NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  -4    Q  4.2787 8.3293 121.7373 55.3798 30.6624 175.7974
  -3    W  4.3222 8.5553 115.5275 57.0153 28.5166 174.8999
  -2    D  4.7032 7.4731 118.3213 52.8127 40.3766 178.3725
  -1    N  4.1649 8.3521 119.4460 56.7936 38.6500 174.9912
  0     Y  4.7535 7.7337 113.8636 56.1839 40.9375 174.4792
  1     E  4.1861 8.1876 126.6036 55.6332 32.6023 174.7287
  -1    I  3.5949 7.9521 120.6460 64.7936 38.5500 176.1912
  0     W  4.8635 7.8637 114.8636 55.7839 32.7375 174.6792

  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   
  -4    Q  8.33 4.28 0.00 2.06 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.07 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 
  -3    W  8.56 4.32 0.00 3.56 3.34 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 
  -2    D  7.47 4.70 0.00 2.49 2.15 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 
  -1    N  8.35 4.16 0.00 2.72 2.54 0.00 0.00 6.98 7.46 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     Y  7.73 4.75 0.00 2.90 2.86 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 
  1     E  8.19 4.19 0.00 1.79 1.44 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 2.50 0.00 
  -1    I  7.95 3.59 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.80 0.91 0.00 0.00 
  0     W  7.86 4.86 0.00 3.16 3.15 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