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



Input alignment information:
Query sequenceMLEIKNLSKKFDQ-KTILDNVNITLQDGEILSIVGPSGGGKTTLLRCISGLEKMDAGEILIDGEKIDPMSRKDVENTIGVVFQEFHLFPHLSVLDNLILAPTLARKTKKADAVKEAERLLGLLDL-----------ADKANSMPYQLSGGQKQRVAIARALAMNPKVLLFDEPTSALDPDLRDHVAALILSLKKVGITQIIVTHDHTFAEKVADQMMEVEPLKKEAI
3NH6 Chain:A ((54-268))-IEFENVHFSYADGRETLQDVSFTVMPGQTLALVGPSGAGKSTILRLLFRFYDISSGCIRIDGQDISQVTQASLRSHIGVVPQDTVLFN-DTIADNIRYGRVTAG-------NDEVEAAAQAAGIHDAIMAFPEGYRTQVGERGLKLSGGEKQRVAIARTILKAPGIILLDEATSALDTSNERAIQASLAKVC-ANRTTIVVAHRLSTVV-NADQILVIKDGCIVE-


General information:
TITO was launched using:
RESULT:

Template: 3NH6.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -112300 for 1553 contacts (-72.3/contact) +
2D Compatibility (PS) -21451 + (NN) -2923 + (LL) 1040
1D Compatibility (HY) -10400 + (ID) 3200
Total energy: -149234.0 ( -96.09 by residue)
QMean score : 0.586

(partial model without unconserved sides chains):
PDB file : Tito_3NH6.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3NH6-query.scw
PDB file : Tito_Scwrl_3NH6.pdb: