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 2AK52_1.PDB 1.16615 -13.87000 -1.11000 -4.79000 -7.44000 -2.57000 7.38000 -9.30000 0.61000 3.55000 1.15000 0.00000 0.00000 0.00000 0.10000 0.33000 0.00000 -0.15000 0.00000 -1.30000 0.00000 2.38000 72.00000 2AK52_2.PDB 1.27435 -13.79000 -1.12000 -4.84000 -7.35000 -2.50000 7.22000 -9.24000 0.66000 3.54000 1.12000 0.00000 0.00000 0.00000 0.11000 0.32000 0.00000 -0.13000 0.00000 -1.25000 0.00000 2.38000 72.00000 2AK52_3.PDB 0.94277 -13.89000 -1.07000 -5.04000 -7.45000 -2.54000 7.32000 -9.34000 0.85000 3.54000 1.12000 0.00000 0.00000 0.00000 0.08000 0.32000 0.00000 -0.13000 0.00000 -1.24000 0.00000 2.38000 72.00000 2AK52_4.PDB 1.39652 -13.77000 -1.12000 -4.95000 -7.93000 -2.55000 7.53000 -10.00000 0.76000 4.06000 1.79000 0.00000 0.00000 0.00000 0.20000 0.34000 0.00000 -0.28000 0.00000 -1.29000 0.00000 2.38000 72.00000 2AK52_5.PDB 1.10403 -13.92000 -1.10000 -4.89000 -7.47000 -2.51000 7.43000 -9.36000 0.55000 3.57000 1.15000 0.00000 0.00000 0.00000 0.09000 0.32000 0.00000 -0.14000 0.00000 -1.25000 0.00000 2.38000 72.00000 2AK52_6.PDB 1.27151 -13.62000 -1.11000 -4.93000 -7.30000 -2.51000 7.21000 -9.13000 0.80000 3.53000 1.11000 0.00000 0.00000 0.00000 0.10000 0.32000 0.00000 -0.15000 0.00000 -1.24000 0.00000 2.38000 72.00000 2AK52_7.PDB 1.46518 -13.90000 -1.07000 -4.96000 -8.02000 -2.52000 7.51000 -10.16000 0.77000 4.10000 1.84000 0.00000 0.00000 0.00000 0.18000 0.36000 0.00000 -0.34000 0.00000 -1.26000 0.00000 2.38000 72.00000 2AK52_8.PDB 1.14343 -13.32000 -1.07000 -4.32000 -7.44000 -2.34000 7.69000 -9.39000 0.38000 3.27000 1.16000 0.00000 0.00000 0.00000 0.08000 0.32000 0.00000 -0.16000 0.00000 -1.19000 0.00000 2.38000 72.00000 2AK52_9.PDB 1.59302 -14.03000 -1.12000 -5.03000 -7.76000 -2.46000 7.41000 -9.80000 0.34000 3.97000 1.77000 0.00000 0.00000 0.00000 0.13000 0.33000 0.00000 -0.28000 0.00000 -1.21000 0.00000 2.38000 72.00000 2AK52_10.PDB 1.17235 -13.73000 -1.12000 -4.89000 -7.42000 -2.47000 7.33000 -9.31000 0.67000 3.56000 1.16000 0.00000 0.00000 0.00000 0.10000 0.32000 0.00000 -0.15000 0.00000 -1.19000 0.00000 2.38000 72.00000 2AK52_11.PDB 1.06838 -13.93000 -1.14000 -5.05000 -7.35000 -2.50000 7.33000 -9.32000 0.80000 3.52000 1.07000 0.00000 0.00000 0.00000 0.09000 0.32000 0.00000 -0.15000 0.00000 -1.22000 0.00000 2.38000 72.00000 2AK52_12.PDB 1.20608 -12.53000 -1.07000 -4.70000 -7.38000 -2.51000 7.29000 -9.26000 0.66000 3.58000 2.19000 0.00000 0.00000 0.00000 0.11000 0.33000 0.00000 -0.15000 0.00000 -1.30000 0.00000 2.38000 72.00000 2AK52_13.PDB 1.13554 -12.98000 -1.15000 -5.00000 -7.24000 -2.54000 7.10000 -9.22000 0.75000 3.52000 2.12000 0.00000 0.00000 0.00000 0.11000 0.32000 0.00000 -0.16000 0.00000 -1.29000 0.00000 2.38000 72.00000 2AK52_14.PDB 1.21005 -13.55000 -1.13000 -4.53000 -7.40000 -2.36000 7.76000 -9.40000 0.50000 3.17000 1.08000 0.00000 0.00000 0.00000 0.09000 0.33000 0.00000 -0.16000 0.00000 -1.17000 0.00000 2.38000 72.00000 2AK52_15.PDB 1.05146 -12.78000 -1.13000 -5.03000 -7.34000 -2.49000 7.20000 -9.23000 0.76000 3.59000 2.19000 0.00000 0.00000 0.00000 0.09000 0.33000 0.00000 -0.16000 0.00000 -1.24000 0.00000 2.38000 72.00000 2AK52_16.PDB 1.05242 -12.86000 -1.14000 -4.95000 -7.33000 -2.52000 7.13000 -9.22000 0.70000 3.57000 2.22000 0.00000 0.00000 0.00000 0.09000 0.33000 0.00000 -0.15000 0.00000 -1.26000 0.00000 2.38000 72.00000 2AK52_17.PDB 1.08064 -12.67000 -1.13000 -4.93000 -7.27000 -2.48000 7.06000 -9.19000 0.74000 3.60000 2.19000 0.00000 0.00000 0.00000 0.10000 0.33000 0.00000 -0.16000 0.00000 -1.23000 0.00000 2.38000 72.00000 2AK52_18.PDB 1.09458 -12.31000 -1.08000 -4.42000 -7.41000 -2.40000 7.68000 -9.31000 0.44000 3.26000 2.21000 0.00000 0.00000 0.00000 0.08000 0.33000 0.00000 -0.14000 0.00000 -1.21000 0.00000 2.38000 72.00000 2AK52_19.PDB 1.33861 -12.98000 -1.14000 -5.04000 -7.15000 -2.58000 7.32000 -8.84000 0.79000 3.49000 1.59000 0.00000 0.00000 0.00000 0.10000 0.27000 0.00000 -0.22000 0.00000 -1.30000 0.00000 2.38000 72.00000 2AK52_20.PDB 1.32510 -13.19000 -1.14000 -4.76000 -7.84000 -2.45000 7.45000 -9.87000 0.90000 4.04000 1.86000 0.00000 0.00000 0.00000 0.15000 0.33000 0.00000 -0.31000 0.00000 -1.23000 0.00000 2.38000 72.00000 2AK52_21.PDB 1.12581 -12.50000 -1.09000 -4.39000 -7.27000 -2.46000 7.81000 -9.05000 0.46000 3.19000 1.73000 0.00000 0.00000 0.00000 0.09000 0.26000 0.00000 -0.24000 0.00000 -1.28000 0.00000 2.38000 72.00000 2AK52_22.PDB 1.35821 -13.98000 -1.12000 -4.96000 -7.93000 -2.49000 7.56000 -9.99000 0.69000 4.06000 1.57000 0.00000 0.00000 0.00000 0.18000 0.33000 0.00000 -0.33000 0.00000 -1.23000 0.00000 2.38000 72.00000 2AK52_23.PDB 1.32446 -13.60000 -1.11000 -4.74000 -7.94000 -2.48000 7.54000 -10.03000 0.61000 4.03000 1.87000 0.00000 0.00000 0.00000 0.17000 0.33000 0.00000 -0.30000 0.00000 -1.21000 0.00000 2.38000 72.00000 2AK52_24.PDB 1.10780 -12.97000 -1.14000 -4.92000 -7.24000 -2.57000 7.42000 -8.99000 0.67000 3.52000 1.68000 0.00000 0.00000 0.00000 0.09000 0.27000 0.00000 -0.23000 0.00000 -1.27000 0.00000 2.38000 72.00000 2AK52_25.PDB 1.31913 -13.44000 -1.08000 -4.86000 -7.38000 -2.56000 7.53000 -9.16000 0.64000 3.56000 1.49000 0.00000 0.00000 0.00000 0.09000 0.32000 0.00000 -0.32000 0.00000 -1.41000 0.00000 2.38000 72.00000 2AK52_26.PDB 1.32728 -13.82000 -1.12000 -4.90000 -7.92000 -2.45000 7.58000 -9.93000 0.62000 4.05000 1.61000 0.00000 0.00000 0.00000 0.18000 0.35000 0.00000 -0.34000 0.00000 -1.21000 0.00000 2.38000 72.00000 2AK52_27.PDB 1.25844 -12.50000 -1.08000 -4.56000 -7.73000 -2.11000 7.18000 -9.97000 0.17000 4.09000 2.78000 0.00000 0.00000 0.00000 0.17000 0.36000 0.00000 -0.18000 0.00000 -1.24000 0.00000 2.38000 72.00000 2AK52_28.PDB 1.29643 -13.27000 -1.13000 -4.78000 -7.82000 -2.44000 7.42000 -9.89000 0.87000 3.99000 1.82000 0.00000 0.00000 0.00000 0.15000 0.32000 0.00000 -0.26000 0.00000 -1.20000 0.00000 2.38000 72.00000 2AK52_29.PDB 1.11787 -12.64000 -1.06000 -4.90000 -7.44000 -2.41000 7.35000 -9.31000 0.62000 3.57000 2.22000 0.00000 0.00000 0.00000 0.09000 0.32000 0.00000 -0.13000 0.00000 -1.22000 0.00000 2.38000 72.00000 2AK52_30.PDB 1.33558 -12.32000 -1.13000 -4.53000 -7.57000 -2.14000 7.21000 -9.73000 0.18000 4.09000 2.66000 0.00000 0.00000 0.00000 0.15000 0.33000 0.00000 -0.26000 0.00000 -1.25000 0.00000 2.38000 72.00000