Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSGRGKGGKGLGKGGAKRHRKVLRDNIQGITKPAIRRLARRGGVKRISGLIYEETRGVLKVFLENVIRDAVTYTEHAKRKTVTAMDVVYALKRQGRTLYGFGG 1AOI Chain:B ((5-87)) --------------------KVLRDNIQGITKPAIRRLARRGGVKRISGLIYEETRGVLKVFLENVIRDAVTYTEHAKRKTVTAMDVVYALKRQGRTLYGFGG

General information: TITO was launched using: RESULT: Template: 1AOI.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 : 180 -26251 -145.84 -316.28 target 2D structure prediction score : 0.81 Monomeric hydrophicity matching model chain B : 0.93 3D Compatibility (PKB) : -145.84 2D Compatibility (Sec. Struct. Predict.) : 0.81 1D Compatibility (Hydrophobicity) : 0.93 QMean score : 0.491

(partial model without unconserved sides chains): PDB file : Tito_1AOI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1AOI-query.scw PDB file : Tito_Scwrl_1AOI.pdb: