NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     C  4.4677 8.1914 120.8372 59.1396 32.8641 172.3929
  2     G  3.4214 8.4496 118.2659 42.9039  0.0000 175.7854
  3     G  4.0187 8.3395 113.8429 45.0118  0.0000 171.8584
  4     I  3.7979 8.4257 112.0451 63.5657 37.6177 176.3910
  5     R  4.3887 7.3101 112.8587 55.4486 32.6402 175.9046
  6     G  3.8437 8.5240 112.9639 42.5422  0.0000 173.9949
  7     E  4.4352 7.5235 116.8331 56.1158 31.7866 175.3229
  8     R  4.5755 8.2602 125.7984 54.8469 32.0308 175.1526
  9     A  4.1456 8.4638 123.1898 52.4420 19.3749 176.4296

  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   
  1     C  8.19 4.47 0.00 2.97 2.88 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 
  2     G  8.45 3.42 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 
  3     G  8.34 4.02 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 
  4     I  8.43 3.80 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.63 0.91 0.00 0.00 
  5     R  7.31 4.39 0.00 1.93 1.89 0.00 3.05 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.51 0.00 
  6     G  8.52 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 0.00 0.00 0.00 
  7     E  7.52 4.44 0.00 1.89 1.82 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 2.20 2.25 0.00 
  8     R  8.26 4.58 0.00 1.78 1.80 0.00 3.29 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 
  9     A  8.46 4.15 1.21 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