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



Input alignment information:
Query sequenceMRPLQISAETAQKLAESLNLPLEQIMHMPQHILLAKMAELQKEDKS
2XI8 Chain:A ((41-61))-----PSLQLALKIAYYLNTPLEDIF--------------------


General information:
TITO was launched using:
RESULT:

Template: 2XI8.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 : 33 -10871 -329.41 -517.64
target 2D structure prediction score : 0.67
Monomeric hydrophicity matching model chain A : 0.67

3D Compatibility (PKB) : -329.41
2D Compatibility (Sec. Struct. Predict.) : 0.67
1D Compatibility (Hydrophobicity) : 0.67
QMean score : 1.238

(partial model without unconserved sides chains):
PDB file : Tito_2XI8.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2XI8-query.scw
PDB file : Tito_Scwrl_2XI8.pdb: