#PDB cf residue atom     bb_p  bb_s  bb_f  chi_p chi_s  HB-D  HB-I  REF         pred
#---------------------------------------------------------------------------------------------
3n3x n ASP  2   N        0.00 -0.47  0.00 -3.46  5.68 -1.26 -5.07  116.55      111.97
3n3x n ASP  2   Ca       0.00 -0.20  0.00  0.00 -0.50  0.00  0.00   54.79       54.09
3n3x n ASP  2   Cb       0.00  0.00  0.00  0.00 -1.14  0.00  0.00   41.12       39.98
3n3x n ASP  2   CO       0.00  0.00  0.00 -0.67 -1.33  0.00  0.00  177.20      175.20
3n3x n ASP  3   N       -1.31  0.00 -0.04 -1.12  4.64 -1.26 -5.15  116.55      112.31
3n3x n ASP  3   Ca       0.00  0.00 -0.01  0.00 -1.38  0.00  0.00   54.79       53.40
3n3x n ASP  3   Cb       0.00  0.00 -0.00  0.00 -1.04  0.00  0.00   41.12       40.08
3n3x n ASP  3   CO       0.00  0.00  0.00 -0.90 -0.82  0.00  0.00  177.20      175.48
3n3x n ASP  4   N        0.00 -0.00  0.00  1.67  5.68 -1.26 -4.95  116.55      117.69
3n3x n ASP  4   Ca       0.00  0.01  0.00  0.00 -0.50  0.00  0.00   54.79       54.30
3n3x n ASP  4   Cb       0.00 -0.01  0.00  0.00 -1.14  0.00  0.00   41.12       39.97
3n3x n ASP  4   CO       0.00  0.00  0.00  0.23 -1.33  0.00  0.00  177.20      176.10
3n3x n MET  5   N        0.01  0.00  0.00  0.11  2.81 -1.26 -5.34  117.12      113.46
3n3x n MET  5   Ca       0.00  0.00  0.00  0.00 -1.81  0.00  0.00   57.70       55.89
3n3x n MET  5   Cb       0.00  0.00  0.00  0.00 -0.71  0.00  0.00   33.22       32.51
3n3x n MET  5   CO       0.00  0.00  0.00  0.41  1.51  0.00  0.00  175.97      177.89