NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  49    N  4.4766 8.4244 118.1250 54.0142 38.9340 170.2292
  50    D  3.9819 8.2613 120.7626 52.8203 39.1699 170.4429
  51    K  4.6407 8.7475 126.3437 54.2767 36.3268 174.3962
  52    Y  4.5549 8.5327 122.8560 56.2526 39.3987 175.6204
  53    E  4.2546 8.7280 123.9232 55.6733 30.3270 175.2671
  54    P  4.5000 0.0000   0.0000 62.6396 32.1887 175.8550
  55    F  5.0725 7.4580 113.8002 56.6654 41.3366 175.5191
  56    W  3.6625 8.7703 119.5394 59.0558 25.8129 174.0649
  57    E  4.1407 9.1375 123.5820 57.5210 29.6659 174.5782

  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   
  49    N  8.42 4.48 0.00 2.74 2.86 0.00 0.00 6.88 7.18 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 
  50    D  8.26 3.98 0.00 2.83 2.68 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 
  51    K  8.75 4.64 0.00 1.69 1.58 0.00 1.82 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.47 7.81 
  52    Y  8.53 4.55 0.00 3.08 3.04 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 
  53    E  8.73 4.25 0.00 2.09 2.02 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 2.37 2.38 0.00 
  54    P  0.00 4.50 0.00 2.06 1.93 0.00 3.74 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 
  55    F  7.46 5.07 0.00 3.24 3.06 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 
  56    W  8.77 3.66 0.00 3.54 3.48 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 
  57    E  9.14 4.14 0.00 2.10 2.08 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 2.16 2.21 0.00