NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
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7950 |
1laq   |
cing | 1-original | 6 | XPLOR/CNS | distance | NOE | ambi |
! assign ( resid 1 and name H5 )( resid 1 and name H2'' ) 2.74 0.60 0.59 ! OFF
assign ( resid 1 and name H1' )( resid 1 and name H2' ) 2.51 0.51 0.51 ! ub+0.5
assign ( resid 1 and name H1' )( resid 1 and name H2'' ) 2.46 0.36 0.36 ! nc
assign ( resid 1 and name H3' )( resid 1 and name H4' ) 2.66 0.54 0.53 ! nc
! assign ( resid 1 and name H1' )( resid 2 and name H5'' ) 3.22 0.98 0.98 ! OFF
assign ( resid 2 and name H8 )( resid 2 and name H2' ) 2.26 0.28 0.29 ! nc
assign ( resid 2 and name H8 )( resid 2 and name H2'' ) 2.88 0.81 0.81 ! ub+1.2
assign ( resid 2 and name H1' )( resid 2 and name H3' ) 3.04 1.01 1.01 ! ub+1
assign ( resid 2 and name H3' )( resid 2 and name H4' ) 2.58 0.35 0.35 ! ub+0.3
assign ( resid 2 and name H3' )( resid 2 and name H5' ) 2.87 0.89 0.88 ! ub+1.5
assign ( resid 2 and name H3' )( resid 2 and name H5'' ) 2.90 0.82 0.82 ! ub+1
assign ( resid 3 and name H6 )( resid 2 and name H2'' ) 2.54 0.24 0.23 ! lb=2.3
assign ( resid 3 and name H5 )( resid 2 and name H2' ) 2.93 0.55 0.55 ! nc
assign ( resid 3 and name H6 )( resid 3 and name H2' ) 2.37 0.23 0.22 ! nc
assign ( resid 3 and name H6 )( resid 3 and name H2'' ) 2.94 0.71 0.71 ! ub+1
assign ( resid 3 and name H6 )( resid 3 and name H4' ) 3.85 0.99 1.00 ! ub+1
assign (( resid 3 and name H5' ) or ( resid 3 and name H5'' ))
( resid 3 and name H6 ) 3.54 0.64 0.63 ! nc
! assign ( resid 3 and name H5 )( resid 3 and name H2'' ) 3.20 0.60 0.59 ! OFF
assign ( resid 3 and name H1' )( resid 3 and name H2' ) 2.39 0.51 0.51 ! ub+0.5
assign ( resid 3 and name H1' )( resid 3 and name H2'' ) 2.20 0.17 0.17 ! nc
assign ( resid 3 and name H1' )( resid 3 and name H3' ) 2.92 0.96 0.96 ! ub+1
assign ( resid 3 and name H2'' )( resid 3 and name H3' ) 2.82 0.45 0.45 ! nc
assign ( resid 3 and name H2' )( resid 3 and name H4' ) 2.73 1.07 1.07 ! ub+1
assign ( resid 3 and name H1' )( resid 4 and name H4' ) 3.93 1.17 1.17 ! ub=5.1
assign ( resid 4 and name H8 )( resid 4 and name H2'' ) 3.14 0.95 0.95 ! ub+1
assign ( resid 4 and name H1' )( resid 4 and name H2' ) 2.97 0.75 0.75 ! ub+0.5
assign ( resid 4 and name H1' )( resid 4 and name H2'' ) 2.22 0.27 0.27 ! nc
! assign ( resid 4 and name H1' )( resid 4 and name H5'' ) 3.68 0.58 0.58 ! OFF
assign ( resid 4 and name H2' )( resid 4 and name H3' ) 2.59 0.26 0.26 ! nc
assign ( resid 4 and name H2'' )( resid 4 and name H3' ) 2.71 0.43 0.42 ! nc
assign ( resid 4 and name H3' )( resid 4 and name H4' ) 2.54 0.22 0.22 ! nc
assign ( resid 4 and name H3' )( resid 4 and name H5' ) 2.94 0.90 0.90 ! ub+1.5
assign ( resid 4 and name H3' )( resid 4 and name H5'' ) 2.94 0.83 0.83 ! ub+1
assign ( resid 5 and name H8 )( resid 4 and name H2'' ) 2.81 0.51 0.51 ! lb=2.3
assign ( resid 5 and name H8 )( resid 5 and name H4' ) 3.64 1.78 1.77 ! ub+1
assign ( resid 5 and name H1' )( resid 5 and name H2' ) 2.55 0.49 0.50 ! ub+0.5
assign ( resid 5 and name H2'' )( resid 5 and name H4' ) 3.53 1.07 1.07 ! ub+1
assign ( resid 5 and name H3' )( resid 5 and name H4' ) 2.56 0.37 0.37 ! ub+0.3
assign (( resid 5 and name H5' ) or ( resid 5 and name H5'' ))
( resid 5 and name H3' ) 2.78 0.72 0.72 ! ub+1
assign ( resid 5 and name H1' )( resid 6 and name H3' ) 4.43 1.57 1.57 ! ub=6
assign ( resid 6 and name H6 )( resid 5 and name H2'' ) 2.88 0.58 0.58 ! lb=2.3
assign ( resid 6 and name H6 )( resid 5 and name H4' ) 4.11 1.70 1.69 ! ub=5.8
assign ( resid 6 and name H6 )( resid 6 and name H2'' ) 2.85 1.02 1.02 ! ub+1
assign ( resid 6 and name H5# )( resid 6 and name H2' ) 4.22 1.08 1.08 ! nc
! assign ( resid 6 and name H5# )( resid 6 and name H2'' ) 3.82 0.60 0.60 ! OFF
assign ( resid 6 and name H1' )( resid 6 and name H3' ) 3.45 1.19 1.19 ! ub+1
! assign ( resid 6 and name H5# )( resid 6 and name H4' ) 4.96 1.16 1.16 ! OFF
assign ( resid 7 and name H8 )( resid 7 and name H1' ) 2.38 0.27 0.27 ! nc
assign ( resid 7 and name H1' )( resid 7 and name H3' ) 3.41 0.97 0.97 ! ub+1
assign ( resid 8 and name H6 )( resid 7 and name H3' ) 4.00 0.90 0.89 ! nc
! assign ( resid 8 and name Q2' )( resid 7 and name H3' ) 3.62 0.72 0.71 ! OFF
assign (( resid 8 and name H2' ) or ( resid 8 and name H2'' ))
( resid 8 and name H6 ) 2.96 0.44 0.44 ! ub+0.5
assign ( resid 8 and name H6 )( resid 8 and name H3' ) 3.43 0.84 0.84 ! ub+0.5
assign (( resid 8 and name H2' ) or ( resid 8 and name H2'' ))
( resid 8 and name H1' ) 2.44 0.42 0.42 ! ub+0.5
assign ( resid 8 and name H1' )( resid 8 and name H4' ) 3.19 0.96 0.96 ! ub+1
assign (( resid 8 and name H2' ) or ( resid 8 and name H2'' ))
( resid 8 and name H3' ) 2.65 0.34 0.34 ! nc
assign (( resid 8 and name H5' ) or ( resid 8 and name H5'' ))
( resid 8 and name H3' ) 2.75 0.72 0.72 ! ub+1
assign ( resid 8 and name H1' )( resid 9 and name H3' ) 4.20 1.80 1.80 ! ub=6
assign (( resid 8 and name H2' ) or ( resid 8 and name H2'' ))
( resid 9 and name H6 ) 3.37 0.37 0.37 ! ub+0.5
assign ( resid 9 and name H6 )( resid 8 and name H3' ) 3.89 0.90 0.90 ! ub+0.5
assign (( resid 8 and name H2' ) or ( resid 8 and name H2'' ))
( resid 9 and name H5 ) 2.92 0.36 0.37 ! nc
assign ( resid 9 and name H6 )( resid 9 and name H4' ) 3.54 1.05 1.05 ! ub+1
assign (( resid 9 and name H5' ) or ( resid 9 and name H5'' ))
( resid 9 and name H6 ) 3.54 0.79 0.79 ! nc
! assign ( resid 9 and name H5 )( resid 9 and name H2'' ) 2.91 0.56 0.55 ! OFF
! assign ( resid 9 and name H5 )( resid 9 and name Q5' ) 4.01 0.73 0.73 ! OFF
assign ( resid 9 and name H1' )( resid 9 and name H2'' ) 2.25 0.17 0.17 ! nc
assign ( resid 9 and name H1' )( resid 9 and name H3' ) 3.15 1.28 1.28 ! ub+1
assign ( resid 9 and name H2' )( resid 9 and name H3' ) 2.92 0.60 0.59 ! nc
assign ( resid 9 and name H2'' )( resid 9 and name H3' ) 2.52 0.21 0.21 ! nc
assign ( resid 10 and name H6 )( resid 9 and name H2' ) 3.47 0.47 0.47 ! ub+1
assign ( resid 10 and name H6 )( resid 9 and name H4' ) 4.42 1.38 1.38 ! ub=5.8
assign ( resid 10 and name H6 )( resid 9 and name H6 ) 5.00 0.40 0.40 ! gen
assign ( resid 10 and name H5 )( resid 9 and name H2'' ) 2.48 0.42 0.42 ! nc
assign ( resid 10 and name H6 )( resid 10 and name H1' ) 3.08 0.96 0.96 ! ub+0.5
assign ( resid 10 and name H6 )( resid 10 and name H2'' ) 2.87 0.79 0.79 ! ub+1.2
assign ( resid 10 and name H6 )( resid 10 and name H4' ) 3.62 1.00 1.00 ! ub+1.5
assign (( resid 10 and name H5' ) or ( resid 10 and name H5'' ))
( resid 10 and name H6 ) 3.73 0.68 0.68 ! nc
assign ( resid 10 and name H2' )( resid 10 and name H3' ) 2.52 0.37 0.37 ! nc
assign ( resid 10 and name H2'' )( resid 10 and name H3' ) 2.44 0.27 0.27 ! nc
assign ( resid 11 and name H8 )( resid 10 and name H1' ) 3.12 0.73 0.73 ! ub+0.5
assign ( resid 11 and name H8 )( resid 10 and name H2' ) 3.48 0.48 0.48 ! ub+0.5
assign ( resid 11 and name H8 )( resid 11 and name H1' ) 3.10 0.88 0.88 ! ub+1.3
assign ( resid 11 and name H1' )( resid 11 and name H3' ) 3.33 0.87 0.87 ! ub+1
assign ( resid 11 and name H3' )( resid 11 and name H4' ) 2.42 0.28 0.29 ! nc
assign ( resid 11 and name H3' )( resid 11 and name H5' ) 2.88 0.94 0.94 ! ub+1.5
assign ( resid 11 and name H3' )( resid 11 and name H5'' ) 3.03 1.08 1.08 ! ub+1
assign ( resid 11 and name H8 )( resid 12 and name H5 ) 3.83 0.92 0.92 ! ub+4.75
assign ( resid 12 and name H6 )( resid 11 and name H1' ) 3.04 0.70 0.70 ! ub+0.5
assign ( resid 12 and name H6 )( resid 11 and name H2' ) 3.54 0.54 0.54 ! ub+0.3
assign ( resid 12 and name H6 )( resid 11 and name H3' ) 4.38 0.88 0.88 ! ub+0.5
assign ( resid 12 and name H6 )( resid 12 and name H2'' ) 2.92 0.83 0.83 ! ub+1
assign ( resid 12 and name H5 )( resid 12 and name H1' ) 4.12 1.29 1.29 ! ub+0.5
assign ( resid 12 and name H1' )( resid 12 and name H2'' ) 2.15 0.16 0.15 ! nc
assign ( resid 12 and name H1' )( resid 12 and name H4' ) 3.15 0.90 0.90 ! ub+1
assign ( resid 12 and name H2' )( resid 12 and name H3' ) 2.71 0.46 0.46 ! nc
assign ( resid 12 and name H2'' )( resid 12 and name H3' ) 2.65 0.32 0.32 ! nc
assign ( resid 12 and name H2' )( resid 12 and name H4' ) 3.13 1.26 1.26 ! ub+1
assign ( resid 12 and name H1' )( resid 13 and name H3' ) 4.56 1.43 1.44 ! ub=6
assign ( resid 13 and name H8 )( resid 12 and name H2'' ) 2.82 0.52 0.52 ! lb=2.3
assign ( resid 13 and name H8 )( resid 13 and name H2'' ) 2.92 0.99 0.99 ! ub+1
assign ( resid 13 and name H1' )( resid 13 and name H4' ) 3.20 0.95 0.95 ! ub+1
assign (( resid 13 and name H5' ) or ( resid 13 and name H5'' ))
( resid 13 and name H1' ) 3.88 0.99 0.99 ! ub+1
assign ( resid 13 and name H3' )( resid 13 and name H4' ) 2.44 0.33 0.33 ! nc
! assign ( resid 14 and name H5 )( resid 14 and name H2'' ) 3.69 0.76 0.76 ! OFF
assign ( resid 14 and name H1' )( resid 14 and name H2' ) 2.37 0.49 0.48 ! ub+0.5
assign ( resid 14 and name H1' )( resid 14 and name H2'' ) 2.52 0.35 0.35 ! nc
assign ( resid 14 and name H3' )( resid 14 and name H4' ) 2.53 0.49 0.49 ! nc
! assign ( resid 14 and name H1' )( resid 15 and name H5'' ) 3.19 1.02 1.02 ! OFF
assign ( resid 15 and name H8 )( resid 15 and name H2' ) 2.27 0.28 0.28 ! nc
assign ( resid 15 and name H8 )( resid 15 and name H2'' ) 2.90 0.82 0.82 ! ub+1.2
assign ( resid 15 and name H1' )( resid 15 and name H3' ) 3.01 0.98 0.98 ! ub+1
assign ( resid 15 and name H3' )( resid 15 and name H4' ) 2.58 0.38 0.38 ! ub+0.3
assign ( resid 15 and name H3' )( resid 15 and name H5' ) 2.83 0.89 0.89 ! ub+1.5
assign ( resid 15 and name H3' )( resid 15 and name H5'' ) 2.90 0.97 0.98 ! ub+1
assign ( resid 16 and name H6 )( resid 15 and name H2'' ) 2.62 0.32 0.32 ! lb=2.3
assign ( resid 16 and name H5 )( resid 15 and name H2' ) 3.00 0.56 0.56 ! nc
assign ( resid 16 and name H6 )( resid 16 and name H2' ) 2.29 0.17 0.17 ! nc
assign ( resid 16 and name H6 )( resid 16 and name H2'' ) 2.94 0.75 0.75 ! ub+1.2
assign ( resid 16 and name H6 )( resid 16 and name H4' ) 3.88 1.08 1.08 ! ub+1
assign (( resid 16 and name H5' ) or ( resid 16 and name H5'' ))
( resid 16 and name H6 ) 3.32 0.76 0.76 ! ub+0.5
! assign ( resid 16 and name H5 )( resid 16 and name H2'' ) 3.04 0.77 0.76 ! OFF
assign ( resid 16 and name H1' )( resid 16 and name H3' ) 3.06 1.39 1.39 ! ub+1
assign ( resid 17 and name H8 )( resid 17 and name H2'' ) 3.18 1.13 1.13 ! ub+1
assign ( resid 17 and name H8 )( resid 17 and name H5' ) 3.09 0.80 0.80 ! nc
assign ( resid 17 and name H1' )( resid 17 and name H2' ) 3.10 0.88 0.88 ! ub+0.5
assign ( resid 17 and name H1' )( resid 17 and name H2'' ) 2.29 0.40 0.40 ! nc
assign ( resid 17 and name H2' )( resid 17 and name H4' ) 3.99 1.14 1.14 ! ub+1
assign ( resid 17 and name H2'' )( resid 17 and name H4' ) 3.35 0.95 0.95 ! ub+1
assign ( resid 17 and name H3' )( resid 17 and name H4' ) 2.58 0.39 0.39 ! ub+0.3
assign ( resid 17 and name H3' )( resid 17 and name H5' ) 2.90 0.95 0.94 ! ub+1.5
assign ( resid 17 and name H3' )( resid 17 and name H5'' ) 2.88 0.91 0.90 ! ub+1
assign ( resid 17 and name H1' )( resid 18 and name H4' ) 3.83 1.27 1.27 ! ub=5.1
assign ( resid 18 and name H8 )( resid 17 and name H2' ) 3.42 0.42 0.43 ! ub+1
assign ( resid 18 and name H8 )( resid 17 and name H2'' ) 2.88 0.58 0.59 ! lb=2.3
assign ( resid 18 and name H8 )( resid 17 and name H8 ) 5.00 0.40 0.40 ! gen
assign ( resid 18 and name H8 )( resid 18 and name H2' ) 2.38 0.31 0.32 ! nc
assign ( resid 18 and name H8 )( resid 18 and name H2'' ) 3.46 1.10 1.11 ! ub+1
assign ( resid 19 and name H8 )( resid 18 and name H2' ) 3.46 0.46 0.46 ! ub+0.5
assign ( resid 19 and name H8 )( resid 18 and name H2'' ) 2.85 0.55 0.55 ! lb=2.3
assign ( resid 19 and name H8 )( resid 18 and name H8 ) 5.50 0.50 0.50 ! gen
assign ( resid 19 and name H8 )( resid 19 and name H2' ) 2.31 0.40 0.40 ! nc
assign ( resid 19 and name H8 )( resid 19 and name H2'' ) 2.92 0.90 0.90 ! ub+1
assign ( resid 19 and name H8 )( resid 19 and name H4' ) 4.50 1.52 1.51 ! ub+1
assign (( resid 19 and name H5' ) or ( resid 19 and name H5'' ))
( resid 19 and name H8 ) 3.67 0.85 0.85 ! nc
assign ( resid 19 and name H1' )( resid 19 and name H4' ) 3.56 0.94 0.94 ! ub+1
assign ( resid 19 and name H3' )( resid 19 and name H4' ) 2.48 0.45 0.45 ! ub+0.3
assign ( resid 19 and name H8 )( resid 20 and name H5 ) 4.07 0.68 0.68 ! ub+4.75
assign ( resid 19 and name H1' )( resid 20 and name H5' ) 4.20 0.80 0.80 ! gen
! assign ( resid 19 and name H2'' )( resid 20 and name H5' ) 3.17 0.67 0.67 ! OFF
assign ( resid 20 and name H6 )( resid 19 and name H3' ) 4.31 0.68 0.68 ! nc
assign ( resid 20 and name H6 )( resid 19 and name H8 ) 5.00 0.40 0.40 ! gen
assign ( resid 20 and name H1' )( resid 19 and name H1' ) 3.77 1.19 1.19 ! ub+0.5
assign ( resid 20 and name H6 )( resid 20 and name H4' ) 4.53 1.09 1.08 ! ub+1
assign ( resid 20 and name H6 )( resid 20 and name H5'' ) 3.62 0.92 0.92 ! ub+0.5
assign ( resid 20 and name H5 )( resid 20 and name H2' ) 4.21 1.81 1.82 ! ub+1.5
assign ( resid 20 and name H1' )( resid 20 and name H4' ) 2.91 0.86 0.86 ! ub+1
assign ( resid 20 and name H2'' )( resid 20 and name H4' ) 2.92 0.98 0.98 ! ub+1
assign ( resid 20 and name H3' )( resid 20 and name H5' ) 3.09 1.00 1.00 ! ub+1.5
! assign ( resid 20 and name H2'' )( resid 21 and name H5'' ) 3.02 0.67 0.67 ! OFF
assign ( resid 21 and name H8 )( resid 20 and name H6 ) 5.50 0.50 0.50 ! gen
assign ( resid 21 and name H8 )( resid 21 and name H4' ) 4.55 1.96 1.96 ! ub+1
assign ( resid 21 and name H8 )( resid 21 and name H5' ) 3.17 0.85 0.85 ! nc
assign ( resid 21 and name H8 )( resid 21 and name H5'' ) 3.88 0.98 0.99 ! ub+0.5
assign ( resid 21 and name H1' )( resid 21 and name H4' ) 3.62 1.28 1.28 ! ub+1
assign (( resid 21 and name H2' ) or ( resid 21 and name H2'' ))
( resid 21 and name H3' ) 2.54 0.21 0.21 ! nc
assign (( resid 21 and name H2' ) or ( resid 21 and name H2'' ))
( resid 21 and name H5'' ) 3.61 1.27 1.27 ! ub+1.5
assign ( resid 21 and name H3' )( resid 21 and name H5'' ) 3.01 0.80 0.80 ! ub+1
assign ( resid 22 and name H1' )( resid 21 and name H1' ) 4.26 1.13 1.13 ! ub+0.5
assign ( resid 22 and name H6 )( resid 22 and name H2'' ) 3.18 1.05 1.05 ! ub+1
assign ( resid 22 and name H6 )( resid 22 and name H4' ) 3.46 1.06 1.07 ! ub+1.5
assign ( resid 22 and name H1' )( resid 22 and name H4' ) 3.41 1.03 1.03 ! ub+1
assign ( resid 22 and name H3' )( resid 22 and name H4' ) 2.30 0.41 0.41 ! ub+0.5
assign ( resid 23 and name H6 )( resid 22 and name H6 ) 5.00 0.40 0.40 ! gen
assign ( resid 23 and name H6 )( resid 23 and name H4' ) 3.74 1.06 1.06 ! ub+1.5
assign (( resid 23 and name H5' ) or ( resid 23 and name H5'' ))
( resid 23 and name H6 ) 4.38 0.79 0.79 ! nc
assign ( resid 23 and name H1' )( resid 23 and name H2' ) 2.35 0.68 0.68 ! ub+0.5
assign ( resid 23 and name H1' )( resid 23 and name H2'' ) 2.20 0.15 0.15 ! nc
assign ( resid 23 and name H2' )( resid 23 and name H3' ) 2.43 0.32 0.32 ! nc
assign ( resid 23 and name H2'' )( resid 23 and name H3' ) 2.46 0.23 0.23 ! nc
assign ( resid 24 and name H8 )( resid 23 and name H2' ) 3.39 0.39 0.39 ! ub+0.5
assign ( resid 24 and name H8 )( resid 23 and name H6 ) 5.00 0.40 0.40 ! gen
assign ( resid 24 and name H1' )( resid 24 and name H3' ) 3.27 0.90 0.90 ! ub+1
assign ( resid 24 and name H3' )( resid 24 and name H4' ) 2.54 0.42 0.42 ! ub+0.3
assign ( resid 24 and name H3' )( resid 24 and name H5' ) 2.87 0.94 0.94 ! ub+1.5
assign ( resid 24 and name H3' )( resid 24 and name H5'' ) 2.97 1.01 1.01 ! ub+1
assign ( resid 24 and name H1' )( resid 25 and name H2' ) 3.82 1.18 1.18 ! ub=5
assign ( resid 25 and name H6 )( resid 24 and name H1' ) 3.12 0.71 0.71 ! ub+0.5
assign ( resid 25 and name H6 )( resid 24 and name H2' ) 3.48 0.48 0.48 ! ub+0.3
assign ( resid 25 and name H6 )( resid 24 and name H3' ) 4.26 0.93 0.93 ! ub+0.5
assign ( resid 25 and name H6 )( resid 25 and name H2'' ) 2.88 0.75 0.75 ! ub+1
assign ( resid 25 and name H5 )( resid 25 and name H1' ) 4.45 1.31 1.30 ! ub+0.5
assign ( resid 25 and name H1' )( resid 25 and name H2'' ) 2.20 0.18 0.18 ! nc
assign ( resid 25 and name H1' )( resid 25 and name H4' ) 3.19 0.94 0.94 ! ub+1
assign ( resid 25 and name H2' )( resid 25 and name H3' ) 2.70 0.51 0.51 ! nc
assign ( resid 25 and name H2'' )( resid 25 and name H3' ) 2.60 0.35 0.35 ! nc
assign ( resid 25 and name H2' )( resid 25 and name H4' ) 3.06 1.33 1.33 ! ub+1
assign ( resid 25 and name H1' )( resid 26 and name H3' ) 4.54 1.46 1.46 ! ub=6
assign ( resid 26 and name H8 )( resid 25 and name H2'' ) 2.77 0.48 0.48 ! lb=2.3
assign ( resid 26 and name H8 )( resid 26 and name H2'' ) 2.89 1.03 1.03 ! ub+1
assign ( resid 26 and name H1' )( resid 26 and name H4' ) 3.21 1.05 1.05 ! ub+1
assign (( resid 26 and name H5' ) or ( resid 26 and name H5'' ))
( resid 26 and name H1' ) 3.93 0.98 0.98 ! ub+1
assign ( resid 26 and name H3' )( resid 26 and name H4' ) 2.40 0.38 0.38 ! nc
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