name total energy Backbone Hbon 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 BEM1-D1_JO8-LCK-27_1.PDB 27.26000 -42.75000 -13.85000 -68.52000 -2.68000 88.89000 -85.16000 19.94000 33.11000 91.06000 0.00000 0.00000 0.00000 9.61000 16.84000 0.00000 -1.85000 0.00000 -0.55000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_2.PDB 26.03000 -42.81000 -13.87000 -68.13000 -2.47000 87.93000 -84.74000 19.72000 32.45000 90.76000 0.00000 0.00000 0.00000 9.93000 16.71000 0.00000 -2.31000 0.00000 -0.43000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_3.PDB 26.30000 -42.90000 -13.94000 -68.59000 -2.73000 88.45000 -85.24000 19.13000 33.61000 90.68000 0.00000 0.00000 0.00000 10.11000 16.90000 0.00000 -1.73000 0.00000 -0.55000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_4.PDB 26.18000 -42.95000 -14.11000 -68.63000 -2.74000 88.47000 -85.21000 18.63000 33.10000 90.73000 0.00000 0.00000 0.00000 11.04000 16.94000 0.00000 -1.71000 0.00000 -0.45000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_5.PDB 26.65000 -42.23000 -12.47000 -68.31000 -2.10000 88.80000 -84.65000 18.80000 31.15000 90.08000 0.00000 0.00000 0.00000 10.31000 16.70000 0.00000 -2.18000 0.00000 -0.56000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_6.PDB 26.15000 -42.67000 -13.82000 -68.53000 -2.61000 88.29000 -85.36000 19.28000 33.11000 90.84000 0.00000 0.00000 0.00000 10.03000 16.79000 0.00000 -1.93000 0.00000 -0.47000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_7.PDB 29.12000 -41.68000 -12.82000 -68.37000 -2.33000 87.52000 -85.12000 22.02000 31.77000 90.02000 0.00000 0.00000 0.00000 10.39000 16.86000 0.00000 -1.67000 0.00000 -0.61000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_8.PDB 26.09000 -42.14000 -14.85000 -68.22000 -2.58000 87.47000 -84.79000 19.10000 33.11000 90.74000 0.00000 0.00000 0.00000 10.56000 16.80000 0.00000 -1.80000 0.00000 -0.50000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_9.PDB 25.45000 -41.97000 -13.02000 -68.10000 -2.59000 87.53000 -84.69000 19.20000 31.94000 89.81000 0.00000 0.00000 0.00000 9.82000 16.80000 0.00000 -1.97000 0.00000 -0.51000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_10.PDB 26.59000 -43.26000 -12.81000 -68.20000 -2.78000 88.21000 -84.73000 18.62000 32.70000 91.24000 0.00000 0.00000 0.00000 10.17000 16.72000 0.00000 -1.91000 0.00000 -0.66000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_11.PDB 28.13000 -43.01000 -13.67000 -68.59000 -2.90000 89.04000 -85.24000 19.27000 33.34000 91.24000 0.00000 0.00000 0.00000 11.14000 16.82000 0.00000 -1.90000 0.00000 -0.60000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_12.PDB 27.10000 -44.76000 -14.14000 -68.86000 -2.66000 90.19000 -85.45000 19.20000 34.20000 91.25000 0.00000 0.00000 0.00000 10.61000 16.79000 0.00000 -2.10000 0.00000 -0.38000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_13.PDB 26.46000 -43.24000 -13.51000 -68.73000 -1.96000 89.36000 -85.27000 19.42000 31.91000 90.94000 0.00000 0.00000 0.00000 10.18000 16.85000 0.00000 -2.24000 0.00000 -0.41000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_14.PDB 27.73000 -41.66000 -12.88000 -68.16000 -2.07000 86.94000 -85.32000 19.87000 33.46000 90.98000 0.00000 0.00000 0.00000 9.08000 16.52000 0.00000 -1.87000 0.00000 -0.66000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_15.PDB 32.61000 -42.58000 -11.83000 -69.36000 -3.12000 89.55000 -86.06000 21.55000 33.67000 91.55000 0.00000 0.00000 0.00000 11.90000 17.10000 0.00000 -2.06000 0.00000 -0.60000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_16.PDB 29.51000 -41.84000 -13.50000 -68.51000 -2.40000 88.51000 -85.63000 21.86000 33.83000 90.86000 0.00000 0.00000 0.00000 9.32000 16.82000 0.00000 -2.44000 0.00000 -0.55000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_17.PDB 26.67000 -42.39000 -11.83000 -68.55000 -2.79000 88.16000 -85.17000 19.30000 32.45000 90.46000 0.00000 0.00000 0.00000 9.75000 16.80000 0.00000 -1.90000 0.00000 -0.82000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_18.PDB 26.62000 -44.19000 -13.93000 -69.09000 -3.22000 89.75000 -85.46000 19.22000 34.20000 91.64000 0.00000 0.00000 0.00000 10.05000 16.95000 0.00000 -1.67000 0.00000 -0.68000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_19.PDB 29.48000 -42.87000 -13.92000 -69.00000 -2.62000 88.76000 -85.74000 20.12000 33.78000 90.74000 0.00000 0.00000 0.00000 12.61000 17.02000 0.00000 -1.96000 0.00000 -0.42000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_20.PDB 25.79000 -42.98000 -14.05000 -68.30000 -2.75000 88.26000 -84.80000 19.32000 33.02000 90.66000 0.00000 0.00000 0.00000 9.92000 16.83000 0.00000 -2.07000 0.00000 -0.43000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_21.PDB 27.81000 -42.02000 -13.23000 -68.66000 -2.77000 88.23000 -85.65000 20.05000 34.28000 90.77000 0.00000 0.00000 0.00000 9.31000 16.73000 0.00000 -1.85000 0.00000 -0.64000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_22.PDB 28.16000 -41.76000 -12.70000 -68.46000 -2.34000 87.55000 -85.13000 19.31000 32.01000 89.96000 0.00000 0.00000 0.00000 12.08000 16.83000 0.00000 -1.90000 0.00000 -0.45000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_23.PDB 27.64000 -43.29000 -13.12000 -68.61000 -2.69000 87.87000 -85.71000 20.14000 34.71000 91.52000 0.00000 0.00000 0.00000 9.64000 16.68000 0.00000 -2.10000 0.00000 -0.72000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_24.PDB 29.07000 -41.11000 -12.19000 -68.41000 -2.18000 86.34000 -85.64000 21.03000 32.73000 90.13000 0.00000 0.00000 0.00000 11.00000 16.49000 0.00000 -1.84000 0.00000 -0.79000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_25.PDB 27.41000 -43.34000 -12.60000 -69.14000 -2.70000 90.03000 -85.59000 19.30000 32.91000 91.24000 0.00000 0.00000 0.00000 10.30000 16.80000 0.00000 -2.19000 0.00000 -0.82000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_26.PDB 26.68000 -43.22000 -11.77000 -69.07000 -1.96000 89.32000 -85.61000 19.21000 31.74000 90.49000 0.00000 0.00000 0.00000 10.29000 16.83000 0.00000 -2.03000 0.00000 -0.70000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_27.PDB 27.69000 -42.97000 -12.58000 -67.91000 -2.54000 87.46000 -84.35000 19.01000 32.78000 90.75000 0.00000 0.00000 0.00000 10.44000 16.70000 0.00000 -1.91000 0.00000 -0.49000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_28.PDB 28.87000 -41.59000 -12.67000 -68.69000 -2.47000 87.91000 -85.46000 20.03000 32.18000 90.11000 0.00000 0.00000 0.00000 11.77000 16.90000 0.00000 -1.80000 0.00000 -0.45000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_29.PDB 29.67000 -43.50000 -12.70000 -69.15000 -2.97000 89.46000 -85.76000 19.73000 33.38000 91.09000 0.00000 0.00000 0.00000 12.64000 17.01000 0.00000 -1.98000 0.00000 -0.57000 0.00000 0.00000 65.00000 BEM1-D1_JO8-LCK-27_30.PDB 28.45000 -42.47000 -13.54000 -68.74000 -2.54000 88.25000 -85.56000 19.91000 33.11000 90.78000 0.00000 0.00000 0.00000 11.59000 16.94000 0.00000 -1.98000 0.00000 -0.38000 0.00000 0.00000 65.00000