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



Input alignment information:
Query sequenceMNRAPDTPEVVLRLRGVCKRYGSITAVSNLDLDVHDAEVMALLGPNGAGKTTTVEMCEGFVRPDAGSIEVLGLDPITDNARLRARIGVMLQGGGGYPAARAGEMLDLVASYAANPLD-----PHWLLDTLGLTEAARTTYRRLSGGQQQRLALACALVGRPQLVFLDEPTAGMDAHARVLVWELIDAL-RRDGVTVVLTTHHLKEAEELADRLVIIDHGVTVAAGTPAELMRSGAKDQLR-FTAPPRLDLSLLASALPEGYQATELTPGEYLVEGPVDPQVLATVTAWCAQIDVLATDMRVEQRSLEDVFLDLTGRKLRQ
1Q1B Chain:A ((4-241))-----------VQLQNVTKAWGEVVVSKDINLDIHEGEFVVFVGPSGCGKSTLLRMIAGLETITSGDL-FIGEKRMNDTPPAERGVGMVFQSYALYPHLSVAENMSFGLKLAGAKKEVINQRVNQVAEVLQLAHLLDRKPKALSGGQRQRVAIGRTLVAEPSVFLLDEPLSNLDAALRVQMRIEISRLHKRLGRTMIYVTHDQVEAMTLADKIVVLDAGRVAQVGKPLELYHYPADRFVAGFIGSPKMNF----------------------------------------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 1Q1B.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -148422 for 1803 contacts (-82.3/contact) +
2D Compatibility (PS) -25101 + (NN) -11575 + (LL) 6176
1D Compatibility (HY) -16000 + (ID) 3400
Total energy: -198322.0 ( -110.00 by residue)
QMean score : 0.315

(partial model without unconserved sides chains):
PDB file : Tito_1Q1B.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-1Q1B-query.scw
PDB file : Tito_Scwrl_1Q1B.pdb: