NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  95    K  4.3310 8.1733 119.9975 57.1280 35.2736 177.9057
  96    T  3.6722 7.9051 116.5313 64.9163 66.8604 174.9600
  97    T  3.8781 8.6416 112.5655 64.9307 69.2060 175.8581
  98    C  3.9881 7.9408 119.0157 62.7333 28.4701 175.7149
  99    N  4.6259 8.6551 119.1152 55.6347 37.8170 177.2839
  100   A  4.0237 7.6369 121.0686 54.4521 18.3960 178.2919
  101   C  4.3200 7.0935 115.4919 61.9288 32.4147 175.0162
  102   H  4.3721 7.6733 116.4776 58.9180 28.4705 175.5365
  103   Q  4.2041 8.0224 123.3753 56.0760 28.7387 175.6443

  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   
  95    K  8.17 4.33 0.00 1.93 2.14 0.00 1.49 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.39 1.42 7.81 
  96    T  7.91 3.67 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 
  97    T  8.64 3.88 4.22 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 1.20 0.00 0.00 
  98    C  7.94 3.99 0.00 3.13 3.03 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 
  99    N  8.66 4.63 0.00 2.75 2.87 0.00 0.00 6.45 8.50 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 
  100   A  7.64 4.02 1.38 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 
  101   C  7.09 4.32 0.00 2.96 2.85 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   H  7.67 4.37 0.00 3.18 3.33 0.00 5.72 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 
  103   Q  8.02 4.20 0.00 2.39 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.55 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00