Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MELNLKEDWSKKMKTALNRTPASFPVRRMDYNFEDTPRYWCNHEPSLTHYFTGLSTLFPEGESYFV-RSVRALRAK----AKENEILDREIGAFIGQEAMHSKEHHAFHVSAQQY-GLNP-------ESLEKATGIVLKAI-EKVFSKKWNLLVTVGLEHYTAVLVVSMMQSV--NELMTENTIRNLWLWHSVEETEHKAVAYDLYQHLYGNGLDAYIPRVGIFTFSLVLITAFSTIYHIVLMKRDKQLTNFKTWRNFFKFASKQYKVLIPKFLEYYRFDFHPNQTDEKALVAATKVKLGINDRSLLLS 5HYH Chain:A ((79-229)) -----------------------------------------------------YNRNTVLIEQRIANPAFELVIGGAYPGLG-GQQLELAVAQAMVDEQYHTLMHINGSAVTRRMRRSDFSDRVLPDSHITTIHQEHLDRCEEPWQRSLTTLGFATVAEIS----INAYLDLLADDQ-EIQVVNSTTVKLHNRDEYCHASISGEMMKQVY---------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5HYH.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 : 431 -8784 -20.38 -65.06 target 2D structure prediction score : 0.55 Monomeric hydrophicity matching model chain A : 0.56 3D Compatibility (PKB) : -20.38 2D Compatibility (Sec. Struct. Predict.) : 0.55 1D Compatibility (Hydrophobicity) : 0.56 QMean score : 0.287

(partial model without unconserved sides chains): PDB file : Tito_5HYH.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5HYH-query.scw PDB file : Tito_Scwrl_5HYH.pdb: