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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7946 |
1laq   |
cing | 1-original | 2 | XPLOR/CNS | distance | NOE | ambi |
assign ( resid 1 and name H6 )( resid 1 and name H1' ) 3.02 0.66 0.66 ! nc
assign ( resid 1 and name H6 )( resid 1 and name H2' ) 2.82 0.62 0.61 ! nc
assign ( resid 1 and name H6 )( resid 1 and name H3' ) 3.60 0.89 0.89 ! ub+0.5
assign ( resid 1 and name H6 )( resid 1 and name H4' ) 4.17 1.06 1.07 ! ub+1
assign (( resid 1 and name H5' ) or ( resid 1 and name H5'' ))
( resid 1 and name H6 ) 2.65 0.66 0.67 ! nc
! assign ( resid 1 and name H5 )( resid 1 and name H3' ) 3.35 0.81 0.81 ! OFF
assign (( resid 1 and name H5' ) or ( resid 1 and name H5'' ))
( resid 1 and name H1' ) 4.88 0.93 0.93 ! nc
assign ( resid 1 and name H2' )( resid 1 and name H3' ) 2.35 0.25 0.25 ! nc
assign (( resid 1 and name H5' ) or ( resid 1 and name H5'' ))
( resid 1 and name H2' ) 3.31 0.70 0.71 ! nc
assign (( resid 1 and name H5' ) or ( resid 1 and name H5'' ))
( resid 1 and name H2'' ) 4.07 0.94 0.95 ! ub+0.5
assign (( resid 1 and name H5' ) or ( resid 1 and name H5'' ))
( resid 1 and name H3' ) 2.94 0.85 0.85 ! ub+1
assign ( resid 2 and name H8 )( resid 1 and name H1' ) 2.99 0.77 0.76 ! nc
assign ( resid 2 and name H8 )( resid 1 and name H2' ) 3.47 0.47 0.47 ! ub+1
assign ( resid 2 and name H8 )( resid 1 and name H2'' ) 2.69 0.40 0.40 ! lb=2.3
assign ( resid 2 and name H8 )( resid 1 and name H3' ) 3.98 0.96 0.96 ! ub+0.5
assign ( resid 2 and name H8 )( resid 1 and name H6 ) 5.00 0.40 0.40 ! gen
! assign ( resid 2 and name H1' )( resid 1 and name Q5' ) 4.92 0.50 0.50 ! OFF
assign ( resid 2 and name H8 )( resid 2 and name H1' ) 3.54 0.69 0.68 ! nc
assign ( resid 2 and name H8 )( resid 2 and name H3' ) 3.71 0.81 0.80 ! ub+0.5
assign ( resid 2 and name H8 )( resid 2 and name H4' ) 3.71 1.38 1.38 ! ub+1
assign ( resid 2 and name H8 )( resid 2 and name H5' ) 3.24 0.60 0.59 ! nc
assign ( resid 2 and name H8 )( resid 2 and name H5'' ) 3.73 0.85 0.85 ! nc
assign ( resid 2 and name H8 )( resid 3 and name H5 ) 3.49 1.26 1.26 ! ub+4.75
assign ( resid 2 and name H1' )( resid 3 and name H4' ) 5.00 0.20 0.20 ! gen
assign ( resid 3 and name H6 )( resid 2 and name H8 ) 5.00 0.40 0.40 ! gen
assign ( resid 3 and name H5 )( resid 2 and name H3' ) 4.16 1.43 1.42 ! ub+1
assign ( resid 3 and name H6 )( resid 3 and name H1' ) 2.96 0.86 0.87 ! ub+1
assign ( resid 3 and name H6 )( resid 3 and name H3' ) 3.38 1.20 1.21 ! ub+1
! assign ( resid 3 and name H5 )( resid 3 and name H3' ) 2.84 0.57 0.57 ! OFF
assign ( resid 4 and name H8 )( resid 3 and name H2' ) 3.42 0.42 0.42 ! ub+0.3
assign ( resid 4 and name H8 )( resid 3 and name H2'' ) 2.65 0.35 0.35 ! lb=2.3
assign ( resid 4 and name H8 )( resid 3 and name H6 ) 5.00 0.40 0.40 ! gen
assign ( resid 4 and name H8 )( resid 4 and name H3' ) 3.32 1.26 1.25 ! ub+1.5
assign ( resid 4 and name H8 )( resid 4 and name H4' ) 5.13 1.16 1.16 ! ub+1
assign ( resid 4 and name H1' )( resid 4 and name H3' ) 2.93 1.14 1.14 ! ub+1
assign ( resid 4 and name H1' )( resid 4 and name H4' ) 3.38 0.88 0.88 ! ub+1
assign ( resid 4 and name H1' )( resid 5 and name H4' ) 5.00 0.20 0.20 ! gen
assign ( resid 5 and name H8 )( resid 4 and name H1' ) 3.02 0.83 0.83 ! ub+1
assign ( resid 5 and name H8 )( resid 4 and name H3' ) 3.86 1.01 1.01 ! ub+0.5
assign ( resid 5 and name H8 )( resid 4 and name H8 ) 5.00 0.40 0.40 ! gen
assign ( resid 5 and name H8 )( resid 5 and name H3' ) 4.01 0.76 0.76 ! ub+0.5
assign (( resid 5 and name H5' ) or ( resid 5 and name H5'' ))
( resid 5 and name H8 ) 3.76 0.97 0.97 ! nc
assign ( resid 5 and name H1' )( resid 5 and name H3' ) 3.27 1.06 1.06 ! ub+1
assign ( resid 5 and name H2' )( resid 5 and name H4' ) 3.01 1.25 1.25 ! ub+1
assign ( resid 5 and name H8 )( resid 6 and name H5# ) 3.82 0.93 0.92 ! ub+1
assign ( resid 6 and name H6 )( resid 5 and name H2' ) 3.49 0.49 0.49 ! ub+1
assign ( resid 6 and name H6 )( resid 5 and name H3' ) 4.33 0.79 0.79 ! nc
assign ( resid 6 and name H6 )( resid 5 and name H8 ) 5.00 0.40 0.40 ! gen
assign ( resid 6 and name H5# )( resid 5 and name H1' ) 4.71 0.92 0.92 ! nc
assign ( resid 6 and name H5# )( resid 5 and name H2' ) 3.18 0.48 0.48 ! nc
assign ( resid 6 and name H5# )( resid 5 and name H3' ) 4.35 0.89 0.89 ! ub+0.5
! assign ( resid 6 and name H5# )( resid 5 and name H4' ) 6.55 0.70 0.70 ! OFF
assign ( resid 6 and name H6 )( resid 6 and name H2' ) 2.48 0.21 0.21 ! nc
assign ( resid 6 and name H6 )( resid 6 and name H3' ) 3.52 1.15 1.15 ! ub+1.5
assign ( resid 6 and name H6 )( resid 6 and name H4' ) 3.51 1.08 1.08 ! ub+1
assign (( resid 6 and name H5' ) or ( resid 6 and name H5'' ))
( resid 6 and name H6 ) 3.64 0.74 0.74 ! nc
assign ( resid 6 and name H6 )( resid 6 and name H5# ) 2.62 0.30 0.30 ! nc
assign ( resid 6 and name H5# )( resid 6 and name H3' ) 5.59 0.97 0.97 ! ub+0.5
assign ( resid 6 and name H1' )( resid 6 and name H2' ) 2.63 0.43 0.43 ! ub+0.5
assign ( resid 6 and name H2' )( resid 6 and name H3' ) 2.55 0.33 0.33 ! nc
assign ( resid 6 and name H2'' )( resid 6 and name H3' ) 2.50 0.25 0.25 ! nc
assign ( resid 6 and name H2' )( resid 6 and name H4' ) 3.40 1.18 1.18 ! ub+1
assign (( resid 7 and name H6A1 ) or ( resid 7 and name H6A2 ))
( resid 6 and name H6 ) 4.39 0.65 0.65 ! nc
assign ( resid 7 and name H8A2 )( resid 6 and name H6 ) 2.90 0.94 0.94 ! nc
assign ( resid 7 and name H7A2 )( resid 6 and name H6 ) 3.78 0.95 0.95 ! ub+1.0
assign ( resid 7 and name H8A1 )( resid 6 and name H5# ) 3.40 0.73 0.73 ! nc
! assign ( resid 7 and name Q6A )( resid 6 and name H2' ) 3.47 0.51 0.51 ! OFF
! assign ( resid 7 and name H8A2 )( resid 6 and name H2' ) 7.35 2.65 2.65 ! OFF
assign (( resid 7 and name H6A1 ) or ( resid 7 and name H6A2 ))
( resid 8 and name H5# ) 4.50 0.50 0.50 ! obsv
! assign ( resid 7 and name H8A1 )( resid 8 and name H5# ) 7.50 2.50 2.50 ! OFF
! assign ( resid 7 and name Q2' )( resid 8 and name Q2' ) 4.21 0.84 0.84 ! OFF
assign ( resid 7 and name H8 )( resid 21 and name H2 ) 3.25 0.74 0.73 ! ub+1
assign ( resid 8 and name H5# )( resid 7 and name H3' ) 5.06 1.02 1.02 ! ub+1
assign (( resid 8 and name H2' ) or ( resid 8 and name H2'' ))
( resid 8 and name H5# ) 4.32 0.95 0.95 ! ub+1
assign ( resid 8 and name H1' )( resid 8 and name H3' ) 3.15 1.35 1.35 ! ub+1
assign ( resid 8 and name H5# )( resid 9 and name H5 ) 5.12 0.97 0.97 ! nc
assign ( resid 9 and name H5 )( resid 8 and name H3' ) 4.24 1.41 1.41 ! ub+1
assign ( resid 9 and name H6 )( resid 9 and name H2' ) 2.58 0.41 0.40 ! nc
assign ( resid 9 and name H6 )( resid 9 and name H3' ) 3.45 1.01 1.01 ! ub+0.8
assign ( resid 9 and name H1' )( resid 9 and name H2' ) 2.37 0.55 0.55 ! ub+0.5
assign ( resid 9 and name H2' )( resid 9 and name H4' ) 2.88 0.91 0.90 ! ub+1
assign ( resid 9 and name H1' )( resid 10 and name H4' ) 5.00 0.20 0.20 ! gen
assign ( resid 10 and name H2' )( resid 10 and name H4' ) 3.67 0.92 0.92 ! ub+1
assign ( resid 10 and name H1' )( resid 11 and name H4' ) 5.00 0.20 0.20 ! gen
assign ( resid 11 and name H8 )( resid 11 and name H3' ) 3.73 0.87 0.87 ! ub+0.5
assign ( resid 11 and name H8 )( resid 11 and name H4' ) 4.16 1.28 1.28 ! ub+1
assign ( resid 11 and name H1' )( resid 12 and name H4' ) 5.00 0.20 0.20 ! gen
assign ( resid 12 and name H5 )( resid 11 and name H3' ) 4.56 1.29 1.29 ! ub+1
assign ( resid 12 and name H6 )( resid 12 and name H1' ) 3.17 0.92 0.92 ! ub+0.5
assign ( resid 12 and name H5 )( resid 12 and name H2' ) 3.50 1.40 1.41 ! ub+1.5
! assign ( resid 12 and name H5 )( resid 12 and name H2'' ) 3.75 0.52 0.51 ! OFF
! assign ( resid 12 and name H5 )( resid 12 and name H3' ) 3.36 0.81 0.81 ! OFF
assign ( resid 12 and name H1' )( resid 12 and name H3' ) 3.02 0.99 1.00 ! ub+1
assign ( resid 13 and name H8 )( resid 12 and name H1' ) 3.45 0.71 0.71 ! nc
assign ( resid 13 and name H8 )( resid 12 and name H2' ) 3.51 0.51 0.51 ! ub+0.5
assign ( resid 13 and name H8 )( resid 13 and name H1' ) 3.43 0.88 0.88 ! nc
assign ( resid 13 and name H8 )( resid 13 and name H3' ) 3.30 0.96 0.96 ! ub+0.5
assign ( resid 13 and name H1' )( resid 13 and name H2' ) 2.49 0.53 0.53 ! ub+0.5
assign ( resid 13 and name H1' )( resid 13 and name H2'' ) 2.21 0.16 0.15 ! nc
assign ( resid 13 and name H1' )( resid 13 and name H3' ) 3.62 1.36 1.36 ! ub+1
assign ( resid 13 and name H2' )( resid 13 and name H3' ) 2.40 0.19 0.19 ! nc
assign ( resid 14 and name H6 )( resid 14 and name H1' ) 3.18 0.84 0.84 ! ub+0.5
assign ( resid 14 and name H6 )( resid 14 and name H2' ) 2.33 0.25 0.25 ! nc
assign ( resid 14 and name H6 )( resid 14 and name H3' ) 3.65 0.97 0.96 ! ub+0.5
assign ( resid 14 and name H6 )( resid 14 and name H4' ) 4.15 1.10 1.11 ! ub+1
assign (( resid 14 and name H5' ) or ( resid 14 and name H5'' ))
( resid 14 and name H6 ) 3.29 0.81 0.82 ! ub+0.5
! assign ( resid 14 and name H5 )( resid 14 and name H3' ) 3.39 0.81 0.81 ! OFF
assign (( resid 14 and name H5' ) or ( resid 14 and name H5'' ))
( resid 14 and name H1' ) 4.88 0.74 0.74 ! nc
assign ( resid 14 and name H2' )( resid 14 and name H3' ) 2.59 0.44 0.44 ! nc
assign (( resid 14 and name H5' ) or ( resid 14 and name H5'' ))
( resid 14 and name H2' ) 3.33 0.69 0.68 ! nc
assign (( resid 14 and name H5' ) or ( resid 14 and name H5'' ))
( resid 14 and name H2'' ) 4.06 0.94 0.95 ! ub+0.5
assign (( resid 14 and name H5' ) or ( resid 14 and name H5'' ))
( resid 14 and name H3' ) 2.88 0.85 0.85 ! ub+1
assign ( resid 14 and name H1' )( resid 15 and name H4' ) 5.00 0.20 0.20 ! gen
assign ( resid 15 and name H8 )( resid 14 and name H1' ) 3.13 0.75 0.75 ! nc
assign ( resid 15 and name H8 )( resid 14 and name H2' ) 3.48 0.48 0.48 ! ub+1
assign ( resid 15 and name H8 )( resid 14 and name H2'' ) 2.65 0.35 0.35 ! lb=2.3
assign ( resid 15 and name H8 )( resid 14 and name H3' ) 4.19 0.95 0.95 ! ub+0.5
assign ( resid 15 and name H8 )( resid 14 and name H6 ) 5.00 0.40 0.40 ! gen
! assign ( resid 15 and name H1' )( resid 14 and name Q5' ) 4.81 0.53 0.54 ! OFF
assign ( resid 15 and name H8 )( resid 15 and name H1' ) 3.38 0.56 0.56 ! ub+0.1
assign ( resid 15 and name H8 )( resid 15 and name H3' ) 3.72 0.73 0.73 ! ub+0.5
assign ( resid 15 and name H8 )( resid 15 and name H4' ) 3.75 1.35 1.34 ! ub+1
assign ( resid 15 and name H8 )( resid 15 and name H5' ) 3.22 0.52 0.52 ! nc
assign ( resid 15 and name H8 )( resid 15 and name H5'' ) 3.88 0.85 0.85 ! nc
assign ( resid 15 and name H8 )( resid 16 and name H5 ) 3.65 1.10 1.10 ! ub+4.75
assign ( resid 16 and name H6 )( resid 15 and name H8 ) 5.00 0.40 0.40 ! gen
assign ( resid 16 and name H5 )( resid 15 and name H3' ) 4.35 1.39 1.39 ! ub+1
assign ( resid 16 and name H6 )( resid 16 and name H1' ) 3.12 0.77 0.76 ! nc
assign ( resid 16 and name H6 )( resid 16 and name H3' ) 3.58 0.83 0.83 ! ub+0.5
! assign ( resid 16 and name H5 )( resid 16 and name H3' ) 2.54 0.30 0.30 ! OFF
assign ( resid 16 and name H1' )( resid 17 and name H4' ) 5.00 0.20 0.20 ! gen
assign ( resid 17 and name H8 )( resid 16 and name H1' ) 3.08 0.94 0.95 ! ub+0.5
assign ( resid 17 and name H8 )( resid 16 and name H2' ) 3.50 0.50 0.50 ! ub+0.5
assign ( resid 17 and name H8 )( resid 16 and name H2'' ) 2.68 0.38 0.39 ! lb=2.3
assign ( resid 17 and name H8 )( resid 16 and name H3' ) 4.95 0.83 0.83 ! nc
assign ( resid 17 and name H8 )( resid 16 and name H6 ) 5.00 0.40 0.40 ! gen
assign ( resid 17 and name H8 )( resid 17 and name H1' ) 2.74 1.15 1.15 ! ub+0.5
assign ( resid 17 and name H8 )( resid 17 and name H3' ) 3.49 0.81 0.80 ! ub+0.5
assign ( resid 17 and name H8 )( resid 17 and name H4' ) 4.17 1.83 1.83 ! ub+1
assign ( resid 17 and name H8 )( resid 17 and name H5'' ) 3.87 0.87 0.87 ! ub+0.5
assign ( resid 17 and name H1' )( resid 17 and name H3' ) 3.46 1.04 1.04 ! ub+1
assign ( resid 17 and name H1' )( resid 17 and name H4' ) 3.30 1.11 1.11 ! ub+1
assign ( resid 18 and name H8 )( resid 18 and name H3' ) 3.48 0.94 0.94 ! ub+1
assign ( resid 18 and name H8 )( resid 18 and name H4' ) 5.12 1.65 1.66 ! ub+1
assign ( resid 18 and name H1' )( resid 18 and name H4' ) 3.29 0.96 0.96 ! ub+1
assign ( resid 19 and name H2 )( resid 9 and name H1' ) 4.17 0.83 0.83 ! ub=5
assign ( resid 19 and name H8 )( resid 18 and name H1' ) 3.05 0.91 0.91 ! ub+0.5
assign ( resid 19 and name H8 )( resid 19 and name H1' ) 3.40 0.76 0.76 ! nc
assign ( resid 19 and name H1' )( resid 19 and name H3' ) 3.63 1.08 1.08 ! ub+1
assign ( resid 19 and name H2' )( resid 19 and name H4' ) 3.89 1.13 1.13 ! ub+1
assign ( resid 19 and name H2 )( resid 20 and name H1' ) 4.04 0.96 0.96 ! ub=5
assign ( resid 20 and name H1' )( resid 20 and name H2' ) 2.54 0.49 0.48 ! ub+0.5
assign ( resid 20 and name H1' )( resid 20 and name H3' ) 3.04 1.17 1.17 ! ub+1
assign ( resid 20 and name H2' )( resid 20 and name H4' ) 3.32 1.21 1.21 ! ub+1
assign ( resid 21 and name H8 )( resid 20 and name H1' ) 3.11 0.86 0.86 ! nc
assign ( resid 21 and name H8 )( resid 20 and name H2' ) 3.21 0.70 0.69 ! ub+0.3
assign ( resid 21 and name H8 )( resid 20 and name H2'' ) 3.05 0.91 0.91 ! nc
assign ( resid 21 and name H8 )( resid 21 and name H1' ) 2.71 1.17 1.17 ! ub+0.6
assign (( resid 21 and name H2' ) or ( resid 21 and name H2'' ))
( resid 21 and name H8 ) 2.88 0.44 0.44 ! ub+0.5
assign (( resid 21 and name H2' ) or ( resid 21 and name H2'' ))
( resid 21 and name H1' ) 2.40 0.36 0.36 ! ub+0.5
assign ( resid 21 and name H1' )( resid 21 and name H3' ) 2.83 1.04 1.03 ! ub+1
assign (( resid 21 and name H2' ) or ( resid 21 and name H2'' ))
( resid 21 and name H4' ) 3.50 1.19 1.18 ! ub+1
assign ( resid 21 and name H8 )( resid 22 and name H5 ) 3.94 0.81 0.81 ! ub+4.75
assign ( resid 22 and name H6 )( resid 21 and name H1' ) 3.16 0.71 0.71 ! ub+0.5
assign ( resid 22 and name H6 )( resid 21 and name H8 ) 5.00 0.40 0.40 ! gen
assign ( resid 22 and name H5 )( resid 21 and name H1' ) 3.37 1.33 1.33 ! ub=4.7
assign (( resid 21 and name H2' ) or ( resid 21 and name H2'' ))
( resid 22 and name H5 ) 3.49 0.74 0.74 ! lb-0.5
assign ( resid 22 and name H5 )( resid 21 and name H3' ) 4.16 1.13 1.13 ! ub+1
assign ( resid 22 and name H6 )( resid 22 and name H3' ) 3.63 1.15 1.15 ! ub+0.5
assign ( resid 22 and name H5 )( resid 22 and name H2' ) 3.16 1.51 1.50 ! ub+1.5
! assign ( resid 22 and name H5 )( resid 22 and name H2'' ) 3.20 0.92 0.92 ! OFF
! assign ( resid 22 and name H5 )( resid 22 and name H3' ) 2.68 0.59 0.60 ! OFF
assign ( resid 22 and name H1' )( resid 22 and name H2' ) 3.02 0.75 0.75 ! ub+0.5
assign ( resid 22 and name H1' )( resid 22 and name H3' ) 3.07 1.15 1.15 ! ub+1
assign ( resid 22 and name H2' )( resid 22 and name H4' ) 3.01 1.14 1.14 ! ub+1
assign ( resid 22 and name H1' )( resid 23 and name H4' ) 5.00 0.20 0.20 ! gen
assign ( resid 23 and name H6 )( resid 22 and name H1' ) 3.20 0.78 0.77 ! nc
assign ( resid 23 and name H6 )( resid 22 and name H3' ) 4.12 1.15 1.15 ! nc
assign ( resid 23 and name H5 )( resid 22 and name H1' ) 3.54 1.16 1.16 ! ub=4.7
assign ( resid 23 and name H5 )( resid 22 and name H3' ) 3.65 1.60 1.60 ! ub+2
assign ( resid 23 and name H6 )( resid 23 and name H3' ) 3.80 1.24 1.25 ! ub+0.5
assign ( resid 23 and name H1' )( resid 24 and name H4' ) 5.00 0.20 0.20 ! gen
assign ( resid 24 and name H8 )( resid 24 and name H3' ) 3.79 0.96 0.96 ! ub+0.5
assign ( resid 24 and name H8 )( resid 24 and name H4' ) 4.11 1.43 1.42 ! ub+1
assign ( resid 24 and name H1' )( resid 25 and name H4' ) 5.00 0.20 0.20 ! gen
assign ( resid 25 and name H5 )( resid 24 and name H3' ) 4.55 1.53 1.53 ! ub+1
assign ( resid 25 and name H6 )( resid 25 and name H1' ) 3.00 0.90 0.90 ! ub+0.5
assign ( resid 25 and name H5 )( resid 25 and name H2' ) 3.37 1.37 1.37 ! ub+1.5
! assign ( resid 25 and name H5 )( resid 25 and name H2'' ) 3.71 0.62 0.62 ! OFF
! assign ( resid 25 and name H5 )( resid 25 and name H3' ) 3.09 0.88 0.88 ! OFF
assign ( resid 25 and name H1' )( resid 25 and name H3' ) 2.88 0.91 0.92 ! ub+1
assign ( resid 26 and name H8 )( resid 25 and name H1' ) 3.40 0.77 0.77 ! nc
assign ( resid 26 and name H8 )( resid 25 and name H2' ) 3.49 0.49 0.48 ! ub+0.5
assign ( resid 26 and name H8 )( resid 26 and name H1' ) 3.27 0.82 0.82 ! nc
assign ( resid 26 and name H8 )( resid 26 and name H3' ) 3.24 1.00 1.00 ! ub+0.5
assign ( resid 26 and name H1' )( resid 26 and name H2' ) 2.44 0.56 0.56 ! ub+0.5
assign ( resid 26 and name H1' )( resid 26 and name H2'' ) 2.18 0.16 0.16 ! nc
assign ( resid 26 and name H1' )( resid 26 and name H3' ) 3.47 1.43 1.43 ! ub+1
assign ( resid 26 and name H2' )( resid 26 and name H3' ) 2.41 0.25 0.24 ! nc
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