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 BOI1_1YCS-13_1.PDB 5.35971 -9.71000 -0.59000 -1.16000 -9.43000 -1.95000 9.03000 -12.11000 1.40000 4.24000 2.40000 0.00000 0.00000 0.00000 0.17000 0.71000 0.00000 -1.17000 0.00000 -0.54000 0.00000 2.38000 68.00000 BOI1_1YCS-13_2.PDB 6.62536 -8.76000 -0.60000 -1.21000 -9.37000 -2.00000 8.99000 -11.90000 1.50000 4.19000 2.40000 0.00000 0.00000 0.00000 0.36000 0.75000 0.00000 -0.59000 0.00000 -0.51000 0.00000 2.38000 68.00000 BOI1_1YCS-13_3.PDB 7.39203 -9.70000 -0.59000 -2.30000 -9.76000 -1.87000 9.50000 -12.40000 1.45000 5.33000 2.52000 0.00000 0.00000 0.00000 0.18000 0.67000 0.00000 -1.17000 0.00000 -0.56000 0.00000 2.38000 68.00000 BOI1_1YCS-13_4.PDB 5.01415 -9.29000 -0.58000 -4.03000 -9.61000 -2.14000 9.83000 -11.98000 2.31000 5.49000 3.00000 0.00000 0.00000 0.00000 0.18000 0.65000 0.00000 -1.02000 0.00000 -0.73000 0.00000 2.38000 68.00000 BOI1_1YCS-13_5.PDB 5.17455 -10.14000 -0.59000 -3.00000 -9.71000 -2.02000 9.63000 -12.22000 1.83000 5.15000 2.44000 0.00000 0.00000 0.00000 0.11000 0.69000 0.00000 -1.23000 0.00000 -0.53000 0.00000 2.38000 68.00000 BOI1_1YCS-13_6.PDB 6.52127 -10.05000 -0.58000 -4.12000 -9.66000 -2.03000 9.77000 -12.02000 1.48000 5.66000 3.00000 0.00000 0.00000 0.00000 0.13000 0.66000 0.00000 -1.03000 0.00000 -0.66000 0.00000 2.38000 68.00000 BOI1_1YCS-13_7.PDB 6.06716 -9.49000 -0.59000 -3.96000 -9.74000 -2.10000 10.05000 -12.13000 1.37000 5.59000 3.15000 0.00000 0.00000 0.00000 0.12000 0.67000 0.00000 -0.54000 0.00000 -0.70000 0.00000 2.38000 68.00000 BOI1_1YCS-13_8.PDB 6.52799 -10.50000 -2.11000 -4.47000 -10.27000 -2.09000 11.57000 -12.33000 1.62000 5.88000 3.14000 0.00000 0.00000 0.00000 0.46000 0.81000 0.00000 -1.28000 0.00000 -0.61000 0.00000 2.38000 68.00000 BOI1_1YCS-13_9.PDB 6.69256 -7.54000 -0.60000 -0.62000 -9.10000 -1.84000 8.80000 -11.74000 1.95000 4.12000 2.42000 0.00000 0.00000 0.00000 0.40000 0.76000 0.00000 -0.77000 0.00000 -0.57000 0.00000 2.38000 68.00000 BOI1_1YCS-13_10.PDB 5.81622 -10.38000 -0.55000 -4.69000 -9.85000 -2.25000 10.15000 -12.24000 1.95000 5.68000 3.10000 0.00000 0.00000 0.00000 0.11000 0.67000 0.00000 -1.06000 0.00000 -0.73000 0.00000 2.38000 68.00000 BOI1_1YCS-13_11.PDB 6.63408 -9.77000 -0.59000 -2.32000 -9.58000 -1.86000 9.39000 -12.11000 1.12000 5.17000 2.49000 0.00000 0.00000 0.00000 0.15000 0.66000 0.00000 -1.13000 0.00000 -0.50000 0.00000 2.38000 68.00000 BOI1_1YCS-13_12.PDB 6.77675 -9.20000 -0.59000 -2.23000 -9.74000 -1.87000 9.35000 -12.34000 1.65000 4.76000 2.99000 0.00000 0.00000 0.00000 0.41000 0.75000 0.00000 -1.03000 0.00000 -0.56000 0.00000 2.38000 68.00000 BOI1_1YCS-13_13.PDB 6.55401 -8.92000 -0.60000 -0.53000 -9.46000 -1.82000 8.84000 -12.13000 1.37000 4.29000 2.32000 0.00000 0.00000 0.00000 0.44000 0.76000 0.00000 -1.25000 0.00000 -0.41000 0.00000 2.38000 68.00000 BOI1_1YCS-13_14.PDB 6.15743 -8.75000 -2.29000 -4.46000 -9.93000 -2.06000 11.56000 -11.57000 1.47000 6.78000 2.86000 0.00000 0.00000 0.00000 0.19000 0.76000 0.00000 -0.83000 0.00000 -0.47000 0.00000 2.38000 68.00000 BOI1_1YCS-13_15.PDB 5.52121 -9.52000 -0.56000 -5.55000 -9.70000 -1.93000 9.89000 -12.09000 2.39000 5.70000 3.19000 0.00000 0.00000 0.00000 0.26000 0.66000 0.00000 -0.52000 0.00000 -0.58000 0.00000 2.38000 68.00000 BOI1_1YCS-13_16.PDB 6.50561 -8.36000 -0.60000 -0.55000 -9.36000 -1.76000 8.80000 -12.09000 1.96000 4.25000 2.35000 0.00000 0.00000 0.00000 0.33000 0.79000 0.00000 -1.15000 0.00000 -0.53000 0.00000 2.38000 68.00000 BOI1_1YCS-13_17.PDB 6.81970 -8.28000 -0.57000 -1.25000 -9.17000 -2.14000 9.11000 -11.62000 2.02000 4.04000 2.37000 0.00000 0.00000 0.00000 0.32000 0.76000 0.00000 -0.78000 0.00000 -0.60000 0.00000 2.38000 68.00000 BOI1_1YCS-13_18.PDB 7.81705 -9.64000 -2.30000 -2.36000 -10.19000 -1.96000 10.74000 -12.26000 1.36000 5.92000 2.89000 0.00000 0.00000 0.00000 0.36000 0.82000 0.00000 -1.33000 0.00000 -0.50000 0.00000 2.38000 68.00000 BOI1_1YCS-13_19.PDB 5.44214 -7.60000 -0.59000 -0.58000 -9.67000 -1.74000 8.99000 -12.49000 1.97000 4.23000 3.13000 0.00000 0.00000 0.00000 0.14000 0.70000 0.00000 -0.55000 0.00000 -0.43000 0.00000 2.38000 68.00000 BOI1_1YCS-13_20.PDB 7.47937 -8.62000 -2.30000 -3.78000 -9.41000 -1.94000 10.81000 -11.11000 1.45000 5.49000 2.76000 0.00000 0.00000 0.00000 0.61000 0.70000 0.00000 -0.67000 0.00000 -0.53000 0.00000 2.38000 68.00000 BOI1_1YCS-13_21.PDB 6.87275 -8.78000 -0.60000 -0.55000 -9.38000 -1.89000 8.80000 -12.10000 1.39000 4.39000 2.43000 0.00000 0.00000 0.00000 0.40000 0.76000 0.00000 -1.16000 0.00000 -0.53000 0.00000 2.38000 68.00000 BOI1_1YCS-13_22.PDB 6.14831 -10.30000 -2.06000 -3.83000 -10.39000 -1.95000 11.46000 -12.60000 1.44000 6.00000 3.27000 0.00000 0.00000 0.00000 0.19000 0.83000 0.00000 -1.29000 0.00000 -0.53000 0.00000 2.38000 68.00000 BOI1_1YCS-13_23.PDB 6.52954 -9.65000 -0.57000 -3.63000 -9.72000 -1.97000 9.52000 -12.22000 1.64000 5.08000 2.80000 0.00000 0.00000 0.00000 0.50000 0.66000 0.00000 -0.59000 0.00000 -0.49000 0.00000 2.38000 68.00000 BOI1_1YCS-13_24.PDB 6.56109 -9.67000 -0.56000 -2.71000 -9.86000 -1.88000 9.53000 -12.64000 1.99000 4.81000 2.99000 0.00000 0.00000 0.00000 0.13000 0.72000 0.00000 -0.88000 0.00000 -0.58000 0.00000 2.38000 68.00000 BOI1_1YCS-13_25.PDB 5.63478 -9.82000 -0.59000 -0.55000 -9.68000 -1.86000 8.90000 -12.55000 1.25000 4.33000 2.40000 0.00000 0.00000 0.00000 0.14000 0.68000 0.00000 -1.14000 0.00000 -0.47000 0.00000 2.38000 68.00000 BOI1_1YCS-13_26.PDB 5.03226 -7.87000 -0.59000 -0.57000 -9.75000 -1.50000 8.78000 -12.70000 1.92000 4.22000 3.01000 0.00000 0.00000 0.00000 0.28000 0.72000 0.00000 -0.66000 0.00000 -0.31000 0.00000 2.38000 68.00000 BOI1_1YCS-13_27.PDB 5.42527 -9.32000 -0.59000 -1.40000 -9.57000 -1.86000 8.89000 -12.35000 1.73000 4.19000 2.78000 0.00000 0.00000 0.00000 0.19000 0.72000 0.00000 -0.76000 0.00000 -0.56000 0.00000 2.38000 68.00000 BOI1_1YCS-13_28.PDB 5.98128 -9.79000 -0.56000 -3.05000 -9.61000 -2.07000 9.42000 -12.15000 1.88000 4.76000 3.06000 0.00000 0.00000 0.00000 0.29000 0.75000 0.00000 -1.13000 0.00000 -0.63000 0.00000 2.38000 68.00000 BOI1_1YCS-13_29.PDB 6.01084 -9.14000 -2.31000 -5.20000 -9.79000 -1.96000 11.25000 -11.56000 1.54000 6.89000 2.94000 0.00000 0.00000 0.00000 0.40000 0.73000 0.00000 -0.93000 0.00000 -0.40000 0.00000 2.38000 68.00000 BOI1_1YCS-13_30.PDB 5.64342 -8.59000 -0.57000 -0.54000 -9.82000 -1.84000 9.21000 -12.69000 1.79000 4.34000 2.99000 0.00000 0.00000 0.00000 0.16000 0.66000 0.00000 -1.19000 0.00000 -0.43000 0.00000 2.38000 68.00000