name total energy Backbone Hbon Sidechain Hbond Van der Waals Electrostatics Solvation Polar Solvation Hydrophobic Van de Waals clashes entropy side chain entropy main chain sloop_entropy mloop_entropy cis_bond torsional clash backbone clash helix dipole water bridge disulfide electrostatic Kon partial covalent bonds 1_1XH62.PDB -88.75396636 -266.11250000 -163.81250000 -457.94427941 -37.11300205 584.89723836 -562.15763937 14.61761466 254.57802152 527.18811769 0.00000000 0.00000000 0.00000000 25.76927181 27.21367922 -1.10565002 -2.85655620 0.00000000 -4.70210335 0.00000000 0.00000000 353.00000000 2_1XH62.PDB -85.65271525 -266.96250000 -162.75000000 -458.01684729 -38.78003246 585.86437627 -561.15548340 18.17844030 253.63822958 527.50939216 0.00000000 0.00000000 0.00000000 25.41024502 27.20630424 -1.03499402 -2.28799156 0.00000000 -5.26554986 0.00000000 0.00000000 353.00000000 3_1XH62.PDB -83.56426858 -266.10000000 -163.91250000 -457.32806368 -39.83281509 587.00236104 -559.92933522 18.02938886 254.63846971 528.43338473 0.00000000 0.00000000 0.00000000 24.96754080 27.18017227 -1.10281963 -2.92457086 0.00000000 -5.50530923 0.00000000 0.00000000 353.00000000 4_1XH62.PDB -88.69716456 -265.18750000 -163.77500000 -458.04881534 -39.71853068 585.48957977 -561.34404924 14.29442818 254.04234734 528.08290217 0.00000000 0.00000000 0.00000000 26.65893884 27.33316534 -1.12225479 -2.59605106 0.00000000 -5.47315974 0.00000000 0.00000000 353.00000000 5_1XH62.PDB -89.40925207 -267.00000000 -162.77500000 -457.53874849 -39.79915405 586.83686561 -560.22095267 14.44371813 253.81430602 527.59902025 0.00000000 0.00000000 0.00000000 25.13792439 27.26805213 -1.79539963 -2.87404023 0.00000000 -5.23779142 0.00000000 0.00000000 353.00000000 6_1XH62.PDB -88.45414949 -264.33750000 -162.03750000 -456.27698019 -39.79003518 582.88550362 -558.82292245 14.01010527 252.85979485 527.07881468 0.00000000 0.00000000 0.00000000 25.21093832 27.31019394 -1.34091181 -2.62884957 0.00000000 -5.26460701 0.00000000 0.00000000 353.00000000 7_1XH62.PDB -88.23311157 -262.56250000 -164.82500000 -457.52560501 -38.33723724 584.87631622 -561.70434932 14.63970550 253.65644020 527.03834160 0.00000000 0.00000000 0.00000000 26.34019341 27.25329152 -2.07841489 -2.78417892 0.00000000 -4.96682311 0.00000000 0.00000000 353.00000000 8_1XH62.PDB -84.49207022 -265.22500000 -162.96250000 -455.78000292 -39.07663054 582.76015207 -558.06253314 18.25822968 253.61946516 526.60187691 0.00000000 0.00000000 0.00000000 25.40554833 27.28667326 -2.05727049 -2.77222905 0.00000000 -5.20117620 0.00000000 0.00000000 353.00000000 9_1XH62.PDB -86.34781037 -265.18750000 -159.48750000 -456.43945064 -38.70478187 583.31029873 -560.09256191 14.59188295 252.93499914 526.85447892 0.00000000 0.00000000 0.00000000 26.06321125 27.12532618 -2.19010508 -2.86493544 0.00000000 -5.13584642 0.00000000 0.00000000 353.00000000 10_1XH62.PDB -85.06188037 -263.48750000 -160.37500000 -454.97986009 -38.24273317 580.18836252 -557.81258053 14.22042889 252.04044774 526.48579428 0.00000000 0.00000000 0.00000000 25.71721540 27.17263026 -1.19502401 -2.77003184 0.00000000 -4.85139956 0.00000000 0.00000000 353.00000000 11_1XH62.PDB -86.00248695 -264.37500000 -162.52500000 -455.22469479 -39.45982925 582.50039081 -557.16943257 13.68399989 252.99595140 526.80840357 0.00000000 0.00000000 0.00000000 25.83268120 27.24222973 -1.49181478 -2.36254970 0.00000000 -5.21559273 0.00000000 0.00000000 353.00000000 12_1XH62.PDB -87.89267762 -266.11250000 -162.07500000 -457.33654237 -40.25818040 585.51682577 -559.14740745 14.92345825 253.14565782 527.41063319 0.00000000 0.00000000 0.00000000 25.51649476 27.22845335 -1.50080704 -2.69206720 0.00000000 -5.28324294 0.00000000 0.00000000 353.00000000 13_1XH62.PDB -86.09750168 -265.00000000 -166.55000000 -458.37947013 -38.31392121 586.40051225 -561.51758085 16.31109751 254.82055920 527.48804060 0.00000000 0.00000000 0.00000000 26.76303217 27.21286929 -0.81730389 -2.57185896 0.00000000 -4.73060836 0.00000000 0.00000000 353.00000000 14_1XH62.PDB -87.68507773 -266.81250000 -162.73750000 -457.09634555 -39.43975117 583.77680068 -560.33021065 15.53132873 254.54093476 528.26233840 0.00000000 0.00000000 0.00000000 25.65780928 27.26480978 -1.07861913 -2.50151768 0.00000000 -5.45784540 0.00000000 0.00000000 353.00000000 15_1XH62.PDB -90.59852405 -266.77500000 -163.45000000 -456.61402031 -40.15983382 583.73568852 -559.58852032 14.22226554 254.03327976 527.15397497 0.00000000 0.00000000 0.00000000 25.92746101 27.08273171 -1.43664529 -2.57597659 0.00000000 -5.07119754 0.00000000 0.00000000 353.00000000 16_1XH62.PDB -86.25733700 -267.66250000 -160.15000000 -457.98681975 -39.15039762 584.11547892 -561.42868153 18.19288824 253.38916615 528.28435468 0.00000000 0.00000000 0.00000000 25.52908398 27.21404781 -1.24557999 -2.64093439 0.00000000 -5.50339570 0.00000000 0.00000000 353.00000000 17_1XH62.PDB -87.34457533 -265.92500000 -161.70000000 -456.76622126 -37.75358068 582.13017021 -560.30607878 14.57925798 253.27170631 528.10653385 0.00000000 0.00000000 0.00000000 26.28713713 27.23743858 -1.31209475 -2.92414768 0.00000000 -5.03225765 0.00000000 0.00000000 353.00000000 18_1XH62.PDB -89.51190859 -266.77500000 -162.77500000 -458.36664417 -40.53328860 584.48903911 -562.63029631 18.43054859 254.60605348 528.05385592 0.00000000 0.00000000 0.00000000 25.29253624 27.20117803 -1.32775787 -2.48113762 0.00000000 -5.49481737 0.00000000 0.00000000 353.00000000 19_1XH62.PDB -88.10005371 -264.15000000 -163.82500000 -456.97575271 -38.70700297 583.84465620 -560.05763919 14.07393503 253.21325852 527.37228278 0.00000000 0.00000000 0.00000000 25.24896998 27.15703587 -0.98891813 -2.76342504 0.00000000 -4.38541816 0.00000000 0.00000000 353.00000000 20_1XH62.PDB -83.07653706 -265.03750000 -163.51250000 -456.14296139 -37.63345505 583.64746975 -558.55680028 14.66383274 253.68486615 528.19795688 0.00000000 0.00000000 0.00000000 25.67844158 27.11971573 -1.17472843 -2.55246914 0.00000000 -4.33868988 0.00000000 0.00000000 353.00000000 21_1XH62.PDB -84.35084479 -268.55000000 -160.85000000 -457.99721805 -38.93374967 585.85558849 -560.81215707 18.12918833 253.90615952 528.75593543 0.00000000 0.00000000 0.00000000 25.69556941 27.40424059 -1.72424972 -2.44903163 0.00000000 -5.37687983 0.00000000 0.00000000 353.00000000 22_1XH62.PDB -86.58829286 -265.18750000 -163.77500000 -456.77084040 -37.82475435 583.71446001 -559.00951116 13.75175034 253.32380175 527.60139385 0.00000000 0.00000000 0.00000000 25.87934747 27.16241516 -1.04636531 -2.59815097 0.00000000 -4.64692410 0.00000000 0.00000000 353.00000000 23_1XH62.PDB -88.17522506 -266.81250000 -162.73750000 -456.26593531 -39.53327566 583.70364032 -559.21538296 14.45560851 253.72451076 528.00683635 0.00000000 0.00000000 0.00000000 25.69297694 27.26136852 -1.17732932 -2.88786672 0.00000000 -5.12900799 0.00000000 0.00000000 353.00000000 24_1XH62.PDB -89.82901028 -267.62500000 -164.51250000 -457.59270023 -37.65186612 585.25771373 -560.57011197 14.09135317 253.74281921 528.56253857 0.00000000 0.00000000 0.00000000 25.70511760 27.19036154 -1.13253159 -3.39194783 0.00000000 -4.71189482 0.00000000 0.00000000 353.00000000 25_1XH62.PDB -88.15601507 -265.22500000 -162.88750000 -456.59914468 -39.79575993 583.71606645 -558.65161450 14.46976416 252.76872582 527.34790540 0.00000000 0.00000000 0.00000000 25.64142878 27.21492775 -1.23451483 -2.61904319 0.00000000 -5.08732855 0.00000000 0.00000000 353.00000000 26_1XH62.PDB -88.44516626 -265.22500000 -162.96250000 -455.53215207 -40.76324996 582.82217543 -557.41460963 13.93013011 254.14437061 526.74765879 0.00000000 0.00000000 0.00000000 25.69109183 27.16659669 -1.64913431 -2.83628198 0.00000000 -5.39766507 0.00000000 0.00000000 353.00000000 27_1XH62.PDB -86.63653705 -267.70000000 -161.92500000 -456.85425759 -38.68522652 584.63611490 -560.29781241 14.55582303 253.07263448 528.09012570 0.00000000 0.00000000 0.00000000 27.05723690 27.16435469 -1.07298155 -2.60704311 0.00000000 -4.90615087 0.00000000 0.00000000 353.00000000 28_1XH62.PDB -85.94635305 -265.03750000 -163.67500000 -456.12262426 -38.16598620 583.09086163 -559.12492256 15.53761524 253.13362326 528.06231596 0.00000000 0.00000000 0.00000000 25.09487843 27.27012014 -1.00980531 -2.67129972 0.00000000 -5.05850951 0.00000000 0.00000000 353.00000000 29_1XH62.PDB -93.21091170 -267.88750000 -165.55000000 -457.76499002 -39.73630105 586.18639837 -560.49470880 13.95845927 254.55267222 527.65861961 0.00000000 0.00000000 0.00000000 25.84069727 27.27396586 -1.73421808 -2.99337270 0.00000000 -5.24666777 0.00000000 0.00000000 353.00000000 30_1XH62.PDB -89.81942888 -266.81250000 -163.51250000 -456.94808426 -39.28981124 584.23521292 -559.36148718 15.79419844 253.99563129 527.53724924 0.00000000 0.00000000 0.00000000 25.38153514 27.20641477 -2.56377088 -2.80633054 0.00000000 -5.46877181 0.00000000 0.00000000 353.00000000