Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MELKHLPKYKHITEHAETYANIDAGSLELFLSLFDISKKMNHVMEHYFAGRGLSEGKFKILMLLFDAKDHRLSPTELAKRSNVTKATITGLLDGLARDGFVSRRHHTEDKRKISIELTTEGKARLEQFLPGHFSKI-SAVMENYSDEEKDMFVKMLGDLFERLSVFKD 3ZPL Chain:A ((53-157)) ---------------------------------------------------GMPHVYYGLLVKLAESPRRRLRMTELAKYAKITRSRLSHAVARLEKNGWVRREDCPSDKRGQFAILTDEGYEVLRRTAPGHVDAVRQAVFDRLTPEQQ----KSLGEIM--------

General information: TITO was launched using: RESULT: Template: 3ZPL.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 : 321 -50734 -158.05 -487.83 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : -158.05 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.631

(partial model without unconserved sides chains): PDB file : Tito_3ZPL.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3ZPL-query.scw PDB file : Tito_Scwrl_3ZPL.pdb: