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 2AK53_1.PDB 1.21028 -13.79000 -2.12000 -4.99000 -8.55000 -2.90000 9.63000 -10.11000 0.34000 4.99000 2.46000 0.00000 0.00000 0.00000 0.06000 0.36000 0.00000 -0.84000 0.00000 -1.74000 0.00000 2.38000 68.00000 2AK53_2.PDB 1.28775 -12.94000 -2.16000 -5.03000 -8.11000 -2.88000 9.54000 -9.35000 0.23000 4.79000 2.46000 0.00000 0.00000 0.00000 0.02000 0.36000 0.00000 -0.70000 0.00000 -1.76000 0.00000 2.38000 68.00000 2AK53_3.PDB 1.20523 -14.45000 -2.15000 -5.75000 -8.43000 -2.89000 9.75000 -9.95000 0.21000 4.89000 2.42000 0.00000 0.00000 0.00000 0.05000 0.34000 0.00000 -0.88000 0.00000 -1.74000 0.00000 2.38000 68.00000 2AK53_4.PDB 1.24764 -14.08000 -2.15000 -5.05000 -8.53000 -2.90000 9.76000 -10.03000 0.18000 4.98000 2.23000 0.00000 0.00000 0.00000 0.05000 0.37000 0.00000 -0.84000 0.00000 -1.78000 0.00000 2.38000 68.00000 2AK53_5.PDB 1.13237 -13.16000 -2.15000 -5.00000 -7.96000 -2.97000 9.47000 -9.16000 0.19000 4.54000 2.43000 0.00000 0.00000 0.00000 0.04000 0.46000 0.00000 -0.86000 0.00000 -1.73000 0.00000 2.38000 68.00000 2AK53_6.PDB 1.55141 -12.81000 -2.13000 -5.25000 -7.92000 -2.54000 8.91000 -9.36000 0.26000 4.98000 2.38000 0.00000 0.00000 0.00000 0.10000 0.37000 0.00000 -0.51000 0.00000 -1.72000 0.00000 2.38000 68.00000 2AK53_7.PDB 1.14364 -14.04000 -2.16000 -5.16000 -8.25000 -2.95000 9.62000 -9.79000 0.17000 4.81000 2.07000 0.00000 0.00000 0.00000 0.08000 0.38000 0.00000 -0.72000 0.00000 -1.76000 0.00000 2.38000 68.00000 2AK53_8.PDB 1.20355 -14.84000 -2.14000 -5.70000 -8.59000 -2.84000 9.83000 -10.19000 0.20000 5.08000 1.86000 0.00000 0.00000 0.00000 0.07000 0.37000 0.00000 -0.73000 0.00000 -1.69000 0.00000 2.38000 68.00000 2AK53_9.PDB 1.45146 -14.82000 -2.16000 -5.80000 -8.52000 -3.03000 9.77000 -10.04000 0.37000 5.00000 1.89000 0.00000 0.00000 0.00000 0.05000 0.35000 0.00000 -0.57000 0.00000 -1.77000 0.00000 2.38000 68.00000 2AK53_10.PDB 0.89652 -13.65000 -2.12000 -5.11000 -7.63000 -2.88000 8.78000 -9.16000 0.11000 4.47000 2.30000 0.00000 0.00000 0.00000 0.04000 0.31000 0.00000 -0.67000 0.00000 -1.78000 0.00000 2.38000 68.00000 2AK53_11.PDB 0.89849 -13.72000 -2.15000 -5.67000 -7.31000 -2.93000 8.81000 -8.57000 0.06000 4.29000 2.27000 0.00000 0.00000 0.00000 0.02000 0.31000 0.00000 -0.79000 0.00000 -1.76000 0.00000 2.38000 68.00000 2AK53_12.PDB 0.90747 -13.67000 -2.10000 -4.98000 -7.65000 -2.87000 8.41000 -9.19000 0.06000 4.82000 2.43000 0.00000 0.00000 0.00000 0.05000 0.26000 0.00000 -0.91000 0.00000 -1.75000 0.00000 2.38000 68.00000 2AK53_13.PDB 1.49452 -14.05000 -2.65000 -6.26000 -8.30000 -2.86000 9.97000 -9.69000 0.28000 5.12000 2.75000 0.00000 0.00000 0.00000 0.05000 0.37000 0.00000 -0.73000 0.00000 -1.74000 0.00000 2.38000 68.00000 2AK53_14.PDB 1.39983 -13.50000 -2.63000 -5.60000 -8.33000 -2.86000 9.81000 -9.68000 0.22000 5.12000 2.79000 0.00000 0.00000 0.00000 0.06000 0.39000 0.00000 -0.65000 0.00000 -1.74000 0.00000 2.38000 68.00000 2AK53_15.PDB 1.43765 -12.30000 -2.12000 -4.87000 -7.76000 -2.76000 9.17000 -9.10000 0.10000 4.50000 2.89000 0.00000 0.00000 0.00000 0.04000 0.33000 0.00000 -0.67000 0.00000 -1.73000 0.00000 2.38000 68.00000 2AK53_16.PDB 1.21370 -14.41000 -2.13000 -5.64000 -7.60000 -2.85000 8.84000 -9.18000 0.13000 4.54000 1.77000 0.00000 0.00000 0.00000 0.06000 0.33000 0.00000 -0.61000 0.00000 -1.75000 0.00000 2.38000 68.00000 2AK53_17.PDB 1.05005 -13.78000 -2.15000 -5.20000 -7.57000 -2.54000 8.41000 -9.25000 0.08000 4.58000 1.74000 0.00000 0.00000 0.00000 0.08000 0.32000 0.00000 -0.28000 0.00000 -1.68000 0.00000 2.38000 68.00000 2AK53_18.PDB 0.91674 -14.58000 -2.14000 -5.71000 -7.73000 -2.98000 8.99000 -9.28000 0.06000 4.59000 1.92000 0.00000 0.00000 0.00000 0.06000 0.37000 0.00000 -0.62000 0.00000 -1.75000 0.00000 2.38000 68.00000 2AK53_19.PDB 0.97712 -13.38000 -2.15000 -5.36000 -7.44000 -2.57000 8.52000 -8.99000 0.07000 4.51000 2.10000 0.00000 0.00000 0.00000 0.07000 0.37000 0.00000 -0.44000 0.00000 -1.69000 0.00000 2.38000 68.00000 2AK53_20.PDB 1.02341 -14.09000 -2.16000 -5.82000 -7.58000 -2.92000 8.99000 -9.03000 0.27000 4.49000 2.17000 0.00000 0.00000 0.00000 0.02000 0.37000 0.00000 -0.76000 0.00000 -1.76000 0.00000 2.38000 68.00000 2AK53_21.PDB 1.19060 -14.22000 -2.18000 -5.80000 -7.62000 -3.00000 9.04000 -9.04000 0.10000 4.50000 2.18000 0.00000 0.00000 0.00000 0.07000 0.41000 0.00000 -0.73000 0.00000 -1.75000 0.00000 2.38000 68.00000 2AK53_22.PDB 1.91921 -14.61000 -2.11000 -6.88000 -8.26000 -2.69000 10.21000 -10.02000 0.28000 4.88000 2.34000 0.00000 0.00000 0.00000 0.10000 0.30000 0.00000 -0.73000 0.00000 -1.72000 0.00000 2.38000 68.00000 2AK53_23.PDB 1.24357 -14.07000 -2.14000 -5.71000 -8.54000 -2.93000 10.18000 -10.25000 0.25000 4.99000 2.55000 0.00000 0.00000 0.00000 0.06000 0.35000 0.00000 -0.84000 0.00000 -1.68000 0.00000 2.38000 68.00000 2AK53_24.PDB 1.22363 -14.20000 -2.43000 -5.97000 -8.51000 -2.89000 10.30000 -10.18000 0.25000 5.22000 2.41000 0.00000 0.00000 0.00000 0.05000 0.35000 0.00000 -0.79000 0.00000 -1.67000 0.00000 2.38000 68.00000 2AK53_25.PDB 1.61497 -14.64000 -2.62000 -6.23000 -8.71000 -2.87000 10.13000 -10.05000 0.34000 5.51000 1.89000 0.00000 0.00000 0.00000 0.07000 0.33000 0.00000 -0.36000 0.00000 -1.75000 0.00000 2.38000 68.00000 2AK53_26.PDB 1.47384 -12.57000 -2.11000 -5.08000 -7.71000 -2.78000 8.79000 -9.02000 0.21000 4.82000 2.30000 0.00000 0.00000 0.00000 0.06000 0.31000 0.00000 -0.29000 0.00000 -1.76000 0.00000 2.38000 68.00000 2AK53_27.PDB 1.52308 -14.82000 -2.65000 -5.55000 -8.75000 -2.91000 10.14000 -10.08000 0.34000 5.22000 1.90000 0.00000 0.00000 0.00000 0.05000 0.42000 0.00000 -0.77000 0.00000 -1.75000 0.00000 2.38000 68.00000 2AK53_28.PDB 1.22156 -13.86000 -2.16000 -5.63000 -8.42000 -2.89000 9.88000 -9.72000 0.23000 4.92000 2.48000 0.00000 0.00000 0.00000 0.02000 0.34000 0.00000 -0.82000 0.00000 -1.73000 0.00000 2.38000 68.00000 2AK53_29.PDB 1.18066 -13.62000 -2.14000 -5.69000 -8.57000 -2.92000 9.75000 -9.91000 0.23000 5.37000 2.50000 0.00000 0.00000 0.00000 0.02000 0.28000 0.00000 -0.54000 0.00000 -1.74000 0.00000 2.38000 68.00000 2AK53_30.PDB 1.16494 -14.00000 -2.17000 -5.78000 -8.49000 -3.00000 9.94000 -9.75000 0.29000 4.94000 2.50000 0.00000 0.00000 0.00000 0.02000 0.34000 0.00000 -0.75000 0.00000 -1.76000 0.00000 2.38000 68.00000