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



Input alignment information:
Query sequenceMCMGRLAVNLSMIFTEVPLIERFALAHAEGFEHVEIQFPYELAISDIQDQLERYNLNLCLINVPAGDLMQGGNGLAGIPGQEAAFREALQLAIRYATALKVPRVNILAGKQPQDSDLLPCLKTLASNLKLACDLLTEHDIEPVFEMINGTDMPRFLVQNIAQAQEMLEAVNHPALKMQYDCYHMAMMGEDVLEGLQENIHQIGHIQFADCPGRHEPDTAQIPYEQIFSWIKQSAYEGYIAAE-YKPKNGSNQSFTWKKKYFSDDVNI
2QUM Chain:A ((123-254))-------------------------------------------------------------------------------------------------------------------DKRPYVDRAIESVRRVIKVAEDYGIIYALEVVN--RFEQWLCNDAKEAIAFADAVDSPACKVQLDTFHMNIEETSFRDAILACKGKMGHFHLGEA-NRLPPGEGRLPWDEIFGALKEIGYDGTIVMEPFMRKGGS-----------------


General information:
TITO was launched using:
RESULT:

Template: 2QUM.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 : 566 -70918 -125.30 -541.35
target 2D structure prediction score : 0.69
Monomeric hydrophicity matching model chain A : 0.62

3D Compatibility (PKB) : -125.30
2D Compatibility (Sec. Struct. Predict.) : 0.69
1D Compatibility (Hydrophobicity) : 0.62
QMean score : 0.528

(partial model without unconserved sides chains):
PDB file : Tito_2QUM.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2QUM-query.scw
PDB file : Tito_Scwrl_2QUM.pdb: