NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  2     Y  4.4604 8.0027 118.3356 57.4155 39.3357 173.5569
  3     I  3.8851 8.3298 121.6765 61.4482 37.8069 173.6046
  4     Q  3.6785 9.4818 126.5841 56.6655 27.2543 174.0063
  5     N  4.9407 8.2363 112.6526 53.1712 39.6577 174.9050
  6     C  4.6828 7.6715 119.7752 56.8255 32.7459 171.8965
  7     P  4.5976 0.0000   0.0000 63.6917 31.6984 177.9498
  8     L  4.1242 8.0407 119.3945 55.9095 41.9957 177.0162
  9     G  3.7504 7.3553 110.0816 46.4386  0.0000 172.0792

  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   
  2     Y  8.00 4.46 0.00 3.12 2.98 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 
  3     I  8.33 3.89 1.91 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.88 0.96 0.00 0.00 
  4     Q  9.48 3.68 0.00 2.27 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.11 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 
  5     N  8.24 4.94 0.00 2.66 2.82 0.00 0.00 6.73 7.24 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 
  6     C  7.67 4.68 0.00 3.08 2.77 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 4.60 0.00 2.23 2.17 0.00 3.84 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 2.00 2.01 0.00 
  8     L  8.04 4.12 0.00 1.64 1.75 0.90 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 
  9     G  7.36 3.75 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