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-12_1.PDB 4.08924 -7.51000 -0.25000 -1.08000 -6.17000 -1.46000 4.46000 -8.59000 0.51000 4.03000 1.92000 0.00000 0.00000 0.00000 0.17000 0.57000 0.00000 -0.23000 0.00000 -0.83000 0.00000 2.38000 63.00000 LSB1_1CKB-12_2.PDB 4.23670 -7.65000 -0.15000 -1.05000 -5.87000 -1.55000 3.94000 -8.49000 0.63000 3.55000 2.30000 0.00000 0.00000 0.00000 0.19000 0.46000 0.00000 -0.22000 0.00000 -0.93000 0.00000 2.38000 63.00000 LSB1_1CKB-12_3.PDB 4.15605 -7.12000 -0.27000 -1.14000 -6.37000 -1.41000 4.66000 -8.79000 0.79000 4.45000 1.88000 0.00000 0.00000 0.00000 0.07000 0.54000 0.00000 -0.19000 0.00000 -0.80000 0.00000 2.38000 63.00000 LSB1_1CKB-12_4.PDB 3.75942 -7.44000 -0.21000 -1.07000 -6.31000 -1.37000 4.58000 -8.86000 0.44000 4.32000 1.96000 0.00000 0.00000 0.00000 0.05000 0.43000 0.00000 -0.20000 0.00000 -0.79000 0.00000 2.38000 63.00000 LSB1_1CKB-12_5.PDB 4.06878 -7.28000 -0.24000 -1.06000 -6.61000 -1.63000 5.03000 -9.03000 0.78000 4.54000 1.99000 0.00000 0.00000 0.00000 0.05000 0.53000 0.00000 -0.16000 0.00000 -0.95000 0.00000 2.38000 63.00000 LSB1_1CKB-12_6.PDB 4.34202 -7.64000 -0.28000 -1.13000 -6.57000 -1.41000 5.02000 -8.98000 0.19000 4.49000 2.03000 0.00000 0.00000 0.00000 0.06000 0.50000 0.00000 -0.19000 0.00000 -0.86000 0.00000 2.38000 63.00000 LSB1_1CKB-12_7.PDB 4.53032 -6.22000 -0.19000 -1.10000 -6.12000 -1.27000 4.53000 -8.57000 1.33000 4.07000 1.87000 0.00000 0.00000 0.00000 0.20000 0.38000 0.00000 -0.22000 0.00000 -0.75000 0.00000 2.38000 63.00000 LSB1_1CKB-12_8.PDB 4.43438 -6.15000 -0.12000 -1.03000 -6.06000 -1.36000 4.48000 -8.50000 1.51000 3.89000 1.81000 0.00000 0.00000 0.00000 0.22000 0.43000 0.00000 -0.21000 0.00000 -0.78000 0.00000 2.38000 63.00000 LSB1_1CKB-12_9.PDB 4.61568 -6.23000 -0.17000 -1.06000 -6.34000 -1.32000 4.78000 -8.78000 1.44000 4.27000 1.89000 0.00000 0.00000 0.00000 0.15000 0.44000 0.00000 -0.33000 0.00000 -0.75000 0.00000 2.38000 63.00000 LSB1_1CKB-12_10.PDB 4.76657 -6.29000 -0.18000 -1.08000 -6.27000 -1.48000 4.89000 -8.65000 1.38000 4.00000 2.01000 0.00000 0.00000 0.00000 0.20000 0.46000 0.00000 -0.20000 0.00000 -0.90000 0.00000 2.38000 63.00000 LSB1_1CKB-12_11.PDB 5.14741 -6.35000 -0.18000 -1.08000 -6.41000 -1.50000 4.98000 -8.81000 1.42000 4.22000 2.04000 0.00000 0.00000 0.00000 0.14000 0.48000 0.00000 -0.25000 0.00000 -0.91000 0.00000 2.38000 63.00000 LSB1_1CKB-12_12.PDB 5.02465 -6.29000 -0.17000 -1.09000 -6.44000 -1.44000 5.10000 -8.79000 1.30000 4.20000 2.05000 0.00000 0.00000 0.00000 0.14000 0.47000 0.00000 -0.31000 0.00000 -0.85000 0.00000 2.38000 63.00000 LSB1_1CKB-12_13.PDB 4.32368 -7.47000 -0.24000 -2.64000 -6.66000 -1.23000 4.89000 -9.26000 1.16000 5.02000 2.09000 0.00000 0.00000 0.00000 0.11000 0.54000 0.00000 -0.15000 0.00000 -0.57000 0.00000 2.38000 63.00000 LSB1_1CKB-12_14.PDB 4.37048 -8.23000 -0.30000 -2.71000 -6.67000 -1.30000 5.20000 -9.07000 0.50000 5.00000 1.80000 0.00000 0.00000 0.00000 0.10000 0.50000 0.00000 -0.15000 0.00000 -0.63000 0.00000 2.38000 63.00000 LSB1_1CKB-12_15.PDB 3.79490 -7.56000 -0.21000 -2.79000 -5.79000 -1.05000 4.40000 -8.18000 0.24000 4.46000 1.95000 0.00000 0.00000 0.00000 0.08000 0.40000 0.00000 -0.16000 0.00000 -0.51000 0.00000 2.38000 63.00000 LSB1_1CKB-12_16.PDB 3.78520 -7.25000 -0.07000 -2.63000 -6.06000 -1.10000 4.56000 -8.60000 0.82000 4.53000 1.86000 0.00000 0.00000 0.00000 0.09000 0.42000 0.00000 -0.13000 0.00000 -0.51000 0.00000 2.38000 63.00000 LSB1_1CKB-12_17.PDB 4.82790 -8.07000 -0.32000 -2.77000 -6.76000 -1.37000 5.12000 -9.30000 0.68000 5.12000 2.28000 0.00000 0.00000 0.00000 0.09000 0.53000 0.00000 -0.15000 0.00000 -0.68000 0.00000 2.38000 63.00000 LSB1_1CKB-12_18.PDB 3.97434 -7.76000 -0.12000 -2.72000 -6.02000 -1.22000 4.73000 -8.45000 0.29000 4.36000 2.14000 0.00000 0.00000 0.00000 0.09000 0.43000 0.00000 -0.17000 0.00000 -0.66000 0.00000 2.38000 63.00000 LSB1_1CKB-12_19.PDB 5.36383 -9.93000 -0.23000 -1.90000 -6.34000 -1.18000 4.19000 -8.61000 0.37000 2.97000 1.57000 0.00000 0.00000 0.00000 0.25000 0.52000 0.00000 -0.52000 0.00000 -0.52000 0.00000 2.38000 63.00000 LSB1_1CKB-12_20.PDB 4.12407 -6.98000 -0.11000 -1.00000 -5.84000 -1.27000 3.97000 -8.46000 0.64000 3.78000 2.07000 0.00000 0.00000 0.00000 0.11000 0.44000 0.00000 -0.20000 0.00000 -0.67000 0.00000 2.38000 63.00000 LSB1_1CKB-12_21.PDB 3.87143 -7.06000 -0.23000 -1.06000 -6.61000 -1.31000 4.94000 -9.10000 0.71000 4.61000 1.84000 0.00000 0.00000 0.00000 0.08000 0.57000 0.00000 -0.21000 0.00000 -0.72000 0.00000 2.38000 63.00000 LSB1_1CKB-12_22.PDB 4.95592 -7.94000 -0.33000 -1.13000 -6.43000 -1.56000 4.87000 -8.82000 0.19000 4.22000 2.08000 0.00000 0.00000 0.00000 0.09000 0.52000 0.00000 -0.20000 0.00000 -0.92000 0.00000 2.38000 63.00000 LSB1_1CKB-12_23.PDB 4.11467 -7.64000 -0.28000 -1.16000 -6.09000 -1.43000 4.43000 -8.52000 0.30000 4.10000 1.89000 0.00000 0.00000 0.00000 0.10000 0.50000 0.00000 -0.19000 0.00000 -0.79000 0.00000 2.38000 63.00000 LSB1_1CKB-12_24.PDB 4.63204 -7.50000 -0.22000 -1.15000 -6.01000 -1.46000 4.17000 -8.63000 0.90000 3.79000 2.01000 0.00000 0.00000 0.00000 0.11000 0.45000 0.00000 -0.18000 0.00000 -0.83000 0.00000 2.38000 63.00000 LSB1_1CKB-12_25.PDB 4.41350 -7.54000 -0.28000 -1.08000 -6.48000 -1.42000 4.87000 -8.93000 0.24000 4.35000 2.01000 0.00000 0.00000 0.00000 0.11000 0.54000 0.00000 -0.14000 0.00000 -0.80000 0.00000 2.38000 63.00000 LSB1_1CKB-12_26.PDB 4.76495 -6.92000 -0.25000 -1.16000 -6.24000 -1.45000 4.81000 -8.54000 0.67000 4.27000 1.97000 0.00000 0.00000 0.00000 0.05000 0.54000 0.00000 -0.20000 0.00000 -0.84000 0.00000 2.38000 63.00000 LSB1_1CKB-12_27.PDB 5.03799 -6.51000 -0.32000 -1.18000 -6.67000 -1.37000 5.08000 -9.11000 1.51000 4.47000 1.95000 0.00000 0.00000 0.00000 0.09000 0.53000 0.00000 -0.23000 0.00000 -0.73000 0.00000 2.38000 63.00000 LSB1_1CKB-12_28.PDB 4.38904 -5.51000 -0.20000 -1.11000 -5.74000 -1.13000 4.14000 -8.13000 1.39000 3.91000 2.07000 0.00000 0.00000 0.00000 0.09000 0.41000 0.00000 -0.20000 0.00000 -0.59000 0.00000 2.38000 63.00000 LSB1_1CKB-12_29.PDB 4.06846 -7.18000 -0.17000 -1.01000 -5.96000 -1.36000 4.52000 -8.32000 0.14000 3.92000 2.01000 0.00000 0.00000 0.00000 0.07000 0.43000 0.00000 -0.20000 0.00000 -0.81000 0.00000 2.38000 63.00000 LSB1_1CKB-12_30.PDB 4.75112 -6.47000 -0.75000 -0.80000 -6.16000 -1.78000 5.86000 -8.31000 1.44000 3.14000 2.08000 0.00000 0.00000 0.00000 0.09000 0.50000 0.00000 -0.48000 0.00000 -0.80000 0.00000 2.38000 63.00000