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_1QZ22.PDB 3.03221000 -3.06256813 -0.63750000 -1.83750000 -3.56809573 0.07527608 3.65671235 -5.13075456 0.80462366 0.83164841 2.79632689 0.00000000 0.00000000 0.00000000 0.15819566 0.07027908 -0.00357854 -0.00000000 0.00000000 -0.20792234 0.00000000 2.38400000 290.00000000 2_1QZ22.PDB 3.41305000 -5.09028275 -0.63750000 -1.83750000 -3.95321394 -0.77685138 4.89533507 -5.53102488 0.92562792 1.40930989 1.39803238 0.00000000 0.00000000 0.00000000 0.16049618 0.07085176 -0.00348163 0.00000000 0.00000000 -1.13951237 0.00000000 2.38400000 290.00000000 3_1QZ22.PDB 3.42498000 -4.20917329 -0.63750000 -3.57500000 -2.80961588 -0.88975969 5.16333111 -3.29822924 1.00320445 1.07709296 1.09995610 0.00000000 0.00000000 0.00000000 0.10865962 0.06289520 -0.00877000 -0.09543073 0.00000000 -1.34711199 0.00000000 2.38400000 290.00000000 4_1QZ22.PDB 2.67830000 -2.68517927 0.00000000 0.00000000 -2.37710770 -0.11542027 1.97431834 -3.74975710 0.31108878 0.90098147 0.65224159 0.00000000 0.00000000 0.00000000 0.10098351 0.06718104 -0.00626380 -0.00000000 0.00000000 -0.37624409 0.00000000 2.38400000 290.00000000 5_1QZ22.PDB 3.39597000 -3.86364264 -0.63750000 -3.57500000 -2.84776181 -1.04468307 4.78656751 -3.46909871 0.92605548 1.15418583 2.49146854 0.00000000 0.00000000 0.00000000 0.06881530 0.13198336 -0.00831497 -0.15420042 0.00000000 -1.55417631 0.00000000 2.38400000 290.00000000 6_1QZ22.PDB 3.06683000 -3.09154614 -0.63750000 -1.83750000 -3.56681855 0.05281606 3.60063054 -5.09044253 0.84661721 0.86882824 2.78947832 0.00000000 0.00000000 0.00000000 0.11866102 0.06620625 -0.00331466 -0.00000000 0.00000000 -0.23300178 0.00000000 2.38400000 290.00000000 7_1QZ22.PDB 3.52150000 -2.89527011 -0.63750000 -1.83750000 -3.68959081 0.14380185 3.50560719 -5.34134565 0.83875868 0.80072056 3.27147912 0.00000000 0.00000000 0.00000000 0.15736569 0.06996624 -0.00368265 -0.00000000 0.00000000 -0.10338410 0.00000000 2.38400000 290.00000000 8_1QZ22.PDB 3.12744000 -3.04296693 0.00000000 0.00000000 -2.30985805 -0.29167051 1.79924286 -3.60922081 0.30802264 0.86083193 0.75009042 0.00000000 0.00000000 0.00000000 0.11631817 0.06645426 -0.00627380 -0.00000000 0.00000000 -0.66044977 0.00000000 2.38400000 290.00000000 9_1QZ22.PDB 2.25712000 -2.05718316 0.00000000 -1.73750000 -1.10939140 -0.52132581 1.99355150 -1.36060658 0.28130472 0.68232230 0.77305752 0.00000000 0.00000000 0.00000000 0.03161658 0.06046563 -0.01194296 -0.10842787 0.00000000 -0.96984117 0.00000000 2.38400000 290.00000000 10_1QZ22.PDB 3.14066000 -4.50110462 -0.63750000 -1.83750000 -3.77022017 -0.47753227 3.82429313 -5.42684480 0.80912775 1.13313844 2.62422000 0.00000000 0.00000000 0.00000000 0.15165574 0.07294967 -0.00267875 0.00000000 0.00000000 -0.89126370 0.00000000 2.38400000 290.00000000 11_1QZ22.PDB 3.26677000 -3.12170418 -0.63750000 -3.57500000 -2.90919025 -0.21405225 4.32758566 -3.80172252 0.79308456 0.81964271 2.64443807 0.00000000 0.00000000 0.00000000 0.08760454 0.06688730 -0.00915924 -0.06583797 0.00000000 -0.58159750 0.00000000 2.38400000 290.00000000 12_1QZ22.PDB 3.40688000 -2.82841263 -0.63750000 -1.83750000 -3.50382031 -0.50433008 5.02842754 -4.75636191 1.04379039 1.14743022 1.69423184 0.00000000 0.00000000 0.00000000 0.07741331 0.07025773 -0.00238352 -0.00000000 0.00000000 -0.57781011 0.00000000 2.38400000 290.00000000 13_1QZ22.PDB 3.40420000 -4.24609939 -0.63750000 -3.57500000 -2.69277254 -0.98327214 4.81093927 -3.21158112 1.13166218 1.09860185 1.30824662 0.00000000 0.00000000 0.00000000 0.07860221 0.06499210 -0.00736370 -0.21335781 0.00000000 -1.35330423 0.00000000 2.38400000 290.00000000 14_1QZ22.PDB 3.06144000 -2.76309579 0.00000000 -1.73750000 -1.57575329 -0.68071179 2.36811979 -2.15207622 0.27883759 0.83968464 1.09503893 0.00000000 0.00000000 0.00000000 0.02184484 0.06529500 -0.01178162 -0.00000000 0.00000000 -1.20879865 0.00000000 2.38400000 290.00000000 15_1QZ22.PDB 3.01968000 -2.33692020 -0.63750000 -3.57500000 -2.82492153 -0.92412309 4.97673239 -3.36737852 1.00450736 1.88824480 2.33412371 0.00000000 0.00000000 0.00000000 0.12744825 0.06686294 -0.00706539 -0.02837800 0.00000000 -1.30361019 0.00000000 2.38400000 290.00000000 16_1QZ22.PDB 2.73366000 -1.75817895 0.00000000 0.00000000 -2.26098717 -0.05808316 1.83434470 -3.58161768 0.31878018 0.84909742 1.38728180 0.00000000 0.00000000 0.00000000 0.10574182 0.06775354 -0.00606643 -0.00793317 0.00000000 -0.33873725 0.00000000 2.38400000 290.00000000 17_1QZ22.PDB 3.01174000 -2.45418879 0.00000000 0.00000000 -2.33220570 -0.00071917 1.76813444 -3.65594730 0.31069271 0.80421252 0.79593975 0.00000000 0.00000000 0.00000000 0.10625251 0.06482501 -0.00628251 -0.02342625 0.00000000 -0.22083980 0.00000000 2.38400000 290.00000000 18_1QZ22.PDB 3.34721000 -2.91966943 -0.63750000 -1.83750000 -3.39889361 -0.56477629 5.23342138 -4.26170180 1.25336522 1.16157192 0.78240781 0.00000000 0.00000000 0.00000000 0.16646870 0.00398350 -0.00234598 -0.00000000 0.00000000 -0.81418678 0.00000000 2.38400000 290.00000000 19_1QZ22.PDB 3.51157000 -4.49621604 -0.63750000 -3.57500000 -2.85280051 -1.11416386 4.71033538 -3.49433939 0.86258774 1.21661074 2.24126750 0.00000000 0.00000000 0.00000000 0.07803294 0.13325865 -0.00741918 -0.28319677 0.00000000 -1.64063064 0.00000000 2.38400000 290.00000000 20_1QZ22.PDB 3.49479000 -3.29891149 -0.63750000 -1.83750000 -3.67669581 0.19032037 3.52740231 -5.28978376 0.90272236 0.79574334 2.64667125 0.00000000 0.00000000 0.00000000 0.15054366 0.07043016 -0.00249995 -0.01212358 0.00000000 -0.05621168 0.00000000 2.38400000 290.00000000 21_1QZ22.PDB 3.07880000 -4.69363677 -0.63750000 -3.57500000 -3.15716609 -0.62793708 4.98513393 -4.05011456 0.84336676 1.03327466 1.46351980 0.00000000 0.00000000 0.00000000 0.06021325 0.06288404 -0.00807100 -0.09728953 0.00000000 -0.92606692 0.00000000 2.38400000 290.00000000 22_1QZ22.PDB 3.51751000 -2.59307768 -0.63750000 -1.83750000 -3.37642741 -0.43244152 5.22873026 -4.30162291 0.89381812 1.04005267 1.40651791 0.00000000 0.00000000 0.00000000 0.19893947 0.00649653 -0.00434935 -0.02184626 0.00000000 -0.74944866 0.00000000 2.38400000 290.00000000 23_1QZ22.PDB 3.87839000 -4.16757161 -0.63750000 -3.57500000 -3.28933537 -1.10881643 5.57571907 -3.97977264 0.94322551 2.04666989 1.49246278 0.00000000 0.00000000 0.00000000 0.09562630 0.13403767 -0.00680549 -0.13117547 0.00000000 -1.59286976 0.00000000 2.38400000 290.00000000 24_1QZ22.PDB 5.04731000 -2.18234460 0.00000000 0.00000000 -2.37473072 -0.57751148 2.38923919 -3.54528285 0.31873932 0.83959917 1.57935799 0.00000000 0.00000000 0.00000000 0.11254359 0.06590120 -0.00604910 -0.05812511 0.00000000 -0.86012459 0.00000000 2.38400000 290.00000000 25_1QZ22.PDB 3.05074000 -1.83315851 0.00000000 -1.73750000 -1.30766945 -0.42447617 2.19169602 -1.66078557 0.27924495 0.66025621 1.01776280 0.00000000 0.00000000 0.00000000 0.04401983 0.12956032 -0.01017016 -0.13332738 0.00000000 -0.75220959 0.00000000 2.38400000 290.00000000 26_1QZ22.PDB 2.10721000 -2.17609390 0.00000000 -1.73750000 -1.05532109 -0.45797772 1.76058107 -1.33087881 0.27546311 0.67732689 0.77017419 0.00000000 0.00000000 0.00000000 0.02151134 0.06104286 -0.01161748 -0.18641435 0.00000000 -0.90144106 0.00000000 2.38400000 290.00000000 27_1QZ22.PDB 2.62964000 -1.74470752 0.00000000 0.00000000 -2.38480092 0.12031089 2.12662093 -3.67275449 0.32278534 0.84343514 0.75669514 0.00000000 0.00000000 0.00000000 0.19267656 0.05901165 -0.00515895 -0.00000000 0.00000000 -0.04451716 0.00000000 2.38400000 290.00000000 28_1QZ22.PDB 3.19807000 -3.91869138 -0.63750000 -1.83750000 -3.35308598 -0.72647000 5.05904300 -4.23248916 1.01344761 1.03309233 0.73198395 0.00000000 0.00000000 0.00000000 0.14548921 0.00412611 -0.00430110 0.00000000 0.00000000 -1.11040125 0.00000000 2.38400000 290.00000000 29_1QZ22.PDB 3.80964000 -4.13401730 -0.63750000 -3.57500000 -2.80221923 -0.88758090 4.94562939 -3.40696285 1.13002440 1.14656168 1.38349764 0.00000000 0.00000000 0.00000000 0.12036149 0.06664375 -0.00733772 -0.21539211 0.00000000 -1.32809908 0.00000000 2.38400000 290.00000000 30_1QZ22.PDB 3.17482000 -3.74933643 -0.63750000 -3.57500000 -2.81395745 -0.17776674 3.85546533 -3.73180121 0.77312161 0.75214489 2.56306824 0.00000000 0.00000000 0.00000000 0.05946549 0.07101937 -0.00782243 -0.22605277 0.00000000 -0.58270141 0.00000000 2.38400000 290.00000000