Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSFFKKLAASAGIGAAKVDTILE----KDAYFPGEEVQGTVHVKGGKIAQDIRYIDLQLSTRYVIVKDDEEHR-----------KYATIHSFRVT--GSFTIQPGEEHQFPFTFTLPLD-TPIT----VGKVEVAVVTDLDIQGGIDKSDHDRIFVEAHPWIENVLEAIENLGFRLNEADCEQAPYFQRRLPFVQEFEFVPTSGYYRQMLDELELIFLLDEDGLEIIFEVDRRARGLRGWLEEMYNDGEQLVRVRFSQSELEDTEELEEVLEEILDQYAE 4R7X Chain:A ((12-173)) ---------------KSLTISFDCLNNVPVYSSGDTVSGRVNLEVTG-EIRVKSLKIHARGHAKVRWTESR--NTAYTQNYTEEVEYFNHKDILIGH-FHTIHSGR-HEYAFSFELPQTPLATSFEGRHGSVRYWVKAELHRPWLLPVKLKKEFTVFEHIDINT-PS-----------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4R7X.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 : 520 -45933 -88.33 -370.43 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : -88.33 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.423

(partial model without unconserved sides chains): PDB file : Tito_4R7X.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4R7X-query.scw PDB file : Tito_Scwrl_4R7X.pdb: