Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAYDDQNIFAKILRGELPAIKLYEDDQVLAFMDIMPQADGHALVIPKTPAVTLLDLPPEAAAYTIQIVQKIAKAMETALNLDGIVLMQLSGAAAGQTVPHVHFHLIPTNVHQLGKHAAQLGDQDKIKALAEKIKAAL 3O1C Chain:A ((12-120)) -RPGGDTIFGKIIRKEIPAKIIFEDDQALAFHDISPQAPTHFLVIPKKHISQISAAEDADESLLGHLMIVGKKCAADLGLKKGYRMVVNEGSDGGQSVYHVHLHVLGGRQ---------------------------

General information: TITO was launched using: RESULT: Template: 3O1C.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 : 486 -66954 -137.76 -614.25 target 2D structure prediction score : 0.71 Monomeric hydrophicity matching model chain A : 0.71 3D Compatibility (PKB) : -137.76 2D Compatibility (Sec. Struct. Predict.) : 0.71 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.583

(partial model without unconserved sides chains): PDB file : Tito_3O1C.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3O1C-query.scw PDB file : Tito_Scwrl_3O1C.pdb: