NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     L  4.2819 8.1693 122.4911 54.2637 43.2228 176.2660
  2     P  4.4109 0.0000   0.0000 59.6072 32.4490 173.6340
  3     P  4.4283 0.0000   0.0000 62.1098 33.1763 176.8384
  4     L  4.0674 8.2402 121.9427 54.4796 42.0247 175.8473
  5     D  4.6203 8.6287 126.8906 53.5179 41.0795 175.3085
  6     I  4.3658 8.3432 125.6205 60.7104 39.7864 174.8396
  7     T  4.5096 7.8353 116.4646 61.6997 69.8057 172.7735
  8     P  4.7772 0.0000   0.0000 61.7973 32.6794 175.9366
  9     Y  4.2445 8.6732 115.8587 58.6157 37.8833 175.9578

  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   
  1     L  8.17 4.28 0.00 1.60 1.65 0.92 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 
  2     P  0.00 4.41 0.00 2.31 2.03 0.00 3.82 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.02 0.00 
  3     P  0.00 4.43 0.00 2.21 2.09 0.00 3.77 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 
  4     L  8.24 4.07 0.00 1.61 1.64 0.93 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 
  5     D  8.63 4.62 0.00 2.69 2.61 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 
  6     I  8.34 4.37 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.95 0.92 0.00 0.00 
  7     T  7.84 4.51 4.24 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 0.00 0.00 0.00 1.21 0.00 0.00 
  8     P  0.00 4.78 0.00 2.11 2.06 0.00 3.71 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 
  9     Y  8.67 4.24 0.00 2.83 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00