NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  16    K  4.3380 8.3149 122.1414 54.1603 33.2878 175.5002
  17    R  3.9861 8.4969 123.8325 53.5266 30.6972 174.4596
  18    H  4.8424 8.2019 117.0339 53.9548 31.7852 172.7492
  19    R  4.7065 8.2081 114.8755 54.3018 32.3661 174.1986
  20    K  4.7139 8.3830 116.8590 54.5420 34.3856 176.5264
  21    V  4.3912 8.0665 121.3347 60.1319 34.1913 173.5298
  22    L  4.4781 8.3772 125.3775 53.2202 42.9183 175.7287
  23    R  4.1145 8.3655 126.5478 56.9671 31.0472 175.6819
  24    D  4.8894 8.6640 122.4044 54.8341 40.3724 174.1720

  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   
  16    K  8.31 4.34 0.00 1.79 1.69 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.04 7.81 
  17    R  8.50 3.99 0.00 1.86 1.84 0.00 3.14 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 
  18    H  8.20 4.84 0.00 3.22 3.34 0.00 5.66 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  19    R  8.21 4.71 0.00 1.88 1.92 0.00 2.99 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 
  20    K  8.38 4.71 0.00 1.74 1.75 0.00 1.75 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.42 7.81 
  21    V  8.07 4.39 2.09 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 0.67 0.00 0.00 0.93 0.00 0.00 
  22    L  8.38 4.48 0.00 1.59 1.61 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 
  23    R  8.37 4.11 0.00 1.81 1.80 0.00 3.35 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 
  24    D  8.66 4.89 0.00 2.90 2.73 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