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


Input alignment information:
Query sequenceMPQDARLQPFSLVGIEATVRPEQRRWSAGKRSGTHGRPLERFFLFLFLAALALCSVCCSQASSAPFHPARHIVADEALSNAPSARSVALRYTFPGSSLALLVTEGGHLHAYDLERGQHAWCADAGGDMVTVTIDLPPSKEAALRDPLALPFLVRGNSLFTRVPFFTYTPLESMDATERLEGLPQSLRPYFFMNISTLLRRQTLFLGGTDVYVTTSVQVADLDASTGRPVGGLETPSQAFCGSNATRSPPRGDSTTESHRVPHNELLPLLHIVRYNIVLHVVRPGEYSWSICLSQLRMSPRAVVQPRFPSPFSAHSAADTSSAAPEDDSEHTPRFFSQFMRNMFDYDDEHVVNVAYRRAADQQANPTPAARTSTAVLMRNLQRTHTQAADYISRVVSVHQVNESHVSLRSVHDGTTAWTSALPHVAREPSGDGTGSTTSSSNATSTVIAAYVWVSGADEIFRVPVLRLAFGSVVEEAEQLRISMETDARGAVPTGLPRLTSASLAGALVPATHAAGRLQLWTLMQSGDSGRGRCRDGGACGEWATDDVEADEREETELAAYYHQCTWWETPPVSWPLLAGAFNGESGAVTFQAIDSATSSRTVAGTSGVYSTENPPLGFDSSGAVVKTGLAWRTAAFISFHVLCLAGSIAFLCAGVPPRGQLQRAWAQADRNRDRVSHTSSSHQPSTQLVPQDLLSPHGGRGTPFSLIMDSFSMDTLGLGTLPTASASMATVSLPHSDDSLQELMRHHQLGHLSRSPPRSPWVYPAPEQVRSLTYEESEKMLPVTATPATTTTTKGTATSSKAGFGMTPSTARQKAKTSETPVKRAAALPSSPADSAAADKAAASASNSSSDDDTVDIDLGERWWLRAQFLPRQHASAPALDETFSDRGSSYSRSQANTGTEEEGKLFQLHFKVLEKIGFGGEGSVFCVEHRVTHARYAIKVIHIHEKDEERVVQEAVLHSSFDNANVVRFYFCWIEDIAVSTANRLELCHRDEDGLDATSLAYSDNSLMVSTSGNTNGHSTDHDTASKAGDTYHMLFIQMEYFPRGTLADWLRLRSG--FFRLEVLRYMKQIGEGLAYLHNQDVVHHDLKPTNIFVSNDNVLKIGDFGLAKRRGNANGSAGDLASNVAGGQEERSVVGGSPLYSSPEQTRGEPVNKPSDIFSLGIIAVEMLCTFTTLHERIRILTDAHQLILPEELEAEFPDEAQLIKSMLAANPLQRPPIRKLLRQISKLIVALEAQESDEEAEKPPPPSPLDGAEHSESRNGNDEAATVALVDDSASALAAATATGKFGNTPLSTSVTAASSSCGRSVAADLASGSHVDSFPSPLGEQKSRVALLPVLHSEAATGISAAAASHMPATTSAHDSNAASTGKHVTRLGDSLASLHASTMVKRGNTYHHRRRGSASPNMEAEIGRLHICEMVATGSASRKEFFANDPYGLPNTPVMYTEDADLSTILKHDLQDRTVSAPD
2A1A Chain:B ((255-537))----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GAHTVDKRFGMDFKEIELIGSGGFGQVFKAKHRIDGKTYVIKRVKYNNEKAEREVKAL---AKLDHVNIVHYNGCW-------------------DGFDYDPETSS----RSKTK---------------------CLFIQMEFCDKGTLEQWIEKRRGEKLDKVLALELFEQITKGVDYIHSKKLINRDLKPSNIFLVDTKQVKIGDFGLVTSLKN-------------DGKRTRS--KGTLRYMSPEQISSQDYGKEVDLYALGLILAELLHVCDTAFETSKFFTDLRDGIISDIFDKK---EKTLLQKLLSKKPEDRPNTSEILRTLT------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 2A1A.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 : 1295 10655 8.23 40.36
target 2D structure prediction score : 0.75
Monomeric hydrophicity matching model chain B : 0.57

3D Compatibility (PKB) : 8.23
2D Compatibility (Sec. Struct. Predict.) : 0.75
1D Compatibility (Hydrophobicity) : 0.57
QMean score : 0.435

(partial model without unconserved sides chains):
PDB file : Tito_2A1A.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2A1A-query.scw
PDB file : Tito_Scwrl_2A1A.pdb: