Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLLEKILQSQGFGSRKYCQQLIKNGSVSIDGEVVSDLKKQFSPENFEFSVFGQNYQYREKIYIALRKPQGFECSHHPQHHQSVFSLLPETMIHRGVQAVGRLDQDTTGLLLLTDDGKYLQVLTHPRKHVPKVYHVTTY--DPVTPEQIEMLI---QGVNLHQEKEVFAAT---DVALL--GTHQLTMTIHQGVYHQVKRMIAAVGN------KVEKLHRHQIGQLVLPEIEDGDWVYLSEQEKQLAQNII 2AUS Chain:C ((43-212)) --------------------------------------------------------HIQYGVINLDKPPGPTSHEVVA-------WIKRILNLEKAGHGGTLDPKVSGVLPVALERA--TRVVQALLPAGKEYVALMHLHGDVPEDKIRAVMKEFEGEIIQR------TRKVYYIEILEIDGRDVLFRVGVEAGTYIRSLIHHIGLALGVGAHMAELRRTRSGPFKEDE---------------------

General information: TITO was launched using: RESULT: Template: 2AUS.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 : 622 -18803 -30.23 -132.41 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain C : 0.60 3D Compatibility (PKB) : -30.23 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.453

(partial model without unconserved sides chains): PDB file : Tito_2AUS.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2AUS-query.scw PDB file : Tito_Scwrl_2AUS.pdb: