NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     D  4.4768 8.3649 120.5153 53.9127 42.3347 174.4774
  2     Y  4.2846 8.1859 118.0752 57.6332 38.4459 174.0397
  3     Q  4.7462 9.2239 122.9707 53.5902 33.5025 175.2783
  4     R  3.9467 8.5095 119.9709 56.3141 30.6148 176.2031
  5     L  4.0135 8.7279 124.7804 56.4132 42.7644 176.1718
  6     N  4.4454 8.4620 122.4497 53.6438 38.3744 173.9646

  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     D  8.36 4.48 0.00 2.65 2.70 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 
  2     Y  8.19 4.28 0.00 3.09 2.81 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 
  3     Q  9.22 4.75 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.91 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 
  4     R  8.51 3.95 0.00 1.81 1.88 0.00 3.36 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.57 0.00 
  5     L  8.73 4.01 0.00 1.60 1.58 0.93 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 
  6     N  8.46 4.45 0.00 2.82 3.11 0.00 0.00 6.99 7.56 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