#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 2.87 -0.02 0.54 3.76 -1.26 -5.11 115.29 116.07 2qut s HIS 2 Ca 0.00 -0.15 -0.22 0.00 -0.15 0.00 0.00 55.06 54.54 2qut s HIS 2 Cb 0.00 -1.73 -0.05 0.00 1.11 0.00 0.00 32.58 31.91 2qut s HIS 2 CO 0.00 0.18 0.66 0.45 -0.85 0.00 0.00 174.74 175.18 2qut s SER 3 N -0.51 7.01 -0.59 1.40 0.15 -1.26 -5.01 113.70 114.90 2qut s SER 3 Ca 0.07 1.21 0.06 0.00 0.70 0.00 0.00 55.95 57.98 2qut s SER 3 Cb -0.12 -2.40 0.21 0.00 -1.71 0.00 0.00 66.02 62.00 2qut s SER 3 CO 0.02 0.00 0.55 1.41 1.20 0.00 0.00 173.24 176.42 2qut n HIS 4 N 3.17 2.06 -0.43 3.44 8.25 -1.26 -5.08 115.22 125.38 2qut n HIS 4 Ca -0.04 -3.97 -0.19 0.00 -0.26 0.00 0.00 57.72 53.26 2qut n HIS 4 Cb 0.51 -0.40 -0.03 0.00 1.12 0.00 0.00 29.99 31.19 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 1.70 0.00 0.08 -0.41 -0.02 -1.26 -4.84 135.00 130.25 2qut n PRO 5 Ca 0.25 0.00 -0.09 0.00 -2.02 0.00 0.00 63.50 61.64 2qut n PRO 5 Cb 0.42 -0.45 -0.02 0.00 -0.02 0.00 0.00 33.50 33.42 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 2.33 0.48 -3.22 3.55 0.00 -1.98 -3.46 119.26 116.97 2qut h ALA 6 Ca -0.06 -0.74 -0.41 0.00 0.00 0.00 0.00 54.91 53.69 2qut h ALA 6 Cb 0.43 -0.07 -0.20 0.00 0.00 0.00 0.00 17.79 17.94 2qut h ALA 6 CO 0.32 0.93 -0.77 -0.51 0.00 0.00 0.00 179.25 179.22 2qut s LEU 7 N -7.39 2.32 0.56 0.00 1.43 -1.26 -4.97 118.68 109.36 2qut s LEU 7 Ca -0.03 -0.69 -0.03 0.00 -1.03 0.00 0.00 54.13 52.35 2qut s LEU 7 Cb 0.10 -0.53 0.01 0.00 0.03 0.00 0.00 46.19 45.80 2qut s LEU 7 CO 0.83 -0.10 0.83 0.42 0.23 0.00 0.00 176.35 178.56 2qut s THR 8 N -1.61 3.51 0.36 5.49 -4.23 -1.26 -4.89 115.64 113.02 2qut s THR 8 Ca 0.02 -0.25 0.06 0.00 -1.18 0.00 0.00 61.69 60.35 2qut s THR 8 Cb -0.08 -3.37 0.29 0.00 1.34 0.00 0.00 72.50 70.69 2qut s THR 8 CO 0.02 -0.33 1.96 -0.65 -0.54 0.00 0.00 174.62 175.09 2qut h PRO 9 N -0.02 0.72 -0.50 3.99 0.11 -2.01 -0.51 132.00 133.78 2qut h PRO 9 Ca -0.45 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.53 2qut h PRO 9 Cb 1.27 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 2qut h PRO 9 CO 0.59 0.48 -0.04 0.93 -0.21 0.00 0.00 178.00 179.74 2qut h GLU 10 N 0.74 0.90 -0.59 1.05 3.07 -1.99 -0.54 114.58 117.23 2qut h GLU 10 Ca 0.31 -0.31 -0.09 0.00 -0.50 0.00 0.00 59.36 58.77 2qut h GLU 10 Cb 0.26 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 28.08 2qut h GLU 10 CO -0.10 0.95 0.02 1.96 -1.40 0.00 0.00 179.01 180.44 2qut h GLN 11 N 0.76 1.01 -0.15 2.33 4.20 -1.71 -2.00 115.11 119.55 2qut h GLN 11 Ca 0.14 -0.30 -0.01 0.00 0.06 0.00 0.00 58.65 58.54 2qut h GLN 11 Cb 0.57 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 2qut h GLN 11 CO 0.03 0.98 0.07 0.87 -0.67 0.00 0.00 178.83 180.11 2qut h LYS 12 N 0.93 0.22 -0.67 1.46 1.57 -0.85 -1.99 116.57 117.23 2qut h LYS 12 Ca 0.17 -0.03 0.06 0.00 -1.87 0.00 0.00 60.65 58.97 2qut h LYS 12 Cb 0.52 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.74 2qut h LYS 12 CO 0.03 0.28 0.38 -0.22 -0.57 0.00 0.00 179.45 179.34 2qut h LYS 13 N 0.10 0.69 0.10 3.15 3.64 -0.94 0.68 116.57 123.99 2qut h LYS 13 Ca 0.05 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2qut h LYS 13 Cb 0.13 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 2qut h LYS 13 CO -0.01 0.45 -0.09 1.49 -2.27 0.00 0.00 179.45 179.02 2qut h GLU 14 N 0.71 -0.20 -0.09 1.90 4.81 -1.16 0.65 114.58 121.18 2qut h GLU 14 Ca 0.30 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.54 2qut h GLU 14 Cb 0.17 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.59 2qut h GLU 14 CO -0.17 -0.14 0.06 -0.07 -0.73 0.00 0.00 179.01 177.96 2qut h LEU 15 N -0.21 0.11 -0.38 1.64 3.38 -0.87 -1.54 115.31 117.43 2qut h LEU 15 Ca 0.00 -0.02 0.03 0.00 0.09 0.00 0.00 57.88 57.99 2qut h LEU 15 Cb 0.20 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 40.89 2qut h LEU 15 CO -0.02 0.09 0.17 -1.28 0.09 0.00 0.00 178.44 177.49 2qut h SER 16 N 0.11 0.22 -0.56 -0.43 0.87 -0.76 -0.92 113.55 112.08 2qut h SER 16 Ca 0.03 0.03 0.03 0.00 -1.23 0.00 0.00 61.79 60.65 2qut h SER 16 Cb 0.00 -0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 61.92 2qut h SER 16 CO -0.01 0.17 0.34 0.44 -0.53 0.00 0.00 176.83 177.24 2qut h ASP 17 N 0.35 0.54 -0.09 6.23 3.32 -0.66 -0.82 116.42 125.28 2qut h ASP 17 Ca 0.17 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.22 2qut h ASP 17 Cb 0.10 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.54 2qut h ASP 17 CO -0.14 0.38 0.05 0.40 -1.72 0.00 0.00 179.24 178.22 2qut h ILE 18 N 0.66 1.08 -0.33 0.35 2.04 -0.87 -1.81 117.51 118.63 2qut h ILE 18 Ca 0.23 -0.21 0.05 0.00 1.00 0.00 0.00 64.86 65.93 2qut h ILE 18 Cb 0.03 1.04 -0.04 0.00 -0.74 0.00 0.00 36.82 37.11 2qut h ILE 18 CO -0.10 0.07 0.06 0.00 0.00 0.00 0.00 178.15 178.17 2qut h ALA 19 N 0.97 0.35 -0.39 1.87 0.00 -0.84 -2.19 119.26 119.02 2qut h ALA 19 Ca 0.03 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2qut h ALA 19 Cb 0.06 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2qut h ALA 19 CO -0.01 -0.35 0.04 0.45 0.00 0.00 0.00 179.25 179.39 2qut h HIS 20 N 0.17 0.62 -0.59 0.00 3.86 -1.04 -2.78 115.15 115.38 2qut h HIS 20 Ca 0.16 -0.06 -0.10 0.00 -1.16 0.00 0.00 60.37 59.22 2qut h HIS 20 Cb 0.18 -0.18 -0.02 0.00 1.06 0.00 0.00 27.41 28.45 2qut h HIS 20 CO -0.19 0.57 -0.00 0.00 0.86 0.00 0.00 177.93 179.17 2qut h ARG 21 N 0.58 1.04 -0.86 2.45 3.08 -0.77 -2.27 114.38 117.63 2qut h ARG 21 Ca 0.13 -0.33 -0.03 0.00 0.07 0.00 0.00 59.98 59.82 2qut h ARG 21 Cb 0.30 -0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.21 2qut h ARG 21 CO 0.01 1.02 0.42 0.82 -1.07 0.00 0.00 179.97 181.17 2qut h ILE 22 N 0.95 1.26 -0.59 2.04 2.04 -1.14 -3.13 117.51 118.94 2qut h ILE 22 Ca 0.17 -0.72 -0.32 0.00 1.00 0.00 0.00 64.86 64.99 2qut h ILE 22 Cb 0.55 0.15 -0.19 0.00 -0.74 0.00 0.00 36.82 36.59 2qut h ILE 22 CO 0.03 0.31 0.15 1.33 0.00 0.00 0.00 178.15 179.97 2qut n VAL 23 N -4.31 2.80 -1.46 1.67 0.24 -1.14 -4.16 118.33 111.98 2qut n VAL 23 Ca 0.09 -2.59 -0.35 0.00 -2.04 0.00 0.00 64.34 59.44 2qut n VAL 23 Cb 0.13 -0.44 0.09 0.00 -1.47 0.00 0.00 33.84 32.16 2qut n VAL 23 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2qut s ALA 24 N -3.31 2.13 -0.20 2.33 0.00 -0.86 -4.74 121.76 117.11 2qut s ALA 24 Ca 0.50 1.05 -0.42 0.00 0.00 0.00 0.00 51.96 53.09 2qut s ALA 24 Cb 0.43 -3.53 -0.20 0.00 0.00 0.00 0.00 23.12 19.83 2qut s ALA 24 CO 0.03 -1.91 1.27 -2.30 0.00 0.00 0.00 175.76 172.84 2qut n PRO 25 N -2.53 0.00 -0.98 0.00 -0.02 -1.26 -0.40 135.00 129.81 2qut n PRO 25 Ca 0.15 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 2qut n PRO 25 Cb 0.49 -1.47 0.00 0.00 -0.02 0.00 0.00 33.50 32.50 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 2.49 0.91 3.70 -1.23 0.00 -1.26 -5.02 105.19 104.77 2qut n GLY 26 Ca 0.24 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.04 2.68 0.03 1.61 1.02 0.47 -4.42 119.74 121.09 2qut s LYS 27 Ca 0.00 -0.74 0.01 0.00 0.02 0.00 0.00 55.97 55.26 2qut s LYS 27 Cb 0.00 -2.61 -0.00 0.00 -0.52 0.00 0.00 37.83 34.69 2qut s LYS 27 CO 0.00 0.57 0.03 0.41 -0.92 0.00 0.00 175.35 175.44 2qut n GLY 28 N 0.83 3.91 3.32 -3.33 0.00 0.12 -4.60 105.19 105.44 2qut n GLY 28 Ca -0.12 -1.69 -0.32 0.00 0.00 0.00 0.00 46.02 43.90 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 -2.14 2.45 -0.37 -0.61 1.01 0.21 -0.22 121.20 121.53 2qut s ILE 29 Ca 0.04 -0.91 -0.19 0.00 0.00 0.00 0.00 60.65 59.59 2qut s ILE 29 Cb 0.00 -1.95 0.01 0.00 0.01 0.00 0.00 42.46 40.53 2qut s ILE 29 CO 0.03 0.56 0.58 -0.22 0.00 0.00 0.00 174.94 175.89 2qut s LEU 30 N -0.04 4.38 -0.74 2.97 2.96 -0.48 -1.49 118.68 126.23 2qut s LEU 30 Ca -0.06 -0.07 -0.18 0.00 -0.22 0.00 0.00 54.13 53.60 2qut s LEU 30 Cb -0.15 -2.67 0.14 0.00 0.50 0.00 0.00 46.19 44.01 2qut s LEU 30 CO 0.05 -0.59 0.85 0.00 -1.32 0.00 0.00 176.35 175.34 2qut s ALA 31 N 2.58 3.53 -0.33 5.97 0.00 0.09 -1.02 121.76 132.59 2qut s ALA 31 Ca 0.21 -2.61 0.07 0.00 0.00 0.00 0.00 51.96 49.64 2qut s ALA 31 Cb -0.15 -3.69 0.49 0.00 0.00 0.00 0.00 23.12 19.77 2qut s ALA 31 CO 0.15 -2.54 1.47 0.00 0.00 0.00 0.00 175.76 174.84 2qut n ALA 32 N 5.94 4.66 -0.23 0.00 0.00 -0.61 -4.10 120.51 126.16 2qut n ALA 32 Ca 0.05 -3.31 -0.10 0.00 0.00 0.00 0.00 53.44 50.08 2qut n ALA 32 Cb 0.45 -0.76 0.13 0.00 0.00 0.00 0.00 19.45 19.28 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 -1.03 3.49 -4.74 0.00 5.75 -0.90 -4.16 116.55 114.96 2qut n ASP 33 Ca 0.38 -2.84 -0.41 0.00 -0.01 0.00 0.00 54.79 51.91 2qut n ASP 33 Cb 0.98 -0.68 -0.03 0.00 -1.03 0.00 0.00 41.12 40.37 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 -1.90 4.29 1.05 0.11 8.01 -1.26 -4.47 118.70 124.53 2qut s GLU 34 Ca 0.32 2.25 -0.16 0.00 0.01 0.00 0.00 54.97 57.39 2qut s GLU 34 Cb 0.27 -3.14 0.22 0.00 -4.31 0.00 0.00 34.13 27.17 2qut s GLU 34 CO 0.07 -0.41 1.19 -1.54 0.01 0.00 0.00 175.26 174.58 2qut s SER 35 N 0.47 2.30 0.10 -0.19 1.04 -1.26 -4.62 113.70 111.53 2qut s SER 35 Ca 0.60 0.60 -0.25 0.00 0.48 0.00 0.00 55.95 57.38 2qut s SER 35 Cb -0.41 -0.87 -0.11 0.00 0.10 0.00 0.00 66.02 64.73 2qut s SER 35 CO 0.40 -3.27 1.69 0.74 0.98 0.00 0.00 173.24 173.78 2qut h THR 36 N -2.00 0.69 -0.09 2.02 2.02 -1.98 0.27 112.91 113.85 2qut h THR 36 Ca -0.46 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 66.68 2qut h THR 36 Cb 1.28 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 68.38 2qut h THR 36 CO 0.43 0.00 -0.10 1.23 0.37 0.00 0.00 175.52 177.44 2qut h GLY 37 N -0.28 0.14 0.73 2.16 0.00 -2.00 -1.80 103.07 102.02 2qut h GLY 37 Ca 0.01 -0.08 -0.14 0.00 0.00 0.00 0.00 47.33 47.13 2qut h GLY 37 CO -0.05 0.07 -0.54 0.23 0.00 0.00 0.00 176.54 176.24 2qut h SER 38 N 0.13 0.48 0.63 0.19 0.87 -1.76 -3.14 113.55 110.96 2qut h SER 38 Ca 0.03 -0.76 0.00 0.00 -1.23 0.00 0.00 61.79 59.82 2qut h SER 38 Cb 0.27 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.08 2qut h SER 38 CO 0.02 1.18 0.00 0.00 -0.53 0.00 0.00 176.83 177.50 2qut n ILE 39 N -4.27 0.89 0.14 2.23 0.13 0.91 -3.54 119.36 115.86 2qut n ILE 39 Ca -0.10 0.22 -0.14 0.00 -1.10 0.00 0.00 62.75 61.63 2qut n ILE 39 Cb 0.65 -1.05 -0.07 0.00 -0.84 0.00 0.00 39.64 38.32 2qut n ILE 39 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2qut h ALA 40 N 2.41 -0.68 -0.30 1.51 0.00 -1.27 -1.76 119.26 119.16 2qut h ALA 40 Ca 0.00 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.86 2qut h ALA 40 Cb 0.32 0.59 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 2qut h ALA 40 CO 0.00 -0.94 0.15 -0.22 0.00 0.00 0.00 179.25 178.24 2qut h LYS 41 N -0.64 0.30 -0.48 0.00 1.63 -1.73 0.89 116.57 116.53 2qut h LYS 41 Ca 0.01 -0.02 0.09 0.00 -0.85 0.00 0.00 60.65 59.88 2qut h LYS 41 Cb 0.64 -0.07 -0.10 0.00 -0.60 0.00 0.00 32.23 32.10 2qut h LYS 41 CO -0.18 0.20 -0.37 0.00 -3.45 0.00 0.00 179.45 175.65 2qut h ARG 42 N 0.31 -0.23 -0.27 1.90 2.47 -1.65 0.47 114.38 117.37 2qut h ARG 42 Ca 0.13 0.02 -0.11 0.00 -1.26 0.00 0.00 59.98 58.75 2qut h ARG 42 Cb 0.05 0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 28.41 2qut h ARG 42 CO -0.09 -0.15 -0.29 -0.07 0.56 0.00 0.00 179.97 179.92 2qut h LEU 43 N -0.24 0.57 -0.72 3.04 3.38 -1.07 -2.98 115.31 117.29 2qut h LEU 43 Ca 0.18 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 2qut h LEU 43 Cb 0.56 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 2qut h LEU 43 CO -0.61 0.84 0.36 1.56 0.09 0.00 0.00 178.44 180.68 2qut h GLN 44 N 0.48 1.03 0.00 1.13 4.20 0.10 -0.21 115.11 121.85 2qut h GLN 44 Ca 0.06 -0.14 0.00 0.00 0.06 0.00 0.00 58.65 58.63 2qut h GLN 44 Cb 0.75 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.34 2qut h GLN 44 CO 0.06 0.79 0.00 -1.13 -0.67 0.00 0.00 178.83 177.88 2qut n SER 45 N -4.44 0.13 -0.39 1.46 3.41 0.15 -1.13 113.62 112.80 2qut n SER 45 Ca 0.06 0.55 0.06 0.00 -0.26 0.00 0.00 58.87 59.29 2qut n SER 45 Cb 0.12 -0.57 0.11 0.00 -0.26 0.00 0.00 64.21 63.60 2qut n SER 45 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 2qut n ILE 46 N -1.67 1.34 -3.86 -1.33 -5.35 -0.62 -5.01 119.36 102.87 2qut n ILE 46 Ca 0.00 -1.81 -0.25 0.00 -0.27 0.00 0.00 62.75 60.43 2qut n ILE 46 Cb 0.03 0.04 -0.00 0.00 -1.74 0.00 0.00 39.64 37.97 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 -0.88 -0.31 3.01 3.28 0.00 -0.28 -4.69 105.19 105.33 2qut n GLY 47 Ca 0.12 0.17 -0.30 0.00 0.00 0.00 0.00 46.02 46.00 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 -3.84 1.64 0.30 2.61 2.01 -0.19 -4.99 115.64 113.18 2qut s THR 48 Ca 0.04 -0.87 -0.28 0.00 0.31 0.00 0.00 61.69 60.89 2qut s THR 48 Cb -0.02 -1.64 -0.14 0.00 0.01 0.00 0.00 72.50 70.72 2qut s THR 48 CO 0.87 0.29 1.11 1.21 -0.69 0.00 0.00 174.62 177.41 2qut n GLU 49 N 4.71 1.59 -2.43 4.92 2.13 -1.26 -4.20 120.64 126.09 2qut n GLU 49 Ca -0.16 0.56 -0.43 0.00 0.66 0.00 0.00 57.16 57.79 2qut n GLU 49 Cb 0.48 -2.00 0.00 0.00 0.27 0.00 0.00 31.44 30.19 2qut n GLU 49 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 2qut n ASN 50 N 1.16 4.82 -4.88 4.31 4.05 -1.26 -4.81 115.26 118.65 2qut n ASN 50 Ca 0.08 -2.96 -0.21 0.00 0.45 0.00 0.00 54.58 51.94 2qut n ASN 50 Cb 0.33 -1.62 -0.03 0.00 1.23 0.00 0.00 39.78 39.69 2qut n ASN 50 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 177.26 174.63 2qut s THR 51 N 2.38 3.76 0.29 -0.44 -4.23 -1.26 -5.02 115.64 111.11 2qut s THR 51 Ca 0.46 -1.30 0.01 0.00 -1.18 0.00 0.00 61.69 59.68 2qut s THR 51 Cb 0.06 -3.26 0.10 0.00 1.34 0.00 0.00 72.50 70.74 2qut s THR 51 CO 0.00 -0.19 1.77 -0.08 -0.54 0.00 0.00 174.62 175.58 2qut h GLU 52 N 1.21 0.60 0.14 3.99 4.81 -1.99 -2.55 114.58 120.78 2qut h GLU 52 Ca -0.45 -0.18 -0.01 0.00 -0.13 0.00 0.00 59.36 58.59 2qut h GLU 52 Cb 1.25 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.57 2qut h GLU 52 CO 0.58 0.70 -0.07 1.49 -0.73 0.00 0.00 179.01 180.98 2qut h GLU 53 N 0.55 -0.18 -0.68 1.92 4.22 -1.97 0.74 114.58 119.18 2qut h GLU 53 Ca 0.10 0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.55 2qut h GLU 53 Cb 0.52 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.78 2qut h GLU 53 CO 0.03 -0.05 0.44 -0.91 -2.18 0.00 0.00 179.01 176.34 2qut h ASN 54 N -0.28 0.79 -0.20 1.04 2.35 -1.85 0.31 115.58 117.75 2qut h ASN 54 Ca -0.02 -0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 55.67 2qut h ASN 54 Cb 0.22 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.39 2qut h ASN 54 CO 0.03 0.59 0.00 0.03 -1.65 0.00 0.00 177.43 176.43 2qut h ARG 55 N 0.93 0.34 -0.44 0.81 3.08 -1.18 0.14 114.38 118.06 2qut h ARG 55 Ca 0.25 -0.11 0.01 0.00 0.07 0.00 0.00 59.98 60.20 2qut h ARG 55 Cb -0.08 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 2qut h ARG 55 CO -0.05 0.54 0.29 -0.09 -1.07 0.00 0.00 179.97 179.59 2qut h ARG 56 N 0.10 0.57 -0.42 0.04 2.43 -0.20 0.48 114.38 117.40 2qut h ARG 56 Ca 0.06 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.18 2qut h ARG 56 Cb 0.38 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.78 2qut h ARG 56 CO 0.01 0.38 0.22 0.35 -1.51 0.00 0.00 179.97 179.42 2qut h PHE 57 N 0.59 0.58 -0.12 2.20 3.57 -0.24 0.18 116.94 123.70 2qut h PHE 57 Ca 0.16 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.65 2qut h PHE 57 Cb -0.06 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.49 2qut h PHE 57 CO -0.05 0.45 0.07 -0.92 -2.23 0.00 0.00 178.31 175.63 2qut h TYR 58 N 0.54 0.15 -0.81 0.41 3.20 -0.32 -0.23 116.97 119.90 2qut h TYR 58 Ca 0.15 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.00 2qut h TYR 58 Cb 0.07 -0.05 -0.04 0.00 1.54 0.00 0.00 36.73 38.25 2qut h TYR 58 CO -0.02 0.14 0.43 0.00 -1.64 0.00 0.00 178.16 177.07 2qut h ARG 59 N 0.12 1.15 -0.59 1.82 -0.00 -0.75 -2.19 114.38 113.94 2qut h ARG 59 Ca 0.04 -0.14 0.03 0.00 -0.50 0.00 0.00 59.98 59.40 2qut h ARG 59 Cb 0.03 -0.22 -0.04 0.00 0.00 0.00 0.00 29.97 29.74 2qut h ARG 59 CO -0.01 0.86 0.36 0.37 0.00 0.00 0.00 179.97 181.55 2qut h GLN 60 N 1.14 0.70 -0.57 0.04 4.15 -0.30 -0.25 115.11 120.01 2qut h GLN 60 Ca 0.28 -0.04 0.10 0.00 0.77 0.00 0.00 58.65 59.77 2qut h GLN 60 Cb 0.05 -0.16 -0.08 0.00 0.21 0.00 0.00 27.48 27.51 2qut h GLN 60 CO -0.04 0.46 0.12 1.25 -1.93 0.00 0.00 178.83 178.69 2qut h LEU 61 N 0.72 0.01 0.11 -2.39 6.46 -0.43 0.38 115.31 120.18 2qut h LEU 61 Ca 0.24 0.10 -0.01 0.00 -0.12 0.00 0.00 57.88 58.10 2qut h LEU 61 Cb 0.01 0.14 0.00 0.00 -0.73 0.00 0.00 40.66 40.08 2qut h LEU 61 CO -0.10 0.02 -0.05 -0.07 -0.62 0.00 0.00 178.44 177.62 2qut h LEU 62 N 0.26 -0.12 -2.18 2.25 3.38 -1.06 -3.18 115.31 114.66 2qut h LEU 62 Ca 0.30 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 2qut h LEU 62 Cb 0.42 0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 2qut h LEU 62 CO -0.38 0.39 -0.06 -0.07 0.09 0.00 0.00 178.44 178.42 2qut h LEU 63 N -0.68 0.00 -3.02 1.67 3.38 -0.82 -2.71 115.31 113.12 2qut h LEU 63 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2qut h LEU 63 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2qut h LEU 63 CO 0.02 0.06 0.00 0.35 0.09 0.00 0.00 178.44 178.96 2qut n THR 64 N -3.83 1.55 -1.22 0.22 -2.24 0.10 -4.74 114.28 104.13 2qut n THR 64 Ca -0.02 -1.17 -0.35 0.00 -2.27 0.00 0.00 64.05 60.24 2qut n THR 64 Cb 0.15 0.25 0.09 0.00 -2.10 0.00 0.00 70.33 68.72 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 1.10 -0.78 -0.91 6.98 0.00 -1.03 -4.89 120.51 120.98 2qut n ALA 65 Ca 0.24 -0.28 -0.33 0.00 0.00 0.00 0.00 53.44 53.07 2qut n ALA 65 Cb 0.77 -2.04 0.13 0.00 0.00 0.00 0.00 19.45 18.31 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 -1.61 -0.59 0.00 0.00 5.68 -1.26 -4.82 116.55 113.96 2qut n ASP 66 Ca 0.12 0.45 0.00 0.00 -0.50 0.00 0.00 54.79 54.86 2qut n ASP 66 Cb 0.50 -1.35 0.00 0.00 -1.14 0.00 0.00 41.12 39.13 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 -2.38 0.00 0.29 -1.12 9.92 -1.26 -2.30 116.55 119.70 2qut n ASP 67 Ca 0.10 0.24 0.16 0.00 -0.53 0.00 0.00 54.79 54.77 2qut n ASP 67 Cb 0.52 -0.24 0.86 0.00 -0.64 0.00 0.00 41.12 41.61 2qut n ASP 67 CO 0.00 0.00 0.00 0.03 0.13 0.00 0.00 177.20 177.36 2qut h ARG 68 N 0.00 0.00 0.00 -1.24 3.08 -2.00 -2.37 114.38 111.85 2qut h ARG 68 Ca 0.00 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.90 2qut h ARG 68 Cb 0.45 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.47 2qut h ARG 68 CO 0.00 0.06 -0.80 -0.39 -1.07 0.00 0.00 179.97 177.77 2qut h VAL 69 N 0.00 1.00 -0.98 2.04 -1.51 -1.79 -3.39 116.25 111.63 2qut h VAL 69 Ca -0.00 -2.48 0.13 0.00 -1.23 0.00 0.00 66.70 63.12 2qut h VAL 69 Cb 0.24 2.46 -0.14 0.00 -2.13 0.00 0.00 31.29 31.72 2qut h VAL 69 CO 0.01 0.57 -0.44 0.59 -1.23 0.00 0.00 177.57 177.07 2qut n ASN 70 N -3.19 -0.76 0.00 4.19 4.13 -0.89 0.79 115.26 119.53 2qut n ASN 70 Ca -0.01 1.71 0.10 0.00 1.68 0.00 0.00 54.58 58.07 2qut n ASN 70 Cb 0.81 -0.34 0.51 0.00 -1.54 0.00 0.00 39.78 39.22 2qut n ASN 70 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 2qut n PRO 71 N -5.37 0.19 -0.03 3.52 -0.04 -1.26 -3.06 135.00 128.96 2qut n PRO 71 Ca 0.08 0.10 -0.14 0.00 -0.04 0.00 0.00 63.50 63.50 2qut n PRO 71 Cb 0.35 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.17 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 -2.56 5.11 -0.15 0.00 -1.09 0.11 -0.70 121.20 121.91 2qut s ILE 73 Ca -0.14 -0.93 0.16 0.00 -2.23 0.00 0.00 60.65 57.52 2qut s ILE 73 Cb 0.07 -3.97 -0.03 0.00 -1.58 0.00 0.00 42.46 36.95 2qut s ILE 73 CO 0.79 -0.45 1.13 1.23 -1.23 0.00 0.00 174.94 176.41 2qut h GLY 74 N 8.66 0.00 -3.29 6.18 0.00 -0.76 -3.37 103.07 110.48 2qut h GLY 74 Ca -0.27 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.02 2qut h GLY 74 CO 0.80 0.00 0.11 -0.32 0.00 0.00 0.00 176.54 177.13 2qut s GLY 75 N -4.61 -0.50 -0.08 4.60 0.00 -1.12 -1.08 107.32 104.53 2qut s GLY 75 Ca 0.00 0.52 0.00 0.00 0.00 0.00 0.00 44.72 45.24 2qut s GLY 75 CO 0.78 0.20 -0.05 0.14 0.00 0.00 0.00 173.10 174.17 2qut s VAL 76 N -3.13 0.73 -0.19 1.40 1.01 -0.32 -1.38 120.40 118.53 2qut s VAL 76 Ca -0.02 -0.16 -0.19 0.00 0.00 0.00 0.00 61.98 61.61 2qut s VAL 76 Cb -0.00 -0.78 -0.03 0.00 0.00 0.00 0.00 36.38 35.57 2qut s VAL 76 CO -0.07 0.30 0.54 -0.63 0.00 0.00 0.00 175.10 175.23 2qut s ILE 77 N 1.41 5.10 0.23 2.22 1.01 -0.19 0.16 121.20 131.13 2qut s ILE 77 Ca -0.02 1.01 0.10 0.00 0.00 0.00 0.00 60.65 61.73 2qut s ILE 77 Cb -0.13 -3.86 -0.04 0.00 0.01 0.00 0.00 42.46 38.43 2qut s ILE 77 CO -0.03 0.18 -0.08 -0.76 0.00 0.00 0.00 174.94 174.25 2qut s LEU 78 N 1.58 2.99 0.24 2.97 1.43 0.41 -1.58 118.68 126.72 2qut s LEU 78 Ca 0.25 -0.67 -0.09 0.00 -1.03 0.00 0.00 54.13 52.59 2qut s LEU 78 Cb -0.16 -1.59 -0.07 0.00 0.03 0.00 0.00 46.19 44.41 2qut s LEU 78 CO 0.10 0.06 0.56 0.12 0.23 0.00 0.00 176.35 177.41 2qut s PHE 79 N -2.05 3.43 0.18 0.29 5.36 -1.26 -1.43 117.98 122.51 2qut s PHE 79 Ca 0.28 0.87 -0.24 0.00 -0.96 0.00 0.00 56.93 56.88 2qut s PHE 79 Cb -0.07 -2.26 0.07 0.00 -0.34 0.00 0.00 43.02 40.42 2qut s PHE 79 CO 0.17 0.25 1.47 1.58 -1.46 0.00 0.00 175.22 177.23 2qut n HIS 80 N -0.22 -0.22 -0.22 10.12 -0.00 -1.26 -1.15 115.22 122.27 2qut n HIS 80 Ca 0.00 1.18 0.00 0.00 -0.00 0.00 0.00 57.72 58.91 2qut n HIS 80 Cb 0.53 -0.70 0.08 0.00 -0.00 0.00 0.00 29.99 29.89 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 -0.42 1.57 4.81 -1.98 -1.68 114.58 116.90 2qut h GLU 81 Ca 0.23 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.41 2qut h GLU 81 Cb 0.47 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.83 2qut h GLU 81 CO -0.92 0.01 0.03 1.15 -0.73 0.00 0.00 179.01 178.55 2qut h THR 82 N 0.02 1.22 -0.08 0.32 2.02 -1.52 -2.59 112.91 112.29 2qut h THR 82 Ca 0.32 -0.85 0.02 0.00 0.77 0.00 0.00 66.41 66.67 2qut h THR 82 Cb 0.50 0.87 -0.00 0.00 -1.74 0.00 0.00 68.15 67.77 2qut h THR 82 CO -0.66 0.30 0.10 0.25 0.37 0.00 0.00 175.52 175.88 2qut h LEU 83 N 0.63 0.00 -3.13 2.58 5.85 -0.87 -2.09 115.31 118.27 2qut h LEU 83 Ca 0.13 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.85 2qut h LEU 83 Cb 0.35 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.38 2qut h LEU 83 CO 0.01 0.00 0.00 -1.22 -0.34 0.00 0.00 178.44 176.89 2qut n TYR 84 N -3.68 0.74 -3.69 1.25 4.01 -0.98 -4.58 117.16 110.23 2qut n TYR 84 Ca -0.01 -0.77 -0.20 0.00 -0.16 0.00 0.00 57.90 56.76 2qut n TYR 84 Cb 0.20 -0.22 -0.02 0.00 -0.31 0.00 0.00 39.34 38.99 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 -2.27 3.12 0.16 -0.72 -0.21 -0.79 -5.01 119.66 113.95 2qut s GLN 85 Ca 0.35 -1.00 0.09 0.00 0.02 0.00 0.00 55.36 54.82 2qut s GLN 85 Cb 0.27 -2.77 -0.04 0.00 1.00 0.00 0.00 33.01 31.47 2qut s GLN 85 CO 0.10 0.18 -0.20 0.15 -2.12 0.00 0.00 175.29 173.40 2qut s LYS 86 N -4.08 1.31 1.03 2.91 1.02 -1.26 -1.73 119.74 118.94 2qut s LYS 86 Ca 0.41 -1.40 -0.16 0.00 0.02 0.00 0.00 55.97 54.83 2qut s LYS 86 Cb -0.09 -1.44 0.21 0.00 -0.52 0.00 0.00 37.83 35.99 2qut s LYS 86 CO 0.29 0.30 1.22 0.00 -0.92 0.00 0.00 175.35 176.25 2qut s ALA 87 N -1.86 1.64 0.20 5.17 0.00 0.23 -4.88 121.76 122.26 2qut s ALA 87 Ca 0.16 -0.99 -0.11 0.00 0.00 0.00 0.00 51.96 51.01 2qut s ALA 87 Cb -0.07 -2.86 0.21 0.00 0.00 0.00 0.00 23.12 20.40 2qut s ALA 87 CO 0.07 -2.77 1.78 -0.44 0.00 0.00 0.00 175.76 174.41 2qut h ASP 88 N -1.91 0.40 0.00 0.00 3.32 -1.99 -1.10 116.42 115.15 2qut h ASP 88 Ca -0.46 0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.64 2qut h ASP 88 Cb 1.27 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.79 2qut h ASP 88 CO 0.41 0.26 0.00 -0.90 -1.72 0.00 0.00 179.24 177.30 2qut n ASP 89 N -4.87 0.00 0.00 6.45 3.85 -1.26 -4.81 116.55 115.90 2qut n ASP 89 Ca 0.07 -0.69 0.00 0.00 -0.71 0.00 0.00 54.79 53.46 2qut n ASP 89 Cb 0.18 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 39.95 2qut n ASP 89 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2qut n GLY 90 N -0.08 1.43 3.70 6.12 0.00 -0.41 -5.03 105.19 110.91 2qut n GLY 90 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.37 4.39 0.32 1.61 0.52 -1.26 -4.69 118.95 119.47 2qut s ARG 91 Ca 0.00 1.73 -0.29 0.00 -0.52 0.00 0.00 55.73 56.65 2qut s ARG 91 Cb 0.00 -3.47 -0.11 0.00 0.52 0.00 0.00 34.95 31.89 2qut s ARG 91 CO 0.00 -0.36 1.52 -2.14 0.02 0.00 0.00 175.30 174.34 2qut s PRO 92 N 1.70 4.14 0.30 3.54 0.02 -1.26 -0.60 135.00 142.85 2qut s PRO 92 Ca 0.58 2.53 0.07 0.00 0.02 0.00 0.00 61.00 64.19 2qut s PRO 92 Cb -0.27 -3.01 0.80 0.00 0.02 0.00 0.00 34.50 32.03 2qut s PRO 92 CO 0.26 -0.55 1.72 0.74 -0.33 0.00 0.00 177.00 178.84 2qut h PHE 93 N 4.06 0.88 -0.89 6.54 0.04 -1.61 0.40 116.94 126.36 2qut h PHE 93 Ca -0.49 0.04 0.11 0.00 2.80 0.00 0.00 57.97 60.43 2qut h PHE 93 Cb 1.23 -0.24 -0.07 0.00 2.20 0.00 0.00 35.95 39.07 2qut h PHE 93 CO 0.56 0.05 0.57 -1.35 -0.60 0.00 0.00 178.31 177.55 2qut h PRO 94 N 0.54 0.82 -0.52 1.51 0.11 -1.84 -0.27 132.00 132.35 2qut h PRO 94 Ca 0.60 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 66.54 2qut h PRO 94 Cb 1.11 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.01 2qut h PRO 94 CO -0.48 0.54 -0.13 0.37 -0.21 0.00 0.00 178.00 178.09 2qut h GLN 95 N 0.85 1.00 -0.11 1.05 4.15 -0.58 -1.82 115.11 119.65 2qut h GLN 95 Ca 0.42 -0.38 -0.00 0.00 0.77 0.00 0.00 58.65 59.46 2qut h GLN 95 Cb 0.47 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.09 2qut h GLN 95 CO -0.18 1.06 0.07 0.28 -1.93 0.00 0.00 178.83 178.12 2qut h VAL 96 N 0.88 1.05 -0.17 2.39 2.07 -0.39 -0.51 116.25 121.58 2qut h VAL 96 Ca 0.13 -0.12 0.01 0.00 0.82 0.00 0.00 66.70 67.55 2qut h VAL 96 Cb 0.69 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 2qut h VAL 96 CO 0.05 0.05 0.06 0.40 0.02 0.00 0.00 177.57 178.15 2qut h ILE 97 N 0.12 0.97 -0.24 4.57 2.04 -1.03 -2.81 117.51 121.13 2qut h ILE 97 Ca 0.04 -0.05 -0.06 0.00 1.00 0.00 0.00 64.86 65.79 2qut h ILE 97 Cb 0.02 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 2qut h ILE 97 CO -0.01 0.03 -0.12 0.11 0.00 0.00 0.00 178.15 178.16 2qut h LYS 98 N 0.14 0.39 0.00 2.37 1.57 -1.18 -2.05 116.57 117.82 2qut h LYS 98 Ca 0.07 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2qut h LYS 98 Cb 0.04 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.30 2qut h LYS 98 CO -0.07 0.52 0.00 -1.13 -0.57 0.00 0.00 179.45 178.20 2qut n SER 99 N -4.23 0.62 -1.20 0.86 3.41 -0.21 -2.00 113.62 110.87 2qut n SER 99 Ca 0.00 0.64 0.11 0.00 -0.26 0.00 0.00 58.87 59.36 2qut n SER 99 Cb 0.30 -0.78 0.26 0.00 -0.26 0.00 0.00 64.21 63.73 2qut n SER 99 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2qut n LYS 100 N -2.17 2.59 -0.55 4.33 5.02 -0.83 -4.95 118.16 121.60 2qut n LYS 100 Ca 0.03 -2.42 0.00 0.00 -2.02 0.00 0.00 58.31 53.89 2qut n LYS 100 Cb 0.25 -1.52 0.00 0.00 -0.02 0.00 0.00 35.03 33.74 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 1.49 0.73 3.86 0.72 0.00 -0.85 -4.54 105.19 106.61 2qut n GLY 101 Ca 0.21 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.95 1.72 0.11 -0.02 0.00 -0.84 -4.81 107.32 101.53 2qut s GLY 102 Ca 0.00 -1.13 -0.15 0.00 0.00 0.00 0.00 44.72 43.44 2qut s GLY 102 CO 0.00 -1.13 0.53 0.14 0.00 0.00 0.00 173.10 172.64 2qut s VAL 103 N -1.74 4.86 -0.10 1.40 1.01 -0.24 -3.64 120.40 121.95 2qut s VAL 103 Ca 0.32 0.89 -0.19 0.00 0.00 0.00 0.00 61.98 63.01 2qut s VAL 103 Cb -0.11 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 2qut s VAL 103 CO 0.26 0.34 0.50 -0.69 0.00 0.00 0.00 175.10 175.51 2qut s VAL 104 N -1.35 5.16 0.24 2.92 1.01 -1.26 -1.18 120.40 125.93 2qut s VAL 104 Ca 0.34 1.01 0.12 0.00 0.00 0.00 0.00 61.98 63.45 2qut s VAL 104 Cb -0.16 -3.84 -0.05 0.00 0.00 0.00 0.00 36.38 32.33 2qut s VAL 104 CO 0.18 0.33 -0.21 -0.83 0.00 0.00 0.00 175.10 174.58 2qut s GLY 105 N 0.54 1.79 -0.05 4.51 0.00 0.12 -0.40 107.32 113.84 2qut s GLY 105 Ca 0.27 -1.75 -0.00 0.00 0.00 0.00 0.00 44.72 43.24 2qut s GLY 105 CO 0.11 -1.81 -0.01 -1.50 0.00 0.00 0.00 173.10 169.89 2qut s ILE 106 N -2.09 0.39 0.13 0.90 1.10 -0.09 -0.44 121.20 121.10 2qut s ILE 106 Ca 0.26 0.03 -0.30 0.00 -0.51 0.00 0.00 60.65 60.12 2qut s ILE 106 Cb -0.07 -0.48 -0.07 0.00 0.15 0.00 0.00 42.46 41.99 2qut s ILE 106 CO 0.13 0.22 1.22 -0.75 -2.11 0.00 0.00 174.94 173.65 2qut s LYS 107 N 1.40 4.45 0.00 3.50 2.36 -0.51 -2.08 119.74 128.86 2qut s LYS 107 Ca -0.04 1.85 0.00 0.00 -2.55 0.00 0.00 55.97 55.24 2qut s LYS 107 Cb -0.13 -3.28 -0.00 0.00 -1.05 0.00 0.00 37.83 33.36 2qut s LYS 107 CO -0.03 -0.19 0.21 1.33 1.55 0.00 0.00 175.35 178.23 2qut n VAL 108 N 3.20 0.00 -1.56 4.02 0.24 -0.22 -4.63 118.33 119.38 2qut n VAL 108 Ca 0.07 -0.50 -0.30 0.00 -2.04 0.00 0.00 64.34 61.57 2qut n VAL 108 Cb 0.45 1.00 0.09 0.00 -1.47 0.00 0.00 33.84 33.91 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 -0.62 4.54 -0.29 -1.34 1.47 -1.25 -4.83 116.67 114.35 2qut s ASP 109 Ca 0.00 1.31 0.07 0.00 1.18 0.00 0.00 52.55 55.12 2qut s ASP 109 Cb 0.00 -2.05 0.46 0.00 -0.34 0.00 0.00 42.92 40.98 2qut s ASP 109 CO 0.01 -1.94 1.22 0.29 0.68 0.00 0.00 175.17 175.43 2qut n LYS 110 N -3.41 3.36 0.00 2.11 5.02 0.59 -4.95 118.16 120.88 2qut n LYS 110 Ca 0.07 -4.04 0.00 0.00 -2.02 0.00 0.00 58.31 52.32 2qut n LYS 110 Cb 0.56 -2.21 0.00 0.00 -0.02 0.00 0.00 35.03 33.37 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 -0.76 -1.40 3.89 0.72 0.00 -1.26 -4.70 105.19 101.68 2qut n GLY 111 Ca 0.42 -1.58 -0.29 0.00 0.00 0.00 0.00 46.02 44.56 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 -2.03 4.86 0.05 1.61 -7.23 -1.26 -1.78 120.40 114.61 2qut s VAL 112 Ca 0.00 0.41 0.03 0.00 -1.81 0.00 0.00 61.98 60.61 2qut s VAL 112 Cb 0.00 -3.77 -0.02 0.00 0.56 0.00 0.00 36.38 33.14 2qut s VAL 112 CO 0.00 -0.59 -0.10 0.68 -0.31 0.00 0.00 175.10 174.78 2qut s VAL 113 N -2.44 0.70 0.37 1.32 -7.23 -0.28 -4.88 120.40 107.96 2qut s VAL 113 Ca 0.49 -1.10 -0.26 0.00 -1.81 0.00 0.00 61.98 59.29 2qut s VAL 113 Cb -0.10 -0.73 -0.09 0.00 0.56 0.00 0.00 36.38 36.02 2qut s VAL 113 CO 0.35 -0.31 1.14 -2.16 -0.31 0.00 0.00 175.10 173.81 2qut s PRO 114 N -1.55 4.24 -0.42 4.82 0.04 -1.26 -1.56 135.00 139.30 2qut s PRO 114 Ca -0.07 1.79 -0.17 0.00 0.04 0.00 0.00 61.00 62.59 2qut s PRO 114 Cb -0.10 -2.80 0.02 0.00 0.04 0.00 0.00 34.50 31.66 2qut s PRO 114 CO 0.01 -0.14 0.41 -0.51 0.04 0.00 0.00 177.00 176.80 2qut s LEU 115 N -2.22 4.95 0.46 -3.56 1.43 -0.30 -4.82 118.68 114.62 2qut s LEU 115 Ca 0.53 -0.75 -0.25 0.00 -1.03 0.00 0.00 54.13 52.63 2qut s LEU 115 Cb -0.30 -2.33 -0.08 0.00 0.03 0.00 0.00 46.19 43.51 2qut s LEU 115 CO 0.38 -0.56 1.35 0.00 0.23 0.00 0.00 176.35 177.75 2qut n ALA 116 N 5.50 1.66 -0.87 4.21 0.00 -1.26 -2.66 120.51 127.09 2qut n ALA 116 Ca -0.08 0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.59 2qut n ALA 116 Cb 0.47 -2.34 0.00 0.00 0.00 0.00 0.00 19.45 17.58 2qut n ALA 116 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qut n GLY 117 N 0.71 0.62 3.59 0.00 0.00 -1.26 -5.04 105.19 103.81 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 -2.26 2.25 -1.34 2.61 -4.23 -1.09 -5.04 115.64 106.54 2qut s THR 118 Ca 0.00 -2.09 -0.13 0.00 -1.18 0.00 0.00 61.69 58.29 2qut s THR 118 Cb 0.00 -2.78 0.10 0.00 1.34 0.00 0.00 72.50 71.16 2qut s THR 118 CO 0.00 -0.14 1.93 -3.20 -0.54 0.00 0.00 174.62 172.67 2qut n ASN 119 N -0.89 4.61 -1.25 3.99 4.05 -1.26 -4.42 115.26 120.09 2qut n ASN 119 Ca -0.05 -2.95 -0.14 0.00 0.45 0.00 0.00 54.58 51.89 2qut n ASN 119 Cb 0.64 -1.61 -0.04 0.00 1.23 0.00 0.00 39.78 40.00 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 3.95 0.84 3.92 8.20 0.00 -1.26 -5.01 105.19 115.84 2qut n GLY 120 Ca 0.46 -0.35 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.72 3.05 0.21 1.61 2.02 -1.26 -4.97 118.70 115.64 2qut s GLU 121 Ca 0.00 -0.04 -0.01 0.00 0.02 0.00 0.00 54.97 54.94 2qut s GLU 121 Cb 0.00 -2.33 -0.04 0.00 0.10 0.00 0.00 34.13 31.85 2qut s GLU 121 CO 0.00 -0.55 0.12 0.95 0.02 0.00 0.00 175.26 175.80 2qut s THR 122 N -2.88 0.13 0.21 3.63 -4.23 -1.26 -1.15 115.64 110.09 2qut s THR 122 Ca 0.52 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 59.05 2qut s THR 122 Cb -0.10 -2.50 -0.01 0.00 1.34 0.00 0.00 72.50 71.23 2qut s THR 122 CO 0.44 -0.03 0.07 1.07 -0.54 0.00 0.00 174.62 175.63 2qut n THR 123 N -0.30 0.00 -4.60 3.99 5.66 -0.60 -4.77 114.28 113.65 2qut n THR 123 Ca 0.01 -1.21 -0.23 0.00 -3.05 0.00 0.00 64.05 59.58 2qut n THR 123 Cb 0.66 0.42 -0.14 0.00 -1.55 0.00 0.00 70.33 69.71 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 -2.29 1.25 0.38 1.09 2.01 -1.26 -1.12 115.64 115.70 2qut s THR 124 Ca 0.10 -0.84 0.08 0.00 0.31 0.00 0.00 61.69 61.33 2qut s THR 124 Cb 0.00 -1.08 -0.02 0.00 0.01 0.00 0.00 72.50 71.41 2qut s THR 124 CO 0.07 0.22 0.34 0.00 -0.69 0.00 0.00 174.62 174.56 2qut s GLN 125 N -0.71 2.60 0.00 4.92 -2.07 -0.73 -4.91 119.66 118.76 2qut s GLN 125 Ca 0.05 -1.45 0.00 0.00 -1.82 0.00 0.00 55.36 52.14 2qut s GLN 125 Cb -0.07 -2.41 0.00 0.00 -1.09 0.00 0.00 33.01 29.44 2qut s GLN 125 CO 0.00 -0.07 0.00 0.41 -1.32 0.00 0.00 175.29 174.31 2qut n GLY 126 N -1.47 -0.75 0.15 2.60 0.00 -1.26 -0.30 105.19 104.16 2qut n GLY 126 Ca 0.01 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.06 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 -9.42 0.99 3.38 -1.90 -3.41 115.31 104.94 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 0.03 0.00 0.09 0.00 0.00 40.66 40.78 2qut h LEU 127 CO 0.00 0.51 1.17 -1.81 0.09 0.00 0.00 178.44 178.40 2qut s ASP 128 N -6.48 6.44 -0.53 -0.43 1.01 -1.26 -1.56 116.67 113.86 2qut s ASP 128 Ca 0.02 2.70 0.00 0.00 0.71 0.00 0.00 52.55 55.98 2qut s ASP 128 Cb 0.09 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.47 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 4.39 0.61 0.36 0.21 0.00 -1.26 -4.88 105.19 104.61 2qut n GLY 129 Ca 0.19 -0.10 -0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 0.97 -0.34 0.99 5.85 -1.51 -1.97 115.31 119.30 2qut h LEU 130 Ca -0.10 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.61 2qut h LEU 130 Cb 0.81 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.57 2qut h LEU 130 CO 0.15 0.70 0.18 -1.28 -0.34 0.00 0.00 178.44 177.85 2qut h SER 131 N 1.15 0.28 -0.74 1.25 0.87 -1.90 0.97 113.55 115.42 2qut h SER 131 Ca 0.31 0.01 -0.06 0.00 -1.23 0.00 0.00 61.79 60.82 2qut h SER 131 Cb -0.13 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 61.76 2qut h SER 131 CO -0.07 0.20 0.22 -0.33 -0.53 0.00 0.00 176.83 176.33 2qut h GLU 132 N 0.37 1.16 -0.56 2.24 3.07 -1.90 -1.55 114.58 117.41 2qut h GLU 132 Ca 0.14 -0.25 -0.04 0.00 -0.50 0.00 0.00 59.36 58.70 2qut h GLU 132 Cb 0.03 -0.16 -0.02 0.00 -0.84 0.00 0.00 28.75 27.75 2qut h GLU 132 CO -0.08 0.99 0.18 0.00 -1.40 0.00 0.00 179.01 178.70 2qut h ARG 133 N 1.10 0.86 -0.55 2.33 3.08 -0.87 -1.77 114.38 118.57 2qut h ARG 133 Ca 0.24 -0.18 -0.04 0.00 0.07 0.00 0.00 59.98 60.06 2qut h ARG 133 Cb 0.32 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 2qut h ARG 133 CO -0.01 0.78 0.18 0.00 -1.07 0.00 0.00 179.97 179.85 2qut h ALA 135 N 1.04 0.95 -0.36 0.00 0.00 -1.10 0.95 119.26 120.74 2qut h ALA 135 Ca 0.18 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 2qut h ALA 135 Cb 0.27 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2qut h ALA 135 CO -0.01 0.41 -0.04 0.37 0.00 0.00 0.00 179.25 179.99 2qut h GLN 136 N 1.02 0.67 -0.69 0.00 5.75 -1.03 -1.94 115.11 118.90 2qut h GLN 136 Ca 0.27 -0.23 -0.04 0.00 -0.15 0.00 0.00 58.65 58.50 2qut h GLN 136 Cb -0.05 -0.05 -0.03 0.00 1.07 0.00 0.00 27.48 28.42 2qut h GLN 136 CO -0.05 0.80 0.28 1.88 -2.65 0.00 0.00 178.83 179.08 2qut h TYR 137 N 0.47 1.04 -0.01 3.99 0.05 -0.45 -0.80 116.97 121.26 2qut h TYR 137 Ca 0.10 -0.08 0.01 0.00 0.05 0.00 0.00 58.73 58.81 2qut h TYR 137 Cb 0.52 -0.31 -0.01 0.00 1.01 0.00 0.00 36.73 37.93 2qut h TYR 137 CO 0.04 0.81 -0.06 -0.22 -1.05 0.00 0.00 178.16 177.68 2qut h LYS 138 N 0.98 -0.09 -0.15 4.88 1.63 -0.72 -1.22 116.57 121.88 2qut h LYS 138 Ca 0.23 0.01 0.04 0.00 -0.85 0.00 0.00 60.65 60.07 2qut h LYS 138 Cb 0.20 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.85 2qut h LYS 138 CO -0.02 -0.06 0.11 -0.22 -3.45 0.00 0.00 179.45 175.81 2qut h LYS 139 N -0.09 0.03 -0.67 1.90 3.64 -1.08 -1.99 116.57 118.31 2qut h LYS 139 Ca 0.03 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2qut h LYS 139 Cb 0.13 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 2qut h LYS 139 CO -0.07 0.02 0.00 -0.25 -2.27 0.00 0.00 179.45 176.88 2qut n ASP 140 N -4.50 4.74 0.00 4.20 8.00 -0.33 -4.94 116.55 123.72 2qut n ASP 140 Ca 0.00 -2.72 0.00 0.00 0.71 0.00 0.00 54.79 52.78 2qut n ASP 140 Cb 0.22 -0.64 0.00 0.00 -0.02 0.00 0.00 41.12 40.67 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 0.52 2.14 3.76 0.44 0.00 -0.75 -4.96 105.19 106.34 2qut n GLY 141 Ca 0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.16 3.39 -0.10 4.61 0.00 -0.64 -4.49 121.76 122.37 2qut s ALA 142 Ca 0.00 0.84 0.03 0.00 0.00 0.00 0.00 51.96 52.82 2qut s ALA 142 Cb 0.00 -3.30 -0.03 0.00 0.00 0.00 0.00 23.12 19.78 2qut s ALA 142 CO 0.00 -0.08 0.10 -0.25 0.00 0.00 0.00 175.76 175.53 2qut n ASP 143 N 1.31 1.13 -4.02 0.00 8.00 0.47 -4.01 116.55 119.43 2qut n ASP 143 Ca -0.01 -0.43 -0.08 0.00 0.71 0.00 0.00 54.79 54.98 2qut n ASP 143 Cb 0.45 1.03 -0.09 0.00 -0.02 0.00 0.00 41.12 42.49 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 -1.47 0.45 0.31 1.24 -0.71 -1.15 -0.81 117.98 115.84 2qut s PHE 144 Ca 0.01 -0.92 0.03 0.00 -1.04 0.00 0.00 56.93 55.01 2qut s PHE 144 Cb 0.02 -0.27 -0.05 0.00 -1.21 0.00 0.00 43.02 41.51 2qut s PHE 144 CO 0.11 -0.48 0.09 0.00 -1.34 0.00 0.00 175.22 173.60 2qut s ALA 145 N -3.92 2.17 0.01 1.99 0.00 0.18 -0.91 121.76 121.27 2qut s ALA 145 Ca 0.10 -1.83 0.01 0.00 0.00 0.00 0.00 51.96 50.23 2qut s ALA 145 Cb 0.07 0.88 -0.01 0.00 0.00 0.00 0.00 23.12 24.05 2qut s ALA 145 CO -0.08 -0.39 -0.03 0.21 0.00 0.00 0.00 175.76 175.47 2qut s LYS 146 N -3.91 0.23 -0.07 0.00 2.20 -0.88 -0.89 119.74 116.41 2qut s LYS 146 Ca 0.35 -0.30 -0.03 0.00 -0.36 0.00 0.00 55.97 55.63 2qut s LYS 146 Cb 0.07 -0.08 0.04 0.00 -1.51 0.00 0.00 37.83 36.36 2qut s LYS 146 CO 0.15 0.01 0.15 -0.46 -0.36 0.00 0.00 175.35 174.84 2qut s TRP 147 N -0.60 -0.16 -0.20 4.03 -0.11 -1.21 -1.05 118.94 119.64 2qut s TRP 147 Ca -0.05 0.54 -0.06 0.00 1.22 0.00 0.00 56.10 57.75 2qut s TRP 147 Cb -0.04 -0.19 -0.03 0.00 -1.50 0.00 0.00 33.47 31.70 2qut s TRP 147 CO -0.00 -0.22 0.02 0.50 -4.62 0.00 0.00 176.95 172.63 2qut s ARG 148 N 1.81 3.73 0.01 5.86 3.52 -1.26 -2.66 118.95 129.97 2qut s ARG 148 Ca -0.02 -0.46 0.05 0.00 -0.13 0.00 0.00 55.73 55.16 2qut s ARG 148 Cb -0.12 -3.13 -0.03 0.00 -1.56 0.00 0.00 34.95 30.11 2qut s ARG 148 CO -0.06 0.09 -0.12 0.00 -0.81 0.00 0.00 175.30 174.40 2qut s VAL 150 N -0.93 1.81 0.18 0.00 1.01 -1.26 -1.36 120.40 119.85 2qut s VAL 150 Ca 0.15 -0.84 0.10 0.00 0.00 0.00 0.00 61.98 61.39 2qut s VAL 150 Cb -0.11 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.62 2qut s VAL 150 CO 0.06 0.50 -0.22 -0.76 0.00 0.00 0.00 175.10 174.68 2qut s LEU 151 N 0.74 2.43 0.00 3.92 1.43 0.16 -4.46 118.68 122.90 2qut s LEU 151 Ca -0.10 -0.85 0.04 0.00 -1.03 0.00 0.00 54.13 52.18 2qut s LEU 151 Cb -0.16 -1.04 -0.01 0.00 0.03 0.00 0.00 46.19 45.00 2qut s LEU 151 CO 0.01 0.07 -0.13 -0.75 0.23 0.00 0.00 176.35 175.78 2qut s LYS 152 N -2.65 1.00 -0.27 1.70 2.20 -1.26 -0.64 119.74 119.81 2qut s LYS 152 Ca 0.18 -0.52 -0.20 0.00 -0.36 0.00 0.00 55.97 55.07 2qut s LYS 152 Cb -0.07 -0.97 -0.02 0.00 -1.51 0.00 0.00 37.83 35.26 2qut s LYS 152 CO 0.08 0.26 0.60 0.42 -0.36 0.00 0.00 175.35 176.35 2qut s ILE 153 N -0.43 4.99 0.00 5.43 1.01 -1.26 -1.98 121.20 128.96 2qut s ILE 153 Ca 0.04 0.96 0.00 0.00 0.00 0.00 0.00 60.65 61.65 2qut s ILE 153 Cb -0.06 -3.93 0.00 0.00 0.01 0.00 0.00 42.46 38.48 2qut s ILE 153 CO -0.00 -0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.53 2qut n GLY 154 N 4.32 3.57 0.28 6.18 0.00 -0.37 -4.77 105.19 114.39 2qut n GLY 154 Ca -0.02 -1.42 -0.03 0.00 0.00 0.00 0.00 46.02 44.56 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 0.69 0.00 1.61 4.57 -2.01 -3.21 114.58 116.24 2qut h GLU 155 Ca 0.00 -0.17 0.00 0.00 -1.18 0.00 0.00 59.36 58.01 2qut h GLU 155 Cb 0.00 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.50 2qut h GLU 155 CO 0.00 0.70 -0.02 0.72 -1.18 0.00 0.00 179.01 179.23 2qut n HIS 156 N -4.24 0.00 -4.18 0.92 8.25 -1.26 -5.06 115.22 109.65 2qut n HIS 156 Ca 0.02 -0.66 -0.14 0.00 -0.26 0.00 0.00 57.72 56.68 2qut n HIS 156 Cb 0.28 -0.09 -0.11 0.00 1.12 0.00 0.00 29.99 31.19 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 -1.69 0.96 0.23 1.59 -4.23 -1.21 -3.75 115.64 107.54 2qut s THR 157 Ca 0.14 -1.66 -0.30 0.00 -1.18 0.00 0.00 61.69 58.69 2qut s THR 157 Cb 0.12 -1.39 -0.09 0.00 1.34 0.00 0.00 72.50 72.48 2qut s THR 157 CO 0.01 -0.57 1.15 -2.16 -0.54 0.00 0.00 174.62 172.51 2qut s PRO 158 N -2.84 4.56 0.75 3.99 0.04 -0.84 -1.24 135.00 139.43 2qut s PRO 158 Ca 0.06 1.84 -0.12 0.00 0.04 0.00 0.00 61.00 62.82 2qut s PRO 158 Cb -0.03 -3.21 0.04 0.00 0.04 0.00 0.00 34.50 31.35 2qut s PRO 158 CO 0.00 0.06 1.13 -1.54 0.04 0.00 0.00 177.00 176.69 2qut s SER 159 N -0.38 4.99 0.23 6.66 1.04 -1.25 -4.84 113.70 120.15 2qut s SER 159 Ca 0.48 1.01 -0.07 0.00 0.48 0.00 0.00 55.95 57.85 2qut s SER 159 Cb -0.32 -1.68 0.30 0.00 0.10 0.00 0.00 66.02 64.41 2qut s SER 159 CO 0.39 -1.62 1.82 0.00 0.98 0.00 0.00 173.24 174.82 2qut h ALA 160 N -0.85 1.04 0.19 5.32 0.00 -1.99 -0.92 119.26 122.05 2qut h ALA 160 Ca -0.46 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.45 2qut h ALA 160 Cb 1.28 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2qut h ALA 160 CO 0.64 0.14 -0.09 1.25 0.00 0.00 0.00 179.25 181.19 2qut h LEU 161 N 0.81 -0.21 -0.69 0.00 5.85 -1.99 -0.63 115.31 118.45 2qut h LEU 161 Ca 0.34 -0.00 0.03 0.00 0.84 0.00 0.00 57.88 59.08 2qut h LEU 161 Cb 0.20 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.25 2qut h LEU 161 CO -0.19 -0.14 0.43 0.00 -0.34 0.00 0.00 178.44 178.21 2qut h ALA 162 N 0.55 0.89 -0.05 1.25 0.00 -1.82 0.17 119.26 120.24 2qut h ALA 162 Ca -0.03 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2qut h ALA 162 Cb 0.20 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2qut h ALA 162 CO 0.04 0.21 0.02 0.82 0.00 0.00 0.00 179.25 180.34 2qut h ILE 163 N 0.85 1.17 -0.13 0.00 2.04 -1.07 -1.61 117.51 118.76 2qut h ILE 163 Ca 0.27 -0.52 -0.00 0.00 1.00 0.00 0.00 64.86 65.61 2qut h ILE 163 Cb 0.00 1.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 2qut h ILE 163 CO -0.10 0.14 0.06 -0.03 0.00 0.00 0.00 178.15 178.23 2qut h MET 164 N -0.11 0.19 -0.37 2.37 4.05 -0.79 -1.98 114.93 118.29 2qut h MET 164 Ca 0.02 -0.03 -0.03 0.00 -0.28 0.00 0.00 59.70 59.38 2qut h MET 164 Cb 0.22 -0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 30.97 2qut h MET 164 CO -0.00 0.25 0.12 1.49 0.23 0.00 0.00 176.91 179.00 2qut h GLU 165 N 0.09 0.58 -0.32 0.39 4.57 -0.69 -1.16 114.58 118.04 2qut h GLU 165 Ca 0.05 -0.12 -0.09 0.00 -1.18 0.00 0.00 59.36 58.02 2qut h GLU 165 Cb 0.12 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.61 2qut h GLU 165 CO -0.01 0.58 -0.17 -0.91 -1.18 0.00 0.00 179.01 177.33 2qut h ASN 166 N 0.46 0.57 -0.49 1.04 2.35 -1.30 -1.01 115.58 117.20 2qut h ASN 166 Ca 0.12 -0.17 -0.10 0.00 -0.55 0.00 0.00 56.30 55.60 2qut h ASN 166 Cb 0.24 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.44 2qut h ASN 166 CO -0.01 0.75 -0.10 0.00 -1.65 0.00 0.00 177.43 176.43 2qut h ALA 167 N 1.30 0.67 -0.27 -0.83 0.00 -1.21 -2.12 119.26 116.81 2qut h ALA 167 Ca 0.09 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 2qut h ALA 167 Cb 0.59 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2qut h ALA 167 CO 0.04 0.56 0.03 -0.97 0.00 0.00 0.00 179.25 178.91 2qut h ASN 168 N 0.78 0.44 0.19 0.00 -1.24 -0.83 -2.07 115.58 112.86 2qut h ASN 168 Ca 0.13 -0.28 -0.09 0.00 0.71 0.00 0.00 56.30 56.77 2qut h ASN 168 Cb 0.65 -0.12 -0.01 0.00 0.73 0.00 0.00 38.32 39.57 2qut h ASN 168 CO 0.04 0.61 -0.33 1.62 -1.29 0.00 0.00 177.43 178.09 2qut h VAL 169 N 0.26 1.27 -0.72 2.57 3.04 -1.18 -1.47 116.25 120.01 2qut h VAL 169 Ca 0.08 -1.29 -0.04 0.00 -1.01 0.00 0.00 66.70 64.44 2qut h VAL 169 Cb 0.37 1.55 -0.03 0.00 -2.01 0.00 0.00 31.29 31.17 2qut h VAL 169 CO 0.01 0.39 0.30 -0.07 -1.01 0.00 0.00 177.57 177.19 2qut h LEU 170 N 0.19 0.97 -0.57 3.16 3.38 -1.22 -0.85 115.31 120.36 2qut h LEU 170 Ca 0.02 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 2qut h LEU 170 Cb 0.68 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 2qut h LEU 170 CO 0.05 0.87 0.14 0.00 0.09 0.00 0.00 178.44 179.58 2qut h ALA 171 N 1.15 0.75 -0.29 1.53 0.00 -0.78 -0.11 119.26 121.51 2qut h ALA 171 Ca 0.24 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2qut h ALA 171 Cb 0.18 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2qut h ALA 171 CO -0.02 0.46 0.16 0.00 0.00 0.00 0.00 179.25 179.84 2qut h ARG 172 N 0.82 0.40 -0.34 0.00 2.47 -0.98 -0.25 114.38 116.50 2qut h ARG 172 Ca 0.18 -0.04 0.03 0.00 -1.26 0.00 0.00 59.98 58.89 2qut h ARG 172 Cb 0.35 -0.08 -0.03 0.00 -1.65 0.00 0.00 29.97 28.56 2qut h ARG 172 CO 0.00 0.34 0.14 -0.92 0.56 0.00 0.00 179.97 180.09 2qut h TYR 173 N 0.35 0.25 -0.61 3.04 3.20 -0.94 -1.51 116.97 120.75 2qut h TYR 173 Ca 0.10 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.99 2qut h TYR 173 Cb 0.05 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.23 2qut h TYR 173 CO -0.03 0.12 0.40 0.00 -1.64 0.00 0.00 178.16 177.01 2qut h ALA 174 N 1.20 0.77 -0.01 1.82 0.00 -0.71 -1.00 119.26 121.33 2qut h ALA 174 Ca 0.15 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2qut h ALA 174 Cb 0.10 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2qut h ALA 174 CO -0.13 0.21 -0.01 1.03 0.00 0.00 0.00 179.25 180.35 2qut h SER 175 N 0.82 -0.03 -0.56 0.00 0.87 -0.67 -1.36 113.55 112.63 2qut h SER 175 Ca 0.22 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.79 2qut h SER 175 Cb -0.09 0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 61.86 2qut h SER 175 CO -0.05 -0.01 0.35 0.40 -0.53 0.00 0.00 176.83 176.99 2qut h ILE 176 N -0.01 1.16 -0.12 2.23 2.04 -1.06 -2.24 117.51 119.51 2qut h ILE 176 Ca 0.01 -0.33 0.02 0.00 1.00 0.00 0.00 64.86 65.57 2qut h ILE 176 Cb 0.02 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.44 2qut h ILE 176 CO -0.02 0.16 -0.02 0.00 0.00 0.00 0.00 178.15 178.27 2qut h GLN 178 N 0.01 0.00 0.00 0.00 4.20 -1.04 -0.45 115.11 117.84 2qut h GLN 178 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 2qut h GLN 178 Cb 0.08 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.86 2qut h GLN 178 CO -0.12 0.10 0.00 1.96 -0.67 0.00 0.00 178.83 180.10 2qut h GLN 179 N 0.00 0.00 -0.27 1.46 1.08 -0.99 -3.10 115.11 113.29 2qut h GLN 179 Ca -0.00 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.16 2qut h GLN 179 Cb 0.23 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.64 2qut h GLN 179 CO 0.01 0.00 -0.00 0.09 -0.95 0.00 0.00 178.83 177.98 2qut n ASN 180 N -3.06 3.55 -0.90 1.46 4.13 -0.27 -4.96 115.26 115.22 2qut n ASN 180 Ca 0.01 -3.17 -0.11 0.00 1.68 0.00 0.00 54.58 52.99 2qut n ASN 180 Cb 0.33 -0.56 -0.05 0.00 -1.54 0.00 0.00 39.78 37.96 2qut n ASN 180 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2qut n GLY 181 N -0.68 1.18 3.49 7.41 0.00 -1.14 -4.77 105.19 110.68 2qut n GLY 181 Ca 0.24 -0.50 -0.34 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.43 3.96 -0.22 -0.61 -1.09 -0.64 -4.85 121.20 115.33 2qut s ILE 182 Ca 0.00 -0.32 -0.29 0.00 -2.23 0.00 0.00 60.65 57.81 2qut s ILE 182 Cb 0.00 -2.76 0.00 0.00 -1.58 0.00 0.00 42.46 38.12 2qut s ILE 182 CO 0.00 0.47 1.13 -0.69 -1.23 0.00 0.00 174.94 174.62 2qut s VAL 183 N 0.58 4.51 -0.09 2.92 1.01 0.01 -3.18 120.40 126.16 2qut s VAL 183 Ca -0.02 1.81 -0.22 0.00 0.00 0.00 0.00 61.98 63.55 2qut s VAL 183 Cb -0.14 -4.21 -0.04 0.00 0.00 0.00 0.00 36.38 31.99 2qut s VAL 183 CO 0.02 -0.20 0.66 -2.16 0.00 0.00 0.00 175.10 173.42 2qut s PRO 184 N 3.38 4.39 -0.31 2.72 0.04 -1.25 -0.65 135.00 143.32 2qut s PRO 184 Ca 0.48 0.79 -0.18 0.00 0.04 0.00 0.00 61.00 62.13 2qut s PRO 184 Cb -0.17 -3.46 -0.01 0.00 0.04 0.00 0.00 34.50 30.89 2qut s PRO 184 CO 0.10 0.03 0.53 0.42 0.04 0.00 0.00 177.00 178.12 2qut s ILE 185 N 0.93 5.02 -0.44 0.56 1.01 -0.07 -2.51 121.20 125.70 2qut s ILE 185 Ca 0.35 0.60 -0.22 0.00 0.00 0.00 0.00 60.65 61.38 2qut s ILE 185 Cb -0.17 -3.92 0.02 0.00 0.01 0.00 0.00 42.46 38.41 2qut s ILE 185 CO 0.16 -0.09 0.75 -0.69 0.00 0.00 0.00 174.94 175.06 2qut s VAL 186 N 2.40 4.70 -0.48 2.92 1.01 0.10 -3.28 120.40 127.77 2qut s VAL 186 Ca 0.20 0.40 -0.02 0.00 0.00 0.00 0.00 61.98 62.56 2qut s VAL 186 Cb -0.15 -4.28 0.13 0.00 0.00 0.00 0.00 36.38 32.08 2qut s VAL 186 CO 0.12 -0.65 0.28 -0.70 0.00 0.00 0.00 175.10 174.14 2qut s GLU 187 N 3.15 2.17 -0.96 2.72 2.12 -1.09 -0.49 118.70 126.32 2qut s GLU 187 Ca 0.28 -2.09 -0.09 0.00 0.36 0.00 0.00 54.97 53.43 2qut s GLU 187 Cb -0.13 -3.61 0.24 0.00 0.26 0.00 0.00 34.13 30.90 2qut s GLU 187 CO 0.21 -1.10 0.91 -1.25 -0.54 0.00 0.00 175.26 173.48 2qut s PRO 188 N 0.68 3.77 -0.21 4.30 0.04 -1.22 -1.19 135.00 141.16 2qut s PRO 188 Ca 0.12 -2.93 -0.28 0.00 0.04 0.00 0.00 61.00 57.95 2qut s PRO 188 Cb -0.22 -4.38 0.00 0.00 0.04 0.00 0.00 34.50 29.94 2qut s PRO 188 CO -0.04 -1.26 0.96 -2.00 0.04 0.00 0.00 177.00 174.71 2qut s GLU 189 N -0.72 4.26 -0.36 4.56 2.12 -0.47 -4.47 118.70 123.63 2qut s GLU 189 Ca 0.25 1.22 -0.16 0.00 0.36 0.00 0.00 54.97 56.65 2qut s GLU 189 Cb -0.10 -3.62 -0.00 0.00 0.26 0.00 0.00 34.13 30.66 2qut s GLU 189 CO -0.09 -0.54 0.38 0.42 -0.54 0.00 0.00 175.26 174.90 2qut s ILE 190 N 2.87 5.15 0.69 -3.70 1.01 -1.26 -0.66 121.20 125.30 2qut s ILE 190 Ca 0.42 -0.06 -0.17 0.00 0.00 0.00 0.00 60.65 60.84 2qut s ILE 190 Cb -0.16 -3.88 0.00 0.00 0.01 0.00 0.00 42.46 38.44 2qut s ILE 190 CO 0.08 -0.17 1.12 0.18 0.00 0.00 0.00 174.94 176.15 2qut n LEU 191 N 5.43 4.60 -0.32 2.97 4.77 0.18 -4.82 117.00 129.80 2qut n LEU 191 Ca -0.09 0.73 0.14 0.00 -0.03 0.00 0.00 56.01 56.77 2qut n LEU 191 Cb 0.49 -1.47 0.58 0.00 -2.33 0.00 0.00 43.42 40.69 2qut n LEU 191 CO 0.42 -1.59 0.88 -0.81 -1.33 0.00 0.00 177.39 174.95 2qut n PRO 192 N -1.95 1.32 -1.76 3.23 -0.04 -1.26 -4.53 135.00 130.01 2qut n PRO 192 Ca 0.14 -0.65 -0.41 0.00 -0.04 0.00 0.00 63.50 62.54 2qut n PRO 192 Cb 0.49 -1.49 -0.01 0.00 -0.04 0.00 0.00 33.50 32.45 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 -0.27 3.75 0.00 3.54 10.43 -1.26 -0.27 116.55 132.46 2qut n ASP 193 Ca 0.18 1.20 0.00 0.00 2.57 0.00 0.00 54.79 58.74 2qut n ASP 193 Cb 0.30 -1.60 0.00 0.00 1.84 0.00 0.00 41.12 41.66 2qut n ASP 193 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2qut n GLY 194 N 1.13 1.99 1.37 0.44 0.00 -1.26 -4.57 105.19 104.29 2qut n GLY 194 Ca 0.04 -2.16 0.08 0.00 0.00 0.00 0.00 46.02 43.98 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 4.66 -4.74 1.61 5.68 -1.26 -0.91 116.55 121.59 2qut n ASP 195 Ca 0.00 -2.79 -0.32 0.00 -0.50 0.00 0.00 54.79 51.18 2qut n ASP 195 Cb 0.00 -0.58 0.09 0.00 -1.14 0.00 0.00 41.12 39.49 2qut n ASP 195 CO 0.00 0.00 0.00 -1.38 -1.33 0.00 0.00 177.20 174.49 2qut s HIS 196 N -2.45 2.30 0.39 2.11 -3.43 -1.26 -4.28 115.29 108.66 2qut s HIS 196 Ca 0.47 1.61 0.01 0.00 -0.80 0.00 0.00 55.06 56.35 2qut s HIS 196 Cb 0.35 -3.24 0.08 0.00 -1.43 0.00 0.00 32.58 28.33 2qut s HIS 196 CO 0.15 -2.14 0.54 -0.40 -2.00 0.00 0.00 174.74 170.90 2qut n ASP 197 N -3.09 0.84 -0.26 7.38 5.68 -1.26 -0.23 116.55 125.62 2qut n ASP 197 Ca 0.11 -1.68 -0.06 0.00 -0.50 0.00 0.00 54.79 52.66 2qut n ASP 197 Cb 0.52 -0.34 0.05 0.00 -1.14 0.00 0.00 41.12 40.21 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 0.90 -0.75 -2.12 5.85 -1.92 -2.56 115.31 114.71 2qut h LEU 198 Ca -0.18 -0.11 0.01 0.00 0.84 0.00 0.00 57.88 58.44 2qut h LEU 198 Cb 0.69 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.45 2qut h LEU 198 CO 0.20 0.75 0.50 0.11 -0.34 0.00 0.00 178.44 179.66 2qut h LYS 199 N 0.98 0.97 -0.22 1.25 1.57 -1.95 -0.49 116.57 118.68 2qut h LYS 199 Ca 0.25 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2qut h LYS 199 Cb 0.07 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.15 2qut h LYS 199 CO -0.04 0.64 0.14 -0.09 -0.57 0.00 0.00 179.45 179.54 2qut h ARG 200 N 1.00 0.29 -0.51 3.15 9.65 -1.88 -0.46 114.38 125.63 2qut h ARG 200 Ca 0.28 -0.02 -0.02 0.00 -1.10 0.00 0.00 59.98 59.12 2qut h ARG 200 Cb -0.09 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 28.40 2qut h ARG 200 CO -0.07 0.20 0.22 0.00 2.80 0.00 0.00 179.97 183.13 2qut h GLN 202 N 0.68 0.99 -0.04 0.00 4.15 -0.79 0.17 115.11 120.27 2qut h GLN 202 Ca 0.17 -0.06 -0.00 0.00 0.77 0.00 0.00 58.65 59.53 2qut h GLN 202 Cb 0.16 -0.22 -0.00 0.00 0.21 0.00 0.00 27.48 27.62 2qut h GLN 202 CO -0.02 0.65 0.02 -0.92 -1.93 0.00 0.00 178.83 176.63 2qut h TYR 203 N 1.01 0.06 -0.62 3.99 3.20 -0.79 -0.75 116.97 123.07 2qut h TYR 203 Ca 0.29 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.11 2qut h TYR 203 Cb -0.09 -0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.14 2qut h TYR 203 CO -0.02 0.18 0.20 0.28 -1.64 0.00 0.00 178.16 177.16 2qut h VAL 204 N -0.08 1.24 -0.56 1.81 2.07 -0.96 -1.91 116.25 117.86 2qut h VAL 204 Ca 0.01 -0.81 -0.00 0.00 0.82 0.00 0.00 66.70 66.72 2qut h VAL 204 Cb 0.14 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.49 2qut h VAL 204 CO -0.00 0.31 0.35 0.74 0.02 0.00 0.00 177.57 178.99 2qut h THR 205 N 0.88 1.16 -0.81 2.57 2.02 -0.52 -0.13 112.91 118.08 2qut h THR 205 Ca 0.20 -0.35 -0.00 0.00 0.77 0.00 0.00 66.41 67.03 2qut h THR 205 Cb 0.27 0.38 -0.04 0.00 -1.74 0.00 0.00 68.15 67.03 2qut h THR 205 CO -0.01 0.17 0.50 -0.33 0.37 0.00 0.00 175.52 176.21 2qut h GLU 206 N 0.76 1.09 -0.34 6.66 5.08 -0.89 -0.44 114.58 126.50 2qut h GLU 206 Ca 0.20 -0.09 -0.15 0.00 -1.00 0.00 0.00 59.36 58.32 2qut h GLU 206 Cb -0.03 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 28.98 2qut h GLU 206 CO -0.04 0.76 -0.36 0.87 -1.00 0.00 0.00 179.01 179.24 2qut h LYS 207 N 1.11 0.84 -0.04 2.33 1.79 -0.88 -1.89 116.57 119.82 2qut h LYS 207 Ca 0.29 -0.45 -0.00 0.00 -2.18 0.00 0.00 60.65 58.31 2qut h LYS 207 Cb -0.06 0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 30.61 2qut h LYS 207 CO -0.06 1.09 0.01 0.28 -1.08 0.00 0.00 179.45 179.69 2qut h VAL 208 N 0.62 1.21 -0.56 0.50 2.07 -0.84 -1.90 116.25 117.35 2qut h VAL 208 Ca 0.05 -0.62 -0.03 0.00 0.82 0.00 0.00 66.70 66.93 2qut h VAL 208 Cb 0.95 1.55 -0.03 0.00 -1.52 0.00 0.00 31.29 32.23 2qut h VAL 208 CO 0.09 0.17 0.25 -0.07 0.02 0.00 0.00 177.57 178.02 2qut h LEU 209 N -0.18 0.72 -0.75 2.57 3.38 -1.11 0.19 115.31 120.14 2qut h LEU 209 Ca 0.01 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 2qut h LEU 209 Cb 0.26 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 2qut h LEU 209 CO 0.00 0.64 0.27 0.00 0.09 0.00 0.00 178.44 179.43 2qut h ALA 210 N 1.47 0.98 -0.37 1.53 0.00 -1.23 -1.00 119.26 120.64 2qut h ALA 210 Ca 0.19 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 2qut h ALA 210 Cb 0.12 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2qut h ALA 210 CO -0.02 0.63 -0.06 0.00 0.00 0.00 0.00 179.25 179.80 2qut h ALA 211 N 1.14 0.50 -0.28 0.00 0.00 -0.46 -2.33 119.26 117.83 2qut h ALA 211 Ca 0.25 -0.29 0.04 0.00 0.00 0.00 0.00 54.91 54.91 2qut h ALA 211 Cb 0.26 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 2qut h ALA 211 CO -0.01 0.33 0.05 0.28 0.00 0.00 0.00 179.25 179.90 2qut h VAL 212 N 0.49 0.86 0.00 0.00 2.07 -0.28 -1.67 116.25 117.71 2qut h VAL 212 Ca 0.10 -0.05 -0.10 0.00 0.82 0.00 0.00 66.70 67.46 2qut h VAL 212 Cb 0.56 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 2qut h VAL 212 CO 0.03 0.03 -0.48 1.88 0.02 0.00 0.00 177.57 179.05 2qut h TYR 213 N 0.15 0.00 -0.49 1.57 0.05 -1.15 -0.93 116.97 116.17 2qut h TYR 213 Ca 0.13 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.79 2qut h TYR 213 Cb 0.14 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.87 2qut h TYR 213 CO -0.17 0.48 -0.18 -0.22 -1.05 0.00 0.00 178.16 177.02 2qut h LYS 214 N 0.00 0.99 -0.54 4.88 1.63 -1.10 -1.23 116.57 121.20 2qut h LYS 214 Ca -0.00 -0.41 -0.08 0.00 -0.85 0.00 0.00 60.65 59.31 2qut h LYS 214 Cb 0.94 -0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 32.51 2qut h LYS 214 CO 0.06 1.09 0.04 0.00 -3.45 0.00 0.00 179.45 177.19 2qut h ALA 215 N 0.88 0.72 -0.72 5.00 0.00 -1.06 0.30 119.26 124.38 2qut h ALA 215 Ca 0.12 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2qut h ALA 215 Cb 0.76 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 2qut h ALA 215 CO 0.06 0.51 0.37 -0.07 0.00 0.00 0.00 179.25 180.12 2qut h LEU 216 N 0.80 0.90 -0.28 0.00 3.38 -0.98 -1.40 115.31 117.73 2qut h LEU 216 Ca 0.16 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 57.97 2qut h LEU 216 Cb 0.48 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 2qut h LEU 216 CO 0.02 0.74 -0.12 -1.28 0.09 0.00 0.00 178.44 177.90 2qut h SER 217 N 1.01 0.59 -0.07 -0.43 0.87 -0.83 0.95 113.55 115.63 2qut h SER 217 Ca 0.25 -0.40 -0.01 0.00 -1.23 0.00 0.00 61.79 60.40 2qut h SER 217 Cb 0.06 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 61.85 2qut h SER 217 CO -0.04 0.85 0.02 0.44 -0.53 0.00 0.00 176.83 177.58 2qut h ASP 218 N 0.32 0.15 -0.53 6.23 3.32 -0.53 -1.66 116.42 123.72 2qut h ASP 218 Ca 0.07 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.10 2qut h ASP 218 Cb 0.62 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.13 2qut h ASP 218 CO 0.04 0.17 0.00 1.41 -1.72 0.00 0.00 179.24 179.14 2qut n HIS 219 N -4.45 0.70 -3.47 4.55 8.25 -0.57 -4.95 115.22 115.29 2qut n HIS 219 Ca -0.01 -0.35 -0.19 0.00 -0.26 0.00 0.00 57.72 56.90 2qut n HIS 219 Cb 0.13 0.00 0.08 0.00 1.12 0.00 0.00 29.99 31.32 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 1.05 -2.43 -2.88 4.41 8.25 -0.62 -4.89 115.22 118.11 2qut n HIS 220 Ca 0.18 0.95 -0.41 0.00 -0.26 0.00 0.00 57.72 58.18 2qut n HIS 220 Cb 0.45 -4.96 -0.04 0.00 1.12 0.00 0.00 29.99 26.55 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 4.73 -0.83 1.59 -1.09 0.29 -4.92 121.20 117.64 2qut s ILE 221 Ca 0.25 1.80 -0.24 0.00 -2.23 0.00 0.00 60.65 60.23 2qut s ILE 221 Cb -0.11 -4.20 0.05 0.00 -1.58 0.00 0.00 42.46 36.63 2qut s ILE 221 CO 0.71 0.31 1.27 -0.47 -1.23 0.00 0.00 174.94 175.52 2qut s TYR 222 N 0.23 2.50 0.32 3.97 5.04 -1.26 -4.81 117.35 123.34 2qut s TYR 222 Ca 0.43 -0.49 0.06 0.00 -2.44 0.00 0.00 57.07 54.62 2qut s TYR 222 Cb -0.21 -4.56 0.71 0.00 0.35 0.00 0.00 41.96 38.24 2qut s TYR 222 CO 0.25 -1.91 1.84 -0.07 -1.34 0.00 0.00 175.55 174.32 2qut h LEU 223 N 12.45 0.78 -2.26 6.97 3.38 -1.94 -0.30 115.31 134.39 2qut h LEU 223 Ca -0.10 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 2qut h LEU 223 Cb 1.04 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 2qut h LEU 223 CO 1.29 0.39 -0.02 -0.33 0.09 0.00 0.00 178.44 179.86 2qut h GLU 224 N 0.82 0.00 -0.93 1.13 3.07 -1.90 -1.03 114.58 115.74 2qut h GLU 224 Ca 0.48 0.00 -0.34 0.00 -0.50 0.00 0.00 59.36 59.00 2qut h GLU 224 Cb 0.66 0.00 -0.20 0.00 -0.84 0.00 0.00 28.75 28.37 2qut h GLU 224 CO -0.25 0.02 0.43 0.41 -1.40 0.00 0.00 179.01 178.22 2qut n GLY 225 N -1.29 3.79 3.26 -3.84 0.00 -0.12 -4.36 105.19 102.63 2qut n GLY 225 Ca -0.03 -0.87 -0.14 0.00 0.00 0.00 0.00 46.02 44.97 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 -2.67 0.49 0.07 2.61 -4.23 -0.39 -3.90 115.64 107.61 2qut s THR 226 Ca 0.47 -1.99 0.02 0.00 -1.18 0.00 0.00 61.69 59.01 2qut s THR 226 Cb 0.39 -2.40 -0.03 0.00 1.34 0.00 0.00 72.50 71.80 2qut s THR 226 CO 0.10 -0.20 -0.07 -0.76 -0.54 0.00 0.00 174.62 173.15 2qut s LEU 227 N -3.22 2.37 -0.10 4.79 1.43 -1.05 -3.66 118.68 119.24 2qut s LEU 227 Ca 0.32 -0.76 0.02 0.00 -1.03 0.00 0.00 54.13 52.69 2qut s LEU 227 Cb 0.07 -0.11 -0.01 0.00 0.03 0.00 0.00 46.19 46.16 2qut s LEU 227 CO 0.09 -0.33 -0.17 -0.22 0.23 0.00 0.00 176.35 175.96 2qut s LEU 228 N -2.24 2.52 -0.52 1.79 2.96 -0.46 -0.72 118.68 122.01 2qut s LEU 228 Ca -0.00 -0.37 0.04 0.00 -0.22 0.00 0.00 54.13 53.57 2qut s LEU 228 Cb -0.03 -1.53 0.13 0.00 0.50 0.00 0.00 46.19 45.26 2qut s LEU 228 CO -0.02 0.21 0.27 -0.75 -1.32 0.00 0.00 176.35 174.74 2qut s LYS 229 N 0.10 1.91 0.47 1.98 2.20 0.35 -0.12 119.74 126.63 2qut s LYS 229 Ca -0.08 -2.59 0.08 0.00 -0.36 0.00 0.00 55.97 53.02 2qut s LYS 229 Cb -0.15 -3.18 0.02 0.00 -1.51 0.00 0.00 37.83 33.01 2qut s LYS 229 CO 0.05 -1.13 0.48 -1.25 -0.36 0.00 0.00 175.35 173.14 2qut s PRO 230 N -0.29 2.47 0.52 4.03 0.04 -1.26 -3.45 135.00 137.06 2qut s PRO 230 Ca 0.18 -1.62 -0.16 0.00 0.04 0.00 0.00 61.00 59.44 2qut s PRO 230 Cb -0.24 -2.42 -0.08 0.00 0.04 0.00 0.00 34.50 31.80 2qut s PRO 230 CO -0.01 -0.41 0.98 0.54 0.04 0.00 0.00 177.00 178.13 2qut s ASN 231 N -4.29 6.59 0.74 6.66 4.22 -1.26 -2.45 114.94 125.14 2qut s ASN 231 Ca 0.49 1.54 -0.11 0.00 -2.14 0.00 0.00 52.86 52.63 2qut s ASN 231 Cb -0.04 -2.50 0.03 0.00 1.28 0.00 0.00 41.25 40.02 2qut s ASN 231 CO 0.29 -0.60 1.10 -0.04 -2.04 0.00 0.00 177.10 175.82 2qut s MET 232 N -4.14 2.60 -0.35 3.55 -1.94 -1.26 -4.95 119.30 112.82 2qut s MET 232 Ca 0.58 0.49 -0.21 0.00 -1.71 0.00 0.00 55.69 54.85 2qut s MET 232 Cb -0.10 -1.99 0.00 0.00 2.01 0.00 0.00 34.83 34.75 2qut s MET 232 CO 0.33 -1.22 0.67 0.08 -0.01 0.00 0.00 175.02 174.86 2qut s VAL 233 N -3.31 4.86 0.11 -6.03 1.01 -1.26 -5.02 120.40 110.75 2qut s VAL 233 Ca 0.59 0.67 -0.04 0.00 0.00 0.00 0.00 61.98 63.20 2qut s VAL 233 Cb -0.12 -4.10 -0.03 0.00 0.00 0.00 0.00 36.38 32.14 2qut s VAL 233 CO 0.52 -0.33 0.11 0.42 0.00 0.00 0.00 175.10 175.82 2qut s THR 234 N 2.78 0.14 0.87 3.92 -4.23 -1.26 -4.51 115.64 113.34 2qut s THR 234 Ca 0.26 -1.62 -0.11 0.00 -1.18 0.00 0.00 61.69 59.04 2qut s THR 234 Cb -0.14 -1.71 0.11 0.00 1.34 0.00 0.00 72.50 72.10 2qut s THR 234 CO 0.15 -0.62 1.09 -2.16 -0.54 0.00 0.00 174.62 172.55 2qut s PRO 235 N -3.96 1.50 0.90 3.99 0.04 -1.26 -4.60 135.00 131.61 2qut s PRO 235 Ca 0.14 0.87 -0.11 0.00 0.04 0.00 0.00 61.00 61.94 2qut s PRO 235 Cb 0.06 -1.83 0.13 0.00 0.04 0.00 0.00 34.50 32.90 2qut s PRO 235 CO -0.05 -2.09 1.10 0.20 0.04 0.00 0.00 177.00 176.20 2qut s GLY 236 N -3.45 1.64 0.33 0.56 0.00 0.69 -4.92 107.32 102.17 2qut s GLY 236 Ca 0.63 0.17 0.01 0.00 0.00 0.00 0.00 44.72 45.53 2qut s GLY 236 CO 0.57 0.63 1.97 0.45 0.00 0.00 0.00 173.10 176.71 2qut h HIS 237 N -1.63 0.80 -0.48 1.90 3.86 -0.11 -2.53 115.15 116.96 2qut h HIS 237 Ca -0.48 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.73 2qut h HIS 237 Cb 1.27 -0.26 0.00 0.00 1.06 0.00 0.00 27.41 29.48 2qut h HIS 237 CO 0.47 0.55 0.00 0.00 0.86 0.00 0.00 177.93 179.81 2qut n ALA 238 N -2.44 2.48 -2.30 2.45 0.00 -0.09 -4.93 120.51 115.68 2qut n ALA 238 Ca 0.06 -0.87 -0.42 0.00 0.00 0.00 0.00 53.44 52.21 2qut n ALA 238 Cb 0.09 -0.97 -0.03 0.00 0.00 0.00 0.00 19.45 18.54 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 4.66 1.43 -3.87 0.00 1.35 -1.91 -3.45 112.91 111.12 2qut h THR 240 Ca -0.39 -2.45 -0.51 0.00 -0.55 0.00 0.00 66.41 62.51 2qut h THR 240 Cb 1.19 2.35 0.04 0.00 -1.73 0.00 0.00 68.15 70.00 2qut h THR 240 CO 0.86 0.68 0.51 -1.58 -0.25 0.00 0.00 175.52 175.75 2qut s GLN 241 N -3.30 4.39 0.04 4.72 0.74 -1.26 -5.03 119.66 119.96 2qut s GLN 241 Ca -0.00 1.88 0.05 0.00 0.05 0.00 0.00 55.36 57.34 2qut s GLN 241 Cb 0.11 -2.98 -0.04 0.00 1.10 0.00 0.00 33.01 31.21 2qut s GLN 241 CO 0.77 -0.04 -0.07 0.15 -0.55 0.00 0.00 175.29 175.54 2qut s LYS 242 N -1.82 2.40 0.21 1.67 -0.14 -1.26 -5.03 119.74 115.77 2qut s LYS 242 Ca 0.50 -0.84 0.06 0.00 -1.36 0.00 0.00 55.97 54.33 2qut s LYS 242 Cb -0.33 -2.43 -0.05 0.00 -1.68 0.00 0.00 37.83 33.34 2qut s LYS 242 CO 0.42 0.56 -0.08 0.71 -0.76 0.00 0.00 175.35 176.20 2qut s TYR 243 N -1.09 1.59 0.44 3.18 1.51 -1.26 -5.16 117.35 116.56 2qut s TYR 243 Ca 0.19 -0.73 -0.01 0.00 -1.01 0.00 0.00 57.07 55.51 2qut s TYR 243 Cb -0.11 -0.83 -0.01 0.00 -0.11 0.00 0.00 41.96 40.89 2qut s TYR 243 CO 0.10 0.17 0.68 -1.54 -1.11 0.00 0.00 175.55 173.85 2qut s SER 244 N -3.29 5.98 0.36 2.29 1.04 -1.26 -4.97 113.70 113.84 2qut s SER 244 Ca 0.23 0.45 0.05 0.00 0.48 0.00 0.00 55.95 57.17 2qut s SER 244 Cb 0.03 -1.77 0.69 0.00 0.10 0.00 0.00 66.02 65.07 2qut s SER 244 CO 0.06 -0.62 1.94 0.45 0.98 0.00 0.00 173.24 176.05 2qut h HIS 245 N 0.41 0.52 -0.38 5.02 3.86 -2.00 -1.78 115.15 120.81 2qut h HIS 245 Ca -0.47 -0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 58.68 2qut h HIS 245 Cb 1.24 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 29.53 2qut h HIS 245 CO 0.49 0.46 0.10 0.93 0.86 0.00 0.00 177.93 180.76 2qut h GLU 246 N 0.51 0.55 -0.11 2.45 3.07 -1.94 -0.49 114.58 118.63 2qut h GLU 246 Ca 0.12 -0.09 -0.16 0.00 -0.50 0.00 0.00 59.36 58.73 2qut h GLU 246 Cb 0.21 -0.10 0.01 0.00 -0.84 0.00 0.00 28.75 28.03 2qut h GLU 246 CO -0.00 0.51 -0.55 0.93 -1.40 0.00 0.00 179.01 178.50 2qut h GLU 247 N 0.54 0.56 -0.06 2.33 5.08 -1.72 -0.78 114.58 120.53 2qut h GLU 247 Ca 0.13 -0.46 -0.09 0.00 -1.00 0.00 0.00 59.36 57.94 2qut h GLU 247 Cb 0.20 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 2qut h GLU 247 CO -0.00 1.08 -0.39 -0.84 -1.00 0.00 0.00 179.01 177.85 2qut h ILE 248 N 0.17 1.30 -0.49 3.13 -0.00 -1.25 -0.91 117.51 119.46 2qut h ILE 248 Ca -0.04 -1.43 -0.13 0.00 -0.00 0.00 0.00 64.86 63.26 2qut h ILE 248 Cb 1.19 1.69 -0.01 0.00 -0.00 0.00 0.00 36.82 39.69 2qut h ILE 248 CO 0.11 0.42 -0.21 0.00 -0.00 0.00 0.00 178.15 178.47 2qut h ALA 249 N 1.49 0.68 -0.49 0.16 0.00 -1.02 0.36 119.26 120.44 2qut h ALA 249 Ca 0.01 -0.39 -0.08 0.00 0.00 0.00 0.00 54.91 54.45 2qut h ALA 249 Cb 0.75 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 2qut h ALA 249 CO 0.06 0.67 0.00 1.98 0.00 0.00 0.00 179.25 181.96 2qut h MET 250 N 0.86 0.87 -0.45 0.00 1.85 -0.69 -0.58 114.93 116.80 2qut h MET 250 Ca 0.11 -0.28 -0.14 0.00 -0.61 0.00 0.00 59.70 58.78 2qut h MET 250 Cb 0.79 -0.08 -0.01 0.00 0.43 0.00 0.00 31.60 32.73 2qut h MET 250 CO 0.07 0.91 -0.28 0.00 -0.40 0.00 0.00 176.91 177.20 2qut h ALA 251 N 0.93 0.65 0.38 0.39 0.00 -1.06 -0.80 119.26 119.75 2qut h ALA 251 Ca 0.14 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 2qut h ALA 251 Cb 0.51 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2qut h ALA 251 CO 0.03 0.68 -0.18 1.15 0.00 0.00 0.00 179.25 180.92 2qut h THR 252 N 0.82 0.62 -0.61 0.00 2.02 -0.78 -1.50 112.91 113.47 2qut h THR 252 Ca 0.09 -0.35 -0.04 0.00 0.77 0.00 0.00 66.41 66.89 2qut h THR 252 Cb 0.87 0.79 -0.03 0.00 -1.74 0.00 0.00 68.15 68.04 2qut h THR 252 CO 0.08 0.07 0.23 0.58 0.37 0.00 0.00 175.52 176.84 2qut h VAL 253 N -0.72 1.22 -0.40 3.16 2.07 -1.14 -1.80 116.25 118.64 2qut h VAL 253 Ca -0.05 -0.72 -0.05 0.00 0.82 0.00 0.00 66.70 66.71 2qut h VAL 253 Cb 0.50 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 2qut h VAL 253 CO 0.09 0.28 0.07 0.74 0.02 0.00 0.00 177.57 178.77 2qut h THR 254 N 0.88 1.24 -0.68 2.57 2.02 -1.10 -0.24 112.91 117.60 2qut h THR 254 Ca 0.21 -0.85 -0.02 0.00 0.77 0.00 0.00 66.41 66.51 2qut h THR 254 Cb 0.20 1.01 -0.03 0.00 -1.74 0.00 0.00 68.15 67.59 2qut h THR 254 CO -0.02 0.29 0.34 0.00 0.37 0.00 0.00 175.52 176.50 2qut h ALA 255 N 0.93 0.88 -0.54 6.16 0.00 -0.95 -2.10 119.26 123.64 2qut h ALA 255 Ca 0.12 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 2qut h ALA 255 Cb 0.36 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2qut h ALA 255 CO 0.01 0.43 -0.11 -0.07 0.00 0.00 0.00 179.25 179.50 2qut h LEU 256 N 0.94 1.03 -1.83 0.00 3.38 -1.19 -2.81 115.31 114.83 2qut h LEU 256 Ca 0.24 -0.35 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 2qut h LEU 256 Cb 0.10 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 2qut h LEU 256 CO -0.03 1.15 -0.14 0.03 0.09 0.00 0.00 178.44 179.53 2qut h ARG 257 N 0.91 0.00 -0.01 1.13 3.08 -0.77 0.33 114.38 119.05 2qut h ARG 257 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.19 2qut h ARG 257 Cb 0.68 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.73 2qut h ARG 257 CO 0.05 0.14 -0.19 0.54 -1.07 0.00 0.00 179.97 179.44 2qut n ARG 258 N -3.94 1.13 0.00 0.04 1.74 -0.81 -4.62 116.66 110.21 2qut n ARG 258 Ca -0.02 -0.70 0.00 0.00 -0.77 0.00 0.00 57.85 56.36 2qut n ARG 258 Cb 0.23 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.19 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 -0.33 0.00 -2.95 0.55 -2.24 -0.98 -4.99 114.28 103.35 2qut n THR 259 Ca 0.14 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.49 2qut n THR 259 Cb 0.37 -0.17 -0.05 0.00 -2.10 0.00 0.00 70.33 68.38 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 -1.21 4.65 0.48 2.28 1.01 0.07 -4.76 120.40 122.92 2qut s VAL 260 Ca 0.00 0.52 -0.23 0.00 0.00 0.00 0.00 61.98 62.27 2qut s VAL 260 Cb 0.00 -4.31 -0.08 0.00 0.00 0.00 0.00 36.38 31.99 2qut s VAL 260 CO 0.00 -0.69 1.19 -2.65 0.00 0.00 0.00 175.10 172.95 2qut n PRO 261 N 6.71 1.58 0.16 2.72 -0.02 -1.26 -4.84 135.00 140.05 2qut n PRO 261 Ca 0.03 0.57 0.17 0.00 -2.02 0.00 0.00 63.50 62.26 2qut n PRO 261 Cb 0.48 -2.32 0.78 0.00 -0.02 0.00 0.00 33.50 32.42 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 1.55 0.00 0.00 0.52 0.11 -1.96 -1.55 132.00 130.67 2qut h PRO 262 Ca -0.48 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 2qut h PRO 262 Cb 1.32 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.42 2qut h PRO 262 CO 0.57 0.00 -0.07 0.00 -0.21 0.00 0.00 178.00 178.29 2qut h ALA 263 N 1.74 1.22 -2.35 -0.75 0.00 -1.91 -3.42 119.26 113.79 2qut h ALA 263 Ca 0.12 -0.07 -0.54 0.00 0.00 0.00 0.00 54.91 54.43 2qut h ALA 263 Cb 0.63 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.42 2qut h ALA 263 CO -0.00 0.09 1.15 0.08 0.00 0.00 0.00 179.25 180.57 2qut s VAL 264 N -4.16 3.15 0.38 0.00 1.01 -0.59 -3.46 120.40 116.73 2qut s VAL 264 Ca -0.03 0.28 0.05 0.00 0.00 0.00 0.00 61.98 62.28 2qut s VAL 264 Cb 0.13 -3.18 0.25 0.00 0.00 0.00 0.00 36.38 33.58 2qut s VAL 264 CO 0.55 -0.02 2.02 0.74 0.00 0.00 0.00 175.10 178.38 2qut h THR 265 N 5.44 1.14 -1.85 3.92 2.02 -1.68 -3.44 112.91 118.47 2qut h THR 265 Ca -0.45 -0.30 0.14 0.00 0.77 0.00 0.00 66.41 66.56 2qut h THR 265 Cb 1.21 0.44 -0.19 0.00 -1.74 0.00 0.00 68.15 67.88 2qut h THR 265 CO 0.94 0.14 0.60 -0.83 0.37 0.00 0.00 175.52 176.74 2qut s GLY 266 N -3.62 -0.35 -0.18 2.16 0.00 -1.26 -3.53 107.32 100.54 2qut s GLY 266 Ca -0.09 1.50 -0.01 0.00 0.00 0.00 0.00 44.72 46.12 2qut s GLY 266 CO 0.75 0.61 -0.12 0.14 0.00 0.00 0.00 173.10 174.48 2qut s VAL 267 N -2.31 2.82 -0.49 1.40 1.01 0.21 -1.35 120.40 121.70 2qut s VAL 267 Ca 0.04 -0.69 0.03 0.00 0.00 0.00 0.00 61.98 61.36 2qut s VAL 267 Cb -0.01 -2.23 0.13 0.00 0.00 0.00 0.00 36.38 34.27 2qut s VAL 267 CO -0.05 0.49 0.23 0.42 0.00 0.00 0.00 175.10 176.18 2qut s THR 268 N 1.15 2.66 0.43 3.92 -4.23 0.83 -0.73 115.64 119.66 2qut s THR 268 Ca 0.01 -3.02 -0.26 0.00 -1.18 0.00 0.00 61.69 57.24 2qut s THR 268 Cb -0.14 -2.85 -0.09 0.00 1.34 0.00 0.00 72.50 70.75 2qut s THR 268 CO -0.04 -0.76 1.41 0.49 -0.54 0.00 0.00 174.62 175.19 2qut n PHE 269 N 3.46 2.66 -3.09 3.99 3.72 -0.66 -4.12 117.46 123.42 2qut n PHE 269 Ca 0.05 0.45 -0.30 0.00 -0.05 0.00 0.00 57.45 57.61 2qut n PHE 269 Cb 0.35 -2.46 -0.03 0.00 -0.94 0.00 0.00 39.48 36.40 2qut n PHE 269 CO 0.00 0.00 0.00 -0.48 -0.05 0.00 0.00 176.76 176.23 2qut s LEU 270 N -2.30 3.95 0.17 4.37 0.05 -1.03 -1.14 118.68 122.75 2qut s LEU 270 Ca 0.59 0.96 0.23 0.00 0.05 0.00 0.00 54.13 55.97 2qut s LEU 270 Cb -0.47 -3.81 0.17 0.00 -2.05 0.00 0.00 46.19 40.03 2qut s LEU 270 CO 0.59 -0.29 1.19 0.77 -0.55 0.00 0.00 176.35 178.06 2qut h SER 271 N 1.55 0.00 -6.57 1.48 4.64 -1.92 -3.41 113.55 109.32 2qut h SER 271 Ca -0.47 -0.11 -0.45 0.00 -0.47 0.00 0.00 61.79 60.28 2qut h SER 271 Cb 1.19 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.13 2qut h SER 271 CO 0.65 0.05 -0.71 0.61 -0.87 0.00 0.00 176.83 176.56 2qut n GLY 272 N 1.25 -0.12 0.51 -0.77 0.00 -1.26 -0.89 105.19 103.92 2qut n GLY 272 Ca 0.02 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 -2.14 0.99 3.76 -0.02 0.00 -1.26 -4.83 105.19 101.69 2qut n GLY 273 Ca -0.23 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.84 2.34 0.73 1.61 -0.21 -0.07 -5.01 119.66 118.22 2qut s GLN 274 Ca 0.00 1.32 -0.11 0.00 0.02 0.00 0.00 55.36 56.58 2qut s GLN 274 Cb 0.00 -1.90 0.03 0.00 1.00 0.00 0.00 33.01 32.14 2qut s GLN 274 CO 0.00 -1.60 1.09 -1.54 -2.12 0.00 0.00 175.29 171.12 2qut s SER 275 N -2.96 5.16 0.19 5.90 1.04 -1.26 -4.64 113.70 117.13 2qut s SER 275 Ca 0.65 1.25 -0.13 0.00 0.48 0.00 0.00 55.95 58.19 2qut s SER 275 Cb -0.20 -2.04 0.20 0.00 0.10 0.00 0.00 66.02 64.08 2qut s SER 275 CO 0.50 -1.53 1.71 -0.33 0.98 0.00 0.00 173.24 174.57 2qut h GLU 276 N -0.79 0.20 -0.23 4.02 5.08 -1.88 -0.01 114.58 120.97 2qut h GLU 276 Ca -0.45 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 57.86 2qut h GLU 276 Cb 1.25 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 2qut h GLU 276 CO 0.62 0.13 0.02 1.49 -1.00 0.00 0.00 179.01 180.27 2qut h GLU 277 N 0.20 0.39 -0.53 2.33 4.57 -1.92 -2.31 114.58 117.32 2qut h GLU 277 Ca 0.26 -0.11 0.01 0.00 -1.18 0.00 0.00 59.36 58.34 2qut h GLU 277 Cb 0.36 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.88 2qut h GLU 277 CO -0.36 0.55 0.34 1.49 -1.18 0.00 0.00 179.01 179.85 2qut h GLU 278 N 0.17 0.66 -0.80 1.92 4.81 -1.83 0.11 114.58 119.61 2qut h GLU 278 Ca 0.07 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.23 2qut h GLU 278 Cb 0.36 -0.15 -0.04 0.00 0.63 0.00 0.00 28.75 29.55 2qut h GLU 278 CO 0.01 0.44 0.41 0.00 -0.73 0.00 0.00 179.01 179.13 2qut h ALA 279 N 1.21 1.21 -0.16 2.92 0.00 -0.96 0.77 119.26 124.25 2qut h ALA 279 Ca 0.20 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.84 2qut h ALA 279 Cb -0.04 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.43 2qut h ALA 279 CO -0.06 0.62 -0.41 0.77 0.00 0.00 0.00 179.25 180.16 2qut h SER 280 N 1.13 0.64 -0.61 0.00 0.02 -0.94 -2.08 113.55 111.71 2qut h SER 280 Ca 0.28 -0.58 -0.05 0.00 -0.84 0.00 0.00 61.79 60.60 2qut h SER 280 Cb 0.07 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.40 2qut h SER 280 CO -0.04 1.10 0.20 0.40 -1.14 0.00 0.00 176.83 177.36 2qut h ILE 281 N 0.21 1.24 -0.27 3.27 2.04 -0.55 -1.05 117.51 122.40 2qut h ILE 281 Ca -0.01 -0.82 -0.10 0.00 1.00 0.00 0.00 64.86 64.93 2qut h ILE 281 Cb 1.03 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 2qut h ILE 281 CO 0.09 0.32 -0.22 0.78 0.00 0.00 0.00 178.15 179.12 2qut h ASN 282 N 0.95 0.66 -0.76 1.72 2.35 -0.85 -1.38 115.58 118.27 2qut h ASN 282 Ca 0.21 -0.45 -0.01 0.00 -0.55 0.00 0.00 56.30 55.50 2qut h ASN 282 Cb 0.27 -0.19 -0.04 0.00 0.05 0.00 0.00 38.32 38.41 2qut h ASN 282 CO -0.01 0.98 0.44 0.25 -1.65 0.00 0.00 177.43 177.44 2qut h LEU 283 N 0.36 0.93 -0.04 1.61 5.85 -1.21 0.30 115.31 123.10 2qut h LEU 283 Ca 0.05 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.69 2qut h LEU 283 Cb 0.77 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.56 2qut h LEU 283 CO 0.06 0.74 0.03 -1.13 -0.34 0.00 0.00 178.44 177.79 2qut h ASN 284 N 1.04 0.05 -0.82 1.25 -1.24 -1.11 -1.65 115.58 113.10 2qut h ASN 284 Ca 0.27 -0.01 0.02 0.00 0.71 0.00 0.00 56.30 57.30 2qut h ASN 284 Cb -0.00 -0.01 -0.04 0.00 0.73 0.00 0.00 38.32 38.99 2qut h ASN 284 CO -0.05 0.04 0.54 0.00 -1.29 0.00 0.00 177.43 176.67 2qut h ALA 285 N 1.01 1.46 -0.81 1.57 0.00 -0.81 -2.04 119.26 119.65 2qut h ALA 285 Ca 0.01 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2qut h ALA 285 Cb -0.00 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.45 2qut h ALA 285 CO -0.00 0.47 0.37 0.82 0.00 0.00 0.00 179.25 180.91 2qut h ILE 286 N 1.06 1.26 0.00 0.00 2.04 -0.42 -1.84 117.51 119.60 2qut h ILE 286 Ca 0.32 -0.74 0.00 0.00 1.00 0.00 0.00 64.86 65.43 2qut h ILE 286 Cb -0.03 0.24 0.00 0.00 -0.74 0.00 0.00 36.82 36.30 2qut h ILE 286 CO -0.08 0.31 0.00 0.78 0.00 0.00 0.00 178.15 179.16 2qut h ASN 287 N 1.16 0.00 0.08 1.72 2.35 -0.65 -2.95 115.58 117.28 2qut h ASN 287 Ca 0.28 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.03 2qut h ASN 287 Cb 0.15 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.52 2qut h ASN 287 CO -0.03 0.00 -0.38 0.29 -1.65 0.00 0.00 177.43 175.66 2qut n LYS 288 N -3.02 1.11 -1.67 0.81 5.02 -0.83 -4.80 118.16 114.77 2qut n LYS 288 Ca 0.03 -0.84 -0.47 0.00 -2.02 0.00 0.00 58.31 55.01 2qut n LYS 288 Cb 0.42 -1.48 -0.04 0.00 -0.02 0.00 0.00 35.03 33.90 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 4.61 0.40 -4.32 0.00 -0.04 -1.26 -4.78 135.00 129.61 2qut n PRO 290 Ca 0.19 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.46 2qut n PRO 290 Cb 0.29 -1.30 -0.11 0.00 -0.04 0.00 0.00 33.50 32.34 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 2.48 0.00 1.53 1.43 -1.26 -4.51 118.68 118.35 2qut s LEU 291 Ca 0.00 -0.91 -0.30 0.00 -1.03 0.00 0.00 54.13 51.88 2qut s LEU 291 Cb 0.00 -0.71 -0.05 0.00 0.03 0.00 0.00 46.19 45.47 2qut s LEU 291 CO 0.00 -0.11 1.27 -0.22 0.23 0.00 0.00 176.35 177.52 2qut s LEU 292 N -2.88 4.32 -0.31 1.79 0.20 -1.26 -5.00 118.68 115.54 2qut s LEU 292 Ca 0.17 1.98 0.02 0.00 0.69 0.00 0.00 54.13 56.99 2qut s LEU 292 Cb -0.04 -3.57 0.09 0.00 -0.43 0.00 0.00 46.19 42.25 2qut s LEU 292 CO 0.06 -0.60 0.04 -0.54 -0.29 0.00 0.00 176.35 175.02 2qut s LYS 293 N 1.89 1.31 0.00 1.98 3.01 -1.26 -4.97 119.74 121.70 2qut s LYS 293 Ca 0.59 -1.48 0.10 0.00 -1.01 0.00 0.00 55.97 54.18 2qut s LYS 293 Cb -0.29 -2.74 0.61 0.00 -1.01 0.00 0.00 37.83 34.41 2qut s LYS 293 CO 0.26 -0.88 1.26 -0.35 0.51 0.00 0.00 175.35 176.14 2qut n PRO 294 N 4.50 0.83 -4.16 -1.68 -0.04 -1.26 -4.81 135.00 128.38 2qut n PRO 294 Ca -0.01 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.32 2qut n PRO 294 Cb 0.42 -1.19 -0.11 0.00 -0.04 0.00 0.00 33.50 32.58 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 0.96 0.34 0.54 0.51 -1.26 -4.93 118.94 113.11 2qut s TRP 295 Ca 0.15 -0.70 -0.29 0.00 -2.12 0.00 0.00 56.10 53.15 2qut s TRP 295 Cb 0.07 -0.54 -0.11 0.00 -0.81 0.00 0.00 33.47 32.09 2qut s TRP 295 CO 0.12 -0.05 1.45 0.00 -0.51 0.00 0.00 176.95 177.95 2qut s ALA 296 N -2.61 3.58 -0.40 0.98 0.00 -1.23 -4.84 121.76 117.24 2qut s ALA 296 Ca 0.05 1.47 0.04 0.00 0.00 0.00 0.00 51.96 53.51 2qut s ALA 296 Cb -0.02 -3.57 0.11 0.00 0.00 0.00 0.00 23.12 19.64 2qut s ALA 296 CO -0.01 -0.91 0.12 -0.51 0.00 0.00 0.00 175.76 174.45 2qut s LEU 297 N -1.68 4.51 0.00 0.00 1.43 -1.26 -0.62 118.68 121.06 2qut s LEU 297 Ca 0.53 -2.43 0.00 0.00 -1.03 0.00 0.00 54.13 51.20 2qut s LEU 297 Cb -0.44 -1.60 0.00 0.00 0.03 0.00 0.00 46.19 44.18 2qut s LEU 297 CO 0.57 -0.33 0.00 1.07 0.23 0.00 0.00 176.35 177.89 2qut n THR 298 N 3.88 0.00 -4.41 5.49 5.66 0.09 -4.67 114.28 120.32 2qut n THR 298 Ca 0.04 0.00 -0.25 0.00 -3.05 0.00 0.00 64.05 60.79 2qut n THR 298 Cb 0.39 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.06 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 0.63 2.38 -0.43 1.09 -0.71 -1.26 -1.66 117.98 118.03 2qut s PHE 299 Ca 0.00 -0.31 0.06 0.00 -1.04 0.00 0.00 56.93 55.63 2qut s PHE 299 Cb 0.00 -1.11 0.20 0.00 -1.21 0.00 0.00 43.02 40.91 2qut s PHE 299 CO 0.00 0.60 0.52 0.45 -1.34 0.00 0.00 175.22 175.45 2qut n SER 300 N -0.24 -1.06 -4.79 1.98 2.88 -0.29 0.68 113.62 112.78 2qut n SER 300 Ca -0.09 -2.65 -0.36 0.00 -1.33 0.00 0.00 58.87 54.44 2qut n SER 300 Cb 0.58 0.06 -0.07 0.00 -0.75 0.00 0.00 64.21 64.03 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 -0.09 3.50 0.00 0.66 2.02 -0.56 -4.12 117.35 118.77 2qut s TYR 301 Ca 0.33 0.49 0.00 0.00 -0.37 0.00 0.00 57.07 57.52 2qut s TYR 301 Cb 0.09 -2.13 0.00 0.00 -0.40 0.00 0.00 41.96 39.52 2qut s TYR 301 CO -0.15 0.45 0.00 0.41 -1.57 0.00 0.00 175.55 174.69 2qut n GLY 302 N 2.87 -0.26 0.32 0.71 0.00 -1.26 -0.73 105.19 106.85 2qut n GLY 302 Ca -0.16 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.86 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 0.95 0.00 1.61 3.08 -1.95 -2.04 114.38 116.03 2qut h ARG 303 Ca 0.00 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.99 2qut h ARG 303 Cb 0.00 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 29.84 2qut h ARG 303 CO 0.00 0.63 0.00 0.00 -1.07 0.00 0.00 179.97 179.53 2qut n ALA 304 N -2.35 1.56 0.16 0.04 0.00 -1.26 -1.06 120.51 117.60 2qut n ALA 304 Ca 0.12 -0.04 0.03 0.00 0.00 0.00 0.00 53.44 53.55 2qut n ALA 304 Cb 0.17 -1.15 -0.03 0.00 0.00 0.00 0.00 19.45 18.44 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 -1.33 0.16 -0.01 0.00 4.77 -0.80 -4.58 117.00 115.21 2qut n LEU 305 Ca 0.04 -0.32 0.03 0.00 -0.03 0.00 0.00 56.01 55.73 2qut n LEU 305 Cb 0.08 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.11 2qut n LEU 305 CO 0.07 0.04 -0.61 0.00 -1.33 0.00 0.00 177.39 175.57 2qut n GLN 306 N -1.33 0.45 -0.23 3.23 6.02 -0.82 -4.58 117.38 120.12 2qut n GLN 306 Ca 0.00 -0.07 -0.06 0.00 -0.01 0.00 0.00 57.00 56.87 2qut n GLN 306 Cb 0.10 -1.19 -0.05 0.00 1.02 0.00 0.00 30.24 30.12 2qut n GLN 306 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2qut n ALA 307 N -1.82 -0.35 -0.08 -1.58 0.00 -0.22 0.11 120.51 116.57 2qut n ALA 307 Ca -0.02 0.47 -0.05 0.00 0.00 0.00 0.00 53.44 53.83 2qut n ALA 307 Cb 0.25 0.15 0.14 0.00 0.00 0.00 0.00 19.45 19.99 2qut n ALA 307 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2qut h SER 308 N 0.00 0.72 -0.38 0.00 0.02 -1.88 -2.64 113.55 109.40 2qut h SER 308 Ca 0.09 -0.21 -0.04 0.00 -0.84 0.00 0.00 61.79 60.79 2qut h SER 308 Cb 0.22 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.55 2qut h SER 308 CO -0.52 0.87 0.10 0.00 -1.14 0.00 0.00 176.83 176.13 2qut h ALA 309 N 1.20 0.50 -0.49 3.77 0.00 -1.53 -0.72 119.26 121.99 2qut h ALA 309 Ca 0.11 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.84 2qut h ALA 309 Cb 0.59 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2qut h ALA 309 CO 0.04 0.17 0.33 1.25 0.00 0.00 0.00 179.25 181.04 2qut h LEU 310 N 0.47 0.56 -0.20 0.00 5.85 -0.25 -1.29 115.31 120.45 2qut h LEU 310 Ca 0.12 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.81 2qut h LEU 310 Cb 0.30 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 2qut h LEU 310 CO 0.00 0.41 0.05 0.50 -0.34 0.00 0.00 178.44 179.06 2qut h LYS 311 N 0.67 0.32 -0.69 1.25 3.64 -1.32 -2.24 116.57 118.19 2qut h LYS 311 Ca 0.18 -0.07 0.01 0.00 -1.27 0.00 0.00 60.65 59.49 2qut h LYS 311 Cb -0.08 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.67 2qut h LYS 311 CO -0.04 0.44 0.46 0.00 -2.27 0.00 0.00 179.45 178.03 2qut h ALA 312 N 0.87 1.50 0.02 5.00 0.00 -0.95 -2.81 119.26 122.89 2qut h ALA 312 Ca 0.06 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2qut h ALA 312 Cb 0.26 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2qut h ALA 312 CO -0.00 0.46 -0.01 2.35 0.00 0.00 0.00 179.25 182.05 2qut h TRP 313 N 0.94 -0.03 -0.15 0.00 7.01 -1.07 -3.42 115.95 119.24 2qut h TRP 313 Ca 0.25 -0.00 -0.06 0.00 2.11 0.00 0.00 58.89 61.19 2qut h TRP 313 Cb -0.10 0.01 -0.02 0.00 -2.10 0.00 0.00 29.16 26.94 2qut h TRP 313 CO 0.00 0.26 -0.06 0.41 -2.79 0.00 0.00 178.44 176.27 2qut n GLY 314 N -0.32 0.29 1.74 2.65 0.00 -0.86 -0.93 105.19 107.77 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 0.79 0.54 3.29 -0.02 0.00 -1.26 -4.82 105.19 103.71 2qut n GLY 315 Ca -0.03 -0.22 -0.36 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.50 3.06 0.57 1.61 1.02 -0.10 -4.97 119.74 120.43 2qut s LYS 316 Ca 0.00 -0.85 0.28 0.00 0.02 0.00 0.00 55.97 55.42 2qut s LYS 316 Cb 0.00 -3.19 1.48 0.00 -0.52 0.00 0.00 37.83 35.61 2qut s LYS 316 CO 0.00 -0.39 1.95 0.87 -0.92 0.00 0.00 175.35 176.87 2qut h LYS 317 N 8.14 0.00 -0.52 1.68 1.57 -1.96 0.11 116.57 125.58 2qut h LYS 317 Ca -0.33 0.00 0.05 0.00 -1.87 0.00 0.00 60.65 58.50 2qut h LYS 317 Cb 1.13 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.41 2qut h LYS 317 CO 0.59 0.00 0.35 0.93 -0.57 0.00 0.00 179.45 180.75 2qut h GLU 318 N 0.00 0.50 -0.86 3.15 5.08 -1.93 -1.77 114.58 118.75 2qut h GLU 318 Ca 0.23 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.50 2qut h GLU 318 Cb 1.09 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 30.20 2qut h GLU 318 CO -0.00 0.33 0.08 0.09 -1.00 0.00 0.00 179.01 178.50 2qut n ASN 319 N -4.47 3.23 0.17 1.42 5.03 0.37 -4.56 115.26 116.45 2qut n ASN 319 Ca 0.07 -2.51 -0.14 0.00 0.87 0.00 0.00 54.58 52.87 2qut n ASN 319 Cb 0.21 -0.60 -0.08 0.00 -1.02 0.00 0.00 39.78 38.28 2qut n ASN 319 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.26 175.68 2qut h LEU 320 N 1.63 -1.24 -1.45 3.41 5.85 -1.44 -0.02 115.31 122.06 2qut h LEU 320 Ca 0.07 0.11 0.02 0.00 0.84 0.00 0.00 57.88 58.93 2qut h LEU 320 Cb 1.35 0.43 -0.03 0.00 0.37 0.00 0.00 40.66 42.79 2qut h LEU 320 CO 0.30 -0.51 0.39 0.50 -0.34 0.00 0.00 178.44 178.77 2qut h LYS 321 N -0.74 0.72 -0.16 1.25 1.63 -1.85 -1.01 116.57 116.41 2qut h LYS 321 Ca -0.03 -0.04 -0.03 0.00 -0.85 0.00 0.00 60.65 59.70 2qut h LYS 321 Cb 0.68 -0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 32.15 2qut h LYS 321 CO -0.14 0.48 -0.01 0.00 -3.45 0.00 0.00 179.45 176.33 2qut h ALA 322 N 1.65 0.22 0.21 5.00 0.00 -1.81 -2.14 119.26 122.38 2qut h ALA 322 Ca 0.22 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2qut h ALA 322 Cb -0.01 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 2qut h ALA 322 CO -0.05 -0.06 -0.12 0.00 0.00 0.00 0.00 179.25 179.01 2qut h ALA 323 N 0.75 -0.31 -0.90 0.00 0.00 -0.55 -2.78 119.26 115.47 2qut h ALA 323 Ca 0.04 -0.06 0.08 0.00 0.00 0.00 0.00 54.91 54.97 2qut h ALA 323 Cb 0.41 0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.28 2qut h ALA 323 CO 0.01 -0.68 0.58 1.96 0.00 0.00 0.00 179.25 181.12 2qut h GLN 324 N -0.32 0.93 -1.00 0.00 4.20 -1.21 -1.56 115.11 116.15 2qut h GLN 324 Ca -0.02 -0.06 0.04 0.00 0.06 0.00 0.00 58.65 58.67 2qut h GLN 324 Cb 0.26 -0.21 -0.06 0.00 0.30 0.00 0.00 27.48 27.77 2qut h GLN 324 CO 0.03 0.61 0.65 1.49 -0.67 0.00 0.00 178.83 180.95 2qut h GLU 325 N 0.96 1.21 -0.45 1.46 4.57 -1.12 0.14 114.58 121.34 2qut h GLU 325 Ca 0.40 -0.07 -0.06 0.00 -1.18 0.00 0.00 59.36 58.45 2qut h GLU 325 Cb 0.31 -0.27 -0.02 0.00 -0.16 0.00 0.00 28.75 28.61 2qut h GLU 325 CO -0.16 0.80 0.03 0.93 -1.18 0.00 0.00 179.01 179.43 2qut h GLU 326 N 1.24 0.78 -0.02 1.92 4.39 -1.10 -1.35 114.58 120.44 2qut h GLU 326 Ca 0.41 -0.23 -0.00 0.00 0.34 0.00 0.00 59.36 59.87 2qut h GLU 326 Cb 0.04 -0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 28.61 2qut h GLU 326 CO -0.14 0.82 0.01 -0.92 -1.16 0.00 0.00 179.01 177.62 2qut h TYR 327 N 0.63 0.03 -0.61 4.33 3.20 -1.01 -2.32 116.97 121.22 2qut h TYR 327 Ca 0.13 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.08 2qut h TYR 327 Cb 0.45 -0.01 -0.06 0.00 1.54 0.00 0.00 36.73 38.64 2qut h TYR 327 CO 0.03 0.11 0.26 0.28 -1.64 0.00 0.00 178.16 177.21 2qut h VAL 328 N -0.06 0.84 -0.93 1.81 2.07 -0.65 0.10 116.25 119.43 2qut h VAL 328 Ca 0.01 -0.16 0.03 0.00 0.82 0.00 0.00 66.70 67.39 2qut h VAL 328 Cb 0.09 0.32 -0.05 0.00 -1.52 0.00 0.00 31.29 30.12 2qut h VAL 328 CO -0.00 0.09 0.61 0.11 0.02 0.00 0.00 177.57 178.39 2qut h LYS 329 N 0.48 1.16 -0.10 1.57 1.57 -1.04 0.13 116.57 120.33 2qut h LYS 329 Ca 0.30 -0.07 -0.17 0.00 -1.87 0.00 0.00 60.65 58.84 2qut h LYS 329 Cb 0.31 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 2qut h LYS 329 CO -0.26 0.77 -0.65 0.00 -0.57 0.00 0.00 179.45 178.73 2qut h ARG 330 N 1.19 0.41 -0.50 3.15 2.47 -0.72 -0.21 114.38 120.17 2qut h ARG 330 Ca 0.36 -0.30 -0.03 0.00 -1.26 0.00 0.00 59.98 58.76 2qut h ARG 330 Cb -0.03 0.05 -0.02 0.00 -1.65 0.00 0.00 29.97 28.32 2qut h ARG 330 CO -0.11 0.92 0.20 0.00 0.56 0.00 0.00 179.97 181.54 2qut h ALA 331 N 1.00 0.65 -0.42 0.04 0.00 -0.19 -0.62 119.26 119.72 2qut h ALA 331 Ca -0.02 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 2qut h ALA 331 Cb 1.21 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 2qut h ALA 331 CO 0.11 0.25 0.12 -0.07 0.00 0.00 0.00 179.25 179.67 2qut h LEU 332 N 0.66 0.62 -0.07 0.00 3.38 -0.62 -1.40 115.31 117.87 2qut h LEU 332 Ca 0.17 -0.22 0.01 0.00 0.09 0.00 0.00 57.88 57.93 2qut h LEU 332 Cb 0.19 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2qut h LEU 332 CO -0.01 0.67 -0.01 0.00 0.09 0.00 0.00 178.44 179.17 2qut h ALA 333 N 0.97 0.05 0.00 1.53 0.00 -0.76 -2.37 119.26 118.68 2qut h ALA 333 Ca 0.13 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 2qut h ALA 333 Cb 0.28 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2qut h ALA 333 CO -0.00 -0.48 -0.38 -0.91 0.00 0.00 0.00 179.25 177.47 2qut h ASN 334 N 0.01 0.00 -0.61 0.00 2.35 -1.06 -0.40 115.58 115.86 2qut h ASN 334 Ca 0.04 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.73 2qut h ASN 334 Cb 0.05 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.39 2qut h ASN 334 CO -0.07 0.38 0.15 -1.28 -1.65 0.00 0.00 177.43 174.96 2qut h SER 335 N 0.00 0.92 -0.16 5.81 0.87 -0.95 -0.23 113.55 119.81 2qut h SER 335 Ca -0.00 -0.23 -0.15 0.00 -1.23 0.00 0.00 61.79 60.17 2qut h SER 335 Cb 0.83 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.54 2qut h SER 335 CO 0.05 0.91 -0.45 -0.07 -0.53 0.00 0.00 176.83 176.74 2qut h LEU 336 N 0.89 0.77 -0.34 2.23 3.38 -1.08 -3.21 115.31 117.95 2qut h LEU 336 Ca 0.19 -0.37 0.02 0.00 0.09 0.00 0.00 57.88 57.81 2qut h LEU 336 Cb 0.35 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 2qut h LEU 336 CO 0.00 1.11 0.18 0.00 0.09 0.00 0.00 178.44 179.82 2qut h ALA 337 N 0.92 0.42 0.00 1.53 0.00 -0.45 -0.19 119.26 121.48 2qut h ALA 337 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2qut h ALA 337 Cb 1.01 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2qut h ALA 337 CO 0.10 -0.18 0.00 0.00 0.00 0.00 0.00 179.25 179.16 2qut n GLN 339 N -0.82 1.21 -2.31 0.00 6.02 -0.24 -4.66 117.38 116.59 2qut n GLN 339 Ca 0.08 -0.47 -0.13 0.00 -0.01 0.00 0.00 57.00 56.47 2qut n GLN 339 Cb 0.04 -0.93 -0.00 0.00 1.02 0.00 0.00 30.24 30.37 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 0.38 -0.14 0.61 1.08 0.00 0.21 -4.92 105.19 102.41 2qut n GLY 340 Ca 0.01 -0.33 0.06 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.29 1.19 -3.99 1.61 5.02 -0.29 -4.88 118.16 114.52 2qut n LYS 341 Ca -0.14 -2.82 -0.35 0.00 -2.02 0.00 0.00 58.31 52.98 2qut n LYS 341 Cb 0.61 -1.29 -0.06 0.00 -0.02 0.00 0.00 35.03 34.27 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 -2.49 3.47 -0.24 2.13 5.04 -1.25 -4.83 117.35 119.18 2qut s TYR 342 Ca 0.34 0.38 -0.02 0.00 -2.44 0.00 0.00 57.07 55.33 2qut s TYR 342 Cb 0.33 -1.86 0.12 0.00 0.35 0.00 0.00 41.96 40.91 2qut s TYR 342 CO -0.06 0.65 0.30 0.95 -1.34 0.00 0.00 175.55 176.05 2qut s THR 343 N -1.11 -0.45 0.24 4.34 -4.23 -1.26 -4.98 115.64 108.18 2qut s THR 343 Ca 0.19 -0.21 -0.05 0.00 -1.18 0.00 0.00 61.69 60.44 2qut s THR 343 Cb -0.12 -0.82 0.21 0.00 1.34 0.00 0.00 72.50 73.10 2qut s THR 343 CO 0.09 -0.26 1.73 1.55 -0.54 0.00 0.00 174.62 177.19 2qut h PRO 344 N 8.25 0.41 0.07 3.99 0.13 -1.98 -3.54 132.00 139.34 2qut h PRO 344 Ca -0.16 -0.02 -0.37 0.00 -0.87 0.00 0.00 66.00 64.57 2qut h PRO 344 Cb 1.13 -0.09 -0.04 0.00 0.13 0.00 0.00 31.00 32.13 2qut h PRO 344 CO 0.29 0.27 -2.18 0.43 -0.23 0.00 0.00 178.00 176.58 2qut n SER 345 N -5.01 1.94 -4.92 1.44 7.64 -1.26 -5.23 113.62 108.22 2qut n SER 345 Ca 0.13 0.08 -0.27 0.00 1.01 0.00 0.00 58.87 59.83 2qut n SER 345 Cb 0.39 -0.59 -0.02 0.00 -1.01 0.00 0.00 64.21 62.98 2qut n SER 345 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2qut s SER 359 N -6.75 6.36 -0.11 6.43 0.15 -1.26 -5.34 113.70 113.18 2qut s SER 359 Ca -0.26 0.66 -0.01 0.00 0.70 0.00 0.00 55.95 57.04 2qut s SER 359 Cb 0.08 -2.12 0.03 0.00 -1.71 0.00 0.00 66.02 62.29 2qut s SER 359 CO 0.71 -0.31 -0.05 0.21 1.20 0.00 0.00 173.24 175.01 2qut s ASN 360 N -3.67 2.06 0.00 5.45 3.84 -1.26 -4.99 114.94 116.37 2qut s ASN 360 Ca 0.43 -0.27 0.16 0.00 0.21 0.00 0.00 52.86 53.39 2qut s ASN 360 Cb -0.10 -0.71 0.97 0.00 -0.55 0.00 0.00 41.25 40.85 2qut s ASN 360 CO 0.35 -0.15 1.54 1.41 -2.79 0.00 0.00 177.10 177.46 2qut n HIS 361 N 5.01 0.00 1.87 0.43 8.25 -1.26 -2.92 115.22 126.60 2qut n HIS 361 Ca -0.11 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.49 2qut n HIS 361 Cb 0.50 0.00 0.75 0.00 1.12 0.00 0.00 29.99 32.36 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 -0.79 2.64 0.32 -1.41 0.00 -1.26 -5.30 120.51 114.71 2qut n ALA 362 Ca 0.12 -0.24 0.04 0.00 0.00 0.00 0.00 53.44 53.36 2qut n ALA 362 Cb 0.06 -1.39 0.03 0.00 0.00 0.00 0.00 19.45 18.15 2qut n ALA 362 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16