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-16_1.PDB 5.37610 -5.11000 -0.14000 0.00000 -8.58000 0.02000 5.62000 -12.74000 5.21000 3.18000 2.80000 0.00000 0.00000 0.00000 0.19000 0.74000 0.00000 -0.60000 0.00000 -0.07000 0.00000 2.38000 66.00000 CYK3_1QCF-16_2.PDB 5.33967 -5.68000 -0.07000 0.00000 -8.40000 0.04000 5.44000 -12.56000 4.87000 2.92000 2.64000 0.00000 0.00000 0.00000 0.12000 0.74000 0.00000 -0.61000 0.00000 -0.06000 0.00000 2.38000 66.00000 CYK3_1QCF-16_3.PDB 6.13003 -5.96000 -0.09000 -1.74000 -8.96000 0.02000 6.24000 -13.10000 5.07000 3.94000 3.05000 0.00000 0.00000 0.00000 0.16000 0.67000 0.00000 -0.52000 0.00000 -0.03000 0.00000 2.38000 66.00000 CYK3_1QCF-16_4.PDB 5.41458 -5.09000 -0.12000 -0.01000 -8.67000 0.00000 5.58000 -12.86000 5.16000 3.26000 3.02000 0.00000 0.00000 0.00000 0.21000 0.80000 0.00000 -0.59000 0.00000 -0.09000 0.00000 2.38000 66.00000 CYK3_1QCF-16_5.PDB 5.66352 -4.41000 -0.07000 0.00000 -8.90000 -0.04000 6.05000 -13.00000 5.38000 3.43000 3.22000 0.00000 0.00000 0.00000 0.26000 0.87000 0.00000 -0.61000 0.00000 -0.13000 0.00000 2.38000 66.00000 CYK3_1QCF-16_6.PDB 3.98793 -5.66000 -1.02000 -0.90000 -8.56000 0.01000 5.80000 -12.57000 4.86000 4.02000 3.37000 0.00000 0.00000 0.00000 0.15000 0.69000 0.00000 -0.70000 0.00000 -0.12000 0.00000 2.38000 66.00000 CYK3_1QCF-16_7.PDB 5.60186 -3.36000 -0.08000 0.00000 -8.64000 0.02000 5.72000 -12.72000 6.26000 3.29000 2.97000 0.00000 0.00000 0.00000 0.44000 0.76000 0.00000 -0.55000 0.00000 -0.07000 0.00000 2.38000 66.00000 CYK3_1QCF-16_8.PDB 5.71982 -6.62000 -1.02000 -2.59000 -9.11000 -0.06000 6.51000 -13.19000 5.13000 4.77000 3.56000 0.00000 0.00000 0.00000 0.21000 0.68000 0.00000 -0.72000 0.00000 -0.14000 0.00000 2.38000 66.00000 CYK3_1QCF-16_9.PDB 5.46314 -6.70000 -0.93000 -2.54000 -8.86000 -0.12000 6.49000 -12.82000 4.77000 4.54000 3.57000 0.00000 0.00000 0.00000 0.10000 0.65000 0.00000 -0.69000 0.00000 -0.20000 0.00000 2.38000 66.00000 CYK3_1QCF-16_10.PDB 5.27808 -6.14000 -0.16000 -1.75000 -8.86000 -0.14000 6.17000 -12.95000 5.46000 3.76000 2.94000 0.00000 0.00000 0.00000 0.18000 0.68000 0.00000 -0.57000 0.00000 -0.22000 0.00000 2.38000 66.00000 CYK3_1QCF-16_11.PDB 4.11993 -5.15000 -0.94000 -0.80000 -8.63000 0.02000 5.77000 -12.72000 5.13000 4.09000 3.46000 0.00000 0.00000 0.00000 0.23000 0.74000 0.00000 -0.68000 0.00000 -0.08000 0.00000 2.38000 66.00000 CYK3_1QCF-16_12.PDB 5.19313 -3.31000 -0.06000 0.00000 -8.29000 -0.07000 6.08000 -12.00000 5.19000 3.48000 3.06000 0.00000 0.00000 0.00000 0.07000 0.77000 0.00000 -0.69000 0.00000 -0.08000 0.00000 2.38000 66.00000 CYK3_1QCF-16_13.PDB 5.47663 -5.46000 -1.01000 -0.88000 -8.68000 0.03000 5.96000 -12.80000 5.19000 4.10000 3.26000 0.00000 0.00000 0.00000 0.18000 0.64000 0.00000 -0.72000 0.00000 -0.09000 0.00000 2.38000 66.00000 CYK3_1QCF-16_14.PDB 4.02138 -6.81000 -1.02000 -2.67000 -8.89000 -0.07000 6.34000 -12.89000 5.12000 4.52000 3.48000 0.00000 0.00000 0.00000 0.15000 0.52000 0.00000 -0.73000 0.00000 -0.15000 0.00000 2.38000 66.00000 CYK3_1QCF-16_15.PDB 5.18786 -6.33000 -0.09000 0.00000 -8.88000 0.16000 5.62000 -13.32000 4.88000 3.02000 2.82000 0.00000 0.00000 0.00000 0.11000 0.74000 0.00000 -0.65000 0.00000 0.01000 0.00000 2.38000 66.00000 CYK3_1QCF-16_16.PDB 3.95925 -4.72000 -0.14000 0.00000 -8.46000 -0.04000 5.57000 -12.53000 5.25000 3.13000 3.07000 0.00000 0.00000 0.00000 0.22000 0.68000 0.00000 -0.65000 0.00000 -0.14000 0.00000 2.38000 66.00000 CYK3_1QCF-16_17.PDB 4.34116 -4.60000 -0.06000 0.00000 -8.48000 -0.01000 5.62000 -12.54000 5.05000 3.25000 3.03000 0.00000 0.00000 0.00000 0.19000 0.65000 0.00000 -0.54000 0.00000 -0.10000 0.00000 2.38000 66.00000 CYK3_1QCF-16_18.PDB 5.40817 -5.61000 -0.06000 -0.00000 -8.51000 -0.04000 5.68000 -12.65000 4.84000 3.11000 2.60000 0.00000 0.00000 0.00000 0.18000 0.62000 0.00000 -0.59000 0.00000 -0.16000 0.00000 2.38000 66.00000 CYK3_1QCF-16_19.PDB 5.22275 -5.25000 -0.10000 0.00000 -8.54000 -0.02000 5.86000 -12.57000 4.93000 3.09000 2.70000 0.00000 0.00000 0.00000 0.15000 0.69000 0.00000 -0.61000 0.00000 -0.14000 0.00000 2.38000 66.00000 CYK3_1QCF-16_20.PDB 4.17128 -4.49000 -0.14000 0.00000 -8.63000 -0.00000 5.80000 -12.72000 5.21000 3.06000 3.38000 0.00000 0.00000 0.00000 0.33000 0.63000 0.00000 -0.66000 0.00000 -0.11000 0.00000 2.38000 66.00000 CYK3_1QCF-16_21.PDB 5.14405 -3.69000 -0.07000 0.00000 -8.64000 -0.06000 6.19000 -12.57000 5.20000 3.80000 3.12000 0.00000 0.00000 0.00000 0.10000 0.78000 0.00000 -0.71000 0.00000 -0.06000 0.00000 2.38000 66.00000 CYK3_1QCF-16_22.PDB 5.10890 -4.54000 -0.10000 -1.74000 -8.78000 -0.16000 6.67000 -12.54000 5.23000 4.23000 3.34000 0.00000 0.00000 0.00000 0.07000 0.64000 0.00000 -0.64000 0.00000 -0.12000 0.00000 2.38000 66.00000 CYK3_1QCF-16_23.PDB 5.26782 -5.38000 -0.10000 0.00000 -8.86000 0.19000 5.68000 -13.28000 4.90000 3.26000 3.22000 0.00000 0.00000 0.00000 0.22000 0.83000 0.00000 -0.66000 0.00000 0.02000 0.00000 2.38000 66.00000 CYK3_1QCF-16_24.PDB 3.96990 -5.67000 -0.08000 -1.75000 -8.78000 -0.05000 6.16000 -12.85000 5.09000 3.88000 3.24000 0.00000 0.00000 0.00000 0.14000 0.59000 0.00000 -0.55000 0.00000 -0.11000 0.00000 2.38000 66.00000 CYK3_1QCF-16_25.PDB 5.19961 -4.25000 -0.14000 -0.01000 -8.71000 -0.16000 6.31000 -12.56000 5.01000 3.82000 2.90000 0.00000 0.00000 0.00000 0.08000 0.77000 0.00000 -0.64000 0.00000 -0.17000 0.00000 2.38000 66.00000 CYK3_1QCF-16_26.PDB 5.23927 -4.19000 -0.13000 -0.01000 -8.78000 -0.15000 6.27000 -12.68000 5.25000 3.86000 2.94000 0.00000 0.00000 0.00000 0.11000 0.80000 0.00000 -0.70000 0.00000 -0.17000 0.00000 2.38000 66.00000 CYK3_1QCF-16_27.PDB 5.33365 -6.75000 -0.09000 -1.75000 -9.18000 0.11000 6.19000 -13.51000 4.85000 3.90000 3.15000 0.00000 0.00000 0.00000 0.19000 0.65000 0.00000 -0.59000 0.00000 -0.02000 0.00000 2.38000 66.00000 CYK3_1QCF-16_28.PDB 4.10594 -5.64000 -0.09000 -1.72000 -8.92000 -0.11000 6.20000 -13.01000 5.47000 4.03000 3.09000 0.00000 0.00000 0.00000 0.20000 0.58000 0.00000 -0.57000 0.00000 -0.19000 0.00000 2.38000 66.00000 CYK3_1QCF-16_29.PDB 4.00124 -5.25000 -0.11000 -1.76000 -8.82000 -0.16000 6.17000 -12.82000 5.29000 3.90000 3.74000 0.00000 0.00000 0.00000 0.20000 0.61000 0.00000 -0.66000 0.00000 -0.23000 0.00000 2.38000 66.00000 CYK3_1QCF-16_30.PDB 5.28144 -6.14000 -0.06000 0.00000 -8.78000 0.09000 5.60000 -13.20000 5.10000 2.93000 2.81000 0.00000 0.00000 0.00000 0.15000 0.72000 0.00000 -0.69000 0.00000 -0.08000 0.00000 2.38000 66.00000