Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKGWLFLEHLKQRLEEMKWV-PLHVECITGAHAGDIFRFEIINHNGDTEKFIYKEFAEG---RNNEIEVFKKLENHLQPFTKLV-KWW-------ESNPQAILMVDL-GRPLKDDFMNLPLDSKKKSIVSILQRLSYLHSLKIDQTALTLDAHSITYEWSEWAIDQLKLLNEGHDWASDWSKLIESAYQKLKLGQYTVKGPLTLTHGDPHLENVFCYE-NEIWFIDWEWAAIGSPLRDITILLQDVY-------DEELVRYTYRAYKELLDSKKISISNDAYRRDFHHLYVDHTTMMLAWEIDKYFQGFTSEARIKEIVEFKMKEINRVVIEEAHISPW 2PPQ Chain:A ((7-290)) ----ITEDELRNFLTQYDVGSLTSYKGIAE---NSNFLLHTTK-----DPLILTLYEK-KNDLPFFLGLMQHLAAK-GLSCPLPLPRKDGELLGELSGRPAALISFLEGMWLRKP--------EAKHCREVGKALAAMHLASEGFEIKR-PNALSVDGWKVLW-DKSEERAD--EVEKGLREEIRPEIDYLAA-HWPKDLPAGVIHADLFQDNVFFLGDELSGLIDFYFACNDLLAYDVSICLNAWCFEKDGAYNVTKGKALLEGYQSVRP-----LSEAE-LEALPLLSRGSALRFFLTRLYDWLTTPAG----------------------------

General information: TITO was launched using: RESULT: Template: 2PPQ.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 : 1146 2161 1.89 8.41 target 2D structure prediction score : 0.55 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : 1.89 2D Compatibility (Sec. Struct. Predict.) : 0.55 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.381

(partial model without unconserved sides chains): PDB file : Tito_2PPQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2ppq-query.scw PDB file : Tito_Scwrl_2PPQ.pdb: