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


Input alignment information:
Query sequenceMVSPHGRSTFAASILTTGTQLTTGNGTASTGGSAGLGANHNGACAFTPSSLSQDGNGGQSRAPRLASHLFLEDGSIPDISLPPATLQSPAVPDGQQHFGCSGGGGHVSVTALDQSRTPLCSAERRASLYDESSALAAVSLPADASRPTAANFVKGELIGKGSYGAVYRGMQRNNNRIIAMKEIRLPGVVEQQLRQPEKLAATAASPAGVSSCPVLPASNSVKGESALAKEVAAIKRELTLLKQLNHPNIVRYLNDEVVDGTLRIYMDYVSGGSVTAALKSYGSFEEPQAAALCFQLLQGLAYMHRRGIIHRDLKGDNLLLETSSQLKIADLGTARSICSSTTMTTNIVGTAYFMAPEVLQPNGAAAGTAADIWSVACCVIEMMTGKPPLSDLPNQFTVMMAIGGSATVPLDKYIPADNTWSSEVLDFVSQCLRANPAQRPTAVELLQHSWFAKFLNVVHVPSMSTPATLNSFLTPPAPPIERPFTLSPQRQMVSPICSPNLTAVLTPGYAGPQYSAGQPESRSSSRTSSRTSRERKGKRDKRVSARRHTRYSTSGATSATSRRSQESSQASTPQYSSSTRTRDGSAQSASLPRSHSHPGRQQGPTSKRRAHAHTPGHGLLKDDSRQSSSSEYAMPHHTCTPGSGSAGAGGGGDGSGDNKTKTVFLPAITHNGSVALSPCGYSLDMLRCSRSLKNSGSSREPVKACLHTTDAENKSRDLLHLGQCLSDHHQSFSRDLVDSSMQHGGVTKAGVESGLSTRGAGSHSMIDDLEGMGQRTLPPSISALPSTSCKNTRASEGAS
4XBR Chain:A ((93-350))----------------------------------------------------------------------------------------------------------------------------------------------------RSYLDNFIKIGEGSTGIVCIATVRSSGKLVAVKKMDLRKQ----------------------------------------QRRELLFNEVVIMRDYQHENVVEMYNSYLVGDELWVVMEFLEGGALTDIVTHT-RMNEEQIAAVCLAVLQALSVLHAQGVIHRDIKSDSILLTHDGRVKLSDFGFCAQVSKEVPRRKSLVGTPYWMAPELISR--LPYGPEVDIWSLGIMVIEMVDGEPPYFNEPPLKA-MKMIRDNLPP----RLKNLHKVSPSLKGFLDRLLVRDPAQRATAAELLKHPFLAKA---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------


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 : 1302 -157057 -120.63 -608.75
target 2D structure prediction score : 0.67
Monomeric hydrophicity matching model chain A : 0.63

3D Compatibility (PKB) : -120.63
2D Compatibility (Sec. Struct. Predict.) : 0.67
1D Compatibility (Hydrophobicity) : 0.63
QMean score : 0.498

(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: