#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nrr n ASP 1 N 0.00 2.63 -4.57 0.00 2.03 -1.26 -5.03 116.55 110.35 1nrr n ASP 1 Ca 0.00 -1.80 -0.40 0.00 0.52 0.00 0.00 54.79 53.11 1nrr n ASP 1 Cb 0.00 -0.02 0.03 0.00 -0.72 0.00 0.00 41.12 40.41 1nrr n ASP 1 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1nrr n GLY 2 N 1.36 0.33 3.21 0.00 0.00 -1.26 -4.97 105.19 103.86 1nrr n GLY 2 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 1nrr n GLY 2 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nrr s LEU 3 N 0.00 4.91 -0.02 0.99 1.43 -1.15 -5.02 118.68 119.83 1nrr s LEU 3 Ca 0.00 -1.61 -0.30 0.00 -1.03 0.00 0.00 54.13 51.19 1nrr s LEU 3 Cb 0.00 -1.88 -0.04 0.00 0.03 0.00 0.00 46.19 44.30 1nrr s LEU 3 CO 0.00 -0.48 1.24 -0.13 0.23 0.00 0.00 176.35 177.21 1nrr s ARG 4 N 1.30 4.35 0.31 1.70 0.52 -1.26 -4.81 118.95 121.07 1nrr s ARG 4 Ca 0.03 1.75 0.07 0.00 -0.52 0.00 0.00 55.73 57.06 1nrr s ARG 4 Cb -0.22 -3.52 0.82 0.00 0.52 0.00 0.00 34.95 32.55 1nrr s ARG 4 CO -0.00 -0.43 1.72 -1.35 0.02 0.00 0.00 175.30 175.25 1nrr h PRO 5 N 7.40 0.50 -0.09 3.54 0.11 -1.97 -0.91 132.00 140.57 1nrr h PRO 5 Ca -0.36 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1nrr h PRO 5 Cb 1.18 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1nrr h PRO 5 CO 0.87 0.33 0.00 1.28 -0.21 0.00 0.00 178.00 180.27 1nrr n LEU 6 N -4.94 1.92 0.00 2.35 4.77 -1.26 -4.22 117.00 115.62 1nrr n LEU 6 Ca 0.25 -0.71 0.00 0.00 -0.03 0.00 0.00 56.01 55.52 1nrr n LEU 6 Cb 0.71 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.74 1nrr n LEU 6 CO 0.15 0.36 0.00 0.49 -1.33 0.00 0.00 177.39 177.06 1nrr n PHE 7 N 0.49 0.00 -0.04 -1.77 3.72 -0.38 -4.75 117.46 114.73 1nrr n PHE 7 Ca 0.17 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.46 1nrr n PHE 7 Cb 0.40 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.89 1nrr n PHE 7 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1nrr h GLU 8 N 0.00 -0.41 -1.21 -1.08 3.07 -1.52 0.56 114.58 113.99 1nrr h GLU 8 Ca 0.00 0.03 0.35 0.00 -0.50 0.00 0.00 59.36 59.24 1nrr h GLU 8 Cb 0.00 0.09 -0.05 0.00 -0.84 0.00 0.00 28.75 27.95 1nrr h GLU 8 CO 0.00 -0.27 0.86 0.87 -1.40 0.00 0.00 179.01 179.07 1nrr h LYS 9 N -0.42 0.03 -0.09 2.33 6.56 -1.69 0.24 116.57 123.53 1nrr h LYS 9 Ca 0.10 -0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.69 1nrr h LYS 9 Cb 0.60 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.25 1nrr h LYS 9 CO -0.45 0.02 0.00 1.63 -2.06 0.00 0.00 179.45 178.59 1nrr n LYS 10 N -4.21 1.05 -3.12 3.15 5.02 -0.79 -4.97 118.16 114.30 1nrr n LYS 10 Ca 0.26 -1.35 -0.19 0.00 -2.02 0.00 0.00 58.31 55.01 1nrr n LYS 10 Cb 1.25 -1.22 0.05 0.00 -0.02 0.00 0.00 35.03 35.09 1nrr n LYS 10 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1nrr n SER 11 N 0.58 -5.55 -4.60 4.39 2.88 0.31 -5.01 113.62 106.61 1nrr n SER 11 Ca 0.07 -0.33 -0.34 0.00 -1.33 0.00 0.00 58.87 56.95 1nrr n SER 11 Cb 0.31 -4.30 -0.11 0.00 -0.75 0.00 0.00 64.21 59.36 1nrr n SER 11 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1nrr s LEU 12 N -5.97 3.25 -0.04 2.46 1.43 0.17 -4.97 118.68 115.00 1nrr s LEU 12 Ca 0.36 -0.00 -0.03 0.00 -1.03 0.00 0.00 54.13 53.43 1nrr s LEU 12 Cb -0.16 -1.73 -0.04 0.00 0.03 0.00 0.00 46.19 44.30 1nrr s LEU 12 CO 0.44 0.36 0.10 -1.61 0.23 0.00 0.00 176.35 175.87 1nrr s GLU 13 N -0.89 3.22 0.78 1.70 2.02 -1.26 -3.52 118.70 120.74 1nrr s GLU 13 Ca 0.13 -0.36 -0.12 0.00 0.02 0.00 0.00 54.97 54.64 1nrr s GLU 13 Cb -0.11 -2.98 0.06 0.00 0.10 0.00 0.00 34.13 31.20 1nrr s GLU 13 CO 0.02 0.69 1.14 0.16 0.02 0.00 0.00 175.26 177.29 1nrr s ASP 14 N -1.50 4.76 0.64 -0.19 1.47 -1.26 -4.98 116.67 115.61 1nrr s ASP 14 Ca 0.21 0.96 0.41 0.00 1.18 0.00 0.00 52.55 55.31 1nrr s ASP 14 Cb -0.12 -1.59 2.23 0.00 -0.34 0.00 0.00 42.92 43.11 1nrr s ASP 14 CO 0.11 -1.76 2.32 0.11 0.68 0.00 0.00 175.17 176.63 1nrr h LYS 14 N -0.95 0.00 0.00 2.11 1.57 -2.06 -3.22 116.57 114.02 1nrr h LYS 14 Ca -0.46 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 1nrr h LYS 14 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.61 1nrr h LYS 14 CO 0.64 0.00 -0.25 0.25 -0.57 0.00 0.00 179.45 179.53 1nrr n THR 14 N -3.24 0.33 0.23 -0.16 -2.24 -1.26 -4.80 114.28 103.14 1nrr n THR 14 Ca -0.03 -0.38 0.12 0.00 -2.27 0.00 0.00 64.05 61.49 1nrr n THR 14 Cb 0.09 0.54 0.46 0.00 -2.10 0.00 0.00 70.33 69.32 1nrr n THR 14 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1nrr h GLU 14 N 0.00 0.00 -0.86 -0.78 4.11 -1.96 -2.79 114.58 112.31 1nrr h GLU 14 Ca 0.00 0.00 0.03 0.00 0.07 0.00 0.00 59.36 59.46 1nrr h GLU 14 Cb 1.16 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.37 1nrr h GLU 14 CO 0.00 0.13 0.56 0.00 0.07 0.00 0.00 179.01 179.78 1nrr h ARG 14 N 0.00 1.05 -0.14 1.06 -0.00 -1.87 -2.63 114.38 111.85 1nrr h ARG 14 Ca -0.00 -0.06 0.00 0.00 -0.50 0.00 0.00 59.98 59.42 1nrr h ARG 14 Cb 0.75 -0.24 0.00 0.00 0.00 0.00 0.00 29.97 30.49 1nrr h ARG 14 CO 0.02 0.70 0.00 -1.91 0.00 0.00 0.00 179.97 178.77 1nrr n GLU 14 N -4.44 0.00 0.00 0.04 2.13 -1.05 0.20 120.64 117.52 1nrr n GLU 14 Ca 0.11 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.93 1nrr n GLU 14 Cb 0.09 -0.86 0.00 0.00 0.27 0.00 0.00 31.44 30.94 1nrr n GLU 14 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1nrr n LEU 14 N 0.37 0.00 0.22 4.31 7.99 -0.99 -2.53 117.00 126.36 1nrr n LEU 14 Ca 0.00 0.00 0.10 0.00 -0.01 0.00 0.00 56.01 56.10 1nrr n LEU 14 Cb 0.00 0.00 0.43 0.00 -0.11 0.00 0.00 43.42 43.74 1nrr n LEU 14 CO 0.00 0.00 0.78 -0.33 -1.51 0.00 0.00 177.39 176.33 1nrr h GLU 14 N 0.00 0.00 0.00 3.23 5.08 -0.53 -1.70 114.58 120.66 1nrr h GLU 14 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1nrr h GLU 14 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1nrr h GLU 14 CO 0.00 0.23 -0.01 -1.13 -1.00 0.00 0.00 179.01 177.11 1nrr n SER 14 N -3.37 0.66 -0.48 1.42 3.41 -1.05 -5.23 113.62 108.98 1nrr n SER 14 Ca 0.00 0.55 0.14 0.00 -0.26 0.00 0.00 58.87 59.31 1nrr n SER 14 Cb 0.45 -0.73 0.52 0.00 -0.26 0.00 0.00 64.21 64.20 1nrr n SER 14 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66