#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m90 n THR 11 N 0.00 1.11 0.27 8.89 -1.04 -1.26 -3.63 114.28 118.62 1m90 n THR 11 Ca 0.00 0.31 0.17 0.00 -2.04 0.00 0.00 64.05 62.49 1m90 n THR 11 Cb 0.00 -1.16 0.89 0.00 -1.82 0.00 0.00 70.33 68.24 1m90 n THR 11 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1m90 h GLY 12 N 1.90 0.00 2.00 3.41 0.00 -1.95 -0.74 103.07 107.70 1m90 h GLY 12 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1m90 h GLY 12 CO 0.00 0.00 -0.06 0.07 0.00 0.00 0.00 176.54 176.55 1m90 h ARG 13 N 0.00 0.00 0.00 4.80 0.11 -2.04 -2.96 114.38 114.29 1m90 h ARG 13 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1m90 h ARG 13 Cb 0.17 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.25 1m90 h ARG 13 CO 0.00 0.06 0.00 1.19 0.10 0.00 0.00 179.97 181.32 1m90 n PHE 14 N -3.19 0.00 -4.70 4.08 0.99 -0.28 -5.01 117.46 109.35 1m90 n PHE 14 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1m90 n PHE 14 Cb 0.34 -0.36 0.00 0.00 -1.00 0.00 0.00 39.48 38.46 1m90 n PHE 14 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1m90 n GLY 15 N 0.85 2.11 1.04 1.37 0.00 -1.12 -2.20 105.19 107.23 1m90 n GLY 15 Ca 0.10 -0.46 0.05 0.00 0.00 0.00 0.00 46.02 45.71 1m90 n GLY 15 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1m90 n PRO 16 N 8.08 2.61 -2.80 1.61 -0.04 -1.26 -4.95 135.00 138.25 1m90 n PRO 16 Ca 0.00 -1.60 -0.26 0.00 -0.04 0.00 0.00 63.50 61.60 1m90 n PRO 16 Cb 0.00 -1.66 -0.00 0.00 -0.04 0.00 0.00 33.50 31.80 1m90 n PRO 16 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1m90 s ARG 17 N -1.74 3.48 0.00 0.54 0.52 -0.94 -4.57 118.95 116.24 1m90 s ARG 17 Ca 0.28 0.05 0.00 0.00 -0.52 0.00 0.00 55.73 55.54 1m90 s ARG 17 Cb 0.19 -2.44 0.00 0.00 0.52 0.00 0.00 34.95 33.22 1m90 s ARG 17 CO 0.13 -0.15 0.00 0.66 0.02 0.00 0.00 175.30 175.95 1m90 n TYR 18 N -2.17 0.00 0.00 -0.53 0.53 -1.26 -4.91 117.16 108.82 1m90 n TYR 18 Ca -0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.88 1m90 n TYR 18 Cb 0.56 -0.11 0.00 0.00 -1.03 0.00 0.00 39.34 38.76 1m90 n TYR 18 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1m90 n GLY 19 N -1.82 -0.35 0.00 2.72 0.00 -1.26 -4.53 105.19 99.96 1m90 n GLY 19 Ca 0.00 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.26 1m90 n GLY 19 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1m90 n LEU 20 N -1.15 0.00 -0.09 0.99 4.77 -1.26 -2.99 117.00 117.27 1m90 n LEU 20 Ca 0.00 0.98 -0.08 0.00 -0.03 0.00 0.00 56.01 56.88 1m90 n LEU 20 Cb 0.00 -0.48 -0.02 0.00 -2.33 0.00 0.00 43.42 40.58 1m90 n LEU 20 CO 0.00 -0.48 0.64 0.11 -1.33 0.00 0.00 177.39 176.33 1m90 h LYS 21 N 0.00 -0.28 -0.25 3.23 1.57 -1.98 0.12 116.57 118.98 1m90 h LYS 21 Ca 0.00 0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.86 1m90 h LYS 21 Cb 0.00 0.06 -0.08 0.00 0.08 0.00 0.00 32.23 32.30 1m90 h LYS 21 CO 0.00 -0.18 -0.38 0.82 -0.57 0.00 0.00 179.45 179.14 1m90 h ILE 22 N -0.29 0.19 0.00 1.86 2.04 -1.80 -0.93 117.51 118.59 1m90 h ILE 22 Ca 0.15 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.92 1m90 h ILE 22 Cb 0.54 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.79 1m90 h ILE 22 CO -0.49 0.00 -0.45 0.08 0.00 0.00 0.00 178.15 177.29 1m90 h ARG 23 N -0.38 0.00 -0.55 2.37 0.11 -1.40 -2.41 114.38 112.12 1m90 h ARG 23 Ca 0.12 0.00 -0.08 0.00 0.10 0.00 0.00 59.98 60.11 1m90 h ARG 23 Cb 0.58 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.64 1m90 h ARG 23 CO -0.46 0.45 0.02 0.28 0.10 0.00 0.00 179.97 180.36 1m90 h VAL 24 N 0.00 1.26 0.00 0.08 2.07 -0.37 -1.03 116.25 118.25 1m90 h VAL 24 Ca -0.00 -1.07 -0.12 0.00 0.82 0.00 0.00 66.70 66.33 1m90 h VAL 24 Cb 1.24 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 1m90 h VAL 24 CO 0.06 0.38 -0.58 0.03 0.02 0.00 0.00 177.57 177.48 1m90 h ARG 25 N 0.87 0.00 -0.28 1.57 3.08 -1.10 -0.73 114.38 117.79 1m90 h ARG 25 Ca 0.16 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 60.04 1m90 h ARG 25 Cb 0.49 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.54 1m90 h ARG 25 CO 0.02 0.58 -0.53 0.28 -1.07 0.00 0.00 179.97 179.25 1m90 h VAL 26 N 0.00 1.28 0.29 2.04 2.07 -1.00 -0.26 116.25 120.67 1m90 h VAL 26 Ca -0.01 -1.72 -0.01 0.00 0.82 0.00 0.00 66.70 65.78 1m90 h VAL 26 Cb 1.15 1.62 0.00 0.00 -1.52 0.00 0.00 31.29 32.54 1m90 h VAL 26 CO 0.08 0.56 -0.14 0.00 0.02 0.00 0.00 177.57 178.09 1m90 h ALA 27 N 0.75 -0.39 -0.33 1.67 0.00 -1.08 -1.21 119.26 118.67 1m90 h ALA 27 Ca 0.02 -0.19 0.07 0.00 0.00 0.00 0.00 54.91 54.81 1m90 h ALA 27 Cb 1.13 0.15 -0.08 0.00 0.00 0.00 0.00 17.79 18.98 1m90 h ALA 27 CO 0.12 -0.53 -0.33 -0.44 0.00 0.00 0.00 179.25 178.06 1m90 h ASP 28 N -0.76 -1.08 0.22 0.00 5.19 -1.13 0.66 116.42 119.53 1m90 h ASP 28 Ca -0.04 0.18 -0.01 0.00 -0.62 0.00 0.00 57.03 56.54 1m90 h ASP 28 Cb 0.50 0.49 -0.00 0.00 0.18 0.00 0.00 39.33 40.50 1m90 h ASP 28 CO 0.07 -0.33 -0.14 0.58 -3.12 0.00 0.00 179.24 176.29 1m90 h VAL 29 N -0.30 0.70 0.00 -1.35 2.07 -1.07 -2.69 116.25 113.61 1m90 h VAL 29 Ca 0.15 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.62 1m90 h VAL 29 Cb 0.54 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 1m90 h VAL 29 CO -0.49 0.00 -0.22 -0.33 0.02 0.00 0.00 177.57 176.55 1m90 h GLU 30 N -0.35 0.00 -0.04 1.57 5.08 -0.71 0.19 114.58 120.31 1m90 h GLU 30 Ca -0.02 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 1m90 h GLU 30 Cb 0.30 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 1m90 h GLU 30 CO 0.02 0.22 -0.04 0.97 -1.00 0.00 0.00 179.01 179.18 1m90 h ILE 31 N 0.00 1.37 -0.56 3.13 2.10 0.53 0.83 117.51 124.91 1m90 h ILE 31 Ca -0.00 -1.16 0.02 0.00 1.08 0.00 0.00 64.86 64.80 1m90 h ILE 31 Cb 0.49 2.05 -0.04 0.00 -1.09 0.00 0.00 36.82 38.23 1m90 h ILE 31 CO 0.03 0.31 0.34 0.11 -1.08 0.00 0.00 178.15 177.86 1m90 h LYS 32 N -0.34 0.65 -0.59 2.19 1.57 -1.26 -1.58 116.57 117.21 1m90 h LYS 32 Ca 0.01 -0.04 0.12 0.00 -1.87 0.00 0.00 60.65 58.87 1m90 h LYS 32 Cb 0.53 -0.15 -0.11 0.00 0.08 0.00 0.00 32.23 32.58 1m90 h LYS 32 CO 0.01 0.43 -0.17 1.25 -0.57 0.00 0.00 179.45 180.39 1m90 h HIS 33 N 0.67 -0.40 -0.01 -1.35 2.76 -0.45 -2.01 115.15 114.36 1m90 h HIS 33 Ca 0.22 0.06 0.00 0.00 -2.20 0.00 0.00 60.37 58.45 1m90 h HIS 33 Cb 0.02 0.27 0.00 0.00 1.55 0.00 0.00 27.41 29.24 1m90 h HIS 33 CO -0.06 -0.28 -0.01 1.63 -1.30 0.00 0.00 177.93 177.91 1m90 n LYS 34 N -5.42 1.47 -0.65 5.26 5.02 0.27 -4.77 118.16 119.33 1m90 n LYS 34 Ca 0.06 -0.72 -0.30 0.00 -2.02 0.00 0.00 58.31 55.33 1m90 n LYS 34 Cb 0.32 -1.49 0.18 0.00 -0.02 0.00 0.00 35.03 34.03 1m90 n LYS 34 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1m90 s LYS 35 N -2.03 0.62 0.11 1.97 1.02 -0.65 -4.93 119.74 115.84 1m90 s LYS 35 Ca 0.39 1.43 -0.30 0.00 0.02 0.00 0.00 55.97 57.51 1m90 s LYS 35 Cb 0.21 -1.69 -0.06 0.00 -0.52 0.00 0.00 37.83 35.77 1m90 s LYS 35 CO 0.35 -2.87 1.12 0.15 -0.92 0.00 0.00 175.35 173.19 1m90 s LYS 36 N -4.61 4.52 -0.02 1.68 1.02 -1.26 -4.95 119.74 116.13 1m90 s LYS 36 Ca 0.67 1.70 0.07 0.00 0.02 0.00 0.00 55.97 58.43 1m90 s LYS 36 Cb -0.23 -3.33 -0.02 0.00 -0.52 0.00 0.00 37.83 33.72 1m90 s LYS 36 CO 0.59 -0.08 -0.24 -1.01 -0.92 0.00 0.00 175.35 173.70 1m90 s HIS 37 N 0.46 2.41 -0.42 3.18 3.76 -1.25 -4.99 115.29 118.43 1m90 s HIS 37 Ca 0.54 -0.38 -0.27 0.00 -0.15 0.00 0.00 55.06 54.80 1m90 s HIS 37 Cb -0.28 -1.51 0.02 0.00 1.11 0.00 0.00 32.58 31.92 1m90 s HIS 37 CO 0.32 0.03 0.99 0.15 -0.85 0.00 0.00 174.74 175.38 1m90 s LYS 38 N -0.73 3.72 0.21 1.40 1.02 -1.26 -2.06 119.74 122.03 1m90 s LYS 38 Ca 0.11 0.47 -0.32 0.00 0.02 0.00 0.00 55.97 56.25 1m90 s LYS 38 Cb -0.10 -3.87 -0.15 0.00 -0.52 0.00 0.00 37.83 33.19 1m90 s LYS 38 CO -0.00 -1.15 1.20 0.00 -0.92 0.00 0.00 175.35 174.48 1m90 h PRO 40 N 3.38 0.86 0.02 0.00 0.11 -1.95 -3.35 132.00 131.07 1m90 h PRO 40 Ca -0.43 -0.52 -0.00 0.00 0.11 0.00 0.00 66.00 65.16 1m90 h PRO 40 Cb 1.33 0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.49 1m90 h PRO 40 CO 0.70 1.15 -0.01 0.28 -0.21 0.00 0.00 178.00 179.91 1m90 h VAL 41 N 0.67 0.00 -1.79 3.15 2.07 -1.98 -3.45 116.25 114.91 1m90 h VAL 41 Ca 0.03 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1m90 h VAL 41 Cb 1.10 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.87 1m90 h VAL 41 CO 0.11 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.70 1m90 n GLY 43 N 5.00 1.40 3.78 0.00 0.00 -1.26 -4.52 105.19 109.60 1m90 n GLY 43 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1m90 n GLY 43 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1m90 s PHE 44 N -0.70 3.11 -1.40 1.61 0.40 -1.26 -4.48 117.98 115.25 1m90 s PHE 44 Ca 0.00 1.60 -0.09 0.00 -0.60 0.00 0.00 56.93 57.84 1m90 s PHE 44 Cb 0.00 -3.20 0.07 0.00 0.51 0.00 0.00 43.02 40.40 1m90 s PHE 44 CO 0.00 -0.94 2.36 1.63 0.70 0.00 0.00 175.22 178.97 1m90 n LYS 45 N -0.31 3.89 -2.30 0.44 5.02 -1.26 -0.00 118.16 123.64 1m90 n LYS 45 Ca 0.06 -3.08 -0.11 0.00 -2.02 0.00 0.00 58.31 53.16 1m90 n LYS 45 Cb 0.49 -2.84 0.04 0.00 -0.02 0.00 0.00 35.03 32.70 1m90 n LYS 45 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1m90 n LYS 46 N 3.33 2.60 -3.58 1.97 5.02 -0.98 -4.39 118.16 122.12 1m90 n LYS 46 Ca 0.59 -3.78 -0.37 0.00 -2.02 0.00 0.00 58.31 52.73 1m90 n LYS 46 Cb 0.29 -1.89 -0.09 0.00 -0.02 0.00 0.00 35.03 33.33 1m90 n LYS 46 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1m90 s LEU 47 N -3.55 4.11 0.09 -0.35 1.43 -0.88 -0.77 118.68 118.77 1m90 s LEU 47 Ca 0.40 0.20 0.07 0.00 -1.03 0.00 0.00 54.13 53.77 1m90 s LEU 47 Cb 0.37 -2.22 -0.03 0.00 0.03 0.00 0.00 46.19 44.34 1m90 s LEU 47 CO -0.01 0.01 -0.18 -0.54 0.23 0.00 0.00 176.35 175.86 1m90 s LYS 48 N 1.21 1.01 0.01 1.70 1.02 0.06 -3.80 119.74 120.96 1m90 s LYS 48 Ca 0.10 -1.08 -0.30 0.00 0.02 0.00 0.00 55.97 54.71 1m90 s LYS 48 Cb -0.14 -1.18 -0.05 0.00 -0.52 0.00 0.00 37.83 35.93 1m90 s LYS 48 CO 0.06 0.27 1.32 0.50 -0.92 0.00 0.00 175.35 176.58 1m90 s ARG 49 N -1.84 4.33 0.06 1.68 3.52 -1.26 -1.48 118.95 123.95 1m90 s ARG 49 Ca 0.03 1.88 0.22 0.00 -0.13 0.00 0.00 55.73 57.74 1m90 s ARG 49 Cb -0.10 -3.49 -0.09 0.00 -1.56 0.00 0.00 34.95 29.70 1m90 s ARG 49 CO 0.03 -0.48 0.86 0.00 -0.81 0.00 0.00 175.30 174.91 1m90 n ALA 50 N 4.93 3.10 0.00 6.12 0.00 0.16 -4.94 120.51 129.87 1m90 n ALA 50 Ca 0.12 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.15 1m90 n ALA 50 Cb 0.44 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 18.97 1m90 n ALA 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1m90 n GLY 51 N 1.30 -1.34 3.56 0.00 0.00 -1.14 -4.98 105.19 102.59 1m90 n GLY 51 Ca -0.00 -1.07 -0.46 0.00 0.00 0.00 0.00 46.02 44.49 1m90 n GLY 51 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1m90 n THR 52 N 5.58 0.33 -0.77 2.61 -1.04 -1.26 -1.76 114.28 117.97 1m90 n THR 52 Ca 0.00 -0.36 0.00 0.00 -2.04 0.00 0.00 64.05 61.65 1m90 n THR 52 Cb 0.00 -2.23 0.00 0.00 -1.82 0.00 0.00 70.33 66.28 1m90 n THR 52 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1m90 n GLY 53 N 5.85 0.86 3.46 3.41 0.00 -1.23 -4.98 105.19 112.55 1m90 n GLY 53 Ca 0.32 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.00 1m90 n GLY 53 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1m90 s ILE 54 N -3.08 3.81 0.13 -0.61 1.01 -0.72 -1.56 121.20 120.18 1m90 s ILE 54 Ca 0.00 -0.38 0.09 0.00 0.00 0.00 0.00 60.65 60.36 1m90 s ILE 54 Cb 0.00 -2.68 -0.04 0.00 0.01 0.00 0.00 42.46 39.75 1m90 s ILE 54 CO 0.00 0.47 -0.20 0.26 0.00 0.00 0.00 174.94 175.47 1m90 s TRP 55 N 0.61 1.83 -0.05 3.97 0.52 -0.48 0.38 118.94 125.73 1m90 s TRP 55 Ca -0.02 -0.43 -0.13 0.00 0.02 0.00 0.00 56.10 55.53 1m90 s TRP 55 Cb -0.14 -0.97 0.02 0.00 -1.15 0.00 0.00 33.47 31.23 1m90 s TRP 55 CO 0.02 0.26 0.31 1.41 0.02 0.00 0.00 176.95 178.97 1m90 s MET 56 N -2.26 0.56 -0.28 4.98 1.75 -0.55 0.12 119.30 123.61 1m90 s MET 56 Ca 0.10 0.01 -0.17 0.00 -1.25 0.00 0.00 55.69 54.39 1m90 s MET 56 Cb -0.08 0.25 -0.02 0.00 2.84 0.00 0.00 34.83 37.82 1m90 s MET 56 CO 0.05 -0.13 0.48 0.00 -0.65 0.00 0.00 175.02 174.77 1m90 h GLY 58 N 8.81 0.00 0.10 0.00 0.00 -1.30 0.95 103.07 111.62 1m90 h GLY 58 Ca -0.29 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.03 1m90 h GLY 58 CO 0.71 0.00 -0.05 0.84 0.00 0.00 0.00 176.54 178.04 1m90 h HIS 59 N 0.00 -0.12 -0.00 5.60 6.17 -1.92 -3.40 115.15 121.47 1m90 h HIS 59 Ca 0.00 -0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.08 1m90 h HIS 59 Cb 0.37 0.04 0.00 0.00 2.52 0.00 0.00 27.41 30.34 1m90 h HIS 59 CO 0.00 -0.08 -0.82 0.00 0.71 0.00 0.00 177.93 177.74 1m90 n GLY 61 N 1.46 1.27 3.68 0.00 0.00 0.33 -5.00 105.19 106.93 1m90 n GLY 61 Ca 0.05 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.56 1m90 n GLY 61 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1m90 n TYR 62 N -2.00 2.19 -3.72 1.61 9.36 -1.25 -4.54 117.16 118.81 1m90 n TYR 62 Ca 0.00 0.23 -0.37 0.00 3.32 0.00 0.00 57.90 61.08 1m90 n TYR 62 Cb 0.00 -2.57 -0.12 0.00 -0.63 0.00 0.00 39.34 36.02 1m90 n TYR 62 CO 0.00 0.00 0.00 0.21 0.22 0.00 0.00 176.86 177.29 1m90 s LYS 63 N 3.33 3.42 0.33 2.98 2.20 -1.26 -1.08 119.74 129.67 1m90 s LYS 63 Ca 0.92 -0.64 0.09 0.00 -0.36 0.00 0.00 55.97 55.98 1m90 s LYS 63 Cb -0.82 -3.42 -0.05 0.00 -1.51 0.00 0.00 37.83 32.03 1m90 s LYS 63 CO 0.54 -0.32 0.04 0.96 -0.36 0.00 0.00 175.35 176.21 1m90 s ILE 64 N 1.59 2.78 -0.22 5.43 -4.36 0.31 -4.96 121.20 121.77 1m90 s ILE 64 Ca 0.05 -1.90 -0.09 0.00 -0.26 0.00 0.00 60.65 58.45 1m90 s ILE 64 Cb -0.16 -2.84 -0.04 0.00 1.25 0.00 0.00 42.46 40.66 1m90 s ILE 64 CO 0.04 -0.21 0.11 0.00 0.24 0.00 0.00 174.94 175.12 1m90 s ALA 65 N -2.48 3.43 0.00 2.27 0.00 -1.26 -1.38 121.76 122.34 1m90 s ALA 65 Ca 0.35 -0.90 0.00 0.00 0.00 0.00 0.00 51.96 51.41 1m90 s ALA 65 Cb -0.01 -2.13 0.00 0.00 0.00 0.00 0.00 23.12 20.98 1m90 s ALA 65 CO 0.20 -0.14 0.00 0.41 0.00 0.00 0.00 175.76 176.23 1m90 n GLY 66 N 4.20 5.00 2.94 0.00 0.00 -0.60 -4.97 105.19 111.75 1m90 n GLY 66 Ca -0.16 -1.15 -0.24 0.00 0.00 0.00 0.00 46.02 44.48 1m90 n GLY 66 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1m90 n GLY 67 N 0.00 -1.99 0.13 -0.02 0.00 0.19 -4.74 105.19 98.76 1m90 n GLY 67 Ca 0.00 -1.61 -0.20 0.00 0.00 0.00 0.00 46.02 44.22 1m90 n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m90 n TYR 69 N -3.64 0.00 -3.82 0.00 4.02 -1.26 -3.68 117.16 108.79 1m90 n TYR 69 Ca -0.12 -0.23 -0.12 0.00 -0.01 0.00 0.00 57.90 57.42 1m90 n TYR 69 Cb 1.04 -0.02 -0.12 0.00 -0.02 0.00 0.00 39.34 40.22 1m90 n TYR 69 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 176.86 175.20 1m90 s GLN 70 N -0.46 0.25 0.34 -0.72 -0.21 -1.26 -3.67 119.66 113.92 1m90 s GLN 70 Ca 0.00 0.17 0.07 0.00 0.02 0.00 0.00 55.36 55.61 1m90 s GLN 70 Cb 0.00 0.12 0.62 0.00 1.00 0.00 0.00 33.01 34.75 1m90 s GLN 70 CO 0.00 -0.04 1.83 -1.00 -2.12 0.00 0.00 175.29 173.97 1m90 h PRO 71 N 5.65 0.34 -6.29 2.91 0.13 -1.93 0.53 132.00 133.34 1m90 h PRO 71 Ca -0.26 -0.10 -0.69 0.00 -0.87 0.00 0.00 66.00 64.08 1m90 h PRO 71 Cb 1.20 -0.04 -0.31 0.00 0.13 0.00 0.00 31.00 31.98 1m90 h PRO 71 CO 0.40 0.51 -0.89 -1.21 -0.23 0.00 0.00 178.00 176.58 1m90 s GLU 72 N -4.64 2.30 0.20 0.86 2.02 -1.26 -2.65 118.70 115.53 1m90 s GLU 72 Ca -0.06 -0.91 0.08 0.00 0.02 0.00 0.00 54.97 54.10 1m90 s GLU 72 Cb 0.15 -2.08 -0.04 0.00 0.10 0.00 0.00 34.13 32.26 1m90 s GLU 72 CO 0.76 0.47 -0.00 0.95 0.02 0.00 0.00 175.26 177.45 1m90 s THR 73 N -0.38 3.62 0.48 3.63 -4.23 -1.26 -4.78 115.64 112.72 1m90 s THR 73 Ca 0.03 -1.57 0.25 0.00 -1.18 0.00 0.00 61.69 59.22 1m90 s THR 73 Cb -0.12 -2.85 0.43 0.00 1.34 0.00 0.00 72.50 71.30 1m90 s THR 73 CO 0.01 -0.18 1.88 0.58 -0.54 0.00 0.00 174.62 176.37 1m90 h VAL 74 N 2.32 0.63 0.16 2.29 2.07 -2.00 -0.44 116.25 121.28 1m90 h VAL 74 Ca -0.46 -0.06 -0.30 0.00 0.82 0.00 0.00 66.70 66.70 1m90 h VAL 74 Cb 1.22 0.43 0.01 0.00 -1.52 0.00 0.00 31.29 31.42 1m90 h VAL 74 CO 0.58 0.03 -1.35 0.00 0.02 0.00 0.00 177.57 176.86 1m90 h ALA 75 N 1.60 0.04 0.00 1.67 0.00 -2.00 -3.17 119.26 117.40 1m90 h ALA 75 Ca 0.43 -0.91 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 1m90 h ALA 75 Cb 1.39 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.27 1m90 h ALA 75 CO -0.09 0.92 -0.08 0.78 0.00 0.00 0.00 179.25 180.78 1m90 h GLY 76 N 1.20 0.00 1.39 0.00 0.00 -1.48 -2.09 103.07 102.09 1m90 h GLY 76 Ca -0.18 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 46.93 1m90 h GLY 76 CO 0.22 0.00 -0.81 0.50 0.00 0.00 0.00 176.54 176.44 1m90 h LYS 77 N 0.00 0.59 0.00 4.80 1.57 -1.47 -3.06 116.57 118.99 1m90 h LYS 77 Ca -0.00 -0.52 -0.02 0.00 -1.87 0.00 0.00 60.65 58.24 1m90 h LYS 77 Cb 0.14 0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.57 1m90 h LYS 77 CO 0.01 1.14 -0.09 0.00 -0.57 0.00 0.00 179.45 179.94 1m90 h ALA 78 N 0.70 1.74 0.63 3.86 0.00 -1.35 -2.89 119.26 121.96 1m90 h ALA 78 Ca -0.06 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 1m90 h ALA 78 Cb 1.43 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.21 1m90 h ALA 78 CO 0.15 0.11 -0.30 0.28 0.00 0.00 0.00 179.25 179.49 1m90 h VAL 79 N 0.00 0.35 -0.99 0.00 2.07 -1.40 -2.77 116.25 113.51 1m90 h VAL 79 Ca -0.00 -0.12 0.22 0.00 0.82 0.00 0.00 66.70 67.62 1m90 h VAL 79 Cb 0.17 0.39 -0.19 0.00 -1.52 0.00 0.00 31.29 30.14 1m90 h VAL 79 CO 0.01 0.02 -0.17 0.24 0.02 0.00 0.00 177.57 177.69 1m90 h MET 80 N -0.93 0.00 0.00 1.57 2.07 -1.55 -2.97 114.93 113.12 1m90 h MET 80 Ca -0.09 -0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.54 1m90 h MET 80 Cb 0.68 -0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.41 1m90 h MET 80 CO 0.14 0.00 0.00 1.63 1.07 0.00 0.00 176.91 179.75 1m90 n LYS 81 N -5.59 0.00 0.00 1.72 5.02 -1.15 -5.17 118.16 112.99 1m90 n LYS 81 Ca 0.18 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.47 1m90 n LYS 81 Cb 0.57 -0.65 0.00 0.00 -0.02 0.00 0.00 35.03 34.94 1m90 n LYS 81 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88