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



Input alignment information:
Query sequenceMSTTPDLPKERVITQEEFDNAVKLGGKFAPVFKVDEKTVVKTSDMTQLGEAAAMKMVREKTTIPVPEDQNVYTDPTTGDVP----IVMDFIEGDCLLDVW-----DTYDNDQKQQIIEQLH-SYFAQLRELKGSFIGSVDGKFCF--DQVFDQDIGGHGPYEDEASFNEGLVKALKNT---MISGWGDTVCDMVLAMKDHEIVFTHGDISPRNILVKDCNIVSVLDWEYSGYYPEYWEYAKAFFRPAWEKSWIKDRAVNKILKPYPLENAICQHVFSFGAW
3ATS Chain:A ((81-264))-----------------------------------------------------IRLVGELTDVPVPRVRWI---ETTGDVLGTPFFLMDYVEGVVPPDVMPYTFGDNWFADAPAERQRQLQDATVAALATLHS--IPNAQNTFSFLTDTTLHRHFNWVRSWYDFAVEGIGRSPLLERTFEWLQSHWPDDAAA-------REPVLLWGDARVGNVLYRDFQPVAVLDWEMVALGPRELDVAWMIF-------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 3ATS.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 498 -16813 -33.76 -102.52
target 2D structure prediction score : 0.52
Monomeric hydrophicity matching model chain A : 0.65

3D Compatibility (PKB) : -33.76
2D Compatibility (Sec. Struct. Predict.) : 0.52
1D Compatibility (Hydrophobicity) : 0.65
QMean score : 0.247

(partial model without unconserved sides chains):
PDB file : Tito_3ATS.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3ats-query.scw
PDB file : Tito_Scwrl_3ATS.pdb: