NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     K  4.2668 8.3149 121.7915 55.8863 33.3587 175.6089
  2     L  4.1539 8.3084 125.6187 51.8403 42.3532 174.5354
  3     P  4.3464 0.0000   0.0000 62.8522 32.7176 176.0350
  4     A  4.3079 8.1724 121.2458 53.1004 19.3486 177.5885
  5     Q  4.4261 7.1245 113.2353 53.8598 32.1539 174.8068
  6     F  4.3137 7.6891 117.6183 55.8616 43.0101 173.6901
  7     Y  4.8252 8.3805 120.3666 56.2125 41.0595 174.9641
  8     I  4.4031 8.2578 122.1000 59.9214 38.6303 176.2315
  9     L  4.2346 8.5303 124.0578 55.0856 41.5723 176.7344

  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     K  8.31 4.27 0.00 1.74 1.79 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.49 7.81 
  2     L  8.31 4.15 0.00 1.86 1.78 0.98 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 
  3     P  0.00 4.35 0.00 1.78 1.94 0.00 3.90 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.92 0.00 
  4     A  8.17 4.31 1.25 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 
  5     Q  7.12 4.43 0.00 1.58 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.68 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 
  6     F  7.69 4.31 0.00 2.93 2.88 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 
  7     Y  8.38 4.83 0.00 3.02 2.88 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 
  8     I  8.26 4.40 1.94 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.59 0.95 0.00 0.00 
  9     L  8.53 4.23 0.00 1.67 1.60 0.95 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00