NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     K  4.1731 8.3101 120.1323 56.2587 33.4448 175.4403
  2     A  4.2083 8.2406 126.4672 49.0812 19.6775 171.9039
  3     V  3.8359 8.8363 120.4897 61.6237 33.1322 174.0961
  4     F  4.7065 8.6184 121.0904 56.0473 40.0982 175.8095
  5     N  4.9393 8.8331 123.1573 53.0859 40.6083 177.0601
  6     F  4.8494 8.1664 120.1608 57.6670 38.4545 179.1556
  7     A  3.9244 9.0090 119.4782 52.0038 18.2983 178.0872
  8     T  4.2498 8.1124 112.4120 61.1105 70.0548 174.5697
  9     M  4.2424 8.3788 119.9716 55.7464 32.0341 176.6600

  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     K  8.31 4.17 0.00 1.76 1.82 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.45 7.81 
  2     A  8.24 4.21 1.19 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 
  3     V  8.84 3.84 2.10 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 0.77 0.00 0.00 0.99 0.00 0.00 
  4     F  8.62 4.71 0.00 3.13 2.96 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 
  5     N  8.83 4.94 0.00 2.82 2.85 0.00 0.00 6.97 7.45 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     F  8.17 4.85 0.00 2.90 2.07 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     A  9.01 3.92 1.27 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 
  8     T  8.11 4.25 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 
  9     M  8.38 4.24 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.55 0.00