Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIAVKTCGKLYWAGEYAILEPGQLALIKDIPIYMRAEIAFSDSYRIYSDMFDF------AVDL-R-PNPDYSLIQETIALMGDFLAVRGQNLRPFSLAIYGKMEREGKKFGLGSSGSVVVLVVKALLALYNLSVDQNLLFKLTSAVLLK-RGDNGSMGDLACIAAE--D-LVLYQSFDRQKVAAWLEEENLATVLERDWGFSISQVKPTLECDFLVGWTKEVAVSSH--MV----------QQIKQ------------NINQN---FLTSS---KETVVSLVEALEQGKSEKIIEQVEVASKLLEG-LSTDIYTPLLRQLKEASQDLQAV-AKSSGAGGGDCGIALSFDAQSTKTLKNRWADLGIELLYQERIGHDDKS 2DEI Chain:A ((1-325)) MIKVKSPGRVNLIGEHTDY-TYGYVMPMAINLYTKIEAEKHGE--VILYSEHFGEERKFSLNDLRKENSWIDYVKGIFWVLKES-D---YEVGGIKGRVSGNLP---LGAGLSSSASFEVGILETLDKLYNLKLDSLSKVLLAKKAENEFVGVPCGILDQFAVVFGREGNVIFLDTHTL-DY---------------------EYIPFPKDVSILVFYTGVRRELASSEYAERKHIAEESLKILGKGSSKEVREGELSKLPPLHRKFFGYIVRENARVLEVRDALKEGNVEEVGKILTTAHWDLAKNYE--VSCKELDFFVERALKLGAYGARLTGAGFGGSAIALVDKEDA-ETIGEEI-------------------

General information: TITO was launched using: RESULT: Template: 2DEI.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 : 1445 -32434 -22.45 -115.42 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : -22.45 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.437

(partial model without unconserved sides chains): PDB file : Tito_2DEI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2DEI-query.scw PDB file : Tito_Scwrl_2DEI.pdb: