#PDB cf residue atom     bb_p  bb_s  bb_f  chi_p chi_s  HB-D  HB-I  REF         pred
#---------------------------------------------------------------------------------------------
3hqi s VAL  98  N        0.00  5.16  0.27  6.31  1.01 -1.26 -5.07  120.40      126.83
3hqi s VAL  98  Ca       0.00  0.98  0.03  0.00  0.00  0.00  0.00   61.98       62.99
3hqi s VAL  98  Cb       0.00 -3.84 -0.04  0.00  0.00  0.00  0.00   36.38       32.51
3hqi s VAL  98  CO       0.00  0.29  0.18  0.42  0.00  0.00  0.00  175.10      175.99
3hqi s THR  99  N        0.87  0.12  0.05  3.92 -4.23 -1.26 -5.16  115.64      109.94
3hqi s THR  99  Ca       0.26 -2.00  0.08  0.00 -1.18  0.00  0.00   61.69       58.86
3hqi s THR  99  Cb      -0.15 -2.51 -0.03  0.00  1.34  0.00  0.00   72.50       71.15
3hqi s THR  99  CO       0.11  0.00 -0.24 -0.55 -0.54  0.00  0.00  174.62      173.40
3hqi s SER  100 N       -3.29  2.83  0.55  3.99  0.15 -1.26 -5.01  113.70      111.65
3hqi s SER  100 Ca       0.38 -0.56  0.33  0.00  0.70  0.00  0.00   55.95       56.80
3hqi s SER  100 Cb       0.05 -0.24  1.49  0.00 -1.71  0.00  0.00   66.02       65.61
3hqi s SER  100 CO       0.18  0.21  2.04  0.71  1.20  0.00  0.00  173.24      177.58
3hqi h THR  101 N        4.28  0.16 -0.02  6.45  1.35 -2.06 -3.57  112.91      119.50
3hqi h THR  101 Ca      -0.45 -0.52  0.00  0.00 -0.55  0.00  0.00   66.41       64.89
3hqi h THR  101 Cb       1.15  1.44  0.00  0.00 -1.73  0.00  0.00   68.15       69.01
3hqi h THR  101 CO       0.44  0.05  0.00  0.35 -0.25  0.00  0.00  175.52      176.10