Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSAVTESVLESIISPVTMSEFLEEYWPVKPLVARGEVERFTSIPGFEKVRTLENVLAIYNN-PVMVVGDAVIEESEGI-T-DRFLVSPAEALEWYEKGAALEFDFTDLFIPQVRRWIEKLKAELRLPAGTSSKAIVYAAKNGGGFKAHFDAYTNLIFQIQGEKTWKLAKNENVSNPMQHYDLSEAPYYPDDLQSYWKGDPPKEDLPDAEIVNLTPGTMLYLPRGLWHSTKSDQATLALNITFGQPAWLDLMLAALRKKLISDNRFRELAVNHQSLHESSKSELNGYLESLIQTLSENAETLTPEQIFQSQDSDFDPYQSTQLVFRQLLTSYKF 4CSW Chain:A ((16-235)) ------QLPETILGGLAPEEFLANYWQKRPLLIRQALP---GFR--SPIT-PEELAGLACEEGVTARLI-LEKGGAYPWEVRYGPFEPEDFVALPPTHWTLLVQEVDRLVPEVAALLETVRFVPNWRLD---DIMVSYAPEGGTVGAHIDNYDVFLVQAWGRRRWQINHRPVEREELVPGLE-----------V-----RLLAHFEPDAEWILEPGDVLYLPPRIPHYGVALEDCMTFSIGFRAPDQAELAE---------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4CSW.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 : 1154 -16624 -14.41 -76.61 target 2D structure prediction score : 0.52 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -14.41 2D Compatibility (Sec. Struct. Predict.) : 0.52 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.406

(partial model without unconserved sides chains): PDB file : Tito_4CSW.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4CSW-query.scw PDB file : Tito_Scwrl_4CSW.pdb: