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-17_1.PDB 7.85546 -6.27000 -0.64000 -0.62000 -7.90000 -0.05000 5.62000 -11.17000 3.19000 2.78000 3.11000 0.00000 0.00000 0.00000 0.35000 0.35000 0.00000 -0.76000 0.00000 -0.18000 0.00000 2.38000 66.00000 CYK3_1QCF-17_2.PDB 8.17201 -6.19000 -0.64000 -0.62000 -8.38000 -0.12000 5.92000 -11.80000 3.56000 3.20000 3.31000 0.00000 0.00000 0.00000 0.38000 0.40000 0.00000 -0.74000 0.00000 -0.25000 0.00000 2.38000 66.00000 CYK3_1QCF-17_3.PDB 7.51671 -6.93000 -0.64000 -0.65000 -8.48000 -0.13000 5.62000 -12.23000 4.24000 3.19000 2.99000 0.00000 0.00000 0.00000 0.32000 0.37000 0.00000 -0.92000 0.00000 -0.24000 0.00000 2.38000 66.00000 CYK3_1QCF-17_4.PDB 7.50448 -5.03000 -0.63000 -2.27000 -8.77000 -0.19000 7.11000 -11.70000 4.97000 4.25000 2.91000 0.00000 0.00000 0.00000 0.42000 0.72000 0.00000 -0.88000 0.00000 -0.27000 0.00000 2.38000 66.00000 CYK3_1QCF-17_5.PDB 9.00247 -6.39000 -0.70000 -2.23000 -9.70000 -0.52000 8.31000 -12.91000 5.02000 4.32000 2.94000 0.00000 0.00000 0.00000 0.56000 0.87000 0.00000 -1.01000 0.00000 -0.48000 0.00000 2.38000 66.00000 CYK3_1QCF-17_6.PDB 5.76291 -4.47000 -0.72000 -0.62000 -8.94000 -0.08000 6.79000 -12.39000 5.41000 3.37000 3.10000 0.00000 0.00000 0.00000 0.44000 0.60000 0.00000 -0.59000 0.00000 -0.22000 0.00000 2.38000 66.00000 CYK3_1QCF-17_7.PDB 8.68519 -6.63000 -0.65000 -2.20000 -8.28000 -0.12000 6.20000 -11.53000 3.74000 3.69000 3.21000 0.00000 0.00000 0.00000 0.36000 0.48000 0.00000 -0.84000 0.00000 -0.21000 0.00000 2.38000 66.00000 CYK3_1QCF-17_8.PDB 8.69283 -6.77000 -0.73000 -2.29000 -9.19000 -0.50000 7.59000 -12.45000 4.81000 3.98000 3.39000 0.00000 0.00000 0.00000 0.50000 0.75000 0.00000 -1.41000 0.00000 -0.46000 0.00000 2.38000 66.00000 CYK3_1QCF-17_9.PDB 5.21638 -5.55000 -0.68000 -0.62000 -8.75000 -0.11000 6.65000 -12.03000 4.40000 3.37000 3.17000 0.00000 0.00000 0.00000 0.17000 0.51000 0.00000 -0.86000 0.00000 -0.25000 0.00000 2.38000 66.00000 CYK3_1QCF-17_10.PDB 6.98405 -5.43000 -0.67000 -0.64000 -9.04000 -0.11000 6.83000 -12.63000 4.90000 3.42000 3.23000 0.00000 0.00000 0.00000 0.48000 0.68000 0.00000 -0.95000 0.00000 -0.24000 0.00000 2.38000 66.00000 CYK3_1QCF-17_11.PDB 7.87932 -5.88000 -0.65000 -2.15000 -8.57000 -0.21000 6.52000 -11.89000 4.82000 4.09000 2.83000 0.00000 0.00000 0.00000 0.38000 0.55000 0.00000 -0.80000 0.00000 -0.27000 0.00000 2.38000 66.00000 CYK3_1QCF-17_12.PDB 8.73303 -5.84000 -0.64000 -2.28000 -8.36000 -0.23000 6.94000 -11.38000 3.54000 4.03000 3.10000 0.00000 0.00000 0.00000 0.59000 0.57000 0.00000 -0.86000 0.00000 -0.29000 0.00000 2.38000 66.00000 CYK3_1QCF-17_13.PDB 7.44694 -7.19000 -0.64000 -2.26000 -8.58000 -0.15000 6.36000 -11.88000 3.60000 3.96000 3.18000 0.00000 0.00000 0.00000 0.35000 0.44000 0.00000 -0.91000 0.00000 -0.22000 0.00000 2.38000 66.00000 CYK3_1QCF-17_14.PDB 8.52304 -5.38000 -0.66000 -0.62000 -8.35000 -0.10000 6.27000 -11.69000 4.00000 3.05000 3.30000 0.00000 0.00000 0.00000 0.45000 0.58000 0.00000 -0.81000 0.00000 -0.23000 0.00000 2.38000 66.00000 CYK3_1QCF-17_15.PDB 7.95676 -4.07000 -0.63000 -2.20000 -8.30000 -0.10000 6.91000 -10.98000 4.89000 3.84000 3.13000 0.00000 0.00000 0.00000 0.36000 0.54000 0.00000 -0.84000 0.00000 -0.15000 0.00000 2.38000 66.00000 CYK3_1QCF-17_16.PDB 8.21672 -5.45000 -0.64000 -0.62000 -8.10000 -0.13000 6.24000 -11.11000 3.23000 3.04000 3.24000 0.00000 0.00000 0.00000 0.38000 0.38000 0.00000 -0.75000 0.00000 -0.24000 0.00000 2.38000 66.00000 CYK3_1QCF-17_17.PDB 7.80850 -5.25000 -0.66000 -0.62000 -8.85000 -0.08000 6.91000 -12.26000 3.80000 3.29000 3.42000 0.00000 0.00000 0.00000 0.66000 0.60000 0.00000 -0.64000 0.00000 -0.23000 0.00000 2.38000 66.00000 CYK3_1QCF-17_18.PDB 7.40383 -5.80000 -0.64000 -2.20000 -8.29000 -0.13000 6.24000 -11.73000 4.74000 3.73000 3.28000 0.00000 0.00000 0.00000 0.37000 0.46000 0.00000 -0.96000 0.00000 -0.21000 0.00000 2.38000 66.00000 CYK3_1QCF-17_19.PDB 7.75908 -3.30000 -0.63000 -2.14000 -8.18000 -0.02000 6.87000 -10.75000 5.11000 3.70000 3.34000 0.00000 0.00000 0.00000 0.37000 0.54000 0.00000 -0.87000 0.00000 -0.10000 0.00000 2.38000 66.00000 CYK3_1QCF-17_20.PDB 7.41550 -6.66000 -0.64000 -0.62000 -8.21000 -0.16000 6.00000 -11.62000 3.24000 3.19000 2.96000 0.00000 0.00000 0.00000 0.35000 0.44000 0.00000 -0.91000 0.00000 -0.25000 0.00000 2.38000 66.00000 CYK3_1QCF-17_21.PDB 7.87840 -6.47000 -0.64000 -0.62000 -8.24000 -0.15000 5.85000 -11.60000 3.23000 3.13000 3.19000 0.00000 0.00000 0.00000 0.40000 0.40000 0.00000 -0.78000 0.00000 -0.24000 0.00000 2.38000 66.00000 CYK3_1QCF-17_22.PDB 8.99922 -6.02000 -0.67000 -2.18000 -8.57000 -0.22000 6.74000 -11.97000 4.17000 3.91000 3.37000 0.00000 0.00000 0.00000 0.56000 0.65000 0.00000 -0.88000 0.00000 -0.28000 0.00000 2.38000 66.00000 CYK3_1QCF-17_23.PDB 8.32593 -5.47000 -0.63000 -0.62000 -7.87000 -0.02000 5.83000 -10.98000 3.31000 2.84000 3.20000 0.00000 0.00000 0.00000 0.42000 0.35000 0.00000 -0.83000 0.00000 -0.12000 0.00000 2.38000 66.00000 CYK3_1QCF-17_24.PDB 6.83990 -6.67000 -0.64000 -2.18000 -8.76000 -0.17000 6.75000 -11.90000 3.71000 4.08000 3.27000 0.00000 0.00000 0.00000 0.41000 0.49000 0.00000 -1.02000 0.00000 -0.21000 0.00000 2.38000 66.00000 CYK3_1QCF-17_25.PDB 9.55857 -6.02000 -0.66000 -2.23000 -9.15000 -0.26000 7.69000 -12.37000 3.71000 4.45000 3.30000 0.00000 0.00000 0.00000 0.74000 0.67000 0.00000 -0.89000 0.00000 -0.32000 0.00000 2.38000 66.00000 CYK3_1QCF-17_26.PDB 7.60358 -3.45000 -0.65000 -2.17000 -7.95000 -0.02000 6.87000 -10.47000 4.14000 3.56000 3.61000 0.00000 0.00000 0.00000 0.45000 0.54000 0.00000 -0.72000 0.00000 -0.10000 0.00000 2.38000 66.00000 CYK3_1QCF-17_27.PDB 8.61693 -4.73000 -0.69000 -2.24000 -9.13000 -0.17000 7.05000 -12.56000 6.29000 4.26000 3.32000 0.00000 0.00000 0.00000 0.39000 0.61000 0.00000 -1.03000 0.00000 -0.23000 0.00000 2.38000 66.00000 CYK3_1QCF-17_28.PDB 9.25657 -6.74000 -0.64000 -0.62000 -8.55000 -0.19000 6.28000 -12.27000 3.34000 3.30000 3.10000 0.00000 0.00000 0.00000 0.59000 0.46000 0.00000 -0.80000 0.00000 -0.28000 0.00000 2.38000 66.00000 CYK3_1QCF-17_29.PDB 7.59308 -6.11000 -0.63000 -0.62000 -8.12000 -0.18000 5.72000 -11.68000 3.99000 3.14000 2.93000 0.00000 0.00000 0.00000 0.32000 0.35000 0.00000 -0.74000 0.00000 -0.27000 0.00000 2.38000 66.00000 CYK3_1QCF-17_30.PDB 7.87200 -5.38000 -0.65000 -0.62000 -8.66000 -0.18000 6.86000 -11.78000 3.76000 3.38000 3.37000 0.00000 0.00000 0.00000 0.38000 0.55000 0.00000 -0.95000 0.00000 -0.28000 0.00000 2.38000 66.00000