Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNGMKAKKMWMAGLALLGIGSLALATKKVADD-----RKLMKTQEELTEIVRDHFSDMGEIATLYVQVYESSLESLVGGVIFEDGRHYTFVYENEDLVYEEEVL 2XAJ Chain:A ((416-466)) ---------------------IQLQEKHVKDEQIEHWKKIVKTQEELKELLNKMVNLKEKIKELHQQYKEAS--------------------------------

General information: TITO was launched using: RESULT: Template: 2XAJ.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 : 8 526 65.69 11.42 target 2D structure prediction score : 0.83 Monomeric hydrophicity matching model chain A : 0.59 3D Compatibility (PKB) : 65.69 2D Compatibility (Sec. Struct. Predict.) : 0.83 1D Compatibility (Hydrophobicity) : 0.59 QMean score : 0.379

(partial model without unconserved sides chains): PDB file : Tito_2XAJ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2XAJ-query.scw PDB file : Tito_Scwrl_2XAJ.pdb: