NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type | subtype | subsubtype |
|
|
2966 |
1cz5   |
4376 | cing | recoord | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
! NOE RESTRAINTS (all 1923) ! ! Intra-residue (460) ! assign(resid 6 and name HN )(resid 6 and name HA1 ) 0.0 0.0 2.7 assign(resid 6 and name HN )(resid 6 and name HA2 ) 3.0 0.5 0.3 assign(resid 7 and name HN )(resid 7 and name HA ) 3.0 0.5 0.3 assign(resid 7 and name HN )(resid 7 and name HB ) 0.0 0.0 4.0 assign(resid 7 and name HN )(resid 7 and name HD1+ ) 0.0 0.0 4.8 assign(resid 7 and name HN )(resid 7 and name HG1+ ) 0.0 0.0 4.0 assign(resid 7 and name HN )(resid 7 and name HG2+ ) 0.0 0.0 4.0 assign(resid 8 and name HN )(resid 8 and name HA ) 3.0 0.5 0.3 assign(resid 8 and name HN )(resid 8 and name HB ) 0.0 0.0 3.2 assign(resid 8 and name HN )(resid 8 and name HG1+ ) 0.0 0.0 4.8 assign(resid 9 and name HN )(resid 9 and name HA ) 3.0 0.5 0.3 assign(resid 9 and name HN )(resid 9 and name HB+ ) 0.0 0.0 4.0 assign(resid 9 and name HN )(resid 9 and name HG ) 0.0 0.0 5.0 assign(resid 9 and name HN )(resid 9 and name HD1+ ) 0.0 0.0 4.8 assign(resid 9 and name HN )(resid 9 and name HD2+ ) 0.0 0.0 4.0 assign(resid 10 and name HN )(resid 10 and name HA ) 3.0 0.5 0.3 assign(resid 10 and name HN )(resid 10 and name HB+ ) 0.0 0.0 3.5 assign(resid 11 and name HN )(resid 11 and name HA ) 0.0 0.0 4.0 assign(resid 11 and name HN )(resid 11 and name HB ) 0.0 0.0 3.2 assign(resid 11 and name HN )(resid 11 and name HG++ ) 0.0 0.0 4.7 assign(resid 12 and name HN )(resid 12 and name HA ) 3.0 0.5 0.3 assign(resid 12 and name HN )(resid 12 and name HB+ ) 0.0 0.0 4.0 assign(resid 13 and name HN )(resid 13 and name HA ) 3.0 0.5 0.3 assign(resid 13 and name HN )(resid 13 and name HB+ ) 0.0 0.0 3.5 assign(resid 13 and name HN )(resid 13 and name HG+ ) 0.0 0.0 4.8 assign(resid 18 and name HN )(resid 18 and name HA ) 3.0 0.5 0.3 assign(resid 18 and name HN )(resid 18 and name HB1 ) 0.0 0.0 3.2 assign(resid 18 and name HN )(resid 18 and name HB2 ) 0.0 0.0 4.0 assign(resid 21 and name HN )(resid 21 and name HB+ ) 0.0 0.0 4.0 assign(resid 22 and name HN )(resid 22 and name HA ) 3.0 0.5 0.3 assign(resid 22 and name HN )(resid 22 and name HB+ ) 0.0 0.0 4.0 assign(resid 24 and name HN )(resid 24 and name HA ) 3.0 0.5 0.3 assign(resid 24 and name HN )(resid 24 and name HB ) 0.0 0.0 2.7 assign(resid 25 and name HN )(resid 25 and name HA ) 3.0 0.5 0.3 assign(resid 26 and name HN )(resid 26 and name HA ) 3.0 0.5 0.3 assign(resid 26 and name HN )(resid 26 and name HB+ ) 0.0 0.0 4.0 assign(resid 26 and name HN )(resid 26 and name HD++ ) 0.0 0.0 5.5 assign(resid 27 and name HN )(resid 27 and name HA ) 3.0 0.5 0.3 assign(resid 27 and name HN )(resid 27 and name HB1 ) 0.0 0.0 3.2 assign(resid 27 and name HN )(resid 27 and name HB2 ) 0.0 0.0 4.0 assign(resid 28 and name HN )(resid 28 and name HA ) 3.0 0.5 0.3 assign(resid 28 and name HN )(resid 28 and name HB+ ) 0.0 0.0 3.5 assign(resid 28 and name HN )(resid 28 and name HG+ ) 0.0 0.0 4.0 assign(resid 29 and name HN )(resid 29 and name HA ) 3.0 0.5 0.3 assign(resid 29 and name HN )(resid 29 and name HB+ ) 0.0 0.0 3.5 assign(resid 30 and name HN )(resid 30 and name HA ) 0.0 0.0 2.7 assign(resid 31 and name HN )(resid 31 and name HA ) 3.0 0.5 0.3 assign(resid 31 and name HN )(resid 31 and name HB+ ) 0.0 0.0 3.5 assign(resid 31 and name HN )(resid 31 and name HD+ ) 0.0 0.0 5.8 assign(resid 32 and name HN )(resid 32 and name HA ) 3.0 0.5 0.3 assign(resid 32 and name HN )(resid 32 and name HB+ ) 0.0 0.0 3.5 assign(resid 33 and name HN )(resid 33 and name HA ) 3.0 0.5 0.3 assign(resid 33 and name HN )(resid 33 and name HB+ ) 0.0 0.0 3.5 assign(resid 33 and name HN )(resid 33 and name HD1+ ) 0.0 0.0 4.8 assign(resid 33 and name HN )(resid 33 and name HD2+ ) 0.0 0.0 4.8 assign(resid 34 and name HN )(resid 34 and name HA ) 3.0 0.5 0.3 assign(resid 34 and name HN )(resid 34 and name HB+ ) 0.0 0.0 3.5 assign(resid 34 and name HN )(resid 34 and name HD1+ ) 0.0 0.0 4.8 assign(resid 34 and name HN )(resid 34 and name HD2+ ) 0.0 0.0 4.8 assign(resid 35 and name HN )(resid 35 and name HA ) 0.0 0.0 2.7 assign(resid 36 and name HN )(resid 36 and name HA ) 0.0 0.0 2.7 assign(resid 36 and name HN )(resid 36 and name HB+ ) 0.0 0.0 3.5 assign(resid 37 and name HN )(resid 37 and name HA ) 3.0 0.5 0.3 assign(resid 37 and name HN )(resid 37 and name HB1 ) 0.0 0.0 3.2 assign(resid 37 and name HN )(resid 37 and name HB2 ) 0.0 0.0 4.0 assign(resid 37 and name HN )(resid 37 and name HG+ ) 0.0 0.0 4.0 assign(resid 38 and name HN )(resid 38 and name HA ) 0.0 0.0 4.0 assign(resid 38 and name HN )(resid 38 and name HB ) 0.0 0.0 2.7 assign(resid 38 and name HN )(resid 38 and name HD1+ ) 0.0 0.0 5.8 assign(resid 38 and name HN )(resid 38 and name HG1+ ) 0.0 0.0 4.0 assign(resid 38 and name HN )(resid 38 and name HG2+ ) 0.0 0.0 4.8 assign(resid 39 and name HN )(resid 39 and name HA1 ) 3.0 0.5 0.3 assign(resid 39 and name HN )(resid 39 and name HA2 ) 0.0 0.0 2.7 assign(resid 40 and name HN )(resid 40 and name HA ) 3.0 0.5 0.3 assign(resid 40 and name HN )(resid 40 and name HB1 ) 0.0 0.0 4.0 assign(resid 40 and name HN )(resid 40 and name HB2 ) 0.0 0.0 2.7 assign(resid 41 and name HN )(resid 41 and name HA ) 3.0 0.5 0.3 assign(resid 41 and name HN )(resid 41 and name HB ) 0.0 0.0 2.7 assign(resid 41 and name HN )(resid 41 and name HG1+ ) 0.0 0.0 4.8 assign(resid 41 and name HN )(resid 41 and name HG2+ ) 0.0 0.0 4.0 assign(resid 42 and name HN )(resid 42 and name HA ) 3.0 0.5 0.3 assign(resid 42 and name HN )(resid 42 and name HG2+ ) 0.0 0.0 3.5 assign(resid 42 and name HN )(resid 42 and name HG1+ ) 0.0 0.0 4.0 assign(resid 43 and name HN )(resid 43 and name HA ) 3.0 0.5 0.3 assign(resid 44 and name HN )(resid 44 and name HA ) 3.0 0.5 0.3 assign(resid 44 and name HN )(resid 44 and name HB ) 0.0 0.0 3.2 assign(resid 44 and name HN )(resid 44 and name HD1+ ) 0.0 0.0 5.8 assign(resid 44 and name HN )(resid 44 and name HG1+ ) 0.0 0.0 4.0 assign(resid 44 and name HN )(resid 44 and name HG2+ ) 0.0 0.0 4.8 assign(resid 45 and name HN )(resid 45 and name HA ) 3.0 0.5 0.3 assign(resid 45 and name HN )(resid 45 and name HB1 ) 0.0 0.0 3.2 assign(resid 45 and name HN )(resid 45 and name HB2 ) 0.0 0.0 3.2 assign(resid 45 and name HN )(resid 45 and name HG+ ) 0.0 0.0 4.8 assign(resid 46 and name HN )(resid 46 and name HA ) 3.0 0.5 0.3 assign(resid 46 and name HN )(resid 46 and name HB+ ) 0.0 0.0 4.0 assign(resid 47 and name HN )(resid 47 and name HA ) 3.0 0.5 0.3 assign(resid 47 and name HN )(resid 47 and name HB ) 0.0 0.0 3.2 assign(resid 47 and name HN )(resid 47 and name HG2+ ) 0.0 0.0 4.8 assign(resid 48 and name HN )(resid 48 and name HA ) 3.0 0.5 0.3 assign(resid 48 and name HN )(resid 48 and name HB+ ) 0.0 0.0 5.8 assign(resid 48 and name HN )(resid 48 and name HD+ ) 0.0 0.0 5.8 assign(resid 48 and name HN )(resid 48 and name HG+ ) 0.0 0.0 4.0 assign(resid 49 and name HN )(resid 49 and name HA ) 3.0 0.5 0.3 assign(resid 49 and name HN )(resid 49 and name HB+ ) 0.0 0.0 4.0 assign(resid 49 and name HN )(resid 49 and name HG+ ) 0.0 0.0 4.0 assign(resid 49 and name HN )(resid 49 and name HD+ ) 0.0 0.0 5.8 assign(resid 50 and name HN )(resid 50 and name HA ) 3.0 0.5 0.3 assign(resid 50 and name HN )(resid 50 and name HG2+ ) 0.0 0.0 4.0 assign(resid 51 and name HN )(resid 51 and name HA ) 3.0 0.5 0.3 assign(resid 51 and name HN )(resid 51 and name HB ) 0.0 0.0 4.0 assign(resid 51 and name HN )(resid 51 and name HG++ ) 0.0 0.0 4.2 assign(resid 53 and name HN )(resid 53 and name HA ) 3.0 0.5 0.3 assign(resid 53 and name HN )(resid 53 and name HB+ ) 0.0 0.0 3.5 assign(resid 53 and name HN )(resid 53 and name HG+ ) 0.0 0.0 4.8 assign(resid 53 and name HN )(resid 53 and name HD+ ) 0.0 0.0 5.8 assign(resid 54 and name HN )(resid 54 and name HA ) 3.0 0.5 0.3 assign(resid 54 and name HN )(resid 54 and name HB ) 0.0 0.0 3.2 assign(resid 54 and name HN )(resid 54 and name HG2+ ) 0.0 0.0 4.8 assign(resid 54 and name HN )(resid 54 and name HG1+ ) 0.0 0.0 3.5 assign(resid 55 and name HN )(resid 55 and name HB1 ) 0.0 0.0 4.0 assign(resid 55 and name HN )(resid 55 and name HB2 ) 0.0 0.0 3.2 assign(resid 56 and name HN )(resid 56 and name HA ) 0.0 0.0 4.0 assign(resid 56 and name HN )(resid 56 and name HB+ ) 0.0 0.0 3.5 assign(resid 57 and name HN )(resid 57 and name HA ) 3.0 0.5 0.3 assign(resid 57 and name HN )(resid 57 and name HB+ ) 0.0 0.0 3.5 assign(resid 58 and name HN )(resid 58 and name HA ) 3.0 0.5 0.3 assign(resid 58 and name HN )(resid 58 and name HB+ ) 0.0 0.0 4.0 assign(resid 60 and name HN )(resid 60 and name HA ) 3.0 0.5 0.3 assign(resid 60 and name HN )(resid 60 and name HB+ ) 0.0 0.0 3.5 assign(resid 60 and name HN )(resid 60 and name HG+ ) 0.0 0.0 4.0 assign(resid 61 and name HN )(resid 61 and name HA ) 3.0 0.5 0.3 assign(resid 61 and name HN )(resid 61 and name HB+ ) 0.0 0.0 3.5 assign(resid 62 and name HN )(resid 62 and name HA ) 3.0 0.5 0.3 assign(resid 62 and name HN )(resid 62 and name HB+ ) 0.0 0.0 3.5 assign(resid 62 and name HN )(resid 62 and name HG+ ) 0.0 0.0 3.5 assign(resid 63 and name HN )(resid 63 and name HA ) 3.0 0.5 0.3 assign(resid 63 and name HN )(resid 63 and name HB+ ) 0.0 0.0 4.0 assign(resid 64 and name HN )(resid 64 and name HA ) 3.0 0.5 0.3 assign(resid 64 and name HN )(resid 64 and name HB+ ) 0.0 0.0 3.5 assign(resid 64 and name HN )(resid 64 and name HG+ ) 0.0 0.0 4.0 assign(resid 64 and name HN )(resid 64 and name HD+ ) 0.0 0.0 4.8 assign(resid 65 and name HN )(resid 65 and name HA1 ) 0.0 0.0 2.7 assign(resid 65 and name HN )(resid 65 and name HA2 ) 0.0 0.0 2.7 assign(resid 66 and name HA )(resid 66 and name HB ) 0.0 0.0 2.7 assign(resid 66 and name HN )(resid 66 and name HA ) 3.0 0.5 0.3 assign(resid 66 and name HN )(resid 66 and name HB ) 0.0 0.0 4.0 assign(resid 67 and name HN )(resid 67 and name HB ) 0.0 0.0 4.0 assign(resid 67 and name HN )(resid 67 and name HG1+ ) 0.0 0.0 3.5 assign(resid 68 and name HN )(resid 68 and name HA ) 3.0 0.5 0.3 assign(resid 69 and name HN )(resid 69 and name HA ) 3.0 0.5 0.3 assign(resid 69 and name HN )(resid 69 and name HD1+ ) 0.0 0.0 5.8 assign(resid 69 and name HN )(resid 69 and name HG1+ ) 0.0 0.0 4.0 assign(resid 69 and name HN )(resid 69 and name HG2+ ) 0.0 0.0 4.8 assign(resid 70 and name HN )(resid 70 and name HA ) 3.0 0.5 0.3 assign(resid 70 and name HN )(resid 70 and name HB+ ) 0.0 0.0 3.5 assign(resid 71 and name HN )(resid 71 and name HA ) 3.0 0.5 0.3 assign(resid 71 and name HN )(resid 71 and name HB+ ) 0.0 0.0 4.0 assign(resid 72 and name HN )(resid 72 and name HA ) 3.0 0.5 0.3 assign(resid 72 and name HN )(resid 72 and name HB ) 0.0 0.0 2.7 assign(resid 72 and name HN )(resid 72 and name HG1+ ) 0.0 0.0 4.8 assign(resid 72 and name HN )(resid 72 and name HG2+ ) 0.0 0.0 3.5 assign(resid 73 and name HN )(resid 73 and name HA ) 3.0 0.5 0.3 assign(resid 74 and name HN )(resid 74 and name HA ) 3.0 0.5 0.3 assign(resid 74 and name HN )(resid 74 and name HB+ ) 0.0 0.0 3.5 assign(resid 75 and name HN )(resid 75 and name HA ) 3.0 0.5 0.3 assign(resid 75 and name HN )(resid 75 and name HB+ ) 0.0 0.0 4.0 assign(resid 76 and name HN )(resid 76 and name HA ) 3.0 0.5 0.3 assign(resid 76 and name HN )(resid 76 and name HB+ ) 0.0 0.0 4.0 assign(resid 77 and name HN )(resid 77 and name HA ) 3.0 0.5 0.3 assign(resid 77 and name HN )(resid 77 and name HB2 ) 0.0 0.0 4.0 assign(resid 77 and name HN )(resid 77 and name HB1 ) 0.0 0.0 3.2 assign(resid 78 and name HN )(resid 78 and name HA+ ) 0.0 0.0 3.5 assign(resid 79 and name HN )(resid 79 and name HA ) 3.0 0.5 0.3 assign(resid 79 and name HN )(resid 79 and name HB+ ) 0.0 0.0 4.0 assign(resid 80 and name HN )(resid 80 and name HA ) 3.0 0.5 0.3 assign(resid 80 and name HN )(resid 80 and name HB1 ) 0.0 0.0 3.2 assign(resid 80 and name HN )(resid 80 and name HB2 ) 0.0 0.0 4.0 assign(resid 81 and name HD1+ )(resid 81 and name HA ) 0.0 0.0 4.0 assign(resid 81 and name HN )(resid 81 and name HA ) 3.0 0.5 0.3 assign(resid 81 and name HN )(resid 81 and name HB ) 0.0 0.0 2.7 assign(resid 81 and name HN )(resid 81 and name HG2+ ) 0.0 0.0 4.0 assign(resid 82 and name HN )(resid 82 and name HA1 ) 3.0 0.5 0.3 assign(resid 82 and name HN )(resid 82 and name HA2 ) 0.0 0.0 2.7 assign(resid 83 and name HN )(resid 83 and name HA ) 0.0 0.0 2.7 assign(resid 83 and name HN )(resid 83 and name HB1 ) 0.0 0.0 3.2 assign(resid 83 and name HN )(resid 83 and name HB2 ) 0.0 0.0 2.7 assign(resid 84 and name HN )(resid 84 and name HA ) 3.0 0.5 0.3 assign(resid 85 and name HN )(resid 85 and name HA ) 3.0 0.5 0.3 assign(resid 85 and name HN )(resid 85 and name HG2+ ) 0.0 0.0 3.5 assign(resid 86 and name HN )(resid 86 and name HA ) 3.0 0.5 0.3 assign(resid 86 and name HN )(resid 86 and name HB1 ) 0.0 0.0 3.2 assign(resid 86 and name HN )(resid 86 and name HB2 ) 0.0 0.0 3.2 assign(resid 86 and name HN )(resid 86 and name HG+ ) 0.0 0.0 4.8 assign(resid 86 and name HN )(resid 86 and name HD+ ) 0.0 0.0 5.8 assign(resid 87 and name HN )(resid 87 and name HA ) 3.0 0.5 0.3 assign(resid 87 and name HN )(resid 87 and name HB ) 0.0 0.0 3.2 assign(resid 87 and name HN )(resid 87 and name HG++ ) 0.0 0.0 4.5 assign(resid 88 and name HN )(resid 88 and name HA ) 3.0 0.5 0.3 assign(resid 88 and name HN )(resid 88 and name HB+ ) 0.0 0.0 4.0 assign(resid 89 and name HN )(resid 89 and name HA ) 3.0 0.5 0.3 assign(resid 89 and name HN )(resid 89 and name HB+ ) 0.0 0.0 3.5 assign(resid 89 and name HN )(resid 89 and name HG+ ) 0.0 0.0 4.8 assign(resid 90 and name HN )(resid 90 and name HA ) 3.0 0.5 0.3 assign(resid 90 and name HN )(resid 90 and name HG1+ ) 0.0 0.0 4.0 assign(resid 90 and name HN )(resid 90 and name HG2+ ) 0.0 0.0 3.5 assign(resid 91 and name HN )(resid 91 and name HA ) 3.0 0.5 0.3 assign(resid 91 and name HN )(resid 91 and name HB+ ) 0.0 0.0 3.5 assign(resid 91 and name HN )(resid 91 and name HD+ ) 0.0 0.0 5.8 assign(resid 92 and name HN )(resid 92 and name HA ) 3.0 0.5 0.3 assign(resid 92 and name HN )(resid 92 and name HB ) 0.0 0.0 4.0 assign(resid 92 and name HN )(resid 92 and name HG2+ ) 0.0 0.0 4.0 assign(resid 93 and name HN )(resid 93 and name HB1 ) 0.0 0.0 4.0 assign(resid 93 and name HN )(resid 93 and name HB2 ) 0.0 0.0 4.0 assign(resid 93 and name HN )(resid 93 and name HG+ ) 0.0 0.0 4.8 assign(resid 94 and name HN )(resid 94 and name HA ) 3.0 0.5 0.3 assign(resid 94 and name HN )(resid 94 and name HB ) 0.0 0.0 2.7 assign(resid 94 and name HN )(resid 94 and name HD1+ ) 0.0 0.0 4.8 assign(resid 94 and name HN )(resid 94 and name HG1+ ) 0.0 0.0 3.5 assign(resid 94 and name HN )(resid 94 and name HG2+ ) 0.0 0.0 4.8 assign(resid 95 and name HN )(resid 95 and name HA ) 3.0 0.5 0.3 assign(resid 95 and name HN )(resid 95 and name HB+ ) 0.0 0.0 3.5 assign(resid 96 and name HN )(resid 96 and name HA ) 3.0 0.5 0.3 assign(resid 96 and name HN )(resid 96 and name HB1 ) 0.0 0.0 3.2 assign(resid 96 and name HN )(resid 96 and name HB2 ) 0.0 0.0 4.0 assign(resid 96 and name HN )(resid 96 and name HD+ ) 0.0 0.0 5.8 assign(resid 96 and name HN )(resid 96 and name HE+ ) 0.0 0.0 5.8 assign(resid 96 and name HN )(resid 96 and name HG+ ) 0.0 0.0 4.0 assign(resid 97 and name HN )(resid 97 and name HA ) 3.0 0.5 0.3 assign(resid 97 and name HN )(resid 97 and name HB+ ) 0.0 0.0 4.0 assign(resid 98 and name HN )(resid 98 and name HA ) 3.0 0.5 0.3 assign(resid 99 and name HN )(resid 99 and name HA ) 3.0 0.5 0.3 assign(resid 99 and name HN )(resid 99 and name HG2+ ) 0.0 0.0 4.8 assign(resid 100 and name HN )(resid 100 and name HA ) 3.0 0.5 0.3 assign(resid 100 and name HN )(resid 100 and name HD1+ ) 0.0 0.0 4.8 assign(resid 100 and name HN )(resid 100 and name HD2+ ) 0.0 0.0 4.8 assign(resid 100 and name HN )(resid 100 and name HG ) 0.0 0.0 4.0 assign(resid 101 and name HN )(resid 101 and name HA ) 3.0 0.5 0.3 assign(resid 101 and name HN )(resid 101 and name HB+ ) 0.0 0.0 3.5 assign(resid 103 and name HN )(resid 103 and name HB ) 0.0 0.0 2.7 assign(resid 103 and name HN )(resid 103 and name HD1+ ) 0.0 0.0 4.0 assign(resid 103 and name HN )(resid 103 and name HG1+ ) 0.0 0.0 4.0 assign(resid 103 and name HN )(resid 103 and name HG2+ ) 0.0 0.0 4.8 assign(resid 104 and name HN )(resid 104 and name HA ) 3.0 0.5 0.3 assign(resid 104 and name HN )(resid 104 and name HB ) 0.0 0.0 4.0 assign(resid 104 and name HN )(resid 104 and name HG1+ ) 0.0 0.0 4.0 assign(resid 104 and name HN )(resid 104 and name HG2+ ) 0.0 0.0 4.8 assign(resid 104 and name HN )(resid 104 and name HD1+ ) 0.0 0.0 4.8 assign(resid 105 and name HN )(resid 105 and name HA ) 3.0 0.5 0.3 assign(resid 105 and name HN )(resid 105 and name HB+ ) 0.0 0.0 3.5 assign(resid 105 and name HN )(resid 105 and name HD+ ) 0.0 0.0 4.8 assign(resid 106 and name HN )(resid 106 and name HA ) 3.0 0.5 0.3 assign(resid 106 and name HN )(resid 106 and name HB+ ) 0.0 0.0 3.5 assign(resid 106 and name HN )(resid 106 and name HG+ ) 0.0 0.0 4.0 assign(resid 107 and name HN )(resid 107 and name HA ) 3.0 0.5 0.3 assign(resid 107 and name HN )(resid 107 and name HB1 ) 0.0 0.0 3.2 assign(resid 107 and name HN )(resid 107 and name HB2 ) 0.0 0.0 4.0 assign(resid 108 and name HN )(resid 108 and name HA ) 3.0 0.5 0.3 assign(resid 108 and name HN )(resid 108 and name HB+ ) 0.0 0.0 3.5 assign(resid 108 and name HN )(resid 108 and name HG+ ) 0.0 0.0 4.0 assign(resid 109 and name HN )(resid 109 and name HA ) 3.0 0.5 0.3 assign(resid 109 and name HN )(resid 109 and name HB+ ) 0.0 0.0 4.0 assign(resid 110 and name HN )(resid 110 and name HA ) 3.0 0.5 0.3 assign(resid 110 and name HN )(resid 110 and name HB1 ) 0.0 0.0 2.7 assign(resid 110 and name HN )(resid 110 and name HB2 ) 0.0 0.0 4.0 assign(resid 110 and name HN )(resid 110 and name HD1+ ) 0.0 0.0 4.8 assign(resid 110 and name HN )(resid 110 and name HD2+ ) 0.0 0.0 4.0 assign(resid 111 and name HN )(resid 111 and name HA ) 3.0 0.5 0.3 assign(resid 111 and name HN )(resid 111 and name HB+ ) 0.0 0.0 3.5 assign(resid 111 and name HN )(resid 111 and name HG+ ) 0.0 0.0 4.0 assign(resid 111 and name HN )(resid 111 and name HD+ ) 0.0 0.0 4.8 assign(resid 112 and name HN )(resid 112 and name HA ) 3.0 0.5 0.3 assign(resid 112 and name HN )(resid 112 and name HB1 ) 0.0 0.0 4.0 assign(resid 112 and name HN )(resid 112 and name HB2 ) 0.0 0.0 2.7 assign(resid 114 and name HN )(resid 114 and name HA ) 3.0 0.5 0.3 assign(resid 114 and name HN )(resid 114 and name HB+ ) 0.0 0.0 3.5 assign(resid 114 and name HN )(resid 114 and name HG+ ) 0.0 0.0 4.0 assign(resid 115 and name HN )(resid 115 and name HA1 ) 3.0 0.5 0.3 assign(resid 115 and name HN )(resid 115 and name HA2 ) 0.0 0.0 2.7 assign(resid 116 and name HN )(resid 116 and name HA ) 3.0 0.5 0.3 assign(resid 116 and name HN )(resid 116 and name HB ) 0.0 0.0 2.7 assign(resid 116 and name HN )(resid 116 and name HG1+ ) 0.0 0.0 4.8 assign(resid 116 and name HN )(resid 116 and name HG2+ ) 0.0 0.0 3.5 assign(resid 116 and name HN )(resid 116 and name HD1+ ) 0.0 0.0 4.8 assign(resid 117 and name HN )(resid 117 and name HA ) 3.0 0.5 0.3 assign(resid 117 and name HN )(resid 117 and name HB+ ) 0.0 0.0 3.5 assign(resid 117 and name HN )(resid 117 and name HG+ ) 0.0 0.0 4.8 assign(resid 118 and name HN )(resid 118 and name HA ) 3.0 0.5 0.3 assign(resid 118 and name HN )(resid 118 and name HB+ ) 0.0 0.0 3.5 assign(resid 119 and name HN )(resid 119 and name HA ) 3.0 0.5 0.3 assign(resid 119 and name HN )(resid 119 and name HB+ ) 0.0 0.0 3.5 assign(resid 120 and name HN )(resid 120 and name HA ) 3.0 0.5 0.3 assign(resid 120 and name HN )(resid 120 and name HB ) 0.0 0.0 3.2 assign(resid 120 and name HN )(resid 120 and name HG1+ ) 0.0 0.0 4.8 assign(resid 120 and name HN )(resid 120 and name HG2+ ) 0.0 0.0 3.5 assign(resid 121 and name HN )(resid 121 and name HA ) 3.0 0.5 0.3 assign(resid 122 and name HN )(resid 122 and name HA ) 3.0 0.5 0.3 assign(resid 122 and name HN )(resid 122 and name HB+ ) 0.0 0.0 3.5 assign(resid 122 and name HN )(resid 122 and name HD+ ) 0.0 0.0 4.8 assign(resid 123 and name HN )(resid 123 and name HA ) 3.0 0.5 0.3 assign(resid 123 and name HN )(resid 123 and name HB+ ) 0.0 0.0 3.5 assign(resid 124 and name HN )(resid 124 and name HA ) 0.0 0.0 4.0 assign(resid 124 and name HN )(resid 124 and name HB+ ) 0.0 0.0 3.5 assign(resid 124 and name HN )(resid 124 and name HD1+ ) 0.0 0.0 4.8 assign(resid 124 and name HN )(resid 124 and name HD2+ ) 0.0 0.0 4.0 assign(resid 125 and name HN )(resid 125 and name HA ) 3.0 0.5 0.3 assign(resid 125 and name HN )(resid 125 and name HB ) 0.0 0.0 2.7 assign(resid 125 and name HN )(resid 125 and name HG1+ ) 0.0 0.0 4.0 assign(resid 125 and name HN )(resid 125 and name HG2+ ) 0.0 0.0 3.5 assign(resid 126 and name HN )(resid 126 and name HA ) 3.0 0.5 0.3 assign(resid 126 and name HN )(resid 126 and name HB1 ) 0.0 0.0 4.0 assign(resid 127 and name HN )(resid 127 and name HA ) 3.0 0.5 0.3 assign(resid 127 and name HN )(resid 127 and name HB+ ) 0.0 0.0 4.0 assign(resid 129 and name HN )(resid 129 and name HA ) 3.0 0.5 0.3 assign(resid 129 and name HN )(resid 129 and name HB+ ) 0.0 0.0 4.0 assign(resid 129 and name HN )(resid 129 and name HG+ ) 0.0 0.0 3.5 assign(resid 130 and name HN )(resid 130 and name HA ) 3.0 0.5 0.3 assign(resid 130 and name HN )(resid 130 and name HB+ ) 0.0 0.0 4.0 assign(resid 130 and name HN )(resid 130 and name HG ) 0.0 0.0 4.0 assign(resid 131 and name HN )(resid 131 and name HA ) 0.0 0.0 4.0 assign(resid 131 and name HN )(resid 131 and name HB1 ) 0.0 0.0 3.2 assign(resid 131 and name HN )(resid 131 and name HB2 ) 0.0 0.0 4.0 assign(resid 131 and name HN )(resid 131 and name HG+ ) 0.0 0.0 4.0 assign(resid 132 and name HN )(resid 132 and name HA ) 0.0 0.0 2.7 assign(resid 132 and name HN )(resid 132 and name HB+ ) 0.0 0.0 4.0 assign(resid 132 and name HN )(resid 132 and name HG+ ) 0.0 0.0 4.8 assign(resid 133 and name HN )(resid 133 and name HA ) 3.0 0.5 0.3 assign(resid 133 and name HN )(resid 133 and name HB1 ) 0.0 0.0 2.7 assign(resid 133 and name HN )(resid 133 and name HB2 ) 0.0 0.0 4.0 assign(resid 134 and name HN )(resid 134 and name HA ) 0.0 0.0 4.0 assign(resid 134 and name HN )(resid 134 and name HB1 ) 0.0 0.0 4.0 assign(resid 134 and name HN )(resid 134 and name HB2 ) 0.0 0.0 3.2 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name HB2 ) 0.0 0.0 4.0 assign(resid 140 and name HN )(resid 140 and name HD++ ) 0.0 0.0 4.7 assign(resid 140 and name HN )(resid 140 and name HG ) 0.0 0.0 4.0 assign(resid 141 and name HA )(resid 141 and name HB ) 0.0 0.0 2.7 assign(resid 141 and name HN )(resid 141 and name HB ) 0.0 0.0 4.0 assign(resid 141 and name HN )(resid 141 and name HG+ ) 0.0 0.0 4.8 assign(resid 141 and name HN )(resid 141 and name HA ) 3.0 0.5 0.3 assign(resid 142 and name HN )(resid 142 and name HA ) 3.0 0.5 0.3 assign(resid 142 and name HN )(resid 142 and name HB+ ) 0.0 0.0 3.5 assign(resid 142 and name HN )(resid 142 and name HD1+ ) 0.0 0.0 4.8 assign(resid 142 and name HN )(resid 142 and name HD2+ ) 0.0 0.0 4.8 assign(resid 142 and name HN )(resid 142 and name HG ) 0.0 0.0 4.0 assign(resid 143 and name HN )(resid 143 and name HA ) 3.0 0.5 0.3 assign(resid 143 and name HN )(resid 143 and name HB+ ) 0.0 0.0 4.0 assign(resid 145 and name HN )(resid 145 and name HA ) 3.0 0.5 0.3 assign(resid 145 and name HN 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assign(resid 150 and name HN )(resid 150 and name HA ) 3.0 0.5 0.3 assign(resid 150 and name HN )(resid 150 and name HB+ ) 0.0 0.0 4.0 assign(resid 151 and name HN )(resid 151 and name HB+ ) 0.0 0.0 3.5 assign(resid 151 and name HN )(resid 151 and name HD+ ) 0.0 0.0 5.8 assign(resid 152 and name HN )(resid 152 and name HA ) 3.0 0.5 0.3 assign(resid 152 and name HN )(resid 152 and name HB ) 0.0 0.0 3.2 assign(resid 152 and name HN )(resid 152 and name HG1+ ) 0.0 0.0 4.8 assign(resid 152 and name HN )(resid 152 and name HG2+ ) 0.0 0.0 3.5 assign(resid 153 and name HN )(resid 153 and name HA ) 3.0 0.5 0.3 assign(resid 153 and name HN )(resid 153 and name HB ) 0.0 0.0 3.2 assign(resid 154 and name HN )(resid 154 and name HA ) 3.0 0.5 0.3 assign(resid 154 and name HN )(resid 154 and name HB+ ) 0.0 0.0 4.0 assign(resid 155 and name HN )(resid 155 and name HA ) 3.0 0.5 0.3 assign(resid 155 and name HN )(resid 155 and name HG2+ ) 0.0 0.0 4.8 assign(resid 156 and name HN )(resid 156 and name HA ) 3.0 0.5 0.3 assign(resid 156 and name HN )(resid 156 and name HB1 ) 0.0 0.0 4.0 assign(resid 156 and name HN )(resid 156 and name HB2 ) 0.0 0.0 3.2 assign(resid 156 and name HN )(resid 156 and name HG ) 0.0 0.0 5.0 assign(resid 157 and name HA )(resid 157 and name HB1 ) 0.0 0.0 2.7 assign(resid 157 and name HA )(resid 157 and name HG+ ) 0.0 0.0 4.0 assign(resid 158 and name HN )(resid 158 and name HA ) 0.0 0.0 4.0 assign(resid 158 and name HN )(resid 158 and name HB1 ) 0.0 0.0 3.2 assign(resid 158 and name HN )(resid 158 and name HB2 ) 0.0 0.0 3.2 assign(resid 159 and name HN )(resid 159 and name HA ) 0.0 0.0 2.7 assign(resid 159 and name HN )(resid 159 and name HB+ ) 0.0 0.0 4.0 assign(resid 159 and name HN )(resid 159 and name HD+ ) 0.0 0.0 4.8 assign(resid 159 and name HN )(resid 159 and name HG+ ) 0.0 0.0 4.8 assign(resid 160 and name HN )(resid 160 and name HA ) 3.0 0.5 0.3 assign(resid 160 and name HN )(resid 160 and name HB ) 0.0 0.0 4.0 assign(resid 160 and name HN )(resid 160 and name HG1+ ) 0.0 0.0 3.5 assign(resid 160 and name HN )(resid 160 and name HG2+ ) 0.0 0.0 3.5 assign(resid 162 and name HN )(resid 162 and name HA ) 3.0 0.5 0.3 assign(resid 162 and name HN )(resid 162 and name HG1+ ) 0.0 0.0 4.0 assign(resid 162 and name HN )(resid 162 and name HG2+ ) 0.0 0.0 3.5 assign(resid 163 and name HN )(resid 163 and name HA ) 3.0 0.5 0.3 assign(resid 163 and name HN )(resid 163 and name HB+ ) 0.0 0.0 4.0 assign(resid 164 and name HN )(resid 164 and name HA ) 3.0 0.5 0.3 assign(resid 164 and name HN )(resid 164 and name HB ) 0.0 0.0 3.2 assign(resid 164 and name HN )(resid 164 and name HD1+ ) 0.0 0.0 4.8 assign(resid 164 and name HN )(resid 164 and name HG1+ ) 0.0 0.0 4.0 assign(resid 164 and name HN )(resid 164 and name HG2+ ) 0.0 0.0 4.8 assign(resid 165 and name HN )(resid 165 and name HA1 ) 0.0 0.0 2.7 assign(resid 165 and name HN )(resid 165 and name HA2 ) 3.0 0.5 0.3 assign(resid 166 and name HN )(resid 166 and name HA ) 3.0 0.5 0.3 assign(resid 166 and name HN )(resid 166 and name HB+ ) 0.0 0.0 3.5 assign(resid 166 and name HN )(resid 166 and name HG+ ) 0.0 0.0 4.0 assign(resid 167 and name HN )(resid 167 and name HA ) 3.0 0.5 0.3 assign(resid 167 and name HN )(resid 167 and name HG+ ) 0.0 0.0 4.0 assign(resid 168 and name HN )(resid 168 and name HA ) 3.0 0.5 0.3 assign(resid 168 and name HN )(resid 168 and name HB ) 0.0 0.0 2.7 assign(resid 168 and name HN )(resid 168 and name HG2+ ) 0.0 0.0 4.8 assign(resid 169 and name HN )(resid 169 and name HA ) 3.0 0.5 0.3 assign(resid 169 and name HN )(resid 169 and name HB+ ) 0.0 0.0 3.5 assign(resid 169 and name HN )(resid 169 and name HD+ ) 0.0 0.0 5.8 assign(resid 169 and name HN )(resid 169 and name HG+ ) 0.0 0.0 4.0 assign(resid 170 and name HN )(resid 170 and name HA ) 3.0 0.5 0.3 assign(resid 170 and name HN )(resid 170 and name HB ) 0.0 0.0 3.2 assign(resid 170 and name HN )(resid 170 and name HD1+ ) 0.0 0.0 5.8 assign(resid 170 and name HN )(resid 170 and name HG2+ ) 0.0 0.0 4.8 assign(resid 171 and name HN )(resid 171 and name HA ) 3.0 0.5 0.3 assign(resid 171 and name HN )(resid 171 and name HB1 ) 0.0 0.0 4.0 assign(resid 171 and name HN )(resid 171 and name HB2 ) 0.0 0.0 3.2 assign(resid 171 and name HN )(resid 171 and name HG+ ) 0.0 0.0 4.0 assign(resid 172 and name HN )(resid 172 and name HA ) 3.0 0.5 0.3 assign(resid 172 and name HN )(resid 172 and name HB ) 0.0 0.0 3.2 assign(resid 172 and name HN )(resid 172 and name HG1+ ) 0.0 0.0 4.0 assign(resid 172 and name HN )(resid 172 and name HG2+ ) 0.0 0.0 4.8 assign(resid 173 and name HN )(resid 173 and name HA ) 3.0 0.5 0.3 assign(resid 173 and name HN )(resid 173 and name HB+ ) 0.0 0.0 3.5 assign(resid 173 and name HN )(resid 173 and name HD+ ) 0.0 0.0 5.8 assign(resid 173 and name HN )(resid 173 and name HG+ ) 0.0 0.0 4.0 assign(resid 174 and name HN )(resid 174 and name HA ) 3.0 0.5 0.3 assign(resid 174 and name HN )(resid 174 and name HB+ ) 0.0 0.0 3.5 assign(resid 174 and name HN )(resid 174 and name HG+ ) 0.0 0.0 4.8 assign(resid 175 and name HN )(resid 175 and name HA ) 3.0 0.5 0.3 assign(resid 175 and name HN )(resid 175 and name HB+ ) 0.0 0.0 3.5 assign(resid 177 and name HN )(resid 177 and name HA ) 3.0 0.5 0.3 assign(resid 177 and name HN )(resid 177 and name HB+ ) 0.0 0.0 4.0 assign(resid 178 and name HN )(resid 178 and name HA ) 3.0 0.5 0.3 assign(resid 178 and name HN )(resid 178 and name HB+ ) 0.0 0.0 3.5 assign(resid 179 and name HN )(resid 179 and name HA ) 0.0 0.0 2.7 assign(resid 180 and name HN )(resid 180 and name HA ) 3.0 0.5 0.3 assign(resid 180 and name HN )(resid 180 and name HB ) 0.0 0.0 2.7 assign(resid 181 and name HN )(resid 181 and name HA ) 0.0 0.0 4.0 assign(resid 181 and name HN )(resid 181 and name HD++ ) 0.0 0.0 5.5 ! ! inter-residue sequential (643) ! assign(resid 6 and name HN )(resid 5 and name HA ) 0.0 0.0 2.7 assign(resid 6 and name HN )(resid 5 and name HB+ ) 0.0 0.0 4.0 assign(resid 6 and name HN )(resid 7 and name HN ) 3.2 0.0 3.0 assign(resid 7 and name HN )(resid 6 and name HA1 ) 0.0 0.0 2.7 assign(resid 7 and name HN )(resid 6 and name HA2 ) 0.0 0.0 3.2 assign(resid 7 and name HN )(resid 8 and name HN ) 3.2 0.0 3.0 assign(resid 8 and name HN )(resid 7 and name HA ) 0.0 0.0 2.7 assign(resid 8 and name HN )(resid 7 and name HB ) 0.0 0.0 3.2 assign(resid 8 and name HN )(resid 7 and name HG1+ ) 0.0 0.0 5.8 assign(resid 8 and name HN )(resid 7 and name HD1+ ) 0.0 0.0 5.8 assign(resid 8 and name HN )(resid 9 and name HN ) 3.2 0.0 3.0 assign(resid 9 and name HN )(resid 8 and name HA ) 0.0 0.0 2.7 assign(resid 9 and name HN )(resid 8 and name HB ) 0.0 0.0 5.0 assign(resid 9 and name HN )(resid 10 and name HN ) 3.2 0.0 3.0 assign(resid 10 and name HN )(resid 9 and name HA ) 0.0 0.0 2.7 assign(resid 10 and name HN )(resid 9 and name HB+ ) 0.0 0.0 4.0 assign(resid 10 and name HN )(resid 9 and name HD1+ ) 0.0 0.0 4.8 assign(resid 10 and name HN )(resid 9 and name HD2+ ) 0.0 0.0 5.8 assign(resid 10 and name HN )(resid 11 and name HN ) 3.2 0.0 3.0 assign(resid 11 and name HN )(resid 10 and name HA ) 0.0 0.0 2.7 assign(resid 11 and name HN )(resid 10 and name HB+ ) 0.0 0.0 5.8 assign(resid 11 and name HN )(resid 12 and name HN ) 3.2 0.0 3.0 assign(resid 12 and name HN )(resid 11 and name HA ) 0.0 0.0 2.7 assign(resid 12 and name HN )(resid 11 and name HG1+ ) 0.0 0.0 5.8 assign(resid 12 and name HN )(resid 11 and name HG2+ ) 0.0 0.0 3.5 assign(resid 12 and name HN )(resid 13 and name HN ) 3.2 0.0 3.0 assign(resid 13 and name HN )(resid 12 and name HA ) 0.0 0.0 2.7 assign(resid 13 and name HN )(resid 12 and name HB+ ) 0.0 0.0 3.5 assign(resid 13 and name HN )(resid 14 and name HN ) 3.2 0.0 3.0 assign(resid 18 and name HN )(resid 17 and name HA ) 0.0 0.0 4.0 assign(resid 18 and name HN )(resid 17 and name HB ) 0.0 0.0 5.0 assign(resid 18 and name HN )(resid 17 and name HG2+ ) 0.0 0.0 4.8 assign(resid 18 and name HN )(resid 19 and name HG+ ) 0.0 0.0 4.8 assign(resid 18 and name HN )(resid 19 and name HD+ ) 0.0 0.0 3.5 assign(resid 20 and name HN )(resid 19 and name HA ) 0.0 0.0 2.7 assign(resid 20 and name HN )(resid 19 and name HB+ ) 0.0 0.0 4.0 assign(resid 20 and name HN )(resid 21 and name HN ) 0.0 0.0 3.2 assign(resid 21 and name HN )(resid 20 and name HA1 ) 0.0 0.0 4.0 assign(resid 21 and name HN )(resid 20 and name HA2 ) 0.0 0.0 4.0 assign(resid 22 and name HN )(resid 21 and name HA ) 0.0 0.0 4.0 assign(resid 22 and name HN )(resid 21 and name HB+ ) 0.0 0.0 4.8 assign(resid 22 and name HN )(resid 21 and name HN ) 0.0 0.0 4.0 assign(resid 22 and name HN )(resid 23 and name HN ) 0.0 0.0 4.0 assign(resid 23 and name HN )(resid 22 and name HA ) 0.0 0.0 3.2 assign(resid 23 and name HN )(resid 24 and name HN ) 3.2 0.0 3.0 assign(resid 24 and name HN )(resid 25 and name HN ) 3.2 0.0 3.0 assign(resid 25 and name HN )(resid 24 and name HA ) 0.0 0.0 2.7 assign(resid 25 and name HN )(resid 24 and name HG1+ ) 0.0 0.0 4.0 assign(resid 25 and name HN )(resid 24 and name HG2+ ) 0.0 0.0 4.8 assign(resid 25 and name HN )(resid 26 and name HN ) 3.2 0.0 3.0 assign(resid 26 and name HN )(resid 25 and name HA ) 0.0 0.0 2.7 assign(resid 26 and name HN )(resid 25 and name HB+ ) 0.0 0.0 4.0 assign(resid 26 and name HN )(resid 25 and name HG+ ) 0.0 0.0 4.0 assign(resid 26 and name HN )(resid 27 and name HN ) 3.2 0.0 3.0 assign(resid 27 and name HN )(resid 26 and name HA ) 0.0 0.0 2.7 assign(resid 27 and name HN )(resid 26 and name HB+ ) 0.0 0.0 4.8 assign(resid 27 and name HN )(resid 26 and name HD++ ) 0.0 0.0 4.7 assign(resid 27 and name HN )(resid 26 and name HG ) 0.0 0.0 4.0 assign(resid 27 and name HN )(resid 28 and name HN ) 3.2 0.0 3.0 assign(resid 28 and name HN )(resid 27 and name HA ) 0.0 0.0 2.7 assign(resid 28 and name HN )(resid 27 and name HB1 ) 0.0 0.0 4.0 assign(resid 28 and name HN )(resid 27 and name HB2 ) 0.0 0.0 3.2 assign(resid 29 and name HN )(resid 28 and name HA ) 0.0 0.0 5.0 assign(resid 29 and name HN )(resid 28 and name HB+ ) 0.0 0.0 3.5 assign(resid 29 and name HN )(resid 28 and name HG+ ) 0.0 0.0 4.0 assign(resid 29 and name HN )(resid 28 and name HN ) 0.0 0.0 3.2 assign(resid 29 and name HN )(resid 30 and name HN ) 0.0 0.0 3.2 assign(resid 30 and name HN )(resid 29 and name HA ) 0.0 0.0 4.0 assign(resid 30 and name HN )(resid 29 and name HB+ ) 0.0 0.0 3.5 assign(resid 30 and name HN )(resid 31 and name HN ) 0.0 0.0 3.2 assign(resid 31 and name HN )(resid 30 and name HA ) 0.0 0.0 4.0 assign(resid 31 and name HN )(resid 30 and name HB+ ) 0.0 0.0 4.8 assign(resid 31 and name HN )(resid 32 and name HN ) 0.0 0.0 3.2 assign(resid 32 and name HN )(resid 31 and name HA ) 0.0 0.0 4.0 assign(resid 32 and name HN )(resid 31 and name HB+ ) 0.0 0.0 3.5 assign(resid 32 and name HN )(resid 31 and name HG+ ) 0.0 0.0 3.5 assign(resid 32 and name HN )(resid 33 and name HN ) 0.0 0.0 3.2 assign(resid 33 and name HN )(resid 32 and name HA ) 0.0 0.0 4.0 assign(resid 34 and name HN )(resid 33 and name HB+ ) 0.0 0.0 4.0 assign(resid 34 and name HN )(resid 33 and name HA ) 0.0 0.0 4.0 assign(resid 34 and name HN )(resid 33 and name HD1+ ) 0.0 0.0 5.8 assign(resid 34 and name HN )(resid 33 and name HD2+ ) 0.0 0.0 4.8 assign(resid 34 and name HN )(resid 33 and name HG ) 0.0 0.0 3.2 assign(resid 34 and name HN )(resid 33 and name HN ) 0.0 0.0 2.7 assign(resid 35 and name HN )(resid 34 and name HA ) 0.0 0.0 4.0 assign(resid 35 and name HN )(resid 34 and name HD1+ ) 0.0 0.0 5.8 assign(resid 35 and name HN )(resid 34 and name HD2+ ) 0.0 0.0 5.8 assign(resid 35 and name HN )(resid 34 and name HN ) 0.0 0.0 2.7 assign(resid 35 and name HN )(resid 36 and name HN ) 0.0 0.0 2.7 assign(resid 36 and name HN )(resid 35 and name HA ) 0.0 0.0 4.0 assign(resid 36 and name HN )(resid 35 and name HB+ ) 0.0 0.0 4.0 assign(resid 36 and name HN )(resid 37 and name HN ) 3.2 0.0 3.0 assign(resid 37 and name HN )(resid 36 and name HA ) 0.0 0.0 2.7 assign(resid 37 and name HN )(resid 36 and name HB+ ) 0.0 0.0 4.0 assign(resid 37 and name HN )(resid 38 and name HN 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assign(resid 41 and name HN )(resid 42 and name HN ) 3.2 0.0 3.0 assign(resid 42 and name HN )(resid 41 and name HA ) 0.0 0.0 2.7 assign(resid 42 and name HN )(resid 41 and name HB ) 0.0 0.0 5.0 assign(resid 42 and name HN )(resid 41 and name HG1+ ) 0.0 0.0 3.5 assign(resid 42 and name HN )(resid 41 and name HG2+ ) 0.0 0.0 4.8 assign(resid 42 and name HN )(resid 43 and name HN ) 3.2 0.0 3.0 assign(resid 43 and name HN )(resid 42 and name HA ) 0.0 0.0 2.7 assign(resid 43 and name HN )(resid 42 and name HG++ ) 0.0 0.0 4.7 assign(resid 43 and name HN )(resid 44 and name HN ) 3.2 0.0 3.0 assign(resid 44 and name HN )(resid 43 and name HA ) 0.0 0.0 2.7 assign(resid 44 and name HN )(resid 43 and name HG+ ) 0.0 0.0 4.0 assign(resid 44 and name HN )(resid 45 and name HN ) 3.2 0.0 3.0 assign(resid 45 and name HN )(resid 44 and name HA ) 0.0 0.0 2.7 assign(resid 45 and name HN )(resid 44 and name HB ) 0.0 0.0 5.0 assign(resid 45 and name HN )(resid 44 and name HD1+ ) 0.0 0.0 5.8 assign(resid 45 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name HN )(resid 160 and name HN ) 0.0 0.0 3.2 assign(resid 160 and name HA )(resid 161 and name HD+ ) 0.0 0.0 3.5 assign(resid 160 and name HB )(resid 161 and name HD+ ) 0.0 0.0 4.0 assign(resid 160 and name HN )(resid 159 and name HA ) 0.0 0.0 3.2 assign(resid 160 and name HN )(resid 159 and name HB+ ) 0.0 0.0 4.8 assign(resid 160 and name HN )(resid 159 and name HD+ ) 0.0 0.0 5.8 assign(resid 160 and name HN )(resid 159 and name HG+ ) 0.0 0.0 4.8 assign(resid 160 and name HN )(resid 161 and name HD+ ) 0.0 0.0 4.8 assign(resid 162 and name HN )(resid 161 and name HA ) 0.0 0.0 2.7 assign(resid 162 and name HN )(resid 161 and name HB1 ) 0.0 0.0 4.0 assign(resid 162 and name HN )(resid 161 and name HB2 ) 0.0 0.0 5.0 assign(resid 162 and name HN )(resid 163 and name HN ) 3.2 0.0 3.0 assign(resid 163 and name HN )(resid 162 and name HA ) 0.0 0.0 2.7 assign(resid 163 and name HN )(resid 162 and name HB ) 0.0 0.0 2.7 assign(resid 163 and name HN )(resid 162 and name HG1+ ) 0.0 0.0 4.8 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assign(resid 163 and name HN )(resid 92 and name HA ) 0.0 0.0 5.0 assign(resid 163 and name HN )(resid 92 and name HB ) 0.0 0.0 5.0 assign(resid 163 and name HN )(resid 93 and name HB+ ) 0.0 0.0 5.8 assign(resid 163 and name HN )(resid 94 and name HA ) 0.0 0.0 3.2 assign(resid 163 and name HN )(resid 94 and name HG1+ ) 0.0 0.0 5.8 assign(resid 164 and name HN )(resid 126 and name HN ) 0.0 0.0 5.0 assign(resid 164 and name HN )(resid 128 and name HA ) 0.0 0.0 4.0 assign(resid 166 and name HA )(resid 121 and name HE21 ) 0.0 0.0 3.2 assign(resid 166 and name HA )(resid 121 and name HE22 ) 0.0 0.0 3.2 assign(resid 166 and name HA )(resid 125 and name HD1+ ) 0.0 0.0 4.8 assign(resid 166 and name HA )(resid 125 and name HG2+ ) 0.0 0.0 5.8 assign(resid 166 and name HN )(resid 125 and name HD1+ ) 0.0 0.0 4.0 assign(resid 168 and name HN )(resid 121 and name HE21 ) 0.0 0.0 3.2 assign(resid 168 and name HN )(resid 121 and name HE22 ) 0.0 0.0 4.0 assign(resid 168 and name HN )(resid 121 and name 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)(resid 117 and name HG+ ) 0.0 0.0 4.0 assign(resid 173 and name HN )(resid 101 and name HA ) 0.0 0.0 4.0 assign(resid 173 and name HN )(resid 101 and name HB+ ) 0.0 0.0 4.8 assign(resid 173 and name HN )(resid 102 and name HD1 ) 0.0 0.0 5.0 assign(resid 173 and name HN )(resid 102 and name HD2 ) 0.0 0.0 5.0 assign(resid 177 and name HA )(resid 103 and name HA ) 0.0 0.0 4.0 assign(resid 177 and name HN )(resid 103 and name HA ) 0.0 0.0 4.0 ! ! inter-domain (1-92 to 93-185) (31) ! assign(resid 41 and name HG2+ )(resid 161 and name HG+ ) 0.0 0.0 5.6 assign(resid 51 and name HN )(resid 130 and name HD2+ ) 0.0 0.0 4.8 assign(resid 51 and name HN )(resid 130 and name HB+ ) 0.0 0.0 5.8 assign(resid 51 and name HN )(resid 130 and name HD1+ ) 0.0 0.0 5.8 assign(resid 51 and name HA )(resid 161 and name HB1 ) 0.0 0.0 5.0 assign(resid 51 and name HB )(resid 128 and name HB+ ) 0.0 0.0 5.8 assign(resid 51 and name HG2+ )(resid 129 and name HA ) 0.0 0.0 4.0 assign(resid 51 and name HG2+ )(resid 161 and name HD+ ) 0.0 0.0 6.6 assign(resid 51 and name HG1+ )(resid 161 and name HG+ ) 0.0 0.0 5.6 assign(resid 51 and name HG1+ )(resid 161 and name HB+ ) 0.0 0.0 5.6 assign(resid 51 and name HG2+ )(resid 130 and name HB+ ) 0.0 0.0 5.6 assign(resid 51 and name HG1+ )(resid 130 and name HB+ ) 0.0 0.0 5.8 assign(resid 51 and name HG1+ )(resid 128 and name HA ) 0.0 0.0 5.8 assign(resid 51 and name HG2+ )(resid 128 and name HB+ ) 0.0 0.0 5.6 assign(resid 51 and name HG2+ )(resid 130 and name HG ) 0.0 0.0 4.8 assign(resid 52 and name HN )(resid 161 and name HG+ ) 0.0 0.0 5.8 assign(resid 130 and name HN )(resid 51 and name HG1+ ) 0.0 0.0 5.8 assign(resid 130 and name HN )(resid 51 and name HG2+ ) 0.0 0.0 4.8 assign(resid 130 and name HD2+ )(resid 49 and name HB+ ) 0.0 0.0 5.6 assign(resid 130 and name HD2+ )(resid 43 and name HG+ ) 0.0 0.0 6.6 assign(resid 130 and name HD1+ )(resid 50 and name HA ) 0.0 0.0 5.8 assign(resid 130 and name HD2+ )(resid 50 and name HA ) 0.0 0.0 4.8 assign(resid 130 and name HD2+ )(resid 51 and name HG1+ ) 0.0 0.0 4.8 assign(resid 130 and name HD1+ )(resid 51 and name HG2+ ) 0.0 0.0 5.6 assign(resid 130 and name HD2+ )(resid 51 and name HG2+ ) 0.0 0.0 5.6 assign(resid 134 and name HN )(resid 50 and name HG2+ ) 0.0 0.0 5.8 assign(resid 134 and name HN )(resid 76 and name HA ) 0.0 0.0 5.0 assign(resid 134 and name HN )(resid 76 and name HB+ ) 0.0 0.0 4.8 assign(resid 161 and name HD+ )(resid 43 and name HB+ ) 0.0 0.0 4.8 assign(resid 76 and name HD21 )(resid 134 and name HN ) 0.0 0.0 5.0 assign(resid 76 and name HD22 )(resid 134 and name HN ) 0.0 0.0 5.0 !
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