CRYST1 0.000 0.000 0.000 90.00 90.00 90.00 P 1 1 ATOM 1 C1 3PTLX 1 8.724 1.601 17.450 1.00 0.00 ATOM 2 C2 3PTLX 1 7.685 0.478 17.441 1.00 0.00 ATOM 3 C3 3PTLX 1 6.391 0.764 18.206 1.00 0.00 ATOM 4 O1 3PTLX 1 5.622 1.862 17.708 1.00 0.00 ATOM 5 H1 3PTLX 1 5.083 2.271 18.443 1.00 0.00 ATOM 6 C4 3PTLX 1 5.392 45.238 18.286 1.00 0.00 ATOM 7 C5 3PTLX 1 6.068 44.044 18.964 1.00 0.00 ATOM 8 C1 3PTLX 2 38.664 13.322 21.120 1.00 0.00 ATOM 9 C2 3PTLX 2 38.147 13.082 22.540 1.00 0.00 ATOM 10 C3 3PTLX 2 37.463 14.252 23.250 1.00 0.00 ATOM 11 O1 3PTLX 2 38.211 15.463 23.109 1.00 0.00 ATOM 12 H1 3PTLX 2 38.840 15.513 23.885 1.00 0.00 ATOM 13 C4 3PTLX 2 36.025 14.504 22.792 1.00 0.00 ATOM 14 C5 3PTLX 2 35.036 13.383 23.119 1.00 0.00 ATOM 15 C1 3PTLX 3 26.557 20.869 11.502 1.00 0.00 ATOM 16 C2 3PTLX 3 26.049 20.869 12.946 1.00 0.00 ATOM 17 C3 3PTLX 3 24.532 20.819 13.137 1.00 0.00 ATOM 18 O1 3PTLX 3 24.188 20.523 14.493 1.00 0.00 ATOM 19 H1 3PTLX 3 23.969 19.559 14.643 1.00 0.00 ATOM 20 C4 3PTLX 3 23.918 22.155 12.714 1.00 0.00 ATOM 21 C5 3PTLX 3 22.412 22.232 12.972 1.00 0.00 ATOM 22 C1 3PTLX 4 3.390 25.290 19.004 1.00 0.00 ATOM 23 C2 3PTLX 4 2.029 24.618 19.196 1.00 0.00 ATOM 24 C3 3PTLX 4 1.030 25.028 18.112 1.00 0.00 ATOM 25 O1 3PTLX 4 0.016 24.029 17.974 1.00 0.00 ATOM 26 H1 3PTLX 4 0.116 23.218 17.399 1.00 0.00 ATOM 27 C4 3PTLX 4 0.397 26.359 18.525 1.00 0.00 ATOM 28 C5 3PTLX 4 -0.233 26.964 17.269 1.00 0.00 ATOM 29 C1 3PTLX 5 45.530 5.653 23.261 1.00 0.00 ATOM 30 C2 3PTLX 5 45.512 6.742 24.335 1.00 0.00 ATOM 31 C3 3PTLX 5 0.785 6.524 25.550 1.00 0.00 ATOM 32 O1 3PTLX 5 0.613 7.726 26.306 1.00 0.00 ATOM 33 H1 3PTLX 5 0.617 7.562 27.292 1.00 0.00 ATOM 34 C4 3PTLX 5 0.294 5.284 26.299 1.00 0.00 ATOM 35 C5 3PTLX 5 1.012 4.938 27.605 1.00 0.00 ATOM 36 C1 3PTLX 6 27.995 40.891 19.913 1.00 0.00 ATOM 37 C2 3PTLX 6 28.761 41.012 18.594 1.00 0.00 ATOM 38 C3 3PTLX 6 30.281 40.892 18.719 1.00 0.00 ATOM 39 O1 3PTLX 6 30.566 39.495 18.823 1.00 0.00 ATOM 40 H1 3PTLX 6 31.379 39.284 19.366 1.00 0.00 ATOM 41 C4 3PTLX 6 31.075 41.623 17.635 1.00 0.00 ATOM 42 C5 3PTLX 6 32.573 41.345 17.778 1.00 0.00 ATOM 43 C1 3PTLX 7 0.341 39.316 38.299 1.00 0.00 ATOM 44 C2 3PTLX 7 1.241 39.160 39.526 1.00 0.00 ATOM 45 C3 3PTLX 7 1.923 37.796 39.650 1.00 0.00 ATOM 46 O1 3PTLX 7 2.936 38.016 40.635 1.00 0.00 ATOM 47 H1 3PTLX 7 3.700 38.559 40.285 1.00 0.00 ATOM 48 C4 3PTLX 7 0.952 36.685 40.056 1.00 0.00 ATOM 49 C5 3PTLX 7 1.673 35.385 40.416 1.00 0.00 ATOM 50 C1 3PTLX 8 0.708 18.272 16.368 1.00 0.00 ATOM 51 C2 3PTLX 8 0.164 19.654 16.735 1.00 0.00 ATOM 52 C3 3PTLX 8 0.967 20.798 16.114 1.00 0.00 ATOM 53 O1 3PTLX 8 0.337 22.069 16.295 1.00 0.00 ATOM 54 H1 3PTLX 8 -0.430 22.085 15.654 1.00 0.00 ATOM 55 C4 3PTLX 8 2.339 20.783 16.790 1.00 0.00 ATOM 56 C5 3PTLX 8 3.305 21.892 16.369 1.00 0.00 ATOM 57 C1 3PTLX 9 0.595 27.932 11.333 1.00 0.00 ATOM 58 C2 3PTLX 9 0.656 29.294 12.026 1.00 0.00 ATOM 59 C3 3PTLX 9 0.630 30.465 11.042 1.00 0.00 ATOM 60 O1 3PTLX 9 0.456 31.677 11.782 1.00 0.00 ATOM 61 H1 3PTLX 9 0.179 32.440 11.198 1.00 0.00 ATOM 62 C4 3PTLX 9 1.926 30.618 10.244 1.00 0.00 ATOM 63 C5 3PTLX 9 1.854 31.680 9.145 1.00 0.00 ATOM 64 C1 3PTLX 10 24.494 9.834 10.906 1.00 0.00 ATOM 65 C2 3PTLX 10 23.016 9.917 10.520 1.00 0.00 ATOM 66 C3 3PTLX 10 22.277 8.600 10.770 1.00 0.00 ATOM 67 O1 3PTLX 10 20.938 8.821 10.319 1.00 0.00 ATOM 68 H1 3PTLX 10 20.398 9.149 11.094 1.00 0.00 ATOM 69 C4 3PTLX 10 22.941 7.462 9.992 1.00 0.00 ATOM 70 C5 3PTLX 10 22.450 6.110 10.513 1.00 0.00 ATOM 71 C1 3PTLX 11 32.865 36.325 11.136 1.00 0.00 ATOM 72 C2 3PTLX 11 32.589 37.384 12.206 1.00 0.00 ATOM 73 C3 3PTLX 11 33.801 38.295 12.414 1.00 0.00 ATOM 74 O1 3PTLX 11 33.891 39.182 11.296 1.00 0.00 ATOM 75 H1 3PTLX 11 34.763 39.671 11.327 1.00 0.00 ATOM 76 C4 3PTLX 11 33.728 39.115 13.703 1.00 0.00 ATOM 77 C5 3PTLX 11 33.359 38.404 15.007 1.00 0.00 ATOM 78 C1 3PTLX 12 11.480 22.930 6.213 1.00 0.00 ATOM 79 C2 3PTLX 12 12.049 24.290 6.621 1.00 0.00 ATOM 80 C3 3PTLX 12 13.557 24.322 6.875 1.00 0.00 ATOM 81 O1 3PTLX 12 14.243 23.897 5.695 1.00 0.00 ATOM 82 H1 3PTLX 12 13.801 23.068 5.351 1.00 0.00 ATOM 83 C4 3PTLX 12 14.011 25.749 7.190 1.00 0.00 ATOM 84 C5 3PTLX 12 13.810 26.207 8.636 1.00 0.00 ATOM 85 C1 3PTLX 13 38.789 34.194 2.897 1.00 0.00 ATOM 86 C2 3PTLX 13 39.071 35.407 3.786 1.00 0.00 ATOM 87 C3 3PTLX 13 39.788 35.083 5.099 1.00 0.00 ATOM 88 O1 3PTLX 13 41.093 34.648 4.707 1.00 0.00 ATOM 89 H1 3PTLX 13 41.423 35.079 3.867 1.00 0.00 ATOM 90 C4 3PTLX 13 39.987 36.354 5.927 1.00 0.00 ATOM 91 C5 3PTLX 13 38.718 37.177 6.156 1.00 0.00 ATOM 92 C1 3PTLX 14 12.385 21.612 30.226 1.00 0.00 ATOM 93 C2 3PTLX 14 11.716 20.563 31.117 1.00 0.00 ATOM 94 C3 3PTLX 14 10.286 20.858 31.575 1.00 0.00 ATOM 95 O1 3PTLX 14 9.433 20.749 30.432 1.00 0.00 ATOM 96 H1 3PTLX 14 9.161 21.680 30.187 1.00 0.00 ATOM 97 C4 3PTLX 14 9.969 19.920 32.741 1.00 0.00 ATOM 98 C5 3PTLX 14 8.506 19.637 33.090 1.00 0.00 ATOM 99 C1 3PTLX 15 20.591 31.052 29.329 1.00 0.00 ATOM 100 C2 3PTLX 15 20.610 30.602 30.791 1.00 0.00 ATOM 101 C3 3PTLX 15 21.119 29.177 31.012 1.00 0.00 ATOM 102 O1 3PTLX 15 20.868 28.973 32.405 1.00 0.00 ATOM 103 H1 3PTLX 15 21.423 29.530 33.023 1.00 0.00 ATOM 104 C4 3PTLX 15 20.221 28.173 30.286 1.00 0.00 ATOM 105 C5 3PTLX 15 20.998 26.862 30.157 1.00 0.00 ATOM 106 C1 3PTLX 16 12.995 24.165 16.327 1.00 0.00 ATOM 107 C2 3PTLX 16 14.115 23.229 16.786 1.00 0.00 ATOM 108 C3 3PTLX 16 14.922 23.926 17.884 1.00 0.00 ATOM 109 O1 3PTLX 16 14.273 23.902 19.158 1.00 0.00 ATOM 110 H1 3PTLX 16 14.796 24.588 19.664 1.00 0.00 ATOM 111 C4 3PTLX 16 16.366 23.464 18.089 1.00 0.00 ATOM 112 C5 3PTLX 16 17.028 24.669 18.761 1.00 0.00 ATOM 113 C1 3PTLX 17 36.634 33.932 24.761 1.00 0.00 ATOM 114 C2 3PTLX 17 37.528 33.685 25.978 1.00 0.00 ATOM 115 C3 3PTLX 17 36.849 33.470 27.332 1.00 0.00 ATOM 116 O1 3PTLX 17 37.886 33.603 28.308 1.00 0.00 ATOM 117 H1 3PTLX 17 38.607 34.260 28.089 1.00 0.00 ATOM 118 C4 3PTLX 17 35.742 34.508 27.529 1.00 0.00 ATOM 119 C5 3PTLX 17 34.905 34.342 28.799 1.00 0.00 ATOM 120 C1 3PTLX 18 40.670 26.925 14.506 1.00 0.00 ATOM 121 C2 3PTLX 18 40.321 28.195 13.728 1.00 0.00 ATOM 122 C3 3PTLX 18 39.176 29.044 14.285 1.00 0.00 ATOM 123 O1 3PTLX 18 39.197 30.376 13.766 1.00 0.00 ATOM 124 H1 3PTLX 18 38.729 31.000 14.393 1.00 0.00 ATOM 125 C4 3PTLX 18 37.791 28.463 13.990 1.00 0.00 ATOM 126 C5 3PTLX 18 36.702 28.882 14.979 1.00 0.00 ATOM 127 C1 3PTLX 19 9.820 22.994 43.536 1.00 0.00 ATOM 128 C2 3PTLX 19 10.526 21.697 43.136 1.00 0.00 ATOM 129 C3 3PTLX 19 10.246 21.459 41.651 1.00 0.00 ATOM 130 O1 3PTLX 19 11.306 20.635 41.157 1.00 0.00 ATOM 131 H1 3PTLX 19 11.499 19.940 41.850 1.00 0.00 ATOM 132 C4 3PTLX 19 8.990 20.586 41.597 1.00 0.00 ATOM 133 C5 3PTLX 19 8.384 20.636 40.193 1.00 0.00 ATOM 134 C1 3PTLX 20 9.493 34.151 2.699 1.00 0.00 ATOM 135 C2 3PTLX 20 9.576 35.602 3.177 1.00 0.00 ATOM 136 C3 3PTLX 20 9.682 35.692 4.700 1.00 0.00 ATOM 137 O1 3PTLX 20 8.596 35.024 5.347 1.00 0.00 ATOM 138 H1 3PTLX 20 9.010 34.714 6.203 1.00 0.00 ATOM 139 C4 3PTLX 20 11.020 35.256 5.301 1.00 0.00 ATOM 140 C5 3PTLX 20 12.054 36.329 4.956 1.00 0.00 ATOM 141 C1 3PTLX 21 31.907 22.302 15.774 1.00 0.00 ATOM 142 C2 3PTLX 21 32.599 21.157 16.516 1.00 0.00 ATOM 143 C3 3PTLX 21 33.313 20.033 15.762 1.00 0.00 ATOM 144 O1 3PTLX 21 34.234 20.727 14.916 1.00 0.00 ATOM 145 H1 3PTLX 21 34.563 21.587 15.305 1.00 0.00 ATOM 146 C4 3PTLX 21 33.893 18.952 16.676 1.00 0.00 ATOM 147 C5 3PTLX 21 34.194 17.726 15.811 1.00 0.00 ATOM 148 C1 3PTLX 22 3.851 12.456 34.114 1.00 0.00 ATOM 149 C2 3PTLX 22 2.455 12.054 34.592 1.00 0.00 ATOM 150 C3 3PTLX 22 1.472 13.149 35.014 1.00 0.00 ATOM 151 O1 3PTLX 22 2.095 14.023 35.959 1.00 0.00 ATOM 152 H1 3PTLX 22 1.456 14.748 36.214 1.00 0.00 ATOM 153 C4 3PTLX 22 0.919 13.922 33.816 1.00 0.00 ATOM 154 C5 3PTLX 22 -0.174 14.952 34.111 1.00 0.00 ATOM 155 C1 3PTLX 23 16.460 37.088 17.140 1.00 0.00 ATOM 156 C2 3PTLX 23 16.850 38.498 16.693 1.00 0.00 ATOM 157 C3 3PTLX 23 17.957 39.208 17.474 1.00 0.00 ATOM 158 O1 3PTLX 23 19.218 38.536 17.523 1.00 0.00 ATOM 159 H1 3PTLX 23 19.118 37.833 18.227 1.00 0.00 ATOM 160 C4 3PTLX 23 18.088 40.600 16.852 1.00 0.00 ATOM 161 C5 3PTLX 23 18.927 41.596 17.656 1.00 0.00 ATOM 162 C1 3PTLX 24 37.092 4.831 19.154 1.00 0.00 ATOM 163 C2 3PTLX 24 35.788 4.698 18.363 1.00 0.00 ATOM 164 C3 3PTLX 24 36.023 4.907 16.866 1.00 0.00 ATOM 165 O1 3PTLX 24 35.081 4.121 16.132 1.00 0.00 ATOM 166 H1 3PTLX 24 35.260 4.301 15.165 1.00 0.00 ATOM 167 C4 3PTLX 24 35.759 6.365 16.483 1.00 0.00 ATOM 168 C5 3PTLX 24 35.708 6.732 14.999 1.00 0.00 ATOM 169 C1 3PTLX 25 27.197 24.951 2.582 1.00 0.00 ATOM 170 C2 3PTLX 25 28.309 25.679 1.822 1.00 0.00 ATOM 171 C3 3PTLX 25 29.154 24.624 1.105 1.00 0.00 ATOM 172 O1 3PTLX 25 29.782 23.677 1.973 1.00 0.00 ATOM 173 H1 3PTLX 25 29.469 22.749 1.771 1.00 0.00 ATOM 174 C4 3PTLX 25 28.427 23.808 0.034 1.00 0.00 ATOM 175 C5 3PTLX 25 27.889 24.525 -1.206 1.00 0.00 ATOM 176 C1 3PTLX 26 30.937 24.444 31.436 1.00 0.00 ATOM 177 C2 3PTLX 26 29.986 25.429 32.117 1.00 0.00 ATOM 178 C3 3PTLX 26 30.017 25.210 33.631 1.00 0.00 ATOM 179 O1 3PTLX 26 31.341 25.409 34.134 1.00 0.00 ATOM 180 H1 3PTLX 26 31.645 26.303 33.805 1.00 0.00 ATOM 181 C4 3PTLX 26 29.104 26.273 34.244 1.00 0.00 ATOM 182 C5 3PTLX 26 28.775 25.778 35.654 1.00 0.00 ATOM 183 C1 3PTLX 27 34.667 18.143 32.536 1.00 0.00 ATOM 184 C2 3PTLX 27 36.115 17.917 32.976 1.00 0.00 ATOM 185 C3 3PTLX 27 36.945 19.202 33.009 1.00 0.00 ATOM 186 O1 3PTLX 27 37.606 19.567 34.223 1.00 0.00 ATOM 187 H1 3PTLX 27 37.923 20.509 34.117 1.00 0.00 ATOM 188 C4 3PTLX 27 38.049 19.204 31.950 1.00 0.00 ATOM 189 C5 3PTLX 27 37.570 19.352 30.504 1.00 0.00 ATOM 190 C1 3PTLX 28 45.447 21.038 31.418 1.00 0.00 ATOM 191 C2 3PTLX 28 43.944 21.087 31.697 1.00 0.00 ATOM 192 C3 3PTLX 28 43.271 22.205 30.898 1.00 0.00 ATOM 193 O1 3PTLX 28 43.754 22.257 29.553 1.00 0.00 ATOM 194 H1 3PTLX 28 44.655 22.691 29.581 1.00 0.00 ATOM 195 C4 3PTLX 28 41.757 21.984 30.894 1.00 0.00 ATOM 196 C5 3PTLX 28 41.110 23.283 30.410 1.00 0.00 ATOM 197 C1 3PTLX 29 39.484 26.760 6.155 1.00 0.00 ATOM 198 C2 3PTLX 29 39.904 26.115 7.478 1.00 0.00 ATOM 199 C3 3PTLX 29 40.331 24.672 7.201 1.00 0.00 ATOM 200 O1 3PTLX 29 41.560 24.610 6.473 1.00 0.00 ATOM 201 H1 3PTLX 29 41.452 24.657 5.480 1.00 0.00 ATOM 202 C4 3PTLX 29 40.484 23.890 8.506 1.00 0.00 ATOM 203 C5 3PTLX 29 39.091 23.596 9.065 1.00 0.00 ATOM 204 C1 3PTLX 30 26.898 22.244 27.256 1.00 0.00 ATOM 205 C2 3PTLX 30 28.355 21.887 27.560 1.00 0.00 ATOM 206 C3 3PTLX 30 28.562 21.193 28.908 1.00 0.00 ATOM 207 O1 3PTLX 30 27.955 19.899 28.959 1.00 0.00 ATOM 208 H1 3PTLX 30 26.958 19.958 29.006 1.00 0.00 ATOM 209 C4 3PTLX 30 30.046 21.196 29.280 1.00 0.00 ATOM 210 C5 3PTLX 30 30.297 20.483 30.611 1.00 0.00 ATOM 211 C1 3PTLX 31 34.386 22.268 30.823 1.00 0.00 ATOM 212 C2 3PTLX 31 34.633 22.157 29.317 1.00 0.00 ATOM 213 C3 3PTLX 31 34.635 23.543 28.667 1.00 0.00 ATOM 214 O1 3PTLX 31 35.039 23.397 27.304 1.00 0.00 ATOM 215 H1 3PTLX 31 34.534 22.632 26.903 1.00 0.00 ATOM 216 C4 3PTLX 31 33.166 23.972 28.657 1.00 0.00 ATOM 217 C5 3PTLX 31 33.119 25.467 28.335 1.00 0.00 ATOM 218 C1 3PTLX 32 40.537 5.624 31.215 1.00 0.00 ATOM 219 C2 3PTLX 32 41.737 4.708 31.465 1.00 0.00 ATOM 220 C3 3PTLX 32 42.374 4.026 30.252 1.00 0.00 ATOM 221 O1 3PTLX 32 42.905 5.116 29.493 1.00 0.00 ATOM 222 H1 3PTLX 32 42.265 5.444 28.798 1.00 0.00 ATOM 223 C4 3PTLX 32 43.441 3.093 30.827 1.00 0.00 ATOM 224 C5 3PTLX 32 44.243 2.450 29.694 1.00 0.00 ATOM 225 C1 3PTLX 33 41.835 0.778 0.497 1.00 0.00 ATOM 226 C2 3PTLX 33 42.477 1.285 -0.796 1.00 0.00 ATOM 227 C3 3PTLX 33 43.970 0.955 44.799 1.00 0.00 ATOM 228 O1 3PTLX 33 44.629 1.756 43.814 1.00 0.00 ATOM 229 H1 3PTLX 33 44.629 1.437 42.866 1.00 0.00 ATOM 230 C4 3PTLX 33 44.788 1.185 0.442 1.00 0.00 ATOM 231 C5 3PTLX 33 46.221 0.778 0.095 1.00 0.00 ATOM 232 C1 3PTLX 34 22.470 9.237 2.987 1.00 0.00 ATOM 233 C2 3PTLX 34 21.151 9.951 2.687 1.00 0.00 ATOM 234 C3 3PTLX 34 21.099 10.227 1.183 1.00 0.00 ATOM 235 O1 3PTLX 34 20.722 8.981 0.593 1.00 0.00 ATOM 236 H1 3PTLX 34 19.794 8.708 0.848 1.00 0.00 ATOM 237 C4 3PTLX 34 20.127 11.368 0.875 1.00 0.00 ATOM 238 C5 3PTLX 34 19.927 11.492 -0.637 1.00 0.00 ATOM 239 C1 3PTLX 35 37.986 39.372 9.080 1.00 0.00 ATOM 240 C2 3PTLX 35 37.946 38.856 10.519 1.00 0.00 ATOM 241 C3 3PTLX 35 37.722 39.906 11.609 1.00 0.00 ATOM 242 O1 3PTLX 35 36.348 40.302 11.567 1.00 0.00 ATOM 243 H1 3PTLX 35 36.295 41.296 11.478 1.00 0.00 ATOM 244 C4 3PTLX 35 38.005 39.333 12.999 1.00 0.00 ATOM 245 C5 3PTLX 35 39.324 38.626 13.318 1.00 0.00 ATOM 246 C1 3PTLX 36 26.400 3.401 4.565 1.00 0.00 ATOM 247 C2 3PTLX 36 27.827 2.887 4.765 1.00 0.00 ATOM 248 C3 3PTLX 36 28.772 3.224 3.609 1.00 0.00 ATOM 249 O1 3PTLX 36 29.152 4.595 3.462 1.00 0.00 ATOM 250 H1 3PTLX 36 29.944 4.575 2.852 1.00 0.00 ATOM 251 C4 3PTLX 36 29.983 2.290 3.661 1.00 0.00 ATOM 252 C5 3PTLX 36 29.516 0.895 3.241 1.00 0.00 ATOM 253 C1 3PTLX 37 22.018 42.757 3.718 1.00 0.00 ATOM 254 C2 3PTLX 37 20.981 42.740 4.842 1.00 0.00 ATOM 255 C3 3PTLX 37 21.140 44.029 5.652 1.00 0.00 ATOM 256 O1 3PTLX 37 20.644 45.086 4.826 1.00 0.00 ATOM 257 H1 3PTLX 37 20.227 44.692 4.008 1.00 0.00 ATOM 258 C4 3PTLX 37 20.293 43.943 6.923 1.00 0.00 ATOM 259 C5 3PTLX 37 20.070 45.245 7.697 1.00 0.00 ATOM 260 C1 3PTLX 38 19.783 20.053 13.742 1.00 0.00 ATOM 261 C2 3PTLX 38 18.758 20.186 14.870 1.00 0.00 ATOM 262 C3 3PTLX 38 19.312 21.149 15.922 1.00 0.00 ATOM 263 O1 3PTLX 38 20.599 20.782 16.423 1.00 0.00 ATOM 264 H1 3PTLX 38 21.025 21.656 16.658 1.00 0.00 ATOM 265 C4 3PTLX 38 19.277 22.504 15.211 1.00 0.00 ATOM 266 C5 3PTLX 38 19.810 23.740 15.940 1.00 0.00 ATOM 267 C1 3PTLX 39 33.795 3.853 40.156 1.00 0.00 ATOM 268 C2 3PTLX 39 33.230 5.257 40.385 1.00 0.00 ATOM 269 C3 3PTLX 39 34.259 6.350 40.676 1.00 0.00 ATOM 270 O1 3PTLX 39 35.016 5.963 41.826 1.00 0.00 ATOM 271 H1 3PTLX 39 35.457 6.786 42.184 1.00 0.00 ATOM 272 C4 3PTLX 39 35.205 6.668 39.516 1.00 0.00 ATOM 273 C5 3PTLX 39 36.462 7.441 39.919 1.00 0.00 ATOM 274 C1 3PTLX 40 3.493 12.047 5.217 1.00 0.00 ATOM 275 C2 3PTLX 40 3.840 11.507 6.606 1.00 0.00 ATOM 276 C3 3PTLX 40 2.599 11.101 7.404 1.00 0.00 ATOM 277 O1 3PTLX 40 3.133 10.636 8.647 1.00 0.00 ATOM 278 H1 3PTLX 40 3.683 9.812 8.515 1.00 0.00 ATOM 279 C4 3PTLX 40 1.472 12.109 7.636 1.00 0.00 ATOM 280 C5 3PTLX 40 0.276 11.565 8.420 1.00 0.00 ATOM 281 C1 3PTLX 41 30.821 43.206 39.372 1.00 0.00 ATOM 282 C2 3PTLX 41 29.364 42.865 39.053 1.00 0.00 ATOM 283 C3 3PTLX 41 28.311 43.305 40.072 1.00 0.00 ATOM 284 O1 3PTLX 41 28.229 44.732 40.117 1.00 0.00 ATOM 285 H1 3PTLX 41 28.483 45.109 41.008 1.00 0.00 ATOM 286 C4 3PTLX 41 26.999 42.639 39.653 1.00 0.00 ATOM 287 C5 3PTLX 41 26.046 42.559 40.847 1.00 0.00 ATOM 288 C1 3PTLX 42 45.564 25.020 23.039 1.00 0.00 ATOM 289 C2 3PTLX 42 46.324 26.348 23.060 1.00 0.00 ATOM 290 C3 3PTLX 42 45.382 27.527 23.313 1.00 0.00 ATOM 291 O1 3PTLX 42 46.221 28.613 23.718 1.00 0.00 ATOM 292 H1 3PTLX 42 46.834 28.783 22.946 1.00 0.00 ATOM 293 C4 3PTLX 42 44.638 27.888 22.026 1.00 0.00 ATOM 294 C5 3PTLX 42 43.594 29.001 22.145 1.00 0.00 ATOM 295 C1 3PTLX 43 1.072 20.756 21.191 1.00 0.00 ATOM 296 C2 3PTLX 43 2.424 20.989 20.514 1.00 0.00 ATOM 297 C3 3PTLX 43 3.591 20.845 21.493 1.00 0.00 ATOM 298 O1 3PTLX 43 4.396 19.777 20.987 1.00 0.00 ATOM 299 H1 3PTLX 43 4.060 18.928 21.395 1.00 0.00 ATOM 300 C4 3PTLX 43 4.415 22.135 21.489 1.00 0.00 ATOM 301 C5 3PTLX 43 5.389 22.010 22.661 1.00 0.00 ATOM 302 C1 3PTLX 44 35.207 20.060 0.740 1.00 0.00 ATOM 303 C2 3PTLX 44 34.684 21.247 -0.071 1.00 0.00 ATOM 304 C3 3PTLX 44 33.164 21.258 45.385 1.00 0.00 ATOM 305 O1 3PTLX 44 32.545 21.326 46.672 1.00 0.00 ATOM 306 H1 3PTLX 44 32.602 22.228 47.101 1.00 0.00 ATOM 307 C4 3PTLX 44 32.621 22.512 44.696 1.00 0.00 ATOM 308 C5 3PTLX 44 32.820 22.462 43.180 1.00 0.00 ATOM 309 C1 3PTLX 45 13.145 11.669 22.907 1.00 0.00 ATOM 310 C2 3PTLX 45 12.251 12.889 22.681 1.00 0.00 ATOM 311 C3 3PTLX 45 12.955 13.955 21.838 1.00 0.00 ATOM 312 O1 3PTLX 45 13.160 13.500 20.498 1.00 0.00 ATOM 313 H1 3PTLX 45 14.140 13.407 20.325 1.00 0.00 ATOM 314 C4 3PTLX 45 12.247 15.306 21.730 1.00 0.00 ATOM 315 C5 3PTLX 45 12.398 15.965 23.103 1.00 0.00 ATOM 316 C1 3PTLX 46 40.746 29.939 42.393 1.00 0.00 ATOM 317 C2 3PTLX 46 40.863 28.453 42.737 1.00 0.00 ATOM 318 C3 3PTLX 46 39.517 27.728 42.780 1.00 0.00 ATOM 319 O1 3PTLX 46 39.269 27.437 41.401 1.00 0.00 ATOM 320 H1 3PTLX 46 38.338 27.135 41.199 1.00 0.00 ATOM 321 C4 3PTLX 46 39.577 26.393 43.525 1.00 0.00 ATOM 322 C5 3PTLX 46 38.180 25.816 43.762 1.00 0.00 ATOM 323 C1 3PTLX 47 12.827 30.254 26.250 1.00 0.00 ATOM 324 C2 3PTLX 47 14.144 31.006 26.049 1.00 0.00 ATOM 325 C3 3PTLX 47 13.769 32.465 26.314 1.00 0.00 ATOM 326 O1 3PTLX 47 13.646 32.804 27.697 1.00 0.00 ATOM 327 H1 3PTLX 47 12.793 32.352 27.958 1.00 0.00 ATOM 328 C4 3PTLX 47 14.923 33.336 25.813 1.00 0.00 ATOM 329 C5 3PTLX 47 15.291 33.136 24.341 1.00 0.00 ATOM 330 C1 3PTLX 48 42.331 36.151 12.747 1.00 0.00 ATOM 331 C2 3PTLX 48 43.678 36.850 12.945 1.00 0.00 ATOM 332 C3 3PTLX 48 44.688 35.948 13.658 1.00 0.00 ATOM 333 O1 3PTLX 48 45.202 34.857 12.890 1.00 0.00 ATOM 334 H1 3PTLX 48 45.595 34.147 13.475 1.00 0.00 ATOM 335 C4 3PTLX 48 0.200 36.866 14.098 1.00 0.00 ATOM 336 C5 3PTLX 48 0.949 36.327 15.318 1.00 0.00 ATOM 337 C1 3PTLX 49 4.713 28.141 31.050 1.00 0.00 ATOM 338 C2 3PTLX 49 4.522 28.668 32.473 1.00 0.00 ATOM 339 C3 3PTLX 49 3.051 28.867 32.842 1.00 0.00 ATOM 340 O1 3PTLX 49 2.398 27.607 32.663 1.00 0.00 ATOM 341 H1 3PTLX 49 2.625 26.956 33.388 1.00 0.00 ATOM 342 C4 3PTLX 49 2.868 29.275 34.306 1.00 0.00 ATOM 343 C5 3PTLX 49 3.160 30.755 34.564 1.00 0.00 ATOM 344 C1 3PTLX 50 18.148 30.332 26.318 1.00 0.00 ATOM 345 C2 3PTLX 50 18.254 28.974 27.016 1.00 0.00 ATOM 346 C3 3PTLX 50 17.866 27.789 26.130 1.00 0.00 ATOM 347 O1 3PTLX 50 18.935 27.183 25.398 1.00 0.00 ATOM 348 H1 3PTLX 50 18.927 27.569 24.476 1.00 0.00 ATOM 349 C4 3PTLX 50 17.091 26.701 26.876 1.00 0.00 ATOM 350 C5 3PTLX 50 15.859 27.238 27.609 1.00 0.00 ATOM 351 C1 3PTLX 51 44.614 5.927 42.455 1.00 0.00 ATOM 352 C2 3PTLX 51 44.218 5.525 43.877 1.00 0.00 ATOM 353 C3 3PTLX 51 45.424 4.872 44.555 1.00 0.00 ATOM 354 O1 3PTLX 51 46.134 3.933 43.743 1.00 0.00 ATOM 355 H1 3PTLX 51 45.691 3.039 43.804 1.00 0.00 ATOM 356 C4 3PTLX 51 0.703 5.952 45.143 1.00 0.00 ATOM 357 C5 3PTLX 51 1.719 5.254 46.049 1.00 0.00 ATOM 358 C1 3PTLX 52 9.387 13.911 1.164 1.00 0.00 ATOM 359 C2 3PTLX 52 10.591 14.771 1.552 1.00 0.00 ATOM 360 C3 3PTLX 52 11.907 14.080 1.911 1.00 0.00 ATOM 361 O1 3PTLX 52 12.979 15.023 1.983 1.00 0.00 ATOM 362 H1 3PTLX 52 12.651 15.968 1.979 1.00 0.00 ATOM 363 C4 3PTLX 52 11.899 13.223 3.179 1.00 0.00 ATOM 364 C5 3PTLX 52 12.791 12.000 2.957 1.00 0.00 ATOM 365 C1 3PTLX 53 13.622 35.573 40.316 1.00 0.00 ATOM 366 C2 3PTLX 53 13.808 34.484 41.374 1.00 0.00 ATOM 367 C3 3PTLX 53 13.829 33.063 40.806 1.00 0.00 ATOM 368 O1 3PTLX 53 15.092 33.047 40.136 1.00 0.00 ATOM 369 H1 3PTLX 53 15.689 32.393 40.602 1.00 0.00 ATOM 370 C4 3PTLX 53 13.755 32.166 42.043 1.00 0.00 ATOM 371 C5 3PTLX 53 12.657 32.456 43.068 1.00 0.00 ATOM 372 C1 3PTLX 54 15.508 37.582 28.880 1.00 0.00 ATOM 373 C2 3PTLX 54 16.246 38.428 29.919 1.00 0.00 ATOM 374 C3 3PTLX 54 15.382 38.945 31.071 1.00 0.00 ATOM 375 O1 3PTLX 54 14.220 39.614 30.576 1.00 0.00 ATOM 376 H1 3PTLX 54 14.417 39.983 29.668 1.00 0.00 ATOM 377 C4 3PTLX 54 14.894 37.828 31.996 1.00 0.00 ATOM 378 C5 3PTLX 54 16.013 37.104 32.747 1.00 0.00 ATOM 379 C1 3PTLX 55 9.050 40.375 2.029 1.00 0.00 ATOM 380 C2 3PTLX 55 8.907 41.886 1.830 1.00 0.00 ATOM 381 C3 3PTLX 55 8.536 42.395 0.436 1.00 0.00 ATOM 382 O1 3PTLX 55 9.404 41.800 -0.533 1.00 0.00 ATOM 383 H1 3PTLX 55 9.374 42.411 -1.324 1.00 0.00 ATOM 384 C4 3PTLX 55 7.108 41.915 0.170 1.00 0.00 ATOM 385 C5 3PTLX 55 5.933 42.552 0.914 1.00 0.00 ATOM 386 C1 3PTLX 56 13.976 44.575 25.166 1.00 0.00 ATOM 387 C2 3PTLX 56 15.177 44.927 24.285 1.00 0.00 ATOM 388 C3 3PTLX 56 15.287 43.992 23.079 1.00 0.00 ATOM 389 O1 3PTLX 56 14.134 43.967 22.233 1.00 0.00 ATOM 390 H1 3PTLX 56 13.811 43.024 22.150 1.00 0.00 ATOM 391 C4 3PTLX 56 16.474 44.415 22.211 1.00 0.00 ATOM 392 C5 3PTLX 56 17.874 44.361 22.827 1.00 0.00 ATOM 393 C1 3PTLX 57 35.035 32.982 21.092 1.00 0.00 ATOM 394 C2 3PTLX 57 35.023 31.462 21.270 1.00 0.00 ATOM 395 C3 3PTLX 57 35.915 30.660 20.319 1.00 0.00 ATOM 396 O1 3PTLX 57 37.318 30.900 20.454 1.00 0.00 ATOM 397 H1 3PTLX 57 37.678 30.686 21.362 1.00 0.00 ATOM 398 C4 3PTLX 57 35.783 29.191 20.727 1.00 0.00 ATOM 399 C5 3PTLX 57 36.342 28.053 19.870 1.00 0.00 ATOM 400 C1 3PTLX 58 7.093 36.764 26.231 1.00 0.00 ATOM 401 C2 3PTLX 58 8.446 37.320 25.783 1.00 0.00 ATOM 402 C3 3PTLX 58 9.575 36.388 25.339 1.00 0.00 ATOM 403 O1 3PTLX 58 9.157 35.880 24.070 1.00 0.00 ATOM 404 H1 3PTLX 58 8.656 35.015 24.101 1.00 0.00 ATOM 405 C4 3PTLX 58 10.890 37.140 25.126 1.00 0.00 ATOM 406 C5 3PTLX 58 12.088 36.283 24.712 1.00 0.00 ATOM 407 C1 3PTLX 59 19.026 30.539 12.349 1.00 0.00 ATOM 408 C2 3PTLX 59 19.835 29.624 13.270 1.00 0.00 ATOM 409 C3 3PTLX 59 18.865 28.635 13.920 1.00 0.00 ATOM 410 O1 3PTLX 59 18.439 27.727 12.900 1.00 0.00 ATOM 411 H1 3PTLX 59 17.521 27.363 13.057 1.00 0.00 ATOM 412 C4 3PTLX 59 19.653 27.864 14.981 1.00 0.00 ATOM 413 C5 3PTLX 59 18.743 26.987 15.842 1.00 0.00 ATOM 414 C1 3PTLX 60 17.392 0.802 41.720 1.00 0.00 ATOM 415 C2 3PTLX 60 16.460 -0.119 40.928 1.00 0.00 ATOM 416 C3 3PTLX 60 16.224 44.187 41.657 1.00 0.00 ATOM 417 O1 3PTLX 60 15.180 43.472 40.991 1.00 0.00 ATOM 418 H1 3PTLX 60 15.619 43.001 40.225 1.00 0.00 ATOM 419 C4 3PTLX 60 17.393 43.274 42.032 1.00 0.00 ATOM 420 C5 3PTLX 60 18.024 42.477 40.888 1.00 0.00 ATOM 421 C1 3PTLX 61 24.702 27.952 28.584 1.00 0.00 ATOM 422 C2 3PTLX 61 25.775 28.831 27.940 1.00 0.00 ATOM 423 C3 3PTLX 61 26.825 27.931 27.285 1.00 0.00 ATOM 424 O1 3PTLX 61 27.501 28.826 26.397 1.00 0.00 ATOM 425 H1 3PTLX 61 27.913 28.380 25.602 1.00 0.00 ATOM 426 C4 3PTLX 61 27.811 27.491 28.368 1.00 0.00 ATOM 427 C5 3PTLX 61 28.694 26.347 27.865 1.00 0.00 ATOM 428 C1 3PTLX 62 41.451 42.434 40.368 1.00 0.00 ATOM 429 C2 3PTLX 62 40.504 43.634 40.422 1.00 0.00 ATOM 430 C3 3PTLX 62 41.320 44.928 40.470 1.00 0.00 ATOM 431 O1 3PTLX 62 42.020 45.165 39.246 1.00 0.00 ATOM 432 H1 3PTLX 62 41.425 45.152 38.443 1.00 0.00 ATOM 433 C4 3PTLX 62 40.331 0.425 40.774 1.00 0.00 ATOM 434 C5 3PTLX 62 41.011 1.634 41.420 1.00 0.00 ATOM 435 C1 3PTLX 63 42.225 33.791 25.077 1.00 0.00 ATOM 436 C2 3PTLX 63 41.357 33.053 26.097 1.00 0.00 ATOM 437 C3 3PTLX 63 42.053 33.324 27.432 1.00 0.00 ATOM 438 O1 3PTLX 63 41.500 34.545 27.929 1.00 0.00 ATOM 439 H1 3PTLX 63 41.787 34.696 28.875 1.00 0.00 ATOM 440 C4 3PTLX 63 41.863 32.227 28.481 1.00 0.00 ATOM 441 C5 3PTLX 63 42.834 31.065 28.263 1.00 0.00 ATOM 442 C1 3PTLX 64 12.048 9.654 14.949 1.00 0.00 ATOM 443 C2 3PTLX 64 12.450 11.102 15.235 1.00 0.00 ATOM 444 C3 3PTLX 64 13.428 11.106 16.413 1.00 0.00 ATOM 445 O1 3PTLX 64 13.770 12.480 16.611 1.00 0.00 ATOM 446 H1 3PTLX 64 12.999 13.044 16.908 1.00 0.00 ATOM 447 C4 3PTLX 64 12.708 10.712 17.704 1.00 0.00 ATOM 448 C5 3PTLX 64 13.608 10.197 18.829 1.00 0.00 ATOM 449 C1 3PTLX 65 28.106 39.369 3.374 1.00 0.00 ATOM 450 C2 3PTLX 65 28.344 37.911 3.773 1.00 0.00 ATOM 451 C3 3PTLX 65 28.424 37.784 5.296 1.00 0.00 ATOM 452 O1 3PTLX 65 27.130 38.010 5.862 1.00 0.00 ATOM 453 H1 3PTLX 65 27.272 37.887 6.844 1.00 0.00 ATOM 454 C4 3PTLX 65 29.014 36.427 5.682 1.00 0.00 ATOM 455 C5 3PTLX 65 29.695 36.538 7.048 1.00 0.00 ATOM 456 C1 3PTLX 66 8.341 13.560 7.518 1.00 0.00 ATOM 457 C2 3PTLX 66 7.207 13.825 8.509 1.00 0.00 ATOM 458 C3 3PTLX 66 7.106 12.858 9.690 1.00 0.00 ATOM 459 O1 3PTLX 66 6.119 13.356 10.598 1.00 0.00 ATOM 460 H1 3PTLX 66 5.445 12.625 10.700 1.00 0.00 ATOM 461 C4 3PTLX 66 6.824 11.399 9.327 1.00 0.00 ATOM 462 C5 3PTLX 66 7.029 10.438 10.499 1.00 0.00 ATOM 463 C1 3PTLX 67 18.410 41.343 45.545 1.00 0.00 ATOM 464 C2 3PTLX 67 18.609 42.697 46.228 1.00 0.00 ATOM 465 C3 3PTLX 67 18.010 42.689 2.006 1.00 0.00 ATOM 466 O1 3PTLX 67 18.656 43.755 2.706 1.00 0.00 ATOM 467 H1 3PTLX 67 18.063 44.560 2.691 1.00 0.00 ATOM 468 C4 3PTLX 67 16.488 42.848 2.037 1.00 0.00 ATOM 469 C5 3PTLX 67 15.954 42.413 3.403 1.00 0.00 ATOM 470 C1 3PTLX 68 32.127 12.415 38.675 1.00 0.00 ATOM 471 C2 3PTLX 68 31.790 13.872 38.351 1.00 0.00 ATOM 472 C3 3PTLX 68 30.580 14.210 39.225 1.00 0.00 ATOM 473 O1 3PTLX 68 30.869 15.414 39.940 1.00 0.00 ATOM 474 H1 3PTLX 68 30.670 16.230 39.398 1.00 0.00 ATOM 475 C4 3PTLX 68 29.326 14.403 38.370 1.00 0.00 ATOM 476 C5 3PTLX 68 28.146 14.724 39.289 1.00 0.00 ATOM 477 C1 3PTLX 69 1.708 34.190 29.758 1.00 0.00 ATOM 478 C2 3PTLX 69 2.967 33.395 30.106 1.00 0.00 ATOM 479 C3 3PTLX 69 4.080 34.418 30.340 1.00 0.00 ATOM 480 O1 3PTLX 69 3.904 35.223 31.509 1.00 0.00 ATOM 481 H1 3PTLX 69 2.965 35.131 31.841 1.00 0.00 ATOM 482 C4 3PTLX 69 5.495 33.860 30.167 1.00 0.00 ATOM 483 C5 3PTLX 69 5.820 33.230 28.811 1.00 0.00 ATOM 484 C1 3PTLX 70 31.591 39.365 38.571 1.00 0.00 ATOM 485 C2 3PTLX 70 32.413 38.270 39.254 1.00 0.00 ATOM 486 C3 3PTLX 70 32.533 36.940 38.509 1.00 0.00 ATOM 487 O1 3PTLX 70 33.440 37.205 37.435 1.00 0.00 ATOM 488 H1 3PTLX 70 33.076 36.775 36.609 1.00 0.00 ATOM 489 C4 3PTLX 70 32.825 35.814 39.503 1.00 0.00 ATOM 490 C5 3PTLX 70 32.612 34.462 38.819 1.00 0.00 ATOM 491 C1 3PTLX 71 23.943 34.530 3.826 1.00 0.00 ATOM 492 C2 3PTLX 71 23.391 34.305 5.235 1.00 0.00 ATOM 493 C3 3PTLX 71 22.103 33.481 5.282 1.00 0.00 ATOM 494 O1 3PTLX 71 22.335 32.099 4.997 1.00 0.00 ATOM 495 H1 3PTLX 71 22.968 31.821 5.719 1.00 0.00 ATOM 496 C4 3PTLX 71 21.526 33.569 6.697 1.00 0.00 ATOM 497 C5 3PTLX 71 20.309 32.720 7.068 1.00 0.00 ATOM 498 C1 3PTLX 72 4.147 3.992 4.447 1.00 0.00 ATOM 499 C2 3PTLX 72 3.067 5.004 4.059 1.00 0.00 ATOM 500 C3 3PTLX 72 2.872 6.070 5.139 1.00 0.00 ATOM 501 O1 3PTLX 72 3.945 7.014 5.095 1.00 0.00 ATOM 502 H1 3PTLX 72 3.956 7.423 4.183 1.00 0.00 ATOM 503 C4 3PTLX 72 1.546 6.765 4.823 1.00 0.00 ATOM 504 C5 3PTLX 72 1.318 7.939 5.778 1.00 0.00 ATOM 505 C1 3PTLX 73 18.901 32.379 17.410 1.00 0.00 ATOM 506 C2 3PTLX 73 19.632 32.750 16.118 1.00 0.00 ATOM 507 C3 3PTLX 73 20.639 33.887 16.302 1.00 0.00 ATOM 508 O1 3PTLX 73 19.914 35.088 16.578 1.00 0.00 ATOM 509 H1 3PTLX 73 19.800 35.612 15.734 1.00 0.00 ATOM 510 C4 3PTLX 73 21.585 33.794 17.501 1.00 0.00 ATOM 511 C5 3PTLX 73 22.520 32.586 17.425 1.00 0.00 ATOM 512 C1 3PTLX 74 38.390 36.514 30.537 1.00 0.00 ATOM 513 C2 3PTLX 74 38.345 37.477 29.350 1.00 0.00 ATOM 514 C3 3PTLX 74 39.473 37.191 28.356 1.00 0.00 ATOM 515 O1 3PTLX 74 39.315 35.836 27.928 1.00 0.00 ATOM 516 H1 3PTLX 74 40.235 35.458 27.823 1.00 0.00 ATOM 517 C4 3PTLX 74 39.412 38.226 27.231 1.00 0.00 ATOM 518 C5 3PTLX 74 40.613 37.926 26.332 1.00 0.00 ATOM 519 C1 3PTLX 75 22.028 44.769 40.260 1.00 0.00 ATOM 520 C2 3PTLX 75 23.052 45.906 40.254 1.00 0.00 ATOM 521 C3 3PTLX 75 23.559 0.767 41.611 1.00 0.00 ATOM 522 O1 3PTLX 75 24.616 -0.081 42.067 1.00 0.00 ATOM 523 H1 3PTLX 75 25.339 -0.166 41.381 1.00 0.00 ATOM 524 C4 3PTLX 75 23.870 2.246 41.377 1.00 0.00 ATOM 525 C5 3PTLX 75 24.680 2.944 42.472 1.00 0.00 ATOM 526 C1 3PTLX 76 3.168 7.756 14.791 1.00 0.00 ATOM 527 C2 3PTLX 76 3.120 6.982 16.110 1.00 0.00 ATOM 528 C3 3PTLX 76 4.393 6.142 16.228 1.00 0.00 ATOM 529 O1 3PTLX 76 5.562 6.948 16.391 1.00 0.00 ATOM 530 H1 3PTLX 76 6.353 6.339 16.321 1.00 0.00 ATOM 531 C4 3PTLX 76 4.202 5.243 17.451 1.00 0.00 ATOM 532 C5 3PTLX 76 3.158 4.143 17.250 1.00 0.00 ATOM 533 C1 3PTLX 77 40.642 3.939 21.092 1.00 0.00 ATOM 534 C2 3PTLX 77 40.586 2.465 21.498 1.00 0.00 ATOM 535 C3 3PTLX 77 41.116 2.174 22.903 1.00 0.00 ATOM 536 O1 3PTLX 77 41.021 0.787 23.238 1.00 0.00 ATOM 537 H1 3PTLX 77 41.389 0.218 22.502 1.00 0.00 ATOM 538 C4 3PTLX 77 42.530 2.679 23.195 1.00 0.00 ATOM 539 C5 3PTLX 77 43.709 2.160 22.370 1.00 0.00 ATOM 540 C1 3PTLX 78 35.766 33.535 41.144 1.00 0.00 ATOM 541 C2 3PTLX 78 36.265 33.354 39.709 1.00 0.00 ATOM 542 C3 3PTLX 78 37.377 34.376 39.462 1.00 0.00 ATOM 543 O1 3PTLX 78 38.614 34.101 40.126 1.00 0.00 ATOM 544 H1 3PTLX 78 39.370 34.299 39.501 1.00 0.00 ATOM 545 C4 3PTLX 78 37.566 34.474 37.947 1.00 0.00 ATOM 546 C5 3PTLX 78 36.366 34.894 37.095 1.00 0.00 ATOM 547 C1 3PTLX 79 34.369 30.643 16.844 1.00 0.00 ATOM 548 C2 3PTLX 79 34.147 32.129 16.554 1.00 0.00 ATOM 549 C3 3PTLX 79 34.111 32.598 15.098 1.00 0.00 ATOM 550 O1 3PTLX 79 35.241 32.141 14.351 1.00 0.00 ATOM 551 H1 3PTLX 79 35.106 32.080 13.362 1.00 0.00 ATOM 552 C4 3PTLX 79 32.805 32.210 14.400 1.00 0.00 ATOM 553 C5 3PTLX 79 32.807 32.538 12.906 1.00 0.00 ATOM 554 C1 3PTLX 80 32.815 30.973 39.906 1.00 0.00 ATOM 555 C2 3PTLX 80 32.037 29.773 40.450 1.00 0.00 ATOM 556 C3 3PTLX 80 31.306 28.938 39.396 1.00 0.00 ATOM 557 O1 3PTLX 80 32.309 28.579 38.442 1.00 0.00 ATOM 558 H1 3PTLX 80 32.145 27.642 38.135 1.00 0.00 ATOM 559 C4 3PTLX 80 30.674 27.674 39.983 1.00 0.00 ATOM 560 C5 3PTLX 80 29.769 26.896 39.025 1.00 0.00 ATOM 561 C1 3PTLX 81 2.963 21.094 25.859 1.00 0.00 ATOM 562 C2 3PTLX 81 3.148 20.093 27.001 1.00 0.00 ATOM 563 C3 3PTLX 81 3.136 20.650 28.426 1.00 0.00 ATOM 564 O1 3PTLX 81 1.843 21.094 28.848 1.00 0.00 ATOM 565 H1 3PTLX 81 1.228 20.307 28.884 1.00 0.00 ATOM 566 C4 3PTLX 81 3.677 19.479 29.247 1.00 0.00 ATOM 567 C5 3PTLX 81 4.134 20.046 30.593 1.00 0.00 ATOM 568 C1 3PTLX 82 42.227 1.528 11.670 1.00 0.00 ATOM 569 C2 3PTLX 82 43.004 0.889 12.823 1.00 0.00 ATOM 570 C3 3PTLX 82 42.135 0.905 14.082 1.00 0.00 ATOM 571 O1 3PTLX 82 42.897 0.263 15.108 1.00 0.00 ATOM 572 H1 3PTLX 82 42.349 -0.400 15.619 1.00 0.00 ATOM 573 C4 3PTLX 82 41.611 2.301 14.425 1.00 0.00 ATOM 574 C5 3PTLX 82 40.529 2.447 15.496 1.00 0.00 ATOM 575 C1 3PTLX 83 7.586 37.596 7.597 1.00 0.00 ATOM 576 C2 3PTLX 83 7.461 37.947 9.081 1.00 0.00 ATOM 577 C3 3PTLX 83 5.995 37.992 9.518 1.00 0.00 ATOM 578 O1 3PTLX 83 6.104 38.122 10.938 1.00 0.00 ATOM 579 H1 3PTLX 83 6.730 38.867 11.169 1.00 0.00 ATOM 580 C4 3PTLX 83 5.235 39.128 8.829 1.00 0.00 ATOM 581 C5 3PTLX 83 3.767 38.699 8.799 1.00 0.00 ATOM 582 C1 3PTLX 84 45.363 24.599 35.289 1.00 0.00 ATOM 583 C2 3PTLX 84 46.711 25.006 34.690 1.00 0.00 ATOM 584 C3 3PTLX 84 2.242 25.116 35.681 1.00 0.00 ATOM 585 O1 3PTLX 84 3.343 25.479 34.843 1.00 0.00 ATOM 586 H1 3PTLX 84 4.147 25.051 35.255 1.00 0.00 ATOM 587 C4 3PTLX 84 2.004 26.262 36.666 1.00 0.00 ATOM 588 C5 3PTLX 84 3.101 26.279 37.733 1.00 0.00 ATOM 589 C1 3PTLX 85 8.650 3.289 21.222 1.00 0.00 ATOM 590 C2 3PTLX 85 8.583 4.675 20.580 1.00 0.00 ATOM 591 C3 3PTLX 85 7.232 5.067 19.978 1.00 0.00 ATOM 592 O1 3PTLX 85 6.154 4.965 20.913 1.00 0.00 ATOM 593 H1 3PTLX 85 6.405 5.401 21.777 1.00 0.00 ATOM 594 C4 3PTLX 85 7.268 6.490 19.415 1.00 0.00 ATOM 595 C5 3PTLX 85 8.237 6.502 18.231 1.00 0.00 ATOM 596 C1 3PTLX 86 11.649 41.632 16.728 1.00 0.00 ATOM 597 C2 3PTLX 86 12.194 43.043 16.961 1.00 0.00 ATOM 598 C3 3PTLX 86 13.252 43.063 18.066 1.00 0.00 ATOM 599 O1 3PTLX 86 12.743 42.479 19.269 1.00 0.00 ATOM 600 H1 3PTLX 86 12.305 43.177 19.835 1.00 0.00 ATOM 601 C4 3PTLX 86 14.470 42.337 17.493 1.00 0.00 ATOM 602 C5 3PTLX 86 15.048 43.031 16.258 1.00 0.00 ATOM 603 C1 3PTLX 87 24.832 35.851 24.882 1.00 0.00 ATOM 604 C2 3PTLX 87 23.482 35.415 24.307 1.00 0.00 ATOM 605 C3 3PTLX 87 22.509 34.935 25.386 1.00 0.00 ATOM 606 O1 3PTLX 87 22.332 36.051 26.262 1.00 0.00 ATOM 607 H1 3PTLX 87 23.054 35.961 26.948 1.00 0.00 ATOM 608 C4 3PTLX 87 21.254 34.341 24.743 1.00 0.00 ATOM 609 C5 3PTLX 87 20.231 33.990 25.825 1.00 0.00 ATOM 610 C1 3PTLX 88 6.990 3.264 25.056 1.00 0.00 ATOM 611 C2 3PTLX 88 5.946 4.376 25.171 1.00 0.00 ATOM 612 C3 3PTLX 88 6.643 5.651 24.692 1.00 0.00 ATOM 613 O1 3PTLX 88 7.238 5.538 23.396 1.00 0.00 ATOM 614 H1 3PTLX 88 7.850 6.313 23.240 1.00 0.00 ATOM 615 C4 3PTLX 88 5.616 6.783 24.745 1.00 0.00 ATOM 616 C5 3PTLX 88 5.936 7.694 25.932 1.00 0.00 ATOM 617 C1 3PTLX 89 5.993 19.065 16.136 1.00 0.00 ATOM 618 C2 3PTLX 89 5.187 18.453 17.284 1.00 0.00 ATOM 619 C3 3PTLX 89 6.141 17.809 18.292 1.00 0.00 ATOM 620 O1 3PTLX 89 6.519 18.837 19.212 1.00 0.00 ATOM 621 H1 3PTLX 89 5.683 19.321 19.471 1.00 0.00 ATOM 622 C4 3PTLX 89 5.345 16.640 18.876 1.00 0.00 ATOM 623 C5 3PTLX 89 6.147 15.661 19.736 1.00 0.00 ATOM 624 C1 3PTLX 90 36.822 43.368 5.927 1.00 0.00 ATOM 625 C2 3PTLX 90 37.724 43.311 7.162 1.00 0.00 ATOM 626 C3 3PTLX 90 37.247 44.232 8.287 1.00 0.00 ATOM 627 O1 3PTLX 90 36.039 43.887 8.969 1.00 0.00 ATOM 628 H1 3PTLX 90 35.259 44.038 8.361 1.00 0.00 ATOM 629 C4 3PTLX 90 38.184 44.531 9.459 1.00 0.00 ATOM 630 C5 3PTLX 90 39.476 45.208 8.997 1.00 0.00 ATOM 631 C1 3PTLX 91 20.527 39.765 35.915 1.00 0.00 ATOM 632 C2 3PTLX 91 20.347 40.583 37.195 1.00 0.00 ATOM 633 C3 3PTLX 91 21.521 40.283 38.129 1.00 0.00 ATOM 634 O1 3PTLX 91 22.699 40.854 37.552 1.00 0.00 ATOM 635 H1 3PTLX 91 23.498 40.259 37.638 1.00 0.00 ATOM 636 C4 3PTLX 91 21.300 41.044 39.438 1.00 0.00 ATOM 637 C5 3PTLX 91 22.203 40.604 40.592 1.00 0.00 ATOM 638 C1 3PTLX 92 17.659 24.408 7.132 1.00 0.00 ATOM 639 C2 3PTLX 92 18.754 24.932 6.200 1.00 0.00 ATOM 640 C3 3PTLX 92 18.510 24.545 4.740 1.00 0.00 ATOM 641 O1 3PTLX 92 17.248 24.925 4.186 1.00 0.00 ATOM 642 H1 3PTLX 92 16.682 24.101 4.214 1.00 0.00 ATOM 643 C4 3PTLX 92 19.693 25.095 3.941 1.00 0.00 ATOM 644 C5 3PTLX 92 19.921 24.298 2.654 1.00 0.00 ATOM 645 C1 3PTLX 93 9.779 39.770 27.980 1.00 0.00 ATOM 646 C2 3PTLX 93 10.115 40.981 27.108 1.00 0.00 ATOM 647 C3 3PTLX 93 10.338 42.343 27.768 1.00 0.00 ATOM 648 O1 3PTLX 93 11.466 42.196 28.635 1.00 0.00 ATOM 649 H1 3PTLX 93 11.247 41.971 29.585 1.00 0.00 ATOM 650 C4 3PTLX 93 10.408 43.435 26.699 1.00 0.00 ATOM 651 C5 3PTLX 93 10.440 44.851 27.279 1.00 0.00 ATOM 652 C1 3PTLX 94 39.603 5.865 14.740 1.00 0.00 ATOM 653 C2 3PTLX 94 40.551 7.065 14.701 1.00 0.00 ATOM 654 C3 3PTLX 94 39.851 8.401 14.444 1.00 0.00 ATOM 655 O1 3PTLX 94 40.821 9.452 14.487 1.00 0.00 ATOM 656 H1 3PTLX 94 41.372 9.365 15.317 1.00 0.00 ATOM 657 C4 3PTLX 94 39.147 8.622 13.104 1.00 0.00 ATOM 658 C5 3PTLX 94 39.872 8.292 11.797 1.00 0.00 ATOM 659 C1 3PTLX 95 6.089 36.981 38.223 1.00 0.00 ATOM 660 C2 3PTLX 95 6.852 37.647 39.369 1.00 0.00 ATOM 661 C3 3PTLX 95 6.408 39.111 39.387 1.00 0.00 ATOM 662 O1 3PTLX 95 5.146 39.314 40.027 1.00 0.00 ATOM 663 H1 3PTLX 95 4.761 40.233 39.943 1.00 0.00 ATOM 664 C4 3PTLX 95 7.426 40.086 39.982 1.00 0.00 ATOM 665 C5 3PTLX 95 7.512 39.944 41.503 1.00 0.00 ATOM 666 C1 3PTLX 96 9.151 27.118 16.856 1.00 0.00 ATOM 667 C2 3PTLX 96 9.324 25.809 16.083 1.00 0.00 ATOM 668 C3 3PTLX 96 8.022 25.023 15.914 1.00 0.00 ATOM 669 O1 3PTLX 96 7.829 24.584 14.567 1.00 0.00 ATOM 670 H1 3PTLX 96 6.966 24.967 14.237 1.00 0.00 ATOM 671 C4 3PTLX 96 7.939 23.940 16.991 1.00 0.00 ATOM 672 C5 3PTLX 96 6.798 22.943 16.778 1.00 0.00 ATOM 673 C1 3PTLX 97 26.414 7.345 26.602 1.00 0.00 ATOM 674 C2 3PTLX 97 25.210 7.800 25.775 1.00 0.00 ATOM 675 C3 3PTLX 97 24.489 9.076 26.215 1.00 0.00 ATOM 676 O1 3PTLX 97 23.753 8.785 27.406 1.00 0.00 ATOM 677 H1 3PTLX 97 22.828 8.477 27.182 1.00 0.00 ATOM 678 C4 3PTLX 97 25.332 10.315 26.527 1.00 0.00 ATOM 679 C5 3PTLX 97 25.533 11.239 25.324 1.00 0.00 ATOM 680 C1 3PTLX 98 11.378 45.453 38.848 1.00 0.00 ATOM 681 C2 3PTLX 98 11.478 44.602 37.579 1.00 0.00 ATOM 682 C3 3PTLX 98 11.453 43.113 37.929 1.00 0.00 ATOM 683 O1 3PTLX 98 12.354 42.708 38.964 1.00 0.00 ATOM 684 H1 3PTLX 98 11.913 42.874 39.847 1.00 0.00 ATOM 685 C4 3PTLX 98 10.069 42.629 38.364 1.00 0.00 ATOM 686 C5 3PTLX 98 9.039 42.415 37.253 1.00 0.00 ATOM 687 C1 3PTLX 99 21.309 7.421 23.772 1.00 0.00 ATOM 688 C2 3PTLX 99 21.610 6.599 22.517 1.00 0.00 ATOM 689 C3 3PTLX 99 21.976 7.337 21.228 1.00 0.00 ATOM 690 O1 3PTLX 99 23.026 6.647 20.545 1.00 0.00 ATOM 691 H1 3PTLX 99 22.857 5.691 20.784 1.00 0.00 ATOM 692 C4 3PTLX 99 20.710 7.406 20.372 1.00 0.00 ATOM 693 C5 3PTLX 99 20.964 8.146 19.057 1.00 0.00 ATOM 694 C1 3PTLX 100 39.049 21.177 44.790 1.00 0.00 ATOM 695 C2 3PTLX 100 38.687 19.733 44.439 1.00 0.00 ATOM 696 C3 3PTLX 100 38.989 18.734 45.558 1.00 0.00 ATOM 697 O1 3PTLX 100 38.473 17.444 45.217 1.00 0.00 ATOM 698 H1 3PTLX 100 39.117 17.000 44.594 1.00 0.00 ATOM 699 C4 3PTLX 100 40.492 18.597 0.178 1.00 0.00 ATOM 700 C5 3PTLX 100 40.892 17.438 1.094 1.00 0.00 ATOM 701 C1 3PTLX 101 8.437 29.683 29.726 1.00 0.00 ATOM 702 C2 3PTLX 101 9.863 29.689 29.170 1.00 0.00 ATOM 703 C3 3PTLX 101 10.433 31.109 29.156 1.00 0.00 ATOM 704 O1 3PTLX 101 11.840 31.117 28.900 1.00 0.00 ATOM 705 H1 3PTLX 101 12.289 30.611 29.636 1.00 0.00 ATOM 706 C4 3PTLX 101 9.724 31.956 28.098 1.00 0.00 ATOM 707 C5 3PTLX 101 10.286 33.372 27.959 1.00 0.00 ATOM 708 C1 3PTLX 102 5.465 44.993 23.052 1.00 0.00 ATOM 709 C2 3PTLX 102 5.411 43.475 23.233 1.00 0.00 ATOM 710 C3 3PTLX 102 5.698 43.138 24.698 1.00 0.00 ATOM 711 O1 3PTLX 102 4.558 43.440 25.507 1.00 0.00 ATOM 712 H1 3PTLX 102 4.207 42.572 25.856 1.00 0.00 ATOM 713 C4 3PTLX 102 6.097 41.668 24.846 1.00 0.00 ATOM 714 C5 3PTLX 102 7.364 41.258 24.092 1.00 0.00 ATOM 715 C1 3PTLX 103 25.620 31.148 2.305 1.00 0.00 ATOM 716 C2 3PTLX 103 26.110 32.281 1.401 1.00 0.00 ATOM 717 C3 3PTLX 103 27.564 32.730 1.560 1.00 0.00 ATOM 718 O1 3PTLX 103 27.787 33.565 0.421 1.00 0.00 ATOM 719 H1 3PTLX 103 26.889 33.876 0.110 1.00 0.00 ATOM 720 C4 3PTLX 103 27.628 33.640 2.788 1.00 0.00 ATOM 721 C5 3PTLX 103 29.071 34.148 2.761 1.00 0.00 ATOM 722 C1 3PTLX 104 30.396 38.205 42.422 1.00 0.00 ATOM 723 C2 3PTLX 104 29.613 36.892 42.452 1.00 0.00 ATOM 724 C3 3PTLX 104 28.411 36.778 43.393 1.00 0.00 ATOM 725 O1 3PTLX 104 27.507 35.787 42.899 1.00 0.00 ATOM 726 H1 3PTLX 104 27.919 35.334 42.107 1.00 0.00 ATOM 727 C4 3PTLX 104 28.820 36.502 44.841 1.00 0.00 ATOM 728 C5 3PTLX 104 27.957 37.119 45.943 1.00 0.00 ATOM 729 C1 3PTLX 105 32.719 12.527 43.595 1.00 0.00 ATOM 730 C2 3PTLX 105 32.279 13.644 42.647 1.00 0.00 ATOM 731 C3 3PTLX 105 31.177 14.502 43.273 1.00 0.00 ATOM 732 O1 3PTLX 105 30.871 15.703 42.561 1.00 0.00 ATOM 733 H1 3PTLX 105 30.956 15.618 41.568 1.00 0.00 ATOM 734 C4 3PTLX 105 29.895 13.668 43.318 1.00 0.00 ATOM 735 C5 3PTLX 105 28.958 14.187 44.410 1.00 0.00 ATOM 736 C1 3PTLX 106 44.751 33.431 34.952 1.00 0.00 ATOM 737 C2 3PTLX 106 45.311 34.338 33.854 1.00 0.00 ATOM 738 C3 3PTLX 106 1.191 34.536 34.011 1.00 0.00 ATOM 739 O1 3PTLX 106 1.527 35.267 32.828 1.00 0.00 ATOM 740 H1 3PTLX 106 1.365 36.225 33.064 1.00 0.00 ATOM 741 C4 3PTLX 106 1.666 35.295 35.251 1.00 0.00 ATOM 742 C5 3PTLX 106 3.195 35.334 35.230 1.00 0.00 ATOM 743 C1 3PTLX 107 7.204 31.687 16.181 1.00 0.00 ATOM 744 C2 3PTLX 107 7.950 30.637 15.356 1.00 0.00 ATOM 745 C3 3PTLX 107 9.391 31.117 15.164 1.00 0.00 ATOM 746 O1 3PTLX 107 10.151 31.444 16.331 1.00 0.00 ATOM 747 H1 3PTLX 107 10.182 32.443 16.355 1.00 0.00 ATOM 748 C4 3PTLX 107 10.194 30.231 14.211 1.00 0.00 ATOM 749 C5 3PTLX 107 9.742 30.388 12.758 1.00 0.00 ATOM 750 C1 3PTLX 108 26.793 17.253 15.362 1.00 0.00 ATOM 751 C2 3PTLX 108 27.584 17.852 16.527 1.00 0.00 ATOM 752 C3 3PTLX 108 26.984 17.634 17.917 1.00 0.00 ATOM 753 O1 3PTLX 108 27.031 16.228 18.174 1.00 0.00 ATOM 754 H1 3PTLX 108 27.841 15.884 17.700 1.00 0.00 ATOM 755 C4 3PTLX 108 27.848 18.430 18.898 1.00 0.00 ATOM 756 C5 3PTLX 108 27.354 18.340 20.344 1.00 0.00 ATOM 757 C1 3PTLX 109 44.361 31.185 41.901 1.00 0.00 ATOM 758 C2 3PTLX 109 44.570 31.661 40.462 1.00 0.00 ATOM 759 C3 3PTLX 109 43.193 31.873 39.831 1.00 0.00 ATOM 760 O1 3PTLX 109 42.835 33.248 39.990 1.00 0.00 ATOM 761 H1 3PTLX 109 42.065 33.393 40.611 1.00 0.00 ATOM 762 C4 3PTLX 109 43.433 31.667 38.334 1.00 0.00 ATOM 763 C5 3PTLX 109 42.211 31.862 37.434 1.00 0.00 ATOM 764 C1 3PTLX 110 23.839 12.884 42.275 1.00 0.00 ATOM 765 C2 3PTLX 110 23.434 14.267 42.788 1.00 0.00 ATOM 766 C3 3PTLX 110 24.115 15.352 41.952 1.00 0.00 ATOM 767 O1 3PTLX 110 23.238 15.690 40.875 1.00 0.00 ATOM 768 H1 3PTLX 110 22.341 15.782 41.308 1.00 0.00 ATOM 769 C4 3PTLX 110 24.648 16.505 42.805 1.00 0.00 ATOM 770 C5 3PTLX 110 23.711 17.682 43.080 1.00 0.00 ATOM 771 C1 3PTLX 111 40.863 16.537 40.847 1.00 0.00 ATOM 772 C2 3PTLX 111 39.780 15.630 41.434 1.00 0.00 ATOM 773 C3 3PTLX 111 40.115 14.818 42.687 1.00 0.00 ATOM 774 O1 3PTLX 111 39.921 15.610 43.862 1.00 0.00 ATOM 775 H1 3PTLX 111 40.321 15.143 44.651 1.00 0.00 ATOM 776 C4 3PTLX 111 39.297 13.530 42.802 1.00 0.00 ATOM 777 C5 3PTLX 111 37.801 13.853 42.785 1.00 0.00 ATOM 778 C1 3PTLX 112 43.349 0.822 26.417 1.00 0.00 ATOM 779 C2 3PTLX 112 43.112 -0.618 25.958 1.00 0.00 ATOM 780 C3 3PTLX 112 41.718 44.447 26.240 1.00 0.00 ATOM 781 O1 3PTLX 112 40.650 45.233 25.703 1.00 0.00 ATOM 782 H1 3PTLX 112 40.839 45.570 24.780 1.00 0.00 ATOM 783 C4 3PTLX 112 41.557 43.042 25.656 1.00 0.00 ATOM 784 C5 3PTLX 112 42.748 42.089 25.775 1.00 0.00 ATOM 785 C1 3PTLX 113 26.745 43.191 15.651 1.00 0.00 ATOM 786 C2 3PTLX 113 26.364 43.589 17.079 1.00 0.00 ATOM 787 C3 3PTLX 113 25.969 45.052 17.290 1.00 0.00 ATOM 788 O1 3PTLX 113 25.102 45.214 18.415 1.00 0.00 ATOM 789 H1 3PTLX 113 25.697 45.138 19.215 1.00 0.00 ATOM 790 C4 3PTLX 113 27.142 0.332 17.660 1.00 0.00 ATOM 791 C5 3PTLX 113 26.742 1.808 17.621 1.00 0.00 ATOM 792 C1 3PTLX 114 36.454 14.858 30.041 1.00 0.00 ATOM 793 C2 3PTLX 114 36.462 14.205 31.425 1.00 0.00 ATOM 794 C3 3PTLX 114 37.455 13.044 31.506 1.00 0.00 ATOM 795 O1 3PTLX 114 37.996 13.172 32.823 1.00 0.00 ATOM 796 H1 3PTLX 114 37.225 13.112 33.456 1.00 0.00 ATOM 797 C4 3PTLX 114 36.586 11.792 31.369 1.00 0.00 ATOM 798 C5 3PTLX 114 37.454 10.534 31.302 1.00 0.00 ATOM 799 C1 3PTLX 115 39.502 9.281 39.419 1.00 0.00 ATOM 800 C2 3PTLX 115 40.814 10.020 39.149 1.00 0.00 ATOM 801 C3 3PTLX 115 41.730 9.757 40.346 1.00 0.00 ATOM 802 O1 3PTLX 115 42.380 8.492 40.203 1.00 0.00 ATOM 803 H1 3PTLX 115 43.116 8.575 39.531 1.00 0.00 ATOM 804 C4 3PTLX 115 42.715 10.924 40.447 1.00 0.00 ATOM 805 C5 3PTLX 115 43.004 11.363 41.884 1.00 0.00 ATOM 806 C1 3PTLX 116 8.494 11.291 15.324 1.00 0.00 ATOM 807 C2 3PTLX 116 8.190 10.530 16.615 1.00 0.00 ATOM 808 C3 3PTLX 116 6.715 10.703 16.984 1.00 0.00 ATOM 809 O1 3PTLX 116 6.558 9.870 18.136 1.00 0.00 ATOM 810 H1 3PTLX 116 6.144 9.040 17.763 1.00 0.00 ATOM 811 C4 3PTLX 116 6.162 12.088 17.325 1.00 0.00 ATOM 812 C5 3PTLX 116 4.690 12.008 17.735 1.00 0.00 ATOM 813 C1 3PTLX 117 23.368 29.036 40.724 1.00 0.00 ATOM 814 C2 3PTLX 117 24.561 29.201 41.667 1.00 0.00 ATOM 815 C3 3PTLX 117 24.596 28.394 42.967 1.00 0.00 ATOM 816 O1 3PTLX 117 24.500 27.005 42.642 1.00 0.00 ATOM 817 H1 3PTLX 117 24.091 26.372 43.300 1.00 0.00 ATOM 818 C4 3PTLX 117 25.935 28.651 43.662 1.00 0.00 ATOM 819 C5 3PTLX 117 25.747 28.386 45.157 1.00 0.00 ATOM 820 C1 3PTLX 118 44.317 37.304 24.041 1.00 0.00 ATOM 821 C2 3PTLX 118 45.607 36.698 23.483 1.00 0.00 ATOM 822 C3 3PTLX 118 1.193 37.601 23.266 1.00 0.00 ATOM 823 O1 3PTLX 118 0.930 38.580 22.258 1.00 0.00 ATOM 824 H1 3PTLX 118 0.351 38.066 21.626 1.00 0.00 ATOM 825 C4 3PTLX 118 1.736 38.246 24.543 1.00 0.00 ATOM 826 C5 3PTLX 118 2.612 37.234 25.284 1.00 0.00 ATOM 827 C1 3PTLX 119 7.840 1.111 10.437 1.00 0.00 ATOM 828 C2 3PTLX 119 7.883 0.694 8.966 1.00 0.00 ATOM 829 C3 3PTLX 119 6.632 0.806 8.092 1.00 0.00 ATOM 830 O1 3PTLX 119 7.037 0.476 6.761 1.00 0.00 ATOM 831 H1 3PTLX 119 7.402 -0.455 6.791 1.00 0.00 ATOM 832 C4 3PTLX 119 5.560 45.475 8.611 1.00 0.00 ATOM 833 C5 3PTLX 119 4.167 45.816 8.079 1.00 0.00 ATOM 834 C1 3PTLX 120 11.453 9.167 30.978 1.00 0.00 ATOM 835 C2 3PTLX 120 11.105 8.933 29.507 1.00 0.00 ATOM 836 C3 3PTLX 120 9.596 9.069 29.297 1.00 0.00 ATOM 837 O1 3PTLX 120 9.269 10.460 29.236 1.00 0.00 ATOM 838 H1 3PTLX 120 9.082 10.834 30.144 1.00 0.00 ATOM 839 C4 3PTLX 120 9.142 8.432 27.982 1.00 0.00 ATOM 840 C5 3PTLX 120 8.926 6.918 28.009 1.00 0.00 ATOM 841 C1 3PTLX 121 36.767 0.906 22.664 1.00 0.00 ATOM 842 C2 3PTLX 121 36.669 0.102 21.366 1.00 0.00 ATOM 843 C3 3PTLX 121 37.994 44.966 21.394 1.00 0.00 ATOM 844 O1 3PTLX 121 38.055 43.802 22.222 1.00 0.00 ATOM 845 H1 3PTLX 121 38.220 44.189 23.129 1.00 0.00 ATOM 846 C4 3PTLX 121 38.479 44.578 19.996 1.00 0.00 ATOM 847 C5 3PTLX 121 38.684 45.869 19.202 1.00 0.00 ATOM 848 C1 3PTLX 122 40.358 36.330 22.489 1.00 0.00 ATOM 849 C2 3PTLX 122 39.209 35.362 22.778 1.00 0.00 ATOM 850 C3 3PTLX 122 38.701 34.657 21.519 1.00 0.00 ATOM 851 O1 3PTLX 122 37.999 33.474 21.908 1.00 0.00 ATOM 852 H1 3PTLX 122 37.901 32.832 21.148 1.00 0.00 ATOM 853 C4 3PTLX 122 37.910 35.547 20.558 1.00 0.00 ATOM 854 C5 3PTLX 122 37.599 34.822 19.246 1.00 0.00 ATOM 855 C1 3PTLX 123 12.490 0.211 2.432 1.00 0.00 ATOM 856 C2 3PTLX 123 11.343 -0.393 3.245 1.00 0.00 ATOM 857 C3 3PTLX 123 11.376 45.415 4.764 1.00 0.00 ATOM 858 O1 3PTLX 123 10.048 45.292 5.282 1.00 0.00 ATOM 859 H1 3PTLX 123 9.349 45.757 4.737 1.00 0.00 ATOM 860 C4 3PTLX 123 12.284 44.347 5.377 1.00 0.00 ATOM 861 C5 3PTLX 123 12.239 44.338 6.906 1.00 0.00 ATOM 862 C1 3PTLX 124 39.999 21.890 3.793 1.00 0.00 ATOM 863 C2 3PTLX 124 40.860 21.052 4.740 1.00 0.00 ATOM 864 C3 3PTLX 124 42.317 21.105 4.276 1.00 0.00 ATOM 865 O1 3PTLX 124 42.894 22.413 4.243 1.00 0.00 ATOM 866 H1 3PTLX 124 43.408 22.645 5.069 1.00 0.00 ATOM 867 C4 3PTLX 124 43.336 20.236 5.016 1.00 0.00 ATOM 868 C5 3PTLX 124 42.997 18.767 4.758 1.00 0.00 ATOM 869 C1 3PTLX 125 15.317 23.038 23.427 1.00 0.00 ATOM 870 C2 3PTLX 125 16.340 24.157 23.216 1.00 0.00 ATOM 871 C3 3PTLX 125 15.714 25.413 22.606 1.00 0.00 ATOM 872 O1 3PTLX 125 15.033 25.041 21.404 1.00 0.00 ATOM 873 H1 3PTLX 125 14.050 24.865 21.454 1.00 0.00 ATOM 874 C4 3PTLX 125 14.739 26.004 23.626 1.00 0.00 ATOM 875 C5 3PTLX 125 14.342 27.440 23.276 1.00 0.00 ATOM 876 C1 3PTLX 126 5.179 0.093 3.700 1.00 0.00 ATOM 877 C2 3PTLX 126 6.262 0.204 2.624 1.00 0.00 ATOM 878 C3 3PTLX 126 7.383 1.236 2.764 1.00 0.00 ATOM 879 O1 3PTLX 126 8.017 0.764 3.956 1.00 0.00 ATOM 880 H1 3PTLX 126 7.567 1.116 4.776 1.00 0.00 ATOM 881 C4 3PTLX 126 8.233 1.014 1.512 1.00 0.00 ATOM 882 C5 3PTLX 126 9.243 2.155 1.373 1.00 0.00 ATOM 883 C1 3PTLX 127 7.832 16.277 43.914 1.00 0.00 ATOM 884 C2 3PTLX 127 9.063 16.689 43.105 1.00 0.00 ATOM 885 C3 3PTLX 127 8.970 16.235 41.648 1.00 0.00 ATOM 886 O1 3PTLX 127 10.273 16.618 41.197 1.00 0.00 ATOM 887 H1 3PTLX 127 10.264 16.736 40.204 1.00 0.00 ATOM 888 C4 3PTLX 127 8.872 14.708 41.630 1.00 0.00 ATOM 889 C5 3PTLX 127 8.958 14.179 40.197 1.00 0.00 ATOM 890 C1 3PTLX 128 11.888 36.611 29.124 1.00 0.00 ATOM 891 C2 3PTLX 128 10.700 36.772 30.075 1.00 0.00 ATOM 892 C3 3PTLX 128 11.129 37.556 31.316 1.00 0.00 ATOM 893 O1 3PTLX 128 11.503 38.935 31.249 1.00 0.00 ATOM 894 H1 3PTLX 128 12.432 38.984 30.883 1.00 0.00 ATOM 895 C4 3PTLX 128 10.127 37.143 32.396 1.00 0.00 ATOM 896 C5 3PTLX 128 10.864 37.155 33.737 1.00 0.00 ATOM 897 C1 3PTLX 129 18.906 17.745 34.901 1.00 0.00 ATOM 898 C2 3PTLX 129 20.076 17.479 33.951 1.00 0.00 ATOM 899 C3 3PTLX 129 20.541 18.840 33.429 1.00 0.00 ATOM 900 O1 3PTLX 129 19.495 19.604 32.822 1.00 0.00 ATOM 901 H1 3PTLX 129 19.054 20.029 33.612 1.00 0.00 ATOM 902 C4 3PTLX 129 21.341 19.645 34.455 1.00 0.00 ATOM 903 C5 3PTLX 129 21.806 20.977 33.861 1.00 0.00 ATOM 904 C1 3PTLX 130 1.883 35.962 9.957 1.00 0.00 ATOM 905 C2 3PTLX 130 0.526 36.258 9.317 1.00 0.00 ATOM 906 C3 3PTLX 130 45.223 35.054 9.171 1.00 0.00 ATOM 907 O1 3PTLX 130 45.284 34.221 10.332 1.00 0.00 ATOM 908 H1 3PTLX 130 45.066 34.728 11.166 1.00 0.00 ATOM 909 C4 3PTLX 130 43.769 35.416 8.862 1.00 0.00 ATOM 910 C5 3PTLX 130 43.726 36.016 7.455 1.00 0.00 ATOM 911 C1 3PTLX 131 37.145 35.468 14.387 1.00 0.00 ATOM 912 C2 3PTLX 131 38.506 34.958 14.867 1.00 0.00 ATOM 913 C3 3PTLX 131 38.343 33.568 15.485 1.00 0.00 ATOM 914 O1 3PTLX 131 37.823 32.593 14.577 1.00 0.00 ATOM 915 H1 3PTLX 131 36.866 32.810 14.387 1.00 0.00 ATOM 916 C4 3PTLX 131 39.643 32.980 16.036 1.00 0.00 ATOM 917 C5 3PTLX 131 40.411 33.952 16.936 1.00 0.00 ATOM 918 C1 3PTLX 132 42.295 36.746 18.788 1.00 0.00 ATOM 919 C2 3PTLX 132 43.215 35.640 19.307 1.00 0.00 ATOM 920 C3 3PTLX 132 44.705 35.932 19.115 1.00 0.00 ATOM 921 O1 3PTLX 132 45.004 37.143 19.814 1.00 0.00 ATOM 922 H1 3PTLX 132 45.153 37.817 19.091 1.00 0.00 ATOM 923 C4 3PTLX 132 45.508 34.782 19.726 1.00 0.00 ATOM 924 C5 3PTLX 132 47.009 35.072 19.692 1.00 0.00 ATOM 925 C1 3PTLX 133 22.158 2.180 18.906 1.00 0.00 ATOM 926 C2 3PTLX 133 22.077 2.208 20.433 1.00 0.00 ATOM 927 C3 3PTLX 133 23.338 2.701 21.146 1.00 0.00 ATOM 928 O1 3PTLX 133 23.527 4.073 20.792 1.00 0.00 ATOM 929 H1 3PTLX 133 24.490 4.339 20.744 1.00 0.00 ATOM 930 C4 3PTLX 133 23.234 2.397 22.642 1.00 0.00 ATOM 931 C5 3PTLX 133 24.350 3.054 23.458 1.00 0.00 ATOM 932 C1 3PTLX 134 23.768 21.293 37.438 1.00 0.00 ATOM 933 C2 3PTLX 134 23.234 21.086 38.857 1.00 0.00 ATOM 934 C3 3PTLX 134 23.296 19.754 39.607 1.00 0.00 ATOM 935 O1 3PTLX 134 22.136 19.029 39.191 1.00 0.00 ATOM 936 H1 3PTLX 134 22.217 18.077 38.898 1.00 0.00 ATOM 937 C4 3PTLX 134 24.535 18.902 39.329 1.00 0.00 ATOM 938 C5 3PTLX 134 25.749 19.504 40.040 1.00 0.00 ATOM 939 C1 3PTLX 135 5.089 41.889 29.960 1.00 0.00 ATOM 940 C2 3PTLX 135 3.561 41.805 29.971 1.00 0.00 ATOM 941 C3 3PTLX 135 2.918 41.159 28.742 1.00 0.00 ATOM 942 O1 3PTLX 135 3.270 41.946 27.602 1.00 0.00 ATOM 943 H1 3PTLX 135 3.544 42.853 27.921 1.00 0.00 ATOM 944 C4 3PTLX 135 3.296 39.690 28.537 1.00 0.00 ATOM 945 C5 3PTLX 135 2.552 38.794 29.529 1.00 0.00 ATOM 946 C1 3PTLX 136 1.905 10.946 38.405 1.00 0.00 ATOM 947 C2 3PTLX 136 0.506 10.342 38.272 1.00 0.00 ATOM 948 C3 3PTLX 136 0.525 8.815 38.181 1.00 0.00 ATOM 949 O1 3PTLX 136 -0.845 8.468 38.401 1.00 0.00 ATOM 950 H1 3PTLX 136 -1.091 7.759 37.740 1.00 0.00 ATOM 951 C4 3PTLX 136 0.918 8.413 36.758 1.00 0.00 ATOM 952 C5 3PTLX 136 1.304 6.934 36.705 1.00 0.00 ATOM 953 C1 3PTLX 137 0.552 18.472 38.967 1.00 0.00 ATOM 954 C2 3PTLX 137 0.513 17.007 39.408 1.00 0.00 ATOM 955 C3 3PTLX 137 45.302 16.132 38.477 1.00 0.00 ATOM 956 O1 3PTLX 137 45.965 15.816 37.251 1.00 0.00 ATOM 957 H1 3PTLX 137 46.082 16.549 36.581 1.00 0.00 ATOM 958 C4 3PTLX 137 45.117 14.924 39.398 1.00 0.00 ATOM 959 C5 3PTLX 137 44.510 13.733 38.655 1.00 0.00 ATOM 960 C1 3PTLX 138 7.063 7.483 44.545 1.00 0.00 ATOM 961 C2 3PTLX 138 7.469 6.021 44.351 1.00 0.00 ATOM 962 C3 3PTLX 138 7.732 5.820 42.857 1.00 0.00 ATOM 963 O1 3PTLX 138 8.748 6.651 42.290 1.00 0.00 ATOM 964 H1 3PTLX 138 8.562 6.803 41.319 1.00 0.00 ATOM 965 C4 3PTLX 138 8.050 4.335 42.668 1.00 0.00 ATOM 966 C5 3PTLX 138 8.036 3.540 41.361 1.00 0.00 ATOM 967 C1 3PTLX 139 40.579 28.675 25.123 1.00 0.00 ATOM 968 C2 3PTLX 139 39.969 29.310 23.871 1.00 0.00 ATOM 969 C3 3PTLX 139 38.703 30.153 24.033 1.00 0.00 ATOM 970 O1 3PTLX 139 38.421 30.764 22.771 1.00 0.00 ATOM 971 H1 3PTLX 139 38.461 31.743 22.972 1.00 0.00 ATOM 972 C4 3PTLX 139 37.613 29.248 24.611 1.00 0.00 ATOM 973 C5 3PTLX 139 36.369 29.998 25.093 1.00 0.00 ATOM 974 C1 3PTLX 140 4.865 20.262 42.699 1.00 0.00 ATOM 975 C2 3PTLX 140 5.351 21.243 43.768 1.00 0.00 ATOM 976 C3 3PTLX 140 4.459 22.475 43.610 1.00 0.00 ATOM 977 O1 3PTLX 140 3.115 22.098 43.922 1.00 0.00 ATOM 978 H1 3PTLX 140 2.454 22.844 43.844 1.00 0.00 ATOM 979 C4 3PTLX 140 4.926 23.531 44.613 1.00 0.00 ATOM 980 C5 3PTLX 140 6.352 23.978 44.281 1.00 0.00 ATOM 981 C1 3PTLX 141 38.952 18.574 12.707 1.00 0.00 ATOM 982 C2 3PTLX 141 37.985 18.345 13.870 1.00 0.00 ATOM 983 C3 3PTLX 141 38.469 17.306 14.884 1.00 0.00 ATOM 984 O1 3PTLX 141 38.797 16.096 14.195 1.00 0.00 ATOM 985 H1 3PTLX 141 38.215 15.362 14.545 1.00 0.00 ATOM 986 C4 3PTLX 141 39.642 17.689 15.789 1.00 0.00 ATOM 987 C5 3PTLX 141 39.451 18.797 16.826 1.00 0.00 ATOM 988 C1 3PTLX 142 10.224 9.432 20.804 1.00 0.00 ATOM 989 C2 3PTLX 142 10.550 8.327 21.811 1.00 0.00 ATOM 990 C3 3PTLX 142 9.533 8.392 22.952 1.00 0.00 ATOM 991 O1 3PTLX 142 8.408 7.617 22.526 1.00 0.00 ATOM 992 H1 3PTLX 142 8.022 8.150 21.774 1.00 0.00 ATOM 993 C4 3PTLX 142 10.030 7.822 24.282 1.00 0.00 ATOM 994 C5 3PTLX 142 11.200 8.621 24.861 1.00 0.00 ATOM 995 C1 3PTLX 143 42.567 21.522 37.687 1.00 0.00 ATOM 996 C2 3PTLX 143 41.798 20.229 37.970 1.00 0.00 ATOM 997 C3 3PTLX 143 40.309 20.569 37.889 1.00 0.00 ATOM 998 O1 3PTLX 143 39.937 20.614 36.508 1.00 0.00 ATOM 999 H1 3PTLX 143 40.262 19.790 36.044 1.00 0.00 ATOM 1000 C4 3PTLX 143 39.431 19.518 38.571 1.00 0.00 ATOM 1001 C5 3PTLX 143 39.546 19.525 40.097 1.00 0.00 ATOM 1002 C1 3PTLX 144 15.625 14.890 36.946 1.00 0.00 ATOM 1003 C2 3PTLX 144 15.897 14.802 35.443 1.00 0.00 ATOM 1004 C3 3PTLX 144 17.032 13.808 35.188 1.00 0.00 ATOM 1005 O1 3PTLX 144 16.560 12.469 35.357 1.00 0.00 ATOM 1006 H1 3PTLX 144 15.821 12.335 36.017 1.00 0.00 ATOM 1007 C4 3PTLX 144 17.520 13.882 33.740 1.00 0.00 ATOM 1008 C5 3PTLX 144 18.560 12.805 33.425 1.00 0.00 ATOM 1009 C1 3PTLX 145 43.333 35.672 37.332 1.00 0.00 ATOM 1010 C2 3PTLX 145 41.996 36.411 37.244 1.00 0.00 ATOM 1011 C3 3PTLX 145 41.205 36.181 38.534 1.00 0.00 ATOM 1012 O1 3PTLX 145 40.952 34.838 38.955 1.00 0.00 ATOM 1013 H1 3PTLX 145 41.861 34.434 38.853 1.00 0.00 ATOM 1014 C4 3PTLX 145 41.913 37.020 39.599 1.00 0.00 ATOM 1015 C5 3PTLX 145 41.517 38.496 39.681 1.00 0.00 ATOM 1016 C1 3PTLX 146 28.288 23.411 14.073 1.00 0.00 ATOM 1017 C2 3PTLX 146 28.029 23.898 15.499 1.00 0.00 ATOM 1018 C3 3PTLX 146 29.020 24.983 15.926 1.00 0.00 ATOM 1019 O1 3PTLX 146 28.739 26.289 15.415 1.00 0.00 ATOM 1020 H1 3PTLX 146 28.964 26.253 14.442 1.00 0.00 ATOM 1021 C4 3PTLX 146 28.888 25.175 17.439 1.00 0.00 ATOM 1022 C5 3PTLX 146 29.489 24.017 18.237 1.00 0.00 ATOM 1023 C1 3PTLX 147 16.643 34.775 20.128 1.00 0.00 ATOM 1024 C2 3PTLX 147 17.438 35.843 20.883 1.00 0.00 ATOM 1025 C3 3PTLX 147 18.859 35.905 20.320 1.00 0.00 ATOM 1026 O1 3PTLX 147 19.000 36.400 18.986 1.00 0.00 ATOM 1027 H1 3PTLX 147 19.536 35.734 18.468 1.00 0.00 ATOM 1028 C4 3PTLX 147 19.706 36.676 21.335 1.00 0.00 ATOM 1029 C5 3PTLX 147 21.170 36.441 20.956 1.00 0.00 ATOM 1030 C1 3PTLX 148 9.870 23.619 23.019 1.00 0.00 ATOM 1031 C2 3PTLX 148 9.821 24.695 21.933 1.00 0.00 ATOM 1032 C3 3PTLX 148 11.163 25.377 21.656 1.00 0.00 ATOM 1033 O1 3PTLX 148 12.181 24.399 21.426 1.00 0.00 ATOM 1034 H1 3PTLX 148 11.788 23.801 20.727 1.00 0.00 ATOM 1035 C4 3PTLX 148 11.020 26.261 20.416 1.00 0.00 ATOM 1036 C5 3PTLX 148 10.268 27.563 20.696 1.00 0.00 ATOM 1037 C1 3PTLX 149 1.342 20.468 35.948 1.00 0.00 ATOM 1038 C2 3PTLX 149 1.069 19.397 34.891 1.00 0.00 ATOM 1039 C3 3PTLX 149 2.229 18.403 34.807 1.00 0.00 ATOM 1040 O1 3PTLX 149 2.098 17.289 35.694 1.00 0.00 ATOM 1041 H1 3PTLX 149 2.984 16.855 35.860 1.00 0.00 ATOM 1042 C4 3PTLX 149 2.492 17.937 33.374 1.00 0.00 ATOM 1043 C5 3PTLX 149 3.569 16.894 33.067 1.00 0.00 ATOM 1044 C1 3PTLX 150 16.878 14.091 40.281 1.00 0.00 ATOM 1045 C2 3PTLX 150 17.774 15.315 40.480 1.00 0.00 ATOM 1046 C3 3PTLX 150 19.234 14.872 40.371 1.00 0.00 ATOM 1047 O1 3PTLX 150 19.997 16.077 40.474 1.00 0.00 ATOM 1048 H1 3PTLX 150 19.862 16.702 39.706 1.00 0.00 ATOM 1049 C4 3PTLX 150 19.694 13.964 41.514 1.00 0.00 ATOM 1050 C5 3PTLX 150 19.296 14.229 42.967 1.00 0.00 ATOM 1051 C1 3PTLX 151 43.464 21.782 19.663 1.00 0.00 ATOM 1052 C2 3PTLX 151 42.911 23.196 19.854 1.00 0.00 ATOM 1053 C3 3PTLX 151 42.198 23.702 18.598 1.00 0.00 ATOM 1054 O1 3PTLX 151 43.004 23.870 17.428 1.00 0.00 ATOM 1055 H1 3PTLX 151 43.956 24.068 17.664 1.00 0.00 ATOM 1056 C4 3PTLX 151 40.889 22.982 18.269 1.00 0.00 ATOM 1057 C5 3PTLX 151 39.928 23.431 19.372 1.00 0.00 ATOM 1058 C1 3PTLX 152 2.318 39.334 17.033 1.00 0.00 ATOM 1059 C2 3PTLX 152 1.942 40.676 17.665 1.00 0.00 ATOM 1060 C3 3PTLX 152 2.079 40.743 19.188 1.00 0.00 ATOM 1061 O1 3PTLX 152 1.220 39.780 19.805 1.00 0.00 ATOM 1062 H1 3PTLX 152 1.483 39.533 20.737 1.00 0.00 ATOM 1063 C4 3PTLX 152 3.473 40.516 19.776 1.00 0.00 ATOM 1064 C5 3PTLX 152 3.511 40.514 21.306 1.00 0.00 ATOM 1065 C1 3PTLX 153 17.113 8.074 32.056 1.00 0.00 ATOM 1066 C2 3PTLX 153 17.766 6.772 32.524 1.00 0.00 ATOM 1067 C3 3PTLX 153 16.628 5.864 32.994 1.00 0.00 ATOM 1068 O1 3PTLX 153 17.297 4.666 33.399 1.00 0.00 ATOM 1069 H1 3PTLX 153 17.673 4.195 32.601 1.00 0.00 ATOM 1070 C4 3PTLX 153 15.858 6.493 34.157 1.00 0.00 ATOM 1071 C5 3PTLX 153 14.632 5.623 34.443 1.00 0.00 ATOM 1072 C1 3PTLX 154 22.932 38.503 7.217 1.00 0.00 ATOM 1073 C2 3PTLX 154 23.608 37.782 6.049 1.00 0.00 ATOM 1074 C3 3PTLX 154 23.989 38.826 4.997 1.00 0.00 ATOM 1075 O1 3PTLX 154 25.155 39.551 5.395 1.00 0.00 ATOM 1076 H1 3PTLX 154 25.929 38.943 5.571 1.00 0.00 ATOM 1077 C4 3PTLX 154 24.112 38.163 3.624 1.00 0.00 ATOM 1078 C5 3PTLX 154 24.138 39.219 2.518 1.00 0.00 ATOM 1079 C1 3PTLX 155 12.941 36.131 17.864 1.00 0.00 ATOM 1080 C2 3PTLX 155 12.148 36.201 16.557 1.00 0.00 ATOM 1081 C3 3PTLX 155 12.044 34.848 15.850 1.00 0.00 ATOM 1082 O1 3PTLX 155 11.168 33.973 16.567 1.00 0.00 ATOM 1083 H1 3PTLX 155 11.362 33.894 17.545 1.00 0.00 ATOM 1084 C4 3PTLX 155 11.586 35.178 14.428 1.00 0.00 ATOM 1085 C5 3PTLX 155 11.911 33.976 13.539 1.00 0.00 ATOM 1086 C1 3PTLX 156 28.507 1.041 21.858 1.00 0.00 ATOM 1087 C2 3PTLX 156 28.257 -0.461 21.707 1.00 0.00 ATOM 1088 C3 3PTLX 156 26.791 44.893 22.046 1.00 0.00 ATOM 1089 O1 3PTLX 156 25.995 45.263 20.917 1.00 0.00 ATOM 1090 H1 3PTLX 156 25.054 45.407 21.225 1.00 0.00 ATOM 1091 C4 3PTLX 156 26.543 43.400 22.275 1.00 0.00 ATOM 1092 C5 3PTLX 156 27.189 42.959 23.589 1.00 0.00 ATOM 1093 C1 3PTLX 157 2.132 3.084 36.425 1.00 0.00 ATOM 1094 C2 3PTLX 157 2.504 1.682 35.939 1.00 0.00 ATOM 1095 C3 3PTLX 157 2.761 1.483 34.444 1.00 0.00 ATOM 1096 O1 3PTLX 157 4.021 1.905 33.917 1.00 0.00 ATOM 1097 H1 3PTLX 157 4.747 1.285 34.216 1.00 0.00 ATOM 1098 C4 3PTLX 157 2.502 0.019 34.082 1.00 0.00 ATOM 1099 C5 3PTLX 157 3.456 -0.943 34.793 1.00 0.00 ATOM 1100 C1 3PTLX 158 21.774 41.317 9.857 1.00 0.00 ATOM 1101 C2 3PTLX 158 23.153 41.975 9.933 1.00 0.00 ATOM 1102 C3 3PTLX 158 24.315 41.027 10.236 1.00 0.00 ATOM 1103 O1 3PTLX 158 24.942 40.373 9.130 1.00 0.00 ATOM 1104 H1 3PTLX 158 25.448 40.999 8.537 1.00 0.00 ATOM 1105 C4 3PTLX 158 25.413 41.687 11.074 1.00 0.00 ATOM 1106 C5 3PTLX 158 25.111 41.919 12.556 1.00 0.00 ATOM 1107 C1 3PTLX 159 22.280 29.825 26.360 1.00 0.00 ATOM 1108 C2 3PTLX 159 22.257 30.730 25.127 1.00 0.00 ATOM 1109 C3 3PTLX 159 22.905 30.038 23.926 1.00 0.00 ATOM 1110 O1 3PTLX 159 22.125 28.879 23.618 1.00 0.00 ATOM 1111 H1 3PTLX 159 22.253 28.216 24.356 1.00 0.00 ATOM 1112 C4 3PTLX 159 22.913 30.988 22.727 1.00 0.00 ATOM 1113 C5 3PTLX 159 24.059 30.844 21.723 1.00 0.00 ATOM 1114 C1 3PTLX 160 23.597 20.102 18.562 1.00 0.00 ATOM 1115 C2 3PTLX 160 24.451 21.370 18.505 1.00 0.00 ATOM 1116 C3 3PTLX 160 23.723 22.594 17.946 1.00 0.00 ATOM 1117 O1 3PTLX 160 22.864 22.354 16.828 1.00 0.00 ATOM 1118 H1 3PTLX 160 23.455 21.881 16.174 1.00 0.00 ATOM 1119 C4 3PTLX 160 23.074 23.461 19.027 1.00 0.00 ATOM 1120 C5 3PTLX 160 24.298 24.087 19.698 1.00 0.00 ATOM 1121 C1 3PTLX 161 43.359 30.989 15.077 1.00 0.00 ATOM 1122 C2 3PTLX 161 44.421 31.584 16.004 1.00 0.00 ATOM 1123 C3 3PTLX 161 0.118 31.668 15.246 1.00 0.00 ATOM 1124 O1 3PTLX 161 -0.003 32.649 14.213 1.00 0.00 ATOM 1125 H1 3PTLX 161 0.293 32.205 13.367 1.00 0.00 ATOM 1126 C4 3PTLX 161 1.221 32.106 16.212 1.00 0.00 ATOM 1127 C5 3PTLX 161 2.152 30.985 16.678 1.00 0.00 ATOM 1128 C1 3PTLX 162 23.152 10.959 7.011 1.00 0.00 ATOM 1129 C2 3PTLX 162 21.809 11.666 6.818 1.00 0.00 ATOM 1130 C3 3PTLX 162 20.581 11.025 7.468 1.00 0.00 ATOM 1131 O1 3PTLX 162 20.486 11.272 8.873 1.00 0.00 ATOM 1132 H1 3PTLX 162 20.679 10.400 9.322 1.00 0.00 ATOM 1133 C4 3PTLX 162 19.324 11.606 6.818 1.00 0.00 ATOM 1134 C5 3PTLX 162 18.820 12.960 7.321 1.00 0.00 ATOM 1135 C1 3PTLX 163 30.627 0.538 16.129 1.00 0.00 ATOM 1136 C2 3PTLX 163 31.570 1.008 17.238 1.00 0.00 ATOM 1137 C3 3PTLX 163 32.909 1.400 16.609 1.00 0.00 ATOM 1138 O1 3PTLX 163 32.840 2.693 16.002 1.00 0.00 ATOM 1139 H1 3PTLX 163 33.735 3.037 16.286 1.00 0.00 ATOM 1140 C4 3PTLX 163 33.981 1.326 17.698 1.00 0.00 ATOM 1141 C5 3PTLX 163 34.490 -0.101 17.909 1.00 0.00 ATOM 1142 C1 3PTLX 164 32.495 21.148 23.469 1.00 0.00 ATOM 1143 C2 3PTLX 164 33.363 21.513 22.264 1.00 0.00 ATOM 1144 C3 3PTLX 164 34.230 22.721 22.623 1.00 0.00 ATOM 1145 O1 3PTLX 164 35.182 22.479 23.662 1.00 0.00 ATOM 1146 H1 3PTLX 164 35.539 23.338 24.029 1.00 0.00 ATOM 1147 C4 3PTLX 164 34.933 23.329 21.407 1.00 0.00 ATOM 1148 C5 3PTLX 164 35.205 24.820 21.611 1.00 0.00 ATOM 1149 C1 3PTLX 165 27.811 33.899 20.390 1.00 0.00 ATOM 1150 C2 3PTLX 165 26.752 34.759 19.697 1.00 0.00 ATOM 1151 C3 3PTLX 165 26.645 36.076 20.469 1.00 0.00 ATOM 1152 O1 3PTLX 165 27.697 37.011 20.215 1.00 0.00 ATOM 1153 H1 3PTLX 165 27.735 37.136 19.224 1.00 0.00 ATOM 1154 C4 3PTLX 165 25.382 36.810 20.016 1.00 0.00 ATOM 1155 C5 3PTLX 165 25.114 38.047 20.876 1.00 0.00 ATOM 1156 C1 3PTLX 166 9.030 25.822 10.502 1.00 0.00 ATOM 1157 C2 3PTLX 166 8.474 25.266 9.189 1.00 0.00 ATOM 1158 C3 3PTLX 166 8.599 23.741 9.144 1.00 0.00 ATOM 1159 O1 3PTLX 166 7.811 23.202 10.209 1.00 0.00 ATOM 1160 H1 3PTLX 166 8.371 22.746 10.901 1.00 0.00 ATOM 1161 C4 3PTLX 166 8.011 23.310 7.799 1.00 0.00 ATOM 1162 C5 3PTLX 166 7.833 21.801 7.620 1.00 0.00 ATOM 1163 C1 3PTLX 167 36.614 29.355 10.435 1.00 0.00 ATOM 1164 C2 3PTLX 167 36.737 30.624 9.589 1.00 0.00 ATOM 1165 C3 3PTLX 167 35.871 31.768 10.119 1.00 0.00 ATOM 1166 O1 3PTLX 167 36.310 32.243 11.394 1.00 0.00 ATOM 1167 H1 3PTLX 167 37.293 32.081 11.483 1.00 0.00 ATOM 1168 C4 3PTLX 167 35.639 32.925 9.145 1.00 0.00 ATOM 1169 C5 3PTLX 167 34.734 32.656 7.941 1.00 0.00 ATOM 1170 C1 3PTLX 168 31.573 19.568 3.808 1.00 0.00 ATOM 1171 C2 3PTLX 168 30.158 19.135 3.417 1.00 0.00 ATOM 1172 C3 3PTLX 168 29.351 20.357 2.975 1.00 0.00 ATOM 1173 O1 3PTLX 168 29.934 20.962 1.817 1.00 0.00 ATOM 1174 H1 3PTLX 168 30.909 20.830 1.640 1.00 0.00 ATOM 1175 C4 3PTLX 168 27.877 20.012 2.756 1.00 0.00 ATOM 1176 C5 3PTLX 168 27.049 21.299 2.756 1.00 0.00 ATOM 1177 C1 3PTLX 169 11.711 22.989 11.116 1.00 0.00 ATOM 1178 C2 3PTLX 169 11.479 21.865 12.128 1.00 0.00 ATOM 1179 C3 3PTLX 169 10.462 22.401 13.138 1.00 0.00 ATOM 1180 O1 3PTLX 169 9.318 23.124 12.675 1.00 0.00 ATOM 1181 H1 3PTLX 169 8.901 23.685 13.391 1.00 0.00 ATOM 1182 C4 3PTLX 169 10.009 21.310 14.110 1.00 0.00 ATOM 1183 C5 3PTLX 169 9.595 19.986 13.465 1.00 0.00 ATOM 1184 C1 3PTLX 170 24.527 44.082 28.833 1.00 0.00 ATOM 1185 C2 3PTLX 170 24.665 43.674 27.365 1.00 0.00 ATOM 1186 C3 3PTLX 170 24.054 44.747 26.461 1.00 0.00 ATOM 1187 O1 3PTLX 170 24.994 45.808 26.271 1.00 0.00 ATOM 1188 H1 3PTLX 170 25.123 46.162 27.197 1.00 0.00 ATOM 1189 C4 3PTLX 170 23.554 44.201 25.122 1.00 0.00 ATOM 1190 C5 3PTLX 170 22.175 43.544 25.194 1.00 0.00 ATOM 1191 C1 3PTLX 171 10.325 10.090 7.208 1.00 0.00 ATOM 1192 C2 3PTLX 171 11.526 9.933 8.143 1.00 0.00 ATOM 1193 C3 3PTLX 171 11.691 8.516 8.696 1.00 0.00 ATOM 1194 O1 3PTLX 171 11.853 7.601 7.609 1.00 0.00 ATOM 1195 H1 3PTLX 171 11.489 6.702 7.854 1.00 0.00 ATOM 1196 C4 3PTLX 171 12.861 8.402 9.675 1.00 0.00 ATOM 1197 C5 3PTLX 171 12.376 9.020 10.987 1.00 0.00 ATOM 1198 C1 3PTLX 172 39.220 15.893 36.518 1.00 0.00 ATOM 1199 C2 3PTLX 172 40.662 16.292 36.197 1.00 0.00 ATOM 1200 C3 3PTLX 172 40.592 17.042 34.866 1.00 0.00 ATOM 1201 O1 3PTLX 172 40.127 18.347 35.220 1.00 0.00 ATOM 1202 H1 3PTLX 172 39.230 18.429 34.785 1.00 0.00 ATOM 1203 C4 3PTLX 172 41.979 17.141 34.227 1.00 0.00 ATOM 1204 C5 3PTLX 172 43.181 17.760 34.944 1.00 0.00 ATOM 1205 C1 3PTLX 173 9.334 11.783 26.305 1.00 0.00 ATOM 1206 C2 3PTLX 173 10.339 12.932 26.208 1.00 0.00 ATOM 1207 C3 3PTLX 173 11.464 12.765 27.232 1.00 0.00 ATOM 1208 O1 3PTLX 173 11.047 12.428 28.558 1.00 0.00 ATOM 1209 H1 3PTLX 173 10.313 11.769 28.718 1.00 0.00 ATOM 1210 C4 3PTLX 173 12.544 11.815 26.712 1.00 0.00 ATOM 1211 C5 3PTLX 173 13.730 11.545 27.640 1.00 0.00 ATOM 1212 C1 3PTLX 174 11.390 13.549 12.175 1.00 0.00 ATOM 1213 C2 3PTLX 174 10.768 14.497 11.148 1.00 0.00 ATOM 1214 C3 3PTLX 174 10.083 15.611 11.943 1.00 0.00 ATOM 1215 O1 3PTLX 174 9.520 16.554 11.027 1.00 0.00 ATOM 1216 H1 3PTLX 174 8.525 16.508 10.932 1.00 0.00 ATOM 1217 C4 3PTLX 174 9.097 15.087 12.988 1.00 0.00 ATOM 1218 C5 3PTLX 174 8.625 16.218 13.904 1.00 0.00 ATOM 1219 C1 3PTLX 175 17.254 19.809 6.861 1.00 0.00 ATOM 1220 C2 3PTLX 175 17.195 19.087 8.208 1.00 0.00 ATOM 1221 C3 3PTLX 175 15.973 19.665 8.925 1.00 0.00 ATOM 1222 O1 3PTLX 175 15.478 18.637 9.786 1.00 0.00 ATOM 1223 H1 3PTLX 175 15.030 17.929 9.240 1.00 0.00 ATOM 1224 C4 3PTLX 175 16.481 20.933 9.613 1.00 0.00 ATOM 1225 C5 3PTLX 175 17.298 20.661 10.878 1.00 0.00 ATOM 1226 C1 3PTLX 176 29.482 21.027 42.107 1.00 0.00 ATOM 1227 C2 3PTLX 176 29.207 20.373 43.462 1.00 0.00 ATOM 1228 C3 3PTLX 176 29.398 18.860 43.340 1.00 0.00 ATOM 1229 O1 3PTLX 176 30.748 18.476 43.067 1.00 0.00 ATOM 1230 H1 3PTLX 176 30.710 17.478 43.120 1.00 0.00 ATOM 1231 C4 3PTLX 176 28.995 18.203 44.662 1.00 0.00 ATOM 1232 C5 3PTLX 176 27.484 18.440 44.705 1.00 0.00 ATOM 1233 C1 3PTLX 177 1.115 13.226 12.799 1.00 0.00 ATOM 1234 C2 3PTLX 177 1.874 12.729 11.567 1.00 0.00 ATOM 1235 C3 3PTLX 177 3.120 11.954 12.000 1.00 0.00 ATOM 1236 O1 3PTLX 177 3.919 11.737 10.834 1.00 0.00 ATOM 1237 H1 3PTLX 177 3.356 11.306 10.129 1.00 0.00 ATOM 1238 C4 3PTLX 177 3.969 12.639 13.074 1.00 0.00 ATOM 1239 C5 3PTLX 177 5.114 11.745 13.553 1.00 0.00 ATOM 1240 C1 3PTLX 178 27.336 32.175 6.539 1.00 0.00 ATOM 1241 C2 3PTLX 178 26.636 31.137 7.419 1.00 0.00 ATOM 1242 C3 3PTLX 178 25.133 31.366 7.587 1.00 0.00 ATOM 1243 O1 3PTLX 178 24.349 31.242 6.398 1.00 0.00 ATOM 1244 H1 3PTLX 178 24.549 30.277 6.233 1.00 0.00 ATOM 1245 C4 3PTLX 178 24.569 30.584 8.775 1.00 0.00 ATOM 1246 C5 3PTLX 178 23.183 31.109 9.156 1.00 0.00 ATOM 1247 C1 3PTLX 179 44.875 6.455 13.315 1.00 0.00 ATOM 1248 C2 3PTLX 179 45.217 7.909 12.981 1.00 0.00 ATOM 1249 C3 3PTLX 179 44.306 8.759 13.869 1.00 0.00 ATOM 1250 O1 3PTLX 179 44.631 8.646 15.257 1.00 0.00 ATOM 1251 H1 3PTLX 179 44.947 9.478 15.713 1.00 0.00 ATOM 1252 C4 3PTLX 179 44.140 10.237 13.511 1.00 0.00 ATOM 1253 C5 3PTLX 179 43.756 10.501 12.054 1.00 0.00 ATOM 1254 C1 3PTLX 180 16.297 36.941 43.557 1.00 0.00 ATOM 1255 C2 3PTLX 180 16.307 37.943 44.713 1.00 0.00 ATOM 1256 C3 3PTLX 180 15.800 37.433 0.433 1.00 0.00 ATOM 1257 O1 3PTLX 180 16.776 36.567 1.016 1.00 0.00 ATOM 1258 H1 3PTLX 180 16.419 35.675 1.294 1.00 0.00 ATOM 1259 C4 3PTLX 180 15.611 38.598 1.408 1.00 0.00 ATOM 1260 C5 3PTLX 180 14.619 38.156 2.485 1.00 0.00 ATOM 1261 C1 3PTLX 181 0.706 31.315 21.682 1.00 0.00 ATOM 1262 C2 3PTLX 181 1.856 30.857 20.783 1.00 0.00 ATOM 1263 C3 3PTLX 181 3.007 30.156 21.507 1.00 0.00 ATOM 1264 O1 3PTLX 181 2.637 29.069 22.359 1.00 0.00 ATOM 1265 H1 3PTLX 181 3.346 28.985 23.060 1.00 0.00 ATOM 1266 C4 3PTLX 181 3.981 29.594 20.469 1.00 0.00 ATOM 1267 C5 3PTLX 181 4.868 30.637 19.785 1.00 0.00 ATOM 1268 C1 3PTLX 182 35.856 10.063 42.845 1.00 0.00 ATOM 1269 C2 3PTLX 182 37.086 9.589 43.621 1.00 0.00 ATOM 1270 C3 3PTLX 182 36.706 8.433 44.548 1.00 0.00 ATOM 1271 O1 3PTLX 182 36.319 7.259 43.828 1.00 0.00 ATOM 1272 H1 3PTLX 182 37.042 6.598 43.627 1.00 0.00 ATOM 1273 C4 3PTLX 182 37.881 8.092 45.468 1.00 0.00 ATOM 1274 C5 3PTLX 182 38.998 7.380 44.703 1.00 0.00 ATOM 1275 C1 3PTLX 183 28.125 4.893 22.805 1.00 0.00 ATOM 1276 C2 3PTLX 183 26.888 5.790 22.739 1.00 0.00 ATOM 1277 C3 3PTLX 183 26.785 6.431 21.353 1.00 0.00 ATOM 1278 O1 3PTLX 183 25.661 5.856 20.682 1.00 0.00 ATOM 1279 H1 3PTLX 183 24.919 6.516 20.806 1.00 0.00 ATOM 1280 C4 3PTLX 183 26.644 7.954 21.373 1.00 0.00 ATOM 1281 C5 3PTLX 183 27.251 8.554 20.103 1.00 0.00 ATOM 1282 C1 3PTLX 184 0.456 36.368 2.496 1.00 0.00 ATOM 1283 C2 3PTLX 184 -0.706 35.424 2.815 1.00 0.00 ATOM 1284 C3 3PTLX 184 43.571 35.847 2.239 1.00 0.00 ATOM 1285 O1 3PTLX 184 42.564 34.833 2.284 1.00 0.00 ATOM 1286 H1 3PTLX 184 43.014 34.002 1.959 1.00 0.00 ATOM 1287 C4 3PTLX 184 43.079 37.138 2.898 1.00 0.00 ATOM 1288 C5 3PTLX 184 42.248 38.028 1.972 1.00 0.00 ATOM 1289 C1 3PTLX 185 16.357 28.514 30.937 1.00 0.00 ATOM 1290 C2 3PTLX 185 14.992 27.977 31.372 1.00 0.00 ATOM 1291 C3 3PTLX 185 14.003 29.056 31.816 1.00 0.00 ATOM 1292 O1 3PTLX 185 13.453 29.902 30.803 1.00 0.00 ATOM 1293 H1 3PTLX 185 14.210 30.547 30.699 1.00 0.00 ATOM 1294 C4 3PTLX 185 12.952 28.276 32.607 1.00 0.00 ATOM 1295 C5 3PTLX 185 11.947 29.286 33.164 1.00 0.00 ATOM 1296 C1 3PTLX 186 29.832 3.912 27.148 1.00 0.00 ATOM 1297 C2 3PTLX 186 29.016 2.759 26.561 1.00 0.00 ATOM 1298 C3 3PTLX 186 29.388 1.386 27.125 1.00 0.00 ATOM 1299 O1 3PTLX 186 28.787 1.259 28.416 1.00 0.00 ATOM 1300 H1 3PTLX 186 29.421 0.941 29.119 1.00 0.00 ATOM 1301 C4 3PTLX 186 28.748 0.367 26.180 1.00 0.00 ATOM 1302 C5 3PTLX 186 29.104 -1.036 26.677 1.00 0.00 ATOM 1303 C1 3PTLX 187 20.159 38.973 30.746 1.00 0.00 ATOM 1304 C2 3PTLX 187 19.837 40.102 29.765 1.00 0.00 ATOM 1305 C3 3PTLX 187 21.025 40.594 28.936 1.00 0.00 ATOM 1306 O1 3PTLX 187 21.617 39.483 28.258 1.00 0.00 ATOM 1307 H1 3PTLX 187 20.999 39.080 27.583 1.00 0.00 ATOM 1308 C4 3PTLX 187 20.443 41.582 27.923 1.00 0.00 ATOM 1309 C5 3PTLX 187 20.055 42.938 28.515 1.00 0.00 ATOM 1310 C1 3PTLX 188 30.016 9.697 12.301 1.00 0.00 ATOM 1311 C2 3PTLX 188 29.602 8.955 13.574 1.00 0.00 ATOM 1312 C3 3PTLX 188 28.447 9.689 14.258 1.00 0.00 ATOM 1313 O1 3PTLX 188 27.313 9.801 13.394 1.00 0.00 ATOM 1314 H1 3PTLX 188 27.022 8.907 13.051 1.00 0.00 ATOM 1315 C4 3PTLX 188 28.073 8.974 15.558 1.00 0.00 ATOM 1316 C5 3PTLX 188 27.002 9.644 16.421 1.00 0.00 ATOM 1317 C1 3PTLX 189 43.163 13.177 45.400 1.00 0.00 ATOM 1318 C2 3PTLX 189 42.075 12.154 45.733 1.00 0.00 ATOM 1319 C3 3PTLX 189 41.155 12.778 1.154 1.00 0.00 ATOM 1320 O1 3PTLX 189 40.519 13.970 0.685 1.00 0.00 ATOM 1321 H1 3PTLX 189 39.901 14.370 1.362 1.00 0.00 ATOM 1322 C4 3PTLX 189 40.072 11.713 1.340 1.00 0.00 ATOM 1323 C5 3PTLX 189 40.372 10.600 2.346 1.00 0.00 ATOM 1324 C1 3PTLX 190 17.909 15.759 30.342 1.00 0.00 ATOM 1325 C2 3PTLX 190 18.642 17.102 30.306 1.00 0.00 ATOM 1326 C3 3PTLX 190 17.642 18.257 30.226 1.00 0.00 ATOM 1327 O1 3PTLX 190 18.417 19.458 30.233 1.00 0.00 ATOM 1328 H1 3PTLX 190 18.733 19.583 31.174 1.00 0.00 ATOM 1329 C4 3PTLX 190 16.989 18.204 28.843 1.00 0.00 ATOM 1330 C5 3PTLX 190 15.701 19.024 28.748 1.00 0.00 ATOM 1331 C1 3PTLX 191 2.096 0.826 19.993 1.00 0.00 ATOM 1332 C2 3PTLX 191 2.085 2.336 20.236 1.00 0.00 ATOM 1333 C3 3PTLX 191 3.393 2.727 20.927 1.00 0.00 ATOM 1334 O1 3PTLX 191 4.503 2.813 20.029 1.00 0.00 ATOM 1335 H1 3PTLX 191 5.179 3.389 20.489 1.00 0.00 ATOM 1336 C4 3PTLX 191 3.194 3.980 21.782 1.00 0.00 ATOM 1337 C5 3PTLX 191 2.838 5.230 20.975 1.00 0.00 ATOM 1338 C1 3PTLX 192 24.793 13.910 17.772 1.00 0.00 ATOM 1339 C2 3PTLX 192 24.604 13.733 19.280 1.00 0.00 ATOM 1340 C3 3PTLX 192 25.945 13.268 19.851 1.00 0.00 ATOM 1341 O1 3PTLX 192 26.794 14.401 20.053 1.00 0.00 ATOM 1342 H1 3PTLX 192 26.804 15.010 19.260 1.00 0.00 ATOM 1343 C4 3PTLX 192 25.769 12.445 21.129 1.00 0.00 ATOM 1344 C5 3PTLX 192 24.982 13.317 22.109 1.00 0.00 ATOM 1345 C1 3PTLX 193 17.389 1.449 27.633 1.00 0.00 ATOM 1346 C2 3PTLX 193 18.666 1.799 26.867 1.00 0.00 ATOM 1347 C3 3PTLX 193 18.309 2.210 25.437 1.00 0.00 ATOM 1348 O1 3PTLX 193 17.277 3.191 25.299 1.00 0.00 ATOM 1349 H1 3PTLX 193 17.403 3.727 24.464 1.00 0.00 ATOM 1350 C4 3PTLX 193 19.582 2.573 24.670 1.00 0.00 ATOM 1351 C5 3PTLX 193 19.364 2.642 23.157 1.00 0.00 ATOM 1352 C1 3PTLX 194 36.693 44.939 28.415 1.00 0.00 ATOM 1353 C2 3PTLX 194 37.425 45.197 27.097 1.00 0.00 ATOM 1354 C3 3PTLX 194 37.231 44.074 26.077 1.00 0.00 ATOM 1355 O1 3PTLX 194 38.130 44.355 25.001 1.00 0.00 ATOM 1356 H1 3PTLX 194 39.000 44.692 25.362 1.00 0.00 ATOM 1357 C4 3PTLX 194 37.648 42.724 26.665 1.00 0.00 ATOM 1358 C5 3PTLX 194 37.654 41.529 25.709 1.00 0.00 ATOM 1359 C1 3PTLX 195 11.728 1.364 43.644 1.00 0.00 ATOM 1360 C2 3PTLX 195 11.467 -0.141 43.563 1.00 0.00 ATOM 1361 C3 3PTLX 195 10.213 45.087 42.784 1.00 0.00 ATOM 1362 O1 3PTLX 195 10.046 43.698 43.083 1.00 0.00 ATOM 1363 H1 3PTLX 195 10.950 43.275 43.021 1.00 0.00 ATOM 1364 C4 3PTLX 195 8.955 0.111 43.358 1.00 0.00 ATOM 1365 C5 3PTLX 195 7.799 -0.146 42.389 1.00 0.00 ATOM 1366 C1 3PTLX 196 26.296 21.330 22.728 1.00 0.00 ATOM 1367 C2 3PTLX 196 24.874 21.458 23.278 1.00 0.00 ATOM 1368 C3 3PTLX 196 24.281 20.069 23.524 1.00 0.00 ATOM 1369 O1 3PTLX 196 24.011 19.593 22.202 1.00 0.00 ATOM 1370 H1 3PTLX 196 23.977 18.600 22.089 1.00 0.00 ATOM 1371 C4 3PTLX 196 25.080 19.009 24.285 1.00 0.00 ATOM 1372 C5 3PTLX 196 24.589 17.563 24.183 1.00 0.00 ATOM 1373 C1 3PTLX 197 8.411 28.548 33.286 1.00 0.00 ATOM 1374 C2 3PTLX 197 8.512 27.312 34.182 1.00 0.00 ATOM 1375 C3 3PTLX 197 7.461 27.229 35.290 1.00 0.00 ATOM 1376 O1 3PTLX 197 7.637 25.929 35.861 1.00 0.00 ATOM 1377 H1 3PTLX 197 8.578 25.609 35.746 1.00 0.00 ATOM 1378 C4 3PTLX 197 7.794 28.239 36.390 1.00 0.00 ATOM 1379 C5 3PTLX 197 6.748 28.228 37.507 1.00 0.00 ATOM 1380 C1 3PTLX 198 39.002 12.266 16.596 1.00 0.00 ATOM 1381 C2 3PTLX 198 37.485 12.424 16.716 1.00 0.00 ATOM 1382 C3 3PTLX 198 36.979 13.857 16.539 1.00 0.00 ATOM 1383 O1 3PTLX 198 37.049 14.212 15.155 1.00 0.00 ATOM 1384 H1 3PTLX 198 36.871 13.398 14.604 1.00 0.00 ATOM 1385 C4 3PTLX 198 35.550 14.141 17.007 1.00 0.00 ATOM 1386 C5 3PTLX 198 35.158 13.711 18.422 1.00 0.00 ATOM 1387 C1 3PTLX 199 14.299 35.535 11.406 1.00 0.00 ATOM 1388 C2 3PTLX 199 14.475 36.698 10.427 1.00 0.00 ATOM 1389 C3 3PTLX 199 13.158 37.446 10.208 1.00 0.00 ATOM 1390 O1 3PTLX 199 13.550 38.817 10.099 1.00 0.00 ATOM 1391 H1 3PTLX 199 13.671 39.192 11.019 1.00 0.00 ATOM 1392 C4 3PTLX 199 12.578 36.844 8.927 1.00 0.00 ATOM 1393 C5 3PTLX 199 11.141 37.342 8.757 1.00 0.00 ATOM 1394 C1 3PTLX 200 0.156 15.556 43.551 1.00 0.00 ATOM 1395 C2 3PTLX 200 0.912 14.289 43.147 1.00 0.00 ATOM 1396 C3 3PTLX 200 2.313 14.298 43.763 1.00 0.00 ATOM 1397 O1 3PTLX 200 2.292 13.867 45.126 1.00 0.00 ATOM 1398 H1 3PTLX 200 2.668 14.619 45.667 1.00 0.00 ATOM 1399 C4 3PTLX 200 3.274 13.575 42.818 1.00 0.00 ATOM 1400 C5 3PTLX 200 4.688 13.922 43.290 1.00 0.00 ATOM 1401 C1 3PTLX 201 38.065 4.549 34.738 1.00 0.00 ATOM 1402 C2 3PTLX 201 36.538 4.477 34.674 1.00 0.00 ATOM 1403 C3 3PTLX 201 35.876 5.152 35.878 1.00 0.00 ATOM 1404 O1 3PTLX 201 35.988 6.577 35.865 1.00 0.00 ATOM 1405 H1 3PTLX 201 36.875 6.816 35.472 1.00 0.00 ATOM 1406 C4 3PTLX 201 34.403 4.741 35.908 1.00 0.00 ATOM 1407 C5 3PTLX 201 33.566 5.066 34.669 1.00 0.00 ATOM 1408 C1 3PTLX 202 4.202 9.153 31.038 1.00 0.00 ATOM 1409 C2 3PTLX 202 4.234 10.591 30.517 1.00 0.00 ATOM 1410 C3 3PTLX 202 4.101 10.470 28.998 1.00 0.00 ATOM 1411 O1 3PTLX 202 2.749 10.094 28.723 1.00 0.00 ATOM 1412 H1 3PTLX 202 2.503 10.340 27.786 1.00 0.00 ATOM 1413 C4 3PTLX 202 4.288 11.824 28.310 1.00 0.00 ATOM 1414 C5 3PTLX 202 4.709 11.654 26.849 1.00 0.00 ATOM 1415 C1 3PTLX 203 2.800 24.087 30.812 1.00 0.00 ATOM 1416 C2 3PTLX 203 1.677 25.017 30.348 1.00 0.00 ATOM 1417 C3 3PTLX 203 1.165 24.648 28.954 1.00 0.00 ATOM 1418 O1 3PTLX 203 0.597 23.337 28.995 1.00 0.00 ATOM 1419 H1 3PTLX 203 1.235 22.569 28.941 1.00 0.00 ATOM 1420 C4 3PTLX 203 0.128 25.624 28.395 1.00 0.00 ATOM 1421 C5 3PTLX 203 -0.240 25.435 26.922 1.00 0.00 ATOM 1422 C1 3PTLX 204 13.053 18.093 36.368 1.00 0.00 ATOM 1423 C2 3PTLX 204 12.045 18.404 37.477 1.00 0.00 ATOM 1424 C3 3PTLX 204 10.815 17.496 37.416 1.00 0.00 ATOM 1425 O1 3PTLX 204 10.261 17.509 38.734 1.00 0.00 ATOM 1426 H1 3PTLX 204 9.881 18.411 38.941 1.00 0.00 ATOM 1427 C4 3PTLX 204 9.855 17.834 36.274 1.00 0.00 ATOM 1428 C5 3PTLX 204 9.018 16.665 35.750 1.00 0.00 ATOM 1429 C1 3PTLX 205 41.708 15.081 19.231 1.00 0.00 ATOM 1430 C2 3PTLX 205 42.932 15.572 20.007 1.00 0.00 ATOM 1431 C3 3PTLX 205 42.678 16.792 20.895 1.00 0.00 ATOM 1432 O1 3PTLX 205 41.631 16.408 21.790 1.00 0.00 ATOM 1433 H1 3PTLX 205 40.825 16.971 21.604 1.00 0.00 ATOM 1434 C4 3PTLX 205 43.964 17.204 21.615 1.00 0.00 ATOM 1435 C5 3PTLX 205 45.073 17.592 20.634 1.00 0.00 ATOM 1436 C1 3PTLX 206 36.659 29.283 40.169 1.00 0.00 ATOM 1437 C2 3PTLX 206 35.562 28.313 40.611 1.00 0.00 ATOM 1438 C3 3PTLX 206 35.602 26.869 40.105 1.00 0.00 ATOM 1439 O1 3PTLX 206 36.892 26.368 40.466 1.00 0.00 ATOM 1440 H1 3PTLX 206 37.056 25.581 39.870 1.00 0.00 ATOM 1441 C4 3PTLX 206 34.449 25.976 40.567 1.00 0.00 ATOM 1442 C5 3PTLX 206 34.349 25.857 42.089 1.00 0.00 ATOM 1443 C1 3PTLX 207 35.445 38.359 19.580 1.00 0.00 ATOM 1444 C2 3PTLX 207 34.503 37.628 18.622 1.00 0.00 ATOM 1445 C3 3PTLX 207 33.382 36.852 19.317 1.00 0.00 ATOM 1446 O1 3PTLX 207 32.377 37.714 19.858 1.00 0.00 ATOM 1447 H1 3PTLX 207 31.564 37.188 20.110 1.00 0.00 ATOM 1448 C4 3PTLX 207 32.708 35.908 18.320 1.00 0.00 ATOM 1449 C5 3PTLX 207 32.029 34.837 19.176 1.00 0.00 ATOM 1450 C1 3PTLX 208 40.429 27.495 19.100 1.00 0.00 ATOM 1451 C2 3PTLX 208 40.741 28.864 19.708 1.00 0.00 ATOM 1452 C3 3PTLX 208 40.337 30.088 18.884 1.00 0.00 ATOM 1453 O1 3PTLX 208 38.942 30.097 18.572 1.00 0.00 ATOM 1454 H1 3PTLX 208 38.417 30.694 19.178 1.00 0.00 ATOM 1455 C4 3PTLX 208 40.805 31.291 19.705 1.00 0.00 ATOM 1456 C5 3PTLX 208 42.328 31.239 19.577 1.00 0.00 ATOM 1457 C1 3PTLX 209 22.204 24.163 23.060 1.00 0.00 ATOM 1458 C2 3PTLX 209 21.689 25.478 23.648 1.00 0.00 ATOM 1459 C3 3PTLX 209 22.263 25.696 25.050 1.00 0.00 ATOM 1460 O1 3PTLX 209 21.913 27.023 25.450 1.00 0.00 ATOM 1461 H1 3PTLX 209 20.919 27.046 25.560 1.00 0.00 ATOM 1462 C4 3PTLX 209 21.736 24.579 25.952 1.00 0.00 ATOM 1463 C5 3PTLX 209 22.521 24.624 27.265 1.00 0.00 ATOM 1464 C1 3PTLX 210 30.996 1.061 41.687 1.00 0.00 ATOM 1465 C2 3PTLX 210 30.516 1.021 43.140 1.00 0.00 ATOM 1466 C3 3PTLX 210 28.998 1.193 43.217 1.00 0.00 ATOM 1467 O1 3PTLX 210 28.400 0.049 42.601 1.00 0.00 ATOM 1468 H1 3PTLX 210 28.425 -0.707 43.255 1.00 0.00 ATOM 1469 C4 3PTLX 210 28.615 1.221 44.698 1.00 0.00 ATOM 1470 C5 3PTLX 210 27.142 1.505 44.996 1.00 0.00 ATOM 1471 C1 3PTLX 211 45.602 41.667 42.466 1.00 0.00 ATOM 1472 C2 3PTLX 211 46.682 42.523 41.802 1.00 0.00 ATOM 1473 C3 3PTLX 211 2.294 42.214 42.640 1.00 0.00 ATOM 1474 O1 3PTLX 211 2.951 41.082 42.064 1.00 0.00 ATOM 1475 H1 3PTLX 211 2.858 40.249 42.609 1.00 0.00 ATOM 1476 C4 3PTLX 211 3.213 43.436 42.589 1.00 0.00 ATOM 1477 C5 3PTLX 211 4.278 43.338 43.684 1.00 0.00 ATOM 1478 C1 3PTLX 212 41.857 41.735 36.211 1.00 0.00 ATOM 1479 C2 3PTLX 212 40.331 41.838 36.238 1.00 0.00 ATOM 1480 C3 3PTLX 212 39.870 43.263 36.549 1.00 0.00 ATOM 1481 O1 3PTLX 212 40.279 44.226 35.574 1.00 0.00 ATOM 1482 H1 3PTLX 212 39.684 44.236 34.770 1.00 0.00 ATOM 1483 C4 3PTLX 212 38.365 43.418 36.782 1.00 0.00 ATOM 1484 C5 3PTLX 212 37.943 44.855 37.096 1.00 0.00 ATOM 1485 C1 3PTLX 213 23.589 22.147 4.707 1.00 0.00 ATOM 1486 C2 3PTLX 213 22.457 21.302 4.119 1.00 0.00 ATOM 1487 C3 3PTLX 213 23.066 20.309 3.127 1.00 0.00 ATOM 1488 O1 3PTLX 213 23.404 19.089 3.791 1.00 0.00 ATOM 1489 H1 3PTLX 213 24.134 19.173 4.470 1.00 0.00 ATOM 1490 C4 3PTLX 213 22.056 20.192 1.984 1.00 0.00 ATOM 1491 C5 3PTLX 213 22.487 19.134 0.966 1.00 0.00 ATOM 1492 C1 3PTLX 214 17.940 43.358 31.479 1.00 0.00 ATOM 1493 C2 3PTLX 214 17.601 43.063 32.941 1.00 0.00 ATOM 1494 C3 3PTLX 214 17.996 44.353 33.662 1.00 0.00 ATOM 1495 O1 3PTLX 214 17.519 45.584 33.115 1.00 0.00 ATOM 1496 H1 3PTLX 214 17.013 46.146 33.770 1.00 0.00 ATOM 1497 C4 3PTLX 214 17.514 44.189 35.105 1.00 0.00 ATOM 1498 C5 3PTLX 214 18.287 43.157 35.929 1.00 0.00 ATOM 1499 C1 3PTLX 215 27.602 14.908 31.787 1.00 0.00 ATOM 1500 C2 3PTLX 215 28.762 15.303 32.703 1.00 0.00 ATOM 1501 C3 3PTLX 215 29.766 16.138 31.906 1.00 0.00 ATOM 1502 O1 3PTLX 215 29.158 17.291 31.316 1.00 0.00 ATOM 1503 H1 3PTLX 215 29.208 17.146 30.328 1.00 0.00 ATOM 1504 C4 3PTLX 215 31.003 16.536 32.713 1.00 0.00 ATOM 1505 C5 3PTLX 215 31.838 15.513 33.487 1.00 0.00 ATOM 1506 C1 3PTLX 216 17.131 44.439 10.401 1.00 0.00 ATOM 1507 C2 3PTLX 216 15.768 44.946 10.879 1.00 0.00 ATOM 1508 C3 3PTLX 216 14.522 44.273 10.300 1.00 0.00 ATOM 1509 O1 3PTLX 216 14.622 42.855 10.454 1.00 0.00 ATOM 1510 H1 3PTLX 216 14.390 42.477 9.557 1.00 0.00 ATOM 1511 C4 3PTLX 216 13.494 45.022 11.151 1.00 0.00 ATOM 1512 C5 3PTLX 216 12.092 44.869 10.556 1.00 0.00 ATOM 1513 C1 3PTLX 217 15.438 14.528 44.393 1.00 0.00 ATOM 1514 C2 3PTLX 217 15.414 13.625 45.628 1.00 0.00 ATOM 1515 C3 3PTLX 217 16.273 14.135 1.156 1.00 0.00 ATOM 1516 O1 3PTLX 217 15.587 15.277 1.675 1.00 0.00 ATOM 1517 H1 3PTLX 217 14.601 15.119 1.624 1.00 0.00 ATOM 1518 C4 3PTLX 217 16.525 13.079 2.235 1.00 0.00 ATOM 1519 C5 3PTLX 217 17.502 13.456 3.350 1.00 0.00 ATOM 1520 C1 3PTLX 218 26.819 11.080 41.536 1.00 0.00 ATOM 1521 C2 3PTLX 218 27.532 10.873 40.198 1.00 0.00 ATOM 1522 C3 3PTLX 218 27.194 9.555 39.499 1.00 0.00 ATOM 1523 O1 3PTLX 218 27.789 9.429 38.204 1.00 0.00 ATOM 1524 H1 3PTLX 218 27.974 8.479 37.952 1.00 0.00 ATOM 1525 C4 3PTLX 218 27.697 8.379 40.337 1.00 0.00 ATOM 1526 C5 3PTLX 218 27.089 7.071 39.825 1.00 0.00 ATOM 1527 C1 3PTLX 219 10.070 30.633 1.463 1.00 0.00 ATOM 1528 C2 3PTLX 219 8.734 30.704 0.721 1.00 0.00 ATOM 1529 C3 3PTLX 219 8.911 31.729 45.229 1.00 0.00 ATOM 1530 O1 3PTLX 219 9.137 30.963 44.044 1.00 0.00 ATOM 1531 H1 3PTLX 219 8.725 31.420 43.256 1.00 0.00 ATOM 1532 C4 3PTLX 219 7.693 32.644 45.082 1.00 0.00 ATOM 1533 C5 3PTLX 219 6.344 32.174 44.535 1.00 0.00 ATOM 1534 C1 3PTLX 220 8.162 19.837 23.245 1.00 0.00 ATOM 1535 C2 3PTLX 220 8.838 18.644 22.566 1.00 0.00 ATOM 1536 C3 3PTLX 220 7.931 17.429 22.779 1.00 0.00 ATOM 1537 O1 3PTLX 220 6.731 17.596 22.020 1.00 0.00 ATOM 1538 H1 3PTLX 220 6.678 18.470 21.536 1.00 0.00 ATOM 1539 C4 3PTLX 220 8.688 16.102 22.851 1.00 0.00 ATOM 1540 C5 3PTLX 220 7.856 14.939 23.396 1.00 0.00 ATOM 1541 C1 3PTLX 221 28.065 38.427 10.206 1.00 0.00 ATOM 1542 C2 3PTLX 221 27.262 37.157 10.495 1.00 0.00 ATOM 1543 C3 3PTLX 221 25.987 37.329 9.667 1.00 0.00 ATOM 1544 O1 3PTLX 221 26.099 37.939 8.379 1.00 0.00 ATOM 1545 H1 3PTLX 221 25.610 38.807 8.301 1.00 0.00 ATOM 1546 C4 3PTLX 221 25.206 36.029 9.457 1.00 0.00 ATOM 1547 C5 3PTLX 221 26.068 34.933 8.828 1.00 0.00 ATOM 1548 C1 3PTLX 222 21.616 16.309 5.773 1.00 0.00 ATOM 1549 C2 3PTLX 222 21.689 15.304 4.621 1.00 0.00 ATOM 1550 C3 3PTLX 222 21.840 15.887 3.215 1.00 0.00 ATOM 1551 O1 3PTLX 222 23.075 16.600 3.107 1.00 0.00 ATOM 1552 H1 3PTLX 222 22.886 17.512 3.470 1.00 0.00 ATOM 1553 C4 3PTLX 222 21.656 14.775 2.180 1.00 0.00 ATOM 1554 C5 3PTLX 222 21.914 15.327 0.777 1.00 0.00 ATOM 1555 C1 3PTLX 223 29.015 6.342 34.119 1.00 0.00 ATOM 1556 C2 3PTLX 223 29.918 5.925 35.281 1.00 0.00 ATOM 1557 C3 3PTLX 223 29.831 7.051 36.313 1.00 0.00 ATOM 1558 O1 3PTLX 223 28.553 7.139 36.949 1.00 0.00 ATOM 1559 H1 3PTLX 223 27.874 6.724 36.344 1.00 0.00 ATOM 1560 C4 3PTLX 223 30.962 6.676 37.273 1.00 0.00 ATOM 1561 C5 3PTLX 223 31.195 7.876 38.194 1.00 0.00 ATOM 1562 C1 3PTLX 224 30.179 32.770 30.925 1.00 0.00 ATOM 1563 C2 3PTLX 224 31.009 34.053 30.858 1.00 0.00 ATOM 1564 C3 3PTLX 224 30.520 35.090 29.845 1.00 0.00 ATOM 1565 O1 3PTLX 224 31.542 36.088 29.779 1.00 0.00 ATOM 1566 H1 3PTLX 224 31.264 36.956 30.190 1.00 0.00 ATOM 1567 C4 3PTLX 224 30.141 34.558 28.461 1.00 0.00 ATOM 1568 C5 3PTLX 224 29.096 35.439 27.774 1.00 0.00 ATOM 1569 C1 3PTLX 225 23.624 44.793 35.879 1.00 0.00 ATOM 1570 C2 3PTLX 225 22.644 43.903 35.112 1.00 0.00 ATOM 1571 C3 3PTLX 225 23.368 42.834 34.292 1.00 0.00 ATOM 1572 O1 3PTLX 225 23.938 41.782 35.074 1.00 0.00 ATOM 1573 H1 3PTLX 225 23.519 41.830 35.981 1.00 0.00 ATOM 1574 C4 3PTLX 225 22.543 42.013 33.298 1.00 0.00 ATOM 1575 C5 3PTLX 225 23.256 41.937 31.947 1.00 0.00 ATOM 1576 C1 3PTLX 226 17.666 41.253 12.211 1.00 0.00 ATOM 1577 C2 3PTLX 226 16.748 40.085 12.578 1.00 0.00 ATOM 1578 C3 3PTLX 226 15.301 40.462 12.902 1.00 0.00 ATOM 1579 O1 3PTLX 226 14.420 40.647 11.791 1.00 0.00 ATOM 1580 H1 3PTLX 226 14.586 41.548 11.388 1.00 0.00 ATOM 1581 C4 3PTLX 226 14.867 39.303 13.802 1.00 0.00 ATOM 1582 C5 3PTLX 226 13.475 39.564 14.380 1.00 0.00 ATOM 1583 C1 3PTLX 227 3.519 31.175 42.376 1.00 0.00 ATOM 1584 C2 3PTLX 227 2.941 31.616 41.030 1.00 0.00 ATOM 1585 C3 3PTLX 227 3.822 31.128 39.878 1.00 0.00 ATOM 1586 O1 3PTLX 227 5.217 30.921 40.112 1.00 0.00 ATOM 1587 H1 3PTLX 227 5.415 30.007 40.467 1.00 0.00 ATOM 1588 C4 3PTLX 227 3.108 29.912 39.282 1.00 0.00 ATOM 1589 C5 3PTLX 227 1.744 30.123 38.623 1.00 0.00 ATOM 1590 C1 3PTLX 228 39.049 3.579 38.751 1.00 0.00 ATOM 1591 C2 3PTLX 228 39.739 4.891 38.372 1.00 0.00 ATOM 1592 C3 3PTLX 228 40.829 5.324 39.354 1.00 0.00 ATOM 1593 O1 3PTLX 228 41.713 6.298 38.792 1.00 0.00 ATOM 1594 H1 3PTLX 228 41.690 7.043 39.459 1.00 0.00 ATOM 1595 C4 3PTLX 228 40.335 5.945 40.662 1.00 0.00 ATOM 1596 C5 3PTLX 228 41.066 5.562 41.950 1.00 0.00 ATOM 1597 C1 3PTLX 229 42.494 26.784 30.735 1.00 0.00 ATOM 1598 C2 3PTLX 229 42.895 27.921 31.677 1.00 0.00 ATOM 1599 C3 3PTLX 229 44.245 27.577 32.311 1.00 0.00 ATOM 1600 O1 3PTLX 229 45.308 27.568 31.354 1.00 0.00 ATOM 1601 H1 3PTLX 229 46.194 27.415 31.790 1.00 0.00 ATOM 1602 C4 3PTLX 229 44.579 28.521 33.468 1.00 0.00 ATOM 1603 C5 3PTLX 229 43.614 28.444 34.653 1.00 0.00 ATOM 1604 C1 3PTLX 230 13.338 4.280 2.637 1.00 0.00 ATOM 1605 C2 3PTLX 230 13.193 5.801 2.724 1.00 0.00 ATOM 1606 C3 3PTLX 230 12.205 6.283 3.788 1.00 0.00 ATOM 1607 O1 3PTLX 230 12.660 5.967 5.107 1.00 0.00 ATOM 1608 H1 3PTLX 230 13.418 6.562 5.372 1.00 0.00 ATOM 1609 C4 3PTLX 230 11.880 7.777 3.743 1.00 0.00 ATOM 1610 C5 3PTLX 230 10.687 8.051 2.825 1.00 0.00 ATOM 1611 C1 3PTLX 231 21.182 11.284 24.958 1.00 0.00 ATOM 1612 C2 3PTLX 231 20.291 11.921 26.027 1.00 0.00 ATOM 1613 C3 3PTLX 231 19.541 10.885 26.866 1.00 0.00 ATOM 1614 O1 3PTLX 231 20.472 10.226 27.729 1.00 0.00 ATOM 1615 H1 3PTLX 231 21.014 10.919 28.204 1.00 0.00 ATOM 1616 C4 3PTLX 231 18.433 11.553 27.683 1.00 0.00 ATOM 1617 C5 3PTLX 231 17.634 10.558 28.527 1.00 0.00 ATOM 1618 C1 3PTLX 232 5.234 13.051 37.820 1.00 0.00 ATOM 1619 C2 3PTLX 232 5.835 14.350 37.278 1.00 0.00 ATOM 1620 C3 3PTLX 232 4.884 15.548 37.320 1.00 0.00 ATOM 1621 O1 3PTLX 232 4.055 15.627 36.157 1.00 0.00 ATOM 1622 H1 3PTLX 232 3.480 14.812 36.087 1.00 0.00 ATOM 1623 C4 3PTLX 232 4.078 15.832 38.589 1.00 0.00 ATOM 1624 C5 3PTLX 232 5.096 16.112 39.696 1.00 0.00 ATOM 1625 C1 3PTLX 233 29.877 29.382 2.904 1.00 0.00 ATOM 1626 C2 3PTLX 233 30.108 30.263 4.133 1.00 0.00 ATOM 1627 C3 3PTLX 233 31.490 30.005 4.736 1.00 0.00 ATOM 1628 O1 3PTLX 233 32.419 30.284 3.686 1.00 0.00 ATOM 1629 H1 3PTLX 233 33.354 30.093 3.985 1.00 0.00 ATOM 1630 C4 3PTLX 233 31.869 30.998 5.836 1.00 0.00 ATOM 1631 C5 3PTLX 233 31.205 30.633 7.166 1.00 0.00 ATOM 1632 C1 3PTLX 234 39.842 17.788 8.288 1.00 0.00 ATOM 1633 C2 3PTLX 234 40.730 16.801 7.528 1.00 0.00 ATOM 1634 C3 3PTLX 234 42.164 16.711 8.052 1.00 0.00 ATOM 1635 O1 3PTLX 234 42.318 16.634 9.472 1.00 0.00 ATOM 1636 H1 3PTLX 234 41.568 16.148 9.922 1.00 0.00 ATOM 1637 C4 3PTLX 234 42.889 15.618 7.264 1.00 0.00 ATOM 1638 C5 3PTLX 234 42.429 14.189 7.558 1.00 0.00 ATOM 1639 C1 3PTLX 235 27.903 43.504 30.646 1.00 0.00 ATOM 1640 C2 3PTLX 235 27.074 43.697 31.917 1.00 0.00 ATOM 1641 C3 3PTLX 235 27.857 43.597 33.227 1.00 0.00 ATOM 1642 O1 3PTLX 235 28.854 44.618 33.316 1.00 0.00 ATOM 1643 H1 3PTLX 235 29.254 44.596 34.232 1.00 0.00 ATOM 1644 C4 3PTLX 235 26.940 43.666 34.450 1.00 0.00 ATOM 1645 C5 3PTLX 235 27.623 43.212 35.742 1.00 0.00 ATOM 1646 C1 3PTLX 236 44.323 7.451 33.891 1.00 0.00 ATOM 1647 C2 3PTLX 236 42.865 7.827 34.161 1.00 0.00 ATOM 1648 C3 3PTLX 236 42.196 7.097 35.327 1.00 0.00 ATOM 1649 O1 3PTLX 236 42.890 7.117 36.578 1.00 0.00 ATOM 1650 H1 3PTLX 236 42.377 6.745 37.351 1.00 0.00 ATOM 1651 C4 3PTLX 236 40.876 7.771 35.709 1.00 0.00 ATOM 1652 C5 3PTLX 236 39.834 7.997 34.613 1.00 0.00 ATOM 1653 C1 3PTLX 237 3.697 33.368 13.650 1.00 0.00 ATOM 1654 C2 3PTLX 237 3.905 34.803 13.161 1.00 0.00 ATOM 1655 C3 3PTLX 237 4.952 35.619 13.921 1.00 0.00 ATOM 1656 O1 3PTLX 237 4.768 36.998 13.593 1.00 0.00 ATOM 1657 H1 3PTLX 237 5.072 37.197 12.661 1.00 0.00 ATOM 1658 C4 3PTLX 237 4.932 35.407 15.437 1.00 0.00 ATOM 1659 C5 3PTLX 237 5.940 36.290 16.176 1.00 0.00 ATOM 1660 C1 3PTLX 238 19.353 19.657 41.768 1.00 0.00 ATOM 1661 C2 3PTLX 238 18.266 19.361 40.732 1.00 0.00 ATOM 1662 C3 3PTLX 238 18.836 19.625 39.337 1.00 0.00 ATOM 1663 O1 3PTLX 238 19.577 18.491 38.880 1.00 0.00 ATOM 1664 H1 3PTLX 238 20.560 18.622 38.749 1.00 0.00 ATOM 1665 C4 3PTLX 238 17.738 19.965 38.327 1.00 0.00 ATOM 1666 C5 3PTLX 238 16.673 18.910 38.019 1.00 0.00 ATOM 1667 C1 3PTLX 239 6.240 23.701 33.029 1.00 0.00 ATOM 1668 C2 3PTLX 239 5.499 22.778 33.999 1.00 0.00 ATOM 1669 C3 3PTLX 239 5.955 23.004 35.442 1.00 0.00 ATOM 1670 O1 3PTLX 239 5.422 24.290 35.771 1.00 0.00 ATOM 1671 H1 3PTLX 239 6.224 24.858 35.582 1.00 0.00 ATOM 1672 C4 3PTLX 239 5.379 21.860 36.279 1.00 0.00 ATOM 1673 C5 3PTLX 239 5.440 21.898 37.807 1.00 0.00 ATOM 1674 C1 3PTLX 240 16.437 39.218 39.230 1.00 0.00 ATOM 1675 C2 3PTLX 240 16.629 40.253 38.120 1.00 0.00 ATOM 1676 C3 3PTLX 240 15.245 40.858 37.874 1.00 0.00 ATOM 1677 O1 3PTLX 240 15.048 42.060 38.624 1.00 0.00 ATOM 1678 H1 3PTLX 240 14.087 42.188 38.868 1.00 0.00 ATOM 1679 C4 3PTLX 240 15.181 41.043 36.357 1.00 0.00 ATOM 1680 C5 3PTLX 240 14.915 39.779 35.537 1.00 0.00 ATOM 1681 C1 3PTLX 241 2.406 0.286 24.530 1.00 0.00 ATOM 1682 C2 3PTLX 241 2.423 0.960 25.903 1.00 0.00 ATOM 1683 C3 3PTLX 241 2.401 45.624 27.090 1.00 0.00 ATOM 1684 O1 3PTLX 241 3.704 45.124 27.405 1.00 0.00 ATOM 1685 H1 3PTLX 241 4.040 44.739 26.545 1.00 0.00 ATOM 1686 C4 3PTLX 241 1.685 0.639 28.278 1.00 0.00 ATOM 1687 C5 3PTLX 241 1.339 -0.229 29.489 1.00 0.00 ATOM 1688 C1 3PTLX 242 37.608 2.171 11.560 1.00 0.00 ATOM 1689 C2 3PTLX 242 37.170 3.168 12.635 1.00 0.00 ATOM 1690 C3 3PTLX 242 35.702 3.480 12.340 1.00 0.00 ATOM 1691 O1 3PTLX 242 35.064 3.951 13.530 1.00 0.00 ATOM 1692 H1 3PTLX 242 34.118 4.165 13.288 1.00 0.00 ATOM 1693 C4 3PTLX 242 35.762 4.670 11.379 1.00 0.00 ATOM 1694 C5 3PTLX 242 34.482 5.058 10.636 1.00 0.00 ATOM 1695 C1 3PTLX 243 12.886 33.044 1.943 1.00 0.00 ATOM 1696 C2 3PTLX 243 14.217 32.291 1.898 1.00 0.00 ATOM 1697 C3 3PTLX 243 15.272 33.150 1.198 1.00 0.00 ATOM 1698 O1 3PTLX 243 15.562 34.271 2.037 1.00 0.00 ATOM 1699 H1 3PTLX 243 15.473 33.993 2.993 1.00 0.00 ATOM 1700 C4 3PTLX 243 16.491 32.241 1.029 1.00 0.00 ATOM 1701 C5 3PTLX 243 17.347 32.916 -0.044 1.00 0.00 ATOM 1702 C1 3PTLX 244 43.726 22.667 0.367 1.00 0.00 ATOM 1703 C2 3PTLX 244 44.952 22.064 1.056 1.00 0.00 ATOM 1704 C3 3PTLX 244 45.285 20.734 0.378 1.00 0.00 ATOM 1705 O1 3PTLX 244 45.723 20.915 -0.971 1.00 0.00 ATOM 1706 H1 3PTLX 244 46.716 21.017 -0.914 1.00 0.00 ATOM 1707 C4 3PTLX 244 0.871 20.140 1.090 1.00 0.00 ATOM 1708 C5 3PTLX 244 0.569 19.820 2.556 1.00 0.00 ATOM 1709 C1 3PTLX 245 34.730 16.589 2.719 1.00 0.00 ATOM 1710 C2 3PTLX 245 34.632 16.481 1.196 1.00 0.00 ATOM 1711 C3 3PTLX 245 35.427 15.297 0.641 1.00 0.00 ATOM 1712 O1 3PTLX 245 36.810 15.631 0.781 1.00 0.00 ATOM 1713 H1 3PTLX 245 37.021 16.379 0.152 1.00 0.00 ATOM 1714 C4 3PTLX 245 35.143 13.949 1.307 1.00 0.00 ATOM 1715 C5 3PTLX 245 35.938 12.829 0.633 1.00 0.00 ATOM 1716 C1 3PTLX 246 39.864 34.630 34.100 1.00 0.00 ATOM 1717 C2 3PTLX 246 41.146 34.275 33.344 1.00 0.00 ATOM 1718 C3 3PTLX 246 40.712 33.058 32.524 1.00 0.00 ATOM 1719 O1 3PTLX 246 40.492 33.432 31.161 1.00 0.00 ATOM 1720 H1 3PTLX 246 39.997 32.669 30.745 1.00 0.00 ATOM 1721 C4 3PTLX 246 41.674 31.879 32.674 1.00 0.00 ATOM 1722 C5 3PTLX 246 41.070 31.051 33.810 1.00 0.00 ATOM 1723 C1 3PTLX 247 12.153 19.868 8.587 1.00 0.00 ATOM 1724 C2 3PTLX 247 10.797 19.318 8.137 1.00 0.00 ATOM 1725 C3 3PTLX 247 10.787 17.817 7.842 1.00 0.00 ATOM 1726 O1 3PTLX 247 11.452 16.895 8.710 1.00 0.00 ATOM 1727 H1 3PTLX 247 10.706 16.556 9.284 1.00 0.00 ATOM 1728 C4 3PTLX 247 9.428 17.345 7.322 1.00 0.00 ATOM 1729 C5 3PTLX 247 9.283 17.826 5.876 1.00 0.00 ATOM 1730 C1 3PTLX 248 31.108 35.687 24.368 1.00 0.00 ATOM 1731 C2 3PTLX 248 30.022 36.621 23.831 1.00 0.00 ATOM 1732 C3 3PTLX 248 30.447 37.588 22.724 1.00 0.00 ATOM 1733 O1 3PTLX 248 30.270 37.067 21.404 1.00 0.00 ATOM 1734 H1 3PTLX 248 29.294 37.073 21.187 1.00 0.00 ATOM 1735 C4 3PTLX 248 29.845 38.993 22.790 1.00 0.00 ATOM 1736 C5 3PTLX 248 28.328 38.957 22.987 1.00 0.00 ATOM 1737 C1 3PTLX 249 45.385 3.634 10.532 1.00 0.00 ATOM 1738 C2 3PTLX 249 46.727 2.905 10.630 1.00 0.00 ATOM 1739 C3 3PTLX 249 0.993 1.381 10.706 1.00 0.00 ATOM 1740 O1 3PTLX 249 0.429 0.857 9.501 1.00 0.00 ATOM 1741 H1 3PTLX 249 0.589 -0.119 9.354 1.00 0.00 ATOM 1742 C4 3PTLX 249 2.397 0.784 10.822 1.00 0.00 ATOM 1743 C5 3PTLX 249 2.394 -0.647 11.363 1.00 0.00 ATOM 1744 C1 3PTLX 250 4.227 30.866 1.827 1.00 0.00 ATOM 1745 C2 3PTLX 250 4.764 31.987 2.719 1.00 0.00 ATOM 1746 C3 3PTLX 250 5.200 31.470 4.092 1.00 0.00 ATOM 1747 O1 3PTLX 250 5.962 32.456 4.794 1.00 0.00 ATOM 1748 H1 3PTLX 250 5.623 33.378 4.606 1.00 0.00 ATOM 1749 C4 3PTLX 250 3.942 31.144 4.899 1.00 0.00 ATOM 1750 C5 3PTLX 250 4.284 30.558 6.271 1.00 0.00 ATOM 1751 C1 3PTLX 251 12.759 24.146 33.447 1.00 0.00 ATOM 1752 C2 3PTLX 251 11.801 24.905 34.368 1.00 0.00 ATOM 1753 C3 3PTLX 251 11.177 24.084 35.498 1.00 0.00 ATOM 1754 O1 3PTLX 251 10.439 25.008 36.302 1.00 0.00 ATOM 1755 H1 3PTLX 251 11.108 25.338 36.968 1.00 0.00 ATOM 1756 C4 3PTLX 251 10.147 23.062 35.013 1.00 0.00 ATOM 1757 C5 3PTLX 251 9.958 22.135 36.215 1.00 0.00 ATOM 1758 C1 3PTLX 252 17.423 5.591 1.974 1.00 0.00 ATOM 1759 C2 3PTLX 252 16.712 6.086 0.713 1.00 0.00 ATOM 1760 C3 3PTLX 252 17.040 7.578 0.623 1.00 0.00 ATOM 1761 O1 3PTLX 252 18.361 7.883 0.169 1.00 0.00 ATOM 1762 H1 3PTLX 252 18.494 7.784 -0.817 1.00 0.00 ATOM 1763 C4 3PTLX 252 15.984 8.200 45.339 1.00 0.00 ATOM 1764 C5 3PTLX 252 16.152 9.707 45.547 1.00 0.00 ATOM 1765 C1 3PTLX 253 8.010 22.248 26.159 1.00 0.00 ATOM 1766 C2 3PTLX 253 6.775 22.262 27.063 1.00 0.00 ATOM 1767 C3 3PTLX 253 6.978 22.892 28.442 1.00 0.00 ATOM 1768 O1 3PTLX 253 8.249 22.740 29.080 1.00 0.00 ATOM 1769 H1 3PTLX 253 8.858 23.295 28.514 1.00 0.00 ATOM 1770 C4 3PTLX 253 6.472 24.335 28.473 1.00 0.00 ATOM 1771 C5 3PTLX 253 6.680 25.105 29.779 1.00 0.00 ATOM 1772 C1 3PTLX 254 11.474 17.183 28.921 1.00 0.00 ATOM 1773 C2 3PTLX 254 10.353 17.002 27.895 1.00 0.00 ATOM 1774 C3 3PTLX 254 9.108 17.790 28.309 1.00 0.00 ATOM 1775 O1 3PTLX 254 9.474 19.172 28.328 1.00 0.00 ATOM 1776 H1 3PTLX 254 9.122 19.633 29.142 1.00 0.00 ATOM 1777 C4 3PTLX 254 7.879 17.615 27.414 1.00 0.00 ATOM 1778 C5 3PTLX 254 7.025 16.354 27.560 1.00 0.00 ATOM 1779 C1 3PTLX 255 32.133 27.265 24.758 1.00 0.00 ATOM 1780 C2 3PTLX 255 31.626 27.993 26.005 1.00 0.00 ATOM 1781 C3 3PTLX 255 31.699 29.521 26.028 1.00 0.00 ATOM 1782 O1 3PTLX 255 30.683 30.217 25.300 1.00 0.00 ATOM 1783 H1 3PTLX 255 29.993 30.484 25.972 1.00 0.00 ATOM 1784 C4 3PTLX 255 31.742 30.241 27.377 1.00 0.00 ATOM 1785 C5 3PTLX 255 32.328 31.653 27.326 1.00 0.00 ATOM 1786 C1 3PTLX 256 27.274 4.173 31.845 1.00 0.00 ATOM 1787 C2 3PTLX 256 27.114 2.754 31.294 1.00 0.00 ATOM 1788 C3 3PTLX 256 25.988 2.516 30.286 1.00 0.00 ATOM 1789 O1 3PTLX 256 26.233 1.484 29.326 1.00 0.00 ATOM 1790 H1 3PTLX 256 27.129 1.483 28.882 1.00 0.00 ATOM 1791 C4 3PTLX 256 24.594 2.252 30.860 1.00 0.00 ATOM 1792 C5 3PTLX 256 24.392 1.315 32.053 1.00 0.00 ATOM 1793 C1 3PTLX 257 31.796 33.175 44.229 1.00 0.00 ATOM 1794 C2 3PTLX 257 31.363 31.846 43.607 1.00 0.00 ATOM 1795 C3 3PTLX 257 30.064 31.393 44.276 1.00 0.00 ATOM 1796 O1 3PTLX 257 29.122 32.412 43.930 1.00 0.00 ATOM 1797 H1 3PTLX 257 28.907 32.918 44.765 1.00 0.00 ATOM 1798 C4 3PTLX 257 29.627 30.028 43.742 1.00 0.00 ATOM 1799 C5 3PTLX 257 30.379 28.770 44.179 1.00 0.00 ATOM 1800 C1 3PTLX 258 41.951 41.356 12.718 1.00 0.00 ATOM 1801 C2 3PTLX 258 43.429 41.025 12.506 1.00 0.00 ATOM 1802 C3 3PTLX 258 44.338 42.203 12.863 1.00 0.00 ATOM 1803 O1 3PTLX 258 44.108 42.847 14.119 1.00 0.00 ATOM 1804 H1 3PTLX 258 44.612 43.698 14.268 1.00 0.00 ATOM 1805 C4 3PTLX 258 0.180 41.788 12.872 1.00 0.00 ATOM 1806 C5 3PTLX 258 0.785 41.321 11.547 1.00 0.00 ATOM 1807 C1 3PTLX 259 18.965 22.287 28.286 1.00 0.00 ATOM 1808 C2 3PTLX 259 17.959 23.326 28.785 1.00 0.00 ATOM 1809 C3 3PTLX 259 16.815 22.657 29.550 1.00 0.00 ATOM 1810 O1 3PTLX 259 17.293 21.990 30.721 1.00 0.00 ATOM 1811 H1 3PTLX 259 17.724 21.126 30.460 1.00 0.00 ATOM 1812 C4 3PTLX 259 15.718 23.637 29.969 1.00 0.00 ATOM 1813 C5 3PTLX 259 16.223 24.689 30.959 1.00 0.00 ATOM 1814 C1 3PTLX 260 26.133 32.668 27.943 1.00 0.00 ATOM 1815 C2 3PTLX 260 26.257 32.348 26.452 1.00 0.00 ATOM 1816 C3 3PTLX 260 27.692 32.318 25.922 1.00 0.00 ATOM 1817 O1 3PTLX 260 28.417 31.280 26.585 1.00 0.00 ATOM 1818 H1 3PTLX 260 28.063 30.375 26.348 1.00 0.00 ATOM 1819 C4 3PTLX 260 27.658 32.067 24.413 1.00 0.00 ATOM 1820 C5 3PTLX 260 27.355 33.424 23.775 1.00 0.00 ATOM 1821 C1 3PTLX 261 23.709 7.760 37.383 1.00 0.00 ATOM 1822 C2 3PTLX 261 24.457 6.558 36.804 1.00 0.00 ATOM 1823 C3 3PTLX 261 25.021 6.657 35.385 1.00 0.00 ATOM 1824 O1 3PTLX 261 26.319 7.218 35.595 1.00 0.00 ATOM 1825 H1 3PTLX 261 26.300 8.202 35.420 1.00 0.00 ATOM 1826 C4 3PTLX 261 25.075 5.293 34.694 1.00 0.00 ATOM 1827 C5 3PTLX 261 23.666 4.769 34.412 1.00 0.00 ATOM 1828 C1 3PTLX 262 0.654 31.507 0.398 1.00 0.00 ATOM 1829 C2 3PTLX 262 -0.825 31.264 0.089 1.00 0.00 ATOM 1830 C3 3PTLX 262 43.788 31.144 1.226 1.00 0.00 ATOM 1831 O1 3PTLX 262 43.742 32.388 1.929 1.00 0.00 ATOM 1832 H1 3PTLX 262 43.631 32.203 2.906 1.00 0.00 ATOM 1833 C4 3PTLX 262 42.394 30.924 0.635 1.00 0.00 ATOM 1834 C5 3PTLX 262 41.365 30.650 1.733 1.00 0.00 ATOM 1835 C1 3PTLX 263 13.409 22.918 26.638 1.00 0.00 ATOM 1836 C2 3PTLX 263 12.696 21.967 25.675 1.00 0.00 ATOM 1837 C3 3PTLX 263 11.951 20.806 26.336 1.00 0.00 ATOM 1838 O1 3PTLX 263 10.885 21.366 27.107 1.00 0.00 ATOM 1839 H1 3PTLX 263 10.320 20.566 27.305 1.00 0.00 ATOM 1840 C4 3PTLX 263 11.337 19.849 25.312 1.00 0.00 ATOM 1841 C5 3PTLX 263 12.454 19.173 24.516 1.00 0.00 ATOM 1842 C1 3PTLX 264 24.558 6.471 17.463 1.00 0.00 ATOM 1843 C2 3PTLX 264 23.812 5.917 16.247 1.00 0.00 ATOM 1844 C3 3PTLX 264 23.315 7.160 15.507 1.00 0.00 ATOM 1845 O1 3PTLX 264 24.347 7.826 14.774 1.00 0.00 ATOM 1846 H1 3PTLX 264 24.105 8.790 14.672 1.00 0.00 ATOM 1847 C4 3PTLX 264 22.074 6.779 14.698 1.00 0.00 ATOM 1848 C5 3PTLX 264 21.237 7.963 14.208 1.00 0.00 ATOM 1849 C1 3PTLX 265 25.140 26.592 37.644 1.00 0.00 ATOM 1850 C2 3PTLX 265 25.475 25.283 38.362 1.00 0.00 ATOM 1851 C3 3PTLX 265 25.765 25.251 39.865 1.00 0.00 ATOM 1852 O1 3PTLX 265 24.573 25.583 40.582 1.00 0.00 ATOM 1853 H1 3PTLX 265 24.677 26.129 41.413 1.00 0.00 ATOM 1854 C4 3PTLX 265 26.208 23.854 40.302 1.00 0.00 ATOM 1855 C5 3PTLX 265 27.679 23.569 39.996 1.00 0.00 ATOM 1856 C1 3PTLX 266 23.182 40.896 15.992 1.00 0.00 ATOM 1857 C2 3PTLX 266 22.301 40.031 15.089 1.00 0.00 ATOM 1858 C3 3PTLX 266 22.228 38.662 15.768 1.00 0.00 ATOM 1859 O1 3PTLX 266 20.943 38.118 15.457 1.00 0.00 ATOM 1860 H1 3PTLX 266 20.337 38.249 16.241 1.00 0.00 ATOM 1861 C4 3PTLX 266 23.501 37.894 15.406 1.00 0.00 ATOM 1862 C5 3PTLX 266 23.891 36.810 16.414 1.00 0.00 ATOM 1863 C1 3PTLX 267 13.245 33.945 31.523 1.00 0.00 ATOM 1864 C2 3PTLX 267 14.647 34.239 30.985 1.00 0.00 ATOM 1865 C3 3PTLX 267 15.437 32.941 30.805 1.00 0.00 ATOM 1866 O1 3PTLX 267 14.690 32.054 29.969 1.00 0.00 ATOM 1867 H1 3PTLX 267 14.545 32.415 29.048 1.00 0.00 ATOM 1868 C4 3PTLX 267 16.791 33.155 30.124 1.00 0.00 ATOM 1869 C5 3PTLX 267 17.727 33.389 31.312 1.00 0.00 ATOM 1870 C1 3PTLX 268 22.744 26.629 5.874 1.00 0.00 ATOM 1871 C2 3PTLX 268 23.401 26.775 4.500 1.00 0.00 ATOM 1872 C3 3PTLX 268 24.676 27.607 4.650 1.00 0.00 ATOM 1873 O1 3PTLX 268 24.363 28.954 5.017 1.00 0.00 ATOM 1874 H1 3PTLX 268 23.601 29.209 4.422 1.00 0.00 ATOM 1875 C4 3PTLX 268 25.684 26.971 5.608 1.00 0.00 ATOM 1876 C5 3PTLX 268 26.954 27.822 5.554 1.00 0.00 ATOM 1877 C1 3PTLX 269 32.414 37.893 27.388 1.00 0.00 ATOM 1878 C2 3PTLX 269 33.879 37.702 26.989 1.00 0.00 ATOM 1879 C3 3PTLX 269 34.294 38.684 25.893 1.00 0.00 ATOM 1880 O1 3PTLX 269 34.533 40.023 26.336 1.00 0.00 ATOM 1881 H1 3PTLX 269 33.678 40.387 26.705 1.00 0.00 ATOM 1882 C4 3PTLX 269 35.526 38.092 25.206 1.00 0.00 ATOM 1883 C5 3PTLX 269 35.055 37.124 24.119 1.00 0.00 ATOM 1884 C1 3PTLX 270 28.399 23.501 5.890 1.00 0.00 ATOM 1885 C2 3PTLX 270 29.471 24.563 6.138 1.00 0.00 ATOM 1886 C3 3PTLX 270 30.879 24.043 5.840 1.00 0.00 ATOM 1887 O1 3PTLX 270 31.230 24.593 4.568 1.00 0.00 ATOM 1888 H1 3PTLX 270 30.607 24.261 3.860 1.00 0.00 ATOM 1889 C4 3PTLX 270 31.899 24.561 6.855 1.00 0.00 ATOM 1890 C5 3PTLX 270 33.318 24.456 6.293 1.00 0.00 ATOM 1891 C1 3PTLX 271 19.675 4.155 7.883 1.00 0.00 ATOM 1892 C2 3PTLX 271 19.990 4.296 6.393 1.00 0.00 ATOM 1893 C3 3PTLX 271 20.720 3.114 5.752 1.00 0.00 ATOM 1894 O1 3PTLX 271 19.807 2.107 5.310 1.00 0.00 ATOM 1895 H1 3PTLX 271 20.171 1.226 5.007 1.00 0.00 ATOM 1896 C4 3PTLX 271 21.514 3.666 4.566 1.00 0.00 ATOM 1897 C5 3PTLX 271 22.597 2.680 4.124 1.00 0.00 ATOM 1898 C1 3PTLX 272 0.207 32.164 5.067 1.00 0.00 ATOM 1899 C2 3PTLX 272 -0.748 31.081 5.574 1.00 0.00 ATOM 1900 C3 3PTLX 272 43.495 31.709 5.726 1.00 0.00 ATOM 1901 O1 3PTLX 272 42.970 32.261 4.516 1.00 0.00 ATOM 1902 H1 3PTLX 272 42.210 32.863 4.762 1.00 0.00 ATOM 1903 C4 3PTLX 272 42.408 30.796 6.297 1.00 0.00 ATOM 1904 C5 3PTLX 272 42.762 30.055 7.588 1.00 0.00 ATOM 1905 C1 3PTLX 273 4.331 2.205 44.870 1.00 0.00 ATOM 1906 C2 3PTLX 273 4.996 2.376 43.503 1.00 0.00 ATOM 1907 C3 3PTLX 273 3.849 2.651 42.527 1.00 0.00 ATOM 1908 O1 3PTLX 273 3.288 3.956 42.692 1.00 0.00 ATOM 1909 H1 3PTLX 273 2.309 3.896 42.885 1.00 0.00 ATOM 1910 C4 3PTLX 273 4.517 2.577 41.153 1.00 0.00 ATOM 1911 C5 3PTLX 273 3.657 3.186 40.044 1.00 0.00 ATOM 1912 C1 3PTLX 274 6.693 27.224 23.287 1.00 0.00 ATOM 1913 C2 3PTLX 274 5.444 26.411 23.636 1.00 0.00 ATOM 1914 C3 3PTLX 274 4.675 27.042 24.798 1.00 0.00 ATOM 1915 O1 3PTLX 274 4.060 28.276 24.420 1.00 0.00 ATOM 1916 H1 3PTLX 274 3.630 28.610 25.259 1.00 0.00 ATOM 1917 C4 3PTLX 274 3.497 26.145 25.184 1.00 0.00 ATOM 1918 C5 3PTLX 274 3.793 24.856 25.954 1.00 0.00 ATOM 1919 C1 3PTLX 275 40.208 19.743 21.832 1.00 0.00 ATOM 1920 C2 3PTLX 275 38.712 19.506 21.612 1.00 0.00 ATOM 1921 C3 3PTLX 275 38.559 18.356 20.614 1.00 0.00 ATOM 1922 O1 3PTLX 275 39.081 17.116 21.097 1.00 0.00 ATOM 1923 H1 3PTLX 275 38.485 16.561 21.677 1.00 0.00 ATOM 1924 C4 3PTLX 275 37.124 18.244 20.094 1.00 0.00 ATOM 1925 C5 3PTLX 275 36.569 19.467 19.360 1.00 0.00 ATOM 1926 C1 3PTLX 276 31.685 3.998 31.540 1.00 0.00 ATOM 1927 C2 3PTLX 276 30.951 2.829 30.881 1.00 0.00 ATOM 1928 C3 3PTLX 276 31.489 1.473 31.343 1.00 0.00 ATOM 1929 O1 3PTLX 276 30.417 0.598 30.980 1.00 0.00 ATOM 1930 H1 3PTLX 276 30.209 0.071 31.804 1.00 0.00 ATOM 1931 C4 3PTLX 276 32.760 0.934 30.684 1.00 0.00 ATOM 1932 C5 3PTLX 276 32.774 0.921 29.154 1.00 0.00 ATOM 1933 C1 3PTLX 277 37.539 8.933 23.722 1.00 0.00 ATOM 1934 C2 3PTLX 277 36.031 8.694 23.815 1.00 0.00 ATOM 1935 C3 3PTLX 277 35.237 8.403 22.541 1.00 0.00 ATOM 1936 O1 3PTLX 277 33.881 8.166 22.929 1.00 0.00 ATOM 1937 H1 3PTLX 277 33.664 7.241 22.618 1.00 0.00 ATOM 1938 C4 3PTLX 277 35.457 9.682 21.731 1.00 0.00 ATOM 1939 C5 3PTLX 277 34.770 9.801 20.369 1.00 0.00 ATOM 1940 C1 3PTLX 278 44.706 44.455 34.965 1.00 0.00 ATOM 1941 C2 3PTLX 278 43.931 45.681 35.452 1.00 0.00 ATOM 1942 C3 3PTLX 278 42.975 0.739 34.476 1.00 0.00 ATOM 1943 O1 3PTLX 278 42.058 -0.234 33.968 1.00 0.00 ATOM 1944 H1 3PTLX 278 41.278 -0.366 34.579 1.00 0.00 ATOM 1945 C4 3PTLX 278 42.167 1.747 35.295 1.00 0.00 ATOM 1946 C5 3PTLX 278 41.430 2.696 34.347 1.00 0.00 ATOM 1947 C1 3PTLX 279 22.989 1.867 9.471 1.00 0.00 ATOM 1948 C2 3PTLX 279 24.357 1.541 10.074 1.00 0.00 ATOM 1949 C3 3PTLX 279 24.202 0.729 11.361 1.00 0.00 ATOM 1950 O1 3PTLX 279 23.609 -0.551 11.128 1.00 0.00 ATOM 1951 H1 3PTLX 279 23.397 -0.557 10.151 1.00 0.00 ATOM 1952 C4 3PTLX 279 25.617 0.659 11.939 1.00 0.00 ATOM 1953 C5 3PTLX 279 26.587 -0.376 11.364 1.00 0.00 ATOM 1954 C1 3PTLX 280 28.731 38.487 14.066 1.00 0.00 ATOM 1955 C2 3PTLX 280 28.366 38.386 15.549 1.00 0.00 ATOM 1956 C3 3PTLX 280 29.101 37.279 16.307 1.00 0.00 ATOM 1957 O1 3PTLX 280 28.890 37.412 17.715 1.00 0.00 ATOM 1958 H1 3PTLX 280 29.362 38.226 18.056 1.00 0.00 ATOM 1959 C4 3PTLX 280 28.530 35.900 15.974 1.00 0.00 ATOM 1960 C5 3PTLX 280 29.266 34.655 16.473 1.00 0.00 ATOM 1961 C1 3PTLX 281 26.398 30.840 17.970 1.00 0.00 ATOM 1962 C2 3PTLX 281 27.679 30.992 17.147 1.00 0.00 ATOM 1963 C3 3PTLX 281 28.503 29.703 17.168 1.00 0.00 ATOM 1964 O1 3PTLX 281 27.869 28.583 16.546 1.00 0.00 ATOM 1965 H1 3PTLX 281 28.490 27.918 16.131 1.00 0.00 ATOM 1966 C4 3PTLX 281 29.802 29.970 16.404 1.00 0.00 ATOM 1967 C5 3PTLX 281 30.746 28.767 16.472 1.00 0.00 ATOM 1968 C1 3PTLX 282 14.262 40.011 25.689 1.00 0.00 ATOM 1969 C2 3PTLX 282 15.365 40.665 26.525 1.00 0.00 ATOM 1970 C3 3PTLX 282 14.626 41.578 27.505 1.00 0.00 ATOM 1971 O1 3PTLX 282 13.687 40.919 28.358 1.00 0.00 ATOM 1972 H1 3PTLX 282 12.850 41.459 28.444 1.00 0.00 ATOM 1973 C4 3PTLX 282 15.584 42.457 28.311 1.00 0.00 ATOM 1974 C5 3PTLX 282 14.946 43.436 29.299 1.00 0.00 ATOM 1975 C1 3PTLX 283 24.904 12.354 30.197 1.00 0.00 ATOM 1976 C2 3PTLX 283 23.838 13.353 29.743 1.00 0.00 ATOM 1977 C3 3PTLX 283 22.390 12.887 29.910 1.00 0.00 ATOM 1978 O1 3PTLX 283 22.138 11.592 29.360 1.00 0.00 ATOM 1979 H1 3PTLX 283 22.562 10.817 29.829 1.00 0.00 ATOM 1980 C4 3PTLX 283 22.021 12.991 31.392 1.00 0.00 ATOM 1981 C5 3PTLX 283 21.762 14.415 31.886 1.00 0.00 ATOM 1982 C1 3PTLX 284 30.388 31.052 34.749 1.00 0.00 ATOM 1983 C2 3PTLX 284 31.625 31.878 35.108 1.00 0.00 ATOM 1984 C3 3PTLX 284 32.598 31.156 36.043 1.00 0.00 ATOM 1985 O1 3PTLX 284 32.553 29.727 36.030 1.00 0.00 ATOM 1986 H1 3PTLX 284 32.286 29.473 36.960 1.00 0.00 ATOM 1987 C4 3PTLX 284 33.983 31.619 35.588 1.00 0.00 ATOM 1988 C5 3PTLX 284 34.987 31.585 36.742 1.00 0.00 ATOM 1989 C1 3PTLX 285 16.882 29.889 22.633 1.00 0.00 ATOM 1990 C2 3PTLX 285 17.549 28.941 21.634 1.00 0.00 ATOM 1991 C3 3PTLX 285 19.060 29.177 21.682 1.00 0.00 ATOM 1992 O1 3PTLX 285 19.555 28.650 22.915 1.00 0.00 ATOM 1993 H1 3PTLX 285 20.555 28.637 22.898 1.00 0.00 ATOM 1994 C4 3PTLX 285 19.816 28.472 20.554 1.00 0.00 ATOM 1995 C5 3PTLX 285 19.728 29.370 19.319 1.00 0.00 ATOM 1996 C1 3PTLX 286 17.587 34.604 13.073 1.00 0.00 ATOM 1997 C2 3PTLX 286 18.754 35.096 12.215 1.00 0.00 ATOM 1998 C3 3PTLX 286 19.327 36.390 12.796 1.00 0.00 ATOM 1999 O1 3PTLX 286 19.691 36.205 14.166 1.00 0.00 ATOM 2000 H1 3PTLX 286 20.251 36.989 14.432 1.00 0.00 ATOM 2001 C4 3PTLX 286 20.518 36.886 11.974 1.00 0.00 ATOM 2002 C5 3PTLX 286 19.950 37.308 10.618 1.00 0.00 ATOM 2003 C1 3PTLX 287 37.181 39.944 3.751 1.00 0.00 ATOM 2004 C2 3PTLX 287 36.194 39.012 3.044 1.00 0.00 ATOM 2005 C3 3PTLX 287 35.514 39.547 1.782 1.00 0.00 ATOM 2006 O1 3PTLX 287 36.393 40.059 0.777 1.00 0.00 ATOM 2007 H1 3PTLX 287 36.388 39.336 0.087 1.00 0.00 ATOM 2008 C4 3PTLX 287 34.603 38.520 1.106 1.00 0.00 ATOM 2009 C5 3PTLX 287 33.311 38.419 1.920 1.00 0.00 ATOM 2010 C1 3PTLX 288 32.531 11.481 32.721 1.00 0.00 ATOM 2011 C2 3PTLX 288 31.831 10.378 33.518 1.00 0.00 ATOM 2012 C3 3PTLX 288 32.416 8.965 33.496 1.00 0.00 ATOM 2013 O1 3PTLX 288 32.376 8.312 32.225 1.00 0.00 ATOM 2014 H1 3PTLX 288 31.527 8.580 31.768 1.00 0.00 ATOM 2015 C4 3PTLX 288 33.867 9.034 33.977 1.00 0.00 ATOM 2016 C5 3PTLX 288 33.967 9.441 35.448 1.00 0.00 ATOM 2017 C1 3PTLX 289 20.033 1.517 36.737 1.00 0.00 ATOM 2018 C2 3PTLX 289 18.871 2.301 37.349 1.00 0.00 ATOM 2019 C3 3PTLX 289 18.493 3.516 36.500 1.00 0.00 ATOM 2020 O1 3PTLX 289 17.320 3.440 35.685 1.00 0.00 ATOM 2021 H1 3PTLX 289 17.284 3.909 34.803 1.00 0.00 ATOM 2022 C4 3PTLX 289 18.442 4.828 37.285 1.00 0.00 ATOM 2023 C5 3PTLX 289 19.828 5.181 37.828 1.00 0.00 ATOM 2024 C1 3PTLX 290 39.317 28.777 36.530 1.00 0.00 ATOM 2025 C2 3PTLX 290 40.299 27.607 36.627 1.00 0.00 ATOM 2026 C3 3PTLX 290 40.754 27.503 38.084 1.00 0.00 ATOM 2027 O1 3PTLX 290 39.781 26.890 38.935 1.00 0.00 ATOM 2028 H1 3PTLX 290 39.820 27.116 39.909 1.00 0.00 ATOM 2029 C4 3PTLX 290 42.158 26.898 38.145 1.00 0.00 ATOM 2030 C5 3PTLX 290 42.771 26.965 39.546 1.00 0.00 ATOM 2031 C1 3PTLX 291 11.631 4.015 24.434 1.00 0.00 ATOM 2032 C2 3PTLX 291 12.665 3.075 23.811 1.00 0.00 ATOM 2033 C3 3PTLX 291 13.589 3.692 22.759 1.00 0.00 ATOM 2034 O1 3PTLX 291 14.371 4.717 23.379 1.00 0.00 ATOM 2035 H1 3PTLX 291 14.268 4.592 24.366 1.00 0.00 ATOM 2036 C4 3PTLX 291 14.451 2.651 22.044 1.00 0.00 ATOM 2037 C5 3PTLX 291 13.802 1.723 21.016 1.00 0.00 ATOM 2038 C1 3PTLX 292 7.088 27.477 1.999 1.00 0.00 ATOM 2039 C2 3PTLX 292 8.268 26.505 2.053 1.00 0.00 ATOM 2040 C3 3PTLX 292 8.615 26.237 3.519 1.00 0.00 ATOM 2041 O1 3PTLX 292 7.761 25.439 4.342 1.00 0.00 ATOM 2042 H1 3PTLX 292 6.897 25.929 4.459 1.00 0.00 ATOM 2043 C4 3PTLX 292 10.007 25.633 3.718 1.00 0.00 ATOM 2044 C5 3PTLX 292 10.385 24.466 2.803 1.00 0.00 ATOM 2045 C1 3PTLX 293 1.248 16.475 27.217 1.00 0.00 ATOM 2046 C2 3PTLX 293 -0.153 16.541 27.828 1.00 0.00 ATOM 2047 C3 3PTLX 293 45.402 17.598 28.932 1.00 0.00 ATOM 2048 O1 3PTLX 293 45.740 18.949 28.608 1.00 0.00 ATOM 2049 H1 3PTLX 293 44.942 19.186 28.054 1.00 0.00 ATOM 2050 C4 3PTLX 293 44.027 17.657 29.601 1.00 0.00 ATOM 2051 C5 3PTLX 293 43.817 16.370 30.401 1.00 0.00 ATOM 2052 C1 3PTLX 294 36.700 39.221 40.649 1.00 0.00 ATOM 2053 C2 3PTLX 294 37.094 38.118 41.634 1.00 0.00 ATOM 2054 C3 3PTLX 294 37.534 38.579 43.025 1.00 0.00 ATOM 2055 O1 3PTLX 294 36.485 39.282 43.696 1.00 0.00 ATOM 2056 H1 3PTLX 294 36.382 40.198 43.308 1.00 0.00 ATOM 2057 C4 3PTLX 294 37.925 37.290 43.750 1.00 0.00 ATOM 2058 C5 3PTLX 294 38.807 37.606 44.961 1.00 0.00 ATOM 2059 C1 3PTLX 295 2.600 42.372 8.161 1.00 0.00 ATOM 2060 C2 3PTLX 295 2.619 41.827 6.732 1.00 0.00 ATOM 2061 C3 3PTLX 295 1.305 41.139 6.356 1.00 0.00 ATOM 2062 O1 3PTLX 295 0.446 42.117 5.763 1.00 0.00 ATOM 2063 H1 3PTLX 295 -0.475 41.938 6.110 1.00 0.00 ATOM 2064 C4 3PTLX 295 1.518 39.975 5.387 1.00 0.00 ATOM 2065 C5 3PTLX 295 0.257 39.126 5.208 1.00 0.00 ATOM 2066 C1 3PTLX 296 39.169 3.398 44.958 1.00 0.00 ATOM 2067 C2 3PTLX 296 38.479 2.825 43.719 1.00 0.00 ATOM 2068 C3 3PTLX 296 37.090 3.400 43.432 1.00 0.00 ATOM 2069 O1 3PTLX 296 37.091 4.640 42.720 1.00 0.00 ATOM 2070 H1 3PTLX 296 36.179 4.682 42.313 1.00 0.00 ATOM 2071 C4 3PTLX 296 36.211 2.414 42.660 1.00 0.00 ATOM 2072 C5 3PTLX 296 36.855 1.824 41.403 1.00 0.00 ATOM 2073 C1 3PTLX 297 20.481 21.231 21.706 1.00 0.00 ATOM 2074 C2 3PTLX 297 19.059 20.934 21.226 1.00 0.00 ATOM 2075 C3 3PTLX 297 18.775 19.442 21.040 1.00 0.00 ATOM 2076 O1 3PTLX 297 19.259 18.586 22.079 1.00 0.00 ATOM 2077 H1 3PTLX 297 19.076 17.702 21.650 1.00 0.00 ATOM 2078 C4 3PTLX 297 17.256 19.293 20.936 1.00 0.00 ATOM 2079 C5 3PTLX 297 16.926 17.868 20.488 1.00 0.00 ATOM 2080 C1 3PTLX 298 34.108 41.248 22.161 1.00 0.00 ATOM 2081 C2 3PTLX 298 34.610 42.523 22.843 1.00 0.00 ATOM 2082 C3 3PTLX 298 33.509 43.098 23.737 1.00 0.00 ATOM 2083 O1 3PTLX 298 33.425 42.351 24.953 1.00 0.00 ATOM 2084 H1 3PTLX 298 34.169 41.683 24.987 1.00 0.00 ATOM 2085 C4 3PTLX 298 33.881 44.531 24.120 1.00 0.00 ATOM 2086 C5 3PTLX 298 32.734 45.275 24.806 1.00 0.00 ATOM 2087 C1 3PTLX 299 27.625 13.073 9.919 1.00 0.00 ATOM 2088 C2 3PTLX 299 28.679 14.165 9.729 1.00 0.00 ATOM 2089 C3 3PTLX 299 29.293 14.552 11.076 1.00 0.00 ATOM 2090 O1 3PTLX 299 30.400 15.452 10.982 1.00 0.00 ATOM 2091 H1 3PTLX 299 30.228 16.238 11.575 1.00 0.00 ATOM 2092 C4 3PTLX 299 28.310 15.216 12.042 1.00 0.00 ATOM 2093 C5 3PTLX 299 27.976 16.646 11.613 1.00 0.00 ATOM 2094 C1 3PTLX 300 10.742 25.794 30.371 1.00 0.00 ATOM 2095 C2 3PTLX 300 10.302 26.173 28.956 1.00 0.00 ATOM 2096 C3 3PTLX 300 10.802 25.182 27.903 1.00 0.00 ATOM 2097 O1 3PTLX 300 10.188 23.891 27.928 1.00 0.00 ATOM 2098 H1 3PTLX 300 10.795 23.226 27.495 1.00 0.00 ATOM 2099 C4 3PTLX 300 10.675 25.802 26.510 1.00 0.00 ATOM 2100 C5 3PTLX 300 9.271 26.246 26.094 1.00 0.00 ATOM 2101 C1 3PTLX 301 15.691 10.621 11.144 1.00 0.00 ATOM 2102 C2 3PTLX 301 17.210 10.590 10.957 1.00 0.00 ATOM 2103 C3 3PTLX 301 18.060 10.260 12.185 1.00 0.00 ATOM 2104 O1 3PTLX 301 19.464 10.215 11.915 1.00 0.00 ATOM 2105 H1 3PTLX 301 19.773 11.165 11.966 1.00 0.00 ATOM 2106 C4 3PTLX 301 17.747 11.302 13.261 1.00 0.00 ATOM 2107 C5 3PTLX 301 18.485 10.923 14.546 1.00 0.00 ATOM 2108 C1 3PTLX 302 35.078 34.651 0.722 1.00 0.00 ATOM 2109 C2 3PTLX 302 35.001 34.250 2.196 1.00 0.00 ATOM 2110 C3 3PTLX 302 33.559 33.971 2.625 1.00 0.00 ATOM 2111 O1 3PTLX 302 33.171 32.648 2.246 1.00 0.00 ATOM 2112 H1 3PTLX 302 32.235 32.350 2.436 1.00 0.00 ATOM 2113 C4 3PTLX 302 33.428 34.075 4.145 1.00 0.00 ATOM 2114 C5 3PTLX 302 33.400 35.540 4.586 1.00 0.00 ATOM 2115 C1 3PTLX 303 35.046 15.514 36.676 1.00 0.00 ATOM 2116 C2 3PTLX 303 35.787 14.257 37.137 1.00 0.00 ATOM 2117 C3 3PTLX 303 35.896 13.123 36.116 1.00 0.00 ATOM 2118 O1 3PTLX 303 36.380 13.671 34.888 1.00 0.00 ATOM 2119 H1 3PTLX 303 36.318 14.667 34.953 1.00 0.00 ATOM 2120 C4 3PTLX 303 36.882 12.054 36.590 1.00 0.00 ATOM 2121 C5 3PTLX 303 36.317 11.449 37.876 1.00 0.00 ATOM 2122 C1 3PTLX 304 17.341 0.737 18.175 1.00 0.00 ATOM 2123 C2 3PTLX 304 17.662 2.207 18.452 1.00 0.00 ATOM 2124 C3 3PTLX 304 18.196 2.897 17.195 1.00 0.00 ATOM 2125 O1 3PTLX 304 17.098 2.918 16.279 1.00 0.00 ATOM 2126 H1 3PTLX 304 17.528 2.962 15.377 1.00 0.00 ATOM 2127 C4 3PTLX 304 18.675 4.229 17.777 1.00 0.00 ATOM 2128 C5 3PTLX 304 19.346 4.878 16.564 1.00 0.00 ATOM 2129 C1 3PTLX 305 43.360 41.560 29.717 1.00 0.00 ATOM 2130 C2 3PTLX 305 42.917 42.607 30.741 1.00 0.00 ATOM 2131 C3 3PTLX 305 41.631 42.134 31.422 1.00 0.00 ATOM 2132 O1 3PTLX 305 41.284 42.979 32.522 1.00 0.00 ATOM 2133 H1 3PTLX 305 41.994 43.575 32.896 1.00 0.00 ATOM 2134 C4 3PTLX 305 40.432 42.083 30.474 1.00 0.00 ATOM 2135 C5 3PTLX 305 39.183 41.331 30.938 1.00 0.00 ATOM 2136 C1 3PTLX 306 3.002 35.734 5.842 1.00 0.00 ATOM 2137 C2 3PTLX 306 3.664 36.400 4.634 1.00 0.00 ATOM 2138 C3 3PTLX 306 5.185 36.521 4.736 1.00 0.00 ATOM 2139 O1 3PTLX 306 5.790 35.226 4.784 1.00 0.00 ATOM 2140 H1 3PTLX 306 6.759 35.268 5.024 1.00 0.00 ATOM 2141 C4 3PTLX 306 5.578 37.473 3.604 1.00 0.00 ATOM 2142 C5 3PTLX 306 5.548 36.812 2.225 1.00 0.00 ATOM 2143 C1 3PTLX 307 17.887 8.543 24.120 1.00 0.00 ATOM 2144 C2 3PTLX 307 17.230 7.170 24.271 1.00 0.00 ATOM 2145 C3 3PTLX 307 17.160 6.534 22.881 1.00 0.00 ATOM 2146 O1 3PTLX 307 17.042 5.119 23.053 1.00 0.00 ATOM 2147 H1 3PTLX 307 16.065 4.931 23.156 1.00 0.00 ATOM 2148 C4 3PTLX 307 16.020 7.082 22.020 1.00 0.00 ATOM 2149 C5 3PTLX 307 15.939 6.467 20.622 1.00 0.00 ATOM 2150 C1 3PTLX 308 4.298 26.578 7.830 1.00 0.00 ATOM 2151 C2 3PTLX 308 3.447 26.203 6.614 1.00 0.00 ATOM 2152 C3 3PTLX 308 3.986 26.428 5.200 1.00 0.00 ATOM 2153 O1 3PTLX 308 5.293 25.902 4.956 1.00 0.00 ATOM 2154 H1 3PTLX 308 5.360 24.966 5.300 1.00 0.00 ATOM 2155 C4 3PTLX 308 2.974 25.940 4.160 1.00 0.00 ATOM 2156 C5 3PTLX 308 3.442 26.327 2.756 1.00 0.00 ATOM 2157 C1 3PTLX 309 25.794 2.739 38.019 1.00 0.00 ATOM 2158 C2 3PTLX 309 26.686 1.497 37.989 1.00 0.00 ATOM 2159 C3 3PTLX 309 28.052 1.597 37.307 1.00 0.00 ATOM 2160 O1 3PTLX 309 28.725 0.344 37.454 1.00 0.00 ATOM 2161 H1 3PTLX 309 28.454 -0.072 38.321 1.00 0.00 ATOM 2162 C4 3PTLX 309 27.955 1.947 35.821 1.00 0.00 ATOM 2163 C5 3PTLX 309 29.297 2.034 35.091 1.00 0.00 ATOM 2164 C1 3PTLX 310 10.409 4.785 33.118 1.00 0.00 ATOM 2165 C2 3PTLX 310 9.320 5.852 33.246 1.00 0.00 ATOM 2166 C3 3PTLX 310 8.098 5.643 32.350 1.00 0.00 ATOM 2167 O1 3PTLX 310 7.425 4.394 32.534 1.00 0.00 ATOM 2168 H1 3PTLX 310 6.459 4.460 32.284 1.00 0.00 ATOM 2169 C4 3PTLX 310 7.083 6.769 32.560 1.00 0.00 ATOM 2170 C5 3PTLX 310 7.580 8.208 32.410 1.00 0.00 ATOM 2171 C1 3PTLX 311 3.247 28.965 27.919 1.00 0.00 ATOM 2172 C2 3PTLX 311 1.933 29.733 27.763 1.00 0.00 ATOM 2173 C3 3PTLX 311 1.958 30.722 26.596 1.00 0.00 ATOM 2174 O1 3PTLX 311 2.160 30.007 25.374 1.00 0.00 ATOM 2175 H1 3PTLX 311 1.288 29.645 25.044 1.00 0.00 ATOM 2176 C4 3PTLX 311 0.684 31.569 26.585 1.00 0.00 ATOM 2177 C5 3PTLX 311 0.666 32.757 25.621 1.00 0.00 ATOM 2178 C1 3PTLX 312 16.317 15.305 17.894 1.00 0.00 ATOM 2179 C2 3PTLX 312 16.980 13.941 17.692 1.00 0.00 ATOM 2180 C3 3PTLX 312 16.644 13.059 18.896 1.00 0.00 ATOM 2181 O1 3PTLX 312 15.247 12.872 19.134 1.00 0.00 ATOM 2182 H1 3PTLX 312 14.793 12.678 18.264 1.00 0.00 ATOM 2183 C4 3PTLX 312 17.377 11.716 18.872 1.00 0.00 ATOM 2184 C5 3PTLX 312 17.081 10.805 20.065 1.00 0.00 ATOM 2185 C1 3PTLX 313 13.671 41.882 33.079 1.00 0.00 ATOM 2186 C2 3PTLX 313 12.200 41.593 33.387 1.00 0.00 ATOM 2187 C3 3PTLX 313 11.126 42.278 32.540 1.00 0.00 ATOM 2188 O1 3PTLX 313 11.112 41.658 31.251 1.00 0.00 ATOM 2189 H1 3PTLX 313 11.193 40.686 31.474 1.00 0.00 ATOM 2190 C4 3PTLX 313 9.906 41.829 33.348 1.00 0.00 ATOM 2191 C5 3PTLX 313 8.748 42.677 32.818 1.00 0.00 ATOM 2192 C1 3PTLX 314 20.996 14.259 35.833 1.00 0.00 ATOM 2193 C2 3PTLX 314 21.143 15.143 37.073 1.00 0.00 ATOM 2194 C3 3PTLX 314 22.594 15.517 37.383 1.00 0.00 ATOM 2195 O1 3PTLX 314 22.513 16.505 38.413 1.00 0.00 ATOM 2196 H1 3PTLX 314 22.752 16.017 39.253 1.00 0.00 ATOM 2197 C4 3PTLX 314 23.259 14.277 37.986 1.00 0.00 ATOM 2198 C5 3PTLX 314 24.788 14.272 37.994 1.00 0.00 ATOM 2199 C1 3PTLX 315 37.163 25.075 2.690 1.00 0.00 ATOM 2200 C2 3PTLX 315 35.990 24.180 3.093 1.00 0.00 ATOM 2201 C3 3PTLX 315 34.600 24.466 2.521 1.00 0.00 ATOM 2202 O1 3PTLX 315 33.564 23.596 2.985 1.00 0.00 ATOM 2203 H1 3PTLX 315 32.947 24.166 3.526 1.00 0.00 ATOM 2204 C4 3PTLX 315 34.259 25.886 2.975 1.00 0.00 ATOM 2205 C5 3PTLX 315 32.887 26.319 2.454 1.00 0.00 ATOM 2206 C1 3PTLX 316 22.063 11.698 15.401 1.00 0.00 ATOM 2207 C2 3PTLX 316 22.940 12.305 14.304 1.00 0.00 ATOM 2208 C3 3PTLX 316 24.413 11.895 14.363 1.00 0.00 ATOM 2209 O1 3PTLX 316 24.564 10.473 14.334 1.00 0.00 ATOM 2210 H1 3PTLX 316 25.379 10.304 13.780 1.00 0.00 ATOM 2211 C4 3PTLX 316 25.274 12.566 13.292 1.00 0.00 ATOM 2212 C5 3PTLX 316 25.511 14.065 13.491 1.00 0.00 ATOM 2213 C1 3PTLX 317 35.345 41.018 34.335 1.00 0.00 ATOM 2214 C2 3PTLX 317 35.248 40.737 35.836 1.00 0.00 ATOM 2215 C3 3PTLX 317 35.978 39.443 36.200 1.00 0.00 ATOM 2216 O1 3PTLX 317 35.313 38.205 35.936 1.00 0.00 ATOM 2217 H1 3PTLX 317 34.762 37.873 36.702 1.00 0.00 ATOM 2218 C4 3PTLX 317 37.373 39.391 35.572 1.00 0.00 ATOM 2219 C5 3PTLX 317 38.214 38.387 36.363 1.00 0.00 ATOM 2220 C1 3PTLX 318 26.832 38.553 29.312 1.00 0.00 ATOM 2221 C2 3PTLX 318 26.089 39.376 28.258 1.00 0.00 ATOM 2222 C3 3PTLX 318 24.899 38.691 27.583 1.00 0.00 ATOM 2223 O1 3PTLX 318 23.961 38.252 28.568 1.00 0.00 ATOM 2224 H1 3PTLX 318 23.117 38.784 28.626 1.00 0.00 ATOM 2225 C4 3PTLX 318 24.320 39.567 26.470 1.00 0.00 ATOM 2226 C5 3PTLX 318 25.389 39.943 25.442 1.00 0.00 ATOM 2227 C1 3PTLX 319 13.202 20.627 20.636 1.00 0.00 ATOM 2228 C2 3PTLX 319 12.635 20.716 19.217 1.00 0.00 ATOM 2229 C3 3PTLX 319 11.285 21.435 19.258 1.00 0.00 ATOM 2230 O1 3PTLX 319 11.505 22.846 19.314 1.00 0.00 ATOM 2231 H1 3PTLX 319 12.315 23.019 18.753 1.00 0.00 ATOM 2232 C4 3PTLX 319 10.507 21.043 18.000 1.00 0.00 ATOM 2233 C5 3PTLX 319 9.586 19.833 18.168 1.00 0.00 ATOM 2234 C1 3PTLX 320 21.116 1.289 29.643 1.00 0.00 ATOM 2235 C2 3PTLX 320 19.926 1.315 30.605 1.00 0.00 ATOM 2236 C3 3PTLX 320 19.604 2.692 31.189 1.00 0.00 ATOM 2237 O1 3PTLX 320 18.508 2.425 32.067 1.00 0.00 ATOM 2238 H1 3PTLX 320 18.517 1.432 32.185 1.00 0.00 ATOM 2239 C4 3PTLX 320 20.812 3.196 31.981 1.00 0.00 ATOM 2240 C5 3PTLX 320 20.597 4.654 32.393 1.00 0.00 ATOM 2241 C1 3PTLX 321 7.103 29.235 8.937 1.00 0.00 ATOM 2242 C2 3PTLX 321 8.457 29.258 8.226 1.00 0.00 ATOM 2243 C3 3PTLX 321 8.251 30.037 6.925 1.00 0.00 ATOM 2244 O1 3PTLX 321 7.727 31.366 6.976 1.00 0.00 ATOM 2245 H1 3PTLX 321 7.560 31.721 6.056 1.00 0.00 ATOM 2246 C4 3PTLX 321 9.586 29.989 6.179 1.00 0.00 ATOM 2247 C5 3PTLX 321 10.675 30.916 6.723 1.00 0.00 ATOM 2248 C1 3PTLX 322 32.183 13.848 29.039 1.00 0.00 ATOM 2249 C2 3PTLX 322 32.025 12.480 28.372 1.00 0.00 ATOM 2250 C3 3PTLX 322 33.267 11.630 28.646 1.00 0.00 ATOM 2251 O1 3PTLX 322 32.807 10.510 29.406 1.00 0.00 ATOM 2252 H1 3PTLX 322 33.460 9.752 29.420 1.00 0.00 ATOM 2253 C4 3PTLX 322 33.699 11.276 27.222 1.00 0.00 ATOM 2254 C5 3PTLX 322 35.222 11.186 27.101 1.00 0.00 ATOM 2255 C1 3PTLX 323 16.708 23.956 11.960 1.00 0.00 ATOM 2256 C2 3PTLX 323 15.384 24.677 11.696 1.00 0.00 ATOM 2257 C3 3PTLX 323 14.938 25.687 12.755 1.00 0.00 ATOM 2258 O1 3PTLX 323 15.740 26.871 12.754 1.00 0.00 ATOM 2259 H1 3PTLX 323 15.419 27.473 12.023 1.00 0.00 ATOM 2260 C4 3PTLX 323 13.455 25.921 12.459 1.00 0.00 ATOM 2261 C5 3PTLX 323 12.978 26.958 13.478 1.00 0.00 ATOM 2262 C1 3PTLX 324 27.303 39.291 33.266 1.00 0.00 ATOM 2263 C2 3PTLX 324 25.841 39.082 32.862 1.00 0.00 ATOM 2264 C3 3PTLX 324 25.024 38.467 34.000 1.00 0.00 ATOM 2265 O1 3PTLX 324 24.916 39.383 35.094 1.00 0.00 ATOM 2266 H1 3PTLX 324 24.679 40.290 34.747 1.00 0.00 ATOM 2267 C4 3PTLX 324 23.628 38.053 33.532 1.00 0.00 ATOM 2268 C5 3PTLX 324 22.813 37.371 34.633 1.00 0.00 ATOM 2269 C1 3PTLX 325 11.513 29.911 36.916 1.00 0.00 ATOM 2270 C2 3PTLX 325 11.548 28.384 36.821 1.00 0.00 ATOM 2271 C3 3PTLX 325 12.791 27.764 37.462 1.00 0.00 ATOM 2272 O1 3PTLX 325 12.564 26.355 37.560 1.00 0.00 ATOM 2273 H1 3PTLX 325 13.033 25.881 38.305 1.00 0.00 ATOM 2274 C4 3PTLX 325 13.962 28.205 36.583 1.00 0.00 ATOM 2275 C5 3PTLX 325 15.289 27.551 36.974 1.00 0.00 ATOM 2276 C1 3PTLX 326 20.795 10.252 36.808 1.00 0.00 ATOM 2277 C2 3PTLX 326 19.420 9.685 36.450 1.00 0.00 ATOM 2278 C3 3PTLX 326 18.380 10.116 37.485 1.00 0.00 ATOM 2279 O1 3PTLX 326 18.220 11.533 37.383 1.00 0.00 ATOM 2280 H1 3PTLX 326 17.566 11.711 36.648 1.00 0.00 ATOM 2281 C4 3PTLX 326 17.033 9.505 37.095 1.00 0.00 ATOM 2282 C5 3PTLX 326 16.694 8.180 37.780 1.00 0.00 ATOM 2283 C1 3PTLX 327 35.662 4.423 5.504 1.00 0.00 ATOM 2284 C2 3PTLX 327 36.307 4.257 6.882 1.00 0.00 ATOM 2285 C3 3PTLX 327 37.814 4.036 6.733 1.00 0.00 ATOM 2286 O1 3PTLX 327 38.419 5.178 6.121 1.00 0.00 ATOM 2287 H1 3PTLX 327 39.361 4.918 5.908 1.00 0.00 ATOM 2288 C4 3PTLX 327 38.459 3.805 8.101 1.00 0.00 ATOM 2289 C5 3PTLX 327 39.914 3.332 8.119 1.00 0.00 ATOM 2290 C1 3PTLX 328 0.426 27.651 42.161 1.00 0.00 ATOM 2291 C2 3PTLX 328 0.530 26.148 41.890 1.00 0.00 ATOM 2292 C3 3PTLX 328 0.777 25.198 43.064 1.00 0.00 ATOM 2293 O1 3PTLX 328 1.042 23.797 42.957 1.00 0.00 ATOM 2294 H1 3PTLX 328 0.155 23.339 43.003 1.00 0.00 ATOM 2295 C4 3PTLX 328 1.886 25.767 43.950 1.00 0.00 ATOM 2296 C5 3PTLX 328 1.896 25.219 45.378 1.00 0.00 ATOM 2297 C1 3PTLX 329 30.933 5.545 8.512 1.00 0.00 ATOM 2298 C2 3PTLX 329 30.071 5.996 7.331 1.00 0.00 ATOM 2299 C3 3PTLX 329 30.615 6.319 5.937 1.00 0.00 ATOM 2300 O1 3PTLX 329 29.570 7.053 5.295 1.00 0.00 ATOM 2301 H1 3PTLX 329 29.615 6.738 4.347 1.00 0.00 ATOM 2302 C4 3PTLX 329 31.778 7.284 6.176 1.00 0.00 ATOM 2303 C5 3PTLX 329 32.359 7.807 4.862 1.00 0.00 ATOM 2304 C1 3PTLX 330 16.361 29.314 44.229 1.00 0.00 ATOM 2305 C2 3PTLX 330 15.086 28.542 43.881 1.00 0.00 ATOM 2306 C3 3PTLX 330 15.328 27.332 42.977 1.00 0.00 ATOM 2307 O1 3PTLX 330 14.844 26.121 43.564 1.00 0.00 ATOM 2308 H1 3PTLX 330 15.434 25.823 44.315 1.00 0.00 ATOM 2309 C4 3PTLX 330 14.545 27.606 41.692 1.00 0.00 ATOM 2310 C5 3PTLX 330 15.300 28.495 40.703 1.00 0.00 ATOM 2311 C1 3PTLX 331 32.889 40.395 5.892 1.00 0.00 ATOM 2312 C2 3PTLX 331 34.229 40.360 6.629 1.00 0.00 ATOM 2313 C3 3PTLX 331 34.249 39.302 7.734 1.00 0.00 ATOM 2314 O1 3PTLX 331 33.234 39.576 8.704 1.00 0.00 ATOM 2315 H1 3PTLX 331 33.427 39.262 9.633 1.00 0.00 ATOM 2316 C4 3PTLX 331 34.096 37.905 7.129 1.00 0.00 ATOM 2317 C5 3PTLX 331 34.509 36.712 7.994 1.00 0.00 ATOM 2318 C1 3PTLX 332 19.700 31.206 43.413 1.00 0.00 ATOM 2319 C2 3PTLX 332 19.553 31.699 41.972 1.00 0.00 ATOM 2320 C3 3PTLX 332 18.266 31.191 41.320 1.00 0.00 ATOM 2321 O1 3PTLX 332 17.356 32.277 41.126 1.00 0.00 ATOM 2322 H1 3PTLX 332 17.818 32.980 40.586 1.00 0.00 ATOM 2323 C4 3PTLX 332 18.361 30.582 39.919 1.00 0.00 ATOM 2324 C5 3PTLX 332 19.462 29.520 39.927 1.00 0.00 ATOM 2325 C1 3PTLX 333 43.449 14.409 23.791 1.00 0.00 ATOM 2326 C2 3PTLX 333 42.335 13.889 24.703 1.00 0.00 ATOM 2327 C3 3PTLX 333 41.565 15.009 25.406 1.00 0.00 ATOM 2328 O1 3PTLX 333 40.721 15.697 24.479 1.00 0.00 ATOM 2329 H1 3PTLX 333 41.196 15.883 23.618 1.00 0.00 ATOM 2330 C4 3PTLX 333 40.678 14.377 26.480 1.00 0.00 ATOM 2331 C5 3PTLX 333 41.403 13.613 27.590 1.00 0.00 ATOM 2332 C1 3PTLX 334 40.042 32.993 8.841 1.00 0.00 ATOM 2333 C2 3PTLX 334 40.211 33.657 10.209 1.00 0.00 ATOM 2334 C3 3PTLX 334 40.261 32.684 11.389 1.00 0.00 ATOM 2335 O1 3PTLX 334 39.030 31.980 11.568 1.00 0.00 ATOM 2336 H1 3PTLX 334 39.106 31.366 12.354 1.00 0.00 ATOM 2337 C4 3PTLX 334 41.364 31.653 11.143 1.00 0.00 ATOM 2338 C5 3PTLX 334 42.674 32.226 11.687 1.00 0.00 ATOM 2339 C1 3PTLX 335 33.748 2.311 0.528 1.00 0.00 ATOM 2340 C2 3PTLX 335 32.496 2.907 1.174 1.00 0.00 ATOM 2341 C3 3PTLX 335 32.537 4.434 1.084 1.00 0.00 ATOM 2342 O1 3PTLX 335 31.173 4.735 1.391 1.00 0.00 ATOM 2343 H1 3PTLX 335 31.148 5.653 0.994 1.00 0.00 ATOM 2344 C4 3PTLX 335 33.556 4.867 2.139 1.00 0.00 ATOM 2345 C5 3PTLX 335 34.118 6.281 1.978 1.00 0.00 ATOM 2346 C1 3PTLX 336 22.053 16.393 21.798 1.00 0.00 ATOM 2347 C2 3PTLX 336 21.462 15.227 21.004 1.00 0.00 ATOM 2348 C3 3PTLX 336 20.486 14.350 21.791 1.00 0.00 ATOM 2349 O1 3PTLX 336 19.353 15.148 22.142 1.00 0.00 ATOM 2350 H1 3PTLX 336 19.212 14.932 23.108 1.00 0.00 ATOM 2351 C4 3PTLX 336 20.000 13.239 20.857 1.00 0.00 ATOM 2352 C5 3PTLX 336 21.075 12.252 20.399 1.00 0.00 ATOM 2353 C1 3PTLX 337 41.085 23.893 34.682 1.00 0.00 ATOM 2354 C2 3PTLX 337 39.577 24.043 34.473 1.00 0.00 ATOM 2355 C3 3PTLX 337 38.966 22.875 33.695 1.00 0.00 ATOM 2356 O1 3PTLX 337 38.946 21.633 34.402 1.00 0.00 ATOM 2357 H1 3PTLX 337 39.456 21.645 35.262 1.00 0.00 ATOM 2358 C4 3PTLX 337 37.537 23.292 33.341 1.00 0.00 ATOM 2359 C5 3PTLX 337 37.525 24.397 32.284 1.00 0.00 ATOM 2360 C1 3PTLX 338 24.593 11.761 34.461 1.00 0.00 ATOM 2361 C2 3PTLX 338 26.085 11.664 34.137 1.00 0.00 ATOM 2362 C3 3PTLX 338 26.943 11.429 35.381 1.00 0.00 ATOM 2363 O1 3PTLX 338 26.639 10.194 36.034 1.00 0.00 ATOM 2364 H1 3PTLX 338 27.090 10.046 36.915 1.00 0.00 ATOM 2365 C4 3PTLX 338 28.402 11.290 34.942 1.00 0.00 ATOM 2366 C5 3PTLX 338 29.380 11.152 36.111 1.00 0.00 ATOM 2367 C1 3PTLX 339 27.621 20.246 7.463 1.00 0.00 ATOM 2368 C2 3PTLX 339 26.496 19.341 7.971 1.00 0.00 ATOM 2369 C3 3PTLX 339 25.165 19.675 7.295 1.00 0.00 ATOM 2370 O1 3PTLX 339 25.124 18.975 6.049 1.00 0.00 ATOM 2371 H1 3PTLX 339 25.867 18.312 6.144 1.00 0.00 ATOM 2372 C4 3PTLX 339 23.983 19.197 8.142 1.00 0.00 ATOM 2373 C5 3PTLX 339 22.739 20.070 7.973 1.00 0.00 ATOM 2374 C1 3PTLX 340 16.944 29.042 3.079 1.00 0.00 ATOM 2375 C2 3PTLX 340 15.864 28.233 3.800 1.00 0.00 ATOM 2376 C3 3PTLX 340 15.011 27.397 2.845 1.00 0.00 ATOM 2377 O1 3PTLX 340 15.908 26.412 2.325 1.00 0.00 ATOM 2378 H1 3PTLX 340 16.414 26.070 3.117 1.00 0.00 ATOM 2379 C4 3PTLX 340 13.927 26.685 3.658 1.00 0.00 ATOM 2380 C5 3PTLX 340 12.886 27.711 4.110 1.00 0.00 ATOM 2381 C1 3PTLX 341 44.525 24.796 13.863 1.00 0.00 ATOM 2382 C2 3PTLX 341 43.082 24.298 13.761 1.00 0.00 ATOM 2383 C3 3PTLX 341 42.945 22.775 13.805 1.00 0.00 ATOM 2384 O1 3PTLX 341 43.659 22.278 14.940 1.00 0.00 ATOM 2385 H1 3PTLX 341 43.250 22.702 15.748 1.00 0.00 ATOM 2386 C4 3PTLX 341 41.472 22.438 14.043 1.00 0.00 ATOM 2387 C5 3PTLX 341 40.640 22.978 12.878 1.00 0.00 ATOM 2388 C1 3PTLX 342 34.983 43.877 2.156 1.00 0.00 ATOM 2389 C2 3PTLX 342 35.696 44.435 0.923 1.00 0.00 ATOM 2390 C3 3PTLX 342 36.883 43.548 0.542 1.00 0.00 ATOM 2391 O1 3PTLX 342 36.394 42.397 -0.151 1.00 0.00 ATOM 2392 H1 3PTLX 342 36.672 41.555 0.312 1.00 0.00 ATOM 2393 C4 3PTLX 342 37.812 44.412 45.316 1.00 0.00 ATOM 2394 C5 3PTLX 342 39.137 43.699 45.038 1.00 0.00 ATOM 2395 C1 3PTLX 343 38.923 24.693 27.487 1.00 0.00 ATOM 2396 C2 3PTLX 343 38.528 25.378 26.178 1.00 0.00 ATOM 2397 C3 3PTLX 343 38.146 24.375 25.088 1.00 0.00 ATOM 2398 O1 3PTLX 343 36.724 24.225 25.096 1.00 0.00 ATOM 2399 H1 3PTLX 343 36.359 24.189 26.026 1.00 0.00 ATOM 2400 C4 3PTLX 343 38.658 24.942 23.763 1.00 0.00 ATOM 2401 C5 3PTLX 343 38.643 23.858 22.683 1.00 0.00 ATOM 2402 C1 3PTLX 344 10.774 33.498 9.867 1.00 0.00 ATOM 2403 C2 3PTLX 344 9.325 33.069 10.105 1.00 0.00 ATOM 2404 C3 3PTLX 344 8.346 33.816 9.196 1.00 0.00 ATOM 2405 O1 3PTLX 344 8.689 33.644 7.818 1.00 0.00 ATOM 2406 H1 3PTLX 344 8.503 32.696 7.559 1.00 0.00 ATOM 2407 C4 3PTLX 344 6.877 33.436 9.390 1.00 0.00 ATOM 2408 C5 3PTLX 344 5.755 34.071 8.566 1.00 0.00 ATOM 2409 C1 3PTLX 345 34.730 23.434 35.858 1.00 0.00 ATOM 2410 C2 3PTLX 345 33.308 22.930 36.110 1.00 0.00 ATOM 2411 C3 3PTLX 345 32.679 23.768 37.225 1.00 0.00 ATOM 2412 O1 3PTLX 345 32.169 25.030 36.787 1.00 0.00 ATOM 2413 H1 3PTLX 345 31.972 25.050 35.807 1.00 0.00 ATOM 2414 C4 3PTLX 345 31.474 22.973 37.732 1.00 0.00 ATOM 2415 C5 3PTLX 345 31.041 23.065 39.197 1.00 0.00 ATOM 2416 C1 3PTLX 346 33.647 44.884 37.090 1.00 0.00 ATOM 2417 C2 3PTLX 346 32.443 45.332 36.258 1.00 0.00 ATOM 2418 C3 3PTLX 346 31.675 44.167 35.630 1.00 0.00 ATOM 2419 O1 3PTLX 346 30.330 44.625 35.463 1.00 0.00 ATOM 2420 H1 3PTLX 346 30.059 45.046 36.329 1.00 0.00 ATOM 2421 C4 3PTLX 346 32.397 43.747 34.348 1.00 0.00 ATOM 2422 C5 3PTLX 346 31.771 42.478 33.765 1.00 0.00 ATOM 2423 C1 3PTLX 347 33.632 16.754 12.117 1.00 0.00 ATOM 2424 C2 3PTLX 347 34.961 16.084 12.473 1.00 0.00 ATOM 2425 C3 3PTLX 347 35.836 15.445 11.392 1.00 0.00 ATOM 2426 O1 3PTLX 347 35.316 14.172 11.000 1.00 0.00 ATOM 2427 H1 3PTLX 347 34.571 14.221 10.335 1.00 0.00 ATOM 2428 C4 3PTLX 347 36.019 16.337 10.163 1.00 0.00 ATOM 2429 C5 3PTLX 347 36.729 15.673 8.981 1.00 0.00 ATOM 2430 C1 3PTLX 348 10.116 26.416 40.415 1.00 0.00 ATOM 2431 C2 3PTLX 348 10.207 26.202 41.927 1.00 0.00 ATOM 2432 C3 3PTLX 348 10.248 27.511 42.719 1.00 0.00 ATOM 2433 O1 3PTLX 348 9.298 28.525 42.381 1.00 0.00 ATOM 2434 H1 3PTLX 348 9.414 29.227 43.084 1.00 0.00 ATOM 2435 C4 3PTLX 348 10.079 27.086 44.179 1.00 0.00 ATOM 2436 C5 3PTLX 348 11.338 26.857 45.018 1.00 0.00 ATOM 2437 C1 3PTLX 349 37.595 44.084 13.617 1.00 0.00 ATOM 2438 C2 3PTLX 349 36.115 43.774 13.850 1.00 0.00 ATOM 2439 C3 3PTLX 349 35.383 43.865 12.509 1.00 0.00 ATOM 2440 O1 3PTLX 349 35.731 42.908 11.505 1.00 0.00 ATOM 2441 H1 3PTLX 349 35.670 43.246 10.566 1.00 0.00 ATOM 2442 C4 3PTLX 349 33.872 43.659 12.630 1.00 0.00 ATOM 2443 C5 3PTLX 349 33.182 44.846 13.305 1.00 0.00 ATOM 2444 C1 3PTLX 350 30.900 32.198 22.122 1.00 0.00 ATOM 2445 C2 3PTLX 350 30.705 30.997 21.194 1.00 0.00 ATOM 2446 C3 3PTLX 350 31.107 29.610 21.699 1.00 0.00 ATOM 2447 O1 3PTLX 350 30.162 29.225 22.701 1.00 0.00 ATOM 2448 H1 3PTLX 350 30.415 29.793 23.484 1.00 0.00 ATOM 2449 C4 3PTLX 350 30.958 28.615 20.546 1.00 0.00 ATOM 2450 C5 3PTLX 350 31.954 27.454 20.602 1.00 0.00 ATOM 2451 C1 3PTLX 351 10.468 18.942 1.301 1.00 0.00 ATOM 2452 C2 3PTLX 351 11.763 19.689 1.626 1.00 0.00 ATOM 2453 C3 3PTLX 351 12.430 18.984 2.809 1.00 0.00 ATOM 2454 O1 3PTLX 351 13.148 17.871 2.269 1.00 0.00 ATOM 2455 H1 3PTLX 351 14.143 17.908 2.361 1.00 0.00 ATOM 2456 C4 3PTLX 351 13.288 20.027 3.529 1.00 0.00 ATOM 2457 C5 3PTLX 351 13.533 19.519 4.951 1.00 0.00 ATOM 2458 C1 3PTLX 352 4.107 15.380 25.572 1.00 0.00 ATOM 2459 C2 3PTLX 352 4.295 16.536 24.587 1.00 0.00 ATOM 2460 C3 3PTLX 352 3.464 16.468 23.304 1.00 0.00 ATOM 2461 O1 3PTLX 352 3.903 17.461 22.374 1.00 0.00 ATOM 2462 H1 3PTLX 352 4.841 17.296 22.068 1.00 0.00 ATOM 2463 C4 3PTLX 352 3.698 15.059 22.754 1.00 0.00 ATOM 2464 C5 3PTLX 352 2.795 14.627 21.596 1.00 0.00 ATOM 2465 C1 3PTLX 353 9.333 42.454 20.273 1.00 0.00 ATOM 2466 C2 3PTLX 353 9.266 43.840 20.917 1.00 0.00 ATOM 2467 C3 3PTLX 353 10.484 44.246 21.749 1.00 0.00 ATOM 2468 O1 3PTLX 353 11.662 44.200 20.940 1.00 0.00 ATOM 2469 H1 3PTLX 353 12.321 44.869 21.284 1.00 0.00 ATOM 2470 C4 3PTLX 353 10.271 0.019 22.323 1.00 0.00 ATOM 2471 C5 3PTLX 353 9.513 -0.075 23.648 1.00 0.00 ATOM 2472 C1 3PTLX 354 33.415 11.308 14.957 1.00 0.00 ATOM 2473 C2 3PTLX 354 34.283 10.389 14.096 1.00 0.00 ATOM 2474 C3 3PTLX 354 34.812 10.940 12.771 1.00 0.00 ATOM 2475 O1 3PTLX 354 35.605 12.105 13.013 1.00 0.00 ATOM 2476 H1 3PTLX 354 35.687 12.629 12.165 1.00 0.00 ATOM 2477 C4 3PTLX 354 35.628 9.797 12.164 1.00 0.00 ATOM 2478 C5 3PTLX 354 34.970 8.707 11.315 1.00 0.00 ATOM 2479 C1 3PTLX 355 25.469 7.512 30.903 1.00 0.00 ATOM 2480 C2 3PTLX 355 23.964 7.244 30.839 1.00 0.00 ATOM 2481 C3 3PTLX 355 23.297 8.564 31.232 1.00 0.00 ATOM 2482 O1 3PTLX 355 23.208 9.325 30.024 1.00 0.00 ATOM 2483 H1 3PTLX 355 23.416 8.756 29.229 1.00 0.00 ATOM 2484 C4 3PTLX 355 21.962 8.258 31.915 1.00 0.00 ATOM 2485 C5 3PTLX 355 21.127 9.497 32.242 1.00 0.00 ATOM 2486 C1 3PTLX 356 4.589 33.053 24.317 1.00 0.00 ATOM 2487 C2 3PTLX 356 5.788 32.297 24.893 1.00 0.00 ATOM 2488 C3 3PTLX 356 7.079 32.315 24.073 1.00 0.00 ATOM 2489 O1 3PTLX 356 7.666 33.607 24.256 1.00 0.00 ATOM 2490 H1 3PTLX 356 6.892 34.239 24.237 1.00 0.00 ATOM 2491 C4 3PTLX 356 8.118 31.336 24.624 1.00 0.00 ATOM 2492 C5 3PTLX 356 9.253 30.939 23.678 1.00 0.00 ATOM 2493 C1 3PTLX 357 20.930 2.802 13.440 1.00 0.00 ATOM 2494 C2 3PTLX 357 20.020 3.671 12.569 1.00 0.00 ATOM 2495 C3 3PTLX 357 18.594 3.141 12.414 1.00 0.00 ATOM 2496 O1 3PTLX 357 17.948 3.136 13.689 1.00 0.00 ATOM 2497 H1 3PTLX 357 17.672 4.066 13.929 1.00 0.00 ATOM 2498 C4 3PTLX 357 17.922 4.130 11.459 1.00 0.00 ATOM 2499 C5 3PTLX 357 16.486 3.832 11.021 1.00 0.00 ATOM 2500 C1 3PTLX 358 22.091 41.845 45.326 1.00 0.00 ATOM 2501 C2 3PTLX 358 23.343 42.158 44.504 1.00 0.00 ATOM 2502 C3 3PTLX 358 24.302 43.165 45.143 1.00 0.00 ATOM 2503 O1 3PTLX 358 25.286 43.637 44.220 1.00 0.00 ATOM 2504 H1 3PTLX 358 24.927 44.086 43.401 1.00 0.00 ATOM 2505 C4 3PTLX 358 23.599 44.429 0.013 1.00 0.00 ATOM 2506 C5 3PTLX 358 24.498 45.428 0.745 1.00 0.00 ATOM 2507 C1 3PTLX 359 44.964 14.550 17.331 1.00 0.00 ATOM 2508 C2 3PTLX 359 44.526 13.219 16.716 1.00 0.00 ATOM 2509 C3 3PTLX 359 44.908 11.903 17.395 1.00 0.00 ATOM 2510 O1 3PTLX 359 44.268 10.776 16.791 1.00 0.00 ATOM 2511 H1 3PTLX 359 43.356 10.703 17.196 1.00 0.00 ATOM 2512 C4 3PTLX 359 0.774 11.587 17.450 1.00 0.00 ATOM 2513 C5 3PTLX 359 1.457 11.334 16.104 1.00 0.00 ATOM 2514 C1 3PTLX 360 35.266 27.686 6.000 1.00 0.00 ATOM 2515 C2 3PTLX 360 35.993 29.029 6.094 1.00 0.00 ATOM 2516 C3 3PTLX 360 36.277 29.563 4.689 1.00 0.00 ATOM 2517 O1 3PTLX 360 35.074 29.987 4.043 1.00 0.00 ATOM 2518 H1 3PTLX 360 35.238 30.051 3.058 1.00 0.00 ATOM 2519 C4 3PTLX 360 37.164 30.810 4.682 1.00 0.00 ATOM 2520 C5 3PTLX 360 38.592 30.479 5.119 1.00 0.00 ATOM 2521 C1 3PTLX 361 5.201 27.604 44.798 1.00 0.00 ATOM 2522 C2 3PTLX 361 6.083 28.266 43.738 1.00 0.00 ATOM 2523 C3 3PTLX 361 5.708 27.929 42.293 1.00 0.00 ATOM 2524 O1 3PTLX 361 6.406 28.847 41.448 1.00 0.00 ATOM 2525 H1 3PTLX 361 7.353 28.887 41.767 1.00 0.00 ATOM 2526 C4 3PTLX 361 6.194 26.505 42.015 1.00 0.00 ATOM 2527 C5 3PTLX 361 5.663 25.944 40.695 1.00 0.00 ATOM 2528 C1 3PTLX 362 9.182 37.311 12.704 1.00 0.00 ATOM 2529 C2 3PTLX 362 9.784 38.664 13.092 1.00 0.00 ATOM 2530 C3 3PTLX 362 9.175 39.688 12.132 1.00 0.00 ATOM 2531 O1 3PTLX 362 7.748 39.754 12.085 1.00 0.00 ATOM 2532 H1 3PTLX 362 7.328 39.914 12.979 1.00 0.00 ATOM 2533 C4 3PTLX 362 9.741 41.092 12.355 1.00 0.00 ATOM 2534 C5 3PTLX 362 11.245 41.112 12.073 1.00 0.00 ATOM 2535 C1 3PTLX 363 0.602 21.999 40.526 1.00 0.00 ATOM 2536 C2 3PTLX 363 -0.894 22.317 40.492 1.00 0.00 ATOM 2537 C3 3PTLX 363 43.974 21.753 41.693 1.00 0.00 ATOM 2538 O1 3PTLX 363 44.249 22.572 42.832 1.00 0.00 ATOM 2539 H1 3PTLX 363 44.540 21.963 43.570 1.00 0.00 ATOM 2540 C4 3PTLX 363 42.459 21.680 41.495 1.00 0.00 ATOM 2541 C5 3PTLX 363 41.904 23.069 41.169 1.00 0.00 ATOM 2542 C1 3PTLX 364 6.101 32.348 36.608 1.00 0.00 ATOM 2543 C2 3PTLX 364 6.767 32.363 35.230 1.00 0.00 ATOM 2544 C3 3PTLX 364 8.256 32.700 35.321 1.00 0.00 ATOM 2545 O1 3PTLX 364 9.002 31.608 35.866 1.00 0.00 ATOM 2546 H1 3PTLX 364 8.332 30.911 36.118 1.00 0.00 ATOM 2547 C4 3PTLX 364 8.787 33.225 33.986 1.00 0.00 ATOM 2548 C5 3PTLX 364 9.093 32.117 32.977 1.00 0.00 ATOM 2549 C1 3PTLX 365 4.276 21.441 2.238 1.00 0.00 ATOM 2550 C2 3PTLX 365 4.662 21.778 3.680 1.00 0.00 ATOM 2551 C3 3PTLX 365 5.985 22.547 3.688 1.00 0.00 ATOM 2552 O1 3PTLX 365 6.092 23.354 4.864 1.00 0.00 ATOM 2553 H1 3PTLX 365 6.948 23.866 4.793 1.00 0.00 ATOM 2554 C4 3PTLX 365 7.162 21.572 3.752 1.00 0.00 ATOM 2555 C5 3PTLX 365 8.130 21.846 2.599 1.00 0.00 ATOM 2556 C1 3PTLX 366 37.293 30.605 32.750 1.00 0.00 ATOM 2557 C2 3PTLX 366 37.855 29.819 31.564 1.00 0.00 ATOM 2558 C3 3PTLX 366 37.812 30.626 30.264 1.00 0.00 ATOM 2559 O1 3PTLX 366 38.606 31.815 30.246 1.00 0.00 ATOM 2560 H1 3PTLX 366 38.209 32.381 29.523 1.00 0.00 ATOM 2561 C4 3PTLX 366 38.235 29.783 29.059 1.00 0.00 ATOM 2562 C5 3PTLX 366 39.639 29.179 29.129 1.00 0.00 ATOM 2563 C1 3PTLX 367 20.892 17.331 18.256 1.00 0.00 ATOM 2564 C2 3PTLX 367 21.990 16.784 17.342 1.00 0.00 ATOM 2565 C3 3PTLX 367 22.030 17.390 15.938 1.00 0.00 ATOM 2566 O1 3PTLX 367 22.337 18.786 15.926 1.00 0.00 ATOM 2567 H1 3PTLX 367 21.610 19.327 16.348 1.00 0.00 ATOM 2568 C4 3PTLX 367 23.126 16.667 15.152 1.00 0.00 ATOM 2569 C5 3PTLX 367 22.795 16.956 13.686 1.00 0.00 ATOM 2570 C1 3PTLX 368 30.799 13.269 2.562 1.00 0.00 ATOM 2571 C2 3PTLX 368 30.130 12.120 1.804 1.00 0.00 ATOM 2572 C3 3PTLX 368 30.842 10.771 1.927 1.00 0.00 ATOM 2573 O1 3PTLX 368 29.857 9.799 1.568 1.00 0.00 ATOM 2574 H1 3PTLX 368 29.045 9.975 2.124 1.00 0.00 ATOM 2575 C4 3PTLX 368 32.000 10.763 0.927 1.00 0.00 ATOM 2576 C5 3PTLX 368 33.328 10.267 1.502 1.00 0.00 ATOM 2577 C1 3PTLX 369 43.837 4.080 2.825 1.00 0.00 ATOM 2578 C2 3PTLX 369 43.104 4.512 4.097 1.00 0.00 ATOM 2579 C3 3PTLX 369 41.640 4.758 3.729 1.00 0.00 ATOM 2580 O1 3PTLX 369 40.982 4.944 4.985 1.00 0.00 ATOM 2581 H1 3PTLX 369 41.317 5.787 5.406 1.00 0.00 ATOM 2582 C4 3PTLX 369 41.521 6.049 2.917 1.00 0.00 ATOM 2583 C5 3PTLX 369 40.071 6.189 2.451 1.00 0.00 ATOM 2584 C1 3PTLX 370 4.963 35.214 19.532 1.00 0.00 ATOM 2585 C2 3PTLX 370 5.451 35.010 20.967 1.00 0.00 ATOM 2586 C3 3PTLX 370 6.100 36.175 21.718 1.00 0.00 ATOM 2587 O1 3PTLX 370 6.423 35.721 23.035 1.00 0.00 ATOM 2588 H1 3PTLX 370 7.400 35.933 23.061 1.00 0.00 ATOM 2589 C4 3PTLX 370 7.283 36.809 20.984 1.00 0.00 ATOM 2590 C5 3PTLX 370 7.858 38.124 21.514 1.00 0.00 ATOM 2591 C1 3PTLX 371 15.605 32.340 9.990 1.00 0.00 ATOM 2592 C2 3PTLX 371 16.132 30.989 10.479 1.00 0.00 ATOM 2593 C3 3PTLX 371 15.118 29.889 10.159 1.00 0.00 ATOM 2594 O1 3PTLX 371 15.720 28.712 10.704 1.00 0.00 ATOM 2595 H1 3PTLX 371 16.653 28.575 10.372 1.00 0.00 ATOM 2596 C4 3PTLX 371 13.771 30.107 10.851 1.00 0.00 ATOM 2597 C5 3PTLX 371 12.702 29.144 10.329 1.00 0.00 ATOM 2598 C1 3PTLX 372 13.939 2.437 27.991 1.00 0.00 ATOM 2599 C2 3PTLX 372 13.252 3.805 28.002 1.00 0.00 ATOM 2600 C3 3PTLX 372 14.216 4.942 27.657 1.00 0.00 ATOM 2601 O1 3PTLX 372 14.530 4.673 26.288 1.00 0.00 ATOM 2602 H1 3PTLX 372 15.502 4.449 26.210 1.00 0.00 ATOM 2603 C4 3PTLX 372 13.498 6.290 27.754 1.00 0.00 ATOM 2604 C5 3PTLX 372 14.280 7.545 27.362 1.00 0.00 ATOM 2605 C1 3PTLX 373 29.935 42.794 11.601 1.00 0.00 ATOM 2606 C2 3PTLX 373 31.069 42.120 10.826 1.00 0.00 ATOM 2607 C3 3PTLX 373 30.941 42.378 9.324 1.00 0.00 ATOM 2608 O1 3PTLX 373 32.251 42.205 8.775 1.00 0.00 ATOM 2609 H1 3PTLX 373 32.523 41.254 8.629 1.00 0.00 ATOM 2610 C4 3PTLX 373 30.006 41.416 8.588 1.00 0.00 ATOM 2611 C5 3PTLX 373 29.816 41.851 7.134 1.00 0.00 ATOM 2612 C1 3PTLX 374 43.557 17.921 12.934 1.00 0.00 ATOM 2613 C2 3PTLX 374 44.122 19.227 12.372 1.00 0.00 ATOM 2614 C3 3PTLX 374 44.615 19.051 10.934 1.00 0.00 ATOM 2615 O1 3PTLX 374 43.566 19.068 9.963 1.00 0.00 ATOM 2616 H1 3PTLX 374 43.231 18.133 9.845 1.00 0.00 ATOM 2617 C4 3PTLX 374 0.007 20.143 10.610 1.00 0.00 ATOM 2618 C5 3PTLX 374 1.409 19.618 10.293 1.00 0.00 ATOM 2619 C1 3PTLX 375 29.285 10.683 22.125 1.00 0.00 ATOM 2620 C2 3PTLX 375 29.756 10.009 23.415 1.00 0.00 ATOM 2621 C3 3PTLX 375 30.104 8.535 23.199 1.00 0.00 ATOM 2622 O1 3PTLX 375 31.249 8.496 22.344 1.00 0.00 ATOM 2623 H1 3PTLX 375 32.097 8.689 22.839 1.00 0.00 ATOM 2624 C4 3PTLX 375 30.335 7.887 24.566 1.00 0.00 ATOM 2625 C5 3PTLX 375 30.902 6.468 24.487 1.00 0.00 ATOM 2626 C1 3PTLX 376 6.741 14.501 31.854 1.00 0.00 ATOM 2627 C2 3PTLX 376 8.021 13.781 31.425 1.00 0.00 ATOM 2628 C3 3PTLX 376 8.138 12.472 32.208 1.00 0.00 ATOM 2629 O1 3PTLX 376 9.185 11.760 31.543 1.00 0.00 ATOM 2630 H1 3PTLX 376 10.075 12.045 31.898 1.00 0.00 ATOM 2631 C4 3PTLX 376 8.565 12.604 33.671 1.00 0.00 ATOM 2632 C5 3PTLX 376 7.989 11.439 34.479 1.00 0.00 ATOM 2633 C1 3PTLX 377 20.649 24.223 32.857 1.00 0.00 ATOM 2634 C2 3PTLX 377 19.701 25.334 33.311 1.00 0.00 ATOM 2635 C3 3PTLX 377 20.252 26.178 34.463 1.00 0.00 ATOM 2636 O1 3PTLX 377 21.381 26.915 33.987 1.00 0.00 ATOM 2637 H1 3PTLX 377 21.104 27.558 33.273 1.00 0.00 ATOM 2638 C4 3PTLX 377 19.099 27.039 34.982 1.00 0.00 ATOM 2639 C5 3PTLX 377 19.623 27.861 36.162 1.00 0.00 ATOM 2640 C1 3PTLX 378 14.653 31.360 15.530 1.00 0.00 ATOM 2641 C2 3PTLX 378 13.807 30.096 15.692 1.00 0.00 ATOM 2642 C3 3PTLX 378 13.541 29.868 17.181 1.00 0.00 ATOM 2643 O1 3PTLX 378 12.570 30.855 17.538 1.00 0.00 ATOM 2644 H1 3PTLX 378 11.690 30.805 17.064 1.00 0.00 ATOM 2645 C4 3PTLX 378 12.905 28.495 17.405 1.00 0.00 ATOM 2646 C5 3PTLX 378 13.853 27.403 17.905 1.00 0.00 ATOM 2647 C1 3PTLX 379 1.039 11.084 22.462 1.00 0.00 ATOM 2648 C2 3PTLX 379 1.856 11.061 23.755 1.00 0.00 ATOM 2649 C3 3PTLX 379 1.089 10.856 25.063 1.00 0.00 ATOM 2650 O1 3PTLX 379 1.929 10.115 25.952 1.00 0.00 ATOM 2651 H1 3PTLX 379 1.446 9.242 26.025 1.00 0.00 ATOM 2652 C4 3PTLX 379 0.774 12.243 25.626 1.00 0.00 ATOM 2653 C5 3PTLX 379 -0.102 12.279 26.880 1.00 0.00 ATOM 2654 C1 3PTLX 380 20.910 27.232 10.663 1.00 0.00 ATOM 2655 C2 3PTLX 380 20.660 28.256 9.554 1.00 0.00 ATOM 2656 C3 3PTLX 380 19.177 28.114 9.204 1.00 0.00 ATOM 2657 O1 3PTLX 380 18.180 28.291 10.213 1.00 0.00 ATOM 2658 H1 3PTLX 380 18.550 27.817 11.012 1.00 0.00 ATOM 2659 C4 3PTLX 380 18.976 29.205 8.150 1.00 0.00 ATOM 2660 C5 3PTLX 380 19.079 28.826 6.671 1.00 0.00 ATOM 2661 C1 3PTLX 381 13.759 41.475 44.753 1.00 0.00 ATOM 2662 C2 3PTLX 381 14.196 41.106 43.334 1.00 0.00 ATOM 2663 C3 3PTLX 381 12.950 41.036 42.448 1.00 0.00 ATOM 2664 O1 3PTLX 381 12.845 42.220 41.654 1.00 0.00 ATOM 2665 H1 3PTLX 381 13.759 42.594 41.495 1.00 0.00 ATOM 2666 C4 3PTLX 381 13.229 39.773 41.630 1.00 0.00 ATOM 2667 C5 3PTLX 381 12.105 39.349 40.683 1.00 0.00 ATOM 2668 C1 3PTLX 382 31.619 8.302 17.264 1.00 0.00 ATOM 2669 C2 3PTLX 382 31.301 8.063 18.741 1.00 0.00 ATOM 2670 C3 3PTLX 382 31.252 6.542 18.900 1.00 0.00 ATOM 2671 O1 3PTLX 382 31.380 6.396 20.316 1.00 0.00 ATOM 2672 H1 3PTLX 382 31.451 7.296 20.747 1.00 0.00 ATOM 2673 C4 3PTLX 382 29.901 6.047 18.381 1.00 0.00 ATOM 2674 C5 3PTLX 382 29.725 4.530 18.469 1.00 0.00 ATOM 2675 C1 3PTLX 383 7.183 6.670 12.426 1.00 0.00 ATOM 2676 C2 3PTLX 383 7.873 5.364 12.829 1.00 0.00 ATOM 2677 C3 3PTLX 383 8.360 5.337 14.279 1.00 0.00 ATOM 2678 O1 3PTLX 383 7.350 5.029 15.244 1.00 0.00 ATOM 2679 H1 3PTLX 383 6.974 4.131 15.015 1.00 0.00 ATOM 2680 C4 3PTLX 383 9.593 4.438 14.387 1.00 0.00 ATOM 2681 C5 3PTLX 383 9.444 2.934 14.146 1.00 0.00 ATOM 2682 C1 3PTLX 384 13.305 40.271 5.392 1.00 0.00 ATOM 2683 C2 3PTLX 384 14.334 39.479 6.200 1.00 0.00 ATOM 2684 C3 3PTLX 384 15.049 40.436 7.156 1.00 0.00 ATOM 2685 O1 3PTLX 384 14.342 40.991 8.268 1.00 0.00 ATOM 2686 H1 3PTLX 384 13.901 40.263 8.792 1.00 0.00 ATOM 2687 C4 3PTLX 384 16.249 39.622 7.645 1.00 0.00 ATOM 2688 C5 3PTLX 384 17.209 40.587 8.344 1.00 0.00 ATOM 2689 C1 3PTLX 385 25.165 14.512 6.595 1.00 0.00 ATOM 2690 C2 3PTLX 385 26.410 15.030 5.874 1.00 0.00 ATOM 2691 C3 3PTLX 385 26.210 15.338 4.389 1.00 0.00 ATOM 2692 O1 3PTLX 385 25.425 16.519 4.201 1.00 0.00 ATOM 2693 H1 3PTLX 385 24.628 16.373 3.615 1.00 0.00 ATOM 2694 C4 3PTLX 385 27.545 15.473 3.655 1.00 0.00 ATOM 2695 C5 3PTLX 385 27.420 15.598 2.135 1.00 0.00 ATOM 2696 C1 3PTLX 386 15.603 14.505 12.291 1.00 0.00 ATOM 2697 C2 3PTLX 386 15.783 16.001 12.028 1.00 0.00 ATOM 2698 C3 3PTLX 386 15.735 16.983 13.200 1.00 0.00 ATOM 2699 O1 3PTLX 386 16.263 18.202 12.670 1.00 0.00 ATOM 2700 H1 3PTLX 386 15.857 18.384 11.774 1.00 0.00 ATOM 2701 C4 3PTLX 386 14.303 17.167 13.704 1.00 0.00 ATOM 2702 C5 3PTLX 386 13.290 17.851 12.782 1.00 0.00 ATOM 2703 C1 3PTLX 387 15.004 15.693 5.338 1.00 0.00 ATOM 2704 C2 3PTLX 387 14.196 14.957 6.409 1.00 0.00 ATOM 2705 C3 3PTLX 387 14.588 15.351 7.835 1.00 0.00 ATOM 2706 O1 3PTLX 387 14.214 16.695 8.148 1.00 0.00 ATOM 2707 H1 3PTLX 387 13.294 16.810 8.522 1.00 0.00 ATOM 2708 C4 3PTLX 387 13.827 14.538 8.883 1.00 0.00 ATOM 2709 C5 3PTLX 387 14.320 13.093 8.984 1.00 0.00 ATOM 2710 C1 3PTLX 388 22.551 4.732 27.776 1.00 0.00 ATOM 2711 C2 3PTLX 388 21.151 5.137 27.312 1.00 0.00 ATOM 2712 C3 3PTLX 388 20.717 6.433 28.001 1.00 0.00 ATOM 2713 O1 3PTLX 388 21.463 7.545 27.500 1.00 0.00 ATOM 2714 H1 3PTLX 388 20.931 8.390 27.543 1.00 0.00 ATOM 2715 C4 3PTLX 388 19.205 6.522 27.780 1.00 0.00 ATOM 2716 C5 3PTLX 388 18.149 5.732 28.555 1.00 0.00 ATOM 2717 C1 3PTLX 389 39.488 11.964 11.162 1.00 0.00 ATOM 2718 C2 3PTLX 389 39.863 12.819 12.374 1.00 0.00 ATOM 2719 C3 3PTLX 389 40.950 13.848 12.056 1.00 0.00 ATOM 2720 O1 3PTLX 389 40.478 15.130 11.634 1.00 0.00 ATOM 2721 H1 3PTLX 389 40.043 15.525 12.443 1.00 0.00 ATOM 2722 C4 3PTLX 389 41.974 13.902 13.192 1.00 0.00 ATOM 2723 C5 3PTLX 389 43.279 14.624 12.852 1.00 0.00 ATOM 2724 C1 3PTLX 390 0.638 16.797 6.492 1.00 0.00 ATOM 2725 C2 3PTLX 390 1.736 15.761 6.746 1.00 0.00 ATOM 2726 C3 3PTLX 390 3.083 15.868 6.030 1.00 0.00 ATOM 2727 O1 3PTLX 390 2.789 15.811 4.631 1.00 0.00 ATOM 2728 H1 3PTLX 390 2.140 15.119 4.315 1.00 0.00 ATOM 2729 C4 3PTLX 390 3.930 17.072 6.448 1.00 0.00 ATOM 2730 C5 3PTLX 390 4.134 17.168 7.961 1.00 0.00 ATOM 2731 C1 3PTLX 391 35.416 25.034 9.645 1.00 0.00 ATOM 2732 C2 3PTLX 391 34.803 24.641 10.991 1.00 0.00 ATOM 2733 C3 3PTLX 391 35.158 23.339 11.712 1.00 0.00 ATOM 2734 O1 3PTLX 391 34.215 23.197 12.777 1.00 0.00 ATOM 2735 H1 3PTLX 391 33.371 22.744 12.486 1.00 0.00 ATOM 2736 C4 3PTLX 391 34.903 22.119 10.824 1.00 0.00 ATOM 2737 C5 3PTLX 391 35.578 20.906 11.467 1.00 0.00 ATOM 2738 C1 3PTLX 392 23.666 25.764 13.911 1.00 0.00 ATOM 2739 C2 3PTLX 392 23.759 27.216 14.385 1.00 0.00 ATOM 2740 C3 3PTLX 392 24.696 27.380 15.583 1.00 0.00 ATOM 2741 O1 3PTLX 392 25.477 28.557 15.356 1.00 0.00 ATOM 2742 H1 3PTLX 392 26.285 28.628 15.940 1.00 0.00 ATOM 2743 C4 3PTLX 392 23.899 27.404 16.888 1.00 0.00 ATOM 2744 C5 3PTLX 392 22.830 28.481 17.084 1.00 0.00 ATOM 2745 C1 3PTLX 393 8.745 4.003 37.142 1.00 0.00 ATOM 2746 C2 3PTLX 393 7.588 3.443 36.313 1.00 0.00 ATOM 2747 C3 3PTLX 393 7.778 1.997 35.851 1.00 0.00 ATOM 2748 O1 3PTLX 393 6.719 1.579 34.986 1.00 0.00 ATOM 2749 H1 3PTLX 393 6.989 1.752 34.039 1.00 0.00 ATOM 2750 C4 3PTLX 393 9.157 1.694 35.261 1.00 0.00 ATOM 2751 C5 3PTLX 393 9.297 0.454 34.375 1.00 0.00 ATOM 2752 C1 3PTLX 394 41.813 22.747 25.912 1.00 0.00 ATOM 2753 C2 3PTLX 394 41.962 21.226 25.836 1.00 0.00 ATOM 2754 C3 3PTLX 394 43.460 20.919 25.790 1.00 0.00 ATOM 2755 O1 3PTLX 394 43.997 20.737 27.103 1.00 0.00 ATOM 2756 H1 3PTLX 394 43.544 21.462 27.622 1.00 0.00 ATOM 2757 C4 3PTLX 394 43.651 19.628 24.991 1.00 0.00 ATOM 2758 C5 3PTLX 394 45.072 19.454 24.449 1.00 0.00 ATOM 2759 C1 3PTLX 395 41.616 13.613 31.064 1.00 0.00 ATOM 2760 C2 3PTLX 395 42.450 12.761 32.023 1.00 0.00 ATOM 2761 C3 3PTLX 395 41.737 12.455 33.342 1.00 0.00 ATOM 2762 O1 3PTLX 395 40.510 11.730 33.232 1.00 0.00 ATOM 2763 H1 3PTLX 395 39.724 12.342 33.315 1.00 0.00 ATOM 2764 C4 3PTLX 395 42.615 11.805 34.414 1.00 0.00 ATOM 2765 C5 3PTLX 395 41.878 11.695 35.750 1.00 0.00 ATOM 2766 C1 3PTLX 396 32.765 1.843 22.078 1.00 0.00 ATOM 2767 C2 3PTLX 396 32.417 3.298 22.399 1.00 0.00 ATOM 2768 C3 3PTLX 396 33.641 4.215 22.435 1.00 0.00 ATOM 2769 O1 3PTLX 396 33.199 5.533 22.099 1.00 0.00 ATOM 2770 H1 3PTLX 396 32.326 5.474 21.615 1.00 0.00 ATOM 2771 C4 3PTLX 396 34.231 4.127 23.844 1.00 0.00 ATOM 2772 C5 3PTLX 396 35.596 4.794 24.025 1.00 0.00 ATOM 2773 C1 3PTLX 397 43.073 34.421 43.729 1.00 0.00 ATOM 2774 C2 3PTLX 397 41.778 35.171 43.413 1.00 0.00 ATOM 2775 C3 3PTLX 397 40.586 34.313 42.983 1.00 0.00 ATOM 2776 O1 3PTLX 397 40.916 33.521 41.839 1.00 0.00 ATOM 2777 H1 3PTLX 397 40.070 33.203 41.410 1.00 0.00 ATOM 2778 C4 3PTLX 397 39.982 33.674 44.234 1.00 0.00 ATOM 2779 C5 3PTLX 397 38.619 32.998 44.071 1.00 0.00 ATOM 2780 C1 3PTLX 398 42.335 6.637 9.170 1.00 0.00 ATOM 2781 C2 3PTLX 398 42.229 7.981 8.446 1.00 0.00 ATOM 2782 C3 3PTLX 398 42.645 7.837 6.980 1.00 0.00 ATOM 2783 O1 3PTLX 398 41.564 7.225 6.272 1.00 0.00 ATOM 2784 H1 3PTLX 398 40.720 7.761 6.298 1.00 0.00 ATOM 2785 C4 3PTLX 398 42.968 9.179 6.320 1.00 0.00 ATOM 2786 C5 3PTLX 398 41.887 10.236 6.551 1.00 0.00 ATOM 2787 C1 3PTLX 399 3.442 40.939 36.791 1.00 0.00 ATOM 2788 C2 3PTLX 399 2.909 42.246 37.379 1.00 0.00 ATOM 2789 C3 3PTLX 399 3.603 42.687 38.670 1.00 0.00 ATOM 2790 O1 3PTLX 399 3.771 41.580 39.559 1.00 0.00 ATOM 2791 H1 3PTLX 399 3.555 41.792 40.512 1.00 0.00 ATOM 2792 C4 3PTLX 399 4.987 43.209 38.281 1.00 0.00 ATOM 2793 C5 3PTLX 399 5.510 43.995 39.485 1.00 0.00 ATOM 2794 C1 3PTLX 400 44.433 37.806 34.272 1.00 0.00 ATOM 2795 C2 3PTLX 400 45.198 38.973 33.643 1.00 0.00 ATOM 2796 C3 3PTLX 400 1.089 39.067 33.781 1.00 0.00 ATOM 2797 O1 3PTLX 400 1.667 37.860 33.277 1.00 0.00 ATOM 2798 H1 3PTLX 400 2.642 37.967 33.085 1.00 0.00 ATOM 2799 C4 3PTLX 400 1.659 40.222 32.955 1.00 0.00 ATOM 2800 C5 3PTLX 400 1.144 41.629 33.265 1.00 0.00 ATOM 2801 C1 3PTLX 401 42.832 9.727 27.803 1.00 0.00 ATOM 2802 C2 3PTLX 401 42.722 9.010 29.149 1.00 0.00 ATOM 2803 C3 3PTLX 401 44.032 8.404 29.655 1.00 0.00 ATOM 2804 O1 3PTLX 401 44.354 7.284 28.826 1.00 0.00 ATOM 2805 H1 3PTLX 401 44.011 6.421 29.197 1.00 0.00 ATOM 2806 C4 3PTLX 401 45.140 9.449 29.802 1.00 0.00 ATOM 2807 C5 3PTLX 401 45.196 9.704 31.309 1.00 0.00 ATOM 2808 C1 3PTLX 402 7.621 7.550 36.762 1.00 0.00 ATOM 2809 C2 3PTLX 402 7.987 8.855 37.472 1.00 0.00 ATOM 2810 C3 3PTLX 402 7.959 8.712 38.995 1.00 0.00 ATOM 2811 O1 3PTLX 402 8.474 7.515 39.583 1.00 0.00 ATOM 2812 H1 3PTLX 402 9.443 7.388 39.373 1.00 0.00 ATOM 2813 C4 3PTLX 402 8.397 9.982 39.728 1.00 0.00 ATOM 2814 C5 3PTLX 402 7.818 10.150 41.135 1.00 0.00 ATOM 2815 C1 3PTLX 403 24.110 7.044 42.324 1.00 0.00 ATOM 2816 C2 3PTLX 403 23.171 6.323 43.293 1.00 0.00 ATOM 2817 C3 3PTLX 403 23.015 7.258 44.493 1.00 0.00 ATOM 2818 O1 3PTLX 403 21.949 8.173 44.225 1.00 0.00 ATOM 2819 H1 3PTLX 403 21.456 8.532 45.017 1.00 0.00 ATOM 2820 C4 3PTLX 403 22.653 6.223 45.560 1.00 0.00 ATOM 2821 C5 3PTLX 403 23.831 5.537 46.256 1.00 0.00 ATOM 2822 C1 3PTLX 404 11.455 5.387 44.124 1.00 0.00 ATOM 2823 C2 3PTLX 404 11.235 6.820 44.614 1.00 0.00 ATOM 2824 C3 3PTLX 404 11.608 7.963 43.666 1.00 0.00 ATOM 2825 O1 3PTLX 404 11.116 7.599 42.374 1.00 0.00 ATOM 2826 H1 3PTLX 404 10.199 7.226 42.521 1.00 0.00 ATOM 2827 C4 3PTLX 404 10.820 9.169 44.182 1.00 0.00 ATOM 2828 C5 3PTLX 404 11.652 10.093 45.073 1.00 0.00 ATOM 2829 C1 3PTLX 405 29.206 11.955 17.906 1.00 0.00 ATOM 2830 C2 3PTLX 405 30.308 12.829 17.304 1.00 0.00 ATOM 2831 C3 3PTLX 405 29.674 14.011 16.570 1.00 0.00 ATOM 2832 O1 3PTLX 405 29.053 14.960 17.441 1.00 0.00 ATOM 2833 H1 3PTLX 405 29.424 14.774 18.351 1.00 0.00 ATOM 2834 C4 3PTLX 405 30.746 14.693 15.717 1.00 0.00 ATOM 2835 C5 3PTLX 405 30.302 16.013 15.084 1.00 0.00 ATOM 2836 C1 3PTLX 406 9.892 34.582 40.173 1.00 0.00 ATOM 2837 C2 3PTLX 406 8.818 33.740 40.864 1.00 0.00 ATOM 2838 C3 3PTLX 406 8.954 32.217 40.888 1.00 0.00 ATOM 2839 O1 3PTLX 406 8.027 31.556 41.754 1.00 0.00 ATOM 2840 H1 3PTLX 406 7.308 31.055 41.272 1.00 0.00 ATOM 2841 C4 3PTLX 406 8.661 31.735 39.466 1.00 0.00 ATOM 2842 C5 3PTLX 406 8.997 30.243 39.430 1.00 0.00 ATOM 2843 C1 3PTLX 407 31.051 42.628 1.017 1.00 0.00 ATOM 2844 C2 3PTLX 407 30.424 43.180 -0.265 1.00 0.00 ATOM 2845 C3 3PTLX 407 28.964 42.736 45.253 1.00 0.00 ATOM 2846 O1 3PTLX 407 28.085 43.650 44.592 1.00 0.00 ATOM 2847 H1 3PTLX 407 27.177 43.284 44.792 1.00 0.00 ATOM 2848 C4 3PTLX 407 28.953 41.348 44.608 1.00 0.00 ATOM 2849 C5 3PTLX 407 27.530 40.795 44.719 1.00 0.00 ATOM 2850 C1 3PTLX 408 11.584 36.011 43.991 1.00 0.00 ATOM 2851 C2 3PTLX 408 10.285 36.735 43.633 1.00 0.00 ATOM 2852 C3 3PTLX 408 9.903 37.818 44.645 1.00 0.00 ATOM 2853 O1 3PTLX 408 10.809 38.923 44.605 1.00 0.00 ATOM 2854 H1 3PTLX 408 10.341 39.802 44.514 1.00 0.00 ATOM 2855 C4 3PTLX 408 8.428 38.182 44.464 1.00 0.00 ATOM 2856 C5 3PTLX 408 7.491 36.973 44.458 1.00 0.00 ATOM 2857 C1 3PTLX 409 4.556 6.548 39.512 1.00 0.00 ATOM 2858 C2 3PTLX 409 3.242 6.804 40.253 1.00 0.00 ATOM 2859 C3 3PTLX 409 3.351 7.540 41.590 1.00 0.00 ATOM 2860 O1 3PTLX 409 4.116 6.802 42.547 1.00 0.00 ATOM 2861 H1 3PTLX 409 3.946 5.822 42.443 1.00 0.00 ATOM 2862 C4 3PTLX 409 3.928 8.926 41.292 1.00 0.00 ATOM 2863 C5 3PTLX 409 3.457 10.026 42.245 1.00 0.00 ATOM 2864 C1 3PTLX 410 18.583 20.154 3.498 1.00 0.00 ATOM 2865 C2 3PTLX 410 17.193 19.631 3.132 1.00 0.00 ATOM 2866 C3 3PTLX 410 17.309 18.535 2.071 1.00 0.00 ATOM 2867 O1 3PTLX 410 16.025 17.917 1.943 1.00 0.00 ATOM 2868 H1 3PTLX 410 16.208 16.975 1.661 1.00 0.00 ATOM 2869 C4 3PTLX 410 17.735 19.099 0.714 1.00 0.00 ATOM 2870 C5 3PTLX 410 18.211 17.977 -0.212 1.00 0.00 ATOM 2871 C1 3PTLX 411 1.512 1.629 5.769 1.00 0.00 ATOM 2872 C2 3PTLX 411 0.825 0.824 4.665 1.00 0.00 ATOM 2873 C3 3PTLX 411 44.972 0.755 5.033 1.00 0.00 ATOM 2874 O1 3PTLX 411 44.360 0.121 3.907 1.00 0.00 ATOM 2875 H1 3PTLX 411 44.961 -0.557 3.484 1.00 0.00 ATOM 2876 C4 3PTLX 411 44.714 45.502 6.255 1.00 0.00 ATOM 2877 C5 3PTLX 411 43.624 46.127 7.128 1.00 0.00 ATOM 2878 C1 3PTLX 412 12.070 7.478 36.732 1.00 0.00 ATOM 2879 C2 3PTLX 412 12.259 6.271 37.654 1.00 0.00 ATOM 2880 C3 3PTLX 412 12.266 6.752 39.106 1.00 0.00 ATOM 2881 O1 3PTLX 412 11.121 7.477 39.563 1.00 0.00 ATOM 2882 H1 3PTLX 412 11.173 7.696 40.537 1.00 0.00 ATOM 2883 C4 3PTLX 412 12.590 5.585 40.040 1.00 0.00 ATOM 2884 C5 3PTLX 412 11.501 4.512 40.082 1.00 0.00 ATOM 2885 C1 3PTLX 413 0.525 2.230 15.085 1.00 0.00 ATOM 2886 C2 3PTLX 413 0.826 1.202 16.178 1.00 0.00 ATOM 2887 C3 3PTLX 413 0.912 45.360 15.768 1.00 0.00 ATOM 2888 O1 3PTLX 413 -0.083 45.105 14.773 1.00 0.00 ATOM 2889 H1 3PTLX 413 -0.953 45.559 14.969 1.00 0.00 ATOM 2890 C4 3PTLX 413 2.359 45.126 15.331 1.00 0.00 ATOM 2891 C5 3PTLX 413 2.755 43.653 15.455 1.00 0.00 ATOM 2892 C1 3PTLX 414 35.593 34.370 33.143 1.00 0.00 ATOM 2893 C2 3PTLX 414 35.865 35.832 32.785 1.00 0.00 ATOM 2894 C3 3PTLX 414 34.568 36.637 32.686 1.00 0.00 ATOM 2895 O1 3PTLX 414 33.950 36.840 33.960 1.00 0.00 ATOM 2896 H1 3PTLX 414 34.604 37.312 34.552 1.00 0.00 ATOM 2897 C4 3PTLX 414 34.535 38.053 32.108 1.00 0.00 ATOM 2898 C5 3PTLX 414 34.798 38.172 30.606 1.00 0.00 ATOM 2899 C1 3PTLX 415 3.989 26.508 15.212 1.00 0.00 ATOM 2900 C2 3PTLX 415 3.967 27.246 13.871 1.00 0.00 ATOM 2901 C3 3PTLX 415 5.406 27.342 13.360 1.00 0.00 ATOM 2902 O1 3PTLX 415 6.020 26.092 13.033 1.00 0.00 ATOM 2903 H1 3PTLX 415 5.575 25.812 12.183 1.00 0.00 ATOM 2904 C4 3PTLX 415 5.589 28.412 12.282 1.00 0.00 ATOM 2905 C5 3PTLX 415 5.391 29.850 12.764 1.00 0.00 ATOM 2906 C1 3PTLX 416 6.980 38.907 35.007 1.00 0.00 ATOM 2907 C2 3PTLX 416 5.619 38.710 34.337 1.00 0.00 ATOM 2908 C3 3PTLX 416 5.681 37.860 33.067 1.00 0.00 ATOM 2909 O1 3PTLX 416 4.346 37.478 32.723 1.00 0.00 ATOM 2910 H1 3PTLX 416 4.255 36.565 32.326 1.00 0.00 ATOM 2911 C4 3PTLX 416 6.356 38.692 31.975 1.00 0.00 ATOM 2912 C5 3PTLX 416 6.848 37.911 30.755 1.00 0.00 ATOM 2913 C1 3PTLX 417 37.166 7.730 8.855 1.00 0.00 ATOM 2914 C2 3PTLX 417 37.756 8.945 8.137 1.00 0.00 ATOM 2915 C3 3PTLX 417 37.909 8.826 6.619 1.00 0.00 ATOM 2916 O1 3PTLX 417 38.855 7.812 6.268 1.00 0.00 ATOM 2917 H1 3PTLX 417 38.562 6.882 6.490 1.00 0.00 ATOM 2918 C4 3PTLX 417 36.597 8.535 5.888 1.00 0.00 ATOM 2919 C5 3PTLX 417 36.691 8.634 4.365 1.00 0.00 ATOM 2920 C1 3PTLX 418 44.657 16.443 1.329 1.00 0.00 ATOM 2921 C2 3PTLX 418 45.822 15.948 2.189 1.00 0.00 ATOM 2922 C3 3PTLX 418 45.583 14.551 2.766 1.00 0.00 ATOM 2923 O1 3PTLX 418 46.749 14.005 3.388 1.00 0.00 ATOM 2924 H1 3PTLX 418 47.048 13.364 2.680 1.00 0.00 ATOM 2925 C4 3PTLX 418 44.400 14.619 3.733 1.00 0.00 ATOM 2926 C5 3PTLX 418 44.027 13.253 4.312 1.00 0.00 ATOM 2927 C1 3PTLX 419 25.291 17.020 33.846 1.00 0.00 ATOM 2928 C2 3PTLX 419 25.444 18.534 34.007 1.00 0.00 ATOM 2929 C3 3PTLX 419 26.808 19.079 33.580 1.00 0.00 ATOM 2930 O1 3PTLX 419 26.788 18.805 32.176 1.00 0.00 ATOM 2931 H1 3PTLX 419 27.637 18.331 31.942 1.00 0.00 ATOM 2932 C4 3PTLX 419 26.939 20.598 33.712 1.00 0.00 ATOM 2933 C5 3PTLX 419 28.382 21.004 33.409 1.00 0.00 ATOM 2934 C1 3PTLX 420 23.003 37.560 44.220 1.00 0.00 ATOM 2935 C2 3PTLX 420 24.056 36.751 44.979 1.00 0.00 ATOM 2936 C3 3PTLX 420 24.414 35.414 44.327 1.00 0.00 ATOM 2937 O1 3PTLX 420 25.736 35.059 44.740 1.00 0.00 ATOM 2938 H1 3PTLX 420 26.395 35.412 44.076 1.00 0.00 ATOM 2939 C4 3PTLX 420 23.364 34.373 44.723 1.00 0.00 ATOM 2940 C5 3PTLX 420 23.563 32.999 44.081 1.00 0.00 ATOM 2941 C1 3PTLX 421 7.142 45.024 29.172 1.00 0.00 ATOM 2942 C2 3PTLX 421 6.727 45.635 30.512 1.00 0.00 ATOM 2943 C3 3PTLX 421 7.472 1.324 30.726 1.00 0.00 ATOM 2944 O1 3PTLX 421 7.153 1.881 32.004 1.00 0.00 ATOM 2945 H1 3PTLX 421 7.352 2.853 31.881 1.00 0.00 ATOM 2946 C4 3PTLX 421 8.982 1.178 30.528 1.00 0.00 ATOM 2947 C5 3PTLX 421 9.693 2.442 30.042 1.00 0.00 ATOM 2948 C1 3PTLX 422 36.040 6.081 31.254 1.00 0.00 ATOM 2949 C2 3PTLX 422 35.712 6.263 29.771 1.00 0.00 ATOM 2950 C3 3PTLX 422 34.227 6.620 29.672 1.00 0.00 ATOM 2951 O1 3PTLX 422 33.905 7.977 29.985 1.00 0.00 ATOM 2952 H1 3PTLX 422 33.495 7.941 30.897 1.00 0.00 ATOM 2953 C4 3PTLX 422 33.575 6.278 28.331 1.00 0.00 ATOM 2954 C5 3PTLX 422 34.341 7.013 27.229 1.00 0.00 ATOM 2955 C1 3PTLX 423 6.574 11.516 23.349 1.00 0.00 ATOM 2956 C2 3PTLX 423 5.860 10.192 23.066 1.00 0.00 ATOM 2957 C3 3PTLX 423 5.490 9.962 21.600 1.00 0.00 ATOM 2958 O1 3PTLX 423 6.653 9.525 20.891 1.00 0.00 ATOM 2959 H1 3PTLX 423 6.491 9.861 19.963 1.00 0.00 ATOM 2960 C4 3PTLX 423 4.462 8.829 21.571 1.00 0.00 ATOM 2961 C5 3PTLX 423 3.619 8.870 20.295 1.00 0.00 ATOM 2962 C1 3PTLX 424 23.782 25.165 0.866 1.00 0.00 ATOM 2963 C2 3PTLX 424 24.028 23.864 0.099 1.00 0.00 ATOM 2964 C3 3PTLX 424 23.007 23.690 44.604 1.00 0.00 ATOM 2965 O1 3PTLX 424 22.974 24.861 43.783 1.00 0.00 ATOM 2966 H1 3PTLX 424 22.517 24.657 42.917 1.00 0.00 ATOM 2967 C4 3PTLX 424 23.450 22.448 43.828 1.00 0.00 ATOM 2968 C5 3PTLX 424 22.283 22.012 42.940 1.00 0.00 ATOM 2969 C1 3PTLX 425 11.633 12.691 36.314 1.00 0.00 ATOM 2970 C2 3PTLX 425 11.766 11.952 37.647 1.00 0.00 ATOM 2971 C3 3PTLX 425 13.150 11.326 37.830 1.00 0.00 ATOM 2972 O1 3PTLX 425 14.297 12.121 37.522 1.00 0.00 ATOM 2973 H1 3PTLX 425 14.509 12.813 38.213 1.00 0.00 ATOM 2974 C4 3PTLX 425 13.226 10.866 39.287 1.00 0.00 ATOM 2975 C5 3PTLX 425 13.281 11.996 40.318 1.00 0.00 ATOM 2976 C1 3PTLX 426 13.906 1.365 32.572 1.00 0.00 ATOM 2977 C2 3PTLX 426 13.591 1.612 34.049 1.00 0.00 ATOM 2978 C3 3PTLX 426 14.563 1.036 35.081 1.00 0.00 ATOM 2979 O1 3PTLX 426 15.889 1.454 34.746 1.00 0.00 ATOM 2980 H1 3PTLX 426 16.168 2.246 35.288 1.00 0.00 ATOM 2981 C4 3PTLX 426 14.264 1.645 36.452 1.00 0.00 ATOM 2982 C5 3PTLX 426 15.283 1.122 37.466 1.00 0.00 ATOM 2983 C1 3PTLX 427 42.016 39.487 9.385 1.00 0.00 ATOM 2984 C2 3PTLX 427 42.227 40.062 7.983 1.00 0.00 ATOM 2985 C3 3PTLX 427 43.331 41.117 8.072 1.00 0.00 ATOM 2986 O1 3PTLX 427 43.720 41.340 6.714 1.00 0.00 ATOM 2987 H1 3PTLX 427 43.188 42.060 6.267 1.00 0.00 ATOM 2988 C4 3PTLX 427 42.697 42.378 8.663 1.00 0.00 ATOM 2989 C5 3PTLX 427 43.829 43.337 9.036 1.00 0.00 ATOM 2990 C1 3PTLX 428 38.816 1.481 30.733 1.00 0.00 ATOM 2991 C2 3PTLX 428 39.203 0.676 31.975 1.00 0.00 ATOM 2992 C3 3PTLX 428 38.203 45.213 32.359 1.00 0.00 ATOM 2993 O1 3PTLX 428 38.989 44.331 33.165 1.00 0.00 ATOM 2994 H1 3PTLX 428 39.663 43.931 32.544 1.00 0.00 ATOM 2995 C4 3PTLX 428 36.935 0.110 33.033 1.00 0.00 ATOM 2996 C5 3PTLX 428 35.763 -0.866 33.147 1.00 0.00 ATOM 2997 C1 3PTLX 429 2.493 42.349 2.013 1.00 0.00 ATOM 2998 C2 3PTLX 429 1.237 42.916 1.348 1.00 0.00 ATOM 2999 C3 3PTLX 429 45.629 42.649 2.205 1.00 0.00 ATOM 3000 O1 3PTLX 429 45.684 43.410 3.415 1.00 0.00 ATOM 3001 H1 3PTLX 429 45.939 42.729 4.101 1.00 0.00 ATOM 3002 C4 3PTLX 429 44.373 42.924 1.375 1.00 0.00 ATOM 3003 C5 3PTLX 429 44.157 41.685 0.504 1.00 0.00 ATOM 3004 C1 3PTLX 430 41.422 37.793 31.998 1.00 0.00 ATOM 3005 C2 3PTLX 430 42.557 37.847 30.975 1.00 0.00 ATOM 3006 C3 3PTLX 430 43.122 36.426 30.928 1.00 0.00 ATOM 3007 O1 3PTLX 430 42.259 35.491 30.276 1.00 0.00 ATOM 3008 H1 3PTLX 430 41.555 35.028 30.815 1.00 0.00 ATOM 3009 C4 3PTLX 430 44.473 36.451 30.209 1.00 0.00 ATOM 3010 C5 3PTLX 430 44.380 36.976 28.775 1.00 0.00 ATOM 3011 C1 3PTLX 431 18.742 23.062 44.683 1.00 0.00 ATOM 3012 C2 3PTLX 431 17.213 23.102 44.624 1.00 0.00 ATOM 3013 C3 3PTLX 431 16.670 23.727 0.281 1.00 0.00 ATOM 3014 O1 3PTLX 431 16.355 25.092 -0.008 1.00 0.00 ATOM 3015 H1 3PTLX 431 16.414 25.579 0.863 1.00 0.00 ATOM 3016 C4 3PTLX 431 15.404 22.996 0.731 1.00 0.00 ATOM 3017 C5 3PTLX 431 14.189 22.973 -0.199 1.00 0.00 ATOM 3018 C1 3PTLX 432 21.156 35.567 29.837 1.00 0.00 ATOM 3019 C2 3PTLX 432 22.516 35.640 30.535 1.00 0.00 ATOM 3020 C3 3PTLX 432 23.607 34.877 29.782 1.00 0.00 ATOM 3021 O1 3PTLX 432 23.889 35.594 28.577 1.00 0.00 ATOM 3022 H1 3PTLX 432 23.870 36.578 28.756 1.00 0.00 ATOM 3023 C4 3PTLX 432 24.847 34.935 30.677 1.00 0.00 ATOM 3024 C5 3PTLX 432 24.945 33.700 31.574 1.00 0.00 ATOM 3025 C1 3PTLX 433 6.763 6.180 8.713 1.00 0.00 ATOM 3026 C2 3PTLX 433 5.313 6.116 9.199 1.00 0.00 ATOM 3027 C3 3PTLX 433 4.757 7.488 9.586 1.00 0.00 ATOM 3028 O1 3PTLX 433 4.567 8.294 8.421 1.00 0.00 ATOM 3029 H1 3PTLX 433 5.473 8.514 8.060 1.00 0.00 ATOM 3030 C4 3PTLX 433 3.558 7.442 10.536 1.00 0.00 ATOM 3031 C5 3PTLX 433 2.335 6.815 9.864 1.00 0.00 ATOM 3032 C1 3PTLX 434 30.529 38.963 34.851 1.00 0.00 ATOM 3033 C2 3PTLX 434 30.015 37.665 35.477 1.00 0.00 ATOM 3034 C3 3PTLX 434 30.577 36.394 34.839 1.00 0.00 ATOM 3035 O1 3PTLX 434 31.853 35.984 35.336 1.00 0.00 ATOM 3036 H1 3PTLX 434 32.519 36.315 34.667 1.00 0.00 ATOM 3037 C4 3PTLX 434 29.676 35.171 35.025 1.00 0.00 ATOM 3038 C5 3PTLX 434 28.406 35.118 34.173 1.00 0.00 ATOM 3039 C1 3PTLX 435 6.954 18.781 10.310 1.00 0.00 ATOM 3040 C2 3PTLX 435 6.235 18.229 11.543 1.00 0.00 ATOM 3041 C3 3PTLX 435 5.569 16.879 11.271 1.00 0.00 ATOM 3042 O1 3PTLX 435 6.668 15.985 11.072 1.00 0.00 ATOM 3043 H1 3PTLX 435 6.313 15.052 11.026 1.00 0.00 ATOM 3044 C4 3PTLX 435 4.666 16.305 12.365 1.00 0.00 ATOM 3045 C5 3PTLX 435 3.275 16.940 12.305 1.00 0.00 ATOM 3046 C1 3PTLX 436 34.723 26.128 16.578 1.00 0.00 ATOM 3047 C2 3PTLX 436 35.803 25.551 15.660 1.00 0.00 ATOM 3048 C3 3PTLX 436 35.959 24.052 15.922 1.00 0.00 ATOM 3049 O1 3PTLX 436 35.028 23.148 15.320 1.00 0.00 ATOM 3050 H1 3PTLX 436 34.594 23.551 14.515 1.00 0.00 ATOM 3051 C4 3PTLX 436 37.404 23.707 15.555 1.00 0.00 ATOM 3052 C5 3PTLX 436 37.808 22.232 15.592 1.00 0.00 ATOM 3053 C1 3PTLX 437 29.876 2.254 11.596 1.00 0.00 ATOM 3054 C2 3PTLX 437 30.395 3.635 12.002 1.00 0.00 ATOM 3055 C3 3PTLX 437 30.990 3.546 13.409 1.00 0.00 ATOM 3056 O1 3PTLX 437 32.369 3.175 13.331 1.00 0.00 ATOM 3057 H1 3PTLX 437 32.595 3.151 14.305 1.00 0.00 ATOM 3058 C4 3PTLX 437 30.835 4.967 13.955 1.00 0.00 ATOM 3059 C5 3PTLX 437 31.827 5.907 13.267 1.00 0.00 ATOM 3060 C1 3PTLX 438 19.168 25.925 42.184 1.00 0.00 ATOM 3061 C2 3PTLX 438 19.662 24.930 41.132 1.00 0.00 ATOM 3062 C3 3PTLX 438 21.011 25.146 40.442 1.00 0.00 ATOM 3063 O1 3PTLX 438 22.140 25.259 41.312 1.00 0.00 ATOM 3064 H1 3PTLX 438 23.046 25.252 40.889 1.00 0.00 ATOM 3065 C4 3PTLX 438 21.341 24.093 39.382 1.00 0.00 ATOM 3066 C5 3PTLX 438 20.745 24.460 38.022 1.00 0.00 ATOM 3067 C1 3PTLX 439 28.430 10.874 7.288 1.00 0.00 ATOM 3068 C2 3PTLX 439 27.785 9.503 7.505 1.00 0.00 ATOM 3069 C3 3PTLX 439 26.728 9.195 6.443 1.00 0.00 ATOM 3070 O1 3PTLX 439 27.428 8.874 5.237 1.00 0.00 ATOM 3071 H1 3PTLX 439 28.038 8.084 5.304 1.00 0.00 ATOM 3072 C4 3PTLX 439 25.811 8.014 6.768 1.00 0.00 ATOM 3073 C5 3PTLX 439 26.468 6.692 7.170 1.00 0.00 ATOM 3074 C1 3PTLX 440 29.263 24.568 23.623 1.00 0.00 ATOM 3075 C2 3PTLX 440 29.197 25.600 22.495 1.00 0.00 ATOM 3076 C3 3PTLX 440 28.110 26.602 22.890 1.00 0.00 ATOM 3077 O1 3PTLX 440 28.642 27.462 23.901 1.00 0.00 ATOM 3078 H1 3PTLX 440 29.323 28.054 23.469 1.00 0.00 ATOM 3079 C4 3PTLX 440 27.688 27.323 21.609 1.00 0.00 ATOM 3080 C5 3PTLX 440 26.967 26.312 20.715 1.00 0.00 ATOM 3081 C1 3PTLX 441 5.501 45.456 13.082 1.00 0.00 ATOM 3082 C2 3PTLX 441 6.028 46.499 14.070 1.00 0.00 ATOM 3083 C3 3PTLX 441 5.151 2.121 14.132 1.00 0.00 ATOM 3084 O1 3PTLX 441 5.826 2.895 15.127 1.00 0.00 ATOM 3085 H1 3PTLX 441 5.762 2.346 15.960 1.00 0.00 ATOM 3086 C4 3PTLX 441 5.099 2.988 12.873 1.00 0.00 ATOM 3087 C5 3PTLX 441 3.982 4.011 13.090 1.00 0.00 ATOM 3088 C1 3PTLX 442 25.953 44.428 8.004 1.00 0.00 ATOM 3089 C2 3PTLX 442 25.821 44.142 6.506 1.00 0.00 ATOM 3090 C3 3PTLX 442 26.324 42.761 6.081 1.00 0.00 ATOM 3091 O1 3PTLX 442 25.790 41.671 6.837 1.00 0.00 ATOM 3092 H1 3PTLX 442 25.479 40.942 6.229 1.00 0.00 ATOM 3093 C4 3PTLX 442 26.046 42.603 4.584 1.00 0.00 ATOM 3094 C5 3PTLX 442 26.913 43.632 3.856 1.00 0.00 ATOM 3095 C1 3PTLX 443 12.307 16.844 17.699 1.00 0.00 ATOM 3096 C2 3PTLX 443 11.098 16.176 18.357 1.00 0.00 ATOM 3097 C3 3PTLX 443 10.893 14.786 17.750 1.00 0.00 ATOM 3098 O1 3PTLX 443 11.862 13.808 18.138 1.00 0.00 ATOM 3099 H1 3PTLX 443 11.948 13.760 19.133 1.00 0.00 ATOM 3100 C4 3PTLX 443 9.475 14.266 17.997 1.00 0.00 ATOM 3101 C5 3PTLX 443 9.162 13.789 19.417 1.00 0.00 ATOM 3102 C1 3PTLX 444 45.075 4.100 39.217 1.00 0.00 ATOM 3103 C2 3PTLX 444 44.363 3.105 40.134 1.00 0.00 ATOM 3104 C3 3PTLX 444 45.134 1.785 40.187 1.00 0.00 ATOM 3105 O1 3PTLX 444 44.409 1.017 41.151 1.00 0.00 ATOM 3106 H1 3PTLX 444 43.808 0.431 40.607 1.00 0.00 ATOM 3107 C4 3PTLX 444 45.010 0.987 38.887 1.00 0.00 ATOM 3108 C5 3PTLX 444 45.978 -0.196 38.808 1.00 0.00 ATOM 3109 C1 3PTLX 445 28.584 32.962 37.897 1.00 0.00 ATOM 3110 C2 3PTLX 445 28.650 33.842 39.147 1.00 0.00 ATOM 3111 C3 3PTLX 445 28.483 33.046 40.442 1.00 0.00 ATOM 3112 O1 3PTLX 445 28.941 33.789 41.575 1.00 0.00 ATOM 3113 H1 3PTLX 445 29.324 33.075 42.160 1.00 0.00 ATOM 3114 C4 3PTLX 445 27.130 32.357 40.636 1.00 0.00 ATOM 3115 C5 3PTLX 445 25.882 33.227 40.795 1.00 0.00 ATOM 3116 C1 3PTLX 446 45.509 43.099 21.154 1.00 0.00 ATOM 3117 C2 3PTLX 446 44.833 44.314 20.515 1.00 0.00 ATOM 3118 C3 3PTLX 446 43.375 44.018 20.157 1.00 0.00 ATOM 3119 O1 3PTLX 446 42.542 44.238 21.298 1.00 0.00 ATOM 3120 H1 3PTLX 446 41.818 43.553 21.375 1.00 0.00 ATOM 3121 C4 3PTLX 446 42.902 44.828 18.948 1.00 0.00 ATOM 3122 C5 3PTLX 446 42.919 46.352 19.084 1.00 0.00 ATOM 3123 C1 3PTLX 447 12.918 30.624 21.126 1.00 0.00 ATOM 3124 C2 3PTLX 447 11.519 31.207 20.920 1.00 0.00 ATOM 3125 C3 3PTLX 447 11.379 32.621 20.352 1.00 0.00 ATOM 3126 O1 3PTLX 447 12.167 32.867 19.185 1.00 0.00 ATOM 3127 H1 3PTLX 447 12.354 32.011 18.702 1.00 0.00 ATOM 3128 C4 3PTLX 447 9.940 32.990 19.984 1.00 0.00 ATOM 3129 C5 3PTLX 447 9.652 34.380 19.413 1.00 0.00 ATOM 3130 C1 3PTLX 448 12.361 0.773 16.252 1.00 0.00 ATOM 3131 C2 3PTLX 448 13.350 1.763 15.631 1.00 0.00 ATOM 3132 C3 3PTLX 448 13.604 2.934 16.582 1.00 0.00 ATOM 3133 O1 3PTLX 448 14.662 3.737 16.054 1.00 0.00 ATOM 3134 H1 3PTLX 448 15.570 3.332 16.160 1.00 0.00 ATOM 3135 C4 3PTLX 448 12.403 3.862 16.768 1.00 0.00 ATOM 3136 C5 3PTLX 448 12.471 4.951 17.842 1.00 0.00 ATOM 3137 C1 3PTLX 449 29.127 6.706 29.596 1.00 0.00 ATOM 3138 C2 3PTLX 449 29.152 8.117 29.006 1.00 0.00 ATOM 3139 C3 3PTLX 449 29.265 9.171 30.110 1.00 0.00 ATOM 3140 O1 3PTLX 449 30.660 9.080 30.410 1.00 0.00 ATOM 3141 H1 3PTLX 449 31.249 9.614 29.803 1.00 0.00 ATOM 3142 C4 3PTLX 449 28.991 10.526 29.453 1.00 0.00 ATOM 3143 C5 3PTLX 449 28.619 11.530 30.546 1.00 0.00 ATOM 3144 C1 3PTLX 450 42.364 10.787 21.013 1.00 0.00 ATOM 3145 C2 3PTLX 450 41.554 9.618 20.450 1.00 0.00 ATOM 3146 C3 3PTLX 450 41.146 9.794 18.986 1.00 0.00 ATOM 3147 O1 3PTLX 450 42.248 9.850 18.076 1.00 0.00 ATOM 3148 H1 3PTLX 450 42.595 8.955 17.796 1.00 0.00 ATOM 3149 C4 3PTLX 450 40.237 8.649 18.533 1.00 0.00 ATOM 3150 C5 3PTLX 450 38.897 8.628 19.271 1.00 0.00 ATOM 3151 C1 3PTLX 451 14.950 31.368 5.608 1.00 0.00 ATOM 3152 C2 3PTLX 451 14.476 32.820 5.693 1.00 0.00 ATOM 3153 C3 3PTLX 451 15.757 33.642 5.848 1.00 0.00 ATOM 3154 O1 3PTLX 451 16.336 33.825 4.554 1.00 0.00 ATOM 3155 H1 3PTLX 451 17.155 34.363 4.754 1.00 0.00 ATOM 3156 C4 3PTLX 451 15.423 34.988 6.494 1.00 0.00 ATOM 3157 C5 3PTLX 451 16.759 35.657 6.823 1.00 0.00 ATOM 3158 C1 3PTLX 452 34.564 44.370 40.830 1.00 0.00 ATOM 3159 C2 3PTLX 452 35.371 43.740 41.967 1.00 0.00 ATOM 3160 C3 3PTLX 452 35.076 42.274 42.288 1.00 0.00 ATOM 3161 O1 3PTLX 452 36.192 41.714 42.985 1.00 0.00 ATOM 3162 H1 3PTLX 452 36.277 42.171 43.870 1.00 0.00 ATOM 3163 C4 3PTLX 452 33.877 42.082 43.220 1.00 0.00 ATOM 3164 C5 3PTLX 452 33.271 40.689 43.400 1.00 0.00 ATOM 3165 C1 3PTLX 453 43.687 26.786 5.359 1.00 0.00 ATOM 3166 C2 3PTLX 453 42.845 26.890 4.086 1.00 0.00 ATOM 3167 C3 3PTLX 453 42.593 25.585 3.328 1.00 0.00 ATOM 3168 O1 3PTLX 453 41.684 24.638 3.895 1.00 0.00 ATOM 3169 H1 3PTLX 453 42.271 23.830 3.845 1.00 0.00 ATOM 3170 C4 3PTLX 453 42.039 25.995 1.962 1.00 0.00 ATOM 3171 C5 3PTLX 453 43.197 26.327 1.018 1.00 0.00 ATOM 3172 C1 3PTLX 454 20.468 27.987 0.959 1.00 0.00 ATOM 3173 C2 3PTLX 454 21.631 28.911 1.329 1.00 0.00 ATOM 3174 C3 3PTLX 454 21.201 29.787 2.507 1.00 0.00 ATOM 3175 O1 3PTLX 454 22.402 30.195 3.168 1.00 0.00 ATOM 3176 H1 3PTLX 454 22.159 30.979 3.739 1.00 0.00 ATOM 3177 C4 3PTLX 454 20.559 31.113 2.091 1.00 0.00 ATOM 3178 C5 3PTLX 454 19.541 31.653 3.097 1.00 0.00 ATOM 3179 C1 3PTLX 455 34.368 13.517 6.234 1.00 0.00 ATOM 3180 C2 3PTLX 455 33.170 13.015 7.042 1.00 0.00 ATOM 3181 C3 3PTLX 455 33.330 12.760 8.542 1.00 0.00 ATOM 3182 O1 3PTLX 455 33.474 13.988 9.260 1.00 0.00 ATOM 3183 H1 3PTLX 455 33.018 14.762 8.820 1.00 0.00 ATOM 3184 C4 3PTLX 455 32.171 12.012 9.202 1.00 0.00 ATOM 3185 C5 3PTLX 455 32.165 10.572 8.684 1.00 0.00 ATOM 3186 C1 3PTLX 456 1.756 6.243 32.159 1.00 0.00 ATOM 3187 C2 3PTLX 456 2.730 5.147 32.596 1.00 0.00 ATOM 3188 C3 3PTLX 456 3.755 4.579 31.614 1.00 0.00 ATOM 3189 O1 3PTLX 456 4.818 3.924 32.312 1.00 0.00 ATOM 3190 H1 3PTLX 456 4.526 3.107 32.810 1.00 0.00 ATOM 3191 C4 3PTLX 456 3.037 3.495 30.808 1.00 0.00 ATOM 3192 C5 3PTLX 456 3.869 3.101 29.586 1.00 0.00 ATOM 3193 C1 3PTLX 457 34.402 41.759 29.538 1.00 0.00 ATOM 3194 C2 3PTLX 457 33.430 42.830 29.040 1.00 0.00 ATOM 3195 C3 3PTLX 457 32.139 42.199 28.515 1.00 0.00 ATOM 3196 O1 3PTLX 457 32.303 41.619 27.219 1.00 0.00 ATOM 3197 H1 3PTLX 457 32.629 42.305 26.569 1.00 0.00 ATOM 3198 C4 3PTLX 457 31.593 41.103 29.432 1.00 0.00 ATOM 3199 C5 3PTLX 457 30.155 40.724 29.073 1.00 0.00 ATOM 3200 C1 3PTLX 458 41.406 41.007 3.395 1.00 0.00 ATOM 3201 C2 3PTLX 458 41.211 42.487 3.059 1.00 0.00 ATOM 3202 C3 3PTLX 458 41.037 43.408 4.268 1.00 0.00 ATOM 3203 O1 3PTLX 458 42.331 43.445 4.874 1.00 0.00 ATOM 3204 H1 3PTLX 458 42.900 44.029 4.295 1.00 0.00 ATOM 3205 C4 3PTLX 458 40.439 44.762 3.880 1.00 0.00 ATOM 3206 C5 3PTLX 458 40.742 45.810 4.953 1.00 0.00 ATOM 3207 C1 3PTLX 459 32.604 44.402 4.655 1.00 0.00 ATOM 3208 C2 3PTLX 459 33.153 45.574 5.471 1.00 0.00 ATOM 3209 C3 3PTLX 459 32.953 45.342 6.970 1.00 0.00 ATOM 3210 O1 3PTLX 459 33.761 44.255 7.431 1.00 0.00 ATOM 3211 H1 3PTLX 459 33.128 43.600 7.845 1.00 0.00 ATOM 3212 C4 3PTLX 459 33.336 0.920 7.827 1.00 0.00 ATOM 3213 C5 3PTLX 459 32.670 0.866 9.204 1.00 0.00 ATOM 3214 C1 3PTLX 460 38.258 5.125 26.517 1.00 0.00 ATOM 3215 C2 3PTLX 460 39.650 5.131 27.151 1.00 0.00 ATOM 3216 C3 3PTLX 460 40.566 6.291 26.756 1.00 0.00 ATOM 3217 O1 3PTLX 460 41.802 6.127 27.456 1.00 0.00 ATOM 3218 H1 3PTLX 460 42.416 6.901 27.299 1.00 0.00 ATOM 3219 C4 3PTLX 460 40.835 6.327 25.250 1.00 0.00 ATOM 3220 C5 3PTLX 460 41.507 7.614 24.769 1.00 0.00 ATOM 3221 C1 3PTLX 461 22.909 45.433 15.317 1.00 0.00 ATOM 3222 C2 3PTLX 461 21.599 44.649 15.215 1.00 0.00 ATOM 3223 C3 3PTLX 461 21.126 44.375 13.786 1.00 0.00 ATOM 3224 O1 3PTLX 461 22.136 43.657 13.072 1.00 0.00 ATOM 3225 H1 3PTLX 461 22.591 44.316 12.472 1.00 0.00 ATOM 3226 C4 3PTLX 461 19.756 43.702 13.683 1.00 0.00 ATOM 3227 C5 3PTLX 461 18.716 44.618 14.332 1.00 0.00 ATOM 3228 C1 3PTLX 462 10.087 3.484 5.286 1.00 0.00 ATOM 3229 C2 3PTLX 462 9.969 3.057 6.751 1.00 0.00 ATOM 3230 C3 3PTLX 462 11.230 3.605 7.422 1.00 0.00 ATOM 3231 O1 3PTLX 462 11.462 5.016 7.385 1.00 0.00 ATOM 3232 H1 3PTLX 462 11.940 5.119 6.513 1.00 0.00 ATOM 3233 C4 3PTLX 462 11.273 3.254 8.911 1.00 0.00 ATOM 3234 C5 3PTLX 462 10.479 4.093 9.913 1.00 0.00 ATOM 3235 C1 3PTLX 463 17.232 24.088 36.232 1.00 0.00 ATOM 3236 C2 3PTLX 463 17.389 22.633 35.786 1.00 0.00 ATOM 3237 C3 3PTLX 463 16.760 22.292 34.434 1.00 0.00 ATOM 3238 O1 3PTLX 463 17.726 21.743 33.534 1.00 0.00 ATOM 3239 H1 3PTLX 463 17.382 22.009 32.633 1.00 0.00 ATOM 3240 C4 3PTLX 463 15.674 21.259 34.739 1.00 0.00 ATOM 3241 C5 3PTLX 463 14.583 21.030 33.691 1.00 0.00 ATOM 3242 C1 3PTLX 464 14.143 11.444 32.964 1.00 0.00 ATOM 3243 C2 3PTLX 464 14.242 12.280 31.687 1.00 0.00 ATOM 3244 C3 3PTLX 464 13.135 13.314 31.472 1.00 0.00 ATOM 3245 O1 3PTLX 464 11.857 12.747 31.175 1.00 0.00 ATOM 3246 H1 3PTLX 464 11.844 12.605 30.185 1.00 0.00 ATOM 3247 C4 3PTLX 464 13.006 14.373 32.569 1.00 0.00 ATOM 3248 C5 3PTLX 464 14.005 15.515 32.372 1.00 0.00 ATOM 3249 C1 3PTLX 465 30.516 16.452 6.249 1.00 0.00 ATOM 3250 C2 3PTLX 465 30.590 17.534 7.327 1.00 0.00 ATOM 3251 C3 3PTLX 465 31.917 17.508 8.089 1.00 0.00 ATOM 3252 O1 3PTLX 465 32.200 16.269 8.744 1.00 0.00 ATOM 3253 H1 3PTLX 465 31.408 16.010 9.298 1.00 0.00 ATOM 3254 C4 3PTLX 465 33.146 18.043 7.351 1.00 0.00 ATOM 3255 C5 3PTLX 465 33.092 19.532 7.005 1.00 0.00 ATOM 3256 C1 3PTLX 466 7.126 6.162 4.447 1.00 0.00 ATOM 3257 C2 3PTLX 466 7.843 7.393 5.005 1.00 0.00 ATOM 3258 C3 3PTLX 466 6.822 8.525 5.138 1.00 0.00 ATOM 3259 O1 3PTLX 466 6.009 8.661 6.306 1.00 0.00 ATOM 3260 H1 3PTLX 466 5.354 7.906 6.269 1.00 0.00 ATOM 3261 C4 3PTLX 466 7.537 9.839 4.814 1.00 0.00 ATOM 3262 C5 3PTLX 466 7.354 10.167 3.331 1.00 0.00 ATOM 3263 C1 3PTLX 467 34.602 19.887 38.821 1.00 0.00 ATOM 3264 C2 3PTLX 467 34.696 18.714 39.798 1.00 0.00 ATOM 3265 C3 3PTLX 467 33.785 18.993 40.995 1.00 0.00 ATOM 3266 O1 3PTLX 467 32.388 18.901 40.702 1.00 0.00 ATOM 3267 H1 3PTLX 467 31.871 19.114 41.532 1.00 0.00 ATOM 3268 C4 3PTLX 467 34.213 17.948 42.027 1.00 0.00 ATOM 3269 C5 3PTLX 467 35.615 17.829 42.628 1.00 0.00 ATOM 3270 C1 3PTLX 468 15.701 0.283 0.241 1.00 0.00 ATOM 3271 C2 3PTLX 468 17.092 0.893 0.058 1.00 0.00 ATOM 3272 C3 3PTLX 468 17.634 1.570 1.319 1.00 0.00 ATOM 3273 O1 3PTLX 468 17.443 0.825 2.525 1.00 0.00 ATOM 3274 H1 3PTLX 468 17.098 1.334 3.314 1.00 0.00 ATOM 3275 C4 3PTLX 468 19.077 2.062 1.196 1.00 0.00 ATOM 3276 C5 3PTLX 468 19.352 2.835 -0.095 1.00 0.00 ATOM 3277 C1 3PTLX 469 26.669 3.820 13.964 1.00 0.00 ATOM 3278 C2 3PTLX 469 25.613 4.460 13.061 1.00 0.00 ATOM 3279 C3 3PTLX 469 25.978 5.744 12.314 1.00 0.00 ATOM 3280 O1 3PTLX 469 26.188 6.809 13.245 1.00 0.00 ATOM 3281 H1 3PTLX 469 25.399 7.021 13.820 1.00 0.00 ATOM 3282 C4 3PTLX 469 27.341 5.560 11.644 1.00 0.00 ATOM 3283 C5 3PTLX 469 27.809 6.740 10.791 1.00 0.00 ATOM 3284 C1 3PTLX 470 15.628 9.559 3.939 1.00 0.00 ATOM 3285 C2 3PTLX 470 16.473 9.384 5.203 1.00 0.00 ATOM 3286 C3 3PTLX 470 15.486 9.150 6.348 1.00 0.00 ATOM 3287 O1 3PTLX 470 14.665 8.027 6.019 1.00 0.00 ATOM 3288 H1 3PTLX 470 13.850 8.047 6.598 1.00 0.00 ATOM 3289 C4 3PTLX 470 16.461 8.759 7.460 1.00 0.00 ATOM 3290 C5 3PTLX 470 17.349 7.530 7.255 1.00 0.00 ATOM 3291 C1 3PTLX 471 43.816 4.459 19.099 1.00 0.00 ATOM 3292 C2 3PTLX 471 43.121 5.729 18.604 1.00 0.00 ATOM 3293 C3 3PTLX 471 44.033 6.542 17.683 1.00 0.00 ATOM 3294 O1 3PTLX 471 43.317 7.707 17.265 1.00 0.00 ATOM 3295 H1 3PTLX 471 43.768 7.908 16.396 1.00 0.00 ATOM 3296 C4 3PTLX 471 45.356 7.081 18.232 1.00 0.00 ATOM 3297 C5 3PTLX 471 45.365 7.852 19.554 1.00 0.00 ATOM 3298 C1 3PTLX 472 15.721 17.237 24.725 1.00 0.00 ATOM 3299 C2 3PTLX 472 16.531 16.244 25.560 1.00 0.00 ATOM 3300 C3 3PTLX 472 16.987 15.065 24.699 1.00 0.00 ATOM 3301 O1 3PTLX 472 18.392 14.853 24.861 1.00 0.00 ATOM 3302 H1 3PTLX 472 18.785 15.767 24.964 1.00 0.00 ATOM 3303 C4 3PTLX 472 16.088 13.972 25.280 1.00 0.00 ATOM 3304 C5 3PTLX 472 16.158 12.697 24.437 1.00 0.00 ATOM 3305 C1 3PTLX 473 19.695 16.331 11.186 1.00 0.00 ATOM 3306 C2 3PTLX 473 19.569 14.824 10.956 1.00 0.00 ATOM 3307 C3 3PTLX 473 20.946 14.164 11.055 1.00 0.00 ATOM 3308 O1 3PTLX 473 20.765 12.746 11.078 1.00 0.00 ATOM 3309 H1 3PTLX 473 20.646 12.457 10.128 1.00 0.00 ATOM 3310 C4 3PTLX 473 21.853 14.545 9.882 1.00 0.00 ATOM 3311 C5 3PTLX 473 23.289 14.183 10.263 1.00 0.00 ATOM 3312 C1 3PTLX 474 34.842 27.058 30.914 1.00 0.00 ATOM 3313 C2 3PTLX 474 33.566 27.429 31.674 1.00 0.00 ATOM 3314 C3 3PTLX 474 34.018 28.069 32.988 1.00 0.00 ATOM 3315 O1 3PTLX 474 32.768 28.066 33.683 1.00 0.00 ATOM 3316 H1 3PTLX 474 32.817 28.746 34.415 1.00 0.00 ATOM 3317 C4 3PTLX 474 35.029 27.267 33.812 1.00 0.00 ATOM 3318 C5 3PTLX 474 35.314 27.884 35.183 1.00 0.00 ATOM 3319 C1 3PTLX 475 27.714 14.187 26.828 1.00 0.00 ATOM 3320 C2 3PTLX 475 28.491 15.117 27.761 1.00 0.00 ATOM 3321 C3 3PTLX 475 28.226 16.601 27.499 1.00 0.00 ATOM 3322 O1 3PTLX 475 28.738 17.170 28.708 1.00 0.00 ATOM 3323 H1 3PTLX 475 28.580 18.157 28.689 1.00 0.00 ATOM 3324 C4 3PTLX 475 28.841 17.382 26.336 1.00 0.00 ATOM 3325 C5 3PTLX 475 30.336 17.162 26.094 1.00 0.00 ATOM 3326 C1 3PTLX 476 19.319 38.987 5.216 1.00 0.00 ATOM 3327 C2 3PTLX 476 18.471 38.115 4.288 1.00 0.00 ATOM 3328 C3 3PTLX 476 19.222 36.839 3.906 1.00 0.00 ATOM 3329 O1 3PTLX 476 18.283 35.823 3.542 1.00 0.00 ATOM 3330 H1 3PTLX 476 18.144 36.064 2.582 1.00 0.00 ATOM 3331 C4 3PTLX 476 20.160 37.119 2.730 1.00 0.00 ATOM 3332 C5 3PTLX 476 20.958 35.929 2.194 1.00 0.00 ATOM 3333 C1 3PTLX 477 28.785 19.629 37.877 1.00 0.00 ATOM 3334 C2 3PTLX 477 29.763 19.032 36.862 1.00 0.00 ATOM 3335 C3 3PTLX 477 31.121 18.823 37.534 1.00 0.00 ATOM 3336 O1 3PTLX 477 31.141 17.959 38.674 1.00 0.00 ATOM 3337 H1 3PTLX 477 31.577 18.366 39.476 1.00 0.00 ATOM 3338 C4 3PTLX 477 32.223 18.341 36.588 1.00 0.00 ATOM 3339 C5 3PTLX 477 32.381 19.322 35.426 1.00 0.00 ATOM 3340 C1 3PTLX 478 37.700 20.323 25.657 1.00 0.00 ATOM 3341 C2 3PTLX 478 36.577 19.572 24.940 1.00 0.00 ATOM 3342 C3 3PTLX 478 35.297 19.597 25.777 1.00 0.00 ATOM 3343 O1 3PTLX 478 34.723 20.907 25.780 1.00 0.00 ATOM 3344 H1 3PTLX 478 35.019 21.424 24.977 1.00 0.00 ATOM 3345 C4 3PTLX 478 34.245 18.610 25.267 1.00 0.00 ATOM 3346 C5 3PTLX 478 34.799 17.190 25.398 1.00 0.00 ATOM 3347 C1 3PTLX 479 26.474 29.825 35.803 1.00 0.00 ATOM 3348 C2 3PTLX 479 26.809 30.087 34.333 1.00 0.00 ATOM 3349 C3 3PTLX 479 26.165 29.139 33.319 1.00 0.00 ATOM 3350 O1 3PTLX 479 24.751 28.965 33.441 1.00 0.00 ATOM 3351 H1 3PTLX 479 24.579 27.982 33.498 1.00 0.00 ATOM 3352 C4 3PTLX 479 26.605 29.605 31.930 1.00 0.00 ATOM 3353 C5 3PTLX 479 28.075 29.279 31.654 1.00 0.00 ATOM 3354 C1 3PTLX 480 5.504 13.370 2.563 1.00 0.00 ATOM 3355 C2 3PTLX 480 5.645 14.858 2.890 1.00 0.00 ATOM 3356 C3 3PTLX 480 5.031 15.683 1.757 1.00 0.00 ATOM 3357 O1 3PTLX 480 3.624 15.506 1.576 1.00 0.00 ATOM 3358 H1 3PTLX 480 3.216 15.555 2.488 1.00 0.00 ATOM 3359 C4 3PTLX 480 5.460 17.133 1.988 1.00 0.00 ATOM 3360 C5 3PTLX 480 4.784 18.126 1.041 1.00 0.00 ATOM 3361 C1 3PTLX 481 6.717 42.521 15.569 1.00 0.00 ATOM 3362 C2 3PTLX 481 7.755 41.425 15.816 1.00 0.00 ATOM 3363 C3 3PTLX 481 7.225 40.016 16.092 1.00 0.00 ATOM 3364 O1 3PTLX 481 6.917 39.464 14.809 1.00 0.00 ATOM 3365 H1 3PTLX 481 6.097 38.934 15.023 1.00 0.00 ATOM 3366 C4 3PTLX 481 8.288 39.116 16.724 1.00 0.00 ATOM 3367 C5 3PTLX 481 8.861 39.508 18.087 1.00 0.00 ATOM 3368 C1 3PTLX 482 28.736 32.131 12.141 1.00 0.00 ATOM 3369 C2 3PTLX 482 27.790 31.561 13.199 1.00 0.00 ATOM 3370 C3 3PTLX 482 26.467 31.067 12.612 1.00 0.00 ATOM 3371 O1 3PTLX 482 26.443 29.638 12.652 1.00 0.00 ATOM 3372 H1 3PTLX 482 26.144 29.237 13.518 1.00 0.00 ATOM 3373 C4 3PTLX 482 25.190 31.491 13.340 1.00 0.00 ATOM 3374 C5 3PTLX 482 25.023 33.011 13.301 1.00 0.00 ATOM 3375 C1 3PTLX 483 38.847 13.618 4.937 1.00 0.00 ATOM 3376 C2 3PTLX 483 38.147 14.974 4.826 1.00 0.00 ATOM 3377 C3 3PTLX 483 38.839 15.940 3.862 1.00 0.00 ATOM 3378 O1 3PTLX 483 38.931 15.300 2.587 1.00 0.00 ATOM 3379 H1 3PTLX 483 38.031 15.296 2.150 1.00 0.00 ATOM 3380 C4 3PTLX 483 37.936 17.175 3.876 1.00 0.00 ATOM 3381 C5 3PTLX 483 37.756 17.859 5.233 1.00 0.00 ATOM 3382 C1 3PTLX 484 21.299 39.749 23.652 1.00 0.00 ATOM 3383 C2 3PTLX 484 19.904 39.812 24.277 1.00 0.00 ATOM 3384 C3 3PTLX 484 19.672 38.505 25.038 1.00 0.00 ATOM 3385 O1 3PTLX 484 20.598 38.275 26.103 1.00 0.00 ATOM 3386 H1 3PTLX 484 21.298 37.610 25.844 1.00 0.00 ATOM 3387 C4 3PTLX 484 18.208 38.485 25.481 1.00 0.00 ATOM 3388 C5 3PTLX 484 17.512 37.365 24.706 1.00 0.00 ATOM 3389 C1 3PTLX 485 29.893 5.036 42.957 1.00 0.00 ATOM 3390 C2 3PTLX 485 29.834 5.760 44.304 1.00 0.00 ATOM 3391 C3 3PTLX 485 30.474 7.142 44.448 1.00 0.00 ATOM 3392 O1 3PTLX 485 30.787 7.304 45.834 1.00 0.00 ATOM 3393 H1 3PTLX 485 30.276 8.082 46.201 1.00 0.00 ATOM 3394 C4 3PTLX 485 31.832 7.167 43.745 1.00 0.00 ATOM 3395 C5 3PTLX 485 32.391 8.574 43.524 1.00 0.00 ATOM 3396 C1 3PTLX 486 25.867 24.743 30.798 1.00 0.00 ATOM 3397 C2 3PTLX 486 24.605 25.228 31.514 1.00 0.00 ATOM 3398 C3 3PTLX 486 24.689 25.176 33.041 1.00 0.00 ATOM 3399 O1 3PTLX 486 23.974 26.322 33.512 1.00 0.00 ATOM 3400 H1 3PTLX 486 22.979 26.288 33.604 1.00 0.00 ATOM 3401 C4 3PTLX 486 23.983 24.010 33.736 1.00 0.00 ATOM 3402 C5 3PTLX 486 24.658 23.670 35.066 1.00 0.00 ATOM 3403 C1 3PTLX 487 19.615 37.299 40.521 1.00 0.00 ATOM 3404 C2 3PTLX 487 19.360 36.402 39.308 1.00 0.00 ATOM 3405 C3 3PTLX 487 19.157 34.887 39.381 1.00 0.00 ATOM 3406 O1 3PTLX 487 17.795 34.569 39.674 1.00 0.00 ATOM 3407 H1 3PTLX 487 17.078 34.760 39.003 1.00 0.00 ATOM 3408 C4 3PTLX 487 19.373 34.182 38.040 1.00 0.00 ATOM 3409 C5 3PTLX 487 20.897 34.052 38.024 1.00 0.00 ATOM 3410 C1 3PTLX 488 32.412 25.591 13.483 1.00 0.00 ATOM 3411 C2 3PTLX 488 31.942 27.039 13.642 1.00 0.00 ATOM 3412 C3 3PTLX 488 30.839 27.283 12.610 1.00 0.00 ATOM 3413 O1 3PTLX 488 29.522 26.851 12.959 1.00 0.00 ATOM 3414 H1 3PTLX 488 28.807 27.238 12.378 1.00 0.00 ATOM 3415 C4 3PTLX 488 30.822 28.741 12.144 1.00 0.00 ATOM 3416 C5 3PTLX 488 31.808 29.015 11.006 1.00 0.00 ATOM 3417 C1 3PTLX 489 24.670 26.752 10.560 1.00 0.00 ATOM 3418 C2 3PTLX 489 26.008 26.126 10.161 1.00 0.00 ATOM 3419 C3 3PTLX 489 27.065 27.197 9.887 1.00 0.00 ATOM 3420 O1 3PTLX 489 27.541 27.562 11.185 1.00 0.00 ATOM 3421 H1 3PTLX 489 26.804 28.131 11.550 1.00 0.00 ATOM 3422 C4 3PTLX 489 28.195 26.526 9.103 1.00 0.00 ATOM 3423 C5 3PTLX 489 29.214 27.519 8.542 1.00 0.00 ATOM 3424 C1 3PTLX 490 2.312 24.152 11.447 1.00 0.00 ATOM 3425 C2 3PTLX 490 3.082 23.016 10.770 1.00 0.00 ATOM 3426 C3 3PTLX 490 4.522 22.825 11.249 1.00 0.00 ATOM 3427 O1 3PTLX 490 5.305 23.997 11.009 1.00 0.00 ATOM 3428 H1 3PTLX 490 6.165 23.664 10.622 1.00 0.00 ATOM 3429 C4 3PTLX 490 4.436 22.459 12.732 1.00 0.00 ATOM 3430 C5 3PTLX 490 5.603 21.622 13.260 1.00 0.00 ATOM 3431 C1 3PTLX 491 22.670 41.103 19.874 1.00 0.00 ATOM 3432 C2 3PTLX 491 23.347 42.467 20.025 1.00 0.00 ATOM 3433 C3 3PTLX 491 22.390 43.579 20.463 1.00 0.00 ATOM 3434 O1 3PTLX 491 23.231 44.678 20.824 1.00 0.00 ATOM 3435 H1 3PTLX 491 23.385 45.199 19.984 1.00 0.00 ATOM 3436 C4 3PTLX 491 21.363 43.883 19.370 1.00 0.00 ATOM 3437 C5 3PTLX 491 19.986 44.344 19.851 1.00 0.00 ATOM 3438 C1 3PTLX 492 1.374 39.209 0.009 1.00 0.00 ATOM 3439 C2 3PTLX 492 2.577 38.282 -0.179 1.00 0.00 ATOM 3440 C3 3PTLX 492 2.693 37.720 44.032 1.00 0.00 ATOM 3441 O1 3PTLX 492 3.124 38.784 43.179 1.00 0.00 ATOM 3442 H1 3PTLX 492 3.075 38.465 42.232 1.00 0.00 ATOM 3443 C4 3PTLX 492 3.681 36.557 43.924 1.00 0.00 ATOM 3444 C5 3PTLX 492 3.345 35.360 44.816 1.00 0.00 ATOM 3445 C1 3PTLX 493 28.038 37.804 39.012 1.00 0.00 ATOM 3446 C2 3PTLX 493 26.878 38.177 38.086 1.00 0.00 ATOM 3447 C3 3PTLX 493 25.674 38.852 38.746 1.00 0.00 ATOM 3448 O1 3PTLX 493 24.689 39.153 37.754 1.00 0.00 ATOM 3449 H1 3PTLX 493 25.099 39.015 36.852 1.00 0.00 ATOM 3450 C4 3PTLX 493 25.102 38.026 39.900 1.00 0.00 ATOM 3451 C5 3PTLX 493 24.435 36.678 39.616 1.00 0.00 ATOM 3452 C1 3PTLX 494 24.794 17.396 29.892 1.00 0.00 ATOM 3453 C2 3PTLX 494 24.062 18.470 29.084 1.00 0.00 ATOM 3454 C3 3PTLX 494 23.869 19.657 30.029 1.00 0.00 ATOM 3455 O1 3PTLX 494 25.083 20.394 30.195 1.00 0.00 ATOM 3456 H1 3PTLX 494 25.618 20.025 30.954 1.00 0.00 ATOM 3457 C4 3PTLX 494 22.701 20.452 29.442 1.00 0.00 ATOM 3458 C5 3PTLX 494 22.432 21.726 30.246 1.00 0.00 ATOM 3459 C1 3PTLX 495 20.321 9.715 41.826 1.00 0.00 ATOM 3460 C2 3PTLX 495 20.258 8.439 40.985 1.00 0.00 ATOM 3461 C3 3PTLX 495 19.496 7.214 41.493 1.00 0.00 ATOM 3462 O1 3PTLX 495 19.717 6.869 42.863 1.00 0.00 ATOM 3463 H1 3PTLX 495 20.298 7.581 43.258 1.00 0.00 ATOM 3464 C4 3PTLX 495 18.003 7.493 41.306 1.00 0.00 ATOM 3465 C5 3PTLX 495 17.234 6.221 41.668 1.00 0.00 ATOM 3466 C1 3PTLX 496 37.499 29.462 0.333 1.00 0.00 ATOM 3467 C2 3PTLX 496 36.100 28.965 -0.036 1.00 0.00 ATOM 3468 C3 3PTLX 496 34.971 29.983 0.138 1.00 0.00 ATOM 3469 O1 3PTLX 496 34.806 30.505 1.459 1.00 0.00 ATOM 3470 H1 3PTLX 496 34.258 31.340 1.501 1.00 0.00 ATOM 3471 C4 3PTLX 496 35.145 31.202 44.859 1.00 0.00 ATOM 3472 C5 3PTLX 496 34.895 30.719 43.429 1.00 0.00 ATOM 3473 C1 3PTLX 497 27.204 7.105 1.761 1.00 0.00 ATOM 3474 C2 3PTLX 497 26.954 8.355 0.915 1.00 0.00 ATOM 3475 C3 3PTLX 497 26.275 9.316 1.893 1.00 0.00 ATOM 3476 O1 3PTLX 497 27.274 9.868 2.754 1.00 0.00 ATOM 3477 H1 3PTLX 497 27.245 9.407 3.641 1.00 0.00 ATOM 3478 C4 3PTLX 497 25.667 10.462 1.082 1.00 0.00 ATOM 3479 C5 3PTLX 497 25.075 11.541 1.991 1.00 0.00 ATOM 3480 C1 3PTLX 498 15.397 4.328 6.363 1.00 0.00 ATOM 3481 C2 3PTLX 498 15.849 2.978 6.922 1.00 0.00 ATOM 3482 C3 3PTLX 498 16.006 1.876 5.872 1.00 0.00 ATOM 3483 O1 3PTLX 498 16.940 2.202 4.840 1.00 0.00 ATOM 3484 H1 3PTLX 498 17.863 2.347 5.198 1.00 0.00 ATOM 3485 C4 3PTLX 498 16.398 0.570 6.567 1.00 0.00 ATOM 3486 C5 3PTLX 498 16.554 -0.595 5.588 1.00 0.00 ATOM 3487 C1 3PTLX 499 42.968 40.084 16.068 1.00 0.00 ATOM 3488 C2 3PTLX 499 42.567 41.048 17.186 1.00 0.00 ATOM 3489 C3 3PTLX 499 41.634 42.175 16.737 1.00 0.00 ATOM 3490 O1 3PTLX 499 42.083 43.173 15.817 1.00 0.00 ATOM 3491 H1 3PTLX 499 42.616 42.920 15.009 1.00 0.00 ATOM 3492 C4 3PTLX 499 40.308 41.530 16.327 1.00 0.00 ATOM 3493 C5 3PTLX 499 39.079 42.390 16.025 1.00 0.00 ATOM 3494 C1 3PTLX 500 30.924 19.108 12.287 1.00 0.00 ATOM 3495 C2 3PTLX 500 30.985 19.989 11.037 1.00 0.00 ATOM 3496 C3 3PTLX 500 30.692 21.461 11.334 1.00 0.00 ATOM 3497 O1 3PTLX 500 31.745 22.020 12.124 1.00 0.00 ATOM 3498 H1 3PTLX 500 31.969 21.441 12.908 1.00 0.00 ATOM 3499 C4 3PTLX 500 30.528 22.181 9.993 1.00 0.00 ATOM 3500 C5 3PTLX 500 29.530 23.291 10.326 1.00 0.00 ATOM 3501 C1 3PTLX 501 16.688 7.871 16.688 1.00 0.00 ATOM 3502 C2 3PTLX 501 15.628 7.439 15.672 1.00 0.00 ATOM 3503 C3 3PTLX 501 16.167 6.716 14.436 1.00 0.00 ATOM 3504 O1 3PTLX 501 16.378 5.315 14.627 1.00 0.00 ATOM 3505 H1 3PTLX 501 15.593 4.832 15.017 1.00 0.00 ATOM 3506 C4 3PTLX 501 15.295 6.887 13.190 1.00 0.00 ATOM 3507 C5 3PTLX 501 13.921 6.240 13.377 1.00 0.00 ATOM 3508 C1 3PTLX 502 14.158 20.138 43.210 1.00 0.00 ATOM 3509 C2 3PTLX 502 14.325 18.674 43.624 1.00 0.00 ATOM 3510 C3 3PTLX 502 13.430 17.715 42.836 1.00 0.00 ATOM 3511 O1 3PTLX 502 12.181 18.364 42.585 1.00 0.00 ATOM 3512 H1 3PTLX 502 11.565 17.607 42.365 1.00 0.00 ATOM 3513 C4 3PTLX 502 14.204 17.410 41.552 1.00 0.00 ATOM 3514 C5 3PTLX 502 13.609 16.248 40.755 1.00 0.00 ATOM 3515 C1 3PTLX 503 10.732 40.009 22.403 1.00 0.00 ATOM 3516 C2 3PTLX 503 12.222 39.836 22.707 1.00 0.00 ATOM 3517 C3 3PTLX 503 13.156 39.759 21.498 1.00 0.00 ATOM 3518 O1 3PTLX 503 13.436 41.125 21.180 1.00 0.00 ATOM 3519 H1 3PTLX 503 13.112 41.401 20.275 1.00 0.00 ATOM 3520 C4 3PTLX 503 14.428 38.930 21.680 1.00 0.00 ATOM 3521 C5 3PTLX 503 14.047 37.482 21.995 1.00 0.00 ATOM 3522 C1 3PTLX 504 3.656 8.879 1.117 1.00 0.00 ATOM 3523 C2 3PTLX 504 3.413 10.378 0.929 1.00 0.00 ATOM 3524 C3 3PTLX 504 1.912 10.645 1.057 1.00 0.00 ATOM 3525 O1 3PTLX 504 1.723 12.052 1.228 1.00 0.00 ATOM 3526 H1 3PTLX 504 2.325 12.544 0.600 1.00 0.00 ATOM 3527 C4 3PTLX 504 1.192 10.092 45.455 1.00 0.00 ATOM 3528 C5 3PTLX 504 -0.338 10.089 45.484 1.00 0.00 ATOM 3529 C1 3PTLX 505 16.097 23.799 41.103 1.00 0.00 ATOM 3530 C2 3PTLX 505 14.663 23.267 41.138 1.00 0.00 ATOM 3531 C3 3PTLX 505 13.691 23.793 40.080 1.00 0.00 ATOM 3532 O1 3PTLX 505 13.391 25.190 40.126 1.00 0.00 ATOM 3533 H1 3PTLX 505 13.369 25.479 41.082 1.00 0.00 ATOM 3534 C4 3PTLX 505 14.200 23.537 38.661 1.00 0.00 ATOM 3535 C5 3PTLX 505 13.793 22.114 38.271 1.00 0.00 ATOM 3536 C1 3PTLX 506 44.785 25.173 9.017 1.00 0.00 ATOM 3537 C2 3PTLX 506 45.660 24.767 7.829 1.00 0.00 ATOM 3538 C3 3PTLX 506 45.276 23.350 7.397 1.00 0.00 ATOM 3539 O1 3PTLX 506 44.187 23.386 6.472 1.00 0.00 ATOM 3540 H1 3PTLX 506 43.385 23.648 7.009 1.00 0.00 ATOM 3541 C4 3PTLX 506 0.967 22.814 6.841 1.00 0.00 ATOM 3542 C5 3PTLX 506 1.021 21.448 6.154 1.00 0.00 ATOM 3543 C1 3PTLX 507 42.837 40.531 22.457 1.00 0.00 ATOM 3544 C2 3PTLX 507 41.630 40.207 21.574 1.00 0.00 ATOM 3545 C3 3PTLX 507 40.291 40.843 21.954 1.00 0.00 ATOM 3546 O1 3PTLX 507 40.442 42.237 21.669 1.00 0.00 ATOM 3547 H1 3PTLX 507 39.506 42.561 21.530 1.00 0.00 ATOM 3548 C4 3PTLX 507 39.212 40.200 21.081 1.00 0.00 ATOM 3549 C5 3PTLX 507 37.807 40.422 21.645 1.00 0.00 ATOM 3550 C1 3PTLX 508 6.412 40.606 5.525 1.00 0.00 ATOM 3551 C2 3PTLX 508 6.685 41.925 6.250 1.00 0.00 ATOM 3552 C3 3PTLX 508 8.126 42.427 6.142 1.00 0.00 ATOM 3553 O1 3PTLX 508 8.055 43.800 6.534 1.00 0.00 ATOM 3554 H1 3PTLX 508 9.004 44.098 6.629 1.00 0.00 ATOM 3555 C4 3PTLX 508 9.009 41.624 7.098 1.00 0.00 ATOM 3556 C5 3PTLX 508 8.789 41.818 8.600 1.00 0.00 ATOM 3557 C1 3PTLX 509 13.410 35.496 36.491 1.00 0.00 ATOM 3558 C2 3PTLX 509 13.861 34.035 36.545 1.00 0.00 ATOM 3559 C3 3PTLX 509 15.374 33.827 36.636 1.00 0.00 ATOM 3560 O1 3PTLX 509 15.830 34.251 37.923 1.00 0.00 ATOM 3561 H1 3PTLX 509 15.427 33.703 38.656 1.00 0.00 ATOM 3562 C4 3PTLX 509 15.715 32.351 36.419 1.00 0.00 ATOM 3563 C5 3PTLX 509 16.995 32.160 35.603 1.00 0.00 ATOM 3564 C1 3PTLX 510 32.190 16.769 21.389 1.00 0.00 ATOM 3565 C2 3PTLX 510 31.598 15.594 20.608 1.00 0.00 ATOM 3566 C3 3PTLX 510 30.144 15.468 21.066 1.00 0.00 ATOM 3567 O1 3PTLX 510 29.516 14.609 20.110 1.00 0.00 ATOM 3568 H1 3PTLX 510 28.642 14.274 20.462 1.00 0.00 ATOM 3569 C4 3PTLX 510 29.898 14.886 22.459 1.00 0.00 ATOM 3570 C5 3PTLX 510 28.433 15.068 22.861 1.00 0.00 ATOM 3571 C1 3PTLX 511 21.262 33.305 33.595 1.00 0.00 ATOM 3572 C2 3PTLX 511 22.514 32.627 34.155 1.00 0.00 ATOM 3573 C3 3PTLX 511 22.257 31.365 34.981 1.00 0.00 ATOM 3574 O1 3PTLX 511 22.219 30.211 34.137 1.00 0.00 ATOM 3575 H1 3PTLX 511 23.142 29.985 33.826 1.00 0.00 ATOM 3576 C4 3PTLX 511 23.263 31.239 36.128 1.00 0.00 ATOM 3577 C5 3PTLX 511 23.073 29.890 36.823 1.00 0.00 ATOM 3578 C1 3PTLX 512 21.057 15.947 26.733 1.00 0.00 ATOM 3579 C2 3PTLX 512 20.752 17.439 26.585 1.00 0.00 ATOM 3580 C3 3PTLX 512 20.673 17.857 25.115 1.00 0.00 ATOM 3581 O1 3PTLX 512 19.628 17.117 24.478 1.00 0.00 ATOM 3582 H1 3PTLX 512 19.575 17.364 23.510 1.00 0.00 ATOM 3583 C4 3PTLX 512 20.123 19.283 25.167 1.00 0.00 ATOM 3584 C5 3PTLX 512 21.021 20.305 25.866 1.00 0.00 END