Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIQAESRLKVADNSGAREILTIKVLGGSGRKTANIGDVIVATVKQATPGGVVKKGDVVKAVIVRTKSGARRTDGSYIKFDENAAVIIRDD-KSPRGTRIFGPVARELRENNFMKIVSLAPEVL 5AKA Chain:K ((2-122)) -IQEQTMLNVADNSGARRVMCIKVLGGSHRRYAGVGDIIKITIKEAIPRGKVKKGDVLKAVVVRTKKGVRRPDGSVIRFDGNACVLLNNNSEQPIGTRIFGPVTRELRSEKFMKIISLAPEV-

General information: TITO was launched using: RESULT: Template: 5AKA.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain K - contact count / total energy / energy per contact / energy per residue : 605 -50080 -82.78 -417.33 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain K : 0.90 3D Compatibility (PKB) : -82.78 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.90 QMean score : 0.415

(partial model without unconserved sides chains): PDB file : Tito_5AKA.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5AKA-query.scw PDB file : Tito_Scwrl_5AKA.pdb: