Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSIVERPSYTSKDVEVTSREPLFSGFIQVEKVSLRHRLFNQSEYTPVLQRELVHRPEAAGVLLYNDQKQQFALIEQFRVGALDDSHSPWQL-EIIAGVLDGNESPESCIRCESLEESGCEVQDLEHLFSFYPSAGACSELFHLYVAETN--LPAVGGVFGVDNEGENIQLHLFSYSEIQTLLNSGRLRNAPVIMALQWLAQHSKTIINPKR 3O52 Chain:B ((38-184)) ------------------------------------------------KREVYDRGNGATILLYNTKKKTVVLIRQFRVATWVNGNESGQLIESCAGLLD-NDEPEVCIRKEAIEETGYEVGEVRKLFELYMSPGGVTELIHFFIAEYSDN---------------DIEVLELPFSQALEMIKTGEIRDGKTVLLLNYL------------

General information: TITO was launched using: RESULT: Template: 3O52.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 : 599 -41575 -69.41 -314.96 target 2D structure prediction score : 0.51 Monomeric hydrophicity matching model chain B : 0.75 3D Compatibility (PKB) : -69.41 2D Compatibility (Sec. Struct. Predict.) : 0.51 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.397

(partial model without unconserved sides chains): PDB file : Tito_3O52.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3O52-query.scw PDB file : Tito_Scwrl_3O52.pdb: