NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     E  4.2699 8.4293 121.4691 55.7613 30.9526 176.0795
  2     S  4.2203 8.2957 120.7857 57.7453 65.1639 173.9172
  3     Q  3.9634 8.7723 122.5266 58.9950 28.9272 179.9585
  4     L  3.9216 7.9333 120.8694 58.6286 42.0507 178.4913
  5     H  4.1284 8.5122 118.1946 59.3119 29.5741 177.2775
  6     S  4.2268 8.1802 116.3107 61.8638 62.7445 176.2211
  7     N  4.4867 8.2452 118.2817 56.1803 38.3046 177.3873
  8     K  4.1049 7.7581 119.3462 59.1245 32.2324 177.6188
  9     R  4.1254 7.9571 122.6917 56.5848 30.1621 175.8324

  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     E  8.43 4.27 0.00 1.94 1.93 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 2.23 2.33 0.00 
  2     S  8.30 4.22 0.00 4.18 3.98 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  8.77 3.96 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.42 0.00 
  4     L  7.93 3.92 0.00 1.76 1.69 0.92 0.96 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 
  5     H  8.51 4.13 0.00 3.23 3.41 0.00 5.65 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  6     S  8.18 4.23 0.00 4.03 3.93 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     N  8.25 4.49 0.00 2.83 2.87 0.00 0.00 7.11 8.47 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     K  7.76 4.10 0.00 1.78 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.45 1.62 7.81 
  9     R  7.96 4.13 0.00 1.71 1.79 0.00 3.31 0.00 0.00 3.30 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00