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 SLA1-D3_UJ0-CSK-15_1.PDB 2.39116 -8.14000 -1.97000 -4.85000 -9.38000 -3.12000 11.97000 -11.49000 2.71000 7.31000 3.18000 0.00000 0.00000 0.00000 0.33000 0.96000 0.00000 -0.57000 0.00000 -2.28000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_2.PDB 3.33424 -8.54000 -2.08000 -5.47000 -10.40000 -6.36000 15.96000 -11.45000 4.16000 7.77000 3.48000 0.00000 0.00000 0.00000 0.46000 1.01000 0.00000 -0.75000 0.00000 -3.86000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_3.PDB 1.80772 -9.09000 -1.95000 -5.67000 -9.16000 -3.04000 11.77000 -10.99000 2.68000 7.22000 3.33000 0.00000 0.00000 0.00000 0.15000 0.73000 0.00000 -1.17000 0.00000 -2.26000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_4.PDB 2.66198 -8.81000 -1.95000 -4.25000 -9.38000 -3.38000 11.76000 -11.55000 2.68000 7.14000 3.26000 0.00000 0.00000 0.00000 0.35000 0.98000 0.00000 -1.04000 0.00000 -2.44000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_5.PDB 2.17392 -8.76000 -2.05000 -4.27000 -9.94000 -3.52000 12.29000 -12.02000 3.22000 7.39000 3.11000 0.00000 0.00000 0.00000 0.19000 0.98000 0.00000 -0.91000 0.00000 -2.27000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_6.PDB 1.99032 -8.98000 -1.92000 -3.96000 -9.21000 -5.25000 13.72000 -9.65000 2.55000 6.88000 2.49000 0.00000 0.00000 0.00000 0.24000 0.88000 0.00000 -1.64000 0.00000 -3.23000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_7.PDB 2.52657 -8.47000 -1.96000 -5.11000 -9.55000 -3.16000 12.05000 -11.77000 2.89000 7.55000 3.27000 0.00000 0.00000 0.00000 0.32000 0.99000 0.00000 -0.68000 0.00000 -2.31000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_8.PDB 2.25423 -11.22000 -1.98000 -5.83000 -10.54000 -6.92000 16.18000 -11.57000 2.85000 8.25000 3.14000 0.00000 0.00000 0.00000 0.48000 0.99000 0.00000 -0.95000 0.00000 -4.33000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_9.PDB 2.50244 -8.34000 -1.98000 -4.32000 -9.36000 -3.10000 11.76000 -11.44000 2.53000 7.12000 3.31000 0.00000 0.00000 0.00000 0.25000 0.99000 0.00000 -0.85000 0.00000 -2.26000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_10.PDB 1.27191 -9.39000 -1.94000 -5.21000 -8.95000 -3.01000 11.11000 -10.88000 2.49000 7.15000 3.32000 0.00000 0.00000 0.00000 0.05000 0.71000 0.00000 -1.17000 0.00000 -2.35000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_11.PDB 2.33690 -11.93000 -1.99000 -4.42000 -9.85000 -7.14000 15.18000 -10.51000 2.44000 7.20000 2.61000 0.00000 0.00000 0.00000 0.19000 1.06000 0.00000 -1.44000 0.00000 -4.20000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_12.PDB 1.70134 -8.27000 -1.97000 -3.61000 -9.05000 -3.36000 11.91000 -11.05000 2.53000 6.47000 3.18000 0.00000 0.00000 0.00000 0.13000 0.72000 0.00000 -1.24000 0.00000 -2.20000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_13.PDB 2.60394 -9.38000 -2.01000 -3.06000 -10.04000 -5.70000 14.24000 -10.86000 2.89000 6.75000 2.28000 0.00000 0.00000 0.00000 0.41000 1.15000 0.00000 -0.90000 0.00000 -3.39000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_14.PDB 2.31672 -8.31000 -1.99000 -2.99000 -9.86000 -5.64000 15.18000 -10.84000 2.91000 6.83000 2.42000 0.00000 0.00000 0.00000 0.34000 1.19000 0.00000 -1.33000 0.00000 -3.34000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_15.PDB 1.62434 -10.20000 -1.98000 -5.22000 -9.60000 -5.91000 14.53000 -9.90000 2.68000 7.53000 2.67000 0.00000 0.00000 0.00000 0.16000 0.86000 0.00000 -1.43000 0.00000 -3.75000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_16.PDB 2.02075 -7.67000 -1.98000 -2.92000 -9.20000 -2.90000 11.83000 -11.42000 2.53000 6.23000 3.24000 0.00000 0.00000 0.00000 0.11000 0.86000 0.00000 -1.01000 0.00000 -2.16000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_17.PDB 1.57631 -7.51000 -1.95000 -3.87000 -9.15000 -3.21000 12.01000 -11.04000 2.57000 6.70000 3.24000 0.00000 0.00000 0.00000 0.26000 0.75000 0.00000 -0.96000 0.00000 -2.10000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_18.PDB 2.18983 -6.52000 -1.25000 -2.92000 -9.42000 -2.73000 10.94000 -11.99000 3.12000 6.58000 3.69000 0.00000 0.00000 0.00000 0.38000 0.94000 0.00000 -0.88000 0.00000 -2.04000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_19.PDB 1.68950 -7.00000 -1.95000 -3.47000 -8.75000 -2.34000 11.03000 -10.88000 2.61000 6.29000 3.21000 0.00000 0.00000 0.00000 0.19000 0.67000 0.00000 -0.95000 0.00000 -2.01000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_20.PDB 3.12691 -11.31000 -1.98000 -5.70000 -9.33000 -5.66000 14.01000 -9.92000 2.59000 7.01000 2.14000 0.00000 0.00000 0.00000 0.34000 0.84000 0.00000 -1.48000 0.00000 -3.32000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_21.PDB 1.78629 -8.16000 -2.04000 -2.96000 -9.29000 -3.69000 11.84000 -11.64000 2.55000 6.54000 3.76000 0.00000 0.00000 0.00000 0.16000 0.89000 0.00000 -0.63000 0.00000 -2.75000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_22.PDB 1.99778 -8.41000 -2.12000 -5.55000 -9.02000 -4.29000 13.60000 -9.87000 2.68000 7.32000 3.00000 0.00000 0.00000 0.00000 0.17000 0.66000 0.00000 -1.01000 0.00000 -3.31000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_23.PDB 2.58757 -7.30000 -2.09000 -2.47000 -9.23000 -2.40000 11.73000 -11.65000 2.84000 5.48000 3.15000 0.00000 0.00000 0.00000 0.27000 0.92000 0.00000 -0.93000 0.00000 -1.99000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_24.PDB 2.82008 -9.33000 -1.99000 -3.89000 -9.74000 -6.75000 15.00000 -10.22000 3.02000 7.14000 2.47000 0.00000 0.00000 0.00000 0.32000 1.01000 0.00000 -0.83000 0.00000 -3.85000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_25.PDB 2.19535 -8.45000 -1.94000 -3.49000 -9.51000 -5.27000 13.60000 -10.37000 3.27000 6.89000 2.27000 0.00000 0.00000 0.00000 0.20000 1.08000 0.00000 -0.95000 0.00000 -3.15000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_26.PDB 1.68466 -9.72000 -1.98000 -6.91000 -9.31000 -4.18000 13.62000 -10.39000 2.56000 8.61000 2.99000 0.00000 0.00000 0.00000 0.18000 0.73000 0.00000 -1.75000 0.00000 -3.16000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_27.PDB 1.66977 -9.33000 -1.18000 -4.83000 -9.00000 -3.63000 10.74000 -10.88000 2.36000 7.21000 3.69000 0.00000 0.00000 0.00000 0.09000 0.74000 0.00000 -1.44000 0.00000 -2.48000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_28.PDB 2.53284 -10.01000 -1.97000 -6.35000 -9.21000 -3.39000 11.82000 -11.00000 2.43000 7.62000 3.16000 0.00000 0.00000 0.00000 0.27000 0.74000 0.00000 -1.06000 0.00000 -2.33000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_29.PDB 2.46492 -8.00000 -1.23000 -4.56000 -9.30000 -3.91000 12.33000 -10.95000 3.05000 7.71000 2.44000 0.00000 0.00000 0.00000 0.39000 0.90000 0.00000 -0.71000 0.00000 -3.27000 0.00000 2.38000 67.00000 SLA1-D3_UJ0-CSK-15_30.PDB 2.15061 -11.82000 -1.99000 -6.46000 -10.68000 -6.94000 16.40000 -11.50000 3.19000 7.70000 2.97000 0.00000 0.00000 0.00000 0.35000 1.05000 0.00000 -0.89000 0.00000 -3.96000 0.00000 2.38000 67.00000