00 0.00
ATOM 1143 H2 HOH A 381 11.818 17.665 -0.168 1.00 0.00
ATOM 1144 O HOH A 382 7.013 23.097 7.065 1.00 0.00
ATOM 1145 H1 HOH A 382 6.555 23.937 6.774 1.00 0.00
ATOM 1146 H2 HOH A 382 6.921 22.993 8.055 1.00 0.00
ATOM 1147 O HOH A 383 5.392 1.869 15.100 1.00 0.00
ATOM 1148 H1 HOH A 383 5.197 1.419 15.972 1.00 0.00
ATOM 1149 H2 HOH A 383 5.469 1.180 14.380 1.00 0.00
ATOM 1150 O HOH A 384 16.415 23.668 1.375 1.00 0.00
ATOM 1151 H1 HOH A 384 16.755 24.561 1.080 1.00 0.00
ATOM 1152 H2 HOH A 384 16.648 22.979 0.689 1.00 0.00
ATOM 1153 O HOH A 385 15.311 27.512 2.524 1.00 0.00
ATOM 1154 H1 HOH A 385 16.119 27.514 3.113 1.00 0.00
ATOM 1155 H2 HOH A 385 14.936 28.437 2.469 1.00 0.00
ATOM 1156 O HOH A 386 3.652 1.025 4.632 1.00 0.00
ATOM 1157 H1 HOH A 386 3.563 1.973 4.939 1.00 0.00
ATOM 1158 H2 HOH A 386 3.790 1.007 3.642 1.00 0.00
ATOM 1159 O HOH A 387 5.912 25.421 6.746 1.00 0.00
ATOM 1160 H1 HOH A 387 4.941 25.460 6.981 1.00 0.00
ATOM 1161 H2 HOH A 387 6.402 26.146 7.230 1.00 0.00
ATOM 1162 O HOH A 388 5.710 21.660 15.219 1.00 0.00
ATOM 1163 H1 HOH A 388 6.457 22.251 14.915 1.00 0.00
ATOM 1164 H2 HOH A 388 5.654 20.860 14.621 1.00 0.00
ATOM 1165 O HOH A 389 10.253 25.955 14.539 1.00 0.00
ATOM 1166 H1 HOH A 389 9.735 26.174 13.712 1.00 0.00
ATOM 1167 H2 HOH A 389 9.619 25.774 15.291 1.00 0.00
ATOM 1168 O HOH A 390 11.926 23.944 11.781 1.00 0.00
ATOM 1169 H1 HOH A 390 12.581 24.616 11.434 1.00 0.00
ATOM 1170 H2 HOH A 390 11.927 23.963 12.780 1.00 0.00
ATOM 1171 O HOH A 391 7.318 22.704 9.818 1.00 0.00
ATOM 1172 H1 HOH A 391 7.244 21.719 9.973 1.00 0.00
ATOM 1173 H2 HOH A 391 8.278 22.979 9.871 1.00 0.00
ATOM 1174 O HOH A 392 26.860 22.265 6.414 1.00 0.00
ATOM 1175 H1 HOH A 392 27.556 22.109 5.713 1.00 0.00
ATOM 1176 H2 HOH A 392 26.077 21.666 6.246 1.00 0.00
ATOM 1177 O HOH A 393 1.327 26.173 14.896 1.00 0.00
ATOM 1178 H1 HOH A 393 0.746 25.382 14.704 1.00 0.00
ATOM 1179 H2 HOH A 393 2.251 25.862 15.119 1.00 0.00
ATOM 1180 O HOH A 394 12.069 4.224 12.448 1.00 0.00
ATOM 1181 H1 HOH A 394 12.443 4.136 13.371 1.00 0.00
ATOM 1182 H2 HOH A 394 11.259 4.810 12.471 1.00 0.00
ATOM 1183 O HOH A 395 4.276 19.561 4.323 1.00 0.00
ATOM 1184 H1 HOH A 395 4.420 20.260 5.024 1.00 0.00
ATOM 1185 H2 HOH A 395 5.160 19.207 4.019 1.00 0.00
ATOM 1186 O HOH A 396 16.580 24.642 11.298 1.00 0.00
ATOM 1187 H1 HOH A 396 16.877 25.561 11.558 1.00 0.00
ATOM 1188 H2 HOH A 396 17.059 24.359 10.467 1.00 0.00
ATOM 1189 O HOH A 397 2.103 22.769 16.406 1.00 0.00
ATOM 1190 H1 HOH A 397 2.119 22.275 15.537 1.00 0.00
ATOM 1191 H2 HOH A 397 1.224 22.620 16.858 1.00 0.00
ATOM 1192 O HOH A 398 1.462 20.848 29.718 1.00 0.00
ATOM 1193 H1 HOH A 398 0.540 20.463 29.681 1.00 0.00
ATOM 1194 H2 HOH A 398 1.859 20.851 28.801 1.00 0.00
ATOM 1195 O HOH A 399 28.839 27.486 15.400 1.00 0.00
ATOM 1196 H1 HOH A 399 29.782 27.164 15.486 1.00 0.00
ATOM 1197 H2 HOH A 399 28.830 28.485 15.357 1.00 0.00
ATOM 1198 O HOH A 400 5.853 29.952 13.156 1.00 0.00
ATOM 1199 H1 HOH A 400 6.027 30.721 12.542 1.00 0.00
ATOM 1200 H2 HOH A 400 5.481 29.185 12.633 1.00 0.00
ATOM 1201 O HOH A 401 13.350 25.706 3.062 1.00 0.00
ATOM 1202 H1 HOH A 401 14.249 26.032 2.769 1.00 0.00
ATOM 1203 H2 HOH A 401 13.273 24.727 2.876 1.00 0.00
ATOM 1204 O HOH A 402 13.124 9.833 3.416 1.00 0.00
ATOM 1205 H1 HOH A 402 12.920 9.922 2.441 1.00 0.00
ATOM 1206 H2 HOH A 402 13.194 8.865 3.654 1.00 0.00
ATOM 1207 O HOH A 403 14.200 19.359 1.860 1.00 0.00
ATOM 1208 H1 HOH A 403 13.448 18.983 1.318 1.00 0.00
ATOM 1209 H2 HOH A 403 14.602 20.137 1.377 1.00 0.00
ATOM 1210 O HOH A 404 13.101 26.137 5.800 1.00 0.00
ATOM 1211 H1 HOH A 404 13.373 25.772 4.910 1.00 0.00
ATOM 1212 H2 HOH A 404 13.834 26.713 6.162 1.00 0.00
ATOM 1213 O HOH A 405 17.858 17.989 7.992 1.00 0.00
ATOM 1214 H1 HOH A 405 17.365 18.329 8.793 1.00 0.00
ATOM 1215 H2 HOH A 405 18.829 18.213 8.079 1.00 0.00
ATOM 1216 O HOH A 406 3.707 28.235 15.418 1.00 0.00
ATOM 1217 H1 HOH A 406 4.640 28.446 15.128 1.00 0.00
ATOM 1218 H2 HOH A 406 3.555 27.248 15.364 1.00 0.00
ATOM 1219 O HOH A 407 10.924 27.395 6.250 1.00 0.00
ATOM 1220 H1 HOH A 407 11.849 27.023 6.177 1.00 0.00
ATOM 1221 H2 HOH A 407 10.280 26.781 5.794 1.00 0.00
ATOM 1222 O HOH A 408 2.748 2.760 19.482 1.00 0.00
ATOM 1223 H1 HOH A 408 2.328 1.994 19.968 1.00 0.00
ATOM 1224 H2 HOH A 408 2.694 2.599 18.497 1.00 0.00
ATOM 1225 O HOH A 409 6.338 24.775 11.281 1.00 0.00
ATOM 1226 H1 HOH A 409 5.500 24.360 11.636 1.00 0.00
ATOM 1227 H2 HOH A 409 6.852 24.094 10.760 1.00 0.00
ATOM 1228 O HOH A 410 16.556 24.119 15.496 1.00 0.00
ATOM 1229 H1 HOH A 410 15.827 23.696 16.034 1.00 0.00
ATOM 1230 H2 HOH A 410 16.507 25.113 15.591 1.00 0.00
ATOM 1231 O HOH A 411 4.141 26.603 21.793 1.00 0.00
ATOM 1232 H1 HOH A 411 4.280 26.367 22.754 1.00 0.00
ATOM 1233 H2 HOH A 411 3.886 25.783 21.281 1.00 0.00
ATOM 1234 O HOH A 412 4.182 17.403 14.934 1.00 0.00
ATOM 1235 H1 HOH A 412 3.356 17.815 15.320 1.00 0.00
ATOM 1236 H2 HOH A 412 4.711 16.970 15.664 1.00 0.00
ATOM 1237 O HOH A 413 4.135 27.498 1.366 1.00 0.00
ATOM 1238 H1 HOH A 413 3.809 27.429 2.308 1.00 0.00
ATOM 1239 H2 HOH A 413 4.484 26.610 1.068 1.00 0.00
ATOM 1240 O HOH A 414 8.972 5.342 18.879 1.00 0.00
ATOM 1241 H1 HOH A 414 9.593 6.104 18.694 1.00 0.00
ATOM 1242 H2 HOH A 414 9.046 5.078 19.840 1.00 0.00
ATOM 1243 O HOH A 415 15.723 5.878 1.462 1.00 0.00
ATOM 1244 H1 HOH A 415 14.945 5.251 1.439 1.00 0.00
ATOM 1245 H2 HOH A 415 16.477 5.494 0.929 1.00 0.00
ATOM 1246 O HOH A 416 5.452 27.378 11.271 1.00 0.00
ATOM 1247 H1 HOH A 416 5.618 26.401 11.143 1.00 0.00
ATOM 1248 H2 HOH A 416 4.469 27.558 11.228 1.00 0.00
ATOM 1249 O HOH A 417 7.510 23.362 14.208 1.00 0.00
ATOM 1250 H1 HOH A 417 7.343 24.302 13.910 1.00 0.00
ATOM 1251 H2 HOH A 417 8.158 22.925 13.586 1.00 0.00
ATOM 1252 O HOH A 418 18.443 28.921 13.647 1.00 0.00
ATOM 1253 H1 HOH A 418 19.146 28.442 14.173 1.00 0.00
ATOM 1254 H2 HOH A 418 18.062 28.302 12.960 1.00 0.00
ATOM 1255 O HOH A 419 9.295 17.717 6.047 1.00 0.00
ATOM 1256 H1 HOH A 419 10.204 17.407 5.767 1.00 0.00
ATOM 1257 H2 HOH A 419 8.929 18.341 5.356 1.00 0.00
ATOM 1258 O HOH A 420 3.885 26.230 3.973 1.00 0.00
ATOM 1259 H1 HOH A 420 3.027 25.998 4.430 1.00 0.00
ATOM 1260 H2 HOH A 420 4.500 25.441 3.997 1.00 0.00
ATOM 1261 O HOH A 421 19.825 23.060 22.528 1.00 0.00
ATOM 1262 H1 HOH A 421 19.025 22.877 23.098 1.00 0.00
ATOM 1263 H2 HOH A 421 19.843 22.419 21.761 1.00 0.00
ATOM 1264 O HOH A 422 18.535 27.241 17.059 1.00 0.00
ATOM 1265 H1 HOH A 422 18.410 27.010 18.024 1.00 0.00
ATOM 1266 H2 HOH A 422 17.652 27.207 16.591 1.00 0.00
ATOM 1267 O HOH A 423 4.564 20.791 9.116 1.00 0.00
ATOM 1268 H1 HOH A 423 4.909 19.875 9.320 1.00 0.00
ATOM 1269 H2 HOH A 423 4.644 20.967 8.135 1.00 0.00
ATOM 1270 O HOH A 424 9.636 24.192 27.262 1.00 0.00
ATOM 1271 H1 HOH A 424 10.219 24.960 26.995 1.00 0.00
ATOM 1272 H2 HOH A 424 9.875 23.899 28.187 1.00 0.00
ATOM 1273 O HOH A 425 5.881 2.753 4.162 1.00 0.00
ATOM 1274 H1 HOH A 425 5.699 2.146 3.389 1.00 0.00
ATOM 1275 H2 HOH A 425 6.747 3.230 4.015 1.00 0.00
ATOM 1276 O HOH A 426 21.357 17.066 14.993 1.00 0.00
ATOM 1277 H1 HOH A 426 20.767 17.680 14.469 1.00 0.00
ATOM 1278 H2 HOH A 426 21.276 16.137 14.631 1.00 0.00
ATOM 1279 O HOH A 427 0.563 23.513 3.341 1.00 0.00
ATOM 1280 H1 HOH A 427 1.115 22.805 2.900 1.00 0.00
ATOM 1281 H2 HOH A 427 0.321 24.214 2.670 1.00 0.00
ATOM 1282 O HOH A 428 3.514 21.016 11.704 1.00 0.00
ATOM 1283 H1 HOH A 428 2.673 20.487 11.594 1.00 0.00
ATOM 1284 H2 HOH A 428 3.990 21.074 10.827 1.00 0.00
ATOM 1285 O HOH A 429 10.096 23.619 6.710 1.00 0.00
ATOM 1286 H1 HOH A 429 9.440 23.716 7.459 1.00 0.00
ATOM 1287 H2 HOH A 429 10.314 22.651 6.581 1.00 0.00
ATOM 1288 O HOH A 430 10.131 22.918 10.194 1.00 0.00
ATOM 1289 H1 HOH A 430 10.570 23.552 10.832 1.00 0.00
ATOM 1290 H2 HOH A 430 10.832 22.411 9.693 1.00 0.00
ATOM 1291 O HOH A 431 10.257 0.490 29.051 1.00 0.00
ATOM 1292 H1 HOH A 431 10.509 0.709 28.108 1.00 0.00
ATOM 1293 H2 HOH A 431 9.510 -0.175 29.051 1.00 0.00
ATOM 1294 O HOH A 432 18.888 16.329 2.389 1.00 0.00
ATOM 1295 H1 HOH A 432 18.603 17.282 2.498 1.00 0.00
ATOM 1296 H2 HOH A 432 19.479 16.069 3.152 1.00 0.00
ATOM 1297 O HOH A 433 10.144 24.096 4.007 1.00 0.00
ATOM 1298 H1 HOH A 433 9.968 25.029 3.693 1.00 0.00
ATOM 1299 H2 HOH A 433 10.235 24.091 5.003 1.00 0.00
ATOM 1300 O HOH A 434 14.346 18.163 6.741 1.00 0.00
ATOM 1301 H1 HOH A 434 14.337 17.571 5.935 1.00 0.00
ATOM 1302 H2 HOH A 434 14.931 18.955 6.567 1.00 0.00
ATOM 1303 O HOH A 435 26.570 29.833 6.500 1.00 0.00
ATOM 1304 H1 HOH A 435 27.314 29.485 5.929 1.00 0.00
ATOM 1305 H2 HOH A 435 26.371 29.175 7.226 1.00 0.00
ATOM 1306 O HOH A 436 16.580 29.484 26.332 1.00 0.00
ATOM 1307 H1 HOH A 436 16.272 30.365 25.971 1.00 0.00
ATOM 1308 H2 HOH A 436 16.318 29.410 27.295 1.00 0.00
ATOM 1309 O HOH A 437 11.222 23.365 24.963 1.00 0.00
ATOM 1310 H1 HOH A 437 10.445 23.407 25.591 1.00 0.00
ATOM 1311 H2 HOH A 437 11.877 24.084 25.194 1.00 0.00
ATOM 1312 O HOH A 438 19.858 23.247 18.035 1.00 0.00
ATOM 1313 H1 HOH A 438 19.960 22.879 18.959 1.00 0.00
ATOM 1314 H2 HOH A 438 18.946 23.642 17.933 1.00 0.00
ATOM 1315 O HOH A 439 10.108 1.661 25.831 1.00 0.00
ATOM 1316 H1 HOH A 439 9.146 1.852 25.632 1.00 0.00
ATOM 1317 H2 HOH A 439 10.350 0.760 25.472 1.00 0.00
ATOM 1318 O HOH A 440 10.895 -0.090 20.570 1.00 0.00
ATOM 1319 H1 HOH A 440 11.789 -0.000 21.008 1.00 0.00
ATOM 1320 H2 HOH A 440 10.278 0.611 20.924 1.00 0.00
ATOM 1321 O HOH A 441 16.486 26.815 0.002 1.00 0.00
ATOM 1322 H1 HOH A 441 15.911 27.480 -0.474 1.00 0.00
ATOM 1323 H2 HOH A 441 16.450 26.987 0.986 1.00 0.00
ATOM 1324 O HOH A 442 0.486 27.856 0.410 1.00 0.00
ATOM 1325 H1 HOH A 442 1.131 28.428 0.917 1.00 0.00
ATOM 1326 H2 HOH A 442 0.457 28.152 -0.544 1.00 0.00
ATOM 1327 O HOH A 443 9.531 27.698 19.811 1.00 0.00
ATOM 1328 H1 HOH A 443 10.130 28.469 20.028 1.00 0.00
ATOM 1329 H2 HOH A 443 9.284 27.221 20.655 1.00 0.00
ATOM 1330 O HOH A 444 0.552 18.935 22.655 1.00 0.00
ATOM 1331 H1 HOH A 444 1.184 18.552 23.328 1.00 0.00
ATOM 1332 H2 HOH A 444 1.072 19.389 21.931 1.00 0.00
ATOM 1333 O HOH A 445 15.873 26.839 18.577 1.00 0.00
ATOM 1334 H1 HOH A 445 16.256 27.466 19.256 1.00 0.00
ATOM 1335 H2 HOH A 445 14.970 27.164 18.295 1.00 0.00
ATOM 1336 O HOH A 446 7.621 23.111 22.142 1.00 0.00
ATOM 1337 H1 HOH A 446 6.931 22.730 21.527 1.00 0.00
ATOM 1338 H2 HOH A 446 7.648 24.105 22.036 1.00 0.00
ATOM 1339 O HOH A 447 16.656 29.171 20.734 1.00 0.00
ATOM 1340 H1 HOH A 447 17.034 29.559 19.893 1.00 0.00
ATOM 1341 H2 HOH A 447 17.392 29.029 21.396 1.00 0.00
ATOM 1342 O HOH A 448 1.525 29.904 15.297 1.00 0.00
ATOM 1343 H1 HOH A 448 2.015 30.732 15.569 1.00 0.00
ATOM 1344 H2 HOH A 448 2.154 29.127 15.307 1.00 0.00
ATOM 1345 O HOH A 449 10.672 22.427 1.693 1.00 0.00
ATOM 1346 H1 HOH A 449 11.577 22.063 1.911 1.00 0.00
ATOM 1347 H2 HOH A 449 10.376 23.045 2.421 1.00 0.00
ATOM 1348 O HOH A 450 8.730 27.048 24.253 1.00 0.00
ATOM 1349 H1 HOH A 450 8.611 27.974 23.894 1.00 0.00
ATOM 1350 H2 HOH A 450 9.113 27.096 25.176 1.00 0.00
ATOM 1351 O HOH A 451 4.182 23.490 12.512 1.00 0.00
ATOM 1352 H1 HOH A 451 4.398 23.231 13.454 1.00 0.00
ATOM 1353 H2 HOH A 451 3.798 22.703 12.030 1.00 0.00
ATOM 1354 O HOH A 452 6.715 19.881 2.270 1.00 0.00
ATOM 1355 H1 HOH A 452 7.415 19.489 2.868 1.00 0.00
ATOM 1356 H2 HOH A 452 6.921 20.845 2.104 1.00 0.00
ATOM 1357 O HOH A 453 17.507 28.023 24.064 1.00 0.00
ATOM 1358 H1 HOH A 453 17.046 28.539 24.786 1.00 0.00
ATOM 1359 H2 HOH A 453 17.847 28.655 23.367 1.00 0.00
ATOM 1360 O HOH A 454 17.434 22.941 28.550 1.00 0.00
ATOM 1361 H1 HOH A 454 16.583 22.628 28.127 1.00 0.00
ATOM 1362 H2 HOH A 454 17.954 23.483 27.891 1.00 0.00
ATOM 1363 O HOH A 455 13.655 23.008 20.755 1.00 0.00
ATOM 1364 H1 HOH A 455 13.392 22.760 21.688 1.00 0.00
ATOM 1365 H2 HOH A 455 12.878 22.865 20.141 1.00 0.00
ATOM 1366 O HOH A 456 5.191 29.976 24.475 1.00 0.00
ATOM 1367 H1 HOH A 456 5.814 30.245 25.209 1.00 0.00
ATOM 1368 H2 HOH A 456 4.679 29.163 24.753 1.00 0.00
ATOM 1369 O HOH A 457 4.362 15.078 13.215 1.00 0.00
ATOM 1370 H1 HOH A 457 4.327 15.949 13.705 1.00 0.00
ATOM 1371 H2 HOH A 457 3.434 14.725 13.095 1.00 0.00
ATOM 1372 O HOH A 458 16.221 2.308 23.239 1.00 0.00
ATOM 1373 H1 HOH A 458 15.378 2.556 23.716 1.00 0.00
ATOM 1374 H2 HOH A 458 15.999 1.962 22.327 1.00 0.00
ATOM 1375 O HOH A 459 6.042 20.952 25.030 1.00 0.00
ATOM 1376 H1 HOH A 459 6.509 20.371 24.363 1.00 0.00
ATOM 1377 H2 HOH A 459 6.692 21.608 25.413 1.00 0.00
ATOM 1378 O HOH A 460 26.433 15.060 22.054 1.00 0.00
ATOM 1379 H1 HOH A 460 26.744 14.175 21.708 1.00 0.00
ATOM 1380 H2 HOH A 460 26.399 15.719 21.303 1.00 0.00
ATOM 1381 O HOH A 461 4.827 17.758 22.774 1.00 0.00
ATOM 1382 H1 HOH A 461 4.752 17.556 21.797 1.00 0.00
ATOM 1383 H2 HOH A 461 5.359 17.040 23.223 1.00 0.00
ATOM 1384 O HOH A 462 11.876 25.832 20.267 1.00 0.00
ATOM 1385 H1 HOH A 462 10.894 25.962 20.131 1.00 0.00
ATOM 1386 H2 HOH A 462 12.077 25.812 21.246 1.00 0.00
ATOM 1387 O HOH A 463 4.869 14.458 21.735 1.00 0.00
ATOM 1388 H1 HOH A 463 4.682 13.476 21.720 1.00 0.00
ATOM 1389 H2 HOH A 463 4.214 14.931 21.147 1.00 0.00
ATOM 1390 O HOH A 464 10.839 22.697 20.038 1.00 0.00
ATOM 1391 H1 HOH A 464 10.879 21.741 20.328 1.00 0.00
ATOM 1392 H2 HOH A 464 9.917 23.054 20.192 1.00 0.00
ATOM 1393 O HOH A 465 15.377 21.705 26.967 1.00 0.00
ATOM 1394 H1 HOH A 465 15.315 21.790 25.972 1.00 0.00
ATOM 1395 H2 HOH A 465 15.578 20.756 27.209 1.00 0.00
ATOM 1396 O HOH A 466 16.290 25.746 23.332 1.00 0.00
ATOM 1397 H1 HOH A 466 16.591 26.653 23.627 1.00 0.00
ATOM 1398 H2 HOH A 466 15.764 25.829 22.485 1.00 0.00
ATOM 1399 O HOH A 467 20.000 28.768 20.280 1.00 0.00
ATOM 1400 H1 HOH A 467 19.540 27.881 20.248 1.00 0.00
ATOM 1401 H2 HOH A 467 20.418 28.959 19.392 1.00 0.00
ATOM 1402 O HOH A 468 14.578 29.479 16.565 1.00 0.00
ATOM 1403 H1 HOH A 468 15.513 29.829 16.503 1.00 0.00
ATOM 1404 H2 HOH A 468 14.194 29.391 15.646 1.00 0.00
ATOM 1405 O HOH A 469 7.479 14.247 20.805 1.00 0.00
ATOM 1406 H1 HOH A 469 6.597 14.286 21.275 1.00 0.00
ATOM 1407 H2 HOH A 469 7.402 13.658 20.000 1.00 0.00
ATOM 1408 O HOH A 470 19.102 -0.034 1.991 1.00 0.00
ATOM 1409 H1 HOH A 470 19.244 0.815 1.482 1.00 0.00
ATOM 1410 H2 HOH A 470 18.183 -0.035 2.387 1.00 0.00
ATOM 1411 O HOH A 471 13.706 23.484 28.500 1.00 0.00
ATOM 1412 H1 HOH A 471 13.894 22.586 28.104 1.00 0.00
ATOM 1413 H2 HOH A 471 14.349 24.154 28.129 1.00 0.00
ATOM 1414 O HOH A 472 4.936 25.446 24.399 1.00 0.00
ATOM 1415 H1 HOH A 472 4.794 24.456 24.407 1.00 0.00
ATOM 1416 H2 HOH A 472 5.662 25.683 25.045 1.00 0.00
ATOM 1417 O HOH A 473 17.377 24.602 18.883 1.00 0.00
ATOM 1418 H1 HOH A 473 16.654 25.246 18.636 1.00 0.00
ATOM 1419 H2 HOH A 473 16.968 23.760 19.235 1.00 0.00
ATOM 1420 O HOH A 474 8.196 22.854 29.600 1.00 0.00
ATOM 1421 H1 HOH A 474 8.207 22.955 30.595 1.00 0.00
ATOM 1422 H2 HOH A 474 7.723 23.635 29.191 1.00 0.00
ATOM 1423 O HOH A 475 14.526 25.412 21.031 1.00 0.00
ATOM 1424 H1 HOH A 475 14.158 24.488 20.920 1.00 0.00
ATOM 1425 H2 HOH A 475 14.725 25.801 20.131 1.00 0.00
ATOM 1426 O HOH A 476 1.962 18.345 3.537 1.00 0.00
ATOM 1427 H1 HOH A 476 2.790 18.747 3.927 1.00 0.00
ATOM 1428 H2 HOH A 476 1.168 18.888 3.810 1.00 0.00
ATOM 1429 O HOH A 477 10.432 21.057 29.347 1.00 0.00
ATOM 1430 H1 HOH A 477 10.811 21.309 30.237 1.00 0.00
ATOM 1431 H2 HOH A 477 9.820 21.780 29.028 1.00 0.00
ATOM 1432 O HOH A 478 4.041 19.409 18.201 1.00 0.00
ATOM 1433 H1 HOH A 478 3.463 19.082 17.454 1.00 0.00
ATOM 1434 H2 HOH A 478 4.092 20.407 18.171 1.00 0.00
ATOM 1435 O HOH A 479 16.150 22.509 19.897 1.00 0.00
ATOM 1436 H1 HOH A 479 16.550 21.614 20.092 1.00 0.00
ATOM 1437 H2 HOH A 479 15.234 22.559 20.295 1.00 0.00
ATOM 1438 O HOH A 480 5.704 21.234 29.100 1.00 0.00
ATOM 1439 H1 HOH A 480 6.327 21.710 29.720 1.00 0.00
ATOM 1440 H2 HOH A 480 6.220 20.866 28.326 1.00 0.00
ATOM 1441 O HOH A 481 9.533 22.944 16.335 1.00 0.00
ATOM 1442 H1 HOH A 481 8.850 23.123 15.627 1.00 0.00
ATOM 1443 H2 HOH A 481 10.229 22.322 15.976 1.00 0.00
ATOM 1444 O HOH A 482 16.980 0.688 16.014 1.00 0.00
ATOM 1445 H1 HOH A 482 16.611 1.464 15.501 1.00 0.00
ATOM 1446 H2 HOH A 482 17.465 0.076 15.390 1.00 0.00
ATOM 1447 O HOH A 483 5.983 24.005 27.382 1.00 0.00
ATOM 1448 H1 HOH A 483 5.935 24.926 26.997 1.00 0.00
ATOM 1449 H2 HOH A 483 6.618 23.451 26.844 1.00 0.00
ATOM 1450 O HOH A 484 12.332 25.481 23.088 1.00 0.00
ATOM 1451 H1 HOH A 484 12.165 25.931 23.965 1.00 0.00
ATOM 1452 H2 HOH A 484 13.317 25.368 22.953 1.00 0.00
ATOM 1453 O HOH A 485 8.389 24.453 19.447 1.00 0.00
ATOM 1454 H1 HOH A 485 8.259 25.027 20.256 1.00 0.00
ATOM 1455 H2 HOH A 485 9.107 24.845 18.872 1.00 0.00
ATOM 1456 O HOH A 486 13.076 29.621 14.343 1.00 0.00
ATOM 1457 H1 HOH A 486 13.138 30.025 13.430 1.00 0.00
ATOM 1458 H2 HOH A 486 12.949 28.633 14.262 1.00 0.00
ATOM 1459 O HOH A 487 13.189 26.945 18.211 1.00 0.00
ATOM 1460 H1 HOH A 487 13.088 27.940 18.177 1.00 0.00
ATOM 1461 H2 HOH A 487 12.761 26.594 19.043 1.00 0.00
ATOM 1462 O HOH A 488 12.660 23.255 14.390 1.00 0.00
ATOM 1463 H1 HOH A 488 13.596 22.920 14.279 1.00 0.00
ATOM 1464 H2 HOH A 488 12.156 22.639 14.996 1.00 0.00
ATOM 1465 O HOH A 489 15.466 19.221 25.103 1.00 0.00
ATOM 1466 H1 HOH A 489 15.800 18.894 24.218 1.00 0.00
ATOM 1467 H2 HOH A 489 14.653 19.786 24.964 1.00 0.00
ATOM 1468 O HOH A 490 15.419 23.427 24.464 1.00 0.00
ATOM 1469 H1 HOH A 490 15.701 24.309 24.086 1.00 0.00
ATOM 1470 H2 HOH A 490 14.774 22.988 23.839 1.00 0.00
ATOM 1471 O HOH A 491 18.145 17.783 28.897 1.00 0.00
ATOM 1472 H1 HOH A 491 17.979 17.076 29.584 1.00 0.00
ATOM 1473 H2 HOH A 491 17.429 17.746 28.200 1.00 0.00
ATOM 1474 O HOH A 492 10.477 0.969 17.998 1.00 0.00
ATOM 1475 H1 HOH A 492 10.292 0.506 18.865 1.00 0.00
ATOM 1476 H2 HOH A 492 10.634 1.942 18.167 1.00 0.00
ATOM 1477 O HOH A 493 13.689 14.878 1.573 1.00 0.00
ATOM 1478 H1 HOH A 493 14.003 14.668 0.647 1.00 0.00
ATOM 1479 H2 HOH A 493 14.474 15.111 2.147 1.00 0.00
ATOM 1480 O HOH A 494 30.000 9.957 24.645 1.00 0.00
ATOM 1481 H1 HOH A 494 30.668 10.269 23.969 1.00 0.00
ATOM 1482 H2 HOH A 494 29.152 9.700 24.181 1.00 0.00
ATOM 1483 O HOH A 495 13.444 4.461 24.399 1.00 0.00
ATOM 1484 H1 HOH A 495 13.927 4.968 23.684 1.00 0.00
ATOM 1485 H2 HOH A 495 12.580 4.919 24.606 1.00 0.00
ATOM 1486 O HOH A 496 6.296 24.769 17.133 1.00 0.00
ATOM 1487 H1 HOH A 496 7.037 24.992 17.766 1.00 0.00
ATOM 1488 H2 HOH A 496 6.022 23.816 17.264 1.00 0.00
ATOM 1489 O HOH A 497 7.338 1.914 24.714 1.00 0.00
ATOM 1490 H1 HOH A 497 6.392 2.215 24.830 1.00 0.00
ATOM 1491 H2 HOH A 497 7.367 1.145 24.075 1.00 0.00
ATOM 1492 O HOH A 498 14.322 19.367 28.438 1.00 0.00
ATOM 1493 H1 HOH A 498 14.143 18.485 28.874 1.00 0.00
ATOM 1494 H2 HOH A 498 13.497 19.678 27.966 1.00 0.00
ATOM 1495 O HOH A 499 12.066 1.451 15.820 1.00 0.00
ATOM 1496 H1 HOH A 499 12.457 0.704 15.281 1.00 0.00
ATOM 1497 H2 HOH A 499 11.352 1.090 16.420 1.00 0.00
ATOM 1498 O HOH A 500 27.543 4.102 27.154 1.00 0.00
ATOM 1499 H1 HOH A 500 27.882 3.777 26.271 1.00 0.00
ATOM 1500 H2 HOH A 500 27.032 3.370 27.605 1.00 0.00
ATOM 1501 O HOH A 501 19.903 14.036 0.251 1.00 0.00
ATOM 1502 H1 HOH A 501 20.849 13.726 0.350 1.00 0.00
ATOM 1503 H2 HOH A 501 19.690 14.693 0.974 1.00 0.00
ATOM 1504 O HOH A 502 2.523 17.774 24.221 1.00 0.00
ATOM 1505 H1 HOH A 502 2.741 18.275 25.058 1.00 0.00
ATOM 1506 H2 HOH A 502 3.304 17.811 23.597 1.00 0.00
ATOM 1507 O HOH A 503 8.127 29.533 23.161 1.00 0.00
ATOM 1508 H1 HOH A 503 7.237 29.465 22.710 1.00 0.00
ATOM 1509 H2 HOH A 503 8.719 30.146 22.638 1.00 0.00
ATOM 1510 O HOH A 504 15.584 16.383 18.271 1.00 0.00
ATOM 1511 H1 HOH A 504 14.810 16.496 18.894 1.00 0.00
ATOM 1512 H2 HOH A 504 16.340 16.965 18.570 1.00 0.00
ATOM 1513 O HOH A 505 16.161 17.298 27.136 1.00 0.00
ATOM 1514 H1 HOH A 505 15.965 18.106 26.581 1.00 0.00
ATOM 1515 H2 HOH A 505 15.327 16.758 27.245 1.00 0.00
ATOM 1516 O HOH A 506 13.248 22.014 23.335 1.00 0.00
ATOM 1517 H1 HOH A 506 12.962 21.068 23.484 1.00 0.00
ATOM 1518 H2 HOH A 506 12.734 22.618 23.945 1.00 0.00
ATOM 1519 O HOH A 507 3.181 1.678 23.187 1.00 0.00
ATOM 1520 H1 HOH A 507 3.897 1.035 23.460 1.00 0.00
ATOM 1521 H2 HOH A 507 3.501 2.225 22.413 1.00 0.00
ATOM 1522 O HOH A 508 19.667 9.364 27.823 1.00 0.00
ATOM 1523 H1 HOH A 508 20.168 10.228 27.765 1.00 0.00
ATOM 1524 H2 HOH A 508 18.689 9.551 27.911 1.00 0.00
ATOM 1525 O HOH A 509 18.809 3.250 3.846 1.00 0.00
ATOM 1526 H1 HOH A 509 18.001 2.884 4.308 1.00 0.00
ATOM 1527 H2 HOH A 509 19.616 3.104 4.419 1.00 0.00
ATOM 1528 O HOH A 510 11.720 27.057 8.835 1.00 0.00
ATOM 1529 H1 HOH A 510 11.396 27.219 7.903 1.00 0.00
ATOM 1530 H2 HOH A 510 12.193 26.177 8.875 1.00 0.00
ATOM 1531 O HOH A 511 18.910 11.081 1.997 1.00 0.00
ATOM 1532 H1 HOH A 511 18.673 10.403 2.693 1.00 0.00
ATOM 1533 H2 HOH A 511 18.606 10.758 1.100 1.00 0.00
ATOM 1534 O HOH A 512 24.446 16.092 4.512 1.00 0.00
ATOM 1535 H1 HOH A 512 24.515 17.035 4.836 1.00 0.00
ATOM 1536 H2 HOH A 512 24.281 16.089 3.526 1.00 0.00
ATOM 1537 O HOH A 513 27.958 12.513 20.880 1.00 0.00
ATOM 1538 H1 HOH A 513 28.844 12.900 20.625 1.00 0.00
ATOM 1539 H2 HOH A 513 28.055 11.986 21.724 1.00 0.00
ATOM 1540 O HOH A 514 27.959 7.273 9.593 1.00 0.00
ATOM 1541 H1 HOH A 514 28.207 8.240 9.660 1.00 0.00
ATOM 1542 H2 HOH A 514 27.381 7.132 8.789 1.00 0.00
ATOM 1543 O HOH A 515 20.298 10.087 18.271 1.00 0.00
ATOM 1544 H1 HOH A 515 20.385 9.213 18.749 1.00 0.00
ATOM 1545 H2 HOH A 515 21.147 10.287 17.783 1.00 0.00
ATOM 1546 O HOH A 516 26.694 15.617 8.129 1.00 0.00
ATOM 1547 H1 HOH A 516 26.320 15.132 7.338 1.00 0.00
ATOM 1548 H2 HOH A 516 27.692 15.634 8.069 1.00 0.00
ATOM 1549 O HOH A 517 24.513 6.083 15.612 1.00 0.00
ATOM 1550 H1 HOH A 517 24.190 6.433 16.491 1.00 0.00
ATOM 1551 H2 HOH A 517 24.426 5.087 15.597 1.00 0.00
ATOM 1552 O HOH A 518 22.796 18.681 1.927 1.00 0.00
ATOM 1553 H1 HOH A 518 23.391 18.642 2.730 1.00 0.00
ATOM 1554 H2 HOH A 518 23.293 19.097 1.165 1.00 0.00
ATOM 1555 O HOH A 519 29.790 14.411 18.038 1.00 0.00
ATOM 1556 H1 HOH A 519 29.897 15.246 18.579 1.00 0.00
ATOM 1557 H2 HOH A 519 29.980 13.615 18.612 1.00 0.00
ATOM 1558 O HOH A 520 16.458 20.653 6.987 1.00 0.00
ATOM 1559 H1 HOH A 520 16.513 20.177 7.864 1.00 0.00
ATOM 1560 H2 HOH A 520 17.307 20.514 6.478 1.00 0.00
ATOM 1561 O HOH A 521 28.937 0.649 18.757 1.00 0.00
ATOM 1562 H1 HOH A 521 29.712 1.026 19.264 1.00 0.00
ATOM 1563 H2 HOH A 521 28.193 1.318 18.740 1.00 0.00
ATOM 1564 O HOH A 522 21.556 17.527 17.560 1.00 0.00
ATOM 1565 H1 HOH A 522 22.533 17.512 17.776 1.00 0.00
ATOM 1566 H2 HOH A 522 21.410 17.138 16.650 1.00 0.00
ATOM 1567 O HOH A 523 24.927 11.487 5.430 1.00 0.00
ATOM 1568 H1 HOH A 523 24.784 10.501 5.344 1.00 0.00
ATOM 1569 H2 HOH A 523 24.838 11.755 6.390 1.00 0.00
ATOM 1570 O HOH A 524 20.008 6.754 5.625 1.00 0.00
ATOM 1571 H1 HOH A 524 20.675 6.065 5.343 1.00 0.00
ATOM 1572 H2 HOH A 524 19.394 6.363 6.311 1.00 0.00
ATOM 1573 O HOH A 525 21.480 22.480 26.799 1.00 0.00
ATOM 1574 H1 HOH A 525 21.190 21.856 26.073 1.00 0.00
ATOM 1575 H2 HOH A 525 21.780 21.950 27.593 1.00 0.00
ATOM 1576 O HOH A 526 17.718 5.528 16.349 1.00 0.00
ATOM 1577 H1 HOH A 526 17.833 6.176 15.596 1.00 0.00
ATOM 1578 H2 HOH A 526 18.566 5.015 16.480 1.00 0.00
ATOM 1579 O HOH A 527 12.943 9.724 0.496 1.00 0.00
ATOM 1580 H1 HOH A 527 12.676 10.601 0.097 1.00 0.00
ATOM 1581 H2 HOH A 527 12.364 8.999 0.125 1.00 0.00
ATOM 1582 O HOH A 528 2.199 2.074 29.611 1.00 0.00
ATOM 1583 H1 HOH A 528 2.857 2.806 29.433 1.00 0.00
ATOM 1584 H2 HOH A 528 1.890 2.128 30.561 1.00 0.00
ATOM 1585 O HOH A 529 21.993 9.193 15.413 1.00 0.00
ATOM 1586 H1 HOH A 529 22.670 9.689 15.958 1.00 0.00
ATOM 1587 H2 HOH A 529 21.591 8.463 15.966 1.00 0.00
ATOM 1588 O HOH A 530 25.511 3.566 21.471 1.00 0.00
ATOM 1589 H1 HOH A 530 25.150 3.186 20.619 1.00 0.00
ATOM 1590 H2 HOH A 530 25.187 3.018 22.243 1.00 0.00
ATOM 1591 O HOH A 531 27.987 9.695 2.770 1.00 0.00
ATOM 1592 H1 HOH A 531 28.545 8.903 2.523 1.00 0.00
ATOM 1593 H2 HOH A 531 28.416 10.182 3.530 1.00 0.00
ATOM 1594 O HOH A 532 29.691 29.565 7.566 1.00 0.00
ATOM 1595 H1 HOH A 532 29.368 30.450 7.902 1.00 0.00
ATOM 1596 H2 HOH A 532 29.237 28.831 8.071 1.00 0.00
ATOM 1597 O HOH A 533 1.048 2.147 24.836 1.00 0.00
ATOM 1598 H1 HOH A 533 1.569 1.931 24.011 1.00 0.00
ATOM 1599 H2 HOH A 533 1.585 1.903 25.644 1.00 0.00
ATOM 1600 O HOH A 534 27.805 10.112 15.237 1.00 0.00
ATOM 1601 H1 HOH A 534 27.939 9.904 16.206 1.00 0.00
ATOM 1602 H2 HOH A 534 27.383 9.327 14.783 1.00 0.00
ATOM 1603 O HOH A 535 3.160 4.973 14.652 1.00 0.00
ATOM 1604 H1 HOH A 535 2.199 5.226 14.767 1.00 0.00
ATOM 1605 H2 HOH A 535 3.284 4.532 13.764 1.00 0.00
ATOM 1606 O HOH A 536 3.153 10.116 3.962 1.00 0.00
ATOM 1607 H1 HOH A 536 3.840 10.487 3.338 1.00 0.00
ATOM 1608 H2 HOH A 536 2.289 9.993 3.473 1.00 0.00
ATOM 1609 O HOH A 537 18.987 5.180 11.743 1.00 0.00
ATOM 1610 H1 HOH A 537 18.814 6.092 12.115 1.00 0.00
ATOM 1611 H2 HOH A 537 19.595 5.252 10.953 1.00 0.00
ATOM 1612 O HOH A 538 19.729 21.067 20.608 1.00 0.00
ATOM 1613 H1 HOH A 538 18.773 20.774 20.610 1.00 0.00
ATOM 1614 H2 HOH A 538 20.247 20.508 19.960 1.00 0.00
ATOM 1615 O HOH A 539 27.740 5.965 3.817 1.00 0.00
ATOM 1616 H1 HOH A 539 28.376 6.635 3.436 1.00 0.00
ATOM 1617 H2 HOH A 539 27.380 5.391 3.082 1.00 0.00
ATOM 1618 O HOH A 540 18.859 2.539 1.017 1.00 0.00
ATOM 1619 H1 HOH A 540 19.460 3.156 0.508 1.00 0.00
ATOM 1620 H2 HOH A 540 18.781 2.856 1.962 1.00 0.00
ATOM 1621 O HOH A 541 22.783 13.642 11.026 1.00 0.00
ATOM 1622 H1 HOH A 541 23.335 14.454 11.215 1.00 0.00
ATOM 1623 H2 HOH A 541 21.948 13.671 11.575 1.00 0.00
ATOM 1624 O HOH A 542 22.354 16.909 8.549 1.00 0.00
ATOM 1625 H1 HOH A 542 21.688 17.651 8.473 1.00 0.00
ATOM 1626 H2 HOH A 542 23.190 17.161 8.061 1.00 0.00
ATOM 1627 O HOH A 543 22.613 10.879 3.117 1.00 0.00
ATOM 1628 H1 HOH A 543 23.579 10.788 3.360 1.00 0.00
ATOM 1629 H2 HOH A 543 22.118 10.058 3.401 1.00 0.00
ATOM 1630 O HOH A 544 23.085 14.735 16.982 1.00 0.00
ATOM 1631 H1 HOH A 544 23.270 15.129 16.081 1.00 0.00
ATOM 1632 H2 HOH A 544 22.104 14.567 17.077 1.00 0.00
ATOM 1633 O HOH A 545 3.344 16.051 3.551 1.00 0.00
ATOM 1634 H1 HOH A 545 3.019 15.110 3.637 1.00 0.00
ATOM 1635 H2 HOH A 545 2.561 16.673 3.531 1.00 0.00
ATOM 1636 O HOH A 546 20.485 0.825 13.965 1.00 0.00
ATOM 1637 H1 HOH A 546 21.107 0.726 13.189 1.00 0.00
ATOM 1638 H2 HOH A 546 19.683 0.243 13.827 1.00 0.00
ATOM 1639 O HOH A 547 19.517 12.803 4.134 1.00 0.00
ATOM 1640 H1 HOH A 547 19.474 12.165 3.365 1.00 0.00
ATOM 1641 H2 HOH A 547 20.298 13.416 4.015 1.00 0.00
ATOM 1642 O HOH A 548 18.610 22.621 15.513 1.00 0.00
ATOM 1643 H1 HOH A 548 17.705 23.039 15.586 1.00 0.00
ATOM 1644 H2 HOH A 548 19.261 23.136 16.071 1.00 0.00
ATOM 1645 O HOH A 549 29.787 17.982 5.387 1.00 0.00
ATOM 1646 H1 HOH A 549 30.314 17.474 6.068 1.00 0.00
ATOM 1647 H2 HOH A 549 29.310 17.340 4.787 1.00 0.00
ATOM 1648 O HOH A 550 24.479 7.027 7.974 1.00 0.00
ATOM 1649 H1 HOH A 550 25.302 7.053 7.407 1.00 0.00
ATOM 1650 H2 HOH A 550 24.691 6.596 8.851 1.00 0.00
ATOM 1651 O HOH A 551 25.112 3.644 29.722 1.00 0.00
ATOM 1652 H1 HOH A 551 24.784 3.003 30.416 1.00 0.00
ATOM 1653 H2 HOH A 551 25.542 3.137 28.976 1.00 0.00
ATOM 1654 O HOH A 552 24.880 7.051 13.172 1.00 0.00
ATOM 1655 H1 HOH A 552 24.025 7.375 12.768 1.00 0.00
ATOM 1656 H2 HOH A 552 24.716 6.773 14.119 1.00 0.00
ATOM 1657 O HOH A 553 20.745 12.412 13.325 1.00 0.00
ATOM 1658 H1 HOH A 553 20.419 11.833 14.073 1.00 0.00
ATOM 1659 H2 HOH A 553 20.159 12.284 12.525 1.00 0.00
ATOM 1660 O HOH A 554 24.562 18.686 6.043 1.00 0.00
ATOM 1661 H1 HOH A 554 25.312 18.618 5.385 1.00 0.00
ATOM 1662 H2 HOH A 554 24.326 19.648 6.181 1.00 0.00
ATOM 1663 O HOH A 555 27.347 7.377 13.884 1.00 0.00
ATOM 1664 H1 HOH A 555 26.414 7.259 13.541 1.00 0.00
ATOM 1665 H2 HOH A 555 27.978 6.846 13.319 1.00 0.00
ATOM 1666 O HOH A 556 29.159 26.545 5.366 1.00 0.00
ATOM 1667 H1 HOH A 556 28.510 25.850 5.057 1.00 0.00
ATOM 1668 H2 HOH A 556 29.010 26.732 6.337 1.00 0.00
ATOM 1669 O HOH A 557 22.228 3.922 1.853 1.00 0.00
ATOM 1670 H1 HOH A 557 22.492 3.163 2.447 1.00 0.00
ATOM 1671 H2 HOH A 557 21.647 4.557 2.362 1.00 0.00
ATOM 1672 O HOH A 558 1.122 0.285 5.140 1.00 0.00
ATOM 1673 H1 HOH A 558 0.814 0.093 6.072 1.00 0.00
ATOM 1674 H2 HOH A 558 2.121 0.300 5.115 1.00 0.00
ATOM 1675 O HOH A 559 26.063 14.436 5.788 1.00 0.00
ATOM 1676 H1 HOH A 559 25.418 15.082 5.381 1.00 0.00
ATOM 1677 H2 HOH A 559 25.813 13.504 5.522 1.00 0.00
ATOM 1678 O HOH A 560 17.944 12.985 16.728 1.00 0.00
ATOM 1679 H1 HOH A 560 17.353 13.535 16.138 1.00 0.00
ATOM 1680 H2 HOH A 560 17.602 12.046 16.761 1.00 0.00
ATOM 1681 O HOH A 561 28.929 21.110 10.398 1.00 0.00
ATOM 1682 H1 HOH A 561 28.443 20.241 10.492 1.00 0.00
ATOM 1683 H2 HOH A 561 28.302 21.806 10.048 1.00 0.00
ATOM 1684 O HOH A 562 5.541 0.190 28.025 1.00 0.00
ATOM 1685 H1 HOH A 562 4.787 -0.204 28.550 1.00 0.00
ATOM 1686 H2 HOH A 562 6.046 0.835 28.600 1.00 0.00
ATOM 1687 O HOH A 563 24.562 2.404 19.081 1.00 0.00
ATOM 1688 H1 HOH A 563 24.798 2.491 18.114 1.00 0.00
ATOM 1689 H2 HOH A 563 23.722 1.868 19.173 1.00 0.00
ATOM 1690 O HOH A 564 17.312 3.073 11.837 1.00 0.00
ATOM 1691 H1 HOH A 564 17.984 3.808 11.926 1.00 0.00
ATOM 1692 H2 HOH A 564 17.322 2.725 10.900 1.00 0.00
ATOM 1693 O HOH A 565 24.744 6.348 4.306 1.00 0.00
ATOM 1694 H1 HOH A 565 24.402 5.985 3.439 1.00 0.00
ATOM 1695 H2 HOH A 565 25.742 6.405 4.273 1.00 0.00
ATOM 1696 O HOH A 566 24.081 27.027 12.724 1.00 0.00
ATOM 1697 H1 HOH A 566 23.653 27.403 13.547 1.00 0.00
ATOM 1698 H2 HOH A 566 24.267 27.767 12.078 1.00 0.00
ATOM 1699 O HOH A 567 21.121 11.551 7.016 1.00 0.00
ATOM 1700 H1 HOH A 567 21.362 12.211 6.305 1.00 0.00
ATOM 1701 H2 HOH A 567 20.138 11.369 6.983 1.00 0.00
ATOM 1702 O HOH A 568 21.343 9.080 5.033 1.00 0.00
ATOM 1703 H1 HOH A 568 21.179 9.847 5.652 1.00 0.00
ATOM 1704 H2 HOH A 568 20.611 8.407 5.135 1.00 0.00
ATOM 1705 O HOH A 569 3.138 2.725 16.393 1.00 0.00
ATOM 1706 H1 HOH A 569 3.119 3.630 15.967 1.00 0.00
ATOM 1707 H2 HOH A 569 3.876 2.183 15.991 1.00 0.00
ATOM 1708 O HOH A 570 2.616 12.050 24.908 1.00 0.00
ATOM 1709 H1 HOH A 570 2.843 12.994 24.669 1.00 0.00
ATOM 1710 H2 HOH A 570 1.910 12.046 25.616 1.00 0.00
ATOM 1711 O HOH A 571 28.976 3.358 4.421 1.00 0.00
ATOM 1712 H1 HOH A 571 28.555 2.843 5.168 1.00 0.00
ATOM 1713 H2 HOH A 571 28.589 4.280 4.392 1.00 0.00
ATOM 1714 O HOH A 572 22.540 11.321 17.525 1.00 0.00
ATOM 1715 H1 HOH A 572 22.224 12.038 18.146 1.00 0.00
ATOM 1716 H2 HOH A 572 22.737 11.718 16.629 1.00 0.00
ATOM 1717 O HOH A 573 21.928 22.337 16.447 1.00 0.00
ATOM 1718 H1 HOH A 573 22.023 21.349 16.571 1.00 0.00
ATOM 1719 H2 HOH A 573 21.257 22.691 17.099 1.00 0.00
ATOM 1720 O HOH A 574 22.940 9.806 28.499 1.00 0.00
ATOM 1721 H1 HOH A 574 23.558 10.575 28.333 1.00 0.00
ATOM 1722 H2 HOH A 574 22.292 10.049 29.221 1.00 0.00
ATOM 1723 O HOH A 575 14.378 4.231 8.711 1.00 0.00
ATOM 1724 H1 HOH A 575 13.656 4.880 8.472 1.00 0.00
ATOM 1725 H2 HOH A 575 15.198 4.732 8.989 1.00 0.00
ATOM 1726 O HOH A 576 0.929 14.324 1.402 1.00 0.00
ATOM 1727 H1 HOH A 576 0.500 14.064 2.267 1.00 0.00
ATOM 1728 H2 HOH A 576 0.232 14.677 0.777 1.00 0.00
ATOM 1729 O HOH A 577 18.033 18.571 15.190 1.00 0.00
ATOM 1730 H1 HOH A 577 18.148 17.608 15.435 1.00 0.00
ATOM 1731 H2 HOH A 577 18.142 18.679 14.202 1.00 0.00
ATOM 1732 O HOH A 578 26.227 9.041 19.726 1.00 0.00
ATOM 1733 H1 HOH A 578 26.038 9.845 20.290 1.00 0.00
ATOM 1734 H2 HOH A 578 26.514 8.283 20.311 1.00 0.00
ATOM 1735 O HOH A 579 6.671 1.614 19.534 1.00 0.00
ATOM 1736 H1 HOH A 579 7.259 2.278 19.071 1.00 0.00
ATOM 1737 H2 HOH A 579 6.300 0.972 18.862 1.00 0.00
ATOM 1738 O HOH A 580 25.832 27.158 20.582 1.00 0.00
ATOM 1739 H1 HOH A 580 26.534 27.557 19.992 1.00 0.00
ATOM 1740 H2 HOH A 580 26.102 26.231 20.841 1.00 0.00
ATOM 1741 O HOH A 581 19.184 8.308 11.960 1.00 0.00
ATOM 1742 H1 HOH A 581 20.091 8.171 12.357 1.00 0.00
ATOM 1743 H2 HOH A 581 19.274 8.518 10.987 1.00 0.00
ATOM 1744 O HOH A 582 30.067 5.663 30.187 1.00 0.00
ATOM 1745 H1 HOH A 582 29.819 4.728 30.441 1.00 0.00
ATOM 1746 H2 HOH A 582 29.866 5.810 29.218 1.00 0.00
ATOM 1747 O HOH A 583 22.181 1.984 16.113 1.00 0.00
ATOM 1748 H1 HOH A 583 21.655 1.563 15.374 1.00 0.00
ATOM 1749 H2 HOH A 583 23.046 2.331 15.751 1.00 0.00
ATOM 1750 O HOH A 584 16.708 10.551 12.635 1.00 0.00
ATOM 1751 H1 HOH A 584 17.408 9.870 12.418 1.00 0.00
ATOM 1752 H2 HOH A 584 16.621 10.635 13.627 1.00 0.00
ATOM 1753 O HOH A 585 30.193 4.530 16.321 1.00 0.00
ATOM 1754 H1 HOH A 585 29.653 5.365 16.215 1.00 0.00
ATOM 1755 H2 HOH A 585 29.669 3.749 15.983 1.00 0.00
ATOM 1756 O HOH A 586 19.296 26.996 29.349 1.00 0.00
ATOM 1757 H1 HOH A 586 18.301 27.044 29.260 1.00 0.00
ATOM 1758 H2 HOH A 586 19.710 27.780 28.887 1.00 0.00
ATOM 1759 O HOH A 587 28.359 3.889 12.915 1.00 0.00
ATOM 1760 H1 HOH A 587 28.856 4.675 12.547 1.00 0.00
ATOM 1761 H2 HOH A 587 27.864 3.432 12.176 1.00 0.00
ATOM 1762 O HOH A 588 21.192 16.479 11.343 1.00 0.00
ATOM 1763 H1 HOH A 588 21.983 17.034 11.087 1.00 0.00
ATOM 1764 H2 HOH A 588 20.818 16.037 10.528 1.00 0.00
ATOM 1765 O HOH A 589 18.659 11.485 19.956 1.00 0.00
ATOM 1766 H1 HOH A 589 18.330 12.308 19.492 1.00 0.00
ATOM 1767 H2 HOH A 589 19.311 11.009 19.366 1.00 0.00
ATOM 1768 O HOH A 590 5.492 9.304 1.702 1.00 0.00
ATOM 1769 H1 HOH A 590 5.351 10.269 1.921 1.00 0.00
ATOM 1770 H2 HOH A 590 5.840 8.826 2.508 1.00 0.00
ATOM 1771 O HOH A 591 3.201 15.292 7.896 1.00 0.00
ATOM 1772 H1 HOH A 591 3.677 15.257 8.774 1.00 0.00
ATOM 1773 H2 HOH A 591 3.163 16.238 7.575 1.00 0.00
ATOM 1774 O HOH A 592 22.769 1.710 7.984 1.00 0.00
ATOM 1775 H1 HOH A 592 23.309 2.379 8.494 1.00 0.00
ATOM 1776 H2 HOH A 592 23.289 1.398 7.189 1.00 0.00
ATOM 1777 O HOH A 593 21.018 -0.120 9.004 1.00 0.00
ATOM 1778 H1 HOH A 593 21.681 0.521 8.617 1.00 0.00
ATOM 1779 H2 HOH A 593 20.094 0.156 8.740 1.00 0.00
ATOM 1780 O HOH A 594 25.445 2.638 16.497 1.00 0.00
ATOM 1781 H1 HOH A 594 26.387 2.931 16.332 1.00 0.00
ATOM 1782 H2 HOH A 594 24.906 2.763 15.664 1.00 0.00
ATOM 1783 O HOH A 595 2.062 8.751 16.407 1.00 0.00
ATOM 1784 H1 HOH A 595 1.366 8.283 15.862 1.00 0.00
ATOM 1785 H2 HOH A 595 2.669 8.075 16.825 1.00 0.00
ATOM 1786 O HOH A 596 21.101 7.310 28.843 1.00 0.00
ATOM 1787 H1 HOH A 596 21.960 7.562 29.288 1.00 0.00
ATOM 1788 H2 HOH A 596 20.510 8.114 28.778 1.00 0.00
ATOM 1789 O HOH A 597 19.667 18.451 12.982 1.00 0.00
ATOM 1790 H1 HOH A 597 18.798 18.841 12.676 1.00 0.00
ATOM 1791 H2 HOH A 597 19.891 17.654 12.421 1.00 0.00
ATOM 1792 O HOH A 598 21.189 14.739 7.961 1.00 0.00
ATOM 1793 H1 HOH A 598 21.649 14.242 7.225 1.00 0.00
ATOM 1794 H2 HOH A 598 21.699 15.573 8.169 1.00 0.00
ATOM 1795 O HOH A 599 1.129 5.548 18.516 1.00 0.00
ATOM 1796 H1 HOH A 599 1.571 4.881 19.116 1.00 0.00
ATOM 1797 H2 HOH A 599 0.769 5.082 17.708 1.00 0.00
ATOM 1798 O HOH A 600 13.872 6.562 13.616 1.00 0.00
ATOM 1799 H1 HOH A 600 14.457 6.600 14.426 1.00 0.00
ATOM 1800 H2 HOH A 600 13.446 5.659 13.555 1.00 0.00
ATOM 1801 O HOH A 601 23.842 7.412 22.954 1.00 0.00
ATOM 1802 H1 HOH A 601 23.611 6.698 23.614 1.00 0.00
ATOM 1803 H2 HOH A 601 24.101 8.246 23.442 1.00 0.00
ATOM 1804 O HOH A 602 26.589 9.533 0.362 1.00 0.00
ATOM 1805 H1 HOH A 602 27.053 9.540 1.248 1.00 0.00
ATOM 1806 H2 HOH A 602 26.407 8.589 0.089 1.00 0.00
ATOM 1807 O HOH A 603 24.304 18.330 17.871 1.00 0.00
ATOM 1808 H1 HOH A 603 24.091 18.141 18.829 1.00 0.00
ATOM 1809 H2 HOH A 603 25.257 18.088 17.687 1.00 0.00
ATOM 1810 O HOH A 604 29.996 1.512 13.382 1.00 0.00
ATOM 1811 H1 HOH A 604 29.145 2.030 13.458 1.00 0.00
ATOM 1812 H2 HOH A 604 30.237 1.133 14.275 1.00 0.00
ATOM 1813 O HOH A 605 19.446 22.021 13.071 1.00 0.00
ATOM 1814 H1 HOH A 605 19.139 22.254 13.994 1.00 0.00
ATOM 1815 H2 HOH A 605 20.360 21.619 13.114 1.00 0.00
ATOM 1816 O HOH A 606 21.863 7.391 1.426 1.00 0.00
ATOM 1817 H1 HOH A 606 21.462 8.306 1.375 1.00 0.00
ATOM 1818 H2 HOH A 606 21.133 6.709 1.474 1.00 0.00
ATOM 1819 O HOH A 607 22.598 8.326 12.468 1.00 0.00
ATOM 1820 H1 HOH A 607 22.442 8.852 13.304 1.00 0.00
ATOM 1821 H2 HOH A 607 23.035 8.910 11.784 1.00 0.00
ATOM 1822 O HOH A 608 4.799 9.703 9.709 1.00 0.00
ATOM 1823 H1 HOH A 608 5.282 8.829 9.757 1.00 0.00
ATOM 1824 H2 HOH A 608 5.209 10.272 8.996 1.00 0.00
ATOM 1825 O HOH A 609 7.184 6.458 0.942 1.00 0.00
ATOM 1826 H1 HOH A 609 7.080 7.358 0.520 1.00 0.00
ATOM 1827 H2 HOH A 609 6.709 5.773 0.389 1.00 0.00
ATOM 1828 O HOH A 610 28.050 16.408 14.293 1.00 0.00
ATOM 1829 H1 HOH A 610 28.458 16.042 13.457 1.00 0.00
ATOM 1830 H2 HOH A 610 27.985 15.681 14.978 1.00 0.00
ATOM 1831 O HOH A 611 19.799 8.865 9.535 1.00 0.00
ATOM 1832 H1 HOH A 611 19.445 9.490 8.840 1.00 0.00
ATOM 1833 H2 HOH A 611 20.576 8.358 9.163 1.00 0.00
ATOM 1834 O HOH A 612 25.564 13.525 17.352 1.00 0.00
ATOM 1835 H1 HOH A 612 25.862 12.967 16.578 1.00 0.00
ATOM 1836 H2 HOH A 612 24.615 13.810 17.212 1.00 0.00
ATOM 1837 O HOH A 613 25.278 6.931 29.253 1.00 0.00
ATOM 1838 H1 HOH A 613 25.073 6.631 30.184 1.00 0.00
ATOM 1839 H2 HOH A 613 24.743 6.391 28.603 1.00 0.00
ATOM 1840 O HOH A 614 27.237 18.297 23.647 1.00 0.00
ATOM 1841 H1 HOH A 614 27.710 17.584 23.128 1.00 0.00
ATOM 1842 H2 HOH A 614 26.511 18.693 23.085 1.00 0.00
ATOM 1843 O HOH A 615 2.610 5.694 2.573 1.00 0.00
ATOM 1844 H1 HOH A 615 3.436 6.090 2.974 1.00 0.00
ATOM 1845 H2 HOH A 615 2.519 6.003 1.626 1.00 0.00
ATOM 1846 O HOH A 616 20.092 15.140 13.548 1.00 0.00
ATOM 1847 H1 HOH A 616 20.411 15.608 12.723 1.00 0.00
ATOM 1848 H2 HOH A 616 20.209 14.153 13.437 1.00 0.00
ATOM 1849 O HOH A 617 23.633 12.515 28.149 1.00 0.00
ATOM 1850 H1 HOH A 617 24.499 12.417 28.639 1.00 0.00
ATOM 1851 H2 HOH A 617 23.814 12.685 27.181 1.00 0.00
ATOM 1852 O HOH A 618 19.676 5.776 2.636 1.00 0.00
ATOM 1853 H1 HOH A 618 19.456 4.933 3.125 1.00 0.00
ATOM 1854 H2 HOH A 618 18.854 6.125 2.186 1.00 0.00
ATOM 1855 O HOH A 619 29.230 10.984 4.727 1.00 0.00
ATOM 1856 H1 HOH A 619 28.650 11.276 5.487 1.00 0.00
ATOM 1857 H2 HOH A 619 30.118 10.688 5.079 1.00 0.00
ATOM 1858 O HOH A 620 25.583 12.848 19.882 1.00 0.00
ATOM 1859 H1 HOH A 620 25.573 13.078 18.909 1.00 0.00
ATOM 1860 H2 HOH A 620 26.529 12.793 20.201 1.00 0.00
ATOM 1861 O HOH A 621 1.536 0.904 2.019 1.00 0.00
ATOM 1862 H1 HOH A 621 1.673 0.593 2.959 1.00 0.00
ATOM 1863 H2 HOH A 621 0.560 1.051 1.856 1.00 0.00
ATOM 1864 O HOH A 622 21.709 7.571 8.171 1.00 0.00
ATOM 1865 H1 HOH A 622 22.677 7.622 7.923 1.00 0.00
ATOM 1866 H2 HOH A 622 21.183 7.227 7.392 1.00 0.00
ATOM 1867 O HOH A 623 29.477 6.094 11.692 1.00 0.00
ATOM 1868 H1 HOH A 623 30.349 6.579 11.750 1.00 0.00
ATOM 1869 H2 HOH A 623 28.932 6.476 10.946 1.00 0.00
ATOM 1870 O HOH A 624 1.532 25.444 4.888 1.00 0.00
ATOM 1871 H1 HOH A 624 1.235 24.783 4.199 1.00 0.00
ATOM 1872 H2 HOH A 624 0.749 25.990 5.186 1.00 0.00
ATOM 1873 O HOH A 625 25.168 17.767 8.646 1.00 0.00
ATOM 1874 H1 HOH A 625 25.673 16.906 8.710 1.00 0.00
ATOM 1875 H2 HOH A 625 25.243 18.129 7.717 1.00 0.00
ATOM 1876 O HOH A 626 19.779 14.381 10.236 1.00 0.00
ATOM 1877 H1 HOH A 626 20.268 14.464 9.368 1.00 0.00
ATOM 1878 H2 HOH A 626 19.380 13.467 10.308 1.00 0.00
ATOM 1879 O HOH A 627 19.754 10.328 15.151 1.00 0.00
ATOM 1880 H1 HOH A 627 19.590 10.658 16.080 1.00 0.00
ATOM 1881 H2 HOH A 627 20.564 9.742 15.143 1.00 0.00
ATOM 1882 O HOH A 628 1.716 1.672 11.305 1.00 0.00
ATOM 1883 H1 HOH A 628 1.095 1.597 12.085 1.00 0.00
ATOM 1884 H2 HOH A 628 2.148 0.786 11.136 1.00 0.00
ATOM 1885 O HOH A 629 26.957 4.881 1.452 1.00 0.00
ATOM 1886 H1 HOH A 629 27.747 5.218 0.939 1.00 0.00
ATOM 1887 H2 HOH A 629 26.263 4.547 0.814 1.00 0.00
ATOM 1888 O HOH A 630 0.958 10.905 2.468 1.00 0.00
ATOM 1889 H1 HOH A 630 0.007 11.211 2.524 1.00 0.00
ATOM 1890 H2 HOH A 630 1.229 10.834 1.508 1.00 0.00
ATOM 1891 O HOH A 631 23.133 12.216 15.055 1.00 0.00
ATOM 1892 H1 HOH A 631 22.510 12.257 14.274 1.00 0.00
ATOM 1893 H2 HOH A 631 24.065 12.060 14.730 1.00 0.00
ATOM 1894 O HOH A 632 1.256 23.173 20.691 1.00 0.00
ATOM 1895 H1 HOH A 632 2.141 23.581 20.914 1.00 0.00
ATOM 1896 H2 HOH A 632 0.912 23.566 19.839 1.00 0.00
ATOM 1897 O HOH A 633 21.876 17.553 22.212 1.00 0.00
ATOM 1898 H1 HOH A 633 22.683 17.628 21.626 1.00 0.00
ATOM 1899 H2 HOH A 633 21.930 16.709 22.745 1.00 0.00
ATOM 1900 O HOH A 634 26.988 2.486 6.436 1.00 0.00
ATOM 1901 H1 HOH A 634 26.173 3.030 6.636 1.00 0.00
ATOM 1902 H2 HOH A 634 26.732 1.523 6.347 1.00 0.00
ATOM 1903 O HOH A 635 28.427 6.817 16.540 1.00 0.00
ATOM 1904 H1 HOH A 635 28.204 6.828 15.565 1.00 0.00
ATOM 1905 H2 HOH A 635 28.337 7.741 16.912 1.00 0.00
ATOM 1906 O HOH A 636 29.720 14.615 28.752 1.00 0.00
ATOM 1907 H1 HOH A 636 29.686 15.246 27.977 1.00 0.00
ATOM 1908 H2 HOH A 636 28.880 14.074 28.779 1.00 0.00
ATOM 1909 O HOH A 637 20.362 19.081 8.485 1.00 0.00
ATOM 1910 H1 HOH A 637 20.811 19.529 7.712 1.00 0.00
ATOM 1911 H2 HOH A 637 20.154 19.759 9.189 1.00 0.00
ATOM 1912 O HOH A 638 26.886 2.149 10.731 1.00 0.00
ATOM 1913 H1 HOH A 638 25.993 2.475 10.421 1.00 0.00
ATOM 1914 H2 HOH A 638 27.446 1.908 9.939 1.00 0.00
ATOM 1915 O HOH A 639 27.139 6.832 27.195 1.00 0.00
ATOM 1916 H1 HOH A 639 26.441 7.097 27.860 1.00 0.00
ATOM 1917 H2 HOH A 639 27.186 5.835 27.139 1.00 0.00
ATOM 1918 O HOH A 640 20.484 14.236 17.464 1.00 0.00
ATOM 1919 H1 HOH A 640 19.709 13.789 17.016 1.00 0.00
ATOM 1920 H2 HOH A 640 20.395 14.143 18.455 1.00 0.00
ATOM 1921 O HOH A 641 16.745 8.486 5.824 1.00 0.00
ATOM 1922 H1 HOH A 641 17.366 8.440 5.042 1.00 0.00
ATOM 1923 H2 HOH A 641 16.049 9.185 5.657 1.00 0.00
ATOM 1924 O HOH A 642 25.402 12.339 11.253 1.00 0.00
ATOM 1925 H1 HOH A 642 24.885 13.190 11.345 1.00 0.00
ATOM 1926 H2 HOH A 642 24.791 11.560 11.397 1.00 0.00
ATOM 1927 O HOH A 643 23.735 5.263 27.896 1.00 0.00
ATOM 1928 H1 HOH A 643 23.234 4.753 27.197 1.00 0.00
ATOM 1929 H2 HOH A 643 24.175 4.623 28.525 1.00 0.00
ATOM 1930 O HOH A 644 24.445 3.310 10.121 1.00 0.00
ATOM 1931 H1 HOH A 644 24.766 4.253 10.206 1.00 0.00
ATOM 1932 H2 HOH A 644 23.622 3.187 10.677 1.00 0.00
ATOM 1933 O HOH A 645 25.101 12.068 7.987 1.00 0.00
ATOM 1934 H1 HOH A 645 24.459 11.683 8.650 1.00 0.00
ATOM 1935 H2 HOH A 645 25.926 12.374 8.461 1.00 0.00
ATOM 1936 O HOH A 646 1.611 0.678 20.802 1.00 0.00
ATOM 1937 H1 HOH A 646 1.585 0.857 21.785 1.00 0.00
ATOM 1938 H2 HOH A 646 1.356 -0.273 20.629 1.00 0.00
ATOM 1939 O HOH A 647 27.774 11.124 28.621 1.00 0.00
ATOM 1940 H1 HOH A 647 27.448 10.402 29.232 1.00 0.00
ATOM 1941 H2 HOH A 647 27.468 12.013 28.962 1.00 0.00
ATOM 1942 O HOH A 648 21.271 20.079 18.232 1.00 0.00
ATOM 1943 H1 HOH A 648 20.398 20.350 17.826 1.00 0.00
ATOM 1944 H2 HOH A 648 21.408 19.097 18.102 1.00 0.00
ATOM 1945 O HOH A 649 6.204 4.638 29.030 1.00 0.00
ATOM 1946 H1 HOH A 649 6.462 4.898 28.100 1.00 0.00
ATOM 1947 H2 HOH A 649 5.221 4.462 29.067 1.00 0.00
ATOM 1948 O HOH A 650 6.850 26.946 -0.125 1.00 0.00
ATOM 1949 H1 HOH A 650 6.387 27.403 0.635 1.00 0.00
ATOM 1950 H2 HOH A 650 6.576 25.985 -0.152 1.00 0.00
ATOM 1951 O HOH A 651 28.631 16.965 1.656 1.00 0.00
ATOM 1952 H1 HOH A 651 29.580 17.110 1.374 1.00 0.00
ATOM 1953 H2 HOH A 651 28.578 16.953 2.655 1.00 0.00
ATOM 1954 O HOH A 652 22.989 21.686 3.256 1.00 0.00
ATOM 1955 H1 HOH A 652 22.209 21.591 2.637 1.00 0.00
ATOM 1956 H2 HOH A 652 23.035 22.626 3.594 1.00 0.00
ATOM 1957 O HOH A 653 14.306 5.047 19.603 1.00 0.00
ATOM 1958 H1 HOH A 653 14.406 5.931 19.145 1.00 0.00
ATOM 1959 H2 HOH A 653 14.941 4.389 19.200 1.00 0.00
ATOM 1960 O HOH A 654 14.904 0.400 1.617 1.00 0.00
ATOM 1961 H1 HOH A 654 13.922 0.474 1.446 1.00 0.00
ATOM 1962 H2 HOH A 654 15.395 1.038 1.025 1.00 0.00
ATOM 1963 O HOH A 655 19.418 5.695 22.192 1.00 0.00
ATOM 1964 H1 HOH A 655 20.108 5.458 21.508 1.00 0.00
ATOM 1965 H2 HOH A 655 18.648 6.150 21.744 1.00 0.00
ATOM 1966 O HOH A 656 29.554 13.750 3.747 1.00 0.00
ATOM 1967 H1 HOH A 656 30.331 13.938 4.347 1.00 0.00
ATOM 1968 H2 HOH A 656 29.068 12.939 4.074 1.00 0.00
ATOM 1969 O HOH A 657 26.507 11.440 26.231 1.00 0.00
ATOM 1970 H1 HOH A 657 26.496 10.558 25.761 1.00 0.00
ATOM 1971 H2 HOH A 657 26.940 11.335 27.126 1.00 0.00
ATOM 1972 O HOH A 658 22.626 13.525 0.591 1.00 0.00
ATOM 1973 H1 HOH A 658 23.323 12.866 0.307 1.00 0.00
ATOM 1974 H2 HOH A 658 23.020 14.162 1.253 1.00 0.00
ATOM 1975 O HOH A 659 16.693 18.427 22.776 1.00 0.00
ATOM 1976 H1 HOH A 659 17.687 18.359 22.855 1.00 0.00
ATOM 1977 H2 HOH A 659 16.315 17.533 22.536 1.00 0.00
ATOM 1978 O HOH A 660 17.269 14.056 19.556 1.00 0.00
ATOM 1979 H1 HOH A 660 17.332 14.630 18.740 1.00 0.00
ATOM 1980 H2 HOH A 660 18.161 14.013 20.004 1.00 0.00
ATOM 1981 O HOH A 661 24.986 11.777 0.412 1.00 0.00
ATOM 1982 H1 HOH A 661 25.356 10.872 0.205 1.00 0.00
ATOM 1983 H2 HOH A 661 25.304 12.070 1.313 1.00 0.00
ATOM 1984 O HOH A 662 24.477 9.467 17.666 1.00 0.00
ATOM 1985 H1 HOH A 662 23.793 10.164 17.879 1.00 0.00
ATOM 1986 H2 HOH A 662 25.139 9.409 18.413 1.00 0.00
ATOM 1987 O HOH A 663 19.748 9.600 24.180 1.00 0.00
ATOM 1988 H1 HOH A 663 20.071 8.790 24.669 1.00 0.00
ATOM 1989 H2 HOH A 663 19.509 10.314 24.838 1.00 0.00
ATOM 1990 O HOH A 664 16.054 13.841 23.712 1.00 0.00
ATOM 1991 H1 HOH A 664 16.458 13.020 23.310 1.00 0.00
ATOM 1992 H2 HOH A 664 16.780 14.431 24.067 1.00 0.00
ATOM 1993 O HOH A 665 24.221 12.965 25.670 1.00 0.00
ATOM 1994 H1 HOH A 665 24.934 12.269 25.762 1.00 0.00
ATOM 1995 H2 HOH A 665 24.607 13.783 25.245 1.00 0.00
ATOM 1996 O HOH A 666 26.789 28.225 26.410 1.00 0.00
ATOM 1997 H1 HOH A 666 27.582 28.659 25.983 1.00 0.00
ATOM 1998 H2 HOH A 666 25.973 28.409 25.863 1.00 0.00
ATOM 1999 O HOH A 667 2.903 14.548 24.014 1.00 0.00
ATOM 2000 H1 HOH A 667 3.340 15.038 24.768 1.00 0.00
ATOM 2001 H2 HOH A 667 3.478 14.609 23.198 1.00 0.00
ATOM 2002 O HOH A 668 24.130 9.396 24.531 1.00 0.00
ATOM 2003 H1 HOH A 668 23.796 8.936 25.354 1.00 0.00
ATOM 2004 H2 HOH A 668 23.616 10.242 24.391 1.00 0.00
ATOM 2005 O HOH A 669 25.011 26.954 3.692 1.00 0.00
ATOM 2006 H1 HOH A 669 25.785 27.400 3.243 1.00 0.00
ATOM 2007 H2 HOH A 669 25.349 26.280 4.349 1.00 0.00
ATOM 2008 O HOH A 670 3.975 9.692 24.810 1.00 0.00
ATOM 2009 H1 HOH A 670 3.549 9.262 24.014 1.00 0.00
ATOM 2010 H2 HOH A 670 3.649 10.634 24.894 1.00 0.00
ATOM 2011 O HOH A 671 19.024 12.302 25.818 1.00 0.00
ATOM 2012 H1 HOH A 671 19.317 12.438 26.764 1.00 0.00
ATOM 2013 H2 HOH A 671 18.026 12.254 25.782 1.00 0.00
ATOM 2014 O HOH A 672 27.065 5.436 18.675 1.00 0.00
ATOM 2015 H1 HOH A 672 26.100 5.695 18.660 1.00 0.00
ATOM 2016 H2 HOH A 672 27.527 5.824 17.876 1.00 0.00
ATOM 2017 O HOH A 673 23.804 0.563 26.787 1.00 0.00
ATOM 2018 H1 HOH A 673 23.703 1.462 26.362 1.00 0.00
ATOM 2019 H2 HOH A 673 23.958 -0.125 26.078 1.00 0.00
ATOM 2020 O HOH A 674 27.102 17.740 26.326 1.00 0.00
ATOM 2021 H1 HOH A 674 27.069 17.984 25.357 1.00 0.00
ATOM 2022 H2 HOH A 674 26.501 18.348 26.843 1.00 0.00
ATOM 2023 O HOH A 675 24.053 15.701 1.681 1.00 0.00
ATOM 2024 H1 HOH A 675 25.049 15.715 1.599 1.00 0.00
ATOM 2025 H2 HOH A 675 23.665 16.463 1.164 1.00 0.00
ATOM 2026 O HOH A 676 21.343 8.486 21.737 1.00 0.00
ATOM 2027 H1 HOH A 676 20.930 8.985 22.499 1.00 0.00
ATOM 2028 H2 HOH A 676 22.219 8.100 22.028 1.00 0.00
ATOM 2029 O HOH A 677 26.805 16.898 20.202 1.00 0.00
ATOM 2030 H1 HOH A 677 27.696 16.995 20.647 1.00 0.00
ATOM 2031 H2 HOH A 677 26.822 17.365 19.318 1.00 0.00
ATOM 2032 O HOH A 678 26.128 21.593 26.809 1.00 0.00
ATOM 2033 H1 HOH A 678 25.860 20.754 27.282 1.00 0.00
ATOM 2034 H2 HOH A 678 26.493 21.365 25.906 1.00 0.00
ATOM 2035 O HOH A 679 23.530 24.711 1.083 1.00 0.00
ATOM 2036 H1 HOH A 679 23.067 24.623 0.202 1.00 0.00
ATOM 2037 H2 HOH A 679 24.384 25.218 0.962 1.00 0.00
ATOM 2038 O HOH A 680 4.552 17.153 27.327 1.00 0.00
ATOM 2039 H1 HOH A 680 3.884 17.018 28.058 1.00 0.00
ATOM 2040 H2 HOH A 680 4.357 18.012 26.852 1.00 0.00
ATOM 2041 O HOH A 681 22.684 5.556 24.679 1.00 0.00
ATOM 2042 H1 HOH A 681 22.583 4.749 24.097 1.00 0.00
ATOM 2043 H2 HOH A 681 21.780 5.880 24.958 1.00 0.00
ATOM 2044 O HOH A 682 26.156 1.967 27.906 1.00 0.00
ATOM 2045 H1 HOH A 682 25.387 1.759 27.301 1.00 0.00
ATOM 2046 H2 HOH A 682 26.462 1.128 28.356 1.00 0.00
ATOM 2047 O HOH A 683 26.798 14.284 2.064 1.00 0.00
ATOM 2048 H1 HOH A 683 26.415 13.467 2.496 1.00 0.00
ATOM 2049 H2 HOH A 683 27.762 14.373 2.315 1.00 0.00
ATOM 2050 O HOH A 684 2.522 6.821 30.081 1.00 0.00
ATOM 2051 H1 HOH A 684 1.529 6.703 30.055 1.00 0.00
ATOM 2052 H2 HOH A 684 2.769 7.671 29.616 1.00 0.00
ATOM 2053 O HOH A 685 26.778 8.582 25.127 1.00 0.00
ATOM 2054 H1 HOH A 685 26.883 8.154 26.025 1.00 0.00
ATOM 2055 H2 HOH A 685 25.806 8.698 24.924 1.00 0.00
ATOM 2056 O HOH A 686 23.743 5.770 20.757 1.00 0.00
ATOM 2057 H1 HOH A 686 24.409 5.096 21.075 1.00 0.00
ATOM 2058 H2 HOH A 686 23.774 6.575 21.349 1.00 0.00
ATOM 2059 O HOH A 687 4.582 7.647 26.667 1.00 0.00
ATOM 2060 H1 HOH A 687 4.283 8.384 26.061 1.00 0.00
ATOM 2061 H2 HOH A 687 4.831 8.027 27.557 1.00 0.00
ATOM 2062 O HOH A 688 5.664 13.422 29.259 1.00 0.00
ATOM 2063 H1 HOH A 688 4.884 13.200 29.844 1.00 0.00
ATOM 2064 H2 HOH A 688 6.252 14.084 29.724 1.00 0.00
ATOM 2065 O HOH A 689 23.423 15.705 28.403 1.00 0.00
ATOM 2066 H1 HOH A 689 22.679 15.991 27.799 1.00 0.00
ATOM 2067 H2 HOH A 689 23.189 14.831 28.829 1.00 0.00
ATOM 2068 O HOH A 690 0.177 15.164 23.934 1.00 0.00
ATOM 2069 H1 HOH A 690 -0.386 14.379 24.193 1.00 0.00
ATOM 2070 H2 HOH A 690 1.120 14.865 23.788 1.00 0.00
ATOM 2071 O HOH A 691 27.293 2.865 18.865 1.00 0.00
ATOM 2072 H1 HOH A 691 26.410 2.403 18.950 1.00 0.00
ATOM 2073 H2 HOH A 691 27.177 3.842 19.048 1.00 0.00
ATOM 2074 O HOH A 692 21.229 11.372 21.020 1.00 0.00
ATOM 2075 H1 HOH A 692 20.268 11.198 20.803 1.00 0.00
ATOM 2076 H2 HOH A 692 21.743 10.515 20.967 1.00 0.00
ATOM 2077 O HOH A 693 21.469 2.168 23.784 1.00 0.00
ATOM 2078 H1 HOH A 693 21.361 1.842 24.723 1.00 0.00
ATOM 2079 H2 HOH A 693 20.570 2.380 23.400 1.00 0.00
ATOM 2080 O HOH A 694 24.600 19.997 22.200 1.00 0.00
ATOM 2081 H1 HOH A 694 24.707 20.950 22.485 1.00 0.00
ATOM 2082 H2 HOH A 694 24.086 19.962 21.343 1.00 0.00
ATOM 2083 O HOH A 695 23.940 6.821 18.209 1.00 0.00
ATOM 2084 H1 HOH A 695 24.121 7.804 18.207 1.00 0.00
ATOM 2085 H2 HOH A 695 23.790 6.511 19.148 1.00 0.00
ATOM 2086 O HOH A 696 27.776 9.864 22.836 1.00 0.00
ATOM 2087 H1 HOH A 696 27.422 9.288 23.572 1.00 0.00
ATOM 2088 H2 HOH A 696 27.045 10.055 22.181 1.00 0.00
ATOM 2089 O HOH A 697 19.386 18.120 23.147 1.00 0.00
ATOM 2090 H1 HOH A 697 20.298 17.971 22.763 1.00 0.00
ATOM 2091 H2 HOH A 697 19.078 17.288 23.606 1.00 0.00
ATOM 2092 O HOH A 698 18.231 5.677 29.414 1.00 0.00
ATOM 2093 H1 HOH A 698 17.952 5.737 28.456 1.00 0.00
ATOM 2094 H2 HOH A 698 19.210 5.480 29.464 1.00 0.00
ATOM 2095 O HOH A 699 23.634 7.978 26.720 1.00 0.00
ATOM 2096 H1 HOH A 699 23.657 7.016 26.990 1.00 0.00
ATOM 2097 H2 HOH A 699 23.400 8.541 27.513 1.00 0.00
ATOM 2098 O HOH A 700 6.093 5.218 26.251 1.00 0.00
ATOM 2099 H1 HOH A 700 5.369 5.889 26.413 1.00 0.00
ATOM 2100 H2 HOH A 700 5.686 4.317 26.103 1.00 0.00
ATOM 2101 O HOH A 701 29.286 3.061 1.032 1.00 0.00
ATOM 2102 H1 HOH A 701 28.837 3.049 1.926 1.00 0.00
ATOM 2103 H2 HOH A 701 29.107 2.199 0.558 1.00 0.00
ATOM 2104 O HOH A 702 18.887 2.534 22.654 1.00 0.00
ATOM 2105 H1 HOH A 702 19.219 3.471 22.550 1.00 0.00
ATOM 2106 H2 HOH A 702 17.946 2.549 22.993 1.00 0.00
ATOM 2107 O HOH A 703 9.371 6.008 26.487 1.00 0.00
ATOM 2108 H1 HOH A 703 8.995 6.902 26.733 1.00 0.00
ATOM 2109 H2 HOH A 703 8.872 5.291 26.973 1.00 0.00
ATOM 2110 O HOH A 704 28.138 13.398 24.819 1.00 0.00
ATOM 2111 H1 HOH A 704 27.848 12.754 25.527 1.00 0.00
ATOM 2112 H2 HOH A 704 27.350 13.930 24.509 1.00 0.00
ATOM 2113 O HOH A 705 28.923 19.583 29.148 1.00 0.00
ATOM 2114 H1 HOH A 705 28.097 19.025 29.221 1.00 0.00
ATOM 2115 H2 HOH A 705 29.619 19.082 28.634 1.00 0.00
ATOM 2116 O HOH A 706 24.119 6.082 1.556 1.00 0.00
ATOM 2117 H1 HOH A 706 23.428 6.798 1.653 1.00 0.00
ATOM 2118 H2 HOH A 706 23.674 5.186 1.565 1.00 0.00
ATOM 2119 O HOH A 707 16.528 8.095 27.407 1.00 0.00
ATOM 2120 H1 HOH A 707 16.057 8.665 26.735 1.00 0.00
ATOM 2121 H2 HOH A 707 16.159 8.279 28.318 1.00 0.00
ATOM 2122 O HOH A 708 14.783 12.263 19.114 1.00 0.00
ATOM 2123 H1 HOH A 708 14.441 12.695 18.279 1.00 0.00
ATOM 2124 H2 HOH A 708 15.356 12.912 19.614 1.00 0.00
ATOM 2125 O HOH A 709 20.343 12.292 28.052 1.00 0.00
ATOM 2126 H1 HOH A 709 19.957 12.897 28.749 1.00 0.00
ATOM 2127 H2 HOH A 709 21.341 12.314 28.109 1.00 0.00
ATOM 2128 O HOH A 710 23.115 24.439 3.633 1.00 0.00
ATOM 2129 H1 HOH A 710 23.602 25.192 4.076 1.00 0.00
ATOM 2130 H2 HOH A 710 23.087 24.595 2.646 1.00 0.00
ATOM 2131 O HOH A 711 18.884 7.988 0.632 1.00 0.00
ATOM 2132 H1 HOH A 711 18.754 8.768 0.020 1.00 0.00
ATOM 2133 H2 HOH A 711 18.441 7.181 0.241 1.00 0.00
ATOM 2134 O HOH A 712 30.107 9.220 21.635 1.00 0.00
ATOM 2135 H1 HOH A 712 29.193 9.382 22.009 1.00 0.00
ATOM 2136 H2 HOH A 712 30.360 8.263 21.778 1.00 0.00
ATOM 2137 O HOH A 713 18.149 2.869 19.550 1.00 0.00
ATOM 2138 H1 HOH A 713 17.793 1.986 19.243 1.00 0.00
ATOM 2139 H2 HOH A 713 18.996 3.075 19.060 1.00 0.00
ATOM 2140 O HOH A 714 7.088 9.013 4.239 1.00 0.00
ATOM 2141 H1 HOH A 714 6.934 9.667 4.980 1.00 0.00
ATOM 2142 H2 HOH A 714 7.476 9.490 3.450 1.00 0.00
ATOM 2143 O HOH A 715 26.071 15.619 27.739 1.00 0.00
ATOM 2144 H1 HOH A 715 26.403 16.270 27.056 1.00 0.00
ATOM 2145 H2 HOH A 715 25.083 15.501 27.634 1.00 0.00
ATOM 2146 O HOH A 716 14.698 14.256 28.944 1.00 0.00
ATOM 2147 H1 HOH A 716 14.142 14.962 28.505 1.00 0.00
ATOM 2148 H2 HOH A 716 14.366 13.353 28.672 1.00 0.00
ATOM 2149 O HOH A 717 2.814 1.205 26.695 1.00 0.00
ATOM 2150 H1 HOH A 717 2.479 1.279 27.634 1.00 0.00
ATOM 2151 H2 HOH A 717 3.278 0.327 26.575 1.00 0.00
ATOM 2152 O HOH A 718 9.909 4.513 21.404 1.00 0.00
ATOM 2153 H1 HOH A 718 10.739 4.930 21.772 1.00 0.00
ATOM 2154 H2 HOH A 718 9.272 4.322 22.151 1.00 0.00
ATOM 2155 O HOH A 719 23.409 17.753 24.703 1.00 0.00
ATOM 2156 H1 HOH A 719 24.150 18.242 25.164 1.00 0.00
ATOM 2157 H2 HOH A 719 23.123 18.267 23.894 1.00 0.00
ATOM 2158 O HOH A 720 19.707 5.222 24.828 1.00 0.00
ATOM 2159 H1 HOH A 720 19.412 5.468 23.904 1.00 0.00
ATOM 2160 H2 HOH A 720 19.961 6.049 25.328 1.00 0.00
ATOM 2161 O HOH A 721 23.884 16.285 14.897 1.00 0.00
ATOM 2162 H1 HOH A 721 23.052 16.837 14.865 1.00 0.00
ATOM 2163 H2 HOH A 721 24.681 16.886 14.962 1.00 0.00
ATOM 2164 O HOH A 722 25.294 10.808 21.652 1.00 0.00
ATOM 2165 H1 HOH A 722 25.347 11.730 21.268 1.00 0.00
ATOM 2166 H2 HOH A 722 24.517 10.752 22.279 1.00 0.00
ATOM 2167 O HOH A 723 0.344 10.474 27.340 1.00 0.00
ATOM 2168 H1 HOH A 723 -0.550 10.710 27.721 1.00 0.00
ATOM 2169 H2 HOH A 723 0.237 10.196 26.386 1.00 0.00
ATOM 2170 O HOH A 724 29.899 7.343 27.288 1.00 0.00
ATOM 2171 H1 HOH A 724 28.910 7.478 27.349 1.00 0.00
ATOM 2172 H2 HOH A 724 30.345 8.223 27.125 1.00 0.00
ATOM 2173 O HOH A 725 23.106 11.493 23.467 1.00 0.00
ATOM 2174 H1 HOH A 725 23.087 12.352 23.978 1.00 0.00
ATOM 2175 H2 HOH A 725 22.388 11.502 22.771 1.00 0.00
ATOM 2176 O HOH A 726 13.277 16.526 27.178 1.00 0.00
ATOM 2177 H1 HOH A 726 13.245 16.794 26.215 1.00 0.00
ATOM 2178 H2 HOH A 726 12.352 16.539 27.558 1.00 0.00
ATOM 2179 O HOH A 727 20.323 3.511 13.727 1.00 0.00
ATOM 2180 H1 HOH A 727 19.453 3.947 13.495 1.00 0.00
ATOM 2181 H2 HOH A 727 20.183 2.527 13.840 1.00 0.00
ATOM 2182 O HOH A 728 19.862 7.592 19.641 1.00 0.00
ATOM 2183 H1 HOH A 728 20.304 7.768 20.521 1.00 0.00
ATOM 2184 H2 HOH A 728 20.546 7.285 18.980 1.00 0.00
ATOM 2185 O HOH A 729 23.574 14.825 19.597 1.00 0.00
ATOM 2186 H1 HOH A 729 23.164 14.759 18.687 1.00 0.00
ATOM 2187 H2 HOH A 729 24.296 14.139 19.687 1.00 0.00
ATOM 2188 O HOH A 730 1.472 4.876 24.057 1.00 0.00
ATOM 2189 H1 HOH A 730 1.238 5.130 24.996 1.00 0.00
ATOM 2190 H2 HOH A 730 1.294 3.902 23.921 1.00 0.00
ATOM 2191 O HOH A 731 20.713 7.754 25.818 1.00 0.00
ATOM 2192 H1 HOH A 731 20.185 8.107 26.591 1.00 0.00
ATOM 2193 H2 HOH A 731 21.686 7.760 26.049 1.00 0.00
ATOM 2194 O HOH A 732 27.447 15.197 16.803 1.00 0.00
ATOM 2195 H1 HOH A 732 28.211 14.601 17.050 1.00 0.00
ATOM 2196 H2 HOH A 732 26.586 14.700 16.913 1.00 0.00
ATOM 2197 O HOH A 733 26.987 21.067 2.536 1.00 0.00
ATOM 2198 H1 HOH A 733 26.846 21.775 1.844 1.00 0.00
ATOM 2199 H2 HOH A 733 27.651 21.389 3.211 1.00 0.00
ATOM 2200 O HOH A 734 26.909 7.113 6.888 1.00 0.00
ATOM 2201 H1 HOH A 734 27.796 6.887 6.484 1.00 0.00
ATOM 2202 H2 HOH A 734 26.753 8.098 6.818 1.00 0.00
ATOM 2203 O HOH A 735 0.530 12.403 20.002 1.00 0.00
ATOM 2204 H1 HOH A 735 1.200 12.212 20.719 1.00 0.00
ATOM 2205 H2 HOH A 735 0.377 11.577 19.459 1.00 0.00
ATOM 2206 O HOH A 736 21.841 15.003 23.398 1.00 0.00
ATOM 2207 H1 HOH A 736 21.902 14.918 24.393 1.00 0.00
ATOM 2208 H2 HOH A 736 21.313 14.237 23.030 1.00 0.00
ATOM 2209 O HOH A 737 26.626 6.936 21.676 1.00 0.00
ATOM 2210 H1 HOH A 737 25.842 7.179 22.247 1.00 0.00
ATOM 2211 H2 HOH A 737 27.351 6.555 22.249 1.00 0.00
ATOM 2212 O HOH A 738 24.403 20.694 0.642 1.00 0.00
ATOM 2213 H1 HOH A 738 24.010 21.528 1.029 1.00 0.00
ATOM 2214 H2 HOH A 738 25.338 20.580 0.978 1.00 0.00
ATOM 2215 O HOH A 739 20.462 13.875 20.101 1.00 0.00
ATOM 2216 H1 HOH A 739 20.897 13.017 20.375 1.00 0.00
ATOM 2217 H2 HOH A 739 20.463 14.511 20.873 1.00 0.00
ATOM 2218 O HOH A 740 9.245 1.722 21.628 1.00 0.00
ATOM 2219 H1 HOH A 740 9.487 2.576 22.089 1.00 0.00
ATOM 2220 H2 HOH A 740 8.448 1.873 21.043 1.00 0.00
ATOM 2221 O HOH A 741 1.644 4.512 4.891 1.00 0.00
ATOM 2222 H1 HOH A 741 1.992 4.913 4.044 1.00 0.00
ATOM 2223 H2 HOH A 741 0.810 3.994 4.696 1.00 0.00
ATOM 2224 O HOH A 742 17.184 7.486 18.700 1.00 0.00
ATOM 2225 H1 HOH A 742 17.281 7.101 17.782 1.00 0.00
ATOM 2226 H2 HOH A 742 18.021 7.975 18.946 1.00 0.00
ATOM 2227 O HOH A 743 25.226 15.212 24.552 1.00 0.00
ATOM 2228 H1 HOH A 743 24.473 15.865 24.629 1.00 0.00
ATOM 2229 H2 HOH A 743 25.640 15.287 23.644 1.00 0.00
ATOM 2230 O HOH A 744 21.405 28.208 1.508 1.00 0.00
ATOM 2231 H1 HOH A 744 21.199 27.282 1.189 1.00 0.00
ATOM 2232 H2 HOH A 744 20.555 28.729 1.587 1.00 0.00
ATOM 2233 O HOH A 745 15.223 20.213 13.672 1.00 0.00
ATOM 2234 H1 HOH A 745 14.985 21.149 13.412 1.00 0.00
ATOM 2235 H2 HOH A 745 15.638 20.215 14.582 1.00 0.00
ATOM 2236 O HOH A 746 19.351 25.345 5.845 1.00 0.00
ATOM 2237 H1 HOH A 746 19.431 25.051 4.893 1.00 0.00
ATOM 2238 H2 HOH A 746 18.879 24.639 6.373 1.00 0.00
ATOM 2239 O HOH A 747 16.095 2.358 7.533 1.00 0.00
ATOM 2240 H1 HOH A 747 15.523 3.119 7.839 1.00 0.00
ATOM 2241 H2 HOH A 747 15.999 1.592 8.169 1.00 0.00
ATOM 2242 O HOH A 748 1.555 27.831 21.546 1.00 0.00
ATOM 2243 H1 HOH A 748 2.454 27.447 21.335 1.00 0.00
ATOM 2244 H2 HOH A 748 1.509 28.056 22.519 1.00 0.00
ATOM 2245 O HOH A 749 22.860 27.883 8.700 1.00 0.00
ATOM 2246 H1 HOH A 749 22.156 28.564 8.900 1.00 0.00
ATOM 2247 H2 HOH A 749 22.667 27.451 7.819 1.00 0.00
ATOM 2248 O HOH A 750 0.833 28.621 17.834 1.00 0.00
ATOM 2249 H1 HOH A 750 0.143 28.917 18.495 1.00 0.00
ATOM 2250 H2 HOH A 750 0.723 29.137 16.985 1.00 0.00
ATOM 2251 O HOH A 751 22.947 28.494 15.033 1.00 0.00
ATOM 2252 H1 HOH A 751 23.655 28.367 15.727 1.00 0.00
ATOM 2253 H2 HOH A 751 22.083 28.113 15.363 1.00 0.00
ATOM 2254 O HOH A 752 23.670 2.513 4.035 1.00 0.00
ATOM 2255 H1 HOH A 752 23.413 1.712 4.576 1.00 0.00
ATOM 2256 H2 HOH A 752 24.301 2.238 3.310 1.00 0.00
ATOM 2257 O HOH A 753 19.584 21.713 2.628 1.00 0.00
ATOM 2258 H1 HOH A 753 19.824 22.583 3.059 1.00 0.00
ATOM 2259 H2 HOH A 753 19.512 21.839 1.639 1.00 0.00
ATOM 2260 O HOH A 754 25.090 28.092 16.883 1.00 0.00
ATOM 2261 H1 HOH A 754 25.949 28.080 17.395 1.00 0.00
ATOM 2262 H2 HOH A 754 24.414 27.524 17.353 1.00 0.00
ATOM 2263 O HOH A 755 27.157 13.700 29.354 1.00 0.00
ATOM 2264 H1 HOH A 755 26.960 13.855 30.322 1.00 0.00
ATOM 2265 H2 HOH A 755 26.664 14.374 28.802 1.00 0.00
ATOM 2266 O HOH A 756 21.814 5.975 10.457 1.00 0.00
ATOM 2267 H1 HOH A 756 21.802 6.554 9.641 1.00 0.00
ATOM 2268 H2 HOH A 756 22.075 6.525 11.251 1.00 0.00
ATOM 2269 O HOH A 757 23.333 19.839 15.358 1.00 0.00
ATOM 2270 H1 HOH A 757 24.213 19.612 14.943 1.00 0.00
ATOM 2271 H2 HOH A 757 23.247 19.369 16.237 1.00 0.00
ATOM 2272 O HOH A 758 23.789 30.222 5.642 1.00 0.00
ATOM 2273 H1 HOH A 758 24.626 29.727 5.872 1.00 0.00
ATOM 2274 H2 HOH A 758 23.257 29.690 4.982 1.00 0.00
ATOM 2275 O HOH A 759 23.028 21.578 11.032 1.00 0.00
ATOM 2276 H1 HOH A 759 24.024 21.651 11.093 1.00 0.00
ATOM 2277 H2 HOH A 759 22.675 21.135 11.856 1.00 0.00
ATOM 2278 O HOH A 760 29.818 24.078 13.759 1.00 0.00
ATOM 2279 H1 HOH A 760 28.856 24.298 13.599 1.00 0.00
ATOM 2280 H2 HOH A 760 30.357 24.335 12.956 1.00 0.00
ATOM 2281 O HOH A 761 28.966 24.651 21.932 1.00 0.00
ATOM 2282 H1 HOH A 761 28.826 25.558 21.535 1.00 0.00
ATOM 2283 H2 HOH A 761 29.811 24.256 21.570 1.00 0.00
ATOM 2284 O HOH A 762 27.613 21.000 14.018 1.00 0.00
ATOM 2285 H1 HOH A 762 26.734 20.691 13.654 1.00 0.00
ATOM 2286 H2 HOH A 762 27.731 21.973 13.820 1.00 0.00
ATOM 2287 O HOH A 763 26.145 24.829 4.963 1.00 0.00
ATOM 2288 H1 HOH A 763 26.221 23.989 5.500 1.00 0.00
ATOM 2289 H2 HOH A 763 26.277 24.619 3.995 1.00 0.00
ATOM 2290 O HOH A 764 14.439 27.189 11.457 1.00 0.00
ATOM 2291 H1 HOH A 764 14.009 26.647 10.736 1.00 0.00
ATOM 2292 H2 HOH A 764 13.816 27.264 12.235 1.00 0.00
ATOM 2293 O HOH A 765 27.384 24.588 2.219 1.00 0.00
ATOM 2294 H1 HOH A 765 28.170 25.094 1.865 1.00 0.00
ATOM 2295 H2 HOH A 765 27.094 23.908 1.544 1.00 0.00
ATOM 2296 O HOH A 766 24.215 21.346 5.635 1.00 0.00
ATOM 2297 H1 HOH A 766 23.621 22.094 5.932 1.00 0.00
ATOM 2298 H2 HOH A 766 24.136 21.230 4.645 1.00 0.00
ATOM 2299 O HOH A 767 23.579 0.519 13.258 1.00 0.00
ATOM 2300 H1 HOH A 767 23.503 -0.170 13.980 1.00 0.00
ATOM 2301 H2 HOH A 767 22.909 0.325 12.541 1.00 0.00
ATOM 2302 O HOH A 768 24.623 22.834 17.563 1.00 0.00
ATOM 2303 H1 HOH A 768 24.421 23.444 18.329 1.00 0.00
ATOM 2304 H2 HOH A 768 23.775 22.609 17.084 1.00 0.00
ATOM 2305 O HOH A 769 22.614 28.008 4.366 1.00 0.00
ATOM 2306 H1 HOH A 769 23.526 27.686 4.111 1.00 0.00
ATOM 2307 H2 HOH A 769 22.073 28.167 3.541 1.00 0.00
ATOM 2308 O HOH A 770 26.622 22.833 30.336 1.00 0.00
ATOM 2309 H1 HOH A 770 25.886 23.189 29.760 1.00 0.00
ATOM 2310 H2 HOH A 770 27.351 22.468 29.758 1.00 0.00
ATOM 2311 O HOH A 771 0.447 25.126 18.637 1.00 0.00
ATOM 2312 H1 HOH A 771 0.078 24.537 17.917 1.00 0.00
ATOM 2313 H2 HOH A 771 1.226 25.641 18.279 1.00 0.00
ATOM 2314 O HOH A 772 22.312 5.218 5.213 1.00 0.00
ATOM 2315 H1 HOH A 772 23.117 5.743 4.936 1.00 0.00
ATOM 2316 H2 HOH A 772 22.564 4.256 5.322 1.00 0.00
ATOM 2317 O HOH A 773 28.480 26.955 7.827 1.00 0.00
ATOM 2318 H1 HOH A 773 28.856 26.220 8.392 1.00 0.00
ATOM 2319 H2 HOH A 773 27.485 26.972 7.922 1.00 0.00
ATOM 2320 O HOH A 774 24.067 25.306 8.894 1.00 0.00
ATOM 2321 H1 HOH A 774 23.627 26.194 8.765 1.00 0.00
ATOM 2322 H2 HOH A 774 23.382 24.631 9.169 1.00 0.00
ATOM 2323 O HOH A 775 18.830 20.839 5.487 1.00 0.00
ATOM 2324 H1 HOH A 775 18.772 21.130 4.532 1.00 0.00
ATOM 2325 H2 HOH A 775 19.777 20.912 5.801 1.00 0.00
ATOM 2326 O HOH A 776 2.465 27.098 27.670 1.00 0.00
ATOM 2327 H1 HOH A 776 2.495 27.747 28.430 1.00 0.00
ATOM 2328 H2 HOH A 776 2.562 26.167 28.023 1.00 0.00
ATOM 2329 O HOH A 777 14.783 22.991 17.404 1.00 0.00
ATOM 2330 H1 HOH A 777 15.406 22.869 18.176 1.00 0.00
ATOM 2331 H2 HOH A 777 13.838 22.955 17.730 1.00 0.00
ATOM 2332 O HOH A 778 22.731 24.839 12.363 1.00 0.00
ATOM 2333 H1 HOH A 778 22.913 24.849 11.380 1.00 0.00
ATOM 2334 H2 HOH A 778 23.197 25.609 12.797 1.00 0.00
ATOM 2335 O HOH A 779 27.197 22.849 9.043 1.00 0.00
ATOM 2336 H1 HOH A 779 26.911 22.418 8.186 1.00 0.00
ATOM 2337 H2 HOH A 779 27.661 23.712 8.843 1.00 0.00
ATOM 2338 O HOH A 780 26.021 18.321 3.022 1.00 0.00
ATOM 2339 H1 HOH A 780 26.303 19.277 2.938 1.00 0.00
ATOM 2340 H2 HOH A 780 26.614 17.748 2.456 1.00 0.00
ATOM 2341 O HOH A 781 0.010 25.415 1.386 1.00 0.00
ATOM 2342 H1 HOH A 781 -0.099 24.801 0.604 1.00 0.00
ATOM 2343 H2 HOH A 781 0.163 26.347 1.058 1.00 0.00
ATOM 2344 O HOH A 782 29.525 19.112 14.846 1.00 0.00
ATOM 2345 H1 HOH A 782 29.159 18.184 14.785 1.00 0.00
ATOM 2346 H2 HOH A 782 28.814 19.769 14.595 1.00 0.00
ATOM 2347 O HOH A 783 21.514 29.782 11.655 1.00 0.00
ATOM 2348 H1 HOH A 783 21.163 28.860 11.821 1.00 0.00
ATOM 2349 H2 HOH A 783 21.317 30.049 10.712 1.00 0.00
ATOM 2350 O HOH A 784 3.052 17.072 -0.001 1.00 0.00
ATOM 2351 H1 HOH A 784 3.518 17.915 0.266 1.00 0.00
ATOM 2352 H2 HOH A 784 3.346 16.325 0.596 1.00 0.00
ATOM 2353 O HOH A 785 25.763 25.192 11.229 1.00 0.00
ATOM 2354 H1 HOH A 785 25.497 26.000 11.755 1.00 0.00
ATOM 2355 H2 HOH A 785 25.129 25.067 10.466 1.00 0.00
ATOM 2356 O HOH A 786 26.813 25.752 15.210 1.00 0.00
ATOM 2357 H1 HOH A 786 27.644 26.299 15.318 1.00 0.00
ATOM 2358 H2 HOH A 786 26.011 26.344 15.289 1.00 0.00
ATOM 2359 O HOH A 787 26.891 17.890 17.603 1.00 0.00
ATOM 2360 H1 HOH A 787 27.048 17.257 16.845 1.00 0.00
ATOM 2361 H2 HOH A 787 27.571 18.622 17.572 1.00 0.00
ATOM 2362 O HOH A 788 21.658 20.557 13.275 1.00 0.00
ATOM 2363 H1 HOH A 788 22.163 20.556 14.137 1.00 0.00
ATOM 2364 H2 HOH A 788 21.032 19.778 13.254 1.00 0.00
ATOM 2365 O HOH A 789 20.523 2.201 5.731 1.00 0.00
ATOM 2366 H1 HOH A 789 20.034 2.845 6.320 1.00 0.00
ATOM 2367 H2 HOH A 789 21.352 1.890 6.194 1.00 0.00
ATOM 2368 O HOH A 790 2.341 24.582 28.224 1.00 0.00
ATOM 2369 H1 HOH A 790 2.755 23.677 28.125 1.00 0.00
ATOM 2370 H2 HOH A 790 1.347 24.488 28.291 1.00 0.00
ATOM 2371 O HOH A 791 21.959 24.553 14.942 1.00 0.00
ATOM 2372 H1 HOH A 791 22.372 24.526 14.031 1.00 0.00
ATOM 2373 H2 HOH A 791 22.391 23.865 15.525 1.00 0.00
ATOM 2374 O HOH A 792 11.930 8.670 13.689 1.00 0.00
ATOM 2375 H1 HOH A 792 12.712 8.106 13.425 1.00 0.00
ATOM 2376 H2 HOH A 792 11.459 8.245 14.463 1.00 0.00
ATOM 2377 O HOH A 793 5.546 30.224 17.522 1.00 0.00
ATOM 2378 H1 HOH A 793 4.712 29.983 18.018 1.00 0.00
ATOM 2379 H2 HOH A 793 6.142 29.423 17.462 1.00 0.00
ATOM 2380 O HOH A 794 22.024 26.236 6.385 1.00 0.00
ATOM 2381 H1 HOH A 794 21.046 26.029 6.350 1.00 0.00
ATOM 2382 H2 HOH A 794 22.270 26.818 5.611 1.00 0.00
ATOM 2383 O HOH A 795 27.645 0.149 15.437 1.00 0.00
ATOM 2384 H1 HOH A 795 27.188 0.678 14.722 1.00 0.00
ATOM 2385 H2 HOH A 795 26.963 -0.196 16.083 1.00 0.00
ATOM 2386 O HOH A 796 26.048 29.404 22.590 1.00 0.00
ATOM 2387 H1 HOH A 796 27.013 29.664 22.575 1.00 0.00
ATOM 2388 H2 HOH A 796 25.901 28.631 21.972 1.00 0.00
ATOM 2389 O HOH A 797 29.395 24.659 28.802 1.00 0.00
ATOM 2390 H1 HOH A 797 28.636 25.309 28.751 1.00 0.00
ATOM 2391 H2 HOH A 797 29.104 23.778 28.431 1.00 0.00
ATOM 2392 O HOH A 798 20.453 27.095 11.385 1.00 0.00
ATOM 2393 H1 HOH A 798 20.393 26.118 11.591 1.00 0.00
ATOM 2394 H2 HOH A 798 19.707 27.352 10.771 1.00 0.00
ATOM 2395 O HOH A 799 19.971 20.834 10.500 1.00 0.00
ATOM 2396 H1 HOH A 799 20.932 20.696 10.738 1.00 0.00
ATOM 2397 H2 HOH A 799 19.459 21.097 11.317 1.00 0.00
ATOM 2398 O HOH A 800 28.268 20.369 18.268 1.00 0.00
ATOM 2399 H1 HOH A 800 27.752 20.596 19.094 1.00 0.00
ATOM 2400 H2 HOH A 800 28.021 21.004 17.536 1.00 0.00
ATOM 2401 O HOH A 801 2.130 18.768 16.518 1.00 0.00
ATOM 2402 H1 HOH A 801 1.762 18.777 17.447 1.00 0.00
ATOM 2403 H2 HOH A 801 1.392 18.945 15.866 1.00 0.00
ATOM 2404 O HOH A 802 23.649 17.946 11.109 1.00 0.00
ATOM 2405 H1 HOH A 802 24.086 17.794 10.223 1.00 0.00
ATOM 2406 H2 HOH A 802 23.388 18.908 11.192 1.00 0.00
ATOM 2407 O HOH A 803 26.579 1.177 13.099 1.00 0.00
ATOM 2408 H1 HOH A 803 25.858 0.523 12.870 1.00 0.00
ATOM 2409 H2 HOH A 803 26.728 1.793 12.325 1.00 0.00
ATOM 2410 O HOH A 804 12.892 26.832 13.755 1.00 0.00
ATOM 2411 H1 HOH A 804 13.289 26.357 14.541 1.00 0.00
ATOM 2412 H2 HOH A 804 11.927 26.583 13.669 1.00 0.00
ATOM 2413 O HOH A 805 21.545 28.752 24.093 1.00 0.00
ATOM 2414 H1 HOH A 805 21.263 29.645 23.742 1.00 0.00
ATOM 2415 H2 HOH A 805 20.969 28.040 23.693 1.00 0.00
ATOM 2416 O HOH A 806 21.012 1.046 26.402 1.00 0.00
ATOM 2417 H1 HOH A 806 21.853 0.616 26.729 1.00 0.00
ATOM 2418 H2 HOH A 806 21.045 2.028 26.590 1.00 0.00
ATOM 2419 O HOH A 807 -0.003 24.597 9.198 1.00 0.00
ATOM 2420 H1 HOH A 807 -0.341 25.101 9.993 1.00 0.00
ATOM 2421 H2 HOH A 807 0.866 24.157 9.427 1.00 0.00
ATOM 2422 O HOH A 808 19.836 20.245 25.583 1.00 0.00
ATOM 2423 H1 HOH A 808 19.409 20.814 24.880 1.00 0.00
ATOM 2424 H2 HOH A 808 19.735 19.281 25.339 1.00 0.00
ATOM 2425 O HOH A 809 22.265 0.847 20.269 1.00 0.00
ATOM 2426 H1 HOH A 809 22.785 -0.007 20.254 1.00 0.00
ATOM 2427 H2 HOH A 809 21.287 0.643 20.219 1.00 0.00
ATOM 2428 O HOH A 810 2.684 26.909 18.185 1.00 0.00
ATOM 2429 H1 HOH A 810 3.270 26.738 17.393 1.00 0.00
ATOM 2430 H2 HOH A 810 1.959 27.550 17.932 1.00 0.00
ATOM 2431 O HOH A 811 28.794 29.212 4.521 1.00 0.00
ATOM 2432 H1 HOH A 811 28.965 28.239 4.679 1.00 0.00
ATOM 2433 H2 HOH A 811 29.645 29.724 4.637 1.00 0.00
ATOM 2434 O HOH A 812 2.153 21.513 2.312 1.00 0.00
ATOM 2435 H1 HOH A 812 3.018 21.068 2.542 1.00 0.00
ATOM 2436 H2 HOH A 812 1.867 21.233 1.396 1.00 0.00
ATOM 2437 O HOH A 813 27.823 27.652 0.469 1.00 0.00
ATOM 2438 H1 HOH A 813 28.822 27.695 0.470 1.00 0.00
ATOM 2439 H2 HOH A 813 27.490 27.640 -0.473 1.00 0.00
ATOM 2440 O HOH A 814 19.334 17.631 5.591 1.00 0.00
ATOM 2441 H1 HOH A 814 18.692 17.966 6.281 1.00 0.00
ATOM 2442 H2 HOH A 814 19.539 18.365 4.943 1.00 0.00
ATOM 2443 O HOH A 815 27.007 23.700 13.405 1.00 0.00
ATOM 2444 H1 HOH A 815 26.836 24.374 12.686 1.00 0.00
ATOM 2445 H2 HOH A 815 26.784 24.099 14.295 1.00 0.00
ATOM 2446 O HOH A 816 28.497 28.965 11.755 1.00 0.00
ATOM 2447 H1 HOH A 816 27.956 29.646 12.248 1.00 0.00
ATOM 2448 H2 HOH A 816 29.270 28.680 12.321 1.00 0.00
ATOM 2449 O HOH A 817 22.441 4.030 12.037 1.00 0.00
ATOM 2450 H1 HOH A 817 22.063 4.590 11.300 1.00 0.00
ATOM 2451 H2 HOH A 817 21.706 3.757 12.659 1.00 0.00
ATOM 2452 O HOH A 818 25.460 26.777 6.929 1.00 0.00
ATOM 2453 H1 HOH A 818 24.857 26.479 7.669 1.00 0.00
ATOM 2454 H2 HOH A 818 25.730 25.986 6.380 1.00 0.00
ATOM 2455 O HOH A 819 27.551 28.195 18.621 1.00 0.00
ATOM 2456 H1 HOH A 819 28.229 27.471 18.747 1.00 0.00
ATOM 2457 H2 HOH A 819 28.017 29.074 18.516 1.00 0.00
ATOM 2458 O HOH A 820 27.132 22.346 16.509 1.00 0.00
ATOM 2459 H1 HOH A 820 27.050 21.920 15.608 1.00 0.00
ATOM 2460 H2 HOH A 820 26.219 22.537 16.871 1.00 0.00
ATOM 2461 O HOH A 821 21.899 25.222 28.779 1.00 0.00
ATOM 2462 H1 HOH A 821 20.972 25.410 28.454 1.00 0.00
ATOM 2463 H2 HOH A 821 22.542 25.841 28.328 1.00 0.00
ATOM 2464 O HOH A 822 28.467 2.590 24.756 1.00 0.00
ATOM 2465 H1 HOH A 822 28.297 3.090 23.907 1.00 0.00
ATOM 2466 H2 HOH A 822 29.448 2.592 24.954 1.00 0.00
ATOM 2467 O HOH A 823 26.061 21.699 19.560 1.00 0.00
ATOM 2468 H1 HOH A 823 25.625 21.106 20.237 1.00 0.00
ATOM 2469 H2 HOH A 823 25.390 21.963 18.867 1.00 0.00
ATOM 2470 O HOH A 824 26.524 24.133 20.989 1.00 0.00
ATOM 2471 H1 HOH A 824 26.309 23.276 20.521 1.00 0.00
ATOM 2472 H2 HOH A 824 27.405 24.047 21.454 1.00 0.00
ATOM 2473 O HOH A 825 3.548 17.434 6.384 1.00 0.00
ATOM 2474 H1 HOH A 825 3.868 17.022 5.531 1.00 0.00
ATOM 2475 H2 HOH A 825 3.439 18.420 6.257 1.00 0.00
ATOM 2476 O HOH A 826 17.697 23.461 7.119 1.00 0.00
ATOM 2477 H1 HOH A 826 17.709 23.019 8.016 1.00 0.00
ATOM 2478 H2 HOH A 826 17.668 22.763 6.404 1.00 0.00
ATOM 2479 O HOH A 827 24.039 3.105 14.251 1.00 0.00
ATOM 2480 H1 HOH A 827 23.963 3.796 13.534 1.00 0.00
ATOM 2481 H2 HOH A 827 23.857 2.201 13.864 1.00 0.00
ATOM 2482 O HOH A 828 26.839 28.549 2.568 1.00 0.00
ATOM 2483 H1 HOH A 828 27.240 28.247 1.703 1.00 0.00
ATOM 2484 H2 HOH A 828 27.553 28.942 3.147 1.00 0.00
ATOM 2485 O HOH A 829 18.966 29.580 5.367 1.00 0.00
ATOM 2486 H1 HOH A 829 19.367 28.898 4.757 1.00 0.00
ATOM 2487 H2 HOH A 829 19.307 30.488 5.123 1.00 0.00
ATOM 2488 O HOH A 830 21.754 23.610 9.625 1.00 0.00
ATOM 2489 H1 HOH A 830 20.965 24.035 10.068 1.00 0.00
ATOM 2490 H2 HOH A 830 22.073 22.841 10.179 1.00 0.00
ATOM 2491 O HOH A 831 20.076 24.365 11.730 1.00 0.00
ATOM 2492 H1 HOH A 831 19.561 23.586 12.087 1.00 0.00
ATOM 2493 H2 HOH A 831 21.026 24.305 12.035 1.00 0.00
ATOM 2494 O HOH A 832 25.637 22.147 11.261 1.00 0.00
ATOM 2495 H1 HOH A 832 25.858 22.708 12.059 1.00 0.00
ATOM 2496 H2 HOH A 832 26.110 22.508 10.458 1.00 0.00
ATOM 2497 O HOH A 833 28.820 1.005 29.516 1.00 0.00
ATOM 2498 H1 HOH A 833 28.084 0.339 29.638 1.00 0.00
ATOM 2499 H2 HOH A 833 29.446 0.684 28.806 1.00 0.00
ATOM 2500 O HOH A 834 4.064 29.128 19.561 1.00 0.00
ATOM 2501 H1 HOH A 834 3.512 29.656 20.205 1.00 0.00
ATOM 2502 H2 HOH A 834 3.593 28.273 19.341 1.00 0.00
ATOM 2503 O HOH A 835 20.865 4.564 29.619 1.00 0.00
ATOM 2504 H1 HOH A 835 21.003 5.492 29.274 1.00 0.00
ATOM 2505 H2 HOH A 835 21.494 4.393 30.377 1.00 0.00
ATOM 2506 O HOH A 836 1.118 25.418 23.886 1.00 0.00
ATOM 2507 H1 HOH A 836 0.312 25.152 23.359 1.00 0.00
ATOM 2508 H2 HOH A 836 1.591 24.598 24.209 1.00 0.00
ATOM 2509 O HOH A 837 20.115 19.044 2.849 1.00 0.00
ATOM 2510 H1 HOH A 837 20.005 20.017 2.644 1.00 0.00
ATOM 2511 H2 HOH A 837 20.884 18.678 2.325 1.00 0.00
ATOM 2512 O HOH A 838 16.425 14.601 3.337 1.00 0.00
ATOM 2513 H1 HOH A 838 16.761 13.736 3.711 1.00 0.00
ATOM 2514 H2 HOH A 838 17.095 14.967 2.691 1.00 0.00
ATOM 2515 O HOH A 839 29.981 3.131 27.787 1.00 0.00
ATOM 2516 H1 HOH A 839 30.157 2.615 28.626 1.00 0.00
ATOM 2517 H2 HOH A 839 28.996 3.170 27.621 1.00 0.00
ATOM 2518 O HOH A 840 25.451 23.985 27.842 1.00 0.00
ATOM 2519 H1 HOH A 840 25.843 23.143 27.473 1.00 0.00
ATOM 2520 H2 HOH A 840 24.630 24.225 27.325 1.00 0.00
ATOM 2521 O HOH A 841 26.431 29.567 29.080 1.00 0.00
ATOM 2522 H1 HOH A 841 26.326 28.775 28.478 1.00 0.00
ATOM 2523 H2 HOH A 841 25.671 29.596 29.728 1.00 0.00
ATOM 2524 O HOH A 842 28.096 3.740 22.140 1.00 0.00
ATOM 2525 H1 HOH A 842 27.211 3.471 21.762 1.00 0.00
ATOM 2526 H2 HOH A 842 28.668 4.120 21.413 1.00 0.00
ATOM 2527 O HOH A 843 21.640 4.113 20.661 1.00 0.00
ATOM 2528 H1 HOH A 843 22.448 4.688 20.537 1.00 0.00
ATOM 2529 H2 HOH A 843 21.867 3.343 21.256 1.00 0.00
ATOM 2530 O HOH A 844 29.479 16.348 26.421 1.00 0.00
ATOM 2531 H1 HOH A 844 29.768 15.958 25.546 1.00 0.00
ATOM 2532 H2 HOH A 844 28.638 16.873 26.289 1.00 0.00
ATOM 2533 O HOH A 845 29.423 26.945 20.438 1.00 0.00
ATOM 2534 H1 HOH A 845 29.701 26.149 19.901 1.00 0.00
ATOM 2535 H2 HOH A 845 30.215 27.308 20.929 1.00 0.00
ATOM 2536 O HOH A 846 6.799 14.766 1.095 1.00 0.00
ATOM 2537 H1 HOH A 846 7.027 14.225 1.904 1.00 0.00
ATOM 2538 H2 HOH A 846 6.295 15.584 1.371 1.00 0.00
ATOM 2539 O HOH A 847 2.781 15.154 19.898 1.00 0.00
ATOM 2540 H1 HOH A 847 1.995 15.749 19.729 1.00 0.00
ATOM 2541 H2 HOH A 847 2.962 14.602 19.084 1.00 0.00
ATOM 2542 O HOH A 848 18.690 -0.108 22.306 1.00 0.00
ATOM 2543 H1 HOH A 848 19.341 -0.385 21.599 1.00 0.00
ATOM 2544 H2 HOH A 848 18.614 0.889 22.317 1.00 0.00
ATOM 2545 O HOH A 849 1.791 20.533 21.054 1.00 0.00
ATOM 2546 H1 HOH A 849 1.676 21.520 20.948 1.00 0.00
ATOM 2547 H2 HOH A 849 2.730 20.335 21.338 1.00 0.00
ATOM 2548 O HOH A 850 27.013 17.692 29.518 1.00 0.00
ATOM 2549 H1 HOH A 850 26.795 16.864 29.002 1.00 0.00
ATOM 2550 H2 HOH A 850 27.630 17.462 30.271 1.00 0.00
ATOM 2551 O HOH A 851 22.294 23.815 23.342 1.00 0.00
ATOM 2552 H1 HOH A 851 21.632 23.081 23.188 1.00 0.00
ATOM 2553 H2 HOH A 851 22.263 24.458 22.577 1.00 0.00
ATOM 2554 O HOH A 852 23.223 26.925 26.261 1.00 0.00
ATOM 2555 H1 HOH A 852 24.016 27.435 25.927 1.00 0.00
ATOM 2556 H2 HOH A 852 23.295 25.970 25.972 1.00 0.00
ATOM 2557 O HOH A 853 29.221 16.782 21.793 1.00 0.00
ATOM 2558 H1 HOH A 853 29.545 16.140 22.488 1.00 0.00
ATOM 2559 H2 HOH A 853 29.647 17.675 21.940 1.00 0.00
ATOM 2560 O HOH A 854 16.274 2.191 30.121 1.00 0.00
ATOM 2561 H1 HOH A 854 17.241 2.200 30.377 1.00 0.00
ATOM 2562 H2 HOH A 854 16.105 2.896 29.433 1.00 0.00
ATOM 2563 O HOH A 855 0.883 19.944 26.271 1.00 0.00
ATOM 2564 H1 HOH A 855 -0.040 19.768 25.929 1.00 0.00
ATOM 2565 H2 HOH A 855 1.068 19.346 27.051 1.00 0.00
ATOM 2566 O HOH A 856 21.434 21.006 6.500 1.00 0.00
ATOM 2567 H1 HOH A 856 22.013 20.676 5.754 1.00 0.00
ATOM 2568 H2 HOH A 856 21.739 21.916 6.781 1.00 0.00
ATOM 2569 O HOH A 857 25.394 19.207 27.736 1.00 0.00
ATOM 2570 H1 HOH A 857 24.418 19.401 27.834 1.00 0.00
ATOM 2571 H2 HOH A 857 25.729 18.756 28.564 1.00 0.00
ATOM 2572 O HOH A 858 5.677 16.118 17.681 1.00 0.00
ATOM 2573 H1 HOH A 858 5.020 15.366 17.744 1.00 0.00
ATOM 2574 H2 HOH A 858 6.281 15.967 16.898 1.00 0.00
ATOM 2575 O HOH A 859 1.194 28.038 24.329 1.00 0.00
ATOM 2576 H1 HOH A 859 2.100 27.997 24.751 1.00 0.00
ATOM 2577 H2 HOH A 859 0.806 27.117 24.284 1.00 0.00
ATOM 2578 O HOH A 860 28.483 21.880 28.047 1.00 0.00
ATOM 2579 H1 HOH A 860 28.739 20.976 28.390 1.00 0.00
ATOM 2580 H2 HOH A 860 27.789 21.781 27.333 1.00 0.00
ATOM 2581 O HOH A 861 24.871 22.635 23.224 1.00 0.00
ATOM 2582 H1 HOH A 861 23.982 23.045 23.430 1.00 0.00
ATOM 2583 H2 HOH A 861 25.537 23.359 23.044 1.00 0.00
ATOM 2584 O HOH A 862 19.569 19.995 28.486 1.00 0.00
ATOM 2585 H1 HOH A 862 19.239 19.051 28.518 1.00 0.00
ATOM 2586 H2 HOH A 862 19.782 20.241 27.541 1.00 0.00
ATOM 2587 O HOH A 863 29.082 21.297 22.669 1.00 0.00
ATOM 2588 H1 HOH A 863 29.453 22.132 22.262 1.00 0.00
ATOM 2589 H2 HOH A 863 29.670 20.523 22.436 1.00 0.00
ATOM 2590 O HOH A 864 19.593 22.249 30.004 1.00 0.00
ATOM 2591 H1 HOH A 864 19.541 21.284 29.745 1.00 0.00
ATOM 2592 H2 HOH A 864 18.853 22.754 29.560 1.00 0.00
ATOM 2593 O HOH A 865 26.980 26.301 28.168 1.00 0.00
ATOM 2594 H1 HOH A 865 26.826 26.926 27.403 1.00 0.00
ATOM 2595 H2 HOH A 865 26.342 25.534 28.107 1.00 0.00
ATOM 2596 O HOH A 866 0.784 19.226 18.869 1.00 0.00
ATOM 2597 H1 HOH A 866 1.166 19.765 19.619 1.00 0.00
ATOM 2598 H2 HOH A 866 -0.004 19.704 18.482 1.00 0.00
ATOM 2599 O HOH A 867 15.288 24.877 26.997 1.00 0.00
ATOM 2600 H1 HOH A 867 15.719 24.421 26.218 1.00 0.00
ATOM 2601 H2 HOH A 867 15.978 25.391 27.506 1.00 0.00
ATOM 2602 O HOH A 868 24.193 29.241 1.359 1.00 0.00
ATOM 2603 H1 HOH A 868 24.799 28.658 1.901 1.00 0.00
ATOM 2604 H2 HOH A 868 23.290 28.816 1.296 1.00 0.00
ATOM 2605 O HOH A 869 22.678 20.409 28.639 1.00 0.00
ATOM 2606 H1 HOH A 869 21.783 20.149 29.003 1.00 0.00
ATOM 2607 H2 HOH A 869 23.312 20.570 29.395 1.00 0.00
ATOM 2608 O HOH A 870 0.351 29.289 27.867 1.00 0.00
ATOM 2609 H1 HOH A 870 0.920 28.544 27.519 1.00 0.00
ATOM 2610 H2 HOH A 870 -0.201 29.663 27.121 1.00 0.00
ATOM 2611 O HOH A 871 3.715 23.835 21.453 1.00 0.00
ATOM 2612 H1 HOH A 871 4.516 23.450 20.995 1.00 0.00
ATOM 2613 H2 HOH A 871 3.779 23.663 22.436 1.00 0.00
ATOM 2614 O HOH A 872 1.522 22.146 24.253 1.00 0.00
ATOM 2615 H1 HOH A 872 0.856 21.542 23.814 1.00 0.00
ATOM 2616 H2 HOH A 872 1.455 22.049 25.246 1.00 0.00
ATOM 2617 O HOH A 873 20.206 26.397 23.196 1.00 0.00
ATOM 2618 H1 HOH A 873 20.342 25.512 23.642 1.00 0.00
ATOM 2619 H2 HOH A 873 19.308 26.760 23.444 1.00 0.00
ATOM 2620 O HOH A 874 11.181 19.121 2.857 1.00 0.00
ATOM 2621 H1 HOH A 874 11.692 19.925 3.162 1.00 0.00
ATOM 2622 H2 HOH A 874 11.663 18.689 2.095 1.00 0.00
ATOM 2623 O HOH A 875 23.256 24.303 25.721 1.00 0.00
ATOM 2624 H1 HOH A 875 22.884 24.133 24.808 1.00 0.00
ATOM 2625 H2 HOH A 875 22.604 23.987 26.410 1.00 0.00
ATOM 2626 O HOH A 876 27.747 20.666 24.897 1.00 0.00
ATOM 2627 H1 HOH A 876 27.982 21.156 24.057 1.00 0.00
ATOM 2628 H2 HOH A 876 27.680 19.687 24.704 1.00 0.00
ATOM 2629 O HOH A 877 20.383 26.591 26.479 1.00 0.00
ATOM 2630 H1 HOH A 877 19.901 27.445 26.674 1.00 0.00
ATOM 2631 H2 HOH A 877 21.336 26.791 26.252 1.00 0.00
ATOM 2632 O HOH A 878 29.374 23.703 16.743 1.00 0.00
ATOM 2633 H1 HOH A 878 28.442 23.343 16.696 1.00 0.00
ATOM 2634 H2 HOH A 878 29.686 23.945 15.824 1.00 0.00
ATOM 2635 O HOH A 879 3.739 27.834 25.345 1.00 0.00
ATOM 2636 H1 HOH A 879 4.059 27.005 24.887 1.00 0.00
ATOM 2637 H2 HOH A 879 3.336 27.594 26.228 1.00 0.00
ATOM 2638 O HOH A 880 18.220 22.461 24.586 1.00 0.00
ATOM 2639 H1 HOH A 880 17.222 22.507 24.569 1.00 0.00
ATOM 2640 H2 HOH A 880 18.565 22.995 25.358 1.00 0.00
ATOM 2641 O HOH A 881 28.970 29.513 25.386 1.00 0.00
ATOM 2642 H1 HOH A 881 28.928 30.511 25.351 1.00 0.00
ATOM 2643 H2 HOH A 881 29.793 29.197 24.914 1.00 0.00
ATOM 2644 O HOH A 882 4.077 22.831 23.975 1.00 0.00
ATOM 2645 H1 HOH A 882 4.719 22.081 24.137 1.00 0.00
ATOM 2646 H2 HOH A 882 3.140 22.492 24.064 1.00 0.00
ATOM 2647 O HOH A 883 23.944 24.332 19.862 1.00 0.00
ATOM 2648 H1 HOH A 883 24.677 24.271 20.538 1.00 0.00
ATOM 2649 H2 HOH A 883 23.189 24.870 20.236 1.00 0.00
ATOM 2650 O HOH A 884 23.144 20.983 20.107 1.00 0.00
ATOM 2651 H1 HOH A 884 22.435 20.594 19.517 1.00 0.00
ATOM 2652 H2 HOH A 884 22.801 21.820 20.532 1.00 0.00
ATOM 2653 O HOH A 885 1.204 6.677 22.030 1.00 0.00
ATOM 2654 H1 HOH A 885 0.402 6.389 21.505 1.00 0.00
ATOM 2655 H2 HOH A 885 1.531 5.912 22.584 1.00 0.00
ATOM 2656 O HOH A 886 5.339 17.640 19.708 1.00 0.00
ATOM 2657 H1 HOH A 886 4.740 18.394 19.436 1.00 0.00
ATOM 2658 H2 HOH A 886 5.350 16.947 18.988 1.00 0.00
ATOM 2659 O HOH A 887 22.199 25.978 21.368 1.00 0.00
ATOM 2660 H1 HOH A 887 22.408 26.810 20.855 1.00 0.00
ATOM 2661 H2 HOH A 887 21.505 26.178 22.060 1.00 0.00
ATOM 2662 O HOH A 888 3.493 22.046 27.272 1.00 0.00
ATOM 2663 H1 HOH A 888 4.113 21.437 27.767 1.00 0.00
ATOM 2664 H2 HOH A 888 4.008 22.561 26.587 1.00 0.00
ATOM 2665 O HOH A 889 6.121 28.521 21.144 1.00 0.00
ATOM 2666 H1 HOH A 889 5.345 28.100 21.615 1.00 0.00
ATOM 2667 H2 HOH A 889 5.814 28.907 20.274 1.00 0.00
ATOM 2668 O HOH A 890 24.491 1.843 23.456 1.00 0.00
ATOM 2669 H1 HOH A 890 23.500 1.716 23.496 1.00 0.00
ATOM 2670 H2 HOH A 890 24.933 0.963 23.287 1.00 0.00
ATOM 2671 O HOH A 891 19.162 24.031 26.666 1.00 0.00
ATOM 2672 H1 HOH A 891 19.370 25.006 26.581 1.00 0.00
ATOM 2673 H2 HOH A 891 20.011 23.519 26.796 1.00 0.00
ATOM 2674 O HOH A 892 24.213 3.176 25.712 1.00 0.00
ATOM 2675 H1 HOH A 892 24.510 2.612 24.941 1.00 0.00
ATOM 2676 H2 HOH A 892 24.487 4.125 25.556 1.00 0.00
ATOM 2677 O HOH A 893 0.540 16.669 19.473 1.00 0.00
ATOM 2678 H1 HOH A 893 0.558 17.626 19.182 1.00 0.00
ATOM 2679 H2 HOH A 893 0.138 16.606 20.386 1.00 0.00
ATOM 2680 O HOH A 894 3.946 19.486 26.020 1.00 0.00
ATOM 2681 H1 HOH A 894 3.337 20.253 26.224 1.00 0.00
ATOM 2682 H2 HOH A 894 4.780 19.829 25.588 1.00 0.00
ATOM 2683 O HOH A 895 17.865 0.216 18.538 1.00 0.00
ATOM 2684 H1 HOH A 895 17.621 0.307 17.573 1.00 0.00
ATOM 2685 H2 HOH A 895 18.646 -0.402 18.628 1.00 0.00
TER 2686 HOH A 895
END
wrappers/python/simtk/openmm/app/modeller.py
View file @ 1878512f
...@@ -74,9 +74,9 @@ class Modeller(object): ...@@ -74,9 +74,9 @@ class Modeller(object):
"""Convert all water molecules to a different water model. """Convert all water molecules to a different water model.
Parameters: Parameters:
- model (string='tip3p') the water model to convert to. Supported values are 'tip3p', 'tip4pew', and 'tip5p'. - model (string='tip3p') the water model to convert to. Supported values are 'tip3p', 'spce', 'tip4pew', and 'tip5p'.
""" """
if model == 'tip3p': if model in ('tip3p', 'spce'):
sites = 3 sites = 3
elif model == 'tip4pew': elif model == 'tip4pew':
sites = 4 sites = 4
...@@ -153,7 +153,7 @@ class Modeller(object): ...@@ -153,7 +153,7 @@ class Modeller(object):
Parameters: Parameters:
- forcefield (ForceField) the ForceField to use for determining van der Waals radii and atomic charges - forcefield (ForceField) the ForceField to use for determining van der Waals radii and atomic charges
- model (string='tip3p') the water model to use. Supported values are 'tip3p', 'tip4pew', and 'tip5p'. - model (string='tip3p') the water model to use. Supported values are 'tip3p', 'spce', 'tip4pew', and 'tip5p'.
- boxSize (Vec3=None) the size of the box to fill with water - boxSize (Vec3=None) the size of the box to fill with water
- padding (distance=None) the padding distance to use - padding (distance=None) the padding distance to use
- positiveIon (string='Na+') the type of positive ion to add. Allowed values are 'Cs+', 'K+', 'Li+', 'Na+', and 'Rb+' - positiveIon (string='Na+') the type of positive ion to add. Allowed values are 'Cs+', 'K+', 'Li+', 'Na+', and 'Rb+'
...@@ -192,6 +192,8 @@ class Modeller(object): ...@@ -192,6 +192,8 @@ class Modeller(object):
vdwRadiusPerSigma = 0.5612310241546864907 vdwRadiusPerSigma = 0.5612310241546864907
if model == 'tip3p': if model == 'tip3p':
waterRadius = 0.31507524065751241*vdwRadiusPerSigma waterRadius = 0.31507524065751241*vdwRadiusPerSigma
elif model == 'spce':
waterRadius = 0.31657195050398818*vdwRadiusPerSigma
elif model == 'tip4pew': elif model == 'tip4pew':
waterRadius = 0.315365*vdwRadiusPerSigma waterRadius = 0.315365*vdwRadiusPerSigma
elif model == 'tip5p': elif model == 'tip5p':
......
Markdown is supported
0% or .
You are about to add 0 people to the discussion. Proceed with caution.
Finish editing this message first!
Please register or to comment