******************************************************************************* * * Library of 50 fragments, each 5 residues long * ******************************************************************************* ******************************************************************************* * REFERENCE ******************************************************************************* * * If you use this data in research, please cite: * * Rachel Kolodny, Patrice Koehl, Leonidas Guibas, Michael Levitt * Small Libraries of Protein Fragments Accurately Model Native Protein * Structures ******************************************************************************* ****************************************************************************** * Cluster number: 0 * Size (out of 1.0): 0.038193 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 17.532 28.566 27.632 15.956 31.675 29.167 14.185 32.430 25.881 12.464 29.042 25.912 10.923 29.760 29.308 ****************************************************************************** * Cluster number: 1 * Size (out of 1.0): 0.008694 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 18.076 28.418 27.569 17.529 32.132 28.107 14.028 32.575 26.768 12.540 29.103 27.212 8.887 29.245 28.244 ****************************************************************************** * Cluster number: 2 * Size (out of 1.0): 0.170626 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 17.165 28.443 27.787 15.896 31.782 29.113 14.154 32.544 25.826 12.557 29.090 25.810 11.288 29.614 29.365 ****************************************************************************** * Cluster number: 3 * Size (out of 1.0): 0.010868 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 19.147 29.392 27.895 15.803 30.696 29.036 14.364 31.770 25.837 11.294 29.506 25.744 10.451 30.108 29.389 ****************************************************************************** * Cluster number: 4 * Size (out of 1.0): 0.008539 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 20.177 30.689 28.412 16.731 29.158 27.866 14.315 31.598 26.201 10.994 29.743 26.140 8.842 30.285 29.281 ****************************************************************************** * Cluster number: 5 * Size (out of 1.0): 0.012731 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 18.025 28.753 27.359 16.038 31.434 29.209 14.155 32.332 26.006 12.476 28.898 26.179 10.367 30.057 29.147 ****************************************************************************** * Cluster number: 6 * Size (out of 1.0): 0.002639 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 16.826 28.791 29.924 16.677 30.692 26.586 13.713 32.973 25.876 11.486 31.221 28.430 12.358 27.796 27.084 ****************************************************************************** * Cluster number: 7 * Size (out of 1.0): 0.017389 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 18.842 28.656 27.258 17.978 32.357 27.753 14.230 31.988 27.582 11.748 29.272 28.406 8.262 29.200 26.902 ****************************************************************************** * Cluster number: 8 * Size (out of 1.0): 0.023754 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 20.512 30.209 27.555 16.891 30.887 28.560 13.888 28.946 27.289 11.032 30.950 25.734 8.738 30.481 28.761 ****************************************************************************** * Cluster number: 9 * Size (out of 1.0): 0.008694 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 18.464 28.901 27.688 15.930 31.274 29.214 14.207 32.132 25.923 11.819 29.129 25.791 10.639 30.037 29.285 ****************************************************************************** * Cluster number: 10 * Size (out of 1.0): 0.006210 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 19.998 30.017 28.271 16.276 30.336 28.907 14.310 30.581 25.701 10.523 30.713 25.691 9.953 29.825 29.330 ****************************************************************************** * Cluster number: 11 * Size (out of 1.0): 0.033069 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 20.678 29.411 28.036 17.600 31.621 27.771 14.219 30.037 27.075 10.636 31.176 26.590 7.927 29.228 28.428 ****************************************************************************** * Cluster number: 12 * Size (out of 1.0): 0.035243 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 20.858 30.110 28.163 17.541 30.593 26.332 14.332 30.631 28.416 10.931 30.123 26.815 7.398 30.015 28.173 ****************************************************************************** * Cluster number: 13 * Size (out of 1.0): 0.014749 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 19.576 28.988 27.899 17.420 32.136 28.131 14.494 30.444 26.386 10.949 31.409 27.374 8.620 28.497 28.110 ****************************************************************************** * Cluster number: 14 * Size (out of 1.0): 0.022823 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 20.470 29.494 28.250 17.537 31.561 26.916 14.175 30.062 28.024 10.876 30.853 26.263 8.003 29.502 28.448 ****************************************************************************** * Cluster number: 15 * Size (out of 1.0): 0.019873 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 17.863 28.570 27.400 16.804 31.915 28.863 14.256 32.450 26.106 12.575 29.064 26.583 9.562 29.473 28.948 ****************************************************************************** * Cluster number: 16 * Size (out of 1.0): 0.010247 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 20.223 30.054 28.057 16.452 30.080 28.583 14.606 31.117 25.442 10.922 30.629 26.415 8.856 29.593 29.403 ****************************************************************************** * Cluster number: 17 * Size (out of 1.0): 0.005279 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 18.228 29.661 29.619 17.119 30.357 26.045 14.137 32.402 27.264 11.602 29.932 25.802 9.975 29.120 29.170 ****************************************************************************** * Cluster number: 18 * Size (out of 1.0): 0.018631 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 20.245 29.387 28.248 17.254 31.100 26.582 13.949 31.219 28.457 11.324 29.599 26.228 8.287 30.169 28.386 ****************************************************************************** * Cluster number: 19 * Size (out of 1.0): 0.009160 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 17.792 28.274 28.126 17.407 32.057 27.863 14.016 32.873 26.414 12.520 29.393 26.762 9.325 28.876 28.736 ****************************************************************************** * Cluster number: 20 * Size (out of 1.0): 0.009471 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 17.761 29.518 30.370 16.819 30.198 26.770 14.025 32.564 25.780 10.610 30.980 26.328 11.845 28.213 28.652 ****************************************************************************** * Cluster number: 21 * Size (out of 1.0): 0.023754 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 20.600 29.772 28.319 17.371 30.237 26.374 14.254 31.944 27.714 11.248 29.659 27.270 7.588 29.860 28.224 ****************************************************************************** * Cluster number: 22 * Size (out of 1.0): 0.002795 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 16.607 29.102 29.410 17.680 31.283 26.502 14.358 33.091 26.530 12.300 29.856 26.443 10.115 28.140 29.015 ****************************************************************************** * Cluster number: 23 * Size (out of 1.0): 0.011644 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 18.011 28.613 27.193 17.176 31.998 28.708 14.241 32.368 26.340 12.608 29.094 27.246 9.023 29.401 28.413 ****************************************************************************** * Cluster number: 24 * Size (out of 1.0): 0.008073 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 19.831 29.496 26.685 17.386 31.411 28.857 14.309 30.797 26.660 11.330 30.109 28.930 8.204 29.659 26.769 ****************************************************************************** * Cluster number: 25 * Size (out of 1.0): 0.018165 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 16.733 28.384 28.279 16.241 32.114 28.886 14.391 32.584 25.594 12.154 29.532 25.735 11.541 28.858 29.407 ****************************************************************************** * Cluster number: 26 * Size (out of 1.0): 0.029343 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 17.881 29.257 30.156 16.511 30.233 26.767 13.866 32.898 26.118 11.107 30.297 25.695 11.696 28.788 29.164 ****************************************************************************** * Cluster number: 27 * Size (out of 1.0): 0.004813 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 17.115 28.460 28.222 17.188 32.254 28.424 14.461 32.642 25.811 12.221 29.604 26.221 10.075 28.514 29.222 ****************************************************************************** * Cluster number: 28 * Size (out of 1.0): 0.018010 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 18.886 30.269 29.601 16.036 29.164 27.321 14.200 32.148 25.785 10.849 30.365 25.749 11.089 29.527 29.445 ****************************************************************************** * Cluster number: 29 * Size (out of 1.0): 0.046887 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 20.910 29.875 27.811 17.451 31.099 27.015 14.139 30.064 28.429 10.944 30.188 26.418 7.617 30.248 28.226 ****************************************************************************** * Cluster number: 30 * Size (out of 1.0): 0.011334 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 19.134 28.788 28.422 17.257 32.141 28.232 14.405 30.852 25.944 10.769 31.455 26.831 9.496 28.237 28.471 ****************************************************************************** * Cluster number: 31 * Size (out of 1.0): 0.012731 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 19.454 28.823 27.420 17.770 32.143 28.208 14.457 31.341 26.493 11.282 30.506 28.401 8.097 28.661 27.378 ****************************************************************************** * Cluster number: 32 * Size (out of 1.0): 0.003881 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 17.433 28.362 28.078 16.835 32.070 28.666 13.905 32.552 26.258 12.332 29.116 25.773 10.555 29.373 29.124 ****************************************************************************** * Cluster number: 33 * Size (out of 1.0): 0.003105 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 18.964 28.823 27.224 17.028 31.701 28.882 14.311 32.140 26.263 12.026 29.114 26.814 8.732 29.695 28.717 ****************************************************************************** * Cluster number: 34 * Size (out of 1.0): 0.012420 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 16.525 28.440 28.592 17.282 32.080 27.831 14.086 32.303 25.739 12.014 30.996 28.644 11.152 27.654 27.094 ****************************************************************************** * Cluster number: 35 * Size (out of 1.0): 0.009160 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 18.354 28.548 28.162 17.816 32.129 26.946 14.048 32.205 27.535 11.348 30.069 29.091 9.494 28.522 26.166 ****************************************************************************** * Cluster number: 36 * Size (out of 1.0): 0.022046 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 18.863 28.672 28.402 17.621 32.221 27.830 14.369 31.243 26.138 10.946 31.381 27.772 9.261 27.956 27.759 ****************************************************************************** * Cluster number: 37 * Size (out of 1.0): 0.027791 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 20.498 29.545 27.991 17.169 31.368 28.264 14.164 29.790 26.583 10.729 31.416 26.370 8.499 29.354 28.693 ****************************************************************************** * Cluster number: 38 * Size (out of 1.0): 0.003726 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 19.165 29.195 27.407 16.436 31.242 29.084 14.595 31.805 25.807 11.651 29.501 26.364 9.212 29.730 29.238 ****************************************************************************** * Cluster number: 39 * Size (out of 1.0): 0.056047 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 17.293 28.467 27.897 15.832 31.748 29.116 14.241 32.534 25.716 12.328 29.197 25.738 11.366 29.526 29.433 ****************************************************************************** * Cluster number: 40 * Size (out of 1.0): 0.010868 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 19.434 29.620 28.918 17.104 30.324 25.986 14.233 32.258 27.675 11.654 29.710 26.493 8.635 29.561 28.828 ****************************************************************************** * Cluster number: 41 * Size (out of 1.0): 0.006986 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 16.660 28.455 28.926 16.970 32.156 28.252 14.271 32.722 25.830 11.763 29.741 25.668 11.396 28.399 29.223 ****************************************************************************** * Cluster number: 42 * Size (out of 1.0): 0.015060 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 19.573 29.929 29.292 16.434 29.507 27.182 14.441 32.218 25.444 11.050 30.841 26.485 9.562 28.978 29.498 ****************************************************************************** * Cluster number: 43 * Size (out of 1.0): 0.020959 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 20.381 30.843 28.427 17.054 29.127 27.727 14.035 30.176 25.711 11.177 31.868 27.540 8.414 29.459 28.496 ****************************************************************************** * Cluster number: 44 * Size (out of 1.0): 0.011644 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 18.008 28.584 28.624 17.945 32.208 27.341 14.299 32.021 26.347 11.258 30.947 28.335 9.550 27.712 27.251 ****************************************************************************** * Cluster number: 45 * Size (out of 1.0): 0.009626 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 17.224 28.267 27.861 17.418 32.063 27.676 13.782 32.620 26.645 12.523 29.986 29.146 10.112 28.537 26.571 ****************************************************************************** * Cluster number: 46 * Size (out of 1.0): 0.008539 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 18.600 29.510 29.262 17.303 30.574 25.854 14.401 32.540 27.349 11.735 29.917 26.477 9.022 28.932 28.958 ****************************************************************************** * Cluster number: 47 * Size (out of 1.0): 0.013041 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 19.532 30.375 28.550 15.866 29.308 28.326 14.323 31.681 25.758 10.984 29.868 25.772 10.355 30.241 29.495 ****************************************************************************** * Cluster number: 48 * Size (out of 1.0): 0.029499 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 20.724 29.688 27.220 17.312 31.382 27.363 14.034 30.291 28.958 11.174 29.266 26.639 7.816 30.846 27.719 ****************************************************************************** * Cluster number: 49 * Size (out of 1.0): 0.053408 * Centeroid fragment (coordinates of CA atoms): * X-coor Y-coor Z-coor ------ ------ ------ 17.053 28.388 27.956 16.013 31.914 29.043 14.222 32.586 25.741 12.424 29.222 25.746 11.348 29.364 29.414 ******************************************************************************