NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     K  4.3149 8.2993 120.1376 56.2869 33.5084 175.5137
  2     T  4.0089 8.2929 112.9624 60.4808 69.6142 172.7147
  3     F  4.7049 9.3124 126.1166 56.5786 41.2566 175.1266
  4     P  4.3024 0.0000   0.0000 61.3400 31.8261 174.3588
  5     P  4.1017 0.0000   0.0000 63.4617 31.5861 176.8727
  6     T  4.2981 8.0873 116.9629 60.4997 69.1845 173.5711
  7     E  4.0905 8.5128 121.2240 55.7198 29.8925 175.6180
  8     P  4.3915 0.0000   0.0000 62.6399 32.1218 176.6822
  9     K  4.1767 8.4666 118.8388 56.8898 32.0271 177.1724

  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  8.30 4.31 0.00 1.79 1.84 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.36 1.45 7.81 
  2     T  8.29 4.01 4.28 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 1.24 0.00 0.00 
  3     F  9.31 4.70 0.00 2.89 2.99 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 0.00 0.00 0.00 
  4     P  0.00 4.30 0.00 1.75 1.80 0.00 3.21 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.97 0.00 
  5     P  0.00 4.10 0.00 1.96 1.96 0.00 3.54 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.03 0.00 
  6     T  8.09 4.30 4.46 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 1.27 0.00 0.00 
  7     E  8.51 4.09 0.00 2.02 1.89 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 2.32 2.30 0.00 
  8     P  0.00 4.39 0.00 2.04 1.99 0.00 3.67 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 
  9     K  8.47 4.18 0.00 1.75 1.73 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.44 7.81