Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MPVIKINNLNKVFGDNEVLKDINLEINQGEVVAIIGPSGSGKSTLLRCMNLLEVPTKGQVIFEGNDLTEKGTQVDKLRQKMGMVFQNFNLFPHKKVVDNI------------ILAPKLL-KKDNNDELHKEALSLLDKVGLKEKADVYPNQLSGGQKQRVAIARALAMHPDVILFDEPTSALDPEVVGDVLKVMKDLAKEGMTMVVVTHEMGFAKDVSDKVIFMADGVVVESGTPVEIFEQPQHERTQNFLARVL 3B5J Chain:A ((20-231)) -----------------ILDNINLSIKQGEVIGIVGRAGSGKSTLTKLIQRFYIPENGQVLIDGHDLAL--ADPNWLRRQVGVVLQD-NVLLNRSIIDNISLANPGMSVEKVIYAAKLAGAHDFISELREGYNTIVGEQGAG---------LSGGQRQRIAIARALVNNPKILIFDEATSALDYESEHVIMRNMHKICK-GRTVIIIAHRLSTVKN-ADRIIVMEKGKIVEQGKHKELLSEPE------------

General information: TITO was launched using: RESULT: Template: 3B5J.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output 3D Compatibility (PKB) -97613 for 1482 contacts (-65.9/contact) + 2D Compatibility (PS) -20699 + (NN) -1965 + (LL) 2832 1D Compatibility (HY) -18000 + (ID) 4000 Total energy: -139445.0 ( -94.09 by residue) QMean score : 0.471

(partial model without unconserved sides chains): PDB file : Tito_3B5J.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3B5J-query.scw PDB file : Tito_Scwrl_3B5J.pdb: