# Bonding information for index 172 -- THR_5@OG1 THR_4@HG1 THR_4@OG1 # Index Sim # Frame Type Length Angle N-N dist ## Starting information for simulation # 1 172 1 1120 3 2.90 2.3822 8.404 172 1 1227 3 2.78 2.5295 10.842 172 1 1326 3 2.76 2.7481 8.512 172 1 1531 3 2.96 1.8877 9.938 172 1 6502 3 2.99 2.7055 11.075 172 1 6508 3 2.75 2.9119 11.412 172 1 6587 3 2.90 2.2763 10.776 172 1 6624 3 2.91 2.7967 10.412 172 1 6664 3 2.96 2.6063 9.396 172 1 6683 3 2.65 2.7985 10.289 172 1 6810 3 3.00 2.9241 11.458 172 1 6816 3 2.86 2.8804 11.663 172 1 6845 3 3.00 2.9662 11.816 ## Starting information for simulation # 2 ## Starting information for simulation # 3 ## Starting information for simulation # 4 ## Starting information for simulation # 5 172 5 2309 3 2.98 2.8705 10.086 172 5 2361 3 2.92 2.8689 9.646 172 5 2376 3 2.98 2.8229 9.960 172 5 2405 3 2.84 2.8899 10.813 172 5 2424 3 3.00 2.6536 11.001 172 5 2536 3 2.84 2.7870 11.556 172 5 2592 3 2.88 2.8171 11.690 172 5 2618 3 2.82 2.2325 12.173 172 5 2714 3 2.86 2.3262 11.314 172 5 2764 3 2.93 2.8487 12.301 172 5 3013 3 2.76 2.7164 9.665 172 5 3023 3 2.90 2.9177 9.758 172 5 3064 3 2.77 2.9889 10.773 172 5 3094 3 2.68 2.5447 9.873 172 5 3096 3 2.81 2.8187 10.056 172 5 3113 3 2.92 2.9076 10.588 172 5 3151 3 2.72 2.9366 10.610 172 5 3153 3 2.98 3.0946 10.728 172 5 3160 3 2.77 2.8801 10.222 172 5 3171 3 2.95 2.8682 10.379 172 5 3195 3 2.98 2.7859 9.776 172 5 3226 3 2.81 2.7482 10.292 172 5 3231 3 2.95 1.9595 10.003 172 5 3385 3 2.77 3.0724 9.561 172 5 3395 3 2.91 3.0015 10.758 172 5 3446 3 2.98 3.0298 10.226 172 5 3528 3 2.93 2.6043 10.641 172 5 3600 3 2.79 2.4415 9.444 172 5 3615 3 2.82 2.8358 10.065 172 5 3626 3 2.98 2.0922 10.249 172 5 3675 3 2.94 2.9104 9.648 172 5 3692 3 2.87 2.9643 9.649 172 5 3780 3 2.93 2.8835 9.745 172 5 3795 3 2.73 2.9775 10.131 172 5 3811 3 2.90 2.7790 10.549 172 5 3851 3 2.95 2.7012 10.347 172 5 3865 3 2.96 2.7417 10.731 172 5 3959 3 2.86 2.9978 10.506 172 5 4428 3 2.78 2.8950 10.943 172 5 4455 3 2.79 2.9477 10.717 172 5 4459 3 2.81 2.9864 10.565 172 5 4489 3 2.95 2.9662 11.513 172 5 4919 3 2.88 2.9579 11.225 172 5 7274 3 2.95 2.4892 10.564 172 5 7298 3 2.77 2.5845 10.455 172 5 7369 3 2.81 1.7719 11.330 172 5 7511 3 2.86 2.9296 10.614 172 5 7522 3 2.74 2.7111 10.266 172 5 7534 3 2.92 2.7989 10.981 172 5 7541 3 2.93 3.0038 10.924 172 5 7583 3 2.84 3.0061 11.829 172 5 7606 3 2.89 2.0537 12.017 172 5 7615 3 2.68 2.8879 11.556 172 5 7623 3 2.83 2.7272 11.629 172 5 7755 3 2.82 2.9329 11.812 172 5 7884 3 2.71 2.8407 11.668 172 5 7885 3 2.86 2.9337 11.198 172 5 8328 3 2.69 2.9057 9.534 172 5 8913 3 2.72 2.8152 12.500 172 5 8915 3 2.88 2.5503 12.092 172 5 8962 3 2.72 2.8431 11.505 ## Starting information for simulation # 6 ## Starting information for simulation # 7 172 7 956 3 2.93 3.0005 11.165 172 7 977 3 2.83 3.0690 11.353 172 7 1027 3 2.92 2.5753 12.168 172 7 1039 3 2.79 2.8534 12.105 ## Starting information for simulation # 8 172 8 1735 3 2.88 2.3520 9.417 172 8 2303 3 2.92 3.0082 7.961 ## Starting information for simulation # 9 172 9 417 3 3.00 2.6764 10.505 ## Starting information for simulation # 10 ## Starting information for simulation # 11 ## Starting information for simulation # 12 172 12 10662 3 3.00 2.7987 9.814 ## Starting information for simulation # 13 ## Starting information for simulation # 14 ## Starting information for simulation # 15 ## Starting information for simulation # 16 172 16 860 3 2.93 2.0896 7.666 172 16 900 3 2.94 2.8443 7.805 ## Starting information for simulation # 17 172 17 964 3 2.87 2.7892 11.346 172 17 973 3 2.94 2.3367 12.016 172 17 985 3 2.86 2.3760 12.419 ## Starting information for simulation # 18 ## Starting information for simulation # 19 ## Starting information for simulation # 20 172 20 8468 3 2.80 2.6041 7.232 172 20 8469 3 2.74 3.0356 7.589 172 20 8558 3 2.89 1.8315 4.959 ## Starting information for simulation # 21 ## Starting information for simulation # 22 172 22 5238 3 2.87 2.7281 12.111 172 22 7857 3 2.90 2.9430 10.695 172 22 7887 3 2.87 2.3829 12.073 172 22 7900 3 2.83 2.9797 12.163 172 22 7994 3 2.75 2.7344 11.489 172 22 9183 3 2.81 2.9252 11.778 172 22 9184 3 2.93 2.6285 11.467 172 22 9321 3 2.66 2.7088 11.271 172 22 9333 3 2.69 2.6471 11.149 172 22 9351 3 2.94 2.9892 11.405 172 22 9577 3 2.73 2.8748 11.369 172 22 9624 3 2.97 2.6932 11.334 172 22 9694 3 2.93 2.9264 11.492 172 22 9766 3 2.78 2.9436 11.167 172 22 9779 3 2.80 2.9050 9.942 172 22 9785 3 2.85 2.8683 10.545 172 22 9828 3 2.98 2.8971 11.744 172 22 9851 3 2.99 3.0102 11.209 172 22 9876 3 2.71 2.7014 11.538 172 22 9914 3 2.78 2.7076 11.586 172 22 9955 3 2.65 2.8247 11.578 172 22 9985 3 2.93 2.8155 10.553 172 22 10075 3 2.99 2.7956 11.645 172 22 10208 3 2.96 2.4572 9.625 172 22 10218 3 2.78 2.5604 9.518 172 22 10282 3 2.79 2.8755 9.625 172 22 10307 3 2.75 2.9739 9.565 172 22 10339 3 2.83 2.7458 9.380 172 22 10359 3 2.99 2.8624 8.960 172 22 10371 3 2.78 2.8576 9.509 172 22 10396 3 2.80 2.9987 10.097 172 22 10408 3 2.61 3.0607 9.887 172 22 10411 3 2.93 2.8589 10.495 172 22 10478 3 2.92 2.6535 10.879 172 22 10480 3 2.79 2.7028 11.208 172 22 10483 3 2.83 2.9975 11.449 172 22 10513 3 2.97 2.8203 11.807 172 22 10570 3 2.86 2.9641 10.959 172 22 10573 3 2.73 3.0013 9.348 ## Starting information for simulation # 23 ## Starting information for simulation # 24 172 24 3456 3 2.98 2.0272 5.215 ## Starting information for simulation # 25 ## Starting information for simulation # 26 ## Starting information for simulation # 27 ## Starting information for simulation # 28 172 28 9853 3 2.88 3.0544 8.837 172 28 9854 3 2.99 2.6995 9.120 172 28 9900 3 2.98 2.9971 11.123 172 28 10319 3 2.85 3.0232 8.968 172 28 10815 3 2.94 2.8685 8.173 ## Starting information for simulation # 29 ## Starting information for simulation # 30 ## Starting information for simulation # 31 ## Starting information for simulation # 32 172 32 347 3 2.83 2.9923 8.598 172 32 665 3 2.74 2.7200 10.573 ## Starting information for simulation # 33 ## Starting information for simulation # 34 ## Starting information for simulation # 35 ## Starting information for simulation # 36 ## Starting information for simulation # 37 172 37 1131 3 2.68 2.3311 7.455 172 37 5689 3 2.77 3.0441 9.511 172 37 5697 3 2.77 3.0336 9.383 172 37 5711 3 2.89 2.4102 9.166 172 37 7209 3 2.79 2.7547 10.337 172 37 7210 3 2.90 2.7950 10.167 172 37 7226 3 2.82 2.9203 9.863 172 37 7241 3 2.70 3.0224 9.469 172 37 7243 3 2.99 2.9363 9.581 172 37 7413 3 3.00 2.5121 9.251 172 37 7456 3 2.91 2.8771 10.165 172 37 7501 3 2.74 2.9493 9.969 172 37 7512 3 2.96 2.7106 9.494 172 37 7518 3 2.87 2.9760 9.804 172 37 7597 3 2.89 2.8935 10.770 172 37 7610 3 2.89 2.7873 9.543 172 37 7701 3 2.72 2.8445 9.244 172 37 7707 3 2.98 2.9835 9.087 172 37 7721 3 2.78 2.8862 8.887 172 37 7776 3 2.93 2.9821 9.562 172 37 7781 3 2.60 2.9156 9.974 172 37 7795 3 2.98 2.7248 9.736 172 37 7810 3 2.90 2.3881 9.563 172 37 8102 3 2.73 2.9793 10.018 172 37 8130 3 2.79 2.9069 9.986 172 37 8345 3 2.99 2.6359 9.565 172 37 8350 3 2.95 2.5074 9.618 172 37 8351 3 2.60 2.5670 10.149 172 37 8358 3 2.94 2.9537 10.051 172 37 8363 3 2.88 2.9125 9.736 172 37 8406 3 3.00 2.5645 9.285 172 37 8637 3 2.80 2.7000 9.665 172 37 8786 3 2.92 3.0175 9.346 172 37 9006 3 2.64 2.9275 9.632 172 37 9196 3 2.96 2.9451 9.396 172 37 9285 3 2.85 2.7322 9.693 172 37 9468 3 2.87 2.9465 9.448 172 37 9978 3 2.96 1.7642 11.554 172 37 10158 3 2.88 2.6912 11.388 172 37 10184 3 2.88 2.9266 10.553 172 37 10190 3 3.00 3.0001 11.814 ## Starting information for simulation # 38 172 38 2650 3 2.69 2.7906 9.290 172 38 3913 3 2.94 2.7501 9.141 172 38 3914 3 2.67 2.6630 9.296 172 38 7638 3 2.88 2.7248 9.056 172 38 7639 3 2.74 3.1186 8.396 172 38 7640 3 2.88 2.6719 8.375 172 38 7652 3 2.93 2.7375 9.202 172 38 7662 3 2.65 3.0355 8.148 172 38 7714 3 2.93 2.6805 8.063 172 38 7721 3 2.71 3.0577 8.908 172 38 7723 3 2.85 2.6194 8.691 172 38 7724 3 2.69 3.0343 8.564 172 38 7727 3 2.73 2.8102 8.571 172 38 7735 3 2.98 2.4040 9.322 172 38 7739 3 2.78 2.6214 7.959 172 38 8049 3 2.73 2.9029 9.890 172 38 8316 3 2.94 2.8824 9.755 172 38 8317 3 2.62 2.9449 9.990 172 38 8364 3 2.69 2.9117 9.832 172 38 8439 3 2.83 2.5512 9.856 172 38 8676 3 2.80 2.6626 9.534 172 38 8696 3 2.88 2.9032 9.622 172 38 8708 3 2.93 2.7557 9.399 172 38 8713 3 2.78 2.9067 9.542 172 38 8738 3 2.78 3.0078 9.740 172 38 8763 3 2.91 1.9428 9.866 172 38 8770 3 2.80 2.7851 9.436 172 38 8771 3 2.99 2.8750 9.668 172 38 8781 3 2.95 2.4965 9.379 ## Starting information for simulation # 39 ## Starting information for simulation # 40 172 40 5169 3 2.62 2.8215 9.956 ## Starting information for simulation # 41 172 41 53 3 3.00 2.8031 10.611 172 41 81 3 2.87 2.4545 9.669 172 41 91 3 2.87 2.6079 9.958 172 41 4705 3 3.00 2.3010 9.677 172 41 8658 3 2.64 2.7633 10.995 ## Starting information for simulation # 42 ## Starting information for simulation # 43 172 43 6727 3 2.96 1.7574 8.279 ## Starting information for simulation # 44 172 44 1424 3 2.67 2.7475 9.702 ## Starting information for simulation # 45 172 45 7479 3 2.56 2.5872 10.037 172 45 7491 3 2.78 2.6554 10.185 172 45 7516 3 2.99 2.2194 9.681 172 45 7517 3 2.66 3.0794 10.178 172 45 7518 3 2.73 2.7701 10.455 172 45 7519 3 2.94 2.5328 10.012 ## Starting information for simulation # 46 ## Starting information for simulation # 47 172 47 2034 3 2.88 1.9096 10.498 172 47 9240 3 2.79 2.3828 7.746 ## Starting information for simulation # 48 172 48 1120 3 2.90 2.3822 8.404 172 48 1227 3 2.78 2.5295 10.842 172 48 1389 3 2.70 2.9206 9.337 172 48 1394 3 2.75 2.8597 9.485 172 48 1408 3 2.94 2.8758 9.498 172 48 1436 3 2.76 2.9107 8.674 172 48 1440 3 2.94 2.8103 7.702 172 48 1441 3 2.71 2.8470 7.710 172 48 1519 3 2.98 2.7618 9.247 172 48 1701 3 2.81 2.9866 8.225 172 48 1704 3 2.77 2.9833 7.893 172 48 1866 3 2.81 3.1299 9.341 172 48 2441 3 2.93 2.9227 8.861 172 48 2447 3 2.78 3.0072 9.760 172 48 2603 3 2.93 2.7421 8.170 172 48 3197 3 2.70 2.3830 9.813 172 48 3223 3 2.93 2.9624 9.824 172 48 3569 3 2.96 2.9063 9.424 172 48 4232 3 2.99 2.9877 7.956 172 48 4241 3 2.91 3.0702 9.564 172 48 4260 3 2.97 3.1232 9.473 172 48 4373 3 2.82 2.8758 8.554 172 48 4540 3 2.54 2.7131 8.764 172 48 4769 3 2.80 2.4045 9.067 172 48 4775 3 2.73 3.0618 8.811 172 48 5962 3 2.85 2.7747 10.753 172 48 6344 3 2.99 2.1677 9.979