NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  4     H  4.7509 8.3033 120.4071 55.1392 31.4026 173.7701
  5     P  4.1742 0.0000   0.0000 65.0089 31.3977 176.8277
  6     Q  3.6765 8.9259 119.3131 58.2643 29.7879 176.4713
  7     F  4.8955 7.5928 114.0847 56.7305 39.4500 175.4524
  8     E  4.1480 8.0112 119.4863 56.2553 29.9942 176.9274
  9     K  4.1525 8.5079 120.7920 56.6378 32.3242 175.8782

  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 4.75 0.00 3.28 3.45 0.00 5.67 0.00 0.00 0.00 0.00 6.78 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 4.17 0.00 2.15 2.02 0.00 2.95 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 2.02 0.00 
  6     Q  8.93 3.68 0.00 1.78 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 7.22 0.00 0.00 0.00 0.00 0.00 1.16 1.97 0.00 
  7     F  7.59 4.90 0.00 3.19 3.07 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 
  8     E  8.01 4.15 0.00 2.11 1.97 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 2.48 2.24 0.00 
  9     K  8.51 4.15 0.00 1.75 1.73 0.00 1.82 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.42 7.81