NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     R  4.3251 8.2549 117.2848 55.6777 30.7786 174.9805
  2     R  4.0300 8.2400 117.9343 54.7628 30.8186 175.0353
  3     R  4.1555 8.4626 120.6726 55.9924 31.7826 176.0953
  4     W  4.3083 9.0134 135.0000 60.4176 31.0843 176.5538
  5     R  3.9130 7.8993 117.5493 55.8480 30.1229 176.1378
  6     R  4.1445 8.0496 120.9807 55.9328 30.5143 175.5666
  7     L  4.5899 7.9924 120.0241 53.8557 45.1209 175.0361
  8     T  4.6651 8.3407 115.3436 59.6051 71.5444 173.7591
  9     L  4.2331 8.4022 122.3571 55.9934 40.7932 176.2971

  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 4.33 0.00 1.97 2.03 0.00 3.03 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 1.70 0.00 
  2     R  8.24 4.03 0.00 1.96 1.93 0.00 3.23 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 
  3     R  8.46 4.16 0.00 1.80 1.86 0.00 3.27 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 
  4     W  9.01 4.31 0.00 3.39 3.12 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  7.90 3.91 0.00 1.92 1.84 0.00 3.36 0.00 0.00 3.32 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 
  6     R  8.05 4.14 0.00 1.84 1.73 0.00 2.98 0.00 0.00 3.10 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 
  7     L  7.99 4.59 0.00 1.52 1.49 0.91 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 
  8     T  8.34 4.67 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 1.18 0.00 0.00 
  9     L  8.40 4.23 0.00 1.74 1.67 0.91 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00