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_1OOT-1_1.PDB 4.70013 -10.33000 -1.32000 -5.63000 -9.22000 -3.72000 10.37000 -11.18000 3.16000 6.43000 3.74000 0.00000 0.00000 0.00000 0.71000 0.64000 0.00000 -0.52000 0.00000 -3.14000 0.00000 2.38000 67.00000 LSB3_1OOT-1_2.PDB 4.57926 -12.41000 -1.31000 -4.59000 -9.70000 -5.26000 11.60000 -11.51000 1.70000 7.03000 3.48000 0.00000 0.00000 0.00000 0.77000 0.61000 0.00000 -0.96000 0.00000 -3.66000 0.00000 2.38000 67.00000 LSB3_1OOT-1_3.PDB 3.74398 -13.08000 -1.25000 -3.97000 -9.70000 -5.85000 11.77000 -11.33000 1.33000 6.49000 3.42000 0.00000 0.00000 0.00000 0.81000 0.49000 0.00000 -0.85000 0.00000 -3.95000 0.00000 2.38000 67.00000 LSB3_1OOT-1_4.PDB 4.33846 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-0.81000 0.00000 -4.07000 0.00000 2.38000 67.00000 LSB3_1OOT-1_9.PDB 4.57210 -13.75000 -0.93000 -7.35000 -10.27000 -6.16000 12.87000 -11.90000 2.91000 8.46000 3.59000 0.00000 0.00000 0.00000 1.03000 0.52000 0.00000 -1.65000 0.00000 -4.35000 0.00000 2.38000 67.00000 LSB3_1OOT-1_10.PDB 4.65671 -10.18000 -0.90000 -4.09000 -10.01000 -5.10000 12.11000 -11.87000 2.62000 7.26000 3.45000 0.00000 0.00000 0.00000 1.09000 0.52000 0.00000 -0.78000 0.00000 -3.95000 0.00000 2.38000 67.00000 LSB3_1OOT-1_11.PDB 3.77563 -11.56000 -0.93000 -4.52000 -9.36000 -3.65000 10.35000 -11.12000 0.92000 6.06000 3.17000 0.00000 0.00000 0.00000 0.90000 0.57000 0.00000 -0.56000 0.00000 -2.82000 0.00000 2.38000 67.00000 LSB3_1OOT-1_12.PDB 4.19920 -12.34000 -1.25000 -3.93000 -9.09000 -4.86000 10.61000 -10.83000 0.60000 6.28000 3.42000 0.00000 0.00000 0.00000 0.72000 0.54000 0.00000 -0.44000 0.00000 -3.55000 0.00000 2.38000 67.00000 LSB3_1OOT-1_13.PDB 6.22999 -12.42000 -2.19000 -6.48000 -10.02000 -4.42000 11.95000 -11.86000 2.02000 8.87000 3.52000 0.00000 0.00000 0.00000 0.70000 0.41000 0.00000 -0.95000 0.00000 -3.56000 0.00000 2.38000 67.00000 LSB3_1OOT-1_14.PDB 4.10307 -8.41000 -1.33000 -2.01000 -9.29000 -3.58000 10.14000 -11.13000 2.65000 5.74000 3.30000 0.00000 0.00000 0.00000 0.69000 0.54000 0.00000 -0.53000 0.00000 -3.06000 0.00000 2.38000 67.00000 LSB3_1OOT-1_15.PDB 4.85743 -13.02000 -0.95000 -4.90000 -9.24000 -4.28000 10.26000 -11.17000 0.60000 6.61000 3.46000 0.00000 0.00000 0.00000 0.60000 0.49000 0.00000 -0.50000 0.00000 -3.52000 0.00000 2.38000 67.00000 LSB3_1OOT-1_16.PDB 3.16745 -13.76000 -0.87000 -4.36000 -9.91000 -6.07000 11.78000 -11.55000 1.48000 6.90000 3.17000 0.00000 0.00000 0.00000 0.74000 0.60000 0.00000 -1.04000 0.00000 -4.03000 0.00000 2.38000 67.00000 LSB3_1OOT-1_17.PDB 5.17497 -14.50000 -1.29000 -6.69000 -9.35000 -5.37000 11.35000 -11.09000 0.78000 7.65000 3.28000 0.00000 0.00000 0.00000 0.54000 0.60000 0.00000 -0.69000 0.00000 -3.62000 0.00000 2.38000 67.00000 LSB3_1OOT-1_18.PDB 4.88234 -10.70000 -0.91000 -4.95000 -9.88000 -5.07000 11.19000 -11.67000 3.48000 7.09000 3.36000 0.00000 0.00000 0.00000 0.85000 0.64000 0.00000 -0.64000 0.00000 -3.54000 0.00000 2.38000 67.00000 LSB3_1OOT-1_19.PDB 5.64845 -10.91000 -1.27000 -5.19000 -10.45000 -5.87000 12.76000 -12.49000 5.32000 7.18000 2.96000 0.00000 0.00000 0.00000 0.94000 0.52000 0.00000 -0.84000 0.00000 -3.97000 0.00000 2.38000 67.00000 LSB3_1OOT-1_20.PDB 4.75108 -11.72000 -0.97000 -4.10000 -9.76000 -4.13000 10.53000 -11.88000 2.92000 5.80000 2.81000 0.00000 0.00000 0.00000 0.71000 0.38000 0.00000 -0.48000 0.00000 -3.18000 0.00000 2.38000 67.00000 LSB3_1OOT-1_21.PDB 4.16290 -10.26000 -1.24000 -4.78000 -8.91000 -4.29000 10.19000 -10.76000 2.49000 6.50000 3.28000 0.00000 0.00000 0.00000 0.71000 0.51000 0.00000 -0.14000 0.00000 -3.31000 0.00000 2.38000 67.00000 LSB3_1OOT-1_22.PDB 3.94342 -13.03000 -1.89000 -5.70000 -10.46000 -6.11000 13.15000 -12.19000 3.54000 7.73000 3.34000 0.00000 0.00000 0.00000 1.04000 0.60000 0.00000 -1.35000 0.00000 -4.15000 0.00000 2.38000 67.00000 LSB3_1OOT-1_23.PDB 4.12540 -10.76000 -0.91000 -3.96000 -9.21000 -3.36000 9.89000 -11.26000 1.73000 6.61000 3.21000 0.00000 0.00000 0.00000 0.75000 0.64000 0.00000 -1.44000 0.00000 -2.80000 0.00000 2.38000 67.00000 LSB3_1OOT-1_24.PDB 4.16705 -15.35000 -1.04000 -4.11000 -11.29000 -5.54000 12.34000 -13.92000 1.04000 7.67000 3.28000 0.00000 0.00000 0.00000 0.91000 0.71000 0.00000 -1.13000 0.00000 -3.56000 0.00000 2.38000 67.00000 LSB3_1OOT-1_25.PDB 3.88940 -14.59000 -1.39000 -4.48000 -10.90000 -6.19000 12.29000 -13.15000 1.68000 7.75000 4.12000 0.00000 0.00000 0.00000 1.00000 0.56000 0.00000 -1.35000 0.00000 -3.97000 0.00000 2.38000 67.00000 LSB3_1OOT-1_26.PDB 5.85195 -11.34000 -2.13000 -4.43000 -10.12000 -4.43000 11.19000 -12.10000 1.96000 8.69000 3.56000 0.00000 0.00000 0.00000 0.81000 0.52000 0.00000 -0.85000 0.00000 -3.48000 0.00000 2.38000 67.00000 LSB3_1OOT-1_27.PDB 3.66590 -8.61000 -0.97000 -1.89000 -9.53000 -3.49000 10.15000 -11.30000 3.20000 5.59000 2.95000 0.00000 0.00000 0.00000 0.42000 0.52000 0.00000 -0.96000 0.00000 -2.79000 0.00000 2.38000 67.00000 LSB3_1OOT-1_28.PDB 3.77365 -10.86000 -1.29000 -3.67000 -10.78000 -4.80000 12.10000 -12.65000 3.58000 7.12000 3.34000 0.00000 0.00000 0.00000 0.74000 0.40000 0.00000 -0.97000 0.00000 -3.60000 0.00000 2.38000 67.00000 LSB3_1OOT-1_29.PDB 2.60832 -11.30000 -1.79000 -3.79000 -10.08000 -3.14000 10.57000 -12.11000 2.58000 7.18000 2.87000 0.00000 0.00000 0.00000 0.39000 0.62000 0.00000 -1.06000 0.00000 -2.91000 0.00000 2.38000 67.00000 LSB3_1OOT-1_30.PDB 4.46700 -9.64000 -0.93000 -2.00000 -9.03000 -3.26000 9.35000 -11.03000 1.05000 5.75000 3.02000 0.00000 0.00000 0.00000 0.58000 0.54000 0.00000 -0.57000 0.00000 -2.55000 0.00000 2.38000 67.00000