Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLNSANTTAPSLLSAYGLNSYTSSNSGSVTKAAESTETAVADSASNKHEANQIRSGDFSIDSAIKKAADKYGVDEKLIRAVIKQESGFNAKAVSGAG---AMGLMQLMPSTASSLGVSNPL----------DPQQNVEGGTKYLKQMLDKY-DGNVSMALAAYNAGPGNVDRYGGI-------------PPFQETQNYVKKITSVYYA--------------------- 1QSA Chain:A ((451-618)) -----------------------------------------------------LAY----NDLFKRYTSGKEIPQSYAMAIARQESAWNPKV---KSPVGASGLMQIMPGTATHTVKMFSIPGYSSPGQLLDPETNINIGTSYLQYVYQQFG-NNRIFSSAAYNAGPGRVRTWLGNSAGRIDAVAFVESIPFSETRGYVKNVLAYDAYYRYFMGDKPTLMSATEWGRRY

General information: TITO was launched using: RESULT: Template: 1QSA.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 : 554 -50996 -92.05 -424.96 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -92.05 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.440

(partial model without unconserved sides chains): PDB file : Tito_1QSA.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1QSA-query.scw PDB file : Tito_Scwrl_1QSA.pdb: