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



Input alignment information:
Query sequenceMKAGVAQQRSLLELAKLDAELTRIAHRATHLPQRAAYQQVQAEHNAANDRMAALRIAAEDLDGQVSRFESEIDAVRKRGDRDRSLLTSGATDAKQLADLQHELDSLQRRQASLEDALLEVLERREELQAQQTAESRALQALRADLAAAQQALDEALAEIDQARHQHSSQRDMLTATLDPELAGLYERQRAG-GGPGAGRLQGHRCGACRIEIGRGELAQISAAAEDEVVRCPECGAILLRLEGFEE
3NA7 Chain:A ((1-237))-LGSNTHLKQLIEISHLDKEIDSLEPLIREKRKDLD--KALNDKEAKNKAILNLEEEKLALKLQVSKNEQTLQDTNAKIASIQKKMSEIKSE-RELRSLNIEEDIAKERSNQANREIENLQNEIKRKSEKQEDLKKEMLELEKLALELESLVENEVKNIKETQQIIFKKKEDLVEKTEPKIYSFYERIRRWAKNTSIVTIKKQACGGCFIRLNDKIYTEVLTS--GDMITCPYCGRILYAEGA---


General information:
TITO was launched using:
RESULT:

Template: 3NA7.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -24657 for 1512 contacts (-16.3/contact) +
2D Compatibility (PS) -27808 + (NN) -24040 + (LL) 1152
1D Compatibility (HY) -8800 + (ID) 1850
Total energy: -86003.0 ( -56.88 by residue)
QMean score : 0.666

(partial model without unconserved sides chains):
PDB file : Tito_3NA7.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3NA7-query.scw
PDB file : Tito_Scwrl_3NA7.pdb: