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_CKB-OOT-12_1.PDB 4.01034 -8.16000 -0.58000 -1.36000 -4.39000 -3.18000 5.53000 -5.16000 0.24000 2.66000 1.31000 0.00000 0.00000 0.00000 0.21000 0.31000 0.00000 -0.59000 0.00000 -2.86000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_2.PDB 3.76142 -7.16000 -0.56000 -1.39000 -4.01000 -2.76000 5.19000 -4.67000 0.27000 2.48000 1.26000 0.00000 0.00000 0.00000 0.09000 0.18000 0.00000 -0.52000 0.00000 -2.53000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_3.PDB 2.91272 -7.69000 -0.58000 -1.41000 -4.49000 -2.77000 5.83000 -5.53000 0.19000 2.81000 1.26000 0.00000 0.00000 0.00000 0.16000 0.21000 0.00000 -0.64000 0.00000 -2.52000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_4.PDB 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0.00000 -0.56000 0.00000 -2.78000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_9.PDB 3.32226 -8.28000 -0.51000 -1.30000 -4.51000 -3.22000 5.42000 -5.37000 0.19000 2.68000 1.33000 0.00000 0.00000 0.00000 0.32000 0.33000 0.00000 -0.41000 0.00000 -2.89000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_10.PDB 3.42076 -8.44000 -0.45000 -1.87000 -5.50000 -3.63000 6.83000 -6.22000 0.46000 4.10000 1.14000 0.00000 0.00000 0.00000 0.05000 0.24000 0.00000 -0.35000 0.00000 -3.00000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_11.PDB 3.40294 -7.12000 -0.55000 -1.40000 -3.81000 -2.70000 4.73000 -4.59000 0.15000 2.49000 1.23000 0.00000 0.00000 0.00000 0.14000 0.16000 0.00000 -0.27000 0.00000 -2.54000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_12.PDB 2.16076 -6.24000 -0.12000 -2.64000 -4.92000 -3.65000 5.77000 -5.88000 2.91000 4.49000 1.50000 0.00000 0.00000 0.00000 0.01000 0.29000 0.00000 -0.75000 0.00000 -2.96000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_13.PDB 2.91638 -6.97000 -0.37000 -1.25000 -3.60000 -2.61000 4.24000 -4.45000 0.11000 2.54000 1.80000 0.00000 0.00000 0.00000 0.16000 0.12000 0.00000 -1.00000 0.00000 -2.54000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_14.PDB 2.98050 -7.60000 -0.56000 -1.40000 -3.98000 -3.00000 5.17000 -4.75000 0.20000 2.45000 1.24000 0.00000 0.00000 0.00000 0.13000 0.18000 0.00000 -0.38000 0.00000 -2.73000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_15.PDB 3.34771 -9.00000 -0.56000 -1.95000 -5.55000 -3.77000 6.80000 -6.73000 0.34000 3.92000 1.26000 0.00000 0.00000 0.00000 0.14000 0.26000 0.00000 -0.38000 0.00000 -2.51000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_16.PDB 3.07727 -6.28000 -0.59000 -2.11000 -4.37000 -2.78000 6.20000 -4.82000 0.14000 4.24000 1.16000 0.00000 0.00000 0.00000 0.03000 0.22000 0.00000 -0.33000 0.00000 -3.06000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_17.PDB 3.76491 -7.55000 -0.56000 -1.41000 -3.88000 -2.73000 4.94000 -4.66000 0.08000 2.29000 1.19000 0.00000 0.00000 0.00000 0.13000 0.12000 0.00000 -0.46000 0.00000 -2.47000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_18.PDB 1.79875 -6.55000 -0.19000 -1.02000 -5.25000 -3.45000 5.71000 -6.29000 2.96000 3.16000 0.89000 0.00000 0.00000 0.00000 0.01000 0.34000 0.00000 -0.34000 0.00000 -2.73000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_19.PDB 3.76428 -7.31000 -0.35000 -1.21000 -3.58000 -2.58000 4.10000 -4.49000 0.13000 2.30000 1.33000 0.00000 0.00000 0.00000 0.22000 0.22000 0.00000 -0.63000 0.00000 -2.55000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_20.PDB 2.36904 -7.06000 -0.56000 -3.10000 -4.15000 -1.72000 4.54000 -5.04000 0.06000 3.61000 1.06000 0.00000 0.00000 0.00000 0.13000 0.19000 0.00000 -0.29000 0.00000 -1.59000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_21.PDB 1.82573 -6.26000 -0.19000 -1.03000 -5.05000 -3.15000 5.46000 -6.28000 2.98000 2.88000 0.87000 0.00000 0.00000 0.00000 0.02000 0.35000 0.00000 -0.34000 0.00000 -2.44000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_22.PDB 2.82997 -7.30000 -0.58000 -1.42000 -4.38000 -2.42000 5.21000 -5.46000 0.25000 2.96000 1.20000 0.00000 0.00000 0.00000 0.10000 0.22000 0.00000 -0.45000 0.00000 -2.32000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_23.PDB 2.92704 -4.12000 -0.99000 -1.49000 -5.03000 -2.70000 5.51000 -6.30000 3.09000 4.74000 1.71000 0.00000 0.00000 0.00000 0.04000 0.45000 0.00000 -0.31000 0.00000 -2.39000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_24.PDB 3.65722 -6.69000 -0.56000 -1.39000 -3.94000 -2.98000 5.71000 -4.12000 0.07000 2.84000 1.25000 0.00000 0.00000 0.00000 0.03000 0.20000 0.00000 -0.54000 0.00000 -3.08000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_25.PDB 3.59909 -7.11000 -0.58000 -1.37000 -4.31000 -2.11000 4.91000 -5.51000 0.23000 2.44000 1.15000 0.00000 0.00000 0.00000 0.35000 0.21000 0.00000 -0.32000 0.00000 -2.00000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_26.PDB 3.26060 -5.91000 -0.21000 -1.05000 -5.01000 -2.96000 5.05000 -6.37000 3.06000 2.86000 1.25000 0.00000 0.00000 0.00000 0.04000 0.29000 0.00000 -0.22000 0.00000 -2.36000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_27.PDB 3.15518 -9.70000 -0.59000 -2.75000 -4.81000 -2.07000 4.63000 -5.70000 0.05000 3.17000 0.85000 0.00000 0.00000 0.00000 0.25000 0.33000 0.00000 -0.63000 0.00000 -2.11000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_28.PDB 3.14640 -7.83000 -0.58000 -1.05000 -4.26000 -2.78000 5.05000 -5.38000 0.28000 2.56000 1.22000 0.00000 0.00000 0.00000 0.13000 0.23000 0.00000 -0.41000 0.00000 -2.62000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_29.PDB 1.97957 -8.58000 -0.37000 -1.88000 -5.13000 -3.96000 6.57000 -6.01000 0.56000 3.46000 1.20000 0.00000 0.00000 0.00000 0.15000 0.24000 0.00000 -0.44000 0.00000 -2.74000 0.00000 2.38000 65.00000 LSB3_CKB-OOT-12_30.PDB 3.09920 -8.03000 -0.52000 -1.48000 -4.40000 -1.94000 3.95000 -6.06000 0.15000 3.18000 1.14000 0.00000 0.00000 0.00000 0.23000 0.19000 0.00000 -0.30000 0.00000 -1.97000 0.00000 2.38000 65.00000