NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  44    L  4.0022 8.1844 120.6284 56.8191 42.3435 176.1058
  45    N  3.6539 8.0348 109.0471 53.7275 36.9221 171.1531
  46    P  4.4686 0.0000   0.0000 64.6222 33.2100 176.6585
  47    D  4.7518 7.4982 116.6406 52.0094 41.7040 172.2815
  48    P  4.3750 0.0000   0.0000 62.8082 32.2705 177.6353
  49    S  4.3459 8.6214 117.2382 58.1589 63.6774 174.2157
  50    Q  3.9649 8.0598 124.0036 56.3332 28.2773 173.1599

  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   
  44    L  8.18 4.00 0.00 1.63 1.72 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 
  45    N  8.03 3.65 0.00 2.83 2.88 0.00 0.00 7.35 6.80 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 
  46    P  0.00 4.47 0.00 2.08 2.09 0.00 3.72 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 
  47    D  7.50 4.75 0.00 2.70 2.51 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 
  48    P  0.00 4.37 0.00 2.21 2.05 0.00 3.80 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 
  49    S  8.62 4.35 0.00 3.88 3.94 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 
  50    Q  8.06 3.96 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.65 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00