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



Input alignment information:
Query sequenceMMTKINYQPWLQAVLTIAKHYRIEPSEERIRLQLDWNQNQNLDDVLQLMTRQIGLNLRKVPFSLDLLNPWRLPVMVEFNDGQVGVIDKADTQGNVSIQFSGDHGLSQNLSLDVLKTTIKNVYILRPETSIPDARIDEYIKPYEASWFWSIVLRDWKRYVDIMFASLIANVLALATIIFSMQVYDRVVPSQSIPTLWVLAGGVLIAALFEFTLRVSRVYLSDIIGKRADLRVSDRVFGHALRIKNKDRSKSTGSFISQIRELEGVRELVTSTTISAIADFPFFFLFLIIFAIIGGKLFWVMLLVVPLMLLPGILVQKKLAQLAQEGMRESSIRNAILVEAVQGIEDIKLLRAESRFQNQWNHMNEVSADIGMKQRKIVGTLMAWTQKIQGLTYAIVVLVGCFAVMDGEITTGALVACSILSSRMLAPIAQITGVLGRLQQAKVAKQSLDELMQRPIDQADRSHLVHKAVLNGDYELKNVLFQYGEEDPKPSLAIRHLKIRAGEKIAILGRNGAGKSTLLQLLSGMQVPTQGAVHLDGLDLSLIDPSDVRRDMGLLNQNAHLFYGTIRENLTLGAPLATDEEILRALVVTGALPFVQEKKEGLDHLILEGGVGFSGGQKQALLLARLLIRQPNILLLDEPTAAIDDVAEKQLIDHLKGWLAHRTLVVATHRRAVLELVDRIIVVNEGKIVMDGPRDQVLNQSTAQQKQVSQGGNS
3QF4 Chain:B ((182-579))----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------VTLSIVPLTVLITQIVSSQTRKYFYENQRVLGQLNGIIEEDISGLTVIKLFTREEKEMEKFDRVNESLRKVGTKAQIFSGVLPPLMNMVNNLGFALISGFGGWLALKDIITVGTIATFIGYSRQFTRPLNELSNQFNMIQMALASAERIFEILDLE-EEKDDPDAVELREVRGEIEFKNVWFSYDKK--KPVLKDITFHIKPGQKVALVGPTGSGKTTIVNLLMRFYDVDRGQILVDGIDIRKIKRSSLRSSIGIVLQDTILFSTTVKENLKYGNPGATDEEIKEAAKLTHSDHFIKHLPEGYETVLTDNGEDLSQGQRQLLAITRAFLANPKILILDEATSNVDTKTEKSIQAAMWKLMEGKTSIIIAHRLNTIKNADLIIVLRDGEIVEMGKHDELIQK--------------


General information:
TITO was launched using:
RESULT:

Template: 3QF4.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 : 1501 -188814 -125.79 -474.41
target 2D structure prediction score : 0.70
Monomeric hydrophicity matching model chain B : 0.63

3D Compatibility (PKB) : -125.79
2D Compatibility (Sec. Struct. Predict.) : 0.70
1D Compatibility (Hydrophobicity) : 0.63
QMean score : 0.445

(partial model without unconserved sides chains):
PDB file : Tito_3QF4.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3QF4-query.scw
PDB file : Tito_Scwrl_3QF4.pdb: