NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  3     H  4.6232 8.2876 120.3887 55.2011 30.8802 173.8547
  4     P  4.1516 0.0000   0.0000 63.7267 31.0224 174.8531
  5     Q  4.2890 8.4066 119.2863 56.3543 30.6916 176.1801
  6     G  4.0041 7.8104 106.8650 43.1583  0.0000 170.8840
  7     P  4.5009 0.0000   0.0000 61.4048 32.0146 174.7583
  8     P  4.4052 0.0000   0.0000 63.0450 31.1814 176.6129

  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     H  8.29 4.62 0.00 3.18 3.24 0.00 5.65 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  4     P  0.00 4.15 0.00 2.26 2.12 0.00 3.31 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.89 0.00 
  5     Q  8.41 4.29 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.85 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 
  6     G  7.81 4.00 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 0.00 
  7     P  0.00 4.50 0.00 2.19 2.11 0.00 3.79 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 1.99 0.00 
  8     P  0.00 4.41 0.00 2.06 2.02 0.00 3.71 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00