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_2C3I2.PDB -62.44020769 -220.58750000 -116.20000000 -341.89042014 -34.49935596 447.23500600 -414.11245585 9.38222421 195.33135353 407.76821986 0.00000000 0.00000000 1.12405600 14.36517945 17.27108361 -1.43071719 -1.79986251 0.00000000 -7.12593511 0.00000000 0.00000000 274.00000000 2_2C3I2.PDB -61.43163194 -220.58750000 -115.90000000 -341.09824632 -33.53022588 445.82514878 -413.54858836 9.27996003 194.63948855 407.60332496 0.00000000 0.00000000 1.12405600 14.35382612 17.25814343 -1.42429128 -1.84793372 0.00000000 -6.32065082 0.00000000 0.00000000 274.00000000 3_2C3I2.PDB -63.58677310 -222.57500000 -118.18750000 -343.38777225 -34.01302504 450.12279748 -415.77085820 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0.00000000 274.00000000 7_2C3I2.PDB -61.73637774 -221.43750000 -115.42500000 -341.99626040 -33.07197547 448.01450101 -414.07098254 9.35886125 195.55547419 407.34950550 0.00000000 0.00000000 1.12405600 14.20726455 17.33842138 -1.46920589 -2.21132998 0.00000000 -7.66378595 0.00000000 0.00000000 274.00000000 8_2C3I2.PDB -63.95278224 -221.47500000 -119.50000000 -340.73342608 -32.25088335 445.75546860 -413.28913931 9.59938781 196.20544465 406.33643737 0.00000000 0.00000000 1.12405600 14.05305474 17.24477160 -1.44886920 -1.71587945 0.00000000 -6.61343402 0.00000000 0.00000000 274.00000000 9_2C3I2.PDB -62.76795284 -220.80000000 -117.20000000 -342.17828689 -32.20157795 447.77143601 -415.05617269 9.88868476 197.22178611 406.12487265 0.00000000 0.00000000 1.12405600 13.95263160 17.25409927 -1.41382036 -2.37021454 0.00000000 -7.63134755 0.00000000 0.00000000 274.00000000 10_2C3I2.PDB -57.20666941 -219.91250000 -111.01250000 -343.39031385 -35.61339950 450.24367754 -415.08447826 9.72369558 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195.77068205 406.82442672 0.00000000 0.00000000 1.12405600 14.12076194 17.41451546 -1.47653811 -1.87463872 0.00000000 -8.30205461 0.00000000 0.00000000 274.00000000 18_2C3I2.PDB -59.05493715 -220.80000000 -114.52500000 -342.11874149 -33.76248418 448.59234037 -414.29415621 10.11096515 195.42077246 406.53641016 0.00000000 0.00000000 1.12405600 14.37530508 17.28772267 -1.38328312 -1.76405331 0.00000000 -6.56706807 0.00000000 0.00000000 274.00000000 19_2C3I2.PDB -58.23823479 -219.91250000 -111.75000000 -341.68859402 -32.56061598 446.25996243 -413.63551712 9.18964185 193.62153612 406.98647119 0.00000000 0.00000000 1.12405600 13.88602619 17.35794796 -1.39003817 -1.87746116 0.00000000 -6.49120212 0.00000000 0.00000000 274.00000000 20_2C3I2.PDB -60.21792804 -219.95000000 -116.35000000 -340.24918798 -31.41656182 445.59641264 -412.87234611 9.40133512 195.46042205 405.15124217 0.00000000 0.00000000 1.12405600 13.69766620 17.30945527 -1.44859404 -1.55665945 0.00000000 -6.80571283 0.00000000 0.00000000 274.00000000 21_2C3I2.PDB -60.88167811 -221.68750000 -114.96250000 -343.30273212 -33.99980281 451.29454630 -414.69801201 9.45340366 195.07029299 408.43571947 0.00000000 0.00000000 1.12405600 14.34968910 17.43707732 -1.38412413 -2.26490689 0.00000000 -8.30980768 0.00000000 0.00000000 274.00000000 22_2C3I2.PDB -61.73756971 -222.57500000 -115.92500000 -342.23984310 -33.23701457 449.09978043 -413.90331370 9.38037651 195.06472705 407.97343623 0.00000000 0.00000000 1.12405600 14.77047105 17.41126632 -1.44945175 -2.23047367 0.00000000 -7.59032020 0.00000000 0.00000000 274.00000000 23_2C3I2.PDB -60.70338054 -220.58750000 -118.01250000 -341.22019790 -33.32535979 446.79081019 -412.56355671 9.52996834 195.41512048 407.73388602 0.00000000 0.00000000 1.12405600 14.16863936 17.23969800 -1.42662848 -1.79475248 0.00000000 -6.53536557 0.00000000 0.00000000 274.00000000 24_2C3I2.PDB -60.75463321 -221.43750000 -117.50000000 -342.63640550 -32.30461822 449.22434522 -414.59252096 9.27635524 196.46158958 407.32420410 0.00000000 0.00000000 1.12405600 15.19391256 17.27837431 -1.43596344 -1.86561913 0.00000000 -7.58646866 0.00000000 0.00000000 274.00000000 25_2C3I2.PDB -61.36504826 -219.95000000 -116.27500000 -342.01120457 -34.04991853 446.67309263 -414.57107367 9.90852988 196.07259433 407.89332671 0.00000000 0.00000000 1.12405600 14.08630386 17.22697568 -1.44419230 -1.60581767 0.00000000 -7.21574491 0.00000000 0.00000000 274.00000000 26_2C3I2.PDB -60.08392167 -221.43750000 -116.56250000 -341.20425339 -31.60321553 446.92249797 -412.59469100 9.45001506 194.64802120 406.76966683 0.00000000 0.00000000 1.12405600 14.17288755 17.34737014 -1.44915642 -1.89052570 0.00000000 -6.42922424 0.00000000 0.00000000 274.00000000 27_2C3I2.PDB -57.62751003 -219.70000000 -115.01250000 -340.31602755 -32.30627332 445.11276212 -412.31436125 9.88244080 195.20226938 406.09687158 0.00000000 0.00000000 1.12405600 13.85983204 17.23734732 -1.41483428 -1.60896082 0.00000000 -6.23278474 0.00000000 0.00000000 274.00000000 28_2C3I2.PDB -56.31398386 -219.06250000 -112.93750000 -340.79733495 -32.37130524 445.57837187 -413.14865343 9.80210216 194.24845431 406.40043147 0.00000000 0.00000000 1.12405600 14.19890933 17.27731673 -1.41053296 -1.61803161 0.00000000 -6.32045080 0.00000000 0.00000000 274.00000000 29_2C3I2.PDB -61.61632540 -221.68750000 -119.07500000 -341.75903781 -30.61527590 448.38634628 -413.51396513 9.32499886 196.05685930 406.09119749 0.00000000 0.00000000 1.12405600 13.94232156 17.22157388 -1.45001543 -1.74079069 0.00000000 -6.70051994 0.00000000 0.00000000 274.00000000 30_2C3I2.PDB -62.37770276 -222.53750000 -117.35000000 -343.81802478 -35.11063107 452.64710291 -415.06234775 9.43236100 198.64143785 408.39856543 0.00000000 0.00000000 1.12405600 14.25614140 17.36196074 -1.45818339 -2.50477378 0.00000000 -9.03590657 0.00000000 0.00000000 274.00000000