NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  16    K  4.3493 8.3149 120.1340 56.3308 32.4155 174.6168
  17    R  4.4980 8.1730 121.6687 52.6155 34.0060 172.8895
  18    H  4.9543 9.1524 116.3374 53.9301 32.2400 171.9658
  19    R  4.6843 8.2747 117.8534 54.3412 32.8180 175.2193
  20    K  4.7315 8.3067 116.8723 54.8162 35.0192 176.1965
  21    V  4.3531 8.0011 120.3743 60.5287 34.2779 174.9166
  22    L  4.0423 8.6853 129.1894 55.3483 42.4232 176.7603
  23    R  4.2386 8.5189 123.9878 56.3764 30.4958 175.6265

  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 4.35 0.00 1.77 1.88 0.00 1.68 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 1.34 1.42 7.81 
  17    R  8.17 4.50 0.00 1.79 1.72 0.00 3.13 0.00 0.00 3.24 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.67 0.00 
  18    H  9.15 4.95 0.00 3.20 3.31 0.00 5.67 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  19    R  8.27 4.68 0.00 1.80 1.91 0.00 3.15 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 
  20    K  8.31 4.73 0.00 1.71 1.69 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.42 7.81 
  21    V  8.00 4.35 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 0.80 0.00 0.00 0.94 0.00 0.00 
  22    L  8.69 4.04 0.00 1.63 1.58 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 
  23    R  8.52 4.24 0.00 1.80 1.77 0.00 3.29 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.74 0.00