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_1XH62.PDB 5.33095000 -41.14079184 -7.48750000 -17.33750000 -23.44841282 -11.15180855 32.01779415 -30.11016080 1.65129345 12.51382742 6.31156749 0.00000000 0.00000000 0.00000000 1.85499918 0.68445077 0.10002367 -1.35281168 0.00000000 -4.70210335 0.00000000 2.38400000 353.00000000 2_1XH62.PDB 8.55477000 -39.95233382 -7.45000000 -15.38750000 -22.57783508 -12.66114866 31.91199381 -28.91889167 1.71696955 10.97140785 6.28017734 0.00000000 0.00000000 0.00000000 1.56269966 0.67615458 0.11244132 -0.24709807 0.00000000 -5.26554986 0.00000000 2.38400000 353.00000000 3_1XH62.PDB 8.48760000 -38.65338417 -5.92500000 -16.41250000 -22.19670707 -13.65575968 32.69212239 -27.47084089 1.71373323 10.75140680 6.59545170 0.00000000 0.00000000 0.00000000 1.66274820 0.65985718 0.12438036 -1.02710997 0.00000000 -5.50530923 0.00000000 2.38400000 353.00000000 4_1XH62.PDB 6.01107000 -41.78029274 -6.56250000 -17.30000000 -23.40000580 -13.71001750 32.90808624 -29.52160883 1.03940668 12.42614061 6.81664573 0.00000000 0.00000000 0.00000000 2.04628056 0.71478379 0.11324588 -1.16280659 0.00000000 -5.47315974 0.00000000 2.38400000 353.00000000 5_1XH62.PDB 4.94884000 -42.10606194 -8.33750000 -16.30000000 -23.69682615 -12.72469251 33.46839005 -29.99247936 1.50401528 11.63155494 7.09071638 0.00000000 0.00000000 0.00000000 1.59826810 0.72198977 0.11267592 -1.22239318 0.00000000 -5.23779142 0.00000000 2.38400000 353.00000000 6_1XH62.PDB 4.69900000 -43.16576636 -6.56250000 -17.30000000 -22.96155339 -13.55944178 31.56710462 -29.47899088 0.79447684 12.03943835 6.55596122 0.00000000 0.00000000 0.00000000 1.63009465 0.70821719 0.11366339 -0.73941238 0.00000000 -5.26460701 0.00000000 2.38400000 353.00000000 7_1XH62.PDB 6.23346000 -41.39689712 -5.67500000 -20.12500000 -22.83056507 -12.39715131 32.41981047 -29.08022861 1.30497169 12.94682743 6.42562934 0.00000000 0.00000000 0.00000000 1.71833448 0.71862393 0.08828249 -1.22598491 0.00000000 -4.96682311 0.00000000 2.38400000 353.00000000 8_1XH62.PDB 8.23589000 -40.76905580 -7.45000000 -17.37500000 -22.12308467 -12.92273725 31.13550191 -27.87205719 2.02559720 12.16580659 6.37526168 0.00000000 0.00000000 0.00000000 1.68994359 0.68555460 0.11289740 -1.33000885 0.00000000 -5.20117620 0.00000000 2.38400000 353.00000000 9_1XH62.PDB 5.81780000 -40.52936799 -8.33750000 -14.78750000 -23.47959952 -12.86511589 32.22780100 -29.75583238 1.03918591 12.91589990 6.43695471 0.00000000 0.00000000 0.00000000 1.97641156 0.68224887 0.11120512 -0.87543198 0.00000000 -5.13584642 0.00000000 2.38400000 353.00000000 10_1XH62.PDB 4.94636000 -40.17294608 -6.60000000 -15.67500000 -22.72748242 -12.09547649 30.51780800 -29.39967674 1.30167479 12.11820758 6.14391942 0.00000000 0.00000000 0.00000000 1.83863999 0.65219321 0.08955741 -0.83371806 0.00000000 -4.85139956 0.00000000 2.38400000 353.00000000 11_1XH62.PDB 5.24342000 -41.22095522 -6.60000000 -16.93750000 -22.04859893 -13.44656602 30.78903877 -27.57640850 0.79092041 11.87772816 6.19183086 0.00000000 0.00000000 0.00000000 1.64375866 0.66114061 0.10963154 -0.79919743 0.00000000 -5.21559273 0.00000000 2.38400000 353.00000000 12_1XH62.PDB 4.91135000 -42.83521657 -7.45000000 -15.60000000 -23.52048338 -14.20589349 32.65380019 -29.87298875 1.88333466 11.33593836 6.52387460 0.00000000 0.00000000 0.00000000 1.76770021 0.71452591 0.11312763 -1.18038366 0.00000000 -5.28324294 0.00000000 2.38400000 353.00000000 13_1XH62.PDB 8.13680000 -41.42071395 -5.92500000 -20.22500000 -23.10797201 -12.26847734 33.19378775 -29.61626163 1.40110390 12.11352752 6.56758228 0.00000000 0.00000000 0.00000000 1.92292053 0.67931139 0.11923709 -0.86555369 0.00000000 -4.73060836 0.00000000 2.38400000 353.00000000 14_1XH62.PDB 5.86597000 -41.66438718 -8.33750000 -16.45000000 -23.10652942 -13.27030123 32.13569422 -29.24184078 1.69231158 12.44110522 6.94453480 0.00000000 0.00000000 0.00000000 1.79461282 0.71416470 0.11245253 -0.92108153 0.00000000 -5.45784540 0.00000000 2.38400000 353.00000000 15_1XH62.PDB 5.08091000 -44.28211437 -9.18750000 -18.05000000 -22.16694282 -12.88662397 30.71303339 -27.98791692 1.21702220 12.26680190 6.13729762 0.00000000 0.00000000 0.00000000 1.64665739 0.54030928 0.08661900 -0.99936462 0.00000000 -5.07119754 0.00000000 2.38400000 353.00000000 16_1XH62.PDB 8.23071000 -39.72957622 -7.45000000 -12.08750000 -23.10459073 -13.15882117 31.09233851 -29.78802175 2.00547450 10.64733629 6.48604391 0.00000000 0.00000000 0.00000000 1.75232205 0.68760642 0.11889657 -0.73965870 0.00000000 -5.50339570 0.00000000 2.38400000 353.00000000 17_1XH62.PDB 5.62806000 -41.88925773 -8.33750000 -16.30000000 -23.44587854 -11.75743206 31.54163917 -30.33118639 1.25438856 12.88499581 6.61869314 0.00000000 0.00000000 0.00000000 2.17017603 0.68325125 0.08510765 -1.24000343 0.00000000 -5.03225765 0.00000000 2.38400000 353.00000000 18_1XH62.PDB 8.41020000 -41.99138048 -7.45000000 -15.60000000 -23.82591852 -14.47090517 32.84078981 -29.95259933 1.94831544 12.62374783 6.43919373 0.00000000 0.00000000 0.00000000 1.67549763 0.72172929 0.12307002 -0.84775456 0.00000000 -5.49481737 0.00000000 2.38400000 353.00000000 19_1XH62.PDB 4.64004000 -40.69640203 -6.56250000 -18.05000000 -22.80425705 -11.96517353 32.23941966 -28.97266595 1.01198088 12.44402319 6.18032766 0.00000000 0.00000000 0.00000000 1.48809113 0.68762153 0.11161823 -1.43184809 0.00000000 -4.38541816 0.00000000 2.38400000 353.00000000 20_1XH62.PDB 5.34576000 -37.32286757 -6.56250000 -15.45000000 -21.47291633 -11.39133468 29.54246468 -27.03215031 1.23930779 10.61330133 6.78819192 0.00000000 0.00000000 0.00000000 1.71215669 0.62241548 0.05383591 -1.02453469 0.00000000 -4.33868988 0.00000000 2.38400000 353.00000000 21_1XH62.PDB 8.18367000 -38.99184227 -8.33750000 -12.78750000 -22.49971754 -12.82898382 31.48778923 -28.16168465 1.90884260 10.39228235 6.72394310 0.00000000 0.00000000 0.00000000 1.62648045 0.70288757 0.11914345 -1.25805761 0.00000000 -5.37687983 0.00000000 2.38400000 353.00000000 22_1XH62.PDB 5.26082000 -42.56071523 -8.55000000 -19.92500000 -23.40489757 -11.72756635 33.54193270 -29.70850878 0.78609209 13.31461878 7.02453938 0.00000000 0.00000000 0.00000000 1.85218122 0.65356745 0.12342027 -1.24060288 0.00000000 -4.64692410 0.00000000 2.38400000 353.00000000 23_1XH62.PDB 5.78902000 -41.95905614 -8.33750000 -16.45000000 -23.00563801 -13.15481365 32.09171180 -29.01166034 1.40553728 12.01858559 6.57574336 0.00000000 0.00000000 0.00000000 1.93269142 0.68683012 0.11261001 -1.00731563 0.00000000 -5.12900799 0.00000000 2.38400000 353.00000000 24_1XH62.PDB 5.32517000 -42.10623418 -6.81250000 -16.41250000 -23.17641437 -11.37086982 31.57663203 -29.87210472 0.99751006 10.71408617 6.56937591 0.00000000 0.00000000 0.00000000 1.79936805 0.72667634 0.11114212 -1.51806478 0.00000000 -4.71189482 0.00000000 2.38400000 353.00000000 25_1XH62.PDB 5.44723000 -43.01491459 -7.45000000 -17.30000000 -23.03492623 -13.51151918 32.10755776 -29.63029220 1.04747476 12.05921210 6.59293134 0.00000000 0.00000000 0.00000000 1.79071520 0.68132482 0.10701085 -0.70575045 0.00000000 -5.08732855 0.00000000 2.38400000 353.00000000 26_1XH62.PDB 5.05176000 -41.47263649 -7.45000000 -17.37500000 -22.57526582 -13.55834838 31.59372863 -28.21616802 1.06800956 12.84723512 6.52952588 0.00000000 0.00000000 0.00000000 1.65569724 0.67327484 0.11072041 -0.70510604 0.00000000 -5.39766507 0.00000000 2.38400000 353.00000000 27_1XH62.PDB 7.17865000 -40.71525341 -8.33750000 -14.75000000 -22.82074745 -12.69423242 31.57866945 -28.84663570 1.16383561 10.96862264 6.77156259 0.00000000 0.00000000 0.00000000 1.93741982 0.68853598 0.11327389 -0.89337097 0.00000000 -4.90615087 0.00000000 2.38400000 353.00000000 28_1XH62.PDB 4.85233000 -40.15408304 -7.45000000 -18.27500000 -23.19530184 -12.03681927 32.44299106 -29.54477936 2.44814771 12.93746116 6.86810311 0.00000000 0.00000000 0.00000000 1.49223785 0.68116946 0.08606376 -0.86867770 0.00000000 -5.05850951 0.00000000 2.38400000 353.00000000 29_1XH62.PDB 5.08544000 -44.46872610 -8.33750000 -18.22500000 -23.66648293 -12.99880661 33.07772155 -30.10111939 1.05406035 12.77792279 6.87891729 0.00000000 0.00000000 0.00000000 1.74481050 0.69230926 0.10962138 -1.53620325 0.00000000 -5.24666777 0.00000000 2.38400000 353.00000000 30_1XH62.PDB 4.82144000 -42.02626387 -8.33750000 -17.22500000 -23.46224315 -13.56987793 32.69290869 -29.56352716 2.86872281 12.79736477 6.61957604 0.00000000 0.00000000 0.00000000 1.72446465 0.68545675 0.11344979 -1.21583057 0.00000000 -5.46877181 0.00000000 2.38400000 353.00000000