NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  4     H  4.7258 8.3033 120.4058 55.1304 31.3516 173.8768
  5     P  4.1996 0.0000   0.0000 64.9780 31.3861 176.9588
  6     Q  3.7353 8.9203 119.3441 58.0380 29.8990 176.1776
  7     F  4.9055 7.7214 114.8177 56.8829 39.5994 175.0645
  8     E  4.4293 7.9048 119.3094 55.5458 30.5785 176.7963
  9     K  4.1887 8.3767 117.3717 57.0170 32.7885 175.9670

  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   
  4     H  8.30 4.73 0.00 3.30 3.47 0.00 5.66 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  5     P  0.00 4.20 0.00 2.20 2.04 0.00 3.03 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.03 0.00 
  6     Q  8.92 3.74 0.00 1.67 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.33 0.00 0.00 0.00 0.00 0.00 1.16 1.96 0.00 
  7     F  7.72 4.91 0.00 3.13 3.03 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     E  7.90 4.43 0.00 2.10 2.13 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 2.40 2.24 0.00 
  9     K  8.38 4.19 0.00 1.86 1.81 0.00 1.66 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.31 1.35 7.81