Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ----MYCPQC-GHQTDGGNFCEKCGSPLPGQSGHQHAAQTGAAAKQAAKQFGSFVLSVLKRPYQECKATGGEQLISAIITMVLFSLLTPLMF-------------------------------YILFSDGPGSVSFTAIFLEPTIYFILFLFGLHACIFFALKIAGNQVSFKDSFSR--------------FGAFLI--------------PFTAILILALFFFLLHTDICFTILAVGLIGAFFAIPPAMLSSYQHSYK----GKVDFIYSTIVIYLIICVTFQLIIEHYVKEIFRYMLF------------------------ 3BJD Chain:A ((4-329)) NTRNFSLPQLQNLPIEEARIVADALAVHATSRQIDSAASKLAALAEAGLKGDRQAYAAYQQLLYVLSLSDDVATAQTRRWLARAIYRVEERFMPAADLSRALSEEDFQKRLEQEIAAQERHPMSQYVFSGSASRAQLQVFLRHQWFRTFRLYRDAADLLVNLTDVDEAAALARYLYGELGEEDEKGSHPRLLAKLLEAIGLEADFQAVSTMPEEIAYLNNRARAFRHAE---VGWGLAVFYITELVVPGNHEKLYRALLQAGLSEDQAEYYKVHISLVPKREWQLIARRIPDVQFQNAFLTSLSQHFRVERAYYDAIWEEMQSV

General information: TITO was launched using: RESULT: Template: 3BJD.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 : 759 -27300 -35.97 -119.21 target 2D structure prediction score : 0.69 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -35.97 2D Compatibility (Sec. Struct. Predict.) : 0.69 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.177

(partial model without unconserved sides chains): PDB file : Tito_3BJD.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3BJD-query.scw PDB file : Tito_Scwrl_3BJD.pdb: