NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     S  4.4127 8.3349 115.2898 58.0011 63.5797 172.7213
  2     L  4.6913 8.2383 125.1367 52.5479 44.1052 174.6152
  3     K  4.6667 8.2525 119.7372 54.3610 37.1124 175.7723
  4     L  4.1974 8.4070 123.5684 55.4568 42.8819 175.5563
  5     M  4.4640 8.2487 123.6600 56.0349 33.9101 175.6583
  6     T  4.2336 6.9602 103.9271 61.7823 70.9865 171.7876
  7     T  4.7143 8.3656 117.1733 61.9295 71.7019 174.8303
  8     V  4.0376 8.1444 116.9464 61.7218 32.6795 175.4043

  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     S  8.33 4.41 0.00 3.85 3.83 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     L  8.24 4.69 0.00 1.72 1.54 0.92 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 
  3     K  8.25 4.67 0.00 1.67 1.64 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.40 7.81 
  4     L  8.41 4.20 0.00 1.58 1.56 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 
  5     M  8.25 4.46 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.54 0.00 
  6     T  6.96 4.23 4.24 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 1.21 0.00 0.00 
  7     T  8.37 4.71 4.24 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 1.21 0.00 0.00 
  8     V  8.14 4.04 2.08 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 0.70 0.00 0.00 0.93 0.00 0.00