Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MMRIGLFLLTNLAVLVVAGIILSLFGVGSYHGAGGLNLGNLLVICFVFGMVGSLVSLFMSKWMAKKTTGTELIDPNAPRNQAESWLLQTVAELSQRAGI----NMPEVGIFPSYQSNAFATGWNKNDALVAVSSGLLERMNKDELRAVLAHEIGHVANG-DMVTLALIQGVVNAFVMFFARVVGDFIDRNVFGRQDNEAPGMGYFIITMVLDIVFGILASAIVMWFSRYREYRADEAGARLAGKQAMISALLRLQAETELPDQMPKEMKAFAIAEGKEQGFSLAALFQTHPTIEQRVAALHQLDCP 4QHI Chain:B ((7-80)) -------------------------------------------------------------------------------------LNEILSNTINELNLNDKKANIKIKIKPLKWKIASIS---LTNKTIYINKNILPYLSDEEIRFILAHELLHLKYGKYH------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4QHI.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 : 233 -5588 -23.98 -80.98 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain B : 0.48 3D Compatibility (PKB) : -23.98 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.48 QMean score : 0.652

(partial model without unconserved sides chains): PDB file : Tito_4QHI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4QHI-query.scw PDB file : Tito_Scwrl_4QHI.pdb: