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 2HE22_1.PDB 1.34644 -14.86000 -8.82000 -4.77000 -9.92000 -1.06000 16.14000 -12.41000 0.17000 4.03000 2.90000 0.00000 0.00000 0.00000 0.03000 1.30000 0.02000 -0.77000 0.00000 -0.37000 0.00000 2.38000 101.00000 2HE22_2.PDB 1.37831 -15.83000 -8.90000 -6.49000 -10.05000 -1.31000 16.65000 -12.44000 0.21000 5.01000 2.66000 0.00000 0.00000 0.00000 0.01000 1.15000 -0.01000 -0.64000 0.00000 -0.51000 0.00000 2.38000 101.00000 2HE22_3.PDB 1.33202 -16.72000 -8.83000 -7.49000 -10.08000 -1.35000 17.51000 -12.23000 0.31000 4.21000 2.65000 0.00000 0.00000 0.00000 0.01000 1.13000 -0.02000 -0.83000 0.00000 -0.59000 0.00000 2.38000 101.00000 2HE22_4.PDB 1.26989 -16.19000 -9.09000 -4.96000 -10.58000 -1.25000 16.86000 -13.32000 0.26000 4.22000 2.71000 0.00000 0.00000 0.00000 0.01000 1.16000 0.02000 -0.64000 0.00000 -0.41000 0.00000 2.38000 101.00000 2HE22_5.PDB 1.23846 -15.94000 -8.94000 -6.49000 -10.00000 -1.26000 16.54000 -12.34000 0.32000 4.63000 2.66000 0.00000 0.00000 0.00000 0.01000 1.12000 -0.01000 -0.56000 0.00000 -0.51000 0.00000 2.38000 101.00000 2HE22_6.PDB 1.13457 -16.33000 -8.82000 -4.67000 -10.57000 -1.52000 16.84000 -13.32000 0.31000 4.02000 2.70000 0.00000 0.00000 0.00000 0.01000 1.21000 -0.06000 -0.68000 0.00000 -0.58000 0.00000 2.38000 101.00000 2HE22_7.PDB 1.19952 -15.95000 -8.91000 -6.40000 -10.15000 -1.62000 16.77000 -12.50000 0.23000 5.30000 2.69000 0.00000 0.00000 0.00000 0.01000 1.14000 -0.09000 -0.63000 0.00000 -0.66000 0.00000 2.38000 101.00000 2HE22_8.PDB 1.20198 -15.75000 -8.87000 -5.97000 -10.36000 -1.19000 16.76000 -12.80000 0.33000 4.83000 2.65000 0.00000 0.00000 0.00000 0.01000 1.12000 0.02000 -0.73000 0.00000 -0.41000 0.00000 2.38000 101.00000 2HE22_9.PDB 1.31929 -14.58000 -8.94000 -6.19000 -10.00000 -1.47000 17.74000 -12.04000 0.32000 4.33000 2.87000 0.00000 0.00000 0.00000 0.02000 1.15000 -0.02000 -0.61000 0.00000 -0.60000 0.00000 2.38000 101.00000 2HE22_10.PDB 1.21299 -17.21000 -8.81000 -7.53000 -10.13000 -1.85000 17.90000 -12.19000 0.27000 4.13000 2.70000 0.00000 0.00000 0.00000 0.01000 1.11000 -0.10000 -0.87000 0.00000 -0.74000 0.00000 2.38000 101.00000 2HE22_11.PDB 1.23378 -13.75000 -8.49000 -2.53000 -10.81000 -1.01000 15.65000 -13.89000 1.46000 4.02000 2.58000 0.00000 0.00000 0.00000 0.02000 1.47000 0.02000 -0.41000 0.00000 -0.34000 0.00000 2.38000 101.00000 2HE22_12.PDB 1.62541 -14.78000 -8.44000 -4.27000 -10.51000 -1.22000 15.76000 -13.29000 0.56000 4.75000 2.64000 0.00000 0.00000 0.00000 0.12000 1.36000 -0.01000 -0.39000 0.00000 -0.49000 0.00000 2.38000 101.00000 2HE22_13.PDB 1.41465 -15.73000 -8.97000 -4.98000 -10.93000 -1.01000 17.14000 -13.78000 0.29000 4.61000 2.89000 0.00000 0.00000 0.00000 0.01000 1.22000 0.02000 -0.69000 0.00000 -0.34000 0.00000 2.38000 101.00000 2HE22_14.PDB 1.48777 -15.77000 -8.83000 -6.52000 -10.48000 -1.16000 17.18000 -12.95000 0.25000 5.10000 2.85000 0.00000 0.00000 0.00000 0.01000 1.16000 -0.01000 -0.74000 0.00000 -0.50000 0.00000 2.38000 101.00000 2HE22_15.PDB 1.23138 -15.80000 -8.85000 -5.99000 -10.29000 -1.15000 16.69000 -12.66000 0.27000 4.45000 2.68000 0.00000 0.00000 0.00000 0.00000 1.15000 0.02000 -0.58000 0.00000 -0.40000 0.00000 2.38000 101.00000 2HE22_16.PDB 1.60577 -14.63000 -9.21000 -3.23000 -10.90000 -1.17000 16.53000 -14.10000 0.32000 4.82000 3.12000 0.00000 0.00000 0.00000 0.02000 1.39000 0.02000 -0.46000 0.00000 -0.37000 0.00000 2.38000 101.00000 2HE22_17.PDB 1.24604 -15.57000 -8.91000 -4.75000 -10.83000 -1.33000 16.50000 -13.95000 0.28000 5.67000 2.94000 0.00000 0.00000 0.00000 0.02000 1.20000 -0.01000 -0.66000 0.00000 -0.55000 0.00000 2.38000 101.00000 2HE22_18.PDB 1.31261 -16.51000 -8.78000 -5.87000 -10.34000 -1.49000 16.76000 -12.77000 0.24000 4.46000 2.64000 0.00000 0.00000 0.00000 0.01000 1.11000 -0.06000 -0.76000 0.00000 -0.55000 0.00000 2.38000 101.00000 2HE22_19.PDB 1.31206 -16.27000 -8.44000 -5.27000 -10.49000 -1.21000 16.75000 -13.07000 0.32000 3.85000 2.59000 0.00000 0.00000 0.00000 0.04000 1.40000 -0.02000 -0.77000 0.00000 -0.55000 0.00000 2.38000 101.00000 2HE22_20.PDB 1.37955 -15.47000 -8.89000 -7.86000 -10.03000 -1.28000 18.06000 -12.02000 0.36000 4.37000 2.89000 0.00000 0.00000 0.00000 0.01000 1.15000 -0.02000 -0.49000 0.00000 -0.55000 0.00000 2.38000 101.00000 2HE22_21.PDB 1.38253 -14.77000 -8.78000 -4.79000 -10.30000 -1.01000 16.35000 -13.07000 0.18000 4.28000 3.32000 0.00000 0.00000 0.00000 0.00000 1.19000 0.02000 -0.63000 0.00000 -0.33000 0.00000 2.38000 101.00000 2HE22_22.PDB 1.20271 -15.30000 -9.26000 -6.04000 -10.45000 -1.29000 17.21000 -13.00000 0.19000 5.35000 2.97000 0.00000 0.00000 0.00000 0.01000 1.33000 -0.01000 -0.46000 0.00000 -0.53000 0.00000 2.38000 101.00000 2HE22_23.PDB 1.26842 -14.37000 -8.81000 -3.02000 -10.65000 -1.04000 16.05000 -13.65000 0.29000 4.42000 3.20000 0.00000 0.00000 0.00000 0.02000 1.23000 0.02000 -0.75000 0.00000 -0.45000 0.00000 2.38000 101.00000 2HE22_24.PDB 1.91815 -14.59000 -8.92000 -4.74000 -10.15000 -1.20000 16.44000 -12.69000 0.34000 4.61000 2.94000 0.00000 0.00000 0.00000 0.01000 1.09000 -0.01000 -0.68000 0.00000 -0.55000 0.00000 2.38000 101.00000 2HE22_25.PDB 1.47846 -15.28000 -8.71000 -4.56000 -10.31000 -1.04000 16.22000 -12.98000 0.32000 3.54000 3.15000 0.00000 0.00000 0.00000 0.00000 1.32000 0.02000 -0.59000 0.00000 -0.34000 0.00000 2.38000 101.00000 2HE22_26.PDB 1.12713 -14.74000 -8.95000 -3.03000 -10.37000 -1.35000 15.94000 -13.37000 0.17000 4.47000 2.94000 0.00000 0.00000 0.00000 0.01000 1.27000 -0.01000 -0.67000 0.00000 -0.53000 0.00000 2.38000 101.00000 2HE22_27.PDB 1.38926 -15.84000 -8.83000 -6.38000 -10.21000 -1.17000 16.84000 -12.56000 0.23000 4.49000 2.82000 0.00000 0.00000 0.00000 0.02000 1.20000 -0.01000 -0.61000 0.00000 -0.48000 0.00000 2.38000 101.00000 2HE22_28.PDB 1.24456 -14.70000 -8.84000 -3.06000 -10.67000 -1.86000 17.10000 -13.46000 0.28000 4.60000 3.06000 0.00000 0.00000 0.00000 0.02000 1.30000 -0.07000 -0.88000 0.00000 -0.93000 0.00000 2.38000 101.00000 2HE22_29.PDB 1.33048 -15.85000 -9.08000 -4.93000 -10.79000 -1.30000 17.38000 -13.49000 0.29000 4.34000 2.90000 0.00000 0.00000 0.00000 0.01000 1.20000 -0.06000 -0.63000 0.00000 -0.50000 0.00000 2.38000 101.00000 2HE22_30.PDB 1.24021 -14.98000 -8.88000 -4.69000 -10.34000 -2.09000 17.32000 -12.79000 0.26000 5.30000 3.00000 0.00000 0.00000 0.00000 0.03000 1.27000 -0.09000 -0.92000 0.00000 -1.09000 0.00000 2.38000 101.00000