Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNEGYIIAGLLLLTAGMIDFLWTTLWLESGAGPITRCLSAWLWKGCRKISGDHAKVLSMAGPLLLCLTLVIWISLFWSGWVLIYSSDPHSLMETQSKEPASWSDRIYFSGYVMFTLGNGD----------LAPNGGL-WKLVTIIETA-----------QGLLTITFSV----TYLISVLSAVNQKRSFAQ---SVLSLGHDGTEIVHNAWNGKDFHDIDFLLVAA------SSELGKLTAQHNAFPILHFYHSTQHQESSIIAVAVLDEALTIFKYGIPEQYQPNQ-----LHIKEARSSIKNYLDTVHTAYIHPAEQAPPE--------PDISKLQQSGIPALSKQTFQIAVNSIKERRQLLLGIIQAGARKWPVQEQAIGNAYSPK 2BG9 Chain:C ((1-484)) --------------VNEEERLINDLLIVNKYNKHVRPVKHNNEVVNIALSLTLSNLISLKETDE-TLTTNVWMDHAWYDHRLTWNASEYSDISILRLR----PELIWIPDIVLQNNNDGQYNVAYFCNVLVRPNGYVTWLPPAIFRSSCPINVLYFPFDWQNCSLKFTALNYNANEISMDLIIDPEAFTENGEWEIIHKPAKKNIYGDKFPNGTNYQDVTFYLIIRRKPLFYVINFITPCVLISFLAALAFYLPAESGEKMSTAICVL-LAQAVFLLLTSQRLPETALAVPLIGKYLMFIMSLVTGVVVNCGIVLNFHFRTPSTHSGIDSTNYIVKQIKEKNAYDEEVGNWNLVGQTIDRLSMFIITPVMVLGTIFIFVMGNFNRPPAK

General information: TITO was launched using: RESULT: Template: 2BG9.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 1185 -135416 -114.27 -421.86 target 2D structure prediction score : 0.42 Monomeric hydrophicity matching model chain C : 0.58 3D Compatibility (PKB) : -114.27 2D Compatibility (Sec. Struct. Predict.) : 0.42 1D Compatibility (Hydrophobicity) : 0.58 QMean score : 0.086

(partial model without unconserved sides chains): PDB file : Tito_2BG9.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2BG9-query.scw PDB file : Tito_Scwrl_2BG9.pdb: