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 1H3H2_1.PDB 6.50035 -12.69000 -1.75000 -4.03000 -12.01000 -3.99000 12.32000 -14.46000 2.31000 9.27000 4.02000 0.00000 0.00000 0.00000 0.28000 2.55000 0.00000 -1.46000 0.00000 -3.19000 0.00000 2.38000 71.00000 1H3H2_2.PDB 6.90668 -10.18000 -0.97000 -2.11000 -10.74000 -2.68000 11.16000 -13.42000 1.10000 7.88000 3.97000 0.00000 0.00000 0.00000 0.21000 2.25000 0.00000 -1.81000 0.00000 -2.78000 0.00000 2.38000 71.00000 1H3H2_3.PDB 6.35208 -12.09000 -0.93000 -3.02000 -11.09000 -3.14000 10.52000 -14.09000 1.07000 8.70000 4.15000 0.00000 0.00000 0.00000 0.19000 2.20000 0.00000 -1.24000 0.00000 -3.22000 0.00000 2.38000 71.00000 1H3H2_4.PDB 7.05194 -12.07000 -1.60000 -3.71000 -12.90000 -4.84000 13.64000 -15.46000 1.77000 10.26000 5.09000 0.00000 0.00000 0.00000 0.45000 2.55000 0.00000 -1.00000 0.00000 -3.77000 0.00000 2.38000 71.00000 1H3H2_5.PDB 6.50472 -10.81000 -0.98000 -2.98000 -11.48000 -3.64000 11.74000 -14.29000 1.48000 8.87000 4.34000 0.00000 0.00000 0.00000 0.23000 2.30000 0.00000 -0.79000 0.00000 -3.30000 0.00000 2.38000 71.00000 1H3H2_6.PDB 6.40335 -10.84000 -0.92000 -2.80000 -11.39000 -3.35000 11.14000 -14.43000 1.22000 9.12000 4.38000 0.00000 0.00000 0.00000 0.21000 2.30000 0.00000 -0.82000 0.00000 -3.21000 0.00000 2.38000 71.00000 1H3H2_7.PDB 6.41401 -12.68000 -0.93000 -3.10000 -11.59000 -3.36000 11.05000 -14.58000 1.12000 9.15000 4.07000 0.00000 0.00000 0.00000 0.22000 2.44000 0.00000 -1.23000 0.00000 -3.50000 0.00000 2.38000 71.00000 1H3H2_8.PDB 7.83191 -13.43000 -1.79000 -4.37000 -12.92000 -5.95000 14.47000 -15.09000 2.42000 10.09000 4.68000 0.00000 0.00000 0.00000 0.54000 2.54000 0.00000 -1.18000 0.00000 -4.33000 0.00000 2.38000 71.00000 1H3H2_9.PDB 6.43210 -12.91000 -2.18000 -5.05000 -12.68000 -4.99000 14.45000 -14.94000 1.54000 10.62000 4.62000 0.00000 0.00000 0.00000 0.26000 2.78000 0.00000 -0.63000 0.00000 -3.95000 0.00000 2.38000 71.00000 1H3H2_10.PDB 7.17579 -10.19000 -0.93000 -3.01000 -10.44000 -2.74000 10.73000 -13.07000 1.42000 7.87000 4.01000 0.00000 0.00000 0.00000 0.25000 2.32000 0.00000 -1.32000 0.00000 -2.98000 0.00000 2.38000 71.00000 1H3H2_11.PDB 6.55379 -12.31000 -0.93000 -3.89000 -11.22000 -4.73000 13.07000 -13.40000 1.99000 7.52000 3.70000 0.00000 0.00000 0.00000 0.28000 2.59000 0.00000 -0.90000 0.00000 -3.80000 0.00000 2.38000 71.00000 1H3H2_12.PDB 6.42890 -9.37000 -0.96000 -2.38000 -10.43000 -2.78000 11.06000 -12.99000 1.10000 7.88000 3.98000 0.00000 0.00000 0.00000 0.23000 2.33000 0.00000 -1.07000 0.00000 -3.01000 0.00000 2.38000 71.00000 1H3H2_13.PDB 6.76424 -10.92000 -0.94000 -3.21000 -10.87000 -2.67000 10.80000 -13.86000 1.18000 8.29000 4.23000 0.00000 0.00000 0.00000 0.28000 2.37000 0.00000 -1.33000 0.00000 -2.82000 0.00000 2.38000 71.00000 1H3H2_14.PDB 6.42471 -11.37000 -0.93000 -3.32000 -11.90000 -3.62000 12.11000 -14.76000 1.07000 9.22000 4.37000 0.00000 0.00000 0.00000 0.25000 2.56000 0.00000 -0.84000 0.00000 -3.03000 0.00000 2.38000 71.00000 1H3H2_15.PDB 7.19560 -10.76000 -0.93000 -2.94000 -10.59000 -2.65000 10.68000 -13.44000 1.04000 8.07000 4.06000 0.00000 0.00000 0.00000 0.33000 2.25000 0.00000 -1.49000 0.00000 -2.88000 0.00000 2.38000 71.00000 1H3H2_16.PDB 7.02488 -10.45000 -0.94000 -4.36000 -10.38000 -2.63000 11.01000 -12.84000 1.04000 8.55000 3.96000 0.00000 0.00000 0.00000 0.21000 2.21000 0.00000 -1.22000 0.00000 -2.86000 0.00000 2.38000 71.00000 1H3H2_17.PDB 8.19225 -12.72000 -0.97000 -5.03000 -11.13000 -4.49000 12.57000 -13.30000 1.60000 8.10000 3.90000 0.00000 0.00000 0.00000 0.40000 2.32000 0.00000 -1.17000 0.00000 -3.19000 0.00000 2.38000 71.00000 1H3H2_18.PDB 7.79047 -12.64000 -0.93000 -6.59000 -10.77000 -4.08000 12.38000 -12.77000 1.38000 8.29000 4.02000 0.00000 0.00000 0.00000 0.40000 2.33000 0.00000 -1.03000 0.00000 -2.94000 0.00000 2.38000 71.00000 1H3H2_19.PDB 5.60715 -9.33000 -0.89000 -2.82000 -10.07000 -2.39000 10.52000 -12.58000 1.16000 7.40000 3.96000 0.00000 0.00000 0.00000 0.25000 2.17000 0.00000 -1.22000 0.00000 -2.66000 0.00000 2.38000 71.00000 1H3H2_20.PDB 6.74327 -11.15000 -0.90000 -4.76000 -11.12000 -4.28000 12.79000 -13.30000 1.88000 8.78000 4.11000 0.00000 0.00000 0.00000 0.31000 2.53000 0.00000 -0.88000 0.00000 -3.80000 0.00000 2.38000 71.00000 1H3H2_21.PDB 7.81037 -11.04000 -0.94000 -3.05000 -10.75000 -2.79000 10.80000 -13.60000 1.71000 8.04000 3.98000 0.00000 0.00000 0.00000 0.24000 2.23000 0.00000 -1.71000 0.00000 -2.96000 0.00000 2.38000 71.00000 1H3H2_22.PDB 6.18577 -11.77000 -0.95000 -3.07000 -11.20000 -2.82000 10.54000 -14.22000 1.25000 8.43000 3.74000 0.00000 0.00000 0.00000 0.23000 2.54000 0.00000 -0.85000 0.00000 -2.86000 0.00000 2.38000 71.00000 1H3H2_23.PDB 6.51007 -10.34000 -0.90000 -4.14000 -10.43000 -2.73000 11.16000 -12.91000 1.16000 8.57000 4.03000 0.00000 0.00000 0.00000 0.22000 2.34000 0.00000 -1.43000 0.00000 -2.96000 0.00000 2.38000 71.00000 1H3H2_24.PDB 6.78874 -12.29000 -0.94000 -4.60000 -11.51000 -4.45000 13.51000 -13.72000 1.99000 7.50000 3.71000 0.00000 0.00000 0.00000 0.58000 2.35000 0.00000 -1.11000 0.00000 -3.26000 0.00000 2.38000 71.00000 1H3H2_25.PDB 6.60083 -11.23000 -0.91000 -3.29000 -11.76000 -3.42000 11.80000 -14.62000 1.18000 9.01000 4.54000 0.00000 0.00000 0.00000 0.26000 2.56000 0.00000 -0.86000 0.00000 -3.16000 0.00000 2.38000 71.00000 1H3H2_26.PDB 6.84321 -11.24000 -0.94000 -2.98000 -10.62000 -2.68000 10.55000 -13.47000 1.26000 7.96000 3.96000 0.00000 0.00000 0.00000 0.27000 2.27000 0.00000 -1.68000 0.00000 -2.88000 0.00000 2.38000 71.00000 1H3H2_27.PDB 7.00637 -11.89000 -0.97000 -3.09000 -11.07000 -2.75000 10.33000 -14.09000 1.35000 8.04000 3.56000 0.00000 0.00000 0.00000 0.22000 2.28000 0.00000 -0.77000 0.00000 -2.65000 0.00000 2.38000 71.00000 1H3H2_28.PDB 6.34769 -10.09000 -0.92000 -2.96000 -11.64000 -3.83000 12.27000 -14.32000 1.80000 9.63000 4.10000 0.00000 0.00000 0.00000 0.28000 2.39000 0.00000 -1.14000 0.00000 -3.37000 0.00000 2.38000 71.00000 1H3H2_29.PDB 6.38914 -11.00000 -0.94000 -2.95000 -10.73000 -2.70000 10.86000 -13.62000 1.03000 8.25000 3.83000 0.00000 0.00000 0.00000 0.24000 2.36000 0.00000 -1.41000 0.00000 -2.87000 0.00000 2.38000 71.00000 1H3H2_30.PDB 7.01807 -11.13000 -0.91000 -2.76000 -11.34000 -3.36000 11.28000 -13.99000 2.02000 7.71000 3.69000 0.00000 0.00000 0.00000 0.29000 2.45000 0.00000 -0.86000 0.00000 -2.88000 0.00000 2.38000 71.00000