Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTMNDEPQSSSLDNFWMPFTANRQFKARPRLLESAEGIHYIAQGGRRILDGTAGLWCCNAGHGRREISEAVARQIATLDYAPPFQMGHPLPFELAARLTEIAPPSLNKVFFTNSGSESADTALKIALAYQRAIGQGTRTRLIGRELGYHGVGFGGLSVGGMVNNRKAFSANLLPGVDHLPHTLDVARNAFTVGLPEHGVEKAEELERLVTLHGAENIAAVIVEPMSGSAGVVLPPKGYLQRLREITRKHGILLIFDEVITGFGRVGEAFAAQRWGVVPDLLTCAKGLTNGSIPMGAVFVDEKIHAAFMQGPQGAIEFFHGYTYSGHPVACAAALATLDIYRRDDLFQRAVELEGYWQDALFSLRDLPNVVDIRAVGLVGGVQLAPHADGPGKRGYDVFERCFWEHDLMVRVTG-DIIAMSPPLIIDKPHIDQIVERLAQAIRASV |
1VEF Chain:B ((44-392)) | --------------------------------------------GNEYIDCVGGYGVANLGHGNPEVVEAVKRQAETL-MAMPQTLPTPMRGEFYRTLTAILPPELNRVFPVNSGTEANEAALKFARAHT------GRKKFVAAMRGFSGRTMGSLSVTWEPKYREPFLPLVEP-VEFIPYN-DV-----------------EALKRAVD----EETAAVILEPVQGEGGVRPATPEFLRAAREITQEKGALLILDEIQTGMGRTGKRFAFEHFGIVPDILTLAKAL-GGGVPLGVAVMREEVARSM---PKGG----HGTTFGGNPLAMAAGVAAIRYLERTRLWERAAELGPWFMEKLRAIPS-PKIREVRGMGLMVGLELK-------EKAAPYIARLEKEHRVLALQAGPTVIRFLPPLVIEKEDLERVVE----AVRA-- |
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General information:
TITO was launched using:
| RESULT:
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Template: 1VEF.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -281320 for 3182 contacts (-88.4/contact) +
2D Compatibility (PS) -38457 + (NN) -19901 + (LL) 5216
1D Compatibility (HY) -25600 + (ID) 6750
Total energy: -366812.0 ( -115.28 by residue)
QMean score : 0.500
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