NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  4     H  4.7584 8.3033 120.4069 55.1477 31.4731 173.7623
  5     P  4.1383 0.0000   0.0000 64.9841 31.3558 176.8612
  6     Q  3.7277 9.0017 119.0644 58.3068 29.7288 176.5417
  7     F  4.9981 7.7715 114.5034 56.6867 39.8778 174.8726
  8     E  4.1440 8.0379 119.5459 55.7917 29.9574 176.8535
  9     K  4.1211 8.6613 121.9415 56.8570 32.2162 176.2751

  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 4.76 0.00 3.28 3.45 0.00 5.66 0.00 0.00 0.00 0.00 6.79 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 4.14 0.00 2.16 2.02 0.00 2.97 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.03 0.00 
  6     Q  9.00 3.73 0.00 1.77 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 7.35 0.00 0.00 0.00 0.00 0.00 1.16 1.98 0.00 
  7     F  7.77 5.00 0.00 3.13 2.99 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  8.04 4.14 0.00 2.13 1.98 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 2.39 2.25 0.00 
  9     K  8.66 4.12 0.00 1.76 1.76 0.00 1.82 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.46 7.81