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



Input alignment information:
Query sequenceWFHGKLGAGRDGRHIAERLLTEYCIETGAPDGSFLVRESETFVGDYTLSFWRNGKVQHYRIHSRQDAGTPKFFLTDNLVFDSLYDLITHY
1AYA Chain:B ((4-79))WFHPNITGVE-----AENLLL-----TRGVDGSFLARPSKSNPGDFTLSVRRNGAVTHIKIQNTGDY----YDLYGGEKFATLAELVQYY


General information:
TITO was launched using:
RESULT:

Template: 1AYA.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 : 310 -45097 -145.47 -593.38
target 2D structure prediction score : 0.68
Monomeric hydrophicity matching model chain B : 0.77

3D Compatibility (PKB) : -145.47
2D Compatibility (Sec. Struct. Predict.) : 0.68
1D Compatibility (Hydrophobicity) : 0.77
QMean score : 0.734

(partial model without unconserved sides chains):
PDB file : Tito_1AYA.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-1AYA-query.scw
PDB file : Tito_Scwrl_1AYA.pdb: