Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ---MLDPLDILTNIDDVLPYYQAIFSAEEQKVVGYEVLGRILADSEIQSL-GPFFLDAGIPEEYKLEVDNRIIRQALDRFLEAD------SDLLIFMNQDANLLMLDHGESFLELLKEYEAK-GIELHRFVLEITEHN-FE-GDIEQLYHMLAYYRTYGIKIAVDNIGKESSNLDRIALLSPDLLKIDLQALKVSQPSPSYEHVLYSISLLARKIG-AALLYEDIEANFQLQYAWRNGGRYFQGYY-LVSPSETFLERDVLKQRLKTEFHQFITHEKKKLETVYEHSEQFYKRVHQAVTSLRKNNLSSDDDFIKKLAEELTDCSFRIYMCDEEGDQLTGNVFKQDGEWIYQPEYAEKNWSWRPYFLENIMRMRNLRKGFFSDLYSDLETGEMIRTFSYPMDDQMYLFIDLPYSYLYEQDGLI 2R6O Chain:A ((24-281)) RLTLDTRLRQALERNELVLHYQPIVELASGRIVGGEALVRWED-PERGLVMPSAFIPAAEDTGLIVALSDWVLEACCTQLRAWQQQGRAADDLTLSVNISTRQFE---GEHLTRAVDRALARSGLRPDCLELEITENVMLVMT--DEVRTCLDALRARGVRLALDDFGTGYSSLSYLSQLPFHGLKIDQSFVRKIPAHPSETQIVTTILALARGLGME-VVAEGIETAQQYAFLRDRGCEFGQGNLMSTPQAADAFASLLDRQKA-------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2R6O.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 : 1197 -141131 -117.90 -580.78 target 2D structure prediction score : 0.55 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -117.90 2D Compatibility (Sec. Struct. Predict.) : 0.55 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.418

(partial model without unconserved sides chains): PDB file : Tito_2R6O.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2R6O-query.scw PDB file : Tito_Scwrl_2R6O.pdb: