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 |
|
|
143978 |
2kko   |
16368 | cing | 1-original | 2 | XPLOR/CNS | distance | hydrogen bond | simple |
! Hydrogen Bond restraints used in refinement ! Restraint range is HN-O 1.7-2.3 Ang, N-O 2.5-3.3 Ang assign (segid A and resid 11 and name HN )(segid A and resid 8 and name O ) 1.7 0.0 0.6 assign (segid A and resid 11 and name N )(segid A and resid 8 and name O ) 2.5 0.0 0.8 assign (segid A and resid 14 and name HN )(segid A and resid 10 and name O ) 1.7 0.0 0.6 assign (segid A and resid 14 and name N )(segid A and resid 10 and name O ) 2.5 0.0 0.8 assign (segid A and resid 15 and name HN )(segid A and resid 11 and name O ) 1.7 0.0 0.6 assign (segid A and resid 15 and name N )(segid A and resid 11 and name O ) 2.5 0.0 0.8 assign (segid A and resid 16 and name HN )(segid A and resid 12 and name O ) 1.7 0.0 0.6 assign (segid A and resid 16 and name N )(segid A and resid 12 and name O ) 2.5 0.0 0.8 assign (segid A and resid 17 and name HN )(segid A and resid 13 and name O ) 1.7 0.0 0.6 assign (segid A and resid 17 and name N )(segid A and resid 13 and name O ) 2.5 0.0 0.8 assign (segid A and resid 18 and name HN )(segid A and resid 14 and name O ) 1.7 0.0 0.6 assign (segid A and resid 18 and name N )(segid A and resid 14 and name O ) 2.5 0.0 0.8 assign (segid A and resid 19 and name HN )(segid A and resid 15 and name O ) 1.7 0.0 0.6 assign (segid A and resid 19 and name N )(segid A and resid 15 and name O ) 2.5 0.0 0.8 assign (segid A and resid 20 and name HN )(segid A and resid 16 and name O ) 1.7 0.0 0.6 assign (segid A and resid 20 and name N )(segid A and resid 16 and name O ) 2.5 0.0 0.8 assign (segid A and resid 21 and name HN )(segid A and resid 17 and name O ) 1.7 0.0 0.6 assign (segid A and resid 21 and name N )(segid A and resid 17 and name O ) 2.5 0.0 0.8 assign (segid A and resid 22 and name HN )(segid A and resid 18 and name O ) 1.7 0.0 0.6 assign (segid A and resid 22 and name N )(segid A and resid 18 and name O ) 2.5 0.0 0.8 assign (segid A and resid 32 and name HN )(segid A and resid 28 and name O ) 1.7 0.0 0.6 assign (segid A and resid 32 and name N )(segid A and resid 28 and name O ) 2.5 0.0 0.8 assign (segid A and resid 33 and name HN )(segid A and resid 29 and name O ) 1.7 0.0 0.6 assign (segid A and resid 33 and name N )(segid A and resid 29 and name O ) 2.5 0.0 0.8 assign (segid A and resid 34 and name HN )(segid A and resid 30 and name O ) 1.7 0.0 0.6 assign (segid A and resid 34 and name N )(segid A and resid 30 and name O ) 2.5 0.0 0.8 assign (segid A and resid 35 and name HN )(segid A and resid 31 and name O ) 1.7 0.0 0.6 assign (segid A and resid 35 and name N )(segid A and resid 31 and name O ) 2.5 0.0 0.8 assign (segid A and resid 39 and name HN )(segid A and resid 79 and name O ) 1.7 0.0 0.6 assign (segid A and resid 39 and name N )(segid A and resid 79 and name O ) 2.5 0.0 0.8 assign (segid A and resid 41 and name HN )(segid A and resid 77 and name O ) 1.7 0.0 0.6 assign (segid A and resid 41 and name N )(segid A and resid 77 and name O ) 2.5 0.0 0.8 assign (segid A and resid 44 and name HN )(segid A and resid 40 and name O ) 1.7 0.0 0.6 assign (segid A and resid 44 and name N )(segid A and resid 40 and name O ) 2.5 0.0 0.8 assign (segid A and resid 45 and name HN )(segid A and resid 41 and name O ) 1.7 0.0 0.6 assign (segid A and resid 45 and name N )(segid A and resid 41 and name O ) 2.5 0.0 0.8 assign (segid A and resid 46 and name HN )(segid A and resid 42 and name O ) 1.7 0.0 0.6 assign (segid A and resid 46 and name N )(segid A and resid 42 and name O ) 2.5 0.0 0.8 assign (segid A and resid 47 and name HN )(segid A and resid 43 and name O ) 1.7 0.0 0.6 assign (segid A and resid 47 and name N )(segid A and resid 43 and name O ) 2.5 0.0 0.8 assign (segid A and resid 48 and name HN )(segid A and resid 44 and name O ) 1.7 0.0 0.6 assign (segid A and resid 48 and name N )(segid A and resid 44 and name O ) 2.5 0.0 0.8 assign (segid A and resid 49 and name HN )(segid A and resid 46 and name O ) 1.7 0.0 0.6 assign (segid A and resid 49 and name N )(segid A and resid 46 and name O ) 2.5 0.0 0.8 assign (segid A and resid 50 and name HN )(segid A and resid 45 and name O ) 1.7 0.0 0.6 assign (segid A and resid 50 and name N )(segid A and resid 45 and name O ) 2.5 0.0 0.8 assign (segid A and resid 55 and name HN )(segid A and resid 51 and name O ) 1.7 0.0 0.6 assign (segid A and resid 55 and name N )(segid A and resid 51 and name O ) 2.5 0.0 0.8 assign (segid A and resid 56 and name HN )(segid A and resid 52 and name O ) 1.7 0.0 0.6 assign (segid A and resid 56 and name N )(segid A and resid 52 and name O ) 2.5 0.0 0.8 assign (segid A and resid 57 and name HN )(segid A and resid 53 and name O ) 1.7 0.0 0.6 assign (segid A and resid 57 and name N )(segid A and resid 53 and name O ) 2.5 0.0 0.8 assign (segid A and resid 58 and name HN )(segid A and resid 54 and name O ) 1.7 0.0 0.6 assign (segid A and resid 58 and name N )(segid A and resid 54 and name O ) 2.5 0.0 0.8 assign (segid A and resid 59 and name HN )(segid A and resid 55 and name O ) 1.7 0.0 0.6 assign (segid A and resid 59 and name N )(segid A and resid 55 and name O ) 2.5 0.0 0.8 assign (segid A and resid 60 and name HN )(segid A and resid 56 and name O ) 1.7 0.0 0.6 assign (segid A and resid 60 and name N )(segid A and resid 56 and name O ) 2.5 0.0 0.8 assign (segid A and resid 61 and name HN )(segid A and resid 57 and name O ) 1.7 0.0 0.6 assign (segid A and resid 61 and name N )(segid A and resid 57 and name O ) 2.5 0.0 0.8 assign (segid A and resid 62 and name HN )(segid A and resid 58 and name O ) 1.7 0.0 0.6 assign (segid A and resid 62 and name N )(segid A and resid 58 and name O ) 2.5 0.0 0.8 assign (segid A and resid 63 and name HN )(segid A and resid 59 and name O ) 1.7 0.0 0.6 assign (segid A and resid 63 and name N )(segid A and resid 59 and name O ) 2.5 0.0 0.8 assign (segid A and resid 64 and name HN )(segid A and resid 60 and name O ) 1.7 0.0 0.6 assign (segid A and resid 64 and name N )(segid A and resid 60 and name O ) 2.5 0.0 0.8 assign (segid A and resid 65 and name HN )(segid A and resid 61 and name O ) 1.7 0.0 0.6 assign (segid A and resid 65 and name N )(segid A and resid 61 and name O ) 2.5 0.0 0.8 assign (segid A and resid 66 and name HN )(segid A and resid 63 and name O ) 1.7 0.0 0.6 assign (segid A and resid 66 and name N )(segid A and resid 63 and name O ) 2.5 0.0 0.8 assign (segid A and resid 67 and name HN )(segid A and resid 62 and name O ) 1.7 0.0 0.6 assign (segid A and resid 67 and name N )(segid A and resid 62 and name O ) 2.5 0.0 0.8 assign (segid A and resid 69 and name HN )(segid A and resid 80 and name O ) 1.6 0.0 0.6 assign (segid A and resid 69 and name N )(segid A and resid 80 and name O ) 2.5 0.0 0.8 assign (segid A and resid 71 and name HN )(segid A and resid 78 and name O ) 1.7 0.0 0.6 assign (segid A and resid 71 and name N )(segid A and resid 78 and name O ) 2.5 0.0 0.8 assign (segid A and resid 73 and name HN )(segid A and resid 76 and name O ) 1.7 0.0 0.6 assign (segid A and resid 73 and name N )(segid A and resid 76 and name O ) 2.5 0.0 0.8 assign (segid A and resid 76 and name HN )(segid A and resid 73 and name O ) 1.7 0.0 0.6 assign (segid A and resid 76 and name N )(segid A and resid 73 and name O ) 2.5 0.0 0.8 assign (segid A and resid 78 and name HN )(segid A and resid 71 and name O ) 1.7 0.0 0.6 assign (segid A and resid 78 and name N )(segid A and resid 71 and name O ) 2.5 0.0 0.8 assign (segid A and resid 79 and name HN )(segid A and resid 39 and name O ) 1.7 0.0 0.6 assign (segid A and resid 79 and name N )(segid A and resid 39 and name O ) 2.5 0.0 0.8 assign (segid A and resid 80 and name HN )(segid A and resid 69 and name O ) 1.7 0.0 0.6 assign (segid A and resid 80 and name N )(segid A and resid 69 and name O ) 2.5 0.0 0.8 assign (segid A and resid 82 and name HN )(segid A and resid 67 and name O ) 1.7 0.0 0.6 assign (segid A and resid 82 and name N )(segid A and resid 67 and name O ) 2.5 0.0 0.8 assign (segid A and resid 87 and name HN )(segid A and resid 83 and name O ) 1.7 0.0 0.6 assign (segid A and resid 87 and name N )(segid A and resid 83 and name O ) 2.5 0.0 0.8 assign (segid A and resid 88 and name HN )(segid A and resid 84 and name O ) 1.7 0.0 0.6 assign (segid A and resid 88 and name N )(segid A and resid 84 and name O ) 2.5 0.0 0.8 assign (segid A and resid 89 and name HN )(segid A and resid 85 and name O ) 1.7 0.0 0.6 assign (segid A and resid 89 and name N )(segid A and resid 85 and name O ) 2.5 0.0 0.8 assign (segid A and resid 90 and name HN )(segid A and resid 86 and name O ) 1.7 0.0 0.6 assign (segid A and resid 90 and name N )(segid A and resid 86 and name O ) 2.5 0.0 0.8 assign (segid A and resid 91 and name HN )(segid A and resid 87 and name O ) 1.7 0.0 0.6 assign (segid A and resid 91 and name N )(segid A and resid 87 and name O ) 2.5 0.0 0.8 assign (segid A and resid 92 and name HN )(segid A and resid 88 and name O ) 1.7 0.0 0.6 assign (segid A and resid 92 and name N )(segid A and resid 88 and name O ) 2.5 0.0 0.8 assign (segid A and resid 93 and name HN )(segid A and resid 89 and name O ) 1.7 0.0 0.6 assign (segid A and resid 93 and name N )(segid A and resid 89 and name O ) 2.5 0.0 0.8 assign (segid A and resid 94 and name HN )(segid A and resid 90 and name O ) 1.7 0.0 0.6 assign (segid A and resid 94 and name N )(segid A and resid 90 and name O ) 2.5 0.0 0.8 assign (segid A and resid 95 and name HN )(segid A and resid 91 and name O ) 1.7 0.0 0.6 assign (segid A and resid 95 and name N )(segid A and resid 91 and name O ) 2.5 0.0 0.8 assign (segid A and resid 96 and name HN )(segid A and resid 92 and name O ) 1.7 0.0 0.6 assign (segid A and resid 96 and name N )(segid A and resid 92 and name O ) 2.5 0.0 0.8 assign (segid A and resid 97 and name HN )(segid A and resid 93 and name O ) 1.7 0.0 0.6 assign (segid A and resid 97 and name N )(segid A and resid 93 and name O ) 2.5 0.0 0.8 assign (segid A and resid 98 and name HN )(segid A and resid 94 and name O ) 1.7 0.0 0.6 assign (segid A and resid 98 and name N )(segid A and resid 94 and name O ) 2.5 0.0 0.8 assign (segid A and resid 99 and name HN )(segid A and resid 95 and name O ) 1.7 0.0 0.6 assign (segid A and resid 99 and name N )(segid A and resid 95 and name O ) 2.5 0.0 0.8 assign (segid B and resid 11 and name HN )(segid B and resid 8 and name O ) 1.7 0.0 0.6 assign (segid B and resid 11 and name N )(segid B and resid 8 and name O ) 2.5 0.0 0.8 assign (segid B and resid 14 and name HN )(segid B and resid 10 and name O ) 1.7 0.0 0.6 assign (segid B and resid 14 and name N )(segid B and resid 10 and name O ) 2.5 0.0 0.8 assign (segid B and resid 15 and name HN )(segid B and resid 11 and name O ) 1.7 0.0 0.6 assign (segid B and resid 15 and name N )(segid B and resid 11 and name O ) 2.5 0.0 0.8 assign (segid B and resid 16 and name HN )(segid B and resid 12 and name O ) 1.7 0.0 0.6 assign (segid B and resid 16 and name N )(segid B and resid 12 and name O ) 2.5 0.0 0.8 assign (segid B and resid 17 and name HN )(segid B and resid 13 and name O ) 1.7 0.0 0.6 assign (segid B and resid 17 and name N )(segid B and resid 13 and name O ) 2.5 0.0 0.8 assign (segid B and resid 18 and name HN )(segid B and resid 14 and name O ) 1.7 0.0 0.6 assign (segid B and resid 18 and name N )(segid B and resid 14 and name O ) 2.5 0.0 0.8 assign (segid B and resid 19 and name HN )(segid B and resid 15 and name O ) 1.7 0.0 0.6 assign (segid B and resid 19 and name N )(segid B and resid 15 and name O ) 2.5 0.0 0.8 assign (segid B and resid 20 and name HN )(segid B and resid 16 and name O ) 1.7 0.0 0.6 assign (segid B and resid 20 and name N )(segid B and resid 16 and name O ) 2.5 0.0 0.8 assign (segid B and resid 21 and name HN )(segid B and resid 17 and name O ) 1.7 0.0 0.6 assign (segid B and resid 21 and name N )(segid B and resid 17 and name O ) 2.5 0.0 0.8 assign (segid B and resid 22 and name HN )(segid B and resid 18 and name O ) 1.7 0.0 0.6 assign (segid B and resid 22 and name N )(segid B and resid 18 and name O ) 2.5 0.0 0.8 assign (segid B and resid 32 and name HN )(segid B and resid 28 and name O ) 1.7 0.0 0.6 assign (segid B and resid 32 and name N )(segid B and resid 28 and name O ) 2.5 0.0 0.8 assign (segid B and resid 33 and name HN )(segid B and resid 29 and name O ) 1.7 0.0 0.6 assign (segid B and resid 33 and name N )(segid B and resid 29 and name O ) 2.5 0.0 0.8 assign (segid B and resid 34 and name HN )(segid B and resid 30 and name O ) 1.7 0.0 0.6 assign (segid B and resid 34 and name N )(segid B and resid 30 and name O ) 2.5 0.0 0.8 assign (segid B and resid 35 and name HN )(segid B and resid 31 and name O ) 1.7 0.0 0.6 assign (segid B and resid 35 and name N )(segid B and resid 31 and name O ) 2.5 0.0 0.8 assign (segid B and resid 39 and name HN )(segid B and resid 79 and name O ) 1.7 0.0 0.6 assign (segid B and resid 39 and name N )(segid B and resid 79 and name O ) 2.5 0.0 0.8 assign (segid B and resid 41 and name HN )(segid B and resid 77 and name O ) 1.7 0.0 0.6 assign (segid B and resid 41 and name N )(segid B and resid 77 and name O ) 2.5 0.0 0.8 assign (segid B and resid 44 and name HN )(segid B and resid 40 and name O ) 1.7 0.0 0.6 assign (segid B and resid 44 and name N )(segid B and resid 40 and name O ) 2.5 0.0 0.8 assign (segid B and resid 45 and name HN )(segid B and resid 41 and name O ) 1.7 0.0 0.6 assign (segid B and resid 45 and name N )(segid B and resid 41 and name O ) 2.5 0.0 0.8 assign (segid B and resid 46 and name HN )(segid B and resid 42 and name O ) 1.7 0.0 0.6 assign (segid B and resid 46 and name N )(segid B and resid 42 and name O ) 2.5 0.0 0.8 assign (segid B and resid 47 and name HN )(segid B and resid 43 and name O ) 1.7 0.0 0.6 assign (segid B and resid 47 and name N )(segid B and resid 43 and name O ) 2.5 0.0 0.8 assign (segid B and resid 48 and name HN )(segid B and resid 44 and name O ) 1.7 0.0 0.6 assign (segid B and resid 48 and name N )(segid B and resid 44 and name O ) 2.5 0.0 0.8 assign (segid B and resid 49 and name HN )(segid B and resid 46 and name O ) 1.7 0.0 0.6 assign (segid B and resid 49 and name N )(segid B and resid 46 and name O ) 2.5 0.0 0.8 assign (segid B and resid 50 and name HN )(segid B and resid 45 and name O ) 1.7 0.0 0.6 assign (segid B and resid 50 and name N )(segid B and resid 45 and name O ) 2.5 0.0 0.8 assign (segid B and resid 55 and name HN )(segid B and resid 51 and name O ) 1.7 0.0 0.6 assign (segid B and resid 55 and name N )(segid B and resid 51 and name O ) 2.5 0.0 0.8 assign (segid B and resid 56 and name HN )(segid B and resid 52 and name O ) 1.7 0.0 0.6 assign (segid B and resid 56 and name N )(segid B and resid 52 and name O ) 2.5 0.0 0.8 assign (segid B and resid 57 and name HN )(segid B and resid 53 and name O ) 1.7 0.0 0.6 assign (segid B and resid 57 and name N )(segid B and resid 53 and name O ) 2.5 0.0 0.8 assign (segid B and resid 58 and name HN )(segid B and resid 54 and name O ) 1.7 0.0 0.6 assign (segid B and resid 58 and name N )(segid B and resid 54 and name O ) 2.5 0.0 0.8 assign (segid B and resid 59 and name HN )(segid B and resid 55 and name O ) 1.7 0.0 0.6 assign (segid B and resid 59 and name N )(segid B and resid 55 and name O ) 2.5 0.0 0.8 assign (segid B and resid 60 and name HN )(segid B and resid 56 and name O ) 1.7 0.0 0.6 assign (segid B and resid 60 and name N )(segid B and resid 56 and name O ) 2.5 0.0 0.8 assign (segid B and resid 61 and name HN )(segid B and resid 57 and name O ) 1.7 0.0 0.6 assign (segid B and resid 61 and name N )(segid B and resid 57 and name O ) 2.5 0.0 0.8 assign (segid B and resid 62 and name HN )(segid B and resid 58 and name O ) 1.7 0.0 0.6 assign (segid B and resid 62 and name N )(segid B and resid 58 and name O ) 2.5 0.0 0.8 assign (segid B and resid 63 and name HN )(segid B and resid 59 and name O ) 1.7 0.0 0.6 assign (segid B and resid 63 and name N )(segid B and resid 59 and name O ) 2.5 0.0 0.8 assign (segid B and resid 64 and name HN )(segid B and resid 60 and name O ) 1.7 0.0 0.6 assign (segid B and resid 64 and name N )(segid B and resid 60 and name O ) 2.5 0.0 0.8 assign (segid B and resid 65 and name HN )(segid B and resid 61 and name O ) 1.7 0.0 0.6 assign (segid B and resid 65 and name N )(segid B and resid 61 and name O ) 2.5 0.0 0.8 assign (segid B and resid 66 and name HN )(segid B and resid 63 and name O ) 1.7 0.0 0.6 assign (segid B and resid 66 and name N )(segid B and resid 63 and name O ) 2.5 0.0 0.8 assign (segid B and resid 67 and name HN )(segid B and resid 62 and name O ) 1.7 0.0 0.6 assign (segid B and resid 67 and name N )(segid B and resid 62 and name O ) 2.5 0.0 0.8 assign (segid B and resid 69 and name HN )(segid B and resid 80 and name O ) 1.6 0.0 0.6 assign (segid B and resid 69 and name N )(segid B and resid 80 and name O ) 2.5 0.0 0.8 assign (segid B and resid 71 and name HN )(segid B and resid 78 and name O ) 1.7 0.0 0.6 assign (segid B and resid 71 and name N )(segid B and resid 78 and name O ) 2.5 0.0 0.8 assign (segid B and resid 73 and name HN )(segid B and resid 76 and name O ) 1.7 0.0 0.6 assign (segid B and resid 73 and name N )(segid B and resid 76 and name O ) 2.5 0.0 0.8 assign (segid B and resid 76 and name HN )(segid B and resid 73 and name O ) 1.7 0.0 0.6 assign (segid B and resid 76 and name N )(segid B and resid 73 and name O ) 2.5 0.0 0.8 assign (segid B and resid 78 and name HN )(segid B and resid 71 and name O ) 1.7 0.0 0.6 assign (segid B and resid 78 and name N )(segid B and resid 71 and name O ) 2.5 0.0 0.8 assign (segid B and resid 79 and name HN )(segid B and resid 39 and name O ) 1.7 0.0 0.6 assign (segid B and resid 79 and name N )(segid B and resid 39 and name O ) 2.5 0.0 0.8 assign (segid B and resid 80 and name HN )(segid B and resid 69 and name O ) 1.7 0.0 0.6 assign (segid B and resid 80 and name N )(segid B and resid 69 and name O ) 2.5 0.0 0.8 assign (segid B and resid 82 and name HN )(segid B and resid 67 and name O ) 1.7 0.0 0.6 assign (segid B and resid 82 and name N )(segid B and resid 67 and name O ) 2.5 0.0 0.8 assign (segid B and resid 87 and name HN )(segid B and resid 83 and name O ) 1.7 0.0 0.6 assign (segid B and resid 87 and name N )(segid B and resid 83 and name O ) 2.5 0.0 0.8 assign (segid B and resid 88 and name HN )(segid B and resid 84 and name O ) 1.7 0.0 0.6 assign (segid B and resid 88 and name N )(segid B and resid 84 and name O ) 2.5 0.0 0.8 assign (segid B and resid 89 and name HN )(segid B and resid 85 and name O ) 1.7 0.0 0.6 assign (segid B and resid 89 and name N )(segid B and resid 85 and name O ) 2.5 0.0 0.8 assign (segid B and resid 90 and name HN )(segid B and resid 86 and name O ) 1.7 0.0 0.6 assign (segid B and resid 90 and name N )(segid B and resid 86 and name O ) 2.5 0.0 0.8 assign (segid B and resid 91 and name HN )(segid B and resid 87 and name O ) 1.7 0.0 0.6 assign (segid B and resid 91 and name N )(segid B and resid 87 and name O ) 2.5 0.0 0.8 assign (segid B and resid 92 and name HN )(segid B and resid 88 and name O ) 1.7 0.0 0.6 assign (segid B and resid 92 and name N )(segid B and resid 88 and name O ) 2.5 0.0 0.8 assign (segid B and resid 93 and name HN )(segid B and resid 89 and name O ) 1.7 0.0 0.6 assign (segid B and resid 93 and name N )(segid B and resid 89 and name O ) 2.5 0.0 0.8 assign (segid B and resid 94 and name HN )(segid B and resid 90 and name O ) 1.7 0.0 0.6 assign (segid B and resid 94 and name N )(segid B and resid 90 and name O ) 2.5 0.0 0.8 assign (segid B and resid 95 and name HN )(segid B and resid 91 and name O ) 1.7 0.0 0.6 assign (segid B and resid 95 and name N )(segid B and resid 91 and name O ) 2.5 0.0 0.8 assign (segid B and resid 96 and name HN )(segid B and resid 92 and name O ) 1.7 0.0 0.6 assign (segid B and resid 96 and name N )(segid B and resid 92 and name O ) 2.5 0.0 0.8 assign (segid B and resid 97 and name HN )(segid B and resid 93 and name O ) 1.7 0.0 0.6 assign (segid B and resid 97 and name N )(segid B and resid 93 and name O ) 2.5 0.0 0.8 assign (segid B and resid 98 and name HN )(segid B and resid 94 and name O ) 1.7 0.0 0.6 assign (segid B and resid 98 and name N )(segid B and resid 94 and name O ) 2.5 0.0 0.8 assign (segid B and resid 99 and name HN )(segid B and resid 95 and name O ) 1.7 0.0 0.6 assign (segid B and resid 99 and name N )(segid B and resid 95 and name O ) 2.5 0.0 0.8
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