NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     E  4.3218 8.4449 118.7961 55.6097 30.9870 174.9143
  2     L  3.9997 8.1062 118.8077 53.2986 42.3982 175.7031
  3     D  4.4865 8.6257 121.1694 53.8304 42.8893 176.5415
  4     K  3.5657 8.6031 124.4718 59.4141 31.9427 177.0489
  5     Y  4.6030 8.3054 113.6229 57.5873 37.9834 175.6573
  6     A  4.2640 7.6609 123.2029 52.8018 19.4260 178.8291
  7     S  4.3868 8.5776 114.3198 59.0029 62.3713 169.7075

  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     E  8.44 4.32 0.00 2.08 2.05 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 2.16 2.27 0.00 
  2     L  8.11 4.00 0.00 1.73 1.63 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 
  3     D  8.63 4.49 0.00 2.77 2.57 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 
  4     K  8.60 3.57 0.00 1.52 1.28 0.00 1.63 0.00 0.00 1.36 0.00 0.00 2.91 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.46 1.14 7.81 
  5     Y  8.31 4.60 0.00 3.10 2.95 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 
  6     A  7.66 4.26 1.32 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 
  7     S  8.58 4.39 0.00 4.05 4.01 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