Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFFQIQYKSSTRDGGNNVNGLFITIEGPDGAGKTSILNELYPLLKEVAKTEIIQTREPGGIPIAEEIRAVILDPKNDRMDERTEALLYAAARRQHLVEKVLPALAKGKIVLCDRFVDSSLAYQGAGRRIGVTEIARLNEFATEGTTPDFTLYLDVDSDTGLRRIKKNRQNQIDRLDSEGLEFHQRVRHAYLKLAEENPERIHKVDARKSFEEVLQTSYHTIIEQYPQFFEN 3UXM Chain:C ((1-192)) ------------------TGLFVTLEGPEGA---TNRDYLAERLRERG-IEVQLTREPGGTPLAERIRELLLAPSDEPMAADTELLLMFAARAQHLAGVIRPALARGAVVLCDRFTDATYAYQGGGRGLPEARIAALESFVQGDLRPDLTLVFDLPVEIGLARAA------LDRFEQEDRRFFEAVRQTYLQRAAQAPERYQVLDAGLPLAEV------------------

General information: TITO was launched using: RESULT: Template: 3UXM.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 : 851 -61420 -72.17 -332.00 target 2D structure prediction score : 0.70 Monomeric hydrophicity matching model chain C : 0.77 3D Compatibility (PKB) : -72.17 2D Compatibility (Sec. Struct. Predict.) : 0.70 1D Compatibility (Hydrophobicity) : 0.77 QMean score : 0.456

(partial model without unconserved sides chains): PDB file : Tito_3UXM.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3UXM-query.scw PDB file : Tito_Scwrl_3UXM.pdb: