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


Input alignment information:
Query sequenceMSQNSVVAPLNTFSPKDLTAKKAEVDKWFREYTNGVVTVDRLETICRSLPVLGSAFAIGDIIIDIISMINKGGLDKVEIFDWLNLGIDVIGLVPMGPVGPSVRSAARPALFYVKNESEKIIKAQAKKLGKKTLTSQEVKKALSTGFKDSASVFLTTIIAENVAGTLENFAKKGQSLLNQILKEVGNWIVLLTKTIDDGFKKLVSGSLNGLPNLKRAGQQSLGVIKGIFELDGTRIVNNAKYATENVAKTVGKGYVNLANLAVSDEARAKVLALGAKIRSIGQVAQAKVNGLSDPNTLWTIGWLFSIMGMVAAKHRQKRAQIKAKETTKANASHPSTATDKSNKQAHAENNANQCKNCMGGTGGSITFAMGTEFFTHVDVQLGGIIQDSISRTYVSNLYQMDDAIFGARWVTPFTTKISRKFKYTSKKKDHKDYLNGLEYIGLDGRAIDLPDLKKGQSIYDPIEQYTYTVLSDQLHLIAYGEDEKRYYEKYGEDYRLSYIERKNGFKVALRYDHVSIDNKTILSDILFKQDDNLLAHLALQLTPQGLVSDIWTIKNGQLDRVLASYDYDQQGDLVQATNEFAASYYYQYTHHLITRYTDLTHRGMNLKWDGILPTSKAIEEWADNASRASKLEWDKNIRKTTVLDVEGNSTEHYYDIDGYTYRIVYPDNFEEWFFRDDAKNITLHIAKDGSKTSYTYDERGNVLTTTQDDGAT-SYFEYDEKNQLTGIVDAEQGRWFKQYD---GSGNLIKEIDPLKH-----ETAYVYNAMGLVTSITDAKGGSKSLKYDDQGNLISYTDCSGKETKWQYDERGRVISIENALNQK---VEYFYTELTLENREPIIKGLPLNAFGQLEKIKHADGT----EEHFIHDAEGRLLSHVDPKQNITRYEYDEAGLILSRTDALN------HKLKYKWDRLGRLTRLINENGASYQFFYDVA-SRLVKEIDFDG----------KETVYHYDEKSGQLATSIEVASAYGQDLKDRAAPKDRIQQFIFDNMGRLEQRTAGYGHYGLELEEKQTEEFAYDYMGRIIQAKNAQSNLQWFYDAAGNLVQEHQQDYKINKTAVWKHQYDEINDRIKTTRPDGQVIDWLTYGSGHVQSLIVNGQDLVSFERDDLHREIARHYANGVSQEQQYDLAGRLKSQMMLSEHENGYQNQYKRHNNALEQTSQLVQRLYQYDKTGELTAIRDTRRGNIAYKYDPIGRLLEASSKLGKETFSFDPASNIIDSYHSHKAQSYSQTTEEKDYGYNRLVNNVVKEYLDQQYQYDAYGQLVRQKTSQGDLNLEWDVYGRMVKP
4IGL Chain:B ((40-368))-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------CITYHQFDFRGFLAQSLDPRLNH-----KEVTNFSYLTDLNGNIIYTQSVDAGNTLVLNDTEGRSVIAMTNISR-ENGKDDLSLAVTRTFQYENAPLPGRPLSVTEQVNGENARITEHFVYAGNTP-----------QEKNLNLAGQCVSYYDAAGLIQTDSVSLTGKPLSVSRKLLKNLDDTNILADW-----------------QGNDTSAWNSLLATEIYTTVTRTDAAGAVLTTIDAVGNQQRVAFDIAGQLSASWLTLKGGQEQVIIKVLTYSAAGQKLREEGGNGVVTTYTYEAETQRLIGIKTERPNGHAAGAKVLQDLRYEYDPV-GNVLSITND----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 4IGL.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 : 1046 47618 45.52 173.15
target 2D structure prediction score : 0.52
Monomeric hydrophicity matching model chain B : 0.55

3D Compatibility (PKB) : 45.52
2D Compatibility (Sec. Struct. Predict.) : 0.52
1D Compatibility (Hydrophobicity) : 0.55
QMean score : 0.302

(partial model without unconserved sides chains):
PDB file : Tito_4IGL.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-4IGL-query.scw
PDB file : Tito_Scwrl_4IGL.pdb: