Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | SMHPQAVAAVLPAGGCGERMGVPTPKQFCPILERPLISYTLQALERVCWIKDIVVAVTGENMEVMKSIIQKYQHKRISLVEAGVTRHRSIFNGLKALAEDQINSKLSKPEVVIIHDAVRPFVEEGVLLKVVTAAKEHGAAGAIRPLVSTVVSPSADGCLDYSLERARHRASEMPQAFLFDVIYEAYQQCSDYDLEFGTECLQLALKYCCTKAKLVEGSPDLWKVTYKRDLYAAESIIKERISQEICVVMDTEEDNKHVGHLLEEVLKSELNHVKVTSE--ALGHAGRHLQQIILDQCYNFVCVNVTTSDFQETQKLLSMLEESSLCILYPVVVVSVHFLDFKLVPPSQKMENLMQIREFAKEVKERNILLYGLLISYPQDDQKLQESLRQGAIIIASLIKERNSGL-IGQLLIA------------------------------- |
1W55 Chain:A ((2-370)) | ----SEMSLIMLAAGNSTRFNTKVKKQFLRLGNDPLWLYATKNLSSFYPFKKIVVTS--SNITYMKKF-----TKNYEFIEGGDTRAESLKKALELI----------DSEFVMVSDVARVLVSKNLFDRLIENLDKADCITPALKVADTTLFDN------EALQREKIKLIQTPQISKTKLLKKAL-----DQNLEFTD-DSTAIAAMGGKIWFVEGEENARKLTFKEDLKKL---------DLPTPSFEIFTGNGFDVHEFGENRPLLLAGVQIHPTMGLKAHSDGD----------------VLA--HSLTDAILGAA---GLGD------IGELYPD--TDMKFKNANSMELLKQAYDKVREIGFELINIDICVMAQSPKLKDFKQAMQSNIAHTL-----DLDEFRINVKATTTEKLGFIGRKEGMAVLSSVNLKYFDWTR |
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General information:
TITO was launched using:
| RESULT:
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Template: 1W55.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -195970 for 2667 contacts (-73.5/contact) +
2D Compatibility (PS) -34384 + (NN) -3618 + (LL) 5132
1D Compatibility (HY) -7200 + (ID) 3300
Total energy: -239340.0 ( -89.74 by residue)
QMean score : 0.206
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