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 |
|
|
7250 |
1k45   |
5181 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
!cbm_restraints.tbl ! unambiguous NOE restraints assign ( resid 1 and name he+ ) ( resid 165 and name hb+ ) 3.3 1.4 0.0 assign ( resid 3 and name hg2+ ) ( resid 4 and name hn ) 3.8 1.9 0.0 assign ( resid 3 and name hg1+ ) ( resid 4 and name hn ) 2.8 0.9 0.0 assign ( resid 3 and name hn ) ( resid 4 and name hn ) 5.5 3.6 0.0 assign ( resid 3 and name hg2+ ) ( resid 5 and name hn ) 3.3 1.4 0.0 assign ( resid 3 and name hg1+ ) ( resid 5 and name hn ) 2.8 0.9 0.0 assign ( resid 3 and name hg2+ ) ( resid 164 and name hn ) 4.2 2.3 0.0 assign ( resid 3 and name hg1+ ) ( resid 164 and name hn ) 3.3 1.4 0.0 assign ( resid 3 and name hg1+ ) ( resid 165 and name ha ) 5.5 3.6 0.0 assign ( resid 4 and name ha ) ( resid 4 and name hn ) 3.3 1.4 0.0 assign ( resid 4 and name hb+ ) ( resid 4 and name hn ) 2.8 0.9 0.0 assign ( resid 4 and name ha ) ( resid 5 and name hn ) 3.8 1.9 0.0 assign ( resid 4 and name hn ) ( resid 5 and name hn ) 2.8 0.9 0.0 assign ( resid 4 and name ha ) ( resid 78 and name hg1+ ) 5.5 3.6 0.0 assign ( resid 4 and name hb+ ) ( resid 78 and name ha ) 4.2 2.3 0.0 assign ( resid 4 and name hn ) ( resid 78 and name hg1+ ) 5.5 3.6 0.0 assign ( resid 4 and name ha ) ( resid 79 and name hb+ ) 5.5 3.6 0.0 assign ( resid 4 and name ha ) ( resid 79 and name hn ) 3.3 1.4 0.0 assign ( resid 4 and name hb+ ) ( resid 80 and name hg1+ ) 2.8 0.9 0.0 assign ( resid 4 and name hb+ ) ( resid 86 and name hd+ ) 4.2 2.3 0.0 assign ( resid 4 and name hn ) ( resid 164 and name hb ) 4.2 2.3 0.0 assign ( resid 4 and name hn ) ( resid 164 and name hg2+ ) 5.5 3.6 0.0 assign ( resid 4 and name hn ) ( resid 164 and name hn ) 5.5 3.6 0.0 assign ( resid 4 and name hn ) ( resid 165 and name ha ) 4.2 2.3 0.0 assign ( resid 4 and name hn ) ( resid 165 and name hb+ ) 4.2 2.3 0.0 assign ( resid 5 and name ha ) ( resid 5 and name hb+ ) 3.8 1.9 0.0 assign ( resid 5 and name ha ) ( resid 5 and name hn ) 3.8 1.9 0.0 assign ( resid 5 and name hb+ ) ( resid 5 and name hd2+ ) 5.5 3.6 0.0 assign ( resid 5 and name hb+ ) ( resid 5 and name hn ) 4.2 2.3 0.0 assign ( resid 5 and name ha ) ( resid 6 and name hn ) 3.3 1.4 0.0 assign ( resid 5 and name hb+ ) ( resid 6 and name hn ) 3.8 1.9 0.0 assign ( resid 5 and name hd2+ ) ( resid 8 and name ha+ ) 5.5 3.6 0.0 assign ( resid 5 and name hd2+ ) ( resid 8 and name hn ) 3.8 1.9 0.0 assign ( resid 5 and name hd2+ ) ( resid 9 and name hn ) 5.5 3.6 0.0 assign ( resid 5 and name hd2+ ) ( resid 75 and name hb+ ) 5.5 3.6 0.0 assign ( resid 5 and name ha ) ( resid 78 and name hg2+ ) 3.8 1.9 0.0 assign ( resid 5 and name ha ) ( resid 78 and name hg1+ ) 3.8 1.9 0.0 assign ( resid 5 and name ha ) ( resid 78 and name ha ) 4.2 2.3 0.0 assign ( resid 5 and name hb+ ) ( resid 78 and name hg2+ ) 3.8 1.9 0.0 assign ( resid 5 and name hn ) ( resid 78 and name hg2+ ) 5.5 3.6 0.0 assign ( resid 5 and name hn ) ( resid 78 and name hg1+ ) 5.5 3.6 0.0 assign ( resid 5 and name ha ) ( resid 79 and name hn ) 5.5 3.6 0.0 assign ( resid 5 and name hd2+ ) ( resid 162 and name hn ) 5.5 3.6 0.0 assign ( resid 5 and name hd2+ ) ( resid 162 and name hd2+ ) 4.2 2.3 0.0 assign ( resid 5 and name hb+ ) ( resid 164 and name hd1+ ) 5.5 3.6 0.0 assign ( resid 5 and name hn ) ( resid 164 and name hb ) 3.3 1.4 0.0 assign ( resid 5 and name hn ) ( resid 164 and name hn ) 5.5 3.6 0.0 assign ( resid 6 and name ha ) ( resid 6 and name hb ) 4.2 2.3 0.0 assign ( resid 6 and name ha ) ( resid 6 and name hg1+ ) 3.8 1.9 0.0 assign ( resid 6 and name ha ) ( resid 6 and name hg2+ ) 2.8 0.9 0.0 assign ( resid 6 and name ha ) ( resid 6 and name hn ) 4.2 2.3 0.0 assign ( resid 6 and name ha ) ( resid 6 and name hd1+ ) 3.8 1.9 0.0 assign ( resid 6 and name hb ) ( resid 6 and name hn ) 2.8 0.9 0.0 assign ( resid 6 and name hd1+ ) ( resid 6 and name hn ) 4.2 2.3 0.0 assign ( resid 6 and name hg1+ ) ( resid 6 and name hn ) 3.8 1.9 0.0 assign ( resid 6 and name hg2+ ) ( resid 6 and name hn ) 5.5 3.6 0.0 assign ( resid 6 and name hg2+ ) ( resid 7 and name hd2+ ) 5.5 3.6 0.0 assign ( resid 6 and name hg2+ ) ( resid 7 and name ha ) 3.8 1.9 0.0 assign ( resid 6 and name hg2+ ) ( resid 7 and name hb+ ) 4.2 2.3 0.0 assign ( resid 6 and name ha ) ( resid 8 and name hn ) 5.5 3.6 0.0 assign ( resid 6 and name hg2+ ) ( resid 26 and name hg+ ) 3.3 1.4 0.0 assign ( resid 6 and name hb ) ( resid 27 and name ha+ ) 4.2 2.3 0.0 assign ( resid 6 and name hg2+ ) ( resid 27 and name ha+ ) 3.8 1.9 0.0 assign ( resid 6 and name hn ) ( resid 27 and name ha+ ) 5.5 3.6 0.0 assign ( resid 6 and name hd1+ ) ( resid 77 and name hd+ ) 4.2 2.3 0.0 assign ( resid 6 and name hn ) ( resid 78 and name hg2+ ) 5.5 3.6 0.0 assign ( resid 6 and name hd1+ ) ( resid 79 and name hd2+ ) 4.2 2.3 0.0 assign ( resid 7 and name ha ) ( resid 7 and name hb+ ) 3.3 1.4 0.0 assign ( resid 7 and name hb+ ) ( resid 7 and name hd2+ ) 3.8 1.9 0.0 assign ( resid 7 and name hb+ ) ( resid 7 and name hn ) 4.2 2.3 0.0 assign ( resid 7 and name hd2+ ) ( resid 7 and name hn ) 5.5 3.6 0.0 assign ( resid 7 and name ha ) ( resid 8 and name hn ) 3.3 1.4 0.0 assign ( resid 7 and name hb+ ) ( resid 8 and name hn ) 5.5 3.6 0.0 assign ( resid 7 and name hn ) ( resid 8 and name hn ) 3.3 1.4 0.0 assign ( resid 7 and name hd2+ ) ( resid 10 and name ha ) 5.5 3.6 0.0 assign ( resid 7 and name hd2+ ) ( resid 12 and name hn ) 3.8 1.9 0.0 assign ( resid 7 and name hd2+ ) ( resid 12 and name hb+ ) 5.5 3.6 0.0 assign ( resid 7 and name hd2+ ) ( resid 13 and name hg1 ) 4.2 2.3 0.0 assign ( resid 7 and name hd2+ ) ( resid 13 and name hg2+ ) 5.5 3.6 0.0 assign ( resid 7 and name hd2+ ) ( resid 13 and name hn ) 5.5 3.6 0.0 assign ( resid 7 and name hd2+ ) ( resid 25 and name hg1+ ) 3.8 1.9 0.0 assign ( resid 7 and name hd2+ ) ( resid 26 and name hn ) 5.5 3.6 0.0 assign ( resid 7 and name hd2+ ) ( resid 28 and name hd1 ) 5.5 3.6 0.0 assign ( resid 8 and name ha+ ) ( resid 8 and name hn ) 4.2 2.3 0.0 assign ( resid 8 and name hn ) ( resid 9 and name hn ) 3.3 1.4 0.0 assign ( resid 8 and name hn ) ( resid 10 and name hn ) 5.5 3.6 0.0 assign ( resid 8 and name ha+ ) ( resid 28 and name he1 ) 2.8 0.9 0.0 assign ( resid 9 and name ha+ ) ( resid 9 and name hn ) 3.8 1.9 0.0 assign ( resid 9 and name ha+ ) ( resid 10 and name hn ) 5.5 3.6 0.0 !removed 04/06/01 assign ( resid 9 and name hn ) ( resid 10 and name ha ) 4.2 2.3 0.0 assign ( resid 9 and name hn ) ( resid 10 and name hn ) 2.8 0.9 0.0 assign ( resid 9 and name ha+ ) ( resid 11 and name hn ) 5.5 3.6 0.0 assign ( resid 9 and name ha+ ) ( resid 161 and name hn ) 3.3 1.4 0.0 assign ( resid 10 and name ha ) ( resid 10 and name hb+ ) 3.3 1.4 0.0 assign ( resid 10 and name ha ) ( resid 10 and name hn ) 2.8 0.9 0.0 assign ( resid 10 and name ha ) ( resid 11 and name hn ) 3.3 1.4 0.0 assign ( resid 10 and name hn ) ( resid 11 and name hn ) 3.3 1.4 0.0 assign ( resid 10 and name ha ) ( resid 25 and name hg1+ ) 5.5 3.6 0.0 assign ( resid 10 and name hn ) ( resid 28 and name he1 ) 5.5 3.6 0.0 assign ( resid 11 and name ha ) ( resid 11 and name hb+ ) 3.3 1.4 0.0 assign ( resid 11 and name ha ) ( resid 11 and name hg+ ) 5.5 3.6 0.0 assign ( resid 11 and name ha ) ( resid 11 and name hn ) 3.8 1.9 0.0 assign ( resid 11 and name hb+ ) ( resid 11 and name hn ) 2.8 0.9 0.0 assign ( resid 11 and name hg+ ) ( resid 11 and name hn ) 2.8 0.9 0.0 assign ( resid 11 and name ha ) ( resid 12 and name hn ) 5.5 3.6 0.0 assign ( resid 11 and name hn ) ( resid 12 and name hn ) 2.8 0.9 0.0 assign ( resid 11 and name ha ) ( resid 13 and name hn ) 5.5 3.6 0.0 assign ( resid 11 and name ha ) ( resid 44 and name hg++ ) 5.5 3.6 0.0 assign ( resid 11 and name ha ) ( resid 55 and name hd+ ) 3.8 1.9 0.0 assign ( resid 11 and name ha ) ( resid 55 and name he+ ) 5.5 3.6 0.0 assign ( resid 11 and name ha ) ( resid 55 and name hg+ ) 5.5 3.6 0.0 assign ( resid 12 and name hb+ ) ( resid 12 and name hn ) 2.8 0.9 0.0 assign ( resid 12 and name hb+ ) ( resid 13 and name hn ) 3.8 1.9 0.0 !removed 04/06/01 assign ( resid 12 and name hn ) ( resid 13 and name hb ) 3.8 1.9 0.0 assign ( resid 12 and name hn ) ( resid 13 and name hn ) 2.8 0.9 0.0 assign ( resid 13 and name ha ) ( resid 13 and name hn ) 5.5 3.6 0.0 assign ( resid 13 and name ha ) ( resid 13 and name hg2+ ) 2.8 0.9 0.0 assign ( resid 13 and name hb ) ( resid 13 and name hn ) 2.8 0.9 0.0 assign ( resid 13 and name hg1 ) ( resid 13 and name hg2+ ) 2.8 0.9 0.0 assign ( resid 13 and name hg2+ ) ( resid 13 and name hn ) 4.2 2.3 0.0 assign ( resid 13 and name ha ) ( resid 14 and name hd+ ) 2.8 0.9 0.0 assign ( resid 13 and name hg1 ) ( resid 14 and name hd+ ) 5.5 3.6 0.0 assign ( resid 13 and name hg2+ ) ( resid 14 and name hd+ ) 2.8 0.9 0.0 assign ( resid 13 and name hg2+ ) ( resid 25 and name hg1+ ) 2.8 0.9 0.0 assign ( resid 13 and name hg1 ) ( resid 26 and name hn ) 3.3 1.4 0.0 assign ( resid 13 and name hg2+ ) ( resid 26 and name hn ) 3.3 1.4 0.0 assign ( resid 14 and name ha ) ( resid 14 and name hb+ ) 2.8 0.9 0.0 assign ( resid 14 and name ha ) ( resid 14 and name hg+ ) 3.8 1.9 0.0 assign ( resid 14 and name hb+ ) ( resid 14 and name hd+ ) 5.5 3.6 0.0 assign ( resid 14 and name hd+ ) ( resid 14 and name hg+ ) 3.3 1.4 0.0 assign ( resid 14 and name ha ) ( resid 15 and name hb+ ) 3.8 1.9 0.0 assign ( resid 14 and name ha ) ( resid 15 and name hn ) 2.8 0.9 0.0 assign ( resid 14 and name hb+ ) ( resid 15 and name hn ) 4.2 2.3 0.0 assign ( resid 14 and name ha ) ( resid 55 and name he+ ) 5.5 3.6 0.0 assign ( resid 15 and name ha ) ( resid 15 and name hn ) 3.8 1.9 0.0 assign ( resid 15 and name hb+ ) ( resid 15 and name hn ) 2.8 0.9 0.0 assign ( resid 15 and name ha ) ( resid 16 and name hn ) 2.8 0.9 0.0 assign ( resid 15 and name hb+ ) ( resid 16 and name ha+ ) 5.5 3.6 0.0 assign ( resid 15 and name hb+ ) ( resid 16 and name hn ) 2.8 0.9 0.0 assign ( resid 15 and name hn ) ( resid 16 and name hn ) 5.5 3.6 0.0 assign ( resid 15 and name ha ) ( resid 44 and name hb ) 3.3 1.4 0.0 assign ( resid 15 and name ha ) ( resid 44 and name hn ) 4.2 2.3 0.0 assign ( resid 15 and name hb+ ) ( resid 44 and name hn ) 5.5 3.6 0.0 assign ( resid 15 and name hb+ ) ( resid 44 and name hb ) 5.5 3.6 0.0 assign ( resid 15 and name hb+ ) ( resid 46 and name ha ) 5.5 3.6 0.0 assign ( resid 15 and name hb+ ) ( resid 46 and name hn ) 3.3 1.4 0.0 assign ( resid 15 and name hb+ ) ( resid 46 and name hg+ ) 3.8 1.9 0.0 assign ( resid 15 and name hb+ ) ( resid 55 and name he+ ) 3.8 1.9 0.0 assign ( resid 15 and name hn ) ( resid 55 and name he+ ) 4.2 2.3 0.0 assign ( resid 16 and name ha+ ) ( resid 16 and name hn ) 3.3 1.4 0.0 assign ( resid 16 and name ha+ ) ( resid 17 and name hn ) 2.8 0.9 0.0 assign ( resid 16 and name hn ) ( resid 17 and name hn ) 3.8 1.9 0.0 assign ( resid 16 and name hn ) ( resid 43 and name hg+ ) 3.3 1.4 0.0 assign ( resid 16 and name hn ) ( resid 44 and name hb ) 2.8 0.9 0.0 assign ( resid 16 and name hn ) ( resid 44 and name hn ) 3.3 1.4 0.0 assign ( resid 17 and name ha ) ( resid 17 and name hn ) 5.5 3.6 0.0 assign ( resid 17 and name ha ) ( resid 18 and name hn ) 2.8 0.9 0.0 assign ( resid 17 and name ha ) ( resid 18 and name hg2+ ) 3.3 1.4 0.0 assign ( resid 17 and name hg1+ ) ( resid 18 and name hn ) 2.8 0.9 0.0 assign ( resid 17 and name hg2+ ) ( resid 18 and name hn ) 2.8 0.9 0.0 assign ( resid 17 and name hg1+ ) ( resid 19 and name hn ) 4.2 2.3 0.0 assign ( resid 17 and name ha ) ( resid 43 and name ha ) 2.8 0.9 0.0 assign ( resid 17 and name ha ) ( resid 43 and name hb+ ) 4.2 2.3 0.0 assign ( resid 17 and name ha ) ( resid 43 and name hn ) 5.5 3.6 0.0 assign ( resid 17 and name hg2+ ) ( resid 43 and name ha ) 3.8 1.9 0.0 assign ( resid 17 and name ha ) ( resid 44 and name hn ) 4.2 2.3 0.0 assign ( resid 17 and name hg2+ ) ( resid 44 and name hn ) 5.5 3.6 0.0 assign ( resid 18 and name ha ) ( resid 18 and name hb ) 4.2 2.3 0.0 assign ( resid 18 and name ha ) ( resid 18 and name hn ) 3.8 1.9 0.0 assign ( resid 18 and name hb ) ( resid 18 and name hn ) 2.8 0.9 0.0 assign ( resid 18 and name hg2+ ) ( resid 18 and name hn ) 2.8 0.9 0.0 assign ( resid 18 and name hg1+ ) ( resid 18 and name hn ) 3.8 1.9 0.0 assign ( resid 18 and name ha ) ( resid 19 and name hg2+ ) 4.2 2.3 0.0 assign ( resid 18 and name ha ) ( resid 19 and name hn ) 2.8 0.9 0.0 assign ( resid 18 and name hg2+ ) ( resid 19 and name hn ) 3.8 1.9 0.0 assign ( resid 18 and name hg1+ ) ( resid 19 and name hn ) 3.3 1.4 0.0 assign ( resid 18 and name hn ) ( resid 19 and name hn ) 5.5 3.6 0.0 assign ( resid 18 and name ha ) ( resid 20 and name hn ) 3.8 1.9 0.0 assign ( resid 18 and name hg1+ ) ( resid 20 and name hn ) 2.8 0.9 0.0 assign ( resid 18 and name hg2+ ) ( resid 42 and name hb1 ) 3.3 1.4 0.0 assign ( resid 18 and name hg2+ ) ( resid 42 and name hb2 ) 3.8 1.9 0.0 assign ( resid 18 and name hg1+ ) ( resid 42 and name hb1 ) 4.2 2.3 0.0 assign ( resid 18 and name hg1+ ) ( resid 42 and name hb2 ) 5.5 3.6 0.0 assign ( resid 18 and name hn ) ( resid 42 and name hb2 ) 4.2 2.3 0.0 assign ( resid 18 and name hg2+ ) ( resid 43 and name ha ) 3.3 1.4 0.0 assign ( resid 18 and name hg2+ ) ( resid 43 and name hn ) 5.5 3.6 0.0 assign ( resid 18 and name hn ) ( resid 43 and name ha ) 3.8 1.9 0.0 assign ( resid 18 and name hn ) ( resid 43 and name hb+ ) 3.8 1.9 0.0 assign ( resid 18 and name hg2+ ) ( resid 44 and name hn ) 3.3 1.4 0.0 assign ( resid 18 and name hn ) ( resid 44 and name hn ) 3.8 1.9 0.0 assign ( resid 19 and name hb ) ( resid 19 and name hn ) 4.2 2.3 0.0 assign ( resid 19 and name hg2+ ) ( resid 19 and name hn ) 3.3 1.4 0.0 assign ( resid 19 and name hg2+ ) ( resid 20 and name hn ) 3.8 1.9 0.0 assign ( resid 19 and name hn ) ( resid 20 and name hn ) 2.8 0.9 0.0 assign ( resid 20 and name hb+ ) ( resid 20 and name hn ) 2.8 0.9 0.0 assign ( resid 20 and name ha ) ( resid 21 and name hn ) 2.8 0.9 0.0 assign ( resid 20 and name ha ) ( resid 21 and name hd2+ ) 5.5 3.6 0.0 assign ( resid 20 and name hb+ ) ( resid 21 and name hn ) 5.5 3.6 0.0 assign ( resid 20 and name hn ) ( resid 21 and name hn ) 4.2 2.3 0.0 assign ( resid 20 and name hb+ ) ( resid 24 and name ha+ ) 5.5 3.6 0.0 assign ( resid 20 and name hb+ ) ( resid 24 and name hn ) 5.5 3.6 0.0 assign ( resid 20 and name hn ) ( resid 24 and name ha+ ) 4.2 2.3 0.0 assign ( resid 21 and name ha ) ( resid 21 and name hb+ ) 3.3 1.4 0.0 assign ( resid 21 and name ha ) ( resid 21 and name hd1+ ) 3.8 1.9 0.0 assign ( resid 21 and name ha ) ( resid 21 and name hn ) 3.3 1.4 0.0 assign ( resid 21 and name hb+ ) ( resid 21 and name hd2+ ) 2.8 0.9 0.0 assign ( resid 21 and name hd2+ ) ( resid 21 and name hn ) 3.3 1.4 0.0 assign ( resid 21 and name hd1+ ) ( resid 21 and name hn ) 2.8 0.9 0.0 assign ( resid 21 and name ha ) ( resid 22 and name hn ) 3.8 1.9 0.0 assign ( resid 21 and name hb+ ) ( resid 22 and name hn ) 3.3 1.4 0.0 !removed 04/06/01 assign ( resid 21 and name hd2+ ) ( resid 22 and name hn ) 2.8 0.9 0.0 assign ( resid 21 and name hn ) ( resid 22 and name hn ) 2.8 0.9 0.0 assign ( resid 21 and name ha ) ( resid 30 and name hb+ ) 5.5 3.6 0.0 assign ( resid 21 and name ha ) ( resid 30 and name hd2+ ) 5.5 3.6 0.0 assign ( resid 21 and name ha ) ( resid 30 and name hd1+ ) 3.3 1.4 0.0 assign ( resid 21 and name hb+ ) ( resid 30 and name hd1+ ) 5.5 3.6 0.0 assign ( resid 21 and name hb+ ) ( resid 30 and name hn ) 3.8 1.9 0.0 assign ( resid 21 and name hd2+ ) ( resid 30 and name hb+ ) 3.3 1.4 0.0 assign ( resid 21 and name hd2+ ) ( resid 30 and name hd1+ ) 2.8 0.9 0.0 assign ( resid 21 and name hd2+ ) ( resid 30 and name hn ) 3.8 1.9 0.0 assign ( resid 21 and name hd1+ ) ( resid 30 and name hn ) 5.5 3.6 0.0 assign ( resid 21 and name hd1+ ) ( resid 31 and name hn ) 5.5 3.6 0.0 assign ( resid 21 and name hd2+ ) ( resid 32 and name hg2+ ) 3.3 1.4 0.0 assign ( resid 21 and name hd1+ ) ( resid 32 and name hn ) 3.3 1.4 0.0 assign ( resid 21 and name hd2+ ) ( resid 42 and name hb1 ) 5.5 3.6 0.0 assign ( resid 21 and name hd2+ ) ( resid 42 and name hb2 ) 5.5 3.6 0.0 assign ( resid 22 and name hb+ ) ( resid 23 and name hg+ ) 2.8 0.9 0.0 assign ( resid 22 and name hb+ ) ( resid 23 and name hn ) 2.8 0.9 0.0 assign ( resid 22 and name hb+ ) ( resid 24 and name hn ) 5.5 3.6 0.0 assign ( resid 22 and name ha ) ( resid 29 and name ha ) 3.8 1.9 0.0 assign ( resid 22 and name ha ) ( resid 30 and name hn ) 3.3 1.4 0.0 assign ( resid 23 and name ha ) ( resid 23 and name hn ) 3.3 1.4 0.0 assign ( resid 23 and name hb+ ) ( resid 23 and name hn ) 3.8 1.9 0.0 assign ( resid 23 and name hg+ ) ( resid 23 and name hn ) 2.8 0.9 0.0 assign ( resid 23 and name ha ) ( resid 24 and name hn ) 5.5 3.6 0.0 assign ( resid 23 and name hg+ ) ( resid 24 and name hn ) 3.8 1.9 0.0 assign ( resid 23 and name hn ) ( resid 24 and name ha+ ) 5.5 3.6 0.0 assign ( resid 23 and name hn ) ( resid 24 and name hn ) 2.8 0.9 0.0 assign ( resid 23 and name ha ) ( resid 25 and name hn ) 5.5 3.6 0.0 assign ( resid 23 and name hn ) ( resid 25 and name hn ) 5.5 3.6 0.0 assign ( resid 24 and name ha+ ) ( resid 24 and name hn ) 3.3 1.4 0.0 assign ( resid 24 and name ha+ ) ( resid 25 and name hn ) 3.8 1.9 0.0 assign ( resid 24 and name hn ) ( resid 25 and name hn ) 2.8 0.9 0.0 assign ( resid 25 and name hb ) ( resid 25 and name hn ) 2.8 0.9 0.0 assign ( resid 25 and name ha ) ( resid 26 and name hn ) 2.8 0.9 0.0 assign ( resid 25 and name hg1+ ) ( resid 26 and name hn ) 3.3 1.4 0.0 assign ( resid 25 and name hb ) ( resid 28 and name hn ) 4.2 2.3 0.0 assign ( resid 25 and name hg1+ ) ( resid 28 and name hn ) 5.5 3.6 0.0 assign ( resid 26 and name ha ) ( resid 26 and name hb+ ) 3.8 1.9 0.0 assign ( resid 26 and name ha ) ( resid 26 and name hg+ ) 3.3 1.4 0.0 assign ( resid 26 and name hb+ ) ( resid 26 and name hn ) 3.3 1.4 0.0 assign ( resid 26 and name ha ) ( resid 27 and name ha+ ) 5.5 3.6 0.0 assign ( resid 26 and name hg+ ) ( resid 27 and name hn ) 3.3 1.4 0.0 assign ( resid 26 and name ha ) ( resid 28 and name hn ) 5.5 3.6 0.0 assign ( resid 27 and name ha+ ) ( resid 27 and name hn ) 3.3 1.4 0.0 assign ( resid 27 and name ha+ ) ( resid 28 and name hn ) 5.5 3.6 0.0 assign ( resid 27 and name hn ) ( resid 28 and name hn ) 2.8 0.9 0.0 assign ( resid 28 and name ha ) ( resid 28 and name hn ) 3.8 1.9 0.0 assign ( resid 28 and name ha ) ( resid 29 and name hn ) 2.8 0.9 0.0 assign ( resid 28 and name hb+ ) ( resid 29 and name hn ) 3.3 1.4 0.0 assign ( resid 28 and name hn ) ( resid 29 and name hn ) 5.5 3.6 0.0 assign ( resid 28 and name hb+ ) ( resid 30 and name hd2+ ) 3.8 1.9 0.0 assign ( resid 28 and name hz2 ) ( resid 57 and name hd2+ ) 5.5 3.6 0.0 assign ( resid 28 and name ha ) ( resid 75 and name ha ) 3.8 1.9 0.0 assign ( resid 28 and name ha ) ( resid 75 and name hb+ ) 5.5 3.6 0.0 assign ( resid 28 and name ha ) ( resid 76 and name hn ) 3.3 1.4 0.0 assign ( resid 28 and name hz2 ) ( resid 145 and name hg2+ ) 3.3 1.4 0.0 assign ( resid 28 and name hz2 ) ( resid 159 and name hg2+ ) 3.3 1.4 0.0 assign ( resid 28 and name hz2 ) ( resid 162 and name hn ) 4.2 2.3 0.0 assign ( resid 29 and name ha ) ( resid 29 and name hb+ ) 3.8 1.9 0.0 assign ( resid 29 and name ha ) ( resid 29 and name hn ) 3.8 1.9 0.0 assign ( resid 29 and name hb+ ) ( resid 29 and name hn ) 3.3 1.4 0.0 assign ( resid 29 and name ha ) ( resid 30 and name hd1+ ) 5.5 3.6 0.0 assign ( resid 29 and name ha ) ( resid 30 and name hn ) 2.8 0.9 0.0 assign ( resid 29 and name hb+ ) ( resid 30 and name hn ) 5.5 3.6 0.0 assign ( resid 29 and name hn ) ( resid 30 and name hd2+ ) 5.5 3.6 0.0 assign ( resid 29 and name hn ) ( resid 30 and name hn ) 5.5 3.6 0.0 assign ( resid 29 and name hn ) ( resid 73 and name ha ) 5.5 3.6 0.0 assign ( resid 29 and name hb+ ) ( resid 74 and name hn ) 5.5 3.6 0.0 assign ( resid 29 and name hn ) ( resid 74 and name hb ) 3.8 1.9 0.0 assign ( resid 29 and name hn ) ( resid 74 and name hg2+ ) 5.5 3.6 0.0 assign ( resid 29 and name hn ) ( resid 74 and name hn ) 3.8 1.9 0.0 assign ( resid 29 and name hn ) ( resid 75 and name ha ) 5.5 3.6 0.0 assign ( resid 29 and name hn ) ( resid 75 and name hb+ ) 5.5 3.6 0.0 assign ( resid 29 and name hn ) ( resid 76 and 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0.9 0.0 assign ( resid 162 and name hb+ ) ( resid 162 and name hd1+ ) 5.5 3.6 0.0 assign ( resid 162 and name hb+ ) ( resid 162 and name hd2+ ) 3.8 1.9 0.0 assign ( resid 162 and name hd1+ ) ( resid 162 and name hn ) 4.2 2.3 0.0 assign ( resid 162 and name hd2+ ) ( resid 162 and name hn ) 4.2 2.3 0.0 assign ( resid 162 and name ha ) ( resid 163 and name hn ) 2.8 0.9 0.0 assign ( resid 162 and name hb+ ) ( resid 163 and name hn ) 4.2 2.3 0.0 assign ( resid 162 and name hd1+ ) ( resid 163 and name hn ) 2.8 0.9 0.0 assign ( resid 162 and name hd2+ ) ( resid 163 and name hn ) 5.5 3.6 0.0 assign ( resid 162 and name hn ) ( resid 163 and name hn ) 5.5 3.6 0.0 assign ( resid 162 and name hd1+ ) ( resid 164 and name hn ) 5.5 3.6 0.0 assign ( resid 163 and name hb+ ) ( resid 163 and name hn ) 2.8 0.9 0.0 assign ( resid 163 and name hb+ ) ( resid 164 and name hn ) 2.8 0.9 0.0 assign ( resid 164 and name ha ) ( resid 164 and name hn ) 5.5 3.6 0.0 assign ( resid 164 and name ha ) ( resid 164 and name hg2+ ) 3.3 1.4 0.0 assign ( resid 164 and name hb ) ( resid 164 and name hn ) 2.8 0.9 0.0 assign ( resid 164 and name ha ) ( resid 165 and name hb+ ) 5.5 3.6 0.0 assign ( resid 164 and name ha ) ( resid 165 and name hn ) 2.8 0.9 0.0 assign ( resid 164 and name hb ) ( resid 165 and name hn ) 5.5 3.6 0.0 assign ( resid 164 and name hg2+ ) ( resid 165 and name ha ) 5.5 3.6 0.0 assign ( resid 164 and name hg2+ ) ( resid 165 and name hn ) 3.3 1.4 0.0 assign ( resid 164 and name hg2+ ) ( resid 165 and name hb+ ) 5.5 3.6 0.0 assign ( resid 164 and name hn ) ( resid 165 and name hb+ ) 5.5 3.6 0.0 assign ( resid 164 and name hn ) ( resid 165 and name hn ) 5.5 3.6 0.0 assign ( resid 165 and name ha ) ( resid 165 and name hn ) 3.8 1.9 0.0 assign ( resid 165 and name hb+ ) ( resid 165 and name hn ) 2.8 0.9 0.0 assign ( resid 165 and name ha ) ( resid 166 and name hn ) 2.8 0.9 0.0 assign ( resid 165 and name hb+ ) ( resid 166 and name hn ) 2.8 0.9 0.0 assign ( resid 166 and name ha ) ( resid 166 and name hb+ ) 3.3 1.4 0.0 assign ( resid 166 and name ha ) ( resid 166 and name hn ) 3.3 1.4 0.0 assign ( resid 166 and name hb+ ) ( resid 166 and name hn ) 3.3 1.4 0.0 !restraints added 14/05/01 assign ( resid 42 and name he+ ) ( resid 59 and name hg1+ ) 5.5 3.6 0.0 assign ( resid 42 and name he+ ) ( resid 59 and name hg2+ ) 5.5 3.6 0.0 assign ( resid 42 and name he+ ) ( resid 57 and name hd2+ ) 5.5 3.6 0.0 assign ( resid 42 and name he+ ) ( resid 30 and name hd1+ ) 5.5 3.6 0.0 assign ( resid 42 and name he+ ) ( resid 21 and name hd1+ ) 5.5 3.6 0.0 assign ( resid 42 and name he+ ) ( resid 71 and name hg2+ ) 5.5 3.6 0.0 assign ( resid 42 and name he+ ) ( resid 21 and name hd2+ ) 5.5 3.6 0.0 assign ( resid 42 and name he+ ) ( resid 32 and name hg2+ ) 5.5 3.6 0.0 assign ( resid 110 and name hd+ ) ( resid 142 and name hd1 ) 5.5 3.6 0.0 assign ( resid 110 and name hd+ ) ( resid 109 and name ha ) 5.5 3.6 0.0 assign ( resid 110 and name hd+ ) ( resid 111 and name hn ) 5.5 3.6 0.0 assign ( resid 110 and name he+ ) ( resid 108 and name ha ) 5.5 3.6 0.0 assign ( resid 110 and name he+ ) ( resid 109 and name ha ) 5.5 3.6 0.0 assign ( resid 69 and name hd1 ) ( resid 70 and name hn ) 5.5 3.6 0.0 !restraints added 18/05/01 to help the formation of high affinity calcium binding site assign ( resid 11 and name cd ) ( resid 160 and name cg ) 6.0 3.6 0.0 !restraints added 18/05/01 to help the formation of high affinity calcium binding site !assign ( resid 69 and name hz2 ) ( resid 146 and name hb+ ) 5.5 3.6 0.0 !assign ( resid 69 and name hz2 ) ( resid 146 and name hb+ ) 5.5 3.6 0.0 assign ( resid 28 and name hz2 ) ( resid 73 and name hb+ ) 5.5 3.6 0.0 assign ( resid 28 and name hz2 ) ( resid 162 and name hb+ ) 5.5 3.6 0.0 assign ( resid 28 and name hz2 ) ( resid 101 and name hg1+ ) 5.5 3.6 0.0 assign ( resid 28 and name hz2 ) ( resid 162 and name hd2+ ) 5.5 3.6 0.0 !Restraints added 31may01 assign ( resid 69 and name he3 ) ( resid 69 and name hb1 ) 5.5 3.6 0.0 assign ( resid 69 and name he3 ) ( resid 68 and name hd1 ) 5.5 3.6 0.0 assign ( resid 69 and name he3 ) ( resid 69 and name hb2 ) 5.5 3.6 0.0 assign ( resid 69 and name he3 ) ( resid 69 and name ha ) 5.5 3.6 0.0 assign ( resid 69 and name he3 ) ( resid 69 and name hn ) 4.2 2.3 0.0 !added 01/06/01 assign ( resid 69 and name hd1 ) ( resid 69 and name hb2 ) 5.5 3.6 0.0 assign ( resid 69 and name hd1 ) ( resid 69 and name hb1 ) 5.5 3.6 0.0 assign ( resid 69 and name hd1 ) ( resid 69 and name ha ) 5.5 3.6 0.0 assign ( resid 69 and name he3 ) ( resid 68 and name hg2 ) 5.5 3.6 0.0 assign ( resid 5 and name hn )
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