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 1OO42_1.PDB 4.88620 -15.53000 -3.20000 -8.26000 -13.94000 -4.95000 20.88000 -15.69000 0.80000 7.84000 6.33000 0.00000 0.00000 0.00000 0.01000 1.88000 -0.52000 -1.25000 0.00000 -3.56000 0.00000 2.38000 119.00000 1OO42_2.PDB 5.10138 -13.29000 -2.18000 -7.19000 -12.90000 -4.14000 18.37000 -14.85000 1.38000 6.63000 5.97000 0.00000 0.00000 0.00000 0.02000 1.75000 -0.65000 -0.58000 0.00000 -3.16000 0.00000 2.38000 119.00000 1OO42_3.PDB 4.56062 -14.61000 -3.17000 -8.14000 -13.82000 -4.71000 20.60000 -15.51000 0.82000 8.33000 6.56000 0.00000 0.00000 0.00000 0.05000 1.65000 -0.42000 -1.47000 0.00000 -3.72000 0.00000 2.38000 119.00000 1OO42_4.PDB 4.21804 -13.37000 -3.08000 -8.02000 -13.09000 -3.82000 19.22000 -14.68000 0.76000 7.95000 6.48000 0.00000 0.00000 0.00000 0.05000 1.76000 -0.59000 -1.36000 0.00000 -3.18000 0.00000 2.38000 119.00000 1OO42_5.PDB 4.39663 -16.46000 -3.15000 -8.11000 -14.23000 -6.17000 21.75000 -15.49000 0.82000 7.99000 5.78000 0.00000 0.00000 0.00000 0.01000 1.74000 -0.53000 -0.89000 0.00000 -4.23000 0.00000 2.38000 119.00000 1OO42_6.PDB 4.50859 -13.91000 -2.29000 -8.50000 -13.69000 -5.13000 21.35000 -15.46000 0.91000 8.06000 6.60000 0.00000 0.00000 0.00000 0.03000 1.92000 -0.43000 -1.32000 0.00000 -4.05000 0.00000 2.38000 119.00000 1OO42_7.PDB 4.36090 -17.51000 -3.19000 -8.01000 -13.35000 -4.47000 19.03000 -14.88000 0.84000 6.06000 5.99000 0.00000 0.00000 0.00000 0.01000 1.85000 -0.41000 -1.55000 0.00000 -3.58000 0.00000 2.38000 119.00000 1OO42_8.PDB 4.26812 -13.06000 -2.26000 -7.15000 -13.39000 -5.21000 20.20000 -14.74000 0.83000 7.06000 6.52000 0.00000 0.00000 0.00000 0.01000 1.91000 -0.64000 -0.59000 0.00000 -3.71000 0.00000 2.38000 119.00000 1OO42_9.PDB 4.49741 -14.95000 -3.00000 -7.94000 -13.64000 -5.02000 20.74000 -14.94000 0.83000 7.25000 6.27000 0.00000 0.00000 0.00000 0.02000 1.88000 -0.67000 -1.08000 0.00000 -3.79000 0.00000 2.38000 119.00000 1OO42_10.PDB 4.61473 -14.34000 -2.37000 -7.38000 -12.98000 -4.49000 18.66000 -15.00000 1.83000 6.50000 5.77000 0.00000 0.00000 0.00000 0.05000 1.63000 -0.50000 -1.19000 0.00000 -3.25000 0.00000 2.38000 119.00000 1OO42_11.PDB 5.64136 -12.63000 -1.45000 -9.04000 -12.83000 -5.32000 19.98000 -14.58000 2.20000 7.06000 6.75000 0.00000 0.00000 0.00000 0.04000 1.83000 -0.49000 -0.78000 0.00000 -4.17000 0.00000 2.38000 119.00000 1OO42_12.PDB 4.35515 -14.60000 -3.24000 -8.20000 -13.89000 -5.00000 21.38000 -15.40000 0.83000 8.19000 6.06000 0.00000 0.00000 0.00000 0.01000 1.89000 -0.67000 -1.08000 0.00000 -3.57000 0.00000 2.38000 119.00000 1OO42_13.PDB 4.77202 -14.45000 -3.00000 -7.83000 -13.42000 -5.13000 20.02000 -15.20000 1.02000 7.38000 6.86000 0.00000 0.00000 0.00000 0.03000 1.76000 -0.50000 -0.77000 0.00000 -3.90000 0.00000 2.38000 119.00000 1OO42_14.PDB 4.88571 -11.77000 -1.44000 -9.12000 -12.88000 -5.15000 20.37000 -14.39000 2.03000 7.12000 6.77000 0.00000 0.00000 0.00000 0.04000 1.81000 -0.64000 -0.35000 0.00000 -4.13000 0.00000 2.38000 119.00000 1OO42_15.PDB 6.35373 -15.28000 -1.47000 -9.27000 -12.98000 -5.49000 19.90000 -14.56000 2.03000 6.62000 5.80000 0.00000 0.00000 0.00000 0.02000 1.90000 -0.49000 -1.20000 0.00000 -4.19000 0.00000 2.38000 119.00000 1OO42_16.PDB 4.04952 -13.73000 -2.94000 -7.94000 -13.45000 -4.46000 20.55000 -14.90000 0.73000 7.72000 6.51000 0.00000 0.00000 0.00000 0.04000 1.76000 -0.67000 -1.32000 0.00000 -3.59000 0.00000 2.38000 119.00000 1OO42_17.PDB 5.75719 -15.04000 -2.15000 -7.51000 -12.70000 -4.90000 17.98000 -14.49000 0.83000 7.95000 5.69000 0.00000 0.00000 0.00000 0.01000 1.88000 -0.49000 -1.50000 0.00000 -3.77000 0.00000 2.38000 119.00000 1OO42_18.PDB 6.44020 -14.11000 -1.48000 -9.68000 -12.61000 -5.07000 19.87000 -14.24000 1.09000 7.19000 6.21000 0.00000 0.00000 0.00000 0.01000 1.88000 -0.49000 -0.88000 0.00000 -4.02000 0.00000 2.38000 119.00000 1OO42_19.PDB 5.52003 -12.17000 -1.48000 -7.66000 -12.99000 -5.05000 19.82000 -14.30000 1.76000 7.06000 6.27000 0.00000 0.00000 0.00000 0.01000 1.90000 -0.65000 -0.93000 0.00000 -4.03000 0.00000 2.38000 119.00000 1OO42_20.PDB 4.28702 -13.13000 -3.12000 -8.08000 -14.53000 -5.96000 23.55000 -15.40000 0.81000 8.55000 7.32000 0.00000 0.00000 0.00000 0.01000 1.62000 -0.51000 -1.67000 0.00000 -4.13000 0.00000 2.38000 119.00000 1OO42_21.PDB 4.34654 -14.58000 -3.09000 -8.11000 -14.10000 -5.86000 21.34000 -15.74000 1.90000 8.05000 6.80000 0.00000 0.00000 0.00000 0.03000 1.78000 -0.68000 -1.00000 0.00000 -4.12000 0.00000 2.38000 119.00000 1OO42_22.PDB 4.13740 -14.76000 -3.19000 -7.87000 -14.26000 -5.04000 20.53000 -15.92000 0.96000 8.38000 7.07000 0.00000 0.00000 0.00000 0.01000 1.78000 -0.59000 -1.08000 0.00000 -3.77000 0.00000 2.38000 119.00000 1OO42_23.PDB 4.30631 -11.25000 -2.17000 -6.44000 -11.94000 -4.38000 17.92000 -13.73000 2.00000 6.10000 5.70000 0.00000 0.00000 0.00000 0.03000 1.72000 -0.49000 -0.50000 0.00000 -3.33000 0.00000 2.38000 119.00000 1OO42_24.PDB 5.10370 -15.01000 -1.50000 -9.16000 -13.42000 -5.27000 21.01000 -14.85000 1.15000 6.57000 6.52000 0.00000 0.00000 0.00000 0.02000 1.91000 -0.51000 -1.42000 0.00000 -4.15000 0.00000 2.38000 119.00000 1OO42_25.PDB 5.98026 -13.61000 -2.14000 -7.65000 -12.40000 -4.31000 17.23000 -14.14000 2.07000 7.01000 5.68000 0.00000 0.00000 0.00000 0.01000 1.78000 -0.40000 -1.19000 0.00000 -3.39000 0.00000 2.38000 119.00000 1OO42_26.PDB 4.55076 -12.93000 -2.35000 -7.92000 -12.94000 -4.63000 19.20000 -14.58000 1.79000 7.52000 6.42000 0.00000 0.00000 0.00000 0.02000 1.94000 -0.58000 -0.99000 0.00000 -3.89000 0.00000 2.38000 119.00000 1OO42_27.PDB 4.24573 -14.50000 -2.26000 -8.02000 -13.24000 -5.74000 20.83000 -14.71000 1.56000 7.12000 6.16000 0.00000 0.00000 0.00000 0.02000 1.93000 -0.70000 -1.40000 0.00000 -4.11000 0.00000 2.38000 119.00000 1OO42_28.PDB 4.64103 -12.76000 -2.24000 -7.75000 -12.91000 -4.75000 19.38000 -14.49000 1.83000 7.28000 6.41000 0.00000 0.00000 0.00000 0.03000 1.76000 -0.51000 -1.33000 0.00000 -3.73000 0.00000 2.38000 119.00000 1OO42_29.PDB 4.41437 -15.08000 -3.11000 -8.14000 -13.25000 -3.58000 19.12000 -14.88000 0.78000 6.91000 5.67000 0.00000 0.00000 0.00000 0.02000 1.89000 -0.57000 -1.03000 0.00000 -3.02000 0.00000 2.38000 119.00000 1OO42_30.PDB 4.05778 -13.79000 -2.25000 -7.76000 -13.42000 -5.22000 20.20000 -14.68000 0.96000 7.56000 6.57000 0.00000 0.00000 0.00000 0.03000 1.79000 -0.67000 -1.05000 0.00000 -4.05000 0.00000 2.38000 119.00000