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



Input alignment information:
Query sequenceMAQSHSSSINYFGSANKVVYEGKDSTNPLAFKYYNPQEVIGGKTLKEHLRFSIAYWHTFTADGTDVFGAATMQRPWDHYKGMDLAKMRVEAAFEMFEKLDAPFFAFHDRDIAPEGSTLKETNQNLDMIMGMIKDYMRNSGVKLLWNTANMFTNPRFVHGAATSCNADVFAYAAAQVKKGLETAKELGAENYVFWGGREGYETLLNTDLKFELDNLARFMHMAVDYAKEIGYTGQFLIEPKPKEPTTHQYDTDAATTIAFLKQYGLDNHFKLNLEANHATLAGHTFEHELRMARVHGLLGSVDANQGHPLLGWDTD-EFPTDLYSTTLAMYEILQNGGLGSGGLNFDAKVRRSSFEPDDLIYAHIAGMDAFARGLKVAHKLIEDRVFEDVIQHRYRSFTEGIGLEIIEGRANFHTLEQYALNHKSIKNESGRQEKLKAILNQYILEV
1DIE Chain:A ((10-277))--------------------------------------------------FTFGLW-TVGWTGADPFGVATR-------KNLD----PVEAVHKLAE-LGAYGITFHDNDLIPFDATEAEREK----ILGDFNQALKDTGLKVPMVTTNLFSHPVFKDGGFTSNDRSIRRFALAKVLHNIDLAAEMGAETFVMWGGREGSEYDGSKDLAAALDRMREGVDTAAGYIKDKGYNLRIALEPKPNEPRGDIFLPTVGHGLAFIEQLEHGDIVGLNPETGHEQMAGLNFTHGIAQALWAEKLFHIDLN-GQRGIKYDQDLVFGHGDLTSAFFTVDLLENG--------------------------------------------------------------------------------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 1DIE.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 1295 -96489 -74.51 -361.38
target 2D structure prediction score : 0.73
Monomeric hydrophicity matching model chain A : 0.68

3D Compatibility (PKB) : -74.51
2D Compatibility (Sec. Struct. Predict.) : 0.73
1D Compatibility (Hydrophobicity) : 0.68
QMean score : 0.443

(partial model without unconserved sides chains):
PDB file : Tito_1DIE.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-1DIE-query.scw
PDB file : Tito_Scwrl_1DIE.pdb: