Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDSYPESLKKETEEIKERV---RNGNIKEDKIKEIAETTVEFLKSEEKRHKYFSEVAAAMADNLS----EFFKSYLKGE 3VIQ Chain:B ((13-78)) -------LEQQKEQLESSLQDALAK-LKNRDAKQTVQKHIDLLHTYNEIRDIALGMIGKVAEHEKCTSVELFDR-----

General information: TITO was launched using: RESULT: Template: 3VIQ.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 : 22 4356 198.00 73.83 target 2D structure prediction score : 0.78 Monomeric hydrophicity matching model chain B : 0.73 3D Compatibility (PKB) : 198.00 2D Compatibility (Sec. Struct. Predict.) : 0.78 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.639

(partial model without unconserved sides chains): PDB file : Tito_3VIQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3VIQ-query.scw PDB file : Tito_Scwrl_3VIQ.pdb: