Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKISLLGSGRVAFHLAKALLAQGHHIAQVYARDFEKTKKFAEQIQ--------------------------AKA--CQS-LQEFQPTDLIILAVSDSA--ITELATQVHELF-PKMLMVHTSGSTDIQVISQVH---EKAGVFYPLQTFSLERDVDWKATPLFVEA--TNKDDLVILSDLANSLSKRVYQYTSKQRLTLHLAAVFACNFSNYCFDMAKQVVDAEQVDFGLLYPLILETAKKATENDPKQMQTGPAMRGDQNILVMHQSLLAQANRDDLKQVYQLLSDGIVKRHHSS 2HDH Chain:A ((5-254)) KHVTVIGGGLMGAGIAQVAAATGHTVV-LVDQTEDILAKSKKGIEESLRKVAKKKFAENPKAGDEFVAKTLSTIATSTDAASVVHSTDLVVEAIVENLKVKNELFKRLDKRAAEHTIFASNTSSLQITSIANATTRQDRFAGLHFFNPVPVM------KLVEVIKTPMTSQKTFESLVDFSKALGKHPVSCKDTPGF-------IVNRLLVPYLMEAIRLYERGDASKEDIDTAMKLGAG---------YPMGPFELLDYVGLDTTKFIVDGW-----------------------

General information: TITO was launched using: RESULT: Template: 2HDH.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 : 1023 -36303 -35.49 -170.43 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : -35.49 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.433

(partial model without unconserved sides chains): PDB file : Tito_2HDH.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2HDH-query.scw PDB file : Tito_Scwrl_2HDH.pdb: