#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wwk s LYS 2 N 0.00 2.15 -0.16 0.03 1.02 -1.26 -0.56 119.74 120.96 1wwk s LYS 2 Ca 0.00 -0.91 -0.01 0.00 0.02 0.00 0.00 55.97 55.07 1wwk s LYS 2 Cb 0.00 -2.10 -0.01 0.00 -0.52 0.00 0.00 37.83 35.20 1wwk s LYS 2 CO 0.00 0.57 -0.10 0.08 -0.92 0.00 0.00 175.35 174.98 1wwk s VAL 3 N -0.66 3.14 -0.31 3.17 1.01 0.21 -1.00 120.40 125.96 1wwk s VAL 3 Ca 0.11 -0.61 -0.21 0.00 0.00 0.00 0.00 61.98 61.26 1wwk s VAL 3 Cb -0.10 -2.36 -0.00 0.00 0.00 0.00 0.00 36.38 33.92 1wwk s VAL 3 CO -0.00 0.49 0.68 -0.22 0.00 0.00 0.00 175.10 176.05 1wwk s LEU 4 N 0.78 4.14 -0.51 3.92 2.96 -0.28 -1.08 118.68 128.60 1wwk s LEU 4 Ca -0.04 0.48 -0.18 0.00 -0.22 0.00 0.00 54.13 54.17 1wwk s LEU 4 Cb -0.15 -2.90 0.07 0.00 0.50 0.00 0.00 46.19 43.72 1wwk s LEU 4 CO 0.01 -0.54 0.57 -0.69 -1.32 0.00 0.00 176.35 174.39 1wwk s VAL 5 N 2.73 4.97 -2.01 1.68 1.01 0.90 -0.68 120.40 129.01 1wwk s VAL 5 Ca 0.27 -0.77 0.22 0.00 0.00 0.00 0.00 61.98 61.70 1wwk s VAL 5 Cb -0.15 -4.29 0.63 0.00 0.00 0.00 0.00 36.38 32.57 1wwk s VAL 5 CO 0.12 -0.80 1.52 0.00 0.00 0.00 0.00 175.10 175.94 1wwk n ALA 6 N 5.91 2.39 -2.38 5.51 0.00 -0.78 -1.72 120.51 129.44 1wwk n ALA 6 Ca -0.09 -1.24 -0.10 0.00 0.00 0.00 0.00 53.44 52.01 1wwk n ALA 6 Cb 0.44 -0.94 -0.09 0.00 0.00 0.00 0.00 19.45 18.86 1wwk n ALA 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wwk s ALA 7 N -1.05 0.50 0.08 0.00 0.00 -1.25 0.13 121.76 120.16 1wwk s ALA 7 Ca 0.48 -1.22 -0.34 0.00 0.00 0.00 0.00 51.96 50.88 1wwk s ALA 7 Cb 0.25 0.84 -0.13 0.00 0.00 0.00 0.00 23.12 24.07 1wwk s ALA 7 CO 0.32 -0.55 1.66 -2.30 0.00 0.00 0.00 175.76 174.90 1wwk n PRO 8 N -0.13 2.11 -4.32 0.00 -0.02 -1.26 -4.81 135.00 126.57 1wwk n PRO 8 Ca -0.07 0.77 -0.19 0.00 -2.02 0.00 0.00 63.50 61.99 1wwk n PRO 8 Cb 0.63 -2.55 -0.13 0.00 -0.02 0.00 0.00 33.50 31.43 1wwk n PRO 8 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1wwk s LEU 9 N 1.89 2.13 0.77 2.45 2.96 -1.26 -4.95 118.68 122.67 1wwk s LEU 9 Ca 0.83 -0.37 -0.14 0.00 -0.22 0.00 0.00 54.13 54.24 1wwk s LEU 9 Cb -0.70 -0.49 0.06 0.00 0.50 0.00 0.00 46.19 45.57 1wwk s LEU 9 CO 0.43 0.03 1.18 -2.28 -1.32 0.00 0.00 176.35 174.39 1wwk s HIS 10 N -0.71 1.99 0.14 5.38 5.65 -1.26 -4.82 115.29 121.67 1wwk s HIS 10 Ca 0.01 1.64 -0.17 0.00 0.25 0.00 0.00 55.06 56.79 1wwk s HIS 10 Cb -0.07 -3.41 -0.00 0.00 -1.18 0.00 0.00 32.58 27.92 1wwk s HIS 10 CO 0.01 -2.59 1.80 1.49 -0.65 0.00 0.00 174.74 174.79 1wwk h GLU 11 N -0.71 0.42 -0.43 2.88 4.81 -1.99 -1.57 114.58 117.99 1wwk h GLU 11 Ca -0.46 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 58.72 1wwk h GLU 11 Cb 1.28 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.55 1wwk h GLU 11 CO 0.48 0.28 0.18 0.87 -0.73 0.00 0.00 179.01 180.08 1wwk h LYS 12 N 0.43 0.60 -0.41 1.92 1.57 -1.98 0.18 116.57 118.88 1wwk h LYS 12 Ca 0.13 -0.08 -0.10 0.00 -1.87 0.00 0.00 60.65 58.73 1wwk h LYS 12 Cb -0.02 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.16 1wwk h LYS 12 CO -0.05 0.50 -0.15 0.00 -0.57 0.00 0.00 179.45 179.18 1wwk h ALA 13 N 1.60 0.58 -0.79 3.86 0.00 -1.78 -1.41 119.26 121.31 1wwk h ALA 13 Ca 0.15 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 1wwk h ALA 13 Cb 0.11 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 1wwk h ALA 13 CO -0.02 0.50 0.32 0.82 0.00 0.00 0.00 179.25 180.87 1wwk h ILE 14 N 0.65 1.26 -0.28 0.00 1.08 -0.80 -2.52 117.51 116.91 1wwk h ILE 14 Ca 0.10 -0.82 -0.02 0.00 -0.39 0.00 0.00 64.86 63.73 1wwk h ILE 14 Cb 0.70 0.31 -0.01 0.00 -3.07 0.00 0.00 36.82 34.74 1wwk h ILE 14 CO 0.05 0.34 0.09 -0.61 -0.69 0.00 0.00 178.15 177.33 1wwk h GLN 15 N 1.16 0.39 -0.53 2.37 5.75 -0.33 -1.64 115.11 122.27 1wwk h GLN 15 Ca 0.26 -0.05 -0.07 0.00 -0.15 0.00 0.00 58.65 58.64 1wwk h GLN 15 Cb 0.22 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 28.67 1wwk h GLN 15 CO -0.02 0.34 0.04 0.28 -2.65 0.00 0.00 178.83 176.82 1wwk h VAL 16 N 0.39 1.25 -0.02 2.39 2.07 -0.81 0.24 116.25 121.75 1wwk h VAL 16 Ca 0.10 -1.00 -0.00 0.00 0.82 0.00 0.00 66.70 66.61 1wwk h VAL 16 Cb 0.11 0.80 -0.00 0.00 -1.52 0.00 0.00 31.29 30.68 1wwk h VAL 16 CO -0.01 0.36 -0.00 -0.07 0.02 0.00 0.00 177.57 177.87 1wwk h LEU 17 N 0.82 0.04 -0.52 2.57 3.38 -1.23 -3.03 115.31 117.34 1wwk h LEU 17 Ca 0.16 -0.34 -0.07 0.00 0.09 0.00 0.00 57.88 57.72 1wwk h LEU 17 Cb 0.44 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 1wwk h LEU 17 CO 0.02 0.38 0.04 0.11 0.09 0.00 0.00 178.44 179.08 1wwk h LYS 18 N -0.29 0.90 -0.01 1.13 1.57 -1.24 -2.27 116.57 116.36 1wwk h LYS 18 Ca 0.01 -0.26 0.00 0.00 -1.87 0.00 0.00 60.65 58.53 1wwk h LYS 18 Cb 0.35 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.57 1wwk h LYS 18 CO 0.00 0.90 0.03 -0.44 -0.57 0.00 0.00 179.45 179.37 1wwk h ASP 19 N 0.77 0.00 0.48 0.86 3.32 -0.99 0.53 116.42 121.39 1wwk h ASP 19 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 1wwk h ASP 19 Cb 0.46 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.01 1wwk h ASP 19 CO 0.02 0.00 -0.21 0.00 -1.72 0.00 0.00 179.24 177.33 1wwk n ALA 20 N -2.16 2.94 -0.65 3.45 0.00 -0.88 -4.92 120.51 118.28 1wwk n ALA 20 Ca -0.03 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.13 1wwk n ALA 20 Cb 0.10 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.28 1wwk n ALA 20 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wwk n GLY 21 N 1.38 0.65 3.84 0.00 0.00 0.18 -5.05 105.19 106.19 1wwk n GLY 21 Ca 0.11 -0.24 -0.34 0.00 0.00 0.00 0.00 46.02 45.55 1wwk n GLY 21 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wwk s LEU 22 N 0.00 4.16 0.10 0.99 1.43 -1.05 -4.81 118.68 119.50 1wwk s LEU 22 Ca 0.00 1.31 -0.26 0.00 -1.03 0.00 0.00 54.13 54.15 1wwk s LEU 22 Cb 0.00 -3.90 -0.06 0.00 0.03 0.00 0.00 46.19 42.26 1wwk s LEU 22 CO 0.00 -0.12 0.80 -0.70 0.23 0.00 0.00 176.35 176.56 1wwk s GLU 23 N -2.64 4.56 -0.18 1.70 2.12 0.27 -4.38 118.70 120.15 1wwk s GLU 23 Ca 0.50 1.16 -0.01 0.00 0.36 0.00 0.00 54.97 56.98 1wwk s GLU 23 Cb -0.12 -3.33 -0.00 0.00 0.26 0.00 0.00 34.13 30.94 1wwk s GLU 23 CO 0.19 0.37 -0.12 0.08 -0.54 0.00 0.00 175.26 175.24 1wwk s VAL 24 N -0.42 2.83 -0.32 3.70 1.01 -1.26 0.64 120.40 126.58 1wwk s VAL 24 Ca 0.39 -0.69 -0.11 0.00 0.00 0.00 0.00 61.98 61.56 1wwk s VAL 24 Cb -0.22 -2.23 -0.02 0.00 0.00 0.00 0.00 36.38 33.91 1wwk s VAL 24 CO 0.25 0.49 0.19 -0.63 0.00 0.00 0.00 175.10 175.40 1wwk s ILE 25 N 1.14 5.00 -0.31 2.22 -1.09 -0.24 -4.97 121.20 122.96 1wwk s ILE 25 Ca 0.01 -0.22 0.04 0.00 -2.23 0.00 0.00 60.65 58.24 1wwk s ILE 25 Cb -0.14 -3.52 0.08 0.00 -1.58 0.00 0.00 42.46 37.30 1wwk s ILE 25 CO -0.04 0.08 -0.01 -0.47 -1.23 0.00 0.00 174.94 173.27 1wwk s TYR 26 N 1.69 3.58 -0.29 3.97 6.14 -1.26 -0.07 117.35 131.10 1wwk s TYR 26 Ca 0.06 -2.74 -0.02 0.00 0.64 0.00 0.00 57.07 55.01 1wwk s TYR 26 Cb -0.17 -2.55 0.12 0.00 0.42 0.00 0.00 41.96 39.79 1wwk s TYR 26 CO 0.09 -0.92 0.23 -2.00 0.64 0.00 0.00 175.55 173.59 1wwk s GLU 27 N 0.98 0.28 0.50 4.97 2.12 -0.70 -5.02 118.70 121.83 1wwk s GLU 27 Ca 0.03 -0.32 -0.22 0.00 0.36 0.00 0.00 54.97 54.82 1wwk s GLU 27 Cb -0.19 -0.86 -0.06 0.00 0.26 0.00 0.00 34.13 33.27 1wwk s GLU 27 CO -0.07 -1.03 1.22 -1.21 -0.54 0.00 0.00 175.26 173.63 1wwk s GLU 28 N 2.22 3.50 -1.30 4.30 2.02 -1.26 -4.05 118.70 124.15 1wwk s GLU 28 Ca 0.09 1.90 -0.19 0.00 0.02 0.00 0.00 54.97 56.80 1wwk s GLU 28 Cb -0.15 -2.31 0.02 0.00 0.10 0.00 0.00 34.13 31.79 1wwk s GLU 28 CO -0.33 -0.80 0.53 0.66 0.02 0.00 0.00 175.26 175.33 1wwk n TYR 29 N -0.76 -1.52 -2.09 1.61 4.01 0.34 -4.91 117.16 113.85 1wwk n TYR 29 Ca 0.09 0.37 -0.33 0.00 -0.16 0.00 0.00 57.90 57.87 1wwk n TYR 29 Cb 0.47 -3.09 0.01 0.00 -0.31 0.00 0.00 39.34 36.43 1wwk n TYR 29 CO 0.00 0.00 0.00 -2.14 -0.46 0.00 0.00 176.86 174.26 1wwk s PRO 30 N -6.97 3.32 0.88 -0.72 0.02 -1.26 -5.03 135.00 125.24 1wwk s PRO 30 Ca 0.31 1.27 -0.13 0.00 0.02 0.00 0.00 61.00 62.47 1wwk s PRO 30 Cb -0.15 -2.03 0.12 0.00 0.02 0.00 0.00 34.50 32.46 1wwk s PRO 30 CO 0.94 -0.82 1.18 0.16 -0.33 0.00 0.00 177.00 178.13 1wwk s ASP 31 N -2.60 3.87 0.14 2.53 3.84 -1.26 -4.74 116.67 118.45 1wwk s ASP 31 Ca 0.65 0.77 -0.18 0.00 -0.00 0.00 0.00 52.55 53.79 1wwk s ASP 31 Cb -0.17 -1.22 0.00 0.00 -1.38 0.00 0.00 42.92 40.15 1wwk s ASP 31 CO 0.35 -2.31 1.76 -0.08 -0.00 0.00 0.00 175.17 174.89 1wwk h GLU 32 N -1.33 0.24 -0.44 2.11 4.81 -1.97 0.21 114.58 118.21 1wwk h GLU 32 Ca -0.47 -0.01 0.09 0.00 -0.13 0.00 0.00 59.36 58.83 1wwk h GLU 32 Cb 1.32 -0.05 -0.09 0.00 0.63 0.00 0.00 28.75 30.56 1wwk h GLU 32 CO 0.60 0.16 -0.13 -0.44 -0.73 0.00 0.00 179.01 178.47 1wwk h ASP 33 N 0.25 -0.47 -0.66 1.04 3.32 -2.00 0.21 116.42 118.11 1wwk h ASP 33 Ca 0.12 0.14 -0.09 0.00 0.02 0.00 0.00 57.03 57.23 1wwk h ASP 33 Cb 0.07 0.30 -0.03 0.00 0.22 0.00 0.00 39.33 39.89 1wwk h ASP 33 CO -0.11 -0.17 0.08 -0.09 -1.72 0.00 0.00 179.24 177.24 1wwk h ARG 34 N -0.03 1.12 -0.14 3.56 9.65 -1.82 -2.93 114.38 123.79 1wwk h ARG 34 Ca 0.21 -0.31 0.01 0.00 -1.10 0.00 0.00 59.98 58.79 1wwk h ARG 34 Cb 0.35 -0.12 -0.01 0.00 -1.39 0.00 0.00 29.97 28.80 1wwk h ARG 34 CO -0.47 1.03 0.06 1.25 2.80 0.00 0.00 179.97 184.65 1wwk h LEU 35 N 1.04 0.09 -1.91 3.80 5.85 0.46 -1.68 115.31 122.95 1wwk h LEU 35 Ca 0.20 0.01 0.20 0.00 0.84 0.00 0.00 57.88 59.13 1wwk h LEU 35 Cb 0.48 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.46 1wwk h LEU 35 CO 0.02 0.07 0.52 0.58 -0.34 0.00 0.00 178.44 179.29 1wwk h VAL 36 N 0.14 0.66 0.00 1.05 2.07 -0.53 0.18 116.25 119.82 1wwk h VAL 36 Ca 0.06 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.55 1wwk h VAL 36 Cb 0.02 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 1wwk h VAL 36 CO -0.04 0.01 -0.33 -0.08 0.02 0.00 0.00 177.57 177.15 1wwk h GLU 37 N 0.08 0.00 0.00 1.57 4.57 -1.16 -3.32 114.58 116.32 1wwk h GLU 37 Ca 0.36 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.54 1wwk h GLU 37 Cb 1.30 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.89 1wwk h GLU 37 CO -0.03 0.00 -1.06 1.28 -1.18 0.00 0.00 179.01 178.02 1wwk n LEU 38 N -2.77 0.69 -0.51 1.64 4.77 0.58 -4.16 117.00 117.23 1wwk n LEU 38 Ca 0.03 0.21 0.12 0.00 -0.03 0.00 0.00 56.01 56.34 1wwk n LEU 38 Cb 0.51 -0.08 0.17 0.00 -2.33 0.00 0.00 43.42 41.69 1wwk n LEU 38 CO 0.35 -0.10 0.51 1.33 -1.33 0.00 0.00 177.39 178.15 1wwk n VAL 39 N -2.40 0.00 -0.22 4.08 0.24 -0.75 -4.38 118.33 114.91 1wwk n VAL 39 Ca 0.00 -0.27 0.09 0.00 -2.04 0.00 0.00 64.34 62.12 1wwk n VAL 39 Cb 0.51 1.01 0.37 0.00 -1.47 0.00 0.00 33.84 34.25 1wwk n VAL 39 CO 0.00 0.00 0.00 0.07 -2.14 0.00 0.00 176.83 174.76 1wwk h LYS 40 N 2.53 0.71 0.00 7.34 2.10 -1.69 -2.98 116.57 124.57 1wwk h LYS 40 Ca 0.00 -0.04 -0.00 0.00 -2.00 0.00 0.00 60.65 58.60 1wwk h LYS 40 Cb 0.71 -0.16 -0.01 0.00 -0.90 0.00 0.00 32.23 31.87 1wwk h LYS 40 CO 0.00 0.47 -0.24 -3.47 -2.00 0.00 0.00 179.45 174.21 1wwk n ASP 41 N -4.50 2.00 -4.68 7.07 4.64 -1.26 -4.11 116.55 115.70 1wwk n ASP 41 Ca 0.13 -3.37 -0.32 0.00 -1.38 0.00 0.00 54.79 49.86 1wwk n ASP 41 Cb 0.32 -0.46 -0.09 0.00 -1.04 0.00 0.00 41.12 39.86 1wwk n ASP 41 CO 0.00 0.00 0.00 0.68 -0.82 0.00 0.00 177.20 177.06 1wwk s VAL 42 N -2.89 4.06 -0.42 5.18 -7.23 -1.13 -4.42 120.40 113.56 1wwk s VAL 42 Ca 0.34 -0.77 0.23 0.00 -1.81 0.00 0.00 61.98 59.96 1wwk s VAL 42 Cb 0.31 -2.86 -0.02 0.00 0.56 0.00 0.00 36.38 34.37 1wwk s VAL 42 CO -0.02 0.27 1.10 -0.62 -0.31 0.00 0.00 175.10 175.53 1wwk n GLU 43 N 1.06 0.45 -3.67 4.82 4.71 -0.17 -2.68 120.64 125.17 1wwk n GLU 43 Ca -0.13 0.08 -0.12 0.00 -0.01 0.00 0.00 57.16 56.98 1wwk n GLU 43 Cb 0.52 -1.73 -0.06 0.00 -1.01 0.00 0.00 31.44 29.16 1wwk n GLU 43 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1wwk s ALA 44 N -3.28 -0.95 -0.03 0.62 0.00 -1.17 0.89 121.76 117.84 1wwk s ALA 44 Ca 0.02 0.19 0.02 0.00 0.00 0.00 0.00 51.96 52.19 1wwk s ALA 44 Cb 0.12 0.42 0.01 0.00 0.00 0.00 0.00 23.12 23.67 1wwk s ALA 44 CO 0.78 -0.49 -0.08 0.42 0.00 0.00 0.00 175.76 176.38 1wwk s ILE 45 N -2.79 0.76 -0.15 0.00 1.01 -0.83 -1.13 121.20 118.07 1wwk s ILE 45 Ca -0.03 -0.32 0.00 0.00 0.00 0.00 0.00 60.65 60.30 1wwk s ILE 45 Cb -0.00 -0.70 -0.00 0.00 0.01 0.00 0.00 42.46 41.76 1wwk s ILE 45 CO -0.05 0.25 -0.15 -0.63 0.00 0.00 0.00 174.94 174.37 1wwk s ILE 46 N 0.41 2.71 0.19 2.92 1.01 0.14 -0.04 121.20 128.55 1wwk s ILE 46 Ca -0.07 -0.76 0.03 0.00 0.00 0.00 0.00 60.65 59.86 1wwk s ILE 46 Cb -0.11 -2.15 -0.05 0.00 0.01 0.00 0.00 42.46 40.17 1wwk s ILE 46 CO 0.01 0.51 -0.01 0.68 0.00 0.00 0.00 174.94 176.13 1wwk s VAL 47 N 0.80 0.86 0.00 2.92 -7.23 0.79 -1.87 120.40 116.66 1wwk s VAL 47 Ca -0.05 -2.01 0.00 0.00 -1.81 0.00 0.00 61.98 58.11 1wwk s VAL 47 Cb -0.15 -2.16 0.00 0.00 0.56 0.00 0.00 36.38 34.63 1wwk s VAL 47 CO 0.00 -0.46 0.00 0.54 -0.31 0.00 0.00 175.10 174.87 1wwk n ARG 48 N -0.29 1.90 0.27 4.82 5.12 -1.26 0.05 116.66 127.26 1wwk n ARG 48 Ca -0.06 0.00 0.18 0.00 -1.93 0.00 0.00 57.85 56.03 1wwk n ARG 48 Cb 0.63 0.00 0.83 0.00 -1.16 0.00 0.00 32.46 32.76 1wwk n ARG 48 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 1wwk h SER 49 N 0.00 0.00 -5.36 0.55 4.64 -1.95 -3.44 113.55 107.99 1wwk h SER 49 Ca 0.00 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.18 1wwk h SER 49 Cb 0.00 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 61.96 1wwk h SER 49 CO 0.00 0.00 -0.41 -1.59 -0.87 0.00 0.00 176.83 173.96 1wwk s LYS 50 N -3.77 1.19 0.87 4.77 -2.85 -1.26 -4.69 119.74 113.99 1wwk s LYS 50 Ca -0.01 -1.33 -0.15 0.00 -1.00 0.00 0.00 55.97 53.48 1wwk s LYS 50 Cb 0.10 0.35 0.20 0.00 -2.06 0.00 0.00 37.83 36.42 1wwk s LYS 50 CO 0.44 -0.42 1.08 -0.35 0.10 0.00 0.00 175.35 176.21 1wwk n PRO 51 N -0.23 -1.43 -2.82 1.78 -0.04 -1.26 -4.68 135.00 126.31 1wwk n PRO 51 Ca -0.04 -1.69 -0.42 0.00 -0.04 0.00 0.00 63.50 61.31 1wwk n PRO 51 Cb 0.64 -1.20 -0.04 0.00 -0.04 0.00 0.00 33.50 32.86 1wwk n PRO 51 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1wwk s LYS 52 N -5.38 4.25 -1.00 0.54 1.02 -1.26 -4.87 119.74 113.04 1wwk s LYS 52 Ca 0.63 1.09 -0.16 0.00 0.02 0.00 0.00 55.97 57.55 1wwk s LYS 52 Cb -0.02 -3.61 0.17 0.00 -0.52 0.00 0.00 37.83 33.84 1wwk s LYS 52 CO 0.45 -0.47 1.14 0.08 -0.92 0.00 0.00 175.35 175.63 1wwk s VAL 53 N 2.64 5.09 0.86 3.17 1.01 0.60 -4.97 120.40 128.81 1wwk s VAL 53 Ca 0.39 -2.19 -0.13 0.00 0.00 0.00 0.00 61.98 60.05 1wwk s VAL 53 Cb -0.16 -4.74 0.13 0.00 0.00 0.00 0.00 36.38 31.61 1wwk s VAL 53 CO 0.09 -1.42 1.21 0.42 0.00 0.00 0.00 175.10 175.40 1wwk s THR 54 N 1.57 2.04 0.20 3.92 -4.23 -1.26 -1.49 115.64 116.39 1wwk s THR 54 Ca 0.33 -0.06 -0.11 0.00 -1.18 0.00 0.00 61.69 60.67 1wwk s THR 54 Cb -0.06 -2.98 0.14 0.00 1.34 0.00 0.00 72.50 70.95 1wwk s THR 54 CO -0.07 0.00 1.84 -0.09 -0.54 0.00 0.00 174.62 175.77 1wwk h ARG 55 N -1.24 0.98 -0.80 3.99 2.43 -1.95 -1.60 114.38 116.20 1wwk h ARG 55 Ca -0.45 -0.09 0.11 0.00 -0.81 0.00 0.00 59.98 58.74 1wwk h ARG 55 Cb 1.28 -0.21 -0.08 0.00 -0.42 0.00 0.00 29.97 30.55 1wwk h ARG 55 CO 0.52 0.69 0.43 -0.09 -1.51 0.00 0.00 179.97 180.01 1wwk h ARG 56 N 0.99 0.68 -0.38 0.20 2.43 -1.98 0.22 114.38 116.54 1wwk h ARG 56 Ca 0.26 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.36 1wwk h ARG 56 Cb -0.04 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.34 1wwk h ARG 56 CO -0.05 0.45 0.12 0.28 -1.51 0.00 0.00 179.97 179.26 1wwk h VAL 57 N 0.70 1.21 -0.36 0.20 2.07 -1.81 -2.94 116.25 115.33 1wwk h VAL 57 Ca 0.40 -0.70 -0.05 0.00 0.82 0.00 0.00 66.70 67.17 1wwk h VAL 57 Cb 0.43 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 1wwk h VAL 57 CO -0.28 0.24 0.02 0.40 0.02 0.00 0.00 177.57 177.98 1wwk h ILE 58 N 0.46 1.25 0.00 4.57 2.04 -0.52 -2.35 117.51 122.96 1wwk h ILE 58 Ca 0.12 -0.93 0.00 0.00 1.00 0.00 0.00 64.86 65.05 1wwk h ILE 58 Cb 0.26 1.15 0.00 0.00 -0.74 0.00 0.00 36.82 37.49 1wwk h ILE 58 CO -0.00 0.31 0.00 -0.62 0.00 0.00 0.00 178.15 177.84 1wwk n GLU 59 N -4.52 0.11 -0.20 2.37 1.02 0.69 -1.25 120.64 118.87 1wwk n GLU 59 Ca -0.01 0.22 0.09 0.00 -0.02 0.00 0.00 57.16 57.44 1wwk n GLU 59 Cb 0.26 -1.50 0.20 0.00 -0.02 0.00 0.00 31.44 30.38 1wwk n GLU 59 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1wwk n SER 60 N -1.33 3.23 -3.99 1.62 7.64 -0.89 -4.79 113.62 115.11 1wwk n SER 60 Ca 0.04 -1.93 -0.32 0.00 1.01 0.00 0.00 58.87 57.68 1wwk n SER 60 Cb 0.09 -0.26 -0.12 0.00 -1.01 0.00 0.00 64.21 62.91 1wwk n SER 60 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wwk s ALA 61 N -1.19 3.47 0.48 -0.43 0.00 -0.38 -3.97 121.76 119.73 1wwk s ALA 61 Ca 0.33 -3.37 0.24 0.00 0.00 0.00 0.00 51.96 49.17 1wwk s ALA 61 Cb 0.19 -2.31 1.43 0.00 0.00 0.00 0.00 23.12 22.43 1wwk s ALA 61 CO 0.25 -2.06 2.11 -1.00 0.00 0.00 0.00 175.76 175.06 1wwk h PRO 62 N 6.47 0.00 -0.01 0.00 0.13 -1.80 -2.70 132.00 134.09 1wwk h PRO 62 Ca -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 1wwk h PRO 62 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 1wwk h PRO 62 CO 0.70 0.10 -0.68 1.63 -0.23 0.00 0.00 178.00 179.52 1wwk n LYS 63 N -3.91 0.87 -1.67 0.86 5.02 -1.26 -4.99 118.16 113.07 1wwk n LYS 63 Ca -0.02 -0.51 -0.49 0.00 -2.02 0.00 0.00 58.31 55.26 1wwk n LYS 63 Cb 0.19 -1.44 -0.05 0.00 -0.02 0.00 0.00 35.03 33.71 1wwk n LYS 63 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1wwk n LEU 64 N -0.71 2.88 -0.07 -0.35 7.94 -1.02 -4.33 117.00 121.34 1wwk n LEU 64 Ca 0.06 1.05 -0.08 0.00 -1.11 0.00 0.00 56.01 55.93 1wwk n LEU 64 Cb 0.38 -1.33 -0.08 0.00 0.53 0.00 0.00 43.42 42.93 1wwk n LEU 64 CO 0.33 -0.35 -0.93 0.29 -1.11 0.00 0.00 177.39 175.62 1wwk n LYS 65 N 4.70 1.12 -3.76 1.96 5.02 0.26 -4.83 118.16 122.63 1wwk n LYS 65 Ca 0.21 0.05 -0.13 0.00 -2.02 0.00 0.00 58.31 56.41 1wwk n LYS 65 Cb 0.25 -1.29 -0.09 0.00 -0.02 0.00 0.00 35.03 33.87 1wwk n LYS 65 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1wwk s VAL 66 N -2.28 0.03 -0.18 -0.18 0.11 -1.12 -1.79 120.40 114.99 1wwk s VAL 66 Ca -0.14 -0.28 -0.01 0.00 -2.93 0.00 0.00 61.98 58.63 1wwk s VAL 66 Cb 0.04 -0.56 0.00 0.00 -1.53 0.00 0.00 36.38 34.34 1wwk s VAL 66 CO 0.39 -0.15 -0.13 -0.63 -3.33 0.00 0.00 175.10 171.24 1wwk s ILE 67 N -0.71 2.71 -0.06 7.04 1.01 0.91 -1.96 121.20 130.14 1wwk s ILE 67 Ca -0.08 -0.73 0.05 0.00 0.00 0.00 0.00 60.65 59.89 1wwk s ILE 67 Cb -0.04 -2.17 -0.01 0.00 0.01 0.00 0.00 42.46 40.24 1wwk s ILE 67 CO 0.03 0.50 -0.22 0.00 0.00 0.00 0.00 174.94 175.24 1wwk s ALA 68 N 1.10 2.29 -0.24 9.38 0.00 0.95 -0.93 121.76 134.30 1wwk s ALA 68 Ca 0.00 -1.02 -0.04 0.00 0.00 0.00 0.00 51.96 50.90 1wwk s ALA 68 Cb -0.14 -0.77 0.00 0.00 0.00 0.00 0.00 23.12 22.21 1wwk s ALA 68 CO -0.04 0.42 -0.03 0.50 0.00 0.00 0.00 175.76 176.61 1wwk s ARG 69 N -0.19 3.18 -1.33 0.00 6.06 0.03 -0.15 118.95 126.55 1wwk s ARG 69 Ca -0.02 -0.76 -0.17 0.00 -2.50 0.00 0.00 55.73 52.28 1wwk s ARG 69 Cb -0.13 -3.06 0.06 0.00 0.06 0.00 0.00 34.95 31.88 1wwk s ARG 69 CO 0.03 -0.29 1.84 0.00 -2.50 0.00 0.00 175.30 174.38 1wwk n ALA 70 N 4.77 3.91 0.00 6.12 0.00 0.11 -3.31 120.51 132.11 1wwk n ALA 70 Ca -0.17 -3.84 0.00 0.00 0.00 0.00 0.00 53.44 49.43 1wwk n ALA 70 Cb 0.49 -3.59 0.00 0.00 0.00 0.00 0.00 19.45 16.35 1wwk n ALA 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wwk n GLY 71 N 5.15 -0.01 3.53 0.00 0.00 -1.26 -4.79 105.19 107.81 1wwk n GLY 71 Ca 0.50 -1.08 -0.31 0.00 0.00 0.00 0.00 46.02 45.13 1wwk n GLY 71 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wwk s VAL 72 N -4.00 3.26 0.00 1.61 0.11 -1.26 -0.62 120.40 119.49 1wwk s VAL 72 Ca 0.00 -0.97 0.00 0.00 -2.93 0.00 0.00 61.98 58.08 1wwk s VAL 72 Cb 0.00 -2.40 0.00 0.00 -1.53 0.00 0.00 36.38 32.45 1wwk s VAL 72 CO 0.00 0.36 0.00 0.61 -3.33 0.00 0.00 175.10 172.74 1wwk n GLY 73 N 1.54 -1.14 1.75 6.54 0.00 -1.26 -4.91 105.19 107.71 1wwk n GLY 73 Ca -0.16 -1.43 -0.06 0.00 0.00 0.00 0.00 46.02 44.37 1wwk n GLY 73 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wwk n LEU 74 N -0.95 2.98 0.29 0.99 4.77 -1.26 -4.82 117.00 118.99 1wwk n LEU 74 Ca 0.00 -3.71 0.16 0.00 -0.03 0.00 0.00 56.01 52.43 1wwk n LEU 74 Cb 0.00 -0.15 0.85 0.00 -2.33 0.00 0.00 43.42 41.79 1wwk n LEU 74 CO 0.00 1.43 1.04 -2.24 -1.33 0.00 0.00 177.39 176.29 1wwk h ASP 75 N 1.78 0.00 -0.37 -1.43 3.04 -1.96 -1.83 116.42 115.64 1wwk h ASP 75 Ca 0.06 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.85 1wwk h ASP 75 Cb 1.40 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.69 1wwk h ASP 75 CO 0.33 0.06 0.00 -0.46 -2.04 0.00 0.00 179.24 177.13 1wwk n ASN 76 N -3.46 2.60 -4.20 4.15 6.94 -1.26 -4.86 115.26 115.16 1wwk n ASN 76 Ca -0.02 -1.91 -0.32 0.00 -0.02 0.00 0.00 54.58 52.31 1wwk n ASN 76 Cb 0.19 -0.25 -0.17 0.00 -2.36 0.00 0.00 39.78 37.20 1wwk n ASN 76 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1wwk s ILE 77 N -1.51 2.05 -1.09 1.53 1.01 -0.69 -0.29 121.20 122.21 1wwk s ILE 77 Ca 0.35 -1.00 -0.22 0.00 0.00 0.00 0.00 60.65 59.77 1wwk s ILE 77 Cb 0.19 -1.78 -0.00 0.00 0.01 0.00 0.00 42.46 40.87 1wwk s ILE 77 CO 0.26 0.56 1.76 -0.62 0.00 0.00 0.00 174.94 176.90 1wwk s ASP 78 N 0.48 5.86 0.55 3.58 -1.08 -0.56 -4.77 116.67 120.74 1wwk s ASP 78 Ca -0.15 -1.53 0.22 0.00 -0.52 0.00 0.00 52.55 50.57 1wwk s ASP 78 Cb -0.17 -2.57 1.47 0.00 -1.46 0.00 0.00 42.92 40.18 1wwk s ASP 78 CO 0.06 -2.14 2.16 -0.37 0.52 0.00 0.00 175.17 175.40 1wwk h VAL 79 N 6.49 0.80 -0.10 1.11 -1.51 -1.89 -2.27 116.25 118.87 1wwk h VAL 79 Ca 0.23 0.00 -0.06 0.00 -1.23 0.00 0.00 66.70 65.65 1wwk h VAL 79 Cb 0.96 0.96 -0.00 0.00 -2.13 0.00 0.00 31.29 31.08 1wwk h VAL 79 CO 1.33 0.00 -0.16 -0.33 -1.23 0.00 0.00 177.57 177.18 1wwk h GLU 80 N 0.00 0.29 -0.55 5.19 4.39 -2.00 -1.81 114.58 120.09 1wwk h GLU 80 Ca 0.03 -0.17 0.01 0.00 0.34 0.00 0.00 59.36 59.57 1wwk h GLU 80 Cb 0.14 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.77 1wwk h GLU 80 CO -0.00 0.75 0.37 0.00 -1.16 0.00 0.00 179.01 178.96 1wwk h ALA 81 N 0.54 0.70 0.00 3.43 0.00 -1.89 -1.29 119.26 120.76 1wwk h ALA 81 Ca 0.01 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.90 1wwk h ALA 81 Cb 0.72 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1wwk h ALA 81 CO 0.04 0.14 -0.12 0.00 0.00 0.00 0.00 179.25 179.31 1wwk h ALA 82 N 1.21 -0.13 -0.94 0.00 0.00 -1.41 -2.17 119.26 115.81 1wwk h ALA 82 Ca 0.20 0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.24 1wwk h ALA 82 Cb -0.08 0.20 -0.08 0.00 0.00 0.00 0.00 17.79 17.83 1wwk h ALA 82 CO -0.05 -0.61 0.57 -0.22 0.00 0.00 0.00 179.25 178.94 1wwk h LYS 83 N -0.20 0.87 -0.96 0.00 3.64 -0.91 -0.73 116.57 118.28 1wwk h LYS 83 Ca 0.04 -0.05 0.01 0.00 -1.27 0.00 0.00 60.65 59.38 1wwk h LYS 83 Cb 0.25 -0.20 -0.05 0.00 -0.41 0.00 0.00 32.23 31.83 1wwk h LYS 83 CO -0.12 0.57 0.64 0.93 -2.27 0.00 0.00 179.45 179.20 1wwk h GLU 84 N 0.89 1.25 -0.01 1.90 5.08 -0.62 -2.02 114.58 121.05 1wwk h GLU 84 Ca 0.47 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.75 1wwk h GLU 84 Cb 0.48 -0.28 0.00 0.00 0.50 0.00 0.00 28.75 29.45 1wwk h GLU 84 CO -0.27 0.83 -0.01 1.63 -1.00 0.00 0.00 179.01 180.18 1wwk n LYS 85 N -4.40 1.52 -1.99 2.33 4.76 -0.66 -4.92 118.16 114.81 1wwk n LYS 85 Ca 0.12 -0.79 -0.07 0.00 -2.87 0.00 0.00 58.31 54.70 1wwk n LYS 85 Cb 0.03 -1.48 -0.01 0.00 -1.84 0.00 0.00 35.03 31.73 1wwk n LYS 85 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1wwk n GLY 86 N 1.15 0.21 3.68 0.72 0.00 -0.69 -5.01 105.19 105.25 1wwk n GLY 86 Ca 0.20 -0.62 -0.38 0.00 0.00 0.00 0.00 46.02 45.21 1wwk n GLY 86 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wwk s ILE 87 N -2.33 5.18 0.36 -0.61 1.01 -0.37 -5.00 121.20 119.44 1wwk s ILE 87 Ca 0.00 0.79 -0.26 0.00 0.00 0.00 0.00 60.65 61.18 1wwk s ILE 87 Cb 0.00 -3.76 -0.09 0.00 0.01 0.00 0.00 42.46 38.62 1wwk s ILE 87 CO 0.00 0.25 1.12 -1.61 0.00 0.00 0.00 174.94 174.70 1wwk s GLU 88 N 1.25 4.26 -0.20 2.79 2.02 -0.74 -4.28 118.70 123.80 1wwk s GLU 88 Ca 0.21 1.76 0.01 0.00 0.02 0.00 0.00 54.97 56.97 1wwk s GLU 88 Cb -0.15 -2.80 0.04 0.00 0.10 0.00 0.00 34.13 31.32 1wwk s GLU 88 CO 0.08 -0.12 -0.12 0.08 0.02 0.00 0.00 175.26 175.21 1wwk s VAL 89 N -1.40 1.74 0.25 2.63 1.01 -1.26 -0.06 120.40 123.31 1wwk s VAL 89 Ca 0.53 -1.01 0.11 0.00 0.00 0.00 0.00 61.98 61.61 1wwk s VAL 89 Cb -0.29 -1.76 -0.05 0.00 0.00 0.00 0.00 36.38 34.28 1wwk s VAL 89 CO 0.37 0.23 -0.18 0.68 0.00 0.00 0.00 175.10 176.20 1wwk s VAL 90 N 1.37 2.25 0.16 2.92 -7.23 -0.11 -4.98 120.40 114.77 1wwk s VAL 90 Ca -0.00 -2.34 0.01 0.00 -1.81 0.00 0.00 61.98 57.84 1wwk s VAL 90 Cb -0.16 -2.21 -0.00 0.00 0.56 0.00 0.00 36.38 34.56 1wwk s VAL 90 CO -0.09 -0.45 0.18 -0.46 -0.31 0.00 0.00 175.10 173.97 1wwk n ASN 91 N -0.52 -0.49 -3.19 4.85 0.23 -1.26 -0.79 115.26 114.10 1wwk n ASN 91 Ca -0.06 -1.96 -0.22 0.00 -0.53 0.00 0.00 54.58 51.81 1wwk n ASN 91 Cb 0.60 0.99 -0.05 0.00 -2.08 0.00 0.00 39.78 39.24 1wwk n ASN 91 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1wwk n ALA 92 N -1.92 2.46 -0.12 -2.53 0.00 0.21 -4.81 120.51 113.79 1wwk n ALA 92 Ca -0.06 -3.56 -0.09 0.00 0.00 0.00 0.00 53.44 49.73 1wwk n ALA 92 Cb 0.28 -0.87 -0.01 0.00 0.00 0.00 0.00 19.45 18.85 1wwk n ALA 92 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1wwk h PRO 93 N 3.47 0.54 -0.28 0.00 0.13 -1.92 -2.55 132.00 131.38 1wwk h PRO 93 Ca 0.10 -0.09 0.08 0.00 -0.87 0.00 0.00 66.00 65.22 1wwk h PRO 93 Cb 0.89 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.91 1wwk h PRO 93 CO 0.52 0.50 0.39 0.00 -0.23 0.00 0.00 178.00 179.18 1wwk h ALA 94 N 1.02 1.88 -0.13 -0.56 0.00 -1.92 -2.15 119.26 117.40 1wwk h ALA 94 Ca 0.13 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1wwk h ALA 94 Cb 0.14 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1wwk h ALA 94 CO -0.01 -0.53 0.05 0.00 0.00 0.00 0.00 179.25 178.75 1wwk h ALA 95 N 1.49 1.85 -0.27 0.00 0.00 -1.80 -3.02 119.26 117.51 1wwk h ALA 95 Ca 0.13 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1wwk h ALA 95 Cb 0.91 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1wwk h ALA 95 CO -0.00 0.13 0.00 -1.13 0.00 0.00 0.00 179.25 178.24 1wwk n SER 96 N -4.48 2.68 -0.09 0.00 3.41 -0.81 -4.52 113.62 109.81 1wwk n SER 96 Ca -0.01 -1.90 -0.06 0.00 -0.26 0.00 0.00 58.87 56.64 1wwk n SER 96 Cb 0.11 -0.18 0.01 0.00 -0.26 0.00 0.00 64.21 63.89 1wwk n SER 96 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1wwk h SER 97 N 1.91 -0.13 -0.62 4.04 0.02 -1.57 -1.04 113.55 116.17 1wwk h SER 97 Ca 0.00 0.07 -0.06 0.00 -0.84 0.00 0.00 61.79 60.96 1wwk h SER 97 Cb 0.67 0.13 -0.03 0.00 0.14 0.00 0.00 62.40 63.31 1wwk h SER 97 CO 0.00 -0.03 0.14 -0.09 -1.14 0.00 0.00 176.83 175.71 1wwk h ARG 98 N 0.09 1.00 -0.47 3.45 9.65 -1.84 -1.91 114.38 124.35 1wwk h ARG 98 Ca 0.15 -0.25 -0.08 0.00 -1.10 0.00 0.00 59.98 58.70 1wwk h ARG 98 Cb 0.21 -0.13 -0.02 0.00 -1.39 0.00 0.00 29.97 28.64 1wwk h ARG 98 CO -0.26 0.91 -0.05 0.77 2.80 0.00 0.00 179.97 184.15 1wwk h SER 99 N 0.91 0.79 -0.36 -3.80 0.02 -1.72 0.91 113.55 110.30 1wwk h SER 99 Ca 0.19 -0.21 -0.11 0.00 -0.84 0.00 0.00 61.79 60.82 1wwk h SER 99 Cb 0.37 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.69 1wwk h SER 99 CO 0.00 0.89 -0.21 0.58 -1.14 0.00 0.00 176.83 176.95 1wwk h VAL 100 N 0.75 1.29 -0.58 2.27 2.07 -0.76 -1.61 116.25 119.68 1wwk h VAL 100 Ca 0.14 -1.35 -0.00 0.00 0.82 0.00 0.00 66.70 66.31 1wwk h VAL 100 Cb 0.52 1.37 -0.03 0.00 -1.52 0.00 0.00 31.29 31.63 1wwk h VAL 100 CO 0.03 0.44 0.35 0.00 0.02 0.00 0.00 177.57 178.41 1wwk h ALA 101 N 0.78 0.74 -0.62 1.67 0.00 -1.06 -1.03 119.26 119.74 1wwk h ALA 101 Ca 0.08 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1wwk h ALA 101 Cb 0.76 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1wwk h ALA 101 CO 0.06 0.22 0.22 0.93 0.00 0.00 0.00 179.25 180.68 1wwk h GLU 102 N 0.78 0.93 -0.51 0.00 5.08 -0.63 -1.48 114.58 118.74 1wwk h GLU 102 Ca 0.21 -0.17 -0.06 0.00 -1.00 0.00 0.00 59.36 58.34 1wwk h GLU 102 Cb -0.01 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.07 1wwk h GLU 102 CO -0.04 0.78 0.07 1.25 -1.00 0.00 0.00 179.01 180.07 1wwk h LEU 103 N 0.91 0.82 -0.60 1.33 5.85 -0.77 0.13 115.31 122.98 1wwk h LEU 103 Ca 0.21 -0.27 0.06 0.00 0.84 0.00 0.00 57.88 58.72 1wwk h LEU 103 Cb 0.22 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 40.98 1wwk h LEU 103 CO -0.01 0.88 0.31 0.00 -0.34 0.00 0.00 178.44 179.28 1wwk h ALA 104 N 0.97 0.79 -0.42 1.25 0.00 -0.69 0.43 119.26 121.59 1wwk h ALA 104 Ca 0.15 0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.97 1wwk h ALA 104 Cb 0.42 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1wwk h ALA 104 CO 0.01 -0.04 -0.21 0.28 0.00 0.00 0.00 179.25 179.30 1wwk h VAL 105 N 0.58 1.27 -0.62 0.00 2.07 -1.03 -1.07 116.25 117.44 1wwk h VAL 105 Ca 0.27 -1.33 -0.04 0.00 0.82 0.00 0.00 66.70 66.43 1wwk h VAL 105 Cb 0.20 1.16 -0.03 0.00 -1.52 0.00 0.00 31.29 31.10 1wwk h VAL 105 CO -0.19 0.45 0.24 1.23 0.02 0.00 0.00 177.57 179.32 1wwk h GLY 106 N 0.95 1.00 1.02 2.17 0.00 0.42 -1.41 103.07 107.21 1wwk h GLY 106 Ca 0.10 -0.55 -0.05 0.00 0.00 0.00 0.00 47.33 46.83 1wwk h GLY 106 CO 0.06 0.52 0.20 1.41 0.00 0.00 0.00 176.54 178.73 1wwk h LEU 107 N 0.87 0.91 -0.41 3.11 3.38 0.07 -0.94 115.31 122.29 1wwk h LEU 107 Ca 0.21 -0.20 0.04 0.00 0.09 0.00 0.00 57.88 58.01 1wwk h LEU 107 Cb 0.22 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 1wwk h LEU 107 CO -0.02 0.87 0.20 -0.03 0.09 0.00 0.00 178.44 179.55 1wwk h MET 108 N 0.90 0.39 -0.51 1.13 4.05 -0.86 -0.35 114.93 119.67 1wwk h MET 108 Ca 0.20 -0.02 -0.03 0.00 -0.28 0.00 0.00 59.70 59.57 1wwk h MET 108 Cb 0.29 -0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 30.98 1wwk h MET 108 CO -0.01 0.25 0.22 0.74 0.23 0.00 0.00 176.91 178.35 1wwk h PHE 109 N 0.40 0.76 -0.77 1.39 -1.00 -0.98 -0.07 116.94 116.66 1wwk h PHE 109 Ca 0.18 -0.05 -0.03 0.00 2.81 0.00 0.00 57.97 60.88 1wwk h PHE 109 Cb 0.10 -0.23 -0.04 0.00 3.61 0.00 0.00 35.95 39.40 1wwk h PHE 109 CO -0.11 0.62 0.36 1.03 -1.61 0.00 0.00 178.31 178.60 1wwk h SER 110 N 0.68 1.00 0.06 2.17 0.87 -0.64 -0.56 113.55 117.13 1wwk h SER 110 Ca 0.17 -0.12 -0.00 0.00 -1.23 0.00 0.00 61.79 60.61 1wwk h SER 110 Cb 0.17 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 61.87 1wwk h SER 110 CO -0.02 0.85 -0.03 0.58 -0.53 0.00 0.00 176.83 177.68 1wwk h VAL 111 N 1.09 1.24 -0.64 2.23 2.07 -0.94 -0.71 116.25 120.59 1wwk h VAL 111 Ca 0.26 -1.46 0.04 0.00 0.82 0.00 0.00 66.70 66.36 1wwk h VAL 111 Cb 0.12 2.14 -0.04 0.00 -1.52 0.00 0.00 31.29 32.00 1wwk h VAL 111 CO -0.03 0.34 0.42 0.00 0.02 0.00 0.00 177.57 178.32 1wwk h ALA 112 N 0.01 1.69 -0.42 1.67 0.00 -0.95 -2.48 119.26 118.77 1wwk h ALA 112 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1wwk h ALA 112 Cb 0.62 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1wwk h ALA 112 CO 0.01 0.23 0.00 0.54 0.00 0.00 0.00 179.25 180.04 1wwk n ARG 113 N -4.47 2.72 -3.88 0.00 5.12 -0.23 -1.66 116.66 114.27 1wwk n ARG 113 Ca 0.08 -2.16 -0.28 0.00 -1.93 0.00 0.00 57.85 53.57 1wwk n ARG 113 Cb 0.16 -1.34 0.02 0.00 -1.16 0.00 0.00 32.46 30.14 1wwk n ARG 113 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1wwk n LYS 114 N 0.81 -4.88 -0.02 5.56 5.02 -0.41 -4.79 118.16 119.47 1wwk n LYS 114 Ca 0.15 0.56 -0.16 0.00 -2.02 0.00 0.00 58.31 56.84 1wwk n LYS 114 Cb 0.47 -5.25 -0.11 0.00 -0.02 0.00 0.00 35.03 30.13 1wwk n LYS 114 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1wwk h ILE 115 N -1.94 1.46 -0.53 -0.18 2.04 -1.45 -1.53 117.51 115.38 1wwk h ILE 115 Ca -0.60 -1.92 -0.03 0.00 1.00 0.00 0.00 64.86 63.31 1wwk h ILE 115 Cb 1.37 2.56 -0.02 0.00 -0.74 0.00 0.00 36.82 39.99 1wwk h ILE 115 CO 0.64 0.55 0.20 0.00 0.00 0.00 0.00 178.15 179.54 1wwk h ALA 116 N 0.34 0.69 0.39 1.87 0.00 -1.91 -0.89 119.26 119.75 1wwk h ALA 116 Ca -0.04 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1wwk h ALA 116 Cb 1.10 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 1wwk h ALA 116 CO 0.08 0.32 -0.36 0.35 0.00 0.00 0.00 179.25 179.64 1wwk h PHE 117 N 0.72 -0.97 -0.79 0.00 3.57 -1.86 0.12 116.94 117.73 1wwk h PHE 117 Ca 0.18 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.70 1wwk h PHE 117 Cb 0.22 0.37 -0.04 0.00 2.79 0.00 0.00 35.95 39.30 1wwk h PHE 117 CO 0.01 -0.51 0.52 0.00 -2.23 0.00 0.00 178.31 176.10 1wwk h ALA 118 N -0.33 1.46 -0.31 2.41 0.00 -1.19 -0.35 119.26 120.96 1wwk h ALA 118 Ca -0.03 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 1wwk h ALA 118 Cb 0.68 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1wwk h ALA 118 CO -0.04 0.49 -0.15 0.22 0.00 0.00 0.00 179.25 179.76 1wwk h ASP 119 N 1.04 0.67 -0.55 0.00 3.58 -0.90 -1.17 116.42 119.08 1wwk h ASP 119 Ca 0.30 -0.41 0.03 0.00 0.42 0.00 0.00 57.03 57.37 1wwk h ASP 119 Cb -0.08 -0.18 -0.04 0.00 1.72 0.00 0.00 39.33 40.75 1wwk h ASP 119 CO -0.07 0.92 0.32 -0.09 -2.88 0.00 0.00 179.24 177.44 1wwk h ARG 120 N 0.41 0.61 -0.57 0.28 2.43 -0.17 -2.47 114.38 114.89 1wwk h ARG 120 Ca 0.07 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.11 1wwk h ARG 120 Cb 0.67 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.06 1wwk h ARG 120 CO 0.04 0.40 0.01 0.87 -1.51 0.00 0.00 179.97 179.79 1wwk h LYS 121 N 0.62 1.00 -0.84 0.20 1.79 -0.96 -3.00 116.57 115.40 1wwk h LYS 121 Ca 0.23 -0.31 0.10 0.00 -2.18 0.00 0.00 60.65 58.48 1wwk h LYS 121 Cb 0.05 -0.09 -0.07 0.00 -1.58 0.00 0.00 32.23 30.54 1wwk h LYS 121 CO -0.11 0.99 0.48 1.98 -1.08 0.00 0.00 179.45 181.71 1wwk h MET 122 N 0.89 0.78 0.00 3.15 4.05 -0.82 0.89 114.93 123.88 1wwk h MET 122 Ca 0.16 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.54 1wwk h MET 122 Cb 0.53 -0.18 0.00 0.00 -0.80 0.00 0.00 31.60 31.16 1wwk h MET 122 CO 0.03 0.52 0.00 0.54 0.23 0.00 0.00 176.91 178.23 1wwk n ARG 123 N -4.73 0.04 -0.48 0.39 1.74 -0.96 -1.50 116.66 111.16 1wwk n ARG 123 Ca 0.14 0.29 0.10 0.00 -0.77 0.00 0.00 57.85 57.61 1wwk n ARG 123 Cb 0.28 -1.58 0.33 0.00 -1.02 0.00 0.00 32.46 30.46 1wwk n ARG 123 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1wwk n GLU 124 N -1.67 3.23 -0.98 5.56 1.02 0.20 -4.91 120.64 123.10 1wwk n GLU 124 Ca 0.03 -2.74 0.00 0.00 -0.02 0.00 0.00 57.16 54.43 1wwk n GLU 124 Cb 0.18 -1.71 0.00 0.00 -0.02 0.00 0.00 31.44 29.89 1wwk n GLU 124 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1wwk n GLY 125 N 1.28 0.52 3.59 0.62 0.00 -0.56 -5.01 105.19 105.62 1wwk n GLY 125 Ca 0.24 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.92 1wwk n GLY 125 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wwk s VAL 126 N -2.04 4.51 -0.84 1.61 1.01 -0.57 -5.00 120.40 119.07 1wwk s VAL 126 Ca 0.00 -0.13 -0.15 0.00 0.00 0.00 0.00 61.98 61.70 1wwk s VAL 126 Cb 0.00 -3.02 0.21 0.00 0.00 0.00 0.00 36.38 33.57 1wwk s VAL 126 CO 0.00 0.47 0.82 0.86 0.00 0.00 0.00 175.10 177.25 1wwk s TRP 127 N 0.38 3.68 -0.55 5.22 -0.11 -1.26 -2.81 118.94 123.48 1wwk s TRP 127 Ca 0.01 -1.91 -0.02 0.00 1.22 0.00 0.00 56.10 55.39 1wwk s TRP 127 Cb -0.13 -3.88 0.25 0.00 -1.50 0.00 0.00 33.47 28.20 1wwk s TRP 127 CO 0.01 -1.06 2.27 0.00 -4.62 0.00 0.00 176.95 173.55 1wwk n ALA 128 N 4.32 6.12 -0.22 5.86 0.00 -1.26 -4.56 120.51 130.76 1wwk n ALA 128 Ca 0.15 -3.03 -0.05 0.00 0.00 0.00 0.00 53.44 50.52 1wwk n ALA 128 Cb 0.47 -1.84 0.06 0.00 0.00 0.00 0.00 19.45 18.13 1wwk n ALA 128 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1wwk h LYS 129 N 2.40 0.78 -0.57 0.00 3.64 -1.97 -1.49 116.57 119.37 1wwk h LYS 129 Ca 0.45 -0.05 0.08 0.00 -1.27 0.00 0.00 60.65 59.87 1wwk h LYS 129 Cb 0.64 -0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 32.25 1wwk h LYS 129 CO 1.12 0.51 0.38 1.57 -2.27 0.00 0.00 179.45 180.77 1wwk h LYS 130 N 0.80 0.42 -0.36 1.90 -0.00 -2.04 -1.92 116.57 115.37 1wwk h LYS 130 Ca 0.25 -0.03 0.00 0.00 -0.00 0.00 0.00 60.65 60.87 1wwk h LYS 130 Cb -0.02 -0.09 0.00 0.00 -0.00 0.00 0.00 32.23 32.11 1wwk h LYS 130 CO -0.08 0.28 0.00 -0.85 -0.00 0.00 0.00 179.45 178.79 1wwk n GLU 131 N -4.47 2.31 -0.69 0.07 0.00 -1.04 -4.17 120.64 112.65 1wwk n GLU 131 Ca 0.09 -2.07 0.04 0.00 0.00 0.00 0.00 57.16 55.21 1wwk n GLU 131 Cb 0.32 -1.39 0.29 0.00 0.00 0.00 0.00 31.44 30.66 1wwk n GLU 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1wwk n ALA 132 N 1.06 3.63 -1.98 -1.84 0.00 -0.59 -4.92 120.51 115.87 1wwk n ALA 132 Ca 0.15 -1.48 -0.42 0.00 0.00 0.00 0.00 53.44 51.69 1wwk n ALA 132 Cb 0.49 -1.11 -0.03 0.00 0.00 0.00 0.00 19.45 18.81 1wwk n ALA 132 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 1wwk s MET 133 N -2.33 4.18 0.00 0.00 0.00 -1.25 -4.79 119.30 115.10 1wwk s MET 133 Ca 0.41 2.22 0.00 0.00 0.00 0.00 0.00 55.69 58.32 1wwk s MET 133 Cb 0.32 -4.00 0.00 0.00 0.00 0.00 0.00 34.83 31.15 1wwk s MET 133 CO 0.12 -0.85 0.00 0.41 0.00 0.00 0.00 175.02 174.69 1wwk n GLY 134 N 4.16 5.46 3.16 2.11 0.00 -1.26 -4.95 105.19 113.86 1wwk n GLY 134 Ca 0.17 -1.73 -0.16 0.00 0.00 0.00 0.00 46.02 44.30 1wwk n GLY 134 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1wwk s ILE 135 N 1.65 0.97 0.08 -0.61 -4.36 -0.66 -5.02 121.20 113.25 1wwk s ILE 135 Ca 0.00 -1.37 -0.21 0.00 -0.26 0.00 0.00 60.65 58.81 1wwk s ILE 135 Cb 0.00 -1.08 -0.07 0.00 1.25 0.00 0.00 42.46 42.57 1wwk s ILE 135 CO 0.00 -0.35 0.63 -0.70 0.24 0.00 0.00 174.94 174.76 1wwk s GLU 136 N -2.02 4.33 0.01 0.37 2.12 -1.26 -4.64 118.70 117.60 1wwk s GLU 136 Ca -0.01 0.86 0.14 0.00 0.36 0.00 0.00 54.97 56.32 1wwk s GLU 136 Cb -0.08 -3.27 -0.18 0.00 0.26 0.00 0.00 34.13 30.86 1wwk s GLU 136 CO 0.01 0.55 0.76 -0.07 -0.54 0.00 0.00 175.26 175.97 1wwk h LEU 137 N 4.75 0.00 -9.53 2.70 3.38 -1.99 -3.45 115.31 111.17 1wwk h LEU 137 Ca -0.48 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 56.93 1wwk h LEU 137 Cb 1.21 0.00 0.05 0.00 0.09 0.00 0.00 40.66 42.01 1wwk h LEU 137 CO 0.66 0.81 0.90 1.21 0.09 0.00 0.00 178.44 182.11 1wwk n GLU 138 N -2.98 2.38 0.00 1.13 2.13 -1.26 -1.40 120.64 120.63 1wwk n GLU 138 Ca -0.13 0.86 0.00 0.00 0.66 0.00 0.00 57.16 58.55 1wwk n GLU 138 Cb 0.95 -2.67 0.00 0.00 0.27 0.00 0.00 31.44 30.00 1wwk n GLU 138 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1wwk n GLY 139 N 3.71 1.65 3.83 8.31 0.00 -0.33 -4.98 105.19 117.38 1wwk n GLY 139 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 1wwk n GLY 139 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wwk s LYS 140 N -0.51 3.12 -0.22 1.61 -0.14 -0.50 -4.51 119.74 118.60 1wwk s LYS 140 Ca 0.00 0.91 -0.10 0.00 -1.36 0.00 0.00 55.97 55.42 1wwk s LYS 140 Cb 0.00 -2.01 -0.05 0.00 -1.68 0.00 0.00 37.83 34.09 1wwk s LYS 140 CO 0.00 -0.96 0.13 0.99 -0.76 0.00 0.00 175.35 174.75 1wwk s THR 141 N -3.06 5.23 -0.15 2.17 2.01 -1.26 0.02 115.64 120.60 1wwk s THR 141 Ca 0.57 0.13 -0.03 0.00 0.31 0.00 0.00 61.69 62.67 1wwk s THR 141 Cb -0.13 -3.40 -0.03 0.00 0.01 0.00 0.00 72.50 68.95 1wwk s THR 141 CO 0.54 0.40 -0.05 -0.51 -0.69 0.00 0.00 174.62 174.32 1wwk s ILE 142 N 0.70 3.83 -0.32 1.82 2.07 0.14 0.01 121.20 129.45 1wwk s ILE 142 Ca 0.07 -0.39 -0.10 0.00 -1.41 0.00 0.00 60.65 58.82 1wwk s ILE 142 Cb -0.12 -2.66 -0.00 0.00 0.13 0.00 0.00 42.46 39.80 1wwk s ILE 142 CO 0.01 0.51 0.17 -0.83 -1.91 0.00 0.00 174.94 172.89 1wwk s GLY 143 N 0.25 1.89 -0.38 1.50 0.00 0.32 -0.78 107.32 110.12 1wwk s GLY 143 Ca -0.03 -1.43 -0.14 0.00 0.00 0.00 0.00 44.72 43.12 1wwk s GLY 143 CO 0.03 0.73 0.29 -0.42 0.00 0.00 0.00 173.10 173.73 1wwk s ILE 144 N 1.62 5.25 -0.47 0.90 1.01 0.23 -1.04 121.20 128.72 1wwk s ILE 144 Ca 0.05 -0.45 -0.17 0.00 0.00 0.00 0.00 60.65 60.08 1wwk s ILE 144 Cb -0.17 -3.86 0.05 0.00 0.01 0.00 0.00 42.46 38.49 1wwk s ILE 144 CO 0.07 -0.20 0.48 -0.63 0.00 0.00 0.00 174.94 174.66 1wwk s ILE 145 N 1.74 5.07 0.00 2.92 1.01 -0.73 -1.70 121.20 129.52 1wwk s ILE 145 Ca 0.06 -0.66 0.00 0.00 0.00 0.00 0.00 60.65 60.05 1wwk s ILE 145 Cb -0.18 -4.16 0.00 0.00 0.01 0.00 0.00 42.46 38.13 1wwk s ILE 145 CO 0.10 -0.61 0.00 0.61 0.00 0.00 0.00 174.94 175.05 1wwk n GLY 146 N 5.17 0.33 3.02 6.18 0.00 -1.03 -0.44 105.19 118.42 1wwk n GLY 146 Ca -0.09 -0.72 -0.43 0.00 0.00 0.00 0.00 46.02 44.77 1wwk n GLY 146 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1wwk n PHE 147 N 0.09 2.59 -0.21 1.61 7.35 -1.26 -4.02 117.46 123.60 1wwk n PHE 147 Ca 0.00 -2.71 0.00 0.00 -0.76 0.00 0.00 57.45 53.98 1wwk n PHE 147 Cb 0.00 -1.37 0.00 0.00 0.35 0.00 0.00 39.48 38.46 1wwk n PHE 147 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1wwk n GLY 148 N 1.60 4.25 0.25 7.13 0.00 -1.26 -4.75 105.19 112.40 1wwk n GLY 148 Ca 0.27 -1.67 -0.16 0.00 0.00 0.00 0.00 46.02 44.47 1wwk n GLY 148 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1wwk h ARG 149 N 0.00 -0.54 -0.15 1.61 3.08 -1.93 -0.34 114.38 116.11 1wwk h ARG 149 Ca 0.00 0.04 -0.19 0.00 0.07 0.00 0.00 59.98 59.90 1wwk h ARG 149 Cb 0.00 0.12 0.01 0.00 0.08 0.00 0.00 29.97 30.18 1wwk h ARG 149 CO 0.00 -0.36 -0.63 0.82 -1.07 0.00 0.00 179.97 178.73 1wwk h ILE 150 N -0.56 1.31 -0.90 2.04 2.04 -1.92 -2.92 117.51 116.60 1wwk h ILE 150 Ca -0.05 -1.87 0.08 0.00 1.00 0.00 0.00 64.86 64.01 1wwk h ILE 150 Cb 0.43 2.02 -0.07 0.00 -0.74 0.00 0.00 36.82 38.46 1wwk h ILE 150 CO 0.09 0.58 0.56 1.23 0.00 0.00 0.00 178.15 180.61 1wwk h GLY 151 N 0.39 1.39 0.96 5.37 0.00 -1.69 -0.44 103.07 109.05 1wwk h GLY 151 Ca -0.04 -0.39 0.01 0.00 0.00 0.00 0.00 47.33 46.90 1wwk h GLY 151 CO 0.13 0.24 0.06 -1.82 0.00 0.00 0.00 176.54 175.14 1wwk h TYR 152 N 0.98 0.10 -1.00 5.60 3.20 -1.01 -0.90 116.97 123.94 1wwk h TYR 152 Ca 0.41 0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.30 1wwk h TYR 152 Cb 0.26 -0.03 -0.05 0.00 1.54 0.00 0.00 36.73 38.44 1wwk h TYR 152 CO -0.03 0.06 0.66 1.96 -1.64 0.00 0.00 178.16 179.17 1wwk h GLN 153 N 0.12 1.30 -0.64 1.82 1.08 -1.14 0.09 115.11 117.73 1wwk h GLN 153 Ca 0.04 -0.08 -0.03 0.00 -1.45 0.00 0.00 58.65 57.13 1wwk h GLN 153 Cb 0.00 -0.29 -0.03 0.00 -0.05 0.00 0.00 27.48 27.11 1wwk h GLN 153 CO -0.03 0.86 0.28 0.28 -0.95 0.00 0.00 178.83 179.27 1wwk h VAL 154 N 1.34 1.23 -0.88 -0.54 2.07 -0.74 -1.72 116.25 117.02 1wwk h VAL 154 Ca 0.37 -0.70 0.03 0.00 0.82 0.00 0.00 66.70 67.22 1wwk h VAL 154 Cb -0.13 0.49 -0.05 0.00 -1.52 0.00 0.00 31.29 30.07 1wwk h VAL 154 CO -0.09 0.28 0.57 0.00 0.02 0.00 0.00 177.57 178.35 1wwk h ALA 155 N 1.12 1.15 -0.51 1.67 0.00 -0.20 0.45 119.26 122.94 1wwk h ALA 155 Ca 0.22 -0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.16 1wwk h ALA 155 Cb 0.17 -0.31 -0.06 0.00 0.00 0.00 0.00 17.79 17.59 1wwk h ALA 155 CO -0.02 0.43 0.16 -0.22 0.00 0.00 0.00 179.25 179.60 1wwk h LYS 156 N 1.12 0.31 -0.21 0.00 3.64 -0.45 -0.29 116.57 120.69 1wwk h LYS 156 Ca 0.34 -0.02 -0.18 0.00 -1.27 0.00 0.00 60.65 59.52 1wwk h LYS 156 Cb -0.02 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 31.73 1wwk h LYS 156 CO -0.11 0.20 -0.60 0.82 -2.27 0.00 0.00 179.45 177.50 1wwk h ILE 157 N 0.32 1.30 -0.49 2.00 2.04 -0.55 -2.42 117.51 119.71 1wwk h ILE 157 Ca 0.25 -1.83 0.05 0.00 1.00 0.00 0.00 64.86 64.32 1wwk h ILE 157 Cb 0.29 1.78 -0.04 0.00 -0.74 0.00 0.00 36.82 38.11 1wwk h ILE 157 CO -0.28 0.58 0.24 0.00 0.00 0.00 0.00 178.15 178.69 1wwk h ALA 158 N 0.81 0.63 -0.28 1.87 0.00 0.23 0.27 119.26 122.79 1wwk h ALA 158 Ca -0.00 0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.97 1wwk h ALA 158 Cb 1.18 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1wwk h ALA 158 CO 0.12 -0.11 0.19 -0.97 0.00 0.00 0.00 179.25 178.48 1wwk h ASN 159 N 0.48 0.20 0.48 0.00 -1.24 -0.97 0.85 115.58 115.38 1wwk h ASN 159 Ca 0.22 -0.00 -0.09 0.00 0.71 0.00 0.00 56.30 57.14 1wwk h ASN 159 Cb 0.14 -0.05 -0.01 0.00 0.73 0.00 0.00 38.32 39.13 1wwk h ASN 159 CO -0.16 0.14 -0.43 0.00 -1.29 0.00 0.00 177.43 175.69 1wwk h ALA 160 N 1.85 1.24 -0.17 1.57 0.00 -0.48 -2.58 119.26 120.69 1wwk h ALA 160 Ca 0.12 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1wwk h ALA 160 Cb 0.18 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1wwk h ALA 160 CO -0.02 0.54 0.00 1.28 0.00 0.00 0.00 179.25 181.04 1wwk n LEU 161 N -3.95 1.92 -0.96 0.00 4.77 0.23 -4.93 117.00 114.09 1wwk n LEU 161 Ca -0.02 -0.78 -0.09 0.00 -0.03 0.00 0.00 56.01 55.09 1wwk n LEU 161 Cb 0.46 -0.10 -0.01 0.00 -2.33 0.00 0.00 43.42 41.44 1wwk n LEU 161 CO 0.39 0.39 -0.11 0.61 -1.33 0.00 0.00 177.39 177.34 1wwk n GLY 162 N 1.19 0.29 3.88 -0.72 0.00 -0.82 -4.11 105.19 104.91 1wwk n GLY 162 Ca 0.17 -0.53 -0.31 0.00 0.00 0.00 0.00 46.02 45.35 1wwk n GLY 162 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1wwk s MET 163 N -4.00 3.74 -0.14 1.61 -1.94 -0.80 -1.18 119.30 116.58 1wwk s MET 163 Ca 0.00 0.16 -0.29 0.00 -1.71 0.00 0.00 55.69 53.85 1wwk s MET 163 Cb 0.00 -2.67 -0.01 0.00 2.01 0.00 0.00 34.83 34.16 1wwk s MET 163 CO 0.00 0.31 1.11 1.21 -0.01 0.00 0.00 175.02 177.64 1wwk s ASN 164 N -2.56 7.10 -0.23 3.03 2.47 0.10 -4.53 114.94 120.32 1wwk s ASN 164 Ca 0.46 1.59 -0.09 0.00 0.42 0.00 0.00 52.86 55.24 1wwk s ASN 164 Cb -0.11 -2.55 -0.04 0.00 -1.45 0.00 0.00 41.25 37.10 1wwk s ASN 164 CO 0.24 -0.60 0.12 -0.63 -3.72 0.00 0.00 177.10 172.51 1wwk s ILE 165 N 2.67 5.00 -0.11 -5.21 1.01 -1.26 0.26 121.20 123.56 1wwk s ILE 165 Ca 0.50 0.05 0.01 0.00 0.00 0.00 0.00 60.65 61.22 1wwk s ILE 165 Cb -0.20 -3.32 -0.01 0.00 0.01 0.00 0.00 42.46 38.94 1wwk s ILE 165 CO 0.15 0.36 -0.15 -0.76 0.00 0.00 0.00 174.94 174.54 1wwk s LEU 166 N 1.09 2.63 0.02 2.97 1.43 0.04 -2.58 118.68 124.27 1wwk s LEU 166 Ca 0.06 -0.34 0.08 0.00 -1.03 0.00 0.00 54.13 52.90 1wwk s LEU 166 Cb -0.14 -1.57 -0.02 0.00 0.03 0.00 0.00 46.19 44.49 1wwk s LEU 166 CO 0.04 0.20 -0.23 -0.76 0.23 0.00 0.00 176.35 175.83 1wwk s LEU 167 N 0.14 2.12 -0.18 1.79 1.43 -0.39 0.78 118.68 124.37 1wwk s LEU 167 Ca -0.08 -0.50 -0.03 0.00 -1.03 0.00 0.00 54.13 52.49 1wwk s LEU 167 Cb -0.15 -1.11 0.06 0.00 0.03 0.00 0.00 46.19 45.02 1wwk s LEU 167 CO 0.05 0.22 0.05 -0.47 0.23 0.00 0.00 176.35 176.44 1wwk s TYR 168 N -0.70 0.72 -0.06 0.29 5.04 -0.69 -1.43 117.35 120.53 1wwk s TYR 168 Ca 0.09 -0.64 -0.02 0.00 -2.44 0.00 0.00 57.07 54.06 1wwk s TYR 168 Cb -0.09 -0.90 0.04 0.00 0.35 0.00 0.00 41.96 41.36 1wwk s TYR 168 CO 0.01 -0.56 0.11 0.34 -1.34 0.00 0.00 175.55 174.11 1wwk s ASP 169 N 1.96 0.57 0.59 4.32 -1.08 -1.26 -2.46 116.67 119.31 1wwk s ASP 169 Ca 0.00 0.22 0.29 0.00 -0.52 0.00 0.00 52.55 52.54 1wwk s ASP 169 Cb -0.16 0.10 1.44 0.00 -1.46 0.00 0.00 42.92 42.83 1wwk s ASP 169 CO -0.08 -0.21 1.85 1.55 0.52 0.00 0.00 175.17 178.80 1wwk h PRO 170 N 7.99 0.00 -2.53 4.34 0.13 -1.99 -2.57 132.00 137.37 1wwk h PRO 170 Ca -0.24 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.29 1wwk h PRO 170 Cb 1.12 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.84 1wwk h PRO 170 CO 0.25 0.00 -0.69 0.66 -0.23 0.00 0.00 178.00 177.99 1wwk n TYR 171 N -3.70 2.45 -2.09 1.56 4.01 -1.26 -5.10 117.16 113.04 1wwk n TYR 171 Ca 0.10 -4.04 -0.42 0.00 -0.16 0.00 0.00 57.90 53.38 1wwk n TYR 171 Cb 0.75 -0.46 -0.03 0.00 -0.31 0.00 0.00 39.34 39.30 1wwk n TYR 171 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1wwk s PRO 172 N -1.63 4.29 -0.71 -0.72 0.04 -0.97 -4.98 135.00 130.33 1wwk s PRO 172 Ca 0.33 2.19 -0.17 0.00 0.04 0.00 0.00 61.00 63.39 1wwk s PRO 172 Cb 0.07 -3.19 0.15 0.00 0.04 0.00 0.00 34.50 31.57 1wwk s PRO 172 CO -0.11 -0.45 0.74 1.21 0.04 0.00 0.00 177.00 178.43 1wwk s ASN 173 N 0.88 6.45 0.25 6.66 3.84 -1.26 -4.95 114.94 126.81 1wwk s ASN 173 Ca 0.64 -2.04 -0.04 0.00 0.21 0.00 0.00 52.86 51.62 1wwk s ASN 173 Cb -0.39 -2.26 0.37 0.00 -0.55 0.00 0.00 41.25 38.42 1wwk s ASN 173 CO 0.34 -0.86 1.84 -0.33 -2.79 0.00 0.00 177.10 175.30 1wwk h GLU 174 N 8.57 0.93 0.25 0.43 4.39 -1.99 -2.14 114.58 125.02 1wwk h GLU 174 Ca -0.09 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.54 1wwk h GLU 174 Cb 1.06 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 29.51 1wwk h GLU 174 CO 0.97 0.61 -0.12 1.49 -1.16 0.00 0.00 179.01 180.80 1wwk h GLU 175 N 0.96 -0.32 -0.58 2.33 4.81 -2.00 -1.89 114.58 117.89 1wwk h GLU 175 Ca 0.40 0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.61 1wwk h GLU 175 Cb 0.24 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.66 1wwk h GLU 175 CO -0.20 -0.20 0.21 0.00 -0.73 0.00 0.00 179.01 178.09 1wwk h ARG 176 N -0.35 0.85 -0.48 1.92 3.08 -1.97 -2.21 114.38 115.22 1wwk h ARG 176 Ca -0.03 -0.14 -0.05 0.00 0.07 0.00 0.00 59.98 59.83 1wwk h ARG 176 Cb 0.27 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 1wwk h ARG 176 CO 0.06 0.71 0.11 0.00 -1.07 0.00 0.00 179.97 179.78 1wwk h ALA 177 N 1.40 1.29 -0.20 0.04 0.00 -1.22 -2.13 119.26 118.44 1wwk h ALA 177 Ca 0.19 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 1wwk h ALA 177 Cb 0.20 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1wwk h ALA 177 CO -0.01 0.50 -0.36 -0.22 0.00 0.00 0.00 179.25 179.16 1wwk h LYS 178 N 0.70 0.42 0.00 0.00 3.64 -0.76 0.25 116.57 120.83 1wwk h LYS 178 Ca 0.16 -0.19 -0.05 0.00 -1.27 0.00 0.00 60.65 59.30 1wwk h LYS 178 Cb 0.28 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 1wwk h LYS 178 CO -0.00 0.72 -0.22 0.93 -2.27 0.00 0.00 179.45 178.61 1wwk h GLU 179 N 0.36 0.00 -0.36 1.90 5.08 -0.91 -2.72 114.58 117.92 1wwk h GLU 179 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1wwk h GLU 179 Cb 0.80 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.05 1wwk h GLU 179 CO 0.06 0.22 0.00 1.33 -1.00 0.00 0.00 179.01 179.62 1wwk n VAL 180 N -4.25 1.34 -3.85 3.13 0.24 -1.07 -4.97 118.33 108.89 1wwk n VAL 180 Ca -0.02 -1.21 -0.28 0.00 -2.04 0.00 0.00 64.34 60.79 1wwk n VAL 180 Cb 0.28 0.31 0.03 0.00 -1.47 0.00 0.00 33.84 32.99 1wwk n VAL 180 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1wwk n ASN 181 N 0.37 -4.27 -4.88 -1.34 5.15 -0.56 -4.85 115.26 104.88 1wwk n ASN 181 Ca 0.15 -0.77 -0.36 0.00 -0.60 0.00 0.00 54.58 53.00 1wwk n ASN 181 Cb 0.57 -4.01 -0.06 0.00 -0.53 0.00 0.00 39.78 35.75 1wwk n ASN 181 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 1wwk s GLY 182 N -3.51 2.21 -0.16 8.20 0.00 0.78 -4.56 107.32 110.28 1wwk s GLY 182 Ca 0.54 -0.61 -0.03 0.00 0.00 0.00 0.00 44.72 44.61 1wwk s GLY 182 CO 0.82 -0.38 -0.06 0.54 0.00 0.00 0.00 173.10 174.02 1wwk s LYS 183 N -1.34 3.56 0.10 2.90 -0.14 -1.07 -4.55 119.74 119.20 1wwk s LYS 183 Ca 0.20 -0.57 -0.30 0.00 -1.36 0.00 0.00 55.97 53.94 1wwk s LYS 183 Cb -0.13 -2.88 -0.06 0.00 -1.68 0.00 0.00 37.83 33.09 1wwk s LYS 183 CO 0.10 0.15 1.01 -0.06 -0.76 0.00 0.00 175.35 175.79 1wwk s PHE 184 N 0.58 3.72 0.23 3.18 0.08 -1.26 -1.27 117.98 123.24 1wwk s PHE 184 Ca -0.04 1.71 -0.03 0.00 0.12 0.00 0.00 56.93 58.69 1wwk s PHE 184 Cb -0.15 -3.13 -0.03 0.00 -0.57 0.00 0.00 43.02 39.14 1wwk s PHE 184 CO 0.03 -0.07 0.24 0.14 -0.10 0.00 0.00 175.22 175.45 1wwk s VAL 185 N 0.19 0.00 0.77 -0.44 -7.23 -0.51 -4.93 120.40 108.25 1wwk s VAL 185 Ca 0.49 -1.85 -0.11 0.00 -1.81 0.00 0.00 61.98 58.70 1wwk s VAL 185 Cb -0.24 -2.44 0.06 0.00 0.56 0.00 0.00 36.38 34.31 1wwk s VAL 185 CO 0.30 0.00 1.08 1.51 -0.31 0.00 0.00 175.10 177.69 1wwk s ASP 186 N -3.14 4.62 0.31 4.85 -4.77 -1.26 -4.48 116.67 112.80 1wwk s ASP 186 Ca 0.35 1.55 0.00 0.00 -3.30 0.00 0.00 52.55 51.15 1wwk s ASP 186 Cb 0.05 -2.32 0.50 0.00 -1.09 0.00 0.00 42.92 40.06 1wwk s ASP 186 CO 0.13 -1.92 1.91 0.25 0.70 0.00 0.00 175.17 176.23 1wwk h LEU 187 N -1.05 0.75 0.06 2.11 5.85 -1.96 -2.31 115.31 118.77 1wwk h LEU 187 Ca -0.46 -0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.18 1wwk h LEU 187 Cb 1.24 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.08 1wwk h LEU 187 CO 0.56 0.65 -0.03 -0.08 -0.34 0.00 0.00 178.44 179.20 1wwk h GLU 188 N 0.83 -0.08 -0.67 1.25 4.81 -1.99 -0.98 114.58 117.75 1wwk h GLU 188 Ca 0.20 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.48 1wwk h GLU 188 Cb 0.11 0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.47 1wwk h GLU 188 CO -0.02 -0.03 0.40 1.15 -0.73 0.00 0.00 179.01 179.78 1wwk h THR 189 N -0.10 1.06 -0.01 0.32 2.02 -1.88 -0.84 112.91 113.47 1wwk h THR 189 Ca -0.01 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 66.91 1wwk h THR 189 Cb 0.08 0.21 -0.00 0.00 -1.74 0.00 0.00 68.15 66.70 1wwk h THR 189 CO 0.01 0.14 -0.00 0.25 0.37 0.00 0.00 175.52 176.29 1wwk h LEU 190 N 0.78 -0.01 -0.79 2.58 6.46 -1.15 -0.24 115.31 122.94 1wwk h LEU 190 Ca 0.28 0.00 0.04 0.00 -0.12 0.00 0.00 57.88 58.07 1wwk h LEU 190 Cb 0.06 0.01 -0.05 0.00 -0.73 0.00 0.00 40.66 39.95 1wwk h LEU 190 CO -0.13 -0.00 0.50 -0.07 -0.62 0.00 0.00 178.44 178.12 1wwk h LEU 191 N -0.00 0.82 -0.55 2.25 3.38 -0.81 -1.40 115.31 118.99 1wwk h LEU 191 Ca 0.00 -0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.82 1wwk h LEU 191 Cb 0.01 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1wwk h LEU 191 CO -0.01 0.56 -0.70 0.11 0.09 0.00 0.00 178.44 178.50 1wwk h LYS 192 N 0.97 0.15 -0.01 1.13 1.57 -0.91 -3.33 116.57 116.14 1wwk h LYS 192 Ca 0.32 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 1wwk h LYS 192 Cb 0.03 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1wwk h LYS 192 CO -0.12 0.79 -0.53 0.39 -0.57 0.00 0.00 179.45 179.41 1wwk n GLU 193 N -3.77 1.21 -3.12 3.15 1.02 -0.12 -4.58 120.64 114.42 1wwk n GLU 193 Ca -0.02 -0.77 -0.35 0.00 -0.02 0.00 0.00 57.16 56.00 1wwk n GLU 193 Cb 0.68 -1.42 -0.06 0.00 -0.02 0.00 0.00 31.44 30.62 1wwk n GLU 193 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1wwk s SER 194 N -2.41 6.97 0.03 1.62 0.01 -0.55 -4.79 113.70 114.59 1wwk s SER 194 Ca 0.15 1.37 0.22 0.00 1.31 0.00 0.00 55.95 59.00 1wwk s SER 194 Cb 0.16 -2.40 -0.24 0.00 0.21 0.00 0.00 66.02 63.75 1wwk s SER 194 CO 0.58 -0.03 0.64 0.47 0.41 0.00 0.00 173.24 175.31 1wwk n ASP 195 N 0.43 0.25 -3.70 2.44 8.00 0.10 -4.49 116.55 119.58 1wwk n ASP 195 Ca -0.01 0.04 -0.16 0.00 0.71 0.00 0.00 54.79 55.37 1wwk n ASP 195 Cb 0.52 1.56 -0.16 0.00 -0.02 0.00 0.00 41.12 43.02 1wwk n ASP 195 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1wwk s VAL 196 N -3.46 -0.16 -0.19 2.53 1.01 -0.93 -1.78 120.40 117.42 1wwk s VAL 196 Ca -0.05 0.30 -0.01 0.00 0.00 0.00 0.00 61.98 62.21 1wwk s VAL 196 Cb 0.13 -0.25 0.00 0.00 0.00 0.00 0.00 36.38 36.27 1wwk s VAL 196 CO 0.88 0.12 -0.12 -0.69 0.00 0.00 0.00 175.10 175.29 1wwk s VAL 197 N 1.84 2.73 -0.08 2.92 1.01 0.07 0.12 120.40 129.01 1wwk s VAL 197 Ca -0.01 -0.72 0.05 0.00 0.00 0.00 0.00 61.98 61.29 1wwk s VAL 197 Cb -0.12 -2.20 -0.00 0.00 0.00 0.00 0.00 36.38 34.06 1wwk s VAL 197 CO -0.05 0.49 -0.23 0.28 0.00 0.00 0.00 175.10 175.59 1wwk s THR 198 N 1.25 1.91 -0.20 3.92 -1.32 -0.20 -0.28 115.64 120.72 1wwk s THR 198 Ca 0.03 -0.95 -0.13 0.00 -1.21 0.00 0.00 61.69 59.43 1wwk s THR 198 Cb -0.14 -1.64 -0.05 0.00 -1.51 0.00 0.00 72.50 69.16 1wwk s THR 198 CO -0.06 0.53 0.27 -0.63 -2.21 0.00 0.00 174.62 172.52 1wwk s ILE 199 N 0.18 5.30 -0.35 5.08 -1.09 0.27 -1.77 121.20 128.83 1wwk s ILE 199 Ca -0.12 0.45 0.15 0.00 -2.23 0.00 0.00 60.65 58.90 1wwk s ILE 199 Cb -0.16 -3.61 0.41 0.00 -1.58 0.00 0.00 42.46 37.53 1wwk s ILE 199 CO 0.06 0.34 0.89 1.41 -1.23 0.00 0.00 174.94 176.41 1wwk n HIS 200 N 4.02 0.50 -4.37 3.97 8.25 0.41 -3.18 115.22 124.82 1wwk n HIS 200 Ca -0.12 -3.13 -0.25 0.00 -0.26 0.00 0.00 57.72 53.96 1wwk n HIS 200 Cb 0.52 -0.25 -0.09 0.00 1.12 0.00 0.00 29.99 31.29 1wwk n HIS 200 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1wwk s VAL 201 N -2.61 2.92 0.72 1.59 -7.23 -1.25 -4.44 120.40 110.11 1wwk s VAL 201 Ca 0.32 -2.05 -0.11 0.00 -1.81 0.00 0.00 61.98 58.33 1wwk s VAL 201 Cb 0.41 -2.51 0.03 0.00 0.56 0.00 0.00 36.38 34.87 1wwk s VAL 201 CO -0.01 -0.29 1.11 -2.16 -0.31 0.00 0.00 175.10 173.43 1wwk s PRO 202 N -3.31 2.64 -0.43 4.82 0.04 -1.26 -4.52 135.00 132.98 1wwk s PRO 202 Ca 0.28 0.34 -0.19 0.00 0.04 0.00 0.00 61.00 61.47 1wwk s PRO 202 Cb -0.07 -2.02 0.02 0.00 0.04 0.00 0.00 34.50 32.48 1wwk s PRO 202 CO 0.16 -1.16 0.55 -1.17 0.04 0.00 0.00 177.00 175.42 1wwk s LEU 203 N -5.39 4.67 0.22 -3.56 2.96 -1.26 -4.73 118.68 111.58 1wwk s LEU 203 Ca 0.59 -0.49 0.00 0.00 -0.22 0.00 0.00 54.13 54.01 1wwk s LEU 203 Cb -0.11 -2.57 -0.04 0.00 0.50 0.00 0.00 46.19 43.97 1wwk s LEU 203 CO 0.51 -0.68 0.13 0.68 -1.32 0.00 0.00 176.35 175.66 1wwk s VAL 204 N 2.49 0.16 0.33 1.68 -7.23 -1.26 -5.00 120.40 111.57 1wwk s VAL 204 Ca 0.18 -2.00 0.09 0.00 -1.81 0.00 0.00 61.98 58.43 1wwk s VAL 204 Cb -0.15 -2.54 0.32 0.00 0.56 0.00 0.00 36.38 34.57 1wwk s VAL 204 CO 0.16 0.00 1.80 -0.08 -0.31 0.00 0.00 175.10 176.67 1wwk h GLU 205 N 2.52 0.67 0.00 4.82 4.81 -1.97 0.61 114.58 126.05 1wwk h GLU 205 Ca -0.36 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 58.81 1wwk h GLU 205 Cb 1.25 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 30.47 1wwk h GLU 205 CO 0.54 0.45 -0.10 1.03 -0.73 0.00 0.00 179.01 180.20 1wwk h SER 206 N 0.69 0.00 -0.01 1.04 0.87 -1.96 -3.06 113.55 111.12 1wwk h SER 206 Ca 0.55 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.11 1wwk h SER 206 Cb 0.95 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.91 1wwk h SER 206 CO -0.32 0.10 -0.23 0.35 -0.53 0.00 0.00 176.83 176.20 1wwk n THR 207 N -3.75 0.00 -1.68 2.23 -2.24 0.10 -4.82 114.28 104.12 1wwk n THR 207 Ca -0.02 -0.38 -0.44 0.00 -2.27 0.00 0.00 64.05 60.93 1wwk n THR 207 Cb 0.21 1.16 -0.04 0.00 -2.10 0.00 0.00 70.33 69.56 1wwk n THR 207 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wwk n TYR 208 N -0.11 2.50 -3.55 4.78 9.36 -0.56 -0.91 117.16 128.67 1wwk n TYR 208 Ca 0.05 -0.04 -0.26 0.00 3.32 0.00 0.00 57.90 60.97 1wwk n TYR 208 Cb 0.27 -2.68 0.01 0.00 -0.63 0.00 0.00 39.34 36.30 1wwk n TYR 208 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 1wwk n HIS 209 N 5.33 -1.97 -0.17 2.98 8.25 0.11 -4.86 115.22 124.89 1wwk n HIS 209 Ca 0.19 0.63 -0.04 0.00 -0.26 0.00 0.00 57.72 58.24 1wwk n HIS 209 Cb 0.34 -3.46 0.06 0.00 1.12 0.00 0.00 29.99 28.05 1wwk n HIS 209 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1wwk h LEU 210 N -1.40 0.37 -8.29 2.41 5.85 0.11 -3.30 115.31 111.05 1wwk h LEU 210 Ca -0.50 0.03 -0.58 0.00 0.84 0.00 0.00 57.88 57.67 1wwk h LEU 210 Cb 1.33 -0.04 -0.11 0.00 0.37 0.00 0.00 40.66 42.22 1wwk h LEU 210 CO 0.60 0.25 0.90 -0.63 -0.34 0.00 0.00 178.44 179.22 1wwk s ILE 211 N -6.13 3.98 0.34 4.05 -1.09 -0.88 -4.86 121.20 116.60 1wwk s ILE 211 Ca -0.13 -0.00 0.00 0.00 -2.23 0.00 0.00 60.65 58.29 1wwk s ILE 211 Cb 0.14 -4.84 -0.00 0.00 -1.58 0.00 0.00 42.46 36.18 1wwk s ILE 211 CO 0.74 -1.71 0.00 -0.46 -1.23 0.00 0.00 174.94 172.28 1wwk n ASN 212 N 8.67 2.93 -0.22 3.58 0.23 -1.24 -1.30 115.26 127.91 1wwk n ASN 212 Ca 0.03 -2.50 0.02 0.00 -0.53 0.00 0.00 54.58 51.61 1wwk n ASN 212 Cb 0.48 0.24 0.13 0.00 -2.08 0.00 0.00 39.78 38.55 1wwk n ASN 212 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1wwk h GLU 213 N 0.00 0.21 -0.51 -3.83 4.81 -1.92 0.24 114.58 113.58 1wwk h GLU 213 Ca -0.28 -0.01 0.09 0.00 -0.13 0.00 0.00 59.36 59.02 1wwk h GLU 213 Cb 0.86 -0.05 -0.07 0.00 0.63 0.00 0.00 28.75 30.12 1wwk h GLU 213 CO 0.47 0.14 0.11 1.49 -0.73 0.00 0.00 179.01 180.49 1wwk h GLU 214 N 0.22 0.25 0.02 1.92 4.81 -1.97 -1.57 114.58 118.26 1wwk h GLU 214 Ca 0.35 -0.01 -0.21 0.00 -0.13 0.00 0.00 59.36 59.36 1wwk h GLU 214 Cb 0.57 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.87 1wwk h GLU 214 CO -0.48 0.16 -0.98 0.00 -0.73 0.00 0.00 179.01 176.98 1wwk h ARG 215 N 0.25 0.06 -0.73 1.92 3.08 -1.68 -3.15 114.38 114.15 1wwk h ARG 215 Ca 0.26 -0.09 -0.03 0.00 0.07 0.00 0.00 59.98 60.19 1wwk h ARG 215 Cb 0.34 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.39 1wwk h ARG 215 CO -0.32 0.99 0.34 -0.07 -1.07 0.00 0.00 179.97 179.83 1wwk h LEU 216 N 0.02 0.96 -1.93 3.04 3.38 -0.71 -2.02 115.31 118.06 1wwk h LEU 216 Ca -0.03 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 1wwk h LEU 216 Cb 1.70 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 42.20 1wwk h LEU 216 CO 0.14 0.83 -0.10 0.11 0.09 0.00 0.00 178.44 179.51 1wwk h LYS 217 N 1.02 0.00 0.00 1.13 1.57 -1.30 -2.17 116.57 116.82 1wwk h LYS 217 Ca 0.25 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.89 1wwk h LYS 217 Cb 0.14 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 1wwk h LYS 217 CO -0.03 0.10 -0.66 -0.07 -0.57 0.00 0.00 179.45 178.22 1wwk h LEU 218 N 0.00 0.00-10.25 2.94 3.38 -1.33 -3.46 115.31 106.59 1wwk h LEU 218 Ca -0.00 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.45 1wwk h LEU 218 Cb 0.34 0.00 0.16 0.00 0.09 0.00 0.00 40.66 41.26 1wwk h LEU 218 CO 0.01 0.66 0.30 -0.04 0.09 0.00 0.00 178.44 179.46 1wwk s MET 219 N -3.22 1.71 0.54 1.13 -1.94 -0.82 -4.01 119.30 112.70 1wwk s MET 219 Ca 0.01 1.50 -0.20 0.00 -1.71 0.00 0.00 55.69 55.28 1wwk s MET 219 Cb 0.11 -1.81 -0.06 0.00 2.01 0.00 0.00 34.83 35.08 1wwk s MET 219 CO 0.76 -2.10 1.16 0.15 -0.01 0.00 0.00 175.02 174.97 1wwk s LYS 220 N -4.50 3.34 0.53 2.03 1.02 -1.26 -4.89 119.74 116.01 1wwk s LYS 220 Ca 0.67 1.70 0.30 0.00 0.02 0.00 0.00 55.97 58.67 1wwk s LYS 220 Cb -0.23 -2.07 1.44 0.00 -0.52 0.00 0.00 37.83 36.45 1wwk s LYS 220 CO 0.53 -0.88 2.04 0.87 -0.92 0.00 0.00 175.35 176.99 1wwk h LYS 221 N 1.30 0.00 -0.03 1.68 1.57 -1.88 -1.53 116.57 117.68 1wwk h LYS 221 Ca -0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 1wwk h LYS 221 Cb 1.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.58 1wwk h LYS 221 CO 0.57 0.10 0.00 0.25 -0.57 0.00 0.00 179.45 179.80 1wwk n THR 222 N -3.40 0.01 -2.14 -0.16 -2.24 -1.26 -1.44 114.28 103.65 1wwk n THR 222 Ca -0.01 -0.28 -0.32 0.00 -2.27 0.00 0.00 64.05 61.17 1wwk n THR 222 Cb 0.27 0.59 -0.01 0.00 -2.10 0.00 0.00 70.33 69.09 1wwk n THR 222 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wwk s ALA 223 N -1.99 2.92 -0.06 6.98 0.00 -0.57 -4.54 121.76 124.50 1wwk s ALA 223 Ca 0.37 0.22 0.06 0.00 0.00 0.00 0.00 51.96 52.61 1wwk s ALA 223 Cb 0.21 -3.16 -0.01 0.00 0.00 0.00 0.00 23.12 20.15 1wwk s ALA 223 CO 0.33 -0.58 -0.24 0.42 0.00 0.00 0.00 175.76 175.69 1wwk s ILE 224 N -2.65 2.15 -0.16 0.00 1.01 -0.73 -0.48 121.20 120.34 1wwk s ILE 224 Ca 0.60 -1.03 -0.06 0.00 0.00 0.00 0.00 60.65 60.16 1wwk s ILE 224 Cb -0.13 -1.78 -0.04 0.00 0.01 0.00 0.00 42.46 40.52 1wwk s ILE 224 CO 0.38 0.57 0.03 -0.22 0.00 0.00 0.00 174.94 175.69 1wwk s LEU 225 N -0.22 3.62 -0.13 2.97 2.96 -0.55 -0.75 118.68 126.58 1wwk s LEU 225 Ca -0.02 0.03 0.03 0.00 -0.22 0.00 0.00 54.13 53.94 1wwk s LEU 225 Cb -0.13 -1.89 0.01 0.00 0.50 0.00 0.00 46.19 44.67 1wwk s LEU 225 CO 0.03 0.19 -0.22 -0.63 -1.32 0.00 0.00 176.35 174.41 1wwk s ILE 226 N 0.23 2.02 -0.25 6.68 -1.09 0.62 -0.03 121.20 129.38 1wwk s ILE 226 Ca 0.02 -0.96 0.00 0.00 -2.23 0.00 0.00 60.65 57.48 1wwk s ILE 226 Cb -0.13 -1.78 0.07 0.00 -1.58 0.00 0.00 42.46 39.04 1wwk s ILE 226 CO 0.01 0.54 0.00 0.21 -1.23 0.00 0.00 174.94 174.48 1wwk s ASN 227 N 0.79 3.80 0.00 3.58 2.47 -0.63 -0.57 114.94 124.38 1wwk s ASN 227 Ca -0.08 -1.30 0.01 0.00 0.42 0.00 0.00 52.86 51.91 1wwk s ASN 227 Cb -0.16 -1.05 0.02 0.00 -1.45 0.00 0.00 41.25 38.61 1wwk s ASN 227 CO -0.01 -0.30 0.96 0.35 -3.72 0.00 0.00 177.10 174.38 1wwk n THR 228 N 4.74 0.89 0.00 -5.21 -2.24 -1.24 -2.09 114.28 109.13 1wwk n THR 228 Ca -0.08 -0.94 0.00 0.00 -2.27 0.00 0.00 64.05 60.76 1wwk n THR 228 Cb 0.44 0.56 0.00 0.00 -2.10 0.00 0.00 70.33 69.23 1wwk n THR 228 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1wwk n SER 229 N -0.38 0.00 -4.07 3.42 3.41 -1.19 -4.90 113.62 109.90 1wwk n SER 229 Ca 0.01 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.48 1wwk n SER 229 Cb 0.23 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.07 1wwk n SER 229 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1wwk s ARG 230 N 0.00 0.55 0.07 4.33 1.81 -1.26 -4.92 118.95 119.53 1wwk s ARG 230 Ca 0.00 -0.78 -0.21 0.00 -1.72 0.00 0.00 55.73 53.02 1wwk s ARG 230 Cb 0.00 -0.33 -0.08 0.00 -0.45 0.00 0.00 34.95 34.09 1wwk s ARG 230 CO 0.00 0.06 1.34 0.78 -0.68 0.00 0.00 175.30 176.80 1wwk h GLY 231 N 4.47 -1.26 1.42 -3.53 0.00 -1.78 -2.04 103.07 100.33 1wwk h GLY 231 Ca -0.36 0.67 0.00 0.00 0.00 0.00 0.00 47.33 47.64 1wwk h GLY 231 CO 0.41 -0.35 0.21 -1.05 0.00 0.00 0.00 176.54 175.76 1wwk n PRO 232 N -4.35 0.09 0.24 4.80 -0.02 -1.26 -0.38 135.00 134.12 1wwk n PRO 232 Ca -0.04 0.56 0.09 0.00 -2.02 0.00 0.00 63.50 62.09 1wwk n PRO 232 Cb 0.24 -2.00 0.60 0.00 -0.02 0.00 0.00 33.50 32.31 1wwk n PRO 232 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1wwk h VAL 233 N 0.00 0.86 -3.31 -1.45 2.07 -1.57 0.31 116.25 113.16 1wwk h VAL 233 Ca 0.00 -0.67 -0.64 0.00 0.82 0.00 0.00 66.70 66.21 1wwk h VAL 233 Cb 0.42 1.39 -0.20 0.00 -1.52 0.00 0.00 31.29 31.38 1wwk h VAL 233 CO 0.00 0.17 -0.65 -0.69 0.02 0.00 0.00 177.57 176.42 1wwk s VAL 234 N -4.34 4.03 -0.69 2.57 1.01 0.49 -0.53 120.40 122.94 1wwk s VAL 234 Ca -0.03 -0.31 -0.27 0.00 0.00 0.00 0.00 61.98 61.37 1wwk s VAL 234 Cb 0.14 -2.77 0.01 0.00 0.00 0.00 0.00 36.38 33.76 1wwk s VAL 234 CO 0.64 0.50 1.53 -0.62 0.00 0.00 0.00 175.10 177.15 1wwk s ASP 235 N 0.28 5.79 0.20 3.32 -1.08 -0.42 -4.80 116.67 119.96 1wwk s ASP 235 Ca -0.02 -0.15 -0.13 0.00 -0.52 0.00 0.00 52.55 51.73 1wwk s ASP 235 Cb -0.14 -2.55 0.23 0.00 -1.46 0.00 0.00 42.92 39.00 1wwk s ASP 235 CO 0.03 -2.07 1.66 0.74 0.52 0.00 0.00 175.17 176.04 1wwk h THR 236 N 6.41 0.49 -0.75 1.71 2.02 -1.88 0.10 112.91 121.01 1wwk h THR 236 Ca -0.26 -0.02 0.02 0.00 0.77 0.00 0.00 66.41 66.93 1wwk h THR 236 Cb 1.09 0.43 -0.04 0.00 -1.74 0.00 0.00 68.15 67.89 1wwk h THR 236 CO 1.26 0.01 0.48 0.78 0.37 0.00 0.00 175.52 178.42 1wwk h ASN 237 N 0.06 0.81 -0.59 4.18 2.35 -1.99 0.12 115.58 120.53 1wwk h ASN 237 Ca 0.28 -0.01 -0.10 0.00 -0.55 0.00 0.00 56.30 55.93 1wwk h ASN 237 Cb 0.44 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.61 1wwk h ASN 237 CO -0.53 0.57 -0.00 0.00 -1.65 0.00 0.00 177.43 175.82 1wwk h ALA 238 N 1.31 0.86 -0.51 -0.83 0.00 -1.70 -1.80 119.26 116.58 1wwk h ALA 238 Ca 0.30 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1wwk h ALA 238 Cb -0.02 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1wwk h ALA 238 CO -0.10 0.67 0.15 1.25 0.00 0.00 0.00 179.25 181.22 1wwk h LEU 239 N 0.96 0.75 -0.60 0.00 5.85 -0.15 0.57 115.31 122.69 1wwk h LEU 239 Ca 0.17 -0.22 0.03 0.00 0.84 0.00 0.00 57.88 58.70 1wwk h LEU 239 Cb 0.56 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.35 1wwk h LEU 239 CO 0.03 0.77 0.36 0.58 -0.34 0.00 0.00 178.44 179.84 1wwk h VAL 240 N 0.70 1.06 -0.63 1.05 2.07 -0.61 -0.35 116.25 119.53 1wwk h VAL 240 Ca 0.16 -0.24 -0.04 0.00 0.82 0.00 0.00 66.70 67.40 1wwk h VAL 240 Cb 0.30 0.29 -0.03 0.00 -1.52 0.00 0.00 31.29 30.33 1wwk h VAL 240 CO -0.00 0.13 0.23 0.50 0.02 0.00 0.00 177.57 178.45 1wwk h LYS 241 N 0.70 0.96 -0.71 1.57 3.64 -0.96 -0.77 116.57 120.99 1wwk h LYS 241 Ca 0.24 -0.19 -0.04 0.00 -1.27 0.00 0.00 60.65 59.40 1wwk h LYS 241 Cb 0.04 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 31.68 1wwk h LYS 241 CO -0.11 0.82 0.30 0.00 -2.27 0.00 0.00 179.45 178.19 1wwk h ALA 242 N 1.09 1.18 -0.23 5.00 0.00 -0.28 -0.70 119.26 125.32 1wwk h ALA 242 Ca 0.21 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 1wwk h ALA 242 Cb 0.24 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1wwk h ALA 242 CO -0.01 0.60 -0.42 -0.07 0.00 0.00 0.00 179.25 179.35 1wwk h LEU 243 N 1.03 0.76 -0.23 0.00 3.38 -0.74 0.31 115.31 119.82 1wwk h LEU 243 Ca 0.24 -0.54 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 1wwk h LEU 243 Cb 0.18 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1wwk h LEU 243 CO -0.02 1.16 0.11 0.50 0.09 0.00 0.00 178.44 180.28 1wwk h LYS 244 N 0.40 0.33 -0.00 1.13 3.64 -0.94 -2.88 116.57 118.26 1wwk h LYS 244 Ca 0.01 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1wwk h LYS 244 Cb 1.01 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.77 1wwk h LYS 244 CO 0.09 0.33 -0.03 0.39 -2.27 0.00 0.00 179.45 177.97 1wwk n GLU 245 N -4.84 0.05 -2.57 1.90 -0.58 -0.29 -4.93 120.64 109.38 1wwk n GLU 245 Ca -0.03 -0.00 -0.04 0.00 -0.42 0.00 0.00 57.16 56.66 1wwk n GLU 245 Cb 0.09 -1.50 0.01 0.00 -0.57 0.00 0.00 31.44 29.48 1wwk n GLU 245 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1wwk n GLY 246 N 1.47 0.57 0.13 0.62 0.00 -0.41 -4.94 105.19 102.63 1wwk n GLY 246 Ca 0.08 -0.55 -0.01 0.00 0.00 0.00 0.00 46.02 45.54 1wwk n GLY 246 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1wwk h TRP 247 N -0.41 0.00 -3.83 1.61 6.55 -0.73 -3.45 115.95 115.70 1wwk h TRP 247 Ca -0.11 0.00 -0.29 0.00 0.95 0.00 0.00 58.89 59.45 1wwk h TRP 247 Cb 1.07 0.00 -0.15 0.00 -0.86 0.00 0.00 29.16 29.22 1wwk h TRP 247 CO 0.10 0.65 -0.65 0.96 -1.05 0.00 0.00 178.44 178.44 1wwk s ILE 248 N -3.21 0.61 -0.52 1.49 -4.36 -1.24 -3.53 121.20 110.43 1wwk s ILE 248 Ca 0.01 -1.98 0.23 0.00 -0.26 0.00 0.00 60.65 58.65 1wwk s ILE 248 Cb 0.10 -2.20 -0.01 0.00 1.25 0.00 0.00 42.46 41.61 1wwk s ILE 248 CO 0.76 -0.39 1.17 0.00 0.24 0.00 0.00 174.94 176.72 1wwk n ALA 249 N -0.27 2.93 0.00 2.27 0.00 0.37 -4.76 120.51 121.05 1wwk n ALA 249 Ca -0.05 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.11 1wwk n ALA 249 Cb 0.64 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.98 1wwk n ALA 249 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wwk n GLY 250 N 1.30 0.46 3.26 0.00 0.00 -1.20 -4.88 105.19 104.13 1wwk n GLY 250 Ca 0.02 -0.97 -0.13 0.00 0.00 0.00 0.00 46.02 44.94 1wwk n GLY 250 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wwk s ALA 251 N -2.00 -0.88 -0.18 4.61 0.00 -0.91 -1.48 121.76 120.92 1wwk s ALA 251 Ca 0.00 0.82 -0.01 0.00 0.00 0.00 0.00 51.96 52.77 1wwk s ALA 251 Cb 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 23.12 22.74 1wwk s ALA 251 CO 0.00 -0.20 -0.14 0.20 0.00 0.00 0.00 175.76 175.62 1wwk s GLY 252 N -0.30 1.48 -0.03 0.00 0.00 0.96 -1.46 107.32 107.98 1wwk s GLY 252 Ca -0.04 -1.13 0.03 0.00 0.00 0.00 0.00 44.72 43.57 1wwk s GLY 252 CO 0.02 0.21 -0.10 1.08 0.00 0.00 0.00 173.10 174.31 1wwk s LEU 253 N 1.13 1.80 -0.00 0.66 1.43 -0.07 -1.60 118.68 122.03 1wwk s LEU 253 Ca 0.01 -0.21 0.04 0.00 -1.03 0.00 0.00 54.13 52.94 1wwk s LEU 253 Cb -0.14 -0.61 -0.05 0.00 0.03 0.00 0.00 46.19 45.42 1wwk s LEU 253 CO -0.05 0.07 0.14 -0.67 0.23 0.00 0.00 176.35 176.08 1wwk n ASP 254 N 3.29 1.34 -4.17 2.29 2.03 -0.89 -0.81 116.55 119.64 1wwk n ASP 254 Ca -0.18 -0.42 -0.15 0.00 0.52 0.00 0.00 54.79 54.56 1wwk n ASP 254 Cb 0.54 1.06 -0.11 0.00 -0.72 0.00 0.00 41.12 41.89 1wwk n ASP 254 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1wwk s VAL 255 N -1.64 0.93 0.22 5.18 -7.23 -1.24 -0.45 120.40 116.16 1wwk s VAL 255 Ca 0.01 -1.56 -0.06 0.00 -1.81 0.00 0.00 61.98 58.55 1wwk s VAL 255 Cb 0.03 -1.27 -0.02 0.00 0.56 0.00 0.00 36.38 35.67 1wwk s VAL 255 CO 0.16 -0.51 0.28 -0.36 -0.31 0.00 0.00 175.10 174.37 1wwk s PHE 256 N -2.23 0.80 -1.01 2.82 0.08 -1.26 -4.47 117.98 112.71 1wwk s PHE 256 Ca 0.03 -1.08 0.29 0.00 0.12 0.00 0.00 56.93 56.29 1wwk s PHE 256 Cb -0.04 -0.23 1.24 0.00 -0.57 0.00 0.00 43.02 43.42 1wwk s PHE 256 CO 0.00 -0.79 1.93 0.39 -0.10 0.00 0.00 175.22 176.65 1wwk n GLU 257 N -0.31 0.01 -3.74 0.44 1.02 -1.26 -3.94 120.64 112.85 1wwk n GLU 257 Ca 0.00 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 56.89 1wwk n GLU 257 Cb 0.64 -1.50 -0.17 0.00 -0.02 0.00 0.00 31.44 30.39 1wwk n GLU 257 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1wwk s GLU 258 N -2.99 0.61 -0.11 3.49 2.02 -1.26 -4.95 118.70 115.51 1wwk s GLU 258 Ca 0.14 -0.20 -0.01 0.00 0.02 0.00 0.00 54.97 54.93 1wwk s GLU 258 Cb 0.19 -1.65 0.03 0.00 0.10 0.00 0.00 34.13 32.80 1wwk s GLU 258 CO 0.53 -0.51 -0.04 -1.21 0.02 0.00 0.00 175.26 174.05 1wwk s GLU 259 N 1.92 1.16 0.97 1.61 2.02 -1.26 -2.82 118.70 122.29 1wwk s GLU 259 Ca 0.02 -0.16 -0.12 0.00 0.02 0.00 0.00 54.97 54.73 1wwk s GLU 259 Cb -0.15 -1.44 0.17 0.00 0.10 0.00 0.00 34.13 32.81 1wwk s GLU 259 CO -0.07 -0.31 1.09 -1.25 0.02 0.00 0.00 175.26 174.73 1wwk s PRO 260 N 1.80 0.67 0.21 0.39 0.04 -1.26 -5.10 135.00 131.75 1wwk s PRO 260 Ca 0.04 0.95 -0.30 0.00 0.04 0.00 0.00 61.00 61.74 1wwk s PRO 260 Cb -0.13 -1.73 -0.09 0.00 0.04 0.00 0.00 34.50 32.59 1wwk s PRO 260 CO -0.07 -2.68 1.23 -1.17 0.04 0.00 0.00 177.00 174.35 1wwk s LEU 261 N -6.53 4.45 0.76 -3.56 2.96 -1.13 -4.99 118.68 110.64 1wwk s LEU 261 Ca 0.65 2.32 -0.14 0.00 -0.22 0.00 0.00 54.13 56.75 1wwk s LEU 261 Cb -0.20 -3.61 0.06 0.00 0.50 0.00 0.00 46.19 42.93 1wwk s LEU 261 CO 0.59 -0.41 1.17 -2.16 -1.32 0.00 0.00 176.35 174.23 1wwk s PRO 262 N -0.45 2.03 0.36 0.98 0.04 -1.26 -4.93 135.00 131.77 1wwk s PRO 262 Ca 0.53 1.61 -0.28 0.00 0.04 0.00 0.00 61.00 62.90 1wwk s PRO 262 Cb -0.34 -1.84 -0.11 0.00 0.04 0.00 0.00 34.50 32.25 1wwk s PRO 262 CO 0.39 -1.89 1.46 1.17 0.04 0.00 0.00 177.00 178.17 1wwk n LYS 263 N -3.04 2.57 -2.50 4.56 4.81 -1.26 -2.37 118.16 120.93 1wwk n LYS 263 Ca 0.12 0.90 -0.18 0.00 -0.87 0.00 0.00 58.31 58.28 1wwk n LYS 263 Cb 0.51 -2.61 -0.00 0.00 0.02 0.00 0.00 35.03 32.95 1wwk n LYS 263 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1wwk n ASP 264 N 0.69 -5.21 -4.77 3.14 8.00 -1.26 -4.94 116.55 112.19 1wwk n ASP 264 Ca 0.03 0.02 -0.41 0.00 0.71 0.00 0.00 54.79 55.13 1wwk n ASP 264 Cb 0.38 -4.35 0.00 0.00 -0.02 0.00 0.00 41.12 37.13 1wwk n ASP 264 CO 0.00 0.00 0.00 1.57 -0.39 0.00 0.00 177.20 178.38 1wwk n HIS 265 N -3.85 2.91 -0.35 1.24 -0.00 -1.00 -4.87 115.22 109.30 1wwk n HIS 265 Ca -0.20 0.45 0.26 0.00 -0.00 0.00 0.00 57.72 58.24 1wwk n HIS 265 Cb 0.65 -2.51 0.51 0.00 -0.00 0.00 0.00 29.99 28.64 1wwk n HIS 265 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 1wwk h PRO 266 N 2.81 0.28 -0.11 1.57 0.11 -1.92 -0.48 132.00 134.27 1wwk h PRO 266 Ca -0.51 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.57 1wwk h PRO 266 Cb 1.25 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1wwk h PRO 266 CO 0.63 0.19 -0.03 -0.07 -0.21 0.00 0.00 178.00 178.51 1wwk h LEU 267 N 0.29 0.14 0.00 2.35 3.38 -1.98 -2.50 115.31 116.99 1wwk h LEU 267 Ca 0.73 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.69 1wwk h LEU 267 Cb 1.82 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.53 1wwk h LEU 267 CO -0.53 0.20 0.00 0.35 0.09 0.00 0.00 178.44 178.55 1wwk n THR 268 N -4.41 0.00 0.91 0.22 -2.24 -0.19 -3.10 114.28 105.48 1wwk n THR 268 Ca -0.01 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.87 1wwk n THR 268 Cb 0.17 -0.52 0.04 0.00 -2.10 0.00 0.00 70.33 67.92 1wwk n THR 268 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1wwk n LYS 269 N -0.91 1.69 -3.43 -0.78 4.76 -0.94 -4.94 118.16 113.61 1wwk n LYS 269 Ca 0.16 -1.36 -0.37 0.00 -2.87 0.00 0.00 58.31 53.86 1wwk n LYS 269 Cb 0.07 -1.42 -0.06 0.00 -1.84 0.00 0.00 35.03 31.78 1wwk n LYS 269 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 1wwk s PHE 270 N -2.07 3.52 -0.49 2.13 0.08 -1.18 -4.96 117.98 115.00 1wwk s PHE 270 Ca 0.21 0.79 0.25 0.00 0.12 0.00 0.00 56.93 58.30 1wwk s PHE 270 Cb 0.17 -2.44 0.66 0.00 -0.57 0.00 0.00 43.02 40.84 1wwk s PHE 270 CO 0.40 0.26 1.71 -0.44 -0.10 0.00 0.00 175.22 177.05 1wwk h ASP 271 N 6.45 0.00 -0.94 1.36 3.32 -1.92 -3.27 116.42 121.42 1wwk h ASP 271 Ca -0.42 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.10 1wwk h ASP 271 Cb 1.18 0.00 -0.29 0.00 0.22 0.00 0.00 39.33 40.44 1wwk h ASP 271 CO 0.74 0.00 0.68 -0.46 -1.72 0.00 0.00 179.24 178.48 1wwk n ASN 272 N -2.74 4.75 -4.08 6.45 6.94 -1.26 -4.78 115.26 120.54 1wwk n ASN 272 Ca 0.04 -3.57 -0.14 0.00 -0.02 0.00 0.00 54.58 50.90 1wwk n ASN 272 Cb 0.45 -0.87 -0.11 0.00 -2.36 0.00 0.00 39.78 36.89 1wwk n ASN 272 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 1wwk s VAL 273 N -3.50 0.63 -0.12 3.53 -7.23 -1.24 -2.14 120.40 110.34 1wwk s VAL 273 Ca 0.56 -1.15 0.01 0.00 -1.81 0.00 0.00 61.98 59.58 1wwk s VAL 273 Cb 0.46 -0.72 0.02 0.00 0.56 0.00 0.00 36.38 36.70 1wwk s VAL 273 CO 0.07 -0.38 -0.12 -0.69 -0.31 0.00 0.00 175.10 173.67 1wwk s VAL 274 N -1.47 1.33 -0.09 1.32 1.01 -0.53 -4.94 120.40 117.03 1wwk s VAL 274 Ca -0.08 -0.51 0.02 0.00 0.00 0.00 0.00 61.98 61.42 1wwk s VAL 274 Cb -0.09 -1.26 -0.02 0.00 0.00 0.00 0.00 36.38 35.01 1wwk s VAL 274 CO 0.00 0.41 -0.16 -0.76 0.00 0.00 0.00 175.10 174.60 1wwk s LEU 275 N 1.34 2.58 0.05 3.92 1.43 -1.26 -0.89 118.68 125.85 1wwk s LEU 275 Ca -0.00 -0.33 0.06 0.00 -1.03 0.00 0.00 54.13 52.83 1wwk s LEU 275 Cb -0.14 -1.55 -0.02 0.00 0.03 0.00 0.00 46.19 44.51 1wwk s LEU 275 CO -0.06 0.23 -0.18 0.42 0.23 0.00 0.00 176.35 176.99 1wwk s THR 276 N -0.05 1.46 -1.36 5.49 -4.23 0.01 -4.99 115.64 111.97 1wwk s THR 276 Ca -0.04 -1.15 -0.10 0.00 -1.18 0.00 0.00 61.69 59.22 1wwk s THR 276 Cb -0.14 -1.29 -0.07 0.00 1.34 0.00 0.00 72.50 72.34 1wwk s THR 276 CO 0.04 0.11 2.58 -0.81 -0.54 0.00 0.00 174.62 176.00 1wwk n PRO 277 N 1.81 3.03 -3.78 3.99 -0.04 -1.26 -4.26 135.00 134.49 1wwk n PRO 277 Ca -0.18 -2.03 -0.27 0.00 -0.04 0.00 0.00 63.50 60.98 1wwk n PRO 277 Cb 0.54 -2.77 0.02 0.00 -0.04 0.00 0.00 33.50 31.24 1wwk n PRO 277 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 1wwk n HIS 278 N 4.29 -1.82 -0.92 0.54 -0.00 0.40 -4.90 115.22 112.82 1wwk n HIS 278 Ca 0.64 0.63 0.08 0.00 -0.00 0.00 0.00 57.72 59.07 1wwk n HIS 278 Cb 0.23 -3.72 0.30 0.00 -0.00 0.00 0.00 29.99 26.80 1wwk n HIS 278 CO 0.00 0.00 0.00 0.44 -0.00 0.00 0.00 176.34 176.78 1wwk n ILE 279 N -4.27 2.36 -0.33 3.57 -5.35 -1.26 -4.69 119.36 109.39 1wwk n ILE 279 Ca -0.21 -1.68 0.10 0.00 -0.27 0.00 0.00 62.75 60.70 1wwk n ILE 279 Cb 0.64 -0.21 0.28 0.00 -1.74 0.00 0.00 39.64 38.61 1wwk n ILE 279 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 1wwk h GLY 280 N 2.56 1.63 -2.50 3.28 0.00 -1.90 -0.21 103.07 105.93 1wwk h GLY 280 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.01 1wwk h GLY 280 CO 0.29 -0.04 0.00 0.00 0.00 0.00 0.00 176.54 176.79 1wwk n ALA 281 N -2.37 2.40 -1.89 3.60 0.00 -1.26 -2.28 120.51 118.70 1wwk n ALA 281 Ca 0.21 -1.17 -0.42 0.00 0.00 0.00 0.00 53.44 52.06 1wwk n ALA 281 Cb 0.51 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 19.02 1wwk n ALA 281 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1wwk n SER 282 N 1.52 4.43 -4.10 0.00 7.64 -0.09 -4.41 113.62 118.61 1wwk n SER 282 Ca 0.23 -2.91 -0.18 0.00 1.01 0.00 0.00 58.87 57.01 1wwk n SER 282 Cb 0.59 -1.60 -0.13 0.00 -1.01 0.00 0.00 64.21 62.06 1wwk n SER 282 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1wwk s THR 283 N 2.30 0.89 0.36 0.44 -4.23 -1.26 -5.03 115.64 109.10 1wwk s THR 283 Ca 0.46 -0.91 0.04 0.00 -1.18 0.00 0.00 61.69 60.10 1wwk s THR 283 Cb 0.13 -0.83 0.27 0.00 1.34 0.00 0.00 72.50 73.42 1wwk s THR 283 CO -0.06 -0.06 1.99 -0.37 -0.54 0.00 0.00 174.62 175.58 1wwk h VAL 284 N 4.58 1.11 -0.22 2.29 -1.51 -1.99 -1.08 116.25 119.41 1wwk h VAL 284 Ca -0.36 -0.28 -0.02 0.00 -1.23 0.00 0.00 66.70 64.81 1wwk h VAL 284 Cb 1.19 0.22 -0.01 0.00 -2.13 0.00 0.00 31.29 30.56 1wwk h VAL 284 CO 0.44 0.15 0.07 -0.33 -1.23 0.00 0.00 177.57 176.67 1wwk h GLU 285 N 0.82 0.35 -0.52 5.19 3.07 -1.95 -0.56 114.58 120.97 1wwk h GLU 285 Ca 0.26 -0.07 -0.09 0.00 -0.50 0.00 0.00 59.36 58.96 1wwk h GLU 285 Cb 0.04 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 27.88 1wwk h GLU 285 CO -0.07 0.43 -0.02 0.00 -1.40 0.00 0.00 179.01 177.95 1wwk h ALA 286 N 0.90 0.98 -0.46 3.43 0.00 -1.66 -0.14 119.26 122.30 1wwk h ALA 286 Ca 0.07 -0.29 -0.13 0.00 0.00 0.00 0.00 54.91 54.56 1wwk h ALA 286 Cb 0.23 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1wwk h ALA 286 CO -0.00 0.62 -0.22 1.96 0.00 0.00 0.00 179.25 181.61 1wwk h GLN 287 N 0.83 0.95 -0.28 0.00 1.08 -1.08 -2.04 115.11 114.58 1wwk h GLN 287 Ca 0.15 -0.41 -0.05 0.00 -1.45 0.00 0.00 58.65 56.89 1wwk h GLN 287 Cb 0.52 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.92 1wwk h GLN 287 CO 0.03 1.08 -0.02 1.49 -0.95 0.00 0.00 178.83 180.45 1wwk h GLU 288 N 0.79 0.50 -0.96 1.46 4.81 -0.96 -2.83 114.58 117.39 1wwk h GLU 288 Ca 0.10 -0.17 0.06 0.00 -0.13 0.00 0.00 59.36 59.22 1wwk h GLU 288 Cb 0.79 -0.04 -0.06 0.00 0.63 0.00 0.00 28.75 30.07 1wwk h GLU 288 CO 0.07 0.68 0.62 -0.09 -0.73 0.00 0.00 179.01 179.56 1wwk h ARG 289 N 0.28 1.08 -0.45 1.92 2.43 -0.93 -1.11 114.38 117.60 1wwk h ARG 289 Ca 0.08 -0.07 -0.12 0.00 -0.81 0.00 0.00 59.98 59.06 1wwk h ARG 289 Cb 0.47 -0.24 -0.02 0.00 -0.42 0.00 0.00 29.97 29.76 1wwk h ARG 289 CO 0.02 0.72 -0.18 0.00 -1.51 0.00 0.00 179.97 179.02 1wwk h ALA 290 N 1.48 0.83 -0.34 2.80 0.00 -1.29 0.82 119.26 123.57 1wwk h ALA 290 Ca 0.41 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1wwk h ALA 290 Cb 0.18 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1wwk h ALA 290 CO -0.16 0.65 -0.06 0.78 0.00 0.00 0.00 179.25 180.46 1wwk h GLY 291 N 0.94 0.69 1.04 0.00 0.00 -1.13 -2.22 103.07 102.39 1wwk h GLY 291 Ca 0.11 -0.55 -0.10 0.00 0.00 0.00 0.00 47.33 46.79 1wwk h GLY 291 CO 0.05 0.51 -0.06 -2.08 0.00 0.00 0.00 176.54 174.96 1wwk h VAL 292 N 0.43 1.27 -0.16 4.60 2.07 -1.13 -1.86 116.25 121.47 1wwk h VAL 292 Ca 0.09 -1.18 0.00 0.00 0.82 0.00 0.00 66.70 66.43 1wwk h VAL 292 Cb 0.55 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 1wwk h VAL 292 CO 0.03 0.41 0.10 -0.08 0.02 0.00 0.00 177.57 178.06 1wwk h GLU 293 N 0.79 0.21 0.00 1.57 4.81 -0.74 -1.49 114.58 119.72 1wwk h GLU 293 Ca 0.13 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.26 1wwk h GLU 293 Cb 0.61 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.93 1wwk h GLU 293 CO 0.04 0.14 -0.45 -0.39 -0.73 0.00 0.00 179.01 177.62 1wwk h VAL 294 N 0.21 1.10 -0.47 0.32 -1.51 -1.39 -1.97 116.25 112.54 1wwk h VAL 294 Ca 0.06 -1.68 -0.04 0.00 -1.23 0.00 0.00 66.70 63.80 1wwk h VAL 294 Cb -0.02 1.97 -0.02 0.00 -2.13 0.00 0.00 31.29 31.09 1wwk h VAL 294 CO -0.01 0.44 0.12 0.00 -1.23 0.00 0.00 177.57 176.89 1wwk h ALA 295 N 1.55 0.62 -0.56 5.19 0.00 -0.96 0.33 119.26 125.42 1wwk h ALA 295 Ca -0.00 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 1wwk h ALA 295 Cb 0.93 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 1wwk h ALA 295 CO 0.06 0.30 0.16 0.93 0.00 0.00 0.00 179.25 180.70 1wwk h GLU 296 N 0.63 0.88 -0.73 0.00 5.08 -1.07 -0.33 114.58 119.04 1wwk h GLU 296 Ca 0.15 -0.20 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1wwk h GLU 296 Cb 0.31 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 1wwk h GLU 296 CO 0.00 0.81 0.33 0.87 -1.00 0.00 0.00 179.01 180.02 1wwk h LYS 297 N 0.79 1.05 -0.19 2.33 1.57 -1.09 -0.37 116.57 120.66 1wwk h LYS 297 Ca 0.18 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1wwk h LYS 297 Cb 0.31 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 1wwk h LYS 297 CO -0.00 0.82 0.07 0.28 -0.57 0.00 0.00 179.45 180.05 1wwk h VAL 298 N 1.04 1.17 -0.71 0.50 2.07 -0.47 -1.94 116.25 117.91 1wwk h VAL 298 Ca 0.25 -0.53 0.03 0.00 0.82 0.00 0.00 66.70 67.27 1wwk h VAL 298 Cb 0.14 1.17 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 1wwk h VAL 298 CO -0.03 0.17 0.44 0.58 0.02 0.00 0.00 177.57 178.75 1wwk h VAL 299 N 0.14 1.10 -0.58 2.57 2.07 -0.63 -1.16 116.25 119.77 1wwk h VAL 299 Ca 0.06 -0.30 -0.04 0.00 0.82 0.00 0.00 66.70 67.24 1wwk h VAL 299 Cb 0.20 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.10 1wwk h VAL 299 CO -0.00 0.16 0.20 0.50 0.02 0.00 0.00 177.57 178.44 1wwk h LYS 300 N 0.87 0.89 0.36 1.57 3.64 -0.85 -1.17 116.57 121.87 1wwk h LYS 300 Ca 0.28 -0.18 -0.02 0.00 -1.27 0.00 0.00 60.65 59.46 1wwk h LYS 300 Cb 0.01 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.70 1wwk h LYS 300 CO -0.11 0.79 -0.17 0.82 -2.27 0.00 0.00 179.45 178.51 1wwk h ILE 301 N 0.81 0.65 0.00 2.00 2.04 -1.05 -2.34 117.51 119.62 1wwk h ILE 301 Ca 0.19 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.73 1wwk h ILE 301 Cb 0.26 0.81 0.00 0.00 -0.74 0.00 0.00 36.82 37.15 1wwk h ILE 301 CO -0.01 0.06 0.00 0.18 0.00 0.00 0.00 178.15 178.38 1wwk n LEU 302 N -5.23 0.03 -0.14 1.44 4.77 -0.46 -3.94 117.00 113.47 1wwk n LEU 302 Ca -0.10 0.86 -0.06 0.00 -0.03 0.00 0.00 56.01 56.68 1wwk n LEU 302 Cb 0.25 -0.48 0.11 0.00 -2.33 0.00 0.00 43.42 40.98 1wwk n LEU 302 CO 0.33 -0.48 0.86 0.11 -1.33 0.00 0.00 177.39 176.88 1wwk h LYS 303 N 0.00 0.89 0.00 3.23 1.79 -1.40 -3.51 116.57 117.56 1wwk h LYS 303 Ca 0.00 -0.26 0.00 0.00 -2.18 0.00 0.00 60.65 58.21 1wwk h LYS 303 Cb 0.00 -0.09 0.00 0.00 -1.58 0.00 0.00 32.23 30.56 1wwk h LYS 303 CO 0.00 0.89 0.00 0.41 -1.08 0.00 0.00 179.45 179.67