Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSVVAFKQVDVFTSQAFKGNPVAVIMDASTLTSEQMQAIANWTNLSETTFVLPAIDSQADYQVRIFTPQSELPFAGHPTIGTAYALLEAGLVKAKEGQLVQQCAAGLVTLTVNDSNHISFEL-PK-PKITPLDALQTQKLAEILKCKINTQWNAALVDVGARWVVLQAVNAKAVLASQPDLNALKQFSLEMKVTGSTIYGFYEESNEQKRIEVRSFAPAYGVNEDPVCGSGNGSVASFIRYHSILPAQNDVMLSSQGQALGREGQLQLELHQDKILVGGAAVTCIDGTIKL 1S7J Chain:B ((1-260)) -MSYPYYIVDAFAEEVFKGNPAAVYVLEKWLPEAVMQNIAIENNLSETAFTVKE---GQSYALRWFTPEREIDLCGHATLATAFVLFNYYSVA--EETLHFTSQSGPLAVTKKEE---YYYLDFPYILPERIP--ILPEYEAALGT------KIYEAYLG-RDLFFVLKDEETVAKITPDFSALKALDLG--V-GVIVTASGD---S-VDFVSRTFFPKLRINEDPVCGSAHANLIPYWGKRLN----QTTLSAYQVSP--RGGFLTCEVKENRVIIGGTAKLFAKGEAYL

General information: TITO was launched using: RESULT: Template: 1S7J.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 : 1565 -111033 -70.95 -430.36 target 2D structure prediction score : 0.71 Monomeric hydrophicity matching model chain B : 0.71 3D Compatibility (PKB) : -70.95 2D Compatibility (Sec. Struct. Predict.) : 0.71 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.474

(partial model without unconserved sides chains): PDB file : Tito_1S7J.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1S7J-query.scw PDB file : Tito_Scwrl_1S7J.pdb: