NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     Q  4.3591 8.3444 119.6944 55.4033 29.7614 174.7253
  2     F  3.9779 8.7610 125.7216 55.6134 40.0971 173.3242
  3     K  4.1066 8.4451 126.1250 57.3551 34.3824 176.7186
  4     D  4.7845 8.2925 121.1795 52.9619 39.5484 177.2202
  5     N  4.6678 7.6256 114.7600 51.6407 41.6077 175.2960
  6     V  3.9467 8.3646 124.5084 61.8747 31.3804 175.3244
  7     I  4.5215 8.1704 128.0682 59.4252 39.6868 175.1969
  8     L  4.5701 8.3214 125.3348 52.9897 43.1214 176.7125
  9     L  4.1680 8.4264 120.7904 55.2518 41.5059 177.1254

  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     Q  8.34 4.36 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.95 0.00 0.00 0.00 0.00 0.00 2.30 2.38 0.00 
  2     F  8.76 3.98 0.00 3.07 2.97 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     K  8.45 4.11 0.00 1.83 1.61 0.00 1.54 0.00 0.00 1.53 0.00 0.00 2.91 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.93 1.44 7.81 
  4     D  8.29 4.78 0.00 2.71 2.69 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     N  7.63 4.67 0.00 2.65 2.72 0.00 0.00 7.16 7.68 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 
  6     V  8.36 3.95 2.10 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 0.82 0.00 0.00 0.95 0.00 0.00 
  7     I  8.17 4.52 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.96 0.91 0.00 0.00 
  8     L  8.32 4.57 0.00 1.63 1.59 0.93 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 
  9     L  8.43 4.17 0.00 1.62 1.59 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00