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 LSB3_1SSH-3_1.PDB 4.60933 -8.10000 -0.11000 -4.48000 -10.24000 -3.59000 12.22000 -11.72000 1.58000 6.54000 3.35000 0.00000 0.00000 0.00000 0.53000 0.83000 0.00000 -0.57000 0.00000 -1.61000 0.00000 2.38000 67.00000 LSB3_1SSH-3_2.PDB 4.79512 -8.25000 -0.13000 -3.41000 -11.32000 -3.77000 13.29000 -13.48000 1.70000 6.28000 4.02000 0.00000 0.00000 0.00000 0.51000 1.42000 0.00000 -0.26000 0.00000 -1.68000 0.00000 2.38000 67.00000 LSB3_1SSH-3_3.PDB 4.80533 -5.26000 -0.13000 -1.74000 -8.87000 -1.70000 9.39000 -11.13000 1.39000 5.45000 3.18000 0.00000 0.00000 0.00000 0.35000 0.72000 0.00000 -0.34000 0.00000 -1.13000 0.00000 2.38000 67.00000 LSB3_1SSH-3_4.PDB 4.77359 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0.00000 -1.61000 0.00000 2.38000 67.00000 LSB3_1SSH-3_9.PDB 5.83680 -4.40000 -0.11000 -1.71000 -9.21000 -1.28000 9.76000 -11.75000 1.56000 5.21000 3.70000 0.00000 0.00000 0.00000 0.51000 0.73000 0.00000 -0.24000 0.00000 -0.84000 0.00000 2.38000 67.00000 LSB3_1SSH-3_10.PDB 5.29725 -9.91000 -0.19000 -3.41000 -11.45000 -3.55000 12.40000 -14.00000 1.78000 6.30000 3.59000 0.00000 0.00000 0.00000 0.71000 1.39000 0.00000 -0.49000 0.00000 -1.60000 0.00000 2.38000 67.00000 LSB3_1SSH-3_11.PDB 4.87212 -6.56000 -0.19000 -2.19000 -11.45000 -3.26000 12.77000 -14.08000 2.72000 6.27000 4.41000 0.00000 0.00000 0.00000 0.51000 1.53000 0.00000 -0.55000 0.00000 -1.52000 0.00000 2.38000 67.00000 LSB3_1SSH-3_12.PDB 4.56524 -7.94000 -0.19000 -2.00000 -10.99000 -3.37000 12.36000 -13.22000 1.68000 5.76000 3.55000 0.00000 0.00000 0.00000 0.47000 1.59000 0.00000 -0.37000 0.00000 -1.61000 0.00000 2.38000 67.00000 LSB3_1SSH-3_13.PDB 4.70813 -7.48000 -0.07000 -4.33000 -10.45000 -3.84000 12.55000 -11.94000 1.89000 6.66000 3.62000 0.00000 0.00000 0.00000 0.52000 0.73000 0.00000 -0.46000 0.00000 -1.64000 0.00000 2.38000 67.00000 LSB3_1SSH-3_14.PDB 5.00047 -7.66000 -0.14000 -2.79000 -11.19000 -3.87000 13.01000 -13.20000 2.01000 6.27000 3.86000 0.00000 0.00000 0.00000 0.60000 1.11000 0.00000 -0.54000 0.00000 -1.67000 0.00000 2.38000 67.00000 LSB3_1SSH-3_15.PDB 4.92954 -8.30000 -0.06000 -3.46000 -10.23000 -3.59000 11.60000 -12.16000 1.46000 6.39000 3.38000 0.00000 0.00000 0.00000 0.55000 0.97000 0.00000 -0.50000 0.00000 -1.68000 0.00000 2.38000 67.00000 LSB3_1SSH-3_16.PDB 6.01763 -6.45000 -0.11000 -1.99000 -10.42000 -3.41000 12.05000 -12.66000 1.81000 6.11000 3.35000 0.00000 0.00000 0.00000 0.49000 0.50000 0.00000 -0.07000 0.00000 -1.59000 0.00000 2.38000 67.00000 LSB3_1SSH-3_17.PDB 4.55273 -9.15000 -0.19000 -3.43000 -10.61000 -3.45000 11.57000 -12.93000 1.48000 6.15000 3.71000 0.00000 0.00000 0.00000 0.55000 1.25000 0.00000 -0.41000 0.00000 -1.58000 0.00000 2.38000 67.00000 LSB3_1SSH-3_18.PDB 4.68766 -5.60000 -0.09000 -2.24000 -9.67000 -3.33000 10.89000 -11.77000 2.58000 5.76000 3.50000 0.00000 0.00000 0.00000 0.42000 0.53000 0.00000 -0.08000 0.00000 -1.56000 0.00000 2.38000 67.00000 LSB3_1SSH-3_19.PDB 5.29871 -7.60000 -0.11000 -3.99000 -10.35000 -3.79000 12.71000 -11.80000 1.66000 6.65000 3.26000 0.00000 0.00000 0.00000 0.63000 0.69000 0.00000 -0.69000 0.00000 -1.78000 0.00000 2.38000 67.00000 LSB3_1SSH-3_20.PDB 5.27971 -10.01000 -0.17000 -3.45000 -11.19000 -3.55000 12.09000 -13.75000 2.22000 6.15000 3.15000 0.00000 0.00000 0.00000 0.56000 1.66000 0.00000 -0.42000 0.00000 -1.67000 0.00000 2.38000 67.00000 LSB3_1SSH-3_21.PDB 5.03488 -4.58000 -0.09000 -2.88000 -8.98000 -1.16000 9.96000 -10.98000 1.33000 5.41000 3.58000 0.00000 0.00000 0.00000 0.56000 0.75000 0.00000 -0.49000 0.00000 -0.84000 0.00000 2.38000 67.00000 LSB3_1SSH-3_22.PDB 5.51585 -7.82000 -0.11000 -2.31000 -11.94000 -3.91000 13.66000 -14.57000 2.74000 6.32000 3.90000 0.00000 0.00000 0.00000 0.59000 1.61000 0.00000 -0.45000 0.00000 -1.73000 0.00000 2.38000 67.00000 LSB3_1SSH-3_23.PDB 5.51784 -4.48000 -0.09000 -2.89000 -9.63000 -1.78000 11.30000 -11.22000 1.42000 5.98000 3.65000 0.00000 0.00000 0.00000 0.40000 0.72000 0.00000 -0.40000 0.00000 -1.23000 0.00000 2.38000 67.00000 LSB3_1SSH-3_24.PDB 5.33533 -9.27000 -0.18000 -3.46000 -11.49000 -3.84000 12.89000 -13.73000 1.80000 6.39000 4.01000 0.00000 0.00000 0.00000 0.58000 1.54000 0.00000 -0.44000 0.00000 -1.79000 0.00000 2.38000 67.00000 LSB3_1SSH-3_25.PDB 4.74625 -9.11000 -0.20000 -3.34000 -10.86000 -3.64000 12.03000 -13.26000 1.57000 5.83000 4.13000 0.00000 0.00000 0.00000 0.50000 1.45000 0.00000 -0.29000 0.00000 -1.59000 0.00000 2.38000 67.00000 LSB3_1SSH-3_26.PDB 5.30653 -6.83000 -0.12000 -2.94000 -11.57000 -2.28000 13.18000 -13.79000 1.57000 6.87000 3.81000 0.00000 0.00000 0.00000 0.56000 1.25000 0.00000 -0.61000 0.00000 -1.51000 0.00000 2.38000 67.00000 LSB3_1SSH-3_27.PDB 5.49158 -6.43000 -0.07000 -3.10000 -10.14000 -3.23000 12.11000 -11.73000 1.82000 6.16000 3.35000 0.00000 0.00000 0.00000 0.45000 0.55000 0.00000 -0.59000 0.00000 -1.46000 0.00000 2.38000 67.00000 LSB3_1SSH-3_28.PDB 4.69994 -9.02000 -0.10000 -3.49000 -10.75000 -3.55000 11.95000 -12.98000 1.65000 6.18000 3.63000 0.00000 0.00000 0.00000 0.51000 1.39000 0.00000 -0.39000 0.00000 -1.68000 0.00000 2.38000 67.00000 LSB3_1SSH-3_29.PDB 4.58298 -9.17000 -0.07000 -4.51000 -10.30000 -3.55000 11.78000 -12.22000 1.41000 6.67000 3.10000 0.00000 0.00000 0.00000 0.62000 0.91000 0.00000 -0.50000 0.00000 -1.60000 0.00000 2.38000 67.00000 LSB3_1SSH-3_30.PDB 5.86681 -8.41000 -0.12000 -3.20000 -11.55000 -3.16000 13.50000 -13.42000 1.89000 5.90000 3.29000 0.00000 0.00000 0.00000 0.64000 1.24000 0.00000 -0.69000 0.00000 -1.49000 0.00000 2.38000 67.00000