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



Input alignment information:
Query sequenceMAHLDSDAITPHSPRSQPRILAGHIGEEKDAIDRDGMQPGGDVGNGAASILRRRWMYDGGRKIAPFLSARHTHQESKEKVEIGGDSSTVVVRPNVIAATPRENRSPLDRAITPPSPLQLLPKTILPASVVASTSLARQHGVRGNVRPVDEASTYNDEQANPEEHSSPSCSIIASSSSGGGDFSLEADNDAQLSNAPCHAPLGRRLTQLELPFPQVTLSSLLQSNQSTSADGVDTSAGSQDTRLSSKRSTASRRCYVPGRASRLHSNTLVSEGGGGMLSALFSNTSRATTQASEVTTRAPNESLHGLDTSYMRASLLSLSSETESASEGTSLTPVQQHDESITYRSSLPPPPPPPPVRTRTFTLAEATENAAHAAAKHSSTRLTPSALMTPPLMAVEPRSRLPSFRTRNPLMQPRQLSDGHLGEHAVAPSQLHDEDAPAAAGTPRSCYRGPRSALLRGCADRRQSASRTPPIAVLVPLPPKSEELAPAPAPASTPATASPPPTQPLDSDTYAVNANSLASEMSFRYRARPSPRAQQLDPASVLEPRASLCVSPLHPSLSQVYVLTPRPQPPRSTPARSSPPRSGDPTLLEYVASLKPPRGSCSIRRALLSVGVALCAVPLCVAILLFGLHYWAVTLQEKSYAEALLHARMGTMLKVDLELLLSILLSIVVVGGGSGTVIYVVLYRLAIRHQVRAFALCVRLADTLLPLDVHHLAAEDSEGRQDIAMPIDAAAAAAQQADNGDSRAQWFSPFVARWHEEVSRLVKLLTCPIEVSQAEWRSFLFSERRSLALPNEGTNGSGDLPVTETTLADGPFHNSNNRRSLPFGVQASVPMTENEPWPPHEAQPGSRYQMSEAVFSRRPQHPVDVSKRQEAVTVVVCRLMAPAELLVEQRPLTQAQLKELQRLSNEFHQRLRTVPRTSCAAVTEVGVSEVVFSFNTFSPLPSLVASPAAVALAVVAQKALVEWSPTYRGTPVQWGIAVHRFDAYICPTRGMQGRLYVSFGTVEYDFARQLAELAALFDYGALCHAGFLADASCESQCLPVDYVMDLRQQAFLVYQLHDGDVDREQRLQMNSAIASMRNGEYKAAADALGMWRRKSGGCSGLPRTAAHLRYVAGFLERAARKRRLRVSEATVEAVTAPSFTCAVEGVAEWAAESLLTSYFRPPPVWEEEEAPRAPSPDLLRAPAILATSGGGSCGLRKRECGSSNVLVPFSPQPSRGAAGELATFFRSLMRRSYQARTRYVLSAEQREGQVGSRAMGEPPHQPREVLAAIEGDARPPSSLQRCYGLPSPGTESVSGERNVLEDGSAPLSPRDNVTGCSSSFHATRSVFEASTPTTTFPDVTCGDRKWAALALLTEPDQSTVTVTASRPRLFSNSWSLAESGVPEMPTLTPLTSGVLRSSQSDVRRQRHASILISAAKKEDDAAGPVAACASAKDNATLRSSRGRRDSGGCRSERPRGRHGSQFTTEVPTSDELSSRLLGHQCVSQLTDTTIARFPSEVSHESLSARSGSVRRRASASTAAASSVLPLFADSMVPFTVQDRTEARSEAETACEADLNQELSMMSVAQRSRSRRSHRATAQPSSVVCSCTRRIDTSSSNTVMVFQGFH-PDGYLVVVKRADRRAAKQVAQLRNEVDLLRELHHRNVVNIVSAWKDDEAVYFAMEYACETLATVLQKFKVLLPGVVRFYAREVLNALVYLHRDCGIIHRDLSPNNVIITNTTDRSRVKLIDFGRSIMGPHFCSGSSGMSTTVPGNASLEFTEQHSSRNKVSVTDVPTSVVGTPLFMSPQACRGL-AHPTSDIWSLGIIVHLCLTGTYPYPPETFTDPETFVANIGSGRLTPVIADTCEMTGEARSFIEQCLTLSHTERPSAAALLKHGFVER
4XBR Chain:A ((101-349))------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------KIGEGSTGIVCIATVRSSGKLVAVKKMDLRKQQRRELLFNEVVIMRDYQHENVVEMYNSYLVGDELWVVMEFLEGGALTDIVTHTRMNEEQIAAVCLAVLQALSVLH-AQGVIHRDIKSDSILLTHD---GRVKLSDFGFCAQVSK--------------------E-----------VPRRKSLVGTPYWMAPELISRLPYGPEVDIWSLGIMVIEMVDGEPPYFNEPPL---KAMKMIRD-NLPPRLKNLHKVSPSLKGFLDRLLVRDPAQRATAAELLKHPFLAK


General information:
TITO was launched using:
RESULT:

Template: 4XBR.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 : 1222 -35586 -29.12 -144.07
target 2D structure prediction score : 0.65
Monomeric hydrophicity matching model chain A : 0.55

3D Compatibility (PKB) : -29.12
2D Compatibility (Sec. Struct. Predict.) : 0.65
1D Compatibility (Hydrophobicity) : 0.55
QMean score : 0.405

(partial model without unconserved sides chains):
PDB file : Tito_4XBR.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-4XBR-query.scw
PDB file : Tito_Scwrl_4XBR.pdb: