# Bonding information for index 128 -- THR_4@OG1 LYS_9@H LYS_9@N # Index Sim # Frame Type Length Angle N-N dist ## Starting information for simulation # 1 ## 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 ## Starting information for simulation # 8 ## Starting information for simulation # 9 ## Starting information for simulation # 10 ## Starting information for simulation # 11 ## Starting information for simulation # 12 128 12 1699 3 2.95 2.4352 4.945 128 12 1704 3 2.87 2.8799 4.429 128 12 1709 3 3.00 2.6088 5.571 128 12 1717 3 2.83 2.9546 4.475 128 12 1724 3 2.93 2.5168 4.991 128 12 1746 3 2.79 2.8188 4.842 128 12 1748 3 2.97 2.7848 4.789 128 12 1754 3 2.97 2.8427 5.109 128 12 1755 3 2.72 2.7628 4.944 128 12 1758 3 2.84 2.8005 5.473 128 12 1762 3 2.93 2.7025 5.344 128 12 1766 3 2.87 2.6159 5.333 128 12 1776 3 2.98 2.1346 4.989 128 12 1785 3 2.85 2.6412 3.892 128 12 1791 3 2.83 2.7911 4.867 128 12 1799 3 2.95 2.7425 5.055 128 12 1801 3 2.92 2.8345 4.870 128 12 1802 3 2.86 2.5178 4.485 128 12 1807 3 2.85 3.0308 4.808 128 12 1808 3 2.98 2.2482 4.843 128 12 1811 3 2.97 2.7390 4.971 128 12 1812 3 2.89 2.5382 5.082 128 12 1817 3 2.94 2.9900 5.140 128 12 1819 3 2.88 2.8786 5.059 128 12 1821 3 3.00 2.6519 4.571 128 12 1822 3 2.98 3.0298 5.001 128 12 1823 3 2.93 2.9339 5.028 128 12 1828 3 2.98 2.6060 4.860 128 12 1829 3 2.89 2.4566 5.418 128 12 1830 3 2.94 2.7548 4.811 128 12 1831 3 2.88 2.8430 4.973 128 12 1832 3 2.99 2.8379 5.138 128 12 1844 3 2.73 2.9253 4.923 128 12 1848 3 2.95 2.4048 5.056 128 12 1862 3 2.99 2.7556 5.270 128 12 1863 3 2.94 2.9615 5.009 128 12 1868 3 2.88 2.9764 5.360 128 12 1871 3 2.85 2.5713 5.299 128 12 1873 3 2.97 2.9228 5.138 128 12 1876 3 2.93 2.5987 4.677 128 12 1891 3 2.96 2.9289 5.039 128 12 1892 3 2.85 2.5570 4.890 128 12 1893 3 2.76 2.4108 5.170 128 12 1894 3 2.90 2.8628 5.288 128 12 1898 3 2.87 2.5741 4.945 128 12 1905 3 2.99 2.2430 4.606 128 12 1912 3 2.76 2.3286 4.213 128 12 1913 3 2.90 2.5427 4.570 128 12 1915 3 2.88 2.7978 5.228 128 12 1916 3 2.86 2.8917 5.614 128 12 1919 3 2.85 2.8128 5.786 128 12 1922 3 2.98 2.7183 5.326 128 12 1923 3 2.92 2.6542 5.058 128 12 1929 3 2.88 2.7257 4.915 128 12 1930 3 2.96 2.5152 4.940 128 12 1932 3 2.92 2.4481 5.030 128 12 1933 3 2.77 3.1079 5.289 128 12 1934 3 3.00 2.7025 5.496 128 12 1935 3 2.93 2.2081 4.734 128 12 1937 3 2.97 2.8376 5.166 128 12 1939 3 2.97 2.6279 4.999 128 12 1942 3 2.90 2.6812 4.687 128 12 1949 3 2.80 2.8715 5.520 128 12 1954 3 2.86 2.8413 4.608 128 12 1955 3 2.94 2.4863 4.602 128 12 1956 3 2.91 2.7930 4.454 128 12 1959 3 3.00 2.7622 5.013 128 12 1963 3 2.92 2.7072 4.712 128 12 1976 3 2.96 2.7579 5.162 128 12 1990 3 2.98 2.7596 4.812 128 12 1994 3 2.95 2.9804 4.972 128 12 2010 3 2.91 3.0338 4.940 128 12 2022 3 2.89 2.4441 4.523 128 12 2042 3 2.95 2.7542 5.065 128 12 2046 3 2.80 2.3024 4.774 128 12 2057 3 2.81 2.6925 5.537 128 12 2059 3 2.97 2.9434 5.121 128 12 2060 3 2.84 2.3697 5.269 128 12 2067 3 2.91 2.8783 4.381 128 12 2078 3 2.94 2.9874 4.151 128 12 2079 3 2.79 2.9950 4.256 128 12 2083 3 2.97 2.8103 4.780 128 12 2084 3 2.91 2.7941 5.211 128 12 2086 3 2.89 2.9538 4.907 128 12 2087 3 2.84 2.3634 4.734 128 12 2090 3 2.83 2.4679 5.370 128 12 2095 3 2.87 2.4735 5.533 128 12 2114 3 2.91 2.4932 4.773 128 12 2116 3 2.86 2.7904 4.948 128 12 2135 3 2.95 2.6782 5.185 128 12 2148 3 2.88 2.8287 5.210 128 12 2149 3 2.89 2.4451 4.691 128 12 2151 3 2.87 2.9440 5.327 128 12 2164 3 2.93 2.8309 5.435 ## Starting information for simulation # 13 ## Starting information for simulation # 14 128 14 10826 3 2.95 2.3684 7.153 ## Starting information for simulation # 15 ## Starting information for simulation # 16 ## Starting information for simulation # 17 128 17 6283 3 2.84 2.3152 4.276 128 17 8311 3 2.98 2.4889 5.125 128 17 8318 3 2.94 2.6777 4.730 128 17 8319 3 2.87 2.5258 4.466 128 17 8322 3 2.97 2.1380 4.064 128 17 8326 3 2.83 2.9542 4.696 128 17 8330 3 2.79 2.1185 4.452 128 17 8333 3 2.92 2.7338 4.525 128 17 8339 3 2.85 2.4199 4.253 128 17 8344 3 2.92 2.0162 4.485 128 17 8352 3 2.82 2.7362 4.724 128 17 8356 3 2.93 2.9071 4.280 128 17 8368 3 2.88 2.5451 4.306 128 17 8371 3 2.83 2.6449 4.509 128 17 8373 3 2.92 3.0827 4.557 128 17 8376 3 2.98 2.6915 4.221 128 17 8386 3 2.89 2.8943 5.122 128 17 8390 3 2.88 2.5193 4.517 128 17 8393 3 2.95 2.7557 4.728 128 17 8396 3 2.85 2.8144 4.975 128 17 8399 3 2.92 2.3086 4.956 128 17 8400 3 2.75 2.7016 5.075 128 17 8418 3 2.98 2.4893 4.839 128 17 8423 3 2.85 2.5219 4.822 128 17 8424 3 2.91 2.6892 4.642 128 17 8427 3 2.90 1.9939 4.335 128 17 8428 3 2.93 2.2951 4.371 128 17 8435 3 2.82 2.5309 4.651 128 17 8443 3 2.95 2.6766 4.492 128 17 8445 3 2.97 2.3029 5.038 128 17 8448 3 2.88 2.8141 4.859 128 17 8450 3 2.82 2.8261 5.165 128 17 8455 3 2.99 2.6809 4.296 128 17 8456 3 2.96 2.8805 4.308 128 17 8457 3 2.95 2.6189 4.884 128 17 8459 3 2.92 2.7728 5.378 128 17 8462 3 2.82 2.6905 4.445 128 17 8467 3 2.87 2.4751 4.424 128 17 8473 3 2.96 2.7256 5.066 128 17 8475 3 2.90 3.0495 5.048 128 17 8477 3 2.84 2.8557 5.328 128 17 8479 3 2.91 2.9851 4.976 128 17 8480 3 2.89 2.9687 5.112 128 17 8481 3 2.86 2.9873 4.886 128 17 8487 3 2.99 2.6815 5.225 128 17 8502 3 2.96 2.6452 4.853 128 17 8505 3 2.88 2.5744 4.881 128 17 8509 3 2.99 2.4813 4.696 128 17 8510 3 2.92 2.5789 4.661 128 17 8512 3 2.97 2.4630 4.980 128 17 8522 3 2.81 2.5824 5.184 128 17 8528 3 2.90 2.3608 4.985 128 17 8536 3 2.95 2.4455 4.616 128 17 8539 3 2.78 2.7467 4.643 128 17 8540 3 2.90 2.2673 4.496 128 17 8549 3 2.92 2.7987 4.812 128 17 8566 3 2.94 2.4287 5.016 128 17 8567 3 2.85 2.8591 4.963 128 17 8570 3 2.95 2.8709 5.633 128 17 8573 3 2.99 2.5402 5.060 128 17 8576 3 2.76 2.1611 5.885 128 17 8598 3 2.78 2.2174 4.436 128 17 8605 3 2.81 2.5144 4.859 128 17 8613 3 2.84 2.2974 4.918 128 17 8616 3 2.74 2.6288 4.389 128 17 8644 3 2.93 2.3073 4.362 128 17 8669 3 2.91 1.7835 4.400 128 17 8673 3 2.94 2.6900 4.760 128 17 8688 3 2.91 3.1051 5.236 128 17 8695 3 2.96 2.3741 4.708 128 17 8724 3 2.90 2.4390 4.795 128 17 8752 3 2.94 3.0425 4.426 128 17 8777 3 2.92 2.9052 5.462 128 17 8824 3 3.00 2.8076 4.914 128 17 8825 3 2.84 2.8707 5.002 128 17 8827 3 2.91 2.1192 5.020 128 17 8831 3 2.93 2.3986 4.679 128 17 8833 3 2.80 2.3258 5.112 128 17 8835 3 2.96 2.0556 5.081 128 17 8881 3 2.99 2.1664 4.337 128 17 8913 3 2.92 2.8645 5.278 128 17 8933 3 2.86 2.8590 4.964 128 17 8942 3 2.94 2.8900 5.106 128 17 8945 3 2.90 2.5033 4.522 128 17 8955 3 2.90 2.2732 5.285 128 17 8962 3 2.91 2.9630 4.479 128 17 8982 3 2.93 2.6731 4.245 128 17 9026 3 2.99 2.2913 4.880 128 17 9027 3 2.98 2.3975 5.273 128 17 9037 3 2.87 2.4254 4.809 128 17 9053 3 2.89 2.5439 4.604 128 17 9060 3 2.96 2.8384 4.687 128 17 9064 3 2.99 2.8123 4.513 128 17 9068 3 2.98 2.1559 4.685 128 17 9070 3 2.86 2.4440 4.770 128 17 9072 3 2.75 2.5567 4.741 128 17 9086 3 2.99 2.2140 4.293 128 17 9087 3 2.91 2.7799 5.190 128 17 9092 3 2.85 2.6349 4.992 128 17 9100 3 2.90 2.9156 5.195 128 17 9102 3 2.97 2.8449 5.696 128 17 9104 3 2.96 3.0278 5.430 128 17 9105 3 2.92 2.9754 5.156 128 17 9119 3 2.99 2.4051 6.066 128 17 9124 3 2.99 2.8033 5.459 128 17 9136 3 2.98 2.8485 5.487 128 17 9138 3 2.82 2.4379 5.459 128 17 9151 3 2.96 2.6850 5.513 128 17 9157 3 2.89 2.2552 5.326 128 17 9159 3 2.90 2.7579 5.216 128 17 9162 3 2.90 2.8142 5.287 128 17 9165 3 2.95 2.5405 5.340 128 17 9166 3 2.95 2.6972 5.494 128 17 9167 3 2.99 2.9777 5.127 128 17 9179 3 2.99 2.5429 4.840 128 17 9195 3 2.94 3.0971 4.210 128 17 9196 3 2.88 2.8701 4.478 128 17 9197 3 2.95 2.6695 4.499 128 17 9236 3 2.82 2.4880 4.727 128 17 9237 3 2.87 2.5233 4.826 128 17 9238 3 2.96 2.7428 4.880 128 17 9253 3 2.90 2.7579 5.045 128 17 9256 3 2.80 2.7145 5.201 128 17 9280 3 2.98 2.4591 4.427 128 17 9289 3 2.86 3.0414 4.965 128 17 9296 3 2.86 2.6176 4.701 128 17 9297 3 2.84 2.6824 4.940 128 17 9298 3 2.97 2.4619 5.208 128 17 9299 3 2.89 2.7364 4.799 128 17 9309 3 2.94 2.5193 4.977 128 17 9315 3 2.88 2.6336 4.507 128 17 9325 3 2.97 2.9798 5.130 128 17 9332 3 2.92 2.0028 4.405 128 17 9365 3 2.97 2.8683 4.967 128 17 9366 3 2.77 2.9901 5.114 128 17 9367 3 2.79 3.0427 5.327 128 17 9408 3 2.93 2.5262 5.108 128 17 9410 3 2.89 2.7405 4.415 128 17 9427 3 3.00 2.6736 5.324 128 17 9428 3 2.90 2.8823 5.816 128 17 9430 3 2.83 2.6181 5.352 128 17 9437 3 2.88 3.1247 5.400 128 17 9442 3 2.81 2.5783 5.073 128 17 9447 3 2.98 2.5799 5.443 128 17 9448 3 2.98 2.8865 5.479 128 17 9449 3 2.94 2.8046 5.190 128 17 9452 3 2.89 2.6336 4.739 128 17 9454 3 2.80 2.9379 5.274 128 17 9456 3 2.99 2.6073 4.557 128 17 9470 3 2.93 2.5642 4.705 128 17 9483 3 2.86 2.5518 4.809 128 17 9484 3 2.71 2.3538 4.993 128 17 9485 3 2.74 2.5479 4.890 128 17 9486 3 3.00 2.2697 4.980 128 17 9495 3 2.92 2.7616 4.421 128 17 9509 3 2.97 2.4023 4.652 ## 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 # 28 128 28 2978 3 2.96 1.8632 7.499 ## 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 ## Starting information for simulation # 37 ## Starting information for simulation # 38 ## Starting information for simulation # 39 ## Starting information for simulation # 40 ## Starting information for simulation # 41 ## Starting information for simulation # 42 ## Starting information for simulation # 43 ## Starting information for simulation # 44 ## Starting information for simulation # 45 ## Starting information for simulation # 46 ## Starting information for simulation # 47 ## Starting information for simulation # 48