#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a4t s ALA 2 N 0.00 3.38 -0.12 5.20 0.00 -1.26 -4.71 121.76 124.25 1a4t s ALA 2 Ca 0.00 -2.84 -0.10 0.00 0.00 0.00 0.00 51.96 49.02 1a4t s ALA 2 Cb 0.00 -4.30 -0.03 0.00 0.00 0.00 0.00 23.12 18.79 1a4t s ALA 2 CO 0.00 -3.13 -0.20 1.63 0.00 0.00 0.00 175.76 174.06 1a4t n LYS 3 N 7.20 0.36 -0.14 0.00 4.76 -1.26 -4.25 118.16 124.84 1a4t n LYS 3 Ca 0.34 0.29 -0.10 0.00 -2.87 0.00 0.00 58.31 55.97 1a4t n LYS 3 Cb 0.47 -1.30 -0.01 0.00 -1.84 0.00 0.00 35.03 32.34 1a4t n LYS 3 CO 0.00 0.00 0.00 1.79 -1.37 0.00 0.00 177.40 177.82 1a4t h THR 4 N -0.74 1.25 -0.41 -0.18 1.35 -1.98 -0.81 112.91 111.41 1a4t h THR 4 Ca 0.00 -0.96 0.04 0.00 -0.55 0.00 0.00 66.41 64.94 1a4t h THR 4 Cb 0.57 1.10 -0.04 0.00 -1.73 0.00 0.00 68.15 68.05 1a4t h THR 4 CO 0.00 0.33 0.18 0.03 -0.25 0.00 0.00 175.52 175.81 1a4t h ARG 5 N 0.52 0.36 0.12 4.72 2.47 -1.93 -0.70 114.38 119.94 1a4t h ARG 5 Ca 0.12 -0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 58.81 1a4t h ARG 5 Cb 0.44 -0.08 0.00 0.00 -1.65 0.00 0.00 29.97 28.68 1a4t h ARG 5 CO 0.02 0.24 -0.06 -0.09 0.56 0.00 0.00 179.97 180.63 1a4t h ARG 6 N 0.37 -0.16 -0.69 0.04 2.43 -1.73 -3.32 114.38 111.31 1a4t h ARG 6 Ca 0.18 0.01 0.09 0.00 -0.81 0.00 0.00 59.98 59.45 1a4t h ARG 6 Cb 0.12 0.04 -0.11 0.00 -0.42 0.00 0.00 29.97 29.59 1a4t h ARG 6 CO -0.15 0.18 -0.50 1.25 -1.51 0.00 0.00 179.97 179.24 1a4t h HIS 7 N -0.52 -1.54 -0.78 2.20 2.76 -0.85 -2.71 115.15 113.72 1a4t h HIS 7 Ca -0.02 0.10 0.10 0.00 -2.20 0.00 0.00 60.37 58.35 1a4t h HIS 7 Cb 0.41 0.77 -0.11 0.00 1.55 0.00 0.00 27.41 30.03 1a4t h HIS 7 CO 0.04 -0.42 -0.38 0.39 -1.30 0.00 0.00 177.93 176.25 1a4t n GLU 8 N -5.36 -0.26 0.31 5.26 1.02 -0.29 0.21 120.64 121.53 1a4t n GLU 8 Ca 0.01 1.19 -0.16 0.00 -0.02 0.00 0.00 57.16 58.18 1a4t n GLU 8 Cb 0.33 -1.75 -0.08 0.00 -0.02 0.00 0.00 31.44 29.92 1a4t n GLU 8 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1a4t h ARG 9 N 0.00 -0.77 -0.62 3.49 2.47 -1.65 -3.15 114.38 114.16 1a4t h ARG 9 Ca 0.20 0.05 0.02 0.00 -1.26 0.00 0.00 59.98 58.99 1a4t h ARG 9 Cb 0.39 0.18 -0.04 0.00 -1.65 0.00 0.00 29.97 28.85 1a4t h ARG 9 CO -0.75 -0.46 0.39 -0.09 0.56 0.00 0.00 179.97 179.62 1a4t h ARG 10 N -0.99 0.76 -0.12 0.04 2.43 -1.21 -3.13 114.38 112.16 1a4t h ARG 10 Ca -0.08 -0.05 0.04 0.00 -0.81 0.00 0.00 59.98 59.08 1a4t h ARG 10 Cb 0.67 -0.17 -0.06 0.00 -0.42 0.00 0.00 29.97 29.98 1a4t h ARG 10 CO 0.13 0.50 -0.43 -0.09 -1.51 0.00 0.00 179.97 178.58 1a4t h ARG 11 N 0.79 -0.49 -0.93 0.20 2.43 -0.33 -0.77 114.38 115.27 1a4t h ARG 11 Ca 0.24 0.03 0.12 0.00 -0.81 0.00 0.00 59.98 59.56 1a4t h ARG 11 Cb -0.03 0.11 -0.14 0.00 -0.42 0.00 0.00 29.97 29.49 1a4t h ARG 11 CO -0.08 -0.32 -0.48 -0.22 -1.51 0.00 0.00 179.97 177.36 1a4t h LYS 12 N -0.50 -0.04 0.19 0.20 3.64 -1.49 0.14 116.57 118.71 1a4t h LYS 12 Ca 0.07 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.44 1a4t h LYS 12 Cb 0.63 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.46 1a4t h LYS 12 CO -0.39 -0.02 -0.09 -0.07 -2.27 0.00 0.00 179.45 176.60 1a4t h LEU 13 N -0.04 -0.21 -0.64 5.20 -0.00 -1.57 -2.32 115.31 115.73 1a4t h LEU 13 Ca 0.25 -0.15 0.12 0.00 -0.00 0.00 0.00 57.88 58.09 1a4t h LEU 13 Cb 0.52 0.06 -0.09 0.00 -0.00 0.00 0.00 40.66 41.15 1a4t h LEU 13 CO -0.92 0.03 0.17 0.00 -0.00 0.00 0.00 178.44 177.71 1a4t h ALA 14 N 0.31 0.79 0.68 1.53 0.00 -0.58 -1.09 119.26 120.91 1a4t h ALA 14 Ca -0.03 0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1a4t h ALA 14 Cb 0.35 0.16 0.01 0.00 0.00 0.00 0.00 17.79 18.31 1a4t h ALA 14 CO 0.04 -0.28 -0.33 0.82 0.00 0.00 0.00 179.25 179.50 1a4t h ILE 15 N 0.30 0.25 -0.65 0.00 5.03 -0.76 -3.13 117.51 118.55 1a4t h ILE 15 Ca 0.34 -0.17 0.19 0.00 -0.12 0.00 0.00 64.86 65.10 1a4t h ILE 15 Cb 0.50 0.30 -0.03 0.00 -3.03 0.00 0.00 36.82 34.57 1a4t h ILE 15 CO -0.40 0.02 0.58 -0.08 -0.68 0.00 0.00 178.15 177.59 1a4t h GLU 16 N -1.05 0.00 0.07 2.37 4.81 -0.84 -0.91 114.58 119.03 1a4t h GLU 16 Ca -0.09 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.14 1a4t h GLU 16 Cb 0.73 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.10 1a4t h GLU 16 CO 0.15 0.00 -0.08 0.00 -0.73 0.00 0.00 179.01 178.35 1a4t h ARG 17 N 0.00 -0.17 -0.12 1.92 3.08 -1.16 -3.16 114.38 114.77 1a4t h ARG 17 Ca 0.31 0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.35 1a4t h ARG 17 Cb 1.47 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 31.55 1a4t h ARG 17 CO -0.00 -0.12 -0.00 -0.44 -1.07 0.00 0.00 179.97 178.34 1a4t h ASP 18 N -0.18 0.21 0.00 7.04 3.32 -1.29 -3.52 116.42 122.00 1a4t h ASP 18 Ca 0.01 -0.31 0.00 0.00 0.02 0.00 0.00 57.03 56.75 1a4t h ASP 18 Cb 0.18 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.68 1a4t h ASP 18 CO -0.04 0.47 0.00 0.35 -1.72 0.00 0.00 179.24 178.31