NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | in_recoord | stage | position | program | type | subtype | subsubtype |
|
|
2184 |
1bip   |
cing | recoord | 1-original | 3 | XPLOR/CNS | distance | NOE | simple |
! =========== HN-HN ====================
assign (resid 2 and name HN ) (resid 1 and name HT# ) 2.8 0.3 2.0
assign (resid 3 and name HN ) (resid 2 and name HN ) 3.4 0.3 0.3
assign (resid 4 and name HN ) (resid 3 and name HN ) 4.2 0.6 0.8
assign (resid 5 and name HN ) (resid 4 and name HN ) 2.8 0.3 0.3
assign (resid 6 and name HN ) (resid 5 and name HN ) 4.2 0.6 0.8
assign (resid 7 and name HN ) (resid 6 and name HN ) 4.2 0.6 0.8
assign (resid 8 and name HD# ) (resid 7 and name HN ) 4.2 0.6 50.0
assign (resid 10 and name HN ) (resid 9 and name HN ) 2.8 0.3 0.3
assign (resid 11 and name HN ) (resid 10 and name HN ) 4.2 0.6 0.8
assign (resid 12 and name HN ) (resid 11 and name HN ) 3.8 0.3 0.3
assign (resid 15 and name HN ) (resid 14 and name HN ) 4.2 0.6 0.8
assign (resid 18 and name HN ) (resid 17 and name HN ) 2.9 0.3 0.3
assign (resid 19 and name HN ) (resid 18 and name HN ) 2.8 0.3 0.3
assign (resid 20 and name HN ) (resid 19 and name HN ) 2.8 0.3 0.3
assign (resid 21 and name HN ) (resid 20 and name HN ) 2.8 0.3 0.3
assign (resid 22 and name HN ) (resid 21 and name HN ) 2.8 0.3 0.3
assign (resid 23 and name HN ) (resid 22 and name HN ) 2.8 0.3 0.3
assign (resid 24 and name HN ) (resid 23 and name HN ) 2.8 0.3 0.3
assign (resid 25 and name HN ) (resid 24 and name HN ) 2.8 0.3 0.3
assign (resid 26 and name HN ) (resid 25 and name HN ) 2.8 0.3 0.3
assign (resid 27 and name HN ) (resid 26 and name HN ) 2.8 0.3 0.3
assign (resid 28 and name HN ) (resid 27 and name HN ) 2.8 0.3 0.3
assign (resid 29 and name HN ) (resid 28 and name HN ) 2.8 0.3 0.3
assign (resid 30 and name HN ) (resid 29 and name HN ) 2.3 0.3 0.3
assign (resid 42 and name HN ) (resid 41 and name HN ) 2.8 0.3 0.3
assign (resid 43 and name HN ) (resid 42 and name HN ) 2.8 0.3 0.3
assign (resid 44 and name HN ) (resid 43 and name HN ) 2.8 0.3 0.3
assign (resid 45 and name HN ) (resid 44 and name HN ) 2.8 0.3 0.3
assign (resid 46 and name HN ) (resid 45 and name HN ) 2.8 0.3 0.3
assign (resid 47 and name HN ) (resid 46 and name HN ) 2.8 0.3 0.3
assign (resid 48 and name HN ) (resid 47 and name HN ) 2.8 0.3 0.3
assign (resid 49 and name HN ) (resid 48 and name HN ) 2.8 0.3 0.3
assign (resid 50 and name HN ) (resid 49 and name HN ) 2.8 0.3 0.3
assign (resid 51 and name HN ) (resid 50 and name HN ) 2.8 0.3 0.3
assign (resid 52 and name HD# ) (resid 51 and name HN ) 4.2 0.6 1.8
assign (resid 54 and name HN ) (resid 53 and name HN ) 2.8 0.3 2.0
assign (resid 55 and name HN ) (resid 54 and name HN ) 2.8 0.3 2.0
assign (resid 56 and name HN ) (resid 55 and name HN ) 3.0 0.3 0.3
assign (resid 57 and name HN ) (resid 56 and name HN ) 4.2 0.6 0.8
assign (resid 58 and name HN ) (resid 57 and name HN ) 4.2 0.6 0.8
assign (resid 59 and name HN ) (resid 58 and name HN ) 3.6 0.3 0.3
assign (resid 60 and name HN ) (resid 59 and name HN ) 3.5 0.3 0.3
assign (resid 61 and name HN ) (resid 60 and name HN ) 3.1 0.3 0.3
assign (resid 62 and name HN ) (resid 61 and name HN ) 2.8 0.3 0.3
assign (resid 63 and name HN ) (resid 62 and name HN ) 2.8 0.3 0.3
assign (resid 64 and name HN ) (resid 63 and name HN ) 2.8 0.3 0.3
assign (resid 65 and name HN ) (resid 64 and name HN ) 2.8 0.3 0.3
assign (resid 66 and name HN ) (resid 65 and name HN ) 2.8 0.3 0.3
assign (resid 67 and name HN ) (resid 66 and name HN ) 4.5 2.6 0.8
assign (resid 68 and name HN ) (resid 67 and name HN ) 4.5 0.6 0.8
assign (resid 69 and name HN ) (resid 68 and name HN ) 4.5 0.6 0.8
assign (resid 70 and name HN ) (resid 69 and name HN ) 4.5 0.6 0.8
assign (resid 71 and name HN ) (resid 70 and name HN ) 2.7 0.3 0.3
assign (resid 72 and name HN ) (resid 71 and name HN ) 2.5 0.3 0.3
assign (resid 73 and name HN ) (resid 72 and name HN ) 2.3 0.3 0.3
assign (resid 74 and name HN ) (resid 73 and name HN ) 4.5 0.6 0.8
assign (resid 75 and name HN ) (resid 74 and name HN ) 4.5 0.6 0.8
assign (resid 76 and name HN ) (resid 75 and name HN ) 4.5 0.6 0.8
assign (resid 77 and name HN ) (resid 76 and name HN ) 4.5 0.6 0.8
assign (resid 78 and name HN ) (resid 77 and name HN ) 3.2 0.3 0.3
assign (resid 79 and name HN ) (resid 78 and name HN ) 2.8 0.3 0.3
assign (resid 80 and name HN ) (resid 79 and name HN ) 4.2 0.6 0.8
assign (resid 81 and name HN ) (resid 80 and name HN ) 4.2 0.6 50.0
assign (resid 82 and name HN ) (resid 81 and name HN ) 4.2 0.6 0.8
assign (resid 85 and name HN ) (resid 84 and name HN ) 2.4 0.3 0.3
assign (resid 88 and name HN ) (resid 87 and name HN ) 2.8 0.3 0.3
assign (resid 89 and name HN ) (resid 88 and name HN ) 2.8 0.3 0.3
assign (resid 90 and name HN ) (resid 89 and name HN ) 2.8 0.3 0.3
assign (resid 91 and name HN ) (resid 90 and name HN ) 2.8 0.3 0.3
assign (resid 92 and name HN ) (resid 91 and name HN ) 2.8 0.3 0.3
assign (resid 93 and name HN ) (resid 92 and name HN ) 2.8 0.3 0.3
assign (resid 94 and name HN ) (resid 93 and name HN ) 2.8 0.3 0.3
assign (resid 97 and name HN ) (resid 96 and name HN ) 2.8 0.3 2.0
assign (resid 98 and name HN ) (resid 97 and name HN ) 3.5 0.3 0.3
assign (resid 99 and name HN ) (resid 98 and name HN ) 3.2 0.3 0.3
assign (resid 100 and name HN ) (resid 99 and name HN ) 4.2 0.6 0.8
assign (resid 101 and name HN ) (resid 100 and name HN ) 3.6 0.3 0.3
assign (resid 102 and name HN ) (resid 101 and name HN ) 2.8 0.3 0.3
assign (resid 103 and name HN ) (resid 102 and name HN ) 3.4 0.3 0.3
assign (resid 104 and name HN ) (resid 103 and name HN ) 2.8 0.3 0.3
assign (resid 105 and name HN ) (resid 104 and name HN ) 3.6 0.3 0.3
assign (resid 106 and name HN ) (resid 105 and name HN ) 3.4 0.3 0.3
assign (resid 107 and name HN ) (resid 106 and name HN ) 4.2 0.6 50.0
assign (resid 108 and name HN ) (resid 107 and name HN ) 4.2 0.6 50.0
assign (resid 109 and name HN ) (resid 108 and name HN ) 2.8 0.3 2.0
assign (resid 110 and name HN ) (resid 109 and name HN ) 3.2 0.3 0.3
assign (resid 111 and name HN ) (resid 110 and name HN ) 2.8 0.3 2.0
assign (resid 112 and name HD# ) (resid 111 and name HN ) 2.8 0.3 3.0
assign (resid 114 and name HN ) (resid 113 and name HN ) 4.2 0.6 50.0
assign (resid 115 and name HN ) (resid 114 and name HN ) 4.2 0.6 50.0
assign (resid 116 and name HN ) (resid 115 and name HN ) 2.8 0.3 2.0
assign (resid 117 and name HN ) (resid 116 and name HN ) 2.8 0.3 2.0
assign (resid 118 and name HN ) (resid 117 and name HN ) 2.8 0.3 2.0
assign (resid 119 and name HN ) (resid 118 and name HN ) 3.4 0.3 0.3
assign (resid 120 and name HN ) (resid 119 and name HN ) 2.8 0.3 2.0
assign (resid 121 and name HN ) (resid 120 and name HN ) 3.4 0.3 0.3
assign (resid 122 and name HN ) (resid 121 and name HN ) 2.8 0.3 2.0
! =========== Seq HN-HA ====================
assign (resid 2 and name HN ) (resid 1 and name HA ) 2.3 0.3 1.5
assign (resid 3 and name HN ) (resid 2 and name HA ) 3.4 0.3 0.3
assign (resid 4 and name HN ) (resid 3 and name HA# ) 2.8 0.3 1.3
assign (resid 5 and name HN ) (resid 4 and name HA ) 2.8 0.3 0.3
assign (resid 6 and name HN ) (resid 5 and name HA ) 2.8 0.3 0.3
assign (resid 7 and name HN ) (resid 6 and name HA ) 2.5 0.3 0.3
assign (resid 8 and name HD# ) (resid 7 and name HA ) 2.5 0.3 1.3
assign (resid 9 and name HN ) (resid 8 and name HA ) 2.8 0.3 0.3
assign (resid 10 and name HN ) (resid 9 and name HA1 ) 3.4 0.3 0.3
assign (resid 10 and name HN ) (resid 9 and name HA2 ) 3.1 0.3 0.3
assign (resid 11 and name HN ) (resid 10 and name HA ) 3.0 0.3 0.3
assign (resid 12 and name HN ) (resid 11 and name HA ) 3.4 0.3 0.3
assign (resid 13 and name HD1 ) (resid 12 and name HN ) 3.9 0.3 0.3
assign (resid 13 and name HD2 ) (resid 12 and name HN ) 4.5 0.6 0.8
assign (resid 13 and name HD1 ) (resid 12 and name HA ) 2.4 0.3 0.3
assign (resid 13 and name HD2 ) (resid 12 and name HA ) 3.0 0.3 0.3
assign (resid 14 and name HN ) (resid 13 and name HA ) 2.3 0.3 0.3
assign (resid 15 and name HN ) (resid 14 and name HA ) 2.8 0.3 0.3
assign (resid 16 and name HD1 ) (resid 15 and name HN ) 2.4 0.3 0.3
assign (resid 16 and name HD2 ) (resid 15 and name HN ) 3.0 0.3 0.3
assign (resid 16 and name HD1 ) (resid 15 and name HA ) 3.0 0.3 0.3
assign (resid 16 and name HD2 ) (resid 15 and name HA ) 2.5 0.3 0.3
assign (resid 17 and name HN ) (resid 16 and name HA ) 2.3 0.3 0.3
assign (resid 18 and name HN ) (resid 17 and name HA ) 3.0 0.3 0.5
assign (resid 19 and name HN ) (resid 18 and name HA ) 3.1 0.3 0.3
assign (resid 20 and name HN ) (resid 19 and name HA ) 3.2 0.3 0.3
assign (resid 21 and name HN ) (resid 20 and name HA ) 3.4 0.3 0.3
assign (resid 22 and name HN ) (resid 21 and name HA ) 3.4 0.3 0.3
assign (resid 23 and name HN ) (resid 22 and name HA ) 3.4 0.3 0.3
assign (resid 24 and name HN ) (resid 23 and name HA ) 3.4 0.3 0.3
assign (resid 25 and name HN ) (resid 24 and name HA ) 3.4 0.3 0.3
assign (resid 26 and name HN ) (resid 25 and name HA ) 3.4 0.3 0.3
assign (resid 27 and name HN ) (resid 26 and name HA ) 3.5 0.3 0.3
assign (resid 28 and name HN ) (resid 27 and name HA ) 3.5 0.3 0.3
assign (resid 29 and name HN ) (resid 28 and name HA ) 3.4 0.3 0.3
assign (resid 42 and name HN ) (resid 41 and name HA ) 3.4 0.3 0.3
assign (resid 43 and name HN ) (resid 42 and name HA ) 3.4 0.3 0.3
assign (resid 44 and name HN ) (resid 43 and name HA ) 3.4 0.3 0.3
assign (resid 45 and name HN ) (resid 44 and name HA ) 3.4 0.3 0.3
assign (resid 46 and name HN ) (resid 45 and name HA ) 3.4 0.3 0.3
assign (resid 47 and name HN ) (resid 46 and name HA ) 3.4 0.3 0.3
assign (resid 48 and name HN ) (resid 47 and name HA ) 3.4 0.3 0.3
assign (resid 49 and name HN ) (resid 48 and name HA ) 3.4 0.3 0.3
assign (resid 50 and name HN ) (resid 49 and name HA ) 3.4 0.3 0.3
assign (resid 51 and name HN ) (resid 50 and name HA ) 3.4 0.3 0.3
assign (resid 52 and name HD# ) (resid 51 and name HA ) 2.3 0.3 1.3
assign (resid 53 and name HN ) (resid 52 and name HA ) 2.3 0.3 0.3
assign (resid 54 and name HN ) (resid 53 and name HA ) 2.3 0.3 1.5
assign (resid 55 and name HN ) (resid 54 and name HA ) 2.3 0.3 1.5
assign (resid 56 and name HN ) (resid 55 and name HA ) 3.7 0.3 0.3
assign (resid 57 and name HN ) (resid 56 and name HA ) 4.2 0.6 0.8
assign (resid 58 and name HN ) (resid 57 and name HA ) 3.9 0.3 0.3
assign (resid 59 and name HN ) (resid 58 and name HA ) 3.5 0.3 0.3
assign (resid 60 and name HN ) (resid 59 and name HA ) 3.1 0.3 0.3
assign (resid 61 and name HN ) (resid 60 and name HA ) 3.4 0.3 0.3
assign (resid 62 and name HN ) (resid 61 and name HA ) 3.4 0.3 0.3
assign (resid 63 and name HN ) (resid 62 and name HA ) 3.4 0.3 0.3
assign (resid 64 and name HN ) (resid 63 and name HA ) 3.4 0.3 0.3
assign (resid 65 and name HN ) (resid 64 and name HA ) 3.4 0.3 0.3
assign (resid 66 and name HN ) (resid 65 and name HA ) 3.4 0.3 0.3
assign (resid 66 and name HN ) (resid 66 and name HA1) 3.0 0.3 0.3
assign (resid 66 and name HN ) (resid 66 and name HA2) 2.5 0.3 0.3
assign (resid 67 and name HN ) (resid 66 and name HA1) 2.7 0.3 0.3
assign (resid 67 and name HN ) (resid 66 and name HA2) 2.5 0.3 0.3
assign (resid 68 and name HN ) (resid 67 and name HA ) 2.3 0.3 0.3
assign (resid 69 and name HN ) (resid 68 and name HA ) 2.3 0.3 0.3
assign (resid 70 and name HN ) (resid 69 and name HA ) 2.6 0.3 0.3
assign (resid 71 and name HN ) (resid 70 and name HA ) 3.0 0.3 0.3
assign (resid 72 and name HN ) (resid 71 and name HA ) 3.3 0.3 0.3
assign (resid 73 and name HN ) (resid 72 and name HA1 ) 3.7 0.3 0.3
assign (resid 73 and name HN ) (resid 72 and name HA2 ) 3.7 0.3 0.3
assign (resid 74 and name HN ) (resid 73 and name HA ) 2.3 0.3 0.3
assign (resid 75 and name HN ) (resid 74 and name HA ) 2.3 0.3 0.3
assign (resid 76 and name HN ) (resid 75 and name HA ) 2.3 0.3 0.3
assign (resid 77 and name HN ) (resid 76 and name HA1 ) 2.3 0.3 0.3
assign (resid 77 and name HN ) (resid 76 and name HA2 ) 3.0 0.3 0.3
assign (resid 78 and name HN ) (resid 77 and name HA ) 2.8 0.3 0.3
assign (resid 79 and name HN ) (resid 78 and name HA ) 3.4 0.3 0.3
assign (resid 80 and name HN ) (resid 79 and name HA ) 2.2 0.3 0.3
assign (resid 81 and name HN ) (resid 80 and name HA ) 2.2 0.3 0.3
assign (resid 82 and name HN ) (resid 81 and name HA ) 2.2 0.3 0.3
assign (resid 83 and name HD1 ) (resid 82 and name HN ) 4.2 0.6 50.0
assign (resid 83 and name HD2 ) (resid 82 and name HN ) 4.2 0.6 50.0
assign (resid 83 and name HD1 ) (resid 82 and name HA ) 2.2 0.3 0.3
assign (resid 83 and name HD2 ) (resid 82 and name HA ) 3.0 0.3 0.3
assign (resid 84 and name HN ) (resid 83 and name HA ) 2.2 0.3 0.3
assign (resid 84 and name HN ) (resid 84 and name HA1) 3.0 0.3 0.3
assign (resid 84 and name HN ) (resid 84 and name HA2) 2.3 0.3 0.3
assign (resid 85 and name HN ) (resid 84 and name HA1) 3.8 0.3 0.3
assign (resid 85 and name HN ) (resid 84 and name HA2) 3.4 0.3 0.3
assign (resid 86 and name HD1 ) (resid 85 and name HN ) 3.7 0.3 0.3
assign (resid 86 and name HD2 ) (resid 85 and name HN ) 4.2 0.6 0.8
assign (resid 86 and name HD1 ) (resid 85 and name HA ) 2.8 0.3 0.3
assign (resid 86 and name HD2 ) (resid 85 and name HA ) 2.6 0.3 0.3
assign (resid 87 and name HN ) (resid 86 and name HA ) 2.8 0.3 0.3
assign (resid 88 and name HN ) (resid 87 and name HA ) 3.4 0.3 0.3
assign (resid 89 and name HN ) (resid 88 and name HA ) 3.4 0.3 0.3
assign (resid 90 and name HN ) (resid 89 and name HA ) 3.4 0.3 0.3
assign (resid 91 and name HN ) (resid 90 and name HA ) 3.4 0.3 0.3
assign (resid 92 and name HN ) (resid 91 and name HA ) 3.4 0.3 0.3
assign (resid 93 and name HN ) (resid 92 and name HA ) 3.4 0.3 0.3
assign (resid 94 and name HN ) (resid 93 and name HA ) 3.4 0.3 0.3
assign (resid 96 and name HN ) (resid 95 and name HA ) 2.3 0.3 1.5
assign (resid 97 and name HN ) (resid 96 and name HA ) 2.3 0.3 1.5
assign (resid 98 and name HN ) (resid 97 and name HA ) 3.4 0.3 0.3
assign (resid 99 and name HN ) (resid 98 and name HA ) 3.4 0.3 0.3
assign (resid 100 and name HN ) (resid 99 and name HA ) 3.0 0.3 0.3
assign (resid 101 and name HN ) (resid 100 and name HA ) 3.2 0.3 0.3
assign (resid 102 and name HN ) (resid 101 and name HA ) 3.4 0.3 0.3
assign (resid 103 and name HN ) (resid 102 and name HA ) 3.4 0.3 0.3
assign (resid 104 and name HN ) (resid 103 and name HA ) 3.4 0.3 0.3
assign (resid 105 and name HN ) (resid 104 and name HA ) 3.5 0.3 0.3
assign (resid 106 and name HN ) (resid 105 and name HA ) 3.0 0.3 0.3
assign (resid 107 and name HN ) (resid 106 and name HA ) 2.5 0.3 0.3
assign (resid 108 and name HN ) (resid 107 and name HA ) 2.8 0.3 0.3
assign (resid 109 and name HN ) (resid 108 and name HA ) 3.4 0.3 0.3
assign (resid 110 and name HN ) (resid 109 and name HA ) 3.5 0.3 0.3
assign (resid 111 and name HN ) (resid 110 and name HA1) 3.5 0.3 0.3
assign (resid 111 and name HN ) (resid 110 and name HA2) 3.0 0.3 0.3
assign (resid 112 and name HD# ) (resid 111 and name HA1) 2.6 0.3 0.3
assign (resid 112 and name HD# ) (resid 111 and name HA2) 2.3 0.3 0.3
assign (resid 113 and name HN ) (resid 112 and name HA ) 2.3 0.3 0.3
assign (resid 114 and name HN ) (resid 113 and name HA ) 2.8 0.3 0.3
assign (resid 115 and name HN ) (resid 114 and name HA ) 2.8 0.3 0.3
assign (resid 116 and name HN ) (resid 115 and name HA ) 2.3 0.3 1.5
assign (resid 117 and name HN ) (resid 116 and name HA ) 3.5 0.3 0.3
assign (resid 118 and name HN ) (resid 117 and name HA ) 3.4 0.3 0.3
assign (resid 119 and name HN ) (resid 118 and name HA ) 3.4 0.3 0.3
assign (resid 120 and name HN ) (resid 119 and name HA# ) 2.8 0.3 1.3
assign (resid 121 and name HN ) (resid 120 and name HA ) 2.8 0.3 0.3
assign (resid 122 and name HN ) (resid 121 and name HA# ) 2.8 0.3 1.3
! ============================================================================
! =========== Seqential of side chains and other intraresidual ================
!14
assign (resid 14 and name HN ) (resid 14 and name HB1) 3.0 0.3 0.3
assign (resid 14 and name HN ) (resid 14 and name HB2) 2.4 0.3 0.3
assign (resid 14 and name HA ) (resid 14 and name HB1) 2.4 0.3 0.3
assign (resid 14 and name HA ) (resid 14 and name HB2) 3.4 0.3 0.3
assign (resid 14 and name HD2) (resid 14 and name HB1) 3.6 0.3 0.3
assign (resid 14 and name HD2) (resid 14 and name HB2) 2.8 0.3 0.3
assign (resid 15 and name HN ) (resid 14 and name HB1) 3.4 0.3 0.3
assign (resid 15 and name HN ) (resid 14 and name HB2) 4.2 0.6 0.8
!22
assign (resid 22 and name HN ) (resid 22 and name HB1) 3.6 0.3 0.3
assign (resid 22 and name HN ) (resid 22 and name HB2) 2.8 0.3 0.3
assign (resid 22 and name HA ) (resid 22 and name HB1) 2.4 0.3 0.3
assign (resid 22 and name HA ) (resid 22 and name HB2) 3.4 0.3 0.3
assign (resid 22 and name HD1 ) (resid 22 and name HB1) 3.2 0.3 0.3
assign (resid 22 and name HD1 ) (resid 22 and name HB2) 2.8 0.3 0.3
assign (resid 22 and name HE3 ) (resid 22 and name HB1) 2.4 0.3 0.3
assign (resid 22 and name HE3 ) (resid 22 and name HB2) 3.5 0.3 0.3
!29
assign (resid 29 and name HN ) (resid 29 and name HB1) 3.6 0.3 0.3
assign (resid 29 and name HN ) (resid 29 and name HB2) 2.7 0.3 0.3
assign (resid 29 and name HA ) (resid 29 and name HB1) 2.5 0.3 0.3
assign (resid 29 and name HA ) (resid 29 and name HB2) 3.2 0.3 0.3
assign (resid 30 and name HN ) (resid 29 and name HB1) 4.2 0.6 50.0
assign (resid 30 and name HN ) (resid 29 and name HB2) 3.6 0.3 0.3
!64
assign (resid 64 and name HN ) (resid 64 and name HB1) 2.5 0.3 0.3
assign (resid 64 and name HN ) (resid 64 and name HB2) 2.3 0.3 0.3
assign (resid 64 and name HA ) (resid 64 and name HB1) 3.4 0.3 0.3
assign (resid 64 and name HA ) (resid 64 and name HB2) 2.4 0.3 0.3
assign (resid 65 and name HN ) (resid 64 and name HB1) 2.6 0.3 0.3
assign (resid 65 and name HN ) (resid 64 and name HB2) 4.2 0.6 50.0
assign (resid 65 and name HN ) (resid 64 and name HG#) 4.2 0.6 1.8
!65
assign (resid 65 and name HN ) (resid 65 and name HB1) 3.8 0.3 0.3
assign (resid 65 and name HN ) (resid 65 and name HB2) 2.8 0.3 0.3
assign (resid 65 and name HA ) (resid 65 and name HB1) 2.4 0.3 0.3
assign (resid 65 and name HA ) (resid 65 and name HB2) 3.4 0.3 0.3
assign (resid 66 and name HN ) (resid 65 and name HB1) 4.2 0.6 50.0
assign (resid 66 and name HN ) (resid 65 and name HB2) 4.2 0.6 0.8
!74
assign (resid 74 and name HN ) (resid 74 and name HB1) 3.2 0.3 0.3
assign (resid 74 and name HN ) (resid 74 and name HB2) 2.6 0.3 0.3
assign (resid 74 and name HA ) (resid 74 and name HB1) 2.4 0.3 0.3
assign (resid 74 and name HA ) (resid 74 and name HB2) 3.0 0.3 0.3
assign (resid 74 and name HD2) (resid 74 and name HB1) 4.2 0.6 0.8
assign (resid 74 and name HD2) (resid 74 and name HB2) 3.4 1.0 0.3
assign (resid 75 and name HN ) (resid 74 and name HB1) 2.4 0.3 0.3
assign (resid 75 and name HN ) (resid 74 and name HB2) 3.5 0.3 0.3
assign (resid 81 and name HN ) (resid 80 and name HB1) 2.3 0.3 0.3
assign (resid 81 and name HN ) (resid 80 and name HB2) 3.2 0.3 0.3
!81
assign (resid 81 and name HN ) (resid 81 and name HB1) 3.3 0.3 0.3
assign (resid 81 and name HN ) (resid 81 and name HB2) 2.5 0.3 0.3
assign (resid 81 and name HA ) (resid 81 and name HB1) 2.4 0.3 0.3
assign (resid 81 and name HA ) (resid 81 and name HB2) 3.4 0.3 0.3
assign (resid 82 and name HN ) (resid 81 and name HB1) 3.4 0.3 0.3
assign (resid 82 and name HN ) (resid 81 and name HB2) 4.2 0.6 0.8
!87
assign (resid 87 and name HN ) (resid 87 and name HB1) 3.3 0.3 0.3
assign (resid 87 and name HN ) (resid 87 and name HB2) 2.4 0.3 0.3
assign (resid 87 and name HA ) (resid 87 and name HB1) 2.6 0.3 0.3
assign (resid 87 and name HA ) (resid 87 and name HB2) 3.2 0.3 0.3
assign (resid 88 and name HN ) (resid 87 and name HB1) 3.4 0.3 0.3
assign (resid 88 and name HN ) (resid 87 and name HB2) 2.8 0.3 0.3
assign (resid 5 and name HN ) (resid 4 and name HG2# ) 4.2 0.6 1.8
assign (resid 11 and name HN ) (resid 10 and name HB#) 4.2 0.6 1.8
assign (resid 11 and name HN ) (resid 10 and name HG#) 4.2 0.6 1.8
!13
assign (resid 13 and name HA ) (resid 13 and name HB1) 2.2 0.3 0.3
assign (resid 13 and name HA ) (resid 13 and name HB2) 2.7 0.3 0.3
assign (resid 14 and name HN ) (resid 13 and name HB1) 3.0 0.3 0.3
assign (resid 14 and name HN ) (resid 13 and name HB2) 2.4 0.3 0.3
assign (resid 14 and name HD2 ) (resid 13 and name HB1) 4.2 0.6 0.8
assign (resid 14 and name HD2 ) (resid 13 and name HB2) 3.8 0.3 0.3
assign (resid 14 and name HD2 ) (resid 13 and name HA ) 3.5 0.3 0.3
!18
assign (resid 18 and name HN ) (resid 18 and name HB1) 2.5 0.3 0.3
assign (resid 18 and name HN ) (resid 18 and name HB2) 4.0 0.3 0.4
assign (resid 19 and name HN ) (resid 18 and name HB1) 4.2 0.6 0.8
assign (resid 19 and name HN ) (resid 18 and name HB2) 4.2 0.6 0.8
assign (resid 20 and name HN ) (resid 19 and name HB1) 2.8 0.3 0.3
assign (resid 20 and name HN ) (resid 19 and name HB2) 3.5 0.3 0.3
assign (resid 22 and name HN ) (resid 21 and name HB1) 3.4 0.3 2.3
assign (resid 21 and name HE ) (resid 22 and name HH2 ) 4.2 0.6 0.8
assign (resid 21 and name HE ) (resid 22 and name HZ2 ) 4.2 0.6 0.8
assign (resid 23 and name HN ) (resid 22 and name HB1) 4.2 0.6 0.8
assign (resid 23 and name HD1) (resid 23 and name HB#) 2.6 0.3 1.3
assign (resid 23 and name HD2) (resid 23 and name HB#) 2.6 0.3 1.3
assign (resid 24 and name HN ) (resid 23 and name HB1) 3.2 0.3 0.3
assign (resid 24 and name HN ) (resid 23 and name HD# ) 2.8 0.3 2.3
assign (resid 24 and name HN ) (resid 23 and name HE# ) 4.2 0.6 2.8
assign (resid 24 and name HA ) (resid 23 and name HE# ) 4.2 0.6 2.8
!24
assign (resid 24 and name HN ) (resid 24 and name HB ) 2.3 0.3 0.3
assign (resid 24 and name HN ) (resid 24 and name HG1#) 4.0 0.6 1.8
assign (resid 24 and name HN ) (resid 24 and name HG2#) 2.0 0.3 1.3
assign (resid 25 and name HN ) (resid 24 and name HB ) 2.8 0.3 0.3
assign (resid 25 and name HN ) (resid 24 and name HG1#) 4.0 0.6 1.8
assign (resid 25 and name HN ) (resid 24 and name HG2#) 4.0 0.6 1.8
assign (resid 27 and name HN ) (resid 26 and name HB) 2.8 0.3 0.3
assign (resid 27 and name HN ) (resid 26 and name HG2#) 3.0 0.3 1.3
assign (resid 27 and name HA ) (resid 26 and name HA ) 4.2 0.6 0.8
assign (resid 27 and name HA ) (resid 26 and name HG2# ) 4.2 0.6 1.8
!assign (resid 27 and name HD# ) (resid 26 and name HG2# ) 4.2 0.6 2.8
assign (resid 28 and name HN ) (resid 27 and name HB#) 3.0 0.3 1.3
assign (resid 29 and name HN ) (resid 28 and name HB) 3.5 0.3 0.3
assign (resid 29 and name HN ) (resid 28 and name HG2#) 4.2 0.3 1.3
!assign (resid 34 and name HA ) (resid 33 and name HA ) 4.2 0.6 0.8
assign (resid 36 and name HN ) (resid 35 and name HB# ) 3.0 0.3 1.3
assign (resid 36 and name HN ) (resid 35 and name HD* ) 3.0 0.3 2.7
assign (resid 37 and name HN ) (resid 36 and name HB#) 2.6 0.3 1.3
assign (resid 38 and name HN ) (resid 37 and name HB) 2.6 0.3 0.3
assign (resid 38 and name HN ) (resid 37 and name HG2#) 3.5 0.3 1.3
assign (resid 39 and name HN ) (resid 38 and name HG1) 3.4 0.3 2.3
!assign (resid 39 and name HN ) (resid 38 and name HG2) 3.4 0.3 2.3
assign (resid 40 and name HN ) (resid 39 and name HB1) 2.8 0.3 2.3
!assign (resid 40 and name HN ) (resid 39 and name HB2) 2.8 0.3 2.3
assign (resid 40 and name HN ) (resid 39 and name HG1) 4.2 0.3 2.3
!assign (resid 40 and name HN ) (resid 39 and name HG2) 4.2 0.3 2.3
assign (resid 41 and name HN ) (resid 40 and name HB2) 2.9 0.3 0.3
assign (resid 41 and name HN ) (resid 40 and name HG#) 4.2 0.6 1.8
assign (resid 42 and name HN ) (resid 41 and name HB1) 3.0 0.3 2.3
!assign (resid 42 and name HN ) (resid 41 and name HB2) 3.4 0.3 2.3
assign (resid 43 and name HN ) (resid 42 and name HB#) 2.8 0.3 1.3
assign (resid 44 and name HN ) (resid 43 and name HB1) 3.0 0.3 2.3
!assign (resid 44 and name HN ) (resid 43 and name HB2) 3.0 0.3 2.3
assign (resid 44 and name HN ) (resid 43 and name HD1 ) 4.2 0.6 0.8
assign (resid 44 and name HN ) (resid 43 and name HD2 ) 4.2 0.6 0.8
assign (resid 45 and name HN ) (resid 44 and name HB1) 4.2 0.6 0.8
assign (resid 45 and name HN ) (resid 44 and name HB2) 3.0 0.3 0.3
assign (resid 46 and name HN ) (resid 45 and name HB1) 3.5 0.3 0.3
assign (resid 46 and name HN ) (resid 45 and name HB2) 3.3 0.3 0.3
assign (resid 47 and name HN ) (resid 46 and name HB1) 3.2 0.3 0.3
assign (resid 47 and name HN ) (resid 46 and name HB2) 3.2 0.3 0.3
assign (resid 48 and name HN ) (resid 47 and name HB1) 4.2 0.6 0.8
assign (resid 48 and name HN ) (resid 47 and name HB2) 3.0 0.3 0.3
assign (resid 48 and name HN ) (resid 47 and name HG1) 4.2 0.6 0.8
assign (resid 48 and name HN ) (resid 47 and name HG2) 4.2 0.6 0.8
assign (resid 49 and name HN ) (resid 48 and name HB1) 3.0 0.3 0.3
assign (resid 49 and name HN ) (resid 48 and name HB2) 3.8 0.3 0.3
!assign (resid 49 and name HN ) (resid 48 and name HG ) 4.2 0.6 0.8
!assign (resid 49 and name HN ) (resid 48 and name HD*) 2.8 0.3 2.7
!assign (resid 49 and name HA ) (resid 48 and name HD* ) 3.4 0.3 2.7
assign (resid 50 and name HN ) (resid 49 and name HB#) 2.8 0.3 1.3
assign (resid 50 and name HN ) (resid 49 and name HG#) 3.8 0.3 1.3
assign (resid 51 and name HN ) (resid 50 and name HB#) 3.0 0.3 1.3
!52
assign (resid 53 and name HN ) (resid 52 and name HB1) 4.2 0.6 50.0
assign (resid 53 and name HN ) (resid 52 and name HB2) 3.4 0.3 0.3
!assign (resid 54 and name HD# ) (resid 53 and name HN ) 3.8 0.3 1.3
!assign (resid 54 and name HD# ) (resid 53 and name HB#) 4.2 0.6 3.8
!assign (resid 60 and name HN ) (resid 59 and name HB# ) 2.8 0.3 1.3
!assign (resid 61 and name HN ) (resid 60 and name HB ) 3.4 0.3 0.3
!assign (resid 61 and name HN ) (resid 60 and name HG*) 4.2 0.6 3.2
assign (resid 63 and name HN ) (resid 62 and name HB ) 3.0 0.3 0.3
assign (resid 63 and name HN ) (resid 62 and name HG1# ) 4.2 0.6 1.8
assign (resid 68 and name HN ) (resid 67 and name HG1# ) 3.4 0.3 1.3
assign (resid 68 and name HN ) (resid 67 and name HG2# ) 2.2 0.3 1.3
!68
assign (resid 68 and name HN ) (resid 68 and name HB ) 2.3 0.3 0.3
assign (resid 68 and name HN ) (resid 68 and name HG2# ) 2.5 0.3 1.3
assign (resid 68 and name HN ) (resid 68 and name HG1# ) 3.5 0.3 1.3
assign (resid 69 and name HN ) (resid 68 and name HB ) 4.0 0.6 0.8
assign (resid 69 and name HN ) (resid 68 and name HG2# ) 4.0 0.6 1.8
assign (resid 69 and name HN ) (resid 68 and name HG1# ) 2.8 0.3 1.3
assign (resid 70 and name HN ) (resid 69 and name HB ) 2.3 0.3 0.3
assign (resid 70 and name HN ) (resid 69 and name HG2# ) 3.2 0.3 1.3
assign (resid 71 and name HN ) (resid 70 and name HB#) 2.6 0.3 1.3
assign (resid 72 and name HN ) (resid 71 and name HB1) 4.2 0.6 0.8
assign (resid 72 and name HN ) (resid 71 and name HB2) 3.6 0.3 0.3
!73
assign (resid 73 and name HN ) (resid 73 and name HB1) 3.6 0.3 0.3
assign (resid 73 and name HN ) (resid 73 and name HB2) 2.5 0.3 0.3
assign (resid 74 and name HN ) (resid 73 and name HB1) 3.2 1.0 0.3
assign (resid 74 and name HN ) (resid 73 and name HB2) 4.0 0.6 0.8
assign (resid 74 and name HD2) (resid 73 and name HA ) 3.2 0.3 0.3
assign (resid 79 and name HN ) (resid 78 and name HB#) 4.2 0.6 1.8
assign (resid 82 and name HA ) (resid 81 and name HA ) 4.2 0.6 0.8
!83
assign (resid 83 and name HA ) (resid 83 and name HB1) 2.2 0.3 0.3
assign (resid 83 and name HA ) (resid 83 and name HB2) 3.0 0.3 0.3
assign (resid 84 and name HN ) (resid 83 and name HB1) 4.2 0.6 0.8
assign (resid 84 and name HN ) (resid 83 and name HB2) 3.8 0.3 0.3
assign (resid 86 and name HG#) (resid 85 and name HA ) 3.4 0.3 1.3
!86
assign (resid 87 and name HN ) (resid 86 and name HB1) 4.2 0.6 0.8
assign (resid 88 and name HN ) (resid 86 and name HB1) 3.4 0.3 0.3
assign (resid 88 and name HN ) (resid 87 and name HG#) 3.0 0.3 1.3
assign (resid 89 and name HN ) (resid 88 and name HB#) 3.2 0.3 1.3
!89
assign (resid 89 and name HN ) (resid 89 and name HB ) 2.0 0.3 0.3
assign (resid 89 and name HN ) (resid 89 and name HG1#) 3.0 0.3 1.3
assign (resid 89 and name HN ) (resid 89 and name HG2#) 2.1 0.3 1.3
assign (resid 90 and name HN ) (resid 89 and name HB ) 3.0 0.3 0.3
assign (resid 90 and name HN ) (resid 89 and name HG1#) 3.0 0.3 1.3
assign (resid 90 and name HN ) (resid 89 and name HG2#) 3.0 0.3 1.3
assign (resid 90 and name HE2# ) (resid 89 and name HG1# ) 4.2 0.6 2.8
assign (resid 90 and name HE2# ) (resid 89 and name HG2# ) 4.2 0.6 2.8
assign (resid 92 and name HN ) (resid 91 and name HB1) 3.2 0.3 0.3
assign (resid 92 and name HN ) (resid 91 and name HB2) 3.8 0.3 0.3
assign (resid 93 and name HN ) (resid 92 and name HB# ) 2.8 0.3 1.3
assign (resid 93 and name HD# ) (resid 94 and name HA ) 2.3 0.3 2.3
assign (resid 93 and name HE# ) (resid 94 and name HA ) 3.4 0.3 2.3
assign (resid 93 and name HD# ) (resid 94 and name HB# ) 4.2 0.6 3.8
assign (resid 94 and name HN ) (resid 93 and name HB1 ) 3.2 0.3 0.3
!assign (resid 95 and name HD# ) (resid 94 and name HB#) 3.6 0.3 2.3
assign (resid 98 and name HG2#) (resid 99 and name HN ) 4.2 0.6 1.8
assign (resid 99 and name HN ) (resid 98 and name HB ) 4.2 0.6 0.8
assign (resid 99 and name HN ) (resid 98 and name HG1#) 3.6 0.3 1.3
assign (resid 99 and name HN ) (resid 98 and name HG2#) 3.0 0.3 1.3
assign (resid 99 and name HA ) (resid 98 and name HG2# ) 3.6 0.6 1.3
assign (resid 100 and name HN ) (resid 99 and name HB ) 2.8 0.3 0.3
assign (resid 100 and name HN ) (resid 99 and name HG2#) 4.2 0.6 1.8
!assign (resid 100 and name HB# ) (resid 99 and name HA ) 4.2 0.6 1.8
!assign (resid 100 and name HG# ) (resid 99 and name HA ) 4.2 0.6 1.8
!assign (resid 100 and name HB# ) (resid 99 and name HB ) 4.2 0.6 1.8
!assign (resid 100 and name HG# ) (resid 99 and name HB ) 4.2 0.6 1.8
assign (resid 101 and name HN ) (resid 100 and name HB#) 2.8 0.3 1.3
assign (resid 101 and name HN ) (resid 100 and name HG#) 4.2 0.6 1.8
assign (resid 102 and name HN ) (resid 101 and name HG*) 2.8 0.3 2.7
assign (resid 102 and name HN ) (resid 101 and name HB ) 4.2 0.6 0.8
assign (resid 103 and name HN ) (resid 102 and name HB#) 2.4 0.3 1.3
!assign (resid 103 and name HN ) (resid 102 and name HB2) 2.6 0.3 0.3
assign (resid 104 and name HN ) (resid 103 and name HB1) 4.2 0.6 0.8
assign (resid 104 and name HN ) (resid 103 and name HB2) 4.2 0.6 0.8
assign (resid 107 and name HN ) (resid 106 and name HB# ) 3.6 0.3 1.3
assign (resid 107 and name HA ) (resid 108 and name HG2# ) 4.2 0.6 1.8
assign (resid 107 and name HB ) (resid 108 and name HG2# ) 3.4 0.3 1.3
assign (resid 108 and name HN ) (resid 107 and name HB ) 2.6 0.3 0.3
assign (resid 108 and name HN ) (resid 107 and name HG2#) 3.8 0.3 1.3
!assign (resid 108 and name HG2#) (resid 107 and name HG2#) 3.4 0.3 2.3
assign (resid 109 and name HN ) (resid 108 and name HG2#) 2.8 0.3 1.3
assign (resid 109 and name HD2 ) (resid 108 and name HG2# ) 2.8 0.3 1.3
assign (resid 109 and name HE1 ) (resid 108 and name HG2# ) 3.6 0.3 1.3
assign (resid 110 and name HN ) (resid 109 and name HB1) 4.2 0.6 0.8
assign (resid 110 and name HN ) (resid 109 and name HB2) 4.2 0.6 0.8
assign (resid 119 and name HN ) (resid 118 and name HB1) 3.4 0.3 0.3
assign (resid 119 and name HN ) (resid 118 and name HB2) 4.2 0.6 0.8
assign (resid 121 and name HN ) (resid 120 and name HB#) 3.0 0.3 1.3
!! NOEs from Loop resid 22 to 41
! ***************************************************************************************
! ************************************* 32 ******************************************
assign (resid 22 and name HE3 ) (resid 32 and name HA1) 3.0 0.3 0.3
assign (resid 22 and name HE3 ) (resid 32 and name HA2) 2.0 0.3 50.0
assign (resid 32 and name HN ) (resid 32 and name HA1 ) 2.6 0.3 0.3
assign (resid 32 and name HN ) (resid 32 and name HA2 ) 2.3 0.3 0.3
assign (resid 22 and name HE3 ) (resid 33 and name HD1 ) 3.8 0.3 0.4
assign (resid 22 and name HE3 ) (resid 33 and name HD2 ) 3.5 0.3 0.3
assign (resid 22 and name HD1 ) (resid 33 and name HD2 ) 4.2 0.6 0.8
assign (resid 22 and name HD1 ) (resid 33 and name HD1 ) 2.0 0.3 50.0
assign (resid 30 and name HN ) (resid 29 and name HA ) 2.8 0.3 0.3
assign (resid 30 and name HN ) (resid 30 and name HA1 ) 2.9 0.3 0.3
assign (resid 30 and name HN ) (resid 30 and name HA2 ) 2.7 0.3 0.3
assign (resid 31 and name HN ) (resid 30 and name HA1 ) 3.6 0.3 0.3
assign (resid 31 and name HN ) (resid 30 and name HA2 ) 2.9 0.3 0.3
assign (resid 32 and name HN ) (resid 31 and name HA ) 2.5 0.3 0.3
assign (resid 33 and name HD2 ) (resid 32 and name HN ) 4.2 0.6 50.0
assign (resid 33 and name HD1 ) (resid 32 and name HN ) 4.2 0.6 50.0
assign (resid 33 and name HD1 ) (resid 32 and name HA1 ) 3.7 0.3 0.5
assign (resid 33 and name HD2 ) (resid 32 and name HA1 ) 3.1 0.3 0.3
assign (resid 33 and name HD1 ) (resid 32 and name HA2 ) 3.1 0.3 0.3
assign (resid 33 and name HD2 ) (resid 32 and name HA2 ) 2.8 0.3 0.3
assign (resid 34 and name HN ) (resid 33 and name HA ) 2.5 0.3 0.3
assign (resid 33 and name HA ) (resid 33 and name HB1) 2.5 0.3 0.3
assign (resid 33 and name HA ) (resid 33 and name HB2) 3.0 0.3 0.3
assign (resid 34 and name HN ) (resid 33 and name HB1) 3.8 0.3 0.3
assign (resid 34 and name HN ) (resid 33 and name HB2) 3.0 0.3 0.3
assign (resid 34 and name HN ) (resid 33 and name HD1) 4.2 0.6 50.0
assign (resid 34 and name HN ) (resid 33 and name HD2) 4.2 0.6 50.0
assign (resid 35 and name HN ) (resid 34 and name HA ) 2.5 0.3 0.3
assign (resid 35 and name HN ) (resid 34 and name HB1) 4.2 0.6 50.0
assign (resid 35 and name HN ) (resid 34 and name HB2) 4.2 0.6 50.0
assign (resid 36 and name HN ) (resid 35 and name HA ) 2.5 0.3 0.3
assign (resid 37 and name HN ) (resid 36 and name HA ) 2.8 0.3 0.3
assign (resid 38 and name HN ) (resid 37 and name HA ) 3.4 0.3 0.3
assign (resid 39 and name HN ) (resid 38 and name HA ) 3.4 0.3 0.3
assign (resid 40 and name HN ) (resid 39 and name HA ) 3.4 0.3 0.3
assign (resid 41 and name HN ) (resid 40 and name HA ) 3.4 0.3 0.3
assign (resid 31 and name HN ) (resid 30 and name HN ) 2.8 0.3 0.3
assign (resid 32 and name HN ) (resid 31 and name HN ) 4.2 0.6 0.8
assign (resid 35 and name HN ) (resid 34 and name HN ) 3.6 0.3 0.3
assign (resid 36 and name HN ) (resid 35 and name HN ) 4.2 0.6 0.8
assign (resid 37 and name HN ) (resid 36 and name HN ) 4.2 0.6 0.8
assign (resid 38 and name HN ) (resid 37 and name HN ) 2.8 0.3 0.3
assign (resid 39 and name HN ) (resid 38 and name HN ) 2.8 0.3 0.3
assign (resid 40 and name HN ) (resid 39 and name HN ) 2.8 0.3 0.3
assign (resid 41 and name HN ) (resid 40 and name HN ) 2.8 0.3 0.3
!31
assign (resid 31 and name HN ) (resid 31 and name HB ) 2.5 0.3 0.3
assign (resid 31 and name HN ) (resid 31 and name HG1#) 4.0 0.6 1.8
assign (resid 31 and name HN ) (resid 31 and name HG2#) 2.8 0.3 1.3
assign (resid 32 and name HN ) (resid 31 and name HB ) 4.0 0.6 0.8
assign (resid 32 and name HN ) (resid 31 and name HG1#) 2.7 0.3 1.3
assign (resid 32 and name HN ) (resid 31 and name HG2#) 3.4 0.3 1.3
!95
assign (resid 93 and name HN ) (resid 95 and name HD1) 4.2 0.6 0.8
assign (resid 93 and name HN ) (resid 95 and name HD2) 4.2 0.6 50.0
assign (resid 94 and name HN ) (resid 95 and name HD1) 2.7 0.3 0.3
assign (resid 94 and name HN ) (resid 95 and name HD2) 2.4 0.3 0.3
assign (resid 94 and name HA ) (resid 95 and name HD#) 4.2 0.6 50.0
assign (resid 113 and name HD# ) (resid 112 and name HD#) 3.8 0.3 2.8
assign (resid 113 and name HE# ) (resid 112 and name HD#) 3.4 0.3 2.8
assign (resid 113 and name HZ ) (resid 112 and name HD#) 4.2 0.6 1.8
Contact the webmaster for help, if required. Friday, May 3, 2024 3:27:35 PM GMT (wattos1)