Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTVEQNEFLSSVQLQILAEQAIKQYPNEYQGSVKLLCQS-ENAT--FLVTTAQAKYALRIHRPNYHHLQDIESELAWLDALNQSGIE-VPLAIADQDGQRVITLKLAEGISRYAVLFNWVNGSMPTTDV-DPTAFQQLGQITAALHQHSKSWKRPEQF----NRIVWN--HDTMVGAQGH--W-GNWKHA-PHLDQADHAVVEEAIARISTELCQYGAGEDRYGLIHADLRLTNLLLQDQ-QIGVIDFDDCGMSWFMHDLAAAISFNEHLDAAPQWVEHWLTGYEKTGHVQNHDYVMIPTFIMQRRIQMMAWNGSHAHTEMALSLGDQWSNETVRLCKKYLNGEMPVGRSNA 3I1A Chain:B ((5-291)) ----------PIQAQQLIELLKVHYGIDIH-TAQFIQGGADTNAFAYQADSESKSYFIKLKYGYH---D--EINLSIIRLLHDSGIKEIIFPIHTLEAKLFQQL-----KHFKIIAYPFIHAPNGFTQNLTGKQWKQLGKVLRQIHETSVPISIQQQLRKEIYSPKWREIVRSFYNQIEFDNSDDKLTAAFKSFFNQNSAAIHRLVDTSEKLSKKIQPDLDKYVLCHSDIHAGNVLVGNEESIYIIDWDEPMLAPKERDLMFIGGGVGNVWNKPHEIQYFYEGYGEINV----DKTILSYYRHERIVEDIAV----------------------------------------

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 : 1087 955 0.88 3.52 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain B : 0.68 3D Compatibility (PKB) : 0.88 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.261

(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: