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 LSB1_1CKB-8_1.PDB 3.57316 -8.04000 -0.65000 -2.29000 -8.72000 -0.43000 7.11000 -11.92000 1.95000 4.81000 2.65000 0.00000 0.00000 0.00000 0.19000 0.65000 0.00000 -0.30000 0.00000 -0.46000 0.00000 2.38000 63.00000 LSB1_1CKB-8_2.PDB 3.22738 -8.87000 -0.66000 -2.41000 -9.36000 -0.91000 8.17000 -12.45000 1.82000 5.22000 2.76000 0.00000 0.00000 0.00000 0.23000 0.65000 0.00000 -0.34000 0.00000 -0.94000 0.00000 2.38000 63.00000 LSB1_1CKB-8_3.PDB 4.03578 -9.42000 -1.17000 -2.97000 -9.03000 -0.80000 7.96000 -12.07000 0.90000 5.62000 3.35000 0.00000 0.00000 0.00000 0.19000 0.71000 0.00000 -0.53000 0.00000 -0.87000 0.00000 2.38000 63.00000 LSB1_1CKB-8_4.PDB 5.49999 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-0.79000 0.00000 2.38000 63.00000 LSB1_1CKB-8_9.PDB 3.43057 -6.58000 -0.57000 -2.57000 -9.30000 -1.24000 8.90000 -12.34000 2.70000 6.13000 3.38000 0.00000 0.00000 0.00000 0.34000 0.45000 0.00000 -0.74000 0.00000 -1.27000 0.00000 2.38000 63.00000 LSB1_1CKB-8_10.PDB 3.92110 -10.82000 -1.54000 -3.85000 -9.17000 -0.96000 8.64000 -12.14000 0.96000 5.65000 2.90000 0.00000 0.00000 0.00000 0.33000 0.66000 0.00000 -0.73000 0.00000 -0.92000 0.00000 2.38000 63.00000 LSB1_1CKB-8_11.PDB 2.73634 -9.95000 -1.15000 -2.92000 -9.38000 -0.46000 7.97000 -12.62000 1.81000 5.59000 1.89000 0.00000 0.00000 0.00000 0.19000 0.63000 0.00000 -0.42000 0.00000 -0.45000 0.00000 2.38000 63.00000 LSB1_1CKB-8_12.PDB 4.63689 -9.00000 -0.69000 -2.38000 -9.14000 -0.81000 8.18000 -12.14000 0.77000 5.25000 2.78000 0.00000 0.00000 0.00000 0.27000 0.64000 0.00000 -0.28000 0.00000 -0.82000 0.00000 2.38000 63.00000 LSB1_1CKB-8_13.PDB 3.56918 -8.67000 -1.21000 -1.53000 -9.09000 -1.16000 8.04000 -12.39000 2.61000 4.88000 2.57000 0.00000 0.00000 0.00000 0.30000 0.56000 0.00000 -0.54000 0.00000 -1.16000 0.00000 2.38000 63.00000 LSB1_1CKB-8_14.PDB 4.85354 -9.35000 -0.70000 -2.46000 -9.20000 -1.04000 8.50000 -12.08000 0.87000 5.29000 2.43000 0.00000 0.00000 0.00000 0.61000 0.66000 0.00000 -0.41000 0.00000 -1.15000 0.00000 2.38000 63.00000 LSB1_1CKB-8_15.PDB 3.84176 -8.07000 -0.48000 -2.89000 -9.50000 -1.31000 8.58000 -12.35000 1.84000 6.49000 3.25000 0.00000 0.00000 0.00000 0.24000 0.82000 0.00000 -0.59000 0.00000 -1.36000 0.00000 2.38000 63.00000 LSB1_1CKB-8_16.PDB 3.02841 -8.90000 -0.95000 -1.72000 -9.08000 -0.91000 6.96000 -12.61000 2.39000 5.05000 2.93000 0.00000 0.00000 0.00000 0.22000 0.54000 0.00000 -0.33000 0.00000 -0.86000 0.00000 2.38000 63.00000 LSB1_1CKB-8_17.PDB 3.98856 -9.49000 -0.70000 -2.54000 -9.24000 -0.82000 8.09000 -12.40000 0.94000 5.13000 3.15000 0.00000 0.00000 0.00000 0.19000 0.68000 0.00000 -0.41000 0.00000 -0.88000 0.00000 2.38000 63.00000 LSB1_1CKB-8_18.PDB 3.70384 -8.30000 -1.52000 -1.80000 -8.49000 -0.82000 7.33000 -11.75000 0.97000 5.60000 3.45000 0.00000 0.00000 0.00000 0.23000 0.53000 0.00000 -0.76000 0.00000 -0.73000 0.00000 2.38000 63.00000 LSB1_1CKB-8_19.PDB 4.30538 -10.00000 -0.99000 -0.98000 -8.43000 -0.66000 5.95000 -12.11000 0.66000 4.38000 2.83000 0.00000 0.00000 0.00000 0.16000 0.44000 0.00000 -0.17000 0.00000 -0.66000 0.00000 2.38000 63.00000 LSB1_1CKB-8_20.PDB 3.94241 -7.82000 -1.14000 -3.63000 -10.05000 -1.22000 9.42000 -13.15000 3.99000 5.64000 3.63000 0.00000 0.00000 0.00000 0.47000 0.72000 0.00000 -0.51000 0.00000 -1.28000 0.00000 2.38000 63.00000 LSB1_1CKB-8_21.PDB 4.40317 -8.31000 -0.60000 -1.66000 -8.65000 -0.75000 7.41000 -11.91000 1.12000 5.21000 2.38000 0.00000 0.00000 0.00000 0.18000 0.47000 0.00000 -0.30000 0.00000 -0.73000 0.00000 2.38000 63.00000 LSB1_1CKB-8_22.PDB 4.37351 -8.05000 -1.28000 -3.87000 -9.25000 -0.82000 8.46000 -12.23000 1.89000 6.28000 3.72000 0.00000 0.00000 0.00000 0.22000 0.76000 0.00000 -0.40000 0.00000 -0.78000 0.00000 2.38000 63.00000 LSB1_1CKB-8_23.PDB 4.04977 -6.08000 -0.70000 -1.98000 -8.49000 -0.70000 7.74000 -11.50000 2.25000 5.34000 3.11000 0.00000 0.00000 0.00000 0.22000 0.32000 0.00000 -0.68000 0.00000 -0.70000 0.00000 2.38000 63.00000 LSB1_1CKB-8_24.PDB 4.37206 -9.60000 -0.69000 -2.42000 -9.09000 -0.98000 7.99000 -12.17000 0.91000 5.13000 2.88000 0.00000 0.00000 0.00000 0.25000 0.68000 0.00000 -0.34000 0.00000 -1.07000 0.00000 2.38000 63.00000 LSB1_1CKB-8_25.PDB 3.70256 -8.96000 -1.58000 -4.22000 -9.88000 -1.50000 9.39000 -12.70000 2.82000 6.81000 3.34000 0.00000 0.00000 0.00000 0.42000 0.74000 0.00000 -0.58000 0.00000 -1.29000 0.00000 2.38000 63.00000 LSB1_1CKB-8_26.PDB 4.49138 -8.06000 -0.46000 -2.19000 -8.99000 -0.72000 7.52000 -12.12000 1.84000 4.89000 2.93000 0.00000 0.00000 0.00000 0.28000 0.68000 0.00000 -0.32000 0.00000 -0.74000 0.00000 2.38000 63.00000 LSB1_1CKB-8_27.PDB 4.36554 -9.72000 -1.57000 -4.12000 -9.20000 -0.98000 8.80000 -12.16000 0.92000 6.30000 3.27000 0.00000 0.00000 0.00000 0.32000 0.75000 0.00000 -0.37000 0.00000 -0.94000 0.00000 2.38000 63.00000 LSB1_1CKB-8_28.PDB 3.67264 -9.54000 -0.71000 -2.47000 -8.81000 -0.63000 7.33000 -12.03000 0.86000 5.01000 2.77000 0.00000 0.00000 0.00000 0.17000 0.62000 0.00000 -0.40000 0.00000 -0.64000 0.00000 2.38000 63.00000 LSB1_1CKB-8_29.PDB 4.57831 -8.85000 -1.43000 -3.35000 -8.95000 -0.98000 8.87000 -11.92000 0.99000 6.48000 2.62000 0.00000 0.00000 0.00000 0.32000 0.53000 0.00000 -0.58000 0.00000 -0.91000 0.00000 2.38000 63.00000 LSB1_1CKB-8_30.PDB 4.59294 -11.63000 -0.79000 -5.47000 -9.47000 -1.45000 9.24000 -12.20000 0.76000 6.90000 2.84000 0.00000 0.00000 0.00000 0.20000 0.73000 0.00000 -0.92000 0.00000 -1.27000 0.00000 2.38000 63.00000