Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSFFRNQLANVVEWEEFRDDMIFYKWNNREIKKGSRLIIRPGQDAVFLNNGRVEGVFQDDGDYDIESEIIPFLSTLKGFKFGFNSGMRAEVLFVNTKEFTVRWGTKQAINIPAAGMPGGMPIRANGTFNFKVQDYISLIDKIAGVKDQYFVEDIKT-RIISILDQLLMKWITREGKDMFNLQANAFDIAKGIQEDLDMQ-LISDGMTVTGFQIMSFNYPQEVQDMITKNASYGMVGDVNRYQQISMTDGMASGKMSGSGAASDMAGMMMGMNMANQMMNQMNQNQQAQSSGPQSTGSGSKPNFCPNCGTKTGEANFCPNCGQKLV 5FWX Chain:B ((157-253)) ----------------------------------------------------------------------------------------------------------------------GWHVSAICVENFNDVSYRQLLEELDRRQEKKFVIDCEIERLQNILEQ-----IVSVGK---HVKGYHYIIANLGFKDISLERFIHGGANVTGFQLVDFNTP-----MVTK-------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5FWX.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 279 -35063 -125.67 -369.08 target 2D structure prediction score : 0.49 Monomeric hydrophicity matching model chain B : 0.59 3D Compatibility (PKB) : -125.67 2D Compatibility (Sec. Struct. Predict.) : 0.49 1D Compatibility (Hydrophobicity) : 0.59 QMean score : 0.278

(partial model without unconserved sides chains): PDB file : Tito_5FWX.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5FWX-query.scw PDB file : Tito_Scwrl_5FWX.pdb: