#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xnf h TRP 24 N 0.00 0.00 0.00 7.33 5.08 -2.06 -3.03 115.95 123.27 1xnf h TRP 24 Ca 0.00 0.00 -0.05 0.00 1.08 0.00 0.00 58.89 59.92 1xnf h TRP 24 Cb 0.00 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.15 1xnf h TRP 24 CO 0.00 0.00 -0.24 0.07 -1.28 0.00 0.00 178.44 176.99 1xnf h ARG 25 N 0.00 0.00 0.00 0.12 0.11 -2.06 -1.58 114.38 110.97 1xnf h ARG 25 Ca 0.38 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.44 1xnf h ARG 25 Cb 1.79 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.87 1xnf h ARG 25 CO -0.00 0.24 -0.07 0.87 0.10 0.00 0.00 179.97 181.11 1xnf h LYS 26 N 0.00 0.00 -0.01 0.08 1.57 -2.02 -2.82 116.57 113.37 1xnf h LYS 26 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1xnf h LYS 26 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.78 1xnf h LYS 26 CO 0.03 0.07 -0.12 0.43 -0.57 0.00 0.00 179.45 179.28 1xnf n SER 27 N -3.24 1.44 -4.76 0.86 7.64 -0.59 -4.96 113.62 110.00 1xnf n SER 27 Ca -0.00 -1.29 -0.31 0.00 1.01 0.00 0.00 58.87 58.28 1xnf n SER 27 Cb 0.30 0.08 0.10 0.00 -1.01 0.00 0.00 64.21 63.67 1xnf n SER 27 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1xnf s GLU 28 N -2.22 2.10 -0.23 1.43 0.41 -1.07 -5.00 118.70 114.12 1xnf s GLU 28 Ca 0.31 1.04 -0.25 0.00 -0.41 0.00 0.00 54.97 55.66 1xnf s GLU 28 Cb 0.20 -1.89 -0.00 0.00 -1.78 0.00 0.00 34.13 30.66 1xnf s GLU 28 CO 0.42 -1.72 0.86 0.08 -0.49 0.00 0.00 175.26 174.41 1xnf s VAL 29 N -2.94 4.82 0.01 2.63 1.01 -1.26 -5.04 120.40 119.64 1xnf s VAL 29 Ca 0.61 1.64 0.02 0.00 0.00 0.00 0.00 61.98 64.26 1xnf s VAL 29 Cb -0.17 -4.15 -0.01 0.00 0.00 0.00 0.00 36.38 32.05 1xnf s VAL 29 CO 0.56 -0.08 -0.08 -0.76 0.00 0.00 0.00 175.10 174.75 1xnf s LEU 30 N 2.81 2.10 0.36 3.92 1.43 -1.26 -5.07 118.68 122.97 1xnf s LEU 30 Ca 0.37 -0.27 0.07 0.00 -1.03 0.00 0.00 54.13 53.27 1xnf s LEU 30 Cb -0.15 -0.31 -0.01 0.00 0.03 0.00 0.00 46.19 45.75 1xnf s LEU 30 CO 0.08 -0.01 0.47 0.00 0.23 0.00 0.00 176.35 177.12 1xnf s ALA 31 N -0.56 4.25 -0.16 4.21 0.00 -1.26 -5.04 121.76 123.20 1xnf s ALA 31 Ca -0.01 -1.55 -0.29 0.00 0.00 0.00 0.00 51.96 50.10 1xnf s ALA 31 Cb -0.05 -1.57 -0.01 0.00 0.00 0.00 0.00 23.12 21.48 1xnf s ALA 31 CO 0.00 -0.09 1.22 0.08 0.00 0.00 0.00 175.76 176.97 1xnf s VAL 32 N -2.25 4.33 0.20 0.00 1.01 -1.26 -4.96 120.40 117.47 1xnf s VAL 32 Ca 0.47 1.62 -0.32 0.00 0.00 0.00 0.00 61.98 63.75 1xnf s VAL 32 Cb -0.09 -4.05 -0.15 0.00 0.00 0.00 0.00 36.38 32.09 1xnf s VAL 32 CO 0.31 -0.12 1.12 -2.65 0.00 0.00 0.00 175.10 173.76 1xnf n PRO 33 N 6.33 1.18 -1.85 2.72 -0.02 -1.26 -4.85 135.00 137.25 1xnf n PRO 33 Ca 0.13 0.42 -0.41 0.00 -2.02 0.00 0.00 63.50 61.62 1xnf n PRO 33 Cb 0.45 -1.88 -0.00 0.00 -0.02 0.00 0.00 33.50 32.05 1xnf n PRO 33 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1xnf s LEU 34 N 0.68 4.33 0.14 2.45 1.02 -0.86 -4.99 118.68 121.44 1xnf s LEU 34 Ca 0.70 3.00 0.11 0.00 0.02 0.00 0.00 54.13 57.96 1xnf s LEU 34 Cb -0.82 -3.67 -0.04 0.00 0.02 0.00 0.00 46.19 41.68 1xnf s LEU 34 CO 0.54 -0.83 -0.24 -1.10 0.02 0.00 0.00 176.35 174.74 1xnf s GLN 35 N -2.03 1.52 0.38 1.70 -1.52 -1.26 -4.82 119.66 113.62 1xnf s GLN 35 Ca 0.52 -1.33 -0.26 0.00 -1.95 0.00 0.00 55.36 52.35 1xnf s GLN 35 Cb -0.46 -1.95 -0.12 0.00 -0.22 0.00 0.00 33.01 30.27 1xnf s GLN 35 CO 0.62 0.45 1.01 -2.30 -0.25 0.00 0.00 175.29 174.81 1xnf n PRO 36 N 0.78 1.37 -2.79 2.91 -0.02 -1.26 -4.98 135.00 131.02 1xnf n PRO 36 Ca -0.17 0.49 -0.28 0.00 -2.02 0.00 0.00 63.50 61.52 1xnf n PRO 36 Cb 0.53 -1.98 -0.01 0.00 -0.02 0.00 0.00 33.50 32.03 1xnf n PRO 36 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1xnf s THR 37 N -1.21 4.91 0.20 3.45 -4.23 -1.26 -4.98 115.64 112.52 1xnf s THR 37 Ca 0.61 0.22 -0.11 0.00 -1.18 0.00 0.00 61.69 61.23 1xnf s THR 37 Cb -0.60 -3.83 0.12 0.00 1.34 0.00 0.00 72.50 69.52 1xnf s THR 37 CO 0.58 -0.72 1.79 0.25 -0.54 0.00 0.00 174.62 175.98 1xnf h LEU 38 N 0.58 0.42 -1.00 4.79 5.85 -1.99 -1.24 115.31 122.72 1xnf h LEU 38 Ca -0.47 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.27 1xnf h LEU 38 Cb 1.20 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 42.15 1xnf h LEU 38 CO 0.62 0.28 0.45 1.56 -0.34 0.00 0.00 178.44 181.01 1xnf h GLN 39 N 0.56 1.15 -0.65 1.25 7.50 -1.98 0.31 115.11 123.25 1xnf h GLN 39 Ca 0.27 -0.13 -0.08 0.00 0.50 0.00 0.00 58.65 59.21 1xnf h GLN 39 Cb 0.20 -0.23 -0.03 0.00 0.05 0.00 0.00 27.48 27.47 1xnf h GLN 39 CO -0.19 0.84 0.10 1.96 -1.50 0.00 0.00 178.83 180.05 1xnf h GLN 40 N 1.16 1.08 -0.41 1.46 4.20 -1.73 -0.06 115.11 120.80 1xnf h GLN 40 Ca 0.29 -0.29 -0.15 0.00 0.06 0.00 0.00 58.65 58.56 1xnf h GLN 40 Cb 0.03 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 1xnf h GLN 40 CO -0.05 1.00 -0.31 0.93 -0.67 0.00 0.00 178.83 179.73 1xnf h GLU 41 N 1.00 0.93 -0.55 1.46 5.08 -0.19 -1.74 114.58 120.56 1xnf h GLU 41 Ca 0.20 -0.46 0.04 0.00 -1.00 0.00 0.00 59.36 58.14 1xnf h GLU 41 Cb 0.44 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.65 1xnf h GLU 41 CO 0.01 1.11 0.30 0.28 -1.00 0.00 0.00 179.01 179.72 1xnf h VAL 42 N 0.75 0.99 -0.42 3.13 2.07 -0.30 -1.43 116.25 121.04 1xnf h VAL 42 Ca 0.08 -0.20 -0.05 0.00 0.82 0.00 0.00 66.70 67.35 1xnf h VAL 42 Cb 0.90 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 1xnf h VAL 42 CO 0.08 0.11 0.09 0.40 0.02 0.00 0.00 177.57 178.27 1xnf h ILE 43 N 0.59 1.24 -0.65 4.57 2.04 -0.85 -1.57 117.51 122.87 1xnf h ILE 43 Ca 0.24 -0.84 -0.03 0.00 1.00 0.00 0.00 64.86 65.23 1xnf h ILE 43 Cb 0.11 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 37.13 1xnf h ILE 43 CO -0.14 0.29 0.30 -0.07 0.00 0.00 0.00 178.15 178.52 1xnf h LEU 44 N 0.55 0.87 -0.71 1.44 3.38 -1.13 -2.48 115.31 117.24 1xnf h LEU 44 Ca 0.13 -0.15 0.05 0.00 0.09 0.00 0.00 57.88 58.01 1xnf h LEU 44 Cb 0.34 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.82 1xnf h LEU 44 CO 0.00 0.77 0.42 0.00 0.09 0.00 0.00 178.44 179.73 1xnf h ALA 45 N 1.13 0.95 0.00 1.53 0.00 -0.94 -1.99 119.26 119.94 1xnf h ALA 45 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1xnf h ALA 45 Cb 0.15 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1xnf h ALA 45 CO -0.02 0.14 0.00 2.89 0.00 0.00 0.00 179.25 182.25 1xnf n ARG 46 N -4.72 0.44 0.00 0.00 0.00 -0.62 -2.88 116.66 108.87 1xnf n ARG 46 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.94 1xnf n ARG 46 Cb 0.15 -1.28 0.00 0.00 -0.00 0.00 0.00 32.46 31.33 1xnf n ARG 46 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 1xnf n GLU 48 N 1.16 0.00 -0.08 2.89 2.13 -0.75 -1.75 120.64 124.24 1xnf n GLU 48 Ca 0.00 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.69 1xnf n GLU 48 Cb 0.22 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 31.88 1xnf n GLU 48 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 1xnf h GLN 49 N 0.00 0.62 -0.20 5.31 1.08 -1.82 -1.56 115.11 118.55 1xnf h GLN 49 Ca 0.00 -0.33 -0.03 0.00 -1.45 0.00 0.00 58.65 56.84 1xnf h GLN 49 Cb 0.00 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.44 1xnf h GLN 49 CO 0.00 0.94 0.02 0.82 -0.95 0.00 0.00 178.83 179.65 1xnf h ILE 50 N 0.34 1.24 -0.27 2.54 2.04 -1.66 -2.14 117.51 119.61 1xnf h ILE 50 Ca 0.04 -0.80 -0.00 0.00 1.00 0.00 0.00 64.86 65.09 1xnf h ILE 50 Cb 0.83 1.39 -0.01 0.00 -0.74 0.00 0.00 36.82 38.28 1xnf h ILE 50 CO 0.06 0.25 0.15 -0.07 0.00 0.00 0.00 178.15 178.54 1xnf h LEU 51 N 0.11 0.32 -0.99 1.44 3.38 -1.82 -1.97 115.31 115.78 1xnf h LEU 51 Ca 0.06 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1xnf h LEU 51 Cb 0.35 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 1xnf h LEU 51 CO 0.01 0.26 -0.15 0.00 0.09 0.00 0.00 178.44 178.64 1xnf h ALA 52 N 1.80 0.99 -2.43 1.53 0.00 -0.65 -3.45 119.26 117.05 1xnf h ALA 52 Ca 0.10 -0.14 -0.50 0.00 0.00 0.00 0.00 54.91 54.37 1xnf h ALA 52 Cb 0.01 -0.02 0.07 0.00 0.00 0.00 0.00 17.79 17.84 1xnf h ALA 52 CO -0.02 0.19 0.39 -1.54 0.00 0.00 0.00 179.25 178.28 1xnf s SER 53 N -6.07 5.66 0.00 0.00 1.04 -0.74 -4.98 113.70 108.61 1xnf s SER 53 Ca 0.02 1.16 0.20 0.00 0.48 0.00 0.00 55.95 57.82 1xnf s SER 53 Cb 0.09 -2.05 0.55 0.00 0.10 0.00 0.00 66.02 64.71 1xnf s SER 53 CO 0.62 -1.19 1.46 -2.11 0.98 0.00 0.00 173.24 173.00 1xnf n ARG 54 N -2.90 2.43 -1.29 4.02 0.00 -1.26 -4.53 116.66 113.13 1xnf n ARG 54 Ca 0.06 -2.20 -0.25 0.00 -0.00 0.00 0.00 57.85 55.46 1xnf n ARG 54 Cb 0.56 -1.49 0.13 0.00 -0.00 0.00 0.00 32.46 31.66 1xnf n ARG 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1xnf n ALA 55 N 1.32 5.60 -3.16 2.89 0.00 -1.26 -4.91 120.51 120.99 1xnf n ALA 55 Ca 0.21 -3.27 -0.28 0.00 0.00 0.00 0.00 53.44 50.10 1xnf n ALA 55 Cb 0.54 -1.32 -0.16 0.00 0.00 0.00 0.00 19.45 18.50 1xnf n ALA 55 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1xnf s LEU 56 N -3.53 1.88 0.74 0.00 1.43 -1.26 -5.10 118.68 112.84 1xnf s LEU 56 Ca 0.57 -0.40 -0.11 0.00 -1.03 0.00 0.00 54.13 53.16 1xnf s LEU 56 Cb 0.47 -1.07 0.04 0.00 0.03 0.00 0.00 46.19 45.66 1xnf s LEU 56 CO 0.04 0.12 1.08 0.42 0.23 0.00 0.00 176.35 178.24 1xnf s THR 57 N 0.31 3.56 0.18 5.49 -4.23 -1.26 -4.79 115.64 114.90 1xnf s THR 57 Ca -0.11 0.52 -0.13 0.00 -1.18 0.00 0.00 61.69 60.79 1xnf s THR 57 Cb -0.15 -3.09 0.10 0.00 1.34 0.00 0.00 72.50 70.70 1xnf s THR 57 CO 0.05 -0.65 1.73 0.44 -0.54 0.00 0.00 174.62 175.65 1xnf h ASP 58 N -0.90 0.07 -0.92 3.99 3.32 -1.98 0.12 116.42 120.12 1xnf h ASP 58 Ca -0.44 0.08 0.04 0.00 0.02 0.00 0.00 57.03 56.73 1xnf h ASP 58 Cb 1.22 0.09 -0.06 0.00 0.22 0.00 0.00 39.33 40.81 1xnf h ASP 58 CO 0.53 0.07 0.59 0.44 -1.72 0.00 0.00 179.24 179.15 1xnf h ASP 59 N 0.27 0.97 0.22 6.45 3.32 -1.93 0.18 116.42 125.90 1xnf h ASP 59 Ca 0.24 -0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.19 1xnf h ASP 59 Cb 0.29 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 1xnf h ASP 59 CO -0.29 0.65 -0.37 -0.33 -1.72 0.00 0.00 179.24 177.18 1xnf h GLU 60 N 1.12 0.22 -0.16 3.56 5.08 -1.62 -2.52 114.58 120.26 1xnf h GLU 60 Ca 0.38 -0.09 -0.10 0.00 -1.00 0.00 0.00 59.36 58.55 1xnf h GLU 60 Cb 0.06 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 1xnf h GLU 60 CO -0.14 0.56 -0.28 -0.09 -1.00 0.00 0.00 179.01 178.07 1xnf h ARG 61 N 0.19 0.47 -0.35 2.33 2.43 0.09 -1.85 114.38 117.68 1xnf h ARG 61 Ca 0.02 -0.29 -0.02 0.00 -0.81 0.00 0.00 59.98 58.88 1xnf h ARG 61 Cb 0.74 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.31 1xnf h ARG 61 CO 0.06 0.89 0.13 0.00 -1.51 0.00 0.00 179.97 179.54 1xnf h ALA 62 N 0.57 0.46 -0.25 2.80 0.00 -0.62 0.99 119.26 123.22 1xnf h ALA 62 Ca 0.01 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.82 1xnf h ALA 62 Cb 0.86 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.47 1xnf h ALA 62 CO 0.06 0.08 -0.01 0.37 0.00 0.00 0.00 179.25 179.75 1xnf h GLN 63 N 0.42 0.06 -0.42 0.00 5.75 -1.51 -0.36 115.11 119.06 1xnf h GLN 63 Ca 0.12 -0.00 -0.13 0.00 -0.15 0.00 0.00 58.65 58.48 1xnf h GLN 63 Cb 0.21 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.74 1xnf h GLN 63 CO -0.01 0.04 -0.25 1.25 -2.65 0.00 0.00 178.83 177.22 1xnf h LEU 64 N 0.06 0.94 -0.55 -2.39 5.85 -0.96 -0.54 115.31 117.73 1xnf h LEU 64 Ca 0.12 -0.42 0.00 0.00 0.84 0.00 0.00 57.88 58.42 1xnf h LEU 64 Cb 0.16 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 1xnf h LEU 64 CO -0.21 1.15 0.34 -0.07 -0.34 0.00 0.00 178.44 179.32 1xnf h LEU 65 N 0.73 0.65 -0.49 2.25 4.07 -0.71 -0.62 115.31 121.19 1xnf h LEU 65 Ca 0.09 -0.04 0.04 0.00 0.08 0.00 0.00 57.88 58.04 1xnf h LEU 65 Cb 0.82 -0.16 -0.04 0.00 1.08 0.00 0.00 40.66 42.36 1xnf h LEU 65 CO 0.07 0.50 0.25 0.22 -1.08 0.00 0.00 178.44 178.40 1xnf h TYR 66 N 0.74 0.45 -0.83 1.13 3.20 -0.72 -0.89 116.97 120.06 1xnf h TYR 66 Ca 0.20 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.07 1xnf h TYR 66 Cb -0.04 -0.13 -0.04 0.00 1.54 0.00 0.00 36.73 38.06 1xnf h TYR 66 CO -0.03 0.23 0.43 0.93 -1.64 0.00 0.00 178.16 178.08 1xnf h GLU 67 N 0.49 1.18 -0.26 1.82 5.08 -0.59 -0.23 114.58 122.06 1xnf h GLU 67 Ca 0.21 -0.15 -0.10 0.00 -1.00 0.00 0.00 59.36 58.32 1xnf h GLU 67 Cb 0.11 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 1xnf h GLU 67 CO -0.15 0.88 -0.28 -0.09 -1.00 0.00 0.00 179.01 178.38 1xnf h ARG 68 N 1.18 0.52 -0.37 2.33 2.43 -0.87 -1.68 114.38 117.91 1xnf h ARG 68 Ca 0.29 -0.21 -0.04 0.00 -0.81 0.00 0.00 59.98 59.22 1xnf h ARG 68 Cb 0.06 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1xnf h ARG 68 CO -0.04 0.75 0.08 0.78 -1.51 0.00 0.00 179.97 180.03 1xnf h GLY 69 N 1.03 0.64 0.69 2.80 0.00 -0.12 0.12 103.07 108.23 1xnf h GLY 69 Ca 0.06 -0.41 0.05 0.00 0.00 0.00 0.00 47.33 47.04 1xnf h GLY 69 CO 0.06 0.38 0.25 -2.08 0.00 0.00 0.00 176.54 175.14 1xnf h VAL 70 N 0.45 0.94 -0.25 4.60 2.07 -0.92 -0.87 116.25 122.26 1xnf h VAL 70 Ca 0.12 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 1xnf h VAL 70 Cb 0.31 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 1xnf h VAL 70 CO 0.00 0.09 0.10 0.25 0.02 0.00 0.00 177.57 178.04 1xnf h LEU 71 N 0.49 0.34 -0.83 2.57 5.85 -0.53 -1.66 115.31 121.54 1xnf h LEU 71 Ca 0.23 -0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 1xnf h LEU 71 Cb 0.16 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.06 1xnf h LEU 71 CO -0.17 0.41 0.40 1.88 -0.34 0.00 0.00 178.44 180.61 1xnf h TYR 72 N 0.26 1.20 -0.52 1.25 0.05 -0.66 -1.75 116.97 116.79 1xnf h TYR 72 Ca 0.08 -0.06 0.03 0.00 0.05 0.00 0.00 58.73 58.83 1xnf h TYR 72 Cb 0.17 -0.37 -0.04 0.00 1.01 0.00 0.00 36.73 37.50 1xnf h TYR 72 CO -0.01 0.87 0.30 0.22 -1.05 0.00 0.00 178.16 178.49 1xnf h ASP 73 N 1.18 0.47 0.21 3.88 3.58 -1.04 0.14 116.42 124.85 1xnf h ASP 73 Ca 0.28 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.75 1xnf h ASP 73 Cb 0.12 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.09 1xnf h ASP 73 CO -0.04 0.33 0.00 0.77 -2.88 0.00 0.00 179.24 177.43 1xnf h SER 74 N 0.59 0.00 -0.13 2.28 4.64 -0.59 -0.51 113.55 119.83 1xnf h SER 74 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 1xnf h SER 74 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1xnf h SER 74 CO -0.11 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.03 1xnf n LEU 75 N -3.06 3.13 0.00 5.97 4.77 -0.47 -4.38 117.00 122.96 1xnf n LEU 75 Ca -0.02 -1.13 0.00 0.00 -0.03 0.00 0.00 56.01 54.83 1xnf n LEU 75 Cb 0.12 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1xnf n LEU 75 CO 0.21 0.57 0.00 0.61 -1.33 0.00 0.00 177.39 177.45 1xnf n GLY 76 N 1.39 0.67 3.12 -0.72 0.00 -0.20 -4.99 105.19 104.46 1xnf n GLY 76 Ca 0.15 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.74 1xnf n GLY 76 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xnf n LEU 77 N 0.00 6.12 0.14 0.99 4.77 0.38 -4.85 117.00 124.55 1xnf n LEU 77 Ca 0.00 -5.07 0.01 0.00 -0.03 0.00 0.00 56.01 50.92 1xnf n LEU 77 Cb 0.00 -1.37 0.15 0.00 -2.33 0.00 0.00 43.42 39.87 1xnf n LEU 77 CO 0.00 1.51 0.50 0.03 -1.33 0.00 0.00 177.39 178.10 1xnf h ARG 78 N 5.92 0.00 -0.26 3.23 3.08 -1.87 -0.68 114.38 123.80 1xnf h ARG 78 Ca 0.22 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.12 1xnf h ARG 78 Cb 0.71 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.76 1xnf h ARG 78 CO 1.26 0.56 -0.40 0.00 -1.07 0.00 0.00 179.97 180.32 1xnf h ALA 79 N 1.44 0.40 -0.26 0.04 0.00 -1.96 0.51 119.26 119.43 1xnf h ALA 79 Ca -0.01 -0.45 -0.07 0.00 0.00 0.00 0.00 54.91 54.38 1xnf h ALA 79 Cb 1.21 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1xnf h ALA 79 CO 0.07 0.50 -0.13 -0.07 0.00 0.00 0.00 179.25 179.62 1xnf h LEU 80 N 0.46 0.42 -0.07 0.00 3.38 -1.93 -0.74 115.31 116.83 1xnf h LEU 80 Ca 0.02 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1xnf h LEU 80 Cb 1.00 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.63 1xnf h LEU 80 CO 0.09 0.58 0.01 0.00 0.09 0.00 0.00 178.44 179.21 1xnf h ALA 81 N 1.47 0.09 -0.65 1.53 0.00 -1.02 -2.29 119.26 118.39 1xnf h ALA 81 Ca 0.08 -0.14 0.08 0.00 0.00 0.00 0.00 54.91 54.92 1xnf h ALA 81 Cb 0.47 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.17 1xnf h ALA 81 CO 0.03 -0.27 0.32 -0.09 0.00 0.00 0.00 179.25 179.24 1xnf h ARG 82 N -0.13 0.55 -0.39 0.00 2.43 -0.69 0.28 114.38 116.44 1xnf h ARG 82 Ca 0.02 -0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.19 1xnf h ARG 82 Cb 0.28 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.67 1xnf h ARG 82 CO 0.00 0.37 0.18 -0.97 -1.51 0.00 0.00 179.97 178.04 1xnf h ASN 83 N 0.57 0.25 -0.49 -3.80 -1.24 -0.99 -0.82 115.58 109.07 1xnf h ASN 83 Ca 0.31 0.02 -0.08 0.00 0.71 0.00 0.00 56.30 57.26 1xnf h ASN 83 Cb 0.28 -0.02 -0.02 0.00 0.73 0.00 0.00 38.32 39.29 1xnf h ASN 83 CO -0.23 0.19 0.00 0.44 -1.29 0.00 0.00 177.43 176.54 1xnf h ASP 84 N 0.37 0.84 -0.51 1.15 3.32 -0.78 -1.76 116.42 119.05 1xnf h ASP 84 Ca 0.17 -0.31 -0.02 0.00 0.02 0.00 0.00 57.03 56.89 1xnf h ASP 84 Cb 0.09 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 1xnf h ASP 84 CO -0.13 0.94 0.23 -0.26 -1.72 0.00 0.00 179.24 178.30 1xnf h PHE 85 N 0.72 0.75 -0.46 4.55 0.05 -0.59 -0.52 116.94 121.45 1xnf h PHE 85 Ca 0.14 -0.05 -0.09 0.00 3.82 0.00 0.00 57.97 61.80 1xnf h PHE 85 Cb 0.51 -0.23 -0.02 0.00 2.00 0.00 0.00 35.95 38.21 1xnf h PHE 85 CO 0.04 0.61 -0.05 0.77 -0.18 0.00 0.00 178.31 179.50 1xnf h SER 86 N 0.68 0.83 -0.69 2.17 0.02 -1.03 0.43 113.55 115.96 1xnf h SER 86 Ca 0.17 -0.33 -0.03 0.00 -0.84 0.00 0.00 61.79 60.76 1xnf h SER 86 Cb 0.15 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.43 1xnf h SER 86 CO -0.02 0.97 0.31 1.56 -1.14 0.00 0.00 176.83 178.51 1xnf h GLN 87 N 0.68 1.03 -0.30 3.45 4.20 -1.07 -1.81 115.11 121.30 1xnf h GLN 87 Ca 0.12 -0.16 -0.05 0.00 0.06 0.00 0.00 58.65 58.62 1xnf h GLN 87 Cb 0.57 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 1xnf h GLN 87 CO 0.03 0.82 -0.01 0.00 -0.67 0.00 0.00 178.83 179.00 1xnf h ALA 88 N 1.32 0.40 -0.78 3.87 0.00 -0.67 -2.81 119.26 120.61 1xnf h ALA 88 Ca 0.24 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1xnf h ALA 88 Cb 0.15 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 1xnf h ALA 88 CO -0.03 0.16 0.51 1.25 0.00 0.00 0.00 179.25 181.15 1xnf h LEU 89 N 0.32 0.84 -1.16 0.00 5.85 -0.62 0.16 115.31 120.70 1xnf h LEU 89 Ca 0.08 -0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.71 1xnf h LEU 89 Cb 0.45 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 1xnf h LEU 89 CO 0.02 0.59 -0.39 0.00 -0.34 0.00 0.00 178.44 178.31 1xnf h ALA 90 N 1.54 1.21 0.09 1.25 0.00 -1.22 -2.44 119.26 119.69 1xnf h ALA 90 Ca 0.30 -0.36 -0.25 0.00 0.00 0.00 0.00 54.91 54.60 1xnf h ALA 90 Cb -0.00 -0.06 0.02 0.00 0.00 0.00 0.00 17.79 17.75 1xnf h ALA 90 CO -0.08 0.49 -1.04 0.82 0.00 0.00 0.00 179.25 179.44 1xnf h ILE 91 N 0.00 1.34 -2.73 0.00 2.04 -1.05 -3.44 117.51 113.68 1xnf h ILE 91 Ca -0.00 -2.37 -0.55 0.00 1.00 0.00 0.00 64.86 62.94 1xnf h ILE 91 Cb 0.76 2.71 -0.40 0.00 -0.74 0.00 0.00 36.82 39.16 1xnf h ILE 91 CO 0.05 0.71 -0.80 -0.60 0.00 0.00 0.00 178.15 177.51 1xnf s ARG 92 N -2.99 0.33 0.60 2.37 3.52 0.47 -4.97 118.95 118.28 1xnf s ARG 92 Ca -0.11 -0.83 0.37 0.00 -0.13 0.00 0.00 55.73 55.03 1xnf s ARG 92 Cb 0.05 -1.23 1.87 0.00 -1.56 0.00 0.00 34.95 34.07 1xnf s ARG 92 CO 0.90 -1.09 2.19 -1.35 -0.81 0.00 0.00 175.30 175.14 1xnf h PRO 93 N 7.91 0.00 -5.59 5.12 0.11 -1.71 -3.37 132.00 134.47 1xnf h PRO 93 Ca -0.11 0.00 -0.62 0.00 0.11 0.00 0.00 66.00 65.39 1xnf h PRO 93 Cb 1.00 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 31.99 1xnf h PRO 93 CO 0.38 0.03 0.23 0.34 -0.21 0.00 0.00 178.00 178.76 1xnf s ASP 94 N -5.60 6.53 0.00 -2.05 -1.08 -1.26 -5.05 116.67 108.16 1xnf s ASP 94 Ca -0.03 0.42 0.00 0.00 -0.52 0.00 0.00 52.55 52.42 1xnf s ASP 94 Cb 0.12 -2.35 0.00 0.00 -1.46 0.00 0.00 42.92 39.23 1xnf s ASP 94 CO 0.50 -0.56 0.00 -0.81 0.52 0.00 0.00 175.17 174.82 1xnf n PRO 96 N 6.04 0.00 -0.32 4.34 -0.04 -1.26 -5.07 135.00 138.69 1xnf n PRO 96 Ca 0.00 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.58 1xnf n PRO 96 Cb 0.49 -0.15 0.34 0.00 -0.04 0.00 0.00 33.50 34.14 1xnf n PRO 96 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1xnf h GLU 97 N 0.00 0.75 -0.06 0.54 3.07 -2.00 0.03 114.58 116.91 1xnf h GLU 97 Ca 0.00 -0.05 -0.09 0.00 -0.50 0.00 0.00 59.36 58.73 1xnf h GLU 97 Cb 0.00 -0.17 0.00 0.00 -0.84 0.00 0.00 28.75 27.75 1xnf h GLU 97 CO 0.00 0.50 -0.31 0.28 -1.40 0.00 0.00 179.01 178.08 1xnf h VAL 98 N 0.77 1.43 -0.12 3.13 2.07 -1.97 -3.13 116.25 118.42 1xnf h VAL 98 Ca 0.50 -1.72 -0.03 0.00 0.82 0.00 0.00 66.70 66.27 1xnf h VAL 98 Cb 0.76 2.35 -0.01 0.00 -1.52 0.00 0.00 31.29 32.87 1xnf h VAL 98 CO -0.27 0.49 -0.08 -0.26 0.02 0.00 0.00 177.57 177.47 1xnf h PHE 99 N -0.18 0.18 0.53 1.57 0.04 -1.66 -0.77 116.94 116.64 1xnf h PHE 99 Ca -0.02 -0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.72 1xnf h PHE 99 Cb 0.96 -0.05 -0.02 0.00 2.20 0.00 0.00 35.95 39.04 1xnf h PHE 99 CO 0.13 0.26 -0.43 -0.97 -0.60 0.00 0.00 178.31 176.70 1xnf h ASN 100 N 0.17 -1.15 -0.87 2.17 -1.24 -1.06 0.28 115.58 113.88 1xnf h ASN 100 Ca 0.04 0.09 0.15 0.00 0.71 0.00 0.00 56.30 57.28 1xnf h ASN 100 Cb 0.26 0.37 -0.09 0.00 0.73 0.00 0.00 38.32 39.58 1xnf h ASN 100 CO 0.01 -0.62 0.47 1.88 -1.29 0.00 0.00 177.43 177.88 1xnf h TYR 101 N -0.95 0.83 -0.57 0.67 -1.99 -1.39 -1.41 116.97 112.15 1xnf h TYR 101 Ca -0.06 0.03 -0.09 0.00 2.00 0.00 0.00 58.73 60.61 1xnf h TYR 101 Cb 0.81 -0.24 -0.02 0.00 2.00 0.00 0.00 36.73 39.28 1xnf h TYR 101 CO -0.19 0.22 -0.01 -0.07 -0.00 0.00 0.00 178.16 178.11 1xnf h LEU 102 N 0.67 0.98 -0.87 3.88 3.38 -0.76 -1.36 115.31 121.23 1xnf h LEU 102 Ca 0.47 -0.27 -0.08 0.00 0.09 0.00 0.00 57.88 58.08 1xnf h LEU 102 Cb 0.65 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 1xnf h LEU 102 CO -0.35 1.03 -0.08 1.23 0.09 0.00 0.00 178.44 180.37 1xnf h GLY 103 N 0.99 0.82 0.99 0.83 0.00 -0.47 -0.98 103.07 105.25 1xnf h GLY 103 Ca 0.16 -0.59 -0.01 0.00 0.00 0.00 0.00 47.33 46.90 1xnf h GLY 103 CO 0.03 0.54 0.29 -2.22 0.00 0.00 0.00 176.54 175.19 1xnf h ILE 104 N 0.69 1.16 -0.27 2.60 2.04 -0.77 -0.28 117.51 122.69 1xnf h ILE 104 Ca 0.12 -0.40 -0.14 0.00 1.00 0.00 0.00 64.86 65.45 1xnf h ILE 104 Cb 0.54 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 1xnf h ILE 104 CO 0.03 0.17 -0.39 1.88 0.00 0.00 0.00 178.15 179.84 1xnf h TYR 105 N 0.68 0.76 -0.70 1.37 0.05 -0.89 0.12 116.97 118.36 1xnf h TYR 105 Ca 0.18 -0.22 -0.02 0.00 0.05 0.00 0.00 58.73 58.72 1xnf h TYR 105 Cb 0.02 -0.16 -0.03 0.00 1.01 0.00 0.00 36.73 37.56 1xnf h TYR 105 CO -0.02 0.93 0.36 -0.07 -1.05 0.00 0.00 178.16 178.31 1xnf h LEU 106 N 0.53 0.90 -0.41 3.88 3.38 -0.99 -1.28 115.31 121.31 1xnf h LEU 106 Ca 0.05 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1xnf h LEU 106 Cb 0.91 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 1xnf h LEU 106 CO 0.08 0.76 0.24 0.74 0.09 0.00 0.00 178.44 180.35 1xnf h THR 107 N 0.97 1.14 -0.27 0.22 2.02 0.06 -0.82 112.91 116.23 1xnf h THR 107 Ca 0.24 -0.35 0.00 0.00 0.77 0.00 0.00 66.41 67.07 1xnf h THR 107 Cb 0.08 0.63 -0.01 0.00 -1.74 0.00 0.00 68.15 67.11 1xnf h THR 107 CO -0.03 0.15 0.18 1.56 0.37 0.00 0.00 175.52 177.75 1xnf h GLN 108 N 0.54 0.36 0.00 6.66 4.20 -0.46 0.67 115.11 127.07 1xnf h GLN 108 Ca 0.15 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.83 1xnf h GLN 108 Cb 0.03 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.73 1xnf h GLN 108 CO -0.03 0.24 0.00 0.00 -0.67 0.00 0.00 178.83 178.37 1xnf n ALA 109 N -2.50 2.45 -0.76 3.87 0.00 -0.51 -4.87 120.51 118.19 1xnf n ALA 109 Ca 0.01 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1xnf n ALA 109 Cb 0.07 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.03 1xnf n ALA 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xnf n GLY 110 N 1.32 0.80 3.03 0.00 0.00 0.23 -4.97 105.19 105.59 1xnf n GLY 110 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 1xnf n GLY 110 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1xnf n ASN 111 N 0.00 5.02 -0.13 1.61 2.85 -0.37 -4.82 115.26 119.43 1xnf n ASN 111 Ca 0.00 -3.05 -0.11 0.00 -0.11 0.00 0.00 54.58 51.31 1xnf n ASN 111 Cb 0.00 -1.53 -0.02 0.00 1.24 0.00 0.00 39.78 39.47 1xnf n ASN 111 CO 0.00 0.00 0.00 -0.26 -2.11 0.00 0.00 177.26 174.89 1xnf h PHE 112 N 6.17 0.79 -0.57 1.20 -1.00 -1.89 -0.89 116.94 120.75 1xnf h PHE 112 Ca 0.39 -0.17 0.11 0.00 2.81 0.00 0.00 57.97 61.11 1xnf h PHE 112 Cb 0.70 -0.20 -0.08 0.00 3.61 0.00 0.00 35.95 39.98 1xnf h PHE 112 CO 1.24 0.85 0.09 -0.44 -1.61 0.00 0.00 178.31 178.44 1xnf h ASP 113 N 0.51 -0.05 0.31 2.17 3.32 -1.95 0.10 116.42 120.83 1xnf h ASP 113 Ca 0.10 0.11 -0.14 0.00 0.02 0.00 0.00 57.03 57.12 1xnf h ASP 113 Cb 0.58 0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.28 1xnf h ASP 113 CO 0.03 -0.01 -0.54 0.00 -1.72 0.00 0.00 179.24 177.00 1xnf h ALA 114 N 1.47 0.91 -0.57 3.45 0.00 -1.89 -2.61 119.26 120.02 1xnf h ALA 114 Ca 0.30 -0.50 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1xnf h ALA 114 Cb 0.44 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1xnf h ALA 114 CO -0.40 0.69 0.35 0.00 0.00 0.00 0.00 179.25 179.89 1xnf h ALA 115 N 1.23 0.72 -0.81 0.00 0.00 0.34 -1.23 119.26 119.52 1xnf h ALA 115 Ca 0.00 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 54.91 1xnf h ALA 115 Cb 1.02 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.52 1xnf h ALA 115 CO 0.09 0.19 0.49 1.88 0.00 0.00 0.00 179.25 181.90 1xnf h TYR 116 N 0.77 0.91 -0.40 0.00 0.99 -0.51 -1.54 116.97 117.20 1xnf h TYR 116 Ca 0.21 0.03 -0.08 0.00 2.00 0.00 0.00 58.73 60.88 1xnf h TYR 116 Cb -0.04 -0.29 -0.02 0.00 1.00 0.00 0.00 36.73 37.38 1xnf h TYR 116 CO -0.03 0.46 -0.08 1.49 -0.00 0.00 0.00 178.16 180.01 1xnf h GLU 117 N 0.91 0.68 -0.54 4.88 4.81 -1.19 0.22 114.58 124.34 1xnf h GLU 117 Ca 0.35 -0.20 -0.10 0.00 -0.13 0.00 0.00 59.36 59.29 1xnf h GLU 117 Cb 0.16 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 1xnf h GLU 117 CO -0.17 0.75 -0.04 0.00 -0.73 0.00 0.00 179.01 178.83 1xnf h ALA 118 N 1.29 0.73 -0.05 2.92 0.00 -0.32 -0.55 119.26 123.28 1xnf h ALA 118 Ca 0.12 -0.32 -0.22 0.00 0.00 0.00 0.00 54.91 54.49 1xnf h ALA 118 Cb 0.51 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1xnf h ALA 118 CO 0.03 0.59 -0.87 0.74 0.00 0.00 0.00 179.25 179.74 1xnf h PHE 119 N 0.86 0.74 -0.90 0.00 0.05 -0.94 -1.44 116.94 115.31 1xnf h PHE 119 Ca 0.15 -0.37 0.13 0.00 3.82 0.00 0.00 57.97 61.70 1xnf h PHE 119 Cb 0.58 -0.10 -0.09 0.00 2.00 0.00 0.00 35.95 38.35 1xnf h PHE 119 CO 0.04 1.18 0.52 -0.44 -0.18 0.00 0.00 178.31 179.43 1xnf h ASP 120 N 0.32 0.70 -0.60 2.17 5.19 -0.43 -2.06 116.42 121.71 1xnf h ASP 120 Ca -0.07 0.07 -0.10 0.00 -0.62 0.00 0.00 57.03 56.31 1xnf h ASP 120 Cb 1.49 -0.06 -0.02 0.00 0.18 0.00 0.00 39.33 40.92 1xnf h ASP 120 CO 0.16 0.34 -0.00 0.28 -3.12 0.00 0.00 179.24 176.89 1xnf h SER 121 N 0.78 1.04 -0.14 6.45 0.02 -0.61 -1.42 113.55 119.68 1xnf h SER 121 Ca 0.47 -0.30 0.05 0.00 -0.84 0.00 0.00 61.79 61.17 1xnf h SER 121 Cb 0.57 -0.28 -0.05 0.00 0.14 0.00 0.00 62.40 62.78 1xnf h SER 121 CO -0.31 1.09 -0.20 0.58 -1.14 0.00 0.00 176.83 176.85 1xnf h VAL 122 N 0.97 0.49 0.00 2.27 2.07 -0.78 -2.07 116.25 119.20 1xnf h VAL 122 Ca 0.17 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.59 1xnf h VAL 122 Cb 0.56 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 1xnf h VAL 122 CO 0.03 0.00 -0.48 -0.07 0.02 0.00 0.00 177.57 177.07 1xnf h LEU 123 N -0.25 0.00 -0.31 2.57 3.38 -1.15 0.11 115.31 119.66 1xnf h LEU 123 Ca 0.10 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.95 1xnf h LEU 123 Cb 0.40 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1xnf h LEU 123 CO -0.28 0.48 -0.26 -0.08 0.09 0.00 0.00 178.44 178.39 1xnf h GLU 124 N 0.00 0.73 -0.21 1.13 4.81 -1.15 -0.89 114.58 119.00 1xnf h GLU 124 Ca -0.00 -0.37 -0.15 0.00 -0.13 0.00 0.00 59.36 58.71 1xnf h GLU 124 Cb 1.08 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.46 1xnf h GLU 124 CO 0.06 0.98 -0.49 -0.07 -0.73 0.00 0.00 179.01 178.77 1xnf h LEU 125 N 0.49 0.60 -6.20 1.64 3.38 -1.01 -3.41 115.31 110.80 1xnf h LEU 125 Ca 0.06 -0.30 -0.18 0.00 0.09 0.00 0.00 57.88 57.54 1xnf h LEU 125 Cb 0.83 -0.17 -0.26 0.00 0.09 0.00 0.00 40.66 41.15 1xnf h LEU 125 CO 0.07 0.99 -0.54 -0.62 0.09 0.00 0.00 178.44 178.43 1xnf s ASP 126 N -6.89 -0.14 0.05 -0.43 2.15 0.36 -5.01 116.67 106.77 1xnf s ASP 126 Ca -0.07 -0.79 0.06 0.00 0.43 0.00 0.00 52.55 52.17 1xnf s ASP 126 Cb 0.12 1.28 0.28 0.00 -0.30 0.00 0.00 42.92 44.30 1xnf s ASP 126 CO 0.83 -0.27 1.18 -0.81 -0.17 0.00 0.00 175.17 175.94 1xnf n PRO 127 N 4.77 0.02 -0.11 4.34 -0.05 -0.34 -2.17 135.00 141.45 1xnf n PRO 127 Ca 0.07 0.47 0.11 0.00 -0.05 0.00 0.00 63.50 64.11 1xnf n PRO 127 Cb 0.51 -1.57 0.29 0.00 -0.05 0.00 0.00 33.50 32.68 1xnf n PRO 127 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 175.50 175.70 1xnf n THR 128 N -1.62 0.30 -2.41 0.52 -2.24 -1.26 -4.68 114.28 102.90 1xnf n THR 128 Ca 0.00 -0.52 -0.43 0.00 -2.27 0.00 0.00 64.05 60.84 1xnf n THR 128 Cb 0.04 0.72 0.00 0.00 -2.10 0.00 0.00 70.33 68.99 1xnf n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xnf n TYR 129 N 0.88 3.76 -0.22 4.78 4.19 -0.92 -4.83 117.16 124.80 1xnf n TYR 129 Ca 0.17 -2.97 0.06 0.00 3.31 0.00 0.00 57.90 58.47 1xnf n TYR 129 Cb 0.47 -2.20 0.13 0.00 0.49 0.00 0.00 39.34 38.22 1xnf n TYR 129 CO 0.00 0.00 0.00 0.09 0.91 0.00 0.00 176.86 177.86 1xnf n ASN 130 N 5.23 -0.17 0.31 2.98 5.03 -1.26 -1.76 115.26 125.63 1xnf n ASN 130 Ca 0.42 1.07 0.19 0.00 0.87 0.00 0.00 54.58 57.13 1xnf n ASN 130 Cb 0.39 -0.35 1.06 0.00 -1.02 0.00 0.00 39.78 39.86 1xnf n ASN 130 CO 0.00 0.00 0.00 1.88 -1.83 0.00 0.00 177.26 177.31 1xnf h TYR 131 N 0.00 0.00 0.00 3.10 -1.99 -2.00 -0.04 116.97 116.04 1xnf h TYR 131 Ca 0.33 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 61.01 1xnf h TYR 131 Cb 0.58 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.31 1xnf h TYR 131 CO -0.42 0.00 -0.23 0.00 -0.00 0.00 0.00 178.16 177.51 1xnf h ALA 132 N 1.97 1.54 -0.23 3.88 0.00 -1.74 0.16 119.26 124.84 1xnf h ALA 132 Ca 0.00 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 1xnf h ALA 132 Cb 0.04 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1xnf h ALA 132 CO -0.00 0.29 -0.05 0.45 0.00 0.00 0.00 179.25 179.94 1xnf h HIS 133 N 0.00 0.50 0.06 0.00 3.86 -1.20 0.20 115.15 118.57 1xnf h HIS 133 Ca -0.00 -0.10 0.01 0.00 -1.16 0.00 0.00 60.37 59.12 1xnf h HIS 133 Cb 0.43 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 28.75 1xnf h HIS 133 CO 0.00 0.67 -0.13 1.25 0.86 0.00 0.00 177.93 180.58 1xnf h LEU 134 N 0.18 -0.36 -0.45 2.43 5.85 -1.36 0.29 115.31 121.90 1xnf h LEU 134 Ca 0.06 0.05 -0.18 0.00 0.84 0.00 0.00 57.88 58.65 1xnf h LEU 134 Cb 0.50 0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.67 1xnf h LEU 134 CO 0.02 -0.19 -0.69 0.78 -0.34 0.00 0.00 178.44 178.03 1xnf h ASN 135 N -0.25 0.49 -0.01 1.25 -0.26 -0.71 -1.28 115.58 114.81 1xnf h ASN 135 Ca 0.03 -0.30 -0.15 0.00 -0.56 0.00 0.00 56.30 55.31 1xnf h ASN 135 Cb 0.27 -0.14 -0.01 0.00 -1.06 0.00 0.00 38.32 37.38 1xnf h ASN 135 CO -0.08 1.03 -0.48 -0.09 -1.06 0.00 0.00 177.43 176.75 1xnf h ARG 136 N 0.29 0.57 -0.56 0.81 2.43 -0.53 -1.81 114.38 115.58 1xnf h ARG 136 Ca -0.02 -0.32 0.05 0.00 -0.81 0.00 0.00 59.98 58.87 1xnf h ARG 136 Cb 1.25 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.78 1xnf h ARG 136 CO 0.12 0.92 0.30 0.78 -1.51 0.00 0.00 179.97 180.58 1xnf h GLY 137 N 1.05 0.79 0.93 2.80 0.00 -0.63 0.63 103.07 108.65 1xnf h GLY 137 Ca 0.02 -0.21 -0.03 0.00 0.00 0.00 0.00 47.33 47.12 1xnf h GLY 137 CO 0.09 0.14 0.11 -2.22 0.00 0.00 0.00 176.54 174.66 1xnf h ILE 138 N 0.57 1.21 -0.67 2.60 2.04 -1.09 -0.49 117.51 121.68 1xnf h ILE 138 Ca 0.24 -0.71 0.02 0.00 1.00 0.00 0.00 64.86 65.41 1xnf h ILE 138 Cb 0.13 0.97 -0.04 0.00 -0.74 0.00 0.00 36.82 37.15 1xnf h ILE 138 CO -0.16 0.25 0.44 0.00 0.00 0.00 0.00 178.15 178.67 1xnf h ALA 139 N 0.96 0.87 -0.46 1.87 0.00 -1.01 -0.79 119.26 120.69 1xnf h ALA 139 Ca 0.12 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 1xnf h ALA 139 Cb 0.26 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1xnf h ALA 139 CO -0.00 0.24 -0.02 -0.07 0.00 0.00 0.00 179.25 179.39 1xnf h LEU 140 N 0.87 0.75 0.23 0.00 -0.00 -0.62 0.17 115.31 116.72 1xnf h LEU 140 Ca 0.26 -0.19 -0.01 0.00 -0.00 0.00 0.00 57.88 57.94 1xnf h LEU 140 Cb -0.05 -0.20 -0.00 0.00 -0.00 0.00 0.00 40.66 40.41 1xnf h LEU 140 CO -0.08 0.83 -0.14 0.22 -0.00 0.00 0.00 178.44 179.28 1xnf h TYR 141 N 0.72 -0.35 0.00 1.13 3.20 -0.44 0.19 116.97 121.41 1xnf h TYR 141 Ca 0.14 -0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.91 1xnf h TYR 141 Cb 0.48 0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.86 1xnf h TYR 141 CO 0.02 -0.22 -0.45 1.88 -1.64 0.00 0.00 178.16 177.76 1xnf h TYR 142 N -0.35 0.00 0.00 -3.82 -1.99 -0.90 -1.31 116.97 108.60 1xnf h TYR 142 Ca -0.02 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.71 1xnf h TYR 142 Cb 0.29 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.02 1xnf h TYR 142 CO -0.08 0.45 0.00 0.41 -0.00 0.00 0.00 178.16 178.94 1xnf n GLY 143 N -0.14 -0.70 2.14 3.88 0.00 0.59 -4.91 105.19 106.04 1xnf n GLY 143 Ca -0.01 -0.08 -0.02 0.00 0.00 0.00 0.00 46.02 45.90 1xnf n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xnf n GLY 144 N 0.33 0.53 2.75 -0.02 0.00 -0.49 -4.94 105.19 103.34 1xnf n GLY 144 Ca 0.10 -0.43 -0.36 0.00 0.00 0.00 0.00 46.02 45.33 1xnf n GLY 144 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xnf n ARG 145 N -2.59 3.74 -0.23 1.61 1.74 0.55 -4.90 116.66 116.58 1xnf n ARG 145 Ca -0.02 -4.63 -0.06 0.00 -0.77 0.00 0.00 57.85 52.38 1xnf n ARG 145 Cb 0.10 -2.40 0.04 0.00 -1.02 0.00 0.00 32.46 29.19 1xnf n ARG 145 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1xnf h ASP 146 N 4.74 0.79 -0.23 0.55 5.19 -1.88 -1.44 116.42 124.14 1xnf h ASP 146 Ca 0.22 -0.07 -0.01 0.00 -0.62 0.00 0.00 57.03 56.55 1xnf h ASP 146 Cb 0.61 -0.20 -0.01 0.00 0.18 0.00 0.00 39.33 39.91 1xnf h ASP 146 CO 1.11 0.62 0.10 0.11 -3.12 0.00 0.00 179.24 178.06 1xnf h LYS 147 N 0.89 0.34 -0.29 3.56 1.57 -1.90 -1.38 116.57 119.36 1xnf h LYS 147 Ca 0.23 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 58.90 1xnf h LYS 147 Cb -0.01 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.22 1xnf h LYS 147 CO -0.04 0.38 -0.04 -0.07 -0.57 0.00 0.00 179.45 179.10 1xnf h LEU 148 N 0.22 0.42 -0.61 2.94 3.38 -1.90 -2.37 115.31 117.39 1xnf h LEU 148 Ca 0.08 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1xnf h LEU 148 Cb 0.16 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 1xnf h LEU 148 CO -0.01 0.52 0.28 0.00 0.09 0.00 0.00 178.44 179.32 1xnf h ALA 149 N 1.53 0.79 -0.90 1.53 0.00 -0.74 -2.44 119.26 119.04 1xnf h ALA 149 Ca 0.09 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1xnf h ALA 149 Cb 0.35 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 1xnf h ALA 149 CO 0.01 0.38 0.57 1.96 0.00 0.00 0.00 179.25 182.17 1xnf h GLN 150 N 0.85 1.20 -0.39 0.00 4.20 -0.78 0.20 115.11 120.38 1xnf h GLN 150 Ca 0.21 -0.09 0.03 0.00 0.06 0.00 0.00 58.65 58.86 1xnf h GLN 150 Cb 0.15 -0.26 -0.03 0.00 0.30 0.00 0.00 27.48 27.63 1xnf h GLN 150 CO -0.02 0.81 0.19 -0.44 -0.67 0.00 0.00 178.83 178.70 1xnf h ASP 151 N 1.22 0.28 -0.38 1.46 3.32 -0.99 0.42 116.42 121.76 1xnf h ASP 151 Ca 0.33 0.02 -0.13 0.00 0.02 0.00 0.00 57.03 57.27 1xnf h ASP 151 Cb -0.10 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 1xnf h ASP 151 CO -0.07 0.21 -0.25 0.44 -1.72 0.00 0.00 179.24 177.85 1xnf h ASP 152 N 0.40 0.88 0.63 6.45 3.32 -1.05 -1.76 116.42 125.28 1xnf h ASP 152 Ca 0.17 -0.43 -0.14 0.00 0.02 0.00 0.00 57.03 56.65 1xnf h ASP 152 Cb 0.08 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.36 1xnf h ASP 152 CO -0.12 1.12 -0.65 -0.07 -1.72 0.00 0.00 179.24 177.80 1xnf h LEU 153 N 0.65 0.02 -0.23 1.55 3.38 -0.40 -0.71 115.31 119.57 1xnf h LEU 153 Ca 0.08 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 1xnf h LEU 153 Cb 0.82 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 1xnf h LEU 153 CO 0.07 0.67 -0.02 0.25 0.09 0.00 0.00 178.44 179.50 1xnf h LEU 154 N 0.01 0.41 -0.64 1.67 5.85 -0.18 0.14 115.31 122.58 1xnf h LEU 154 Ca -0.01 -0.33 0.06 0.00 0.84 0.00 0.00 57.88 58.44 1xnf h LEU 154 Cb 1.15 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 42.02 1xnf h LEU 154 CO 0.09 0.64 0.35 0.00 -0.34 0.00 0.00 178.44 179.17 1xnf h ALA 155 N 0.78 0.85 -0.31 1.25 0.00 -0.93 0.20 119.26 121.11 1xnf h ALA 155 Ca 0.06 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1xnf h ALA 155 Cb 0.44 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1xnf h ALA 155 CO 0.01 0.01 0.08 0.35 0.00 0.00 0.00 179.25 179.71 1xnf h PHE 156 N 0.64 0.51 -0.64 0.00 3.57 -1.06 -2.90 116.94 117.06 1xnf h PHE 156 Ca 0.29 -0.06 0.10 0.00 3.53 0.00 0.00 57.97 61.83 1xnf h PHE 156 Cb 0.18 -0.14 -0.08 0.00 2.79 0.00 0.00 35.95 38.70 1xnf h PHE 156 CO -0.09 0.54 0.24 -0.92 -2.23 0.00 0.00 178.31 175.85 1xnf h TYR 157 N 0.33 0.41 0.00 0.41 3.20 -0.06 -2.11 116.97 119.15 1xnf h TYR 157 Ca 0.10 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.99 1xnf h TYR 157 Cb 0.28 -0.09 -0.00 0.00 1.54 0.00 0.00 36.73 38.46 1xnf h TYR 157 CO 0.01 0.09 -0.02 1.96 -1.64 0.00 0.00 178.16 178.56 1xnf h GLN 158 N 0.41 0.00 0.00 1.82 4.20 -0.77 -0.11 115.11 120.66 1xnf h GLN 158 Ca 0.33 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 59.02 1xnf h GLN 158 Cb 0.43 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.20 1xnf h GLN 158 CO -0.33 0.02 -0.06 -0.44 -0.67 0.00 0.00 178.83 177.35 1xnf h ASP 159 N 0.00 0.00 -0.93 1.46 3.32 -1.33 -3.40 116.42 115.54 1xnf h ASP 159 Ca -0.00 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.92 1xnf h ASP 159 Cb 0.05 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 39.44 1xnf h ASP 159 CO 0.00 0.06 -0.46 -0.62 -1.72 0.00 0.00 179.24 176.51 1xnf s ASP 160 N -6.11 -1.36 0.21 6.45 -1.08 -0.12 -5.01 116.67 109.64 1xnf s ASP 160 Ca 0.05 -1.55 0.21 0.00 -0.52 0.00 0.00 52.55 50.74 1xnf s ASP 160 Cb 0.07 1.77 0.90 0.00 -1.46 0.00 0.00 42.92 44.19 1xnf s ASP 160 CO 0.65 -0.06 1.63 -2.65 0.52 0.00 0.00 175.17 175.26 1xnf n PRO 161 N 3.02 0.14 0.00 4.34 -0.02 -0.78 -1.81 135.00 139.91 1xnf n PRO 161 Ca 0.17 0.42 0.14 0.00 -2.02 0.00 0.00 63.50 62.21 1xnf n PRO 161 Cb 0.57 -1.80 0.67 0.00 -0.02 0.00 0.00 33.50 32.93 1xnf n PRO 161 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1xnf n ASN 162 N -2.07 0.16 -4.49 2.55 3.02 -1.26 -4.70 115.26 108.46 1xnf n ASN 162 Ca 0.02 -0.18 -0.43 0.00 -0.03 0.00 0.00 54.58 53.95 1xnf n ASN 162 Cb 0.19 -0.23 -0.05 0.00 -0.61 0.00 0.00 39.78 39.08 1xnf n ASN 162 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1xnf s ASP 163 N -2.62 6.29 0.54 6.41 -1.08 -0.75 -4.68 116.67 120.77 1xnf s ASP 163 Ca 0.26 -0.57 0.20 0.00 -0.52 0.00 0.00 52.55 51.91 1xnf s ASP 163 Cb 0.20 -2.40 1.39 0.00 -1.46 0.00 0.00 42.92 40.65 1xnf s ASP 163 CO 0.49 -1.16 2.15 1.55 0.52 0.00 0.00 175.17 178.72 1xnf h PRO 164 N 9.25 0.00 0.00 4.34 0.13 -1.88 -0.36 132.00 143.48 1xnf h PRO 164 Ca -0.27 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.80 1xnf h PRO 164 Cb 1.08 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 1xnf h PRO 164 CO 1.07 0.00 -0.30 0.74 -0.23 0.00 0.00 178.00 179.28 1xnf h PHE 165 N 0.00 0.00 -0.21 1.56 -1.00 -1.91 -0.83 116.94 114.55 1xnf h PHE 165 Ca 0.03 0.00 -0.12 0.00 2.81 0.00 0.00 57.97 60.68 1xnf h PHE 165 Cb 0.11 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.66 1xnf h PHE 165 CO 0.00 0.30 -0.39 0.00 -1.61 0.00 0.00 178.31 176.61 1xnf h ARG 166 N 0.00 0.48 -0.14 1.51 3.08 -1.39 -1.65 114.38 116.26 1xnf h ARG 166 Ca -0.00 -0.23 -0.15 0.00 0.07 0.00 0.00 59.98 59.67 1xnf h ARG 166 Cb 0.56 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.60 1xnf h ARG 166 CO 0.04 0.79 -0.55 0.77 -1.07 0.00 0.00 179.97 179.95 1xnf h SER 167 N 0.40 0.47 -0.40 7.04 0.02 -1.47 -2.12 113.55 117.50 1xnf h SER 167 Ca 0.04 -0.25 -0.08 0.00 -0.84 0.00 0.00 61.79 60.65 1xnf h SER 167 Cb 0.86 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.25 1xnf h SER 167 CO 0.07 0.93 -0.08 -0.07 -1.14 0.00 0.00 176.83 176.54 1xnf h LEU 168 N 0.33 0.76 -0.66 5.07 3.38 -1.00 0.05 115.31 123.23 1xnf h LEU 168 Ca 0.01 -0.36 -0.13 0.00 0.09 0.00 0.00 57.88 57.49 1xnf h LEU 168 Cb 1.06 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 1xnf h LEU 168 CO 0.10 0.94 -0.40 -0.50 0.09 0.00 0.00 178.44 178.66 1xnf h TRP 169 N 0.57 0.69 -0.73 1.13 4.06 -1.28 -0.35 115.95 120.04 1xnf h TRP 169 Ca 0.10 -0.20 -0.06 0.00 2.06 0.00 0.00 58.89 60.79 1xnf h TRP 169 Cb 0.60 -0.15 -0.03 0.00 -1.00 0.00 0.00 29.16 28.58 1xnf h TRP 169 CO 0.05 0.89 0.23 1.25 -3.56 0.00 0.00 178.44 177.30 1xnf h LEU 170 N 0.48 1.05 -0.60 -4.49 5.85 -1.18 -1.85 115.31 114.58 1xnf h LEU 170 Ca 0.04 -0.20 -0.02 0.00 0.84 0.00 0.00 57.88 58.55 1xnf h LEU 170 Cb 0.90 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.63 1xnf h LEU 170 CO 0.08 0.98 0.30 0.22 -0.34 0.00 0.00 178.44 179.67 1xnf h TYR 171 N 1.08 0.85 -0.64 1.25 3.20 -0.63 -1.72 116.97 120.36 1xnf h TYR 171 Ca 0.24 -0.04 -0.04 0.00 3.14 0.00 0.00 58.73 62.03 1xnf h TYR 171 Cb 0.30 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.28 1xnf h TYR 171 CO 0.02 0.64 0.23 -0.07 -1.64 0.00 0.00 178.16 177.35 1xnf h LEU 172 N 0.81 0.90 -1.40 2.82 -0.00 -0.66 0.56 115.31 118.35 1xnf h LEU 172 Ca 0.21 -0.19 -0.04 0.00 -0.00 0.00 0.00 57.88 57.86 1xnf h LEU 172 Cb 0.10 -0.23 -0.01 0.00 -0.00 0.00 0.00 40.66 40.52 1xnf h LEU 172 CO -0.03 0.84 -0.18 0.00 -0.00 0.00 0.00 178.44 179.07 1xnf h ALA 173 N 1.09 1.09 0.00 1.53 0.00 -0.98 -3.14 119.26 118.85 1xnf h ALA 173 Ca 0.21 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 1xnf h ALA 173 Cb 0.24 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1xnf h ALA 173 CO -0.01 0.23 -1.44 0.39 0.00 0.00 0.00 179.25 178.41 1xnf n GLU 174 N -3.45 0.63 0.27 0.00 1.02 -0.68 -4.53 120.64 113.90 1xnf n GLU 174 Ca -0.00 0.13 0.17 0.00 -0.02 0.00 0.00 57.16 57.43 1xnf n GLU 174 Cb 0.36 -1.76 0.70 0.00 -0.02 0.00 0.00 31.44 30.72 1xnf n GLU 174 CO 0.00 0.00 0.00 -0.56 1.18 0.00 0.00 177.13 177.75 1xnf h GLN 175 N 0.00 0.00 0.08 3.49 -0.00 -0.86 -2.08 115.11 115.73 1xnf h GLN 175 Ca -0.13 0.00 -0.27 0.00 -0.00 0.00 0.00 58.65 58.25 1xnf h GLN 175 Cb 1.40 0.00 0.02 0.00 -0.00 0.00 0.00 27.48 28.90 1xnf h GLN 175 CO 0.03 0.00 -1.15 0.87 -0.00 0.00 0.00 178.83 178.58 1xnf h LYS 176 N 0.00 0.53 -0.18 0.06 1.57 -1.80 -3.19 116.57 113.57 1xnf h LYS 176 Ca 0.00 -0.68 -0.10 0.00 -1.87 0.00 0.00 60.65 57.99 1xnf h LYS 176 Cb 0.47 0.22 -0.00 0.00 0.08 0.00 0.00 32.23 33.00 1xnf h LYS 176 CO 0.00 1.29 -0.30 -0.07 -0.57 0.00 0.00 179.45 179.80 1xnf h LEU 177 N 0.25 0.57 -5.61 2.94 3.38 -1.81 -3.43 115.31 111.60 1xnf h LEU 177 Ca -0.15 -0.53 -0.11 0.00 0.09 0.00 0.00 57.88 57.18 1xnf h LEU 177 Cb 1.82 -0.16 -0.18 0.00 0.09 0.00 0.00 40.66 42.22 1xnf h LEU 177 CO 0.21 0.99 -0.48 -0.62 0.09 0.00 0.00 178.44 178.63 1xnf s ASP 178 N -6.43 -1.38 0.23 -0.43 -1.08 -0.80 -5.03 116.67 101.75 1xnf s ASP 178 Ca -0.13 -1.22 -0.05 0.00 -0.52 0.00 0.00 52.55 50.62 1xnf s ASP 178 Cb 0.06 1.87 0.23 0.00 -1.46 0.00 0.00 42.92 43.62 1xnf s ASP 178 CO 0.80 -0.12 1.76 -0.08 0.52 0.00 0.00 175.17 178.05 1xnf h GLU 179 N 6.18 1.02 0.18 4.34 4.81 -1.73 0.64 114.58 130.02 1xnf h GLU 179 Ca 0.06 -0.23 -0.00 0.00 -0.13 0.00 0.00 59.36 59.05 1xnf h GLU 179 Cb 1.14 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 30.38 1xnf h GLU 179 CO 0.07 0.91 -0.12 0.87 -0.73 0.00 0.00 179.01 180.01 1xnf h LYS 180 N 0.98 -0.29 -0.42 1.92 1.57 -1.94 -0.89 116.57 117.51 1xnf h LYS 180 Ca 0.21 0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.96 1xnf h LYS 180 Cb 0.34 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.70 1xnf h LYS 180 CO 0.00 -0.19 0.09 0.37 -0.57 0.00 0.00 179.45 179.15 1xnf h GLN 181 N -0.30 0.68 -0.81 3.15 5.75 -1.83 -1.92 115.11 119.83 1xnf h GLN 181 Ca -0.01 -0.17 0.20 0.00 -0.15 0.00 0.00 58.65 58.51 1xnf h GLN 181 Cb 0.25 -0.08 -0.13 0.00 1.07 0.00 0.00 27.48 28.58 1xnf h GLN 181 CO 0.01 0.70 0.10 0.00 -2.65 0.00 0.00 178.83 177.00 1xnf h ALA 182 N 0.95 0.99 -0.12 3.38 0.00 -0.72 0.10 119.26 123.82 1xnf h ALA 182 Ca 0.13 0.23 -0.17 0.00 0.00 0.00 0.00 54.91 55.10 1xnf h ALA 182 Cb 0.34 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1xnf h ALA 182 CO 0.00 -0.43 -0.63 0.87 0.00 0.00 0.00 179.25 179.06 1xnf h LYS 183 N 0.15 0.45 -0.73 0.00 1.57 -0.84 0.31 116.57 117.48 1xnf h LYS 183 Ca 0.47 -0.32 -0.03 0.00 -1.87 0.00 0.00 60.65 58.90 1xnf h LYS 183 Cb 0.88 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 33.20 1xnf h LYS 183 CO -0.66 0.93 0.34 1.49 -0.57 0.00 0.00 179.45 180.98 1xnf h GLU 184 N 0.33 1.07 -0.41 3.15 4.22 -0.54 0.36 114.58 122.76 1xnf h GLU 184 Ca -0.01 -0.17 -0.09 0.00 0.08 0.00 0.00 59.36 59.17 1xnf h GLU 184 Cb 1.18 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 30.23 1xnf h GLU 184 CO 0.11 0.85 -0.10 0.28 -2.18 0.00 0.00 179.01 177.96 1xnf h VAL 185 N 1.04 1.27 -0.66 0.32 2.07 -0.77 -1.40 116.25 118.12 1xnf h VAL 185 Ca 0.25 -1.20 -0.07 0.00 0.82 0.00 0.00 66.70 66.51 1xnf h VAL 185 Cb 0.14 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.10 1xnf h VAL 185 CO -0.03 0.40 0.16 0.25 0.02 0.00 0.00 177.57 178.37 1xnf h LEU 186 N 0.60 1.00 -0.50 2.57 6.46 -0.73 0.14 115.31 124.85 1xnf h LEU 186 Ca 0.10 -0.23 0.04 0.00 -0.12 0.00 0.00 57.88 57.67 1xnf h LEU 186 Cb 0.63 -0.26 -0.04 0.00 -0.73 0.00 0.00 40.66 40.25 1xnf h LEU 186 CO 0.04 0.98 0.27 0.50 -0.62 0.00 0.00 178.44 179.61 1xnf h LYS 187 N 0.98 0.51 -0.64 1.25 3.64 -0.70 0.42 116.57 122.03 1xnf h LYS 187 Ca 0.21 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.51 1xnf h LYS 187 Cb 0.37 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.04 1xnf h LYS 187 CO 0.00 0.34 0.22 1.96 -2.27 0.00 0.00 179.45 179.70 1xnf h GLN 188 N 0.53 0.99 -0.67 1.90 4.20 -0.47 -0.58 115.11 121.00 1xnf h GLN 188 Ca 0.22 -0.20 -0.06 0.00 0.06 0.00 0.00 58.65 58.66 1xnf h GLN 188 Cb 0.10 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 27.70 1xnf h GLN 188 CO -0.14 0.86 0.18 0.45 -0.67 0.00 0.00 178.83 179.51 1xnf h HIS 189 N 0.92 1.12 -0.41 2.96 3.86 -0.19 -1.14 115.15 122.27 1xnf h HIS 189 Ca 0.21 -0.13 -0.01 0.00 -1.16 0.00 0.00 60.37 59.28 1xnf h HIS 189 Cb 0.27 -0.32 -0.02 0.00 1.06 0.00 0.00 27.41 28.41 1xnf h HIS 189 CO 0.02 0.91 0.20 0.35 0.86 0.00 0.00 177.93 180.27 1xnf h PHE 190 N 1.00 0.58 -0.18 2.45 3.57 -0.62 -2.01 116.94 121.72 1xnf h PHE 190 Ca 0.21 -0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.58 1xnf h PHE 190 Cb 0.35 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.89 1xnf h PHE 190 CO 0.03 0.47 -0.36 0.93 -2.23 0.00 0.00 178.31 177.14 1xnf h GLU 191 N 0.52 0.40 -0.01 1.11 4.39 -0.70 -1.98 114.58 118.31 1xnf h GLU 191 Ca 0.14 -0.18 -0.14 0.00 0.34 0.00 0.00 59.36 59.52 1xnf h GLU 191 Cb 0.10 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.73 1xnf h GLU 191 CO -0.02 0.71 -0.68 -0.22 -1.16 0.00 0.00 179.01 177.64 1xnf h LYS 192 N 0.34 0.03 -7.35 2.33 3.64 -1.12 -3.46 116.57 110.97 1xnf h LYS 192 Ca 0.04 -0.02 -0.48 0.00 -1.27 0.00 0.00 60.65 58.92 1xnf h LYS 192 Cb 0.80 0.00 0.15 0.00 -0.41 0.00 0.00 32.23 32.77 1xnf h LYS 192 CO 0.06 0.69 0.24 -1.54 -2.27 0.00 0.00 179.45 176.64 1xnf s SER 193 N -6.84 3.36 0.00 4.20 1.04 -0.75 -4.93 113.70 109.79 1xnf s SER 193 Ca -0.01 1.41 0.25 0.00 0.48 0.00 0.00 55.95 58.08 1xnf s SER 193 Cb 0.12 -2.08 1.24 0.00 0.10 0.00 0.00 66.02 65.40 1xnf s SER 193 CO 0.78 -2.70 1.85 -0.90 0.98 0.00 0.00 173.24 173.24 1xnf n ASP 194 N -3.91 0.00 -1.51 7.02 5.68 -1.26 -4.92 116.55 117.65 1xnf n ASP 194 Ca 0.07 0.04 -0.19 0.00 -0.50 0.00 0.00 54.79 54.20 1xnf n ASP 194 Cb 0.56 -0.33 -0.07 0.00 -1.14 0.00 0.00 41.12 40.13 1xnf n ASP 194 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1xnf n LYS 195 N -1.33 -1.33 0.01 0.11 5.02 -1.26 -4.86 118.16 114.52 1xnf n LYS 195 Ca 0.11 1.14 -0.21 0.00 -2.02 0.00 0.00 58.31 57.34 1xnf n LYS 195 Cb 0.22 -5.46 -0.14 0.00 -0.02 0.00 0.00 35.03 29.63 1xnf n LYS 195 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1xnf n GLU 196 N -2.48 0.75 -2.55 1.97 -0.58 -1.26 -4.89 120.64 111.60 1xnf n GLU 196 Ca -0.19 0.27 -0.37 0.00 -0.42 0.00 0.00 57.16 56.44 1xnf n GLU 196 Cb 0.62 -1.72 -0.04 0.00 -0.57 0.00 0.00 31.44 29.73 1xnf n GLU 196 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 1xnf s GLN 197 N -2.56 4.29 0.44 3.49 -0.21 -1.26 -4.91 119.66 118.94 1xnf s GLN 197 Ca -0.21 1.55 0.12 0.00 0.02 0.00 0.00 55.36 56.84 1xnf s GLN 197 Cb 0.07 -2.69 1.01 0.00 1.00 0.00 0.00 33.01 32.39 1xnf s GLN 197 CO 0.78 -0.04 2.02 2.35 -2.12 0.00 0.00 175.29 178.28 1xnf h TRP 198 N 2.82 0.41 0.00 0.91 7.01 -1.97 -2.42 115.95 122.70 1xnf h TRP 198 Ca -0.48 0.01 0.00 0.00 2.11 0.00 0.00 58.89 60.53 1xnf h TRP 198 Cb 1.21 -0.13 0.00 0.00 -2.10 0.00 0.00 29.16 28.14 1xnf h TRP 198 CO 0.58 0.22 0.00 0.41 -2.79 0.00 0.00 178.44 176.86 1xnf n GLY 199 N -1.51 -1.09 0.29 2.65 0.00 -1.26 -0.67 105.19 103.60 1xnf n GLY 199 Ca 0.06 0.13 0.15 0.00 0.00 0.00 0.00 46.02 46.36 1xnf n GLY 199 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1xnf h TRP 200 N 0.00 0.00 -0.90 1.61 4.06 -1.79 -1.37 115.95 117.55 1xnf h TRP 200 Ca 0.00 0.00 0.05 0.00 2.06 0.00 0.00 58.89 61.00 1xnf h TRP 200 Cb 0.21 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.31 1xnf h TRP 200 CO 0.00 0.03 0.59 -0.91 -3.56 0.00 0.00 178.44 174.59 1xnf h ASN 201 N 0.00 0.95 -0.58 -3.49 2.35 -1.12 0.16 115.58 113.85 1xnf h ASN 201 Ca -0.00 -0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.64 1xnf h ASN 201 Cb 0.09 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.23 1xnf h ASN 201 CO 0.00 0.63 -0.06 0.40 -1.65 0.00 0.00 177.43 176.76 1xnf h ILE 202 N 1.09 1.27 -0.42 2.81 2.04 -1.44 -1.75 117.51 121.11 1xnf h ILE 202 Ca 0.37 -1.22 0.03 0.00 1.00 0.00 0.00 64.86 65.04 1xnf h ILE 202 Cb 0.09 0.89 -0.04 0.00 -0.74 0.00 0.00 36.82 37.02 1xnf h ILE 202 CO -0.12 0.44 0.21 0.58 0.00 0.00 0.00 178.15 179.26 1xnf h VAL 203 N 0.95 0.98 -0.29 1.67 2.07 -1.16 -0.82 116.25 119.64 1xnf h VAL 203 Ca 0.16 -0.15 -0.05 0.00 0.82 0.00 0.00 66.70 67.48 1xnf h VAL 203 Cb 0.63 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 1xnf h VAL 203 CO 0.04 0.08 -0.05 -0.33 0.02 0.00 0.00 177.57 177.33 1xnf h GLU 204 N 0.43 0.46 -0.33 1.57 5.08 -0.32 -0.97 114.58 120.51 1xnf h GLU 204 Ca 0.18 -0.11 -0.04 0.00 -1.00 0.00 0.00 59.36 58.39 1xnf h GLU 204 Cb 0.08 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1xnf h GLU 204 CO -0.12 0.53 0.04 0.35 -1.00 0.00 0.00 179.01 178.80 1xnf h PHE 205 N 0.44 0.59 -0.51 4.33 3.57 -0.69 -1.27 116.94 123.40 1xnf h PHE 205 Ca 0.09 -0.09 0.05 0.00 3.53 0.00 0.00 57.97 61.56 1xnf h PHE 205 Cb 0.37 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 38.92 1xnf h PHE 205 CO 0.01 0.64 0.34 1.88 -2.23 0.00 0.00 178.31 178.95 1xnf h TYR 206 N 0.37 0.48 0.00 0.41 -1.99 -0.30 -1.63 116.97 114.31 1xnf h TYR 206 Ca 0.10 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.84 1xnf h TYR 206 Cb 0.38 -0.16 0.00 0.00 2.00 0.00 0.00 36.73 38.95 1xnf h TYR 206 CO 0.03 0.27 0.00 1.28 -0.00 0.00 0.00 178.16 179.73 1xnf n LEU 207 N -4.47 0.22 0.00 3.88 4.77 -0.45 -4.91 117.00 116.04 1xnf n LEU 207 Ca 0.07 0.52 0.00 0.00 -0.03 0.00 0.00 56.01 56.57 1xnf n LEU 207 Cb 0.22 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.86 1xnf n LEU 207 CO 0.34 -0.07 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 1xnf n GLY 208 N 1.32 0.50 0.12 -0.72 0.00 -0.61 -4.96 105.19 100.84 1xnf n GLY 208 Ca 0.06 -0.42 -0.06 0.00 0.00 0.00 0.00 46.02 45.61 1xnf n GLY 208 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1xnf h ASN 209 N 0.00 0.13 -4.23 1.61 2.35 -1.46 -3.46 115.58 110.51 1xnf h ASN 209 Ca 0.00 -0.10 -0.40 0.00 -0.55 0.00 0.00 56.30 55.25 1xnf h ASN 209 Cb 0.00 -0.04 -0.19 0.00 0.05 0.00 0.00 38.32 38.14 1xnf h ASN 209 CO 0.00 0.88 -0.76 0.27 -1.65 0.00 0.00 177.43 176.17 1xnf s ILE 210 N -3.24 1.22 0.84 2.81 -4.36 -1.24 -5.02 121.20 112.20 1xnf s ILE 210 Ca -0.02 -1.57 -0.12 0.00 -0.26 0.00 0.00 60.65 58.69 1xnf s ILE 210 Cb 0.11 -1.36 0.09 0.00 1.25 0.00 0.00 42.46 42.55 1xnf s ILE 210 CO 0.81 -0.37 1.10 -0.94 0.24 0.00 0.00 174.94 175.78 1xnf s SER 211 N -2.21 4.09 0.28 4.36 1.04 -1.26 -4.58 113.70 115.42 1xnf s SER 211 Ca 0.05 1.33 0.01 0.00 0.48 0.00 0.00 55.95 57.82 1xnf s SER 211 Cb -0.06 -2.04 0.42 0.00 0.10 0.00 0.00 66.02 64.44 1xnf s SER 211 CO 0.02 -2.23 1.77 -0.08 0.98 0.00 0.00 173.24 173.70 1xnf h GLU 212 N -1.27 0.61 -0.71 4.02 4.81 -1.99 -1.84 114.58 118.21 1xnf h GLU 212 Ca -0.48 -0.18 0.03 0.00 -0.13 0.00 0.00 59.36 58.60 1xnf h GLU 212 Cb 1.28 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 30.55 1xnf h GLU 212 CO 0.58 0.71 0.44 0.37 -0.73 0.00 0.00 179.01 180.38 1xnf h GLN 213 N 0.56 0.84 -0.76 1.92 4.15 -2.06 -2.02 115.11 117.75 1xnf h GLN 213 Ca 0.10 -0.05 -0.06 0.00 0.77 0.00 0.00 58.65 59.42 1xnf h GLN 213 Cb 0.51 -0.19 -0.03 0.00 0.21 0.00 0.00 27.48 27.98 1xnf h GLN 213 CO 0.03 0.55 0.26 1.15 -1.93 0.00 0.00 178.83 178.89 1xnf h THR 214 N 0.86 1.26 0.00 2.39 2.02 -1.79 -0.97 112.91 116.68 1xnf h THR 214 Ca 0.29 -0.88 0.00 0.00 0.77 0.00 0.00 66.41 66.58 1xnf h THR 214 Cb 0.03 0.40 0.00 0.00 -1.74 0.00 0.00 68.15 66.84 1xnf h THR 214 CO -0.11 0.35 0.00 -0.11 0.37 0.00 0.00 175.52 176.02 1xnf n LEU 215 N -4.27 0.30 0.00 2.58 7.94 -0.74 -1.29 117.00 121.52 1xnf n LEU 215 Ca 0.06 -0.15 0.00 0.00 -1.11 0.00 0.00 56.01 54.81 1xnf n LEU 215 Cb 0.22 -0.10 0.00 0.00 0.53 0.00 0.00 43.42 44.07 1xnf n LEU 215 CO 0.41 0.06 0.00 -0.62 -1.11 0.00 0.00 177.39 176.14 1xnf n GLU 217 N 0.55 0.00 0.10 1.96 1.02 -0.37 -1.30 120.64 122.60 1xnf n GLU 217 Ca 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 57.16 57.15 1xnf n GLU 217 Cb 0.06 0.00 0.34 0.00 -0.02 0.00 0.00 31.44 31.82 1xnf n GLU 217 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xnf h ARG 218 N 0.00 0.28 -0.15 3.49 3.08 -1.45 -0.96 114.38 118.67 1xnf h ARG 218 Ca 0.00 -0.08 -0.07 0.00 0.07 0.00 0.00 59.98 59.91 1xnf h ARG 218 Cb 0.00 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.02 1xnf h ARG 218 CO 0.00 0.45 -0.16 1.25 -1.07 0.00 0.00 179.97 180.44 1xnf h LEU 219 N 0.26 0.40 -0.86 3.04 7.12 -1.45 -1.97 115.31 121.85 1xnf h LEU 219 Ca 0.05 -0.49 -0.08 0.00 0.13 0.00 0.00 57.88 57.49 1xnf h LEU 219 Cb 0.46 -0.11 -0.02 0.00 -0.53 0.00 0.00 40.66 40.45 1xnf h LEU 219 CO 0.03 0.81 0.01 0.11 -0.13 0.00 0.00 178.44 179.27 1xnf h LYS 220 N -0.00 0.85 -0.30 1.25 1.57 -1.77 -2.09 116.57 116.07 1xnf h LYS 220 Ca 0.02 -0.23 -0.07 0.00 -1.87 0.00 0.00 60.65 58.50 1xnf h LYS 220 Cb 0.71 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.90 1xnf h LYS 220 CO 0.04 0.85 -0.12 0.00 -0.57 0.00 0.00 179.45 179.65 1xnf h ALA 221 N 1.21 1.24 0.14 3.86 0.00 -1.13 -3.23 119.26 121.35 1xnf h ALA 221 Ca 0.15 -0.27 -0.29 0.00 0.00 0.00 0.00 54.91 54.50 1xnf h ALA 221 Cb 0.47 -0.14 0.02 0.00 0.00 0.00 0.00 17.79 18.14 1xnf h ALA 221 CO 0.02 0.50 -1.27 0.22 0.00 0.00 0.00 179.25 178.72 1xnf h ASP 222 N 0.47 0.65 -3.74 0.00 3.58 -0.82 -3.45 116.42 113.12 1xnf h ASP 222 Ca 0.09 -0.65 -0.52 0.00 0.42 0.00 0.00 57.03 56.37 1xnf h ASP 222 Cb 0.49 -0.21 0.05 0.00 1.72 0.00 0.00 39.33 41.38 1xnf h ASP 222 CO 0.03 1.49 0.64 0.00 -2.88 0.00 0.00 179.24 178.51 1xnf s ALA 223 N -2.80 3.51 0.00 -0.78 0.00 -0.84 -4.94 121.76 115.91 1xnf s ALA 223 Ca -0.07 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.10 1xnf s ALA 223 Cb 0.06 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.71 1xnf s ALA 223 CO 0.91 -0.58 0.40 0.25 0.00 0.00 0.00 175.76 176.73 1xnf n THR 224 N 1.29 0.00 -3.82 0.00 -2.24 -1.26 -4.94 114.28 103.31 1xnf n THR 224 Ca 0.02 -0.40 -0.08 0.00 -2.27 0.00 0.00 64.05 61.32 1xnf n THR 224 Cb 0.42 1.20 0.02 0.00 -2.10 0.00 0.00 70.33 69.87 1xnf n THR 224 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1xnf s ASP 225 N -0.00 -0.02 0.23 3.42 1.47 -1.26 -5.04 116.67 115.47 1xnf s ASP 225 Ca 0.00 -1.02 -0.03 0.00 1.18 0.00 0.00 52.55 52.68 1xnf s ASP 225 Cb 0.00 0.78 0.24 0.00 -0.34 0.00 0.00 42.92 43.60 1xnf s ASP 225 CO 0.00 -1.54 1.65 -1.13 0.68 0.00 0.00 175.17 174.83 1xnf h ASN 226 N 2.00 0.71 -0.31 2.11 -1.24 -1.97 -1.73 115.58 115.15 1xnf h ASN 226 Ca -0.30 -0.25 -0.16 0.00 0.71 0.00 0.00 56.30 56.29 1xnf h ASN 226 Cb 1.24 -0.20 -0.00 0.00 0.73 0.00 0.00 38.32 40.10 1xnf h ASN 226 CO 0.38 0.93 -0.44 0.00 -1.29 0.00 0.00 177.43 177.00 1xnf h THR 227 N 0.61 1.28 -0.67 -3.57 1.03 -1.96 0.32 112.91 109.96 1xnf h THR 227 Ca 0.09 -1.63 -0.01 0.00 -0.01 0.00 0.00 66.41 64.85 1xnf h THR 227 Cb 0.72 1.58 -0.03 0.00 -1.07 0.00 0.00 68.15 69.34 1xnf h THR 227 CO 0.06 0.53 0.37 0.77 -0.01 0.00 0.00 175.52 177.24 1xnf h SER 228 N 0.62 0.82 0.01 0.00 4.64 -1.92 -0.91 113.55 116.81 1xnf h SER 228 Ca 0.03 -0.06 -0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1xnf h SER 228 Cb 1.04 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 1xnf h SER 228 CO 0.10 0.66 -0.00 0.25 -0.87 0.00 0.00 176.83 176.97 1xnf h LEU 229 N 0.93 -0.01 -0.41 5.97 5.85 -1.03 -0.38 115.31 126.23 1xnf h LEU 229 Ca 0.24 -0.19 0.02 0.00 0.84 0.00 0.00 57.88 58.79 1xnf h LEU 229 Cb 0.02 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 1xnf h LEU 229 CO -0.04 0.19 0.24 0.00 -0.34 0.00 0.00 178.44 178.49 1xnf h ALA 230 N 0.79 0.52 -0.48 1.25 0.00 -0.76 -0.10 119.26 120.48 1xnf h ALA 230 Ca -0.00 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1xnf h ALA 230 Cb 0.20 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1xnf h ALA 230 CO 0.00 -0.09 0.05 0.93 0.00 0.00 0.00 179.25 180.14 1xnf h GLU 231 N 0.49 0.81 -0.81 0.00 5.08 -1.07 0.33 114.58 119.41 1xnf h GLU 231 Ca 0.16 -0.23 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1xnf h GLU 231 Cb 0.01 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.13 1xnf h GLU 231 CO -0.07 0.83 0.52 0.45 -1.00 0.00 0.00 179.01 179.73 1xnf h HIS 232 N 0.67 1.04 -0.01 4.33 3.86 -0.51 -2.69 115.15 121.84 1xnf h HIS 232 Ca 0.14 0.01 -0.15 0.00 -1.16 0.00 0.00 60.37 59.22 1xnf h HIS 232 Cb 0.44 -0.35 -0.02 0.00 1.06 0.00 0.00 27.41 28.54 1xnf h HIS 232 CO 0.03 0.67 -0.68 -0.07 0.86 0.00 0.00 177.93 178.74 1xnf h LEU 233 N 1.10 0.07 -0.21 2.43 3.38 -0.64 0.12 115.31 121.57 1xnf h LEU 233 Ca 0.29 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 58.17 1xnf h LEU 233 Cb -0.09 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1xnf h LEU 233 CO -0.06 0.73 -0.05 -1.28 0.09 0.00 0.00 178.44 177.87 1xnf h SER 234 N 0.04 0.40 -0.07 -0.43 0.87 -0.72 -0.58 113.55 113.07 1xnf h SER 234 Ca -0.01 -0.36 -0.01 0.00 -1.23 0.00 0.00 61.79 60.17 1xnf h SER 234 Cb 1.21 -0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 63.05 1xnf h SER 234 CO 0.09 0.67 -0.01 -0.33 -0.53 0.00 0.00 176.83 176.72 1xnf h GLU 235 N 0.13 0.13 -0.22 2.24 5.08 -1.32 -2.89 114.58 117.72 1xnf h GLU 235 Ca 0.05 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.30 1xnf h GLU 235 Cb 0.49 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 1xnf h GLU 235 CO 0.02 0.44 -0.12 1.15 -1.00 0.00 0.00 179.01 179.50 1xnf h THR 236 N -0.20 1.31 0.00 1.13 2.02 -0.74 -1.77 112.91 114.65 1xnf h THR 236 Ca 0.02 -1.20 -0.05 0.00 0.77 0.00 0.00 66.41 65.94 1xnf h THR 236 Cb 0.39 1.62 -0.01 0.00 -1.74 0.00 0.00 68.15 68.42 1xnf h THR 236 CO 0.01 0.37 -0.26 0.78 0.37 0.00 0.00 175.52 176.79 1xnf h ASN 237 N 0.18 0.00 -0.24 4.18 2.35 -1.19 0.13 115.58 120.99 1xnf h ASN 237 Ca 0.05 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.75 1xnf h ASN 237 Cb 0.62 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.99 1xnf h ASN 237 CO 0.04 0.26 -0.05 0.15 -1.65 0.00 0.00 177.43 176.17 1xnf h PHE 238 N 0.00 0.52 -0.26 1.19 3.57 -1.21 0.69 116.94 121.44 1xnf h PHE 238 Ca -0.00 -0.11 -0.12 0.00 3.53 0.00 0.00 57.97 61.27 1xnf h PHE 238 Cb 0.47 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.07 1xnf h PHE 238 CO 0.00 0.68 -0.33 1.88 -2.23 0.00 0.00 178.31 178.31 1xnf h TYR 239 N 0.21 0.64 -0.60 0.41 0.05 -0.78 -1.09 116.97 115.82 1xnf h TYR 239 Ca 0.06 -0.16 -0.07 0.00 0.05 0.00 0.00 58.73 58.61 1xnf h TYR 239 Cb 0.51 -0.15 -0.02 0.00 1.01 0.00 0.00 36.73 38.08 1xnf h TYR 239 CO 0.05 0.82 0.10 -0.07 -1.05 0.00 0.00 178.16 178.01 1xnf h LEU 240 N 0.47 0.95 -0.58 3.88 3.38 -0.70 -1.83 115.31 120.88 1xnf h LEU 240 Ca 0.06 -0.26 0.06 0.00 0.09 0.00 0.00 57.88 57.83 1xnf h LEU 240 Cb 0.80 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 41.24 1xnf h LEU 240 CO 0.07 0.97 0.29 1.23 0.09 0.00 0.00 178.44 181.08 1xnf h GLY 241 N 0.89 0.83 1.38 0.83 0.00 -0.11 -1.47 103.07 105.42 1xnf h GLY 241 Ca 0.18 -0.19 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 1xnf h GLY 241 CO 0.01 0.10 -0.15 0.50 0.00 0.00 0.00 176.54 177.00 1xnf h LYS 242 N 0.54 0.73 -0.25 4.80 1.79 -0.97 0.54 116.57 123.76 1xnf h LYS 242 Ca 0.27 -0.25 -0.00 0.00 -2.18 0.00 0.00 60.65 58.48 1xnf h LYS 242 Cb 0.21 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.79 1xnf h LYS 242 CO -0.20 0.84 0.14 -0.92 -1.08 0.00 0.00 179.45 178.23 1xnf h TYR 243 N 0.66 0.34 -0.32 -1.35 3.20 -0.74 -1.04 116.97 117.72 1xnf h TYR 243 Ca 0.11 -0.01 -0.16 0.00 3.14 0.00 0.00 58.73 61.81 1xnf h TYR 243 Cb 0.62 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.77 1xnf h TYR 243 CO 0.03 0.29 -0.43 1.88 -1.64 0.00 0.00 178.16 178.29 1xnf h TYR 244 N 0.29 0.99 -0.75 -3.82 -1.99 -1.15 -2.10 116.97 108.43 1xnf h TYR 244 Ca 0.09 -0.31 0.03 0.00 2.00 0.00 0.00 58.73 60.54 1xnf h TYR 244 Cb 0.06 -0.20 -0.05 0.00 2.00 0.00 0.00 36.73 38.54 1xnf h TYR 244 CO -0.04 1.10 0.47 1.25 -0.00 0.00 0.00 178.16 180.95 1xnf h LEU 245 N 0.66 0.78 -0.77 3.88 5.85 -0.71 -1.00 115.31 123.99 1xnf h LEU 245 Ca 0.05 -0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 1xnf h LEU 245 Cb 1.00 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 1xnf h LEU 245 CO 0.10 0.54 -0.21 0.77 -0.34 0.00 0.00 178.44 179.30 1xnf h SER 246 N 0.92 0.00 0.63 1.25 4.64 -0.79 0.33 113.55 120.54 1xnf h SER 246 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 1xnf h SER 246 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1xnf h SER 246 CO -0.12 0.21 0.00 0.18 -0.87 0.00 0.00 176.83 176.23 1xnf n LEU 247 N -3.27 0.00 0.00 5.97 4.77 -0.83 -4.91 117.00 118.74 1xnf n LEU 247 Ca 0.01 0.47 0.00 0.00 -0.03 0.00 0.00 56.01 56.46 1xnf n LEU 247 Cb 0.49 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 1xnf n LEU 247 CO 0.34 -0.16 0.00 0.61 -1.33 0.00 0.00 177.39 176.85 1xnf n GLY 248 N 0.49 0.65 3.45 -0.72 0.00 0.11 -5.00 105.19 104.18 1xnf n GLY 248 Ca 0.05 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.63 1xnf n GLY 248 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xnf s ASP 249 N -2.04 6.96 0.33 1.61 -1.08 -0.43 -4.84 116.67 117.19 1xnf s ASP 249 Ca 0.00 -2.77 0.04 0.00 -0.52 0.00 0.00 52.55 49.30 1xnf s ASP 249 Cb 0.00 -2.39 0.58 0.00 -1.46 0.00 0.00 42.92 39.65 1xnf s ASP 249 CO 0.00 -0.80 1.85 -0.07 0.52 0.00 0.00 175.17 176.67 1xnf h LEU 250 N 9.73 0.48 -0.14 -1.34 4.07 -1.89 -1.25 115.31 124.96 1xnf h LEU 250 Ca 0.27 -0.10 -0.07 0.00 0.08 0.00 0.00 57.88 58.06 1xnf h LEU 250 Cb 0.92 -0.13 -0.00 0.00 1.08 0.00 0.00 40.66 42.53 1xnf h LEU 250 CO 1.19 0.58 -0.17 0.44 -1.08 0.00 0.00 178.44 179.41 1xnf h ASP 251 N 0.48 0.40 -0.30 -0.43 3.32 -1.96 -0.24 116.42 117.68 1xnf h ASP 251 Ca 0.10 -0.50 -0.03 0.00 0.02 0.00 0.00 57.03 56.62 1xnf h ASP 251 Cb 0.39 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 1xnf h ASP 251 CO 0.02 0.81 0.08 0.28 -1.72 0.00 0.00 179.24 178.71 1xnf h SER 252 N -0.01 0.45 -0.37 6.45 0.02 -1.93 -2.39 113.55 115.78 1xnf h SER 252 Ca 0.02 -0.22 0.06 0.00 -0.84 0.00 0.00 61.79 60.81 1xnf h SER 252 Cb 0.71 -0.12 -0.05 0.00 0.14 0.00 0.00 62.40 63.08 1xnf h SER 252 CO 0.04 0.56 0.04 0.00 -1.14 0.00 0.00 176.83 176.33 1xnf h ALA 253 N 0.91 0.36 -0.20 3.77 0.00 -1.17 -0.67 119.26 122.27 1xnf h ALA 253 Ca 0.10 0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.13 1xnf h ALA 253 Cb 0.28 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1xnf h ALA 253 CO -0.00 -0.36 -0.03 1.15 0.00 0.00 0.00 179.25 180.01 1xnf h THR 254 N 0.15 0.83 -0.63 0.00 2.02 -0.90 -0.41 112.91 113.97 1xnf h THR 254 Ca 0.18 -0.01 0.05 0.00 0.77 0.00 0.00 66.41 67.40 1xnf h THR 254 Cb 0.23 0.80 -0.05 0.00 -1.74 0.00 0.00 68.15 67.38 1xnf h THR 254 CO -0.26 0.00 0.35 0.00 0.37 0.00 0.00 175.52 175.98 1xnf h ALA 255 N 1.18 0.84 -0.37 6.16 0.00 -1.07 -1.23 119.26 124.78 1xnf h ALA 255 Ca 0.09 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 1xnf h ALA 255 Cb 0.13 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1xnf h ALA 255 CO -0.18 0.03 -0.27 -0.07 0.00 0.00 0.00 179.25 178.76 1xnf h LEU 256 N 0.66 0.78 -0.55 0.00 3.38 -0.68 0.44 115.31 119.34 1xnf h LEU 256 Ca 0.28 -0.30 -0.10 0.00 0.09 0.00 0.00 57.88 57.85 1xnf h LEU 256 Cb 0.16 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1xnf h LEU 256 CO -0.17 1.01 -0.04 -0.26 0.09 0.00 0.00 178.44 179.07 1xnf h PHE 257 N 0.65 1.11 -0.62 1.13 0.05 -0.75 0.53 116.94 119.04 1xnf h PHE 257 Ca 0.08 -0.21 -0.01 0.00 3.82 0.00 0.00 57.97 61.66 1xnf h PHE 257 Cb 0.79 -0.28 -0.03 0.00 2.00 0.00 0.00 35.95 38.43 1xnf h PHE 257 CO 0.04 1.01 0.37 0.87 -0.18 0.00 0.00 178.31 180.42 1xnf h LYS 258 N 0.89 0.85 -0.67 1.51 1.57 -0.94 -0.78 116.57 119.00 1xnf h LYS 258 Ca 0.15 -0.08 -0.04 0.00 -1.87 0.00 0.00 60.65 58.81 1xnf h LYS 258 Cb 0.60 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.70 1xnf h LYS 258 CO 0.04 0.62 0.27 -0.07 -0.57 0.00 0.00 179.45 179.74 1xnf h LEU 259 N 0.84 0.89 0.14 2.94 3.38 -0.66 -1.57 115.31 121.28 1xnf h LEU 259 Ca 0.22 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1xnf h LEU 259 Cb -0.00 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.52 1xnf h LEU 259 CO -0.04 0.80 -0.07 0.00 0.09 0.00 0.00 178.44 179.22 1xnf h ALA 260 N 1.33 -0.19 -0.19 1.53 0.00 0.03 -3.15 119.26 118.62 1xnf h ALA 260 Ca 0.23 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1xnf h ALA 260 Cb 0.18 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1xnf h ALA 260 CO -0.02 -0.57 0.06 0.28 0.00 0.00 0.00 179.25 178.99 1xnf h VAL 261 N -0.26 1.09 0.00 0.00 2.07 -0.87 -2.82 116.25 115.47 1xnf h VAL 261 Ca -0.02 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.19 1xnf h VAL 261 Cb 0.20 0.89 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 1xnf h VAL 261 CO 0.03 0.11 0.13 0.00 0.02 0.00 0.00 177.57 177.86 1xnf h ALA 262 N 1.80 1.11 0.00 1.67 0.00 -1.25 0.58 119.26 123.17 1xnf h ALA 262 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1xnf h ALA 262 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1xnf h ALA 262 CO -0.00 -0.11 0.00 -0.91 0.00 0.00 0.00 179.25 178.22 1xnf h ASN 263 N 0.00 0.00 -4.74 0.00 2.35 -1.62 -3.38 115.58 108.18 1xnf h ASN 263 Ca 0.00 0.00 -0.41 0.00 -0.55 0.00 0.00 56.30 55.34 1xnf h ASN 263 Cb 0.25 0.00 0.08 0.00 0.05 0.00 0.00 38.32 38.70 1xnf h ASN 263 CO 0.00 0.00 -0.63 0.59 -1.65 0.00 0.00 177.43 175.74 1xnf n ASN 264 N -2.60 -6.23 -4.20 5.81 5.03 0.19 -2.03 115.26 111.24 1xnf n ASN 264 Ca 0.04 -0.34 -0.43 0.00 0.87 0.00 0.00 54.58 54.72 1xnf n ASN 264 Cb 0.41 -5.01 0.00 0.00 -1.02 0.00 0.00 39.78 34.16 1xnf n ASN 264 CO 0.00 0.00 0.00 0.52 -1.83 0.00 0.00 177.26 175.95 1xnf n VAL 265 N -4.63 4.39 0.01 2.41 0.31 -1.26 -4.64 118.33 114.92 1xnf n VAL 265 Ca -0.09 -4.73 0.04 0.00 -0.01 0.00 0.00 64.34 59.54 1xnf n VAL 265 Cb 0.61 -2.41 0.43 0.00 -0.91 0.00 0.00 33.84 31.56 1xnf n VAL 265 CO 0.00 0.00 0.00 0.45 -1.32 0.00 0.00 176.83 175.96 1xnf h HIS 266 N 6.46 0.49 -0.02 3.52 3.86 -1.87 -1.87 115.15 125.73 1xnf h HIS 266 Ca 0.33 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.55 1xnf h HIS 266 Cb 0.76 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 29.07 1xnf h HIS 266 CO 1.13 0.32 0.00 0.27 0.86 0.00 0.00 177.93 180.51 1xnf n ASN 267 N -4.47 1.41 -4.75 2.45 0.23 -1.26 -4.61 115.26 104.26 1xnf n ASN 267 Ca 0.03 -1.47 -0.41 0.00 -0.53 0.00 0.00 54.58 52.20 1xnf n ASN 267 Cb 0.07 -0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 37.73 1xnf n ASN 267 CO 0.00 0.00 0.00 -0.36 -0.93 0.00 0.00 177.26 175.97 1xnf s PHE 268 N -2.00 3.53 0.31 -2.53 2.99 -0.70 -4.93 117.98 114.65 1xnf s PHE 268 Ca 0.39 1.58 0.08 0.00 0.00 0.00 0.00 56.93 58.98 1xnf s PHE 268 Cb 0.21 -3.33 0.88 0.00 0.00 0.00 0.00 43.02 40.78 1xnf s PHE 268 CO 0.34 -0.78 1.67 0.28 -0.00 0.00 0.00 175.22 176.72 1xnf h VAL 269 N 3.48 0.34 -0.00 -0.44 2.07 -1.90 -1.03 116.25 118.78 1xnf h VAL 269 Ca -0.45 -0.11 -0.11 0.00 0.82 0.00 0.00 66.70 66.85 1xnf h VAL 269 Cb 1.21 0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 1xnf h VAL 269 CO 0.71 0.06 -0.51 -0.33 0.02 0.00 0.00 177.57 177.51 1xnf h GLU 270 N 0.31 0.00 0.04 1.57 3.07 -1.91 0.72 114.58 118.38 1xnf h GLU 270 Ca 0.64 -0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.49 1xnf h GLU 270 Cb 1.35 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.26 1xnf h GLU 270 CO -0.61 0.51 -0.02 1.25 -1.40 0.00 0.00 179.01 178.75 1xnf h HIS 271 N 0.00 -0.05 -0.48 4.33 2.76 -1.58 -0.03 115.15 120.10 1xnf h HIS 271 Ca -0.00 -0.00 0.08 0.00 -2.20 0.00 0.00 60.37 58.25 1xnf h HIS 271 Cb 0.91 0.02 -0.07 0.00 1.55 0.00 0.00 27.41 29.81 1xnf h HIS 271 CO 0.00 0.47 0.08 0.00 -1.30 0.00 0.00 177.93 177.18 1xnf h ARG 272 N -0.60 0.21 0.00 5.26 3.08 -0.81 -2.28 114.38 119.24 1xnf h ARG 272 Ca -0.01 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1xnf h ARG 272 Cb 0.54 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1xnf h ARG 272 CO 0.01 0.14 -0.72 1.88 -1.07 0.00 0.00 179.97 180.20 1xnf h TYR 273 N 0.21 0.00 -0.39 3.04 0.99 -0.91 -1.82 116.97 118.09 1xnf h TYR 273 Ca 0.24 0.00 0.01 0.00 2.00 0.00 0.00 58.73 60.98 1xnf h TYR 273 Cb 0.33 0.00 -0.02 0.00 1.00 0.00 0.00 36.73 38.04 1xnf h TYR 273 CO -0.24 0.00 0.25 0.00 -0.00 0.00 0.00 178.16 178.17 1xnf h ALA 274 N 2.18 0.50 -0.70 3.88 0.00 -0.84 0.21 119.26 124.48 1xnf h ALA 274 Ca 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1xnf h ALA 274 Cb 0.91 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 1xnf h ALA 274 CO 0.00 -0.07 0.39 -0.07 0.00 0.00 0.00 179.25 179.50 1xnf h LEU 275 N 0.51 0.87 0.09 0.00 3.38 -1.21 -1.58 115.31 117.36 1xnf h LEU 275 Ca 0.15 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 1xnf h LEU 275 Cb -0.03 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.49 1xnf h LEU 275 CO -0.05 0.72 -0.04 0.25 0.09 0.00 0.00 178.44 179.41 1xnf h LEU 276 N 0.96 -0.10 -0.96 1.67 5.85 -0.98 0.14 115.31 121.89 1xnf h LEU 276 Ca 0.25 0.00 0.06 0.00 0.84 0.00 0.00 57.88 59.03 1xnf h LEU 276 Cb 0.03 0.03 -0.07 0.00 0.37 0.00 0.00 40.66 41.02 1xnf h LEU 276 CO -0.04 -0.07 0.61 -0.33 -0.34 0.00 0.00 178.44 178.28 1xnf h GLU 277 N -0.12 1.08 -0.64 1.25 4.39 -0.49 -0.17 114.58 119.88 1xnf h GLU 277 Ca -0.01 -0.07 -0.06 0.00 0.34 0.00 0.00 59.36 59.56 1xnf h GLU 277 Cb 0.09 -0.24 -0.03 0.00 -0.10 0.00 0.00 28.75 28.47 1xnf h GLU 277 CO 0.02 0.72 0.16 -0.07 -1.16 0.00 0.00 179.01 178.68 1xnf h LEU 278 N 1.12 0.96 -0.89 1.33 3.38 -0.99 0.67 115.31 120.89 1xnf h LEU 278 Ca 0.42 -0.23 0.01 0.00 0.09 0.00 0.00 57.88 58.16 1xnf h LEU 278 Cb 0.17 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 1xnf h LEU 278 CO -0.17 0.94 0.58 -1.28 0.09 0.00 0.00 178.44 178.60 1xnf h SER 279 N 0.94 1.03 -0.41 -0.43 0.87 0.97 -0.42 113.55 116.09 1xnf h SER 279 Ca 0.20 -0.03 -0.10 0.00 -1.23 0.00 0.00 61.79 60.62 1xnf h SER 279 Cb 0.35 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 62.04 1xnf h SER 279 CO 0.00 0.75 -0.12 -0.07 -0.53 0.00 0.00 176.83 176.87 1xnf h LEU 280 N 1.21 0.87 -1.30 2.23 3.38 -0.66 -2.53 115.31 118.51 1xnf h LEU 280 Ca 0.32 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 1xnf h LEU 280 Cb -0.13 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.39 1xnf h LEU 280 CO -0.07 1.00 -0.14 -0.07 0.09 0.00 0.00 178.44 179.25 1xnf h LEU 281 N 0.78 0.00 -0.03 1.67 3.38 -0.35 -3.03 115.31 117.72 1xnf h LEU 281 Ca 0.13 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.84 1xnf h LEU 281 Cb 0.63 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.39 1xnf h LEU 281 CO 0.04 0.14 -1.09 1.23 0.09 0.00 0.00 178.44 178.86 1xnf h GLY 282 N 1.96 0.44 0.76 0.83 0.00 -0.67 -3.32 103.07 103.06 1xnf h GLY 282 Ca -0.00 -0.90 -0.04 0.00 0.00 0.00 0.00 47.33 46.40 1xnf h GLY 282 CO 0.02 0.79 -0.40 0.06 0.00 0.00 0.00 176.54 177.01 1xnf h GLN 283 N 0.18 -1.02 0.00 4.80 -0.00 -1.38 -3.51 115.11 114.18 1xnf h GLN 283 Ca -0.11 0.07 0.00 0.00 -0.00 0.00 0.00 58.65 58.61 1xnf h GLN 283 Cb 1.76 0.23 0.00 0.00 -0.00 0.00 0.00 27.48 29.47 1xnf h GLN 283 CO 0.19 -0.68 0.00 -0.40 -0.00 0.00 0.00 178.83 177.94