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_1IAL2.PDB 6.84435000 -30.23355748 -7.97500000 -15.58750000 -19.17646849 -5.59395973 28.38364066 -23.59646038 2.40288186 6.68801808 6.85749307 0.00000000 0.00000000 0.00000000 0.92740522 0.96902246 -0.21966649 -0.75981787 0.00000000 -2.58412340 0.00000000 2.38400000 439.00000000 2_1IAL2.PDB 6.30440000 -24.31378141 -7.97500000 -15.21250000 -18.10149061 -4.69427046 27.32383421 -22.47632950 6.07793271 6.08767446 7.23339910 0.00000000 0.00000000 0.00000000 0.73253814 0.89179385 -0.19974286 -1.24063341 0.00000000 -1.86919318 0.00000000 2.38400000 439.00000000 3_1IAL2.PDB 6.73629000 -23.26600802 -7.97500000 -16.05000000 -19.69416873 -5.31347480 30.66108802 -23.11924323 6.23668703 7.34183928 7.27220559 0.00000000 0.00000000 0.00000000 0.94430088 0.94397504 -0.18561069 -1.03127808 0.00000000 -2.35335329 0.00000000 2.38400000 439.00000000 4_1IAL2.PDB 7.13826000 -29.87056406 -8.82500000 -16.17500000 -19.76287335 -5.10413379 29.87106908 -23.65304283 2.49333440 7.01961760 7.23504427 0.00000000 0.00000000 0.00000000 1.20684190 0.98538949 -0.48377391 -1.11324892 0.00000000 -2.57939851 0.00000000 2.38400000 439.00000000 5_1IAL2.PDB 5.78258000 -27.10686624 -7.97500000 -15.58750000 -17.88334271 -5.55489799 27.68848664 -21.47680876 3.60974003 6.56818465 6.67920957 0.00000000 0.00000000 0.00000000 0.69081854 0.89681455 -0.18312827 -1.02173652 0.00000000 -2.66089142 0.00000000 2.38400000 439.00000000 6_1IAL2.PDB 5.75984000 -26.24824900 -7.97500000 -15.21250000 -17.63061948 -4.76508308 27.31911523 -21.21637544 1.90778005 6.04936557 7.41529394 0.00000000 0.00000000 0.00000000 0.87586342 0.88093340 -0.19328331 -0.93133341 0.00000000 -1.89147249 0.00000000 2.38400000 439.00000000 7_1IAL2.PDB 5.75708000 -24.15625249 -8.82500000 -15.80000000 -18.46763853 -4.02368544 28.43149340 -22.34173819 5.89353509 5.91343945 7.26611374 0.00000000 0.00000000 0.00000000 0.77822092 0.93075471 -0.38120791 -0.81936886 0.00000000 -1.78041615 0.00000000 2.38400000 439.00000000 8_1IAL2.PDB 4.38238000 -26.37123824 -7.97500000 -15.58750000 -18.35626668 -5.12145390 28.65372180 -21.69956370 2.11423704 6.56107337 7.84589803 0.00000000 0.00000000 0.00000000 0.97252417 0.92545873 -0.20281480 -1.27459568 0.00000000 -2.30149790 0.00000000 2.38400000 439.00000000 9_1IAL2.PDB 4.60876000 -25.80093382 -8.82500000 -16.17500000 -19.00409397 -5.40200815 29.48946252 -22.23374454 5.82324390 6.67856960 7.39581751 0.00000000 0.00000000 0.00000000 0.81488305 0.93142210 -0.49279913 -1.13365190 0.00000000 -2.73661271 0.00000000 2.38400000 439.00000000 10_1IAL2.PDB 6.70527000 -25.46041335 -7.97500000 -15.58750000 -19.28956140 -5.19500505 28.35544266 -23.77353107 6.27691311 7.40912735 7.06772239 0.00000000 0.00000000 0.00000000 0.83342649 0.91452361 -0.19308791 -1.04225873 0.00000000 -2.34710118 0.00000000 2.38400000 439.00000000 11_1IAL2.PDB 4.28294000 -24.14428773 -8.82500000 -16.17500000 -18.21500744 -4.97703426 28.77504867 -21.32446884 5.74192459 6.69196234 7.09134491 0.00000000 0.00000000 0.00000000 0.84183962 0.90722353 -0.39243355 -0.82723736 0.00000000 -2.55022640 0.00000000 2.38400000 439.00000000 12_1IAL2.PDB 4.98196000 -22.28993399 -8.82500000 -15.80000000 -18.38271881 -4.25006135 29.09948552 -21.25962057 5.96035359 5.85187890 7.57719072 0.00000000 0.00000000 0.00000000 1.17709761 0.97279210 -0.41999573 -1.19725492 0.00000000 -1.82128895 0.00000000 2.38400000 439.00000000 13_1IAL2.PDB 4.60639000 -21.25726859 -7.97500000 -15.21250000 -18.48244129 -4.26934512 28.51036178 -22.22610010 5.98295982 6.03250885 8.34842447 0.00000000 0.00000000 0.00000000 0.90651583 0.95860104 -0.17352742 -1.05538072 0.00000000 -1.64374469 0.00000000 2.38400000 439.00000000 14_1IAL2.PDB 5.35678000 -24.33574884 -8.82500000 -16.17500000 -18.04570714 -4.14765788 28.95963418 -21.13288803 3.36522646 6.20058269 7.52783069 0.00000000 0.00000000 0.00000000 1.23950072 0.91629160 -0.38546268 -0.85509120 0.00000000 -2.06171663 0.00000000 2.38400000 439.00000000 15_1IAL2.PDB 6.37097000 -28.96551855 -7.97500000 -15.58750000 -18.54304642 -4.95856639 27.71463428 -22.98649887 2.86400721 6.47546331 6.46813033 0.00000000 0.00000000 0.00000000 0.78073835 0.90011368 -0.20940421 -0.86862540 0.00000000 -2.13985073 0.00000000 2.38400000 439.00000000 16_1IAL2.PDB 5.01607000 -25.40701202 -7.97500000 -15.58750000 -18.81673268 -6.09344428 28.62067764 -22.56654850 5.57924881 6.64915347 7.72902798 0.00000000 0.00000000 0.00000000 0.82526399 0.89753803 -0.19730871 -0.82618506 0.00000000 -2.74766468 0.00000000 2.38400000 439.00000000 17_1IAL2.PDB 5.82762000 -24.67832610 -7.97500000 -15.58750000 -18.52856297 -5.53554655 27.66281771 -22.84912642 7.03679293 6.88456260 7.32482936 0.00000000 0.00000000 0.00000000 0.78555212 0.87844264 -0.21627971 -1.12904998 0.00000000 -2.55181520 0.00000000 2.38400000 439.00000000 18_1IAL2.PDB 6.74319000 -25.45631253 -7.97500000 -13.62500000 -18.73705868 -4.11166704 25.67979521 -22.57747357 5.75493448 5.68361282 6.62632058 0.00000000 0.00000000 0.00000000 1.04724566 0.89123256 -0.21269808 -0.95928063 0.00000000 -2.05004328 0.00000000 2.38400000 439.00000000 19_1IAL2.PDB 5.07066000 -25.82345461 -7.08750000 -14.73750000 -17.76578091 -5.44204338 27.63930773 -21.27343736 3.10409062 6.09958901 6.54481799 0.00000000 0.00000000 0.00000000 0.75184046 0.93215994 -0.24192568 -0.94192047 0.00000000 -2.47299261 0.00000000 2.38400000 439.00000000 20_1IAL2.PDB 5.74078000 -24.14712004 -7.97500000 -15.21250000 -17.91915190 -4.16879137 27.16570372 -22.21861945 4.74224262 6.06478304 7.10947429 0.00000000 0.00000000 0.00000000 0.82746323 0.90451658 -0.17633261 -0.91255885 0.00000000 -1.47383276 0.00000000 2.38400000 439.00000000 21_1IAL2.PDB 4.89886000 -27.00005421 -7.97500000 -15.21250000 -18.54637473 -4.49046542 27.98134228 -22.23664777 2.21987624 5.77646866 7.37118677 0.00000000 0.00000000 0.00000000 0.92758838 1.01211440 -0.19155268 -0.94156687 0.00000000 -1.68240907 0.00000000 2.38400000 439.00000000 22_1IAL2.PDB 6.33460000 -24.41483806 -8.82500000 -15.80000000 -18.07330232 -3.90151309 27.79748691 -21.69922616 5.61933280 5.78679574 7.02362610 0.00000000 0.00000000 0.00000000 0.80638996 0.92143840 -0.48225468 -1.07100134 0.00000000 -1.59617199 0.00000000 2.38400000 439.00000000 23_1IAL2.PDB 5.27750000 -21.37515716 -8.82500000 -15.76250000 -17.45560822 -2.76279381 27.09238686 -21.35503637 5.89135320 5.84179828 8.15604569 0.00000000 0.00000000 0.00000000 0.46252076 0.90464230 -0.49051169 -1.01037008 0.00000000 -1.15744178 0.00000000 2.38400000 439.00000000 24_1IAL2.PDB 4.32195000 -22.28127881 -7.97500000 -15.58750000 -17.71813655 -4.70410075 27.57355992 -21.30219834 6.43980595 6.23388778 7.42262998 0.00000000 0.00000000 0.00000000 0.75200189 0.91121234 -0.21766791 -1.15096605 0.00000000 -2.04759471 0.00000000 2.38400000 439.00000000 25_1IAL2.PDB 7.33146000 -27.61280007 -7.08750000 -14.73750000 -18.43532150 -5.58917439 27.84644685 -22.63355327 2.96568196 6.70966451 6.31219382 0.00000000 0.00000000 0.00000000 0.80935701 0.94851935 -0.22291164 -0.88836028 0.00000000 -2.66182313 0.00000000 2.38400000 439.00000000 26_1IAL2.PDB 6.20353000 -23.79703687 -7.97500000 -15.58750000 -18.65099676 -5.27371556 28.69588155 -22.32822808 6.21691700 6.91179258 6.98240984 0.00000000 0.00000000 0.00000000 0.80123587 0.89278686 -0.20916946 -0.98810139 0.00000000 -2.39256244 0.00000000 2.38400000 439.00000000 27_1IAL2.PDB 6.54125000 -28.52246681 -7.97500000 -15.55000000 -18.50566143 -5.67831326 29.32365292 -22.63454748 1.98475487 6.01178375 6.72001793 0.00000000 0.00000000 0.00000000 0.90844940 0.92316898 -0.18255805 -0.92384205 0.00000000 -2.02120342 0.00000000 2.38400000 439.00000000 28_1IAL2.PDB 7.62433000 -29.13559965 -8.82500000 -16.17500000 -19.41704416 -5.19623903 29.97579878 -22.56708981 2.45752353 6.77257461 6.92687212 0.00000000 0.00000000 0.00000000 1.15343129 0.93436297 -0.47750787 -1.21463590 0.00000000 -2.54928320 0.00000000 2.38400000 439.00000000 29_1IAL2.PDB 7.16091000 -23.78475943 -8.82500000 -16.13750000 -18.28658925 -4.70878970 28.13764439 -21.77866439 7.08584999 6.89913305 7.01087040 0.00000000 0.00000000 0.00000000 0.90171722 0.90653593 -0.52216696 -0.99497415 0.00000000 -2.56629003 0.00000000 2.38400000 439.00000000 30_1IAL2.PDB 5.11980000 -27.62143472 -7.97500000 -15.58750000 -18.45350467 -5.21283330 28.38787330 -22.14206068 2.39366757 6.19948956 7.23428571 0.00000000 0.00000000 0.00000000 0.90185720 0.97347009 -0.21018927 -0.94900673 0.00000000 -2.20851341 0.00000000 2.38400000 439.00000000