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



Input alignment information:
Query sequenceMHKGWSGHFFCAQNEKGSEKMAEITLEFDTIAAISTPPGEGAISIVRLSGDQAVQLADKVYQSGNKRLSEVPSHTIHYGHIVDPKSNQLVDEVMVSVMRAPKTFTREDVVEINCHGGIVVVNQILQLLLREGARLAEPGEFTKRAFLNGRVDLSQAEAVMDLIRAKTDKAMGLALNQLDGNLSALIRSLRQEILETLAQVEVNIDYPEYDDVEELTTKLLLEKAQMIQQRIQALLATSKQGKVLREGLSTAIIGRPNVGKSSLLNHLLREEKAIVTDIAGTTRDVIEEYVNV-RGVPLKLIDTAGIRETED--VVERIGVERSRKALAEADLILLVLNQSEPLTAEDEQLLE-A--TSGLKRIILLNKTDLPAQLE-QE----KLKKLIE-NEPVFSISVAKNDGLDRLESAISDLFFSGETGERDATYVSNTRHIALLEKASLSLEEVIAGIDSGMPVDLVQIDMTRCWDYLGEVVGDSVQDELITQLFSQFCLGK
3IEV Chain:A ((9-182))-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------KVGYVAIVGKPNVGKSTLLNNLLGTKVSIISPKAGTTRMRVLGVKNIPNEAQIIFLDTPGIYEPKKSDVLGHSMVEIAKQSLEEADVILFMIDATEGWRPRDEEIYQNFIKPLNKPVIVVINKIDKIGPAKNVLPLIDEIHKKHPELTEIVPISALKGANLDELVKTILKYLPE------------------------------------------------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 3IEV.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 : 768 11611 15.12 71.67
target 2D structure prediction score : 0.57
Monomeric hydrophicity matching model chain A : 0.60

3D Compatibility (PKB) : 15.12
2D Compatibility (Sec. Struct. Predict.) : 0.57
1D Compatibility (Hydrophobicity) : 0.60
QMean score : 0.528

(partial model without unconserved sides chains):
PDB file : Tito_3IEV.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3IEV-query.scw
PDB file : Tito_Scwrl_3IEV.pdb: