NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  -3    P  4.0687 0.0000   0.0000 62.7850 32.7069 175.2448
  -2    V  2.9387 7.9238 121.0315 64.0737 29.5703 169.3590
  -1    Y  4.3766 8.3259 125.2496 56.6978 40.0714 175.7184
  0     I  4.0926 8.3209 116.1784 61.0257 37.9465 175.4047

  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    P  0.00 4.07 0.00 2.02 2.12 0.00 3.87 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.79 0.00 
  -2    V  7.92 2.94 2.03 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 0.66 0.00 0.00 0.92 0.00 0.00 
  -1    Y  8.33 4.38 0.00 2.97 2.87 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     I  8.32 4.09 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.49 0.91 0.00 0.00