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



Input alignment information:
Query sequenceMRSADLTAHARIREAAIEQFGRHGFGVGLRAIAEAAGVSAALVIHHFGSKEGLRKACDDFVAEEIRSSKAAALKS-NDPTTWLAQMAEIESYAPLMAYLVRSMQSGGELAKMLWQKMIDNAEEYLDEGVRAGTVKPSRDPRARARFLAITGGGGFLLYLQMHENPTDLRAALRDYAHDMVLPSLEVYTEGLLADRAMYEAFLAEAQQGEAHVG
4NN1 Chain:A ((6-210))-----LTAHARIREAAIEQFGRHGFGVGLRAIAEAAGVSAALVIHHFGSKEGLRKACDDFVAEEIRSSKAAALKSNDPTTWLAQMAEIE-SYAPLMAYLVRSMQSGGELAKMLWQKMIDNAEEYLDEGVRAGTVKPSRDPRARARFLAITGGGGFLLYLQMHENPTDLRAALRDYAHDMVLPSLEVYTEGLLADRAMYEAFLAEAQQGEAH--


General information:
TITO was launched using:
RESULT:

Template: 4NN1.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -68884 for 1340 contacts (-51.4/contact) +
2D Compatibility (PS) -23152 + (NN) -14669 + (LL) 472
1D Compatibility (HY) -23200 + (ID) 9600
Total energy: -139033.0 ( -103.76 by residue)
QMean score : 0.449

(partial model without unconserved sides chains):
PDB file : Tito_4NN1.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-4NN1-query.scw
PDB file : Tito_Scwrl_4NN1.pdb: