Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MVQQKVEVRLKTGLQARPAALFVQEANRFTSDVFLEKDGKKVNAKSIMGLMSLAVSTGTEVTLIAQGEDEQEALEKLAAYVQEEV 2AK7 Chain:A ((1-85)) MVQQKVEVRLKTGLQARPAALFVQEANRFTSDVFLEKDGKKVNAKSIMGLMSLAVSTGTEVTLIAQGEDEQEALEKLAAYVQEEV

General information: TITO was launched using: RESULT: Template: 2AK7.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 : 295 -33921 -114.99 -399.07 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain A : 1.00 3D Compatibility (PKB) : -114.99 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 1.00 QMean score : 0.761

(partial model without unconserved sides chains): PDB file : Tito_2AK7.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2AK7-query.scw PDB file : Tito_Scwrl_2AK7.pdb: