NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     E  4.2632 8.4293 121.4689 55.7000 30.9433 176.1255
  2     S  4.1854 8.3319 121.0852 57.3747 65.1232 173.6661
  3     Q  3.9256 8.7427 123.8275 59.2091 29.2079 179.4659
  4     L  3.9343 7.8750 120.9580 58.4967 42.1651 178.3468
  5     H  4.0764 8.3926 118.1678 59.0932 29.5597 177.0119
  6     S  4.2131 8.0921 114.2477 61.7103 62.2970 175.7223
  7     N  4.4859 8.0748 117.6686 56.2585 38.3276 177.3239
  8     K  4.1119 8.1040 119.3116 59.2836 32.2152 177.8752
  9     R  4.1768 7.9140 121.8866 56.4588 30.1185 176.3689

  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  8.43 4.26 0.00 1.95 1.94 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 2.23 2.34 0.00 
  2     S  8.33 4.19 0.00 4.18 3.98 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 
  3     Q  8.74 3.93 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.94 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 
  4     L  7.88 3.93 0.00 1.80 1.66 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 
  5     H  8.39 4.08 0.00 3.25 3.40 0.00 5.65 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  6     S  8.09 4.21 0.00 3.99 4.17 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     N  8.07 4.49 0.00 2.89 2.86 0.00 0.00 7.20 7.17 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 
  8     K  8.10 4.11 0.00 1.74 1.82 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.15 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.45 1.63 7.81 
  9     R  7.91 4.18 0.00 2.01 1.83 0.00 3.20 0.00 0.00 3.32 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.58 0.00