#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 4.65 0.03 -0.61 0.00 0.31 -1.26 -5.07 118.33 116.39 1a1p n VAL 3 Ca -0.18 -0.03 -0.28 0.00 -0.01 0.00 0.00 64.34 63.83 1a1p n VAL 3 Cb 0.49 0.94 0.25 0.00 -0.91 0.00 0.00 33.84 34.61 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 -0.03 2.00 -0.05 2.52 0.11 -1.26 -4.41 120.40 119.28 1a1p s VAL 4 Ca 0.00 0.00 -0.01 0.00 -2.93 0.00 0.00 61.98 59.04 1a1p s VAL 4 Cb 0.00 -2.11 0.00 0.00 -1.53 0.00 0.00 36.38 32.75 1a1p s VAL 4 CO 0.00 -0.00 0.02 0.00 -3.33 0.00 0.00 175.10 171.79 1a1p n GLN 5 N -4.89 -1.31 0.21 1.54 6.02 -1.26 -4.70 117.38 112.98 1a1p n GLN 5 Ca 0.03 1.36 0.09 0.00 -0.01 0.00 0.00 57.00 58.47 1a1p n GLN 5 Cb 0.55 -1.72 0.32 0.00 1.02 0.00 0.00 30.24 30.41 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 4.10 0.00 -0.01 1.08 3.58 -2.02 -3.19 116.42 119.96 1a1p h ASP 6 Ca -0.05 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.40 1a1p h ASP 6 Cb 0.57 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.62 1a1p h ASP 6 CO 0.01 0.23 -0.51 -2.67 -2.88 0.00 0.00 179.24 173.42 1a1p n TRP 7 N -3.26 0.00 -3.37 0.28 4.27 -1.26 -4.83 117.44 109.27 1a1p n TRP 7 Ca 0.01 0.00 -0.17 0.00 -3.89 0.00 0.00 57.50 53.46 1a1p n TRP 7 Cb 0.51 0.00 -0.08 0.00 -1.36 0.00 0.00 31.31 30.38 1a1p n TRP 7 CO 0.00 0.00 0.00 0.20 -2.29 0.00 0.00 177.69 175.60 1a1p s GLY 8 N -2.12 -0.06 0.79 -1.67 0.00 -1.20 -5.14 107.32 97.91 1a1p s GLY 8 Ca 0.09 -0.78 -0.12 0.00 0.00 0.00 0.00 44.72 43.92 1a1p s GLY 8 CO 0.50 2.72 1.13 0.30 0.00 0.00 0.00 173.10 177.75 1a1p s HIS 9 N 1.71 3.00 0.00 1.90 3.76 -1.25 -4.59 115.29 119.81 1a1p s HIS 9 Ca 0.15 0.94 0.00 0.00 -0.15 0.00 0.00 55.06 56.00 1a1p s HIS 9 Cb -0.15 -3.27 0.00 0.00 1.11 0.00 0.00 32.58 30.27 1a1p s HIS 9 CO -0.12 -1.66 0.00 0.72 -0.85 0.00 0.00 174.74 172.84 1a1p n HIS 10 N -3.30 0.00 -3.21 1.40 8.25 -1.26 -5.09 115.22 112.02 1a1p n HIS 10 Ca 0.07 0.00 -0.00 0.00 -0.26 0.00 0.00 57.72 57.53 1a1p n HIS 10 Cb 0.59 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.68 1a1p n HIS 10 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 1a1p s ARG 11 N 0.54 0.70 0.00 -0.41 3.03 -1.26 -5.06 118.95 116.48 1a1p s ARG 11 Ca 0.00 -0.04 0.00 0.00 2.03 0.00 0.00 55.73 57.72 1a1p s ARG 11 Cb 0.00 0.05 0.00 0.00 -1.03 0.00 0.00 34.95 33.97 1a1p s ARG 11 CO 0.00 -1.14 0.00 0.00 -1.13 0.00 0.00 175.30 173.03