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 BOI2_1YCS-10_1.PDB 3.92092 -3.66000 -1.31000 -2.97000 -6.03000 -1.41000 8.11000 -7.47000 1.93000 4.53000 2.17000 0.00000 0.00000 0.00000 0.14000 0.70000 0.00000 -0.30000 0.00000 -1.03000 0.00000 2.38000 68.00000 BOI2_1YCS-10_2.PDB 5.34251 -4.02000 -1.04000 -2.68000 -6.62000 -2.34000 9.30000 -7.78000 1.89000 5.16000 2.32000 0.00000 0.00000 0.00000 0.19000 0.68000 0.00000 -0.79000 0.00000 -1.63000 0.00000 2.38000 68.00000 BOI2_1YCS-10_3.PDB 5.71252 -5.76000 -1.08000 -5.51000 -6.81000 -2.48000 9.45000 -7.88000 1.52000 6.25000 2.37000 0.00000 0.00000 0.00000 0.17000 0.81000 0.00000 -0.39000 0.00000 -1.36000 0.00000 2.38000 68.00000 BOI2_1YCS-10_4.PDB 5.17758 -4.26000 -0.90000 -3.77000 -6.57000 -1.74000 8.72000 -7.92000 1.76000 5.64000 2.27000 0.00000 0.00000 0.00000 0.12000 0.70000 0.00000 -0.73000 0.00000 -1.14000 0.00000 2.38000 68.00000 BOI2_1YCS-10_5.PDB 4.50044 -4.11000 -1.32000 -2.81000 -6.22000 -1.56000 8.40000 -7.60000 1.66000 4.47000 2.31000 0.00000 0.00000 0.00000 0.17000 0.80000 0.00000 -0.54000 0.00000 -1.07000 0.00000 2.38000 68.00000 BOI2_1YCS-10_6.PDB 5.39621 -4.48000 -1.11000 -2.82000 -6.04000 -1.65000 8.09000 -7.50000 1.52000 4.52000 2.27000 0.00000 0.00000 0.00000 0.19000 0.67000 0.00000 -0.67000 0.00000 -1.28000 0.00000 2.38000 68.00000 BOI2_1YCS-10_7.PDB 5.15154 -5.59000 -0.95000 -5.60000 -6.85000 -2.44000 9.36000 -7.97000 1.69000 6.31000 2.30000 0.00000 0.00000 0.00000 0.19000 0.84000 0.00000 -0.26000 0.00000 -1.37000 0.00000 2.38000 68.00000 BOI2_1YCS-10_8.PDB 5.30245 -4.71000 -1.20000 -3.53000 -5.83000 -1.45000 7.71000 -7.33000 1.60000 4.72000 2.28000 0.00000 0.00000 0.00000 0.14000 0.70000 0.00000 -0.68000 0.00000 -1.15000 0.00000 2.38000 68.00000 BOI2_1YCS-10_9.PDB 5.24999 -5.20000 -1.09000 -4.36000 -6.82000 -2.73000 9.70000 -7.87000 1.89000 5.74000 2.30000 0.00000 0.00000 0.00000 0.20000 0.73000 0.00000 -0.47000 0.00000 -1.69000 0.00000 2.38000 68.00000 BOI2_1YCS-10_10.PDB 4.57245 -4.53000 -0.98000 -3.93000 -5.93000 -1.60000 7.82000 -7.43000 1.69000 5.00000 2.50000 0.00000 0.00000 0.00000 0.11000 0.78000 0.00000 -0.45000 0.00000 -1.35000 0.00000 2.38000 68.00000 BOI2_1YCS-10_11.PDB 4.04782 -4.29000 -0.88000 -3.65000 -5.85000 -1.64000 7.68000 -7.32000 1.67000 5.14000 2.39000 0.00000 0.00000 0.00000 0.11000 0.68000 0.00000 -0.59000 0.00000 -1.36000 0.00000 2.38000 68.00000 BOI2_1YCS-10_12.PDB 5.36286 -5.25000 -1.08000 -5.35000 -6.94000 -2.57000 9.81000 -8.01000 1.79000 6.42000 2.27000 0.00000 0.00000 0.00000 0.24000 0.73000 0.00000 -0.44000 0.00000 -1.40000 0.00000 2.38000 68.00000 BOI2_1YCS-10_13.PDB 5.20175 -3.62000 -1.15000 -2.51000 -6.58000 -2.30000 9.40000 -7.66000 1.93000 4.87000 2.52000 0.00000 0.00000 0.00000 0.17000 0.72000 0.00000 -0.84000 0.00000 -1.47000 0.00000 2.38000 68.00000 BOI2_1YCS-10_14.PDB 4.69121 -3.92000 -1.06000 -2.77000 -6.03000 -1.57000 8.13000 -7.49000 1.60000 4.29000 2.28000 0.00000 0.00000 0.00000 0.15000 0.60000 0.00000 -0.28000 0.00000 -1.18000 0.00000 2.38000 68.00000 BOI2_1YCS-10_15.PDB 4.61371 -3.80000 -1.07000 -3.92000 -5.87000 -1.30000 7.74000 -7.33000 1.76000 4.80000 2.45000 0.00000 0.00000 0.00000 0.21000 0.78000 0.00000 -0.30000 0.00000 -0.98000 0.00000 2.38000 68.00000 BOI2_1YCS-10_16.PDB 3.94755 -2.79000 -0.92000 -2.65000 -5.73000 -1.40000 7.52000 -7.15000 1.91000 4.34000 2.90000 0.00000 0.00000 0.00000 0.12000 0.61000 0.00000 -0.71000 0.00000 -1.02000 0.00000 2.38000 68.00000 BOI2_1YCS-10_17.PDB 3.84364 -3.49000 -0.87000 -3.47000 -5.79000 -1.26000 7.49000 -7.32000 1.98000 4.66000 2.22000 0.00000 0.00000 0.00000 0.13000 0.73000 0.00000 -0.35000 0.00000 -0.92000 0.00000 2.38000 68.00000 BOI2_1YCS-10_18.PDB 5.34688 -6.40000 -0.13000 -4.93000 -6.65000 -2.41000 8.52000 -7.97000 1.38000 5.52000 1.67000 0.00000 0.00000 0.00000 0.14000 0.60000 0.00000 -0.18000 0.00000 -1.35000 0.00000 2.38000 68.00000 BOI2_1YCS-10_19.PDB 4.20080 -3.74000 -1.14000 -4.68000 -6.23000 -1.91000 9.26000 -7.21000 1.31000 5.80000 2.60000 0.00000 0.00000 0.00000 0.18000 0.56000 0.00000 -0.52000 0.00000 -1.20000 0.00000 2.38000 68.00000 BOI2_1YCS-10_20.PDB 5.53055 -3.60000 -1.04000 -2.67000 -6.62000 -2.15000 9.31000 -7.77000 1.68000 4.97000 2.47000 0.00000 0.00000 0.00000 0.18000 0.74000 0.00000 -0.70000 0.00000 -1.26000 0.00000 2.38000 68.00000 BOI2_1YCS-10_21.PDB 4.33968 -3.25000 -1.03000 -1.01000 -5.66000 -0.83000 6.49000 -7.45000 1.45000 2.88000 2.87000 0.00000 0.00000 0.00000 0.12000 0.64000 0.00000 -0.52000 0.00000 -0.57000 0.00000 2.38000 68.00000 BOI2_1YCS-10_22.PDB 4.13773 -3.83000 -1.22000 -3.95000 -5.89000 -1.40000 7.76000 -7.37000 1.91000 4.97000 2.96000 0.00000 0.00000 0.00000 0.12000 0.74000 0.00000 -0.69000 0.00000 -1.03000 0.00000 2.38000 68.00000 BOI2_1YCS-10_23.PDB 5.49070 -3.95000 -0.31000 -2.03000 -6.45000 -2.23000 8.81000 -7.71000 1.47000 4.39000 1.77000 0.00000 0.00000 0.00000 0.12000 0.54000 0.00000 -0.24000 0.00000 -1.55000 0.00000 2.38000 68.00000 BOI2_1YCS-10_24.PDB 4.22543 -4.64000 -0.85000 -3.97000 -6.23000 -1.57000 8.26000 -7.69000 1.53000 5.30000 2.38000 0.00000 0.00000 0.00000 0.14000 0.73000 0.00000 -0.79000 0.00000 -1.13000 0.00000 2.38000 68.00000 BOI2_1YCS-10_25.PDB 5.07163 -3.45000 -1.07000 -2.60000 -6.59000 -2.14000 9.34000 -7.72000 1.92000 4.85000 2.44000 0.00000 0.00000 0.00000 0.17000 0.73000 0.00000 -0.76000 0.00000 -1.28000 0.00000 2.38000 68.00000 BOI2_1YCS-10_26.PDB 5.43118 -5.80000 -0.90000 -5.67000 -6.56000 -2.72000 9.13000 -7.45000 1.46000 6.37000 2.67000 0.00000 0.00000 0.00000 0.22000 0.60000 0.00000 -0.63000 0.00000 -1.72000 0.00000 2.38000 68.00000 BOI2_1YCS-10_27.PDB 6.15639 -4.99000 -0.98000 -4.30000 -6.88000 -2.63000 9.75000 -7.97000 1.61000 5.72000 2.40000 0.00000 0.00000 0.00000 0.32000 0.72000 0.00000 -0.61000 0.00000 -1.42000 0.00000 2.38000 68.00000 BOI2_1YCS-10_28.PDB 5.02478 -4.74000 -1.05000 -3.49000 -6.77000 -2.16000 8.82000 -8.08000 1.68000 5.41000 2.39000 0.00000 0.00000 0.00000 0.18000 0.81000 0.00000 -0.36000 0.00000 -1.32000 0.00000 2.38000 68.00000 BOI2_1YCS-10_29.PDB 4.26873 -4.76000 -0.12000 -2.88000 -6.39000 -1.90000 8.30000 -7.84000 1.60000 4.79000 1.50000 0.00000 0.00000 0.00000 0.03000 0.66000 0.00000 -0.66000 0.00000 -1.19000 0.00000 2.38000 68.00000 BOI2_1YCS-10_30.PDB 4.76967 -5.16000 -0.14000 -3.13000 -6.44000 -2.21000 8.23000 -7.73000 1.50000 4.40000 1.49000 0.00000 0.00000 0.00000 0.08000 0.61000 0.00000 -0.00000 0.00000 -1.21000 0.00000 2.38000 68.00000