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



Input alignment information:
Query sequenceMGGVLTLDAAFLGSVPADLGKALLERARADCGPVLHRAIESMREPLATMAGYHLGWWNADRSTAAGSSGKYFRAALVYAAAAACGGDVGDATPVSAAVELVHNFTLLHDDVMDGDATRRGRPTVWSVWGVGVAILLGDALHATAVRILTGLTDECVAVRAIRRLQMSCLDLCIGQFEDCLLEGQPEVTVDDYLRMAAGKTAALTGCCCALGALVANADDATIAALERFGHELGLAFQCVDDLIGIWGDPGVTGKPVGNDLARRKATLPVVAALNSRSEA-ATELAALYQAPAAMTASDVERATALVKVAGGGHVAQRCADERIQAAIAAL---PDAVRSPDLIALSQLICRREC
3AQB Chain:B ((5-325))------------------SYKAFLNPYIIEVEKRLYECIQSDSETINKAAHHILS-----------SGGKRVRPMFVLLSGFLNDTQKDDLIRTAVSLELVHMASLVHDDYIDNSDMRRGNTSVHIAFDKDTAIRTGHFLLARALQNIATINN----SKFHQIFSKTILEVCFGEFDQMADRFNYPVSFTAYLRRINRKTAILIEASCHLGALSSQLDEQSTYHIKQFGHCIGMSYQIIDDILDYTSDEATLGKPVGSDIRNGHITYPLMAAIANLKEQDDDKLEAVVKHLTSTSDDEVYQYIVSQVKQYGIEPAELLSRKYGDKAKYHLSQLQDSNIKDYLEEIHEKMLKRVY


General information:
TITO was launched using:
RESULT:

Template: 3AQB.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -182348 for 2613 contacts (-69.8/contact) +
2D Compatibility (PS) -34222 + (NN) -20557 + (LL) 1936
1D Compatibility (HY) -11600 + (ID) 4050
Total energy: -250841.0 ( -96.00 by residue)
QMean score : 0.486

(partial model without unconserved sides chains):
PDB file : Tito_3AQB.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3AQB-query.scw
PDB file : Tito_Scwrl_3AQB.pdb: