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



Input alignment information:
Query sequenceMAETHTAIVFFAGDRAYKVKKAVDLGFVDYTDRQARRAACVREVALNRRFAPDVYLGVGEVVAPDAEVSEPLVVMRRMPAGRRLSALVRAGADVDEVLRAVARRLAAWHATAPRGRDVDEQGTRDALASRWEASFEQVRATTEGGSGFDGVPEVQRLVRRYLAGREALFDSRIEQRRVVDGHGDLLAEDIFCLDDGPRVLDCLEFDDHLRYVDGLDDAAFLAMDLEQLGAPAAAARFLARYGEYSGDPAPPSLWHHYVAYRAFVRAKVSLIQAEQGAPGVRSAARRLVSTTLRHLRTSAVGLTLVGGLPGSGKSTLSGALADRLGVTLLSSDRLRKELAGIPPESPAPAAYEEGLYTPEWTARTYDILLDRAAALLSRG-ESVVLDATWSAAELRAAAGRVAERTCADLVALHCQVPDEVAAARLSTRSPGPSDADLGVADALAAREPPW----PDAVVVDTSGPLESAVSRALAAVRPWGTDQAPVFRRPSAEPDQDRGAGSSLP
1KNQ Chain:A ((5-173))--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------NHDHHIYVLMGVSGSGKSAVASEVAHQLHAAFLDGDFLHPRRNIEKMAS-------GEPLNDDDRKPWLQALNDAAFAMQRTNKVSLIVCSAL-KKHYRDLLR----EGNPNLSFIYLKGDFDVIESRLKARKGHF--FKTQMLVTQFETLQEPGADETDVLVVDIDQPLEGVVASTIEVIKK---------------------------


General information:
TITO was launched using:
RESULT:

Template: 1KNQ.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 : 763 -27661 -36.25 -168.66
target 2D structure prediction score : 0.71
Monomeric hydrophicity matching model chain A : 0.59

3D Compatibility (PKB) : -36.25
2D Compatibility (Sec. Struct. Predict.) : 0.71
1D Compatibility (Hydrophobicity) : 0.59
QMean score : 0.174

(partial model without unconserved sides chains):
PDB file : Tito_1KNQ.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-1knq-query.scw
PDB file : Tito_Scwrl_1KNQ.pdb: