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-2_1.PDB 6.01922 -9.18000 -0.20000 -0.05000 -9.96000 -0.02000 6.35000 -14.98000 4.42000 3.36000 2.00000 0.00000 0.00000 0.00000 0.17000 1.06000 0.00000 -0.11000 0.00000 -0.17000 0.00000 2.38000 67.00000 CYK3_1QCF-2_2.PDB 4.72461 -6.49000 -0.48000 -0.31000 -9.40000 0.03000 6.53000 -13.94000 5.51000 3.07000 2.42000 0.00000 0.00000 0.00000 0.18000 0.95000 0.00000 -0.05000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-2_3.PDB 5.98599 -9.02000 -0.21000 -0.06000 -9.94000 0.03000 6.16000 -14.97000 4.45000 3.27000 2.37000 0.00000 0.00000 0.00000 0.17000 1.08000 0.00000 -0.15000 0.00000 -0.14000 0.00000 2.38000 67.00000 CYK3_1QCF-2_4.PDB 4.55560 -7.90000 -0.52000 -0.34000 -9.36000 0.04000 6.53000 -13.83000 3.91000 3.05000 2.59000 0.00000 0.00000 0.00000 0.30000 0.84000 0.00000 -0.19000 0.00000 -0.08000 0.00000 2.38000 67.00000 CYK3_1QCF-2_5.PDB 4.44499 -10.01000 -0.23000 0.00000 -10.26000 -0.03000 6.97000 -15.25000 2.83000 4.23000 1.78000 0.00000 0.00000 0.00000 0.23000 0.84000 0.00000 -0.08000 0.00000 -0.20000 0.00000 2.38000 67.00000 CYK3_1QCF-2_6.PDB 4.59549 -9.36000 -0.20000 0.00000 -9.83000 -0.03000 6.72000 -14.61000 2.35000 3.96000 2.29000 0.00000 0.00000 0.00000 0.22000 0.87000 0.00000 -0.08000 0.00000 -0.15000 0.00000 2.38000 67.00000 CYK3_1QCF-2_7.PDB 5.50908 -7.29000 -0.48000 -0.29000 -9.56000 0.04000 6.47000 -14.13000 5.25000 3.16000 2.18000 0.00000 0.00000 0.00000 0.16000 1.01000 0.00000 -0.02000 0.00000 -0.07000 0.00000 2.38000 67.00000 CYK3_1QCF-2_8.PDB 5.94704 -8.23000 -0.20000 -0.06000 -9.94000 0.01000 6.22000 -14.95000 4.96000 3.41000 2.40000 0.00000 0.00000 0.00000 0.19000 1.04000 0.00000 -0.10000 0.00000 -0.17000 0.00000 2.38000 67.00000 CYK3_1QCF-2_9.PDB 4.88260 -7.44000 -0.51000 -0.29000 -9.41000 0.03000 6.40000 -13.89000 4.51000 3.13000 2.42000 0.00000 0.00000 0.00000 0.36000 0.96000 0.00000 -0.12000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-2_10.PDB 5.92480 -6.88000 -0.19000 -0.01000 -9.57000 0.06000 7.03000 -13.83000 4.07000 3.30000 2.21000 0.00000 0.00000 0.00000 0.18000 0.87000 0.00000 -0.10000 0.00000 -0.03000 0.00000 2.38000 67.00000 CYK3_1QCF-2_11.PDB 5.31843 -7.36000 -0.47000 -0.31000 -9.78000 -0.06000 6.89000 -14.24000 5.33000 3.30000 2.02000 0.00000 0.00000 0.00000 0.41000 0.97000 0.00000 -0.25000 0.00000 -0.22000 0.00000 2.38000 67.00000 CYK3_1QCF-2_12.PDB 6.06602 -7.66000 -0.19000 -0.02000 -10.32000 -0.01000 7.03000 -14.88000 4.60000 3.51000 2.64000 0.00000 0.00000 0.00000 0.29000 0.86000 0.00000 -0.13000 0.00000 -0.19000 0.00000 2.38000 67.00000 CYK3_1QCF-2_13.PDB 5.48497 -8.08000 -0.19000 -0.01000 -9.64000 0.05000 6.55000 -14.35000 4.27000 3.07000 2.29000 0.00000 0.00000 0.00000 0.11000 1.02000 0.00000 -0.15000 0.00000 -0.07000 0.00000 2.38000 67.00000 CYK3_1QCF-2_14.PDB 5.11735 -9.09000 -0.22000 0.00000 -10.57000 0.07000 7.44000 -15.15000 2.48000 4.23000 2.41000 0.00000 0.00000 0.00000 0.36000 0.74000 0.00000 -0.08000 0.00000 -0.06000 0.00000 2.38000 67.00000 CYK3_1QCF-2_15.PDB 4.78241 -6.18000 -0.99000 -0.30000 -9.88000 -0.03000 7.91000 -13.76000 4.06000 3.74000 2.95000 0.00000 0.00000 0.00000 0.48000 0.97000 0.00000 -0.21000 0.00000 -0.16000 0.00000 2.38000 67.00000 CYK3_1QCF-2_16.PDB 4.96476 -6.64000 -1.05000 -0.91000 -9.95000 0.04000 7.82000 -14.03000 4.51000 4.02000 2.87000 0.00000 0.00000 0.00000 0.42000 1.00000 0.00000 -0.24000 0.00000 -0.13000 0.00000 2.38000 67.00000 CYK3_1QCF-2_17.PDB 4.36216 -8.09000 -0.50000 -0.33000 -9.93000 -0.03000 7.02000 -14.52000 4.25000 3.69000 2.07000 0.00000 0.00000 0.00000 0.36000 0.94000 0.00000 -0.02000 0.00000 -0.14000 0.00000 2.38000 67.00000 CYK3_1QCF-2_18.PDB 4.54596 -8.10000 -0.53000 -0.33000 -9.45000 0.04000 6.37000 -13.99000 4.24000 3.15000 2.18000 0.00000 0.00000 0.00000 0.37000 0.90000 0.00000 -0.09000 0.00000 -0.07000 0.00000 2.38000 67.00000 CYK3_1QCF-2_19.PDB 5.19397 -6.37000 -0.46000 -0.29000 -9.22000 -0.05000 6.48000 -13.25000 4.43000 3.01000 2.79000 0.00000 0.00000 0.00000 0.50000 0.91000 0.00000 -0.09000 0.00000 -0.22000 0.00000 2.38000 67.00000 CYK3_1QCF-2_20.PDB 4.86289 -6.34000 -1.03000 -0.83000 -9.72000 0.01000 7.77000 -13.46000 4.15000 3.76000 3.15000 0.00000 0.00000 0.00000 0.35000 1.00000 0.00000 -0.37000 0.00000 -0.11000 0.00000 2.38000 67.00000 CYK3_1QCF-2_21.PDB 5.06734 -6.40000 -0.49000 -0.28000 -9.18000 -0.00000 6.84000 -13.29000 4.47000 3.01000 2.32000 0.00000 0.00000 0.00000 0.47000 0.88000 0.00000 -0.17000 0.00000 -0.11000 0.00000 2.38000 67.00000 CYK3_1QCF-2_22.PDB 4.52168 -8.73000 -0.51000 -0.34000 -9.91000 -0.04000 6.91000 -14.60000 4.14000 3.55000 2.02000 0.00000 0.00000 0.00000 0.32000 1.02000 0.00000 -0.06000 0.00000 -0.21000 0.00000 2.38000 67.00000 CYK3_1QCF-2_23.PDB 4.43480 -8.48000 -0.50000 -0.36000 -10.05000 -0.00000 7.13000 -14.77000 5.19000 2.91000 2.10000 0.00000 0.00000 0.00000 0.12000 0.98000 0.00000 -0.13000 0.00000 -0.12000 0.00000 2.38000 67.00000 CYK3_1QCF-2_24.PDB 5.93028 -8.14000 -0.19000 0.00000 -9.55000 0.06000 6.55000 -13.91000 3.97000 3.05000 1.92000 0.00000 0.00000 0.00000 0.23000 0.86000 0.00000 -0.21000 0.00000 -0.07000 0.00000 2.38000 67.00000 CYK3_1QCF-2_25.PDB 5.65866 -8.72000 -0.20000 -0.00000 -9.91000 0.13000 6.56000 -14.69000 4.07000 3.35000 2.02000 0.00000 0.00000 0.00000 0.11000 1.07000 0.00000 -0.15000 0.00000 0.01000 0.00000 2.38000 67.00000 CYK3_1QCF-2_26.PDB 6.51185 -9.20000 -0.22000 -0.03000 -9.89000 0.07000 6.44000 -14.64000 3.97000 3.38000 1.95000 0.00000 0.00000 0.00000 0.13000 1.07000 0.00000 -0.24000 0.00000 -0.11000 0.00000 2.38000 67.00000 CYK3_1QCF-2_27.PDB 5.07556 -7.68000 -0.79000 -0.57000 -10.06000 -0.04000 7.88000 -14.08000 2.48000 4.62000 2.95000 0.00000 0.00000 0.00000 0.34000 0.95000 0.00000 -0.24000 0.00000 -0.17000 0.00000 2.38000 67.00000 CYK3_1QCF-2_28.PDB 6.38175 -8.86000 -0.20000 -0.03000 -9.97000 -0.08000 6.59000 -14.78000 4.11000 3.43000 2.29000 0.00000 0.00000 0.00000 0.24000 1.12000 0.00000 -0.21000 0.00000 -0.25000 0.00000 2.38000 67.00000 CYK3_1QCF-2_29.PDB 4.30666 -6.77000 -0.51000 -0.34000 -9.27000 0.03000 6.86000 -13.47000 4.12000 3.22000 2.62000 0.00000 0.00000 0.00000 0.25000 0.88000 0.00000 -0.20000 0.00000 -0.07000 0.00000 2.38000 67.00000 CYK3_1QCF-2_30.PDB 5.55562 -6.34000 -1.09000 -0.91000 -9.58000 0.00000 7.74000 -13.26000 4.18000 3.75000 2.64000 0.00000 0.00000 0.00000 0.49000 1.03000 0.00000 -0.18000 0.00000 -0.12000 0.00000 2.38000 67.00000