Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNFKPLAYILLATSSLTACTMAPVKEQKIEPFVFKEPELTPPFYALNPFNYDAPPAFEVALKEAAAQPVTKMVVTRQDDPTKTLTLDTNKLIVPTVNNSQRSMKYAVLAGDNEIDVTEIDDFLQLVEGKARHYPPRFTDRQERKGFESKLMEVT----QRLD-TLAANPDASFDILIRAFKASV------------------LARNL---DLGTAHTTKSLEYAQRLLKINPDDAEANFWFGFGLSEGGGQREAIPYLDKAIKGNVQEAYLAAANNYIAMEQKKNAIQTLKNYKVKYPDEAEVADRLIQEIEKQGRWNVWQVLTNPAMSSATPSAATKK 5MGX Chain:E ((125-244)) --------------------------------------------------------------------------------------------------------------------------------------------QERVALANRKRECGNAHYQRADFVLAAN---SYDLAIKAITSSAKVDMTFEEEAQLLQLKVKCLNNLAASQLKLDHYRAALRSCSLVLEHQPDNIKALFRKGKVLAQQGEYSEAIPILRAALK----------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5MGX.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain E - contact count / total energy / energy per contact / energy per residue : 337 21820 64.75 232.12 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain E : 0.59 3D Compatibility (PKB) : 64.75 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.59 QMean score : 0.534

(partial model without unconserved sides chains): PDB file : Tito_5MGX.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5MGX-query.scw PDB file : Tito_Scwrl_5MGX.pdb: