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



Input alignment information:
Query sequenceMNPREHGKRSIDNETRSALKRQRPAVIWLTGLSGAGKSTIASALELALFEQKKHTFLLDGDDLRLGLCRNLGYSDEDRTENIRRIAEVAKILLEAGLIVIVATISPFSRDRRLSRELIGIEH------FIEVFVDTPLSECERRDPKGLYRKARSGKIENFTGIDSIYETPAQPNITIDTLSEDPDLAVKRIISYLETNQPA
2PEZ Chain:B ((5-174))-----------------------GCTVWLTGLSGAGKTTVSMALEEYLVCHGIPCYTLDGDNIRQGLNKNLGFSPEDREENVRRIAEVAKLFADAGLVCITSFISPYTQDRNNARQI----HEGASLPFFEVFVDAPLHVCEQRDVKGLY----------------EYEKPEAPELVLKTDSCDVNDCVQQVVELLQERDIV


General information:
TITO was launched using:
RESULT:

Template: 2PEZ.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -106535 for 1167 contacts (-91.3/contact) +
2D Compatibility (PS) -16176 + (NN) -8835 + (LL) 2132
1D Compatibility (HY) -12800 + (ID) 3750
Total energy: -145964.0 ( -125.08 by residue)
QMean score : 0.634

(partial model without unconserved sides chains):
PDB file : Tito_2PEZ.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2PEZ-query.scw
PDB file : Tito_Scwrl_2PEZ.pdb: