Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKNKWLSFFSGKVQLELTGRGIERLLNECTRQGIPVFHVKKKKEAVSLYIQLQDVHAFRRVRSKFKCKARFINRKGFPFLLLKSKLNIGFTIGFAIFFILLFLLSNMVWKIDVTGAKPETEHQMRQHLNEIGVKKGRLQFLMMSPEKIQKSLTNGIDNITWVGVDLKGTTIHMKVVEKNEPEKEKYVSPRNIVAKKKATITRMFVQKGQPMAAIHDHVEKGQLLVSGLIGSEDHQQEVASKAEIYGETWYRSEVTVPLETLFNVYTGKVRTKHKLSFGSLAIPIWGMTFKKEELKHPKTEQEKHSLHFLGFKLPVSYVKEQTRESEEALRKYTKE--EAVQEGIK-LGKQDVEDKIGENGEVKSEKVLHQTVENGKVKLIILYQVIEDIVQTTPIVRETEE 5B2T Chain:B ((755-845)) --------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------MGRHKPENIVIEMAR--------NSRERMKRIEEGIKELGSQILKEHP--NTQLQNEKLYLYYLQNGR-------------------------

General information: TITO was launched using: RESULT: Template: 5B2T.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 78 16095 206.34 292.63 target 2D structure prediction score : 0.49 Monomeric hydrophicity matching model chain B : 0.55 3D Compatibility (PKB) : 206.34 2D Compatibility (Sec. Struct. Predict.) : 0.49 1D Compatibility (Hydrophobicity) : 0.55 QMean score : 0.661

(partial model without unconserved sides chains): PDB file : Tito_5B2T.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5B2T-query.scw PDB file : Tito_Scwrl_5B2T.pdb: