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_1JLU2.PDB 7.30940000 -34.04615602 -8.72500000 -17.76250000 -23.96901289 -7.38470121 34.30870302 -30.07865644 2.41427354 8.81155552 8.20833767 0.00000000 0.00000000 0.00000000 3.60958348 1.42065593 0.02043670 -0.87740569 0.00000000 -2.62176972 0.00000000 2.38400000 359.00000000 2_1JLU2.PDB 8.19004000 -31.59348987 -9.32500000 -13.07500000 -23.53949677 -8.87598170 35.07184918 -29.60563350 2.08580354 9.18139040 7.19812786 0.00000000 0.00000000 0.00000000 2.56475517 1.52495602 0.01339235 -0.24268046 0.00000000 -3.04501593 0.00000000 2.38400000 359.00000000 3_1JLU2.PDB 7.03376000 -31.11635318 -9.32500000 -15.28750000 -21.88778183 -6.18438868 32.35974916 -26.55170367 0.96944786 7.84279594 8.29821336 0.00000000 0.00000000 0.00000000 2.12119162 1.25348724 0.01319474 -1.08613352 0.00000000 -2.39843817 0.00000000 2.38400000 359.00000000 4_1JLU2.PDB 7.05831000 -26.28763524 -7.83750000 -16.08750000 -20.97703133 -5.52110171 31.07368051 -25.46676632 2.60688788 7.68578454 8.90391163 0.00000000 0.00000000 0.00000000 2.51541940 1.28325828 0.01241263 -0.76039990 0.00000000 -2.43543256 0.00000000 2.38400000 359.00000000 5_1JLU2.PDB 7.92021000 -35.02914666 -9.61250000 -19.05000000 -23.86504631 -7.82957387 34.97646191 -29.80149214 2.39888299 9.39530699 8.26687289 0.00000000 0.00000000 0.00000000 3.39161511 1.42598167 0.01451255 -0.44259090 0.00000000 -2.87159586 0.00000000 2.38400000 359.00000000 6_1JLU2.PDB 7.88525000 -30.49826969 -9.61250000 -18.12500000 -20.53156401 -6.41029905 31.87848095 -25.12826434 0.81723920 7.65022162 8.87050563 0.00000000 0.00000000 0.00000000 3.77587967 1.33881320 0.01176059 -1.12332804 0.00000000 -2.57140192 0.00000000 2.38400000 359.00000000 7_1JLU2.PDB 7.56019000 -33.42589178 -9.32500000 -16.25000000 -23.09846709 -8.38529564 34.84479334 -28.59171644 1.45159242 9.57755657 6.92703366 0.00000000 0.00000000 0.00000000 2.82575360 1.50002705 0.01796389 -0.30419412 0.00000000 -3.11591198 0.00000000 2.38400000 359.00000000 8_1JLU2.PDB 7.75483000 -35.63704029 -10.21250000 -19.07500000 -23.50611567 -7.37806864 34.37879061 -29.29661151 1.92855223 9.39557231 8.17566178 0.00000000 0.00000000 0.00000000 3.56921162 1.45986227 0.01322153 -0.79140577 0.00000000 -2.83834879 0.00000000 2.38400000 359.00000000 9_1JLU2.PDB 7.35010000 -28.55004772 -8.72500000 -15.23750000 -22.51767042 -5.57276427 32.09123051 -27.80221150 2.13828800 7.67697940 9.55180121 0.00000000 0.00000000 0.00000000 3.02112501 1.51152531 0.01137882 -0.83525205 0.00000000 -2.35045245 0.00000000 2.38400000 359.00000000 10_1JLU2.PDB 7.46516000 -27.12345058 -7.87500000 -10.83750000 -21.36052607 -7.11404381 30.62213317 -27.76032527 1.49052089 5.96161690 9.51904809 0.00000000 0.00000000 0.00000000 4.23615805 1.48532125 0.01927992 -0.87481218 0.00000000 -3.15000028 0.00000000 2.38400000 359.00000000 11_1JLU2.PDB 9.40601000 -32.26773946 -8.43750000 -15.91250000 -24.23624398 -7.83410237 34.27160109 -30.40059963 2.72618394 10.39763828 7.33256156 0.00000000 0.00000000 0.00000000 3.36646382 1.54757660 0.02379614 -0.52240846 0.00000000 -3.04262986 0.00000000 2.38400000 359.00000000 12_1JLU2.PDB 6.39664000 -28.10857714 -8.72500000 -15.53750000 -21.99859930 -6.04616775 32.29412942 -26.75094536 1.79489198 7.69818583 9.37191208 0.00000000 0.00000000 0.00000000 2.96756025 1.42900817 0.01646582 -0.64361416 0.00000000 -2.54989597 0.00000000 2.38400000 359.00000000 13_1JLU2.PDB 8.57983000 -30.06552206 -7.83750000 -12.55000000 -23.48651551 -7.97132126 33.76722029 -29.20090857 1.61600004 8.76485081 7.11039721 0.00000000 0.00000000 0.00000000 3.18129283 1.49220379 0.02392132 -0.67645142 0.00000000 -2.80650778 0.00000000 2.38400000 359.00000000 14_1JLU2.PDB 8.78694000 -28.56322762 -9.28750000 -12.73750000 -22.85085004 -7.31361827 33.23963311 -28.61470630 2.06938103 9.11407396 7.79240169 0.00000000 0.00000000 0.00000000 3.29650658 1.40790307 0.01035548 -0.69973087 0.00000000 -2.58167400 0.00000000 2.38400000 359.00000000 15_1JLU2.PDB 6.34205000 -30.02153186 -9.57500000 -16.12500000 -20.92554305 -5.96693419 31.06165395 -25.53622655 1.80246708 8.09674061 8.53370750 0.00000000 0.00000000 0.00000000 2.29594920 1.34886808 0.01509614 -1.06016549 0.00000000 -2.63827705 0.00000000 2.38400000 359.00000000 16_1JLU2.PDB 7.13183000 -35.86320007 -7.87500000 -15.02500000 -22.79973761 -8.01642424 32.19534007 -29.74464395 2.21030365 7.93614625 7.85580406 0.00000000 0.00000000 0.00000000 1.98821380 1.24434435 0.02219210 -1.33703091 0.00000000 -3.27336330 0.00000000 2.38400000 359.00000000 17_1JLU2.PDB 6.64997000 -31.33416690 -9.61250000 -13.95000000 -22.93031325 -7.57266017 33.09720156 -28.71808368 1.52173025 8.80084659 8.34985317 0.00000000 0.00000000 0.00000000 3.01797616 1.45198265 0.01248194 -0.50659695 0.00000000 -2.84410252 0.00000000 2.38400000 359.00000000 18_1JLU2.PDB 6.60186000 -30.67996480 -8.72500000 -16.05000000 -22.30591653 -6.84534449 33.71359563 -27.35033843 1.18262847 7.27540978 9.48514539 0.00000000 0.00000000 0.00000000 2.65818206 1.39141866 0.01690545 -0.95621732 0.00000000 -2.77901482 0.00000000 2.38400000 359.00000000 19_1JLU2.PDB 6.77307000 -32.04723617 -10.46250000 -15.57500000 -23.85634407 -7.69432936 36.23489110 -29.41176915 1.31813711 9.51913343 7.18955252 0.00000000 0.00000000 0.00000000 3.77554361 1.53146378 0.01607599 -0.17390207 0.00000000 -2.92672528 0.00000000 2.38400000 359.00000000 20_1JLU2.PDB 6.76260000 -26.00933257 -7.83750000 -12.61250000 -22.36860257 -6.14769093 32.42239763 -27.38695424 1.36375134 7.70145345 9.54488175 0.00000000 0.00000000 0.00000000 3.08826756 1.40509540 0.00983249 -1.13281676 0.00000000 -2.65385230 0.00000000 2.38400000 359.00000000 21_1JLU2.PDB 8.71905000 -34.12777843 -6.95000000 -11.46250000 -24.03649258 -8.46846614 32.94366769 -32.09302194 1.93944959 7.43675398 7.48878941 0.00000000 0.00000000 0.00000000 2.77166309 1.50543638 0.02371768 -0.37884927 0.00000000 -3.34248994 0.00000000 2.38400000 359.00000000 22_1JLU2.PDB 7.47854000 -31.41187654 -8.68750000 -16.61250000 -24.00374839 -7.16378882 36.75364689 -30.18022192 2.28167798 9.71299450 7.09315329 0.00000000 0.00000000 0.00000000 2.88870825 1.53170551 0.01494392 -0.80284322 0.00000000 -2.70639903 0.00000000 2.38400000 359.00000000 23_1JLU2.PDB 7.73260000 -32.94161060 -7.83750000 -12.92500000 -23.89817162 -8.40161067 33.08846445 -30.20376657 1.97162615 8.77616421 8.06194814 0.00000000 0.00000000 0.00000000 2.59927071 1.50480877 0.01678420 -1.13713881 0.00000000 -3.05268081 0.00000000 2.38400000 359.00000000 24_1JLU2.PDB 7.99272000 -25.34953902 -8.43750000 -12.70000000 -22.25397761 -7.64570114 33.18737299 -27.16109024 4.89230536 9.04186917 6.82536256 0.00000000 0.00000000 0.00000000 2.08659484 1.36974087 0.02248569 -0.40668793 0.00000000 -2.80057270 0.00000000 2.38400000 359.00000000 25_1JLU2.PDB 6.90729000 -28.52464193 -7.83750000 -12.21250000 -23.21223516 -7.67862363 33.47042289 -29.03191255 1.62199735 8.89797624 7.95181869 0.00000000 0.00000000 0.00000000 2.91451056 1.48779776 0.01911591 -0.43309866 0.00000000 -2.99461357 0.00000000 2.38400000 359.00000000 26_1JLU2.PDB 6.72275000 -31.72017010 -7.87500000 -12.17500000 -22.80746227 -6.78237986 31.09610994 -29.67454112 1.29105110 6.51820007 9.54689406 0.00000000 0.00000000 0.00000000 2.88543699 1.45327449 0.01747474 -0.59363588 0.00000000 -3.16731785 0.00000000 2.38400000 359.00000000 27_1JLU2.PDB 8.91387000 -29.41302210 -8.68750000 -15.61250000 -24.31531018 -7.99911942 34.74498319 -30.10161511 6.87190939 9.15510940 7.37001983 0.00000000 0.00000000 0.00000000 3.69228401 1.57121631 0.00766080 -1.37667955 0.00000000 -3.16226445 0.00000000 2.38400000 359.00000000 28_1JLU2.PDB 6.57689000 -29.29973171 -9.36250000 -15.83750000 -21.71613868 -5.83978065 32.80136328 -26.92635978 1.57812124 8.07013524 9.28292865 0.00000000 0.00000000 0.00000000 2.05852171 1.47618301 0.01125431 -0.86272249 0.00000000 -2.55705455 0.00000000 2.38400000 359.00000000 29_1JLU2.PDB 7.33470000 -30.45276260 -7.87500000 -11.17500000 -21.97547113 -6.84304201 30.17139077 -28.57296792 1.33371945 6.02510796 9.54604782 0.00000000 0.00000000 0.00000000 2.82350918 1.47354108 0.02109165 -1.03831149 0.00000000 -2.89383686 0.00000000 2.38400000 359.00000000 30_1JLU2.PDB 7.25595000 -31.55057330 -7.83750000 -13.91250000 -22.45203130 -8.10685282 32.68092880 -28.34759523 1.70920169 9.06560137 7.31766095 0.00000000 0.00000000 0.00000000 1.90155272 1.20439200 0.02006142 -0.54445847 0.00000000 -3.04464243 0.00000000 2.38400000 359.00000000