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_1K3Q2.PDB 3.07567000 -8.26078710 0.00000000 -5.88750000 -6.12992081 -2.98291935 9.50120625 -6.42900846 1.60559607 1.39232404 2.88218828 0.00000000 0.00000000 0.00000000 0.26382607 0.78204807 0.00000000 -0.40128685 0.00000000 -2.07529234 0.00000000 2.38400000 164.00000000 2_1K3Q2.PDB 2.50273000 -6.79203722 0.00000000 -4.15000000 -5.97678568 -2.96314826 9.22330864 -6.31914834 1.60668825 1.06444530 2.86017181 0.00000000 0.00000000 0.00000000 0.25838896 0.77323389 0.00000000 -0.24098354 0.00000000 -2.15497436 0.00000000 2.38400000 164.00000000 3_1K3Q2.PDB 2.70271000 -7.52879666 -0.00000000 -5.85000000 -5.82194574 -2.33865985 9.39182291 -6.16807858 1.58251194 0.79024912 2.66499824 0.00000000 0.00000000 0.00000000 0.26850227 0.76705136 0.00000000 -0.25654398 0.00000000 -1.79165300 0.00000000 2.38400000 164.00000000 4_1K3Q2.PDB 2.30132000 -8.04940472 0.00000000 -5.85000000 -5.94139653 -2.84569731 9.41282600 -6.32946902 1.63063108 1.07973044 2.83820396 0.00000000 0.00000000 0.00000000 0.29039142 0.77856392 0.00000000 -0.18338296 0.00000000 -2.15124180 0.00000000 2.38400000 164.00000000 5_1K3Q2.PDB 2.91546000 -7.53841159 0.00000000 -5.88750000 -5.95912650 -2.81220970 9.15357000 -6.29787031 1.57862410 2.24677868 2.78061830 0.00000000 0.00000000 0.00000000 0.26623668 0.77050667 0.00000000 -0.49770669 0.00000000 -2.10982614 0.00000000 2.38400000 164.00000000 6_1K3Q2.PDB 2.08441000 -7.86457710 0.00000000 -5.85000000 -5.94343700 -2.69653095 9.49916895 -6.32984058 1.61571743 0.95756392 2.83547353 0.00000000 0.00000000 0.00000000 0.27407466 0.78494714 0.00000000 -0.30134217 0.00000000 -1.92542489 0.00000000 2.38400000 164.00000000 7_1K3Q2.PDB 2.21622000 -8.51851842 -0.88750000 -6.73750000 -6.16968041 -2.64825034 9.58907463 -6.46019615 1.68243224 2.24600993 2.87866376 0.00000000 0.00000000 0.00000000 0.28980049 0.78306828 0.00000000 -0.44089771 0.00000000 -1.86047488 0.00000000 2.38400000 164.00000000 8_1K3Q2.PDB 2.88869000 -8.50186252 -0.88750000 -6.73750000 -6.17741965 -2.69337724 10.01007405 -6.41746924 1.60415400 2.04696163 2.94969181 0.00000000 0.00000000 0.00000000 0.25443043 0.78437124 0.00000000 -0.48072137 0.00000000 -1.97318694 0.00000000 2.38400000 164.00000000 9_1K3Q2.PDB 2.47175000 -7.60869224 0.00000000 -5.85000000 -6.08613288 -2.77343251 10.17012810 -6.38162781 1.60192155 0.84217371 2.98360652 0.00000000 0.00000000 0.00000000 0.22481981 0.78062661 0.00000000 -0.26333957 0.00000000 -2.07680917 0.00000000 2.38400000 164.00000000 10_1K3Q2.PDB 2.18140000 -8.16536577 0.00000000 -5.85000000 -6.11602740 -2.94432240 9.78865975 -6.43608036 1.60164468 0.96912852 2.88240200 0.00000000 0.00000000 0.00000000 0.31576296 0.78105522 0.00000000 -0.34083346 0.00000000 -2.03570005 0.00000000 2.38400000 164.00000000 11_1K3Q2.PDB 2.04055000 -7.70625926 0.00000000 -5.88750000 -5.91669520 -2.45391553 8.99867610 -6.24432905 1.63630190 1.33352858 2.71388277 0.00000000 0.00000000 0.00000000 0.28544644 0.78657821 0.00000000 -0.36113984 0.00000000 -1.81051543 0.00000000 2.38400000 164.00000000 12_1K3Q2.PDB 2.71714000 -8.14140652 0.00000000 -5.88750000 -5.92165944 -2.66390725 9.05407651 -6.23252036 1.57929177 1.25319533 2.73751171 0.00000000 0.00000000 0.00000000 0.28235304 0.77441421 0.00000000 -0.44284417 0.00000000 -1.89940365 0.00000000 2.38400000 164.00000000 13_1K3Q2.PDB 2.21114000 -8.49772713 0.00000000 -5.88750000 -6.42517575 -3.19884315 9.96932852 -6.59934789 1.61936314 1.30104980 2.96769271 0.00000000 0.00000000 0.00000000 0.28359533 0.78376993 0.00000000 -0.47113049 0.00000000 -2.05675936 0.00000000 2.38400000 164.00000000 14_1K3Q2.PDB 2.19135000 -8.12339625 0.00000000 -5.88750000 -5.95435336 -2.68316410 8.98247804 -6.31989922 1.57586158 1.29227670 2.82216482 0.00000000 0.00000000 0.00000000 0.27048494 0.77211950 0.00000000 -0.35205863 0.00000000 -1.86968701 0.00000000 2.38400000 164.00000000 15_1K3Q2.PDB 3.00330000 -7.92804261 0.00000000 -5.85000000 -5.89524190 -2.83410615 9.50108506 -6.24054591 1.61307005 0.99950377 2.80828904 0.00000000 0.00000000 0.00000000 0.25600423 0.77406949 0.00000000 -0.19311441 0.00000000 -2.09298637 0.00000000 2.38400000 164.00000000 16_1K3Q2.PDB 3.70692000 -7.98392115 -1.73750000 -7.11250000 -7.15939402 -3.74395191 11.70699733 -6.98641587 4.16174828 1.38003234 3.68872514 0.00000000 0.00000000 0.00000000 0.34144726 0.80331008 0.00000000 -0.29120692 0.00000000 -2.23190276 0.00000000 2.38400000 164.00000000 17_1K3Q2.PDB 2.39119000 -7.68215324 0.00000000 -5.85000000 -6.01362439 -2.73823457 9.65680868 -6.40001631 1.65338371 0.97759667 2.83945138 0.00000000 0.00000000 0.00000000 0.39415121 0.78879061 0.00000000 -0.28348341 0.00000000 -1.91818620 0.00000000 2.38400000 164.00000000 18_1K3Q2.PDB 3.09495000 -8.21906938 0.00000000 -5.85000000 -6.14849394 -3.01680961 9.93561719 -6.42041874 1.64563830 0.87671790 2.83921968 0.00000000 0.00000000 0.00000000 0.36789179 0.77205496 0.00000000 -0.44189209 0.00000000 -2.00653987 0.00000000 2.38400000 164.00000000 19_1K3Q2.PDB 2.86715000 -8.13085974 0.00000000 -5.88750000 -6.01293335 -2.59988403 9.11383300 -6.35277739 1.57718702 1.33425791 2.77912099 0.00000000 0.00000000 0.00000000 0.27992008 0.77292790 0.00000000 -0.44656446 0.00000000 -1.91551950 0.00000000 2.38400000 164.00000000 20_1K3Q2.PDB 2.15091000 -7.69571849 0.00000000 -5.85000000 -5.93073711 -2.70543034 9.64810311 -6.26080483 1.60206672 0.90699251 2.77314152 0.00000000 0.00000000 0.00000000 0.29930594 0.77996328 0.00000000 -0.29234916 0.00000000 -1.88600685 0.00000000 2.38400000 164.00000000 21_1K3Q2.PDB 2.34285000 -8.21743231 0.00000000 -5.88750000 -6.10117102 -2.93976602 9.38569328 -6.44361596 1.62932122 1.45381688 2.88344500 0.00000000 0.00000000 0.00000000 0.27471324 0.78446632 0.00000000 -0.34990647 0.00000000 -2.12246246 0.00000000 2.38400000 164.00000000 22_1K3Q2.PDB 2.00225000 -7.85345748 0.00000000 -5.88750000 -6.64165006 -3.27936552 10.48566600 -6.75129084 1.82524129 1.18820369 3.23786476 0.00000000 0.00000000 0.00000000 0.27701240 0.79981278 0.00000000 -0.21768585 0.00000000 -2.08995336 0.00000000 2.38400000 164.00000000 23_1K3Q2.PDB 2.03165000 -6.93247509 -0.00000000 -6.56250000 -6.83374842 -3.77391046 11.08736011 -6.76966870 3.79936904 0.91518929 3.59242252 0.00000000 0.00000000 0.00000000 0.27329405 0.78679259 0.00000000 -0.30114011 0.00000000 -2.35914241 0.00000000 2.38400000 164.00000000 24_1K3Q2.PDB 2.14537000 -6.88226303 0.00000000 -4.15000000 -6.29025842 -3.09620813 9.81585989 -6.51742174 1.61734366 0.87589161 3.06628585 0.00000000 0.00000000 0.00000000 0.27744701 0.78144077 0.00000000 -0.28708507 0.00000000 -2.19411769 0.00000000 2.38400000 164.00000000 25_1K3Q2.PDB 2.08459000 -7.66789555 0.00000000 -5.85000000 -5.95707198 -2.73570762 9.65591882 -6.29221421 1.63229564 0.94480803 2.84306590 0.00000000 0.00000000 0.00000000 0.25956959 0.77890310 0.00000000 -0.22031831 0.00000000 -1.94824141 0.00000000 2.38400000 164.00000000 26_1K3Q2.PDB 3.88129000 -7.02592920 0.00000000 -5.55000000 -6.20805041 -2.18504986 9.45015654 -6.60392340 1.60630047 1.24227373 2.71842476 0.00000000 0.00000000 0.00000000 0.29155440 0.77518248 0.00000000 -0.33357037 0.00000000 -1.45404505 0.00000000 2.38400000 164.00000000 27_1K3Q2.PDB 2.60677000 -7.02674250 0.00000000 -5.88750000 -5.98341963 -2.57547215 9.18395534 -6.31962936 1.61420587 2.13345711 2.73415125 0.00000000 0.00000000 0.00000000 0.26870910 0.78120807 0.00000000 -0.38376966 0.00000000 -1.81143036 0.00000000 2.38400000 164.00000000 28_1K3Q2.PDB 2.43228000 -7.79934525 0.00000000 -5.85000000 -5.87514253 -2.75348154 9.44572182 -6.19303504 1.62185278 0.86936526 2.79688142 0.00000000 0.00000000 0.00000000 0.45819794 0.75972784 0.00000000 -0.33104662 0.00000000 -1.98865874 0.00000000 2.38400000 164.00000000 29_1K3Q2.PDB 2.23850000 -8.36580732 0.00000000 -5.88750000 -6.02520408 -2.83741248 9.10405329 -6.37359430 1.58081474 1.37854790 2.84751518 0.00000000 0.00000000 0.00000000 0.29979055 0.77778543 0.00000000 -0.41671836 0.00000000 -2.03609976 0.00000000 2.38400000 164.00000000 30_1K3Q2.PDB 1.93899000 -7.53391474 0.00000000 -5.88750000 -5.69880703 -2.84368004 8.88576568 -5.96013454 1.69815992 1.32656502 2.98905938 0.00000000 0.00000000 0.00000000 0.29549206 0.76352579 0.00000000 -0.28247416 0.00000000 -2.05636105 0.00000000 2.38400000 164.00000000