#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k21 n ASP 1 N 0.00 3.90 -4.74 0.00 5.75 -1.26 -5.02 116.55 115.18 1k21 n ASP 1 Ca 0.00 -3.15 -0.38 0.00 -0.01 0.00 0.00 54.79 51.26 1k21 n ASP 1 Cb 0.00 -0.59 0.06 0.00 -1.03 0.00 0.00 41.12 39.56 1k21 n ASP 1 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1k21 n GLY 2 N 0.82 0.33 3.17 0.00 0.00 -1.26 -4.97 105.19 103.28 1k21 n GLY 2 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 1k21 n GLY 2 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1k21 s LEU 3 N 0.00 4.27 -0.02 0.99 1.43 -1.12 -5.01 118.68 119.23 1k21 s LEU 3 Ca 0.00 -1.44 -0.30 0.00 -1.03 0.00 0.00 54.13 51.36 1k21 s LEU 3 Cb 0.00 -1.76 -0.04 0.00 0.03 0.00 0.00 46.19 44.43 1k21 s LEU 3 CO 0.00 -0.33 1.17 -0.13 0.23 0.00 0.00 176.35 177.29 1k21 s ARG 4 N 1.24 4.39 0.28 1.70 0.52 -1.26 -4.75 118.95 121.08 1k21 s ARG 4 Ca -0.01 1.67 0.02 0.00 -0.52 0.00 0.00 55.73 56.89 1k21 s ARG 4 Cb -0.20 -3.49 0.65 0.00 0.52 0.00 0.00 34.95 32.42 1k21 s ARG 4 CO -0.01 -0.35 1.75 -1.35 0.02 0.00 0.00 175.30 175.35 1k21 h PRO 5 N 7.21 0.61 -0.03 3.54 0.11 -1.97 -0.81 132.00 140.66 1k21 h PRO 5 Ca -0.37 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1k21 h PRO 5 Cb 1.18 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1k21 h PRO 5 CO 0.85 0.40 0.00 1.28 -0.21 0.00 0.00 178.00 180.32 1k21 n LEU 6 N -4.87 1.62 0.00 2.35 4.77 -1.26 -3.99 117.00 115.62 1k21 n LEU 6 Ca 0.20 -0.55 0.00 0.00 -0.03 0.00 0.00 56.01 55.63 1k21 n LEU 6 Cb 0.53 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 1k21 n LEU 6 CO 0.19 0.28 0.00 0.49 -1.33 0.00 0.00 177.39 177.02 1k21 n PHE 7 N 0.27 0.00 -0.24 -1.77 3.01 -0.48 -4.71 117.46 113.54 1k21 n PHE 7 Ca 0.18 0.00 0.05 0.00 1.01 0.00 0.00 57.45 58.69 1k21 n PHE 7 Cb 0.37 0.00 0.17 0.00 -0.01 0.00 0.00 39.48 40.01 1k21 n PHE 7 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 1k21 h GLU 8 N 0.00 0.35 0.00 -1.08 3.07 -1.53 0.28 114.58 115.67 1k21 h GLU 8 Ca 0.00 -0.02 -0.01 0.00 -0.50 0.00 0.00 59.36 58.83 1k21 h GLU 8 Cb 0.00 -0.08 -0.00 0.00 -0.84 0.00 0.00 28.75 27.83 1k21 h GLU 8 CO 0.00 0.23 -0.03 -0.22 -1.40 0.00 0.00 179.01 177.59 1k21 h LYS 9 N 0.36 0.00 -0.15 2.33 3.64 -1.41 -1.80 116.57 119.54 1k21 h LYS 9 Ca 0.40 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.78 1k21 h LYS 9 Cb 0.63 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.45 1k21 h LYS 9 CO -0.44 0.03 0.00 1.63 -2.27 0.00 0.00 179.45 178.40 1k21 n LYS 10 N -4.35 1.75 -3.49 1.90 5.02 -0.32 -4.98 118.16 113.70 1k21 n LYS 10 Ca -0.03 -1.74 -0.23 0.00 -2.02 0.00 0.00 58.31 54.30 1k21 n LYS 10 Cb 0.11 -1.35 0.07 0.00 -0.02 0.00 0.00 35.03 33.84 1k21 n LYS 10 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1k21 n SER 11 N 1.00 -6.14 -4.53 4.39 2.88 0.80 -5.00 113.62 107.02 1k21 n SER 11 Ca 0.12 -0.49 -0.33 0.00 -1.33 0.00 0.00 58.87 56.84 1k21 n SER 11 Cb 0.46 -4.78 -0.12 0.00 -0.75 0.00 0.00 64.21 59.02 1k21 n SER 11 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1k21 s LEU 12 N -6.91 2.94 0.03 2.46 1.43 -0.06 -4.99 118.68 113.58 1k21 s LEU 12 Ca 0.53 -0.14 0.01 0.00 -1.03 0.00 0.00 54.13 53.50 1k21 s LEU 12 Cb -0.24 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.31 1k21 s LEU 12 CO 0.66 0.34 0.09 -1.61 0.23 0.00 0.00 176.35 176.05 1k21 s GLU 13 N -0.91 3.01 0.77 1.70 2.02 -1.26 -3.79 118.70 120.24 1k21 s GLU 13 Ca 0.13 -0.56 -0.11 0.00 0.02 0.00 0.00 54.97 54.45 1k21 s GLU 13 Cb -0.11 -2.81 0.06 0.00 0.10 0.00 0.00 34.13 31.37 1k21 s GLU 13 CO 0.02 0.61 1.13 0.16 0.02 0.00 0.00 175.26 177.21 1k21 s ASP 14 N -2.02 4.74 0.52 -0.19 3.84 -1.26 -4.96 116.67 117.34 1k21 s ASP 14 Ca 0.26 0.78 0.35 0.00 -0.00 0.00 0.00 52.55 53.94 1k21 s ASP 14 Cb -0.12 -1.36 1.84 0.00 -1.38 0.00 0.00 42.92 41.90 1k21 s ASP 14 CO 0.18 -1.74 2.07 0.11 -0.00 0.00 0.00 175.17 175.79 1k21 h LYS 14 N -0.89 0.00 0.00 2.11 1.57 -2.05 -3.28 116.57 114.02 1k21 h LYS 14 Ca -0.46 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 1k21 h LYS 14 Cb 1.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.62 1k21 h LYS 14 CO 0.65 0.00 0.00 0.25 -0.57 0.00 0.00 179.45 179.78 1k21 n THR 14 N -2.78 0.11 0.27 -0.16 -2.24 -1.26 -4.78 114.28 103.43 1k21 n THR 14 Ca -0.02 -0.29 0.12 0.00 -2.27 0.00 0.00 64.05 61.59 1k21 n THR 14 Cb 0.10 1.35 0.76 0.00 -2.10 0.00 0.00 70.33 70.44 1k21 n THR 14 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1k21 h GLU 14 N 0.00 0.00 -0.16 -0.78 4.11 -1.96 -1.38 114.58 114.41 1k21 h GLU 14 Ca 0.00 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.39 1k21 h GLU 14 Cb 0.37 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1k21 h GLU 14 CO 0.00 0.08 -0.06 -0.09 0.07 0.00 0.00 179.01 179.01 1k21 h ARG 14 N 0.00 0.24 -1.00 1.06 2.43 -1.86 -2.49 114.38 112.75 1k21 h ARG 14 Ca -0.00 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1k21 h ARG 14 Cb 0.19 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 1k21 h ARG 14 CO 0.01 0.32 0.00 -1.91 -1.51 0.00 0.00 179.97 176.88 1k21 n GLU 14 N -4.34 0.06 0.00 0.20 2.13 -0.52 -0.71 120.64 117.45 1k21 n GLU 14 Ca -0.01 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.81 1k21 n GLU 14 Cb 0.22 -1.25 0.00 0.00 0.27 0.00 0.00 31.44 30.68 1k21 n GLU 14 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 1k21 n LEU 14 N 0.72 0.00 0.30 4.31 7.94 -0.94 -2.53 117.00 126.80 1k21 n LEU 14 Ca 0.00 0.00 0.17 0.00 -1.11 0.00 0.00 56.01 55.07 1k21 n LEU 14 Cb 0.02 0.00 0.94 0.00 0.53 0.00 0.00 43.42 44.91 1k21 n LEU 14 CO 0.00 0.00 1.09 -0.33 -1.11 0.00 0.00 177.39 177.04 1k21 h GLU 14 N 0.00 0.00 0.00 1.96 5.08 -1.21 -1.30 114.58 119.11 1k21 h GLU 14 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1k21 h GLU 14 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1k21 h GLU 14 CO 0.00 0.03 -0.28 0.66 -1.00 0.00 0.00 179.01 178.42 1k21 h SER 14 N 0.00 0.00 -0.75 1.42 4.64 -1.75 -3.37 113.55 113.74 1k21 h SER 14 Ca -0.00 -0.07 -0.73 0.00 -0.47 0.00 0.00 61.79 60.52 1k21 h SER 14 Cb 0.14 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.14 1k21 h SER 14 CO 0.00 0.03 2.66 -1.22 -0.87 0.00 0.00 176.83 177.44 1k21 n TYR 14 N -2.38 2.98 1.24 4.77 4.01 -0.49 -5.25 117.16 122.05 1k21 n TYR 14 Ca 0.04 -2.89 0.10 0.00 -0.16 0.00 0.00 57.90 54.99 1k21 n TYR 14 Cb 0.46 -2.18 0.59 0.00 -0.31 0.00 0.00 39.34 37.90 1k21 n TYR 14 CO 0.00 0.00 0.00 0.44 -0.46 0.00 0.00 176.86 176.84