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-14_1.PDB 4.55368 -6.43000 -0.35000 -0.37000 -8.95000 -0.16000 6.66000 -12.84000 3.43000 3.92000 2.20000 0.00000 0.00000 0.00000 0.26000 0.91000 0.00000 -0.22000 0.00000 -0.02000 0.00000 2.38000 66.00000 CYK3_1QCF-14_2.PDB 3.99272 -7.29000 -0.36000 -0.37000 -9.01000 -0.18000 6.55000 -13.03000 3.14000 3.91000 2.14000 0.00000 0.00000 0.00000 0.23000 1.08000 0.00000 -0.26000 0.00000 -0.05000 0.00000 2.38000 66.00000 CYK3_1QCF-14_3.PDB 5.28651 -6.89000 -0.51000 -2.15000 -9.03000 -0.13000 7.14000 -12.65000 3.16000 4.93000 2.29000 0.00000 0.00000 0.00000 0.33000 1.18000 0.00000 -0.26000 0.00000 0.01000 0.00000 2.38000 66.00000 CYK3_1QCF-14_4.PDB 3.97333 -8.11000 -0.33000 -0.43000 -9.30000 -0.31000 6.71000 -13.48000 2.87000 3.90000 2.35000 0.00000 0.00000 0.00000 0.22000 1.03000 0.00000 -0.21000 0.00000 -0.09000 0.00000 2.38000 66.00000 CYK3_1QCF-14_5.PDB 3.84821 -7.28000 -0.35000 -0.35000 -8.98000 -0.19000 6.61000 -12.99000 3.14000 3.84000 2.04000 0.00000 0.00000 0.00000 0.12000 1.08000 0.00000 -0.15000 0.00000 -0.04000 0.00000 2.38000 66.00000 CYK3_1QCF-14_6.PDB 3.50175 -8.74000 -0.40000 -0.39000 -9.44000 -0.25000 6.82000 -13.65000 2.89000 3.76000 2.06000 0.00000 0.00000 0.00000 0.09000 1.09000 0.00000 -0.20000 0.00000 -0.02000 0.00000 2.38000 66.00000 CYK3_1QCF-14_7.PDB 3.73227 -8.79000 -0.30000 -0.36000 -9.29000 -0.29000 6.71000 -13.40000 2.49000 3.80000 1.99000 0.00000 0.00000 0.00000 0.10000 0.98000 0.00000 -0.23000 0.00000 -0.03000 0.00000 2.38000 66.00000 CYK3_1QCF-14_8.PDB 4.47681 -7.04000 -0.40000 -0.41000 -9.48000 -0.22000 7.38000 -13.38000 3.21000 4.07000 2.12000 0.00000 0.00000 0.00000 0.33000 1.04000 0.00000 -0.24000 0.00000 -0.01000 0.00000 2.38000 66.00000 CYK3_1QCF-14_9.PDB 4.79721 -6.71000 -0.40000 -0.38000 -8.88000 -0.18000 6.62000 -12.74000 3.36000 3.76000 2.13000 0.00000 0.00000 0.00000 0.27000 1.07000 0.00000 -0.24000 0.00000 -0.04000 0.00000 2.38000 66.00000 CYK3_1QCF-14_10.PDB 4.02518 -7.59000 -0.38000 -0.55000 -9.18000 -0.28000 6.55000 -13.32000 3.44000 4.12000 2.26000 0.00000 0.00000 0.00000 0.25000 1.14000 0.00000 -0.35000 0.00000 -0.16000 0.00000 2.38000 66.00000 CYK3_1QCF-14_11.PDB 4.46889 -7.33000 -0.42000 -0.42000 -9.17000 -0.26000 6.89000 -13.14000 3.00000 3.87000 2.46000 0.00000 0.00000 0.00000 0.25000 1.02000 0.00000 -0.29000 0.00000 -0.10000 0.00000 2.38000 66.00000 CYK3_1QCF-14_12.PDB 5.19442 -7.38000 -0.40000 -2.04000 -8.85000 -0.10000 6.74000 -12.61000 2.83000 4.83000 2.19000 0.00000 0.00000 0.00000 0.30000 1.04000 0.00000 -0.29000 0.00000 0.02000 0.00000 2.38000 66.00000 CYK3_1QCF-14_13.PDB 3.94801 -8.56000 -0.35000 -0.40000 -9.48000 -0.28000 6.84000 -13.76000 2.66000 3.94000 2.28000 0.00000 0.00000 0.00000 0.25000 1.10000 0.00000 -0.20000 0.00000 -0.05000 0.00000 2.38000 66.00000 CYK3_1QCF-14_14.PDB 3.75442 -7.18000 -0.36000 -0.37000 -9.21000 -0.10000 6.98000 -13.07000 2.96000 3.88000 2.08000 0.00000 0.00000 0.00000 0.12000 1.15000 0.00000 -0.17000 0.00000 0.07000 0.00000 2.38000 66.00000 CYK3_1QCF-14_15.PDB 4.24441 -6.93000 -0.38000 -0.37000 -8.98000 -0.20000 6.81000 -12.88000 2.77000 3.95000 2.34000 0.00000 0.00000 0.00000 0.28000 1.00000 0.00000 -0.23000 0.00000 -0.05000 0.00000 2.38000 66.00000 CYK3_1QCF-14_16.PDB 3.23395 -8.47000 -0.35000 -0.38000 -9.23000 -0.31000 6.62000 -13.40000 2.83000 3.64000 2.27000 0.00000 0.00000 0.00000 0.10000 0.93000 0.00000 -0.15000 0.00000 -0.10000 0.00000 2.38000 66.00000 CYK3_1QCF-14_17.PDB 4.56606 -8.31000 -0.32000 -0.34000 -9.01000 -0.31000 6.32000 -13.15000 3.18000 3.44000 2.24000 0.00000 0.00000 0.00000 0.07000 1.03000 0.00000 -0.32000 0.00000 -0.09000 0.00000 2.38000 66.00000 CYK3_1QCF-14_18.PDB 4.34024 -7.45000 -0.36000 -0.41000 -9.25000 -0.12000 6.98000 -13.17000 2.84000 3.84000 2.17000 0.00000 0.00000 0.00000 0.15000 1.01000 0.00000 -0.16000 0.00000 0.05000 0.00000 2.38000 66.00000 CYK3_1QCF-14_19.PDB 4.47131 -6.64000 -0.35000 -0.35000 -8.62000 -0.12000 6.53000 -12.36000 2.87000 3.65000 2.16000 0.00000 0.00000 0.00000 0.16000 0.95000 0.00000 -0.17000 0.00000 -0.01000 0.00000 2.38000 66.00000 CYK3_1QCF-14_20.PDB 4.03416 -7.27000 -0.37000 -0.37000 -9.10000 -0.21000 6.72000 -13.15000 2.81000 4.05000 2.33000 0.00000 0.00000 0.00000 0.27000 1.00000 0.00000 -0.20000 0.00000 -0.05000 0.00000 2.38000 66.00000 CYK3_1QCF-14_21.PDB 3.11106 -8.67000 -0.33000 -0.40000 -9.22000 -0.31000 6.66000 -13.36000 2.40000 3.77000 2.24000 0.00000 0.00000 0.00000 0.12000 0.92000 0.00000 -0.15000 0.00000 -0.10000 0.00000 2.38000 66.00000 CYK3_1QCF-14_22.PDB 3.66376 -8.80000 -0.37000 -0.59000 -9.42000 -0.29000 6.78000 -13.63000 2.57000 4.08000 2.06000 0.00000 0.00000 0.00000 0.23000 1.07000 0.00000 -0.12000 0.00000 -0.10000 0.00000 2.38000 66.00000 CYK3_1QCF-14_23.PDB 5.10540 -7.29000 -0.38000 -0.54000 -8.89000 -0.21000 6.56000 -12.73000 2.97000 3.89000 2.05000 0.00000 0.00000 0.00000 0.29000 1.09000 0.00000 -0.20000 0.00000 -0.10000 0.00000 2.38000 66.00000 CYK3_1QCF-14_24.PDB 5.18779 -7.19000 -0.40000 -0.55000 -8.96000 -0.23000 6.55000 -12.84000 3.32000 3.87000 2.07000 0.00000 0.00000 0.00000 0.28000 1.09000 0.00000 -0.20000 0.00000 -0.11000 0.00000 2.38000 66.00000 CYK3_1QCF-14_25.PDB 4.05542 -7.73000 -0.38000 -0.36000 -9.07000 -0.21000 6.68000 -13.07000 2.80000 3.77000 2.24000 0.00000 0.00000 0.00000 0.12000 1.01000 0.00000 -0.21000 0.00000 -0.05000 0.00000 2.38000 66.00000 CYK3_1QCF-14_26.PDB 3.67919 -8.77000 -0.35000 -0.41000 -9.37000 -0.25000 6.75000 -13.56000 2.62000 3.83000 2.03000 0.00000 0.00000 0.00000 0.11000 1.03000 0.00000 -0.16000 0.00000 -0.00000 0.00000 2.38000 66.00000 CYK3_1QCF-14_27.PDB 3.85516 -7.96000 -0.34000 -0.37000 -9.36000 -0.19000 6.79000 -13.54000 3.23000 3.80000 2.07000 0.00000 0.00000 0.00000 0.09000 1.10000 0.00000 -0.16000 0.00000 0.02000 0.00000 2.38000 66.00000 CYK3_1QCF-14_28.PDB 4.52322 -8.99000 -0.35000 -0.35000 -9.17000 -0.31000 6.38000 -13.38000 2.76000 3.46000 2.17000 0.00000 0.00000 0.00000 0.08000 1.09000 0.00000 -0.23000 0.00000 -0.05000 0.00000 2.38000 66.00000 CYK3_1QCF-14_29.PDB 4.34507 -5.95000 -0.41000 -0.37000 -9.52000 0.07000 7.74000 -13.09000 3.42000 4.02000 2.07000 0.00000 0.00000 0.00000 0.16000 1.15000 0.00000 -0.23000 0.00000 0.19000 0.00000 2.38000 66.00000 CYK3_1QCF-14_30.PDB 4.54816 -9.12000 -0.33000 -0.73000 -9.43000 -0.22000 6.74000 -13.60000 2.48000 3.90000 2.06000 0.00000 0.00000 0.00000 0.16000 1.07000 0.00000 -0.15000 0.00000 -0.00000 0.00000 2.38000 66.00000