NUM RES   HA     H       N        CA      CB       C
 --- --- ------ ------ -------- ------- ------- --------
  1     P  4.3730 0.0000   0.0000 61.8125 33.5644 176.1735
  2     I  3.7749 7.6028 120.3104 59.7707 37.5285 174.3265
  3     D  4.5699 9.3278 126.9980 53.7065 40.5193 174.5226
  4     L  4.6143 8.0095 124.4500 54.2074 42.1522 177.0204
  5     S  4.3118 7.8792 115.5120 58.0534 63.2626 175.0289
  6     K  4.0436 8.6169 125.6193 57.8068 29.8815 176.8113
  7     K  4.1203 8.2607 122.6696 56.6311 33.1247 174.2786

  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   
  1     P  0.00 4.37 0.00 2.06 2.17 0.00 3.64 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.11 0.00 
  2     I  7.60 3.77 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 1.30 0.59 0.91 0.00 0.00 
  3     D  9.33 4.57 0.00 2.61 2.61 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 
  4     L  8.01 4.61 0.00 1.67 1.65 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 
  5     S  7.88 4.31 0.00 3.86 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 
  6     K  8.62 4.04 0.00 1.74 1.80 0.00 1.91 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.38 7.81 
  7     K  8.26 4.12 0.00 1.77 1.69 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.11 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.47 7.81