Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGRLVFNYRKAMREPKKIQQLTENYSLPFAVELIPAINYFIFVGLCFGFWYGVRMIFPHAFDNSYVIVIFGIPFFLTMLVTKIKPEGKNIYIYFFDFAKYYFFIKLPQKKYCNDRKIDLSNEKQIEFRKLVKVVDYSNETKNAYEGNTQEFAVNKNGRRVGVLPNKKQFDSYAK 2N2U Chain:A ((1-77)) ------------------------------------------------------------------------------MVDLKIDVSDDEEAEKIIREIREQWPKATVTRTNGDIKLDAQTEKEAEKMEKAVKKVKPNATIRKTGGSLEHHHHHH-------------------

General information: TITO was launched using: RESULT: Template: 2N2U.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 : 291 8178 28.10 106.20 target 2D structure prediction score : 0.40 Monomeric hydrophicity matching model chain A : 0.45 3D Compatibility (PKB) : 28.10 2D Compatibility (Sec. Struct. Predict.) : 0.40 1D Compatibility (Hydrophobicity) : 0.45 QMean score : ?

(partial model without unconserved sides chains): PDB file : Tito_2N2U.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2N2U-query.scw PDB file : Tito_Scwrl_2N2U.pdb: