Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNKLIQLALFFTLMLTGCSNSSTSSESKVETTVKTTAAFPQKELEKELKKLKPVSLDMKFESPLATELGKRKAKEEAEKQRQIAAEKKLEKEREAKRKKQQEEKAERQRLAEQQAAERQRLAEAERQAELERQRQAAIQKEQKANAEKKRQSQAQRQQTEAPSSNSQDPPSSSSQTDKTIQQPASELPDDDGYGYEERKKWHDDQVEWGIKQGYIDPEDAP 5A5T Chain:A ((544-606)) --------------------------------------------------------------------------QEKEEQHQLAVTAYLKNSR----KEHQRILARRQTIEERK--ERLESLNIQREKEELEQREAELQKVRK------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5A5T.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 : 14 662 47.25 10.50 target 2D structure prediction score : 0.92 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : 47.25 2D Compatibility (Sec. Struct. Predict.) : 0.92 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 1.010

(partial model without unconserved sides chains): PDB file : Tito_5A5T.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5A5T-query.scw PDB file : Tito_Scwrl_5A5T.pdb: