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



Input alignment information:
Query sequenceMAIDPNSIGAVTEPMLFEWTDRDTLLYAIGVGAGTGDLAFTTENSHGIDQQVLPTYAVICCPAFGAAAKVGTFNPAALLHGSQGIRLHAPLPAAGKLSVVTEVADIQDKGEGKNAIVVLRGRGCDPESGSLVAETLTTLVLRGQGGFGGARGERPAAPEFPDRHPDARIDMPTREDQALIYRLSGDRNPLHSDPWFATQLAGFPKPILHGLCTYGVAGRALVAELGGGVAANITSIAARFTKPVFPGETLSTVIWRTEPGRAVFRTEVAGSDGAEARVVLDDGAVEYVAG
3KHP Chain:D ((24-310))--IDPNSIGAVTEPMLFEWTDRDTLLYAIGVGAGTGDLAFTTENSHGIDQQVLPTYAVICCPAFGAAAKV-----AALLHGSQGIRLHAPLPAAGKLSVVTEVADIQDKGE---AIVVLRGRGCDPESGSLVAETLTTLVL----------GERPAAPEFPDRHPDARIDMPTREDQALIYRLSGDRNPLHSDPWFATQLAGFPKPILHGLCTYGVAGRALVAELGGGVAANITSIAARFTKPVFPGETLSTVIWRTEPGRAVFRTEVAGS--AEARVVLDDGAVEYVA-


General information:
TITO was launched using:
RESULT:

Template: 3KHP.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -155052 for 2256 contacts (-68.7/contact) +
2D Compatibility (PS) -28216 + (NN) -11037 + (LL) -728
1D Compatibility (HY) -34000 + (ID) 13350
Total energy: -242383.0 ( -107.44 by residue)
QMean score : 0.516

(partial model without unconserved sides chains):
PDB file : Tito_3KHP.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3KHP-query.scw
PDB file : Tito_Scwrl_3KHP.pdb: