Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAKRLDLTDVNIYYGSFHAVADVSLAILPRSVTAFIGPSGCGKTTVLRTLNRMHEVIPGARVEGAVLLDDQDIYAPGIDPVGVRRAIGMVFQRPNPFPAMSIRNNVVAGLKLQGVRNRKVLDD----TAESSLRGANLWDEVKDRLDKPGGG----------LSGGQQQRLCIARAIAVQPDVLLMDEPCSSLDPISTMAIEDLISELKQQYTIVIVTHNMQQAARVSDQTAFFNLEAVGKPGRLVEIASTEKIFSNPNQKATEDYISGRFG 4AYT Chain:A ((362-567)) ---------------------DFSLSIPSGSVTALVGPSGSGKSTVLSLLLRLYD--PAS---GTISLDGHDIRQ--LNPVWLRSKIGTVSQEPILF-SCSIAENIAYGA-----------DDPSSVTAEEIQRVAEVANAVAFIRNFPQGFNTVVGEKGVLLSGGQKQRIAIARALLKNPKILLLDEATSALDAENEYLVQEALDRLMDGRTVLVIAHRLSTIKNA-------NMVAVLDQGKITEYGKHEE-------------------

General information: TITO was launched using: RESULT: Template: 4AYT.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output 3D Compatibility (PKB) -78109 for 1431 contacts (-54.6/contact) + 2D Compatibility (PS) -20799 + (NN) -7225 + (LL) 4044 1D Compatibility (HY) -10800 + (ID) 3800 Total energy: -116689.0 ( -81.54 by residue) QMean score : 0.395

(partial model without unconserved sides chains): PDB file : Tito_4AYT.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4AYT-query.scw PDB file : Tito_Scwrl_4AYT.pdb: