#PDB cf residue atom     bb_p  bb_s  bb_f  chi_p chi_s  HB-D  HB-I  REF         pred
#---------------------------------------------------------------------------------------------
1qkb s VAL  2   N        0.00  4.13  0.00  0.58  1.01 -1.26 -5.74  120.40      119.13
1qkb s VAL  2   Ca       0.00  2.00  0.00  0.00  0.00  0.00  0.00   61.98       63.98
1qkb s VAL  2   Cb       0.00 -4.27  0.00  0.00  0.00  0.00  0.00   36.38       32.11
1qkb s VAL  2   CO       0.00  0.42  0.32  1.17  0.00  0.00  0.00  175.10      177.01