NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     A  4.3816 8.2493 123.5859 52.0184 19.9625 175.7163
  2     I  4.2420 8.0214 112.4404 58.3242 39.9074 174.0190
  3     A  4.3386 8.3401 127.0277 51.3593 18.6644 178.1686
  4     Y  4.4015 8.5211 120.5774 59.5661 38.7409 176.0768
  5     F  4.5904 7.4538 122.5117 56.8136 42.0956 172.8789
  6     I  4.0307 7.2695 128.4793 58.2913 39.2264 172.8055
  7     P  3.7585 0.0000   0.0000 64.2332 31.1664 175.8734
  8     D  4.6152 7.5590 122.0577 53.4432 40.0979 176.1070

  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     A  8.25 4.38 1.30 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 
  2     I  8.02 4.24 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.00 0.94 0.00 0.00 
  3     A  8.34 4.34 1.24 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 0.00 0.00 0.00 
  4     Y  8.52 4.40 0.00 3.09 3.08 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 
  5     F  7.45 4.59 0.00 2.79 2.52 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  7.27 4.03 1.62 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.64 0.75 0.00 0.00 
  7     P  0.00 3.76 0.00 1.95 2.06 0.00 3.52 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.19 0.00 
  8     D  7.56 4.62 0.00 2.69 2.70 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