NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  2     D  4.5272 8.3531 120.5185 53.3444 42.0729 174.2037
  3     G  3.9475 7.1243 106.3137 43.6380  0.0000 171.0646
  4     F  4.4942 9.1143 120.5867 57.0561 40.6153 174.7475
  5     K  4.2132 8.8111 123.7687 58.6840 32.2875 176.1700
  6     D  4.9667 7.7111 115.4299 52.2922 42.5359 174.1474
  7     S  4.6562 8.2089 112.8541 57.3081 66.8586 174.4366
  8     F  4.5437 9.0924 127.1068 60.8594 39.5015 174.4397
  9     D  4.1716 7.8305 122.7345 54.2897 41.3568 174.5303

  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     D  8.35 4.53 0.00 2.62 2.66 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     G  7.12 3.95 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 
  4     F  9.11 4.49 0.00 3.06 2.94 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     K  8.81 4.21 0.00 1.81 1.91 0.00 1.73 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.40 7.81 
  6     D  7.71 4.97 0.00 2.75 2.67 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     S  8.21 4.66 0.00 3.86 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  8     F  9.09 4.54 0.00 2.83 3.12 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     D  7.83 4.17 0.00 2.32 2.41 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