#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xnf h SER 27 N 0.00 0.00 1.05 3.14 4.64 -2.06 -3.23 113.55 117.08 1xnf h SER 27 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xnf h SER 27 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1xnf h SER 27 CO 0.00 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.34 1xnf n GLU 28 N -2.42 0.12 -0.09 4.77 -0.58 -1.26 -2.47 120.64 118.71 1xnf n GLU 28 Ca 0.02 0.18 0.09 0.00 -0.42 0.00 0.00 57.16 57.04 1xnf n GLU 28 Cb 0.29 -1.66 0.35 0.00 -0.57 0.00 0.00 31.44 29.84 1xnf n GLU 28 CO 0.00 0.00 0.00 1.55 -0.48 0.00 0.00 177.13 178.20 1xnf n VAL 29 N -1.88 0.24 -4.44 2.62 3.14 -1.22 -4.77 118.33 112.02 1xnf n VAL 29 Ca 0.05 -0.34 -0.22 0.00 -2.96 0.00 0.00 64.34 60.87 1xnf n VAL 29 Cb 0.33 0.30 -0.13 0.00 -1.06 0.00 0.00 33.84 33.27 1xnf n VAL 29 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 1xnf s LEU 30 N -1.47 2.19 0.34 6.55 1.43 -1.03 -5.06 118.68 121.63 1xnf s LEU 30 Ca 0.30 -0.51 0.06 0.00 -1.03 0.00 0.00 54.13 52.94 1xnf s LEU 30 Cb 0.16 -0.76 -0.01 0.00 0.03 0.00 0.00 46.19 45.61 1xnf s LEU 30 CO 0.24 0.08 0.48 0.00 0.23 0.00 0.00 176.35 177.37 1xnf s ALA 31 N -0.89 4.15 -0.12 4.21 0.00 -1.26 -5.01 121.76 122.85 1xnf s ALA 31 Ca 0.04 -1.39 -0.30 0.00 0.00 0.00 0.00 51.96 50.32 1xnf s ALA 31 Cb -0.09 -1.74 -0.02 0.00 0.00 0.00 0.00 23.12 21.28 1xnf s ALA 31 CO 0.02 -0.04 1.18 0.08 0.00 0.00 0.00 175.76 176.99 1xnf s VAL 32 N -2.20 4.38 0.16 0.00 1.01 -1.26 -4.95 120.40 117.54 1xnf s VAL 32 Ca 0.44 1.68 -0.34 0.00 0.00 0.00 0.00 61.98 63.77 1xnf s VAL 32 Cb -0.10 -4.08 -0.15 0.00 0.00 0.00 0.00 36.38 32.05 1xnf s VAL 32 CO 0.32 -0.07 1.36 -2.65 0.00 0.00 0.00 175.10 174.06 1xnf n PRO 33 N 5.76 1.58 -1.87 2.72 -0.02 -1.26 -4.88 135.00 137.03 1xnf n PRO 33 Ca 0.12 0.57 -0.39 0.00 -2.02 0.00 0.00 63.50 61.77 1xnf n PRO 33 Cb 0.46 -2.20 0.01 0.00 -0.02 0.00 0.00 33.50 31.75 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 0.54 4.10 0.15 2.45 1.02 -0.79 -4.98 118.68 121.16 1xnf s LEU 34 Ca 0.76 2.83 0.09 0.00 0.02 0.00 0.00 54.13 57.83 1xnf s LEU 34 Cb -0.79 -3.98 -0.04 0.00 0.02 0.00 0.00 46.19 41.40 1xnf s LEU 34 CO 0.47 -1.14 -0.20 -1.10 0.02 0.00 0.00 176.35 174.40 1xnf s GLN 35 N -2.46 1.25 0.33 1.70 -1.52 -1.26 -4.77 119.66 112.92 1xnf s GLN 35 Ca 0.61 -1.33 -0.29 0.00 -1.95 0.00 0.00 55.36 52.40 1xnf s GLN 35 Cb -0.42 -1.40 -0.12 0.00 -0.22 0.00 0.00 33.01 30.85 1xnf s GLN 35 CO 0.53 0.30 1.45 -2.30 -0.25 0.00 0.00 175.29 175.02 1xnf n PRO 36 N 0.57 2.46 -2.53 2.91 -0.02 -1.26 -4.99 135.00 132.14 1xnf n PRO 36 Ca -0.15 0.87 -0.26 0.00 -2.02 0.00 0.00 63.50 61.93 1xnf n PRO 36 Cb 0.56 -2.56 0.02 0.00 -0.02 0.00 0.00 33.50 31.50 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 -0.70 3.98 0.21 3.45 -4.23 -1.26 -4.97 115.64 112.12 1xnf s THR 37 Ca 0.58 -0.02 -0.08 0.00 -1.18 0.00 0.00 61.69 60.99 1xnf s THR 37 Cb -0.53 -3.55 0.16 0.00 1.34 0.00 0.00 72.50 69.93 1xnf s THR 37 CO 0.58 -0.53 1.81 0.25 -0.54 0.00 0.00 174.62 176.18 1xnf h LEU 38 N -0.01 1.05 -0.93 4.79 5.85 -1.99 -2.01 115.31 122.05 1xnf h LEU 38 Ca -0.46 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.11 1xnf h LEU 38 Cb 1.24 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.96 1xnf h LEU 38 CO 0.60 0.89 0.45 1.56 -0.34 0.00 0.00 178.44 181.61 1xnf h GLN 39 N 1.14 1.21 -0.56 1.25 7.50 -1.99 0.14 115.11 123.80 1xnf h GLN 39 Ca 0.28 -0.15 -0.02 0.00 0.50 0.00 0.00 58.65 59.25 1xnf h GLN 39 Cb 0.12 -0.23 -0.03 0.00 0.05 0.00 0.00 27.48 27.39 1xnf h GLN 39 CO -0.04 0.90 0.26 1.96 -1.50 0.00 0.00 178.83 180.41 1xnf h GLN 40 N 1.21 0.82 -0.49 1.46 4.20 -1.77 0.24 115.11 120.78 1xnf h GLN 40 Ca 0.30 -0.13 -0.12 0.00 0.06 0.00 0.00 58.65 58.77 1xnf h GLN 40 Cb 0.05 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.68 1xnf h GLN 40 CO -0.05 0.68 -0.16 0.93 -0.67 0.00 0.00 178.83 179.57 1xnf h GLU 41 N 0.76 0.94 -0.52 1.46 5.08 -0.84 -1.37 114.58 120.10 1xnf h GLU 41 Ca 0.19 -0.36 -0.03 0.00 -1.00 0.00 0.00 59.36 58.16 1xnf h GLU 41 Cb 0.14 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1xnf h GLU 41 CO -0.02 1.03 0.20 0.28 -1.00 0.00 0.00 179.01 179.50 1xnf h VAL 42 N 0.83 1.22 -0.26 3.13 2.07 -0.46 -1.35 116.25 121.43 1xnf h VAL 42 Ca 0.12 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.96 1xnf h VAL 42 Cb 0.71 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 1xnf h VAL 42 CO 0.05 0.25 0.14 0.40 0.02 0.00 0.00 177.57 178.44 1xnf h ILE 43 N 0.70 1.13 -0.65 4.57 2.04 -0.78 -1.19 117.51 123.32 1xnf h ILE 43 Ca 0.17 -0.34 0.06 0.00 1.00 0.00 0.00 64.86 65.75 1xnf h ILE 43 Cb 0.20 0.88 -0.05 0.00 -0.74 0.00 0.00 36.82 37.11 1xnf h ILE 43 CO -0.01 0.13 0.36 -0.07 0.00 0.00 0.00 178.15 178.55 1xnf h LEU 44 N 0.30 0.53 -0.64 1.44 3.38 -1.02 -2.38 115.31 116.92 1xnf h LEU 44 Ca 0.09 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 1xnf h LEU 44 Cb 0.08 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 1xnf h LEU 44 CO -0.01 0.34 0.29 0.00 0.09 0.00 0.00 178.44 179.15 1xnf h ALA 45 N 1.35 0.83 0.00 1.53 0.00 -0.78 -1.58 119.26 120.61 1xnf h ALA 45 Ca 0.29 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1xnf h ALA 45 Cb 0.19 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1xnf h ALA 45 CO -0.19 0.41 0.00 -2.13 0.00 0.00 0.00 179.25 177.34 1xnf n ARG 46 N -4.47 0.28 0.00 0.00 0.63 -0.49 -3.17 116.66 109.44 1xnf n ARG 46 Ca 0.04 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.97 1xnf n ARG 46 Cb 0.14 -1.36 0.00 0.00 0.45 0.00 0.00 32.46 31.69 1xnf n ARG 46 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 1xnf n GLU 48 N 1.06 0.00 0.05 -0.14 2.13 -0.59 -1.81 120.64 121.35 1xnf n GLU 48 Ca 0.00 0.00 -0.08 0.00 0.66 0.00 0.00 57.16 57.74 1xnf n GLU 48 Cb 0.14 0.00 0.06 0.00 0.27 0.00 0.00 31.44 31.91 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 0.37 -0.24 5.31 4.20 -1.83 -1.28 115.11 121.64 1xnf h GLN 49 Ca 0.00 -0.28 -0.09 0.00 0.06 0.00 0.00 58.65 58.35 1xnf h GLN 49 Cb 0.00 0.05 -0.00 0.00 0.30 0.00 0.00 27.48 27.82 1xnf h GLN 49 CO 0.00 0.90 -0.19 0.82 -0.67 0.00 0.00 178.83 179.69 1xnf h ILE 50 N 0.27 1.31 0.00 2.54 2.04 -1.67 -2.78 117.51 119.22 1xnf h ILE 50 Ca -0.02 -1.32 -0.06 0.00 1.00 0.00 0.00 64.86 64.46 1xnf h ILE 50 Cb 1.20 1.65 -0.01 0.00 -0.74 0.00 0.00 36.82 38.92 1xnf h ILE 50 CO 0.11 0.41 -0.30 -0.07 0.00 0.00 0.00 178.15 178.30 1xnf h LEU 51 N 0.25 0.00 -0.23 1.44 3.38 -1.79 -1.82 115.31 116.55 1xnf h LEU 51 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1xnf h LEU 51 Cb 0.72 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.47 1xnf h LEU 51 CO 0.05 0.30 0.00 0.00 0.09 0.00 0.00 178.44 178.88 1xnf n ALA 52 N -2.42 1.74 -2.19 1.53 0.00 -0.50 -4.82 120.51 113.86 1xnf n ALA 52 Ca -0.02 -0.01 -0.23 0.00 0.00 0.00 0.00 53.44 53.18 1xnf n ALA 52 Cb 0.37 -1.31 0.02 0.00 0.00 0.00 0.00 19.45 18.52 1xnf n ALA 52 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1xnf s SER 53 N -3.48 5.63 -0.11 0.00 1.04 -0.68 -4.99 113.70 111.11 1xnf s SER 53 Ca 0.07 0.28 0.18 0.00 0.48 0.00 0.00 55.95 56.96 1xnf s SER 53 Cb 0.10 -1.38 0.71 0.00 0.10 0.00 0.00 66.02 65.55 1xnf s SER 53 CO 0.34 -0.89 1.61 0.54 0.98 0.00 0.00 173.24 175.83 1xnf n ARG 54 N -2.24 3.67 0.00 4.02 1.74 -1.26 -4.39 116.66 118.20 1xnf n ARG 54 Ca 0.04 -2.80 0.12 0.00 -0.77 0.00 0.00 57.85 54.43 1xnf n ARG 54 Cb 0.58 -1.89 0.55 0.00 -1.02 0.00 0.00 32.46 30.69 1xnf n ARG 54 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1xnf n ALA 55 N 1.13 2.14 -2.83 7.54 0.00 -1.26 -4.84 120.51 122.39 1xnf n ALA 55 Ca 0.25 -0.10 -0.35 0.00 0.00 0.00 0.00 53.44 53.25 1xnf n ALA 55 Cb 0.87 -1.39 -0.10 0.00 0.00 0.00 0.00 19.45 18.84 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 -2.81 3.80 1.05 0.00 1.43 -1.26 -5.10 118.68 115.80 1xnf s LEU 56 Ca 0.17 0.06 -0.12 0.00 -1.03 0.00 0.00 54.13 53.20 1xnf s LEU 56 Cb 0.16 -1.97 0.22 0.00 0.03 0.00 0.00 46.19 44.63 1xnf s LEU 56 CO 0.40 0.15 1.07 0.42 0.23 0.00 0.00 176.35 178.62 1xnf s THR 57 N 0.50 2.15 0.17 5.49 -4.23 -1.26 -4.75 115.64 113.71 1xnf s THR 57 Ca 0.03 0.05 -0.14 0.00 -1.18 0.00 0.00 61.69 60.45 1xnf s THR 57 Cb -0.13 -2.28 0.05 0.00 1.34 0.00 0.00 72.50 71.49 1xnf s THR 57 CO 0.01 -0.06 1.82 0.44 -0.54 0.00 0.00 174.62 176.29 1xnf h ASP 58 N -2.19 0.52 -0.30 3.99 3.32 -1.98 -0.82 116.42 118.96 1xnf h ASP 58 Ca -0.56 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 56.43 1xnf h ASP 58 Cb 1.32 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.73 1xnf h ASP 58 CO 0.52 0.38 0.03 0.44 -1.72 0.00 0.00 179.24 178.88 1xnf h ASP 59 N 0.63 0.58 -0.27 6.45 3.32 -1.93 -0.61 116.42 124.59 1xnf h ASP 59 Ca 0.19 -0.11 -0.14 0.00 0.02 0.00 0.00 57.03 56.99 1xnf h ASP 59 Cb -0.03 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 1xnf h ASP 59 CO -0.06 0.63 -0.34 -0.33 -1.72 0.00 0.00 179.24 177.42 1xnf h GLU 60 N 0.59 0.80 -0.16 3.56 5.08 -1.87 -2.44 114.58 120.14 1xnf h GLU 60 Ca 0.13 -0.38 -0.02 0.00 -1.00 0.00 0.00 59.36 58.08 1xnf h GLU 60 Cb 0.33 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 1xnf h GLU 60 CO 0.01 1.01 0.01 -0.09 -1.00 0.00 0.00 179.01 178.95 1xnf h ARG 61 N 0.67 0.28 -0.60 2.33 2.43 -0.48 -0.23 114.38 118.78 1xnf h ARG 61 Ca 0.07 -0.08 0.12 0.00 -0.81 0.00 0.00 59.98 59.27 1xnf h ARG 61 Cb 0.89 -0.03 -0.09 0.00 -0.42 0.00 0.00 29.97 30.32 1xnf h ARG 61 CO 0.08 0.48 0.10 0.00 -1.51 0.00 0.00 179.97 179.12 1xnf h ALA 62 N 0.79 0.69 -0.39 2.80 0.00 -1.18 0.20 119.26 122.16 1xnf h ALA 62 Ca 0.05 0.14 -0.14 0.00 0.00 0.00 0.00 54.91 54.96 1xnf h ALA 62 Cb 0.35 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1xnf h ALA 62 CO 0.01 -0.33 -0.29 0.37 0.00 0.00 0.00 179.25 179.01 1xnf h GLN 63 N 0.23 0.89 -0.41 0.00 5.75 -1.24 -1.62 115.11 118.71 1xnf h GLN 63 Ca 0.32 -0.43 -0.14 0.00 -0.15 0.00 0.00 58.65 58.25 1xnf h GLN 63 Cb 0.49 -0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.02 1xnf h GLN 63 CO -0.43 1.08 -0.28 1.25 -2.65 0.00 0.00 178.83 177.81 1xnf h LEU 64 N 0.71 0.96 -0.46 -2.39 5.85 -0.59 -1.18 115.31 118.20 1xnf h LEU 64 Ca 0.08 -0.43 0.06 0.00 0.84 0.00 0.00 57.88 58.42 1xnf h LEU 64 Cb 0.87 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 41.58 1xnf h LEU 64 CO 0.08 1.18 0.17 -0.07 -0.34 0.00 0.00 178.44 179.46 1xnf h LEU 65 N 0.74 0.19 -0.33 2.25 4.07 -0.55 0.69 115.31 122.36 1xnf h LEU 65 Ca 0.08 0.05 0.03 0.00 0.08 0.00 0.00 57.88 58.13 1xnf h LEU 65 Cb 0.86 0.03 -0.03 0.00 1.08 0.00 0.00 40.66 42.59 1xnf h LEU 65 CO 0.08 0.14 0.13 0.22 -1.08 0.00 0.00 178.44 177.93 1xnf h TYR 66 N 0.35 0.24 -0.60 1.13 3.20 -0.92 -0.32 116.97 120.05 1xnf h TYR 66 Ca 0.22 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 62.04 1xnf h TYR 66 Cb 0.21 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.39 1xnf h TYR 66 CO -0.15 0.11 0.12 0.93 -1.64 0.00 0.00 178.16 177.53 1xnf h GLU 67 N 0.29 0.95 -0.36 1.82 5.08 -0.75 0.09 114.58 121.69 1xnf h GLU 67 Ca 0.15 -0.22 -0.15 0.00 -1.00 0.00 0.00 59.36 58.14 1xnf h GLU 67 Cb 0.10 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1xnf h GLU 67 CO -0.14 0.86 -0.37 -0.09 -1.00 0.00 0.00 179.01 178.27 1xnf h ARG 68 N 0.90 0.85 -0.52 2.33 2.43 -0.49 -1.42 114.38 118.47 1xnf h ARG 68 Ca 0.19 -0.44 0.02 0.00 -0.81 0.00 0.00 59.98 58.94 1xnf h ARG 68 Cb 0.36 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.88 1xnf h ARG 68 CO 0.00 1.08 0.31 0.78 -1.51 0.00 0.00 179.97 180.64 1xnf h GLY 69 N 0.86 0.73 0.79 2.80 0.00 -0.46 0.31 103.07 108.10 1xnf h GLY 69 Ca 0.06 -0.24 0.04 0.00 0.00 0.00 0.00 47.33 47.20 1xnf h GLY 69 CO 0.09 0.21 0.40 -2.08 0.00 0.00 0.00 176.54 175.16 1xnf h VAL 70 N 0.62 1.04 -0.10 4.60 2.07 -0.77 0.89 116.25 124.60 1xnf h VAL 70 Ca 0.20 -0.26 -0.02 0.00 0.82 0.00 0.00 66.70 67.44 1xnf h VAL 70 Cb 0.01 0.20 -0.00 0.00 -1.52 0.00 0.00 31.29 29.97 1xnf h VAL 70 CO -0.09 0.14 -0.01 0.25 0.02 0.00 0.00 177.57 177.88 1xnf h LEU 71 N 0.77 0.19 -0.22 2.57 5.85 -0.41 -1.40 115.31 122.65 1xnf h LEU 71 Ca 0.28 -0.34 0.06 0.00 0.84 0.00 0.00 57.88 58.72 1xnf h LEU 71 Cb 0.09 -0.05 -0.07 0.00 0.37 0.00 0.00 40.66 41.00 1xnf h LEU 71 CO -0.14 0.48 -0.30 1.88 -0.34 0.00 0.00 178.44 180.02 1xnf h TYR 72 N -0.11 -0.84 -0.77 1.25 0.05 -0.32 -1.20 116.97 115.03 1xnf h TYR 72 Ca 0.03 0.04 0.18 0.00 0.05 0.00 0.00 58.73 59.03 1xnf h TYR 72 Cb 0.39 0.40 -0.13 0.00 1.01 0.00 0.00 36.73 38.40 1xnf h TYR 72 CO 0.04 -0.38 0.01 0.22 -1.05 0.00 0.00 178.16 177.01 1xnf h ASP 73 N -0.33 -0.35 0.62 3.88 3.58 -0.77 0.47 116.42 123.53 1xnf h ASP 73 Ca 0.12 0.20 0.00 0.00 0.42 0.00 0.00 57.03 57.77 1xnf h ASP 73 Cb 0.52 0.35 0.00 0.00 1.72 0.00 0.00 39.33 41.93 1xnf h ASP 73 CO -0.40 -0.19 0.00 0.77 -2.88 0.00 0.00 179.24 176.54 1xnf h SER 74 N 0.10 0.00 -0.21 2.28 4.64 -0.11 -2.12 113.55 118.13 1xnf h SER 74 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 1xnf h SER 74 Cb 0.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 1xnf h SER 74 CO -0.68 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 175.46 1xnf n LEU 75 N -2.61 3.10 0.00 5.97 4.77 -0.33 -4.30 117.00 123.60 1xnf n LEU 75 Ca 0.00 -1.20 0.00 0.00 -0.03 0.00 0.00 56.01 54.79 1xnf n LEU 75 Cb 0.20 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1xnf n LEU 75 CO 0.21 0.60 0.00 0.61 -1.33 0.00 0.00 177.39 177.47 1xnf n GLY 76 N 1.41 0.70 2.97 -0.72 0.00 -0.80 -4.98 105.19 103.77 1xnf n GLY 76 Ca 0.17 -0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 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 6.05 0.16 0.99 4.77 0.01 -4.85 117.00 124.13 1xnf n LEU 77 Ca 0.00 -5.23 0.05 0.00 -0.03 0.00 0.00 56.01 50.80 1xnf n LEU 77 Cb 0.00 -1.22 0.15 0.00 -2.33 0.00 0.00 43.42 40.01 1xnf n LEU 77 CO 0.00 1.71 0.57 0.03 -1.33 0.00 0.00 177.39 178.37 1xnf h ARG 78 N 5.40 0.00 -0.11 3.23 3.08 -1.89 -1.25 114.38 122.84 1xnf h ARG 78 Ca 0.20 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 60.03 1xnf h ARG 78 Cb 0.64 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.70 1xnf h ARG 78 CO 1.25 0.41 -0.79 0.00 -1.07 0.00 0.00 179.97 179.77 1xnf h ALA 79 N 1.59 0.39 -0.23 0.04 0.00 -1.96 -1.31 119.26 117.77 1xnf h ALA 79 Ca -0.00 -0.61 -0.10 0.00 0.00 0.00 0.00 54.91 54.19 1xnf h ALA 79 Cb 1.20 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1xnf h ALA 79 CO 0.05 0.71 -0.29 -0.07 0.00 0.00 0.00 179.25 179.66 1xnf h LEU 80 N 0.44 0.46 -0.04 0.00 3.38 -1.94 -1.46 115.31 116.14 1xnf h LEU 80 Ca -0.05 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 1xnf h LEU 80 Cb 1.41 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 42.03 1xnf h LEU 80 CO 0.15 0.74 0.01 0.00 0.09 0.00 0.00 178.44 179.43 1xnf h ALA 81 N 1.30 0.06 -0.32 1.53 0.00 -1.13 -2.15 119.26 118.55 1xnf h ALA 81 Ca 0.05 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1xnf h ALA 81 Cb 0.71 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1xnf h ALA 81 CO 0.05 -0.32 0.01 -0.09 0.00 0.00 0.00 179.25 178.90 1xnf h ARG 82 N -0.16 0.49 0.15 0.00 2.43 -1.05 0.43 114.38 116.68 1xnf h ARG 82 Ca 0.01 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 1xnf h ARG 82 Cb 0.24 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.71 1xnf h ARG 82 CO 0.00 0.51 -0.14 -0.97 -1.51 0.00 0.00 179.97 177.87 1xnf h ASN 83 N 0.48 -0.36 -0.32 -3.80 -1.24 -1.01 -0.32 115.58 109.01 1xnf h ASN 83 Ca 0.10 0.03 0.00 0.00 0.71 0.00 0.00 56.30 57.15 1xnf h ASN 83 Cb 0.30 0.12 -0.02 0.00 0.73 0.00 0.00 38.32 39.45 1xnf h ASN 83 CO 0.01 -0.21 0.21 0.44 -1.29 0.00 0.00 177.43 176.59 1xnf h ASP 84 N -0.31 0.37 -0.67 1.15 3.32 -0.71 -2.04 116.42 117.53 1xnf h ASP 84 Ca -0.00 -0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.06 1xnf h ASP 84 Cb 0.29 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 39.71 1xnf h ASP 84 CO -0.03 0.27 0.43 -0.26 -1.72 0.00 0.00 179.24 177.93 1xnf h PHE 85 N 0.43 0.80 -0.36 4.55 0.05 -0.73 0.16 116.94 121.84 1xnf h PHE 85 Ca 0.12 0.02 -0.10 0.00 3.82 0.00 0.00 57.97 61.83 1xnf h PHE 85 Cb -0.05 -0.26 -0.01 0.00 2.00 0.00 0.00 35.95 37.63 1xnf h PHE 85 CO -0.05 0.47 -0.17 0.77 -0.18 0.00 0.00 178.31 179.14 1xnf h SER 86 N 0.84 0.78 -0.88 2.17 0.02 -0.89 -1.15 113.55 114.44 1xnf h SER 86 Ca 0.27 -0.40 -0.01 0.00 -0.84 0.00 0.00 61.79 60.80 1xnf h SER 86 Cb -0.01 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 62.27 1xnf h SER 86 CO -0.09 1.01 0.52 1.56 -1.14 0.00 0.00 176.83 178.68 1xnf h GLN 87 N 0.54 1.21 -0.19 3.45 4.20 -1.20 -1.96 115.11 121.16 1xnf h GLN 87 Ca 0.08 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 1xnf h GLN 87 Cb 0.71 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 1xnf h GLN 87 CO 0.05 0.86 0.07 0.00 -0.67 0.00 0.00 178.83 179.14 1xnf h ALA 88 N 1.28 0.24 -0.21 3.87 0.00 -0.57 -2.56 119.26 121.32 1xnf h ALA 88 Ca 0.31 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 55.15 1xnf h ALA 88 Cb -0.03 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1xnf h ALA 88 CO -0.06 -0.16 0.15 1.25 0.00 0.00 0.00 179.25 180.43 1xnf h LEU 89 N 0.15 0.11 -0.50 0.00 5.85 -1.11 0.13 115.31 119.94 1xnf h LEU 89 Ca 0.06 -0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.62 1xnf h LEU 89 Cb 0.18 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 1xnf h LEU 89 CO -0.01 0.08 -0.50 0.00 -0.34 0.00 0.00 178.44 177.68 1xnf h ALA 90 N 1.89 0.68 0.10 1.25 0.00 -0.96 -2.62 119.26 119.59 1xnf h ALA 90 Ca 0.09 -0.49 -0.29 0.00 0.00 0.00 0.00 54.91 54.22 1xnf h ALA 90 Cb 0.20 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 17.93 1xnf h ALA 90 CO -0.01 0.68 -1.20 0.82 0.00 0.00 0.00 179.25 179.54 1xnf h ILE 91 N 0.51 1.31 -2.73 0.00 2.04 -1.07 -3.42 117.51 114.15 1xnf h ILE 91 Ca 0.02 -2.48 -0.57 0.00 1.00 0.00 0.00 64.86 62.83 1xnf h ILE 91 Cb 1.05 2.65 -0.39 0.00 -0.74 0.00 0.00 36.82 39.38 1xnf h ILE 91 CO 0.10 0.75 -0.81 -0.60 0.00 0.00 0.00 178.15 177.59 1xnf s ARG 92 N -3.02 0.59 0.49 2.37 3.52 0.39 -4.97 118.95 118.30 1xnf s ARG 92 Ca -0.09 -1.23 0.32 0.00 -0.13 0.00 0.00 55.73 54.60 1xnf s ARG 92 Cb 0.06 -1.47 1.46 0.00 -1.56 0.00 0.00 34.95 33.44 1xnf s ARG 92 CO 0.92 -1.14 1.97 -1.35 -0.81 0.00 0.00 175.30 174.88 1xnf h PRO 93 N 7.36 0.00 -5.46 5.12 0.11 -1.73 -3.36 132.00 134.05 1xnf h PRO 93 Ca -0.02 0.00 -0.61 0.00 0.11 0.00 0.00 66.00 65.48 1xnf h PRO 93 Cb 0.98 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 31.97 1xnf h PRO 93 CO 0.35 0.00 0.01 0.34 -0.21 0.00 0.00 178.00 178.49 1xnf s ASP 94 N -5.12 6.51 0.00 -2.05 2.15 -1.26 -5.04 116.67 111.86 1xnf s ASP 94 Ca 0.00 0.62 0.00 0.00 0.43 0.00 0.00 52.55 53.61 1xnf s ASP 94 Cb 0.10 -2.30 0.00 0.00 -0.30 0.00 0.00 42.92 40.42 1xnf s ASP 94 CO 0.46 -0.26 0.00 -0.81 -0.17 0.00 0.00 175.17 174.38 1xnf n PRO 96 N 5.29 0.00 -0.26 4.34 -0.04 -1.26 -5.07 135.00 137.99 1xnf n PRO 96 Ca -0.04 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.48 1xnf n PRO 96 Cb 0.50 -0.19 0.28 0.00 -0.04 0.00 0.00 33.50 34.05 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 0.90 0.02 0.54 3.07 -1.99 -1.09 114.58 116.02 1xnf h GLU 97 Ca 0.00 -0.05 -0.10 0.00 -0.50 0.00 0.00 59.36 58.71 1xnf h GLU 97 Cb 0.00 -0.20 0.01 0.00 -0.84 0.00 0.00 28.75 27.72 1xnf h GLU 97 CO 0.00 0.60 -0.39 0.28 -1.40 0.00 0.00 179.01 178.10 1xnf h VAL 98 N 0.93 1.53 -0.79 3.13 2.07 -1.97 -3.03 116.25 118.11 1xnf h VAL 98 Ca 0.37 -2.08 0.06 0.00 0.82 0.00 0.00 66.70 65.87 1xnf h VAL 98 Cb 0.25 2.82 -0.05 0.00 -1.52 0.00 0.00 31.29 32.79 1xnf h VAL 98 CO -0.14 0.58 0.52 -0.26 0.02 0.00 0.00 177.57 178.29 1xnf h PHE 99 N -0.42 0.87 0.16 1.57 0.04 -1.74 -0.16 116.94 117.26 1xnf h PHE 99 Ca -0.05 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.73 1xnf h PHE 99 Cb 1.16 -0.29 -0.00 0.00 2.20 0.00 0.00 35.95 39.02 1xnf h PHE 99 CO 0.18 0.46 -0.09 -0.97 -0.60 0.00 0.00 178.31 177.29 1xnf h ASN 100 N 0.86 -0.22 -0.91 2.17 -1.24 -1.29 0.38 115.58 115.34 1xnf h ASN 100 Ca 0.34 0.01 0.01 0.00 0.71 0.00 0.00 56.30 57.37 1xnf h ASN 100 Cb 0.22 0.06 -0.05 0.00 0.73 0.00 0.00 38.32 39.29 1xnf h ASN 100 CO -0.12 -0.15 0.61 1.88 -1.29 0.00 0.00 177.43 178.36 1xnf h TYR 101 N -0.24 1.15 -0.42 0.67 -1.99 -1.34 -0.56 116.97 114.25 1xnf h TYR 101 Ca -0.02 0.03 -0.06 0.00 2.00 0.00 0.00 58.73 60.68 1xnf h TYR 101 Cb 0.19 -0.39 -0.02 0.00 2.00 0.00 0.00 36.73 38.51 1xnf h TYR 101 CO -0.08 0.72 -0.00 -0.07 -0.00 0.00 0.00 178.16 178.73 1xnf h LEU 102 N 1.24 0.65 -0.53 3.88 3.38 -0.69 0.54 115.31 123.78 1xnf h LEU 102 Ca 0.33 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 1xnf h LEU 102 Cb -0.14 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.41 1xnf h LEU 102 CO -0.07 0.72 0.27 1.23 0.09 0.00 0.00 178.44 180.68 1xnf h GLY 103 N 0.93 0.81 0.97 0.83 0.00 0.32 -0.84 103.07 106.09 1xnf h GLY 103 Ca 0.13 -0.39 0.01 0.00 0.00 0.00 0.00 47.33 47.08 1xnf h GLY 103 CO 0.02 0.37 0.35 -2.22 0.00 0.00 0.00 176.54 175.05 1xnf h ILE 104 N 0.71 1.12 -0.50 2.60 2.04 -0.09 -1.05 117.51 122.33 1xnf h ILE 104 Ca 0.18 -0.24 -0.07 0.00 1.00 0.00 0.00 64.86 65.73 1xnf h ILE 104 Cb 0.09 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 36.50 1xnf h ILE 104 CO -0.03 0.13 0.01 1.88 0.00 0.00 0.00 178.15 180.14 1xnf h TYR 105 N 0.71 0.89 -0.71 1.37 0.05 -0.72 0.22 116.97 118.77 1xnf h TYR 105 Ca 0.20 -0.12 -0.06 0.00 0.05 0.00 0.00 58.73 58.80 1xnf h TYR 105 Cb -0.05 -0.24 -0.03 0.00 1.01 0.00 0.00 36.73 37.41 1xnf h TYR 105 CO -0.04 0.81 0.22 -0.07 -1.05 0.00 0.00 178.16 178.02 1xnf h LEU 106 N 0.78 1.03 -0.28 3.88 3.38 -0.81 -0.50 115.31 122.80 1xnf h LEU 106 Ca 0.15 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 1xnf h LEU 106 Cb 0.45 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1xnf h LEU 106 CO 0.02 0.97 0.11 0.74 0.09 0.00 0.00 178.44 180.37 1xnf h THR 107 N 1.06 1.17 -0.72 0.22 2.02 -0.50 0.51 112.91 116.67 1xnf h THR 107 Ca 0.23 -0.53 0.09 0.00 0.77 0.00 0.00 66.41 66.97 1xnf h THR 107 Cb 0.31 1.00 -0.05 0.00 -1.74 0.00 0.00 68.15 67.67 1xnf h THR 107 CO -0.01 0.18 0.48 1.56 0.37 0.00 0.00 175.52 178.10 1xnf h GLN 108 N 0.30 0.63 -0.00 6.66 4.20 -0.63 -0.40 115.11 125.87 1xnf h GLN 108 Ca 0.09 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.77 1xnf h GLN 108 Cb 0.18 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.81 1xnf h GLN 108 CO -0.01 0.42 -0.05 0.00 -0.67 0.00 0.00 178.83 178.52 1xnf n ALA 109 N -2.46 2.65 -0.70 3.87 0.00 -0.23 -4.85 120.51 118.79 1xnf n ALA 109 Ca 0.12 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1xnf n ALA 109 Cb 0.31 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.35 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 1.24 0.68 3.04 0.00 0.00 -0.16 -4.97 105.19 105.02 1xnf n GLY 110 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 1xnf n GLY 110 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xnf n ASN 111 N 0.00 6.31 -0.02 1.61 3.02 0.11 -4.85 115.26 121.45 1xnf n ASN 111 Ca 0.00 -3.37 -0.13 0.00 -0.03 0.00 0.00 54.58 51.05 1xnf n ASN 111 Cb 0.00 -1.28 -0.01 0.00 -0.61 0.00 0.00 39.78 37.88 1xnf n ASN 111 CO 0.00 0.00 0.00 -0.26 -2.62 0.00 0.00 177.26 174.38 1xnf h PHE 112 N 5.57 0.89 -0.40 3.10 -1.00 -1.89 -0.68 116.94 122.54 1xnf h PHE 112 Ca 0.20 -0.35 0.02 0.00 2.81 0.00 0.00 57.97 60.65 1xnf h PHE 112 Cb 0.64 -0.15 -0.03 0.00 3.61 0.00 0.00 35.95 40.02 1xnf h PHE 112 CO 0.98 1.14 0.23 -0.44 -1.61 0.00 0.00 178.31 178.61 1xnf h ASP 113 N 0.50 0.36 0.27 2.17 3.32 -1.94 -0.43 116.42 120.68 1xnf h ASP 113 Ca -0.01 0.01 -0.10 0.00 0.02 0.00 0.00 57.03 56.95 1xnf h ASP 113 Cb 1.23 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.70 1xnf h ASP 113 CO 0.13 0.26 -0.39 0.00 -1.72 0.00 0.00 179.24 177.52 1xnf h ALA 114 N 1.18 1.21 -0.48 3.45 0.00 -1.92 -2.22 119.26 120.48 1xnf h ALA 114 Ca 0.16 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1xnf h ALA 114 Cb 0.02 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1xnf h ALA 114 CO -0.08 0.55 0.27 0.00 0.00 0.00 0.00 179.25 179.98 1xnf h ALA 115 N 1.47 0.62 -0.82 0.00 0.00 -0.41 -1.68 119.26 118.43 1xnf h ALA 115 Ca 0.01 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 54.88 1xnf h ALA 115 Cb 0.75 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 1xnf h ALA 115 CO 0.06 0.13 0.52 1.88 0.00 0.00 0.00 179.25 181.83 1xnf h TYR 116 N 0.64 0.96 -0.55 0.00 0.99 -0.50 -1.14 116.97 117.36 1xnf h TYR 116 Ca 0.17 0.03 -0.09 0.00 2.00 0.00 0.00 58.73 60.84 1xnf h TYR 116 Cb 0.04 -0.31 -0.02 0.00 1.00 0.00 0.00 36.73 37.43 1xnf h TYR 116 CO -0.02 0.53 -0.01 1.49 -0.00 0.00 0.00 178.16 180.15 1xnf h GLU 117 N 0.98 0.96 -0.64 4.88 4.81 -1.11 0.76 114.58 125.23 1xnf h GLU 117 Ca 0.34 -0.29 -0.07 0.00 -0.13 0.00 0.00 59.36 59.20 1xnf h GLU 117 Cb 0.06 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.32 1xnf h GLU 117 CO -0.13 0.96 0.13 0.00 -0.73 0.00 0.00 179.01 179.24 1xnf h ALA 118 N 1.09 0.84 -0.02 2.92 0.00 -0.31 -1.30 119.26 122.48 1xnf h ALA 118 Ca 0.16 -0.25 -0.17 0.00 0.00 0.00 0.00 54.91 54.66 1xnf h ALA 118 Cb 0.53 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1xnf h ALA 118 CO 0.03 0.58 -0.74 0.74 0.00 0.00 0.00 179.25 179.85 1xnf h PHE 119 N 0.95 0.19 -0.36 0.00 0.05 -0.83 -1.52 116.94 115.42 1xnf h PHE 119 Ca 0.20 -0.09 0.07 0.00 3.82 0.00 0.00 57.97 61.96 1xnf h PHE 119 Cb 0.39 -0.03 -0.06 0.00 2.00 0.00 0.00 35.95 38.26 1xnf h PHE 119 CO 0.03 0.83 -0.01 -0.44 -0.18 0.00 0.00 178.31 178.54 1xnf h ASP 120 N 0.09 -0.17 -0.82 2.17 5.19 -0.57 -1.88 116.42 120.43 1xnf h ASP 120 Ca -0.02 0.09 -0.00 0.00 -0.62 0.00 0.00 57.03 56.47 1xnf h ASP 120 Cb 1.31 0.16 -0.04 0.00 0.18 0.00 0.00 39.33 40.93 1xnf h ASP 120 CO 0.11 -0.05 0.50 0.28 -3.12 0.00 0.00 179.24 176.96 1xnf h SER 121 N 0.09 0.98 -0.26 6.45 0.02 -0.88 -1.36 113.55 118.60 1xnf h SER 121 Ca 0.18 -0.06 0.06 0.00 -0.84 0.00 0.00 61.79 61.13 1xnf h SER 121 Cb 0.25 -0.25 -0.07 0.00 0.14 0.00 0.00 62.40 62.47 1xnf h SER 121 CO -0.30 0.75 -0.28 0.58 -1.14 0.00 0.00 176.83 176.44 1xnf h VAL 122 N 1.12 0.33 0.00 2.27 2.07 -0.98 -0.20 116.25 120.86 1xnf h VAL 122 Ca 0.29 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.77 1xnf h VAL 122 Cb -0.05 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.04 1xnf h VAL 122 CO -0.06 0.00 -0.21 -0.07 0.02 0.00 0.00 177.57 177.25 1xnf h LEU 123 N -0.28 0.00 -0.09 2.57 3.38 -0.79 0.19 115.31 120.29 1xnf h LEU 123 Ca 0.14 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.88 1xnf h LEU 123 Cb 0.50 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.26 1xnf h LEU 123 CO -0.42 0.21 -0.83 -0.08 0.09 0.00 0.00 178.44 177.42 1xnf h GLU 124 N 0.00 0.72 -0.40 1.13 4.81 -1.08 -1.04 114.58 118.72 1xnf h GLU 124 Ca -0.00 -0.65 -0.11 0.00 -0.13 0.00 0.00 59.36 58.46 1xnf h GLU 124 Cb 1.03 0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.55 1xnf h GLU 124 CO 0.03 1.25 -0.21 -0.07 -0.73 0.00 0.00 179.01 179.28 1xnf h LEU 125 N 0.42 0.79 -6.07 1.64 3.38 -0.58 -3.42 115.31 111.46 1xnf h LEU 125 Ca -0.08 -0.28 -0.12 0.00 0.09 0.00 0.00 57.88 57.49 1xnf h LEU 125 Cb 1.47 -0.22 -0.22 0.00 0.09 0.00 0.00 40.66 41.79 1xnf h LEU 125 CO 0.17 0.99 -0.49 -0.62 0.09 0.00 0.00 178.44 178.57 1xnf s ASP 126 N -6.75 -0.98 0.37 -0.43 2.15 0.63 -5.00 116.67 106.66 1xnf s ASP 126 Ca -0.09 -0.88 0.23 0.00 0.43 0.00 0.00 52.55 52.24 1xnf s ASP 126 Cb 0.13 1.68 1.28 0.00 -0.30 0.00 0.00 42.92 45.71 1xnf s ASP 126 CO 0.84 -0.20 1.70 -0.65 -0.17 0.00 0.00 175.17 176.69 1xnf h PRO 127 N 7.08 0.00 -0.01 4.34 0.11 -1.40 0.60 132.00 142.72 1xnf h PRO 127 Ca 0.04 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.15 1xnf h PRO 127 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1xnf h PRO 127 CO 0.12 0.00 -0.24 0.25 -0.21 0.00 0.00 178.00 177.92 1xnf n THR 128 N -2.34 0.00 -1.86 -1.15 -2.24 -1.26 -4.63 114.28 100.79 1xnf n THR 128 Ca -0.02 -0.10 -0.38 0.00 -2.27 0.00 0.00 64.05 61.28 1xnf n THR 128 Cb 0.09 0.28 -0.04 0.00 -2.10 0.00 0.00 70.33 68.56 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 -0.78 3.03 -0.27 4.78 4.19 0.20 -4.77 117.16 123.54 1xnf n TYR 129 Ca 0.12 -2.11 0.08 0.00 3.31 0.00 0.00 57.90 59.31 1xnf n TYR 129 Cb 0.33 -2.35 0.23 0.00 0.49 0.00 0.00 39.34 38.05 1xnf n TYR 129 CO 0.00 0.00 0.00 -0.97 0.91 0.00 0.00 176.86 176.80 1xnf h ASN 130 N 8.12 0.20 0.20 2.98 -0.00 -1.86 -0.49 115.58 124.73 1xnf h ASN 130 Ca 0.39 0.14 0.00 0.00 -0.00 0.00 0.00 56.30 56.82 1xnf h ASN 130 Cb 0.80 0.14 0.00 0.00 -0.00 0.00 0.00 38.32 39.26 1xnf h ASN 130 CO 1.60 0.02 0.00 1.88 -0.00 0.00 0.00 177.43 180.93 1xnf h TYR 131 N 0.37 0.00 -0.06 0.67 -1.99 -1.99 0.32 116.97 114.29 1xnf h TYR 131 Ca 0.47 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 61.15 1xnf h TYR 131 Cb 0.82 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.54 1xnf h TYR 131 CO -0.19 0.00 -0.20 0.00 -0.00 0.00 0.00 178.16 177.77 1xnf h ALA 132 N 2.02 1.55 -0.28 3.88 0.00 -1.48 -0.03 119.26 124.92 1xnf h ALA 132 Ca 0.00 -0.22 -0.19 0.00 0.00 0.00 0.00 54.91 54.50 1xnf h ALA 132 Cb 0.10 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1xnf h ALA 132 CO 0.00 0.33 -0.57 0.45 0.00 0.00 0.00 179.25 179.47 1xnf h HIS 133 N 0.10 1.11 0.46 0.00 3.86 -1.09 0.77 115.15 120.35 1xnf h HIS 133 Ca 0.02 -0.40 -0.02 0.00 -1.16 0.00 0.00 60.37 58.81 1xnf h HIS 133 Cb 0.42 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 28.68 1xnf h HIS 133 CO 0.00 1.23 -0.28 1.25 0.86 0.00 0.00 177.93 180.99 1xnf h LEU 134 N 0.67 -0.71 -0.60 2.43 5.85 -1.46 -0.01 115.31 121.48 1xnf h LEU 134 Ca 0.01 0.04 -0.12 0.00 0.84 0.00 0.00 57.88 58.65 1xnf h LEU 134 Cb 1.18 0.21 -0.01 0.00 0.37 0.00 0.00 40.66 42.40 1xnf h LEU 134 CO 0.13 -0.45 -0.19 0.78 -0.34 0.00 0.00 178.44 178.37 1xnf h ASN 135 N -0.71 0.93 -0.40 1.25 -0.26 -0.98 0.01 115.58 115.42 1xnf h ASN 135 Ca -0.05 -0.33 -0.08 0.00 -0.56 0.00 0.00 56.30 55.28 1xnf h ASN 135 Cb 0.58 -0.25 -0.01 0.00 -1.06 0.00 0.00 38.32 37.57 1xnf h ASN 135 CO 0.05 1.09 -0.05 -0.09 -1.06 0.00 0.00 177.43 177.37 1xnf h ARG 136 N 0.80 0.74 -0.61 0.81 2.43 -0.82 -0.57 114.38 117.16 1xnf h ARG 136 Ca 0.11 -0.26 0.12 0.00 -0.81 0.00 0.00 59.98 59.14 1xnf h ARG 136 Cb 0.74 -0.05 -0.12 0.00 -0.42 0.00 0.00 29.97 30.12 1xnf h ARG 136 CO 0.06 0.85 -0.16 0.78 -1.51 0.00 0.00 179.97 179.99 1xnf h GLY 137 N 0.56 0.42 0.99 2.80 0.00 -0.61 0.16 103.07 107.39 1xnf h GLY 137 Ca 0.11 0.21 -0.04 0.00 0.00 0.00 0.00 47.33 47.60 1xnf h GLY 137 CO 0.03 -0.23 0.18 -2.22 0.00 0.00 0.00 176.54 174.29 1xnf h ILE 138 N -0.01 1.24 -0.57 2.60 2.04 -0.78 -0.02 117.51 122.01 1xnf h ILE 138 Ca 0.29 -0.79 -0.04 0.00 1.00 0.00 0.00 64.86 65.31 1xnf h ILE 138 Cb 0.45 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 1xnf h ILE 138 CO -0.63 0.30 0.17 0.00 0.00 0.00 0.00 178.15 177.99 1xnf h ALA 139 N 1.04 1.24 -0.30 1.87 0.00 -0.54 -0.84 119.26 121.72 1xnf h ALA 139 Ca 0.18 -0.19 -0.16 0.00 0.00 0.00 0.00 54.91 54.74 1xnf h ALA 139 Cb 0.28 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1xnf h ALA 139 CO -0.01 0.54 -0.45 -0.07 0.00 0.00 0.00 179.25 179.27 1xnf h LEU 140 N 0.83 0.85 0.02 0.00 -0.00 -0.36 0.21 115.31 116.85 1xnf h LEU 140 Ca 0.19 -0.41 0.02 0.00 -0.00 0.00 0.00 57.88 57.68 1xnf h LEU 140 Cb 0.25 -0.24 -0.02 0.00 -0.00 0.00 0.00 40.66 40.65 1xnf h LEU 140 CO -0.01 1.17 -0.11 0.22 -0.00 0.00 0.00 178.44 179.70 1xnf h TYR 141 N 0.63 -0.29 0.00 1.13 3.20 -0.70 0.30 116.97 121.24 1xnf h TYR 141 Ca 0.04 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.86 1xnf h TYR 141 Cb 1.02 0.13 -0.01 0.00 1.54 0.00 0.00 36.73 39.40 1xnf h TYR 141 CO 0.06 -0.17 -0.27 1.88 -1.64 0.00 0.00 178.16 178.01 1xnf h TYR 142 N -0.20 0.00 -0.05 -3.82 -1.99 -1.01 -1.21 116.97 108.69 1xnf h TYR 142 Ca 0.04 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.77 1xnf h TYR 142 Cb 0.25 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.98 1xnf h TYR 142 CO -0.17 0.27 0.00 0.41 -0.00 0.00 0.00 178.16 178.67 1xnf n GLY 143 N -0.56 -0.57 2.02 3.88 0.00 0.71 -4.92 105.19 105.75 1xnf n GLY 143 Ca -0.02 -0.23 -0.01 0.00 0.00 0.00 0.00 46.02 45.77 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 0.93 0.42 2.77 -0.02 0.00 -0.18 -4.98 105.19 104.14 1xnf n GLY 144 Ca 0.16 -1.05 -0.33 0.00 0.00 0.00 0.00 46.02 44.80 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 -2.81 3.03 -0.02 1.61 5.12 0.90 -4.92 116.66 119.57 1xnf n ARG 145 Ca -0.01 -4.59 -0.03 0.00 -1.93 0.00 0.00 57.85 51.30 1xnf n ARG 145 Cb 0.07 -2.36 0.22 0.00 -1.16 0.00 0.00 32.46 29.22 1xnf n ARG 145 CO 0.00 0.00 0.00 -0.44 -1.93 0.00 0.00 177.63 175.26 1xnf h ASP 146 N 5.02 0.55 -0.38 0.55 3.45 -1.89 0.07 116.42 123.79 1xnf h ASP 146 Ca 0.19 -0.15 -0.14 0.00 0.43 0.00 0.00 57.03 57.35 1xnf h ASP 146 Cb 0.69 -0.15 -0.01 0.00 -0.56 0.00 0.00 39.33 39.31 1xnf h ASP 146 CO 0.97 0.71 -0.33 0.11 -1.57 0.00 0.00 179.24 179.13 1xnf h LYS 147 N 0.52 0.90 -0.38 3.56 1.79 -1.91 -0.56 116.57 120.48 1xnf h LYS 147 Ca 0.09 -0.45 -0.13 0.00 -2.18 0.00 0.00 60.65 57.98 1xnf h LYS 147 Cb 0.53 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.17 1xnf h LYS 147 CO 0.03 1.10 -0.27 -0.07 -1.08 0.00 0.00 179.45 179.17 1xnf h LEU 148 N 0.71 0.83 -0.83 2.94 3.38 -1.92 -2.45 115.31 117.97 1xnf h LEU 148 Ca 0.07 -0.32 -0.05 0.00 0.09 0.00 0.00 57.88 57.66 1xnf h LEU 148 Cb 0.91 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.40 1xnf h LEU 148 CO 0.08 1.05 0.24 0.00 0.09 0.00 0.00 178.44 179.90 1xnf h ALA 149 N 1.00 1.05 -0.51 1.53 0.00 -0.80 -2.84 119.26 118.69 1xnf h ALA 149 Ca 0.08 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.71 1xnf h ALA 149 Cb 0.80 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1xnf h ALA 149 CO 0.07 0.65 0.02 0.37 0.00 0.00 0.00 179.25 180.36 1xnf h GLN 150 N 1.07 0.85 -0.26 0.00 4.15 -0.72 0.11 115.11 120.31 1xnf h GLN 150 Ca 0.24 -0.23 0.05 0.00 0.77 0.00 0.00 58.65 59.48 1xnf h GLN 150 Cb 0.28 -0.10 -0.05 0.00 0.21 0.00 0.00 27.48 27.82 1xnf h GLN 150 CO -0.01 0.83 -0.05 -0.44 -1.93 0.00 0.00 178.83 177.23 1xnf h ASP 151 N 0.79 -0.21 -0.36 -0.69 3.32 -1.21 0.51 116.42 118.57 1xnf h ASP 151 Ca 0.16 0.07 -0.16 0.00 0.02 0.00 0.00 57.03 57.12 1xnf h ASP 151 Cb 0.44 0.15 -0.00 0.00 0.22 0.00 0.00 39.33 40.14 1xnf h ASP 151 CO 0.02 -0.07 -0.41 0.44 -1.72 0.00 0.00 179.24 177.50 1xnf h ASP 152 N 0.02 0.99 -0.03 6.45 3.32 -1.32 -2.32 116.42 123.53 1xnf h ASP 152 Ca 0.13 -0.48 -0.17 0.00 0.02 0.00 0.00 57.03 56.52 1xnf h ASP 152 Cb 0.19 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.45 1xnf h ASP 152 CO -0.25 1.27 -0.58 -0.07 -1.72 0.00 0.00 179.24 177.88 1xnf h LEU 153 N 0.73 0.70 -0.75 1.55 3.38 -0.49 -0.62 115.31 119.82 1xnf h LEU 153 Ca 0.05 -0.39 0.01 0.00 0.09 0.00 0.00 57.88 57.64 1xnf h LEU 153 Cb 1.01 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.52 1xnf h LEU 153 CO 0.10 1.13 0.49 0.25 0.09 0.00 0.00 178.44 180.50 1xnf h LEU 154 N 0.47 0.85 -0.68 1.67 5.85 -0.02 0.11 115.31 123.55 1xnf h LEU 154 Ca 0.00 -0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.62 1xnf h LEU 154 Cb 1.15 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.94 1xnf h LEU 154 CO 0.11 0.61 0.11 0.00 -0.34 0.00 0.00 178.44 178.94 1xnf h ALA 155 N 1.28 0.90 -0.43 1.25 0.00 -1.21 -0.26 119.26 120.80 1xnf h ALA 155 Ca 0.28 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 1xnf h ALA 155 Cb -0.10 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 1xnf h ALA 155 CO -0.07 0.67 0.03 0.35 0.00 0.00 0.00 179.25 180.23 1xnf h PHE 156 N 1.04 0.79 -0.50 0.00 3.57 -0.91 -2.74 116.94 118.20 1xnf h PHE 156 Ca 0.21 -0.13 0.09 0.00 3.53 0.00 0.00 57.97 61.67 1xnf h PHE 156 Cb 0.44 -0.21 -0.08 0.00 2.79 0.00 0.00 35.95 38.89 1xnf h PHE 156 CO 0.03 0.78 0.02 -0.92 -2.23 0.00 0.00 178.31 176.00 1xnf h TYR 157 N 0.58 0.02 -0.47 0.41 3.20 -0.52 -2.41 116.97 117.77 1xnf h TYR 157 Ca 0.12 0.04 0.02 0.00 3.14 0.00 0.00 58.73 62.05 1xnf h TYR 157 Cb 0.44 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.76 1xnf h TYR 157 CO 0.03 -0.09 0.31 1.96 -1.64 0.00 0.00 178.16 178.74 1xnf h GLN 158 N 0.14 0.56 0.00 1.82 4.20 -0.76 -0.56 115.11 120.51 1xnf h GLN 158 Ca 0.25 -0.03 -0.05 0.00 0.06 0.00 0.00 58.65 58.88 1xnf h GLN 158 Cb 0.37 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 1xnf h GLN 158 CO -0.40 0.37 -0.22 -0.44 -0.67 0.00 0.00 178.83 177.48 1xnf h ASP 159 N 0.58 0.00 -1.36 1.46 3.32 -1.25 -3.38 116.42 115.79 1xnf h ASP 159 Ca 0.18 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 56.96 1xnf h ASP 159 Cb 0.02 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 39.35 1xnf h ASP 159 CO -0.04 0.22 -0.63 -0.67 -1.72 0.00 0.00 179.24 176.40 1xnf n ASP 160 N -3.63 -2.64 0.18 6.45 2.03 -0.32 -5.02 116.55 113.61 1xnf n ASP 160 Ca -0.01 -2.78 0.12 0.00 0.52 0.00 0.00 54.79 52.64 1xnf n ASP 160 Cb 0.35 1.12 0.62 0.00 -0.72 0.00 0.00 41.12 42.49 1xnf n ASP 160 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1xnf h PRO 161 N 5.15 0.00 -0.01 -0.67 0.11 -1.48 -1.97 132.00 133.13 1xnf h PRO 161 Ca 0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.22 1xnf h PRO 161 Cb 1.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1xnf h PRO 161 CO 0.11 0.00 -0.32 0.09 -0.21 0.00 0.00 178.00 177.68 1xnf n ASN 162 N -2.32 1.19 -4.56 -2.05 3.02 -1.26 -4.74 115.26 104.54 1xnf n ASN 162 Ca -0.02 -0.99 -0.43 0.00 -0.03 0.00 0.00 54.58 53.12 1xnf n ASN 162 Cb 0.08 0.21 -0.03 0.00 -0.61 0.00 0.00 39.78 39.44 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 -2.52 6.45 0.45 6.41 -1.08 -0.74 -4.72 116.67 120.91 1xnf s ASP 163 Ca 0.23 0.02 0.13 0.00 -0.52 0.00 0.00 52.55 52.40 1xnf s ASP 163 Cb 0.19 -2.50 1.00 0.00 -1.46 0.00 0.00 42.92 40.15 1xnf s ASP 163 CO 0.54 -1.31 2.03 1.55 0.52 0.00 0.00 175.17 178.49 1xnf h PRO 164 N 9.37 0.14 0.00 4.34 0.13 -1.88 -1.59 132.00 142.51 1xnf h PRO 164 Ca -0.25 -0.02 -0.04 0.00 -0.87 0.00 0.00 66.00 64.83 1xnf h PRO 164 Cb 1.06 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.16 1xnf h PRO 164 CO 1.13 0.21 -0.17 0.74 -0.23 0.00 0.00 178.00 179.67 1xnf h PHE 165 N 0.14 0.00 -0.37 1.56 -1.00 -1.90 -0.00 116.94 115.36 1xnf h PHE 165 Ca 0.03 0.00 -0.14 0.00 2.81 0.00 0.00 57.97 60.67 1xnf h PHE 165 Cb 0.19 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.74 1xnf h PHE 165 CO 0.00 0.17 -0.33 0.00 -1.61 0.00 0.00 178.31 176.54 1xnf h ARG 166 N 0.00 0.84 -0.24 1.51 3.08 -1.63 -1.36 114.38 116.58 1xnf h ARG 166 Ca -0.00 -0.40 -0.16 0.00 0.07 0.00 0.00 59.98 59.48 1xnf h ARG 166 Cb 0.37 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 1xnf h ARG 166 CO 0.02 1.04 -0.51 0.77 -1.07 0.00 0.00 179.97 180.22 1xnf h SER 167 N 0.70 0.74 -0.20 7.04 0.02 -1.43 -1.80 113.55 118.62 1xnf h SER 167 Ca 0.07 -0.38 -0.00 0.00 -0.84 0.00 0.00 61.79 60.64 1xnf h SER 167 Cb 0.89 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 63.21 1xnf h SER 167 CO 0.08 1.12 0.12 -0.07 -1.14 0.00 0.00 176.83 176.94 1xnf h LEU 168 N 0.53 0.25 -0.67 5.07 3.38 -0.82 -0.05 115.31 123.00 1xnf h LEU 168 Ca 0.02 -0.07 -0.09 0.00 0.09 0.00 0.00 57.88 57.83 1xnf h LEU 168 Cb 1.07 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.73 1xnf h LEU 168 CO 0.10 0.24 0.01 -0.50 0.09 0.00 0.00 178.44 178.38 1xnf h TRP 169 N 0.23 1.13 -0.69 1.13 4.06 -1.22 -0.43 115.95 120.17 1xnf h TRP 169 Ca 0.07 -0.19 0.02 0.00 2.06 0.00 0.00 58.89 60.85 1xnf h TRP 169 Cb 0.04 -0.30 -0.04 0.00 -1.00 0.00 0.00 29.16 27.87 1xnf h TRP 169 CO -0.04 0.99 0.44 1.25 -3.56 0.00 0.00 178.44 177.52 1xnf h LEU 170 N 0.96 0.74 -0.65 -4.49 5.85 -1.26 -1.39 115.31 115.07 1xnf h LEU 170 Ca 0.17 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.90 1xnf h LEU 170 Cb 0.54 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.36 1xnf h LEU 170 CO 0.03 0.53 0.42 0.22 -0.34 0.00 0.00 178.44 179.30 1xnf h TYR 171 N 0.88 0.80 -0.65 1.25 3.20 -0.68 0.02 116.97 121.79 1xnf h TYR 171 Ca 0.26 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.13 1xnf h TYR 171 Cb -0.04 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 37.93 1xnf h TYR 171 CO -0.03 0.49 0.33 -0.07 -1.64 0.00 0.00 178.16 177.24 1xnf h LEU 172 N 0.86 0.84 -0.70 2.82 -0.00 -0.61 0.13 115.31 118.64 1xnf h LEU 172 Ca 0.25 -0.12 -0.09 0.00 -0.00 0.00 0.00 57.88 57.91 1xnf h LEU 172 Cb -0.07 -0.21 -0.02 0.00 -0.00 0.00 0.00 40.66 40.36 1xnf h LEU 172 CO -0.07 0.72 -0.04 0.00 -0.00 0.00 0.00 178.44 179.05 1xnf h ALA 173 N 1.16 0.91 0.00 1.53 0.00 -0.91 -3.24 119.26 118.70 1xnf h ALA 173 Ca 0.23 -0.31 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 1xnf h ALA 173 Cb 0.08 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1xnf h ALA 173 CO -0.03 0.64 -0.63 0.93 0.00 0.00 0.00 179.25 180.16 1xnf h GLU 174 N 0.88 0.00 0.00 0.00 5.08 -0.25 -3.34 114.58 116.94 1xnf h GLU 174 Ca 0.15 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.47 1xnf h GLU 174 Cb 0.57 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 1xnf h GLU 174 CO 0.03 0.63 -0.21 -0.56 -1.00 0.00 0.00 179.01 177.90 1xnf h GLN 175 N 0.00 0.00 -0.15 2.33 -0.00 -0.79 0.43 115.11 116.93 1xnf h GLN 175 Ca -0.01 0.00 -0.19 0.00 -0.00 0.00 0.00 58.65 58.45 1xnf h GLN 175 Cb 1.42 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.90 1xnf h GLN 175 CO 0.08 0.21 -0.69 0.87 -0.00 0.00 0.00 178.83 179.31 1xnf h LYS 176 N 0.00 0.60 -0.08 0.06 1.57 -1.71 -3.18 116.57 113.83 1xnf h LYS 176 Ca -0.00 -0.45 -0.11 0.00 -1.87 0.00 0.00 60.65 58.21 1xnf h LYS 176 Cb 0.56 0.08 0.01 0.00 0.08 0.00 0.00 32.23 32.96 1xnf h LYS 176 CO 0.03 1.07 -0.40 -0.07 -0.57 0.00 0.00 179.45 179.52 1xnf h LEU 177 N 0.43 0.49 -6.15 2.94 3.38 -1.62 -3.44 115.31 111.34 1xnf h LEU 177 Ca -0.02 -0.65 -0.10 0.00 0.09 0.00 0.00 57.88 57.20 1xnf h LEU 177 Cb 1.27 -0.14 -0.24 0.00 0.09 0.00 0.00 40.66 41.64 1xnf h LEU 177 CO 0.13 1.06 -0.47 -0.62 0.09 0.00 0.00 178.44 178.62 1xnf s ASP 178 N -6.51 -0.63 0.16 -0.43 -1.08 0.09 -5.04 116.67 103.23 1xnf s ASP 178 Ca -0.14 -0.30 -0.12 0.00 -0.52 0.00 0.00 52.55 51.48 1xnf s ASP 178 Cb 0.04 1.56 0.03 0.00 -1.46 0.00 0.00 42.92 43.09 1xnf s ASP 178 CO 0.80 -0.30 1.61 -0.08 0.52 0.00 0.00 175.17 177.72 1xnf h GLU 179 N 7.86 0.91 -0.13 4.34 4.81 -1.74 0.10 114.58 130.73 1xnf h GLU 179 Ca -0.03 -0.28 -0.00 0.00 -0.13 0.00 0.00 59.36 58.92 1xnf h GLU 179 Cb 1.15 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.44 1xnf h GLU 179 CO 0.19 0.93 0.07 0.87 -0.73 0.00 0.00 179.01 180.34 1xnf h LYS 180 N 0.78 0.18 -0.74 1.92 1.57 -1.94 0.03 116.57 118.38 1xnf h LYS 180 Ca 0.15 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.86 1xnf h LYS 180 Cb 0.51 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.75 1xnf h LYS 180 CO 0.02 0.22 0.27 0.37 -0.57 0.00 0.00 179.45 179.76 1xnf h GLN 181 N 0.09 1.12 -0.65 3.15 5.75 -1.89 -1.42 115.11 121.27 1xnf h GLN 181 Ca 0.04 -0.21 -0.02 0.00 -0.15 0.00 0.00 58.65 58.31 1xnf h GLN 181 Cb 0.10 -0.18 -0.03 0.00 1.07 0.00 0.00 27.48 28.44 1xnf h GLN 181 CO -0.01 0.93 0.34 0.00 -2.65 0.00 0.00 178.83 177.44 1xnf h ALA 182 N 1.20 0.83 -0.60 3.38 0.00 -0.28 -0.56 119.26 123.23 1xnf h ALA 182 Ca 0.24 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 1xnf h ALA 182 Cb 0.25 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1xnf h ALA 182 CO -0.01 0.37 0.18 0.87 0.00 0.00 0.00 179.25 180.65 1xnf h LYS 183 N 0.88 0.92 -0.32 0.00 1.57 -0.87 -0.08 116.57 118.67 1xnf h LYS 183 Ca 0.22 -0.18 -0.17 0.00 -1.87 0.00 0.00 60.65 58.66 1xnf h LYS 183 Cb 0.07 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.24 1xnf h LYS 183 CO -0.03 0.80 -0.47 1.49 -0.57 0.00 0.00 179.45 180.67 1xnf h GLU 184 N 0.89 0.87 -0.64 3.15 4.57 -0.72 -0.51 114.58 122.18 1xnf h GLU 184 Ca 0.20 -0.50 -0.07 0.00 -1.18 0.00 0.00 59.36 57.81 1xnf h GLU 184 Cb 0.27 0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.87 1xnf h GLU 184 CO -0.01 1.14 0.13 0.28 -1.18 0.00 0.00 179.01 179.38 1xnf h VAL 185 N 0.69 1.26 -0.87 0.32 2.07 -0.93 -1.97 116.25 116.83 1xnf h VAL 185 Ca 0.04 -0.97 -0.01 0.00 0.82 0.00 0.00 66.70 66.58 1xnf h VAL 185 Cb 1.06 0.66 -0.04 0.00 -1.52 0.00 0.00 31.29 31.45 1xnf h VAL 185 CO 0.11 0.36 0.50 0.25 0.02 0.00 0.00 177.57 178.81 1xnf h LEU 186 N 0.95 1.06 -0.44 2.57 6.46 -0.73 0.22 115.31 125.40 1xnf h LEU 186 Ca 0.20 -0.08 -0.02 0.00 -0.12 0.00 0.00 57.88 57.85 1xnf h LEU 186 Cb 0.39 -0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 40.03 1xnf h LEU 186 CO 0.01 0.84 0.18 0.50 -0.62 0.00 0.00 178.44 179.34 1xnf h LYS 187 N 1.20 0.66 -0.52 1.25 3.64 -0.91 0.17 116.57 122.06 1xnf h LYS 187 Ca 0.31 -0.12 -0.07 0.00 -1.27 0.00 0.00 60.65 59.50 1xnf h LYS 187 Cb -0.01 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.68 1xnf h LYS 187 CO -0.05 0.60 0.05 1.96 -2.27 0.00 0.00 179.45 179.74 1xnf h GLN 188 N 0.57 0.88 -0.70 1.90 4.20 -0.74 -0.28 115.11 120.92 1xnf h GLN 188 Ca 0.15 -0.25 -0.04 0.00 0.06 0.00 0.00 58.65 58.57 1xnf h GLN 188 Cb 0.19 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.84 1xnf h GLN 188 CO -0.01 0.88 0.29 0.45 -0.67 0.00 0.00 178.83 179.76 1xnf h HIS 189 N 0.75 1.04 0.15 2.96 3.86 -0.08 -0.03 115.15 123.81 1xnf h HIS 189 Ca 0.15 -0.06 -0.01 0.00 -1.16 0.00 0.00 60.37 59.29 1xnf h HIS 189 Cb 0.45 -0.32 0.00 0.00 1.06 0.00 0.00 27.41 28.60 1xnf h HIS 189 CO 0.03 0.79 -0.07 0.35 0.86 0.00 0.00 177.93 179.89 1xnf h PHE 190 N 1.02 -0.19 -0.51 2.45 3.57 -0.39 -1.68 116.94 121.21 1xnf h PHE 190 Ca 0.24 -0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.84 1xnf h PHE 190 Cb 0.18 0.06 -0.09 0.00 2.79 0.00 0.00 35.95 38.90 1xnf h PHE 190 CO 0.02 -0.01 -0.03 1.49 -2.23 0.00 0.00 178.31 177.55 1xnf h GLU 191 N -0.33 0.09 0.00 1.11 4.22 -0.76 -1.98 114.58 116.93 1xnf h GLU 191 Ca -0.02 -0.01 -0.02 0.00 0.08 0.00 0.00 59.36 59.39 1xnf h GLU 191 Cb 0.26 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.49 1xnf h GLU 191 CO 0.03 0.06 -0.09 0.87 -2.18 0.00 0.00 179.01 177.70 1xnf h LYS 192 N 0.09 0.00 -7.44 1.92 1.57 -0.86 -3.45 116.57 108.39 1xnf h LYS 192 Ca 0.26 0.00 -0.49 0.00 -1.87 0.00 0.00 60.65 58.55 1xnf h LYS 192 Cb 0.40 0.00 0.09 0.00 0.08 0.00 0.00 32.23 32.80 1xnf h LYS 192 CO -0.45 0.09 0.38 -1.54 -0.57 0.00 0.00 179.45 177.36 1xnf s SER 193 N -6.00 5.07 0.12 0.86 1.04 -0.64 -4.95 113.70 109.20 1xnf s SER 193 Ca 0.03 1.23 0.25 0.00 0.48 0.00 0.00 55.95 57.93 1xnf s SER 193 Cb 0.08 -2.01 0.96 0.00 0.10 0.00 0.00 66.02 65.16 1xnf s SER 193 CO 0.61 -1.59 1.78 -0.90 0.98 0.00 0.00 173.24 174.11 1xnf n ASP 194 N -3.18 0.40 -1.09 7.02 5.68 -1.26 -4.91 116.55 119.20 1xnf n ASP 194 Ca 0.07 0.55 -0.14 0.00 -0.50 0.00 0.00 54.79 54.77 1xnf n ASP 194 Cb 0.57 -0.65 -0.06 0.00 -1.14 0.00 0.00 41.12 39.83 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 -1.89 -1.19 -0.06 0.11 5.02 -1.26 -4.90 118.16 113.99 1xnf n LYS 195 Ca 0.05 0.99 -0.15 0.00 -2.02 0.00 0.00 58.31 57.18 1xnf n LYS 195 Cb 0.33 -5.18 -0.13 0.00 -0.02 0.00 0.00 35.03 30.04 1xnf n LYS 195 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1xnf h GLU 196 N 0.03 0.02 -7.11 1.97 4.39 -1.90 -3.47 114.58 108.51 1xnf h GLU 196 Ca -0.29 -0.04 -0.51 0.00 0.34 0.00 0.00 59.36 58.86 1xnf h GLU 196 Cb 1.03 0.02 0.09 0.00 -0.10 0.00 0.00 28.75 29.78 1xnf h GLU 196 CO 0.43 1.02 0.43 -0.65 -1.16 0.00 0.00 179.01 179.08 1xnf s GLN 197 N -2.25 3.14 0.38 2.33 -0.21 -1.26 -4.92 119.66 116.87 1xnf s GLN 197 Ca -0.20 1.62 0.06 0.00 0.02 0.00 0.00 55.36 56.86 1xnf s GLN 197 Cb -0.02 -1.97 0.77 0.00 1.00 0.00 0.00 33.01 32.79 1xnf s GLN 197 CO 0.69 -1.03 1.99 2.35 -2.12 0.00 0.00 175.29 177.18 1xnf h TRP 198 N 0.87 0.52 -0.29 0.91 7.01 -1.97 -1.93 115.95 121.06 1xnf h TRP 198 Ca -0.49 -0.01 0.08 0.00 2.11 0.00 0.00 58.89 60.58 1xnf h TRP 198 Cb 1.27 -0.17 -0.01 0.00 -2.10 0.00 0.00 29.16 28.15 1xnf h TRP 198 CO 0.51 0.40 0.36 0.78 -2.79 0.00 0.00 178.44 177.69 1xnf h GLY 199 N 0.66 0.00 2.00 2.65 0.00 -1.97 0.52 103.07 106.93 1xnf h GLY 199 Ca 0.13 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.46 1xnf h GLY 199 CO -0.02 0.00 -0.03 1.49 0.00 0.00 0.00 176.54 177.99 1xnf h TRP 200 N 0.00 0.00 -0.79 5.60 4.06 -1.69 -1.60 115.95 121.53 1xnf h TRP 200 Ca 0.14 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.06 1xnf h TRP 200 Cb 0.85 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.98 1xnf h TRP 200 CO 0.00 0.03 0.38 -0.91 -3.56 0.00 0.00 178.44 174.38 1xnf h ASN 201 N 0.00 1.03 -0.49 -3.49 2.35 -1.09 0.11 115.58 114.00 1xnf h ASN 201 Ca -0.00 -0.13 -0.10 0.00 -0.55 0.00 0.00 56.30 55.52 1xnf h ASN 201 Cb 0.10 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.19 1xnf h ASN 201 CO 0.00 0.87 -0.07 0.40 -1.65 0.00 0.00 177.43 176.99 1xnf h ILE 202 N 1.11 1.27 -0.95 2.81 2.04 -1.45 -1.30 117.51 121.05 1xnf h ILE 202 Ca 0.27 -1.18 0.02 0.00 1.00 0.00 0.00 64.86 64.97 1xnf h ILE 202 Cb 0.12 1.04 -0.05 0.00 -0.74 0.00 0.00 36.82 37.19 1xnf h ILE 202 CO -0.03 0.41 0.63 0.58 0.00 0.00 0.00 178.15 179.73 1xnf h VAL 203 N 0.76 1.22 -0.58 1.67 2.07 -0.91 -0.12 116.25 120.36 1xnf h VAL 203 Ca 0.13 -0.43 -0.04 0.00 0.82 0.00 0.00 66.70 67.17 1xnf h VAL 203 Cb 0.61 -0.15 -0.03 0.00 -1.52 0.00 0.00 31.29 30.20 1xnf h VAL 203 CO 0.04 0.23 0.19 -0.33 0.02 0.00 0.00 177.57 177.72 1xnf h GLU 204 N 1.26 0.87 -0.34 1.57 5.08 -0.16 -0.02 114.58 122.85 1xnf h GLU 204 Ca 0.35 -0.16 -0.06 0.00 -1.00 0.00 0.00 59.36 58.50 1xnf h GLU 204 Cb -0.11 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 28.98 1xnf h GLU 204 CO -0.09 0.75 -0.01 0.35 -1.00 0.00 0.00 179.01 179.02 1xnf h PHE 205 N 0.85 0.66 -0.91 4.33 3.57 -0.47 -0.72 116.94 124.26 1xnf h PHE 205 Ca 0.19 -0.12 0.17 0.00 3.53 0.00 0.00 57.97 61.75 1xnf h PHE 205 Cb 0.24 -0.17 -0.07 0.00 2.79 0.00 0.00 35.95 38.73 1xnf h PHE 205 CO 0.02 0.72 0.59 1.88 -2.23 0.00 0.00 178.31 179.29 1xnf h TYR 206 N 0.41 0.74 -0.00 0.41 -1.99 -0.27 -0.66 116.97 115.61 1xnf h TYR 206 Ca 0.10 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.85 1xnf h TYR 206 Cb 0.47 -0.23 0.00 0.00 2.00 0.00 0.00 36.73 38.97 1xnf h TYR 206 CO 0.04 0.23 -0.08 1.28 -0.00 0.00 0.00 178.16 179.62 1xnf n LEU 207 N -4.57 0.13 0.00 3.88 4.77 -0.09 -4.90 117.00 116.22 1xnf n LEU 207 Ca 0.19 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.49 1xnf n LEU 207 Cb 0.57 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 1xnf n LEU 207 CO 0.29 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 1xnf n GLY 208 N 1.42 0.60 0.19 -0.72 0.00 -0.25 -4.95 105.19 101.47 1xnf n GLY 208 Ca 0.09 -0.16 -0.09 0.00 0.00 0.00 0.00 46.02 45.86 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 0.50 -4.31 1.61 2.35 -1.34 -3.47 115.58 110.92 1xnf h ASN 209 Ca 0.00 -0.30 -0.33 0.00 -0.55 0.00 0.00 56.30 55.12 1xnf h ASN 209 Cb 0.00 -0.15 -0.15 0.00 0.05 0.00 0.00 38.32 38.08 1xnf h ASN 209 CO 0.00 1.02 -0.65 0.27 -1.65 0.00 0.00 177.43 176.42 1xnf s ILE 210 N -3.75 0.77 0.57 2.81 -4.36 -1.24 -5.02 121.20 110.99 1xnf s ILE 210 Ca -0.06 -2.00 -0.10 0.00 -0.26 0.00 0.00 60.65 58.23 1xnf s ILE 210 Cb 0.11 -2.26 -0.04 0.00 1.25 0.00 0.00 42.46 41.51 1xnf s ILE 210 CO 0.83 -0.36 0.96 -0.94 0.24 0.00 0.00 174.94 175.68 1xnf s SER 211 N -3.23 6.29 0.28 4.36 1.04 -1.26 -4.60 113.70 116.57 1xnf s SER 211 Ca 0.27 1.32 -0.00 0.00 0.48 0.00 0.00 55.95 58.02 1xnf s SER 211 Cb 0.06 -2.42 0.49 0.00 0.10 0.00 0.00 66.02 64.25 1xnf s SER 211 CO 0.07 -0.76 1.86 -0.08 0.98 0.00 0.00 173.24 175.31 1xnf h GLU 212 N -0.01 1.05 -0.60 4.02 4.81 -1.99 -0.76 114.58 121.10 1xnf h GLU 212 Ca -0.45 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 58.67 1xnf h GLU 212 Cb 1.19 -0.24 -0.03 0.00 0.63 0.00 0.00 28.75 30.31 1xnf h GLU 212 CO 0.62 0.70 0.18 0.37 -0.73 0.00 0.00 179.01 180.15 1xnf h GLN 213 N 1.09 0.93 -0.59 1.92 4.15 -2.05 -2.65 115.11 117.90 1xnf h GLN 213 Ca 0.47 -0.20 -0.03 0.00 0.77 0.00 0.00 58.65 59.66 1xnf h GLN 213 Cb 0.34 -0.13 -0.03 0.00 0.21 0.00 0.00 27.48 27.87 1xnf h GLN 213 CO -0.22 0.84 0.27 1.15 -1.93 0.00 0.00 178.83 178.93 1xnf h THR 214 N 0.85 1.22 0.00 2.39 2.02 -1.82 0.14 112.91 117.71 1xnf h THR 214 Ca 0.19 -0.64 0.00 0.00 0.77 0.00 0.00 66.41 66.73 1xnf h THR 214 Cb 0.30 0.54 0.00 0.00 -1.74 0.00 0.00 68.15 67.25 1xnf h THR 214 CO -0.00 0.25 0.00 -0.11 0.37 0.00 0.00 175.52 176.03 1xnf n LEU 215 N -4.51 0.00 0.00 2.58 7.94 -0.34 -0.23 117.00 122.44 1xnf n LEU 215 Ca 0.04 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.94 1xnf n LEU 215 Cb 0.14 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.09 1xnf n LEU 215 CO 0.38 0.00 0.00 -0.62 -1.11 0.00 0.00 177.39 176.04 1xnf n GLU 217 N 0.30 0.00 -0.13 1.96 -0.58 0.50 -0.79 120.64 121.89 1xnf n GLU 217 Ca 0.00 0.00 -0.06 0.00 -0.42 0.00 0.00 57.16 56.68 1xnf n GLU 217 Cb 0.00 0.00 0.11 0.00 -0.57 0.00 0.00 31.44 30.98 1xnf n GLU 217 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1xnf h ARG 218 N 0.00 0.87 -0.11 3.49 3.08 -0.86 -2.31 114.38 118.54 1xnf h ARG 218 Ca 0.00 -0.27 0.01 0.00 0.07 0.00 0.00 59.98 59.79 1xnf h ARG 218 Cb 0.00 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 1xnf h ARG 218 CO 0.00 0.90 0.05 1.25 -1.07 0.00 0.00 179.97 181.10 1xnf h LEU 219 N 0.79 0.08 -0.74 3.04 7.12 -1.20 -0.63 115.31 123.77 1xnf h LEU 219 Ca 0.14 0.00 0.03 0.00 0.13 0.00 0.00 57.88 58.19 1xnf h LEU 219 Cb 0.55 -0.01 -0.05 0.00 -0.53 0.00 0.00 40.66 40.62 1xnf h LEU 219 CO 0.03 0.06 0.46 0.11 -0.13 0.00 0.00 178.44 178.98 1xnf h LYS 220 N 0.12 0.87 -0.23 1.25 1.57 -1.81 -0.85 116.57 117.49 1xnf h LYS 220 Ca 0.04 -0.05 -0.09 0.00 -1.87 0.00 0.00 60.65 58.68 1xnf h LYS 220 Cb 0.01 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.11 1xnf h LYS 220 CO -0.03 0.57 -0.25 0.00 -0.57 0.00 0.00 179.45 179.17 1xnf h ALA 221 N 1.32 1.15 0.09 3.86 0.00 -1.25 -3.26 119.26 121.17 1xnf h ALA 221 Ca 0.30 -0.34 -0.28 0.00 0.00 0.00 0.00 54.91 54.59 1xnf h ALA 221 Cb 0.04 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1xnf h ALA 221 CO -0.12 0.54 -1.40 0.22 0.00 0.00 0.00 179.25 178.49 1xnf h ASP 222 N 0.38 0.29 -4.04 0.00 3.58 -0.50 -3.46 116.42 112.67 1xnf h ASP 222 Ca 0.06 -0.38 -0.53 0.00 0.42 0.00 0.00 57.03 56.60 1xnf h ASP 222 Cb 0.65 -0.09 0.10 0.00 1.72 0.00 0.00 39.33 41.71 1xnf h ASP 222 CO 0.05 1.31 0.53 0.00 -2.88 0.00 0.00 179.24 178.25 1xnf s ALA 223 N -2.64 2.82 -0.03 -0.78 0.00 -0.38 -4.95 121.76 115.80 1xnf s ALA 223 Ca -0.06 1.10 0.10 0.00 0.00 0.00 0.00 51.96 53.10 1xnf s ALA 223 Cb 0.08 -3.47 -0.15 0.00 0.00 0.00 0.00 23.12 19.57 1xnf s ALA 223 CO 0.85 -1.05 0.23 0.25 0.00 0.00 0.00 175.76 176.04 1xnf n THR 224 N -0.95 0.00 -3.83 0.00 -2.24 -1.26 -4.93 114.28 101.07 1xnf n THR 224 Ca 0.10 -0.23 -0.04 0.00 -2.27 0.00 0.00 64.05 61.61 1xnf n THR 224 Cb 0.47 0.29 0.01 0.00 -2.10 0.00 0.00 70.33 69.00 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 -3.11 -0.05 0.19 3.42 -4.77 -1.26 -5.05 116.67 106.03 1xnf s ASP 225 Ca -0.03 -0.66 -0.08 0.00 -3.30 0.00 0.00 52.55 48.48 1xnf s ASP 225 Cb 0.06 0.55 0.09 0.00 -1.09 0.00 0.00 42.92 42.54 1xnf s ASP 225 CO 0.42 -1.07 1.64 -1.13 0.70 0.00 0.00 175.17 175.73 1xnf h ASN 226 N 2.00 1.01 -0.51 2.11 -1.24 -1.98 -1.50 115.58 115.48 1xnf h ASN 226 Ca -0.27 -0.30 -0.13 0.00 0.71 0.00 0.00 56.30 56.31 1xnf h ASN 226 Cb 1.23 -0.27 -0.01 0.00 0.73 0.00 0.00 38.32 39.99 1xnf h ASN 226 CO 0.33 1.09 -0.17 0.00 -1.29 0.00 0.00 177.43 177.39 1xnf h THR 227 N 0.93 1.27 -0.23 -3.57 1.03 -1.98 0.68 112.91 111.05 1xnf h THR 227 Ca 0.16 -1.34 -0.10 0.00 -0.01 0.00 0.00 66.41 65.12 1xnf h THR 227 Cb 0.59 1.05 -0.01 0.00 -1.07 0.00 0.00 68.15 68.71 1xnf h THR 227 CO 0.04 0.47 -0.30 0.77 -0.01 0.00 0.00 175.52 176.49 1xnf h SER 228 N 0.89 0.46 -0.13 0.00 4.64 -1.93 -0.73 113.55 116.75 1xnf h SER 228 Ca 0.12 -0.17 0.01 0.00 -0.47 0.00 0.00 61.79 61.29 1xnf h SER 228 Cb 0.75 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.70 1xnf h SER 228 CO 0.06 0.74 0.07 0.25 -0.87 0.00 0.00 176.83 177.07 1xnf h LEU 229 N 0.39 0.10 -0.84 5.97 5.85 -1.12 -0.99 115.31 124.67 1xnf h LEU 229 Ca 0.05 0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.79 1xnf h LEU 229 Cb 0.72 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.69 1xnf h LEU 229 CO 0.06 0.08 0.55 0.00 -0.34 0.00 0.00 178.44 178.78 1xnf h ALA 230 N 1.07 1.08 -0.54 1.25 0.00 -0.58 0.13 119.26 121.66 1xnf h ALA 230 Ca 0.05 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 1xnf h ALA 230 Cb 0.01 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 1xnf h ALA 230 CO -0.04 0.44 -0.12 0.93 0.00 0.00 0.00 179.25 180.47 1xnf h GLU 231 N 1.11 1.02 -0.64 0.00 5.08 -0.98 -0.55 114.58 119.62 1xnf h GLU 231 Ca 0.32 -0.38 -0.05 0.00 -1.00 0.00 0.00 59.36 58.25 1xnf h GLU 231 Cb -0.09 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.07 1xnf h GLU 231 CO -0.08 1.07 0.22 0.45 -1.00 0.00 0.00 179.01 179.66 1xnf h HIS 232 N 0.91 1.02 -0.07 4.33 3.86 -0.81 -2.42 115.15 121.97 1xnf h HIS 232 Ca 0.14 -0.10 -0.10 0.00 -1.16 0.00 0.00 60.37 59.15 1xnf h HIS 232 Cb 0.68 -0.30 -0.01 0.00 1.06 0.00 0.00 27.41 28.84 1xnf h HIS 232 CO 0.05 0.83 -0.43 -0.07 0.86 0.00 0.00 177.93 179.17 1xnf h LEU 233 N 0.92 0.16 0.11 2.43 3.38 -0.77 0.34 115.31 121.88 1xnf h LEU 233 Ca 0.21 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 1xnf h LEU 233 Cb 0.27 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1xnf h LEU 233 CO -0.01 0.57 -0.05 -1.28 0.09 0.00 0.00 178.44 177.76 1xnf h SER 234 N 0.12 -0.13 -0.07 -0.43 0.87 -0.87 -1.43 113.55 111.62 1xnf h SER 234 Ca 0.01 -0.31 -0.00 0.00 -1.23 0.00 0.00 61.79 60.26 1xnf h SER 234 Cb 0.81 0.03 -0.00 0.00 -0.44 0.00 0.00 62.40 62.80 1xnf h SER 234 CO 0.06 0.25 0.04 -0.33 -0.53 0.00 0.00 176.83 176.32 1xnf h GLU 235 N -0.53 0.10 -0.16 2.24 5.08 -1.38 -2.92 114.58 117.01 1xnf h GLU 235 Ca -0.02 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.25 1xnf h GLU 235 Cb 0.43 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.66 1xnf h GLU 235 CO 0.02 0.16 -0.24 1.15 -1.00 0.00 0.00 179.01 179.11 1xnf h THR 236 N 0.00 1.35 -0.55 1.13 2.02 -0.92 -2.32 112.91 113.63 1xnf h THR 236 Ca 0.02 -1.46 0.02 0.00 0.77 0.00 0.00 66.41 65.76 1xnf h THR 236 Cb 0.10 1.92 -0.03 0.00 -1.74 0.00 0.00 68.15 68.40 1xnf h THR 236 CO -0.00 0.44 0.36 0.78 0.37 0.00 0.00 175.52 177.47 1xnf h ASN 237 N 0.07 0.58 0.20 4.18 2.35 -1.35 -0.22 115.58 121.40 1xnf h ASN 237 Ca 0.02 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 1xnf h ASN 237 Cb 0.81 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 39.04 1xnf h ASN 237 CO 0.06 0.41 -0.10 0.15 -1.65 0.00 0.00 177.43 176.30 1xnf h PHE 238 N 0.68 -0.25 -0.29 1.19 3.57 -1.27 0.21 116.94 120.79 1xnf h PHE 238 Ca 0.21 -0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.61 1xnf h PHE 238 Cb 0.01 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.82 1xnf h PHE 238 CO -0.00 -0.11 -0.23 1.88 -2.23 0.00 0.00 178.31 177.63 1xnf h TYR 239 N -0.33 0.60 -0.72 0.41 0.05 -1.13 0.17 116.97 116.02 1xnf h TYR 239 Ca -0.03 -0.12 -0.06 0.00 0.05 0.00 0.00 58.73 58.57 1xnf h TYR 239 Cb 0.26 -0.15 -0.03 0.00 1.01 0.00 0.00 36.73 37.82 1xnf h TYR 239 CO -0.05 0.72 0.22 -0.07 -1.05 0.00 0.00 178.16 177.94 1xnf h LEU 240 N 0.48 1.04 -0.84 3.88 3.38 -1.01 -1.61 115.31 120.63 1xnf h LEU 240 Ca 0.07 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 1xnf h LEU 240 Cb 0.65 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 1xnf h LEU 240 CO 0.05 0.97 0.15 1.23 0.09 0.00 0.00 178.44 180.93 1xnf h GLY 241 N 1.10 1.09 1.25 0.83 0.00 -0.09 -1.07 103.07 106.19 1xnf h GLY 241 Ca 0.23 -0.67 -0.09 0.00 0.00 0.00 0.00 47.33 46.80 1xnf h GLY 241 CO -0.01 0.62 -0.04 0.50 0.00 0.00 0.00 176.54 177.61 1xnf h LYS 242 N 0.97 0.90 0.01 4.80 1.79 -0.75 0.49 116.57 124.78 1xnf h LYS 242 Ca 0.21 -0.28 -0.00 0.00 -2.18 0.00 0.00 60.65 58.39 1xnf h LYS 242 Cb 0.35 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 30.91 1xnf h LYS 242 CO 0.00 0.92 -0.01 -0.92 -1.08 0.00 0.00 179.45 178.37 1xnf h TYR 243 N 0.82 -0.02 -0.77 -1.35 3.20 -0.91 -0.61 116.97 117.34 1xnf h TYR 243 Ca 0.15 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.97 1xnf h TYR 243 Cb 0.55 0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.79 1xnf h TYR 243 CO 0.03 0.08 0.29 1.88 -1.64 0.00 0.00 178.16 178.81 1xnf h TYR 244 N -0.12 1.18 -0.79 -3.82 -1.99 -1.03 -2.12 116.97 108.28 1xnf h TYR 244 Ca -0.00 -0.10 -0.03 0.00 2.00 0.00 0.00 58.73 60.60 1xnf h TYR 244 Cb 0.11 -0.35 -0.04 0.00 2.00 0.00 0.00 36.73 38.46 1xnf h TYR 244 CO -0.04 0.90 0.36 1.25 -0.00 0.00 0.00 178.16 180.63 1xnf h LEU 245 N 1.11 1.05 -1.20 3.88 5.85 -0.70 -1.06 115.31 124.25 1xnf h LEU 245 Ca 0.25 -0.15 -0.08 0.00 0.84 0.00 0.00 57.88 58.75 1xnf h LEU 245 Cb 0.24 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 1xnf h LEU 245 CO -0.02 0.91 -0.28 0.77 -0.34 0.00 0.00 178.44 179.48 1xnf h SER 246 N 1.13 0.20 0.26 1.25 4.64 -0.82 -0.83 113.55 119.37 1xnf h SER 246 Ca 0.27 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 1xnf h SER 246 Cb 0.15 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1xnf h SER 246 CO -0.03 0.48 0.00 0.18 -0.87 0.00 0.00 176.83 176.59 1xnf n LEU 247 N -4.15 0.00 0.00 5.97 4.77 -0.82 -4.92 117.00 117.85 1xnf n LEU 247 Ca -0.01 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 1xnf n LEU 247 Cb 0.37 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 1xnf n LEU 247 CO 0.40 -0.08 0.00 0.61 -1.33 0.00 0.00 177.39 176.98 1xnf n GLY 248 N 0.27 0.47 3.33 -0.72 0.00 -0.32 -4.98 105.19 103.25 1xnf n GLY 248 Ca 0.10 -0.57 -0.47 0.00 0.00 0.00 0.00 46.02 45.08 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 -2.52 6.76 0.19 1.61 -1.08 -0.45 -4.84 116.67 116.34 1xnf s ASP 249 Ca 0.00 -2.67 -0.04 0.00 -0.52 0.00 0.00 52.55 49.32 1xnf s ASP 249 Cb 0.00 -2.22 0.10 0.00 -1.46 0.00 0.00 42.92 39.34 1xnf s ASP 249 CO 0.00 -0.59 1.50 -0.07 0.52 0.00 0.00 175.17 176.53 1xnf h LEU 250 N 7.88 0.67 0.05 -1.34 4.07 -1.91 -1.72 115.31 123.01 1xnf h LEU 250 Ca 0.11 -0.35 -0.00 0.00 0.08 0.00 0.00 57.88 57.72 1xnf h LEU 250 Cb 1.04 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 42.59 1xnf h LEU 250 CO 0.77 1.07 -0.02 0.44 -1.08 0.00 0.00 178.44 179.61 1xnf h ASP 251 N 0.47 -0.05 -0.53 -0.43 3.32 -1.96 0.81 116.42 118.05 1xnf h ASP 251 Ca 0.01 -0.25 0.00 0.00 0.02 0.00 0.00 57.03 56.82 1xnf h ASP 251 Cb 1.07 0.01 -0.03 0.00 0.22 0.00 0.00 39.33 40.61 1xnf h ASP 251 CO 0.10 0.22 0.35 0.28 -1.72 0.00 0.00 179.24 178.47 1xnf h SER 252 N -0.33 0.61 -0.24 6.45 0.02 -1.95 -2.23 113.55 115.88 1xnf h SER 252 Ca -0.01 -0.02 0.03 0.00 -0.84 0.00 0.00 61.79 60.95 1xnf h SER 252 Cb 0.30 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.65 1xnf h SER 252 CO 0.01 0.45 0.05 0.00 -1.14 0.00 0.00 176.83 176.20 1xnf h ALA 253 N 1.19 0.25 -0.38 3.77 0.00 -1.14 -0.92 119.26 122.03 1xnf h ALA 253 Ca 0.19 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1xnf h ALA 253 Cb -0.08 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1xnf h ALA 253 CO -0.04 -0.37 0.25 1.15 0.00 0.00 0.00 179.25 180.24 1xnf h THR 254 N 0.15 1.10 -0.70 0.00 2.02 -0.70 0.01 112.91 114.79 1xnf h THR 254 Ca 0.11 -0.20 0.01 0.00 0.77 0.00 0.00 66.41 67.10 1xnf h THR 254 Cb 0.10 0.56 -0.04 0.00 -1.74 0.00 0.00 68.15 67.03 1xnf h THR 254 CO -0.14 0.10 0.46 0.00 0.37 0.00 0.00 175.52 176.31 1xnf h ALA 255 N 1.13 0.90 -0.51 6.16 0.00 -1.16 -1.79 119.26 123.98 1xnf h ALA 255 Ca 0.14 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 1xnf h ALA 255 Cb -0.05 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 1xnf h ALA 255 CO -0.03 0.29 0.08 -0.07 0.00 0.00 0.00 179.25 179.52 1xnf h LEU 256 N 0.93 0.82 -0.81 0.00 3.38 -0.59 -0.44 115.31 118.60 1xnf h LEU 256 Ca 0.26 -0.26 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1xnf h LEU 256 Cb -0.08 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 1xnf h LEU 256 CO -0.07 0.88 0.07 -0.26 0.09 0.00 0.00 178.44 179.15 1xnf h PHE 257 N 0.74 1.02 -0.40 1.13 0.05 -0.74 0.15 116.94 118.89 1xnf h PHE 257 Ca 0.16 -0.14 -0.15 0.00 3.82 0.00 0.00 57.97 61.66 1xnf h PHE 257 Cb 0.41 -0.28 -0.01 0.00 2.00 0.00 0.00 35.95 38.07 1xnf h PHE 257 CO 0.03 0.88 -0.35 0.87 -0.18 0.00 0.00 178.31 179.56 1xnf h LYS 258 N 0.91 0.93 -0.17 1.51 1.57 -1.08 -1.42 116.57 118.82 1xnf h LYS 258 Ca 0.18 -0.47 -0.04 0.00 -1.87 0.00 0.00 60.65 58.46 1xnf h LYS 258 Cb 0.43 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 1xnf h LYS 258 CO 0.01 1.12 -0.07 -0.07 -0.57 0.00 0.00 179.45 179.88 1xnf h LEU 259 N 0.77 0.23 -0.00 2.94 3.38 -0.69 -0.20 115.31 121.74 1xnf h LEU 259 Ca 0.07 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 1xnf h LEU 259 Cb 0.94 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.63 1xnf h LEU 259 CO 0.09 0.33 -0.00 0.00 0.09 0.00 0.00 178.44 178.95 1xnf h ALA 260 N 1.70 0.00 -0.24 1.53 0.00 -0.08 -3.26 119.26 118.92 1xnf h ALA 260 Ca 0.05 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 1xnf h ALA 260 Cb 0.28 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1xnf h ALA 260 CO 0.01 -0.28 -0.05 0.28 0.00 0.00 0.00 179.25 179.20 1xnf h VAL 261 N -0.41 1.18 0.00 0.00 2.07 -0.87 -2.81 116.25 115.40 1xnf h VAL 261 Ca 0.00 -0.73 -0.00 0.00 0.82 0.00 0.00 66.70 66.79 1xnf h VAL 261 Cb 0.42 1.06 -0.00 0.00 -1.52 0.00 0.00 31.29 31.25 1xnf h VAL 261 CO 0.00 0.24 -0.00 0.00 0.02 0.00 0.00 177.57 177.83 1xnf h ALA 262 N 1.60 1.11 0.00 1.67 0.00 -1.08 -0.20 119.26 122.36 1xnf h ALA 262 Ca 0.08 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1xnf h ALA 262 Cb 0.33 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1xnf h ALA 262 CO 0.01 0.00 -0.03 -0.91 0.00 0.00 0.00 179.25 178.33 1xnf h ASN 263 N 0.00 0.00 -4.55 0.00 2.35 -1.62 -3.39 115.58 108.37 1xnf h ASN 263 Ca -0.00 0.00 -0.38 0.00 -0.55 0.00 0.00 56.30 55.37 1xnf h ASN 263 Cb 0.00 0.00 0.08 0.00 0.05 0.00 0.00 38.32 38.45 1xnf h ASN 263 CO 0.00 0.03 -0.59 0.59 -1.65 0.00 0.00 177.43 175.81 1xnf n ASN 264 N -3.15 -5.97 -4.27 5.81 5.03 -0.09 -1.89 115.26 110.73 1xnf n ASN 264 Ca -0.00 -0.33 -0.44 0.00 0.87 0.00 0.00 54.58 54.68 1xnf n ASN 264 Cb 0.27 -4.74 0.00 0.00 -1.02 0.00 0.00 39.78 34.29 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 -4.55 4.35 -0.01 2.41 0.31 -1.26 -4.68 118.33 114.89 1xnf n VAL 265 Ca -0.08 -4.74 0.07 0.00 -0.01 0.00 0.00 64.34 59.58 1xnf n VAL 265 Cb 0.60 -2.43 0.46 0.00 -0.91 0.00 0.00 33.84 31.57 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 6.63 0.46 -0.01 3.52 3.86 -1.88 -1.77 115.15 125.96 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 0.79 -0.15 0.00 0.00 1.06 0.00 0.00 27.41 29.11 1xnf h HIS 266 CO 1.11 0.26 -0.00 0.27 0.86 0.00 0.00 177.93 180.43 1xnf n ASN 267 N -4.48 1.14 -4.74 2.45 0.23 -1.26 -4.60 115.26 103.99 1xnf n ASN 267 Ca 0.05 -1.37 -0.40 0.00 -0.53 0.00 0.00 54.58 52.32 1xnf n ASN 267 Cb 0.17 0.00 -0.05 0.00 -2.08 0.00 0.00 39.78 37.82 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 -2.01 3.91 0.28 -2.53 2.99 -0.66 -4.94 117.98 115.01 1xnf s PHE 268 Ca 0.40 1.87 -0.03 0.00 0.00 0.00 0.00 56.93 59.17 1xnf s PHE 268 Cb 0.21 -3.02 0.58 0.00 0.00 0.00 0.00 43.02 40.79 1xnf s PHE 268 CO 0.35 0.31 1.60 0.28 -0.00 0.00 0.00 175.22 177.76 1xnf h VAL 269 N 3.42 0.18 -0.28 -0.44 2.07 -1.90 -0.23 116.25 119.07 1xnf h VAL 269 Ca -0.44 -0.02 -0.06 0.00 0.82 0.00 0.00 66.70 66.99 1xnf h VAL 269 Cb 1.20 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.07 1xnf h VAL 269 CO 0.69 0.01 -0.10 -0.33 0.02 0.00 0.00 177.57 177.86 1xnf h GLU 270 N 0.06 0.46 0.12 1.57 3.07 -1.92 0.70 114.58 118.65 1xnf h GLU 270 Ca 0.50 -0.12 -0.01 0.00 -0.50 0.00 0.00 59.36 59.23 1xnf h GLU 270 Cb 0.95 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.80 1xnf h GLU 270 CO -0.80 0.57 -0.06 1.25 -1.40 0.00 0.00 179.01 178.57 1xnf h HIS 271 N 0.44 -0.15 -0.69 4.33 2.76 -1.53 -0.16 115.15 120.15 1xnf h HIS 271 Ca 0.08 -0.00 0.06 0.00 -2.20 0.00 0.00 60.37 58.31 1xnf h HIS 271 Cb 0.44 0.05 -0.05 0.00 1.55 0.00 0.00 27.41 29.40 1xnf h HIS 271 CO 0.01 0.25 0.39 0.00 -1.30 0.00 0.00 177.93 177.28 1xnf h ARG 272 N -0.58 0.71 0.00 5.26 3.08 -0.70 -2.18 114.38 119.96 1xnf h ARG 272 Ca -0.02 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 59.99 1xnf h ARG 272 Cb 0.46 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 30.35 1xnf h ARG 272 CO 0.03 0.47 -0.60 1.88 -1.07 0.00 0.00 179.97 180.68 1xnf h TYR 273 N 0.73 0.00 -0.56 3.04 -1.99 -0.93 -1.26 116.97 116.01 1xnf h TYR 273 Ca 0.30 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 61.02 1xnf h TYR 273 Cb 0.17 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 38.87 1xnf h TYR 273 CO -0.07 0.01 0.31 0.00 -0.00 0.00 0.00 178.16 178.41 1xnf h ALA 274 N 1.99 0.71 -0.69 3.88 0.00 -0.84 0.31 119.26 124.62 1xnf h ALA 274 Ca -0.00 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1xnf h ALA 274 Cb 1.01 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 1xnf h ALA 274 CO 0.00 0.22 0.40 -0.07 0.00 0.00 0.00 179.25 179.81 1xnf h LEU 275 N 0.75 0.85 -0.38 0.00 3.38 -1.24 -0.75 115.31 117.93 1xnf h LEU 275 Ca 0.20 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 1xnf h LEU 275 Cb 0.03 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 1xnf h LEU 275 CO -0.03 0.68 0.18 0.25 0.09 0.00 0.00 178.44 179.61 1xnf h LEU 276 N 0.95 0.50 -1.34 1.67 5.85 -0.81 -0.72 115.31 121.41 1xnf h LEU 276 Ca 0.25 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 1xnf h LEU 276 Cb 0.00 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 1xnf h LEU 276 CO -0.04 0.49 0.26 -0.33 -0.34 0.00 0.00 178.44 178.48 1xnf h GLU 277 N 0.47 0.71 -0.04 1.25 4.39 -0.17 -0.63 114.58 120.56 1xnf h GLU 277 Ca 0.13 -0.08 -0.19 0.00 0.34 0.00 0.00 59.36 59.56 1xnf h GLU 277 Cb 0.13 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 1xnf h GLU 277 CO -0.02 0.54 -0.79 -0.07 -1.16 0.00 0.00 179.01 177.52 1xnf h LEU 278 N 0.71 0.42 -0.70 1.33 3.38 -0.83 0.12 115.31 119.75 1xnf h LEU 278 Ca 0.18 -0.30 -0.11 0.00 0.09 0.00 0.00 57.88 57.74 1xnf h LEU 278 Cb 0.06 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1xnf h LEU 278 CO -0.03 1.06 -0.23 -1.28 0.09 0.00 0.00 178.44 178.05 1xnf h SER 279 N 0.22 0.77 -0.52 -0.43 0.87 -0.32 0.37 113.55 114.51 1xnf h SER 279 Ca -0.04 -0.28 -0.07 0.00 -1.23 0.00 0.00 61.79 60.17 1xnf h SER 279 Cb 1.38 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 63.11 1xnf h SER 279 CO 0.13 0.97 0.05 -0.07 -0.53 0.00 0.00 176.83 177.39 1xnf h LEU 280 N 0.66 0.85 -1.17 2.23 3.38 -0.65 -0.54 115.31 120.07 1xnf h LEU 280 Ca 0.09 -0.28 -0.04 0.00 0.09 0.00 0.00 57.88 57.74 1xnf h LEU 280 Cb 0.73 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 1xnf h LEU 280 CO 0.06 0.92 0.15 -0.07 0.09 0.00 0.00 178.44 179.59 1xnf h LEU 281 N 0.75 0.67 -0.11 1.67 3.38 -0.59 -2.99 115.31 118.08 1xnf h LEU 281 Ca 0.15 -0.10 -0.24 0.00 0.09 0.00 0.00 57.88 57.79 1xnf h LEU 281 Cb 0.45 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1xnf h LEU 281 CO 0.02 0.64 -1.00 1.23 0.09 0.00 0.00 178.44 179.42 1xnf h GLY 282 N 0.89 0.46 0.49 0.83 0.00 -0.64 -3.16 103.07 101.95 1xnf h GLY 282 Ca 0.17 -0.85 0.12 0.00 0.00 0.00 0.00 47.33 46.76 1xnf h GLY 282 CO -0.01 0.75 0.64 1.46 0.00 0.00 0.00 176.54 179.38 1xnf h GLN 283 N 0.22 0.98 0.00 4.80 4.20 -1.05 -3.51 115.11 120.75 1xnf h GLN 283 Ca -0.09 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.56 1xnf h GLN 283 Cb 1.65 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 29.21 1xnf h GLN 283 CO 0.17 0.65 0.00 -0.25 -0.67 0.00 0.00 178.83 178.74