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_1K5R2.PDB 83.23965173 -9.63750000 -12.10000000 -33.72336315 0.22745824 44.05821673 -36.61351338 25.52448467 23.65476593 72.64839313 0.00000000 0.00000000 0.00000000 9.31335453 10.84359475 0.00000000 -0.06002055 0.00000000 -0.05262442 0.00000000 0.00000000 50.00000000 2_1K5R2.PDB 82.95934777 -7.86250000 -8.62500000 -33.87482446 0.46524918 42.68873519 -37.35688869 25.37057146 22.81593338 71.65878187 0.00000000 0.00000000 0.00000000 7.92727274 10.92092668 0.00000000 -0.07531303 0.00000000 -0.17266987 0.00000000 0.00000000 50.00000000 3_1K5R2.PDB 84.39180069 -8.53750000 -9.26250000 -33.46618846 0.16442835 42.68859097 -35.71767566 25.54113330 23.28250512 71.23221115 0.00000000 0.00000000 0.00000000 8.50542379 10.77857846 0.00000000 0.00000000 0.00000000 -0.03862787 0.00000000 0.00000000 50.00000000 4_1K5R2.PDB 82.03964808 -9.13750000 -8.12500000 -33.96298905 0.25328029 42.68398153 -37.64184916 25.51424232 22.41206103 71.24185243 0.00000000 0.00000000 0.00000000 8.81005987 10.92682811 0.00000000 -0.01072633 0.00000000 0.00223515 0.00000000 0.00000000 50.00000000 5_1K5R2.PDB 85.02945453 -7.90000000 -6.85000000 -33.92706474 0.41296960 42.73081991 -36.32173502 25.31069574 21.82267283 71.05962968 0.00000000 0.00000000 0.00000000 8.71742314 10.86823583 0.00000000 -0.00957575 0.00000000 -0.01638086 0.00000000 0.00000000 50.00000000 6_1K5R2.PDB 83.68283530 -10.23750000 -11.00000000 -35.24119554 0.50785845 45.66196715 -38.37626218 26.54344151 23.30126553 73.05211729 0.00000000 0.00000000 0.00000000 9.47372561 10.95798626 0.00000000 -0.03926789 0.00000000 0.03668537 0.00000000 0.00000000 50.00000000 7_1K5R2.PDB 81.22541061 -12.01250000 -14.51250000 -35.20741825 0.59066336 46.79753544 -38.48038319 26.30002984 25.84343965 72.49972016 0.00000000 0.00000000 0.00000000 9.59248205 10.97636481 0.00000000 -0.12649551 0.00000000 -0.05916295 0.00000000 0.00000000 50.00000000 8_1K5R2.PDB 82.25747312 -10.87500000 -13.37500000 -34.23386451 0.36187661 44.39421632 -37.14424297 25.89984413 24.61363542 73.35502390 0.00000000 0.00000000 0.00000000 9.31891793 10.89809179 0.00000000 -0.08995528 0.00000000 0.03202158 0.00000000 0.00000000 50.00000000 9_1K5R2.PDB 81.69831253 -10.87500000 -13.37500000 -34.89848439 0.49521655 45.54475306 -38.58432592 26.95993579 24.35577904 73.16232392 0.00000000 0.00000000 0.00000000 8.92401185 10.94471547 0.00000000 -0.04385188 0.00000000 0.03295452 0.00000000 0.00000000 50.00000000 10_1K5R2.PDB 84.66425277 -7.90000000 -5.07500000 -32.20324564 0.23474938 40.21957123 -35.58592260 24.60993939 21.04652955 71.21651059 0.00000000 0.00000000 0.00000000 8.25318623 10.84230352 0.00000000 -0.01882628 0.00000000 -0.13323910 0.00000000 0.00000000 50.00000000 11_1K5R2.PDB 84.75280235 -7.90000000 -6.81250000 -32.98115659 0.56190988 41.68949199 -36.51636568 24.96895611 21.68646402 71.45226207 0.00000000 0.00000000 0.00000000 8.78482656 10.84649477 0.00000000 -0.08033216 0.00000000 -0.10075385 0.00000000 0.00000000 50.00000000 12_1K5R2.PDB 86.07450317 -7.90000000 -5.07500000 -33.20270989 0.23483636 41.75173017 -35.67005402 25.43366806 20.99460384 70.94922475 0.00000000 0.00000000 0.00000000 8.57708556 10.86704451 0.00000000 -0.00908689 0.00000000 -0.00979478 0.00000000 0.00000000 50.00000000 13_1K5R2.PDB 84.22203883 -8.50000000 -5.71250000 -33.90041806 -0.15435085 42.18457514 -37.34512790 25.43701001 21.42642343 72.47583538 0.00000000 0.00000000 0.00000000 8.73722698 10.91882980 0.00000000 -0.00993854 0.00000000 -0.41669675 0.00000000 0.00000000 50.00000000 14_1K5R2.PDB 84.17498054 -8.53750000 -5.71250000 -33.56601040 0.35030784 41.44329836 -36.87496331 25.20560700 21.50386056 71.67718029 0.00000000 0.00000000 0.00000000 8.86173113 10.82474427 0.00000000 -0.01756159 0.00000000 -0.15846934 0.00000000 0.00000000 50.00000000 15_1K5R2.PDB 83.80518275 -9.13750000 -6.35000000 -33.83887363 0.18547240 41.76602231 -37.36902371 26.02799726 22.04876571 72.50361904 0.00000000 0.00000000 0.00000000 8.33823015 10.90463989 0.00000000 -0.02105205 0.00000000 -0.34847474 0.00000000 0.00000000 50.00000000 16_1K5R2.PDB 84.91640703 -7.90000000 -5.07500000 -32.36782674 0.32018177 40.03788790 -35.99444254 25.53217666 20.60093989 71.50532478 0.00000000 0.00000000 0.00000000 8.30047940 10.83084040 0.00000000 -0.04050875 0.00000000 -0.00280533 0.00000000 0.00000000 50.00000000 17_1K5R2.PDB 84.09320498 -7.90000000 -6.85000000 -33.42477907 0.28570670 41.29731658 -36.95584967 25.26573151 21.50748207 72.10631819 0.00000000 0.00000000 0.00000000 8.85848372 10.84355284 0.00000000 -0.08774033 0.00000000 -0.00946471 0.00000000 0.00000000 50.00000000 18_1K5R2.PDB 84.56473784 -10.23750000 -7.48750000 -34.38954803 0.24462058 43.36801834 -36.91461615 26.29195758 22.13659448 72.36890679 0.00000000 0.00000000 0.00000000 9.28578461 11.01764409 0.00000000 -0.06394262 0.00000000 -0.03803773 0.00000000 0.00000000 50.00000000 19_1K5R2.PDB 84.34806800 -7.90000000 -6.35000000 -34.08555440 0.46785528 41.72152448 -37.44443913 25.21399312 21.86917677 71.82337928 0.00000000 0.00000000 0.00000000 9.14224604 10.84533435 0.00000000 -0.01158384 0.00000000 -0.09852959 0.00000000 0.00000000 50.00000000 20_1K5R2.PDB 83.80733683 -8.53750000 -5.71250000 -33.05724356 0.58667153 40.67116918 -36.69511558 24.75075859 21.28217898 71.82746294 0.00000000 0.00000000 0.00000000 8.72815445 10.83202583 0.00000000 -0.01057269 0.00000000 -0.02612700 0.00000000 0.00000000 50.00000000 21_1K5R2.PDB 85.37139625 -8.50000000 -5.71250000 -32.98517380 0.49267273 41.03693841 -35.76676604 26.02526785 21.10670835 71.57638121 0.00000000 0.00000000 0.00000000 8.13081065 10.90918717 0.00000000 -0.01996229 0.00000000 -0.01298081 0.00000000 0.00000000 50.00000000 22_1K5R2.PDB 83.69794788 -7.90000000 -5.07500000 -33.45643875 0.43086393 41.19265574 -36.80933109 24.78016736 20.29456293 71.91710200 0.00000000 0.00000000 0.00000000 8.31934387 10.86287208 0.00000000 -0.00656121 0.00000000 0.01058311 0.00000000 0.00000000 50.00000000 23_1K5R2.PDB 85.04087643 -9.13750000 -6.35000000 -33.69666415 0.33718351 41.76770162 -36.23735312 26.15219135 21.46682316 71.94163788 0.00000000 0.00000000 0.00000000 8.80228060 10.89355615 0.00000000 -0.01605411 0.00000000 0.01062970 0.00000000 0.00000000 50.00000000 24_1K5R2.PDB 83.78902463 -8.53750000 -5.71250000 -33.64158865 0.54908831 41.24864136 -37.16624151 25.06131882 20.90426644 72.22864366 0.00000000 0.00000000 0.00000000 8.86726398 10.83145148 0.00000000 -0.01283871 0.00000000 0.00047093 0.00000000 0.00000000 50.00000000 25_1K5R2.PDB 85.16615861 -8.50000000 -5.71250000 -34.10056269 0.45191091 41.95406100 -36.99132655 26.31689889 20.87180073 72.06360507 0.00000000 0.00000000 0.00000000 8.81861674 10.93064507 0.00000000 -0.00957706 0.00000000 0.00323159 0.00000000 0.00000000 50.00000000 26_1K5R2.PDB 85.31830192 -7.90000000 -5.07500000 -33.78460686 0.61210020 41.59435925 -36.08303415 25.06663609 20.56908968 71.72328020 0.00000000 0.00000000 0.00000000 8.59526798 10.85399991 0.00000000 -0.00969217 0.00000000 0.00990170 0.00000000 0.00000000 50.00000000 27_1K5R2.PDB 82.91633113 -10.27500000 -7.48750000 -34.53455414 0.58773292 43.20076437 -37.65339634 26.14812036 22.21854507 71.72420998 0.00000000 0.00000000 0.00000000 9.05612736 10.92196443 0.00000000 -0.06657838 0.00000000 -0.00214006 0.00000000 0.00000000 50.00000000 28_1K5R2.PDB 83.69115831 -7.90000000 -6.85000000 -33.32067733 0.42760013 41.36687100 -37.36877760 25.15784322 22.45384009 71.42603816 0.00000000 0.00000000 0.00000000 8.57114274 10.85461800 0.00000000 -0.09520832 0.00000000 -0.17751378 0.00000000 0.00000000 50.00000000 29_1K5R2.PDB 83.45696197 -8.50000000 -5.71250000 -34.25998462 0.14056018 42.54542238 -38.37570188 25.30122450 21.50052792 72.56652168 0.00000000 0.00000000 0.00000000 8.64457413 10.91450276 0.00000000 -0.00961385 0.00000000 -0.38406846 0.00000000 0.00000000 50.00000000 30_1K5R2.PDB 84.47523197 -8.50000000 -5.71250000 -32.91375357 0.51149453 40.84224943 -36.36380626 25.52020277 21.13495746 71.50772953 0.00000000 0.00000000 0.00000000 8.48768582 10.89503240 0.00000000 -0.04679084 0.00000000 0.00776311 0.00000000 0.00000000 50.00000000