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



Input alignment information:
Query sequence---------------------------MKHDAYEIILSWF---------ITPLTAILGRFAEFFLYTLHAQLVFNSAVALAFMLFAYRSLKEQNFFSASALLEALWFVGFFALFNYALKNPSRFYELFQNAIFIAPNMIT----QSLSQSLSNFSNHALSLDFIFNHGFYALSF--------ISDLSHNEM----SVWLFLSILQALFLSVLFAIIILVYLEAHV------WCSLGALFL---AFGFFKTWRSVVVICLKKCFALGFYKPFLLLVGFLNVSVT----KALMDASMQEKQDLSLLLV-----VALFLCCVFIIGVPFFINALFRVQNSLKET--------YKLATNLSANLTQSAFQSLQHATTSPAPSHISSSASQSVSKEKETHSPTFKVETTQLDVK--IPNFKQKKVKKDTIDTKNEI------------------------------------------
4HE8 Chain:G ((1-467))MVVLAVLLPVVFGALLLLGLPRALGVLGAGLSFLLNLYLFLTHPGGVAHAFQAPLLPGAGVYWAFGLDGLSALFFLTIALTVFLGALVARVEGRFLGLALLMEGLLLGLFAAR------DLLVFYVFFEAALIPALLMLYLYGGEGRTRALYTFVLFTLVGSLPMLAAVLGARLLSGSPTFLLEDLLAHPLQEEAAFWVFLGFALAFAIKTPLFPLHAWLPPFHQENHPSGLADALGTLYKVGVFAFFRFAIPLAPEGFAQAQGLLLFLAALSALYGAWVAFAAKDFKTLLAYAGLSHMGVAALGVFSGTPEGAMGGLYLLAASGVYTGGLFLLAGRLYERTGTLEIGRYRGLAQSAPGLAALALILFLAMVGLPGLSGFPGEFLTLLGAYKASPWLAALAFLSVIASAAYALTAFQKTFWEEGGSGVKDLAGAEWGFALLSVLALLLMGVFPGYFARGLHPLAEAFAKLLGG


General information:
TITO was launched using:
RESULT:

Template: 4HE8.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -274663 for 2972 contacts (-92.4/contact) +
2D Compatibility (PS) -35611 + (NN) -15026 + (LL) 528
1D Compatibility (HY) -13200 + (ID) 2650
Total energy: -340622.0 ( -114.61 by residue)
QMean score : 0.192

(partial model without unconserved sides chains):
PDB file : Tito_4HE8.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-4HE8-query.scw
PDB file : Tito_Scwrl_4HE8.pdb: