Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFLTEANVLDYLTGRGFAGPEFVVRGEWTVRNLSRRNRNFRVTRGGREFLVKQAGTWDLPGRASIEREADLCRRAATDPCFGALRPLVPDVYSYDPDHSILIFEFLPDEASLSDVPERLDARTARLAGELMADYHRQMQSAALAE-HFPGSLPGYFSMHRWDSERLVTRSQGQRELVRLVKRHAAFAPALESAAAEWRPGALIHGDWKLENCLISNDGARMHVVDWELAGWGDARWDVATLLQSWWKRWVRDPAEYRLEAMRPELRALLNPSEDEVAAILRFAAVRMLQSAWESLQDIPAIHGEAVRMAQVSLNILTNPEWAGEAVFGHD 3DXQ Chain:B ((26-229)) -------------------------------LGGLTNLVFRA----GDLCLRIP---------NRANEAVAAREAAKA------GVS-PEVLHVDPATGVMVTRYIAGAQTMSPEKFKTRPGSPARAGEAFRKLHGSGAVFPFRFELFAMIDDYLK---VLSTKN-VTLPAG----YHDV--VREAGGVRSALAAHPLPLAACHCDPLCENFLDTG--ERMWIVDWEYSGMNDPLWDLGDLSVEGKF-------------NANQDEELMRAY----------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3DXQ.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 840 -38570 -45.92 -197.79 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain B : 0.61 3D Compatibility (PKB) : -45.92 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.200

(partial model without unconserved sides chains): PDB file : Tito_3DXQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3dxq-query.scw PDB file : Tito_Scwrl_3DXQ.pdb: