Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAIQNPYTAYQQNSVNTATPGELTLMLYNGCLKFIRLAAQAIENDDMERKNENLIKAQNIIQELNFTLNRNIELSASMGAMYDYMYRRLVQANIKNDTGMLAEVEGYVTDFRDAWKQAIQSERKDRHGSGGIA 2NOX Chain:A ((54-103)) --------------------HQTTELWMKLMLHELRAARDGVKSDQLQPAFKMLARVSRIMDQLVQAWNV---------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2NOX.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 : 87 -7273 -83.60 -145.46 target 2D structure prediction score : 0.86 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : -83.60 2D Compatibility (Sec. Struct. Predict.) : 0.86 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.618

(partial model without unconserved sides chains): PDB file : Tito_2NOX.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2NOX-query.scw PDB file : Tito_Scwrl_2NOX.pdb: