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



Input alignment information:
Query sequenceMTLNQFKSWPSKYPKSALEDTAPVRLRANSSTAASASPATAPATSTMPTSVLYSVLLRASVSRNAVSKNPAERSPHSHTVYDIDSTVREAVRAEVERLFPYRGAFAEPPGGADVDRATPAQRFFGLAPKAEEGERSGCRSACVARVNVYRHISEPDTHNPRAPVPSTTTAVAATETPSSSAARQTSTSVLQRLSGGPRVVIKSLKRKKTLAVMGATRVPAPSMPESAEAPKQLFAPLLAENSIGVGGVMRDQEASSCTSPSAVADNSHRFTVVSATELPDMQRHLERLFDDFAAAVEQCRAALDQQQLQSSSPAAWQTTKKKRGVASEEPSVSLLGEEASASQHPQQPPHCTNSNHRPGNSTVLSTDVLPRHNSHHPVSDFLSPDRIPDEWRHDHGTVATANGSCCTSYAQSASGESVRMADGSVPETTPSLEAEDFSTGIVMIAHTIAEHLHAILHPNITLAALEEEAAALRGQGHGGSSGAGGPAALNAVMATCRRSHTGAEGEDRKPMSPASFSSPSPLPDLRSSEGLQSPSGASSAPLGPRALRQLVHSLFWSRITAFLSSVSLKTPGKDCPMWLSTAAVEQREACSYVQLPFWIWLYAACGLATDVIRAQQEAQRDFTIPGQATGPRKTLTSSSATASAPPPPSLSQLLPTVETLARQLQRRQYERVDSTAGTLLTANTFLSFTGVQMTDKAVMKRLFPLQSGVIASDALGFATLSPHSAQCITHEASVATESSSGSLTTGAFDSAAVPTLISINTSSDRLISAEHTMSAFAGAGPNAIDRSSSSVEGAPISPSRRGQAATSVVLGDAGNTAAYATEEAPQVHSGSYSCPSTVELYLQWLESADAARLAACSSRSEAERFPDRADTEADAAGEVAASSPTSRPYRPGTIACMQPHVSSYAEDGQASNGDGNIARGNSSSGKDRSSSDSSFSYATVQRPSEPFRVAAVMPSAGLAPCLGRVEKELHQARSAVQFARKVGTLYATQDMKTLLQLLPAVAREEPVSPNANLVSARADGGAVESFGGAFPPRGGTDSTGTPAAPATPAEGVHSQYTWTGTPTTSNPMTGSLPPLVTPPQVAADRMPGNHALFFRRANASSTPPALFPSVTSPSLEKRLLMEHLDSCAAAIVSNSYELFVDSARALEVSFSLAVVLLSHVMGEAVPKGEVASVVQAAAVASSSDSSQSAISTKAGAVTTTMVVLKRLPAKVAAAALSEKSKGRVTTKTAAAPPPPRPLSMDLAKVFGFGRSRLWWQHLSAYVRETLISVALRALQRKDVAMTQELLQCITLDMTIAHHYDQVRRHHPVPKPARVKGVGDTKKVSGSTLKKSRSAFKAGGRKVTHLSAPPHESSASFVNVWLSSFAHLADTTTHLLHGDHNAPSSLKGAVWHLAGLAHYFLLTRARGYDMYGGQSHLCSTTLFGHGSGNSAGVGVRTSSVTSSAALQSFITSQLVEPAGKVLGVVVSFMESVCQALSADIESGGAAERHFREGVMFVDNSSDDESLFMCPAADDSVRLGSAAESTSLYSDGGGGDYDMASNRLETSGLQTCWMELAIHYFFEIVDVLLDAALHLPEKPLYLYQLTVSAFNTAAPSIDFADTLSAAVLAGGAGSPLLWGLGDLSSSVVATAPQVVADSPLDRVQEFLSTYTSMVLQSAVNHFTVDSRHAHSRVATARETPLNTSAAADGTSEDDWPRTFWERLLTSVAAPANPSALGEVILTARQPLPSASTPTSWPAANPAVSPEVSASSSYTRSTMWWPDVRFHRYSHLIRIVEHAQLVSLYLNSCAGSNPAQTAPLTSYLEVSRAPRDSAPSLQVSAVTSLLNTSTGPCAQLLSIPYACPPSAVDTSSSSIIPGSARTTSHERCWFHCTGSPADQSPPRFPAGAHRRVPADRAMREVCGGLWIRVELLRLLRLAAAPLDAETFVSFTKTASKVATQTRDRAMQTHYTAIASMKAGAESVLPKTYASTYVRLLFLRYVQAFYADVHALSASGPATGPDHTTSERVDGTSNATPLTRSVDQRAALATHADLSSHGDATPYRTLGPPQMRSQVSTLQHLSQRLWTHYCHELLWALRELCWSCAEAHETAANLSVASVFGRLLQMISGRGELEGDDVIDDYDDEPAEKFPDEPHLDLKDVGMSFITSERALEPYSTAEGVRMEGFVDFEVSSSDSSVTVVPGMSEGRKRPPGQPPNSGSSDDFERRLEPSRSARRSPVSKASVEVEQQVMVGISDQASVFDFKERRRLGSNDHFISGGTQATVRSTTPLAASNTPVPTPPRTPVTAPPVVQKLSFTGLKPPLYFTSSGDTAAAQENDFYKEQSKQPQMAKEPMVHFLSTTGMSVVDAASHQSQDDDNGECDVKYEARSDALESASKHTLPKSTSHEPRESYSTANANADSATRRDAPKPPALTIPKLSLGALSPPLYFTSTGDTAVFAERPISPSLARPPAQAFPTLNSLTAAAPAVVGAAHVDPAVRGAPLKGAAEAANASTLTPPPAPVLHTSTPTTVDGFALPKLSFGSLGPPMYFTSTGDTGGFIEAENQKPHAVAGATTSAQIPSDTIHLQFGLTAQGMASRGTANTATATAAAITASNCPTAATAAAHFHGSHSSDESHLRPVFSFADFAPTGGKVSRSGNASDEVGSYAGCVDEQDSKERRRCDSALSLNSLPMPESSPLSMLTGQRRRKRVPRTSRPVLTPIVAPAVTMELILCICSIILQQDSGMIQYAYTVSSLTQKRVLPDMSSSSQRRWHAGSGTAAAASGSTFTQKSDAAQTDRWRYTPQHSPSSFHVIQAMHNYLKDSRNSLVIDLLEEWVLDEYAEMERARMEQFESAYAPSMQQECSPQPPHPSYSHNESGGNIGNSVHHHSLHQPQAGGTGGGRSGKPSAAMLAGRYVLLRLLLPRAITPLITQQNERRIGAGGYGSVTSGFVQRPGTGGDTQLPPGWGQRGFRWRPAKTRGSTAASGSGAGVGGTTPQSLHMGRSVTTTAERIAPGVLDGLRAPWRTATQRIAQAVCKCEVAIKHIPLNVQGSESGNLPLCHAEVLCMYRLRGHPHIVPLLSFDNTKDEYILVLPHYTQGSLRLWRQKHYPLGCAVLTLSPGMKDSCKSGPMPTAAPATTSSTPTPAAAPSTSLFTTCARCLLQVLKGVAFMHDHRIRHGDIKCDNVLITATAASAARGEMDPPMLPSSVCLCDFGSCDTCDDDDIQNLKHDIMAGEARFLAGRWGVGRGTEAIQPPELMSAKRRYALLRRIATAVAPAAAATPATSSLLTLSERVERGSHAASFAGPSAEYLPLRSRGGELMESTGPQMTELLRRAELSVDIWACGCLLYEMLT-GRMLFGEARLGRLLVLAAVDDGEDQDPETAASKTSTAAGPLPGAPRSLQKATVPTTSSVGADTGSSFTPSVSKKALDDWERRDLEAAVGKRVVDFMSTLLDLDPLQRPSAHEALQHWKTIMVEAGLEI
2PSQ Chain:B ((113-368))------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------AVTVAVKMLKDDAT---EKDLSDLVSEMEMMKMIGKHKNIINLLGACTQDGPLYVIVEYASKGNLREYLRARRPPG--------------------E--------E--------QMTFKDLVSCTYQLARGMEYLASQKCIHRDLAARNVLVTENN---------------VMKIADFGLARDINNIDYY---------------KKTTNGRLPVKWMAPEALFDRV------------------------------------------------------------------------YTHQSDVWSFGVLMWEIFTLGGSPYPGIPVEELFKLLK--------------E---------------------------------------------GHRMDKPANCTNELYMMMRDCWHAVPSQRPTFKQLVEDLDRILTLTTN--


General information:
TITO was launched using:
RESULT:

Template: 2PSQ.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 : 1168 -131244 -112.37 -537.88
target 2D structure prediction score : 0.70
Monomeric hydrophicity matching model chain B : 0.53

3D Compatibility (PKB) : -112.37
2D Compatibility (Sec. Struct. Predict.) : 0.70
1D Compatibility (Hydrophobicity) : 0.53
QMean score : 0.437

(partial model without unconserved sides chains):
PDB file : Tito_2PSQ.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2PSQ-query.scw
PDB file : Tito_Scwrl_2PSQ.pdb: