Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRVISGSKKGRSLKAVAGT-STRPTTDKVKESIFNMIGPYFDGGRGLDLFAGSGGLGIEALSR-GFEHCIFVDRDFKAIQTVKSNLKTLELTKHAQVYRNDAERALHAAAKRETGFRGIFLDPPYKEQ-----------------------KLKALLTLIDEYQM-LEEDGFIVAEHDREVELPETVGDLVMTRKETYGLTGVAIYKKRG 2B3T Chain:A ((76-242)) ------EFWSLPLFVSPATLIPRPDTECLVEQALARLPE--QPCRILDLGTGTGAIALALASERPDCEIIAVDRMPDAVSLAQRNAQHLAI-KNIHILQSDWFSAL-----AGQQFAMIVSNPPYIDEQDPHLQQGDVRFEPLTALVAADSGMADIVHIIEQSRNALVSGGFLLLEHGWQQ-----------------------------

General information: TITO was launched using: RESULT: Template: 2B3T.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 : 713 -65516 -91.89 -464.65 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -91.89 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.549

(partial model without unconserved sides chains): PDB file : Tito_2B3T.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2B3T-query.scw PDB file : Tito_Scwrl_2B3T.pdb: