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 2IUH2_1.PDB 2.14682 -22.73000 -6.11000 -8.42000 -15.02000 -4.85000 20.29000 -18.53000 0.69000 8.81000 5.01000 0.00000 0.00000 0.00000 0.03000 0.65000 -0.30000 -0.82000 0.00000 -3.52000 0.00000 2.38000 123.00000 2IUH2_2.PDB 2.74582 -17.51000 -5.98000 -8.66000 -13.96000 -5.27000 20.44000 -16.63000 3.22000 8.73000 5.53000 0.00000 0.00000 0.00000 0.23000 0.74000 -0.27000 -1.32000 0.00000 -3.58000 0.00000 2.38000 123.00000 2IUH2_3.PDB 2.18898 -20.02000 -6.08000 -8.63000 -14.21000 -4.82000 20.22000 -17.12000 1.82000 8.70000 4.78000 0.00000 0.00000 0.00000 0.07000 0.85000 -0.29000 -1.28000 0.00000 -3.17000 0.00000 2.38000 123.00000 2IUH2_4.PDB 2.10573 -19.67000 -6.11000 -8.23000 -13.57000 -4.84000 19.13000 -16.46000 1.42000 8.45000 4.54000 0.00000 0.00000 0.00000 0.06000 0.78000 -0.29000 -0.59000 0.00000 -3.19000 0.00000 2.38000 123.00000 2IUH2_5.PDB 3.44039 -24.52000 -6.12000 -10.33000 -14.93000 -5.80000 21.09000 -17.99000 0.62000 9.36000 4.97000 0.00000 0.00000 0.00000 0.11000 0.75000 -0.29000 -1.14000 0.00000 -4.07000 0.00000 2.38000 123.00000 2IUH2_6.PDB 2.80665 -20.63000 -6.10000 -8.66000 -14.23000 -4.92000 19.72000 -17.32000 1.82000 8.55000 4.91000 0.00000 0.00000 0.00000 0.10000 0.79000 -0.29000 -0.98000 0.00000 -3.24000 0.00000 2.38000 123.00000 2IUH2_7.PDB 2.47938 -19.93000 -6.09000 -9.77000 -13.77000 -4.80000 20.25000 -16.51000 1.61000 9.32000 4.54000 0.00000 0.00000 0.00000 0.10000 0.74000 -0.29000 -1.31000 0.00000 -3.21000 0.00000 2.38000 123.00000 2IUH2_8.PDB 2.51531 -23.42000 -6.13000 -8.27000 -14.54000 -4.49000 19.53000 -18.23000 0.54000 8.46000 4.45000 0.00000 0.00000 0.00000 0.04000 0.85000 -0.29000 -1.16000 0.00000 -3.34000 0.00000 2.38000 123.00000 2IUH2_9.PDB 2.59749 -19.82000 -6.08000 -8.75000 -14.05000 -4.66000 19.97000 -17.09000 1.71000 8.34000 5.48000 0.00000 0.00000 0.00000 0.09000 0.81000 -0.27000 -1.47000 0.00000 -3.04000 0.00000 2.38000 123.00000 2IUH2_10.PDB 2.09238 -22.99000 -6.11000 -9.81000 -14.15000 -4.88000 20.74000 -17.19000 0.31000 7.66000 5.02000 0.00000 0.00000 0.00000 0.05000 0.62000 -0.27000 -1.39000 0.00000 -2.97000 0.00000 2.38000 123.00000 2IUH2_11.PDB 2.86831 -20.67000 -6.16000 -7.15000 -14.74000 -4.29000 19.50000 -18.25000 1.82000 7.32000 5.02000 0.00000 0.00000 0.00000 0.14000 0.88000 -0.30000 -0.85000 0.00000 -2.74000 0.00000 2.38000 123.00000 2IUH2_12.PDB 2.59656 -23.75000 -6.15000 -10.45000 -15.04000 -5.88000 22.13000 -17.92000 0.46000 9.31000 5.50000 0.00000 0.00000 0.00000 0.09000 0.76000 -0.27000 -1.48000 0.00000 -4.06000 0.00000 2.38000 123.00000 2IUH2_13.PDB 2.50953 -18.52000 -6.05000 -8.30000 -14.33000 -4.67000 20.79000 -17.16000 1.66000 8.42000 5.67000 0.00000 0.00000 0.00000 0.09000 0.80000 -0.27000 -1.39000 0.00000 -2.97000 0.00000 2.38000 123.00000 2IUH2_14.PDB 2.08901 -24.16000 -6.14000 -11.00000 -14.02000 -5.21000 20.12000 -17.15000 0.48000 8.99000 4.77000 0.00000 0.00000 0.00000 0.09000 0.60000 -0.29000 -1.16000 0.00000 -3.64000 0.00000 2.38000 123.00000 2IUH2_15.PDB 2.43081 -19.30000 -6.00000 -8.78000 -13.65000 -4.64000 19.97000 -16.48000 1.41000 8.27000 5.02000 0.00000 0.00000 0.00000 0.08000 0.75000 -0.27000 -1.26000 0.00000 -2.98000 0.00000 2.38000 123.00000 2IUH2_16.PDB 2.28633 -22.90000 -6.18000 -9.83000 -14.87000 -5.30000 21.70000 -18.07000 0.62000 8.60000 5.03000 0.00000 0.00000 0.00000 0.08000 0.77000 -0.30000 -0.72000 0.00000 -3.66000 0.00000 2.38000 123.00000 2IUH2_17.PDB 2.93813 -21.35000 -6.07000 -8.60000 -14.88000 -5.00000 20.44000 -18.60000 1.79000 8.79000 5.36000 0.00000 0.00000 0.00000 0.29000 0.69000 -0.27000 -1.20000 0.00000 -3.40000 0.00000 2.38000 123.00000 2IUH2_18.PDB 2.55155 -23.31000 -6.18000 -10.09000 -15.01000 -5.31000 21.89000 -18.12000 0.80000 8.54000 4.91000 0.00000 0.00000 0.00000 0.13000 0.85000 -0.30000 -0.91000 0.00000 -3.66000 0.00000 2.38000 123.00000 2IUH2_19.PDB 2.67470 -16.73000 -6.07000 -7.19000 -14.25000 -4.09000 19.50000 -17.42000 3.38000 7.38000 5.87000 0.00000 0.00000 0.00000 0.22000 0.77000 -0.27000 -1.24000 0.00000 -2.55000 0.00000 2.38000 123.00000 2IUH2_20.PDB 2.46036 -19.71000 -6.06000 -8.51000 -14.66000 -4.79000 20.92000 -17.68000 1.70000 8.93000 5.48000 0.00000 0.00000 0.00000 0.08000 0.75000 -0.27000 -1.30000 0.00000 -3.55000 0.00000 2.38000 123.00000 2IUH2_21.PDB 2.27054 -23.65000 -6.09000 -9.40000 -13.64000 -4.44000 18.49000 -17.24000 0.67000 8.39000 4.16000 0.00000 0.00000 0.00000 0.14000 0.76000 -0.29000 -1.31000 0.00000 -3.08000 0.00000 2.38000 123.00000 2IUH2_22.PDB 2.35212 -21.46000 -6.11000 -8.31000 -14.15000 -4.54000 19.13000 -17.73000 1.63000 8.04000 4.84000 0.00000 0.00000 0.00000 0.17000 0.72000 -0.29000 -1.08000 0.00000 -3.05000 0.00000 2.38000 123.00000 2IUH2_23.PDB 2.22905 -24.09000 -6.15000 -11.80000 -14.53000 -5.24000 21.48000 -17.43000 0.38000 9.42000 4.80000 0.00000 0.00000 0.00000 0.08000 0.76000 -0.29000 -1.18000 0.00000 -3.63000 0.00000 2.38000 123.00000 2IUH2_24.PDB 3.50027 -22.79000 -6.15000 -9.38000 -14.11000 -4.71000 20.36000 -17.29000 0.52000 7.87000 4.40000 0.00000 0.00000 0.00000 0.09000 0.75000 -0.30000 -0.78000 0.00000 -3.30000 0.00000 2.38000 123.00000 2IUH2_25.PDB 2.19766 -22.09000 -6.14000 -8.52000 -13.82000 -4.77000 19.30000 -17.34000 2.07000 8.09000 3.90000 0.00000 0.00000 0.00000 0.05000 0.82000 -0.29000 -1.36000 0.00000 -3.27000 0.00000 2.38000 123.00000 2IUH2_26.PDB 2.10183 -23.77000 -6.15000 -11.24000 -13.99000 -5.08000 20.59000 -17.04000 0.30000 8.91000 5.30000 0.00000 0.00000 0.00000 0.07000 0.61000 -0.27000 -1.66000 0.00000 -3.51000 0.00000 2.38000 123.00000 2IUH2_27.PDB 2.33541 -19.76000 -6.12000 -7.16000 -14.14000 -4.03000 18.69000 -17.47000 1.65000 7.45000 4.83000 0.00000 0.00000 0.00000 0.10000 0.83000 -0.29000 -0.94000 0.00000 -2.34000 0.00000 2.38000 123.00000 2IUH2_28.PDB 2.37386 -19.45000 -6.08000 -7.26000 -13.63000 -4.70000 18.93000 -16.59000 1.66000 7.48000 4.47000 0.00000 0.00000 0.00000 0.05000 0.77000 -0.29000 -0.90000 0.00000 -2.57000 0.00000 2.38000 123.00000 2IUH2_29.PDB 2.28281 -23.47000 -6.06000 -10.16000 -14.75000 -5.36000 21.64000 -17.91000 0.26000 8.91000 5.21000 0.00000 0.00000 0.00000 0.08000 0.68000 -0.28000 -1.40000 0.00000 -3.64000 0.00000 2.38000 123.00000 2IUH2_30.PDB 2.44870 -23.05000 -6.04000 -10.08000 -14.15000 -4.98000 20.28000 -17.36000 0.65000 8.90000 4.53000 0.00000 0.00000 0.00000 0.04000 0.73000 -0.29000 -1.27000 0.00000 -3.26000 0.00000 2.38000 123.00000