NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     K  4.0589 8.4145 121.7884 56.0393 32.5029 175.1036

  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  8.41 4.06 0.00 1.71 1.76 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.50 7.81