NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     E  4.3579 8.3033 120.2299 57.1725 32.0471 178.6372
  2     S  3.7834 7.6482 114.9290 60.4172 62.8308 174.9183
  3     Q  3.9590 8.9425 121.1931 58.3691 29.3950 176.8564
  4     L  4.4495 7.5330 118.7008 56.6365 43.0518 178.0505
  5     H  4.2537 8.5810 116.4398 58.7655 28.3516 177.5116
  6     S  3.9926 8.2909 114.8072 60.9197 62.3360 174.9137
  7     N  4.4530 8.7434 118.0406 54.4369 38.8812 177.9126
  8     K  3.9818 8.7905 118.2212 59.1470 34.3528 174.3402
  9     R  4.1866 7.9208 123.7781 56.7423 30.6661 175.9209

  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  8.30 4.36 0.00 2.09 2.17 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 2.33 2.36 0.00 
  2     S  7.65 3.78 0.00 3.97 3.88 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 0.00 0.00 0.00 
  3     Q  8.94 3.96 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.85 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 
  4     L  7.53 4.45 0.00 1.72 1.54 0.89 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 
  5     H  8.58 4.25 0.00 3.21 3.39 0.00 5.85 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  6     S  8.29 3.99 0.00 3.96 4.05 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 0.00 0.00 0.00 
  7     N  8.74 4.45 0.00 2.72 2.93 0.00 0.00 6.81 6.68 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  8.79 3.98 0.00 2.05 2.14 0.00 1.91 0.00 0.00 1.73 0.00 0.00 3.13 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.48 7.81 
  9     R  7.92 4.19 0.00 1.96 1.89 0.00 3.37 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 0.00