NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  31    A  4.3235 8.1227 123.5833 52.7346 21.6432 178.7858
  32    H  4.0094 7.9998 112.9570 57.2052 30.0817 176.0006
  33    S  4.2965 8.8189 112.5582 59.2958 64.1990 174.1102
  34    N  4.4501 7.7589 118.1658 54.0431 39.8837 176.9239
  35    R  3.9092 8.2020 120.3701 58.9389 29.8849 178.4871
  36    K  3.8275 7.8317 119.1407 59.5613 32.0965 178.2644
  37    L  3.9614 7.4269 119.9937 58.5982 41.8981 178.8301
  38    M  4.2779 7.8327 117.6666 58.3088 31.9236 178.4256
  39    E  4.1492 7.9555 118.3229 59.1355 29.7492 178.9205
  40    I  3.9205 7.2668 118.6102 64.2360 37.4206 176.1688
  41    I  3.8808 8.1326 123.9224 61.6311 36.8893 175.7873

  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   
  31    A  8.12 4.32 1.31 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 
  32    H  8.00 4.01 0.00 3.30 3.32 0.00 5.87 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  33    S  8.82 4.30 0.00 3.99 4.02 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 
  34    N  7.76 4.45 0.00 2.84 2.86 0.00 0.00 7.12 7.66 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 
  35    R  8.20 3.91 0.00 1.98 1.97 0.00 3.30 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 
  36    K  7.83 3.83 0.00 1.81 1.91 0.00 1.59 0.00 0.00 1.48 0.00 0.00 2.85 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.43 7.81 
  37    L  7.43 3.96 0.00 1.83 1.63 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 
  38    M  7.83 4.28 0.00 2.05 2.28 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.59 0.00 
  39    E  7.96 4.15 0.00 2.11 2.00 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 2.34 2.44 0.00 
  40    I  7.27 3.92 1.97 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.55 0.91 0.00 0.00 
  41    I  8.13 3.88 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.73 0.91 0.00 0.00