Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)



Input alignment information:
Query sequenceMKAINIALDGPAAAGKSTIAKRVASELSMIYVDTGAMYRALTYKYLK----LNKTEDFAKLVDQTTLDLTYKADKGQCVILDNEDVTDFLRNNDVTQHVSYVASKEPVRSFAVKKQKELAAEKG-IVMDGRDIGTVVLPDADLKVYMIASVEERAERRYKDNQLRGIESNFEDLKRDIEARDQYDMNREISPLRKADDAVTLDTTGKSIEEVTDEILAMVSQIK
4DIE Chain:C ((7-220))-----VAVDGPSGTGKSSVAKELARQLGASYLDTGAMYRIVTLWVLRAGVDLTDPAAIAAATDQVPMSVSSDPDA-QTALLAGEDVSVPIRGNEVTGAVSAVSAVPAVRERLVRQQRELAESSGAVVVEGRDIGTVVLPDADVKIYLTASAQARAQRRNAQNVS-------EKVLADVQRRDHLDSTRAVSPLRPAEDALEVDTSDMTQEQVVAHLLDLV----


General information:
TITO was launched using:
RESULT:

Template: 4DIE.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -88313 for 1580 contacts (-55.9/contact) +
2D Compatibility (PS) -21851 + (NN) -8311 + (LL) 988
1D Compatibility (HY) -13600 + (ID) 4400
Total energy: -135487.0 ( -85.75 by residue)
QMean score : 0.555

(partial model without unconserved sides chains):
PDB file : Tito_4DIE.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-4DIE-query.scw
PDB file : Tito_Scwrl_4DIE.pdb: