NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     S  4.3958 8.3349 115.2898 58.2263 63.4510 172.3974
  2     L  4.6161 8.2419 118.1172 51.6175 43.6159 174.1502
  3     K  4.6261 8.1844 119.0697 54.8362 36.4476 175.3673
  4     L  4.0381 8.3680 122.5345 55.7906 42.5867 176.5684
  5     M  4.2402 8.7244 126.4528 57.4000 32.6606 175.9395
  6     T  4.4636 7.0772 104.5808 61.3455 70.9760 171.7226
  7     T  4.6291 8.3557 110.3957 60.3958 71.3870 174.0278
  8     V  4.0087 8.3763 117.6646 61.4781 32.2871 175.3656

  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     S  8.33 4.40 0.00 3.85 3.89 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     L  8.24 4.62 0.00 1.74 1.55 0.92 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 
  3     K  8.18 4.63 0.00 1.80 1.72 0.00 1.58 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.30 1.42 7.81 
  4     L  8.37 4.04 0.00 1.61 1.62 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 
  5     M  8.72 4.24 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.46 0.00 
  6     T  7.08 4.46 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 
  7     T  8.36 4.63 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 
  8     V  8.38 4.01 2.08 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 0.73 0.00 0.00 0.93 0.00 0.00