Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MANASLRHQLFEKLDQKCDQMVAIRRYLHENPELSFKETKTAAYISD---------------------------------FYKGKDCHVQTQF-----GGMNGVVVDIYGDKATDKPIKHIALRADFDALPIQEETGLSFASKTAGVMHACGHDAHTAYLLILAESLIELKSEFSGHIRILHQPAEEVPPGGAKAMIEAGCLDGIDAVLGIHVMSTMEEGTVQYHAGPIQTGRATFKVILQGKGGH-GSMPHRANDTIVAASSFVIAAQTIVSRRVNPFDTAVVTIGSFDGKGSANVIKDSVTLEGDVRVMSEETRGVVEEEFKRILDGIAQTYGVSYQLDYQNDYPVLVNNSEVTQKVANSLKSVAIKEILDVIDCDPQTPSEDFAYYAQTIPACFFYVGAHEEGQPYYPHHHPKFQIAESSLMVSAKSMATAALAMLEEGE |
3IO1 Chain:A ((4-333)) | --------QLDEYLRQLAPSMTQWRRDFHLHAESGWLEFRTASKVADILDGLGYQLALGRDVIDADSRMGLPDEETLARAFERAREQGAPERWLPAFEGGFAGVVATL----DTGRPGPTLAFRVDMDALDL------------------CGHDGHTAIGLGLAHVLKQYAAQLNGVIKLIFQPAEE-GTRGARAMVAAGVVDDVDYFTAIHIGTGVPAGTV-VCGGDNFMATTKFDVQFSGVAAHAGGKPEDGRNALLAAAQAALGLHAIPPHSAG---ASRVNVGVMQAGTGRNVVPSSALLKVETRGESEAINQYVFERAQHVVAGAAAMYEARYELRMMGAATASAPSPAWVDYLREQAARVPGVQQAVDRIAAPAGSEDATLMMARVQARGGLASYMIFGTELDESVMAVAVETLARVALNFPWQR------------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 3IO1.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -96503 for 1925 contacts (-50.1/contact) +
2D Compatibility (PS) -28765 + (NN) -10977 + (LL) 2456
1D Compatibility (HY) -11200 + (ID) 4250
Total energy: -149239.0 ( -77.53 by residue)
QMean score : 0.378
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