Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MPNIESAIKRVRTSENANVKNSSQTSAMRTAIKKFEDAVASGADNVDA--LYKEAVKAIDMAESKGLIHKNKANRDKSRLSKKIAK 4A2I Chain:T ((2-84)) --NIKSAKKRAIQSEKARKHNASRRSMMRTFIKKVYAAIEAG-DKAAAQKAFNEMQPIVDRQAAKGLIHKNKAARHKANLTAQINK

General information: TITO was launched using: RESULT: Template: 4A2I.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain T - contact count / total energy / energy per contact / energy per residue : 184 23754 129.10 293.26 target 2D structure prediction score : 0.52 Monomeric hydrophicity matching model chain T : 0.80 3D Compatibility (PKB) : 129.10 2D Compatibility (Sec. Struct. Predict.) : 0.52 1D Compatibility (Hydrophobicity) : 0.80 QMean score : 0.609

(partial model without unconserved sides chains): PDB file : Tito_4A2I.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4A2I-query.scw PDB file : Tito_Scwrl_4A2I.pdb: