Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTTQNLMCPVCRQRLELVSKTWRCEQGHSYDIAKQGYVNLHVVQHKHSKNPGDTPESVDARRAFLQGGYYQPLQQAVVHLLKDLQAKMVLDIGCGEGYYTSAM-QQVVEQCIGVDIAKNAVQRA----AKLNDKVTWVVGTGATLPVIDQSMDVCTS--LFSPIPQTEILR--------VVKDDGYLIVVTSATDHLYAMREALFEQVNPHIPQKFVEQLQDLFELKEQQVIDAPLVLDQQALKNLIAMTPYAYKASPERRMQLEQKAHLQVTASFQIYLFQKRNKKAI 5JE2 Chain:A ((31-150)) --------------------------------------------------------------------------RTIFHMIGDVSGKSVLDLACGFGFFGREIYRRGAAKVVGVDISEKMIELAREESRKYGDPLEFHVRDVANMEPLGQ-FDLVNAAWLFNYADSVENLRKMFKVVRASLKPDGKLVAYTVDPD----------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5JE2.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 : 478 -24516 -51.29 -233.49 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -51.29 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.488

(partial model without unconserved sides chains): PDB file : Tito_5JE2.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5JE2-query.scw PDB file : Tito_Scwrl_5JE2.pdb: