Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTLNEYILQYRLKQAIDKMAESPNSPLSAISDQVGFSDYKYFAKVFKKYLHISPKKLKSLGRIVK 3LSG Chain:A ((48-102)) --FQDYLLQKRMEKAKLLLLTTELKNYE-IAEQVGFEDVNYFITKFKKYYQITPKQYR-------

General information: TITO was launched using: RESULT: Template: 3LSG.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 : 168 -14982 -89.18 -272.40 target 2D structure prediction score : 0.80 Monomeric hydrophicity matching model chain A : 0.75 3D Compatibility (PKB) : -89.18 2D Compatibility (Sec. Struct. Predict.) : 0.80 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.573

(partial model without unconserved sides chains): PDB file : Tito_3LSG.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3LSG-query.scw PDB file : Tito_Scwrl_3LSG.pdb: