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 CYK3_1QCF-9_1.PDB 12.84000 -40.00000 -11.38000 -68.74000 -1.96000 83.77000 -88.16000 9.73000 33.36000 93.59000 0.00000 0.00000 0.00000 5.07000 20.94000 0.00000 -2.31000 0.00000 -0.14000 0.00000 0.00000 65.00000 CYK3_1QCF-9_2.PDB 11.58000 -40.02000 -11.39000 -68.38000 -2.50000 83.14000 -87.77000 9.03000 32.77000 93.37000 0.00000 0.00000 0.00000 5.76000 21.11000 0.00000 -2.26000 0.00000 -0.18000 0.00000 0.00000 65.00000 CYK3_1QCF-9_3.PDB 13.91000 -39.39000 -13.57000 -67.78000 -2.10000 84.20000 -86.28000 9.35000 33.85000 92.10000 0.00000 0.00000 0.00000 5.59000 20.68000 0.00000 -1.87000 0.00000 -0.19000 0.00000 0.00000 65.00000 CYK3_1QCF-9_4.PDB 15.26000 -39.42000 -13.97000 -68.77000 -2.08000 84.48000 -88.03000 10.94000 34.35000 93.27000 0.00000 0.00000 0.00000 6.66000 20.70000 0.00000 -1.97000 0.00000 -0.20000 0.00000 0.00000 65.00000 CYK3_1QCF-9_5.PDB 9.37000 -40.65000 -13.43000 -67.25000 -2.67000 82.85000 -85.98000 7.55000 33.99000 92.59000 0.00000 0.00000 0.00000 5.16000 20.87000 0.00000 -2.45000 0.00000 -0.34000 0.00000 0.00000 65.00000 CYK3_1QCF-9_6.PDB 10.57000 -39.46000 -14.10000 -69.67000 -2.12000 85.67000 -88.69000 6.87000 34.12000 94.19000 0.00000 0.00000 0.00000 6.11000 21.22000 0.00000 -2.11000 0.00000 -0.23000 0.00000 0.00000 65.00000 CYK3_1QCF-9_7.PDB 11.89000 -39.37000 -12.43000 -68.83000 -2.64000 84.29000 -88.11000 8.66000 33.49000 92.76000 0.00000 0.00000 0.00000 6.41000 20.83000 0.00000 -2.03000 0.00000 -0.31000 0.00000 0.00000 65.00000 CYK3_1QCF-9_8.PDB 11.02000 -39.38000 -13.61000 -70.36000 -2.15000 85.76000 -89.90000 8.06000 35.08000 93.59000 0.00000 0.00000 0.00000 6.22000 20.93000 0.00000 -2.07000 0.00000 -0.23000 0.00000 0.00000 65.00000 CYK3_1QCF-9_9.PDB 10.09000 -40.27000 -16.24000 -69.86000 -2.86000 86.50000 -88.36000 6.99000 36.44000 94.68000 0.00000 0.00000 0.00000 5.56000 21.11000 0.00000 -2.02000 0.00000 -0.47000 0.00000 0.00000 65.00000 CYK3_1QCF-9_10.PDB 13.66000 -39.43000 -13.60000 -68.60000 -2.11000 84.18000 -87.82000 10.57000 34.07000 92.04000 0.00000 0.00000 0.00000 6.48000 20.82000 0.00000 -1.93000 0.00000 -0.19000 0.00000 0.00000 65.00000 CYK3_1QCF-9_11.PDB 10.79000 -40.09000 -13.06000 -69.98000 -2.59000 85.20000 -89.35000 8.44000 34.70000 94.01000 0.00000 0.00000 0.00000 5.86000 21.10000 0.00000 -2.09000 0.00000 -0.26000 0.00000 0.00000 65.00000 CYK3_1QCF-9_12.PDB 12.33000 -39.43000 -12.43000 -69.97000 -1.89000 85.19000 -89.69000 8.07000 33.83000 94.62000 0.00000 0.00000 0.00000 6.19000 21.00000 0.00000 -2.08000 0.00000 -0.07000 0.00000 0.00000 65.00000 CYK3_1QCF-9_13.PDB 9.53000 -39.99000 -14.49000 -67.33000 -2.23000 83.73000 -85.77000 6.47000 33.69000 93.12000 0.00000 0.00000 0.00000 5.05000 20.96000 0.00000 -2.38000 0.00000 -0.33000 0.00000 0.00000 65.00000 CYK3_1QCF-9_14.PDB 10.01000 -40.08000 -14.30000 -69.07000 -2.73000 84.58000 -88.32000 8.50000 34.96000 92.40000 0.00000 0.00000 0.00000 6.58000 20.83000 0.00000 -2.14000 0.00000 -0.37000 0.00000 0.00000 65.00000 CYK3_1QCF-9_15.PDB 10.64000 -39.66000 -12.89000 -68.82000 -2.14000 84.38000 -88.27000 7.91000 33.05000 94.68000 0.00000 0.00000 0.00000 5.00000 21.23000 0.00000 -2.37000 0.00000 -0.24000 0.00000 0.00000 65.00000 CYK3_1QCF-9_16.PDB 11.45000 -39.45000 -13.56000 -70.14000 -2.68000 85.85000 -89.42000 7.43000 35.04000 94.49000 0.00000 0.00000 0.00000 6.16000 21.06000 0.00000 -1.98000 0.00000 -0.29000 0.00000 0.00000 65.00000 CYK3_1QCF-9_17.PDB 10.20000 -40.24000 -16.07000 -68.95000 -2.84000 86.04000 -87.05000 6.71000 35.64000 93.53000 0.00000 0.00000 0.00000 5.92000 20.96000 0.00000 -2.03000 0.00000 -0.45000 0.00000 0.00000 65.00000 CYK3_1QCF-9_18.PDB 12.74000 -39.94000 -12.58000 -68.49000 -2.05000 83.42000 -88.19000 10.84000 33.88000 93.31000 0.00000 0.00000 0.00000 4.98000 20.95000 0.00000 -2.26000 0.00000 -0.17000 0.00000 0.00000 65.00000 CYK3_1QCF-9_19.PDB 9.17000 -40.04000 -14.73000 -68.40000 -2.82000 84.38000 -87.43000 7.29000 34.58000 93.56000 0.00000 0.00000 0.00000 5.53000 21.08000 0.00000 -2.29000 0.00000 -0.46000 0.00000 0.00000 65.00000 CYK3_1QCF-9_20.PDB 13.93000 -39.40000 -13.57000 -69.24000 -2.13000 85.34000 -88.28000 9.50000 34.46000 93.60000 0.00000 0.00000 0.00000 5.83000 20.87000 0.00000 -1.97000 0.00000 -0.19000 0.00000 0.00000 65.00000 CYK3_1QCF-9_21.PDB 10.32000 -39.36000 -13.65000 -69.19000 -2.65000 84.26000 -88.84000 8.89000 34.65000 92.79000 0.00000 0.00000 0.00000 5.65000 20.96000 0.00000 -1.95000 0.00000 -0.29000 0.00000 0.00000 65.00000 CYK3_1QCF-9_22.PDB 9.77000 -40.08000 -13.11000 -68.67000 -2.14000 84.55000 -87.53000 6.43000 33.32000 94.08000 0.00000 0.00000 0.00000 5.58000 21.25000 0.00000 -2.39000 0.00000 -0.27000 0.00000 0.00000 65.00000 CYK3_1QCF-9_23.PDB 8.62000 -39.41000 -12.56000 -70.42000 -1.65000 84.56000 -90.75000 8.30000 34.14000 93.60000 0.00000 0.00000 0.00000 5.00000 21.01000 0.00000 -2.11000 0.00000 -0.10000 0.00000 0.00000 65.00000 CYK3_1QCF-9_24.PDB 13.81000 -39.42000 -12.38000 -68.96000 -1.95000 84.21000 -88.59000 9.25000 33.35000 94.23000 0.00000 0.00000 0.00000 6.11000 20.97000 0.00000 -1.93000 0.00000 -0.10000 0.00000 0.00000 65.00000 CYK3_1QCF-9_25.PDB 11.11000 -39.37000 -15.31000 -68.77000 -2.31000 85.19000 -87.56000 7.60000 34.50000 92.87000 0.00000 0.00000 0.00000 6.67000 21.00000 0.00000 -2.06000 0.00000 -0.34000 0.00000 0.00000 65.00000 CYK3_1QCF-9_26.PDB 11.05000 -39.39000 -13.45000 -68.24000 -2.67000 84.21000 -87.02000 7.17000 33.95000 93.22000 0.00000 0.00000 0.00000 5.45000 20.88000 0.00000 -1.90000 0.00000 -0.27000 0.00000 0.00000 65.00000 CYK3_1QCF-9_27.PDB 9.23000 -40.89000 -15.27000 -68.47000 -2.72000 84.80000 -86.94000 6.46000 35.33000 94.71000 0.00000 0.00000 0.00000 5.09000 21.09000 0.00000 -2.42000 0.00000 -0.45000 0.00000 0.00000 65.00000 CYK3_1QCF-9_28.PDB 9.22000 -40.09000 -13.14000 -70.06000 -2.22000 84.33000 -90.15000 8.30000 34.58000 94.07000 0.00000 0.00000 0.00000 5.99000 20.89000 0.00000 -2.15000 0.00000 -0.23000 0.00000 0.00000 65.00000 CYK3_1QCF-9_29.PDB 12.10000 -39.37000 -13.59000 -69.60000 -2.08000 85.27000 -88.87000 7.89000 34.77000 94.50000 0.00000 0.00000 0.00000 5.40000 20.95000 0.00000 -1.98000 0.00000 -0.23000 0.00000 0.00000 65.00000 CYK3_1QCF-9_30.PDB 10.87000 -39.90000 -11.45000 -68.94000 -2.45000 83.58000 -88.97000 8.73000 33.24000 94.26000 0.00000 0.00000 0.00000 5.01000 21.17000 0.00000 -2.04000 0.00000 -0.19000 0.00000 0.00000 65.00000