NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  2     S  4.4309 8.3344 115.4104 57.7981 64.4303 173.3399
  3     E  3.7759 8.9814 124.5075 57.8461 29.6631 175.2407
  4     Q  4.4523 7.9533 119.3475 54.1078 31.2235 174.2983
  5     V  3.8658 8.1704 125.3668 62.3810 32.4392 175.1113
  6     E  4.3114 8.3776 126.1321 55.1255 30.4868 176.4454
  7     L  3.7883 8.1462 122.7490 54.6804 42.0206 176.8086
  8     E  4.1724 8.2715 121.3659 54.8270 29.4727 175.7786
  9     F  4.8487 8.1242 121.8352 57.3301 39.2144 175.9164
  10    D  4.8490 7.6432 125.6688 54.8812 41.0972 173.7319

  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     S  8.33 4.43 0.00 3.98 3.92 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 
  3     E  8.98 3.78 0.00 2.02 2.02 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 2.29 2.35 0.00 
  4     Q  7.95 4.45 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.71 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 
  5     V  8.17 3.87 2.05 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 0.82 0.00 0.00 0.91 0.00 0.00 
  6     E  8.38 4.31 0.00 1.91 1.74 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 2.25 2.22 0.00 
  7     L  8.15 3.79 0.00 1.15 0.98 1.02 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 
  8     E  8.27 4.17 0.00 2.06 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 2.20 2.26 0.00 
  9     F  8.12 4.85 0.00 3.10 3.01 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 
  10    D  7.64 4.85 0.00 2.95 2.73 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