Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MVKYQYEFPLDKAGKAGAVKPYRGGKNDFVTPVSNLSGVAEILTNAALKATEAYSQLGQDRLGAVLISKVKGWAYADREGTLFIEESDNNNVWTTTAAVNVAAGVLTATDWVYLSKRYYRFRYVNGNLQQSEFVLYQSVGAGEMDVRVNEKTPLQIDFAENQTHDGRLKVEARKTFDFVFHENAESASEGAALPVDGAAHLLVEVYGTAEMSEVKFWGKSVSGQKLPIRGVKTDDATTASSTLGKAEAWAFDIKGFKEIIMEIISITGGTLSVKGTAVS 2V72 Chain:A ((117-130)) -----------------------------------------------------------------------------------------------------------------IDAEEIKITAIQGV--------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2V72.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 : 1 -375 -374.50 -26.75 target 2D structure prediction score : 0.71 Monomeric hydrophicity matching model chain A : 0.51 3D Compatibility (PKB) : -374.50 2D Compatibility (Sec. Struct. Predict.) : 0.71 1D Compatibility (Hydrophobicity) : 0.51 QMean score : 0.228

(partial model without unconserved sides chains): PDB file : Tito_2V72.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2V72-query.scw PDB file : Tito_Scwrl_2V72.pdb: