NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  18    R  4.3621 8.0600 119.1044 55.5429 32.3218 176.3995
  19    F  4.0595 8.4545 122.4505 61.6155 39.1117 175.4863
  20    M  4.0415 8.9935 119.0977 58.5132 31.7346 177.8714
  21    D  4.2436 7.6921 119.1013 57.3809 40.9455 178.3439
  22    Y  4.3361 7.0530 116.6630 60.5770 38.2954 177.6269
  23    W  3.8890 8.2377 129.5876 60.1101 30.4931 177.7534
  24    E  4.1795 8.2005 117.8749 58.7349 28.8790 178.9797
  25    G  3.6540 7.6970 104.8240 46.8188  0.0000 173.5823
  26    L  3.9563 7.1483 124.7869 54.9377 41.5085 176.7400

  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   
  18    R  8.06 4.36 0.00 1.82 1.76 0.00 3.45 0.00 0.00 3.28 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 
  19    F  8.45 4.06 0.00 3.28 3.10 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 
  20    M  8.99 4.04 0.00 2.08 2.12 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.72 0.00 
  21    D  7.69 4.24 0.00 2.13 2.44 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 
  22    Y  7.05 4.34 0.00 3.04 2.86 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 
  23    W  8.24 3.89 0.00 2.57 2.80 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 
  24    E  8.20 4.18 0.00 2.13 1.99 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 2.37 2.54 0.00 
  25    G  7.70 3.65 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 0.00 
  26    L  7.15 3.96 0.00 1.12 1.23 -0.84 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00