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



Input alignment information:
Query sequenceMNQKYQIKLSQLIKGCFIYAIANYALAQPIVVEGVVPNEASKQAILMKMQSVYGADQVVDKIQVRPVAAPNGWSDSVTRVITPDLKKVSQGKLSVNGTRFELTGKMLNPTEIQPTIQSFQSLVQPPYQLFSQLSVNQAEQKIIDDALKNRIIEFESGSAVLTEAGQKILDEMAVALNKVGGKKVKIVGHTDSSGDATKNLKLSQDRALAVKNYLISKNIPADHLSTEGLGSSKPVADNTSAEGRKKNRRIEFTVL
2HQS Chain:H ((4-105))---------------------------------------------------------------------------------------------------------------------------------------------------QNNIVYFDLDKYDIRSDFAQMLDAHANFLRSNPSYKVTVEGHADERGTPEYNISLGERRANAVKMYLQGKGVSADQISIVSYGKEKPAVLGHDEAAYSKNRR------


General information:
TITO was launched using:
RESULT:

Template: 2HQS.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
Monomeric PKB - chain H - contact count / total energy / energy per contact / energy per residue : 403 -10457 -25.95 -102.51
target 2D structure prediction score : 0.67
Monomeric hydrophicity matching model chain H : 0.57

3D Compatibility (PKB) : -25.95
2D Compatibility (Sec. Struct. Predict.) : 0.67
1D Compatibility (Hydrophobicity) : 0.57
QMean score : 0.621

(partial model without unconserved sides chains):
PDB file : Tito_2HQS.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2HQS-query.scw
PDB file : Tito_Scwrl_2HQS.pdb: