Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKQTTNLTEVQDILQ--QSSVAVIYLSMPNCSVCHAVRPRLEELLTHYD-IPALHLDAFETPEVASKFEVLTAPVVLIFHQGKEVFRQARFIDFKKIRYLLDELTAEDDSLSYEEIFRTK 3TRX Chain:A ((3-104)) -KQIESKTAFQEALDAAGDKLVVVDFSATWCGPCKMIKPFFHSLSEKYSNVIFLEVDVDDCQDVASECEVKCTPTFQFFKKGQKVGEFSGA-NKEKLEATINEL----------------

General information: TITO was launched using: RESULT: Template: 3TRX.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 : 401 -13312 -33.20 -134.46 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.73 3D Compatibility (PKB) : -33.20 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.609

(partial model without unconserved sides chains): PDB file : Tito_3TRX.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3TRX-query.scw PDB file : Tito_Scwrl_3TRX.pdb: