name Intraclash total energy Backbone Hbond 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-20_1.PDB 5.30300 -7.34000 -1.92000 -1.77000 -10.06000 -0.08000 9.07000 -13.05000 2.62000 4.88000 3.63000 0.00000 0.00000 0.00000 0.11000 0.46000 0.00000 -0.61000 0.00000 -0.17000 0.00000 2.38000 66.00000 CYK3_1QCF-20_2.PDB 5.44867 -8.64000 -1.85000 -1.75000 -10.00000 -0.09000 8.85000 -12.97000 1.84000 4.88000 3.15000 0.00000 0.00000 0.00000 0.08000 0.45000 0.00000 -0.62000 0.00000 -0.16000 0.00000 2.38000 66.00000 CYK3_1QCF-20_3.PDB 5.21235 -8.34000 -1.82000 -1.75000 -9.79000 -0.14000 8.76000 -12.83000 2.11000 4.73000 3.19000 0.00000 0.00000 0.00000 0.07000 0.47000 0.00000 -0.68000 0.00000 -0.20000 0.00000 2.38000 66.00000 CYK3_1QCF-20_4.PDB 5.35749 -9.11000 -1.81000 -1.75000 -9.75000 -0.13000 8.58000 -12.79000 1.78000 4.70000 2.97000 0.00000 0.00000 0.00000 0.08000 0.50000 0.00000 -0.82000 0.00000 -0.18000 0.00000 2.38000 66.00000 CYK3_1QCF-20_5.PDB 5.44190 -8.64000 -1.85000 -1.75000 -9.90000 -0.11000 8.94000 -12.81000 1.45000 4.89000 3.27000 0.00000 0.00000 0.00000 0.08000 0.46000 0.00000 -0.70000 0.00000 -0.18000 0.00000 2.38000 66.00000 CYK3_1QCF-20_6.PDB 5.42106 -10.56000 -1.87000 -3.50000 -10.02000 -0.20000 9.15000 -12.92000 1.83000 4.55000 3.15000 0.00000 0.00000 0.00000 0.25000 0.49000 0.00000 -0.79000 0.00000 -0.21000 0.00000 2.38000 66.00000 CYK3_1QCF-20_7.PDB 5.54182 -10.12000 -1.87000 -3.49000 -10.08000 -0.22000 9.31000 -13.00000 2.06000 4.54000 3.37000 0.00000 0.00000 0.00000 0.25000 0.49000 0.00000 -0.80000 0.00000 -0.20000 0.00000 2.38000 66.00000 CYK3_1QCF-20_8.PDB 5.13486 -8.20000 -1.81000 -1.76000 -9.78000 -0.12000 8.68000 -12.84000 2.48000 4.70000 3.10000 0.00000 0.00000 0.00000 0.07000 0.48000 0.00000 -0.75000 0.00000 -0.18000 0.00000 2.38000 66.00000 CYK3_1QCF-20_9.PDB 5.23887 -8.56000 -2.46000 -2.41000 -9.41000 -0.28000 8.73000 -12.07000 1.71000 5.47000 3.31000 0.00000 0.00000 0.00000 0.07000 0.43000 0.00000 -0.83000 0.00000 -0.38000 0.00000 2.38000 66.00000 CYK3_1QCF-20_10.PDB 5.28630 -8.13000 -1.81000 -1.75000 -9.31000 -0.28000 8.41000 -12.05000 2.18000 4.71000 2.74000 0.00000 0.00000 0.00000 0.08000 0.45000 0.00000 -0.70000 0.00000 -0.36000 0.00000 2.38000 66.00000 CYK3_1QCF-20_11.PDB 5.49876 -10.81000 -1.84000 -3.45000 -9.87000 -0.27000 8.92000 -12.88000 1.84000 4.39000 3.02000 0.00000 0.00000 0.00000 0.28000 0.52000 0.00000 -0.71000 0.00000 -0.25000 0.00000 2.38000 66.00000 CYK3_1QCF-20_12.PDB 5.84156 -10.09000 -1.83000 -3.48000 -9.91000 -0.23000 9.14000 -12.92000 1.95000 4.40000 3.45000 0.00000 0.00000 0.00000 0.24000 0.52000 0.00000 -0.70000 0.00000 -0.20000 0.00000 2.38000 66.00000 CYK3_1QCF-20_13.PDB 5.04279 -9.94000 -1.84000 -3.43000 -10.14000 -0.15000 9.29000 -12.91000 1.57000 5.36000 3.14000 0.00000 0.00000 0.00000 0.16000 0.48000 0.00000 -0.81000 0.00000 -0.18000 0.00000 2.38000 66.00000 CYK3_1QCF-20_14.PDB 5.25688 -9.49000 -1.85000 -3.45000 -10.11000 -0.16000 9.27000 -12.90000 1.85000 5.40000 3.31000 0.00000 0.00000 0.00000 0.17000 0.47000 0.00000 -0.83000 0.00000 -0.18000 0.00000 2.38000 66.00000 CYK3_1QCF-20_15.PDB 5.13587 -9.18000 -1.86000 -3.22000 -10.43000 -0.19000 9.32000 -13.50000 2.95000 5.18000 3.20000 0.00000 0.00000 0.00000 0.21000 0.59000 0.00000 -0.65000 0.00000 -0.18000 0.00000 2.38000 66.00000 CYK3_1QCF-20_16.PDB 4.83630 -9.07000 -1.86000 -3.40000 -10.43000 -0.19000 9.38000 -13.54000 3.01000 5.29000 3.37000 0.00000 0.00000 0.00000 0.18000 0.57000 0.00000 -0.67000 0.00000 -0.20000 0.00000 2.38000 66.00000 CYK3_1QCF-20_17.PDB 5.03723 -8.15000 -1.86000 -1.74000 -9.37000 -0.10000 8.26000 -12.25000 1.97000 3.53000 4.40000 0.00000 0.00000 0.00000 0.15000 0.49000 0.00000 -0.95000 0.00000 -0.20000 0.00000 2.38000 66.00000 CYK3_1QCF-20_18.PDB 4.97370 -8.42000 -1.84000 -1.73000 -9.61000 -0.13000 8.70000 -12.42000 2.30000 4.07000 3.19000 0.00000 0.00000 0.00000 0.15000 0.47000 0.00000 -0.87000 0.00000 -0.23000 0.00000 2.38000 66.00000 CYK3_1QCF-20_19.PDB 5.20587 -8.29000 -1.81000 -1.73000 -8.64000 -0.10000 7.15000 -11.54000 2.32000 4.17000 2.40000 0.00000 0.00000 0.00000 0.06000 0.43000 0.00000 -0.38000 0.00000 -0.19000 0.00000 2.38000 66.00000 CYK3_1QCF-20_20.PDB 6.01619 -10.53000 -1.87000 -3.47000 -9.98000 -0.21000 9.20000 -12.85000 1.47000 4.53000 3.29000 0.00000 0.00000 0.00000 0.22000 0.48000 0.00000 -0.66000 0.00000 -0.20000 0.00000 2.38000 66.00000 CYK3_1QCF-20_21.PDB 5.12832 -8.18000 -1.83000 -1.72000 -9.76000 -0.15000 8.12000 -12.98000 2.67000 4.70000 3.29000 0.00000 0.00000 0.00000 0.08000 0.43000 0.00000 -0.36000 0.00000 -0.23000 0.00000 2.38000 66.00000 CYK3_1QCF-20_22.PDB 5.32046 -9.23000 -1.81000 -1.73000 -9.45000 -0.17000 7.71000 -12.69000 2.03000 4.49000 2.83000 0.00000 0.00000 0.00000 0.08000 0.45000 0.00000 -0.30000 0.00000 -0.23000 0.00000 2.38000 66.00000 CYK3_1QCF-20_23.PDB 6.09302 -9.05000 -1.81000 -1.78000 -9.37000 -0.19000 8.27000 -12.34000 2.21000 3.88000 2.96000 0.00000 0.00000 0.00000 0.16000 0.50000 0.00000 -0.79000 0.00000 -0.25000 0.00000 2.38000 66.00000 CYK3_1QCF-20_24.PDB 5.06311 -8.53000 -1.81000 -1.75000 -9.39000 -0.13000 8.42000 -12.32000 2.23000 3.95000 3.18000 0.00000 0.00000 0.00000 0.15000 0.49000 0.00000 -0.86000 0.00000 -0.20000 0.00000 2.38000 66.00000 CYK3_1QCF-20_25.PDB 5.24968 -9.96000 -1.84000 -3.50000 -9.60000 -0.42000 8.86000 -12.33000 2.27000 4.42000 2.86000 0.00000 0.00000 0.00000 0.28000 0.50000 0.00000 -0.54000 0.00000 -0.43000 0.00000 2.38000 66.00000 CYK3_1QCF-20_26.PDB 5.53351 -10.20000 -1.83000 -3.50000 -9.42000 -0.35000 8.80000 -12.16000 1.81000 4.38000 2.97000 0.00000 0.00000 0.00000 0.23000 0.46000 0.00000 -0.74000 0.00000 -0.38000 0.00000 2.38000 66.00000 CYK3_1QCF-20_27.PDB 5.32400 -8.14000 -1.81000 -1.75000 -9.33000 -0.22000 8.52000 -12.09000 1.83000 4.75000 2.93000 0.00000 0.00000 0.00000 0.08000 0.42000 0.00000 -0.73000 0.00000 -0.32000 0.00000 2.38000 66.00000 CYK3_1QCF-20_28.PDB 5.33264 -8.12000 -1.86000 -1.75000 -9.94000 -0.10000 9.17000 -12.75000 1.54000 5.08000 3.31000 0.00000 0.00000 0.00000 0.09000 0.54000 0.00000 -0.74000 0.00000 -0.16000 0.00000 2.38000 66.00000 CYK3_1QCF-20_29.PDB 5.26082 -10.52000 -1.83000 -3.46000 -9.81000 -0.21000 8.93000 -12.79000 1.81000 4.39000 3.15000 0.00000 0.00000 0.00000 0.27000 0.52000 0.00000 -0.76000 0.00000 -0.21000 0.00000 2.38000 66.00000 CYK3_1QCF-20_30.PDB 5.38353 -8.98000 -1.81000 -1.72000 -9.31000 -0.14000 7.69000 -12.46000 1.83000 4.40000 3.04000 0.00000 0.00000 0.00000 0.07000 0.48000 0.00000 -0.38000 0.00000 -0.18000 0.00000 2.38000 66.00000