from igfold import IgFoldRunner sequences = { "H": "QVQLQESGGGLVQAGGSLTLSCAVSGLTFSNYAMGWFRQAPGKEREFVAAITWDGGNTYYTDSVKGRFTISRDNAKNTVFLQMNSLKPEDTAVYYCAAKLLGSSRYELALAGYDYWGQGTQVTVS" } pred_pdb = "my_nanobody1.pdb" igfold = IgFoldRunner() igfold.fold( pred_pdb, sequences=sequences, do_refine=False, do_renum=False, )