Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSHRIVIVGGGAGGLELATRLGRTLGKRGKAQVTLVDANLTHIWKPLLHEVAAGSLNSS---EDELNYVAQAKWN--HFEFQLGRMQGLDRAGKRVRLAALVD-----EN--GVELVPERDIAYDTLVIAVGSTTNDFGTEGAAEHCIFLDTRAQAERFHRQLLGQYLRAH---TGHDANNNAVSIAIIGAGATGVELAAELHHAAQMLAAYGLDRIRP---EDLHISLVEAGPRVLPALPERISQPVHQTLSKLGVRVMTGSAVSKVDADGLWTG----DG----EFVPATLKVWAAGIRAPAFLKELDGL--ESNRINQ-LVVRPTLQTTRDDDIFAFGDCAACPQPAQPGEQPRNVPPRAQAAHQQASLLV-------------KSLRAR----LEGKPLGEYHYRDYGSLISLSRFSAVGNLMGN----LMGSVMLEGWLARMFYVSLYRMHQMALYGPLRTAMLMLSGRLRSTEPRLKLH |
4GAP Chain:A ((14-443)) | ----VLILGSGWGAISFLKHIDTK-----KYNVSIISPRSYFLFTPLLPSAPVGTVDEKSIIEPIVNFALKKKGNVTYYEAEATSINP-DRNTVTIKSLSAVSQLYQPENHLGLHQAEPAEIKYDYLISAVGAEPNTFGIPGVTDYGHFLKEIPNSLEIRRTFAANLEKANLLPKGDPERRRLLSIVVVGGGPTGVEAAGELQDYVHQ----DLRKFLPALAEEVQIHLVEALPIVLNMFEKKLSSYAQSHLENTSIKVHLRTAVAKVEEKQLLAKTKHEDGKITEETIPYGTLIWATGNKARPVITDLFKKIPEQNSSKRGLAVNDFLQVKGSNNIFAIGDNAFA-----------GLPPTAQVAHQEAEYLAKNFDKMAQIPNFQK-----IDLLFEENNFKPFKYNDLGALAYLGSERAIATIRSGKRTFYTGGGLMTFYLWRILYLSM--------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4GAP.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -243233 for 3034 contacts (-80.2/contact) +
2D Compatibility (PS) -39476 + (NN) -5991 + (LL) 4356
1D Compatibility (HY) -22400 + (ID) 5500
Total energy: -312244.0 ( -102.91 by residue)
QMean score : 0.420
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