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



Input alignment information:
Query sequenceMVSPHGRSTFAASILTTGTQLTTGNGTASTGGSAGLGANHNGACAFTPSSLSQDGNGGQSRAPRLASHLFLEDGSIPDISLPPATLQSPAVPDGQQHFGCSGGGGHVSVTALDQSRTPLCSAERRASLYDESSALAAVSLPADASRPTAANFVKGELIGKGSYGAVYRGMQRNNNRIIAMKEIRLPGVVEQQLRQPEKLAATAASPAGVSSCPVLPASNSVKGESALAKEVAAIKRELTLLKQLNHPNIVRYLNDEVVDGTLRIYMDYVSGGSVTAALKSYGSFEEPQAAALCFQLLQGLAYMHRRGIIHRDLKGDNLLLETSSQLKIADLGTARSICSSTTMTTNIVGTAYFMAPEVLQPNGAAAGTAADIWSVACCVIEMMTGKPPLSDL-PNQFTVMMAIGGSATVPLDKYIPADNTWSSEVLDFVSQCLRANPAQRPTAVELLQHSWFAKFLNVVHVPSMSTPATLNSFLTPPAPPIERPFTLSPQRQMVSPICSPNLTAVLTPGYAGPQYSAGQPESRSSSRTSSRTSRERKGKRDKRVSARRHTRYSTSGATSATSRRSQESSQASTPQYSSSTRTRDGSAQSASLPRSHSHPGRQQGPTSKRRAHAHTPGHGLLKDDSRQSSSSEYAMPHHTCTPGSGSAGAGGGGDGSGDNKTKTVFLPAITHNGSVALSPCGYSLDMLRCSRSLKNSGSSREPVKACLHTTDAENKSRDLLHLGQCLSDHHQSFSRDLVDSSMQHGGVTKAGVESGLSTRGAGSHSMIDDLEGMGQRTLPPSISALPSTSCKNTRASEGAS
4QMU Chain:A ((31-283))-------------------------------------------------------------------------------------------------------------------------------------------------------FTKLEKIGKGSFGEVFKGIDNRTQKVVAIKIIDL---------------------------------------EEAEDEIEDIQQEITVLSQCDSPYVTKYYGSYLKDTKLWIIMEYLGGGSALDLLEP-GPLDETQIATILREILKGLDYLHSEKKIHRDIKAANVLLSEHGEVKLADFGVAGQLTDTQIKRNTFVGTPFWMAPEVIK--QSAYDSKADIWSLGITAIELARGEPPHSELHPMKVLFLIPKNNPPTL--------EGNYSKPLKEFVEACLNKEPSFRPTAKELLKHKFILR----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 4QMU.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 : 1319 -99313 -75.29 -394.10
target 2D structure prediction score : 0.66
Monomeric hydrophicity matching model chain A : 0.64

3D Compatibility (PKB) : -75.29
2D Compatibility (Sec. Struct. Predict.) : 0.66
1D Compatibility (Hydrophobicity) : 0.64
QMean score : 0.456

(partial model without unconserved sides chains):
PDB file : Tito_4QMU.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-4QMU-query.scw
PDB file : Tito_Scwrl_4QMU.pdb: