Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKDVSKNQEENISDTALTNELIHLLGHSRHDWMNKLQLIKGNLSLQKYD--RVFEMIEEMVIDAKHESKLS----N-------LKTPHLAFDFLTF----NWKTHYMTLEYEVLGEI-KDLSAYDQKLAKLMRKLFHLFDQAVSRE-SENHLTVSLQTDHPDRQLILYLDFHGAFADPSAFDDIRQNGYEDVDIMRFEITSHECLIEIGLD 4R39 Chain:A ((17-176)) ------------------TELDRQLAEVQHRVKNHLAMIVSMIRIQSSQAGGVGSQFDSLSRRVEALQLLYQEMDIAGAAKATDKIIPLGAYLGRIASAINHIDGRGAIKVNVQADTVDVPVETAGRIGLLVSEVLTNALQHAFSDRASGVVQLRSSVM-SGEQLRVTVEDDGRGIPED--------------------------------

General information: TITO was launched using: RESULT: Template: 4R39.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 : 567 1474 2.60 10.45 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : 2.60 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.321

(partial model without unconserved sides chains): PDB file : Tito_4R39.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4R39-query.scw PDB file : Tito_Scwrl_4R39.pdb: