#PDB cf residue atom     bb_p  bb_s  bb_f  chi_p chi_s  HB-D  HB-I  REF         pred
#---------------------------------------------------------------------------------------------
2agg s ALA  3   N        0.00 -1.12  0.66  0.00  0.00 -1.26 -5.15  121.76      114.89
2agg s ALA  3   Ca       0.00  0.61 -0.17  0.00  0.00  0.00  0.00   51.96       52.40
2agg s ALA  3   Cb       0.00  0.11 -0.00  0.00  0.00  0.00  0.00   23.12       23.23
2agg s ALA  3   CO       0.00 -0.33  1.24 -2.14  0.00  0.00  0.00  175.76      174.52
2agg s PRO  4   N       -1.53  2.56  0.00  0.00  0.02 -1.26 -5.74  135.00      129.05
2agg s PRO  4   Ca      -0.11  1.88  0.06  0.00  0.02  0.00  0.00   61.00       62.84
2agg s PRO  4   Cb      -0.03 -1.87  0.04  0.00  0.02  0.00  0.00   34.50       32.67
2agg s PRO  4   CO       0.04 -1.54  0.68  1.63 -0.33  0.00  0.00  177.00      177.48