#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a1p n VAL 3 N 7.32 0.43 -0.58 0.00 0.31 -1.26 -4.98 118.33 119.57 1a1p n VAL 3 Ca 0.21 -0.47 -0.30 0.00 -0.01 0.00 0.00 64.34 63.78 1a1p n VAL 3 Cb 0.48 0.86 0.22 0.00 -0.91 0.00 0.00 33.84 34.48 1a1p n VAL 3 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1a1p s VAL 4 N -0.43 2.02 -0.07 2.52 0.11 -1.26 -4.32 120.40 118.96 1a1p s VAL 4 Ca 0.00 0.01 -0.02 0.00 -2.93 0.00 0.00 61.98 59.03 1a1p s VAL 4 Cb 0.00 -2.02 0.01 0.00 -1.53 0.00 0.00 36.38 32.84 1a1p s VAL 4 CO 0.00 -0.01 0.04 0.00 -3.33 0.00 0.00 175.10 171.80 1a1p n GLN 5 N -4.64 -1.83 0.31 1.54 6.02 -1.26 -4.58 117.38 112.95 1a1p n GLN 5 Ca 0.07 1.68 0.19 0.00 -0.01 0.00 0.00 57.00 58.93 1a1p n GLN 5 Cb 0.53 -2.20 1.00 0.00 1.02 0.00 0.00 30.24 30.59 1a1p n GLN 5 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 177.06 176.27 1a1p h ASP 6 N 4.18 0.00 0.00 1.08 3.58 -2.03 -1.79 116.42 121.44 1a1p h ASP 6 Ca -0.10 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.35 1a1p h ASP 6 Cb 0.54 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.59 1a1p h ASP 6 CO 0.02 0.00 -0.79 -2.67 -2.88 0.00 0.00 179.24 172.92 1a1p n TRP 7 N -3.18 0.00 -1.00 0.28 4.27 -1.26 -4.73 117.44 111.83 1a1p n TRP 7 Ca -0.02 0.00 -0.18 0.00 -3.89 0.00 0.00 57.50 53.41 1a1p n TRP 7 Cb 0.23 -0.05 -0.12 0.00 -1.36 0.00 0.00 31.31 30.01 1a1p n TRP 7 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1a1p n GLY 8 N 1.88 3.17 3.53 -1.67 0.00 -0.67 -4.86 105.19 106.57 1a1p n GLY 8 Ca -0.00 -1.19 -0.43 0.00 0.00 0.00 0.00 46.02 44.40 1a1p n GLY 8 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1a1p s HIS 9 N 1.51 2.80 -0.13 1.61 3.76 -1.26 -4.83 115.29 118.74 1a1p s HIS 9 Ca 0.62 0.06 -0.04 0.00 -0.15 0.00 0.00 55.06 55.55 1a1p s HIS 9 Cb 0.26 -4.08 -0.07 0.00 1.11 0.00 0.00 32.58 29.80 1a1p s HIS 9 CO -0.02 -1.33 -0.15 0.72 -0.85 0.00 0.00 174.74 173.11 1a1p n HIS 10 N 7.48 0.00 -3.15 1.40 8.25 -1.26 -5.01 115.22 122.92 1a1p n HIS 10 Ca 0.03 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.53 1a1p n HIS 10 Cb 0.48 -0.49 -0.00 0.00 1.12 0.00 0.00 29.99 31.09 1a1p n HIS 10 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 1a1p s ARG 11 N -2.25 0.40 0.00 -0.41 3.52 -1.26 -5.11 118.95 113.84 1a1p s ARG 11 Ca -0.18 0.41 0.00 0.00 -0.13 0.00 0.00 55.73 55.83 1a1p s ARG 11 Cb 0.06 0.19 0.00 0.00 -1.56 0.00 0.00 34.95 33.65 1a1p s ARG 11 CO 0.26 -0.72 0.00 0.00 -0.81 0.00 0.00 175.30 174.03