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



Input alignment information:
Query sequenceMRKKLKWLSFLLGFIILLFLFKYQFSNNDSWKPWSLPLSGKIIYLDPGHGGPDGGAVGGK-LLEKDVTLEVAFRVRDYLQE-QGALVIMTRESDTDLAPEGTKGYSRRKAEDLRQRVKLINHSEAELYISIHLNAIPSQKWSGAQSFYYGKYAENEKVAKYIQD--------------ELRRNLENTTRKAKRIHGIYLMQNVTK---------------------------PGALIEVGFLSNPSEATLLGKPKYQDKVASSIYKGILRYFTEKGDPPE
3NE8 Chain:A ((7-225))------------------------------------------VVLDPGHGGIDGGARGVTGILEKDVTLAFARALRDELQKGSHTIVALTRDSDIFLR--------------LSERVKKAQEFDADLFISIHADTIDVHSLRGATVYTISDEA-SDAIAKSLAESENKVDLLDGLPKE---DILLDLTRRETHAFSINFANNVVSNLSKSHINLINNPHRYADFQVLKAPDVPSVLIEIGYLSNKEDEKLLNNPQWRKQMAASIAYSI-RQFAE------


General information:
TITO was launched using:
RESULT:

Template: 3NE8.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -72319 for 1298 contacts (-55.7/contact) +
2D Compatibility (PS) -18254 + (NN) -9343 + (LL) 3764
1D Compatibility (HY) -10800 + (ID) 3500
Total energy: -110452.0 ( -85.09 by residue)
QMean score : 0.520

(partial model without unconserved sides chains):
PDB file : Tito_3NE8.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3NE8-query.scw
PDB file : Tito_Scwrl_3NE8.pdb: