#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 2.62 -0.02 0.54 3.76 -1.26 -5.13 115.29 115.80 2qut s HIS 2 Ca 0.00 -0.22 -0.04 0.00 -0.15 0.00 0.00 55.06 54.65 2qut s HIS 2 Cb 0.00 -1.56 -0.04 0.00 1.11 0.00 0.00 32.58 32.09 2qut s HIS 2 CO 0.00 0.19 0.20 0.45 -0.85 0.00 0.00 174.74 174.73 2qut s SER 3 N -0.97 6.41 -0.41 1.40 0.15 -1.26 -5.05 113.70 113.98 2qut s SER 3 Ca 0.13 0.42 0.05 0.00 0.70 0.00 0.00 55.95 57.25 2qut s SER 3 Cb -0.11 -2.04 0.19 0.00 -1.71 0.00 0.00 66.02 62.36 2qut s SER 3 CO 0.02 0.28 0.38 1.41 1.20 0.00 0.00 173.24 176.54 2qut n HIS 4 N 1.14 -0.87 -0.49 3.44 8.25 -1.26 -5.10 115.22 120.33 2qut n HIS 4 Ca -0.12 -3.33 -0.21 0.00 -0.26 0.00 0.00 57.72 53.80 2qut n HIS 4 Cb 0.53 0.16 -0.04 0.00 1.12 0.00 0.00 29.99 31.76 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 2.54 0.00 0.16 -0.41 -0.02 -1.26 -4.81 135.00 131.20 2qut n PRO 5 Ca 0.28 0.00 0.04 0.00 -2.02 0.00 0.00 63.50 61.80 2qut n PRO 5 Cb 0.49 -0.50 0.16 0.00 -0.02 0.00 0.00 33.50 33.64 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 2.39 0.80 -3.25 3.55 0.00 -1.99 -3.45 119.26 117.31 2qut h ALA 6 Ca -0.09 -0.41 -0.28 0.00 0.00 0.00 0.00 54.91 54.13 2qut h ALA 6 Cb 0.47 -0.07 -0.22 0.00 0.00 0.00 0.00 17.79 17.96 2qut h ALA 6 CO 0.35 0.57 -0.74 -0.51 0.00 0.00 0.00 179.25 178.92 2qut s LEU 7 N -6.70 2.23 0.58 0.00 1.43 -1.26 -4.95 118.68 110.01 2qut s LEU 7 Ca 0.02 -0.50 -0.04 0.00 -1.03 0.00 0.00 54.13 52.59 2qut s LEU 7 Cb 0.09 -0.18 0.02 0.00 0.03 0.00 0.00 46.19 46.16 2qut s LEU 7 CO 0.72 -0.17 0.86 0.42 0.23 0.00 0.00 176.35 178.41 2qut s THR 8 N -1.23 3.22 0.44 5.49 -4.23 -1.26 -4.89 115.64 113.18 2qut s THR 8 Ca -0.09 -0.27 0.11 0.00 -1.18 0.00 0.00 61.69 60.26 2qut s THR 8 Cb -0.09 -3.27 0.28 0.00 1.34 0.00 0.00 72.50 70.75 2qut s THR 8 CO 0.00 -0.25 2.07 -0.65 -0.54 0.00 0.00 174.62 175.25 2qut h PRO 9 N -0.13 0.38 -0.39 3.99 0.11 -2.01 -0.72 132.00 133.22 2qut h PRO 9 Ca -0.45 -0.02 -0.13 0.00 0.11 0.00 0.00 66.00 65.51 2qut h PRO 9 Cb 1.28 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 2qut h PRO 9 CO 0.58 0.25 -0.27 0.93 -0.21 0.00 0.00 178.00 179.28 2qut h GLU 10 N 0.39 0.88 -0.51 1.05 3.07 -1.99 -0.72 114.58 116.75 2qut h GLU 10 Ca 0.13 -0.42 -0.13 0.00 -0.50 0.00 0.00 59.36 58.45 2qut h GLU 10 Cb 0.05 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 27.94 2qut h GLU 10 CO -0.03 1.07 -0.17 1.96 -1.40 0.00 0.00 179.01 180.44 2qut h GLN 11 N 0.69 1.02 -0.07 2.33 4.20 -1.78 -1.80 115.11 119.70 2qut h GLN 11 Ca 0.08 -0.41 -0.00 0.00 0.06 0.00 0.00 58.65 58.37 2qut h GLN 11 Cb 0.85 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 28.58 2qut h GLN 11 CO 0.07 1.10 0.04 0.87 -0.67 0.00 0.00 178.83 180.24 2qut h LYS 12 N 0.89 0.10 -0.48 1.46 1.57 -1.04 -1.79 116.57 117.28 2qut h LYS 12 Ca 0.12 -0.01 0.07 0.00 -1.87 0.00 0.00 60.65 58.96 2qut h LYS 12 Cb 0.75 -0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.98 2qut h LYS 12 CO 0.06 0.15 0.14 -0.22 -0.57 0.00 0.00 179.45 179.01 2qut h LYS 13 N 0.02 0.29 -0.15 3.15 3.64 -1.00 0.75 116.57 123.27 2qut h LYS 13 Ca 0.02 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.42 2qut h LYS 13 Cb 0.08 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.81 2qut h LYS 13 CO -0.00 0.19 -0.04 1.49 -2.27 0.00 0.00 179.45 178.82 2qut h GLU 14 N 0.30 -0.00 -0.33 1.90 4.81 -1.09 0.54 114.58 120.72 2qut h GLU 14 Ca 0.23 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.44 2qut h GLU 14 Cb 0.27 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 2qut h GLU 14 CO -0.27 -0.00 0.11 -0.07 -0.73 0.00 0.00 179.01 178.05 2qut h LEU 15 N -0.00 0.47 -0.39 1.64 3.38 -0.83 -2.00 115.31 117.57 2qut h LEU 15 Ca 0.07 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 2qut h LEU 15 Cb 0.11 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 2qut h LEU 15 CO -0.16 0.53 0.23 -1.28 0.09 0.00 0.00 178.44 177.85 2qut h SER 16 N 0.37 0.48 -0.63 -0.43 0.87 -0.67 -1.41 113.55 112.14 2qut h SER 16 Ca 0.11 -0.07 0.03 0.00 -1.23 0.00 0.00 61.79 60.63 2qut h SER 16 Cb 0.23 -0.12 -0.04 0.00 -0.44 0.00 0.00 62.40 62.02 2qut h SER 16 CO -0.01 0.41 0.38 0.44 -0.53 0.00 0.00 176.83 177.52 2qut h ASP 17 N 0.51 0.60 0.08 6.23 3.32 -0.79 -1.49 116.42 124.88 2qut h ASP 17 Ca 0.14 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.19 2qut h ASP 17 Cb 0.03 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.46 2qut h ASP 17 CO -0.02 0.41 -0.04 0.40 -1.72 0.00 0.00 179.24 178.27 2qut h ILE 18 N 0.73 0.95 -0.85 0.35 2.04 -1.04 -1.66 117.51 118.04 2qut h ILE 18 Ca 0.26 -0.09 0.04 0.00 1.00 0.00 0.00 64.86 66.07 2qut h ILE 18 Cb 0.06 1.01 -0.05 0.00 -0.74 0.00 0.00 36.82 37.09 2qut h ILE 18 CO -0.12 0.02 0.54 0.00 0.00 0.00 0.00 178.15 178.59 2qut h ALA 19 N 0.77 1.13 -0.38 1.87 0.00 -1.01 -2.15 119.26 119.48 2qut h ALA 19 Ca -0.01 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 2qut h ALA 19 Cb 0.12 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2qut h ALA 19 CO 0.02 0.33 -0.15 0.45 0.00 0.00 0.00 179.25 179.90 2qut h HIS 20 N 1.02 0.78 -0.66 0.00 3.86 -1.13 -2.93 115.15 116.08 2qut h HIS 20 Ca 0.35 -0.15 -0.04 0.00 -1.16 0.00 0.00 60.37 59.37 2qut h HIS 20 Cb 0.07 -0.20 -0.03 0.00 1.06 0.00 0.00 27.41 28.32 2qut h HIS 20 CO -0.03 0.82 0.25 0.00 0.86 0.00 0.00 177.93 179.83 2qut h ARG 21 N 0.63 1.00 -0.92 2.45 3.08 -0.68 -1.22 114.38 118.72 2qut h ARG 21 Ca 0.10 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 2qut h ARG 21 Cb 0.62 -0.16 -0.04 0.00 0.08 0.00 0.00 29.97 30.47 2qut h ARG 21 CO 0.04 0.84 0.52 0.82 -1.07 0.00 0.00 179.97 181.12 2qut h ILE 22 N 0.94 1.26 -0.53 2.04 2.04 -1.29 -3.00 117.51 118.97 2qut h ILE 22 Ca 0.22 -0.62 -0.25 0.00 1.00 0.00 0.00 64.86 65.20 2qut h ILE 22 Cb 0.22 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 36.16 2qut h ILE 22 CO -0.02 0.29 0.13 1.33 0.00 0.00 0.00 178.15 179.88 2qut n VAL 23 N -4.34 2.72 -1.28 1.67 0.24 -1.12 -4.11 118.33 112.12 2qut n VAL 23 Ca 0.10 -2.42 -0.35 0.00 -2.04 0.00 0.00 64.34 59.62 2qut n VAL 23 Cb 0.09 -0.36 0.09 0.00 -1.47 0.00 0.00 33.84 32.19 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 -1.03 -0.55 -1.53 2.33 0.00 -0.48 -4.72 120.51 114.52 2qut n ALA 24 Ca 0.39 -0.24 -0.55 0.00 0.00 0.00 0.00 53.44 53.05 2qut n ALA 24 Cb 1.21 -2.07 -0.06 0.00 0.00 0.00 0.00 19.45 18.52 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 -1.84 0.53 -0.94 0.00 -0.02 -1.26 -0.73 135.00 130.74 2qut n PRO 25 Ca 0.12 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 2qut n PRO 25 Cb 0.50 -1.70 0.00 0.00 -0.02 0.00 0.00 33.50 32.28 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 1.94 0.80 3.72 -1.23 0.00 -1.26 -5.01 105.19 104.14 2qut n GLY 26 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.16 2.71 0.09 1.61 1.02 0.09 -4.41 119.74 120.68 2qut s LYS 27 Ca 0.00 -0.75 0.02 0.00 0.02 0.00 0.00 55.97 55.26 2qut s LYS 27 Cb 0.00 -2.63 -0.01 0.00 -0.52 0.00 0.00 37.83 34.67 2qut s LYS 27 CO 0.00 0.56 0.08 0.41 -0.92 0.00 0.00 175.35 175.48 2qut n GLY 28 N 0.65 3.72 3.39 -3.33 0.00 0.02 -4.62 105.19 105.02 2qut n GLY 28 Ca -0.11 -1.72 -0.32 0.00 0.00 0.00 0.00 46.02 43.88 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 -2.36 2.67 -0.36 -0.61 1.01 0.20 0.02 121.20 121.77 2qut s ILE 29 Ca 0.11 -0.85 -0.16 0.00 0.00 0.00 0.00 60.65 59.75 2qut s ILE 29 Cb 0.01 -2.03 -0.00 0.00 0.01 0.00 0.00 42.46 40.44 2qut s ILE 29 CO 0.07 0.57 0.38 -0.22 0.00 0.00 0.00 174.94 175.75 2qut s LEU 30 N -0.42 4.56 -0.66 2.97 2.96 -0.15 -1.90 118.68 126.03 2qut s LEU 30 Ca 0.04 -0.36 -0.18 0.00 -0.22 0.00 0.00 54.13 53.41 2qut s LEU 30 Cb -0.12 -2.34 0.12 0.00 0.50 0.00 0.00 46.19 44.35 2qut s LEU 30 CO 0.02 -0.40 0.77 0.00 -1.32 0.00 0.00 176.35 175.42 2qut s ALA 31 N 2.03 3.48 -0.28 5.97 0.00 0.18 -1.14 121.76 132.01 2qut s ALA 31 Ca 0.12 -2.42 0.08 0.00 0.00 0.00 0.00 51.96 49.74 2qut s ALA 31 Cb -0.17 -3.60 0.45 0.00 0.00 0.00 0.00 23.12 19.81 2qut s ALA 31 CO 0.12 -2.43 1.29 0.00 0.00 0.00 0.00 175.76 174.74 2qut n ALA 32 N 6.11 4.43 -0.09 0.00 0.00 -0.63 -4.06 120.51 126.26 2qut n ALA 32 Ca -0.03 -3.48 -0.07 0.00 0.00 0.00 0.00 53.44 49.86 2qut n ALA 32 Cb 0.44 -0.47 0.13 0.00 0.00 0.00 0.00 19.45 19.55 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 -0.95 3.41 -4.71 0.00 5.75 -1.03 -4.19 116.55 114.83 2qut n ASP 33 Ca 0.33 -2.71 -0.42 0.00 -0.01 0.00 0.00 54.79 51.98 2qut n ASP 33 Cb 0.86 -0.65 -0.03 0.00 -1.03 0.00 0.00 41.12 40.27 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 -1.78 4.20 1.07 0.11 8.01 -1.26 -4.45 118.70 124.61 2qut s GLU 34 Ca 0.29 2.38 -0.14 0.00 0.01 0.00 0.00 54.97 57.52 2qut s GLU 34 Cb 0.24 -3.20 0.23 0.00 -4.31 0.00 0.00 34.13 27.08 2qut s GLU 34 CO 0.07 -0.64 1.08 -1.54 0.01 0.00 0.00 175.26 174.24 2qut s SER 35 N 1.31 1.98 0.18 -0.19 1.04 -1.26 -4.53 113.70 112.23 2qut s SER 35 Ca 0.71 1.11 -0.14 0.00 0.48 0.00 0.00 55.95 58.11 2qut s SER 35 Cb -0.44 -1.73 0.15 0.00 0.10 0.00 0.00 66.02 64.10 2qut s SER 35 CO 0.31 -3.52 1.73 0.74 0.98 0.00 0.00 173.24 173.48 2qut h THR 36 N -2.16 0.77 -0.02 2.02 2.02 -1.98 0.25 112.91 113.81 2qut h THR 36 Ca -0.54 -0.08 -0.08 0.00 0.77 0.00 0.00 66.41 66.47 2qut h THR 36 Cb 1.33 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 68.24 2qut h THR 36 CO 0.53 0.04 -0.37 1.23 0.37 0.00 0.00 175.52 177.32 2qut h GLY 37 N 0.24 0.04 0.45 2.16 0.00 -2.00 -1.87 103.07 102.08 2qut h GLY 37 Ca 0.22 -0.03 -0.07 0.00 0.00 0.00 0.00 47.33 47.45 2qut h GLY 37 CO -0.28 0.03 -0.26 0.23 0.00 0.00 0.00 176.54 176.27 2qut h SER 38 N 0.03 0.22 0.54 0.19 0.87 -1.58 -3.23 113.55 110.60 2qut h SER 38 Ca 0.00 -0.79 -0.02 0.00 -1.23 0.00 0.00 61.79 59.75 2qut h SER 38 Cb 0.67 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.56 2qut h SER 38 CO 0.05 0.98 -0.11 -0.29 -0.53 0.00 0.00 176.83 176.93 2qut h ILE 39 N -0.51 0.41 -0.80 2.23 6.09 -0.55 -2.86 117.51 121.52 2qut h ILE 39 Ca -0.03 -0.58 0.09 0.00 -1.37 0.00 0.00 64.86 62.96 2qut h ILE 39 Cb 1.02 1.42 -0.07 0.00 0.47 0.00 0.00 36.82 39.66 2qut h ILE 39 CO 0.05 0.11 0.46 0.00 -3.07 0.00 0.00 178.15 175.69 2qut h ALA 40 N 1.89 1.13 -0.32 0.18 0.00 -1.35 0.75 119.26 121.54 2qut h ALA 40 Ca -0.00 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 2qut h ALA 40 Cb 0.41 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2qut h ALA 40 CO 0.01 0.10 -0.05 0.87 0.00 0.00 0.00 179.25 180.18 2qut h LYS 41 N 0.78 0.60 0.01 0.00 1.79 -1.62 -0.02 116.57 118.11 2qut h LYS 41 Ca 0.38 -0.22 0.02 0.00 -2.18 0.00 0.00 60.65 58.65 2qut h LYS 41 Cb 0.33 -0.04 -0.03 0.00 -1.58 0.00 0.00 32.23 30.91 2qut h LYS 41 CO -0.23 0.77 -0.12 0.00 -1.08 0.00 0.00 179.45 178.78 2qut h ARG 42 N 0.39 -0.20 -0.36 3.15 2.47 -1.40 0.32 114.38 118.75 2qut h ARG 42 Ca 0.09 0.01 -0.07 0.00 -1.26 0.00 0.00 59.98 58.75 2qut h ARG 42 Cb 0.53 0.05 -0.02 0.00 -1.65 0.00 0.00 29.97 28.87 2qut h ARG 42 CO 0.03 -0.13 -0.09 -0.07 0.56 0.00 0.00 179.97 180.27 2qut h LEU 43 N -0.21 0.58 -0.84 3.04 3.38 -0.85 -2.68 115.31 117.73 2qut h LEU 43 Ca 0.04 -0.15 -0.11 0.00 0.09 0.00 0.00 57.88 57.75 2qut h LEU 43 Cb 0.26 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2qut h LEU 43 CO -0.12 0.71 -0.35 -0.61 0.09 0.00 0.00 178.44 178.17 2qut h GLN 44 N 0.56 0.45 0.00 1.13 4.15 -0.40 0.18 115.11 121.18 2qut h GLN 44 Ca 0.11 -0.20 0.00 0.00 0.77 0.00 0.00 58.65 59.32 2qut h GLN 44 Cb 0.49 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.17 2qut h GLN 44 CO 0.03 0.74 0.00 0.66 -1.93 0.00 0.00 178.83 178.33 2qut h SER 45 N 0.38 0.00 -0.09 -0.69 4.64 -0.03 -1.10 113.55 116.66 2qut h SER 45 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2qut h SER 45 Cb 0.80 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 2qut h SER 45 CO 0.06 0.00 0.00 2.30 -0.87 0.00 0.00 176.83 178.32 2qut n ILE 46 N -2.71 2.00 -3.66 0.95 -5.35 -0.95 -5.00 119.36 104.64 2qut n ILE 46 Ca -0.01 -2.11 -0.22 0.00 -0.27 0.00 0.00 62.75 60.15 2qut n ILE 46 Cb 0.16 -0.23 0.05 0.00 -1.74 0.00 0.00 39.64 37.88 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 -1.10 -0.34 3.19 3.28 0.00 -0.42 -4.70 105.19 105.10 2qut n GLY 47 Ca 0.17 0.13 -0.29 0.00 0.00 0.00 0.00 46.02 46.04 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 -3.55 1.71 0.17 2.61 2.01 0.60 -4.98 115.64 114.21 2qut s THR 48 Ca 0.10 -0.86 -0.31 0.00 0.31 0.00 0.00 61.69 60.92 2qut s THR 48 Cb -0.05 -1.46 -0.10 0.00 0.01 0.00 0.00 72.50 70.90 2qut s THR 48 CO 0.79 0.48 1.56 -0.70 -0.69 0.00 0.00 174.62 176.07 2qut s GLU 49 N 0.03 4.22 -1.27 4.92 2.12 -1.26 -3.94 118.70 123.51 2qut s GLU 49 Ca -0.06 2.36 -0.19 0.00 0.36 0.00 0.00 54.97 57.44 2qut s GLU 49 Cb -0.13 -3.15 0.06 0.00 0.26 0.00 0.00 34.13 31.16 2qut s GLU 49 CO 0.03 -0.60 1.73 1.21 -0.54 0.00 0.00 175.26 177.10 2qut s ASN 50 N 1.10 6.70 0.24 -1.70 2.47 -1.26 -4.75 114.94 117.75 2qut s ASN 50 Ca 0.69 -2.32 0.09 0.00 0.42 0.00 0.00 52.86 51.74 2qut s ASN 50 Cb -0.44 -2.58 -0.04 0.00 -1.45 0.00 0.00 41.25 36.74 2qut s ASN 50 CO 0.32 -1.31 0.04 0.42 -3.72 0.00 0.00 177.10 172.84 2qut s THR 51 N 4.70 3.71 0.23 -5.21 -4.23 -1.26 -5.01 115.64 108.56 2qut s THR 51 Ca 0.54 -1.71 -0.07 0.00 -1.18 0.00 0.00 61.69 59.27 2qut s THR 51 Cb 0.03 -2.96 0.18 0.00 1.34 0.00 0.00 72.50 71.09 2qut s THR 51 CO 0.07 -0.32 1.82 -0.08 -0.54 0.00 0.00 174.62 175.57 2qut h GLU 52 N 1.97 0.76 -0.37 3.99 4.81 -1.99 -0.92 114.58 122.83 2qut h GLU 52 Ca -0.46 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 58.71 2qut h GLU 52 Cb 1.24 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 30.43 2qut h GLU 52 CO 0.60 0.50 0.16 1.49 -0.73 0.00 0.00 179.01 181.03 2qut h GLU 53 N 0.78 0.54 -0.40 1.92 4.57 -1.96 0.15 114.58 120.18 2qut h GLU 53 Ca 0.35 -0.09 -0.05 0.00 -1.18 0.00 0.00 59.36 58.39 2qut h GLU 53 Cb 0.24 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.72 2qut h GLU 53 CO -0.20 0.50 0.02 -0.91 -1.18 0.00 0.00 179.01 177.24 2qut h ASN 54 N 0.45 0.59 -0.40 1.04 2.35 -1.75 0.30 115.58 118.17 2qut h ASN 54 Ca 0.12 -0.11 -0.14 0.00 -0.55 0.00 0.00 56.30 55.62 2qut h ASN 54 Cb 0.15 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 2qut h ASN 54 CO -0.01 0.64 -0.31 0.03 -1.65 0.00 0.00 177.43 176.13 2qut h ARG 55 N 0.60 0.91 -0.42 0.81 3.08 -0.87 -0.93 114.38 117.56 2qut h ARG 55 Ca 0.13 -0.45 -0.02 0.00 0.07 0.00 0.00 59.98 59.71 2qut h ARG 55 Cb 0.34 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.38 2qut h ARG 55 CO 0.01 1.10 0.18 -0.09 -1.07 0.00 0.00 179.97 180.10 2qut h ARG 56 N 0.73 0.63 -0.04 0.04 2.43 0.01 -1.45 114.38 116.72 2qut h ARG 56 Ca 0.07 -0.11 -0.00 0.00 -0.81 0.00 0.00 59.98 59.13 2qut h ARG 56 Cb 0.89 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.34 2qut h ARG 56 CO 0.08 0.57 0.02 0.35 -1.51 0.00 0.00 179.97 179.48 2qut h PHE 57 N 0.54 0.06 -0.45 2.20 3.57 -0.31 0.77 116.94 123.32 2qut h PHE 57 Ca 0.14 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.68 2qut h PHE 57 Cb 0.17 -0.02 -0.04 0.00 2.79 0.00 0.00 35.95 38.85 2qut h PHE 57 CO -0.00 0.19 0.21 -0.92 -2.23 0.00 0.00 178.31 175.56 2qut h TYR 58 N -0.09 0.39 -0.71 0.41 3.20 -1.10 0.24 116.97 119.31 2qut h TYR 58 Ca 0.01 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.85 2qut h TYR 58 Cb 0.15 -0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.28 2qut h TYR 58 CO -0.02 0.19 0.23 0.00 -1.64 0.00 0.00 178.16 176.91 2qut h ARG 59 N 0.43 1.09 -0.56 1.82 -0.00 -1.11 -2.17 114.38 113.87 2qut h ARG 59 Ca 0.20 -0.22 -0.01 0.00 -0.50 0.00 0.00 59.98 59.45 2qut h ARG 59 Cb 0.13 -0.16 -0.03 0.00 0.00 0.00 0.00 29.97 29.90 2qut h ARG 59 CO -0.15 0.93 0.32 0.37 0.00 0.00 0.00 179.97 181.44 2qut h GLN 60 N 1.06 0.77 -0.74 0.04 4.15 0.02 -0.17 115.11 120.24 2qut h GLN 60 Ca 0.23 -0.08 0.13 0.00 0.77 0.00 0.00 58.65 59.70 2qut h GLN 60 Cb 0.28 -0.16 -0.09 0.00 0.21 0.00 0.00 27.48 27.73 2qut h GLN 60 CO -0.01 0.57 0.32 1.25 -1.93 0.00 0.00 178.83 179.03 2qut h LEU 61 N 0.75 0.33 -0.01 -2.39 6.46 0.02 0.33 115.31 120.81 2qut h LEU 61 Ca 0.20 0.10 -0.03 0.00 -0.12 0.00 0.00 57.88 58.02 2qut h LEU 61 Cb 0.01 0.06 0.00 0.00 -0.73 0.00 0.00 40.66 40.00 2qut h LEU 61 CO -0.04 0.15 -0.12 -0.07 -0.62 0.00 0.00 178.44 177.74 2qut h LEU 62 N 0.49 0.12 -1.56 2.25 3.38 -0.93 -3.32 115.31 115.73 2qut h LEU 62 Ca 0.40 -0.75 -0.03 0.00 0.09 0.00 0.00 57.88 57.59 2qut h LEU 62 Cb 0.55 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 2qut h LEU 62 CO -0.36 0.85 -0.13 -0.07 0.09 0.00 0.00 178.44 178.82 2qut h LEU 63 N -0.60 0.00 -3.65 1.67 3.38 -0.79 -3.12 115.31 112.19 2qut h LEU 63 Ca -0.01 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.65 2qut h LEU 63 Cb 0.86 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 41.43 2qut h LEU 63 CO 0.02 0.13 0.26 0.35 0.09 0.00 0.00 178.44 179.29 2qut n THR 64 N -3.38 2.85 -1.11 0.22 -2.24 0.09 -4.75 114.28 105.96 2qut n THR 64 Ca -0.01 -2.25 -0.31 0.00 -2.27 0.00 0.00 64.05 59.22 2qut n THR 64 Cb 0.32 -0.38 0.13 0.00 -2.10 0.00 0.00 70.33 68.29 2qut n THR 64 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qut s ALA 65 N -3.22 1.78 1.06 6.98 0.00 -1.18 -4.97 121.76 122.21 2qut s ALA 65 Ca 0.51 0.21 -0.12 0.00 0.00 0.00 0.00 51.96 52.55 2qut s ALA 65 Cb 0.44 -3.28 0.19 0.00 0.00 0.00 0.00 23.12 20.47 2qut s ALA 65 CO 0.06 -2.21 0.88 -0.40 0.00 0.00 0.00 175.76 174.09 2qut n ASP 66 N -3.82 -1.12 0.00 0.00 5.68 -1.26 -4.84 116.55 111.19 2qut n ASP 66 Ca 0.09 0.10 0.00 0.00 -0.50 0.00 0.00 54.79 54.48 2qut n ASP 66 Cb 0.54 -1.30 0.00 0.00 -1.14 0.00 0.00 41.12 39.22 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 -3.93 0.00 0.31 -1.12 8.00 -1.26 -2.47 116.55 116.09 2qut n ASP 67 Ca 0.06 0.39 0.20 0.00 0.71 0.00 0.00 54.79 56.16 2qut n ASP 67 Cb 0.54 -0.39 0.98 0.00 -0.02 0.00 0.00 41.12 42.23 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 -1.85 114.38 112.37 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 0.00 -0.68 -0.39 -1.07 0.00 0.00 179.97 177.83 2qut h VAL 69 N 0.00 0.00 -0.59 2.04 -1.51 -1.82 -3.39 116.25 110.98 2qut h VAL 69 Ca -0.00 -0.88 0.12 0.00 -1.23 0.00 0.00 66.70 64.71 2qut h VAL 69 Cb 0.24 1.52 -0.11 0.00 -2.13 0.00 0.00 31.29 30.80 2qut h VAL 69 CO 0.00 0.00 -0.16 0.78 -1.23 0.00 0.00 177.57 176.96 2qut h ASN 70 N 0.00 -0.58 0.95 4.19 4.21 -1.54 0.29 115.58 123.10 2qut h ASN 70 Ca 0.00 0.18 0.00 0.00 1.21 0.00 0.00 56.30 57.69 2qut h ASN 70 Cb 0.94 0.38 0.00 0.00 -1.12 0.00 0.00 38.32 38.52 2qut h ASN 70 CO 0.00 -0.20 0.00 -2.65 -1.29 0.00 0.00 177.43 173.29 2qut n PRO 71 N -5.41 0.19 -0.02 0.81 -0.02 -1.26 -3.12 135.00 126.17 2qut n PRO 71 Ca 0.07 0.32 -0.08 0.00 -2.02 0.00 0.00 63.50 61.78 2qut n PRO 71 Cb 0.31 -1.80 -0.14 0.00 -0.02 0.00 0.00 33.50 31.85 2qut n PRO 71 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qut s ILE 73 N -2.60 4.28 -0.20 0.00 -1.09 0.39 -0.80 121.20 121.19 2qut s ILE 73 Ca -0.05 -1.04 0.20 0.00 -2.23 0.00 0.00 60.65 57.53 2qut s ILE 73 Cb 0.08 -3.45 -0.03 0.00 -1.58 0.00 0.00 42.46 37.49 2qut s ILE 73 CO 0.82 -0.27 1.02 1.23 -1.23 0.00 0.00 174.94 176.52 2qut h GLY 74 N 8.37 0.00 -3.23 6.18 0.00 -0.56 -3.40 103.07 110.44 2qut h GLY 74 Ca -0.24 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.05 2qut h GLY 74 CO 0.67 0.00 0.08 -0.32 0.00 0.00 0.00 176.54 176.97 2qut s GLY 75 N -4.52 -0.47 -0.06 4.60 0.00 -1.06 -1.44 107.32 104.37 2qut s GLY 75 Ca -0.01 0.40 -0.01 0.00 0.00 0.00 0.00 44.72 45.11 2qut s GLY 75 CO 0.79 0.10 -0.00 0.14 0.00 0.00 0.00 173.10 174.12 2qut s VAL 76 N -3.31 0.34 -0.14 1.40 1.01 -0.71 -0.98 120.40 118.02 2qut s VAL 76 Ca -0.01 0.09 -0.17 0.00 0.00 0.00 0.00 61.98 61.89 2qut s VAL 76 Cb -0.00 -0.47 -0.04 0.00 0.00 0.00 0.00 36.38 35.86 2qut s VAL 76 CO -0.09 0.23 0.45 -0.63 0.00 0.00 0.00 175.10 175.06 2qut s ILE 77 N 1.65 5.20 0.29 2.22 1.01 -0.29 -0.19 121.20 131.09 2qut s ILE 77 Ca -0.00 0.88 0.11 0.00 0.00 0.00 0.00 60.65 61.64 2qut s ILE 77 Cb -0.13 -3.79 -0.05 0.00 0.01 0.00 0.00 42.46 38.50 2qut s ILE 77 CO -0.04 0.32 -0.15 -0.76 0.00 0.00 0.00 174.94 174.32 2qut s LEU 78 N 0.71 2.70 0.22 2.97 1.43 0.09 -1.60 118.68 125.20 2qut s LEU 78 Ca 0.24 -1.02 -0.04 0.00 -1.03 0.00 0.00 54.13 52.28 2qut s LEU 78 Cb -0.15 -1.16 -0.05 0.00 0.03 0.00 0.00 46.19 44.86 2qut s LEU 78 CO 0.09 -0.03 0.46 0.12 0.23 0.00 0.00 176.35 177.23 2qut s PHE 79 N -2.51 3.47 0.15 0.29 5.36 -1.26 -1.39 117.98 122.09 2qut s PHE 79 Ca 0.31 0.55 -0.28 0.00 -0.96 0.00 0.00 56.93 56.55 2qut s PHE 79 Cb -0.03 -2.02 -0.04 0.00 -0.34 0.00 0.00 43.02 40.58 2qut s PHE 79 CO 0.16 0.31 1.44 1.58 -1.46 0.00 0.00 175.22 177.24 2qut n HIS 80 N -0.53 -0.38 -0.24 10.12 -0.00 -1.26 -1.29 115.22 121.65 2qut n HIS 80 Ca -0.03 1.16 0.00 0.00 -0.00 0.00 0.00 57.72 58.86 2qut n HIS 80 Cb 0.53 -0.60 0.07 0.00 -0.00 0.00 0.00 29.99 30.00 2qut n HIS 80 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 176.34 177.83 2qut h GLU 81 N 0.00 -0.02 -0.18 1.57 4.81 -1.98 -1.21 114.58 117.58 2qut h GLU 81 Ca 0.16 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.34 2qut h GLU 81 Cb 0.40 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 2qut h GLU 81 CO -0.88 -0.01 -0.14 1.15 -0.73 0.00 0.00 179.01 178.40 2qut h THR 82 N -0.02 1.20 0.00 0.32 2.02 -1.58 -2.30 112.91 112.55 2qut h THR 82 Ca 0.33 -0.87 -0.00 0.00 0.77 0.00 0.00 66.41 66.63 2qut h THR 82 Cb 0.52 1.22 -0.00 0.00 -1.74 0.00 0.00 68.15 68.15 2qut h THR 82 CO -0.72 0.27 -0.01 0.25 0.37 0.00 0.00 175.52 175.68 2qut h LEU 83 N 0.27 0.00 -3.12 2.58 5.85 -0.77 -2.05 115.31 118.07 2qut h LEU 83 Ca 0.05 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.77 2qut h LEU 83 Cb 0.42 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.45 2qut h LEU 83 CO 0.03 0.01 0.00 -1.22 -0.34 0.00 0.00 178.44 176.92 2qut n TYR 84 N -3.67 0.88 -3.33 1.25 4.01 -0.87 -4.55 117.16 110.87 2qut n TYR 84 Ca -0.03 -0.70 -0.19 0.00 -0.16 0.00 0.00 57.90 56.82 2qut n TYR 84 Cb 0.10 -0.21 -0.01 0.00 -0.31 0.00 0.00 39.34 38.91 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 2.85 0.16 -0.72 -0.21 -0.77 -5.00 119.66 113.92 2qut s GLN 85 Ca 0.37 -1.23 0.07 0.00 0.02 0.00 0.00 55.36 54.59 2qut s GLN 85 Cb 0.26 -2.68 -0.04 0.00 1.00 0.00 0.00 33.01 31.55 2qut s GLN 85 CO 0.13 -0.12 -0.16 0.15 -2.12 0.00 0.00 175.29 173.18 2qut s LYS 86 N -4.22 1.20 0.87 2.91 1.02 -1.26 -1.42 119.74 118.85 2qut s LYS 86 Ca 0.49 -1.39 -0.12 0.00 0.02 0.00 0.00 55.97 54.97 2qut s LYS 86 Cb -0.08 -1.14 0.15 0.00 -0.52 0.00 0.00 37.83 36.24 2qut s LYS 86 CO 0.31 0.22 1.22 0.00 -0.92 0.00 0.00 175.35 176.18 2qut s ALA 87 N -2.28 2.60 0.59 5.17 0.00 -0.11 -4.88 121.76 122.85 2qut s ALA 87 Ca 0.15 -1.13 0.30 0.00 0.00 0.00 0.00 51.96 51.28 2qut s ALA 87 Cb -0.04 -2.70 1.82 0.00 0.00 0.00 0.00 23.12 22.20 2qut s ALA 87 CO 0.05 -2.05 2.23 -0.44 0.00 0.00 0.00 175.76 175.56 2qut h ASP 88 N -1.28 0.00 -0.16 0.00 3.32 -1.98 -0.68 116.42 115.64 2qut h ASP 88 Ca -0.44 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.61 2qut h ASP 88 Cb 1.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.82 2qut h ASP 88 CO 0.46 0.00 0.00 -0.90 -1.72 0.00 0.00 179.24 177.08 2qut n ASP 89 N -3.80 0.99 0.00 6.45 5.68 -1.26 -4.89 116.55 119.72 2qut n ASP 89 Ca -0.02 -1.86 0.00 0.00 -0.50 0.00 0.00 54.79 52.41 2qut n ASP 89 Cb 0.13 -0.11 0.00 0.00 -1.14 0.00 0.00 41.12 40.01 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 0.86 1.94 3.70 6.12 0.00 -0.26 -5.02 105.19 112.54 2qut n GLY 90 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.16 4.49 0.52 1.61 0.52 -1.26 -4.73 118.95 119.94 2qut s ARG 91 Ca 0.00 1.49 -0.22 0.00 -0.52 0.00 0.00 55.73 56.48 2qut s ARG 91 Cb 0.00 -3.47 -0.06 0.00 0.52 0.00 0.00 34.95 31.95 2qut s ARG 91 CO 0.00 -0.17 1.33 -1.25 0.02 0.00 0.00 175.30 175.23 2qut s PRO 92 N 1.33 3.34 0.37 3.54 0.04 -1.26 -0.94 135.00 141.42 2qut s PRO 92 Ca 0.53 2.17 0.13 0.00 0.04 0.00 0.00 61.00 63.86 2qut s PRO 92 Cb -0.22 -2.34 0.94 0.00 0.04 0.00 0.00 34.50 32.91 2qut s PRO 92 CO 0.26 -1.01 1.84 0.74 0.04 0.00 0.00 177.00 178.86 2qut h PHE 93 N 1.70 0.74 -0.73 0.56 0.04 -1.50 -0.44 116.94 117.31 2qut h PHE 93 Ca -0.51 0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.29 2qut h PHE 93 Cb 1.28 -0.23 -0.04 0.00 2.20 0.00 0.00 35.95 39.17 2qut h PHE 93 CO 0.48 0.20 0.48 -1.35 -0.60 0.00 0.00 178.31 177.52 2qut h PRO 94 N 0.56 0.96 -0.32 1.51 0.11 -1.85 -0.21 132.00 132.77 2qut h PRO 94 Ca 0.50 -0.06 -0.16 0.00 0.11 0.00 0.00 66.00 66.38 2qut h PRO 94 Cb 1.01 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 31.90 2qut h PRO 94 CO -0.24 0.64 -0.43 0.37 -0.21 0.00 0.00 178.00 178.13 2qut h GLN 95 N 0.99 0.82 0.29 1.05 4.15 -1.45 -1.43 115.11 119.54 2qut h GLN 95 Ca 0.27 -0.45 -0.01 0.00 0.77 0.00 0.00 58.65 59.22 2qut h GLN 95 Cb -0.11 0.03 -0.00 0.00 0.21 0.00 0.00 27.48 27.61 2qut h GLN 95 CO -0.06 1.09 -0.16 0.28 -1.93 0.00 0.00 178.83 178.05 2qut h VAL 96 N 0.66 0.67 -0.12 2.39 2.07 -0.74 0.01 116.25 121.20 2qut h VAL 96 Ca 0.04 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.60 2qut h VAL 96 Cb 1.01 0.67 -0.04 0.00 -1.52 0.00 0.00 31.29 31.41 2qut h VAL 96 CO 0.10 0.00 -0.13 0.40 0.02 0.00 0.00 177.57 177.96 2qut h ILE 97 N -0.42 0.65 -0.83 4.57 2.04 -1.02 -2.71 117.51 119.78 2qut h ILE 97 Ca -0.04 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.83 2qut h ILE 97 Cb 0.34 0.65 -0.04 0.00 -0.74 0.00 0.00 36.82 37.03 2qut h ILE 97 CO 0.05 0.00 0.54 0.11 0.00 0.00 0.00 178.15 178.85 2qut h LYS 98 N -0.16 1.10 0.00 2.37 1.57 -1.12 -1.70 116.57 118.63 2qut h LYS 98 Ca 0.09 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2qut h LYS 98 Cb 0.28 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.35 2qut h LYS 98 CO -0.21 0.74 0.00 0.66 -0.57 0.00 0.00 179.45 180.07 2qut h SER 99 N 1.13 0.00 -0.64 0.86 4.64 -0.68 0.29 113.55 119.14 2qut h SER 99 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 2qut h SER 99 Cb -0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 61.98 2qut h SER 99 CO -0.06 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.19 2qut n LYS 100 N -2.85 2.89 -0.85 4.77 5.02 -0.74 -4.91 118.16 121.48 2qut n LYS 100 Ca -0.02 -2.47 0.00 0.00 -2.02 0.00 0.00 58.31 53.81 2qut n LYS 100 Cb 0.13 -1.64 0.00 0.00 -0.02 0.00 0.00 35.03 33.50 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 1.38 0.53 3.91 0.72 0.00 0.09 -4.63 105.19 107.19 2qut n GLY 101 Ca 0.23 -0.43 -0.29 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.39 1.99 0.05 -0.02 0.00 -0.72 -4.82 107.32 101.41 2qut s GLY 102 Ca 0.00 -0.94 -0.14 0.00 0.00 0.00 0.00 44.72 43.64 2qut s GLY 102 CO 0.00 -0.93 0.45 0.14 0.00 0.00 0.00 173.10 172.76 2qut s VAL 103 N -1.59 4.98 -0.11 1.40 1.01 -0.52 -3.61 120.40 121.96 2qut s VAL 103 Ca 0.34 0.80 -0.18 0.00 0.00 0.00 0.00 61.98 62.94 2qut s VAL 103 Cb -0.12 -3.72 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 2qut s VAL 103 CO 0.27 0.45 0.48 -0.69 0.00 0.00 0.00 175.10 175.61 2qut s VAL 104 N -1.22 5.18 0.22 2.92 1.01 -1.26 -1.74 120.40 125.51 2qut s VAL 104 Ca 0.29 0.95 0.11 0.00 0.00 0.00 0.00 61.98 63.33 2qut s VAL 104 Cb -0.16 -3.82 -0.05 0.00 0.00 0.00 0.00 36.38 32.36 2qut s VAL 104 CO 0.16 0.33 -0.20 -0.83 0.00 0.00 0.00 175.10 174.56 2qut s GLY 105 N 0.58 1.76 -0.05 4.51 0.00 0.73 -0.34 107.32 114.51 2qut s GLY 105 Ca 0.26 -1.69 0.00 0.00 0.00 0.00 0.00 44.72 43.29 2qut s GLY 105 CO 0.10 -1.74 -0.02 -1.50 0.00 0.00 0.00 173.10 169.94 2qut s ILE 106 N -1.94 0.40 -0.01 0.90 1.10 -0.35 -0.73 121.20 120.57 2qut s ILE 106 Ca 0.24 -0.01 -0.30 0.00 -0.51 0.00 0.00 60.65 60.07 2qut s ILE 106 Cb -0.07 -0.47 -0.04 0.00 0.15 0.00 0.00 42.46 42.02 2qut s ILE 106 CO 0.12 0.21 1.15 -0.75 -2.11 0.00 0.00 174.94 173.56 2qut s LYS 107 N 1.18 4.42 0.00 3.50 2.36 -0.49 -1.87 119.74 128.85 2qut s LYS 107 Ca -0.07 1.65 0.03 0.00 -2.55 0.00 0.00 55.97 55.03 2qut s LYS 107 Cb -0.14 -3.46 0.00 0.00 -1.05 0.00 0.00 37.83 33.19 2qut s LYS 107 CO -0.02 -0.30 0.42 1.33 1.55 0.00 0.00 175.35 178.34 2qut n VAL 108 N 4.23 0.00 -1.61 4.02 0.24 -0.59 -4.60 118.33 120.02 2qut n VAL 108 Ca 0.09 -0.47 -0.31 0.00 -2.04 0.00 0.00 64.34 61.61 2qut n VAL 108 Cb 0.47 1.04 0.05 0.00 -1.47 0.00 0.00 33.84 33.94 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 -0.69 5.28 -0.35 -1.34 1.47 -1.25 -4.83 116.67 114.96 2qut s ASP 109 Ca 0.03 1.51 0.06 0.00 1.18 0.00 0.00 52.55 55.33 2qut s ASP 109 Cb 0.03 -2.37 0.46 0.00 -0.34 0.00 0.00 42.92 40.70 2qut s ASP 109 CO 0.08 -1.49 1.36 0.29 0.68 0.00 0.00 175.17 176.08 2qut n LYS 110 N -3.15 3.17 0.00 2.11 5.02 0.40 -4.95 118.16 120.76 2qut n LYS 110 Ca 0.07 -3.88 0.00 0.00 -2.02 0.00 0.00 58.31 52.48 2qut n LYS 110 Cb 0.54 -2.20 0.00 0.00 -0.02 0.00 0.00 35.03 33.36 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 -0.81 -1.40 3.89 0.72 0.00 -1.26 -4.70 105.19 101.63 2qut n GLY 111 Ca 0.45 -1.58 -0.29 0.00 0.00 0.00 0.00 46.02 44.59 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 -2.25 4.82 0.03 1.61 -7.23 -1.26 -1.67 120.40 114.45 2qut s VAL 112 Ca 0.00 0.49 0.01 0.00 -1.81 0.00 0.00 61.98 60.67 2qut s VAL 112 Cb 0.00 -3.79 -0.02 0.00 0.56 0.00 0.00 36.38 33.13 2qut s VAL 112 CO 0.00 -0.70 -0.05 0.68 -0.31 0.00 0.00 175.10 174.72 2qut s VAL 113 N -2.58 0.32 0.26 1.32 -7.23 -0.21 -4.88 120.40 107.40 2qut s VAL 113 Ca 0.50 -0.90 -0.29 0.00 -1.81 0.00 0.00 61.98 59.48 2qut s VAL 113 Cb -0.10 -0.41 -0.09 0.00 0.56 0.00 0.00 36.38 36.33 2qut s VAL 113 CO 0.38 -0.38 1.21 -2.16 -0.31 0.00 0.00 175.10 173.84 2qut s PRO 114 N -1.36 4.49 -0.38 4.82 0.04 -1.26 -1.13 135.00 140.22 2qut s PRO 114 Ca -0.11 1.98 -0.19 0.00 0.04 0.00 0.00 61.00 62.71 2qut s PRO 114 Cb -0.09 -3.17 0.01 0.00 0.04 0.00 0.00 34.50 31.29 2qut s PRO 114 CO -0.00 -0.04 0.58 -0.51 0.04 0.00 0.00 177.00 177.07 2qut s LEU 115 N -1.06 4.39 0.42 -3.56 1.43 0.11 -4.83 118.68 115.57 2qut s LEU 115 Ca 0.49 -0.09 -0.26 0.00 -1.03 0.00 0.00 54.13 53.24 2qut s LEU 115 Cb -0.35 -2.67 -0.09 0.00 0.03 0.00 0.00 46.19 43.11 2qut s LEU 115 CO 0.43 -0.60 1.41 0.00 0.23 0.00 0.00 176.35 177.82 2qut s ALA 116 N 2.58 3.33 0.00 4.21 0.00 -1.26 -2.73 121.76 127.89 2qut s ALA 116 Ca 0.21 1.43 0.00 0.00 0.00 0.00 0.00 51.96 53.60 2qut s ALA 116 Cb -0.15 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.40 2qut s ALA 116 CO 0.15 -1.06 0.00 0.41 0.00 0.00 0.00 175.76 175.26 2qut n GLY 117 N 0.58 0.65 3.57 0.00 0.00 -1.26 -5.05 105.19 103.69 2qut n GLY 117 Ca 0.04 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.12 2.20 -1.31 2.61 -4.23 -1.11 -5.04 115.64 106.65 2qut s THR 118 Ca 0.00 -2.12 -0.13 0.00 -1.18 0.00 0.00 61.69 58.26 2qut s THR 118 Cb 0.00 -2.76 0.12 0.00 1.34 0.00 0.00 72.50 71.20 2qut s THR 118 CO 0.00 -0.14 1.84 -3.20 -0.54 0.00 0.00 174.62 172.57 2qut n ASN 119 N -0.86 4.80 -0.91 3.99 4.05 -1.26 -4.42 115.26 120.65 2qut n ASN 119 Ca -0.05 -2.98 -0.11 0.00 0.45 0.00 0.00 54.58 51.89 2qut n ASN 119 Cb 0.64 -1.59 -0.04 0.00 1.23 0.00 0.00 39.78 40.02 2qut n ASN 119 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2qut n GLY 120 N 3.86 0.99 3.91 8.20 0.00 -1.26 -5.00 105.19 115.88 2qut n GLY 120 Ca 0.44 -0.51 -0.27 0.00 0.00 0.00 0.00 46.02 45.67 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 -3.21 3.30 0.21 1.61 2.02 -1.26 -4.96 118.70 116.41 2qut s GLU 121 Ca 0.00 0.17 0.00 0.00 0.02 0.00 0.00 54.97 55.16 2qut s GLU 121 Cb 0.00 -2.31 -0.05 0.00 0.10 0.00 0.00 34.13 31.88 2qut s GLU 121 CO 0.00 -0.43 0.08 0.95 0.02 0.00 0.00 175.26 175.88 2qut s THR 122 N -2.88 0.37 0.19 3.63 -4.23 -1.26 -0.72 115.64 110.75 2qut s THR 122 Ca 0.51 -1.98 0.02 0.00 -1.18 0.00 0.00 61.69 59.05 2qut s THR 122 Cb -0.10 -2.40 -0.01 0.00 1.34 0.00 0.00 72.50 71.33 2qut s THR 122 CO 0.46 -0.17 0.06 1.07 -0.54 0.00 0.00 174.62 175.49 2qut n THR 123 N -0.31 0.00 -4.63 3.99 5.66 -0.29 -4.80 114.28 113.91 2qut n THR 123 Ca -0.02 -1.10 -0.23 0.00 -3.05 0.00 0.00 64.05 59.65 2qut n THR 123 Cb 0.65 0.37 -0.14 0.00 -1.55 0.00 0.00 70.33 69.66 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 -2.20 1.35 0.42 1.09 2.01 -1.26 -1.05 115.64 116.00 2qut s THR 124 Ca 0.08 -0.92 0.08 0.00 0.31 0.00 0.00 61.69 61.24 2qut s THR 124 Cb 0.00 -1.16 -0.02 0.00 0.01 0.00 0.00 72.50 71.34 2qut s THR 124 CO 0.06 0.23 0.39 0.00 -0.69 0.00 0.00 174.62 174.61 2qut s GLN 125 N -0.80 2.55 0.00 4.92 -2.07 -0.67 -4.90 119.66 118.69 2qut s GLN 125 Ca 0.05 -1.52 0.00 0.00 -1.82 0.00 0.00 55.36 52.07 2qut s GLN 125 Cb -0.07 -2.40 0.00 0.00 -1.09 0.00 0.00 33.01 29.44 2qut s GLN 125 CO 0.01 -0.21 0.00 0.41 -1.32 0.00 0.00 175.29 174.18 2qut n GLY 126 N -1.58 -0.27 0.15 2.60 0.00 -1.26 -0.45 105.19 104.38 2qut n GLY 126 Ca 0.04 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.09 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 -9.34 0.99 3.38 -1.90 -3.41 115.31 105.03 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 0.47 1.21 -1.81 0.09 0.00 0.00 178.44 178.40 2qut s ASP 128 N -6.44 6.48 -0.95 -0.43 1.01 -1.26 -1.40 116.67 113.68 2qut s ASP 128 Ca 0.03 2.61 0.00 0.00 0.71 0.00 0.00 52.55 55.90 2qut s ASP 128 Cb 0.08 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.48 2qut s ASP 128 CO 0.73 -1.03 0.00 0.61 0.21 0.00 0.00 175.17 175.69 2qut n GLY 129 N 4.48 0.99 0.33 0.21 0.00 -1.26 -4.87 105.19 105.06 2qut n GLY 129 Ca 0.19 -0.21 0.01 0.00 0.00 0.00 0.00 46.02 46.02 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 0.72 -0.20 0.99 5.85 -1.47 -1.97 115.31 119.23 2qut h LEU 130 Ca -0.18 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.51 2qut h LEU 130 Cb 0.85 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 2qut h LEU 130 CO 0.27 0.54 0.12 -1.28 -0.34 0.00 0.00 178.44 177.76 2qut h SER 131 N 0.83 0.23 -0.64 1.25 0.87 -1.90 0.15 113.55 114.35 2qut h SER 131 Ca 0.22 -0.03 -0.06 0.00 -1.23 0.00 0.00 61.79 60.69 2qut h SER 131 Cb -0.05 -0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 61.82 2qut h SER 131 CO -0.04 0.20 0.19 -0.33 -0.53 0.00 0.00 176.83 176.31 2qut h GLU 132 N 0.25 1.01 -0.58 2.24 3.07 -1.91 -1.38 114.58 117.28 2qut h GLU 132 Ca 0.07 -0.23 -0.00 0.00 -0.50 0.00 0.00 59.36 58.70 2qut h GLU 132 Cb 0.00 -0.14 -0.03 0.00 -0.84 0.00 0.00 28.75 27.74 2qut h GLU 132 CO -0.01 0.89 0.35 0.00 -1.40 0.00 0.00 179.01 178.84 2qut h ARG 133 N 0.93 0.79 -0.37 2.33 3.08 -1.00 -1.50 114.38 118.64 2qut h ARG 133 Ca 0.21 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.17 2qut h ARG 133 Cb 0.32 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 2qut h ARG 133 CO -0.00 0.57 0.17 0.00 -1.07 0.00 0.00 179.97 179.64 2qut h ALA 135 N 1.02 1.09 -0.23 0.00 0.00 -1.01 0.15 119.26 120.29 2qut h ALA 135 Ca 0.13 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 2qut h ALA 135 Cb 0.13 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2qut h ALA 135 CO -0.02 0.18 -0.17 0.37 0.00 0.00 0.00 179.25 179.61 2qut h GLN 136 N 0.85 0.53 -0.87 0.00 5.75 -0.88 -2.47 115.11 118.02 2qut h GLN 136 Ca 0.36 -0.26 0.01 0.00 -0.15 0.00 0.00 58.65 58.61 2qut h GLN 136 Cb 0.21 -0.00 -0.04 0.00 1.07 0.00 0.00 27.48 28.72 2qut h GLN 136 CO -0.19 0.83 0.58 1.88 -2.65 0.00 0.00 178.83 179.28 2qut h TYR 137 N 0.23 1.10 -0.21 3.99 0.05 -0.08 -0.97 116.97 121.08 2qut h TYR 137 Ca 0.04 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.85 2qut h TYR 137 Cb 0.70 -0.37 -0.01 0.00 1.01 0.00 0.00 36.73 38.06 2qut h TYR 137 CO 0.07 0.69 0.13 -0.22 -1.05 0.00 0.00 178.16 177.78 2qut h LYS 138 N 1.18 0.28 -0.15 4.88 1.63 -0.62 -1.46 116.57 122.31 2qut h LYS 138 Ca 0.32 -0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 60.09 2qut h LYS 138 Cb -0.13 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 31.43 2qut h LYS 138 CO -0.07 0.22 0.05 0.87 -3.45 0.00 0.00 179.45 177.07 2qut h LYS 139 N 0.26 0.21 -0.58 1.90 1.57 -0.90 -2.38 116.57 116.65 2qut h LYS 139 Ca 0.08 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 2qut h LYS 139 Cb 0.01 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.28 2qut h LYS 139 CO -0.01 0.19 0.00 -0.25 -0.57 0.00 0.00 179.45 178.81 2qut n ASP 140 N -4.45 2.68 0.00 0.86 8.00 -0.43 -4.92 116.55 118.28 2qut n ASP 140 Ca -0.01 -2.23 0.00 0.00 0.71 0.00 0.00 54.79 53.26 2qut n ASP 140 Cb 0.12 -0.42 0.00 0.00 -0.02 0.00 0.00 41.12 40.81 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 0.71 0.93 3.80 0.44 0.00 -0.89 -4.92 105.19 105.25 2qut n GLY 141 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.07 3.45 0.00 4.61 0.00 -0.62 -4.36 121.76 122.77 2qut s ALA 142 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 51.96 52.16 2qut s ALA 142 Cb 0.00 -2.83 0.00 0.00 0.00 0.00 0.00 23.12 20.29 2qut s ALA 142 CO 0.00 0.33 0.00 -0.25 0.00 0.00 0.00 175.76 175.84 2qut n ASP 143 N 1.09 0.91 -4.06 0.00 8.00 0.53 -4.09 116.55 118.94 2qut n ASP 143 Ca -0.04 -0.38 -0.08 0.00 0.71 0.00 0.00 54.79 55.00 2qut n ASP 143 Cb 0.50 0.94 -0.09 0.00 -0.02 0.00 0.00 41.12 42.45 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 -1.12 0.53 0.27 1.24 -0.71 -1.13 -0.77 117.98 116.30 2qut s PHE 144 Ca 0.00 -1.01 0.02 0.00 -1.04 0.00 0.00 56.93 54.90 2qut s PHE 144 Cb 0.00 -0.33 -0.05 0.00 -1.21 0.00 0.00 43.02 41.43 2qut s PHE 144 CO 0.00 -0.47 0.11 0.00 -1.34 0.00 0.00 175.22 173.52 2qut s ALA 145 N -3.95 1.83 0.00 1.99 0.00 0.44 -1.21 121.76 120.88 2qut s ALA 145 Ca 0.12 -1.84 0.01 0.00 0.00 0.00 0.00 51.96 50.24 2qut s ALA 145 Cb 0.07 1.04 -0.00 0.00 0.00 0.00 0.00 23.12 24.22 2qut s ALA 145 CO -0.06 -0.46 -0.02 0.21 0.00 0.00 0.00 175.76 175.43 2qut s LYS 146 N -3.98 0.17 -0.04 0.00 2.20 -0.78 -0.84 119.74 116.47 2qut s LYS 146 Ca 0.37 -0.13 -0.02 0.00 -0.36 0.00 0.00 55.97 55.84 2qut s LYS 146 Cb 0.07 -0.13 0.03 0.00 -1.51 0.00 0.00 37.83 36.30 2qut s LYS 146 CO 0.14 0.03 0.06 -0.46 -0.36 0.00 0.00 175.35 174.77 2qut s TRP 147 N -0.19 0.04 -0.25 4.03 -0.11 -1.21 -1.54 118.94 119.71 2qut s TRP 147 Ca -0.01 0.25 -0.08 0.00 1.22 0.00 0.00 56.10 57.48 2qut s TRP 147 Cb -0.02 -0.40 -0.03 0.00 -1.50 0.00 0.00 33.47 31.52 2qut s TRP 147 CO -0.00 -0.17 0.08 0.50 -4.62 0.00 0.00 176.95 172.74 2qut s ARG 148 N 1.87 3.71 0.01 5.86 3.52 -1.26 -2.58 118.95 130.08 2qut s ARG 148 Ca 0.01 -0.45 0.02 0.00 -0.13 0.00 0.00 55.73 55.17 2qut s ARG 148 Cb -0.12 -3.34 -0.04 0.00 -1.56 0.00 0.00 34.95 29.89 2qut s ARG 148 CO -0.03 -0.15 0.02 0.00 -0.81 0.00 0.00 175.30 174.33 2qut s VAL 150 N -1.14 1.55 0.12 0.00 1.01 -1.26 -1.00 120.40 119.66 2qut s VAL 150 Ca 0.21 -0.71 0.08 0.00 0.00 0.00 0.00 61.98 61.56 2qut s VAL 150 Cb -0.12 -1.37 -0.04 0.00 0.00 0.00 0.00 36.38 34.85 2qut s VAL 150 CO 0.12 0.45 -0.20 -0.76 0.00 0.00 0.00 175.10 174.72 2qut s LEU 151 N 0.58 2.34 -0.03 3.92 1.43 0.30 -4.51 118.68 122.71 2qut s LEU 151 Ca -0.15 -0.73 0.03 0.00 -1.03 0.00 0.00 54.13 52.24 2qut s LEU 151 Cb -0.17 -0.83 0.00 0.00 0.03 0.00 0.00 46.19 45.22 2qut s LEU 151 CO 0.05 0.02 -0.11 -0.75 0.23 0.00 0.00 176.35 175.79 2qut s LYS 152 N -2.16 1.16 -0.21 1.70 2.20 -1.26 -0.71 119.74 120.45 2qut s LYS 152 Ca 0.08 -0.38 -0.24 0.00 -0.36 0.00 0.00 55.97 55.07 2qut s LYS 152 Cb -0.09 -1.06 -0.01 0.00 -1.51 0.00 0.00 37.83 35.17 2qut s LYS 152 CO 0.05 0.15 0.81 0.42 -0.36 0.00 0.00 175.35 176.42 2qut s ILE 153 N 0.15 4.87 0.00 5.43 1.01 -1.26 -2.42 121.20 128.98 2qut s ILE 153 Ca -0.03 1.56 0.00 0.00 0.00 0.00 0.00 60.65 62.18 2qut s ILE 153 Cb -0.09 -4.11 0.00 0.00 0.01 0.00 0.00 42.46 38.27 2qut s ILE 153 CO 0.01 -0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.53 2qut n GLY 154 N 3.66 2.95 0.29 6.18 0.00 0.02 -4.80 105.19 113.49 2qut n GLY 154 Ca 0.05 -1.21 0.02 0.00 0.00 0.00 0.00 46.02 44.87 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 0.71 0.00 1.61 4.81 -2.00 -3.16 114.58 116.55 2qut h GLU 155 Ca 0.00 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2qut h GLU 155 Cb 0.00 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.22 2qut h GLU 155 CO 0.00 0.47 -0.15 0.72 -0.73 0.00 0.00 179.01 179.32 2qut n HIS 156 N -4.78 0.00 -4.21 0.92 8.25 -1.26 -5.06 115.22 109.08 2qut n HIS 156 Ca 0.12 -0.61 -0.17 0.00 -0.26 0.00 0.00 57.72 56.80 2qut n HIS 156 Cb 0.25 -0.10 -0.11 0.00 1.12 0.00 0.00 29.99 31.15 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 -1.71 1.17 0.23 1.59 -4.23 -1.20 -3.76 115.64 107.74 2qut s THR 157 Ca 0.18 -1.63 -0.30 0.00 -1.18 0.00 0.00 61.69 58.76 2qut s THR 157 Cb 0.16 -1.41 -0.09 0.00 1.34 0.00 0.00 72.50 72.50 2qut s THR 157 CO 0.02 -0.43 1.23 -2.84 -0.54 0.00 0.00 174.62 172.06 2qut s PRO 158 N -2.57 4.46 0.76 3.99 0.02 -1.01 -0.80 135.00 139.85 2qut s PRO 158 Ca 0.06 1.98 -0.12 0.00 0.02 0.00 0.00 61.00 62.95 2qut s PRO 158 Cb -0.05 -3.19 0.05 0.00 0.02 0.00 0.00 34.50 31.34 2qut s PRO 158 CO 0.02 -0.10 1.14 -1.54 -0.33 0.00 0.00 177.00 176.19 2qut s SER 159 N -0.11 4.90 0.19 2.53 1.04 -1.25 -4.86 113.70 116.15 2qut s SER 159 Ca 0.52 0.92 -0.12 0.00 0.48 0.00 0.00 55.95 57.75 2qut s SER 159 Cb -0.35 -1.54 0.13 0.00 0.10 0.00 0.00 66.02 64.36 2qut s SER 159 CO 0.41 -1.67 1.83 0.00 0.98 0.00 0.00 173.24 174.79 2qut h ALA 160 N -0.88 0.75 -0.17 5.32 0.00 -2.00 -1.33 119.26 120.95 2qut h ALA 160 Ca -0.46 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 2qut h ALA 160 Cb 1.30 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2qut h ALA 160 CO 0.65 0.08 0.10 1.25 0.00 0.00 0.00 179.25 181.33 2qut h LEU 161 N 0.70 0.21 -0.73 0.00 5.85 -1.99 -0.79 115.31 118.57 2qut h LEU 161 Ca 0.24 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.90 2qut h LEU 161 Cb 0.03 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 40.97 2qut h LEU 161 CO -0.10 0.21 0.48 0.00 -0.34 0.00 0.00 178.44 178.69 2qut h ALA 162 N 1.01 0.92 0.05 1.25 0.00 -1.86 0.75 119.26 121.39 2qut h ALA 162 Ca 0.06 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2qut h ALA 162 Cb 0.04 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.54 2qut h ALA 162 CO -0.01 0.35 -0.03 0.82 0.00 0.00 0.00 179.25 180.38 2qut h ILE 163 N 0.99 1.10 -0.18 0.00 2.04 -1.06 -1.92 117.51 118.47 2qut h ILE 163 Ca 0.27 -0.51 0.00 0.00 1.00 0.00 0.00 64.86 65.62 2qut h ILE 163 Cb -0.11 1.43 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 2qut h ILE 163 CO -0.06 0.13 0.12 -0.03 0.00 0.00 0.00 178.15 178.31 2qut h MET 164 N -0.30 0.25 -0.29 2.37 4.05 -0.93 -1.47 114.93 118.61 2qut h MET 164 Ca -0.01 -0.02 -0.03 0.00 -0.28 0.00 0.00 59.70 59.36 2qut h MET 164 Cb 0.27 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.00 2qut h MET 164 CO 0.01 0.19 0.06 1.49 0.23 0.00 0.00 176.91 178.89 2qut h GLU 165 N 0.23 0.47 -0.64 0.39 4.57 -0.88 -0.41 114.58 118.31 2qut h GLU 165 Ca 0.07 -0.12 -0.09 0.00 -1.18 0.00 0.00 59.36 58.04 2qut h GLU 165 Cb 0.00 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.51 2qut h GLU 165 CO -0.01 0.56 0.06 -0.91 -1.18 0.00 0.00 179.01 177.53 2qut h ASN 166 N 0.30 1.05 -0.69 1.04 2.35 -1.34 -0.45 115.58 117.84 2qut h ASN 166 Ca 0.09 -0.27 -0.02 0.00 -0.55 0.00 0.00 56.30 55.55 2qut h ASN 166 Cb 0.31 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.36 2qut h ASN 166 CO 0.00 1.06 0.37 0.00 -1.65 0.00 0.00 177.43 177.22 2qut h ALA 167 N 1.05 0.89 -0.38 -0.83 0.00 -1.14 -1.78 119.26 117.07 2qut h ALA 167 Ca 0.19 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 2qut h ALA 167 Cb 0.49 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2qut h ALA 167 CO 0.02 0.41 0.02 -0.97 0.00 0.00 0.00 179.25 178.73 2qut h ASN 168 N 0.95 0.64 0.29 0.00 -1.24 -0.60 -2.21 115.58 113.42 2qut h ASN 168 Ca 0.24 -0.29 -0.08 0.00 0.71 0.00 0.00 56.30 56.88 2qut h ASN 168 Cb 0.05 -0.17 -0.01 0.00 0.73 0.00 0.00 38.32 38.92 2qut h ASN 168 CO -0.04 0.77 -0.36 1.62 -1.29 0.00 0.00 177.43 178.14 2qut h VAL 169 N 0.49 1.27 -0.61 2.57 3.04 -0.93 -1.57 116.25 120.52 2qut h VAL 169 Ca 0.11 -1.31 -0.08 0.00 -1.01 0.00 0.00 66.70 64.41 2qut h VAL 169 Cb 0.43 1.64 -0.02 0.00 -2.01 0.00 0.00 31.29 31.33 2qut h VAL 169 CO 0.02 0.38 0.06 -0.07 -1.01 0.00 0.00 177.57 176.95 2qut h LEU 170 N 0.09 1.00 -0.62 3.16 3.38 -1.15 -1.39 115.31 119.77 2qut h LEU 170 Ca 0.01 -0.28 -0.04 0.00 0.09 0.00 0.00 57.88 57.66 2qut h LEU 170 Cb 0.68 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 2qut h LEU 170 CO 0.05 1.03 0.24 0.00 0.09 0.00 0.00 178.44 179.85 2qut h ALA 171 N 1.00 0.81 -0.17 1.53 0.00 -0.78 0.57 119.26 122.22 2qut h ALA 171 Ca 0.18 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2qut h ALA 171 Cb 0.48 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2qut h ALA 171 CO 0.02 0.44 0.10 0.00 0.00 0.00 0.00 179.25 179.81 2qut h ARG 172 N 0.87 0.24 -0.47 0.00 2.47 -1.06 -0.10 114.38 116.34 2qut h ARG 172 Ca 0.21 -0.02 0.02 0.00 -1.26 0.00 0.00 59.98 58.92 2qut h ARG 172 Cb 0.22 -0.05 -0.03 0.00 -1.65 0.00 0.00 29.97 28.46 2qut h ARG 172 CO -0.01 0.22 0.29 -0.92 0.56 0.00 0.00 179.97 180.10 2qut h TYR 173 N 0.20 0.54 -0.54 3.04 3.20 -1.00 -1.47 116.97 120.93 2qut h TYR 173 Ca 0.06 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.94 2qut h TYR 173 Cb 0.04 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.11 2qut h TYR 173 CO -0.05 0.32 0.33 0.00 -1.64 0.00 0.00 178.16 177.12 2qut h ALA 174 N 1.20 0.69 -0.09 1.82 0.00 -0.63 -1.21 119.26 121.04 2qut h ALA 174 Ca 0.18 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.04 2qut h ALA 174 Cb -0.01 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 2qut h ALA 174 CO -0.07 0.18 -0.03 1.03 0.00 0.00 0.00 179.25 180.35 2qut h SER 175 N 0.73 -0.11 -0.46 0.00 0.87 -0.63 -1.80 113.55 112.15 2qut h SER 175 Ca 0.20 0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.78 2qut h SER 175 Cb -0.01 0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 61.99 2qut h SER 175 CO -0.04 -0.04 0.26 0.40 -0.53 0.00 0.00 176.83 176.88 2qut h ILE 176 N -0.02 1.16 -0.19 2.23 2.04 -1.06 -2.70 117.51 118.96 2qut h ILE 176 Ca 0.05 -0.40 0.04 0.00 1.00 0.00 0.00 64.86 65.55 2qut h ILE 176 Cb 0.09 0.59 -0.04 0.00 -0.74 0.00 0.00 36.82 36.72 2qut h ILE 176 CO -0.10 0.17 -0.05 0.00 0.00 0.00 0.00 178.15 178.17 2qut h GLN 178 N 0.00 0.00 0.00 0.00 4.20 -1.21 -0.07 115.11 118.03 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 0.14 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.92 2qut h GLN 178 CO -0.19 0.10 0.00 1.04 -0.67 0.00 0.00 178.83 179.10 2qut n GLN 179 N -3.90 0.22 -0.26 1.46 1.13 -0.91 -2.92 117.38 112.20 2qut n GLN 179 Ca -0.02 0.39 0.09 0.00 -1.94 0.00 0.00 57.00 55.52 2qut n GLN 179 Cb 0.19 -1.88 0.20 0.00 0.11 0.00 0.00 30.24 28.86 2qut n GLN 179 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2qut n ASN 180 N -2.29 3.13 -0.86 1.08 3.02 -0.13 -4.97 115.26 114.24 2qut n ASN 180 Ca 0.03 -3.03 -0.11 0.00 -0.03 0.00 0.00 54.58 51.44 2qut n ASN 180 Cb 0.27 -0.48 -0.04 0.00 -0.61 0.00 0.00 39.78 38.92 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 -0.94 1.02 3.42 7.41 0.00 -1.12 -4.76 105.19 110.21 2qut n GLY 181 Ca 0.18 -0.53 -0.34 0.00 0.00 0.00 0.00 46.02 45.33 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 -2.41 3.67 -0.13 -0.61 -1.09 -0.65 -4.82 121.20 115.17 2qut s ILE 182 Ca 0.00 -0.42 -0.29 0.00 -2.23 0.00 0.00 60.65 57.71 2qut s ILE 182 Cb 0.00 -2.63 -0.02 0.00 -1.58 0.00 0.00 42.46 38.23 2qut s ILE 182 CO 0.00 0.46 1.21 -0.69 -1.23 0.00 0.00 174.94 174.69 2qut s VAL 183 N 0.87 4.33 -0.06 2.92 1.01 0.05 -3.14 120.40 126.37 2qut s VAL 183 Ca -0.01 1.62 -0.20 0.00 0.00 0.00 0.00 61.98 63.40 2qut s VAL 183 Cb -0.15 -4.04 -0.05 0.00 0.00 0.00 0.00 36.38 32.15 2qut s VAL 183 CO 0.01 -0.08 0.56 -2.16 0.00 0.00 0.00 175.10 173.43 2qut s PRO 184 N 2.94 4.33 -0.33 2.72 0.04 -1.26 -0.42 135.00 143.02 2qut s PRO 184 Ca 0.54 0.63 -0.17 0.00 0.04 0.00 0.00 61.00 62.04 2qut s PRO 184 Cb -0.22 -3.40 -0.01 0.00 0.04 0.00 0.00 34.50 30.91 2qut s PRO 184 CO 0.17 0.24 0.45 0.42 0.04 0.00 0.00 177.00 178.32 2qut s ILE 185 N 0.30 5.08 -0.42 0.56 1.01 -0.02 -2.48 121.20 125.23 2qut s ILE 185 Ca 0.30 0.30 -0.24 0.00 0.00 0.00 0.00 60.65 61.01 2qut s ILE 185 Cb -0.17 -3.89 0.02 0.00 0.01 0.00 0.00 42.46 38.44 2qut s ILE 185 CO 0.14 -0.12 0.83 -0.69 0.00 0.00 0.00 174.94 175.10 2qut s VAL 186 N 2.24 4.62 -0.51 2.92 1.01 0.06 -3.31 120.40 127.43 2qut s VAL 186 Ca 0.16 0.72 -0.02 0.00 0.00 0.00 0.00 61.98 62.83 2qut s VAL 186 Cb -0.16 -4.32 0.13 0.00 0.00 0.00 0.00 36.38 32.04 2qut s VAL 186 CO 0.12 -0.65 0.32 -0.70 0.00 0.00 0.00 175.10 174.19 2qut s GLU 187 N 3.38 2.26 -1.07 2.72 2.12 -1.07 -0.61 118.70 126.43 2qut s GLU 187 Ca 0.33 -2.19 -0.07 0.00 0.36 0.00 0.00 54.97 53.40 2qut s GLU 187 Cb -0.12 -3.64 0.27 0.00 0.26 0.00 0.00 34.13 30.90 2qut s GLU 187 CO 0.22 -1.12 1.07 -0.35 -0.54 0.00 0.00 175.26 174.53 2qut n PRO 188 N 4.01 3.40 -2.50 4.30 -0.04 -1.24 -0.41 135.00 142.51 2qut n PRO 188 Ca 0.03 -4.47 -0.43 0.00 -0.04 0.00 0.00 63.50 58.59 2qut n PRO 188 Cb 0.39 -2.52 -0.02 0.00 -0.04 0.00 0.00 33.50 31.32 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 -1.42 4.26 -0.35 0.54 2.12 -0.18 -4.56 118.70 119.12 2qut s GLU 189 Ca 0.30 1.57 -0.16 0.00 0.36 0.00 0.00 54.97 57.04 2qut s GLU 189 Cb -0.08 -3.70 -0.01 0.00 0.26 0.00 0.00 34.13 30.60 2qut s GLU 189 CO -0.08 -0.64 0.39 0.42 -0.54 0.00 0.00 175.26 174.81 2qut s ILE 190 N 3.20 5.14 0.72 -3.70 1.01 -1.26 -0.54 121.20 125.77 2qut s ILE 190 Ca 0.52 0.04 -0.16 0.00 0.00 0.00 0.00 60.65 61.05 2qut s ILE 190 Cb -0.20 -3.86 0.03 0.00 0.01 0.00 0.00 42.46 38.44 2qut s ILE 190 CO 0.13 -0.14 1.25 -0.76 0.00 0.00 0.00 174.94 175.42 2qut s LEU 191 N 2.07 3.39 0.00 2.97 1.43 0.12 -4.81 118.68 123.84 2qut s LEU 191 Ca 0.13 2.50 0.28 0.00 -1.03 0.00 0.00 54.13 56.01 2qut s LEU 191 Cb -0.16 -4.60 1.09 0.00 0.03 0.00 0.00 46.19 42.54 2qut s LEU 191 CO 0.12 -2.28 1.77 -0.81 0.23 0.00 0.00 176.35 175.38 2qut n PRO 192 N -2.51 0.95 -1.66 1.29 -0.04 -1.26 -4.53 135.00 127.24 2qut n PRO 192 Ca 0.15 -0.45 -0.46 0.00 -0.04 0.00 0.00 63.50 62.70 2qut n PRO 192 Cb 0.49 -1.49 -0.04 0.00 -0.04 0.00 0.00 33.50 32.42 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 -0.63 2.80 0.00 3.54 9.92 -1.26 -0.04 116.55 130.87 2qut n ASP 193 Ca 0.15 1.11 0.00 0.00 -0.53 0.00 0.00 54.79 55.52 2qut n ASP 193 Cb 0.30 -1.40 0.00 0.00 -0.64 0.00 0.00 41.12 39.39 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 2.89 1.82 1.06 0.44 0.00 -1.26 -4.59 105.19 105.56 2qut n GLY 194 Ca 0.15 -2.20 0.08 0.00 0.00 0.00 0.00 46.02 44.05 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 4.17 -4.77 1.61 5.75 -1.26 -0.81 116.55 121.24 2qut n ASP 195 Ca 0.00 -2.94 -0.33 0.00 -0.01 0.00 0.00 54.79 51.51 2qut n ASP 195 Cb 0.00 -0.55 0.06 0.00 -1.03 0.00 0.00 41.12 39.60 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 -2.71 2.58 0.71 2.11 -3.43 -1.26 -4.32 115.29 108.97 2qut s HIS 196 Ca 0.44 1.56 -0.02 0.00 -0.80 0.00 0.00 55.06 56.23 2qut s HIS 196 Cb 0.34 -3.15 0.15 0.00 -1.43 0.00 0.00 32.58 28.49 2qut s HIS 196 CO 0.11 -1.76 0.98 -0.40 -2.00 0.00 0.00 174.74 171.67 2qut n ASP 197 N -2.72 1.15 -0.18 7.38 5.68 -1.26 0.27 116.55 126.88 2qut n ASP 197 Ca 0.10 -2.01 -0.06 0.00 -0.50 0.00 0.00 54.79 52.32 2qut n ASP 197 Cb 0.52 -0.65 0.04 0.00 -1.14 0.00 0.00 41.12 39.89 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 0.53 -0.65 -2.12 5.85 -1.91 -2.62 115.31 114.39 2qut h LEU 198 Ca -0.32 0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.46 2qut h LEU 198 Cb 1.15 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 42.02 2qut h LEU 198 CO 0.33 0.38 0.36 0.50 -0.34 0.00 0.00 178.44 179.66 2qut h LYS 199 N 0.65 0.64 -0.60 1.25 3.64 -1.95 -0.14 116.57 120.07 2qut h LYS 199 Ca 0.21 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.50 2qut h LYS 199 Cb 0.01 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.66 2qut h LYS 199 CO -0.09 0.42 0.17 -0.09 -2.27 0.00 0.00 179.45 177.60 2qut h ARG 200 N 0.66 0.94 -0.58 1.90 9.65 -1.89 -0.40 114.38 124.66 2qut h ARG 200 Ca 0.29 -0.21 -0.07 0.00 -1.10 0.00 0.00 59.98 58.89 2qut h ARG 200 Cb 0.19 -0.13 -0.02 0.00 -1.39 0.00 0.00 29.97 28.61 2qut h ARG 200 CO -0.18 0.85 0.10 0.00 2.80 0.00 0.00 179.97 183.54 2qut h GLN 202 N 0.85 1.22 0.44 0.00 4.15 -0.73 0.11 115.11 121.14 2qut h GLN 202 Ca 0.18 -0.18 -0.02 0.00 0.77 0.00 0.00 58.65 59.40 2qut h GLN 202 Cb 0.40 -0.22 0.00 0.00 0.21 0.00 0.00 27.48 27.88 2qut h GLN 202 CO 0.01 0.93 -0.21 -0.92 -1.93 0.00 0.00 178.83 176.71 2qut h TYR 203 N 1.20 -0.55 -0.95 3.99 3.20 -0.72 -0.95 116.97 122.20 2qut h TYR 203 Ca 0.29 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.16 2qut h TYR 203 Cb 0.12 0.18 -0.05 0.00 1.54 0.00 0.00 36.73 38.52 2qut h TYR 203 CO 0.01 -0.30 0.63 0.28 -1.64 0.00 0.00 178.16 177.15 2qut h VAL 204 N -0.67 1.24 -0.73 1.81 2.07 -1.00 -1.75 116.25 117.21 2qut h VAL 204 Ca -0.06 -0.44 -0.05 0.00 0.82 0.00 0.00 66.70 66.97 2qut h VAL 204 Cb 0.50 -0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 30.08 2qut h VAL 204 CO 0.10 0.23 0.27 0.74 0.02 0.00 0.00 177.57 178.94 2qut h THR 205 N 1.28 1.25 -0.64 2.57 2.02 -0.65 -0.15 112.91 118.60 2qut h THR 205 Ca 0.35 -0.83 -0.07 0.00 0.77 0.00 0.00 66.41 66.64 2qut h THR 205 Cb -0.14 0.42 -0.03 0.00 -1.74 0.00 0.00 68.15 66.66 2qut h THR 205 CO -0.08 0.33 0.14 -0.33 0.37 0.00 0.00 175.52 175.95 2qut h GLU 206 N 1.06 1.03 -0.35 6.66 5.08 -0.71 -1.18 114.58 126.17 2qut h GLU 206 Ca 0.24 -0.26 -0.16 0.00 -1.00 0.00 0.00 59.36 58.19 2qut h GLU 206 Cb 0.24 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 2qut h GLU 206 CO -0.02 0.94 -0.39 0.87 -1.00 0.00 0.00 179.01 179.42 2qut h LYS 207 N 0.95 0.88 -0.15 2.33 1.79 -1.07 -2.27 116.57 119.03 2qut h LYS 207 Ca 0.20 -0.48 -0.02 0.00 -2.18 0.00 0.00 60.65 58.17 2qut h LYS 207 Cb 0.39 0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 31.05 2qut h LYS 207 CO 0.01 1.12 0.03 0.28 -1.08 0.00 0.00 179.45 179.81 2qut h VAL 208 N 0.68 1.21 -0.22 0.50 2.07 -0.94 -2.44 116.25 117.11 2qut h VAL 208 Ca 0.05 -0.67 -0.07 0.00 0.82 0.00 0.00 66.70 66.82 2qut h VAL 208 Cb 0.98 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 32.11 2qut h VAL 208 CO 0.09 0.20 -0.18 -0.07 0.02 0.00 0.00 177.57 177.63 2qut h LEU 209 N 0.04 0.38 -0.86 2.57 3.38 -1.25 -0.02 115.31 119.56 2qut h LEU 209 Ca 0.05 -0.11 -0.09 0.00 0.09 0.00 0.00 57.88 57.83 2qut h LEU 209 Cb 0.28 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 2qut h LEU 209 CO 0.00 0.59 -0.07 0.00 0.09 0.00 0.00 178.44 179.05 2qut h ALA 210 N 1.45 1.04 -0.39 1.53 0.00 -1.35 -1.62 119.26 119.92 2qut h ALA 210 Ca 0.06 -0.30 -0.11 0.00 0.00 0.00 0.00 54.91 54.56 2qut h ALA 210 Cb 0.53 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2qut h ALA 210 CO 0.04 0.59 -0.20 0.00 0.00 0.00 0.00 179.25 179.67 2qut h ALA 211 N 1.21 0.55 -0.14 0.00 0.00 -0.90 -2.30 119.26 117.68 2qut h ALA 211 Ca 0.13 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 54.68 2qut h ALA 211 Cb 0.53 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2qut h ALA 211 CO 0.03 0.51 0.06 0.28 0.00 0.00 0.00 179.25 180.13 2qut h VAL 212 N 0.63 0.98 0.00 0.00 2.07 -0.68 -1.33 116.25 117.93 2qut h VAL 212 Ca 0.08 -0.04 -0.10 0.00 0.82 0.00 0.00 66.70 67.46 2qut h VAL 212 Cb 0.76 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 2qut h VAL 212 CO 0.06 0.02 -0.49 1.88 0.02 0.00 0.00 177.57 179.07 2qut h TYR 213 N 0.13 0.00 -0.39 1.57 0.05 -1.31 0.78 116.97 117.80 2qut h TYR 213 Ca 0.06 0.00 -0.13 0.00 0.05 0.00 0.00 58.73 58.71 2qut h TYR 213 Cb 0.02 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.75 2qut h TYR 213 CO -0.10 0.49 -0.26 -0.22 -1.05 0.00 0.00 178.16 177.02 2qut h LYS 214 N 0.00 0.87 -0.31 4.88 1.63 -1.23 -0.27 116.57 122.13 2qut h LYS 214 Ca -0.00 -0.41 -0.04 0.00 -0.85 0.00 0.00 60.65 59.35 2qut h LYS 214 Cb 0.92 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.52 2qut h LYS 214 CO 0.06 1.06 0.05 0.00 -3.45 0.00 0.00 179.45 177.17 2qut h ALA 215 N 0.80 0.42 -0.89 5.00 0.00 -0.86 0.04 119.26 123.75 2qut h ALA 215 Ca 0.08 -0.19 0.07 0.00 0.00 0.00 0.00 54.91 54.86 2qut h ALA 215 Cb 0.83 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.44 2qut h ALA 215 CO 0.07 0.11 0.58 -0.07 0.00 0.00 0.00 179.25 179.94 2qut h LEU 216 N 0.35 0.88 -0.10 0.00 3.38 -0.69 -0.66 115.31 118.47 2qut h LEU 216 Ca 0.10 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 2qut h LEU 216 Cb 0.34 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 2qut h LEU 216 CO 0.01 0.56 -0.02 -1.28 0.09 0.00 0.00 178.44 177.80 2qut h SER 217 N 1.00 0.19 -0.53 -0.43 0.87 -0.65 0.10 113.55 114.11 2qut h SER 217 Ca 0.39 -0.35 0.06 0.00 -1.23 0.00 0.00 61.79 60.66 2qut h SER 217 Cb 0.22 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.09 2qut h SER 217 CO -0.15 0.50 0.35 0.44 -0.53 0.00 0.00 176.83 177.45 2qut h ASP 218 N -0.12 0.42 -0.34 6.23 3.32 -0.32 -0.66 116.42 124.96 2qut h ASP 218 Ca 0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 2qut h ASP 218 Cb 0.41 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.87 2qut h ASP 218 CO 0.01 0.27 0.00 1.41 -1.72 0.00 0.00 179.24 179.21 2qut n HIS 219 N -4.47 0.44 -3.57 4.55 8.25 -0.32 -4.94 115.22 115.17 2qut n HIS 219 Ca 0.07 -0.22 -0.23 0.00 -0.26 0.00 0.00 57.72 57.08 2qut n HIS 219 Cb 0.24 0.00 0.08 0.00 1.12 0.00 0.00 29.99 31.43 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 0.57 -2.77 -2.69 4.41 8.25 -0.25 -4.90 115.22 117.84 2qut n HIS 220 Ca 0.14 1.00 -0.41 0.00 -0.26 0.00 0.00 57.72 58.19 2qut n HIS 220 Cb 0.33 -5.02 -0.05 0.00 1.12 0.00 0.00 29.99 26.37 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 -3.32 4.18 -0.74 1.59 -1.09 -0.01 -4.90 121.20 116.90 2qut s ILE 221 Ca 0.50 1.98 -0.23 0.00 -2.23 0.00 0.00 60.65 60.67 2qut s ILE 221 Cb -0.22 -4.26 0.07 0.00 -1.58 0.00 0.00 42.46 36.47 2qut s ILE 221 CO 0.72 0.38 1.07 -0.47 -1.23 0.00 0.00 174.94 175.42 2qut s TYR 222 N -0.54 2.68 0.30 3.97 5.04 -1.26 -4.81 117.35 122.73 2qut s TYR 222 Ca 0.45 -0.64 0.02 0.00 -2.44 0.00 0.00 57.07 54.46 2qut s TYR 222 Cb -0.26 -4.37 0.59 0.00 0.35 0.00 0.00 41.96 38.28 2qut s TYR 222 CO 0.32 -1.71 1.87 -0.07 -1.34 0.00 0.00 175.55 174.62 2qut h LEU 223 N 11.55 0.87 -2.58 6.97 3.38 -1.94 -0.43 115.31 133.13 2qut h LEU 223 Ca -0.18 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 2qut h LEU 223 Cb 1.05 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.66 2qut h LEU 223 CO 1.20 0.50 -0.01 -0.33 0.09 0.00 0.00 178.44 179.88 2qut h GLU 224 N 0.95 0.00 -0.92 1.13 3.07 -1.89 -0.73 114.58 116.19 2qut h GLU 224 Ca 0.45 0.00 -0.45 0.00 -0.50 0.00 0.00 59.36 58.86 2qut h GLU 224 Cb 0.43 0.00 -0.27 0.00 -0.84 0.00 0.00 28.75 28.07 2qut h GLU 224 CO -0.21 0.01 0.55 0.41 -1.40 0.00 0.00 179.01 178.38 2qut n GLY 225 N -1.10 4.39 3.21 -3.84 0.00 -0.17 -4.33 105.19 103.35 2qut n GLY 225 Ca -0.03 -1.08 -0.12 0.00 0.00 0.00 0.00 46.02 44.79 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 -3.25 0.22 0.08 2.61 -4.23 -0.28 -3.99 115.64 106.79 2qut s THR 226 Ca 0.56 -1.97 0.03 0.00 -1.18 0.00 0.00 61.69 59.13 2qut s THR 226 Cb 0.47 -2.35 -0.03 0.00 1.34 0.00 0.00 72.50 71.92 2qut s THR 226 CO 0.11 -0.19 -0.09 -0.76 -0.54 0.00 0.00 174.62 173.15 2qut s LEU 227 N -3.16 2.37 -0.13 4.79 1.43 -1.04 -3.54 118.68 119.40 2qut s LEU 227 Ca 0.33 -0.75 0.01 0.00 -1.03 0.00 0.00 54.13 52.69 2qut s LEU 227 Cb 0.07 -0.21 -0.01 0.00 0.03 0.00 0.00 46.19 46.07 2qut s LEU 227 CO 0.08 -0.28 -0.16 -0.22 0.23 0.00 0.00 176.35 176.00 2qut s LEU 228 N -2.23 2.51 -0.63 1.79 2.96 -0.33 -0.76 118.68 121.99 2qut s LEU 228 Ca 0.01 -0.42 0.02 0.00 -0.22 0.00 0.00 54.13 53.52 2qut s LEU 228 Cb -0.04 -1.55 0.16 0.00 0.50 0.00 0.00 46.19 45.26 2qut s LEU 228 CO -0.01 0.14 0.41 -0.75 -1.32 0.00 0.00 176.35 174.83 2qut s LYS 229 N 0.46 2.38 0.49 1.98 2.20 0.21 0.21 119.74 127.67 2qut s LYS 229 Ca -0.11 -2.85 0.08 0.00 -0.36 0.00 0.00 55.97 52.73 2qut s LYS 229 Cb -0.16 -3.51 0.03 0.00 -1.51 0.00 0.00 37.83 32.67 2qut s LYS 229 CO 0.05 -1.18 0.56 -1.25 -0.36 0.00 0.00 175.35 173.17 2qut s PRO 230 N -0.63 2.50 0.39 4.03 0.04 -1.26 -3.65 135.00 136.42 2qut s PRO 230 Ca 0.20 -1.57 -0.18 0.00 0.04 0.00 0.00 61.00 59.50 2qut s PRO 230 Cb -0.18 -2.52 -0.10 0.00 0.04 0.00 0.00 34.50 31.75 2qut s PRO 230 CO -0.06 -0.48 0.85 0.54 0.04 0.00 0.00 177.00 177.89 2qut s ASN 231 N -4.37 6.84 0.76 6.66 4.22 -1.26 -2.42 114.94 125.37 2qut s ASN 231 Ca 0.52 1.48 -0.11 0.00 -2.14 0.00 0.00 52.86 52.61 2qut s ASN 231 Cb -0.06 -2.46 0.05 0.00 1.28 0.00 0.00 41.25 40.07 2qut s ASN 231 CO 0.32 -0.31 1.09 -0.04 -2.04 0.00 0.00 177.10 176.11 2qut s MET 232 N -3.16 2.36 -0.36 3.55 -1.94 -1.26 -4.96 119.30 113.52 2qut s MET 232 Ca 0.58 0.74 -0.22 0.00 -1.71 0.00 0.00 55.69 55.08 2qut s MET 232 Cb -0.10 -1.94 0.01 0.00 2.01 0.00 0.00 34.83 34.81 2qut s MET 232 CO 0.16 -1.45 0.70 0.08 -0.01 0.00 0.00 175.02 174.50 2qut s VAL 233 N -3.12 4.82 0.12 -6.03 1.01 -1.26 -5.02 120.40 110.92 2qut s VAL 233 Ca 0.60 0.69 -0.02 0.00 0.00 0.00 0.00 61.98 63.24 2qut s VAL 233 Cb -0.14 -4.14 -0.03 0.00 0.00 0.00 0.00 36.38 32.06 2qut s VAL 233 CO 0.54 -0.38 0.08 0.42 0.00 0.00 0.00 175.10 175.76 2qut s THR 234 N 2.88 0.12 0.86 3.92 -4.23 -1.26 -4.42 115.64 113.51 2qut s THR 234 Ca 0.27 -1.79 -0.11 0.00 -1.18 0.00 0.00 61.69 58.88 2qut s THR 234 Cb -0.14 -1.90 0.11 0.00 1.34 0.00 0.00 72.50 71.91 2qut s THR 234 CO 0.16 -0.54 1.09 -2.16 -0.54 0.00 0.00 174.62 172.63 2qut s PRO 235 N -4.01 1.57 0.81 3.99 0.04 -1.26 -4.55 135.00 131.59 2qut s PRO 235 Ca 0.19 0.82 -0.13 0.00 0.04 0.00 0.00 61.00 61.92 2qut s PRO 235 Cb 0.07 -1.84 0.08 0.00 0.04 0.00 0.00 34.50 32.85 2qut s PRO 235 CO -0.01 -2.03 1.20 0.20 0.04 0.00 0.00 177.00 176.41 2qut s GLY 236 N -3.53 2.15 0.61 0.56 0.00 0.14 -4.87 107.32 102.39 2qut s GLY 236 Ca 0.63 0.84 0.33 0.00 0.00 0.00 0.00 44.72 46.51 2qut s GLY 236 CO 0.56 1.26 2.28 1.12 0.00 0.00 0.00 173.10 178.32 2qut h HIS 237 N -0.90 0.00 -0.20 1.90 2.07 -0.09 -2.28 115.15 115.65 2qut h HIS 237 Ca -0.46 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.06 2qut h HIS 237 Cb 1.29 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.27 2qut h HIS 237 CO 0.47 0.00 0.00 0.00 -3.07 0.00 0.00 177.93 175.33 2qut n ALA 238 N -2.27 2.81 -2.23 6.11 0.00 0.01 -5.00 120.51 119.95 2qut n ALA 238 Ca -0.03 -2.38 -0.42 0.00 0.00 0.00 0.00 53.44 50.61 2qut n ALA 238 Cb 0.08 -0.63 -0.03 0.00 0.00 0.00 0.00 19.45 18.87 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 4.38 1.43 -3.82 0.00 1.35 -1.92 -3.43 112.91 110.91 2qut h THR 240 Ca -0.42 -2.05 -0.51 0.00 -0.55 0.00 0.00 66.41 62.88 2qut h THR 240 Cb 1.21 2.11 0.02 0.00 -1.73 0.00 0.00 68.15 69.76 2qut h THR 240 CO 0.86 0.59 0.49 -1.58 -0.25 0.00 0.00 175.52 175.63 2qut s GLN 241 N -3.66 4.61 0.15 4.72 0.74 -1.26 -5.03 119.66 119.93 2qut s GLN 241 Ca -0.01 1.85 0.07 0.00 0.05 0.00 0.00 55.36 57.32 2qut s GLN 241 Cb 0.13 -3.18 -0.04 0.00 1.10 0.00 0.00 33.01 31.02 2qut s GLN 241 CO 0.76 0.17 -0.02 0.15 -0.55 0.00 0.00 175.29 175.80 2qut s LYS 242 N -1.49 2.38 0.20 1.67 -0.14 -1.26 -5.01 119.74 116.09 2qut s LYS 242 Ca 0.45 -1.06 0.01 0.00 -1.36 0.00 0.00 55.97 54.01 2qut s LYS 242 Cb -0.33 -2.37 -0.05 0.00 -1.68 0.00 0.00 37.83 33.40 2qut s LYS 242 CO 0.42 0.48 0.06 0.71 -0.76 0.00 0.00 175.35 176.26 2qut s TYR 243 N -1.59 1.26 0.31 3.18 1.51 -1.26 -5.14 117.35 115.62 2qut s TYR 243 Ca 0.26 -1.17 0.06 0.00 -1.01 0.00 0.00 57.07 55.21 2qut s TYR 243 Cb -0.10 -0.71 -0.02 0.00 -0.11 0.00 0.00 41.96 41.03 2qut s TYR 243 CO 0.18 -0.38 0.44 -1.54 -1.11 0.00 0.00 175.55 173.14 2qut s SER 244 N -3.20 6.04 0.35 2.29 1.04 -1.26 -4.99 113.70 113.97 2qut s SER 244 Ca 0.31 -0.13 0.03 0.00 0.48 0.00 0.00 55.95 56.64 2qut s SER 244 Cb 0.07 -1.39 0.65 0.00 0.10 0.00 0.00 66.02 65.45 2qut s SER 244 CO 0.08 -0.33 1.98 0.45 0.98 0.00 0.00 173.24 176.40 2qut h HIS 245 N 0.98 0.82 -0.66 5.02 3.86 -1.99 -1.35 115.15 121.83 2qut h HIS 245 Ca -0.47 0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 58.71 2qut h HIS 245 Cb 1.25 -0.28 -0.03 0.00 1.06 0.00 0.00 27.41 29.41 2qut h HIS 245 CO 0.43 0.49 0.22 0.93 0.86 0.00 0.00 177.93 180.87 2qut h GLU 246 N 0.86 0.99 -0.27 2.45 3.07 -1.94 0.10 114.58 119.85 2qut h GLU 246 Ca 0.28 -0.19 -0.15 0.00 -0.50 0.00 0.00 59.36 58.80 2qut h GLU 246 Cb 0.03 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 27.78 2qut h GLU 246 CO -0.08 0.84 -0.45 0.93 -1.40 0.00 0.00 179.01 178.85 2qut h GLU 247 N 0.96 0.68 -0.51 2.33 5.08 -1.68 -0.40 114.58 121.05 2qut h GLU 247 Ca 0.22 -0.38 -0.08 0.00 -1.00 0.00 0.00 59.36 58.11 2qut h GLU 247 Cb 0.25 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 2qut h GLU 247 CO -0.01 1.00 -0.01 0.82 -1.00 0.00 0.00 179.01 179.81 2qut h ILE 248 N 0.55 1.26 -0.63 3.13 2.04 -0.87 -0.76 117.51 122.23 2qut h ILE 248 Ca 0.03 -1.10 -0.09 0.00 1.00 0.00 0.00 64.86 64.71 2qut h ILE 248 Cb 1.00 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 38.01 2qut h ILE 248 CO 0.09 0.39 0.05 0.00 0.00 0.00 0.00 178.15 178.68 2qut h ALA 249 N 0.94 0.89 -0.27 1.87 0.00 -0.64 -0.98 119.26 121.06 2qut h ALA 249 Ca 0.14 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 2qut h ALA 249 Cb 0.53 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2qut h ALA 249 CO 0.03 0.67 -0.16 1.98 0.00 0.00 0.00 179.25 181.76 2qut h MET 250 N 0.99 0.59 -0.79 0.00 1.85 -0.91 -0.53 114.93 116.14 2qut h MET 250 Ca 0.19 -0.27 -0.05 0.00 -0.61 0.00 0.00 59.70 58.95 2qut h MET 250 Cb 0.50 -0.01 -0.03 0.00 0.43 0.00 0.00 31.60 32.49 2qut h MET 250 CO 0.02 0.85 0.30 0.00 -0.40 0.00 0.00 176.91 177.69 2qut h ALA 251 N 0.73 1.03 0.15 0.39 0.00 -1.05 -0.84 119.26 119.66 2qut h ALA 251 Ca 0.06 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 2qut h ALA 251 Cb 0.69 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2qut h ALA 251 CO 0.05 0.67 -0.07 1.15 0.00 0.00 0.00 179.25 181.04 2qut h THR 252 N 1.16 1.00 -0.38 0.00 2.02 -1.09 -2.02 112.91 113.60 2qut h THR 252 Ca 0.26 -0.81 -0.04 0.00 0.77 0.00 0.00 66.41 66.59 2qut h THR 252 Cb 0.23 1.49 -0.02 0.00 -1.74 0.00 0.00 68.15 68.12 2qut h THR 252 CO -0.02 0.19 0.05 0.58 0.37 0.00 0.00 175.52 176.69 2qut h VAL 253 N -0.60 1.19 -0.28 3.16 2.07 -1.07 -1.93 116.25 118.79 2qut h VAL 253 Ca -0.02 -0.73 -0.05 0.00 0.82 0.00 0.00 66.70 66.72 2qut h VAL 253 Cb 0.45 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 2qut h VAL 253 CO 0.03 0.26 -0.02 0.74 0.02 0.00 0.00 177.57 178.60 2qut h THR 254 N 0.56 1.27 -0.48 2.57 2.02 -1.15 -0.74 112.91 116.95 2qut h THR 254 Ca 0.12 -0.99 0.01 0.00 0.77 0.00 0.00 66.41 66.33 2qut h THR 254 Cb 0.28 1.34 -0.03 0.00 -1.74 0.00 0.00 68.15 68.01 2qut h THR 254 CO 0.00 0.32 0.31 0.00 0.37 0.00 0.00 175.52 176.52 2qut h ALA 255 N 0.81 0.62 -0.45 6.16 0.00 -1.04 -2.18 119.26 123.17 2qut h ALA 255 Ca 0.08 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 2qut h ALA 255 Cb 0.47 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2qut h ALA 255 CO 0.02 0.03 -0.02 -0.07 0.00 0.00 0.00 179.25 179.21 2qut h LEU 256 N 0.62 0.80 -2.17 0.00 3.38 -1.26 -2.72 115.31 113.97 2qut h LEU 256 Ca 0.18 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 2qut h LEU 256 Cb -0.04 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.49 2qut h LEU 256 CO -0.06 0.92 -0.07 0.03 0.09 0.00 0.00 178.44 179.36 2qut h ARG 257 N 0.65 0.00 -0.01 1.13 3.08 -0.89 0.30 114.38 118.64 2qut h ARG 257 Ca 0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.18 2qut h ARG 257 Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.58 2qut h ARG 257 CO 0.03 0.07 -0.22 0.54 -1.07 0.00 0.00 179.97 179.31 2qut n ARG 258 N -3.73 0.92 0.00 0.04 1.74 -0.84 -4.60 116.66 110.19 2qut n ARG 258 Ca -0.02 -0.53 0.00 0.00 -0.77 0.00 0.00 57.85 56.53 2qut n ARG 258 Cb 0.17 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.12 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 -0.58 0.00 -3.07 0.55 -2.24 -0.67 -4.99 114.28 103.28 2qut n THR 259 Ca 0.13 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.48 2qut n THR 259 Cb 0.35 -0.04 -0.06 0.00 -2.10 0.00 0.00 70.33 68.47 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 -1.01 4.78 0.44 2.28 1.01 0.96 -4.76 120.40 124.10 2qut s VAL 260 Ca 0.00 0.21 -0.24 0.00 0.00 0.00 0.00 61.98 61.94 2qut s VAL 260 Cb 0.00 -4.24 -0.09 0.00 0.00 0.00 0.00 36.38 32.05 2qut s VAL 260 CO 0.00 -0.63 1.14 -2.65 0.00 0.00 0.00 175.10 172.96 2qut n PRO 261 N 6.39 1.59 0.26 2.72 -0.02 -1.26 -4.83 135.00 139.84 2qut n PRO 261 Ca -0.01 0.57 0.18 0.00 -2.02 0.00 0.00 63.50 62.22 2qut n PRO 261 Cb 0.48 -2.23 0.91 0.00 -0.02 0.00 0.00 33.50 32.64 2qut n PRO 261 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2qut h PRO 262 N 1.69 0.00 0.00 0.52 0.11 -1.96 -1.82 132.00 130.54 2qut h PRO 262 Ca -0.47 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 2qut h PRO 262 Cb 1.32 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.43 2qut h PRO 262 CO 0.58 0.00 -0.06 0.00 -0.21 0.00 0.00 178.00 178.30 2qut h ALA 263 N 1.70 1.08 -2.46 -0.75 0.00 -1.90 -3.43 119.26 113.49 2qut h ALA 263 Ca 0.05 -0.06 -0.53 0.00 0.00 0.00 0.00 54.91 54.37 2qut h ALA 263 Cb 0.45 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.26 2qut h ALA 263 CO -0.00 0.08 0.96 0.08 0.00 0.00 0.00 179.25 180.37 2qut s VAL 264 N -3.90 3.07 0.23 0.00 1.01 -0.69 -3.06 120.40 117.06 2qut s VAL 264 Ca -0.01 0.56 -0.05 0.00 0.00 0.00 0.00 61.98 62.47 2qut s VAL 264 Cb 0.11 -3.36 0.10 0.00 0.00 0.00 0.00 36.38 33.24 2qut s VAL 264 CO 0.54 0.00 1.72 0.74 0.00 0.00 0.00 175.10 178.11 2qut h THR 265 N 4.72 1.25 -2.52 3.92 2.02 -1.65 -3.44 112.91 117.21 2qut h THR 265 Ca -0.42 -1.04 -0.00 0.00 0.77 0.00 0.00 66.41 65.72 2qut h THR 265 Cb 1.20 0.79 -0.15 0.00 -1.74 0.00 0.00 68.15 68.25 2qut h THR 265 CO 0.92 0.38 0.28 -0.83 0.37 0.00 0.00 175.52 176.64 2qut s GLY 266 N -3.64 -0.56 -0.21 2.16 0.00 -1.26 -3.53 107.32 100.28 2qut s GLY 266 Ca -0.11 0.90 -0.01 0.00 0.00 0.00 0.00 44.72 45.51 2qut s GLY 266 CO 0.83 0.45 -0.12 0.14 0.00 0.00 0.00 173.10 174.40 2qut s VAL 267 N -2.81 2.55 -0.52 1.40 1.01 0.49 -1.19 120.40 121.34 2qut s VAL 267 Ca -0.02 -0.92 -0.01 0.00 0.00 0.00 0.00 61.98 61.03 2qut s VAL 267 Cb -0.01 -2.19 0.13 0.00 0.00 0.00 0.00 36.38 34.32 2qut s VAL 267 CO -0.05 0.38 0.30 0.42 0.00 0.00 0.00 175.10 176.15 2qut s THR 268 N 1.32 3.24 0.36 3.92 -4.23 0.13 -0.83 115.64 119.55 2qut s THR 268 Ca 0.03 -2.71 -0.28 0.00 -1.18 0.00 0.00 61.69 57.54 2qut s THR 268 Cb -0.15 -3.18 -0.11 0.00 1.34 0.00 0.00 72.50 70.40 2qut s THR 268 CO -0.08 -0.78 1.52 -0.36 -0.54 0.00 0.00 174.62 174.38 2qut s PHE 269 N 0.33 2.59 0.31 3.99 0.08 -0.64 -4.13 117.98 120.51 2qut s PHE 269 Ca 0.14 1.07 -0.11 0.00 0.12 0.00 0.00 56.93 58.15 2qut s PHE 269 Cb -0.22 -4.06 -0.08 0.00 -0.57 0.00 0.00 43.02 38.10 2qut s PHE 269 CO -0.03 -3.19 0.67 -0.48 -0.10 0.00 0.00 175.22 172.09 2qut s LEU 270 N -1.81 4.04 0.27 -0.37 0.05 -1.02 -1.01 118.68 118.84 2qut s LEU 270 Ca 0.55 1.09 0.18 0.00 0.05 0.00 0.00 54.13 56.00 2qut s LEU 270 Cb -0.47 -3.90 0.08 0.00 -2.05 0.00 0.00 46.19 39.85 2qut s LEU 270 CO 0.61 -0.21 1.32 0.77 -0.55 0.00 0.00 176.35 178.29 2qut h SER 271 N 2.07 0.00 -6.97 1.48 4.64 -1.92 -3.41 113.55 109.45 2qut h SER 271 Ca -0.47 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.26 2qut h SER 271 Cb 1.18 0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 63.02 2qut h SER 271 CO 0.66 0.32 -0.91 0.61 -0.87 0.00 0.00 176.83 176.65 2qut n GLY 272 N 1.22 -0.30 0.78 -0.77 0.00 -1.26 -1.39 105.19 103.47 2qut n GLY 272 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 -1.72 0.91 3.75 -0.02 0.00 -1.26 -4.81 105.19 102.04 2qut n GLY 273 Ca -0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.74 2.58 0.90 1.61 -0.21 -0.48 -5.00 119.66 118.32 2qut s GLN 274 Ca 0.00 1.58 -0.12 0.00 0.02 0.00 0.00 55.36 56.84 2qut s GLN 274 Cb 0.00 -1.91 0.13 0.00 1.00 0.00 0.00 33.01 32.24 2qut s GLN 274 CO 0.00 -1.46 1.11 -1.54 -2.12 0.00 0.00 175.29 171.28 2qut s SER 275 N -2.24 3.52 0.14 5.90 1.04 -1.26 -4.68 113.70 116.12 2qut s SER 275 Ca 0.71 1.20 -0.18 0.00 0.48 0.00 0.00 55.95 58.16 2qut s SER 275 Cb -0.25 -1.86 -0.00 0.00 0.10 0.00 0.00 66.02 64.01 2qut s SER 275 CO 0.41 -2.57 1.75 -0.33 0.98 0.00 0.00 173.24 173.48 2qut h GLU 276 N -1.51 0.19 -0.05 4.02 5.08 -1.88 -0.98 114.58 119.47 2qut h GLU 276 Ca -0.50 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 57.84 2qut h GLU 276 Cb 1.31 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.51 2qut h GLU 276 CO 0.59 0.13 0.02 0.93 -1.00 0.00 0.00 179.01 179.68 2qut h GLU 277 N 0.20 0.07 -0.45 2.33 4.39 -1.92 -2.64 114.58 116.56 2qut h GLU 277 Ca 0.12 -0.01 0.06 0.00 0.34 0.00 0.00 59.36 59.86 2qut h GLU 277 Cb 0.09 -0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 28.68 2qut h GLU 277 CO -0.13 0.19 0.15 1.49 -1.16 0.00 0.00 179.01 179.56 2qut h GLU 278 N -0.07 0.31 -0.87 2.33 4.81 -1.89 0.89 114.58 120.08 2qut h GLU 278 Ca 0.02 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.25 2qut h GLU 278 Cb 0.15 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.41 2qut h GLU 278 CO -0.00 0.20 0.57 0.00 -0.73 0.00 0.00 179.01 179.06 2qut h ALA 279 N 1.30 1.43 -0.16 2.92 0.00 -1.13 0.42 119.26 124.04 2qut h ALA 279 Ca 0.21 -0.05 -0.20 0.00 0.00 0.00 0.00 54.91 54.88 2qut h ALA 279 Cb 0.22 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 17.69 2qut h ALA 279 CO -0.22 0.50 -0.66 0.77 0.00 0.00 0.00 179.25 179.64 2qut h SER 280 N 1.12 0.86 -0.49 0.00 0.02 -0.98 -2.22 113.55 111.86 2qut h SER 280 Ca 0.34 -0.62 -0.05 0.00 -0.84 0.00 0.00 61.79 60.62 2qut h SER 280 Cb -0.04 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.23 2qut h SER 280 CO -0.09 1.33 0.12 0.40 -1.14 0.00 0.00 176.83 177.45 2qut h ILE 281 N 0.44 1.24 -0.46 3.27 2.04 -0.39 -0.92 117.51 122.74 2qut h ILE 281 Ca -0.04 -0.83 -0.12 0.00 1.00 0.00 0.00 64.86 64.88 2qut h ILE 281 Cb 1.29 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 38.21 2qut h ILE 281 CO 0.14 0.30 -0.17 0.78 0.00 0.00 0.00 178.15 179.19 2qut h ASN 282 N 0.66 0.90 -0.53 1.72 2.35 -0.98 -0.70 115.58 119.01 2qut h ASN 282 Ca 0.15 -0.31 -0.06 0.00 -0.55 0.00 0.00 56.30 55.53 2qut h ASN 282 Cb 0.32 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.42 2qut h ASN 282 CO 0.00 1.06 0.11 0.25 -1.65 0.00 0.00 177.43 177.20 2qut h LEU 283 N 0.78 0.86 -0.26 1.61 5.85 -1.22 0.61 115.31 123.54 2qut h LEU 283 Ca 0.11 -0.18 -0.04 0.00 0.84 0.00 0.00 57.88 58.62 2qut h LEU 283 Cb 0.71 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 2qut h LEU 283 CO 0.05 0.85 0.02 -1.13 -0.34 0.00 0.00 178.44 177.90 2qut h ASN 284 N 0.86 0.44 -0.28 1.25 -1.24 -0.86 -1.91 115.58 113.84 2qut h ASN 284 Ca 0.18 -0.28 -0.05 0.00 0.71 0.00 0.00 56.30 56.86 2qut h ASN 284 Cb 0.36 -0.12 -0.02 0.00 0.73 0.00 0.00 38.32 39.27 2qut h ASN 284 CO 0.00 0.61 0.02 0.00 -1.29 0.00 0.00 177.43 176.78 2qut h ALA 285 N 0.84 1.33 -0.55 1.57 0.00 -0.77 -1.08 119.26 120.60 2qut h ALA 285 Ca 0.08 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 2qut h ALA 285 Cb 0.38 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2qut h ALA 285 CO 0.01 0.46 0.21 0.82 0.00 0.00 0.00 179.25 180.75 2qut h ILE 286 N 0.57 1.22 0.00 0.00 2.04 -0.68 -0.59 117.51 120.07 2qut h ILE 286 Ca 0.12 -0.72 0.00 0.00 1.00 0.00 0.00 64.86 65.27 2qut h ILE 286 Cb 0.33 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 37.08 2qut h ILE 286 CO 0.01 0.27 0.00 0.59 0.00 0.00 0.00 178.15 179.02 2qut n ASN 287 N -4.49 0.75 -0.44 1.72 3.02 -0.73 -2.67 115.26 112.41 2qut n ASN 287 Ca 0.03 0.62 0.11 0.00 -0.03 0.00 0.00 54.58 55.31 2qut n ASN 287 Cb 0.17 -0.81 0.03 0.00 -0.61 0.00 0.00 39.78 38.56 2qut n ASN 287 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2qut n LYS 288 N -2.26 1.09 -1.69 3.52 5.02 -0.46 -4.72 118.16 118.66 2qut n LYS 288 Ca 0.04 -0.89 -0.44 0.00 -2.02 0.00 0.00 58.31 55.00 2qut n LYS 288 Cb 0.33 -1.48 -0.04 0.00 -0.02 0.00 0.00 35.03 33.82 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 4.39 1.02 -4.14 0.00 -0.04 -1.26 -4.78 135.00 130.17 2qut n PRO 290 Ca 0.17 -0.39 -0.16 0.00 -0.04 0.00 0.00 63.50 63.08 2qut n PRO 290 Cb 0.33 -1.58 -0.12 0.00 -0.04 0.00 0.00 33.50 32.09 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 2.30 0.07 1.53 1.43 -1.26 -5.11 118.68 117.63 2qut s LEU 291 Ca 0.26 -0.64 -0.31 0.00 -1.03 0.00 0.00 54.13 52.42 2qut s LEU 291 Cb 0.12 -0.39 -0.07 0.00 0.03 0.00 0.00 46.19 45.88 2qut s LEU 291 CO 0.00 -0.14 1.49 -0.22 0.23 0.00 0.00 176.35 177.71 2qut s LEU 292 N -1.83 4.35 -0.32 1.79 0.20 -1.26 -4.99 118.68 116.61 2qut s LEU 292 Ca -0.03 2.34 0.03 0.00 0.69 0.00 0.00 54.13 57.16 2qut s LEU 292 Cb -0.09 -3.57 0.09 0.00 -0.43 0.00 0.00 46.19 42.20 2qut s LEU 292 CO 0.01 -0.77 0.04 -0.54 -0.29 0.00 0.00 176.35 174.81 2qut s LYS 293 N 2.01 1.39 0.00 1.98 3.01 -1.26 -4.97 119.74 121.90 2qut s LYS 293 Ca 0.68 -1.59 0.05 0.00 -1.01 0.00 0.00 55.97 54.11 2qut s LYS 293 Cb -0.37 -2.87 0.33 0.00 -1.01 0.00 0.00 37.83 33.91 2qut s LYS 293 CO 0.30 -0.89 1.00 -0.35 0.51 0.00 0.00 175.35 175.92 2qut n PRO 294 N 4.43 0.76 -4.10 -1.68 -0.04 -1.26 -4.80 135.00 128.31 2qut n PRO 294 Ca -0.00 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.36 2qut n PRO 294 Cb 0.42 -1.11 -0.10 0.00 -0.04 0.00 0.00 33.50 32.67 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 0.64 0.30 0.54 0.51 -1.26 -4.91 118.94 112.76 2qut s TRP 295 Ca 0.08 -0.84 -0.29 0.00 -2.12 0.00 0.00 56.10 52.93 2qut s TRP 295 Cb 0.04 -0.41 -0.10 0.00 -0.81 0.00 0.00 33.47 32.19 2qut s TRP 295 CO 0.06 -0.22 1.40 0.00 -0.51 0.00 0.00 176.95 177.68 2qut s ALA 296 N -3.03 3.57 -0.52 0.98 0.00 -1.23 -4.84 121.76 116.69 2qut s ALA 296 Ca 0.02 1.33 0.02 0.00 0.00 0.00 0.00 51.96 53.34 2qut s ALA 296 Cb 0.01 -3.53 0.13 0.00 0.00 0.00 0.00 23.12 19.73 2qut s ALA 296 CO -0.05 -0.74 0.27 -0.51 0.00 0.00 0.00 175.76 174.73 2qut s LEU 297 N -1.13 4.64 0.00 0.00 1.43 -1.26 -0.38 118.68 121.98 2qut s LEU 297 Ca 0.55 -2.82 0.00 0.00 -1.03 0.00 0.00 54.13 50.82 2qut s LEU 297 Cb -0.42 -1.70 0.00 0.00 0.03 0.00 0.00 46.19 44.10 2qut s LEU 297 CO 0.49 -0.30 0.00 1.07 0.23 0.00 0.00 176.35 177.85 2qut n THR 298 N 3.41 0.00 -4.41 5.49 5.66 -0.01 -4.65 114.28 119.78 2qut n THR 298 Ca 0.05 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 60.81 2qut n THR 298 Cb 0.35 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.02 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 1.15 2.12 -0.42 1.09 -0.71 -1.26 -1.62 117.98 118.33 2qut s PHE 299 Ca 0.00 -0.40 0.06 0.00 -1.04 0.00 0.00 56.93 55.55 2qut s PHE 299 Cb 0.00 -1.01 0.21 0.00 -1.21 0.00 0.00 43.02 41.01 2qut s PHE 299 CO 0.00 0.50 0.49 0.45 -1.34 0.00 0.00 175.22 175.33 2qut n SER 300 N -0.02 -0.62 -4.82 1.98 2.88 -0.18 0.58 113.62 113.42 2qut n SER 300 Ca -0.10 -2.63 -0.37 0.00 -1.33 0.00 0.00 58.87 54.44 2qut n SER 300 Cb 0.58 -0.22 -0.06 0.00 -0.75 0.00 0.00 64.21 63.75 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 -0.38 3.60 0.00 0.66 2.02 -0.80 -4.20 117.35 118.25 2qut s TYR 301 Ca 0.34 0.68 0.00 0.00 -0.37 0.00 0.00 57.07 57.72 2qut s TYR 301 Cb 0.11 -2.16 0.00 0.00 -0.40 0.00 0.00 41.96 39.51 2qut s TYR 301 CO -0.15 0.56 0.00 0.41 -1.57 0.00 0.00 175.55 174.80 2qut n GLY 302 N 2.37 -0.22 0.33 0.71 0.00 -1.26 -0.65 105.19 106.48 2qut n GLY 302 Ca -0.16 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.88 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 0.76 0.00 1.61 3.08 -1.95 -2.22 114.38 115.66 2qut h ARG 303 Ca 0.00 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.00 2qut h ARG 303 Cb 0.00 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 29.88 2qut h ARG 303 CO 0.00 0.51 0.00 0.00 -1.07 0.00 0.00 179.97 179.41 2qut n ALA 304 N -2.45 1.55 0.23 0.04 0.00 -1.26 -1.20 120.51 117.42 2qut n ALA 304 Ca 0.06 -0.01 0.03 0.00 0.00 0.00 0.00 53.44 53.51 2qut n ALA 304 Cb 0.05 -1.24 -0.03 0.00 0.00 0.00 0.00 19.45 18.23 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 -1.66 0.23 -0.00 0.00 4.77 -0.88 -4.63 117.00 114.82 2qut n LEU 305 Ca 0.03 -0.45 0.03 0.00 -0.03 0.00 0.00 56.01 55.59 2qut n LEU 305 Cb 0.15 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.21 2qut n LEU 305 CO 0.13 0.06 -0.24 0.00 -1.33 0.00 0.00 177.39 176.00 2qut n GLN 306 N -1.19 3.11 -0.11 3.23 6.02 -0.93 -4.61 117.38 122.91 2qut n GLN 306 Ca 0.01 -0.02 -0.11 0.00 -0.01 0.00 0.00 57.00 56.87 2qut n GLN 306 Cb 0.09 -0.92 -0.08 0.00 1.02 0.00 0.00 30.24 30.35 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 0.69 -0.68 -0.16 -1.58 0.00 -1.43 -0.23 119.26 115.88 2qut h ALA 307 Ca 0.00 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 2qut h ALA 307 Cb 0.19 1.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 2qut h ALA 307 CO 0.00 -0.89 -0.50 0.77 0.00 0.00 0.00 179.25 178.63 2qut h SER 308 N -0.31 0.46 -0.68 0.00 0.02 -1.88 -2.79 113.55 108.37 2qut h SER 308 Ca 0.06 -0.23 -0.04 0.00 -0.84 0.00 0.00 61.79 60.74 2qut h SER 308 Cb 0.47 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 62.85 2qut h SER 308 CO -0.47 0.88 0.28 0.00 -1.14 0.00 0.00 176.83 176.38 2qut h ALA 309 N 1.13 0.88 -0.32 3.77 0.00 -1.69 0.15 119.26 123.20 2qut h ALA 309 Ca 0.01 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.64 2qut h ALA 309 Cb 0.99 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2qut h ALA 309 CO 0.09 0.49 -0.27 1.25 0.00 0.00 0.00 179.25 180.81 2qut h LEU 310 N 0.96 0.66 -0.16 0.00 5.85 -1.01 -1.78 115.31 119.83 2qut h LEU 310 Ca 0.23 -0.24 -0.20 0.00 0.84 0.00 0.00 57.88 58.51 2qut h LEU 310 Cb 0.19 -0.18 0.01 0.00 0.37 0.00 0.00 40.66 41.05 2qut h LEU 310 CO -0.02 0.90 -0.68 0.50 -0.34 0.00 0.00 178.44 178.79 2qut h LYS 311 N 0.56 0.75 0.00 1.25 3.64 -1.19 -1.68 116.57 119.89 2qut h LYS 311 Ca 0.07 -0.59 -0.07 0.00 -1.27 0.00 0.00 60.65 58.80 2qut h LYS 311 Cb 0.75 0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.67 2qut h LYS 311 CO 0.06 1.20 -0.33 0.00 -2.27 0.00 0.00 179.45 178.11 2qut h ALA 312 N 0.55 1.25 0.17 5.00 0.00 -0.64 -3.23 119.26 122.36 2qut h ALA 312 Ca -0.04 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 2qut h ALA 312 Cb 1.31 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2qut h ALA 312 CO 0.14 0.41 -0.08 2.35 0.00 0.00 0.00 179.25 182.07 2qut h TRP 313 N 0.00 -0.22 -0.32 0.00 7.01 -1.24 -3.41 115.95 117.79 2qut h TRP 313 Ca -0.00 -0.01 -0.14 0.00 2.11 0.00 0.00 58.89 60.86 2qut h TRP 313 Cb 0.67 0.07 -0.05 0.00 -2.10 0.00 0.00 29.16 27.75 2qut h TRP 313 CO 0.00 -0.13 -0.12 0.41 -2.79 0.00 0.00 178.44 175.80 2qut n GLY 314 N 0.91 0.80 2.07 2.65 0.00 -0.64 -2.39 105.19 108.58 2qut n GLY 314 Ca -0.03 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.94 0.69 3.58 -0.02 0.00 -1.26 -4.83 105.19 102.41 2qut n GLY 315 Ca -0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.12 3.92 0.60 1.61 1.02 -1.01 -4.98 119.74 120.79 2qut s LYS 316 Ca 0.00 -0.35 0.36 0.00 0.02 0.00 0.00 55.97 56.00 2qut s LYS 316 Cb 0.00 -3.47 1.94 0.00 -0.52 0.00 0.00 37.83 35.77 2qut s LYS 316 CO 0.00 -0.03 2.23 0.87 -0.92 0.00 0.00 175.35 177.49 2qut h LYS 317 N 7.81 0.00 0.00 1.68 1.57 -1.95 -1.81 116.57 123.86 2qut h LYS 317 Ca -0.37 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.41 2qut h LYS 317 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.49 2qut h LYS 317 CO 0.61 0.03 0.00 -0.85 -0.57 0.00 0.00 179.45 178.67 2qut n GLU 318 N -3.38 0.53 -0.66 3.15 0.00 -1.26 -2.92 120.64 116.10 2qut n GLU 318 Ca -0.02 0.00 0.08 0.00 0.00 0.00 0.00 57.16 57.22 2qut n GLU 318 Cb 0.14 -1.50 0.34 0.00 0.00 0.00 0.00 31.44 30.42 2qut n GLU 318 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2qut n ASN 319 N -1.23 4.82 0.12 -1.84 3.02 -0.68 -4.71 115.26 114.76 2qut n ASN 319 Ca 0.16 -2.80 -0.11 0.00 -0.03 0.00 0.00 54.58 51.80 2qut n ASN 319 Cb 0.21 -0.59 -0.06 0.00 -0.61 0.00 0.00 39.78 38.73 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 3.24 -0.95 -1.47 3.41 5.85 -1.67 -0.28 115.31 123.43 2qut h LEU 320 Ca 0.00 0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 2qut h LEU 320 Cb 1.64 0.34 -0.02 0.00 0.37 0.00 0.00 40.66 42.99 2qut h LEU 320 CO 0.33 -0.38 0.21 0.11 -0.34 0.00 0.00 178.44 178.37 2qut h LYS 321 N -0.54 0.57 -0.33 1.25 1.57 -1.88 -0.26 116.57 116.95 2qut h LYS 321 Ca -0.02 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.67 2qut h LYS 321 Cb 0.51 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 2qut h LYS 321 CO -0.12 0.43 0.08 0.00 -0.57 0.00 0.00 179.45 179.27 2qut h ALA 322 N 1.66 0.43 -0.41 3.86 0.00 -1.83 -0.74 119.26 122.24 2qut h ALA 322 Ca 0.15 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 2qut h ALA 322 Cb 0.04 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2qut h ALA 322 CO -0.02 0.09 0.03 0.00 0.00 0.00 0.00 179.25 179.35 2qut h ALA 323 N 0.92 0.55 -0.68 0.00 0.00 -0.55 -2.83 119.26 116.66 2qut h ALA 323 Ca 0.10 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 2qut h ALA 323 Cb 0.30 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2qut h ALA 323 CO 0.00 0.30 0.36 1.96 0.00 0.00 0.00 179.25 181.87 2qut h GLN 324 N 0.54 0.95 -0.97 0.00 4.20 -0.95 -2.27 115.11 116.60 2qut h GLN 324 Ca 0.12 -0.11 0.02 0.00 0.06 0.00 0.00 58.65 58.74 2qut h GLN 324 Cb 0.43 -0.19 -0.05 0.00 0.30 0.00 0.00 27.48 27.97 2qut h GLN 324 CO 0.02 0.71 0.64 1.49 -0.67 0.00 0.00 178.83 181.01 2qut h GLU 325 N 0.95 1.23 -0.46 1.46 4.57 -0.90 0.52 114.58 121.95 2qut h GLU 325 Ca 0.24 -0.07 -0.10 0.00 -1.18 0.00 0.00 59.36 58.24 2qut h GLU 325 Cb 0.05 -0.28 -0.02 0.00 -0.16 0.00 0.00 28.75 28.34 2qut h GLU 325 CO -0.04 0.82 -0.12 0.93 -1.18 0.00 0.00 179.01 179.41 2qut h GLU 326 N 1.27 0.86 -0.20 1.92 4.39 -1.21 -1.65 114.58 119.96 2qut h GLU 326 Ca 0.37 -0.30 -0.04 0.00 0.34 0.00 0.00 59.36 59.73 2qut h GLU 326 Cb -0.08 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.50 2qut h GLU 326 CO -0.10 0.94 -0.02 -0.92 -1.16 0.00 0.00 179.01 177.74 2qut h TYR 327 N 0.77 0.40 -0.94 4.33 3.20 -1.02 -2.57 116.97 121.15 2qut h TYR 327 Ca 0.12 -0.08 0.08 0.00 3.14 0.00 0.00 58.73 62.00 2qut h TYR 327 Cb 0.64 -0.10 -0.07 0.00 1.54 0.00 0.00 36.73 38.74 2qut h TYR 327 CO 0.04 0.59 0.59 0.28 -1.64 0.00 0.00 178.16 178.01 2qut h VAL 328 N 0.10 1.01 -0.85 1.81 2.07 -0.79 0.05 116.25 119.65 2qut h VAL 328 Ca 0.05 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 2qut h VAL 328 Cb 0.45 -0.10 -0.04 0.00 -1.52 0.00 0.00 31.29 30.07 2qut h VAL 328 CO 0.01 0.19 0.48 0.11 0.02 0.00 0.00 177.57 178.38 2qut h LYS 329 N 1.02 1.18 0.00 1.57 1.57 -1.10 0.09 116.57 120.91 2qut h LYS 329 Ca 0.43 -0.13 -0.11 0.00 -1.87 0.00 0.00 60.65 58.96 2qut h LYS 329 Cb 0.27 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 2qut h LYS 329 CO -0.21 0.86 -0.53 0.00 -0.57 0.00 0.00 179.45 179.01 2qut h ARG 330 N 1.19 0.00 -0.20 3.15 2.47 -0.91 -0.90 114.38 119.17 2qut h ARG 330 Ca 0.30 0.00 -0.09 0.00 -1.26 0.00 0.00 59.98 58.93 2qut h ARG 330 Cb 0.02 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.33 2qut h ARG 330 CO -0.05 0.53 -0.23 0.00 0.56 0.00 0.00 179.97 180.78 2qut h ALA 331 N 1.47 0.30 -0.25 0.04 0.00 -0.48 -1.67 119.26 118.67 2qut h ALA 331 Ca -0.01 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 2qut h ALA 331 Cb 1.19 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2qut h ALA 331 CO 0.07 0.26 0.08 -0.07 0.00 0.00 0.00 179.25 179.59 2qut h LEU 332 N 0.18 0.35 -0.47 0.00 3.38 -0.92 -0.45 115.31 117.38 2qut h LEU 332 Ca 0.03 -0.19 0.04 0.00 0.09 0.00 0.00 57.88 57.85 2qut h LEU 332 Cb 0.79 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.41 2qut h LEU 332 CO 0.06 0.45 0.22 0.00 0.09 0.00 0.00 178.44 179.25 2qut h ALA 333 N 0.91 0.58 0.00 1.53 0.00 -1.15 -2.28 119.26 118.86 2qut h ALA 333 Ca 0.08 0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 2qut h ALA 333 Cb 0.22 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2qut h ALA 333 CO -0.00 -0.15 -0.54 -0.91 0.00 0.00 0.00 179.25 177.65 2qut h ASN 334 N 0.43 0.00 -0.52 0.00 2.35 -1.19 -1.58 115.58 115.07 2qut h ASN 334 Ca 0.21 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.87 2qut h ASN 334 Cb 0.14 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.49 2qut h ASN 334 CO -0.16 0.54 0.00 -1.28 -1.65 0.00 0.00 177.43 174.88 2qut h SER 335 N 0.00 0.93 -0.11 5.81 0.87 -0.70 -0.93 113.55 119.42 2qut h SER 335 Ca -0.01 -0.25 -0.20 0.00 -1.23 0.00 0.00 61.79 60.10 2qut h SER 335 Cb 1.11 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 62.83 2qut h SER 335 CO 0.07 0.99 -0.69 -0.07 -0.53 0.00 0.00 176.83 176.60 2qut h LEU 336 N 0.89 0.86 -0.67 2.23 3.38 -1.29 -3.27 115.31 117.44 2qut h LEU 336 Ca 0.16 -0.52 0.00 0.00 0.09 0.00 0.00 57.88 57.61 2qut h LEU 336 Cb 0.51 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 2qut h LEU 336 CO 0.03 1.31 0.42 0.00 0.09 0.00 0.00 178.44 180.28 2qut h ALA 337 N 0.69 0.85 0.00 1.53 0.00 -0.92 0.32 119.26 121.72 2qut h ALA 337 Ca -0.03 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2qut h ALA 337 Cb 1.30 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2qut h ALA 337 CO 0.14 0.31 0.00 0.00 0.00 0.00 0.00 179.25 179.70 2qut n GLN 339 N -0.75 -0.56 -1.50 0.00 6.02 -0.45 -4.70 117.38 115.44 2qut n GLN 339 Ca 0.07 -0.53 -0.12 0.00 -0.01 0.00 0.00 57.00 56.40 2qut n GLN 339 Cb 0.03 -0.95 -0.05 0.00 1.02 0.00 0.00 30.24 30.30 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 -0.04 1.09 0.98 1.08 0.00 -0.00 -4.88 105.19 103.42 2qut n GLY 340 Ca 0.00 -0.44 0.05 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.57 2.69 -3.79 1.61 5.02 -0.03 -4.89 118.16 116.21 2qut n LYS 341 Ca -0.13 -2.92 -0.35 0.00 -2.02 0.00 0.00 58.31 52.89 2qut n LYS 341 Cb 0.44 -1.85 -0.09 0.00 -0.02 0.00 0.00 35.03 33.51 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 -2.93 3.34 -0.07 2.13 5.04 -1.22 -4.78 117.35 118.86 2qut s TYR 342 Ca 0.43 0.22 0.03 0.00 -2.44 0.00 0.00 57.07 55.30 2qut s TYR 342 Cb 0.36 -2.16 0.01 0.00 0.35 0.00 0.00 41.96 40.51 2qut s TYR 342 CO 0.07 0.18 -0.16 0.95 -1.34 0.00 0.00 175.55 175.26 2qut s THR 343 N 0.55 1.39 -1.53 4.34 -4.23 -1.26 -4.94 115.64 109.97 2qut s THR 343 Ca 0.06 -0.63 0.00 0.00 -1.18 0.00 0.00 61.69 59.94 2qut s THR 343 Cb -0.12 -1.24 0.00 0.00 1.34 0.00 0.00 72.50 72.47 2qut s THR 343 CO 0.00 0.41 0.30 -2.65 -0.54 0.00 0.00 174.62 172.15 2qut n PRO 344 N 3.72 0.00 0.06 3.99 -0.02 -1.26 -5.16 135.00 136.33 2qut n PRO 344 Ca -0.22 0.00 -0.22 0.00 -2.02 0.00 0.00 63.50 61.04 2qut n PRO 344 Cb 0.52 -1.40 -0.15 0.00 -0.02 0.00 0.00 33.50 32.46 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 0.57 -6.75 2.55 0.87 -2.01 -3.55 113.55 105.22 2qut h SER 345 Ca 0.00 -0.92 -0.38 0.00 -1.23 0.00 0.00 61.79 59.27 2qut h SER 345 Cb 0.00 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 61.77 2qut h SER 345 CO 0.00 1.78 -0.71 -0.24 -0.53 0.00 0.00 176.83 177.14 2qut n SER 359 N -3.56 -2.91 -0.47 6.23 2.88 -1.26 -5.28 113.62 109.25 2qut n SER 359 Ca -0.26 -0.79 0.12 0.00 -1.33 0.00 0.00 58.87 56.62 2qut n SER 359 Cb 1.07 -1.06 0.49 0.00 -0.75 0.00 0.00 64.21 63.96 2qut n SER 359 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 2qut n ASN 360 N -1.30 1.43 0.00 -3.46 0.23 -1.26 -3.31 115.26 107.59 2qut n ASN 360 Ca -0.13 -1.55 0.14 0.00 -0.53 0.00 0.00 54.58 52.50 2qut n ASN 360 Cb 0.41 -0.04 0.73 0.00 -2.08 0.00 0.00 39.78 38.80 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 0.13 0.00 1.66 -2.53 8.25 -1.26 -2.55 115.22 118.92 2qut n HIS 361 Ca 0.18 0.00 0.15 0.00 -0.26 0.00 0.00 57.72 57.79 2qut n HIS 361 Cb 0.32 -0.27 0.77 0.00 1.12 0.00 0.00 29.99 31.93 2qut n HIS 361 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2qut n ALA 362 N -1.27 2.65 0.63 -1.41 0.00 -1.21 -5.30 120.51 114.60 2qut n ALA 362 Ca 0.14 -0.24 0.08 0.00 0.00 0.00 0.00 53.44 53.42 2qut n ALA 362 Cb 0.22 -1.42 0.06 0.00 0.00 0.00 0.00 19.45 18.31 2qut n ALA 362 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16