Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSMHKALTIAGSDSSGGAGIQADLKTFQEKNVYGMTALTVIVAMDPNNSWNHQVFPIDT---DTIRAQLATITDGIGVDAMKTGMLPTVDIIELAAKTIKEKQLKNVVIDPVMVCKGANEVLYPEHAQALRE--QLAPLATVITPNLFEASQLSGMDELKTVDDMIEAAKKIHALGAQYVVITGGGKLKHEKAVDV----LY-DGETAEVLESEMIDTPYTHGAGCTFSAAVTAELAKGAEVKEAIYAAKEFITAAIKESFPLNQYVGPTKHSALRLNQQS 4YL5 Chain:A ((14-245)) ------LCFSGLDPSGGAGLQADIEAIGQSGAHAAIACT---ALTIQNS--QQVFGFEATSKELLLAQANAVVGDLPIKCVKSGMLGTTDNIAALAEFLRAHPDYQYVLDPVLVANSGGSL--GDQATLVKAFVELIPLATLITPNTVELRALTG------VTDLDQATQKLFEMGAKAVLVKGG----HEDTPDFIKNSLYIDGELAASSTCP-----------CSLASFIAGRLALGDSLKIAVQHAETWLFGV-------------------------

General information: TITO was launched using: RESULT: Template: 4YL5.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 : 1202 -17479 -14.54 -82.45 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain A : 0.75 3D Compatibility (PKB) : -14.54 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.464

(partial model without unconserved sides chains): PDB file : Tito_4YL5.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4YL5-query.scw PDB file : Tito_Scwrl_4YL5.pdb: