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 1LKK2_1.PDB -1.36000 -75.13000 -35.75000 -121.00000 -9.31000 164.32000 -146.21000 6.62000 69.21000 154.47000 0.00000 0.00000 0.00000 1.40000 50.13000 -0.37000 -6.38000 0.00000 -3.23000 0.00000 0.00000 109.00000 1LKK2_2.PDB -2.20000 -75.16000 -37.05000 -121.55000 -9.56000 165.69000 -146.85000 6.24000 70.81000 154.56000 0.00000 0.00000 0.00000 1.52000 50.04000 -0.37000 -6.68000 0.00000 -3.81000 0.00000 0.00000 109.00000 1LKK2_3.PDB -2.27000 -74.76000 -36.62000 -121.01000 -9.12000 165.26000 -146.08000 6.27000 69.20000 153.79000 0.00000 0.00000 0.00000 1.29000 50.02000 -0.36000 -6.54000 0.00000 -3.56000 0.00000 0.00000 109.00000 1LKK2_4.PDB -2.01000 -74.83000 -36.46000 -120.82000 -9.16000 164.95000 -146.39000 7.02000 69.34000 153.40000 0.00000 0.00000 0.00000 1.64000 50.05000 -0.37000 -6.68000 0.00000 -3.63000 0.00000 0.00000 109.00000 1LKK2_5.PDB -3.52000 -74.79000 -36.11000 -121.67000 -10.55000 166.42000 -146.74000 6.22000 69.58000 153.45000 0.00000 0.00000 0.00000 1.34000 50.12000 -0.36000 -6.51000 0.00000 -3.78000 0.00000 0.00000 109.00000 1LKK2_6.PDB -1.38000 -75.13000 -36.38000 -121.82000 -9.67000 166.47000 -147.36000 8.08000 70.37000 153.67000 0.00000 0.00000 0.00000 1.71000 50.04000 -0.42000 -7.06000 0.00000 -3.85000 0.00000 0.00000 109.00000 1LKK2_7.PDB -0.40000 -75.14000 -34.46000 -120.43000 -8.59000 162.95000 -145.89000 6.62000 68.44000 154.57000 0.00000 0.00000 0.00000 1.40000 50.07000 -0.37000 -6.52000 0.00000 -2.99000 0.00000 0.00000 109.00000 1LKK2_8.PDB -2.07000 -74.80000 -36.41000 -120.56000 -9.11000 165.01000 -145.89000 6.66000 68.61000 153.41000 0.00000 0.00000 0.00000 1.46000 50.03000 -0.36000 -6.51000 0.00000 -3.58000 0.00000 0.00000 109.00000 1LKK2_9.PDB -1.02000 -75.15000 -35.91000 -120.28000 -9.33000 164.35000 -145.35000 6.24000 68.74000 154.26000 0.00000 0.00000 0.00000 1.46000 50.10000 -0.37000 -6.44000 0.00000 -3.25000 0.00000 0.00000 109.00000 1LKK2_10.PDB 0.39000 -75.11000 -36.55000 -119.51000 -9.23000 164.42000 -144.09000 6.47000 68.65000 153.99000 0.00000 0.00000 0.00000 1.49000 49.76000 -0.37000 -6.11000 0.00000 -3.66000 0.00000 0.00000 109.00000 1LKK2_11.PDB 0.13000 -75.92000 -37.08000 -120.18000 -9.23000 165.77000 -144.78000 6.36000 69.10000 154.57000 0.00000 0.00000 0.00000 2.17000 50.07000 -0.39000 -6.71000 0.00000 -3.55000 0.00000 0.00000 109.00000 1LKK2_12.PDB -1.62000 -73.99000 -35.03000 -121.43000 -9.16000 164.07000 -147.05000 6.21000 68.64000 153.96000 0.00000 0.00000 0.00000 1.37000 50.14000 -0.34000 -6.25000 0.00000 -2.64000 0.00000 0.00000 109.00000 1LKK2_13.PDB -1.35000 -74.76000 -35.31000 -120.56000 -8.90000 163.86000 -145.76000 6.43000 68.28000 153.71000 0.00000 0.00000 0.00000 1.36000 50.16000 -0.36000 -6.54000 0.00000 -2.80000 0.00000 0.00000 109.00000 1LKK2_14.PDB -2.35000 -74.75000 -36.56000 -121.10000 -10.13000 166.51000 -146.43000 6.58000 69.67000 153.53000 0.00000 0.00000 0.00000 1.41000 50.02000 -0.36000 -6.62000 0.00000 -4.11000 0.00000 0.00000 109.00000 1LKK2_15.PDB -1.94000 -73.96000 -34.27000 -121.07000 -8.42000 162.83000 -146.81000 6.13000 68.08000 153.59000 0.00000 0.00000 0.00000 1.32000 50.03000 -0.34000 -6.39000 0.00000 -2.62000 0.00000 0.00000 109.00000 1LKK2_16.PDB 0.18000 -75.14000 -36.00000 -120.45000 -8.79000 164.63000 -146.00000 6.74000 69.19000 154.45000 0.00000 0.00000 0.00000 1.53000 50.01000 -0.37000 -6.42000 0.00000 -3.21000 0.00000 0.00000 109.00000 1LKK2_17.PDB -1.53000 -75.11000 -36.37000 -120.50000 -10.32000 165.63000 -145.49000 6.21000 69.44000 154.02000 0.00000 0.00000 0.00000 1.51000 49.81000 -0.37000 -6.38000 0.00000 -3.81000 0.00000 0.00000 109.00000 1LKK2_18.PDB -0.60000 -75.11000 -36.55000 -120.12000 -10.37000 165.92000 -144.75000 6.51000 69.32000 154.00000 0.00000 0.00000 0.00000 1.50000 49.75000 -0.37000 -6.38000 0.00000 -4.19000 0.00000 0.00000 109.00000 1LKK2_19.PDB 1.40000 -75.96000 -36.20000 -120.05000 -10.42000 166.67000 -144.33000 6.55000 69.91000 155.38000 0.00000 0.00000 0.00000 1.52000 49.92000 -0.39000 -7.13000 0.00000 -4.14000 0.00000 0.00000 109.00000 1LKK2_20.PDB -1.76000 -74.77000 -35.70000 -120.12000 -9.19000 164.35000 -145.02000 6.13000 67.82000 153.33000 0.00000 0.00000 0.00000 1.38000 50.10000 -0.36000 -6.41000 0.00000 -3.21000 0.00000 0.00000 109.00000 1LKK2_21.PDB -0.37000 -74.77000 -36.54000 -119.36000 -9.17000 164.68000 -143.78000 6.37000 67.95000 153.08000 0.00000 0.00000 0.00000 1.40000 49.78000 -0.36000 -6.29000 0.00000 -3.59000 0.00000 0.00000 109.00000 1LKK2_22.PDB 1.59000 -75.60000 -35.89000 -119.16000 -9.20000 164.77000 -143.24000 6.58000 67.97000 154.30000 0.00000 0.00000 0.00000 1.53000 49.92000 -0.38000 -6.54000 0.00000 -3.56000 0.00000 0.00000 109.00000 1LKK2_23.PDB -2.08000 -74.02000 -36.73000 -122.11000 -9.95000 166.32000 -147.76000 6.24000 70.55000 154.22000 0.00000 0.00000 0.00000 1.40000 50.06000 -0.34000 -6.29000 0.00000 -3.60000 0.00000 0.00000 109.00000 1LKK2_24.PDB -2.14000 -74.05000 -33.45000 -121.83000 -8.36000 163.51000 -148.05000 6.45000 68.55000 152.76000 0.00000 0.00000 0.00000 1.52000 50.07000 -0.34000 -6.52000 0.00000 -2.34000 0.00000 0.00000 109.00000 1LKK2_25.PDB -0.55000 -73.99000 -35.72000 -121.26000 -8.93000 164.97000 -147.20000 6.71000 68.84000 154.14000 0.00000 0.00000 0.00000 1.53000 50.03000 -0.34000 -6.27000 0.00000 -3.02000 0.00000 0.00000 109.00000 1LKK2_26.PDB 0.00000 -74.26000 -35.19000 -121.17000 -9.15000 163.98000 -146.66000 6.82000 68.55000 154.88000 0.00000 0.00000 0.00000 1.31000 50.15000 -0.34000 -6.12000 0.00000 -2.64000 0.00000 0.00000 109.00000 1LKK2_27.PDB -1.01000 -75.13000 -35.87000 -120.99000 -9.20000 164.30000 -146.35000 6.54000 69.57000 154.56000 0.00000 0.00000 0.00000 1.41000 50.13000 -0.37000 -6.46000 0.00000 -3.00000 0.00000 0.00000 109.00000 1LKK2_28.PDB -0.54000 -74.73000 -35.94000 -120.22000 -8.67000 164.49000 -145.65000 6.57000 68.49000 153.75000 0.00000 0.00000 0.00000 1.42000 50.03000 -0.36000 -6.53000 0.00000 -3.16000 0.00000 0.00000 109.00000 1LKK2_29.PDB -2.79000 -74.73000 -35.95000 -120.56000 -10.08000 165.29000 -145.57000 6.19000 68.72000 153.17000 0.00000 0.00000 0.00000 1.47000 50.12000 -0.36000 -6.75000 0.00000 -3.65000 0.00000 0.00000 109.00000 1LKK2_30.PDB -1.76000 -74.74000 -36.76000 -119.80000 -10.10000 165.54000 -144.31000 6.47000 68.57000 153.00000 0.00000 0.00000 0.00000 1.40000 49.78000 -0.36000 -6.64000 0.00000 -4.03000 0.00000 0.00000 109.00000