NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  16    K  4.3389 8.3149 122.1412 54.0243 33.0402 175.5479
  17    R  3.9256 8.5071 124.1025 53.6833 30.5911 174.5074
  18    H  4.8156 8.5911 117.7276 54.7240 31.8899 173.1075
  19    R  4.8599 8.1953 117.0099 54.1759 32.8489 172.2727
  20    K  4.8168 8.2925 112.3014 56.4553 35.6983 176.3419
  21    V  4.3965 8.0034 120.4143 61.2734 34.6136 174.6226
  22    L  4.1897 8.5531 127.2977 55.3228 41.9643 176.0477

  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   
  16    K  8.31 4.34 0.00 1.79 1.70 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.04 7.81 
  17    R  8.51 3.93 0.00 1.86 1.84 0.00 3.13 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 
  18    H  8.59 4.82 0.00 3.20 3.32 0.00 5.66 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  19    R  8.20 4.86 0.00 1.80 1.74 0.00 3.21 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.17 0.00 
  20    K  8.29 4.82 0.00 1.69 1.70 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.41 7.81 
  21    V  8.00 4.40 2.09 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 0.77 0.00 0.00 0.94 0.00 0.00 
  22    L  8.55 4.19 0.00 1.62 1.52 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00