NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     Y  4.5611 8.1449 121.6935 57.3294 39.4980 174.8835
  2     M  4.1334 8.0715 127.1810 53.8082 32.7534 175.4521
  3     F  4.4189 9.3343 124.5515 57.6688 41.2367 173.3759
  4     P  4.1172 0.0000   0.0000 64.8474 31.3333 176.5099
  5     N  4.7400 6.9260 112.7219 51.2575 40.8359 173.8551
  6     A  4.6814 8.0978 123.2356 49.5528 20.2468 175.0887
  7     P  4.3074 0.0000   0.0000 62.5302 32.2097 176.1062
  8     Y  4.2783 8.2698 119.2662 58.4255 38.3096 176.5557
  9     L  4.2220 8.7337 123.2580 55.1942 41.6853 176.9404

  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     Y  8.14 4.56 0.00 2.95 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 
  2     M  8.07 4.13 0.00 2.08 1.81 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.57 0.00 
  3     F  9.33 4.42 0.00 2.92 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 
  4     P  0.00 4.12 0.00 1.64 1.86 0.00 2.25 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.90 0.00 
  5     N  6.93 4.74 0.00 2.72 2.62 0.00 0.00 6.70 7.35 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     A  8.10 4.68 1.18 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 4.31 0.00 2.22 2.11 0.00 3.81 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.01 0.00 
  8     Y  8.27 4.28 0.00 3.05 2.92 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 
  9     L  8.73 4.22 0.00 1.70 1.63 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00