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 |
|
|
586526 |
2muy   |
25235 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
!!! DISTANCE RESTRAINTS n=386 !! NOE Restraints n=344 ! Intraresidue (i=j) n=62 assign(resid 30 and name hn )(resid 30 and name ha ) 2.7 0.0 5.0 assign(resid 31 and name hn )(resid 31 and name ha ) 2.7 0.0 5.0 assign(resid 32 and name hn )(resid 32 and name ha ) 2.7 0.0 5.0 assign(resid 33 and name hn )(resid 33 and name ha ) 2.7 0.0 5.0 assign(resid 34 and name hn )(resid 34 and name ha ) 2.7 0.0 5.0 assign(resid 35 and name hn )(resid 35 and name ha ) 2.7 0.0 5.0 assign(resid 36 and name hn )(resid 36 and name ha ) 2.7 0.0 5.0 assign(resid 37 and name hn )(resid 37 and name ha ) 2.7 0.0 5.0 assign(resid 38 and name hn )(resid 38 and name ha ) 2.7 0.0 5.0 assign(resid 39 and name hn )(resid 39 and name ha ) 2.7 0.0 5.0 assign(resid 40 and name hn )(resid 40 and name ha ) 2.7 0.0 5.0 assign(resid 41 and name hn )(resid 41 and name ha ) 2.7 0.0 5.0 assign(resid 42 and name hn )(resid 42 and name ha ) 2.7 0.0 5.0 assign(resid 43 and name hd21 )(resid 43 and name hb2 ) 0.0 0.0 3.2 assign(resid 43 and name hn )(resid 43 and name ha ) 2.7 0.0 5.0 assign(resid 44 and name hn )(resid 44 and name ha ) 0.0 0.0 2.7 assign(resid 45 and name hn )(resid 45 and name ha ) 2.7 0.0 5.0 assign(resid 46 and name hn )(resid 46 and name ha ) 2.7 0.0 5.0 assign(resid 47 and name hn )(resid 47 and name ha ) 2.7 0.0 5.0 assign(resid 48 and name hn )(resid 48 and name ha ) 2.7 0.0 5.0 assign(resid 49 and name hn )(resid 49 and name ha ) 2.7 0.0 5.0 assign(resid 50 and name hn )(resid 50 and name ha ) 2.7 0.0 5.0 assign(resid 51 and name hn )(resid 51 and name ha ) 2.7 0.0 5.0 assign(resid 52 and name hn )(resid 52 and name ha ) 2.7 0.0 5.0 assign(resid 53 and name hn )(resid 53 and name ha1 ) 2.7 0.0 5.0 assign(resid 53 and name hn )(resid 53 and name ha2 ) 0.0 0.0 2.7 assign(resid 54 and name hn )(resid 54 and name ha ) 2.7 0.0 5.0 assign(resid 55 and name hn )(resid 55 and name ha ) 2.7 0.0 5.0 assign(resid 56 and name hn )(resid 56 and name ha ) 2.7 0.0 5.0 assign(resid 57 and name hn )(resid 57 and name ha ) 2.7 0.0 5.0 assign(resid 58 and name hn )(resid 58 and name ha ) 2.7 0.0 5.0 assign(resid 59 and name hn )(resid 59 and name ha ) 2.7 0.0 5.0 assign(resid 60 and name hn )(resid 60 and name ha ) 2.7 0.0 5.0 assign(resid 61 and name hn )(resid 61 and name ha ) 2.7 0.0 5.0 assign(resid 63 and name hn )(resid 63 and name ha ) 0.0 0.0 2.7 assign(resid 64 and name hn )(resid 64 and name ha ) 2.7 0.0 5.0 assign(resid 64 and name hn )(resid 64 and name hb2 ) 0.0 0.0 2.7 assign(resid 65 and name hn )(resid 65 and name ha ) 2.7 0.0 5.0 assign(resid 66 and name hn )(resid 66 and name ha ) 2.7 0.0 5.0 assign(resid 67 and name hn )(resid 67 and name ha ) 2.7 0.0 5.0 assign(resid 68 and name hn )(resid 68 and name ha ) 2.7 0.0 5.0 assign(resid 69 and name hn )(resid 69 and name ha ) 2.7 0.0 5.0 assign(resid 70 and name hn )(resid 70 and name ha ) 2.7 0.0 5.0 assign(resid 72 and name hn )(resid 72 and name ha ) 2.7 0.0 5.0 assign(resid 74 and name hn )(resid 74 and name ha ) 2.7 0.0 5.0 assign(resid 76 and name hn )(resid 76 and name ha ) 2.7 0.0 5.0 assign(resid 77 and name hn )(resid 77 and name ha ) 2.7 0.0 5.0 assign(resid 78 and name hn )(resid 78 and name ha ) 2.7 0.0 5.0 assign(resid 79 and name hn )(resid 79 and name ha ) 2.7 0.0 5.0 assign(resid 80 and name hn )(resid 80 and name ha ) 2.7 0.0 5.0 assign(resid 81 and name hn )(resid 81 and name ha ) 2.7 0.0 5.0 assign(resid 84 and name hn )(resid 84 and name ha ) 2.7 0.0 5.0 assign(resid 85 and name hn )(resid 85 and name ha ) 0.0 0.0 2.7 assign(resid 86 and name hn )(resid 86 and name ha ) 2.7 0.0 5.0 assign(resid 87 and name hn )(resid 87 and name ha ) 2.7 0.0 5.0 assign(resid 88 and name hn )(resid 88 and name ha ) 2.7 0.0 5.0 assign(resid 89 and name hn )(resid 89 and name ha ) 2.7 0.0 5.0 assign(resid 90 and name hn )(resid 90 and name ha1 ) 0.0 0.0 2.7 assign(resid 90 and name hn )(resid 90 and name ha2 ) 2.7 0.0 5.0 assign(resid 91 and name hn )(resid 91 and name ha ) 2.7 0.0 5.0 assign(resid 94 and name hn )(resid 94 and name ha ) 2.7 0.0 5.0 assign(resid 95 and name hn )(resid 95 and name ha ) 2.7 0.0 5.0 ! Intreresidue Sequential (i-j=1) n=134 assign(resid 31 and name hn )(resid 30 and name ha ) 0.0 0.0 2.7 assign(resid 31 and name hn )(resid 30 and name hb+ ) 0.0 0.0 4.0 assign(resid 31 and name hn )(resid 30 and name hg+ ) 3.5 0.0 2.3 assign(resid 32 and name hn )(resid 31 and name ha ) 0.0 0.0 2.7 assign(resid 32 and name hn )(resid 31 and name hb+ ) 0.0 0.0 4.0 assign(resid 33 and name hn )(resid 32 and name ha ) 0.0 0.0 2.7 assign(resid 33 and name hn )(resid 32 and name hb ) 3.2 0.0 5.0 assign(resid 33 and name hn )(resid 34 and name hn ) 3.2 0.0 5.0 assign(resid 34 and name hn )(resid 33 and name ha ) 0.0 0.0 2.7 assign(resid 34 and name hn )(resid 33 and name hb+ ) 3.2 0.0 5.0 assign(resid 34 and name hn )(resid 35 and name hn ) 0.0 0.0 3.2 assign(resid 35 and name hn )(resid 34 and name ha ) 3.2 0.0 5.0 assign(resid 35 and name hn )(resid 34 and name hb1 ) 0.0 0.0 3.2 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 ) 3.2 0.0 5.0 assign(resid 36 and name hn )(resid 37 and name hn ) 0.0 0.0 2.7 assign(resid 37 and name hn )(resid 36 and name ha ) 3.2 0.0 5.0 assign(resid 37 and name hn )(resid 38 and name hn ) 0.0 0.0 3.2 assign(resid 38 and name hd2+ )(resid 37 and name hd1 ) 0.0 0.0 4.8 assign(resid 38 and name hd2+ )(resid 37 and name he1 ) 0.0 0.0 4.8 assign(resid 38 and name hn )(resid 37 and name ha ) 3.2 0.0 5.0 assign(resid 38 and name hn )(resid 39 and name hn ) 0.0 0.0 2.7 assign(resid 39 and name hn )(resid 38 and name ha ) 3.2 0.0 5.0 assign(resid 39 and name hn )(resid 38 and name hb2 ) 0.0 0.0 3.2 assign(resid 39 and name hn )(resid 40 and name hn ) 0.0 0.0 2.7 assign(resid 40 and name hn )(resid 39 and name ha ) 3.2 0.0 5.0 assign(resid 40 and name hn )(resid 41 and name hn ) 0.0 0.0 2.7 assign(resid 41 and name hn )(resid 40 and name ha ) 3.2 0.0 5.0 assign(resid 41 and name hn )(resid 42 and name hn ) 0.0 0.0 3.0 assign(resid 42 and name hn )(resid 41 and name ha ) 3.2 0.0 5.0 assign(resid 42 and name hn )(resid 41 and name hb ) 0.0 0.0 3.2 assign(resid 42 and name hn )(resid 41 and name hg1+ ) 0.0 0.0 4.0 assign(resid 42 and name hn )(resid 43 and name hn ) 0.0 0.0 2.7 assign(resid 43 and name hn )(resid 42 and name ha ) 3.2 0.0 5.0 assign(resid 43 and name hn )(resid 42 and name hb+ ) 0.0 0.0 3.5 assign(resid 44 and name hn )(resid 43 and name ha ) 3.2 0.0 5.0 assign(resid 45 and name hn )(resid 44 and name ha ) 2.7 0.0 5.0 assign(resid 45 and name hn )(resid 44 and name hb1 ) 3.2 0.0 1.8 assign(resid 45 and name hn )(resid 44 and name hb2 ) 3.2 0.0 1.8 assign(resid 45 and name hn )(resid 46 and name hn ) 0.0 0.0 2.7 assign(resid 46 and name hn )(resid 45 and name ha ) 2.7 0.0 5.0 assign(resid 46 and name hn )(resid 45 and name hb1 ) 3.2 0.0 1.8 assign(resid 46 and name hn )(resid 45 and name hb2 ) 3.2 0.0 1.8 assign(resid 47 and name hn )(resid 46 and name ha ) 0.0 0.0 2.7 assign(resid 47 and name hn )(resid 46 and name hb ) 3.2 0.0 1.8 assign(resid 47 and name hn )(resid 48 and name hn ) 0.0 0.0 2.7 assign(resid 48 and name hn )(resid 47 and name ha ) 2.7 0.0 5.0 assign(resid 48 and name hn )(resid 49 and name hn ) 3.2 0.0 5.0 assign(resid 49 and name hn )(resid 48 and name ha ) 0.0 0.0 2.7 assign(resid 49 and name hn )(resid 50 and name hn ) 3.2 0.0 5.0 assign(resid 50 and name hn )(resid 49 and name ha ) 0.0 0.0 2.7 assign(resid 50 and name hn )(resid 51 and name hn ) 3.2 0.0 5.0 assign(resid 51 and name hn )(resid 50 and name ha ) 0.0 0.0 2.7 assign(resid 52 and name hn )(resid 51 and name ha ) 0.0 0.0 2.7 assign(resid 53 and name hn )(resid 52 and name ha ) 0.0 0.0 2.7 assign(resid 53 and name hn )(resid 54 and name hn ) 3.5 0.0 5.0 assign(resid 54 and name hn )(resid 53 and name ha1 ) 0.0 0.0 2.7 assign(resid 54 and name hn )(resid 53 and name ha2 ) 2.7 0.0 5.0 assign(resid 54 and name hn )(resid 55 and name hn ) 0.0 0.0 2.7 assign(resid 55 and name hn )(resid 54 and name ha ) 2.7 0.0 5.0 assign(resid 55 and name hn )(resid 56 and name hn ) 3.2 0.0 5.0 assign(resid 56 and name hn )(resid 55 and name ha ) 0.0 0.0 2.7 assign(resid 56 and name hn )(resid 57 and name hn ) 3.2 0.0 5.0 assign(resid 57 and name hn )(resid 56 and name ha ) 0.0 0.0 2.7 assign(resid 58 and name hn )(resid 57 and name ha ) 0.0 0.0 2.7 assign(resid 58 and name hn )(resid 59 and name hn ) 3.2 0.0 5.0 assign(resid 59 and name hn )(resid 58 and name ha ) 0.0 0.0 2.7 assign(resid 59 and name hn )(resid 60 and name hn ) 3.2 0.0 5.0 assign(resid 60 and name hn )(resid 59 and name ha ) 0.0 0.0 2.7 assign(resid 60 and name hn )(resid 61 and name hn ) 3.2 0.0 5.0 assign(resid 61 and name hn )(resid 60 and name ha ) 0.0 0.0 2.7 assign(resid 63 and name hn )(resid 62 and name ha ) 2.7 0.0 5.0 assign(resid 63 and name hn )(resid 64 and name hn ) 2.7 0.0 0.5 assign(resid 64 and name hn )(resid 63 and name ha ) 2.7 0.0 5.0 assign(resid 65 and name hn )(resid 64 and name ha ) 0.0 0.0 2.7 assign(resid 66 and name hn )(resid 65 and name ha ) 0.0 0.0 2.7 assign(resid 66 and name hn )(resid 67 and name hn ) 3.2 0.0 5.0 assign(resid 67 and name hn )(resid 66 and name ha ) 0.0 0.0 2.7 assign(resid 68 and name hn )(resid 67 and name ha ) 0.0 0.0 2.7 assign(resid 68 and name hn )(resid 67 and name hg2+ ) 0.0 0.0 3.5 assign(resid 68 and name hn )(resid 69 and name hn ) 3.2 0.0 5.0 assign(resid 69 and name hn )(resid 68 and name ha ) 0.0 0.0 2.7 assign(resid 69 and name hn )(resid 70 and name hn ) 3.2 0.0 5.0 assign(resid 70 and name ha )(resid 71 and name hd1 ) 0.0 0.0 2.7 assign(resid 70 and name hn )(resid 69 and name ha ) 0.0 0.0 2.7 assign(resid 70 and name hn )(resid 71 and name hd1 ) 3.2 0.0 5.0 assign(resid 70 and name hn )(resid 71 and name hd2 ) 3.2 0.0 5.0 assign(resid 71 and name hd2 )(resid 70 and name hg2+ ) 0.0 0.0 4.0 assign(resid 72 and name hn )(resid 71 and name ha ) 2.7 0.0 5.0 assign(resid 72 and name hn )(resid 71 and name hd1 ) 4.0 0.0 5.0 assign(resid 72 and name hn )(resid 71 and name hd2 ) 3.2 0.0 0.8 assign(resid 74 and name ha )(resid 75 and name hd1 ) 0.0 0.0 2.7 assign(resid 74 and name ha )(resid 75 and name hd2 ) 0.0 0.0 2.7 assign(resid 74 and name hn )(resid 73 and name ha ) 0.0 0.0 2.7 assign(resid 76 and name hn )(resid 75 and name ha ) 3.2 0.0 5.0 assign(resid 76 and name hn )(resid 75 and name hd2 ) 0.0 0.0 2.7 assign(resid 76 and name hn )(resid 77 and name hn ) 0.0 0.0 2.7 assign(resid 77 and name hn )(resid 76 and name ha ) 3.2 0.0 5.0 assign(resid 77 and name hn )(resid 78 and name hn ) 0.0 0.0 2.7 assign(resid 78 and name hn )(resid 77 and name ha ) 3.2 0.0 5.0 assign(resid 78 and name hn )(resid 79 and name hn ) 0.0 0.0 2.7 assign(resid 79 and name hn )(resid 78 and name ha ) 3.2 0.0 5.0 assign(resid 80 and name hn )(resid 79 and name ha ) 3.2 0.0 5.0 assign(resid 81 and name hn )(resid 80 and name ha ) 3.2 0.0 5.0 assign(resid 81 and name hn )(resid 82 and name hn ) 0.0 0.0 2.7 assign(resid 82 and name hn )(resid 81 and name ha ) 2.7 0.0 5.0 assign(resid 82 and name hn )(resid 83 and name hn ) 0.0 0.0 2.7 assign(resid 83 and name hn )(resid 82 and name ha ) 2.7 0.0 5.0 assign(resid 83 and name hn )(resid 84 and name hn ) 0.0 0.0 3.2 assign(resid 84 and name hn )(resid 83 and name ha ) 3.2 0.0 5.0 assign(resid 84 and name hn )(resid 85 and name hn ) 0.0 0.0 3.2 assign(resid 85 and name hn )(resid 84 and name ha ) 3.2 0.0 5.0 assign(resid 85 and name hn )(resid 84 and name hb1 ) 3.2 0.0 1.8 assign(resid 85 and name hn )(resid 84 and name hb2 ) 3.2 0.0 1.8 assign(resid 86 and name hn )(resid 85 and name ha ) 2.7 0.0 5.0 assign(resid 87 and name hn )(resid 86 and name ha ) 0.0 0.0 2.7 assign(resid 87 and name hn )(resid 88 and name hn ) 3.2 0.0 5.0 assign(resid 88 and name hn )(resid 87 and name ha ) 0.0 0.0 2.7 assign(resid 89 and name hn )(resid 88 and name ha ) 0.0 0.0 2.7 assign(resid 89 and name hn )(resid 90 and name hn ) 3.2 0.0 5.0 assign(resid 90 and name hn )(resid 89 and name ha ) 0.0 0.0 2.7 assign(resid 90 and name hn )(resid 91 and name hn ) 3.2 0.0 5.0 assign(resid 91 and name hn )(resid 90 and name ha1 ) 2.7 0.0 5.0 assign(resid 91 and name hn )(resid 90 and name ha2 ) 0.0 0.0 2.7 assign(resid 91 and name hn )(resid 92 and name hd1 ) 3.2 0.0 5.0 assign(resid 91 and name hn )(resid 92 and name hd2 ) 3.2 0.0 5.0 assign(resid 94 and name hn )(resid 93 and name ha ) 0.0 0.0 2.7 assign(resid 94 and name hn )(resid 93 and name hd1 ) 3.2 0.0 5.0 assign(resid 94 and name hn )(resid 93 and name hd2 ) 3.2 0.0 5.0 assign(resid 95 and name hn )(resid 94 and name ha ) 0.0 0.0 2.7 assign(resid 95 and name hn )(resid 96 and name hd1 ) 3.2 0.0 5.0 assign(resid 95 and name hn )(resid 96 and name hd2 ) 3.2 0.0 5.0 assign(resid 97 and name hn )(resid 96 and name hd1 ) 3.2 0.0 5.0 assign(resid 97 and name hn )(resid 96 and name hd2 ) 3.2 0.0 5.0 ! Medium Range (1<|i-j|<6) n=58 assign(resid 33 and name hn )(resid 36 and name hb ) 3.2 0.0 5.0 assign(resid 34 and name ha )(resid 37 and name hb+ ) 0.0 0.0 3.5 assign(resid 35 and name ha )(resid 38 and name hb2 ) 0.0 0.0 4.0 assign(resid 35 and name hn )(resid 38 and name hd1+ ) 0.0 0.0 5.3 assign(resid 36 and name ha )(resid 39 and name hb+ ) 0.0 0.0 4.8 assign(resid 36 and name hb )(resid 32 and name hg1+ ) 0.0 0.0 4.0 assign(resid 36 and name hn )(resid 32 and name hg1+ ) 0.0 0.0 4.8 assign(resid 36 and name hn )(resid 33 and name hb+ ) 0.0 0.0 4.0 assign(resid 36 and name hn )(resid 38 and name hn ) 0.0 0.0 4.5 assign(resid 37 and name ha )(resid 40 and name hb+ ) 0.0 0.0 4.8 assign(resid 38 and name ha )(resid 41 and name hb ) 0.0 0.0 3.2 assign(resid 38 and name ha )(resid 41 and name hg2+ ) 0.0 0.0 4.8 assign(resid 38 and name hd1+ )(resid 34 and name he1 ) 0.0 0.0 4.0 assign(resid 38 and name hn )(resid 35 and name ha ) 0.0 0.0 4.0 assign(resid 41 and name hn )(resid 38 and name ha ) 0.0 0.0 3.5 assign(resid 42 and name hd21 )(resid 38 and name hb1 ) 0.0 0.0 4.0 assign(resid 42 and name hn )(resid 38 and name ha ) 0.0 0.0 4.5 assign(resid 42 and name hn )(resid 39 and name ha ) 0.0 0.0 3.5 assign(resid 43 and name hn )(resid 39 and name hg+ ) 0.0 0.0 4.8 assign(resid 43 and name hn )(resid 40 and name ha ) 0.0 0.0 3.5 assign(resid 43 and name hn )(resid 41 and name ha ) 0.0 0.0 4.5 assign(resid 43 and name hn )(resid 41 and name hg1+ ) 0.0 0.0 5.8 assign(resid 43 and name hn )(resid 41 and name hn ) 0.0 0.0 4.5 assign(resid 44 and name hn )(resid 41 and name ha ) 0.0 0.0 5.0 assign(resid 44 and name hn )(resid 42 and name ha ) 0.0 0.0 4.0 assign(resid 45 and name he21 )(resid 43 and name hb1 ) 0.0 0.0 4.0 assign(resid 45 and name hn )(resid 41 and name ha ) 0.0 0.0 4.0 assign(resid 45 and name hn )(resid 43 and name hb1 ) 0.0 0.0 4.0 assign(resid 45 and name hn )(resid 43 and name hb2 ) 0.0 0.0 4.0 assign(resid 48 and name hn )(resid 46 and name hg1+ ) 0.0 0.0 4.0 assign(resid 52 and name hn )(resid 55 and name hb+ ) 0.0 0.0 4.8 assign(resid 52 and name hn )(resid 56 and name ha ) 0.0 0.0 3.5 assign(resid 53 and name hn )(resid 51 and name hg2+ ) 0.0 0.0 4.8 assign(resid 55 and name hn )(resid 52 and name hn ) 0.0 0.0 4.0 assign(resid 55 and name hn )(resid 53 and name ha1 ) 0.0 0.0 4.0 assign(resid 55 and name hn )(resid 53 and name ha2 ) 0.0 0.0 5.0 assign(resid 60 and name hn )(resid 64 and name hn ) 3.2 0.0 1.8 assign(resid 63 and name hn )(resid 60 and name hb+ ) 0.0 0.0 4.8 assign(resid 63 and name hn )(resid 61 and name hb+ ) 0.0 0.0 5.8 assign(resid 64 and name hn )(resid 60 and name hb+ ) 0.0 0.0 3.5 assign(resid 64 and name hn )(resid 60 and name hd+ ) 0.0 0.0 4.8 assign(resid 68 and name hb )(resid 66 and name he1 ) 0.0 0.0 3.2 assign(resid 68 and name hn )(resid 66 and name hd1 ) 0.0 0.0 4.0 assign(resid 72 and name hn )(resid 70 and name ha ) 4.0 0.0 5.0 assign(resid 72 and name hn )(resid 70 and name hg2+ ) 2.7 0.0 1.3 assign(resid 73 and name ha )(resid 70 and name hg2+ ) 0.0 0.0 4.8 assign(resid 76 and name hn )(resid 74 and name ha ) 0.0 0.0 5.0 assign(resid 77 and name ha )(resid 80 and name hb1 ) 0.0 0.0 3.2 assign(resid 77 and name ha )(resid 80 and name hb2 ) 0.0 0.0 3.2 assign(resid 81 and name ha )(resid 84 and name hb+ ) 0.0 0.0 3.5 assign(resid 82 and name hn )(resid 79 and name ha ) 0.0 0.0 3.5 assign(resid 82 and name hn )(resid 80 and name ha ) 3.2 0.0 5.0 assign(resid 83 and name hn )(resid 81 and name ha ) 3.2 0.0 5.0 assign(resid 84 and name hn )(resid 81 and name ha ) 0.0 0.0 3.5 assign(resid 84 and name hn )(resid 86 and name hg2+ ) 0.0 0.0 4.8 assign(resid 85 and name hn )(resid 82 and name ha ) 0.0 0.0 3.5 assign(resid 86 and name hn )(resid 82 and name ha ) 0.0 0.0 3.5 assign(resid 86 and name hn )(resid 84 and name hb2 ) 0.0 0.0 3.5 ! Long Range (|i-j|>5) n=90 assign(resid 32 and name hg2+ )(resid 66 and name hb2 ) 0.0 0.0 4.8 assign(resid 32 and name hg2+ )(resid 66 and name hd1 ) 0.0 0.0 4.8 assign(resid 32 and name hn )(resid 66 and name hd1 ) 0.0 0.0 4.5 assign(resid 32 and name hn )(resid 67 and name hb ) 0.0 0.0 5.0 assign(resid 32 and name hn )(resid 68 and name ha ) 0.0 0.0 3.5 assign(resid 34 and name hn )(resid 71 and name hd1 ) 3.2 0.0 5.0 assign(resid 34 and name hn )(resid 71 and name hd2 ) 3.2 0.0 5.0 assign(resid 37 and name ha )(resid 32 and name hg1+ ) 0.0 0.0 5.8 assign(resid 37 and name hb+ )(resid 68 and name hg2+ ) 0.0 0.0 4.8 assign(resid 37 and name hn )(resid 32 and name hg1+ ) 0.0 0.0 4.0 assign(resid 41 and name ha )(resid 46 and name hb ) 0.0 0.0 4.0 assign(resid 41 and name ha )(resid 46 and name hg2+ ) 0.0 0.0 3.5 assign(resid 41 and name hg1+ )(resid 46 and name hb ) 0.0 0.0 4.8 assign(resid 41 and name hg1+ )(resid 81 and name ha ) 0.0 0.0 4.8 assign(resid 41 and name hg2+ )(resid 46 and name hb ) 0.0 0.0 4.8 assign(resid 41 and name hn )(resid 46 and name hg2+ ) 0.0 0.0 4.0 assign(resid 44 and name hn )(resid 84 and name hd+ ) 0.0 0.0 5.8 assign(resid 46 and name hn )(resid 41 and name ha ) 0.0 0.0 4.0 assign(resid 46 and name hn )(resid 41 and name hg2+ ) 0.0 0.0 5.8 assign(resid 47 and name hn )(resid 60 and name ha ) 0.0 0.0 3.5 assign(resid 47 and name hn )(resid 60 and name hg+ ) 0.0 0.0 4.8 assign(resid 48 and name ha )(resid 86 and name hg1+ ) 0.0 0.0 4.8 assign(resid 48 and name ha )(resid 87 and name hn ) 0.0 0.0 3.5 assign(resid 48 and name hn )(resid 58 and name hg1+ ) 0.0 0.0 4.8 assign(resid 48 and name hn )(resid 59 and name hb ) 0.0 0.0 4.0 assign(resid 49 and name hn )(resid 86 and name hg1+ ) 0.0 0.0 4.0 assign(resid 49 and name hn )(resid 88 and name hg2+ ) 0.0 0.0 4.8 assign(resid 50 and name ha )(resid 89 and name hg2+ ) 0.0 0.0 4.0 assign(resid 50 and name hn )(resid 57 and name hb2 ) 0.0 0.0 4.0 assign(resid 50 and name hn )(resid 57 and name hn ) 0.0 0.0 3.5 assign(resid 51 and name ha )(resid 56 and name ha ) 0.0 0.0 2.7 assign(resid 51 and name hn )(resid 90 and name ha2 ) 0.0 0.0 3.5 assign(resid 56 and name hg2+ )(resid 37 and name hz ) 0.0 0.0 4.8 assign(resid 56 and name hn )(resid 68 and name hn ) 0.0 0.0 3.5 assign(resid 56 and name hn )(resid 69 and name ha ) 0.0 0.0 3.5 assign(resid 57 and name ha )(resid 67 and name ha ) 0.0 0.0 2.7 assign(resid 57 and name hd22 )(resid 67 and name hg2+ ) 0.0 0.0 4.0 assign(resid 57 and name hn )(resid 50 and name hb1 ) 0.0 0.0 4.0 assign(resid 57 and name hn )(resid 51 and name ha ) 0.0 0.0 4.0 assign(resid 58 and name ha )(resid 49 and name ha ) 0.0 0.0 27.0 assign(resid 58 and name hg2+ )(resid 66 and name hd1 ) 0.0 0.0 4.8 assign(resid 58 and name hg2+ )(resid 67 and name ha ) 0.0 0.0 5.8 assign(resid 58 and name hn )(resid 67 and name ha ) 0.0 0.0 3.5 assign(resid 59 and name hb )(resid 48 and name hb1 ) 0.0 0.0 2.7 assign(resid 59 and name hg2+ )(resid 47 and name hd+ ) 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