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



Input alignment information:
Query sequenceMDSRLLSGIGAGPDSGSYTDLNRLNQLKVGKDRDGEANIRKVAQEFESLFLNEMLKSMRSANEAL---GDGNFMNSQTTKQYQDMYDQQLSVSLSKNAGGIGLADVLVRQLSKMKQGSRGNGENPFARVAENGAGRWPSNPSAQAGKALPMPEAGRDDSKLLNQRRLALPGKLAERMLAGIVPSASPAASQMQSLGQDSYLPAQSYPAASRRGFSTDGVDSQGSRRIAQPPLARGKSMFASADEFIATMLPMAQKAAERIGVDARYLVAQAALETGWGKSIIRQQDGGSSHNLFGIKTGSRWDGASARALTTEYEGGKAVKEIAAFRSYSSFEQSFHDYVSFLQGNDRYQNALDSAANPERFMQELQRAGYATDPQYARKVAQIARQMQTYQAVAAAGTPPLG
1IB2 Chain:A ((1-322))GRSRLLEDFRNNRYPNLQLREIAGHIMEFSQDQHGSRFIQLKLERATPAERQLVFNEILQAAYQLMVDVFGNYVIQKFFEFGSLEQKLALAERIRGHVLSLALQMYGCRVIQKALEFIPSDQQNEMVRELDGHVLKCVKDQ---------------NGNHVVQKCIECVQPQSLQFIIDAFKGQVFALST------------------------------HPYGCRVIQRILEH-----CLPDQTLPILEELHQHTEQLVQDQYGNYVIQHVLEHGRPEDKSKIVAEIRGN---------------VLVLSQHKFASNVVEKCVTHASRTERAVLIDEVCTMNDGPHSALYTMMKDQYANYVVQKMIDVAE------PGQRKIVMHKIRPHIA----------


General information:
TITO was launched using:
RESULT:

Template: 1IB2.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) 40578 for 2621 contacts (15.5/contact) +
2D Compatibility (PS) -34303 + (NN) -10294 + (LL) 2688
1D Compatibility (HY) -5600 + (ID) 1650
Total energy: -8581.0 ( -3.27 by residue)
QMean score : 0.308

(partial model without unconserved sides chains):
PDB file : Tito_1IB2.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-1IB2-query.scw
PDB file : Tito_Scwrl_1IB2.pdb: