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-19_1.PDB 3.90340 -6.86000 -1.75000 -1.65000 -8.19000 0.01000 7.13000 -11.13000 0.94000 3.68000 4.46000 0.00000 0.00000 0.00000 0.11000 0.19000 0.00000 -0.41000 0.00000 -0.06000 0.00000 2.38000 66.00000 CYK3_1QCF-19_2.PDB 4.44632 -6.60000 -2.14000 -2.05000 -8.49000 0.03000 7.69000 -11.54000 1.02000 4.23000 4.66000 0.00000 0.00000 0.00000 0.32000 0.35000 0.00000 -0.28000 0.00000 -0.04000 0.00000 2.38000 66.00000 CYK3_1QCF-19_3.PDB 4.18238 -6.34000 -2.13000 -2.06000 -8.08000 0.04000 7.48000 -10.83000 1.09000 3.64000 4.66000 0.00000 0.00000 0.00000 0.14000 0.18000 0.00000 -0.25000 0.00000 -0.03000 0.00000 2.38000 66.00000 CYK3_1QCF-19_4.PDB 4.28361 -6.10000 -2.09000 -2.03000 -8.14000 0.03000 7.53000 -10.99000 1.11000 3.90000 4.79000 0.00000 0.00000 0.00000 0.10000 0.21000 0.00000 -0.27000 0.00000 -0.05000 0.00000 2.38000 66.00000 CYK3_1QCF-19_5.PDB 3.79096 -5.56000 -1.28000 -1.15000 -7.76000 -0.05000 5.90000 -10.90000 2.76000 2.91000 4.32000 0.00000 0.00000 0.00000 0.09000 0.11000 0.00000 -0.21000 0.00000 -0.18000 0.00000 2.38000 66.00000 CYK3_1QCF-19_6.PDB 4.16668 -6.14000 -2.15000 -2.16000 -7.96000 0.03000 7.56000 -10.67000 1.09000 3.63000 4.55000 0.00000 0.00000 0.00000 0.12000 0.21000 0.00000 -0.15000 0.00000 -0.04000 0.00000 2.38000 66.00000 CYK3_1QCF-19_7.PDB 3.93541 -6.67000 -2.36000 -2.25000 -8.62000 0.04000 8.17000 -11.27000 1.17000 3.99000 4.82000 0.00000 0.00000 0.00000 0.09000 0.30000 0.00000 -0.40000 0.00000 -0.05000 0.00000 2.38000 66.00000 CYK3_1QCF-19_8.PDB 4.12072 -7.45000 -1.31000 -1.23000 -8.56000 -0.05000 6.79000 -12.02000 1.06000 3.32000 4.94000 0.00000 0.00000 0.00000 0.19000 0.28000 0.00000 -0.39000 0.00000 -0.18000 0.00000 2.38000 66.00000 CYK3_1QCF-19_9.PDB 4.25123 -5.73000 -1.27000 -1.17000 -7.42000 -0.05000 6.34000 -10.17000 1.17000 2.74000 4.43000 0.00000 0.00000 0.00000 0.11000 0.14000 0.00000 -0.30000 0.00000 -0.15000 0.00000 2.38000 66.00000 CYK3_1QCF-19_10.PDB 3.74406 -5.10000 -1.26000 -1.15000 -7.67000 -0.08000 6.02000 -10.64000 2.86000 2.93000 4.04000 0.00000 0.00000 0.00000 0.10000 0.14000 0.00000 -0.05000 0.00000 -0.21000 0.00000 2.38000 66.00000 CYK3_1QCF-19_11.PDB 4.10536 -5.48000 -1.25000 -1.15000 -8.07000 -0.08000 6.21000 -11.22000 2.88000 2.87000 4.68000 0.00000 0.00000 0.00000 0.13000 0.17000 0.00000 -0.28000 0.00000 -0.20000 0.00000 2.38000 66.00000 CYK3_1QCF-19_12.PDB 3.99154 -5.50000 -1.89000 -1.78000 -7.46000 0.04000 7.13000 -9.84000 0.93000 3.34000 4.16000 0.00000 0.00000 0.00000 0.11000 0.18000 0.00000 -0.19000 0.00000 -0.04000 0.00000 2.38000 66.00000 CYK3_1QCF-19_13.PDB 3.77933 -6.24000 -1.72000 -1.60000 -7.72000 -0.07000 7.01000 -10.31000 0.87000 3.25000 4.15000 0.00000 0.00000 0.00000 0.11000 0.26000 0.00000 -0.08000 0.00000 -0.14000 0.00000 2.38000 66.00000 CYK3_1QCF-19_14.PDB 3.87276 -7.18000 -1.28000 -1.15000 -7.78000 -0.13000 6.26000 -10.73000 0.97000 2.80000 4.63000 0.00000 0.00000 0.00000 0.11000 0.13000 0.00000 -0.60000 0.00000 -0.28000 0.00000 2.38000 66.00000 CYK3_1QCF-19_15.PDB 4.48346 -6.78000 -1.26000 -1.15000 -8.02000 -0.09000 5.97000 -11.50000 2.20000 3.06000 4.57000 0.00000 0.00000 0.00000 0.12000 0.22000 0.00000 -0.45000 0.00000 -0.21000 0.00000 2.38000 66.00000 CYK3_1QCF-19_16.PDB 3.86213 -3.54000 -1.25000 -1.15000 -6.67000 -0.07000 5.58000 -9.09000 3.35000 2.27000 3.78000 0.00000 0.00000 0.00000 0.11000 0.10000 0.00000 -0.19000 0.00000 -0.20000 0.00000 2.38000 66.00000 CYK3_1QCF-19_17.PDB 4.10952 -6.84000 -1.25000 -1.15000 -8.09000 -0.04000 6.58000 -11.15000 0.93000 3.10000 4.52000 0.00000 0.00000 0.00000 0.10000 0.13000 0.00000 -0.26000 0.00000 -0.15000 0.00000 2.38000 66.00000 CYK3_1QCF-19_18.PDB 4.07804 -7.77000 -1.95000 -1.87000 -8.95000 -0.07000 7.49000 -12.27000 1.10000 4.16000 5.09000 0.00000 0.00000 0.00000 0.18000 0.31000 0.00000 -0.48000 0.00000 -0.18000 0.00000 2.38000 66.00000 CYK3_1QCF-19_19.PDB 3.87877 -6.75000 -1.27000 -1.20000 -8.18000 -0.06000 6.73000 -11.26000 1.04000 2.88000 4.79000 0.00000 0.00000 0.00000 0.17000 0.35000 0.00000 -0.21000 0.00000 -0.18000 0.00000 2.38000 66.00000 CYK3_1QCF-19_20.PDB 3.97247 -5.39000 -1.87000 -1.80000 -8.42000 -0.12000 7.01000 -11.41000 3.40000 3.64000 4.72000 0.00000 0.00000 0.00000 0.10000 0.20000 0.00000 -0.41000 0.00000 -0.23000 0.00000 2.38000 66.00000 CYK3_1QCF-19_21.PDB 4.34033 -6.79000 -1.31000 -1.22000 -8.37000 -0.07000 6.77000 -11.78000 1.19000 3.23000 5.23000 0.00000 0.00000 0.00000 0.15000 0.29000 0.00000 -0.41000 0.00000 -0.18000 0.00000 2.38000 66.00000 CYK3_1QCF-19_22.PDB 3.87874 -6.53000 -1.28000 -1.15000 -7.73000 -0.14000 6.40000 -10.50000 0.99000 2.58000 4.87000 0.00000 0.00000 0.00000 0.11000 0.17000 0.00000 -0.41000 0.00000 -0.28000 0.00000 2.38000 66.00000 CYK3_1QCF-19_23.PDB 4.00178 -7.30000 -1.84000 -1.74000 -7.82000 -0.14000 6.71000 -10.48000 0.97000 3.39000 4.50000 0.00000 0.00000 0.00000 0.11000 0.14000 0.00000 -0.68000 0.00000 -0.28000 0.00000 2.38000 66.00000 CYK3_1QCF-19_24.PDB 4.06836 -6.02000 -1.77000 -1.64000 -7.97000 -0.04000 7.35000 -10.53000 1.23000 3.17000 4.44000 0.00000 0.00000 0.00000 0.11000 0.25000 0.00000 -0.26000 0.00000 -0.10000 0.00000 2.38000 66.00000 CYK3_1QCF-19_25.PDB 4.12223 -4.37000 -1.25000 -1.15000 -7.43000 -0.08000 5.85000 -10.37000 3.31000 2.80000 4.18000 0.00000 0.00000 0.00000 0.11000 0.17000 0.00000 -0.14000 0.00000 -0.20000 0.00000 2.38000 66.00000 CYK3_1QCF-19_26.PDB 4.12868 -6.86000 -1.89000 -1.80000 -8.20000 -0.05000 6.77000 -11.33000 1.14000 3.55000 5.61000 0.00000 0.00000 0.00000 0.16000 0.28000 0.00000 -0.63000 0.00000 -0.18000 0.00000 2.38000 66.00000 CYK3_1QCF-19_27.PDB 4.58039 -6.40000 -1.28000 -1.15000 -7.48000 -0.14000 6.19000 -10.27000 1.03000 2.65000 4.77000 0.00000 0.00000 0.00000 0.12000 0.16000 0.00000 -0.56000 0.00000 -0.28000 0.00000 2.38000 66.00000 CYK3_1QCF-19_28.PDB 4.46586 -5.75000 -1.79000 -1.68000 -7.51000 -0.06000 6.97000 -10.04000 1.05000 3.17000 4.26000 0.00000 0.00000 0.00000 0.12000 0.22000 0.00000 -0.11000 0.00000 -0.13000 0.00000 2.38000 66.00000 CYK3_1QCF-19_29.PDB 4.14812 -4.58000 -2.49000 -2.41000 -7.59000 -0.12000 6.51000 -10.19000 3.23000 3.93000 4.84000 0.00000 0.00000 0.00000 0.12000 0.12000 0.00000 -0.18000 0.00000 -0.23000 0.00000 2.38000 66.00000 CYK3_1QCF-19_30.PDB 5.66720 -6.79000 -1.87000 -3.16000 -8.74000 -0.24000 7.11000 -11.57000 2.75000 4.71000 4.49000 0.00000 0.00000 0.00000 0.17000 0.27000 0.00000 -0.15000 0.00000 -0.31000 0.00000 2.38000 66.00000