NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  3     H  4.6505 8.2876 120.3901 55.1243 30.9527 174.0139
  4     P  4.0710 0.0000   0.0000 64.5932 30.9823 175.3604
  5     Q  4.1312 8.4004 118.6400 57.0361 30.2887 176.7463
  6     G  3.9203 7.8498 106.7075 44.1713  0.0000 170.9880
  7     P  4.5276 0.0000   0.0000 61.3145 32.1433 174.7035
  8     P  4.4066 0.0000   0.0000 62.9788 31.1792 176.6521

  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 4.65 0.00 3.18 3.25 0.00 5.66 0.00 0.00 0.00 0.00 6.70 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 4.07 0.00 2.25 2.13 0.00 3.29 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.88 0.00 
  5     Q  8.40 4.13 0.00 2.14 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.04 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 
  6     G  7.85 3.92 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 4.53 0.00 2.19 2.10 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 2.01 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 2.08 0.00