#PDB cf residue atom     bb_p  bb_s  bb_f  chi_p chi_s  HB-D  HB-I  REF         pred
#---------------------------------------------------------------------------------------------
1sha s PRO  203 N        0.00  2.82 -0.16  5.55  0.04 -1.26 -4.97  135.00      137.03
1sha s PRO  203 Ca       0.00  0.88 -0.06  0.00  0.04  0.00  0.00   61.00       61.86
1sha s PRO  203 Cb       0.00 -4.33 -0.04  0.00  0.04  0.00  0.00   34.50       30.17
1sha s PRO  203 CO       0.00 -2.49  0.06 -1.64  0.04  0.00  0.00  177.00      172.97
1sha s MET  204 N        6.66  3.75  0.00  4.56 -1.94 -1.26 -5.74  119.30      125.34
1sha s MET  204 Ca       0.72 -0.34  0.24  0.00 -1.71  0.00  0.00   55.69       54.60
1sha s MET  204 Cb      -0.15 -3.13  1.44  0.00  2.01  0.00  0.00   34.83       34.99
1sha s MET  204 CO       0.25  0.40  1.80  1.28 -0.01  0.00  0.00  175.02      178.74