├── .DS_Store ├── EvoEF1 ├── .DS_Store ├── LICENSE ├── build.sh ├── library │ ├── param_charmm19_lk_ref2015.prm │ ├── param_charmm22.prm │ ├── rotlib11810.txt │ ├── rotlib3222.txt │ ├── rotlib7421.txt │ ├── rotlib984.txt │ ├── top_all22_prot.inp │ └── top_polh19_prot.inp └── src │ ├── Atom.cpp │ ├── Atom.h │ ├── AtomParamsSet.cpp │ ├── AtomParamsSet.h │ ├── Chain.cpp │ ├── Chain.h │ ├── DesignSite.cpp │ ├── DesignSite.h │ ├── EEF1Parameter.cpp │ ├── EEF1Parameter.h │ ├── EnergyComputation.cpp │ ├── EnergyComputation.h │ ├── EnergyFunction.cpp │ ├── EnergyFunction.h │ ├── ErrorHandling.cpp │ ├── ErrorHandling.h │ ├── FOLDEFParameter.cpp │ ├── FOLDEFParameter.h │ ├── GeometryCalc.cpp │ ├── GeometryCalc.h │ ├── Getopt.cpp │ ├── Getopt.h │ ├── Main.cpp │ ├── ProgramFunction.cpp │ ├── ProgramFunction.h │ ├── Residue.cpp │ ├── Residue.h │ ├── ResidueTopology.cpp │ ├── ResidueTopology.h │ ├── Rotamer.cpp │ ├── Rotamer.h │ ├── Structure.cpp │ ├── Structure.h │ ├── Utility.cpp │ └── Utility.h ├── LICENSE ├── README.md ├── VERSION ├── example-input ├── complex.pdb └── complex_chain_D_pssm.csv ├── example-output ├── complex_chain_D_PositionSpecificBoxPlot.png ├── complex_chain_D_PositionSpecificBoxPlot.svg ├── complex_chain_D_ResidueSpecificBoxPlot.png ├── complex_chain_D_ResidueSpecificBoxPlot.svg ├── complex_chain_D_boxplot.png ├── complex_chain_D_boxplot.svg ├── complex_chain_D_depleting_mutations ├── complex_chain_D_enriching_mutations ├── complex_chain_D_heatmap.png ├── complex_chain_D_heatmap.svg ├── complex_chain_D_interface_aa_list ├── complex_chain_D_mutation_list ├── complex_chain_D_proton_scores ├── complex_chain_D_stabilizing_depleting_mutations ├── complex_chain_D_stabilizing_enriching_mutations ├── complex_pairwise_distance_list ├── heatmap_df ├── mutation_models │ ├── complex_Repair_Model_AD72C.pdb │ ├── complex_Repair_Model_AD72D.pdb │ ├── complex_Repair_Model_AD72E.pdb │ ├── complex_Repair_Model_AD72F.pdb │ ├── complex_Repair_Model_AD72G.pdb │ ├── complex_Repair_Model_AD72H.pdb │ ├── complex_Repair_Model_AD72I.pdb │ ├── complex_Repair_Model_AD72K.pdb │ ├── complex_Repair_Model_AD72L.pdb │ ├── complex_Repair_Model_AD72M.pdb │ ├── complex_Repair_Model_AD72N.pdb │ ├── complex_Repair_Model_AD72P.pdb │ ├── complex_Repair_Model_AD72Q.pdb │ ├── complex_Repair_Model_AD72R.pdb │ ├── complex_Repair_Model_AD72S.pdb │ ├── complex_Repair_Model_AD72T.pdb │ ├── complex_Repair_Model_AD72V.pdb │ ├── complex_Repair_Model_AD72W.pdb │ ├── complex_Repair_Model_AD72Y.pdb │ ├── complex_Repair_Model_DD73A.pdb │ ├── complex_Repair_Model_DD73C.pdb │ ├── complex_Repair_Model_DD73E.pdb │ ├── complex_Repair_Model_DD73F.pdb │ ├── complex_Repair_Model_DD73G.pdb │ ├── complex_Repair_Model_DD73H.pdb │ ├── complex_Repair_Model_DD73I.pdb │ ├── complex_Repair_Model_DD73K.pdb │ ├── complex_Repair_Model_DD73L.pdb │ ├── complex_Repair_Model_DD73M.pdb │ ├── complex_Repair_Model_DD73N.pdb │ ├── complex_Repair_Model_DD73P.pdb │ ├── complex_Repair_Model_DD73Q.pdb │ ├── complex_Repair_Model_DD73R.pdb │ ├── complex_Repair_Model_DD73S.pdb │ ├── complex_Repair_Model_DD73T.pdb │ ├── complex_Repair_Model_DD73V.pdb │ ├── complex_Repair_Model_DD73W.pdb │ ├── complex_Repair_Model_DD73Y.pdb │ ├── complex_Repair_Model_DD84A.pdb │ ├── complex_Repair_Model_DD84C.pdb │ ├── complex_Repair_Model_DD84E.pdb │ ├── complex_Repair_Model_DD84F.pdb │ ├── complex_Repair_Model_DD84G.pdb │ ├── complex_Repair_Model_DD84H.pdb │ ├── complex_Repair_Model_DD84I.pdb │ ├── complex_Repair_Model_DD84K.pdb │ ├── complex_Repair_Model_DD84L.pdb │ ├── complex_Repair_Model_DD84M.pdb │ ├── complex_Repair_Model_DD84N.pdb │ ├── complex_Repair_Model_DD84P.pdb │ ├── complex_Repair_Model_DD84Q.pdb │ ├── complex_Repair_Model_DD84R.pdb │ ├── complex_Repair_Model_DD84S.pdb │ ├── complex_Repair_Model_DD84T.pdb │ ├── complex_Repair_Model_DD84V.pdb │ ├── complex_Repair_Model_DD84W.pdb │ ├── complex_Repair_Model_DD84Y.pdb │ ├── complex_Repair_Model_ED56A.pdb │ ├── complex_Repair_Model_ED56C.pdb │ ├── complex_Repair_Model_ED56D.pdb │ ├── complex_Repair_Model_ED56F.pdb │ ├── complex_Repair_Model_ED56G.pdb │ ├── complex_Repair_Model_ED56H.pdb │ ├── complex_Repair_Model_ED56I.pdb │ ├── complex_Repair_Model_ED56K.pdb │ ├── complex_Repair_Model_ED56L.pdb │ ├── complex_Repair_Model_ED56M.pdb │ ├── complex_Repair_Model_ED56N.pdb │ ├── complex_Repair_Model_ED56P.pdb │ ├── complex_Repair_Model_ED56Q.pdb │ ├── complex_Repair_Model_ED56R.pdb │ ├── complex_Repair_Model_ED56S.pdb │ ├── complex_Repair_Model_ED56T.pdb │ ├── complex_Repair_Model_ED56V.pdb │ ├── complex_Repair_Model_ED56W.pdb │ ├── complex_Repair_Model_ED56Y.pdb │ ├── complex_Repair_Model_ED59A.pdb │ ├── complex_Repair_Model_ED59C.pdb │ ├── complex_Repair_Model_ED59D.pdb │ ├── complex_Repair_Model_ED59F.pdb │ ├── complex_Repair_Model_ED59G.pdb │ ├── complex_Repair_Model_ED59H.pdb │ ├── complex_Repair_Model_ED59I.pdb │ ├── complex_Repair_Model_ED59K.pdb │ ├── complex_Repair_Model_ED59L.pdb │ ├── complex_Repair_Model_ED59M.pdb │ ├── complex_Repair_Model_ED59N.pdb │ ├── complex_Repair_Model_ED59P.pdb │ ├── complex_Repair_Model_ED59Q.pdb │ ├── complex_Repair_Model_ED59R.pdb │ ├── complex_Repair_Model_ED59S.pdb │ ├── complex_Repair_Model_ED59T.pdb │ ├── complex_Repair_Model_ED59V.pdb │ ├── complex_Repair_Model_ED59W.pdb │ ├── complex_Repair_Model_ED59Y.pdb │ ├── complex_Repair_Model_ED70A.pdb │ ├── complex_Repair_Model_ED70C.pdb │ ├── complex_Repair_Model_ED70D.pdb │ ├── complex_Repair_Model_ED70F.pdb │ ├── complex_Repair_Model_ED70G.pdb │ ├── complex_Repair_Model_ED70H.pdb │ ├── complex_Repair_Model_ED70I.pdb │ ├── complex_Repair_Model_ED70K.pdb │ ├── complex_Repair_Model_ED70L.pdb │ ├── complex_Repair_Model_ED70M.pdb │ ├── complex_Repair_Model_ED70N.pdb │ ├── complex_Repair_Model_ED70P.pdb │ ├── complex_Repair_Model_ED70Q.pdb │ ├── complex_Repair_Model_ED70R.pdb │ ├── complex_Repair_Model_ED70S.pdb │ ├── complex_Repair_Model_ED70T.pdb │ ├── complex_Repair_Model_ED70V.pdb │ ├── complex_Repair_Model_ED70W.pdb │ ├── complex_Repair_Model_ED70Y.pdb │ ├── complex_Repair_Model_ED83A.pdb │ ├── complex_Repair_Model_ED83C.pdb │ ├── complex_Repair_Model_ED83D.pdb │ ├── complex_Repair_Model_ED83F.pdb │ ├── complex_Repair_Model_ED83G.pdb │ ├── complex_Repair_Model_ED83H.pdb │ ├── complex_Repair_Model_ED83I.pdb │ ├── complex_Repair_Model_ED83K.pdb │ ├── complex_Repair_Model_ED83L.pdb │ ├── complex_Repair_Model_ED83M.pdb │ ├── complex_Repair_Model_ED83N.pdb │ ├── complex_Repair_Model_ED83P.pdb │ ├── complex_Repair_Model_ED83Q.pdb │ ├── complex_Repair_Model_ED83R.pdb │ ├── complex_Repair_Model_ED83S.pdb │ ├── complex_Repair_Model_ED83T.pdb │ ├── complex_Repair_Model_ED83V.pdb │ ├── complex_Repair_Model_ED83W.pdb │ ├── complex_Repair_Model_ED83Y.pdb │ ├── complex_Repair_Model_ED85A.pdb │ ├── complex_Repair_Model_ED85C.pdb │ ├── complex_Repair_Model_ED85D.pdb │ ├── complex_Repair_Model_ED85F.pdb │ ├── complex_Repair_Model_ED85G.pdb │ ├── complex_Repair_Model_ED85H.pdb │ ├── complex_Repair_Model_ED85I.pdb │ ├── complex_Repair_Model_ED85K.pdb │ ├── complex_Repair_Model_ED85L.pdb │ ├── complex_Repair_Model_ED85M.pdb │ ├── complex_Repair_Model_ED85N.pdb │ ├── complex_Repair_Model_ED85P.pdb │ ├── complex_Repair_Model_ED85Q.pdb │ ├── complex_Repair_Model_ED85R.pdb │ ├── complex_Repair_Model_ED85S.pdb │ ├── complex_Repair_Model_ED85T.pdb │ ├── complex_Repair_Model_ED85V.pdb │ ├── complex_Repair_Model_ED85W.pdb │ ├── complex_Repair_Model_ED85Y.pdb │ ├── complex_Repair_Model_GD82A.pdb │ ├── complex_Repair_Model_GD82C.pdb │ ├── complex_Repair_Model_GD82D.pdb │ ├── complex_Repair_Model_GD82E.pdb │ ├── complex_Repair_Model_GD82F.pdb │ ├── complex_Repair_Model_GD82H.pdb │ ├── complex_Repair_Model_GD82I.pdb │ ├── complex_Repair_Model_GD82K.pdb │ ├── complex_Repair_Model_GD82L.pdb │ ├── complex_Repair_Model_GD82M.pdb │ ├── complex_Repair_Model_GD82N.pdb │ ├── complex_Repair_Model_GD82P.pdb │ ├── complex_Repair_Model_GD82Q.pdb │ ├── complex_Repair_Model_GD82R.pdb │ ├── complex_Repair_Model_GD82S.pdb │ ├── complex_Repair_Model_GD82T.pdb │ ├── complex_Repair_Model_GD82V.pdb │ ├── complex_Repair_Model_GD82W.pdb │ ├── complex_Repair_Model_GD82Y.pdb │ ├── complex_Repair_Model_HD61A.pdb │ ├── complex_Repair_Model_HD61C.pdb │ ├── complex_Repair_Model_HD61D.pdb │ ├── complex_Repair_Model_HD61E.pdb │ ├── complex_Repair_Model_HD61F.pdb │ ├── complex_Repair_Model_HD61G.pdb │ ├── complex_Repair_Model_HD61I.pdb │ ├── complex_Repair_Model_HD61K.pdb │ ├── complex_Repair_Model_HD61L.pdb │ ├── complex_Repair_Model_HD61M.pdb │ ├── complex_Repair_Model_HD61N.pdb │ ├── complex_Repair_Model_HD61P.pdb │ ├── complex_Repair_Model_HD61Q.pdb │ ├── complex_Repair_Model_HD61R.pdb │ ├── complex_Repair_Model_HD61S.pdb │ ├── complex_Repair_Model_HD61T.pdb │ ├── complex_Repair_Model_HD61V.pdb │ ├── complex_Repair_Model_HD61W.pdb │ ├── complex_Repair_Model_HD61Y.pdb │ ├── complex_Repair_Model_ID90A.pdb │ ├── complex_Repair_Model_ID90C.pdb │ ├── complex_Repair_Model_ID90D.pdb │ ├── complex_Repair_Model_ID90E.pdb │ ├── complex_Repair_Model_ID90F.pdb │ ├── complex_Repair_Model_ID90G.pdb │ ├── complex_Repair_Model_ID90H.pdb │ ├── complex_Repair_Model_ID90K.pdb │ ├── complex_Repair_Model_ID90L.pdb │ ├── complex_Repair_Model_ID90M.pdb │ ├── complex_Repair_Model_ID90N.pdb │ ├── complex_Repair_Model_ID90P.pdb │ ├── complex_Repair_Model_ID90Q.pdb │ ├── complex_Repair_Model_ID90R.pdb │ ├── complex_Repair_Model_ID90S.pdb │ ├── complex_Repair_Model_ID90T.pdb │ ├── complex_Repair_Model_ID90V.pdb │ ├── complex_Repair_Model_ID90W.pdb │ ├── complex_Repair_Model_ID90Y.pdb │ ├── complex_Repair_Model_LD71A.pdb │ ├── complex_Repair_Model_LD71C.pdb │ ├── complex_Repair_Model_LD71D.pdb │ ├── complex_Repair_Model_LD71E.pdb │ ├── complex_Repair_Model_LD71F.pdb │ ├── complex_Repair_Model_LD71G.pdb │ ├── complex_Repair_Model_LD71H.pdb │ ├── complex_Repair_Model_LD71I.pdb │ ├── complex_Repair_Model_LD71K.pdb │ ├── complex_Repair_Model_LD71M.pdb │ ├── complex_Repair_Model_LD71N.pdb │ ├── complex_Repair_Model_LD71P.pdb │ ├── complex_Repair_Model_LD71Q.pdb │ ├── complex_Repair_Model_LD71R.pdb │ ├── complex_Repair_Model_LD71S.pdb │ ├── complex_Repair_Model_LD71T.pdb │ ├── complex_Repair_Model_LD71V.pdb │ ├── complex_Repair_Model_LD71W.pdb │ ├── complex_Repair_Model_LD71Y.pdb │ ├── complex_Repair_Model_LD81A.pdb │ ├── complex_Repair_Model_LD81C.pdb │ ├── complex_Repair_Model_LD81D.pdb │ ├── complex_Repair_Model_LD81E.pdb │ ├── complex_Repair_Model_LD81F.pdb │ ├── complex_Repair_Model_LD81G.pdb │ ├── complex_Repair_Model_LD81H.pdb │ ├── complex_Repair_Model_LD81I.pdb │ ├── complex_Repair_Model_LD81K.pdb │ ├── complex_Repair_Model_LD81M.pdb │ ├── complex_Repair_Model_LD81N.pdb │ ├── complex_Repair_Model_LD81P.pdb │ ├── complex_Repair_Model_LD81Q.pdb │ ├── complex_Repair_Model_LD81R.pdb │ ├── complex_Repair_Model_LD81S.pdb │ ├── complex_Repair_Model_LD81T.pdb │ ├── complex_Repair_Model_LD81V.pdb │ ├── complex_Repair_Model_LD81W.pdb │ ├── complex_Repair_Model_LD81Y.pdb │ ├── complex_Repair_Model_PD57A.pdb │ ├── complex_Repair_Model_PD57C.pdb │ ├── complex_Repair_Model_PD57D.pdb │ ├── complex_Repair_Model_PD57E.pdb │ ├── complex_Repair_Model_PD57F.pdb │ ├── complex_Repair_Model_PD57G.pdb │ ├── complex_Repair_Model_PD57H.pdb │ ├── complex_Repair_Model_PD57I.pdb │ ├── complex_Repair_Model_PD57K.pdb │ ├── complex_Repair_Model_PD57L.pdb │ ├── complex_Repair_Model_PD57M.pdb │ ├── complex_Repair_Model_PD57N.pdb │ ├── complex_Repair_Model_PD57Q.pdb │ ├── complex_Repair_Model_PD57R.pdb │ ├── complex_Repair_Model_PD57S.pdb │ ├── complex_Repair_Model_PD57T.pdb │ ├── complex_Repair_Model_PD57V.pdb │ ├── complex_Repair_Model_PD57W.pdb │ ├── complex_Repair_Model_PD57Y.pdb │ ├── complex_Repair_Model_PD80A.pdb │ ├── complex_Repair_Model_PD80C.pdb │ ├── complex_Repair_Model_PD80D.pdb │ ├── complex_Repair_Model_PD80E.pdb │ ├── complex_Repair_Model_PD80F.pdb │ ├── complex_Repair_Model_PD80G.pdb │ ├── complex_Repair_Model_PD80H.pdb │ ├── complex_Repair_Model_PD80I.pdb │ ├── complex_Repair_Model_PD80K.pdb │ ├── complex_Repair_Model_PD80L.pdb │ ├── complex_Repair_Model_PD80M.pdb │ ├── complex_Repair_Model_PD80N.pdb │ ├── complex_Repair_Model_PD80Q.pdb │ ├── complex_Repair_Model_PD80R.pdb │ ├── complex_Repair_Model_PD80S.pdb │ ├── complex_Repair_Model_PD80T.pdb │ ├── complex_Repair_Model_PD80V.pdb │ ├── complex_Repair_Model_PD80W.pdb │ ├── complex_Repair_Model_PD80Y.pdb │ ├── complex_Repair_Model_QD50A.pdb │ ├── complex_Repair_Model_QD50C.pdb │ ├── complex_Repair_Model_QD50D.pdb │ ├── complex_Repair_Model_QD50E.pdb │ ├── complex_Repair_Model_QD50F.pdb │ ├── complex_Repair_Model_QD50G.pdb │ ├── complex_Repair_Model_QD50H.pdb │ ├── complex_Repair_Model_QD50I.pdb │ ├── complex_Repair_Model_QD50K.pdb │ ├── complex_Repair_Model_QD50L.pdb │ ├── complex_Repair_Model_QD50M.pdb │ ├── complex_Repair_Model_QD50N.pdb │ ├── complex_Repair_Model_QD50P.pdb │ ├── complex_Repair_Model_QD50R.pdb │ ├── complex_Repair_Model_QD50S.pdb │ ├── complex_Repair_Model_QD50T.pdb │ ├── complex_Repair_Model_QD50V.pdb │ ├── complex_Repair_Model_QD50W.pdb │ ├── complex_Repair_Model_QD50Y.pdb │ ├── complex_Repair_Model_QD76A.pdb │ ├── complex_Repair_Model_QD76C.pdb │ ├── complex_Repair_Model_QD76D.pdb │ ├── complex_Repair_Model_QD76E.pdb │ ├── complex_Repair_Model_QD76F.pdb │ ├── complex_Repair_Model_QD76G.pdb │ ├── complex_Repair_Model_QD76H.pdb │ ├── complex_Repair_Model_QD76I.pdb │ ├── complex_Repair_Model_QD76K.pdb │ ├── complex_Repair_Model_QD76L.pdb │ ├── complex_Repair_Model_QD76M.pdb │ ├── complex_Repair_Model_QD76N.pdb │ ├── complex_Repair_Model_QD76P.pdb │ ├── complex_Repair_Model_QD76R.pdb │ ├── complex_Repair_Model_QD76S.pdb │ ├── complex_Repair_Model_QD76T.pdb │ ├── complex_Repair_Model_QD76V.pdb │ ├── complex_Repair_Model_QD76W.pdb │ ├── complex_Repair_Model_QD76Y.pdb │ ├── complex_Repair_Model_QD78A.pdb │ ├── complex_Repair_Model_QD78C.pdb │ ├── complex_Repair_Model_QD78D.pdb │ ├── complex_Repair_Model_QD78E.pdb │ ├── complex_Repair_Model_QD78F.pdb │ ├── complex_Repair_Model_QD78G.pdb │ ├── complex_Repair_Model_QD78H.pdb │ ├── complex_Repair_Model_QD78I.pdb │ ├── complex_Repair_Model_QD78K.pdb │ ├── complex_Repair_Model_QD78L.pdb │ ├── complex_Repair_Model_QD78M.pdb │ ├── complex_Repair_Model_QD78N.pdb │ ├── complex_Repair_Model_QD78P.pdb │ ├── complex_Repair_Model_QD78R.pdb │ ├── complex_Repair_Model_QD78S.pdb │ ├── complex_Repair_Model_QD78T.pdb │ ├── complex_Repair_Model_QD78V.pdb │ ├── complex_Repair_Model_QD78W.pdb │ ├── complex_Repair_Model_QD78Y.pdb │ ├── complex_Repair_Model_QD94A.pdb │ ├── complex_Repair_Model_QD94C.pdb │ ├── complex_Repair_Model_QD94D.pdb │ ├── complex_Repair_Model_QD94E.pdb │ ├── complex_Repair_Model_QD94F.pdb │ ├── complex_Repair_Model_QD94G.pdb │ ├── complex_Repair_Model_QD94H.pdb │ ├── complex_Repair_Model_QD94I.pdb │ ├── complex_Repair_Model_QD94K.pdb │ ├── complex_Repair_Model_QD94L.pdb │ ├── complex_Repair_Model_QD94M.pdb │ ├── complex_Repair_Model_QD94N.pdb │ ├── complex_Repair_Model_QD94P.pdb │ ├── complex_Repair_Model_QD94R.pdb │ ├── complex_Repair_Model_QD94S.pdb │ ├── complex_Repair_Model_QD94T.pdb │ ├── complex_Repair_Model_QD94V.pdb │ ├── complex_Repair_Model_QD94W.pdb │ ├── complex_Repair_Model_QD94Y.pdb │ ├── complex_Repair_Model_RD48A.pdb │ ├── complex_Repair_Model_RD48C.pdb │ ├── complex_Repair_Model_RD48D.pdb │ ├── complex_Repair_Model_RD48E.pdb │ ├── complex_Repair_Model_RD48F.pdb │ ├── complex_Repair_Model_RD48G.pdb │ ├── complex_Repair_Model_RD48H.pdb │ ├── complex_Repair_Model_RD48I.pdb │ ├── complex_Repair_Model_RD48K.pdb │ ├── complex_Repair_Model_RD48L.pdb │ ├── complex_Repair_Model_RD48M.pdb │ ├── complex_Repair_Model_RD48N.pdb │ ├── complex_Repair_Model_RD48P.pdb │ ├── complex_Repair_Model_RD48Q.pdb │ ├── complex_Repair_Model_RD48S.pdb │ ├── complex_Repair_Model_RD48T.pdb │ ├── complex_Repair_Model_RD48V.pdb │ ├── complex_Repair_Model_RD48W.pdb │ ├── complex_Repair_Model_RD48Y.pdb │ ├── complex_Repair_Model_RD96A.pdb │ ├── complex_Repair_Model_RD96C.pdb │ ├── complex_Repair_Model_RD96D.pdb │ ├── complex_Repair_Model_RD96E.pdb │ ├── complex_Repair_Model_RD96F.pdb │ ├── complex_Repair_Model_RD96G.pdb │ ├── complex_Repair_Model_RD96H.pdb │ ├── complex_Repair_Model_RD96I.pdb │ ├── complex_Repair_Model_RD96K.pdb │ ├── complex_Repair_Model_RD96L.pdb │ ├── complex_Repair_Model_RD96M.pdb │ ├── complex_Repair_Model_RD96N.pdb │ ├── complex_Repair_Model_RD96P.pdb │ ├── complex_Repair_Model_RD96Q.pdb │ ├── complex_Repair_Model_RD96S.pdb │ ├── complex_Repair_Model_RD96T.pdb │ ├── complex_Repair_Model_RD96V.pdb │ ├── complex_Repair_Model_RD96W.pdb │ ├── complex_Repair_Model_RD96Y.pdb │ ├── complex_Repair_Model_SD74A.pdb │ ├── complex_Repair_Model_SD74C.pdb │ ├── complex_Repair_Model_SD74D.pdb │ ├── complex_Repair_Model_SD74E.pdb │ ├── complex_Repair_Model_SD74F.pdb │ ├── complex_Repair_Model_SD74G.pdb │ ├── complex_Repair_Model_SD74H.pdb │ ├── complex_Repair_Model_SD74I.pdb │ ├── complex_Repair_Model_SD74K.pdb │ ├── complex_Repair_Model_SD74L.pdb │ ├── complex_Repair_Model_SD74M.pdb │ ├── complex_Repair_Model_SD74N.pdb │ ├── complex_Repair_Model_SD74P.pdb │ ├── complex_Repair_Model_SD74Q.pdb │ ├── complex_Repair_Model_SD74R.pdb │ ├── complex_Repair_Model_SD74T.pdb │ ├── complex_Repair_Model_SD74V.pdb │ ├── complex_Repair_Model_SD74W.pdb │ ├── complex_Repair_Model_SD74Y.pdb │ ├── complex_Repair_Model_TD75A.pdb │ ├── complex_Repair_Model_TD75C.pdb │ ├── complex_Repair_Model_TD75D.pdb │ ├── complex_Repair_Model_TD75E.pdb │ ├── complex_Repair_Model_TD75F.pdb │ ├── complex_Repair_Model_TD75G.pdb │ ├── complex_Repair_Model_TD75H.pdb │ ├── complex_Repair_Model_TD75I.pdb │ ├── complex_Repair_Model_TD75K.pdb │ ├── complex_Repair_Model_TD75L.pdb │ ├── complex_Repair_Model_TD75M.pdb │ ├── complex_Repair_Model_TD75N.pdb │ ├── complex_Repair_Model_TD75P.pdb │ ├── complex_Repair_Model_TD75Q.pdb │ ├── complex_Repair_Model_TD75R.pdb │ ├── complex_Repair_Model_TD75S.pdb │ ├── complex_Repair_Model_TD75V.pdb │ ├── complex_Repair_Model_TD75W.pdb │ ├── complex_Repair_Model_TD75Y.pdb │ ├── complex_Repair_Model_TD77A.pdb │ ├── complex_Repair_Model_TD77C.pdb │ ├── complex_Repair_Model_TD77D.pdb │ ├── complex_Repair_Model_TD77E.pdb │ ├── complex_Repair_Model_TD77F.pdb │ ├── complex_Repair_Model_TD77G.pdb │ ├── complex_Repair_Model_TD77H.pdb │ ├── complex_Repair_Model_TD77I.pdb │ ├── complex_Repair_Model_TD77K.pdb │ ├── complex_Repair_Model_TD77L.pdb │ ├── complex_Repair_Model_TD77M.pdb │ ├── complex_Repair_Model_TD77N.pdb │ ├── complex_Repair_Model_TD77P.pdb │ ├── complex_Repair_Model_TD77Q.pdb │ ├── complex_Repair_Model_TD77R.pdb │ ├── complex_Repair_Model_TD77S.pdb │ ├── complex_Repair_Model_TD77V.pdb │ ├── complex_Repair_Model_TD77W.pdb │ ├── complex_Repair_Model_TD77Y.pdb │ ├── complex_Repair_Model_VD60A.pdb │ ├── complex_Repair_Model_VD60C.pdb │ ├── complex_Repair_Model_VD60D.pdb │ ├── complex_Repair_Model_VD60E.pdb │ ├── complex_Repair_Model_VD60F.pdb │ ├── complex_Repair_Model_VD60G.pdb │ ├── complex_Repair_Model_VD60H.pdb │ ├── complex_Repair_Model_VD60I.pdb │ ├── complex_Repair_Model_VD60K.pdb │ ├── complex_Repair_Model_VD60L.pdb │ ├── complex_Repair_Model_VD60M.pdb │ ├── complex_Repair_Model_VD60N.pdb │ ├── complex_Repair_Model_VD60P.pdb │ ├── complex_Repair_Model_VD60Q.pdb │ ├── complex_Repair_Model_VD60R.pdb │ ├── complex_Repair_Model_VD60S.pdb │ ├── complex_Repair_Model_VD60T.pdb │ ├── complex_Repair_Model_VD60W.pdb │ ├── complex_Repair_Model_VD60Y.pdb │ ├── complex_Repair_Model_VD79A.pdb │ ├── complex_Repair_Model_VD79C.pdb │ ├── complex_Repair_Model_VD79D.pdb │ ├── complex_Repair_Model_VD79E.pdb │ ├── complex_Repair_Model_VD79F.pdb │ ├── complex_Repair_Model_VD79G.pdb │ ├── complex_Repair_Model_VD79H.pdb │ ├── complex_Repair_Model_VD79I.pdb │ ├── complex_Repair_Model_VD79K.pdb │ ├── complex_Repair_Model_VD79L.pdb │ ├── complex_Repair_Model_VD79M.pdb │ ├── complex_Repair_Model_VD79N.pdb │ ├── complex_Repair_Model_VD79P.pdb │ ├── complex_Repair_Model_VD79Q.pdb │ ├── complex_Repair_Model_VD79R.pdb │ ├── complex_Repair_Model_VD79S.pdb │ ├── complex_Repair_Model_VD79T.pdb │ ├── complex_Repair_Model_VD79W.pdb │ ├── complex_Repair_Model_VD79Y.pdb │ ├── complex_Repair_Model_VD92A.pdb │ ├── complex_Repair_Model_VD92C.pdb │ ├── complex_Repair_Model_VD92D.pdb │ ├── complex_Repair_Model_VD92E.pdb │ ├── complex_Repair_Model_VD92F.pdb │ ├── complex_Repair_Model_VD92G.pdb │ ├── complex_Repair_Model_VD92H.pdb │ ├── complex_Repair_Model_VD92I.pdb │ ├── complex_Repair_Model_VD92K.pdb │ ├── complex_Repair_Model_VD92L.pdb │ ├── complex_Repair_Model_VD92M.pdb │ ├── complex_Repair_Model_VD92N.pdb │ ├── complex_Repair_Model_VD92P.pdb │ ├── complex_Repair_Model_VD92Q.pdb │ ├── complex_Repair_Model_VD92R.pdb │ ├── complex_Repair_Model_VD92S.pdb │ ├── complex_Repair_Model_VD92T.pdb │ ├── complex_Repair_Model_VD92W.pdb │ ├── complex_Repair_Model_VD92Y.pdb │ ├── complex_Repair_Model_WD89A.pdb │ ├── complex_Repair_Model_WD89C.pdb │ ├── complex_Repair_Model_WD89D.pdb │ ├── complex_Repair_Model_WD89E.pdb │ ├── complex_Repair_Model_WD89F.pdb │ ├── complex_Repair_Model_WD89G.pdb │ ├── complex_Repair_Model_WD89H.pdb │ ├── complex_Repair_Model_WD89I.pdb │ ├── complex_Repair_Model_WD89K.pdb │ ├── complex_Repair_Model_WD89L.pdb │ ├── complex_Repair_Model_WD89M.pdb │ ├── complex_Repair_Model_WD89N.pdb │ ├── complex_Repair_Model_WD89P.pdb │ ├── complex_Repair_Model_WD89Q.pdb │ ├── complex_Repair_Model_WD89R.pdb │ ├── complex_Repair_Model_WD89S.pdb │ ├── complex_Repair_Model_WD89T.pdb │ ├── complex_Repair_Model_WD89V.pdb │ └── complex_Repair_Model_WD89Y.pdb └── parameters ├── logo.png ├── proton.py ├── proton_code_architecture.jpg ├── requirements.txt ├── results ├── .DS_Store └── README ├── setup.py └── src ├── detect_outliers.py ├── energy_calculation_EvoEF1.py ├── energy_calculation_FoldX.py └── interface_residues.py /.DS_Store: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/CSB-KaracaLab/prot-on/HEAD/.DS_Store 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