NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  2     Y  4.5581 8.0033 118.3519 57.1494 39.3674 173.9360
  3     I  3.6424 8.4871 121.9597 62.8270 37.0831 174.4641
  4     Q  3.6132 9.1776 123.4291 56.5579 27.3935 174.2058
  5     N  4.9660 8.1391 115.3805 52.3389 39.7951 172.7274
  6     C  4.5496 7.7728 119.3478 56.9636 32.9674 172.1633
  7     P  4.4496 0.0000   0.0000 63.8325 31.7087 177.9088
  8     L  4.1059 8.1282 119.4699 56.2330 41.9294 177.0510
  9     G  3.7657 7.3087 110.6425 46.4739  0.0000 172.2262

  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 4.56 0.00 3.09 2.96 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  8.49 3.64 1.92 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 1.46 0.12 0.94 0.00 0.00 
  4     Q  9.18 3.61 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.26 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 
  5     N  8.14 4.97 0.00 2.64 2.78 0.00 0.00 6.77 7.03 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  7.77 4.55 0.00 2.95 2.76 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 4.45 0.00 2.23 2.17 0.00 3.85 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  8.13 4.11 0.00 1.65 1.76 0.90 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 
  9     G  7.31 3.77 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 0.00 0.00 0.00