#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i80 n PRO 4 N 0.00 2.56 -5.00 -0.67 -0.02 -1.26 -5.00 135.00 125.61 1i80 n PRO 4 Ca 0.00 0.91 -0.32 0.00 -2.02 0.00 0.00 63.50 62.07 1i80 n PRO 4 Cb 0.00 -2.65 -0.16 0.00 -0.02 0.00 0.00 33.50 30.66 1i80 n PRO 4 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1i80 s ARG 5 N -0.78 3.15 1.01 -0.52 0.52 -1.26 -3.69 118.95 117.40 1i80 s ARG 5 Ca 0.63 -0.81 -0.13 0.00 -0.52 0.00 0.00 55.73 54.89 1i80 s ARG 5 Cb -0.52 -2.43 0.20 0.00 0.52 0.00 0.00 34.95 32.72 1i80 s ARG 5 CO 0.51 0.16 1.10 -1.25 0.02 0.00 0.00 175.30 175.85 1i80 s PRO 6 N 0.42 0.31 -0.25 3.54 0.04 -1.26 -5.13 135.00 132.66 1i80 s PRO 6 Ca -0.15 0.39 -0.14 0.00 0.04 0.00 0.00 61.00 61.14 1i80 s PRO 6 Cb -0.17 -1.73 -0.04 0.00 0.04 0.00 0.00 34.50 32.59 1i80 s PRO 6 CO 0.07 -2.79 0.31 0.34 0.04 0.00 0.00 177.00 174.97 1i80 s ASP 7 N -3.61 6.22 0.20 6.66 2.15 -1.24 -5.01 116.67 122.05 1i80 s ASP 7 Ca 0.66 0.25 -0.19 0.00 0.43 0.00 0.00 52.55 53.69 1i80 s ASP 7 Cb -0.17 -2.18 0.17 0.00 -0.30 0.00 0.00 42.92 40.44 1i80 s ASP 7 CO 0.57 -0.10 1.58 -0.65 -0.17 0.00 0.00 175.17 176.40 1i80 h PRO 8 N 7.95 -0.10 -0.33 4.34 0.11 -2.00 -1.66 132.00 140.30 1i80 h PRO 8 Ca -0.34 0.01 -0.12 0.00 0.11 0.00 0.00 66.00 65.65 1i80 h PRO 8 Cb 1.17 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1i80 h PRO 8 CO 0.64 -0.07 -0.30 -0.44 -0.21 0.00 0.00 178.00 177.62 1i80 h ASP 9 N -0.11 0.73 -0.49 -2.05 3.32 -1.99 -1.95 116.42 113.88 1i80 h ASP 9 Ca 0.27 -0.29 -0.04 0.00 0.02 0.00 0.00 57.03 56.99 1i80 h ASP 9 Cb 0.56 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 1i80 h ASP 9 CO -0.77 0.98 0.15 -0.08 -1.72 0.00 0.00 179.24 177.80 1i80 h GLU 10 N 0.60 0.76 -0.47 3.56 4.22 -1.86 -1.70 114.58 119.69 1i80 h GLU 10 Ca 0.07 -0.17 -0.08 0.00 0.08 0.00 0.00 59.36 59.26 1i80 h GLU 10 Cb 0.81 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.93 1i80 h GLU 10 CO 0.07 0.72 -0.03 1.25 -2.18 0.00 0.00 179.01 178.84 1i80 h LEU 11 N 0.66 0.78 -0.67 1.64 5.85 -1.25 -1.36 115.31 120.96 1i80 h LEU 11 Ca 0.16 -0.20 -0.11 0.00 0.84 0.00 0.00 57.88 58.57 1i80 h LEU 11 Cb 0.28 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 1i80 h LEU 11 CO -0.00 0.87 -0.11 0.00 -0.34 0.00 0.00 178.44 178.85 1i80 h ALA 12 N 1.22 0.86 -0.25 1.25 0.00 -1.09 -0.80 119.26 120.45 1i80 h ALA 12 Ca 0.14 -0.34 -0.17 0.00 0.00 0.00 0.00 54.91 54.54 1i80 h ALA 12 Cb 0.50 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1i80 h ALA 12 CO 0.03 0.64 -0.54 0.00 0.00 0.00 0.00 179.25 179.39 1i80 h ARG 13 N 0.82 0.73 -0.54 0.00 3.08 -1.07 -1.39 114.38 116.02 1i80 h ARG 13 Ca 0.13 -0.45 -0.12 0.00 0.07 0.00 0.00 59.98 59.61 1i80 h ARG 13 Cb 0.65 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.73 1i80 h ARG 13 CO 0.04 1.08 -0.13 -0.09 -1.07 0.00 0.00 179.97 179.81 1i80 h ARG 14 N 0.56 1.03 -0.44 0.04 2.43 -1.10 -1.49 114.38 115.42 1i80 h ARG 14 Ca 0.02 -0.39 -0.08 0.00 -0.81 0.00 0.00 59.98 58.72 1i80 h ARG 14 Cb 1.11 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.58 1i80 h ARG 14 CO 0.11 1.08 -0.05 0.00 -1.51 0.00 0.00 179.97 179.60 1i80 h ALA 15 N 0.93 1.10 -0.65 2.80 0.00 -1.06 -1.94 119.26 120.44 1i80 h ALA 15 Ca 0.14 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1i80 h ALA 15 Cb 0.70 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1i80 h ALA 15 CO 0.05 0.56 0.32 0.00 0.00 0.00 0.00 179.25 180.18 1i80 h ALA 16 N 1.27 0.84 -0.24 0.00 0.00 -0.83 -0.17 119.26 120.13 1i80 h ALA 16 Ca 0.13 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1i80 h ALA 16 Cb 0.49 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1i80 h ALA 16 CO 0.03 0.40 0.13 0.37 0.00 0.00 0.00 179.25 180.17 1i80 h GLN 17 N 0.90 0.35 -0.43 0.00 5.75 -0.92 0.58 115.11 121.33 1i80 h GLN 17 Ca 0.22 -0.04 0.03 0.00 -0.15 0.00 0.00 58.65 58.71 1i80 h GLN 17 Cb 0.11 -0.07 -0.04 0.00 1.07 0.00 0.00 27.48 28.56 1i80 h GLN 17 CO -0.03 0.33 0.22 0.28 -2.65 0.00 0.00 178.83 176.98 1i80 h VAL 18 N 0.28 0.98 -0.69 2.39 2.07 -1.06 -1.49 116.25 118.72 1i80 h VAL 18 Ca 0.09 -0.15 0.02 0.00 0.82 0.00 0.00 66.70 67.47 1i80 h VAL 18 Cb 0.09 0.50 -0.04 0.00 -1.52 0.00 0.00 31.29 30.32 1i80 h VAL 18 CO -0.01 0.08 0.45 0.40 0.02 0.00 0.00 177.57 178.51 1i80 h ILE 19 N 0.45 1.15 -0.55 4.57 2.04 -0.65 -0.69 117.51 123.82 1i80 h ILE 19 Ca 0.18 -0.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 1i80 h ILE 19 Cb 0.08 0.16 -0.03 0.00 -0.74 0.00 0.00 36.82 36.29 1i80 h ILE 19 CO -0.12 0.17 0.30 0.00 0.00 0.00 0.00 178.15 178.49 1i80 h ALA 20 N 1.27 0.70 -0.17 1.87 0.00 -0.37 -1.60 119.26 120.95 1i80 h ALA 20 Ca 0.26 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1i80 h ALA 20 Cb -0.06 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1i80 h ALA 20 CO -0.07 0.22 -0.05 -0.44 0.00 0.00 0.00 179.25 178.90 1i80 h ASP 21 N 0.73 0.35 0.13 0.00 3.32 -0.96 -1.02 116.42 118.96 1i80 h ASP 21 Ca 0.19 -0.38 -0.07 0.00 0.02 0.00 0.00 57.03 56.79 1i80 h ASP 21 Cb 0.05 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 1i80 h ASP 21 CO -0.03 0.65 -0.25 0.03 -1.72 0.00 0.00 179.24 177.91 1i80 h ARG 22 N 0.04 0.22 0.00 3.56 2.47 -1.05 -3.01 114.38 116.61 1i80 h ARG 22 Ca 0.04 -0.07 0.00 0.00 -1.26 0.00 0.00 59.98 58.69 1i80 h ARG 22 Cb 0.51 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.81 1i80 h ARG 22 CO 0.02 0.47 -1.12 0.25 0.56 0.00 0.00 179.97 180.15 1i80 n THR 23 N -4.16 0.20 -1.00 2.04 -2.24 -0.61 -4.95 114.28 103.56 1i80 n THR 23 Ca -0.01 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 1i80 n THR 23 Cb 0.36 0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.73 1i80 n THR 23 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1i80 n GLY 24 N 1.34 0.35 3.35 3.38 0.00 -0.40 -4.95 105.19 108.26 1i80 n GLY 24 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 1i80 n GLY 24 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i80 s ILE 25 N -1.72 3.65 0.27 -0.61 -1.09 -1.11 -5.01 121.20 115.58 1i80 s ILE 25 Ca 0.00 -0.40 0.00 0.00 -2.23 0.00 0.00 60.65 58.02 1i80 s ILE 25 Cb 0.00 -2.67 0.26 0.00 -1.58 0.00 0.00 42.46 38.47 1i80 s ILE 25 CO 0.00 0.40 1.80 1.23 -1.23 0.00 0.00 174.94 177.14 1i80 h GLY 26 N 8.11 1.52 -4.27 6.18 0.00 -1.94 -3.40 103.07 109.27 1i80 h GLY 26 Ca -0.40 -0.35 -0.09 0.00 0.00 0.00 0.00 47.33 46.49 1i80 h GLY 26 CO 0.60 0.07 -0.06 -0.54 0.00 0.00 0.00 176.54 176.61 1i80 s GLU 27 N -5.96 0.85 0.24 4.80 2.02 -1.26 -4.87 118.70 114.51 1i80 s GLU 27 Ca -0.12 0.01 0.08 0.00 0.02 0.00 0.00 54.97 54.96 1i80 s GLU 27 Cb 0.22 0.39 -0.04 0.00 0.10 0.00 0.00 34.13 34.80 1i80 s GLU 27 CO 0.79 -0.25 0.11 -1.01 0.02 0.00 0.00 175.26 174.92 1i80 s HIS 28 N -1.28 2.96 -0.19 1.61 3.76 -0.55 -4.90 115.29 116.70 1i80 s HIS 28 Ca -0.12 -0.13 0.14 0.00 -0.15 0.00 0.00 55.06 54.80 1i80 s HIS 28 Cb -0.03 -1.35 -0.22 0.00 1.11 0.00 0.00 32.58 32.09 1i80 s HIS 28 CO 0.07 0.55 0.02 -0.25 -0.85 0.00 0.00 174.74 174.28 1i80 n ASP 29 N -0.87 0.64 -3.95 1.40 8.00 0.16 -2.32 116.55 119.60 1i80 n ASP 29 Ca -0.08 -0.02 -0.09 0.00 0.71 0.00 0.00 54.79 55.31 1i80 n ASP 29 Cb 0.57 0.77 -0.10 0.00 -0.02 0.00 0.00 41.12 42.34 1i80 n ASP 29 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1i80 s VAL 30 N -2.46 0.12 -0.02 2.53 1.01 -1.20 -3.05 120.40 117.34 1i80 s VAL 30 Ca -0.13 -0.97 0.04 0.00 0.00 0.00 0.00 61.98 60.92 1i80 s VAL 30 Cb 0.06 -0.54 -0.01 0.00 0.00 0.00 0.00 36.38 35.90 1i80 s VAL 30 CO 0.74 -0.54 -0.13 0.00 0.00 0.00 0.00 175.10 175.17 1i80 s ALA 31 N -1.88 1.10 -0.13 5.51 0.00 -0.70 -0.58 121.76 125.09 1i80 s ALA 31 Ca -0.12 -0.54 0.03 0.00 0.00 0.00 0.00 51.96 51.33 1i80 s ALA 31 Cb -0.06 -0.31 0.01 0.00 0.00 0.00 0.00 23.12 22.75 1i80 s ALA 31 CO -0.02 0.24 -0.21 0.08 0.00 0.00 0.00 175.76 175.85 1i80 s VAL 32 N -0.17 1.99 -0.30 0.00 1.01 0.14 -0.08 120.40 122.99 1i80 s VAL 32 Ca 0.02 -0.94 -0.08 0.00 0.00 0.00 0.00 61.98 60.98 1i80 s VAL 32 Cb -0.07 -1.75 0.00 0.00 0.00 0.00 0.00 36.38 34.57 1i80 s VAL 32 CO -0.00 0.54 0.11 -0.69 0.00 0.00 0.00 175.10 175.05 1i80 s VAL 33 N 0.75 4.21 -0.01 2.92 1.01 -0.52 -0.17 120.40 128.58 1i80 s VAL 33 Ca -0.09 -0.59 -0.29 0.00 0.00 0.00 0.00 61.98 61.02 1i80 s VAL 33 Cb -0.16 -3.16 -0.03 0.00 0.00 0.00 0.00 36.38 33.03 1i80 s VAL 33 CO 0.00 0.08 0.92 -0.76 0.00 0.00 0.00 175.10 175.34 1i80 s LEU 34 N 1.54 4.36 0.89 3.92 1.43 -0.79 -2.22 118.68 127.83 1i80 s LEU 34 Ca 0.03 1.57 -0.12 0.00 -1.03 0.00 0.00 54.13 54.58 1i80 s LEU 34 Cb -0.17 -3.47 0.13 0.00 0.03 0.00 0.00 46.19 42.71 1i80 s LEU 34 CO 0.04 -0.22 1.13 -0.83 0.23 0.00 0.00 176.35 176.69 1i80 s GLY 35 N 0.94 1.58 0.31 -3.19 0.00 -1.21 -4.54 107.32 101.21 1i80 s GLY 35 Ca 0.49 -0.44 -0.29 0.00 0.00 0.00 0.00 44.72 44.47 1i80 s GLY 35 CO 0.26 0.09 1.29 -1.35 0.00 0.00 0.00 173.10 173.39 1i80 s SER 36 N -3.96 6.83 0.00 1.64 1.04 -1.26 -1.80 113.70 116.19 1i80 s SER 36 Ca 0.63 2.62 0.00 0.00 0.48 0.00 0.00 55.95 59.68 1i80 s SER 36 Cb -0.15 -2.64 0.00 0.00 0.10 0.00 0.00 66.02 63.33 1i80 s SER 36 CO 0.54 -0.50 0.00 0.61 0.98 0.00 0.00 173.24 174.87 1i80 n GLY 37 N 1.05 3.14 0.17 7.32 0.00 -1.26 -4.45 105.19 111.16 1i80 n GLY 37 Ca 0.01 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.18 1i80 n GLY 37 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1i80 n TRP 38 N -1.40 0.00 -0.16 1.61 7.02 -0.75 -3.62 117.44 120.14 1i80 n TRP 38 Ca 0.00 0.00 -0.02 0.00 -1.02 0.00 0.00 57.50 56.46 1i80 n TRP 38 Cb 0.00 -0.01 0.07 0.00 -2.42 0.00 0.00 31.31 28.95 1i80 n TRP 38 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 1i80 h LEU 39 N 0.84 0.10 0.00 -0.99 5.85 -1.89 -1.14 115.31 118.08 1i80 h LEU 39 Ca 0.00 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.80 1i80 h LEU 39 Cb 0.19 0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.31 1i80 h LEU 39 CO 0.00 0.08 0.00 -0.81 -0.34 0.00 0.00 178.44 177.37 1i80 n PRO 40 N -5.06 0.44 0.00 5.25 -0.04 -1.26 -2.26 135.00 132.07 1i80 n PRO 40 Ca 0.06 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.63 1i80 n PRO 40 Cb 0.23 -1.33 0.10 0.00 -0.04 0.00 0.00 33.50 32.46 1i80 n PRO 40 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1i80 n ALA 41 N -0.83 4.04 -0.06 0.55 0.00 -0.43 -4.38 120.51 119.40 1i80 n ALA 41 Ca 0.07 -0.45 -0.07 0.00 0.00 0.00 0.00 53.44 52.99 1i80 n ALA 41 Cb 0.03 -0.98 -0.01 0.00 0.00 0.00 0.00 19.45 18.49 1i80 n ALA 41 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1i80 h VAL 42 N 0.00 0.63 -0.92 0.00 2.07 -1.57 -2.00 116.25 114.46 1i80 h VAL 42 Ca 0.00 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.65 1i80 h VAL 42 Cb 0.50 0.63 -0.07 0.00 -1.52 0.00 0.00 31.29 30.83 1i80 h VAL 42 CO 0.00 0.00 0.59 0.00 0.02 0.00 0.00 177.57 178.18 1i80 h ALA 43 N 1.15 1.71 0.00 1.67 0.00 -1.83 0.16 119.26 122.13 1i80 h ALA 43 Ca 0.14 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1i80 h ALA 43 Cb 0.28 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1i80 h ALA 43 CO -0.31 0.05 -0.05 0.00 0.00 0.00 0.00 179.25 178.94 1i80 h ALA 44 N 1.58 1.17 -0.01 0.00 0.00 -1.63 -2.58 119.26 117.79 1i80 h ALA 44 Ca 0.45 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 55.23 1i80 h ALA 44 Cb 0.60 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1i80 h ALA 44 CO -0.22 0.06 -0.40 -0.07 0.00 0.00 0.00 179.25 178.62 1i80 h LEU 45 N 0.00 0.02 0.00 0.00 3.38 -0.85 -3.38 115.31 114.48 1i80 h LEU 45 Ca -0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1i80 h LEU 45 Cb 0.24 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1i80 h LEU 45 CO 0.01 0.42 0.00 0.61 0.09 0.00 0.00 178.44 179.56 1i80 n GLY 46 N -0.36 2.71 3.67 0.83 0.00 -0.97 -4.83 105.19 106.23 1i80 n GLY 46 Ca -0.02 -1.66 -0.43 0.00 0.00 0.00 0.00 46.02 43.92 1i80 n GLY 46 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1i80 s SER 47 N 0.00 7.16 0.28 1.61 0.01 -1.26 -4.76 113.70 116.74 1i80 s SER 47 Ca 0.00 1.45 -0.29 0.00 1.31 0.00 0.00 55.95 58.42 1i80 s SER 47 Cb 0.00 -2.55 -0.10 0.00 0.21 0.00 0.00 66.02 63.59 1i80 s SER 47 CO 0.00 -0.58 1.15 -2.84 0.41 0.00 0.00 173.24 171.38 1i80 s PRO 48 N 2.71 4.57 0.10 12.44 0.02 -1.26 -4.34 135.00 149.24 1i80 s PRO 48 Ca 0.46 1.90 0.20 0.00 0.02 0.00 0.00 61.00 63.58 1i80 s PRO 48 Cb -0.17 -3.17 -0.11 0.00 0.02 0.00 0.00 34.50 31.08 1i80 s PRO 48 CO 0.11 0.11 0.83 0.25 -0.33 0.00 0.00 177.00 177.97 1i80 n THR 49 N 1.21 0.74 -3.75 0.99 -2.24 0.15 -4.91 114.28 106.48 1i80 n THR 49 Ca -0.00 -0.60 -0.13 0.00 -2.27 0.00 0.00 64.05 61.04 1i80 n THR 49 Cb 0.44 -0.42 -0.10 0.00 -2.10 0.00 0.00 70.33 68.15 1i80 n THR 49 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1i80 s THR 50 N -3.20 0.00 -0.04 4.28 2.01 -1.20 -4.99 115.64 112.49 1i80 s THR 50 Ca -0.03 -0.02 0.01 0.00 0.31 0.00 0.00 61.69 61.95 1i80 s THR 50 Cb 0.10 -0.51 0.02 0.00 0.01 0.00 0.00 72.50 72.12 1i80 s THR 50 CO 0.82 -0.01 -0.02 -0.69 -0.69 0.00 0.00 174.62 174.03 1i80 s VAL 51 N 0.11 0.35 -0.02 3.82 1.01 -1.26 -0.80 120.40 123.61 1i80 s VAL 51 Ca -0.01 0.00 -0.04 0.00 0.00 0.00 0.00 61.98 61.93 1i80 s VAL 51 Cb -0.03 -0.42 0.00 0.00 0.00 0.00 0.00 36.38 35.93 1i80 s VAL 51 CO 0.01 0.19 0.09 -1.48 0.00 0.00 0.00 175.10 173.91 1i80 s LEU 52 N 1.07 1.68 0.26 3.92 0.05 -0.70 -4.99 118.68 119.97 1i80 s LEU 52 Ca -0.09 0.01 -0.30 0.00 0.05 0.00 0.00 54.13 53.80 1i80 s LEU 52 Cb -0.14 0.40 -0.11 0.00 -2.05 0.00 0.00 46.19 44.30 1i80 s LEU 52 CO -0.01 -0.15 1.55 -2.84 -0.55 0.00 0.00 176.35 174.34 1i80 s PRO 53 N -0.50 4.18 0.52 1.48 0.02 -1.26 -1.16 135.00 138.28 1i80 s PRO 53 Ca -0.06 2.47 0.27 0.00 0.02 0.00 0.00 61.00 63.70 1i80 s PRO 53 Cb -0.04 -3.07 1.44 0.00 0.02 0.00 0.00 34.50 32.86 1i80 s PRO 53 CO 0.00 -0.56 2.07 1.96 -0.33 0.00 0.00 177.00 180.14 1i80 h GLN 54 N 5.18 0.00 0.00 5.54 4.20 -1.66 -1.34 115.11 127.04 1i80 h GLN 54 Ca -0.46 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.24 1i80 h GLN 54 Cb 1.22 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.00 1i80 h GLN 54 CO 0.81 0.12 -0.02 0.00 -0.67 0.00 0.00 178.83 179.06 1i80 h ALA 55 N 1.88 1.04 -0.45 3.87 0.00 -1.89 -1.72 119.26 121.99 1i80 h ALA 55 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1i80 h ALA 55 Cb 0.33 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1i80 h ALA 55 CO 0.02 0.03 0.00 0.39 0.00 0.00 0.00 179.25 179.68 1i80 n GLU 56 N -3.17 2.65 -5.05 0.00 1.02 -0.50 -4.84 120.64 110.74 1i80 n GLU 56 Ca -0.01 -1.87 -0.32 0.00 -0.02 0.00 0.00 57.16 54.94 1i80 n GLU 56 Cb 0.21 -1.61 -0.16 0.00 -0.02 0.00 0.00 31.44 29.87 1i80 n GLU 56 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1i80 s LEU 57 N -1.30 2.36 0.37 -4.62 1.43 -0.65 -5.03 118.68 111.25 1i80 s LEU 57 Ca 0.34 -0.43 -0.28 0.00 -1.03 0.00 0.00 54.13 52.73 1i80 s LEU 57 Cb 0.21 -1.48 -0.10 0.00 0.03 0.00 0.00 46.19 44.84 1i80 s LEU 57 CO 0.18 0.21 1.43 -2.16 0.23 0.00 0.00 176.35 176.24 1i80 s PRO 58 N 0.07 4.13 0.00 1.29 0.04 -1.26 -3.13 135.00 136.14 1i80 s PRO 58 Ca -0.09 2.45 0.00 0.00 0.04 0.00 0.00 61.00 63.41 1i80 s PRO 58 Cb -0.15 -2.96 0.00 0.00 0.04 0.00 0.00 34.50 31.43 1i80 s PRO 58 CO 0.05 -0.47 0.00 0.41 0.04 0.00 0.00 177.00 177.04 1i80 n GLY 59 N 0.56 2.59 0.15 0.56 0.00 -1.26 -4.63 105.19 103.16 1i80 n GLY 59 Ca 0.01 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.88 1i80 n GLY 59 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1i80 h PHE 60 N 0.00 0.67 -3.31 1.61 -1.00 -1.81 -3.46 116.94 109.64 1i80 h PHE 60 Ca 0.00 -0.39 -0.67 0.00 2.81 0.00 0.00 57.97 59.72 1i80 h PHE 60 Cb 0.00 -0.06 -0.31 0.00 3.61 0.00 0.00 35.95 39.19 1i80 h PHE 60 CO 0.00 1.23 -0.83 0.08 -1.61 0.00 0.00 178.31 177.18 1i80 s VAL 61 N -3.12 2.43 0.58 -0.55 1.01 -1.26 -4.98 120.40 114.51 1i80 s VAL 61 Ca -0.06 -0.87 -0.19 0.00 0.00 0.00 0.00 61.98 60.85 1i80 s VAL 61 Cb 0.08 -1.98 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 1i80 s VAL 61 CO 0.88 0.54 1.21 -2.16 0.00 0.00 0.00 175.10 175.57 1i80 s PRO 62 N 0.48 3.06 0.07 2.72 0.04 -1.26 -4.96 135.00 135.14 1i80 s PRO 62 Ca -0.13 1.83 -0.28 0.00 0.04 0.00 0.00 61.00 62.46 1i80 s PRO 62 Cb -0.17 -1.98 -0.17 0.00 0.04 0.00 0.00 34.50 32.22 1i80 s PRO 62 CO 0.05 -1.13 1.60 -1.00 0.04 0.00 0.00 177.00 176.56 1i80 h PRO 63 N 1.02 -0.50 0.00 0.56 0.13 -2.01 -3.41 132.00 127.80 1i80 h PRO 63 Ca -0.50 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1i80 h PRO 63 Cb 1.29 0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.54 1i80 h PRO 63 CO 0.56 -0.30 0.00 0.25 -0.23 0.00 0.00 178.00 178.28 1i80 n THR 64 N -5.29 0.00 -1.66 1.56 -2.24 -1.26 -4.72 114.28 100.67 1i80 n THR 64 Ca -0.11 0.31 -0.45 0.00 -2.27 0.00 0.00 64.05 61.54 1i80 n THR 64 Cb 0.24 -1.28 -0.03 0.00 -2.10 0.00 0.00 70.33 67.16 1i80 n THR 64 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1i80 n ALA 65 N -3.00 0.86 -3.00 6.98 0.00 -1.26 -4.94 120.51 116.15 1i80 n ALA 65 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1i80 n ALA 65 Cb 0.00 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 17.22 1i80 n ALA 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1i80 n ALA 66 N 1.65 0.00 0.00 0.00 0.00 -1.26 -4.51 120.51 116.39 1i80 n ALA 66 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1i80 n ALA 66 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.76 1i80 n ALA 66 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i80 n GLY 67 N 0.00 0.29 3.15 0.00 0.00 -1.26 -5.04 105.19 102.33 1i80 n GLY 67 Ca 0.00 -0.03 0.06 0.00 0.00 0.00 0.00 46.02 46.05 1i80 n GLY 67 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1i80 s HIS 68 N 0.00 -0.14 1.14 1.61 2.46 -1.26 -5.18 115.29 113.93 1i80 s HIS 68 Ca 0.00 0.12 -0.19 0.00 0.47 0.00 0.00 55.06 55.46 1i80 s HIS 68 Cb 0.00 0.04 0.28 0.00 -0.13 0.00 0.00 32.58 32.77 1i80 s HIS 68 CO 0.00 -0.08 1.05 0.00 -2.47 0.00 0.00 174.74 173.24 1i80 n ALA 69 N 5.34 -3.11 -1.21 1.58 0.00 -1.26 -5.08 120.51 116.78 1i80 n ALA 69 Ca -0.03 -1.55 0.00 0.00 0.00 0.00 0.00 53.44 51.86 1i80 n ALA 69 Cb 0.56 -0.11 0.00 0.00 0.00 0.00 0.00 19.45 19.90 1i80 n ALA 69 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i80 n GLY 70 N -4.28 1.10 3.26 0.00 0.00 -1.26 -4.78 105.19 99.23 1i80 n GLY 70 Ca 0.14 -1.45 -0.14 0.00 0.00 0.00 0.00 46.02 44.57 1i80 n GLY 70 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1i80 s GLU 71 N 1.03 1.22 -0.10 1.61 2.02 -0.27 -1.80 118.70 122.40 1i80 s GLU 71 Ca 0.00 -1.62 0.02 0.00 0.02 0.00 0.00 54.97 53.38 1i80 s GLU 71 Cb 0.00 -0.18 0.01 0.00 0.10 0.00 0.00 34.13 34.07 1i80 s GLU 71 CO 0.00 -0.23 -0.15 -1.17 0.02 0.00 0.00 175.26 173.74 1i80 s LEU 72 N -3.22 1.70 0.10 1.80 0.20 -0.31 -1.44 118.68 117.51 1i80 s LEU 72 Ca 0.31 -0.41 0.08 0.00 0.69 0.00 0.00 54.13 54.79 1i80 s LEU 72 Cb 0.07 -1.06 -0.04 0.00 -0.43 0.00 0.00 46.19 44.73 1i80 s LEU 72 CO 0.08 0.01 -0.15 -0.76 -0.29 0.00 0.00 176.35 175.24 1i80 s LEU 73 N 0.97 2.80 -0.29 -0.68 1.02 0.37 -1.72 118.68 121.15 1i80 s LEU 73 Ca -0.07 -0.47 -0.07 0.00 0.02 0.00 0.00 54.13 53.54 1i80 s LEU 73 Cb -0.15 -1.63 0.00 0.00 0.02 0.00 0.00 46.19 44.43 1i80 s LEU 73 CO -0.01 0.19 0.08 -0.55 0.02 0.00 0.00 176.35 176.08 1i80 s SER 74 N -2.02 5.12 -0.07 2.29 0.15 0.02 -0.55 113.70 118.63 1i80 s SER 74 Ca 0.18 -0.63 0.02 0.00 0.70 0.00 0.00 55.95 56.23 1i80 s SER 74 Cb -0.11 -1.89 0.01 0.00 -1.71 0.00 0.00 66.02 62.33 1i80 s SER 74 CO 0.10 -0.17 -0.13 -0.69 1.20 0.00 0.00 173.24 173.56 1i80 s VAL 75 N 1.52 1.19 -0.09 4.45 1.01 0.51 -0.68 120.40 128.31 1i80 s VAL 75 Ca 0.03 -0.51 -0.27 0.00 0.00 0.00 0.00 61.98 61.23 1i80 s VAL 75 Cb -0.17 -1.09 -0.02 0.00 0.00 0.00 0.00 36.38 35.10 1i80 s VAL 75 CO 0.03 0.37 0.87 -2.16 0.00 0.00 0.00 175.10 174.21 1i80 s PRO 76 N 0.66 4.42 -0.22 2.72 0.04 -1.26 -0.46 135.00 140.90 1i80 s PRO 76 Ca -0.15 1.16 -0.02 0.00 0.04 0.00 0.00 61.00 62.04 1i80 s PRO 76 Cb -0.16 -3.51 0.06 0.00 0.04 0.00 0.00 34.50 30.94 1i80 s PRO 76 CO 0.04 -0.16 0.02 0.42 0.04 0.00 0.00 177.00 177.36 1i80 s ILE 77 N 1.50 0.84 0.00 0.56 1.01 0.01 -4.80 121.20 120.32 1i80 s ILE 77 Ca 0.44 -0.84 0.00 0.00 0.00 0.00 0.00 60.65 60.24 1i80 s ILE 77 Cb -0.18 -1.32 0.00 0.00 0.01 0.00 0.00 42.46 40.97 1i80 s ILE 77 CO 0.19 -0.24 0.00 0.61 0.00 0.00 0.00 174.94 175.50 1i80 n GLY 78 N 4.92 2.43 0.86 6.18 0.00 -1.26 -1.27 105.19 117.06 1i80 n GLY 78 Ca -0.09 -0.40 0.06 0.00 0.00 0.00 0.00 46.02 45.59 1i80 n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i80 n ALA 79 N 10.06 2.61 -2.75 4.61 0.00 -1.26 -4.91 120.51 128.86 1i80 n ALA 79 Ca 0.00 -0.79 -0.30 0.00 0.00 0.00 0.00 53.44 52.35 1i80 n ALA 79 Cb 0.00 -0.99 -0.07 0.00 0.00 0.00 0.00 19.45 18.39 1i80 n ALA 79 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1i80 s HIS 80 N -1.56 3.13 -0.35 0.00 4.02 -0.39 -5.08 115.29 115.05 1i80 s HIS 80 Ca 0.28 0.04 -0.09 0.00 1.02 0.00 0.00 55.06 56.30 1i80 s HIS 80 Cb 0.16 -1.59 0.02 0.00 -1.02 0.00 0.00 32.58 30.16 1i80 s HIS 80 CO 0.17 0.51 0.16 1.03 1.02 0.00 0.00 174.74 177.63 1i80 s ARG 81 N -2.44 2.88 -0.13 1.40 1.81 -1.26 -0.81 118.95 120.39 1i80 s ARG 81 Ca 0.29 -1.03 -0.02 0.00 -1.72 0.00 0.00 55.73 53.24 1i80 s ARG 81 Cb -0.12 -3.61 -0.03 0.00 -0.45 0.00 0.00 34.95 30.74 1i80 s ARG 81 CO 0.21 -0.63 -0.04 0.08 -0.68 0.00 0.00 175.30 174.24 1i80 s VAL 82 N 1.52 3.88 -0.21 3.52 1.01 0.39 -0.67 120.40 129.85 1i80 s VAL 82 Ca 0.02 -0.38 -0.19 0.00 0.00 0.00 0.00 61.98 61.43 1i80 s VAL 82 Cb -0.19 -2.67 -0.03 0.00 0.00 0.00 0.00 36.38 33.50 1i80 s VAL 82 CO 0.05 0.53 0.53 -0.76 0.00 0.00 0.00 175.10 175.45 1i80 s LEU 83 N -0.02 4.13 -0.21 3.92 1.43 0.25 -0.37 118.68 127.82 1i80 s LEU 83 Ca 0.01 0.67 -0.02 0.00 -1.03 0.00 0.00 54.13 53.76 1i80 s LEU 83 Cb -0.13 -2.72 0.00 0.00 0.03 0.00 0.00 46.19 43.37 1i80 s LEU 83 CO 0.03 -0.21 -0.10 -0.69 0.23 0.00 0.00 176.35 175.60 1i80 s VAL 84 N 1.79 2.86 -0.53 -1.59 1.01 0.28 0.25 120.40 124.48 1i80 s VAL 84 Ca 0.24 -0.67 -0.17 0.00 0.00 0.00 0.00 61.98 61.38 1i80 s VAL 84 Cb -0.15 -2.28 0.10 0.00 0.00 0.00 0.00 36.38 34.04 1i80 s VAL 84 CO 0.10 0.46 0.54 -0.76 0.00 0.00 0.00 175.10 175.44 1i80 s LEU 85 N 1.40 5.64 -0.77 3.92 1.43 0.75 -0.48 118.68 130.58 1i80 s LEU 85 Ca 0.05 -1.43 -0.16 0.00 -1.03 0.00 0.00 54.13 51.56 1i80 s LEU 85 Cb -0.14 -2.26 0.16 0.00 0.03 0.00 0.00 46.19 43.98 1i80 s LEU 85 CO -0.07 -0.87 0.82 0.00 0.23 0.00 0.00 176.35 176.46 1i80 s ALA 86 N 2.04 3.72 0.00 4.21 0.00 -0.52 -1.88 121.76 129.33 1i80 s ALA 86 Ca 0.07 -2.86 0.00 0.00 0.00 0.00 0.00 51.96 49.17 1i80 s ALA 86 Cb -0.25 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 19.24 1i80 s ALA 86 CO 0.06 -2.44 0.00 0.41 0.00 0.00 0.00 175.76 173.79 1i80 n GLY 87 N 4.76 3.38 3.84 0.00 0.00 -1.26 -1.11 105.19 114.80 1i80 n GLY 87 Ca 0.08 -1.55 -0.08 0.00 0.00 0.00 0.00 46.02 44.48 1i80 n GLY 87 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1i80 s ARG 88 N -4.92 1.93 -0.03 1.61 1.04 -1.26 -4.74 118.95 112.58 1i80 s ARG 88 Ca 0.00 -1.13 0.05 0.00 -1.04 0.00 0.00 55.73 53.61 1i80 s ARG 88 Cb 0.00 0.62 -0.03 0.00 -2.04 0.00 0.00 34.95 33.50 1i80 s ARG 88 CO 0.00 -0.89 -0.18 0.96 -0.04 0.00 0.00 175.30 175.15 1i80 s ILE 89 N -3.42 2.75 0.26 4.99 -5.25 -1.26 -5.01 121.20 114.26 1i80 s ILE 89 Ca 0.12 -0.90 0.08 0.00 -0.99 0.00 0.00 60.65 58.96 1i80 s ILE 89 Cb -0.06 -2.06 -0.04 0.00 2.95 0.00 0.00 42.46 43.25 1i80 s ILE 89 CO 0.08 0.55 0.15 -1.00 -1.79 0.00 0.00 174.94 172.93 1i80 s HIS 90 N -0.73 3.01 0.37 1.37 3.76 -1.26 -4.54 115.29 117.27 1i80 s HIS 90 Ca 0.12 -0.14 0.08 0.00 -0.15 0.00 0.00 55.06 54.96 1i80 s HIS 90 Cb -0.10 -1.35 0.80 0.00 1.11 0.00 0.00 32.58 33.04 1i80 s HIS 90 CO 0.01 0.55 1.96 0.00 -0.85 0.00 0.00 174.74 176.40 1i80 h ALA 91 N 1.59 1.77 0.00 -1.40 0.00 -1.88 -1.73 119.26 117.60 1i80 h ALA 91 Ca -0.47 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1i80 h ALA 91 Cb 1.24 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1i80 h ALA 91 CO 0.61 0.10 0.00 2.48 0.00 0.00 0.00 179.25 182.44 1i80 n TYR 92 N -4.49 0.75 0.58 0.00 0.18 -1.26 -1.00 117.16 111.93 1i80 n TYR 92 Ca 0.11 0.37 0.08 0.00 1.88 0.00 0.00 57.90 60.34 1i80 n TYR 92 Cb 0.27 -1.10 0.36 0.00 -0.38 0.00 0.00 39.34 38.50 1i80 n TYR 92 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 1i80 n GLU 93 N -2.26 0.00 -0.45 -3.48 1.02 -0.65 -4.83 120.64 110.00 1i80 n GLU 93 Ca -0.01 0.21 0.00 0.00 -0.02 0.00 0.00 57.16 57.34 1i80 n GLU 93 Cb 0.07 -1.51 0.00 0.00 -0.02 0.00 0.00 31.44 29.99 1i80 n GLU 93 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1i80 n GLY 94 N 0.25 0.74 3.94 0.62 0.00 -0.17 -5.08 105.19 105.49 1i80 n GLY 94 Ca 0.04 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.82 1i80 n GLY 94 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1i80 s HIS 95 N -2.64 3.42 0.47 1.61 3.76 -1.26 -5.05 115.29 115.60 1i80 s HIS 95 Ca 0.00 0.33 -0.23 0.00 -0.15 0.00 0.00 55.06 55.01 1i80 s HIS 95 Cb 0.00 -2.04 -0.09 0.00 1.11 0.00 0.00 32.58 31.57 1i80 s HIS 95 CO 0.00 -0.04 1.07 -3.47 -0.85 0.00 0.00 174.74 171.45 1i80 n ASP 96 N -1.89 1.46 0.23 1.40 2.03 -1.26 -4.83 116.55 113.70 1i80 n ASP 96 Ca -0.03 0.99 0.16 0.00 0.52 0.00 0.00 54.79 56.43 1i80 n ASP 96 Cb 0.57 -1.40 0.83 0.00 -0.72 0.00 0.00 41.12 40.39 1i80 n ASP 96 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1i80 h LEU 97 N 1.38 0.00 -1.08 -2.67 3.38 -1.96 -1.82 115.31 112.54 1i80 h LEU 97 Ca -0.47 0.00 0.14 0.00 0.09 0.00 0.00 57.88 57.64 1i80 h LEU 97 Cb 1.33 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 42.00 1i80 h LEU 97 CO 0.56 0.00 0.62 -0.09 0.09 0.00 0.00 178.44 179.62 1i80 h ARG 98 N 0.00 0.86 0.00 1.13 2.43 -1.90 0.23 114.38 117.12 1i80 h ARG 98 Ca 0.00 -0.05 -0.14 0.00 -0.81 0.00 0.00 59.98 58.98 1i80 h ARG 98 Cb 0.02 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.36 1i80 h ARG 98 CO 0.00 0.57 -0.65 1.88 -1.51 0.00 0.00 179.97 180.26 1i80 h TYR 99 N 0.88 0.00 -0.36 2.20 -1.99 -1.64 -0.90 116.97 115.16 1i80 h TYR 99 Ca 0.50 0.00 -0.07 0.00 2.00 0.00 0.00 58.73 61.16 1i80 h TYR 99 Cb 0.62 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.34 1i80 h TYR 99 CO -0.00 0.65 -0.07 0.28 -0.00 0.00 0.00 178.16 179.02 1i80 h VAL 100 N 0.00 1.27 -0.02 -2.88 2.07 -0.70 -3.29 116.25 112.71 1i80 h VAL 100 Ca -0.01 -1.12 0.00 0.00 0.82 0.00 0.00 66.70 66.40 1i80 h VAL 100 Cb 1.17 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 32.20 1i80 h VAL 100 CO 0.08 0.37 -0.21 1.33 0.02 0.00 0.00 177.57 179.16 1i80 n VAL 101 N -4.41 0.00 -0.33 2.57 0.24 -0.51 -4.46 118.33 111.43 1i80 n VAL 101 Ca -0.02 -0.36 0.01 0.00 -2.04 0.00 0.00 64.34 61.94 1i80 n VAL 101 Cb 0.33 1.24 0.15 0.00 -1.47 0.00 0.00 33.84 34.09 1i80 n VAL 101 CO 0.00 0.00 0.00 -0.74 -2.14 0.00 0.00 176.83 173.95 1i80 h HIS 102 N 3.35 1.06 -0.78 6.34 6.17 -1.22 -1.72 115.15 128.36 1i80 h HIS 102 Ca 0.00 0.03 0.07 0.00 0.71 0.00 0.00 60.37 61.18 1i80 h HIS 102 Cb 0.83 -0.35 -0.06 0.00 2.52 0.00 0.00 27.41 30.35 1i80 h HIS 102 CO 0.00 0.56 0.45 -1.35 0.71 0.00 0.00 177.93 178.30 1i80 h PRO 103 N 1.05 0.77 -0.38 5.26 0.11 -1.79 0.53 132.00 137.56 1i80 h PRO 103 Ca 0.39 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 66.41 1i80 h PRO 103 Cb 0.14 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 31.06 1i80 h PRO 103 CO -0.16 0.51 0.08 0.28 -0.21 0.00 0.00 178.00 178.50 1i80 h VAL 104 N 0.79 1.23 -0.60 3.15 2.07 -1.68 0.09 116.25 121.31 1i80 h VAL 104 Ca 0.36 -0.79 -0.10 0.00 0.82 0.00 0.00 66.70 66.99 1i80 h VAL 104 Cb 0.26 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 1i80 h VAL 104 CO -0.21 0.27 -0.02 0.03 0.02 0.00 0.00 177.57 177.66 1i80 h ARG 105 N 0.46 1.07 -0.58 1.57 3.08 -0.65 -0.90 114.38 118.43 1i80 h ARG 105 Ca 0.12 -0.35 -0.06 0.00 0.07 0.00 0.00 59.98 59.76 1i80 h ARG 105 Cb 0.32 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 1i80 h ARG 105 CO 0.00 1.05 0.14 0.00 -1.07 0.00 0.00 179.97 180.09 1i80 h ALA 106 N 0.99 0.76 -0.65 0.04 0.00 0.18 -1.05 119.26 119.54 1i80 h ALA 106 Ca 0.17 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1i80 h ALA 106 Cb 0.58 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 1i80 h ALA 106 CO 0.03 0.47 0.32 0.00 0.00 0.00 0.00 179.25 180.07 1i80 h ALA 107 N 1.03 0.83 -0.39 0.00 0.00 -0.72 -0.91 119.26 119.09 1i80 h ALA 107 Ca 0.18 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1i80 h ALA 107 Cb 0.35 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1i80 h ALA 107 CO 0.00 0.38 0.13 -0.09 0.00 0.00 0.00 179.25 179.68 1i80 h ARG 108 N 0.89 0.60 0.00 0.00 9.65 -0.93 -1.12 114.38 123.47 1i80 h ARG 108 Ca 0.22 -0.12 -0.01 0.00 -1.10 0.00 0.00 59.98 58.97 1i80 h ARG 108 Cb 0.10 -0.09 -0.00 0.00 -1.39 0.00 0.00 29.97 28.59 1i80 h ARG 108 CO -0.03 0.60 -0.04 0.00 2.80 0.00 0.00 179.97 183.30 1i80 h ALA 109 N 0.98 1.43 -0.04 2.80 0.00 -0.88 0.21 119.26 123.77 1i80 h ALA 109 Ca 0.13 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1i80 h ALA 109 Cb 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1i80 h ALA 109 CO -0.01 0.05 0.00 0.00 0.00 0.00 0.00 179.25 179.29 1i80 n ALA 110 N -2.30 2.61 0.00 0.00 0.00 -0.37 -4.90 120.51 115.54 1i80 n ALA 110 Ca -0.03 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.10 1i80 n ALA 110 Cb 0.13 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.29 1i80 n ALA 110 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i80 n GLY 111 N 1.03 1.38 3.64 0.00 0.00 0.73 -1.49 105.19 110.48 1i80 n GLY 111 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 1i80 n GLY 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i80 s ALA 112 N -2.19 3.38 -2.29 4.61 0.00 -0.52 -4.64 121.76 120.11 1i80 s ALA 112 Ca 0.00 0.67 0.21 0.00 0.00 0.00 0.00 51.96 52.84 1i80 s ALA 112 Cb 0.00 -3.82 0.31 0.00 0.00 0.00 0.00 23.12 19.61 1i80 s ALA 112 CO 0.00 -1.78 1.27 1.04 0.00 0.00 0.00 175.76 176.30 1i80 n GLN 113 N 7.51 2.21 -4.02 0.00 6.02 -1.17 -4.06 117.38 123.87 1i80 n GLN 113 Ca 0.19 -2.03 -0.21 0.00 -0.01 0.00 0.00 57.00 54.94 1i80 n GLN 113 Cb 0.44 -1.44 -0.17 0.00 1.02 0.00 0.00 30.24 30.10 1i80 n GLN 113 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1i80 s ILE 114 N -1.47 0.47 -0.14 5.09 1.01 -1.25 -0.77 121.20 124.14 1i80 s ILE 114 Ca 0.31 -0.04 -0.00 0.00 0.00 0.00 0.00 60.65 60.92 1i80 s ILE 114 Cb 0.19 -0.54 -0.01 0.00 0.01 0.00 0.00 42.46 42.11 1i80 s ILE 114 CO 0.27 0.23 -0.13 -0.04 0.00 0.00 0.00 174.94 175.28 1i80 s MET 115 N 1.25 3.37 -0.40 2.79 -1.94 0.09 -1.71 119.30 122.75 1i80 s MET 115 Ca -0.06 -0.69 -0.08 0.00 -1.71 0.00 0.00 55.69 53.16 1i80 s MET 115 Cb -0.14 -2.65 0.08 0.00 2.01 0.00 0.00 34.83 34.13 1i80 s MET 115 CO -0.02 0.18 0.23 0.08 -0.01 0.00 0.00 175.02 175.47 1i80 s VAL 116 N 0.45 4.02 -0.32 -6.03 1.01 0.89 -1.15 120.40 119.27 1i80 s VAL 116 Ca -0.10 -1.45 -0.12 0.00 0.00 0.00 0.00 61.98 60.32 1i80 s VAL 116 Cb -0.16 -3.47 -0.02 0.00 0.00 0.00 0.00 36.38 32.73 1i80 s VAL 116 CO 0.05 -0.48 0.21 -0.76 0.00 0.00 0.00 175.10 174.12 1i80 s LEU 117 N 1.38 4.29 0.20 3.92 1.43 -0.28 -1.44 118.68 128.18 1i80 s LEU 117 Ca 0.03 -0.32 0.08 0.00 -1.03 0.00 0.00 54.13 52.88 1i80 s LEU 117 Cb -0.22 -2.10 -0.04 0.00 0.03 0.00 0.00 46.19 43.85 1i80 s LEU 117 CO 0.01 -0.17 0.04 0.42 0.23 0.00 0.00 176.35 176.88 1i80 s THR 118 N 1.71 3.83 0.26 5.49 -4.23 -0.94 -1.00 115.64 120.75 1i80 s THR 118 Ca 0.06 -1.49 -0.21 0.00 -1.18 0.00 0.00 61.69 58.86 1i80 s THR 118 Cb -0.17 -2.97 0.03 0.00 1.34 0.00 0.00 72.50 70.73 1i80 s THR 118 CO 0.10 -0.20 0.78 0.54 -0.54 0.00 0.00 174.62 175.30 1i80 s ASN 119 N -3.22 -0.22 -0.10 3.99 6.03 -0.52 -3.33 114.94 117.57 1i80 s ASN 119 Ca 0.29 -0.61 -0.03 0.00 -1.03 0.00 0.00 52.86 51.48 1i80 s ASN 119 Cb -0.09 0.68 -0.03 0.00 -3.03 0.00 0.00 41.25 38.79 1i80 s ASN 119 CO 0.20 -1.28 0.01 0.00 -2.03 0.00 0.00 177.10 174.01 1i80 s ALA 120 N -3.63 3.31 0.07 3.54 0.00 -1.26 -0.85 121.76 122.94 1i80 s ALA 120 Ca 0.12 -0.79 -0.06 0.00 0.00 0.00 0.00 51.96 51.23 1i80 s ALA 120 Cb -0.05 -1.55 -0.01 0.00 0.00 0.00 0.00 23.12 21.50 1i80 s ALA 120 CO 0.06 0.52 0.11 0.00 0.00 0.00 0.00 175.76 176.46 1i80 s ALA 121 N -0.68 0.01 0.15 0.00 0.00 -0.78 -4.70 121.76 115.76 1i80 s ALA 121 Ca 0.11 -0.78 -0.16 0.00 0.00 0.00 0.00 51.96 51.13 1i80 s ALA 121 Cb -0.12 0.39 -0.07 0.00 0.00 0.00 0.00 23.12 23.32 1i80 s ALA 121 CO 0.02 -0.44 0.57 0.20 0.00 0.00 0.00 175.76 176.12 1i80 s GLY 122 N -2.76 2.51 -0.11 0.00 0.00 -0.19 -1.71 107.32 105.06 1i80 s GLY 122 Ca 0.04 -0.07 -0.16 0.00 0.00 0.00 0.00 44.72 44.53 1i80 s GLY 122 CO -0.10 0.24 0.41 -0.32 0.00 0.00 0.00 173.10 173.34 1i80 s GLY 123 N -1.62 2.36 -0.12 0.20 0.00 0.53 -1.66 107.32 107.01 1i80 s GLY 123 Ca 0.37 -0.27 0.05 0.00 0.00 0.00 0.00 44.72 44.88 1i80 s GLY 123 CO 0.19 0.58 -0.04 1.04 0.00 0.00 0.00 173.10 174.87 1i80 n LEU 124 N 3.36 1.43 -4.71 0.66 4.32 0.35 -0.49 117.00 121.92 1i80 n LEU 124 Ca -0.09 -0.03 -0.42 0.00 -0.02 0.00 0.00 56.01 55.44 1i80 n LEU 124 Cb 0.52 -0.09 -0.03 0.00 -1.62 0.00 0.00 43.42 42.20 1i80 n LEU 124 CO 0.41 0.48 0.93 -0.60 -1.22 0.00 0.00 177.39 177.40 1i80 s ARG 125 N -2.26 4.40 0.40 3.23 3.52 -1.05 -4.92 118.95 122.28 1i80 s ARG 125 Ca -0.11 1.84 0.24 0.00 -0.13 0.00 0.00 55.73 57.56 1i80 s ARG 125 Cb 0.04 -3.35 1.29 0.00 -1.56 0.00 0.00 34.95 31.37 1i80 s ARG 125 CO 0.37 -0.32 1.66 0.00 -0.81 0.00 0.00 175.30 176.20 1i80 h ALA 126 N 6.88 2.43 0.00 6.12 0.00 -1.94 -1.80 119.26 130.95 1i80 h ALA 126 Ca -0.41 0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1i80 h ALA 126 Cb 1.21 0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1i80 h ALA 126 CO 0.83 -1.02 -0.12 -0.40 0.00 0.00 0.00 179.25 178.54 1i80 n ASP 127 N -4.80 0.65 -4.71 0.00 5.68 -1.26 -4.84 116.55 107.27 1i80 n ASP 127 Ca 0.34 0.46 -0.42 0.00 -0.50 0.00 0.00 54.79 54.67 1i80 n ASP 127 Cb 1.22 -0.55 -0.03 0.00 -1.14 0.00 0.00 41.12 40.61 1i80 n ASP 127 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1i80 s LEU 128 N -4.16 4.36 0.25 -2.12 1.43 -0.68 -5.04 118.68 112.71 1i80 s LEU 128 Ca 0.11 1.57 0.10 0.00 -1.03 0.00 0.00 54.13 54.87 1i80 s LEU 128 Cb 0.14 -3.48 -0.04 0.00 0.03 0.00 0.00 46.19 42.84 1i80 s LEU 128 CO 0.61 -0.24 -0.08 -1.10 0.23 0.00 0.00 176.35 175.77 1i80 s GLN 129 N 1.00 2.07 0.29 1.70 -0.21 -1.26 -4.92 119.66 118.32 1i80 s GLN 129 Ca 0.49 -1.48 -0.30 0.00 0.02 0.00 0.00 55.36 54.09 1i80 s GLN 129 Cb -0.20 -2.05 -0.12 0.00 1.00 0.00 0.00 33.01 31.64 1i80 s GLN 129 CO 0.26 0.37 1.57 0.28 -2.12 0.00 0.00 175.29 175.65 1i80 n VAL 130 N -0.60 1.05 -0.14 1.09 0.31 -1.26 -1.50 118.33 117.27 1i80 n VAL 130 Ca -0.07 -0.26 0.00 0.00 -0.01 0.00 0.00 64.34 64.00 1i80 n VAL 130 Cb 0.58 -1.91 0.00 0.00 -0.91 0.00 0.00 33.84 31.60 1i80 n VAL 130 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1i80 n GLY 131 N 2.11 1.12 3.72 2.92 0.00 0.83 -5.01 105.19 110.88 1i80 n GLY 131 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 1i80 n GLY 131 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1i80 s GLN 132 N -0.56 4.39 0.05 1.61 0.74 -0.56 -4.86 119.66 120.46 1i80 s GLN 132 Ca 0.00 0.69 -0.23 0.00 0.05 0.00 0.00 55.36 55.86 1i80 s GLN 132 Cb 0.00 -3.44 -0.06 0.00 1.10 0.00 0.00 33.01 30.61 1i80 s GLN 132 CO 0.00 0.11 0.70 -1.25 -0.55 0.00 0.00 175.29 174.30 1i80 s PRO 133 N 0.71 4.43 -0.06 1.67 0.04 -1.26 -1.58 135.00 138.95 1i80 s PRO 133 Ca 0.32 0.95 0.03 0.00 0.04 0.00 0.00 61.00 62.34 1i80 s PRO 133 Cb -0.17 -3.34 0.01 0.00 0.04 0.00 0.00 34.50 31.05 1i80 s PRO 133 CO 0.15 0.37 -0.13 0.08 0.04 0.00 0.00 177.00 177.51 1i80 s VAL 134 N -0.30 1.16 0.38 -0.36 1.01 0.16 -4.45 120.40 118.01 1i80 s VAL 134 Ca 0.35 -0.51 -0.24 0.00 0.00 0.00 0.00 61.98 61.58 1i80 s VAL 134 Cb -0.20 -1.05 -0.09 0.00 0.00 0.00 0.00 36.38 35.04 1i80 s VAL 134 CO 0.21 0.36 1.04 -0.76 0.00 0.00 0.00 175.10 175.95 1i80 s LEU 135 N 0.54 4.18 -0.25 3.92 1.43 -0.40 -0.47 118.68 127.64 1i80 s LEU 135 Ca -0.13 2.03 -0.18 0.00 -1.03 0.00 0.00 54.13 54.83 1i80 s LEU 135 Cb -0.15 -4.14 -0.03 0.00 0.03 0.00 0.00 46.19 41.91 1i80 s LEU 135 CO 0.03 -0.43 0.52 -0.63 0.23 0.00 0.00 176.35 176.07 1i80 s ILE 136 N -1.63 5.07 -0.07 -0.59 1.01 0.30 -0.85 121.20 124.44 1i80 s ILE 136 Ca 0.56 0.90 0.14 0.00 0.00 0.00 0.00 60.65 62.25 1i80 s ILE 136 Cb -0.22 -3.83 -0.19 0.00 0.01 0.00 0.00 42.46 38.22 1i80 s ILE 136 CO 0.28 0.10 0.74 -1.54 0.00 0.00 0.00 174.94 174.51 1i80 n SER 137 N 5.43 0.88 -3.57 3.58 3.41 0.00 -4.53 113.62 118.83 1i80 n SER 137 Ca -0.04 0.41 -0.02 0.00 -0.26 0.00 0.00 58.87 58.96 1i80 n SER 137 Cb 0.50 0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 1i80 n SER 137 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1i80 s ASP 138 N -5.97 -0.07 0.14 4.04 -1.08 -1.25 -4.60 116.67 107.88 1i80 s ASP 138 Ca -0.04 -0.47 -0.04 0.00 -0.52 0.00 0.00 52.55 51.48 1i80 s ASP 138 Cb 0.08 0.43 -0.03 0.00 -1.46 0.00 0.00 42.92 41.94 1i80 s ASP 138 CO 0.82 -0.82 0.13 -1.38 0.52 0.00 0.00 175.17 174.44 1i80 s HIS 139 N -2.59 0.68 -0.24 -5.34 -3.43 -1.26 -1.16 115.29 101.94 1i80 s HIS 139 Ca 0.18 -1.06 0.02 0.00 -0.80 0.00 0.00 55.06 53.40 1i80 s HIS 139 Cb -0.01 -0.33 0.06 0.00 -1.43 0.00 0.00 32.58 30.87 1i80 s HIS 139 CO 0.03 -0.58 -0.09 -0.51 -2.00 0.00 0.00 174.74 171.59 1i80 s LEU 140 N -3.01 3.01 -0.62 5.38 1.43 0.48 -4.90 118.68 120.44 1i80 s LEU 140 Ca 0.20 -1.26 -0.25 0.00 -1.03 0.00 0.00 54.13 51.80 1i80 s LEU 140 Cb 0.06 -1.39 0.05 0.00 0.03 0.00 0.00 46.19 44.93 1i80 s LEU 140 CO 0.00 -0.20 1.05 0.21 0.23 0.00 0.00 176.35 177.64 1i80 s ASN 141 N 1.23 6.27 -0.38 2.29 3.84 -1.26 -0.78 114.94 126.15 1i80 s ASN 141 Ca -0.07 -0.50 0.06 0.00 0.21 0.00 0.00 52.86 52.57 1i80 s ASN 141 Cb -0.19 -2.47 0.52 0.00 -0.55 0.00 0.00 41.25 38.56 1i80 s ASN 141 CO -0.06 -1.44 1.59 0.18 -2.79 0.00 0.00 177.10 174.58 1i80 n LEU 142 N 8.04 5.22 0.00 3.21 4.77 -0.18 -4.47 117.00 133.59 1i80 n LEU 142 Ca 0.01 -3.97 0.11 0.00 -0.03 0.00 0.00 56.01 52.12 1i80 n LEU 142 Cb 0.47 -0.68 -0.10 0.00 -2.33 0.00 0.00 43.42 40.78 1i80 n LEU 142 CO 0.66 1.39 -0.26 0.35 -1.33 0.00 0.00 177.39 178.20 1i80 n THR 143 N -1.04 0.03 -1.82 -5.08 -2.24 -1.25 -4.54 114.28 98.34 1i80 n THR 143 Ca 0.44 -0.21 -0.16 0.00 -2.27 0.00 0.00 64.05 61.85 1i80 n THR 143 Cb 1.09 0.52 -0.04 0.00 -2.10 0.00 0.00 70.33 69.79 1i80 n THR 143 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1i80 n ALA 144 N -1.81 -0.34 -2.38 6.98 0.00 -1.26 -4.94 120.51 116.76 1i80 n ALA 144 Ca 0.01 0.20 -0.20 0.00 0.00 0.00 0.00 53.44 53.46 1i80 n ALA 144 Cb 0.43 -1.74 -0.10 0.00 0.00 0.00 0.00 19.45 18.04 1i80 n ALA 144 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1i80 s ARG 145 N -3.96 1.60 -0.09 0.00 0.52 -1.26 -5.17 118.95 110.60 1i80 s ARG 145 Ca 0.00 -1.91 -0.17 0.00 -0.52 0.00 0.00 55.73 53.13 1i80 s ARG 145 Cb 0.00 -0.36 0.04 0.00 0.52 0.00 0.00 34.95 35.15 1i80 s ARG 145 CO 0.00 -0.37 0.42 0.45 0.02 0.00 0.00 175.30 175.82 1i80 s SER 146 N -3.41 -0.37 0.00 0.23 0.15 -1.26 -5.03 113.70 104.00 1i80 s SER 146 Ca 0.35 0.52 0.29 0.00 0.70 0.00 0.00 55.95 57.81 1i80 s SER 146 Cb 0.06 0.60 1.31 0.00 -1.71 0.00 0.00 66.02 66.28 1i80 s SER 146 CO 0.16 -0.34 1.89 -0.81 1.20 0.00 0.00 173.24 175.34 1i80 n PRO 147 N 1.93 1.24 -3.68 5.44 -0.04 -1.26 -4.82 135.00 133.81 1i80 n PRO 147 Ca -0.18 -0.52 -0.37 0.00 -0.04 0.00 0.00 63.50 62.39 1i80 n PRO 147 Cb 0.57 -1.49 -0.06 0.00 -0.04 0.00 0.00 33.50 32.47 1i80 n PRO 147 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1i80 s LEU 148 N -2.12 4.40 0.00 1.53 1.43 -1.26 -4.90 118.68 117.77 1i80 s LEU 148 Ca 0.38 0.67 0.00 0.00 -1.03 0.00 0.00 54.13 54.16 1i80 s LEU 148 Cb 0.21 -2.32 0.00 0.00 0.03 0.00 0.00 46.19 44.11 1i80 s LEU 148 CO 0.38 0.33 0.67 1.33 0.23 0.00 0.00 176.35 179.29 1i80 n VAL 149 N 2.16 0.45 -3.79 -1.59 0.24 -1.26 -5.06 118.33 109.47 1i80 n VAL 149 Ca -0.16 -0.58 -0.22 0.00 -2.04 0.00 0.00 64.34 61.33 1i80 n VAL 149 Cb 0.53 0.88 -0.05 0.00 -1.47 0.00 0.00 33.84 33.74 1i80 n VAL 149 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1i80 s GLY 150 N -0.45 2.23 -0.04 7.63 0.00 -1.26 -5.03 107.32 110.41 1i80 s GLY 150 Ca 0.00 -1.94 0.07 0.00 0.00 0.00 0.00 44.72 42.85 1i80 s GLY 150 CO 0.00 -1.79 1.11 0.61 0.00 0.00 0.00 173.10 173.03 1i80 n GLY 151 N -1.45 0.99 3.77 0.20 0.00 -1.26 -4.94 105.19 102.51 1i80 n GLY 151 Ca 0.02 -0.32 -0.41 0.00 0.00 0.00 0.00 46.02 45.31 1i80 n GLY 151 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1i80 n GLU 152 N 0.28 2.55 -2.29 1.61 4.71 -1.26 -4.92 120.64 121.33 1i80 n GLU 152 Ca 0.10 0.90 -0.43 0.00 -0.01 0.00 0.00 57.16 57.72 1i80 n GLU 152 Cb 0.38 -2.66 -0.02 0.00 -1.01 0.00 0.00 31.44 28.13 1i80 n GLU 152 CO 0.00 0.00 0.00 0.12 0.09 0.00 0.00 177.13 177.34 1i80 s PHE 153 N -1.14 2.52 -0.24 -0.32 5.36 -1.26 -4.99 117.98 117.91 1i80 s PHE 153 Ca 0.55 0.75 -0.01 0.00 -0.96 0.00 0.00 56.93 57.26 1i80 s PHE 153 Cb -0.47 -3.75 0.07 0.00 -0.34 0.00 0.00 43.02 38.53 1i80 s PHE 153 CO 0.62 -2.32 0.02 0.08 -1.46 0.00 0.00 175.22 172.16 1i80 s VAL 154 N 4.10 1.02 -0.24 3.12 1.01 -1.26 -5.08 120.40 123.07 1i80 s VAL 154 Ca 0.61 -1.03 -0.17 0.00 0.00 0.00 0.00 61.98 61.39 1i80 s VAL 154 Cb -0.23 -1.49 -0.03 0.00 0.00 0.00 0.00 36.38 34.62 1i80 s VAL 154 CO 0.22 -0.28 0.48 -0.62 0.00 0.00 0.00 175.10 174.90 1i80 s ASP 155 N 1.61 6.44 -0.03 3.32 2.15 -1.26 -4.97 116.67 123.93 1i80 s ASP 155 Ca -0.00 0.52 0.13 0.00 0.43 0.00 0.00 52.55 53.63 1i80 s ASP 155 Cb -0.18 -2.27 0.42 0.00 -0.30 0.00 0.00 42.92 40.60 1i80 s ASP 155 CO -0.11 -0.21 1.32 0.18 -0.17 0.00 0.00 175.17 176.18 1i80 n LEU 156 N 5.15 2.70 -4.76 -1.34 4.77 -1.26 -4.85 117.00 117.41 1i80 n LEU 156 Ca -0.06 -1.35 -0.41 0.00 -0.03 0.00 0.00 56.01 54.16 1i80 n LEU 156 Cb 0.50 -0.36 -0.02 0.00 -2.33 0.00 0.00 43.42 41.22 1i80 n LEU 156 CO 0.40 0.59 1.09 -0.89 -1.33 0.00 0.00 177.39 177.24 1i80 s THR 157 N -1.51 2.50 -1.43 -5.08 2.01 -1.26 -1.75 115.64 109.12 1i80 s THR 157 Ca 0.31 0.46 -0.10 0.00 0.31 0.00 0.00 61.69 62.67 1i80 s THR 157 Cb 0.18 -3.29 0.07 0.00 0.01 0.00 0.00 72.50 69.46 1i80 s THR 157 CO 0.19 0.09 0.67 0.47 -0.69 0.00 0.00 174.62 175.35 1i80 n ASP 158 N 1.51 -4.53 -0.06 3.53 8.00 -1.26 -4.83 116.55 118.90 1i80 n ASP 158 Ca 0.04 -0.50 0.10 0.00 0.71 0.00 0.00 54.79 55.13 1i80 n ASP 158 Cb 0.40 -3.68 0.48 0.00 -0.02 0.00 0.00 41.12 38.30 1i80 n ASP 158 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1i80 h ALA 159 N 0.98 1.93 -2.54 2.24 0.00 -1.67 -3.22 119.26 116.97 1i80 h ALA 159 Ca -0.50 -0.01 -0.76 0.00 0.00 0.00 0.00 54.91 53.64 1i80 h ALA 159 Cb 1.33 -0.11 -0.27 0.00 0.00 0.00 0.00 17.79 18.75 1i80 h ALA 159 CO 0.59 -0.04 -0.16 0.71 0.00 0.00 0.00 179.25 180.35 1i80 s TYR 160 N -5.42 3.47 -0.40 0.00 1.51 -1.26 -4.08 117.35 111.16 1i80 s TYR 160 Ca -0.08 -1.77 -0.37 0.00 -1.01 0.00 0.00 57.07 53.84 1i80 s TYR 160 Cb 0.19 -3.69 -0.16 0.00 -0.11 0.00 0.00 41.96 38.19 1i80 s TYR 160 CO 0.74 -0.99 1.49 0.45 -1.11 0.00 0.00 175.55 176.14 1i80 n SER 161 N 4.60 0.79 -0.11 2.29 2.88 -0.94 -4.83 113.62 118.31 1i80 n SER 161 Ca -0.02 0.76 0.01 0.00 -1.33 0.00 0.00 58.87 58.29 1i80 n SER 161 Cb 0.42 -0.71 0.30 0.00 -0.75 0.00 0.00 64.21 63.46 1i80 n SER 161 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1i80 h PRO 162 N 5.55 0.77 -0.32 -1.46 0.11 -1.91 -2.07 132.00 132.67 1i80 h PRO 162 Ca -0.22 -0.08 0.02 0.00 0.11 0.00 0.00 66.00 65.83 1i80 h PRO 162 Cb 1.12 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.05 1i80 h PRO 162 CO 0.83 0.57 0.17 -0.09 -0.21 0.00 0.00 178.00 179.27 1i80 h ARG 163 N 0.78 0.35 -0.46 1.05 1.12 -1.98 -0.20 114.38 115.04 1i80 h ARG 163 Ca 0.20 -0.02 -0.10 0.00 -1.11 0.00 0.00 59.98 58.94 1i80 h ARG 163 Cb 0.03 -0.08 -0.02 0.00 -0.01 0.00 0.00 29.97 29.89 1i80 h ARG 163 CO -0.03 0.23 -0.13 -0.07 -3.11 0.00 0.00 179.97 176.86 1i80 h LEU 164 N 0.36 0.84 -1.33 3.80 3.38 -1.81 -1.78 115.31 118.78 1i80 h LEU 164 Ca 0.13 -0.27 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 1i80 h LEU 164 Cb 0.02 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1i80 h LEU 164 CO -0.07 0.98 -0.04 0.03 0.09 0.00 0.00 178.44 179.43 1i80 h ARG 165 N 0.76 0.40 -0.34 1.13 3.08 -0.99 0.43 114.38 118.84 1i80 h ARG 165 Ca 0.12 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 1i80 h ARG 165 Cb 0.64 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.62 1i80 h ARG 165 CO 0.04 0.46 0.17 1.49 -1.07 0.00 0.00 179.97 181.06 1i80 h GLU 166 N 0.38 0.49 -0.60 0.04 4.22 -0.46 -1.67 114.58 116.98 1i80 h GLU 166 Ca 0.08 -0.07 -0.09 0.00 0.08 0.00 0.00 59.36 59.36 1i80 h GLU 166 Cb 0.33 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1i80 h GLU 166 CO 0.01 0.45 0.01 -0.07 -2.18 0.00 0.00 179.01 177.23 1i80 h LEU 167 N 0.42 1.02 -0.96 1.64 3.38 -0.57 -2.52 115.31 117.72 1i80 h LEU 167 Ca 0.12 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.81 1i80 h LEU 167 Cb 0.12 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.55 1i80 h LEU 167 CO -0.02 1.06 0.60 0.00 0.09 0.00 0.00 178.44 180.18 1i80 h ALA 168 N 1.04 1.23 0.00 1.53 0.00 -0.67 -1.67 119.26 120.71 1i80 h ALA 168 Ca 0.17 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1i80 h ALA 168 Cb 0.54 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1i80 h ALA 168 CO 0.03 0.66 0.00 0.00 0.00 0.00 0.00 179.25 179.94 1i80 h ARG 169 N 1.32 0.00 0.00 0.00 3.08 -1.03 -0.89 114.38 116.86 1i80 h ARG 169 Ca 0.35 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.34 1i80 h ARG 169 Cb -0.09 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.95 1i80 h ARG 169 CO -0.07 0.00 -0.28 1.96 -1.07 0.00 0.00 179.97 180.51 1i80 h GLN 170 N 0.00 0.00 0.16 0.04 4.20 -0.88 -0.84 115.11 117.79 1i80 h GLN 170 Ca 0.00 0.00 -0.25 0.00 0.06 0.00 0.00 58.65 58.46 1i80 h GLN 170 Cb 0.50 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.30 1i80 h GLN 170 CO 0.00 0.28 -1.13 1.03 -0.67 0.00 0.00 178.83 178.33 1i80 h SER 171 N 0.00 0.53 -2.63 1.46 0.87 -1.05 -3.43 113.55 109.31 1i80 h SER 171 Ca -0.00 -0.92 -0.55 0.00 -1.23 0.00 0.00 61.79 59.08 1i80 h SER 171 Cb 0.98 -0.17 -0.39 0.00 -0.44 0.00 0.00 62.40 62.38 1i80 h SER 171 CO 0.04 1.53 -0.82 -0.62 -0.53 0.00 0.00 176.83 176.43 1i80 s ASP 172 N -7.13 3.08 0.21 6.23 -1.08 -0.55 -5.00 116.67 112.44 1i80 s ASP 172 Ca -0.14 -1.82 0.13 0.00 -0.52 0.00 0.00 52.55 50.19 1i80 s ASP 172 Cb 0.03 -0.33 0.71 0.00 -1.46 0.00 0.00 42.92 41.87 1i80 s ASP 172 CO 0.84 -0.36 1.37 -2.65 0.52 0.00 0.00 175.17 174.90 1i80 n PRO 173 N 4.50 0.08 0.03 4.34 -0.02 -0.33 -1.76 135.00 141.84 1i80 n PRO 173 Ca 0.05 0.57 0.12 0.00 -2.02 0.00 0.00 63.50 62.23 1i80 n PRO 173 Cb 0.39 -1.83 0.28 0.00 -0.02 0.00 0.00 33.50 32.32 1i80 n PRO 173 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1i80 n GLN 174 N -1.96 0.13 -1.67 -0.52 6.02 -1.26 -4.96 117.38 113.17 1i80 n GLN 174 Ca -0.01 0.05 -0.46 0.00 -0.01 0.00 0.00 57.00 56.57 1i80 n GLN 174 Cb 0.07 -1.59 -0.04 0.00 1.02 0.00 0.00 30.24 29.70 1i80 n GLN 174 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1i80 n LEU 175 N -1.79 3.14 -4.93 1.08 4.77 -0.72 -5.00 117.00 113.53 1i80 n LEU 175 Ca 0.05 1.08 -0.25 0.00 -0.03 0.00 0.00 56.01 56.85 1i80 n LEU 175 Cb 0.38 -1.43 0.04 0.00 -2.33 0.00 0.00 43.42 40.09 1i80 n LEU 175 CO 0.34 -0.26 0.52 0.00 -1.33 0.00 0.00 177.39 176.66 1i80 s ALA 176 N 1.04 3.37 0.12 -1.18 0.00 -1.26 -4.94 121.76 118.91 1i80 s ALA 176 Ca 0.79 -0.90 0.04 0.00 0.00 0.00 0.00 51.96 51.90 1i80 s ALA 176 Cb -0.67 -2.49 -0.04 0.00 0.00 0.00 0.00 23.12 19.92 1i80 s ALA 176 CO 0.38 -0.94 -0.11 -1.21 0.00 0.00 0.00 175.76 173.88 1i80 s GLU 177 N -5.02 0.97 0.11 0.00 2.02 -1.26 -1.27 118.70 114.25 1i80 s GLU 177 Ca 0.56 -1.28 -0.26 0.00 0.02 0.00 0.00 54.97 54.01 1i80 s GLU 177 Cb -0.11 -0.65 0.07 0.00 0.10 0.00 0.00 34.13 33.54 1i80 s GLU 177 CO 0.43 0.10 0.85 0.20 0.02 0.00 0.00 175.26 176.87 1i80 s GLY 178 N -2.71 -0.36 -0.15 -1.39 0.00 -0.03 -4.89 107.32 97.80 1i80 s GLY 178 Ca 0.10 0.45 -0.21 0.00 0.00 0.00 0.00 44.72 45.06 1i80 s GLY 178 CO 0.01 0.13 0.60 0.14 0.00 0.00 0.00 173.10 173.99 1i80 s VAL 179 N -3.37 5.07 -0.21 1.40 1.01 -1.26 -0.82 120.40 122.22 1i80 s VAL 179 Ca 0.08 1.18 -0.09 0.00 0.00 0.00 0.00 61.98 63.15 1i80 s VAL 179 Cb -0.02 -3.93 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 1i80 s VAL 179 CO -0.04 0.20 0.11 -0.47 0.00 0.00 0.00 175.10 174.90 1i80 s TYR 180 N 1.34 3.29 -0.26 5.22 5.04 -0.31 -1.04 117.35 130.63 1i80 s TYR 180 Ca 0.30 0.13 -0.12 0.00 -2.44 0.00 0.00 57.07 54.94 1i80 s TYR 180 Cb -0.16 -2.18 -0.05 0.00 0.35 0.00 0.00 41.96 39.92 1i80 s TYR 180 CO 0.12 0.10 0.23 0.00 -1.34 0.00 0.00 175.55 174.66 1i80 s ALA 181 N 0.74 3.57 -0.28 3.97 0.00 0.18 -0.39 121.76 129.54 1i80 s ALA 181 Ca 0.06 -0.92 -0.10 0.00 0.00 0.00 0.00 51.96 51.00 1i80 s ALA 181 Cb -0.13 -2.48 -0.04 0.00 0.00 0.00 0.00 23.12 20.47 1i80 s ALA 181 CO 0.02 -0.42 0.16 0.20 0.00 0.00 0.00 175.76 175.71 1i80 s GLY 182 N 1.42 1.88 0.34 0.00 0.00 0.04 -1.18 107.32 109.83 1i80 s GLY 182 Ca 0.10 -1.14 0.08 0.00 0.00 0.00 0.00 44.72 43.76 1i80 s GLY 182 CO 0.08 0.63 0.12 1.08 0.00 0.00 0.00 173.10 175.01 1i80 s LEU 183 N 1.71 3.21 0.17 0.66 1.02 -0.44 -1.01 118.68 123.98 1i80 s LEU 183 Ca 0.07 -0.82 -0.10 0.00 0.02 0.00 0.00 54.13 53.29 1i80 s LEU 183 Cb -0.16 -1.66 0.03 0.00 0.02 0.00 0.00 46.19 44.42 1i80 s LEU 183 CO 0.09 -0.30 1.59 -0.65 0.02 0.00 0.00 176.35 177.09 1i80 h PRO 184 N 1.58 1.02 0.00 1.29 0.11 -1.86 -3.39 132.00 130.75 1i80 h PRO 184 Ca -0.43 -0.38 0.00 0.00 0.11 0.00 0.00 66.00 65.30 1i80 h PRO 184 Cb 1.25 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1i80 h PRO 184 CO 0.64 1.06 0.00 0.41 -0.21 0.00 0.00 178.00 179.90 1i80 n GLY 185 N -0.26 -1.19 0.09 -0.55 0.00 -1.26 -4.05 105.19 97.96 1i80 n GLY 185 Ca 0.01 -1.19 0.13 0.00 0.00 0.00 0.00 46.02 44.97 1i80 n GLY 185 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1i80 n PRO 186 N -0.59 0.24 -1.72 1.61 -0.04 -1.26 -4.86 135.00 128.38 1i80 n PRO 186 Ca 0.00 0.18 -0.35 0.00 -0.04 0.00 0.00 63.50 63.29 1i80 n PRO 186 Cb 0.00 -1.77 0.06 0.00 -0.04 0.00 0.00 33.50 31.76 1i80 n PRO 186 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 1i80 s HIS 187 N -3.10 2.24 0.82 0.54 -3.43 -1.26 -5.02 115.29 106.08 1i80 s HIS 187 Ca 0.11 1.55 -0.11 0.00 -0.80 0.00 0.00 55.06 55.81 1i80 s HIS 187 Cb 0.13 -3.47 0.11 0.00 -1.43 0.00 0.00 32.58 27.92 1i80 s HIS 187 CO 0.60 -2.40 1.16 0.71 -2.00 0.00 0.00 174.74 172.82 1i80 s TYR 188 N -1.81 2.55 0.43 0.38 1.51 -1.26 -5.05 117.35 114.09 1i80 s TYR 188 Ca 0.76 0.52 -0.14 0.00 -1.01 0.00 0.00 57.07 57.19 1i80 s TYR 188 Cb -0.30 -3.55 -0.08 0.00 -0.11 0.00 0.00 41.96 37.93 1i80 s TYR 188 CO 0.40 -1.89 0.85 -1.21 -1.11 0.00 0.00 175.55 172.58 1i80 s GLU 189 N -5.55 3.91 0.56 -0.62 8.01 -1.26 -5.08 118.70 118.67 1i80 s GLU 189 Ca 0.65 0.72 -0.08 0.00 0.01 0.00 0.00 54.97 56.26 1i80 s GLU 189 Cb -0.09 -2.29 -0.03 0.00 -4.31 0.00 0.00 34.13 27.41 1i80 s GLU 189 CO 0.49 -0.09 0.90 0.95 0.01 0.00 0.00 175.26 177.52 1i80 s THR 190 N -2.38 4.63 0.38 3.63 -4.23 -1.26 -4.64 115.64 111.76 1i80 s THR 190 Ca 0.55 0.44 0.06 0.00 -1.18 0.00 0.00 61.69 61.56 1i80 s THR 190 Cb -0.10 -3.80 0.28 0.00 1.34 0.00 0.00 72.50 70.22 1i80 s THR 190 CO 0.28 -0.91 2.00 -0.65 -0.54 0.00 0.00 174.62 174.80 1i80 h PRO 191 N -0.06 0.68 -0.71 3.99 0.11 -1.98 -1.86 132.00 132.16 1i80 h PRO 191 Ca -0.46 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 65.55 1i80 h PRO 191 Cb 1.21 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 32.14 1i80 h PRO 191 CO 0.62 0.45 0.18 0.00 -0.21 0.00 0.00 178.00 179.03 1i80 h ALA 192 N 1.65 0.97 -0.35 -0.75 0.00 -1.93 -1.59 119.26 117.25 1i80 h ALA 192 Ca 0.25 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 1i80 h ALA 192 Cb 0.14 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1i80 h ALA 192 CO -0.07 0.67 -0.16 0.93 0.00 0.00 0.00 179.25 180.62 1i80 h GLU 193 N 1.08 0.64 -0.50 0.00 5.08 -1.78 -1.46 114.58 117.63 1i80 h GLU 193 Ca 0.22 -0.22 -0.12 0.00 -1.00 0.00 0.00 59.36 58.25 1i80 h GLU 193 Cb 0.36 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1i80 h GLU 193 CO 0.00 0.77 -0.16 0.82 -1.00 0.00 0.00 179.01 179.44 1i80 h ILE 194 N 0.58 1.27 -0.39 3.13 1.08 -0.92 0.51 117.51 122.77 1i80 h ILE 194 Ca 0.10 -1.31 -0.06 0.00 -0.39 0.00 0.00 64.86 63.20 1i80 h ILE 194 Cb 0.60 1.04 -0.02 0.00 -3.07 0.00 0.00 36.82 35.37 1i80 h ILE 194 CO 0.04 0.46 -0.00 0.03 -0.69 0.00 0.00 178.15 177.99 1i80 h ARG 195 N 0.86 0.62 -0.17 2.37 3.08 -1.02 -1.26 114.38 118.87 1i80 h ARG 195 Ca 0.12 -0.14 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 1i80 h ARG 195 Cb 0.72 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.68 1i80 h ARG 195 CO 0.06 0.64 0.03 1.98 -1.07 0.00 0.00 179.97 181.61 1i80 h MET 196 N 0.59 0.28 -0.78 0.04 4.05 -0.75 -2.28 114.93 116.07 1i80 h MET 196 Ca 0.12 -0.07 0.04 0.00 -0.28 0.00 0.00 59.70 59.51 1i80 h MET 196 Cb 0.37 -0.03 -0.05 0.00 -0.80 0.00 0.00 31.60 31.09 1i80 h MET 196 CO 0.01 0.44 0.49 -0.07 0.23 0.00 0.00 176.91 178.02 1i80 h LEU 197 N 0.08 0.80 -0.89 3.39 3.38 -0.60 -0.90 115.31 120.58 1i80 h LEU 197 Ca 0.05 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.09 1i80 h LEU 197 Cb 0.30 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 40.81 1i80 h LEU 197 CO 0.00 0.55 0.56 1.56 0.09 0.00 0.00 178.44 181.19 1i80 h GLN 198 N 0.95 0.98 -0.23 1.13 4.20 -1.06 -0.48 115.11 120.61 1i80 h GLN 198 Ca 0.32 -0.06 -0.07 0.00 0.06 0.00 0.00 58.65 58.90 1i80 h GLN 198 Cb 0.05 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.59 1i80 h GLN 198 CO -0.13 0.65 -0.16 1.15 -0.67 0.00 0.00 178.83 179.68 1i80 h THR 199 N 1.01 1.22 0.00 -0.54 2.02 -0.69 -2.19 112.91 113.75 1i80 h THR 199 Ca 0.38 -0.99 0.00 0.00 0.77 0.00 0.00 66.41 66.57 1i80 h THR 199 Cb 0.16 1.22 0.00 0.00 -1.74 0.00 0.00 68.15 67.80 1i80 h THR 199 CO -0.17 0.32 0.00 0.18 0.37 0.00 0.00 175.52 176.21 1i80 n LEU 200 N -4.21 0.00 0.00 2.58 4.77 -0.28 -4.90 117.00 114.96 1i80 n LEU 200 Ca -0.00 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 1i80 n LEU 200 Cb 0.32 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 1i80 n LEU 200 CO 0.40 -0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 1i80 n GLY 201 N 1.05 0.89 3.75 -0.72 0.00 -0.74 -5.07 105.19 104.35 1i80 n GLY 201 Ca 0.15 -0.08 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 1i80 n GLY 201 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i80 s ALA 202 N -2.00 3.37 -0.03 4.61 0.00 -0.66 -4.70 121.76 122.36 1i80 s ALA 202 Ca 0.00 0.36 0.12 0.00 0.00 0.00 0.00 51.96 52.44 1i80 s ALA 202 Cb 0.00 -3.03 -0.18 0.00 0.00 0.00 0.00 23.12 19.91 1i80 s ALA 202 CO 0.00 0.13 0.23 -0.25 0.00 0.00 0.00 175.76 175.87 1i80 n ASP 203 N 2.39 2.29 -4.05 0.00 8.00 -0.21 -4.40 116.55 120.57 1i80 n ASP 203 Ca -0.03 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.34 1i80 n ASP 203 Cb 0.49 1.44 -0.12 0.00 -0.02 0.00 0.00 41.12 42.92 1i80 n ASP 203 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1i80 s LEU 204 N -3.96 2.24 -0.04 0.64 1.43 -0.64 -0.50 118.68 117.85 1i80 s LEU 204 Ca -0.04 -0.51 0.02 0.00 -1.03 0.00 0.00 54.13 52.56 1i80 s LEU 204 Cb 0.07 -0.14 0.01 0.00 0.03 0.00 0.00 46.19 46.16 1i80 s LEU 204 CO 0.49 -0.19 -0.08 0.54 0.23 0.00 0.00 176.35 177.34 1i80 s VAL 205 N -1.30 0.73 0.37 -1.59 0.11 -0.66 -0.65 120.40 117.41 1i80 s VAL 205 Ca -0.10 -0.28 -0.03 0.00 -2.93 0.00 0.00 61.98 58.65 1i80 s VAL 205 Cb -0.09 -0.69 0.01 0.00 -1.53 0.00 0.00 36.38 34.08 1i80 s VAL 205 CO 0.00 0.25 0.53 -0.83 -3.33 0.00 0.00 175.10 171.72 1i80 s GLY 206 N 0.55 1.49 -0.20 6.54 0.00 -0.32 -1.02 107.32 114.35 1i80 s GLY 206 Ca -0.09 -1.50 0.14 0.00 0.00 0.00 0.00 44.72 43.27 1i80 s GLY 206 CO 0.01 -0.95 1.31 1.03 0.00 0.00 0.00 173.10 174.50 1i80 n MET 207 N -0.60 1.87 0.00 2.90 2.81 -1.26 -1.33 117.12 121.50 1i80 n MET 207 Ca 0.00 -2.96 0.00 0.00 -1.81 0.00 0.00 57.70 52.93 1i80 n MET 207 Cb 0.61 -1.69 0.00 0.00 -0.71 0.00 0.00 33.22 31.43 1i80 n MET 207 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1i80 n SER 208 N -1.08 0.00 0.00 7.83 3.41 -1.26 -4.68 113.62 117.84 1i80 n SER 208 Ca 0.22 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.83 1i80 n SER 208 Cb 0.81 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.76 1i80 n SER 208 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1i80 n THR 209 N 0.00 0.00 -0.21 6.66 -1.04 -1.26 -4.66 114.28 113.77 1i80 n THR 209 Ca 0.00 0.00 0.01 0.00 -2.04 0.00 0.00 64.05 62.02 1i80 n THR 209 Cb 0.00 0.00 0.12 0.00 -1.82 0.00 0.00 70.33 68.63 1i80 n THR 209 CO 0.00 0.00 0.00 -0.37 -0.64 0.00 0.00 175.07 174.06 1i80 h VAL 210 N 0.00 0.70 -0.24 12.58 -1.51 -1.96 -1.01 116.25 124.81 1i80 h VAL 210 Ca 0.00 -0.12 -0.13 0.00 -1.23 0.00 0.00 66.70 65.22 1i80 h VAL 210 Cb 0.00 0.32 -0.01 0.00 -2.13 0.00 0.00 31.29 29.47 1i80 h VAL 210 CO 0.00 0.06 -0.40 0.45 -1.23 0.00 0.00 177.57 176.45 1i80 h HIS 211 N 0.35 0.68 -0.67 5.19 3.86 -1.97 -1.87 115.15 120.72 1i80 h HIS 211 Ca 0.33 -0.20 -0.01 0.00 -1.16 0.00 0.00 60.37 59.33 1i80 h HIS 211 Cb 0.45 -0.15 -0.03 0.00 1.06 0.00 0.00 27.41 28.74 1i80 h HIS 211 CO -0.20 0.88 0.37 0.93 0.86 0.00 0.00 177.93 180.78 1i80 h GLU 212 N 0.47 0.93 -0.31 2.45 3.07 -1.73 -0.06 114.58 119.40 1i80 h GLU 212 Ca 0.04 -0.11 -0.02 0.00 -0.50 0.00 0.00 59.36 58.78 1i80 h GLU 212 Cb 0.91 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 28.62 1i80 h GLU 212 CO 0.08 0.70 0.12 1.15 -1.40 0.00 0.00 179.01 179.65 1i80 h THR 213 N 0.92 1.18 -0.48 1.13 2.02 -1.00 0.02 112.91 116.71 1i80 h THR 213 Ca 0.24 -0.57 -0.02 0.00 0.77 0.00 0.00 66.41 66.83 1i80 h THR 213 Cb 0.03 0.99 -0.02 0.00 -1.74 0.00 0.00 68.15 67.40 1i80 h THR 213 CO -0.04 0.20 0.23 0.40 0.37 0.00 0.00 175.52 176.68 1i80 h ILE 214 N 0.35 1.19 -0.53 3.11 2.04 -1.12 -0.29 117.51 122.26 1i80 h ILE 214 Ca 0.10 -0.52 -0.08 0.00 1.00 0.00 0.00 64.86 65.35 1i80 h ILE 214 Cb 0.19 0.66 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 1i80 h ILE 214 CO -0.01 0.21 -0.00 0.00 0.00 0.00 0.00 178.15 178.35 1i80 h ALA 215 N 1.07 1.00 -0.08 1.87 0.00 -0.87 -0.74 119.26 121.51 1i80 h ALA 215 Ca 0.16 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1i80 h ALA 215 Cb 0.11 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1i80 h ALA 215 CO -0.02 0.62 0.03 0.00 0.00 0.00 0.00 179.25 179.87 1i80 h ALA 216 N 1.16 0.10 -0.86 0.00 0.00 -0.69 -0.21 119.26 118.76 1i80 h ALA 216 Ca 0.16 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1i80 h ALA 216 Cb 0.50 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 1i80 h ALA 216 CO 0.02 -0.31 0.51 0.00 0.00 0.00 0.00 179.25 179.47 1i80 h ARG 217 N -0.04 1.17 -0.24 0.00 2.47 -0.85 -0.61 114.38 116.28 1i80 h ARG 217 Ca 0.03 -0.11 -0.08 0.00 -1.26 0.00 0.00 59.98 58.56 1i80 h ARG 217 Cb 0.17 -0.24 -0.01 0.00 -1.65 0.00 0.00 29.97 28.23 1i80 h ARG 217 CO -0.00 0.83 -0.19 0.00 0.56 0.00 0.00 179.97 181.16 1i80 h ALA 218 N 1.37 1.23 -0.01 0.04 0.00 -0.86 -2.57 119.26 118.46 1i80 h ALA 218 Ca 0.31 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1i80 h ALA 218 Cb -0.03 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1i80 h ALA 218 CO -0.06 0.50 -0.06 0.00 0.00 0.00 0.00 179.25 179.64 1i80 n ALA 219 N -2.48 2.70 -0.50 0.00 0.00 -0.11 -4.93 120.51 115.18 1i80 n ALA 219 Ca -0.00 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.15 1i80 n ALA 219 Cb 0.35 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.46 1i80 n ALA 219 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i80 n GLY 220 N 1.19 0.69 3.81 0.00 0.00 -0.70 -5.06 105.19 105.12 1i80 n GLY 220 Ca 0.18 -0.51 -0.29 0.00 0.00 0.00 0.00 46.02 45.40 1i80 n GLY 220 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i80 s ALA 221 N -2.00 3.63 0.40 4.61 0.00 -0.32 -4.96 121.76 123.12 1i80 s ALA 221 Ca 0.00 -1.08 -0.09 0.00 0.00 0.00 0.00 51.96 50.79 1i80 s ALA 221 Cb 0.00 -1.46 -0.06 0.00 0.00 0.00 0.00 23.12 21.60 1i80 s ALA 221 CO 0.00 0.65 0.75 -1.21 0.00 0.00 0.00 175.76 175.95 1i80 s GLU 222 N -2.73 3.74 -0.03 0.00 2.02 0.05 -4.05 118.70 117.70 1i80 s GLU 222 Ca 0.31 0.39 0.03 0.00 0.02 0.00 0.00 54.97 55.72 1i80 s GLU 222 Cb -0.11 -2.41 0.00 0.00 0.10 0.00 0.00 34.13 31.70 1i80 s GLU 222 CO 0.23 -0.03 -0.12 0.08 0.02 0.00 0.00 175.26 175.44 1i80 s VAL 223 N -2.39 1.03 -0.21 2.63 1.01 -1.26 -0.73 120.40 120.48 1i80 s VAL 223 Ca 0.50 -0.50 -0.01 0.00 0.00 0.00 0.00 61.98 61.98 1i80 s VAL 223 Cb -0.10 -0.90 0.02 0.00 0.00 0.00 0.00 36.38 35.40 1i80 s VAL 223 CO 0.33 0.31 -0.12 -0.22 0.00 0.00 0.00 175.10 175.39 1i80 s LEU 224 N 0.12 2.69 -0.15 3.92 2.96 -0.30 -2.20 118.68 125.71 1i80 s LEU 224 Ca -0.03 -0.71 -0.06 0.00 -0.22 0.00 0.00 54.13 53.10 1i80 s LEU 224 Cb -0.09 -1.59 -0.04 0.00 0.50 0.00 0.00 46.19 44.97 1i80 s LEU 224 CO 0.01 -0.05 0.06 -0.83 -1.32 0.00 0.00 176.35 174.22 1i80 s GLY 225 N 1.33 1.93 -0.15 7.98 0.00 -1.26 -1.13 107.32 116.01 1i80 s GLY 225 Ca 0.03 -0.74 -0.01 0.00 0.00 0.00 0.00 44.72 43.99 1i80 s GLY 225 CO -0.08 -0.13 -0.02 0.14 0.00 0.00 0.00 173.10 173.01 1i80 s VAL 226 N -0.08 0.81 -0.03 1.40 1.01 -0.17 -0.54 120.40 122.80 1i80 s VAL 226 Ca 0.07 -0.44 -0.03 0.00 0.00 0.00 0.00 61.98 61.58 1i80 s VAL 226 Cb -0.12 -1.05 -0.04 0.00 0.00 0.00 0.00 36.38 35.17 1i80 s VAL 226 CO 0.01 0.09 0.15 -0.44 0.00 0.00 0.00 175.10 174.90 1i80 s SER 227 N 1.76 6.18 -0.27 3.32 0.01 0.39 -1.43 113.70 123.66 1i80 s SER 227 Ca 0.01 0.31 -0.04 0.00 1.31 0.00 0.00 55.95 57.55 1i80 s SER 227 Cb -0.15 -1.91 0.02 0.00 0.21 0.00 0.00 66.02 64.19 1i80 s SER 227 CO -0.07 0.29 0.01 -0.22 0.41 0.00 0.00 173.24 173.65 1i80 s LEU 228 N -1.72 3.48 -0.34 2.44 2.96 -0.03 0.38 118.68 125.86 1i80 s LEU 228 Ca 0.24 -0.77 -0.29 0.00 -0.22 0.00 0.00 54.13 53.09 1i80 s LEU 228 Cb -0.12 -1.77 -0.01 0.00 0.50 0.00 0.00 46.19 44.79 1i80 s LEU 228 CO 0.15 -0.15 1.64 -0.69 -1.32 0.00 0.00 176.35 175.97 1i80 s VAL 229 N 1.41 3.66 -0.91 1.68 1.01 -0.62 -1.86 120.40 124.77 1i80 s VAL 229 Ca 0.02 0.68 0.22 0.00 0.00 0.00 0.00 61.98 62.89 1i80 s VAL 229 Cb -0.17 -3.85 -0.19 0.00 0.00 0.00 0.00 36.38 32.17 1i80 s VAL 229 CO -0.01 -0.52 0.97 0.35 0.00 0.00 0.00 175.10 175.89 1i80 n THR 230 N 7.18 0.01 -3.61 3.92 -2.24 -0.69 -0.12 114.28 118.73 1i80 n THR 230 Ca 0.20 -0.05 -0.05 0.00 -2.27 0.00 0.00 64.05 61.88 1i80 n THR 230 Cb 0.47 0.75 -0.02 0.00 -2.10 0.00 0.00 70.33 69.44 1i80 n THR 230 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1i80 s ASN 231 N -3.17 -0.24 0.17 3.42 4.22 -1.25 -4.56 114.94 113.53 1i80 s ASN 231 Ca 0.07 -0.15 -0.17 0.00 -2.14 0.00 0.00 52.86 50.48 1i80 s ASN 231 Cb 0.16 0.36 -0.07 0.00 1.28 0.00 0.00 41.25 42.98 1i80 s ASN 231 CO 0.84 -0.63 0.61 -0.76 -2.04 0.00 0.00 177.10 175.13 1i80 s LEU 232 N -2.65 4.36 0.80 3.54 1.43 -1.26 -0.35 118.68 124.56 1i80 s LEU 232 Ca 0.09 1.22 -0.14 0.00 -1.03 0.00 0.00 54.13 54.26 1i80 s LEU 232 Cb -0.00 -3.34 0.02 0.00 0.03 0.00 0.00 46.19 42.90 1i80 s LEU 232 CO -0.04 0.09 0.77 0.00 0.23 0.00 0.00 176.35 177.40 1i80 n ALA 233 N 0.86 -1.15 -1.58 4.21 0.00 0.36 -4.65 120.51 118.56 1i80 n ALA 233 Ca -0.05 -0.35 -0.48 0.00 0.00 0.00 0.00 53.44 52.56 1i80 n ALA 233 Cb 0.51 -2.00 -0.04 0.00 0.00 0.00 0.00 19.45 17.93 1i80 n ALA 233 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1i80 n ALA 234 N -2.98 -0.74 0.00 0.00 0.00 -1.26 -2.30 120.51 113.22 1i80 n ALA 234 Ca 0.11 0.46 0.00 0.00 0.00 0.00 0.00 53.44 54.00 1i80 n ALA 234 Cb 0.51 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 17.94 1i80 n ALA 234 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i80 n GLY 235 N 1.94 2.51 0.07 0.00 0.00 -1.26 -4.39 105.19 104.05 1i80 n GLY 235 Ca 0.14 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.04 1i80 n GLY 235 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1i80 h ILE 236 N 0.00 1.36 0.00 -0.61 1.08 -1.78 -3.30 117.51 114.25 1i80 h ILE 236 Ca 0.00 -1.23 0.00 0.00 -0.39 0.00 0.00 64.86 63.24 1i80 h ILE 236 Cb 0.00 2.18 0.00 0.00 -3.07 0.00 0.00 36.82 35.93 1i80 h ILE 236 CO 0.00 0.31 -0.94 0.35 -0.69 0.00 0.00 178.15 177.18 1i80 n THR 237 N -4.85 0.43 -0.71 -0.27 -2.24 -1.26 -4.94 114.28 100.44 1i80 n THR 237 Ca -0.09 -0.41 0.00 0.00 -2.27 0.00 0.00 64.05 61.28 1i80 n THR 237 Cb 0.27 -0.16 0.00 0.00 -2.10 0.00 0.00 70.33 68.34 1i80 n THR 237 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1i80 n GLY 238 N 1.26 0.84 3.81 3.38 0.00 -1.25 -5.03 105.19 108.21 1i80 n GLY 238 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 1i80 n GLY 238 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1i80 s GLU 239 N -0.29 3.26 0.44 1.61 0.41 -1.26 -4.98 118.70 117.89 1i80 s GLU 239 Ca 0.00 -0.26 -0.24 0.00 -0.41 0.00 0.00 54.97 54.06 1i80 s GLU 239 Cb 0.00 -3.03 -0.08 0.00 -1.78 0.00 0.00 34.13 29.24 1i80 s GLU 239 CO 0.00 0.74 1.17 -1.25 -0.49 0.00 0.00 175.26 175.43 1i80 s PRO 240 N -1.13 3.86 0.68 0.39 0.04 -1.26 -4.68 135.00 132.90 1i80 s PRO 240 Ca 0.16 1.82 -0.09 0.00 0.04 0.00 0.00 61.00 62.93 1i80 s PRO 240 Cb -0.12 -2.51 0.02 0.00 0.04 0.00 0.00 34.50 31.94 1i80 s PRO 240 CO 0.06 -0.48 1.03 -0.51 0.04 0.00 0.00 177.00 177.14 1i80 s LEU 241 N -2.83 2.97 -0.15 -3.56 1.43 -1.26 -5.10 118.68 110.18 1i80 s LEU 241 Ca 0.61 0.88 -0.26 0.00 -1.03 0.00 0.00 54.13 54.33 1i80 s LEU 241 Cb -0.30 -3.64 0.06 0.00 0.03 0.00 0.00 46.19 42.35 1i80 s LEU 241 CO 0.37 -1.33 0.65 -0.94 0.23 0.00 0.00 176.35 175.33 1i80 s SER 242 N -4.38 -0.65 0.40 2.29 1.04 -1.26 -5.02 113.70 106.12 1i80 s SER 242 Ca 0.57 1.00 0.07 0.00 0.48 0.00 0.00 55.95 58.06 1i80 s SER 242 Cb -0.11 0.94 0.84 0.00 0.10 0.00 0.00 66.02 67.79 1i80 s SER 242 CO 0.48 -0.41 2.05 -0.74 0.98 0.00 0.00 173.24 175.61 1i80 h HIS 243 N 4.11 0.55 -0.69 5.02 2.76 -1.99 -1.08 115.15 123.82 1i80 h HIS 243 Ca -0.28 0.01 0.04 0.00 -2.20 0.00 0.00 60.37 57.94 1i80 h HIS 243 Cb 1.15 -0.19 -0.05 0.00 1.55 0.00 0.00 27.41 29.88 1i80 h HIS 243 CO 0.40 0.34 0.42 0.00 -1.30 0.00 0.00 177.93 177.79 1i80 h ALA 244 N 1.73 0.91 -0.32 5.26 0.00 -1.98 0.18 119.26 125.03 1i80 h ALA 244 Ca 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1i80 h ALA 244 Cb -0.06 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1i80 h ALA 244 CO -0.04 0.17 0.21 1.49 0.00 0.00 0.00 179.25 181.09 1i80 h GLU 245 N 0.82 0.42 -0.29 0.00 4.81 -1.61 0.50 114.58 119.22 1i80 h GLU 245 Ca 0.28 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.49 1i80 h GLU 245 Cb 0.06 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.33 1i80 h GLU 245 CO -0.12 0.28 0.17 0.28 -0.73 0.00 0.00 179.01 178.88 1i80 h VAL 246 N 0.43 1.11 -0.77 0.32 2.07 -0.87 -1.90 116.25 116.65 1i80 h VAL 246 Ca 0.12 -0.28 -0.02 0.00 0.82 0.00 0.00 66.70 67.34 1i80 h VAL 246 Cb -0.04 0.77 -0.04 0.00 -1.52 0.00 0.00 31.29 30.46 1i80 h VAL 246 CO -0.03 0.11 0.40 -0.07 0.02 0.00 0.00 177.57 178.00 1i80 h LEU 247 N 0.37 0.96 0.06 2.57 3.38 -0.39 -0.84 115.31 121.43 1i80 h LEU 247 Ca 0.10 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1i80 h LEU 247 Cb 0.03 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.54 1i80 h LEU 247 CO -0.02 0.79 -0.03 0.00 0.09 0.00 0.00 178.44 179.27 1i80 h ALA 248 N 1.36 -0.08 -0.70 1.53 0.00 -0.50 -0.10 119.26 120.77 1i80 h ALA 248 Ca 0.27 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1i80 h ALA 248 Cb 0.06 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1i80 h ALA 248 CO -0.04 -0.54 0.35 0.00 0.00 0.00 0.00 179.25 179.02 1i80 h ALA 249 N 0.83 1.31 -0.51 0.00 0.00 -1.10 0.33 119.26 120.13 1i80 h ALA 249 Ca -0.01 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1i80 h ALA 249 Cb 0.08 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1i80 h ALA 249 CO 0.01 0.54 0.26 0.78 0.00 0.00 0.00 179.25 180.84 1i80 h GLY 250 N 1.04 0.78 0.96 0.00 0.00 -0.66 -1.89 103.07 103.31 1i80 h GLY 250 Ca 0.24 -0.38 -0.11 0.00 0.00 0.00 0.00 47.33 47.08 1i80 h GLY 250 CO -0.04 0.36 -0.26 0.00 0.00 0.00 0.00 176.54 176.60 1i80 h ALA 251 N 1.09 0.43 -0.75 3.60 0.00 -0.57 -1.84 119.26 121.21 1i80 h ALA 251 Ca 0.18 -0.39 0.08 0.00 0.00 0.00 0.00 54.91 54.78 1i80 h ALA 251 Cb 0.10 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 1i80 h ALA 251 CO -0.02 0.42 0.49 0.00 0.00 0.00 0.00 179.25 180.14 1i80 h ALA 252 N 0.71 1.74 -0.40 0.00 0.00 -0.76 -2.35 119.26 118.20 1i80 h ALA 252 Ca 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1i80 h ALA 252 Cb 0.83 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1i80 h ALA 252 CO 0.07 0.13 0.00 0.43 0.00 0.00 0.00 179.25 179.87 1i80 n SER 253 N -4.49 3.36 0.04 0.00 7.64 -0.73 -4.71 113.62 114.73 1i80 n SER 253 Ca 0.12 -1.95 -0.15 0.00 1.01 0.00 0.00 58.87 57.90 1i80 n SER 253 Cb 0.27 -0.26 -0.09 0.00 -1.01 0.00 0.00 64.21 63.12 1i80 n SER 253 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1i80 h ALA 254 N 4.00 -0.91 -0.43 -0.43 0.00 -0.76 0.59 119.26 121.32 1i80 h ALA 254 Ca 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1i80 h ALA 254 Cb 0.92 0.93 -0.02 0.00 0.00 0.00 0.00 17.79 19.62 1i80 h ALA 254 CO 0.00 -1.06 0.23 1.15 0.00 0.00 0.00 179.25 179.56 1i80 h THR 255 N -0.61 1.14 -0.28 0.00 2.02 -1.81 -1.40 112.91 111.97 1i80 h THR 255 Ca 0.01 -0.36 -0.15 0.00 0.77 0.00 0.00 66.41 66.68 1i80 h THR 255 Cb 0.66 0.57 -0.00 0.00 -1.74 0.00 0.00 68.15 67.64 1i80 h THR 255 CO -0.35 0.15 -0.42 -0.09 0.37 0.00 0.00 175.52 175.19 1i80 h ARG 256 N 0.59 0.78 -0.20 6.66 2.43 -1.80 -2.38 114.38 120.46 1i80 h ARG 256 Ca 0.15 -0.46 -0.02 0.00 -0.81 0.00 0.00 59.98 58.85 1i80 h ARG 256 Cb 0.03 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 1i80 h ARG 256 CO -0.02 1.09 0.06 0.52 -1.51 0.00 0.00 179.97 180.11 1i80 h MET 257 N 0.53 0.32 -0.75 0.20 2.86 -0.43 -1.51 114.93 116.14 1i80 h MET 257 Ca 0.03 -0.07 -0.03 0.00 -2.06 0.00 0.00 59.70 57.57 1i80 h MET 257 Cb 1.01 -0.05 -0.04 0.00 0.06 0.00 0.00 31.60 32.59 1i80 h MET 257 CO 0.10 0.41 0.35 0.78 1.06 0.00 0.00 176.91 179.61 1i80 h GLY 258 N 0.16 1.16 1.16 8.32 0.00 -1.31 0.38 103.07 112.93 1i80 h GLY 258 Ca 0.07 -0.57 -0.09 0.00 0.00 0.00 0.00 47.33 46.74 1i80 h GLY 258 CO -0.00 0.54 0.03 0.00 0.00 0.00 0.00 176.54 177.11 1i80 h ALA 259 N 1.31 0.93 -0.08 3.60 0.00 -1.29 -1.48 119.26 122.24 1i80 h ALA 259 Ca 0.26 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1i80 h ALA 259 Cb 0.12 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1i80 h ALA 259 CO -0.03 0.65 -0.01 1.25 0.00 0.00 0.00 179.25 181.10 1i80 h LEU 260 N 0.94 0.14 -0.50 0.00 5.85 -0.76 -2.21 115.31 118.79 1i80 h LEU 260 Ca 0.18 -0.35 0.04 0.00 0.84 0.00 0.00 57.88 58.58 1i80 h LEU 260 Cb 0.50 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.45 1i80 h LEU 260 CO 0.02 0.46 0.26 -0.07 -0.34 0.00 0.00 178.44 178.77 1i80 h LEU 261 N -0.18 0.37 -0.65 2.25 3.38 -0.84 -0.82 115.31 118.83 1i80 h LEU 261 Ca 0.02 0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.03 1i80 h LEU 261 Cb 0.40 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.07 1i80 h LEU 261 CO 0.01 0.26 0.41 0.00 0.09 0.00 0.00 178.44 179.21 1i80 h ALA 262 N 1.26 0.83 -0.16 1.53 0.00 -1.23 0.60 119.26 122.10 1i80 h ALA 262 Ca 0.22 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.96 1i80 h ALA 262 Cb 0.12 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1i80 h ALA 262 CO -0.15 0.20 -0.48 0.22 0.00 0.00 0.00 179.25 179.04 1i80 h ASP 263 N 0.83 0.46 -0.05 0.00 3.58 -0.97 -1.91 116.42 118.35 1i80 h ASP 263 Ca 0.25 -0.22 -0.04 0.00 0.42 0.00 0.00 57.03 57.44 1i80 h ASP 263 Cb -0.03 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 40.89 1i80 h ASP 263 CO -0.08 0.87 -0.11 0.58 -2.88 0.00 0.00 179.24 177.61 1i80 h VAL 264 N 0.34 1.43 -0.78 2.25 2.07 -0.79 -3.21 116.25 117.56 1i80 h VAL 264 Ca 0.02 -1.44 -0.00 0.00 0.82 0.00 0.00 66.70 66.10 1i80 h VAL 264 Cb 0.97 2.25 -0.04 0.00 -1.52 0.00 0.00 31.29 32.95 1i80 h VAL 264 CO 0.08 0.40 0.49 0.40 0.02 0.00 0.00 177.57 178.96 1i80 h ILE 265 N -0.34 1.21 -0.07 4.57 2.04 -0.90 -1.01 117.51 123.02 1i80 h ILE 265 Ca 0.00 -0.44 0.02 0.00 1.00 0.00 0.00 64.86 65.44 1i80 h ILE 265 Cb 0.70 0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 36.87 1i80 h ILE 265 CO 0.03 0.22 0.12 0.00 0.00 0.00 0.00 178.15 178.51 1i80 h ALA 266 N 1.47 1.50 -0.01 1.87 0.00 -1.34 -0.19 119.26 122.54 1i80 h ALA 266 Ca 0.28 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1i80 h ALA 266 Cb -0.07 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1i80 h ALA 266 CO -0.06 -0.15 -0.07 0.54 0.00 0.00 0.00 179.25 179.52 1i80 n ARG 267 N -3.56 1.44 0.00 0.00 1.74 -0.38 -4.77 116.66 111.13 1i80 n ARG 267 Ca -0.01 -0.83 0.13 0.00 -0.77 0.00 0.00 57.85 56.36 1i80 n ARG 267 Cb 0.21 -1.48 0.74 0.00 -1.02 0.00 0.00 32.46 30.91 1i80 n ARG 267 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30