Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSAANPPRPSRSLQGKVAIVTGAGSRGETIGNGRAIALLLAEDGAKVVCVDREEALAQRTAELVLAENEGASALAVAADVSSAEECARVVDAALRLFGRVDVLVNGVGVLGPPGTAVDVDAARWARGLEVNVTSMMLMAKYAVPAMRDNEPEAGVRGSIVNLGSVAGLR-GGTPSLLYPTSKCAVVNMTRAMAAHHAKDGVRVNCVCPGMLYTPMV---YDAEGGMSAEVREARRRRSLLQTEGNAWDCAGPVRFLAGGEARWITGTVLTVDAGATCALAVSMPDGE 5JC8 Chain:B ((15-270)) ------------LQGKVALVTGAGCIGPGWGNGRAIAVRFAEEGAHVIAVDRDLASMDATLELVRA--AGGSVTPCLCDVTDSASVERLVADSVARCGRVDILVNNVGA-PSPGGPVALDEAQWAMQLELNLTTAFLMCKYVLPVM---EQQGG--GAIVNIASTSGIRWTGAAQVGYAAAKAGMIQMGRVVAVEYAAKNVRVNSVVPGLLHTPMVDTK----------LLRKRQARIPMPFMGDGRDTANAALFLASDEARFVTGTEIVVDGG-------------

General information: TITO was launched using: RESULT: Template: 5JC8.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 : 1397 -146198 -104.65 -609.16 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain B : 0.80 3D Compatibility (PKB) : -104.65 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.80 QMean score : 0.383

(partial model without unconserved sides chains): PDB file : Tito_5JC8.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5jc8-query.scw PDB file : Tito_Scwrl_5JC8.pdb: