Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGSMDQSIAVKSPLTYAEALANTIMNTYTVEELPPANRWHYHQGVFLCGVLRLWEATGEKRYFEYAKAYADLLIDDNGNLLFRRDELD-AIQAGLILFPLYEQTKDERYVKAAKRLRSLYGTLNRTSEGGF--WHKDGYPYQMWLDGLYMGGPFALKYANLKQETELFDQVVLQESLMRKHTKDAKTGLFYHAWDEAKK-MPWANEET---GCSPEFWARSIGWYVMSLADMIEELPKKHPNRHVWKNTLQDMIKSICRYQ--DKETGLWYQIVDKGDRSDNWLESSGSCLYMYAIAKGINKGYLD-RAYETTLLKAYQGLIQHKTET----SEDGAFLVKDICVGTSAGFYDYYVSRERSTNDLHGAGAFILAMTELEPLFRSAGK 3WIW Chain:A ((70-396)) -------------------------------------PRDWTTGFFPGTLWYGYELSGDKNLAAEAKRFTLALDTIQYV----KDTHDLGFMLYCSYGNAYRVTGDKIYLKPLENGAANLYARFNKKVGAIRSWDFGHWQFPVIIDN-LMNLEYLYWAGKEFNKPEWFDAAKTHAVTTMKNHFRK-DYSSYHVI-YDTLSGKVLQRETHQGLTNESAWARGQAWGLYGYTMSYKDTK-----DKKFIEHAEHIAAFIMNHPAMP-ADKIPLWDFDVHNRDRSPRDASAAAVIASALLDLSTQV-KDGQKYFKFAEDILKTLSSDEYLAKPGENQFFILKH-----SVGALLYN----SEIDTPLNYADYYYLEALKRYAEIKKIDL-

General information: TITO was launched using: RESULT: Template: 3WIW.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 : 1783 -6025 -3.38 -19.31 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -3.38 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.449

(partial model without unconserved sides chains): PDB file : Tito_3WIW.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3WIW-query.scw PDB file : Tito_Scwrl_3WIW.pdb: