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-5_1.PDB 3.36383 -12.24000 -0.59000 -0.37000 -8.55000 -0.61000 5.11000 -12.54000 1.79000 3.14000 1.40000 0.00000 0.00000 0.00000 0.05000 0.85000 0.00000 -0.37000 0.00000 -0.69000 0.00000 2.38000 67.00000 CYK3_1QCF-5_2.PDB 3.55850 -11.82000 -0.94000 -2.42000 -8.88000 -0.64000 5.68000 -12.73000 2.99000 4.14000 2.03000 0.00000 0.00000 0.00000 0.08000 1.07000 0.00000 -0.47000 0.00000 -0.64000 0.00000 2.38000 67.00000 CYK3_1QCF-5_3.PDB 3.59889 -13.03000 -0.96000 -4.36000 -9.58000 -1.36000 7.58000 -13.32000 2.92000 5.61000 1.62000 0.00000 0.00000 0.00000 0.08000 0.99000 0.00000 -0.40000 0.00000 -0.87000 0.00000 2.38000 67.00000 CYK3_1QCF-5_4.PDB 3.10100 -10.70000 -0.98000 -0.75000 -8.58000 -0.36000 4.69000 -12.72000 4.19000 2.94000 1.75000 0.00000 0.00000 0.00000 0.05000 0.96000 0.00000 -0.57000 0.00000 -0.35000 0.00000 2.38000 67.00000 CYK3_1QCF-5_5.PDB 3.83341 -12.07000 -0.89000 -0.84000 -9.74000 -0.59000 6.46000 -13.75000 1.37000 4.38000 2.49000 0.00000 0.00000 0.00000 0.10000 1.03000 0.00000 -0.48000 0.00000 -0.57000 0.00000 2.38000 67.00000 CYK3_1QCF-5_6.PDB 3.72194 -11.50000 -0.57000 -2.00000 -10.23000 -1.10000 7.98000 -13.87000 3.04000 4.28000 1.98000 0.00000 0.00000 0.00000 0.15000 0.99000 0.00000 -0.28000 0.00000 -0.88000 0.00000 2.38000 67.00000 CYK3_1QCF-5_7.PDB 3.82053 -11.21000 -0.93000 -1.55000 -8.81000 -0.45000 5.28000 -12.62000 3.28000 3.53000 1.83000 0.00000 0.00000 0.00000 0.06000 1.02000 0.00000 -0.34000 0.00000 -0.47000 0.00000 2.38000 67.00000 CYK3_1QCF-5_8.PDB 3.58581 -11.76000 -0.98000 -1.87000 -8.58000 -0.69000 5.35000 -12.44000 2.76000 3.75000 2.19000 0.00000 0.00000 0.00000 0.07000 1.04000 0.00000 -0.69000 0.00000 -0.63000 0.00000 2.38000 67.00000 CYK3_1QCF-5_9.PDB 3.33103 -9.04000 -1.10000 -0.80000 -8.46000 -0.35000 5.41000 -12.38000 3.85000 3.38000 2.36000 0.00000 0.00000 0.00000 0.04000 0.89000 0.00000 -0.55000 0.00000 -0.43000 0.00000 2.38000 67.00000 CYK3_1QCF-5_10.PDB 3.43868 -11.60000 -0.95000 -2.38000 -8.89000 -0.48000 5.37000 -12.85000 3.53000 3.94000 1.88000 0.00000 0.00000 0.00000 0.06000 1.05000 0.00000 -0.41000 0.00000 -0.42000 0.00000 2.38000 67.00000 CYK3_1QCF-5_11.PDB 3.79613 -12.99000 -0.92000 -2.39000 -9.00000 -0.69000 5.65000 -13.08000 2.57000 4.15000 1.74000 0.00000 0.00000 0.00000 0.05000 1.03000 0.00000 -0.43000 0.00000 -0.63000 0.00000 2.38000 67.00000 CYK3_1QCF-5_12.PDB 3.79372 -11.86000 -0.94000 -2.41000 -9.67000 -0.53000 6.07000 -14.02000 2.75000 5.03000 2.65000 0.00000 0.00000 0.00000 0.08000 1.03000 0.00000 -0.31000 0.00000 -0.56000 0.00000 2.38000 67.00000 CYK3_1QCF-5_13.PDB 4.74081 -13.36000 -0.55000 -3.05000 -10.25000 -1.29000 8.33000 -13.98000 2.06000 4.64000 2.00000 0.00000 0.00000 0.00000 0.24000 0.86000 0.00000 -0.52000 0.00000 -0.99000 0.00000 2.38000 67.00000 CYK3_1QCF-5_14.PDB 5.09051 -10.81000 -0.59000 -2.10000 -9.94000 -0.58000 6.86000 -13.86000 4.07000 4.11000 1.85000 0.00000 0.00000 0.00000 0.37000 1.40000 0.00000 -0.32000 0.00000 -0.68000 0.00000 2.38000 67.00000 CYK3_1QCF-5_15.PDB 3.96404 -11.83000 -0.94000 -2.43000 -8.67000 -0.36000 5.46000 -12.57000 2.27000 4.71000 1.53000 0.00000 0.00000 0.00000 0.05000 0.96000 0.00000 -0.47000 0.00000 -0.41000 0.00000 2.38000 67.00000 CYK3_1QCF-5_16.PDB 3.69328 -8.40000 -1.11000 -2.56000 -9.07000 -0.39000 6.19000 -12.86000 4.64000 4.95000 2.56000 0.00000 0.00000 0.00000 0.08000 1.05000 0.00000 -0.36000 0.00000 -0.46000 0.00000 2.38000 67.00000 CYK3_1QCF-5_17.PDB 3.48705 -11.60000 -0.94000 -0.70000 -8.75000 -0.59000 5.20000 -13.05000 2.98000 3.33000 2.09000 0.00000 0.00000 0.00000 0.06000 1.05000 0.00000 -0.58000 0.00000 -0.65000 0.00000 2.38000 67.00000 CYK3_1QCF-5_18.PDB 3.40440 -11.48000 -0.97000 -2.30000 -9.03000 -0.51000 5.66000 -13.08000 3.56000 4.08000 2.07000 0.00000 0.00000 0.00000 0.05000 1.05000 0.00000 -0.52000 0.00000 -0.49000 0.00000 2.38000 67.00000 CYK3_1QCF-5_19.PDB 4.97054 -11.12000 -0.63000 -2.14000 -10.45000 -1.20000 8.09000 -14.22000 4.41000 4.09000 1.52000 0.00000 0.00000 0.00000 0.47000 1.41000 0.00000 -0.20000 0.00000 -0.87000 0.00000 2.38000 67.00000 CYK3_1QCF-5_20.PDB 3.64687 -10.73000 -0.61000 -3.45000 -9.80000 -1.37000 7.49000 -13.51000 4.91000 5.73000 1.13000 0.00000 0.00000 0.00000 0.07000 0.69000 0.00000 -0.37000 0.00000 -0.93000 0.00000 2.38000 67.00000 CYK3_1QCF-5_21.PDB 3.75155 -11.50000 -0.60000 -0.39000 -8.85000 -0.54000 5.22000 -12.95000 2.92000 3.02000 1.48000 0.00000 0.00000 0.00000 0.06000 0.92000 0.00000 -0.38000 0.00000 -0.49000 0.00000 2.38000 67.00000 CYK3_1QCF-5_22.PDB 4.35063 -12.76000 -0.95000 -2.33000 -9.76000 -1.32000 7.00000 -13.87000 3.68000 4.15000 1.85000 0.00000 0.00000 0.00000 0.14000 1.15000 0.00000 -0.57000 0.00000 -0.81000 0.00000 2.38000 67.00000 CYK3_1QCF-5_23.PDB 4.77503 -12.29000 -0.55000 -2.15000 -9.65000 -0.68000 6.26000 -13.74000 2.70000 4.36000 2.12000 0.00000 0.00000 0.00000 0.19000 0.94000 0.00000 -0.43000 0.00000 -0.73000 0.00000 2.38000 67.00000 CYK3_1QCF-5_24.PDB 3.72503 -11.61000 -0.91000 -0.71000 -9.24000 -0.43000 5.59000 -13.44000 2.03000 3.93000 2.52000 0.00000 0.00000 0.00000 0.08000 1.03000 0.00000 -0.59000 0.00000 -0.45000 0.00000 2.38000 67.00000 CYK3_1QCF-5_25.PDB 3.71464 -12.88000 -0.91000 -2.36000 -9.39000 -0.31000 5.64000 -13.66000 1.75000 4.56000 2.34000 0.00000 0.00000 0.00000 0.09000 1.05000 0.00000 -0.36000 0.00000 -0.27000 0.00000 2.38000 67.00000 CYK3_1QCF-5_26.PDB 5.13105 -11.29000 -0.55000 -1.97000 -9.11000 -0.36000 5.65000 -13.17000 2.76000 3.98000 1.90000 0.00000 0.00000 0.00000 0.09000 0.76000 0.00000 -0.11000 0.00000 -0.40000 0.00000 2.38000 67.00000 CYK3_1QCF-5_27.PDB 3.34715 -11.67000 -0.94000 -2.38000 -9.39000 -1.32000 6.99000 -13.00000 2.97000 4.19000 2.34000 0.00000 0.00000 0.00000 0.10000 0.99000 0.00000 -0.38000 0.00000 -0.83000 0.00000 2.38000 67.00000 CYK3_1QCF-5_28.PDB 3.63792 -12.01000 -0.96000 -2.27000 -9.25000 -1.23000 6.59000 -12.89000 3.53000 3.77000 1.72000 0.00000 0.00000 0.00000 0.12000 1.03000 0.00000 -0.41000 0.00000 -0.74000 0.00000 2.38000 67.00000 CYK3_1QCF-5_29.PDB 3.67152 -11.68000 -0.97000 -2.47000 -9.27000 -0.34000 6.18000 -13.18000 2.34000 4.87000 1.76000 0.00000 0.00000 0.00000 0.06000 1.04000 0.00000 -0.35000 0.00000 -0.31000 0.00000 2.38000 67.00000 CYK3_1QCF-5_30.PDB 3.92111 -8.16000 -1.09000 -2.56000 -8.59000 -0.34000 5.84000 -12.35000 4.51000 4.58000 2.65000 0.00000 0.00000 0.00000 0.07000 0.93000 0.00000 -0.45000 0.00000 -0.41000 0.00000 2.38000 67.00000