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-18_1.PDB 5.56925 -5.46000 -0.21000 -0.85000 -8.36000 0.04000 5.22000 -11.92000 5.21000 3.57000 2.23000 0.00000 0.00000 0.00000 0.16000 0.97000 0.00000 -0.49000 0.00000 -0.05000 0.00000 2.38000 67.00000 CYK3_1QCF-18_2.PDB 5.74825 -5.26000 -0.21000 -0.85000 -8.33000 0.02000 5.27000 -11.83000 5.10000 3.58000 2.41000 0.00000 0.00000 0.00000 0.15000 0.95000 0.00000 -0.50000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-18_3.PDB 5.63663 -6.30000 -0.18000 -0.84000 -8.65000 0.20000 5.15000 -12.50000 5.47000 3.28000 2.16000 0.00000 0.00000 0.00000 0.17000 0.98000 0.00000 -0.60000 0.00000 0.04000 0.00000 2.38000 67.00000 CYK3_1QCF-18_4.PDB 5.70538 -5.10000 -0.19000 -0.84000 -8.06000 0.05000 5.04000 -11.52000 5.12000 3.43000 2.20000 0.00000 0.00000 0.00000 0.18000 0.84000 0.00000 -0.49000 0.00000 -0.02000 0.00000 2.38000 67.00000 CYK3_1QCF-18_5.PDB 7.85645 -7.48000 -0.22000 -1.63000 -9.17000 -0.04000 6.00000 -13.07000 5.07000 3.82000 2.02000 0.00000 0.00000 0.00000 0.42000 1.01000 0.00000 -0.58000 0.00000 -0.09000 0.00000 2.38000 67.00000 CYK3_1QCF-18_6.PDB 5.53416 -5.13000 -0.19000 -0.85000 -7.94000 0.06000 4.78000 -11.37000 4.99000 3.43000 2.33000 0.00000 0.00000 0.00000 0.15000 0.89000 0.00000 -0.47000 0.00000 -0.04000 0.00000 2.38000 67.00000 CYK3_1QCF-18_7.PDB 4.28405 -5.20000 -0.21000 -0.84000 -8.10000 0.05000 4.94000 -11.58000 5.04000 3.47000 2.36000 0.00000 0.00000 0.00000 0.15000 0.94000 0.00000 -0.44000 0.00000 -0.04000 0.00000 2.38000 67.00000 CYK3_1QCF-18_8.PDB 5.60644 -5.67000 -0.21000 -0.85000 -8.06000 -0.03000 4.73000 -11.60000 5.19000 3.36000 2.28000 0.00000 0.00000 0.00000 0.14000 0.86000 0.00000 -0.52000 0.00000 -0.10000 0.00000 2.38000 67.00000 CYK3_1QCF-18_9.PDB 5.40175 -5.26000 -0.21000 0.00000 -8.44000 -0.01000 5.47000 -11.97000 5.10000 3.15000 2.24000 0.00000 0.00000 0.00000 0.13000 1.01000 0.00000 -0.66000 0.00000 -0.07000 0.00000 2.38000 67.00000 CYK3_1QCF-18_10.PDB 5.58690 -6.69000 -0.19000 -0.81000 -9.02000 -0.06000 5.83000 -12.69000 5.12000 3.40000 2.30000 0.00000 0.00000 0.00000 0.18000 1.18000 0.00000 -0.70000 0.00000 -0.05000 0.00000 2.38000 67.00000 CYK3_1QCF-18_11.PDB 5.80072 -5.31000 -0.19000 -0.84000 -8.16000 0.02000 5.04000 -11.69000 5.25000 3.41000 2.13000 0.00000 0.00000 0.00000 0.24000 1.04000 0.00000 -0.49000 0.00000 -0.05000 0.00000 2.38000 67.00000 CYK3_1QCF-18_12.PDB 5.52943 -5.95000 -0.20000 -0.84000 -8.49000 0.16000 5.00000 -12.34000 5.27000 3.51000 2.34000 0.00000 0.00000 0.00000 0.16000 0.87000 0.00000 -0.55000 0.00000 0.03000 0.00000 2.38000 67.00000 CYK3_1QCF-18_13.PDB 5.60083 -4.75000 -0.19000 -0.00000 -8.10000 0.03000 5.10000 -11.64000 5.06000 3.03000 2.31000 0.00000 0.00000 0.00000 0.17000 1.14000 0.00000 -0.46000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-18_14.PDB 5.44805 -5.45000 -0.19000 -0.83000 -8.01000 0.03000 4.90000 -11.48000 5.13000 3.27000 2.16000 0.00000 0.00000 0.00000 0.13000 0.92000 0.00000 -0.51000 0.00000 -0.05000 0.00000 2.38000 67.00000 CYK3_1QCF-18_15.PDB 5.57794 -5.89000 -0.21000 -0.86000 -8.65000 0.19000 5.32000 -12.51000 5.16000 3.59000 2.45000 0.00000 0.00000 0.00000 0.15000 0.93000 0.00000 -0.58000 0.00000 0.05000 0.00000 2.38000 67.00000 CYK3_1QCF-18_16.PDB 5.62969 -5.61000 -0.20000 -0.00000 -8.68000 0.16000 5.20000 -12.56000 5.14000 3.15000 2.50000 0.00000 0.00000 0.00000 0.18000 1.15000 0.00000 -0.52000 0.00000 0.03000 0.00000 2.38000 67.00000 CYK3_1QCF-18_17.PDB 5.61563 -5.78000 -0.20000 -0.84000 -8.42000 0.21000 4.86000 -12.28000 5.15000 3.46000 2.59000 0.00000 0.00000 0.00000 0.17000 0.90000 0.00000 -0.53000 0.00000 0.04000 0.00000 2.38000 67.00000 CYK3_1QCF-18_18.PDB 5.27350 -5.03000 -0.21000 0.00000 -8.31000 0.04000 5.27000 -11.91000 5.27000 2.98000 2.23000 0.00000 0.00000 0.00000 0.15000 1.03000 0.00000 -0.51000 0.00000 -0.04000 0.00000 2.38000 67.00000 CYK3_1QCF-18_19.PDB 6.22531 -4.87000 -0.20000 -0.82000 -8.31000 -0.02000 4.95000 -11.99000 5.85000 3.23000 2.27000 0.00000 0.00000 0.00000 0.92000 0.83000 0.00000 -0.72000 0.00000 -0.03000 0.00000 2.38000 67.00000 CYK3_1QCF-18_20.PDB 6.56709 -6.77000 -0.20000 -4.64000 -8.76000 0.11000 6.20000 -12.12000 5.12000 5.52000 2.36000 0.00000 0.00000 0.00000 0.17000 0.99000 0.00000 -0.60000 0.00000 0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-18_21.PDB 4.12790 -5.29000 -0.19000 -0.83000 -8.05000 0.02000 4.92000 -11.54000 5.12000 3.43000 2.29000 0.00000 0.00000 0.00000 0.20000 0.94000 0.00000 -0.61000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-18_22.PDB 5.44626 -5.77000 -0.19000 -0.85000 -8.00000 -0.12000 4.83000 -11.49000 5.07000 3.28000 2.19000 0.00000 0.00000 0.00000 0.20000 0.88000 0.00000 -0.50000 0.00000 -0.20000 0.00000 2.38000 67.00000 CYK3_1QCF-18_23.PDB 5.67480 -5.37000 -0.19000 -0.85000 -8.11000 0.06000 5.04000 -11.63000 4.99000 3.54000 2.14000 0.00000 0.00000 0.00000 0.14000 0.95000 0.00000 -0.47000 0.00000 -0.04000 0.00000 2.38000 67.00000 CYK3_1QCF-18_24.PDB 5.82916 -4.55000 -0.20000 0.00000 -8.36000 -0.01000 5.44000 -11.85000 5.12000 3.18000 2.45000 0.00000 0.00000 0.00000 0.19000 1.01000 0.00000 -0.48000 0.00000 -0.04000 0.00000 2.38000 67.00000 CYK3_1QCF-18_25.PDB 4.25903 -4.92000 -0.19000 -0.85000 -8.02000 0.07000 5.01000 -11.47000 4.99000 3.50000 2.38000 0.00000 0.00000 0.00000 0.14000 0.93000 0.00000 -0.46000 0.00000 -0.03000 0.00000 2.38000 67.00000 CYK3_1QCF-18_26.PDB 4.02033 -5.56000 -0.19000 -0.83000 -8.68000 0.24000 5.19000 -12.57000 5.91000 3.35000 2.40000 0.00000 0.00000 0.00000 0.15000 0.96000 0.00000 -0.57000 0.00000 0.04000 0.00000 2.38000 67.00000 CYK3_1QCF-18_27.PDB 6.33823 -6.00000 -0.21000 -0.83000 -8.19000 -0.00000 5.00000 -11.76000 5.15000 3.30000 2.00000 0.00000 0.00000 0.00000 0.27000 1.02000 0.00000 -0.67000 0.00000 -0.07000 0.00000 2.38000 67.00000 CYK3_1QCF-18_28.PDB 5.61382 -6.52000 -0.19000 -0.82000 -8.80000 -0.07000 5.64000 -12.44000 4.94000 3.38000 2.25000 0.00000 0.00000 0.00000 0.19000 1.03000 0.00000 -0.54000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-18_29.PDB 4.21317 -5.01000 -0.19000 0.00000 -8.18000 0.05000 5.00000 -11.77000 5.10000 3.02000 2.35000 0.00000 0.00000 0.00000 0.15000 1.06000 0.00000 -0.49000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-18_30.PDB 4.23708 -5.10000 -0.19000 -0.85000 -7.81000 0.07000 4.70000 -11.23000 4.98000 3.37000 2.23000 0.00000 0.00000 0.00000 0.14000 0.83000 0.00000 -0.44000 0.00000 -0.04000 0.00000 2.38000 67.00000