Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MANSAQAKKRARQNVKARKHNASLRSMVRTYIKRTLSAIAGGDYAVATEAYKKAVPVIDRMADKGIIHKNKAARHKSRLNAQVKALAN 5IWA Chain:T ((3-89)) PKRNLSALKRHRQSLKRRLRNKAKKSAIKTLSKKAIQLAQEGKAEEALKIMRKAESLIDKAAKGSTLHKNAAARRKSRLMRKVRQLL-

General information: TITO was launched using: RESULT: Template: 5IWA.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain T - contact count / total energy / energy per contact / energy per residue : 226 -21966 -97.19 -252.48 target 2D structure prediction score : 0.85 Monomeric hydrophicity matching model chain T : 0.78 3D Compatibility (PKB) : -97.19 2D Compatibility (Sec. Struct. Predict.) : 0.85 1D Compatibility (Hydrophobicity) : 0.78 QMean score : 0.827

(partial model without unconserved sides chains): PDB file : Tito_5IWA.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5IWA-query.scw PDB file : Tito_Scwrl_5IWA.pdb: