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 2IUI2_1.PDB 0.74000 -78.78000 -33.90000 -139.58000 -6.36000 177.41000 -176.98000 12.26000 76.64000 175.76000 0.00000 0.00000 1.12000 4.56000 62.20000 -1.72000 -7.16000 0.00000 -2.52000 0.00000 0.00000 118.00000 2IUI2_2.PDB 0.75000 -79.03000 -34.24000 -140.58000 -6.40000 179.30000 -178.47000 13.11000 77.36000 176.06000 0.00000 0.00000 1.12000 5.22000 62.29000 -1.78000 -7.66000 0.00000 -3.26000 0.00000 0.00000 118.00000 2IUI2_3.PDB 1.86000 -78.30000 -34.07000 -140.10000 -6.43000 178.05000 -177.49000 12.74000 76.52000 175.97000 0.00000 0.00000 1.12000 5.07000 62.01000 -1.23000 -7.52000 0.00000 -2.48000 0.00000 0.00000 118.00000 2IUI2_4.PDB 2.02000 -77.58000 -32.38000 -139.69000 -6.54000 176.91000 -177.45000 12.22000 76.01000 175.69000 0.00000 0.00000 1.12000 4.81000 61.72000 -1.21000 -7.30000 0.00000 -2.60000 0.00000 0.00000 118.00000 2IUI2_5.PDB 1.98000 -78.22000 -33.95000 -138.56000 -6.10000 176.58000 -175.91000 12.21000 75.45000 175.45000 0.00000 0.00000 1.12000 4.99000 61.77000 -1.23000 -7.65000 0.00000 -2.20000 0.00000 0.00000 118.00000 2IUI2_6.PDB 1.75000 -78.43000 -34.50000 -140.10000 -6.12000 177.86000 -177.65000 13.02000 77.15000 175.63000 0.00000 0.00000 1.12000 5.03000 62.04000 -1.73000 -7.04000 0.00000 -2.50000 0.00000 0.00000 118.00000 2IUI2_7.PDB -0.09000 -79.20000 -34.31000 -140.63000 -6.20000 179.13000 -178.29000 13.20000 77.45000 175.77000 0.00000 0.00000 1.12000 4.23000 62.18000 -1.77000 -7.58000 0.00000 -3.03000 0.00000 0.00000 118.00000 2IUI2_8.PDB 2.66000 -78.57000 -33.91000 -139.18000 -6.78000 178.08000 -176.43000 13.94000 76.07000 174.77000 0.00000 0.00000 1.12000 5.09000 62.15000 -1.61000 -7.90000 0.00000 -2.04000 0.00000 0.00000 118.00000 2IUI2_9.PDB 3.61000 -78.62000 -37.39000 -141.19000 -6.55000 183.12000 -178.17000 13.44000 78.70000 175.95000 0.00000 0.00000 1.12000 5.25000 62.12000 -1.71000 -7.37000 0.00000 -2.96000 0.00000 0.00000 118.00000 2IUI2_10.PDB 4.61000 -78.28000 -33.71000 -140.27000 -6.09000 177.78000 -177.46000 13.83000 77.17000 176.23000 0.00000 0.00000 1.12000 5.53000 62.24000 -1.46000 -7.54000 0.00000 -2.24000 0.00000 0.00000 118.00000 2IUI2_11.PDB 2.29000 -78.55000 -33.93000 -138.93000 -6.06000 177.43000 -175.85000 12.49000 76.35000 174.75000 0.00000 0.00000 1.12000 5.17000 62.12000 -1.62000 -7.68000 0.00000 -2.41000 0.00000 0.00000 118.00000 2IUI2_12.PDB 2.09000 -78.39000 -33.69000 -139.51000 -5.68000 177.26000 -177.08000 12.34000 76.29000 175.75000 0.00000 0.00000 1.12000 4.56000 62.08000 -1.64000 -7.07000 0.00000 -2.17000 0.00000 0.00000 118.00000 2IUI2_13.PDB 0.48000 -78.49000 -34.29000 -139.78000 -5.74000 177.59000 -177.50000 12.98000 77.16000 174.99000 0.00000 0.00000 1.12000 4.99000 62.13000 -1.79000 -8.10000 0.00000 -2.68000 0.00000 0.00000 118.00000 2IUI2_14.PDB 1.74000 -79.08000 -32.73000 -139.36000 -6.39000 177.70000 -176.67000 12.15000 75.68000 175.81000 0.00000 0.00000 1.12000 5.02000 62.15000 -1.58000 -7.58000 0.00000 -2.36000 0.00000 0.00000 118.00000 2IUI2_15.PDB 1.91000 -78.97000 -35.61000 -139.51000 -7.06000 179.22000 -176.60000 12.36000 77.98000 175.78000 0.00000 0.00000 1.12000 4.51000 61.63000 -1.21000 -7.68000 0.00000 -2.42000 0.00000 0.00000 118.00000 2IUI2_16.PDB 6.93000 -76.72000 -30.23000 -138.05000 -3.14000 171.66000 -175.84000 12.08000 74.73000 175.66000 0.00000 0.00000 1.12000 5.33000 61.95000 -1.06000 -7.81000 0.00000 -0.79000 0.00000 0.00000 118.00000 2IUI2_17.PDB 0.32000 -79.10000 -35.09000 -140.85000 -6.59000 179.39000 -178.48000 13.03000 78.40000 176.19000 0.00000 0.00000 1.12000 5.03000 62.14000 -1.78000 -7.54000 0.00000 -3.41000 0.00000 0.00000 118.00000 2IUI2_18.PDB 3.88000 -77.84000 -34.90000 -139.08000 -5.87000 177.06000 -176.35000 13.02000 76.10000 175.78000 0.00000 0.00000 1.12000 5.94000 62.11000 -1.17000 -7.92000 0.00000 -2.01000 0.00000 0.00000 118.00000 2IUI2_19.PDB 1.48000 -78.50000 -33.61000 -139.81000 -6.51000 177.62000 -177.50000 12.93000 76.41000 175.95000 0.00000 0.00000 1.12000 5.13000 62.14000 -1.47000 -7.62000 0.00000 -2.65000 0.00000 0.00000 118.00000 2IUI2_20.PDB 5.05000 -75.23000 -31.51000 -138.38000 -5.42000 172.91000 -176.30000 12.70000 75.20000 175.24000 0.00000 0.00000 1.12000 5.57000 61.96000 -1.09000 -7.96000 0.00000 -1.81000 0.00000 0.00000 118.00000 2IUI2_21.PDB 2.16000 -78.24000 -33.48000 -139.20000 -5.65000 177.55000 -176.49000 12.87000 76.28000 174.71000 0.00000 0.00000 1.12000 5.06000 61.95000 -1.78000 -7.77000 0.00000 -2.82000 0.00000 0.00000 118.00000 2IUI2_22.PDB 3.16000 -78.96000 -36.89000 -141.03000 -6.55000 182.29000 -177.97000 13.45000 78.73000 175.94000 0.00000 0.00000 1.12000 4.46000 62.18000 -1.71000 -6.76000 0.00000 -2.96000 0.00000 0.00000 118.00000 2IUI2_23.PDB 3.33000 -76.90000 -32.20000 -139.62000 -6.53000 176.57000 -176.91000 12.29000 75.84000 174.77000 0.00000 0.00000 1.12000 5.44000 61.83000 -1.21000 -7.10000 0.00000 -2.24000 0.00000 0.00000 118.00000 2IUI2_24.PDB 4.11000 -78.24000 -36.45000 -141.11000 -6.75000 182.04000 -178.20000 13.34000 78.70000 175.99000 0.00000 0.00000 1.12000 5.33000 62.14000 -1.70000 -6.94000 0.00000 -3.02000 0.00000 0.00000 118.00000 2IUI2_25.PDB 2.37000 -78.38000 -34.64000 -140.07000 -6.26000 178.19000 -177.80000 13.41000 78.03000 175.74000 0.00000 0.00000 1.12000 5.25000 61.95000 -1.76000 -7.48000 0.00000 -2.97000 0.00000 0.00000 118.00000 2IUI2_26.PDB 0.45000 -79.01000 -35.39000 -139.43000 -6.24000 177.88000 -176.63000 12.29000 76.56000 175.76000 0.00000 0.00000 1.12000 5.32000 62.05000 -1.25000 -8.02000 0.00000 -2.51000 0.00000 0.00000 118.00000 2IUI2_27.PDB 0.74000 -78.05000 -35.27000 -139.03000 -6.40000 177.26000 -176.10000 12.43000 75.97000 175.04000 0.00000 0.00000 1.12000 4.89000 61.98000 -1.15000 -7.78000 0.00000 -2.21000 0.00000 0.00000 118.00000 2IUI2_28.PDB 0.40000 -79.52000 -35.96000 -141.04000 -6.99000 181.53000 -178.68000 12.72000 78.53000 175.92000 0.00000 0.00000 1.12000 5.28000 62.36000 -1.77000 -7.34000 0.00000 -3.40000 0.00000 0.00000 118.00000 2IUI2_29.PDB 0.43000 -78.26000 -34.71000 -139.92000 -6.28000 177.40000 -177.75000 12.45000 76.44000 175.87000 0.00000 0.00000 1.12000 5.14000 62.23000 -1.22000 -7.41000 0.00000 -2.45000 0.00000 0.00000 118.00000 2IUI2_30.PDB 0.66000 -79.80000 -35.81000 -139.79000 -6.36000 178.57000 -176.45000 12.28000 77.27000 175.31000 0.00000 0.00000 1.12000 5.81000 62.13000 -1.24000 -7.58000 0.00000 -2.67000 0.00000 0.00000 118.00000