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
539124 2lrl 18379 cing 1-original 7 unknown chemical shift


!Chemical shifts

!HPr shifts
  1   MET    HA     4.581
  1   MET   HB2     2.245
  1   MET   HB3     2.053
  1   MET   HG2     2.436
  1   MET   HG3     2.436
  1   MET    CA    54.814
  1   MET    CB    32.653
  1   MET    CG    31.317
  2   PHE    HA     4.763
  2   PHE   HB2     2.596
  2   PHE   HB3     3.131
  2   PHE   HD1     7.223
  2   PHE   HD2     7.223
  2   PHE    CA    57.438
  2   PHE    CB    42.911
  2   PHE   CD1   132.463
  2   PHE   CD2   132.463
  2   PHE   CE1   131.721
  2   PHE   CE2   131.721
  3   GLN     H     7.661
  3   GLN    HA     5.706
  3   GLN   HB2     2.041
  3   GLN   HB3     1.938
  3   GLN    CA    53.776
  3   GLN    CB    32.679
  3   GLN     N   123.252
  4   GLN     H     8.527
  4   GLN    HA     4.361
  4   GLN   HB2     1.825
  4   GLN   HB3     1.825
  4   GLN   HG2     2.350
  4   GLN   HG3     2.350
  4   GLN    CA    55.686
  4   GLN    CB    34.664
  4   GLN    CG    34.223
  4   GLN     N   119.696
  5   GLU     H     8.376
  5   GLU    HA     5.361
  5   GLU   HB2     1.799
  5   GLU   HB3     1.799
  5   GLU   HG2     2.098
  5   GLU   HG3     2.098
  5   GLU    CA    55.034
  5   GLU    CB    32.232
  5   GLU    CG    37.058
  5   GLU     N   123.577
  6   VAL     H     9.312
  6   VAL    HA     4.509
  6   VAL    HB     2.101
  6   VAL  HG11     1.059
  6   VAL  HG12     1.059
  6   VAL  HG13     1.059
  6   VAL  HG21     0.872
  6   VAL  HG22     0.872
  6   VAL  HG23     0.872
  6   VAL    CA    60.379
  6   VAL    CB    35.210
  6   VAL   CG1    21.677
  6   VAL   CG2    20.519
  6   VAL     N   122.199
  7   THR     H     8.306
  7   THR    HA     4.824
  7   THR    HB     3.836
  7   THR    CA    62.019
  7   THR    CB    69.679
  7   THR   CG2    21.064
  7   THR     N   123.431
  8   ILE     H     8.772
  8   ILE    HA     3.908
  8   ILE    HB     2.087
  8   ILE  HD11     0.701
  8   ILE  HD12     0.701
  8   ILE  HD13     0.701
  8   ILE    CA    62.003
  8   ILE    CB    37.381
  8   ILE   CD1    13.524
  8   ILE   CG1    27.702
  8   ILE   CG2    17.456
  8   ILE     N   127.284
  9   THR     H     8.530
  9   THR    HA     4.486
  9   THR    HB     4.380
  9   THR    CA    61.526
  9   THR    CB    69.465
  9   THR   CG2    21.766
  9   THR     N   121.688
 10   ALA     H     7.615
 10   ALA    HA     4.475
 10   ALA    CA    50.974
 10   ALA    CB    18.213
 10   ALA     N   131.267
 11   PRO    CA    65.305
 11   PRO    CB    32.111
 11   PRO    CG    27.713
 11   PRO    CD    51.031
 11   PRO    HA     4.130
 11   PRO   HB1     1.877
 11   PRO   HB2     2.313
 11   PRO   HG1     2.079
 11   PRO   HG2     2.079
 11   PRO   HD1     3.888
 11   PRO   HD2     3.888
 12   ASN     H     8.863
 12   ASN    HA     4.829
 12   ASN   HB2     2.684
 12   ASN   HB3     2.849
 12   ASN    CA    52.752
 12   ASN    CB    38.738
 12   ASN     N   115.324
 13   GLY     H     8.028
 13   GLY   HA2     3.353
 13   GLY   HA3     4.154
 13   GLY    CA    45.182
 13   GLY     N   107.372
 14   LEU     H     8.270
 14   LEU    HA     4.453
 14   LEU   HB2     1.030
 14   LEU   HB3     1.940
 14   LEU  HD11     0.636
 14   LEU  HD12     0.636
 14   LEU  HD13     0.636
 14   LEU  HD21     0.459
 14   LEU  HD22     0.459
 14   LEU  HD23     0.459
 14   LEU    HG     1.187
 14   LEU    CA    53.395
 14   LEU    CB    40.823
 14   LEU   CD1    24.382
 14   LEU   CD2    25.280
 14   LEU    CG    28.193
 14   LEU     N   124.337
 15   HIS     H     6.735
 15   HIS    HA     4.744
 15   HIS   HB2     3.171
 15   HIS   HB3     3.532
 15   HIS   HD2     7.145
 15   HIS    CA    54.680
 15   HIS    CB    29.646
 15   HIS   CD2   119.697
 15   HIS     N   120.117
 16   THR     H     8.220
 16   THR   CG2    22.697
 16   THR     N   114.368
 17   ARG     H     8.604
 17   ARG    HA     4.309
 17   ARG   HB2     1.966
 17   ARG   HB3     1.920
 17   ARG   HD2     3.267
 17   ARG   HD3     3.302
 17   ARG   HG2     1.594
 17   ARG   HG3     1.784
 17   ARG    CA    61.555
 17   ARG    CB    27.405
 17   ARG    CD    43.499
 17   ARG    CG    27.633
 17   ARG     N   118.975
 18   PRO    CA    65.177
 18   PRO    CB    31.262
 18   PRO    HA     4.483
 18   PRO   HB1     2.139
 18   PRO   HB2     1.683
 19   ALA     H     8.404
 19   ALA    HA     3.798
 19   ALA    CA    55.718
 19   ALA    CB    17.611
 19   ALA     N   122.386
 20   ALA     H     8.378
 20   ALA    HA     4.010
 20   ALA    CA    55.198
 20   ALA    CB    17.559
 20   ALA     N   120.093
 21   GLN     H     7.534
 21   GLN    HA     3.962
 21   GLN   HB2     2.203
 21   GLN   HB3     2.171
 21   GLN   HG2     2.478
 21   GLN   HG3     2.384
 21   GLN    CA    59.094
 21   GLN    CB    28.365
 21   GLN    CG    33.687
 21   GLN     N   119.279
 22   PHE     H     8.497
 22   PHE    HA     3.879
 22   PHE   HB2     3.553
 22   PHE   HB3     2.960
 22   PHE   HD1     7.088
 22   PHE   HD2     7.088
 22   PHE    CA    62.156
 22   PHE    CB    39.426
 22   PHE   CD1   132.206
 22   PHE   CD2   132.206
 22   PHE   CE1   131.245
 22   PHE   CE2   131.245
 22   PHE     N   122.582
 23   VAL     H     8.447
 23   VAL    HA     4.131
 23   VAL    HB     2.065
 23   VAL  HG11     1.106
 23   VAL  HG12     1.106
 23   VAL  HG13     1.106
 23   VAL  HG21     0.861
 23   VAL  HG22     0.861
 23   VAL  HG23     0.861
 23   VAL    CA    65.234
 23   VAL    CB    32.112
 23   VAL   CG1    22.767
 23   VAL   CG2    21.686
 23   VAL     N   120.113
 24   LYS     H     7.942
 24   LYS    HA     3.805
 24   LYS   HB2     1.895
 24   LYS   HB3     1.895
 24   LYS   HD2     1.642
 24   LYS   HD3     1.642
 24   LYS   HG2     1.595
 24   LYS   HG3     1.314
 24   LYS    CA    60.199
 24   LYS    CB    32.690
 24   LYS    CD    29.393
 24   LYS    CE    42.175
 24   LYS    CG    25.763
 24   LYS     N   119.928
 25   GLU     H     8.029
 25   GLU    HA     3.942
 25   GLU   HB2     1.962
 25   GLU   HB3     1.962
 25   GLU   HG2     2.509
 25   GLU   HG3     2.322
 25   GLU    CA    58.829
 25   GLU    CB    28.983
 25   GLU    CG    37.176
 25   GLU     N   118.058
 26   ALA     H     8.837
 26   ALA    HA     3.930
 26   ALA    CA    55.533
 26   ALA    CB    18.578
 26   ALA     N   125.662
 27   LYS     H     8.036
 27   LYS    HA     3.880
 27   LYS   HB2     1.939
 27   LYS   HB3     1.939
 27   LYS   HD2     1.727
 27   LYS   HD3     1.727
 27   LYS   HG2     1.484
 27   LYS   HG3     1.484
 27   LYS    CA    59.161
 27   LYS    CB    32.983
 27   LYS    CD    30.535
 27   LYS    CE    41.663
 27   LYS    CG    26.963
 27   LYS     N   113.329
 28   GLY     H     7.541
 28   GLY    CA    45.161
 28   GLY     N   106.572
 29   PHE     H     7.375
 29   PHE    HA     4.690
 29   PHE   HB2     2.740
 29   PHE   HB3     2.740
 29   PHE   HD1     7.263
 29   PHE   HD2     7.263
 29   PHE    CA    57.434
 29   PHE    CB    40.300
 29   PHE   CD1   132.616
 29   PHE   CD2   132.616
 29   PHE   CE1   130.948
 29   PHE   CE2   130.948
 29   PHE     N   120.541
 30   THR     H    11.016
 30   THR    HA     4.125
 30   THR    HB     4.197
 30   THR    CA    64.042
 30   THR    CB    69.142
 30   THR   CG2    21.938
 30   THR     N   119.649
 31   SER     H     9.196
 31   SER    HA     4.379
 31   SER   HB2     3.493
 31   SER   HB3     3.168
 31   SER    CA    61.356
 31   SER    CB    65.564
 31   SER     N   120.899
 32   GLU     H     7.870
 32   GLU    HA     4.402
 32   GLU   HB2     2.029
 32   GLU   HB3     2.029
 32   GLU   HG2     2.333
 32   GLU   HG3     2.231
 32   GLU    CA    56.062
 32   GLU    CB    30.160
 32   GLU    CG    36.110
 32   GLU     N   121.999
 33   ILE     H     9.133
 33   ILE    HA     5.089
 33   ILE    HB     1.572
 33   ILE  HD11     0.788
 33   ILE  HD12     0.788
 33   ILE  HD13     0.788
 33   ILE    CA    60.513
 33   ILE    CB    41.969
 33   ILE   CD1    16.303
 33   ILE   CG1    26.320
 33   ILE   CG2    18.365
 33   ILE     N   129.906
 34   THR     H     9.741
 34   THR    HA     4.911
 34   THR    HB     3.850
 34   THR    CA    61.359
 34   THR    CB    71.537
 34   THR   CG2    21.725
 34   THR     N   125.969
 35   VAL     H     9.304
 35   VAL    HA     4.851
 35   VAL    HB     1.804
 35   VAL  HG11     0.989
 35   VAL  HG12     0.989
 35   VAL  HG13     0.989
 35   VAL  HG21     0.678
 35   VAL  HG22     0.678
 35   VAL  HG23     0.678
 35   VAL    CA    60.856
 35   VAL    CB    33.449
 35   VAL   CG1    21.963
 35   VAL   CG2    21.619
 35   VAL     N   126.978
 36   THR     H     8.966
 36   THR    HA     5.436
 36   THR    HB     3.745
 36   THR    CA    60.973
 36   THR    CB    71.058
 36   THR   CG2    20.680
 36   THR     N   123.085
 37   SER     H     9.168
 37   SER    HA     4.747
 37   SER   HB2     3.634
 37   SER   HB3     3.634
 37   SER    CA    56.628
 37   SER    CB    65.239
 37   SER     N   119.881
 38   ASN     H     9.919
 38   ASN    HA     4.368
 38   ASN   HB2     2.788
 38   ASN   HB3     3.063
 38   ASN    CA    54.262
 38   ASN    CB    37.810
 38   ASN     N   128.649
 39   GLY     H     8.658
 39   GLY    CA    45.494
 39   GLY     N   103.969
 40   LYS     H     7.963
 40   LYS    HA     4.643
 40   LYS   HB2     1.839
 40   LYS   HB3     1.839
 40   LYS   HD2     1.737
 40   LYS   HD3     1.737
 40   LYS   HG2     1.490
 40   LYS   HG3     1.384
 40   LYS    CA    55.020
 40   LYS    CB    35.207
 40   LYS    CD    29.262
 40   LYS    CE    42.191
 40   LYS    CG    24.972
 40   LYS     N   124.053
 41   SER     H     8.505
 41   SER    HA     5.791
 41   SER   HB2     3.605
 41   SER   HB3     3.489
 41   SER    CA    57.009
 41   SER    CB    66.620
 41   SER     N   117.412
 42   ALA     H     9.161
 42   ALA    HA     4.559
 42   ALA    CA    51.170
 42   ALA    CB    23.722
 42   ALA     N   124.299
 43   SER     H     8.219
 43   SER    HA     4.789
 43   SER   HB2     4.096
 43   SER   HB3     3.677
 43   SER    CA    57.203
 43   SER    CB    64.046
 43   SER     N   114.489
 44   ALA     H     8.415
 44   ALA    HA     4.189
 44   ALA    CA    52.658
 44   ALA    CB    20.200
 44   ALA     N   127.163
 45   LYS     H     7.687
 45   LYS    HA     4.311
 45   LYS   HB2     1.451
 45   LYS   HB3     2.208
 45   LYS   HD2     1.739
 45   LYS   HD3     1.804
 45   LYS   HG2     0.864
 45   LYS    CA    55.802
 45   LYS    CB    33.148
 45   LYS    CD    30.199
 45   LYS    CE    42.150
 45   LYS    CG    27.047
 45   LYS     N   108.619
 46   SER     H     7.188
 46   SER    HA     5.110
 46   SER   HB2     3.867
 46   SER   HB3     3.867
 46   SER    CA    55.051
 46   SER    CB    64.795
 46   SER     N   114.697
 47   LEU     H     8.980
 47   LEU    HA     4.020
 47   LEU   HB2     1.841
 47   LEU   HB3     1.841
 47   LEU  HD11     0.832
 47   LEU  HD12     0.832
 47   LEU  HD13     0.832
 47   LEU  HD21     0.828
 47   LEU  HD22     0.828
 47   LEU  HD23     0.828
 47   LEU    HG     1.475
 47   LEU    CA    55.832
 47   LEU    CB    42.283
 47   LEU   CD1    25.959
 47   LEU   CD2    23.299
 47   LEU    CG    29.384
 47   LEU     N   131.759
 48   PHE     H     8.385
 48   PHE    HA     4.104
 48   PHE   HB2     2.897
 48   PHE   HB3     2.983
 48   PHE   HD1     7.040
 48   PHE   HD2     7.040
 48   PHE    CA    60.981
 48   PHE    CB    39.005
 48   PHE   CD1   131.963
 48   PHE   CD2   131.963
 48   PHE     N   116.329
 49   LYS     H     7.833
 49   LYS    HA     4.246
 49   LYS   HB2     1.953
 49   LYS   HB3     1.953
 49   LYS   HD2     1.696
 49   LYS   HD3     1.827
 49   LYS   HG2     1.552
 49   LYS   HG3     1.552
 49   LYS    CA    57.658
 49   LYS    CB    31.969
 49   LYS    CD    28.447
 49   LYS    CE    42.317
 49   LYS    CG    25.017
 49   LYS     N   117.450
 50   LEU     H     8.670
 50   LEU    HA     3.736
 50   LEU   HB2     1.858
 50   LEU   HB3     1.559
 50   LEU  HD11     0.771
 50   LEU  HD12     0.771
 50   LEU  HD13     0.771
 50   LEU  HD21     0.773
 50   LEU  HD22     0.773
 50   LEU  HD23     0.773
 50   LEU    HG     1.665
 50   LEU    CA    58.666
 50   LEU    CB    42.628
 50   LEU   CD1    26.764
 50   LEU   CD2    24.536
 50   LEU    CG    26.897
 50   LEU     N   125.234
 51   GLN     H     7.867
 51   GLN    HA     4.099
 51   GLN   HB2     2.083
 51   GLN   HB3     2.083
 51   GLN   HG2     2.352
 51   GLN   HG3     2.352
 51   GLN    CA    58.238
 51   GLN    CB    28.978
 51   GLN    CG    34.511
 51   GLN     N   112.289
 52   THR     H     7.570
 52   THR    CA    63.555
 52   THR    CB    70.209
 52   THR   CG2    21.494
 52   THR     N   110.209
 53   LEU     H     7.516
 53   LEU    HA     4.220
 53   LEU   HB2     1.317
 53   LEU   HB3     1.850
 53   LEU  HD11     0.784
 53   LEU  HD12     0.784
 53   LEU  HD13     0.784
 53   LEU  HD21     0.655
 53   LEU  HD22     0.655
 53   LEU  HD23     0.655
 53   LEU    HG     1.730
 53   LEU    CA    55.049
 53   LEU    CB    42.437
 53   LEU   CD1    26.257
 53   LEU   CD2    22.607
 53   LEU    CG    27.014
 53   LEU     N   121.706
 54   GLY     H     8.492
 54   GLY    CA    46.778
 54   GLY     N   108.885
 55   LEU     H     8.504
 55   LEU    HA     4.289
 55   LEU   HB2     1.337
 55   LEU   HB3     1.676
 55   LEU  HD11     0.779
 55   LEU  HD12     0.779
 55   LEU  HD13     0.779
 55   LEU  HD21     0.653
 55   LEU  HD22     0.653
 55   LEU  HD23     0.653
 55   LEU    HG     1.445
 55   LEU    CA    53.624
 55   LEU    CB    41.233
 55   LEU   CD1    26.246
 55   LEU   CD2    23.110
 55   LEU    CG    25.899
 55   LEU     N   127.042
 56   THR     H     7.201
 56   THR    HA     4.220
 56   THR    HB     4.336
 56   THR    CA    60.623
 56   THR    CB    70.600
 56   THR   CG2    22.483
 56   THR     N   110.927
 57   GLN     H     8.957
 57   GLN    HA     3.619
 57   GLN   HB2     1.952
 57   GLN   HB3     2.120
 57   GLN   HG2     2.125
 57   GLN   HG3     2.125
 57   GLN    CA    58.575
 57   GLN    CB    27.945
 57   GLN    CG    33.958
 57   GLN     N   123.061
 58   GLY     H     9.321
 58   GLY    CA    44.650
 58   GLY     N   116.728
 59   THR     H     7.904
 59   THR    HA     4.007
 59   THR    HB     4.038
 59   THR    CA    64.372
 59   THR    CB    69.436
 59   THR   CG2    21.998
 59   THR     N   119.525
 60   VAL     H     8.679
 60   VAL    HA     4.441
 60   VAL    HB     1.915
 60   VAL  HG11     0.986
 60   VAL  HG12     0.986
 60   VAL  HG13     0.986
 60   VAL  HG21     0.763
 60   VAL  HG22     0.763
 60   VAL  HG23     0.763
 60   VAL    CA    62.348
 60   VAL    CB    31.958
 60   VAL   CG1    21.069
 60   VAL   CG2    21.228
 60   VAL     N   128.880
 61   VAL     H     9.272
 61   VAL    HA     5.050
 61   VAL    HB     1.999
 61   VAL  HG11     0.781
 61   VAL  HG12     0.781
 61   VAL  HG13     0.781
 61   VAL  HG21     0.744
 61   VAL  HG22     0.744
 61   VAL  HG23     0.744
 61   VAL    CA    58.716
 61   VAL    CB    34.378
 61   VAL   CG1    22.877
 61   VAL   CG2    20.514
 61   VAL     N   125.778
 62   THR     H     8.869
 62   THR    HA     4.816
 62   THR    HB     3.811
 62   THR    CA    62.507
 62   THR    CB    70.097
 62   THR   CG2    21.791
 62   THR     N   118.467
 63   ILE     H     9.035
 63   ILE    HA     4.801
 63   ILE    HB     1.826
 63   ILE  HD11     0.928
 63   ILE  HD12     0.928
 63   ILE  HD13     0.928
 63   ILE    CA    60.684
 63   ILE    CB    38.474
 63   ILE   CD1    13.891
 63   ILE   CG1    31.093
 63   ILE   CG2    18.036
 63   ILE     N   129.932
 64   SER     H     9.103
 64   SER    HA     5.572
 64   SER   HB2     3.666
 64   SER   HB3     3.666
 64   SER    CA    56.005
 64   SER    CB    65.960
 64   SER     N   121.847
 65   ALA     H     9.213
 65   ALA    HA     5.640
 65   ALA    CA    50.244
 65   ALA    CB    25.272
 65   ALA     N   124.759
 66   GLU     H     8.348
 66   GLU    HA     5.331
 66   GLU   HB2     1.914
 66   GLU   HB3     1.982
 66   GLU   HG2     2.162
 66   GLU   HG3     2.102
 66   GLU    CA    54.244
 66   GLU    CB    33.530
 66   GLU    CG    36.845
 66   GLU     N   119.604
 67   GLY     H    10.228
 67   GLY    CA    45.217
 67   GLY     N   119.409
 68   GLU     H     9.057
 68   GLU    HA     4.000
 68   GLU   HB2     1.975
 68   GLU   HB3     1.975
 68   GLU   HG2     2.262
 68   GLU   HG3     2.262
 68   GLU    CA    59.379
 68   GLU    CB    29.036
 68   GLU    CG    36.083
 68   GLU     N   119.517
 69   ASP     H     7.227
 69   ASP    HA     4.890
 69   ASP   HB2     2.630
 69   ASP   HB3     3.285
 69   ASP    CA    50.965
 69   ASP    CB    39.826
 69   ASP     N   114.836
 70   GLU     H     6.863
 70   GLU    HA     3.755
 70   GLU   HB2     2.718
 70   GLU   HB3     2.718
 70   GLU   HG2     2.092
 70   GLU   HG3     2.718
 70   GLU    CA    59.791
 70   GLU    CB    28.039
 70   GLU    CG    34.653
 70   GLU     N   117.029
 71   GLN     H     7.736
 71   GLN    HA     3.245
 71   GLN   HB2     1.387
 71   GLN   HB3     1.489
 71   GLN   HG2     1.046
 71   GLN   HG3     1.046
 71   GLN    CA    58.795
 71   GLN    CB    26.887
 71   GLN    CG    32.327
 71   GLN     N   120.392
 72   LYS     H     7.551
 72   LYS    HA     3.842
 72   LYS   HB2     1.758
 72   LYS   HB3     1.793
 72   LYS   HD2     1.739
 72   LYS   HD3     1.739
 72   LYS   HG2     1.424
 72   LYS   HG3     1.506
 72   LYS    CA    58.510
 72   LYS    CB    32.332
 72   LYS    CD    29.200
 72   LYS    CE    42.264
 72   LYS    CG    25.070
 72   LYS     N   119.582
 73   ALA     H     8.369
 73   ALA    HA     1.911
 73   ALA    CA    53.886
 73   ALA    CB    18.456
 73   ALA     N   121.561
 74   VAL     H     7.247
 74   VAL    HA     3.231
 74   VAL    HB     2.151
 74   VAL  HG11     1.131
 74   VAL  HG12     1.131
 74   VAL  HG13     1.131
 74   VAL  HG21     0.934
 74   VAL  HG22     0.934
 74   VAL  HG23     0.934
 74   VAL    CA    67.393
 74   VAL    CB    31.950
 74   VAL   CG1    24.454
 74   VAL   CG2    22.914
 74   VAL     N   116.556
 75   GLU     H     8.267
 75   GLU    HA     3.805
 75   GLU   HB2     2.047
 75   GLU   HB3     1.895
 75   GLU   HG2     2.500
 75   GLU   HG3     2.207
 75   GLU    CA    60.224
 75   GLU    CB    29.464
 75   GLU    CG    37.330
 75   GLU     N   117.148
 76   HIS     H     8.224
 76   HIS    HA     4.191
 76   HIS   HB2     3.079
 76   HIS   HB3     3.217
 76   HIS   HD2     6.642
 76   HIS    CA    60.046
 76   HIS    CB    32.449
 76   HIS   CD2   116.337
 76   HIS     N   119.206
 77   LEU     H     7.984
 77   LEU    HA     4.002
 77   LEU   HB2     1.535
 77   LEU   HB3     1.802
 77   LEU  HD11     0.577
 77   LEU  HD12     0.577
 77   LEU  HD13     0.577
 77   LEU  HD21     0.212
 77   LEU  HD22     0.212
 77   LEU  HD23     0.212
 77   LEU    HG     1.903
 77   LEU    CA    57.547
 77   LEU    CB    40.854
 77   LEU   CD1    26.554
 77   LEU   CD2    20.661
 77   LEU    CG    26.844
 77   LEU     N   119.809
 78   VAL     H     8.946
 78   VAL    HA     3.557
 78   VAL    HB     2.110
 78   VAL  HG11     0.977
 78   VAL  HG12     0.977
 78   VAL  HG13     0.977
 78   VAL  HG21     0.919
 78   VAL  HG22     0.919
 78   VAL  HG23     0.919
 78   VAL    CA    66.947
 78   VAL    CB    31.578
 78   VAL   CG1    23.539
 78   VAL   CG2    21.088
 78   VAL     N   120.501
 79   LYS     H     7.263
 79   LYS    HA     3.981
 79   LYS   HB2     1.811
 79   LYS   HB3     1.877
 79   LYS   HD2     1.640
 79   LYS   HD3     1.640
 79   LYS   HG2     1.508
 79   LYS   HG3     1.312
 79   LYS    CA    59.437
 79   LYS    CB    32.016
 79   LYS    CD    29.330
 79   LYS    CE    41.871
 79   LYS    CG    24.889
 79   LYS     N   121.449
 80   LEU     H     7.826
 80   LEU    HA     4.002
 80   LEU   HB2     1.615
 80   LEU   HB3     1.838
 80   LEU  HD11     0.865
 80   LEU  HD12     0.865
 80   LEU  HD13     0.865
 80   LEU  HD21     0.888
 80   LEU  HD22     0.888
 80   LEU  HD23     0.888
 80   LEU    HG     1.617
 80   LEU    CA    57.488
 80   LEU    CB    42.194
 80   LEU   CD1    26.009
 80   LEU   CD2    24.520
 80   LEU    CG    26.836
 80   LEU     N   119.535
 81   MET     H     7.990
 81   MET    HA     3.995
 81   MET   HB2     2.022
 81   MET   HB3     2.257
 81   MET   HG2     2.535
 81   MET   HG3     2.462
 81   MET    CA    58.773
 81   MET    CB    33.840
 81   MET    CE    24.990
 81   MET    CG    32.210
 81   MET     N   116.889
 82   ALA     H     7.659
 82   ALA    HA     4.282
 82   ALA    CA    53.670
 82   ALA    CB    18.999
 82   ALA     N   118.929
 83   GLU     H     7.823
 83   GLU    HA     4.403
 83   GLU   HB2     2.026
 83   GLU   HB3     2.139
 83   GLU   HG2     2.350
 83   GLU   HG3     2.350
 83   GLU    CA    56.005
 83   GLU    CB    30.784
 83   GLU    CG    36.489
 83   GLU     N   117.106
 84   LEU     H     7.236
 84   LEU    HA     4.239
 84   LEU   HB2     1.407
 84   LEU   HB3     1.778
 84   LEU  HD11     0.937
 84   LEU  HD12     0.937
 84   LEU  HD13     0.937
 84   LEU  HD21     0.871
 84   LEU  HD22     0.871
 84   LEU  HD23     0.871
 84   LEU    HG     2.032
 84   LEU    CA    56.000
 84   LEU    CB    43.082
 84   LEU   CD1    26.473
 84   LEU   CD2    23.353
 84   LEU    CG    26.227
 84   LEU     N   122.297
 85   GLU     H     7.920
 85   GLU    HA     4.249
 85   GLU   HB2     2.052
 85   GLU   HB3     1.939
 85   GLU   HG2     2.187
 85   GLU   HG3     2.187
 85   GLU    CA    57.610
 85   GLU    CB    32.577
 85   GLU    CG    36.416
 85   GLU     N   125.644

!IIAChb shifts

  2   GLU    HA     4.388
  2   GLU   HB2     1.940
  2   GLU   HB3     2.110
  2   GLU   HG2     2.282
  2   GLU   HG3     2.282
  2   GLU     C   176.335
  2   GLU    CA    56.591
  2   GLU    CB    30.439
  2   GLU    CG    36.457
  3   GLU     H     8.765
  3   GLU    HA     4.356
  3   GLU   HB2     1.940
  3   GLU   HB3     2.110
  3   GLU   HG2     2.280
  3   GLU   HG3     2.340
  3   GLU     C   177.487
  3   GLU    CA    56.653
  3   GLU    CB    29.394
  3   GLU    CG    36.320
  3   GLU     N   122.694
  4   LEU     H     8.578
  4   LEU    HA     4.170
  4   LEU   HB2     1.640
  4   LEU   HB3     1.775
  4   LEU  HD11     0.919
  4   LEU  HD12     0.919
  4   LEU  HD13     0.919
  4   LEU  HD21     0.952
  4   LEU  HD22     0.952
  4   LEU  HD23     0.952
  4   LEU    HG     1.650
  4   LEU     C   178.124
  4   LEU    CA    57.097
  4   LEU    CB    40.973
  4   LEU   CD1    24.947
  4   LEU   CD2    24.668
  4   LEU    CG    27.242
  4   LEU     N   122.722
  5   GLU     H     8.686
  5   GLU    HA     3.902
  5   GLU   HB2     2.125
  5   GLU   HB3     2.125
  5   GLU   HG2     2.338
  5   GLU   HG3     2.367
  5   GLU     C   178.429
  5   GLU    CA    59.362
  5   GLU    CB    28.900
  5   GLU    CG    37.217
  5   GLU     N   117.541
  6   GLU     H     7.832
  6   GLU    HA     4.123
  6   GLU   HB2     2.150
  6   GLU   HB3     2.150
  6   GLU   HG2     2.365
  6   GLU   HG3     2.365
  6   GLU     C   179.386
  6   GLU    CA    58.745
  6   GLU    CB    28.706
  6   GLU    CG    36.215
  6   GLU     N   118.541
  7   VAL     H     7.942
  7   VAL    HA     3.810
  7   VAL    HB     2.245
  7   VAL  HG11     0.906
  7   VAL  HG12     0.906
  7   VAL  HG13     0.906
  7   VAL  HG21     1.043
  7   VAL  HG22     1.043
  7   VAL  HG23     1.043
  7   VAL     C   179.145
  7   VAL    CA    65.345
  7   VAL    CB    31.327
  7   VAL   CG1    22.077
  7   VAL   CG2    22.256
  7   VAL     N   121.021
  8   VAL     H     8.273
  8   VAL    HA     3.635
  8   VAL    HB     2.140
  8   VAL  HG11     0.982
  8   VAL  HG12     0.982
  8   VAL  HG13     0.982
  8   VAL  HG21     1.029
  8   VAL  HG22     1.029
  8   VAL  HG23     1.029
  8   VAL     C   177.379
  8   VAL    CA    65.908
  8   VAL    CB    31.041
  8   VAL   CG1    21.160
  8   VAL   CG2    23.632
  8   VAL     N   119.581
  9   MET     H     8.001
  9   MET    HA     4.228
  9   MET   HB2     2.183
  9   MET   HB3     2.183
  9   MET   HG2     2.680
  9   MET   HG3     2.680
  9   MET     C   178.706
  9   MET    CA    57.831
  9   MET    CB    27.945
  9   MET    CG    32.032
  9   MET     N   119.636
 10   GLY     H     7.764
 10   GLY     C   176.040
 10   GLY    CA    46.855
 10   GLY     N   105.487
 11   LEU     H     7.581
 11   LEU    HA     4.170
 11   LEU   HB2     1.910
 11   LEU   HB3     1.970
 11   LEU  HD11     0.913
 11   LEU  HD12     0.913
 11   LEU  HD13     0.913
 11   LEU  HD21     0.928
 11   LEU  HD22     0.928
 11   LEU  HD23     0.928
 11   LEU    HG     1.914
 11   LEU     C   176.217
 11   LEU    CA    58.540
 11   LEU    CB    41.042
 11   LEU   CD1    27.596
 11   LEU   CD2    24.712
 11   LEU     N   123.651
 12   ILE     H     8.311
 12   ILE    HA     3.755
 12   ILE    HB     1.940
 12   ILE  HD11     0.554
 12   ILE  HD12     0.554
 12   ILE  HD13     0.554
 12   ILE     C   179.368
 12   ILE    CA    66.074
 12   ILE    CB    36.703
 12   ILE   CD1    13.363
 12   ILE   CG1    28.957
 12   ILE   CG2    15.492
 12   ILE     N   124.386
 13   ILE     H     8.551
 13   ILE    HA     3.795
 13   ILE    HB     1.983
 13   ILE  HD11     0.805
 13   ILE  HD12     0.805
 13   ILE  HD13     0.805
 13   ILE     C   179.701
 13   ILE    CA    64.449
 13   ILE    CB    36.734
 13   ILE   CD1    12.482
 13   ILE   CG1    28.452
 13   ILE   CG2    16.532
 13   ILE     N   122.710
 14   ASN     H     8.407
 14   ASN    HA     4.608
 14   ASN   HB2     2.785
 14   ASN   HB3     3.000
 14   ASN     C   178.143
 14   ASN    CA    56.444
 14   ASN    CB    37.827
 14   ASN     N   119.428
 15   SER     H     8.647
 15   SER     C   177.346
 15   SER    CA    62.648
 15   SER    CB    62.786
 15   SER     N   116.754
 16   GLY     H     8.374
 16   GLY     C   176.804
 16   GLY    CA    46.937
 16   GLY     N   112.458
 17   GLN     H     8.440
 17   GLN    HA     4.290
 17   GLN   HB2     2.130
 17   GLN   HB3     2.300
 17   GLN   HG2     2.453
 17   GLN   HG3     2.510
 17   GLN     C   178.519
 17   GLN    CA    58.073
 17   GLN    CB    27.263
 17   GLN    CG    33.665
 17   GLN     N   123.751
 18   ALA     H     8.342
 18   ALA    HA     4.210
 18   ALA     C   181.243
 18   ALA    CA    54.997
 18   ALA    CB    18.294
 18   ALA     N   120.889
 19   ARG     H     7.850
 19   ARG    HA     3.950
 19   ARG   HB2     2.060
 19   ARG   HB3     2.150
 19   ARG   HD2     3.216
 19   ARG   HD3     3.216
 19   ARG   HG2     1.655
 19   ARG   HG3     1.655
 19   ARG     C   176.880
 19   ARG    CA    59.577
 19   ARG    CB    29.783
 19   ARG    CD    44.203
 19   ARG    CG    27.322
 19   ARG     N   119.885
 20   SER     H     8.577
 20   SER    HA     4.330
 20   SER   HB2     4.050
 20   SER   HB3     4.050
 20   SER     C   178.308
 20   SER    CA    61.830
 20   SER    CB    61.695
 20   SER     N   115.557
 21   LEU     H     8.671
 21   LEU    HA     4.200
 21   LEU   HB2     1.800
 21   LEU   HB3     1.800
 21   LEU  HD11     0.821
 21   LEU  HD12     0.821
 21   LEU  HD13     0.821
 21   LEU  HD21     0.916
 21   LEU  HD22     0.916
 21   LEU  HD23     0.916
 21   LEU    HG     1.690
 21   LEU     C   177.973
 21   LEU    CA    57.335
 21   LEU    CB    41.845
 21   LEU   CD1    25.190
 21   LEU   CD2    23.242
 21   LEU     N   123.061
 22   ALA     H     7.451
 22   ALA    HA     4.450
 22   ALA     C   179.285
 22   ALA    CA    54.438
 22   ALA    CB    16.549
 22   ALA     N   121.107
 23   TYR     H     8.218
 23   TYR    HA     4.255
 23   TYR   HB2     3.100
 23   TYR   HB3     3.020
 23   TYR   HD1     7.190
 23   TYR   HD2     7.190
 23   TYR     C   179.456
 23   TYR    CA    62.045
 23   TYR    CB    36.640
 23   TYR   CD1   132.619
 23   TYR   CD2   132.619
 23   TYR   CE1   119.604
 23   TYR   CE2   119.604
 23   TYR     N   117.238
 24   ALA     H     8.398
 24   ALA    HA     4.170
 24   ALA     C   180.409
 24   ALA    CA    54.757
 24   ALA    CB    17.372
 24   ALA     N   124.328
 25   ALA     H     8.499
 25   ALA    HA     4.025
 25   ALA     C   179.467
 25   ALA    CA    54.594
 25   ALA    CB    18.294
 25   ALA     N   124.070
 26   LEU     H     7.874
 26   LEU    HA     3.900
 26   LEU  HD11     0.904
 26   LEU  HD12     0.904
 26   LEU  HD13     0.904
 26   LEU  HD21     1.026
 26   LEU  HD22     1.026
 26   LEU  HD23     1.026
 26   LEU    HG     1.480
 26   LEU     C   177.747
 26   LEU    CA    57.197
 26   LEU    CB    39.672
 26   LEU   CD1    23.534
 26   LEU   CD2    26.343
 26   LEU    CG    27.442
 26   LEU     N   119.115
 27   LYS     H     7.721
 27   LYS    HA     3.752
 27   LYS   HB2     1.950
 27   LYS   HB3     1.950
 27   LYS   HD2     1.660
 27   LYS   HD3     1.660
 27   LYS   HG2     1.320
 27   LYS   HG3     1.540
 27   LYS     C   179.308
 27   LYS    CA    59.752
 27   LYS    CB    31.003
 27   LYS    CD    29.292
 27   LYS    CG    25.322
 27   LYS     N   118.594
 28   GLN     H     7.599
 28   GLN   HG2     2.490
 28   GLN   HG3     2.490
 28   GLN     C   178.593
 28   GLN    CA    57.736
 28   GLN    CB    26.381
 28   GLN    CG    33.620
 28   GLN     N   116.601
 29   ALA     H     8.165
 29   ALA    HA     2.938
 29   ALA     C   180.056
 29   ALA    CA    54.245
 29   ALA    CB    18.325
 29   ALA     N   122.339
 30   LYS     H     8.055
 30   LYS    HA     3.475
 30   LYS   HB2     1.700
 30   LYS   HB3     1.700
 30   LYS   HD2     1.570
 30   LYS   HD3     1.470
 30   LYS   HG2     1.295
 30   LYS   HG3     1.295
 30   LYS     C   177.674
 30   LYS    CA    59.306
 30   LYS    CB    30.725
 30   LYS    CD    29.932
 30   LYS    CE    41.252
 30   LYS    CG    24.622
 30   LYS     N   117.179
 31   GLN     H     7.122
 31   GLN    HA     4.360
 31   GLN   HB2     2.160
 31   GLN   HB3     2.160
 31   GLN   HG2     2.430
 31   GLN   HG3     2.430
 31   GLN     C   176.026
 31   GLN    CA    54.972
 31   GLN    CB    28.044
 31   GLN    CG    33.960
 31   GLN     N   115.100
 32   GLY     H     7.506
 32   GLY     C   173.061
 32   GLY    CA    44.543
 32   GLY     N   107.281
 33   ASP     H     7.729
 33   ASP    HA     4.987
 33   ASP   HB2     2.260
 33   ASP   HB3     2.260
 33   ASP     C   175.810
 33   ASP    CA    51.035
 33   ASP    CB    38.698
 33   ASP     N   122.167
 34   PHE     H     7.714
 34   PHE    HA     3.990
 34   PHE   HB2     3.190
 34   PHE   HB3     3.190
 34   PHE   HD1     7.276
 34   PHE   HD2     7.303
 34   PHE     C   178.012
 34   PHE    CA    61.523
 34   PHE    CB    37.827
 34   PHE   CD1   131.138
 34   PHE   CD2   131.138
 34   PHE   CE1   131.495
 34   PHE   CE2   131.495
 34   PHE     N   120.724
 35   ALA     H     8.453
 35   ALA    HA     4.265
 35   ALA     C   180.938
 35   ALA    CA    54.777
 35   ALA    CB    17.886
 35   ALA     N   124.412
 36   ALA     H     8.047
 36   ALA    HA     4.160
 36   ALA     C   180.379
 36   ALA    CA    54.032
 36   ALA    CB    17.438
 36   ALA     N   122.973
 37   ALA     H     7.735
 37   ALA    HA     4.010
 37   ALA     C   179.224
 37   ALA    CA    54.921
 37   ALA    CB    18.393
 37   ALA     N   118.750
 38   LYS     H     8.041
 38   LYS    HA     3.963
 38   LYS   HB2     2.020
 38   LYS   HB3     2.020
 38   LYS   HD2     1.725
 38   LYS   HD3     1.725
 38   LYS   HG2     1.510
 38   LYS   HG3     1.660
 38   LYS     C   178.960
 38   LYS    CA    59.345
 38   LYS    CB    31.305
 38   LYS    CD    29.082
 38   LYS    CG    25.632
 38   LYS     N   117.968
 39   ALA     H     7.658
 39   ALA    HA     4.270
 39   ALA     C   181.347
 39   ALA    CA    54.766
 39   ALA    CB    17.094
 39   ALA     N   121.980
 40   MET     H     8.308
 40   MET    HA     4.175
 40   MET   HB2     2.035
 40   MET   HB3     2.035
 40   MET   HG2     2.150
 40   MET   HG3     2.150
 40   MET     C   178.799
 40   MET    CA    58.809
 40   MET    CB    32.638
 40   MET    CG    32.362
 40   MET     N   118.613
 41   MET     H     8.422
 41   MET    HA     4.485
 41   MET   HB2     2.175
 41   MET   HB3     2.175
 41   MET     C   180.001
 41   MET    CA    56.084
 41   MET    CB    29.083
 41   MET     N   119.369
 42   ASP     H     8.305
 42   ASP    HA     4.565
 42   ASP   HB2     2.717
 42   ASP   HB3     2.938
 42   ASP     C   178.858
 42   ASP    CA    57.361
 42   ASP    CB    39.572
 42   ASP     N   123.269
 43   GLN     H     7.703
 43   GLN    HA     4.110
 43   GLN   HB2     2.125
 43   GLN   HB3     2.125
 43   GLN   HG2     2.420
 43   GLN   HG3     2.600
 43   GLN     C   179.294
 43   GLN    CA    58.798
 43   GLN    CB    27.855
 43   GLN    CG    34.040
 43   GLN     N   119.822
 44   SER     H     8.403
 44   SER     C   175.967
 44   SER    CA    61.574
 44   SER    CB    62.260
 44   SER     N   115.940
 45   ARG     H     8.258
 45   ARG    HA     3.770
 45   ARG   HB2     1.893
 45   ARG   HB3     2.217
 45   ARG   HD2     3.178
 45   ARG   HD3     3.329
 45   ARG   HG2     1.540
 45   ARG   HG3     1.633
 45   ARG     C   178.521
 45   ARG    CA    59.295
 45   ARG    CB    29.375
 45   ARG    CD    43.356
 45   ARG    CG    27.342
 45   ARG     N   119.356
 46   MET     H     8.018
 46   MET    HA     4.180
 46   MET   HB2     2.640
 46   MET   HB3     2.780
 46   MET   HG2     2.218
 46   MET   HG3     2.218
 46   MET     C   178.568
 46   MET    CA    58.533
 46   MET    CB    31.437
 46   MET    CG    32.362
 46   MET     N   118.042
 47   ALA     H     7.829
 47   ALA    HA     4.330
 47   ALA     C   180.132
 47   ALA    CA    54.697
 47   ALA    CB    16.774
 47   ALA     N   122.458
 48   LEU     H     8.086
 48   LEU   HB2     1.665
 48   LEU   HB3     1.665
 48   LEU  HD11     0.877
 48   LEU  HD12     0.877
 48   LEU  HD13     0.877
 48   LEU  HD21     0.940
 48   LEU  HD22     0.940
 48   LEU  HD23     0.940
 48   LEU    HG     1.729
 48   LEU     C   178.727
 48   LEU    CA    56.761
 48   LEU    CB    40.363
 48   LEU   CD1    24.762
 48   LEU   CD2    25.220
 48   LEU     N   118.471
 49   ASN     H     8.679
 49   ASN    HA     4.580
 49   ASN   HB2     3.000
 49   ASN   HB3     3.000
 49   ASN     C   178.024
 49   ASN    CA    55.653
 49   ASN    CB    38.085
 49   ASN     N   119.842
 50   GLU     H     8.004
 50   GLU   HB2     2.170
 50   GLU   HB3     2.170
 50   GLU   HG2     2.360
 50   GLU   HG3     2.360
 50   GLU     C   179.193
 50   GLU    CA    58.986
 50   GLU    CB    28.275
 50   GLU    CG    35.880
 50   GLU     N   120.121
 51   ALA     H     7.836
 51   ALA    HA     4.170
 51   ALA     C   178.858
 51   ALA    CA    54.625
 51   ALA    CB    17.662
 51   ALA     N   121.711
 52   HIS     H     8.613
 52   HIS    HA     4.225
 52   HIS   HB2     3.300
 52   HIS   HB3     3.300
 52   HIS     C   178.321
 52   HIS    CA    59.830
 52   HIS    CB    29.394
 52   HIS     N   117.458
 53   LEU     H     8.049
 53   LEU    HA     4.140
 53   LEU   HB2     1.940
 53   LEU   HB3     1.940
 53   LEU  HD11     0.924
 53   LEU  HD12     0.924
 53   LEU  HD13     0.924
 53   LEU  HD21     0.924
 53   LEU  HD22     0.924
 53   LEU  HD23     0.924
 53   LEU    HG     1.795
 53   LEU     C   179.985
 53   LEU    CA    57.758
 53   LEU    CB    40.725
 53   LEU   CD1    23.686
 53   LEU   CD2    24.881
 53   LEU    CG    26.872
 53   LEU     N   121.096
 54   VAL     H     7.623
 54   VAL    HA     3.670
 54   VAL    HB     2.243
 54   VAL  HG11     0.919
 54   VAL  HG12     0.919
 54   VAL  HG13     0.919
 54   VAL  HG21     1.088
 54   VAL  HG22     1.088
 54   VAL  HG23     1.088
 54   VAL     C   177.866
 54   VAL    CA    65.859
 54   VAL    CB    30.811
 54   VAL   CG1    22.580
 54   VAL   CG2    22.483
 54   VAL     N   119.475
 55   GLN     H     8.099
 55   GLN    HA     3.843
 55   GLN   HB2     2.070
 55   GLN   HB3     2.070
 55   GLN   HG2     2.320
 55   GLN   HG3     2.170
 55   GLN     C   177.664
 55   GLN    CA    59.380
 55   GLN    CB    27.748
 55   GLN    CG    33.875
 55   GLN     N   119.797
 56   THR     H     8.115
 56   THR    HA     3.890
 56   THR    HB     4.237
 56   THR     C   175.810
 56   THR    CA    65.877
 56   THR    CB    68.327
 56   THR   CG2    21.802
 56   THR     N   112.938
 57   LYS     H     7.532
 57   LYS    HA     4.157
 57   LYS   HB2     1.980
 57   LYS   HB3     1.980
 57   LYS   HD2     1.680
 57   LYS   HD3     1.680
 57   LYS   HG2     1.490
 57   LYS   HG3     1.490
 57   LYS     C   178.898
 57   LYS    CA    58.090
 57   LYS    CB    31.091
 57   LYS    CD    29.062
 57   LYS    CE    42.210
 57   LYS    CG    25.072
 57   LYS     N   120.782
 58   LEU     H     7.902
 58   LEU    HA     4.173
 58   LEU   HB2     1.475
 58   LEU   HB3     1.475
 58   LEU  HD11     0.806
 58   LEU  HD12     0.806
 58   LEU  HD13     0.806
 58   LEU  HD21     0.777
 58   LEU  HD22     0.777
 58   LEU  HD23     0.777
 58   LEU    HG     1.830
 58   LEU     C   178.391
 58   LEU    CA    56.571
 58   LEU    CB    41.351
 58   LEU   CD1    23.361
 58   LEU   CD2    23.366
 58   LEU    CG    26.602
 58   LEU     N   119.218
 59   ILE     H     7.775
 59   ILE    HA     4.000
 59   ILE    HB     1.986
 59   ILE  HD11     0.829
 59   ILE  HD12     0.829
 59   ILE  HD13     0.829
 59   ILE     C   177.018
 59   ILE    CA    62.797
 59   ILE    CB    37.761
 59   ILE   CD1    13.504
 59   ILE   CG1    28.372
 59   ILE   CG2    17.472
 59   ILE     N   117.043
 60   GLU     H     8.009
 60   GLU    HA     4.212
 60   GLU   HB2     2.070
 60   GLU   HB3     2.070
 60   GLU   HG2     2.275
 60   GLU   HG3     2.410
 60   GLU     C   177.674
 60   GLU    CA    57.205
 60   GLU    CB    29.263
 60   GLU    CG    36.670
 60   GLU     N   120.016
 61   GLY     H     7.872
 61   GLY     C   173.924
 61   GLY    CA    45.212
 61   GLY     N   107.074
 62   ASP     H     8.061
 62   ASP    HA     4.652
 62   ASP   HB2     2.640
 62   ASP   HB3     2.735
 62   ASP     C   179.962
 62   ASP    CA    54.102
 62   ASP    CB    41.219
 62   ASP     N   120.773
 63   ALA     H     8.307
 63   ALA    HA     4.345
 63   ALA     C   178.264
 63   ALA    CA    52.480
 63   ALA    CB    18.393
 63   ALA     N   124.154
 64   GLY     H     8.370
 64   GLY     C   174.312
 64   GLY    CA    45.144
 64   GLY     N   107.534
 65   GLU     H     8.333
 65   GLU    HA     4.333
 65   GLU   HB2     1.993
 65   GLU   HB3     2.120
 65   GLU   HG2     2.280
 65   GLU   HG3     2.280
 65   GLU     C   177.194
 65   GLU    CA    56.442
 65   GLU    CB    29.559
 65   GLU     N   120.426
 66   GLY     H     8.513
 66   GLY     C   174.261
 66   GLY    CA    45.205
 66   GLY     N   109.639
 67   LYS     H     8.132
 67   LYS    HA     4.315
 67   LYS   HB2     1.770
 67   LYS   HB3     1.770
 67   LYS   HD2     1.673
 67   LYS   HD3     1.673
 67   LYS   HG2     1.390
 67   LYS   HG3     1.430
 67   LYS     C   176.633
 67   LYS    CA    56.286
 67   LYS    CB    32.194
 67   LYS    CD    29.037
 67   LYS    CE    42.200
 67   LYS    CG    24.932
 67   LYS     N   120.276
 68   MET     H     8.427
 68   MET    HA     4.407
 68   MET   HB2     2.030
 68   MET   HB3     2.030
 68   MET   HG2     2.483
 68   MET   HG3     2.540
 68   MET     C   175.546
 68   MET    CA    55.851
 68   MET    CB    33.164
 68   MET    CG    32.212
 68   MET     N   119.453
 69   LYS     H     8.274
 69   LYS    HA     4.355
 69   LYS   HB2     1.810
 69   LYS   HB3     1.810
 69   LYS   HD2     1.640
 69   LYS   HD3     1.640
 69   LYS   HG2     1.333
 69   LYS   HG3     1.333
 69   LYS     C   175.780
 69   LYS    CA    56.273
 69   LYS    CB    32.628
 69   LYS    CD    29.119
 69   LYS    CE    42.030
 69   LYS    CG    24.962
 69   LYS     N   121.534
 70   VAL     H     7.951
 70   VAL    HA     4.045
 70   VAL    HB     1.850
 70   VAL  HG11     0.911
 70   VAL  HG12     0.911
 70   VAL  HG13     0.911
 70   VAL  HG21     0.961
 70   VAL  HG22     0.961
 70   VAL  HG23     0.961
 70   VAL     C   174.318
 70   VAL    CA    62.297
 70   VAL    CB    32.046
 70   VAL   CG1    21.283
 70   VAL   CG2    21.628
 70   VAL     N   118.383
 71   SER     H     7.397
 71   SER     C   174.410
 71   SER    CA    57.520
 71   SER    CB    66.160
 71   SER     N   116.614
 72   LEU     H     8.655
 72   LEU    HA     4.030
 72   LEU   HB2     1.740
 72   LEU   HB3     1.740
 72   LEU  HD11     0.888
 72   LEU  HD12     0.888
 72   LEU  HD13     0.888
 72   LEU  HD21     0.940
 72   LEU  HD22     0.940
 72   LEU  HD23     0.940
 72   LEU    HG     1.660
 72   LEU     C   178.178
 72   LEU    CA    58.259
 72   LEU    CB    41.636
 72   LEU   CD1    24.807
 72   LEU   CD2    25.074
 72   LEU    CG    27.192
 72   LEU     N   124.509
 73   VAL     H     7.959
 73   VAL    HA     3.885
 73   VAL    HB     2.123
 73   VAL  HG11     1.013
 73   VAL  HG12     1.013
 73   VAL  HG13     1.013
 73   VAL  HG21     1.107
 73   VAL  HG22     1.107
 73   VAL  HG23     1.107
 73   VAL     C   177.524
 73   VAL    CA    65.312
 73   VAL    CB    31.041
 73   VAL   CG1    21.905
 73   VAL   CG2    22.313
 73   VAL     N   116.266
 74   LEU     H     7.701
 74   LEU    HA     4.220
 74   LEU   HB2     1.660
 74   LEU   HB3     1.660
 74   LEU  HD11     0.869
 74   LEU  HD12     0.869
 74   LEU  HD13     0.869
 74   LEU  HD21     0.922
 74   LEU  HD22     0.922
 74   LEU  HD23     0.922
 74   LEU    HG     1.660
 74   LEU     C   179.351
 74   LEU    CA    57.208
 74   LEU    CB    41.911
 74   LEU   CD1    23.960
 74   LEU   CD2    25.163
 74   LEU    CG    27.262
 74   LEU     N   119.454
 75   VAL     H     7.980
 75   VAL    HA     3.770
 75   VAL    HB     2.140
 75   VAL  HG11     0.908
 75   VAL  HG12     0.908
 75   VAL  HG13     0.908
 75   VAL  HG21     1.075
 75   VAL  HG22     1.075
 75   VAL  HG23     1.075
 75   VAL     C   176.915
 75   VAL    CA    59.380
 75   VAL    CB    31.488
 75   VAL   CG1    21.524
 75   VAL   CG2    23.333
 75   VAL     N   119.505
 77   ALA     H     8.276
 77   ALA    HA     3.885
 77   ALA     C   179.500
 77   ALA    CA    54.942
 77   ALA    CB    17.619
 77   ALA     N   119.560
 78   GLN     H     8.284
 78   GLN    HA     4.050
 78   GLN   HB2     2.120
 78   GLN   HB3     2.120
 78   GLN   HG2     2.420
 78   GLN   HG3     2.610
 78   GLN     C   177.993
 78   GLN    CA    58.746
 78   GLN    CB    29.032
 78   GLN    CG    34.653
 78   GLN     N   116.922
 79   LEU     H     8.419
 79   LEU    HA     4.020
 79   LEU   HB2     1.530
 79   LEU   HB3     1.530
 79   LEU  HD11     0.816
 79   LEU  HD12     0.816
 79   LEU  HD13     0.816
 79   LEU  HD21     0.759
 79   LEU  HD22     0.759
 79   LEU  HD23     0.759
 79   LEU    HG     1.327
 79   LEU     C   179.360
 79   LEU    CA    58.366
 79   LEU    CB    40.264
 79   LEU   CD1    24.239
 79   LEU   CD2    26.299
 79   LEU    CG    27.122
 79   LEU     N   120.615
 80   HIS     H     7.537
 80   HIS    HA     3.755
 80   HIS     C   177.428
 80   HIS    CA    60.881
 80   HIS    CB    30.317
 80   HIS     N   119.658
 81   LEU     H     8.642
 81   LEU    HA     4.083
 81   LEU   HB2     1.650
 81   LEU   HB3     1.650
 81   LEU  HD11     0.705
 81   LEU  HD12     0.705
 81   LEU  HD13     0.705
 81   LEU  HD21     0.797
 81   LEU  HD22     0.797
 81   LEU  HD23     0.797
 81   LEU    HG     1.650
 81   LEU     C   179.222
 81   LEU    CA    58.205
 81   LEU    CB    41.021
 81   LEU   CD1    24.442
 81   LEU   CD2    25.101
 81   LEU    CG    27.372
 81   LEU     N   121.240
 82   MET     H     9.460
 82   MET    HA     3.920
 82   MET   HB2     2.230
 82   MET   HB3     2.230
 82   MET     C   180.973
 82   MET    CA    59.587
 82   MET    CB    32.556
 82   MET     N   115.959
 83   THR     H     7.661
 83   THR    HB     4.245
 83   THR     C   176.301
 83   THR    CA    65.720
 83   THR    CB    68.129
 83   THR   CG2    22.352
 83   THR     N   110.240
 84   SER     H     7.843
 84   SER    HA     4.145
 84   SER     C   175.809
 84   SER    CA    62.572
 84   SER    CB    63.129
 84   SER     N   118.353
 85   MET     H     8.647
 85   MET    HA     4.040
 85   MET   HB2     2.550
 85   MET   HB3     2.780
 85   MET   HG2     2.075
 85   MET   HG3     2.075
 85   MET     C   177.452
 85   MET    CA    59.146
 85   MET    CB    32.622
 85   MET    CG    33.370
 85   MET     N   120.631
 86   LEU     H     7.572
 86   LEU    HA     4.247
 86   LEU   HB2     1.575
 86   LEU   HB3     1.840
 86   LEU    HG     1.570
 86   LEU     C   178.100
 86   LEU    CA    57.361
 86   LEU    CB    40.834
 86   LEU    CG    27.302
 86   LEU     N   119.058
 87   ALA     H     8.095
 87   ALA    HA     3.930
 87   ALA     C   178.523
 87   ALA    CA    55.356
 87   ALA    CB    16.560
 87   ALA     N   118.278
 88   ARG     H     8.152
 88   ARG    HA     3.580
 88   ARG   HB2     1.770
 88   ARG   HB3     1.770
 88   ARG   HG2     1.670
 88   ARG   HG3     1.670
 88   ARG     C   179.550
 88   ARG    CA    60.515
 88   ARG    CB    28.273
 88   ARG    CG    27.462
 88   ARG     N   115.775
 89   GLU     H     8.490
 89   GLU    HA     3.850
 89   GLU   HB2     2.070
 89   GLU   HB3     2.070
 89   GLU   HG2     2.375
 89   GLU   HG3     2.375
 89   GLU     C   179.910
 89   GLU    CA    59.329
 89   GLU    CB    29.098
 89   GLU    CG    36.530
 89   GLU     N   120.153
 90   LEU     H     8.400
 90   LEU    HA     4.275
 90   LEU    HG     2.172
 90   LEU     C   179.919
 90   LEU    CA    56.902
 90   LEU    CB    40.396
 90   LEU     N   117.829
 91   ILE     H     9.146
 91   ILE    HA     3.740
 91   ILE    HB     1.890
 91   ILE  HD11     0.145
 91   ILE  HD12     0.145
 91   ILE  HD13     0.145
 91   ILE     C   178.302
 91   ILE    CA    65.938
 91   ILE    CB    36.476
 91   ILE   CD1    12.996
 91   ILE   CG1    31.667
 91   ILE   CG2    19.224
 91   ILE     N   121.699
 92   THR     H     8.099
 92   THR    HA     3.825
 92   THR    HB     4.503
 92   THR     C   176.174
 92   THR    CA    67.945
 92   THR    CB    68.755
 92   THR   CG2    21.292
 92   THR     N   117.124
 93   GLU     H     6.943
 93   GLU    HA     4.170
 93   GLU     C   180.025
 93   GLU    CA    57.318
 93   GLU    CB    28.110
 93   GLU     N   117.675
 94   LEU     H     8.207
 94   LEU    HA     4.170
 94   LEU   HB2     1.650
 94   LEU   HB3     1.650
 94   LEU    HG     1.999
 94   LEU     C   178.939
 94   LEU    CA    57.312
 94   LEU    CB    41.450
 94   LEU     N   121.835
 95   ILE     H     8.796
 95   ILE    HA     3.563
 95   ILE    HB     2.130
 95   ILE  HD11     0.825
 95   ILE  HD12     0.825
 95   ILE  HD13     0.825
 95   ILE     C   177.323
 95   ILE    CA    66.915
 95   ILE    CB    37.003
 95   ILE   CD1    14.342
 95   ILE   CG2    16.430
 95   ILE     N   120.799
 96   GLU     H     7.584
 96   GLU    HA     4.173
 96   GLU   HB2     2.212
 96   GLU   HB3     2.212
 96   GLU   HG2     2.567
 96   GLU   HG3     2.567
 96   GLU     C   179.704
 96   GLU    CA    59.409
 96   GLU    CB    28.703
 96   GLU    CG    36.790
 96   GLU     N   117.848
 97   LEU     H     7.486
 97   LEU    HA     3.894
 97   LEU   HB2     1.040
 97   LEU   HB3     1.040
 97   LEU    HG     1.390
 97   LEU     C   178.248
 97   LEU    CA    58.298
 97   LEU    CB    42.043
 97   LEU    CG    28.737
 97   LEU     N   119.451
 98   HIS     H     8.080
 98   HIS    HA     4.310
 98   HIS   HB2     3.390
 98   HIS   HB3     3.390
 98   HIS   HD2     6.924
 98   HIS     C   178.771
 98   HIS    CA    61.648
 98   HIS    CB    29.954
 98   HIS     N   116.886
 99   GLU     H     8.392
 99   GLU    HA     3.945
 99   GLU   HB2     2.115
 99   GLU   HB3     2.115
 99   GLU     C   178.669
 99   GLU    CA    59.062
 99   GLU    CB    28.373
 99   GLU     N   120.797
100   LYS     H     7.750
100   LYS    HA     4.107
100   LYS   HB2     1.977
100   LYS   HB3     1.977
100   LYS   HD2     1.730
100   LYS   HD3     1.730
100   LYS   HG2     1.570
100   LYS   HG3     1.720
100   LYS     C   177.941
100   LYS    CA    57.781
100   LYS    CB    31.898
100   LYS    CD    29.462
100   LYS    CE    42.090
100   LYS    CG    25.595
100   LYS     N   118.642
101   LEU     H     7.493
101   LEU    HA     4.252
101   LEU   HB2     1.748
101   LEU   HB3     1.748
101   LEU    HG     1.750
101   LEU     C   177.033
101   LEU    CA    55.203
101   LEU    CB    41.351
101   LEU    CG    26.872
101   LEU     N   118.214
102   LYS     H     7.422
102   LYS    HA     4.369
102   LYS   HB2     2.010
102   LYS   HB3     2.055
102   LYS   HD2     1.800
102   LYS   HD3     1.800
102   LYS   HG2     1.630
102   LYS   HG3     1.630
102   LYS     C   175.189
102   LYS    CA    56.080
102   LYS    CB    31.766
102   LYS    CD    29.222
102   LYS    CE    42.288
102   LYS    CG    24.544
102   LYS     N   120.035
103   ALA     H     7.834
103   ALA    HA     4.185
103   ALA    CA    53.540
103   ALA    CB    19.184
103   ALA     N   131.157



Please acknowledge these references in publications where the data from this site have been utilized.

Contact the webmaster for help, if required. Thursday, April 25, 2024 1:32:36 AM GMT (wattos1)