Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFYSIKELVEQADLDFQGNVAELMITTEFELTGREREEVFLLMERNLEVMKASVQLGLNENKSRSGLTGGDAAKLDHYIENGKTLSDYTILSAARNAIAVNEHNAKMGLVCATPTAGSAGCLPSVLTAAIEKL----------DLSHEQQLDFLFAAGAFGLVIANNASISGAEGGCQAEVGS-ASAMSAAALTLAAGGTPYQASQAIAFVIKNMLGLI-CDP--VAGLVEVPCVKRNAMGASFAFIAADMALAGIESKIPVDEVIDAMYQVGASMPTAFRETAEGGLATTPTGRRLQKEIFGE 1SZQ Chain:B ((116-244)) ------------------------------------------------------------------------------------------------------------------------NLGGIL-ATADWLSRNAVASGKAPLTMKQVLTAMIKAHEIQGCIALENSFNR-V-G-LD-HVLLVKVASTAVVAEMLGLTREEILNAVSLAWVDGQSLRTYRHAPNTG---TRKSWAAGDATSRAVRLALMAKTGEM-----------------------------------------------

General information: TITO was launched using: RESULT: Template: 1SZQ.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 : 388 -24642 -63.51 -214.27 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain B : 0.57 3D Compatibility (PKB) : -63.51 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.57 QMean score : 0.322

(partial model without unconserved sides chains): PDB file : Tito_1SZQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1SZQ-query.scw PDB file : Tito_Scwrl_1SZQ.pdb: