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



Input alignment information:
Query sequenceMHYSRLKLTVQTPLKLKDLTYKFVVTNNSTKKKTEFEGRFDDQGLTGWTEIYNLNTSLIYEVYLRGEILQKIAVKAYPNKKTHSVFTIKVTSEITKNVKENIKEIYLNDGEVAWYLIKKTETMLDWSKRVFKKPLNVSDWDTLKANNPHIPNMAPIRLLSPGMVVVLSNSTTAKELPRYKKEAQEAQKRLEEMKKDKDFDAEFFAQNYEFFYDALNDSRTEITNENIFTNNDHPLIYQLDGSENESGVAWGSIGKGGIDATLAFHEGTVTRMNQIHGELALKMAEERAKGSGLANPKNFKAFRQKYKDLYKALDHEYSKGVFKWDRSIKTNNMRRIINQSSLARGVTYKGGMKEYVEKMGELGKMSKVIKGGGYLFLALDIYNASDAIANAKPEEKAKTAVVETSKIAGGLAGGAVGAFIVLTVATGGTSLIVLGVAAGASALVGWAGGEVGGYLGKEGYELISK
3HE4 Chain:B ((1-44))--------------------------------------------------------------------------------------------------------------------------------------------------------------------------NTVKELKNYIQELEERNAELKNLKEHLKFAKAELEFELAAHKFE-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 3HE4.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 6 299 49.75 6.78
target 2D structure prediction score : 0.80
Monomeric hydrophicity matching model chain B : 0.52

3D Compatibility (PKB) : 49.75
2D Compatibility (Sec. Struct. Predict.) : 0.80
1D Compatibility (Hydrophobicity) : 0.52
QMean score : 0.537

(partial model without unconserved sides chains):
PDB file : Tito_3HE4.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3HE4-query.scw
PDB file : Tito_Scwrl_3HE4.pdb: