# Bonding information for index 580 -- LYS_9@O 0MA_13@H2O 0MA_13@O2 # Index Sim # Frame Type Length Angle N-N dist ## Starting information for simulation # 1 580 1 3382 2 2.73 3.0560 8.660 580 1 3383 2 2.91 2.7952 8.657 580 1 3385 2 2.97 2.9006 9.148 580 1 3388 2 2.63 2.8682 8.895 580 1 3389 2 2.96 2.6400 8.619 580 1 3390 2 2.67 2.7168 8.813 580 1 3391 2 2.86 2.7024 8.936 580 1 3392 2 2.88 2.9958 8.950 580 1 3393 2 2.88 3.0007 8.834 580 1 3394 2 2.74 2.7234 8.554 580 1 3395 2 2.86 2.8127 8.522 580 1 3396 2 2.68 2.5405 8.886 580 1 3397 2 2.75 2.7388 8.844 580 1 3398 2 2.84 2.9903 8.748 580 1 3400 2 2.66 2.9932 8.593 580 1 3402 2 2.94 2.4832 8.948 580 1 3403 2 2.87 2.9608 8.937 580 1 3405 2 2.87 3.1318 9.182 580 1 3406 2 2.66 2.7495 9.075 580 1 3407 2 2.93 2.8742 9.253 580 1 3409 2 2.72 2.2979 8.534 580 1 3411 2 2.85 2.6477 8.664 580 1 3412 2 2.64 2.8430 8.711 580 1 3413 2 2.96 2.9482 8.581 580 1 3414 2 2.86 2.6244 8.998 580 1 3415 2 2.77 2.7179 9.036 580 1 3416 2 2.75 2.9090 8.789 580 1 3417 2 2.75 3.0533 8.974 580 1 3418 2 2.77 2.9262 8.483 580 1 3419 2 2.94 2.7753 8.317 580 1 3420 2 2.87 2.6887 8.607 580 1 3421 2 2.80 2.5322 8.829 580 1 3422 2 2.85 2.8501 9.004 580 1 3424 2 2.72 2.8257 9.043 580 1 3425 2 2.79 2.9702 8.698 580 1 3426 2 2.61 3.0209 8.632 580 1 3447 2 2.74 2.6303 8.894 580 1 3449 2 2.75 2.9324 8.700 580 1 3452 2 2.87 2.8680 8.791 580 1 3453 2 2.77 2.7624 8.821 580 1 3454 2 2.89 3.0931 9.053 580 1 3455 2 2.73 2.6621 9.049 580 1 3457 2 2.71 2.8038 8.895 580 1 3461 2 2.49 2.9447 8.836 580 1 3462 2 2.73 2.8831 8.669 580 1 3463 2 2.84 2.6187 8.737 580 1 3465 2 2.67 2.7032 8.751 580 1 3467 2 2.58 2.7880 8.695 580 1 3469 2 2.86 2.7480 8.667 580 1 3471 2 2.82 2.8823 9.001 580 1 3472 2 2.87 3.0285 9.352 580 1 3473 2 2.72 2.7296 8.779 580 1 3474 2 2.90 2.6326 8.671 580 1 3475 2 2.85 2.8684 8.748 580 1 3477 2 2.77 2.6390 9.062 580 1 3478 2 2.64 2.8569 8.861 580 1 3479 2 2.81 2.8918 8.878 580 1 3483 2 2.83 2.9409 8.640 580 1 3484 2 2.66 2.7706 8.800 580 1 3485 2 2.73 2.7972 8.572 580 1 3486 2 2.88 2.9202 8.726 580 1 3487 2 2.67 2.5230 8.847 580 1 3488 2 2.91 2.5851 8.897 580 1 3489 2 2.66 3.0094 8.734 580 1 3490 2 2.68 2.7578 8.803 580 1 3491 2 2.65 2.6136 8.531 580 1 3493 2 2.83 2.8455 8.628 580 1 3494 2 2.90 2.9716 8.916 580 1 3495 2 2.99 3.0505 8.994 580 1 3497 2 2.81 2.9543 8.732 580 1 3499 2 2.64 2.8182 8.296 580 1 3500 2 2.71 3.0457 8.818 580 1 3501 2 2.60 3.0470 8.939 580 1 3502 2 2.67 3.0460 8.564 580 1 3505 2 2.68 2.8463 8.777 580 1 3506 2 2.70 2.9170 9.072 580 1 3508 2 2.53 2.8931 8.650 580 1 3511 2 2.76 2.6875 9.000 580 1 3512 2 2.78 2.6114 8.804 580 1 3513 2 2.84 3.0265 8.802 580 1 3514 2 2.84 2.8708 8.398 580 1 3515 2 2.86 3.0990 9.087 580 1 3516 2 2.91 2.5771 9.030 580 1 3517 2 2.83 2.8184 8.802 580 1 3518 2 2.75 2.4925 9.312 580 1 3519 2 2.77 2.8164 8.450 580 1 3521 2 2.72 2.3990 9.092 580 1 3525 2 2.76 2.8045 8.911 580 1 3526 2 2.66 2.8622 8.820 580 1 3528 2 2.77 2.9300 8.765 580 1 3529 2 2.94 2.9849 8.828 580 1 3530 2 2.63 2.7111 8.929 580 1 3531 2 2.49 3.0026 8.902 580 1 3532 2 2.94 2.9770 8.971 580 1 3533 2 2.77 2.7540 8.840 580 1 3534 2 2.76 2.4447 9.084 580 1 3535 2 2.93 2.2661 9.028 580 1 3536 2 2.89 2.7467 8.978 580 1 3537 2 2.60 2.9517 8.807 580 1 3538 2 2.71 3.1385 8.997 580 1 3539 2 2.87 2.8242 8.827 580 1 3541 2 2.88 2.8161 8.956 580 1 3542 2 2.92 2.6990 9.080 580 1 3543 2 2.52 2.8525 9.141 580 1 3549 2 2.71 2.3866 9.092 580 1 3550 2 2.83 2.5065 8.999 580 1 3551 2 2.59 2.6251 8.902 580 1 3553 2 2.95 2.5025 8.933 580 1 3556 2 2.87 2.6094 8.846 580 1 3559 2 2.88 2.7021 8.754 580 1 3561 2 2.83 2.5979 8.870 580 1 3562 2 2.79 2.9295 8.940 580 1 3563 2 2.78 2.9049 8.998 580 1 3564 2 2.93 2.9634 9.070 580 1 3565 2 2.83 2.9547 8.980 580 1 3566 2 2.83 2.7374 8.571 580 1 3567 2 2.73 3.0308 8.787 580 1 3568 2 2.87 2.9342 8.669 580 1 3569 2 2.63 2.9404 8.653 580 1 3570 2 2.78 2.8883 8.796 580 1 3574 2 2.94 2.9053 8.937 580 1 3579 2 2.85 2.6930 8.908 580 1 3580 2 2.63 2.8805 8.911 580 1 3581 2 2.90 3.0533 8.437 580 1 3582 2 2.58 3.0752 8.782 580 1 3583 2 2.64 2.7278 8.455 580 1 3584 2 2.79 2.5838 8.915 580 1 3586 2 2.76 2.6080 8.780 580 1 3587 2 2.70 2.8573 8.899 580 1 3588 2 2.64 2.4767 8.899 580 1 3589 2 2.86 2.9942 8.979 580 1 3590 2 2.64 2.6334 8.885 580 1 3591 2 2.73 3.0650 8.806 580 1 3592 2 2.74 2.7745 8.984 580 1 3593 2 2.83 2.7843 8.585 580 1 3594 2 2.61 3.0054 8.609 580 1 3595 2 2.97 3.0668 8.742 580 1 3597 2 2.76 2.9110 8.943 580 1 3598 2 2.83 2.8913 8.563 580 1 3599 2 2.61 2.9854 8.733 580 1 3600 2 2.73 2.6706 8.997 580 1 3601 2 2.73 2.7551 8.613 580 1 3603 2 2.61 2.9651 8.366 580 1 3606 2 2.93 2.9837 8.528 580 1 3607 2 2.71 2.7657 9.190 580 1 3611 2 2.99 2.7353 8.723 580 1 3614 2 2.56 2.9926 9.287 580 1 3795 2 2.88 1.8711 9.227 580 1 4244 2 2.79 1.7586 9.199 580 1 8082 2 2.93 2.7707 8.036 580 1 8127 2 2.86 2.7903 8.261 580 1 8128 2 2.76 2.6920 8.620 580 1 8129 2 2.55 2.8975 8.363 580 1 8130 2 2.72 2.9204 8.255 580 1 8131 2 2.66 3.0100 8.242 580 1 8132 2 2.80 2.9189 8.441 580 1 8133 2 2.99 3.0221 8.116 580 1 8134 2 2.77 2.6754 8.111 580 1 8138 2 2.89 2.9000 8.013 580 1 8140 2 2.76 2.7061 8.492 580 1 8145 2 2.81 2.7284 8.843 580 1 8146 2 2.75 2.7215 8.608 580 1 8147 2 2.61 2.7637 8.738 580 1 8148 2 2.76 2.8278 8.709 580 1 8149 2 2.72 2.9139 9.210 580 1 8150 2 2.88 2.7776 8.636 580 1 8151 2 2.85 2.7185 8.780 580 1 8193 2 2.64 2.7623 7.759 580 1 8195 2 2.92 2.7745 7.865 580 1 8196 2 2.63 2.9905 7.766 580 1 8202 2 2.65 2.8327 7.704 580 1 8203 2 2.86 2.9892 8.137 580 1 8205 2 2.89 2.7981 7.881 580 1 8206 2 2.71 2.8820 7.762 580 1 8207 2 2.80 2.8915 7.855 580 1 8208 2 2.77 2.9075 8.157 580 1 8209 2 2.89 2.6869 6.992 580 1 8210 2 2.77 3.0209 7.931 580 1 8220 2 2.61 3.0032 8.446 580 1 8225 2 2.84 2.4922 8.032 580 1 8234 2 2.81 2.7437 7.744 580 1 8238 2 2.69 3.0317 8.181 580 1 8731 2 2.91 2.9041 8.460 580 1 8733 2 2.88 2.0052 8.366 580 1 8761 2 2.54 3.0448 8.553 580 1 8762 2 2.76 2.9647 8.019 580 1 8763 2 2.99 2.7319 7.997 580 1 8764 2 2.83 3.0354 7.940 580 1 8765 2 2.67 2.9568 8.478 580 1 8767 2 2.97 2.8245 7.883 580 1 8768 2 2.92 3.0840 7.451 580 1 8770 2 2.78 2.9292 8.124 580 1 8794 2 2.92 2.9369 7.648 580 1 8795 2 2.77 2.6872 7.722 580 1 8796 2 2.79 3.0349 8.371 580 1 8797 2 2.74 2.4765 7.900 580 1 9040 2 2.75 3.0404 8.564 580 1 9041 2 2.86 2.4355 8.735 580 1 9043 2 2.52 2.1951 8.609 580 1 9044 2 2.83 2.6882 8.549 580 1 9045 2 2.78 2.4729 7.970 580 1 9046 2 2.77 2.8182 8.569 580 1 9048 2 2.80 2.8093 8.428 580 1 9049 2 2.71 2.9930 8.480 580 1 9050 2 2.61 2.7451 8.772 580 1 9062 2 2.84 2.3750 8.589 580 1 9063 2 2.57 2.9246 8.634 580 1 9064 2 2.77 2.4679 8.308 580 1 9065 2 2.96 2.8765 8.459 580 1 9067 2 2.70 2.7975 8.021 580 1 9069 2 2.73 2.5557 7.855 580 1 9070 2 2.66 2.9572 8.094 580 1 9071 2 2.90 2.7010 7.683 580 1 9075 2 2.59 2.6890 7.934 580 1 9087 2 2.55 2.8233 9.341 580 1 9088 2 2.95 2.3305 9.340 580 1 9106 2 2.80 2.6191 8.830 580 1 9107 2 2.74 3.0206 8.847 580 1 9108 2 2.79 3.0063 8.542 580 1 9434 2 2.64 2.6781 8.377 580 1 9460 2 2.93 2.6165 9.035 580 1 9461 2 2.81 2.9578 8.592 580 1 9479 2 2.63 3.0237 8.283 580 1 9480 2 2.70 2.6171 8.483 580 1 9481 2 2.90 2.8467 8.745 580 1 9514 2 2.88 2.8746 8.268 580 1 9520 2 2.70 2.7640 8.103 580 1 9521 2 2.81 2.9621 8.462 580 1 9522 2 2.69 2.8967 8.317 580 1 9531 2 2.75 2.9857 8.641 580 1 9534 2 2.88 2.7819 8.139 580 1 9673 2 2.72 2.7187 7.826 580 1 9692 2 2.83 2.8975 8.283 580 1 9693 2 2.95 2.5603 7.488 580 1 9770 2 2.68 2.7402 8.829 580 1 9772 2 2.86 2.7917 8.655 ## Starting information for simulation # 2 ## Starting information for simulation # 3 ## Starting information for simulation # 4 ## Starting information for simulation # 5 ## Starting information for simulation # 6 ## Starting information for simulation # 7 580 7 1387 2 2.78 2.4595 9.416 580 7 1441 2 2.93 2.4895 9.227 580 7 1443 2 2.88 2.1157 9.323 580 7 1458 2 2.97 2.1934 9.363 580 7 1475 2 2.78 1.7489 9.586 580 7 1476 2 2.82 1.8734 9.442 580 7 1544 2 2.92 2.4570 9.710 ## Starting information for simulation # 8 ## Starting information for simulation # 9 ## Starting information for simulation # 10 ## Starting information for simulation # 11 ## Starting information for simulation # 12 ## Starting information for simulation # 13 ## Starting information for simulation # 14 ## Starting information for simulation # 15 ## Starting information for simulation # 16 ## Starting information for simulation # 17 ## Starting information for simulation # 18 ## Starting information for simulation # 19 ## Starting information for simulation # 20 ## Starting information for simulation # 21 ## Starting information for simulation # 22 ## Starting information for simulation # 23 ## Starting information for simulation # 24 ## Starting information for simulation # 25 ## Starting information for simulation # 26 ## Starting information for simulation # 27 ## Starting information for simulation # 28 ## Starting information for simulation # 29 ## Starting information for simulation # 30 ## Starting information for simulation # 31 ## Starting information for simulation # 32 ## Starting information for simulation # 33 ## Starting information for simulation # 34 ## Starting information for simulation # 35 ## Starting information for simulation # 36