# Bonding information for index 770 -- PRO_10@O 0MA_14@H3O 0MA_14@O3 # Index Sim # Frame Type Length Angle N-N dist ## Starting information for simulation # 1 770 1 323 2 2.89 2.7891 8.776 770 1 5492 2 2.69 3.0991 7.339 770 1 5584 2 2.93 2.8129 7.804 770 1 5585 2 2.82 2.6301 7.592 770 1 5586 2 2.58 2.9720 7.477 770 1 5588 2 2.79 3.0304 7.755 770 1 5691 2 2.66 2.8335 7.800 770 1 5692 2 2.76 2.9459 7.503 770 1 5693 2 2.56 2.9224 7.429 770 1 5706 2 2.99 2.4836 7.310 770 1 5707 2 2.63 2.9471 7.549 770 1 5856 2 2.73 2.7796 7.448 770 1 5858 2 2.98 2.8017 7.169 770 1 5900 2 2.99 2.3671 7.287 770 1 5946 2 2.83 2.5751 6.979 770 1 5965 2 2.57 2.5646 7.356 770 1 5966 2 2.62 2.8234 7.392 770 1 5969 2 2.70 2.9202 7.147 770 1 5970 2 2.69 2.5286 7.558 770 1 5971 2 2.93 2.8914 7.683 770 1 5972 2 2.70 3.1030 7.662 770 1 5976 2 2.63 3.0664 7.469 770 1 5977 2 2.67 2.8330 7.654 770 1 5978 2 2.87 2.9815 7.381 770 1 5979 2 2.68 2.2114 7.173 770 1 5980 2 2.67 2.7186 7.321 770 1 5982 2 2.67 2.4746 7.306 770 1 5983 2 2.63 2.8974 7.419 770 1 5984 2 2.90 2.5316 7.413 770 1 5985 2 2.55 2.9748 7.549 770 1 5986 2 2.75 2.7243 7.411 770 1 5987 2 2.76 3.1029 7.158 770 1 5988 2 2.62 2.6499 7.255 770 1 5989 2 2.70 3.0403 7.570 770 1 5990 2 2.70 2.7721 7.683 770 1 5998 2 2.84 2.5405 7.445 770 1 5999 2 2.82 2.7490 8.245 770 1 6000 2 2.82 2.8754 7.901 770 1 6001 2 2.82 2.5159 8.533 770 1 6088 2 2.72 3.0258 7.347 770 1 6144 2 2.93 2.8391 7.405 770 1 6145 2 2.63 3.0648 7.193 770 1 6404 2 2.85 2.7439 8.268 770 1 6405 2 2.83 2.8810 7.740 770 1 6406 2 2.98 2.5710 7.830 770 1 6407 2 2.69 2.7818 7.544 770 1 6408 2 2.84 2.7550 7.358 770 1 6409 2 2.81 2.7336 8.269 770 1 6720 2 2.94 2.5681 8.857 770 1 6721 2 2.71 2.6051 9.033 770 1 6722 2 2.53 2.9400 8.472 770 1 6724 2 2.74 2.6775 8.403 770 1 6725 2 2.76 2.9383 8.717 770 1 6727 2 2.66 2.7938 8.526 770 1 6729 2 2.67 3.0195 8.829 770 1 6730 2 2.65 3.0679 8.334 770 1 6732 2 2.57 2.9760 8.572 770 1 6733 2 2.90 3.0247 8.709 770 1 6736 2 3.00 2.1167 9.013 770 1 6739 2 2.65 2.9911 8.634 770 1 6740 2 2.69 3.0548 8.735 770 1 6761 2 2.77 3.0140 9.172 770 1 6763 2 2.74 2.9534 9.348 770 1 6765 2 2.75 2.8069 9.213 770 1 6766 2 2.66 2.7579 8.996 770 1 6767 2 2.68 2.7511 8.569 770 1 6790 2 2.76 2.9696 8.939 770 1 6791 2 2.89 2.4238 8.639 770 1 6792 2 2.73 2.7802 8.468 770 1 6793 2 2.99 2.8536 8.543 770 1 6794 2 2.62 2.9814 8.202 770 1 6799 2 2.77 3.0858 8.958 770 1 6800 2 2.73 2.8521 8.554 770 1 6802 2 2.74 2.5222 8.728 770 1 6804 2 2.70 2.9076 8.711 770 1 6805 2 2.73 2.7783 8.212 770 1 6806 2 3.00 2.5133 8.119 770 1 6807 2 2.71 3.0628 8.302 770 1 6808 2 2.68 2.6380 8.194 770 1 6809 2 2.75 2.6650 7.773 770 1 6810 2 2.85 2.6187 8.104 770 1 6811 2 2.81 2.7118 8.277 770 1 6812 2 2.82 3.0098 8.615 770 1 6813 2 2.67 2.8497 8.169 770 1 6814 2 2.62 2.9362 8.064 770 1 6815 2 2.60 2.8726 7.703 770 1 6816 2 2.63 2.9713 7.869 770 1 6817 2 2.72 2.5474 7.420 770 1 6831 2 2.84 2.8428 7.963 770 1 7562 2 2.79 2.7328 8.436 770 1 7563 2 2.72 2.7502 8.425 770 1 7660 2 2.81 2.7893 7.976 770 1 7759 2 2.84 1.8257 7.230 770 1 7769 2 2.73 2.8117 6.861 770 1 7832 2 2.99 1.9457 8.816 770 1 7835 2 2.88 2.6666 8.045 770 1 7926 2 2.84 2.8844 8.171 770 1 7928 2 2.71 2.6610 7.863 770 1 7929 2 2.98 2.9588 7.755 770 1 7930 2 2.80 2.5162 8.054 770 1 7931 2 2.72 2.8954 7.875 770 1 7932 2 2.68 2.5467 7.386 770 1 7934 2 2.65 2.9831 7.743 770 1 7935 2 2.70 2.8764 8.017 770 1 7936 2 2.75 2.6864 8.044 770 1 7937 2 2.89 2.7351 8.156 770 1 7938 2 2.75 2.8501 8.208 770 1 7939 2 2.87 2.3510 7.798 770 1 7940 2 2.50 2.9158 7.104 770 1 7966 2 2.61 2.9129 8.137 770 1 7971 2 2.93 2.7134 7.915 770 1 7972 2 2.77 2.4306 7.770 770 1 7973 2 2.77 2.9635 8.280 770 1 7977 2 2.60 2.9327 8.066 770 1 7978 2 2.95 2.9723 8.049 770 1 7979 2 2.52 3.1031 7.914 770 1 7980 2 2.86 2.5025 7.629 770 1 7990 2 2.67 2.6286 7.466 770 1 7991 2 2.70 2.6938 7.769 770 1 7992 2 2.70 2.8786 7.815 770 1 7994 2 2.98 2.9621 7.542 770 1 8010 2 2.94 2.8146 7.393 770 1 8306 2 2.93 2.7274 7.759 770 1 8307 2 2.66 2.8362 7.222 770 1 8308 2 2.76 2.8706 7.527 770 1 8309 2 2.87 2.9873 7.205 770 1 8351 2 2.76 2.8839 7.489 770 1 8352 2 2.62 3.0982 7.968 770 1 8353 2 2.78 2.7039 7.791 770 1 8356 2 2.71 3.0446 7.657 770 1 8825 2 2.86 2.9244 8.006 770 1 9148 2 2.68 3.0879 8.376 770 1 9149 2 2.73 3.0829 8.111 ## 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 # 12 770 12 37 2 2.77 2.8886 8.802 770 12 39 2 2.94 2.4444 8.957 770 12 40 2 2.67 2.9838 8.504 770 12 49 2 2.85 1.8909 8.687 770 12 51 2 2.76 1.8210 8.510 770 12 53 2 2.94 1.7548 9.265 770 12 68 2 2.75 2.6098 8.728 770 12 69 2 2.86 2.5220 8.788 770 12 70 2 2.92 2.7577 8.759 770 12 71 2 2.70 2.9592 8.470 770 12 72 2 2.87 2.8229 9.095 770 12 73 2 2.64 2.4105 8.948 770 12 74 2 2.77 2.6158 8.548 770 12 75 2 2.65 2.9225 9.101 770 12 78 2 2.64 2.8039 9.381 770 12 79 2 2.65 2.5035 8.860 770 12 80 2 2.57 2.6365 9.262 770 12 81 2 2.80 2.6469 9.429 770 12 83 2 2.70 2.6405 8.849 770 12 84 2 2.77 2.9003 10.149 770 12 85 2 2.55 2.9848 10.158 770 12 86 2 2.73 2.8908 9.768 770 12 87 2 2.86 2.9445 9.670 770 12 88 2 2.64 3.0697 9.068 770 12 90 2 2.88 2.4313 9.387 770 12 91 2 2.65 2.7848 9.446 770 12 92 2 2.75 1.9700 9.523 770 12 93 2 2.83 2.6466 9.640 770 12 94 2 2.99 2.3822 9.806 770 12 95 2 2.58 2.8864 9.387 770 12 96 2 2.79 2.9042 9.518 770 12 97 2 2.75 2.7056 9.996 770 12 98 2 2.63 3.0605 9.719 770 12 99 2 2.68 2.4678 9.701 770 12 100 2 2.77 2.9295 9.558 770 12 101 2 2.52 2.8529 9.464 770 12 102 2 2.62 3.0807 9.750 770 12 103 2 2.86 2.9970 9.649 770 12 104 2 2.58 2.8471 9.155 770 12 105 2 2.71 3.1131 9.569 770 12 107 2 2.71 3.0000 9.616 770 12 108 2 2.79 2.7281 9.894 770 12 109 2 2.85 2.9432 9.429 770 12 110 2 2.60 3.1052 9.846 770 12 112 2 2.59 3.1041 9.861 770 12 113 2 2.60 2.7151 9.699 770 12 114 2 2.55 3.0957 9.570 770 12 115 2 2.78 2.6563 9.520 770 12 116 2 2.75 2.6413 9.450 770 12 117 2 2.78 2.3063 9.749 770 12 119 2 2.93 2.0268 9.523 770 12 120 2 2.99 2.5899 9.386 770 12 122 2 2.82 2.9399 9.059 770 12 123 2 2.61 2.8994 9.713 770 12 125 2 2.86 2.7871 9.867 770 12 126 2 2.87 2.8913 9.837 770 12 127 2 2.62 3.0373 9.699 770 12 128 2 2.74 2.7739 9.801 770 12 129 2 2.93 3.0205 9.810 770 12 130 2 2.73 3.0907 10.016 770 12 131 2 2.77 2.7271 9.934 770 12 132 2 2.74 2.9175 9.544 770 12 133 2 2.70 2.9443 10.059 770 12 134 2 2.76 2.7632 9.678 770 12 135 2 2.81 2.8986 8.520 770 12 136 2 2.74 2.5874 8.843 770 12 137 2 2.59 2.6464 8.846 770 12 138 2 2.75 2.9008 8.356 770 12 139 2 2.66 2.5940 9.109 770 12 141 2 2.71 2.9031 9.446 770 12 143 2 2.63 2.6347 9.612 770 12 144 2 2.75 2.5343 9.567 770 12 145 2 2.70 2.9015 9.756 770 12 146 2 2.68 2.6797 9.830 770 12 147 2 2.96 2.6277 9.862 770 12 148 2 2.89 2.5998 9.746 770 12 149 2 2.90 2.7641 9.541 770 12 170 2 2.99 1.8466 9.630 770 12 175 2 2.89 2.0969 9.572 770 12 179 2 2.93 2.1126 9.945 770 12 189 2 2.77 1.9874 9.832 770 12 190 2 2.55 3.0481 9.661 770 12 191 2 2.55 2.9314 9.814 770 12 192 2 2.70 2.8647 9.993 770 12 193 2 2.90 2.9198 9.563 770 12 194 2 2.93 2.3424 9.279 770 12 195 2 2.76 2.6762 9.771 770 12 196 2 2.52 2.7683 9.644 ## 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 # 22 770 22 5021 2 2.97 1.8416 12.109 770 22 5073 2 2.97 1.7769 12.624 770 22 9231 2 2.97 1.9342 12.873 770 22 9343 2 2.99 2.0333 13.304 ## Starting information for simulation # 23 770 23 1862 2 2.87 2.8645 12.269 770 23 1869 2 2.82 2.7002 12.146 770 23 1870 2 2.80 2.7331 12.389 770 23 1871 2 2.81 2.7718 12.303 770 23 1872 2 2.73 3.0096 12.052 770 23 1873 2 2.81 2.3120 12.259 770 23 1874 2 2.68 2.6446 12.132 770 23 1875 2 2.75 2.9580 12.522 770 23 1876 2 2.83 3.0484 12.122 770 23 1877 2 2.79 2.7980 11.865 770 23 1878 2 2.67 2.6539 12.511 770 23 1879 2 2.89 2.8939 11.940 770 23 1880 2 2.93 2.3732 12.327 770 23 1881 2 2.89 2.8638 12.595 770 23 1885 2 2.66 2.7748 11.439 770 23 1886 2 2.51 2.7738 11.903 770 23 1887 2 2.74 2.9903 11.578 770 23 1888 2 3.00 2.6133 11.805 770 23 1889 2 2.70 2.8667 11.625 770 23 1907 2 2.80 2.1500 11.263 770 23 1910 2 2.72 3.0172 11.619 770 23 1916 2 2.78 2.7414 12.498 770 23 1917 2 2.56 2.9082 11.923 770 23 1919 2 2.70 2.9416 11.780 770 23 1922 2 2.63 3.0820 12.529 770 23 1923 2 2.89 2.9609 12.394 770 23 1924 2 2.69 2.8411 12.107 770 23 1926 2 2.67 2.7151 12.103 770 23 1933 2 2.82 2.8768 11.478 770 23 1934 2 2.65 3.0110 10.645 770 23 1935 2 2.88 2.8570 10.790 770 23 1937 2 2.75 2.9419 10.462 770 23 1945 2 2.73 2.7406 10.107 770 23 1946 2 2.67 2.5010 10.299 770 23 1947 2 2.82 3.0356 10.648 770 23 1950 2 2.53 2.8894 10.400 770 23 1953 2 2.82 2.3113 10.507 770 23 1955 2 2.99 1.8986 10.815 770 23 1963 2 2.87 2.1937 9.239 770 23 1964 2 2.69 2.5224 8.070 770 23 1965 2 2.83 2.9283 8.513 770 23 1967 2 2.71 2.4307 8.455 770 23 1975 2 2.64 2.6878 9.330 770 23 1978 2 2.81 2.9241 11.153 770 23 1985 2 2.56 2.5770 11.322 770 23 1986 2 2.94 2.7141 10.876 770 23 1987 2 2.91 2.7528 10.898 770 23 1988 2 2.97 2.5441 10.932 770 23 1995 2 2.72 2.8209 10.654 770 23 1997 2 2.68 2.9489 11.048 770 23 1998 2 2.99 2.7818 10.996 770 23 2002 2 2.92 2.6302 11.241 770 23 2005 2 2.63 3.0026 10.835 770 23 2006 2 2.65 2.8943 11.864 770 23 2007 2 2.69 2.6689 11.392 770 23 2008 2 2.73 2.8269 11.478 770 23 2010 2 2.71 2.9175 11.731 770 23 2011 2 2.60 2.8102 11.572 770 23 2013 2 2.79 2.7385 11.650 770 23 2014 2 2.73 2.4832 10.563 770 23 2015 2 2.84 2.0338 11.024 770 23 2016 2 2.64 2.8719 11.339 770 23 2017 2 2.80 2.4610 11.609 770 23 2018 2 3.00 2.6854 11.297 770 23 2019 2 2.87 2.7779 11.425 770 23 2020 2 2.54 2.9434 11.409 770 23 2021 2 2.98 2.3774 11.501 770 23 2022 2 2.56 2.3474 11.942 770 23 2023 2 2.57 2.7734 11.669 770 23 2024 2 2.67 3.0138 11.995 770 23 2030 2 2.99 2.9789 12.239 770 23 2055 2 2.89 2.4466 10.984 770 23 2059 2 2.86 2.5963 10.403 770 23 2082 2 2.99 1.7599 12.182 770 23 2089 2 2.95 2.4927 11.847 770 23 2092 2 2.51 2.9399 11.736 770 23 2093 2 2.93 2.5425 11.606 770 23 2100 2 2.74 3.0174 11.377 770 23 2101 2 2.65 2.7826 12.036 770 23 2102 2 2.68 2.7729 10.912 770 23 2177 2 2.87 2.7840 11.020 770 23 2196 2 2.78 2.2014 11.850 770 23 2201 2 2.96 1.7604 11.565 770 23 2209 2 2.75 2.5423 11.350 770 23 2210 2 2.96 1.8038 11.579 770 23 2211 2 2.99 2.1305 11.253 ## 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