#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r8b n LYS 2 N 0.00 -0.09 0.15 0.03 3.00 -1.26 -4.54 118.16 115.46 1r8b n LYS 2 Ca 0.00 0.06 -0.13 0.00 -0.00 0.00 0.00 58.31 58.24 1r8b n LYS 2 Cb 0.00 -0.07 -0.06 0.00 0.00 0.00 0.00 35.03 34.90 1r8b n LYS 2 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1r8b h VAL 3 N 0.05 0.48 -0.77 3.15 2.07 -1.99 -1.49 116.25 117.74 1r8b h VAL 3 Ca 0.00 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.66 1r8b h VAL 3 Cb 0.00 0.48 -0.05 0.00 -1.52 0.00 0.00 31.29 30.19 1r8b h VAL 3 CO 0.00 0.00 0.51 -0.33 0.02 0.00 0.00 177.57 177.77 1r8b h GLU 4 N -0.49 0.46 -0.02 1.57 3.07 -1.99 -0.11 114.58 117.06 1r8b h GLU 4 Ca 0.01 -0.03 -0.24 0.00 -0.50 0.00 0.00 59.36 58.59 1r8b h GLU 4 Cb 0.47 -0.10 0.01 0.00 -0.84 0.00 0.00 28.75 28.29 1r8b h GLU 4 CO -0.08 0.30 -0.96 1.49 -1.40 0.00 0.00 179.01 178.36 1r8b h GLU 5 N 0.47 0.61 -0.47 2.33 4.81 -1.71 -2.80 114.58 117.82 1r8b h GLU 5 Ca 0.38 -0.62 -0.02 0.00 -0.13 0.00 0.00 59.36 58.96 1r8b h GLU 5 Cb 0.80 0.17 -0.02 0.00 0.63 0.00 0.00 28.75 30.32 1r8b h GLU 5 CO -0.13 1.23 0.20 0.82 -0.73 0.00 0.00 179.01 180.40 1r8b h ILE 6 N 0.36 1.20 -0.67 2.32 2.04 -0.14 -0.91 117.51 121.71 1r8b h ILE 6 Ca -0.10 -0.59 -0.01 0.00 1.00 0.00 0.00 64.86 65.16 1r8b h ILE 6 Cb 1.60 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 38.37 1r8b h ILE 6 CO 0.18 0.22 0.36 -0.07 0.00 0.00 0.00 178.15 178.84 1r8b h LEU 7 N 0.61 0.82 -0.51 1.44 3.38 -1.13 0.23 115.31 120.16 1r8b h LEU 7 Ca 0.16 -0.07 -0.10 0.00 0.09 0.00 0.00 57.88 57.97 1r8b h LEU 7 Cb 0.16 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 1r8b h LEU 7 CO -0.02 0.67 -0.06 -0.33 0.09 0.00 0.00 178.44 178.80 1r8b h GLU 8 N 0.93 0.93 0.00 1.13 5.08 -1.22 -2.57 114.58 118.86 1r8b h GLU 8 Ca 0.24 -0.33 -0.06 0.00 -1.00 0.00 0.00 59.36 58.20 1r8b h GLU 8 Cb 0.03 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1r8b h GLU 8 CO -0.04 0.98 -0.31 0.87 -1.00 0.00 0.00 179.01 179.52 1r8b h LYS 9 N 0.79 0.00 0.00 2.33 1.57 -0.13 -2.86 116.57 118.27 1r8b h LYS 9 Ca 0.14 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.80 1r8b h LYS 9 Cb 0.60 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.89 1r8b h LYS 9 CO 0.04 0.31 -0.56 0.00 -0.57 0.00 0.00 179.45 178.66 1r8b h ALA 10 N 1.69 0.76 -0.58 3.86 0.00 -0.38 -3.25 119.26 121.37 1r8b h ALA 10 Ca -0.00 -0.51 0.16 0.00 0.00 0.00 0.00 54.91 54.55 1r8b h ALA 10 Cb 0.59 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 1r8b h ALA 10 CO 0.04 0.70 0.41 -0.07 0.00 0.00 0.00 179.25 180.33 1r8b h LEU 11 N 0.00 0.06 -0.09 0.00 3.38 -1.22 -1.21 115.31 116.24 1r8b h LEU 11 Ca -0.01 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 1r8b h LEU 11 Cb 1.25 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.97 1r8b h LEU 11 CO 0.07 0.03 -0.65 1.05 0.09 0.00 0.00 178.44 179.04 1r8b h GLU 12 N 0.07 0.00 0.00 1.13 4.11 -1.72 0.26 114.58 118.42 1r8b h GLU 12 Ca 0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.70 1r8b h GLU 12 Cb 1.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.25 1r8b h GLU 12 CO -0.02 0.65 0.00 -0.07 0.07 0.00 0.00 179.01 179.63 1r8b h LEU 13 N 0.00 0.00 0.00 3.06 3.38 -1.40 -3.37 115.31 116.98 1r8b h LEU 13 Ca -0.01 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.81 1r8b h LEU 13 Cb 1.46 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.18 1r8b h LEU 13 CO 0.08 0.00 -1.59 0.52 0.09 0.00 0.00 178.44 177.54 1r8b n VAL 14 N -2.95 0.59 -2.94 1.22 0.31 -1.03 -4.76 118.33 108.77 1r8b n VAL 14 Ca 0.01 -0.32 -0.40 0.00 -0.01 0.00 0.00 64.34 63.62 1r8b n VAL 14 Cb 0.31 -0.81 -0.04 0.00 -0.91 0.00 0.00 33.84 32.39 1r8b n VAL 14 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1r8b s ILE 15 N -2.21 4.99 0.51 2.52 1.01 0.06 -1.48 121.20 126.60 1r8b s ILE 15 Ca -0.07 1.63 -0.23 0.00 0.00 0.00 0.00 60.65 61.98 1r8b s ILE 15 Cb 0.03 -4.13 -0.06 0.00 0.01 0.00 0.00 42.46 38.31 1r8b s ILE 15 CO 0.32 0.21 1.35 -2.16 0.00 0.00 0.00 174.94 174.66 1r8b s PRO 16 N 0.93 3.37 0.21 2.79 0.04 -1.26 -4.69 135.00 136.39 1r8b s PRO 16 Ca 0.42 2.22 -0.04 0.00 0.04 0.00 0.00 61.00 63.64 1r8b s PRO 16 Cb -0.19 -2.39 0.05 0.00 0.04 0.00 0.00 34.50 32.02 1r8b s PRO 16 CO 0.21 -1.00 0.26 -0.40 0.04 0.00 0.00 177.00 176.10 1r8b n ASP 17 N -0.73 -0.31 0.15 6.66 5.68 -1.26 -4.79 116.55 121.95 1r8b n ASP 17 Ca 0.09 -0.97 -0.13 0.00 -0.50 0.00 0.00 54.79 53.28 1r8b n ASP 17 Cb 0.44 -0.20 -0.08 0.00 -1.14 0.00 0.00 41.12 40.14 1r8b n ASP 17 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1r8b h GLU 18 N 0.00 -0.40 0.00 0.11 5.08 -2.01 -2.82 114.58 114.54 1r8b h GLU 18 Ca -0.09 0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1r8b h GLU 18 Cb 0.24 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 1r8b h GLU 18 CO 0.06 -0.06 -0.06 1.49 -1.00 0.00 0.00 179.01 179.44 1r8b h GLU 19 N -0.83 0.00 -0.06 2.33 4.57 -1.99 -2.97 114.58 115.63 1r8b h GLU 19 Ca -0.04 0.00 -0.13 0.00 -1.18 0.00 0.00 59.36 58.00 1r8b h GLU 19 Cb 0.52 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.12 1r8b h GLU 19 CO 0.07 0.06 -0.48 1.49 -1.18 0.00 0.00 179.01 178.96 1r8b h GLU 20 N 0.00 0.43 -0.45 1.92 4.81 -1.88 -1.33 114.58 118.08 1r8b h GLU 20 Ca -0.00 -0.39 -0.04 0.00 -0.13 0.00 0.00 59.36 58.81 1r8b h GLU 20 Cb 0.33 0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 1r8b h GLU 20 CO 0.01 1.03 0.13 0.28 -0.73 0.00 0.00 179.01 179.73 1r8b h VAL 21 N -0.04 1.23 0.00 0.32 2.07 -1.34 -1.75 116.25 116.73 1r8b h VAL 21 Ca -0.04 -0.76 -0.11 0.00 0.82 0.00 0.00 66.70 66.60 1r8b h VAL 21 Cb 1.16 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.78 1r8b h VAL 21 CO 0.10 0.27 -0.53 0.03 0.02 0.00 0.00 177.57 177.46 1r8b h ARG 22 N 0.59 0.00 -0.79 1.57 3.08 -1.64 -1.61 114.38 115.59 1r8b h ARG 22 Ca 0.14 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.18 1r8b h ARG 22 Cb 0.28 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.29 1r8b h ARG 22 CO -0.00 0.53 0.44 -0.22 -1.07 0.00 0.00 179.97 179.65 1r8b h LYS 23 N 0.00 1.09 -0.17 0.04 3.64 -0.88 -1.20 116.57 119.10 1r8b h LYS 23 Ca -0.01 -0.12 -0.08 0.00 -1.27 0.00 0.00 60.65 59.17 1r8b h LYS 23 Cb 1.17 -0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 32.77 1r8b h LYS 23 CO 0.07 0.80 -0.22 0.78 -2.27 0.00 0.00 179.45 178.61 1r8b h GLY 24 N 1.13 0.50 0.59 5.01 0.00 -1.02 -2.55 103.07 106.73 1r8b h GLY 24 Ca 0.28 -0.53 0.07 0.00 0.00 0.00 0.00 47.33 47.15 1r8b h GLY 24 CO -0.05 0.48 0.36 -0.09 0.00 0.00 0.00 176.54 177.25 1r8b h ARG 25 N 0.10 0.63 -0.38 4.80 2.43 -1.08 0.17 114.38 121.05 1r8b h ARG 25 Ca 0.02 -0.04 -0.16 0.00 -0.81 0.00 0.00 59.98 58.99 1r8b h ARG 25 Cb 0.78 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.18 1r8b h ARG 25 CO 0.05 0.41 -0.40 0.93 -1.51 0.00 0.00 179.97 179.46 1r8b h GLU 26 N 0.65 0.94 -0.45 0.20 5.08 -1.23 -1.48 114.58 118.29 1r8b h GLU 26 Ca 0.32 -0.50 -0.07 0.00 -1.00 0.00 0.00 59.36 58.11 1r8b h GLU 26 Cb 0.26 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 1r8b h GLU 26 CO -0.22 1.16 0.00 0.00 -1.00 0.00 0.00 179.01 178.95 1r8b h ALA 27 N 0.77 0.60 -0.10 3.43 0.00 -1.13 -2.77 119.26 120.07 1r8b h ALA 27 Ca 0.06 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1r8b h ALA 27 Cb 1.00 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 1r8b h ALA 27 CO 0.10 0.39 0.05 1.49 0.00 0.00 0.00 179.25 181.28 1r8b h GLU 28 N 0.63 0.14 -0.59 0.00 4.81 -0.53 -0.95 114.58 118.09 1r8b h GLU 28 Ca 0.13 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.29 1r8b h GLU 28 Cb 0.49 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.82 1r8b h GLU 28 CO 0.02 0.20 0.19 1.49 -0.73 0.00 0.00 179.01 180.18 1r8b h GLU 29 N 0.05 0.91 -0.75 1.92 4.81 -1.33 -0.21 114.58 119.99 1r8b h GLU 29 Ca 0.04 -0.19 -0.04 0.00 -0.13 0.00 0.00 59.36 59.03 1r8b h GLU 29 Cb 0.10 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.31 1r8b h GLU 29 CO -0.01 0.81 0.32 1.49 -0.73 0.00 0.00 179.01 180.90 1r8b h GLU 30 N 0.83 1.11 -0.63 1.92 4.57 -1.39 -1.47 114.58 119.52 1r8b h GLU 30 Ca 0.19 -0.19 -0.03 0.00 -1.18 0.00 0.00 59.36 58.15 1r8b h GLU 30 Cb 0.28 -0.19 -0.03 0.00 -0.16 0.00 0.00 28.75 28.65 1r8b h GLU 30 CO -0.01 0.89 0.27 1.25 -1.18 0.00 0.00 179.01 180.24 1r8b h LEU 31 N 1.07 0.84 -0.70 1.64 5.85 -0.83 -2.07 115.31 121.12 1r8b h LEU 31 Ca 0.25 -0.15 0.03 0.00 0.84 0.00 0.00 57.88 58.85 1r8b h LEU 31 Cb 0.18 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 40.95 1r8b h LEU 31 CO -0.02 0.76 0.44 0.03 -0.34 0.00 0.00 178.44 179.31 1r8b h ARG 32 N 0.87 0.85 -0.24 1.25 3.08 -0.61 -1.11 114.38 118.47 1r8b h ARG 32 Ca 0.21 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.21 1r8b h ARG 32 Cb 0.16 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 1r8b h ARG 32 CO -0.02 0.56 0.14 -0.09 -1.07 0.00 0.00 179.97 179.49 1r8b h ARG 33 N 0.87 0.32 -0.37 0.04 2.43 -1.00 0.38 114.38 117.06 1r8b h ARG 33 Ca 0.28 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 59.34 1r8b h ARG 33 Cb 0.00 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 1r8b h ARG 33 CO -0.10 0.26 -0.08 0.00 -1.51 0.00 0.00 179.97 178.55 1r8b h ARG 34 N 0.29 0.70 -0.24 0.20 3.08 -1.16 -1.12 114.38 116.13 1r8b h ARG 34 Ca 0.09 -0.26 -0.01 0.00 0.07 0.00 0.00 59.98 59.86 1r8b h ARG 34 Cb 0.02 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 1r8b h ARG 34 CO -0.02 0.85 0.10 -0.07 -1.07 0.00 0.00 179.97 179.76 1r8b h LEU 35 N 0.50 0.33 -0.84 3.04 3.38 -1.04 -2.96 115.31 117.71 1r8b h LEU 35 Ca 0.09 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 1r8b h LEU 35 Cb 0.58 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.21 1r8b h LEU 35 CO 0.03 0.39 0.38 0.44 0.09 0.00 0.00 178.44 179.77 1r8b h ASP 36 N 0.25 1.12 0.36 -0.43 5.19 -0.18 -1.71 116.42 121.02 1r8b h ASP 36 Ca 0.08 -0.15 -0.04 0.00 -0.62 0.00 0.00 57.03 56.30 1r8b h ASP 36 Cb 0.16 -0.29 -0.01 0.00 0.18 0.00 0.00 39.33 39.38 1r8b h ASP 36 CO -0.01 0.96 -0.19 -0.08 -3.12 0.00 0.00 179.24 176.80 1r8b h GLU 37 N 1.20 0.00 -0.00 3.56 4.81 -1.19 -1.22 114.58 121.74 1r8b h GLU 37 Ca 0.28 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.51 1r8b h GLU 37 Cb 0.16 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.54 1r8b h GLU 37 CO -0.03 0.19 -0.30 1.28 -0.73 0.00 0.00 179.01 179.42 1r8b n LEU 38 N -3.86 0.62 -0.53 1.64 4.77 -0.69 -4.94 117.00 114.01 1r8b n LEU 38 Ca -0.02 -0.04 -0.06 0.00 -0.03 0.00 0.00 56.01 55.86 1r8b n LEU 38 Cb 0.29 -0.22 -0.02 0.00 -2.33 0.00 0.00 43.42 41.14 1r8b n LEU 38 CO 0.33 0.13 -0.06 0.61 -1.33 0.00 0.00 177.39 177.07 1r8b n GLY 39 N 1.41 0.62 3.78 -0.72 0.00 -0.46 -5.00 105.19 104.81 1r8b n GLY 39 Ca 0.10 -0.74 -0.37 0.00 0.00 0.00 0.00 46.02 45.01 1r8b n GLY 39 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r8b s VAL 40 N -2.25 4.07 -0.25 1.61 1.01 -0.98 -5.04 120.40 118.57 1r8b s VAL 40 Ca 0.00 1.69 -0.11 0.00 0.00 0.00 0.00 61.98 63.55 1r8b s VAL 40 Cb 0.00 -3.92 -0.05 0.00 0.00 0.00 0.00 36.38 32.41 1r8b s VAL 40 CO 0.00 0.11 0.21 -1.61 0.00 0.00 0.00 175.10 173.81 1r8b s GLU 41 N -2.15 4.04 0.22 2.72 8.01 -1.26 -4.73 118.70 125.54 1r8b s GLU 41 Ca 0.52 -0.22 -0.13 0.00 0.01 0.00 0.00 54.97 55.15 1r8b s GLU 41 Cb -0.20 -3.59 0.00 0.00 -4.31 0.00 0.00 34.13 26.03 1r8b s GLU 41 CO 0.25 -0.05 0.45 1.52 0.01 0.00 0.00 175.26 177.44 1r8b s TYR 42 N 1.39 0.28 -0.09 1.61 -0.85 -1.26 -1.16 117.35 117.27 1r8b s TYR 42 Ca 0.09 -0.64 -0.06 0.00 -0.52 0.00 0.00 57.07 55.94 1r8b s TYR 42 Cb -0.15 0.18 0.03 0.00 0.38 0.00 0.00 41.96 42.41 1r8b s TYR 42 CO 0.07 -0.93 0.21 0.54 -1.52 0.00 0.00 175.55 173.92 1r8b s VAL 43 N -3.98 -0.02 -0.13 -3.49 0.11 -0.40 -4.93 120.40 107.56 1r8b s VAL 43 Ca 0.19 0.08 -0.24 0.00 -2.93 0.00 0.00 61.98 59.07 1r8b s VAL 43 Cb -0.00 -0.32 -0.02 0.00 -1.53 0.00 0.00 36.38 34.51 1r8b s VAL 43 CO 0.05 0.03 0.77 -0.36 -3.33 0.00 0.00 175.10 172.27 1r8b s PHE 44 N 0.67 3.48 0.07 1.54 0.40 -1.26 -1.28 117.98 121.60 1r8b s PHE 44 Ca -0.05 1.24 0.00 0.00 -0.60 0.00 0.00 56.93 57.52 1r8b s PHE 44 Cb -0.06 -2.93 -0.00 0.00 0.51 0.00 0.00 43.02 40.54 1r8b s PHE 44 CO -0.04 -0.12 0.01 1.33 0.70 0.00 0.00 175.22 177.10 1r8b n VAL 45 N 4.38 0.00 -4.32 -0.44 0.24 -0.13 -4.81 118.33 113.25 1r8b n VAL 45 Ca 0.02 -0.37 0.00 0.00 -2.04 0.00 0.00 64.34 61.95 1r8b n VAL 45 Cb 0.50 0.09 0.00 0.00 -1.47 0.00 0.00 33.84 32.96 1r8b n VAL 45 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1r8b n GLY 46 N 3.36 -1.25 0.10 7.63 0.00 -1.26 -3.69 105.19 110.09 1r8b n GLY 46 Ca -0.03 -1.23 -0.08 0.00 0.00 0.00 0.00 46.02 44.69 1r8b n GLY 46 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1r8b h SER 47 N 0.00 0.15 0.04 1.61 4.64 -1.95 -2.73 113.55 115.30 1r8b h SER 47 Ca 0.00 -0.13 0.02 0.00 -0.47 0.00 0.00 61.79 61.21 1r8b h SER 47 Cb 0.00 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 62.01 1r8b h SER 47 CO 0.00 0.98 -0.18 0.22 -0.87 0.00 0.00 176.83 176.98 1r8b h TYR 48 N 0.05 -0.47 -0.15 4.77 3.20 -1.77 -0.82 116.97 121.79 1r8b h TYR 48 Ca -0.04 0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.89 1r8b h TYR 48 Cb 1.57 0.20 -0.01 0.00 1.54 0.00 0.00 36.73 40.04 1r8b h TYR 48 CO 0.02 -0.26 0.12 0.00 -1.64 0.00 0.00 178.16 176.39 1r8b h ALA 49 N 0.57 2.06 -0.34 1.82 0.00 -1.57 -1.87 119.26 119.94 1r8b h ALA 49 Ca 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1r8b h ALA 49 Cb 0.37 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1r8b h ALA 49 CO -0.14 -0.19 0.00 0.54 0.00 0.00 0.00 179.25 179.45 1r8b n ARG 50 N -4.36 2.30 -3.78 0.00 1.74 -1.09 -4.98 116.66 106.49 1r8b n ARG 50 Ca 0.01 -2.00 -0.27 0.00 -0.77 0.00 0.00 57.85 54.82 1r8b n ARG 50 Cb 0.24 -1.35 0.04 0.00 -1.02 0.00 0.00 32.46 30.37 1r8b n ARG 50 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1r8b n ASN 51 N 0.90 -4.29 -0.28 0.55 2.85 -0.42 -4.88 115.26 109.69 1r8b n ASN 51 Ca 0.14 -0.73 0.03 0.00 -0.11 0.00 0.00 54.58 53.91 1r8b n ASN 51 Cb 0.46 -4.23 0.05 0.00 1.24 0.00 0.00 39.78 37.31 1r8b n ASN 51 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1r8b n THR 52 N -4.65 0.54 -2.78 -0.44 -2.24 -0.57 -4.80 114.28 99.34 1r8b n THR 52 Ca -0.05 -0.77 -0.39 0.00 -2.27 0.00 0.00 64.05 60.57 1r8b n THR 52 Cb 0.57 0.78 -0.06 0.00 -2.10 0.00 0.00 70.33 69.52 1r8b n THR 52 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 1r8b s TRP 53 N -0.76 3.93 0.48 4.78 -2.14 -1.22 -4.48 118.94 119.54 1r8b s TRP 53 Ca 0.09 1.87 -0.21 0.00 2.66 0.00 0.00 56.10 60.51 1r8b s TRP 53 Cb 0.05 -2.95 -0.08 0.00 -3.10 0.00 0.00 33.47 27.40 1r8b s TRP 53 CO 0.07 0.42 1.09 -1.17 -2.66 0.00 0.00 176.95 174.71 1r8b s LEU 54 N -1.34 3.90 -0.28 -4.66 2.96 -1.26 -4.64 118.68 113.36 1r8b s LEU 54 Ca 0.42 2.10 -0.41 0.00 -0.22 0.00 0.00 54.13 56.02 1r8b s LEU 54 Cb -0.24 -4.43 -0.16 0.00 0.50 0.00 0.00 46.19 41.85 1r8b s LEU 54 CO 0.30 -0.89 1.68 1.17 -1.32 0.00 0.00 176.35 177.29 1r8b n LYS 55 N -0.80 0.95 -0.20 1.98 4.81 -0.55 -1.49 118.16 122.86 1r8b n LYS 55 Ca 0.09 0.35 0.00 0.00 -0.87 0.00 0.00 58.31 57.88 1r8b n LYS 55 Cb 0.51 -2.00 0.00 0.00 0.02 0.00 0.00 35.03 33.56 1r8b n LYS 55 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1r8b n GLY 56 N 4.00 0.60 2.51 3.14 0.00 -1.26 -4.96 105.19 109.22 1r8b n GLY 56 Ca 0.26 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.05 1r8b n GLY 56 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1r8b n SER 57 N 0.00 4.03 -4.66 1.61 7.64 -0.55 -5.04 113.62 116.65 1r8b n SER 57 Ca 0.00 -3.50 -0.43 0.00 1.01 0.00 0.00 58.87 55.95 1r8b n SER 57 Cb 0.00 -0.47 -0.02 0.00 -1.01 0.00 0.00 64.21 62.71 1r8b n SER 57 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1r8b s LEU 58 N -3.46 4.13 -0.21 -3.43 2.96 -1.26 -4.65 118.68 112.76 1r8b s LEU 58 Ca 0.44 1.58 -0.16 0.00 -0.22 0.00 0.00 54.13 55.76 1r8b s LEU 58 Cb 0.41 -3.54 0.06 0.00 0.50 0.00 0.00 46.19 43.62 1r8b s LEU 58 CO -0.14 -0.80 0.54 -0.70 -1.32 0.00 0.00 176.35 173.93 1r8b s GLU 59 N 3.56 0.59 -0.19 1.98 2.12 -1.26 -4.35 118.70 121.16 1r8b s GLU 59 Ca 0.54 0.83 -0.06 0.00 0.36 0.00 0.00 54.97 56.64 1r8b s GLU 59 Cb -0.20 0.22 -0.03 0.00 0.26 0.00 0.00 34.13 34.37 1r8b s GLU 59 CO 0.15 -0.10 0.02 0.42 -0.54 0.00 0.00 175.26 175.21 1r8b s ILE 60 N 0.70 4.28 -0.25 -3.70 1.01 0.24 -4.23 121.20 119.26 1r8b s ILE 60 Ca -0.03 -0.21 -0.06 0.00 0.00 0.00 0.00 60.65 60.35 1r8b s ILE 60 Cb -0.05 -2.93 -0.02 0.00 0.01 0.00 0.00 42.46 39.48 1r8b s ILE 60 CO -0.05 0.44 0.04 -1.81 0.00 0.00 0.00 174.94 173.56 1r8b s ASP 61 N 0.69 4.86 -0.09 3.58 1.01 -1.26 -0.83 116.67 124.64 1r8b s ASP 61 Ca 0.01 -0.34 0.03 0.00 0.71 0.00 0.00 52.55 52.95 1r8b s ASP 61 Cb -0.14 -1.86 -0.02 0.00 1.01 0.00 0.00 42.92 41.92 1r8b s ASP 61 CO 0.02 -0.05 -0.17 -0.69 0.21 0.00 0.00 175.17 174.48 1r8b s VAL 62 N 1.55 2.73 -0.20 -1.27 1.01 0.87 -0.95 120.40 124.14 1r8b s VAL 62 Ca 0.06 -0.81 -0.05 0.00 0.00 0.00 0.00 61.98 61.18 1r8b s VAL 62 Cb -0.15 -2.08 -0.03 0.00 0.00 0.00 0.00 36.38 34.12 1r8b s VAL 62 CO 0.01 0.56 0.00 -0.36 0.00 0.00 0.00 175.10 175.31 1r8b s PHE 63 N -0.07 3.05 -0.06 5.22 0.40 -0.40 -1.51 117.98 124.61 1r8b s PHE 63 Ca -0.04 -0.41 -0.30 0.00 -0.60 0.00 0.00 56.93 55.58 1r8b s PHE 63 Cb -0.14 -2.08 -0.02 0.00 0.51 0.00 0.00 43.02 41.29 1r8b s PHE 63 CO 0.04 -0.20 1.02 -0.51 0.70 0.00 0.00 175.22 176.26 1r8b s LEU 64 N 0.94 4.30 -0.41 -0.37 1.43 -0.42 -1.27 118.68 122.88 1r8b s LEU 64 Ca 0.01 1.61 -0.05 0.00 -1.03 0.00 0.00 54.13 54.68 1r8b s LEU 64 Cb -0.14 -3.56 0.10 0.00 0.03 0.00 0.00 46.19 42.61 1r8b s LEU 64 CO 0.02 -0.39 0.21 -0.76 0.23 0.00 0.00 176.35 175.66 1r8b s LEU 65 N 1.65 5.15 0.00 1.79 1.43 -0.31 -1.61 118.68 126.77 1r8b s LEU 65 Ca 0.50 -1.84 -0.01 0.00 -1.03 0.00 0.00 54.13 51.76 1r8b s LEU 65 Cb -0.20 -1.87 -0.04 0.00 0.03 0.00 0.00 46.19 44.11 1r8b s LEU 65 CO 0.22 -0.53 0.10 -0.36 0.23 0.00 0.00 176.35 176.01 1r8b s PHE 66 N 1.23 3.33 0.62 0.29 0.40 -0.90 -4.63 117.98 118.31 1r8b s PHE 66 Ca 0.05 0.22 -0.17 0.00 -0.60 0.00 0.00 56.93 56.43 1r8b s PHE 66 Cb -0.23 -1.75 -0.08 0.00 0.51 0.00 0.00 43.02 41.48 1r8b s PHE 66 CO -0.02 0.57 0.47 -2.30 0.70 0.00 0.00 175.22 174.63 1r8b n PRO 67 N 1.10 0.42 -0.26 0.24 -0.02 -1.26 -1.15 135.00 134.06 1r8b n PRO 67 Ca -0.12 0.17 0.09 0.00 -2.02 0.00 0.00 63.50 61.62 1r8b n PRO 67 Cb 0.53 -1.70 0.34 0.00 -0.02 0.00 0.00 33.50 32.65 1r8b n PRO 67 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1r8b h GLU 68 N 0.02 0.75 -3.20 -0.52 4.81 -1.98 -3.27 114.58 111.19 1r8b h GLU 68 Ca -0.45 -0.05 -0.76 0.00 -0.13 0.00 0.00 59.36 57.97 1r8b h GLU 68 Cb 1.38 -0.17 -0.17 0.00 0.63 0.00 0.00 28.75 30.42 1r8b h GLU 68 CO 0.45 0.50 1.88 0.39 -0.73 0.00 0.00 179.01 181.50 1r8b n GLU 69 N -4.54 4.00 -4.19 1.92 4.71 -1.26 -4.80 120.64 116.48 1r8b n GLU 69 Ca 0.16 -3.71 -0.20 0.00 -0.01 0.00 0.00 57.16 53.39 1r8b n GLU 69 Cb 0.37 -2.79 -0.16 0.00 -1.01 0.00 0.00 31.44 27.85 1r8b n GLU 69 CO 0.00 0.00 0.00 -0.06 0.09 0.00 0.00 177.13 177.16 1r8b s PHE 70 N -0.56 0.82 1.37 -0.32 2.99 -1.24 -5.14 117.98 115.90 1r8b s PHE 70 Ca 0.41 -0.24 -0.23 0.00 0.00 0.00 0.00 56.93 56.87 1r8b s PHE 70 Cb 0.11 -0.71 0.35 0.00 0.00 0.00 0.00 43.02 42.78 1r8b s PHE 70 CO -0.00 -0.20 0.89 0.45 -0.00 0.00 0.00 175.22 176.35 1r8b n SER 71 N 4.05 -3.67 -0.23 1.36 2.88 -1.26 -4.61 113.62 112.14 1r8b n SER 71 Ca -0.24 -0.92 -0.02 0.00 -1.33 0.00 0.00 58.87 56.36 1r8b n SER 71 Cb 0.51 -0.96 0.17 0.00 -0.75 0.00 0.00 64.21 63.17 1r8b n SER 71 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 1r8b h LYS 72 N 0.00 1.03 0.00 -1.46 1.63 -2.00 -2.39 116.57 113.37 1r8b h LYS 72 Ca -0.38 -0.14 0.00 0.00 -0.85 0.00 0.00 60.65 59.28 1r8b h LYS 72 Cb 1.27 -0.19 0.00 0.00 -0.60 0.00 0.00 32.23 32.71 1r8b h LYS 72 CO 0.24 0.79 -0.98 -1.91 -3.45 0.00 0.00 179.45 174.13 1r8b n GLU 73 N -4.33 0.49 0.14 1.90 2.13 -1.26 -3.24 120.64 116.47 1r8b n GLU 73 Ca 0.07 0.08 0.03 0.00 0.66 0.00 0.00 57.16 57.99 1r8b n GLU 73 Cb 0.13 -1.74 0.40 0.00 0.27 0.00 0.00 31.44 30.50 1r8b n GLU 73 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 1r8b h GLU 74 N 0.00 0.18 0.05 5.31 5.08 -1.75 0.85 114.58 124.29 1r8b h GLU 74 Ca 0.00 -0.04 -0.24 0.00 -1.00 0.00 0.00 59.36 58.07 1r8b h GLU 74 Cb 0.90 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.11 1r8b h GLU 74 CO 0.00 0.35 -1.18 -0.07 -1.00 0.00 0.00 179.01 177.10 1r8b h LEU 75 N 0.17 0.15 -0.06 1.33 3.38 -1.57 -3.10 115.31 115.60 1r8b h LEU 75 Ca 0.03 -0.18 -0.23 0.00 0.09 0.00 0.00 57.88 57.59 1r8b h LEU 75 Cb 0.40 -0.05 0.02 0.00 0.09 0.00 0.00 40.66 41.12 1r8b h LEU 75 CO 0.03 1.14 -0.87 -0.09 0.09 0.00 0.00 178.44 178.74 1r8b h ARG 76 N 0.03 0.70 0.08 1.13 2.43 -1.43 -2.12 114.38 115.20 1r8b h ARG 76 Ca -0.09 -0.67 -0.19 0.00 -0.81 0.00 0.00 59.98 58.22 1r8b h ARG 76 Cb 1.87 0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 31.59 1r8b h ARG 76 CO 0.15 1.27 -0.95 1.49 -1.51 0.00 0.00 179.97 180.41 1r8b h GLU 77 N 0.39 0.18 -0.00 0.20 4.81 -1.00 -2.98 114.58 116.17 1r8b h GLU 77 Ca -0.09 -0.30 -0.08 0.00 -0.13 0.00 0.00 59.36 58.75 1r8b h GLU 77 Cb 1.52 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 31.00 1r8b h GLU 77 CO 0.17 1.15 -0.40 -0.09 -0.73 0.00 0.00 179.01 179.11 1r8b h ARG 78 N -0.55 0.01 -0.28 1.92 9.65 -1.70 -2.55 114.38 120.88 1r8b h ARG 78 Ca -0.21 -0.00 -0.13 0.00 -1.10 0.00 0.00 59.98 58.54 1r8b h ARG 78 Cb 1.52 -0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 30.09 1r8b h ARG 78 CO 0.04 0.41 -0.32 0.78 2.80 0.00 0.00 179.97 183.67 1r8b h GLY 79 N 1.20 0.78 2.00 2.80 0.00 -1.48 -3.00 103.07 105.38 1r8b h GLY 79 Ca -0.00 -0.82 -0.02 0.00 0.00 0.00 0.00 47.33 46.49 1r8b h GLY 79 CO 0.05 0.74 -0.08 1.41 0.00 0.00 0.00 176.54 178.67 1r8b h LEU 80 N 0.46 0.00 -0.57 3.11 3.38 -1.43 -2.99 115.31 117.27 1r8b h LEU 80 Ca 0.04 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.02 1r8b h LEU 80 Cb 0.90 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.62 1r8b h LEU 80 CO 0.08 0.08 0.38 -0.08 0.09 0.00 0.00 178.44 178.98 1r8b h GLU 81 N 0.00 0.75 0.07 1.13 4.81 -1.30 -3.04 114.58 116.99 1r8b h GLU 81 Ca -0.00 -0.04 -0.28 0.00 -0.13 0.00 0.00 59.36 58.90 1r8b h GLU 81 Cb 0.65 -0.17 0.02 0.00 0.63 0.00 0.00 28.75 29.89 1r8b h GLU 81 CO 0.01 0.49 -1.16 0.82 -0.73 0.00 0.00 179.01 178.45 1r8b h ILE 82 N 0.77 1.29 -0.77 2.32 2.04 -1.55 -2.99 117.51 118.61 1r8b h ILE 82 Ca 0.21 -2.39 0.12 0.00 1.00 0.00 0.00 64.86 63.81 1r8b h ILE 82 Cb -0.08 2.56 -0.08 0.00 -0.74 0.00 0.00 36.82 38.48 1r8b h ILE 82 CO -0.05 0.73 0.38 1.23 0.00 0.00 0.00 178.15 180.44 1r8b h GLY 83 N 0.41 1.20 1.18 5.37 0.00 -1.59 -1.33 103.07 108.32 1r8b h GLY 83 Ca -0.16 -0.23 -0.06 0.00 0.00 0.00 0.00 47.33 46.88 1r8b h GLY 83 CO 0.22 0.01 0.16 0.50 0.00 0.00 0.00 176.54 177.43 1r8b h LYS 84 N 0.60 1.02 0.00 4.80 1.57 -1.55 -2.76 116.57 120.25 1r8b h LYS 84 Ca 0.40 -0.23 -0.09 0.00 -1.87 0.00 0.00 60.65 58.86 1r8b h LYS 84 Cb 0.50 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 1r8b h LYS 84 CO -0.32 0.90 -0.45 0.00 -0.57 0.00 0.00 179.45 179.01 1r8b h ALA 85 N 1.20 1.25 0.00 3.86 0.00 -1.12 -3.33 119.26 121.11 1r8b h ALA 85 Ca 0.21 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1r8b h ALA 85 Cb 0.34 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1r8b h ALA 85 CO -0.00 0.57 -0.93 0.28 0.00 0.00 0.00 179.25 179.17 1r8b n VAL 86 N -3.99 0.00 -4.10 0.00 0.31 -0.70 -4.96 118.33 104.89 1r8b n VAL 86 Ca -0.02 -0.24 -0.33 0.00 -0.01 0.00 0.00 64.34 63.74 1r8b n VAL 86 Cb 0.48 0.70 -0.07 0.00 -0.91 0.00 0.00 33.84 34.04 1r8b n VAL 86 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1r8b s LEU 87 N -3.04 3.91 0.08 7.52 1.43 -1.05 -4.94 118.68 122.60 1r8b s LEU 87 Ca 0.01 0.16 -0.24 0.00 -1.03 0.00 0.00 54.13 53.02 1r8b s LEU 87 Cb 0.08 -2.27 -0.16 0.00 0.03 0.00 0.00 46.19 43.88 1r8b s LEU 87 CO 0.48 0.28 1.67 0.44 0.23 0.00 0.00 176.35 179.45 1r8b h ASP 88 N 4.13 -0.09 -4.56 2.29 3.32 -1.19 -3.44 116.42 116.88 1r8b h ASP 88 Ca -0.49 -0.05 -0.25 0.00 0.02 0.00 0.00 57.03 56.26 1r8b h ASP 88 Cb 1.18 0.02 -0.16 0.00 0.22 0.00 0.00 39.33 40.59 1r8b h ASP 88 CO 0.62 -0.01 -0.71 -0.94 -1.72 0.00 0.00 179.24 176.48 1r8b s SER 89 N -5.15 1.17 0.04 6.45 1.04 -1.25 -4.99 113.70 111.01 1r8b s SER 89 Ca -0.14 -0.91 -0.24 0.00 0.48 0.00 0.00 55.95 55.15 1r8b s SER 89 Cb 0.05 0.07 0.06 0.00 0.10 0.00 0.00 66.02 66.30 1r8b s SER 89 CO 0.65 -0.39 0.55 -0.72 0.98 0.00 0.00 173.24 174.32 1r8b s TYR 90 N -3.08 -0.47 0.22 5.02 -0.85 -1.26 -1.44 117.35 115.48 1r8b s TYR 90 Ca 0.08 0.58 0.11 0.00 -0.52 0.00 0.00 57.07 57.32 1r8b s TYR 90 Cb 0.02 0.37 -0.05 0.00 0.38 0.00 0.00 41.96 42.68 1r8b s TYR 90 CO -0.03 -0.65 -0.21 -1.21 -1.52 0.00 0.00 175.55 171.93 1r8b s GLU 91 N -2.30 1.62 -0.70 -3.49 2.02 0.22 -4.96 118.70 111.10 1r8b s GLU 91 Ca -0.06 -1.57 -0.17 0.00 0.02 0.00 0.00 54.97 53.19 1r8b s GLU 91 Cb -0.01 -1.86 0.15 0.00 0.10 0.00 0.00 34.13 32.51 1r8b s GLU 91 CO -0.00 0.38 0.75 0.42 0.02 0.00 0.00 175.26 176.83 1r8b s ILE 92 N -1.90 5.10 0.74 -1.63 1.09 -1.26 -1.74 121.20 121.60 1r8b s ILE 92 Ca 0.24 -1.60 -0.11 0.00 -1.10 0.00 0.00 60.65 58.07 1r8b s ILE 92 Cb -0.07 -4.50 0.04 0.00 -1.06 0.00 0.00 42.46 36.86 1r8b s ILE 92 CO 0.12 -1.11 1.12 -0.13 -0.10 0.00 0.00 174.94 174.83 1r8b s ARG 93 N 1.77 2.51 -0.34 2.79 0.52 -0.83 -4.92 118.95 120.45 1r8b s ARG 93 Ca 0.15 0.29 -0.00 0.00 -0.52 0.00 0.00 55.73 55.65 1r8b s ARG 93 Cb -0.18 -2.01 0.11 0.00 0.52 0.00 0.00 34.95 33.39 1r8b s ARG 93 CO -0.01 -1.24 0.14 0.71 0.02 0.00 0.00 175.30 174.92 1r8b s TYR 94 N -3.42 1.68 0.00 -0.53 1.51 -1.26 -2.24 117.35 113.08 1r8b s TYR 94 Ca 0.59 -1.87 0.00 0.00 -1.01 0.00 0.00 57.07 54.78 1r8b s TYR 94 Cb -0.11 -1.69 0.00 0.00 -0.11 0.00 0.00 41.96 40.05 1r8b s TYR 94 CO 0.50 -0.85 0.00 0.00 -1.11 0.00 0.00 175.55 174.09 1r8b n ALA 95 N 4.50 0.00 -0.11 3.71 0.00 -1.26 -4.89 120.51 122.46 1r8b n ALA 95 Ca 0.01 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.30 1r8b n ALA 95 Cb 0.40 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.74 1r8b n ALA 95 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1r8b n GLU 96 N 0.00 0.58 -4.10 0.00 1.02 -1.26 -5.02 120.64 111.86 1r8b n GLU 96 Ca 0.00 0.13 -0.08 0.00 -0.02 0.00 0.00 57.16 57.19 1r8b n GLU 96 Cb 0.00 -1.45 -0.10 0.00 -0.02 0.00 0.00 31.44 29.87 1r8b n GLU 96 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1r8b s HIS 97 N -2.45 0.58 0.15 -0.32 3.76 -1.26 -5.13 115.29 110.62 1r8b s HIS 97 Ca -0.30 -0.99 -0.34 0.00 -0.15 0.00 0.00 55.06 53.28 1r8b s HIS 97 Cb 0.08 -0.40 -0.13 0.00 1.11 0.00 0.00 32.58 33.23 1r8b s HIS 97 CO 0.52 -0.32 1.63 -2.30 -0.85 0.00 0.00 174.74 173.43 1r8b n PRO 98 N 0.20 2.26 -4.52 8.40 -0.02 -1.26 -4.82 135.00 135.24 1r8b n PRO 98 Ca -0.14 0.82 -0.26 0.00 -2.02 0.00 0.00 63.50 61.89 1r8b n PRO 98 Cb 0.60 -2.61 -0.08 0.00 -0.02 0.00 0.00 33.50 31.40 1r8b n PRO 98 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 1r8b s TYR 99 N 1.25 1.79 -0.14 6.00 -0.85 -0.95 -4.85 117.35 119.60 1r8b s TYR 99 Ca 0.79 -1.29 -0.05 0.00 -0.52 0.00 0.00 57.07 56.01 1r8b s TYR 99 Cb -0.65 -1.16 -0.04 0.00 0.38 0.00 0.00 41.96 40.50 1r8b s TYR 99 CO 0.38 -0.30 0.02 0.08 -1.52 0.00 0.00 175.55 174.21 1r8b s VAL 100 N -3.20 4.47 0.03 -3.49 1.01 -0.82 -1.96 120.40 116.44 1r8b s VAL 100 Ca 0.23 -0.16 0.08 0.00 0.00 0.00 0.00 61.98 62.13 1r8b s VAL 100 Cb 0.02 -2.96 -0.02 0.00 0.00 0.00 0.00 36.38 33.42 1r8b s VAL 100 CO 0.15 0.52 -0.23 -2.28 0.00 0.00 0.00 175.10 173.26 1r8b s HIS 101 N -0.09 2.01 0.00 5.22 5.04 -0.71 -1.26 115.29 125.50 1r8b s HIS 101 Ca 0.05 -0.39 0.00 0.00 -1.54 0.00 0.00 55.06 53.18 1r8b s HIS 101 Cb -0.12 -1.22 0.00 0.00 0.04 0.00 0.00 32.58 31.28 1r8b s HIS 101 CO 0.02 0.08 0.00 0.41 -2.34 0.00 0.00 174.74 172.91 1r8b n GLY 102 N 1.94 1.84 3.15 1.59 0.00 -0.78 0.69 105.19 113.61 1r8b n GLY 102 Ca -0.17 -0.82 -0.20 0.00 0.00 0.00 0.00 46.02 44.83 1r8b n GLY 102 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r8b s VAL 103 N -2.66 1.13 -0.11 1.61 1.01 -0.52 -1.34 120.40 119.52 1r8b s VAL 103 Ca 0.00 -1.00 -0.03 0.00 0.00 0.00 0.00 61.98 60.96 1r8b s VAL 103 Cb 0.00 -1.02 0.04 0.00 0.00 0.00 0.00 36.38 35.40 1r8b s VAL 103 CO 0.00 0.02 0.04 -0.69 0.00 0.00 0.00 175.10 174.47 1r8b s VAL 104 N -0.84 0.21 -1.38 2.92 1.01 -0.32 -0.59 120.40 121.42 1r8b s VAL 104 Ca 0.02 -0.02 -0.01 0.00 0.00 0.00 0.00 61.98 61.97 1r8b s VAL 104 Cb -0.08 -0.57 0.01 0.00 0.00 0.00 0.00 36.38 35.74 1r8b s VAL 104 CO 0.01 0.03 0.57 0.29 0.00 0.00 0.00 175.10 176.00 1r8b n LYS 105 N 5.19 -4.09 -0.87 2.72 5.02 -1.26 -2.25 118.16 122.62 1r8b n LYS 105 Ca -0.07 0.51 0.00 0.00 -2.02 0.00 0.00 58.31 56.73 1r8b n LYS 105 Cb 0.49 -4.87 0.00 0.00 -0.02 0.00 0.00 35.03 30.64 1r8b n LYS 105 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1r8b n GLY 106 N -1.78 0.79 3.31 0.72 0.00 -1.26 -4.75 105.19 102.21 1r8b n GLY 106 Ca -0.28 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.42 1r8b n GLY 106 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r8b s VAL 107 N -3.06 2.42 0.27 1.61 1.01 -0.96 -5.10 120.40 116.61 1r8b s VAL 107 Ca 0.00 -0.91 -0.30 0.00 0.00 0.00 0.00 61.98 60.77 1r8b s VAL 107 Cb 0.00 -1.94 -0.10 0.00 0.00 0.00 0.00 36.38 34.34 1r8b s VAL 107 CO 0.00 0.56 1.40 -1.61 0.00 0.00 0.00 175.10 175.45 1r8b s GLU 108 N 0.01 4.29 0.00 2.72 2.02 -1.26 -1.17 118.70 125.30 1r8b s GLU 108 Ca -0.07 2.28 0.00 0.00 0.02 0.00 0.00 54.97 57.20 1r8b s GLU 108 Cb -0.15 -3.10 -0.00 0.00 0.10 0.00 0.00 34.13 30.98 1r8b s GLU 108 CO 0.05 -0.36 -0.01 0.08 0.02 0.00 0.00 175.26 175.04 1r8b s VAL 109 N -0.35 0.08 -0.08 2.63 1.01 -0.45 -0.59 120.40 122.65 1r8b s VAL 109 Ca 0.56 -0.13 0.04 0.00 0.00 0.00 0.00 61.98 62.45 1r8b s VAL 109 Cb -0.41 -0.09 -0.01 0.00 0.00 0.00 0.00 36.38 35.87 1r8b s VAL 109 CO 0.47 -0.03 -0.23 -1.81 0.00 0.00 0.00 175.10 173.49 1r8b s ASP 110 N -0.18 3.20 -0.17 3.32 1.01 -0.01 -1.87 116.67 121.97 1r8b s ASP 110 Ca -0.01 -0.51 -0.00 0.00 0.71 0.00 0.00 52.55 52.73 1r8b s ASP 110 Cb -0.01 -1.18 -0.00 0.00 1.01 0.00 0.00 42.92 42.73 1r8b s ASP 110 CO -0.00 0.20 -0.13 -0.69 0.21 0.00 0.00 175.17 174.75 1r8b s VAL 111 N 0.10 2.78 -0.09 -1.27 1.01 -0.39 -0.09 120.40 122.45 1r8b s VAL 111 Ca -0.11 -0.72 0.03 0.00 0.00 0.00 0.00 61.98 61.17 1r8b s VAL 111 Cb -0.16 -2.19 0.01 0.00 0.00 0.00 0.00 36.38 34.04 1r8b s VAL 111 CO 0.06 0.50 -0.17 -0.69 0.00 0.00 0.00 175.10 174.80 1r8b s VAL 112 N 0.93 1.56 -0.02 2.92 1.01 -0.57 -1.95 120.40 124.28 1r8b s VAL 112 Ca -0.03 -0.71 -0.30 0.00 0.00 0.00 0.00 61.98 60.94 1r8b s VAL 112 Cb -0.15 -1.39 -0.03 0.00 0.00 0.00 0.00 36.38 34.81 1r8b s VAL 112 CO -0.01 0.45 1.10 -2.16 0.00 0.00 0.00 175.10 174.47 1r8b s PRO 113 N 0.64 4.45 0.11 2.72 0.04 -1.26 -1.30 135.00 140.41 1r8b s PRO 113 Ca -0.14 1.57 -0.10 0.00 0.04 0.00 0.00 61.00 62.37 1r8b s PRO 113 Cb -0.16 -3.47 0.00 0.00 0.04 0.00 0.00 34.50 30.91 1r8b s PRO 113 CO 0.04 -0.25 0.25 0.00 0.04 0.00 0.00 177.00 177.08 1r8b s TYR 115 N -3.88 2.94 -0.82 0.00 4.12 -1.26 -2.13 117.35 116.32 1r8b s TYR 115 Ca 0.08 1.48 -0.20 0.00 0.02 0.00 0.00 57.07 58.45 1r8b s TYR 115 Cb 0.04 -3.53 0.11 0.00 -1.52 0.00 0.00 41.96 37.06 1r8b s TYR 115 CO -0.08 -1.71 1.04 0.21 0.02 0.00 0.00 175.55 175.02 1r8b s LYS 116 N -2.26 3.42 -0.26 -0.62 2.20 -0.30 -4.74 119.74 117.18 1r8b s LYS 116 Ca 0.57 -1.49 -0.09 0.00 -0.36 0.00 0.00 55.97 54.61 1r8b s LYS 116 Cb -0.34 -4.66 -0.04 0.00 -1.51 0.00 0.00 37.83 31.28 1r8b s LYS 116 CO 0.44 -1.75 0.11 -0.51 -0.36 0.00 0.00 175.35 173.28 1r8b s LEU 117 N 3.00 3.66 -0.63 5.43 1.43 -1.26 -4.44 118.68 125.87 1r8b s LEU 117 Ca 0.28 -0.13 -0.27 0.00 -1.03 0.00 0.00 54.13 52.97 1r8b s LEU 117 Cb -0.10 -1.99 0.02 0.00 0.03 0.00 0.00 46.19 44.15 1r8b s LEU 117 CO -0.03 -0.03 1.38 -0.54 0.23 0.00 0.00 176.35 177.36 1r8b s LYS 118 N 1.61 3.22 0.14 1.70 -0.14 -1.26 -4.66 119.74 120.35 1r8b s LYS 118 Ca 0.06 0.19 0.00 0.00 -1.36 0.00 0.00 55.97 54.87 1r8b s LYS 118 Cb -0.15 -4.16 0.00 0.00 -1.68 0.00 0.00 37.83 31.84 1r8b s LYS 118 CO 0.06 -2.06 0.00 0.39 -0.76 0.00 0.00 175.35 172.98 1r8b n GLU 119 N 8.94 -1.03 0.00 1.68 1.02 -1.26 -5.03 120.64 124.97 1r8b n GLU 119 Ca 0.09 0.79 0.00 0.00 -0.02 0.00 0.00 57.16 58.02 1r8b n GLU 119 Cb 0.49 -0.95 0.00 0.00 -0.02 0.00 0.00 31.44 30.97 1r8b n GLU 119 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1r8b n PRO 120 N -1.50 0.00 -2.71 3.49 -0.04 -1.26 -4.73 135.00 128.26 1r8b n PRO 120 Ca 0.00 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.36 1r8b n PRO 120 Cb 0.08 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.53 1r8b n PRO 120 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1r8b n LYS 121 N 0.00 -2.64 -3.05 0.54 4.76 -1.26 -4.84 118.16 111.67 1r8b n LYS 121 Ca 0.00 0.31 0.00 0.00 -2.87 0.00 0.00 58.31 55.75 1r8b n LYS 121 Cb 0.00 -4.88 -0.00 0.00 -1.84 0.00 0.00 35.03 28.31 1r8b n LYS 121 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 1r8b s ASN 122 N -2.18 -1.31 -0.09 4.39 -0.87 -1.26 -5.14 114.94 108.47 1r8b s ASN 122 Ca 0.10 -0.86 -0.03 0.00 -1.57 0.00 0.00 52.86 50.50 1r8b s ASN 122 Cb -0.06 1.69 0.05 0.00 -0.02 0.00 0.00 41.25 42.91 1r8b s ASN 122 CO 0.12 -0.12 0.17 0.27 -2.57 0.00 0.00 177.10 174.97 1r8b s ILE 123 N 1.65 -0.27 -0.23 0.60 -5.25 -1.26 -4.92 121.20 111.52 1r8b s ILE 123 Ca 0.19 0.32 -0.11 0.00 -0.99 0.00 0.00 60.65 60.06 1r8b s ILE 123 Cb -0.02 -0.33 -0.17 0.00 2.95 0.00 0.00 42.46 44.90 1r8b s ILE 123 CO -0.08 0.12 -0.08 0.29 -1.79 0.00 0.00 174.94 173.41 1r8b n LYS 124 N 5.32 0.63 -1.28 0.37 5.02 -1.26 -5.08 118.16 121.88 1r8b n LYS 124 Ca -0.05 0.31 0.00 0.00 -2.02 0.00 0.00 58.31 56.55 1r8b n LYS 124 Cb 0.50 -1.59 0.00 0.00 -0.02 0.00 0.00 35.03 33.91 1r8b n LYS 124 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1r8b n SER 125 N -3.94 0.00 -0.30 4.39 3.41 -1.26 -5.06 113.62 110.86 1r8b n SER 125 Ca -0.44 -0.71 0.01 0.00 -0.26 0.00 0.00 58.87 57.48 1r8b n SER 125 Cb 0.89 0.00 0.15 0.00 -0.26 0.00 0.00 64.21 64.99 1r8b n SER 125 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1r8b h ALA 126 N 1.19 1.17 -0.67 7.33 0.00 -2.02 -3.12 119.26 123.15 1r8b h ALA 126 Ca 0.00 0.01 0.14 0.00 0.00 0.00 0.00 54.91 55.06 1r8b h ALA 126 Cb 0.00 -0.20 -0.11 0.00 0.00 0.00 0.00 17.79 17.49 1r8b h ALA 126 CO 0.00 0.21 0.08 0.28 0.00 0.00 0.00 179.25 179.82 1r8b h VAL 127 N 0.90 0.51 0.00 0.00 2.07 -1.97 -2.20 116.25 115.56 1r8b h VAL 127 Ca 0.38 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.84 1r8b h VAL 127 Cb 0.24 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.31 1r8b h VAL 127 CO -0.20 0.03 0.00 0.47 0.02 0.00 0.00 177.57 177.90 1r8b n ASP 128 N -5.22 0.48 0.11 0.57 8.00 -1.18 -2.62 116.55 116.69 1r8b n ASP 128 Ca 0.11 0.57 -0.19 0.00 0.71 0.00 0.00 54.79 55.99 1r8b n ASP 128 Cb 0.40 -0.69 -0.13 0.00 -0.02 0.00 0.00 41.12 40.68 1r8b n ASP 128 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1r8b h ARG 129 N 0.00 0.43 -0.81 -1.24 3.08 -1.52 -3.41 114.38 110.91 1r8b h ARG 129 Ca 0.00 -0.64 0.14 0.00 0.07 0.00 0.00 59.98 59.55 1r8b h ARG 129 Cb 0.53 0.23 -0.09 0.00 0.08 0.00 0.00 29.97 30.71 1r8b h ARG 129 CO 0.00 1.28 0.38 1.15 -1.07 0.00 0.00 179.97 181.71 1r8b h THR 130 N 0.16 0.70 -0.95 2.04 2.02 -1.41 0.50 112.91 115.96 1r8b h THR 130 Ca -0.16 -0.19 0.01 0.00 0.77 0.00 0.00 66.41 66.84 1r8b h THR 130 Cb 1.94 0.11 -0.05 0.00 -1.74 0.00 0.00 68.15 68.41 1r8b h THR 130 CO 0.22 0.10 0.63 -0.65 0.37 0.00 0.00 175.52 176.19 1r8b h PRO 131 N 0.54 1.26 -0.07 6.66 0.11 -1.79 -1.58 132.00 137.13 1r8b h PRO 131 Ca 0.44 -0.08 -0.07 0.00 0.11 0.00 0.00 66.00 66.40 1r8b h PRO 131 Cb 0.64 -0.28 -0.01 0.00 0.11 0.00 0.00 31.00 31.46 1r8b h PRO 131 CO -0.38 0.84 -0.28 0.74 -0.21 0.00 0.00 178.00 178.70 1r8b h PHE 132 N 1.29 0.13 0.19 0.65 -1.00 -0.37 -0.25 116.94 117.58 1r8b h PHE 132 Ca 0.35 -0.02 -0.01 0.00 2.81 0.00 0.00 57.97 61.09 1r8b h PHE 132 Cb -0.14 -0.03 0.00 0.00 3.61 0.00 0.00 35.95 39.39 1r8b h PHE 132 CO -0.00 0.40 -0.09 0.45 -1.61 0.00 0.00 178.31 177.46 1r8b h HIS 133 N 0.11 -0.24 0.13 -0.55 3.86 0.11 0.32 115.15 118.89 1r8b h HIS 133 Ca 0.02 -0.01 0.01 0.00 -1.16 0.00 0.00 60.37 59.23 1r8b h HIS 133 Cb 0.57 0.08 -0.01 0.00 1.06 0.00 0.00 27.41 29.10 1r8b h HIS 133 CO 0.00 -0.13 -0.13 1.25 0.86 0.00 0.00 177.93 179.78 1r8b h HIS 134 N -0.28 -0.35 -0.67 2.45 -0.00 -1.33 -1.56 115.15 113.41 1r8b h HIS 134 Ca -0.03 0.00 0.14 0.00 -0.00 0.00 0.00 60.37 60.49 1r8b h HIS 134 Cb 0.22 0.14 -0.11 0.00 -0.00 0.00 0.00 27.41 27.66 1r8b h HIS 134 CO -0.06 -0.21 0.08 -0.22 -0.00 0.00 0.00 177.93 177.53 1r8b h LYS 135 N -0.29 0.18 -0.63 5.26 3.64 -0.91 0.26 116.57 124.08 1r8b h LYS 135 Ca 0.01 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.33 1r8b h LYS 135 Cb 0.28 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 1r8b h LYS 135 CO -0.04 0.12 0.21 2.35 -2.27 0.00 0.00 179.45 179.82 1r8b h TRP 136 N 0.19 1.00 0.00 1.91 7.01 -0.51 -3.19 115.95 122.36 1r8b h TRP 136 Ca 0.36 -0.10 -0.20 0.00 2.11 0.00 0.00 58.89 61.06 1r8b h TRP 136 Cb 0.60 -0.29 -0.03 0.00 -2.10 0.00 0.00 29.16 27.34 1r8b h TRP 136 CO -0.32 0.82 -0.97 -0.07 -2.79 0.00 0.00 178.44 175.11 1r8b h LEU 137 N 0.90 0.00 -9.30 0.65 3.38 -0.43 -3.40 115.31 107.11 1r8b h LEU 137 Ca 0.21 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.63 1r8b h LEU 137 Cb 0.27 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.04 1r8b h LEU 137 CO -0.01 0.94 1.27 1.21 0.09 0.00 0.00 178.44 181.94 1r8b n GLU 138 N -3.32 2.69 0.00 1.13 2.13 0.83 -1.14 120.64 122.96 1r8b n GLU 138 Ca -0.00 0.96 0.00 0.00 0.66 0.00 0.00 57.16 58.78 1r8b n GLU 138 Cb 0.92 -3.02 0.00 0.00 0.27 0.00 0.00 31.44 29.61 1r8b n GLU 138 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1r8b n GLY 139 N 4.73 2.67 0.11 8.31 0.00 -1.26 -4.68 105.19 115.06 1r8b n GLY 139 Ca 0.22 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.22 1r8b n GLY 139 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1r8b h ARG 140 N 1.59 0.00 -0.00 1.61 3.08 -1.35 -3.34 114.38 115.97 1r8b h ARG 140 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1r8b h ARG 140 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1r8b h ARG 140 CO 0.00 0.70 -0.56 1.51 -1.07 0.00 0.00 179.97 180.55 1r8b n ILE 141 N -3.27 0.00 -1.85 2.04 0.13 -0.41 -4.86 119.36 111.15 1r8b n ILE 141 Ca 0.01 -0.06 -0.41 0.00 -1.10 0.00 0.00 62.75 61.19 1r8b n ILE 141 Cb 0.82 0.59 -0.01 0.00 -0.84 0.00 0.00 39.64 40.21 1r8b n ILE 141 CO 0.00 0.00 0.00 -0.54 2.80 0.00 0.00 176.55 178.81 1r8b s LYS 142 N -2.82 4.15 0.00 9.51 1.02 -1.26 -1.07 119.74 129.28 1r8b s LYS 142 Ca 0.14 2.51 0.00 0.00 0.02 0.00 0.00 55.97 58.65 1r8b s LYS 142 Cb 0.18 -3.01 0.00 0.00 -0.52 0.00 0.00 37.83 34.48 1r8b s LYS 142 CO 0.68 -0.52 0.00 0.41 -0.92 0.00 0.00 175.35 175.01 1r8b n GLY 143 N 1.16 2.63 1.89 -3.33 0.00 -1.26 -4.85 105.19 101.42 1r8b n GLY 143 Ca 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.03 1r8b n GLY 143 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1r8b n LYS 144 N -0.09 3.86 -0.11 1.61 5.02 -0.23 -4.59 118.16 123.63 1r8b n LYS 144 Ca 0.00 -3.10 -0.13 0.00 -2.02 0.00 0.00 58.31 53.06 1r8b n LYS 144 Cb 0.00 -2.19 -0.03 0.00 -0.02 0.00 0.00 35.03 32.78 1r8b n LYS 144 CO 0.00 0.00 0.00 1.05 -0.52 0.00 0.00 177.40 177.93 1r8b h GLU 145 N 2.83 0.73 0.00 1.97 9.09 -1.89 -2.62 114.58 124.69 1r8b h GLU 145 Ca 0.20 -0.36 -0.07 0.00 0.05 0.00 0.00 59.36 59.18 1r8b h GLU 145 Cb 2.20 -0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 29.29 1r8b h GLU 145 CO 0.65 0.97 -0.33 -0.91 0.05 0.00 0.00 179.01 179.44 1r8b h ASN 146 N 0.49 0.00 -0.73 3.06 2.35 -1.87 -2.44 115.58 116.45 1r8b h ASN 146 Ca 0.06 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.81 1r8b h ASN 146 Cb 0.80 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.13 1r8b h ASN 146 CO 0.06 0.33 0.45 -0.33 -1.65 0.00 0.00 177.43 176.29 1r8b h GLU 147 N 0.00 0.98 -0.48 0.81 4.39 -1.81 -0.01 114.58 118.47 1r8b h GLU 147 Ca -0.00 -0.08 -0.01 0.00 0.34 0.00 0.00 59.36 59.60 1r8b h GLU 147 Cb 0.96 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 29.38 1r8b h GLU 147 CO 0.04 0.69 0.24 0.28 -1.16 0.00 0.00 179.01 179.10 1r8b h VAL 148 N 0.99 1.18 -0.11 3.13 2.07 -1.10 -1.62 116.25 120.79 1r8b h VAL 148 Ca 0.26 -0.49 -0.11 0.00 0.82 0.00 0.00 66.70 67.18 1r8b h VAL 148 Cb -0.05 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.34 1r8b h VAL 148 CO -0.05 0.20 -0.44 0.03 0.02 0.00 0.00 177.57 177.32 1r8b h ARG 149 N 0.63 0.26 -0.19 1.57 3.08 -1.13 0.90 114.38 119.50 1r8b h ARG 149 Ca 0.17 -0.13 -0.00 0.00 0.07 0.00 0.00 59.98 60.08 1r8b h ARG 149 Cb 0.09 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 1r8b h ARG 149 CO -0.02 0.66 0.11 -0.07 -1.07 0.00 0.00 179.97 179.58 1r8b h LEU 150 N 0.21 0.23 -0.45 3.04 3.38 -0.81 0.18 115.31 121.10 1r8b h LEU 150 Ca 0.02 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 1r8b h LEU 150 Cb 0.87 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.54 1r8b h LEU 150 CO 0.07 0.22 0.13 0.25 0.09 0.00 0.00 178.44 179.20 1r8b h LEU 151 N 0.22 0.67 -0.80 1.67 5.85 -0.72 -0.04 115.31 122.16 1r8b h LEU 151 Ca 0.07 -0.22 0.01 0.00 0.84 0.00 0.00 57.88 58.58 1r8b h LEU 151 Cb 0.03 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.85 1r8b h LEU 151 CO -0.01 0.71 0.53 0.11 -0.34 0.00 0.00 178.44 179.43 1r8b h LYS 152 N 0.59 1.05 -0.39 1.25 1.57 -0.73 -1.57 116.57 118.33 1r8b h LYS 152 Ca 0.14 -0.06 -0.11 0.00 -1.87 0.00 0.00 60.65 58.75 1r8b h LYS 152 Cb 0.29 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 1r8b h LYS 152 CO -0.00 0.69 -0.17 0.78 -0.57 0.00 0.00 179.45 180.18 1r8b h GLY 153 N 1.08 0.88 0.41 3.86 0.00 -0.67 0.14 103.07 108.76 1r8b h GLY 153 Ca 0.29 -0.78 0.04 0.00 0.00 0.00 0.00 47.33 46.89 1r8b h GLY 153 CO -0.07 0.71 -0.21 -2.75 0.00 0.00 0.00 176.54 174.23 1r8b h PHE 154 N 0.61 -0.54 -0.43 5.60 3.57 -0.84 -1.06 116.94 123.84 1r8b h PHE 154 Ca 0.09 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.57 1r8b h PHE 154 Cb 0.72 0.25 -0.02 0.00 2.79 0.00 0.00 35.95 39.70 1r8b h PHE 154 CO 0.06 -0.29 0.12 -0.07 -2.23 0.00 0.00 178.31 175.90 1r8b h LEU 155 N -0.28 0.65 -0.78 0.59 3.38 -1.08 -2.89 115.31 114.89 1r8b h LEU 155 Ca 0.09 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 1r8b h LEU 155 Cb 0.41 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.95 1r8b h LEU 155 CO -0.25 0.70 0.44 0.50 0.09 0.00 0.00 178.44 179.91 1r8b h LYS 156 N 0.56 1.08 0.00 1.13 3.64 -0.64 -0.20 116.57 122.14 1r8b h LYS 156 Ca 0.14 -0.12 -0.02 0.00 -1.27 0.00 0.00 60.65 59.38 1r8b h LYS 156 Cb 0.30 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 31.90 1r8b h LYS 156 CO -0.00 0.79 -0.09 0.00 -2.27 0.00 0.00 179.45 177.88 1r8b h ALA 157 N 1.23 1.43 -0.51 5.00 0.00 -1.08 -2.48 119.26 122.85 1r8b h ALA 157 Ca 0.28 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1r8b h ALA 157 Cb 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1r8b h ALA 157 CO -0.05 0.11 0.00 0.09 0.00 0.00 0.00 179.25 179.41 1r8b n ASN 158 N -3.82 3.56 -0.03 0.00 3.02 -0.83 -4.23 115.26 112.93 1r8b n ASN 158 Ca -0.02 -2.13 -0.00 0.00 -0.03 0.00 0.00 54.58 52.40 1r8b n ASN 158 Cb 0.19 -0.38 -0.00 0.00 -0.61 0.00 0.00 39.78 38.97 1r8b n ASN 158 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1r8b n GLY 159 N 0.89 0.46 0.49 7.41 0.00 -0.63 -4.91 105.19 108.89 1r8b n GLY 159 Ca 0.18 -0.53 0.07 0.00 0.00 0.00 0.00 46.02 45.74 1r8b n GLY 159 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1r8b n ILE 160 N -2.97 1.73 -3.60 -0.61 -5.35 -0.18 -4.94 119.36 103.43 1r8b n ILE 160 Ca -0.00 -2.45 -0.37 0.00 -0.27 0.00 0.00 62.75 59.66 1r8b n ILE 160 Cb 0.02 -0.07 -0.09 0.00 -1.74 0.00 0.00 39.64 37.76 1r8b n ILE 160 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 1r8b s TYR 161 N -2.57 3.35 0.00 4.28 5.04 -1.20 -1.18 117.35 125.07 1r8b s TYR 161 Ca 0.33 0.35 0.00 0.00 -2.44 0.00 0.00 57.07 55.30 1r8b s TYR 161 Cb 0.31 -2.31 0.00 0.00 0.35 0.00 0.00 41.96 40.31 1r8b s TYR 161 CO -0.04 0.09 0.00 0.41 -1.34 0.00 0.00 175.55 174.67 1r8b n GLY 162 N 4.04 3.26 0.80 8.97 0.00 0.18 -4.78 105.19 117.66 1r8b n GLY 162 Ca -0.14 -1.48 0.12 0.00 0.00 0.00 0.00 46.02 44.53 1r8b n GLY 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r8b n ALA 163 N 0.55 2.49 -1.19 4.61 0.00 -1.26 -0.82 120.51 124.91 1r8b n ALA 163 Ca 0.00 -0.65 -0.32 0.00 0.00 0.00 0.00 53.44 52.47 1r8b n ALA 163 Cb 0.00 -0.96 0.10 0.00 0.00 0.00 0.00 19.45 18.59 1r8b n ALA 163 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1r8b s GLU 164 N -1.88 2.05 0.43 0.00 1.03 -1.26 -4.49 118.70 114.58 1r8b s GLU 164 Ca 0.33 1.38 0.18 0.00 0.03 0.00 0.00 54.97 56.89 1r8b s GLU 164 Cb 0.20 -1.86 0.99 0.00 -0.80 0.00 0.00 34.13 32.67 1r8b s GLU 164 CO 0.31 -1.83 1.93 -0.92 -1.33 0.00 0.00 175.26 173.41 1r8b h TYR 165 N -0.97 0.00 -0.20 4.83 3.20 -1.91 0.99 116.97 122.92 1r8b h TYR 165 Ca -0.45 0.00 0.06 0.00 3.14 0.00 0.00 58.73 61.48 1r8b h TYR 165 Cb 1.25 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.51 1r8b h TYR 165 CO 0.54 0.25 0.21 -0.22 -1.64 0.00 0.00 178.16 177.30 1r8b h LYS 166 N 0.00 0.00 0.00 1.82 3.64 -1.91 -3.32 116.57 116.80 1r8b h LYS 166 Ca -0.00 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 59.22 1r8b h LYS 166 Cb 0.51 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.30 1r8b h LYS 166 CO 0.03 0.00 -1.56 0.28 -2.27 0.00 0.00 179.45 175.94 1r8b n VAL 167 N -3.85 0.55 -3.89 2.00 0.31 -0.38 -5.03 118.33 108.04 1r8b n VAL 167 Ca 0.02 -0.18 -0.27 0.00 -0.01 0.00 0.00 64.34 63.90 1r8b n VAL 167 Cb 0.34 -1.22 0.01 0.00 -0.91 0.00 0.00 33.84 32.06 1r8b n VAL 167 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1r8b n ARG 168 N -3.10 -4.70 0.00 5.55 1.74 0.20 -4.91 116.66 111.44 1r8b n ARG 168 Ca -0.18 0.55 0.00 0.00 -0.77 0.00 0.00 57.85 57.44 1r8b n ARG 168 Cb 0.66 -5.18 0.00 0.00 -1.02 0.00 0.00 32.46 26.92 1r8b n ARG 168 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1r8b n GLY 169 N -1.68 3.81 3.76 -0.13 0.00 0.00 -1.39 105.19 109.57 1r8b n GLY 169 Ca -0.12 -1.74 -0.36 0.00 0.00 0.00 0.00 46.02 43.80 1r8b n GLY 169 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1r8b s PHE 170 N 3.55 3.48 0.76 1.61 0.40 -0.32 -3.87 117.98 123.59 1r8b s PHE 170 Ca 0.00 0.49 -0.10 0.00 -0.60 0.00 0.00 56.93 56.72 1r8b s PHE 170 Cb 0.00 -2.19 0.07 0.00 0.51 0.00 0.00 43.02 41.41 1r8b s PHE 170 CO 0.00 0.37 1.11 -1.54 0.70 0.00 0.00 175.22 175.86 1r8b s SER 171 N 0.07 4.70 0.13 1.36 1.04 -1.26 0.48 113.70 120.22 1r8b s SER 171 Ca 0.13 0.70 -0.14 0.00 0.48 0.00 0.00 55.95 57.13 1r8b s SER 171 Cb -0.12 -1.28 -0.01 0.00 0.10 0.00 0.00 66.02 64.71 1r8b s SER 171 CO 0.02 -1.74 1.57 1.23 0.98 0.00 0.00 173.24 175.30 1r8b h GLY 172 N -0.86 0.84 1.02 7.32 0.00 -1.98 -2.04 103.07 107.37 1r8b h GLY 172 Ca -0.45 -0.64 -0.01 0.00 0.00 0.00 0.00 47.33 46.23 1r8b h GLY 172 CO 0.64 0.59 0.51 -1.82 0.00 0.00 0.00 176.54 176.45 1r8b h TYR 173 N 0.62 1.15 -0.66 5.60 3.20 -1.98 -1.87 116.97 123.03 1r8b h TYR 173 Ca 0.12 -0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.93 1r8b h TYR 173 Cb 0.53 -0.37 -0.03 0.00 1.54 0.00 0.00 36.73 38.39 1r8b h TYR 173 CO 0.04 0.78 0.22 1.25 -1.64 0.00 0.00 178.16 178.81 1r8b h LEU 174 N 1.19 0.94 -1.09 2.82 5.85 -1.82 -1.36 115.31 121.84 1r8b h LEU 174 Ca 0.31 -0.20 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 1r8b h LEU 174 Cb -0.03 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.72 1r8b h LEU 174 CO -0.06 0.88 0.53 0.00 -0.34 0.00 0.00 178.44 179.46 1r8b h GLU 176 N 1.18 0.72 -0.53 0.00 5.08 -1.04 -2.53 114.58 117.46 1r8b h GLU 176 Ca 0.31 -0.65 0.06 0.00 -1.00 0.00 0.00 59.36 58.08 1r8b h GLU 176 Cb -0.08 0.15 -0.05 0.00 0.50 0.00 0.00 28.75 29.28 1r8b h GLU 176 CO -0.06 1.25 0.24 -0.07 -1.00 0.00 0.00 179.01 179.36 1r8b h LEU 177 N 0.46 0.31 -0.78 1.33 3.38 -0.98 -1.13 115.31 117.90 1r8b h LEU 177 Ca -0.08 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1r8b h LEU 177 Cb 1.50 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 42.20 1r8b h LEU 177 CO 0.17 0.21 0.50 -0.07 0.09 0.00 0.00 178.44 179.35 1r8b h LEU 178 N 0.46 0.92 -0.74 1.67 3.38 -1.14 0.13 115.31 119.98 1r8b h LEU 178 Ca 0.24 -0.04 -0.09 0.00 0.09 0.00 0.00 57.88 58.09 1r8b h LEU 178 Cb 0.20 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1r8b h LEU 178 CO -0.20 0.68 -0.02 0.40 0.09 0.00 0.00 178.44 179.39 1r8b h ILE 179 N 1.07 1.26 -0.39 1.22 1.08 -1.20 -0.15 117.51 120.39 1r8b h ILE 179 Ca 0.29 -1.12 -0.04 0.00 -0.39 0.00 0.00 64.86 63.59 1r8b h ILE 179 Cb -0.09 0.87 -0.02 0.00 -3.07 0.00 0.00 36.82 34.51 1r8b h ILE 179 CO -0.06 0.40 0.09 0.58 -0.69 0.00 0.00 178.15 178.47 1r8b h VAL 180 N 0.86 1.23 -0.42 1.67 2.07 -0.65 0.26 116.25 121.28 1r8b h VAL 180 Ca 0.16 -0.80 -0.07 0.00 0.82 0.00 0.00 66.70 66.81 1r8b h VAL 180 Cb 0.54 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 1r8b h VAL 180 CO 0.03 0.27 0.00 0.15 0.02 0.00 0.00 177.57 178.04 1r8b h PHE 181 N 0.49 0.80 0.00 1.57 3.57 -0.66 -3.31 116.94 119.40 1r8b h PHE 181 Ca 0.12 -0.14 0.00 0.00 3.53 0.00 0.00 57.97 61.48 1r8b h PHE 181 Cb 0.32 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 38.85 1r8b h PHE 181 CO 0.02 0.80 -1.55 0.66 -2.23 0.00 0.00 178.31 176.01 1r8b n TYR 182 N -4.43 0.00 0.00 0.41 4.01 -0.10 -5.01 117.16 112.05 1r8b n TYR 182 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 1r8b n TYR 182 Cb 0.29 -0.29 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 1r8b n TYR 182 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1r8b n GLY 183 N 1.40 3.28 3.61 2.72 0.00 0.93 -4.70 105.19 112.43 1r8b n GLY 183 Ca -0.01 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.92 1r8b n GLY 183 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1r8b s SER 184 N -0.33 -0.41 0.12 1.61 1.04 -1.25 -4.93 113.70 109.55 1r8b s SER 184 Ca 0.00 -0.25 -0.22 0.00 0.48 0.00 0.00 55.95 55.96 1r8b s SER 184 Cb 0.00 0.61 -0.06 0.00 0.10 0.00 0.00 66.02 66.67 1r8b s SER 184 CO 0.00 -1.06 1.70 0.15 0.98 0.00 0.00 173.24 175.01 1r8b h PHE 185 N 2.00 -0.20 -0.45 5.02 3.04 -1.93 -1.78 116.94 122.64 1r8b h PHE 185 Ca -0.27 0.01 0.02 0.00 3.98 0.00 0.00 57.97 61.72 1r8b h PHE 185 Cb 1.28 0.10 -0.03 0.00 2.56 0.00 0.00 35.95 39.86 1r8b h PHE 185 CO 0.32 -0.13 0.27 1.25 -2.02 0.00 0.00 178.31 178.00 1r8b h LEU 186 N -0.10 0.43 -1.03 0.59 5.85 -1.96 -0.08 115.31 119.02 1r8b h LEU 186 Ca 0.07 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.70 1r8b h LEU 186 Cb 0.19 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 1r8b h LEU 186 CO -0.16 0.31 -0.25 -0.33 -0.34 0.00 0.00 178.44 177.67 1r8b h GLU 187 N 0.54 0.39 -0.04 1.25 4.39 -1.85 -0.01 114.58 119.25 1r8b h GLU 187 Ca 0.18 -0.14 -0.00 0.00 0.34 0.00 0.00 59.36 59.74 1r8b h GLU 187 Cb 0.01 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.63 1r8b h GLU 187 CO -0.08 0.62 0.02 1.15 -1.16 0.00 0.00 179.01 179.56 1r8b h THR 188 N 0.35 1.09 -0.52 1.13 2.02 -0.64 -1.96 112.91 114.39 1r8b h THR 188 Ca 0.05 -0.27 -0.01 0.00 0.77 0.00 0.00 66.41 66.96 1r8b h THR 188 Cb 0.63 1.20 -0.02 0.00 -1.74 0.00 0.00 68.15 68.22 1r8b h THR 188 CO 0.05 0.07 0.30 0.58 0.37 0.00 0.00 175.52 176.89 1r8b h VAL 189 N -0.05 1.16 -0.91 3.16 2.07 -0.79 -0.58 116.25 120.32 1r8b h VAL 189 Ca 0.01 -0.39 0.01 0.00 0.82 0.00 0.00 66.70 67.16 1r8b h VAL 189 Cb 0.10 0.49 -0.05 0.00 -1.52 0.00 0.00 31.29 30.32 1r8b h VAL 189 CO -0.00 0.17 0.60 0.11 0.02 0.00 0.00 177.57 178.47 1r8b h LYS 190 N 0.69 1.19 0.00 1.57 1.57 -0.91 -3.08 116.57 117.60 1r8b h LYS 190 Ca 0.18 -0.07 -0.19 0.00 -1.87 0.00 0.00 60.65 58.70 1r8b h LYS 190 Cb 0.01 -0.27 -0.03 0.00 0.08 0.00 0.00 32.23 32.02 1r8b h LYS 190 CO -0.03 0.79 -1.06 -0.91 -0.57 0.00 0.00 179.45 177.66 1r8b h ASN 191 N 1.22 0.00 1.02 0.86 2.35 -1.11 -3.24 115.58 116.69 1r8b h ASN 191 Ca 0.33 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.08 1r8b h ASN 191 Cb -0.14 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.23 1r8b h ASN 191 CO -0.07 0.82 0.00 0.00 -1.65 0.00 0.00 177.43 176.52 1r8b h ALA 192 N 1.18 1.00 -0.20 -0.83 0.00 -1.02 -2.39 119.26 117.00 1r8b h ALA 192 Ca -0.08 0.00 0.06 0.00 0.00 0.00 0.00 54.91 54.89 1r8b h ALA 192 Cb 1.69 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.47 1r8b h ALA 192 CO 0.09 0.00 0.32 0.00 0.00 0.00 0.00 179.25 179.67 1r8b h ARG 193 N 0.00 0.00 -0.27 0.00 3.08 -1.57 -1.97 114.38 113.65 1r8b h ARG 193 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1r8b h ARG 193 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.56 1r8b h ARG 193 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 179.97 179.44 1r8b n ARG 194 N -3.45 2.37 -1.99 0.04 1.74 -0.90 -4.97 116.66 109.50 1r8b n ARG 194 Ca 0.02 -1.85 -0.36 0.00 -0.77 0.00 0.00 57.85 54.89 1r8b n ARG 194 Cb 0.44 -1.25 0.03 0.00 -1.02 0.00 0.00 32.46 30.66 1r8b n ARG 194 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1r8b s TRP 195 N -0.98 2.39 0.37 -1.55 0.51 -0.74 -5.05 118.94 113.89 1r8b s TRP 195 Ca 0.21 1.50 0.03 0.00 -2.12 0.00 0.00 56.10 55.72 1r8b s TRP 195 Cb 0.11 -3.53 -0.04 0.00 -0.81 0.00 0.00 33.47 29.21 1r8b s TRP 195 CO 0.15 -2.29 0.09 0.95 -0.51 0.00 0.00 176.95 175.34 1r8b s THR 196 N -1.54 0.89 -1.77 2.01 -4.23 -1.26 -5.02 115.64 104.72 1r8b s THR 196 Ca 0.76 -2.00 0.20 0.00 -1.18 0.00 0.00 61.69 59.47 1r8b s THR 196 Cb -0.32 -2.55 0.48 0.00 1.34 0.00 0.00 72.50 71.44 1r8b s THR 196 CO 0.35 0.00 1.59 -2.11 -0.54 0.00 0.00 174.62 173.91 1r8b n ARG 197 N -0.80 0.49 -0.14 3.99 1.85 -1.26 -2.04 116.66 118.74 1r8b n ARG 197 Ca -0.05 0.04 0.05 0.00 -1.00 0.00 0.00 57.85 56.90 1r8b n ARG 197 Cb 0.66 -1.50 0.13 0.00 -1.05 0.00 0.00 32.46 30.70 1r8b n ARG 197 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1r8b n ARG 198 N -1.11 2.54 -2.39 2.89 1.74 -1.26 -1.00 116.66 118.05 1r8b n ARG 198 Ca 0.13 -1.89 -0.42 0.00 -0.77 0.00 0.00 57.85 54.90 1r8b n ARG 198 Cb 0.10 -1.24 -0.03 0.00 -1.02 0.00 0.00 32.46 30.27 1r8b n ARG 198 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1r8b s THR 199 N -0.98 3.95 -0.23 0.55 2.01 -0.86 -0.10 115.64 119.97 1r8b s THR 199 Ca 0.20 1.40 -0.01 0.00 0.31 0.00 0.00 61.69 63.60 1r8b s THR 199 Cb 0.11 -3.90 0.03 0.00 0.01 0.00 0.00 72.50 68.75 1r8b s THR 199 CO 0.14 0.11 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.40 1r8b s VAL 200 N 1.05 2.66 -0.34 3.82 1.01 -0.10 -1.61 120.40 126.87 1r8b s VAL 200 Ca 0.59 -1.05 -0.11 0.00 0.00 0.00 0.00 61.98 61.40 1r8b s VAL 200 Cb -0.30 -2.32 -0.00 0.00 0.00 0.00 0.00 36.38 33.75 1r8b s VAL 200 CO 0.29 0.25 0.21 -0.63 0.00 0.00 0.00 175.10 175.22 1r8b s ILE 201 N 1.30 4.88 -0.59 2.22 1.01 0.30 -0.97 121.20 129.35 1r8b s ILE 201 Ca 0.00 -0.46 -0.05 0.00 0.00 0.00 0.00 60.65 60.14 1r8b s ILE 201 Cb -0.16 -3.56 0.15 0.00 0.01 0.00 0.00 42.46 38.90 1r8b s ILE 201 CO -0.06 -0.05 0.43 -0.62 0.00 0.00 0.00 174.94 174.63 1r8b s ASP 202 N 1.64 5.51 0.15 3.58 -1.08 0.81 -0.89 116.67 126.39 1r8b s ASP 202 Ca 0.05 -2.54 -0.16 0.00 -0.52 0.00 0.00 52.55 49.37 1r8b s ASP 202 Cb -0.18 -1.92 0.01 0.00 -1.46 0.00 0.00 42.92 39.37 1r8b s ASP 202 CO 0.08 -0.48 1.76 0.58 0.52 0.00 0.00 175.17 177.63 1r8b h VAL 203 N 5.53 1.15 0.00 1.11 2.07 -1.80 -1.33 116.25 122.99 1r8b h VAL 203 Ca -0.05 -0.37 -0.08 0.00 0.82 0.00 0.00 66.70 67.02 1r8b h VAL 203 Cb 1.00 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 1r8b h VAL 203 CO 0.74 0.15 -0.36 0.00 0.02 0.00 0.00 177.57 178.12 1r8b h ALA 204 N 1.09 1.02 -0.02 1.67 0.00 -1.91 -2.55 119.26 118.56 1r8b h ALA 204 Ca 0.15 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1r8b h ALA 204 Cb 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1r8b h ALA 204 CO -0.02 0.45 -0.14 1.63 0.00 0.00 0.00 179.25 181.17 1r8b n LYS 205 N -3.55 1.52 -2.75 0.00 5.02 -0.84 -4.95 118.16 112.62 1r8b n LYS 205 Ca -0.00 -1.05 -0.22 0.00 -2.02 0.00 0.00 58.31 55.02 1r8b n LYS 205 Cb 0.49 -1.48 0.02 0.00 -0.02 0.00 0.00 35.03 34.04 1r8b n LYS 205 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1r8b n GLY 206 N 1.29 -0.51 3.15 0.72 0.00 -0.56 -4.96 105.19 104.31 1r8b n GLY 206 Ca 0.15 0.07 -0.21 0.00 0.00 0.00 0.00 46.02 46.03 1r8b n GLY 206 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1r8b s GLU 207 N -5.42 1.04 -0.05 1.61 2.12 -0.91 -5.03 118.70 112.05 1r8b s GLU 207 Ca 0.17 -0.72 0.06 0.00 0.36 0.00 0.00 54.97 54.84 1r8b s GLU 207 Cb -0.07 -1.05 -0.01 0.00 0.26 0.00 0.00 34.13 33.26 1r8b s GLU 207 CO 0.21 0.27 -0.23 0.08 -0.54 0.00 0.00 175.26 175.04 1r8b s VAL 208 N -0.72 1.92 0.22 3.70 1.01 -1.26 -0.13 120.40 125.13 1r8b s VAL 208 Ca 0.03 -0.99 -0.02 0.00 0.00 0.00 0.00 61.98 61.00 1r8b s VAL 208 Cb -0.07 -1.63 0.01 0.00 0.00 0.00 0.00 36.38 34.69 1r8b s VAL 208 CO 0.01 0.54 0.32 -2.11 0.00 0.00 0.00 175.10 173.86 1r8b n ARG 209 N 2.99 0.46 -3.98 2.72 1.85 -0.14 -4.99 116.66 115.57 1r8b n ARG 209 Ca -0.18 -1.71 -0.34 0.00 -1.00 0.00 0.00 57.85 54.63 1r8b n ARG 209 Cb 0.52 1.68 -0.06 0.00 -1.05 0.00 0.00 32.46 33.56 1r8b n ARG 209 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1r8b s LYS 210 N -2.46 3.31 0.00 2.89 1.02 -1.26 -0.93 119.74 122.31 1r8b s LYS 210 Ca 0.17 -0.35 0.00 0.00 0.02 0.00 0.00 55.97 55.81 1r8b s LYS 210 Cb -0.01 -3.03 0.00 0.00 -0.52 0.00 0.00 37.83 34.28 1r8b s LYS 210 CO 0.12 0.68 0.00 0.41 -0.92 0.00 0.00 175.35 175.65 1r8b n GLY 211 N 1.21 4.99 0.07 -3.33 0.00 0.86 -4.85 105.19 104.14 1r8b n GLY 211 Ca -0.13 -1.23 -0.08 0.00 0.00 0.00 0.00 46.02 44.58 1r8b n GLY 211 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1r8b h GLU 212 N 0.00 0.00 -4.14 1.61 4.39 -1.92 -3.44 114.58 111.08 1r8b h GLU 212 Ca 0.00 -0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.55 1r8b h GLU 212 Cb 0.00 0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 28.53 1r8b h GLU 212 CO 0.00 0.72 -0.38 -1.21 -1.16 0.00 0.00 179.01 176.98 1r8b s GLU 213 N -2.65 1.36 0.06 2.33 8.01 -1.26 -4.78 118.70 121.78 1r8b s GLU 213 Ca -0.02 -1.45 -0.31 0.00 0.01 0.00 0.00 54.97 53.20 1r8b s GLU 213 Cb 0.09 0.37 -0.08 0.00 -4.31 0.00 0.00 34.13 30.19 1r8b s GLU 213 CO 0.82 -0.51 1.67 0.12 0.01 0.00 0.00 175.26 177.37 1r8b s PHE 214 N -4.09 2.35 -0.10 1.61 5.36 -0.17 -4.41 117.98 118.53 1r8b s PHE 214 Ca 0.31 0.28 -0.04 0.00 -0.96 0.00 0.00 56.93 56.52 1r8b s PHE 214 Cb 0.03 -3.98 0.05 0.00 -0.34 0.00 0.00 43.02 38.79 1r8b s PHE 214 CO 0.11 -3.94 0.20 0.12 -1.46 0.00 0.00 175.22 170.24 1r8b s PHE 215 N 2.78 -0.27 -0.35 10.12 5.36 -0.64 -4.90 117.98 130.08 1r8b s PHE 215 Ca 0.74 0.73 -0.08 0.00 -0.96 0.00 0.00 56.93 57.37 1r8b s PHE 215 Cb -0.40 -0.15 0.03 0.00 -0.34 0.00 0.00 43.02 42.17 1r8b s PHE 215 CO 0.32 -0.29 0.14 0.08 -1.46 0.00 0.00 175.22 174.02 1r8b s VAL 216 N 2.15 4.07 -0.20 3.12 1.01 -1.26 -0.54 120.40 128.74 1r8b s VAL 216 Ca 0.00 -1.02 -0.29 0.00 0.00 0.00 0.00 61.98 60.67 1r8b s VAL 216 Cb -0.12 -3.28 -0.01 0.00 0.00 0.00 0.00 36.38 32.97 1r8b s VAL 216 CO -0.07 -0.19 1.21 -0.69 0.00 0.00 0.00 175.10 175.36 1r8b s VAL 217 N 1.46 4.36 0.04 2.92 1.01 -0.06 -0.59 120.40 129.53 1r8b s VAL 217 Ca -0.00 1.63 -0.31 0.00 0.00 0.00 0.00 61.98 63.29 1r8b s VAL 217 Cb -0.19 -4.10 -0.10 0.00 0.00 0.00 0.00 36.38 31.98 1r8b s VAL 217 CO 0.04 -0.20 1.92 -0.67 0.00 0.00 0.00 175.10 176.19 1r8b n ASP 218 N 6.69 3.99 0.09 3.32 -0.08 -0.65 -4.04 116.55 125.87 1r8b n ASP 218 Ca 0.14 0.94 0.07 0.00 -1.51 0.00 0.00 54.79 54.42 1r8b n ASP 218 Cb 0.45 -1.50 0.36 0.00 2.34 0.00 0.00 41.12 42.77 1r8b n ASP 218 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1r8b n PRO 219 N 6.84 0.09 -0.00 -0.67 -0.04 -1.26 -1.93 135.00 138.03 1r8b n PRO 219 Ca 0.20 0.55 0.10 0.00 -0.04 0.00 0.00 63.50 64.31 1r8b n PRO 219 Cb 0.38 -1.76 -0.11 0.00 -0.04 0.00 0.00 33.50 31.96 1r8b n PRO 219 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 1r8b n VAL 220 N -1.94 0.01 -3.15 0.52 3.14 -1.26 -4.85 118.33 110.80 1r8b n VAL 220 Ca -0.00 -0.15 0.05 0.00 -2.96 0.00 0.00 64.34 61.27 1r8b n VAL 220 Cb 0.05 0.66 -0.00 0.00 -1.06 0.00 0.00 33.84 33.49 1r8b n VAL 220 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1r8b s ASP 221 N -3.47 -1.11 0.60 6.55 -1.08 -0.81 -4.90 116.67 112.45 1r8b s ASP 221 Ca 0.04 0.21 0.33 0.00 -0.52 0.00 0.00 52.55 52.60 1r8b s ASP 221 Cb 0.15 1.74 1.89 0.00 -1.46 0.00 0.00 42.92 45.24 1r8b s ASP 221 CO 0.87 -0.20 2.24 1.05 0.52 0.00 0.00 175.17 179.65 1r8b h GLU 222 N 7.74 0.00 0.00 4.34 4.11 -1.89 -1.24 114.58 127.64 1r8b h GLU 222 Ca -0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.36 1r8b h GLU 222 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1r8b h GLU 222 CO 0.06 0.02 0.00 1.63 0.07 0.00 0.00 179.01 180.79 1r8b n LYS 223 N -3.59 0.22 -3.29 1.06 4.76 -1.26 -4.71 118.16 111.35 1r8b n LYS 223 Ca -0.03 0.31 -0.39 0.00 -2.87 0.00 0.00 58.31 55.33 1r8b n LYS 223 Cb 0.12 -1.83 -0.07 0.00 -1.84 0.00 0.00 35.03 31.41 1r8b n LYS 223 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 1r8b s ARG 224 N -3.20 4.12 -0.57 1.97 6.06 -0.47 -5.02 118.95 121.85 1r8b s ARG 224 Ca 0.08 0.29 -0.22 0.00 -2.50 0.00 0.00 55.73 53.37 1r8b s ARG 224 Cb 0.11 -3.60 0.05 0.00 0.06 0.00 0.00 34.95 31.58 1r8b s ARG 224 CO 0.49 -0.21 0.86 1.21 -2.50 0.00 0.00 175.30 175.16 1r8b s ASN 225 N 1.32 6.27 0.57 -2.12 2.47 -1.26 -1.63 114.94 120.55 1r8b s ASN 225 Ca 0.21 -0.68 0.27 0.00 0.42 0.00 0.00 52.86 53.07 1r8b s ASN 225 Cb -0.15 -2.39 1.54 0.00 -1.45 0.00 0.00 41.25 38.80 1r8b s ASN 225 CO 0.09 -1.19 2.07 0.58 -3.72 0.00 0.00 177.10 174.92 1r8b h VAL 226 N 5.97 0.58 -0.62 -5.21 2.07 -1.20 -0.73 116.25 117.11 1r8b h VAL 226 Ca -0.27 0.00 -0.18 0.00 0.82 0.00 0.00 66.70 67.07 1r8b h VAL 226 Cb 1.08 0.82 -0.11 0.00 -1.52 0.00 0.00 31.29 31.56 1r8b h VAL 226 CO 1.08 0.00 0.23 0.00 0.02 0.00 0.00 177.57 178.90 1r8b n ALA 227 N -2.43 4.24 -0.13 1.67 0.00 -1.26 -4.62 120.51 117.98 1r8b n ALA 227 Ca 0.03 -1.91 0.10 0.00 0.00 0.00 0.00 53.44 51.66 1r8b n ALA 227 Cb 0.39 -1.22 0.44 0.00 0.00 0.00 0.00 19.45 19.06 1r8b n ALA 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1r8b h ALA 228 N 2.61 1.90 -0.02 0.00 0.00 -1.47 -1.63 119.26 120.64 1r8b h ALA 228 Ca 0.22 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1r8b h ALA 228 Cb 2.07 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.74 1r8b h ALA 228 CO 0.62 -0.03 -0.07 0.09 0.00 0.00 0.00 179.25 179.85 1r8b n ASN 229 N -4.48 2.06 -4.66 0.00 4.13 -1.26 -4.88 115.26 106.17 1r8b n ASN 229 Ca 0.11 -1.62 -0.43 0.00 1.68 0.00 0.00 54.58 54.32 1r8b n ASN 229 Cb 0.33 0.06 -0.02 0.00 -1.54 0.00 0.00 39.78 38.61 1r8b n ASN 229 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1r8b s LEU 230 N -2.10 4.23 0.64 3.41 2.96 -0.61 -4.12 118.68 123.09 1r8b s LEU 230 Ca 0.31 1.90 -0.14 0.00 -0.22 0.00 0.00 54.13 55.98 1r8b s LEU 230 Cb 0.20 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.34 1r8b s LEU 230 CO 0.36 -0.83 1.06 -0.94 -1.32 0.00 0.00 176.35 174.69 1r8b s SER 231 N 2.53 5.54 0.23 3.68 1.04 -0.49 -4.87 113.70 121.38 1r8b s SER 231 Ca 0.62 1.78 -0.06 0.00 0.48 0.00 0.00 55.95 58.78 1r8b s SER 231 Cb -0.26 -2.52 0.39 0.00 0.10 0.00 0.00 66.02 63.73 1r8b s SER 231 CO 0.21 -1.33 1.76 0.25 0.98 0.00 0.00 173.24 175.10 1r8b h LEU 232 N 0.01 0.40 -0.75 2.42 5.85 -1.94 -0.86 115.31 120.44 1r8b h LEU 232 Ca -0.46 0.08 -0.13 0.00 0.84 0.00 0.00 57.88 58.21 1r8b h LEU 232 Cb 1.22 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.26 1r8b h LEU 232 CO 0.57 0.20 -0.58 0.44 -0.34 0.00 0.00 178.44 178.73 1r8b h ASP 233 N 0.54 0.17 0.61 1.25 3.32 -1.96 -0.38 116.42 119.98 1r8b h ASP 233 Ca 0.38 -0.09 -0.15 0.00 0.02 0.00 0.00 57.03 57.18 1r8b h ASP 233 Cb 0.48 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.96 1r8b h ASP 233 CO -0.32 0.71 -0.70 0.78 -1.72 0.00 0.00 179.24 177.99 1r8b h ASN 234 N 0.11 0.08 -0.09 6.45 2.35 -1.70 -0.14 115.58 122.64 1r8b h ASN 234 Ca -0.00 -0.06 -0.01 0.00 -0.55 0.00 0.00 56.30 55.68 1r8b h ASN 234 Cb 1.05 -0.02 -0.00 0.00 0.05 0.00 0.00 38.32 39.39 1r8b h ASN 234 CO 0.08 0.75 0.04 0.25 -1.65 0.00 0.00 177.43 176.90 1r8b h LEU 235 N 0.05 0.13 -0.57 1.61 5.85 -0.95 -1.50 115.31 119.92 1r8b h LEU 235 Ca -0.01 -0.17 0.07 0.00 0.84 0.00 0.00 57.88 58.61 1r8b h LEU 235 Cb 1.23 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 42.17 1r8b h LEU 235 CO 0.10 0.26 0.25 0.00 -0.34 0.00 0.00 178.44 178.71 1r8b h ALA 236 N 0.87 0.73 -0.36 1.25 0.00 -0.88 -1.26 119.26 119.61 1r8b h ALA 236 Ca 0.03 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1r8b h ALA 236 Cb 0.17 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1r8b h ALA 236 CO -0.00 -0.13 -0.17 0.00 0.00 0.00 0.00 179.25 178.95 1r8b h ARG 237 N 0.47 0.68 -0.38 0.00 3.08 -0.90 -1.81 114.38 115.52 1r8b h ARG 237 Ca 0.27 -0.24 -0.13 0.00 0.07 0.00 0.00 59.98 59.94 1r8b h ARG 237 Cb 0.25 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 1r8b h ARG 237 CO -0.23 0.81 -0.29 0.35 -1.07 0.00 0.00 179.97 179.55 1r8b h PHE 238 N 0.61 1.02 -0.75 3.04 3.57 -0.73 0.11 116.94 123.81 1r8b h PHE 238 Ca 0.10 -0.28 -0.02 0.00 3.53 0.00 0.00 57.97 61.30 1r8b h PHE 238 Cb 0.64 -0.22 -0.04 0.00 2.79 0.00 0.00 35.95 39.12 1r8b h PHE 238 CO 0.03 1.08 0.41 0.28 -2.23 0.00 0.00 178.31 177.87 1r8b h VAL 239 N 0.67 1.23 -0.38 1.41 2.07 -0.84 -0.88 116.25 119.52 1r8b h VAL 239 Ca 0.07 -0.58 -0.11 0.00 0.82 0.00 0.00 66.70 66.90 1r8b h VAL 239 Cb 0.86 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 1r8b h VAL 239 CO 0.08 0.25 -0.20 -0.74 0.02 0.00 0.00 177.57 176.98 1r8b h HIS 240 N 1.03 0.94 -0.87 1.57 -0.00 -1.14 -2.32 115.15 114.36 1r8b h HIS 240 Ca 0.26 -0.24 0.01 0.00 -0.00 0.00 0.00 60.37 60.40 1r8b h HIS 240 Cb 0.04 -0.22 -0.04 0.00 -0.00 0.00 0.00 27.41 27.19 1r8b h HIS 240 CO 0.00 1.00 0.57 -0.07 -0.00 0.00 0.00 177.93 179.43 1r8b h LEU 241 N 0.62 0.99 -0.67 0.26 3.38 -0.66 -0.63 115.31 118.60 1r8b h LEU 241 Ca 0.08 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 1r8b h LEU 241 Cb 0.76 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 1r8b h LEU 241 CO 0.06 0.72 0.19 0.00 0.09 0.00 0.00 178.44 179.49 1r8b h ARG 243 N 0.99 0.76 -0.39 0.00 3.08 -0.99 -2.37 114.38 115.45 1r8b h ARG 243 Ca 0.21 -0.24 -0.07 0.00 0.07 0.00 0.00 59.98 59.95 1r8b h ARG 243 Cb 0.33 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 1r8b h ARG 243 CO -0.00 0.83 -0.04 0.93 -1.07 0.00 0.00 179.97 180.62 1r8b h GLU 244 N 0.61 0.72 -0.32 0.04 5.08 -0.90 -2.42 114.58 117.39 1r8b h GLU 244 Ca 0.13 -0.25 0.03 0.00 -1.00 0.00 0.00 59.36 58.26 1r8b h GLU 244 Cb 0.47 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.64 1r8b h GLU 244 CO 0.02 0.83 0.14 0.35 -1.00 0.00 0.00 179.01 179.35 1r8b h PHE 245 N 0.54 0.26 0.00 4.33 3.57 -0.82 -1.90 116.94 122.92 1r8b h PHE 245 Ca 0.11 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.54 1r8b h PHE 245 Cb 0.53 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.19 1r8b h PHE 245 CO 0.04 0.13 -0.39 0.52 -2.23 0.00 0.00 178.31 176.38 1r8b h MET 246 N 0.30 0.00 0.00 1.11 2.86 -1.37 -0.34 114.93 117.49 1r8b h MET 246 Ca 0.14 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.59 1r8b h MET 246 Cb 0.07 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.71 1r8b h MET 246 CO -0.11 0.39 -0.85 0.93 1.06 0.00 0.00 176.91 178.33 1r8b h GLU 247 N 0.00 0.11 -1.31 1.72 5.08 -1.00 -3.40 114.58 115.77 1r8b h GLU 247 Ca -0.00 -0.12 -0.24 0.00 -1.00 0.00 0.00 59.36 57.99 1r8b h GLU 247 Cb 0.71 0.03 -0.21 0.00 0.50 0.00 0.00 28.75 29.78 1r8b h GLU 247 CO 0.05 0.89 -0.60 0.00 -1.00 0.00 0.00 179.01 178.35 1r8b s ALA 248 N -3.18 -1.35 0.53 3.43 0.00 -0.75 -5.11 121.76 115.33 1r8b s ALA 248 Ca -0.02 -0.82 -0.21 0.00 0.00 0.00 0.00 51.96 50.91 1r8b s ALA 248 Cb 0.11 -2.47 -0.05 0.00 0.00 0.00 0.00 23.12 20.71 1r8b s ALA 248 CO 0.81 -2.18 1.21 -2.14 0.00 0.00 0.00 175.76 173.46 1r8b s PRO 249 N 0.78 3.33 -0.02 0.00 0.02 -0.15 -4.69 135.00 134.27 1r8b s PRO 249 Ca 0.29 1.85 -0.30 0.00 0.02 0.00 0.00 61.00 62.87 1r8b s PRO 249 Cb 0.00 -2.17 0.07 0.00 0.02 0.00 0.00 34.50 32.42 1r8b s PRO 249 CO -0.08 -0.92 0.68 0.45 -0.33 0.00 0.00 177.00 176.79 1r8b s SER 250 N -1.42 -0.64 0.50 2.53 0.15 -1.26 -4.36 113.70 109.20 1r8b s SER 250 Ca 0.71 0.61 0.23 0.00 0.70 0.00 0.00 55.95 58.20 1r8b s SER 250 Cb -0.31 0.54 1.32 0.00 -1.71 0.00 0.00 66.02 65.86 1r8b s SER 250 CO 0.35 -0.65 2.05 0.25 1.20 0.00 0.00 173.24 176.44 1r8b h LEU 251 N 2.84 0.00 -1.97 3.45 5.85 -1.95 -2.99 115.31 120.54 1r8b h LEU 251 Ca -0.28 0.00 0.27 0.00 0.84 0.00 0.00 57.88 58.71 1r8b h LEU 251 Cb 1.16 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.16 1r8b h LEU 251 CO 0.39 0.14 0.67 1.23 -0.34 0.00 0.00 178.44 180.53 1r8b h GLY 252 N 0.74 0.05 2.00 3.75 0.00 -1.95 -1.01 103.07 106.64 1r8b h GLY 252 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1r8b h GLY 252 CO 0.02 -0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.25 1r8b n PHE 253 N -4.27 0.53 0.34 5.60 3.01 -1.13 -2.37 117.46 119.18 1r8b n PHE 253 Ca 0.20 0.19 0.08 0.00 1.01 0.00 0.00 57.45 58.93 1r8b n PHE 253 Cb 0.99 -0.81 0.12 0.00 -0.01 0.00 0.00 39.48 39.77 1r8b n PHE 253 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 1r8b n PHE 254 N -1.97 0.23 -4.71 1.38 3.01 -0.39 -4.61 117.46 110.41 1r8b n PHE 254 Ca 0.03 -0.17 -0.33 0.00 1.01 0.00 0.00 57.45 57.99 1r8b n PHE 254 Cb 0.25 -0.01 -0.14 0.00 -0.01 0.00 0.00 39.48 39.58 1r8b n PHE 254 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1r8b s LYS 255 N -1.21 3.41 0.41 -1.08 1.02 -1.00 -4.74 119.74 116.54 1r8b s LYS 255 Ca 0.24 -0.67 -0.26 0.00 0.02 0.00 0.00 55.97 55.29 1r8b s LYS 255 Cb 0.15 -2.67 -0.09 0.00 -0.52 0.00 0.00 37.83 34.70 1r8b s LYS 255 CO 0.21 0.20 1.37 -1.25 -0.92 0.00 0.00 175.35 174.96 1r8b s PRO 256 N 0.40 3.94 0.13 -1.68 0.04 -1.26 -4.89 135.00 131.68 1r8b s PRO 256 Ca -0.10 2.31 -0.31 0.00 0.04 0.00 0.00 61.00 62.94 1r8b s PRO 256 Cb -0.16 -2.79 -0.09 0.00 0.04 0.00 0.00 34.50 31.50 1r8b s PRO 256 CO 0.05 -0.57 1.61 0.15 0.04 0.00 0.00 177.00 178.28 1r8b s LYS 257 N -2.24 4.20 -0.11 4.56 1.02 -1.26 -4.97 119.74 120.94 1r8b s LYS 257 Ca 0.57 2.36 -0.30 0.00 0.02 0.00 0.00 55.97 58.63 1r8b s LYS 257 Cb -0.41 -3.33 -0.02 0.00 -0.52 0.00 0.00 37.83 33.54 1r8b s LYS 257 CO 0.54 -0.67 1.23 -3.38 -0.92 0.00 0.00 175.35 172.15 1r8b s HIS 258 N 1.75 3.02 0.96 3.18 -3.43 -1.26 -4.98 115.29 114.53 1r8b s HIS 258 Ca 0.72 1.11 -0.11 0.00 -0.80 0.00 0.00 55.06 55.99 1r8b s HIS 258 Cb -0.43 -3.46 0.17 0.00 -1.43 0.00 0.00 32.58 27.44 1r8b s HIS 258 CO 0.32 -1.50 1.12 -1.25 -2.00 0.00 0.00 174.74 171.43 1r8b s PRO 259 N 2.84 0.63 0.50 -0.38 0.04 -1.26 -4.89 135.00 132.47 1r8b s PRO 259 Ca 0.55 1.42 0.15 0.00 0.04 0.00 0.00 61.00 63.16 1r8b s PRO 259 Cb -0.23 -1.69 1.18 0.00 0.04 0.00 0.00 34.50 33.80 1r8b s PRO 259 CO 0.18 -2.86 2.12 1.25 0.04 0.00 0.00 177.00 177.74 1r8b h LEU 260 N -2.03 0.06 -3.51 -3.56 5.85 -1.95 -3.47 115.31 106.71 1r8b h LEU 260 Ca -0.47 -0.00 -0.58 0.00 0.84 0.00 0.00 57.88 57.68 1r8b h LEU 260 Cb 1.28 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 42.27 1r8b h LEU 260 CO 0.43 0.07 -0.99 -1.84 -0.34 0.00 0.00 178.44 175.76 1r8b n GLU 261 N -4.51 -0.59 -2.70 1.25 0.28 -1.26 -4.94 120.64 108.17 1r8b n GLU 261 Ca -0.02 0.14 -0.30 0.00 -0.16 0.00 0.00 57.16 56.81 1r8b n GLU 261 Cb 0.10 -2.96 -0.03 0.00 1.43 0.00 0.00 31.44 29.98 1r8b n GLU 261 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 1r8b s ILE 262 N -3.65 4.74 0.12 3.84 1.01 -1.26 -5.06 121.20 120.94 1r8b s ILE 262 Ca 0.41 0.72 -0.16 0.00 0.00 0.00 0.00 60.65 61.63 1r8b s ILE 262 Cb -0.21 -3.75 -0.07 0.00 0.01 0.00 0.00 42.46 38.44 1r8b s ILE 262 CO 0.96 -0.61 0.55 -1.61 0.00 0.00 0.00 174.94 174.23 1r8b s GLU 263 N -4.02 4.03 0.34 2.79 2.02 -1.26 -4.98 118.70 117.63 1r8b s GLU 263 Ca 0.53 0.55 0.13 0.00 0.02 0.00 0.00 54.97 56.20 1r8b s GLU 263 Cb -0.10 -3.02 0.99 0.00 0.10 0.00 0.00 34.13 32.09 1r8b s GLU 263 CO 0.33 0.53 1.72 -1.35 0.02 0.00 0.00 175.26 176.52 1r8b h PRO 264 N 3.86 0.47 -0.68 0.39 0.11 -1.97 -0.79 132.00 133.40 1r8b h PRO 264 Ca -0.49 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.61 1r8b h PRO 264 Cb 1.20 -0.11 -0.04 0.00 0.11 0.00 0.00 31.00 32.17 1r8b h PRO 264 CO 0.65 0.31 0.44 1.49 -0.21 0.00 0.00 178.00 180.68 1r8b h GLU 265 N 0.48 0.86 -0.41 1.05 4.57 -1.99 0.82 114.58 119.97 1r8b h GLU 265 Ca 0.65 -0.05 -0.10 0.00 -1.18 0.00 0.00 59.36 58.69 1r8b h GLU 265 Cb 1.41 -0.19 -0.02 0.00 -0.16 0.00 0.00 28.75 29.79 1r8b h GLU 265 CO -0.45 0.57 -0.14 -0.09 -1.18 0.00 0.00 179.01 177.71 1r8b h ARG 266 N 0.89 0.74 -0.49 1.92 2.43 -1.54 -2.30 114.38 116.03 1r8b h ARG 266 Ca 0.26 -0.26 -0.12 0.00 -0.81 0.00 0.00 59.98 59.05 1r8b h ARG 266 Cb -0.06 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.42 1r8b h ARG 266 CO -0.07 0.85 -0.15 1.25 -1.51 0.00 0.00 179.97 180.34 1r8b h LEU 267 N 0.67 0.95 -0.38 3.80 5.85 -1.21 -1.39 115.31 123.60 1r8b h LEU 267 Ca 0.11 -0.33 0.02 0.00 0.84 0.00 0.00 57.88 58.53 1r8b h LEU 267 Cb 0.62 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.36 1r8b h LEU 267 CO 0.04 1.09 0.20 -0.09 -0.34 0.00 0.00 178.44 179.35 1r8b h ARG 268 N 0.83 0.40 -0.42 1.25 1.12 -0.60 -0.76 114.38 116.21 1r8b h ARG 268 Ca 0.12 -0.02 -0.07 0.00 -1.11 0.00 0.00 59.98 58.90 1r8b h ARG 268 Cb 0.70 -0.09 -0.02 0.00 -0.01 0.00 0.00 29.97 30.55 1r8b h ARG 268 CO 0.05 0.27 -0.04 -0.22 -3.11 0.00 0.00 179.97 176.92 1r8b h LYS 269 N 0.42 0.69 -0.11 0.20 3.64 -1.31 -1.13 116.57 118.97 1r8b h LYS 269 Ca 0.16 -0.19 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1r8b h LYS 269 Cb 0.05 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 31.78 1r8b h LYS 269 CO -0.10 0.73 0.02 0.82 -2.27 0.00 0.00 179.45 178.65 1r8b h ILE 270 N 0.65 1.22 -0.91 2.00 2.04 -0.95 -1.44 117.51 120.12 1r8b h ILE 270 Ca 0.12 -0.70 -0.00 0.00 1.00 0.00 0.00 64.86 65.28 1r8b h ILE 270 Cb 0.46 1.47 -0.04 0.00 -0.74 0.00 0.00 36.82 37.96 1r8b h ILE 270 CO 0.02 0.20 0.56 0.58 0.00 0.00 0.00 178.15 179.51 1r8b h VAL 271 N -0.05 1.25 0.16 1.67 2.07 -1.03 -1.28 116.25 119.03 1r8b h VAL 271 Ca 0.03 -0.52 0.01 0.00 0.82 0.00 0.00 66.70 67.04 1r8b h VAL 271 Cb 0.30 -0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.01 1r8b h VAL 271 CO 0.00 0.25 -0.17 -0.08 0.02 0.00 0.00 177.57 177.59 1r8b h GLU 272 N 1.25 -0.36 -0.72 1.57 4.81 -1.15 -1.36 114.58 118.62 1r8b h GLU 272 Ca 0.33 0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.60 1r8b h GLU 272 Cb -0.07 0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.35 1r8b h GLU 272 CO -0.06 -0.24 0.47 1.49 -0.73 0.00 0.00 179.01 179.94 1r8b h GLU 273 N -0.37 0.90 0.00 1.92 4.81 -0.96 -2.64 114.58 118.24 1r8b h GLU 273 Ca 0.01 -0.05 -0.13 0.00 -0.13 0.00 0.00 59.36 59.05 1r8b h GLU 273 Cb 0.36 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.51 1r8b h GLU 273 CO -0.05 0.59 -0.63 0.00 -0.73 0.00 0.00 179.01 178.19 1r8b h ARG 274 N 0.93 0.00 -0.59 1.92 3.08 -1.06 -3.47 114.38 115.18 1r8b h ARG 274 Ca 0.27 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 60.15 1r8b h ARG 274 Cb -0.04 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 29.95 1r8b h ARG 274 CO -0.07 0.63 -0.17 0.41 -1.07 0.00 0.00 179.97 179.70 1r8b n GLY 275 N 0.48 0.82 3.97 0.04 0.00 -0.53 -5.03 105.19 104.95 1r8b n GLY 275 Ca -0.01 -0.62 -0.21 0.00 0.00 0.00 0.00 46.02 45.18 1r8b n GLY 275 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1r8b s THR 276 N -2.34 2.58 -0.25 2.61 -4.23 -1.24 -4.84 115.64 107.92 1r8b s THR 276 Ca 0.00 -0.65 -0.12 0.00 -1.18 0.00 0.00 61.69 59.75 1r8b s THR 276 Cb 0.00 -2.93 -0.05 0.00 1.34 0.00 0.00 72.50 70.86 1r8b s THR 276 CO 0.00 0.00 0.21 0.00 -0.54 0.00 0.00 174.62 174.29 1r8b s ALA 277 N -2.82 3.57 -0.12 3.99 0.00 -0.67 -4.93 121.76 120.78 1r8b s ALA 277 Ca 0.59 -0.92 0.03 0.00 0.00 0.00 0.00 51.96 51.65 1r8b s ALA 277 Cb -0.10 -2.44 0.00 0.00 0.00 0.00 0.00 23.12 20.59 1r8b s ALA 277 CO 0.39 -0.37 -0.22 0.08 0.00 0.00 0.00 175.76 175.64 1r8b s VAL 278 N 1.42 2.16 0.23 0.00 1.01 -1.26 -0.17 120.40 123.80 1r8b s VAL 278 Ca 0.09 -0.96 -0.19 0.00 0.00 0.00 0.00 61.98 60.91 1r8b s VAL 278 Cb -0.15 -1.85 0.03 0.00 0.00 0.00 0.00 36.38 34.41 1r8b s VAL 278 CO 0.08 0.55 0.62 0.72 0.00 0.00 0.00 175.10 177.06 1r8b s PHE 279 N 0.57 -0.15 0.03 5.22 -0.12 -0.76 -4.15 117.98 118.62 1r8b s PHE 279 Ca -0.13 -0.23 0.02 0.00 -0.05 0.00 0.00 56.93 56.54 1r8b s PHE 279 Cb -0.17 0.53 -0.02 0.00 -0.63 0.00 0.00 43.02 42.74 1r8b s PHE 279 CO 0.04 -1.06 -0.06 0.00 -0.05 0.00 0.00 175.22 174.08 1r8b s ALA 280 N -3.89 0.46 -0.31 1.99 0.00 0.15 -0.77 121.76 119.38 1r8b s ALA 280 Ca 0.10 -0.63 -0.21 0.00 0.00 0.00 0.00 51.96 51.22 1r8b s ALA 280 Cb -0.03 0.04 -0.01 0.00 0.00 0.00 0.00 23.12 23.12 1r8b s ALA 280 CO 0.02 -0.03 0.67 0.08 0.00 0.00 0.00 175.76 176.50 1r8b s VAL 281 N -1.17 4.89 -0.15 0.00 1.01 0.06 -0.23 120.40 124.81 1r8b s VAL 281 Ca -0.09 0.90 -0.05 0.00 0.00 0.00 0.00 61.98 62.74 1r8b s VAL 281 Cb -0.09 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.21 1r8b s VAL 281 CO 0.00 -0.19 0.03 -0.75 0.00 0.00 0.00 175.10 174.19 1r8b s LYS 282 N 2.71 3.63 0.17 2.72 2.20 0.29 -1.56 119.74 129.91 1r8b s LYS 282 Ca 0.27 -0.38 -0.20 0.00 -0.36 0.00 0.00 55.97 55.30 1r8b s LYS 282 Cb -0.15 -3.05 0.05 0.00 -1.51 0.00 0.00 37.83 33.17 1r8b s LYS 282 CO 0.12 0.41 0.54 -0.59 -0.36 0.00 0.00 175.35 175.48 1r8b s PHE 283 N -0.05 -0.33 0.22 4.03 -0.12 -0.78 -1.42 117.98 119.52 1r8b s PHE 283 Ca 0.05 0.04 -0.30 0.00 -0.05 0.00 0.00 56.93 56.67 1r8b s PHE 283 Cb -0.12 0.46 -0.09 0.00 -0.63 0.00 0.00 43.02 42.64 1r8b s PHE 283 CO 0.01 -0.86 1.33 1.03 -0.05 0.00 0.00 175.22 176.68 1r8b s ARG 284 N -3.81 4.37 -0.06 1.99 0.52 -1.26 -0.06 118.95 120.63 1r8b s ARG 284 Ca 0.04 2.11 -0.30 0.00 -0.52 0.00 0.00 55.73 57.06 1r8b s ARG 284 Cb -0.01 -3.17 -0.04 0.00 0.52 0.00 0.00 34.95 32.25 1r8b s ARG 284 CO -0.09 -0.27 1.46 0.21 0.02 0.00 0.00 175.30 176.63 1r8b s LYS 285 N -0.28 4.23 0.64 3.54 2.20 -0.51 -4.68 119.74 124.88 1r8b s LYS 285 Ca 0.56 1.97 -0.16 0.00 -0.36 0.00 0.00 55.97 57.99 1r8b s LYS 285 Cb -0.38 -3.78 -0.01 0.00 -1.51 0.00 0.00 37.83 32.15 1r8b s LYS 285 CO 0.40 -0.72 1.12 -1.25 -0.36 0.00 0.00 175.35 174.54 1r8b s PRO 286 N 3.31 2.91 -1.24 4.03 0.04 -1.26 -4.92 135.00 137.87 1r8b s PRO 286 Ca 0.65 1.44 -0.13 0.00 0.04 0.00 0.00 61.00 63.01 1r8b s PRO 286 Cb -0.30 -1.96 0.16 0.00 0.04 0.00 0.00 34.50 32.45 1r8b s PRO 286 CO 0.24 -1.18 1.60 -3.47 0.04 0.00 0.00 177.00 174.24 1r8b n ASP 287 N -2.19 5.14 -4.15 6.66 2.03 -1.26 -4.91 116.55 117.87 1r8b n ASP 287 Ca 0.11 -3.01 -0.10 0.00 0.52 0.00 0.00 54.79 52.31 1r8b n ASP 287 Cb 0.52 -1.56 -0.10 0.00 -0.72 0.00 0.00 41.12 39.26 1r8b n ASP 287 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 1r8b s ILE 288 N 1.42 0.42 0.72 5.18 -4.36 -1.26 -5.15 121.20 118.17 1r8b s ILE 288 Ca 0.43 -1.90 -0.12 0.00 -0.26 0.00 0.00 60.65 58.81 1r8b s ILE 288 Cb 0.02 -1.77 0.03 0.00 1.25 0.00 0.00 42.46 41.98 1r8b s ILE 288 CO 0.01 -0.77 1.08 0.68 0.24 0.00 0.00 174.94 176.18 1r8b s VAL 289 N -3.81 3.55 0.31 8.37 -7.23 -1.26 -4.67 120.40 115.67 1r8b s VAL 289 Ca 0.15 0.55 0.05 0.00 -1.81 0.00 0.00 61.98 60.92 1r8b s VAL 289 Cb 0.07 -3.11 0.30 0.00 0.56 0.00 0.00 36.38 34.20 1r8b s VAL 289 CO -0.04 -0.62 1.83 0.44 -0.31 0.00 0.00 175.10 176.41 1r8b h ASP 290 N -0.74 0.80 1.10 4.85 5.19 -1.99 0.12 116.42 125.75 1r8b h ASP 290 Ca -0.44 0.06 0.00 0.00 -0.62 0.00 0.00 57.03 56.02 1r8b h ASP 290 Cb 1.23 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 40.64 1r8b h ASP 290 CO 0.54 0.39 0.00 0.44 -3.12 0.00 0.00 179.24 177.48 1r8b h ASP 291 N 0.84 0.00 0.06 6.45 3.32 -1.98 -1.12 116.42 123.99 1r8b h ASP 291 Ca 0.50 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 57.21 1r8b h ASP 291 Cb 0.67 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.19 1r8b h ASP 291 CO -0.27 0.00 -1.90 -3.20 -1.72 0.00 0.00 179.24 172.15 1r8b n ASN 292 N -2.96 2.02 0.04 6.45 5.15 -0.59 -4.46 115.26 120.91 1r8b n ASN 292 Ca 0.01 0.24 -0.12 0.00 -0.60 0.00 0.00 54.58 54.11 1r8b n ASN 292 Cb 0.32 -0.84 -0.08 0.00 -0.53 0.00 0.00 39.78 38.66 1r8b n ASN 292 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 1r8b h LEU 293 N -0.33 -0.02 -0.44 1.20 5.85 -0.58 -3.13 115.31 117.86 1r8b h LEU 293 Ca -0.45 -0.10 -0.10 0.00 0.84 0.00 0.00 57.88 58.07 1r8b h LEU 293 Cb 1.78 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.80 1r8b h LEU 293 CO -0.06 0.09 -0.11 1.88 -0.34 0.00 0.00 178.44 179.90 1r8b h TYR 294 N -0.12 0.97 -0.62 1.25 -1.99 -1.46 -0.01 116.97 114.98 1r8b h TYR 294 Ca -0.00 -0.21 0.08 0.00 2.00 0.00 0.00 58.73 60.60 1r8b h TYR 294 Cb 0.12 -0.24 -0.04 0.00 2.00 0.00 0.00 36.73 38.57 1r8b h TYR 294 CO -0.04 0.96 0.41 -1.35 -0.00 0.00 0.00 178.16 178.14 1r8b h PRO 295 N 0.69 0.53 -0.26 4.88 0.11 -1.78 -0.42 132.00 135.76 1r8b h PRO 295 Ca 0.11 -0.03 -0.18 0.00 0.11 0.00 0.00 66.00 66.01 1r8b h PRO 295 Cb 0.65 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 31.64 1r8b h PRO 295 CO 0.04 0.35 -0.55 1.96 -0.21 0.00 0.00 178.00 179.59 1r8b h GLN 296 N 0.55 0.79 -0.27 1.05 4.20 -1.23 -1.69 115.11 118.50 1r8b h GLN 296 Ca 0.28 -0.50 -0.09 0.00 0.06 0.00 0.00 58.65 58.39 1r8b h GLN 296 Cb 0.38 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.21 1r8b h GLN 296 CO -0.08 1.13 -0.22 -0.07 -0.67 0.00 0.00 178.83 178.91 1r8b h LEU 297 N 0.60 0.51 -0.41 1.46 3.38 -0.41 0.12 115.31 120.57 1r8b h LEU 297 Ca 0.01 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.76 1r8b h LEU 297 Cb 1.15 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.74 1r8b h LEU 297 CO 0.12 0.74 0.04 -0.08 0.09 0.00 0.00 178.44 179.35 1r8b h GLU 298 N 0.46 0.70 -0.35 1.13 4.81 -0.96 -1.57 114.58 118.79 1r8b h GLU 298 Ca 0.07 -0.20 -0.09 0.00 -0.13 0.00 0.00 59.36 59.01 1r8b h GLU 298 Cb 0.64 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.94 1r8b h GLU 298 CO 0.05 0.75 -0.12 -0.09 -0.73 0.00 0.00 179.01 178.87 1r8b h ARG 299 N 0.54 0.70 -0.23 1.92 2.43 -0.78 -1.48 114.38 117.48 1r8b h ARG 299 Ca 0.12 -0.29 -0.00 0.00 -0.81 0.00 0.00 59.98 59.00 1r8b h ARG 299 Cb 0.41 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.92 1r8b h ARG 299 CO 0.01 0.88 0.13 0.00 -1.51 0.00 0.00 179.97 179.48 1r8b h ALA 300 N 0.80 0.29 -0.57 2.80 0.00 -0.65 -0.93 119.26 121.00 1r8b h ALA 300 Ca 0.08 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1r8b h ALA 300 Cb 0.65 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1r8b h ALA 300 CO 0.04 -0.19 0.05 0.66 0.00 0.00 0.00 179.25 179.80 1r8b h SER 301 N 0.27 0.91 -0.71 0.00 4.64 -1.27 -1.51 113.55 115.87 1r8b h SER 301 Ca 0.08 -0.22 -0.04 0.00 -0.47 0.00 0.00 61.79 61.14 1r8b h SER 301 Cb 0.04 -0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 61.86 1r8b h SER 301 CO -0.01 0.94 0.29 -0.09 -0.87 0.00 0.00 176.83 177.08 1r8b h ARG 302 N 0.88 1.05 -0.37 4.77 2.43 -0.95 -0.11 114.38 122.09 1r8b h ARG 302 Ca 0.17 -0.19 -0.14 0.00 -0.81 0.00 0.00 59.98 59.01 1r8b h ARG 302 Cb 0.45 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 1r8b h ARG 302 CO 0.02 0.86 -0.34 0.87 -1.51 0.00 0.00 179.97 179.87 1r8b h LYS 303 N 1.01 0.85 -0.43 0.20 1.79 -0.82 0.21 116.57 119.38 1r8b h LYS 303 Ca 0.24 -0.42 -0.15 0.00 -2.18 0.00 0.00 60.65 58.15 1r8b h LYS 303 Cb 0.20 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.84 1r8b h LYS 303 CO -0.02 1.06 -0.30 0.82 -1.08 0.00 0.00 179.45 179.93 1r8b h ILE 304 N 0.71 1.27 -0.19 1.86 2.04 -1.18 -0.70 117.51 121.32 1r8b h ILE 304 Ca 0.07 -1.47 0.03 0.00 1.00 0.00 0.00 64.86 64.49 1r8b h ILE 304 Cb 0.90 1.25 -0.03 0.00 -0.74 0.00 0.00 36.82 38.20 1r8b h ILE 304 CO 0.08 0.50 0.03 0.15 0.00 0.00 0.00 178.15 178.91 1r8b h PHE 305 N 0.81 0.05 -0.52 1.37 3.57 -0.66 -0.06 116.94 121.50 1r8b h PHE 305 Ca 0.09 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.56 1r8b h PHE 305 Cb 0.89 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.60 1r8b h PHE 305 CO 0.06 0.01 0.18 0.93 -2.23 0.00 0.00 178.31 177.27 1r8b h GLU 306 N 0.11 0.76 -0.41 1.11 5.08 -0.42 -1.26 114.58 119.55 1r8b h GLU 306 Ca 0.09 -0.12 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 1r8b h GLU 306 Cb 0.08 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 1r8b h GLU 306 CO -0.12 0.65 0.17 0.35 -1.00 0.00 0.00 179.01 179.06 1r8b h PHE 307 N 0.75 0.61 -0.75 4.33 3.57 -0.73 -1.94 116.94 122.78 1r8b h PHE 307 Ca 0.18 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.60 1r8b h PHE 307 Cb 0.19 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.71 1r8b h PHE 307 CO 0.01 0.53 0.34 -0.07 -2.23 0.00 0.00 178.31 176.89 1r8b h LEU 308 N 0.51 0.99 -0.06 0.59 3.38 -0.49 -0.76 115.31 119.46 1r8b h LEU 308 Ca 0.14 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1r8b h LEU 308 Cb 0.18 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 1r8b h LEU 308 CO -0.01 0.85 0.02 -0.08 0.09 0.00 0.00 178.44 179.31 1r8b h GLU 309 N 1.07 0.10 -0.88 1.13 4.57 -1.16 -1.75 114.58 117.66 1r8b h GLU 309 Ca 0.26 -0.02 0.09 0.00 -1.18 0.00 0.00 59.36 58.51 1r8b h GLU 309 Cb 0.14 -0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 28.66 1r8b h GLU 309 CO -0.03 0.27 0.57 -0.09 -1.18 0.00 0.00 179.01 178.55 1r8b h ARG 310 N -0.09 0.85 -0.41 1.92 2.43 -1.13 -1.83 114.38 116.11 1r8b h ARG 310 Ca 0.02 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1r8b h ARG 310 Cb 0.22 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.58 1r8b h ARG 310 CO -0.00 0.56 0.00 0.39 -1.51 0.00 0.00 179.97 179.41 1r8b n GLU 311 N -4.52 1.95 -2.41 0.20 -0.58 -0.31 -4.93 120.64 110.03 1r8b n GLU 311 Ca 0.15 -1.31 -0.15 0.00 -0.42 0.00 0.00 57.16 55.43 1r8b n GLU 311 Cb 0.30 -1.35 0.00 0.00 -0.57 0.00 0.00 31.44 29.82 1r8b n GLU 311 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1r8b n ASN 312 N 0.51 -4.56 -0.29 1.62 4.13 -0.69 -4.90 115.26 111.08 1r8b n ASN 312 Ca 0.12 -0.06 0.12 0.00 1.68 0.00 0.00 54.58 56.44 1r8b n ASN 312 Cb 0.35 -3.64 0.25 0.00 -1.54 0.00 0.00 39.78 35.20 1r8b n ASN 312 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 1r8b n PHE 313 N -4.05 0.00 -3.36 3.10 3.72 -0.68 -4.87 117.46 111.32 1r8b n PHE 313 Ca -0.15 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.08 1r8b n PHE 313 Cb 0.62 -0.09 0.04 0.00 -0.94 0.00 0.00 39.48 39.11 1r8b n PHE 313 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 1r8b n MET 314 N -0.55 -1.66 -1.90 -1.08 2.81 -1.25 -2.42 117.12 111.07 1r8b n MET 314 Ca 0.11 0.91 -0.41 0.00 -1.81 0.00 0.00 57.70 56.51 1r8b n MET 314 Cb 0.38 -5.09 -0.00 0.00 -0.71 0.00 0.00 33.22 27.80 1r8b n MET 314 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1r8b s PRO 315 N -4.50 4.09 -0.20 0.03 0.04 -1.26 -1.28 135.00 131.92 1r8b s PRO 315 Ca 0.31 2.42 -0.16 0.00 0.04 0.00 0.00 61.00 63.61 1r8b s PRO 315 Cb -0.07 -2.92 -0.11 0.00 0.04 0.00 0.00 34.50 31.43 1r8b s PRO 315 CO 0.79 -0.49 -0.12 1.28 0.04 0.00 0.00 177.00 178.50 1r8b n LEU 316 N 0.41 1.88 -3.90 -3.56 4.77 0.46 -4.87 117.00 112.19 1r8b n LEU 316 Ca 0.02 0.45 -0.09 0.00 -0.03 0.00 0.00 56.01 56.35 1r8b n LEU 316 Cb 0.41 -0.87 -0.04 0.00 -2.33 0.00 0.00 43.42 40.58 1r8b n LEU 316 CO 0.61 0.05 0.25 -0.60 -1.33 0.00 0.00 177.39 176.37 1r8b s ARG 317 N -2.45 1.53 0.13 3.23 3.52 -1.23 -5.03 118.95 118.63 1r8b s ARG 317 Ca -0.27 -1.09 0.00 0.00 -0.13 0.00 0.00 55.73 54.24 1r8b s ARG 317 Cb 0.07 0.50 -0.04 0.00 -1.56 0.00 0.00 34.95 33.92 1r8b s ARG 317 CO 0.44 -0.65 0.00 -1.54 -0.81 0.00 0.00 175.30 172.75 1r8b s SER 318 N -2.96 0.80 0.31 -2.12 1.04 -1.26 -2.21 113.70 107.30 1r8b s SER 318 Ca 0.16 -1.13 -0.12 0.00 0.48 0.00 0.00 55.95 55.34 1r8b s SER 318 Cb -0.02 0.18 0.02 0.00 0.10 0.00 0.00 66.02 66.30 1r8b s SER 318 CO 0.05 -0.61 0.59 0.00 0.98 0.00 0.00 173.24 174.25 1r8b s ALA 319 N -3.82 -0.27 0.09 5.32 0.00 -0.71 -5.00 121.76 117.38 1r8b s ALA 319 Ca 0.19 -0.92 -0.17 0.00 0.00 0.00 0.00 51.96 51.07 1r8b s ALA 319 Cb 0.07 0.96 0.04 0.00 0.00 0.00 0.00 23.12 24.18 1r8b s ALA 319 CO -0.00 -0.90 0.40 -0.59 0.00 0.00 0.00 175.76 174.67 1r8b s PHE 320 N -3.34 -0.23 -0.12 0.00 -0.12 -1.26 -1.07 117.98 111.84 1r8b s PHE 320 Ca 0.21 0.05 -0.10 0.00 -0.05 0.00 0.00 56.93 57.03 1r8b s PHE 320 Cb -0.03 0.24 0.03 0.00 -0.63 0.00 0.00 43.02 42.63 1r8b s PHE 320 CO 0.12 -0.64 0.32 0.21 -0.05 0.00 0.00 175.22 175.18 1r8b s LYS 321 N -3.16 0.36 -0.17 1.99 2.47 -0.60 -5.01 119.74 115.62 1r8b s LYS 321 Ca -0.01 0.47 -0.01 0.00 -1.56 0.00 0.00 55.97 54.86 1r8b s LYS 321 Cb 0.01 0.14 -0.00 0.00 -1.46 0.00 0.00 37.83 36.52 1r8b s LYS 321 CO -0.07 -0.06 -0.12 0.00 0.16 0.00 0.00 175.35 175.26 1r8b s ALA 322 N 0.33 2.61 0.30 3.13 0.00 -1.26 -0.73 121.76 126.13 1r8b s ALA 322 Ca -0.01 -1.07 0.00 0.00 0.00 0.00 0.00 51.96 50.88 1r8b s ALA 322 Cb -0.03 -1.37 0.00 0.00 0.00 0.00 0.00 23.12 21.72 1r8b s ALA 322 CO -0.01 -0.13 0.00 -1.13 0.00 0.00 0.00 175.76 174.49 1r8b n SER 323 N 4.23 0.00 0.10 0.00 3.41 0.07 -5.01 113.62 116.42 1r8b n SER 323 Ca -0.19 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.20 1r8b n SER 323 Cb 0.51 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.32 1r8b n SER 323 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1r8b h GLU 324 N 0.00 0.47 0.00 4.33 5.08 -2.02 -3.39 114.58 119.06 1r8b h GLU 324 Ca 0.00 -0.75 0.00 0.00 -1.00 0.00 0.00 59.36 57.61 1r8b h GLU 324 Cb 0.00 0.27 0.00 0.00 0.50 0.00 0.00 28.75 29.52 1r8b h GLU 324 CO 0.00 1.35 -1.41 -0.85 -1.00 0.00 0.00 179.01 177.09 1r8b n GLU 325 N -3.90 0.56 -4.30 2.33 0.28 -1.26 -4.87 120.64 109.48 1r8b n GLU 325 Ca -0.15 -0.09 -0.19 0.00 -0.16 0.00 0.00 57.16 56.57 1r8b n GLU 325 Cb 0.97 -1.23 -0.11 0.00 1.43 0.00 0.00 31.44 32.49 1r8b n GLU 325 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 1r8b s PHE 326 N -2.68 1.62 0.17 -1.84 0.40 -1.26 -1.42 117.98 112.96 1r8b s PHE 326 Ca -0.03 -0.55 0.10 0.00 -0.60 0.00 0.00 56.93 55.85 1r8b s PHE 326 Cb 0.07 -0.80 -0.04 0.00 0.51 0.00 0.00 43.02 42.75 1r8b s PHE 326 CO 0.44 0.26 -0.16 0.00 0.70 0.00 0.00 175.22 176.46 1r8b s TYR 328 N -1.53 0.52 -0.27 0.00 1.51 0.09 -1.87 117.35 115.81 1r8b s TYR 328 Ca 0.22 -0.10 -0.02 0.00 -1.01 0.00 0.00 57.07 56.15 1r8b s TYR 328 Cb -0.09 -0.46 0.03 0.00 -0.11 0.00 0.00 41.96 41.33 1r8b s TYR 328 CO 0.12 -0.11 -0.02 -0.51 -1.11 0.00 0.00 175.55 173.92 1r8b s LEU 329 N 0.59 3.48 -0.10 -1.29 1.43 -0.60 -1.56 118.68 120.63 1r8b s LEU 329 Ca -0.07 -0.96 -0.05 0.00 -1.03 0.00 0.00 54.13 52.02 1r8b s LEU 329 Cb -0.10 -1.71 -0.04 0.00 0.03 0.00 0.00 46.19 44.37 1r8b s LEU 329 CO -0.00 -0.17 0.10 -0.76 0.23 0.00 0.00 176.35 175.74 1r8b s LEU 330 N 1.33 4.13 0.01 1.79 1.43 -0.23 -0.76 118.68 126.38 1r8b s LEU 330 Ca -0.01 0.35 -0.01 0.00 -1.03 0.00 0.00 54.13 53.44 1r8b s LEU 330 Cb -0.18 -2.04 -0.01 0.00 0.03 0.00 0.00 46.19 44.00 1r8b s LEU 330 CO -0.03 0.39 0.00 -0.36 0.23 0.00 0.00 176.35 176.58 1r8b s PHE 331 N -1.01 0.15 -0.08 0.29 0.08 0.05 -1.73 117.98 115.73 1r8b s PHE 331 Ca 0.16 -0.30 0.03 0.00 0.12 0.00 0.00 56.93 56.93 1r8b s PHE 331 Cb -0.12 -0.11 0.01 0.00 -0.57 0.00 0.00 43.02 42.23 1r8b s PHE 331 CO 0.05 -0.14 -0.15 -2.00 -0.10 0.00 0.00 175.22 172.88 1r8b s GLU 332 N -0.94 2.02 0.06 0.44 2.12 -0.94 -1.83 118.70 119.63 1r8b s GLU 332 Ca -0.10 -0.52 0.08 0.00 0.36 0.00 0.00 54.97 54.78 1r8b s GLU 332 Cb -0.06 -1.63 -0.03 0.00 0.26 0.00 0.00 34.13 32.67 1r8b s GLU 332 CO -0.00 0.05 -0.21 0.00 -0.54 0.00 0.00 175.26 174.55 1r8b h GLN 334 N 4.65 0.00 -4.95 0.00 4.20 -1.09 -1.79 115.11 116.13 1r8b h GLN 334 Ca -0.44 0.00 -0.66 0.00 0.06 0.00 0.00 58.65 57.62 1r8b h GLN 334 Cb 1.16 0.00 -0.25 0.00 0.30 0.00 0.00 27.48 28.70 1r8b h GLN 334 CO 0.43 0.16 -0.66 0.42 -0.67 0.00 0.00 178.83 178.51 1r8b s ILE 335 N -3.32 3.95 -0.03 2.54 -1.09 -1.01 -4.85 121.20 117.38 1r8b s ILE 335 Ca 0.04 -0.35 0.05 0.00 -2.23 0.00 0.00 60.65 58.16 1r8b s ILE 335 Cb 0.07 -2.85 -0.24 0.00 -1.58 0.00 0.00 42.46 37.85 1r8b s ILE 335 CO 0.66 0.34 0.71 0.11 -1.23 0.00 0.00 174.94 175.52 1r8b h LYS 336 N 8.19 0.11 -2.95 2.79 1.57 -1.88 -3.41 116.57 120.98 1r8b h LYS 336 Ca -0.39 -0.18 -0.17 0.00 -1.87 0.00 0.00 60.65 58.04 1r8b h LYS 336 Cb 1.16 0.07 -0.28 0.00 0.08 0.00 0.00 32.23 33.26 1r8b h LYS 336 CO 0.59 0.82 -0.43 -2.00 -0.57 0.00 0.00 179.45 177.86 1r8b s GLU 337 N -2.61 0.27 0.23 3.15 2.12 -1.26 -4.28 118.70 116.32 1r8b s GLU 337 Ca -0.08 0.55 0.10 0.00 0.36 0.00 0.00 54.97 55.89 1r8b s GLU 337 Cb 0.08 -0.04 -0.04 0.00 0.26 0.00 0.00 34.13 34.39 1r8b s GLU 337 CO 0.82 -0.13 -0.09 -1.50 -0.54 0.00 0.00 175.26 173.82 1r8b s ILE 338 N 1.03 3.11 0.72 -3.70 2.07 0.26 -5.01 121.20 119.68 1r8b s ILE 338 Ca -0.07 -1.90 -0.16 0.00 -1.41 0.00 0.00 60.65 57.11 1r8b s ILE 338 Cb -0.08 -2.60 0.03 0.00 0.13 0.00 0.00 42.46 39.94 1r8b s ILE 338 CO -0.07 -0.26 1.20 -1.54 -1.91 0.00 0.00 174.94 172.36 1r8b n SER 339 N -0.40 1.39 -0.22 4.50 3.41 -1.26 -4.70 113.62 116.34 1r8b n SER 339 Ca -0.08 0.71 -0.07 0.00 -0.26 0.00 0.00 58.87 59.16 1r8b n SER 339 Cb 0.57 -1.51 0.03 0.00 -0.26 0.00 0.00 64.21 63.04 1r8b n SER 339 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1r8b h ARG 340 N -0.17 0.89 -6.58 4.33 9.65 -1.93 -3.44 114.38 117.13 1r8b h ARG 340 Ca -0.48 -0.15 -0.52 0.00 -1.10 0.00 0.00 59.98 57.72 1r8b h ARG 340 Cb 1.32 -0.15 -0.03 0.00 -1.39 0.00 0.00 29.97 29.73 1r8b h ARG 340 CO 0.49 0.75 0.19 0.54 2.80 0.00 0.00 179.97 184.75 1r8b s VAL 341 N -5.59 4.36 0.22 0.20 0.11 -1.26 -0.26 120.40 118.18 1r8b s VAL 341 Ca -0.13 1.68 -0.01 0.00 -2.93 0.00 0.00 61.98 60.59 1r8b s VAL 341 Cb 0.13 -4.10 -0.04 0.00 -1.53 0.00 0.00 36.38 30.84 1r8b s VAL 341 CO 0.79 0.44 0.17 0.72 -3.33 0.00 0.00 175.10 173.90 1r8b s PHE 342 N -1.25 1.18 -0.25 1.54 -0.12 0.12 -4.91 117.98 114.29 1r8b s PHE 342 Ca 0.38 -1.38 -0.10 0.00 -0.05 0.00 0.00 56.93 55.79 1r8b s PHE 342 Cb -0.22 -0.53 -0.05 0.00 -0.63 0.00 0.00 43.02 41.59 1r8b s PHE 342 CO 0.26 -0.70 0.16 1.03 -0.05 0.00 0.00 175.22 175.92 1r8b s ARG 343 N -4.05 3.96 -0.18 1.99 0.52 -1.26 -0.85 118.95 119.09 1r8b s ARG 343 Ca 0.38 -0.32 -0.09 0.00 -0.52 0.00 0.00 55.73 55.18 1r8b s ARG 343 Cb 0.06 -3.54 -0.05 0.00 0.52 0.00 0.00 34.95 31.94 1r8b s ARG 343 CO 0.14 -0.05 0.13 0.50 0.02 0.00 0.00 175.30 176.03 1r8b s ARG 344 N 1.37 3.95 0.03 3.54 6.06 0.06 -4.96 118.95 129.00 1r8b s ARG 344 Ca 0.07 -0.20 -0.29 0.00 -2.50 0.00 0.00 55.73 52.81 1r8b s ARG 344 Cb -0.15 -3.34 -0.04 0.00 0.06 0.00 0.00 34.95 31.48 1r8b s ARG 344 CO 0.07 0.44 0.92 1.41 -2.50 0.00 0.00 175.30 175.64 1r8b s MET 345 N -0.05 4.58 0.03 5.12 -2.45 -1.26 -1.41 119.30 123.86 1r8b s MET 345 Ca 0.10 1.34 0.00 0.00 -1.25 0.00 0.00 55.69 55.88 1r8b s MET 345 Cb -0.11 -3.42 0.00 0.00 1.25 0.00 0.00 34.83 32.55 1r8b s MET 345 CO -0.00 0.08 0.01 0.41 1.05 0.00 0.00 175.02 176.57 1r8b n GLY 346 N 2.67 3.34 3.80 2.11 0.00 0.11 -4.93 105.19 112.29 1r8b n GLY 346 Ca 0.03 -2.19 -0.30 0.00 0.00 0.00 0.00 46.02 43.56 1r8b n GLY 346 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1r8b s PRO 347 N -2.10 2.13 0.59 1.61 0.04 -1.26 -4.43 135.00 131.58 1r8b s PRO 347 Ca 0.01 0.68 -0.20 0.00 0.04 0.00 0.00 61.00 61.53 1r8b s PRO 347 Cb -0.00 -1.92 -0.03 0.00 0.04 0.00 0.00 34.50 32.59 1r8b s PRO 347 CO 0.01 -1.60 1.31 -0.65 0.04 0.00 0.00 177.00 176.11 1r8b s GLN 348 N -5.13 2.87 0.49 4.56 -1.52 -1.26 -0.68 119.66 118.98 1r8b s GLN 348 Ca 0.61 2.11 0.14 0.00 -1.95 0.00 0.00 55.36 56.26 1r8b s GLN 348 Cb -0.15 -2.04 1.16 0.00 -0.22 0.00 0.00 33.01 31.77 1r8b s GLN 348 CO 0.54 -1.36 2.11 0.27 -0.25 0.00 0.00 175.29 176.60 1r8b h PHE 349 N 1.00 0.09 0.00 0.91 -5.15 -1.62 -2.34 116.94 109.83 1r8b h PHE 349 Ca -0.51 0.00 -0.02 0.00 -0.20 0.00 0.00 57.97 57.24 1r8b h PHE 349 Cb 1.32 -0.03 -0.00 0.00 0.22 0.00 0.00 35.95 37.45 1r8b h PHE 349 CO 0.44 0.08 -0.12 0.93 -2.00 0.00 0.00 178.31 177.65 1r8b h GLU 350 N 0.10 0.00 -5.04 6.09 3.07 -1.91 -3.40 114.58 113.50 1r8b h GLU 350 Ca 0.03 0.00 -0.72 0.00 -0.50 0.00 0.00 59.36 58.17 1r8b h GLU 350 Cb 0.03 0.00 -0.15 0.00 -0.84 0.00 0.00 28.75 27.79 1r8b h GLU 350 CO -0.00 0.12 1.50 0.34 -1.40 0.00 0.00 179.01 179.56 1r8b s ASP 351 N -6.42 6.98 0.20 1.42 -1.08 -0.88 -4.85 116.67 112.04 1r8b s ASP 351 Ca -0.04 -2.77 -0.11 0.00 -0.52 0.00 0.00 52.55 49.11 1r8b s ASP 351 Cb 0.14 -2.44 0.25 0.00 -1.46 0.00 0.00 42.92 39.41 1r8b s ASP 351 CO 0.61 -0.88 1.69 -0.08 0.52 0.00 0.00 175.17 177.03 1r8b h GLU 352 N 7.43 0.18 -0.21 4.34 4.81 -1.87 -0.37 114.58 128.90 1r8b h GLU 352 Ca 0.33 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.54 1r8b h GLU 352 Cb 0.89 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.22 1r8b h GLU 352 CO 1.28 0.12 0.11 -0.09 -0.73 0.00 0.00 179.01 179.70 1r8b h ARG 353 N 0.18 0.29 -0.02 1.92 2.43 -1.97 -1.12 114.38 116.09 1r8b h ARG 353 Ca 0.29 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.28 1r8b h ARG 353 Cb 0.44 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.92 1r8b h ARG 353 CO -0.43 0.28 -0.69 -0.91 -1.51 0.00 0.00 179.97 176.71 1r8b h ASN 354 N 0.22 0.11 -0.55 -3.80 2.35 -1.88 -2.56 115.58 109.48 1r8b h ASN 354 Ca 0.07 -0.07 -0.04 0.00 -0.55 0.00 0.00 56.30 55.71 1r8b h ASN 354 Cb 0.07 -0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.39 1r8b h ASN 354 CO -0.01 0.76 0.19 0.58 -1.65 0.00 0.00 177.43 177.31 1r8b h VAL 355 N 0.07 1.23 -0.89 2.81 2.07 -0.89 -0.45 116.25 120.20 1r8b h VAL 355 Ca -0.01 -0.75 0.01 0.00 0.82 0.00 0.00 66.70 66.77 1r8b h VAL 355 Cb 1.22 0.69 -0.05 0.00 -1.52 0.00 0.00 31.29 31.63 1r8b h VAL 355 CO 0.10 0.28 0.59 0.50 0.02 0.00 0.00 177.57 179.05 1r8b h LYS 356 N 0.75 1.15 -0.05 1.57 3.64 -1.07 -0.57 116.57 122.00 1r8b h LYS 356 Ca 0.18 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.48 1r8b h LYS 356 Cb 0.24 -0.26 -0.00 0.00 -0.41 0.00 0.00 32.23 31.80 1r8b h LYS 356 CO -0.01 0.76 0.00 0.87 -2.27 0.00 0.00 179.45 178.81 1r8b h LYS 357 N 1.19 0.09 -0.88 1.90 1.57 -1.13 -1.87 116.57 117.44 1r8b h LYS 357 Ca 0.33 -0.03 0.10 0.00 -1.87 0.00 0.00 60.65 59.19 1r8b h LYS 357 Cb -0.12 -0.01 -0.08 0.00 0.08 0.00 0.00 32.23 32.11 1r8b h LYS 357 CO -0.08 0.34 0.52 0.35 -0.57 0.00 0.00 179.45 180.02 1r8b h PHE 358 N -0.18 0.94 0.00 -1.35 3.57 -0.68 -2.44 116.94 116.80 1r8b h PHE 358 Ca 0.02 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.55 1r8b h PHE 358 Cb 0.30 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 38.75 1r8b h PHE 358 CO 0.02 0.38 -0.18 1.28 -2.23 0.00 0.00 178.31 177.58 1r8b n LEU 359 N -4.71 0.22 0.10 0.59 4.77 -0.26 -3.72 117.00 113.99 1r8b n LEU 359 Ca 0.15 0.33 0.01 0.00 -0.03 0.00 0.00 56.01 56.47 1r8b n LEU 359 Cb 0.30 -0.40 0.33 0.00 -2.33 0.00 0.00 43.42 41.32 1r8b n LEU 359 CO 0.27 0.03 0.81 0.28 -1.33 0.00 0.00 177.39 177.46 1r8b h SER 360 N 0.00 0.25 -3.77 -1.43 0.02 -0.82 -3.44 113.55 104.36 1r8b h SER 360 Ca 0.00 -0.07 -0.51 0.00 -0.84 0.00 0.00 61.79 60.38 1r8b h SER 360 Cb 0.52 -0.07 0.02 0.00 0.14 0.00 0.00 62.40 63.01 1r8b h SER 360 CO 0.00 0.48 0.48 -0.13 -1.14 0.00 0.00 176.83 176.52 1r8b s ARG 361 N -4.56 4.62 0.05 3.45 1.81 -1.24 -4.97 118.95 118.11 1r8b s ARG 361 Ca -0.05 1.81 -0.31 0.00 -1.72 0.00 0.00 55.73 55.46 1r8b s ARG 361 Cb 0.15 -3.20 -0.06 0.00 -0.45 0.00 0.00 34.95 31.39 1r8b s ARG 361 CO 0.75 0.18 1.24 1.21 -0.68 0.00 0.00 175.30 178.00 1r8b s ASN 362 N -0.75 7.02 0.10 0.23 2.47 -1.26 -5.04 114.94 117.72 1r8b s ASN 362 Ca 0.45 2.05 -0.02 0.00 0.42 0.00 0.00 52.86 55.77 1r8b s ASN 362 Cb -0.32 -2.58 -0.04 0.00 -1.45 0.00 0.00 41.25 36.87 1r8b s ASN 362 CO 0.40 -0.53 0.05 -0.13 -3.72 0.00 0.00 177.10 173.17 1r8b s ARG 363 N 1.28 0.83 0.35 0.43 0.52 -1.26 -5.04 118.95 116.06 1r8b s ARG 363 Ca 0.60 -1.33 0.18 0.00 -0.52 0.00 0.00 55.73 54.66 1r8b s ARG 363 Cb -0.30 0.24 0.46 0.00 0.52 0.00 0.00 34.95 35.87 1r8b s ARG 363 CO 0.28 -0.22 1.63 0.00 0.02 0.00 0.00 175.30 177.01 1r8b h ALA 364 N 2.94 0.86 -2.69 2.13 0.00 -1.96 -3.45 119.26 117.09 1r8b h ALA 364 Ca -0.34 -0.36 -0.55 0.00 0.00 0.00 0.00 54.91 53.66 1r8b h ALA 364 Cb 1.18 -0.06 -0.17 0.00 0.00 0.00 0.00 17.79 18.74 1r8b h ALA 364 CO 0.61 0.49 -0.78 -0.06 0.00 0.00 0.00 179.25 179.51 1r8b s PHE 365 N -3.33 1.99 -0.04 0.00 0.08 -1.26 -5.12 117.98 110.30 1r8b s PHE 365 Ca 0.02 -0.44 -0.29 0.00 0.12 0.00 0.00 56.93 56.34 1r8b s PHE 365 Cb 0.09 -0.95 -0.03 0.00 -0.57 0.00 0.00 43.02 41.57 1r8b s PHE 365 CO 0.70 0.45 0.96 1.03 -0.10 0.00 0.00 175.22 178.26 1r8b s ARG 366 N -3.08 4.51 1.03 0.44 0.52 -1.26 -4.77 118.95 116.34 1r8b s ARG 366 Ca 0.21 1.35 -0.12 0.00 -0.52 0.00 0.00 55.73 56.66 1r8b s ARG 366 Cb -0.05 -3.48 0.21 0.00 0.52 0.00 0.00 34.95 32.14 1r8b s ARG 366 CO 0.09 -0.11 1.08 -2.14 0.02 0.00 0.00 175.30 174.24 1r8b s PRO 367 N 1.26 0.16 0.10 3.54 0.02 -1.26 -4.65 135.00 134.17 1r8b s PRO 367 Ca 0.49 1.07 -0.10 0.00 0.02 0.00 0.00 61.00 62.49 1r8b s PRO 367 Cb -0.20 -1.66 0.00 0.00 0.02 0.00 0.00 34.50 32.66 1r8b s PRO 367 CO 0.24 -3.06 0.22 -0.59 -0.33 0.00 0.00 177.00 173.48 1r8b s PHE 368 N -2.62 0.13 -0.14 6.54 -0.12 0.21 -4.98 117.98 117.01 1r8b s PHE 368 Ca 0.67 -0.54 -0.11 0.00 -0.05 0.00 0.00 56.93 56.90 1r8b s PHE 368 Cb -0.23 -0.02 -0.05 0.00 -0.63 0.00 0.00 43.02 42.09 1r8b s PHE 368 CO 0.61 -0.58 0.22 0.42 -0.05 0.00 0.00 175.22 175.84 1r8b s ILE 369 N -3.86 5.35 -0.07 -4.49 1.01 -1.26 -0.82 121.20 117.06 1r8b s ILE 369 Ca 0.06 0.40 -0.03 0.00 0.00 0.00 0.00 60.65 61.08 1r8b s ILE 369 Cb 0.04 -3.53 0.04 0.00 0.01 0.00 0.00 42.46 39.02 1r8b s ILE 369 CO -0.10 0.50 0.14 -0.70 0.00 0.00 0.00 174.94 174.78 1r8b s GLU 370 N -0.22 0.08 -1.53 2.79 2.12 -0.33 -4.91 118.70 116.70 1r8b s GLU 370 Ca 0.15 0.40 -0.08 0.00 0.36 0.00 0.00 54.97 55.80 1r8b s GLU 370 Cb -0.13 -0.20 0.06 0.00 0.26 0.00 0.00 34.13 34.13 1r8b s GLU 370 CO 0.04 -0.19 0.56 0.09 -0.54 0.00 0.00 175.26 175.22 1r8b n ASN 371 N 4.42 -1.59 0.00 -1.70 3.02 -1.26 -2.18 115.26 115.96 1r8b n ASN 371 Ca -0.23 -1.01 0.00 0.00 -0.03 0.00 0.00 54.58 53.31 1r8b n ASN 371 Cb 0.51 -2.92 0.00 0.00 -0.61 0.00 0.00 39.78 36.77 1r8b n ASN 371 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1r8b n GLY 372 N -1.78 0.78 3.02 7.41 0.00 -1.26 -5.01 105.19 108.35 1r8b n GLY 372 Ca -0.15 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.74 1r8b n GLY 372 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1r8b s ARG 373 N -0.44 0.44 0.40 1.61 3.52 -0.93 -1.50 118.95 122.05 1r8b s ARG 373 Ca 0.00 -0.59 -0.18 0.00 -0.13 0.00 0.00 55.73 54.84 1r8b s ARG 373 Cb 0.00 -0.22 -0.10 0.00 -1.56 0.00 0.00 34.95 33.07 1r8b s ARG 373 CO 0.00 0.04 0.86 -1.58 -0.81 0.00 0.00 175.30 173.81 1r8b s TRP 374 N -1.09 3.36 0.01 5.12 0.52 0.14 -1.18 118.94 125.81 1r8b s TRP 374 Ca -0.08 1.42 -0.05 0.00 0.02 0.00 0.00 56.10 57.40 1r8b s TRP 374 Cb -0.08 -2.70 -0.00 0.00 -1.15 0.00 0.00 33.47 29.53 1r8b s TRP 374 CO 0.00 -0.06 0.09 -1.58 0.02 0.00 0.00 176.95 175.42 1r8b s TRP 375 N -2.17 0.10 0.00 -1.98 0.52 -0.00 -0.71 118.94 114.71 1r8b s TRP 375 Ca 0.58 -0.25 0.06 0.00 0.02 0.00 0.00 56.10 56.51 1r8b s TRP 375 Cb -0.10 -0.09 -0.02 0.00 -1.15 0.00 0.00 33.47 32.12 1r8b s TRP 375 CO 0.18 -0.27 -0.18 0.00 0.02 0.00 0.00 176.95 176.70 1r8b s ALA 376 N -1.46 1.48 -0.02 0.98 0.00 -0.50 -0.62 121.76 121.62 1r8b s ALA 376 Ca -0.15 -0.82 -0.30 0.00 0.00 0.00 0.00 51.96 50.70 1r8b s ALA 376 Cb -0.08 -0.34 -0.04 0.00 0.00 0.00 0.00 23.12 22.66 1r8b s ALA 376 CO 0.01 0.35 1.15 -0.06 0.00 0.00 0.00 175.76 177.20 1r8b s PHE 377 N -0.53 3.36 0.29 0.00 0.08 -1.26 -0.76 117.98 119.16 1r8b s PHE 377 Ca 0.06 1.34 0.02 0.00 0.12 0.00 0.00 56.93 58.48 1r8b s PHE 377 Cb -0.07 -3.35 -0.04 0.00 -0.57 0.00 0.00 43.02 38.98 1r8b s PHE 377 CO -0.00 -1.01 0.14 -1.21 -0.10 0.00 0.00 175.22 173.04 1r8b s GLU 378 N 1.72 1.53 -0.15 0.44 2.02 -0.03 -4.66 118.70 119.56 1r8b s GLU 378 Ca 0.55 -1.86 -0.02 0.00 0.02 0.00 0.00 54.97 53.67 1r8b s GLU 378 Cb -0.25 -0.14 -0.02 0.00 0.10 0.00 0.00 34.13 33.82 1r8b s GLU 378 CO 0.24 -0.40 -0.08 -1.64 0.02 0.00 0.00 175.26 173.40 1r8b s MET 379 N -3.90 3.52 0.61 1.61 -1.94 -1.26 -0.70 119.30 117.23 1r8b s MET 379 Ca 0.36 -0.60 -0.18 0.00 -1.71 0.00 0.00 55.69 53.56 1r8b s MET 379 Cb 0.06 -2.79 -0.03 0.00 2.01 0.00 0.00 34.83 34.08 1r8b s MET 379 CO 0.16 0.20 1.17 1.03 -0.01 0.00 0.00 175.02 177.56 1r8b s ARG 380 N 0.43 2.95 0.00 2.03 0.52 0.64 -4.96 118.95 120.56 1r8b s ARG 380 Ca -0.07 1.67 0.27 0.00 -0.52 0.00 0.00 55.73 57.09 1r8b s ARG 380 Cb -0.15 -1.94 0.95 0.00 0.52 0.00 0.00 34.95 34.33 1r8b s ARG 380 CO 0.04 -1.19 1.69 1.63 0.02 0.00 0.00 175.30 177.49 1r8b n LYS 381 N -1.80 1.74 -3.64 3.54 5.02 -1.26 -4.89 118.16 116.86 1r8b n LYS 381 Ca 0.12 -1.07 -0.14 0.00 -2.02 0.00 0.00 58.31 55.20 1r8b n LYS 381 Cb 0.51 -1.48 -0.07 0.00 -0.02 0.00 0.00 35.03 33.97 1r8b n LYS 381 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 1r8b s PHE 382 N -1.99 -0.36 0.00 2.13 -0.12 -1.26 -5.01 117.98 111.37 1r8b s PHE 382 Ca 0.37 0.50 0.00 0.00 -0.05 0.00 0.00 56.93 57.75 1r8b s PHE 382 Cb 0.21 0.25 0.00 0.00 -0.63 0.00 0.00 43.02 42.85 1r8b s PHE 382 CO 0.33 -0.54 0.30 0.25 -0.05 0.00 0.00 175.22 175.51 1r8b n THR 383 N 0.82 0.00 -4.39 -4.49 -2.24 -1.26 -4.94 114.28 97.78 1r8b n THR 383 Ca -0.20 -0.34 -0.25 0.00 -2.27 0.00 0.00 64.05 60.99 1r8b n THR 383 Cb 0.58 1.28 -0.12 0.00 -2.10 0.00 0.00 70.33 69.98 1r8b n THR 383 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1r8b s THR 384 N -0.08 2.18 0.30 4.28 -4.23 -1.26 -0.58 115.64 116.24 1r8b s THR 384 Ca 0.00 -1.97 0.03 0.00 -1.18 0.00 0.00 61.69 58.57 1r8b s THR 384 Cb 0.00 -2.02 0.08 0.00 1.34 0.00 0.00 72.50 71.90 1r8b s THR 384 CO 0.00 -0.16 1.75 1.55 -0.54 0.00 0.00 174.62 177.22 1r8b h PRO 385 N 3.28 0.45 -0.63 3.99 0.13 -1.80 -0.99 132.00 136.43 1r8b h PRO 385 Ca -0.45 -0.16 0.08 0.00 -0.87 0.00 0.00 66.00 64.60 1r8b h PRO 385 Cb 1.21 -0.03 -0.07 0.00 0.13 0.00 0.00 31.00 32.24 1r8b h PRO 385 CO 0.48 0.65 0.28 0.93 -0.23 0.00 0.00 178.00 180.12 1r8b h GLU 386 N 0.40 0.49 -0.44 0.86 3.07 -1.95 0.09 114.58 117.10 1r8b h GLU 386 Ca 0.06 -0.03 -0.13 0.00 -0.50 0.00 0.00 59.36 58.76 1r8b h GLU 386 Cb 0.62 -0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 28.41 1r8b h GLU 386 CO 0.04 0.33 -0.24 0.93 -1.40 0.00 0.00 179.01 178.67 1r8b h GLU 387 N 0.51 0.92 -0.20 2.33 5.08 -1.85 -1.81 114.58 119.55 1r8b h GLU 387 Ca 0.31 -0.40 0.01 0.00 -1.00 0.00 0.00 59.36 58.28 1r8b h GLU 387 Cb 0.32 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 1r8b h GLU 387 CO -0.26 1.05 0.12 0.78 -1.00 0.00 0.00 179.01 179.70 1r8b h GLY 388 N 0.90 0.28 1.79 -3.84 0.00 -0.91 -2.29 103.07 99.01 1r8b h GLY 388 Ca 0.10 -0.09 -0.10 0.00 0.00 0.00 0.00 47.33 47.24 1r8b h GLY 388 CO 0.07 0.08 -0.40 -2.08 0.00 0.00 0.00 176.54 174.21 1r8b h VAL 389 N 0.25 1.31 -0.52 4.60 2.07 -0.88 0.16 116.25 123.23 1r8b h VAL 389 Ca 0.08 -1.50 0.03 0.00 0.82 0.00 0.00 66.70 66.13 1r8b h VAL 389 Cb -0.01 1.68 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 1r8b h VAL 389 CO -0.04 0.45 0.31 -0.09 0.02 0.00 0.00 177.57 178.22 1r8b h ARG 390 N 0.19 0.60 -0.15 1.57 2.43 -1.16 -0.54 114.38 117.32 1r8b h ARG 390 Ca 0.02 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 1r8b h ARG 390 Cb 0.80 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.21 1r8b h ARG 390 CO 0.06 0.39 0.04 1.03 -1.51 0.00 0.00 179.97 179.99 1r8b h SER 391 N 0.61 0.22 -0.11 -3.80 0.87 -0.93 -2.32 113.55 108.10 1r8b h SER 391 Ca 0.21 -0.21 -0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1r8b h SER 391 Cb 0.03 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 61.93 1r8b h SER 391 CO -0.10 0.37 0.05 0.22 -0.53 0.00 0.00 176.83 176.84 1r8b h TYR 392 N 0.05 0.16 0.00 2.24 3.20 -0.44 -2.28 116.97 119.90 1r8b h TYR 392 Ca 0.05 -0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.86 1r8b h TYR 392 Cb 0.23 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 1r8b h TYR 392 CO 0.00 0.23 -0.24 0.00 -1.64 0.00 0.00 178.16 176.52 1r8b h ALA 393 N 0.91 1.47 -0.05 1.82 0.00 -1.14 0.39 119.26 122.66 1r8b h ALA 393 Ca 0.04 -0.21 -0.16 0.00 0.00 0.00 0.00 54.91 54.57 1r8b h ALA 393 Cb 0.13 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1r8b h ALA 393 CO -0.00 0.30 -0.69 0.77 0.00 0.00 0.00 179.25 179.63 1r8b h SER 394 N 0.00 0.26 0.00 0.00 0.02 -1.12 -3.26 113.55 109.45 1r8b h SER 394 Ca -0.00 -0.17 -0.28 0.00 -0.84 0.00 0.00 61.79 60.50 1r8b h SER 394 Cb 0.46 -0.08 -0.05 0.00 0.14 0.00 0.00 62.40 62.87 1r8b h SER 394 CO 0.03 0.87 -2.05 0.41 -1.14 0.00 0.00 176.83 174.95 1r8b n THR 395 N -3.81 1.05 -1.39 -2.27 -1.04 -0.88 -4.67 114.28 101.27 1r8b n THR 395 Ca -0.03 -0.59 0.03 0.00 -2.04 0.00 0.00 64.05 61.43 1r8b n THR 395 Cb 0.67 -0.74 0.20 0.00 -1.82 0.00 0.00 70.33 68.65 1r8b n THR 395 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 1r8b n HIS 396 N -2.68 0.49 0.13 -1.42 -0.00 0.14 -4.67 115.22 107.21 1r8b n HIS 396 Ca -0.27 -1.38 0.19 0.00 -0.00 0.00 0.00 57.72 56.26 1r8b n HIS 396 Cb 0.96 -0.33 0.77 0.00 -0.00 0.00 0.00 29.99 31.40 1r8b n HIS 396 CO 0.00 0.00 0.00 0.11 -0.00 0.00 0.00 176.34 176.45 1r8b h TRP 397 N 0.91 0.00 0.00 4.41 5.08 -1.71 -2.22 115.95 122.43 1r8b h TRP 397 Ca 0.08 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.05 1r8b h TRP 397 Cb 1.29 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.45 1r8b h TRP 397 CO 0.70 0.00 0.00 -2.39 -1.28 0.00 0.00 178.44 175.47 1r8b n HIS 398 N -3.77 0.44 0.31 0.12 1.44 -1.26 -1.87 115.22 110.63 1r8b n HIS 398 Ca 0.05 0.18 0.10 0.00 -2.01 0.00 0.00 57.72 56.04 1r8b n HIS 398 Cb 0.50 -0.78 0.17 0.00 0.12 0.00 0.00 29.99 30.00 1r8b n HIS 398 CO 0.00 0.00 0.00 -2.37 -2.81 0.00 0.00 176.34 171.16 1r8b n THR 399 N -1.91 0.45 -1.10 0.61 5.66 -0.83 -4.59 114.28 112.57 1r8b n THR 399 Ca 0.02 -0.73 -0.08 0.00 -3.05 0.00 0.00 64.05 60.22 1r8b n THR 399 Cb 0.19 1.00 0.28 0.00 -1.55 0.00 0.00 70.33 70.25 1r8b n THR 399 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1r8b n LEU 400 N 1.22 5.98 0.00 1.09 4.77 -0.78 -4.79 117.00 124.48 1r8b n LEU 400 Ca 0.16 -3.32 0.00 0.00 -0.03 0.00 0.00 56.01 52.82 1r8b n LEU 400 Cb 0.53 -0.75 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 1r8b n LEU 400 CO 0.13 0.87 0.00 0.61 -1.33 0.00 0.00 177.39 177.68 1r8b n GLY 401 N -0.40 2.16 0.22 -0.72 0.00 -1.26 -3.39 105.19 101.79 1r8b n GLY 401 Ca 0.43 -1.65 -0.10 0.00 0.00 0.00 0.00 46.02 44.69 1r8b n GLY 401 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1r8b h LYS 402 N 0.00 -0.25 0.12 1.61 3.64 -1.93 0.65 116.57 120.42 1r8b h LYS 402 Ca 0.00 0.02 -0.37 0.00 -1.27 0.00 0.00 60.65 59.03 1r8b h LYS 402 Cb 0.00 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.86 1r8b h LYS 402 CO 0.00 -0.17 -2.01 0.09 -2.27 0.00 0.00 179.45 175.09 1r8b n ASN 403 N -5.31 2.12 -0.19 4.20 4.13 -1.26 -2.85 115.26 116.10 1r8b n ASN 403 Ca -0.04 0.20 -0.07 0.00 1.68 0.00 0.00 54.58 56.35 1r8b n ASN 403 Cb 0.23 -0.85 0.03 0.00 -1.54 0.00 0.00 39.78 37.65 1r8b n ASN 403 CO 0.00 0.00 0.00 0.58 0.28 0.00 0.00 177.26 178.12 1r8b h VAL 404 N 0.06 1.14 -0.46 2.41 2.07 -1.79 -1.26 116.25 118.43 1r8b h VAL 404 Ca -0.43 -0.26 -0.10 0.00 0.82 0.00 0.00 66.70 66.72 1r8b h VAL 404 Cb 2.03 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 32.12 1r8b h VAL 404 CO 0.08 0.14 -0.12 1.23 0.02 0.00 0.00 177.57 178.92 1r8b h GLY 405 N 0.74 0.96 1.02 2.17 0.00 -0.87 -1.32 103.07 105.76 1r8b h GLY 405 Ca 0.20 -0.80 -0.02 0.00 0.00 0.00 0.00 47.33 46.71 1r8b h GLY 405 CO -0.04 0.73 0.39 0.83 0.00 0.00 0.00 176.54 178.45 1r8b h GLU 406 N 0.73 1.07 0.03 4.80 5.08 -1.40 -0.48 114.58 124.40 1r8b h GLU 406 Ca 0.11 -0.14 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1r8b h GLU 406 Cb 0.67 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1r8b h GLU 406 CO 0.05 0.81 -0.01 1.03 -1.00 0.00 0.00 179.01 179.89 1r8b h SER 407 N 1.05 -0.03 -0.65 1.42 0.87 -1.01 -2.65 113.55 112.56 1r8b h SER 407 Ca 0.26 -0.07 0.08 0.00 -1.23 0.00 0.00 61.79 60.83 1r8b h SER 407 Cb 0.08 0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 62.00 1r8b h SER 407 CO -0.04 0.06 0.43 0.40 -0.53 0.00 0.00 176.83 177.15 1r8b h ILE 408 N -0.11 0.96 -0.67 2.23 2.04 -0.97 -1.01 117.51 119.97 1r8b h ILE 408 Ca -0.00 -0.19 0.05 0.00 1.00 0.00 0.00 64.86 65.71 1r8b h ILE 408 Cb 0.10 0.34 -0.05 0.00 -0.74 0.00 0.00 36.82 36.47 1r8b h ILE 408 CO 0.01 0.10 0.38 -0.09 0.00 0.00 0.00 178.15 178.55 1r8b h ARG 409 N 0.57 0.70 -0.06 2.37 2.43 -0.82 -2.80 114.38 116.76 1r8b h ARG 409 Ca 0.29 -0.04 -0.15 0.00 -0.81 0.00 0.00 59.98 59.26 1r8b h ARG 409 Cb 0.40 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 1r8b h ARG 409 CO -0.09 0.46 -0.64 0.93 -1.51 0.00 0.00 179.97 179.12 1r8b h GLU 410 N 0.72 0.24 -0.92 0.20 5.08 -0.87 -3.46 114.58 115.58 1r8b h GLU 410 Ca 0.29 -0.18 0.20 0.00 -1.00 0.00 0.00 59.36 58.68 1r8b h GLU 410 Cb 0.14 0.03 -0.30 0.00 0.50 0.00 0.00 28.75 29.12 1r8b h GLU 410 CO -0.16 0.80 0.61 -0.47 -1.00 0.00 0.00 179.01 178.79 1r8b s TYR 411 N -3.69 -0.18 0.19 4.33 6.14 -0.78 -5.13 117.35 118.22 1r8b s TYR 411 Ca -0.04 0.35 -0.06 0.00 0.64 0.00 0.00 57.07 57.96 1r8b s TYR 411 Cb 0.12 0.11 -0.02 0.00 0.42 0.00 0.00 41.96 42.59 1r8b s TYR 411 CO 0.80 -0.09 0.26 -0.59 0.64 0.00 0.00 175.55 176.57 1r8b s PHE 412 N 1.41 0.68 0.00 4.97 -0.12 -1.25 -4.16 117.98 119.51 1r8b s PHE 412 Ca -0.06 -1.00 -0.00 0.00 -0.05 0.00 0.00 56.93 55.82 1r8b s PHE 412 Cb -0.02 -0.20 -0.00 0.00 -0.63 0.00 0.00 43.02 42.16 1r8b s PHE 412 CO -0.12 -0.74 -0.00 -2.00 -0.05 0.00 0.00 175.22 172.30 1r8b s GLU 413 N -4.05 0.01 -0.22 1.99 2.12 -0.51 -4.97 118.70 113.07 1r8b s GLU 413 Ca 0.26 -0.02 -0.13 0.00 0.36 0.00 0.00 54.97 55.45 1r8b s GLU 413 Cb 0.04 0.00 -0.05 0.00 0.26 0.00 0.00 34.13 34.39 1r8b s GLU 413 CO 0.06 -0.00 0.25 0.42 -0.54 0.00 0.00 175.26 175.45 1r8b s ILE 414 N -0.05 5.30 -0.09 -3.70 -1.09 -1.26 -0.54 121.20 119.77 1r8b s ILE 414 Ca -0.01 0.38 0.04 0.00 -2.23 0.00 0.00 60.65 58.84 1r8b s ILE 414 Cb -0.00 -3.59 -0.00 0.00 -1.58 0.00 0.00 42.46 37.29 1r8b s ILE 414 CO -0.00 0.32 -0.24 -0.63 -1.23 0.00 0.00 174.94 173.16 1r8b s ILE 415 N 1.07 2.08 0.26 2.92 1.01 0.68 -4.96 121.20 124.26 1r8b s ILE 415 Ca 0.12 -1.02 0.07 0.00 0.00 0.00 0.00 60.65 59.82 1r8b s ILE 415 Cb -0.14 -1.78 -0.05 0.00 0.01 0.00 0.00 42.46 40.49 1r8b s ILE 415 CO 0.05 0.56 -0.10 -0.44 0.00 0.00 0.00 174.94 175.02 1r8b s SER 416 N 0.24 2.79 0.77 3.58 0.01 -1.26 -0.68 113.70 119.15 1r8b s SER 416 Ca -0.16 -1.12 0.00 0.00 1.31 0.00 0.00 55.95 55.98 1r8b s SER 416 Cb -0.17 -0.17 0.00 0.00 0.21 0.00 0.00 66.02 65.89 1r8b s SER 416 CO 0.08 -0.25 0.00 0.61 0.41 0.00 0.00 173.24 174.09 1r8b n GLY 417 N -0.52 1.88 0.27 3.44 0.00 -1.26 -2.81 105.19 106.18 1r8b n GLY 417 Ca -0.06 -0.56 0.12 0.00 0.00 0.00 0.00 46.02 45.51 1r8b n GLY 417 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1r8b h GLU 418 N 0.00 0.00 -0.20 1.61 4.39 -1.99 -0.10 114.58 118.29 1r8b h GLU 418 Ca 0.00 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.53 1r8b h GLU 418 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1r8b h GLU 418 CO 0.00 0.08 -0.53 0.87 -1.16 0.00 0.00 179.01 178.27 1r8b h LYS 419 N 0.00 0.72 -0.98 2.33 6.56 -1.97 -2.86 116.57 120.37 1r8b h LYS 419 Ca -0.00 -0.50 0.12 0.00 -1.06 0.00 0.00 60.65 59.20 1r8b h LYS 419 Cb 0.19 0.08 -0.08 0.00 -0.57 0.00 0.00 32.23 31.85 1r8b h LYS 419 CO 0.01 1.12 0.62 1.25 -2.06 0.00 0.00 179.45 180.40 1r8b h LEU 420 N 0.43 0.89 -0.02 2.94 5.85 -0.86 -1.63 115.31 122.92 1r8b h LEU 420 Ca -0.01 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.75 1r8b h LEU 420 Cb 1.15 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.04 1r8b h LEU 420 CO 0.12 0.48 0.00 0.49 -0.34 0.00 0.00 178.44 179.19 1r8b n PHE 421 N -4.59 0.04 0.40 1.25 0.99 -0.96 -2.13 117.46 112.47 1r8b n PHE 421 Ca 0.18 0.02 0.13 0.00 -0.00 0.00 0.00 57.45 57.78 1r8b n PHE 421 Cb 0.35 -0.52 0.35 0.00 -1.00 0.00 0.00 39.48 38.65 1r8b n PHE 421 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.76 177.63 1r8b h LYS 422 N 0.00 0.00 -6.78 -1.08 1.57 -1.19 -3.46 116.57 105.62 1r8b h LYS 422 Ca 0.00 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.28 1r8b h LYS 422 Cb 0.35 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.68 1r8b h LYS 422 CO 0.00 0.00 0.03 -1.21 -0.57 0.00 0.00 179.45 177.70 1r8b s GLU 423 N -3.22 3.61 -1.45 3.15 0.41 -0.90 -4.95 118.70 115.35 1r8b s GLU 423 Ca 0.08 0.17 -0.09 0.00 -0.41 0.00 0.00 54.97 54.71 1r8b s GLU 423 Cb 0.09 -2.46 -0.08 0.00 -1.78 0.00 0.00 34.13 29.90 1r8b s GLU 423 CO 0.60 -0.05 2.72 -0.35 -0.49 0.00 0.00 175.26 177.70 1r8b n PRO 424 N -1.73 3.26 0.00 0.39 -0.04 -1.26 -3.98 135.00 131.64 1r8b n PRO 424 Ca -0.00 -2.04 0.00 0.00 -0.04 0.00 0.00 63.50 61.42 1r8b n PRO 424 Cb 0.55 -2.74 0.00 0.00 -0.04 0.00 0.00 33.50 31.26 1r8b n PRO 424 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1r8b n VAL 425 N 3.83 0.03 -0.03 0.52 0.24 -1.26 -4.86 118.33 116.80 1r8b n VAL 425 Ca 0.69 -0.23 -0.01 0.00 -2.04 0.00 0.00 64.34 62.75 1r8b n VAL 425 Cb 0.22 1.51 0.26 0.00 -1.47 0.00 0.00 33.84 34.35 1r8b n VAL 425 CO 0.00 0.00 0.00 0.71 -2.14 0.00 0.00 176.83 175.40 1r8b h THR 426 N 0.64 1.21 -0.36 3.34 1.35 -1.90 -0.48 112.91 116.71 1r8b h THR 426 Ca 0.00 -0.87 -0.03 0.00 -0.55 0.00 0.00 66.41 64.97 1r8b h THR 426 Cb 0.32 0.95 -0.02 0.00 -1.73 0.00 0.00 68.15 67.67 1r8b h THR 426 CO 0.00 0.30 0.13 0.00 -0.25 0.00 0.00 175.52 175.70 1r8b h ALA 427 N 1.43 0.48 -0.44 6.62 0.00 -1.94 -1.29 119.26 124.12 1r8b h ALA 427 Ca 0.12 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 1r8b h ALA 427 Cb 0.38 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1r8b h ALA 427 CO 0.01 0.10 -0.05 0.93 0.00 0.00 0.00 179.25 180.24 1r8b h GLU 428 N 0.44 0.75 -0.18 0.00 3.07 -1.70 -2.00 114.58 114.96 1r8b h GLU 428 Ca 0.12 -0.22 -0.01 0.00 -0.50 0.00 0.00 59.36 58.75 1r8b h GLU 428 Cb 0.22 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.05 1r8b h GLU 428 CO -0.01 0.79 0.06 -0.07 -1.40 0.00 0.00 179.01 178.39 1r8b h LEU 429 N 0.69 0.26 -0.81 1.33 3.38 -0.98 -0.62 115.31 118.57 1r8b h LEU 429 Ca 0.13 -0.19 0.04 0.00 0.09 0.00 0.00 57.88 57.95 1r8b h LEU 429 Cb 0.50 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.13 1r8b h LEU 429 CO 0.03 0.38 0.51 0.00 0.09 0.00 0.00 178.44 179.45 1r8b h GLU 431 N 0.99 0.58 -0.65 0.00 4.57 -1.28 0.68 114.58 119.47 1r8b h GLU 431 Ca 0.33 -0.25 0.08 0.00 -1.18 0.00 0.00 59.36 58.33 1r8b h GLU 431 Cb 0.04 -0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 28.57 1r8b h GLU 431 CO -0.12 0.82 0.43 1.98 -1.18 0.00 0.00 179.01 180.93 1r8b h MET 432 N 0.33 0.57 -0.02 1.92 4.05 -0.71 -1.85 114.93 119.22 1r8b h MET 432 Ca 0.06 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.45 1r8b h MET 432 Cb 0.64 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 31.31 1r8b h MET 432 CO 0.04 0.38 -0.05 -1.33 0.23 0.00 0.00 176.91 176.17 1r8b n MET 433 N -4.48 1.83 -2.44 0.39 2.81 -0.65 -4.91 117.12 109.66 1r8b n MET 433 Ca 0.10 -1.30 -0.13 0.00 -1.81 0.00 0.00 57.70 54.56 1r8b n MET 433 Cb 0.28 -1.47 0.01 0.00 -0.71 0.00 0.00 33.22 31.33 1r8b n MET 433 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1r8b n GLY 434 N 1.27 -0.09 3.73 3.03 0.00 -0.70 -4.95 105.19 107.48 1r8b n GLY 434 Ca 0.16 -0.31 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 1r8b n GLY 434 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r8b s VAL 435 N -2.75 2.42 0.84 1.61 1.01 0.15 -5.01 120.40 118.67 1r8b s VAL 435 Ca 0.08 0.32 -0.10 0.00 0.00 0.00 0.00 61.98 62.27 1r8b s VAL 435 Cb -0.03 -3.20 0.14 0.00 0.00 0.00 0.00 36.38 33.28 1r8b s VAL 435 CO 0.10 0.03 1.17 -0.54 0.00 0.00 0.00 175.10 175.86 1r8b s LYS 436 N 0.69 1.35 0.00 2.72 1.02 -1.26 -4.86 119.74 119.41 1r8b s LYS 436 Ca 0.68 -0.48 0.28 0.00 0.02 0.00 0.00 55.97 56.48 1r8b s LYS 436 Cb -0.45 -2.04 1.65 0.00 -0.52 0.00 0.00 37.83 36.48 1r8b s LYS 436 CO 0.35 -1.85 2.00 -3.47 -0.92 0.00 0.00 175.35 171.46