NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  2     F  4.4555 8.3249 122.8240 58.1524 40.5083 175.4119
 *4     S  4.0959 7.7634 115.7331 57.8765 62.8357 173.7939
 *7     L  4.0385 8.0632 124.8731 54.8756 43.7915 178.1623
  8     Q  4.0862 7.5733 116.3225 58.7402 28.9701 177.5050
  9     G  3.6470 7.6242 107.9701 44.3591  0.0000 173.4550
 *12    A  4.1118 7.8972 124.8372 51.8687 21.3040 177.6829
  13    A  4.4029 7.9410 121.2703 49.7871 17.7532 174.8390
 *15    P  4.0121 0.0000   0.0000 61.9325 33.0501 177.7004
 *19    Q  4.0927 8.6460 120.3279 56.1544 29.0283 174.9478

  NUM RES  H    HA   HB   HB2  HB3  HD1  HD2  HD21 HD22 HD3  HE   HE1  HE2  HE21 HE22 HE3  HG   HG1  HG12 HG13 HG2  HG3  HZ   
  2     F  8.32 4.46 0.00 2.95 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
 *4     S  7.76 4.10 0.00 3.94 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
 *7     L  8.06 4.04 0.00 1.56 1.70 0.90 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 
  8     Q  7.57 4.09 0.00 1.95 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 7.14 0.00 0.00 0.00 0.00 0.00 2.37 2.28 0.00 
  9     G  7.62 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
 *12    A  7.90 4.11 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  13    A  7.94 4.40 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
 *15    P  0.00 4.01 0.00 2.21 2.12 0.00 3.87 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 
 *19    Q  8.65 4.09 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.68 0.00 0.00 0.00 0.00 0.00 2.43 2.30 0.00 


* Residues marked with a * may have inaccurate shift predictions.