#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qj6 n PHE 1 N 0.00 0.00 0.00 -1.42 -0.00 -0.89 -1.95 117.46 113.20 1qj6 n PHE 1 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1qj6 n PHE 1 Cb 0.00 -0.18 0.00 0.00 -0.00 0.00 0.00 39.48 39.30 1qj6 n PHE 1 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1qj6 n GLY 1 N -0.71 0.31 2.84 7.13 0.00 -1.14 -4.66 105.19 108.97 1qj6 n GLY 1 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1qj6 n GLY 1 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1qj6 n SER 1 N 0.00 7.24 0.00 1.61 7.64 -1.26 -4.80 113.62 124.05 1qj6 n SER 1 Ca 0.00 -3.80 0.00 0.00 1.01 0.00 0.00 58.87 56.08 1qj6 n SER 1 Cb 0.00 -1.03 0.00 0.00 -1.01 0.00 0.00 64.21 62.17 1qj6 n SER 1 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1qj6 n GLY 1 N -0.46 1.93 3.79 0.23 0.00 -0.82 -4.94 105.19 104.92 1qj6 n GLY 1 Ca 0.51 -0.67 -0.38 0.00 0.00 0.00 0.00 46.02 45.48 1qj6 n GLY 1 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1qj6 s GLU 1 N 0.00 4.49 0.00 1.61 4.04 -1.26 -2.10 118.70 125.48 1qj6 s GLU 1 Ca 0.00 1.11 0.00 0.00 0.04 0.00 0.00 54.97 56.12 1qj6 s GLU 1 Cb 0.00 -3.11 0.00 0.00 0.02 0.00 0.00 34.13 31.04 1qj6 s GLU 1 CO 0.00 0.50 0.00 0.00 -1.84 0.00 0.00 175.26 173.92 1qj6 n ALA 1 N 1.26 0.00 1.66 -0.84 0.00 -1.26 -2.86 120.51 118.46 1qj6 n ALA 1 Ca -0.04 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.55 1qj6 n ALA 1 Cb 0.49 0.00 0.67 0.00 0.00 0.00 0.00 19.45 20.61 1qj6 n ALA 1 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1qj6 n ASP 1 N 3.02 0.95 -4.67 0.00 -0.08 -1.26 -5.02 116.55 109.49 1qj6 n ASP 1 Ca 0.00 -1.28 -0.41 0.00 -1.51 0.00 0.00 54.79 51.59 1qj6 n ASP 1 Cb 0.00 -0.00 0.01 0.00 2.34 0.00 0.00 41.12 43.47 1qj6 n ASP 1 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1qj6 n GLY 2 N 0.92 0.60 3.41 0.00 0.00 -1.26 -4.97 105.19 103.89 1qj6 n GLY 2 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 1qj6 n GLY 2 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qj6 s LEU 3 N 0.00 4.28 0.04 0.99 1.43 -1.19 -5.02 118.68 119.22 1qj6 s LEU 3 Ca 0.00 -0.70 -0.26 0.00 -1.03 0.00 0.00 54.13 52.14 1qj6 s LEU 3 Cb 0.00 -1.99 -0.05 0.00 0.03 0.00 0.00 46.19 44.17 1qj6 s LEU 3 CO 0.00 -0.26 0.81 -0.13 0.23 0.00 0.00 176.35 177.00 1qj6 s ARG 4 N 1.58 4.53 0.30 1.70 0.52 -1.26 -4.79 118.95 121.53 1qj6 s ARG 4 Ca 0.03 1.14 0.06 0.00 -0.52 0.00 0.00 55.73 56.44 1qj6 s ARG 4 Cb -0.18 -3.38 0.79 0.00 0.52 0.00 0.00 34.95 32.70 1qj6 s ARG 4 CO 0.06 0.22 1.72 -1.35 0.02 0.00 0.00 175.30 175.97 1qj6 h PRO 5 N 5.86 0.50 -0.01 3.54 0.11 -1.98 -1.60 132.00 138.42 1qj6 h PRO 5 Ca -0.43 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1qj6 h PRO 5 Cb 1.21 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1qj6 h PRO 5 CO 0.72 0.33 -0.14 1.28 -0.21 0.00 0.00 178.00 179.98 1qj6 n LEU 6 N -4.95 1.16 0.00 2.35 4.77 -1.26 -4.24 117.00 114.83 1qj6 n LEU 6 Ca 0.24 -0.33 0.00 0.00 -0.03 0.00 0.00 56.01 55.89 1qj6 n LEU 6 Cb 0.67 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.69 1qj6 n LEU 6 CO 0.15 0.20 0.00 0.49 -1.33 0.00 0.00 177.39 176.91 1qj6 n PHE 7 N -0.36 0.00 -0.22 -1.77 3.72 -0.64 -4.72 117.46 113.47 1qj6 n PHE 7 Ca 0.15 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.56 1qj6 n PHE 7 Cb 0.34 0.00 0.13 0.00 -0.94 0.00 0.00 39.48 39.01 1qj6 n PHE 7 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1qj6 h GLU 8 N 0.00 0.45 0.00 -1.08 3.07 -1.63 -0.68 114.58 114.70 1qj6 h GLU 8 Ca 0.00 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 1qj6 h GLU 8 Cb 0.00 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 27.81 1qj6 h GLU 8 CO 0.00 0.30 0.00 1.63 -1.40 0.00 0.00 179.01 179.54 1qj6 n LYS 9 N -4.96 0.07 -0.03 2.33 4.76 -0.98 -1.96 118.16 117.39 1qj6 n LYS 9 Ca 0.10 0.53 0.01 0.00 -2.87 0.00 0.00 58.31 56.08 1qj6 n LYS 9 Cb 0.30 -1.72 0.03 0.00 -1.84 0.00 0.00 35.03 31.80 1qj6 n LYS 9 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1qj6 n LYS 10 N -1.86 2.48 -3.78 1.97 5.02 -0.54 -4.97 118.16 116.47 1qj6 n LYS 10 Ca -0.00 -1.48 -0.29 0.00 -2.02 0.00 0.00 58.31 54.52 1qj6 n LYS 10 Cb 0.05 -1.05 0.01 0.00 -0.02 0.00 0.00 35.03 34.01 1qj6 n LYS 10 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1qj6 n SER 11 N -0.23 -4.39 -4.79 4.39 2.88 -0.75 -5.00 113.62 105.72 1qj6 n SER 11 Ca 0.02 -0.69 -0.36 0.00 -1.33 0.00 0.00 58.87 56.51 1qj6 n SER 11 Cb 0.26 -3.55 -0.07 0.00 -0.75 0.00 0.00 64.21 60.09 1qj6 n SER 11 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1qj6 s LEU 12 N -7.05 4.13 0.01 2.46 1.43 -0.37 -5.01 118.68 114.27 1qj6 s LEU 12 Ca 0.60 0.33 -0.11 0.00 -1.03 0.00 0.00 54.13 53.92 1qj6 s LEU 12 Cb -0.31 -2.00 -0.05 0.00 0.03 0.00 0.00 46.19 43.86 1qj6 s LEU 12 CO 0.73 0.35 0.35 -1.61 0.23 0.00 0.00 176.35 176.41 1qj6 s GLU 13 N -0.71 3.75 0.86 1.70 2.02 -1.26 -3.97 118.70 121.09 1qj6 s GLU 13 Ca 0.13 0.18 -0.12 0.00 0.02 0.00 0.00 54.97 55.18 1qj6 s GLU 13 Cb -0.12 -3.12 0.10 0.00 0.10 0.00 0.00 34.13 31.09 1qj6 s GLU 13 CO 0.03 0.66 1.11 0.16 0.02 0.00 0.00 175.26 177.23 1qj6 s ASP 14 N -1.39 3.96 0.50 -0.19 1.47 -1.26 -4.97 116.67 114.80 1qj6 s ASP 14 Ca 0.26 1.20 0.20 0.00 1.18 0.00 0.00 52.55 55.39 1qj6 s ASP 14 Cb -0.15 -1.87 1.26 0.00 -0.34 0.00 0.00 42.92 41.82 1qj6 s ASP 14 CO 0.14 -2.29 2.03 0.50 0.68 0.00 0.00 175.17 176.23 1qj6 h LYS 14 N -1.31 0.11 0.00 2.11 1.63 -2.06 -3.16 116.57 113.89 1qj6 h LYS 14 Ca -0.49 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.30 1qj6 h LYS 14 Cb 1.29 -0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.90 1qj6 h LYS 14 CO 0.60 0.08 0.00 0.25 -3.45 0.00 0.00 179.45 176.92 1qj6 n THR 14 N -4.45 0.36 0.23 1.00 -2.24 -1.26 -4.75 114.28 103.18 1qj6 n THR 14 Ca 0.06 -0.57 0.09 0.00 -2.27 0.00 0.00 64.05 61.36 1qj6 n THR 14 Cb 0.40 0.93 0.56 0.00 -2.10 0.00 0.00 70.33 70.13 1qj6 n THR 14 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1qj6 h GLU 14 N 0.00 0.00 -0.99 -0.78 4.11 -1.94 -1.92 114.58 113.06 1qj6 h GLU 14 Ca 0.00 0.00 0.21 0.00 0.07 0.00 0.00 59.36 59.64 1qj6 h GLU 14 Cb 0.34 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.49 1qj6 h GLU 14 CO 0.00 0.21 0.62 -0.09 0.07 0.00 0.00 179.01 179.83 1qj6 h ARG 14 N 0.00 0.55 -0.51 1.06 9.65 -1.85 -2.87 114.38 120.42 1qj6 h ARG 14 Ca -0.00 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.84 1qj6 h ARG 14 Cb 0.53 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 28.99 1qj6 h ARG 14 CO 0.03 0.37 0.00 -1.91 2.80 0.00 0.00 179.97 181.25 1qj6 n GLU 14 N -4.66 0.00 0.00 0.20 2.13 -0.72 -0.76 120.64 116.82 1qj6 n GLU 14 Ca 0.23 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.05 1qj6 n GLU 14 Cb 0.69 -1.08 0.00 0.00 0.27 0.00 0.00 31.44 31.31 1qj6 n GLU 14 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1qj6 n LEU 14 N 0.59 0.00 0.28 4.31 7.99 -1.08 -2.28 117.00 126.80 1qj6 n LEU 14 Ca 0.00 0.00 0.18 0.00 -0.01 0.00 0.00 56.01 56.18 1qj6 n LEU 14 Cb 0.00 0.00 0.84 0.00 -0.11 0.00 0.00 43.42 44.15 1qj6 n LEU 14 CO 0.00 0.00 1.03 -0.33 -1.51 0.00 0.00 177.39 176.58 1qj6 h GLU 14 N 0.00 0.00 -0.00 3.23 5.08 -1.19 -2.49 114.58 119.20 1qj6 h GLU 14 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1qj6 h GLU 14 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1qj6 h GLU 14 CO 0.00 0.00 -0.21 -1.13 -1.00 0.00 0.00 179.01 176.67 1qj6 n SER 14 N -2.95 0.59 -3.71 1.42 3.41 -0.97 -3.11 113.62 108.30 1qj6 n SER 14 Ca -0.01 -0.51 -0.42 0.00 -0.26 0.00 0.00 58.87 57.68 1qj6 n SER 14 Cb 0.20 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.16 1qj6 n SER 14 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1qj6 n TYR 14 N -1.02 2.94 -4.41 7.33 4.01 -0.94 -4.48 117.16 120.59 1qj6 n TYR 14 Ca 0.11 -2.86 -0.37 0.00 -0.16 0.00 0.00 57.90 54.62 1qj6 n TYR 14 Cb 0.31 -2.11 -0.08 0.00 -0.31 0.00 0.00 39.34 37.15 1qj6 n TYR 14 CO 0.00 0.00 0.00 0.44 -0.46 0.00 0.00 176.86 176.84 1qj6 n ILE 14 N 3.43 -0.59 0.00 -0.72 -6.64 -1.26 -3.68 119.36 109.90 1qj6 n ILE 14 Ca 0.50 -0.21 0.00 0.00 -1.77 0.00 0.00 62.75 61.28 1qj6 n ILE 14 Cb 0.33 -0.88 0.00 0.00 -1.44 0.00 0.00 39.64 37.65 1qj6 n ILE 14 CO 0.00 0.00 0.00 0.47 -1.77 0.00 0.00 176.55 175.25 1qj6 n ASP 14 N -2.66 0.00 0.00 7.28 8.00 -1.18 -4.54 116.55 123.45 1qj6 n ASP 14 Ca -0.07 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.43 1qj6 n ASP 14 Cb 0.56 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.66 1qj6 n ASP 14 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1qj6 n GLY 14 N 0.00 4.00 0.00 0.44 0.00 -1.24 -4.55 105.19 103.83 1qj6 n GLY 14 Ca 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 45.08 1qj6 n GLY 14 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36