name total energy Backbone Hbon 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 2PKU2_1.PDB 45.19000 -47.71000 -14.45000 -95.95000 -2.15000 125.13000 -124.80000 20.94000 45.83000 140.81000 0.00000 0.00000 0.00000 4.01000 49.81000 -1.90000 -3.84000 0.00000 -0.72000 0.00000 0.00000 92.00000 2PKU2_2.PDB 46.70000 -47.65000 -14.47000 -96.74000 -1.73000 126.30000 -125.68000 21.00000 45.81000 141.39000 0.00000 0.00000 0.00000 4.24000 49.93000 -1.80000 -3.72000 0.00000 -0.26000 0.00000 0.00000 92.00000 2PKU2_3.PDB 45.39000 -47.73000 -14.48000 -95.80000 -2.16000 124.78000 -124.57000 21.27000 45.62000 140.83000 0.00000 0.00000 0.00000 3.92000 50.13000 -1.90000 -3.80000 0.00000 -0.59000 0.00000 0.00000 92.00000 2PKU2_4.PDB 45.74000 -47.69000 -14.46000 -95.43000 -1.86000 124.14000 -124.17000 21.28000 45.11000 140.67000 0.00000 0.00000 0.00000 3.96000 49.99000 -1.86000 -3.74000 0.00000 -0.22000 0.00000 0.00000 92.00000 2PKU2_5.PDB 44.53000 -48.54000 -16.16000 -96.22000 -2.31000 125.76000 -125.09000 21.01000 47.06000 142.06000 0.00000 0.00000 0.00000 4.07000 50.02000 -1.95000 -4.51000 0.00000 -0.63000 0.00000 0.00000 92.00000 2PKU2_6.PDB 45.25000 -48.62000 -15.37000 -96.78000 -1.86000 125.65000 -126.07000 21.91000 46.85000 142.31000 0.00000 0.00000 0.00000 3.77000 50.07000 -1.88000 -4.45000 0.00000 -0.22000 0.00000 0.00000 92.00000 2PKU2_7.PDB 45.65000 -48.59000 -15.36000 -95.85000 -1.92000 125.34000 -124.55000 21.25000 46.17000 141.64000 0.00000 0.00000 0.00000 3.89000 49.96000 -1.89000 -4.16000 0.00000 -0.31000 0.00000 0.00000 92.00000 2PKU2_8.PDB 44.63000 -48.59000 -16.11000 -96.08000 -2.36000 125.63000 -124.89000 20.99000 46.85000 142.11000 0.00000 0.00000 0.00000 4.27000 50.08000 -1.94000 -4.56000 0.00000 -0.69000 0.00000 0.00000 92.00000 2PKU2_9.PDB 45.82000 -47.63000 -14.48000 -94.96000 -1.89000 123.73000 -123.75000 20.99000 44.85000 140.86000 0.00000 0.00000 0.00000 4.08000 49.66000 -1.81000 -3.89000 0.00000 -0.27000 0.00000 0.00000 92.00000 2PKU2_10.PDB 45.81000 -47.70000 -14.48000 -95.11000 -2.20000 124.50000 -123.46000 21.22000 45.27000 140.17000 0.00000 0.00000 0.00000 3.89000 49.94000 -1.90000 -3.76000 0.00000 -0.61000 0.00000 0.00000 92.00000 2PKU2_11.PDB 45.64000 -47.70000 -14.47000 -95.83000 -1.90000 124.91000 -124.61000 21.05000 45.40000 140.43000 0.00000 0.00000 0.00000 4.21000 50.12000 -1.70000 -3.87000 0.00000 -0.28000 0.00000 0.00000 92.00000 2PKU2_12.PDB 45.44000 -47.72000 -15.27000 -95.20000 -2.23000 124.48000 -123.55000 20.99000 46.14000 140.24000 0.00000 0.00000 0.00000 3.96000 49.93000 -1.91000 -3.84000 0.00000 -0.64000 0.00000 0.00000 92.00000 2PKU2_13.PDB 45.27000 -48.57000 -15.34000 -95.97000 -1.92000 125.19000 -124.73000 20.67000 46.32000 141.88000 0.00000 0.00000 0.00000 4.25000 50.13000 -1.89000 -4.30000 0.00000 -0.31000 0.00000 0.00000 92.00000 2PKU2_14.PDB 46.24000 -47.68000 -14.48000 -95.39000 -2.11000 124.99000 -124.00000 21.49000 45.13000 140.57000 0.00000 0.00000 0.00000 4.00000 50.01000 -1.83000 -3.91000 0.00000 -0.55000 0.00000 0.00000 92.00000 2PKU2_15.PDB 46.45000 -48.53000 -15.35000 -96.54000 -1.86000 126.48000 -125.50000 21.74000 46.36000 142.10000 0.00000 0.00000 0.00000 3.82000 50.06000 -1.88000 -4.19000 0.00000 -0.22000 0.00000 0.00000 92.00000 2PKU2_16.PDB 45.45000 -47.61000 -14.47000 -95.44000 -2.15000 124.87000 -124.20000 20.97000 45.34000 140.66000 0.00000 0.00000 0.00000 3.89000 49.86000 -1.90000 -3.95000 0.00000 -0.57000 0.00000 0.00000 92.00000 2PKU2_17.PDB 45.48000 -47.70000 -14.46000 -95.10000 -1.88000 124.04000 -123.51000 20.98000 44.98000 140.05000 0.00000 0.00000 0.00000 3.98000 49.98000 -1.82000 -3.83000 0.00000 -0.25000 0.00000 0.00000 92.00000 2PKU2_18.PDB 44.45000 -48.58000 -16.19000 -95.59000 -2.32000 125.31000 -124.05000 21.06000 46.59000 141.42000 0.00000 0.00000 0.00000 3.88000 50.03000 -1.95000 -4.49000 0.00000 -0.64000 0.00000 0.00000 92.00000 2PKU2_19.PDB 46.58000 -47.69000 -14.47000 -94.78000 -1.89000 123.63000 -123.27000 21.95000 44.80000 140.28000 0.00000 0.00000 0.00000 3.69000 49.93000 -1.77000 -3.64000 0.00000 -0.27000 0.00000 0.00000 92.00000 2PKU2_20.PDB 44.54000 -48.57000 -16.09000 -95.39000 -2.35000 125.06000 -123.82000 21.17000 46.37000 141.40000 0.00000 0.00000 0.00000 3.84000 50.04000 -1.94000 -4.46000 0.00000 -0.68000 0.00000 0.00000 92.00000 2PKU2_21.PDB 45.91000 -48.57000 -15.32000 -95.34000 -1.77000 125.03000 -123.75000 21.34000 45.69000 141.04000 0.00000 0.00000 0.00000 3.87000 49.81000 -1.87000 -4.14000 0.00000 -0.31000 0.00000 0.00000 92.00000 2PKU2_22.PDB 45.69000 -47.64000 -14.47000 -95.48000 -1.85000 124.59000 -124.25000 20.75000 45.18000 140.50000 0.00000 0.00000 0.00000 4.30000 50.00000 -1.86000 -3.86000 0.00000 -0.22000 0.00000 0.00000 92.00000 2PKU2_23.PDB 45.43000 -48.49000 -16.19000 -95.85000 -2.32000 125.69000 -124.70000 21.97000 46.77000 141.80000 0.00000 0.00000 0.00000 3.86000 49.87000 -1.95000 -4.52000 0.00000 -0.64000 0.00000 0.00000 92.00000 2PKU2_24.PDB 45.14000 -48.49000 -15.35000 -96.64000 -1.86000 125.88000 -125.93000 21.17000 46.68000 142.22000 0.00000 0.00000 0.00000 4.03000 49.94000 -1.88000 -4.48000 0.00000 -0.22000 0.00000 0.00000 92.00000 2PKU2_25.PDB 45.79000 -48.52000 -15.36000 -95.69000 -1.92000 125.51000 -124.40000 21.26000 46.00000 141.47000 0.00000 0.00000 0.00000 3.85000 49.98000 -1.89000 -4.20000 0.00000 -0.31000 0.00000 0.00000 92.00000 2PKU2_26.PDB 46.18000 -48.46000 -16.09000 -95.60000 -2.35000 125.84000 -123.99000 21.46000 46.40000 141.96000 0.00000 0.00000 0.00000 4.23000 49.89000 -1.94000 -4.61000 0.00000 -0.68000 0.00000 0.00000 92.00000 2PKU2_27.PDB 46.91000 -47.64000 -14.48000 -94.22000 -1.89000 123.25000 -122.51000 21.78000 44.33000 140.21000 0.00000 0.00000 0.00000 3.85000 49.43000 -1.82000 -3.69000 0.00000 -0.27000 0.00000 0.00000 92.00000 2PKU2_28.PDB 45.70000 -48.38000 -15.06000 -95.73000 -2.16000 125.64000 -124.00000 21.64000 45.90000 140.21000 0.00000 0.00000 0.00000 3.96000 49.78000 -1.90000 -3.70000 0.00000 -0.73000 0.00000 0.00000 92.00000 2PKU2_29.PDB 45.38000 -48.54000 -15.32000 -95.28000 -1.92000 124.59000 -123.78000 21.20000 45.85000 141.27000 0.00000 0.00000 0.00000 3.91000 49.97000 -1.89000 -4.38000 0.00000 -0.31000 0.00000 0.00000 92.00000 2PKU2_30.PDB 46.25000 -49.02000 -15.78000 -96.13000 -1.88000 126.02000 -124.75000 22.57000 46.33000 141.50000 0.00000 0.00000 0.00000 3.68000 49.91000 -1.84000 -4.22000 0.00000 -0.24000 0.00000 0.00000 92.00000