Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNEGYIIAGLLLLTAGMIDFLW-----TTLWLESGAGPITRCLSAWLWKGCRKISGDHAKVLSMAGPLLLCLTLVIWISLFWSGWVLIYSSDPHSLMETQSKEPASWSDRIYFSGYVMFTLGNGDLAPNGGLWKLVTIIETAQGLLTITFSVTYLISVLSAVNQKRSFAQSVLSLG-----HDGTEIVHNAWNGKDFHDIDFLLVAASSELGKLTAQHNAFPILHFYHSTQHQESSIIAVAVLDEALTIFKYGIPEQYQPNQLHIKEARSSIKNYLDTVHTAYIHPAEQAPPEPDISKLQQSGIPALSKQTFQIAVNSIKERRQLLLGIIQAGARKWPVQEQAIGNAYSPK 3ZGY Chain:A ((19-306)) -HTPVTVIGLGLMGQALAGAFLGAGHPTTVWNRTAAPLVA--------RGAKS-AGSVAEAVAA------------------SPLVVVCVSDYDAVHALLDPLDGT-----ALQGRTLVNLTSGTSAQARERAAWADG-----------RGADYLDGAILAGPAAIGTADAVVLLSGPRSAFDPHASALGGLGAGTTYLGADHGLASLYDAAGLVMMWSILN--GFLQGAALLGTAGVDATTFAPFITQGIGTVADWLPGYARQIDDGAYPADDAAIDTHLATMEHLIHESEFLGVN------------------AELPRFIKALADRAVADG--HGGSGYPALIEQFRTH

General information: TITO was launched using: RESULT: Template: 3ZGY.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 : 1185 -142721 -120.44 -518.98 target 2D structure prediction score : 0.47 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : -120.44 2D Compatibility (Sec. Struct. Predict.) : 0.47 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.225

(partial model without unconserved sides chains): PDB file : Tito_3ZGY.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3ZGY-query.scw PDB file : Tito_Scwrl_3ZGY.pdb: