#PDB cf residue atom     bb_p  bb_s  bb_f  chi_p chi_s  HB-D  HB-I  REF         pred
#---------------------------------------------------------------------------------------------
1rgr s LYS  2   N        0.00 -0.03 -0.06 -3.48  2.20 -1.26 -5.14  119.74      111.98
1rgr s LYS  2   Ca       0.00  0.34 -0.26  0.00 -0.36  0.00  0.00   55.97       55.69
1rgr s LYS  2   Cb       0.00 -0.36 -0.03  0.00 -1.51  0.00  0.00   37.83       35.93
1rgr s LYS  2   CO       0.00 -0.26  0.84  0.21 -0.36  0.00  0.00  175.35      175.78
1rgr s LYS  3   N        1.72  4.47 -0.17  4.03  2.36 -1.26 -5.05  119.74      125.84
1rgr s LYS  3   Ca      -0.01  1.12 -0.08  0.00 -2.55  0.00  0.00   55.97       54.45
1rgr s LYS  3   Cb      -0.12 -3.47 -0.04  0.00 -1.05  0.00  0.00   37.83       33.14
1rgr s LYS  3   CO      -0.04 -0.04  0.10  0.99  1.55  0.00  0.00  175.35      177.91
1rgr s THR  4   N        1.09  5.12  0.44  3.43  2.01 -1.26 -5.10  115.64      121.37
1rgr s THR  4   Ca       0.44  0.08 -0.22  0.00  0.31  0.00  0.00   61.69       62.29
1rgr s THR  4   Cb      -0.19 -3.29 -0.09  0.00  0.01  0.00  0.00   72.50       68.94
1rgr s THR  4   CO       0.21  0.49  1.04 -1.61 -0.69  0.00  0.00  174.62      174.07
1rgr s GLU  5   N        0.01  4.00  0.00  4.92  2.02 -1.26 -5.37  118.70      123.02
1rgr s GLU  5   Ca       0.08  1.43  0.00  0.00  0.02  0.00  0.00   54.97       56.50
1rgr s GLU  5   Cb      -0.12 -2.32  0.00  0.00  0.10  0.00  0.00   34.13       31.79
1rgr s GLU  5   CO       0.00 -0.27  0.00  1.55  0.02  0.00  0.00  175.26      176.56