#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wdd n GLY 12 N 0.00 -1.11 3.68 2.92 0.00 -1.26 -4.94 105.19 104.49 1wdd n GLY 12 Ca 0.00 -0.55 -0.42 0.00 0.00 0.00 0.00 46.02 45.04 1wdd n GLY 12 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1wdd s PHE 13 N -2.18 3.39 -0.29 1.61 5.36 -1.26 -5.01 117.98 119.61 1wdd s PHE 13 Ca 0.65 1.47 0.01 0.00 -0.96 0.00 0.00 56.93 58.10 1wdd s PHE 13 Cb -0.28 -3.27 0.06 0.00 -0.34 0.00 0.00 43.02 39.19 1wdd s PHE 13 CO 0.59 -0.58 -0.03 0.21 -1.46 0.00 0.00 175.22 173.95 1wdd s LYS 14 N 2.21 2.26 0.60 10.12 2.47 -1.26 -5.10 119.74 131.04 1wdd s LYS 14 Ca 0.50 -1.37 -0.18 0.00 -1.56 0.00 0.00 55.97 53.36 1wdd s LYS 14 Cb -0.20 -3.09 -0.03 0.00 -1.46 0.00 0.00 37.83 33.06 1wdd s LYS 14 CO 0.18 -0.65 1.15 0.00 0.16 0.00 0.00 175.35 176.20 1wdd s ALA 15 N 1.16 2.55 0.00 3.13 0.00 -1.26 -4.81 121.76 122.53 1wdd s ALA 15 Ca -0.05 0.82 0.00 0.00 0.00 0.00 0.00 51.96 52.73 1wdd s ALA 15 Cb -0.20 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.53 1wdd s ALA 15 CO -0.03 -1.10 0.00 0.41 0.00 0.00 0.00 175.76 175.04 1wdd n GLY 16 N 0.12 2.12 3.83 0.00 0.00 -1.26 -4.98 105.19 105.02 1wdd n GLY 16 Ca 0.12 -2.09 -0.38 0.00 0.00 0.00 0.00 46.02 43.67 1wdd n GLY 16 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wdd s VAL 17 N -1.65 4.94 0.14 1.61 1.01 -1.26 -1.26 120.40 123.93 1wdd s VAL 17 Ca 0.00 0.96 -0.03 0.00 0.00 0.00 0.00 61.98 62.91 1wdd s VAL 17 Cb 0.00 -3.77 -0.03 0.00 0.00 0.00 0.00 36.38 32.58 1wdd s VAL 17 CO 0.00 0.57 0.11 -1.59 0.00 0.00 0.00 175.10 174.19 1wdd s LYS 18 N -1.04 1.00 0.37 2.72 -2.85 -1.26 -5.00 119.74 113.68 1wdd s LYS 18 Ca 0.25 -1.39 -0.27 0.00 -1.00 0.00 0.00 55.97 53.56 1wdd s LYS 18 Cb -0.18 0.27 -0.10 0.00 -2.06 0.00 0.00 37.83 35.77 1wdd s LYS 18 CO 0.15 -0.31 1.34 -0.51 0.10 0.00 0.00 175.35 176.13 1wdd s ASP 19 N -3.04 6.47 0.42 0.03 1.01 -1.26 -4.90 116.67 115.40 1wdd s ASP 19 Ca 0.24 2.75 0.10 0.00 0.71 0.00 0.00 52.55 56.34 1wdd s ASP 19 Cb 0.06 -2.65 0.92 0.00 1.01 0.00 0.00 42.92 42.26 1wdd s ASP 19 CO 0.02 -0.75 2.02 1.88 0.21 0.00 0.00 175.17 178.55 1wdd h TYR 20 N 2.99 0.50 0.00 4.23 0.05 -1.92 -2.66 116.97 120.16 1wdd h TYR 20 Ca -0.50 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.30 1wdd h TYR 20 Cb 1.24 -0.17 0.00 0.00 1.01 0.00 0.00 36.73 38.81 1wdd h TYR 20 CO 0.54 0.28 0.00 1.57 -1.05 0.00 0.00 178.16 179.50 1wdd h LYS 21 N 0.51 0.00 0.00 4.88 2.10 -1.85 0.98 116.57 123.20 1wdd h LYS 21 Ca 0.22 0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.83 1wdd h LYS 21 Cb 0.21 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.53 1wdd h LYS 21 CO -0.06 0.00 -0.18 -0.07 -2.00 0.00 0.00 179.45 177.15 1wdd h LEU 22 N 0.00 0.00 0.00 7.07 3.38 -1.80 -3.02 115.31 120.94 1wdd h LEU 22 Ca 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1wdd h LEU 22 Cb 0.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1wdd h LEU 22 CO 0.00 0.18 -1.13 0.41 0.09 0.00 0.00 178.44 177.99 1wdd n THR 23 N -3.58 0.13 0.32 0.22 -1.04 -0.62 -4.83 114.28 104.87 1wdd n THR 23 Ca -0.01 -0.08 0.06 0.00 -2.04 0.00 0.00 64.05 61.98 1wdd n THR 23 Cb 0.32 -0.93 0.08 0.00 -1.82 0.00 0.00 70.33 67.97 1wdd n THR 23 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1wdd n TYR 24 N -2.10 0.13 -3.77 -1.42 4.01 0.24 -4.80 117.16 109.45 1wdd n TYR 24 Ca -0.03 -0.13 -0.37 0.00 -0.16 0.00 0.00 57.90 57.21 1wdd n TYR 24 Cb 0.56 -0.01 -0.13 0.00 -0.31 0.00 0.00 39.34 39.46 1wdd n TYR 24 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 1wdd s TYR 25 N -0.99 3.16 -0.47 -0.72 5.04 -1.14 -1.15 117.35 121.07 1wdd s TYR 25 Ca 0.17 -1.07 0.06 0.00 -2.44 0.00 0.00 57.07 53.78 1wdd s TYR 25 Cb 0.11 -2.25 0.21 0.00 0.35 0.00 0.00 41.96 40.38 1wdd s TYR 25 CO 0.15 -0.61 0.48 0.25 -1.34 0.00 0.00 175.55 174.49 1wdd n THR 26 N 4.85 -0.18 0.22 4.34 -2.24 0.07 -4.86 114.28 116.48 1wdd n THR 26 Ca -0.14 -4.07 0.07 0.00 -2.27 0.00 0.00 64.05 57.64 1wdd n THR 26 Cb 0.47 -1.89 0.33 0.00 -2.10 0.00 0.00 70.33 67.14 1wdd n THR 26 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1wdd n PRO 27 N 1.93 0.08 0.00 -0.78 -0.04 -1.26 -1.53 135.00 133.40 1wdd n PRO 27 Ca 0.25 0.48 0.13 0.00 -0.04 0.00 0.00 63.50 64.32 1wdd n PRO 27 Cb 0.47 -1.71 0.38 0.00 -0.04 0.00 0.00 33.50 32.60 1wdd n PRO 27 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1wdd n GLU 28 N -1.87 0.77 -2.19 0.54 0.00 -1.26 -4.85 120.64 111.77 1wdd n GLU 28 Ca 0.01 -0.44 -0.41 0.00 0.00 0.00 0.00 57.16 56.31 1wdd n GLU 28 Cb 0.09 -1.49 -0.03 0.00 0.00 0.00 0.00 31.44 30.01 1wdd n GLU 28 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.13 176.66 1wdd s TYR 29 N -2.54 3.21 -0.24 -1.84 5.04 -0.58 -4.99 117.35 115.41 1wdd s TYR 29 Ca 0.24 1.25 -0.08 0.00 -2.44 0.00 0.00 57.07 56.03 1wdd s TYR 29 Cb 0.19 -3.62 -0.04 0.00 0.35 0.00 0.00 41.96 38.84 1wdd s TYR 29 CO 0.53 -1.90 0.10 -1.21 -1.34 0.00 0.00 175.55 171.73 1wdd s GLU 30 N -0.46 3.82 0.68 4.97 2.02 -1.26 -4.99 118.70 123.48 1wdd s GLU 30 Ca 0.55 -0.40 -0.16 0.00 0.02 0.00 0.00 54.97 54.98 1wdd s GLU 30 Cb -0.37 -3.39 0.01 0.00 0.10 0.00 0.00 34.13 30.47 1wdd s GLU 30 CO 0.41 -0.07 1.19 0.95 0.02 0.00 0.00 175.26 177.76 1wdd s THR 31 N 1.34 2.58 0.11 3.63 -4.23 -1.26 -5.02 115.64 112.78 1wdd s THR 31 Ca 0.06 0.30 0.02 0.00 -1.18 0.00 0.00 61.69 60.89 1wdd s THR 31 Cb -0.15 -2.92 -0.04 0.00 1.34 0.00 0.00 72.50 70.73 1wdd s THR 31 CO 0.05 -0.13 0.22 -0.54 -0.54 0.00 0.00 174.62 173.67 1wdd s LYS 32 N -3.77 3.33 0.00 3.99 1.02 -1.26 -4.99 119.74 118.05 1wdd s LYS 32 Ca 0.74 -0.57 0.16 0.00 0.02 0.00 0.00 55.97 56.32 1wdd s LYS 32 Cb -0.28 -2.94 0.75 0.00 -0.52 0.00 0.00 37.83 34.84 1wdd s LYS 32 CO 0.41 0.56 1.47 -0.40 -0.92 0.00 0.00 175.35 176.47 1wdd n ASP 33 N -0.08 0.00 -0.28 2.83 5.68 -1.26 -1.68 116.55 121.77 1wdd n ASP 33 Ca -0.06 0.23 0.11 0.00 -0.50 0.00 0.00 54.79 54.56 1wdd n ASP 33 Cb 0.53 -0.37 0.02 0.00 -1.14 0.00 0.00 41.12 40.16 1wdd n ASP 33 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1wdd n THR 34 N -1.37 0.00 -2.50 2.12 -2.24 -1.26 -4.67 114.28 104.36 1wdd n THR 34 Ca 0.06 -0.14 -0.36 0.00 -2.27 0.00 0.00 64.05 61.34 1wdd n THR 34 Cb 0.15 1.00 -0.03 0.00 -2.10 0.00 0.00 70.33 69.34 1wdd n THR 34 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1wdd s ASP 35 N -2.68 6.55 -0.11 3.42 1.01 -0.68 -3.74 116.67 120.44 1wdd s ASP 35 Ca 0.15 2.05 -0.21 0.00 0.71 0.00 0.00 52.55 55.26 1wdd s ASP 35 Cb 0.18 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.49 1wdd s ASP 35 CO 0.67 -0.64 0.59 -0.63 0.21 0.00 0.00 175.17 175.37 1wdd s ILE 36 N -1.72 5.10 -0.07 0.77 1.09 -0.08 -4.36 121.20 121.93 1wdd s ILE 36 Ca 0.61 1.20 -0.01 0.00 -1.10 0.00 0.00 60.65 61.35 1wdd s ILE 36 Cb -0.22 -3.93 -0.03 0.00 -1.06 0.00 0.00 42.46 37.22 1wdd s ILE 36 CO 0.27 0.26 -0.02 -0.76 -0.10 0.00 0.00 174.94 174.59 1wdd s LEU 37 N 0.88 3.47 -0.02 2.97 1.43 -1.02 -0.42 118.68 125.98 1wdd s LEU 37 Ca 0.31 0.08 0.06 0.00 -1.03 0.00 0.00 54.13 53.55 1wdd s LEU 37 Cb -0.16 -1.82 -0.01 0.00 0.03 0.00 0.00 46.19 44.23 1wdd s LEU 37 CO 0.14 0.36 -0.18 0.00 0.23 0.00 0.00 176.35 176.89 1wdd s ALA 38 N -0.90 1.54 -0.33 4.21 0.00 0.53 -0.03 121.76 126.78 1wdd s ALA 38 Ca 0.14 -0.78 -0.07 0.00 0.00 0.00 0.00 51.96 51.25 1wdd s ALA 38 Cb -0.11 -0.41 0.03 0.00 0.00 0.00 0.00 23.12 22.63 1wdd s ALA 38 CO 0.03 0.36 0.10 0.00 0.00 0.00 0.00 175.76 176.26 1wdd s ALA 39 N -0.37 3.06 -0.17 0.00 0.00 -0.52 -0.98 121.76 122.77 1wdd s ALA 39 Ca 0.06 -1.68 -0.06 0.00 0.00 0.00 0.00 51.96 50.29 1wdd s ALA 39 Cb -0.08 -2.25 -0.03 0.00 0.00 0.00 0.00 23.12 20.76 1wdd s ALA 39 CO -0.00 -1.24 0.02 -0.06 0.00 0.00 0.00 175.76 174.47 1wdd s PHE 40 N 1.43 3.16 -0.43 0.00 0.08 -0.02 -0.82 117.98 121.38 1wdd s PHE 40 Ca -0.01 -0.06 -0.22 0.00 0.12 0.00 0.00 56.93 56.76 1wdd s PHE 40 Cb -0.19 -2.01 0.02 0.00 -0.57 0.00 0.00 43.02 40.27 1wdd s PHE 40 CO 0.03 0.10 0.75 0.50 -0.10 0.00 0.00 175.22 176.50 1wdd s ARG 41 N 0.28 3.46 -0.10 0.44 3.52 0.99 -0.19 118.95 127.35 1wdd s ARG 41 Ca 0.01 -0.07 0.02 0.00 -0.13 0.00 0.00 55.73 55.55 1wdd s ARG 41 Cb -0.13 -3.91 -0.02 0.00 -1.56 0.00 0.00 34.95 29.33 1wdd s ARG 41 CO 0.01 -1.03 -0.15 0.08 -0.81 0.00 0.00 175.30 173.40 1wdd s VAL 42 N 3.14 2.89 -0.35 7.11 1.01 0.38 -0.75 120.40 133.84 1wdd s VAL 42 Ca 0.28 -0.74 0.01 0.00 0.00 0.00 0.00 61.98 61.53 1wdd s VAL 42 Cb -0.13 -2.17 0.09 0.00 0.00 0.00 0.00 36.38 34.17 1wdd s VAL 42 CO 0.21 0.55 0.07 -0.89 0.00 0.00 0.00 175.10 175.03 1wdd s THR 43 N 0.04 2.71 0.62 3.92 2.01 -0.35 -1.31 115.64 123.28 1wdd s THR 43 Ca -0.06 -2.00 -0.15 0.00 0.31 0.00 0.00 61.69 59.80 1wdd s THR 43 Cb -0.15 -2.82 -0.02 0.00 0.01 0.00 0.00 72.50 69.51 1wdd s THR 43 CO 0.05 -0.47 1.06 -2.84 -0.69 0.00 0.00 174.62 171.72 1wdd s PRO 44 N 1.06 3.21 0.71 4.92 0.02 -1.26 -0.10 135.00 143.58 1wdd s PRO 44 Ca 0.05 1.15 -0.14 0.00 0.02 0.00 0.00 61.00 62.08 1wdd s PRO 44 Cb -0.20 -2.02 0.03 0.00 0.02 0.00 0.00 34.50 32.32 1wdd s PRO 44 CO -0.05 -0.89 1.13 -0.65 -0.33 0.00 0.00 177.00 176.21 1wdd s GLN 45 N -4.30 2.42 0.34 5.54 -1.52 -0.22 -4.36 119.66 117.55 1wdd s GLN 45 Ca 0.62 1.46 -0.29 0.00 -1.95 0.00 0.00 55.36 55.21 1wdd s GLN 45 Cb -0.16 -1.90 -0.12 0.00 -0.22 0.00 0.00 33.01 30.62 1wdd s GLN 45 CO 0.41 -1.56 1.50 -2.30 -0.25 0.00 0.00 175.29 173.09 1wdd n PRO 46 N -2.79 2.59 0.00 2.91 -0.02 -1.26 -1.66 135.00 134.76 1wdd n PRO 46 Ca 0.11 0.91 0.00 0.00 -2.02 0.00 0.00 63.50 62.50 1wdd n PRO 46 Cb 0.52 -2.64 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 1wdd n PRO 46 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wdd n GLY 47 N 1.13 2.18 3.57 -1.23 0.00 -1.26 -5.02 105.19 104.56 1wdd n GLY 47 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 1wdd n GLY 47 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wdd s VAL 48 N -2.38 5.18 0.52 1.61 1.01 -0.67 -5.05 120.40 120.63 1wdd s VAL 48 Ca 0.00 0.26 -0.22 0.00 0.00 0.00 0.00 61.98 62.02 1wdd s VAL 48 Cb 0.00 -3.75 -0.06 0.00 0.00 0.00 0.00 36.38 32.57 1wdd s VAL 48 CO 0.00 0.03 1.33 -2.84 0.00 0.00 0.00 175.10 173.62 1wdd s PRO 49 N 2.03 3.29 0.40 2.72 0.02 -1.26 -4.75 135.00 137.45 1wdd s PRO 49 Ca 0.13 2.18 0.08 0.00 0.02 0.00 0.00 61.00 63.41 1wdd s PRO 49 Cb -0.16 -2.32 0.87 0.00 0.02 0.00 0.00 34.50 32.91 1wdd s PRO 49 CO 0.11 -1.05 2.02 -1.00 -0.33 0.00 0.00 177.00 176.74 1wdd h PRO 50 N 1.64 0.56 -0.26 5.54 0.13 -1.97 -0.99 132.00 136.65 1wdd h PRO 50 Ca -0.51 -0.03 -0.06 0.00 -0.87 0.00 0.00 66.00 64.53 1wdd h PRO 50 Cb 1.29 -0.13 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 1wdd h PRO 50 CO 0.58 0.37 -0.11 0.93 -0.23 0.00 0.00 178.00 179.54 1wdd h GLU 51 N 0.57 0.42 -0.03 0.86 3.07 -1.99 0.74 114.58 118.23 1wdd h GLU 51 Ca 0.22 -0.11 -0.25 0.00 -0.50 0.00 0.00 59.36 58.72 1wdd h GLU 51 Cb 0.16 -0.05 0.01 0.00 -0.84 0.00 0.00 28.75 28.03 1wdd h GLU 51 CO -0.06 0.54 -0.97 1.49 -1.40 0.00 0.00 179.01 178.61 1wdd h GLU 52 N 0.40 0.65 -0.44 2.33 4.57 -1.61 -1.19 114.58 119.28 1wdd h GLU 52 Ca 0.08 -0.66 -0.00 0.00 -1.18 0.00 0.00 59.36 57.59 1wdd h GLU 52 Cb 0.44 0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 29.19 1wdd h GLU 52 CO 0.02 1.26 0.27 0.00 -1.18 0.00 0.00 179.01 179.38 1wdd h ALA 53 N 0.52 0.56 -0.43 2.92 0.00 -0.83 0.51 119.26 122.51 1wdd h ALA 53 Ca -0.10 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.62 1wdd h ALA 53 Cb 1.61 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 19.22 1wdd h ALA 53 CO 0.19 0.05 -0.26 0.78 0.00 0.00 0.00 179.25 180.01 1wdd h GLY 54 N 0.59 0.99 1.12 0.00 0.00 -0.89 -1.69 103.07 103.18 1wdd h GLY 54 Ca 0.16 -0.89 -0.08 0.00 0.00 0.00 0.00 47.33 46.51 1wdd h GLY 54 CO -0.03 0.81 0.07 0.00 0.00 0.00 0.00 176.54 177.39 1wdd h ALA 55 N 0.92 0.92 -0.50 3.60 0.00 -1.02 -1.11 119.26 122.06 1wdd h ALA 55 Ca 0.09 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1wdd h ALA 55 Cb 0.82 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1wdd h ALA 55 CO 0.07 0.66 0.23 0.00 0.00 0.00 0.00 179.25 180.20 1wdd h ALA 56 N 1.07 0.65 -0.36 0.00 0.00 -0.62 0.13 119.26 120.12 1wdd h ALA 56 Ca 0.19 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1wdd h ALA 56 Cb 0.48 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1wdd h ALA 56 CO 0.02 0.23 0.20 0.28 0.00 0.00 0.00 179.25 179.98 1wdd h VAL 57 N 0.67 1.13 -0.68 0.00 2.07 -1.13 -0.30 116.25 118.02 1wdd h VAL 57 Ca 0.17 -0.33 -0.02 0.00 0.82 0.00 0.00 66.70 67.34 1wdd h VAL 57 Cb 0.15 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 1wdd h VAL 57 CO -0.02 0.13 0.34 0.00 0.02 0.00 0.00 177.57 178.04 1wdd h ALA 58 N 1.07 0.87 0.09 1.67 0.00 -0.96 -2.82 119.26 119.18 1wdd h ALA 58 Ca 0.13 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1wdd h ALA 58 Cb 0.03 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.56 1wdd h ALA 58 CO -0.02 0.42 -0.04 0.00 0.00 0.00 0.00 179.25 179.61 1wdd h ALA 59 N 1.16 -0.12 -0.00 0.00 0.00 -0.50 -3.10 119.26 116.70 1wdd h ALA 59 Ca 0.23 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1wdd h ALA 59 Cb 0.10 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1wdd h ALA 59 CO -0.03 -0.44 0.00 0.39 0.00 0.00 0.00 179.25 179.16 1wdd n GLU 60 N -5.03 1.03 -0.21 0.00 -0.58 -0.14 -0.74 120.64 114.96 1wdd n GLU 60 Ca -0.08 -0.04 0.06 0.00 -0.42 0.00 0.00 57.16 56.68 1wdd n GLU 60 Cb 0.17 -1.45 0.16 0.00 -0.57 0.00 0.00 31.44 29.75 1wdd n GLU 60 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1wdd n SER 61 N -0.90 3.03 0.00 1.62 3.41 -1.07 -4.66 113.62 115.05 1wdd n SER 61 Ca 0.21 -2.19 0.00 0.00 -0.26 0.00 0.00 58.87 56.63 1wdd n SER 61 Cb 0.11 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 63.78 1wdd n SER 61 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1wdd n SER 62 N 0.25 0.00 0.00 4.04 3.41 -0.79 -4.46 113.62 116.07 1wdd n SER 62 Ca 0.13 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.74 1wdd n SER 62 Cb 0.50 0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.49 1wdd n SER 62 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1wdd n THR 63 N -1.76 0.00 -3.24 6.66 -2.24 -0.93 -4.92 114.28 107.86 1wdd n THR 63 Ca 0.00 -0.12 -0.22 0.00 -2.27 0.00 0.00 64.05 61.44 1wdd n THR 63 Cb 0.00 0.66 0.00 0.00 -2.10 0.00 0.00 70.33 68.90 1wdd n THR 63 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1wdd s GLY 64 N -0.62 1.53 0.00 3.38 0.00 0.08 -5.03 107.32 106.66 1wdd s GLY 64 Ca 0.00 -1.19 0.00 0.00 0.00 0.00 0.00 44.72 43.53 1wdd s GLY 64 CO 0.00 -1.07 0.00 -0.37 0.00 0.00 0.00 173.10 171.66 1wdd n THR 65 N -1.87 0.00 0.80 0.90 5.66 -1.26 -4.36 114.28 114.16 1wdd n THR 65 Ca -0.00 0.00 0.13 0.00 -3.05 0.00 0.00 64.05 61.13 1wdd n THR 65 Cb 0.58 0.00 0.51 0.00 -1.55 0.00 0.00 70.33 69.86 1wdd n THR 65 CO 0.00 0.00 0.00 -2.67 -3.05 0.00 0.00 175.07 169.35 1wdd n TRP 66 N 0.00 0.49 -4.07 1.09 4.27 -1.26 -4.82 117.44 113.13 1wdd n TRP 66 Ca 0.00 0.14 -0.07 0.00 -3.89 0.00 0.00 57.50 53.68 1wdd n TRP 66 Cb 0.00 -0.73 -0.10 0.00 -1.36 0.00 0.00 31.31 29.12 1wdd n TRP 66 CO 0.00 0.00 0.00 -0.08 -2.29 0.00 0.00 177.69 175.32 1wdd s THR 67 N -3.05 0.21 0.14 -1.67 -1.32 -1.26 -4.61 115.64 104.08 1wdd s THR 67 Ca 0.12 -1.77 -0.30 0.00 -1.21 0.00 0.00 61.69 58.53 1wdd s THR 67 Cb 0.15 -1.52 -0.08 0.00 -1.51 0.00 0.00 72.50 69.55 1wdd s THR 67 CO 0.56 -0.96 1.26 -0.89 -2.21 0.00 0.00 174.62 172.39 1wdd s THR 68 N -3.92 3.55 -0.04 5.08 2.01 -0.39 -4.99 115.64 116.95 1wdd s THR 68 Ca 0.07 1.20 0.05 0.00 0.31 0.00 0.00 61.69 63.33 1wdd s THR 68 Cb 0.08 -3.77 -0.02 0.00 0.01 0.00 0.00 72.50 68.79 1wdd s THR 68 CO -0.10 0.14 -0.18 0.68 -0.69 0.00 0.00 174.62 174.47 1wdd s VAL 69 N 0.52 2.73 0.23 3.82 -7.23 -1.26 -4.48 120.40 114.73 1wdd s VAL 69 Ca 0.58 -0.85 0.28 0.00 -1.81 0.00 0.00 61.98 60.18 1wdd s VAL 69 Cb -0.34 -2.04 0.30 0.00 0.56 0.00 0.00 36.38 34.86 1wdd s VAL 69 CO 0.34 0.59 1.95 4.11 -0.31 0.00 0.00 175.10 181.78 1wdd h TRP 70 N 5.40 0.00 0.00 2.82 5.08 -1.97 -2.71 115.95 124.58 1wdd h TRP 70 Ca -0.45 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.52 1wdd h TRP 70 Cb 1.14 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.30 1wdd h TRP 70 CO 0.46 0.14 0.00 1.79 -1.28 0.00 0.00 178.44 179.55 1wdd h THR 71 N 0.00 0.00 -0.18 0.12 1.35 -2.03 -1.15 112.91 111.02 1wdd h THR 71 Ca -0.00 -0.23 0.05 0.00 -0.55 0.00 0.00 66.41 65.69 1wdd h THR 71 Cb 0.55 0.96 -0.01 0.00 -1.73 0.00 0.00 68.15 67.92 1wdd h THR 71 CO 0.02 0.00 0.16 0.44 -0.25 0.00 0.00 175.52 175.88 1wdd h ASP 72 N 0.00 0.00 0.82 5.36 3.32 -1.85 -1.56 116.42 122.51 1wdd h ASP 72 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1wdd h ASP 72 Cb 0.33 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.88 1wdd h ASP 72 CO 0.00 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.13 1wdd n GLY 73 N -1.49 -1.29 0.19 2.75 0.00 -0.44 -2.67 105.19 102.24 1wdd n GLY 73 Ca 0.01 -0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.15 1wdd n GLY 73 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1wdd h LEU 74 N 0.00 0.00 0.00 0.99 3.38 -1.45 -3.47 115.31 114.76 1wdd h LEU 74 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1wdd h LEU 74 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1wdd h LEU 74 CO 0.00 0.00 0.00 1.07 0.09 0.00 0.00 178.44 179.60 1wdd n THR 75 N -2.88 0.00 -4.02 0.22 5.66 -1.09 -5.13 114.28 107.04 1wdd n THR 75 Ca 0.04 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.73 1wdd n THR 75 Cb 0.51 0.00 -0.15 0.00 -1.55 0.00 0.00 70.33 69.14 1wdd n THR 75 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1wdd s SER 76 N -0.25 4.71 0.48 1.09 0.15 -1.26 -4.94 113.70 113.67 1wdd s SER 76 Ca 0.00 -1.92 0.21 0.00 0.70 0.00 0.00 55.95 54.94 1wdd s SER 76 Cb 0.00 -1.62 1.20 0.00 -1.71 0.00 0.00 66.02 63.89 1wdd s SER 76 CO 0.00 -0.33 2.01 -0.07 1.20 0.00 0.00 173.24 176.05 1wdd h LEU 77 N 7.69 0.00 -1.34 3.45 3.38 -1.98 -1.73 115.31 124.78 1wdd h LEU 77 Ca -0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1wdd h LEU 77 Cb 1.03 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.75 1wdd h LEU 77 CO 0.51 0.17 0.43 0.44 0.09 0.00 0.00 178.44 180.08 1wdd h ASP 78 N 0.00 0.76 0.47 -0.43 3.32 -1.96 0.97 116.42 119.56 1wdd h ASP 78 Ca -0.00 -0.02 -0.24 0.00 0.02 0.00 0.00 57.03 56.78 1wdd h ASP 78 Cb 0.37 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.73 1wdd h ASP 78 CO 0.02 0.56 -1.05 -0.09 -1.72 0.00 0.00 179.24 176.96 1wdd h ARG 79 N 0.90 0.34 0.00 3.56 2.43 -1.75 -3.40 114.38 116.45 1wdd h ARG 79 Ca 0.24 -0.43 0.00 0.00 -0.81 0.00 0.00 59.98 58.98 1wdd h ARG 79 Cb -0.09 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 1wdd h ARG 79 CO -0.05 1.13 -1.57 0.66 -1.51 0.00 0.00 179.97 178.63 1wdd n TYR 80 N -3.66 0.00 -1.96 2.20 4.01 -0.95 -4.81 117.16 111.99 1wdd n TYR 80 Ca -0.07 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.28 1wdd n TYR 80 Cb 0.90 -0.29 0.01 0.00 -0.31 0.00 0.00 39.34 39.65 1wdd n TYR 80 CO 0.00 0.00 0.00 -1.59 -0.46 0.00 0.00 176.86 174.81 1wdd s LYS 81 N -2.90 3.78 0.46 -0.72 -2.85 0.30 -4.62 119.74 113.19 1wdd s LYS 81 Ca -0.05 2.22 -0.21 0.00 -1.00 0.00 0.00 55.97 56.93 1wdd s LYS 81 Cb 0.08 -2.65 -0.09 0.00 -2.06 0.00 0.00 37.83 33.12 1wdd s LYS 81 CO 0.55 -0.67 1.04 0.20 0.10 0.00 0.00 175.35 176.56 1wdd s GLY 82 N -0.73 2.57 -0.06 0.59 0.00 -1.26 -4.54 107.32 103.89 1wdd s GLY 82 Ca 0.60 0.63 -0.03 0.00 0.00 0.00 0.00 44.72 45.92 1wdd s GLY 82 CO 0.50 0.98 0.14 1.09 0.00 0.00 0.00 173.10 175.81 1wdd s ARG 83 N -3.01 0.11 -0.39 2.90 1.70 -0.39 -4.57 118.95 115.30 1wdd s ARG 83 Ca 0.64 0.33 -0.27 0.00 -0.47 0.00 0.00 55.73 55.96 1wdd s ARG 83 Cb -0.18 -0.12 0.02 0.00 -0.57 0.00 0.00 34.95 34.10 1wdd s ARG 83 CO 0.22 -0.13 0.99 0.00 -1.08 0.00 0.00 175.30 175.29 1wdd n TYR 85 N 7.03 0.00 -3.64 0.00 4.11 -0.36 -0.75 117.16 123.55 1wdd n TYR 85 Ca 0.09 0.00 -0.09 0.00 -0.00 0.00 0.00 57.90 57.89 1wdd n TYR 85 Cb 0.48 0.00 -0.07 0.00 -0.00 0.00 0.00 39.34 39.75 1wdd n TYR 85 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.86 175.28 1wdd s HIS 86 N -1.38 -0.59 -0.06 -3.48 5.04 -1.24 -4.30 115.29 109.29 1wdd s HIS 86 Ca 0.13 1.38 0.02 0.00 -1.54 0.00 0.00 55.06 55.06 1wdd s HIS 86 Cb 0.11 0.36 0.01 0.00 0.04 0.00 0.00 32.58 33.10 1wdd s HIS 86 CO 0.25 -0.28 -0.11 0.42 -2.34 0.00 0.00 174.74 172.67 1wdd s ILE 87 N 0.47 1.05 -0.03 0.89 1.01 -1.26 -0.72 121.20 122.61 1wdd s ILE 87 Ca 0.00 -0.45 0.02 0.00 0.00 0.00 0.00 60.65 60.23 1wdd s ILE 87 Cb -0.05 -0.96 0.01 0.00 0.01 0.00 0.00 42.46 41.46 1wdd s ILE 87 CO -0.07 0.33 -0.09 -1.83 0.00 0.00 0.00 174.94 173.28 1wdd s GLU 88 N 0.58 1.04 0.59 2.79 -1.05 0.01 -4.96 118.70 117.70 1wdd s GLU 88 Ca -0.12 -0.31 -0.19 0.00 -0.15 0.00 0.00 54.97 54.20 1wdd s GLU 88 Cb -0.14 -0.96 -0.03 0.00 -0.44 0.00 0.00 34.13 32.55 1wdd s GLU 88 CO 0.03 0.10 1.25 -2.14 0.95 0.00 0.00 175.26 175.44 1wdd s PRO 89 N 0.28 2.93 -0.00 -4.83 0.02 -1.26 0.18 135.00 132.31 1wdd s PRO 89 Ca -0.05 1.94 -0.23 0.00 0.02 0.00 0.00 61.00 62.68 1wdd s PRO 89 Cb -0.10 -1.98 -0.05 0.00 0.02 0.00 0.00 34.50 32.40 1wdd s PRO 89 CO 0.01 -1.27 0.71 0.08 -0.33 0.00 0.00 177.00 176.20 1wdd s VAL 90 N -1.50 4.87 0.11 3.83 1.01 -0.32 -4.75 120.40 123.65 1wdd s VAL 90 Ca 0.77 1.49 -0.33 0.00 0.00 0.00 0.00 61.98 63.91 1wdd s VAL 90 Cb -0.33 -4.05 -0.12 0.00 0.00 0.00 0.00 36.38 31.87 1wdd s VAL 90 CO 0.37 0.34 1.73 0.52 0.00 0.00 0.00 175.10 178.06 1wdd n VAL 91 N 3.08 0.22 -0.46 2.92 0.31 -1.26 -1.71 118.33 121.44 1wdd n VAL 91 Ca -0.03 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.26 1wdd n VAL 91 Cb 0.51 -1.83 0.00 0.00 -0.91 0.00 0.00 33.84 31.60 1wdd n VAL 91 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1wdd n GLY 92 N 3.92 1.29 3.59 2.92 0.00 -1.26 -5.04 105.19 110.60 1wdd n GLY 92 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 1wdd n GLY 92 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wdd s GLU 93 N -0.30 2.50 0.02 1.61 0.41 -0.69 -5.00 118.70 117.25 1wdd s GLU 93 Ca 0.00 -0.76 0.23 0.00 -0.41 0.00 0.00 54.97 54.04 1wdd s GLU 93 Cb 0.00 -2.47 0.19 0.00 -1.78 0.00 0.00 34.13 30.07 1wdd s GLU 93 CO 0.00 0.59 1.17 -0.40 -0.49 0.00 0.00 175.26 176.13 1wdd n ASP 94 N 1.48 0.65 -2.68 -0.19 5.75 -1.26 -4.50 116.55 115.80 1wdd n ASP 94 Ca -0.15 -0.37 -0.01 0.00 -0.01 0.00 0.00 54.79 54.25 1wdd n ASP 94 Cb 0.52 0.58 0.07 0.00 -1.03 0.00 0.00 41.12 41.27 1wdd n ASP 94 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1wdd n ASN 95 N -1.68 0.62 -4.01 -1.12 5.15 -1.26 -5.08 115.26 107.87 1wdd n ASN 95 Ca 0.04 -2.08 -0.16 0.00 -0.60 0.00 0.00 54.58 51.78 1wdd n ASN 95 Cb 0.37 -0.12 -0.14 0.00 -0.53 0.00 0.00 39.78 39.36 1wdd n ASN 95 CO 0.00 0.00 0.00 -1.58 1.40 0.00 0.00 177.26 177.08 1wdd s GLN 96 N -2.42 0.56 0.04 1.20 0.74 -1.26 -4.05 119.66 114.48 1wdd s GLN 96 Ca 0.22 -0.40 -0.02 0.00 0.05 0.00 0.00 55.36 55.21 1wdd s GLN 96 Cb 0.35 -0.50 -0.03 0.00 1.10 0.00 0.00 33.01 33.94 1wdd s GLN 96 CO -0.07 0.13 -0.00 0.71 -0.55 0.00 0.00 175.29 175.51 1wdd s TYR 97 N -0.50 0.36 -0.33 1.67 1.51 -0.43 -1.17 117.35 118.46 1wdd s TYR 97 Ca -0.00 -0.77 -0.12 0.00 -1.01 0.00 0.00 57.07 55.17 1wdd s TYR 97 Cb -0.05 -0.27 -0.01 0.00 -0.11 0.00 0.00 41.96 41.52 1wdd s TYR 97 CO 0.00 -0.32 0.21 0.42 -1.11 0.00 0.00 175.55 174.75 1wdd s ILE 98 N -2.84 5.04 -0.19 2.71 -1.09 0.13 -0.47 121.20 124.49 1wdd s ILE 98 Ca -0.03 -0.28 -0.08 0.00 -2.23 0.00 0.00 60.65 58.02 1wdd s ILE 98 Cb 0.00 -3.58 -0.04 0.00 -1.58 0.00 0.00 42.46 37.26 1wdd s ILE 98 CO -0.06 0.02 0.09 0.00 -1.23 0.00 0.00 174.94 173.76 1wdd s ALA 99 N 1.68 3.51 -0.20 9.38 0.00 0.73 -0.81 121.76 136.06 1wdd s ALA 99 Ca 0.06 -0.74 -0.09 0.00 0.00 0.00 0.00 51.96 51.19 1wdd s ALA 99 Cb -0.17 -2.03 -0.05 0.00 0.00 0.00 0.00 23.12 20.88 1wdd s ALA 99 CO 0.09 0.15 0.11 0.71 0.00 0.00 0.00 175.76 176.82 1wdd s TYR 100 N 0.41 3.32 -0.04 0.00 1.51 0.10 -0.84 117.35 121.80 1wdd s TYR 100 Ca 0.05 0.18 0.05 0.00 -1.01 0.00 0.00 57.07 56.34 1wdd s TYR 100 Cb -0.12 -2.15 -0.01 0.00 -0.11 0.00 0.00 41.96 39.57 1wdd s TYR 100 CO -0.00 0.17 -0.20 0.08 -1.11 0.00 0.00 175.55 174.48 1wdd s VAL 101 N 0.55 1.68 -0.12 0.71 1.01 -0.16 -1.23 120.40 122.85 1wdd s VAL 101 Ca 0.06 -0.87 -0.02 0.00 0.00 0.00 0.00 61.98 61.15 1wdd s VAL 101 Cb -0.12 -1.43 -0.03 0.00 0.00 0.00 0.00 36.38 34.80 1wdd s VAL 101 CO 0.00 0.48 -0.04 0.00 0.00 0.00 0.00 175.10 175.54 1wdd s ALA 102 N -0.11 3.03 -0.15 5.51 0.00 0.04 -0.35 121.76 129.72 1wdd s ALA 102 Ca -0.02 -0.83 0.02 0.00 0.00 0.00 0.00 51.96 51.12 1wdd s ALA 102 Cb -0.12 -1.46 0.01 0.00 0.00 0.00 0.00 23.12 21.56 1wdd s ALA 102 CO 0.02 0.36 -0.21 0.71 0.00 0.00 0.00 175.76 176.65 1wdd s TYR 103 N -0.11 2.71 0.55 0.00 2.02 0.44 -1.26 117.35 121.71 1wdd s TYR 103 Ca 0.02 -1.41 -0.22 0.00 -0.37 0.00 0.00 57.07 55.10 1wdd s TYR 103 Cb -0.13 -1.86 -0.05 0.00 -0.40 0.00 0.00 41.96 39.53 1wdd s TYR 103 CO 0.03 -0.66 1.37 -2.14 -1.57 0.00 0.00 175.55 172.57 1wdd s PRO 104 N 0.97 3.08 0.41 -1.71 0.02 -1.26 -0.91 135.00 135.60 1wdd s PRO 104 Ca -0.03 2.26 0.11 0.00 0.02 0.00 0.00 61.00 63.35 1wdd s PRO 104 Cb -0.15 -2.23 0.92 0.00 0.02 0.00 0.00 34.50 33.06 1wdd s PRO 104 CO -0.05 -1.24 1.98 1.25 -0.33 0.00 0.00 177.00 178.60 1wdd h LEU 105 N 1.39 0.47 0.00 -5.54 5.85 -1.93 -1.51 115.31 114.05 1wdd h LEU 105 Ca -0.51 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.22 1wdd h LEU 105 Cb 1.30 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.24 1wdd h LEU 105 CO 0.57 0.30 0.00 0.47 -0.34 0.00 0.00 178.44 179.44 1wdd n ASP 106 N -4.48 0.00 0.00 1.25 8.00 -1.26 -2.05 116.55 118.01 1wdd n ASP 106 Ca 0.09 0.48 0.12 0.00 0.71 0.00 0.00 54.79 56.20 1wdd n ASP 106 Cb 0.30 -0.49 0.53 0.00 -0.02 0.00 0.00 41.12 41.44 1wdd n ASP 106 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1wdd n LEU 107 N -1.49 0.00 -4.54 0.64 4.77 -0.57 -4.86 117.00 110.95 1wdd n LEU 107 Ca 0.02 0.48 -0.32 0.00 -0.03 0.00 0.00 56.01 56.17 1wdd n LEU 107 Cb 0.11 -0.48 -0.11 0.00 -2.33 0.00 0.00 43.42 40.60 1wdd n LEU 107 CO 0.09 -0.08 -0.43 -0.36 -1.33 0.00 0.00 177.39 175.29 1wdd s PHE 108 N -2.97 2.76 0.01 -1.77 0.08 -0.87 -5.03 117.98 110.20 1wdd s PHE 108 Ca 0.13 -0.12 -0.30 0.00 0.12 0.00 0.00 56.93 56.75 1wdd s PHE 108 Cb 0.16 -1.56 -0.04 0.00 -0.57 0.00 0.00 43.02 41.01 1wdd s PHE 108 CO 0.44 0.32 1.12 -2.00 -0.10 0.00 0.00 175.22 175.00 1wdd s GLU 109 N -1.38 4.46 0.31 0.44 2.12 -1.26 -4.98 118.70 118.41 1wdd s GLU 109 Ca 0.16 1.62 -0.30 0.00 0.36 0.00 0.00 54.97 56.81 1wdd s GLU 109 Cb -0.11 -3.43 -0.12 0.00 0.26 0.00 0.00 34.13 30.73 1wdd s GLU 109 CO 0.06 -0.23 1.55 0.39 -0.54 0.00 0.00 175.26 176.49 1wdd n GLU 110 N 4.21 2.63 -0.93 4.30 4.71 -1.26 -2.37 120.64 131.93 1wdd n GLU 110 Ca 0.08 0.93 0.00 0.00 -0.01 0.00 0.00 57.16 58.17 1wdd n GLU 110 Cb 0.48 -2.69 0.00 0.00 -1.01 0.00 0.00 31.44 28.22 1wdd n GLU 110 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1wdd n GLY 111 N 1.76 0.67 3.07 0.62 0.00 -1.22 -4.98 105.19 105.10 1wdd n GLY 111 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 1wdd n GLY 111 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wdd s SER 112 N -2.55 4.99 0.29 1.61 0.15 -1.00 -4.92 113.70 112.28 1wdd s SER 112 Ca 0.00 -2.23 -0.02 0.00 0.70 0.00 0.00 55.95 54.40 1wdd s SER 112 Cb 0.00 -1.74 0.41 0.00 -1.71 0.00 0.00 66.02 62.98 1wdd s SER 112 CO 0.00 -0.44 1.93 0.58 1.20 0.00 0.00 173.24 176.51 1wdd h VAL 113 N 6.30 1.22 -0.48 4.45 2.07 -1.93 -2.11 116.25 125.78 1wdd h VAL 113 Ca -0.08 -0.48 0.09 0.00 0.82 0.00 0.00 66.70 67.05 1wdd h VAL 113 Cb 1.02 0.10 -0.08 0.00 -1.52 0.00 0.00 31.29 30.81 1wdd h VAL 113 CO 0.63 0.23 0.00 0.74 0.02 0.00 0.00 177.57 179.19 1wdd h THR 114 N 1.09 0.63 -0.58 2.57 2.02 -1.91 -0.91 112.91 115.83 1wdd h THR 114 Ca 0.28 -0.04 -0.08 0.00 0.77 0.00 0.00 66.41 67.35 1wdd h THR 114 Cb -0.05 0.51 -0.02 0.00 -1.74 0.00 0.00 68.15 66.85 1wdd h THR 114 CO -0.05 0.02 0.06 -1.13 0.37 0.00 0.00 175.52 174.79 1wdd h ASN 115 N 0.11 0.94 -0.21 4.18 -0.73 -1.75 -0.88 115.58 117.25 1wdd h ASN 115 Ca 0.24 -0.28 0.03 0.00 1.87 0.00 0.00 56.30 58.17 1wdd h ASN 115 Cb 0.35 -0.25 -0.03 0.00 0.27 0.00 0.00 38.32 38.66 1wdd h ASN 115 CO -0.39 0.98 0.01 -0.03 -0.37 0.00 0.00 177.43 177.62 1wdd h MET 116 N 0.87 0.07 -0.35 6.67 4.05 -0.80 -2.09 114.93 123.35 1wdd h MET 116 Ca 0.17 -0.00 -0.08 0.00 -0.28 0.00 0.00 59.70 59.50 1wdd h MET 116 Cb 0.46 -0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.23 1wdd h MET 116 CO 0.02 0.05 -0.12 0.74 0.23 0.00 0.00 176.91 177.82 1wdd h PHE 117 N 0.07 0.68 -0.75 1.39 -1.00 -1.13 -1.88 116.94 114.33 1wdd h PHE 117 Ca 0.10 -0.11 0.01 0.00 2.81 0.00 0.00 57.97 60.78 1wdd h PHE 117 Cb 0.12 -0.18 -0.04 0.00 3.61 0.00 0.00 35.95 39.46 1wdd h PHE 117 CO -0.17 0.72 0.49 1.15 -1.61 0.00 0.00 178.31 178.88 1wdd h THR 118 N 0.57 1.17 0.38 -1.55 2.02 -0.59 0.61 112.91 115.52 1wdd h THR 118 Ca 0.10 -0.34 -0.02 0.00 0.77 0.00 0.00 66.41 66.92 1wdd h THR 118 Cb 0.55 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.06 1wdd h THR 118 CO 0.03 0.18 -0.18 0.28 0.37 0.00 0.00 175.52 176.20 1wdd h SER 119 N 0.98 -0.43 0.43 4.18 0.02 -1.28 -2.18 113.55 115.27 1wdd h SER 119 Ca 0.28 -0.12 -0.12 0.00 -0.84 0.00 0.00 61.79 60.99 1wdd h SER 119 Cb -0.08 0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 1wdd h SER 119 CO -0.07 0.00 -0.53 0.40 -1.14 0.00 0.00 176.83 175.49 1wdd h ILE 120 N -0.99 1.37 0.00 3.27 2.04 -1.23 -3.22 117.51 118.75 1wdd h ILE 120 Ca -0.05 -1.81 0.00 0.00 1.00 0.00 0.00 64.86 64.00 1wdd h ILE 120 Cb 0.53 1.93 0.00 0.00 -0.74 0.00 0.00 36.82 38.54 1wdd h ILE 120 CO 0.09 0.53 -0.11 1.33 0.00 0.00 0.00 178.15 179.98 1wdd n VAL 121 N -3.92 1.14 0.10 1.67 0.24 0.19 -4.82 118.33 112.92 1wdd n VAL 121 Ca -0.02 -1.33 -0.13 0.00 -2.04 0.00 0.00 64.34 60.82 1wdd n VAL 121 Cb 0.55 0.17 -0.08 0.00 -1.47 0.00 0.00 33.84 33.01 1wdd n VAL 121 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1wdd h GLY 122 N 0.00 -0.25 0.00 7.63 0.00 -1.14 -3.41 103.07 105.89 1wdd h GLY 122 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.42 1wdd h GLY 122 CO 0.00 -0.09 -0.51 0.70 0.00 0.00 0.00 176.54 176.63 1wdd n ASN 123 N -5.08 2.57 0.26 0.19 3.02 -1.26 -4.84 115.26 110.12 1wdd n ASN 123 Ca -0.09 -0.08 0.14 0.00 -0.03 0.00 0.00 54.58 54.52 1wdd n ASN 123 Cb 0.21 0.68 0.63 0.00 -0.61 0.00 0.00 39.78 40.70 1wdd n ASN 123 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 1wdd h VAL 124 N 0.00 0.29 0.00 2.41 -1.51 -1.83 -2.65 116.25 112.96 1wdd h VAL 124 Ca 0.00 -0.72 0.00 0.00 -1.23 0.00 0.00 66.70 64.75 1wdd h VAL 124 Cb 0.00 1.56 0.00 0.00 -2.13 0.00 0.00 31.29 30.72 1wdd h VAL 124 CO 0.00 0.10 0.00 0.49 -1.23 0.00 0.00 177.57 176.93 1wdd n PHE 125 N -3.28 0.48 0.27 5.19 3.01 -1.26 -2.48 117.46 119.39 1wdd n PHE 125 Ca -0.00 0.19 0.11 0.00 1.01 0.00 0.00 57.45 58.76 1wdd n PHE 125 Cb 0.33 -0.80 0.20 0.00 -0.01 0.00 0.00 39.48 39.20 1wdd n PHE 125 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1wdd n GLY 126 N 0.09 1.70 3.74 1.37 0.00 -1.00 -4.82 105.19 106.27 1wdd n GLY 126 Ca 0.03 -0.70 -0.41 0.00 0.00 0.00 0.00 46.02 44.94 1wdd n GLY 126 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1wdd s PHE 127 N -1.42 3.06 0.43 1.61 0.40 -1.04 -4.88 117.98 116.15 1wdd s PHE 127 Ca 0.36 1.06 0.13 0.00 -0.60 0.00 0.00 56.93 57.88 1wdd s PHE 127 Cb 0.21 -3.78 1.01 0.00 0.51 0.00 0.00 43.02 40.97 1wdd s PHE 127 CO 0.30 -2.54 1.99 0.87 0.70 0.00 0.00 175.22 176.54 1wdd h LYS 128 N 5.10 0.41 0.00 0.44 1.57 -1.94 -2.07 116.57 120.08 1wdd h LYS 128 Ca -0.46 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 1wdd h LYS 128 Cb 1.22 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.43 1wdd h LYS 128 CO 0.78 0.27 0.00 0.00 -0.57 0.00 0.00 179.45 179.93 1wdd n ALA 129 N -2.51 1.70 -2.64 3.86 0.00 -1.26 -4.67 120.51 114.98 1wdd n ALA 129 Ca 0.09 -0.05 -0.31 0.00 0.00 0.00 0.00 53.44 53.16 1wdd n ALA 129 Cb 0.32 -1.24 -0.09 0.00 0.00 0.00 0.00 19.45 18.45 1wdd n ALA 129 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1wdd s LEU 130 N -2.92 3.32 -0.07 0.00 1.43 -0.78 -1.06 118.68 118.61 1wdd s LEU 130 Ca 0.08 -0.20 0.15 0.00 -1.03 0.00 0.00 54.13 53.14 1wdd s LEU 130 Cb 0.10 -2.02 -0.22 0.00 0.03 0.00 0.00 46.19 44.07 1wdd s LEU 130 CO 0.26 0.21 0.53 0.54 0.23 0.00 0.00 176.35 178.12 1wdd n ARG 131 N 0.89 0.65 -3.49 1.70 1.74 0.86 -4.68 116.66 114.33 1wdd n ARG 131 Ca -0.13 0.19 -0.12 0.00 -0.77 0.00 0.00 57.85 57.03 1wdd n ARG 131 Cb 0.52 -1.72 -0.03 0.00 -1.02 0.00 0.00 32.46 30.21 1wdd n ARG 131 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1wdd s ALA 132 N -2.65 -1.76 -0.21 7.54 0.00 -1.06 -5.00 121.76 118.63 1wdd s ALA 132 Ca -0.06 0.99 -0.15 0.00 0.00 0.00 0.00 51.96 52.74 1wdd s ALA 132 Cb 0.08 0.32 0.06 0.00 0.00 0.00 0.00 23.12 23.58 1wdd s ALA 132 CO 0.83 -0.59 0.54 -1.17 0.00 0.00 0.00 175.76 175.36 1wdd s LEU 133 N -2.10 -0.27 -0.05 0.00 2.96 -1.21 -1.21 118.68 116.81 1wdd s LEU 133 Ca -0.01 1.13 0.00 0.00 -0.22 0.00 0.00 54.13 55.03 1wdd s LEU 133 Cb -0.01 1.83 0.02 0.00 0.50 0.00 0.00 46.19 48.54 1wdd s LEU 133 CO -0.05 -0.20 -0.02 -0.60 -1.32 0.00 0.00 176.35 174.16 1wdd s ARG 134 N 0.90 0.60 -0.31 1.98 3.52 0.07 -1.26 118.95 124.46 1wdd s ARG 134 Ca -0.05 0.01 -0.24 0.00 -0.13 0.00 0.00 55.73 55.32 1wdd s ARG 134 Cb -0.05 -0.75 0.00 0.00 -1.56 0.00 0.00 34.95 32.58 1wdd s ARG 134 CO -0.08 -0.15 0.80 -1.17 -0.81 0.00 0.00 175.30 173.89 1wdd s LEU 135 N 1.22 4.08 -0.09 -0.88 2.96 -0.13 -0.00 118.68 125.84 1wdd s LEU 135 Ca -0.07 0.66 0.01 0.00 -0.22 0.00 0.00 54.13 54.51 1wdd s LEU 135 Cb -0.14 -3.09 -0.25 0.00 0.50 0.00 0.00 46.19 43.22 1wdd s LEU 135 CO -0.02 -0.63 0.49 -0.62 -1.32 0.00 0.00 176.35 174.26 1wdd n GLU 136 N 6.23 0.71 -3.45 1.98 -0.58 0.00 -0.80 120.64 124.74 1wdd n GLU 136 Ca 0.04 0.28 -0.11 0.00 -0.42 0.00 0.00 57.16 56.95 1wdd n GLU 136 Cb 0.48 -1.75 -0.02 0.00 -0.57 0.00 0.00 31.44 29.58 1wdd n GLU 136 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1wdd s ASP 137 N -6.69 -0.51 -0.03 1.62 -1.08 -1.22 -4.55 116.67 104.22 1wdd s ASP 137 Ca -0.15 0.02 0.01 0.00 -0.52 0.00 0.00 52.55 51.91 1wdd s ASP 137 Cb 0.07 0.53 0.01 0.00 -1.46 0.00 0.00 42.92 42.07 1wdd s ASP 137 CO 0.79 -0.85 -0.06 -0.76 0.52 0.00 0.00 175.17 174.82 1wdd s LEU 138 N -2.62 1.54 -0.48 -1.34 1.43 -1.26 -1.44 118.68 114.52 1wdd s LEU 138 Ca 0.02 -0.13 -0.20 0.00 -1.03 0.00 0.00 54.13 52.79 1wdd s LEU 138 Cb -0.01 -0.44 0.04 0.00 0.03 0.00 0.00 46.19 45.81 1wdd s LEU 138 CO -0.11 -0.01 0.62 -0.60 0.23 0.00 0.00 176.35 176.48 1wdd s ARG 139 N 0.58 3.18 -0.38 1.70 3.00 0.96 -4.93 118.95 123.06 1wdd s ARG 139 Ca -0.08 -0.67 -0.19 0.00 -1.00 0.00 0.00 55.73 53.79 1wdd s ARG 139 Cb -0.11 -4.03 0.01 0.00 0.00 0.00 0.00 34.95 30.81 1wdd s ARG 139 CO 0.00 -1.12 0.57 0.42 0.00 0.00 0.00 175.30 175.17 1wdd s ILE 140 N 2.70 4.95 0.54 4.11 -1.09 -1.26 -2.44 121.20 128.70 1wdd s ILE 140 Ca 0.18 0.30 -0.19 0.00 -2.23 0.00 0.00 60.65 58.71 1wdd s ILE 140 Cb -0.17 -4.05 -0.06 0.00 -1.58 0.00 0.00 42.46 36.60 1wdd s ILE 140 CO 0.15 -0.34 1.08 -2.16 -1.23 0.00 0.00 174.94 172.43 1wdd s PRO 141 N 2.55 3.48 0.40 2.79 0.04 -1.26 -4.61 135.00 138.38 1wdd s PRO 141 Ca 0.20 1.41 0.11 0.00 0.04 0.00 0.00 61.00 62.77 1wdd s PRO 141 Cb -0.15 -2.04 0.92 0.00 0.04 0.00 0.00 34.50 33.27 1wdd s PRO 141 CO 0.15 -0.71 1.93 -1.35 0.04 0.00 0.00 177.00 177.06 1wdd h PRO 142 N 1.09 0.54 0.00 0.56 0.11 -1.83 0.04 132.00 132.51 1wdd h PRO 142 Ca -0.49 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.58 1wdd h PRO 142 Cb 1.24 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 1wdd h PRO 142 CO 0.58 0.36 -0.05 1.79 -0.21 0.00 0.00 178.00 180.47 1wdd h THR 143 N 0.56 0.64 0.08 -1.15 1.35 -1.91 -1.61 112.91 110.86 1wdd h THR 143 Ca 0.35 -0.19 -0.37 0.00 -0.55 0.00 0.00 66.41 65.65 1wdd h THR 143 Cb 0.59 1.12 -0.04 0.00 -1.73 0.00 0.00 68.15 68.09 1wdd h THR 143 CO -0.12 0.05 -2.12 0.00 -0.25 0.00 0.00 175.52 173.07 1wdd n TYR 144 N -3.91 0.83 0.23 4.73 9.36 -0.13 -4.34 117.16 123.94 1wdd n TYR 144 Ca -0.03 0.19 0.07 0.00 3.32 0.00 0.00 57.90 61.45 1wdd n TYR 144 Cb 0.14 -1.11 0.57 0.00 -0.63 0.00 0.00 39.34 38.31 1wdd n TYR 144 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 1wdd h SER 145 N -0.04 0.00 0.40 2.98 4.64 -0.95 -1.62 113.55 118.97 1wdd h SER 145 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1wdd h SER 145 Cb 1.94 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.03 1wdd h SER 145 CO 0.00 0.17 0.00 0.29 -0.87 0.00 0.00 176.83 176.42 1wdd n LYS 146 N -4.14 0.12 -0.00 4.77 4.76 -0.63 -1.59 118.16 121.45 1wdd n LYS 146 Ca -0.02 0.46 0.15 0.00 -2.87 0.00 0.00 58.31 56.02 1wdd n LYS 146 Cb 0.24 -1.78 0.75 0.00 -1.84 0.00 0.00 35.03 32.40 1wdd n LYS 146 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1wdd n THR 147 N -2.02 0.01 -4.38 -0.18 -2.24 -0.61 -4.85 114.28 100.02 1wdd n THR 147 Ca 0.01 -0.11 -0.32 0.00 -2.27 0.00 0.00 64.05 61.37 1wdd n THR 147 Cb 0.14 -0.08 -0.10 0.00 -2.10 0.00 0.00 70.33 68.19 1wdd n THR 147 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1wdd s PHE 148 N -1.99 2.93 0.15 4.78 0.40 -0.62 -3.45 117.98 120.17 1wdd s PHE 148 Ca 0.43 -0.02 -0.12 0.00 -0.60 0.00 0.00 56.93 56.62 1wdd s PHE 148 Cb 0.21 -1.60 0.01 0.00 0.51 0.00 0.00 43.02 42.15 1wdd s PHE 148 CO 0.35 0.40 1.58 0.37 0.70 0.00 0.00 175.22 178.62 1wdd h GLN 149 N 4.33 0.90 0.00 0.44 4.15 -1.86 -3.49 115.11 119.57 1wdd h GLN 149 Ca -0.48 -0.32 0.00 0.00 0.77 0.00 0.00 58.65 58.62 1wdd h GLN 149 Cb 1.17 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.79 1wdd h GLN 149 CO 0.55 0.96 0.00 0.41 -1.93 0.00 0.00 178.83 178.82 1wdd n GLY 150 N -0.29 -0.96 3.60 2.39 0.00 -1.09 -4.87 105.19 103.96 1wdd n GLY 150 Ca 0.00 -1.20 -0.47 0.00 0.00 0.00 0.00 46.02 44.35 1wdd n GLY 150 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1wdd n PRO 151 N 0.00 1.39 -0.05 1.61 -0.02 -1.23 -4.30 135.00 132.40 1wdd n PRO 151 Ca 0.00 0.49 0.08 0.00 -2.02 0.00 0.00 63.50 62.05 1wdd n PRO 151 Cb 0.00 -1.98 0.46 0.00 -0.02 0.00 0.00 33.50 31.96 1wdd n PRO 151 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1wdd h PRO 152 N 3.07 0.48 0.00 0.52 0.11 -1.83 -3.40 132.00 130.96 1wdd h PRO 152 Ca -0.42 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1wdd h PRO 152 Cb 1.33 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1wdd h PRO 152 CO 0.68 0.32 -0.17 0.72 -0.21 0.00 0.00 178.00 179.34 1wdd n HIS 153 N -4.47 -0.90 0.00 0.65 8.25 -1.26 -4.70 115.22 112.78 1wdd n HIS 153 Ca 0.07 0.16 0.00 0.00 -0.26 0.00 0.00 57.72 57.69 1wdd n HIS 153 Cb 0.22 0.36 0.00 0.00 1.12 0.00 0.00 29.99 31.69 1wdd n HIS 153 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1wdd n GLY 154 N 2.10 0.21 0.36 -1.41 0.00 -1.26 -4.43 105.19 100.75 1wdd n GLY 154 Ca 0.00 -1.78 -0.12 0.00 0.00 0.00 0.00 46.02 44.12 1wdd n GLY 154 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1wdd h ILE 155 N 0.00 0.24 -0.14 -0.61 2.04 -1.69 0.03 117.51 117.39 1wdd h ILE 155 Ca 0.00 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.87 1wdd h ILE 155 Cb 0.00 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 36.31 1wdd h ILE 155 CO 0.00 0.00 0.05 -0.61 0.00 0.00 0.00 178.15 177.59 1wdd h GLN 156 N -0.47 0.12 -0.71 2.37 4.15 -1.89 -1.53 115.11 117.16 1wdd h GLN 156 Ca 0.07 -0.01 -0.04 0.00 0.77 0.00 0.00 58.65 59.45 1wdd h GLN 156 Cb 0.58 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 28.21 1wdd h GLN 156 CO -0.33 0.08 0.29 0.28 -1.93 0.00 0.00 178.83 177.22 1wdd h VAL 157 N 0.13 1.25 -0.36 2.39 2.07 -1.69 -0.67 116.25 119.36 1wdd h VAL 157 Ca 0.06 -0.77 -0.01 0.00 0.82 0.00 0.00 66.70 66.79 1wdd h VAL 157 Cb 0.03 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.21 1wdd h VAL 157 CO -0.05 0.31 0.18 -0.08 0.02 0.00 0.00 177.57 177.94 1wdd h GLU 158 N 1.01 0.52 -0.95 1.57 4.81 -0.75 0.19 114.58 120.99 1wdd h GLU 158 Ca 0.24 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 1wdd h GLU 158 Cb 0.21 -0.09 -0.05 0.00 0.63 0.00 0.00 28.75 29.45 1wdd h GLU 158 CO -0.02 0.47 0.60 0.00 -0.73 0.00 0.00 179.01 179.33 1wdd h ARG 159 N 0.45 1.28 -0.34 1.92 3.08 -0.99 -1.43 114.38 118.35 1wdd h ARG 159 Ca 0.13 -0.10 -0.11 0.00 0.07 0.00 0.00 59.98 59.97 1wdd h ARG 159 Cb 0.11 -0.28 -0.01 0.00 0.08 0.00 0.00 29.97 29.87 1wdd h ARG 159 CO -0.02 0.87 -0.24 -0.44 -1.07 0.00 0.00 179.97 179.08 1wdd h ASP 160 N 1.31 0.68 -0.35 7.04 3.32 -0.61 0.17 116.42 127.97 1wdd h ASP 160 Ca 0.34 -0.24 -0.11 0.00 0.02 0.00 0.00 57.03 57.04 1wdd h ASP 160 Cb -0.10 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.25 1wdd h ASP 160 CO -0.07 0.90 -0.19 0.11 -1.72 0.00 0.00 179.24 178.28 1wdd h LYS 161 N 0.59 0.83 -0.00 3.56 1.79 -0.20 -3.16 116.57 119.97 1wdd h LYS 161 Ca 0.08 -0.32 0.00 0.00 -2.18 0.00 0.00 60.65 58.23 1wdd h LYS 161 Cb 0.72 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.33 1wdd h LYS 161 CO 0.06 0.95 -0.54 1.28 -1.08 0.00 0.00 179.45 180.11 1wdd n LEU 162 N -4.12 0.61 -3.44 2.94 4.77 -0.58 -4.96 117.00 112.22 1wdd n LEU 162 Ca 0.01 -0.09 -0.22 0.00 -0.03 0.00 0.00 56.01 55.68 1wdd n LEU 162 Cb 0.42 -0.21 0.08 0.00 -2.33 0.00 0.00 43.42 41.38 1wdd n LEU 162 CO 0.45 0.15 0.22 -3.20 -1.33 0.00 0.00 177.39 173.67 1wdd n ASN 163 N -1.42 -5.59 -4.11 -1.43 5.15 0.52 -4.64 115.26 103.75 1wdd n ASN 163 Ca 0.06 -0.53 -0.33 0.00 -0.60 0.00 0.00 54.58 53.19 1wdd n ASN 163 Cb 0.34 -4.85 -0.16 0.00 -0.53 0.00 0.00 39.78 34.58 1wdd n ASN 163 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1wdd s LYS 164 N -6.12 2.88 0.02 1.20 1.02 -0.84 -5.03 119.74 112.87 1wdd s LYS 164 Ca 0.48 -0.81 -0.02 0.00 0.02 0.00 0.00 55.97 55.63 1wdd s LYS 164 Cb -0.21 -2.52 -0.02 0.00 -0.52 0.00 0.00 37.83 34.56 1wdd s LYS 164 CO 0.70 -0.23 0.02 0.71 -0.92 0.00 0.00 175.35 175.63 1wdd s TYR 165 N 1.31 0.23 0.00 3.18 2.02 -1.26 -4.70 117.35 118.13 1wdd s TYR 165 Ca 0.05 -0.50 0.00 0.00 -0.37 0.00 0.00 57.07 56.25 1wdd s TYR 165 Cb -0.13 -0.17 0.00 0.00 -0.40 0.00 0.00 41.96 41.25 1wdd s TYR 165 CO -0.12 -0.25 0.00 0.41 -1.57 0.00 0.00 175.55 174.02 1wdd n GLY 166 N 1.33 0.75 3.51 0.71 0.00 -1.26 -5.03 105.19 105.19 1wdd n GLY 166 Ca -0.22 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.71 1wdd n GLY 166 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1wdd s ARG 167 N -0.52 0.84 0.74 1.61 1.70 -1.26 -5.02 118.95 117.05 1wdd s ARG 167 Ca 0.00 -0.31 -0.15 0.00 -0.47 0.00 0.00 55.73 54.80 1wdd s ARG 167 Cb 0.00 0.39 0.05 0.00 -0.57 0.00 0.00 34.95 34.81 1wdd s ARG 167 CO 0.00 -0.37 1.23 -2.14 -1.08 0.00 0.00 175.30 172.94 1wdd s PRO 168 N -3.15 2.01 0.51 3.89 0.02 -1.18 -4.78 135.00 132.33 1wdd s PRO 168 Ca 0.05 1.84 -0.10 0.00 0.02 0.00 0.00 61.00 62.80 1wdd s PRO 168 Cb -0.01 -1.81 -0.05 0.00 0.02 0.00 0.00 34.50 32.65 1wdd s PRO 168 CO -0.09 -1.95 0.89 -0.51 -0.33 0.00 0.00 177.00 175.01 1wdd s LEU 169 N -5.21 3.56 -0.08 -5.54 1.43 -0.14 -4.93 118.68 107.78 1wdd s LEU 169 Ca 0.76 1.25 0.04 0.00 -1.03 0.00 0.00 54.13 55.14 1wdd s LEU 169 Cb -0.31 -4.21 0.00 0.00 0.03 0.00 0.00 46.19 41.70 1wdd s LEU 169 CO 0.46 -0.62 -0.19 -0.76 0.23 0.00 0.00 176.35 175.47 1wdd s LEU 170 N -4.52 1.92 0.00 1.79 1.43 -1.26 -0.73 118.68 117.31 1wdd s LEU 170 Ca 0.53 -0.44 0.00 0.00 -1.03 0.00 0.00 54.13 53.19 1wdd s LEU 170 Cb -0.10 -1.16 0.00 0.00 0.03 0.00 0.00 46.19 44.96 1wdd s LEU 170 CO 0.42 0.13 0.00 0.61 0.23 0.00 0.00 176.35 177.73 1wdd n GLY 171 N 3.50 4.38 3.57 -3.19 0.00 -0.03 -1.07 105.19 112.35 1wdd n GLY 171 Ca -0.20 -1.87 0.02 0.00 0.00 0.00 0.00 46.02 43.97 1wdd n GLY 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wdd s THR 173 N 1.28 5.11 0.48 0.00 2.01 -1.26 -4.30 115.64 118.96 1wdd s THR 173 Ca -0.07 1.10 -0.23 0.00 0.31 0.00 0.00 61.69 62.80 1wdd s THR 173 Cb -0.02 -3.88 -0.07 0.00 0.01 0.00 0.00 72.50 68.54 1wdd s THR 173 CO -0.12 0.33 1.29 -0.63 -0.69 0.00 0.00 174.62 174.80 1wdd s ILE 174 N 0.50 2.54 0.06 1.82 -1.09 -1.26 -4.39 121.20 119.38 1wdd s ILE 174 Ca 0.29 0.43 0.00 0.00 -2.23 0.00 0.00 60.65 59.15 1wdd s ILE 174 Cb -0.16 -3.23 -0.04 0.00 -1.58 0.00 0.00 42.46 37.45 1wdd s ILE 174 CO 0.13 0.02 -0.05 -0.54 -1.23 0.00 0.00 174.94 173.27 1wdd s LYS 175 N -2.65 0.62 0.84 2.79 -0.14 -1.26 -4.43 119.74 115.51 1wdd s LYS 175 Ca 0.65 -1.10 -0.13 0.00 -1.36 0.00 0.00 55.97 54.02 1wdd s LYS 175 Cb -0.36 0.01 0.08 0.00 -1.68 0.00 0.00 37.83 35.87 1wdd s LYS 175 CO 0.44 -0.05 1.00 -0.35 -0.76 0.00 0.00 175.35 175.63 1wdd n PRO 176 N 0.46 -0.00 -0.02 -1.68 -0.04 -1.26 -5.05 135.00 127.40 1wdd n PRO 176 Ca -0.16 0.07 -0.09 0.00 -0.04 0.00 0.00 63.50 63.28 1wdd n PRO 176 Cb 0.59 -2.28 -0.03 0.00 -0.04 0.00 0.00 33.50 31.75 1wdd n PRO 176 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1wdd h LYS 177 N -1.14 -0.05 -5.57 0.54 1.57 -1.99 -3.43 116.57 106.50 1wdd h LYS 177 Ca -0.45 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 57.87 1wdd h LYS 177 Cb 1.30 0.01 -0.14 0.00 0.08 0.00 0.00 32.23 33.48 1wdd h LYS 177 CO 0.43 -0.03 -0.72 -0.51 -0.57 0.00 0.00 179.45 178.05 1wdd s LEU 178 N -10.40 2.53 0.00 2.94 1.43 -1.26 -4.71 118.68 109.21 1wdd s LEU 178 Ca -0.14 -1.07 0.00 0.00 -1.03 0.00 0.00 54.13 51.90 1wdd s LEU 178 Cb 0.10 -0.68 0.00 0.00 0.03 0.00 0.00 46.19 45.64 1wdd s LEU 178 CO 0.68 -0.21 0.00 0.61 0.23 0.00 0.00 176.35 177.66 1wdd n GLY 179 N -0.44 1.29 3.85 -3.19 0.00 -1.26 -5.09 105.19 100.35 1wdd n GLY 179 Ca -0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.61 1wdd n GLY 179 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wdd s LEU 180 N 0.00 4.23 0.79 0.99 1.43 -1.26 -5.02 118.68 119.84 1wdd s LEU 180 Ca 0.00 1.11 -0.11 0.00 -1.03 0.00 0.00 54.13 54.10 1wdd s LEU 180 Cb 0.00 -3.61 0.06 0.00 0.03 0.00 0.00 46.19 42.67 1wdd s LEU 180 CO 0.00 -0.03 1.09 -0.94 0.23 0.00 0.00 176.35 176.71 1wdd s SER 181 N -2.03 4.57 0.20 2.29 1.04 -1.26 -4.50 113.70 114.01 1wdd s SER 181 Ca 0.45 1.34 -0.11 0.00 0.48 0.00 0.00 55.95 58.11 1wdd s SER 181 Cb -0.13 -2.09 0.19 0.00 0.10 0.00 0.00 66.02 64.09 1wdd s SER 181 CO 0.20 -1.92 1.80 0.00 0.98 0.00 0.00 173.24 174.29 1wdd h ALA 182 N -1.06 0.79 -0.57 5.32 0.00 -1.92 0.50 119.26 122.32 1wdd h ALA 182 Ca -0.47 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.37 1wdd h ALA 182 Cb 1.26 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1wdd h ALA 182 CO 0.59 0.00 0.01 -0.22 0.00 0.00 0.00 179.25 179.63 1wdd h LYS 183 N 0.62 0.98 -0.00 0.00 1.63 -1.93 -1.78 116.57 116.08 1wdd h LYS 183 Ca 0.26 -0.29 -0.12 0.00 -0.85 0.00 0.00 60.65 59.66 1wdd h LYS 183 Cb 0.15 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 31.66 1wdd h LYS 183 CO -0.16 0.96 -0.57 -0.91 -3.45 0.00 0.00 179.45 175.32 1wdd h ASN 184 N 0.90 0.01 -0.45 4.20 2.35 -1.83 -1.62 115.58 119.14 1wdd h ASN 184 Ca 0.17 -0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.90 1wdd h ASN 184 Cb 0.51 -0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.86 1wdd h ASN 184 CO 0.02 0.57 0.23 0.22 -1.65 0.00 0.00 177.43 176.83 1wdd h TYR 185 N 0.00 0.64 -0.33 1.19 3.20 -0.39 -0.60 116.97 120.68 1wdd h TYR 185 Ca -0.01 -0.02 -0.10 0.00 3.14 0.00 0.00 58.73 61.75 1wdd h TYR 185 Cb 1.00 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 39.06 1wdd h TYR 185 CO 0.00 0.50 -0.19 0.78 -1.64 0.00 0.00 178.16 177.60 1wdd h GLY 186 N 0.59 0.67 0.88 1.82 0.00 -1.14 -0.58 103.07 105.31 1wdd h GLY 186 Ca 0.16 -0.53 -0.02 0.00 0.00 0.00 0.00 47.33 46.93 1wdd h GLY 186 CO -0.02 0.48 0.07 -0.09 0.00 0.00 0.00 176.54 176.98 1wdd h ARG 187 N 0.55 0.41 -0.62 4.80 2.43 -0.95 -0.23 114.38 120.77 1wdd h ARG 187 Ca 0.09 -0.10 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 1wdd h ARG 187 Cb 0.64 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.10 1wdd h ARG 187 CO 0.05 0.50 0.35 0.00 -1.51 0.00 0.00 179.97 179.36 1wdd h ALA 188 N 0.89 0.79 0.14 2.80 0.00 -0.84 -1.51 119.26 121.54 1wdd h ALA 188 Ca 0.08 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1wdd h ALA 188 Cb 0.27 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1wdd h ALA 188 CO 0.00 0.30 -0.12 0.00 0.00 0.00 0.00 179.25 179.43 1wdd h TYR 190 N -0.28 0.60 -0.57 0.00 3.20 -0.82 -0.68 116.97 118.42 1wdd h TYR 190 Ca -0.00 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.81 1wdd h TYR 190 Cb 0.25 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.32 1wdd h TYR 190 CO -0.11 0.31 0.02 0.93 -1.64 0.00 0.00 178.16 177.67 1wdd h GLU 191 N 0.62 0.97 -0.15 1.82 4.39 -1.13 -0.78 114.58 120.32 1wdd h GLU 191 Ca 0.25 -0.28 -0.03 0.00 0.34 0.00 0.00 59.36 59.64 1wdd h GLU 191 Cb 0.11 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.66 1wdd h GLU 191 CO -0.15 0.94 -0.01 0.00 -1.16 0.00 0.00 179.01 178.63 1wdd h LEU 193 N 0.01 0.43 -0.99 0.00 3.38 -0.97 -2.64 115.31 114.54 1wdd h LEU 193 Ca 0.04 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1wdd h LEU 193 Cb 0.41 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1wdd h LEU 193 CO 0.01 0.75 0.00 0.08 0.09 0.00 0.00 178.44 179.37 1wdd h ARG 194 N 0.36 0.00 -0.00 1.13 0.11 -1.15 -2.49 114.38 112.34 1wdd h ARG 194 Ca 0.04 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.12 1wdd h ARG 194 Cb 0.78 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.86 1wdd h ARG 194 CO 0.06 0.00 -0.13 0.41 0.10 0.00 0.00 179.97 180.42 1wdd n GLY 195 N 0.16 -1.18 0.00 0.08 0.00 -1.00 -4.91 105.19 98.35 1wdd n GLY 195 Ca 0.02 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1wdd n GLY 195 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wdd n GLY 196 N 1.37 0.50 3.81 -0.02 0.00 -0.94 -2.26 105.19 107.65 1wdd n GLY 196 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1wdd n GLY 196 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wdd s LEU 197 N 0.00 3.88 0.09 0.99 1.43 -1.23 -4.80 118.68 119.04 1wdd s LEU 197 Ca 0.00 1.78 0.00 0.00 -1.03 0.00 0.00 54.13 54.88 1wdd s LEU 197 Cb 0.00 -4.55 -0.25 0.00 0.03 0.00 0.00 46.19 41.42 1wdd s LEU 197 CO 0.00 -0.55 1.18 0.44 0.23 0.00 0.00 176.35 177.65 1wdd h ASP 198 N 1.70 0.25 -5.09 2.29 3.32 -1.43 -3.43 116.42 114.03 1wdd h ASP 198 Ca -0.49 -0.27 -0.15 0.00 0.02 0.00 0.00 57.03 56.14 1wdd h ASP 198 Cb 1.20 -0.08 -0.18 0.00 0.22 0.00 0.00 39.33 40.48 1wdd h ASP 198 CO 0.60 1.22 -0.69 -0.36 -1.72 0.00 0.00 179.24 178.29 1wdd s PHE 199 N -2.68 0.39 0.00 4.55 0.08 -0.50 -1.70 117.98 118.12 1wdd s PHE 199 Ca -0.02 -0.78 0.00 0.00 0.12 0.00 0.00 56.93 56.25 1wdd s PHE 199 Cb 0.08 -0.29 0.00 0.00 -0.57 0.00 0.00 43.02 42.25 1wdd s PHE 199 CO 0.86 -0.27 0.00 0.25 -0.10 0.00 0.00 175.22 175.95 1wdd n THR 200 N 0.90 0.00 -3.07 0.64 -2.24 -0.91 -2.92 114.28 106.69 1wdd n THR 200 Ca -0.19 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.22 1wdd n THR 200 Cb 0.58 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.75 1wdd n THR 200 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1wdd s ASP 202 N 1.00 7.12 0.85 3.42 1.01 -0.91 -0.70 116.67 128.46 1wdd s ASP 202 Ca 0.00 1.48 -0.10 0.00 0.71 0.00 0.00 52.55 54.63 1wdd s ASP 202 Cb 0.00 -2.44 0.11 0.00 1.01 0.00 0.00 42.92 41.60 1wdd s ASP 202 CO 0.00 0.05 1.12 -0.62 0.21 0.00 0.00 175.17 175.93 1wdd s ASP 203 N -1.57 3.61 0.42 0.27 -1.08 -1.26 -4.87 116.67 112.19 1wdd s ASP 203 Ca 0.42 2.01 0.10 0.00 -0.52 0.00 0.00 52.55 54.56 1wdd s ASP 203 Cb -0.18 -2.54 0.93 0.00 -1.46 0.00 0.00 42.92 39.67 1wdd s ASP 203 CO 0.22 -2.63 2.02 1.05 0.52 0.00 0.00 175.17 176.35 1wdd h GLU 204 N -1.54 0.48 -0.05 4.34 9.09 -1.98 -0.52 114.58 124.41 1wdd h GLU 204 Ca -0.44 -0.03 0.00 0.00 0.05 0.00 0.00 59.36 58.95 1wdd h GLU 204 Cb 1.25 -0.11 0.00 0.00 -1.65 0.00 0.00 28.75 28.24 1wdd h GLU 204 CO 0.46 0.32 0.00 0.27 0.05 0.00 0.00 179.01 180.11 1wdd n ASN 205 N -4.48 1.63 -4.56 3.06 6.94 -1.26 -4.76 115.26 111.83 1wdd n ASN 205 Ca 0.06 -1.56 -0.43 0.00 -0.02 0.00 0.00 54.58 52.63 1wdd n ASN 205 Cb 0.19 -0.02 -0.03 0.00 -2.36 0.00 0.00 39.78 37.56 1wdd n ASN 205 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1wdd s VAL 206 N -1.96 4.24 0.00 3.53 1.01 -0.20 -4.83 120.40 122.18 1wdd s VAL 206 Ca 0.37 0.71 0.00 0.00 0.00 0.00 0.00 61.98 63.06 1wdd s VAL 206 Cb 0.20 -4.60 0.00 0.00 0.00 0.00 0.00 36.38 31.98 1wdd s VAL 206 CO 0.32 -1.14 0.00 0.59 0.00 0.00 0.00 175.10 174.87 1wdd n ASN 207 N 7.83 0.00 -3.72 3.32 5.03 -1.26 -4.72 115.26 121.73 1wdd n ASN 207 Ca 0.06 0.00 -0.14 0.00 0.87 0.00 0.00 54.58 55.38 1wdd n ASN 207 Cb 0.48 0.00 -0.14 0.00 -1.02 0.00 0.00 39.78 39.10 1wdd n ASN 207 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 1wdd s SER 208 N 1.00 -0.01 0.21 6.41 0.15 -1.26 -4.11 113.70 116.08 1wdd s SER 208 Ca 0.00 0.40 -0.10 0.00 0.70 0.00 0.00 55.95 56.96 1wdd s SER 208 Cb 0.00 0.31 -0.01 0.00 -1.71 0.00 0.00 66.02 64.61 1wdd s SER 208 CO 0.00 -0.17 0.35 -1.10 1.20 0.00 0.00 173.24 173.51 1wdd s GLN 209 N 1.45 1.33 0.35 5.44 1.11 -0.41 -4.92 119.66 124.01 1wdd s GLN 209 Ca -0.07 -1.27 0.07 0.00 0.01 0.00 0.00 55.36 54.10 1wdd s GLN 209 Cb -0.11 0.40 0.77 0.00 -1.01 0.00 0.00 33.01 33.06 1wdd s GLN 209 CO -0.07 -0.52 1.88 -1.35 0.01 0.00 0.00 175.29 175.25 1wdd h PRO 210 N 2.42 0.72 0.00 2.91 0.11 -2.01 -1.40 132.00 134.75 1wdd h PRO 210 Ca -0.30 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1wdd h PRO 210 Cb 1.24 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1wdd h PRO 210 CO 0.43 0.48 0.00 1.97 -0.21 0.00 0.00 178.00 180.67 1wdd n PHE 211 N -4.55 0.54 -3.22 0.65 1.16 -1.26 -4.72 117.46 106.07 1wdd n PHE 211 Ca 0.16 0.18 0.04 0.00 -1.87 0.00 0.00 57.45 55.96 1wdd n PHE 211 Cb 0.40 -0.79 -0.02 0.00 -1.61 0.00 0.00 39.48 37.46 1wdd n PHE 211 CO 0.00 0.00 0.00 1.41 -1.87 0.00 0.00 176.76 176.30 1wdd s MET 212 N -3.11 0.27 0.25 3.97 0.00 -0.53 -4.17 119.30 115.98 1wdd s MET 212 Ca 0.09 0.53 -0.13 0.00 0.00 0.00 0.00 55.69 56.19 1wdd s MET 212 Cb 0.13 0.30 -0.08 0.00 0.00 0.00 0.00 34.83 35.18 1wdd s MET 212 CO 0.49 -0.23 0.63 1.03 0.00 0.00 0.00 175.02 176.93 1wdd s ARG 213 N 2.79 3.92 0.27 4.11 1.81 -1.22 -1.29 118.95 129.35 1wdd s ARG 213 Ca 0.02 0.48 -0.02 0.00 -1.72 0.00 0.00 55.73 54.49 1wdd s ARG 213 Cb -0.10 -2.61 0.37 0.00 -0.45 0.00 0.00 34.95 32.16 1wdd s ARG 213 CO -0.14 0.28 1.84 0.11 -0.68 0.00 0.00 175.30 176.71 1wdd h TRP 214 N 2.60 0.94 -0.04 -0.53 5.08 -1.90 -2.54 115.95 119.56 1wdd h TRP 214 Ca -0.47 -0.07 -0.13 0.00 1.08 0.00 0.00 58.89 59.30 1wdd h TRP 214 Cb 1.18 -0.28 -0.01 0.00 -3.00 0.00 0.00 29.16 27.04 1wdd h TRP 214 CO 0.62 0.74 -0.57 -0.09 -1.28 0.00 0.00 178.44 177.85 1wdd h ARG 215 N 0.90 0.14 -0.47 0.12 2.43 -1.94 0.08 114.38 115.64 1wdd h ARG 215 Ca 0.21 -0.09 -0.07 0.00 -0.81 0.00 0.00 59.98 59.22 1wdd h ARG 215 Cb 0.22 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.76 1wdd h ARG 215 CO -0.01 0.67 0.04 -0.44 -1.51 0.00 0.00 179.97 178.72 1wdd h ASP 216 N 0.10 0.78 -0.71 -3.80 3.32 -1.92 -1.70 116.42 112.50 1wdd h ASP 216 Ca -0.00 -0.28 -0.02 0.00 0.02 0.00 0.00 57.03 56.75 1wdd h ASP 216 Cb 1.04 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 40.35 1wdd h ASP 216 CO 0.08 0.87 0.38 -0.09 -1.72 0.00 0.00 179.24 178.76 1wdd h ARG 217 N 0.67 0.99 -0.63 3.56 2.43 -0.95 -1.79 114.38 118.66 1wdd h ARG 217 Ca 0.14 -0.12 -0.02 0.00 -0.81 0.00 0.00 59.98 59.17 1wdd h ARG 217 Cb 0.45 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.78 1wdd h ARG 217 CO 0.02 0.75 0.32 0.74 -1.51 0.00 0.00 179.97 180.28 1wdd h PHE 218 N 0.98 0.89 0.15 2.20 -1.00 -0.70 0.12 116.94 119.58 1wdd h PHE 218 Ca 0.25 -0.04 -0.01 0.00 2.81 0.00 0.00 57.97 60.98 1wdd h PHE 218 Cb 0.06 -0.28 0.00 0.00 3.61 0.00 0.00 35.95 39.34 1wdd h PHE 218 CO -0.00 0.66 -0.07 0.28 -1.61 0.00 0.00 178.31 177.57 1wdd h VAL 219 N 0.86 0.87 -0.09 -0.55 2.07 -1.08 -0.69 116.25 117.64 1wdd h VAL 219 Ca 0.22 -0.05 -0.14 0.00 0.82 0.00 0.00 66.70 67.54 1wdd h VAL 219 Cb 0.09 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 1wdd h VAL 219 CO -0.03 0.01 -0.58 -0.26 0.02 0.00 0.00 177.57 176.73 1wdd h PHE 220 N -0.22 0.36 -0.10 1.57 0.04 -1.10 -1.80 116.94 115.69 1wdd h PHE 220 Ca -0.02 -0.13 -0.15 0.00 2.80 0.00 0.00 57.97 60.46 1wdd h PHE 220 Cb 0.17 -0.07 -0.01 0.00 2.20 0.00 0.00 35.95 38.25 1wdd h PHE 220 CO -0.06 0.80 -0.60 0.00 -0.60 0.00 0.00 178.31 177.84 1wdd h ALA 222 N 1.12 0.50 -0.59 0.00 0.00 -0.87 0.73 119.26 120.14 1wdd h ALA 222 Ca -0.01 -0.12 0.09 0.00 0.00 0.00 0.00 54.91 54.88 1wdd h ALA 222 Cb 1.12 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 18.69 1wdd h ALA 222 CO 0.10 0.07 0.23 1.49 0.00 0.00 0.00 179.25 181.14 1wdd h GLU 223 N 0.48 0.41 -0.55 0.00 4.81 -1.10 -1.35 114.58 117.28 1wdd h GLU 223 Ca 0.13 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.32 1wdd h GLU 223 Cb 0.14 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.40 1wdd h GLU 223 CO -0.01 0.27 0.26 0.00 -0.73 0.00 0.00 179.01 178.79 1wdd h ALA 224 N 1.40 0.71 -0.30 2.92 0.00 -0.76 -0.51 119.26 122.71 1wdd h ALA 224 Ca 0.29 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.09 1wdd h ALA 224 Cb 0.34 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1wdd h ALA 224 CO -0.28 0.27 0.16 0.82 0.00 0.00 0.00 179.25 180.22 1wdd h ILE 225 N 0.74 1.01 -0.01 0.00 2.04 -0.52 -1.51 117.51 119.26 1wdd h ILE 225 Ca 0.19 -0.12 -0.15 0.00 1.00 0.00 0.00 64.86 65.78 1wdd h ILE 225 Cb 0.12 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 36.83 1wdd h ILE 225 CO -0.02 0.06 -0.70 1.88 0.00 0.00 0.00 178.15 179.37 1wdd h TYR 226 N 0.34 0.10 -0.21 1.37 0.05 -1.09 -0.95 116.97 116.57 1wdd h TYR 226 Ca 0.12 -0.04 -0.08 0.00 0.05 0.00 0.00 58.73 58.78 1wdd h TYR 226 Cb 0.02 -0.01 -0.00 0.00 1.01 0.00 0.00 36.73 37.74 1wdd h TYR 226 CO -0.09 0.74 -0.17 -0.22 -1.05 0.00 0.00 178.16 177.38 1wdd h LYS 227 N 0.05 0.49 -0.29 4.88 3.64 -0.92 -1.22 116.57 123.20 1wdd h LYS 227 Ca -0.01 -0.24 -0.12 0.00 -1.27 0.00 0.00 60.65 59.00 1wdd h LYS 227 Cb 1.23 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.04 1wdd h LYS 227 CO 0.10 0.81 -0.32 0.66 -2.27 0.00 0.00 179.45 178.42 1wdd h SER 228 N 0.18 0.64 -0.53 4.20 4.64 -1.19 -0.82 113.55 120.68 1wdd h SER 228 Ca 0.04 -0.26 -0.05 0.00 -0.47 0.00 0.00 61.79 61.06 1wdd h SER 228 Cb 0.70 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.59 1wdd h SER 228 CO 0.04 0.92 0.15 -0.61 -0.87 0.00 0.00 176.83 176.47 1wdd h GLN 229 N 0.53 0.83 -0.60 4.77 4.15 -1.12 -1.27 115.11 122.40 1wdd h GLN 229 Ca 0.06 -0.19 -0.07 0.00 0.77 0.00 0.00 58.65 59.22 1wdd h GLN 229 Cb 0.81 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.36 1wdd h GLN 229 CO 0.07 0.77 0.08 0.00 -1.93 0.00 0.00 178.83 177.82 1wdd h ALA 230 N 1.02 1.02 -0.27 3.38 0.00 -0.96 0.95 119.26 124.40 1wdd h ALA 230 Ca 0.17 -0.26 -0.18 0.00 0.00 0.00 0.00 54.91 54.64 1wdd h ALA 230 Cb 0.30 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1wdd h ALA 230 CO -0.00 0.62 -0.55 0.93 0.00 0.00 0.00 179.25 180.25 1wdd h GLU 231 N 0.91 0.84 0.00 0.00 5.08 -0.89 -3.33 114.58 117.19 1wdd h GLU 231 Ca 0.18 -0.55 -0.14 0.00 -1.00 0.00 0.00 59.36 57.85 1wdd h GLU 231 Cb 0.42 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 1wdd h GLU 231 CO 0.01 1.18 -1.39 0.25 -1.00 0.00 0.00 179.01 178.07 1wdd n THR 232 N -4.03 1.09 -0.99 1.13 -2.24 -0.50 -4.97 114.28 103.75 1wdd n THR 232 Ca -0.05 -0.67 0.00 0.00 -2.27 0.00 0.00 64.05 61.06 1wdd n THR 232 Cb 0.63 -0.66 0.00 0.00 -2.10 0.00 0.00 70.33 68.20 1wdd n THR 232 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wdd n GLY 233 N 1.37 0.78 3.74 3.38 0.00 0.32 -5.05 105.19 109.73 1wdd n GLY 233 Ca -0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 1wdd n GLY 233 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wdd s GLU 234 N -0.04 2.94 0.24 1.61 2.02 -1.25 -5.04 118.70 119.18 1wdd s GLU 234 Ca 0.00 -0.54 -0.30 0.00 0.02 0.00 0.00 54.97 54.15 1wdd s GLU 234 Cb 0.00 -2.78 -0.10 0.00 0.10 0.00 0.00 34.13 31.36 1wdd s GLU 234 CO 0.00 0.64 1.42 0.42 0.02 0.00 0.00 175.26 177.76 1wdd s ILE 235 N -1.14 2.74 0.25 -1.63 1.01 -1.26 -4.46 121.20 116.71 1wdd s ILE 235 Ca 0.21 0.62 0.10 0.00 0.00 0.00 0.00 60.65 61.58 1wdd s ILE 235 Cb -0.12 -3.39 -0.05 0.00 0.01 0.00 0.00 42.46 38.91 1wdd s ILE 235 CO 0.12 0.10 -0.18 -0.54 0.00 0.00 0.00 174.94 174.43 1wdd s LYS 236 N -0.29 1.53 0.10 2.79 -0.14 -1.26 -4.90 119.74 117.57 1wdd s LYS 236 Ca 0.59 -1.69 -0.09 0.00 -1.36 0.00 0.00 55.97 53.42 1wdd s LYS 236 Cb -0.41 -1.51 0.00 0.00 -1.68 0.00 0.00 37.83 34.23 1wdd s LYS 236 CO 0.42 0.27 0.21 0.20 -0.76 0.00 0.00 175.35 175.70 1wdd s GLY 237 N -3.41 0.08 -0.08 -3.33 0.00 -0.69 -4.76 107.32 95.14 1wdd s GLY 237 Ca 0.27 -0.59 -0.02 0.00 0.00 0.00 0.00 44.72 44.38 1wdd s GLY 237 CO 0.12 -0.77 0.01 -1.58 0.00 0.00 0.00 173.10 170.88 1wdd s HIS 238 N -3.86 0.64 -0.28 1.90 2.46 -1.26 -2.14 115.29 112.76 1wdd s HIS 238 Ca 0.05 -0.21 -0.29 0.00 0.47 0.00 0.00 55.06 55.09 1wdd s HIS 238 Cb 0.05 -0.80 -0.02 0.00 -0.13 0.00 0.00 32.58 31.68 1wdd s HIS 238 CO -0.11 -0.35 1.69 0.71 -2.47 0.00 0.00 174.74 174.21 1wdd s TYR 239 N 1.98 1.98 -0.11 3.88 2.02 0.12 -4.75 117.35 122.47 1wdd s TYR 239 Ca 0.04 0.57 -0.22 0.00 -0.37 0.00 0.00 57.07 57.09 1wdd s TYR 239 Cb -0.13 -4.08 -0.03 0.00 -0.40 0.00 0.00 41.96 37.32 1wdd s TYR 239 CO -0.05 -2.92 0.67 -0.51 -1.57 0.00 0.00 175.55 171.17 1wdd s LEU 240 N 5.95 4.27 -0.19 -1.29 1.43 -1.20 -2.13 118.68 125.52 1wdd s LEU 240 Ca 0.75 1.08 -0.29 0.00 -1.03 0.00 0.00 54.13 54.64 1wdd s LEU 240 Cb -0.23 -3.01 0.00 0.00 0.03 0.00 0.00 46.19 42.97 1wdd s LEU 240 CO 0.32 -0.16 1.01 0.21 0.23 0.00 0.00 176.35 177.96 1wdd s ASN 241 N 0.88 7.13 0.00 2.29 3.84 -1.26 -0.81 114.94 127.01 1wdd s ASN 241 Ca 0.35 1.40 0.25 0.00 0.21 0.00 0.00 52.86 55.07 1wdd s ASN 241 Cb -0.17 -2.54 0.50 0.00 -0.55 0.00 0.00 41.25 38.49 1wdd s ASN 241 CO 0.15 -0.58 1.43 0.00 -2.79 0.00 0.00 177.10 175.31 1wdd n ALA 242 N 5.82 2.64 -1.72 1.71 0.00 -0.44 -4.92 120.51 123.60 1wdd n ALA 242 Ca 0.10 -0.59 -0.43 0.00 0.00 0.00 0.00 53.44 52.53 1wdd n ALA 242 Cb 0.47 -0.95 -0.02 0.00 0.00 0.00 0.00 19.45 18.95 1wdd n ALA 242 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1wdd n THR 243 N 0.71 0.63 -3.98 0.00 -1.04 -1.26 -4.31 114.28 105.03 1wdd n THR 243 Ca 0.15 -0.16 -0.12 0.00 -2.04 0.00 0.00 64.05 61.89 1wdd n THR 243 Cb 0.49 -1.84 -0.02 0.00 -1.82 0.00 0.00 70.33 67.14 1wdd n THR 243 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1wdd s ALA 244 N 0.40 0.06 -0.19 2.41 0.00 -1.26 -4.83 121.76 118.35 1wdd s ALA 244 Ca 0.69 -1.13 0.18 0.00 0.00 0.00 0.00 51.96 51.70 1wdd s ALA 244 Cb -0.54 0.97 0.26 0.00 0.00 0.00 0.00 23.12 23.81 1wdd s ALA 244 CO 0.43 -0.87 1.54 0.78 0.00 0.00 0.00 175.76 177.64 1wdd h GLY 245 N 2.09 0.00 -3.25 0.00 0.00 -1.96 -3.46 103.07 96.49 1wdd h GLY 245 Ca -0.29 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 46.87 1wdd h GLY 245 CO 0.38 0.00 -0.69 -0.51 0.00 0.00 0.00 176.54 175.72 1wdd s THR 246 N -3.12 0.43 0.32 4.70 -4.23 -1.26 -5.05 115.64 107.43 1wdd s THR 246 Ca 0.04 -1.82 0.04 0.00 -1.18 0.00 0.00 61.69 58.78 1wdd s THR 246 Cb 0.07 -1.52 0.12 0.00 1.34 0.00 0.00 72.50 72.50 1wdd s THR 246 CO 0.71 -0.91 1.81 0.00 -0.54 0.00 0.00 174.62 175.69 1wdd h GLU 248 N 0.43 0.94 -0.38 0.00 3.07 -1.99 -1.30 114.58 115.36 1wdd h GLU 248 Ca 0.08 -0.33 -0.15 0.00 -0.50 0.00 0.00 59.36 58.46 1wdd h GLU 248 Cb 0.49 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.32 1wdd h GLU 248 CO 0.03 0.99 -0.35 0.93 -1.40 0.00 0.00 179.01 179.21 1wdd h GLU 249 N 0.85 0.87 -0.12 2.33 4.39 -1.87 -1.38 114.58 119.64 1wdd h GLU 249 Ca 0.14 -0.44 0.01 0.00 0.34 0.00 0.00 59.36 59.41 1wdd h GLU 249 Cb 0.63 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.27 1wdd h GLU 249 CO 0.04 1.08 0.04 1.98 -1.16 0.00 0.00 179.01 180.99 1wdd h MET 250 N 0.72 0.10 -0.54 2.33 4.05 -0.91 -1.62 114.93 119.07 1wdd h MET 250 Ca 0.07 -0.01 -0.10 0.00 -0.28 0.00 0.00 59.70 59.38 1wdd h MET 250 Cb 0.92 -0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.68 1wdd h MET 250 CO 0.09 0.06 -0.05 0.82 0.23 0.00 0.00 176.91 178.06 1wdd h ILE 251 N 0.10 1.26 -0.82 1.77 1.08 -1.21 -1.70 117.51 117.99 1wdd h ILE 251 Ca 0.05 -1.17 0.09 0.00 -0.39 0.00 0.00 64.86 63.44 1wdd h ILE 251 Cb 0.03 0.90 -0.07 0.00 -3.07 0.00 0.00 36.82 34.61 1wdd h ILE 251 CO -0.06 0.42 0.47 0.50 -0.69 0.00 0.00 178.15 178.79 1wdd h LYS 252 N 0.87 0.77 -0.27 2.37 3.64 -1.01 0.11 116.57 123.05 1wdd h LYS 252 Ca 0.15 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.38 1wdd h LYS 252 Cb 0.58 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.23 1wdd h LYS 252 CO 0.04 0.51 -0.23 0.00 -2.27 0.00 0.00 179.45 177.49 1wdd h ARG 253 N 0.79 0.63 -0.74 1.90 3.08 -0.86 -2.24 114.38 116.94 1wdd h ARG 253 Ca 0.39 -0.32 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 1wdd h ARG 253 Cb 0.34 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.36 1wdd h ARG 253 CO -0.24 0.92 0.41 0.00 -1.07 0.00 0.00 179.97 179.99 1wdd h ALA 254 N 0.70 1.32 -0.81 0.04 0.00 -0.71 -1.65 119.26 118.15 1wdd h ALA 254 Ca 0.05 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1wdd h ALA 254 Cb 0.78 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 1wdd h ALA 254 CO 0.06 0.56 0.38 0.28 0.00 0.00 0.00 179.25 180.52 1wdd h VAL 255 N 1.04 1.26 -0.08 0.00 2.07 -0.68 -0.61 116.25 119.24 1wdd h VAL 255 Ca 0.26 -0.74 -0.17 0.00 0.82 0.00 0.00 66.70 66.87 1wdd h VAL 255 Cb 0.02 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.01 1wdd h VAL 255 CO -0.04 0.31 -0.68 0.15 0.02 0.00 0.00 177.57 177.33 1wdd h PHE 256 N 1.16 0.49 -0.59 1.57 3.57 -0.90 -0.58 116.94 121.66 1wdd h PHE 256 Ca 0.28 -0.21 -0.05 0.00 3.53 0.00 0.00 57.97 61.53 1wdd h PHE 256 Cb 0.14 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.77 1wdd h PHE 256 CO 0.02 0.94 0.18 0.00 -2.23 0.00 0.00 178.31 177.21 1wdd h ALA 257 N 1.01 1.21 -0.48 2.41 0.00 -0.92 -0.48 119.26 122.01 1wdd h ALA 257 Ca -0.02 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1wdd h ALA 257 Cb 1.24 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1wdd h ALA 257 CO 0.11 0.56 0.26 -0.09 0.00 0.00 0.00 179.25 180.09 1wdd h ARG 258 N 0.86 0.67 -0.94 0.00 1.12 -0.68 -2.24 114.38 113.17 1wdd h ARG 258 Ca 0.19 -0.08 0.03 0.00 -1.11 0.00 0.00 59.98 59.01 1wdd h ARG 258 Cb 0.26 -0.13 -0.05 0.00 -0.01 0.00 0.00 29.97 30.04 1wdd h ARG 258 CO -0.01 0.53 0.62 1.49 -3.11 0.00 0.00 179.97 179.49 1wdd h GLU 259 N 0.63 1.17 0.00 0.20 4.81 -0.43 -1.25 114.58 119.71 1wdd h GLU 259 Ca 0.17 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1wdd h GLU 259 Cb 0.06 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 29.17 1wdd h GLU 259 CO -0.03 0.77 0.00 1.28 -0.73 0.00 0.00 179.01 180.31 1wdd n LEU 260 N -4.43 0.61 0.00 1.64 4.77 -0.25 -4.90 117.00 114.44 1wdd n LEU 260 Ca 0.12 0.62 0.00 0.00 -0.03 0.00 0.00 56.01 56.72 1wdd n LEU 260 Cb 0.07 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.67 1wdd n LEU 260 CO 0.35 -0.40 0.00 0.61 -1.33 0.00 0.00 177.39 176.62 1wdd n GLY 261 N 0.42 0.48 3.81 -0.72 0.00 -0.47 -5.03 105.19 103.68 1wdd n GLY 261 Ca 0.03 -0.33 -0.30 0.00 0.00 0.00 0.00 46.02 45.42 1wdd n GLY 261 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1wdd s VAL 262 N -2.00 3.44 -0.41 1.61 -7.23 -1.16 -5.00 120.40 109.65 1wdd s VAL 262 Ca 0.00 0.47 0.23 0.00 -1.81 0.00 0.00 61.98 60.87 1wdd s VAL 262 Cb 0.00 -3.19 0.12 0.00 0.56 0.00 0.00 36.38 33.86 1wdd s VAL 262 CO 0.00 -0.61 1.30 1.55 -0.31 0.00 0.00 175.10 177.03 1wdd h PRO 263 N -0.96 0.00 -2.66 4.82 0.13 -1.92 -3.46 132.00 127.95 1wdd h PRO 263 Ca -0.46 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.56 1wdd h PRO 263 Cb 1.24 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.14 1wdd h PRO 263 CO 0.58 0.00 -0.20 -1.50 -0.23 0.00 0.00 178.00 176.65 1wdd s ILE 264 N -3.26 -0.00 0.38 -3.56 2.07 -1.26 -1.02 121.20 114.54 1wdd s ILE 264 Ca 0.04 0.00 0.05 0.00 -1.41 0.00 0.00 60.65 59.33 1wdd s ILE 264 Cb 0.09 -0.62 -0.07 0.00 0.13 0.00 0.00 42.46 42.00 1wdd s ILE 264 CO 0.73 0.00 0.04 0.68 -1.91 0.00 0.00 174.94 174.48 1wdd s VAL 265 N 0.27 1.52 0.21 4.00 -7.23 -0.33 -3.25 120.40 115.59 1wdd s VAL 265 Ca -0.00 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.20 1wdd s VAL 265 Cb -0.03 -2.82 -0.05 0.00 0.56 0.00 0.00 36.38 34.04 1wdd s VAL 265 CO 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 175.10 174.79 1wdd s MET 266 N -3.80 1.27 -0.11 4.82 0.23 0.01 -0.13 119.30 121.59 1wdd s MET 266 Ca 0.33 -1.63 -0.17 0.00 -1.03 0.00 0.00 55.69 53.19 1wdd s MET 266 Cb 0.08 -0.52 0.04 0.00 -1.53 0.00 0.00 34.83 32.90 1wdd s MET 266 CO 0.16 -0.10 0.42 -1.58 -2.03 0.00 0.00 175.02 171.89 1wdd s HIS 267 N -3.48 -0.41 -0.74 3.16 5.04 -0.46 -1.33 115.29 117.07 1wdd s HIS 267 Ca 0.27 0.89 -0.17 0.00 -1.54 0.00 0.00 55.06 54.51 1wdd s HIS 267 Cb 0.06 0.17 0.14 0.00 0.04 0.00 0.00 32.58 32.99 1wdd s HIS 267 CO 0.07 -0.31 0.82 -0.51 -2.34 0.00 0.00 174.74 172.47 1wdd s ASP 268 N -0.38 6.46 0.45 9.88 1.01 -1.26 -1.21 116.67 131.63 1wdd s ASP 268 Ca -0.05 -1.96 0.22 0.00 0.71 0.00 0.00 52.55 51.46 1wdd s ASP 268 Cb -0.03 -2.30 1.09 0.00 1.01 0.00 0.00 42.92 42.69 1wdd s ASP 268 CO 0.03 -0.94 1.94 0.10 0.21 0.00 0.00 175.17 176.50 1wdd h TYR 269 N 8.68 0.00 0.11 4.23 -0.00 -1.84 -0.18 116.97 127.97 1wdd h TYR 269 Ca -0.07 0.00 -0.33 0.00 -0.00 0.00 0.00 58.73 58.34 1wdd h TYR 269 Cb 1.06 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.77 1wdd h TYR 269 CO 0.97 0.23 -1.74 -0.07 -0.00 0.00 0.00 178.16 177.55 1wdd h LEU 270 N 0.00 0.36 0.05 0.10 3.38 -1.79 0.31 115.31 117.73 1wdd h LEU 270 Ca -0.00 -0.63 -0.24 0.00 0.09 0.00 0.00 57.88 57.10 1wdd h LEU 270 Cb 0.53 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1wdd h LEU 270 CO 0.03 1.55 -1.11 0.71 0.09 0.00 0.00 178.44 179.71 1wdd h THR 271 N 0.06 1.61 0.01 0.22 1.35 -1.67 -3.20 112.91 111.29 1wdd h THR 271 Ca -0.32 -3.23 -0.22 0.00 -0.55 0.00 0.00 66.41 62.09 1wdd h THR 271 Cb 2.03 2.88 0.02 0.00 -1.73 0.00 0.00 68.15 71.35 1wdd h THR 271 CO 0.13 0.93 -0.88 1.23 -0.25 0.00 0.00 175.52 176.68 1wdd h GLY 272 N 2.30 0.64 0.00 5.82 0.00 -1.18 -3.50 103.07 107.15 1wdd h GLY 272 Ca -0.07 -1.15 0.00 0.00 0.00 0.00 0.00 47.33 46.11 1wdd h GLY 272 CO 0.16 1.02 0.00 0.61 0.00 0.00 0.00 176.54 178.33 1wdd n GLY 273 N 1.11 2.66 0.27 4.60 0.00 0.10 -4.64 105.19 109.29 1wdd n GLY 273 Ca -0.11 -1.90 -0.04 0.00 0.00 0.00 0.00 46.02 43.97 1wdd n GLY 273 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1wdd h PHE 274 N 0.00 0.70 -0.26 1.61 0.04 -1.87 0.75 116.94 117.91 1wdd h PHE 274 Ca 0.00 -0.11 -0.01 0.00 2.80 0.00 0.00 57.97 60.65 1wdd h PHE 274 Cb 0.00 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 37.95 1wdd h PHE 274 CO 0.00 0.72 0.13 1.15 -0.60 0.00 0.00 178.31 179.71 1wdd h THR 275 N 0.60 1.14 -0.49 -1.55 2.02 -1.92 -0.26 112.91 112.45 1wdd h THR 275 Ca 0.11 -0.41 -0.07 0.00 0.77 0.00 0.00 66.41 66.82 1wdd h THR 275 Cb 0.51 0.94 -0.02 0.00 -1.74 0.00 0.00 68.15 67.83 1wdd h THR 275 CO 0.03 0.14 0.04 0.00 0.37 0.00 0.00 175.52 176.10 1wdd h ALA 276 N 0.99 0.66 -0.50 6.16 0.00 -1.79 -2.62 119.26 122.16 1wdd h ALA 276 Ca 0.09 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1wdd h ALA 276 Cb 0.11 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1wdd h ALA 276 CO -0.01 0.43 0.32 -0.97 0.00 0.00 0.00 179.25 179.02 1wdd h ASN 277 N 0.71 0.58 -0.62 0.00 -1.24 -0.67 -0.47 115.58 113.88 1wdd h ASN 277 Ca 0.14 -0.03 -0.02 0.00 0.71 0.00 0.00 56.30 57.11 1wdd h ASN 277 Cb 0.46 -0.15 -0.03 0.00 0.73 0.00 0.00 38.32 39.33 1wdd h ASN 277 CO 0.02 0.44 0.32 0.74 -1.29 0.00 0.00 177.43 177.66 1wdd h THR 278 N 0.67 1.21 -0.74 -3.57 2.02 -0.99 0.19 112.91 111.70 1wdd h THR 278 Ca 0.18 -0.56 0.04 0.00 0.77 0.00 0.00 66.41 66.83 1wdd h THR 278 Cb -0.05 0.44 -0.05 0.00 -1.74 0.00 0.00 68.15 66.75 1wdd h THR 278 CO -0.04 0.24 0.46 0.28 0.37 0.00 0.00 175.52 176.83 1wdd h SER 279 N 0.85 0.75 -0.26 4.18 0.02 -1.14 -1.91 113.55 116.04 1wdd h SER 279 Ca 0.22 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 61.04 1wdd h SER 279 Cb 0.09 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.46 1wdd h SER 279 CO -0.03 0.51 -0.29 0.25 -1.14 0.00 0.00 176.83 176.13 1wdd h LEU 280 N 0.90 0.79 -1.06 5.07 5.85 -0.29 -1.57 115.31 125.01 1wdd h LEU 280 Ca 0.30 -0.32 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 1wdd h LEU 280 Cb 0.05 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 40.82 1wdd h LEU 280 CO -0.12 1.03 0.41 0.00 -0.34 0.00 0.00 178.44 179.42 1wdd h ALA 281 N 1.01 1.28 -0.50 1.25 0.00 -0.31 0.76 119.26 122.75 1wdd h ALA 281 Ca 0.08 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 1wdd h ALA 281 Cb 0.82 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1wdd h ALA 281 CO 0.07 0.58 0.06 0.45 0.00 0.00 0.00 179.25 180.41 1wdd h HIS 282 N 1.07 0.91 -0.62 0.00 3.86 -0.99 -1.51 115.15 117.88 1wdd h HIS 282 Ca 0.27 -0.14 0.00 0.00 -1.16 0.00 0.00 60.37 59.35 1wdd h HIS 282 Cb 0.04 -0.25 -0.03 0.00 1.06 0.00 0.00 27.41 28.24 1wdd h HIS 282 CO 0.01 0.84 0.39 -0.92 0.86 0.00 0.00 177.93 179.11 1wdd h TYR 283 N 0.72 0.80 -0.64 2.45 3.20 -0.74 -0.43 116.97 122.33 1wdd h TYR 283 Ca 0.15 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.96 1wdd h TYR 283 Cb 0.43 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.41 1wdd h TYR 283 CO 0.03 0.52 0.14 0.00 -1.64 0.00 0.00 178.16 177.22 1wdd h ARG 285 N 0.95 0.71 0.00 0.00 9.65 -1.05 -0.73 114.38 123.92 1wdd h ARG 285 Ca 0.20 -0.06 0.00 0.00 -1.10 0.00 0.00 59.98 59.02 1wdd h ARG 285 Cb 0.38 -0.15 0.00 0.00 -1.39 0.00 0.00 29.97 28.80 1wdd h ARG 285 CO 0.00 0.51 0.00 -0.25 2.80 0.00 0.00 179.97 183.03 1wdd n ASP 286 N -4.68 0.00 -0.04 -3.80 8.00 -0.19 -3.49 116.55 112.35 1wdd n ASP 286 Ca 0.03 0.16 0.01 0.00 0.71 0.00 0.00 54.79 55.70 1wdd n ASP 286 Cb 0.04 -0.37 0.01 0.00 -0.02 0.00 0.00 41.12 40.79 1wdd n ASP 286 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1wdd n ASN 287 N -1.37 1.25 -0.65 -2.24 3.02 -0.52 -5.02 115.26 109.73 1wdd n ASN 287 Ca 0.09 -1.78 -0.08 0.00 -0.03 0.00 0.00 54.58 52.77 1wdd n ASN 287 Cb 0.21 -0.06 -0.04 0.00 -0.61 0.00 0.00 39.78 39.29 1wdd n ASN 287 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wdd n GLY 288 N -0.40 1.02 3.71 7.41 0.00 -0.35 -5.01 105.19 111.57 1wdd n GLY 288 Ca 0.02 -0.51 -0.37 0.00 0.00 0.00 0.00 46.02 45.16 1wdd n GLY 288 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wdd s LEU 289 N -1.93 4.21 0.46 0.99 1.43 -0.76 -4.95 118.68 118.13 1wdd s LEU 289 Ca 0.00 0.44 -0.22 0.00 -1.03 0.00 0.00 54.13 53.32 1wdd s LEU 289 Cb 0.00 -2.34 -0.08 0.00 0.03 0.00 0.00 46.19 43.80 1wdd s LEU 289 CO 0.00 0.07 1.12 -0.76 0.23 0.00 0.00 176.35 177.01 1wdd s LEU 290 N 0.68 3.98 -0.28 1.79 1.43 -0.19 -4.53 118.68 121.56 1wdd s LEU 290 Ca 0.15 2.19 0.03 0.00 -1.03 0.00 0.00 54.13 55.47 1wdd s LEU 290 Cb -0.13 -4.32 0.07 0.00 0.03 0.00 0.00 46.19 41.84 1wdd s LEU 290 CO 0.04 -0.87 -0.05 -0.22 0.23 0.00 0.00 176.35 175.49 1wdd s LEU 291 N -3.12 3.55 -0.09 1.79 2.96 -1.26 -1.19 118.68 121.32 1wdd s LEU 291 Ca 0.64 -1.56 -0.24 0.00 -0.22 0.00 0.00 54.13 52.75 1wdd s LEU 291 Cb -0.25 -1.46 -0.03 0.00 0.50 0.00 0.00 46.19 44.95 1wdd s LEU 291 CO 0.30 -0.26 0.73 -2.28 -1.32 0.00 0.00 176.35 173.53 1wdd s HIS 292 N 1.14 3.53 -0.18 5.38 5.65 0.81 -0.12 115.29 131.50 1wdd s HIS 292 Ca -0.02 1.24 -0.05 0.00 0.25 0.00 0.00 55.06 56.49 1wdd s HIS 292 Cb -0.19 -2.86 -0.03 0.00 -1.18 0.00 0.00 32.58 28.32 1wdd s HIS 292 CO -0.07 -0.00 -0.01 0.42 -0.65 0.00 0.00 174.74 174.43 1wdd s ILE 293 N 1.17 4.00 -0.15 0.89 -1.09 -0.18 -1.35 121.20 124.50 1wdd s ILE 293 Ca 0.38 -0.31 -0.08 0.00 -2.23 0.00 0.00 60.65 58.41 1wdd s ILE 293 Cb -0.17 -2.78 -0.04 0.00 -1.58 0.00 0.00 42.46 37.88 1wdd s ILE 293 CO 0.17 0.46 0.12 -2.28 -1.23 0.00 0.00 174.94 172.18 1wdd s HIS 294 N 0.69 3.48 -0.36 3.97 5.65 -0.35 -2.78 115.29 125.60 1wdd s HIS 294 Ca -0.01 0.41 0.05 0.00 0.25 0.00 0.00 55.06 55.76 1wdd s HIS 294 Cb -0.14 -2.01 0.55 0.00 -1.18 0.00 0.00 32.58 29.80 1wdd s HIS 294 CO 0.02 0.53 1.68 2.89 -0.65 0.00 0.00 174.74 179.22 1wdd n ARG 295 N 2.61 2.39 -1.49 2.88 1.85 -1.26 -2.63 116.66 121.00 1wdd n ARG 295 Ca -0.18 -2.41 -0.52 0.00 -1.00 0.00 0.00 57.85 53.74 1wdd n ARG 295 Cb 0.54 -1.97 -0.05 0.00 -1.05 0.00 0.00 32.46 29.93 1wdd n ARG 295 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1wdd n ALA 296 N -0.56 -2.41 -0.30 2.89 0.00 -1.26 -0.92 120.51 117.94 1wdd n ALA 296 Ca 0.43 0.50 0.00 0.00 0.00 0.00 0.00 53.44 54.36 1wdd n ALA 296 Cb 1.35 -1.80 0.00 0.00 0.00 0.00 0.00 19.45 19.00 1wdd n ALA 296 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wdd n MET 297 N 1.39 0.00 -0.33 0.00 0.00 -1.26 -4.04 117.12 112.88 1wdd n MET 297 Ca 0.17 0.00 0.06 0.00 0.00 0.00 0.00 57.70 57.94 1wdd n MET 297 Cb 0.19 -1.60 0.25 0.00 0.00 0.00 0.00 33.22 32.07 1wdd n MET 297 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 175.97 177.09 1wdd h HIS 298 N 0.00 1.07 0.00 3.17 -0.00 -1.46 -1.18 115.15 116.75 1wdd h HIS 298 Ca 0.00 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.40 1wdd h HIS 298 Cb 0.00 -0.34 0.00 0.00 -0.00 0.00 0.00 27.41 27.07 1wdd h HIS 298 CO 0.00 0.49 0.00 0.00 -0.00 0.00 0.00 177.93 178.42 1wdd h ALA 299 N 1.53 1.00 -0.34 6.11 0.00 -1.92 0.88 119.26 126.51 1wdd h ALA 299 Ca 0.44 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.33 1wdd h ALA 299 Cb 0.38 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1wdd h ALA 299 CO -0.20 0.00 0.11 0.28 0.00 0.00 0.00 179.25 179.44 1wdd h VAL 300 N 0.00 1.15 0.02 0.00 2.07 -1.62 -3.07 116.25 114.79 1wdd h VAL 300 Ca 0.00 -0.49 -0.36 0.00 0.82 0.00 0.00 66.70 66.67 1wdd h VAL 300 Cb 0.37 0.78 -0.06 0.00 -1.52 0.00 0.00 31.29 30.85 1wdd h VAL 300 CO 0.00 0.18 -2.18 -0.38 0.02 0.00 0.00 177.57 175.21 1wdd n ILE 301 N -4.38 1.53 -0.20 4.57 5.41 -0.36 -4.72 119.36 121.23 1wdd n ILE 301 Ca 0.02 -0.74 0.04 0.00 1.00 0.00 0.00 62.75 63.07 1wdd n ILE 301 Cb 0.16 -1.05 0.11 0.00 -0.71 0.00 0.00 39.64 38.15 1wdd n ILE 301 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 1wdd n ASP 302 N -3.07 2.69 0.10 4.38 5.68 0.16 -1.90 116.55 124.58 1wdd n ASP 302 Ca -0.32 -2.09 -0.22 0.00 -0.50 0.00 0.00 54.79 51.66 1wdd n ASP 302 Cb 1.07 -0.19 -0.15 0.00 -1.14 0.00 0.00 41.12 40.72 1wdd n ASP 302 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 1wdd h ARG 303 N 1.33 0.40 -6.09 0.11 9.65 -1.78 -3.42 114.38 114.59 1wdd h ARG 303 Ca 0.00 -0.68 -0.59 0.00 -1.10 0.00 0.00 59.98 57.61 1wdd h ARG 303 Cb 0.71 0.25 -0.05 0.00 -1.39 0.00 0.00 29.97 29.50 1wdd h ARG 303 CO 0.01 1.31 -0.12 -0.65 2.80 0.00 0.00 179.97 183.32 1wdd s GLN 304 N -2.60 4.08 0.37 0.20 -1.52 -1.26 -4.24 119.66 114.69 1wdd s GLN 304 Ca -0.11 0.57 0.12 0.00 -1.95 0.00 0.00 55.36 53.99 1wdd s GLN 304 Cb 0.05 -3.25 0.72 0.00 -0.22 0.00 0.00 33.01 30.32 1wdd s GLN 304 CO 0.88 0.62 1.83 -0.22 -0.25 0.00 0.00 175.29 178.16 1wdd h LYS 305 N 4.79 0.03 0.00 2.91 3.64 -1.89 -3.26 116.57 122.79 1wdd h LYS 305 Ca -0.50 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 58.84 1wdd h LYS 305 Cb 1.21 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1wdd h LYS 305 CO 0.63 0.38 -0.35 -2.95 -2.27 0.00 0.00 179.45 174.89 1wdd h ASN 306 N 0.03 0.00 -4.03 4.20 -1.07 -1.95 -3.46 115.58 109.29 1wdd h ASN 306 Ca 0.00 0.00 -0.09 0.00 0.07 0.00 0.00 56.30 56.28 1wdd h ASN 306 Cb 0.63 0.00 -0.23 0.00 -2.07 0.00 0.00 38.32 36.65 1wdd h ASN 306 CO 0.05 0.13 -0.11 -2.28 0.07 0.00 0.00 177.43 175.29 1wdd s HIS 307 N -3.17 -0.55 -0.38 4.14 5.04 -1.23 -3.32 115.29 115.82 1wdd s HIS 307 Ca 0.05 1.31 0.00 0.00 -1.54 0.00 0.00 55.06 54.88 1wdd s HIS 307 Cb 0.07 0.20 0.00 0.00 0.04 0.00 0.00 32.58 32.88 1wdd s HIS 307 CO 0.71 -0.29 0.00 0.41 -2.34 0.00 0.00 174.74 173.23 1wdd n GLY 308 N 2.63 0.20 2.80 1.59 0.00 -0.39 -4.36 105.19 107.67 1wdd n GLY 308 Ca -0.14 -1.78 -0.14 0.00 0.00 0.00 0.00 46.02 43.95 1wdd n GLY 308 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1wdd s MET 309 N -0.49 -0.02 0.55 1.61 -1.94 -0.80 -0.95 119.30 117.26 1wdd s MET 309 Ca 0.00 0.17 -0.19 0.00 -1.71 0.00 0.00 55.69 53.95 1wdd s MET 309 Cb 0.00 -0.19 -0.06 0.00 2.01 0.00 0.00 34.83 36.59 1wdd s MET 309 CO 0.00 -0.13 1.14 -1.58 -0.01 0.00 0.00 175.02 174.44 1wdd s HIS 310 N 0.86 2.63 0.52 -0.03 2.46 0.02 -3.70 115.29 118.06 1wdd s HIS 310 Ca -0.07 1.54 0.18 0.00 0.47 0.00 0.00 55.06 57.18 1wdd s HIS 310 Cb -0.10 -3.32 1.31 0.00 -0.13 0.00 0.00 32.58 30.33 1wdd s HIS 310 CO -0.03 -1.67 2.12 0.35 -2.47 0.00 0.00 174.74 173.04 1wdd h PHE 311 N 1.15 0.00 -0.04 3.88 3.57 -1.91 -1.37 116.94 122.22 1wdd h PHE 311 Ca -0.50 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.01 1wdd h PHE 311 Cb 1.27 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 40.01 1wdd h PHE 311 CO 0.51 0.00 0.03 0.07 -2.23 0.00 0.00 178.31 176.68 1wdd h ARG 312 N 0.00 0.00 -0.21 1.11 0.11 -1.90 0.26 114.38 113.75 1wdd h ARG 312 Ca 0.05 0.00 -0.14 0.00 0.10 0.00 0.00 59.98 59.99 1wdd h ARG 312 Cb 0.22 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.30 1wdd h ARG 312 CO -0.00 0.00 -0.43 0.28 0.10 0.00 0.00 179.97 179.92 1wdd h VAL 313 N 0.00 1.32 -0.13 0.08 2.07 -1.48 -1.58 116.25 116.53 1wdd h VAL 313 Ca 0.02 -1.65 -0.05 0.00 0.82 0.00 0.00 66.70 65.84 1wdd h VAL 313 Cb 0.07 1.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.67 1wdd h VAL 313 CO -0.00 0.52 -0.13 -0.07 0.02 0.00 0.00 177.57 177.91 1wdd h LEU 314 N 0.36 0.19 -0.11 2.57 3.38 -1.22 -0.98 115.31 119.49 1wdd h LEU 314 Ca 0.01 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 1wdd h LEU 314 Cb 1.03 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.73 1wdd h LEU 314 CO 0.09 0.34 -0.22 0.00 0.09 0.00 0.00 178.44 178.75 1wdd h ALA 315 N 1.68 0.18 -0.90 1.53 0.00 -0.42 -1.59 119.26 119.73 1wdd h ALA 315 Ca 0.04 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1wdd h ALA 315 Cb 0.35 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1wdd h ALA 315 CO 0.02 0.14 0.58 0.87 0.00 0.00 0.00 179.25 180.86 1wdd h LYS 316 N -0.08 1.20 -0.35 0.00 1.57 -1.07 -1.42 116.57 116.42 1wdd h LYS 316 Ca 0.00 -0.08 -0.06 0.00 -1.87 0.00 0.00 60.65 58.64 1wdd h LYS 316 Cb 0.81 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.83 1wdd h LYS 316 CO 0.05 0.81 -0.04 0.00 -0.57 0.00 0.00 179.45 179.70 1wdd h ALA 317 N 1.41 1.28 -0.07 3.86 0.00 -1.10 -1.52 119.26 123.12 1wdd h ALA 317 Ca 0.33 -0.23 -0.21 0.00 0.00 0.00 0.00 54.91 54.79 1wdd h ALA 317 Cb -0.11 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.53 1wdd h ALA 317 CO -0.07 0.48 -0.83 1.25 0.00 0.00 0.00 179.25 180.08 1wdd h LEU 318 N 0.53 0.66 -1.44 0.00 7.12 -0.79 0.17 115.31 121.56 1wdd h LEU 318 Ca 0.11 -0.47 -0.02 0.00 0.13 0.00 0.00 57.88 57.63 1wdd h LEU 318 Cb 0.40 -0.20 -0.02 0.00 -0.53 0.00 0.00 40.66 40.32 1wdd h LEU 318 CO 0.02 1.24 0.11 -0.09 -0.13 0.00 0.00 178.44 179.59 1wdd h ARG 319 N 0.34 0.49 0.15 1.25 2.43 -0.76 0.23 114.38 118.52 1wdd h ARG 319 Ca -0.06 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.04 1wdd h ARG 319 Cb 1.45 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.91 1wdd h ARG 319 CO 0.15 0.43 -0.07 0.52 -1.51 0.00 0.00 179.97 179.49 1wdd h MET 320 N 0.49 -0.19 -0.35 0.20 2.86 -1.10 -3.28 114.93 113.57 1wdd h MET 320 Ca 0.12 0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.76 1wdd h MET 320 Cb 0.14 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.83 1wdd h MET 320 CO -0.01 0.24 0.17 1.03 1.06 0.00 0.00 176.91 179.40 1wdd h SER 321 N -0.74 0.45 0.00 1.22 0.87 -0.75 -2.89 113.55 111.71 1wdd h SER 321 Ca -0.02 -0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.41 1wdd h SER 321 Cb 0.52 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.37 1wdd h SER 321 CO 0.03 0.45 0.00 0.61 -0.53 0.00 0.00 176.83 177.40 1wdd n GLY 322 N -0.86 3.92 3.56 5.77 0.00 0.80 -4.50 105.19 113.88 1wdd n GLY 322 Ca -0.01 -1.00 -0.11 0.00 0.00 0.00 0.00 46.02 44.89 1wdd n GLY 322 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1wdd s GLY 323 N 0.00 -0.33 -0.02 -0.02 0.00 -1.25 -4.75 107.32 100.96 1wdd s GLY 323 Ca 0.00 1.85 0.14 0.00 0.00 0.00 0.00 44.72 46.72 1wdd s GLY 323 CO 0.00 0.97 0.68 1.22 0.00 0.00 0.00 173.10 175.97 1wdd n ASP 324 N 0.69 0.81 -4.20 1.64 8.00 0.83 -4.29 116.55 120.03 1wdd n ASP 324 Ca -0.11 0.38 -0.16 0.00 0.71 0.00 0.00 54.79 55.60 1wdd n ASP 324 Cb 0.58 0.09 -0.11 0.00 -0.02 0.00 0.00 41.12 41.66 1wdd n ASP 324 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 1wdd s HIS 325 N -2.71 1.21 -0.10 1.24 3.76 -1.04 -1.16 115.29 116.49 1wdd s HIS 325 Ca -0.04 -0.59 -0.09 0.00 -0.15 0.00 0.00 55.06 54.19 1wdd s HIS 325 Cb 0.08 -0.65 0.03 0.00 1.11 0.00 0.00 32.58 33.15 1wdd s HIS 325 CO 0.82 0.07 0.26 -1.50 -0.85 0.00 0.00 174.74 173.54 1wdd s ILE 326 N -2.16 -0.00 0.40 0.60 2.07 -0.52 -1.01 121.20 120.57 1wdd s ILE 326 Ca 0.06 0.01 -0.27 0.00 -1.41 0.00 0.00 60.65 59.04 1wdd s ILE 326 Cb -0.05 -0.37 -0.09 0.00 0.13 0.00 0.00 42.46 42.08 1wdd s ILE 326 CO 0.02 0.00 1.34 -1.00 -1.91 0.00 0.00 174.94 173.39 1wdd s HIS 327 N 0.23 2.78 -0.00 3.50 3.76 -1.12 -0.58 115.29 123.86 1wdd s HIS 327 Ca -0.01 1.37 0.01 0.00 -0.15 0.00 0.00 55.06 56.28 1wdd s HIS 327 Cb -0.02 -3.74 0.01 0.00 1.11 0.00 0.00 32.58 29.94 1wdd s HIS 327 CO -0.00 -2.26 0.68 0.00 -0.85 0.00 0.00 174.74 172.31 1wdd n ALA 328 N 0.23 1.37 0.00 -1.40 0.00 -0.36 -4.76 120.51 115.58 1wdd n ALA 328 Ca 0.03 -0.74 0.00 0.00 0.00 0.00 0.00 53.44 52.73 1wdd n ALA 328 Cb 0.43 -0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.80 1wdd n ALA 328 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wdd n GLY 329 N -0.15 0.25 0.00 0.00 0.00 -1.24 -4.91 105.19 99.15 1wdd n GLY 329 Ca 0.01 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.17 1wdd n GLY 329 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1wdd n THR 330 N 0.47 0.00 0.00 2.61 -2.24 -1.26 -4.11 114.28 109.75 1wdd n THR 330 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1wdd n THR 330 Cb 0.00 0.48 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 1wdd n THR 330 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1wdd n VAL 331 N -1.47 0.00 1.12 2.28 0.31 -1.26 -4.42 118.33 114.88 1wdd n VAL 331 Ca 0.00 0.00 0.12 0.00 -0.01 0.00 0.00 64.34 64.45 1wdd n VAL 331 Cb 0.00 0.00 0.24 0.00 -0.91 0.00 0.00 33.84 33.17 1wdd n VAL 331 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1wdd n VAL 332 N 0.00 0.00 -0.68 2.52 0.24 -1.26 -4.58 118.33 114.57 1wdd n VAL 332 Ca 0.00 -0.10 0.00 0.00 -2.04 0.00 0.00 64.34 62.20 1wdd n VAL 332 Cb 0.00 0.54 0.00 0.00 -1.47 0.00 0.00 33.84 32.91 1wdd n VAL 332 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1wdd n GLY 333 N 1.41 0.81 0.10 7.63 0.00 -1.26 -4.19 105.19 109.70 1wdd n GLY 333 Ca 0.09 -1.75 0.13 0.00 0.00 0.00 0.00 46.02 44.49 1wdd n GLY 333 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1wdd n LYS 334 N 0.00 0.24 -4.18 1.61 2.85 -0.48 -4.71 118.16 113.49 1wdd n LYS 334 Ca 0.00 0.23 -0.29 0.00 -1.05 0.00 0.00 58.31 57.20 1wdd n LYS 334 Cb 0.00 -1.80 -0.09 0.00 -0.65 0.00 0.00 35.03 32.49 1wdd n LYS 334 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1wdd s LEU 335 N -4.46 3.26 0.44 -5.58 1.43 -1.26 -5.04 118.68 107.47 1wdd s LEU 335 Ca 0.10 -0.31 -0.24 0.00 -1.03 0.00 0.00 54.13 52.65 1wdd s LEU 335 Cb 0.12 -2.00 -0.08 0.00 0.03 0.00 0.00 46.19 44.27 1wdd s LEU 335 CO 0.57 0.16 1.22 -0.70 0.23 0.00 0.00 176.35 177.83 1wdd s GLU 336 N -2.38 3.80 -0.33 1.70 2.12 -1.26 -4.63 118.70 117.72 1wdd s GLU 336 Ca 0.24 1.92 -0.06 0.00 0.36 0.00 0.00 54.97 57.44 1wdd s GLU 336 Cb -0.11 -2.53 0.19 0.00 0.26 0.00 0.00 34.13 31.94 1wdd s GLU 336 CO 0.16 -0.55 0.93 0.20 -0.54 0.00 0.00 175.26 175.46 1wdd s GLY 337 N -1.13 -1.30 0.27 -1.50 0.00 -1.26 -4.87 107.32 97.53 1wdd s GLY 337 Ca 0.61 1.32 -0.30 0.00 0.00 0.00 0.00 44.72 46.35 1wdd s GLY 337 CO 0.40 4.09 1.51 1.85 0.00 0.00 0.00 173.10 180.94 1wdd s GLU 338 N 2.31 4.21 0.13 2.90 -6.30 -1.26 -4.09 118.70 116.58 1wdd s GLU 338 Ca 0.18 2.42 -0.25 0.00 -2.50 0.00 0.00 54.97 54.82 1wdd s GLU 338 Cb -0.01 -3.07 -0.04 0.00 0.00 0.00 0.00 34.13 31.01 1wdd s GLU 338 CO -0.17 -0.51 1.63 -0.09 0.02 0.00 0.00 175.26 176.15 1wdd h ARG 339 N 4.97 -0.36 -0.51 4.30 2.43 -1.98 -0.96 114.38 122.28 1wdd h ARG 339 Ca -0.46 0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 58.62 1wdd h ARG 339 Cb 1.22 0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.83 1wdd h ARG 339 CO 0.78 -0.24 -0.12 0.93 -1.51 0.00 0.00 179.97 179.81 1wdd h GLU 340 N -0.37 0.95 0.00 0.20 4.39 -1.91 -0.65 114.58 117.19 1wdd h GLU 340 Ca 0.07 -0.35 -0.11 0.00 0.34 0.00 0.00 59.36 59.31 1wdd h GLU 340 Cb 0.47 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.05 1wdd h GLU 340 CO -0.25 1.02 -0.54 0.52 -1.16 0.00 0.00 179.01 178.60 1wdd h MET 341 N 0.85 0.00 -0.30 2.33 2.86 -1.76 -2.09 114.93 116.81 1wdd h MET 341 Ca 0.13 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.72 1wdd h MET 341 Cb 0.67 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.32 1wdd h MET 341 CO 0.05 0.54 -0.01 1.15 1.06 0.00 0.00 176.91 179.69 1wdd h THR 342 N 0.00 1.26 -0.61 2.22 2.02 -0.77 -1.56 112.91 115.47 1wdd h THR 342 Ca -0.01 -0.97 0.02 0.00 0.77 0.00 0.00 66.41 66.22 1wdd h THR 342 Cb 0.98 1.29 -0.03 0.00 -1.74 0.00 0.00 68.15 68.66 1wdd h THR 342 CO 0.07 0.31 0.41 -0.07 0.37 0.00 0.00 175.52 176.61 1wdd h LEU 343 N 0.33 0.66 -0.08 2.58 3.38 -0.94 0.63 115.31 121.88 1wdd h LEU 343 Ca 0.08 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1wdd h LEU 343 Cb 0.46 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 1wdd h LEU 343 CO 0.02 0.47 0.03 1.23 0.09 0.00 0.00 178.44 180.27 1wdd h GLY 344 N 0.78 0.14 2.00 0.83 0.00 -0.73 -1.85 103.07 104.24 1wdd h GLY 344 Ca 0.24 -0.08 -0.05 0.00 0.00 0.00 0.00 47.33 47.44 1wdd h GLY 344 CO -0.06 0.08 -0.22 0.27 0.00 0.00 0.00 176.54 176.61 1wdd h PHE 345 N -0.05 0.00 -0.69 5.60 -5.15 -0.89 -1.49 116.94 114.27 1wdd h PHE 345 Ca 0.03 0.00 0.02 0.00 -0.20 0.00 0.00 57.97 57.82 1wdd h PHE 345 Cb 0.21 0.00 -0.04 0.00 0.22 0.00 0.00 35.95 36.34 1wdd h PHE 345 CO -0.00 0.22 0.44 0.28 -2.00 0.00 0.00 178.31 177.25 1wdd h VAL 346 N 0.00 1.13 -0.40 0.88 2.07 -0.78 -0.65 116.25 118.50 1wdd h VAL 346 Ca -0.00 -0.30 -0.12 0.00 0.82 0.00 0.00 66.70 67.10 1wdd h VAL 346 Cb 1.04 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1wdd h VAL 346 CO 0.03 0.16 -0.22 0.44 0.02 0.00 0.00 177.57 178.00 1wdd h ASP 347 N 0.88 0.80 0.02 0.57 3.32 -0.90 -1.66 116.42 119.46 1wdd h ASP 347 Ca 0.27 -0.29 -0.00 0.00 0.02 0.00 0.00 57.03 57.02 1wdd h ASP 347 Cb -0.03 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.30 1wdd h ASP 347 CO -0.09 1.00 -0.02 -0.07 -1.72 0.00 0.00 179.24 178.35 1wdd h LEU 348 N 0.69 0.00 0.07 1.55 3.38 -0.83 -0.42 115.31 119.75 1wdd h LEU 348 Ca 0.10 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.81 1wdd h LEU 348 Cb 0.73 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.47 1wdd h LEU 348 CO 0.06 0.02 -1.25 -0.07 0.09 0.00 0.00 178.44 177.29 1wdd h LEU 349 N 0.00 0.22 0.00 1.67 3.38 -0.53 -3.41 115.31 116.64 1wdd h LEU 349 Ca -0.00 -0.26 -0.34 0.00 0.09 0.00 0.00 57.88 57.36 1wdd h LEU 349 Cb 0.03 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.64 1wdd h LEU 349 CO 0.00 1.21 -2.30 0.54 0.09 0.00 0.00 178.44 177.99 1wdd n ARG 350 N -3.41 0.81 -2.24 1.13 1.74 -0.68 -1.11 116.66 112.90 1wdd n ARG 350 Ca -0.08 0.06 -0.27 0.00 -0.77 0.00 0.00 57.85 56.79 1wdd n ARG 350 Cb 1.00 -1.47 0.04 0.00 -1.02 0.00 0.00 32.46 31.01 1wdd n ARG 350 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1wdd s ASP 351 N -5.74 5.37 -0.00 0.55 1.01 -0.19 -4.34 116.67 113.33 1wdd s ASP 351 Ca -0.20 0.75 0.10 0.00 0.71 0.00 0.00 52.55 53.91 1wdd s ASP 351 Cb 0.07 -1.62 -0.23 0.00 1.01 0.00 0.00 42.92 42.15 1wdd s ASP 351 CO 0.65 -1.26 0.81 -0.78 0.21 0.00 0.00 175.17 174.80 1wdd h ASP 352 N -0.39 0.02 -3.13 0.27 3.58 -1.91 -3.45 116.42 111.41 1wdd h ASP 352 Ca -0.45 -0.03 -0.26 0.00 0.42 0.00 0.00 57.03 56.70 1wdd h ASP 352 Cb 1.27 -0.01 -0.34 0.00 1.72 0.00 0.00 39.33 41.97 1wdd h ASP 352 CO 0.61 1.03 -0.60 0.12 -2.88 0.00 0.00 179.24 177.52 1wdd s PHE 353 N -2.62 -0.23 -0.22 0.28 5.36 -1.26 -0.34 117.98 118.95 1wdd s PHE 353 Ca -0.04 0.66 0.01 0.00 -0.96 0.00 0.00 56.93 56.60 1wdd s PHE 353 Cb 0.08 -0.17 0.05 0.00 -0.34 0.00 0.00 43.02 42.65 1wdd s PHE 353 CO 0.82 -0.26 -0.07 0.42 -1.46 0.00 0.00 175.22 174.67 1wdd s ILE 354 N 2.04 1.58 0.50 3.12 1.09 -0.01 -5.01 121.20 124.52 1wdd s ILE 354 Ca -0.00 -1.15 -0.20 0.00 -1.10 0.00 0.00 60.65 58.20 1wdd s ILE 354 Cb -0.12 -1.77 -0.08 0.00 -1.06 0.00 0.00 42.46 39.43 1wdd s ILE 354 CO -0.06 0.00 1.05 -1.61 -0.10 0.00 0.00 174.94 174.22 1wdd s GLU 355 N 1.39 3.70 0.23 2.79 2.02 -1.26 -0.92 118.70 126.65 1wdd s GLU 355 Ca -0.04 1.38 -0.30 0.00 0.02 0.00 0.00 54.97 56.03 1wdd s GLU 355 Cb -0.18 -2.08 -0.15 0.00 0.10 0.00 0.00 34.13 31.82 1wdd s GLU 355 CO -0.07 -0.52 1.05 1.17 0.02 0.00 0.00 175.26 176.92 1wdd n LYS 356 N -1.10 1.19 -3.14 1.61 4.81 -1.26 -4.80 118.16 115.48 1wdd n LYS 356 Ca 0.10 0.42 0.01 0.00 -0.87 0.00 0.00 58.31 57.97 1wdd n LYS 356 Cb 0.52 -1.83 -0.01 0.00 0.02 0.00 0.00 35.03 33.74 1wdd n LYS 356 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1wdd s ASP 357 N -0.33 -1.34 0.50 3.14 -1.08 -0.10 -4.97 116.67 112.50 1wdd s ASP 357 Ca 0.65 -0.67 0.34 0.00 -0.52 0.00 0.00 52.55 52.36 1wdd s ASP 357 Cb -0.78 1.71 1.71 0.00 -1.46 0.00 0.00 42.92 44.10 1wdd s ASP 357 CO 0.56 -0.15 2.03 0.03 0.52 0.00 0.00 175.17 178.16 1wdd h ARG 358 N 6.75 0.00 0.00 4.34 2.47 -1.92 -0.95 114.38 125.07 1wdd h ARG 358 Ca 0.03 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.75 1wdd h ARG 358 Cb 1.19 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.51 1wdd h ARG 358 CO 0.07 0.00 0.00 0.00 0.56 0.00 0.00 179.97 180.60 1wdd h ALA 359 N 2.03 1.00 0.00 0.04 0.00 -1.95 -2.17 119.26 118.21 1wdd h ALA 359 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1wdd h ALA 359 Cb 0.15 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1wdd h ALA 359 CO 0.00 0.00 -0.06 0.54 0.00 0.00 0.00 179.25 179.73 1wdd n ARG 360 N -2.33 1.28 -1.41 0.00 1.74 -0.48 -4.76 116.66 110.70 1wdd n ARG 360 Ca 0.02 -2.62 -0.14 0.00 -0.77 0.00 0.00 57.85 54.33 1wdd n ARG 360 Cb 0.24 -1.49 -0.06 0.00 -1.02 0.00 0.00 32.46 30.13 1wdd n ARG 360 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wdd n GLY 361 N -1.38 1.46 3.45 -0.13 0.00 -0.82 -4.34 105.19 103.43 1wdd n GLY 361 Ca 0.16 -0.25 -0.44 0.00 0.00 0.00 0.00 46.02 45.50 1wdd n GLY 361 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wdd s ILE 362 N -2.46 4.63 -0.08 -0.61 -1.09 -0.52 -4.90 121.20 116.18 1wdd s ILE 362 Ca 0.00 -0.40 0.13 0.00 -2.23 0.00 0.00 60.65 58.15 1wdd s ILE 362 Cb 0.00 -4.48 0.01 0.00 -1.58 0.00 0.00 42.46 36.40 1wdd s ILE 362 CO 0.00 -1.10 1.43 -0.26 -1.23 0.00 0.00 174.94 173.78 1wdd h PHE 363 N 9.24 0.00 -3.98 3.97 -1.00 -1.93 -0.22 116.94 123.02 1wdd h PHE 363 Ca -0.28 0.00 -0.37 0.00 2.81 0.00 0.00 57.97 60.13 1wdd h PHE 363 Cb 1.08 0.00 -0.23 0.00 3.61 0.00 0.00 35.95 40.41 1wdd h PHE 363 CO 0.86 0.60 -0.77 -0.06 -1.61 0.00 0.00 178.31 177.33 1wdd s PHE 364 N -2.95 0.98 0.13 -0.55 0.08 -1.26 -4.88 117.98 109.53 1wdd s PHE 364 Ca 0.03 -0.39 -0.31 0.00 0.12 0.00 0.00 56.93 56.39 1wdd s PHE 364 Cb 0.08 -0.58 -0.08 0.00 -0.57 0.00 0.00 43.02 41.88 1wdd s PHE 364 CO 0.76 0.00 1.30 0.99 -0.10 0.00 0.00 175.22 178.17 1wdd s THR 365 N -1.01 3.50 -0.18 0.64 2.01 -1.26 -4.18 115.64 115.17 1wdd s THR 365 Ca -0.02 1.13 0.01 0.00 0.31 0.00 0.00 61.69 63.11 1wdd s THR 365 Cb -0.08 -3.73 0.02 0.00 0.01 0.00 0.00 72.50 68.72 1wdd s THR 365 CO 0.01 0.12 -0.18 -1.58 -0.69 0.00 0.00 174.62 172.29 1wdd s GLN 366 N 0.64 3.04 -0.26 4.92 2.00 -0.10 -4.88 119.66 125.02 1wdd s GLN 366 Ca 0.60 -0.81 -0.03 0.00 -2.00 0.00 0.00 55.36 53.12 1wdd s GLN 366 Cb -0.34 -2.60 0.02 0.00 0.80 0.00 0.00 33.01 30.88 1wdd s GLN 366 CO 0.33 -0.19 -0.02 0.34 -0.50 0.00 0.00 175.29 175.25 1wdd s ASP 367 N 1.26 4.55 0.00 6.67 -1.08 -1.26 -0.83 116.67 125.98 1wdd s ASP 367 Ca 0.04 -0.83 0.28 0.00 -0.52 0.00 0.00 52.55 51.52 1wdd s ASP 367 Cb -0.13 -1.73 1.17 0.00 -1.46 0.00 0.00 42.92 40.77 1wdd s ASP 367 CO -0.11 -0.15 1.81 0.79 0.52 0.00 0.00 175.17 178.04 1wdd n TRP 368 N 4.72 0.01 -3.99 -5.34 7.02 0.54 -4.38 117.44 116.02 1wdd n TRP 368 Ca -0.16 -0.01 -0.30 0.00 -1.02 0.00 0.00 57.50 56.02 1wdd n TRP 368 Cb 0.47 0.00 -0.05 0.00 -2.42 0.00 0.00 31.31 29.32 1wdd n TRP 368 CO 0.00 0.00 0.00 1.33 -2.02 0.00 0.00 177.69 177.00 1wdd n VAL 369 N -0.01 -1.27 -1.01 -0.99 0.24 -1.26 -1.36 118.33 112.68 1wdd n VAL 369 Ca 0.20 -0.43 -0.00 0.00 -2.04 0.00 0.00 64.34 62.06 1wdd n VAL 369 Cb 0.31 -1.16 -0.00 0.00 -1.47 0.00 0.00 33.84 31.53 1wdd n VAL 369 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1wdd n SER 370 N -2.01 -3.90 -4.72 -1.34 7.64 -1.26 -5.00 113.62 103.03 1wdd n SER 370 Ca -0.20 0.01 -0.42 0.00 1.01 0.00 0.00 58.87 59.26 1wdd n SER 370 Cb 0.52 -1.43 -0.01 0.00 -1.01 0.00 0.00 64.21 62.29 1wdd n SER 370 CO 0.00 0.00 0.00 0.80 -3.01 0.00 0.00 175.04 172.83 1wdd n MET 371 N -1.84 2.34 -1.57 1.43 0.00 -0.46 -4.90 117.12 112.12 1wdd n MET 371 Ca -0.00 0.82 -0.34 0.00 0.00 0.00 0.00 57.70 58.18 1wdd n MET 371 Cb 0.15 -2.48 0.08 0.00 0.00 0.00 0.00 33.22 30.97 1wdd n MET 371 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 175.97 173.83 1wdd s PRO 372 N -1.64 2.35 0.59 2.12 0.02 -1.26 -4.93 135.00 132.25 1wdd s PRO 372 Ca 0.57 1.74 -0.11 0.00 0.02 0.00 0.00 61.00 63.22 1wdd s PRO 372 Cb -0.54 -1.86 -0.05 0.00 0.02 0.00 0.00 34.50 32.07 1wdd s PRO 372 CO 0.60 -1.67 0.99 0.20 -0.33 0.00 0.00 177.00 176.79 1wdd s GLY 373 N -2.00 1.71 -0.09 0.52 0.00 -1.26 -4.68 107.32 101.52 1wdd s GLY 373 Ca 0.74 -0.09 -0.01 0.00 0.00 0.00 0.00 44.72 45.36 1wdd s GLY 373 CO 0.43 0.16 -0.03 0.14 0.00 0.00 0.00 173.10 173.80 1wdd s VAL 374 N -3.03 4.03 -0.22 1.40 1.01 -0.27 -1.98 120.40 121.34 1wdd s VAL 374 Ca 0.55 -0.35 -0.27 0.00 0.00 0.00 0.00 61.98 61.91 1wdd s VAL 374 Cb -0.11 -2.68 -0.00 0.00 0.00 0.00 0.00 36.38 33.59 1wdd s VAL 374 CO 0.49 0.59 0.93 -0.63 0.00 0.00 0.00 175.10 176.48 1wdd s ILE 375 N -0.69 4.78 0.37 2.22 1.01 -0.31 -4.26 121.20 124.31 1wdd s ILE 375 Ca 0.11 1.80 -0.26 0.00 0.00 0.00 0.00 60.65 62.30 1wdd s ILE 375 Cb -0.12 -4.21 -0.09 0.00 0.01 0.00 0.00 42.46 38.06 1wdd s ILE 375 CO 0.02 -0.09 1.09 -2.16 0.00 0.00 0.00 174.94 173.79 1wdd s PRO 376 N 2.81 4.25 -0.16 2.79 0.04 -1.26 -1.44 135.00 142.03 1wdd s PRO 376 Ca 0.40 1.65 0.01 0.00 0.04 0.00 0.00 61.00 63.10 1wdd s PRO 376 Cb -0.16 -2.72 0.01 0.00 0.04 0.00 0.00 34.50 31.67 1wdd s PRO 376 CO 0.08 -0.10 -0.19 0.08 0.04 0.00 0.00 177.00 176.92 1wdd s VAL 377 N -1.49 2.26 -0.26 -0.36 1.01 0.25 -1.38 120.40 120.44 1wdd s VAL 377 Ca 0.54 -0.90 -0.11 0.00 0.00 0.00 0.00 61.98 61.52 1wdd s VAL 377 Cb -0.26 -1.94 -0.05 0.00 0.00 0.00 0.00 36.38 34.13 1wdd s VAL 377 CO 0.33 0.53 0.19 0.00 0.00 0.00 0.00 175.10 176.16 1wdd s ALA 378 N 1.00 3.57 -0.15 5.51 0.00 0.14 -1.22 121.76 130.60 1wdd s ALA 378 Ca -0.02 -0.96 -0.21 0.00 0.00 0.00 0.00 51.96 50.76 1wdd s ALA 378 Cb -0.15 -2.43 0.05 0.00 0.00 0.00 0.00 23.12 20.60 1wdd s ALA 378 CO -0.05 -0.38 0.55 0.45 0.00 0.00 0.00 175.76 176.33 1wdd s SER 379 N 1.40 -0.55 0.00 0.00 0.15 -1.26 -0.81 113.70 112.63 1wdd s SER 379 Ca 0.08 0.90 0.00 0.00 0.70 0.00 0.00 55.95 57.63 1wdd s SER 379 Cb -0.15 0.90 0.00 0.00 -1.71 0.00 0.00 66.02 65.07 1wdd s SER 379 CO 0.08 -0.32 0.00 0.61 1.20 0.00 0.00 173.24 174.81 1wdd n GLY 380 N 2.16 2.31 2.21 9.45 0.00 -1.26 -4.62 105.19 115.45 1wdd n GLY 380 Ca -0.16 -0.68 -0.09 0.00 0.00 0.00 0.00 46.02 45.09 1wdd n GLY 380 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wdd n GLY 381 N 0.00 0.57 3.85 -0.02 0.00 -1.26 -1.39 105.19 106.93 1wdd n GLY 381 Ca 0.00 -0.58 -0.26 0.00 0.00 0.00 0.00 46.02 45.18 1wdd n GLY 381 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1wdd s ILE 382 N -2.38 4.73 0.31 -0.61 -4.36 -1.26 -4.13 121.20 113.50 1wdd s ILE 382 Ca 0.00 -1.01 0.00 0.00 -0.26 0.00 0.00 60.65 59.38 1wdd s ILE 382 Cb 0.00 -3.44 0.00 0.00 1.25 0.00 0.00 42.46 40.27 1wdd s ILE 382 CO 0.00 -0.14 0.40 0.00 0.24 0.00 0.00 174.94 175.44 1wdd n HIS 383 N -0.53 -1.21 -0.30 1.37 1.44 -1.26 -4.26 115.22 110.47 1wdd n HIS 383 Ca -0.08 -2.15 0.14 0.00 -2.01 0.00 0.00 57.72 53.62 1wdd n HIS 383 Cb 0.55 0.44 0.38 0.00 0.12 0.00 0.00 29.99 31.48 1wdd n HIS 383 CO 0.00 0.00 0.00 -0.39 -2.81 0.00 0.00 176.34 173.14 1wdd h VAL 384 N 1.90 0.75 0.00 0.61 -1.51 -1.91 0.13 116.25 116.22 1wdd h VAL 384 Ca -0.23 -0.23 -0.01 0.00 -1.23 0.00 0.00 66.70 65.00 1wdd h VAL 384 Cb 1.05 0.02 -0.00 0.00 -2.13 0.00 0.00 31.29 30.23 1wdd h VAL 384 CO 0.32 0.12 -0.03 -0.50 -1.23 0.00 0.00 177.57 176.26 1wdd h TRP 385 N 0.67 0.00 0.00 5.19 4.06 -1.94 -1.47 115.95 122.46 1wdd h TRP 385 Ca 0.51 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.46 1wdd h TRP 385 Cb 0.90 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.06 1wdd h TRP 385 CO -0.00 0.03 -0.03 0.72 -3.56 0.00 0.00 178.44 175.59 1wdd n HIS 386 N -3.18 0.14 -0.27 0.49 8.25 0.03 -4.37 115.22 116.32 1wdd n HIS 386 Ca -0.01 0.04 0.04 0.00 -0.26 0.00 0.00 57.72 57.53 1wdd n HIS 386 Cb 0.23 -0.55 0.17 0.00 1.12 0.00 0.00 29.99 30.96 1wdd n HIS 386 CO 0.00 0.00 0.00 1.98 0.64 0.00 0.00 176.34 178.96 1wdd h MET 387 N 0.00 0.60 -0.39 -0.41 -1.53 -1.31 -0.68 114.93 111.21 1wdd h MET 387 Ca 0.00 -0.04 -0.02 0.00 -3.44 0.00 0.00 59.70 56.21 1wdd h MET 387 Cb 0.54 -0.13 -0.02 0.00 -0.55 0.00 0.00 31.60 31.44 1wdd h MET 387 CO 0.00 0.40 0.17 -1.35 0.14 0.00 0.00 176.91 176.26 1wdd h PRO 388 N 0.62 0.57 -0.64 0.39 0.11 -1.81 -0.81 132.00 130.43 1wdd h PRO 388 Ca 0.40 -0.10 -0.04 0.00 0.11 0.00 0.00 66.00 66.38 1wdd h PRO 388 Cb 0.48 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 31.47 1wdd h PRO 388 CO -0.31 0.53 0.26 0.00 -0.21 0.00 0.00 178.00 178.27 1wdd h ALA 389 N 1.01 0.83 -0.59 -0.75 0.00 -1.67 -0.51 119.26 117.59 1wdd h ALA 389 Ca 0.13 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 1wdd h ALA 389 Cb 0.16 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1wdd h ALA 389 CO -0.01 0.44 0.05 -0.07 0.00 0.00 0.00 179.25 179.66 1wdd h LEU 390 N 0.90 0.98 -0.92 0.00 3.38 -0.95 0.48 115.31 119.18 1wdd h LEU 390 Ca 0.21 -0.28 -0.08 0.00 0.09 0.00 0.00 57.88 57.82 1wdd h LEU 390 Cb 0.20 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1wdd h LEU 390 CO -0.02 1.02 -0.11 0.74 0.09 0.00 0.00 178.44 180.16 1wdd h THR 391 N 0.91 1.25 -0.27 0.22 2.02 -0.88 -0.57 112.91 115.59 1wdd h THR 391 Ca 0.17 -1.11 -0.19 0.00 0.77 0.00 0.00 66.41 66.06 1wdd h THR 391 Cb 0.49 1.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.97 1wdd h THR 391 CO 0.02 0.37 -0.57 -0.08 0.37 0.00 0.00 175.52 175.64 1wdd h GLU 392 N 0.61 0.84 -0.02 6.66 4.22 -0.71 0.13 114.58 126.30 1wdd h GLU 392 Ca 0.11 -0.54 -0.01 0.00 0.08 0.00 0.00 59.36 58.99 1wdd h GLU 392 Cb 0.55 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.87 1wdd h GLU 392 CO 0.03 1.18 -0.04 0.82 -2.18 0.00 0.00 179.01 178.82 1wdd h ILE 393 N 0.64 1.42 0.00 2.32 2.04 -0.70 -3.37 117.51 119.85 1wdd h ILE 393 Ca 0.01 -1.29 -0.12 0.00 1.00 0.00 0.00 64.86 64.46 1wdd h ILE 393 Cb 1.17 2.23 -0.02 0.00 -0.74 0.00 0.00 36.82 39.46 1wdd h ILE 393 CO 0.12 0.34 -1.77 0.49 0.00 0.00 0.00 178.15 177.33 1wdd n PHE 394 N -4.77 0.40 -3.17 1.37 3.72 -0.24 -5.03 117.46 109.74 1wdd n PHE 394 Ca -0.08 0.13 0.01 0.00 -0.05 0.00 0.00 57.45 57.46 1wdd n PHE 394 Cb 0.30 -0.82 -0.00 0.00 -0.94 0.00 0.00 39.48 38.01 1wdd n PHE 394 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1wdd n GLY 395 N 1.38 -1.93 0.19 1.37 0.00 0.03 -4.29 105.19 101.94 1wdd n GLY 395 Ca -0.11 -1.36 0.01 0.00 0.00 0.00 0.00 46.02 44.56 1wdd n GLY 395 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1wdd h ASP 396 N -0.09 0.06 -1.56 1.61 3.32 -1.89 -3.37 116.42 114.51 1wdd h ASP 396 Ca 0.00 -0.02 -0.72 0.00 0.02 0.00 0.00 57.03 56.31 1wdd h ASP 396 Cb 0.09 -0.02 -0.13 0.00 0.22 0.00 0.00 39.33 39.48 1wdd h ASP 396 CO 0.00 0.45 1.77 0.47 -1.72 0.00 0.00 179.24 180.22 1wdd n ASP 397 N -4.06 5.07 -3.54 6.45 8.00 -1.26 -3.12 116.55 124.09 1wdd n ASP 397 Ca -0.02 -2.96 -0.09 0.00 0.71 0.00 0.00 54.79 52.43 1wdd n ASP 397 Cb 0.43 -1.64 -0.02 0.00 -0.02 0.00 0.00 41.12 39.87 1wdd n ASP 397 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1wdd s SER 398 N 3.29 -0.43 -0.11 -2.24 1.04 -1.26 -4.20 113.70 109.79 1wdd s SER 398 Ca 0.47 -0.13 0.03 0.00 0.48 0.00 0.00 55.95 56.80 1wdd s SER 398 Cb 0.01 0.55 -0.00 0.00 0.10 0.00 0.00 66.02 66.68 1wdd s SER 398 CO 0.03 -0.93 -0.21 -0.69 0.98 0.00 0.00 173.24 172.42 1wdd s VAL 399 N -3.56 2.31 -0.22 5.02 1.01 -0.48 -0.96 120.40 123.52 1wdd s VAL 399 Ca 0.05 -0.93 -0.05 0.00 0.00 0.00 0.00 61.98 61.05 1wdd s VAL 399 Cb -0.02 -1.91 -0.02 0.00 0.00 0.00 0.00 36.38 34.43 1wdd s VAL 399 CO -0.07 0.55 0.00 -0.76 0.00 0.00 0.00 175.10 174.82 1wdd s LEU 400 N 0.38 3.20 -0.11 3.92 1.43 0.09 -0.69 118.68 126.90 1wdd s LEU 400 Ca -0.16 -0.26 0.01 0.00 -1.03 0.00 0.00 54.13 52.69 1wdd s LEU 400 Cb -0.17 -1.82 -0.02 0.00 0.03 0.00 0.00 46.19 44.21 1wdd s LEU 400 CO 0.07 0.02 -0.13 -1.10 0.23 0.00 0.00 176.35 175.44 1wdd s GLN 401 N 1.29 3.21 -0.33 1.70 -0.21 0.01 -0.85 119.66 124.47 1wdd s GLN 401 Ca 0.04 -0.68 0.01 0.00 0.02 0.00 0.00 55.36 54.75 1wdd s GLN 401 Cb -0.15 -2.58 0.10 0.00 1.00 0.00 0.00 33.01 31.38 1wdd s GLN 401 CO 0.01 0.30 0.09 -0.06 -2.12 0.00 0.00 175.29 173.51 1wdd s PHE 402 N 0.12 2.56 0.00 0.91 0.40 -0.19 -4.20 117.98 117.58 1wdd s PHE 402 Ca -0.06 -2.30 0.00 0.00 -0.60 0.00 0.00 56.93 53.97 1wdd s PHE 402 Cb -0.15 -2.23 0.00 0.00 0.51 0.00 0.00 43.02 41.16 1wdd s PHE 402 CO 0.05 -0.90 0.00 0.41 0.70 0.00 0.00 175.22 175.48 1wdd n GLY 403 N 4.52 0.76 0.37 4.36 0.00 -1.26 -3.34 105.19 110.59 1wdd n GLY 403 Ca 0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.17 1wdd n GLY 403 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1wdd h GLY 404 N 0.00 0.76 1.50 -0.02 0.00 -1.92 0.52 103.07 103.91 1wdd h GLY 404 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.13 1wdd h GLY 404 CO 0.00 0.08 0.00 0.61 0.00 0.00 0.00 176.54 177.23 1wdd n GLY 405 N -1.51 -0.70 0.84 4.60 0.00 -1.26 -0.65 105.19 106.51 1wdd n GLY 405 Ca 0.14 -0.07 -0.04 0.00 0.00 0.00 0.00 46.02 46.05 1wdd n GLY 405 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1wdd n THR 406 N -1.25 0.85 0.86 2.61 -1.04 -0.15 -4.67 114.28 111.50 1wdd n THR 406 Ca 0.07 0.16 0.10 0.00 -2.04 0.00 0.00 64.05 62.34 1wdd n THR 406 Cb 0.10 -1.67 0.49 0.00 -1.82 0.00 0.00 70.33 67.43 1wdd n THR 406 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1wdd n LEU 407 N -3.50 0.00 -0.88 -4.42 4.32 -0.01 -2.00 117.00 110.52 1wdd n LEU 407 Ca -0.07 0.40 0.12 0.00 -0.02 0.00 0.00 56.01 56.44 1wdd n LEU 407 Cb 0.32 -0.40 0.24 0.00 -1.62 0.00 0.00 43.42 41.97 1wdd n LEU 407 CO 0.03 -0.11 0.71 0.61 -1.22 0.00 0.00 177.39 177.40 1wdd n GLY 408 N 0.60 0.93 3.77 -0.72 0.00 0.17 -4.87 105.19 105.07 1wdd n GLY 408 Ca 0.08 -0.63 -0.41 0.00 0.00 0.00 0.00 46.02 45.06 1wdd n GLY 408 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1wdd s HIS 409 N -1.84 2.85 0.36 1.61 5.04 -0.85 -4.88 115.29 117.59 1wdd s HIS 409 Ca 0.33 1.33 0.38 0.00 -1.54 0.00 0.00 55.06 55.56 1wdd s HIS 409 Cb 0.21 -3.79 1.97 0.00 0.04 0.00 0.00 32.58 31.01 1wdd s HIS 409 CO 0.31 -2.27 2.14 -1.00 -2.34 0.00 0.00 174.74 171.58 1wdd h PRO 410 N 3.12 0.00 -0.27 2.88 0.13 -1.91 -1.82 132.00 134.14 1wdd h PRO 410 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1wdd h PRO 410 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1wdd h PRO 410 CO 0.64 0.00 0.00 0.91 -0.23 0.00 0.00 178.00 179.32 1wdd n TRP 411 N -2.86 0.34 0.00 1.56 8.01 -1.26 -5.09 117.44 118.13 1wdd n TRP 411 Ca -0.02 -0.23 0.00 0.00 -1.31 0.00 0.00 57.50 55.94 1wdd n TRP 411 Cb 0.10 -0.01 0.00 0.00 -2.01 0.00 0.00 31.31 29.39 1wdd n TRP 411 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1wdd n GLY 412 N 1.06 -2.21 0.16 6.99 0.00 -0.69 -4.65 105.19 105.86 1wdd n GLY 412 Ca 0.14 -2.15 -0.13 0.00 0.00 0.00 0.00 46.02 43.89 1wdd n GLY 412 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1wdd h ASN 413 N 0.00 0.50 -0.27 1.61 4.21 -1.87 -0.53 115.58 119.23 1wdd h ASN 413 Ca 0.00 -0.47 -0.05 0.00 1.21 0.00 0.00 56.30 56.98 1wdd h ASN 413 Cb 0.00 -0.14 -0.01 0.00 -1.12 0.00 0.00 38.32 37.05 1wdd h ASN 413 CO 0.00 0.87 -0.04 0.00 -1.29 0.00 0.00 177.43 176.96 1wdd h ALA 414 N 0.65 0.37 -0.54 -0.83 0.00 -1.85 0.76 119.26 117.82 1wdd h ALA 414 Ca 0.03 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 1wdd h ALA 414 Cb 0.72 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1wdd h ALA 414 CO 0.05 0.15 0.14 -1.35 0.00 0.00 0.00 179.25 178.24 1wdd h PRO 415 N 0.27 0.82 -0.62 0.00 0.11 -1.82 -0.94 132.00 129.82 1wdd h PRO 415 Ca 0.07 -0.16 -0.06 0.00 0.11 0.00 0.00 66.00 65.96 1wdd h PRO 415 Cb 0.50 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 31.45 1wdd h PRO 415 CO 0.02 0.73 0.15 0.78 -0.21 0.00 0.00 178.00 179.48 1wdd h GLY 416 N 0.96 1.05 0.98 -0.55 0.00 -0.68 -0.16 103.07 104.67 1wdd h GLY 416 Ca 0.18 -0.63 -0.08 0.00 0.00 0.00 0.00 47.33 46.80 1wdd h GLY 416 CO -0.00 0.59 -0.05 0.00 0.00 0.00 0.00 176.54 177.07 1wdd h ALA 417 N 1.23 0.58 -0.75 3.60 0.00 -0.52 -2.41 119.26 121.00 1wdd h ALA 417 Ca 0.20 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1wdd h ALA 417 Cb 0.33 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1wdd h ALA 417 CO -0.00 0.42 0.32 0.00 0.00 0.00 0.00 179.25 179.98 1wdd h ALA 418 N 0.88 0.97 -0.50 0.00 0.00 -0.73 -0.22 119.26 119.67 1wdd h ALA 418 Ca 0.11 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.87 1wdd h ALA 418 Cb 0.56 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1wdd h ALA 418 CO 0.03 0.58 0.28 0.00 0.00 0.00 0.00 179.25 180.14 1wdd h ALA 419 N 1.16 0.63 -0.40 0.00 0.00 -0.85 0.98 119.26 120.78 1wdd h ALA 419 Ca 0.25 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 55.04 1wdd h ALA 419 Cb 0.19 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1wdd h ALA 419 CO -0.02 -0.03 -0.25 -0.91 0.00 0.00 0.00 179.25 178.03 1wdd h ASN 420 N 0.56 0.85 -0.42 0.00 2.35 -0.92 -0.54 115.58 117.46 1wdd h ASN 420 Ca 0.20 -0.32 -0.06 0.00 -0.55 0.00 0.00 56.30 55.57 1wdd h ASN 420 Cb 0.05 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.17 1wdd h ASN 420 CO -0.11 1.06 0.02 -0.09 -1.65 0.00 0.00 177.43 176.66 1wdd h ARG 421 N 0.71 0.72 -0.26 0.81 9.65 -0.68 -0.93 114.38 124.41 1wdd h ARG 421 Ca 0.09 -0.22 -0.02 0.00 -1.10 0.00 0.00 59.98 58.73 1wdd h ARG 421 Cb 0.78 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 29.28 1wdd h ARG 421 CO 0.06 0.79 0.07 0.28 2.80 0.00 0.00 179.97 183.97 1wdd h VAL 422 N 0.56 1.21 -0.44 0.20 2.07 -0.76 -0.22 116.25 118.87 1wdd h VAL 422 Ca 0.12 -0.67 0.06 0.00 0.82 0.00 0.00 66.70 67.03 1wdd h VAL 422 Cb 0.45 1.16 -0.05 0.00 -1.52 0.00 0.00 31.29 31.33 1wdd h VAL 422 CO 0.02 0.22 0.15 0.00 0.02 0.00 0.00 177.57 177.98 1wdd h ALA 423 N 0.90 0.52 -0.16 1.67 0.00 -0.92 0.37 119.26 121.64 1wdd h ALA 423 Ca 0.08 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1wdd h ALA 423 Cb 0.27 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1wdd h ALA 423 CO -0.00 -0.23 0.07 1.25 0.00 0.00 0.00 179.25 180.33 1wdd h LEU 424 N 0.32 0.22 -1.24 0.00 5.85 -0.98 -1.79 115.31 117.69 1wdd h LEU 424 Ca 0.20 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.74 1wdd h LEU 424 Cb 0.20 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 1wdd h LEU 424 CO -0.21 0.31 0.16 -0.33 -0.34 0.00 0.00 178.44 178.04 1wdd h GLU 425 N 0.12 0.69 -0.62 1.25 5.08 -0.73 -0.43 114.58 119.93 1wdd h GLU 425 Ca 0.05 -0.11 -0.08 0.00 -1.00 0.00 0.00 59.36 58.23 1wdd h GLU 425 Cb 0.16 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 1wdd h GLU 425 CO -0.01 0.59 0.06 0.00 -1.00 0.00 0.00 179.01 178.65 1wdd h ALA 426 N 1.50 0.94 -0.47 3.43 0.00 -0.75 0.26 119.26 124.17 1wdd h ALA 426 Ca 0.16 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 1wdd h ALA 426 Cb 0.18 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1wdd h ALA 426 CO -0.01 0.65 0.08 0.00 0.00 0.00 0.00 179.25 179.97 1wdd h VAL 428 N 0.65 1.22 -0.25 0.00 2.07 -0.88 -0.97 116.25 118.09 1wdd h VAL 428 Ca 0.14 -0.72 0.00 0.00 0.82 0.00 0.00 66.70 66.95 1wdd h VAL 428 Cb 0.39 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 1wdd h VAL 428 CO 0.01 0.24 0.16 -0.61 0.02 0.00 0.00 177.57 177.39 1wdd h GLN 429 N 0.34 0.32 -0.23 1.57 4.15 -0.83 -0.76 115.11 119.66 1wdd h GLN 429 Ca 0.10 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.50 1wdd h GLN 429 Cb 0.29 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.89 1wdd h GLN 429 CO 0.00 0.21 0.15 0.00 -1.93 0.00 0.00 178.83 177.26 1wdd h ALA 430 N 1.10 0.29 -0.37 3.38 0.00 -1.13 -1.35 119.26 121.17 1wdd h ALA 430 Ca 0.09 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.04 1wdd h ALA 430 Cb -0.03 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 1wdd h ALA 430 CO -0.03 -0.24 0.11 -0.09 0.00 0.00 0.00 179.25 179.00 1wdd h ARG 431 N 0.30 0.24 -0.10 0.00 2.43 -1.06 0.19 114.38 116.39 1wdd h ARG 431 Ca 0.08 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.19 1wdd h ARG 431 Cb -0.03 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.45 1wdd h ARG 431 CO -0.02 0.16 -0.18 -0.91 -1.51 0.00 0.00 179.97 177.51 1wdd h ASN 432 N 0.25 0.15 0.27 -3.80 4.21 -0.69 -0.45 115.58 115.52 1wdd h ASN 432 Ca 0.17 -0.03 0.00 0.00 1.21 0.00 0.00 56.30 57.65 1wdd h ASN 432 Cb 0.17 -0.04 0.00 0.00 -1.12 0.00 0.00 38.32 37.33 1wdd h ASN 432 CO -0.20 0.34 0.00 -0.62 -1.29 0.00 0.00 177.43 175.66 1wdd n GLU 433 N -4.26 0.70 0.00 0.81 1.02 -0.55 -4.90 120.64 113.46 1wdd n GLU 433 Ca -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 1wdd n GLU 433 Cb 0.28 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.20 1wdd n GLU 433 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1wdd n GLY 434 N 1.06 1.01 3.82 0.62 0.00 -0.18 -5.08 105.19 106.44 1wdd n GLY 434 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 1wdd n GLY 434 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wdd s ARG 435 N -0.81 3.70 -0.53 1.61 1.81 0.02 -4.99 118.95 119.75 1wdd s ARG 435 Ca 0.00 1.09 -0.20 0.00 -1.72 0.00 0.00 55.73 54.90 1wdd s ARG 435 Cb 0.00 -2.09 0.06 0.00 -0.45 0.00 0.00 34.95 32.47 1wdd s ARG 435 CO 0.00 -0.49 0.72 0.34 -0.68 0.00 0.00 175.30 175.20 1wdd s ASP 436 N -2.84 6.24 0.39 0.23 -1.08 -1.26 -4.43 116.67 113.92 1wdd s ASP 436 Ca 0.61 -0.83 0.09 0.00 -0.52 0.00 0.00 52.55 51.90 1wdd s ASP 436 Cb -0.13 -2.33 0.79 0.00 -1.46 0.00 0.00 42.92 39.79 1wdd s ASP 436 CO 0.32 -1.02 1.93 -0.07 0.52 0.00 0.00 175.17 176.85 1wdd h LEU 437 N 10.10 0.26 -1.77 -1.34 3.38 -1.93 0.10 115.31 124.11 1wdd h LEU 437 Ca -0.27 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1wdd h LEU 437 Cb 1.09 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1wdd h LEU 437 CO 1.02 0.38 0.00 0.00 0.09 0.00 0.00 178.44 179.93 1wdd h ALA 438 N 1.65 1.00 0.00 1.53 0.00 -1.91 -2.78 119.26 118.75 1wdd h ALA 438 Ca 0.06 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1wdd h ALA 438 Cb 0.32 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1wdd h ALA 438 CO 0.02 0.00 -1.05 0.54 0.00 0.00 0.00 179.25 178.75 1wdd n ARG 439 N -3.03 0.50 -0.10 0.00 1.74 -0.65 -4.73 116.66 110.38 1wdd n ARG 439 Ca -0.00 -0.01 0.03 0.00 -0.77 0.00 0.00 57.85 57.10 1wdd n ARG 439 Cb 0.24 -1.03 0.09 0.00 -1.02 0.00 0.00 32.46 30.75 1wdd n ARG 439 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1wdd n GLU 440 N -1.60 2.78 -0.19 5.56 1.02 0.26 -4.80 120.64 123.67 1wdd n GLU 440 Ca -0.00 -1.78 -0.00 0.00 -0.02 0.00 0.00 57.16 55.35 1wdd n GLU 440 Cb 0.09 -1.16 0.10 0.00 -0.02 0.00 0.00 31.44 30.45 1wdd n GLU 440 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1wdd h GLY 441 N 1.20 0.74 1.17 0.62 0.00 -1.66 -1.09 103.07 104.06 1wdd h GLY 441 Ca 0.00 -0.05 -0.03 0.00 0.00 0.00 0.00 47.33 47.25 1wdd h GLY 441 CO 0.00 -0.07 0.34 3.43 0.00 0.00 0.00 176.54 180.24 1wdd h ASN 442 N 0.30 0.97 -0.09 0.19 2.35 -1.88 -1.55 115.58 115.87 1wdd h ASN 442 Ca 0.29 -0.12 -0.12 0.00 -0.55 0.00 0.00 56.30 55.81 1wdd h ASN 442 Cb 0.40 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 1wdd h ASN 442 CO -0.35 0.83 -0.32 -0.33 -1.65 0.00 0.00 177.43 175.61 1wdd h GLU 443 N 1.06 0.58 -0.29 0.81 5.08 -1.72 -0.68 114.58 119.42 1wdd h GLU 443 Ca 0.26 -0.25 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 1wdd h GLU 443 Cb 0.13 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1wdd h GLU 443 CO -0.03 0.82 0.03 0.82 -1.00 0.00 0.00 179.01 179.65 1wdd h ILE 444 N 0.49 1.24 -0.36 3.13 2.04 -0.82 -0.69 117.51 122.54 1wdd h ILE 444 Ca 0.06 -0.86 -0.01 0.00 1.00 0.00 0.00 64.86 65.04 1wdd h ILE 444 Cb 0.79 1.24 -0.02 0.00 -0.74 0.00 0.00 36.82 38.10 1wdd h ILE 444 CO 0.06 0.28 0.17 0.40 0.00 0.00 0.00 178.15 179.06 1wdd h ILE 445 N 0.30 1.17 -0.99 -0.67 1.08 -1.19 -2.27 117.51 114.94 1wdd h ILE 445 Ca 0.09 -0.49 0.02 0.00 -0.39 0.00 0.00 64.86 64.08 1wdd h ILE 445 Cb 0.38 0.82 -0.05 0.00 -3.07 0.00 0.00 36.82 34.90 1wdd h ILE 445 CO 0.01 0.18 0.65 0.03 -0.69 0.00 0.00 178.15 178.33 1wdd h ARG 446 N 0.45 1.29 -0.33 2.37 3.08 -1.04 -1.77 114.38 118.42 1wdd h ARG 446 Ca 0.12 -0.08 -0.06 0.00 0.07 0.00 0.00 59.98 60.04 1wdd h ARG 446 Cb 0.13 -0.29 -0.02 0.00 0.08 0.00 0.00 29.97 29.87 1wdd h ARG 446 CO -0.01 0.85 -0.05 0.66 -1.07 0.00 0.00 179.97 180.35 1wdd h SER 447 N 1.32 0.50 1.28 7.04 4.64 -0.83 -1.86 113.55 125.65 1wdd h SER 447 Ca 0.37 -0.11 -0.03 0.00 -0.47 0.00 0.00 61.79 61.55 1wdd h SER 447 Cb -0.13 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 61.83 1wdd h SER 447 CO -0.09 0.61 -0.12 0.00 -0.87 0.00 0.00 176.83 176.36 1wdd h ALA 448 N 1.45 0.97 -0.06 5.18 0.00 -0.76 -2.93 119.26 123.12 1wdd h ALA 448 Ca 0.10 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1wdd h ALA 448 Cb 0.40 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1wdd h ALA 448 CO 0.02 0.15 0.06 0.00 0.00 0.00 0.00 179.25 179.48 1wdd h LYS 450 N 0.00 0.68 0.00 0.00 6.56 -1.60 -2.96 116.57 119.25 1wdd h LYS 450 Ca 0.03 -0.14 -0.19 0.00 -1.06 0.00 0.00 60.65 59.28 1wdd h LYS 450 Cb 0.15 -0.10 -0.03 0.00 -0.57 0.00 0.00 32.23 31.68 1wdd h LYS 450 CO -0.00 0.65 -1.18 2.35 -2.06 0.00 0.00 179.45 179.21 1wdd h TRP 451 N 0.66 0.00 -3.39 -1.35 -0.00 -1.58 -3.45 115.95 106.84 1wdd h TRP 451 Ca 0.14 0.00 -0.62 0.00 -0.00 0.00 0.00 58.89 58.42 1wdd h TRP 451 Cb 0.31 0.00 -0.40 0.00 -0.00 0.00 0.00 29.16 29.07 1wdd h TRP 451 CO 0.01 0.76 -0.74 0.45 -0.00 0.00 0.00 178.44 178.93 1wdd s SER 452 N -6.23 4.35 0.45 2.65 0.15 -0.80 -4.97 113.70 109.31 1wdd s SER 452 Ca -0.01 -1.89 0.13 0.00 0.70 0.00 0.00 55.95 54.88 1wdd s SER 452 Cb 0.09 -1.21 1.05 0.00 -1.71 0.00 0.00 66.02 64.23 1wdd s SER 452 CO 0.80 -0.40 2.04 -0.65 1.20 0.00 0.00 173.24 176.23 1wdd h PRO 453 N 7.85 0.34 -0.26 5.44 0.11 -1.88 -0.74 132.00 142.87 1wdd h PRO 453 Ca -0.09 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.97 1wdd h PRO 453 Cb 1.01 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.04 1wdd h PRO 453 CO 0.49 0.22 0.05 0.93 -0.21 0.00 0.00 178.00 179.49 1wdd h GLU 454 N 0.35 0.42 -0.61 1.05 3.07 -1.92 -1.31 114.58 115.63 1wdd h GLU 454 Ca 0.19 -0.11 -0.06 0.00 -0.50 0.00 0.00 59.36 58.88 1wdd h GLU 454 Cb 0.29 -0.05 -0.03 0.00 -0.84 0.00 0.00 28.75 28.12 1wdd h GLU 454 CO -0.04 0.53 0.16 1.25 -1.40 0.00 0.00 179.01 179.50 1wdd h LEU 455 N 0.24 0.93 -0.95 1.33 5.85 -1.67 -2.41 115.31 118.62 1wdd h LEU 455 Ca 0.08 -0.23 0.08 0.00 0.84 0.00 0.00 57.88 58.65 1wdd h LEU 455 Cb 0.31 -0.24 -0.07 0.00 0.37 0.00 0.00 40.66 41.02 1wdd h LEU 455 CO 0.00 0.91 0.60 0.00 -0.34 0.00 0.00 178.44 179.62 1wdd h ALA 456 N 1.05 1.35 -0.52 1.25 0.00 -0.89 0.43 119.26 121.93 1wdd h ALA 456 Ca 0.19 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.99 1wdd h ALA 456 Cb 0.34 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1wdd h ALA 456 CO 0.00 0.33 -0.11 0.00 0.00 0.00 0.00 179.25 179.46 1wdd h ALA 457 N 1.46 0.71 -0.47 0.00 0.00 -1.02 -1.79 119.26 118.14 1wdd h ALA 457 Ca 0.43 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 1wdd h ALA 457 Cb 0.26 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1wdd h ALA 457 CO -0.20 0.62 0.04 0.00 0.00 0.00 0.00 179.25 179.71 1wdd h ALA 458 N 0.91 0.63 -0.82 0.00 0.00 -1.00 -2.31 119.26 116.66 1wdd h ALA 458 Ca 0.13 -0.25 0.02 0.00 0.00 0.00 0.00 54.91 54.81 1wdd h ALA 458 Cb 0.68 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 1wdd h ALA 458 CO 0.05 0.40 0.54 0.00 0.00 0.00 0.00 179.25 180.24 1wdd h GLU 460 N 1.07 0.73 -0.27 0.00 4.57 -1.01 -1.75 114.58 117.93 1wdd h GLU 460 Ca 0.31 -0.26 -0.11 0.00 -1.18 0.00 0.00 59.36 58.13 1wdd h GLU 460 Cb -0.06 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.46 1wdd h GLU 460 CO -0.08 0.85 -0.29 0.82 -1.18 0.00 0.00 179.01 179.13 1wdd h ILE 461 N 0.55 1.28 -0.30 2.32 1.08 -1.12 -3.30 117.51 118.01 1wdd h ILE 461 Ca 0.11 -1.37 0.00 0.00 -0.39 0.00 0.00 64.86 63.21 1wdd h ILE 461 Cb 0.55 1.38 0.00 0.00 -3.07 0.00 0.00 36.82 35.68 1wdd h ILE 461 CO 0.03 0.44 0.00 0.79 -0.69 0.00 0.00 178.15 178.72 1wdd n TRP 462 N -4.09 0.52 0.14 1.37 8.01 -0.79 -4.66 117.44 117.94 1wdd n TRP 462 Ca -0.01 -0.58 0.12 0.00 -1.31 0.00 0.00 57.50 55.73 1wdd n TRP 462 Cb 0.44 -0.08 0.64 0.00 -2.01 0.00 0.00 31.31 30.30 1wdd n TRP 462 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 177.69 178.25 1wdd h LYS 463 N 1.82 0.04 -0.61 -0.99 2.10 -1.40 -1.66 116.57 115.87 1wdd h LYS 463 Ca 0.00 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1wdd h LYS 463 Cb 0.85 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.17 1wdd h LYS 463 CO 0.04 0.03 0.00 0.00 -2.00 0.00 0.00 179.45 177.52 1wdd n ALA 464 N -2.57 2.45 -2.53 0.07 0.00 -1.26 -4.90 120.51 111.76 1wdd n ALA 464 Ca 0.02 -1.08 -0.40 0.00 0.00 0.00 0.00 53.44 51.98 1wdd n ALA 464 Cb 0.28 -0.96 -0.10 0.00 0.00 0.00 0.00 19.45 18.67 1wdd n ALA 464 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1wdd s ILE 465 N -1.23 5.27 0.02 0.00 -1.09 -0.63 -5.04 121.20 118.51 1wdd s ILE 465 Ca 0.41 -0.18 0.01 0.00 -2.23 0.00 0.00 60.65 58.65 1wdd s ILE 465 Cb 0.22 -3.73 -0.02 0.00 -1.58 0.00 0.00 42.46 37.35 1wdd s ILE 465 CO 0.27 -0.02 -0.04 -0.75 -1.23 0.00 0.00 174.94 173.17 1wdd s LYS 466 N 1.76 0.35 -0.39 2.79 2.47 -1.26 -5.06 119.74 120.40 1wdd s LYS 466 Ca 0.07 -0.63 0.01 0.00 -1.56 0.00 0.00 55.97 53.86 1wdd s LYS 466 Cb -0.17 0.01 0.11 0.00 -1.46 0.00 0.00 37.83 36.32 1wdd s LYS 466 CO 0.11 -0.02 0.14 -0.06 0.16 0.00 0.00 175.35 175.68 1wdd s PHE 467 N -1.39 3.65 -0.32 4.03 0.08 -1.26 -5.04 117.98 117.73 1wdd s PHE 467 Ca -0.14 -2.76 0.02 0.00 0.12 0.00 0.00 56.93 54.18 1wdd s PHE 467 Cb -0.10 -3.06 0.09 0.00 -0.57 0.00 0.00 43.02 39.38 1wdd s PHE 467 CO -0.01 -0.94 0.04 -1.21 -0.10 0.00 0.00 175.22 173.00 1wdd s GLU 468 N 0.90 1.37 0.03 0.44 2.02 -1.26 -4.79 118.70 117.39 1wdd s GLU 468 Ca 0.10 -1.57 0.01 0.00 0.02 0.00 0.00 54.97 53.53 1wdd s GLU 468 Cb -0.21 -2.84 -0.02 0.00 0.10 0.00 0.00 34.13 31.16 1wdd s GLU 468 CO -0.06 -0.89 -0.04 -0.06 0.02 0.00 0.00 175.26 174.23 1wdd s PHE 469 N 1.13 0.37 0.10 1.61 0.08 -1.26 -5.13 117.98 114.88 1wdd s PHE 469 Ca 0.08 -0.51 -0.31 0.00 0.12 0.00 0.00 56.93 56.31 1wdd s PHE 469 Cb -0.19 -0.24 -0.07 0.00 -0.57 0.00 0.00 43.02 41.95 1wdd s PHE 469 CO -0.12 -0.16 1.31 -1.21 -0.10 0.00 0.00 175.22 174.95 1wdd s GLU 470 N -1.45 4.37 0.52 0.44 2.02 -1.26 -4.98 118.70 118.36 1wdd s GLU 470 Ca -0.14 1.96 -0.20 0.00 0.02 0.00 0.00 54.97 56.60 1wdd s GLU 470 Cb -0.10 -3.28 -0.06 0.00 0.10 0.00 0.00 34.13 30.79 1wdd s GLU 470 CO -0.01 -0.35 1.13 -1.25 0.02 0.00 0.00 175.26 174.81 1wdd s PRO 471 N 0.95 3.48 0.16 0.39 0.04 -1.26 -4.94 135.00 133.83 1wdd s PRO 471 Ca 0.61 1.64 0.03 0.00 0.04 0.00 0.00 61.00 63.33 1wdd s PRO 471 Cb -0.34 -2.11 -0.01 0.00 0.04 0.00 0.00 34.50 32.08 1wdd s PRO 471 CO 0.31 -0.76 1.38 0.28 0.04 0.00 0.00 177.00 178.25 1wdd h VAL 472 N 1.38 1.51 -3.51 -0.36 2.07 -1.94 -3.43 116.25 111.98 1wdd h VAL 472 Ca -0.50 -2.67 -0.65 0.00 0.82 0.00 0.00 66.70 63.69 1wdd h VAL 472 Cb 1.26 2.49 -0.25 0.00 -1.52 0.00 0.00 31.29 33.27 1wdd h VAL 472 CO 0.58 0.78 -0.67 -0.62 0.02 0.00 0.00 177.57 177.65 1wdd s ASP 473 N -6.91 4.73 0.14 0.57 2.15 -1.26 -4.57 116.67 111.52 1wdd s ASP 473 Ca -0.02 -0.29 0.07 0.00 0.43 0.00 0.00 52.55 52.74 1wdd s ASP 473 Cb 0.10 -1.83 -0.04 0.00 -0.30 0.00 0.00 42.92 40.85 1wdd s ASP 473 CO 0.82 -0.02 -0.17 -0.54 -0.17 0.00 0.00 175.17 175.10 1wdd s LYS 474 N 1.49 1.14 0.00 4.34 1.02 -1.26 -4.78 119.74 121.70 1wdd s LYS 474 Ca 0.06 -1.31 0.30 0.00 0.02 0.00 0.00 55.97 55.04 1wdd s LYS 474 Cb -0.15 -1.14 1.53 0.00 -0.52 0.00 0.00 37.83 37.56 1wdd s LYS 474 CO 0.00 0.23 2.02 1.28 -0.92 0.00 0.00 175.35 177.96