#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i80 s ASP 7 N 0.00 6.47 0.11 2.55 -1.08 -1.26 -4.88 116.67 118.58 1i80 s ASP 7 Ca 0.00 2.89 -0.23 0.00 -0.52 0.00 0.00 52.55 54.69 1i80 s ASP 7 Cb 0.00 -2.66 -0.10 0.00 -1.46 0.00 0.00 42.92 38.70 1i80 s ASP 7 CO 0.00 -0.77 1.70 -0.65 0.52 0.00 0.00 175.17 175.98 1i80 h PRO 8 N 3.08 -0.13 -0.25 4.34 0.11 -2.00 0.34 132.00 137.49 1i80 h PRO 8 Ca -0.50 0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.54 1i80 h PRO 8 Cb 1.24 0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 1i80 h PRO 8 CO 0.64 -0.09 -0.18 -0.44 -0.21 0.00 0.00 178.00 177.72 1i80 h ASP 9 N -0.13 0.43 -0.47 -2.05 3.32 -1.99 -1.59 116.42 113.93 1i80 h ASP 9 Ca 0.03 -0.12 -0.09 0.00 0.02 0.00 0.00 57.03 56.87 1i80 h ASP 9 Cb 0.17 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 1i80 h ASP 9 CO -0.08 0.64 -0.06 -0.08 -1.72 0.00 0.00 179.24 177.94 1i80 h GLU 10 N 0.40 0.88 -0.34 3.56 4.22 -1.86 -1.18 114.58 120.25 1i80 h GLU 10 Ca 0.07 -0.31 -0.07 0.00 0.08 0.00 0.00 59.36 59.13 1i80 h GLU 10 Cb 0.56 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 1i80 h GLU 10 CO 0.04 0.95 -0.06 -0.07 -2.18 0.00 0.00 179.01 177.68 1i80 h LEU 11 N 0.73 0.54 -0.46 1.64 4.07 -0.61 -0.36 115.31 120.85 1i80 h LEU 11 Ca 0.13 -0.13 -0.04 0.00 0.08 0.00 0.00 57.88 57.92 1i80 h LEU 11 Cb 0.59 -0.14 -0.02 0.00 1.08 0.00 0.00 40.66 42.17 1i80 h LEU 11 CO 0.04 0.65 0.14 0.00 -1.08 0.00 0.00 178.44 178.19 1i80 h ALA 12 N 1.41 0.60 -0.40 1.53 0.00 -0.95 0.19 119.26 121.65 1i80 h ALA 12 Ca 0.10 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1i80 h ALA 12 Cb 0.44 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1i80 h ALA 12 CO 0.02 0.26 0.13 0.00 0.00 0.00 0.00 179.25 179.67 1i80 h ARG 13 N 0.61 0.61 -0.72 0.00 3.08 -0.74 -0.09 114.38 117.13 1i80 h ARG 13 Ca 0.15 -0.13 -0.02 0.00 0.07 0.00 0.00 59.98 60.05 1i80 h ARG 13 Cb 0.28 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.20 1i80 h ARG 13 CO -0.00 0.61 0.39 0.00 -1.07 0.00 0.00 179.97 179.89 1i80 h ARG 14 N 0.50 1.00 -0.42 0.04 3.08 -0.87 -1.42 114.38 116.28 1i80 h ARG 14 Ca 0.13 -0.11 -0.12 0.00 0.07 0.00 0.00 59.98 59.95 1i80 h ARG 14 Cb 0.25 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 1i80 h ARG 14 CO -0.01 0.74 -0.19 0.00 -1.07 0.00 0.00 179.97 179.44 1i80 h ALA 15 N 1.42 0.59 -0.75 0.04 0.00 -0.57 -2.55 119.26 117.44 1i80 h ALA 15 Ca 0.25 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1i80 h ALA 15 Cb 0.03 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 1i80 h ALA 15 CO -0.04 0.55 0.46 0.00 0.00 0.00 0.00 179.25 180.21 1i80 h ALA 16 N 0.83 1.40 -0.13 0.00 0.00 -0.49 -0.19 119.26 120.69 1i80 h ALA 16 Ca 0.10 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1i80 h ALA 16 Cb 0.75 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1i80 h ALA 16 CO 0.06 0.52 0.06 0.37 0.00 0.00 0.00 179.25 180.26 1i80 h GLN 17 N 1.02 0.19 -0.57 0.00 5.75 -1.05 0.46 115.11 120.91 1i80 h GLN 17 Ca 0.27 -0.03 -0.03 0.00 -0.15 0.00 0.00 58.65 58.71 1i80 h GLN 17 Cb -0.06 -0.03 -0.03 0.00 1.07 0.00 0.00 27.48 28.43 1i80 h GLN 17 CO -0.05 0.26 0.24 0.28 -2.65 0.00 0.00 178.83 176.91 1i80 h VAL 18 N 0.08 1.22 0.01 2.39 2.07 -1.06 -1.55 116.25 119.40 1i80 h VAL 18 Ca 0.04 -0.66 0.02 0.00 0.82 0.00 0.00 66.70 66.92 1i80 h VAL 18 Cb 0.14 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1i80 h VAL 18 CO -0.00 0.26 -0.12 0.40 0.02 0.00 0.00 177.57 178.13 1i80 h ILE 19 N 0.78 0.71 -0.10 4.57 2.04 -0.81 -0.15 117.51 124.55 1i80 h ILE 19 Ca 0.19 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.09 1i80 h ILE 19 Cb 0.18 0.71 -0.05 0.00 -0.74 0.00 0.00 36.82 36.92 1i80 h ILE 19 CO -0.02 0.00 -0.19 0.00 0.00 0.00 0.00 178.15 177.94 1i80 h ALA 20 N 0.76 -0.16 -0.60 1.87 0.00 -0.65 0.12 119.26 120.60 1i80 h ALA 20 Ca 0.04 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1i80 h ALA 20 Cb 0.25 0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 1i80 h ALA 20 CO -0.11 -0.65 0.35 -0.44 0.00 0.00 0.00 179.25 178.40 1i80 h ASP 21 N -0.26 0.73 0.81 0.00 3.32 -1.07 -0.94 116.42 119.01 1i80 h ASP 21 Ca 0.09 -0.07 -0.15 0.00 0.02 0.00 0.00 57.03 56.92 1i80 h ASP 21 Cb 0.38 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 1i80 h ASP 21 CO -0.25 0.58 -0.71 0.03 -1.72 0.00 0.00 179.24 177.18 1i80 h ARG 22 N 0.81 0.00 0.00 3.56 2.47 -0.75 -3.26 114.38 117.21 1i80 h ARG 22 Ca 0.21 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.93 1i80 h ARG 22 Cb -0.00 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.32 1i80 h ARG 22 CO -0.04 0.71 -0.98 0.25 0.56 0.00 0.00 179.97 180.47 1i80 n THR 23 N -3.60 0.11 -1.07 2.04 -2.24 0.38 -4.96 114.28 104.94 1i80 n THR 23 Ca -0.01 -0.17 -0.02 0.00 -2.27 0.00 0.00 64.05 61.58 1i80 n THR 23 Cb 0.72 0.35 -0.01 0.00 -2.10 0.00 0.00 70.33 69.28 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 1.41 0.50 3.22 3.38 0.00 -0.37 -4.92 105.19 108.41 1i80 n GLY 24 Ca 0.03 -0.17 -0.34 0.00 0.00 0.00 0.00 46.02 45.53 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 -1.78 2.76 0.13 -0.61 -1.09 -1.20 -5.03 121.20 114.38 1i80 s ILE 25 Ca 0.00 -0.71 -0.24 0.00 -2.23 0.00 0.00 60.65 57.46 1i80 s ILE 25 Cb 0.00 -2.23 -0.03 0.00 -1.58 0.00 0.00 42.46 38.62 1i80 s ILE 25 CO 0.00 0.47 1.64 1.23 -1.23 0.00 0.00 174.94 177.05 1i80 h GLY 26 N 8.03 -0.28 -5.11 6.18 0.00 -1.94 -3.40 103.07 106.55 1i80 h GLY 26 Ca -0.43 0.28 -0.17 0.00 0.00 0.00 0.00 47.33 47.00 1i80 h GLY 26 CO 0.62 -0.19 -0.57 -0.54 0.00 0.00 0.00 176.54 175.86 1i80 s GLU 27 N -6.08 0.30 -0.16 4.80 2.02 -1.26 -4.83 118.70 113.48 1i80 s GLU 27 Ca -0.15 -0.18 -0.05 0.00 0.02 0.00 0.00 54.97 54.61 1i80 s GLU 27 Cb 0.10 0.13 -0.04 0.00 0.10 0.00 0.00 34.13 34.42 1i80 s GLU 27 CO 0.67 -0.06 0.02 -1.01 0.02 0.00 0.00 175.26 174.90 1i80 s HIS 28 N -0.74 3.17 0.15 1.61 3.76 -0.50 -4.84 115.29 117.90 1i80 s HIS 28 Ca -0.08 -0.03 -0.00 0.00 -0.15 0.00 0.00 55.06 54.79 1i80 s HIS 28 Cb -0.05 -2.00 -0.05 0.00 1.11 0.00 0.00 32.58 31.59 1i80 s HIS 28 CO 0.01 0.14 1.34 -0.44 -0.85 0.00 0.00 174.74 174.94 1i80 h ASP 29 N 6.46 0.37 -4.29 1.40 3.32 -1.36 -1.05 116.42 121.27 1i80 h ASP 29 Ca -0.37 -0.30 -0.41 0.00 0.02 0.00 0.00 57.03 55.98 1i80 h ASP 29 Cb 1.18 -0.11 -0.20 0.00 0.22 0.00 0.00 39.33 40.42 1i80 h ASP 29 CO 0.66 1.10 -0.77 -0.69 -1.72 0.00 0.00 179.24 177.82 1i80 s VAL 30 N -3.21 1.19 -0.02 -1.35 1.01 -1.17 -1.34 120.40 115.52 1i80 s VAL 30 Ca -0.04 -1.51 0.04 0.00 0.00 0.00 0.00 61.98 60.46 1i80 s VAL 30 Cb 0.09 -1.30 -0.01 0.00 0.00 0.00 0.00 36.38 35.17 1i80 s VAL 30 CO 0.84 -0.33 -0.12 0.00 0.00 0.00 0.00 175.10 175.49 1i80 s ALA 31 N -1.75 1.02 -0.10 5.51 0.00 -0.47 -1.33 121.76 124.65 1i80 s ALA 31 Ca 0.03 -0.50 0.04 0.00 0.00 0.00 0.00 51.96 51.53 1i80 s ALA 31 Cb -0.07 -0.29 0.00 0.00 0.00 0.00 0.00 23.12 22.76 1i80 s ALA 31 CO 0.02 0.23 -0.21 0.08 0.00 0.00 0.00 175.76 175.88 1i80 s VAL 32 N -0.16 1.86 -0.32 0.00 1.01 0.97 -0.22 120.40 123.55 1i80 s VAL 32 Ca 0.02 -0.90 -0.06 0.00 0.00 0.00 0.00 61.98 61.05 1i80 s VAL 32 Cb -0.06 -1.63 0.03 0.00 0.00 0.00 0.00 36.38 34.73 1i80 s VAL 32 CO -0.00 0.52 0.08 -0.69 0.00 0.00 0.00 175.10 175.00 1i80 s VAL 33 N 0.45 3.67 -0.22 2.92 1.01 -0.59 -0.44 120.40 127.19 1i80 s VAL 33 Ca -0.17 -1.08 -0.29 0.00 0.00 0.00 0.00 61.98 60.44 1i80 s VAL 33 Cb -0.17 -3.03 0.01 0.00 0.00 0.00 0.00 36.38 33.18 1i80 s VAL 33 CO 0.07 -0.10 1.02 -0.76 0.00 0.00 0.00 175.10 175.33 1i80 s LEU 34 N 1.40 4.12 0.94 3.92 1.43 -0.77 -2.20 118.68 127.52 1i80 s LEU 34 Ca -0.01 1.37 -0.14 0.00 -1.03 0.00 0.00 54.13 54.32 1i80 s LEU 34 Cb -0.19 -3.51 0.20 0.00 0.03 0.00 0.00 46.19 42.72 1i80 s LEU 34 CO 0.02 -0.63 1.29 -0.83 0.23 0.00 0.00 176.35 176.43 1i80 s GLY 35 N 1.20 1.80 0.19 -3.19 0.00 -1.18 -4.41 107.32 101.72 1i80 s GLY 35 Ca 0.44 -1.39 -0.33 0.00 0.00 0.00 0.00 44.72 43.44 1i80 s GLY 35 CO 0.08 -0.61 1.57 -1.26 0.00 0.00 0.00 173.10 172.88 1i80 n SER 36 N -3.66 3.20 0.00 1.64 2.88 -1.26 -0.96 113.62 115.45 1i80 n SER 36 Ca 0.16 1.09 0.00 0.00 -1.33 0.00 0.00 58.87 58.80 1i80 n SER 36 Cb 0.59 -1.46 0.00 0.00 -0.75 0.00 0.00 64.21 62.60 1i80 n SER 36 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1i80 n GLY 37 N 3.21 2.08 0.03 0.46 0.00 -1.26 -3.67 105.19 106.05 1i80 n GLY 37 Ca 0.15 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.29 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 -2.00 0.28 -0.27 1.61 7.02 -0.14 -4.45 117.44 119.50 1i80 n TRP 38 Ca 0.00 0.08 0.02 0.00 -1.02 0.00 0.00 57.50 56.58 1i80 n TRP 38 Cb 0.00 -0.44 0.09 0.00 -2.42 0.00 0.00 31.31 28.54 1i80 n TRP 38 CO 0.00 0.00 0.00 -0.07 -2.02 0.00 0.00 177.69 175.60 1i80 h LEU 39 N 0.00 -0.74 0.00 -0.99 3.38 -1.89 0.78 115.31 115.84 1i80 h LEU 39 Ca 0.00 0.23 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1i80 h LEU 39 Cb 0.69 0.49 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1i80 h LEU 39 CO 0.00 -0.26 0.00 -0.81 0.09 0.00 0.00 178.44 177.46 1i80 n PRO 40 N -5.50 0.28 0.00 1.13 -0.04 -1.26 -2.05 135.00 127.55 1i80 n PRO 40 Ca 0.10 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.69 1i80 n PRO 40 Cb 0.39 -1.30 0.30 0.00 -0.04 0.00 0.00 33.50 32.86 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 -0.80 3.34 -0.12 0.55 0.00 0.27 -4.38 120.51 119.37 1i80 n ALA 41 Ca 0.04 -0.39 -0.06 0.00 0.00 0.00 0.00 53.44 53.04 1i80 n ALA 41 Cb 0.02 -1.12 0.01 0.00 0.00 0.00 0.00 19.45 18.36 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 0.63 0.38 -0.59 0.00 2.07 -1.57 -1.73 116.25 115.44 1i80 h VAL 42 Ca 0.00 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.58 1i80 h VAL 42 Cb 0.51 0.38 -0.06 0.00 -1.52 0.00 0.00 31.29 30.60 1i80 h VAL 42 CO 0.00 0.00 0.28 0.00 0.02 0.00 0.00 177.57 177.87 1i80 h ALA 43 N 1.08 0.77 0.00 1.67 0.00 -1.84 -1.94 119.26 119.00 1i80 h ALA 43 Ca 0.19 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 1i80 h ALA 43 Cb 0.45 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1i80 h ALA 43 CO -0.49 -0.08 -0.23 0.00 0.00 0.00 0.00 179.25 178.45 1i80 h ALA 44 N 1.34 1.09 0.00 0.00 0.00 -1.73 -2.39 119.26 117.57 1i80 h ALA 44 Ca 0.27 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1i80 h ALA 44 Cb 0.23 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1i80 h ALA 44 CO -0.21 0.29 -0.29 1.25 0.00 0.00 0.00 179.25 180.29 1i80 h LEU 45 N 0.00 0.00 0.00 0.00 6.46 -0.52 -3.34 115.31 117.91 1i80 h LEU 45 Ca -0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 1i80 h LEU 45 Cb 0.66 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.59 1i80 h LEU 45 CO 0.03 0.29 0.00 0.61 -0.62 0.00 0.00 178.44 178.75 1i80 n GLY 46 N -0.13 4.13 3.73 3.75 0.00 -0.90 -4.71 105.19 111.06 1i80 n GLY 46 Ca -0.01 -1.39 -0.42 0.00 0.00 0.00 0.00 46.02 44.20 1i80 n GLY 46 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1i80 s SER 47 N 0.00 7.03 0.68 1.61 1.04 -1.26 -4.71 113.70 118.08 1i80 s SER 47 Ca 0.00 2.18 -0.13 0.00 0.48 0.00 0.00 55.95 58.49 1i80 s SER 47 Cb 0.00 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.53 1i80 s SER 47 CO 0.00 -0.46 1.07 -2.84 0.98 0.00 0.00 173.24 171.99 1i80 s PRO 48 N 0.44 2.88 -0.03 4.02 0.02 -1.26 -4.53 135.00 136.55 1i80 s PRO 48 Ca 0.57 1.13 0.22 0.00 0.02 0.00 0.00 61.00 62.94 1i80 s PRO 48 Cb -0.32 -1.98 -0.33 0.00 0.02 0.00 0.00 34.50 31.89 1i80 s PRO 48 CO 0.33 -1.15 0.49 0.25 -0.33 0.00 0.00 177.00 176.58 1i80 n THR 49 N -2.81 0.06 -3.86 0.99 -2.24 -0.16 -4.95 114.28 101.31 1i80 n THR 49 Ca 0.09 -0.51 -0.12 0.00 -2.27 0.00 0.00 64.05 61.24 1i80 n THR 49 Cb 0.53 -0.02 -0.12 0.00 -2.10 0.00 0.00 70.33 68.62 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 -3.49 0.03 -0.05 4.28 2.01 -1.23 -5.02 115.64 112.18 1i80 s THR 50 Ca -0.08 -0.25 -0.01 0.00 0.31 0.00 0.00 61.69 61.66 1i80 s THR 50 Cb 0.14 -0.23 0.03 0.00 0.01 0.00 0.00 72.50 72.44 1i80 s THR 50 CO 0.90 -0.14 0.02 -0.69 -0.69 0.00 0.00 174.62 174.03 1i80 s VAL 51 N -0.42 0.14 -0.00 3.82 1.01 -1.26 -1.94 120.40 121.74 1i80 s VAL 51 Ca -0.05 0.22 0.03 0.00 0.00 0.00 0.00 61.98 62.18 1i80 s VAL 51 Cb -0.03 -0.32 -0.01 0.00 0.00 0.00 0.00 36.38 36.02 1i80 s VAL 51 CO 0.00 0.20 -0.09 -1.48 0.00 0.00 0.00 175.10 173.73 1i80 s LEU 52 N 1.75 2.04 0.23 3.92 0.05 -0.71 -4.98 118.68 120.98 1i80 s LEU 52 Ca 0.00 -0.20 -0.30 0.00 0.05 0.00 0.00 54.13 53.68 1i80 s LEU 52 Cb -0.13 -0.46 -0.10 0.00 -2.05 0.00 0.00 46.19 43.46 1i80 s LEU 52 CO -0.03 0.09 1.49 -2.84 -0.55 0.00 0.00 176.35 174.51 1i80 s PRO 53 N -0.34 4.24 0.44 1.48 0.02 -1.26 -0.83 135.00 138.74 1i80 s PRO 53 Ca 0.03 2.35 0.10 0.00 0.02 0.00 0.00 61.00 63.50 1i80 s PRO 53 Cb -0.04 -3.11 0.97 0.00 0.02 0.00 0.00 34.50 32.33 1i80 s PRO 53 CO -0.00 -0.50 2.05 1.96 -0.33 0.00 0.00 177.00 180.18 1i80 h GLN 54 N 5.55 0.30 0.00 5.54 4.20 -1.46 -1.62 115.11 127.62 1i80 h GLN 54 Ca -0.45 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.23 1i80 h GLN 54 Cb 1.21 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.93 1i80 h GLN 54 CO 0.82 0.25 0.00 0.00 -0.67 0.00 0.00 178.83 179.23 1i80 h ALA 55 N 1.80 1.00 -0.61 3.87 0.00 -1.88 -1.06 119.26 122.38 1i80 h ALA 55 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1i80 h ALA 55 Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1i80 h ALA 55 CO -0.01 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.63 1i80 n GLU 56 N -2.40 2.63 -4.56 0.00 1.02 -0.61 -4.90 120.64 111.83 1i80 n GLU 56 Ca -0.01 -2.51 -0.33 0.00 -0.02 0.00 0.00 57.16 54.28 1i80 n GLU 56 Cb 0.09 -1.55 -0.12 0.00 -0.02 0.00 0.00 31.44 29.84 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 -1.18 3.09 0.24 -4.62 1.43 -0.40 -5.04 118.68 112.19 1i80 s LEU 57 Ca 0.45 -0.15 -0.31 0.00 -1.03 0.00 0.00 54.13 53.09 1i80 s LEU 57 Cb 0.25 -1.71 -0.14 0.00 0.03 0.00 0.00 46.19 44.61 1i80 s LEU 57 CO 0.33 0.22 1.30 -2.65 0.23 0.00 0.00 176.35 175.78 1i80 n PRO 58 N 3.19 1.78 -0.30 1.29 -0.02 -1.26 -2.92 135.00 136.76 1i80 n PRO 58 Ca -0.18 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 1i80 n PRO 58 Cb 0.53 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 1i80 n PRO 58 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1i80 n GLY 59 N 1.89 1.98 0.13 -1.23 0.00 -1.26 -4.55 105.19 102.15 1i80 n GLY 59 Ca 0.11 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.06 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 0.26 -3.63 1.61 -1.00 -1.79 -3.46 116.94 108.93 1i80 h PHE 60 Ca 0.00 -0.14 -0.67 0.00 2.81 0.00 0.00 57.97 59.97 1i80 h PHE 60 Cb 0.00 -0.03 -0.25 0.00 3.61 0.00 0.00 35.95 39.27 1i80 h PHE 60 CO 0.00 0.94 -0.77 0.08 -1.61 0.00 0.00 178.31 176.95 1i80 s VAL 61 N -3.25 3.03 0.72 -0.55 1.01 -1.26 -5.00 120.40 115.09 1i80 s VAL 61 Ca -0.03 -0.70 -0.14 0.00 0.00 0.00 0.00 61.98 61.11 1i80 s VAL 61 Cb 0.10 -2.23 0.03 0.00 0.00 0.00 0.00 36.38 34.28 1i80 s VAL 61 CO 0.82 0.55 1.14 -2.16 0.00 0.00 0.00 175.10 175.46 1i80 s PRO 62 N -0.12 2.38 0.01 2.72 0.04 -1.26 -5.00 135.00 133.77 1i80 s PRO 62 Ca -0.01 1.49 -0.15 0.00 0.04 0.00 0.00 61.00 62.36 1i80 s PRO 62 Cb -0.14 -1.89 -0.09 0.00 0.04 0.00 0.00 34.50 32.43 1i80 s PRO 62 CO 0.04 -1.60 0.93 -1.00 0.04 0.00 0.00 177.00 175.41 1i80 h PRO 63 N -0.37 -0.54 0.00 0.56 0.13 -2.00 -3.42 132.00 126.36 1i80 h PRO 63 Ca -0.46 0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1i80 h PRO 63 Cb 1.26 0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.51 1i80 h PRO 63 CO 0.51 -0.36 0.00 0.25 -0.23 0.00 0.00 178.00 178.17 1i80 n THR 64 N -3.99 0.00 -1.70 1.56 -2.24 -1.26 -4.68 114.28 101.97 1i80 n THR 64 Ca -0.07 0.38 -0.44 0.00 -2.27 0.00 0.00 64.05 61.65 1i80 n THR 64 Cb 0.22 -1.24 -0.02 0.00 -2.10 0.00 0.00 70.33 67.19 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 1.54 -3.00 6.98 0.00 -1.26 -4.96 120.51 116.82 1i80 n ALA 65 Ca 0.00 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.83 1i80 n ALA 65 Cb 0.00 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.12 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 1.78 0.00 0.00 0.00 0.00 -1.26 -4.53 120.51 116.50 1i80 n ALA 66 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1i80 n ALA 66 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.78 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 0.22 0.00 0.00 0.00 -1.26 -5.05 105.19 99.10 1i80 n GLY 67 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1i80 n GLY 67 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1i80 n HIS 68 N 0.00 0.00 -0.93 1.61 -0.00 -1.26 -5.18 115.22 109.46 1i80 n HIS 68 Ca 0.00 0.00 -0.16 0.00 0.46 0.00 0.00 57.72 58.02 1i80 n HIS 68 Cb 0.00 0.00 0.13 0.00 -0.12 0.00 0.00 29.99 30.00 1i80 n HIS 68 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1i80 n ALA 69 N 0.00 -1.66 -1.32 1.57 0.00 -1.26 -5.08 120.51 112.75 1i80 n ALA 69 Ca 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 53.44 52.55 1i80 n ALA 69 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 19.45 19.39 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 -1.12 1.22 3.38 0.00 0.00 -1.26 -4.77 105.19 102.63 1i80 n GLY 70 Ca 0.08 -1.56 -0.21 0.00 0.00 0.00 0.00 46.02 44.34 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 1.42 1.41 -0.12 1.61 2.02 -0.71 -1.21 118.70 123.12 1i80 s GLU 71 Ca 0.00 -1.60 0.03 0.00 0.02 0.00 0.00 54.97 53.42 1i80 s GLU 71 Cb 0.00 -1.34 0.01 0.00 0.10 0.00 0.00 34.13 32.89 1i80 s GLU 71 CO 0.00 0.24 -0.22 -1.17 0.02 0.00 0.00 175.26 174.13 1i80 s LEU 72 N -3.22 2.08 0.06 1.80 0.20 -0.01 -1.10 118.68 118.49 1i80 s LEU 72 Ca 0.23 -0.58 0.06 0.00 0.69 0.00 0.00 54.13 54.53 1i80 s LEU 72 Cb -0.03 -1.41 -0.04 0.00 -0.43 0.00 0.00 46.19 44.28 1i80 s LEU 72 CO 0.09 0.10 -0.08 -0.76 -0.29 0.00 0.00 176.35 175.41 1i80 s LEU 73 N 0.67 3.10 -0.29 -0.68 1.02 0.93 -1.73 118.68 121.69 1i80 s LEU 73 Ca -0.11 -0.28 -0.02 0.00 0.02 0.00 0.00 54.13 53.74 1i80 s LEU 73 Cb -0.16 -1.84 0.04 0.00 0.02 0.00 0.00 46.19 44.25 1i80 s LEU 73 CO 0.02 0.22 -0.01 -0.55 0.02 0.00 0.00 176.35 176.04 1i80 s SER 74 N -1.88 4.78 -0.07 2.29 0.15 -0.82 0.36 113.70 118.51 1i80 s SER 74 Ca 0.20 -1.18 0.04 0.00 0.70 0.00 0.00 55.95 55.71 1i80 s SER 74 Cb -0.11 -1.71 -0.00 0.00 -1.71 0.00 0.00 66.02 62.49 1i80 s SER 74 CO 0.11 -0.23 -0.20 -0.69 1.20 0.00 0.00 173.24 173.43 1i80 s VAL 75 N 1.27 1.74 -0.07 4.45 1.01 0.14 -0.99 120.40 127.95 1i80 s VAL 75 Ca -0.04 -0.86 -0.24 0.00 0.00 0.00 0.00 61.98 60.84 1i80 s VAL 75 Cb -0.19 -1.50 -0.03 0.00 0.00 0.00 0.00 36.38 34.65 1i80 s VAL 75 CO -0.02 0.49 0.73 -2.16 0.00 0.00 0.00 175.10 174.15 1i80 s PRO 76 N 0.20 4.44 -0.22 2.72 0.04 -1.26 -0.17 135.00 140.74 1i80 s PRO 76 Ca -0.11 0.93 -0.04 0.00 0.04 0.00 0.00 61.00 61.83 1i80 s PRO 76 Cb -0.15 -3.46 0.07 0.00 0.04 0.00 0.00 34.50 31.01 1i80 s PRO 76 CO 0.05 0.03 0.08 0.42 0.04 0.00 0.00 177.00 177.62 1i80 s ILE 77 N 0.92 0.20 0.00 0.56 1.01 -0.53 -4.89 121.20 118.47 1i80 s ILE 77 Ca 0.39 -0.56 0.00 0.00 0.00 0.00 0.00 60.65 60.48 1i80 s ILE 77 Cb -0.18 -0.92 0.00 0.00 0.01 0.00 0.00 42.46 41.37 1i80 s ILE 77 CO 0.19 -0.41 0.00 0.61 0.00 0.00 0.00 174.94 175.32 1i80 n GLY 78 N 5.16 1.73 1.97 6.18 0.00 -1.26 -1.98 105.19 117.00 1i80 n GLY 78 Ca -0.07 -0.46 -0.21 0.00 0.00 0.00 0.00 46.02 45.28 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 10.63 5.40 -2.43 4.61 0.00 -1.26 -4.97 120.51 132.49 1i80 n ALA 79 Ca 0.00 -3.12 -0.22 0.00 0.00 0.00 0.00 53.44 50.10 1i80 n ALA 79 Cb 0.00 -1.28 -0.11 0.00 0.00 0.00 0.00 19.45 18.07 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 -3.40 1.98 -0.24 0.00 4.02 -0.84 -5.08 115.29 111.74 1i80 s HIS 80 Ca 0.55 -0.44 -0.01 0.00 1.02 0.00 0.00 55.06 56.18 1i80 s HIS 80 Cb 0.46 -0.94 0.02 0.00 -1.02 0.00 0.00 32.58 31.11 1i80 s HIS 80 CO 0.05 0.46 -0.08 1.03 1.02 0.00 0.00 174.74 177.22 1i80 s ARG 81 N -3.13 2.91 -0.14 1.40 1.81 -1.26 -1.45 118.95 119.10 1i80 s ARG 81 Ca 0.21 -0.92 -0.02 0.00 -1.72 0.00 0.00 55.73 53.28 1i80 s ARG 81 Cb -0.05 -2.93 -0.02 0.00 -0.45 0.00 0.00 34.95 31.50 1i80 s ARG 81 CO 0.09 -0.35 -0.06 0.08 -0.68 0.00 0.00 175.30 174.38 1i80 s VAL 82 N 1.33 3.67 -0.19 3.52 1.01 0.76 -1.16 120.40 129.34 1i80 s VAL 82 Ca 0.01 -0.45 -0.19 0.00 0.00 0.00 0.00 61.98 61.36 1i80 s VAL 82 Cb -0.16 -2.58 -0.03 0.00 0.00 0.00 0.00 36.38 33.61 1i80 s VAL 82 CO -0.06 0.52 0.54 -0.76 0.00 0.00 0.00 175.10 175.34 1i80 s LEU 83 N 0.19 4.16 -0.23 3.92 1.43 -0.44 0.28 118.68 127.98 1i80 s LEU 83 Ca -0.03 0.72 -0.01 0.00 -1.03 0.00 0.00 54.13 53.77 1i80 s LEU 83 Cb -0.14 -2.75 0.02 0.00 0.03 0.00 0.00 46.19 43.35 1i80 s LEU 83 CO 0.03 -0.19 -0.09 -0.69 0.23 0.00 0.00 176.35 175.64 1i80 s VAL 84 N 1.62 2.73 -0.48 -1.59 1.01 0.16 -0.02 120.40 123.82 1i80 s VAL 84 Ca 0.25 -0.93 -0.22 0.00 0.00 0.00 0.00 61.98 61.08 1i80 s VAL 84 Cb -0.16 -2.31 0.04 0.00 0.00 0.00 0.00 36.38 33.95 1i80 s VAL 84 CO 0.10 0.31 0.74 -0.76 0.00 0.00 0.00 175.10 175.49 1i80 s LEU 85 N 1.33 4.47 -0.98 3.92 1.43 0.41 -0.05 118.68 129.21 1i80 s LEU 85 Ca 0.02 -0.43 -0.09 0.00 -1.03 0.00 0.00 54.13 52.60 1i80 s LEU 85 Cb -0.15 -2.73 0.25 0.00 0.03 0.00 0.00 46.19 43.58 1i80 s LEU 85 CO -0.06 -0.94 0.94 0.00 0.23 0.00 0.00 176.35 176.52 1i80 s ALA 86 N 3.12 4.45 0.00 4.21 0.00 -0.26 -1.84 121.76 131.44 1i80 s ALA 86 Ca 0.24 -3.69 0.00 0.00 0.00 0.00 0.00 51.96 48.52 1i80 s ALA 86 Cb -0.15 -3.40 0.00 0.00 0.00 0.00 0.00 23.12 19.57 1i80 s ALA 86 CO 0.18 -2.21 0.00 0.41 0.00 0.00 0.00 175.76 174.14 1i80 n GLY 87 N 3.01 3.70 3.35 0.00 0.00 -1.26 -1.73 105.19 112.25 1i80 n GLY 87 Ca 0.20 -0.88 -0.20 0.00 0.00 0.00 0.00 46.02 45.14 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 -4.48 1.68 -0.07 1.61 1.70 -1.26 -4.63 118.95 113.50 1i80 s ARG 88 Ca 0.00 -1.97 0.04 0.00 -0.47 0.00 0.00 55.73 53.32 1i80 s ARG 88 Cb 0.00 -0.07 0.00 0.00 -0.57 0.00 0.00 34.95 34.31 1i80 s ARG 88 CO 0.00 -0.50 -0.18 0.96 -1.08 0.00 0.00 175.30 174.49 1i80 s ILE 89 N -3.52 1.58 0.30 4.99 -4.36 -1.26 -4.98 121.20 113.96 1i80 s ILE 89 Ca 0.35 -0.77 0.04 0.00 -0.26 0.00 0.00 60.65 60.01 1i80 s ILE 89 Cb 0.04 -1.38 -0.02 0.00 1.25 0.00 0.00 42.46 42.35 1i80 s ILE 89 CO 0.19 0.45 0.45 -1.00 0.24 0.00 0.00 174.94 175.27 1i80 s HIS 90 N 0.26 3.38 0.40 1.37 3.76 -1.26 -4.58 115.29 118.61 1i80 s HIS 90 Ca -0.10 0.04 0.07 0.00 -0.15 0.00 0.00 55.06 54.91 1i80 s HIS 90 Cb -0.15 -1.78 0.82 0.00 1.11 0.00 0.00 32.58 32.58 1i80 s HIS 90 CO 0.04 0.22 2.03 0.00 -0.85 0.00 0.00 174.74 176.18 1i80 h ALA 91 N 0.97 1.65 0.00 -1.40 0.00 -1.88 -1.62 119.26 116.98 1i80 h ALA 91 Ca -0.50 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1i80 h ALA 91 Cb 1.23 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1i80 h ALA 91 CO 0.59 0.30 0.00 2.48 0.00 0.00 0.00 179.25 182.62 1i80 n TYR 92 N -4.44 0.28 1.45 0.00 0.18 -1.26 -1.12 117.16 112.25 1i80 n TYR 92 Ca 0.03 0.14 0.14 0.00 1.88 0.00 0.00 57.90 60.09 1i80 n TYR 92 Cb 0.09 -0.72 0.75 0.00 -0.38 0.00 0.00 39.34 39.08 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 -1.78 0.50 -0.44 -3.48 1.02 -0.61 -4.82 120.64 111.02 1i80 n GLU 93 Ca 0.00 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 1i80 n GLU 93 Cb 0.06 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 29.98 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 1.11 0.79 3.90 0.62 0.00 -0.27 -5.07 105.19 106.27 1i80 n GLY 94 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.92 3.48 0.37 1.61 3.76 -1.26 -5.03 115.29 115.30 1i80 s HIS 95 Ca 0.00 0.69 -0.26 0.00 -0.15 0.00 0.00 55.06 55.34 1i80 s HIS 95 Cb 0.00 -2.14 -0.12 0.00 1.11 0.00 0.00 32.58 31.43 1i80 s HIS 95 CO 0.00 0.12 1.09 -3.47 -0.85 0.00 0.00 174.74 171.64 1i80 n ASP 96 N -1.05 1.72 0.24 1.40 2.03 -1.26 -4.83 116.55 114.80 1i80 n ASP 96 Ca -0.01 1.11 0.15 0.00 0.52 0.00 0.00 54.79 56.56 1i80 n ASP 96 Cb 0.54 -1.38 0.80 0.00 -0.72 0.00 0.00 41.12 40.36 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 1.91 0.00 -1.29 -2.67 3.38 -1.96 -1.69 115.31 112.99 1i80 h LEU 97 Ca -0.44 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.53 1i80 h LEU 97 Cb 1.32 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.04 1i80 h LEU 97 CO 0.59 0.00 0.44 0.08 0.09 0.00 0.00 178.44 179.64 1i80 h ARG 98 N 0.00 0.91 -0.04 1.13 0.11 -1.89 -0.90 114.38 113.70 1i80 h ARG 98 Ca 0.00 -0.06 -0.18 0.00 0.10 0.00 0.00 59.98 59.84 1i80 h ARG 98 Cb 0.13 -0.20 -0.01 0.00 1.11 0.00 0.00 29.97 31.00 1i80 h ARG 98 CO 0.00 0.62 -0.76 1.88 0.10 0.00 0.00 179.97 181.81 1i80 h TYR 99 N 0.93 0.37 -0.58 4.08 -1.99 -1.63 -0.57 116.97 117.58 1i80 h TYR 99 Ca 0.25 -0.17 -0.06 0.00 2.00 0.00 0.00 58.73 60.74 1i80 h TYR 99 Cb -0.08 -0.05 -0.02 0.00 2.00 0.00 0.00 36.73 38.57 1i80 h TYR 99 CO 0.00 0.93 0.12 0.28 -0.00 0.00 0.00 178.16 179.49 1i80 h VAL 100 N 0.17 1.25 -0.03 -2.88 2.07 -1.32 -3.18 116.25 112.34 1i80 h VAL 100 Ca -0.03 -0.93 0.00 0.00 0.82 0.00 0.00 66.70 66.56 1i80 h VAL 100 Cb 1.34 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 31.85 1i80 h VAL 100 CO 0.12 0.34 -0.02 1.33 0.02 0.00 0.00 177.57 179.36 1i80 n VAL 101 N -4.35 0.00 -0.35 2.57 0.24 -0.45 -4.48 118.33 111.51 1i80 n VAL 101 Ca 0.03 -0.46 0.07 0.00 -2.04 0.00 0.00 64.34 61.93 1i80 n VAL 101 Cb 0.25 1.37 0.23 0.00 -1.47 0.00 0.00 33.84 34.23 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 4.34 1.10 -0.49 6.34 6.17 -1.07 -0.66 115.15 130.88 1i80 h HIS 102 Ca 0.00 0.03 -0.01 0.00 0.71 0.00 0.00 60.37 61.11 1i80 h HIS 102 Cb 0.93 -0.35 -0.02 0.00 2.52 0.00 0.00 27.41 30.49 1i80 h HIS 102 CO 0.00 0.43 0.28 -1.35 0.71 0.00 0.00 177.93 178.01 1i80 h PRO 103 N 0.96 0.67 -0.22 5.26 0.11 -1.78 0.30 132.00 137.29 1i80 h PRO 103 Ca 0.49 -0.06 -0.10 0.00 0.11 0.00 0.00 66.00 66.44 1i80 h PRO 103 Cb 0.48 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.45 1i80 h PRO 103 CO -0.27 0.48 -0.26 0.28 -0.21 0.00 0.00 178.00 178.02 1i80 h VAL 104 N 0.68 1.32 -0.29 3.15 2.07 -1.46 -1.24 116.25 120.48 1i80 h VAL 104 Ca 0.18 -1.44 -0.14 0.00 0.82 0.00 0.00 66.70 66.12 1i80 h VAL 104 Cb -0.01 1.74 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 1i80 h VAL 104 CO -0.03 0.45 -0.37 0.03 0.02 0.00 0.00 177.57 177.67 1i80 h ARG 105 N 0.27 0.68 -0.49 1.57 3.08 -0.94 -1.30 114.38 117.24 1i80 h ARG 105 Ca 0.03 -0.33 -0.07 0.00 0.07 0.00 0.00 59.98 59.68 1i80 h ARG 105 Cb 0.83 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.86 1i80 h ARG 105 CO 0.06 0.94 0.03 0.00 -1.07 0.00 0.00 179.97 179.93 1i80 h ALA 106 N 1.03 0.66 -0.45 0.04 0.00 -0.39 -0.65 119.26 119.50 1i80 h ALA 106 Ca 0.05 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.71 1i80 h ALA 106 Cb 0.89 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1i80 h ALA 106 CO 0.08 0.44 0.29 0.00 0.00 0.00 0.00 179.25 180.05 1i80 h ALA 107 N 0.94 0.57 -0.75 0.00 0.00 -1.06 0.03 119.26 118.99 1i80 h ALA 107 Ca 0.14 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1i80 h ALA 107 Cb 0.47 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 1i80 h ALA 107 CO 0.02 -0.00 0.47 -0.09 0.00 0.00 0.00 179.25 179.65 1i80 h ARG 108 N 0.58 1.01 0.00 0.00 9.65 -0.94 -0.40 114.38 124.29 1i80 h ARG 108 Ca 0.17 -0.08 -0.03 0.00 -1.10 0.00 0.00 59.98 58.93 1i80 h ARG 108 Cb -0.04 -0.22 -0.00 0.00 -1.39 0.00 0.00 29.97 28.31 1i80 h ARG 108 CO -0.05 0.70 -0.16 0.00 2.80 0.00 0.00 179.97 183.26 1i80 h ALA 109 N 1.25 1.25 -0.09 2.80 0.00 -0.48 -0.88 119.26 123.12 1i80 h ALA 109 Ca 0.27 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1i80 h ALA 109 Cb -0.07 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1i80 h ALA 109 CO -0.05 0.20 0.00 0.00 0.00 0.00 0.00 179.25 179.39 1i80 n ALA 110 N -2.29 2.56 0.00 0.00 0.00 -0.06 -4.88 120.51 115.85 1i80 n ALA 110 Ca -0.01 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.02 1i80 n ALA 110 Cb 0.28 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.56 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 1.08 0.67 3.68 0.00 0.00 -0.34 -1.41 105.19 108.87 1i80 n GLY 111 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.00 3.63 -0.61 4.61 0.00 -0.26 -4.47 121.76 122.66 1i80 s ALA 112 Ca 0.00 1.01 0.19 0.00 0.00 0.00 0.00 51.96 53.16 1i80 s ALA 112 Cb 0.00 -3.68 -0.24 0.00 0.00 0.00 0.00 23.12 19.20 1i80 s ALA 112 CO 0.00 -1.15 0.68 1.04 0.00 0.00 0.00 175.76 176.32 1i80 n GLN 113 N 6.09 0.72 -4.23 0.00 6.02 -0.45 -4.39 117.38 121.14 1i80 n GLN 113 Ca 0.16 -0.06 -0.23 0.00 -0.01 0.00 0.00 57.00 56.86 1i80 n GLN 113 Cb 0.42 -1.41 -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 -2.96 0.82 -0.21 5.09 1.01 -1.20 -0.99 121.20 122.76 1i80 s ILE 114 Ca 0.03 -0.25 -0.05 0.00 0.00 0.00 0.00 60.65 60.37 1i80 s ILE 114 Cb 0.14 -0.81 -0.02 0.00 0.01 0.00 0.00 42.46 41.77 1i80 s ILE 114 CO 0.78 0.30 -0.00 -0.04 0.00 0.00 0.00 174.94 175.98 1i80 s MET 115 N 1.06 3.56 -0.42 2.79 -1.94 0.47 -1.37 119.30 123.45 1i80 s MET 115 Ca -0.08 -0.54 -0.12 0.00 -1.71 0.00 0.00 55.69 53.24 1i80 s MET 115 Cb -0.14 -3.09 0.06 0.00 2.01 0.00 0.00 34.83 33.67 1i80 s MET 115 CO -0.01 -0.06 0.28 0.08 -0.01 0.00 0.00 175.02 175.31 1i80 s VAL 116 N 1.18 4.65 -0.26 -6.03 1.01 0.70 -1.22 120.40 120.43 1i80 s VAL 116 Ca 0.03 -1.10 -0.09 0.00 0.00 0.00 0.00 61.98 60.81 1i80 s VAL 116 Cb -0.14 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 1i80 s VAL 116 CO 0.01 -0.43 0.14 -0.76 0.00 0.00 0.00 175.10 174.05 1i80 s LEU 117 N 1.54 3.79 0.29 3.92 1.43 -0.00 -1.54 118.68 128.09 1i80 s LEU 117 Ca 0.03 -0.08 0.10 0.00 -1.03 0.00 0.00 54.13 53.15 1i80 s LEU 117 Cb -0.22 -2.03 -0.05 0.00 0.03 0.00 0.00 46.19 43.92 1i80 s LEU 117 CO 0.05 -0.03 -0.04 0.42 0.23 0.00 0.00 176.35 176.99 1i80 s THR 118 N 1.60 3.06 0.12 5.49 -4.23 -0.93 -0.99 115.64 119.76 1i80 s THR 118 Ca 0.07 -2.02 -0.26 0.00 -1.18 0.00 0.00 61.69 58.30 1i80 s THR 118 Cb -0.15 -2.72 0.07 0.00 1.34 0.00 0.00 72.50 71.04 1i80 s THR 118 CO 0.07 -0.34 0.89 0.54 -0.54 0.00 0.00 174.62 175.25 1i80 s ASN 119 N -3.65 -0.27 0.07 3.99 6.03 -0.72 -3.10 114.94 117.28 1i80 s ASN 119 Ca 0.32 -0.28 -0.09 0.00 -1.03 0.00 0.00 52.86 51.79 1i80 s ASN 119 Cb -0.05 0.49 -0.06 0.00 -3.03 0.00 0.00 41.25 38.61 1i80 s ASN 119 CO 0.19 -0.87 0.37 0.00 -2.03 0.00 0.00 177.10 174.76 1i80 s ALA 120 N -3.33 3.76 0.03 3.54 0.00 -1.24 -0.74 121.76 123.78 1i80 s ALA 120 Ca 0.09 -0.44 -0.21 0.00 0.00 0.00 0.00 51.96 51.40 1i80 s ALA 120 Cb -0.02 -2.21 0.05 0.00 0.00 0.00 0.00 23.12 20.94 1i80 s ALA 120 CO -0.02 0.59 0.48 0.00 0.00 0.00 0.00 175.76 176.82 1i80 s ALA 121 N -1.40 -1.22 0.11 0.00 0.00 -0.66 -4.67 121.76 113.93 1i80 s ALA 121 Ca 0.32 0.57 -0.18 0.00 0.00 0.00 0.00 51.96 52.67 1i80 s ALA 121 Cb -0.14 0.29 -0.07 0.00 0.00 0.00 0.00 23.12 23.20 1i80 s ALA 121 CO 0.18 -0.45 0.58 0.20 0.00 0.00 0.00 175.76 176.28 1i80 s GLY 122 N -1.81 2.61 -0.04 0.00 0.00 -0.45 -1.80 107.32 105.83 1i80 s GLY 122 Ca -0.07 0.01 -0.16 0.00 0.00 0.00 0.00 44.72 44.50 1i80 s GLY 122 CO 0.00 0.38 0.42 -0.32 0.00 0.00 0.00 173.10 173.58 1i80 s GLY 123 N -1.36 2.44 -0.09 0.20 0.00 -0.11 -1.39 107.32 107.01 1i80 s GLY 123 Ca 0.33 -0.22 0.09 0.00 0.00 0.00 0.00 44.72 44.92 1i80 s GLY 123 CO 0.19 0.35 0.04 1.04 0.00 0.00 0.00 173.10 174.72 1i80 n LEU 124 N 2.46 0.00 -4.73 0.66 4.32 0.19 -0.81 117.00 119.09 1i80 n LEU 124 Ca -0.12 0.00 -0.41 0.00 -0.02 0.00 0.00 56.01 55.46 1i80 n LEU 124 Cb 0.52 0.23 -0.04 0.00 -1.62 0.00 0.00 43.42 42.50 1i80 n LEU 124 CO 0.39 0.23 0.71 -0.60 -1.22 0.00 0.00 177.39 176.90 1i80 s ARG 125 N -2.26 4.67 0.41 3.23 3.52 -1.16 -4.95 118.95 122.40 1i80 s ARG 125 Ca -0.05 1.54 0.21 0.00 -0.13 0.00 0.00 55.73 57.31 1i80 s ARG 125 Cb 0.03 -3.34 1.19 0.00 -1.56 0.00 0.00 34.95 31.27 1i80 s ARG 125 CO 0.40 0.17 1.72 0.00 -0.81 0.00 0.00 175.30 176.78 1i80 h ALA 126 N 5.42 2.36 0.00 6.12 0.00 -1.95 -1.90 119.26 129.31 1i80 h ALA 126 Ca -0.43 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1i80 h ALA 126 Cb 1.21 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1i80 h ALA 126 CO 0.72 -0.84 0.00 0.38 0.00 0.00 0.00 179.25 179.51 1i80 h ASP 127 N 0.30 0.00 -3.63 0.00 -0.00 -2.02 -3.45 116.42 107.62 1i80 h ASP 127 Ca 0.67 0.00 -0.51 0.00 -0.00 0.00 0.00 57.03 57.19 1i80 h ASP 127 Cb 1.82 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 41.15 1i80 h ASP 127 CO -0.35 0.00 0.45 -0.76 -0.00 0.00 0.00 179.24 178.58 1i80 s LEU 128 N -5.53 4.52 0.19 0.15 1.43 -0.72 -5.06 118.68 113.67 1i80 s LEU 128 Ca 0.06 2.09 0.11 0.00 -1.03 0.00 0.00 54.13 55.36 1i80 s LEU 128 Cb 0.08 -3.61 -0.04 0.00 0.03 0.00 0.00 46.19 42.65 1i80 s LEU 128 CO 0.59 -0.15 -0.22 -1.10 0.23 0.00 0.00 176.35 175.70 1i80 s GLN 129 N -0.65 1.47 0.30 1.70 -0.21 -1.26 -4.96 119.66 116.05 1i80 s GLN 129 Ca 0.47 -1.51 -0.30 0.00 0.02 0.00 0.00 55.36 54.04 1i80 s GLN 129 Cb -0.29 -1.71 -0.11 0.00 1.00 0.00 0.00 33.01 31.90 1i80 s GLN 129 CO 0.35 0.36 1.60 0.28 -2.12 0.00 0.00 175.29 175.77 1i80 n VAL 130 N 0.20 1.07 -0.52 1.09 0.31 -1.26 -1.81 118.33 117.42 1i80 n VAL 130 Ca -0.12 -0.27 0.00 0.00 -0.01 0.00 0.00 64.34 63.94 1i80 n VAL 130 Cb 0.57 -1.99 0.00 0.00 -0.91 0.00 0.00 33.84 31.51 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 2.08 0.76 3.70 2.92 0.00 0.17 -5.01 105.19 109.79 1i80 n GLY 131 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.48 4.22 0.21 1.61 0.74 -0.75 -4.88 119.66 120.34 1i80 s GLN 132 Ca 0.00 0.14 -0.28 0.00 0.05 0.00 0.00 55.36 55.27 1i80 s GLN 132 Cb 0.00 -3.48 -0.09 0.00 1.10 0.00 0.00 33.01 30.55 1i80 s GLN 132 CO 0.00 0.11 0.88 -1.25 -0.55 0.00 0.00 175.29 174.48 1i80 s PRO 133 N 0.85 4.74 -0.06 1.67 0.04 -1.26 -2.12 135.00 138.85 1i80 s PRO 133 Ca 0.18 1.36 0.01 0.00 0.04 0.00 0.00 61.00 62.58 1i80 s PRO 133 Cb -0.14 -3.26 0.02 0.00 0.04 0.00 0.00 34.50 31.16 1i80 s PRO 133 CO 0.06 0.54 -0.08 0.08 0.04 0.00 0.00 177.00 177.63 1i80 s VAL 134 N -1.18 0.87 0.20 -0.36 1.01 0.16 -4.47 120.40 116.63 1i80 s VAL 134 Ca 0.39 -0.30 -0.30 0.00 0.00 0.00 0.00 61.98 61.78 1i80 s VAL 134 Cb -0.25 -0.84 -0.08 0.00 0.00 0.00 0.00 36.38 35.21 1i80 s VAL 134 CO 0.30 0.30 1.13 -0.76 0.00 0.00 0.00 175.10 176.07 1i80 s LEU 135 N 0.94 4.49 -0.30 3.92 1.43 -0.05 -0.11 118.68 128.99 1i80 s LEU 135 Ca -0.10 2.17 -0.24 0.00 -1.03 0.00 0.00 54.13 54.93 1i80 s LEU 135 Cb -0.15 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.47 1i80 s LEU 135 CO 0.01 -0.25 0.81 -0.63 0.23 0.00 0.00 176.35 176.51 1i80 s ILE 136 N -0.36 4.78 -0.17 -0.59 1.01 0.44 -1.18 121.20 125.13 1i80 s ILE 136 Ca 0.49 1.24 0.18 0.00 0.00 0.00 0.00 60.65 62.57 1i80 s ILE 136 Cb -0.31 -4.16 -0.05 0.00 0.01 0.00 0.00 42.46 37.95 1i80 s ILE 136 CO 0.37 -0.25 1.00 0.77 0.00 0.00 0.00 174.94 176.82 1i80 h SER 137 N 8.09 0.00 -5.72 3.58 4.64 -1.58 -3.41 113.55 119.15 1i80 h SER 137 Ca -0.24 0.00 0.30 0.00 -0.47 0.00 0.00 61.79 61.38 1i80 h SER 137 Cb 1.09 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.08 1i80 h SER 137 CO 0.89 0.39 0.79 -0.62 -0.87 0.00 0.00 176.83 177.41 1i80 s ASP 138 N -5.78 -0.06 0.09 4.97 -1.08 -1.26 -4.63 116.67 108.93 1i80 s ASP 138 Ca -0.01 -0.20 0.00 0.00 -0.52 0.00 0.00 52.55 51.82 1i80 s ASP 138 Cb 0.09 0.21 -0.04 0.00 -1.46 0.00 0.00 42.92 41.72 1i80 s ASP 138 CO 0.79 -0.40 -0.02 -1.38 0.52 0.00 0.00 175.17 174.68 1i80 s HIS 139 N -2.45 0.76 -0.28 -5.34 -3.43 -1.26 -1.12 115.29 102.18 1i80 s HIS 139 Ca 0.16 -1.06 0.02 0.00 -0.80 0.00 0.00 55.06 53.39 1i80 s HIS 139 Cb 0.03 -0.48 0.06 0.00 -1.43 0.00 0.00 32.58 30.77 1i80 s HIS 139 CO -0.02 -0.33 -0.07 -0.51 -2.00 0.00 0.00 174.74 171.81 1i80 s LEU 140 N -3.01 3.71 -0.70 5.38 1.43 0.30 -4.91 118.68 120.89 1i80 s LEU 140 Ca 0.14 -1.49 -0.26 0.00 -1.03 0.00 0.00 54.13 51.49 1i80 s LEU 140 Cb 0.07 -1.59 0.04 0.00 0.03 0.00 0.00 46.19 44.74 1i80 s LEU 140 CO -0.05 -0.23 1.19 0.21 0.23 0.00 0.00 176.35 177.70 1i80 s ASN 141 N 1.11 6.20 -0.38 2.29 3.84 -1.26 -1.06 114.94 125.67 1i80 s ASN 141 Ca -0.06 -0.51 0.06 0.00 0.21 0.00 0.00 52.86 52.56 1i80 s ASN 141 Cb -0.20 -2.52 0.56 0.00 -0.55 0.00 0.00 41.25 38.53 1i80 s ASN 141 CO -0.05 -1.69 1.66 0.18 -2.79 0.00 0.00 177.10 174.41 1i80 n LEU 142 N 8.85 5.42 -0.18 3.21 4.77 -0.41 -4.47 117.00 134.18 1i80 n LEU 142 Ca 0.02 -3.84 0.11 0.00 -0.03 0.00 0.00 56.01 52.27 1i80 n LEU 142 Cb 0.48 -0.72 0.02 0.00 -2.33 0.00 0.00 43.42 40.87 1i80 n LEU 142 CO 0.69 1.27 0.20 0.35 -1.33 0.00 0.00 177.39 178.57 1i80 n THR 143 N -1.09 0.00 -1.91 -5.08 -2.24 -1.25 -4.60 114.28 98.11 1i80 n THR 143 Ca 0.46 -0.10 -0.20 0.00 -2.27 0.00 0.00 64.05 61.95 1i80 n THR 143 Cb 1.22 0.92 -0.05 0.00 -2.10 0.00 0.00 70.33 70.32 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 -0.94 -0.42 -2.38 6.98 0.00 -1.26 -4.94 120.51 117.55 1i80 n ALA 144 Ca 0.07 0.25 -0.21 0.00 0.00 0.00 0.00 53.44 53.55 1i80 n ALA 144 Cb 0.38 -2.03 -0.09 0.00 0.00 0.00 0.00 19.45 17.71 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 -4.22 1.75 -0.12 0.00 0.52 -1.26 -5.17 118.95 110.44 1i80 s ARG 145 Ca 0.00 -2.03 -0.25 0.00 -0.52 0.00 0.00 55.73 52.93 1i80 s ARG 145 Cb 0.00 -0.14 0.06 0.00 0.52 0.00 0.00 34.95 35.39 1i80 s ARG 145 CO 0.00 -0.52 0.61 0.45 0.02 0.00 0.00 175.30 175.86 1i80 s SER 146 N -3.45 -0.60 0.00 0.23 0.15 -1.26 -5.03 113.70 103.75 1i80 s SER 146 Ca 0.33 0.87 0.30 0.00 0.70 0.00 0.00 55.95 58.15 1i80 s SER 146 Cb 0.03 0.83 1.46 0.00 -1.71 0.00 0.00 66.02 66.63 1i80 s SER 146 CO 0.19 -0.42 1.98 -0.81 1.20 0.00 0.00 173.24 175.39 1i80 n PRO 147 N 1.74 1.06 -3.68 5.44 -0.04 -1.26 -4.80 135.00 133.45 1i80 n PRO 147 Ca -0.17 -0.32 -0.37 0.00 -0.04 0.00 0.00 63.50 62.60 1i80 n PRO 147 Cb 0.56 -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 -2.17 4.43 -0.06 1.53 1.43 -1.26 -4.86 118.68 117.72 1i80 s LEU 148 Ca 0.39 0.73 0.03 0.00 -1.03 0.00 0.00 54.13 54.24 1i80 s LEU 148 Cb 0.21 -2.40 0.01 0.00 0.03 0.00 0.00 46.19 44.04 1i80 s LEU 148 CO 0.40 0.35 -0.15 -0.69 0.23 0.00 0.00 176.35 176.49 1i80 s VAL 149 N -1.09 1.32 0.00 -1.59 1.01 -1.26 -5.01 120.40 113.79 1i80 s VAL 149 Ca 0.21 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.58 1i80 s VAL 149 Cb -0.14 -1.17 0.00 0.00 0.00 0.00 0.00 36.38 35.06 1i80 s VAL 149 CO 0.10 0.39 0.00 0.61 0.00 0.00 0.00 175.10 176.20 1i80 n GLY 150 N 3.58 -2.51 2.69 4.51 0.00 -1.26 -4.59 105.19 107.61 1i80 n GLY 150 Ca -0.21 -1.81 -0.21 0.00 0.00 0.00 0.00 46.02 43.79 1i80 n GLY 150 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i80 n GLY 151 N -0.18 2.91 3.21 -0.02 0.00 -1.26 -4.73 105.19 105.11 1i80 n GLY 151 Ca 0.00 -0.77 -0.41 0.00 0.00 0.00 0.00 46.02 44.84 1i80 n GLY 151 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1i80 s GLU 152 N 3.70 3.55 -1.19 1.61 2.12 -1.26 -4.99 118.70 122.24 1i80 s GLU 152 Ca 0.36 -3.06 -0.18 0.00 0.36 0.00 0.00 54.97 52.44 1i80 s GLU 152 Cb 0.09 -4.19 0.09 0.00 0.26 0.00 0.00 34.13 30.38 1i80 s GLU 152 CO -0.02 -1.25 1.56 -0.06 -0.54 0.00 0.00 175.26 174.95 1i80 s PHE 153 N -0.97 2.90 -0.05 5.30 0.08 -1.26 -4.97 117.98 119.01 1i80 s PHE 153 Ca 0.26 -1.54 -0.22 0.00 0.12 0.00 0.00 56.93 55.55 1i80 s PHE 153 Cb -0.10 -4.61 -0.04 0.00 -0.57 0.00 0.00 43.02 37.69 1i80 s PHE 153 CO -0.09 -1.73 0.65 0.08 -0.10 0.00 0.00 175.22 174.03 1i80 s VAL 154 N 3.71 5.01 0.15 -0.44 1.01 -1.26 -5.05 120.40 123.53 1i80 s VAL 154 Ca 0.48 1.34 -0.30 0.00 0.00 0.00 0.00 61.98 63.50 1i80 s VAL 154 Cb 0.01 -3.99 -0.07 0.00 0.00 0.00 0.00 36.38 32.34 1i80 s VAL 154 CO 0.01 0.31 1.01 -0.62 0.00 0.00 0.00 175.10 175.81 1i80 s ASP 155 N 0.47 7.43 -0.27 3.32 2.15 -1.26 -4.96 116.67 123.54 1i80 s ASP 155 Ca 0.34 1.92 0.09 0.00 0.43 0.00 0.00 52.55 55.33 1i80 s ASP 155 Cb -0.18 -2.60 0.49 0.00 -0.30 0.00 0.00 42.92 40.34 1i80 s ASP 155 CO 0.17 -0.10 1.42 0.18 -0.17 0.00 0.00 175.17 176.66 1i80 n LEU 156 N 2.52 3.84 -4.75 -1.34 4.77 -1.26 -4.91 117.00 115.87 1i80 n LEU 156 Ca 0.02 -3.80 -0.40 0.00 -0.03 0.00 0.00 56.01 51.79 1i80 n LEU 156 Cb 0.48 -0.61 -0.05 0.00 -2.33 0.00 0.00 43.42 40.90 1i80 n LEU 156 CO 0.52 1.29 0.61 -0.89 -1.33 0.00 0.00 177.39 177.59 1i80 s THR 157 N -3.25 4.34 -1.47 -5.08 2.01 -1.26 -3.34 115.64 107.60 1i80 s THR 157 Ca 0.43 1.98 -0.11 0.00 0.31 0.00 0.00 61.69 64.30 1i80 s THR 157 Cb 0.40 -4.28 0.05 0.00 0.01 0.00 0.00 72.50 68.69 1i80 s THR 157 CO -0.02 0.42 0.89 0.47 -0.69 0.00 0.00 174.62 175.69 1i80 n ASP 158 N 2.12 -5.27 -0.33 3.53 8.00 -1.26 -4.85 116.55 118.50 1i80 n ASP 158 Ca -0.01 -0.58 0.04 0.00 0.71 0.00 0.00 54.79 54.96 1i80 n ASP 158 Cb 0.48 -4.21 0.23 0.00 -0.02 0.00 0.00 41.12 37.60 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 0.99 1.50 -2.23 2.24 0.00 -1.89 -3.27 119.26 116.60 1i80 h ALA 159 Ca -0.55 -0.02 -0.76 0.00 0.00 0.00 0.00 54.91 53.59 1i80 h ALA 159 Cb 1.36 -0.27 -0.25 0.00 0.00 0.00 0.00 17.79 18.64 1i80 h ALA 159 CO 0.61 0.34 -0.18 0.71 0.00 0.00 0.00 179.25 180.73 1i80 s TYR 160 N -5.94 3.33 -0.47 0.00 1.51 -1.26 -4.09 117.35 110.43 1i80 s TYR 160 Ca -0.12 -1.43 -0.43 0.00 -1.01 0.00 0.00 57.07 54.08 1i80 s TYR 160 Cb 0.20 -3.78 -0.18 0.00 -0.11 0.00 0.00 41.96 38.08 1i80 s TYR 160 CO 0.80 -1.01 1.68 0.45 -1.11 0.00 0.00 175.55 176.36 1i80 n SER 161 N 5.04 0.99 0.23 2.29 2.88 -0.70 -4.82 113.62 119.52 1i80 n SER 161 Ca -0.10 0.95 0.07 0.00 -1.33 0.00 0.00 58.87 58.46 1i80 n SER 161 Cb 0.41 -0.83 0.53 0.00 -0.75 0.00 0.00 64.21 63.57 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 5.99 0.00 0.31 -1.46 0.11 -1.91 -1.44 132.00 133.60 1i80 h PRO 162 Ca -0.30 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.79 1i80 h PRO 162 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 1i80 h PRO 162 CO 0.96 0.21 -0.15 -0.09 -0.21 0.00 0.00 178.00 178.71 1i80 h ARG 163 N 0.00 -0.40 -0.14 1.05 1.12 -1.98 -0.54 114.38 113.48 1i80 h ARG 163 Ca -0.00 0.03 -0.09 0.00 -1.11 0.00 0.00 59.98 58.81 1i80 h ARG 163 Cb 0.40 0.09 -0.01 0.00 -0.01 0.00 0.00 29.97 30.43 1i80 h ARG 163 CO 0.03 -0.27 -0.31 -0.07 -3.11 0.00 0.00 179.97 176.24 1i80 h LEU 164 N -0.42 0.28 -0.99 3.80 3.38 -1.80 -2.14 115.31 117.41 1i80 h LEU 164 Ca -0.04 -0.09 -0.09 0.00 0.09 0.00 0.00 57.88 57.74 1i80 h LEU 164 Cb 0.32 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1i80 h LEU 164 CO 0.07 0.58 -0.27 0.03 0.09 0.00 0.00 178.44 178.94 1i80 h ARG 165 N 0.24 0.40 -0.49 1.13 3.08 -1.02 -1.24 114.38 116.49 1i80 h ARG 165 Ca 0.03 -0.15 -0.06 0.00 0.07 0.00 0.00 59.98 59.87 1i80 h ARG 165 Cb 0.67 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.68 1i80 h ARG 165 CO 0.05 0.64 0.07 1.49 -1.07 0.00 0.00 179.97 181.15 1i80 h GLU 166 N 0.36 0.81 -0.70 0.04 4.22 -0.49 -1.79 114.58 117.03 1i80 h GLU 166 Ca 0.05 -0.22 -0.06 0.00 0.08 0.00 0.00 59.36 59.21 1i80 h GLU 166 Cb 0.67 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 1i80 h GLU 166 CO 0.05 0.82 0.21 -0.07 -2.18 0.00 0.00 179.01 177.84 1i80 h LEU 167 N 0.68 1.03 -0.82 1.64 3.38 -1.04 -2.31 115.31 117.87 1i80 h LEU 167 Ca 0.15 -0.21 0.02 0.00 0.09 0.00 0.00 57.88 57.92 1i80 h LEU 167 Cb 0.41 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 1i80 h LEU 167 CO 0.01 0.97 0.53 0.00 0.09 0.00 0.00 178.44 180.04 1i80 h ALA 168 N 1.10 1.05 0.00 1.53 0.00 -0.97 -1.42 119.26 120.55 1i80 h ALA 168 Ca 0.22 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 1i80 h ALA 168 Cb 0.32 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1i80 h ALA 168 CO -0.01 0.39 -0.14 0.00 0.00 0.00 0.00 179.25 179.50 1i80 h ARG 169 N 1.06 0.00 0.00 0.00 3.08 -0.90 -1.10 114.38 116.52 1i80 h ARG 169 Ca 0.31 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.30 1i80 h ARG 169 Cb -0.06 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 1i80 h ARG 169 CO -0.09 0.14 -0.31 1.96 -1.07 0.00 0.00 179.97 180.60 1i80 h GLN 170 N 0.00 0.00 0.08 0.04 4.20 -0.72 0.15 115.11 118.85 1i80 h GLN 170 Ca -0.00 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.58 1i80 h GLN 170 Cb 0.45 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.24 1i80 h GLN 170 CO 0.02 0.31 -0.54 1.03 -0.67 0.00 0.00 178.83 178.98 1i80 h SER 171 N 0.00 0.34 -2.59 1.46 0.87 -1.05 -3.42 113.55 109.16 1i80 h SER 171 Ca -0.00 -0.92 -0.55 0.00 -1.23 0.00 0.00 61.79 59.09 1i80 h SER 171 Cb 0.70 -0.11 -0.39 0.00 -0.44 0.00 0.00 62.40 62.17 1i80 h SER 171 CO 0.04 1.24 -0.82 -0.62 -0.53 0.00 0.00 176.83 176.14 1i80 s ASP 172 N -6.70 2.97 0.21 6.23 -1.08 -0.69 -5.00 116.67 112.60 1i80 s ASP 172 Ca -0.15 -1.86 0.11 0.00 -0.52 0.00 0.00 52.55 50.13 1i80 s ASP 172 Cb 0.00 -0.30 0.60 0.00 -1.46 0.00 0.00 42.92 41.77 1i80 s ASP 172 CO 0.79 -0.34 1.27 -2.65 0.52 0.00 0.00 175.17 174.75 1i80 n PRO 173 N 4.42 0.07 -0.17 4.34 -0.02 0.50 -1.42 135.00 142.73 1i80 n PRO 173 Ca 0.07 0.53 0.12 0.00 -2.02 0.00 0.00 63.50 62.19 1i80 n PRO 173 Cb 0.39 -1.87 0.25 0.00 -0.02 0.00 0.00 33.50 32.25 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 -1.88 2.34 -2.00 -0.52 6.02 -1.26 -4.95 117.38 115.12 1i80 n GLN 174 Ca -0.01 -2.02 -0.42 0.00 -0.01 0.00 0.00 57.00 54.54 1i80 n GLN 174 Cb 0.15 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 29.89 1i80 n GLN 174 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1i80 s LEU 175 N -1.50 4.37 0.49 1.08 1.43 -0.51 -5.00 118.68 119.03 1i80 s LEU 175 Ca 0.37 2.50 -0.03 0.00 -1.03 0.00 0.00 54.13 55.94 1i80 s LEU 175 Cb 0.21 -3.58 -0.02 0.00 0.03 0.00 0.00 46.19 42.83 1i80 s LEU 175 CO 0.30 -0.80 0.76 0.00 0.23 0.00 0.00 176.35 176.85 1i80 s ALA 176 N 1.51 3.49 0.30 4.21 0.00 -1.26 -4.93 121.76 125.08 1i80 s ALA 176 Ca 0.69 -0.73 0.08 0.00 0.00 0.00 0.00 51.96 52.00 1i80 s ALA 176 Cb -0.41 -2.43 -0.06 0.00 0.00 0.00 0.00 23.12 20.22 1i80 s ALA 176 CO 0.31 -0.44 -0.08 -1.21 0.00 0.00 0.00 175.76 174.34 1i80 s GLU 177 N -4.72 1.64 -0.15 0.00 2.02 -1.26 -0.87 118.70 115.36 1i80 s GLU 177 Ca 0.48 -1.83 -0.33 0.00 0.02 0.00 0.00 54.97 53.32 1i80 s GLU 177 Cb -0.10 -1.37 0.13 0.00 0.10 0.00 0.00 34.13 32.89 1i80 s GLU 177 CO 0.42 0.09 1.12 0.20 0.02 0.00 0.00 175.26 177.12 1i80 s GLY 178 N -3.50 -0.32 -0.09 -1.39 0.00 -0.32 -4.87 107.32 96.83 1i80 s GLY 178 Ca 0.30 1.53 -0.25 0.00 0.00 0.00 0.00 44.72 46.30 1i80 s GLY 178 CO 0.13 0.54 0.79 0.14 0.00 0.00 0.00 173.10 174.70 1i80 s VAL 179 N -2.46 4.96 -0.17 1.40 1.01 -1.26 -1.43 120.40 122.45 1i80 s VAL 179 Ca 0.08 1.61 -0.13 0.00 0.00 0.00 0.00 61.98 63.53 1i80 s VAL 179 Cb -0.01 -4.12 -0.05 0.00 0.00 0.00 0.00 36.38 32.21 1i80 s VAL 179 CO -0.06 0.16 0.28 -0.47 0.00 0.00 0.00 175.10 175.01 1i80 s TYR 180 N 1.28 3.45 -0.33 5.22 5.04 -0.27 -0.71 117.35 131.03 1i80 s TYR 180 Ca 0.40 0.56 -0.12 0.00 -2.44 0.00 0.00 57.07 55.47 1i80 s TYR 180 Cb -0.18 -2.33 -0.02 0.00 0.35 0.00 0.00 41.96 39.79 1i80 s TYR 180 CO 0.18 0.23 0.21 0.00 -1.34 0.00 0.00 175.55 174.83 1i80 s ALA 181 N 0.51 3.43 -0.32 3.97 0.00 0.06 -0.54 121.76 128.86 1i80 s ALA 181 Ca 0.15 -1.37 -0.16 0.00 0.00 0.00 0.00 51.96 50.58 1i80 s ALA 181 Cb -0.13 -2.56 -0.02 0.00 0.00 0.00 0.00 23.12 20.42 1i80 s ALA 181 CO 0.03 -0.93 0.42 0.20 0.00 0.00 0.00 175.76 175.48 1i80 s GLY 182 N 1.69 1.87 0.32 0.00 0.00 -0.22 -0.87 107.32 110.10 1i80 s GLY 182 Ca 0.06 -1.04 0.08 0.00 0.00 0.00 0.00 44.72 43.82 1i80 s GLY 182 CO 0.09 1.08 0.12 1.08 0.00 0.00 0.00 173.10 175.47 1i80 s LEU 183 N 2.16 3.29 0.08 0.66 1.02 -0.16 -1.29 118.68 124.43 1i80 s LEU 183 Ca 0.15 -0.70 -0.25 0.00 0.02 0.00 0.00 54.13 53.35 1i80 s LEU 183 Cb -0.16 -1.79 -0.16 0.00 0.02 0.00 0.00 46.19 44.10 1i80 s LEU 183 CO 0.12 -0.22 1.67 -0.65 0.02 0.00 0.00 176.35 177.29 1i80 h PRO 184 N 1.61 -0.16 0.00 1.29 0.11 -1.85 -3.39 132.00 129.61 1i80 h PRO 184 Ca -0.44 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1i80 h PRO 184 Cb 1.25 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1i80 h PRO 184 CO 0.62 -0.06 0.00 0.41 -0.21 0.00 0.00 178.00 178.76 1i80 n GLY 185 N -1.04 -1.84 0.23 -0.55 0.00 -1.26 -4.13 105.19 96.61 1i80 n GLY 185 Ca -0.08 -1.37 0.14 0.00 0.00 0.00 0.00 46.02 44.71 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 -0.05 1.01 -2.21 1.61 -0.04 -1.26 -4.87 135.00 129.20 1i80 n PRO 186 Ca 0.00 -0.46 -0.34 0.00 -0.04 0.00 0.00 63.50 62.66 1i80 n PRO 186 Cb 0.00 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 31.97 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 -2.31 2.85 0.75 0.54 -3.43 -1.26 -5.04 115.29 107.39 1i80 s HIS 187 Ca 0.32 1.55 -0.10 0.00 -0.80 0.00 0.00 55.06 56.03 1i80 s HIS 187 Cb 0.20 -3.13 0.06 0.00 -1.43 0.00 0.00 32.58 28.29 1i80 s HIS 187 CO 0.44 -1.24 1.09 0.71 -2.00 0.00 0.00 174.74 173.74 1i80 s TYR 188 N -2.11 3.00 0.61 0.38 1.51 -1.26 -5.05 117.35 114.43 1i80 s TYR 188 Ca 0.68 0.66 -0.10 0.00 -1.01 0.00 0.00 57.07 57.30 1i80 s TYR 188 Cb -0.19 -3.29 -0.02 0.00 -0.11 0.00 0.00 41.96 38.35 1i80 s TYR 188 CO 0.30 -1.52 0.99 -1.21 -1.11 0.00 0.00 175.55 173.00 1i80 s GLU 189 N -5.39 3.37 0.42 -0.62 8.01 -1.26 -5.08 118.70 118.14 1i80 s GLU 189 Ca 0.60 0.53 -0.05 0.00 0.01 0.00 0.00 54.97 56.06 1i80 s GLU 189 Cb -0.11 -2.14 -0.04 0.00 -4.31 0.00 0.00 34.13 27.53 1i80 s GLU 189 CO 0.47 -0.62 0.70 0.95 0.01 0.00 0.00 175.26 176.78 1i80 s THR 190 N -3.13 4.95 0.35 3.63 -4.23 -1.26 -4.73 115.64 111.22 1i80 s THR 190 Ca 0.54 0.10 0.04 0.00 -1.18 0.00 0.00 61.69 61.19 1i80 s THR 190 Cb -0.11 -3.83 0.29 0.00 1.34 0.00 0.00 72.50 70.19 1i80 s THR 190 CO 0.51 -0.67 1.95 -0.65 -0.54 0.00 0.00 174.62 175.22 1i80 h PRO 191 N 0.68 0.81 -0.72 3.99 0.11 -1.97 -1.15 132.00 133.75 1i80 h PRO 191 Ca -0.48 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 65.52 1i80 h PRO 191 Cb 1.20 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 32.10 1i80 h PRO 191 CO 0.62 0.54 0.21 0.00 -0.21 0.00 0.00 178.00 179.16 1i80 h ALA 192 N 1.58 0.94 -0.39 -0.75 0.00 -1.94 -1.11 119.26 117.60 1i80 h ALA 192 Ca 0.32 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 1i80 h ALA 192 Cb 0.20 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1i80 h ALA 192 CO -0.11 0.64 -0.02 0.93 0.00 0.00 0.00 179.25 180.69 1i80 h GLU 193 N 1.07 0.63 -0.52 0.00 5.08 -1.63 -0.85 114.58 118.36 1i80 h GLU 193 Ca 0.23 -0.16 -0.11 0.00 -1.00 0.00 0.00 59.36 58.32 1i80 h GLU 193 Cb 0.32 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 1i80 h GLU 193 CO -0.00 0.67 -0.11 0.82 -1.00 0.00 0.00 179.01 179.39 1i80 h ILE 194 N 0.60 1.27 -0.45 3.13 1.08 -0.80 -0.92 117.51 121.41 1i80 h ILE 194 Ca 0.12 -1.25 -0.08 0.00 -0.39 0.00 0.00 64.86 63.26 1i80 h ILE 194 Cb 0.41 0.98 -0.02 0.00 -3.07 0.00 0.00 36.82 35.12 1i80 h ILE 194 CO 0.02 0.44 -0.05 0.03 -0.69 0.00 0.00 178.15 177.90 1i80 h ARG 195 N 0.87 0.76 -0.34 2.37 3.08 -0.71 -1.87 114.38 118.54 1i80 h ARG 195 Ca 0.14 -0.22 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 1i80 h ARG 195 Cb 0.66 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.61 1i80 h ARG 195 CO 0.05 0.81 0.19 1.98 -1.07 0.00 0.00 179.97 181.93 1i80 h MET 196 N 0.71 0.47 -0.39 0.04 4.05 -0.74 -2.23 114.93 116.84 1i80 h MET 196 Ca 0.13 -0.05 -0.01 0.00 -0.28 0.00 0.00 59.70 59.49 1i80 h MET 196 Cb 0.50 -0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 31.19 1i80 h MET 196 CO 0.03 0.38 0.18 -0.07 0.23 0.00 0.00 176.91 177.65 1i80 h LEU 197 N 0.43 0.48 -0.22 3.39 3.38 -0.78 -1.40 115.31 120.60 1i80 h LEU 197 Ca 0.12 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1i80 h LEU 197 Cb 0.04 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1i80 h LEU 197 CO -0.02 0.42 0.04 1.56 0.09 0.00 0.00 178.44 180.53 1i80 h GLN 198 N 0.54 0.35 -0.70 1.13 4.20 -0.98 -0.96 115.11 118.69 1i80 h GLN 198 Ca 0.14 -0.09 0.07 0.00 0.06 0.00 0.00 58.65 58.82 1i80 h GLN 198 Cb 0.07 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.77 1i80 h GLN 198 CO -0.02 0.49 0.46 1.15 -0.67 0.00 0.00 178.83 180.24 1i80 h THR 199 N 0.16 1.00 0.00 -0.54 2.02 -0.78 -0.60 112.91 114.17 1i80 h THR 199 Ca 0.07 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 67.01 1i80 h THR 199 Cb 0.30 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 66.96 1i80 h THR 199 CO 0.00 0.13 0.00 0.18 0.37 0.00 0.00 175.52 176.20 1i80 n LEU 200 N -4.48 0.00 0.00 2.58 4.77 -0.60 -4.91 117.00 114.36 1i80 n LEU 200 Ca 0.10 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.32 1i80 n LEU 200 Cb 0.24 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 1i80 n LEU 200 CO 0.34 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 1i80 n GLY 201 N 1.11 0.93 3.83 -0.72 0.00 -0.23 -5.07 105.19 105.03 1i80 n GLY 201 Ca 0.15 -0.07 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 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 3.38 -0.03 4.61 0.00 -0.41 -4.66 121.76 122.65 1i80 s ALA 202 Ca 0.00 0.11 0.05 0.00 0.00 0.00 0.00 51.96 52.12 1i80 s ALA 202 Cb 0.00 -2.80 -0.07 0.00 0.00 0.00 0.00 23.12 20.25 1i80 s ALA 202 CO 0.00 0.33 0.06 -0.25 0.00 0.00 0.00 175.76 175.90 1i80 n ASP 203 N 0.30 3.81 -4.13 0.00 8.00 0.11 -4.51 116.55 120.12 1i80 n ASP 203 Ca -0.00 0.00 -0.17 0.00 0.71 0.00 0.00 54.79 55.33 1i80 n ASP 203 Cb 0.52 0.90 -0.12 0.00 -0.02 0.00 0.00 41.12 42.40 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 -3.90 2.26 -0.06 0.64 1.43 -0.80 0.53 118.68 118.78 1i80 s LEU 204 Ca -0.02 -0.58 0.02 0.00 -1.03 0.00 0.00 54.13 52.52 1i80 s LEU 204 Cb 0.02 -0.42 0.02 0.00 0.03 0.00 0.00 46.19 45.84 1i80 s LEU 204 CO 0.21 -0.10 -0.10 0.54 0.23 0.00 0.00 176.35 177.13 1i80 s VAL 205 N -1.25 0.95 0.24 -1.59 0.11 -0.49 -0.76 120.40 117.61 1i80 s VAL 205 Ca -0.04 -0.37 0.03 0.00 -2.93 0.00 0.00 61.98 58.67 1i80 s VAL 205 Cb -0.10 -0.89 -0.01 0.00 -1.53 0.00 0.00 36.38 33.86 1i80 s VAL 205 CO 0.02 0.31 0.26 0.61 -3.33 0.00 0.00 175.10 172.97 1i80 n GLY 206 N 3.89 2.91 0.55 6.54 0.00 -0.05 -1.33 105.19 117.69 1i80 n GLY 206 Ca -0.24 -1.71 0.07 0.00 0.00 0.00 0.00 46.02 44.14 1i80 n GLY 206 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1i80 n MET 207 N -0.42 1.36 0.00 1.61 2.81 -1.26 -0.99 117.12 120.22 1i80 n MET 207 Ca 0.03 -2.98 0.00 0.00 -1.81 0.00 0.00 57.70 52.94 1i80 n MET 207 Cb 0.41 -1.44 0.00 0.00 -0.71 0.00 0.00 33.22 31.48 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 -1.04 0.00 0.00 7.83 3.41 -1.26 -4.75 113.62 117.81 1i80 n SER 208 Ca 0.17 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.78 1i80 n SER 208 Cb 0.71 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.66 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 -0.25 6.66 -1.04 -1.26 -4.65 114.28 113.75 1i80 n THR 209 Ca 0.00 0.00 0.05 0.00 -2.04 0.00 0.00 64.05 62.06 1i80 n THR 209 Cb 0.00 0.00 0.17 0.00 -1.82 0.00 0.00 70.33 68.68 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 0.49 -0.33 12.58 -1.51 -1.96 0.85 116.25 126.37 1i80 h VAL 210 Ca 0.00 -0.08 -0.10 0.00 -1.23 0.00 0.00 66.70 65.28 1i80 h VAL 210 Cb 0.00 0.23 -0.01 0.00 -2.13 0.00 0.00 31.29 29.38 1i80 h VAL 210 CO 0.00 0.04 -0.23 0.45 -1.23 0.00 0.00 177.57 176.61 1i80 h HIS 211 N 0.24 0.71 -0.46 5.19 3.86 -1.97 -1.60 115.15 121.13 1i80 h HIS 211 Ca 0.41 -0.15 -0.05 0.00 -1.16 0.00 0.00 60.37 59.42 1i80 h HIS 211 Cb 0.70 -0.17 -0.02 0.00 1.06 0.00 0.00 27.41 28.98 1i80 h HIS 211 CO -0.28 0.81 0.10 0.93 0.86 0.00 0.00 177.93 180.34 1i80 h GLU 212 N 0.56 0.74 -0.31 2.45 3.07 -1.47 -1.26 114.58 118.36 1i80 h GLU 212 Ca 0.08 -0.18 -0.00 0.00 -0.50 0.00 0.00 59.36 58.76 1i80 h GLU 212 Cb 0.69 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 28.49 1i80 h GLU 212 CO 0.05 0.74 0.19 1.15 -1.40 0.00 0.00 179.01 179.74 1i80 h THR 213 N 0.62 1.10 -0.43 1.13 2.02 -0.65 -0.18 112.91 116.52 1i80 h THR 213 Ca 0.14 -0.23 -0.01 0.00 0.77 0.00 0.00 66.41 67.08 1i80 h THR 213 Cb 0.34 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 67.43 1i80 h THR 213 CO 0.00 0.10 0.23 0.40 0.37 0.00 0.00 175.52 176.63 1i80 h ILE 214 N 0.40 1.16 -0.63 3.11 2.04 -1.12 -1.01 117.51 121.46 1i80 h ILE 214 Ca 0.11 -0.42 -0.05 0.00 1.00 0.00 0.00 64.86 65.50 1i80 h ILE 214 Cb -0.00 0.65 -0.03 0.00 -0.74 0.00 0.00 36.82 36.70 1i80 h ILE 214 CO -0.02 0.17 0.19 0.00 0.00 0.00 0.00 178.15 178.48 1i80 h ALA 215 N 1.08 1.14 0.08 1.87 0.00 -1.11 0.27 119.26 122.60 1i80 h ALA 215 Ca 0.15 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1i80 h ALA 215 Cb 0.06 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1i80 h ALA 215 CO -0.02 0.59 -0.04 0.00 0.00 0.00 0.00 179.25 179.78 1i80 h ALA 216 N 1.27 -0.11 -0.79 0.00 0.00 -0.60 -1.24 119.26 117.79 1i80 h ALA 216 Ca 0.21 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1i80 h ALA 216 Cb 0.28 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 1i80 h ALA 216 CO -0.01 -0.51 0.38 0.00 0.00 0.00 0.00 179.25 179.11 1i80 h ARG 217 N -0.20 1.14 -0.10 0.00 2.47 -0.99 -0.75 114.38 115.94 1i80 h ARG 217 Ca -0.01 -0.16 -0.07 0.00 -1.26 0.00 0.00 59.98 58.48 1i80 h ARG 217 Cb 0.17 -0.21 -0.01 0.00 -1.65 0.00 0.00 29.97 28.27 1i80 h ARG 217 CO 0.02 0.87 -0.24 0.00 0.56 0.00 0.00 179.97 181.18 1i80 h ALA 218 N 1.29 1.41 -0.01 0.04 0.00 -0.74 -1.89 119.26 119.36 1i80 h ALA 218 Ca 0.27 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1i80 h ALA 218 Cb 0.11 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1i80 h ALA 218 CO -0.03 0.42 0.00 0.00 0.00 0.00 0.00 179.25 179.63 1i80 n ALA 219 N -2.48 2.63 -0.76 0.00 0.00 -0.49 -4.93 120.51 114.48 1i80 n ALA 219 Ca -0.01 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.10 1i80 n ALA 219 Cb 0.34 -1.33 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 1.08 0.55 3.88 0.00 0.00 -0.71 -5.06 105.19 104.93 1i80 n GLY 220 Ca 0.21 -0.63 -0.31 0.00 0.00 0.00 0.00 46.02 45.29 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 3.88 0.52 4.61 0.00 -0.35 -5.00 121.76 123.42 1i80 s ALA 221 Ca 0.00 -0.89 -0.15 0.00 0.00 0.00 0.00 51.96 50.93 1i80 s ALA 221 Cb 0.00 -1.72 -0.07 0.00 0.00 0.00 0.00 23.12 21.33 1i80 s ALA 221 CO 0.00 0.81 0.96 -1.21 0.00 0.00 0.00 175.76 176.32 1i80 s GLU 222 N -2.47 3.86 -0.03 0.00 2.02 -0.16 -3.99 118.70 117.93 1i80 s GLU 222 Ca 0.33 0.84 0.02 0.00 0.02 0.00 0.00 54.97 56.18 1i80 s GLU 222 Cb -0.13 -2.17 0.01 0.00 0.10 0.00 0.00 34.13 31.95 1i80 s GLU 222 CO 0.26 -0.29 -0.07 0.08 0.02 0.00 0.00 175.26 175.26 1i80 s VAL 223 N -2.69 0.68 -0.17 2.63 1.01 -1.26 -0.40 120.40 120.21 1i80 s VAL 223 Ca 0.57 -0.26 -0.00 0.00 0.00 0.00 0.00 61.98 62.29 1i80 s VAL 223 Cb -0.10 -0.64 0.00 0.00 0.00 0.00 0.00 36.38 35.64 1i80 s VAL 223 CO 0.35 0.23 -0.15 -0.22 0.00 0.00 0.00 175.10 175.32 1i80 s LEU 224 N 0.49 2.44 -0.12 3.92 2.96 -0.36 -1.73 118.68 126.29 1i80 s LEU 224 Ca -0.07 -0.51 -0.02 0.00 -0.22 0.00 0.00 54.13 53.31 1i80 s LEU 224 Cb -0.11 -1.57 -0.03 0.00 0.50 0.00 0.00 46.19 44.99 1i80 s LEU 224 CO 0.01 0.05 -0.05 -0.83 -1.32 0.00 0.00 176.35 174.21 1i80 s GLY 225 N 1.03 1.71 -0.08 7.98 0.00 -1.26 -0.82 107.32 115.88 1i80 s GLY 225 Ca -0.01 -0.84 -0.01 0.00 0.00 0.00 0.00 44.72 43.86 1i80 s GLY 225 CO -0.04 -0.32 -0.02 0.14 0.00 0.00 0.00 173.10 172.86 1i80 s VAL 226 N -0.15 0.56 -0.01 1.40 1.01 -0.16 -0.42 120.40 122.63 1i80 s VAL 226 Ca 0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 61.98 61.99 1i80 s VAL 226 Cb -0.13 -0.67 -0.04 0.00 0.00 0.00 0.00 36.38 35.54 1i80 s VAL 226 CO 0.03 0.29 0.07 -0.44 0.00 0.00 0.00 175.10 175.04 1i80 s SER 227 N 1.79 5.65 -0.26 3.32 0.01 0.84 -1.76 113.70 123.28 1i80 s SER 227 Ca 0.03 0.15 -0.04 0.00 1.31 0.00 0.00 55.95 57.41 1i80 s SER 227 Cb -0.13 -1.62 0.01 0.00 0.21 0.00 0.00 66.02 64.50 1i80 s SER 227 CO -0.05 0.29 -0.01 -0.22 0.41 0.00 0.00 173.24 173.65 1i80 s LEU 228 N -1.63 3.35 -0.38 2.44 2.96 0.09 0.35 118.68 125.85 1i80 s LEU 228 Ca 0.22 -0.74 -0.28 0.00 -0.22 0.00 0.00 54.13 53.10 1i80 s LEU 228 Cb -0.12 -1.75 -0.00 0.00 0.50 0.00 0.00 46.19 44.82 1i80 s LEU 228 CO 0.12 -0.13 1.61 -0.69 -1.32 0.00 0.00 176.35 175.94 1i80 s VAL 229 N 1.41 3.68 -1.06 1.68 1.01 -0.90 -1.65 120.40 124.55 1i80 s VAL 229 Ca 0.02 0.68 0.22 0.00 0.00 0.00 0.00 61.98 62.90 1i80 s VAL 229 Cb -0.16 -3.94 -0.14 0.00 0.00 0.00 0.00 36.38 32.14 1i80 s VAL 229 CO -0.02 -0.61 1.08 0.35 0.00 0.00 0.00 175.10 175.90 1i80 n THR 230 N 7.24 0.00 -3.57 3.92 -2.24 -0.74 0.41 114.28 119.30 1i80 n THR 230 Ca 0.19 -0.01 -0.06 0.00 -2.27 0.00 0.00 64.05 61.90 1i80 n THR 230 Cb 0.48 0.77 -0.02 0.00 -2.10 0.00 0.00 70.33 69.45 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 -2.96 -0.22 0.25 3.42 4.22 -1.25 -4.33 114.94 114.06 1i80 s ASN 231 Ca 0.10 0.03 -0.24 0.00 -2.14 0.00 0.00 52.86 50.61 1i80 s ASN 231 Cb 0.17 0.23 -0.09 0.00 1.28 0.00 0.00 41.25 42.83 1i80 s ASN 231 CO 0.80 -0.36 0.83 -0.76 -2.04 0.00 0.00 177.10 175.57 1i80 s LEU 232 N -2.16 4.42 0.83 3.54 1.43 -1.26 -0.93 118.68 124.54 1i80 s LEU 232 Ca 0.07 1.66 -0.14 0.00 -1.03 0.00 0.00 54.13 54.69 1i80 s LEU 232 Cb -0.01 -3.69 0.02 0.00 0.03 0.00 0.00 46.19 42.54 1i80 s LEU 232 CO -0.06 0.04 0.64 0.00 0.23 0.00 0.00 176.35 177.20 1i80 n ALA 233 N 0.90 -1.58 -1.64 4.21 0.00 0.01 -4.68 120.51 117.73 1i80 n ALA 233 Ca -0.01 -0.40 -0.45 0.00 0.00 0.00 0.00 53.44 52.57 1i80 n ALA 233 Cb 0.50 -1.92 -0.02 0.00 0.00 0.00 0.00 19.45 18.00 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 -3.06 0.46 -0.55 0.00 0.00 -1.26 -2.45 120.51 113.64 1i80 n ALA 234 Ca 0.10 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.95 1i80 n ALA 234 Cb 0.51 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 17.80 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 1.75 1.00 0.11 0.00 0.00 -1.26 -4.37 105.19 102.43 1i80 n GLY 235 Ca 0.11 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.99 1i80 n GLY 235 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1i80 n ILE 236 N -2.00 1.62 0.58 -0.61 5.41 -1.03 -4.29 119.36 119.04 1i80 n ILE 236 Ca 0.00 -0.73 0.12 0.00 1.00 0.00 0.00 62.75 63.15 1i80 n ILE 236 Cb 0.00 -1.24 0.26 0.00 -0.71 0.00 0.00 39.64 37.95 1i80 n ILE 236 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 176.55 177.26 1i80 h THR 237 N 0.02 0.00 0.00 1.39 1.35 -1.90 -3.47 112.91 110.31 1i80 h THR 237 Ca -0.41 -0.50 0.00 0.00 -0.55 0.00 0.00 66.41 64.95 1i80 h THR 237 Cb 2.04 1.26 0.00 0.00 -1.73 0.00 0.00 68.15 69.72 1i80 h THR 237 CO 0.05 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.93 1i80 n GLY 238 N 1.32 0.74 3.24 5.82 0.00 -1.26 -5.01 105.19 110.04 1i80 n GLY 238 Ca 0.04 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.15 1.03 0.72 1.61 2.02 -1.26 -5.09 118.70 117.58 1i80 s GLU 239 Ca 0.00 -1.39 -0.13 0.00 0.02 0.00 0.00 54.97 53.47 1i80 s GLU 239 Cb 0.00 -0.64 0.03 0.00 0.10 0.00 0.00 34.13 33.62 1i80 s GLU 239 CO 0.00 0.09 1.11 -1.25 0.02 0.00 0.00 175.26 175.23 1i80 s PRO 240 N -3.50 2.45 0.50 0.39 0.04 -1.26 -4.62 135.00 129.00 1i80 s PRO 240 Ca 0.14 1.36 -0.22 0.00 0.04 0.00 0.00 61.00 62.32 1i80 s PRO 240 Cb 0.01 -1.91 -0.06 0.00 0.04 0.00 0.00 34.50 32.58 1i80 s PRO 240 CO 0.01 -1.52 1.22 -0.51 0.04 0.00 0.00 177.00 176.24 1i80 s LEU 241 N -5.35 3.93 -0.24 -3.56 1.43 -1.26 -5.01 118.68 108.62 1i80 s LEU 241 Ca 0.66 2.44 -0.01 0.00 -1.03 0.00 0.00 54.13 56.18 1i80 s LEU 241 Cb -0.20 -4.29 0.02 0.00 0.03 0.00 0.00 46.19 41.76 1i80 s LEU 241 CO 0.48 -1.16 -0.09 -0.55 0.23 0.00 0.00 176.35 175.26 1i80 s SER 242 N -1.27 4.13 0.21 2.29 0.15 -1.26 -4.98 113.70 112.97 1i80 s SER 242 Ca 0.67 -0.84 -0.09 0.00 0.70 0.00 0.00 55.95 56.39 1i80 s SER 242 Cb -0.32 -1.63 0.21 0.00 -1.71 0.00 0.00 66.02 62.57 1i80 s SER 242 CO 0.38 -0.10 1.86 -0.74 1.20 0.00 0.00 173.24 175.83 1i80 h HIS 243 N 7.99 0.88 -0.30 3.44 2.76 -1.99 0.64 115.15 128.58 1i80 h HIS 243 Ca -0.34 0.02 0.01 0.00 -2.20 0.00 0.00 60.37 57.86 1i80 h HIS 243 Cb 1.11 -0.29 -0.02 0.00 1.55 0.00 0.00 27.41 29.76 1i80 h HIS 243 CO 0.57 0.51 0.18 0.00 -1.30 0.00 0.00 177.93 177.88 1i80 h ALA 244 N 1.31 0.37 -0.29 5.26 0.00 -1.99 -1.26 119.26 122.66 1i80 h ALA 244 Ca 0.30 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 55.06 1i80 h ALA 244 Cb 0.01 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1i80 h ALA 244 CO -0.11 -0.19 -0.37 0.93 0.00 0.00 0.00 179.25 179.51 1i80 h GLU 245 N 0.36 0.67 -0.36 0.00 5.08 -1.83 0.43 114.58 118.93 1i80 h GLU 245 Ca 0.11 -0.33 -0.01 0.00 -1.00 0.00 0.00 59.36 58.13 1i80 h GLU 245 Cb -0.01 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 1i80 h GLU 245 CO -0.05 0.93 0.18 0.28 -1.00 0.00 0.00 179.01 179.36 1i80 h VAL 246 N 0.56 1.16 -0.52 3.13 2.07 -0.64 0.83 116.25 122.83 1i80 h VAL 246 Ca 0.05 -0.44 -0.10 0.00 0.82 0.00 0.00 66.70 67.03 1i80 h VAL 246 Cb 0.89 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.43 1i80 h VAL 246 CO 0.08 0.17 -0.05 -0.07 0.02 0.00 0.00 177.57 177.71 1i80 h LEU 247 N 0.45 0.95 -0.91 2.57 3.38 -1.15 -2.72 115.31 117.88 1i80 h LEU 247 Ca 0.13 -0.33 -0.00 0.00 0.09 0.00 0.00 57.88 57.76 1i80 h LEU 247 Cb 0.10 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.55 1i80 h LEU 247 CO -0.02 1.06 0.56 0.00 0.09 0.00 0.00 178.44 180.13 1i80 h ALA 248 N 0.93 1.16 -0.93 1.53 0.00 -0.59 -2.53 119.26 118.84 1i80 h ALA 248 Ca 0.14 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1i80 h ALA 248 Cb 0.60 -0.37 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1i80 h ALA 248 CO 0.04 0.61 0.53 0.00 0.00 0.00 0.00 179.25 180.43 1i80 h ALA 249 N 1.30 1.19 -0.24 0.00 0.00 -0.60 -0.37 119.26 120.54 1i80 h ALA 249 Ca 0.33 -0.12 -0.15 0.00 0.00 0.00 0.00 54.91 54.97 1i80 h ALA 249 Cb -0.06 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.35 1i80 h ALA 249 CO -0.06 0.67 -0.46 0.78 0.00 0.00 0.00 179.25 180.18 1i80 h GLY 250 N 1.29 0.67 1.20 0.00 0.00 -1.18 -2.73 103.07 102.32 1i80 h GLY 250 Ca 0.33 -0.71 -0.23 0.00 0.00 0.00 0.00 47.33 46.71 1i80 h GLY 250 CO -0.06 0.64 -0.84 0.00 0.00 0.00 0.00 176.54 176.29 1i80 h ALA 251 N 1.00 0.28 -0.18 3.60 0.00 -1.26 -2.78 119.26 119.90 1i80 h ALA 251 Ca 0.03 -0.62 -0.03 0.00 0.00 0.00 0.00 54.91 54.29 1i80 h ALA 251 Cb 0.99 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1i80 h ALA 251 CO 0.09 0.69 -0.03 0.00 0.00 0.00 0.00 179.25 180.00 1i80 h ALA 252 N 0.53 1.62 -0.40 0.00 0.00 -1.04 -2.97 119.26 117.00 1i80 h ALA 252 Ca -0.07 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1i80 h ALA 252 Cb 1.47 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1i80 h ALA 252 CO 0.17 0.28 0.00 -1.13 0.00 0.00 0.00 179.25 178.57 1i80 n SER 253 N -4.35 3.49 0.19 0.00 3.41 -1.03 -4.70 113.62 110.62 1i80 n SER 253 Ca -0.00 -2.30 -0.14 0.00 -0.26 0.00 0.00 58.87 56.16 1i80 n SER 253 Cb 0.20 -0.37 -0.07 0.00 -0.26 0.00 0.00 64.21 63.71 1i80 n SER 253 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1i80 h ALA 254 N 2.43 -0.58 -0.83 7.33 0.00 -1.32 -0.09 119.26 126.20 1i80 h ALA 254 Ca 0.00 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 54.86 1i80 h ALA 254 Cb 1.02 0.39 -0.05 0.00 0.00 0.00 0.00 17.79 19.15 1i80 h ALA 254 CO 0.09 -0.86 0.52 1.15 0.00 0.00 0.00 179.25 180.15 1i80 h THR 255 N -0.59 1.09 -0.52 0.00 2.02 -1.81 -1.33 112.91 111.77 1i80 h THR 255 Ca -0.01 -0.34 -0.09 0.00 0.77 0.00 0.00 66.41 66.73 1i80 h THR 255 Cb 0.54 0.01 -0.02 0.00 -1.74 0.00 0.00 68.15 66.94 1i80 h THR 255 CO -0.05 0.18 -0.04 -0.09 0.37 0.00 0.00 175.52 175.89 1i80 h ARG 256 N 0.99 0.95 -0.21 6.66 2.43 -1.83 -1.94 114.38 121.43 1i80 h ARG 256 Ca 0.34 -0.32 -0.02 0.00 -0.81 0.00 0.00 59.98 59.17 1i80 h ARG 256 Cb 0.08 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1i80 h ARG 256 CO -0.14 0.99 0.06 0.52 -1.51 0.00 0.00 179.97 179.88 1i80 h MET 257 N 0.82 0.33 -0.44 0.20 2.86 -0.60 -1.50 114.93 116.60 1i80 h MET 257 Ca 0.14 -0.08 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 1i80 h MET 257 Cb 0.58 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.18 1i80 h MET 257 CO 0.03 0.44 0.29 0.78 1.06 0.00 0.00 176.91 179.52 1i80 h GLY 258 N 0.16 0.62 1.01 8.32 0.00 -1.21 -0.37 103.07 111.60 1i80 h GLY 258 Ca 0.07 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.17 1i80 h GLY 258 CO -0.00 0.23 0.45 0.00 0.00 0.00 0.00 176.54 177.21 1i80 h ALA 259 N 1.16 0.91 0.17 3.60 0.00 -1.28 -1.06 119.26 122.77 1i80 h ALA 259 Ca 0.16 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1i80 h ALA 259 Cb -0.07 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 1i80 h ALA 259 CO -0.04 0.36 -0.12 1.25 0.00 0.00 0.00 179.25 180.70 1i80 h LEU 260 N 0.97 -0.30 -0.48 0.00 5.85 -0.81 -2.22 115.31 118.32 1i80 h LEU 260 Ca 0.26 0.02 0.06 0.00 0.84 0.00 0.00 57.88 59.06 1i80 h LEU 260 Cb -0.07 0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.01 1i80 h LEU 260 CO -0.05 -0.19 0.19 -0.07 -0.34 0.00 0.00 178.44 177.98 1i80 h LEU 261 N -0.29 0.23 -0.86 2.25 3.38 -0.72 -1.92 115.31 117.37 1i80 h LEU 261 Ca -0.01 0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.05 1i80 h LEU 261 Cb 0.25 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 40.96 1i80 h LEU 261 CO 0.00 0.16 0.54 0.00 0.09 0.00 0.00 178.44 179.24 1i80 h ALA 262 N 1.30 1.16 -0.19 1.53 0.00 -1.05 -0.39 119.26 121.60 1i80 h ALA 262 Ca 0.22 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.96 1i80 h ALA 262 Cb 0.20 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1i80 h ALA 262 CO -0.21 0.34 -0.50 0.22 0.00 0.00 0.00 179.25 179.10 1i80 h ASP 263 N 1.03 0.58 0.02 0.00 3.58 -0.90 -1.94 116.42 118.79 1i80 h ASP 263 Ca 0.36 -0.29 -0.00 0.00 0.42 0.00 0.00 57.03 57.51 1i80 h ASP 263 Cb 0.08 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 40.97 1i80 h ASP 263 CO -0.14 0.99 -0.01 0.58 -2.88 0.00 0.00 179.24 177.78 1i80 h VAL 264 N 0.42 1.39 -0.49 2.25 2.07 -1.06 -3.17 116.25 117.67 1i80 h VAL 264 Ca 0.02 -1.29 0.07 0.00 0.82 0.00 0.00 66.70 66.32 1i80 h VAL 264 Cb 1.03 2.26 -0.06 0.00 -1.52 0.00 0.00 31.29 33.00 1i80 h VAL 264 CO 0.09 0.33 0.17 0.40 0.02 0.00 0.00 177.57 178.58 1i80 h ILE 265 N -0.58 0.83 -0.52 4.57 2.04 -1.12 0.12 117.51 122.85 1i80 h ILE 265 Ca -0.00 -0.12 0.15 0.00 1.00 0.00 0.00 64.86 65.89 1i80 h ILE 265 Cb 0.56 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 1i80 h ILE 265 CO 0.00 0.06 0.51 0.00 0.00 0.00 0.00 178.15 178.72 1i80 h ALA 266 N 1.33 2.29 -0.00 1.87 0.00 -1.38 0.23 119.26 123.60 1i80 h ALA 266 Ca 0.23 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1i80 h ALA 266 Cb 0.25 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1i80 h ALA 266 CO -0.24 -0.78 -0.23 0.54 0.00 0.00 0.00 179.25 178.54 1i80 n ARG 267 N -3.82 0.16 0.00 0.00 1.74 0.02 -4.76 116.66 110.01 1i80 n ARG 267 Ca 0.10 -0.06 0.06 0.00 -0.77 0.00 0.00 57.85 57.17 1i80 n ARG 267 Cb 0.71 -1.50 0.33 0.00 -1.02 0.00 0.00 32.46 30.98 1i80 n ARG 267 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30