NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     G  4.0268 8.3393 109.7419 45.6541  0.0000 173.1358
  2     H  4.7635 8.8210 119.8026 53.1140 31.2939 171.2508
  3     R  4.4947 8.3166 121.5560 53.6235 33.0438 175.2534
  4     P  4.4244 0.0000   0.0000 62.9756 31.4998 176.1151

  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 4.03 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  8.82 4.76 0.00 3.31 3.21 0.00 5.47 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  3     R  8.32 4.49 0.00 1.77 1.85 0.00 3.34 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.50 0.00 
  4     P  0.00 4.42 0.00 2.17 2.02 0.00 3.75 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.92 0.00