Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFTAYQDARSWIHGRLKFGVKPGLGRMKQLMARLGHPEKKIRAFHVAGTNGKGSTVAFIRSMLQEAGYTVGTFTSPYIITFNERISVNGIPISDEEWTALVNQMKPHVEALDQTEYGQP----TEFEIMTACAFLYFAEFHKVDFVIFETGLGGRFDSTNVVEPLLTVITSIGHDHMNILGNTIEEIAGEKAGIIKEGIPIVTAVTQPEALQVIRHEAERHAAPFQSLHDACVIFNEEALPAGEQFSFKTEEKCYEDIRTSLIGTHQRQNAALSILAAEWLNKEN---IAH-----ISDEALRSGLVKAAWPGRLELVQEHPPVYLDGAHNEEG----VEKLAETMKQRFAN-SRISVVFSALKDKPYQNMIKRLETIAHAIHFASFDFPRAS----LAKDLYDASEISN--KSWSEDPDDVIKFIESKKGSNEIVLITGSLYFISDIRKRLK 3QCZ Chain:A ((34-435)) ----------------------GLERVKQVAERLDLLKPAPKIFTVAGTNGKGTTCCTLEAILLAAGLRVGVYSSPHLLRYTERVRIQGQELSEAE----------HSHSFAQIEAGRGDISLTYFEFGTLSALQLFKQA-KLDVVILEVGLGGRLDATNIVDSDVAAITSIALDHTDWLGYDRESIGREKAGVFRGGKPAV--VGEPDMPQSIADVAAELGAQLYR-RDVAWKFS-------Q--------------NGWHWQCGERQLTGLPVPNVPLANAATALAVLHYSELPLSDEAIRQGLQAASLPGRFQVVSEQPLLILDVAHNPHAARYLVNRLAQVI------QGKVRAVVGMLSDKDIAGTLACLSERVDEWYCAPLEGPRGASAGQLAEHLVSARQFSDVETAWRQAMQDA--------DTQDVVIVCGSFHTVAHVMAAL-

General information: TITO was launched using: RESULT: Template: 3QCZ.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 : 1992 -37761 -18.96 -105.48 target 2D structure prediction score : 0.52 Monomeric hydrophicity matching model chain A : 0.75 3D Compatibility (PKB) : -18.96 2D Compatibility (Sec. Struct. Predict.) : 0.52 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.446

(partial model without unconserved sides chains): PDB file : Tito_3QCZ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3QCZ-query.scw PDB file : Tito_Scwrl_3QCZ.pdb: