Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKRFSLIMMTGLLFGLTSPAFAAEKTETEAKAPANVAVLLDASGSMAKRIDGVSKFNSAKKEISKFASSLPEGTQVKMSVFGSEGNNKNS-GKVQSCEAIRNVYGFQSF-NEQSFLNSLNTIGPT--GWTPIAKALNEAK-SSFDQLDAKG----EKVVYLLTDGEETCGGNPIKTAKELQKDNITVNVIGFDYKEGYKGQLNAIAKVGGGEYFPAYTQKDVEKIFTQQSLMLSK 4CNB Chain:A ((47-212)) ---------------------------AEECDVQADIIVLFDDSSSI--QYDNKENYQMMKDFVKELVDSF--------TTVGV----GSQFGVVQFSQGVKTAFPLNKFKTKEDIKKGIQDMVPRNGGQTEIGTGLKHVRENSFSGAEGGGNPDKQKIVILMTDGKSNAGAPPQHEAHKLKAEGVTVIAIGI-------------------------------------------

General information: TITO was launched using: RESULT: Template: 4CNB.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 : 735 41088 55.90 287.33 target 2D structure prediction score : 0.70 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : 55.90 2D Compatibility (Sec. Struct. Predict.) : 0.70 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.521

(partial model without unconserved sides chains): PDB file : Tito_4CNB.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4CNB-query.scw PDB file : Tito_Scwrl_4CNB.pdb: