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



Input alignment information:
Query sequenceMRLDFSKKTMQDFERDAEVVHATRERSFWRFMLADRR---AVFATSVLILIT------VACIFAFLSPYDPNALSVQDKLMPPNSSHWFGTDDHGRDYLTRVLYGGRVSLLVGVFAMMIAVVVGTLAGTVSGYFGGFIDNIVMRFLDIFMSIPSFFLLMILNAYLKPGISNIIIIIGLLSWMEVARIVRAETLTLKEREFILYSKSSGGGFFHIMFKHIIPNAMPSIVVAASLNVATAILTESALSF-LGLGVQQPNASWGS----MLNNAQGYVGEATYLALFPGLLILMTILS------------FNVLGDVLRK-GLSRRY-------------------------------------------------------------------------------------------------------------------------------------------
4US3 Chain:A ((10-450))GREQWASRLGFILAAMGSAVG---LGNIWRFSYVTGENGGAAFLLVYLGFIALIGIPIVLAEFTIGRRAQSDAVGSFEKLAPGKPWKVAGLMGVAAGFLILSFYGVIAGWILFYLFNYIT---GQLWSAPAEGFGGFFEGFIANP-----TLPLFWQALFMIATI------WIVAIGVKKGIERSNKILMPLLGVLLIALAIYSLTLGG--AKEGLAFLFS---PDWSALKDPGVYLAAISQAFFTLSLGMGALITYGSYVSKDSRLPGAAVSVAGLDTAFAIIAGIMIFPAVFALGLSPSGGPGLVFVVLPDIFDSIRLGPIVGIAFFILLGAAALSSAVSLLEVPVAYFMRKFDWSRKQAAITLGVIITLLGIPSSLSFGVLGEVTIIPGLNIFDSVDFIASSVFLPLGGMIIALFIGWGWKTSDALAESDLTDSVWGKLWILSLRFIAPIAILIVFLSAF


General information:
TITO was launched using:
RESULT:

Template: 4US3.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -157195 for 2055 contacts (-76.5/contact) +
2D Compatibility (PS) -28759 + (NN) -7592 + (LL) 1596
1D Compatibility (HY) -16400 + (ID) 2850
Total energy: -211200.0 ( -102.77 by residue)
QMean score : 0.234

(partial model without unconserved sides chains):
PDB file : Tito_4US3.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-4US3-query.scw
PDB file : Tito_Scwrl_4US3.pdb: