Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSQLFKSFDASEKTQLICFPFAGGYSASFRPLHA-FLQGECEMLAAEPPGHGTNQTSAIEDLEELTDLYKQELNLRPDRPFVLFGHSMGGMITFRLAQKLEREGIFPQAVIISAIQPPHIQ-R---K-KVS---HLP-DDQFLDHIIQL-GGMPAELVE-NKEVMSF--------FLPSFRSDYRALEQFE----LYDLAQIQSPVHVFNGLDDKK-CIRDAEGWKKWAKDITFHQFDG-GHMFLLSQTEEVAERIFAILNQHPIIQP 4PW0 Chain:A ((28-282)) ----YRSLGAPSDIPLICFQHFTGTLDNWDPLITNGLSKGRQLIIFDNKGVGLSSGTTPDNVAAMTADALEFITALGIRYFDVLGFSLGGFIVQYMAHIQPD---MIRKIIIVGAAPQGVKVLHTFPDLIARAMQLEPKERFLFIFFEQSEHSRSKGLATLGRLYERTTDRDQDASAQAIGAQLTAITNWGKKTPSFEITSIQHPVFVVQGSNDEMMDTYNSYELFKQLPDAILSLYPDAAHGSFYQYPELFVSQTEYFLDS------

General information: TITO was launched using: RESULT: Template: 4PW0.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 1257 -144920 -115.29 -632.84 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : -115.29 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.490

(partial model without unconserved sides chains): PDB file : Tito_4PW0.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4PW0-query.scw PDB file : Tito_Scwrl_4PW0.pdb: