NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  -18   H  4.7458 8.4449 117.8421 55.8335 30.3026 173.3492
  -17   H  4.4123 8.1133 116.3704 55.1137 29.8342 173.8709
  -16   H  5.0289 9.2903 121.3867 54.3968 33.0285 173.1534
  -15   H  4.4888 8.9787 119.7173 57.5694 29.2412 175.3426
  -14   H  4.8252 8.1374 117.2727 54.3420 32.4221 172.1354
  -13   H  4.9186 8.6526 122.3730 53.7357 30.6404 173.6385
  -12   S  4.3208 8.6764 121.3075 58.7966 63.1833 175.1176
  -11   S  4.2347 8.7368 118.3931 58.4311 63.6686 175.3817
  -10   G  3.8331 7.9647 109.4544 44.3693  0.0000 171.7893
  -9    H  4.1679 8.8462 121.0354 56.8624 30.2406 176.2003
  -8    I  4.1460 8.3352 123.5113 60.0155 35.6670 172.0759

  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   
  -18   H  8.44 4.75 0.00 3.22 3.45 0.00 5.66 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  -17   H  8.11 4.41 0.00 3.10 3.19 0.00 5.84 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  -16   H  9.29 5.03 0.00 3.23 3.27 0.00 5.69 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  -15   H  8.98 4.49 0.00 3.14 3.38 0.00 5.84 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  -14   H  8.14 4.83 0.00 3.07 3.13 0.00 5.69 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  -13   H  8.65 4.92 0.00 3.16 3.17 0.00 5.76 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  -12   S  8.68 4.32 0.00 3.85 3.80 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 0.00 0.00 0.00 0.00 
  -11   S  8.74 4.23 0.00 3.99 4.01 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 
  -10   G  7.96 3.83 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 0.00 
  -9    H  8.85 4.17 0.00 3.13 3.20 0.00 5.73 0.00 0.00 0.00 0.00 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  -8    I  8.34 4.15 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 1.27 0.89 0.91 0.00 0.00