Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEERYSRQIRFKQIGEEGQKRLADSHVLIVGAGALGTAGAEGLSRAGVGTITIIDRDYVEWSNLQRQQLYTESDAKLRMPKAMAAKEHLSAINSEIHIEAYVTEGTAETLEPLIEKADVVIDATDNFETRMLINDLAQK------------TKTPWVYGACVSSQGMFMTVIPGETPCLSCLFEQIPVG--GATCD----------------------------------------------------------------------TAGIIPPAVHIVSAYQQAEALKLLTGQKEAIQRGFVTFDVWNN-SHMKINVNHVRREECPSCGANAVYPYLQDWNTPKAAVLCGRDTVQVRSESLKRIPKQELIKRLKTIGKVEANAFLLHIFYEDFRIVIFNDGRALVHGTNDVKEANSVLARVIGL 1TT5 Chain:B ((31-357)) --------------TESLQFLLDTCKVLVIGAGGLGCELLKNLALSGFRQIHVIDMDTIDVSNLNRQFLFRPKDI--GRPKAEVAAEFLNDRVPNCNVVPHFNKIQDFND-TFYRQFHIIVCGLDSIIARRWINGMLISLLNYEDGVLDPSSIVPLIDGGTEGFKGNARVILPGMTACIECTLELYPPQVNFPMCTIASMPRLPEHCIEYVRMLQWPKEQPFGEGVPLDGDDPEHIQWIFQKSLERASQYNIRGVTYRLTQGVVKRIIPAVASTNAVIAAVCATEVFKIATSAYIPLNN-YLVFNDVDGLYTYTFEA--ERKENCPACSQLP--------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 1TT5.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 : 1255 -156075 -124.36 -687.55 target 2D structure prediction score : 0.69 Monomeric hydrophicity matching model chain B : 0.63 3D Compatibility (PKB) : -124.36 2D Compatibility (Sec. Struct. Predict.) : 0.69 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.514

(partial model without unconserved sides chains): PDB file : Tito_1TT5.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1TT5-query.scw PDB file : Tito_Scwrl_1TT5.pdb: