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



Input alignment information:
Query sequenceMLRLQFHKKLPFHDLNIDYTFEKPVTAMMGASGSGKSTLFQCVSGLKSIDGGIIEFDGTPWDDSNISLHLPVTERKVGYLFQNLALFPNMNVYENIAFGLKVKKKKKKEQAEIQQQVRKMSDYLQISHLLYSSVQKLSGGEKQRVAMARAMITEPKLLLLDEPFNGLDEETRLICMKLVGQMAKDFHIPVIFVTHYASEAEMMTEEILVMREGRLEKRKS
3PUW Chain:A ((21-214))-------------DINLD-IHEGEFVVFVGPSGCGKSTLLRMIAGLETITSGDLFIGEKRMNDT------PPAERGVGMVFQSYALYPHLSVAENMSFGLKLAGAKKEV---INQRVNQVAEVLQLAHLLDRKPKALSGGQRQRVAIGRTLVAEPSVFLLDEPLSNLDAALRVQMRIEISRLHKRLGRTMIYVTHDQVEAMTLADKIVVLDAGRVAQ---


General information:
TITO was launched using:
RESULT:

Template: 3PUW.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -119343 for 1467 contacts (-81.4/contact) +
2D Compatibility (PS) -21051 + (NN) -8991 + (LL) 2384
1D Compatibility (HY) -19600 + (ID) 3700
Total energy: -170301.0 ( -116.09 by residue)
QMean score : 0.562

(partial model without unconserved sides chains):
PDB file : Tito_3PUW.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3PUW-query.scw
PDB file : Tito_Scwrl_3PUW.pdb: