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 |
|
|
20840 |
2glw   |
7116 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
!!! NOE RESTRAINTS !!! Note: the first residue of each pair was identified in the HSQC plane of 3D experiments !! Intra-residue assign(resid 2 and name hn )(resid 2 and name ha ) 2.7 0.0 5.0 assign(resid 2 and name hn )(resid 2 and name hb+ ) 0.0 0.0 3.5 assign(resid 3 and name hg2+ )(resid 3 and name ha ) 0.0 0.0 3.5 assign(resid 3 and name hn )(resid 3 and name ha ) 2.7 0.0 5.0 assign(resid 3 and name hn )(resid 3 and name hb ) 0.0 0.0 2.7 assign(resid 3 and name hn )(resid 3 and name hg1+ ) 0.0 0.0 4.0 assign(resid 3 and name hn )(resid 3 and name hg2+ ) 0.0 0.0 4.8 assign(resid 4 and name hd2+ )(resid 4 and name ha ) 0.0 0.0 3.5 assign(resid 4 and name hn )(resid 4 and name ha ) 2.7 0.0 5.0 assign(resid 4 and name hn )(resid 4 and name hb1 ) 0.0 0.0 4.0 assign(resid 4 and name hn )(resid 4 and name hb2 ) 0.0 0.0 2.7 assign(resid 4 and name hn )(resid 4 and name hd1+ ) 0.0 0.0 4.8 assign(resid 4 and name hn )(resid 4 and name hg ) 0.0 0.0 4.0 assign(resid 5 and name hn )(resid 5 and name ha ) 2.7 0.0 5.0 assign(resid 5 and name hn )(resid 5 and name hb+ ) 0.0 0.0 3.5 assign(resid 6 and name hn )(resid 6 and name ha ) 2.7 0.0 5.0 assign(resid 6 and name hn )(resid 6 and name hb+ ) 0.0 0.0 4.0 assign(resid 7 and name hn )(resid 7 and name ha ) 2.7 0.0 5.0 assign(resid 7 and name hn )(resid 7 and name hb1 ) 0.0 0.0 3.2 assign(resid 7 and name hn )(resid 7 and name hb2 ) 0.0 0.0 4.0 assign(resid 8 and name hn )(resid 8 and name ha ) 2.7 0.0 5.0 assign(resid 8 and name hn )(resid 8 and name hb+ ) 0.0 0.0 4.0 assign(resid 9 and name hn )(resid 9 and name ha ) 2.7 0.0 5.0 assign(resid 9 and name hn )(resid 9 and name hb ) 3.2 0.0 5.0 assign(resid 9 and name hn )(resid 9 and name hg2+ ) 0.0 0.0 3.5 assign(resid 10 and name hn )(resid 10 and name ha ) 2.7 0.0 5.0 assign(resid 10 and name hn )(resid 10 and name hb ) 0.0 0.0 3.2 assign(resid 10 and name hn )(resid 10 and name hg2+ ) 0.0 0.0 4.0 assign(resid 11 and name hn )(resid 11 and name ha ) 2.7 0.0 5.0 assign(resid 11 and name hn )(resid 11 and name hb ) 0.0 0.0 2.7 assign(resid 11 and name hn )(resid 11 and name hg2+ ) 0.0 0.0 4.0 assign(resid 11 and name hn )(resid 11 and name hg1+ ) 0.0 0.0 4.8 assign(resid 12 and name hn )(resid 12 and name ha ) 2.7 0.0 5.0 assign(resid 12 and name hn )(resid 12 and name hb1 ) 0.0 0.0 4.0 assign(resid 12 and name hn )(resid 12 and name hb2 ) 0.0 0.0 3.2 assign(resid 13 and name hn )(resid 13 and name ha ) 2.7 0.0 5.0 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 hd+ ) 0.0 0.0 4.8 assign(resid 13 and name hn )(resid 13 and name hg+ ) 0.0 0.0 4.8 assign(resid 14 and name hn )(resid 14 and name ha ) 0.0 0.0 2.7 assign(resid 14 and name hn )(resid 14 and name hb ) 3.2 0.0 5.0 assign(resid 14 and name hn )(resid 14 and name hg1+ ) 0.0 0.0 4.0 assign(resid 14 and name hn )(resid 14 and name hg2+ ) 0.0 0.0 4.8 assign(resid 15 and name hn )(resid 15 and name ha+ ) 0.0 0.0 3.5 assign(resid 16 and name hn )(resid 16 and name ha ) 2.7 0.0 5.0 assign(resid 16 and name hn )(resid 16 and name hb+ ) 0.0 0.0 3.5 assign(resid 17 and name hn )(resid 17 and name ha ) 2.7 0.0 5.0 assign(resid 17 and name hn )(resid 17 and name hb ) 0.0 0.0 4.0 assign(resid 17 and name hn )(resid 17 and name hg1+ ) 0.0 0.0 4.0 assign(resid 17 and name hn )(resid 17 and name hg2+ ) 0.0 0.0 4.8 assign(resid 18 and name hn )(resid 18 and name ha ) 2.7 0.0 5.0 assign(resid 18 and name hn )(resid 18 and name hb ) 0.0 0.0 3.2 assign(resid 18 and name hn )(resid 18 and name hg11 ) 0.0 0.0 4.0 assign(resid 18 and name hn )(resid 18 and name hg12 ) 0.0 0.0 4.0 assign(resid 18 and name hn )(resid 18 and name hg2+ ) 0.0 0.0 4.8 assign(resid 19 and name hn )(resid 19 and name ha ) 2.7 0.0 5.0 assign(resid 19 and name hn )(resid 19 and name hb ) 0.0 0.0 3.2 assign(resid 19 and name hn )(resid 19 and name hd1+ ) 0.0 0.0 5.8 assign(resid 19 and name hn )(resid 19 and name hg1+ ) 0.0 0.0 4.0 assign(resid 21 and name hn )(resid 21 and name ha ) 2.7 0.0 5.0 assign(resid 21 and name hn )(resid 21 and name hb+ ) 0.0 0.0 3.5 assign(resid 22 and name hn )(resid 22 and name ha+ ) 0.0 0.0 3.5 assign(resid 23 and name hn )(resid 23 and name ha ) 2.7 0.0 5.0 assign(resid 23 and name hn )(resid 23 and name hb ) 0.0 0.0 3.2 assign(resid 23 and name hn )(resid 23 and name hg2+ ) 0.0 0.0 4.8 assign(resid 24 and name he )(resid 24 and name hg1 ) 0.0 0.0 3.2 assign(resid 24 and name he )(resid 24 and name hg2 ) 0.0 0.0 3.2 assign(resid 24 and name hn )(resid 24 and name ha ) 2.7 0.0 5.0 assign(resid 24 and name hn )(resid 24 and name hb+ ) 0.0 0.0 3.5 assign(resid 25 and name hn )(resid 25 and name ha ) 2.7 0.0 5.0 assign(resid 25 and name hn )(resid 25 and name hb+ ) 0.0 0.0 3.5 assign(resid 25 and name hn )(resid 25 and name hg+ ) 0.0 0.0 4.8 assign(resid 26 and name hn )(resid 26 and name ha ) 2.7 0.0 5.0 assign(resid 26 and name hn )(resid 26 and name hb1 ) 0.0 0.0 2.7 assign(resid 26 and name hn )(resid 26 and name hb2 ) 0.0 0.0 2.7 assign(resid 26 and name hn )(resid 26 and name hd+ ) 0.0 0.0 4.8 assign(resid 27 and name hn )(resid 27 and name ha ) 2.7 0.0 5.0 assign(resid 27 and name ha )(resid 27 and name hd1 ) 2.7 0.0 1.3 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 2.7 assign(resid 28 and name hn )(resid 28 and name ha+ ) 0.0 0.0 3.5 assign(resid 29 and name ha )(resid 29 and name hb ) 2.7 0.0 5.0 assign(resid 29 and name ha )(resid 29 and name hg2+ ) 0.0 0.0 4.8 assign(resid 29 and name hn )(resid 29 and name ha ) 2.7 0.0 5.0 assign(resid 29 and name hn )(resid 29 and name hb ) 0.0 0.0 2.7 assign(resid 29 and name hn )(resid 29 and name hd1+ ) 0.0 0.0 4.8 assign(resid 29 and name hn )(resid 29 and name hg1+ ) 0.0 0.0 5.8 assign(resid 30 and name hn )(resid 30 and name ha ) 2.7 0.0 5.0 assign(resid 30 and name hn )(resid 30 and name hb+ ) 0.0 0.0 4.0 assign(resid 31 and name hn )(resid 31 and name ha ) 2.7 0.0 5.0 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 hg+ ) 0.0 0.0 4.8 assign(resid 32 and name hn )(resid 32 and name ha1 ) 0.0 0.0 3.2 assign(resid 32 and name hn )(resid 32 and name ha2 ) 0.0 0.0 3.2 assign(resid 33 and name hn )(resid 33 and name ha ) 2.7 0.0 5.0 assign(resid 33 and name hn )(resid 33 and name hb+ ) 0.0 0.0 3.5 assign(resid 34 and name hn )(resid 34 and name ha ) 2.7 0.0 5.0 assign(resid 34 and name hn )(resid 34 and name hb1 ) 0.0 0.0 4.0 assign(resid 34 and name hn )(resid 34 and name hb2 ) 0.0 0.0 3.2 assign(resid 35 and name hn )(resid 35 and name ha ) 2.7 0.0 5.0 assign(resid 35 and name hn )(resid 35 and name hb ) 0.0 0.0 4.0 assign(resid 35 and name hn )(resid 35 and name hg1+ ) 0.0 0.0 4.0 assign(resid 35 and name hn )(resid 35 and name hg2+ ) 0.0 0.0 3.5 assign(resid 36 and name hn )(resid 36 and name ha ) 2.7 0.0 5.0 assign(resid 36 and name hn )(resid 36 and name hb+ ) 0.0 0.0 3.5 assign(resid 36 and name hn )(resid 36 and name hg+ ) 0.0 0.0 4.8 assign(resid 37 and name hn )(resid 37 and name ha ) 2.7 0.0 5.0 assign(resid 37 and name hn )(resid 37 and name hb ) 0.0 0.0 3.2 assign(resid 37 and name hn )(resid 37 and name hg1+ ) 0.0 0.0 4.8 assign(resid 37 and name hn )(resid 37 and name hg2+ ) 0.0 0.0 4.0 assign(resid 38 and name hn )(resid 38 and name ha ) 2.7 0.0 5.0 assign(resid 38 and name hn )(resid 38 and name hb+ ) 0.0 0.0 3.5 assign(resid 39 and name ha )(resid 39 and name hb ) 0.0 0.0 2.7 assign(resid 39 and name hg2+ )(resid 39 and name ha ) 0.0 0.0 3.5 assign(resid 39 and name hn )(resid 39 and name ha ) 2.7 0.0 5.0 assign(resid 39 and name hn )(resid 39 and name hb ) 0.0 0.0 4.0 assign(resid 39 and name hn )(resid 39 and name hd1+ ) 0.0 0.0 5.8 assign(resid 39 and name hn )(resid 39 and name hg1+ ) 0.0 0.0 3.5 assign(resid 40 and name hn )(resid 40 and name ha ) 2.7 0.0 5.0 assign(resid 40 and name hn )(resid 40 and name hb ) 0.0 0.0 2.7 assign(resid 40 and name hn )(resid 40 and name hg1+ ) 0.0 0.0 4.8 assign(resid 40 and name hn )(resid 40 and name hg2+ ) 0.0 0.0 4.0 assign(resid 42 and name hn )(resid 42 and name ha ) 2.7 0.0 5.0 assign(resid 42 and name hn )(resid 42 and name hb+ ) 0.0 0.0 3.5 assign(resid 43 and name hn )(resid 43 and name ha ) 2.7 0.0 5.0 assign(resid 43 and name hn )(resid 43 and name hb+ ) 0.0 0.0 4.0 assign(resid 43 and name hn )(resid 43 and name hg+ ) 0.0 0.0 3.8 assign(resid 44 and name hn )(resid 44 and name ha1 ) 2.7 0.0 5.0 assign(resid 44 and name hn )(resid 44 and name ha2 ) 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 45 and name hn )(resid 45 and name hb+ ) 0.0 0.0 4.0 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 ) 2.7 0.0 5.0 assign(resid 46 and name hn )(resid 46 and name hg+ ) 0.0 0.0 4.8 assign(resid 48 and name hn )(resid 48 and name ha ) 2.7 0.0 5.0 assign(resid 48 and name hn )(resid 48 and name hb+ ) 0.0 0.0 4.0 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 ) 2.7 0.0 5.0 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 50 and name hn )(resid 50 and name ha1 ) 0.0 0.0 2.7 assign(resid 50 and name hn )(resid 50 and name ha2 ) 2.7 0.0 5.0 assign(resid 51 and name ha )(resid 51 and name hg2+ ) 0.0 0.0 4.8 assign(resid 51 and name hn )(resid 51 and name ha ) 2.7 0.0 5.0 assign(resid 51 and name hn )(resid 51 and name hb ) 0.0 0.0 3.2 assign(resid 52 and name hn )(resid 52 and name ha ) 2.7 0.0 5.0 assign(resid 52 and name hn )(resid 52 and name hb+ ) 0.0 0.0 4.0 assign(resid 53 and name ha )(resid 53 and name hg2+ ) 0.0 0.0 4.8 assign(resid 53 and name hn )(resid 53 and name ha ) 2.7 0.0 5.0 assign(resid 53 and name hn )(resid 53 and name hb ) 0.0 0.0 3.2 assign(resid 54 and name hn )(resid 54 and name ha ) 2.7 0.0 5.0 assign(resid 54 and name hn )(resid 54 and name hb+ ) 0.0 0.0 4.0 assign(resid 55 and name hn )(resid 55 and name ha ) 2.7 0.0 5.0 assign(resid 55 and name hn )(resid 55 and name hb+ ) 0.0 0.0 3.5 assign(resid 55 and name hn )(resid 55 and name hd+ ) 0.0 0.0 5.8 assign(resid 55 and name hn )(resid 55 and name hg+ ) 0.0 0.0 5.8 assign(resid 56 and name ha )(resid 56 and name hb ) 0.0 0.0 3.2 assign(resid 56 and name hn )(resid 56 and name ha ) 2.7 0.0 5.0 assign(resid 56 and name hn )(resid 56 and name hb ) 0.0 0.0 3.2 assign(resid 56 and name hn )(resid 56 and name hg2+ ) 0.0 0.0 3.5 assign(resid 56 and name hn )(resid 56 and name hg1+ ) 0.0 0.0 4.8 assign(resid 57 and name hn )(resid 57 and name ha1 ) 0.0 0.0 3.2 assign(resid 57 and name hn )(resid 57 and name ha2 ) 0.0 0.0 3.2 assign(resid 58 and name hn )(resid 58 and name ha ) 2.7 0.0 5.0 assign(resid 58 and name hn )(resid 58 and name hb+ ) 0.0 0.0 3.5 assign(resid 59 and name hn )(resid 59 and name ha ) 0.0 0.0 2.7 assign(resid 59 and name hn )(resid 59 and name hb+ ) 0.0 0.0 4.8 assign(resid 59 and name hn )(resid 59 and name hg+ ) 0.0 0.0 4.0 assign(resid 60 and name hn )(resid 60 and name ha+ ) 0.0 0.0 3.5 assign(resid 61 and name hn )(resid 61 and name ha ) 2.7 0.0 5.0 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 ) 2.7 0.0 5.0 assign(resid 62 and name hn )(resid 62 and name hb ) 0.0 0.0 3.2 assign(resid 62 and name hn )(resid 62 and name hg1+ ) 0.0 0.0 4.8 assign(resid 63 and name ha )(resid 63 and name hg2+ ) 0.0 0.0 4.0 assign(resid 63 and name hn )(resid 63 and name ha ) 2.7 0.0 5.0 assign(resid 63 and name hn )(resid 63 and name hb ) 0.0 0.0 3.2 assign(resid 63 and name hn )(resid 63 and name hg11 ) 0.0 0.0 4.0 assign(resid 63 and name hn )(resid 63 and name hg12 ) 0.0 0.0 4.0 assign(resid 63 and name hn )(resid 63 and name hg2+ ) 0.0 0.0 4.8 assign(resid 64 and name ha )(resid 64 and name hg1+ ) 0.0 0.0 4.0 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 hb ) 0.0 0.0 3.2 assign(resid 64 and name hn )(resid 64 and name hd1+ ) 0.0 0.0 4.8 assign(resid 64 and name hn )(resid 64 and name hg1+ ) 0.0 0.0 3.5 assign(resid 66 and name hn )(resid 66 and name ha ) 2.7 0.0 5.0 assign(resid 66 and name hn )(resid 66 and name hd+ ) 0.0 0.0 5.8 assign(resid 66 and name hn )(resid 66 and name hg+ ) 0.0 0.0 4.8 assign(resid 67 and name hn )(resid 67 and name ha ) 2.7 0.0 5.0 assign(resid 67 and name hn )(resid 67 and name hb+ ) 0.0 0.0 3.5 assign(resid 68 and name hn )(resid 68 and name ha ) 2.7 0.0 5.0 assign(resid 68 and name hn )(resid 68 and name hb+ ) 0.0 0.0 3.5 assign(resid 68 and name hn )(resid 68 and name hd1+ ) 0.0 0.0 5.8 assign(resid 68 and name hn )(resid 68 and name hd2+ ) 0.0 0.0 5.8 assign(resid 68 and name hn )(resid 68 and name hg ) 0.0 0.0 5.0 assign(resid 69 and name he )(resid 69 and name hg1 ) 0.0 0.0 3.2 assign(resid 69 and name he )(resid 69 and name hg2 ) 0.0 0.0 3.2 assign(resid 69 and name hn )(resid 69 and name ha ) 2.7 0.0 5.0 assign(resid 69 and name hn )(resid 69 and name hb+ ) 0.0 0.0 3.5 assign(resid 69 and name hn )(resid 69 and name hd+ ) 0.0 0.0 4.8 assign(resid 69 and name hn )(resid 69 and name hg+ ) 0.0 0.0 4.0 assign(resid 70 and name hn )(resid 70 and name ha ) 2.7 0.0 5.0 assign(resid 70 and name hn )(resid 70 and name hb+ ) 0.0 0.0 3.5 assign(resid 71 and name ha )(resid 71 and name hb ) 0.0 0.0 3.2 assign(resid 71 and name hn )(resid 71 and name ha ) 2.7 0.0 5.0 assign(resid 71 and name hn )(resid 71 and name hb ) 0.0 0.0 2.7 assign(resid 71 and name hn )(resid 71 and name hg2+ ) 0.0 0.0 4.0 assign(resid 71 and name hn )(resid 71 and name hg1+ ) 0.0 0.0 4.8 assign(resid 72 and name ha )(resid 72 and name hg2+ ) 0.0 0.0 4.0 assign(resid 72 and name hn )(resid 72 and name ha ) 2.7 0.0 5.0 assign(resid 72 and name hn )(resid 72 and name hb ) 0.0 0.0 3.2 assign(resid 72 and name hn )(resid 72 and name hd1+ ) 0.0 0.0 4.8 assign(resid 72 and name hn )(resid 72 and name hg1+ ) 0.0 0.0 3.5 assign(resid 72 and name hn )(resid 72 and name hg2+ ) 0.0 0.0 4.8 assign(resid 73 and name hn )(resid 73 and name ha+ ) 0.0 0.0 3.5 assign(resid 74 and name ha )(resid 74 and name hg2+ ) 0.0 0.0 4.0 assign(resid 74 and name hn )(resid 74 and name ha ) 0.0 0.0 3.5 assign(resid 74 and name hn )(resid 74 and name hb ) 0.0 0.0 3.2 assign(resid 74 and name hn )(resid 74 and name hd1+ ) 0.0 0.0 5.8 assign(resid 74 and name hn )(resid 74 and name hg1+ ) 0.0 0.0 5.8 assign(resid 75 and name hn )(resid 75 and name ha ) 2.7 0.0 5.0 assign(resid 75 and name hn )(resid 75 and name hb+ ) 0.0 0.0 3.5 assign(resid 75 and name hn )(resid 75 and name hd+ ) 0.0 0.0 4.0 assign(resid 75 and name hn )(resid 75 and name hg+ ) 0.0 0.0 4.0 assign(resid 77 and name hn )(resid 77 and name ha1 ) 0.0 0.0 3.2 assign(resid 77 and name hn )(resid 77 and name ha2 ) 0.0 0.0 3.2 assign(resid 78 and name hn )(resid 78 and name ha ) 2.7 0.0 5.0 assign(resid 78 and name hn )(resid 78 and name hb+ ) 0.0 0.0 3.5 assign(resid 78 and name hn )(resid 78 and name hg+ ) 0.0 0.0 4.0 assign(resid 79 and name ha )(resid 79 and name hb ) 0.0 0.0 3.2 assign(resid 79 and name hn )(resid 79 and name ha ) 2.7 0.0 5.0 assign(resid 79 and name hn )(resid 79 and name hb ) 0.0 0.0 3.2 assign(resid 79 and name hn )(resid 79 and name hg1+ ) 0.0 0.0 4.0 assign(resid 79 and name hn )(resid 79 and name hg2+ ) 0.0 0.0 4.8 assign(resid 80 and name ha )(resid 80 and name hb ) 0.0 0.0 3.2 assign(resid 80 and name hn )(resid 80 and name ha ) 2.7 0.0 5.0 assign(resid 80 and name hn )(resid 80 and name hb ) 3.2 0.0 5.0 assign(resid 80 and name hn )(resid 80 and name hd1+ ) 0.0 0.0 5.8 assign(resid 80 and name hn )(resid 80 and name hg1+ ) 0.0 0.0 3.5 assign(resid 80 and name hn )(resid 80 and name hg2+ ) 0.0 0.0 4.0 assign(resid 81 and name hn )(resid 81 and name ha ) 2.7 0.0 5.0 assign(resid 81 and name hn )(resid 81 and name hb+ ) 0.0 0.0 3.5 assign(resid 81 and name hn )(resid 81 and name hg+ ) 0.0 0.0 4.8 assign(resid 82 and name hn )(resid 82 and name ha ) 2.7 0.0 5.0 assign(resid 82 and name hn )(resid 82 and name hb ) 0.0 0.0 3.2 assign(resid 82 and name hn )(resid 82 and name hg1+ ) 0.0 0.0 4.8 assign(resid 82 and name hn )(resid 82 and name hg2+ ) 0.0 0.0 4.0 assign(resid 83 and name hb+ )(resid 83 and name hg ) 0.0 0.0 3.5 assign(resid 83 and name hn )(resid 83 and name ha ) 2.7 0.0 5.0 assign(resid 83 and name hn )(resid 83 and name hb1 ) 0.0 0.0 4.0 assign(resid 83 and name hn )(resid 83 and name hb2 ) 0.0 0.0 3.2 assign(resid 83 and name hn )(resid 83 and name hd2+ ) 0.0 0.0 4.0 assign(resid 83 and name hn )(resid 83 and name hg ) 0.0 0.0 5.0 assign(resid 84 and name hn )(resid 84 and name ha ) 2.7 0.0 5.0 assign(resid 84 and name hn )(resid 84 and name hb1 ) 0.0 0.0 4.0 assign(resid 84 and name hn )(resid 84 and name hb2 ) 0.0 0.0 3.2 assign(resid 84 and name hn )(resid 84 and name hd1+ ) 0.0 0.0 4.8 assign(resid 84 and name hn )(resid 84 and name hg ) 0.0 0.0 5.0 assign(resid 85 and name hn )(resid 85 and name ha ) 0.0 0.0 3.2 assign(resid 85 and name hn )(resid 85 and name hb+ ) 0.0 0.0 3.5 assign(resid 85 and name hn )(resid 85 and name hd++ ) 0.0 0.0 5.5 assign(resid 86 and name hn )(resid 86 and name ha1 ) 0.0 0.0 3.2 assign(resid 86 and name hn )(resid 86 and name ha2 ) 0.0 0.0 3.2 assign(resid 87 and name hn )(resid 87 and name ha ) 2.7 0.0 5.0 assign(resid 87 and name hn )(resid 87 and name hb+ ) 0.0 0.0 3.5 assign(resid 88 and name hn )(resid 88 and name ha ) 2.7 0.0 5.0 assign(resid 88 and name hn )(resid 88 and name hb1 ) 0.0 0.0 4.0 assign(resid 88 and name hn )(resid 88 and name hb2 ) 0.0 0.0 3.2 assign(resid 89 and name hn )(resid 89 and name ha ) 2.7 0.0 5.0 assign(resid 89 and name hn )(resid 89 and name hb+ ) 0.0 0.0 3.5 !! Sequential [ Hx(i) to Hx(i-1)] assign(resid 2 and name HN )(resid 1 and name HA ) 0.0 0.0 2.7 assign(resid 2 and name HN )(resid 1 and name HB+ ) 0.0 0.0 4.8 assign(resid 2 and name HN )(resid 1 and name HG+ ) 0.0 0.0 4.0 assign(resid 2 and name HN )(resid 3 and name HN ) 3.2 0.0 5.0 assign(resid 3 and name HN )(resid 2 and name HA ) 0.0 0.0 2.7 assign(resid 3 and name HN )(resid 2 and name HB+ ) 0.0 0.0 4.8 assign(resid 3 and name HN )(resid 4 and name HD++ ) 0.0 0.0 5.5 assign(resid 3 and name HN )(resid 4 and name HN ) 3.2 0.0 5.0 assign(resid 3 and name HA )(resid 4 and name HG ) 0.0 0.0 4.0 assign(resid 4 and name HN )(resid 3 and name HA ) 0.0 0.0 2.7 assign(resid 4 and name HN )(resid 3 and name HB ) 3.2 0.0 1.8 assign(resid 4 and name HN )(resid 3 and name HG2+ ) 0.0 0.0 4.0 assign(resid 4 and name HN )(resid 3 and name HG1+ ) 0.0 0.0 5.8 assign(resid 4 and name HN )(resid 5 and name HN ) 0.0 0.0 2.7 assign(resid 5 and name HN )(resid 4 and name HA ) 3.2 0.0 5.0 assign(resid 5 and name HN )(resid 6 and name HN ) 3.2 0.0 5.0 assign(resid 5 and name HB+ )(resid 4 and name HB+ ) 0.0 0.0 6.6 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 5.8 assign(resid 6 and name HN )(resid 7 and name HN ) 3.2 0.0 5.0 assign(resid 7 and name HN )(resid 6 and name HA ) 0.0 0.0 2.7 assign(resid 7 and name HN )(resid 6 and name HB+ ) 0.0 0.0 4.8 8 assign(resid 7 and name HN )(resid 6 and name HG+ ) 0.0 0.0 4.8 assign(resid 7 and name HN )(resid 6 and name HD+ ) 0.0 0.0 5.8 assign(resid 7 and name HN )(resid 8 and name HN ) 3.2 0.0 5.0 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 HB1 ) 0.0 0.0 4.0 assign(resid 8 and name HN )(resid 7 and name HB2 ) 0.0 0.0 3.2 assign(resid 8 and name HN )(resid 7 and name HD+ ) 0.0 0.0 5.5 assign(resid 8 and name HN )(resid 9 and name HN ) 3.2 0.0 5.0 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 4.0 assign(resid 9 and name HN )(resid 10 and name HN ) 3.2 0.0 5.0 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 ) 3.2 0.0 1.8 assign(resid 10 and name HN )(resid 9 and name HG2+ ) 0.0 0.0 4.0 assign(resid 10 and name HN )(resid 11 and name HN ) 3.2 0.0 5.0 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 ) 3.2 0.0 1.8 assign(resid 11 and name HN )(resid 10 and name HG2+ ) 0.0 0.0 4.8 assign(resid 11 and name HN )(resid 12 and name HN ) 3.2 0.0 5.0 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 HG2+ ) 0.0 0.0 4.8 assign(resid 12 and name HN )(resid 11 and name HG1+ ) 0.0 0.0 4.0 assign(resid 12 and name HN )(resid 13 and name HN ) 3.2 0.0 5.0 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 HB2 ) 3.2 0.0 1.8 assign(resid 13 and name HN )(resid 12 and name HB1 ) 0.0 0.0 3.2 assign(resid 13 and name HN )(resid 12 and name HD2 ) 0.0 0.0 4.0 assign(resid 13 and name HN )(resid 14 and name HN ) 3.2 0.0 5.0 assign(resid 13 and name HB+ )(resid 12 and name HB1 ) 0.0 0.0 4.0 assign(resid 14 and name HN )(resid 13 and name HA ) 0.0 0.0 2.7 assign(resid 14 and name HN )(resid 13 and name HB+ ) 0.0 0.0 4.0 assign(resid 14 and name HN )(resid 15 and name HN ) 0.0 0.0 3.2 assign(resid 15 and name HN )(resid 14 and name HA ) 2.7 0.0 5.0 assign(resid 15 and name HN )(resid 14 and name HB ) 3.2 0.0 1.8 assign(resid 15 and name HN )(resid 16 and name HN ) 0.0 0.0 2.7 assign(resid 16 and name HN )(resid 15 and name HA1 ) 3.2 0.0 5.0 assign(resid 16 and name HN )(resid 15 and name HA2 ) 3.2 0.0 5.0 assign(resid 16 and name HN )(resid 17 and name HN ) 3.2 0.0 5.0 assign(resid 17 and name HN )(resid 16 and name HA ) 0.0 0.0 2.7 assign(resid 17 and name HN )(resid 16 and name HB+ ) 0.0 0.0 4.8 2 assign(resid 17 and name HN )(resid 18 and name HN ) 3.2 0.0 5.0 assign(resid 18 and name HN )(resid 17 and name HA ) 0.0 0.0 2.7 assign(resid 18 and name HN )(resid 17 and name HB ) 0.0 0.0 3.2 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 HN ) 3.2 0.0 5.0 assign(resid 18 and name HD1+ )(resid 17 and name HA ) 0.0 0.0 4.8 assign(resid 19 and name HN )(resid 18 and name HA ) 0.0 0.0 2.7 assign(resid 19 and name HN )(resid 18 and name HG2+ ) 0.0 0.0 4.0 assign(resid 19 and name HN )(resid 20 and name HD+ ) 3.5 0.0 2.3 assign(resid 19 and name HG2+ )(resid 20 and name HD+ ) 0.0 0.0 4.8 assign(resid 20 and name HD1 )(resid 19 and name HA ) 0.0 0.0 2.7 assign(resid 20 and name HD2 )(resid 19 and name HA ) 0.0 0.0 2.7 assign(resid 21 and name HN )(resid 20 and name HA ) 0.0 0.0 2.7 assign(resid 21 and name HN )(resid 20 and name HB2 ) 0.0 0.0 3.2 assign(resid 21 and name HN )(resid 20 and name HG+ ) 0.0 0.0 5.8 assign(resid 21 and name HN )(resid 22 and name HN ) 0.0 0.0 2.7 assign(resid 22 and name HN )(resid 21 and name HA ) 3.2 0.0 5.0 assign(resid 22 and name HN )(resid 21 and name HB+ ) 0.0 0.0 4.0 assign(resid 22 and name HN )(resid 23 and name HN ) 0.0 0.0 2.7 assign(resid 23 and name HN )(resid 22 and name HA1 ) 2.7 0.0 5.0 13 assign(resid 23 and name HN )(resid 22 and name HA2 ) 3.2 0.0 5.0 13 assign(resid 23 and name HN )(resid 24 and name HN ) 0.0 0.0 2.7 assign(resid 24 and name HN )(resid 23 and name HA ) 2.7 0.0 5.0 assign(resid 24 and name HN )(resid 23 and name HB ) 0.0 0.0 2.7 assign(resid 24 and name HN )(resid 23 and name HG2+ ) 0.0 0.0 4.8 assign(resid 24 and name HN )(resid 25 and name HN ) 0.0 0.0 2.7 assign(resid 25 and name HN )(resid 24 and name HA ) 2.7 0.0 5.0 assign(resid 25 and name HN )(resid 24 and name HB+ ) 0.0 0.0 4.0 assign(resid 25 and name HN )(resid 24 and name HG+ ) 0.0 0.0 4.8 assign(resid 25 and name HN )(resid 26 and name HN ) 0.0 0.0 2.7 assign(resid 26 and name HN )(resid 25 and name HA ) 2.7 0.0 5.0 assign(resid 26 and name HN )(resid 25 and name HB+ ) 0.0 0.0 3.5 assign(resid 26 and name HN )(resid 25 and name HG+ ) 0.0 0.0 4.8 assign(resid 26 and name HN )(resid 25 and name HD+ ) 0.0 0.0 4.8 assign(resid 26 and name HN )(resid 27 and name HN ) 0.0 0.0 2.7 assign(resid 26 and name HD1 )(resid 27 and name HA ) 0.0 0.0 4.0 assign(resid 27 and name HN )(resid 26 and name HA ) 2.7 0.0 5.0 assign(resid 27 and name HN )(resid 26 and name HB1 ) 0.0 0.0 2.7 assign(resid 27 and name HN )(resid 28 and name HN ) 0.0 0.0 2.7 assign(resid 28 and name HN )(resid 27 and name HA ) 2.7 0.0 5.0 assign(resid 28 and name HN )(resid 27 and name HB1 ) 3.2 0.0 1.8 assign(resid 28 and name HN )(resid 27 and name HB2 ) 3.2 0.0 1.8 assign(resid 28 and name HN )(resid 29 and name HN ) 0.0 0.0 2.7 assign(resid 29 and name HN )(resid 28 and name HA+ ) 0.0 0.0 3.5 assign(resid 29 and name HN )(resid 30 and name HN ) 3.2 0.0 5.0 assign(resid 30 and name HN )(resid 29 and name HA ) 0.0 0.0 2.7 assign(resid 30 and name HN )(resid 29 and name HB ) 3.2 0.0 1.8 assign(resid 30 and name HN )(resid 29 and name HG1+ ) 0.0 0.0 4.8 assign(resid 30 and name HN )(resid 29 and name HG2+ ) 0.0 0.0 4.0 assign(resid 30 and name HN )(resid 31 and name HN ) 3.2 0.0 5.0 assign(resid 31 and name HN )(resid 30 and name HA ) 0.0 0.0 3.5 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+ ) 0.0 0.0 4.8 assign(resid 31 and name HN )(resid 32 and name HN ) 3.2 0.0 5.0 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 32 and name HN )(resid 31 and name HG+ ) 0.0 0.0 4.8 assign(resid 32 and name HN )(resid 33 and name HN ) 0.0 0.0 2.7 assign(resid 33 and name HN )(resid 32 and name HA1 ) 3.2 0.0 5.0 assign(resid 33 and name HN )(resid 32 and name HA2 ) 2.7 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+ ) 0.0 0.0 3.5 assign(resid 34 and name HN )(resid 35 and name HN ) 3.2 0.0 5.0 assign(resid 35 and name HN )(resid 34 and name HA ) 0.0 0.0 2.7 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 ) 3.2 0.0 5.0 assign(resid 36 and name HN )(resid 35 and name HA ) 0.0 0.0 2.7 assign(resid 36 and name HN )(resid 35 and name HB ) 0.0 0.0 3.2 assign(resid 36 and name HN )(resid 35 and name HG1+ ) 0.0 0.0 4.8 assign(resid 36 and name HN )(resid 35 and name HG2+ ) 0.0 0.0 4.8 assign(resid 36 and name HN )(resid 37 and name HG2+ ) 0.0 0.0 5.8 assign(resid 36 and name HN )(resid 37 and name HN ) 3.2 0.0 5.0 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 4.8 assign(resid 37 and name HN )(resid 36 and name HG1 ) 0.0 0.0 4.0 assign(resid 37 and name HN )(resid 36 and name HG2 ) 0.0 0.0 4.0 assign(resid 37 and name HN )(resid 38 and name HN ) 3.2 0.0 5.0 assign(resid 37 and name HG2+ )(resid 36 and name HA ) 0.0 0.0 4.0 assign(resid 38 and name HN )(resid 37 and name HA ) 0.0 0.0 2.7 assign(resid 38 and name HN )(resid 37 and name HG11 ) 0.0 0.0 4.0 assign(resid 38 and name HN )(resid 37 and name HG12 ) 0.0 0.0 4.0 assign(resid 38 and name HN )(resid 37 and name HG2+ ) 0.0 0.0 4.8 assign(resid 38 and name HN )(resid 39 and name HN ) 3.2 0.0 5.0 assign(resid 39 and name HN )(resid 38 and name HA ) 0.0 0.0 2.7 assign(resid 39 and name HN )(resid 38 and name HB+ ) 0.0 0.0 4.8 assign(resid 39 and name HN )(resid 38 and name HG+ ) 0.0 0.0 4.8 assign(resid 39 and name HN )(resid 40 and name HG2+ ) 0.0 0.0 5.8 assign(resid 39 and name HN )(resid 40 and name HN ) 3.2 0.0 5.0 assign(resid 40 and name HN )(resid 39 and name HA ) 0.0 0.0 2.7 assign(resid 40 and name HN )(resid 39 and name HB ) 0.0 0.0 3.2 assign(resid 40 and name HN )(resid 39 and name HG1+ ) 0.0 0.0 4.8 10 assign(resid 40 and name HN )(resid 39 and name HG2+ ) 0.0 0.0 4.8 assign(resid 40 and name HN )(resid 41 and name HN ) 3.2 0.0 5.0 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 4.0 assign(resid 42 and name HN )(resid 41 and name HG+ ) 0.0 0.0 4.0 assign(resid 42 and name HN )(resid 41 and name HD+ ) 0.0 0.0 5.8 assign(resid 42 and name HN )(resid 43 and name HN ) 3.2 0.0 5.0 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 HB+ ) 0.0 0.0 4.8 assign(resid 43 and name HN )(resid 44 and name HN ) 3.2 0.0 5.0 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 HB+ ) 0.0 0.0 4.8 assign(resid 44 and name HN )(resid 43 and name HG+ ) 0.0 0.0 4.8 assign(resid 44 and name HN )(resid 45 and name HN ) 3.2 0.0 5.0 assign(resid 45 and name HN )(resid 44 and name HA2 ) 2.7 0.0 5.0 2 assign(resid 45 and name HN )(resid 44 and name HA1 ) 0.0 0.0 2.7 2 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 47 and name HD+ ) 3.2 0.0 5.0 assign(resid 46 and name HG+ )(resid 47 and name HD+ ) 0.0 0.0 5.6 assign(resid 47 and name HD1 )(resid 46 and name HA ) 0.0 0.0 2.7 assign(resid 47 and name HD2 )(resid 46 and name HA ) 0.0 0.0 2.7 assign(resid 47 and name HD1 )(resid 46 and name HB+ ) 0.0 0.0 4.8 assign(resid 47 and name HD2 )(resid 46 and name HB+ ) 0.0 0.0 4.8 assign(resid 48 and name HN )(resid 47 and name HA ) 0.0 0.0 2.7 assign(resid 48 and name HN )(resid 47 and name HB+ ) 0.0 0.0 4.0 assign(resid 48 and name HN )(resid 47 and name HG+ ) 0.0 0.0 5.8 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 48 and name HB+ ) 0.0 0.0 3.5 assign(resid 49 and name HN )(resid 48 and name HD+ ) 0.0 0.0 4.8 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 49 and name HB+ ) 0.0 0.0 4.0 assign(resid 50 and name HN )(resid 49 and name HG+ ) 0.0 0.0 4.8 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 HA1 ) 2.7 0.0 5.0 assign(resid 51 and name HN )(resid 50 and name HA2 ) 0.0 0.0 2.7 assign(resid 51 and name HN )(resid 52 and name HN ) 3.2 0.0 5.0 assign(resid 52 and name HN )(resid 51 and name HA ) 0.0 0.0 2.7 assign(resid 52 and name HN )(resid 51 and name HB ) 3.2 0.0 1.8 assign(resid 52 and name HN )(resid 51 and name HG2+ ) 0.0 0.0 3.5 assign(resid 52 and name HN )(resid 53 and name HN ) 3.2 0.0 5.0 assign(resid 52 and name HA )(resid 51 and name HG2+ ) 0.0 0.0 5.8 assign(resid 53 and name HN )(resid 52 and name HA ) 0.0 0.0 2.7 assign(resid 53 and name HN )(resid 52 and name HB+ ) 0.0 0.0 4.0 assign(resid 53 and name HN )(resid 54 and name HN ) 3.2 0.0 5.0 assign(resid 54 and name HN )(resid 53 and name HA ) 0.0 0.0 2.7 assign(resid 54 and name HN )(resid 53 and name HB ) 3.2 0.0 1.8 assign(resid 54 and name HN )(resid 53 and name HG2+ ) 0.0 0.0 4.0 assign(resid 54 and name HN )(resid 55 and name HN ) 3.2 0.0 5.0 assign(resid 55 and name HN )(resid 54 and name HA ) 0.0 0.0 2.7 assign(resid 55 and name HN )(resid 54 and name HB+ ) 0.0 0.0 4.0 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 55 and name HB+ ) 0.0 0.0 4.0 assign(resid 56 and name HN )(resid 55 and name HG+ ) 0.0 0.0 4.0 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 57 and name HN )(resid 56 and name HB ) 3.2 0.0 1.8 assign(resid 57 and name HN )(resid 56 and name HG2+ ) 0.0 0.0 4.8 assign(resid 57 and name HN )(resid 56 and name HG1+ ) 0.0 0.0 4.0 assign(resid 57 and name HN )(resid 58 and name HN ) 3.2 0.0 5.0 assign(resid 58 and name HN )(resid 57 and name HA1 ) 0.0 0.0 2.7 assign(resid 58 and name HN )(resid 57 and name HA2 ) 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 58 and name HB+ ) 0.0 0.0 4.0 assign(resid 59 and name HN )(resid 58 and name HG+ ) 0.0 0.0 4.8 assign(resid 59 and name HE22 )(resid 58 and name HG+ ) 0.0 0.0 4.8 assign(resid 59 and name HN )(resid 60 and name HN ) 0.0 0.0 3.2 assign(resid 60 and name HN )(resid 59 and name HA ) 3.2 0.0 5.0 assign(resid 60 and name HN )(resid 59 and name HB1 ) 3.2 0.0 1.8 assign(resid 60 and name HN )(resid 61 and name HN ) 0.0 0.0 2.7 assign(resid 61 and name HN )(resid 60 and name HA1 ) 2.7 0.0 5.0 assign(resid 61 and name HN )(resid 60 and name HA2 ) 2.7 0.0 5.0 assign(resid 61 and name HN )(resid 62 and name HN ) 3.2 0.0 5.0 assign(resid 62 and name HN )(resid 61 and name HA ) 0.0 0.0 2.7 assign(resid 62 and name HN )(resid 61 and name HB+ ) 0.0 0.0 4.0 assign(resid 62 and name HN )(resid 63 and name HN ) 3.2 0.0 5.0 assign(resid 63 and name HN )(resid 62 and name HA ) 0.0 0.0 2.7 assign(resid 63 and name HN )(resid 62 and name HB ) 3.2 0.0 1.8 assign(resid 63 and name HN )(resid 62 and name HG1+ ) 0.0 0.0 5.8 assign(resid 63 and name HN )(resid 62 and name HG2+ ) 0.0 0.0 4.8 assign(resid 63 and name HN )(resid 64 and name HN ) 3.2 0.0 5.0 assign(resid 64 and name HN )(resid 63 and name HA ) 0.0 0.0 2.7 assign(resid 64 and name HN )(resid 63 and name HG2+ ) 0.0 0.0 4.0 assign(resid 64 and name HN )(resid 65 and name HD+ ) 3.2 0.0 5.0 assign(resid 65 and name HD1 )(resid 64 and name HA ) 0.0 0.0 2.7 assign(resid 65 and name HD2 )(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 65 and name HD+ ) 3.2 0.0 5.0 assign(resid 66 and name HN )(resid 65 and name HB+ ) 0.0 0.0 4.8 assign(resid 66 and name HN )(resid 67 and name HN ) 0.0 0.0 2.7 assign(resid 67 and name HN )(resid 66 and name HA ) 3.2 0.0 5.0 assign(resid 67 and name HN )(resid 66 and name HB+ ) 0.0 0.0 4.0 assign(resid 67 and name HN )(resid 66 and name HG+ ) 0.0 0.0 4.8 assign(resid 67 and name HN )(resid 66 and name HD+ ) 0.0 0.0 5.8 assign(resid 67 and name HN )(resid 68 and name HB+ ) 0.0 0.0 5.8 assign(resid 67 and name HN )(resid 68 and name HN ) 0.0 0.0 2.7 assign(resid 68 and name HN )(resid 67 and name HA ) 3.2 0.0 5.0 assign(resid 68 and name HN )(resid 67 and name HB+ ) 0.0 0.0 4.0 assign(resid 68 and name HN )(resid 69 and name HN ) 0.0 0.0 2.7 assign(resid 69 and name HN )(resid 68 and name HA ) 3.2 0.0 5.0 assign(resid 69 and name HN )(resid 68 and name HB+ ) 0.0 0.0 4.0 assign(resid 69 and name HN )(resid 68 and name HG ) 0.0 0.0 4.8 assign(resid 69 and name HN )(resid 70 and name HN ) 0.0 0.0 2.7 assign(resid 70 and name HN )(resid 69 and name HA ) 3.2 0.0 5.0 assign(resid 70 and name HN )(resid 69 and name HB+ ) 0.0 0.0 4.0 assign(resid 70 and name HN )(resid 69 and name HG+ ) 0.0 0.0 5.8 assign(resid 70 and name HN )(resid 69 and name HD+ ) 0.0 0.0 5.8 assign(resid 70 and name HN )(resid 71 and name HN ) 0.0 0.0 2.7 assign(resid 71 and name HN )(resid 70 and name HA ) 3.2 0.0 5.0 assign(resid 71 and name HN )(resid 70 and name HB+ ) 0.0 0.0 4.0 assign(resid 71 and name HN )(resid 72 and name HN ) 0.0 0.0 2.7 assign(resid 72 and name HN )(resid 71 and name HA ) 3.2 0.0 5.0 assign(resid 72 and name HN )(resid 71 and name HB ) 0.0 0.0 3.2 assign(resid 72 and name HN )(resid 71 and name HG1+ ) 0.0 0.0 4.0 assign(resid 72 and name HN )(resid 73 and name HN ) 0.0 0.0 2.7 assign(resid 73 and name HN )(resid 72 and name HA ) 3.2 0.0 5.0 assign(resid 73 and name HN )(resid 72 and name HB ) 0.0 0.0 3.2 assign(resid 73 and name HN )(resid 72 and name HG1+ ) 0.0 0.0 4.8 assign(resid 73 and name HN )(resid 72 and name HG2+ ) 0.0 0.0 4.8 assign(resid 73 and name HN )(resid 74 and name HG1+ ) 0.0 0.0 4.8 assign(resid 73 and name HN )(resid 74 and name HD1+ ) 0.0 0.0 5.8 assign(resid 73 and name HN )(resid 74 and name HN ) 0.0 0.0 2.7 assign(resid 74 and name HN )(resid 73 and name HA1 ) 3.2 0.0 5.0 3 assign(resid 74 and name HN )(resid 73 and name HA2 ) 2.7 0.0 5.0 3 assign(resid 74 and name HN )(resid 75 and name HN ) 3.2 0.0 5.0 assign(resid 75 and name HN )(resid 74 and name HA ) 0.0 0.0 2.7 assign(resid 75 and name HN )(resid 74 and name HB ) 3.2 0.0 1.8 assign(resid 75 and name HN )(resid 74 and name HG2+ ) 0.0 0.0 4.0 assign(resid 75 and name HN )(resid 76 and name HD+ ) 3.5 0.0 5.0 assign(resid 76 and name HD1 )(resid 75 and name HA ) 0.0 0.0 2.7 assign(resid 76 and name HD2 )(resid 75 and name HA ) 0.0 0.0 2.7 assign(resid 77 and name HN )(resid 76 and name HA ) 0.0 0.0 2.7 assign(resid 77 and name HN )(resid 76 and name HB+ ) 0.0 0.0 4.0 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 HA1 ) 3.2 0.0 5.0 assign(resid 78 and name HN )(resid 77 and name HA2 ) 3.2 0.0 5.0 assign(resid 78 and name HN )(resid 79 and name HN ) 3.2 0.0 5.0 assign(resid 79 and name HN )(resid 78 and name HA ) 0.0 0.0 2.7 assign(resid 79 and name HN )(resid 78 and name HB+ ) 0.0 0.0 4.0 assign(resid 79 and name HN )(resid 78 and name HG+ ) 0.0 0.0 4.0 assign(resid 79 and name HN )(resid 80 and name HN ) 3.2 0.0 5.0 assign(resid 80 and name HN )(resid 79 and name HA ) 0.0 0.0 2.7 assign(resid 80 and name HN )(resid 79 and name HB ) 3.2 0.0 1.8 assign(resid 80 and name HN )(resid 79 and name HG2+ ) 0.0 0.0 4.0 assign(resid 80 and name HN )(resid 81 and name HN ) 3.2 0.0 5.0 assign(resid 81 and name HN )(resid 80 and name HA ) 0.0 0.0 2.7 assign(resid 81 and name HN )(resid 80 and name HB ) 0.0 0.0 3.2 assign(resid 81 and name HN )(resid 80 and name HG1+ ) 0.0 0.0 4.0 assign(resid 81 and name HN )(resid 80 and name HG2+ ) 0.0 0.0 4.8 assign(resid 81 and name HN )(resid 80 and name HD1+ ) 0.0 0.0 5.8 assign(resid 81 and name HN )(resid 82 and name HN ) 3.2 0.0 5.0 assign(resid 82 and name HN )(resid 81 and name HA ) 0.0 0.0 2.7 assign(resid 82 and name HN )(resid 81 and name HB+ ) 0.0 0.0 4.8 assign(resid 82 and name HN )(resid 81 and name HG+ ) 0.0 0.0 4.8 assign(resid 82 and name HN )(resid 83 and name HD2+ ) 0.0 0.0 5.8 assign(resid 82 and name HN )(resid 83 and name HN ) 3.2 0.0 5.0 assign(resid 83 and name HN )(resid 82 and name HA ) 0.0 0.0 2.7 assign(resid 83 and name HN )(resid 82 and name HG1+ ) 0.0 0.0 4.0 assign(resid 83 and name HN )(resid 82 and name HG2+ ) 0.0 0.0 4.8 assign(resid 83 and name HN )(resid 84 and name HN ) 3.2 0.0 5.0 assign(resid 84 and name HN )(resid 83 and name HA ) 0.0 0.0 2.7 assign(resid 84 and name HN )(resid 83 and name HB+ ) 0.0 0.0 4.8 assign(resid 84 and name HN )(resid 83 and name HD2+ ) 0.0 0.0 4.8 assign(resid 84 and name HN )(resid 85 and name HN ) 3.2 0.0 5.0 assign(resid 85 and name HN )(resid 84 and name HA ) 0.0 0.0 3.2 assign(resid 85 and name HN )(resid 84 and name HB2 ) 3.2 0.0 1.8 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 HG ) 0.0 0.0 5.0 assign(resid 85 and name HN )(resid 84 and name HD2+ ) 0.0 0.0 4.8 assign(resid 85 and name HN )(resid 86 and name HN ) 0.0 0.0 2.7 assign(resid 86 and name HN )(resid 85 and name HA ) 2.7 0.0 5.0 assign(resid 86 and name HN )(resid 85 and name HB+ ) 0.0 0.0 4.0 assign(resid 86 and name HN )(resid 87 and name HN ) 3.2 0.0 5.0 assign(resid 87 and name HN )(resid 86 and name HA1 ) 0.0 0.0 3.2 assign(resid 87 and name HN )(resid 86 and name HA2 ) 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 88 and name HN )(resid 87 and name HB+ ) 0.0 0.0 4.0 assign(resid 88 and name HN )(resid 89 and name HN ) 3.2 0.0 5.0 assign(resid 89 and name HN )(resid 88 and name HA ) 0.0 0.0 2.7 assign(resid 89 and name HN )(resid 88 and name HB1 ) 0.0 0.0 3.2 assign(resid 89 and name HN )(resid 88 and name HB2 ) 3.2 0.0 1.8 assign(resid 89 and name HN )(resid 90 and name HD1 ) 3.2 0.0 5.0 assign(resid 89 and name HN )(resid 90 and name HD2 ) 3.2 0.0 5.0 !! Medium-range [ Hx(i) to Hx(i?2-5)] assign(resid 3 and name hg2+ )(resid 6 and name ha ) 0.0 0.0 4.8 assign(resid 3 and name hg2+ )(resid 6 and name he+ ) 0.0 0.0 5.6 assign(resid 4 and name hd2+ )(resid 2 and name hb+ ) 0.0 0.0 4.8 assign(resid 5 and name hn )(resid 3 and name ha ) 0.0 0.0 4.0 assign(resid 5 and name hn )(resid 3 and name hg1+ ) 0.0 0.0 3.5 assign(resid 5 and name hn )(resid 3 and name hg2+ ) 0.0 0.0 4.8 assign(resid 6 and name hn )(resid 3 and name hg2+ ) 0.0 0.0 5.8 assign(resid 9 and name hb )(resid 7 and name he1 ) 0.0 0.0 3.2 assign(resid 9 and name hg2+ )(resid 7 and name he1 ) 0.0 0.0 3.5 assign(resid 12 and name hb1 )(resid 16 and name hb1 ) 0.0 0.0 5.0 assign(resid 12 and name hb2 )(resid 16 and name hb1 ) 0.0 0.0 5.0 assign(resid 14 and name hd1+ )(resid 16 and name hb+ ) 0.0 0.0 4.8 assign(resid 14 and name hd1+ )(resid 16 and name hd+ ) 0.0 0.0 5.6 assign(resid 15 and name ha2 )(resid 11 and name hg1+ ) 0.0 0.0 4.0 assign(resid 15 and name hn )(resid 11 and name hg1+ ) 0.0 0.0 4.8 assign(resid 15 and name hn )(resid 13 and name ha ) 0.0 0.0 4.0 assign(resid 16 and name hn )(resid 12 and name hb2 ) 0.0 0.0 5.0 assign(resid 16 and name hn )(resid 14 and name hn ) 3.2 0.0 1.8 assign(resid 18 and name hd1+ )(resid 16 and name hd+ ) 0.0 0.0 4.8 assign(resid 20 and name ha )(resid 18 and name hg2+ ) 0.0 0.0 4.8 assign(resid 21 and name ha )(resid 24 and name hb+ ) 0.0 0.0 4.0 assign(resid 21 and name ha )(resid 24 and name hd+ ) 0.0 0.0 4.0 assign(resid 21 and name ha )(resid 24 and name he ) 0.0 0.0 2.7 assign(resid 21 and name ha )(resid 24 and name hg+ ) 0.0 0.0 4.8 assign(resid 21 and name hb+ )(resid 24 and name he ) 0.0 0.0 4.8 assign(resid 22 and name ha+ )(resid 25 and name hb+ ) 0.0 0.0 4.8 assign(resid 22 and name ha+ )(resid 25 and name hg+ ) 0.0 0.0 5.8 assign(resid 22 and name hn )(resid 20 and name ha ) 0.0 0.0 5.0 assign(resid 22 and name hn )(resid 20 and name hb1 ) 0.0 0.0 4.0 assign(resid 22 and name hn )(resid 20 and name hb2 ) 0.0 0.0 4.0 assign(resid 23 and name ha )(resid 26 and name hb1 ) 0.0 0.0 3.2 assign(resid 23 and name ha )(resid 26 and name hb2 ) 0.0 0.0 4.0 assign(resid 23 and name hg2+ )(resid 19 and name hd1+ ) 0.0 0.0 5.6 assign(resid 23 and name hg2+ )(resid 19 and name hg2+ ) 0.0 0.0 4.3 assign(resid 23 and name hn )(resid 19 and name hg2+ ) 0.0 0.0 4.8 assign(resid 23 and name hn )(resid 20 and name hb1 ) 0.0 0.0 5.0 assign(resid 23 and name hn )(resid 20 and name hb2 ) 0.0 0.0 3.2 assign(resid 23 and name hn )(resid 20 and name hd+ ) 0.0 0.0 4.8 assign(resid 23 and name hn )(resid 20 and name hg+ ) 0.0 0.0 4.8 assign(resid 23 and name hn )(resid 21 and name ha ) 0.0 0.0 5.0 assign(resid 23 and name hn )(resid 21 and name hb+ ) 0.0 0.0 5.8 assign(resid 23 and name hn )(resid 25 and name hn ) 3.2 0.0 1.8 assign(resid 24 and name hn )(resid 20 and name hd+ ) 0.0 0.0 5.8 assign(resid 24 and name hn )(resid 21 and name ha ) 0.0 0.0 3.5 assign(resid 24 and name hn )(resid 22 and name ha+ ) 0.0 0.0 5.8 assign(resid 25 and name hn )(resid 21 and name ha ) 0.0 0.0 4.5 assign(resid 25 and name hn )(resid 22 and name ha+ ) 0.0 0.0 4.0 assign(resid 25 and name hn )(resid 23 and name ha ) 0.0 0.0 5.0 assign(resid 25 and name hn )(resid 27 and name hn ) 3.2 0.0 1.8 assign(resid 26 and name hd1 )(resid 23 and name hg2+ ) 0.0 0.0 4.8 assign(resid 26 and name hn )(resid 22 and name ha+ ) 0.0 0.0 4.8 assign(resid 26 and name hn )(resid 23 and name ha ) 0.0 0.0 3.5 assign(resid 26 and name hn )(resid 23 and name hg2+ ) 0.0 0.0 5.8 assign(resid 27 and name hb1 )(resid 29 and name hd1+ ) 0.0 0.0 4.0 assign(resid 27 and name hb1 )(resid 29 and name hg1+ ) 0.0 0.0 4.8 assign(resid 27 and name hb2 )(resid 29 and name hd1+ ) 0.0 0.0 4.0 assign(resid 27 and name hb2 )(resid 29 and name hg1+ ) 0.0 0.0 4.8 assign(resid 27 and name hn )(resid 23 and name ha ) 0.0 0.0 4.5 assign(resid 27 and name hn )(resid 23 and name hg2+ ) 0.0 0.0 4.8 assign(resid 27 and name hn )(resid 24 and name ha ) 0.0 0.0 4.0 assign(resid 27 and name hn )(resid 29 and name hd1+ ) 0.0 0.0 4.8 assign(resid 28 and name hn )(resid 25 and name ha ) 0.0 0.0 3.5 assign(resid 28 and name hn )(resid 25 and name hb+ ) 0.0 0.0 5.8 assign(resid 28 and name hn )(resid 24 and name ha ) 0.0 0.0 4.5 assign(resid 28 and name hn )(resid 25 and name hg+ ) 0.0 0.0 5.8 assign(resid 29 and name hn )(resid 25 and name ha ) 0.0 0.0 4.5 assign(resid 29 and name hn )(resid 27 and name hb1 ) 0.0 0.0 5.0 assign(resid 29 and name hn )(resid 27 and name hb2 ) 0.0 0.0 5.0 assign(resid 30 and name hn )(resid 33 and name hb+ ) 0.0 0.0 4.8 assign(resid 30 and name hn )(resid 33 and name hn ) 0.0 0.0 4.0 assign(resid 33 and name hn )(resid 31 and name ha ) 0.0 0.0 3.5 assign(resid 38 and name hd+ )(resid 40 and name hg2+ ) 0.0 0.0 4.8 assign(resid 40 and name hg2+ )(resid 38 and name he+ ) 0.0 0.0 4.8 assign(resid 42 and name he2 )(resid 45 and name ha ) 0.0 0.0 4.0 assign(resid 42 and name he1 )(resid 46 and name ha ) 0.0 0.0 4.0 assign(resid 42 and name hn )(resid 40 and name hg1+ ) 0.0 0.0 5.8 assign(resid 43 and name hn )(resid 47 and name ha ) 0.0 0.0 4.0 assign(resid 46 and name hg+ )(resid 48 and name he+ ) 0.0 0.0 5.6 assign(resid 46 and name hn )(resid 43 and name hn ) 0.0 0.0 4.0 assign(resid 54 and name hb+ )(resid 52 and name hz ) 0.0 0.0 3.5 assign(resid 59 and name hn )(resid 61 and name hn ) 3.2 0.0 1.8 assign(resid 60 and name hn )(resid 58 and name ha ) 0.0 0.0 5.0 assign(resid 61 and name hn )(resid 59 and name hb1 ) 0.0 0.0 5.0 assign(resid 61 and name hn )(resid 59 and name hb2 ) 0.0 0.0 5.0 assign(resid 67 and name ha )(resid 70 and name hb+ ) 0.0 0.0 4.0 assign(resid 67 and name hn )(resid 65 and name ha ) 0.0 0.0 5.0 assign(resid 67 and name hn )(resid 65 and name hg+ ) 0.0 0.0 4.8 assign(resid 67 and name hn )(resid 69 and name hn ) 3.2 0.0 1.8 assign(resid 68 and name ha )(resid 71 and name hb ) 0.0 0.0 3.2 assign(resid 68 and name hn )(resid 65 and name hb1 ) 0.0 0.0 5.0 assign(resid 68 and name hn )(resid 65 and name hb2 ) 0.0 0.0 3.2 assign(resid 68 and name hn )(resid 70 and name hn ) 3.2 0.0 1.8 assign(resid 69 and name ha )(resid 72 and name hb ) 0.0 0.0 3.2 assign(resid 69 and name ha )(resid 72 and name hd1+ ) 0.0 0.0 4.0 assign(resid 69 and name he )(resid 66 and name ha ) 0.0 0.0 3.2 assign(resid 69 and name hn )(resid 65 and name hd+ ) 0.0 0.0 5.8 assign(resid 69 and name hn )(resid 71 and name hn ) 3.2 0.0 1.8 assign(resid 70 and name hn )(resid 66 and name hg+ ) 0.0 0.0 5.8 assign(resid 70 and name hn )(resid 67 and name ha ) 0.0 0.0 4.0 assign(resid 71 and name hn )(resid 68 and name ha ) 0.0 0.0 3.5 assign(resid 72 and name hn )(resid 68 and name ha ) 0.0 0.0 4.5 assign(resid 72 and name hn )(resid 69 and name ha ) 0.0 0.0 4.0 assign(resid 72 and name hn )(resid 74 and name hg1+ ) 0.0 0.0 5.8 assign(resid 73 and name hn )(resid 69 and name ha ) 0.0 0.0 4.5 assign(resid 73 and name hn )(resid 70 and name ha ) 0.0 0.0 3.5 assign(resid 78 and name hn )(resid 74 and name hg2+ ) 0.0 0.0 5.8 assign(resid 78 and name hn )(resid 76 and name ha ) 0.0 0.0 4.0 assign(resid 86 and name hn )(resid 84 and name ha ) 0.0 0.0 5.0 assign(resid 86 and name hn )(resid 84 and name hd2+ ) 0.0 0.0 4.8 assign(resid 88 and name he1 )(resid 86 and name ha1 ) 0.0 0.0 4.0 assign(resid 89 and name hn )(resid 89 and name hb+ ) 0.0 0.0 3.5 !! Long-range [ Hx(i) to Hx(i>?5)] assign(resid 2 and name hn )(resid 85 and name hd++ ) 0.0 0.0 5.5 assign(resid 3 and name ha )(resid 85 and name ha ) 0.0 0.0 3.2 assign(resid 3 and name hg2+ )(resid 83 and name ha ) 0.0 0.0 4.0 assign(resid 3 and name hg2+ )(resid 83 and name hb1 ) 0.0 0.0 3.2 assign(resid 4 and name hb2 )(resid 84 and name hb1 ) 0.0 0.0 5.0 assign(resid 4 and name hb2 )(resid 84 and name hb2 ) 0.0 0.0 4.0 assign(resid 4 and name hd1+ )(resid 84 and name hd2+ ) 0.0 0.0 4.8 assign(resid 4 and name hd1+ )(resid 86 and name ha1 ) 0.0 0.0 4.0 assign(resid 4 and name hd1+ )(resid 86 and name ha2 ) 0.0 0.0 4.0 assign(resid 4 and name hd1+ )(resid 87 and name hb+ ) 0.0 0.0 4.0 assign(resid 4 and name hd1+ )(resid 87 and name hd2 ) 0.0 0.0 4.0 assign(resid 4 and name hd2+ )(resid 86 and name ha1 ) 4.0 0.0 9.0 assign(resid 4 and name hd2+ )(resid 86 and name ha2 ) 4.0 0.0 9.0 assign(resid 4 and name hd2+ )(resid 87 and name hd2 ) 0.0 0.0 4.8 assign(resid 4 and name hn )(resid 84 and name hb1 ) 0.0 0.0 4.0 assign(resid 4 and name hn )(resid 84 and name hb2 ) 0.0 0.0 4.0 assign(resid 4 and name hn )(resid 85 and name ha ) 0.0 0.0 4.0 assign(resid 5 and name hb+ )(resid 23 and name ha ) 0.0 0.0 4.8 assign(resid 5 and name hb+ )(resid 26 and name hd1 ) 0.0 0.0 3.5 assign(resid 5 and name hb+ )(resid 84 and name hb+ ) 0.0 0.0 4.8 assign(resid 5 and name hn )(resid 83 and name ha ) 0.0 0.0 5.0 assign(resid 5 and name hn )(resid 84 and name hb1 ) 0.0 0.0 4.0 assign(resid 5 and name hn )(resid 84 and name hb2 ) 0.0 0.0 2.7 assign(resid 5 and name hn )(resid 84 and name hd1+ ) 0.0 0.0 4.0 assign(resid 5 and name hn )(resid 84 and name hd2+ ) 0.0 0.0 5.8 assign(resid 5 and name hn )(resid 84 and name hn ) 0.0 0.0 3.5 assign(resid 6 and name ha )(resid 82 and name hb ) 0.0 0.0 5.0 assign(resid 7 and name he1 )(resid 17 and name hd1+ ) 0.0 0.0 4.0 assign(resid 7 and name he1 )(resid 19 and name hd1+ ) 0.0 0.0 4.0 assign(resid 7 and name hn )(resid 81 and name ha ) 0.0 0.0 5.0 assign(resid 7 and name hn )(resid 81 and name hg+ ) 0.0 0.0 4.8 assign(resid 7 and name hn )(resid 82 and name hb ) 0.0 0.0 4.0 assign(resid 7 and name hn )(resid 82 and name hg1+ ) 0.0 0.0 4.8 assign(resid 7 and name hn )(resid 82 and name hn ) 0.0 0.0 3.5 assign(resid 7 and name hn )(resid 83 and name ha ) 0.0 0.0 4.0 assign(resid 8 and name ha )(resid 81 and name ha ) 0.0 0.0 2.7 assign(resid 8 and name ha )(resid 81 and name hb+ ) 0.0 0.0 5.8 assign(resid 8 and name ha )(resid 81 and name hg+ ) 0.0 0.0 5.8 assign(resid 8 and name ha )(resid 82 and name hg2+ ) 0.0 0.0 4.8 assign(resid 8 and name hb+ )(resid 79 and name hg2+ ) 0.0 0.0 4.8 assign(resid 9 and name hg2+ )(resid 82 and name hg2+ ) 0.0 0.0 4.8 assign(resid 9 and name hn )(resid 79 and name ha ) 0.0 0.0 5.0 assign(resid 9 and name hn )(resid 79 and name hg2+ ) 0.0 0.0 4.8 assign(resid 9 and name hn )(resid 80 and name hg1+ ) 0.0 0.0 4.8 assign(resid 9 and name hn )(resid 80 and name hn ) 0.0 0.0 3.5 assign(resid 9 and name hn )(resid 81 and name ha ) 0.0 0.0 4.0 assign(resid 10 and name ha )(resid 79 and name ha ) 0.0 0.0 3.2 assign(resid 10 and name hg2+ )(resid 77 and name ha2 ) 0.0 0.0 4.0 assign(resid 10 and name hn )(resid 80 and name hg1+ ) 0.0 0.0 5.8 assign(resid 11 and name hn )(resid 79 and name ha ) 0.0 0.0 4.0 assign(resid 11 and name hn )(resid 80 and name hg1+ ) 0.0 0.0 5.8 assign(resid 11 and name hn )(resid 80 and name hg2+ ) 0.0 0.0 4.8 assign(resid 12 and name hn )(resid 17 and name ha ) 0.0 0.0 5.0 assign(resid 12 and name hn )(resid 17 and name hg2+ ) 0.0 0.0 5.8 assign(resid 16 and name ha )(resid 63 and name ha ) 0.0 0.0 2.7 assign(resid 16 and name hn )(resid 11 and name hg1+ ) 0.0 0.0 5.8 assign(resid 17 and name hd1+ )(resid 7 and name hz ) 0.0 0.0 4.0 assign(resid 17 and name hg1+ )(resid 63 and name ha ) 0.0 0.0 4.8 assign(resid 17 and name hg2+ )(resid 11 and name ha ) 0.0 0.0 3.5 assign(resid 17 and name hn )(resid 62 and name hg1+ ) 0.0 0.0 4.0 assign(resid 17 and name hn )(resid 63 and name ha ) 0.0 0.0 3.5 assign(resid 18 and name hd1+ )(resid 61 and name ha ) 0.0 0.0 4.0 assign(resid 18 and name hd1+ )(resid 61 and name hb+ ) 0.0 0.0 4.8 assign(resid 18 and name hg2+ )(resid 60 and name ha+ ) 0.0 0.0 4.8 assign(resid 19 and name ha )(resid 7 and name he1 ) 0.0 0.0 3.2 assign(resid 19 and name hb )(resid 24 and name hd+ ) 0.0 0.0 3.5 assign(resid 19 and name hn )(resid 60 and name ha1 ) 0.0 0.0 4.0 assign(resid 19 and name hn )(resid 61 and name ha ) 0.0 0.0 3.5 assign(resid 23 and name hg2+ )(resid 5 and name hb+ ) 0.0 0.0 4.8 assign(resid 24 and name ha )(resid 29 and name hb ) 0.0 0.0 2.7 assign(resid 24 and name ha )(resid 29 and name hd1+ ) 0.0 0.0 3.5 assign(resid 24 and name ha )(resid 29 and name hg1+ ) 0.0 0.0 4.8 assign(resid 24 and name he )(resid 19 and name hb ) 0.0 0.0 4.0 assign(resid 24 and name he )(resid 19 and name hg2+ ) 0.0 0.0 4.0 assign(resid 24 and name he )(resid 60 and name ha+ ) 0.0 0.0 4.0 assign(resid 24 and name hg+ )(resid 29 and name hd1+ ) 0.0 0.0 4.8 assign(resid 24 and name hn )(resid 19 and name hd1+ ) 0.0 0.0 5.8 assign(resid 24 and name hn )(resid 19 and name hg2+ ) 0.0 0.0 4.8 assign(resid 29 and name hb )(resid 24 and name hb+ ) 0.0 0.0 4.8 assign(resid 29 and name hd1+ )(resid 35 and name hg2+ ) 0.0 0.0 4.8 assign(resid 29 and name hn )(resid 24 and name ha ) 0.0 0.0 4.0 assign(resid 30 and name hn )(resid 35 and name hg1+ ) 0.0 0.0 5.8 assign(resid 31 and name ha )(resid 56 and name hb ) 0.0 0.0 4.0 assign(resid 31 and name ha )(resid 56 and name hg1+ ) 0.0 0.0 3.5 assign(resid 31 and name ha )(resid 57 and name ha2 ) 0.0 0.0 4.0 assign(resid 31 and name hg+ )(resid 57 and name ha2 ) 0.0 0.0 4.0 assign(resid 31 and name hn )(resid 56 and name hg1+ ) 0.0 0.0 4.8 assign(resid 32 and name hn )(resid 55 and name hd+ ) 0.0 0.0 4.8 assign(resid 32 and name hn )(resid 56 and name hg2+ ) 0.0 0.0 5.8 assign(resid 32 and name hn )(resid 56 and name hg1+ ) 0.0 0.0 4.8 assign(resid 32 and name hn )(resid 56 and name hn ) 0.0 0.0 4.0 assign(resid 33 and name hn )(resid 55 and name hg+ ) 0.0 0.0 4.8 assign(resid 33 and name hn )(resid 56 and name hb ) 0.0 0.0 3.2 assign(resid 33 and name hn )(resid 56 and name hg1+ ) 0.0 0.0 4.8 assign(resid 33 and name hn )(resid 56 and name hg2+ ) 0.0 0.0 5.8 assign(resid 34 and name ha )(resid 55 and name ha ) 0.0 0.0 2.7 assign(resid 34 and name hn )(resid 88 and name hn ) 0.0 0.0 3.5 assign(resid 34 and name hn )(resid 89 and name ha ) 0.0 0.0 4.0 assign(resid 34 and name hn )(resid 90 and name hd+ ) 0.0 0.0 4.8 assign(resid 35 and name ha )(resid 87 and name ha ) 0.0 0.0 2.7 assign(resid 35 and name hb )(resid 87 and name ha ) 0.0 0.0 4.0 assign(resid 35 and name hg1+ )(resid 29 and name hd1+ ) 0.0 0.0 4.3 assign(resid 35 and name hg1+ )(resid 87 and name ha ) 0.0 0.0 4.8 assign(resid 35 and name hg1+ )(resid 87 and name hb+ ) 0.0 0.0 4.3 assign(resid 35 and name hn )(resid 53 and name ha ) 0.0 0.0 5.0 assign(resid 35 and name hn )(resid 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