NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  500   R  4.3562 8.2549 119.7064 55.9004 31.5100 175.5989
  501   R  3.7081 8.4641 120.7001 56.8304 30.3974 176.2376
  502   G  3.8128 7.8804 105.3185 44.4564  0.0000 172.9363
  503   I  3.9888 8.0898 111.3679 61.0225 37.9296 175.5060

  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   
  500   R  8.25 4.36 0.00 1.82 1.93 0.00 3.18 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 
  501   R  8.46 3.71 0.00 1.88 1.99 0.00 3.25 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 
  502   G  7.88 3.81 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 
  503   I  8.09 3.99 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.67 0.91 0.00 0.00