BMRB

NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype
16783 2ari RC 6867 cing 1-original 4 XPLOR/CNS distance NOE simple


!set wrnlev=0 end
!!!Short range NOEs
!CaH(i)-NH(i+1)
assign (resid    2 and  name HA   )(resid    3 and  name HN   ) 2.24 0.34 0.34
assign (resid    3 and  name HA   )(resid    4 and  name HN   ) 2.04 0.31 0.31
assign ((resid   4 and  name HA1) or
        (resid   4 and  name HA2)) (resid    5 and  name HN   ) 2.74 0.41 0.41
assign ((resid   4 and  name HA1) or
        (resid   4 and  name HA2)) (resid    5 and  name HN   ) 2.52 0.38 0.38
assign (resid    5 and  name HA   )(resid    6 and  name HN   ) 4.0 2.2 1.0    !
assign ((resid   6 and  name HA1) or
        (resid   6 and  name HA2)) (resid    7 and  name HN   ) 3.08 0.46 0.46
assign ((resid   6 and  name HA1) or
        (resid   6 and  name HA2)) (resid    7 and  name HN   ) 2.69 0.40 0.40
assign (resid    7 and  name HA   )(resid    8 and  name HN   ) 4.0 2.2 1.0    !
assign (resid    8 and  name HA   )(resid    9 and  name HN   ) 3.15 0.47 0.47
assign (resid    9 and  name HA   )(resid   10 and  name HN   ) 3.61 0.54 0.54
assign (resid   10 and  name HA   )(resid   11 and  name HN   ) 3.05 0.46 0.46
assign (resid   11 and  name HA#  )(resid   12 and  name HN   ) 3.1 0.5 0.5
assign (resid   12 and  name HA   )(resid   13 and  name HN   ) 3.70 0.56 0.56
assign (resid   13 and  name HA   )(resid   14 and  name HN   ) 4.0 2.2 1.0    !
assign (resid   14 and  name HA#  )(resid   15 and  name HN   ) 2.74 0.41 0.41
assign (resid   15 and  name HA   )(resid   16 and  name HN   ) 3.08 0.46 0.46
assign (resid   16 and  name HA   )(resid   17 and  name HN   ) 3.00 0.45 0.45
assign ((resid  17 and  name HA1) or
        (resid  17 and  name HA2)) (resid   18 and  name HN   ) 2.98 0.45 0.45
assign ((resid  17 and  name HA1) or
        (resid  17 and  name HA2)) (resid   18 and  name HN   ) 4.0 2.2 1.0    !
assign (resid   18 and  name HA   )(resid   19 and  name HN   ) 2.80 0.42 0.42
assign (resid   19 and  name HA   )(resid   20 and  name HN   ) 4.0 2.2 1.0    !
assign (resid   20 and  name HA   )(resid   21 and  name HN   ) 2.64 0.40 0.40
assign (resid   21 and  name HA#  )(resid   22 and  name HN   ) 2.95 0.44 0.44
assign (resid   23 and  name HA   )(resid   24 and  name HN   ) 2.44 0.37 0.37
assign (resid   24 and  name HA   )(resid   25 and  name HN   ) 2.67 0.40 0.40
!NH(i)-NH(i+1)
assign (resid    3 and  name HN   )(resid    4 and  name HN   ) 2.84 0.44 0.44
assign (resid    4 and  name HN   )(resid    5 and  name HN   ) 2.79 0.42 0.42
assign (resid    5 and  name HN   )(resid    6 and  name HN   ) 2.67 0.40 0.40
assign (resid    6 and  name HN   )(resid    7 and  name HN   ) 2.45 0.37 0.37
assign (resid    8 and  name HN   )(resid    9 and  name HN   ) 2.60 0.39 0.39
assign (resid    9 and  name HN   )(resid   10 and  name HN   ) 2.77 0.42 0.42
assign (resid   10 and  name HN   )(resid   11 and  name HN   ) 2.74 0.41 0.41
assign (resid   11 and  name HN   )(resid   12 and  name HN   ) 2.78 0.42 0.42
assign (resid   12 and  name HN   )(resid   13 and  name HN   ) 2.71 0.41 0.41
assign (resid   14 and  name HN   )(resid   15 and  name HN   ) 2.70 0.40 0.40
assign (resid   15 and  name HN   )(resid   16 and  name HN   ) 2.46 0.37 0.37
assign (resid   16 and  name HN   )(resid   17 and  name HN   ) 2.74 0.41 0.41
assign (resid   17 and  name HN   )(resid   18 and  name HN   ) 2.70 0.40 0.40
assign (resid   19 and  name HN   )(resid   20 and  name HN   ) 2.52 0.38 0.38
assign (resid   20 and  name HN   )(resid   21 and  name HN   ) 2.38 0.36 0.36
assign (resid   21 and  name HN   )(resid   22 and  name HN   ) 2.68 0.40 0.40
assign (resid   22 and  name HN   )(resid   23 and  name HN   ) 2.44 0.37 0.37
assign (resid   24 and  name HA   )(resid   25 and  name HN   ) 2.35 0.35 0.35
!CaH(i)-NH(i+2)
assign ((resid    4 and  name HA1) or
        (resid    4 and  name HA2))(resid    6 and  name HN   ) 3.57 0.54 0.54
assign (resid   16 and  name HA   )(resid   18 and  name HN   ) 3.83 0.57 0.57
assign ((resid   17 and  name HA1) or
        (resid   17 and  name HA2))(resid   19 and  name HN   ) 3.18 0.48 0.48
assign (resid   19 and  name HA   )(resid   21 and  name HN   ) 3.86 0.58 0.58 !
assign (resid   23 and  name HA   )(resid   25 and  name HN   ) 3.69 0.55 0.55
! CaH(i)-NH(i+3)
assign (resid    5 and  name HA   )(resid    8 and  name HN   ) 2.93 0.44 0.44 !
assign ((resid    6 and  name HA1) or
        (resid    6 and  name HA2))(resid    9 and  name HN   ) 3.64 0.55 0.55
assign (resid    7 and  name HA   )(resid   10 and  name HN   ) 3.07 0.46 0.46 !
assign (resid    8 and  name HA   )(resid   11 and  name HN   ) 3.15 0.47 0.47
assign (resid    9 and  name HA   )(resid   12 and  name HN   ) 3.26 0.49 0.49
assign (resid   10 and  name HA   )(resid   13 and  name HN   ) 3.39 0.51 0.51
assign (resid   12 and  name HA   )(resid   15 and  name HN   ) 3.53 0.53 0.53
assign (resid   13 and  name HA   )(resid   16 and  name HN   ) 3.31 0.50 0.50
assign (resid   15 and  name HA   )(resid   18 and  name HN   ) 3.44 0.52 0.52
assign (resid   16 and  name HA   )(resid   19 and  name HN   ) 3.59 0.54 0.54
assign (resid   20 and  name HA   )(resid   23 and  name HN   ) 3.86 0.58 0.58
!NH(i)-NH(i+2)
assign (resid    5 and  name HN   )(resid    7 and  name HN   ) 3.55 0.53 0.53
assign (resid    6 and  name HN   )(resid    8 and  name HN   ) 3.59 0.54 0.54
!CbH(i)-NH(i+1)
assign (resid    2 and  name HB#  )(resid    3 and  name HN   ) 2.71 0.41 0.41
assign (resid    3 and  name HB   )(resid    4 and  name HN   ) 3.08 0.46 0.46
assign (resid    3 and  name HB   )(resid    4 and  name HN   ) 3.08 0.46 0.46
assign (resid    5 and  name HB   )(resid    6 and  name HN   ) 2.95 0.44 0.44
assign (resid    8 and  name HB#  )(resid    9 and  name HN   ) 3.00 0.45 0.45 !
assign (resid    9 and  name HB#  )(resid   10 and  name HN   ) 2.58 0.39 0.39
assign (resid   10 and  name HB#  )(resid   11 and  name HN   ) 3.19 0.48 0.48
assign (resid   12 and  name HB#  )(resid   13 and  name HN   ) 2.74 0.41 0.41
assign (resid   13 and  name HB#  )(resid   14 and  name HN   ) 3.28 0.49 0.49
assign (resid   16 and  name HB#  )(resid   17 and  name HN   ) 2.62 0.39 0.39
assign (resid   20 and  name HB#  )(resid   21 and  name HN   ) 3.22 0.48 0.48
assign (resid   23 and  name HB#  )(resid   24 and  name HN   ) 2.65 0.40 0.40
assign (resid   24 and  name HB#  )(resid   25 and  name HN   ) 3.36 0.50 0.50