Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNRAPDTPEVVLRLRGVCKRYGSITAVSNLDLDVHDAEVMALLGPNGAGKTTTVEMCEGFVRPDAGSIEVLG----LDPITDNARL-----------------RARIGVMLQGGGGYPAARAGEMLDLVASYAANPLDPHWLLDTLGLTEAARTTYRRLSGGQQQRLALACALVGRPQLVFLDEPTAGMDAHARVLVWELIDALRRDGVTVVLTTHHLKEAEELADRLVIIDHGVTVAAGTPAELMRSGAKDQLRFTAPPRLDLSLLASALPEGYQATELTPGEYLVEGPVDPQVLATVTAWCAQIDVLATDMRVEQRSLEDVFLDLTGRKLRQ 4WBS Chain:A ((37-268)) --------SSSLVVRNLKKRYGSRTVVKDVSLDVKSGEVVGLLGPNGAGKTTSFYMIVGLVPLDAGEIDLDGKSISLLPIHKRASLGLSYLPQEASVFRKLSVEENIRAVLELQVGDDGKRLSK--DAIASRT------EALLDELQISHLRENPALSLSGGERRRVEIARALATNPSFILLDEPFAGVDPIAVLEIQKIVKFLKQRNIGVLITDHNVRETLGICDHAYIISDGSVLAAGAPGDIIEN--------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4WBS.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output 3D Compatibility (PKB) -136255 for 1596 contacts (-85.4/contact) + 2D Compatibility (PS) -23550 + (NN) -12064 + (LL) 6632 1D Compatibility (HY) -15600 + (ID) 3950 Total energy: -184787.0 ( -115.78 by residue) QMean score : 0.398

(partial model without unconserved sides chains): PDB file : Tito_4WBS.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4WBS-query.scw PDB file : Tito_Scwrl_4WBS.pdb: