NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     K  4.1275 8.3149 119.9703 56.4054 33.9328 175.3095
  2     Y  4.0603 8.2399 118.8728 57.0479 38.5749 174.4109
  3     K  4.2032 8.7514 122.7296 56.6122 33.5607 175.2813

  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     K  8.31 4.13 0.00 1.88 1.85 0.00 1.54 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.45 7.81 
  2     Y  8.24 4.06 0.00 3.10 2.94 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     K  8.75 4.20 0.00 1.68 1.64 0.00 1.82 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.41 7.81