NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  3     E  4.2987 8.4449 118.7952 55.9980 30.9436 174.9162
  4     L  4.2568 8.0416 119.6854 52.4890 42.6678 175.2059
  5     D  4.4799 8.5258 120.8788 53.8873 42.7691 176.9032
  6     K  3.6419 8.4017 123.7952 58.4844 32.2604 177.4805
  7     W  5.1270 8.6870 117.9164 56.5197 29.1586 177.1083
  8     A  4.4146 7.6590 119.8578 53.2488 17.9972 178.9034
  9     S  4.3611 7.6691 116.2421 58.8519 62.8228 174.2100

  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   
  3     E  8.44 4.30 0.00 2.07 2.01 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 2.15 2.32 0.00 
  4     L  8.04 4.26 0.00 1.72 1.62 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 
  5     D  8.53 4.48 0.00 2.76 2.56 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 
  6     K  8.40 3.64 0.00 1.37 1.16 0.00 1.39 0.00 0.00 1.04 0.00 0.00 2.57 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.30 0.69 7.81 
  7     W  8.69 5.13 0.00 3.51 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     A  7.66 4.41 1.37 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 
  9     S  7.67 4.36 0.00 4.07 3.89 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