Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTAREQGVVKWFNDTKGFGFIQRNGGDDVFVHFRAIVGDGHRSLRDGQRVEFSVVQGQKGFQAENVQPLD 3PF4 Chain:A ((3-63)) -----EGKVKWFNSEKGFGFIEVEGQDDVFVHFSAIQGEGFKTLEEGQAVSFEIVEGNRGPQAANV----

General information: TITO was launched using: RESULT: Template: 3PF4.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 : 249 -37927 -152.32 -621.75 target 2D structure prediction score : 0.49 Monomeric hydrophicity matching model chain A : 0.83 3D Compatibility (PKB) : -152.32 2D Compatibility (Sec. Struct. Predict.) : 0.49 1D Compatibility (Hydrophobicity) : 0.83 QMean score : 0.565

(partial model without unconserved sides chains): PDB file : Tito_3PF4.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3PF4-query.scw PDB file : Tito_Scwrl_3PF4.pdb: