Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLLAMNEYNKCCFAKHAEKGKKYYCRGCRKRVILKKGKKKCAHFAHQKSDNCSVFSERESKEHLQLKECFMDWLGQSVEPVFLEAYLPRLRQRPDILLANLAIEIQCSRLSHQRFIERTQNYLNNSYQVWWILGNSFLGQSQFSLIEKSCCYYNRKRGVHCWKADLKKQKLYLYHHITETVSGHISFCSSCWTFSSRDLKEIFTSNEIKMNQMKKIEKVSEDGKKWLTRQLIHKQKNTVSIQEQCYLRHKHLLHLSSWIYQKSRFFFYLQEQVFLYRMLYEEALENQKVPDFNSWLCQIKEHKREWLFPMIDEEMVYQQFFNECIHLSSLKK 4UI9 Chain:G ((1-25)) -----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------MLRRKPTRLELKLEDIEEFENIRKD--------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4UI9.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain G - contact count / total energy / energy per contact / energy per residue : 6 100 16.67 4.00 target 2D structure prediction score : 0.44 Monomeric hydrophicity matching model chain G : 0.55 3D Compatibility (PKB) : 16.67 2D Compatibility (Sec. Struct. Predict.) : 0.44 1D Compatibility (Hydrophobicity) : 0.55 QMean score : 0.569

(partial model without unconserved sides chains): PDB file : Tito_4UI9.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4UI9-query.scw PDB file : Tito_Scwrl_4UI9.pdb: