Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | ----------------MLSTAKERQLKIVNRLKVEQ-----------------FMRIIDLVEFV--------NYSEATVKRDLVELEKEGLVR--RTRGGAMII---------DNKKID-LPYLMKMNERSNETSKIRIA-------------DIAKSLIRDDMVIFLDSSSTSLHLIDVLSK-----FDGLQIITNGVMTASM------------LSEFTNAR-VSILGGSILTKRYTVNGAKAYNDALT---------YNADIAFVS--CRGIDYDKGATETHEGEALIKQAFRRQSSS---LVLLVTEEKVGHKFMHQSLACHDIDYLITD-----FKLDPDVEEQFKTHQITCLY--- |
3THI Chain:A ((1-362)) | ITLKVAIYPYVPDPARFQAAVLDQWQRQEPGVKLEFTDWDSYSADPPDDLDVFVLDSIFLSHFVDAGYLLPFGSQDIDQAEDVLPFALQGAKRNGEVYGLPQILCTNLLFYRKGDLKIGQVDNIYELYKKIGTSHSEQIPPPQNKGLLINMAGGTTKASMYLEALIDVTGQYTEYDLLPPLDPLNDKVIRGLRLLINMAGEKPSQYVPEDGDAYVRASWFAQGSGRAFIGYSESMMRMGDYAEQVRFKPISSSAGQDIPLFYSDVVSVNSKTAHPELAKKLANVMASADTVEQALRPQADGQYPQYLLPARHQVYEALMQDYPIYSELAQIVNKPSNRVFRLGPEVRTWLKDAKQVLPEALG |
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General information:
TITO was launched using:
| RESULT:
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Template: 3THI.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -60457 for 1806 contacts (-33.5/contact) +
2D Compatibility (PS) -26337 + (NN) 1319 + (LL) 0
1D Compatibility (HY) -8000 + (ID) 2150
Total energy: -95625.0 ( -52.95 by residue)
QMean score : 0.161
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