# Bonding information for index 112 -- 0MA_12@O6 LYS_8@H LYS_8@N # Index Sim # Frame Type Length Angle N-N dist ## Starting information for simulation # 1 ## Starting information for simulation # 2 112 2 172 2 2.98 2.2946 9.232 112 2 173 2 2.82 2.1959 9.610 112 2 174 2 2.90 2.2625 9.425 112 2 5864 2 2.87 2.6778 8.924 112 2 5869 2 2.94 2.5257 9.253 112 2 5873 2 2.96 2.9057 9.118 112 2 5877 2 2.89 2.4922 9.315 112 2 5878 2 2.88 2.5991 8.761 112 2 5879 2 2.92 2.4873 9.320 112 2 5881 2 2.87 2.5379 9.282 112 2 5882 2 2.68 2.4476 8.717 112 2 5885 2 2.91 2.5570 8.862 112 2 5888 2 2.95 2.8288 9.061 112 2 5889 2 2.84 2.5496 9.184 112 2 5890 2 2.87 3.0008 9.153 112 2 5898 2 2.99 2.9749 9.327 112 2 5903 2 2.90 2.5543 9.619 112 2 5925 2 2.97 2.4248 9.178 112 2 6756 2 2.99 2.7268 8.390 112 2 6759 2 2.87 2.4152 8.646 112 2 6762 2 2.73 2.7741 8.445 112 2 6765 2 2.89 2.4143 8.532 112 2 6812 2 2.90 2.9369 8.549 112 2 6818 2 2.80 3.0883 9.038 112 2 6819 2 2.74 2.7330 9.070 112 2 6820 2 2.81 2.8179 8.623 ## Starting information for simulation # 3 ## Starting information for simulation # 4 ## Starting information for simulation # 5 ## Starting information for simulation # 6 112 6 4077 2 2.82 1.8029 8.454 ## Starting information for simulation # 7 ## Starting information for simulation # 8 ## Starting information for simulation # 9 ## Starting information for simulation # 10 ## Starting information for simulation # 11 112 11 9313 2 2.89 2.4355 8.444 112 11 9314 2 2.87 2.9954 8.588 112 11 9315 2 2.86 2.8559 9.059 112 11 9321 2 2.88 2.7024 8.522 112 11 9323 2 2.86 2.9547 8.989 112 11 9325 2 2.81 2.8612 8.793 112 11 9326 2 2.73 2.8879 7.975 112 11 9328 2 2.83 2.4198 8.222 112 11 9329 2 2.85 2.5315 8.503 112 11 9336 2 2.94 2.8189 8.163 112 11 9340 2 2.84 2.4112 8.806 112 11 9344 2 2.84 2.6941 9.049 112 11 9345 2 2.95 2.8904 8.787 112 11 9346 2 2.99 2.8594 9.266 112 11 9350 2 2.77 2.7296 8.207 112 11 9351 2 2.94 2.9844 9.193 112 11 9352 2 2.92 3.0511 8.933 112 11 9354 2 2.98 2.6577 8.452 112 11 9356 2 2.79 2.9652 9.437 112 11 9358 2 2.85 2.7231 9.427 112 11 9359 2 2.74 2.5427 9.206 112 11 9360 2 2.99 2.9068 9.017 112 11 9365 2 2.99 2.8072 8.620 112 11 9366 2 2.92 2.8487 9.372 112 11 9369 2 2.93 2.9443 9.083 112 11 9370 2 2.90 2.9649 9.440 112 11 9371 2 2.94 2.5952 9.338 112 11 9373 2 2.97 2.8255 9.165 112 11 9380 2 2.97 2.8352 8.991 112 11 9382 2 2.95 2.7918 9.231 112 11 9386 2 2.99 2.7200 8.864 112 11 9388 2 2.89 2.6692 8.675 112 11 9390 2 2.94 2.6930 8.492 112 11 9392 2 2.96 2.9196 9.065 112 11 9394 2 2.96 2.8355 9.195 112 11 9395 2 2.92 2.8039 8.936 112 11 9396 2 2.90 2.8995 9.300 112 11 9397 2 2.94 2.7743 9.503 112 11 9400 2 2.88 2.8624 9.129 112 11 9401 2 2.88 2.8687 9.509 112 11 9402 2 2.95 2.6229 9.495 112 11 9404 2 2.90 2.5564 8.505 112 11 9405 2 2.95 2.7316 8.849 112 11 9409 2 3.00 2.7867 9.372 112 11 9411 2 2.88 2.3939 9.217 112 11 9413 2 2.97 2.7005 9.190 112 11 9415 2 2.98 2.7555 8.809 112 11 9416 2 2.98 2.3840 9.114 112 11 9422 2 2.88 3.0935 9.338 112 11 9423 2 2.98 2.8797 9.325 112 11 9426 2 2.92 2.8128 9.303 112 11 9430 2 2.87 2.9435 9.362 112 11 9431 2 3.00 2.8319 9.132 112 11 9434 2 2.86 2.9163 8.967 112 11 9435 2 2.91 3.0122 9.163 112 11 9439 2 2.90 2.8134 8.770 112 11 9442 2 2.95 2.4226 9.352 112 11 9443 2 2.95 2.6349 9.493 112 11 9445 2 2.86 2.8730 8.649 112 11 9446 2 2.83 2.9154 9.019 112 11 9449 2 2.93 2.7919 8.071 112 11 9456 2 2.96 2.7295 9.355 112 11 9458 2 2.86 2.6890 9.258 112 11 9459 2 2.80 2.8125 9.218 112 11 9464 2 2.99 2.8381 8.735 112 11 9465 2 2.78 2.7905 9.262 112 11 9469 2 2.90 3.0125 8.977 112 11 9471 2 2.88 2.7941 8.615 112 11 9475 2 2.99 2.8476 8.821 112 11 9476 2 2.92 2.9984 8.553 112 11 9480 2 2.98 2.8735 9.222 112 11 9481 2 2.92 2.5579 8.962 112 11 9485 2 2.95 3.0332 8.925 112 11 9491 2 2.78 2.9584 9.025 112 11 9498 2 3.00 2.7189 9.361 112 11 9502 2 2.86 2.5488 8.448 112 11 9503 2 2.98 2.6226 8.638 112 11 9506 2 2.92 2.6915 9.319 112 11 9507 2 2.77 2.7783 9.290 112 11 9509 2 2.79 2.7624 8.849 112 11 9511 2 2.85 2.8703 9.138 112 11 9513 2 2.91 2.7443 9.225 112 11 9515 2 2.87 2.8794 9.160 112 11 9516 2 2.91 2.8144 9.377 112 11 9517 2 2.87 2.3472 8.951 112 11 9519 2 2.93 2.6369 8.830 112 11 9521 2 2.92 2.7457 8.999 112 11 9522 2 2.91 2.8445 8.907 112 11 9523 2 2.89 2.2859 8.664 112 11 9524 2 2.94 2.8608 9.085 112 11 9528 2 2.95 2.8281 9.260 112 11 9530 2 2.84 2.9159 9.184 112 11 9532 2 2.89 2.9977 8.715 112 11 9533 2 2.83 2.9810 8.815 112 11 9534 2 2.86 2.9416 9.202 112 11 9535 2 2.85 2.9462 8.757 112 11 9541 2 2.94 2.6523 8.653 112 11 9543 2 2.96 2.6415 8.455 112 11 9547 2 2.92 2.8790 8.647 112 11 9549 2 2.91 2.9287 8.971 112 11 9551 2 2.82 2.8377 8.678 112 11 9553 2 2.89 2.9525 8.536 112 11 9554 2 2.83 3.0487 8.744 112 11 9556 2 2.82 2.8530 9.360 112 11 9557 2 2.78 2.7678 8.807 112 11 9558 2 2.80 2.9735 8.911 112 11 9559 2 2.98 2.5316 8.757 112 11 9560 2 2.99 3.0874 8.799 112 11 9562 2 2.79 2.9354 8.871 112 11 9563 2 2.87 3.0124 9.266 112 11 9564 2 2.84 2.6674 8.473 112 11 9567 2 2.81 2.9139 8.788 112 11 9570 2 2.96 3.0102 8.859 112 11 9575 2 2.87 2.7632 8.545 112 11 9577 2 2.92 2.9682 8.868 112 11 9578 2 2.95 2.9772 9.107 112 11 9579 2 2.97 2.9168 8.789 112 11 9581 2 2.98 2.7676 8.865 112 11 9585 2 2.80 3.0362 8.867 112 11 9587 2 2.92 2.7173 8.468 112 11 9588 2 2.94 2.7806 9.289 112 11 9589 2 2.95 2.7300 8.992 112 11 9590 2 2.79 3.0370 9.471 112 11 9591 2 2.99 2.9539 9.359 112 11 9592 2 2.93 2.7876 8.694 112 11 9594 2 2.90 2.8137 8.972 112 11 9597 2 2.79 2.9896 9.318 112 11 9598 2 2.88 2.7000 8.567 112 11 9602 2 2.95 2.8352 8.934 112 11 9604 2 2.88 3.0010 8.763 112 11 9605 2 2.90 2.7541 8.875 112 11 9606 2 2.88 2.7722 9.275 112 11 9615 2 2.98 3.0587 8.790 112 11 9616 2 2.89 2.8733 8.564 112 11 9617 2 2.95 2.9153 8.892 112 11 9618 2 2.97 2.6406 9.286 112 11 9620 2 2.92 2.9237 8.652 112 11 9622 2 2.81 2.8976 9.188 112 11 9629 2 2.96 2.6342 8.988 112 11 9630 2 2.82 3.0950 8.525 112 11 9631 2 2.88 2.9563 8.996 112 11 9632 2 3.00 2.7660 9.267 112 11 9633 2 2.92 2.8348 8.290 112 11 9634 2 2.89 2.6391 8.862 112 11 9639 2 2.93 2.5837 9.165 112 11 9640 2 2.93 2.3793 8.990 112 11 9641 2 2.94 2.7221 9.086 112 11 9642 2 2.97 2.3081 9.085 112 11 9643 2 2.94 2.7587 8.656 112 11 9644 2 2.96 2.9741 8.790 112 11 9645 2 2.82 3.0533 8.658 112 11 9646 2 2.96 3.0588 8.722 112 11 9654 2 2.89 2.9374 8.776 112 11 9655 2 2.81 2.9090 8.751 112 11 9656 2 2.86 2.8043 9.014 112 11 9657 2 2.92 2.6558 9.098 112 11 9659 2 2.81 2.7882 8.494 112 11 9660 2 2.93 2.8771 8.573 112 11 9661 2 2.98 3.0356 8.920 112 11 9662 2 2.91 2.7627 8.641 112 11 9664 2 2.84 2.9964 8.639 112 11 9665 2 2.85 2.9402 9.060 112 11 9666 2 2.87 2.5146 8.487 112 11 9668 2 2.83 2.4819 8.238 112 11 9671 2 2.91 2.6380 8.707 112 11 9672 2 2.91 2.5027 8.988 112 11 9674 2 2.73 2.6945 8.942 112 11 9675 2 2.95 2.6544 9.527 112 11 9679 2 2.91 2.9034 8.785 112 11 9681 2 2.72 2.8633 7.865 ## 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 # 26 112 26 238 2 2.95 2.4745 9.262 112 26 240 2 2.80 2.2491 8.923 112 26 248 2 2.86 3.0127 9.056 112 26 249 2 2.85 2.6619 8.843 112 26 252 2 2.90 2.8594 9.082 112 26 345 2 2.97 2.9147 8.830 112 26 352 2 2.86 2.9412 8.539 112 26 353 2 2.91 2.9144 8.525 112 26 354 2 2.88 2.9442 9.132 112 26 355 2 2.90 2.8180 8.491 112 26 357 2 2.86 2.7029 8.801 112 26 358 2 2.97 2.8517 8.466 112 26 359 2 2.94 2.6971 8.538 112 26 360 2 2.98 2.8379 8.450 112 26 364 2 2.88 2.9797 8.558 112 26 368 2 2.80 2.6713 8.928 112 26 555 2 2.92 3.0901 8.233 112 26 561 2 2.84 3.0487 8.589 112 26 562 2 2.91 2.9383 9.035 112 26 563 2 2.98 3.0423 9.077 112 26 572 2 2.99 2.4624 9.027 112 26 573 2 2.86 2.9069 9.105 112 26 576 2 2.95 2.7188 8.984 112 26 577 2 2.97 2.7350 8.715 112 26 579 2 2.95 2.9463 8.376 112 26 581 2 2.87 2.6526 8.953 112 26 582 2 2.92 2.6830 9.084 112 26 591 2 2.84 2.9628 9.150 112 26 597 2 2.91 2.2825 9.298 112 26 603 2 2.91 2.0305 9.126 112 26 628 2 2.92 2.9452 8.912 112 26 629 2 2.99 2.9902 8.698 112 26 630 2 2.84 2.9712 8.207 112 26 631 2 2.78 3.1038 8.461 112 26 636 2 2.95 2.8074 8.795 112 26 638 2 2.96 2.9839 8.694 112 26 640 2 2.88 2.8180 8.806 112 26 641 2 2.88 2.8607 9.290 112 26 643 2 2.83 2.8381 8.633 112 26 650 2 2.75 2.9832 8.687 112 26 655 2 2.75 2.7400 8.357 112 26 657 2 2.98 2.9942 8.727 112 26 659 2 2.97 2.7202 8.597 112 26 660 2 2.94 2.9809 8.560 112 26 665 2 2.87 2.8392 8.860 112 26 667 2 2.83 2.7034 8.674 112 26 670 2 2.96 2.8831 8.096 112 26 671 2 2.96 2.7310 8.166 112 26 672 2 2.92 3.0987 8.272 112 26 673 2 2.85 2.8692 9.017 112 26 675 2 2.95 2.9139 8.478 112 26 688 2 2.92 2.9057 9.190 112 26 691 2 2.94 2.7810 8.624 112 26 692 2 3.00 2.9294 9.057 112 26 693 2 2.93 2.6630 8.937 112 26 694 2 2.95 2.5972 9.487 112 26 695 2 2.90 2.6891 9.276 112 26 697 2 2.99 3.0329 8.745 112 26 700 2 2.95 2.9406 8.547 112 26 706 2 2.81 2.9205 8.924 112 26 707 2 2.94 2.7471 8.997 112 26 708 2 2.99 2.9370 8.699 112 26 709 2 2.98 3.0271 8.631 112 26 710 2 2.94 2.4358 8.224 112 26 712 2 2.97 2.4745 9.016 112 26 713 2 2.98 2.8032 9.382 112 26 714 2 3.00 2.8573 9.064 112 26 716 2 2.89 2.8823 9.229 112 26 718 2 2.98 2.7159 8.910 112 26 720 2 2.83 2.8643 8.966 112 26 721 2 2.71 2.7678 8.850 112 26 723 2 2.95 3.0786 8.789 112 26 736 2 2.98 2.9555 9.152 112 26 739 2 3.00 2.7567 9.248 112 26 740 2 2.74 2.9190 8.858 112 26 741 2 2.99 2.7492 9.256 112 26 903 2 2.92 2.5299 8.797 112 26 905 2 2.82 2.5957 8.661 112 26 943 2 2.97 2.9575 9.142 112 26 944 2 2.96 2.5131 8.599 112 26 1606 2 2.96 1.8453 7.036 112 26 2252 2 2.97 2.8702 7.814 112 26 2257 2 2.82 2.7952 7.994 ## 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 # 32 112 32 2486 2 2.84 2.8879 8.601 112 32 2491 2 2.94 3.0839 9.506 112 32 2492 2 2.99 2.9452 9.384 112 32 2496 2 2.97 2.9153 9.747 112 32 2498 2 2.76 3.0678 9.016 112 32 2499 2 2.91 3.0093 9.417 112 32 2500 2 2.90 2.5877 9.790 112 32 2501 2 2.99 2.8041 8.837 112 32 2503 2 2.96 2.4220 9.548 112 32 2505 2 2.87 2.9441 9.398 112 32 2506 2 2.94 2.1838 9.105 112 32 2508 2 2.97 2.9588 9.255 112 32 2510 2 2.84 2.6865 9.186 112 32 2514 2 2.84 3.0235 9.455 112 32 2516 2 2.99 2.6786 9.103 112 32 2519 2 2.95 3.0142 8.852 112 32 2520 2 2.80 2.8647 9.076 112 32 2525 2 3.00 3.0201 9.431 112 32 2526 2 2.87 2.7426 9.143 112 32 2528 2 2.95 2.7275 10.011 112 32 2529 2 2.95 2.6713 9.637 112 32 2531 2 2.97 2.6551 9.846 112 32 2532 2 2.95 2.3801 9.731 112 32 2537 2 2.99 2.7544 9.341 112 32 2539 2 2.94 2.2957 9.955 112 32 2545 2 2.96 2.6965 9.764 112 32 2548 2 2.84 2.7531 9.145 112 32 2555 2 2.85 2.1541 9.194 112 32 2557 2 2.94 2.5138 9.198 112 32 2572 2 2.94 2.5121 8.588 112 32 2573 2 2.89 3.0329 8.665 112 32 2575 2 2.83 2.7648 9.106 112 32 2578 2 2.94 2.5203 8.922 112 32 3208 2 2.90 2.3777 9.341 112 32 3219 2 2.97 2.6411 8.543 112 32 3222 2 2.85 2.7265 9.189 112 32 3226 2 2.94 2.6866 9.079 112 32 3228 2 2.97 2.4624 9.297 112 32 3240 2 2.93 2.8665 9.019 112 32 3242 2 2.97 2.8412 9.122 112 32 3243 2 2.83 2.5741 8.584 112 32 3244 2 2.96 2.9603 8.627 112 32 3246 2 2.94 2.8250 8.650 112 32 3248 2 2.93 2.7967 8.623 112 32 3253 2 2.90 2.7671 8.807 112 32 3259 2 2.94 2.9746 8.080 112 32 3260 2 2.81 2.5951 8.246 112 32 3263 2 2.79 2.5719 9.271 112 32 3264 2 2.99 2.9794 9.583 112 32 3266 2 2.88 2.9717 8.950 112 32 3267 2 2.91 3.0126 8.732 112 32 3272 2 2.88 3.0850 8.989 112 32 3285 2 2.85 2.8022 8.925 112 32 3286 2 2.87 2.7436 8.908 112 32 3287 2 2.96 2.8285 8.871 112 32 3288 2 2.94 2.7489 8.824 112 32 3289 2 2.94 2.9383 8.205 112 32 3291 2 2.99 3.0436 8.676 112 32 3293 2 2.85 2.7079 9.261 112 32 3295 2 2.98 2.7990 9.186 112 32 3296 2 2.88 3.1330 8.460 112 32 3298 2 2.90 2.7494 8.386 112 32 3300 2 3.00 2.8030 8.418 112 32 3301 2 2.95 2.3376 8.451 112 32 3302 2 2.87 2.3333 9.019 112 32 3304 2 2.97 2.4995 9.371 112 32 3306 2 2.95 2.8398 8.967 112 32 3309 2 2.94 2.5291 8.752 112 32 3311 2 2.86 2.7012 8.370 112 32 3313 2 2.91 2.6944 8.102 112 32 3314 2 2.99 3.0225 8.727 112 32 3317 2 2.85 3.0355 8.112 112 32 3318 2 2.90 2.6311 8.710 112 32 3319 2 2.97 2.7576 8.685 112 32 3321 2 2.92 2.9041 9.065 112 32 3322 2 2.91 2.5114 9.109 112 32 3324 2 3.00 2.8094 8.485 112 32 3325 2 2.90 3.0260 8.561 112 32 3326 2 2.87 2.7933 8.679 112 32 3331 2 2.83 2.9000 8.428 112 32 3332 2 2.91 2.8429 8.718 112 32 3335 2 2.97 2.8492 9.208 ## Starting information for simulation # 33 ## Starting information for simulation # 34 ## Starting information for simulation # 35 ## Starting information for simulation # 36 112 36 5511 2 2.84 2.7401 9.218 112 36 5520 2 2.82 2.3726 8.627 112 36 5530 2 2.89 2.1187 9.565 112 36 5533 2 2.87 2.9489 9.080 112 36 5535 2 3.00 2.8255 9.485 112 36 5538 2 2.99 2.7456 9.659 112 36 5541 2 2.97 2.8937 8.982 112 36 5545 2 2.91 2.5045 9.573 112 36 5547 2 2.74 2.2882 9.390 112 36 5941 2 2.87 2.5245 9.595 112 36 5943 2 2.97 2.8626 9.489 112 36 5946 2 2.97 2.7473 8.916 112 36 5948 2 2.88 2.4605 8.925 112 36 5950 2 2.98 2.6153 9.168 112 36 5953 2 2.95 2.5668 9.118 112 36 5956 2 2.92 2.5569 9.126 112 36 5959 2 2.83 2.2988 9.094 112 36 5965 2 2.92 2.3570 8.400 112 36 5966 2 2.98 2.6440 8.871 112 36 5967 2 2.96 2.4371 9.241 112 36 5976 2 2.98 2.5771 9.093 112 36 5977 2 2.94 2.5741 9.063 112 36 5980 2 2.89 2.7600 8.982 112 36 5986 2 2.91 2.6122 8.998 112 36 5989 2 2.93 2.1889 9.002 112 36 5991 2 2.85 2.5226 8.790 112 36 5993 2 2.96 2.4802 9.374 112 36 5995 2 2.85 2.8453 8.547 112 36 5996 2 2.96 2.3202 8.855 112 36 5997 2 2.95 2.4510 9.260 112 36 6002 2 2.99 2.5980 9.143 112 36 6004 2 2.94 2.9582 9.030 112 36 6008 2 2.94 2.5398 9.285 112 36 6013 2 2.97 2.0685 9.252 112 36 6017 2 2.83 2.6372 8.703