Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGRLCVSDSEALVLLQSLPHVPQPVHIRRSSQGGEHLVWTVNDALVLRIPADQSNAEPLLRERRLLDLLRRNDKIAPVVPPCIDVGVWNPHGWQYALYHKATGVSVESDPQAVTNATEDDLVELLVGLRGVGVGDALGVGVPEGDEV--DFEKLRGNARAALDV-LQKSQQLMELGEVVSL-EKLDAPWFVRLGGSMRRVLSHADLKGEHVFLDAAGRVTGVIDWSDAQVGCPSVEVAGLAVAVGARMAARVAKRAGYEADIVCKGVIMARCNGVVCLEAILRGADDSPECLVRRQLGRAFEELDA 3W0R Chain:A ((46-232)) --------------------------------------------YVLRV---NSCADGFYKDRYVY---RHFASAALPIPEVLDIGEFS-ESLTYCISRRAQGVTLQDLPETELPAVLQPVAEVMDAIAAADLSQTSGFG-PFGPQGIGQYTTWRDFICAIADPHVYHWQTVMDDTVSASVAQALDELMLWAEDCPEVRHLVHADFGSANVLTDN-GRITAVIDWSEAMFGDPLYEVANI------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3W0R.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 : 749 -26701 -35.65 -145.90 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -35.65 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.178

(partial model without unconserved sides chains): PDB file : Tito_3W0R.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3w0r-query.scw PDB file : Tito_Scwrl_3W0R.pdb: