name total energy Backbone Hbon 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_1A0R2.PDB 52.46978738 -285.28750000 -157.25000000 -435.40195221 -24.38857951 584.14366702 -513.52085447 52.45252427 222.93604002 581.81711950 0.00000000 0.00000000 0.00000000 30.06917483 52.21320775 -0.23837904 -1.67662677 0.00000000 -1.18484626 0.00000000 0.00000000 359.00000000 2_1A0R2.PDB 56.67504135 -285.92500000 -156.15000000 -435.42817900 -24.64001333 586.71713281 -512.39038324 52.72062081 222.64428820 581.97374527 0.00000000 0.00000000 0.00000000 30.84567214 52.22818866 -0.24215669 -1.82460037 0.00000000 -1.62608525 0.00000000 0.00000000 359.00000000 3_1A0R2.PDB 57.94394660 -285.32500000 -155.13750000 -434.42128204 -24.17471329 585.71788738 -511.09196352 52.24896318 221.87737836 582.01563407 0.00000000 0.00000000 0.00000000 29.84324537 53.13521086 -0.21519058 -1.76303224 0.00000000 -1.63048008 0.00000000 0.00000000 359.00000000 4_1A0R2.PDB 54.44318351 -287.70000000 -157.92500000 -434.18583011 -23.03209394 585.54638231 -511.10956489 51.72967100 222.65580484 581.87636556 0.00000000 0.00000000 0.00000000 29.53587539 52.71861415 -0.24356846 -1.63169616 0.00000000 -1.07316203 0.00000000 0.00000000 359.00000000 5_1A0R2.PDB 56.88495152 -286.85000000 -153.82500000 -433.50153881 -23.15302584 582.97709580 -510.68513683 49.40512086 221.97998801 581.82102192 0.00000000 0.00000000 0.00000000 31.38700003 52.24942868 -0.30251541 -1.57092054 0.00000000 -0.79713765 0.00000000 0.00000000 359.00000000 6_1A0R2.PDB 67.40760243 -284.83750000 -154.85000000 -434.23836741 -24.12126981 586.04230885 -510.94177971 57.93622533 222.09241780 581.96766229 0.00000000 0.00000000 0.00000000 31.70599734 52.46665418 -0.21850281 -1.62619110 0.00000000 -1.50339834 0.00000000 0.00000000 359.00000000 7_1A0R2.PDB 51.60431871 -285.32500000 -154.76250000 -434.63902046 -22.48817525 582.38398651 -512.75052610 49.25522546 221.06047161 582.23405494 0.00000000 0.00000000 0.00000000 28.98609141 52.14376620 -0.32660149 -1.57080493 0.00000000 -0.45288298 0.00000000 0.00000000 359.00000000 8_1A0R2.PDB 52.49992936 -285.92500000 -155.77500000 -435.12995441 -22.57216512 583.30221323 -512.53381690 50.16755127 221.82204216 581.59576312 0.00000000 0.00000000 0.00000000 29.89036975 52.30942875 -0.31496664 -1.64834835 0.00000000 -0.37875875 0.00000000 0.00000000 359.00000000 9_1A0R2.PDB 52.07841633 -286.96250000 -156.08750000 -435.62353288 -24.53413987 584.41222245 -513.48300066 52.38498485 223.01493811 582.32307992 0.00000000 0.00000000 0.00000000 29.77722284 52.11074453 -0.22813029 -1.61507402 0.00000000 -1.30015414 0.00000000 0.00000000 359.00000000 10_1A0R2.PDB 59.19511710 -285.28750000 -155.26250000 -433.62093572 -24.07914386 582.99299079 -510.69460551 52.33815850 222.53051474 581.97959141 0.00000000 0.00000000 0.00000000 31.22259534 52.26557950 -0.18910942 -1.57779188 0.00000000 -1.15714730 0.00000000 0.00000000 359.00000000 11_1A0R2.PDB 51.58927707 -288.06250000 -157.95000000 -435.15400773 -24.40950906 583.81523184 -512.46366454 53.08252093 223.06746279 582.05392902 0.00000000 0.00000000 0.00000000 30.85502938 52.16582774 -0.27054408 -1.86894953 0.00000000 -1.10572196 0.00000000 0.00000000 359.00000000 12_1A0R2.PDB 55.08590538 -287.70000000 -157.55000000 -434.68434891 -23.26574670 586.32699811 -510.97089738 50.29751843 222.28766374 582.13411914 0.00000000 0.00000000 0.00000000 31.19925439 52.89992325 -0.26771552 -1.58666740 0.00000000 -1.13427252 0.00000000 0.00000000 359.00000000 13_1A0R2.PDB 58.35139987 -285.92500000 -155.77500000 -434.32170606 -23.69034754 585.52046753 -510.90992440 51.18393086 221.70548012 581.84805119 0.00000000 0.00000000 0.00000000 32.05687783 52.41603792 -0.26958463 -1.72927478 0.00000000 -1.34257025 0.00000000 0.00000000 359.00000000 14_1A0R2.PDB 54.84131242 -285.96250000 -155.77500000 -433.48176637 -22.49877633 582.12477877 -510.26382858 48.86416894 221.21376485 582.17555784 0.00000000 0.00000000 0.00000000 31.05537422 52.64374596 -0.32441388 -1.66316305 0.00000000 -0.62288398 0.00000000 0.00000000 359.00000000 15_1A0R2.PDB 52.50880804 -286.85000000 -154.88750000 -434.28087305 -23.17904127 583.02363246 -511.82486035 49.65961898 222.56229978 582.14176847 0.00000000 0.00000000 0.00000000 29.16797055 52.31184771 -0.26062574 -1.67446725 0.00000000 -1.08911455 0.00000000 0.00000000 359.00000000 16_1A0R2.PDB 53.29747199 -287.70000000 -157.55000000 -434.75211451 -23.03639964 585.11701664 -511.87212806 51.19833916 222.75375053 582.14470514 0.00000000 0.00000000 0.00000000 29.91585760 52.45306614 -0.28597428 -1.67294049 0.00000000 -0.96264010 0.00000000 0.00000000 359.00000000 17_1A0R2.PDB 52.05606408 -286.81250000 -156.66250000 -435.06314639 -22.53587157 583.49445800 -512.36596956 49.09319562 221.83112221 582.44961827 0.00000000 0.00000000 0.00000000 31.14800138 52.27825452 -0.29375998 -1.66508307 0.00000000 -0.56150083 0.00000000 0.00000000 359.00000000 18_1A0R2.PDB 49.12531868 -286.96250000 -155.07500000 -434.72987537 -22.33574733 581.47030956 -513.09046706 49.11356322 221.02110444 582.24862350 0.00000000 0.00000000 0.00000000 29.83154678 52.30846256 -0.33362936 -1.59954829 0.00000000 -0.43306142 0.00000000 0.00000000 359.00000000 19_1A0R2.PDB 52.42800352 -286.11250000 -155.96250000 -436.10819956 -22.84105145 585.30513636 -513.22547902 49.72719406 221.80223246 582.26915956 0.00000000 0.00000000 0.00000000 30.21781197 52.63663213 -0.30499436 -1.63204743 0.00000000 -0.70675907 0.00000000 0.00000000 359.00000000 20_1A0R2.PDB 53.13210858 -286.11250000 -154.90000000 -434.70877101 -24.26404222 584.06489116 -512.10159356 49.87153677 222.45081907 582.14830592 0.00000000 0.00000000 0.00000000 30.19460705 52.41353988 -0.21705960 -1.75941215 0.00000000 -1.53467284 0.00000000 0.00000000 359.00000000 21_1A0R2.PDB 52.44428598 -287.21250000 -157.10000000 -434.66519794 -23.32712666 583.39958002 -512.65528401 52.82868650 222.54824853 582.26276152 0.00000000 0.00000000 0.00000000 29.38868561 52.17540580 -0.24834035 -1.80636615 0.00000000 -0.96886110 0.00000000 0.00000000 359.00000000 22_1A0R2.PDB 53.22011638 -287.56250000 -157.48750000 -434.37220169 -23.79085525 585.98203229 -510.74698672 49.68699139 222.89953685 581.78410531 0.00000000 0.00000000 0.00000000 30.06974023 52.84818536 -0.26072746 -1.72477167 0.00000000 -1.25674690 0.00000000 0.00000000 359.00000000 23_1A0R2.PDB 57.35781247 -287.62500000 -159.32500000 -433.97492241 -23.39410162 583.47274322 -511.56036882 55.41530907 223.25731128 582.32686738 0.00000000 0.00000000 0.00000000 31.67362742 52.28881258 -0.25662060 -1.78917610 0.00000000 -0.86285634 0.00000000 0.00000000 359.00000000 24_1A0R2.PDB 52.55216839 -285.92500000 -157.51250000 -434.66662342 -23.81848445 585.06368243 -511.57996371 49.44034121 223.00411400 581.83274929 0.00000000 0.00000000 0.00000000 29.86343303 52.56648731 -0.23200851 -1.69346631 0.00000000 -1.22410517 0.00000000 0.00000000 359.00000000 25_1A0R2.PDB 47.47731701 -288.45000000 -158.37500000 -434.83840228 -23.20713432 583.26779832 -512.71737819 49.29661451 222.84244942 582.20101469 0.00000000 0.00000000 0.00000000 30.08387406 52.30153050 -0.24082824 -1.64098025 0.00000000 -0.74471071 0.00000000 0.00000000 359.00000000 26_1A0R2.PDB 51.05064256 -286.11250000 -155.96250000 -435.11279503 -22.62907985 583.49731724 -512.01877997 48.85922354 221.70852861 582.25537895 0.00000000 0.00000000 0.00000000 29.16505039 52.41981209 -0.30121255 -1.67386727 0.00000000 -0.62412150 0.00000000 0.00000000 359.00000000 27_1A0R2.PDB 55.10499657 -285.92500000 -155.77500000 -435.05721347 -24.78029289 585.04130285 -512.23160537 52.81305145 222.27541866 582.10506867 0.00000000 0.00000000 0.00000000 30.12609225 52.36222129 -0.21156363 -1.73961857 0.00000000 -1.53564337 0.00000000 0.00000000 359.00000000 28_1A0R2.PDB 53.96354887 -288.30000000 -156.41250000 -433.86461813 -23.58299651 583.60653329 -510.78267252 50.01034491 222.93474873 581.82924635 0.00000000 0.00000000 0.00000000 31.37190350 52.31851501 -0.25202544 -1.64925768 0.00000000 -0.94515763 0.00000000 0.00000000 359.00000000 29_1A0R2.PDB 53.49961380 -285.96250000 -154.00000000 -434.39739893 -22.11476867 582.59064339 -511.57500954 48.93032629 220.92366862 582.16255219 0.00000000 0.00000000 0.00000000 29.25044144 53.05788140 -0.34373335 -1.58061546 0.00000000 -0.38399216 0.00000000 0.00000000 359.00000000 30_1A0R2.PDB 64.57988985 -287.91250000 -157.80000000 -435.55474168 -23.28914072 586.23578657 -513.56470566 62.00158314 223.26064290 582.27391506 0.00000000 0.00000000 0.00000000 31.79729276 52.10332129 -0.25524541 -1.76249084 0.00000000 -0.85050627 0.00000000 0.00000000 359.00000000