Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -----------------MIGQQRNILATLGIDVWIP--------RTQVCQKNNAHTLWRDQVVEPHESITVPTIDVPAFEQKNTQPQVFEIPKVVEEPPIVVAEVSQPEILVE---KPKVIEQETI--TPFELQAYCLE--KCVIFVDVTALETEEKQLWANIQKAKV-GRYSELRWPFPLAAYQDQRGVGSYIQGFLDAVAAEKKILCLGKCAYIQHANIIHLASLKEMLDKPL-----LKKRLWQLMQDNNE----------- 2OCC Chain:C ((1-261)) MTHQTHAYHMVNPSPWPLTGALSALLMTSGLTMWFHFNSMTLLMIGLTTNMLTMYQWWRDVIRESTFQGHHTPAVQKGLRYGMILFIISEVLFFTGFFWAFYHSSLAPTPELGGCWPPTGIHPLNPLEVPLLNTSVLLASGVSITWAHHSLMEGDRKHMLQALFITITLGVYFTLLQASEYYEAPFTISDGVYGSTFFVATGFHGLHVIIGS----TFLIVCFFRQLKFHFTSNHHFGFEAGAWYWHFVDVVWLFLYVSIYWWGS

General information: TITO was launched using: RESULT: Template: 2OCC.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 521 -14302 -27.45 -67.46 target 2D structure prediction score : 0.46 Monomeric hydrophicity matching model chain C : 0.54 3D Compatibility (PKB) : -27.45 2D Compatibility (Sec. Struct. Predict.) : 0.46 1D Compatibility (Hydrophobicity) : 0.54 QMean score : 0.153

(partial model without unconserved sides chains): PDB file : Tito_2OCC.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2OCC-query.scw PDB file : Tito_Scwrl_2OCC.pdb: