#PDB cf residue atom     bb_p  bb_s  bb_f  chi_p chi_s  HB-D  HB-I  REF         pred
#---------------------------------------------------------------------------------------------
3fr1 s PHE  2   N        0.00  0.03 -0.01  3.10  5.36 -1.26 -5.15  117.98      120.05
3fr1 s PHE  2   Ca       0.00  0.07  0.00  0.00 -0.96  0.00  0.00   56.93       56.05
3fr1 s PHE  2   Cb       0.00 -0.15  0.02  0.00 -0.34  0.00  0.00   43.02       42.55
3fr1 s PHE  2   CO       0.00 -0.05  0.01 -1.17 -1.46  0.00  0.00  175.22      172.55
3fr1 s LEU  3   N        0.64  1.53 -0.01  6.12  0.20 -1.26 -5.15  118.68      120.75
3fr1 s LEU  3   Ca      -0.05  0.01 -0.01  0.00  0.69  0.00  0.00   54.13       54.77
3fr1 s LEU  3   Cb      -0.08 -0.06  0.00  0.00 -0.43  0.00  0.00   46.19       45.63
3fr1 s LEU  3   CO      -0.02 -0.06  0.02  0.54 -0.29  0.00  0.00  176.35      176.54
3fr1 s VAL  4   N        0.55 -0.00 -0.01  1.68  0.11 -1.26 -5.16  120.40      116.31
3fr1 s VAL  4   Ca      -0.05  0.01  0.01  0.00 -2.93  0.00  0.00   61.98       59.03
3fr1 s VAL  4   Cb      -0.07 -0.04  0.00  0.00 -1.53  0.00  0.00   36.38       34.74
3fr1 s VAL  4   CO      -0.01  0.00 -0.04 -2.28 -3.33  0.00  0.00  175.10      169.43
3fr1 s HIS  5   N        0.05  0.47  0.00  1.54  5.04 -1.26 -5.39  115.29      115.74
3fr1 s HIS  5   Ca      -0.00 -0.09  0.00  0.00 -1.54  0.00  0.00   55.06       53.43
3fr1 s HIS  5   Cb      -0.01 -0.35  0.00  0.00  0.04  0.00  0.00   32.58       32.27
3fr1 s HIS  5   CO      -0.00 -0.04  0.00 -1.13 -2.34  0.00  0.00  174.74      171.23