NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  2     K  4.2163 8.3144 120.1339 56.2814 32.3916 173.2100
  3     Q  4.1775 7.8229 119.9168 52.8647 30.1404 173.5389
  4     L  4.1764 8.5384 122.4226 54.8252 42.5416 176.9986

  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   
  2     K  8.31 4.22 0.00 1.76 1.85 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.38 7.81 
  3     Q  7.82 4.18 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 7.04 0.00 0.00 0.00 0.00 0.00 2.22 2.50 0.00 
  4     L  8.54 4.18 0.00 1.67 1.57 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00