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
8673 1mot 5607 cing 1-original 1 XPLOR/CNS distance NOE simple


! pck2xplr.nawk Table; Input File: 28mer_3dnoesy.PCK
!   Date: Wed May 15 16:23:25 EDT 2002
!   Path: /quantum/people/pravat/NMR/CHEM_600/glyR_28mer/SDS/spectra
!
!@ BEGIN_XPLR_PCK_SUM
! LBL   File-Name                   All   Intra  Seq.  Short   Long
! A   28mer_3dnoesy.PCK             120    41     67     12      0
!    Total                          120    41     67     12      0

!@ END_XPLR_PCK_SUM
!@ BEGIN_XPLR_NOE_FILE
!
! A1

! P2
assign (resid   2 and name   HA ) (resid   3 and name   HN )  2.5  0.7  0.4 ! A.1    at 3.64e+07
assign (resid   2 and name  HB# ) (resid   3 and name   HN )  4.0  2.2  1.0 ! A.4    at 2.82e+06

! A3
assign (resid   3 and name  HB# ) (resid   3 and name   HN )  2.5  0.7  0.9 ! A.3    at 3.11e+07
assign (resid   3 and name   HN ) (resid   4 and name   HN )  4.0  2.2  1.0 ! A.12   at 4.78e+06
assign (resid   3 and name  HB# ) (resid   4 and name   HN )  3.0  1.2  1.0 ! A.14   at 8.31e+06
assign (resid   3 and name  HB# ) (resid   5 and name   HN )  4.0  2.2  1.5 ! A.25   at 1.24e+06

! R4
assign (resid   4 and name  HD# ) (resid   4 and name   HN )  4.0  2.2  1.5 ! A.283  at 1.08e+06
assign (resid   4 and name  HG# ) (resid   4 and name   HN )  4.0  2.2  1.5 ! A.261  at 1.40e+06
assign (resid   4 and name  HB# ) (resid   4 and name   HN )  2.5  0.7  0.4 ! A.259  at 1.29e+07
assign (resid   4 and name   HA ) (resid   5 and name   HN )  3.0  1.2  0.5 ! A.21   at 9.83e+06
assign (resid   4 and name   HN ) (resid   5 and name   HN )  3.0  1.2  0.5 ! A.11   at 7.58e+06
assign (resid   4 and name  HB# ) (resid   5 and name   HN )  4.0  2.2  1.0 ! A.23   at 4.90e+06
assign (resid   4 and name   HA ) (resid   6 and name   HN )  4.0  2.2  2.0 ! A.36   at 1.86e+06

! V5
assign (resid   5 and name  HG* ) (resid   5 and name   HN )  2.5  0.7  0.9 ! A.26   at 1.35e+07
assign (resid   5 and name   HB ) (resid   5 and name   HN )  3.0  1.2  0.5 ! A.22   at 1.33e+07
assign (resid   5 and name   HN ) (resid   6 and name   HN )  3.0  1.2  0.5 ! A.29   at 8.59e+06
assign (resid   5 and name  HG* ) (resid   6 and name   HN )  4.0  2.2  1.5 ! A.262  at 4.46e+06
assign (resid   5 and name   HB ) (resid   6 and name   HN )  3.0  1.2  0.5 ! A.32   at 8.59e+06
assign (resid   5 and name   HA ) (resid   6 and name   HN )  3.0  1.2  0.5 ! A.34   at 1.61e+07!
assign (resid   5 and name   HN ) (resid   7 and name   HN )  4.0  2.2  1.0 ! A.41   at 1.45e+06

! G6
assign (resid   6 and name   HN ) (resid   7 and name   HN )  3.0  1.2  0.5 ! A.30   at 6.87e+06
assign (resid   6 and name  HA# ) (resid   7 and name   HN )  4.0  2.2  1.0 ! A.42   at 5.16e+06

! L7
assign (resid   7 and name  HB# ) (resid   7 and name   HN )  2.5  0.7  0.4 ! A.47   at 1.09e+07
assign (resid   7 and name  HD# ) (resid   7 and name   HN )  4.0  2.2  1.5 ! A.46   at 3.40e+06
assign (resid   7 and name   HN ) (resid   8 and name   HN )  3.0  1.2  0.5 ! A.49   at 9.02e+06
assign (resid   7 and name  HB# ) (resid   8 and name   HN )  4.0  2.2  1.0 ! A.54   at 4.52e+06
assign (resid   7 and name  HD# ) (resid   8 and name   HN )  4.0  2.2  1.5 ! A.53   at 2.72e+06
assign (resid   7 and name   HA ) (resid   8 and name   HN )  4.0  2.2  1.0 ! A.51   at 5.11e+06

! G8
assign (resid   8 and name  HA# ) (resid   9 and name   HN )  3.0  1.2  0.5 ! A.60   at 8.41e+06
assign (resid   8 and name   HN ) (resid   9 and name   HN )  2.5  0.7  0.4 ! A.58   at 1.34e+07

! I9
!assign (resid   9 and name HG1# ) (resid   9 and name   HN )  2.5  0.7  0.4 ! A.235  at 1.09e+07
!assign (resid   9 and name   HB ) (resid   9 and name   HN )  2.5  0.7  0.4 ! A.67   at 1.66e+07!
!assign (resid   9 and name HD1# ) (resid   9 and name   HN )  3.0  1.2  1.0 ! A.263  at 6.46e+06
assign (resid   9 and name   HN ) (resid  10 and name   HN )  3.0  1.2  0.5 ! A.69   at 8.00e+06
assign (resid   9 and name  HG# ) (resid  10 and name   HN )  4.0  2.2  1.0 ! A.221  at 1.38e+06
assign (resid   9 and name   HA ) (resid  10 and name   HN )  4.0  2.2  1.0 ! A.224  at 3.54e+06
assign (resid   9 and name   HB ) (resid  10 and name   HN )  4.0  2.2  1.0 ! A.77   at 8.07e+06!
assign (resid   9 and name HD1# ) (resid  10 and name   HN )  4.0  2.2  1.5 ! A.264  at 5.13e+06
assign (resid   9 and name   HA ) (resid  11 and name   HN )  4.0  2.2  1.0 ! A.87   at 1.27e+06

! T10
!assign (resid  10 and name   HB ) (resid  10 and name   HN )  2.5  0.7  0.4 ! A.222  at 1.12e+07
!assign (resid  10 and name HG2# ) (resid  10 and name   HN )  3.0  1.2  1.0 ! A.282  at 7.80e+06
assign (resid  10 and name   HB ) (resid  11 and name   HN )  4.0  2.2  1.0 ! A.85   at 4.74e+06
assign (resid  10 and name   HN ) (resid  11 and name   HN )  3.0  1.2  0.5 ! A.72   at 5.72e+06
assign (resid  10 and name   HA ) (resid  13 and name   HN )  4.0  2.2  2.0 ! A.107  at 1.35e+06!

! T11
!assign (resid  11 and name   HB ) (resid  11 and name   HN )  3.0  1.2  0.5 ! A.84   at 9.14e+06
!assign (resid  11 and name  HG# ) (resid  11 and name   HN )  3.0  1.2  1.0 ! A.88   at 5.58e+06
assign (resid  11 and name HG2# ) (resid  12 and name   HN )  4.0  2.2  2.5 ! A.102  at 3.21e+06
assign (resid  11 and name   HB ) (resid  12 and name   HN )  4.0  2.2  1.0 ! A.95   at 7.98e+06!
assign (resid  11 and name   HA ) (resid  12 and name   HN )  4.0  2.2  1.0 ! A.96   at 3.38e+06
assign (resid  11 and name   HN ) (resid  12 and name  HG# )  4.0  2.2  2.0 ! A.91   at 1.39e+06
assign (resid  11 and name   HA ) (resid  14 and name   HN )  4.0  2.2  2.0 ! A.280  at 7.40e+05

! V12
!assign (resid  12 and name   HB ) (resid  12 and name   HN )  2.5  0.7  0.4 ! A.98   at 1.18e+07
!assign (resid  12 and name  HG# ) (resid  12 and name   HN )  4.0  2.2  1.0 ! A.100  at 4.91e+06
assign (resid  12 and name   HN ) (resid  13 and name   HN )  3.0  1.2  0.5 ! A.104  at 7.02e+06
assign (resid  12 and name   HN ) (resid  13 and name  HB# )  4.0  2.2  1.5 ! A.266  at 1.46e+06
assign (resid  12 and name  HG# ) (resid  13 and name   HN )  4.0  2.2  1.0 ! A.112  at 2.22e+06
assign (resid  12 and name   HB ) (resid  13 and name   HN )  3.0  1.2  0.5 ! A.109  at 6.44e+06
assign (resid  12 and name   HA ) (resid  13 and name   HN )  4.0  2.2  1.0 ! A.108  at 3.42e+06
assign (resid  12 and name  HG# ) (resid  15 and name   HN )  4.0  2.2  2.0 ! A.145  at 8.74e+05
assign (resid  12 and name   HA ) (resid  15 and name   HN )  4.0  2.2  1.0 ! A.137  at 2.89e+06
assign (resid  12 and name   HA ) (resid  16 and name   HN )  4.0  2.2  2.0 ! A.230  at 6.83e+05

! L13
!assign (resid  13 and name  HD# ) (resid  13 and name   HN )  4.0  2.2  1.5 ! A.113  at 3.43e+06
!assign (resid  13 and name   HG ) (resid  13 and name   HN )  4.0  2.2  1.0 ! A.111  at 4.02e+06
assign (resid  13 and name  HB# ) (resid  13 and name   HN )  2.5  0.7  0.9 ! A.110  at 1.50e+07
assign (resid  13 and name   HN ) (resid  14 and name   HN )  3.0  1.2  0.5 ! A.125  at 5.50e+06
assign (resid  13 and name   HG ) (resid  14 and name   HN )  4.0  2.2  1.0 ! A.132  at 2.14e+06
assign (resid  13 and name  HB# ) (resid  14 and name   HN )  4.0  2.2  1.5 ! A.131  at 3.45e+06
assign (resid  13 and name  HD# ) (resid  14 and name   HN )  4.0  2.2  1.5 ! A.281  at 1.19e+06
assign (resid  13 and name   HA ) (resid  14 and name   HN )  4.0  2.2  1.0 ! A.130  at 1.17e+06
assign (resid  13 and name   HN ) (resid  15 and name   HN )  4.0  2.2  1.0 ! A.217  at 1.25e+06
assign (resid  13 and name   HA ) (resid  16 and name   HN )  4.0  2.2  1.0 ! A.231  at 1.29e+06

! T14
!assign (resid  14 and name   HB ) (resid  14 and name   HN )  3.0  1.2  0.5 ! A.128  at 7.26e+06
!assign (resid  14 and name HG2# ) (resid  14 and name   HN )  3.0  1.2  1.0 ! A.133  at 6.78e+06
assign (resid  14 and name   HN ) (resid  15 and name   HN )  3.0  1.2  0.5 ! A.126  at 8.12e+06
assign (resid  14 and name   HB ) (resid  15 and name   HN )  2.5  0.7  0.4 ! A.140  at 1.86e+07
assign (resid  14 and name   HA ) (resid  15 and name   HN )  4.0  2.2  1.0 ! A.138  at 2.75e+06
assign (resid  14 and name HG2# ) (resid  15 and name   HN )  3.0  1.2  1.0 ! A.144  at 5.87e+06
assign (resid  14 and name   HA ) (resid  16 and name   HN )  4.0  2.2  2.0 ! A.232  at 6.86e+05

! M15
assign (resid  15 and name  HB# ) (resid  15 and name   HN )  2.5  0.7  0.9 ! A.143  at 1.30e+07
assign (resid  15 and name  HG# ) (resid  15 and name   HN )  4.0  2.2  1.0 ! A.142  at 3.52e+06
assign (resid  15 and name  HB# ) (resid  16 and name   HN )  4.0  2.2  1.5 ! A.152  at 4.04e+06

! T16
assign (resid  16 and name HG2# ) (resid  16 and name   HN )  2.5  0.7  0.9 ! A.153  at 1.08e+07
assign (resid  16 and name   HB ) (resid  16 and name   HN )  2.5  0.7  0.4 ! A.284  at 1.56e+07

! T17
assign (resid  17 and name   HB ) (resid  17 and name   HN )  2.5  0.7  0.4 ! A.155  at 1.81e+07
assign (resid  17 and name HG2# ) (resid  17 and name   HN )  2.5  0.7  0.9 ! A.156  at 1.06e+07
assign (resid  17 and name HG2# ) (resid  18 and name   HN )  4.0  2.2  1.5 ! A.164  at 1.88e+06
assign (resid  17 and name   HN ) (resid  18 and name  HB# )  4.0  2.2  2.0 ! A.270  at 9.04e+05

! Q18
assign (resid  18 and name  HG# ) (resid  18 and name   HN )  4.0  2.2  1.5 ! A.161  at 3.45e+06
assign (resid  18 and name  HB# ) (resid  18 and name   HN )  4.0  2.2  1.0 ! A.163  at 2.21e+06
assign (resid  18 and name  HB# ) (resid  19 and name   HN )  4.0  2.2  2.0 ! A.240  at 9.61e+05
assign (resid  18 and name   HA ) (resid  19 and name   HN )  3.0  1.2  0.5 ! A.166  at 6.17e+06

! S19
assign (resid  19 and name  HB# ) (resid  19 and name   HN )  4.0  2.2  1.5 ! A.165  at 4.89e+06
assign (resid  19 and name   HN ) (resid  20 and name   HN )  4.0  2.2  1.0 ! A.243  at 1.88e+06

! S20
assign (resid  20 and name  HB# ) (resid  20 and name   HN )  3.0  1.2  1.0 ! A.170  at 8.74e+06
assign (resid  20 and name  HB# ) (resid  21 and name   HN )  4.0  2.2  1.5 ! A.175  at 5.27e+06

! G21
assign (resid  21 and name  HA# ) (resid  22 and name   HN )  3.0  1.2  1.0 ! A.182  at 6.29e+06
assign (resid  21 and name   HN ) (resid  22 and name   HN )  4.0  2.2  1.0 ! A.173  at 2.46e+06

! S22
assign (resid  22 and name  HB# ) (resid  22 and name   HN )  4.0  2.2  1.5 ! A.181  at 5.09e+06
assign (resid  22 and name   HA ) (resid  23 and name   HN )  4.0  2.2  1.0 ! A.189  at 2.13e+06
assign (resid  22 and name  HB# ) (resid  23 and name   HN )  3.0  1.2  1.0 ! A.187  at 7.55e+06
assign (resid  22 and name   HN ) (resid  23 and name   HN )  4.0  2.2  1.0 ! A.179  at 4.63e+06

! R23
assign (resid  23 and name  HB# ) (resid  23 and name   HN )  4.0  2.2  1.0 ! A.274  at 3.76e+06
assign (resid  23 and name  HG# ) (resid  23 and name   HN )  4.0  2.2  1.5 ! A.272  at 3.30e+06
assign (resid  23 and name  HB# ) (resid  24 and name   HN )  4.0  2.2  1.0 ! A.257  at 1.08e+06
assign (resid  23 and name   HN ) (resid  24 and name   HN )  4.0  2.2  1.0 ! A.185  at 2.96e+06
assign (resid  23 and name  HG# ) (resid  24 and name   HN )  4.0  2.2  2.5 ! A.275  at 9.43e+05

! A24
assign (resid  24 and name  HB# ) (resid  24 and name   HN )  3.0  1.2  1.0 ! A.196  at 8.63e+06
assign (resid  24 and name   HA ) (resid  25 and name   HN )  3.0  1.2  0.5 ! A.202  at 8.51e+06
assign (resid  24 and name  HB# ) (resid  25 and name   HN )  4.0  2.2  1.5 ! A.204  at 3.03e+06
assign (resid  24 and name   HN ) (resid  25 and name   HN )  4.0  2.2  1.0 ! A.200  at 3.24e+06

! S25
assign (resid  25 and name  HB# ) (resid  25 and name   HN )  4.0  2.2  1.5 ! A.201  at 3.08e+06
assign (resid  25 and name  HB# ) (resid  26 and name   HN )  4.0  2.2  1.5 ! A.205  at 1.95e+06
assign (resid  25 and name   HA ) (resid  26 and name   HN )  4.0  2.2  2.0 ! A.253  at 8.73e+05

! L26
assign (resid  26 and name   HG ) (resid  26 and name   HN )  4.0  2.2  1.0 ! A.209  at 1.59e+06
assign (resid  26 and name  HG# ) (resid  26 and name   HN )  4.0  2.2  2.5 ! A.278  at 6.94e+05
assign (resid  26 and name  HB# ) (resid  26 and name   HN )  4.0  2.2  1.5 ! A.208  at 2.07e+06

! P27
assign (resid  27 and name  HB# ) (resid  28 and name   HN )  4.0  2.2  2.5 ! A.246  at 6.36e+05
assign (resid  27 and name   HA ) (resid  28 and name   HN )  3.0  1.2  0.5 ! A.213  at 7.21e+06
assign (resid  27 and name  HG# ) (resid  28 and name   HN )  4.0  2.2  2.5 ! A.247  at 6.70e+05

! K28
assign (resid  28 and name  HD# ) (resid  28 and name   HN )  4.0  2.2  1.5 ! A.245  at 1.14e+06


!@ END_XPLR_NOE_FILE


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