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



Input alignment information:
Query sequenceMQSKRGRPRDEGTHKAILSAAYDLLLEKGFDAVTVDKIAERAKVSKATIYKWWSNKAAVIMDSFLSTATDRLPVPDTGSSVQDIVTHATNLARFLTSREGTVIKELIGAGQLDEKLAEEYRTRFFQPRRLQAKGLLEKGIQKGELRENLDIEVSIDLIYGPIFYRLLITGDEVNDSYVRDLVMNAFKGVQATSATESM
4DW6 Chain:A ((44-96))-----------DRELAILATAENLLEDRPLADISVDDLAKGAGISRPTFYFYFPSKEAVLL-----------------------------------------------------------------------------------------------------------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 4DW6.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 : 158 -30625 -193.83 -612.50
target 2D structure prediction score : 0.68
Monomeric hydrophicity matching model chain A : 0.61

3D Compatibility (PKB) : -193.83
2D Compatibility (Sec. Struct. Predict.) : 0.68
1D Compatibility (Hydrophobicity) : 0.61
QMean score : 0.787

(partial model without unconserved sides chains):
PDB file : Tito_4DW6.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-4DW6-query.scw
PDB file : Tito_Scwrl_4DW6.pdb: