NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     A  4.4041 8.2493 123.5852 52.3419 19.9742 175.6774
  2     T  4.5657 7.9755 108.4239 57.1625 71.6663 171.5769
  3     P  4.4793 0.0000   0.0000 62.6989 33.1020 176.6247
  4     F  5.0685 7.7916 113.4258 55.4779 40.9064 174.4315
  5     Q  4.3426 8.7452 119.4089 56.8262 30.0088 175.8419
  6     E  4.2429 8.4849 121.2688 56.5970 29.6025 176.4066

  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     A  8.25 4.40 1.30 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 
  2     T  7.98 4.57 4.28 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 1.23 0.00 0.00 
  3     P  0.00 4.48 0.00 2.16 2.04 0.00 3.73 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.94 0.00 
  4     F  7.79 5.07 0.00 3.08 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 
  5     Q  8.75 4.34 0.00 2.10 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.13 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 
  6     E  8.48 4.24 0.00 2.09 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 2.45 2.44 0.00