NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     G  3.9294 8.3393 109.7402 45.9274  0.0000 171.8601
  2     H  4.8288 8.6039 114.4645 53.3357 31.0149 173.1240
  3     R  4.4583 7.8536 118.2496 53.0666 31.0562 175.3889
  4     P  4.4366 0.0000   0.0000 62.7825 31.2384 177.2631

  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     G  8.34 3.93 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 0.00 0.00 0.00 
  2     H  8.60 4.83 0.00 3.34 3.28 0.00 5.47 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  3     R  7.85 4.46 0.00 1.76 1.85 0.00 3.35 0.00 0.00 3.24 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.50 0.00 
  4     P  0.00 4.44 0.00 2.18 2.08 0.00 3.65 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.90 0.00