NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     R  4.2829 8.2549 117.2839 55.6378 30.7304 174.5477
  2     R  4.0528 8.2790 117.8622 55.0533 30.8257 174.3106
  3     R  4.4938 8.4455 119.3490 54.3929 32.3954 174.8338
  4     W  4.6049 8.8351 135.0000 56.2432 30.7124 175.1051
  5     R  4.0555 8.3349 127.1175 54.3180 30.6063 175.6935
  6     R  3.6886 7.3893 122.1670 57.6413 30.2947 177.2514
  7     L  3.9882 7.4073 118.6161 54.7143 42.1284 176.5720
  8     T  4.4290 8.0447 112.8512 60.3111 70.6746 175.1695
  9     V  3.8012 8.1020 114.5087 61.8077 31.6846 176.3749

  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     R  8.25 4.28 0.00 1.95 2.04 0.00 3.02 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.69 0.00 
  2     R  8.28 4.05 0.00 1.95 1.97 0.00 3.21 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 
  3     R  8.45 4.49 0.00 1.78 1.83 0.00 3.41 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 
  4     W  8.84 4.60 0.00 3.36 2.96 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 
  5     R  8.33 4.06 0.00 1.64 1.69 0.00 3.19 0.00 0.00 3.19 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.38 0.00 
  6     R  7.39 3.69 0.00 1.63 0.66 0.00 3.04 0.00 0.00 3.09 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.40 0.00 
  7     L  7.41 3.99 0.00 1.49 1.56 0.82 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 
  8     T  8.04 4.43 4.22 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 1.19 0.00 0.00 
  9     V  8.10 3.80 2.06 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 0.66 0.00 0.00 0.92 0.00 0.00