NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     T  4.1931 8.1701 115.2431 61.5229 69.4628 173.8740
  2     A  4.1556 7.5864 124.0112 50.8626 19.2275 176.6990
  3     R  3.8998 8.5645 119.6936 58.8844 31.4954 176.6883
  4     K  4.0333 7.5582 118.2841 59.4466 32.4023 176.4442
  5     S  4.2657 7.9849 115.9243 58.5539 62.2497 173.4504

  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     T  8.17 4.19 4.24 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 1.21 0.00 0.00 
  2     A  7.59 4.16 1.29 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 
  3     R  8.56 3.90 0.00 1.78 1.98 0.00 3.24 0.00 0.00 3.15 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 
  4     K  7.56 4.03 0.00 1.89 1.81 0.00 1.88 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.45 1.52 7.81 
  5     S  7.98 4.27 0.00 3.87 3.73 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