#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 4.86 0.98 -0.84 0.00 0.31 -1.26 -4.95 118.33 117.43 1a1p n VAL 3 Ca -0.16 -0.99 -0.28 0.00 -0.01 0.00 0.00 64.34 62.90 1a1p n VAL 3 Cb 0.53 0.51 0.22 0.00 -0.91 0.00 0.00 33.84 34.19 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 -0.99 2.00 -0.10 2.52 0.11 -1.26 -4.49 120.40 118.20 1a1p s VAL 4 Ca 0.05 0.00 -0.01 0.00 -2.93 0.00 0.00 61.98 59.09 1a1p s VAL 4 Cb 0.02 -2.27 0.00 0.00 -1.53 0.00 0.00 36.38 32.61 1a1p s VAL 4 CO 0.03 -0.00 0.02 0.00 -3.33 0.00 0.00 175.10 171.82 1a1p n GLN 5 N -4.61 -1.61 0.15 1.54 6.02 -1.26 -4.82 117.38 112.78 1a1p n GLN 5 Ca 0.04 1.59 0.13 0.00 -0.01 0.00 0.00 57.00 58.75 1a1p n GLN 5 Cb 0.56 -2.53 0.43 0.00 1.02 0.00 0.00 30.24 29.72 1a1p n GLN 5 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.06 175.61 1a1p h ASP 6 N 3.63 0.00 0.00 1.08 5.19 -2.03 -3.17 116.42 121.13 1a1p h ASP 6 Ca -0.04 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.37 1a1p h ASP 6 Cb 0.61 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.12 1a1p h ASP 6 CO 0.03 0.00 -0.53 -2.67 -3.12 0.00 0.00 179.24 172.96 1a1p n TRP 7 N -2.47 0.00 -3.34 4.55 4.27 -1.26 -4.78 117.44 114.41 1a1p n TRP 7 Ca 0.04 0.00 -0.36 0.00 -3.89 0.00 0.00 57.50 53.29 1a1p n TRP 7 Cb 0.37 -0.03 -0.04 0.00 -1.36 0.00 0.00 31.31 30.25 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 1.53 4.71 3.73 -1.67 0.00 -1.20 -5.05 105.19 107.25 1a1p n GLY 8 Ca 0.00 -2.68 -0.41 0.00 0.00 0.00 0.00 46.02 42.93 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 -2.21 3.72 0.00 1.61 3.76 -1.26 -4.71 115.29 116.20 1a1p s HIS 9 Ca 0.33 1.71 0.00 0.00 -0.15 0.00 0.00 55.06 56.94 1a1p s HIS 9 Cb 0.04 -3.15 0.00 0.00 1.11 0.00 0.00 32.58 30.58 1a1p s HIS 9 CO -0.01 -0.13 0.00 0.72 -0.85 0.00 0.00 174.74 174.47 1a1p n HIS 10 N 2.75 0.00 -2.99 1.40 8.25 -1.26 -5.09 115.22 118.29 1a1p n HIS 10 Ca 0.03 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.37 1a1p n HIS 10 Cb 0.48 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.56 1a1p n HIS 10 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1a1p s ARG 11 N 1.94 1.01 0.01 -0.41 3.00 -1.26 -4.97 118.95 118.28 1a1p s ARG 11 Ca 0.00 -1.41 0.15 0.00 0.00 0.00 0.00 55.73 54.48 1a1p s ARG 11 Cb 0.00 -0.52 0.66 0.00 0.00 0.00 0.00 34.95 35.09 1a1p s ARG 11 CO 0.00 -1.35 1.49 0.00 0.00 0.00 0.00 175.30 175.45