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October 2, 2018 18:25
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| ATOM 1 N SER A 1 0.346 1.210 0.744 1.00 0.00 N | |
| ATOM 2 CA SER A 1 1.687 1.135 0.174 1.00 0.00 C | |
| ATOM 3 C SER A 1 2.383 2.488 0.222 1.00 0.00 C | |
| ATOM 4 O SER A 1 2.209 3.320 -0.670 1.00 0.00 O | |
| ATOM 5 CB SER A 1 1.619 0.643 -1.259 1.00 0.00 C | |
| ATOM 6 OG SER A 1 2.901 0.537 -1.814 1.00 0.00 O | |
| ATOM 7 1H SER A 1 -0.087 0.309 0.699 1.00 0.00 H | |
| ATOM 8 2H SER A 1 0.405 1.504 1.698 1.00 0.00 H | |
| ATOM 9 3H SER A 1 -0.201 1.868 0.226 1.00 0.00 H | |
| ATOM 10 HA SER A 1 2.275 0.433 0.765 1.00 0.00 H | |
| ATOM 11 1HB SER A 1 1.126 -0.328 -1.287 1.00 0.00 H | |
| ATOM 12 2HB SER A 1 1.019 1.332 -1.851 1.00 0.00 H | |
| ATOM 13 HG SER A 1 2.884 -0.245 -2.371 1.00 0.00 H | |
| ATOM 14 N GLN A 2 3.173 2.705 1.270 1.00 0.00 N | |
| ATOM 15 CA GLN A 2 3.871 3.971 1.452 1.00 0.00 C | |
| ATOM 16 C GLN A 2 4.934 4.175 0.379 1.00 0.00 C | |
| ATOM 17 O GLN A 2 5.212 5.302 -0.026 1.00 0.00 O | |
| ATOM 18 CB GLN A 2 4.510 4.035 2.841 1.00 0.00 C | |
| ATOM 19 CG GLN A 2 5.138 5.377 3.176 1.00 0.00 C | |
| ATOM 20 CD GLN A 2 4.122 6.503 3.196 1.00 0.00 C | |
| ATOM 21 OE1 GLN A 2 3.009 6.345 3.706 1.00 0.00 O | |
| ATOM 22 NE2 GLN A 2 4.499 7.648 2.640 1.00 0.00 N | |
| ATOM 23 H GLN A 2 3.293 1.974 1.954 1.00 0.00 H | |
| ATOM 24 HA GLN A 2 3.145 4.782 1.381 1.00 0.00 H | |
| ATOM 25 1HB GLN A 2 3.757 3.817 3.599 1.00 0.00 H | |
| ATOM 26 2HB GLN A 2 5.285 3.272 2.921 1.00 0.00 H | |
| ATOM 27 1HG GLN A 2 5.599 5.315 4.162 1.00 0.00 H | |
| ATOM 28 2HG GLN A 2 5.893 5.611 2.426 1.00 0.00 H | |
| ATOM 29 1HE2 GLN A 2 3.871 8.427 2.623 1.00 0.00 H | |
| ATOM 30 2HE2 GLN A 2 5.411 7.734 2.238 1.00 0.00 H | |
| ATOM 31 N GLU A 3 5.523 3.074 -0.077 1.00 0.00 N | |
| ATOM 32 CA GLU A 3 6.557 3.131 -1.106 1.00 0.00 C | |
| ATOM 33 C GLU A 3 5.980 3.590 -2.438 1.00 0.00 C | |
| ATOM 34 O GLU A 3 6.635 4.310 -3.192 1.00 0.00 O | |
| ATOM 35 CB GLU A 3 7.222 1.763 -1.273 1.00 0.00 C | |
| ATOM 36 CG GLU A 3 8.061 1.323 -0.081 1.00 0.00 C | |
| ATOM 37 CD GLU A 3 9.186 2.271 0.225 1.00 0.00 C | |
| ATOM 38 OE1 GLU A 3 9.930 2.589 -0.672 1.00 0.00 O | |
| ATOM 39 OE2 GLU A 3 9.303 2.678 1.357 1.00 0.00 O | |
| ATOM 40 H GLU A 3 5.252 2.178 0.298 1.00 0.00 H | |
| ATOM 41 HA GLU A 3 7.321 3.839 -0.790 1.00 0.00 H | |
| ATOM 42 1HB GLU A 3 6.458 1.005 -1.442 1.00 0.00 H | |
| ATOM 43 2HB GLU A 3 7.869 1.777 -2.150 1.00 0.00 H | |
| ATOM 44 1HG GLU A 3 7.417 1.247 0.795 1.00 0.00 H | |
| ATOM 45 2HG GLU A 3 8.470 0.334 -0.284 1.00 0.00 H | |
| ATOM 46 N THR A 4 4.753 3.173 -2.724 1.00 0.00 N | |
| ATOM 47 CA THR A 4 4.025 3.666 -3.888 1.00 0.00 C | |
| ATOM 48 C THR A 4 3.731 5.156 -3.760 1.00 0.00 C | |
| ATOM 49 O THR A 4 3.847 5.907 -4.730 1.00 0.00 O | |
| ATOM 50 CB THR A 4 2.708 2.893 -4.088 1.00 0.00 C | |
| ATOM 51 OG1 THR A 4 2.994 1.506 -4.310 1.00 0.00 O | |
| ATOM 52 CG2 THR A 4 1.941 3.446 -5.279 1.00 0.00 C | |
| ATOM 53 H THR A 4 4.311 2.494 -2.120 1.00 0.00 H | |
| ATOM 54 HA THR A 4 4.642 3.512 -4.772 1.00 0.00 H | |
| ATOM 55 HB THR A 4 2.093 2.985 -3.193 1.00 0.00 H | |
| ATOM 56 HG1 THR A 4 3.061 1.055 -3.465 1.00 0.00 H | |
| ATOM 57 1HG2 THR A 4 1.014 2.888 -5.405 1.00 0.00 H | |
| ATOM 58 2HG2 THR A 4 1.712 4.498 -5.109 1.00 0.00 H | |
| ATOM 59 3HG2 THR A 4 2.547 3.349 -6.179 1.00 0.00 H | |
| ATOM 60 N ARG A 5 3.356 5.579 -2.557 1.00 0.00 N | |
| ATOM 61 CA ARG A 5 3.141 6.995 -2.277 1.00 0.00 C | |
| ATOM 62 C ARG A 5 4.405 7.804 -2.531 1.00 0.00 C | |
| ATOM 63 O ARG A 5 4.348 8.913 -3.060 1.00 0.00 O | |
| ATOM 64 CB ARG A 5 2.697 7.195 -0.836 1.00 0.00 C | |
| ATOM 65 CG ARG A 5 1.298 6.687 -0.521 1.00 0.00 C | |
| ATOM 66 CD ARG A 5 0.975 6.826 0.922 1.00 0.00 C | |
| ATOM 67 NE ARG A 5 -0.343 6.297 1.236 1.00 0.00 N | |
| ATOM 68 CZ ARG A 5 -0.813 6.107 2.484 1.00 0.00 C | |
| ATOM 69 NH1 ARG A 5 -0.064 6.406 3.522 1.00 0.00 N | |
| ATOM 70 NH2 ARG A 5 -2.028 5.620 2.665 1.00 0.00 N | |
| ATOM 71 H ARG A 5 3.212 4.906 -1.821 1.00 0.00 H | |
| ATOM 72 HA ARG A 5 2.353 7.364 -2.934 1.00 0.00 H | |
| ATOM 73 1HB ARG A 5 3.390 6.685 -0.168 1.00 0.00 H | |
| ATOM 74 2HB ARG A 5 2.725 8.256 -0.590 1.00 0.00 H | |
| ATOM 75 1HG ARG A 5 0.567 7.258 -1.093 1.00 0.00 H | |
| ATOM 76 2HG ARG A 5 1.225 5.632 -0.789 1.00 0.00 H | |
| ATOM 77 1HD ARG A 5 1.711 6.281 1.513 1.00 0.00 H | |
| ATOM 78 2HD ARG A 5 0.995 7.879 1.199 1.00 0.00 H | |
| ATOM 79 HE ARG A 5 -0.948 6.056 0.463 1.00 0.00 H | |
| ATOM 80 1HH1 ARG A 5 0.865 6.778 3.383 1.00 0.00 H | |
| ATOM 81 2HH1 ARG A 5 -0.416 6.263 4.457 1.00 0.00 H | |
| ATOM 82 1HH2 ARG A 5 -2.605 5.390 1.867 1.00 0.00 H | |
| ATOM 83 2HH2 ARG A 5 -2.381 5.477 3.599 1.00 0.00 H | |
| ATOM 84 N LYS A 6 5.548 7.244 -2.150 1.00 0.00 N | |
| ATOM 85 CA LYS A 6 6.836 7.870 -2.418 1.00 0.00 C | |
| ATOM 86 C LYS A 6 7.076 8.020 -3.916 1.00 0.00 C | |
| ATOM 87 O LYS A 6 7.538 9.060 -4.381 1.00 0.00 O | |
| ATOM 88 CB LYS A 6 7.967 7.061 -1.782 1.00 0.00 C | |
| ATOM 89 CG LYS A 6 7.996 7.108 -0.260 1.00 0.00 C | |
| ATOM 90 CD LYS A 6 9.085 6.206 0.300 1.00 0.00 C | |
| ATOM 91 CE LYS A 6 9.047 6.169 1.821 1.00 0.00 C | |
| ATOM 92 NZ LYS A 6 10.051 5.224 2.380 1.00 0.00 N | |
| ATOM 93 H LYS A 6 5.524 6.360 -1.660 1.00 0.00 H | |
| ATOM 94 HA LYS A 6 6.842 8.861 -1.964 1.00 0.00 H | |
| ATOM 95 1HB LYS A 6 7.881 6.016 -2.083 1.00 0.00 H | |
| ATOM 96 2HB LYS A 6 8.927 7.428 -2.146 1.00 0.00 H | |
| ATOM 97 1HG LYS A 6 8.179 8.132 0.069 1.00 0.00 H | |
| ATOM 98 2HG LYS A 6 7.032 6.786 0.132 1.00 0.00 H | |
| ATOM 99 1HD LYS A 6 8.953 5.193 -0.083 1.00 0.00 H | |
| ATOM 100 2HD LYS A 6 10.061 6.571 -0.020 1.00 0.00 H | |
| ATOM 101 1HE LYS A 6 9.244 7.165 2.214 1.00 0.00 H | |
| ATOM 102 2HE LYS A 6 8.055 5.862 2.152 1.00 0.00 H | |
| ATOM 103 1HZ LYS A 6 9.993 5.229 3.389 1.00 0.00 H | |
| ATOM 104 2HZ LYS A 6 9.866 4.292 2.037 1.00 0.00 H | |
| ATOM 105 3HZ LYS A 6 10.977 5.510 2.096 1.00 0.00 H | |
| ATOM 106 N LYS A 7 6.760 6.968 -4.667 1.00 0.00 N | |
| ATOM 107 CA LYS A 7 6.980 6.964 -6.107 1.00 0.00 C | |
| ATOM 108 C LYS A 7 6.142 8.031 -6.798 1.00 0.00 C | |
| ATOM 109 O LYS A 7 6.639 8.775 -7.645 1.00 0.00 O | |
| ATOM 110 CB LYS A 7 6.663 5.587 -6.692 1.00 0.00 C | |
| ATOM 111 CG LYS A 7 7.681 4.508 -6.349 1.00 0.00 C | |
| ATOM 112 CD LYS A 7 7.245 3.149 -6.875 1.00 0.00 C | |
| ATOM 113 CE LYS A 7 8.257 2.068 -6.526 1.00 0.00 C | |
| ATOM 114 NZ LYS A 7 7.773 0.711 -6.897 1.00 0.00 N | |
| ATOM 115 H LYS A 7 6.357 6.154 -4.228 1.00 0.00 H | |
| ATOM 116 HA LYS A 7 8.036 7.171 -6.298 1.00 0.00 H | |
| ATOM 117 1HB LYS A 7 5.689 5.254 -6.332 1.00 0.00 H | |
| ATOM 118 2HB LYS A 7 6.603 5.658 -7.779 1.00 0.00 H | |
| ATOM 119 1HG LYS A 7 8.646 4.765 -6.788 1.00 0.00 H | |
| ATOM 120 2HG LYS A 7 7.798 4.449 -5.268 1.00 0.00 H | |
| ATOM 121 1HD LYS A 7 6.279 2.884 -6.442 1.00 0.00 H | |
| ATOM 122 2HD LYS A 7 7.137 3.195 -7.959 1.00 0.00 H | |
| ATOM 123 1HE LYS A 7 9.192 2.262 -7.050 1.00 0.00 H | |
| ATOM 124 2HE LYS A 7 8.456 2.088 -5.455 1.00 0.00 H | |
| ATOM 125 1HZ LYS A 7 8.471 0.024 -6.650 1.00 0.00 H | |
| ATOM 126 2HZ LYS A 7 6.915 0.511 -6.402 1.00 0.00 H | |
| ATOM 127 3HZ LYS A 7 7.603 0.674 -7.892 1.00 0.00 H | |
| ATOM 128 N CYS A 8 4.865 8.103 -6.432 1.00 0.00 N | |
| ATOM 129 CA CYS A 8 3.935 9.030 -7.065 1.00 0.00 C | |
| ATOM 130 C CYS A 8 4.165 10.456 -6.577 1.00 0.00 C | |
| ATOM 131 O CYS A 8 3.804 11.418 -7.254 1.00 0.00 O | |
| ATOM 132 CB CYS A 8 2.491 8.622 -6.777 1.00 0.00 C | |
| ATOM 133 SG CYS A 8 1.978 8.880 -5.062 1.00 0.00 S | |
| ATOM 134 H CYS A 8 4.530 7.495 -5.694 1.00 0.00 H | |
| ATOM 135 HA CYS A 8 4.097 9.001 -8.143 1.00 0.00 H | |
| ATOM 136 1HB CYS A 8 1.818 9.191 -7.420 1.00 0.00 H | |
| ATOM 137 2HB CYS A 8 2.356 7.567 -7.014 1.00 0.00 H | |
| ATOM 138 N THR A 9 4.763 10.583 -5.398 1.00 0.00 N | |
| ATOM 139 CA THR A 9 5.196 11.881 -4.895 1.00 0.00 C | |
| ATOM 140 C THR A 9 6.319 12.458 -5.748 1.00 0.00 C | |
| ATOM 141 O THR A 9 6.306 13.641 -6.088 1.00 0.00 O | |
| ATOM 142 CB THR A 9 5.659 11.781 -3.430 1.00 0.00 C | |
| ATOM 143 OG1 THR A 9 4.560 11.371 -2.606 1.00 0.00 O | |
| ATOM 144 CG2 THR A 9 6.180 13.124 -2.943 1.00 0.00 C | |
| ATOM 145 H THR A 9 4.926 9.758 -4.835 1.00 0.00 H | |
| ATOM 146 HA THR A 9 4.345 12.565 -4.927 1.00 0.00 H | |
| ATOM 147 HB THR A 9 6.453 11.039 -3.349 1.00 0.00 H | |
| ATOM 148 HG1 THR A 9 4.208 10.540 -2.934 1.00 0.00 H | |
| ATOM 149 1HG2 THR A 9 6.504 13.034 -1.906 1.00 0.00 H | |
| ATOM 150 2HG2 THR A 9 7.023 13.433 -3.560 1.00 0.00 H | |
| ATOM 151 3HG2 THR A 9 5.388 13.869 -3.012 1.00 0.00 H | |
| ATOM 152 N GLU A 10 7.286 11.614 -6.091 1.00 0.00 N | |
| ATOM 153 CA GLU A 10 8.408 12.033 -6.922 1.00 0.00 C | |
| ATOM 154 C GLU A 10 7.958 12.311 -8.354 1.00 0.00 C | |
| ATOM 155 O GLU A 10 8.478 13.209 -9.012 1.00 0.00 O | |
| ATOM 156 CB GLU A 10 9.503 10.964 -6.918 1.00 0.00 C | |
| ATOM 157 CG GLU A 10 10.210 10.793 -5.582 1.00 0.00 C | |
| ATOM 158 CD GLU A 10 10.894 12.047 -5.116 1.00 0.00 C | |
| ATOM 159 OE1 GLU A 10 11.604 12.638 -5.895 1.00 0.00 O | |
| ATOM 160 OE2 GLU A 10 10.708 12.416 -3.981 1.00 0.00 O | |
| ATOM 161 H GLU A 10 7.244 10.661 -5.766 1.00 0.00 H | |
| ATOM 162 HA GLU A 10 8.828 12.949 -6.504 1.00 0.00 H | |
| ATOM 163 1HB GLU A 10 9.073 10.001 -7.196 1.00 0.00 H | |
| ATOM 164 2HB GLU A 10 10.256 11.213 -7.666 1.00 0.00 H | |
| ATOM 165 1HG GLU A 10 9.479 10.493 -4.832 1.00 0.00 H | |
| ATOM 166 2HG GLU A 10 10.946 9.995 -5.671 1.00 0.00 H | |
| ATOM 167 N MET A 11 6.990 11.532 -8.825 1.00 0.00 N | |
| ATOM 168 CA MET A 11 6.394 11.765 -10.133 1.00 0.00 C | |
| ATOM 169 C MET A 11 5.594 13.061 -10.154 1.00 0.00 C | |
| ATOM 170 O MET A 11 5.536 13.748 -11.174 1.00 0.00 O | |
| ATOM 171 CB MET A 11 5.507 10.585 -10.525 1.00 0.00 C | |
| ATOM 172 CG MET A 11 6.266 9.302 -10.833 1.00 0.00 C | |
| ATOM 173 SD MET A 11 7.450 9.500 -12.179 1.00 0.00 S | |
| ATOM 174 CE MET A 11 6.347 9.640 -13.583 1.00 0.00 C | |
| ATOM 175 H MET A 11 6.661 10.762 -8.261 1.00 0.00 H | |
| ATOM 176 HA MET A 11 7.195 11.833 -10.872 1.00 0.00 H | |
| ATOM 177 1HB MET A 11 4.807 10.373 -9.719 1.00 0.00 H | |
| ATOM 178 2HB MET A 11 4.921 10.847 -11.407 1.00 0.00 H | |
| ATOM 179 1HG MET A 11 6.806 8.976 -9.945 1.00 0.00 H | |
| ATOM 180 2HG MET A 11 5.560 8.519 -11.109 1.00 0.00 H | |
| ATOM 181 1HE MET A 11 6.932 9.768 -14.494 1.00 0.00 H | |
| ATOM 182 2HE MET A 11 5.743 8.735 -13.662 1.00 0.00 H | |
| ATOM 183 3HE MET A 11 5.693 10.502 -13.447 1.00 0.00 H | |
| ATOM 184 N LYS A 12 4.981 13.390 -9.023 1.00 0.00 N | |
| ATOM 185 CA LYS A 12 4.295 14.667 -8.869 1.00 0.00 C | |
| ATOM 186 C LYS A 12 5.279 15.829 -8.891 1.00 0.00 C | |
| ATOM 187 O LYS A 12 5.003 16.877 -9.471 1.00 0.00 O | |
| ATOM 188 CB LYS A 12 3.487 14.686 -7.570 1.00 0.00 C | |
| ATOM 189 CG LYS A 12 2.720 15.978 -7.325 1.00 0.00 C | |
| ATOM 190 CD LYS A 12 1.630 16.179 -8.367 1.00 0.00 C | |
| ATOM 191 CE LYS A 12 0.797 17.417 -8.067 1.00 0.00 C | |
| ATOM 192 NZ LYS A 12 -0.270 17.629 -9.082 1.00 0.00 N | |
| ATOM 193 H LYS A 12 4.992 12.740 -8.251 1.00 0.00 H | |
| ATOM 194 HA LYS A 12 3.594 14.785 -9.695 1.00 0.00 H | |
| ATOM 195 1HB LYS A 12 2.769 13.866 -7.576 1.00 0.00 H | |
| ATOM 196 2HB LYS A 12 4.156 14.529 -6.723 1.00 0.00 H | |
| ATOM 197 1HG LYS A 12 2.264 15.949 -6.335 1.00 0.00 H | |
| ATOM 198 2HG LYS A 12 3.408 16.823 -7.364 1.00 0.00 H | |
| ATOM 199 1HD LYS A 12 2.084 16.288 -9.353 1.00 0.00 H | |
| ATOM 200 2HD LYS A 12 0.976 15.308 -8.382 1.00 0.00 H | |
| ATOM 201 1HE LYS A 12 0.333 17.313 -7.087 1.00 0.00 H | |
| ATOM 202 2HE LYS A 12 1.443 18.294 -8.048 1.00 0.00 H | |
| ATOM 203 1HZ LYS A 12 -0.799 18.458 -8.847 1.00 0.00 H | |
| ATOM 204 2HZ LYS A 12 0.150 17.745 -9.994 1.00 0.00 H | |
| ATOM 205 3HZ LYS A 12 -0.887 16.830 -9.095 1.00 0.00 H | |
| ATOM 206 N LYS A 13 6.428 15.635 -8.253 1.00 0.00 N | |
| ATOM 207 CA LYS A 13 7.509 16.614 -8.307 1.00 0.00 C | |
| ATOM 208 C LYS A 13 7.963 16.852 -9.742 1.00 0.00 C | |
| ATOM 209 O LYS A 13 8.227 17.988 -10.139 1.00 0.00 O | |
| ATOM 210 CB LYS A 13 8.691 16.156 -7.452 1.00 0.00 C | |
| ATOM 211 CG LYS A 13 8.438 16.205 -5.951 1.00 0.00 C | |
| ATOM 212 CD LYS A 13 9.631 15.674 -5.171 1.00 0.00 C | |
| ATOM 213 CE LYS A 13 9.349 15.647 -3.676 1.00 0.00 C | |
| ATOM 214 NZ LYS A 13 10.474 15.047 -2.908 1.00 0.00 N | |
| ATOM 215 H LYS A 13 6.558 14.788 -7.717 1.00 0.00 H | |
| ATOM 216 HA LYS A 13 7.143 17.555 -7.895 1.00 0.00 H | |
| ATOM 217 1HB LYS A 13 8.954 15.130 -7.713 1.00 0.00 H | |
| ATOM 218 2HB LYS A 13 9.559 16.780 -7.665 1.00 0.00 H | |
| ATOM 219 1HG LYS A 13 8.246 17.235 -5.648 1.00 0.00 H | |
| ATOM 220 2HG LYS A 13 7.561 15.605 -5.710 1.00 0.00 H | |
| ATOM 221 1HD LYS A 13 9.865 14.662 -5.507 1.00 0.00 H | |
| ATOM 222 2HD LYS A 13 10.498 16.308 -5.356 1.00 0.00 H | |
| ATOM 223 1HE LYS A 13 9.183 16.662 -3.319 1.00 0.00 H | |
| ATOM 224 2HE LYS A 13 8.447 15.066 -3.486 1.00 0.00 H | |
| ATOM 225 1HZ LYS A 13 10.248 15.047 -1.923 1.00 0.00 H | |
| ATOM 226 2HZ LYS A 13 10.626 14.097 -3.218 1.00 0.00 H | |
| ATOM 227 3HZ LYS A 13 11.313 15.588 -3.061 1.00 0.00 H | |
| ATOM 228 N LYS A 14 8.055 15.775 -10.515 1.00 0.00 N | |
| ATOM 229 CA LYS A 14 8.431 15.872 -11.921 1.00 0.00 C | |
| ATOM 230 C LYS A 14 7.323 16.521 -12.743 1.00 0.00 C | |
| ATOM 231 O LYS A 14 7.589 17.329 -13.631 1.00 0.00 O | |
| ATOM 232 CB LYS A 14 8.764 14.489 -12.483 1.00 0.00 C | |
| ATOM 233 CG LYS A 14 10.050 13.881 -11.940 1.00 0.00 C | |
| ATOM 234 CD LYS A 14 10.284 12.487 -12.502 1.00 0.00 C | |
| ATOM 235 CE LYS A 14 11.555 11.868 -11.940 1.00 0.00 C | |
| ATOM 236 NZ LYS A 14 11.783 10.493 -12.462 1.00 0.00 N | |
| ATOM 237 H LYS A 14 7.859 14.867 -10.119 1.00 0.00 H | |
| ATOM 238 HA LYS A 14 9.328 16.485 -12.000 1.00 0.00 H | |
| ATOM 239 1HB LYS A 14 7.948 13.800 -12.260 1.00 0.00 H | |
| ATOM 240 2HB LYS A 14 8.854 14.549 -13.568 1.00 0.00 H | |
| ATOM 241 1HG LYS A 14 10.895 14.518 -12.207 1.00 0.00 H | |
| ATOM 242 2HG LYS A 14 9.994 13.821 -10.853 1.00 0.00 H | |
| ATOM 243 1HD LYS A 14 9.436 11.847 -12.252 1.00 0.00 H | |
| ATOM 244 2HD LYS A 14 10.367 12.542 -13.587 1.00 0.00 H | |
| ATOM 245 1HE LYS A 14 12.409 12.490 -12.204 1.00 0.00 H | |
| ATOM 246 2HE LYS A 14 11.489 11.824 -10.853 1.00 0.00 H | |
| ATOM 247 1HZ LYS A 14 12.633 10.119 -12.066 1.00 0.00 H | |
| ATOM 248 2HZ LYS A 14 11.004 9.902 -12.206 1.00 0.00 H | |
| ATOM 249 3HZ LYS A 14 11.865 10.524 -13.468 1.00 0.00 H | |
| ATOM 250 N PHE A 15 6.082 16.160 -12.441 1.00 0.00 N | |
| ATOM 251 CA PHE A 15 4.937 16.624 -13.218 1.00 0.00 C | |
| ATOM 252 C PHE A 15 3.883 17.256 -12.321 1.00 0.00 C | |
| ATOM 253 O PHE A 15 2.802 16.699 -12.132 1.00 0.00 O | |
| ATOM 254 CB PHE A 15 4.318 15.466 -14.002 1.00 0.00 C | |
| ATOM 255 CG PHE A 15 5.287 14.760 -14.907 1.00 0.00 C | |
| ATOM 256 CD1 PHE A 15 5.841 13.543 -14.538 1.00 0.00 C | |
| ATOM 257 CD2 PHE A 15 5.648 15.310 -16.127 1.00 0.00 C | |
| ATOM 258 CE1 PHE A 15 6.733 12.892 -15.369 1.00 0.00 C | |
| ATOM 259 CE2 PHE A 15 6.538 14.661 -16.960 1.00 0.00 C | |
| ATOM 260 CZ PHE A 15 7.081 13.450 -16.580 1.00 0.00 C | |
| ATOM 261 H PHE A 15 5.925 15.548 -11.653 1.00 0.00 H | |
| ATOM 262 HA PHE A 15 5.285 17.374 -13.930 1.00 0.00 H | |
| ATOM 263 1HB PHE A 15 3.906 14.736 -13.308 1.00 0.00 H | |
| ATOM 264 2HB PHE A 15 3.495 15.839 -14.611 1.00 0.00 H | |
| ATOM 265 HD1 PHE A 15 5.565 13.100 -13.580 1.00 0.00 H | |
| ATOM 266 HD2 PHE A 15 5.219 16.267 -16.427 1.00 0.00 H | |
| ATOM 267 HE1 PHE A 15 7.161 11.936 -15.066 1.00 0.00 H | |
| ATOM 268 HE2 PHE A 15 6.813 15.104 -17.917 1.00 0.00 H | |
| ATOM 269 HZ PHE A 15 7.785 12.938 -17.235 1.00 0.00 H | |
| ATOM 270 N LYS A 16 4.202 18.422 -11.770 1.00 0.00 N | |
| ATOM 271 CA LYS A 16 3.331 19.076 -10.801 1.00 0.00 C | |
| ATOM 272 C LYS A 16 2.039 19.550 -11.452 1.00 0.00 C | |
| ATOM 273 O LYS A 16 1.009 19.680 -10.789 1.00 0.00 O | |
| ATOM 274 CB LYS A 16 4.051 20.254 -10.143 1.00 0.00 C | |
| ATOM 275 CG LYS A 16 5.189 19.855 -9.212 1.00 0.00 C | |
| ATOM 276 CD LYS A 16 5.866 21.078 -8.612 1.00 0.00 C | |
| ATOM 277 CE LYS A 16 7.007 20.682 -7.687 1.00 0.00 C | |
| ATOM 278 NZ LYS A 16 7.702 21.869 -7.120 1.00 0.00 N | |
| ATOM 279 H LYS A 16 5.071 18.867 -12.029 1.00 0.00 H | |
| ATOM 280 HA LYS A 16 3.085 18.358 -10.017 1.00 0.00 H | |
| ATOM 281 1HB LYS A 16 4.463 20.905 -10.914 1.00 0.00 H | |
| ATOM 282 2HB LYS A 16 3.337 20.841 -9.565 1.00 0.00 H | |
| ATOM 283 1HG LYS A 16 4.799 19.234 -8.406 1.00 0.00 H | |
| ATOM 284 2HG LYS A 16 5.928 19.278 -9.767 1.00 0.00 H | |
| ATOM 285 1HD LYS A 16 6.259 21.706 -9.412 1.00 0.00 H | |
| ATOM 286 2HD LYS A 16 5.136 21.656 -8.045 1.00 0.00 H | |
| ATOM 287 1HE LYS A 16 6.619 20.078 -6.868 1.00 0.00 H | |
| ATOM 288 2HE LYS A 16 7.732 20.083 -8.239 1.00 0.00 H | |
| ATOM 289 1HZ LYS A 16 8.451 21.565 -6.514 1.00 0.00 H | |
| ATOM 290 2HZ LYS A 16 8.083 22.428 -7.871 1.00 0.00 H | |
| ATOM 291 3HZ LYS A 16 7.045 22.423 -6.589 1.00 0.00 H | |
| ATOM 292 N ASN A 17 2.099 19.803 -12.754 1.00 0.00 N | |
| ATOM 293 CA ASN A 17 0.956 20.350 -13.481 1.00 0.00 C | |
| ATOM 294 C ASN A 17 0.167 19.245 -14.173 1.00 0.00 C | |
| ATOM 295 O ASN A 17 -0.700 19.519 -15.005 1.00 0.00 O | |
| ATOM 296 CB ASN A 17 1.409 21.392 -14.486 1.00 0.00 C | |
| ATOM 297 CG ASN A 17 1.943 22.634 -13.830 1.00 0.00 C | |
| ATOM 298 OD1 ASN A 17 1.408 23.094 -12.813 1.00 0.00 O | |
| ATOM 299 ND2 ASN A 17 2.988 23.188 -14.389 1.00 0.00 N | |
| ATOM 300 H ASN A 17 2.955 19.614 -13.253 1.00 0.00 H | |
| ATOM 301 HA ASN A 17 0.303 20.856 -12.769 1.00 0.00 H | |
| ATOM 302 1HB ASN A 17 2.187 20.969 -15.123 1.00 0.00 H | |
| ATOM 303 2HB ASN A 17 0.572 21.666 -15.129 1.00 0.00 H | |
| ATOM 304 1HD2 ASN A 17 3.387 24.017 -13.995 1.00 0.00 H | |
| ATOM 305 2HD2 ASN A 17 3.389 22.783 -15.211 1.00 0.00 H | |
| ATOM 306 N CYS A 18 0.468 18.000 -13.823 1.00 0.00 N | |
| ATOM 307 CA CYS A 18 -0.231 16.855 -14.395 1.00 0.00 C | |
| ATOM 308 C CYS A 18 -1.007 16.097 -13.328 1.00 0.00 C | |
| ATOM 309 O CYS A 18 -0.759 16.258 -12.133 1.00 0.00 O | |
| ATOM 310 CB CYS A 18 0.758 15.904 -15.070 1.00 0.00 C | |
| ATOM 311 SG CYS A 18 1.711 16.658 -16.409 1.00 0.00 S | |
| ATOM 312 H CYS A 18 1.201 17.844 -13.146 1.00 0.00 H | |
| ATOM 313 HA CYS A 18 -0.932 17.217 -15.147 1.00 0.00 H | |
| ATOM 314 1HB CYS A 18 1.461 15.524 -14.329 1.00 0.00 H | |
| ATOM 315 2HB CYS A 18 0.220 15.050 -15.477 1.00 0.00 H | |
| ATOM 316 N GLU A 19 -1.950 15.269 -13.764 1.00 0.00 N | |
| ATOM 317 CA GLU A 19 -2.751 14.466 -12.849 1.00 0.00 C | |
| ATOM 318 C GLU A 19 -2.039 13.173 -12.480 1.00 0.00 C | |
| ATOM 319 O GLU A 19 -1.896 12.274 -13.308 1.00 0.00 O | |
| ATOM 320 CB GLU A 19 -4.113 14.148 -13.470 1.00 0.00 C | |
| ATOM 321 CG GLU A 19 -5.045 13.349 -12.569 1.00 0.00 C | |
| ATOM 322 CD GLU A 19 -6.355 13.020 -13.227 1.00 0.00 C | |
| ATOM 323 OE1 GLU A 19 -6.524 13.358 -14.374 1.00 0.00 O | |
| ATOM 324 OE2 GLU A 19 -7.190 12.430 -12.582 1.00 0.00 O | |
| ATOM 325 H GLU A 19 -2.116 15.191 -14.758 1.00 0.00 H | |
| ATOM 326 HA GLU A 19 -2.920 15.045 -11.941 1.00 0.00 H | |
| ATOM 327 1HB GLU A 19 -4.619 15.078 -13.733 1.00 0.00 H | |
| ATOM 328 2HB GLU A 19 -3.971 13.581 -14.390 1.00 0.00 H | |
| ATOM 329 1HG GLU A 19 -4.550 12.420 -12.285 1.00 0.00 H | |
| ATOM 330 2HG GLU A 19 -5.232 13.920 -11.661 1.00 0.00 H | |
| ATOM 331 N VAL A 20 -1.592 13.084 -11.232 1.00 0.00 N | |
| ATOM 332 CA VAL A 20 -0.811 11.940 -10.779 1.00 0.00 C | |
| ATOM 333 C VAL A 20 -1.612 11.070 -9.818 1.00 0.00 C | |
| ATOM 334 O VAL A 20 -1.987 11.509 -8.733 1.00 0.00 O | |
| ATOM 335 CB VAL A 20 0.478 12.415 -10.082 1.00 0.00 C | |
| ATOM 336 CG1 VAL A 20 1.303 11.224 -9.616 1.00 0.00 C | |
| ATOM 337 CG2 VAL A 20 1.284 13.293 -11.027 1.00 0.00 C | |
| ATOM 338 H VAL A 20 -1.801 13.827 -10.580 1.00 0.00 H | |
| ATOM 339 HA VAL A 20 -0.534 11.342 -11.647 1.00 0.00 H | |
| ATOM 340 HB VAL A 20 0.210 12.987 -9.193 1.00 0.00 H | |
| ATOM 341 1HG1 VAL A 20 2.209 11.579 -9.126 1.00 0.00 H | |
| ATOM 342 2HG1 VAL A 20 0.719 10.630 -8.913 1.00 0.00 H | |
| ATOM 343 3HG1 VAL A 20 1.572 10.610 -10.475 1.00 0.00 H | |
| ATOM 344 1HG2 VAL A 20 2.193 13.626 -10.527 1.00 0.00 H | |
| ATOM 345 2HG2 VAL A 20 1.547 12.723 -11.918 1.00 0.00 H | |
| ATOM 346 3HG2 VAL A 20 0.689 14.160 -11.314 1.00 0.00 H | |
| ATOM 347 N ARG A 21 -1.872 9.833 -10.227 1.00 0.00 N | |
| ATOM 348 CA ARG A 21 -2.639 8.902 -9.408 1.00 0.00 C | |
| ATOM 349 C ARG A 21 -1.723 7.925 -8.681 1.00 0.00 C | |
| ATOM 350 O ARG A 21 -0.872 7.281 -9.296 1.00 0.00 O | |
| ATOM 351 CB ARG A 21 -3.628 8.124 -10.264 1.00 0.00 C | |
| ATOM 352 CG ARG A 21 -4.511 7.152 -9.499 1.00 0.00 C | |
| ATOM 353 CD ARG A 21 -5.587 6.594 -10.358 1.00 0.00 C | |
| ATOM 354 NE ARG A 21 -5.054 5.747 -11.413 1.00 0.00 N | |
| ATOM 355 CZ ARG A 21 -4.859 4.419 -11.303 1.00 0.00 C | |
| ATOM 356 NH1 ARG A 21 -5.157 3.801 -10.182 1.00 0.00 N | |
| ATOM 357 NH2 ARG A 21 -4.368 3.736 -12.323 1.00 0.00 N | |
| ATOM 358 H ARG A 21 -1.528 9.529 -11.128 1.00 0.00 H | |
| ATOM 359 HA ARG A 21 -3.197 9.472 -8.667 1.00 0.00 H | |
| ATOM 360 1HB ARG A 21 -4.281 8.820 -10.788 1.00 0.00 H | |
| ATOM 361 2HB ARG A 21 -3.086 7.554 -11.019 1.00 0.00 H | |
| ATOM 362 1HG ARG A 21 -3.905 6.325 -9.127 1.00 0.00 H | |
| ATOM 363 2HG ARG A 21 -4.976 7.667 -8.658 1.00 0.00 H | |
| ATOM 364 1HD ARG A 21 -6.264 5.994 -9.749 1.00 0.00 H | |
| ATOM 365 2HD ARG A 21 -6.141 7.408 -10.822 1.00 0.00 H | |
| ATOM 366 HE ARG A 21 -4.812 6.187 -12.291 1.00 0.00 H | |
| ATOM 367 1HH1 ARG A 21 -5.533 4.323 -9.402 1.00 0.00 H | |
| ATOM 368 2HH1 ARG A 21 -5.012 2.805 -10.100 1.00 0.00 H | |
| ATOM 369 1HH2 ARG A 21 -4.138 4.211 -13.185 1.00 0.00 H | |
| ATOM 370 2HH2 ARG A 21 -4.222 2.741 -12.241 1.00 0.00 H | |
| ATOM 371 N CYS A 22 -1.904 7.815 -7.368 1.00 0.00 N | |
| ATOM 372 CA CYS A 22 -1.102 6.907 -6.557 1.00 0.00 C | |
| ATOM 373 C CYS A 22 -1.813 5.574 -6.361 1.00 0.00 C | |
| ATOM 374 O CYS A 22 -2.594 5.406 -5.426 1.00 0.00 O | |
| ATOM 375 CB CYS A 22 -0.804 7.526 -5.192 1.00 0.00 C | |
| ATOM 376 SG CYS A 22 -0.023 9.155 -5.274 1.00 0.00 S | |
| ATOM 377 H CYS A 22 -2.614 8.378 -6.922 1.00 0.00 H | |
| ATOM 378 HA CYS A 22 -0.155 6.731 -7.071 1.00 0.00 H | |
| ATOM 379 1HB CYS A 22 -1.731 7.624 -4.626 1.00 0.00 H | |
| ATOM 380 2HB CYS A 22 -0.146 6.865 -4.629 1.00 0.00 H | |
| ATOM 381 N ASP A 23 -1.533 4.627 -7.251 1.00 0.00 N | |
| ATOM 382 CA ASP A 23 -2.237 3.348 -7.254 1.00 0.00 C | |
| ATOM 383 C ASP A 23 -1.560 2.343 -6.333 1.00 0.00 C | |
| ATOM 384 O ASP A 23 -0.625 1.650 -6.733 1.00 0.00 O | |
| ATOM 385 CB ASP A 23 -2.309 2.779 -8.674 1.00 0.00 C | |
| ATOM 386 CG ASP A 23 -3.127 1.498 -8.757 1.00 0.00 C | |
| ATOM 387 OD1 ASP A 23 -3.270 0.841 -7.753 1.00 0.00 O | |
| ATOM 388 OD2 ASP A 23 -3.601 1.188 -9.824 1.00 0.00 O | |
| ATOM 389 H ASP A 23 -0.816 4.796 -7.941 1.00 0.00 H | |
| ATOM 390 HA ASP A 23 -3.256 3.514 -6.903 1.00 0.00 H | |
| ATOM 391 1HB ASP A 23 -2.751 3.519 -9.341 1.00 0.00 H | |
| ATOM 392 2HB ASP A 23 -1.301 2.573 -9.034 1.00 0.00 H | |
| ATOM 393 N GLU A 24 -2.037 2.270 -5.094 1.00 0.00 N | |
| ATOM 394 CA GLU A 24 -1.399 1.445 -4.078 1.00 0.00 C | |
| ATOM 395 C GLU A 24 -1.864 -0.004 -4.168 1.00 0.00 C | |
| ATOM 396 O GLU A 24 -1.293 -0.891 -3.537 1.00 0.00 O | |
| ATOM 397 CB GLU A 24 -1.691 1.999 -2.682 1.00 0.00 C | |
| ATOM 398 CG GLU A 24 -1.119 3.385 -2.423 1.00 0.00 C | |
| ATOM 399 CD GLU A 24 -1.416 3.892 -1.039 1.00 0.00 C | |
| ATOM 400 OE1 GLU A 24 -1.408 3.104 -0.124 1.00 0.00 O | |
| ATOM 401 OE2 GLU A 24 -1.652 5.069 -0.897 1.00 0.00 O | |
| ATOM 402 H GLU A 24 -2.862 2.799 -4.851 1.00 0.00 H | |
| ATOM 403 HA GLU A 24 -0.307 1.506 -4.195 1.00 0.00 H | |
| ATOM 404 1HB GLU A 24 -2.770 2.048 -2.529 1.00 0.00 H | |
| ATOM 405 2HB GLU A 24 -1.285 1.323 -1.930 1.00 0.00 H | |
| ATOM 406 1HG GLU A 24 -0.038 3.352 -2.561 1.00 0.00 H | |
| ATOM 407 2HG GLU A 24 -1.530 4.079 -3.155 1.00 0.00 H | |
| ATOM 408 N SER A 25 -2.904 -0.236 -4.962 1.00 0.00 N | |
| ATOM 409 CA SER A 25 -3.435 -1.580 -5.158 1.00 0.00 C | |
| ATOM 410 C SER A 25 -2.636 -2.340 -6.209 1.00 0.00 C | |
| ATOM 411 O SER A 25 -2.515 -3.561 -6.146 1.00 0.00 O | |
| ATOM 412 CB SER A 25 -4.892 -1.510 -5.571 1.00 0.00 C | |
| ATOM 413 OG SER A 25 -5.026 -0.949 -6.848 1.00 0.00 O | |
| ATOM 414 H SER A 25 -3.339 0.540 -5.442 1.00 0.00 H | |
| ATOM 415 HA SER A 25 -3.370 -2.117 -4.212 1.00 0.00 H | |
| ATOM 416 1HB SER A 25 -5.321 -2.512 -5.565 1.00 0.00 H | |
| ATOM 417 2HB SER A 25 -5.447 -0.913 -4.849 1.00 0.00 H | |
| ATOM 418 HG SER A 25 -4.291 -0.340 -6.948 1.00 0.00 H | |
| ATOM 419 N ASN A 26 -2.092 -1.607 -7.176 1.00 0.00 N | |
| ATOM 420 CA ASN A 26 -1.203 -2.192 -8.170 1.00 0.00 C | |
| ATOM 421 C ASN A 26 0.237 -1.742 -7.957 1.00 0.00 C | |
| ATOM 422 O ASN A 26 1.153 -2.228 -8.617 1.00 0.00 O | |
| ATOM 423 CB ASN A 26 -1.668 -1.844 -9.572 1.00 0.00 C | |
| ATOM 424 CG ASN A 26 -2.983 -2.487 -9.920 1.00 0.00 C | |
| ATOM 425 OD1 ASN A 26 -3.098 -3.717 -9.950 1.00 0.00 O | |
| ATOM 426 ND2 ASN A 26 -3.977 -1.678 -10.185 1.00 0.00 N | |
| ATOM 427 H ASN A 26 -2.301 -0.620 -7.221 1.00 0.00 H | |
| ATOM 428 HA ASN A 26 -1.246 -3.277 -8.081 1.00 0.00 H | |
| ATOM 429 1HB ASN A 26 -1.772 -0.762 -9.664 1.00 0.00 H | |
| ATOM 430 2HB ASN A 26 -0.919 -2.164 -10.295 1.00 0.00 H | |
| ATOM 431 1HD2 ASN A 26 -4.875 -2.049 -10.422 1.00 0.00 H | |
| ATOM 432 2HD2 ASN A 26 -3.839 -0.688 -10.148 1.00 0.00 H | |
| ATOM 433 N HIS A 27 0.427 -0.811 -7.029 1.00 0.00 N | |
| ATOM 434 CA HIS A 27 1.757 -0.298 -6.720 1.00 0.00 C | |
| ATOM 435 C HIS A 27 2.378 0.383 -7.932 1.00 0.00 C | |
| ATOM 436 O HIS A 27 3.552 0.174 -8.239 1.00 0.00 O | |
| ATOM 437 CB HIS A 27 2.674 -1.426 -6.236 1.00 0.00 C | |
| ATOM 438 CG HIS A 27 2.131 -2.180 -5.062 1.00 0.00 C | |
| ATOM 439 ND1 HIS A 27 2.150 -1.674 -3.779 1.00 0.00 N | |
| ATOM 440 CD2 HIS A 27 1.555 -3.402 -4.976 1.00 0.00 C | |
| ATOM 441 CE1 HIS A 27 1.608 -2.553 -2.954 1.00 0.00 C | |
| ATOM 442 NE2 HIS A 27 1.240 -3.610 -3.655 1.00 0.00 N | |
| ATOM 443 H HIS A 27 -0.368 -0.449 -6.522 1.00 0.00 H | |
| ATOM 444 HA HIS A 27 1.664 0.457 -5.937 1.00 0.00 H | |
| ATOM 445 1HB HIS A 27 2.841 -2.134 -7.049 1.00 0.00 H | |
| ATOM 446 2HB HIS A 27 3.643 -1.013 -5.957 1.00 0.00 H | |
| ATOM 447 HD2 HIS A 27 1.376 -4.093 -5.800 1.00 0.00 H | |
| ATOM 448 HE1 HIS A 27 1.485 -2.427 -1.879 1.00 0.00 H | |
| ATOM 449 HE2 HIS A 27 0.797 -4.439 -3.286 1.00 0.00 H | |
| ATOM 450 N CYS A 28 1.585 1.199 -8.617 1.00 0.00 N | |
| ATOM 451 CA CYS A 28 2.060 1.917 -9.796 1.00 0.00 C | |
| ATOM 452 C CYS A 28 1.636 3.379 -9.756 1.00 0.00 C | |
| ATOM 453 O CYS A 28 0.859 3.788 -8.893 1.00 0.00 O | |
| ATOM 454 CB CYS A 28 1.517 1.272 -11.071 1.00 0.00 C | |
| ATOM 455 SG CYS A 28 2.149 -0.394 -11.380 1.00 0.00 S | |
| ATOM 456 H CYS A 28 0.630 1.323 -8.317 1.00 0.00 H | |
| ATOM 457 HA CYS A 28 3.149 1.868 -9.816 1.00 0.00 H | |
| ATOM 458 1HB CYS A 28 0.431 1.216 -11.020 1.00 0.00 H | |
| ATOM 459 2HB CYS A 28 1.774 1.894 -11.930 1.00 0.00 H | |
| ATOM 460 N VAL A 29 2.153 4.166 -10.693 1.00 0.00 N | |
| ATOM 461 CA VAL A 29 1.815 5.583 -10.779 1.00 0.00 C | |
| ATOM 462 C VAL A 29 1.310 5.944 -12.170 1.00 0.00 C | |
| ATOM 463 O VAL A 29 1.966 5.658 -13.171 1.00 0.00 O | |
| ATOM 464 CB VAL A 29 3.044 6.448 -10.443 1.00 0.00 C | |
| ATOM 465 CG1 VAL A 29 2.681 7.925 -10.472 1.00 0.00 C | |
| ATOM 466 CG2 VAL A 29 3.596 6.055 -9.081 1.00 0.00 C | |
| ATOM 467 H VAL A 29 2.796 3.774 -11.364 1.00 0.00 H | |
| ATOM 468 HA VAL A 29 1.026 5.793 -10.055 1.00 0.00 H | |
| ATOM 469 HB VAL A 29 3.808 6.290 -11.205 1.00 0.00 H | |
| ATOM 470 1HG1 VAL A 29 3.561 8.521 -10.233 1.00 0.00 H | |
| ATOM 471 2HG1 VAL A 29 2.322 8.191 -11.467 1.00 0.00 H | |
| ATOM 472 3HG1 VAL A 29 1.899 8.122 -9.739 1.00 0.00 H | |
| ATOM 473 1HG2 VAL A 29 4.465 6.670 -8.850 1.00 0.00 H | |
| ATOM 474 2HG2 VAL A 29 2.830 6.208 -8.320 1.00 0.00 H | |
| ATOM 475 3HG2 VAL A 29 3.888 5.005 -9.095 1.00 0.00 H | |
| ATOM 476 N GLU A 30 0.142 6.574 -12.223 1.00 0.00 N | |
| ATOM 477 CA GLU A 30 -0.423 7.038 -13.486 1.00 0.00 C | |
| ATOM 478 C GLU A 30 -0.378 8.556 -13.587 1.00 0.00 C | |
| ATOM 479 O GLU A 30 -0.999 9.258 -12.789 1.00 0.00 O | |
| ATOM 480 CB GLU A 30 -1.866 6.551 -13.636 1.00 0.00 C | |
| ATOM 481 CG GLU A 30 -2.547 6.988 -14.925 1.00 0.00 C | |
| ATOM 482 CD GLU A 30 -3.963 6.496 -15.035 1.00 0.00 C | |
| ATOM 483 OE1 GLU A 30 -4.368 5.718 -14.205 1.00 0.00 O | |
| ATOM 484 OE2 GLU A 30 -4.642 6.898 -15.951 1.00 0.00 O | |
| ATOM 485 H GLU A 30 -0.369 6.738 -11.367 1.00 0.00 H | |
| ATOM 486 HA GLU A 30 0.166 6.615 -14.301 1.00 0.00 H | |
| ATOM 487 1HB GLU A 30 -1.888 5.461 -13.599 1.00 0.00 H | |
| ATOM 488 2HB GLU A 30 -2.463 6.919 -12.801 1.00 0.00 H | |
| ATOM 489 1HG GLU A 30 -2.548 8.077 -14.972 1.00 0.00 H | |
| ATOM 490 2HG GLU A 30 -1.971 6.616 -15.772 1.00 0.00 H | |
| ATOM 491 N VAL A 31 0.360 9.057 -14.570 1.00 0.00 N | |
| ATOM 492 CA VAL A 31 0.485 10.497 -14.778 1.00 0.00 C | |
| ATOM 493 C VAL A 31 -0.158 10.921 -16.091 1.00 0.00 C | |
| ATOM 494 O VAL A 31 0.191 10.413 -17.158 1.00 0.00 O | |
| ATOM 495 CB VAL A 31 1.969 10.911 -14.781 1.00 0.00 C | |
| ATOM 496 CG1 VAL A 31 2.102 12.412 -14.991 1.00 0.00 C | |
| ATOM 497 CG2 VAL A 31 2.627 10.488 -13.476 1.00 0.00 C | |
| ATOM 498 H VAL A 31 0.846 8.428 -15.191 1.00 0.00 H | |
| ATOM 499 HA VAL A 31 -0.019 11.009 -13.959 1.00 0.00 H | |
| ATOM 500 HB VAL A 31 2.471 10.423 -15.617 1.00 0.00 H | |
| ATOM 501 1HG1 VAL A 31 3.158 12.687 -14.991 1.00 0.00 H | |
| ATOM 502 2HG1 VAL A 31 1.657 12.686 -15.947 1.00 0.00 H | |
| ATOM 503 3HG1 VAL A 31 1.591 12.939 -14.187 1.00 0.00 H | |
| ATOM 504 1HG2 VAL A 31 3.676 10.784 -13.486 1.00 0.00 H | |
| ATOM 505 2HG2 VAL A 31 2.121 10.972 -12.640 1.00 0.00 H | |
| ATOM 506 3HG2 VAL A 31 2.556 9.406 -13.367 1.00 0.00 H | |
| ATOM 507 N ARG A 32 -1.099 11.853 -16.010 1.00 0.00 N | |
| ATOM 508 CA ARG A 32 -1.805 12.338 -17.191 1.00 0.00 C | |
| ATOM 509 C ARG A 32 -1.452 13.791 -17.484 1.00 0.00 C | |
| ATOM 510 O ARG A 32 -1.881 14.700 -16.773 1.00 0.00 O | |
| ATOM 511 CB ARG A 32 -3.310 12.213 -17.006 1.00 0.00 C | |
| ATOM 512 CG ARG A 32 -3.809 10.797 -16.766 1.00 0.00 C | |
| ATOM 513 CD ARG A 32 -5.260 10.772 -16.447 1.00 0.00 C | |
| ATOM 514 NE ARG A 32 -5.734 9.424 -16.181 1.00 0.00 N | |
| ATOM 515 CZ ARG A 32 -6.986 9.116 -15.790 1.00 0.00 C | |
| ATOM 516 NH1 ARG A 32 -7.876 10.070 -15.624 1.00 0.00 N | |
| ATOM 517 NH2 ARG A 32 -7.320 7.856 -15.573 1.00 0.00 N | |
| ATOM 518 H ARG A 32 -1.332 12.241 -15.105 1.00 0.00 H | |
| ATOM 519 HA ARG A 32 -1.495 11.742 -18.049 1.00 0.00 H | |
| ATOM 520 1HB ARG A 32 -3.624 12.820 -16.158 1.00 0.00 H | |
| ATOM 521 2HB ARG A 32 -3.819 12.597 -17.890 1.00 0.00 H | |
| ATOM 522 1HG ARG A 32 -3.645 10.197 -17.662 1.00 0.00 H | |
| ATOM 523 2HG ARG A 32 -3.267 10.356 -15.929 1.00 0.00 H | |
| ATOM 524 1HD ARG A 32 -5.448 11.380 -15.563 1.00 0.00 H | |
| ATOM 525 2HD ARG A 32 -5.824 11.172 -17.289 1.00 0.00 H | |
| ATOM 526 HE ARG A 32 -5.078 8.663 -16.298 1.00 0.00 H | |
| ATOM 527 1HH1 ARG A 32 -7.621 11.033 -15.790 1.00 0.00 H | |
| ATOM 528 2HH1 ARG A 32 -8.814 9.839 -15.331 1.00 0.00 H | |
| ATOM 529 1HH2 ARG A 32 -6.636 7.123 -15.701 1.00 0.00 H | |
| ATOM 530 2HH2 ARG A 32 -8.257 7.626 -15.280 1.00 0.00 H | |
| ATOM 531 N CYS A 33 -0.672 14.003 -18.538 1.00 0.00 N | |
| ATOM 532 CA CYS A 33 -0.282 15.349 -18.945 1.00 0.00 C | |
| ATOM 533 C CYS A 33 -0.972 15.752 -20.241 1.00 0.00 C | |
| ATOM 534 O CYS A 33 -1.563 14.920 -20.928 1.00 0.00 O | |
| ATOM 535 CB CYS A 33 1.233 15.437 -19.132 1.00 0.00 C | |
| ATOM 536 SG CYS A 33 2.183 15.107 -17.630 1.00 0.00 S | |
| ATOM 537 H CYS A 33 -0.337 13.211 -19.072 1.00 0.00 H | |
| ATOM 538 HA CYS A 33 -0.576 16.045 -18.160 1.00 0.00 H | |
| ATOM 539 1HB CYS A 33 1.548 14.725 -19.894 1.00 0.00 H | |
| ATOM 540 2HB CYS A 33 1.498 16.433 -19.488 1.00 0.00 H | |
| ATOM 541 N SER A 34 -0.893 17.038 -20.572 1.00 0.00 N | |
| ATOM 542 CA SER A 34 -1.497 17.551 -21.793 1.00 0.00 C | |
| ATOM 543 C SER A 34 -0.770 17.033 -23.027 1.00 0.00 C | |
| ATOM 544 O SER A 34 -1.335 16.989 -24.121 1.00 0.00 O | |
| ATOM 545 CB SER A 34 -1.482 19.067 -21.785 1.00 0.00 C | |
| ATOM 546 OG SER A 34 -0.172 19.557 -21.861 1.00 0.00 O | |
| ATOM 547 H SER A 34 -0.402 17.675 -19.961 1.00 0.00 H | |
| ATOM 548 HA SER A 34 -2.536 17.222 -21.835 1.00 0.00 H | |
| ATOM 549 1HB SER A 34 -2.063 19.441 -22.628 1.00 0.00 H | |
| ATOM 550 2HB SER A 34 -1.957 19.431 -20.874 1.00 0.00 H | |
| ATOM 551 HG SER A 34 0.176 19.253 -22.703 1.00 0.00 H | |
| ATOM 552 N ASP A 35 0.485 16.640 -22.845 1.00 0.00 N | |
| ATOM 553 CA ASP A 35 1.290 16.119 -23.944 1.00 0.00 C | |
| ATOM 554 C ASP A 35 1.122 14.614 -24.089 1.00 0.00 C | |
| ATOM 555 O ASP A 35 0.744 14.121 -25.153 1.00 0.00 O | |
| ATOM 556 CB ASP A 35 2.769 16.453 -23.730 1.00 0.00 C | |
| ATOM 557 CG ASP A 35 3.063 17.943 -23.847 1.00 0.00 C | |
| ATOM 558 OD1 ASP A 35 2.222 18.657 -24.340 1.00 0.00 O | |
| ATOM 559 OD2 ASP A 35 4.125 18.351 -23.442 1.00 0.00 O | |
| ATOM 560 H ASP A 35 0.892 16.700 -21.924 1.00 0.00 H | |
| ATOM 561 HA ASP A 35 0.969 16.600 -24.869 1.00 0.00 H | |
| ATOM 562 1HB ASP A 35 3.079 16.113 -22.741 1.00 0.00 H | |
| ATOM 563 2HB ASP A 35 3.372 15.919 -24.464 1.00 0.00 H | |
| ATOM 564 N THR A 36 1.399 13.884 -23.012 1.00 0.00 N | |
| ATOM 565 CA THR A 36 1.291 12.431 -23.023 1.00 0.00 C | |
| ATOM 566 C THR A 36 1.064 11.885 -21.618 1.00 0.00 C | |
| ATOM 567 O THR A 36 0.789 12.641 -20.685 1.00 0.00 O | |
| ATOM 568 CB THR A 36 2.549 11.787 -23.633 1.00 0.00 C | |
| ATOM 569 OG1 THR A 36 2.324 10.385 -23.829 1.00 0.00 O | |
| ATOM 570 CG2 THR A 36 3.746 11.981 -22.715 1.00 0.00 C | |
| ATOM 571 H THR A 36 1.695 14.351 -22.167 1.00 0.00 H | |
| ATOM 572 HA THR A 36 0.442 12.151 -23.649 1.00 0.00 H | |
| ATOM 573 HB THR A 36 2.761 12.245 -24.599 1.00 0.00 H | |
| ATOM 574 HG1 THR A 36 2.718 10.111 -24.661 1.00 0.00 H | |
| ATOM 575 1HG2 THR A 36 4.626 11.519 -23.163 1.00 0.00 H | |
| ATOM 576 2HG2 THR A 36 3.927 13.046 -22.573 1.00 0.00 H | |
| ATOM 577 3HG2 THR A 36 3.544 11.516 -21.751 1.00 0.00 H | |
| ATOM 578 N LYS A 37 1.180 10.571 -21.475 1.00 0.00 N | |
| ATOM 579 CA LYS A 37 0.996 9.922 -20.182 1.00 0.00 C | |
| ATOM 580 C LYS A 37 2.256 9.178 -19.755 1.00 0.00 C | |
| ATOM 581 O LYS A 37 3.036 8.727 -20.595 1.00 0.00 O | |
| ATOM 582 CB LYS A 37 -0.192 8.960 -20.229 1.00 0.00 C | |
| ATOM 583 CG LYS A 37 -1.535 9.632 -20.482 1.00 0.00 C | |
| ATOM 584 CD LYS A 37 -2.659 8.609 -20.560 1.00 0.00 C | |
| ATOM 585 CE LYS A 37 -3.993 9.273 -20.864 1.00 0.00 C | |
| ATOM 586 NZ LYS A 37 -5.085 8.277 -21.036 1.00 0.00 N | |
| ATOM 587 H LYS A 37 1.401 10.003 -22.283 1.00 0.00 H | |
| ATOM 588 HA LYS A 37 0.776 10.689 -19.438 1.00 0.00 H | |
| ATOM 589 1HB LYS A 37 -0.033 8.223 -21.017 1.00 0.00 H | |
| ATOM 590 2HB LYS A 37 -0.261 8.420 -19.285 1.00 0.00 H | |
| ATOM 591 1HG LYS A 37 -1.749 10.334 -19.675 1.00 0.00 H | |
| ATOM 592 2HG LYS A 37 -1.494 10.185 -21.420 1.00 0.00 H | |
| ATOM 593 1HD LYS A 37 -2.437 7.882 -21.343 1.00 0.00 H | |
| ATOM 594 2HD LYS A 37 -2.736 8.081 -19.609 1.00 0.00 H | |
| ATOM 595 1HE LYS A 37 -4.258 9.947 -20.051 1.00 0.00 H | |
| ATOM 596 2HE LYS A 37 -3.907 9.860 -21.779 1.00 0.00 H | |
| ATOM 597 1HZ LYS A 37 -5.951 8.756 -21.237 1.00 0.00 H | |
| ATOM 598 2HZ LYS A 37 -4.858 7.657 -21.802 1.00 0.00 H | |
| ATOM 599 3HZ LYS A 37 -5.187 7.739 -20.188 1.00 0.00 H | |
| ATOM 600 N TYR A 38 2.446 9.050 -18.446 1.00 0.00 N | |
| ATOM 601 CA TYR A 38 3.617 8.368 -17.907 1.00 0.00 C | |
| ATOM 602 C TYR A 38 3.217 7.290 -16.907 1.00 0.00 C | |
| ATOM 603 O TYR A 38 2.215 7.426 -16.204 1.00 0.00 O | |
| ATOM 604 CB TYR A 38 4.566 9.374 -17.252 1.00 0.00 C | |
| ATOM 605 CG TYR A 38 4.991 10.500 -18.168 1.00 0.00 C | |
| ATOM 606 CD1 TYR A 38 4.212 11.643 -18.269 1.00 0.00 C | |
| ATOM 607 CD2 TYR A 38 6.159 10.389 -18.908 1.00 0.00 C | |
| ATOM 608 CE1 TYR A 38 4.600 12.672 -19.106 1.00 0.00 C | |
| ATOM 609 CE2 TYR A 38 6.547 11.417 -19.745 1.00 0.00 C | |
| ATOM 610 CZ TYR A 38 5.772 12.555 -19.845 1.00 0.00 C | |
| ATOM 611 OH TYR A 38 6.158 13.579 -20.679 1.00 0.00 O | |
| ATOM 612 H TYR A 38 1.763 9.433 -17.810 1.00 0.00 H | |
| ATOM 613 HA TYR A 38 4.155 7.898 -18.732 1.00 0.00 H | |
| ATOM 614 1HB TYR A 38 4.085 9.811 -16.376 1.00 0.00 H | |
| ATOM 615 2HB TYR A 38 5.463 8.858 -16.909 1.00 0.00 H | |
| ATOM 616 HD1 TYR A 38 3.294 11.731 -17.688 1.00 0.00 H | |
| ATOM 617 HD2 TYR A 38 6.770 9.490 -18.829 1.00 0.00 H | |
| ATOM 618 HE1 TYR A 38 3.988 13.570 -19.185 1.00 0.00 H | |
| ATOM 619 HE2 TYR A 38 7.464 11.330 -20.327 1.00 0.00 H | |
| ATOM 620 HH TYR A 38 6.983 13.345 -21.111 1.00 0.00 H | |
| ATOM 621 N THR A 39 4.004 6.222 -16.849 1.00 0.00 N | |
| ATOM 622 CA THR A 39 3.730 5.117 -15.939 1.00 0.00 C | |
| ATOM 623 C THR A 39 4.976 4.726 -15.155 1.00 0.00 C | |
| ATOM 624 O THR A 39 6.052 4.552 -15.729 1.00 0.00 O | |
| ATOM 625 CB THR A 39 3.192 3.892 -16.701 1.00 0.00 C | |
| ATOM 626 OG1 THR A 39 1.980 4.243 -17.380 1.00 0.00 O | |
| ATOM 627 CG2 THR A 39 2.918 2.745 -15.741 1.00 0.00 C | |
| ATOM 628 H THR A 39 4.814 6.175 -17.451 1.00 0.00 H | |
| ATOM 629 HA THR A 39 2.959 5.432 -15.234 1.00 0.00 H | |
| ATOM 630 HB THR A 39 3.927 3.572 -17.440 1.00 0.00 H | |
| ATOM 631 HG1 THR A 39 1.436 4.786 -16.804 1.00 0.00 H | |
| ATOM 632 1HG2 THR A 39 2.539 1.888 -16.297 1.00 0.00 H | |
| ATOM 633 2HG2 THR A 39 3.840 2.468 -15.231 1.00 0.00 H | |
| ATOM 634 3HG2 THR A 39 2.177 3.056 -15.006 1.00 0.00 H | |
| ATOM 635 N LEU A 40 4.826 4.586 -13.844 1.00 0.00 N | |
| ATOM 636 CA LEU A 40 5.920 4.140 -12.990 1.00 0.00 C | |
| ATOM 637 C LEU A 40 5.457 3.064 -12.018 1.00 0.00 C | |
| ATOM 638 O LEU A 40 4.579 3.299 -11.185 1.00 0.00 O | |
| ATOM 639 CB LEU A 40 6.502 5.326 -12.210 1.00 0.00 C | |
| ATOM 640 CG LEU A 40 7.601 4.981 -11.196 1.00 0.00 C | |
| ATOM 641 CD1 LEU A 40 8.811 4.419 -11.930 1.00 0.00 C | |
| ATOM 642 CD2 LEU A 40 7.971 6.226 -10.405 1.00 0.00 C | |
| ATOM 643 H LEU A 40 3.929 4.795 -13.426 1.00 0.00 H | |
| ATOM 644 HA LEU A 40 6.705 3.725 -13.622 1.00 0.00 H | |
| ATOM 645 1HB LEU A 40 6.919 6.038 -12.920 1.00 0.00 H | |
| ATOM 646 2HB LEU A 40 5.693 5.815 -11.667 1.00 0.00 H | |
| ATOM 647 HG LEU A 40 7.238 4.212 -10.514 1.00 0.00 H | |
| ATOM 648 1HD1 LEU A 40 9.592 4.173 -11.210 1.00 0.00 H | |
| ATOM 649 2HD1 LEU A 40 8.522 3.518 -12.472 1.00 0.00 H | |
| ATOM 650 3HD1 LEU A 40 9.187 5.161 -12.634 1.00 0.00 H | |
| ATOM 651 1HD2 LEU A 40 8.752 5.981 -9.684 1.00 0.00 H | |
| ATOM 652 2HD2 LEU A 40 8.336 6.995 -11.086 1.00 0.00 H | |
| ATOM 653 3HD2 LEU A 40 7.093 6.596 -9.876 1.00 0.00 H | |
| ATOM 654 N CYS A 41 6.052 1.880 -12.125 1.00 0.00 N | |
| ATOM 655 CA CYS A 41 5.758 0.790 -11.203 1.00 0.00 C | |
| ATOM 656 C CYS A 41 7.003 0.371 -10.431 1.00 0.00 C | |
| ATOM 657 O CYS A 41 8.122 0.485 -10.928 1.00 0.00 O | |
| ATOM 658 OXT CYS A 41 6.897 -0.076 -9.322 1.00 0.00 O | |
| ATOM 659 CB CYS A 41 5.202 -0.418 -11.957 1.00 0.00 C | |
| ATOM 660 SG CYS A 41 3.634 -0.103 -12.802 1.00 0.00 S | |
| ATOM 661 H CYS A 41 6.724 1.733 -12.865 1.00 0.00 H | |
| ATOM 662 HA CYS A 41 5.004 1.128 -10.495 1.00 0.00 H | |
| ATOM 663 1HB CYS A 41 5.927 -0.747 -12.702 1.00 0.00 H | |
| ATOM 664 2HB CYS A 41 5.050 -1.243 -11.261 1.00 0.00 H | |
| TER | |
| # All scores below are weighted scores, not raw scores. | |
| #BEGIN_POSE_ENERGIES_TABLE 0_input_0455_ss1_1_ss2_1_ss3_1_ss4_3_ss5_2_0001_0001.pdb | |
| label fa_atr fa_rep fa_sol fa_intra_rep fa_elec pro_close hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 rama omega fa_dun p_aa_pp ref total | |
| weights 0.8 0.44 0.75 0.004 0.7 1 1.17 1.17 1.17 1.1 1 0.2 0.5 0.56 0.32 1 NA | |
| pose -144.556 12.9793 92.1052 0.28115 -27.7965 0 -10.0105 -9.88761 -1.91011 -6.55169 -2.8327 -4.12158 2.62365 39.6109 -5.16238 -8.6302 -73.859 | |
| SER:NtermProteinFull_1 -3.45004 0.32144 3.49522 0.00253 -1.41501 0 0 0 -0.50098 -0.80204 0 0 0.01198 0.2957 0 0.17658 -1.86461 | |
| GLN_2 -3.35524 0.30814 2.34015 0.00752 -0.26433 0 0 0 0 -0.1048 0 -0.21023 3e-05 2.06765 -0.12089 -1.17797 -0.50995 | |
| GLU_3 -3.33035 0.3023 2.5554 0.00508 -0.95553 0 0 0 0 -0.25751 0 -0.25566 0.27263 2.39892 -0.15107 -1.55374 -0.96952 | |
| THR_4 -4.97297 0.41851 3.29403 0.00927 -0.36091 0 0 0 -0.18132 -0.46289 0 -0.05934 0.10761 0.06848 0.10446 0.16454 -1.87053 | |
| ARG_5 -5.53052 0.50928 4.38738 0.00779 -1.54445 0 0 0 0 -0.37512 0 -0.17654 0.09271 1.28272 -0.07896 -0.14916 -1.57488 | |
| LYS_6 -4.4181 0.37885 3.16091 0.00317 -1.04785 0 0 0 0 -0.25751 0 -0.17632 0.01992 0.92193 -0.04566 -0.28737 -1.74804 | |
| LYS_7 -4.50389 0.41453 2.75046 0.00311 -1.28895 0 0 0 -0.19358 0 0 -0.1482 0.05752 0.98422 -0.0368 -0.28737 -2.24894 | |
| CYD_8 -4.26295 0.43165 2.2797 0.0017 -0.16162 0 0 0 0 0 -0.4293 -0.19353 0.32099 0.75999 0.08341 0.35499 -0.81499 | |
| THR_9 -3.78412 0.34665 2.7568 0.01017 -0.62432 0 0 0 0 0 0 -0.02628 0.00468 0.04715 0.074 0.16454 -1.03073 | |
| GLU_10 -4.23757 0.27275 2.94733 0.00511 -1.20154 0 0 0 0 -0.27551 0 -0.2485 0.13674 2.33353 -0.16504 -1.55374 -1.98643 | |
| MET_11 -5.3939 0.44401 2.00472 0.00392 -0.17243 0 0 0 0 0 0 -0.15291 0.19206 0.8418 -0.14512 0.15868 -2.21918 | |
| LYS_12 -4.98778 0.5564 3.24679 0.00823 -0.51901 0 0 0 0 0 0 -0.21827 0.18806 1.65107 -0.03739 -0.28737 -0.39929 | |
| LYS_13 -3.90176 0.28133 2.58847 0.00311 -0.93385 0 0 0 0 -0.27551 0 -0.18734 0.02503 0.85808 -0.04979 -0.28737 -1.87961 | |
| LYS_14 -3.16377 0.17319 1.38509 0.0031 -0.10136 0 0 0 0 0 0 -0.19873 0.11928 0.78188 -0.03223 -0.28737 -1.32091 | |
| PHE_15 -6.35788 0.62484 2.20017 0.02525 -0.23055 0 0 0 0 0 0 -0.02728 0.14689 1.39266 -0.38479 0.43057 -2.18011 | |
| LYS_16 -2.84327 0.33429 1.90209 0.00317 -0.22543 0 0 0 0 0 0 -0.27858 0.08766 0.6877 -0.03949 -0.28737 -0.65924 | |
| ASN_17 -1.08761 0.24098 0.82267 0.00393 0.04778 0 0 0 0 0 0 -0.28003 0.00564 1.41486 -0.37453 -0.94198 -0.14829 | |
| CYD_18 -3.05984 0.35324 1.80547 0.00089 -0.20399 0 0 0 0 0 -0.49669 -0.09652 0.00508 0.12817 -0.18001 0.35499 -1.38921 | |
| GLU_19 -2.78016 0.23354 1.96572 0.00766 -0.68836 0 0 0 0 0 0 0.00041 0.09677 2.10219 0.00105 -1.55374 -0.6149 | |
| VAL_20 -3.29433 0.23719 0.85758 0.01241 -0.1215 0 0 0 0 0 0 -0.1887 0.00138 0.03453 -0.33419 0.74484 -2.0508 | |
| ARG_21 -3.9154 0.27382 3.18815 0.01305 -1.89662 0 0 0 0 -0.43712 0 -0.05119 0.00165 1.79447 0.03996 -0.14916 -1.13839 | |
| CYD_22 -1.57611 0.02301 0.87505 0.00225 -0.16302 0 0 0 0 0 -0.4293 0.06741 0.16981 0.66277 -0.09669 0.35499 -0.10983 | |
| ASP_23 -5.44507 0.49349 4.64801 0.01831 -2.42353 0 0 0 -0.18117 -0.75294 0 -0.14198 0.17618 1.48187 -0.42254 -1.28682 -3.8362 | |
| GLU_24 -4.46942 0.19873 3.80983 0.00397 -1.4141 0 0 0 -0.31966 -0.27032 0 -0.2446 0.00672 2.5029 -0.08915 -1.55374 -1.83885 | |
| SER_25 -2.07176 0.19533 1.90513 0.0027 -0.6388 0 0 0 0 -0.26117 0 -0.11952 0.16646 0.28916 -0.03184 0.17658 -0.38774 | |
| ASN_26 -3.2563 0.40036 2.53721 0.00295 -0.77821 0 0 0 -0.18117 -0.37747 0 -0.06832 0.00073 1.411 -0.05932 -0.94198 -1.31053 | |
| HIS_27 -3.93288 0.44401 2.87247 0.00444 -0.24323 0 0 0 0 -0.33915 0 -0.16049 0.00015 1.23866 -0.491 0.3575 -0.24952 | |
| CYD_28 -3.20541 0.23465 2.04528 0.00087 -0.11788 0 0 0 0 0 -0.49036 -0.02101 0.00416 0.60533 -0.18906 0.35499 -0.77844 | |
| VAL_29 -4.18271 0.54494 1.48258 0.01185 -0.31953 0 0 0 0 0 0 -0.20097 0.05054 0.17548 -0.40794 0.74484 -2.10092 | |
| GLU_30 -4.07078 0.33034 3.39934 0.00761 -2.60335 0 0 0 0 -0.81272 0 0.03585 0.0001 2.08301 0.10177 -1.55374 -3.08257 | |
| VAL_31 -4.78596 0.46274 1.39872 0.01229 -0.46116 0 0 0 0 0 0 -0.221 0.00227 0.05023 -0.37359 0.74484 -3.17061 | |
| ARG_32 -4.13673 0.2172 3.05326 0.00866 -1.75837 0 0 0 0 -0.4899 0 0.11676 0.00856 1.55609 0.10129 -0.14916 -1.47233 | |
| CYD_33 -2.75285 0.34582 1.67189 0.00087 0.02296 0 0 0 0 0 -0.49669 -0.01762 0.00203 0.14909 -0.15833 0.35499 -0.87783 | |
| SER_34 -0.907 0.04439 0.86908 0.00367 -0.20263 0 0 0 0 0 0 -0.29708 0.00021 0.11565 -0.12137 0.17658 -0.31849 | |
| ASP_35 -1.26332 0.22229 1.01507 0.00319 -0.12387 0 0 0 0 0 0 0.25305 0.00171 1.52759 -0.09056 -1.28682 0.25833 | |
| THR_36 -2.56431 0.25214 1.52184 0.01032 -0.49928 0 0 0 -0.07931 0 0 0.23604 0.00071 0.06344 -0.48602 0.16454 -1.3799 | |
| LYS_37 -2.26159 0.23731 1.21943 0.00327 -0.56804 0 0 0 -0.07931 0 0 -0.13334 0.00116 0.7992 -0.0228 -0.28737 -1.09209 | |
| TYR_38 -4.957 0.38037 1.70598 0.02524 -0.25586 0 0 0 0 0 0 -0.16394 0.00025 1.43754 -0.24277 0.1317 -1.93849 | |
| THR_39 -1.10126 0.12357 0.77452 0.00826 -0.10439 0 0 0 0 0 0 0.00188 0.06529 0.07581 -0.13743 0.16454 -0.12923 | |
| LEU_40 -3.19195 0.27367 1.54764 0.00925 -0.32377 0 0 0 0 0 0 0.13103 0.07231 0.21308 -0.07192 0.60233 -0.73833 | |
| CYD:CtermProteinFull_41 -1.79222 0.09798 1.81862 0.00101 -0.91058 0 0 0 -0.19358 0 -0.49036 0 0 0.32535 0 0.35499 -0.78879 |
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| #!/bin/bash | |
| tom_linsky/scripts/blueprint_from_pdb.py HEEE_2.2_02.pdb |
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| Traceback (most recent call last): | |
| File "tom_linsky/scripts/blueprint_from_pdb.py", line 14, in <module> | |
| print "Keys=", dssp.keys() | |
| AttributeError: 'tuple' object has no attribute 'keys' |
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