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 1AYC2_1.PDB 4.44771 -16.43000 -5.29000 -7.24000 -11.73000 -4.03000 17.49000 -14.51000 0.65000 5.92000 5.92000 0.00000 0.00000 0.00000 0.39000 1.72000 -1.25000 -0.61000 0.00000 -2.14000 0.00000 2.38000 107.00000 1AYC2_2.PDB 5.59910 -16.13000 -5.13000 -6.61000 -11.82000 -4.03000 17.22000 -14.84000 1.35000 5.87000 5.63000 0.00000 0.00000 0.00000 0.23000 1.48000 -1.19000 -0.63000 0.00000 -2.17000 0.00000 2.38000 107.00000 1AYC2_3.PDB 5.17599 -16.51000 -5.29000 -7.29000 -11.57000 -3.83000 17.51000 -14.06000 0.66000 6.09000 5.75000 0.00000 0.00000 0.00000 0.24000 1.62000 -1.20000 -1.46000 0.00000 -2.07000 0.00000 2.38000 107.00000 1AYC2_4.PDB 6.39753 -17.98000 -5.69000 -8.35000 -11.32000 -4.05000 17.25000 -13.96000 1.04000 5.47000 5.40000 0.00000 0.00000 0.00000 0.30000 1.76000 -1.17000 -0.73000 0.00000 -2.18000 0.00000 2.38000 107.00000 1AYC2_5.PDB 5.69186 -16.81000 -5.75000 -8.84000 -12.22000 -4.04000 19.27000 -14.91000 1.35000 6.28000 6.34000 0.00000 0.00000 0.00000 0.26000 1.72000 -1.26000 -0.99000 0.00000 -2.30000 0.00000 2.38000 107.00000 1AYC2_6.PDB 4.57014 -14.83000 -5.12000 -7.16000 -12.02000 -4.01000 17.37000 -15.04000 2.61000 6.25000 6.08000 0.00000 0.00000 0.00000 0.36000 1.83000 -1.26000 -0.76000 0.00000 -2.14000 0.00000 2.38000 107.00000 1AYC2_7.PDB 5.16103 -14.83000 -5.60000 -8.12000 -12.07000 -3.79000 17.91000 -15.04000 2.54000 6.50000 6.33000 0.00000 0.00000 0.00000 0.30000 1.77000 -1.13000 -0.57000 0.00000 -2.09000 0.00000 2.38000 107.00000 1AYC2_8.PDB 5.66018 -16.52000 -5.99000 -6.87000 -12.12000 -3.77000 18.28000 -15.17000 1.00000 5.71000 6.85000 0.00000 0.00000 0.00000 0.14000 1.72000 -1.21000 -1.32000 0.00000 -2.05000 0.00000 2.38000 107.00000 1AYC2_9.PDB 4.70625 -15.99000 -5.32000 -7.43000 -12.10000 -3.87000 17.47000 -15.30000 1.75000 6.51000 6.03000 0.00000 0.00000 0.00000 0.33000 1.80000 -1.22000 -0.72000 0.00000 -2.10000 0.00000 2.38000 107.00000 1AYC2_10.PDB 4.62446 -14.72000 -5.22000 -6.95000 -12.22000 -3.96000 18.36000 -15.13000 2.59000 5.91000 6.06000 0.00000 0.00000 0.00000 0.25000 1.64000 -1.24000 -0.97000 0.00000 -2.18000 0.00000 2.38000 107.00000 1AYC2_11.PDB 5.62266 -18.00000 -5.98000 -7.55000 -11.46000 -3.52000 17.49000 -14.27000 1.09000 4.89000 5.73000 0.00000 0.00000 0.00000 0.18000 1.72000 -1.20000 -1.50000 0.00000 -1.91000 0.00000 2.38000 107.00000 1AYC2_12.PDB 5.61098 -17.83000 -5.72000 -8.06000 -12.01000 -3.72000 17.76000 -15.35000 0.87000 6.06000 5.99000 0.00000 0.00000 0.00000 0.31000 1.64000 -1.20000 -0.69000 0.00000 -2.07000 0.00000 2.38000 107.00000 1AYC2_13.PDB 6.48610 -17.23000 -5.89000 -8.27000 -11.90000 -3.91000 18.03000 -14.90000 1.35000 5.83000 5.99000 0.00000 0.00000 0.00000 0.23000 1.70000 -1.17000 -0.54000 0.00000 -2.09000 0.00000 2.38000 107.00000 1AYC2_14.PDB 5.17859 -15.04000 -5.73000 -5.85000 -12.16000 -4.03000 18.17000 -15.47000 1.26000 6.12000 6.58000 0.00000 0.00000 0.00000 0.38000 1.61000 -1.20000 -0.86000 0.00000 -2.25000 0.00000 2.38000 107.00000 1AYC2_15.PDB 4.57414 -14.72000 -5.07000 -7.52000 -11.94000 -3.86000 17.58000 -14.92000 2.40000 6.26000 5.84000 0.00000 0.00000 0.00000 0.26000 1.79000 -1.17000 -0.59000 0.00000 -1.99000 0.00000 2.38000 107.00000 1AYC2_16.PDB 4.91379 -17.47000 -5.03000 -8.43000 -12.09000 -3.93000 18.05000 -14.93000 0.61000 6.44000 6.08000 0.00000 0.00000 0.00000 0.26000 1.75000 -1.22000 -1.23000 0.00000 -2.04000 0.00000 2.38000 107.00000 1AYC2_17.PDB 6.13227 -19.04000 -5.98000 -8.44000 -11.62000 -4.54000 18.40000 -14.08000 1.02000 4.98000 5.77000 0.00000 0.00000 0.00000 0.29000 1.80000 -1.21000 -1.20000 0.00000 -2.44000 0.00000 2.38000 107.00000 1AYC2_18.PDB 5.49473 -13.82000 -5.43000 -4.05000 -11.42000 -4.22000 16.62000 -14.22000 1.52000 5.77000 5.47000 0.00000 0.00000 0.00000 0.25000 1.67000 -1.29000 -0.67000 0.00000 -2.17000 0.00000 2.38000 107.00000 1AYC2_19.PDB 5.23154 -16.28000 -5.31000 -7.77000 -12.20000 -3.84000 17.76000 -15.28000 1.54000 6.32000 5.86000 0.00000 0.00000 0.00000 0.25000 1.63000 -1.24000 -0.30000 0.00000 -2.09000 0.00000 2.38000 107.00000 1AYC2_20.PDB 6.00580 -16.49000 -5.32000 -8.28000 -12.19000 -3.49000 17.81000 -15.14000 1.46000 6.39000 5.41000 0.00000 0.00000 0.00000 0.28000 1.79000 -1.20000 -0.27000 0.00000 -1.95000 0.00000 2.38000 107.00000 1AYC2_21.PDB 5.51169 -15.00000 -4.88000 -7.24000 -11.76000 -3.79000 17.65000 -14.62000 1.22000 6.16000 5.77000 0.00000 0.00000 0.00000 0.23000 1.65000 -1.13000 -0.47000 0.00000 -2.13000 0.00000 2.38000 107.00000 1AYC2_22.PDB 5.45860 -17.25000 -5.07000 -8.04000 -11.95000 -3.97000 17.95000 -14.87000 0.96000 6.45000 5.49000 0.00000 0.00000 0.00000 0.31000 1.78000 -1.18000 -1.16000 0.00000 -2.15000 0.00000 2.38000 107.00000 1AYC2_23.PDB 5.62032 -17.39000 -5.50000 -8.00000 -11.79000 -3.84000 17.73000 -14.86000 0.94000 5.78000 5.77000 0.00000 0.00000 0.00000 0.30000 1.82000 -1.14000 -0.61000 0.00000 -2.17000 0.00000 2.38000 107.00000 1AYC2_24.PDB 4.54070 -14.21000 -5.72000 -7.68000 -11.57000 -4.05000 18.04000 -14.13000 4.10000 5.52000 5.46000 0.00000 0.00000 0.00000 0.25000 1.67000 -1.29000 -1.05000 0.00000 -2.08000 0.00000 2.38000 107.00000 1AYC2_25.PDB 6.63960 -14.03000 -5.31000 -7.52000 -12.04000 -3.53000 18.31000 -14.77000 2.87000 6.35000 5.37000 0.00000 0.00000 0.00000 0.28000 1.81000 -1.21000 -0.87000 0.00000 -1.94000 0.00000 2.38000 107.00000 1AYC2_26.PDB 5.51342 -17.50000 -5.87000 -7.83000 -12.04000 -3.60000 18.20000 -14.72000 1.94000 5.48000 5.47000 0.00000 0.00000 0.00000 0.24000 1.95000 -1.18000 -1.44000 0.00000 -2.14000 0.00000 2.38000 107.00000 1AYC2_27.PDB 5.15951 -13.98000 -5.18000 -9.14000 -10.40000 -3.62000 18.04000 -11.78000 1.60000 4.97000 5.68000 0.00000 0.00000 0.00000 0.23000 1.62000 -1.14000 -1.22000 0.00000 -2.01000 0.00000 2.38000 107.00000 1AYC2_28.PDB 5.43184 -16.48000 -5.34000 -5.88000 -12.14000 -3.34000 16.84000 -15.18000 1.50000 5.68000 5.50000 0.00000 0.00000 0.00000 0.33000 1.78000 -1.20000 -1.24000 0.00000 -2.01000 0.00000 2.38000 107.00000 1AYC2_29.PDB 5.59033 -12.90000 -5.07000 -5.63000 -10.64000 -4.18000 18.05000 -12.41000 0.79000 5.41000 5.56000 0.00000 0.00000 0.00000 0.29000 1.66000 -1.26000 -1.15000 0.00000 -2.65000 0.00000 2.38000 107.00000 1AYC2_30.PDB 6.95410 -16.79000 -5.94000 -7.33000 -11.99000 -3.76000 18.35000 -14.53000 2.03000 5.43000 5.27000 0.00000 0.00000 0.00000 0.22000 1.96000 -1.15000 -1.21000 0.00000 -2.18000 0.00000 2.38000 107.00000