Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ---MKKITTNEQFNELIQSDKE--IIVKFYADWCPDCTRMNMFIGDILEEYNQN---DWYELN--KDELPDLAEKYQV-MGIPSLLIFKNGEKTAHLHSANAKTPEEVTEFLSEHIS 2TRX Chain:A ((1-108)) SDKIIHL-TDDSFDTDVLKAD-GAILVDFWAEWCGPCKMIAPILDEIADEYQ--GKLTVAKLNID--QNPGTAPKYGIR-GIPTLLLFKNGEVAATKVGAL--SKGQLKEFLDANLA

General information: TITO was launched using: RESULT: Template: 2TRX.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 : 397 -74716 -188.20 -770.27 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.78 3D Compatibility (PKB) : -188.20 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.78 QMean score : 0.755

(partial model without unconserved sides chains): PDB file : Tito_2TRX.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2TRX-query.scw PDB file : Tito_Scwrl_2TRX.pdb: