Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEHLPEQYRQLFPTLQ-THTMLASCSQSALAEPVSRAIQDYYDSLL-YKGT-NWK---EAIEKTEFARNEFAKLIGAE-PDEVAIVPSVSDALVSVASSLT---AFGKKHVVYTDMDFPAVPHVWQAHSD---YTVSVIPS-IDGVLPLEQYETHISDETVLTCVPHVHYRDGYVQDIKAIAEISQRKGSLLFVDAYQSAGHIPIDVKEWGVDMLAAGTRKYLLGIPGVAFLYVRKELADALKPKASAWFGRES-GFD-GAYAKVARRFQTGTPAFISVYAAAAALSLLNHIGVSHIRDHVKTICADAVQYAAEK-GLQLAAAQGGIQPGMVAIRDER--ASETAGLLKKKKVICAPR-------------ENVIRLAPHFYNTKEEMRHAIDEIAAKTIHK 4LW2 Chain:A ((9-401)) ----PAQFRAQFPALQDAGVYLDSAATALKPEAVVEATQQFYSLSAGNVHRSQFAEAQRLTARYEAAREKVAQLLNAPDDKTIVWTRGTTESINMVAQCYARPRLQPGDEIIVSVAEHHANLVPWLMVAQQTGAKVVKLPLNAQRLPDVDLLPELITPRSRILALGQMSNVTGGCPDLARAITFAHSAGMVVMVDGAQGAVHFPADVQQLDIDFYAFSGHKLY-GPTGIGVLYGKSELLEAMSPWLGGGKMVHEVSFDGFTTQSAPWKLEAGTPNVAGVIGLSAALEWLADYDINQAESWSRSLATLAEDALAKRPGFRSFRC---QDSSLLAFDFAGVHHSDMVTLLAEYGIALRAGQHCAQPLLAELGVTGTLRASFAPYNTKSDVDALVNAVDRALEL-

General information: TITO was launched using: RESULT: Template: 4LW2.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 : 2063 -253793 -123.02 -703.03 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain A : 0.73 3D Compatibility (PKB) : -123.02 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.516

(partial model without unconserved sides chains): PDB file : Tito_4LW2.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4LW2-query.scw PDB file : Tito_Scwrl_4LW2.pdb: