#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fxt s GLN 2 N 0.00 2.69 0.22 3.17 0.74 -1.26 -2.13 119.66 123.09 1fxt s GLN 2 Ca 0.00 -2.78 -0.28 0.00 0.05 0.00 0.00 55.36 52.34 1fxt s GLN 2 Cb 0.00 -3.73 -0.09 0.00 1.10 0.00 0.00 33.01 30.29 1fxt s GLN 2 CO 0.00 -1.20 0.89 0.96 -0.55 0.00 0.00 175.29 175.39 1fxt s ILE 3 N -0.50 4.17 -0.26 -2.34 -4.36 -0.89 -4.05 121.20 112.96 1fxt s ILE 3 Ca 0.20 1.95 -0.11 0.00 -0.26 0.00 0.00 60.65 62.43 1fxt s ILE 3 Cb -0.16 -4.25 -0.05 0.00 1.25 0.00 0.00 42.46 39.25 1fxt s ILE 3 CO -0.06 0.48 0.17 -0.36 0.24 0.00 0.00 174.94 175.41 1fxt s PHE 4 N -1.21 3.27 -0.41 1.37 0.08 -0.45 -1.37 117.98 119.27 1fxt s PHE 4 Ca 0.40 0.17 -0.19 0.00 0.12 0.00 0.00 56.93 57.43 1fxt s PHE 4 Cb -0.25 -2.33 0.01 0.00 -0.57 0.00 0.00 43.02 39.89 1fxt s PHE 4 CO 0.30 -0.05 0.57 0.08 -0.10 0.00 0.00 175.22 176.02 1fxt s VAL 5 N 1.41 4.93 -0.66 -0.44 1.01 -0.50 -1.17 120.40 124.99 1fxt s VAL 5 Ca 0.07 0.12 -0.27 0.00 0.00 0.00 0.00 61.98 61.90 1fxt s VAL 5 Cb -0.15 -4.10 0.02 0.00 0.00 0.00 0.00 36.38 32.15 1fxt s VAL 5 CO 0.08 -0.44 1.32 -0.75 0.00 0.00 0.00 175.10 175.31 1fxt s LYS 6 N 2.57 3.25 0.78 2.72 2.36 -0.21 -3.02 119.74 128.20 1fxt s LYS 6 Ca 0.20 0.07 -0.12 0.00 -2.55 0.00 0.00 55.97 53.57 1fxt s LYS 6 Cb -0.15 -4.14 0.06 0.00 -1.05 0.00 0.00 37.83 32.55 1fxt s LYS 6 CO 0.16 -2.03 1.14 0.95 1.55 0.00 0.00 175.35 177.11 1fxt s THR 7 N 5.83 2.64 -1.05 3.43 -4.23 -1.26 -1.70 115.64 119.30 1fxt s THR 7 Ca 0.42 0.21 -0.03 0.00 -1.18 0.00 0.00 61.69 61.11 1fxt s THR 7 Cb -0.09 -3.15 0.24 0.00 1.34 0.00 0.00 72.50 70.84 1fxt s THR 7 CO 0.20 -0.27 2.12 0.18 -0.54 0.00 0.00 174.62 176.31 1fxt n LEU 8 N -3.28 7.53 0.00 4.79 4.77 -1.24 -4.56 117.00 125.01 1fxt n LEU 8 Ca 0.07 -5.04 0.00 0.00 -0.03 0.00 0.00 56.01 51.01 1fxt n LEU 8 Cb 0.59 -1.22 0.00 0.00 -2.33 0.00 0.00 43.42 40.45 1fxt n LEU 8 CO 0.57 1.99 -0.06 0.35 -1.33 0.00 0.00 177.39 178.91 1fxt n THR 9 N 0.54 0.00 0.00 -5.08 -2.24 -1.26 -5.00 114.28 101.24 1fxt n THR 9 Ca 0.53 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.31 1fxt n THR 9 Cb 0.28 -0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.40 1fxt n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fxt n GLY 10 N 1.16 2.92 3.62 3.38 0.00 -1.26 -5.06 105.19 109.95 1fxt n GLY 10 Ca 0.00 -0.76 -0.43 0.00 0.00 0.00 0.00 46.02 44.84 1fxt n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1fxt s LYS 11 N 0.00 3.46 -0.05 1.61 2.20 -1.26 -5.00 119.74 120.70 1fxt s LYS 11 Ca 0.00 2.06 -0.01 0.00 -0.36 0.00 0.00 55.97 57.66 1fxt s LYS 11 Cb 0.00 -4.27 -0.03 0.00 -1.51 0.00 0.00 37.83 32.02 1fxt s LYS 11 CO 0.00 -1.72 0.02 0.99 -0.36 0.00 0.00 175.35 174.28 1fxt s THR 12 N 6.90 4.35 -0.11 3.43 2.01 -1.26 -4.56 115.64 126.40 1fxt s THR 12 Ca 0.92 -0.37 0.01 0.00 0.31 0.00 0.00 61.69 62.57 1fxt s THR 12 Cb -0.33 -2.89 -0.02 0.00 0.01 0.00 0.00 72.50 69.27 1fxt s THR 12 CO 0.36 0.50 -0.14 -0.51 -0.69 0.00 0.00 174.62 174.14 1fxt s ILE 13 N -0.99 2.97 0.13 1.82 2.07 -1.17 -5.01 121.20 121.02 1fxt s ILE 13 Ca 0.17 -0.71 -0.30 0.00 -1.41 0.00 0.00 60.65 58.40 1fxt s ILE 13 Cb -0.11 -2.22 -0.06 0.00 0.13 0.00 0.00 42.46 40.19 1fxt s ILE 13 CO 0.06 0.54 1.02 0.42 -1.91 0.00 0.00 174.94 175.08 1fxt s THR 14 N 0.12 4.25 -0.21 4.00 -4.23 -1.26 -1.41 115.64 116.90 1fxt s THR 14 Ca -0.07 1.88 0.01 0.00 -1.18 0.00 0.00 61.69 62.34 1fxt s THR 14 Cb -0.15 -4.20 0.04 0.00 1.34 0.00 0.00 72.50 69.53 1fxt s THR 14 CO 0.05 0.30 -0.14 -0.22 -0.54 0.00 0.00 174.62 174.07 1fxt s LEU 15 N -0.10 2.50 -0.50 4.79 2.96 -0.47 -4.95 118.68 122.91 1fxt s LEU 15 Ca 0.48 -0.92 -0.18 0.00 -0.22 0.00 0.00 54.13 53.29 1fxt s LEU 15 Cb -0.26 -1.39 0.06 0.00 0.50 0.00 0.00 46.19 45.10 1fxt s LEU 15 CO 0.32 -0.10 0.57 -1.61 -1.32 0.00 0.00 176.35 174.20 1fxt s GLU 16 N 1.29 3.09 0.19 1.98 8.01 -1.26 -2.10 118.70 129.89 1fxt s GLU 16 Ca -0.01 -0.99 -0.07 0.00 0.01 0.00 0.00 54.97 53.91 1fxt s GLU 16 Cb -0.16 -4.10 -0.02 0.00 -4.31 0.00 0.00 34.13 25.54 1fxt s GLU 16 CO -0.09 -1.16 0.26 0.14 0.01 0.00 0.00 175.26 174.42 1fxt s VAL 17 N 2.39 0.04 0.28 2.63 -7.23 -0.90 -5.05 120.40 112.55 1fxt s VAL 17 Ca 0.12 -1.61 0.03 0.00 -1.81 0.00 0.00 61.98 58.71 1fxt s VAL 17 Cb -0.20 -2.11 -0.06 0.00 0.56 0.00 0.00 36.38 34.57 1fxt s VAL 17 CO 0.11 -0.18 0.05 -1.61 -0.31 0.00 0.00 175.10 173.16 1fxt s GLU 18 N -4.04 1.49 0.55 4.82 0.41 -1.26 -2.25 118.70 118.42 1fxt s GLU 18 Ca 0.25 -1.80 0.18 0.00 -0.41 0.00 0.00 54.97 53.19 1fxt s GLU 18 Cb 0.04 -0.60 0.97 0.00 -1.78 0.00 0.00 34.13 32.76 1fxt s GLU 18 CO 0.05 -0.20 1.51 -1.35 -0.49 0.00 0.00 175.26 174.78 1fxt h PRO 19 N 2.30 0.00 0.00 0.39 0.11 -1.96 -1.66 132.00 131.18 1fxt h PRO 19 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1fxt h PRO 19 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1fxt h PRO 19 CO 0.65 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.10 1fxt h SER 20 N 0.00 0.00 -3.20 -2.05 4.64 -1.98 -2.28 113.55 108.68 1fxt h SER 20 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 1fxt h SER 20 Cb 0.96 0.00 0.08 0.00 -0.31 0.00 0.00 62.40 63.13 1fxt h SER 20 CO 0.00 0.00 0.91 -0.62 -0.87 0.00 0.00 176.83 176.25 1fxt s ASP 21 N -5.66 6.39 0.55 4.97 2.15 -0.63 -4.73 116.67 119.71 1fxt s ASP 21 Ca 0.01 2.92 -0.16 0.00 0.43 0.00 0.00 52.55 55.75 1fxt s ASP 21 Cb 0.09 -2.63 -0.06 0.00 -0.30 0.00 0.00 42.92 40.02 1fxt s ASP 21 CO 0.54 -0.92 1.02 0.42 -0.17 0.00 0.00 175.17 176.06 1fxt s THR 22 N 0.24 4.24 0.24 1.71 -4.23 -1.26 -1.75 115.64 114.83 1fxt s THR 22 Ca 0.65 1.07 -0.01 0.00 -1.18 0.00 0.00 61.69 62.22 1fxt s THR 22 Cb -0.48 -3.59 0.05 0.00 1.34 0.00 0.00 72.50 69.83 1fxt s THR 22 CO 0.44 -0.62 1.67 0.40 -0.54 0.00 0.00 174.62 175.98 1fxt h ILE 23 N 0.71 1.27 -0.38 2.99 1.08 -1.24 0.29 117.51 122.23 1fxt h ILE 23 Ca -0.47 -1.29 0.03 0.00 -0.39 0.00 0.00 64.86 62.74 1fxt h ILE 23 Cb 1.20 1.25 -0.05 0.00 -3.07 0.00 0.00 36.82 36.15 1fxt h ILE 23 CO 0.60 0.42 -0.22 1.21 -0.69 0.00 0.00 178.15 179.47 1fxt n GLU 24 N -4.12 -0.17 -0.04 2.37 2.13 -0.83 -1.20 120.64 118.79 1fxt n GLU 24 Ca 0.00 0.80 -0.00 0.00 0.66 0.00 0.00 57.16 58.61 1fxt n GLU 24 Cb 0.42 -1.18 0.28 0.00 0.27 0.00 0.00 31.44 31.23 1fxt n GLU 24 CO 0.00 0.00 0.00 -0.97 -0.41 0.00 0.00 177.13 175.75 1fxt h ASN 25 N 0.00 0.56 0.01 4.31 -1.24 -1.71 -1.00 115.58 116.51 1fxt h ASN 25 Ca 0.06 -0.09 0.03 0.00 0.71 0.00 0.00 56.30 57.01 1fxt h ASN 25 Cb 0.16 -0.15 -0.05 0.00 0.73 0.00 0.00 38.32 39.01 1fxt h ASN 25 CO -0.36 0.59 -0.30 0.58 -1.29 0.00 0.00 177.43 176.65 1fxt h VAL 26 N 0.59 0.34 -0.92 2.57 2.07 -0.90 -0.73 116.25 119.27 1fxt h VAL 26 Ca 0.13 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.65 1fxt h VAL 26 Cb 0.27 0.34 -0.04 0.00 -1.52 0.00 0.00 31.29 30.34 1fxt h VAL 26 CO 0.00 0.00 0.56 0.11 0.02 0.00 0.00 177.57 178.26 1fxt h LYS 27 N -0.45 1.25 -0.12 1.57 1.57 -0.94 -2.11 116.57 117.33 1fxt h LYS 27 Ca 0.06 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1fxt h LYS 27 Cb 0.54 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 1fxt h LYS 27 CO -0.25 0.87 0.08 0.00 -0.57 0.00 0.00 179.45 179.58 1fxt h ALA 28 N 1.34 0.15 0.00 3.86 0.00 -1.19 -1.99 119.26 121.44 1fxt h ALA 28 Ca 0.33 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.23 1fxt h ALA 28 Cb -0.06 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1fxt h ALA 28 CO -0.06 -0.36 -0.01 0.87 0.00 0.00 0.00 179.25 179.68 1fxt h LYS 29 N 0.16 0.00 0.08 0.00 1.57 -1.05 -0.98 116.57 116.35 1fxt h LYS 29 Ca 0.04 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.68 1fxt h LYS 29 Cb -0.02 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.30 1fxt h LYS 29 CO -0.01 0.01 -0.69 0.82 -0.57 0.00 0.00 179.45 179.01 1fxt h ILE 30 N 0.00 1.48 -0.45 1.86 2.04 -1.38 -3.35 117.51 117.71 1fxt h ILE 30 Ca -0.00 -2.43 0.09 0.00 1.00 0.00 0.00 64.86 63.52 1fxt h ILE 30 Cb 0.20 3.12 -0.02 0.00 -0.74 0.00 0.00 36.82 39.38 1fxt h ILE 30 CO 0.00 0.65 0.31 -0.61 0.00 0.00 0.00 178.15 178.51 1fxt h GLN 31 N -0.60 0.21 0.00 2.37 4.15 -1.25 -2.46 115.11 117.53 1fxt h GLN 31 Ca -0.14 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.27 1fxt h GLN 31 Cb 1.44 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 29.08 1fxt h GLN 31 CO 0.07 0.14 0.00 -3.47 -1.93 0.00 0.00 178.83 173.63 1fxt n ASP 32 N -4.46 0.00 0.21 -0.69 2.03 -0.38 -2.72 116.55 110.54 1fxt n ASP 32 Ca 0.07 0.23 0.11 0.00 0.52 0.00 0.00 54.79 55.71 1fxt n ASP 32 Cb 0.37 0.00 0.16 0.00 -0.72 0.00 0.00 41.12 40.93 1fxt n ASP 32 CO 0.00 0.00 0.00 0.07 -1.92 0.00 0.00 177.20 175.35 1fxt h LYS 33 N 0.00 0.00 0.02 -0.67 2.10 -1.70 -3.35 116.57 112.98 1fxt h LYS 33 Ca 0.00 0.00 -0.36 0.00 -2.00 0.00 0.00 60.65 58.29 1fxt h LYS 33 Cb 0.00 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 31.27 1fxt h LYS 33 CO 0.00 0.07 -2.26 0.39 -2.00 0.00 0.00 179.45 175.65 1fxt n GLU 34 N -3.12 0.68 -0.95 0.07 -0.58 -0.94 -5.06 120.64 110.74 1fxt n GLU 34 Ca 0.04 0.14 0.00 0.00 -0.42 0.00 0.00 57.16 56.91 1fxt n GLU 34 Cb 0.55 -1.59 0.00 0.00 -0.57 0.00 0.00 31.44 29.83 1fxt n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1fxt n GLY 35 N 1.94 0.44 3.66 0.62 0.00 -1.10 -5.01 105.19 105.75 1fxt n GLY 35 Ca -0.35 -0.74 -0.42 0.00 0.00 0.00 0.00 46.02 44.52 1fxt n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fxt s ILE 36 N -2.00 4.83 0.25 -0.61 1.01 -1.26 -4.93 121.20 118.50 1fxt s ILE 36 Ca 0.00 1.71 -0.31 0.00 0.00 0.00 0.00 60.65 62.06 1fxt s ILE 36 Cb 0.00 -4.17 -0.14 0.00 0.01 0.00 0.00 42.46 38.16 1fxt s ILE 36 CO 0.00 -0.03 1.32 -2.65 0.00 0.00 0.00 174.94 173.58 1fxt n PRO 37 N 5.55 1.88 -0.32 2.79 -0.02 -1.26 -4.26 135.00 139.35 1fxt n PRO 37 Ca 0.06 0.67 0.26 0.00 -2.02 0.00 0.00 63.50 62.47 1fxt n PRO 37 Cb 0.48 -2.27 0.58 0.00 -0.02 0.00 0.00 33.50 32.27 1fxt n PRO 37 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1fxt h PRO 38 N 3.66 0.27 -0.40 0.52 0.11 -1.96 -1.44 132.00 132.77 1fxt h PRO 38 Ca -0.44 -0.02 -0.13 0.00 0.11 0.00 0.00 66.00 65.52 1fxt h PRO 38 Cb 1.29 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1fxt h PRO 38 CO 0.72 0.18 -0.26 0.22 -0.21 0.00 0.00 178.00 178.64 1fxt h ASP 39 N 0.28 0.85 -0.30 -2.05 3.58 -1.94 -3.16 116.42 113.68 1fxt h ASP 39 Ca 0.60 -0.33 0.01 0.00 0.42 0.00 0.00 57.03 57.73 1fxt h ASP 39 Cb 1.74 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 42.54 1fxt h ASP 39 CO -0.23 1.06 0.20 1.56 -2.88 0.00 0.00 179.24 178.95 1fxt h GLN 40 N 0.71 0.37 -5.62 0.28 4.20 -1.41 -3.42 115.11 110.22 1fxt h GLN 40 Ca 0.09 -0.02 -0.42 0.00 0.06 0.00 0.00 58.65 58.36 1fxt h GLN 40 Cb 0.80 -0.08 -0.05 0.00 0.30 0.00 0.00 27.48 28.44 1fxt h GLN 40 CO 0.07 0.25 1.31 -0.65 -0.67 0.00 0.00 178.83 179.13 1fxt s GLN 41 N -5.36 2.89 -0.92 1.46 -0.21 -0.88 -1.31 119.66 115.32 1fxt s GLN 41 Ca -0.07 -1.25 -0.20 0.00 0.02 0.00 0.00 55.36 53.86 1fxt s GLN 41 Cb 0.17 -5.30 0.11 0.00 1.00 0.00 0.00 33.01 29.00 1fxt s GLN 41 CO 0.71 -3.44 1.18 0.50 -2.12 0.00 0.00 175.29 172.12 1fxt s ARG 42 N 5.96 3.56 -0.08 2.91 3.52 -0.65 -4.98 118.95 129.18 1fxt s ARG 42 Ca 0.64 -1.57 -0.22 0.00 -0.13 0.00 0.00 55.73 54.46 1fxt s ARG 42 Cb -0.00 -4.94 -0.04 0.00 -1.56 0.00 0.00 34.95 28.41 1fxt s ARG 42 CO 0.09 -1.86 0.64 -0.51 -0.81 0.00 0.00 175.30 172.85 1fxt s LEU 43 N 3.23 4.30 -0.06 -0.88 1.43 -1.26 -1.21 118.68 124.22 1fxt s LEU 43 Ca 0.34 1.08 0.04 0.00 -1.03 0.00 0.00 54.13 54.57 1fxt s LEU 43 Cb -0.05 -2.98 -0.00 0.00 0.03 0.00 0.00 46.19 43.20 1fxt s LEU 43 CO -0.08 -0.09 -0.19 -0.63 0.23 0.00 0.00 176.35 175.59 1fxt s ILE 44 N 0.79 1.65 -0.32 -0.59 -1.09 -0.41 -0.86 121.20 120.37 1fxt s ILE 44 Ca 0.34 -0.82 -0.01 0.00 -2.23 0.00 0.00 60.65 57.94 1fxt s ILE 44 Cb -0.17 -1.42 0.13 0.00 -1.58 0.00 0.00 42.46 39.42 1fxt s ILE 44 CO 0.16 0.47 0.24 0.12 -1.23 0.00 0.00 174.94 174.70 1fxt s PHE 45 N 0.16 0.04 -0.26 3.97 5.36 -0.12 -1.83 117.98 125.29 1fxt s PHE 45 Ca -0.09 -0.79 -0.09 0.00 -0.96 0.00 0.00 56.93 55.00 1fxt s PHE 45 Cb -0.14 -0.67 0.01 0.00 -0.34 0.00 0.00 43.02 41.88 1fxt s PHE 45 CO 0.04 -0.89 0.21 0.00 -1.46 0.00 0.00 175.22 173.12 1fxt n ALA 46 N 4.84 -2.81 -0.84 11.12 0.00 -1.26 -3.47 120.51 128.09 1fxt n ALA 46 Ca 0.02 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1fxt n ALA 46 Cb 0.43 -1.56 0.00 0.00 0.00 0.00 0.00 19.45 18.32 1fxt n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fxt n GLY 47 N 0.56 0.67 3.25 0.00 0.00 -1.26 -5.01 105.19 103.40 1fxt n GLY 47 Ca 0.01 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.90 1fxt n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fxt s LYS 48 N -0.33 0.55 0.33 1.61 1.02 -1.23 -5.16 119.74 116.53 1fxt s LYS 48 Ca 0.00 0.19 -0.14 0.00 0.02 0.00 0.00 55.97 56.04 1fxt s LYS 48 Cb 0.00 0.25 -0.08 0.00 -0.52 0.00 0.00 37.83 37.48 1fxt s LYS 48 CO 0.00 -0.12 0.74 -1.14 -0.92 0.00 0.00 175.35 173.91 1fxt s GLN 49 N -0.52 3.96 -0.79 1.68 0.74 -1.26 -0.95 119.66 122.52 1fxt s GLN 49 Ca -0.06 0.62 -0.24 0.00 0.05 0.00 0.00 55.36 55.73 1fxt s GLN 49 Cb -0.04 -2.43 0.05 0.00 1.10 0.00 0.00 33.01 31.70 1fxt s GLN 49 CO 0.02 0.13 1.21 -0.51 -0.55 0.00 0.00 175.29 175.59 1fxt s LEU 50 N -3.12 3.74 0.24 3.68 1.43 -0.04 -4.88 118.68 119.72 1fxt s LEU 50 Ca 0.53 -0.94 -0.30 0.00 -1.03 0.00 0.00 54.13 52.39 1fxt s LEU 50 Cb -0.10 -2.51 -0.10 0.00 0.03 0.00 0.00 46.19 43.51 1fxt s LEU 50 CO 0.20 -1.59 1.39 -0.70 0.23 0.00 0.00 176.35 175.87 1fxt s GLU 51 N 4.85 4.31 0.10 1.70 2.12 -1.26 -4.74 118.70 125.78 1fxt s GLU 51 Ca 0.33 2.22 -0.19 0.00 0.36 0.00 0.00 54.97 57.69 1fxt s GLU 51 Cb -0.09 -3.14 -0.06 0.00 0.26 0.00 0.00 34.13 31.11 1fxt s GLU 51 CO 0.06 -0.35 1.65 -0.44 -0.54 0.00 0.00 175.26 175.64 1fxt h ASP 52 N 5.06 0.35 -0.74 -1.70 5.19 -1.96 -3.34 116.42 119.27 1fxt h ASP 52 Ca -0.46 -0.16 -0.72 0.00 -0.62 0.00 0.00 57.03 55.06 1fxt h ASP 52 Cb 1.22 -0.09 -0.08 0.00 0.18 0.00 0.00 39.33 40.55 1fxt h ASP 52 CO 0.77 0.42 2.78 0.61 -3.12 0.00 0.00 179.24 180.70 1fxt n GLY 53 N -0.73 4.73 3.37 2.75 0.00 -1.26 -1.97 105.19 112.08 1fxt n GLY 53 Ca -0.03 -1.86 -0.12 0.00 0.00 0.00 0.00 46.02 44.02 1fxt n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1fxt s ARG 54 N 0.79 1.44 0.45 1.61 1.81 -1.26 -5.02 118.95 118.78 1fxt s ARG 54 Ca 0.53 -1.54 -0.01 0.00 -1.72 0.00 0.00 55.73 52.98 1fxt s ARG 54 Cb 0.15 0.36 -0.01 0.00 -0.45 0.00 0.00 34.95 35.00 1fxt s ARG 54 CO -0.06 -0.54 0.69 0.95 -0.68 0.00 0.00 175.30 175.66 1fxt s THR 55 N -3.94 4.35 0.29 0.02 -4.23 -1.26 -1.03 115.64 109.84 1fxt s THR 55 Ca 0.33 -0.32 -0.02 0.00 -1.18 0.00 0.00 61.69 60.50 1fxt s THR 55 Cb 0.03 -3.62 0.27 0.00 1.34 0.00 0.00 72.50 70.52 1fxt s THR 55 CO 0.13 -0.48 1.93 -0.07 -0.54 0.00 0.00 174.62 175.59 1fxt h LEU 56 N 0.39 0.98 -1.54 4.79 3.38 -1.43 -3.31 115.31 118.58 1fxt h LEU 56 Ca -0.47 -0.01 0.10 0.00 0.09 0.00 0.00 57.88 57.59 1fxt h LEU 56 Cb 1.24 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.72 1fxt h LEU 56 CO 0.59 0.67 0.45 0.77 0.09 0.00 0.00 178.44 181.01 1fxt h SER 57 N 1.13 0.47 -1.25 -0.43 4.64 -1.72 -2.89 113.55 113.50 1fxt h SER 57 Ca 0.37 0.01 0.41 0.00 -0.47 0.00 0.00 61.79 62.11 1fxt h SER 57 Cb 0.04 -0.09 -0.13 0.00 -0.31 0.00 0.00 62.40 61.91 1fxt h SER 57 CO -0.11 0.28 0.79 0.44 -0.87 0.00 0.00 176.83 177.35 1fxt h ASP 58 N 0.52 0.29 -0.02 4.97 5.19 -1.90 -3.26 116.42 122.21 1fxt h ASP 58 Ca 0.31 0.15 0.00 0.00 -0.62 0.00 0.00 57.03 56.87 1fxt h ASP 58 Cb 0.53 0.13 0.00 0.00 0.18 0.00 0.00 39.33 40.17 1fxt h ASP 58 CO -0.10 -0.18 -0.19 -1.22 -3.12 0.00 0.00 179.24 174.44 1fxt n TYR 59 N -4.76 0.00 -3.61 4.55 4.01 -1.09 -5.01 117.16 111.26 1fxt n TYR 59 Ca 0.36 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.90 1fxt n TYR 59 Cb 1.34 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 40.42 1fxt n TYR 59 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1fxt n ASN 60 N 0.56 -1.59 -4.47 7.72 2.85 -1.23 -4.99 115.26 114.10 1fxt n ASN 60 Ca 0.10 -0.76 -0.43 0.00 -0.11 0.00 0.00 54.58 53.38 1fxt n ASN 60 Cb 0.45 -4.40 -0.03 0.00 1.24 0.00 0.00 39.78 37.04 1fxt n ASN 60 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1fxt s ILE 61 N -3.57 4.36 0.66 -1.44 1.01 -1.25 -5.03 121.20 115.94 1fxt s ILE 61 Ca 0.02 -0.68 -0.09 0.00 0.00 0.00 0.00 60.65 59.90 1fxt s ILE 61 Cb -0.00 -4.76 0.02 0.00 0.01 0.00 0.00 42.46 37.72 1fxt s ILE 61 CO 0.79 -1.54 1.00 -1.10 0.00 0.00 0.00 174.94 174.09 1fxt s GLN 62 N 3.88 2.79 0.28 2.79 -0.21 -1.26 -4.88 119.66 123.06 1fxt s GLN 62 Ca 0.28 0.18 -0.30 0.00 0.02 0.00 0.00 55.36 55.53 1fxt s GLN 62 Cb -0.11 -2.14 -0.12 0.00 1.00 0.00 0.00 33.01 31.63 1fxt s GLN 62 CO 0.03 -0.92 1.48 0.36 -2.12 0.00 0.00 175.29 174.12 1fxt n LYS 63 N -2.82 2.36 -2.30 2.91 2.85 -1.26 -2.72 118.16 117.18 1fxt n LYS 63 Ca 0.06 0.84 -0.21 0.00 -1.05 0.00 0.00 58.31 57.95 1fxt n LYS 63 Cb 0.58 -2.55 -0.02 0.00 -0.65 0.00 0.00 35.03 32.39 1fxt n LYS 63 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1fxt n GLU 64 N 1.87 -1.66 -2.71 -1.58 4.71 -1.26 -5.01 120.64 114.99 1fxt n GLU 64 Ca 0.09 1.04 -0.31 0.00 -0.01 0.00 0.00 57.16 57.97 1fxt n GLU 64 Cb 0.35 -5.67 -0.03 0.00 -1.01 0.00 0.00 31.44 25.07 1fxt n GLU 64 CO 0.00 0.00 0.00 -1.12 0.09 0.00 0.00 177.13 176.10 1fxt s SER 65 N -2.14 6.55 -0.37 1.62 0.01 -1.10 -4.65 113.70 113.62 1fxt s SER 65 Ca 0.00 1.27 -0.21 0.00 1.31 0.00 0.00 55.95 58.32 1fxt s SER 65 Cb 0.00 -2.38 0.01 0.00 0.21 0.00 0.00 66.02 63.86 1fxt s SER 65 CO 0.00 -0.46 0.69 -0.89 0.41 0.00 0.00 173.24 172.99 1fxt s THR 66 N -2.45 4.83 -0.14 1.44 2.01 -1.26 -1.34 115.64 118.73 1fxt s THR 66 Ca 0.54 0.64 -0.23 0.00 0.31 0.00 0.00 61.69 62.95 1fxt s THR 66 Cb -0.10 -4.13 -0.03 0.00 0.01 0.00 0.00 72.50 68.25 1fxt s THR 66 CO 0.31 -0.39 0.69 -0.76 -0.69 0.00 0.00 174.62 173.79 1fxt s LEU 67 N 2.86 4.21 -0.69 4.42 1.43 -0.31 -4.94 118.68 125.66 1fxt s LEU 67 Ca 0.27 1.03 -0.19 0.00 -1.03 0.00 0.00 54.13 54.21 1fxt s LEU 67 Cb -0.14 -3.02 0.12 0.00 0.03 0.00 0.00 46.19 43.17 1fxt s LEU 67 CO 0.16 -0.24 0.82 -1.00 0.23 0.00 0.00 176.35 176.32 1fxt s HIS 68 N 1.54 3.06 -0.45 0.29 3.76 -0.76 -1.04 115.29 121.69 1fxt s HIS 68 Ca 0.34 -1.10 -0.27 0.00 -0.15 0.00 0.00 55.06 53.88 1fxt s HIS 68 Cb -0.17 -4.08 0.03 0.00 1.11 0.00 0.00 32.58 29.47 1fxt s HIS 68 CO 0.13 -1.35 1.03 -1.17 -0.85 0.00 0.00 174.74 172.54 1fxt s LEU 69 N 2.60 3.84 -0.22 0.89 2.96 -0.69 -1.28 118.68 126.77 1fxt s LEU 69 Ca 0.17 0.39 -0.14 0.00 -0.22 0.00 0.00 54.13 54.34 1fxt s LEU 69 Cb -0.18 -3.38 -0.04 0.00 0.50 0.00 0.00 46.19 43.08 1fxt s LEU 69 CO 0.02 -1.11 0.31 -0.69 -1.32 0.00 0.00 176.35 173.57 1fxt s VAL 70 N 4.02 5.25 -0.82 1.68 1.01 -0.35 -3.68 120.40 127.52 1fxt s VAL 70 Ca 0.43 0.51 -0.24 0.00 0.00 0.00 0.00 61.98 62.67 1fxt s VAL 70 Cb -0.09 -3.64 0.05 0.00 0.00 0.00 0.00 36.38 32.70 1fxt s VAL 70 CO 0.27 0.28 1.26 -0.76 0.00 0.00 0.00 175.10 176.14 1fxt s LEU 71 N 1.28 3.64 -0.31 3.92 1.02 -1.26 -1.64 118.68 125.33 1fxt s LEU 71 Ca 0.15 -0.96 -0.10 0.00 0.02 0.00 0.00 54.13 53.23 1fxt s LEU 71 Cb -0.14 -2.52 -0.01 0.00 0.02 0.00 0.00 46.19 43.53 1fxt s LEU 71 CO 0.07 -1.61 0.17 -0.60 0.02 0.00 0.00 176.35 174.40 1fxt s ARG 72 N 4.96 3.44 0.00 1.70 3.52 -0.43 -5.02 118.95 127.12 1fxt s ARG 72 Ca 0.35 -0.66 0.00 0.00 -0.13 0.00 0.00 55.73 55.30 1fxt s ARG 72 Cb -0.07 -3.61 0.00 0.00 -1.56 0.00 0.00 34.95 29.71 1fxt s ARG 72 CO 0.05 -0.39 0.00 1.28 -0.81 0.00 0.00 175.30 175.43 1fxt n LEU 73 N 5.01 0.00 -2.90 -0.88 4.32 -1.26 -3.97 117.00 117.32 1fxt n LEU 73 Ca -0.14 0.00 -0.12 0.00 -0.02 0.00 0.00 56.01 55.73 1fxt n LEU 73 Cb 0.50 0.00 0.05 0.00 -1.62 0.00 0.00 43.42 42.34 1fxt n LEU 73 CO 0.34 0.00 0.13 -1.14 -1.22 0.00 0.00 177.39 175.50 1fxt n ARG 74 N 0.00 1.00 0.02 3.23 3.00 -1.26 -4.97 116.66 117.69 1fxt n ARG 74 Ca 0.00 -2.46 0.00 0.00 -0.00 0.00 0.00 57.85 55.39 1fxt n ARG 74 Cb 0.00 -1.28 0.00 0.00 0.00 0.00 0.00 32.46 31.18 1fxt n ARG 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1fxt n GLY 75 N 0.33 -1.79 0.02 5.14 0.00 -1.26 -5.31 105.19 102.31 1fxt n GLY 75 Ca 0.13 0.63 0.16 0.00 0.00 0.00 0.00 46.02 46.93 1fxt n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93