Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKRFILVLSFLSIIVAYPIQTNASPMPCSVILEPVDKNLKNAKGVALIYKVQLNPPSAARTNISILAVHLPAPSSFGNYDSYEGFATKPGEISWRFKLYPTPEEESPSWAGRIDTISAEMKNVKVQVRLSNSSTQKLGPSILTKNIESCY 2BKQ Chain:A ((51-121)) -------VSFISPEVTQFIKCTSNPAEIAMFLEPLD--LPNKRVVFL--AINDNSNQAAG-SHWSLLVYLQDKNSFFHYDSH--------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2BKQ.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 : 197 -34466 -174.95 -492.36 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : -174.95 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.509

(partial model without unconserved sides chains): PDB file : Tito_2BKQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2BKQ-query.scw PDB file : Tito_Scwrl_2BKQ.pdb: