Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLNLKSSHSTAFTPSSPAERYAEALASGQFMADEAQAQAVQELDRVWKELLNRYKASKKAFRRFRRQTSPKGVYMWGSVGRGKTWLMDQFYESVPFRRKTR---MHFHHFMQHVHKELNKLSGQRNPLDIVADQIYKDAVVICFDEFFVSNVTDAM---ILSDLFQKLFVRGVTLIATSNIAPDGLYKNGIH---RDRFIPTIEMVKKNCVVLNVDAGVDYRLRVLKQAQLFKSPLGNEAQSWISECYTALTHTQTNSHEPIVINNRVVETLGHTEDVLWCEFSELCLKPRSPADFIEIANIYNTVLVSNVPHLTDFLSEGTRRFIYLVDEFYDRGVKLLLTSQDSIIDIYQGEKLAFEIERTRSRLLEMQSDEYLHSEHRHIDATKTS 4M4W Chain:K ((159-304)) -------------------------------------------------------------------GKGKGLYLYGKFGVGKTFMLAAIANEL-AEKEYSSMIVYVPEFVRELKNSLQDQ-----TLEEKLNM-VKTTPVLMLDDIGAES-TSWVRDEVIGTVLQHRMSQQLPTFFSSNFSPDELKHHFTYEKEEVKAARLMERILYLAAPIRLD-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4M4W.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain K - contact count / total energy / energy per contact / energy per residue : 486 -9451 -19.45 -71.60 target 2D structure prediction score : 0.45 Monomeric hydrophicity matching model chain K : 0.61 3D Compatibility (PKB) : -19.45 2D Compatibility (Sec. Struct. Predict.) : 0.45 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.306

(partial model without unconserved sides chains): PDB file : Tito_4M4W.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4M4W-query.scw PDB file : Tito_Scwrl_4M4W.pdb: