Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | --------------------------------------MFQKKTYAVFLILLLMMFTAACSGSKTSAEKKESETEKSSDIAQVKIKDVSYTLPSKYDKSTSDDQLVLKV--------------------NVAVKNTGKDPLNVDSMDFTLYQG-----------------DTKMSDTDPEDYSEKLQGSTINADKSVEGNL------FFVVDKGKQYELN--YTPESYGDKKPKSV----TFKIDGKDKKILATADKLQDSAKALSAYVDVLLFGKDNADFEKITGANKNE---IVNDFNESAKDGYLSASGLSSTYADSKALDNI--VNGIKEGLSKNSSIQA------KTTSISKDE-----AIVEATVKPVDASSLSDRIEDKVKDYYSKNS---SASYEE---------AVKYALQVYPEEFKKLGPASSEKTVEVKMKKNDIDQWQLDMDDY---RAAELVEAFIKE |
3W36 Chain:A ((58-527)) | IEFDLDKDNYIKWAQPTDENAGQSPTLAILGPMDVTVFLWINRVVWLAAFDALAPYHETAVGVYSQIPRRPSSESATNRNLNIAALHAQHGVWKRVLPQQVDQLRELMTALGLDPSDETENLSSPVGIGNVAAKN-AFNALKNDGMNFLGYEGRKYNPRPWADYTGYEPVNTAFKVNNPSRWQPQLQAHNARRAGGGPGDLGIYVTQHFVTPQTARTKAHIFRDPSRFRIPRPEFSDHTNTRAYKRSVDEIIDASANLNDERKALAEIMENKLWGIGHSSIVIANKYDQNNEMGVHGWCHWMLAHVLATFEPLIAAWHHKTRFDAVRPVTAIRHVYG-NRKIRAWGGVGMGTVDIRASEWSSYLPVGDHPEYPSGSTSLCSATSQAARRYFDSDELDWTINYPAGSTVVEPGITPGKDLSIHIPTWTDFTRTCATSRVWGGVHFQTTVDRTIDFGEQFGDLAHEFVQRHVKG |
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General information:
TITO was launched using:
| RESULT:
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Template: 3W36.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) 102916 for 2719 contacts (37.9/contact) +
2D Compatibility (PS) -36111 + (NN) -3648 + (LL) 116
1D Compatibility (HY) -6800 + (ID) 2900
Total energy: 53573.0 ( 19.70 by residue)
QMean score : 0.113
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