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_1K5R2.PDB 10.88930000 -1.75953049 0.00000000 -5.25000000 -3.96915618 -0.03101887 5.44895690 -5.07600885 1.19708678 1.33147749 2.79227717 0.00000000 0.00000000 0.00000000 1.86757853 0.03213088 0.00000000 -0.01809903 0.00000000 -0.05262442 0.00000000 2.38400000 50.00000000 2_1K5R2.PDB 12.85990000 -1.64613680 -0.00000000 -3.55000000 -4.34886188 -0.10301337 5.45726048 -5.64998437 1.03991946 2.00312962 2.89894335 0.00000000 0.00000000 0.00000000 0.77913977 0.05462760 0.00000000 0.00000000 0.00000000 -0.17266987 0.00000000 2.38400000 50.00000000 3_1K5R2.PDB 10.06840000 -2.25751911 0.00000000 -5.32500000 -4.32402144 -0.00564864 5.41565190 -5.61109295 0.96579197 2.92056352 2.39806372 0.00000000 0.00000000 0.00000000 1.33232976 0.04848846 0.00000000 0.01447090 0.00000000 -0.03862787 0.00000000 2.38400000 50.00000000 4_1K5R2.PDB 11.12110000 -2.01341833 0.00000000 -3.55000000 -4.37887715 0.00273004 5.17885276 -5.76196182 1.19300955 1.96540050 2.33430160 0.00000000 0.00000000 0.00000000 1.00089104 0.04665807 0.00000000 0.00000000 0.00000000 0.00223515 0.00000000 2.38400000 50.00000000 5_1K5R2.PDB 10.64130000 -1.68248330 0.00000000 -3.55000000 -4.41618307 0.00871637 5.36615865 -5.84328947 1.11809292 2.12966363 2.05919973 0.00000000 0.00000000 0.00000000 1.46202765 0.05291617 0.00000000 -0.00048886 0.00000000 -0.01638086 0.00000000 2.38400000 50.00000000 6_1K5R2.PDB 12.46230000 -1.45980061 0.00000000 -5.28750000 -5.01046730 0.02004729 6.61048275 -6.22927801 1.67358475 2.21448556 3.25230352 0.00000000 0.00000000 0.00000000 1.26951985 0.05832639 0.00000000 -0.00966440 0.00000000 0.03668537 0.00000000 2.38400000 50.00000000 7_1K5R2.PDB 10.53940000 -2.83774363 0.00000000 -7.02500000 -4.97637541 -0.02975753 6.64978481 -6.19331738 1.40118849 2.73944656 2.94387578 0.00000000 0.00000000 0.00000000 1.79644031 0.05762401 0.00000000 -0.08486632 0.00000000 -0.05916295 0.00000000 2.38400000 50.00000000 8_1K5R2.PDB 11.83870000 -2.24581834 0.00000000 -7.02500000 -4.05106119 0.01984716 5.41365296 -5.15783229 1.26906059 2.54026334 3.47678975 0.00000000 0.00000000 0.00000000 1.28732578 0.01165456 0.00000000 -0.05088603 0.00000000 0.03202158 0.00000000 2.38400000 50.00000000 9_1K5R2.PDB 11.94490000 -2.28550689 0.00000000 -7.02500000 -4.69715359 0.01827902 6.47684769 -5.75348534 1.46429834 2.59311070 3.31806616 0.00000000 0.00000000 0.00000000 1.29370423 0.05871053 0.00000000 -0.00712862 0.00000000 0.03295452 0.00000000 2.38400000 50.00000000 10_1K5R2.PDB 8.71734000 -0.99794035 0.00000000 -1.77500000 -3.40638849 -0.08956234 3.47610302 -4.89095186 0.82509087 1.50746244 2.28423814 0.00000000 0.00000000 0.00000000 1.21562480 0.02102458 0.00000000 -0.01131782 0.00000000 -0.13323910 0.00000000 2.38400000 50.00000000 11_1K5R2.PDB 9.21316000 -1.11092570 0.00000000 -3.51250000 -3.77648056 -0.05508612 4.81488812 -5.34919776 0.98781174 2.20303038 2.34177490 0.00000000 0.00000000 0.00000000 1.40683271 0.02365893 0.00000000 -0.07124527 0.00000000 -0.10075385 0.00000000 2.38400000 50.00000000 12_1K5R2.PDB 10.76530000 -1.00099106 0.00000000 -1.77500000 -4.23443125 0.00758808 4.67163194 -5.67452663 1.13958395 1.70053463 1.81484447 0.00000000 0.00000000 0.00000000 1.35857851 0.05364189 0.00000000 -0.00000000 0.00000000 -0.00979478 0.00000000 2.38400000 50.00000000 13_1K5R2.PDB 11.71730000 -1.49930728 -0.00000000 -1.77500000 -3.90580952 -0.42608781 4.65292616 -5.39197825 0.86720960 1.02433903 3.12372234 0.00000000 0.00000000 0.00000000 0.74856777 0.02697454 0.00000000 -0.00049985 0.00000000 -0.41669675 0.00000000 2.38400000 50.00000000 14_1K5R2.PDB 11.55040000 -1.80007434 0.00000000 -1.77500000 -3.75766194 -0.09905945 4.01746660 -5.51972735 0.95044089 0.85008670 2.30044779 0.00000000 0.00000000 0.00000000 1.39190083 0.00053480 0.00000000 -0.00049908 0.00000000 -0.15846934 0.00000000 2.38400000 50.00000000 15_1K5R2.PDB 12.21810000 -1.81428553 0.00000000 -1.77500000 -4.05849234 -0.34788845 4.35781896 -5.88184764 1.12692003 1.06476221 3.28650982 0.00000000 0.00000000 0.00000000 0.76575042 0.02058195 0.00000000 -0.00434380 0.00000000 -0.34847474 0.00000000 2.38400000 50.00000000 16_1K5R2.PDB 9.47821000 -0.59418336 0.00000000 -1.77500000 -3.79513504 -0.00316378 3.58214892 -5.51987097 1.32143166 1.61443977 2.67418171 0.00000000 0.00000000 0.00000000 1.34584186 0.01857065 0.00000000 -0.03625214 0.00000000 -0.00280533 0.00000000 2.38400000 50.00000000 17_1K5R2.PDB 10.65990000 -1.56817213 0.00000000 -1.77500000 -4.08733775 0.00062731 4.17594837 -6.04329707 1.06995385 0.81410144 3.00161833 0.00000000 0.00000000 0.00000000 1.28516822 0.03469642 0.00000000 -0.00049011 0.00000000 -0.00946471 0.00000000 2.38400000 50.00000000 18_1K5R2.PDB 11.96230000 -1.45382566 0.00000000 -1.77500000 -3.86655482 0.00074616 4.05012560 -5.58296978 1.03221564 0.77934060 3.01008172 0.00000000 0.00000000 0.00000000 0.98910344 0.02753014 0.00000000 -0.05287651 0.00000000 -0.03803773 0.00000000 2.38400000 50.00000000 19_1K5R2.PDB 11.84720000 -1.73409046 0.00000000 -1.77500000 -3.93053697 -0.04579850 4.10521378 -5.83250689 1.03013020 0.86516551 2.38611728 0.00000000 0.00000000 0.00000000 1.56731458 0.01867781 0.00000000 -0.00565988 0.00000000 -0.09852959 0.00000000 2.38400000 50.00000000 20_1K5R2.PDB 8.90829000 -0.53185542 0.00000000 -1.77500000 -3.93606905 -0.01432890 3.86516147 -5.62159394 1.12334703 1.68437577 2.76378273 0.00000000 0.00000000 0.00000000 1.40459646 0.02461434 0.00000000 -0.00000000 0.00000000 -0.02612700 0.00000000 2.38400000 50.00000000 21_1K5R2.PDB 9.99970000 -0.66426770 -0.00000000 -1.77500000 -3.26358669 0.00302149 3.44927046 -4.64168821 1.03428864 1.49469136 2.40100881 0.00000000 0.00000000 0.00000000 0.65758263 0.02620244 0.00000000 -0.01087540 0.00000000 -0.01298081 0.00000000 2.38400000 50.00000000 22_1K5R2.PDB 11.37640000 -1.60975063 0.00000000 -1.77500000 -3.88764920 0.01977651 4.01957485 -5.79840275 0.96772479 0.80176448 2.79933270 0.00000000 0.00000000 0.00000000 1.23302904 0.02046508 0.00000000 -0.00048417 0.00000000 0.01058311 0.00000000 2.38400000 50.00000000 23_1K5R2.PDB 12.97820000 -1.35331937 0.00000000 -1.77500000 -3.62057281 0.03630258 3.98805309 -5.24615969 0.98782560 0.68863720 2.65360479 0.00000000 0.00000000 0.00000000 0.92399258 0.00393427 0.00000000 -0.00063240 0.00000000 0.01062970 0.00000000 2.38400000 50.00000000 24_1K5R2.PDB 10.96830000 -1.79174755 0.00000000 -1.77500000 -4.20983235 0.00553451 4.20257796 -6.31943415 1.11667171 0.82513804 3.05896824 0.00000000 0.00000000 0.00000000 1.30363624 0.02592959 0.00000000 -0.00047869 0.00000000 0.00047093 0.00000000 2.38400000 50.00000000 25_1K5R2.PDB 12.61220000 -1.59103012 -0.00000000 -1.77500000 -4.13324514 0.02079391 4.49775152 -6.03067816 1.25994132 0.76847799 2.75337704 0.00000000 0.00000000 0.00000000 1.04480998 0.03720641 0.00000000 -0.00049017 0.00000000 0.00323159 0.00000000 2.38400000 50.00000000 26_1K5R2.PDB 11.39060000 -1.45024025 0.00000000 -1.77500000 -3.93936139 0.03463327 4.24336697 -5.75862488 1.05391953 0.85206748 2.43050826 0.00000000 0.00000000 0.00000000 1.39895408 0.02759167 0.00000000 -0.00060528 0.00000000 0.00990170 0.00000000 2.38400000 50.00000000 27_1K5R2.PDB 12.06110000 -1.59349588 0.00000000 -1.77500000 -4.04716713 0.01886421 4.18361272 -6.02417578 1.09764723 0.83729213 2.73671201 0.00000000 0.00000000 0.00000000 1.43108207 0.00053480 0.00000000 -0.05022327 0.00000000 -0.00214006 0.00000000 2.38400000 50.00000000 28_1K5R2.PDB 9.17774000 -0.44576597 0.00000000 -0.00000000 -3.65123287 -0.11566831 3.75342982 -5.13075480 0.96282290 0.40531864 2.19147334 0.00000000 0.00000000 0.00000000 1.35791674 0.02342972 0.00000000 -0.04155765 0.00000000 -0.17751378 0.00000000 2.38400000 50.00000000 29_1K5R2.PDB 11.84230000 -1.34787832 -0.00000000 -1.77500000 -4.06986631 -0.38301275 4.88635040 -5.60983395 0.89543499 1.09533139 3.22475750 0.00000000 0.00000000 0.00000000 0.77226531 0.02719636 0.00000000 -0.00023644 0.00000000 -0.38406846 0.00000000 2.38400000 50.00000000 30_1K5R2.PDB 10.22890000 -0.61782276 -0.00000000 -1.77500000 -3.31112752 0.01593199 3.49128470 -4.61299626 0.95702572 1.48649030 2.35685380 0.00000000 0.00000000 0.00000000 0.80365533 0.00441904 0.00000000 -0.03770394 0.00000000 0.00776311 0.00000000 2.38400000 50.00000000