Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNKLLVALGLAATV-ALVGCNKD-------------KAPETGATTGEHLENSAQQASADIKSAGDQAASDIATATDNASAKIDAATDHAADATAKAAAETEATARKATADTAQAVENAAADVKKDAQH 3AER Chain:B ((175-245)) VTKLLATMGIKVNVCAPLGASPDDLRKLGQAHFNVLMYPETGESAARHLERACKQPFTKIVPIGVGATRDF---------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3AER.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 : 138 -1841 -13.34 -32.30 target 2D structure prediction score : 0.39 Monomeric hydrophicity matching model chain B : 0.72 3D Compatibility (PKB) : -13.34 2D Compatibility (Sec. Struct. Predict.) : 0.39 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.276

(partial model without unconserved sides chains): PDB file : Tito_3AER.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3AER-query.scw PDB file : Tito_Scwrl_3AER.pdb: