NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type | subtype | subsubtype |
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7074 |
1jyt   |
4735 | cing | recoord | 1-original | 8 | unknown | distance | NOE | ambi |
> !M1 > > !A2 > > !E3 > > !D4 > > !G5 > !long > ! 5.26 w 3 3D NOE > assign (resid 161 and name ha and segid="omp1") (resid 5 and name hn and segid="omp1") 1.8 0 3.2 > > !P6 > > !Q7 > > !K8 > > !Q9 > > !Q10 > > !L11 > !long > ! 8.92 mw 4 3D NOE 125.31 w 3 HNH > ! 9.08/122.9 for 160 plane and 9 m 3D NOE > assign (resid 160 and name hn and segid="omp1") (resid 11 and name hn and segid="omp1") 1.8 0 2.4 > ! 8.73 w 2 3D NOE > assign (resid 161 and name hn and segid="omp1") (resid 11 and name hn and segid="omp1") 1.8 0 3.2 > ! 1.92/38.4 w 3 4D CC > assign (resid 58 and name hb and segid="omp1") (resid 11 and name hd# and segid="omp1") 1.8 0 3.2 > ! 1.14/13.2 s 13 4D CC Med, 9 in 58hd plane. > assign (resid 58 and name hd# and segid="omp1") (resid 11 and name hd# and segid="omp1") 1.8 0 1.5 > ! 1.14/17.4 s 13 4D CC Strong, 10 in 58hg2 plane. > assign (resid 58 and name hg2# and segid="omp1") (resid 11 and name hd# and segid="omp1") 1.8 0 0.9 > > !D12 > !long > ! 5.23/52.7 mw 4 4D CN Make v-wk since not in 3D NOE. > assign (resid 161 and name ha and segid="omp1") (resid 12 and name hn and segid="omp1") 1.8 0 4.2 > ! 8.92 mw 4 3D NOE > assign (resid 160 and name hn and segid="omp1") (resid 12 and name hn and segid="omp1") 1.8 0 2.4 > > !M13 > !long > ! 3.95 mw 4 3D NOESY Make wk since not in 4D CN > assign (resid 158 and name ha and segid="omp1") (resid 13 and name hn and segid="omp1") 1.8 0 3.2 > ! 4.70/60.2 mw 5 4D CN > assign (resid 159 and name ha and segid="omp1") (resid 13 and name hn and segid="omp1") 1.8 0 2.4 > ! -0.08/22.3 w 2 4D CN > assign (resid 158 and name hg# and segid="omp1") (resid 13 and name hn and segid="omp1") 1.8 0 3.2 > ! 7.01 w 2 3D NOESY > assign (resid 160 and name hd# and segid="omp1") (resid 13 and name hn and segid="omp1") 1.8 0 3.2 > ! 7.28 w 2 3D NOESY > assign (resid 160 and name he# and segid="omp1") (resid 13 and name hn and segid="omp1") 1.8 0 3.2 > > !P14 > > !L15 > !long > ! 3.72/65.1 w 2 4D CC > assign (resid 157 and name hb# and segid="omp1") (resid 15 and name hd# and segid="omp1") 1.8 0 3.2 > ! 0.36/20.7 s 12 4D CC medium in 158 hg plane > assign (resid 158 and name hg# and segid="omp1") (resid 15 and name hd# and segid="omp1") 1.8 0 1.5 > ! 4.70/56.4 m 7 4D CN Make med-wk since only 1 157ha-15hd. > assign (resid 157 and name ha and segid="omp1") (resid 15 and name hn and segid="omp1") 1.8 0 2.4 > ! 3.63/65.4 w 3 4D CN > assign (resid 157 and name hb# and segid="omp1") (resid 15 and name hn and segid="omp1") 1.8 0 3.2 > ! 119.0 w 3 3D HNH > assign (resid 157 and name hn and segid="omp1") (resid 15 and name hn and segid="omp1") 1.8 0 3.2 > ! 1.45/46.8 mw 5 4D CC Make v-wk since only 1 55hb-15hd. > assign (resid 55 and name hb# and segid="omp1") (resid 15 and name hd# and segid="omp1") 1.8 0 4.2 > ! 1.14/21.6 s 10 4D CC > assign (resid 156 and name hb# and segid="omp1") (resid 15 and name hd# and segid="omp1") 1.8 0 0.9 > ! 1.30/29.1 mw 4 4D CC > assign (resid 156 and name hb# and segid="omp1") (resid 15 and name hg and segid="omp1") 1.8 0 2.4 > ! 1.06 wk 3 2D N NOE > assign (resid 156 and name hb# and segid="omp1") (resid 15 and name hn and segid="omp1") 1.8 0 3.2 > ! 4.81/56.7 m 8 4D CC > assign (resid 157 and name ha and segid="omp1") (resid 15 and name hd# and segid="omp1") 1.8 0 1.5 > ! 2.86/42.9 mw 4 4D CC Make v-wk for consistency with below. > assign (resid 141 and name hb# and segid="omp1") (resid 15 and name hd# and segid="omp1") 1.8 0 4.2 > ! 7.16/130.8 w 3 4D CC V-wk, 0 in 141hd plane. > assign (resid 141 and name hd# and segid="omp1") (resid 15 and name hd# and segid="omp1") 1.8 0 4.2 > ! 7.39/129.9 w 2 4D CC Absent in 141he/hz plane. > assign ((resid 141 and name he# and segid="omp1") or (resid 141 and name hz and segid="omp1")) (resid 15 and name hd# and segid="omp1") 1.8 0 5.2 > > !V16 > !long > ! 10.02 m 8 3D NOESY Not in 54 hn plane so make m-w > assign (resid 54 and name hn and segid="omp1") (resid 16 and name hn and segid="omp1") 1.8 0 2.4 > ! 5.37/55.3 w 3 4D CN > assign (resid 54 and name ha and segid="omp1") (resid 16 and name hn and segid="omp1") 1.8 0 3.2 > ! w 3 4D CN > assign (resid 53 and name ha and segid="omp1") (resid 16 and name hn and segid="omp1") 1.8 0 3.2 > > !L17 > !long > ! w 3 > assign (resid 54 and name hn and segid="omp1") (resid 17 and name hn and segid="omp1") 1.8 0 3.2 > ! 6.77/116.7 m 7 4D CC Make med-wk since only 1 53he-17hd. Strong, 12 in Y53he plane. > assign (resid 53 and name he# and segid="omp1") (resid 17 and name hd# and segid="omp1") 1.8 0 2.4 > > !D18 > !long > ! m 6 3D NOE Listed in R54 NOEs. Supported by 122.24 in 3D HNH. > !assign (resid 54 and name hn and segid="omp1") (resid 18 and name hn and segid="omp1") 1.8 0 1.7 > > !Q19 > > !D20 > > !L21 > !long > !assign (resid 43 and name hn and segid="omp1") (resid 21 and name hn and segid="omp1") 1.8 0 8.0 > > !T22 > > !K23 > > !Q24 > !long > ! 4.49 mw 5 3D NOE (4.50/56.8 w 2 4D CN) > assign (resid 43 and name ha and segid="omp1") (resid 24 and name hn and segid="omp1") 1.8 0 4.2 > ! w 2 3D NOE > assign (resid 16 and name hn and segid="omp1") (resid 24 and name hn and segid="omp1") 1.8 0 10.0 > ! w 2 3D NOE > assign (resid 47 and name hn and segid="omp1") (resid 24 and name hn and segid="omp1") 1.8 0 10.0 > > !M25 > > !R26 > !long > ! 114.8 w 2 3D HNH > ! 8.15 w 2 3D NOE 86hn? > !assign (resid 42 and name hn and segid="omp1") (resid 26 and name hn and segid="omp1") 1.8 0 3.2 > ! w 2 3D NOE > !assign (resid 18 and name hn and segid="omp1") (resid 26 and name hn and segid="omp1") 1.8 0 6.5 > > !L27 > !long > ! 9.42 w 2 3D NOE > ! 1 contour at 8.65 in D18 plane in 3D NOE > assign (resid 18 and name hn and segid="omp1") (resid 27 and name hn and segid="omp1") 1.8 0 8.5 > > !R28 > > !V29 > > !E30 > > !S31 > > !L32 > > !K33 > > !Q34 > > !R35 > > !G36 > > !E37 > > !K38 > > !K39 > > !Q40 > > !D41 > !long > ! mw 4 3D NOE > !assign ((resid 23 and name ha and segid="omp1") or (resid 24 and name ha and segid="omp1")) (resid 41 and name hn and segid="omp1") 1.8 0 12.0 > > !G42 > !long > ! 0.91/21.0 wk 3 4D CC > assign (resid 71 and name hg# and segid="omp1") (resid 42 and name ha# and segid="omp1") 1.8 0 4.2 > > !E43 > !long > ! 8.92 mw 5 3D NOE Wk, 2 in 38hn plane. > !assign (resid 38 and name hn and segid="omp1") (resid 43 and name hn and segid="omp1") 1.8 0 3.2 > > !K44 > > !L45 > > !L46 > > !R47 > !long > ! 8.21 w 2 3D NOESY Med-wk in 137hn plane. 50hn? 126hn? 117hn? > !assign (resid 137 and name hn and segid="omp1") (resid 47 and name hn and segid="omp1") 1.8 0 3.2 > > !P48 > > !A49 > > !E50 > !long > ! w 3 4D CC > assign (resid 144 and name ha and segid="omp1") (resid 50 and name ha and segid="omp1") 1.8 0 3.2 > ! mw 5 3D NOE > assign (resid 145 and name hn and segid="omp1") (resid 50 and name hn and segid="omp1") 1.8 0 3.2 > ! m 6 3D NOESY > assign (resid 143 and name hn and segid="omp1") (resid 50 and name hn and segid="omp1") 1.8 0 5.2 > > !S51 > !long > ! 9.58 m-w 5 > assign (resid 145 and name hn and segid="omp1") (resid 51 and name hn and segid="omp1") 1.8 0 2.4 > ! 9.31 m 9 > assign (resid 143 and name hn and segid="omp1") (resid 51 and name hn and segid="omp1") 1.8 0 2.1 > ! 4.70/60.9 m 8 4D CN -- Possibly V159 ha > assign (resid 144 and name ha and segid="omp1") (resid 51 and name hn and segid="omp1") 1.8 0 1.7 > ! mw 5 4D CN Make wk. > assign (resid 144 and name hb and segid="omp1") (resid 51 and name hn and segid="omp1") 1.8 0 3.2 > ! 5.21 mw 4 2D NOESY > assign (resid 143 and name ha and segid="omp1") (resid 51 and name ha and segid="omp1") 1.8 0 5.2 > ! 0.72 mw 4 3D NOE 2D N NOE Make wk. > assign (resid 17 and name hd# and segid="omp1") (resid 51 and name hn and segid="omp1") 1.8 0 3.2 > > !V52 > !long > ! w 3 4D CC, > assign (resid 142 and name ha and segid="omp1") (resid 52 and name ha and segid="omp1") 1.8 0 3.2 > ! 9.47 w 2 3D NOE Could be 18hn-113hn > assign (resid 18 and name hn and segid="omp1") (resid 52 and name hn and segid="omp1") 1.8 0 3.2 > ! 4.84 m 8 3D NOE Could be 18ha-113hn > assign (resid 18 and name ha and segid="omp1") (resid 52 and name hn and segid="omp1") 1.8 0 1.7 > ! 0.72 w 4 3D NOE 2D N NOE > assign (resid 17 and name ha and segid="omp1") (resid 52 and name hn and segid="omp1") 1.8 0 3.2 > > !Y53 > !long > ! m 6 3D NOE Make med-wk since wk in 4D CN > assign (resid 142 and name ha and segid="omp1") (resid 53 and name hn and segid="omp1") 1.8 0 2.4 > ! w 2 4D CN > assign (resid 141 and name ha and segid="omp1") (resid 53 and name hn and segid="omp1") 1.8 0 3.2 > ! -0.54 w 3 3D NOE > assign ((resid 143 and name hg2# and segid="omp1") or (resid 143 and name hd# and segid="omp1")) (resid 53 and name hn and segid="omp1") 1.8 0 3.2 > ! mw 4 3D NOE > assign (resid 140 and name ha and segid="omp1") (resid 53 and name hn and segid="omp1") 1.8 0 3.2 > > !R54 > !long > ! w 3 3D NOESY > assign (resid 140 and name ha and segid="omp1") (resid 54 and name hn and segid="omp1") 1.8 0 4.2 > ! 5.75/57.0 w 2 4D CC Looked v-wk. > assign (resid 140 and name ha and segid="omp1") (resid 54 and name ha and segid="omp1") 1.8 0 4.2 > ! mw 3 2D NOESY > ! 7.16/130.6 v-wk 1 4D CN > assign (resid 141 and name hd# and segid="omp1") (resid 54 and name hn and segid="omp1") 1.8 0 4.2 > ! m-w 4 3D NOESY 4 at 131.00 in 3D HNH > assign (resid 18 and name hn and segid="omp1") (resid 54 and name hn and segid="omp1") 1.8 0 4.2 > ! m-w 4 3D NOESY > ! v-w 3 2D N NOE > assign (resid 18 and name ha and segid="omp1") (resid 54 and name hn and segid="omp1") 1.8 0 5.2 > > !L55 > !long > ! 5.70 m 6 3D noesy Make mw since not in 4D CN > assign (resid 140 and name ha and segid="omp1") (resid 55 and name hn and segid="omp1") 1.8 0 2.4 > ! m 6 3D NOESY Make wk. > assign (resid 140 and name hn and segid="omp1") (resid 55 and name hn and segid="omp1") 1.8 0 3.2 > ! 8.38 m 7 3D NOESY > assign (resid 139 and name hn and segid="omp1") (resid 55 and name hn and segid="omp1") 1.8 0 1.7 > ! 9.85 w 3 3D NOESY > assign (resid 141 and name hn and segid="omp1") (resid 55 and name hn and segid="omp1") 1.8 0 4.2 > ! 5.37 mw 4 3D NOE Previously assigned at 5.31. Make wk since not in 4D CN > ! 5.31 mw 4 3D noesy > assign (resid 138 and name ha and segid="omp1") (resid 55 and name hn and segid="omp1") 1.8 0 3.2 > ! 0.52/20.4 mw 5 4D CN Make wk since only 1 138hg in 55hn plane. > assign (resid 138 and name hg# and segid="omp1") (resid 55 and name hn and segid="omp1") 1.8 0 3.2 > ! 0.67/19.8 m 8 4D CC Only 1 138hg in 55hd plane and no 55hd#-138hg#. > assign (resid 138 and name hg# and segid="omp1") (resid 55 and name hd# and segid="omp1") 1.8 0 4.2 > ! m 6 3D NOESY Could be sidechain -NH2 > !assign (resid 135 and name hn and segid="omp1") (resid 55 and name hn and segid="omp1") 1.8 0 1.7 > ! 7.00/131.1 mw 4 4D CC > !assign (resid 140 and name hd# and segid="omp1") (resid 55 and name hd# and segid="omp1") 1.8 0 2.4 > ! 0.67/24.9 s 16 4D CC > !assign (resid 142 and name hd# and segid="omp1") (resid 55 and name hd# and segid="omp1") 1.8 0 0.9 > ! 1.53/33.0 w 2 4D CC Also m,7. > assign (resid 158 and name hb and segid="omp1") (resid 55 and name hd# and segid="omp1") 1.8 0 4.2 > ! 0.05/21.9 m 9 4D CC > assign (resid 158 and name hg# and segid="omp1") (resid 55 and name hd# and segid="omp1") 1.8 0 5.2 > > !D56 > !long > ! 0.67/20.7 m 8 4D CC Wk,2 in 138hg plane. Only 1 138hg-56ha. > assign (resid 138 and name hg# and segid="omp1") (resid 56 and name ha and segid="omp1") 1.8 0 2.4 > > !F57 > !long > ! 5.30/57.9 m 6 4D CN, > assign (resid 138 and name ha and segid="omp1") (resid 57 and name hn and segid="omp1") 1.8 0 1.7 > ! 0.59/19.7 mw 4 4D CN, > assign (resid 138 and name hg# and segid="omp1") (resid 57 and name hn and segid="omp1") 1.8 0 2.4 > > !I58 > !long > ! 0.83/25.5 m 9 4D CC Listed under 11hd. > !assign (resid 11 and name hd# and segid="omp1") (resid 58 and name hd# and segid="omp1") 1.8 0 1.5 > ! 2.08/19.2 m 8 4D CC Listed under M139he. > !assign (resid 139 and name he# and segid="omp1") (resid 58 and name hd# and segid="omp1") 1.8 0 1.5 > ! 2.08/19.2 m 7 4D CC Listed under M139he. > !assign (resid 139 and name he# and segid="omp1") (resid 58 and name hg2# and segid="omp1") 1.8 0 1.5 > ! 0.83/25.8 s 10 4D CC Listed under 11hd. > !assign (resid 11 and name hd# and segid="omp1") (resid 58 and name hg2# and segid="omp1") 1.8 0 0.9 > > !Q59 > !long > ! -0.08 m-w 5 3D NOE > assign (resid 63 and name hd# and segid="omp1") (resid 59 and name hn and segid="omp1") 1.8 0 2.4 > > !Q60 > > !Q61 > > !K62 > > !L63 > !long > ! 7.00/131.1 w 3 4D CC Med, 9 in 57hd plane. > assign (resid 57 and name hd# and segid="omp1") (resid 63 and name hd# and segid="omp1") 1.8 0 3.2 > ! 0.44/17.7 m 6 4D CC Make v-wk since 1 63hd-133hb has 1 contour > assign (resid 133 and name hb# and segid="omp1") (resid 63 and name hd# and segid="omp1") 1.8 0 4.6 > ! 0.83/25.5 s 13 4D CC Make med since only in 1 hd plane. > assign (resid 11 and name hd# and segid="omp1") (resid 63 and name hd# and segid="omp1") 1.8 0 1.5 > ! 1.92/31.8 w 2 4D CC > assign (resid 59 and name hb# and segid="omp1") (resid 63 and name hd# and segid="omp1") 1.8 0 3.2 > > !Q64 > !long > ! m 7 3D NOE > assign (resid 161 and name hn and segid="omp1") (resid 64 and name hn and segid="omp1") 1.8 0 4.2 > > !F65 > !long > ! 3.89 mw 4 3D NOE Make wk since not in 4D CN. > !assign (resid 158 and name ha and segid="omp1") (resid 65 and name hn and segid="omp1") 1.8 0 4.2 > > !D66 > !long > ! 4.84/55.3 m 9 4D CN > assign (resid 160 and name ha and segid="omp1") (resid 66 and name hn and segid="omp1") 1.8 0 1.7 > ! 9.74 mw 5 3D NOE Could be 68he1 or L142hn > assign (resid 161 and name hn and segid="omp1") (resid 66 and name hn and segid="omp1") 1.8 0 2.4 > ! 3.02 m 6 3D NOE > assign (resid 160 and name hb# and segid="omp1") (resid 66 and name hn and segid="omp1") 1.8 0 1.7 > > !H67 > !long > ! 8.49 w 2 3D NOE > assign (resid 158 and name hn and segid="omp1") (resid 67 and name hn and segid="omp1") 1.8 0 5.2 > ! 3.84/60.6 w 2 4D CN > assign (resid 158 and name ha and segid="omp1") (resid 67 and name hn and segid="omp1") 1.8 0 3.2 > ! 0.45/31.3 mw 4 4D CN > assign (resid 159 and name hb and segid="omp1") (resid 67 and name hn and segid="omp1") 1.8 0 2.4 > ! 0.25/20.8 m 6 4D CN > assign ((resid 159 and name hg# and segid="omp1") or (resid 158 and name hg# and segid="omp1")) (resid 67 and name hn and segid="omp1") 1.8 0 1.7 > ! w 2 > assign ((resid 68 and name he1 and segid="omp1") or (resid 161 and name hn and segid="omp1")) (resid 67 and name hn and segid="omp1") 1.8 0 6.0 > > !W68 > > !N69 > !long > ! 3.89 m 7 3D NOE > ! 3.97,59.8 m 6 4D CN > assign (resid 158 and name ha and segid="omp1") (resid 69 and name hn and segid="omp1") 1.8 0 1.7 > ! mw 4 4D CN Other 158hg-69hn is med, 9 > assign (resid 158 and name hg# and segid="omp1") (resid 69 and name hn and segid="omp1") 1.8 0 2.4 > > !V70 > !long > ! 5.44/49.8 m 8 4D CC > assign (resid 156 and name ha and segid="omp1") (resid 70 and name hg# and segid="omp1") 1.8 0 1.5 > ! 1.14/21.6 s 15 4D CC > assign (resid 156 and name hb# and segid="omp1") (resid 70 and name hg# and segid="omp1") 1.8 0 0.9 > ! 0.75/24.3 s 15 4D CC > !assign (resid 154 and name hd# and segid="omp1") (resid 70 and name hg# and segid="omp1") 1.8 0 0.9 > ! 0.75/18.6 s 13 4D CC > assign (resid 78 and name hg# and segid="omp1") (resid 70 and name hg# and segid="omp1") 1.8 0 4.2 > ! 5.42 w 3 3D NOE Make v-v-wk since not in 4D CN. > assign (resid 77 and name ha and segid="omp1") (resid 70 and name hn and segid="omp1") 1.8 0 5.2 > ! 118.9 v-wk 1 3D NOE > assign (resid 157 and name hn and segid="omp1") (resid 70 and name hn and segid="omp1") 1.8 0 4.2 > > !V71 > !long > ! 5.37/50.1 m 7 4D CN > assign (resid 156 and name ha and segid="omp1") (resid 71 and name hn and segid="omp1") 1.8 0 1.7 > ! 1.06 wk 3 2D N NOE > assign (resid 156 and name hb# and segid="omp1") (resid 71 and name hn and segid="omp1") 1.8 0 3.2 > ! 9.09 mw 5 3D NOE > ! Make wk since not in A156 plane > assign (resid 156 and name hn and segid="omp1") (resid 71 and name hn and segid="omp1") 1.8 0 3.2 > ! 5.42 mw 4 2D NOESY Make wk. > assign (resid 77 and name ha and segid="omp1") (resid 71 and name ha and segid="omp1") 1.8 0 3.2 > > !L72 > !long > ! 5.67/56.1 m 6 4D CC Make m-w since only in 1 72hd plane. > assign (resid 107 and name ha and segid="omp1") (resid 72 and name hd# and segid="omp1") 1.8 0 3.2 > ! 0.75/18.6 s 12 4D CC medium in V78 plane. Make wk since 4 methyls. > assign (resid 78 and name hg# and segid="omp1") (resid 72 and name hd# and segid="omp1") 1.8 0 3.2 > > !D73 > !long > ! 4.90/54.6 m-w 4 4D CN > ! 4.99 m 7 3D NOE > assign (resid 153 and name ha and segid="omp1") (resid 73 and name hn and segid="omp1") 1.8 0 3.2 > ! 2.58/41.4 mw 5 4D CN > assign (resid 153 and name hb# and segid="omp1") (resid 73 and name hn and segid="omp1") 1.8 0 2.4 > ! 0.86/24.7 m 9 4D CN Make wk since only 1 154hd-73hn. > assign (resid 154 and name hd# and segid="omp1") (resid 73 and name hn and segid="omp1") 1.8 0 3.2 > > !K74 > > !P75 > > !G76 > !long > ! 8.98 m 9 3D NOESY Med, 8 in 108hn plane. > assign (resid 108 and name hn and segid="omp1") (resid 76 and name hn and segid="omp1") 1.8 0 1.7 > ! 5.10 w 3 3D NOESY > assign (resid 108 and name ha and segid="omp1") (resid 76 and name hn and segid="omp1") 1.8 0 3.2 > ! 9.42 w 3 3D NOESY Could be D18hn > assign (resid 109 and name hn and segid="omp1") (resid 76 and name hn and segid="omp1") 1.8 0 3.2 > ! 4.60 w 3 3D NOESY Could be K74ha > assign (resid 109 and name ha and segid="omp1") (resid 76 and name hn and segid="omp1") 1.8 0 3.2 > > !K77 > !long > ! 0.92/24.9 mw 5 4D CN > assign (resid 149 and name hg# and segid="omp1") (resid 77 and name hn and segid="omp1") 1.8 0 2.4 > ! 5.70 w 3 3D NOESY > assign (resid 107 and name ha and segid="omp1") (resid 77 and name hn and segid="omp1") 1.8 0 3.2 > ! 8.98 w 3 3D NOE > assign (resid 108 and name hn and segid="omp1") (resid 77 and name hn and segid="omp1") 1.8 0 4.2 > ! 8.70/112.4 m or w 7 or 2 3D NOE and 3D HNH Make med-wk. Listed in 146 plane. > !assign (resid 146 and name hn and segid="omp1") (resid 77 and name hn and segid="omp1") 1.8 0 2.4 > > !V78 > !long > ! m 7 3D NOE > assign (resid 106 and name hn and segid="omp1") (resid 78 and name hn and segid="omp1") 1.8 0 1.7 > ! 5.63/55.7 m-w 4 4D CN > assign (resid 107 and name ha and segid="omp1") (resid 78 and name hn and segid="omp1") 1.8 0 2.4 > ! 3.33,3.24 m-w 4 4D CN Wk, 2 in 4D CN. > assign (resid 107 and name hb# and segid="omp1") (resid 78 and name hn and segid="omp1") 1.8 0 3.2 > ! 1.14/20.1 mw 5 4D CC > assign (resid 149 and name hg# and segid="omp1") (resid 78 and name hg# and segid="omp1") 1.8 0 2.4 > ! 2.31/34.8 w 2 4D CC Looked v-wk. > assign (resid 149 and name hb and segid="omp1") (resid 78 and name hg# and segid="omp1") 1.8 0 4.2 > ! 4.42/58.2 m 8 4D CC Make med-wk since only 1 145ha-78hg. > assign (resid 145 and name ha and segid="omp1") (resid 78 and name hg# and segid="omp1") 1.8 0 2.4 > > !T79 > !long > ! s 10 4D CC > assign (resid 104 and name ha and segid="omp1") (resid 79 and name ha and segid="omp1") 1.8 0 4.2 > ! 8.70 mw 4 3D NOE Make v,v-wk > assign (resid 106 and name hn and segid="omp1") (resid 79 and name hn and segid="omp1") 1.8 0 5.2 > ! 9.53 w 3 3D NOE > assign (resid 145 and name hn and segid="omp1") (resid 79 and name hn and segid="omp1") 1.8 0 4.2 > ! 0.91/13.2 s 12 4D CC > assign (resid 105 and name hd# and segid="omp1") (resid 79 and name hg2# and segid="omp1") 1.8 0 0.9 > ! 1.53/27.6 m 6 4D CC > assign (resid 105 and name hg1# and segid="omp1") (resid 79 and name hg2# and segid="omp1") 1.8 0 1.5 > ! -0.28/16.3 m 8 4D CN, > assign ((resid 143 and name hg2# and segid="omp1") or (resid 143 and name hd# and segid="omp1")) (resid 79 and name hn and segid="omp1") 1.8 0 1.7 > ! 5.20 w 3 3D CN > assign (resid 143 and name ha and segid="omp1") (resid 79 and name hn and segid="omp1") 1.8 0 3.2 > ! m 6 4D CC > assign (resid 144 and name hb and segid="omp1") (resid 79 and name hb and segid="omp1") 1.8 0 1.5 > ! m 8 4D CC > assign (resid 144 and name hg2# and segid="omp1") (resid 79 and name hb and segid="omp1") 1.8 0 1.5 > > !I80 > !long > ! 8.54 w 3 3D NOE (122.9 w 2 3D HNH) > assign (resid 104 and name hn and segid="omp1") (resid 80 and name hn and segid="omp1") 1.8 0 3.2 > ! Make following two med-wk since 2 methyls. > ! 1.06/20.1 m 7 4D CC Med, 6 in I80hg2 plane. > assign (resid 104 and name hb# and segid="omp1") (resid 80 and name hg2# and segid="omp1") 1.8 0 2.4 > ! 1.06/20.1 m 7 4D CC Med, 8 in I80hd plane. > assign (resid 104 and name hb# and segid="omp1") (resid 80 and name hd# and segid="omp1") 1.8 0 2.4 > ! w 2 4D CC > assign (resid 105 and name hg2# and segid="omp1") (resid 80 and name hd# and segid="omp1") 1.8 0 3.2 > ! 8.70 w 3 3D NOE Wk 2 in 106hn plane. > assign (resid 106 and name hn and segid="omp1") (resid 80 and name hn and segid="omp1") 1.8 0 3.2 > ! 7.16/130.8 m 8 4D CC Make wk since some ambiguity anda methyl. Strong, 10 in 145hd plane. > assign (resid 141 and name hd# and segid="omp1") (resid 80 and name hg2# and segid="omp1") 1.8 0 3.6 > ! 7.39/129.0 m 6 4D CC Med, 7 in 145he/hz plane. > assign ((resid 141 and name he# and segid="omp1") or (resid 141 and name hz and segid="omp1")) (resid 80 and name hg2# and segid="omp1") 1.8 0 1.5 > > !T81 > !long > ! 5.17/60.2 m-w 4 4D CN > assign (resid 143 and name ha and segid="omp1") (resid 81 and name hn and segid="omp1") 1.8 0 2.4 > ! w 3 3D NOESY > assign (resid 143 and name hn and segid="omp1") (resid 81 and name hn and segid="omp1") 1.8 0 3.2 > ! -0.22 v-wk 2 2D N NOE > assign (resid 143 and name hd# and segid="omp1") (resid 81 and name hn and segid="omp1") 1.8 0 4.2 > ! -0.47 v-wk 2 2D N NOE > assign (resid 143 and name hg2# and segid="omp1") (resid 81 and name hn and segid="omp1") 1.8 0 4.2 > ! 9.69 mw 5 3D NOESY > assign (resid 142 and name hn and segid="omp1") (resid 81 and name hn and segid="omp1") 1.8 0 2.4 > ! 4.58/50.4 w 2 4D CC > assign (resid 103 and name ha and segid="omp1") (resid 81 and name hg2# and segid="omp1") 1.8 0 3.2 > ! 0.91/24.9 s 13 4D CC Make med since 2 methyls > assign (resid 99 and name hd# and segid="omp1") (resid 81 and name hg2# and segid="omp1") 1.8 0 1.9 > ! 1.30/39.9 mw 4 4D CC > assign (resid 99 and name hb# and segid="omp1") (resid 81 and name hg2# and segid="omp1") 1.8 0 2.4 > > !G82 > > !T83 > !long > ! 0.92/21.9 s 15 4D CN Make m-wk since only 1 142hd-83hn. > assign (resid 142 and name hd# and segid="omp1") (resid 83 and name hn and segid="omp1") 1.8 0 2.4 > ! w 2 4D CN No 142hd-83hg2. > assign (resid 142 and name hd# and segid="omp1") (resid 83 and name hg2# and segid="omp1") 1.8 0 4.2 > ! 1.06/21.3 m 8 4D CC Other 142hd-83ha is v-wk. > assign (resid 142 and name hd# and segid="omp1") (resid 83 and name ha and segid="omp1") 1.8 0 4.2 > ! 0.72/26.4 m 6 4D CN > assign (resid 100 and name hd# and segid="omp1") (resid 83 and name hn and segid="omp1") 1.8 0 1.7 > ! 1.14/22.2 m 6 4D CC Med-wk, 4 in 132hd plane. > !assign (resid 132 and name hd# and segid="omp1") (resid 83 and name hg2# and segid="omp1") 1.8 0 2.4 > ! 7.39/129.6 m 9 4D CC Med, 6 in 141he/hz plane. > assign ((resid 141 and name he# and segid="omp1") or (resid 141 and name hz and segid="omp1")) (resid 83 and name hg2# and segid="omp1") 1.8 0 1.5 > ! 7.16/130.5 v-wk 1 4D CC V-wk, 0 in 141hd plane. > assign (resid 141 and name hd# and segid="omp1") (resid 83 and name hg2# and segid="omp1") 1.8 0 4.2 > > !S84 > !long > ! 123.6 mw 5 3D HNH Med-wk in 100hn plane. > assign (resid 100 and name hn and segid="omp1") (resid 84 and name hn and segid="omp1") 1.8 0 3.2 > ! 0.72/21.9 mw 5 4D CN Make wk since only 1 100hd in 84hn plane. > assign (resid 100 and name hd# and segid="omp1") (resid 84 and name hn and segid="omp1") 1.8 0 3.2 > ! 0.92/21.9 m 7 4D CN Make med-wk since only 1 142hd in 84hn plane. > assign (resid 142 and name hd# and segid="omp1") (resid 84 and name hn and segid="omp1") 1.8 0 2.4 > > !Q85 > > !N86 > !long > ! wk 2 3D NOE > !assign ((resid 94 and name hn and segid="omp1") or (resid 81 and name hn and segid="omp1")) (resid 86 and name hn and segid="omp1") 1.8 0 12.0 > > !W87 > !long > ! wk 3 3D NOE > assign (resid 141 and name hn and segid="omp1") (resid 87 and name hn and segid="omp1") 1.8 0 10.0 > > !T88 > > !P89 > > !D90 > !long > ! 9.25 w 3 3D NOE > assign (resid 143 and name hn and segid="omp1") (resid 90 and name hn and segid="omp1") 1.8 0 6.2 > ! w 1 3D NOE > assign (resid 141 and name hn and segid="omp1") (resid 90 and name hn and segid="omp1") 1.8 0 6.2 > > !L91 > !long > ! w 2 3D NOE > assign (resid 53 and name hn and segid="omp1") (resid 91 and name hn and segid="omp1") 1.8 0 10.0 > ! mw 5 3D NOE > assign (resid 51 and name hn and segid="omp1") (resid 91 and name hn and segid="omp1") 1.8 0 8.0 > ! w 2 3D NOE > assign (resid 142 and name hn and segid="omp1") (resid 91 and name hn and segid="omp1") 1.8 0 10.0 > ! mw 5 3D NOE > assign (resid 143 and name hn and segid="omp1") (resid 91 and name hn and segid="omp1") 1.8 0 8.0 > ! mw 4 3D NOE > assign (resid 144 and name hn and segid="omp1") (resid 91 and name hn and segid="omp1") 1.8 0 12.0 > ! mw 4 3D NOE > assign (resid 145 and name hn and segid="omp1") (resid 91 and name hn and segid="omp1") 1.8 0 12.0 > > !T92 > > !N93 > > !L94 > !long > ! 9.26 m 6 3D NOE > assign (resid 143 and name hn and segid="omp1") (resid 94 and name hn and segid="omp1") 1.8 0 4.2 > > !M95 > !long > ! wk 1 3D NOE > assign (resid 143 and name hn and segid="omp1") (resid 95 and name hn and segid="omp1") 1.8 0 6.2 > > !T96 > > !R97 > > !Q98 > !long > ! 4.11 mw 5 3D HNH A guess. Also possible: 33,34,75,121,124 > !assign (resid 122 and name ha and segid="omp1") (resid 98 and name hn and segid="omp1") 1.8 0 2.4 > > !L99 > !long > ! 5.05/58.2 m 9 4D CC V78 hg plane next to L99 hd plane > !assign (resid 78 and name ha and segid="omp1") (resid 99 and name hd# and segid="omp1") 1.8 0 1.5 > ! 1.61/35.1 s 12 4D CC V78 hg plane next to L99 hd plane > !assign (resid 78 and name hb and segid="omp1") (resid 99 and name hd# and segid="omp1") 1.8 0 0.9 > > !L100 > !long > ! 5.30/58.7 m-w 4 4D CN > ! m 7 3D NOESY > assign (resid 83 and name ha and segid="omp1") (resid 100 and name hn and segid="omp1") 1.8 0 2.4 > ! 4.27/57.9 m 8 4D CC Make m-wk. > assign (resid 84 and name ha and segid="omp1") (resid 100 and name hd# and segid="omp1") 1.8 0 2.4 > ! 4.19/63.6 w 3 4D CC > assign (resid 84 and name hb# and segid="omp1") (resid 100 and name hd# and segid="omp1") 1.8 0 3.2 > ! 7.46/130.5 v-wk 0 4D CC V-wk, 1 in 125hd plane > assign (resid 125 and name hd# and segid="omp1") (resid 100 and name hd# and segid="omp1") 1.8 0 5.2 > > !D101 > > !P102 > !long > ! 4.81/50.7 s 10 4D CC Strong, 10 in 118ha plane (178/27) > !assign (resid 118 and name ha and segid="omp1") (resid 102 and name ha and segid="omp1") 1.8 0 0.9 > > !A103 > !long > ! 5.05/60.0 m-w 4 4D CC > assign (resid 81 and name ha and segid="omp1") (resid 103 and name hb# and segid="omp1") 1.8 0 2.4 > > !A104 > !long > ! 2.00/38.1 m 7 4D CC Med, 8 in I80hb plane > assign (resid 80 and name hb and segid="omp1") (resid 104 and name hb# and segid="omp1") 1.8 0 1.5 > ! m 7 3D NOESY Make w since wk in I80 plane > assign (resid 80 and name hn and segid="omp1") (resid 104 and name hn and segid="omp1") 1.8 0 3.2 > ! w 3 3D NOESY > !assign (resid 145 and name hn and segid="omp1") (resid 104 and name hn and segid="omp1") 1.8 0 3.2 > ! 1.69/17.4 s 12 4D CC > assign (resid 122 and name hb# and segid="omp1") (resid 104 and name hb# and segid="omp1") 1.8 0 0.9 > ! 4.19/55.2 m 7 4D CC Make med-wk since 5 contours in A122ha plane. > assign (resid 122 and name ha and segid="omp1") (resid 104 and name hb# and segid="omp1") 1.8 0 2.4 > ! 7.47/130.5 m 8 4D CC > assign (resid 125 and name hd# and segid="omp1") (resid 104 and name hb# and segid="omp1") 1.8 0 2.4 > > !I105 > !long > ! 9.91 w 3 3D NOESY > assign (resid 80 and name hn and segid="omp1") (resid 105 and name hn and segid="omp1") 1.8 0 4.2 > ! 2.00/38.1 m 7 4D CC Strong 10 in 80hb plane. > ! Make wk since 105hg2-80hd is wk. > assign (resid 80 and name hb and segid="omp1") (resid 105 and name hg2# and segid="omp1") 1.8 0 3.2 > ! 7.88/7.12 m-w 5 3D NOESY Sidechain -NH2, N118NH2? > assign (resid 118 and name hd2# and segid="omp1") (resid 105 and name hn and segid="omp1") 1.8 0 2.4 > ! 8.43 wk 2 3D NOESY > assign (resid 118 and name hn and segid="omp1") (resid 105 and name hn and segid="omp1") 1.8 0 3.2 > > !F106 > !long > ! 5.00 m 5 2D NOE (4.97/55.5 m 8 4D CC) > assign (resid 117 and name ha and segid="omp1") (resid 106 and name ha and segid="omp1") 1.8 0 1.5 > ! Possibly Y53hd# > ! w 3 4D CC 106hd-78hg is med-wk, 4. Other 78hg-106hd is v-wk, 0. > assign (resid 78 and name hg# and segid="omp1") (resid 106 and name hd# and segid="omp1") 1.8 0 3.2 > ! w 0 4D CC No 106hd-78hb. > assign (resid 78 and name hb and segid="omp1") (resid 106 and name hd# and segid="omp1") 1.8 0 4.2 > ! mw 4 4D CC 106hd-78hg is wk, 3. > assign (resid 70 and name hg# and segid="omp1") (resid 106 and name hd# and segid="omp1") 1.8 0 5.2 > ! w 2 4D CC 106hd-80hg2 is v-wk, 1. > assign (resid 80 and name hd# and segid="omp1") (resid 106 and name hd# and segid="omp1") 1.8 0 4.2 > ! 9.91 w 3 3D NOE Wk, 2 in 106hn plane. > assign (resid 80 and name hn and segid="omp1") (resid 106 and name hn and segid="omp1") 1.8 0 3.2 > > !W107 > !long > ! mw 4 4D CC Wk, 3 in 77ha plane. > assign (resid 77 and name ha and segid="omp1") (resid 107 and name ha and segid="omp1") 1.8 0 2.4 > ! 5.15 m 7 3D NOE > assign (resid 115 and name ha and segid="omp1") (resid 107 and name hn and segid="omp1") 1.8 0 1.7 > ! 1.91/14.1 s 12 4D CN > assign (resid 115 and name he# and segid="omp1") (resid 107 and name hn and segid="omp1") 1.8 0 1.1 > ! m-w 5 4D CN > assign (resid 117 and name ha and segid="omp1") (resid 107 and name hn and segid="omp1") 1.8 0 2.4 > ! m-w 5 3D HNH 116hn overlaps with 107hn in 3D NOE so can't tell. > assign (resid 116 and name hn and segid="omp1") (resid 107 and name hn and segid="omp1") 1.8 0 2.4 > > !R108 > !long > ! 5.37/54.6 w 3 4D CN > assign (resid 77 and name ha and segid="omp1") (resid 108 and name hn and segid="omp1") 1.8 0 3.2 > ! 4.11/62.8 w 3 4D CN > assign (resid 75 and name ha and segid="omp1") (resid 108 and name hn and segid="omp1") 1.8 0 4.2 > ! v-wk 1 4D CC > assign (resid 115 and name ha and segid="omp1") (resid 108 and name ha and segid="omp1") 1.8 0 4.2 > > !K109 > > !E110 > > !D111 > > !S112 > > !D113 > > !A114 > !long > ! 5.15 w 2 3D NOESY Not in 4D CN > assign (resid 108 and name ha and segid="omp1") (resid 114 and name hn and segid="omp1") 1.8 0 3.2 > ! mw 4 3D NOESY > assign (resid 109 and name hn and segid="omp1") (resid 114 and name hn and segid="omp1") 1.8 0 3.2 > > !M115 > !long > ! 0.12/20.4 s 11 4D CC Strong, 11 in 70hg plane. Make med since no info on the other 70hg > ! Make v-wk like other methyls of 71 and 72. > assign (resid 70 and name hg# and segid="omp1") (resid 115 and name he# and segid="omp1") 1.8 0 4.2 > ! 0.75/23.1 w 2 4D CC Absent in 78hg planes. > assign (resid 78 and name hg# and segid="omp1") (resid 115 and name he# and segid="omp1") 1.8 0 4.2 > ! 0.91/20.7 s 11 4D CC Med, 8 in 71hg plane. > ! Make mw since no info on other 71hg. > assign (resid 71 and name hg# and segid="omp1") (resid 115 and name he# and segid="omp1") 1.8 0 3.2 > ! 0.98,24.0 mw 4 4D CC Absent in that 72hd plane. Other 72hd-115he - strong! > assign (resid 72 and name hd# and segid="omp1") (resid 115 and name he# and segid="omp1") 1.8 0 3.2 > ! 5.68/56.1 w 2 4D CC Looked v-wk. > assign (resid 107 and name ha and segid="omp1") (resid 115 and name he# and segid="omp1") 1.8 0 4.2 > ! 5.35/55.5 w 2 4D CC Looked v-wk. > assign (resid 106 and name ha and segid="omp1") (resid 115 and name he# and segid="omp1") 1.8 0 4.2 > > !D116 > !long > ! m 6 3D HNH > assign (resid 107 and name hn and segid="omp1") (resid 116 and name hn and segid="omp1") 1.8 0 1.7 > > !W117 > !long > ! 5.30/55.5 w 2 4D CN Looked v-wk > assign (resid 106 and name ha and segid="omp1") (resid 117 and name hn and segid="omp1") 1.8 0 4.2 > > !N118 > !long > ! 5.30/55.3 w 3 4D CN > assign (resid 106 and name ha and segid="omp1") (resid 118 and name hn and segid="omp1") 1.8 0 3.2 > ! 6.74 m 7 3D NOE Make mw. > assign (resid 106 and name hd# and segid="omp1") (resid 118 and name hn and segid="omp1") 1.8 0 2.4 > > !E119 > > !A120 > !long > ! 9.42 w 2 3D NOE Make v-wk since not in D18 plane. > !assign (resid 18 and name hn and segid="omp1") (resid 120 and name hn and segid="omp1") 1.8 0 4.2 > ! 8.76 m 7 3D NOE Med, 6 in N69 plane. > !assign (resid 69 and name hn and segid="omp1") (resid 120 and name hn and segid="omp1") 1.8 0 1.7 > > !D121 > > !A122 > !long > ! 4.75/50.1 mw 4 4D CC > assign (resid 104 and name ha and segid="omp1") (resid 122 and name hb# and segid="omp1") 1.8 0 2.4 > ! 7.00/125.00 m 7 4D CC Med, 7 in 117hd1 plane. > assign (resid 117 and name hd1 and segid="omp1") (resid 122 and name hb# and segid="omp1") 1.8 0 1.5 > ! 7.13/119.4 m 7 4D CC Med, 6 in 117he3/hz1 plane. > assign ((resid 117 and name he3 and segid="omp1") or (resid 117 and name hz1 and segid="omp1")) (resid 122 and name hb# and segid="omp1") 1.8 0 1.5 > ! 7.69/126.00 mw 5 4D CC Med-wk, 5 in 117hz2/hz3 plane. > assign ((resid 117 and name hz2 and segid="omp1") or (resid 117 and name hz3 and segid="omp1")) (resid 122 and name hb# and segid="omp1") 1.8 0 2.4 > > !L123 > > !E124 > > !F125 > > !G126 > > !E127 > > !R128 > > !L129 > !long > ! 7.39/129.0 m 8 4D CC Med-wk, 5 in 141he/hz plane. Only 1 141he/hz-129hd. > assign ((resid 141 and name he# and segid="omp1") or (resid 141 and name hz and segid="omp1")) (resid 129 and name hd# and segid="omp1") 1.8 0 2.4 > > !S130 > !long > ! Correlations at 118.52 (8,L129), 121.15 (8,D131), 122.68 (4) & 123.56 (5, L100) > > !D131 > > !L132 > !long > ! 1.14/13.2 m 6 4D CC Make m-w, not in 58hd plane > assign (resid 58 and name hd# and segid="omp1") (resid 132 and name hd# and segid="omp1") 1.8 0 2.4 > ! 1.14/17.4 m 7 4D CC Make it weak since wk in the other L132hd# plane > assign (resid 58 and name hg2# and segid="omp1") (resid 132 and name hd# and segid="omp1") 1.8 0 3.2 > ! 4.19/58.2 m 7 4D CC Make wk since only 1 137ha-132hd. > assign (resid 137 and name ha and segid="omp1") (resid 132 and name hd# and segid="omp1") 1.8 0 3.2 > > !A133 > > !K134 > > !I135 > > !R136 > > !K137 > !long > ! 8.98 m 6 3D NOE T96hn? S51hn? > ! Not in 160 or 96 planes. > !assign (resid 160 and name hn and segid="omp1") (resid 137 and name hn and segid="omp1") 1.8 0 1.7 > > !V138 > !long > ! m 7 4D CC Med, 6 in 56ha plane. > assign (resid 56 and name ha and segid="omp1") (resid 138 and name ha and segid="omp1") 1.8 0 1.5 > > !M139 > !long > ! 4.77/54.2 m 6 4D CN > ! 4.77 m 9 3D NOESY > assign (resid 55 and name ha and segid="omp1") (resid 139 and name hn and segid="omp1") 1.8 0 3.2 > ! 4.99 m 8 3D NOESY Med-wk in 4D CN > assign (resid 56 and name ha and segid="omp1") (resid 139 and name hn and segid="omp1") 1.8 0 2.4 > ! m-w 5 3D NOESY > assign (resid 54 and name ha and segid="omp1") (resid 139 and name hn and segid="omp1") 1.8 0 2.8 > ! 7.01 m 7 3D NOESY Make med-wk since not in 4D CN > assign (resid 57 and name hd# and segid="omp1") (resid 139 and name hn and segid="omp1") 1.8 0 3.2 > ! 7.01/131.4 s 11 4D CC Strong, 10 in F57hd plane. Make med since a methyl. > assign (resid 57 and name hd# and segid="omp1") (resid 139 and name he# and segid="omp1") 1.8 0 1.5 > ! 7.31/129.9 w 2 4D CC > assign (resid 57 and name he# and segid="omp1") (resid 139 and name he# and segid="omp1") 1.8 0 3.2 > ! w 2 3D NOESY > assign ((resid 161 and name hn and segid="omp1") or (resid 157 and name hn and segid="omp1")) (resid 139 and name hn and segid="omp1") 1.8 0 3.2 > ! 3.95/62.4 mw 4 4D CC > assign (resid 58 and name ha and segid="omp1") (resid 139 and name he# and segid="omp1") 1.8 0 2.4 > ! 1.92/38.4 s 10 4D CC Make med since a methyl. > assign (resid 58 and name hb and segid="omp1") (resid 139 and name he# and segid="omp1") 1.8 0 1.5 > ! m 7 4D CC > assign (resid 58 and name hg1# and segid="omp1") (resid 139 and name he# and segid="omp1") 1.8 0 1.5 > ! 1.14/13.2 s 11 4D CC Med, 8 in 58hd plane. > assign (resid 58 and name hd# and segid="omp1") (resid 139 and name he# and segid="omp1") 1.8 0 1.5 > ! 1.14/17.4 s 11 4D CC Med, 7 in 58hg2 plane. > assign (resid 58 and name hg2# and segid="omp1") (resid 139 and name he# and segid="omp1") 1.8 0 1.5 > ! 0.05/24.0 s 13 4D CC Make med since 3 methyls. Strong, 10 in 63hd plane. > assign (resid 63 and name hd# and segid="omp1") (resid 139 and name he# and segid="omp1") 1.8 0 1.5 > ! s 11 4D CC Med-wk, 4 in 11hg plane. Make wk since a methyl > assign (resid 11 and name hg and segid="omp1") (resid 139 and name he# and segid="omp1") 1.8 0 3.2 > ! m 6 4D CC Make v-wk. > assign (resid 11 and name hb# and segid="omp1") (resid 139 and name he# and segid="omp1") 1.8 0 5.2 > ! s 14 4D CC Strong, 10 in 11hd plane. > assign (resid 11 and name hd# and segid="omp1") (resid 139 and name he# and segid="omp1") 1.8 0 3.2 > > !Y140 > !long > ! 5.44/55.2 v-wk 0 4D CC > ! 5.41 m-w 4 2D NOESY > assign (resid 53 and name ha and segid="omp1") (resid 140 and name ha and segid="omp1") 1.8 0 4.2 > ! 5.52/53.7 mw 4 4D CC Make wk since wk,2 in 54ha plane. > assign (resid 54 and name ha and segid="omp1") (resid 140 and name ha and segid="omp1") 1.8 0 3.2 > ! m-w 5 2D NOESY > assign (resid 54 and name ha and segid="omp1") (resid 140 and name hd# and segid="omp1") 1.8 0 2.4 > ! w 3 3D NOESY Make v-wk since no 140hn-53hn. > assign (resid 53 and name hn and segid="omp1") (resid 140 and name hn and segid="omp1") 1.8 0 4.2 > > !F141 > !long > ! 129.0 v-wk 1 3D HNH > assign (resid 53 and name hn and segid="omp1") (resid 141 and name hn and segid="omp1") 1.8 0 4.2 > ! 5.55 v,v-wk 2 2D N NOE > assign (resid 54 and name ha and segid="omp1") (resid 141 and name hn and segid="omp1") 1.8 0 5.2 > > !L142 > !long > ! w 3 3D NOESY Make v-v-wk. > assign (resid 53 and name ha and segid="omp1") (resid 142 and name hn and segid="omp1") 1.8 0 5.2 > ! 5.12/61.8 mw 5 4D CC > assign (resid 52 and name ha and segid="omp1") (resid 142 and name hd# and segid="omp1") 1.8 0 2.4 > ! 1.37/21.9 s 10 4D CC Make med/mw since 4 methyls > assign (resid 52 and name hg# and segid="omp1") (resid 142 and name hd# and segid="omp1") 1.8 0 1.9 > ! 0.28/26.1 s 14 4D CC > !assign (resid 55 and name hd# and segid="omp1") (resid 142 and name hd# and segid="omp1") 1.8 0 0.9 > ! 5.36/58.5 m 6 4D CC Make m-w since L142hd weak in T83hg2 plane. > assign (resid 83 and name ha and segid="omp1") (resid 142 and name hd# and segid="omp1") 1.8 0 2.4 > ! 4.11/71.7 s 10 4D CC Make med-wk to be consistent with above entry. > assign (resid 83 and name hb and segid="omp1") (resid 142 and name hd# and segid="omp1") 1.8 0 2.4 > ! 8.81 m-w 5 3D NOESY Supported by pk at 124.87 (81hn) in HNH > assign (resid 81 and name hn and segid="omp1") (resid 142 and name hn and segid="omp1") 1.8 0 2.4 > > !I143 > !long > ! 3.77/63.6 s 12 4D CN Make med-wk since not in 3D NOE. > assign (resid 89 and name ha and segid="omp1") (resid 143 and name hn and segid="omp1") 1.8 0 2.4 > ! m-w 4 3D NOESY Possibly v-wk in Y53hn plane. > assign (resid 53 and name hn and segid="omp1") (resid 143 and name hn and segid="omp1") 1.8 0 5.2 > ! 3.18/54.9 m-w 4 4D CN > assign (resid 94 and name ha and segid="omp1") (resid 143 and name hn and segid="omp1") 1.8 0 5.2 > ! 4.97/52.7 m 6 4D CN > assign (resid 93 and name ha and segid="omp1") (resid 143 and name hn and segid="omp1") 1.8 0 2.4 > ! w 3 2D N-NOESY > assign (resid 52 and name ha and segid="omp1") (resid 143 and name hn and segid="omp1") 1.8 0 3.2 > > !T144 > !long > ! m 6 3D NOESY > assign (resid 79 and name hn and segid="omp1") (resid 144 and name hn and segid="omp1") 1.8 0 1.7 > ! 3.89 s 10 3D NOE Not in 4D CN. > assign (resid 79 and name hb and segid="omp1") (resid 144 and name hn and segid="omp1") 1.8 0 1.7 > ! w 3 3D NOESY > assign (resid 80 and name hn and segid="omp1") (resid 144 and name hn and segid="omp1") 1.8 0 3.2 > ! 4.33 m 6 3D NOESY Not in 4D CN. > assign (resid 80 and name ha and segid="omp1") (resid 144 and name hn and segid="omp1") 1.8 0 3.2 > ! mw 4 4D CN Make wk since methyl. > assign (resid 51 and name hb# and segid="omp1") (resid 144 and name hn and segid="omp1") 1.8 0 3.2 > > !F145 > !long > ! 1.65/19.3 s 10 4D CN, Make med. > assign (resid 49 and name hb# and segid="omp1") (resid 145 and name hn and segid="omp1") 1.8 0 1.7 > ! 5.88 m 7 3D NOE Make mw. > assign (resid 50 and name ha and segid="omp1") (resid 145 and name hn and segid="omp1") 1.8 0 2.4 > ! mw 5 4D CC > assign (resid 149 and name hg# and segid="omp1") (resid 145 and name hd# and segid="omp1") 1.8 0 2.4 > ! w 3 4D CC > assign (resid 149 and name hb and segid="omp1") (resid 145 and name hd# and segid="omp1") 1.8 0 3.2 > ! m 6 4D CC Make med-wk since only 1 78hg-145hd > assign (resid 78 and name hg# and segid="omp1") (resid 145 and name hd# and segid="omp1") 1.8 0 2.4 > ! w 1 4D CC > assign (resid 78 and name hg# and segid="omp1") ((resid 145 and name he# and segid="omp1") or (resid 145 and name he# and segid="omp1")) 1.8 0 4.2 > > !G146 > !long > ! 5.04 m 7 3D NOE > ! 4.97/58.7 mw 5 4D CN > assign (resid 78 and name ha and segid="omp1") (resid 146 and name hn and segid="omp1") 1.8 0 2.4 > ! 5.05/58.5 mw 4 4D CC Make wk since no 78ha-146ha. > assign (resid 78 and name ha and segid="omp1") (resid 146 and name ha# and segid="omp1") 1.8 0 3.2 > ! 0.65/23.8 m 8 4D CN Make med-wk since only 1 78hg in 146 plane. > ! 0.68 m 9 3D NOE > assign (resid 78 and name hg# and segid="omp1") (resid 146 and name hn and segid="omp1") 1.8 0 2.4 > > !E147 > > !G148 > !long > ! 9.31 w 2 3D NOE Make v-v-wk since either absent or v-wk in 47hn plane. > assign (resid 47 and name hn and segid="omp1") (resid 148 and name hn and segid="omp1") 1.8 0 5.2 > > !V149 > !long > ! 4.11/44.7 mw 5 4D CC > assign (resid 76 and name ha# and segid="omp1") (resid 149 and name hg# and segid="omp1") 1.8 0 2.4 > > !E150 > > !P151 > > !A152 > !long > ! 9.57 mw 4 3D NOE Make wk since 152hn-145hn? > assign (resid 145 and name hn and segid="omp1") (resid 152 and name hn and segid="omp1") 1.8 0 3.2 > ! 0.83/26.1 w 2 4D CC Other 100hd-152ha is strong, 14. > !assign (resid 100 and name hd# and segid="omp1") (resid 152 and name ha and segid="omp1") 1.8 0 3.2 > > !N153 > !long > ! m 6 Make v-wk since 153hn-145hn? > assign (resid 145 and name hn and segid="omp1") (resid 153 and name hn and segid="omp1") 1.8 0 4.2 > > !L154 > !long > ! 9.58 m-w 5 Make v-wk since no 154hn-145hn. > assign (resid 145 and name hn and segid="omp1") (resid 154 and name hn and segid="omp1") 1.8 0 4.2 > ! 7.06 m-w 5 83hn? No 154hn-83hn. > assign ((resid 145 and name he# and segid="omp1") or (resid 145 and name hz and segid="omp1")) (resid 154 and name hn and segid="omp1") 1.8 0 2.4 > > !K155 > !long > ! 5.50/51.9 w 3 4D CN > assign (resid 72 and name ha and segid="omp1") (resid 155 and name hn and segid="omp1") 1.8 0 3.2 > ! 4.39 mw 5 3D NOE Make wk since not in 4D CN > assign (resid 71 and name ha and segid="omp1") (resid 155 and name hn and segid="omp1") 1.8 0 3.2 > ! 1.85/35.8 mw 5 4D CN > assign (resid 71 and name hb and segid="omp1") (resid 155 and name hn and segid="omp1") 1.8 0 2.4 > ! 0.0/20.9 w 2 4D CN Make v-wk since other 70hg? > assign (resid 70 and name hg# and segid="omp1") (resid 155 and name hn and segid="omp1") 1.8 0 4.2 > > !A156 > !long > ! 4.42/60.6 w 3 4D CC > assign (resid 70 and name ha and segid="omp1") (resid 156 and name hb# and segid="omp1") 1.8 0 3.2 > ! m 7 4D CC > assign (resid 70 and name hg# and segid="omp1") (resid 156 and name ha and segid="omp1") 1.8 0 1.5 > ! 4.42/60.6 m 6 4D CC Make wk since 156ha-71ha? > assign (resid 71 and name ha and segid="omp1") (resid 156 and name ha and segid="omp1") 1.8 0 3.2 > ! 1.37/41.7 mw 4 4D CC > assign (resid 15 and name hb# and segid="omp1") (resid 156 and name hb# and segid="omp1") 1.8 0 2.4 > > !S157 > !long > ! 4.38 s 10 3D NOE > ! 60.9/4.37 m 7 4D CN > assign (resid 70 and name ha and segid="omp1") (resid 157 and name hn and segid="omp1") 1.8 0 1.7 > ! 0.06/20.8 s 14 4D CN Make med since the other 70hg-157hn is v-wk. > assign (resid 70 and name hg# and segid="omp1") (resid 157 and name hn and segid="omp1") 1.8 0 1.7 > ! 0.39/24.9 mw 4 4D CN Make wk since only 1 15hd-157hn. > assign (resid 15 and name hd# and segid="omp1") (resid 157 and name hn and segid="omp1") 1.8 0 3.2 > ! 4.42/61.8 m 6 4D CC Make wk. > assign (resid 14 and name ha and segid="omp1") (resid 157 and name hb# and segid="omp1") 1.8 0 3.2 > ! mw 5 4D CC Make wk since only 1 L15hd-S157hb > assign (resid 15 and name hd# and segid="omp1") (resid 157 and name hb# and segid="omp1") 1.8 0 3.2 > > !V158 > !long > ! 4.42/57.0 m 7 4D CC > assign (resid 68 and name ha and segid="omp1") (resid 158 and name ha and segid="omp1") 1.8 0 1.5 > ! 7.08/118.8 mw 4 4D CC Make wk since only 1 68hd1-158hg. > assign (resid 68 and name hd1 and segid="omp1") (resid 158 and name hg2# and segid="omp1") 1.8 0 3.2 > ! 0.39/24.9 m 9 4D CN Make mw since only 1 15hd-158hn. > assign (resid 15 and name hd# and segid="omp1") (resid 158 and name hn and segid="omp1") 1.8 0 2.4 > ! 4.31/62.1 m 8 4D CN > assign (resid 14 and name ha and segid="omp1") (resid 158 and name hn and segid="omp1") 1.8 0 2.4 > > !V159 > !long > ! 5.05,54.9 w 3 4D CC, > assign (resid 10 and name ha and segid="omp1") (resid 159 and name hg# and segid="omp1") 1.8 0 3.2 > ! 4.89/52.8 w 2 4D CC, > assign (resid 12 and name ha and segid="omp1") (resid 159 and name hg# and segid="omp1") 1.8 0 3.2 > ! 6.79 m 6 3D NOE > assign (resid 67 and name hn and segid="omp1") (resid 159 and name hn and segid="omp1") 1.8 0 1.7 > ! w 3 4D CN > assign (resid 68 and name ha and segid="omp1") (resid 159 and name hn and segid="omp1") 1.8 0 3.2 > ! mw 5 3D NOE > assign (resid 69 and name hn and segid="omp1") (resid 159 and name hn and segid="omp1") 1.8 0 2.4 > > !F160 > !long > ! 9.08 m 9 3D NOE 122.9 m-w 4 3D HNH > assign (resid 11 and name hn and segid="omp1") (resid 160 and name hn and segid="omp1") 1.8 0 2.4 > ! 4.82/52.6 m 6 4D CN, > assign (resid 12 and name ha and segid="omp1") (resid 160 and name hn and segid="omp1") 1.8 0 1.7 > > !N161 > !long > ! 5.05/54.9 m 6 4D CC > assign (resid 10 and name ha and segid="omp1") (resid 161 and name ha and segid="omp1") 1.8 0 1.5 > > !Q162 > !long > ! 9.08 m 7 3D NOESY (122.8 in 3D HNH) > assign (resid 11 and name hn and segid="omp1") (resid 162 and name hn and segid="omp1") 1.8 0 2.4 > > !L163 > !long > ! 3.73 mw 5 3D NOE > assign (resid 62 and name ha and segid="omp1") (resid 163 and name hn and segid="omp1") 1.8 0 2.4 > ! 3.80/56.7 m 6 4D CC > ! 9 or med in K62ha plane > assign (resid 62 and name ha and segid="omp1") (resid 163 and name hd# and segid="omp1") 1.8 0 1.5 > ! 115.5 w 2 3D HNH > assign (resid 63 and name hn and segid="omp1") (resid 163 and name hn and segid="omp1") 1.8 0 3.2 > ! 4.90/53.1 mw 4 4D CN > assign (resid 63 and name ha and segid="omp1") (resid 163 and name hn and segid="omp1") 1.8 0 3.2 > ! 0.25/22.7 mw 4 4D CN > assign (resid 63 and name hd# and segid="omp1") (resid 163 and name hn and segid="omp1") 1.8 0 2.4 >
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