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 1SEM2_1.PDB -2.43000 -46.38000 -17.56000 -71.48000 -1.80000 89.99000 -90.12000 8.24000 37.89000 90.39000 0.00000 0.00000 0.00000 1.79000 21.89000 0.00000 -2.87000 0.00000 -0.52000 0.00000 0.00000 65.00000 1SEM2_2.PDB -3.15000 -45.13000 -16.28000 -70.32000 -1.85000 88.14000 -89.20000 7.05000 36.25000 89.97000 0.00000 0.00000 0.00000 1.81000 21.67000 0.00000 -3.10000 0.00000 -0.49000 0.00000 0.00000 65.00000 1SEM2_3.PDB -3.25000 -45.64000 -16.71000 -70.39000 -2.48000 89.12000 -89.21000 7.46000 35.73000 90.67000 0.00000 0.00000 0.00000 1.77000 21.56000 0.00000 -2.77000 0.00000 -0.81000 0.00000 0.00000 65.00000 1SEM2_4.PDB -4.81000 -45.59000 -16.76000 -70.60000 -1.91000 88.60000 -89.45000 7.00000 36.54000 88.45000 0.00000 0.00000 0.00000 2.26000 21.69000 0.00000 -2.83000 0.00000 -0.52000 0.00000 0.00000 65.00000 1SEM2_5.PDB -5.76000 -45.37000 -16.52000 -71.43000 -1.81000 89.46000 -90.38000 6.96000 36.76000 88.14000 0.00000 0.00000 0.00000 1.94000 22.02000 0.00000 -3.02000 0.00000 -0.49000 0.00000 0.00000 65.00000 1SEM2_6.PDB -5.68000 -46.27000 -17.45000 -71.20000 -1.76000 89.24000 -89.93000 7.07000 37.71000 88.34000 0.00000 0.00000 0.00000 2.14000 21.88000 0.00000 -3.03000 0.00000 -0.54000 0.00000 0.00000 65.00000 1SEM2_7.PDB -4.96000 -45.60000 -16.79000 -70.77000 -1.76000 89.07000 -89.48000 7.17000 36.65000 88.13000 0.00000 0.00000 0.00000 1.89000 21.90000 0.00000 -3.00000 0.00000 -0.46000 0.00000 0.00000 65.00000 1SEM2_8.PDB -6.94000 -45.49000 -16.67000 -70.54000 -1.79000 88.35000 -89.55000 7.38000 36.65000 86.56000 0.00000 0.00000 0.00000 1.66000 21.85000 0.00000 -3.06000 0.00000 -0.44000 0.00000 0.00000 65.00000 1SEM2_9.PDB -2.72000 -44.86000 -18.47000 -71.64000 -2.93000 91.02000 -90.25000 7.35000 37.76000 91.15000 0.00000 0.00000 0.00000 2.04000 21.78000 0.00000 -2.80000 0.00000 -1.10000 0.00000 0.00000 65.00000 1SEM2_10.PDB -2.50000 -44.70000 -15.86000 -69.71000 -2.01000 87.24000 -88.73000 7.00000 35.70000 89.71000 0.00000 0.00000 0.00000 2.15000 21.64000 0.00000 -2.67000 0.00000 -0.62000 0.00000 0.00000 65.00000 1SEM2_11.PDB -2.87000 -45.60000 -16.75000 -71.29000 -1.81000 89.47000 -90.28000 7.37000 36.93000 90.28000 0.00000 0.00000 0.00000 2.06000 21.97000 0.00000 -2.80000 0.00000 -0.46000 0.00000 0.00000 65.00000 1SEM2_12.PDB -2.84000 -44.78000 -15.94000 -70.36000 -1.90000 88.31000 -89.29000 7.27000 35.69000 89.89000 0.00000 0.00000 0.00000 1.92000 21.64000 0.00000 -3.06000 0.00000 -0.58000 0.00000 0.00000 65.00000 1SEM2_13.PDB -3.68000 -44.53000 -15.67000 -70.88000 -1.93000 88.40000 -90.24000 7.22000 35.84000 89.90000 0.00000 0.00000 0.00000 1.62000 21.61000 0.00000 -3.01000 0.00000 -0.39000 0.00000 0.00000 65.00000 1SEM2_14.PDB -3.78000 -45.60000 -17.77000 -71.34000 -2.84000 90.03000 -90.21000 7.28000 37.54000 91.04000 0.00000 0.00000 0.00000 1.65000 21.67000 0.00000 -2.71000 0.00000 -0.85000 0.00000 0.00000 65.00000 1SEM2_15.PDB -3.91000 -44.57000 -15.71000 -69.70000 -2.05000 87.38000 -88.59000 7.33000 35.50000 88.17000 0.00000 0.00000 0.00000 2.03000 21.51000 0.00000 -3.07000 0.00000 -0.62000 0.00000 0.00000 65.00000 1SEM2_16.PDB -2.95000 -45.43000 -16.59000 -70.25000 -1.90000 88.38000 -89.30000 7.41000 35.76000 90.67000 0.00000 0.00000 0.00000 1.84000 21.65000 0.00000 -2.99000 0.00000 -0.55000 0.00000 0.00000 65.00000 1SEM2_17.PDB -2.46000 -44.56000 -15.71000 -70.71000 -1.97000 88.34000 -89.80000 7.43000 35.73000 89.86000 0.00000 0.00000 0.00000 2.14000 21.51000 0.00000 -2.78000 0.00000 -0.43000 0.00000 0.00000 65.00000 1SEM2_18.PDB -2.47000 -45.26000 -16.39000 -70.42000 -1.79000 88.64000 -89.06000 7.36000 36.27000 90.01000 0.00000 0.00000 0.00000 1.86000 21.49000 0.00000 -3.15000 0.00000 -0.54000 0.00000 0.00000 65.00000 1SEM2_19.PDB -4.21000 -45.33000 -16.45000 -70.74000 -1.89000 88.48000 -89.74000 7.35000 36.78000 88.62000 0.00000 0.00000 0.00000 1.80000 21.55000 0.00000 -2.76000 0.00000 -0.33000 0.00000 0.00000 65.00000 1SEM2_20.PDB -5.08000 -46.22000 -17.38000 -71.37000 -1.76000 89.74000 -90.01000 7.43000 37.49000 88.85000 0.00000 0.00000 0.00000 1.88000 21.82000 0.00000 -3.18000 0.00000 -0.54000 0.00000 0.00000 65.00000 1SEM2_21.PDB -5.67000 -46.10000 -17.20000 -71.62000 -1.82000 90.08000 -90.75000 7.23000 37.05000 89.22000 0.00000 0.00000 0.00000 1.51000 21.98000 0.00000 -2.92000 0.00000 -0.33000 0.00000 0.00000 65.00000 1SEM2_22.PDB -4.45000 -45.40000 -16.60000 -71.01000 -1.85000 88.69000 -90.09000 8.26000 36.89000 88.15000 0.00000 0.00000 0.00000 1.60000 21.80000 0.00000 -2.78000 0.00000 -0.30000 0.00000 0.00000 65.00000 1SEM2_23.PDB -5.22000 -45.49000 -16.67000 -71.32000 -1.95000 89.31000 -90.26000 7.26000 36.90000 88.24000 0.00000 0.00000 0.00000 2.02000 21.88000 0.00000 -2.92000 0.00000 -0.35000 0.00000 0.00000 65.00000 1SEM2_24.PDB -6.12000 -45.46000 -16.61000 -71.27000 -1.86000 88.94000 -90.36000 8.07000 36.97000 86.63000 0.00000 0.00000 0.00000 1.83000 21.88000 0.00000 -2.66000 0.00000 -0.33000 0.00000 0.00000 65.00000 1SEM2_25.PDB -2.68000 -44.66000 -15.77000 -70.87000 -2.02000 88.63000 -90.13000 7.27000 36.14000 90.21000 0.00000 0.00000 0.00000 1.97000 21.71000 0.00000 -2.97000 0.00000 -0.48000 0.00000 0.00000 65.00000 1SEM2_26.PDB -3.50000 -45.91000 -17.03000 -70.91000 -2.50000 89.43000 -89.99000 7.59000 36.67000 90.93000 0.00000 0.00000 0.00000 1.90000 21.67000 0.00000 -2.84000 0.00000 -0.83000 0.00000 0.00000 65.00000 1SEM2_27.PDB -3.05000 -44.70000 -15.82000 -70.50000 -2.01000 88.15000 -89.65000 7.23000 35.84000 90.03000 0.00000 0.00000 0.00000 1.86000 21.55000 0.00000 -3.00000 0.00000 -0.47000 0.00000 0.00000 65.00000 1SEM2_28.PDB -2.80000 -44.62000 -15.81000 -71.46000 -1.62000 88.43000 -91.13000 7.17000 37.00000 90.07000 0.00000 0.00000 0.00000 1.79000 21.92000 0.00000 -2.49000 0.00000 -0.13000 0.00000 0.00000 65.00000 1SEM2_29.PDB -1.67000 -43.12000 -14.25000 -69.55000 -1.60000 85.76000 -89.34000 6.98000 34.73000 89.26000 0.00000 0.00000 0.00000 1.74000 21.47000 0.00000 -2.19000 0.00000 -0.10000 0.00000 0.00000 65.00000 1SEM2_30.PDB -2.94000 -46.33000 -17.44000 -71.66000 -1.88000 90.22000 -90.84000 8.14000 37.09000 91.36000 0.00000 0.00000 0.00000 1.67000 22.05000 0.00000 -2.92000 0.00000 -0.35000 0.00000 0.00000 65.00000