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_1PJN2.PDB 7.17305000 -52.04540615 -13.65000000 -40.90000000 -30.19209070 -12.76966587 52.33930440 -31.57533074 3.67180051 15.50088040 10.06453341 0.00000000 0.00000000 0.00000000 2.56067935 4.71918533 -0.86113506 -0.82638512 0.00000000 -5.40799674 0.00000000 2.38400000 446.00000000 2_1PJN2.PDB 6.84669000 -43.26352626 -12.55000000 -30.18750000 -29.26351212 -14.84597597 51.20619136 -30.56242840 1.68298557 15.56378404 10.47230243 0.00000000 0.00000000 0.00000000 2.73996257 4.31771608 -0.39469182 -0.85518923 0.00000000 -6.26945469 0.00000000 2.38400000 446.00000000 3_1PJN2.PDB 7.57286000 -38.86641240 -11.70000000 -32.08750000 -29.38128029 -12.45238669 48.52565414 -30.92081409 7.89410871 14.44769845 9.63438935 0.00000000 0.00000000 0.00000000 3.65749382 4.42192282 -0.48352826 -0.60676389 0.00000000 -5.39348366 0.00000000 2.38400000 446.00000000 4_1PJN2.PDB 11.48730000 -42.24700708 -15.38750000 -32.37500000 -29.69388115 -10.94973241 50.99149417 -31.90754751 5.83132602 13.57309735 11.08305839 0.00000000 0.00000000 0.00000000 2.28706136 4.80492149 -0.80981606 -0.14256244 0.00000000 -4.74700481 0.00000000 2.38400000 446.00000000 5_1PJN2.PDB 7.17377000 -42.01932905 -11.70000000 -33.42500000 -30.24953272 -10.78411723 49.43010277 -32.22663644 6.17017293 14.46698727 9.53030757 0.00000000 0.00000000 0.00000000 2.60969267 4.56936884 -0.54954952 -0.29128393 0.00000000 -5.00047242 0.00000000 2.38400000 446.00000000 6_1PJN2.PDB 9.12038000 -40.37104587 -11.70000000 -27.47500000 -28.81401668 -11.76657129 46.71182471 -32.17065754 3.06172671 15.42587084 9.22897328 0.00000000 0.00000000 0.00000000 3.65778053 3.90719958 -0.41411146 -0.96388227 0.00000000 -5.15298269 0.00000000 2.38400000 446.00000000 7_1PJN2.PDB 7.01773000 -43.19726813 -13.65000000 -32.68750000 -29.98421677 -13.22284298 49.13060056 -32.10034584 6.47881606 14.80160303 10.54976896 0.00000000 0.00000000 0.00000000 4.23832288 4.25461621 -0.49207930 -0.65133167 0.00000000 -5.60806306 0.00000000 2.38400000 446.00000000 8_1PJN2.PDB 8.38801000 -44.12050585 -11.66250000 -30.40000000 -29.70199293 -11.82810493 47.37337853 -31.77767708 2.19203348 15.55426318 9.84825716 0.00000000 0.00000000 0.00000000 3.12688774 4.63402226 -0.52738300 -0.96415894 0.00000000 -5.35350906 0.00000000 2.38400000 446.00000000 9_1PJN2.PDB 9.84605000 -42.72345035 -12.80000000 -32.23750000 -30.32727018 -13.70207775 50.85618496 -32.37369436 3.92872200 14.99476413 11.51484999 0.00000000 0.00000000 0.00000000 4.02010060 4.35247108 -0.49839638 -0.43781545 0.00000000 -5.66131792 0.00000000 2.38400000 446.00000000 10_1PJN2.PDB 7.95299000 -36.50430550 -9.96250000 -28.28750000 -29.69656595 -10.25760702 47.53707403 -32.02354667 6.17018410 14.77777350 9.28911134 0.00000000 0.00000000 0.00000000 2.15301768 4.56613971 -0.47532370 -0.72160914 0.00000000 -5.00681367 0.00000000 2.38400000 446.00000000 11_1PJN2.PDB 6.59399000 -40.18541085 -10.81250000 -30.91250000 -28.44589077 -12.38261132 48.80978881 -30.04967467 1.95349451 16.31062158 9.84698632 0.00000000 0.00000000 0.00000000 2.06232671 4.35441236 -0.50102631 -0.49442116 0.00000000 -5.57000457 0.00000000 2.38400000 446.00000000 12_1PJN2.PDB 6.52016000 -43.24423677 -12.55000000 -30.87500000 -28.14902447 -12.55364791 48.35561977 -30.43505055 1.82809961 15.75659231 10.06699921 0.00000000 0.00000000 0.00000000 2.29177326 3.91682452 -0.45155433 -0.74683268 0.00000000 -5.78221100 0.00000000 2.38400000 446.00000000 13_1PJN2.PDB 7.08142000 -39.43568568 -11.70000000 -28.32500000 -28.94148946 -12.25553473 48.86636291 -31.21586695 1.61959845 15.95012724 10.83630388 0.00000000 0.00000000 0.00000000 1.97435899 4.34534804 -0.52662220 -0.50185615 0.00000000 -5.21606764 0.00000000 2.38400000 446.00000000 14_1PJN2.PDB 6.50710000 -48.22952015 -13.40000000 -35.83750000 -29.58855772 -14.16852781 51.94325721 -31.23754335 2.26651200 16.47416741 10.76947879 0.00000000 0.00000000 0.00000000 2.97938633 4.23933408 -0.56831978 -1.61745731 0.00000000 -6.24441592 0.00000000 2.38400000 446.00000000 15_1PJN2.PDB 8.53971000 -44.47950450 -11.95000000 -31.35000000 -30.99060978 -12.76115060 49.08155785 -33.98721668 6.19798312 14.86549277 8.84719705 0.00000000 0.00000000 0.00000000 3.89608252 4.30426854 -0.52150366 -0.48484647 0.00000000 -5.32249063 0.00000000 2.38400000 446.00000000 16_1PJN2.PDB 7.83170000 -45.78211372 -14.28750000 -33.12500000 -31.07326164 -13.45611659 53.11778775 -33.96607192 4.12260728 16.04017528 10.47213351 0.00000000 0.00000000 0.00000000 3.02123492 4.25751360 -0.72555213 -0.21090723 0.00000000 -5.71164296 0.00000000 2.38400000 446.00000000 17_1PJN2.PDB 6.88370000 -41.31194990 -10.17500000 -29.43750000 -28.72937077 -14.11067377 48.83808701 -30.71291144 2.58772407 14.65648943 9.65952574 0.00000000 0.00000000 0.00000000 2.93513380 4.49930732 -0.61636023 -0.16594868 0.00000000 -6.04114506 0.00000000 2.38400000 446.00000000 18_1PJN2.PDB 8.07336000 -43.35950934 -11.73750000 -29.47500000 -31.17355757 -12.97182638 49.26368065 -34.16204560 6.37479341 15.50343900 9.58696022 0.00000000 0.00000000 0.00000000 3.16876229 4.29911414 -0.44776961 -1.71203885 0.00000000 -5.57740690 0.00000000 2.38400000 446.00000000 19_1PJN2.PDB 7.67710000 -46.02101888 -13.65000000 -32.13750000 -31.19400018 -13.54881407 51.18081042 -34.23773732 6.54570034 15.54931750 9.76981377 0.00000000 0.00000000 0.00000000 3.07002801 4.03603669 -0.41109572 -1.17585438 0.00000000 -5.78168724 0.00000000 2.38400000 446.00000000 20_1PJN2.PDB 8.42792000 -46.68081689 -10.81250000 -32.67500000 -30.32362950 -13.61217728 50.61934112 -32.93422311 2.63114505 15.24029953 10.03464232 0.00000000 0.00000000 0.00000000 2.50515072 4.29830277 -0.55487823 -0.85756350 0.00000000 -5.94142399 0.00000000 2.38400000 446.00000000 21_1PJN2.PDB 6.62409000 -46.32970681 -11.70000000 -33.83750000 -29.99807023 -14.88005495 50.95264440 -31.55332520 3.78238779 15.27178457 10.50271809 0.00000000 0.00000000 0.00000000 2.45399184 4.40503952 -0.51192164 -0.80089221 0.00000000 -6.01146928 0.00000000 2.38400000 446.00000000 22_1PJN2.PDB 9.54443000 -50.52169306 -11.98750000 -37.38750000 -31.01482732 -14.90409650 52.59441074 -33.20846129 3.00737549 15.06617251 10.15700947 0.00000000 0.00000000 0.00000000 4.60210439 4.13620635 -0.60053130 -0.62347149 0.00000000 -6.22237776 0.00000000 2.38400000 446.00000000 23_1PJN2.PDB 9.06030000 -41.35263736 -11.70000000 -28.32500000 -29.19086690 -15.99162904 48.88423527 -30.69121306 4.92927997 14.76623674 10.39012376 0.00000000 0.00000000 0.00000000 2.75033325 4.39191161 -0.44784213 -0.60242155 0.00000000 -6.12387367 0.00000000 2.38400000 446.00000000 24_1PJN2.PDB 8.39454000 -49.52804170 -11.70000000 -37.33750000 -30.81882105 -14.07541334 52.59130062 -32.93141898 3.20025665 15.45908219 10.15416844 0.00000000 0.00000000 0.00000000 2.63144594 4.36385036 -0.61058336 -0.36818756 0.00000000 -5.72237124 0.00000000 2.38400000 446.00000000 25_1PJN2.PDB 6.06298000 -46.58923231 -12.80000000 -31.98750000 -30.01086564 -14.16154175 51.21502738 -31.55580068 2.94248397 15.58034223 9.29627183 0.00000000 0.00000000 0.00000000 2.20179846 4.48482907 -0.59875605 -0.72996728 0.00000000 -5.98072478 0.00000000 2.38400000 446.00000000 26_1PJN2.PDB 10.14910000 -38.60806394 -8.18750000 -31.08750000 -28.81647796 -10.53469019 45.57158378 -31.93816427 6.08499320 14.40902001 9.07716080 0.00000000 0.00000000 0.00000000 2.80752935 4.07095450 -0.29220282 -0.96967428 0.00000000 -4.73214156 0.00000000 2.38400000 446.00000000 27_1PJN2.PDB 7.66557000 -42.22412776 -10.85000000 -31.47500000 -30.29070314 -15.65633074 50.25241168 -32.50114213 6.96702896 15.56302323 10.24485988 0.00000000 0.00000000 0.00000000 3.28979694 4.46002307 -0.39272506 -1.13132666 0.00000000 -6.24402073 0.00000000 2.38400000 446.00000000 28_1PJN2.PDB 7.35848000 -39.50233129 -15.17500000 -29.25000000 -28.94060810 -10.72354239 47.94868099 -31.09189041 6.14483744 14.68379756 9.93256842 0.00000000 0.00000000 0.00000000 2.43125677 4.12092065 -0.37306252 -0.46899059 0.00000000 -4.62037846 0.00000000 2.38400000 446.00000000 29_1PJN2.PDB 5.47606000 -43.92998219 -9.96250000 -30.21250000 -29.77752675 -12.71432010 49.40861012 -31.65140004 1.30850423 14.90614245 9.78373866 0.00000000 0.00000000 0.00000000 1.92783485 4.59557462 -0.38687011 -0.88794655 0.00000000 -5.67174895 0.00000000 2.38400000 446.00000000 30_1PJN2.PDB 7.95345000 -44.39808553 -11.70000000 -32.46250000 -31.22856247 -15.39490277 52.78105651 -33.40293451 6.00107505 16.68370239 9.82542348 0.00000000 0.00000000 0.00000000 2.68501484 4.24866514 -0.53909500 -1.33713860 0.00000000 -6.30922444 0.00000000 2.38400000 446.00000000