Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKTMSAITAAAAVTSCFTGFGAASFSAPAKAAAQTNTLSENTNQSAAELVKNLYNTAYKGEMPQQAQGLTINKSTKGDVHAAFGEPERPVGGD---NRFDLYHWNMGQPGYGFSYHKDMTISEIRYFGTGVER---------QLNLGGVTPEVLQKQLGPVNRVLTVPFTD--EIDYVYDTGRYELHFVIGTDQTADHVNLKAK 3D4E Chain:A ((42-149)) ------------------------------------------------------------------------GGTSIEQLKQWFGDPNKSEQRNAGNITLDSYTWVKDGAVINAQLYKNS-TVARSISNFSFSREAKIGKEDYDELKIGESYKKIVEKLGEPDVLSQSMSSDKEEMQTVWS------------------------

General information: TITO was launched using: RESULT: Template: 3D4E.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 : 321 -11263 -35.09 -119.82 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : -35.09 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.295

(partial model without unconserved sides chains): PDB file : Tito_3D4E.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3D4E-query.scw PDB file : Tito_Scwrl_3D4E.pdb: