NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
16415 |
2a36   |
5925 | cing | 1-original | 5 | XPLOR/CNS | dipolar coupling |
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 2 and name N )
( resid 2 and name HN ) 12.44 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 3 and name N )
( resid 3 and name HN ) 6.15 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 4 and name N )
( resid 4 and name HN ) 1.95 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 5 and name N )
( resid 5 and name HN ) -6.84 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 6 and name N )
( resid 6 and name HN ) 0.86 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 7 and name N )
( resid 7 and name HN ) -4.71 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 8 and name N )
( resid 8 and name HN ) -11.09 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 9 and name N )
( resid 9 and name HN ) -9.90 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 10 and name N )
( resid 10 and name HN ) -12.54 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 11 and name N )
( resid 11 and name HN ) -5.74 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 12 and name N )
( resid 12 and name HN ) 5.62 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 13 and name N )
( resid 13 and name HN ) 10.56 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 14 and name N )
( resid 14 and name HN ) 9.33 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 15 and name N )
( resid 15 and name HN ) -5.16 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 16 and name N )
( resid 16 and name HN ) 10.12 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 17 and name N )
( resid 17 and name HN ) 3.76 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 18 and name N )
( resid 18 and name HN ) -1.51 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 19 and name N )
( resid 19 and name HN ) -12.55 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 20 and name N )
( resid 20 and name HN ) -10.79 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 21 and name N )
( resid 21 and name HN ) -1.82 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 22 and name N )
( resid 22 and name HN ) -1.69 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 23 and name N )
( resid 23 and name HN ) -0.06 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 24 and name N )
( resid 24 and name HN ) -3.24 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 26 and name N )
( resid 26 and name HN ) 12.83 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 27 and name N )
( resid 27 and name HN ) 13.40 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 28 and name N )
( resid 28 and name HN ) 0.74 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 29 and name N )
( resid 29 and name HN ) -9.51 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 30 and name N )
( resid 30 and name HN ) -2.33 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 31 and name N )
( resid 31 and name HN ) -5.17 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 32 and name N )
( resid 32 and name HN ) -4.65 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 33 and name N )
( resid 33 and name HN ) -0.71 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 34 and name N )
( resid 34 and name HN ) -1.87 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 35 and name N )
( resid 35 and name HN ) 5.45 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 36 and name N )
( resid 36 and name HN ) -1.58 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 37 and name N )
( resid 37 and name HN ) -4.59 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 38 and name N )
( resid 38 and name HN ) 6.56 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 40 and name N )
( resid 40 and name HN ) 15.93 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 41 and name N )
( resid 41 and name HN ) 12.74 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 42 and name N )
( resid 42 and name HN ) 14.81 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 44 and name N )
( resid 44 and name HN ) 2.43 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 45 and name N )
( resid 45 and name HN ) 9.34 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 47 and name N )
( resid 47 and name HN ) 15.64 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 48 and name N )
( resid 48 and name HN ) 0.63 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 50 and name N )
( resid 50 and name HN ) 3.64 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 51 and name N )
( resid 51 and name HN ) 12.15 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 52 and name N )
( resid 52 and name HN ) -1.87 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 53 and name N )
( resid 53 and name HN ) -1.28 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 54 and name N )
( resid 54 and name HN ) -2.74 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 55 and name N )
( resid 55 and name HN ) -6.97 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 56 and name N )
( resid 56 and name HN ) 1.18 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 57 and name N )
( resid 57 and name HN ) -4.16 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 58 and name N )
( resid 58 and name HN ) -1.25 0.39
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 59 and name N )
( resid 59 and name HN ) -0.51 0.39
#
# N-CO RDC
#
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 2 and name N )
( resid 1 and name C ) -1.30 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 3 and name N )
( resid 2 and name C ) 1.69 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 4 and name N )
( resid 3 and name C ) -10.98 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 5 and name N )
( resid 4 and name C ) 5.69 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 6 and name N )
( resid 5 and name C ) -8.17 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 7 and name N )
( resid 6 and name C ) 13.95 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 8 and name N )
( resid 7 and name C ) 4.10 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 9 and name N )
( resid 8 and name C ) -1.07 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 10 and name N )
( resid 9 and name C ) 3.53 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 11 and name N )
( resid 10 and name C ) -7.99 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 12 and name N )
( resid 11 and name C ) -0.60 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 13 and name N )
( resid 12 and name C ) -9.32 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 14 and name N )
( resid 13 and name C ) -0.77 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 15 and name N )
( resid 14 and name C ) 0.43 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 16 and name N )
( resid 15 and name C ) -9.50 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 17 and name N )
( resid 16 and name C ) 12.46 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 18 and name N )
( resid 17 and name C ) 0.18 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 19 and name N )
( resid 18 and name C ) -3.61 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 20 and name N )
( resid 19 and name C ) 9.04 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 21 and name N )
( resid 20 and name C ) -9.27 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 22 and name N )
( resid 21 and name C ) 11.29 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 23 and name N )
( resid 22 and name C ) 13.19 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 26 and name N )
( resid 25 and name C ) -6.72 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 27 and name N )
( resid 26 and name C ) 8.32 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 28 and name N )
( resid 27 and name C ) 10.68 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 29 and name N )
( resid 28 and name C ) -7.33 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 30 and name N )
( resid 29 and name C ) 5.93 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 31 and name N )
( resid 30 and name C ) -3.35 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 32 and name N )
( resid 31 and name C ) 7.54 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 33 and name N )
( resid 32 and name C ) 1.79 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 34 and name N )
( resid 33 and name C ) 0.55 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 35 and name N )
( resid 34 and name C ) 7.55 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 36 and name N )
( resid 35 and name C ) -7.61 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 37 and name N )
( resid 36 and name C ) 0.58 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 38 and name N )
( resid 37 and name C ) -13.86 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 40 and name N )
( resid 39 and name C ) 1.28 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 41 and name N )
( resid 40 and name C ) 6.61 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 42 and name N )
( resid 41 and name C ) -3.29 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 44 and name N )
( resid 43 and name C ) -13.73 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 45 and name N )
( resid 44 and name C ) 1.54 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 47 and name N )
( resid 46 and name C ) -6.24 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 48 and name N )
( resid 47 and name C ) 8.26 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 50 and name N )
( resid 49 and name C ) 0.76 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 51 and name N )
( resid 50 and name C ) -9.00 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 52 and name N )
( resid 51 and name C ) -2.25 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 53 and name N )
( resid 52 and name C ) 1.27 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 54 and name N )
( resid 53 and name C ) 9.90 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 55 and name N )
( resid 54 and name C ) 0.64 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 56 and name N )
( resid 55 and name C ) -8.30 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 57 and name N )
( resid 56 and name C ) 4.16 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 58 and name N )
( resid 57 and name C ) -3.62 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 59 and name N )
( resid 58 and name C ) -0.10 0.50
#
# CO-CA RDC
#
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 1 and name C )
( resid 1 and name CA ) -3.78 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 2 and name C )
( resid 2 and name CA ) -14.60 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 3 and name C )
( resid 3 and name CA ) -4.40 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 4 and name C )
( resid 4 and name CA ) -3.76 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 5 and name C )
( resid 5 and name CA ) -11.18 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 6 and name C )
( resid 6 and name CA ) -3.63 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 7 and name C )
( resid 7 and name CA ) 2.50 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 8 and name C )
( resid 8 and name CA ) -0.00 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 9 and name C )
( resid 9 and name CA ) -0.90 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 10 and name C )
( resid 10 and name CA ) 7.61 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 11 and name C )
( resid 11 and name CA ) 6.22 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 12 and name C )
( resid 12 and name CA ) 0.87 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 13 and name C )
( resid 13 and name CA ) -10.69 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 14 and name C )
( resid 14 and name CA ) -0.24 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 15 and name C )
( resid 15 and name CA ) 8.82 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 16 and name C )
( resid 16 and name CA ) -0.21 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 17 and name C )
( resid 17 and name CA ) -3.11 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 18 and name C )
( resid 18 and name CA ) 5.53 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 19 and name C )
( resid 19 and name CA ) -6.92 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 20 and name C )
( resid 20 and name CA ) 7.71 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 21 and name C )
( resid 21 and name CA ) -2.56 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 22 and name C )
( resid 22 and name CA ) -18.19 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 23 and name C )
( resid 23 and name CA ) -3.21 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 25 and name C )
( resid 25 and name CA ) -6.93 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 26 and name C )
( resid 26 and name CA ) 2.93 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 27 and name C )
( resid 27 and name CA ) -7.70 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 28 and name C )
( resid 28 and name CA ) 6.17 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 29 and name C )
( resid 29 and name CA ) -11.77 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 30 and name C )
( resid 30 and name CA ) -2.59 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 31 and name C )
( resid 31 and name CA ) -2.35 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 32 and name C )
( resid 32 and name CA ) -8.55 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 33 and name C )
( resid 33 and name CA ) 7.00 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 34 and name C )
( resid 34 and name CA ) 2.38 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 35 and name C )
( resid 35 and name CA ) 0.73 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 36 and name C )
( resid 36 and name CA ) -17.58 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 37 and name C )
( resid 37 and name CA ) -3.94 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 38 and name C )
( resid 38 and name CA ) 7.79 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 39 and name C )
( resid 39 and name CA ) -3.38 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 40 and name C )
( resid 40 and name CA ) 0.38 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 41 and name C )
( resid 41 and name CA ) 0.44 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 43 and name C )
( resid 43 and name CA ) 0.81 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 44 and name C )
( resid 44 and name CA ) 3.25 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 45 and name C )
( resid 45 and name CA ) -12.67 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 46 and name C )
( resid 46 and name CA ) -6.11 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 47 and name C )
( resid 47 and name CA ) -9.26 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 49 and name C )
( resid 49 and name CA ) 18.78 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 50 and name C )
( resid 50 and name CA ) -2.05 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 51 and name C )
( resid 51 and name CA ) 0.11 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 52 and name C )
( resid 52 and name CA ) -4.49 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 53 and name C )
( resid 53 and name CA ) 5.10 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 54 and name C )
( resid 54 and name CA ) -8.49 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 55 and name C )
( resid 55 and name CA ) 10.62 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 56 and name C )
( resid 56 and name CA ) 7.87 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 57 and name C )
( resid 57 and name CA ) 2.52 0.53
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 58 and name C )
( resid 58 and name CA ) 2.47 0.53
#
# CA-HA RDC
#
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 1 and name CA )
( resid 1 and name HA ) 12.33 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 2 and name CA )
( resid 2 and name HA ) 14.41 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 3 and name CA )
( resid 3 and name HA ) 12.52 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 4 and name CA )
( resid 4 and name HA ) -3.50 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 5 and name CA )
( resid 5 and name HA ) -0.68 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 7 and name CA )
( resid 7 and name HA ) -2.42 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 8 and name CA )
( resid 8 and name HA ) -12.68 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 9 and name CA )
( resid 9 and name HA ) -13.16 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 10 and name CA )
( resid 10 and name HA ) -13.06 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 11 and name CA )
( resid 11 and name HA ) 3.45 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 12 and name CA )
( resid 12 and name HA ) 1.96 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 13 and name CA )
( resid 13 and name HA ) 14.03 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 14 and name CA )
( resid 14 and name HA ) -0.43 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 15 and name CA )
( resid 15 and name HA ) -12.41 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 16 and name CA )
( resid 16 and name HA ) 9.88 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 17 and name CA )
( resid 17 and name HA ) 5.64 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 18 and name CA )
( resid 18 and name HA ) -10.62 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 19 and name CA )
( resid 19 and name HA ) -7.29 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 21 and name CA )
( resid 21 and name HA ) -0.31 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 25 and name CA )
( resid 25 and name HA ) 2.41 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 26 and name CA )
( resid 26 and name HA ) 14.42 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 27 and name CA )
( resid 27 and name HA ) 9.57 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 29 and name CA )
( resid 29 and name HA ) 6.26 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 30 and name CA )
( resid 30 and name HA ) -0.36 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 31 and name CA )
( resid 31 and name HA ) -3.11 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 32 and name CA )
( resid 32 and name HA ) 2.22 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 33 and name CA )
( resid 33 and name HA ) -3.28 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 34 and name CA )
( resid 34 and name HA ) -2.04 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 35 and name CA )
( resid 35 and name HA ) 7.76 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 36 and name CA )
( resid 36 and name HA ) -2.55 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 37 and name CA )
( resid 37 and name HA ) -2.37 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 38 and name CA )
( resid 38 and name HA ) 7.05 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 39 and name CA )
( resid 39 and name HA ) 6.10 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 40 and name CA )
( resid 40 and name HA ) 15.75 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 44 and name CA )
( resid 44 and name HA ) 0.53 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 47 and name CA )
( resid 47 and name HA ) 7.24 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 49 and name CA )
( resid 49 and name HA ) 0.49 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 50 and name CA )
( resid 50 and name HA ) -8.74 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 51 and name CA )
( resid 51 and name HA ) 13.60 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 52 and name CA )
( resid 52 and name HA ) -10.94 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 53 and name CA )
( resid 53 and name HA ) -3.40 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 54 and name CA )
( resid 54 and name HA ) -3.21 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 55 and name CA )
( resid 55 and name HA ) 1.43 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 56 and name CA )
( resid 56 and name HA ) -5.90 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 57 and name CA )
( resid 57 and name HA ) -2.27 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 58 and name CA )
( resid 58 and name HA ) -2.09 0.30
#
# CA-CB RDC
#
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 1 and name CA )
( resid 1 and name CB ) -0.25 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 2 and name CA )
( resid 2 and name CB ) 1.00 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 3 and name CA )
( resid 3 and name CB ) 5.79 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 4 and name CA )
( resid 4 and name CB ) 11.68 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 5 and name CA )
( resid 5 and name CB ) 12.75 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 7 and name CA )
( resid 7 and name CB ) -0.16 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 8 and name CA )
( resid 8 and name CB ) 2.95 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 9 and name CA )
( resid 9 and name CB ) -1.24 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 10 and name CA )
( resid 10 and name CB ) 7.68 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 11 and name CA )
( resid 11 and name CB ) -14.30 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 12 and name CA )
( resid 12 and name CB ) -9.10 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 13 and name CA )
( resid 13 and name CB ) 2.46 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 14 and name CA )
( resid 14 and name CB ) 6.66 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 15 and name CA )
( resid 15 and name CB ) -2.24 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 16 and name CA )
( resid 16 and name CB ) -16.95 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 17 and name CA )
( resid 17 and name CB ) 7.10 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 18 and name CA )
( resid 18 and name CB ) 7.61 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 19 and name CA )
( resid 19 and name CB ) 9.39 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 21 and name CA )
( resid 21 and name CB ) -9.45 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 22 and name CA )
( resid 22 and name CB ) 1.11 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 23 and name CA )
( resid 23 and name CB ) 7.68 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 25 and name CA )
( resid 25 and name CB ) -4.81 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 26 and name CA )
( resid 26 and name CB ) -6.09 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 27 and name CA )
( resid 27 and name CB ) -0.86 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 29 and name CA )
( resid 29 and name CB ) 9.92 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 30 and name CA )
( resid 30 and name CB ) 5.56 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 31 and name CA )
( resid 31 and name CB ) -0.31 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 32 and name CA )
( resid 32 and name CB ) 4.66 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 33 and name CA )
( resid 33 and name CB ) 7.45 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 34 and name CA )
( resid 34 and name CB ) -2.38 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 35 and name CA )
( resid 35 and name CB ) -2.58 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 36 and name CA )
( resid 36 and name CB ) 17.19 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 37 and name CA )
( resid 37 and name CB ) 15.91 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 38 and name CA )
( resid 38 and name CB ) -5.41 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 39 and name CA )
( resid 39 and name CB ) -8.67 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 40 and name CA )
( resid 40 and name CB ) -12.07 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 44 and name CA )
( resid 44 and name CB ) -4.22 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 47 and name CA )
( resid 47 and name CB ) 3.53 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 49 and name CA )
( resid 49 and name CB ) -10.46 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 50 and name CA )
( resid 50 and name CB ) 0.17 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 51 and name CA )
( resid 51 and name CB ) -8.14 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 52 and name CA )
( resid 52 and name CB ) 13.64 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 53 and name CA )
( resid 53 and name CB ) -10.35 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 54 and name CA )
( resid 54 and name CB ) 2.22 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 55 and name CA )
( resid 55 and name CB ) 0.13 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 56 and name CA )
( resid 56 and name CB ) -4.31 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 57 and name CA )
( resid 57 and name CB ) -2.25 0.30
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 58 and name CA )
( resid 58 and name CB ) -4.60 0.30
#
# Carbonyl chemical shift anisotropy constraints
#
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 1 and name N )
( resid 0 and name C )
( resid 0 and name O ) 73.333 73.333 40 39.11 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 2 and name N )
( resid 1 and name C )
( resid 1 and name O ) 73.333 73.333 40 -20.84 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 3 and name N )
( resid 2 and name C )
( resid 2 and name O ) 73.333 73.333 40 -35.70 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 4 and name N )
( resid 3 and name C )
( resid 3 and name O ) 73.333 73.333 40 9.12 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 5 and name N )
( resid 4 and name C )
( resid 4 and name O ) 73.333 73.333 40 -71.60 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 6 and name N )
( resid 5 and name C )
( resid 5 and name O ) 73.333 73.333 40 14.86 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 7 and name N )
( resid 6 and name C )
( resid 6 and name O ) 73.333 73.333 40 53.11 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 8 and name N )
( resid 7 and name C )
( resid 7 and name O ) 73.333 73.333 40 -16.46 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 9 and name N )
( resid 8 and name C )
( resid 8 and name O ) 73.333 73.333 40 39.64 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 10 and name N )
( resid 9 and name C )
( resid 9 and name O ) 73.333 73.333 40 -58.15 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 11 and name N )
( resid 10 and name C )
( resid 10 and name O ) 73.333 73.333 40 12.04 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 12 and name N )
( resid 11 and name C )
( resid 11 and name O ) 73.333 73.333 40 2.05 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 13 and name N )
( resid 12 and name C )
( resid 12 and name O ) 73.333 73.333 40 -18.69 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 14 and name N )
( resid 13 and name C )
( resid 13 and name O ) 73.333 73.333 40 31.08 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 15 and name N )
( resid 14 and name C )
( resid 14 and name O ) 73.333 73.333 40 23.72 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 16 and name N )
( resid 15 and name C )
( resid 15 and name O ) 73.333 73.333 40 47.93 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 17 and name N )
( resid 16 and name C )
( resid 16 and name O ) 73.333 73.333 40 -60.40 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 18 and name N )
( resid 17 and name C )
( resid 17 and name O ) 73.333 73.333 40 17.35 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 19 and name N )
( resid 18 and name C )
( resid 18 and name O ) 73.333 73.333 40 -29.43 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 20 and name N )
( resid 19 and name C )
( resid 19 and name O ) 73.333 73.333 40 11.52 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 21 and name N )
( resid 20 and name C )
( resid 20 and name O ) 73.333 73.333 40 20.03 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 22 and name N )
( resid 21 and name C )
( resid 21 and name O ) 73.333 73.333 40 -11.74 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 23 and name N )
( resid 22 and name C )
( resid 22 and name O ) 73.333 73.333 40 -51.08 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 25 and name N )
( resid 24 and name C )
( resid 24 and name O ) 73.333 73.333 40 -17.67 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 26 and name N )
( resid 25 and name C )
( resid 25 and name O ) 73.333 73.333 40 29.49 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 27 and name N )
( resid 26 and name C )
( resid 26 and name O ) 73.333 73.333 40 5.53 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 28 and name N )
( resid 27 and name C )
( resid 27 and name O ) 73.333 73.333 40 -47.32 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 29 and name N )
( resid 28 and name C )
( resid 28 and name O ) 73.333 73.333 40 -31.22 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 30 and name N )
( resid 29 and name C )
( resid 29 and name O ) 73.333 73.333 40 -16.38 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 31 and name N )
( resid 30 and name C )
( resid 30 and name O ) 73.333 73.333 40 23.29 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 32 and name N )
( resid 31 and name C )
( resid 31 and name O ) 73.333 73.333 40 -34.16 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 33 and name N )
( resid 32 and name C )
( resid 32 and name O ) 73.333 73.333 40 10.52 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 34 and name N )
( resid 33 and name C )
( resid 33 and name O ) 73.333 73.333 40 20.01 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 35 and name N )
( resid 34 and name C )
( resid 34 and name O ) 73.333 73.333 40 -45.17 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 36 and name N )
( resid 35 and name C )
( resid 35 and name O ) 73.333 73.333 40 -43.93 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 37 and name N )
( resid 36 and name C )
( resid 36 and name O ) 73.333 73.333 40 -54.56 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 38 and name N )
( resid 37 and name C )
( resid 37 and name O ) 73.333 73.333 40 34.57 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 39 and name N )
( resid 38 and name C )
( resid 38 and name O ) 73.333 73.333 40 -3.26 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 40 and name N )
( resid 39 and name C )
( resid 39 and name O ) 73.333 73.333 40 42.76 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 41 and name N )
( resid 40 and name C )
( resid 40 and name O ) 73.333 73.333 40 15.20 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 43 and name N )
( resid 42 and name C )
( resid 42 and name O ) 73.333 73.333 40 -21.45 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 44 and name N )
( resid 43 and name C )
( resid 43 and name O ) 73.333 73.333 40 -0.97 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 45 and name N )
( resid 44 and name C )
( resid 44 and name O ) 73.333 73.333 40 14.67 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 46 and name N )
( resid 45 and name C )
( resid 45 and name O ) 73.333 73.333 40 -12.35 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 47 and name N )
( resid 46 and name C )
( resid 46 and name O ) 73.333 73.333 40 -9.91 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 49 and name N )
( resid 48 and name C )
( resid 48 and name O ) 73.333 73.333 40 70.92 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 50 and name N )
( resid 49 and name C )
( resid 49 and name O ) 73.333 73.333 40 -39.03 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 51 and name N )
( resid 50 and name C )
( resid 50 and name O ) 73.333 73.333 40 -20.93 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 52 and name N )
( resid 51 and name C )
( resid 51 and name O ) 73.333 73.333 40 -2.35 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 53 and name N )
( resid 52 and name C )
( resid 52 and name O ) 73.333 73.333 40 60.78 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 54 and name N )
( resid 53 and name C )
( resid 53 and name O ) 73.333 73.333 40 -46.48 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 55 and name N )
( resid 54 and name C )
( resid 54 and name O ) 73.333 73.333 40 -8.85 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 56 and name N )
( resid 55 and name C )
( resid 55 and name O ) 73.333 73.333 40 12.52 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 57 and name N )
( resid 56 and name C )
( resid 56 and name O ) 73.333 73.333 40 -16.45 10
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 58 and name N )
( resid 57 and name C )
( resid 57 and name O ) 73.333 73.333 40 22.51 10
Contact the webmaster for help, if required. Sunday, May 12, 2024 8:20:27 PM GMT (wattos1)