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



Input alignment information:
Query sequenceMLINPIELLKEKVSSTILNNQDGYLGEKTNALSKFYPILLSLLAAKPDLIGQLKNSLAHSLSDLFSHNEQIKNTVLTHLSGTAPNNEIENTLNSALKPSLNAISDVAGNDQQSIVNYLRQHAETIRSYLPGWAVGLLAPLGIGAGLSSVTSSTAPPLAAATETTGKSRGFLPIIALIILGLLIAWLWRSCQHKEATPAPETKAASGVEAAAAPATLTLSTDDKGAVSQCQAGIGDQGFLATLQTQVKQVFSATKDCDVDTSQTYAAAFTDKDALAGVLGALKGIPNASLEWVGDKITLKAGDAAALEALTAKVKALVPHTEVVATAPETAEQSVSNSLSASQTALTAIDPNNVDENALVKALNLQIINFASGSSDIPADNKAILDQAATLLNKVSGVKLDVGGHTDSTGNAAANKALSQRRAQAVVDYLVSKGVDASKLVAKGHGSEQPVADNTTEEGRFKNRRIEFSVAQ
2W8B Chain:C ((7-105))-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------IVYFDLDKYDIRSDFAQMLDAHANFLRS--SYKVTVEGHADERGTPEYNISLGERRANAVKMYLQGKGVSADQISIVSYGKEKPAVLGHDEAAYSKNRR-------


General information:
TITO was launched using:
RESULT:

Template: 2W8B.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 375 -10033 -26.75 -103.43
target 2D structure prediction score : 0.61
Monomeric hydrophicity matching model chain C : 0.54

3D Compatibility (PKB) : -26.75
2D Compatibility (Sec. Struct. Predict.) : 0.61
1D Compatibility (Hydrophobicity) : 0.54
QMean score : 0.549

(partial model without unconserved sides chains):
PDB file : Tito_2W8B.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2W8B-query.scw
PDB file : Tito_Scwrl_2W8B.pdb: