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_1NVR2.PDB 1.69339000 -11.31567992 -5.25000000 -2.30000000 -8.58871811 -2.28168689 12.36863268 -12.64049554 0.87571453 3.02063702 4.52517928 0.00000000 0.00000000 0.00000000 0.66190238 0.28871459 0.00000000 -0.18685806 0.00000000 -1.51998722 0.00000000 2.38400000 269.00000000 2_1NVR2.PDB 1.68200000 -10.83744243 -5.25000000 -2.63750000 -8.57989208 -2.32443261 12.41585980 -12.57719330 0.61281294 3.38300968 5.27122753 0.00000000 0.00000000 0.00000000 0.54069586 0.32829874 0.00000000 -0.17040293 0.00000000 -1.52162732 0.00000000 2.38400000 269.00000000 3_1NVR2.PDB 1.78422000 -10.91426987 -5.28750000 -1.93750000 -9.39662567 -3.77608487 13.57222107 -13.36476312 1.14506433 3.67891103 5.45004448 0.00000000 0.00000000 0.00000000 1.29402467 0.35243287 0.00000000 -0.11901727 0.00000000 -2.17304451 0.00000000 2.38400000 269.00000000 4_1NVR2.PDB 1.67838000 -10.80902151 -5.28750000 -2.23750000 -9.23312234 -3.23196553 13.23136549 -13.20549950 0.79613416 3.66907359 6.10515844 0.00000000 0.00000000 0.00000000 0.69841105 0.35696292 0.00000000 -0.13954082 0.00000000 -1.97403604 0.00000000 2.38400000 269.00000000 5_1NVR2.PDB 1.84394000 -10.42778227 -5.28750000 -1.96250000 -8.35752890 -2.50246003 11.89211383 -12.10052450 0.58785869 3.39262021 5.28872629 0.00000000 0.00000000 0.00000000 0.69162957 0.28573612 0.00000000 -0.12523792 0.00000000 -1.94497950 0.00000000 2.38400000 269.00000000 6_1NVR2.PDB 1.70244000 -10.68688198 -5.25000000 -1.92500000 -8.48350417 -2.76637726 12.52024605 -12.12886187 0.46105816 3.29556124 5.28531482 0.00000000 0.00000000 0.00000000 0.69525104 0.34133763 0.00000000 -0.31912862 0.00000000 -2.07144139 0.00000000 2.38400000 269.00000000 7_1NVR2.PDB 1.44355000 -10.87485003 -5.88750000 -4.31250000 -7.97905424 -2.06142043 12.26713017 -11.29279116 0.86777882 3.42729600 4.74030708 0.00000000 0.00000000 0.00000000 0.91982700 0.28372590 0.00000000 -0.11938503 0.00000000 -1.44453824 0.00000000 2.38400000 269.00000000 8_1NVR2.PDB 1.29278000 -11.84632740 -5.88750000 -4.61250000 -8.06962274 -2.11055459 12.02323210 -11.65829696 1.06853366 3.65934378 4.70315643 0.00000000 0.00000000 0.00000000 0.63302528 0.30485003 0.00000000 -0.17795669 0.00000000 -1.41718767 0.00000000 2.38400000 269.00000000 9_1NVR2.PDB 1.85957000 -12.87048921 -5.28750000 -1.93750000 -9.60101094 -5.11867760 14.21984648 -12.98484100 1.15940738 2.99898373 5.64222059 0.00000000 0.00000000 0.00000000 0.96554187 0.39079898 0.00000000 -0.10530110 0.00000000 -2.82165863 0.00000000 2.38400000 269.00000000 10_1NVR2.PDB 1.40516000 -12.06287972 -5.28750000 -2.08750000 -9.76482979 -5.19616348 14.38374661 -13.27518344 1.30169900 4.38070011 5.46719642 0.00000000 0.00000000 0.00000000 1.06709996 0.36048916 0.00000000 -0.17031072 0.00000000 -2.88183439 0.00000000 2.38400000 269.00000000 11_1NVR2.PDB 1.21355000 -10.73422446 -5.92500000 -3.21250000 -8.67020548 -3.74182346 13.33270611 -11.90440467 0.64636848 3.82914600 5.88144605 0.00000000 0.00000000 0.00000000 1.35929800 0.30513926 0.00000000 -0.14072841 0.00000000 -2.18852708 0.00000000 2.38400000 269.00000000 12_1NVR2.PDB 1.60375000 -9.39586302 -5.25000000 -2.30000000 -8.64282712 -2.15528466 12.36616558 -12.15564723 1.55634184 3.06547756 5.17196020 0.00000000 0.00000000 0.00000000 0.69339329 0.31409571 0.00265973 -0.26446445 0.00000000 -1.48363775 0.00000000 2.38400000 269.00000000 13_1NVR2.PDB 1.59320000 -10.93583790 -5.25000000 -2.97500000 -8.47577305 -2.52543580 12.41920542 -12.19159488 1.10534077 3.69023802 4.53342692 0.00000000 0.00000000 0.00000000 1.05106099 0.29636799 0.00000000 -0.16517718 0.00000000 -2.15212911 0.00000000 2.38400000 269.00000000 14_1NVR2.PDB 1.61541000 -9.99338186 -5.25000000 -3.97500000 -8.21278039 -1.81728641 12.47324576 -11.70863657 0.52174113 3.11459166 5.35225379 0.00000000 0.00000000 0.00000000 0.70860411 0.30236184 0.00000000 -0.22695650 0.00000000 -0.97315844 0.00000000 2.38400000 269.00000000 15_1NVR2.PDB 1.28075000 -10.53530125 -5.92500000 -1.91250000 -8.64814439 -3.83931562 12.99867915 -12.11890884 1.25380902 3.63529235 5.79854934 0.00000000 0.00000000 0.00000000 0.64240495 0.30679828 0.00000000 -0.14973324 0.00000000 -2.27043396 0.00000000 2.38400000 269.00000000 16_1NVR2.PDB 2.11268000 -10.78831015 -5.25000000 -4.03750000 -8.97120735 -2.41182650 13.75119476 -12.42769067 0.91940892 4.42968142 4.51798660 0.00000000 0.00000000 0.00000000 0.82293727 0.30820642 0.00000000 -0.13612870 0.00000000 -1.99516590 0.00000000 2.38400000 269.00000000 17_1NVR2.PDB 1.44075000 -9.63280309 -5.25000000 -2.30000000 -8.39780569 -1.79660193 12.31959438 -12.16090584 0.37918827 2.81997561 5.34810247 0.00000000 0.00000000 0.00000000 0.67621708 0.29024062 0.00000000 -0.24653521 0.00000000 -1.02403224 0.00000000 2.38400000 269.00000000 18_1NVR2.PDB 1.65994000 -9.55227738 -5.28750000 -1.93750000 -9.08929436 -4.01760806 13.97938443 -12.12500244 0.90624141 3.60316808 5.79840484 0.00000000 0.00000000 0.00000000 0.80553188 0.37277095 0.00228473 -0.04418674 0.00000000 -2.14620115 0.00000000 2.38400000 269.00000000 19_1NVR2.PDB 1.89474000 -9.70584861 -5.28750000 -0.90000000 -9.51192673 -2.47968120 12.71282908 -14.28812289 1.45720639 3.23531104 5.74001392 0.00000000 0.00000000 0.00000000 1.03568392 0.36428966 0.00000000 0.00207292 0.00000000 -1.42173506 0.00000000 2.38400000 269.00000000 20_1NVR2.PDB 2.07324000 -11.81362344 -5.28750000 -2.57500000 -9.12902460 -4.30279997 13.87246854 -12.43677336 0.34855817 4.24674964 5.83184399 0.00000000 0.00000000 0.00000000 0.87046974 0.31109368 0.00000000 -0.33987708 0.00000000 -2.91273849 0.00000000 2.38400000 269.00000000 21_1NVR2.PDB 1.39052000 -11.01939913 -5.28750000 -1.75000000 -9.09674577 -4.81734322 14.37858384 -11.96529817 0.83105167 3.31645621 4.72262205 0.00000000 0.00000000 0.00000000 1.02432772 0.33528206 0.00000000 -0.27293817 0.00000000 -2.10261529 0.00000000 2.38400000 269.00000000 22_1NVR2.PDB 1.83864000 -10.22817659 -5.28750000 -0.90000000 -9.75169624 -2.35336251 12.52645900 -14.87509120 1.08490876 3.42771525 5.81049682 0.00000000 0.00000000 0.00000000 1.46676452 0.36317021 0.00000000 0.00130610 0.00000000 -1.37817707 0.00000000 2.38400000 269.00000000 23_1NVR2.PDB 1.76145000 -11.11501478 -5.25000000 -3.67500000 -8.67325562 -2.19169731 12.59788763 -12.22613621 0.92270372 3.54772283 4.59003333 0.00000000 0.00000000 0.00000000 0.90847886 0.30139001 0.00000000 -0.17516485 0.00000000 -1.49058717 0.00000000 2.38400000 269.00000000 24_1NVR2.PDB 1.11436000 -8.04622772 -5.28750000 -0.90000000 -9.16734564 -3.70222157 13.55807057 -12.74262186 3.24662119 3.22411259 4.86318303 0.00000000 0.00000000 0.00000000 0.86035665 0.36546164 0.00000000 -0.09658180 0.00000000 -1.90230088 0.00000000 2.38400000 269.00000000 25_1NVR2.PDB 1.91654000 -10.44464626 -5.28750000 -1.05000000 -9.38356101 -4.09194164 14.13438737 -12.65070676 0.39033586 3.40391856 6.09054925 0.00000000 0.00000000 0.00000000 0.87863326 0.36323671 0.00000000 -0.16095810 0.00000000 -2.71780306 0.00000000 2.38400000 269.00000000 26_1NVR2.PDB 1.05679000 -9.53707457 -5.21250000 -1.92500000 -8.13588940 -0.70493697 11.72867398 -12.01523878 0.87083321 1.97661831 3.92974074 0.00000000 0.00000000 0.00000000 0.71704193 0.21830817 0.00000000 -0.28055859 0.00000000 -0.48585901 0.00000000 2.38400000 269.00000000 27_1NVR2.PDB 1.43766000 -10.16849266 -5.21250000 -1.92500000 -8.58219155 -0.69198892 11.76147717 -12.91677595 1.11540006 2.32125470 4.06674480 0.00000000 0.00000000 0.00000000 0.66046496 0.23855293 0.00000000 -0.27951891 0.00000000 -0.48585901 0.00000000 2.38400000 269.00000000 28_1NVR2.PDB 1.76652000 -8.69643180 -5.25000000 -2.97500000 -8.41357273 -2.35460795 12.48438533 -11.54994202 1.98888268 3.65029596 5.18484962 0.00000000 0.00000000 0.00000000 0.67820470 0.30260049 0.00225326 -0.22015956 0.00000000 -1.92202108 0.00000000 2.38400000 269.00000000 29_1NVR2.PDB 1.72535000 -12.01525668 -5.28750000 -1.75000000 -9.72731034 -4.71213795 14.68333501 -12.73111173 0.83228317 2.53776346 5.52489586 0.00000000 0.00000000 0.00000000 0.94871441 0.36115907 0.00000000 -0.00401872 0.00000000 -2.33016985 0.00000000 2.38400000 269.00000000 30_1NVR2.PDB 1.12129000 -8.86528444 -5.88750000 -2.93750000 -8.05216011 -2.19077034 12.22233377 -10.85013012 1.60750458 3.03037334 5.21674299 0.00000000 0.00000000 0.00000000 0.61533149 0.30056942 0.00237147 -0.17684232 0.00000000 -1.46503920 0.00000000 2.38400000 269.00000000