Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNRWLRLGFACVGSIFLMFALAACKQEETLTKVKVAE-VTHSIFYAPLYVAESKGFFKEEGLDVDVNTTWGGDKTMTSLLSNGSDIALVGSETSIYVEAQGAKDPVINFAQLTQTDGTFLVAR-ED-VEHFDWDQLKGKTFLGQRKGGMPQMVGEYVLNKHKIDPHKDIDLIQNIDF-ANIANAFASGTGEYVQLFEPQASLFEKKGIGHIVASFGE------ESG-EVPYTTFMAKQSYLKKNEDTAVKFTKAIYKAQQWVENHSAKDITDAIKDEFDDTDPDVIETSIERYKKQHSYSPDPLLNEKEWELLQTIMDKS--GELPKHIPYNQLVNKEIAEKVTSEK 3QSL Chain:A ((31-341)) ----------------------------EKAKVQIAVGGKPLIYYLPLTIAEVKGFFKDEGLDVSIADFAGGSKALQAVVGGSADVVSGAFEHTLSLQAKGQ--FYRAFALQGRAPMIGVGVSKKNLPGYKGPADLKGRKIGVTAPGSSTNMVVNFFLAKHGLKA-SDVSF-IGVGAGAGAVTALRSGQIDAISNTDPVVSMLETSGDIQIIVDTRTLKDTKEIFGGNMPAGCLYAPQAFVDANPNTAQALTNAIVRADKWIQKAGADEIAKAVPEGYLLGDPAVYKAAIGKSM--EGLSPDGVIPEDGAATALKALAAFVPDFDAAKVDPAKAWTNEYTRRANE--

General information: TITO was launched using: RESULT: Template: 3QSL.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 : 1883 15722 8.35 52.76 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain A : 0.73 3D Compatibility (PKB) : 8.35 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.571

(partial model without unconserved sides chains): PDB file : Tito_3QSL.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3QSL-query.scw PDB file : Tito_Scwrl_3QSL.pdb: