NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     A  4.3135 8.2649 123.5821 51.8512 19.9480 176.1543
  2     R  4.2952 8.2690 119.2476 54.0627 31.8816 174.6946
  3     T  4.2849 8.5930 115.7950 60.8099 70.1510 173.1707
 *5     Q  4.1137 8.5148 120.0441 55.9319 30.0005 175.0532
  6     T  4.1802 8.2778 108.1460 61.9202 69.0674 174.5589

  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     A  8.26 4.31 1.27 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 
  2     R  8.27 4.30 0.00 1.89 1.86 0.00 3.16 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 
  3     T  8.59 4.28 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 
 *5     Q  8.51 4.11 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.90 0.00 0.00 0.00 0.00 0.00 2.26 2.42 0.00 
  6     T  8.28 4.18 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 


* Residues marked with a * may have inaccurate shift predictions.