Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MVILSDLLNRMNKSNRIQTAELDWESIDGIEVPISKQFGDVYFSKDNGLLETRHVFLNGNDLSERLANLQDFEYFSVGETGFGTGLNILALWQ---LWQQVRPN-NHSHLHAISVEKFPLSKADLIRALNVWDELKPLSKQLIEQYPLPLAGCHRLSFPEERFSIDLWLGDAQDIFPSMVKT--KAVNAWFLDGFAPSCNPDMWEQNVLNNIVRLSDYGTTFASFSVAGVLKRGLKTHGIDISRPRGFGHKREMLKAVWKAPVSEEILLEPVSDTFHFTQ----QRIAVIGAGIAGLSTAWAFAQRGHQVTLFERTA-PLSGASGNPLA----LLNPKPCPIEQSHEHLMTLSWQHALNFYKNFQAF--RPIQIQQMALKN---AQDLLDLADQYPADIVT-------QQTSSLESDYPHILLTEAGAVSPHQLRDEIL---QHQGIELKIAN-ITTLISFENKVQLKSGNETTLGADHVVVCCARESAALFE--NYPLLKPIRGQVSWVDNSFATLPLNEAYSYGGYCIQLNASEL--ILGASFYPSRDDQEVLIDDHVHNFELIHSVFPHYA-KQLPPVEQWQGRASVRAQSPDYFPLVGKMQK---------------ESPISTFA------------GLGSKGFLFAPLCSEVLVAQILGEACPVPKSLLQKLDAQRFQKKVKPKKPYFKSQ 3SGL Chain:A ((34-666)) -----------------------------------------------GLEETHHVFLKGNGFPARFAS-HPQQSCIFAETGFGTGLNFLTLWRDFALFRQQSPNATLRRLHYISFEKYPLHVADLASAHARWPELASFAEQLRAQWPLPLAGCHRILLADGAITLDLWFGDVNTLLPTLDDSLNNQVDAWFLDGFAPAKNPDMWNEQLFNAMARMTRPGGTFSTFTAAGFVRRGLQQAGFNVTKVKGFGQKREMLTGTLPQQIH-----APTAPWYHRPAATRCDDIAIIGGGIVSALTALALQRRGAVVTLYCADAQPAQGASGNRQGALYPLLNGKNDALETFFTSAFTFARRQYDQLLEQGIAFDHQWCGVSQLAFDDKSRGKIEKMLHTQWPVEFAEAMSREQLSELAGLDCAHDGIHYPAGGWLCPSDLTHALMMLAQQNGMTCHYQHELQRLKRIDSQWQLTFG--QAAKHHATVILATGHRLPEWEQTHHLPLSAVRGQVSHIPTTPVLSQLQQVLCYDGYLTPVNPANQHHCIGASYQRGDIATDFRLTEQQENRERLLRCLPQVSWPQQVDVSDNQARCGVRCAIRDHLPMVGAVPDYAATLAQYQDLSRRI-----DIAVAPVWPELFMVGGLGSRGLCSAPLVAEILAAQMFGEPLPLDAKTLAALNPNRF--------------

General information: TITO was launched using: RESULT: Template: 3SGL.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 : 2949 -48339 -16.39 -86.47 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.75 3D Compatibility (PKB) : -16.39 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.373

(partial model without unconserved sides chains): PDB file : Tito_3SGL.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3SGL-query.scw PDB file : Tito_Scwrl_3SGL.pdb: