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


Input alignment information:
Query sequenceMGKVKRNAPCPCGSGKKYKKCCGSKVVDFPAELAAKEAKQIQEDLVEYAFTVHRESISGFINQHDFLSAMDRQTKDISVFNLGIWGIFFHPLAGEKTIFEEYLQKKGDSITRPKTREIVESWQSMTPALLLLKDLKEGIIHFEDVITAKQFEVEMDASNQDLPPVGSLILGYPIHEAEKAEFFMQFTIFPVKRTEALISKVKKYADAAVKDGKTPEDFMKQEFNNVLFALLAEKDEEPQAEKAEVSTVEWANDLEKETAAAIEEGMSGEEYPTELIPAVIDIWKTFCEKKSPVIRKPEAFAAAVEYYVNAISLNGASVSQ---------AKLAKKYGVSASTISSRYKEIESTLQDEADRFAQALSS
2W96 Chain:A ((181-264))-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------HAQTFVALCATDVKFISNPPSMVAAGSVVAAVQGL--NLRSPNNFLSYYRLTRFLSRVIKCDPDCLRACQEQIEALLESSLRQAQQ----


General information:
TITO was launched using:
RESULT:

Template: 2W96.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 : 245 -31136 -127.09 -415.15
target 2D structure prediction score : 0.73
Monomeric hydrophicity matching model chain A : 0.55

3D Compatibility (PKB) : -127.09
2D Compatibility (Sec. Struct. Predict.) : 0.73
1D Compatibility (Hydrophobicity) : 0.55
QMean score : 0.443

(partial model without unconserved sides chains):
PDB file : Tito_2W96.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2W96-query.scw
PDB file : Tito_Scwrl_2W96.pdb: