Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PIPRIIGPCEVKVLKAGVSQHLAYFKMGRETTKTFFVPVPGGSTYLFELRTTYDCTATILRWTMPRDYG------------------- 4RKS Chain:A ((21-337)) TYRSIGSTAYPTIGVVLLGGIANPVTRTPLHTSAGIAYSDSCGSIRSETRIYADEATHIYFNGTESTDDNRSVRRVLDRYSSVFEEAFGTKTVSYSSQNFGILSGSSDAGAASIGAAILGLKPDLDPHDVENDLRAVSESAGRSLFGGLTITWSDGFHAYTEKILDPEAFSGYSIVAFAFDYQRNPSDVIHQNIVRSDLYPARKKHADEHAHMIKEYAKTNDIKGIFDLAQEDTEEYHSILRGVGVNVIRENMQKLISYLKLIRKDYWNAYI-VTGGSNVYVAVE-----SENADRLFSIENTFGSKKKMLRIVGGAWHRRPE

General information: TITO was launched using: RESULT: Template: 4RKS.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 : 103 -4605 -44.70 -73.09 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.56 3D Compatibility (PKB) : -44.70 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.56 QMean score : 0.211

(partial model without unconserved sides chains): PDB file : Tito_4RKS.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4rks-query.scw PDB file : Tito_Scwrl_4RKS.pdb: