NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  3     K  4.2469 8.2993 120.1339 56.5230 33.0318 173.2343
  4     R  4.4802 8.2866 118.9508 52.6672 32.1718 172.5905
  5     P  4.6284 0.0000   0.0000 61.1221 33.3832 175.3796
  6     P  4.5212 0.0000   0.0000 61.6137 32.2285 174.2419
  7     P  4.4611 0.0000   0.0000 61.6190 32.1025 174.5949
  8     P  4.4732 0.0000   0.0000 61.6594 32.0635 174.3300
  9     P  4.3307 0.0000   0.0000 61.9599 31.7770 174.9062
  10    P  4.3697 0.0000   0.0000 62.7182 31.9197 176.5894
  11    G  3.7254 8.5187 108.1120 46.0114  0.0000 173.4846

  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   
  3     K  8.30 4.25 0.00 1.76 1.79 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.44 7.81 
  4     R  8.29 4.48 0.00 1.96 1.93 0.00 3.02 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.68 0.00 
  5     P  0.00 4.63 0.00 2.20 2.08 0.00 3.76 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.94 0.00 
  6     P  0.00 4.52 0.00 2.20 2.09 0.00 3.76 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 
  7     P  0.00 4.46 0.00 2.20 2.09 0.00 3.77 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 
  8     P  0.00 4.47 0.00 2.20 2.09 0.00 3.78 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 1.98 1.98 0.00 
  9     P  0.00 4.33 0.00 2.06 2.04 0.00 3.68 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 
  10    P  0.00 4.37 0.00 2.17 2.05 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 
  11    G  8.52 3.73 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 0.00