Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIAVKTCGKLYWAGEYAILEPGQLALIKDIPIYMRAEIAFSDSYRIYSDMFDFAVDLRPNPDYSLIQETIALMGDFLAVRGQNLRPFSLAIYGKMEREGKKFGLGSSGSVVVLVVKALLALYNLSVDQNLLFKLTSAVLLKRGDNGSMGDLACIAAEDLVLYQSFDRQKVAAWLEEENLATVLERDWGFSISQVKPTLECDFLVGWTKEVAVSSHMVQQIKQNINQNFLTSSKETVVSLVEALEQGKSEKIIEQVEVASKLLEGLSTDIYTPLLRQLKEASQDLQAVAKSSGAGGGDCGIALSFDAQSTKTLKNRWADLGIELLYQERIGHDDKS 4UT4 Chain:A ((115-159)) ------------------------------------------------------------------------------------------------------GLGSSSTLVVVMIKAFVELLNLPLDDYAIAQL--AYRIERVDCGLAG------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4UT4.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 : 86 -21630 -251.51 -480.67 target 2D structure prediction score : 0.84 Monomeric hydrophicity matching model chain A : 0.54 3D Compatibility (PKB) : -251.51 2D Compatibility (Sec. Struct. Predict.) : 0.84 1D Compatibility (Hydrophobicity) : 0.54 QMean score : 0.681

(partial model without unconserved sides chains): PDB file : Tito_4UT4.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4UT4-query.scw PDB file : Tito_Scwrl_4UT4.pdb: