Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence GGRKPEPWT------AEQKANMIALS-RSTLSRPRCNIII------------YGLPSGRNQDRPVM-GEADTALNSEVFITVR---SGEKYRCTVKDDCDKPTCHELPPHLTYAGTDMHAIPLVTLRSLGVEIN 4IT6 Chain:A ((6-122)) DWYVGTEWEDKNRGLAKKVIGLQFTEMDKPTIISTVEFSVNKKATNLGGRPSKYLVATYPQKHSLEMGTSLTAVDCYLELLLQQFVPGETAACSITTKTG---------------------ERIEFELKLEKIV

General information: TITO was launched using: RESULT: Template: 4IT6.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 : 244 8082 33.12 89.79 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : 33.12 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.336

(partial model without unconserved sides chains): PDB file : Tito_4IT6.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4IT6-query.scw PDB file : Tito_Scwrl_4IT6.pdb: