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



Input alignment information:
Query sequence--------------------------------MSRSNGSSSRRTFLRLAALLLPAGALLGSLPGVRAAARPRKLYLAGPDVFRADAVAHGEALKALCARYGFEGLYPLDNALPKQLAEPREQAAWIY----RANIG-LIERADAVLANLNFF--RGAEPDSGTAFEVGYATALGKPVYGYVDDAGSYAERIRRHAPELIGEDPTRDRDGMTL------------EEFGLPLNLMLAVPATL------------VVGDAEQALRQLASRRHG
1IPA Chain:A ((1-263))MRITSTANPRIKELARLLERKHRDSQRRFLIEGAREIERALQAGIE-LEQALVWEGGLNPEEQQVYAALL----ALLEVSEAVLKKLSVRDNPAGLIALARMPERTL-----EEYRPSPDALILVAVGLEKPGNLGAVLRSADAAGAEAVLVAG-GVDLYSPQVIRNSTGVVFSLRTLAA-SESEVLD-WIKQHNLPLVATTPHAEALYWEANLRPPVAIAVGPEHEGLRAAWLEAAQTQVRIPMQGQADSLNVSVSAALLLYEALRQRLL


General information:
TITO was launched using:
RESULT:

Template: 1IPA.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -47042 for 1383 contacts (-34.0/contact) +
2D Compatibility (PS) -20350 + (NN) -1472 + (LL) 1036
1D Compatibility (HY) -1600 + (ID) 1600
Total energy: -71028.0 ( -51.36 by residue)
QMean score : 0.192

(partial model without unconserved sides chains):
PDB file : Tito_1IPA.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-1IPA-query.scw
PDB file : Tito_Scwrl_1IPA.pdb: