Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
| Query sequence | MLKE--KYSFKEVENKYNILWEDSRVYK---WDGKKENTFTIDTPPPTISGKLHIGHIFSYCHTDFIARFQRMLGKDIFYPIGFDDNGLPTERLVEQTYKTRA-REV---GREKFIEMCHEVIEKSKQEFKELLRSVGISYDWSLEYHTISKETVTLSQMSFIDLYNKGYAYRKMQPILWDPVDKTAIAQAEIE--DKVCESSLNTITFSTEENEQID-------IATTRPELFLACVAVFCHPEDARYAHLIGKTSVVPIIGVKVPIIADGRVKIDKGTGLVMCCTF-GDELDIYWQQKHNLPMKIIIDQDGKINLDSMYDNNRSQYQGIGMTGERSTGVIKEGAISPHYDVIPVRNTRIY----------------DEINGLKVKEARKKIIKILTERGLLTGSTNISHSVKCAERSGVSLEILPTYQWFIKTLDQKAQVLDKVKECNWYPSTMRK-RMEVWIEGLNWDWCISRQRYFGVPFPVWYSRRKGEEGKVILAEVEDLPVDPLKDLPKGYSKEEVVPDQ---------------DVMDTWATSAITPQLSALAVNSEFSLPDHRYNTIFPADLRSQSHEIIRTWAFYTILKAYYHANSLPWKNIMVSGWCLADDKKKMSKSKGNIITPKSILDTYGADVVRYWT-ANSRLGVDTVYSENILKIGKR-LVTKLWNASKFVSIFMERYQAVSINSVS----ETMDQWILSKLYKVIEKATNNLLQFEYCEALGAVEGFFWKDFCDNYLELAKKRAYGDKVSSKANLSAKQSLTYVLNTILRLLAPFLPYITEQIYH------QLYSDNSVHNRGNWPNKEELIYDKHSEEMGDKFMQILNLVRKIKADNNVSVKHLIKKLMIKANVKEDKLNQSAQNDLQTVCNAEMIEWSENAQAGLITENGKFIVSIDLY |
| 1ILE Chain:A ((1-821)) | MFKEVGEPNFPKLEEEVLAFWKREKIFQKSVENRKGGPRYTVYEGPPTANGLPHVGHAQARSYKDLFPRYKTMRGYYAPRRAGWDTHGLPVELEVEKKLGLKSKREIEAYGIERFNQACRESVFTYEKEWEAFTERIAYWVDLEDAYATLEPTYIESIWWSLKNLFDRGLLYRDHKVVPYCPRCGTPLSSHEVALGYKEIQDPSVYVRFPLKEPKKLGLEKASLLIWTTTPWTLPGNVAAAVHPEYTYAAFQVGDEAL---------ILEEGLGRKLLGEGTQVLKTFPGKALE-------GLPYTPPYPQ----ALEKGYFVVLADY----VSQEDGTGIVHQ---APAFGAEDLETARVYGLPLLKTVDEEGKLLVEPFKGLYFREANRAILRDLRGRGLLFKEESYLHSYPHCWRCSTPLMYYATESWFIKNTLFKDELIRNNQEIHWVPPHIKEGRYGEWLKNLV-DWALSRNRYWGTPLPIWVCQACGKEEAI--GSFQELKARATKPLPEPFDPHRPYVDQVELACACGGTMRRVPYVIDVWYDSGAMP-FASLHYPFEH---EEVFRESFPADFIAEGIDQTRGWFNSLHQLGVMLFGSIAFKNVICHGLILDEKGQKMSKSKGNVVDPWDIIRKFGADALRWYIYVSAPPEADRRFGPNLVRETVRDYFLTLWNVYSFFVTYANLDRPDLKNPPPPEKRPEMDRWLLARMQDLIQRVTEALEAYDPTTSARALRDFVVEDLSQWYVRRNRRRFWKNE-DALDREAAYATLYEALVLVATLAAPFTPFLAEVLWQNLVRSVRLEAKESVH-LADWPEADPALADEALVAQMRAVLKVVDLARAARAKSGV------------------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 1ILE.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -279045 for 6173 contacts (-45.2/contact) +
2D Compatibility (PS) -79357 + (NN) -18680 + (LL) 7400
1D Compatibility (HY) -36800 + (ID) 9800
Total energy: -416282.0 ( -67.44 by residue)
QMean score : 0.415
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