Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEVARTINLIEEEIINDLKGKFGWHIQSLEANNLGYGNMKWI--MKTDSESYFVKKYCKVRYRRGLEDVHEALRYQDLMYRDGIP-CQPVYAY-NNRYIHRLQSDEDYMITGVSKGELIQAGTANLQQMYSLGETTGRMHKWMSIHMPRRTVLHWDLPSKHKMIARLELNLHE----TE-----EANH----GKYV---LAIQKQMEILSGVDM-DIFNECAKGWAHWDMHVDNLLFYKDGVADIVDFDRVQFVYPDFDISRALLSCALKDDQMRLDAVEAYVEGYRVHMSLSNEQLVRSIKLTWYKEFKWVHAMYCSEKTMGRFIDEMIWIGDNWNELNDIFKL 3I1A Chain:B ((8-296)) ----------AQQLIELLKVHYGIDIHTAQFIQGGADTNAFAYQADSESKSYFIKLKYGY-----H--DEINLSIIRLLHDSGIKEIIFPIHTLEAKLFQQL-KHFKIIAYPFIHAPNGFTQNLTGKQWKQLGKVLRQIHETSVPISIQQQ-LRKEIY-----SPKWREIVRSFYNQIEFDNSDDKLTAAFKSFFNQNSAAIHRLVDTSEKLSKKIQPDLDKYVLCHSDIHAGNVLVGNEESIYIIDWDEPMLAPKERDLMFIGGGVGNVW--NKPHEIQYFYEGYGEINV--DKTILSYYRHERIVEDIAVYGQDL----------------------------

General information: TITO was launched using: RESULT: Template: 3I1A.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1061 -24980 -23.54 -93.21 target 2D structure prediction score : 0.52 Monomeric hydrophicity matching model chain B : 0.64 3D Compatibility (PKB) : -23.54 2D Compatibility (Sec. Struct. Predict.) : 0.52 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.266

(partial model without unconserved sides chains): PDB file : Tito_3I1A.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3i1a-query.scw PDB file : Tito_Scwrl_3I1A.pdb: