Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MWLSNEGGFYMKKISTLLFIGLVSLGLFGFSIPGFAHGYITSPGSRAYLGTSAAGNLNQNVGRAQWEPQSIEATKNT----FIDGKIASAGVSGFEPLDEQTSNRWHKNMVNPGTLNITWNLTAQHRTSTWDYYITKPTWNPNQPLKFSDFEL--ITKIDDKATVPPKTVNQTITLPQDRKGYNVILAVWNISDTTNAFYQVIDVNIQ- 2BEM Chain:A ((1-170)) ------------------------------------HGYVESPASRAYQCKLQL---NTQCGSVQYEPQSVEGLKGFPQAGPADGHIASADKSTFFELDQQTPTRWNKLNLKTGPNSFTWKLTARHSTTSWRYFITKPNWDASQPLTRASFDLTPFCQFNDGGAIPAAQVTHQCNIPADRSGSHVILAVWDIADTANAFYQAIDVNLSK

General information: TITO was launched using: RESULT: Template: 2BEM.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 : 879 35155 39.99 215.67 target 2D structure prediction score : 0.72 Monomeric hydrophicity matching model chain A : 0.74 3D Compatibility (PKB) : 39.99 2D Compatibility (Sec. Struct. Predict.) : 0.72 1D Compatibility (Hydrophobicity) : 0.74 QMean score : 0.386

(partial model without unconserved sides chains): PDB file : Tito_2BEM.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2BEM-query.scw PDB file : Tito_Scwrl_2BEM.pdb: