Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MQATLDWLAGLARQHPEVFGGHPGEMAVLEASRSSSHESRVYGSGGALVHVKFFRRTLGRTSVTYDPCREMKAEYDTLREFEKNGFASGRHRVVRTLGINESLDCALATAYVPGD-TLLSIIQRTLKGGDDGELLEALGLAAGFLRKVHGLMPQSPKVDAAETFYSYMKPLFYLEEQGALDGFHRRVTK-GLSRWYGHRPLFEQRGVTVHGDANPSNFKIHEGVIYGLDLERSRPGRSPLLDVGTMVAELEHHCAYVAGDAGRAKPYVERFLRAYAPSPADRKKIDELLPFYVSRGLLKIAMLGYWKHGYRRSLVEAGARRIEEGP 3DXQ Chain:B ((27-232)) ----------------------------------GGLTNLVFRA--GDLCLRIP---------------NRANEAVAAREAAKAG-----VS-PEVLHVDPA-TGVMVTRYIAGAQTMSPEKFK--------TRPGSPARAGEAFRKLHGSGAVFPF--RFELFAMIDDYLKVLSTKNVTLPAGYHDVVREAGGVRSALAAHPLPLAACHCDPLCENFLDTGERMWIVDWEYSGMN-DPLWDLGDLSVEGKF-----------NANQDEELMRAYFGG------------------------------------------------

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 : 844 871 1.03 4.44 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain B : 0.60 3D Compatibility (PKB) : 1.03 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.169

(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: