#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qut s HIS 2 N 0.00 2.83 0.07 0.54 3.76 -1.26 -5.11 115.29 116.13 2qut s HIS 2 Ca 0.00 -0.21 -0.25 0.00 -0.15 0.00 0.00 55.06 54.45 2qut s HIS 2 Cb 0.00 -1.73 -0.06 0.00 1.11 0.00 0.00 32.58 31.90 2qut s HIS 2 CO 0.00 0.13 0.76 0.45 -0.85 0.00 0.00 174.74 175.23 2qut s SER 3 N -0.43 7.24 -0.51 1.40 0.15 -1.26 -5.00 113.70 115.28 2qut s SER 3 Ca 0.06 1.48 0.06 0.00 0.70 0.00 0.00 55.95 58.25 2qut s SER 3 Cb -0.12 -2.47 0.22 0.00 -1.71 0.00 0.00 66.02 61.94 2qut s SER 3 CO 0.02 0.08 0.54 1.41 1.20 0.00 0.00 173.24 176.49 2qut n HIS 4 N 2.46 1.22 -0.49 3.44 8.25 -1.26 -5.09 115.22 123.75 2qut n HIS 4 Ca -0.04 -3.80 -0.21 0.00 -0.26 0.00 0.00 57.72 53.42 2qut n HIS 4 Cb 0.50 -0.33 -0.04 0.00 1.12 0.00 0.00 29.99 31.25 2qut n HIS 4 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 2qut n PRO 5 N 1.63 0.00 0.10 -0.41 -0.02 -1.26 -4.84 135.00 130.20 2qut n PRO 5 Ca 0.25 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.71 2qut n PRO 5 Cb 0.46 -0.49 -0.04 0.00 -0.02 0.00 0.00 33.50 33.41 2qut n PRO 5 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qut h ALA 6 N 2.35 0.53 -3.47 3.55 0.00 -1.98 -3.46 119.26 116.78 2qut h ALA 6 Ca -0.09 -0.67 -0.38 0.00 0.00 0.00 0.00 54.91 53.77 2qut h ALA 6 Cb 0.46 -0.12 -0.23 0.00 0.00 0.00 0.00 17.79 17.91 2qut h ALA 6 CO 0.34 0.92 -0.77 -0.51 0.00 0.00 0.00 179.25 179.23 2qut s LEU 7 N -6.59 2.23 0.56 0.00 1.43 -1.26 -4.95 118.68 110.09 2qut s LEU 7 Ca 0.03 -0.53 -0.03 0.00 -1.03 0.00 0.00 54.13 52.57 2qut s LEU 7 Cb 0.09 -0.44 0.02 0.00 0.03 0.00 0.00 46.19 45.88 2qut s LEU 7 CO 0.78 -0.07 0.82 0.42 0.23 0.00 0.00 176.35 178.53 2qut s THR 8 N -1.13 3.37 0.45 5.49 -4.23 -1.26 -4.89 115.64 113.44 2qut s THR 8 Ca -0.03 -0.32 0.13 0.00 -1.18 0.00 0.00 61.69 60.30 2qut s THR 8 Cb -0.09 -3.31 0.31 0.00 1.34 0.00 0.00 72.50 70.75 2qut s THR 8 CO 0.01 -0.27 2.04 -0.65 -0.54 0.00 0.00 174.62 175.21 2qut h PRO 9 N -0.01 0.33 -0.21 3.99 0.11 -2.01 -0.97 132.00 133.22 2qut h PRO 9 Ca -0.45 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.56 2qut h PRO 9 Cb 1.27 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 2qut h PRO 9 CO 0.58 0.22 -0.19 0.93 -0.21 0.00 0.00 178.00 179.33 2qut h GLU 10 N 0.34 0.51 -0.77 1.05 3.07 -1.99 -1.89 114.58 114.89 2qut h GLU 10 Ca 0.19 -0.26 -0.06 0.00 -0.50 0.00 0.00 59.36 58.73 2qut h GLU 10 Cb 0.32 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.20 2qut h GLU 10 CO -0.04 0.83 0.26 1.96 -1.40 0.00 0.00 179.01 180.62 2qut h GLN 11 N 0.19 1.18 -0.41 2.33 4.20 -1.77 -2.16 115.11 118.67 2qut h GLN 11 Ca 0.04 -0.24 -0.02 0.00 0.06 0.00 0.00 58.65 58.48 2qut h GLN 11 Cb 0.73 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.31 2qut h GLN 11 CO 0.05 0.99 0.17 0.87 -0.67 0.00 0.00 178.83 180.24 2qut h LYS 12 N 1.14 0.61 -0.48 1.46 1.57 -1.16 -2.19 116.57 117.53 2qut h LYS 12 Ca 0.25 -0.11 0.03 0.00 -1.87 0.00 0.00 60.65 58.95 2qut h LYS 12 Cb 0.28 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.45 2qut h LYS 12 CO -0.01 0.56 0.27 -0.22 -0.57 0.00 0.00 179.45 179.48 2qut h LYS 13 N 0.53 0.53 -0.26 3.15 3.64 -1.08 0.69 116.57 123.77 2qut h LYS 13 Ca 0.14 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.49 2qut h LYS 13 Cb 0.17 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.86 2qut h LYS 13 CO -0.01 0.35 0.16 1.49 -2.27 0.00 0.00 179.45 179.16 2qut h GLU 14 N 0.54 0.31 -0.60 1.90 4.81 -1.22 0.13 114.58 120.46 2qut h GLU 14 Ca 0.20 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.37 2qut h GLU 14 Cb 0.05 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.33 2qut h GLU 14 CO -0.11 0.21 0.23 -0.07 -0.73 0.00 0.00 179.01 178.54 2qut h LEU 15 N 0.32 0.84 -0.33 1.64 3.38 -1.06 -1.33 115.31 118.77 2qut h LEU 15 Ca 0.10 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 2qut h LEU 15 Cb -0.02 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 2qut h LEU 15 CO -0.04 0.79 0.05 -1.28 0.09 0.00 0.00 178.44 178.06 2qut h SER 16 N 0.84 0.52 -0.67 -0.43 0.87 -0.63 -1.32 113.55 112.74 2qut h SER 16 Ca 0.20 -0.26 0.00 0.00 -1.23 0.00 0.00 61.79 60.50 2qut h SER 16 Cb 0.23 -0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 62.02 2qut h SER 16 CO -0.01 0.65 0.42 0.44 -0.53 0.00 0.00 176.83 177.79 2qut h ASP 17 N 0.37 0.79 0.13 6.23 3.32 -0.86 -1.00 116.42 125.40 2qut h ASP 17 Ca 0.10 -0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 2qut h ASP 17 Cb 0.35 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.71 2qut h ASP 17 CO 0.01 0.60 -0.06 0.40 -1.72 0.00 0.00 179.24 178.46 2qut h ILE 18 N 0.90 0.92 -0.84 0.35 2.04 -1.13 -1.56 117.51 118.20 2qut h ILE 18 Ca 0.24 -0.20 0.07 0.00 1.00 0.00 0.00 64.86 65.97 2qut h ILE 18 Cb -0.05 1.05 -0.06 0.00 -0.74 0.00 0.00 36.82 37.01 2qut h ILE 18 CO -0.05 0.05 0.51 0.00 0.00 0.00 0.00 178.15 178.66 2qut h ALA 19 N 0.59 1.16 -0.28 1.87 0.00 -1.02 -2.12 119.26 119.46 2qut h ALA 19 Ca -0.02 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 2qut h ALA 19 Cb 0.21 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2qut h ALA 19 CO 0.03 0.22 -0.28 0.45 0.00 0.00 0.00 179.25 179.67 2qut h HIS 20 N 0.91 0.63 -0.48 0.00 3.86 -1.04 -3.00 115.15 116.03 2qut h HIS 20 Ca 0.38 -0.15 -0.07 0.00 -1.16 0.00 0.00 60.37 59.37 2qut h HIS 20 Cb 0.22 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 28.52 2qut h HIS 20 CO -0.04 0.78 -0.01 0.00 0.86 0.00 0.00 177.93 179.52 2qut h ARG 21 N 0.48 0.79 -0.64 2.45 3.08 -0.63 -1.90 114.38 118.01 2qut h ARG 21 Ca 0.06 -0.22 -0.04 0.00 0.07 0.00 0.00 59.98 59.86 2qut h ARG 21 Cb 0.73 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.66 2qut h ARG 21 CO 0.06 0.80 0.24 0.82 -1.07 0.00 0.00 179.97 180.82 2qut h ILE 22 N 0.74 1.24 -0.51 2.04 2.04 -1.31 -3.17 117.51 118.58 2qut h ILE 22 Ca 0.14 -0.78 -0.23 0.00 1.00 0.00 0.00 64.86 65.00 2qut h ILE 22 Cb 0.46 0.55 -0.14 0.00 -0.74 0.00 0.00 36.82 36.95 2qut h ILE 22 CO 0.02 0.30 0.12 1.33 0.00 0.00 0.00 178.15 179.92 2qut n VAL 23 N -4.40 2.69 -1.33 1.67 0.24 -1.16 -4.11 118.33 111.94 2qut n VAL 23 Ca 0.04 -2.37 -0.35 0.00 -2.04 0.00 0.00 64.34 59.62 2qut n VAL 23 Cb 0.18 -0.35 0.09 0.00 -1.47 0.00 0.00 33.84 32.30 2qut n VAL 23 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2qut n ALA 24 N -0.97 -0.31 -1.62 2.33 0.00 -0.73 -4.70 120.51 114.51 2qut n ALA 24 Ca 0.38 -0.21 -0.62 0.00 0.00 0.00 0.00 53.44 53.00 2qut n ALA 24 Cb 1.19 -2.11 -0.09 0.00 0.00 0.00 0.00 19.45 18.44 2qut n ALA 24 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2qut n PRO 25 N -1.92 0.21 -0.71 0.00 -0.02 -1.26 -0.44 135.00 130.87 2qut n PRO 25 Ca 0.13 0.08 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 2qut n PRO 25 Cb 0.50 -1.61 0.00 0.00 -0.02 0.00 0.00 33.50 32.37 2qut n PRO 25 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qut n GLY 26 N 2.81 1.24 3.66 -1.23 0.00 -1.26 -5.03 105.19 105.37 2qut n GLY 26 Ca 0.25 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.96 2qut n GLY 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qut s LYS 27 N -0.13 2.51 0.00 1.61 1.02 0.42 -4.42 119.74 120.75 2qut s LYS 27 Ca 0.00 -0.83 0.00 0.00 0.02 0.00 0.00 55.97 55.16 2qut s LYS 27 Cb 0.00 -2.51 0.00 0.00 -0.52 0.00 0.00 37.83 34.80 2qut s LYS 27 CO 0.00 0.55 0.00 0.41 -0.92 0.00 0.00 175.35 175.39 2qut n GLY 28 N 0.79 4.21 3.29 -3.33 0.00 -0.47 -4.56 105.19 105.12 2qut n GLY 28 Ca -0.12 -1.64 -0.32 0.00 0.00 0.00 0.00 46.02 43.94 2qut n GLY 28 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qut s ILE 29 N -1.83 2.24 -0.34 -0.61 1.01 0.23 -0.26 121.20 121.63 2qut s ILE 29 Ca 0.00 -1.00 -0.20 0.00 0.00 0.00 0.00 60.65 59.45 2qut s ILE 29 Cb 0.00 -1.83 -0.00 0.00 0.01 0.00 0.00 42.46 40.64 2qut s ILE 29 CO 0.00 0.57 0.62 -0.22 0.00 0.00 0.00 174.94 175.91 2qut s LEU 30 N -0.12 4.24 -0.72 2.97 2.96 -0.05 -1.92 118.68 126.03 2qut s LEU 30 Ca -0.04 0.20 -0.17 0.00 -0.22 0.00 0.00 54.13 53.89 2qut s LEU 30 Cb -0.14 -2.77 0.14 0.00 0.50 0.00 0.00 46.19 43.92 2qut s LEU 30 CO 0.04 -0.56 0.79 0.00 -1.32 0.00 0.00 176.35 175.30 2qut s ALA 31 N 2.66 3.60 -0.27 5.97 0.00 0.09 -0.71 121.76 133.10 2qut s ALA 31 Ca 0.24 -2.66 0.09 0.00 0.00 0.00 0.00 51.96 49.63 2qut s ALA 31 Cb -0.15 -3.61 0.48 0.00 0.00 0.00 0.00 23.12 19.84 2qut s ALA 31 CO 0.14 -2.43 1.39 0.00 0.00 0.00 0.00 175.76 174.85 2qut n ALA 32 N 5.66 4.20 0.16 0.00 0.00 -0.55 -4.00 120.51 125.98 2qut n ALA 32 Ca 0.03 -3.24 -0.09 0.00 0.00 0.00 0.00 53.44 50.14 2qut n ALA 32 Cb 0.45 -0.62 0.07 0.00 0.00 0.00 0.00 19.45 19.35 2qut n ALA 32 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2qut n ASP 33 N -1.11 3.33 -4.72 0.00 5.75 -0.83 -4.21 116.55 114.76 2qut n ASP 33 Ca 0.30 -2.60 -0.42 0.00 -0.01 0.00 0.00 54.79 52.06 2qut n ASP 33 Cb 0.92 -0.63 -0.03 0.00 -1.03 0.00 0.00 41.12 40.35 2qut n ASP 33 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 2qut s GLU 34 N -1.21 4.29 1.07 0.11 8.01 -1.26 -4.46 118.70 125.24 2qut s GLU 34 Ca 0.21 2.18 -0.16 0.00 0.01 0.00 0.00 54.97 57.21 2qut s GLU 34 Cb 0.18 -3.20 0.22 0.00 -4.31 0.00 0.00 34.13 27.01 2qut s GLU 34 CO 0.04 -0.48 1.13 -1.54 0.01 0.00 0.00 175.26 174.42 2qut s SER 35 N 1.01 2.09 0.13 -0.19 1.04 -1.26 -4.56 113.70 111.97 2qut s SER 35 Ca 0.65 0.82 -0.23 0.00 0.48 0.00 0.00 55.95 57.67 2qut s SER 35 Cb -0.39 -1.24 -0.02 0.00 0.10 0.00 0.00 66.02 64.47 2qut s SER 35 CO 0.32 -3.42 1.65 0.74 0.98 0.00 0.00 173.24 173.51 2qut h THR 36 N -2.10 0.48 -0.51 2.02 2.02 -1.98 0.25 112.91 113.09 2qut h THR 36 Ca -0.49 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 66.66 2qut h THR 36 Cb 1.31 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 68.18 2qut h THR 36 CO 0.47 0.00 0.19 1.23 0.37 0.00 0.00 175.52 177.78 2qut h GLY 37 N -0.27 0.79 0.53 2.16 0.00 -2.00 -0.93 103.07 103.35 2qut h GLY 37 Ca 0.10 -0.40 -0.02 0.00 0.00 0.00 0.00 47.33 47.01 2qut h GLY 37 CO -0.28 0.38 -0.05 0.23 0.00 0.00 0.00 176.54 176.82 2qut h SER 38 N 0.73 0.10 0.61 0.19 0.87 -1.72 -3.15 113.55 111.18 2qut h SER 38 Ca 0.17 -0.54 -0.03 0.00 -1.23 0.00 0.00 61.79 60.17 2qut h SER 38 Cb 0.17 -0.03 -0.00 0.00 -0.44 0.00 0.00 62.40 62.09 2qut h SER 38 CO -0.01 0.62 -0.13 -0.29 -0.53 0.00 0.00 176.83 176.48 2qut h ILE 39 N -0.41 0.44 -1.00 2.23 6.09 -0.44 -2.43 117.51 121.98 2qut h ILE 39 Ca 0.00 -0.69 0.05 0.00 -1.37 0.00 0.00 64.86 62.85 2qut h ILE 39 Cb 0.60 1.48 -0.06 0.00 0.47 0.00 0.00 36.82 39.31 2qut h ILE 39 CO 0.01 0.13 0.65 0.00 -3.07 0.00 0.00 178.15 175.87 2qut h ALA 40 N 1.87 1.37 -0.61 0.18 0.00 -1.12 0.74 119.26 121.69 2qut h ALA 40 Ca -0.00 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 2qut h ALA 40 Cb 0.47 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2qut h ALA 40 CO 0.02 0.51 0.12 0.87 0.00 0.00 0.00 179.25 180.77 2qut h LYS 41 N 1.23 1.00 -0.37 0.00 1.57 -1.48 -1.16 116.57 117.36 2qut h LYS 41 Ca 0.41 -0.26 -0.06 0.00 -1.87 0.00 0.00 60.65 58.88 2qut h LYS 41 Cb 0.07 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 2qut h LYS 41 CO -0.14 0.93 0.00 0.00 -0.57 0.00 0.00 179.45 179.67 2qut h ARG 42 N 0.91 0.64 -0.02 3.15 2.47 -1.30 -2.77 114.38 117.47 2qut h ARG 42 Ca 0.19 -0.20 -0.08 0.00 -1.26 0.00 0.00 59.98 58.63 2qut h ARG 42 Cb 0.39 -0.06 -0.01 0.00 -1.65 0.00 0.00 29.97 28.64 2qut h ARG 42 CO 0.01 0.75 -0.35 -0.07 0.56 0.00 0.00 179.97 180.87 2qut h LEU 43 N 0.46 0.03 -0.86 3.04 3.38 -0.77 -2.78 115.31 117.81 2qut h LEU 43 Ca 0.10 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.95 2qut h LEU 43 Cb 0.46 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2qut h LEU 43 CO 0.02 0.38 -0.44 -0.61 0.09 0.00 0.00 178.44 177.88 2qut h GLN 44 N 0.03 0.28 0.00 1.13 4.15 -1.02 -0.27 115.11 119.40 2qut h GLN 44 Ca 0.00 -0.14 0.00 0.00 0.77 0.00 0.00 58.65 59.28 2qut h GLN 44 Cb 0.63 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.32 2qut h GLN 44 CO 0.05 0.67 0.00 0.66 -1.93 0.00 0.00 178.83 178.28 2qut h SER 45 N 0.23 0.00 0.00 -0.69 4.64 -1.21 -2.00 113.55 114.52 2qut h SER 45 Ca 0.02 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2qut h SER 45 Cb 0.87 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.96 2qut h SER 45 CO 0.07 0.00 -0.33 2.30 -0.87 0.00 0.00 176.83 178.00 2qut n ILE 46 N -2.39 2.03 -3.95 0.95 -5.35 -1.07 -4.99 119.36 104.59 2qut n ILE 46 Ca 0.00 -2.82 -0.34 0.00 -0.27 0.00 0.00 62.75 59.32 2qut n ILE 46 Cb 0.16 -0.21 0.00 0.00 -1.74 0.00 0.00 39.64 37.85 2qut n ILE 46 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2qut n GLY 47 N -1.19 -0.64 3.02 3.28 0.00 -0.75 -4.61 105.19 104.30 2qut n GLY 47 Ca 0.17 0.31 -0.24 0.00 0.00 0.00 0.00 46.02 46.26 2qut n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qut s THR 48 N -3.73 1.09 0.31 2.61 2.01 -0.14 -4.95 115.64 112.84 2qut s THR 48 Ca 0.30 -0.46 -0.29 0.00 0.31 0.00 0.00 61.69 61.54 2qut s THR 48 Cb -0.13 -0.99 -0.11 0.00 0.01 0.00 0.00 72.50 71.28 2qut s THR 48 CO 0.92 0.34 1.46 -0.70 -0.69 0.00 0.00 174.62 175.95 2qut s GLU 49 N 0.59 4.22 -1.19 4.92 2.12 -1.26 -4.12 118.70 123.98 2qut s GLU 49 Ca -0.13 2.41 -0.16 0.00 0.36 0.00 0.00 54.97 57.45 2qut s GLU 49 Cb -0.15 -3.05 0.13 0.00 0.26 0.00 0.00 34.13 31.32 2qut s GLU 49 CO 0.03 -0.44 1.49 1.21 -0.54 0.00 0.00 175.26 177.01 2qut s ASN 50 N 0.07 6.91 0.23 -1.70 2.47 -1.26 -4.79 114.94 116.88 2qut s ASN 50 Ca 0.56 -2.62 0.09 0.00 0.42 0.00 0.00 52.86 51.31 2qut s ASN 50 Cb -0.44 -2.47 -0.04 0.00 -1.45 0.00 0.00 41.25 36.85 2qut s ASN 50 CO 0.51 -0.96 -0.03 0.42 -3.72 0.00 0.00 177.10 173.33 2qut s THR 51 N 2.72 3.43 0.27 -5.21 -4.23 -1.26 -5.03 115.64 106.33 2qut s THR 51 Ca 0.45 -1.77 -0.01 0.00 -1.18 0.00 0.00 61.69 59.18 2qut s THR 51 Cb -0.01 -2.78 0.28 0.00 1.34 0.00 0.00 72.50 71.33 2qut s THR 51 CO 0.01 -0.27 1.87 -0.08 -0.54 0.00 0.00 174.62 175.61 2qut h GLU 52 N 2.28 1.09 -0.63 3.99 4.81 -1.99 -1.47 114.58 122.66 2qut h GLU 52 Ca -0.45 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 58.68 2qut h GLU 52 Cb 1.23 -0.25 -0.03 0.00 0.63 0.00 0.00 28.75 30.34 2qut h GLU 52 CO 0.58 0.72 0.27 1.49 -0.73 0.00 0.00 179.01 181.35 2qut h GLU 53 N 1.13 0.92 -0.50 1.92 4.22 -1.97 0.16 114.58 120.46 2qut h GLU 53 Ca 0.45 -0.16 -0.09 0.00 0.08 0.00 0.00 59.36 59.64 2qut h GLU 53 Cb 0.26 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 2qut h GLU 53 CO -0.20 0.77 -0.06 -0.91 -2.18 0.00 0.00 179.01 176.43 2qut h ASN 54 N 0.87 0.88 -0.40 1.04 2.35 -1.71 0.22 115.58 118.83 2qut h ASN 54 Ca 0.21 -0.25 -0.06 0.00 -0.55 0.00 0.00 56.30 55.65 2qut h ASN 54 Cb 0.17 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.29 2qut h ASN 54 CO -0.02 0.97 0.03 0.03 -1.65 0.00 0.00 177.43 176.79 2qut h ARG 55 N 0.81 0.68 -0.31 0.81 3.08 -0.97 0.78 114.38 119.26 2qut h ARG 55 Ca 0.14 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 59.98 2qut h ARG 55 Cb 0.57 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 2qut h ARG 55 CO 0.03 0.76 0.17 -0.09 -1.07 0.00 0.00 179.97 179.77 2qut h ARG 56 N 0.52 0.43 -0.80 0.04 2.43 -0.34 0.43 114.38 117.09 2qut h ARG 56 Ca 0.12 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.25 2qut h ARG 56 Cb 0.43 -0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 29.85 2qut h ARG 56 CO 0.01 0.37 0.53 0.35 -1.51 0.00 0.00 179.97 179.72 2qut h PHE 57 N 0.38 1.00 -0.06 2.20 3.57 -0.36 0.22 116.94 123.88 2qut h PHE 57 Ca 0.11 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.62 2qut h PHE 57 Cb 0.06 -0.34 -0.00 0.00 2.79 0.00 0.00 35.95 38.46 2qut h PHE 57 CO -0.03 0.62 0.01 -0.92 -2.23 0.00 0.00 178.31 175.76 2qut h TYR 58 N 1.07 0.11 -0.92 0.41 3.20 -0.38 -0.10 116.97 120.37 2qut h TYR 58 Ca 0.30 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.14 2qut h TYR 58 Cb -0.10 -0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.09 2qut h TYR 58 CO -0.02 0.34 0.51 0.00 -1.64 0.00 0.00 178.16 177.35 2qut h ARG 59 N -0.14 1.27 -0.89 1.82 -0.00 -0.69 -1.69 114.38 114.06 2qut h ARG 59 Ca 0.02 -0.14 -0.00 0.00 -0.50 0.00 0.00 59.98 59.35 2qut h ARG 59 Cb 0.29 -0.25 -0.04 0.00 0.00 0.00 0.00 29.97 29.96 2qut h ARG 59 CO 0.00 0.92 0.55 0.37 0.00 0.00 0.00 179.97 181.81 2qut h GLN 60 N 1.28 1.20 -0.56 0.04 4.15 -0.38 -0.18 115.11 120.66 2qut h GLN 60 Ca 0.32 -0.10 0.09 0.00 0.77 0.00 0.00 58.65 59.73 2qut h GLN 60 Cb 0.01 -0.26 -0.07 0.00 0.21 0.00 0.00 27.48 27.38 2qut h GLN 60 CO -0.05 0.84 0.17 1.25 -1.93 0.00 0.00 178.83 179.10 2qut h LEU 61 N 1.22 0.12 -0.02 -2.39 6.46 -0.07 -0.89 115.31 119.73 2qut h LEU 61 Ca 0.32 0.08 -0.06 0.00 -0.12 0.00 0.00 57.88 58.11 2qut h LEU 61 Cb -0.07 0.09 0.00 0.00 -0.73 0.00 0.00 40.66 39.96 2qut h LEU 61 CO -0.06 0.08 -0.22 -0.07 -0.62 0.00 0.00 178.44 177.55 2qut h LEU 62 N 0.33 0.24 -1.37 2.25 3.38 -1.10 -3.29 115.31 115.74 2qut h LEU 62 Ca 0.28 -0.71 -0.05 0.00 0.09 0.00 0.00 57.88 57.49 2qut h LEU 62 Cb 0.37 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 2qut h LEU 62 CO -0.32 0.91 -0.14 -0.07 0.09 0.00 0.00 178.44 178.91 2qut h LEU 63 N -0.42 0.23 -3.13 1.67 3.38 -0.88 -2.99 115.31 113.18 2qut h LEU 63 Ca -0.02 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2qut h LEU 63 Cb 0.92 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.61 2qut h LEU 63 CO 0.04 0.40 0.00 0.35 0.09 0.00 0.00 178.44 179.32 2qut n THR 64 N -4.26 2.17 -1.23 0.22 -2.24 -0.35 -4.78 114.28 103.79 2qut n THR 64 Ca -0.01 -1.19 -0.35 0.00 -2.27 0.00 0.00 64.05 60.24 2qut n THR 64 Cb 0.28 -0.15 0.10 0.00 -2.10 0.00 0.00 70.33 68.46 2qut n THR 64 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qut n ALA 65 N 0.75 -0.28 -0.69 6.98 0.00 -1.13 -4.92 120.51 121.22 2qut n ALA 65 Ca 0.25 -0.26 -0.31 0.00 0.00 0.00 0.00 53.44 53.11 2qut n ALA 65 Cb 1.00 -2.15 0.16 0.00 0.00 0.00 0.00 19.45 18.46 2qut n ALA 65 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2qut n ASP 66 N -2.26 -0.97 0.00 0.00 5.68 -1.26 -4.82 116.55 112.93 2qut n ASP 66 Ca 0.13 0.28 0.00 0.00 -0.50 0.00 0.00 54.79 54.70 2qut n ASP 66 Cb 0.50 -1.32 0.00 0.00 -1.14 0.00 0.00 41.12 39.16 2qut n ASP 66 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2qut n ASP 67 N -3.10 0.00 0.26 -1.12 8.00 -1.26 -2.35 116.55 116.97 2qut n ASP 67 Ca 0.08 0.14 0.13 0.00 0.71 0.00 0.00 54.79 55.86 2qut n ASP 67 Cb 0.54 -0.14 0.67 0.00 -0.02 0.00 0.00 41.12 42.16 2qut n ASP 67 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 2qut h ARG 68 N 0.00 0.00 0.00 -1.24 3.08 -2.00 -2.70 114.38 111.52 2qut h ARG 68 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2qut h ARG 68 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.16 2qut h ARG 68 CO 0.00 0.13 -0.32 -0.39 -1.07 0.00 0.00 179.97 178.32 2qut h VAL 69 N 0.00 0.00 -0.49 2.04 -1.51 -1.79 -3.39 116.25 111.11 2qut h VAL 69 Ca -0.00 -0.85 0.09 0.00 -1.23 0.00 0.00 66.70 64.71 2qut h VAL 69 Cb 0.46 1.67 -0.10 0.00 -2.13 0.00 0.00 31.29 31.20 2qut h VAL 69 CO 0.02 0.00 -0.33 0.78 -1.23 0.00 0.00 177.57 176.81 2qut h ASN 70 N 0.00 -1.12 0.30 4.19 4.21 -1.70 0.24 115.58 121.70 2qut h ASN 70 Ca 0.00 0.21 0.00 0.00 1.21 0.00 0.00 56.30 57.72 2qut h ASN 70 Cb 0.92 0.54 0.00 0.00 -1.12 0.00 0.00 38.32 38.66 2qut h ASN 70 CO 0.00 -0.31 0.00 -0.81 -1.29 0.00 0.00 177.43 175.02 2qut n PRO 71 N -5.42 0.46 -0.06 0.81 -0.04 -1.26 -3.06 135.00 126.43 2qut n PRO 71 Ca 0.02 0.05 -0.06 0.00 -0.04 0.00 0.00 63.50 63.48 2qut n PRO 71 Cb 0.34 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.16 2qut n PRO 71 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qut s ILE 73 N -2.71 4.07 -0.20 0.00 -1.09 0.00 -1.36 121.20 119.91 2qut s ILE 73 Ca -0.08 -1.25 0.19 0.00 -2.23 0.00 0.00 60.65 57.28 2qut s ILE 73 Cb 0.08 -3.40 0.00 0.00 -1.58 0.00 0.00 42.46 37.55 2qut s ILE 73 CO 0.84 -0.35 1.10 1.23 -1.23 0.00 0.00 174.94 176.53 2qut h GLY 74 N 8.32 0.00 -3.42 6.18 0.00 -0.78 -3.37 103.07 110.00 2qut h GLY 74 Ca -0.23 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.06 2qut h GLY 74 CO 0.68 0.00 0.16 -0.32 0.00 0.00 0.00 176.54 177.06 2qut s GLY 75 N -4.53 -0.55 -0.08 4.60 0.00 -1.12 -0.74 107.32 104.91 2qut s GLY 75 Ca 0.00 0.72 0.00 0.00 0.00 0.00 0.00 44.72 45.45 2qut s GLY 75 CO 0.78 0.40 -0.06 0.14 0.00 0.00 0.00 173.10 174.36 2qut s VAL 76 N -2.75 0.76 -0.18 1.40 1.01 -0.66 -0.87 120.40 119.11 2qut s VAL 76 Ca -0.04 -0.17 -0.18 0.00 0.00 0.00 0.00 61.98 61.59 2qut s VAL 76 Cb -0.01 -0.80 -0.04 0.00 0.00 0.00 0.00 36.38 35.54 2qut s VAL 76 CO -0.04 0.31 0.48 -0.63 0.00 0.00 0.00 175.10 175.22 2qut s ILE 77 N 1.44 5.15 0.19 2.22 1.01 0.12 -0.62 121.20 130.70 2qut s ILE 77 Ca -0.02 0.90 0.09 0.00 0.00 0.00 0.00 60.65 61.63 2qut s ILE 77 Cb -0.13 -3.81 -0.04 0.00 0.01 0.00 0.00 42.46 38.48 2qut s ILE 77 CO -0.04 0.23 -0.08 -0.76 0.00 0.00 0.00 174.94 174.30 2qut s LEU 78 N 1.31 3.04 0.41 2.97 1.43 -0.12 -1.48 118.68 126.23 2qut s LEU 78 Ca 0.24 -0.56 -0.07 0.00 -1.03 0.00 0.00 54.13 52.70 2qut s LEU 78 Cb -0.15 -1.70 -0.05 0.00 0.03 0.00 0.00 46.19 44.31 2qut s LEU 78 CO 0.09 0.09 0.73 0.12 0.23 0.00 0.00 176.35 177.62 2qut s PHE 79 N -1.76 3.50 0.22 0.29 5.36 -1.26 -1.53 117.98 122.81 2qut s PHE 79 Ca 0.26 0.87 -0.16 0.00 -0.96 0.00 0.00 56.93 56.94 2qut s PHE 79 Cb -0.09 -2.31 0.24 0.00 -0.34 0.00 0.00 43.02 40.52 2qut s PHE 79 CO 0.16 -0.11 1.58 1.25 -1.46 0.00 0.00 175.22 176.65 2qut h HIS 80 N 0.96 -0.73 -0.43 10.12 6.17 -1.93 -2.10 115.15 127.22 2qut h HIS 80 Ca -0.47 0.08 0.09 0.00 0.71 0.00 0.00 60.37 60.77 2qut h HIS 80 Cb 1.19 0.43 -0.09 0.00 2.52 0.00 0.00 27.41 31.47 2qut h HIS 80 CO 0.59 -0.37 -0.22 1.49 0.71 0.00 0.00 177.93 180.13 2qut h GLU 81 N -0.06 -0.13 -0.47 5.26 4.81 -1.97 -2.59 114.58 119.43 2qut h GLU 81 Ca 0.32 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.53 2qut h GLU 81 Cb 0.58 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.96 2qut h GLU 81 CO -0.80 -0.09 0.17 1.15 -0.73 0.00 0.00 179.01 178.71 2qut h THR 82 N -0.14 1.18 -0.13 0.32 2.02 -1.77 -2.19 112.91 112.20 2qut h THR 82 Ca 0.20 -0.59 0.04 0.00 0.77 0.00 0.00 66.41 66.83 2qut h THR 82 Cb 0.45 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.51 2qut h THR 82 CO -0.51 0.23 0.13 0.25 0.37 0.00 0.00 175.52 175.99 2qut h LEU 83 N 0.67 0.00 -3.12 2.58 5.85 -1.22 -1.88 115.31 118.19 2qut h LEU 83 Ca 0.16 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.88 2qut h LEU 83 Cb 0.16 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.19 2qut h LEU 83 CO -0.01 0.00 0.00 -1.22 -0.34 0.00 0.00 178.44 176.87 2qut n TYR 84 N -3.90 0.89 -3.62 1.25 4.01 -0.83 -4.55 117.16 110.41 2qut n TYR 84 Ca 0.00 -0.70 -0.20 0.00 -0.16 0.00 0.00 57.90 56.84 2qut n TYR 84 Cb 0.24 -0.21 -0.01 0.00 -0.31 0.00 0.00 39.34 39.05 2qut n TYR 84 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 2qut s GLN 85 N -2.05 3.14 0.15 -0.72 -0.21 -0.71 -5.00 119.66 114.26 2qut s GLN 85 Ca 0.37 -0.99 0.08 0.00 0.02 0.00 0.00 55.36 54.84 2qut s GLN 85 Cb 0.27 -2.79 -0.04 0.00 1.00 0.00 0.00 33.01 31.44 2qut s GLN 85 CO 0.14 0.15 -0.19 0.15 -2.12 0.00 0.00 175.29 173.42 2qut s LYS 86 N -4.11 1.24 0.90 2.91 1.02 -1.26 -1.44 119.74 119.00 2qut s LYS 86 Ca 0.42 -1.36 -0.12 0.00 0.02 0.00 0.00 55.97 54.93 2qut s LYS 86 Cb -0.09 -1.32 0.13 0.00 -0.52 0.00 0.00 37.83 36.03 2qut s LYS 86 CO 0.30 0.28 1.13 0.00 -0.92 0.00 0.00 175.35 176.14 2qut s ALA 87 N -1.89 1.78 0.46 5.17 0.00 0.63 -4.86 121.76 123.05 2qut s ALA 87 Ca 0.14 -0.49 0.19 0.00 0.00 0.00 0.00 51.96 51.80 2qut s ALA 87 Cb -0.06 -3.04 1.17 0.00 0.00 0.00 0.00 23.12 21.18 2qut s ALA 87 CO 0.06 -2.26 1.93 -0.44 0.00 0.00 0.00 175.76 175.05 2qut h ASP 88 N -1.48 0.27 0.00 0.00 3.32 -1.99 0.81 116.42 117.35 2qut h ASP 88 Ca -0.50 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.56 2qut h ASP 88 Cb 1.33 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.84 2qut h ASP 88 CO 0.62 0.14 0.00 -0.90 -1.72 0.00 0.00 179.24 177.37 2qut n ASP 89 N -4.44 0.00 0.00 6.45 5.68 -1.26 -4.87 116.55 118.11 2qut n ASP 89 Ca 0.14 -1.45 0.00 0.00 -0.50 0.00 0.00 54.79 52.97 2qut n ASP 89 Cb 0.59 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.57 2qut n ASP 89 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2qut n GLY 90 N 0.70 1.19 3.72 6.12 0.00 0.28 -5.04 105.19 112.15 2qut n GLY 90 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2qut n GLY 90 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qut s ARG 91 N -0.40 4.56 0.48 1.61 0.52 -1.26 -4.73 118.95 119.74 2qut s ARG 91 Ca 0.00 1.58 -0.24 0.00 -0.52 0.00 0.00 55.73 56.55 2qut s ARG 91 Cb 0.00 -3.38 -0.07 0.00 0.52 0.00 0.00 34.95 32.02 2qut s ARG 91 CO 0.00 -0.02 1.34 -2.14 0.02 0.00 0.00 175.30 174.50 2qut s PRO 92 N 0.52 3.55 0.33 3.54 0.02 -1.26 -0.26 135.00 141.44 2qut s PRO 92 Ca 0.52 2.21 0.07 0.00 0.02 0.00 0.00 61.00 63.82 2qut s PRO 92 Cb -0.25 -2.50 0.74 0.00 0.02 0.00 0.00 34.50 32.51 2qut s PRO 92 CO 0.30 -0.85 1.85 0.74 -0.33 0.00 0.00 177.00 178.71 2qut h PHE 93 N 2.05 0.94 -0.79 6.54 0.04 -1.51 -0.57 116.94 123.64 2qut h PHE 93 Ca -0.50 0.03 0.05 0.00 2.80 0.00 0.00 57.97 60.34 2qut h PHE 93 Cb 1.27 -0.29 -0.05 0.00 2.20 0.00 0.00 35.95 39.08 2qut h PHE 93 CO 0.50 0.33 0.52 -1.35 -0.60 0.00 0.00 178.31 177.70 2qut h PRO 94 N 0.78 0.89 -0.50 1.51 0.11 -1.85 -0.77 132.00 132.17 2qut h PRO 94 Ca 0.48 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 66.41 2qut h PRO 94 Cb 0.69 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.59 2qut h PRO 94 CO -0.24 0.59 -0.16 0.37 -0.21 0.00 0.00 178.00 178.34 2qut h GLN 95 N 0.92 1.00 -0.09 1.05 4.15 -1.47 -1.00 115.11 119.66 2qut h GLN 95 Ca 0.32 -0.40 0.02 0.00 0.77 0.00 0.00 58.65 59.36 2qut h GLN 95 Cb 0.12 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.75 2qut h GLN 95 CO -0.10 1.08 -0.03 0.28 -1.93 0.00 0.00 178.83 178.13 2qut h VAL 96 N 0.86 0.90 -0.19 2.39 2.07 -0.73 0.09 116.25 121.64 2qut h VAL 96 Ca 0.12 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.64 2qut h VAL 96 Cb 0.74 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 2qut h VAL 96 CO 0.06 0.00 0.11 0.40 0.02 0.00 0.00 177.57 178.16 2qut h ILE 97 N -0.01 1.08 -0.74 4.57 2.04 -1.06 -2.82 117.51 120.56 2qut h ILE 97 Ca 0.04 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.73 2qut h ILE 97 Cb 0.08 0.86 -0.04 0.00 -0.74 0.00 0.00 36.82 36.98 2qut h ILE 97 CO -0.10 0.07 0.48 0.11 0.00 0.00 0.00 178.15 178.72 2qut h LYS 98 N 0.23 0.99 0.00 2.37 1.57 -0.96 -0.75 116.57 120.01 2qut h LYS 98 Ca 0.07 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2qut h LYS 98 Cb 0.02 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.11 2qut h LYS 98 CO -0.01 0.66 -0.03 0.66 -0.57 0.00 0.00 179.45 180.16 2qut h SER 99 N 1.01 0.00 -0.57 0.86 4.64 -0.80 -0.13 113.55 118.57 2qut h SER 99 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 2qut h SER 99 Cb -0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 61.99 2qut h SER 99 CO -0.06 0.03 0.00 0.29 -0.87 0.00 0.00 176.83 176.22 2qut n LYS 100 N -3.32 2.52 -0.82 4.77 5.02 -0.77 -4.92 118.16 120.65 2qut n LYS 100 Ca -0.02 -2.12 0.00 0.00 -2.02 0.00 0.00 58.31 54.15 2qut n LYS 100 Cb 0.16 -1.52 0.00 0.00 -0.02 0.00 0.00 35.03 33.66 2qut n LYS 100 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qut n GLY 101 N 1.32 0.66 3.89 0.72 0.00 -0.06 -4.55 105.19 107.17 2qut n GLY 101 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 2qut n GLY 101 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2qut s GLY 102 N -1.96 2.27 0.18 -0.02 0.00 -0.36 -4.81 107.32 102.62 2qut s GLY 102 Ca 0.00 -0.53 -0.21 0.00 0.00 0.00 0.00 44.72 43.98 2qut s GLY 102 CO 0.00 -0.38 0.70 0.14 0.00 0.00 0.00 173.10 173.56 2qut s VAL 103 N -1.44 4.57 -0.13 1.40 1.01 0.08 -3.40 120.40 122.49 2qut s VAL 103 Ca 0.33 1.35 -0.18 0.00 0.00 0.00 0.00 61.98 63.48 2qut s VAL 103 Cb -0.13 -3.93 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 2qut s VAL 103 CO 0.20 0.35 0.45 -0.69 0.00 0.00 0.00 175.10 175.41 2qut s VAL 104 N -1.36 5.20 0.25 2.92 1.01 -1.26 -1.66 120.40 125.50 2qut s VAL 104 Ca 0.38 0.90 0.12 0.00 0.00 0.00 0.00 61.98 63.38 2qut s VAL 104 Cb -0.19 -3.79 -0.05 0.00 0.00 0.00 0.00 36.38 32.35 2qut s VAL 104 CO 0.22 0.32 -0.20 -0.83 0.00 0.00 0.00 175.10 174.61 2qut s GLY 105 N 0.65 1.82 -0.04 4.51 0.00 0.21 -0.22 107.32 114.26 2qut s GLY 105 Ca 0.24 -1.78 0.01 0.00 0.00 0.00 0.00 44.72 43.19 2qut s GLY 105 CO 0.09 -1.85 -0.02 -1.50 0.00 0.00 0.00 173.10 169.82 2qut s ILE 106 N -2.22 0.33 0.05 0.90 1.10 -0.39 -0.95 121.20 120.02 2qut s ILE 106 Ca 0.27 -0.01 -0.30 0.00 -0.51 0.00 0.00 60.65 60.10 2qut s ILE 106 Cb -0.06 -0.40 -0.05 0.00 0.15 0.00 0.00 42.46 42.10 2qut s ILE 106 CO 0.14 0.18 1.10 -0.75 -2.11 0.00 0.00 174.94 173.50 2qut s LYS 107 N 0.96 4.50 0.00 3.50 2.36 -0.58 -1.85 119.74 128.64 2qut s LYS 107 Ca -0.11 1.62 0.01 0.00 -2.55 0.00 0.00 55.97 54.94 2qut s LYS 107 Cb -0.14 -3.39 -0.00 0.00 -1.05 0.00 0.00 37.83 33.25 2qut s LYS 107 CO -0.01 -0.14 0.24 1.33 1.55 0.00 0.00 175.35 178.33 2qut n VAL 108 N 3.77 0.00 -1.57 4.02 0.24 -0.37 -4.60 118.33 119.81 2qut n VAL 108 Ca 0.07 -0.49 -0.31 0.00 -2.04 0.00 0.00 64.34 61.57 2qut n VAL 108 Cb 0.48 1.01 0.06 0.00 -1.47 0.00 0.00 33.84 33.92 2qut n VAL 108 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 2qut s ASP 109 N -0.63 5.07 -0.36 -1.34 1.47 -1.25 -4.85 116.67 114.77 2qut s ASP 109 Ca 0.01 1.50 0.06 0.00 1.18 0.00 0.00 52.55 55.29 2qut s ASP 109 Cb 0.01 -2.33 0.46 0.00 -0.34 0.00 0.00 42.92 40.72 2qut s ASP 109 CO 0.02 -1.63 1.40 0.29 0.68 0.00 0.00 175.17 175.93 2qut n LYS 110 N -3.24 3.07 0.00 2.11 5.02 0.55 -4.96 118.16 120.72 2qut n LYS 110 Ca 0.07 -3.81 0.00 0.00 -2.02 0.00 0.00 58.31 52.55 2qut n LYS 110 Cb 0.55 -2.18 0.00 0.00 -0.02 0.00 0.00 35.03 33.38 2qut n LYS 110 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qut n GLY 111 N -0.83 -1.47 3.89 0.72 0.00 -1.26 -4.69 105.19 101.55 2qut n GLY 111 Ca 0.45 -1.57 -0.29 0.00 0.00 0.00 0.00 46.02 44.62 2qut n GLY 111 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qut s VAL 112 N -1.81 4.84 0.01 1.61 -7.23 -1.26 -1.68 120.40 114.88 2qut s VAL 112 Ca 0.00 0.42 -0.02 0.00 -1.81 0.00 0.00 61.98 60.57 2qut s VAL 112 Cb 0.00 -3.84 -0.01 0.00 0.56 0.00 0.00 36.38 33.09 2qut s VAL 112 CO 0.00 -0.83 0.03 0.68 -0.31 0.00 0.00 175.10 174.67 2qut s VAL 113 N -2.74 0.09 0.28 1.32 -7.23 -0.34 -4.87 120.40 106.91 2qut s VAL 113 Ca 0.50 -0.72 -0.29 0.00 -1.81 0.00 0.00 61.98 59.65 2qut s VAL 113 Cb -0.10 -0.28 -0.10 0.00 0.56 0.00 0.00 36.38 36.45 2qut s VAL 113 CO 0.43 -0.40 1.30 -2.16 -0.31 0.00 0.00 175.10 173.97 2qut s PRO 114 N -1.23 4.38 -0.43 4.82 0.04 -1.26 -1.39 135.00 139.93 2qut s PRO 114 Ca -0.13 2.14 -0.18 0.00 0.04 0.00 0.00 61.00 62.86 2qut s PRO 114 Cb -0.08 -3.12 0.02 0.00 0.04 0.00 0.00 34.50 31.36 2qut s PRO 114 CO -0.00 -0.20 0.51 -0.51 0.04 0.00 0.00 177.00 176.84 2qut s LEU 115 N -1.11 4.76 0.49 -3.56 1.43 0.22 -4.83 118.68 116.08 2qut s LEU 115 Ca 0.52 -0.59 -0.24 0.00 -1.03 0.00 0.00 54.13 52.79 2qut s LEU 115 Cb -0.38 -2.49 -0.07 0.00 0.03 0.00 0.00 46.19 43.27 2qut s LEU 115 CO 0.46 -0.65 1.42 0.00 0.23 0.00 0.00 176.35 177.81 2qut s ALA 116 N 2.36 3.09 0.00 4.21 0.00 -1.26 -2.61 121.76 127.54 2qut s ALA 116 Ca 0.15 1.45 0.00 0.00 0.00 0.00 0.00 51.96 53.56 2qut s ALA 116 Cb -0.16 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.36 2qut s ALA 116 CO 0.15 -1.30 0.00 0.41 0.00 0.00 0.00 175.76 175.02 2qut n GLY 117 N 0.63 0.70 3.69 0.00 0.00 -1.26 -5.04 105.19 103.91 2qut n GLY 117 Ca 0.07 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.83 2qut n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qut s THR 118 N -2.54 2.12 -1.22 2.61 -4.23 -1.07 -5.05 115.64 106.26 2qut s THR 118 Ca 0.00 -1.83 -0.11 0.00 -1.18 0.00 0.00 61.69 58.57 2qut s THR 118 Cb 0.00 -2.95 0.19 0.00 1.34 0.00 0.00 72.50 71.08 2qut s THR 118 CO 0.00 0.00 1.55 -3.20 -0.54 0.00 0.00 174.62 172.43 2qut n ASN 119 N -1.14 5.29 -0.91 3.99 5.15 -1.26 -4.51 115.26 121.88 2qut n ASN 119 Ca -0.03 -3.06 -0.11 0.00 -0.60 0.00 0.00 54.58 50.78 2qut n ASN 119 Cb 0.66 -1.50 -0.04 0.00 -0.53 0.00 0.00 39.78 38.36 2qut n ASN 119 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2qut n GLY 120 N 3.36 1.01 3.91 8.20 0.00 -1.26 -4.99 105.19 115.41 2qut n GLY 120 Ca 0.36 -0.51 -0.27 0.00 0.00 0.00 0.00 46.02 45.60 2qut n GLY 120 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qut s GLU 121 N -3.20 3.55 0.22 1.61 2.02 -1.26 -4.96 118.70 116.68 2qut s GLU 121 Ca 0.00 0.17 0.01 0.00 0.02 0.00 0.00 54.97 55.18 2qut s GLU 121 Cb 0.00 -2.40 -0.05 0.00 0.10 0.00 0.00 34.13 31.79 2qut s GLU 121 CO 0.00 -0.17 0.06 0.95 0.02 0.00 0.00 175.26 176.11 2qut s THR 122 N -2.70 0.58 0.27 3.63 -4.23 -1.26 -0.61 115.64 111.32 2qut s THR 122 Ca 0.47 -1.99 0.02 0.00 -1.18 0.00 0.00 61.69 59.01 2qut s THR 122 Cb -0.10 -2.42 -0.01 0.00 1.34 0.00 0.00 72.50 71.31 2qut s THR 122 CO 0.44 -0.20 0.09 1.07 -0.54 0.00 0.00 174.62 175.48 2qut n THR 123 N -0.36 0.00 -4.82 3.99 5.66 -0.48 -4.79 114.28 113.47 2qut n THR 123 Ca -0.03 -1.52 -0.25 0.00 -3.05 0.00 0.00 64.05 59.21 2qut n THR 123 Cb 0.65 0.53 -0.15 0.00 -1.55 0.00 0.00 70.33 69.81 2qut n THR 123 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 2qut s THR 124 N -2.50 1.38 0.40 1.09 2.01 -1.26 -1.19 115.64 115.56 2qut s THR 124 Ca 0.12 -0.76 0.08 0.00 0.31 0.00 0.00 61.69 61.44 2qut s THR 124 Cb 0.01 -1.15 -0.02 0.00 0.01 0.00 0.00 72.50 71.35 2qut s THR 124 CO 0.09 0.38 0.38 0.00 -0.69 0.00 0.00 174.62 174.77 2qut s GLN 125 N -0.45 2.59 0.00 4.92 -2.07 -0.67 -4.90 119.66 119.08 2qut s GLN 125 Ca 0.07 -1.47 0.00 0.00 -1.82 0.00 0.00 55.36 52.14 2qut s GLN 125 Cb -0.07 -2.43 0.00 0.00 -1.09 0.00 0.00 33.01 29.42 2qut s GLN 125 CO -0.01 -0.14 0.00 0.41 -1.32 0.00 0.00 175.29 174.23 2qut n GLY 126 N -1.54 -0.34 0.18 2.60 0.00 -1.26 -0.33 105.19 104.50 2qut n GLY 126 Ca 0.03 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.11 2qut n GLY 126 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2qut h LEU 127 N 0.00 0.00 -9.40 0.99 3.38 -1.90 -3.41 115.31 104.97 2qut h LEU 127 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 2qut h LEU 127 Cb 0.00 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.77 2qut h LEU 127 CO 0.00 0.33 1.14 -1.81 0.09 0.00 0.00 178.44 178.19 2qut s ASP 128 N -6.34 6.51 -0.59 -0.43 1.01 -1.26 -1.46 116.67 114.11 2qut s ASP 128 Ca 0.04 2.59 0.00 0.00 0.71 0.00 0.00 52.55 55.89 2qut s ASP 128 Cb 0.08 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.46 2qut s ASP 128 CO 0.70 -0.99 0.00 0.61 0.21 0.00 0.00 175.17 175.70 2qut n GLY 129 N 4.29 0.67 0.33 0.21 0.00 -1.26 -4.89 105.19 104.55 2qut n GLY 129 Ca 0.18 -0.13 -0.01 0.00 0.00 0.00 0.00 46.02 46.06 2qut n GLY 129 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2qut h LEU 130 N 0.00 0.87 -0.31 0.99 5.85 -1.48 -2.00 115.31 119.23 2qut h LEU 130 Ca -0.11 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.52 2qut h LEU 130 Cb 0.79 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 2qut h LEU 130 CO 0.17 0.72 0.16 -1.28 -0.34 0.00 0.00 178.44 177.87 2qut h SER 131 N 0.97 0.39 -0.92 1.25 0.87 -1.90 0.37 113.55 114.58 2qut h SER 131 Ca 0.24 -0.10 -0.01 0.00 -1.23 0.00 0.00 61.79 60.69 2qut h SER 131 Cb 0.06 -0.10 -0.04 0.00 -0.44 0.00 0.00 62.40 61.88 2qut h SER 131 CO -0.04 0.37 0.52 -0.33 -0.53 0.00 0.00 176.83 176.83 2qut h GLU 132 N 0.38 1.27 -0.70 2.24 3.07 -1.91 -0.76 114.58 118.17 2qut h GLU 132 Ca 0.11 -0.14 -0.06 0.00 -0.50 0.00 0.00 59.36 58.77 2qut h GLU 132 Cb 0.07 -0.26 -0.03 0.00 -0.84 0.00 0.00 28.75 27.70 2qut h GLU 132 CO -0.02 0.92 0.18 0.00 -1.40 0.00 0.00 179.01 178.69 2qut h ARG 133 N 1.28 1.11 -0.49 2.33 3.08 -0.91 -1.78 114.38 119.01 2qut h ARG 133 Ca 0.33 -0.26 -0.12 0.00 0.07 0.00 0.00 59.98 60.00 2qut h ARG 133 Cb -0.00 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 29.88 2qut h ARG 133 CO -0.06 0.97 -0.16 0.00 -1.07 0.00 0.00 179.97 179.66 2qut h ALA 135 N 0.88 0.85 -0.28 0.00 0.00 -0.97 0.79 119.26 120.53 2qut h ALA 135 Ca 0.12 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 2qut h ALA 135 Cb 0.73 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2qut h ALA 135 CO 0.06 0.28 -0.07 0.37 0.00 0.00 0.00 179.25 179.89 2qut h GLN 136 N 0.91 0.55 -0.71 0.00 5.75 -1.10 -2.19 115.11 118.32 2qut h GLN 136 Ca 0.25 -0.21 -0.03 0.00 -0.15 0.00 0.00 58.65 58.51 2qut h GLN 136 Cb -0.11 -0.03 -0.03 0.00 1.07 0.00 0.00 27.48 28.38 2qut h GLN 136 CO -0.05 0.75 0.34 1.88 -2.65 0.00 0.00 178.83 179.10 2qut h TYR 137 N 0.31 1.03 0.15 3.99 0.05 -0.55 0.10 116.97 122.05 2qut h TYR 137 Ca 0.07 -0.05 0.01 0.00 0.05 0.00 0.00 58.73 58.81 2qut h TYR 137 Cb 0.55 -0.32 -0.03 0.00 1.01 0.00 0.00 36.73 37.94 2qut h TYR 137 CO 0.05 0.77 -0.23 -0.22 -1.05 0.00 0.00 178.16 177.48 2qut h LYS 138 N 1.00 -0.43 -0.63 4.88 1.63 -0.78 -0.80 116.57 121.44 2qut h LYS 138 Ca 0.25 0.03 0.07 0.00 -0.85 0.00 0.00 60.65 60.15 2qut h LYS 138 Cb 0.13 0.10 -0.04 0.00 -0.60 0.00 0.00 32.23 31.81 2qut h LYS 138 CO -0.03 -0.29 0.42 -0.22 -3.45 0.00 0.00 179.45 175.88 2qut h LYS 139 N -0.44 0.56 -0.78 1.90 3.64 -1.09 -1.83 116.57 118.53 2qut h LYS 139 Ca 0.02 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2qut h LYS 139 Cb 0.45 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.14 2qut h LYS 139 CO -0.11 0.37 0.00 -0.25 -2.27 0.00 0.00 179.45 177.20 2qut n ASP 140 N -4.48 2.81 0.00 4.20 8.00 -0.00 -4.89 116.55 122.19 2qut n ASP 140 Ca 0.09 -2.34 0.00 0.00 0.71 0.00 0.00 54.79 53.25 2qut n ASP 140 Cb 0.27 -0.54 0.00 0.00 -0.02 0.00 0.00 41.12 40.83 2qut n ASP 140 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2qut n GLY 141 N 0.32 0.42 3.81 0.44 0.00 -0.69 -4.95 105.19 104.55 2qut n GLY 141 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 2qut n GLY 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qut s ALA 142 N -2.00 3.60 -0.12 4.61 0.00 -0.42 -4.43 121.76 122.99 2qut s ALA 142 Ca 0.00 0.01 0.03 0.00 0.00 0.00 0.00 51.96 51.99 2qut s ALA 142 Cb 0.00 -2.61 -0.03 0.00 0.00 0.00 0.00 23.12 20.48 2qut s ALA 142 CO 0.00 0.40 0.11 -0.25 0.00 0.00 0.00 175.76 176.03 2qut n ASP 143 N 1.75 0.28 -4.08 0.00 8.00 0.70 -3.91 116.55 119.29 2qut n ASP 143 Ca -0.11 -0.54 -0.10 0.00 0.71 0.00 0.00 54.79 54.75 2qut n ASP 143 Cb 0.51 1.00 -0.09 0.00 -0.02 0.00 0.00 41.12 42.53 2qut n ASP 143 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2qut s PHE 144 N -1.28 0.70 0.26 1.24 -0.71 -1.14 -1.02 117.98 116.02 2qut s PHE 144 Ca 0.01 -1.06 0.02 0.00 -1.04 0.00 0.00 56.93 54.85 2qut s PHE 144 Cb 0.02 -0.32 -0.04 0.00 -1.21 0.00 0.00 43.02 41.47 2qut s PHE 144 CO 0.11 -0.61 0.15 0.00 -1.34 0.00 0.00 175.22 173.53 2qut s ALA 145 N -4.03 1.61 -0.00 1.99 0.00 -0.17 -1.26 121.76 119.90 2qut s ALA 145 Ca 0.23 -1.79 0.00 0.00 0.00 0.00 0.00 51.96 50.40 2qut s ALA 145 Cb 0.06 1.25 0.00 0.00 0.00 0.00 0.00 23.12 24.43 2qut s ALA 145 CO 0.02 -0.54 -0.01 0.21 0.00 0.00 0.00 175.76 175.44 2qut s LYS 146 N -3.95 0.08 -0.05 0.00 2.20 -0.77 -1.27 119.74 115.98 2qut s LYS 146 Ca 0.38 -0.01 -0.01 0.00 -0.36 0.00 0.00 55.97 55.97 2qut s LYS 146 Cb 0.06 -0.11 0.03 0.00 -1.51 0.00 0.00 37.83 36.30 2qut s LYS 146 CO 0.16 -0.00 0.01 -0.46 -0.36 0.00 0.00 175.35 174.70 2qut s TRP 147 N 0.11 0.38 -0.21 4.03 -0.11 -1.22 -1.24 118.94 120.69 2qut s TRP 147 Ca -0.01 0.00 -0.05 0.00 1.22 0.00 0.00 56.10 57.26 2qut s TRP 147 Cb -0.02 -0.56 -0.02 0.00 -1.50 0.00 0.00 33.47 31.37 2qut s TRP 147 CO -0.00 -0.21 0.01 0.50 -4.62 0.00 0.00 176.95 172.62 2qut s ARG 148 N 1.60 3.60 0.04 5.86 3.52 -1.26 -2.64 118.95 129.67 2qut s ARG 148 Ca -0.01 -0.52 0.04 0.00 -0.13 0.00 0.00 55.73 55.10 2qut s ARG 148 Cb -0.13 -3.11 -0.04 0.00 -1.56 0.00 0.00 34.95 30.11 2qut s ARG 148 CO -0.03 -0.04 -0.02 0.00 -0.81 0.00 0.00 175.30 174.40 2qut s VAL 150 N -1.17 1.38 0.17 0.00 1.01 -1.26 -1.33 120.40 119.20 2qut s VAL 150 Ca 0.22 -0.58 0.10 0.00 0.00 0.00 0.00 61.98 61.71 2qut s VAL 150 Cb -0.11 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 2qut s VAL 150 CO 0.13 0.41 -0.21 -0.76 0.00 0.00 0.00 175.10 174.67 2qut s LEU 151 N 0.89 2.42 -0.01 3.92 1.43 0.47 -4.48 118.68 123.32 2qut s LEU 151 Ca -0.09 -0.84 0.04 0.00 -1.03 0.00 0.00 54.13 52.21 2qut s LEU 151 Cb -0.15 -0.99 -0.01 0.00 0.03 0.00 0.00 46.19 45.07 2qut s LEU 151 CO 0.00 0.05 -0.13 -0.75 0.23 0.00 0.00 176.35 175.75 2qut s LYS 152 N -2.61 1.06 -0.22 1.70 2.20 -1.26 -1.05 119.74 119.56 2qut s LYS 152 Ca 0.17 -0.45 -0.21 0.00 -0.36 0.00 0.00 55.97 55.12 2qut s LYS 152 Cb -0.07 -1.02 -0.02 0.00 -1.51 0.00 0.00 37.83 35.21 2qut s LYS 152 CO 0.08 0.26 0.65 0.42 -0.36 0.00 0.00 175.35 176.39 2qut s ILE 153 N -0.25 4.99 0.00 5.43 1.01 -1.26 -2.42 121.20 128.70 2qut s ILE 153 Ca 0.04 1.20 0.00 0.00 0.00 0.00 0.00 60.65 61.89 2qut s ILE 153 Cb -0.05 -3.96 0.00 0.00 0.01 0.00 0.00 42.46 38.46 2qut s ILE 153 CO -0.00 0.07 0.00 0.61 0.00 0.00 0.00 174.94 175.61 2qut n GLY 154 N 3.92 3.46 0.26 6.18 0.00 -0.42 -4.81 105.19 113.77 2qut n GLY 154 Ca -0.00 -1.10 -0.06 0.00 0.00 0.00 0.00 46.02 44.85 2qut n GLY 154 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2qut h GLU 155 N 0.00 0.72 0.00 1.61 4.81 -2.00 -3.27 114.58 116.45 2qut h GLU 155 Ca 0.00 -0.27 0.00 0.00 -0.13 0.00 0.00 59.36 58.96 2qut h GLU 155 Cb 0.00 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.34 2qut h GLU 155 CO 0.00 0.86 0.00 0.72 -0.73 0.00 0.00 179.01 179.86 2qut n HIS 156 N -4.13 0.00 -4.25 0.92 8.25 -1.26 -5.05 115.22 109.70 2qut n HIS 156 Ca 0.00 -0.47 -0.19 0.00 -0.26 0.00 0.00 57.72 56.80 2qut n HIS 156 Cb 0.41 -0.05 -0.11 0.00 1.12 0.00 0.00 29.99 31.36 2qut n HIS 156 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2qut s THR 157 N -0.94 1.41 0.14 1.59 -4.23 -1.23 -3.47 115.64 108.90 2qut s THR 157 Ca 0.00 -1.67 -0.30 0.00 -1.18 0.00 0.00 61.69 58.53 2qut s THR 157 Cb 0.00 -1.52 -0.07 0.00 1.34 0.00 0.00 72.50 72.25 2qut s THR 157 CO 0.00 -0.34 1.24 -2.84 -0.54 0.00 0.00 174.62 172.14 2qut s PRO 158 N -2.49 4.43 0.79 3.99 0.02 -1.02 -1.31 135.00 139.42 2qut s PRO 158 Ca 0.08 1.90 -0.12 0.00 0.02 0.00 0.00 61.00 62.89 2qut s PRO 158 Cb -0.06 -3.26 0.07 0.00 0.02 0.00 0.00 34.50 31.26 2qut s PRO 158 CO 0.03 -0.22 1.11 -1.54 -0.33 0.00 0.00 177.00 176.06 2qut s SER 159 N 0.58 4.56 0.23 2.53 1.04 -1.23 -4.84 113.70 116.59 2qut s SER 159 Ca 0.57 1.17 -0.06 0.00 0.48 0.00 0.00 55.95 58.11 2qut s SER 159 Cb -0.33 -1.88 0.30 0.00 0.10 0.00 0.00 66.02 64.22 2qut s SER 159 CO 0.34 -1.91 1.85 0.00 0.98 0.00 0.00 173.24 174.50 2qut h ALA 160 N -1.05 1.12 0.08 5.32 0.00 -2.00 -1.48 119.26 121.26 2qut h ALA 160 Ca -0.47 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.43 2qut h ALA 160 Cb 1.28 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.85 2qut h ALA 160 CO 0.61 0.25 -0.04 1.25 0.00 0.00 0.00 179.25 181.33 2qut h LEU 161 N 0.94 -0.09 -0.58 0.00 5.85 -1.99 -0.70 115.31 118.74 2qut h LEU 161 Ca 0.36 -0.11 0.07 0.00 0.84 0.00 0.00 57.88 59.03 2qut h LEU 161 Cb 0.15 0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.14 2qut h LEU 161 CO -0.16 0.05 0.26 0.00 -0.34 0.00 0.00 178.44 178.25 2qut h ALA 162 N 0.68 0.75 0.18 1.25 0.00 -1.87 0.22 119.26 120.47 2qut h ALA 162 Ca -0.01 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2qut h ALA 162 Cb 0.20 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2qut h ALA 162 CO 0.02 -0.11 -0.09 0.82 0.00 0.00 0.00 179.25 179.89 2qut h ILE 163 N 0.49 0.89 0.25 0.00 2.04 -1.16 -1.30 117.51 118.72 2qut h ILE 163 Ca 0.27 -0.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.82 2qut h ILE 163 Cb 0.25 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 2qut h ILE 163 CO -0.23 0.07 -0.17 -0.03 0.00 0.00 0.00 178.15 177.79 2qut h MET 164 N -0.39 -0.41 -0.38 2.37 4.05 -0.73 -1.42 114.93 118.02 2qut h MET 164 Ca -0.02 0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.43 2qut h MET 164 Cb 0.30 0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 31.17 2qut h MET 164 CO 0.04 -0.27 0.25 1.49 0.23 0.00 0.00 176.91 178.65 2qut h GLU 165 N -0.42 0.50 -0.42 0.39 4.57 -0.61 -0.16 114.58 118.44 2qut h GLU 165 Ca -0.02 -0.03 -0.08 0.00 -1.18 0.00 0.00 59.36 58.04 2qut h GLU 165 Cb 0.36 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 28.82 2qut h GLU 165 CO 0.01 0.34 -0.08 -0.91 -1.18 0.00 0.00 179.01 177.19 2qut h ASN 166 N 0.51 0.71 -0.46 1.04 2.35 -1.20 -0.98 115.58 117.55 2qut h ASN 166 Ca 0.14 -0.19 -0.09 0.00 -0.55 0.00 0.00 56.30 55.60 2qut h ASN 166 Cb -0.05 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.11 2qut h ASN 166 CO -0.03 0.83 -0.06 0.00 -1.65 0.00 0.00 177.43 176.52 2qut h ALA 167 N 1.24 0.94 -0.25 -0.83 0.00 -0.93 -2.31 119.26 117.13 2qut h ALA 167 Ca 0.12 -0.31 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 2qut h ALA 167 Cb 0.53 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2qut h ALA 167 CO 0.03 0.63 -0.03 -0.97 0.00 0.00 0.00 179.25 178.91 2qut h ASN 168 N 0.82 0.45 -0.40 0.00 -1.24 -0.47 -2.32 115.58 112.43 2qut h ASN 168 Ca 0.14 -0.34 -0.07 0.00 0.71 0.00 0.00 56.30 56.74 2qut h ASN 168 Cb 0.57 -0.12 -0.02 0.00 0.73 0.00 0.00 38.32 39.47 2qut h ASN 168 CO 0.03 0.68 0.01 1.62 -1.29 0.00 0.00 177.43 178.48 2qut h VAL 169 N 0.21 1.24 -0.75 2.57 3.04 -1.16 -1.71 116.25 119.69 2qut h VAL 169 Ca 0.07 -0.98 -0.01 0.00 -1.01 0.00 0.00 66.70 64.76 2qut h VAL 169 Cb 0.47 0.87 -0.04 0.00 -2.01 0.00 0.00 31.29 30.58 2qut h VAL 169 CO 0.02 0.35 0.44 -0.07 -1.01 0.00 0.00 177.57 177.29 2qut h LEU 170 N 0.73 0.92 -0.50 3.16 3.38 -1.34 -0.28 115.31 121.38 2qut h LEU 170 Ca 0.14 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 2qut h LEU 170 Cb 0.44 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 2qut h LEU 170 CO 0.02 0.73 0.21 0.00 0.09 0.00 0.00 178.44 179.49 2qut h ALA 171 N 1.23 0.64 -0.45 1.53 0.00 -0.86 0.54 119.26 121.90 2qut h ALA 171 Ca 0.27 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2qut h ALA 171 Cb -0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2qut h ALA 171 CO -0.05 0.23 0.28 0.00 0.00 0.00 0.00 179.25 179.71 2qut h ARG 172 N 0.66 0.60 -0.47 0.00 2.47 -0.93 0.41 114.38 117.13 2qut h ARG 172 Ca 0.17 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.84 2qut h ARG 172 Cb 0.17 -0.13 -0.02 0.00 -1.65 0.00 0.00 29.97 28.33 2qut h ARG 172 CO -0.02 0.44 0.31 -0.92 0.56 0.00 0.00 179.97 180.33 2qut h TYR 173 N 0.60 0.60 -0.70 3.04 3.20 -0.76 -1.66 116.97 121.29 2qut h TYR 173 Ca 0.16 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.98 2qut h TYR 173 Cb -0.02 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.02 2qut h TYR 173 CO -0.03 0.38 0.19 0.00 -1.64 0.00 0.00 178.16 177.06 2qut h ALA 174 N 1.16 0.91 -0.05 1.82 0.00 -0.54 -1.89 119.26 120.68 2qut h ALA 174 Ca 0.17 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2qut h ALA 174 Cb -0.06 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.46 2qut h ALA 174 CO -0.04 0.62 0.03 1.03 0.00 0.00 0.00 179.25 180.89 2qut h SER 175 N 1.04 0.06 -0.73 0.00 0.87 -0.62 -1.86 113.55 112.31 2qut h SER 175 Ca 0.22 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 2qut h SER 175 Cb 0.34 -0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 62.25 2qut h SER 175 CO -0.00 0.14 0.46 0.40 -0.53 0.00 0.00 176.83 177.30 2qut h ILE 176 N -0.02 1.20 -0.19 2.23 2.04 -1.20 -2.66 117.51 118.91 2qut h ILE 176 Ca 0.02 -0.41 0.03 0.00 1.00 0.00 0.00 64.86 65.49 2qut h ILE 176 Cb 0.09 0.16 -0.03 0.00 -0.74 0.00 0.00 36.82 36.31 2qut h ILE 176 CO -0.00 0.20 0.03 0.00 0.00 0.00 0.00 178.15 178.38 2qut h GLN 178 N 0.10 0.00 0.00 0.00 4.20 -1.14 -0.65 115.11 117.62 2qut h GLN 178 Ca 0.09 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.80 2qut h GLN 178 Cb 0.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.87 2qut h GLN 178 CO -0.13 0.16 0.00 1.96 -0.67 0.00 0.00 178.83 180.15 2qut h GLN 179 N 0.00 0.00 -0.15 1.46 1.08 -1.13 -3.04 115.11 113.32 2qut h GLN 179 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2qut h GLN 179 Cb 0.38 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.81 2qut h GLN 179 CO 0.02 0.00 0.00 0.09 -0.95 0.00 0.00 178.83 177.99 2qut n ASN 180 N -2.41 3.23 -0.53 1.46 3.02 -0.36 -4.97 115.26 114.70 2qut n ASN 180 Ca 0.02 -3.05 -0.07 0.00 -0.03 0.00 0.00 54.58 51.45 2qut n ASN 180 Cb 0.26 -0.50 -0.03 0.00 -0.61 0.00 0.00 39.78 38.90 2qut n ASN 180 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qut n GLY 181 N -0.91 0.89 3.49 7.41 0.00 -1.15 -4.78 105.19 110.14 2qut n GLY 181 Ca 0.19 -0.47 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 2qut n GLY 181 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qut s ILE 182 N -2.15 4.02 -0.27 -0.61 1.01 -0.55 -4.84 121.20 117.81 2qut s ILE 182 Ca 0.00 -0.30 -0.29 0.00 0.00 0.00 0.00 60.65 60.06 2qut s ILE 182 Cb 0.00 -2.79 0.01 0.00 0.01 0.00 0.00 42.46 39.69 2qut s ILE 182 CO 0.00 0.46 1.10 -0.69 0.00 0.00 0.00 174.94 175.81 2qut s VAL 183 N 0.66 4.51 -0.01 2.92 1.01 -0.19 -3.14 120.40 126.16 2qut s VAL 183 Ca -0.01 1.78 -0.26 0.00 0.00 0.00 0.00 61.98 63.50 2qut s VAL 183 Cb -0.14 -4.31 -0.04 0.00 0.00 0.00 0.00 36.38 31.88 2qut s VAL 183 CO 0.02 -0.34 0.79 -2.16 0.00 0.00 0.00 175.10 173.41 2qut s PRO 184 N 3.52 4.49 -0.32 2.72 0.04 -1.25 -1.00 135.00 143.21 2qut s PRO 184 Ca 0.47 1.07 -0.15 0.00 0.04 0.00 0.00 61.00 62.43 2qut s PRO 184 Cb -0.15 -3.42 -0.02 0.00 0.04 0.00 0.00 34.50 30.96 2qut s PRO 184 CO 0.13 0.12 0.37 0.42 0.04 0.00 0.00 177.00 178.08 2qut s ILE 185 N 0.53 5.16 -0.37 0.56 1.01 -0.40 -2.27 121.20 125.43 2qut s ILE 185 Ca 0.41 0.24 -0.23 0.00 0.00 0.00 0.00 60.65 61.07 2qut s ILE 185 Cb -0.20 -3.79 0.01 0.00 0.01 0.00 0.00 42.46 38.50 2qut s ILE 185 CO 0.22 -0.02 0.79 -0.69 0.00 0.00 0.00 174.94 175.25 2qut s VAL 186 N 2.06 4.72 -0.47 2.92 1.01 -0.05 -3.37 120.40 127.22 2qut s VAL 186 Ca 0.13 0.88 0.01 0.00 0.00 0.00 0.00 61.98 63.00 2qut s VAL 186 Cb -0.16 -4.23 0.13 0.00 0.00 0.00 0.00 36.38 32.12 2qut s VAL 186 CO 0.11 -0.46 0.24 -0.70 0.00 0.00 0.00 175.10 174.29 2qut s GLU 187 N 3.14 2.00 -1.09 2.72 2.12 -1.08 -0.40 118.70 126.11 2qut s GLU 187 Ca 0.32 -2.23 -0.07 0.00 0.36 0.00 0.00 54.97 53.35 2qut s GLU 187 Cb -0.13 -3.46 0.29 0.00 0.26 0.00 0.00 34.13 31.09 2qut s GLU 187 CO 0.17 -1.07 1.20 -0.35 -0.54 0.00 0.00 175.26 174.67 2qut n PRO 188 N 3.83 3.76 -2.37 4.30 -0.04 -1.24 -0.73 135.00 142.53 2qut n PRO 188 Ca 0.04 -4.49 -0.42 0.00 -0.04 0.00 0.00 63.50 58.58 2qut n PRO 188 Cb 0.38 -2.53 -0.03 0.00 -0.04 0.00 0.00 33.50 31.29 2qut n PRO 188 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2qut s GLU 189 N -1.75 4.32 -0.38 0.54 2.12 -0.44 -4.54 118.70 118.56 2qut s GLU 189 Ca 0.31 1.79 -0.13 0.00 0.36 0.00 0.00 54.97 57.29 2qut s GLU 189 Cb -0.05 -3.57 0.01 0.00 0.26 0.00 0.00 34.13 30.78 2qut s GLU 189 CO -0.03 -0.50 0.25 0.42 -0.54 0.00 0.00 175.26 174.86 2qut s ILE 190 N 2.32 5.03 0.69 -3.70 1.01 -1.26 -0.39 121.20 124.90 2qut s ILE 190 Ca 0.59 -0.61 -0.17 0.00 0.00 0.00 0.00 60.65 60.47 2qut s ILE 190 Cb -0.27 -3.74 0.01 0.00 0.01 0.00 0.00 42.46 38.47 2qut s ILE 190 CO 0.23 -0.20 1.20 0.18 0.00 0.00 0.00 174.94 176.36 2qut n LEU 191 N 5.09 5.15 -0.32 2.97 4.77 -0.21 -4.81 117.00 129.63 2qut n LEU 191 Ca -0.12 0.75 0.14 0.00 -0.03 0.00 0.00 56.01 56.75 2qut n LEU 191 Cb 0.47 -1.51 0.54 0.00 -2.33 0.00 0.00 43.42 40.60 2qut n LEU 191 CO 0.38 -1.37 0.84 -0.81 -1.33 0.00 0.00 177.39 175.10 2qut n PRO 192 N -2.15 1.26 -1.70 3.23 -0.04 -1.26 -4.53 135.00 129.82 2qut n PRO 192 Ca 0.15 -0.65 -0.44 0.00 -0.04 0.00 0.00 63.50 62.52 2qut n PRO 192 Cb 0.49 -1.49 -0.03 0.00 -0.04 0.00 0.00 33.50 32.43 2qut n PRO 192 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2qut n ASP 193 N -0.30 3.32 0.00 3.54 9.92 -1.26 -0.31 116.55 131.46 2qut n ASP 193 Ca 0.17 1.12 0.00 0.00 -0.53 0.00 0.00 54.79 55.55 2qut n ASP 193 Cb 0.32 -1.49 0.00 0.00 -0.64 0.00 0.00 41.12 39.30 2qut n ASP 193 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2qut n GLY 194 N 2.70 1.64 1.03 0.44 0.00 -1.26 -4.60 105.19 105.15 2qut n GLY 194 Ca 0.13 -2.17 0.08 0.00 0.00 0.00 0.00 46.02 44.06 2qut n GLY 194 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2qut n ASP 195 N 0.00 3.94 -4.76 1.61 5.75 -1.26 -0.29 116.55 121.54 2qut n ASP 195 Ca 0.00 -2.62 -0.32 0.00 -0.01 0.00 0.00 54.79 51.84 2qut n ASP 195 Cb 0.00 -0.48 0.08 0.00 -1.03 0.00 0.00 41.12 39.69 2qut n ASP 195 CO 0.00 0.00 0.00 -1.38 -0.11 0.00 0.00 177.20 175.71 2qut s HIS 196 N -2.13 2.46 0.60 2.11 -3.43 -1.26 -4.36 115.29 109.29 2qut s HIS 196 Ca 0.40 1.58 -0.00 0.00 -0.80 0.00 0.00 55.06 56.23 2qut s HIS 196 Cb 0.28 -3.17 0.12 0.00 -1.43 0.00 0.00 32.58 28.38 2qut s HIS 196 CO 0.14 -1.92 0.82 -0.40 -2.00 0.00 0.00 174.74 171.39 2qut n ASP 197 N -2.98 1.10 -0.13 7.38 5.68 -1.26 -0.19 116.55 126.15 2qut n ASP 197 Ca 0.10 -1.93 -0.07 0.00 -0.50 0.00 0.00 54.79 52.39 2qut n ASP 197 Cb 0.52 -0.53 0.01 0.00 -1.14 0.00 0.00 41.12 39.98 2qut n ASP 197 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 2qut h LEU 198 N 0.00 0.40 -1.53 -2.12 5.85 -1.92 -2.62 115.31 113.37 2qut h LEU 198 Ca -0.27 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.40 2qut h LEU 198 Cb 1.00 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.94 2qut h LEU 198 CO 0.29 0.29 -0.24 0.07 -0.34 0.00 0.00 178.44 178.50 2qut h LYS 199 N 0.50 0.00 -0.32 1.25 2.10 -1.95 -1.16 116.57 116.99 2qut h LYS 199 Ca 0.17 0.00 -0.10 0.00 -2.00 0.00 0.00 60.65 58.72 2qut h LYS 199 Cb 0.01 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.33 2qut h LYS 199 CO -0.08 0.24 -0.18 -0.09 -2.00 0.00 0.00 179.45 177.35 2qut h ARG 200 N 0.00 0.69 -0.58 0.07 9.65 -1.86 -1.11 114.38 121.25 2qut h ARG 200 Ca -0.00 -0.31 -0.08 0.00 -1.10 0.00 0.00 59.98 58.48 2qut h ARG 200 Cb 0.49 -0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 29.04 2qut h ARG 200 CO 0.03 0.91 0.05 0.00 2.80 0.00 0.00 179.97 183.77 2qut h GLN 202 N 0.89 0.97 0.18 0.00 4.15 -1.12 0.19 115.11 120.37 2qut h GLN 202 Ca 0.17 -0.14 -0.01 0.00 0.77 0.00 0.00 58.65 59.44 2qut h GLN 202 Cb 0.48 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 27.99 2qut h GLN 202 CO 0.02 0.77 -0.10 -0.92 -1.93 0.00 0.00 178.83 176.67 2qut h TYR 203 N 0.94 -0.25 -0.69 3.99 3.20 -0.91 0.24 116.97 123.49 2qut h TYR 203 Ca 0.23 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 62.04 2qut h TYR 203 Cb 0.11 0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.43 2qut h TYR 203 CO 0.00 -0.15 0.18 0.28 -1.64 0.00 0.00 178.16 176.83 2qut h VAL 204 N -0.26 1.26 -0.64 1.81 2.07 -1.08 -1.83 116.25 117.58 2qut h VAL 204 Ca -0.02 -0.94 -0.01 0.00 0.82 0.00 0.00 66.70 66.55 2qut h VAL 204 Cb 0.21 0.55 -0.03 0.00 -1.52 0.00 0.00 31.29 30.49 2qut h VAL 204 CO 0.03 0.36 0.36 0.74 0.02 0.00 0.00 177.57 179.08 2qut h THR 205 N 1.03 1.20 -0.45 2.57 2.02 -0.42 0.14 112.91 119.00 2qut h THR 205 Ca 0.22 -0.50 -0.01 0.00 0.77 0.00 0.00 66.41 66.88 2qut h THR 205 Cb 0.35 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 67.10 2qut h THR 205 CO -0.00 0.22 0.24 -0.33 0.37 0.00 0.00 175.52 176.02 2qut h GLU 206 N 0.88 0.62 -0.51 6.66 5.08 -0.62 -0.83 114.58 125.87 2qut h GLU 206 Ca 0.23 -0.07 -0.11 0.00 -1.00 0.00 0.00 59.36 58.40 2qut h GLU 206 Cb 0.04 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 2qut h GLU 206 CO -0.04 0.50 -0.11 0.87 -1.00 0.00 0.00 179.01 179.23 2qut h LYS 207 N 0.58 0.95 0.04 2.33 1.79 -1.01 -1.57 116.57 119.67 2qut h LYS 207 Ca 0.16 -0.34 -0.00 0.00 -2.18 0.00 0.00 60.65 58.29 2qut h LYS 207 Cb 0.06 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 30.64 2qut h LYS 207 CO -0.02 1.00 -0.02 0.28 -1.08 0.00 0.00 179.45 179.61 2qut h VAL 208 N 0.84 1.16 -0.47 0.50 2.07 -0.80 -2.30 116.25 117.25 2qut h VAL 208 Ca 0.13 -0.63 -0.02 0.00 0.82 0.00 0.00 66.70 67.00 2qut h VAL 208 Cb 0.65 1.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.98 2qut h VAL 208 CO 0.04 0.16 0.19 -0.07 0.02 0.00 0.00 177.57 177.91 2qut h LEU 209 N -0.32 0.60 -0.69 2.57 3.38 -1.12 0.34 115.31 120.07 2qut h LEU 209 Ca -0.00 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 2qut h LEU 209 Cb 0.30 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 2qut h LEU 209 CO 0.01 0.55 0.30 0.00 0.09 0.00 0.00 178.44 179.38 2qut h ALA 210 N 1.55 0.90 -0.58 1.53 0.00 -1.20 -1.53 119.26 119.92 2qut h ALA 210 Ca 0.16 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 2qut h ALA 210 Cb 0.13 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2qut h ALA 210 CO -0.02 0.49 0.07 0.00 0.00 0.00 0.00 179.25 179.80 2qut h ALA 211 N 1.14 0.77 -0.14 0.00 0.00 -0.72 -2.44 119.26 117.87 2qut h ALA 211 Ca 0.23 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2qut h ALA 211 Cb 0.18 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2qut h ALA 211 CO -0.02 0.55 0.08 0.28 0.00 0.00 0.00 179.25 180.13 2qut h VAL 212 N 0.87 1.02 0.00 0.00 2.07 -0.48 -1.79 116.25 117.95 2qut h VAL 212 Ca 0.17 -0.06 -0.07 0.00 0.82 0.00 0.00 66.70 67.56 2qut h VAL 212 Cb 0.46 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 2qut h VAL 212 CO 0.02 0.03 -0.35 1.88 0.02 0.00 0.00 177.57 179.16 2qut h TYR 213 N 0.17 0.00 -0.31 1.57 0.05 -1.25 -0.82 116.97 116.37 2qut h TYR 213 Ca 0.05 0.00 -0.13 0.00 0.05 0.00 0.00 58.73 58.70 2qut h TYR 213 Cb -0.01 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.73 2qut h TYR 213 CO -0.08 0.35 -0.30 -0.22 -1.05 0.00 0.00 178.16 176.86 2qut h LYS 214 N 0.00 0.76 -0.47 4.88 1.63 -1.26 -1.31 116.57 120.80 2qut h LYS 214 Ca -0.00 -0.40 -0.01 0.00 -0.85 0.00 0.00 60.65 59.38 2qut h LYS 214 Cb 0.88 0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 32.50 2qut h LYS 214 CO 0.05 1.02 0.24 0.00 -3.45 0.00 0.00 179.45 177.30 2qut h ALA 215 N 0.72 0.60 -0.59 5.00 0.00 -1.02 -0.05 119.26 123.93 2qut h ALA 215 Ca 0.05 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2qut h ALA 215 Cb 0.88 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 2qut h ALA 215 CO 0.08 0.15 0.34 -0.07 0.00 0.00 0.00 179.25 179.75 2qut h LEU 216 N 0.62 0.71 -0.15 0.00 3.38 -1.04 -1.00 115.31 117.83 2qut h LEU 216 Ca 0.16 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 2qut h LEU 216 Cb 0.10 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 2qut h LEU 216 CO -0.02 0.56 -0.01 -1.28 0.09 0.00 0.00 178.44 177.78 2qut h SER 217 N 0.81 0.26 -0.25 -0.43 0.87 -0.63 0.42 113.55 114.60 2qut h SER 217 Ca 0.21 -0.32 -0.00 0.00 -1.23 0.00 0.00 61.79 60.45 2qut h SER 217 Cb -0.00 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 61.87 2qut h SER 217 CO -0.04 0.51 0.15 0.44 -0.53 0.00 0.00 176.83 177.37 2qut h ASP 218 N -0.01 0.32 -0.48 6.23 3.32 -0.50 -1.72 116.42 123.59 2qut h ASP 218 Ca 0.04 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.08 2qut h ASP 218 Cb 0.39 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.86 2qut h ASP 218 CO 0.01 0.25 0.00 1.41 -1.72 0.00 0.00 179.24 179.19 2qut n HIS 219 N -4.47 0.69 -3.62 4.55 8.25 -0.43 -4.95 115.22 115.24 2qut n HIS 219 Ca 0.01 -0.33 -0.24 0.00 -0.26 0.00 0.00 57.72 56.90 2qut n HIS 219 Cb 0.09 -0.02 0.07 0.00 1.12 0.00 0.00 29.99 31.26 2qut n HIS 219 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2qut n HIS 220 N 0.89 -2.72 -2.65 4.41 8.25 -0.65 -4.88 115.22 117.87 2qut n HIS 220 Ca 0.16 0.99 -0.42 0.00 -0.26 0.00 0.00 57.72 58.20 2qut n HIS 220 Cb 0.43 -4.92 -0.03 0.00 1.12 0.00 0.00 29.99 26.59 2qut n HIS 220 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2qut s ILE 221 N -3.33 4.55 -0.77 1.59 -1.09 0.10 -4.91 121.20 117.34 2qut s ILE 221 Ca 0.51 1.93 -0.26 0.00 -2.23 0.00 0.00 60.65 60.60 2qut s ILE 221 Cb -0.23 -4.23 0.04 0.00 -1.58 0.00 0.00 42.46 36.46 2qut s ILE 221 CO 0.74 0.20 1.26 -0.47 -1.23 0.00 0.00 174.94 175.45 2qut s TYR 222 N 0.64 2.36 0.36 3.97 5.04 -1.26 -4.82 117.35 123.64 2qut s TYR 222 Ca 0.52 -0.22 0.06 0.00 -2.44 0.00 0.00 57.07 54.99 2qut s TYR 222 Cb -0.24 -4.59 0.73 0.00 0.35 0.00 0.00 41.96 38.20 2qut s TYR 222 CO 0.29 -2.01 1.95 -0.07 -1.34 0.00 0.00 175.55 174.38 2qut h LEU 223 N 12.78 0.68 -2.16 6.97 3.38 -1.93 -0.96 115.31 134.07 2qut h LEU 223 Ca -0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2qut h LEU 223 Cb 1.05 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.66 2qut h LEU 223 CO 1.28 0.44 0.00 -0.33 0.09 0.00 0.00 178.44 179.92 2qut h GLU 224 N 0.77 0.00 -0.76 1.13 3.07 -1.90 -1.93 114.58 114.97 2qut h GLU 224 Ca 0.32 0.00 -0.41 0.00 -0.50 0.00 0.00 59.36 58.77 2qut h GLU 224 Cb 0.27 0.00 -0.24 0.00 -0.84 0.00 0.00 28.75 27.94 2qut h GLU 224 CO -0.11 0.00 0.35 0.41 -1.40 0.00 0.00 179.01 178.27 2qut n GLY 225 N -0.67 4.86 3.18 -3.84 0.00 -0.36 -4.33 105.19 104.02 2qut n GLY 225 Ca -0.01 -1.32 -0.10 0.00 0.00 0.00 0.00 46.02 44.58 2qut n GLY 225 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qut s THR 226 N -3.48 0.07 0.10 2.61 -4.23 -0.73 -3.93 115.64 106.06 2qut s THR 226 Ca 0.53 -1.90 0.03 0.00 -1.18 0.00 0.00 61.69 59.17 2qut s THR 226 Cb 0.45 -2.15 -0.04 0.00 1.34 0.00 0.00 72.50 72.11 2qut s THR 226 CO 0.05 -0.34 -0.08 -0.76 -0.54 0.00 0.00 174.62 172.95 2qut s LEU 227 N -3.07 2.47 -0.09 4.79 1.43 -0.96 -3.63 118.68 119.62 2qut s LEU 227 Ca 0.27 -0.92 0.04 0.00 -1.03 0.00 0.00 54.13 52.50 2qut s LEU 227 Cb 0.07 -0.20 -0.01 0.00 0.03 0.00 0.00 46.19 46.08 2qut s LEU 227 CO 0.04 -0.36 -0.21 -0.22 0.23 0.00 0.00 176.35 175.83 2qut s LEU 228 N -2.78 2.28 -0.59 1.79 2.96 -0.41 -0.87 118.68 121.06 2qut s LEU 228 Ca 0.09 -0.45 0.04 0.00 -0.22 0.00 0.00 54.13 53.59 2qut s LEU 228 Cb 0.01 -1.45 0.15 0.00 0.50 0.00 0.00 46.19 45.40 2qut s LEU 228 CO -0.02 0.21 0.36 -0.75 -1.32 0.00 0.00 176.35 174.83 2qut s LYS 229 N 0.04 2.07 0.43 1.98 2.20 0.46 0.06 119.74 126.99 2qut s LYS 229 Ca -0.08 -2.85 0.08 0.00 -0.36 0.00 0.00 55.97 52.75 2qut s LYS 229 Cb -0.15 -3.19 -0.00 0.00 -1.51 0.00 0.00 37.83 32.98 2qut s LYS 229 CO 0.05 -1.20 0.47 -1.25 -0.36 0.00 0.00 175.35 173.06 2qut s PRO 230 N -0.71 2.62 0.50 4.03 0.04 -1.26 -3.60 135.00 136.62 2qut s PRO 230 Ca 0.21 -1.46 -0.18 0.00 0.04 0.00 0.00 61.00 59.61 2qut s PRO 230 Cb -0.16 -2.51 -0.08 0.00 0.04 0.00 0.00 34.50 31.79 2qut s PRO 230 CO -0.08 -0.27 0.99 0.54 0.04 0.00 0.00 177.00 178.22 2qut s ASN 231 N -4.24 6.57 0.77 6.66 4.22 -1.26 -2.70 114.94 124.97 2qut s ASN 231 Ca 0.51 1.68 -0.11 0.00 -2.14 0.00 0.00 52.86 52.79 2qut s ASN 231 Cb -0.06 -2.53 0.05 0.00 1.28 0.00 0.00 41.25 40.00 2qut s ASN 231 CO 0.30 -0.62 1.10 -0.04 -2.04 0.00 0.00 177.10 175.80 2qut s MET 232 N -3.71 2.30 -0.36 3.55 -1.94 -1.26 -4.96 119.30 112.91 2qut s MET 232 Ca 0.61 0.56 -0.19 0.00 -1.71 0.00 0.00 55.69 54.97 2qut s MET 232 Cb -0.11 -1.95 -0.00 0.00 2.01 0.00 0.00 34.83 34.78 2qut s MET 232 CO 0.25 -1.45 0.54 0.08 -0.01 0.00 0.00 175.02 174.43 2qut s VAL 233 N -3.23 4.98 0.14 -6.03 1.01 -1.26 -5.02 120.40 110.98 2qut s VAL 233 Ca 0.60 0.37 -0.04 0.00 0.00 0.00 0.00 61.98 62.91 2qut s VAL 233 Cb -0.13 -4.00 -0.03 0.00 0.00 0.00 0.00 36.38 32.22 2qut s VAL 233 CO 0.53 -0.26 0.13 0.42 0.00 0.00 0.00 175.10 175.92 2qut s THR 234 N 2.48 0.09 0.91 3.92 -4.23 -1.26 -4.46 115.64 113.09 2qut s THR 234 Ca 0.20 -1.73 -0.12 0.00 -1.18 0.00 0.00 61.69 58.86 2qut s THR 234 Cb -0.15 -1.97 0.14 0.00 1.34 0.00 0.00 72.50 71.85 2qut s THR 234 CO 0.14 -0.41 1.09 -2.16 -0.54 0.00 0.00 174.62 172.74 2qut s PRO 235 N -4.02 1.16 0.80 3.99 0.04 -1.26 -4.58 135.00 131.12 2qut s PRO 235 Ca 0.22 0.71 -0.10 0.00 0.04 0.00 0.00 61.00 61.87 2qut s PRO 235 Cb 0.06 -1.81 0.07 0.00 0.04 0.00 0.00 34.50 32.87 2qut s PRO 235 CO 0.01 -2.28 1.10 0.20 0.04 0.00 0.00 177.00 176.07 2qut s GLY 236 N -3.50 1.69 0.29 0.56 0.00 0.74 -4.91 107.32 102.19 2qut s GLY 236 Ca 0.64 0.33 0.02 0.00 0.00 0.00 0.00 44.72 45.70 2qut s GLY 236 CO 0.57 0.69 1.86 0.45 0.00 0.00 0.00 173.10 176.67 2qut h HIS 237 N -1.24 1.09 -0.37 1.90 3.86 -0.27 -1.80 115.15 118.31 2qut h HIS 237 Ca -0.43 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 58.81 2qut h HIS 237 Cb 1.24 -0.35 0.00 0.00 1.06 0.00 0.00 27.41 29.36 2qut h HIS 237 CO 0.56 0.48 0.00 0.00 0.86 0.00 0.00 177.93 179.84 2qut n ALA 238 N -2.37 2.75 -2.20 2.45 0.00 0.60 -4.93 120.51 116.80 2qut n ALA 238 Ca 0.17 -0.84 -0.42 0.00 0.00 0.00 0.00 53.44 52.35 2qut n ALA 238 Cb 0.31 -1.01 -0.03 0.00 0.00 0.00 0.00 19.45 18.72 2qut n ALA 238 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qut h THR 240 N 4.22 1.56 -3.79 0.00 1.35 -1.90 -3.45 112.91 110.90 2qut h THR 240 Ca -0.42 -2.79 -0.51 0.00 -0.55 0.00 0.00 66.41 62.14 2qut h THR 240 Cb 1.21 2.53 0.02 0.00 -1.73 0.00 0.00 68.15 70.18 2qut h THR 240 CO 0.83 0.80 0.48 -1.58 -0.25 0.00 0.00 175.52 175.81 2qut s GLN 241 N -3.12 4.62 0.04 4.72 0.74 -1.26 -5.04 119.66 120.37 2qut s GLN 241 Ca -0.01 1.82 -0.00 0.00 0.05 0.00 0.00 55.36 57.22 2qut s GLN 241 Cb 0.11 -3.19 -0.04 0.00 1.10 0.00 0.00 33.01 30.99 2qut s GLN 241 CO 0.81 0.18 0.17 -1.59 -0.55 0.00 0.00 175.29 174.31 2qut s LYS 242 N -1.39 3.32 0.07 1.67 -2.85 -1.26 -5.02 119.74 114.28 2qut s LYS 242 Ca 0.45 -0.46 0.04 0.00 -1.00 0.00 0.00 55.97 55.00 2qut s LYS 242 Cb -0.32 -2.99 -0.03 0.00 -2.06 0.00 0.00 37.83 32.43 2qut s LYS 242 CO 0.41 0.62 -0.11 0.71 0.10 0.00 0.00 175.35 177.08 2qut s TYR 243 N -1.42 0.98 0.63 1.78 2.02 -1.26 -5.15 117.35 114.93 2qut s TYR 243 Ca 0.31 -0.52 -0.07 0.00 -0.37 0.00 0.00 57.07 56.43 2qut s TYR 243 Cb -0.13 -0.56 0.02 0.00 -0.40 0.00 0.00 41.96 40.89 2qut s TYR 243 CO 0.24 -0.01 0.95 -1.54 -1.57 0.00 0.00 175.55 173.62 2qut s SER 244 N -1.83 5.45 0.42 2.29 1.04 -1.26 -4.94 113.70 114.86 2qut s SER 244 Ca -0.03 0.74 0.18 0.00 0.48 0.00 0.00 55.95 57.32 2qut s SER 244 Cb -0.08 -1.65 0.95 0.00 0.10 0.00 0.00 66.02 65.34 2qut s SER 244 CO 0.01 -1.19 1.89 0.45 0.98 0.00 0.00 173.24 175.38 2qut h HIS 245 N -0.32 0.00 -0.45 5.02 3.86 -1.99 -2.08 115.15 119.19 2qut h HIS 245 Ca -0.45 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 58.67 2qut h HIS 245 Cb 1.27 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.72 2qut h HIS 245 CO 0.45 0.28 -0.09 0.93 0.86 0.00 0.00 177.93 180.36 2qut h GLU 246 N 0.00 0.81 -0.14 2.45 3.07 -1.94 -0.79 114.58 118.03 2qut h GLU 246 Ca -0.00 -0.26 -0.21 0.00 -0.50 0.00 0.00 59.36 58.38 2qut h GLU 246 Cb 0.59 -0.07 0.01 0.00 -0.84 0.00 0.00 28.75 28.43 2qut h GLU 246 CO 0.04 0.87 -0.75 0.93 -1.40 0.00 0.00 179.01 178.70 2qut h GLU 247 N 0.74 0.68 -0.45 2.33 5.08 -1.80 -1.14 114.58 120.01 2qut h GLU 247 Ca 0.13 -0.55 -0.00 0.00 -1.00 0.00 0.00 59.36 57.93 2qut h GLU 247 Cb 0.58 0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.92 2qut h GLU 247 CO 0.04 1.16 0.27 0.82 -1.00 0.00 0.00 179.01 180.30 2qut h ILE 248 N 0.47 1.14 -0.37 3.13 1.08 -1.20 -0.46 117.51 121.30 2qut h ILE 248 Ca -0.04 -0.33 -0.02 0.00 -0.39 0.00 0.00 64.86 64.08 2qut h ILE 248 Cb 1.36 0.55 -0.02 0.00 -3.07 0.00 0.00 36.82 35.65 2qut h ILE 248 CO 0.15 0.15 0.15 0.00 -0.69 0.00 0.00 178.15 177.90 2qut h ALA 249 N 1.12 0.48 -0.30 1.87 0.00 -1.09 -0.13 119.26 121.21 2qut h ALA 249 Ca 0.16 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2qut h ALA 249 Cb 0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2qut h ALA 249 CO -0.03 0.08 0.16 1.98 0.00 0.00 0.00 179.25 181.44 2qut h MET 250 N 0.45 0.43 -0.59 0.00 1.85 -0.95 0.11 114.93 116.23 2qut h MET 250 Ca 0.12 -0.05 -0.05 0.00 -0.61 0.00 0.00 59.70 59.11 2qut h MET 250 Cb 0.19 -0.08 -0.02 0.00 0.43 0.00 0.00 31.60 32.11 2qut h MET 250 CO -0.01 0.38 0.19 0.00 -0.40 0.00 0.00 176.91 177.06 2qut h ALA 251 N 1.03 0.77 0.42 0.39 0.00 -0.99 0.57 119.26 121.45 2qut h ALA 251 Ca 0.11 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 2qut h ALA 251 Cb 0.08 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.64 2qut h ALA 251 CO -0.02 0.44 -0.20 1.15 0.00 0.00 0.00 179.25 180.62 2qut h THR 252 N 0.83 0.54 -0.91 0.00 2.02 -0.82 -1.82 112.91 112.76 2qut h THR 252 Ca 0.19 -0.42 0.01 0.00 0.77 0.00 0.00 66.41 66.96 2qut h THR 252 Cb 0.28 0.73 -0.04 0.00 -1.74 0.00 0.00 68.15 67.37 2qut h THR 252 CO -0.01 0.07 0.59 0.58 0.37 0.00 0.00 175.52 177.13 2qut h VAL 253 N -0.82 1.24 -0.36 3.16 2.07 -0.77 -1.96 116.25 118.81 2qut h VAL 253 Ca -0.06 -0.46 -0.02 0.00 0.82 0.00 0.00 66.70 66.98 2qut h VAL 253 Cb 0.55 -0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.21 2qut h VAL 253 CO 0.09 0.24 0.15 0.74 0.02 0.00 0.00 177.57 178.81 2qut h THR 254 N 1.25 1.19 -0.58 2.57 2.02 -0.87 0.13 112.91 118.61 2qut h THR 254 Ca 0.33 -0.58 0.04 0.00 0.77 0.00 0.00 66.41 66.97 2qut h THR 254 Cb -0.12 0.89 -0.04 0.00 -1.74 0.00 0.00 68.15 67.14 2qut h THR 254 CO -0.07 0.21 0.34 0.00 0.37 0.00 0.00 175.52 176.36 2qut h ALA 255 N 0.99 0.76 -0.43 6.16 0.00 -0.89 -2.03 119.26 123.81 2qut h ALA 255 Ca 0.12 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 2qut h ALA 255 Cb 0.18 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2qut h ALA 255 CO -0.01 0.04 -0.06 -0.07 0.00 0.00 0.00 179.25 179.14 2qut h LEU 256 N 0.65 0.80 -1.97 0.00 3.38 -1.12 -2.87 115.31 114.18 2qut h LEU 256 Ca 0.24 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 2qut h LEU 256 Cb 0.08 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 2qut h LEU 256 CO -0.13 0.95 -0.02 0.03 0.09 0.00 0.00 178.44 179.36 2qut h ARG 257 N 0.63 0.00 -0.00 1.13 3.08 -0.64 0.15 114.38 118.73 2qut h ARG 257 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.16 2qut h ARG 257 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.63 2qut h ARG 257 CO 0.03 0.02 -0.17 0.54 -1.07 0.00 0.00 179.97 179.33 2qut n ARG 258 N -4.48 0.37 0.00 0.04 1.74 -0.79 -4.57 116.66 108.97 2qut n ARG 258 Ca -0.03 -0.13 0.00 0.00 -0.77 0.00 0.00 57.85 56.93 2qut n ARG 258 Cb 0.11 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.05 2qut n ARG 258 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2qut n THR 259 N -1.21 0.00 -2.98 0.55 -2.24 -0.78 -5.00 114.28 102.62 2qut n THR 259 Ca 0.11 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.46 2qut n THR 259 Cb 0.31 -0.11 -0.05 0.00 -2.10 0.00 0.00 70.33 68.37 2qut n THR 259 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2qut s VAL 260 N -1.12 4.71 0.40 2.28 1.01 0.45 -4.78 120.40 123.35 2qut s VAL 260 Ca 0.00 0.63 -0.26 0.00 0.00 0.00 0.00 61.98 62.34 2qut s VAL 260 Cb 0.00 -4.25 -0.10 0.00 0.00 0.00 0.00 36.38 32.03 2qut s VAL 260 CO 0.00 -0.56 1.31 -2.65 0.00 0.00 0.00 175.10 173.21 2qut n PRO 261 N 6.51 2.09 0.21 2.72 -0.02 -1.26 -4.83 135.00 140.42 2qut n PRO 261 Ca 0.02 0.74 0.14 0.00 -2.02 0.00 0.00 63.50 62.39 2qut n PRO 261 Cb 0.48 -2.42 0.76 0.00 -0.02 0.00 0.00 33.50 32.30 2qut n PRO 261 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2qut h PRO 262 N 2.32 0.00 0.00 0.52 0.13 -1.96 -1.37 132.00 131.65 2qut h PRO 262 Ca -0.48 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.62 2qut h PRO 262 Cb 1.28 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.41 2qut h PRO 262 CO 0.61 0.00 -0.16 0.00 -0.23 0.00 0.00 178.00 178.23 2qut h ALA 263 N 2.02 1.26 -2.41 -0.56 0.00 -1.90 -3.42 119.26 114.24 2qut h ALA 263 Ca 0.00 -0.14 -0.53 0.00 0.00 0.00 0.00 54.91 54.24 2qut h ALA 263 Cb 0.04 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 17.82 2qut h ALA 263 CO 0.00 0.19 1.11 0.08 0.00 0.00 0.00 179.25 180.64 2qut s VAL 264 N -4.12 2.96 0.29 0.00 1.01 -0.52 -3.37 120.40 116.65 2qut s VAL 264 Ca -0.02 0.25 -0.01 0.00 0.00 0.00 0.00 61.98 62.20 2qut s VAL 264 Cb 0.13 -3.16 0.19 0.00 0.00 0.00 0.00 36.38 33.53 2qut s VAL 264 CO 0.61 -0.01 1.87 0.74 0.00 0.00 0.00 175.10 178.31 2qut h THR 265 N 5.13 1.22 -2.02 3.92 2.02 -1.66 -3.44 112.91 118.08 2qut h THR 265 Ca -0.45 -0.67 0.09 0.00 0.77 0.00 0.00 66.41 66.15 2qut h THR 265 Cb 1.21 0.48 -0.18 0.00 -1.74 0.00 0.00 68.15 67.92 2qut h THR 265 CO 0.94 0.27 0.50 -0.83 0.37 0.00 0.00 175.52 176.77 2qut s GLY 266 N -3.54 -0.41 -0.22 2.16 0.00 -1.26 -3.28 107.32 100.77 2qut s GLY 266 Ca -0.10 1.37 -0.01 0.00 0.00 0.00 0.00 44.72 45.97 2qut s GLY 266 CO 0.80 0.60 -0.10 0.14 0.00 0.00 0.00 173.10 174.53 2qut s VAL 267 N -2.35 2.77 -0.47 1.40 1.01 0.71 -1.28 120.40 122.18 2qut s VAL 267 Ca 0.02 -0.84 -0.02 0.00 0.00 0.00 0.00 61.98 61.14 2qut s VAL 267 Cb -0.01 -2.29 0.12 0.00 0.00 0.00 0.00 36.38 34.20 2qut s VAL 267 CO -0.04 0.37 0.26 0.42 0.00 0.00 0.00 175.10 176.11 2qut s THR 268 N 1.36 3.34 0.46 3.92 -4.23 0.11 -0.75 115.64 119.85 2qut s THR 268 Ca 0.03 -2.35 -0.24 0.00 -1.18 0.00 0.00 61.69 57.95 2qut s THR 268 Cb -0.15 -3.27 -0.07 0.00 1.34 0.00 0.00 72.50 70.35 2qut s THR 268 CO -0.07 -0.74 1.32 -0.36 -0.54 0.00 0.00 174.62 174.23 2qut s PHE 269 N 0.77 2.63 0.27 3.99 0.08 -0.50 -4.15 117.98 121.07 2qut s PHE 269 Ca 0.11 1.39 -0.09 0.00 0.12 0.00 0.00 56.93 58.46 2qut s PHE 269 Cb -0.22 -3.70 -0.07 0.00 -0.57 0.00 0.00 43.02 38.46 2qut s PHE 269 CO -0.04 -2.35 0.59 -0.48 -0.10 0.00 0.00 175.22 172.83 2qut s LEU 270 N -2.84 4.09 0.28 -0.37 0.05 -1.10 -1.24 118.68 117.55 2qut s LEU 270 Ca 0.62 0.91 0.23 0.00 0.05 0.00 0.00 54.13 55.94 2qut s LEU 270 Cb -0.38 -3.71 0.11 0.00 -2.05 0.00 0.00 46.19 40.16 2qut s LEU 270 CO 0.48 -0.15 1.23 0.77 -0.55 0.00 0.00 176.35 178.12 2qut h SER 271 N 2.15 0.00 -6.67 1.48 4.64 -1.92 -3.41 113.55 109.82 2qut h SER 271 Ca -0.47 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.35 2qut h SER 271 Cb 1.18 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 63.09 2qut h SER 271 CO 0.67 0.01 -0.78 0.61 -0.87 0.00 0.00 176.83 176.47 2qut n GLY 272 N 1.16 -0.12 0.08 -0.77 0.00 -1.26 -1.19 105.19 103.09 2qut n GLY 272 Ca 0.01 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2qut n GLY 272 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qut n GLY 273 N -2.18 1.89 3.75 -0.02 0.00 -1.26 -4.82 105.19 102.55 2qut n GLY 273 Ca -0.24 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.43 2qut n GLY 273 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2qut s GLN 274 N -0.98 2.86 0.94 1.61 -0.21 -0.34 -4.99 119.66 118.55 2qut s GLN 274 Ca 0.00 1.73 -0.12 0.00 0.02 0.00 0.00 55.36 56.99 2qut s GLN 274 Cb 0.00 -1.93 0.15 0.00 1.00 0.00 0.00 33.01 32.24 2qut s GLN 274 CO 0.00 -1.27 1.09 -1.54 -2.12 0.00 0.00 175.29 171.45 2qut s SER 275 N -1.83 3.13 0.14 5.90 1.04 -1.26 -4.65 113.70 116.17 2qut s SER 275 Ca 0.75 1.41 -0.18 0.00 0.48 0.00 0.00 55.95 58.41 2qut s SER 275 Cb -0.28 -2.09 0.02 0.00 0.10 0.00 0.00 66.02 63.77 2qut s SER 275 CO 0.35 -2.85 1.73 -0.33 0.98 0.00 0.00 173.24 173.13 2qut h GLU 276 N -1.69 0.16 -0.32 4.02 5.08 -1.89 -0.92 114.58 119.02 2qut h GLU 276 Ca -0.51 -0.01 -0.13 0.00 -1.00 0.00 0.00 59.36 57.71 2qut h GLU 276 Cb 1.30 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 2qut h GLU 276 CO 0.55 0.11 -0.33 1.49 -1.00 0.00 0.00 179.01 179.83 2qut h GLU 277 N 0.17 0.71 -0.13 2.33 4.57 -1.92 -2.70 114.58 117.60 2qut h GLU 277 Ca 0.13 -0.33 -0.00 0.00 -1.18 0.00 0.00 59.36 57.98 2qut h GLU 277 Cb 0.13 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.71 2qut h GLU 277 CO -0.17 0.94 0.07 1.49 -1.18 0.00 0.00 179.01 180.16 2qut h GLU 278 N 0.60 0.18 -0.55 1.92 4.81 -1.83 -0.13 114.58 119.57 2qut h GLU 278 Ca 0.06 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 2qut h GLU 278 Cb 0.85 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.16 2qut h GLU 278 CO 0.07 0.20 0.35 0.00 -0.73 0.00 0.00 179.01 178.90 2qut h ALA 279 N 0.97 1.57 -0.11 2.92 0.00 -1.14 -0.66 119.26 122.82 2qut h ALA 279 Ca 0.05 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 2qut h ALA 279 Cb 0.07 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.64 2qut h ALA 279 CO -0.01 0.38 -0.35 0.77 0.00 0.00 0.00 179.25 180.05 2qut h SER 280 N 0.75 0.50 -0.33 0.00 0.02 -1.13 -2.28 113.55 111.08 2qut h SER 280 Ca 0.20 -0.61 -0.02 0.00 -0.84 0.00 0.00 61.79 60.52 2qut h SER 280 Cb -0.05 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.33 2qut h SER 280 CO -0.04 1.02 0.13 0.40 -1.14 0.00 0.00 176.83 177.19 2qut h ILE 281 N 0.00 1.19 -0.77 3.27 2.04 -0.75 -1.08 117.51 121.41 2qut h ILE 281 Ca -0.01 -0.58 -0.02 0.00 1.00 0.00 0.00 64.86 65.25 2qut h ILE 281 Cb 0.97 0.96 -0.04 0.00 -0.74 0.00 0.00 36.82 37.97 2qut h ILE 281 CO 0.07 0.20 0.41 0.78 0.00 0.00 0.00 178.15 179.62 2qut h ASN 282 N 0.38 0.97 -0.67 1.72 2.35 -1.19 0.05 115.58 119.19 2qut h ASN 282 Ca 0.11 -0.10 -0.05 0.00 -0.55 0.00 0.00 56.30 55.71 2qut h ASN 282 Cb 0.19 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.29 2qut h ASN 282 CO -0.01 0.79 0.24 0.25 -1.65 0.00 0.00 177.43 177.06 2qut h LEU 283 N 1.07 0.94 -0.37 1.61 5.85 -1.23 0.56 115.31 123.74 2qut h LEU 283 Ca 0.27 -0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 2qut h LEU 283 Cb 0.05 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.82 2qut h LEU 283 CO -0.04 0.88 0.16 -1.13 -0.34 0.00 0.00 178.44 177.96 2qut h ASN 284 N 0.96 0.50 -0.66 1.25 -1.24 -0.74 -1.63 115.58 114.02 2qut h ASN 284 Ca 0.22 -0.15 -0.00 0.00 0.71 0.00 0.00 56.30 57.07 2qut h ASN 284 Cb 0.25 -0.13 -0.03 0.00 0.73 0.00 0.00 38.32 39.14 2qut h ASN 284 CO -0.01 0.51 0.41 0.00 -1.29 0.00 0.00 177.43 177.05 2qut h ALA 285 N 1.00 0.84 -0.67 1.57 0.00 -0.66 -0.78 119.26 120.56 2qut h ALA 285 Ca 0.12 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.02 2qut h ALA 285 Cb 0.16 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 2qut h ALA 285 CO -0.01 0.30 0.38 0.82 0.00 0.00 0.00 179.25 180.73 2qut h ILE 286 N 0.89 0.98 0.00 0.00 2.04 -0.60 0.79 117.51 121.61 2qut h ILE 286 Ca 0.24 -0.24 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 2qut h ILE 286 Cb -0.04 0.22 -0.00 0.00 -0.74 0.00 0.00 36.82 36.26 2qut h ILE 286 CO -0.05 0.13 -0.00 0.78 0.00 0.00 0.00 178.15 179.01 2qut h ASN 287 N 0.70 0.00 0.18 1.72 2.35 -0.62 -2.75 115.58 117.16 2qut h ASN 287 Ca 0.30 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.05 2qut h ASN 287 Cb 0.17 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.54 2qut h ASN 287 CO -0.17 0.00 -0.59 0.29 -1.65 0.00 0.00 177.43 175.31 2qut n LYS 288 N -3.10 0.45 -1.65 0.81 5.02 -0.36 -4.75 118.16 114.58 2qut n LYS 288 Ca 0.01 -0.33 -0.48 0.00 -2.02 0.00 0.00 58.31 55.49 2qut n LYS 288 Cb 0.34 -1.49 -0.05 0.00 -0.02 0.00 0.00 35.03 33.81 2qut n LYS 288 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2qut n PRO 290 N 3.61 1.23 -4.15 0.00 -0.04 -1.26 -4.80 135.00 129.59 2qut n PRO 290 Ca 0.18 -0.58 -0.14 0.00 -0.04 0.00 0.00 63.50 62.92 2qut n PRO 290 Cb 0.26 -1.75 -0.11 0.00 -0.04 0.00 0.00 33.50 31.86 2qut n PRO 290 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2qut s LEU 291 N 0.00 2.37 0.01 1.53 1.43 -1.26 -5.11 118.68 117.65 2qut s LEU 291 Ca 0.39 -0.76 -0.30 0.00 -1.03 0.00 0.00 54.13 52.43 2qut s LEU 291 Cb 0.18 -0.29 -0.06 0.00 0.03 0.00 0.00 46.19 46.06 2qut s LEU 291 CO 0.00 -0.24 1.41 -0.22 0.23 0.00 0.00 176.35 177.53 2qut s LEU 292 N -2.25 4.32 -0.31 1.79 0.20 -1.26 -4.99 118.68 116.18 2qut s LEU 292 Ca 0.02 2.15 0.03 0.00 0.69 0.00 0.00 54.13 57.02 2qut s LEU 292 Cb -0.04 -3.56 0.09 0.00 -0.43 0.00 0.00 46.19 42.24 2qut s LEU 292 CO 0.00 -0.72 0.03 -0.54 -0.29 0.00 0.00 176.35 174.82 2qut s LYS 293 N 2.34 1.47 0.00 1.98 1.02 -1.26 -4.96 119.74 120.33 2qut s LYS 293 Ca 0.64 -1.58 0.16 0.00 0.02 0.00 0.00 55.97 55.21 2qut s LYS 293 Cb -0.32 -2.90 0.94 0.00 -0.52 0.00 0.00 37.83 35.03 2qut s LYS 293 CO 0.27 -0.86 1.53 -0.35 -0.92 0.00 0.00 175.35 175.02 2qut n PRO 294 N 4.42 0.89 -4.17 -1.68 -0.04 -1.26 -4.82 135.00 128.34 2qut n PRO 294 Ca -0.01 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.31 2qut n PRO 294 Cb 0.42 -1.28 -0.11 0.00 -0.04 0.00 0.00 33.50 32.50 2qut n PRO 294 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2qut s TRP 295 N -2.00 1.00 0.28 0.54 0.51 -1.26 -4.90 118.94 113.11 2qut s TRP 295 Ca 0.24 -0.70 -0.30 0.00 -2.12 0.00 0.00 56.10 53.22 2qut s TRP 295 Cb 0.11 -0.55 -0.10 0.00 -0.81 0.00 0.00 33.47 32.11 2qut s TRP 295 CO 0.18 -0.03 1.46 0.00 -0.51 0.00 0.00 176.95 178.05 2qut s ALA 296 N -2.63 3.63 -0.42 0.98 0.00 -1.21 -4.83 121.76 117.28 2qut s ALA 296 Ca 0.06 1.40 0.01 0.00 0.00 0.00 0.00 51.96 53.43 2qut s ALA 296 Cb -0.02 -3.57 0.12 0.00 0.00 0.00 0.00 23.12 19.65 2qut s ALA 296 CO -0.01 -0.82 0.18 -0.51 0.00 0.00 0.00 175.76 174.60 2qut s LEU 297 N -0.75 4.92 0.00 0.00 1.43 -1.26 -0.21 118.68 122.81 2qut s LEU 297 Ca 0.58 -2.33 0.00 0.00 -1.03 0.00 0.00 54.13 51.35 2qut s LEU 297 Cb -0.43 -1.72 0.00 0.00 0.03 0.00 0.00 46.19 44.06 2qut s LEU 297 CO 0.48 -0.41 0.00 1.07 0.23 0.00 0.00 176.35 177.71 2qut n THR 298 N 4.10 0.00 -4.37 5.49 5.66 0.07 -4.63 114.28 120.60 2qut n THR 298 Ca 0.03 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 60.78 2qut n THR 298 Cb 0.40 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 69.09 2qut n THR 298 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 175.07 172.74 2qut s PHE 299 N 0.03 2.50 -0.43 1.09 -0.71 -1.26 -1.40 117.98 117.79 2qut s PHE 299 Ca 0.00 -0.27 0.07 0.00 -1.04 0.00 0.00 56.93 55.68 2qut s PHE 299 Cb 0.00 -1.12 0.23 0.00 -1.21 0.00 0.00 43.02 40.92 2qut s PHE 299 CO 0.00 0.64 0.62 0.45 -1.34 0.00 0.00 175.22 175.59 2qut n SER 300 N -0.59 -1.13 -4.83 1.98 2.88 -0.38 0.76 113.62 112.32 2qut n SER 300 Ca -0.07 -2.84 -0.37 0.00 -1.33 0.00 0.00 58.87 54.26 2qut n SER 300 Cb 0.59 0.29 -0.06 0.00 -0.75 0.00 0.00 64.21 64.28 2qut n SER 300 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 2qut s TYR 301 N -0.28 3.60 0.00 0.66 2.02 -0.81 -4.22 117.35 118.33 2qut s TYR 301 Ca 0.33 0.67 0.00 0.00 -0.37 0.00 0.00 57.07 57.71 2qut s TYR 301 Cb 0.15 -2.14 0.00 0.00 -0.40 0.00 0.00 41.96 39.58 2qut s TYR 301 CO -0.16 0.59 0.00 0.41 -1.57 0.00 0.00 175.55 174.82 2qut n GLY 302 N 2.28 -0.28 0.31 0.71 0.00 -1.26 -0.73 105.19 106.23 2qut n GLY 302 Ca -0.16 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.81 2qut n GLY 302 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2qut h ARG 303 N 0.00 1.07 0.00 1.61 3.08 -1.95 -2.30 114.38 115.89 2qut h ARG 303 Ca 0.00 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 59.95 2qut h ARG 303 Cb 0.00 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 29.83 2qut h ARG 303 CO 0.00 0.77 0.00 0.00 -1.07 0.00 0.00 179.97 179.67 2qut n ALA 304 N -2.35 1.35 0.08 0.04 0.00 -1.26 -0.90 120.51 117.47 2qut n ALA 304 Ca 0.08 -0.02 0.02 0.00 0.00 0.00 0.00 53.44 53.51 2qut n ALA 304 Cb 0.07 -1.09 -0.03 0.00 0.00 0.00 0.00 19.45 18.39 2qut n ALA 304 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2qut n LEU 305 N -1.40 0.08 -0.00 0.00 4.77 -0.98 -4.63 117.00 114.83 2qut n LEU 305 Ca 0.02 -0.21 0.04 0.00 -0.03 0.00 0.00 56.01 55.83 2qut n LEU 305 Cb 0.06 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.09 2qut n LEU 305 CO 0.05 0.02 -0.35 0.00 -1.33 0.00 0.00 177.39 175.77 2qut n GLN 306 N -1.42 1.97 -0.11 3.23 6.02 -0.79 -4.57 117.38 121.72 2qut n GLN 306 Ca -0.00 -0.04 -0.08 0.00 -0.01 0.00 0.00 57.00 56.86 2qut n GLN 306 Cb 0.09 -1.07 -0.06 0.00 1.02 0.00 0.00 30.24 30.22 2qut n GLN 306 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2qut h ALA 307 N 0.93 -0.54 -0.57 -1.58 0.00 -1.28 0.88 119.26 117.10 2qut h ALA 307 Ca 0.00 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 2qut h ALA 307 Cb 0.30 1.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 2qut h ALA 307 CO 0.00 -0.72 0.14 0.77 0.00 0.00 0.00 179.25 179.44 2qut h SER 308 N -0.20 0.86 -0.14 0.00 0.02 -1.87 -2.57 113.55 109.65 2qut h SER 308 Ca 0.05 -0.23 0.02 0.00 -0.84 0.00 0.00 61.79 60.79 2qut h SER 308 Cb 0.34 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.63 2qut h SER 308 CO -0.39 0.87 0.01 0.00 -1.14 0.00 0.00 176.83 176.19 2qut h ALA 309 N 1.02 0.13 -0.68 3.77 0.00 -1.70 0.29 119.26 122.09 2qut h ALA 309 Ca 0.18 0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.18 2qut h ALA 309 Cb 0.35 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.13 2qut h ALA 309 CO 0.00 -0.43 0.38 1.25 0.00 0.00 0.00 179.25 180.45 2qut h LEU 310 N 0.07 0.56 -0.33 0.00 5.85 -0.76 -0.49 115.31 120.20 2qut h LEU 310 Ca 0.07 0.03 -0.14 0.00 0.84 0.00 0.00 57.88 58.68 2qut h LEU 310 Cb 0.07 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 2qut h LEU 310 CO -0.10 0.35 -0.33 0.50 -0.34 0.00 0.00 178.44 178.52 2qut h LYS 311 N 0.69 0.81 -0.05 1.25 3.64 -1.01 -2.43 116.57 119.48 2qut h LYS 311 Ca 0.31 -0.43 -0.05 0.00 -1.27 0.00 0.00 60.65 59.21 2qut h LYS 311 Cb 0.21 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 2qut h LYS 311 CO -0.19 1.06 -0.20 0.00 -2.27 0.00 0.00 179.45 177.85 2qut h ALA 312 N 0.74 1.59 -0.04 5.00 0.00 -0.02 -3.00 119.26 123.52 2qut h ALA 312 Ca 0.05 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 2qut h ALA 312 Cb 0.91 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2qut h ALA 312 CO 0.08 0.30 -0.14 2.35 0.00 0.00 0.00 179.25 181.85 2qut h TRP 313 N 0.07 0.22 0.00 0.00 7.01 -0.97 -3.42 115.95 118.87 2qut h TRP 313 Ca 0.01 -0.09 0.00 0.00 2.11 0.00 0.00 58.89 60.92 2qut h TRP 313 Cb 0.39 -0.04 0.00 0.00 -2.10 0.00 0.00 29.16 27.42 2qut h TRP 313 CO 0.00 0.76 0.00 0.41 -2.79 0.00 0.00 178.44 176.82 2qut n GLY 314 N 0.60 0.00 1.44 2.65 0.00 -0.93 -0.94 105.19 108.02 2qut n GLY 314 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2qut n GLY 314 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qut n GLY 315 N 0.31 0.61 3.39 -0.02 0.00 -1.26 -4.78 105.19 103.44 2qut n GLY 315 Ca 0.00 -0.27 -0.35 0.00 0.00 0.00 0.00 46.02 45.40 2qut n GLY 315 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qut s LYS 316 N -0.68 3.53 0.51 1.61 1.02 -0.11 -4.98 119.74 120.64 2qut s LYS 316 Ca 0.00 -0.56 0.22 0.00 0.02 0.00 0.00 55.97 55.65 2qut s LYS 316 Cb 0.00 -3.07 1.32 0.00 -0.52 0.00 0.00 37.83 35.57 2qut s LYS 316 CO 0.00 -0.08 2.01 -0.22 -0.92 0.00 0.00 175.35 176.14 2qut h LYS 317 N 7.78 0.07 -0.70 1.68 3.64 -1.97 -0.85 116.57 126.22 2qut h LYS 317 Ca -0.38 -0.00 0.09 0.00 -1.27 0.00 0.00 60.65 59.09 2qut h LYS 317 Cb 1.17 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.93 2qut h LYS 317 CO 0.60 0.04 0.46 0.93 -2.27 0.00 0.00 179.45 179.22 2qut h GLU 318 N 0.07 0.58 -0.55 1.90 5.08 -1.93 -1.89 114.58 117.83 2qut h GLU 318 Ca 0.23 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 2qut h GLU 318 Cb 0.83 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.95 2qut h GLU 318 CO -0.02 0.39 0.00 0.09 -1.00 0.00 0.00 179.01 178.47 2qut n ASN 319 N -4.49 2.64 -0.03 1.42 3.02 -0.32 -4.56 115.26 112.95 2qut n ASN 319 Ca 0.11 -2.20 -0.14 0.00 -0.03 0.00 0.00 54.58 52.32 2qut n ASN 319 Cb 0.33 -0.40 -0.08 0.00 -0.61 0.00 0.00 39.78 39.01 2qut n ASN 319 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 2qut h LEU 320 N 2.17 -1.59 -1.18 3.41 5.85 -1.44 0.79 115.31 123.32 2qut h LEU 320 Ca 0.00 0.20 0.03 0.00 0.84 0.00 0.00 57.88 58.95 2qut h LEU 320 Cb 0.83 0.64 -0.05 0.00 0.37 0.00 0.00 40.66 42.45 2qut h LEU 320 CO 0.11 -0.45 0.56 0.11 -0.34 0.00 0.00 178.44 178.42 2qut h LYS 321 N -0.52 1.04 -0.49 1.25 1.79 -1.85 -0.01 116.57 117.78 2qut h LYS 321 Ca 0.06 -0.06 -0.07 0.00 -2.18 0.00 0.00 60.65 58.39 2qut h LYS 321 Cb 0.65 -0.23 -0.02 0.00 -1.58 0.00 0.00 32.23 31.05 2qut h LYS 321 CO -0.45 0.69 0.03 0.00 -1.08 0.00 0.00 179.45 178.63 2qut h ALA 322 N 1.50 0.66 -0.31 3.86 0.00 -1.71 -1.50 119.26 121.77 2qut h ALA 322 Ca 0.34 -0.27 -0.14 0.00 0.00 0.00 0.00 54.91 54.84 2qut h ALA 322 Cb 0.01 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2qut h ALA 322 CO -0.10 0.44 -0.38 0.00 0.00 0.00 0.00 179.25 179.22 2qut h ALA 323 N 0.94 0.76 -0.16 0.00 0.00 -0.28 -2.85 119.26 117.68 2qut h ALA 323 Ca 0.14 -0.44 -0.11 0.00 0.00 0.00 0.00 54.91 54.51 2qut h ALA 323 Cb 0.47 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2qut h ALA 323 CO 0.02 0.65 -0.37 1.96 0.00 0.00 0.00 179.25 181.52 2qut h GLN 324 N 0.59 0.33 -0.65 0.00 4.20 -0.90 -2.84 115.11 115.85 2qut h GLN 324 Ca 0.05 -0.15 -0.04 0.00 0.06 0.00 0.00 58.65 58.57 2qut h GLN 324 Cb 0.91 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.65 2qut h GLN 324 CO 0.08 0.66 0.23 1.49 -0.67 0.00 0.00 178.83 180.62 2qut h GLU 325 N 0.28 0.99 -0.45 1.46 4.57 -1.11 -0.55 114.58 119.77 2qut h GLU 325 Ca 0.03 -0.19 -0.02 0.00 -1.18 0.00 0.00 59.36 58.00 2qut h GLU 325 Cb 0.78 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 29.20 2qut h GLU 325 CO 0.06 0.85 0.21 0.93 -1.18 0.00 0.00 179.01 179.88 2qut h GLU 326 N 0.92 0.66 -0.06 1.92 4.39 -1.34 -1.21 114.58 119.86 2qut h GLU 326 Ca 0.21 -0.10 -0.00 0.00 0.34 0.00 0.00 59.36 59.81 2qut h GLU 326 Cb 0.25 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 28.78 2qut h GLU 326 CO -0.01 0.57 0.04 -0.92 -1.16 0.00 0.00 179.01 177.53 2qut h TYR 327 N 0.59 0.08 -0.80 4.33 3.20 -1.26 -2.43 116.97 120.68 2qut h TYR 327 Ca 0.15 0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.09 2qut h TYR 327 Cb 0.14 -0.03 -0.06 0.00 1.54 0.00 0.00 36.73 38.32 2qut h TYR 327 CO -0.01 0.08 0.48 0.28 -1.64 0.00 0.00 178.16 177.36 2qut h VAL 328 N 0.05 1.00 -0.72 1.81 2.07 -0.94 -0.06 116.25 119.46 2qut h VAL 328 Ca 0.02 -0.30 0.01 0.00 0.82 0.00 0.00 66.70 67.25 2qut h VAL 328 Cb 0.03 0.06 -0.04 0.00 -1.52 0.00 0.00 31.29 29.82 2qut h VAL 328 CO -0.00 0.16 0.48 0.11 0.02 0.00 0.00 177.57 178.33 2qut h LYS 329 N 0.87 0.95 -0.18 1.57 1.57 -0.94 0.38 116.57 120.79 2qut h LYS 329 Ca 0.36 -0.06 -0.14 0.00 -1.87 0.00 0.00 60.65 58.94 2qut h LYS 329 Cb 0.20 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 2qut h LYS 329 CO -0.19 0.64 -0.48 0.00 -0.57 0.00 0.00 179.45 178.85 2qut h ARG 330 N 0.98 0.47 -0.72 3.15 2.47 -0.90 -1.44 114.38 118.39 2qut h ARG 330 Ca 0.26 -0.26 -0.03 0.00 -1.26 0.00 0.00 59.98 58.69 2qut h ARG 330 Cb -0.11 0.02 -0.03 0.00 -1.65 0.00 0.00 29.97 28.20 2qut h ARG 330 CO -0.06 0.85 0.34 0.00 0.56 0.00 0.00 179.97 181.66 2qut h ALA 331 N 1.11 0.94 -0.12 0.04 0.00 -0.46 -1.11 119.26 119.66 2qut h ALA 331 Ca 0.02 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 2qut h ALA 331 Cb 0.98 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 2qut h ALA 331 CO 0.09 0.51 -0.01 -0.07 0.00 0.00 0.00 179.25 179.77 2qut h LEU 332 N 1.02 0.21 -0.13 0.00 3.38 -0.74 -1.59 115.31 117.45 2qut h LEU 332 Ca 0.25 -0.32 0.03 0.00 0.09 0.00 0.00 57.88 57.93 2qut h LEU 332 Cb 0.14 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 2qut h LEU 332 CO -0.03 0.49 -0.08 0.00 0.09 0.00 0.00 178.44 178.91 2qut h ALA 333 N 0.74 0.03 0.00 1.53 0.00 -1.08 -1.92 119.26 118.56 2qut h ALA 333 Ca 0.03 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 2qut h ALA 333 Cb 0.38 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2qut h ALA 333 CO 0.01 -0.53 -0.36 -0.91 0.00 0.00 0.00 179.25 177.46 2qut h ASN 334 N -0.08 0.00 -0.71 0.00 2.35 -1.22 0.55 115.58 116.47 2qut h ASN 334 Ca 0.08 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.77 2qut h ASN 334 Cb 0.20 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.54 2qut h ASN 334 CO -0.18 0.36 0.19 -1.28 -1.65 0.00 0.00 177.43 174.87 2qut h SER 335 N 0.00 1.05 -0.15 5.81 0.87 -0.76 -0.36 113.55 120.01 2qut h SER 335 Ca -0.00 -0.22 -0.16 0.00 -1.23 0.00 0.00 61.79 60.17 2qut h SER 335 Cb 0.66 -0.28 -0.00 0.00 -0.44 0.00 0.00 62.40 62.34 2qut h SER 335 CO 0.05 1.00 -0.49 -0.07 -0.53 0.00 0.00 176.83 176.79 2qut h LEU 336 N 1.06 0.79 -0.94 2.23 3.38 -0.73 -3.22 115.31 117.88 2qut h LEU 336 Ca 0.22 -0.40 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 2qut h LEU 336 Cb 0.35 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 2qut h LEU 336 CO -0.00 1.15 0.24 0.00 0.09 0.00 0.00 178.44 179.92 2qut h ALA 337 N 0.88 1.15 0.00 1.53 0.00 -0.36 0.93 119.26 123.39 2qut h ALA 337 Ca 0.03 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2qut h ALA 337 Cb 1.06 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2qut h ALA 337 CO 0.10 0.60 0.00 0.00 0.00 0.00 0.00 179.25 179.95 2qut n GLN 339 N -0.72 -0.25 -1.63 0.00 6.02 -0.69 -4.66 117.38 115.46 2qut n GLN 339 Ca 0.08 -0.38 -0.11 0.00 -0.01 0.00 0.00 57.00 56.58 2qut n GLN 339 Cb 0.04 -0.87 -0.03 0.00 1.02 0.00 0.00 30.24 30.39 2qut n GLN 339 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2qut n GLY 340 N 0.07 0.80 0.69 1.08 0.00 -0.66 -4.88 105.19 102.29 2qut n GLY 340 Ca 0.00 -0.48 0.07 0.00 0.00 0.00 0.00 46.02 45.61 2qut n GLY 340 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qut n LYS 341 N -2.47 2.86 -2.85 1.61 5.02 0.24 -4.89 118.16 117.68 2qut n LYS 341 Ca -0.12 -2.35 -0.40 0.00 -2.02 0.00 0.00 58.31 53.42 2qut n LYS 341 Cb 0.45 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.91 2qut n LYS 341 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 2qut s TYR 342 N -1.78 3.92 -0.04 2.13 5.04 -1.15 -4.77 117.35 120.69 2qut s TYR 342 Ca 0.30 1.77 -0.14 0.00 -2.44 0.00 0.00 57.07 56.56 2qut s TYR 342 Cb 0.21 -2.90 0.03 0.00 0.35 0.00 0.00 41.96 39.64 2qut s TYR 342 CO 0.12 0.43 0.32 0.95 -1.34 0.00 0.00 175.55 176.03 2qut s THR 343 N -0.92 0.04 -0.42 4.34 -4.23 -1.26 -4.97 115.64 108.23 2qut s THR 343 Ca 0.40 -0.36 0.14 0.00 -1.18 0.00 0.00 61.69 60.68 2qut s THR 343 Cb -0.24 -0.58 0.14 0.00 1.34 0.00 0.00 72.50 73.15 2qut s THR 343 CO 0.29 -0.20 1.40 -2.65 -0.54 0.00 0.00 174.62 172.92 2qut n PRO 344 N 1.66 0.09 -0.15 3.99 -0.02 -1.26 -1.47 135.00 137.84 2qut n PRO 344 Ca -0.20 0.58 -0.08 0.00 -2.02 0.00 0.00 63.50 61.78 2qut n PRO 344 Cb 0.56 -1.83 0.00 0.00 -0.02 0.00 0.00 33.50 32.21 2qut n PRO 344 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2qut h SER 345 N 0.00 0.59 0.00 2.55 0.87 -1.95 -3.49 113.55 112.12 2qut h SER 345 Ca 0.00 -0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.44 2qut h SER 345 Cb 0.09 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 61.89 2qut h SER 345 CO 0.00 0.55 0.00 0.61 -0.53 0.00 0.00 176.83 177.46 2qut n GLY 346 N -0.91 0.03 2.35 5.77 0.00 -0.54 -4.90 105.19 107.01 2qut n GLY 346 Ca 0.01 -0.14 -0.16 0.00 0.00 0.00 0.00 46.02 45.73 2qut n GLY 346 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2qut n GLN 347 N 0.00 2.87 -2.74 1.61 6.02 -1.26 -4.33 117.38 119.55 2qut n GLN 347 Ca 0.00 -3.94 -0.00 0.00 -0.01 0.00 0.00 57.00 53.05 2qut n GLN 347 Cb 0.00 -2.01 0.06 0.00 1.02 0.00 0.00 30.24 29.31 2qut n GLN 347 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2qut n ALA 348 N -0.62 2.61 -1.78 -1.58 0.00 -1.26 -5.14 120.51 112.74 2qut n ALA 348 Ca 0.30 -2.52 -0.42 0.00 0.00 0.00 0.00 53.44 50.80 2qut n ALA 348 Cb 0.88 -0.86 -0.03 0.00 0.00 0.00 0.00 19.45 19.44 2qut n ALA 348 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2qut s SER 359 N -3.40 6.48 0.00 0.00 0.15 -1.26 -4.91 113.70 110.77 2qut s SER 359 Ca 0.25 2.66 0.30 0.00 0.70 0.00 0.00 55.95 59.86 2qut s SER 359 Cb 0.34 -2.56 1.49 0.00 -1.71 0.00 0.00 66.02 63.57 2qut s SER 359 CO -0.06 -0.97 2.02 -0.46 1.20 0.00 0.00 173.24 174.97 2qut n ASN 360 N 5.80 0.21 0.01 5.45 0.23 -1.26 -3.21 115.26 122.49 2qut n ASN 360 Ca 0.17 -0.52 0.11 0.00 -0.53 0.00 0.00 54.58 53.81 2qut n ASN 360 Cb 0.39 -0.14 0.49 0.00 -2.08 0.00 0.00 39.78 38.44 2qut n ASN 360 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 2qut n HIS 361 N -1.06 0.08 1.32 -2.53 -0.00 -1.26 -2.29 115.22 109.48 2qut n HIS 361 Ca 0.17 0.03 0.07 0.00 -0.00 0.00 0.00 57.72 57.99 2qut n HIS 361 Cb 0.23 -0.55 0.28 0.00 -0.00 0.00 0.00 29.99 29.95 2qut n HIS 361 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2qut n ALA 362 N -1.53 2.50 0.24 -1.41 0.00 -1.20 -5.31 120.51 113.81 2qut n ALA 362 Ca 0.05 -0.43 0.03 0.00 0.00 0.00 0.00 53.44 53.09 2qut n ALA 362 Cb 0.28 -1.07 0.02 0.00 0.00 0.00 0.00 19.45 18.68 2qut n ALA 362 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16