NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     K  4.2153 8.3101 120.1333 55.8894 33.5259 175.3811
  2     A  3.9276 8.2125 124.5340 51.0052 18.9317 172.4814
  3     V  3.8321 8.2083 120.3916 62.8106 33.2562 173.7987
  4     Y  4.5271 8.0451 122.7100 55.1246 39.5654 174.4852
  5     N  4.6269 8.7290 124.0696 53.8306 40.8713 174.9865
  6     F  4.3153 8.8357 117.8563 57.1375 38.0389 179.5344
  7     A  4.1175 9.3373 128.6238 53.1502 18.7811 178.6167
  8     T  4.2648 8.1611 111.5256 61.0662 70.0360 174.6202
  9     M  4.2489 8.4030 119.9927 55.7632 31.9800 176.6660

  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 4.22 0.00 1.76 1.80 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.44 7.81 
  2     A  8.21 3.93 1.18 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 
  3     V  8.21 3.83 2.11 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 0.91 0.00 0.00 0.96 0.00 0.00 
  4     Y  8.05 4.53 0.00 2.79 2.31 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  8.73 4.63 0.00 2.77 2.81 0.00 0.00 7.08 7.45 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     F  8.84 4.32 0.00 3.01 2.38 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     A  9.34 4.12 1.29 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 
  8     T  8.16 4.26 4.26 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 1.23 0.00 0.00 
  9     M  8.40 4.25 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.55 0.00