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-15_1.PDB 34.96000 -38.16000 -14.75000 -67.86000 -2.73000 87.46000 -85.06000 21.23000 35.40000 99.99000 0.00000 0.00000 0.00000 3.66000 17.95000 0.00000 -2.48000 0.00000 -1.74000 0.00000 0.00000 66.00000 SHO1_1QKX-15_2.PDB 34.53000 -38.49000 -13.68000 -67.07000 -2.35000 87.25000 -84.33000 21.20000 35.65000 99.15000 0.00000 0.00000 0.00000 2.59000 17.89000 0.00000 -3.36000 0.00000 -2.01000 0.00000 0.00000 66.00000 SHO1_1QKX-15_3.PDB 32.97000 -39.31000 -16.17000 -68.03000 -2.82000 88.65000 -85.15000 20.82000 37.60000 99.47000 0.00000 0.00000 0.00000 3.02000 17.88000 0.00000 -2.73000 0.00000 -2.38000 0.00000 0.00000 66.00000 SHO1_1QKX-15_4.PDB 30.72000 -38.42000 -15.46000 -68.10000 -2.29000 87.30000 -85.53000 19.59000 36.66000 99.27000 0.00000 0.00000 0.00000 3.42000 18.03000 0.00000 -3.43000 0.00000 -2.28000 0.00000 0.00000 66.00000 SHO1_1QKX-15_5.PDB 32.99000 -37.69000 -12.22000 -68.31000 -2.44000 87.79000 -85.69000 19.64000 35.40000 99.07000 0.00000 0.00000 0.00000 3.10000 18.02000 0.00000 -3.56000 0.00000 -2.09000 0.00000 0.00000 66.00000 SHO1_1QKX-15_6.PDB 35.02000 -38.55000 -13.89000 -67.97000 -2.46000 88.43000 -85.35000 20.97000 36.16000 99.80000 0.00000 0.00000 0.00000 2.50000 17.98000 0.00000 -2.80000 0.00000 -1.82000 0.00000 0.00000 66.00000 SHO1_1QKX-15_7.PDB 35.76000 -38.52000 -13.51000 -67.41000 -2.69000 87.96000 -84.51000 21.03000 35.77000 99.46000 0.00000 0.00000 0.00000 2.88000 18.08000 0.00000 -2.69000 0.00000 -1.98000 0.00000 0.00000 66.00000 SHO1_1QKX-15_8.PDB 33.67000 -39.32000 -15.59000 -68.96000 -2.68000 89.51000 -86.34000 21.59000 37.87000 99.79000 0.00000 0.00000 0.00000 3.27000 17.97000 0.00000 -3.15000 0.00000 -2.33000 0.00000 0.00000 66.00000 SHO1_1QKX-15_9.PDB 30.40000 -39.02000 -16.01000 -68.58000 -2.30000 87.87000 -86.21000 19.69000 37.53000 100.09000 0.00000 0.00000 0.00000 3.05000 18.12000 0.00000 -3.57000 0.00000 -2.15000 0.00000 0.00000 66.00000 SHO1_1QKX-15_10.PDB 32.61000 -39.28000 -16.04000 -67.82000 -2.68000 88.38000 -84.92000 20.77000 37.34000 99.65000 0.00000 0.00000 0.00000 3.07000 18.12000 0.00000 -3.56000 0.00000 -2.29000 0.00000 0.00000 66.00000 SHO1_1QKX-15_11.PDB 34.56000 -39.12000 -13.74000 -67.78000 -2.34000 87.97000 -85.30000 20.76000 36.53000 100.10000 0.00000 0.00000 0.00000 2.85000 18.09000 0.00000 -3.55000 0.00000 -1.81000 0.00000 0.00000 66.00000 SHO1_1QKX-15_12.PDB 32.82000 -39.07000 -14.43000 -68.57000 -2.30000 88.05000 -86.27000 21.25000 36.92000 99.56000 0.00000 0.00000 0.00000 2.61000 18.16000 0.00000 -3.28000 0.00000 -1.65000 0.00000 0.00000 66.00000 SHO1_1QKX-15_13.PDB 32.86000 -38.30000 -12.93000 -68.87000 -2.07000 86.85000 -87.09000 20.27000 35.90000 99.50000 0.00000 0.00000 0.00000 3.62000 18.14000 0.00000 -2.65000 0.00000 -1.36000 0.00000 0.00000 66.00000 SHO1_1QKX-15_14.PDB 34.98000 -38.23000 -13.35000 -67.03000 -2.32000 86.72000 -83.95000 20.11000 35.37000 99.72000 0.00000 0.00000 0.00000 2.87000 17.99000 0.00000 -2.95000 0.00000 -1.99000 0.00000 0.00000 66.00000 SHO1_1QKX-15_15.PDB 34.61000 -38.51000 -15.26000 -68.85000 -2.47000 89.97000 -85.83000 20.83000 37.44000 99.97000 0.00000 0.00000 0.00000 2.88000 18.33000 0.00000 -3.69000 0.00000 -1.86000 0.00000 0.00000 66.00000 SHO1_1QKX-15_16.PDB 35.05000 -37.93000 -13.26000 -67.57000 -2.53000 87.88000 -84.95000 21.21000 35.37000 99.06000 0.00000 0.00000 0.00000 2.66000 17.98000 0.00000 -2.97000 0.00000 -1.92000 0.00000 0.00000 66.00000 SHO1_1QKX-15_17.PDB 33.85000 -38.48000 -13.87000 -68.91000 -2.34000 88.65000 -87.01000 20.73000 36.81000 99.84000 0.00000 0.00000 0.00000 3.88000 18.30000 0.00000 -3.58000 0.00000 -1.86000 0.00000 0.00000 66.00000 SHO1_1QKX-15_18.PDB 32.25000 -39.83000 -16.84000 -68.48000 -2.50000 88.87000 -85.89000 20.77000 38.25000 100.48000 0.00000 0.00000 0.00000 2.71000 18.08000 0.00000 -3.16000 0.00000 -2.13000 0.00000 0.00000 66.00000 SHO1_1QKX-15_19.PDB 30.25000 -39.06000 -16.08000 -69.32000 -2.01000 87.92000 -87.23000 19.72000 37.63000 99.82000 0.00000 0.00000 0.00000 3.80000 18.16000 0.00000 -3.16000 0.00000 -1.77000 0.00000 0.00000 66.00000 SHO1_1QKX-15_20.PDB 31.28000 -39.27000 -16.30000 -68.80000 -2.37000 88.10000 -86.59000 22.21000 37.69000 99.47000 0.00000 0.00000 0.00000 2.29000 18.05000 0.00000 -3.28000 0.00000 -1.87000 0.00000 0.00000 66.00000 SHO1_1QKX-15_21.PDB 33.92000 -39.25000 -17.09000 -68.95000 -2.55000 89.93000 -86.09000 20.90000 38.81000 100.21000 0.00000 0.00000 0.00000 2.79000 18.19000 0.00000 -2.77000 0.00000 -2.02000 0.00000 0.00000 66.00000 SHO1_1QKX-15_22.PDB 33.33000 -39.90000 -16.80000 -68.09000 -2.87000 88.92000 -84.89000 20.83000 38.29000 100.37000 0.00000 0.00000 0.00000 2.73000 18.12000 0.00000 -2.88000 0.00000 -2.38000 0.00000 0.00000 66.00000 SHO1_1QKX-15_23.PDB 32.81000 -39.12000 -14.45000 -68.82000 -1.99000 87.75000 -86.94000 21.18000 36.99000 99.93000 0.00000 0.00000 0.00000 2.84000 18.01000 0.00000 -3.19000 0.00000 -1.38000 0.00000 0.00000 66.00000 SHO1_1QKX-15_24.PDB 33.93000 -37.64000 -13.00000 -68.15000 -2.59000 87.50000 -85.70000 20.32000 35.24000 99.42000 0.00000 0.00000 0.00000 3.33000 18.24000 0.00000 -2.87000 0.00000 -1.93000 0.00000 0.00000 66.00000 SHO1_1QKX-15_25.PDB 31.06000 -37.87000 -14.81000 -68.97000 -2.58000 88.35000 -86.81000 19.31000 36.81000 99.19000 0.00000 0.00000 0.00000 3.57000 18.23000 0.00000 -2.78000 0.00000 -2.35000 0.00000 0.00000 66.00000 SHO1_1QKX-15_26.PDB 35.53000 -38.97000 -13.53000 -68.13000 -2.46000 88.55000 -85.30000 20.81000 36.56000 100.31000 0.00000 0.00000 0.00000 3.07000 18.20000 0.00000 -3.46000 0.00000 -1.91000 0.00000 0.00000 66.00000 SHO1_1QKX-15_27.PDB 35.91000 -38.53000 -13.13000 -66.69000 -1.51000 86.49000 -84.05000 20.62000 35.24000 99.59000 0.00000 0.00000 0.00000 2.76000 18.01000 0.00000 -3.54000 0.00000 -1.36000 0.00000 0.00000 66.00000 SHO1_1QKX-15_28.PDB 33.59000 -39.20000 -15.43000 -68.66000 -2.54000 88.79000 -86.15000 20.93000 37.92000 99.78000 0.00000 0.00000 0.00000 3.09000 18.10000 0.00000 -2.73000 0.00000 -2.20000 0.00000 0.00000 66.00000 SHO1_1QKX-15_29.PDB 34.59000 -38.55000 -13.77000 -67.98000 -2.04000 87.07000 -85.78000 21.73000 35.83000 99.45000 0.00000 0.00000 0.00000 2.66000 18.20000 0.00000 -2.63000 0.00000 -1.39000 0.00000 0.00000 66.00000 SHO1_1QKX-15_30.PDB 32.93000 -38.55000 -13.92000 -68.80000 -1.98000 87.89000 -86.96000 21.06000 36.32000 99.82000 0.00000 0.00000 0.00000 2.71000 18.23000 0.00000 -3.35000 0.00000 -1.32000 0.00000 0.00000 66.00000