NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     L  4.3656 8.1849 122.4939 54.9596 43.2134 175.9191
  2     S  4.6002 8.3699 120.6640 56.4383 66.9547 172.4908
  3     F  4.8790 9.3009 125.7283 56.7900 43.2686 173.6143
  4     S  4.4858 7.3013 121.6814 56.8005 66.7470 173.6147
  5     K  4.3093 8.2350 124.0503 55.2674 34.8215 175.5720
  6     D  4.5541 8.6542 125.0343 54.4703 41.1024 176.0679

  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     L  8.18 4.37 0.00 1.62 1.67 0.95 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 
  2     S  8.37 4.60 0.00 3.95 3.71 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     F  9.30 4.88 0.00 2.92 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  4     S  7.30 4.49 0.00 3.63 3.54 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 
  5     K  8.23 4.31 0.00 1.49 1.66 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.53 7.81 
  6     D  8.65 4.55 0.00 2.65 2.51 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