Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNLKQALIDNDSIRLGLEANNWKEAVKVAVDPLIESGAILPEYYDAIIESTEEYGPYYILMPGMAMPHARPEAGVQSDAFSLITLQNPVVFSD-G-KEVSVLLALAATSS--KIHTSVAIPQIIALFELEDSIARLQACQTKEDVLAMIEESKDSPYLEGLDLES 3URR Chain:B ((3-152)) MNRLAKILPLENVVIGLSVTSKKRVFEQAGLIFENQ-IARSTVTDNLFAR-ERLGSTG-LGEGVAIPHGRIK-GLKHPLAAFVRLAEPIPFEAPDGQPVSLLIFLLVPEQATQAHLE-ILSEIAQLLSDRDTRERLHTEPDRDELHRLLTQWQ------------

General information: TITO was launched using: RESULT: Template: 3URR.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 : 682 -60251 -88.34 -418.41 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain B : 0.69 3D Compatibility (PKB) : -88.34 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.534

(partial model without unconserved sides chains): PDB file : Tito_3URR.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3URR-query.scw PDB file : Tito_Scwrl_3URR.pdb: