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



Input alignment information:
Query sequenceMMNEIIAVANQKGGVGKTTTAVNLAASLAAHEKKILLIDFDPQANATSSLGFRRDKIDYDIYHVLIGR------KQISQVILKTQMPFLDLVPSNLGLAGFEKTFYDS-QDENKRGELMLKNALGSVVKLYDYIIIDSPPALGPLTINSLSAAHSVIIPIQCEFFALEGTKLLLNTIRMLQKSTNPKLKIRGFLPTMHVPQLNLTKGVLAELFKYFDSEFFRDSATGEYIMIPKSVKLAESPSFGKPILLYDIKSNGSIAYQKLAQSILQG
2BEK Chain:A ((9-243))-----IALANQKGGVGKTTTAINLAAYLARLGKRVLLVDLAPQGNATSGLGVRAER---GVYHLLQGEPLEGLVHPVDGFHLLPATP--DLVGATVELAGAPTALREALRDEG-----------------YDLVLLDAPPSLSPLTLNALAAAEGVVVPVQAEYYALEGVAGLLATLEEVRAGLNPRLRLLGILVTMYDGRTLLAQQVEAQLRAHFGEKVF-------WTVIPRNVRLAEAPSFGKTIAQHAPTSPGAHAYRRLAEEVMAR


General information:
TITO was launched using:
RESULT:

Template: 2BEK.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -121475 for 2020 contacts (-60.1/contact) +
2D Compatibility (PS) -23869 + (NN) -5854 + (LL) 2680
1D Compatibility (HY) -19200 + (ID) 5150
Total energy: -172868.0 ( -85.58 by residue)
QMean score : 0.446

(partial model without unconserved sides chains):
PDB file : Tito_2BEK.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2BEK-query.scw
PDB file : Tito_Scwrl_2BEK.pdb: