NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  16    K  4.2908 8.3149 120.1346 56.2822 33.4812 174.7655
  17    R  4.3080 8.4046 122.8718 53.0721 31.6154 174.5602
  18    H  4.9112 9.1617 118.8258 54.7742 32.1572 176.0583
  19    R  4.4495 7.7772 118.9506 56.2120 30.3831 177.9293
 *21    V  3.7925 8.3232 126.1849 63.5357 32.1196 173.8734
  22    L  4.7206 8.4536 128.6219 53.1149 43.8708 175.1378
  23    R  4.7497 8.0948 120.3682 53.7693 32.8435 174.8533
  24    D  4.5408 8.7495 116.7424 54.9944 40.7765 176.8867

  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 4.29 0.00 1.77 1.84 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.47 7.81 
  17    R  8.40 4.31 0.00 1.85 1.80 0.00 3.18 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 
  18    H  9.16 4.91 0.00 3.22 3.33 0.00 5.66 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  19    R  7.78 4.45 0.00 1.79 1.40 0.00 3.24 0.00 0.00 3.15 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 
 *21    V  8.32 3.79 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 0.76 0.00 0.00 0.94 0.00 0.00 
  22    L  8.45 4.72 0.00 1.60 1.51 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 
  23    R  8.09 4.75 0.00 1.88 1.85 0.00 3.16 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.67 0.00 
  24    D  8.75 4.54 0.00 2.67 2.65 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 


* Residues marked with a * may have inaccurate shift predictions.