Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKFLPVILSLALITNASYANPFDPKPASGQVEIPNIGSGIGLLDQQKEKFIGEKVFREVHKQMPVIQDVWLEDQFFQVFSNILSETQLGQPIALVVIKD----PQINAFAVPGGLFALNTGLISSAR------------------NIDEIAGVMAHEIAHVSQRHFSRSEEAFKGQTLLSLAGLLAGVAL-----AAQAGGDAGAAV----M------LGTQ-AALLDKQLTYSRNQEREADRIGMQYMYAAGYNPQSMADYFETMHRATSRV----SFLPDFWLTHPLTSERMSEARLRANQMPKVKSRIYDVDFEILKWYTMVVAGEATENQLQSLASQKNLAGLLALSAFYLKQGDYTQAQATLEQAKSSGKPLVALIQTDIYLGQNKINQAYNSIAPLQMTMPENKAFSYKLAEVLLRQGKYAQVQTLVQRFINKNARDIQGWQLLQQAANLDKNSPLRAVNVLRYRAEAQYWSGSEEDAIKSMLHAQRLAKGNQAMSARIDSRLKQMQDERRMKI 5SYT Chain:A ((232-475)) ------------------------------------------------------------------------GKLKEEIEVMAKSIDFPL-TKVYVVEGSKRSSHS------NKRIVLFDTLLEEYSVLNKEEIKAKVKNKKQGCKNEEVLAVLGHELGHWKLGHTVKNIIISQMNSFLCFF-LF-AVLIGRKELFAAFGFYDSQPTLIGLLIIFQFIFSPYNEVLSFCLTVLSRRFEFQADAFAKKLG-----KAKDLYSALIKLNKDNLGFPVSDWLFSMWHYSHPPLLERLQALKTMKQS-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5SYT.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 : 530 -18602 -35.10 -106.30 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain A : 0.58 3D Compatibility (PKB) : -35.10 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.58 QMean score : 0.286

(partial model without unconserved sides chains): PDB file : Tito_5SYT.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5SYT-query.scw PDB file : Tito_Scwrl_5SYT.pdb: