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 YSC84_2A08-18_1.PDB 3.02003 -7.13000 -1.74000 -1.78000 -8.19000 -0.96000 8.31000 -10.37000 1.45000 4.32000 2.94000 0.00000 0.00000 0.00000 0.04000 0.85000 0.00000 -0.63000 0.00000 -0.51000 0.00000 2.38000 67.00000 YSC84_2A08-18_2.PDB 3.10087 -7.72000 -1.67000 -1.78000 -8.23000 -1.09000 8.24000 -10.51000 1.42000 4.23000 2.88000 0.00000 0.00000 0.00000 0.04000 0.80000 0.00000 -0.69000 0.00000 -0.56000 0.00000 2.38000 67.00000 YSC84_2A08-18_3.PDB 1.13140 -8.05000 -1.70000 -1.79000 -8.34000 -0.92000 8.48000 -10.49000 1.44000 3.64000 2.87000 0.00000 0.00000 0.00000 0.08000 0.80000 0.00000 -0.67000 0.00000 -0.63000 0.00000 2.38000 67.00000 YSC84_2A08-18_4.PDB 3.16007 -7.28000 -1.74000 -1.78000 -8.28000 -0.88000 8.34000 -10.56000 1.43000 4.26000 2.91000 0.00000 0.00000 0.00000 0.05000 0.76000 0.00000 -0.55000 0.00000 -0.48000 0.00000 2.38000 67.00000 YSC84_2A08-18_5.PDB 1.76732 -6.59000 -1.53000 -1.60000 -8.03000 -0.76000 7.91000 -10.40000 1.50000 4.22000 2.96000 0.00000 0.00000 0.00000 0.03000 0.69000 0.00000 -0.44000 0.00000 -0.46000 0.00000 2.38000 67.00000 YSC84_2A08-18_6.PDB 3.06507 -7.58000 -1.68000 -1.76000 -8.41000 -0.87000 8.56000 -10.58000 1.43000 3.82000 3.15000 0.00000 0.00000 0.00000 0.06000 0.81000 0.00000 -0.75000 0.00000 -0.55000 0.00000 2.38000 67.00000 YSC84_2A08-18_7.PDB 3.05862 -5.59000 -0.72000 -0.70000 -7.67000 -0.37000 6.60000 -10.29000 1.42000 3.95000 2.93000 0.00000 0.00000 0.00000 0.01000 0.63000 0.00000 -0.46000 0.00000 -0.29000 0.00000 2.38000 67.00000 YSC84_2A08-18_8.PDB 2.99924 -7.71000 -1.73000 -1.75000 -8.29000 -0.74000 8.18000 -10.64000 1.42000 3.82000 3.04000 0.00000 0.00000 0.00000 0.04000 0.84000 0.00000 -0.54000 0.00000 -0.51000 0.00000 2.38000 67.00000 YSC84_2A08-18_9.PDB 3.00890 -6.75000 -1.62000 -1.66000 -7.85000 -1.00000 8.00000 -9.95000 1.44000 4.25000 2.80000 0.00000 0.00000 0.00000 0.04000 0.69000 0.00000 -0.49000 0.00000 -0.70000 0.00000 2.38000 67.00000 YSC84_2A08-18_10.PDB 2.99440 -5.38000 -0.03000 -0.02000 -7.07000 -0.23000 5.69000 -9.82000 1.37000 2.66000 2.76000 0.00000 0.00000 0.00000 0.01000 0.55000 0.00000 -0.46000 0.00000 -0.24000 0.00000 2.38000 67.00000 YSC84_2A08-18_11.PDB 3.02231 -7.37000 -1.74000 -1.78000 -7.85000 -1.05000 7.80000 -10.05000 1.42000 4.31000 2.75000 0.00000 0.00000 0.00000 0.04000 0.65000 0.00000 -0.48000 0.00000 -0.74000 0.00000 2.38000 67.00000 YSC84_2A08-18_12.PDB 3.27149 -7.86000 -1.65000 -5.15000 -8.51000 -0.89000 9.27000 -10.62000 1.44000 6.30000 3.10000 0.00000 0.00000 0.00000 0.04000 0.81000 0.00000 -0.60000 0.00000 -0.59000 0.00000 2.38000 67.00000 YSC84_2A08-18_13.PDB 1.00132 -6.76000 -1.43000 -1.45000 -8.16000 -0.59000 8.08000 -10.47000 1.41000 3.78000 2.93000 0.00000 0.00000 0.00000 0.05000 0.73000 0.00000 -0.47000 0.00000 -0.44000 0.00000 2.38000 67.00000 YSC84_2A08-18_14.PDB 1.07277 -7.52000 -1.72000 -1.77000 -8.26000 -0.72000 8.08000 -10.62000 1.42000 4.13000 3.00000 0.00000 0.00000 0.00000 0.06000 0.78000 0.00000 -0.60000 0.00000 -0.51000 0.00000 2.38000 67.00000 YSC84_2A08-18_15.PDB 0.86917 -5.66000 -0.02000 -0.02000 -7.06000 -0.22000 5.63000 -9.86000 1.37000 2.58000 2.68000 0.00000 0.00000 0.00000 0.01000 0.48000 0.00000 -0.54000 0.00000 -0.20000 0.00000 2.38000 67.00000 YSC84_2A08-18_16.PDB 1.04048 -8.21000 -1.65000 -1.74000 -8.46000 -1.06000 8.68000 -10.57000 1.43000 3.60000 2.94000 0.00000 0.00000 0.00000 0.06000 0.73000 0.00000 -0.78000 0.00000 -0.67000 0.00000 2.38000 67.00000 YSC84_2A08-18_17.PDB 3.09246 -4.88000 -0.01000 0.00000 -7.61000 -0.28000 6.65000 -10.20000 1.39000 3.13000 2.75000 0.00000 0.00000 0.00000 0.01000 0.51000 0.00000 -0.46000 0.00000 -0.24000 0.00000 2.38000 67.00000 YSC84_2A08-18_18.PDB 3.24386 -5.49000 -0.79000 -0.79000 -7.83000 -0.48000 7.05000 -10.34000 1.43000 4.13000 2.89000 0.00000 0.00000 0.00000 0.02000 0.59000 0.00000 -0.47000 0.00000 -0.32000 0.00000 2.38000 67.00000 YSC84_2A08-18_19.PDB 3.38262 -7.32000 -1.41000 -1.53000 -8.26000 -1.60000 8.52000 -10.30000 1.38000 4.62000 2.76000 0.00000 0.00000 0.00000 0.16000 0.73000 0.00000 -0.65000 0.00000 -1.00000 0.00000 2.38000 67.00000 YSC84_2A08-18_20.PDB 3.30339 -8.38000 -1.73000 -1.80000 -8.08000 -1.13000 7.97000 -10.29000 1.45000 3.92000 2.76000 0.00000 0.00000 0.00000 0.05000 0.70000 0.00000 -0.49000 0.00000 -1.00000 0.00000 2.38000 67.00000 YSC84_2A08-18_21.PDB 3.07583 -6.03000 -0.02000 -0.02000 -6.42000 -0.21000 4.95000 -9.12000 1.23000 2.15000 2.16000 0.00000 0.00000 0.00000 0.01000 0.36000 0.00000 -0.53000 0.00000 -0.21000 0.00000 2.38000 67.00000 YSC84_2A08-18_22.PDB 3.04318 -9.25000 -1.69000 -1.76000 -7.73000 -0.94000 7.43000 -10.07000 1.30000 3.19000 2.13000 0.00000 0.00000 0.00000 0.06000 0.71000 0.00000 -0.58000 0.00000 -0.60000 0.00000 2.38000 67.00000 YSC84_2A08-18_23.PDB 1.28457 -6.84000 -1.17000 -1.29000 -8.17000 -1.46000 8.20000 -10.15000 1.38000 4.35000 2.77000 0.00000 0.00000 0.00000 0.14000 0.69000 0.00000 -0.60000 0.00000 -0.83000 0.00000 2.38000 67.00000 YSC84_2A08-18_24.PDB 0.91736 -6.34000 -0.90000 -4.33000 -7.95000 -0.75000 8.02000 -10.11000 1.38000 6.28000 3.10000 0.00000 0.00000 0.00000 0.02000 0.63000 0.00000 -0.43000 0.00000 -0.66000 0.00000 2.38000 67.00000 YSC84_2A08-18_25.PDB 3.20120 -7.25000 -1.45000 -1.55000 -8.38000 -1.46000 8.67000 -10.40000 1.45000 4.48000 2.69000 0.00000 0.00000 0.00000 0.14000 0.70000 0.00000 -0.62000 0.00000 -0.83000 0.00000 2.38000 67.00000 YSC84_2A08-18_26.PDB 3.51986 -7.07000 -1.20000 -1.33000 -8.33000 -1.43000 8.33000 -10.34000 1.37000 4.52000 2.97000 0.00000 0.00000 0.00000 0.20000 0.74000 0.00000 -1.04000 0.00000 -0.79000 0.00000 2.38000 67.00000 YSC84_2A08-18_27.PDB 0.94783 -5.05000 -0.02000 -0.02000 -7.02000 -0.20000 5.83000 -9.63000 1.35000 2.63000 2.64000 0.00000 0.00000 0.00000 0.02000 0.48000 0.00000 -0.44000 0.00000 -0.19000 0.00000 2.38000 67.00000 YSC84_2A08-18_28.PDB 3.17564 -6.78000 -1.41000 -1.52000 -8.31000 -1.51000 8.36000 -10.46000 2.17000 4.50000 2.71000 0.00000 0.00000 0.00000 0.13000 0.73000 0.00000 -0.62000 0.00000 -0.82000 0.00000 2.38000 67.00000 YSC84_2A08-18_29.PDB 1.09769 -6.98000 -1.67000 -1.74000 -8.07000 -0.84000 7.97000 -10.41000 1.44000 4.39000 2.85000 0.00000 0.00000 0.00000 0.03000 0.70000 0.00000 -0.46000 0.00000 -0.48000 0.00000 2.38000 67.00000 YSC84_2A08-18_30.PDB 3.15120 -8.73000 -1.65000 -5.19000 -8.84000 -0.98000 9.73000 -10.85000 1.45000 5.66000 3.10000 0.00000 0.00000 0.00000 0.06000 0.77000 0.00000 -0.55000 0.00000 -0.67000 0.00000 2.38000 67.00000