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



Input alignment information:
Query sequenceMLPDKIIYEGKAKFIIETKDPLTVIQYFKDEVTAFNKEKYKIIEGKGTINNRISTFIMETLEKAGINTHFIKTLSEREQLVKKLKIIPLEIVVRNIAAGSFCKRFNIKEGEKLAFPIIEFFYKNDGLADPMVNENHVLYFGWLSYEEMEEIKTITIKINTVLIDLFLNAGIDLVDLKLEFGRPINDNTKITLADEISPDNCRLWDKNTHKKLDKDVFRLNLGNLKEAYLEVAKRLSVKLC
3NUA Chain:A ((5-237))VNQLEMLYEGKAKKIYATDKEDMVIVHYKDDATAFNGEKKAQIESKGVLNNEITSLIFEMLNKEGIKTHFVEKLNDRDQLCKKVEIVPLEVIVRNVAAGSMAKRLGLEEGYELKTTVFELSYKDDSLGDPLINDYHAVGIGATTFEELNKIYEITAKVNEILKEAFKKQNINLIDFKLEFGRYN---GEILLADEISPDTCRFWDATTGEKMDKDRFRRDMGNVINGYREVLNRLRN---


General information:
TITO was launched using:
RESULT:

Template: 3NUA.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -97767 for 1828 contacts (-53.5/contact) +
2D Compatibility (PS) -24712 + (NN) -3911 + (LL) 196
1D Compatibility (HY) -19600 + (ID) 5550
Total energy: -151344.0 ( -82.79 by residue)
QMean score : 0.313

(partial model without unconserved sides chains):
PDB file : Tito_3NUA.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3NUA-query.scw
PDB file : Tito_Scwrl_3NUA.pdb: