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-28_1.PDB 3.81278 -14.63000 -0.66000 -3.79000 -11.26000 -0.02000 7.56000 -16.42000 2.09000 5.87000 2.37000 0.00000 0.00000 0.00000 0.16000 1.36000 0.00000 -0.45000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_2.PDB 3.83143 -10.99000 -0.66000 -0.99000 -10.84000 -0.03000 7.56000 -15.58000 1.91000 5.72000 2.55000 0.00000 0.00000 0.00000 0.22000 1.26000 0.00000 -0.78000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_3.PDB 4.15863 -10.12000 -0.99000 -0.77000 -10.49000 -0.03000 7.38000 -14.99000 3.28000 4.54000 2.47000 0.00000 0.00000 0.00000 0.19000 1.12000 0.00000 -0.65000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_4.PDB 4.70832 -14.51000 -1.09000 -4.35000 -11.35000 -0.03000 8.07000 -15.96000 2.31000 5.70000 2.42000 0.00000 0.00000 0.00000 0.31000 1.24000 0.00000 -0.48000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_5.PDB 4.09482 -13.79000 -0.69000 -4.61000 -11.52000 -0.03000 8.72000 -16.14000 2.07000 6.49000 2.43000 0.00000 0.00000 0.00000 0.21000 1.45000 0.00000 -0.67000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_6.PDB 4.22128 -14.60000 -0.98000 -4.19000 -11.33000 -0.03000 8.23000 -15.96000 2.16000 5.43000 2.33000 0.00000 0.00000 0.00000 0.25000 1.15000 0.00000 -0.46000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_7.PDB 4.14104 -10.70000 -0.76000 -1.73000 -11.27000 -0.03000 8.31000 -16.03000 1.95000 6.56000 3.07000 0.00000 0.00000 0.00000 0.20000 1.28000 0.00000 -0.91000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_8.PDB 4.72742 -13.23000 -1.11000 -2.19000 -11.57000 -0.03000 8.08000 -16.47000 1.83000 6.01000 2.38000 0.00000 0.00000 0.00000 0.34000 1.24000 0.00000 -0.46000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_9.PDB 4.40143 -10.30000 -1.00000 -3.02000 -11.14000 -0.03000 9.19000 -14.79000 2.14000 6.07000 2.56000 0.00000 0.00000 0.00000 0.37000 0.92000 0.00000 -0.58000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_10.PDB 4.19567 -13.85000 -0.59000 -4.45000 -11.35000 -0.02000 8.17000 -15.90000 1.83000 6.57000 2.41000 0.00000 0.00000 0.00000 0.18000 1.29000 0.00000 -0.64000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_11.PDB 4.00746 -15.21000 -1.03000 -4.24000 -11.60000 -0.05000 8.24000 -16.40000 2.08000 5.77000 2.53000 0.00000 0.00000 0.00000 0.25000 1.30000 0.00000 -0.66000 0.00000 -0.08000 0.00000 2.38000 67.00000 CYK3_1QCF-28_12.PDB 4.70240 -14.13000 -1.06000 -4.17000 -11.19000 -0.02000 8.30000 -15.67000 2.15000 5.46000 2.40000 0.00000 0.00000 0.00000 0.28000 1.21000 0.00000 -0.54000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_13.PDB 4.31486 -14.29000 -1.03000 -4.21000 -11.33000 -0.03000 8.33000 -15.90000 2.32000 5.47000 2.38000 0.00000 0.00000 0.00000 0.27000 1.25000 0.00000 -0.51000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_14.PDB 3.83591 -11.92000 -0.98000 -0.81000 -10.61000 -0.03000 6.65000 -15.56000 2.66000 4.79000 2.40000 0.00000 0.00000 0.00000 0.26000 1.29000 0.00000 -0.62000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_15.PDB 4.09683 -12.20000 -0.71000 -0.47000 -10.60000 -0.03000 6.60000 -15.65000 1.96000 4.94000 2.25000 0.00000 0.00000 0.00000 0.14000 1.16000 0.00000 -0.57000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_16.PDB 3.85388 -13.64000 -0.62000 -3.79000 -10.93000 -0.02000 7.53000 -15.72000 2.44000 5.58000 2.26000 0.00000 0.00000 0.00000 0.17000 1.20000 0.00000 -0.47000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_17.PDB 4.86758 -14.06000 -1.07000 -5.44000 -11.42000 -0.05000 9.55000 -15.22000 1.52000 5.85000 2.55000 0.00000 0.00000 0.00000 0.44000 1.20000 0.00000 -0.70000 0.00000 -0.08000 0.00000 2.38000 67.00000 CYK3_1QCF-28_18.PDB 3.76212 -11.05000 -1.04000 -0.80000 -10.72000 -0.18000 7.42000 -15.29000 3.24000 4.76000 2.38000 0.00000 0.00000 0.00000 0.23000 1.10000 0.00000 -0.84000 0.00000 -0.23000 0.00000 2.38000 67.00000 CYK3_1QCF-28_19.PDB 4.91584 -14.15000 -1.13000 -4.77000 -11.70000 -0.02000 9.08000 -16.06000 2.14000 6.17000 2.68000 0.00000 0.00000 0.00000 0.35000 1.43000 0.00000 -0.83000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_20.PDB 3.60709 -15.28000 -0.75000 -3.92000 -11.52000 -0.02000 7.86000 -16.68000 2.12000 5.86000 2.24000 0.00000 0.00000 0.00000 0.17000 1.76000 0.00000 -0.57000 0.00000 -0.07000 0.00000 2.38000 67.00000 CYK3_1QCF-28_21.PDB 5.01012 -13.14000 -0.99000 -4.13000 -11.29000 -0.02000 8.86000 -15.37000 2.09000 5.59000 2.66000 0.00000 0.00000 0.00000 0.31000 1.21000 0.00000 -0.78000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_22.PDB 4.13278 -10.65000 -1.09000 -2.08000 -10.90000 -0.03000 8.37000 -14.93000 2.74000 5.03000 2.78000 0.00000 0.00000 0.00000 0.33000 1.35000 0.00000 -0.80000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_23.PDB 4.82685 -13.08000 -1.10000 -5.45000 -11.24000 -0.19000 9.70000 -14.80000 2.36000 5.74000 2.60000 0.00000 0.00000 0.00000 0.24000 1.07000 0.00000 -0.72000 0.00000 -0.24000 0.00000 2.38000 67.00000 CYK3_1QCF-28_24.PDB 4.78367 -9.89000 -1.04000 -1.97000 -11.06000 -0.03000 8.84000 -14.80000 2.95000 5.09000 2.73000 0.00000 0.00000 0.00000 0.38000 1.06000 0.00000 -0.93000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_25.PDB 5.05116 -12.61000 -0.70000 -0.42000 -10.56000 -0.02000 6.66000 -15.26000 0.55000 4.84000 2.68000 0.00000 0.00000 0.00000 0.14000 1.07000 0.00000 -0.45000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_26.PDB 5.02248 -14.13000 -1.13000 -5.50000 -11.96000 -0.03000 9.65000 -16.10000 2.50000 6.21000 2.67000 0.00000 0.00000 0.00000 0.40000 1.37000 0.00000 -0.78000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_27.PDB 4.26450 -14.16000 -1.13000 -5.56000 -11.79000 -0.03000 9.84000 -15.74000 1.93000 6.16000 2.62000 0.00000 0.00000 0.00000 0.34000 1.65000 0.00000 -0.74000 0.00000 -0.07000 0.00000 2.38000 67.00000 CYK3_1QCF-28_28.PDB 3.81520 -14.55000 -1.01000 -4.19000 -11.52000 -0.03000 8.64000 -16.17000 2.40000 5.51000 2.47000 0.00000 0.00000 0.00000 0.25000 1.61000 0.00000 -0.84000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-28_29.PDB 4.31469 -14.62000 -1.07000 -4.26000 -11.25000 -0.04000 8.44000 -15.85000 1.91000 5.39000 2.45000 0.00000 0.00000 0.00000 0.23000 1.27000 0.00000 -0.50000 0.00000 -0.08000 0.00000 2.38000 67.00000 CYK3_1QCF-28_30.PDB 3.53363 -9.80000 -1.01000 -0.79000 -10.69000 -0.18000 7.58000 -15.24000 4.17000 4.74000 2.41000 0.00000 0.00000 0.00000 0.17000 1.18000 0.00000 -0.72000 0.00000 -0.24000 0.00000 2.38000 67.00000