NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
10458 |
1ps2   |
4933 | cing | 1-original | 4 | XPLOR/CNS | distance | NOE | simple |
! assign (resid 3 and name ha ) (resid 51 and name ha ) 4.00 4.00 1.00 ! assign (resid 4 and name hn ) (resid 50 and name hn ) 4.50 4.50 1.00 ! assign (resid 4 and name hn ) (resid 51 and name ha ) 4.50 4.50 1.00 ! assign (resid 5 and name ha ) (resid 49 and name ha ) 3.50 3.50 0.50 ! assign (resid 6 and name hn ) (resid 48 and name hn ) 3.50 3.50 0.50 ! assign (resid 6 and name ha ) (resid 48 and name hn ) 4.50 4.50 1.00 ! assign (resid 6 and name hb ) (resid 48 and name hn ) 4.00 4.00 1.00 ! assign (resid 7 and name hn ) (resid 48 and name hn ) 4.50 4.50 1.00 ! assign (resid 7 and name ha) (resid 33 and name hb1) 4.00 4.00 1.00 ! assign (resid 7 and name ha) (resid 45 and name hz ) 4.00 4.00 1.00 ! assign (resid 7 and name hb1) (resid 45 and name hz ) 3.50 3.50 0.50 ! assign (resid 7 and name ha) (resid 47 and name ha ) 3.50 3.50 0.50 ! assign (resid 7 and name ha) (resid 47 and name hb1) 4.00 4.00 1.00 ! assign (resid 7 and name ha ) (resid 48 and name hn ) 4.00 4.00 1.00 ! assign (resid 7 and name hb1) (resid 33 and name hn) 4.50 4.50 1.00 ! assign (resid 9 and name hn ) (resid 14 and name hg2) 4.50 4.50 1.00 ! assign (resid 9 and name hn ) (resid 14 and name he ) 4.50 4.50 1.00 ! assign (resid 9 and name hb ) (resid 14 and name hg2) 4.00 4.00 1.00 ! assign (resid 9 and name hb ) (resid 45 and name hz) 4.50 4.50 1.00 ! assign (resid 14 and name hb1) (resid 42 and name hd2) 4.50 4.50 1.00 ! assign (resid 14 and name hb2) (resid 42 and name hd2) 3.50 3.50 0.50 ! assign (resid 14 and name hb1 ) (resid 45 and name ha ) 4.50 4.50 1.00 ! assign (resid 14 and name hb1 ) (resid 46 and name hn ) 4.50 4.50 1.00 ! assign (resid 15 and name hn ) (resid 45 and name ha ) 4.50 4.50 1.00 ! assign (resid 15 and name hn ) (resid 45 and name hb2) 4.00 4.00 1.00 ! assign (resid 15 and name hn ) (resid 46 and name hn ) 4.50 4.50 1.00 ! assign (resid 15 and name hn ) (resid 46 and name hb2 ) 4.50 4.50 1.00 ! assign (resid 15 and name ha ) (resid 46 and name hn ) 4.50 4.50 1.00 ! assign (resid 16 and name ha) (resid 45 and name ha ) 3.50 3.50 0.50 ! assign (resid 16 and name ha ) (resid 46 and name hn ) 4.00 4.00 1.00 ! assign (resid 17 and name hn ) (resid 42 and name hb1 ) 4.50 4.50 1.00 ! assign (resid 17 and name hn ) (resid 42 and name hb2 ) 4.00 4.00 1.00 ! assign (resid 17 and name hn ) (resid 45 and name ha ) 2.70 2.70 0.50 ! assign (resid 17 and name ha ) (resid 45 and name ha ) 3.50 3.50 0.50 ! assign (resid 17 and name hn ) (resid 45 and name hb2) 4.00 4.00 1.00 ! assign (resid 17 and name hn ) (resid 46 and name hn ) 4.50 4.50 1.00 ! assign (resid 17 and name hb2) (resid 33 and name hn ) 4.50 4.50 1.00 ! assign (resid 17 and name hb2 ) (resid 45 and name hn ) 4.50 4.50 1.00 ! assign (resid 17 and name hb2 ) (resid 45 and name ha ) 2.70 2.70 0.50 ! assign (resid 17 and name hb2 ) (resid 46 and name hn ) 3.50 3.50 0.50 ! assign (resid 18 and name hn ) (resid 44 and name hn ) 4.50 4.50 1.00 ! assign (resid 18 and name hn ) (resid 45 and name ha ) 4.00 4.00 1.00 ! assign (resid 18 and name ha1) (resid 44 and name hb1) 3.50 3.50 0.50 ! assign (resid 19 and name hz ) (resid 26 and name hb1) 4.50 4.50 1.00 ! assign (resid 19 and name hz ) (resid 26 and name he22) 4.00 4.00 1.00 ! assign (resid 19 and name hz ) (resid 26 and name he21) 4.00 4.00 1.00 ! assign (resid 24 and name hd1) (resid 34 and name hz) 4.00 4.00 1.00 ! assign (resid 27 and name hb1 ) (resid 34 and name hn ) 4.50 4.50 1.00 ! assign (resid 27 and name hn ) (resid 44 and name hb2 ) 4.50 4.50 1.00 ! assign (resid 28 and name hn ) (resid 34 and name hb2 ) 4.50 4.50 1.00 ! assign (resid 32 and name ha ) (resid 45 and name hn ) 4.50 4.50 1.00 ! assign (resid 32 and name ha ) (resid 46 and name ha ) 3.50 3.50 0.50 ! assign (resid 33 and name hn ) (resid 44 and name ha ) 4.50 4.50 1.00 ! assign (resid 33 and name hn ) (resid 45 and name hn ) 3.50 3.50 0.50 ! assign (resid 33 and name hb2 ) (resid 45 and name hn ) 4.00 4.00 1.00 ! assign (resid 33 and name hb1 ) (resid 45 and name hn ) 4.50 4.50 1.00 ! assign (resid 33 and name hb1) (resid 45 and name hz ) 3.50 3.50 0.50 ! assign (resid 33 and name hb2) (resid 45 and name hz ) 3.50 3.50 0.50 ! assign (resid 33 and name hb2 ) (resid 46 and name ha ) 4.50 4.50 1.00 ! assign (resid 34 and name hn ) (resid 45 and name hn ) 4.50 4.50 1.00 ! assign (resid 34 and name ha ) (resid 45 and name hn ) 4.00 4.00 1.00 ! assign (resid 34 and name ha) (resid 44 and name ha) 2.30 2.30 0.50 ! assign (resid 34 and name ha) (resid 43 and name ha) 4.50 4.50 1.00 ! assign (resid 34 and name hz) (resid 43 and name he3) 2.30 2.30 0.50 ! assign (resid 34 and name hz) (resid 43 and name hb1) 4.00 4.00 1.00 ! assign (resid 34 and name hz) (resid 43 and name hb2) 4.00 4.00 1.00 ! assign (resid 34 and name hb1) (resid 44 and name ha) 4.50 4.50 1.00 ! assign (resid 35 and name hn ) (resid 44 and name ha ) 4.00 4.00 1.00 ! assign (resid 35 and name hn ) (resid 43 and name ha ) 3.50 3.50 0.50 ! assign (resid 35 and name hn ) (resid 43 and name hb1 ) 4.00 4.00 1.00 ! assign (resid 35 and name hn ) (resid 43 and name hd1 ) 4.50 4.50 1.00 ! assign (resid 35 and name hn ) (resid 45 and name hn ) 4.00 4.00 1.00 ! assign (resid 35 and name hb2) (resid 45 and name hz ) 3.50 3.50 0.50 ! assign (resid 36 and name ha ) (resid 43 and name he3 ) 4.00 4.00 1.00 ! assign (resid 36 and name hb1) (resid 43 and name he3 ) 3.50 3.50 0.50 ! assign (resid 38 and name hn ) (resid 43 and name he1 ) 4.50 4.50 1.00 ! ! ! Long-range NOEs unambiguously absent from spectra ! assign (resid 5 and name hn ) (resid 50 and name hb ) 4.50 0.00 30.00 ! assign (resid 7 and name hn) (resid 48 and name ha) 4.50 0.00 30.00 ! assign (resid 17 and name hn ) (resid 44 and name hn ) 4.50 0.00 30.00 ! ! ! Medium-range NOEs ! assign (resid 6 and name ha ) (resid 8 and name hn ) 4.00 4.00 1.00 ! assign (resid 10 and name ha) (resid 12 and name hn) 4.50 4.50 1.00 ! assign (resid 10 and name hn ) (resid 13 and name hb2) 4.00 4.00 1.00 ! assign (resid 11 and name ha ) (resid 13 and name hn ) 4.50 4.50 1.00 ! assign (resid 11 and name ha ) (resid 14 and name hn ) 4.50 4.50 1.00 ! assign (resid 11 and name ha ) (resid 14 and name hd2) 2.70 2.70 0.50 ! assign (resid 11 and name ha ) (resid 14 and name he ) 4.00 4.00 1.00 ! assign (resid 12 and name hn ) (resid 14 and name hn ) 4.50 4.50 1.00 ! assign (resid 12 and name ha ) (resid 14 and name hn ) 4.50 4.50 1.00 ! assign (resid 16 and name hb2) (resid 18 and name hn ) 4.50 4.50 1.00 ! assign (resid 19 and name hn ) (resid 22 and name hn ) 4.00 4.00 1.00 ! assign (resid 19 and name hb1) (resid 22 and name hn ) 4.50 4.50 1.00 ! assign (resid 22 and name hb) (resid 27 and name hn ) 3.50 3.50 0.50 ! assign (resid 23 and name hn ) (resid 26 and name hn ) 4.00 4.00 1.00 ! assign (resid 23 and name hn ) (resid 26 and name hb2 ) 2.70 2.70 0.50 ! assign (resid 23 and name hn ) (resid 26 and name hb1 ) 3.50 3.50 0.50 ! assign (resid 23 and name hn ) (resid 27 and name hn ) 3.50 3.50 0.50 ! assign (resid 23 and name hn ) (resid 27 and name hb2) 4.00 4.00 1.00 ! assign (resid 23 and name hb ) (resid 25 and name hn ) 3.50 3.50 0.50 ! assign (resid 23 and name hb ) (resid 26 and name hn ) 4.00 4.00 1.00 ! assign (resid 23 and name hg1 ) (resid 26 and name hn ) 4.50 4.50 1.00 ! assign (resid 25 and name hn ) (resid 27 and name hn ) 4.00 4.00 1.00 ! assign (resid 25 and name hn ) (resid 28 and name hn ) 4.50 4.50 1.00 ! assign (resid 25 and name ha ) (resid 28 and name hn ) 3.50 3.50 0.50 ! assign (resid 25 and name ha ) (resid 29 and name hn ) 4.00 4.00 1.00 ! assign (resid 26 and name hn ) (resid 28 and name hn ) 4.50 4.50 1.00 ! assign (resid 26 and name hb1) (resid 28 and name hn ) 4.50 4.50 1.00 ! assign (resid 26 and name ha ) (resid 29 and name hn ) 3.50 3.50 0.50 ! assign (resid 26 and name ha ) (resid 30 and name hn ) 4.50 4.50 1.00 ! assign (resid 27 and name ha ) (resid 30 and name hn ) 4.00 4.00 1.00 ! assign (resid 27 and name ha ) (resid 31 and name hn ) 4.50 4.50 1.00 ! assign (resid 27 and name ha ) (resid 32 and name hn ) 4.00 4.00 1.00 ! assign (resid 27 and name hb1 ) (resid 29 and name hn ) 4.50 4.50 1.00 ! assign (resid 28 and name hn ) (resid 30 and name hn ) 4.50 4.50 1.00 ! assign (resid 28 and name ha ) (resid 30 and name hn ) 4.50 4.50 1.00 ! assign (resid 28 and name ha ) (resid 31 and name hn ) 3.50 3.50 0.50 ! assign (resid 28 and name ha ) (resid 32 and name hn ) 3.50 3.50 0.50 ! assign (resid 29 and name ha ) (resid 31 and name hn ) 4.00 4.00 1.00 ! assign (resid 29 and name hn ) (resid 31 and name hn ) 4.00 4.00 1.00 ! assign (resid 29 and name hn ) (resid 32 and name hn ) 4.00 4.00 1.00 ! assign (resid 30 and name hn ) (resid 32 and name hn ) 3.50 3.50 0.50 ! assign (resid 34 and name hz ) (resid 36 and name hb1) 3.50 3.50 0.50 ! assign (resid 34 and name hz ) (resid 36 and name hb2) 4.50 4.50 1.00 ! assign (resid 35 and name ha ) (resid 37 and name hn ) 4.00 4.00 1.00 ! assign (resid 36 and name ha ) (resid 38 and name hn ) 4.00 4.00 1.00 ! assign (resid 38 and name hb) (resid 41 and name hn ) 4.00 4.00 1.00 ! assign (resid 39 and name ha ) (resid 41 and name hn ) 3.50 3.50 0.50 ! assign (resid 39 and name ha ) (resid 43 and name he1 ) 2.70 2.70 0.50 ! assign (resid 39 and name ha ) (resid 43 and name hz2 ) 3.50 3.50 0.50 ! assign (resid 41 and name hn ) (resid 43 and name he1 ) 4.50 4.50 1.00 ! assign (resid 42 and name ha ) (resid 44 and name hn ) 4.00 4.00 1.00 ! assign (resid 42 and name hb2) (resid 45 and name ha ) 4.50 4.50 1.00 ! assign (resid 47 and name hb2 ) (resid 49 and name hn ) 4.50 4.50 1.00 ! ! ! Medium NOEs unambiguously absent from spectra ! assign (resid 7 and name ha) (resid 9 and name hn) 4.50 0.00 30.00 ! ! ! Sequential NOEs ! assign (resid 1 and name ha) (resid 2 and name hn) 3.50 3.50 0.50 ! assign (resid 2 and name ha ) (resid 3 and name hn ) 2.70 2.70 0.50 ! assign (resid 3 and name ha ) (resid 4 and name hn ) 2.70 2.70 0.50 ! assign (resid 3 and name hb1 ) (resid 4 and name hn ) 4.00 4.00 1.00 ! assign (resid 3 and name hb2 ) (resid 4 and name hn ) 4.00 4.00 1.00 ! assign (resid 4 and name hn) (resid 5 and name hn ) 4.00 4.00 1.00 ! assign (resid 4 and name hb ) (resid 5 and name hn ) 2.70 2.70 0.50 ! assign (resid 5 and name ha ) (resid 6 and name hn ) 2.70 2.70 0.50 ! assign (resid 5 and name hb2 ) (resid 6 and name hn ) 4.00 4.00 1.00 ! assign (resid 5 and name hb1 ) (resid 6 and name hn ) 3.50 3.50 0.50 ! assign (resid 5 and name hn ) (resid 6 and name hn ) 4.00 4.00 1.00 ! assign (resid 6 and name hn ) (resid 7 and name hn ) 4.00 4.00 1.00 ! assign (resid 6 and name ha ) (resid 7 and name hn ) 2.70 2.70 0.50 ! assign (resid 6 and name hb ) (resid 7 and name hn ) 4.00 4.00 1.00 ! assign (resid 7 and name ha ) (resid 8 and name hn ) 3.50 3.50 0.50 ! assign (resid 7 and name hn ) (resid 8 and name hn ) 3.50 3.50 0.50 ! assign (resid 7 and name hb2 ) (resid 8 and name hn ) 4.00 4.00 1.00 ! assign (resid 8 and name hn ) (resid 9 and name hn ) 4.00 4.00 1.00 ! assign (resid 8 and name ha ) (resid 9 and name hn ) 2.70 2.70 0.50 ! assign (resid 9 and name hn ) (resid 10 and name hn ) 4.50 4.50 1.00 ! assign (resid 9 and name ha) (resid 10 and name hn ) 2.30 2.30 0.50 ! assign (resid 9 and name hb ) (resid 10 and name hn ) 4.00 4.00 1.00 ! assign (resid 10 and name ha) (resid 11 and name ha) 4.00 4.00 1.00 ! assign (resid 11 and name ha ) (resid 12 and name hn ) 4.00 4.00 1.00 ! assign (resid 12 and name hn ) (resid 13 and name hn ) 2.70 2.70 0.50 ! assign (resid 12 and name ha ) (resid 13 and name hn ) 3.50 3.50 0.50 ! assign (resid 13 and name hn ) (resid 14 and name hb2 ) 4.50 4.50 1.00 ! assign (resid 13 and name hn ) (resid 14 and name hn ) 2.70 2.70 0.50 ! assign (resid 13 and name ha ) (resid 14 and name hn ) 3.50 3.50 0.50 ! assign (resid 13 and name hb2 ) (resid 14 and name hn ) 4.50 4.50 1.00 ! assign (resid 14 and name hn ) (resid 15 and name hn ) 4.50 4.50 1.00 ! assign (resid 14 and name ha ) (resid 15 and name hn ) 2.30 2.30 0.50 ! assign (resid 14 and name hb2 ) (resid 15 and name hn ) 4.00 4.00 1.00 ! assign (resid 14 and name hb1 ) (resid 15 and name hn ) 4.00 4.00 1.00 ! assign (resid 14 and name hg1 ) (resid 15 and name hn ) 4.50 4.50 1.00 ! assign (resid 15 and name ha ) (resid 16 and name hn ) 2.30 2.30 0.50 ! assign (resid 16 and name hn ) (resid 17 and name hn ) 4.50 4.50 1.00 ! assign (resid 16 and name ha) (resid 17 and name hn) 3.50 3.50 0.50 ! assign (resid 16 and name hb2) (resid 17 and name hn ) 4.50 4.50 1.00 ! assign (resid 17 and name hn ) (resid 18 and name hn ) 2.70 2.70 0.50 ! assign (resid 17 and name hb2 ) (resid 18 and name hn ) 4.00 4.00 1.00 ! assign (resid 18 and name hn ) (resid 19 and name hn ) 4.00 4.00 1.00 ! assign (resid 18 and name ha1) (resid 19 and name hn ) 2.70 2.70 0.50 ! assign (resid 19 and name hn ) (resid 20 and name hd1) 4.00 4.00 1.00 ! assign (resid 19 and name ha) (resid 20 and name ha ) 4.50 4.50 1.00 ! assign (resid 19 and name ha) (resid 20 and name hd1) 2.30 2.30 0.50 ! assign (resid 19 and name ha) (resid 20 and name hd2) 2.70 2.70 0.50 ! assign (resid 20 and name hb2 ) (resid 21 and name hn ) 4.50 4.50 1.00 ! assign (resid 20 and name hb1 ) (resid 21 and name hn ) 4.00 4.00 1.00 ! assign (resid 21 and name ha2 ) (resid 22 and name hn ) 4.00 4.00 1.00 ! assign (resid 21 and name ha1 ) (resid 22 and name hn ) 4.00 4.00 1.00 ! assign (resid 22 and name hn ) (resid 23 and name hn ) 4.00 4.00 1.00 ! assign (resid 22 and name ha ) (resid 23 and name hn ) 2.30 2.30 0.50 ! assign (resid 24 and name hd2) (resid 25 and name hn) 4.00 4.00 1.00 ! assign (resid 24 and name ha ) (resid 25 and name hn ) 4.00 4.00 1.00 ! assign (resid 25 and name hn ) (resid 26 and name hn ) 2.70 2.70 0.50 ! assign (resid 25 and name ha ) (resid 26 and name hn ) 4.00 4.00 1.00 ! assign (resid 26 and name hn ) (resid 27 and name hn ) 2.70 2.70 0.50 ! assign (resid 26 and name hn ) (resid 27 and name hb2 ) 4.50 4.50 1.00 ! assign (resid 26 and name ha ) (resid 27 and name hn ) 4.00 4.00 1.00 ! assign (resid 26 and name hb2 ) (resid 27 and name hn ) 3.50 3.50 0.50 ! assign (resid 26 and name hb1 ) (resid 27 and name hn ) 4.00 4.00 1.00 ! assign (resid 27 and name hn ) (resid 28 and name hn ) 2.70 2.70 0.50 ! assign (resid 27 and name ha ) (resid 28 and name hn ) 4.00 4.00 1.00 ! assign (resid 27 and name hb1 ) (resid 28 and name hn ) 3.50 3.50 0.50 ! assign (resid 27 and name hb2) (resid 28 and name hn ) 4.00 4.00 1.00 ! assign (resid 28 and name hn ) (resid 29 and name ha ) 4.50 4.50 1.00 ! assign (resid 28 and name ha ) (resid 29 and name hn ) 3.50 3.50 0.50 ! assign (resid 29 and name hn ) (resid 30 and name hn ) 2.70 2.70 0.50 ! assign (resid 29 and name ha ) (resid 30 and name hn ) 3.50 3.50 0.50 ! assign (resid 30 and name hn ) (resid 31 and name hn ) 2.70 2.70 0.50 ! assign (resid 30 and name hn ) (resid 31 and name ha2) 4.00 4.00 1.00 ! assign (resid 30 and name ha ) (resid 31 and name hn ) 3.50 3.50 0.50 ! assign (resid 31 and name hn ) (resid 32 and name hn ) 2.30 2.30 0.50 ! assign (resid 31 and name ha1 ) (resid 32 and name hn ) 3.50 3.50 0.50 ! assign (resid 31 and name ha2 ) (resid 32 and name hn ) 3.50 3.50 0.50 ! assign (resid 31 and name hn ) (resid 32 and name hb2 ) 4.50 4.50 1.00 ! assign (resid 32 and name hb2) (resid 33 and name hn ) 4.00 4.00 1.00 ! assign (resid 32 and name hn ) (resid 33 and name hn ) 4.00 4.00 1.00 ! assign (resid 32 and name ha ) (resid 33 and name hn ) 2.70 2.70 0.50 ! assign (resid 32 and name hb1 ) (resid 33 and name hn ) 2.70 2.70 0.50 ! assign (resid 33 and name ha ) (resid 34 and name hn ) 2.30 2.30 0.50 ! assign (resid 33 and name ha) (resid 34 and name ha) 4.50 4.50 1.00 ! assign (resid 33 and name hb2 ) (resid 34 and name hn ) 4.00 4.00 1.00 ! assign (resid 33 and name hb1 ) (resid 34 and name hn ) 3.50 3.50 0.50 ! assign (resid 34 and name hn ) (resid 35 and name hn ) 4.00 4.00 1.00 ! assign (resid 34 and name ha ) (resid 35 and name hn ) 2.30 2.30 0.50 ! assign (resid 34 and name ha) (resid 35 and name ha) 4.50 4.50 1.00 ! assign (resid 34 and name hb2 ) (resid 35 and name hn ) 4.00 4.00 1.00 ! assign (resid 34 and name hb1 ) (resid 35 and name hn ) 4.00 4.00 1.00 ! assign (resid 35 and name hn ) (resid 36 and name hn ) 4.00 4.00 1.00 ! assign (resid 35 and name ha ) (resid 36 and name hn ) 2.30 2.30 0.50 ! assign (resid 36 and name ha ) (resid 37 and name hn ) 3.50 3.50 0.50 ! assign (resid 37 and name hn ) (resid 38 and name hn ) 2.70 2.70 0.50 ! assign (resid 37 and name hn ) (resid 38 and name hb ) 4.50 4.50 1.00 ! assign (resid 37 and name ha ) (resid 38 and name hn ) 3.50 3.50 0.50 ! assign (resid 38 and name hn ) (resid 39 and name hn ) 4.50 4.50 1.00 ! assign (resid 38 and name ha ) (resid 39 and name hn ) 2.30 2.30 0.50 ! assign (resid 39 and name ha ) (resid 40 and name hn ) 2.70 2.70 0.50 ! assign (resid 40 and name hn ) (resid 41 and name hn ) 3.50 3.50 0.50 ! assign (resid 41 and name ha) (resid 42 and name ha ) 4.00 4.00 1.00 ! assign (resid 41 and name hn ) (resid 42 and name hd2 ) 4.50 4.50 1.00 ! assign (resid 41 and name ha) (resid 42 and name hd1) 2.30 2.30 0.50 ! assign (resid 41 and name ha) (resid 42 and name hd2) 3.50 3.50 0.50 ! assign (resid 42 and name ha ) (resid 43 and name hn ) 2.70 2.70 0.50 ! assign (resid 42 and name hb2 ) (resid 43 and name hn ) 4.00 4.00 1.00 ! assign (resid 43 and name hn ) (resid 44 and name hn ) 3.50 3.50 0.50 ! assign (resid 43 and name ha ) (resid 44 and name hn ) 3.50 3.50 0.50 ! assign (resid 43 and name hn ) (resid 44 and name ha ) 4.50 4.50 1.00 ! assign (resid 43 and name hn ) (resid 44 and name hb1) 4.50 4.50 1.00 ! assign (resid 43 and name hb1 ) (resid 44 and name hn ) 4.00 4.00 1.00 ! assign (resid 43 and name hd1 ) (resid 44 and name hn ) 4.50 4.50 1.00 ! assign (resid 44 and name hn ) (resid 45 and name hn ) 4.00 4.00 1.00 ! assign (resid 44 and name ha ) (resid 45 and name hn ) 2.30 2.30 0.50 ! assign (resid 44 and name ha ) (resid 45 and name ha ) 4.00 4.00 1.00 ! assign (resid 44 and name hb1 ) (resid 45 and name hn ) 4.00 4.00 1.00 ! assign (resid 45 and name hn ) (resid 46 and name hn ) 4.50 4.50 1.00 ! assign (resid 46 and name ha ) (resid 47 and name hd2 ) 3.50 3.50 0.50 ! assign (resid 46 and name ha ) (resid 47 and name hd1 ) 2.70 2.70 0.50 ! assign (resid 47 and name ha ) (resid 48 and name hn ) 2.30 2.30 0.50 ! assign (resid 47 and name hb2 ) (resid 48 and name hn ) 2.70 2.70 0.50 ! assign (resid 47 and name hb1 ) (resid 48 and name hn ) 3.50 3.50 0.50 ! assign (resid 47 and name hb2 ) (resid 48 and name ha ) 4.00 4.00 1.00 ! assign (resid 48 and name hn ) (resid 49 and name hn ) 3.50 3.50 0.50 ! assign (resid 48 and name ha ) (resid 49 and name hn ) 2.30 2.30 0.50 ! assign (resid 48 and name ha ) (resid 49 and name ha ) 4.50 4.50 1.00 ! assign (resid 49 and name ha ) (resid 50 and name hn ) 2.30 2.30 0.50 ! assign (resid 50 and name ha ) (resid 51 and name hn ) 2.30 2.30 0.50 ! assign (resid 50 and name hg11 ) (resid 51 and name hn ) 4.50 4.50 1.00 ! assign (resid 50 and name hg12 ) (resid 51 and name hn ) 4.50 4.50 1.00 ! assign (resid 50 and name hb ) (resid 51 and name hn ) 3.50 3.50 0.50 ! assign (resid 51 and name ha ) (resid 52 and name hn ) 2.70 2.70 0.50 ! assign (resid 51 and name hb2 ) (resid 52 and name hn ) 4.00 4.00 1.00 ! assign (resid 56 and name ha ) (resid 57 and name hn ) 2.70 2.70 0.50 ! assign (resid 59 and name hn ) (resid 60 and name hn ) 4.50 4.50 1.00 ! assign (resid 59 and name ha ) (resid 60 and name hn ) 2.70 2.70 0.50 ! ! !Sequential NOEs unambiguously absent from spectra ! assign (resid 8 and name hn) (resid 9 and name ha) 4.50 0.00 30.00 ! assign (resid 19 and name hb1 ) (resid 21 and name hn ) 4.50 0.00 30.00 ! ! !Intraresidue NOEs ! assign (resid 3 and name hn ) (resid 3 and name hb1 ) 3.50 3.50 0.50 ! assign (resid 3 and name hn ) (resid 3 and name hb2 ) 2.70 2.70 0.50 ! assign (resid 4 and name hn ) (resid 4 and name hb ) 3.50 3.50 0.50 ! assign (resid 5 and name hn ) (resid 5 and name hb2 ) 3.50 3.50 0.50 ! assign (resid 5 and name hn ) (resid 5 and name hb1 ) 4.00 4.00 1.00 ! assign (resid 5 and name hn ) (resid 5 and name hg1 ) 4.00 4.00 1.00 ! assign (resid 6 and name hn ) (resid 6 and name hb ) 3.50 3.50 0.50 ! assign (resid 7 and name hn ) (resid 7 and name hb1 ) 4.00 4.00 1.00 ! assign (resid 9 and name hn ) (resid 9 and name hb ) 2.70 2.70 0.50 ! assign (resid 10 and name hn ) (resid 10 and name ha ) 2.70 2.70 0.50 ! assign (resid 12 and name hn ) (resid 12 and name hb2 ) 3.50 3.50 0.50 ! assign (resid 12 and name hn ) (resid 12 and name hb1 ) 3.50 3.50 0.50 ! assign (resid 13 and name hn ) (resid 13 and name hb1 ) 4.00 4.00 1.00 ! assign (resid 13 and name hn ) (resid 13 and name hb2 ) 2.70 2.70 0.50 ! assign (resid 14 and name hn ) (resid 14 and name ha ) 2.70 2.70 0.50 ! assign (resid 14 and name hn ) (resid 14 and name hb2 ) 2.70 2.70 0.50 ! assign (resid 14 and name hn ) (resid 14 and name hb1 ) 4.00 4.00 1.00 ! assign (resid 14 and name hn ) (resid 14 and name hg2 ) 4.00 4.00 1.00 ! assign (resid 14 and name hn ) (resid 14 and name hg1 ) 3.50 3.50 0.50 ! assign (resid 14 and name hn ) (resid 14 and name hd2 ) 4.50 4.50 1.00 ! assign (resid 15 and name he22 ) (resid 15 and name hg1 ) 4.50 4.50 1.00 ! assign (resid 15 and name he21 ) (resid 15 and name hg2 ) 4.50 4.50 1.00 ! assign (resid 15 and name he21 ) (resid 15 and name hg1 ) 4.50 4.50 1.00 ! assign (resid 15 and name he22 ) (resid 15 and name hg2 ) 4.50 4.50 1.00 ! assign (resid 16 and name hn ) (resid 16 and name hb1 ) 2.70 2.70 0.50 ! assign (resid 16 and name hn ) (resid 16 and name hb2 ) 2.30 2.30 0.50 ! assign (resid 17 and name hn ) (resid 17 and name hb1) 2.30 2.30 0.50 ! assign (resid 17 and name hn ) (resid 17 and name hb2) 4.00 4.00 1.00 ! assign (resid 19 and name hn ) (resid 19 and name hb2 ) 4.00 4.00 1.00 ! assign (resid 21 and name hn ) (resid 21 and name ha1 ) 2.30 2.30 0.50 ! assign (resid 23 and name hn ) (resid 23 and name hb ) 4.00 4.00 1.00 ! assign (resid 26 and name hn ) (resid 26 and name hb2 ) 2.70 2.70 0.50 ! assign (resid 26 and name hn ) (resid 26 and name hb1 ) 4.00 4.00 1.00 ! assign (resid 27 and name hn ) (resid 27 and name ha ) 2.70 2.70 0.50 ! assign (resid 27 and name hn ) (resid 27 and name hb2 ) 2.70 2.70 0.50 ! assign (resid 27 and name hn ) (resid 27 and name hb1 ) 2.70 2.70 0.50 ! assign (resid 32 and name hn ) (resid 32 and name hb1 ) 4.00 4.00 1.00 ! assign (resid 32 and name hn ) (resid 32 and name hb2) 3.50 3.50 0.50 ! assign (resid 33 and name hn ) (resid 33 and name hb2 ) 2.70 2.70 0.50 ! assign (resid 33 and name hn ) (resid 33 and name hb1 ) 4.00 4.00 1.00 ! assign (resid 34 and name hn ) (resid 34 and name hb2 ) 2.70 2.70 0.50 ! assign (resid 34 and name hn ) (resid 34 and name hb1 ) 2.70 2.70 0.50 ! assign (resid 35 and name hn ) (resid 35 and name hb2 ) 3.50 3.50 0.50 ! assign (resid 35 and name hn ) (resid 35 and name hb1 ) 4.50 4.50 1.00 ! assign (resid 36 and name hn ) (resid 36 and name hb2 ) 4.00 4.00 1.00 ! assign (resid 36 and name hn ) (resid 36 and name hb1 ) 4.00 4.00 1.00 ! assign (resid 37 and name hn ) (resid 37 and name hb ) 3.50 3.50 0.50 ! assign (resid 38 and name hn ) (resid 38 and name hb ) 2.70 2.70 0.50 ! assign (resid 41 and name hn ) (resid 41 and name hb ) 3.50 3.50 0.50 ! assign (resid 43 and name hn ) (resid 43 and name ha ) 2.70 2.70 0.50 ! assign (resid 43 and name hn ) (resid 43 and name hb2 ) 3.50 3.50 0.50 ! assign (resid 43 and name hn ) (resid 43 and name hb1 ) 4.00 4.00 1.00 ! assign (resid 43 and name hn ) (resid 43 and name hd1 ) 3.50 3.50 0.50 ! assign (resid 43 and name he1 ) (resid 43 and name hb1 ) 4.50 4.50 1.00 ! assign (resid 43 and name hd1) (resid 43 and name hb2 ) 3.50 3.50 0.50 ! assign (resid 43 and name hd1) (resid 43 and name hb1 ) 3.50 3.50 0.50 ! assign (resid 43 and name he3) (resid 43 and name ha ) 4.50 4.50 1.00 ! assign (resid 43 and name he3) (resid 43 and name hb2 ) 4.00 4.00 1.00 ! assign (resid 43 and name he3) (resid 43 and name hb1 ) 4.00 4.00 1.00 ! assign (resid 44 and name hn ) (resid 44 and name hb2 ) 3.50 3.50 0.50 ! assign (resid 44 and name hn ) (resid 44 and name hb1 ) 2.70 2.70 0.50 ! assign (resid 45 and name hn ) (resid 45 and name hb2 ) 3.50 3.50 0.50 ! assign (resid 46 and name hn ) (resid 46 and name hb2 ) 2.70 2.70 0.50 ! assign (resid 46 and name hn ) (resid 46 and name hb1 ) 4.00 4.00 1.00 ! assign (resid 49 and name hn ) (resid 49 and name hb ) 4.00 4.00 1.00 ! assign (resid 50 and name hn ) (resid 50 and name hb ) 2.70 2.70 0.50 ! assign (resid 50 and name hn ) (resid 50 and name hg11 ) 3.50 3.50 0.50 ! assign (resid 50 and name hn ) (resid 50 and name hg12 ) 4.00 4.00 1.00 ! assign (resid 51 and name hn ) (resid 51 and name hb2 ) 3.50 3.50 0.50 ! assign (resid 52 and name hn ) (resid 52 and name ha ) 2.70 2.70 0.50 ! assign (resid 52 and name hn ) (resid 52 and name hb ) 3.50 3.50 0.50 ! assign (resid 55 and name hn ) (resid 55 and name ha ) 2.70 2.70 0.50 ! assign (resid 56 and name hn ) (resid 56 and name ha ) 2.70 2.70 0.50 ! assign (resid 57 and name hn ) (resid 57 and name ha ) 2.70 2.70 0.50 !
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