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 SHO1_1QKX-7_1.PDB 27.23000 -38.76000 -13.61000 -68.01000 -2.57000 84.21000 -86.27000 20.75000 37.57000 96.51000 0.00000 0.00000 0.00000 2.36000 15.35000 0.00000 -3.30000 0.00000 -1.65000 0.00000 0.00000 65.00000 SHO1_1QKX-7_2.PDB 26.47000 -39.40000 -15.57000 -68.49000 -1.63000 84.89000 -86.83000 20.88000 38.85000 96.55000 0.00000 0.00000 0.00000 2.33000 15.38000 0.00000 -3.51000 0.00000 -1.58000 0.00000 0.00000 65.00000 SHO1_1QKX-7_3.PDB 25.96000 -39.89000 -14.72000 -68.94000 -2.17000 84.98000 -87.39000 21.98000 37.97000 96.07000 0.00000 0.00000 0.00000 2.32000 15.54000 0.00000 -3.11000 0.00000 -1.13000 0.00000 0.00000 65.00000 SHO1_1QKX-7_4.PDB 25.65000 -39.55000 -14.18000 -69.30000 -0.90000 85.19000 -88.06000 22.02000 36.99000 95.60000 0.00000 0.00000 0.00000 2.22000 15.54000 0.00000 -3.30000 0.00000 -1.08000 0.00000 0.00000 65.00000 SHO1_1QKX-7_5.PDB 26.50000 -38.24000 -13.58000 -69.14000 -2.68000 84.99000 -87.65000 20.54000 37.83000 96.89000 0.00000 0.00000 0.00000 2.67000 15.40000 0.00000 -3.46000 0.00000 -1.67000 0.00000 0.00000 65.00000 SHO1_1QKX-7_6.PDB 28.14000 -41.45000 -16.70000 -68.71000 -1.33000 87.73000 -86.48000 22.17000 38.04000 96.71000 0.00000 0.00000 0.00000 2.39000 15.74000 0.00000 -3.18000 0.00000 -1.06000 0.00000 0.00000 65.00000 SHO1_1QKX-7_7.PDB 27.57000 -38.98000 -14.90000 -68.10000 -1.47000 84.48000 -86.11000 20.15000 38.04000 96.66000 0.00000 0.00000 0.00000 2.55000 15.40000 0.00000 -3.26000 0.00000 -1.49000 0.00000 0.00000 65.00000 SHO1_1QKX-7_8.PDB 26.05000 -39.15000 -14.32000 -68.71000 -2.29000 84.98000 -86.79000 21.13000 37.57000 95.99000 0.00000 0.00000 0.00000 2.20000 15.55000 0.00000 -3.12000 0.00000 -1.45000 0.00000 0.00000 65.00000 SHO1_1QKX-7_9.PDB 25.04000 -39.43000 -14.51000 -69.02000 -2.13000 85.20000 -87.51000 21.49000 37.58000 95.82000 0.00000 0.00000 0.00000 2.21000 15.54000 0.00000 -3.26000 0.00000 -1.39000 0.00000 0.00000 65.00000 SHO1_1QKX-7_10.PDB 27.66000 -40.80000 -15.98000 -69.07000 -1.03000 87.77000 -87.03000 21.22000 37.34000 96.28000 0.00000 0.00000 0.00000 3.12000 15.70000 0.00000 -3.26000 0.00000 -0.89000 0.00000 0.00000 65.00000 SHO1_1QKX-7_11.PDB 26.12000 -39.41000 -14.88000 -68.24000 -1.03000 84.02000 -86.82000 21.38000 37.41000 95.85000 0.00000 0.00000 0.00000 2.18000 15.53000 0.00000 -3.17000 0.00000 -1.17000 0.00000 0.00000 65.00000 SHO1_1QKX-7_12.PDB 24.42000 -37.99000 -13.31000 -67.47000 -1.48000 82.59000 -85.98000 19.79000 35.92000 95.21000 0.00000 0.00000 0.00000 2.15000 15.11000 0.00000 -3.29000 0.00000 -1.72000 0.00000 0.00000 65.00000 SHO1_1QKX-7_13.PDB 25.85000 -39.78000 -14.96000 -68.24000 -1.08000 83.96000 -86.88000 22.28000 36.86000 95.68000 0.00000 0.00000 0.00000 2.31000 15.52000 0.00000 -3.23000 0.00000 -1.08000 0.00000 0.00000 65.00000 SHO1_1QKX-7_14.PDB 28.23000 -39.05000 -13.72000 -68.62000 -2.50000 85.93000 -86.56000 20.70000 37.80000 96.48000 0.00000 0.00000 0.00000 2.51000 15.40000 0.00000 -3.22000 0.00000 -1.53000 0.00000 0.00000 65.00000 SHO1_1QKX-7_15.PDB 27.04000 -39.02000 -15.18000 -68.53000 -3.40000 85.75000 -86.34000 20.77000 38.69000 97.90000 0.00000 0.00000 0.00000 2.37000 15.37000 0.00000 -3.76000 0.00000 -2.20000 0.00000 0.00000 65.00000 SHO1_1QKX-7_16.PDB 27.76000 -39.42000 -14.67000 -68.47000 -2.58000 85.71000 -86.15000 20.52000 38.28000 97.09000 0.00000 0.00000 0.00000 2.51000 15.40000 0.00000 -3.26000 0.00000 -1.81000 0.00000 0.00000 65.00000 SHO1_1QKX-7_17.PDB 25.74000 -39.11000 -13.82000 -67.92000 -1.53000 83.89000 -86.43000 21.06000 37.06000 95.28000 0.00000 0.00000 0.00000 2.02000 15.35000 0.00000 -3.46000 0.00000 -1.31000 0.00000 0.00000 65.00000 SHO1_1QKX-7_18.PDB 24.50000 -38.78000 -13.70000 -68.38000 -1.90000 83.95000 -87.04000 21.37000 36.59000 94.54000 0.00000 0.00000 0.00000 2.03000 15.49000 0.00000 -3.30000 0.00000 -0.88000 0.00000 0.00000 65.00000 SHO1_1QKX-7_19.PDB 27.74000 -40.51000 -15.32000 -69.38000 -2.40000 88.10000 -87.31000 22.23000 38.21000 96.51000 0.00000 0.00000 0.00000 2.38000 15.75000 0.00000 -3.31000 0.00000 -1.45000 0.00000 0.00000 65.00000 SHO1_1QKX-7_20.PDB 24.13000 -39.16000 -14.45000 -68.16000 -2.19000 83.71000 -86.83000 21.10000 36.87000 95.74000 0.00000 0.00000 0.00000 2.12000 15.48000 0.00000 -3.39000 0.00000 -1.24000 0.00000 0.00000 65.00000 SHO1_1QKX-7_21.PDB 28.98000 -38.55000 -14.79000 -68.46000 -3.23000 85.79000 -86.12000 22.21000 38.30000 96.68000 0.00000 0.00000 0.00000 2.54000 15.37000 0.00000 -3.40000 0.00000 -1.98000 0.00000 0.00000 65.00000 SHO1_1QKX-7_22.PDB 29.32000 -40.16000 -14.59000 -69.03000 -3.27000 87.01000 -86.82000 22.71000 38.45000 98.14000 0.00000 0.00000 0.00000 2.29000 15.52000 0.00000 -3.48000 0.00000 -1.94000 0.00000 0.00000 65.00000 SHO1_1QKX-7_23.PDB 27.93000 -39.60000 -14.24000 -69.10000 -1.99000 85.54000 -87.40000 21.72000 37.51000 97.23000 0.00000 0.00000 0.00000 2.51000 15.56000 0.00000 -3.13000 0.00000 -1.12000 0.00000 0.00000 65.00000 SHO1_1QKX-7_24.PDB 27.59000 -38.77000 -14.05000 -68.38000 -2.62000 84.93000 -86.41000 21.76000 36.96000 95.85000 0.00000 0.00000 0.00000 2.51000 15.54000 0.00000 -2.90000 0.00000 -1.31000 0.00000 0.00000 65.00000 SHO1_1QKX-7_25.PDB 24.79000 -39.04000 -13.77000 -67.74000 -1.08000 83.29000 -86.49000 21.19000 36.06000 94.43000 0.00000 0.00000 0.00000 1.98000 15.49000 0.00000 -3.12000 0.00000 -0.92000 0.00000 0.00000 65.00000 SHO1_1QKX-7_26.PDB 26.36000 -38.91000 -14.11000 -68.03000 -0.87000 83.88000 -86.51000 21.39000 36.09000 95.47000 0.00000 0.00000 0.00000 2.39000 15.46000 0.00000 -3.55000 0.00000 -0.87000 0.00000 0.00000 65.00000 SHO1_1QKX-7_27.PDB 27.15000 -41.42000 -16.09000 -68.75000 -1.06000 87.50000 -86.80000 21.56000 37.26000 96.57000 0.00000 0.00000 0.00000 2.50000 15.68000 0.00000 -3.13000 0.00000 -0.97000 0.00000 0.00000 65.00000 SHO1_1QKX-7_28.PDB 28.31000 -41.06000 -15.89000 -69.28000 -2.44000 89.11000 -86.45000 21.50000 38.74000 96.51000 0.00000 0.00000 0.00000 2.47000 15.69000 0.00000 -3.17000 0.00000 -1.72000 0.00000 0.00000 65.00000 SHO1_1QKX-7_29.PDB 27.54000 -38.27000 -13.37000 -67.94000 -2.31000 84.49000 -85.92000 20.26000 36.88000 95.80000 0.00000 0.00000 0.00000 2.18000 15.36000 0.00000 -2.93000 0.00000 -1.33000 0.00000 0.00000 65.00000 SHO1_1QKX-7_30.PDB 26.86000 -39.93000 -14.69000 -69.34000 -0.83000 85.12000 -88.13000 22.50000 37.41000 96.35000 0.00000 0.00000 0.00000 2.39000 15.71000 0.00000 -3.29000 0.00000 -0.70000 0.00000 0.00000 65.00000