name Intraclash total energy Backbone Hbond 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_1UJJ2.PDB 2.43553000 -13.80713334 -3.93750000 -5.67500000 -8.01214012 -1.17442368 11.65607011 -10.87270121 0.31657705 4.00398960 1.71659027 0.00000000 0.00000000 0.00000000 0.28487233 0.65602304 0.03651088 -0.33725911 0.00000000 -1.81271946 0.00000000 2.38400000 147.00000000 2_1UJJ2.PDB 2.53771000 -14.01600435 -3.93750000 -5.67500000 -8.27405640 -1.15407002 12.01595937 -11.15952784 0.51433040 3.96305278 1.93487670 0.00000000 0.00000000 0.00000000 0.16101303 0.65838505 0.03384565 -0.80394310 0.00000000 -1.63498492 0.00000000 2.38400000 147.00000000 3_1UJJ2.PDB 2.40843000 -14.36114506 -3.93750000 -5.67500000 -8.08757422 -1.08502680 11.55198077 -11.06435420 0.32148614 3.97804445 1.68815948 0.00000000 0.00000000 0.00000000 0.14804915 0.65832244 0.03591547 -0.56541593 0.00000000 -1.66990936 0.00000000 2.38400000 147.00000000 4_1UJJ2.PDB 2.22918000 -13.62492067 -3.93750000 -5.67500000 -8.06237190 -1.20333864 11.67141475 -10.54476015 0.09665384 4.17700340 2.06911222 0.00000000 0.00000000 0.00000000 0.10134081 0.65608728 0.03647718 -0.51777592 0.00000000 -1.83617625 0.00000000 2.38400000 147.00000000 5_1UJJ2.PDB 2.29111000 -13.30800318 -3.93750000 -5.67500000 -8.22654932 -1.19997891 11.90497379 -10.62534274 0.20527222 4.07276787 2.29968264 0.00000000 0.00000000 0.00000000 0.12083481 0.65554420 0.03508902 -0.60204479 0.00000000 -1.68020777 0.00000000 2.38400000 147.00000000 6_1UJJ2.PDB 2.46842000 -14.14262548 -3.93750000 -5.67500000 -8.08911732 -1.03079898 11.52958268 -11.03857771 0.40724969 3.91858926 1.76900128 0.00000000 0.00000000 0.00000000 0.18398365 0.65554175 0.03635964 -0.58651153 0.00000000 -1.62988614 0.00000000 2.38400000 147.00000000 7_1UJJ2.PDB 2.79744000 -16.24857078 -3.93750000 -5.67500000 -8.71376457 -0.99844996 11.12936083 -12.62065390 0.37654382 3.90304018 1.92779865 0.00000000 0.00000000 0.00000000 0.21204946 0.65566403 0.02785521 -0.45338699 0.00000000 -1.42646351 0.00000000 2.38400000 147.00000000 8_1UJJ2.PDB 2.88797000 -16.03618130 -3.93750000 -5.67500000 -9.00202982 -1.06011681 11.68285383 -12.85364450 0.31698656 3.90889222 2.31924564 0.00000000 0.00000000 0.00000000 0.22692199 0.65621961 0.02665850 -0.60558551 0.00000000 -1.38386339 0.00000000 2.38400000 147.00000000 9_1UJJ2.PDB 2.28696000 -13.21739142 -3.93750000 -5.67500000 -7.69800846 -1.18418714 11.60181477 -10.18697425 0.15142107 3.87380084 1.74197656 0.00000000 0.00000000 0.00000000 0.15433510 0.65525190 0.03820743 -0.26692619 0.00000000 -1.83035117 0.00000000 2.38400000 147.00000000 10_1UJJ2.PDB 2.83510000 -14.16134477 -3.93750000 -5.67500000 -8.15517328 -1.15792288 12.02814388 -11.26428535 0.49344533 3.98035570 1.44979152 0.00000000 0.00000000 0.00000000 0.18532354 0.65537926 0.03838170 -0.39958212 0.00000000 -1.74732280 0.00000000 2.38400000 147.00000000 11_1UJJ2.PDB 2.67708000 -13.77234524 -3.93750000 -5.67500000 -8.28495195 -1.21562704 12.45067152 -11.31352968 0.40739210 3.97209930 1.67711714 0.00000000 0.00000000 0.00000000 0.20123923 0.65554824 0.03797234 -0.47291166 0.00000000 -1.61931652 0.00000000 2.38400000 147.00000000 12_1UJJ2.PDB 2.25979000 -11.85419884 -3.93750000 -3.93750000 -8.22214993 -1.89018315 12.40282283 -10.54928924 0.10354605 4.43562245 2.08938672 0.00000000 0.00000000 0.00000000 0.17797692 0.65576616 0.03644021 -0.30090262 0.00000000 -2.26246907 0.00000000 2.38400000 147.00000000 13_1UJJ2.PDB 2.39096000 -13.09011090 -3.93750000 -3.93750000 -8.20758704 -1.39398264 11.40186010 -11.11413411 0.26167498 4.29310039 1.54193532 0.00000000 0.00000000 0.00000000 0.18888868 0.65607666 0.03596968 -0.18196463 0.00000000 -2.04087163 0.00000000 2.38400000 147.00000000 14_1UJJ2.PDB 2.40072000 -13.15443105 -3.93750000 -3.93750000 -8.10685708 -1.81155695 11.69463102 -10.95233851 0.29510013 4.40253840 1.28267033 0.00000000 0.00000000 0.00000000 0.22406197 0.65607220 0.03779033 -0.13623059 0.00000000 -2.20924010 0.00000000 2.38400000 147.00000000 15_1UJJ2.PDB 2.30376000 -13.56500481 -3.93750000 -5.67500000 -8.04504932 -1.10314911 11.53727696 -10.50939807 0.21395095 4.02354776 2.04411535 0.00000000 0.00000000 0.00000000 0.13130353 0.65608899 0.03570328 -0.59017031 0.00000000 -1.69063581 0.00000000 2.38400000 147.00000000 16_1UJJ2.PDB 2.57171000 -14.38380872 -3.93750000 -5.67500000 -8.54192619 -1.84408104 12.64874341 -11.19277021 0.26240304 4.69613825 1.81975171 0.00000000 0.00000000 0.00000000 0.25438775 0.65704932 0.03678949 -0.64883711 0.00000000 -2.26190781 0.00000000 2.38400000 147.00000000 17_1UJJ2.PDB 2.61728000 -13.91910991 -3.93750000 -5.67500000 -8.14405994 -1.32632016 12.20733953 -10.96243771 0.42908617 3.85881899 1.45312614 0.00000000 0.00000000 0.00000000 0.19414263 0.65572398 0.03708426 -0.39035538 0.00000000 -1.66303445 0.00000000 2.38400000 147.00000000 18_1UJJ2.PDB 2.89852000 -15.90756682 -3.93750000 -5.67500000 -8.68319254 -0.85697351 11.21475931 -12.51726497 0.43059720 3.77243080 1.80386375 0.00000000 0.00000000 0.00000000 0.31258302 0.61623664 0.02690904 -0.48489076 0.00000000 -1.31388816 0.00000000 2.38400000 147.00000000 19_1UJJ2.PDB 2.23030000 -13.35681065 -3.93750000 -5.67500000 -8.13333316 -1.12552413 11.86519280 -10.58004639 0.09964809 4.05440670 2.13968525 0.00000000 0.00000000 0.00000000 0.12529583 0.65628714 0.03639113 -0.53102527 0.00000000 -1.69500150 0.00000000 2.38400000 147.00000000 20_1UJJ2.PDB 2.25900000 -13.56227907 -3.93750000 -5.67500000 -7.72007135 -1.06777516 11.62697016 -10.21243980 0.11993538 3.74399623 1.70863871 0.00000000 0.00000000 0.00000000 0.10470401 0.65618070 0.03545758 -0.63572665 0.00000000 -1.65346819 0.00000000 2.38400000 147.00000000 21_1UJJ2.PDB 2.44650000 -13.88163513 -3.93750000 -5.67500000 -8.20112096 -1.21147342 12.32222404 -11.23795583 0.36940946 4.04094514 1.59388993 0.00000000 0.00000000 0.00000000 0.23032241 0.65686643 0.03766491 -0.49281074 0.00000000 -1.72023007 0.00000000 2.38400000 147.00000000 22_1UJJ2.PDB 2.66576000 -15.17665822 -3.93750000 -5.67500000 -8.68376697 -1.00853957 11.22729854 -12.03828531 0.22498504 3.91862737 2.28839415 0.00000000 0.00000000 0.00000000 0.18384751 0.65595506 0.02788611 -0.29273956 0.00000000 -1.41186552 0.00000000 2.38400000 147.00000000 23_1UJJ2.PDB 2.36482000 -13.05916324 -3.93750000 -3.93750000 -8.08771455 -1.38719264 11.39610947 -10.97960146 0.26217682 4.02658924 1.27372188 0.00000000 0.00000000 0.00000000 0.15873707 0.65624714 0.03730624 -0.06245338 0.00000000 -1.82184193 0.00000000 2.38400000 147.00000000 24_1UJJ2.PDB 2.68477000 -15.09210500 -3.93750000 -5.67500000 -8.96902484 -1.00228775 11.69933037 -12.32242946 0.19168634 3.92810835 2.54682500 0.00000000 0.00000000 0.00000000 0.18543073 0.65635675 0.02683668 -0.41572035 0.00000000 -1.34836008 0.00000000 2.38400000 147.00000000 25_1UJJ2.PDB 2.86817000 -16.24362482 -3.93750000 -5.67500000 -8.84746385 -0.98287853 11.26359350 -12.71409357 0.35555382 3.87249056 2.11839339 0.00000000 0.00000000 0.00000000 0.28716415 0.65566657 0.02767306 -0.62399239 0.00000000 -1.38756495 0.00000000 2.38400000 147.00000000 26_1UJJ2.PDB 2.42847000 -14.24564068 -3.93750000 -5.67500000 -8.07023102 -1.16457250 11.90657846 -11.03432988 0.30212135 4.00680120 1.29945511 0.00000000 0.00000000 0.00000000 0.16931679 0.65548651 0.03690181 -0.37309255 0.00000000 -1.71208943 0.00000000 2.38400000 147.00000000 27_1UJJ2.PDB 2.42537000 -13.79145979 -3.93750000 -5.67500000 -8.22176137 -1.29316766 12.22926788 -10.76662211 0.24385969 4.17835779 1.70644563 0.00000000 0.00000000 0.00000000 0.16638068 0.65701972 0.03933999 -0.56184104 0.00000000 -1.89921927 0.00000000 2.38400000 147.00000000 28_1UJJ2.PDB 3.10399000 -14.35845647 -3.93750000 -5.67500000 -8.18188717 -1.22947761 12.06563736 -11.21655692 0.39832952 3.94600267 1.48342408 0.00000000 0.00000000 0.00000000 0.26256525 0.65603864 0.03827021 -0.57235743 0.00000000 -1.73990643 0.00000000 2.38400000 147.00000000 29_1UJJ2.PDB 2.25722000 -12.24665425 -3.93750000 -3.93750000 -7.83742261 -1.39726994 11.14583210 -10.24162964 0.09611303 3.94358947 1.88279187 0.00000000 0.00000000 0.00000000 0.24886557 0.65618941 0.03489463 -0.26798175 0.00000000 -1.97943700 0.00000000 2.38400000 147.00000000 30_1UJJ2.PDB 2.41671000 -13.27394333 -3.93750000 -5.67500000 -8.39812871 -1.29940820 12.75452802 -10.83899173 0.18965649 4.05286803 1.79700768 0.00000000 0.00000000 0.00000000 0.19403705 0.65574727 0.03768698 -0.47653257 0.00000000 -1.67416636 0.00000000 2.38400000 147.00000000