NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1000   H  4.6211 8.3027 120.3902 55.8238 31.2243 173.3857
  1001   M  3.6874 8.6420 126.7778 58.4545 32.0121 176.2960
  1002   L  4.1592 8.8720 118.0249 57.4881 43.0773 176.4474
  1003   E  4.1593 8.2307 122.4004 56.6056 29.2764 176.5327

  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   
  1000   H  8.30 4.62 0.00 3.25 3.25 0.00 5.88 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  1001   M  8.64 3.69 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.61 0.00 
  1002   L  8.87 4.16 0.00 1.75 1.75 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 
  1003   E  8.23 4.16 0.00 2.03 1.88 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 2.53 2.43 0.00