NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     N  4.6793 8.4093 118.1255 52.3375 38.8786 171.8948
  2     S  3.7891 8.0560 114.4491 58.2728 63.2647 173.3457
  3     T  4.6207 9.1825 122.8642 61.6625 71.6658 175.1814
  4     L  4.8500 7.9714 124.6018 54.2874 44.6543 176.7113
  5     Q  3.9090 8.6690 118.0250 57.3542 28.6399 173.4534

  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     N  8.41 4.68 0.00 2.73 2.87 0.00 0.00 6.91 6.68 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     S  8.06 3.79 0.00 4.05 3.92 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     T  9.18 4.62 4.24 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 1.21 0.00 0.00 
  4     L  7.97 4.85 0.00 1.60 1.60 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 
  5     Q  8.67 3.91 0.00 2.20 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.65 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00