NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     V  3.9483 8.0544 120.3115 61.3310 32.5941 175.3405
  2     S  4.0338 8.4534 117.7723 57.6639 61.0588 171.1828
  3     Q  4.0003 9.0161 127.6199 54.7494 30.3740 175.3418
  4     N  4.5777 7.6875 119.1766 52.1183 41.4888 174.7120
  5     Y  4.9165 8.0539 125.2932 56.5564 38.3818 174.9428
  6     P  4.4120 0.0000   0.0000 62.5951 32.4794 175.9150
  7     I  4.4457 8.2986 122.2520 59.7961 39.2633 175.8629
  8     V  4.0036 8.3979 117.9073 61.3786 31.7242 175.9854

  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     V  8.05 3.95 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 0.89 0.00 0.00 0.92 0.00 0.00 
  2     S  8.45 4.03 0.00 3.90 3.82 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     Q  9.02 4.00 0.00 2.07 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.60 0.00 0.00 0.00 0.00 0.00 2.41 2.52 0.00 
  4     N  7.69 4.58 0.00 2.45 2.57 0.00 0.00 6.96 7.46 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     Y  8.05 4.92 0.00 3.01 2.91 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     P  0.00 4.41 0.00 2.19 2.06 0.00 3.82 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 
  7     I  8.30 4.45 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.97 0.93 0.00 0.00 
  8     V  8.40 4.00 2.09 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 0.94 0.00 0.00