NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  100   Y  4.7637 8.1444 121.6954 57.5741 39.9176 174.2255
  101   D  4.3035 8.4080 124.4267 52.3330 43.6180 169.5306
  102   V  4.2780 7.7346 120.1189 58.3965 34.8854 173.6514
  103   P  4.3960 0.0000   0.0000 62.5557 32.0503 175.6625
  104   D  4.5477 8.3071 118.8716 53.8557 41.8299 176.9401
  105   Y  4.1265 8.5114 122.5568 59.5758 38.1324 176.6065
  106   A  4.3508 7.5054 121.6040 51.8986 19.0596 176.9647
  107   S  4.2578 7.9026 117.5199 58.8647 62.3778 173.7969

  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   
  100   Y  8.14 4.76 0.00 2.82 2.89 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 
  101   D  8.41 4.30 0.00 2.65 2.46 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 0.00 0.00 0.00 0.00 
  102   V  7.73 4.28 1.93 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 0.14 0.00 0.00 0.74 0.00 0.00 
  103   P  0.00 4.40 0.00 2.16 2.04 0.00 3.70 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 
  104   D  8.31 4.55 0.00 2.69 2.44 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 0.00 0.00 0.00 
  105   Y  8.51 4.13 0.00 3.07 2.99 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 
  106   A  7.51 4.35 0.99 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 
  107   S  7.90 4.26 0.00 3.81 3.98 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