#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c9b h SER 16 N 0.00 0.00 -0.48 0.00 4.64 -1.90 -3.06 113.55 112.75 2c9b h SER 16 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2c9b h SER 16 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2c9b h SER 16 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 2c9b n GLY 17 N 0.29 1.63 3.71 -0.77 0.00 -1.26 -4.90 105.19 103.89 2c9b n GLY 17 Ca 0.03 -0.56 -0.37 0.00 0.00 0.00 0.00 46.02 45.11 2c9b n GLY 17 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c9b s VAL 18 N -1.53 5.27 -0.17 1.61 1.01 -1.16 -5.06 120.40 120.38 2c9b s VAL 18 Ca 0.34 0.60 -0.29 0.00 0.00 0.00 0.00 61.98 62.63 2c9b s VAL 18 Cb 0.20 -3.66 -0.00 0.00 0.00 0.00 0.00 36.38 32.91 2c9b s VAL 18 CO 0.20 0.35 1.01 -0.13 0.00 0.00 0.00 175.10 176.53 2c9b s ARG 19 N 0.74 4.34 -0.12 2.72 3.00 -1.26 -4.99 118.95 123.38 2c9b s ARG 19 Ca 0.17 1.35 0.02 0.00 0.00 0.00 0.00 55.73 57.27 2c9b s ARG 19 Cb -0.14 -3.59 0.01 0.00 0.00 0.00 0.00 34.95 31.24 2c9b s ARG 19 CO 0.05 -0.46 -0.16 -1.17 0.00 0.00 0.00 175.30 173.56 2c9b s LEU 20 N 2.57 1.78 -0.06 2.53 2.96 -1.26 -1.56 118.68 125.64 2c9b s LEU 20 Ca 0.46 -0.46 0.04 0.00 -0.22 0.00 0.00 54.13 53.95 2c9b s LEU 20 Cb -0.17 -1.15 -0.02 0.00 0.50 0.00 0.00 46.19 45.35 2c9b s LEU 20 CO 0.12 0.02 -0.17 0.00 -1.32 0.00 0.00 176.35 175.00 2c9b s ALA 21 N 0.99 2.53 -0.08 5.97 0.00 -0.77 -1.38 121.76 129.03 2c9b s ALA 21 Ca -0.06 -0.99 0.04 0.00 0.00 0.00 0.00 51.96 50.95 2c9b s ALA 21 Cb -0.15 -0.92 0.00 0.00 0.00 0.00 0.00 23.12 22.06 2c9b s ALA 21 CO -0.02 0.49 -0.21 0.42 0.00 0.00 0.00 175.76 176.44 2c9b s ILE 22 N -0.48 1.78 -0.22 0.00 1.01 0.11 -1.24 121.20 122.16 2c9b s ILE 22 Ca 0.06 -0.86 0.02 0.00 0.00 0.00 0.00 60.65 59.87 2c9b s ILE 22 Cb -0.12 -1.55 0.05 0.00 0.01 0.00 0.00 42.46 40.85 2c9b s ILE 22 CO 0.01 0.50 -0.12 0.54 0.00 0.00 0.00 174.94 175.87 2c9b s VAL 23 N 0.37 1.92 -0.09 2.92 0.11 0.15 -0.94 120.40 124.84 2c9b s VAL 23 Ca -0.16 -1.26 0.01 0.00 -2.93 0.00 0.00 61.98 57.65 2c9b s VAL 23 Cb -0.17 -1.97 -0.02 0.00 -1.53 0.00 0.00 36.38 32.69 2c9b s VAL 23 CO 0.07 0.15 -0.11 0.00 -3.33 0.00 0.00 175.10 171.87 2c9b s ALA 24 N 1.26 2.75 0.83 1.54 0.00 -0.50 -1.65 121.76 125.99 2c9b s ALA 24 Ca -0.03 -0.92 -0.12 0.00 0.00 0.00 0.00 51.96 50.89 2c9b s ALA 24 Cb -0.17 -1.15 0.09 0.00 0.00 0.00 0.00 23.12 21.89 2c9b s ALA 24 CO -0.08 0.44 1.17 0.45 0.00 0.00 0.00 175.76 177.75 2c9b s SER 25 N -0.34 4.27 -0.04 0.00 0.15 0.34 -1.37 113.70 116.73 2c9b s SER 25 Ca 0.04 0.80 0.07 0.00 0.70 0.00 0.00 55.95 57.56 2c9b s SER 25 Cb -0.13 -1.30 -0.10 0.00 -1.71 0.00 0.00 66.02 62.78 2c9b s SER 25 CO 0.02 -2.06 0.10 -1.20 1.20 0.00 0.00 173.24 171.31 2c9b n SER 26 N -3.42 3.27 -4.67 5.45 7.64 0.06 -4.79 113.62 117.16 2c9b n SER 26 Ca 0.08 0.00 -0.47 0.00 1.01 0.00 0.00 58.87 59.48 2c9b n SER 26 Cb 0.61 1.04 -0.05 0.00 -1.01 0.00 0.00 64.21 64.80 2c9b n SER 26 CO 0.00 0.00 0.00 1.87 -3.01 0.00 0.00 175.04 173.90 2c9b n TRP 27 N -1.99 2.24 -2.69 1.43 -0.00 -0.78 -2.61 117.44 113.04 2c9b n TRP 27 Ca -0.06 0.20 -0.06 0.00 -0.00 0.00 0.00 57.50 57.58 2c9b n TRP 27 Cb 0.44 -2.57 0.01 0.00 -0.00 0.00 0.00 31.31 29.18 2c9b n TRP 27 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 177.69 178.41 2c9b n HIS 28 N 4.57 -2.97 -0.10 5.87 8.25 -1.26 -4.44 115.22 125.13 2c9b n HIS 28 Ca 0.19 1.19 -0.09 0.00 -0.26 0.00 0.00 57.72 58.75 2c9b n HIS 28 Cb 0.28 -3.75 -0.01 0.00 1.12 0.00 0.00 29.99 27.62 2c9b n HIS 28 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 2c9b h GLY 29 N 1.56 0.48 0.64 -1.41 0.00 -1.89 -2.82 103.07 99.63 2c9b h GLY 29 Ca 0.00 -0.21 0.06 0.00 0.00 0.00 0.00 47.33 47.19 2c9b h GLY 29 CO 0.18 0.20 0.32 1.70 0.00 0.00 0.00 176.54 178.95 2c9b h LYS 30 N 0.42 0.58 -0.13 4.80 3.11 -1.93 -2.21 116.57 121.20 2c9b h LYS 30 Ca 0.12 -0.03 -0.21 0.00 -2.81 0.00 0.00 60.65 57.71 2c9b h LYS 30 Cb 0.02 -0.13 0.01 0.00 -1.00 0.00 0.00 32.23 31.13 2c9b h LYS 30 CO -0.02 0.38 -0.77 0.82 -2.81 0.00 0.00 179.45 177.05 2c9b h ILE 31 N 0.59 1.30 -0.95 2.00 2.04 -1.93 -3.10 117.51 117.46 2c9b h ILE 31 Ca 0.28 -2.02 0.00 0.00 1.00 0.00 0.00 64.86 64.13 2c9b h ILE 31 Cb 0.21 2.01 -0.05 0.00 -0.74 0.00 0.00 36.82 38.26 2c9b h ILE 31 CO -0.20 0.63 0.61 0.00 0.00 0.00 0.00 178.15 179.19 2c9b h ASP 33 N 1.30 0.00 -0.21 0.00 5.19 -1.45 -1.27 116.42 119.98 2c9b h ASP 33 Ca 0.35 0.00 -0.14 0.00 -0.62 0.00 0.00 57.03 56.62 2c9b h ASP 33 Cb -0.11 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.40 2c9b h ASP 33 CO -0.07 0.46 -0.41 0.00 -3.12 0.00 0.00 179.24 176.10 2c9b h ALA 34 N 1.54 0.33 0.02 3.45 0.00 -1.33 -2.62 119.26 120.65 2c9b h ALA 34 Ca -0.00 -0.46 0.01 0.00 0.00 0.00 0.00 54.91 54.46 2c9b h ALA 34 Cb 0.93 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 2c9b h ALA 34 CO 0.06 0.45 -0.08 -0.07 0.00 0.00 0.00 179.25 179.60 2c9b h LEU 35 N 0.35 -0.23 -1.36 0.00 3.38 -1.06 -2.74 115.31 113.64 2c9b h LEU 35 Ca 0.01 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 2c9b h LEU 35 Cb 1.02 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.85 2c9b h LEU 35 CO 0.09 -0.12 -0.05 0.25 0.09 0.00 0.00 178.44 178.70 2c9b h LEU 36 N -0.15 0.34 -0.10 1.67 5.85 -1.25 -2.22 115.31 119.44 2c9b h LEU 36 Ca 0.03 -0.06 -0.15 0.00 0.84 0.00 0.00 57.88 58.54 2c9b h LEU 36 Cb 0.18 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 2c9b h LEU 36 CO -0.07 0.44 -0.71 -2.24 -0.34 0.00 0.00 178.44 175.52 2c9b h ASP 37 N 0.35 0.00 -0.60 1.25 2.03 -1.44 -1.93 116.42 116.07 2c9b h ASP 37 Ca 0.08 0.00 -0.04 0.00 -0.73 0.00 0.00 57.03 56.33 2c9b h ASP 37 Cb 0.32 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 38.79 2c9b h ASP 37 CO 0.01 0.71 0.21 1.23 -1.03 0.00 0.00 179.24 180.37 2c9b h GLY 38 N 3.11 0.99 1.33 7.15 0.00 -1.12 -2.21 103.07 112.32 2c9b h GLY 38 Ca -0.01 -0.56 -0.09 0.00 0.00 0.00 0.00 47.33 46.67 2c9b h GLY 38 CO 0.09 0.53 -0.06 0.00 0.00 0.00 0.00 176.54 177.11 2c9b h ALA 39 N 1.07 1.03 -0.26 3.60 0.00 -1.34 -3.03 119.26 120.33 2c9b h ALA 39 Ca 0.20 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2c9b h ALA 39 Cb 0.25 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2c9b h ALA 39 CO -0.01 0.59 0.12 0.00 0.00 0.00 0.00 179.25 179.96 2c9b h ARG 40 N 0.74 0.37 -0.71 0.00 2.47 -1.19 -2.24 114.38 113.83 2c9b h ARG 40 Ca 0.13 -0.05 -0.03 0.00 -1.26 0.00 0.00 59.98 58.77 2c9b h ARG 40 Cb 0.53 -0.07 -0.03 0.00 -1.65 0.00 0.00 29.97 28.75 2c9b h ARG 40 CO 0.03 0.36 0.32 0.87 0.56 0.00 0.00 179.97 182.12 2c9b h LYS 41 N 0.28 1.04 0.00 0.04 1.57 -1.38 -0.72 116.57 117.40 2c9b h LYS 41 Ca 0.09 -0.17 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 2c9b h LYS 41 Cb 0.12 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.24 2c9b h LYS 41 CO -0.01 0.83 -0.03 -0.24 -0.57 0.00 0.00 179.45 179.43 2c9b h VAL 42 N 1.00 0.06 -0.02 0.50 3.04 -1.54 -1.29 116.25 117.99 2c9b h VAL 42 Ca 0.24 -0.98 -0.03 0.00 -1.01 0.00 0.00 66.70 64.92 2c9b h VAL 42 Cb 0.15 1.93 0.00 0.00 -2.01 0.00 0.00 31.29 31.36 2c9b h VAL 42 CO -0.03 0.03 -0.10 0.00 -1.01 0.00 0.00 177.57 176.47 2c9b h ALA 43 N 1.97 0.04 -0.32 3.17 0.00 -0.99 -3.02 119.26 120.12 2c9b h ALA 43 Ca -0.00 -0.36 -0.06 0.00 0.00 0.00 0.00 54.91 54.49 2c9b h ALA 43 Cb 0.93 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 2c9b h ALA 43 CO 0.00 -0.06 -0.07 0.00 0.00 0.00 0.00 179.25 179.12 2c9b h ALA 44 N 0.38 1.30 0.00 0.00 0.00 -0.89 -0.65 119.26 119.39 2c9b h ALA 44 Ca -0.01 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.57 2c9b h ALA 44 Cb 0.74 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2c9b h ALA 44 CO 0.02 0.47 -0.47 0.78 0.00 0.00 0.00 179.25 180.05 2c9b h GLY 45 N 0.88 0.00 -2.24 0.00 0.00 -1.33 -2.87 103.07 97.51 2c9b h GLY 45 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.43 2c9b h GLY 45 CO 0.02 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.56 2c9b n GLY 47 N 0.66 0.92 3.40 0.00 0.00 -1.08 -4.02 105.19 105.05 2c9b n GLY 47 Ca 0.16 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.74 2c9b n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2c9b s LEU 48 N 0.00 5.32 0.14 0.99 1.43 -0.28 -4.86 118.68 121.42 2c9b s LEU 48 Ca 0.00 -1.63 -0.11 0.00 -1.03 0.00 0.00 54.13 51.36 2c9b s LEU 48 Cb 0.00 -2.33 -0.05 0.00 0.03 0.00 0.00 46.19 43.84 2c9b s LEU 48 CO 0.00 -1.10 1.47 0.44 0.23 0.00 0.00 176.35 177.39 2c9b h ASP 49 N 9.02 1.01 -2.72 2.29 3.32 -1.85 -2.86 116.42 124.63 2c9b h ASP 49 Ca -0.16 -0.47 -0.58 0.00 0.02 0.00 0.00 57.03 55.84 2c9b h ASP 49 Cb 1.07 -0.28 -0.39 0.00 0.22 0.00 0.00 39.33 39.94 2c9b h ASP 49 CO 1.08 1.28 -0.83 -0.62 -1.72 0.00 0.00 179.24 178.42 2c9b s ASP 50 N -6.86 3.09 0.75 6.45 -1.08 -1.26 -4.83 116.67 112.93 2c9b s ASP 50 Ca -0.11 -2.20 -0.11 0.00 -0.52 0.00 0.00 52.55 49.60 2c9b s ASP 50 Cb 0.11 -0.48 0.04 0.00 -1.46 0.00 0.00 42.92 41.13 2c9b s ASP 50 CO 0.88 -0.31 1.08 -2.84 0.52 0.00 0.00 175.17 174.51 2c9b s PRO 51 N 1.02 2.48 -0.54 4.34 0.02 -1.26 -5.00 135.00 136.06 2c9b s PRO 51 Ca 0.18 0.73 -0.28 0.00 0.02 0.00 0.00 61.00 61.65 2c9b s PRO 51 Cb -0.23 -1.96 0.03 0.00 0.02 0.00 0.00 34.50 32.37 2c9b s PRO 51 CO -0.01 -1.36 1.13 0.99 -0.33 0.00 0.00 177.00 177.42 2c9b s THR 52 N -3.14 4.15 -0.23 0.99 2.01 -0.48 -4.94 115.64 114.00 2c9b s THR 52 Ca 0.59 0.92 -0.06 0.00 0.31 0.00 0.00 61.69 63.45 2c9b s THR 52 Cb -0.14 -4.65 -0.02 0.00 0.01 0.00 0.00 72.50 67.70 2c9b s THR 52 CO 0.54 -1.18 0.03 -0.69 -0.69 0.00 0.00 174.62 172.62 2c9b s VAL 53 N 4.61 3.98 -0.05 3.82 1.01 -1.26 0.10 120.40 132.62 2c9b s VAL 53 Ca 0.43 -0.29 0.06 0.00 0.00 0.00 0.00 61.98 62.18 2c9b s VAL 53 Cb -0.08 -2.84 -0.01 0.00 0.00 0.00 0.00 36.38 33.45 2c9b s VAL 53 CO 0.27 0.38 -0.22 -0.69 0.00 0.00 0.00 175.10 174.84 2c9b s VAL 54 N 1.46 1.80 -0.04 2.92 1.01 -0.12 -5.00 120.40 122.44 2c9b s VAL 54 Ca 0.05 -0.93 -0.01 0.00 0.00 0.00 0.00 61.98 61.09 2c9b s VAL 54 Cb -0.15 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.67 2c9b s VAL 54 CO 0.01 0.51 0.06 -0.13 0.00 0.00 0.00 175.10 175.55 2c9b s ARG 55 N -0.16 3.05 0.24 2.72 1.81 -1.26 -1.41 118.95 123.95 2c9b s ARG 55 Ca -0.02 -0.44 0.03 0.00 -1.72 0.00 0.00 55.73 53.58 2c9b s ARG 55 Cb -0.12 -2.86 -0.05 0.00 -0.45 0.00 0.00 34.95 31.47 2c9b s ARG 55 CO 0.02 0.67 0.01 0.14 -0.68 0.00 0.00 175.30 175.47 2c9b s VAL 56 N -1.09 0.97 -0.08 3.52 -7.23 -0.47 -4.95 120.40 111.07 2c9b s VAL 56 Ca 0.19 -2.02 -0.02 0.00 -1.81 0.00 0.00 61.98 58.32 2c9b s VAL 56 Cb -0.12 -2.40 -0.01 0.00 0.56 0.00 0.00 36.38 34.41 2c9b s VAL 56 CO 0.10 -0.27 -0.04 -0.07 -0.31 0.00 0.00 175.10 174.51 2c9b h LEU 57 N 2.44 0.00-10.06 1.32 4.07 -1.92 0.19 115.31 111.35 2c9b h LEU 57 Ca -0.38 0.00 -0.48 0.00 0.08 0.00 0.00 57.88 57.09 2c9b h LEU 57 Cb 1.23 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.94 2c9b h LEU 57 CO 0.64 0.40 -0.46 -0.83 -1.08 0.00 0.00 178.44 177.12 2c9b s GLY 58 N -3.29 1.49 0.35 0.83 0.00 -1.26 -1.86 107.32 103.58 2c9b s GLY 58 Ca -0.04 -1.45 0.07 0.00 0.00 0.00 0.00 44.72 43.31 2c9b s GLY 58 CO 0.05 -1.44 1.84 0.00 0.00 0.00 0.00 173.10 173.56 2c9b h ALA 59 N 1.28 1.36 -0.36 3.20 0.00 -1.93 -2.79 119.26 120.02 2c9b h ALA 59 Ca -0.48 -0.26 0.10 0.00 0.00 0.00 0.00 54.91 54.27 2c9b h ALA 59 Cb 1.24 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 2c9b h ALA 59 CO 0.59 0.44 0.27 0.82 0.00 0.00 0.00 179.25 181.37 2c9b h ILE 60 N 0.29 0.76 -0.03 0.00 1.08 -1.96 -1.99 117.51 115.66 2c9b h ILE 60 Ca 0.05 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.52 2c9b h ILE 60 Cb 0.49 0.81 0.00 0.00 -3.07 0.00 0.00 36.82 35.05 2c9b h ILE 60 CO 0.03 0.00 0.00 -0.62 -0.69 0.00 0.00 178.15 176.87 2c9b n GLU 61 N -4.33 1.45 0.03 2.37 4.71 -1.05 -4.20 120.64 119.62 2c9b n GLU 61 Ca 0.06 -0.66 -0.13 0.00 -0.01 0.00 0.00 57.16 56.42 2c9b n GLU 61 Cb 0.45 -1.47 -0.09 0.00 -1.01 0.00 0.00 31.44 29.32 2c9b n GLU 61 CO 0.00 0.00 0.00 0.82 0.09 0.00 0.00 177.13 178.04 2c9b h ILE 62 N 1.56 1.18 -0.78 -3.67 2.04 -1.49 -3.30 117.51 113.06 2c9b h ILE 62 Ca 0.00 -0.97 0.14 0.00 1.00 0.00 0.00 64.86 65.04 2c9b h ILE 62 Cb 0.33 1.80 -0.09 0.00 -0.74 0.00 0.00 36.82 38.11 2c9b h ILE 62 CO 0.00 0.24 0.34 -0.65 0.00 0.00 0.00 178.15 178.08 2c9b h PRO 63 N -0.54 0.48 -0.17 2.37 0.11 -1.78 -1.01 132.00 131.45 2c9b h PRO 63 Ca -0.01 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.97 2c9b h PRO 63 Cb 0.46 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.45 2c9b h PRO 63 CO 0.02 0.32 -0.35 -0.24 -0.21 0.00 0.00 178.00 177.54 2c9b h VAL 64 N 0.50 1.29 0.13 3.15 3.04 -1.84 -1.71 116.25 120.80 2c9b h VAL 64 Ca 0.43 -1.42 -0.29 0.00 -1.01 0.00 0.00 66.70 64.41 2c9b h VAL 64 Cb 0.63 1.54 0.02 0.00 -2.01 0.00 0.00 31.29 31.47 2c9b h VAL 64 CO -0.39 0.44 -1.25 0.58 -1.01 0.00 0.00 177.57 175.94 2c9b h VAL 65 N 0.31 1.37 -0.53 1.51 2.07 -1.54 -3.18 116.25 116.26 2c9b h VAL 65 Ca 0.04 -2.68 -0.03 0.00 0.82 0.00 0.00 66.70 64.84 2c9b h VAL 65 Cb 0.77 2.80 -0.03 0.00 -1.52 0.00 0.00 31.29 33.31 2c9b h VAL 65 CO 0.06 0.80 0.18 0.00 0.02 0.00 0.00 177.57 178.64 2c9b h ALA 66 N 0.42 1.34 -1.00 1.67 0.00 -1.11 -1.76 119.26 118.82 2c9b h ALA 66 Ca -0.17 -0.16 0.07 0.00 0.00 0.00 0.00 54.91 54.65 2c9b h ALA 66 Cb 1.93 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 19.44 2c9b h ALA 66 CO 0.22 0.49 0.65 0.37 0.00 0.00 0.00 179.25 180.98 2c9b h GLN 67 N 0.76 1.13 -0.18 0.00 4.15 -1.32 -0.43 115.11 119.22 2c9b h GLN 67 Ca 0.18 -0.07 -0.13 0.00 0.77 0.00 0.00 58.65 59.40 2c9b h GLN 67 Cb 0.19 -0.26 0.00 0.00 0.21 0.00 0.00 27.48 27.63 2c9b h GLN 67 CO -0.01 0.75 -0.38 1.49 -1.93 0.00 0.00 178.83 178.75 2c9b h GLU 68 N 1.17 0.57 0.00 1.69 4.57 -1.43 -3.30 114.58 117.85 2c9b h GLU 68 Ca 0.43 -0.38 -0.04 0.00 -1.18 0.00 0.00 59.36 58.20 2c9b h GLU 68 Cb 0.17 0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.81 2c9b h GLU 68 CO -0.17 0.99 -0.18 -0.07 -1.18 0.00 0.00 179.01 178.40 2c9b h LEU 69 N 0.22 0.00 -1.76 1.64 3.38 -0.89 -2.62 115.31 115.29 2c9b h LEU 69 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2c9b h LEU 69 Cb 0.98 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.73 2c9b h LEU 69 CO 0.08 0.18 0.00 0.00 0.09 0.00 0.00 178.44 178.80 2c9b h ALA 70 N 1.82 1.00 0.00 1.53 0.00 -1.16 -3.06 119.26 119.38 2c9b h ALA 70 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2c9b h ALA 70 Cb 0.65 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 2c9b h ALA 70 CO 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 179.25 179.16 2c9b h ARG 71 N 0.00 0.00 -0.07 0.00 3.08 -1.61 -3.32 114.38 112.46 2c9b h ARG 71 Ca 0.00 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 59.87 2c9b h ARG 71 Cb 0.38 0.00 -0.32 0.00 0.08 0.00 0.00 29.97 30.11 2c9b h ARG 71 CO 0.00 0.12 -0.84 0.27 -1.07 0.00 0.00 179.97 178.45 2c9b n ASN 72 N -3.39 0.49 -4.17 7.04 6.94 -1.21 -5.11 115.26 115.85 2c9b n ASN 72 Ca -0.01 -2.02 -0.15 0.00 -0.02 0.00 0.00 54.58 52.39 2c9b n ASN 72 Cb 0.30 -0.13 -0.11 0.00 -2.36 0.00 0.00 39.78 37.48 2c9b n ASN 72 CO 0.00 0.00 0.00 -1.00 -1.03 0.00 0.00 177.26 175.23 2c9b s HIS 73 N -0.61 1.05 -0.13 -2.53 3.76 -1.16 -4.98 115.29 110.70 2c9b s HIS 73 Ca 0.24 -0.61 0.15 0.00 -0.15 0.00 0.00 55.06 54.69 2c9b s HIS 73 Cb 0.30 -0.58 -0.03 0.00 1.11 0.00 0.00 32.58 33.38 2c9b s HIS 73 CO -0.11 0.00 1.20 -0.44 -0.85 0.00 0.00 174.74 174.55 2c9b h ASP 74 N 3.75 0.00 -4.25 1.40 3.32 -1.63 -3.45 116.42 115.56 2c9b h ASP 74 Ca -0.38 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.56 2c9b h ASP 74 Cb 1.19 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.52 2c9b h ASP 74 CO 0.50 0.56 -0.18 0.00 -1.72 0.00 0.00 179.24 178.40 2c9b s ALA 75 N -2.93 -1.09 -0.07 3.45 0.00 -1.08 -4.39 121.76 115.65 2c9b s ALA 75 Ca 0.01 1.05 0.05 0.00 0.00 0.00 0.00 51.96 53.07 2c9b s ALA 75 Cb 0.08 -0.48 -0.00 0.00 0.00 0.00 0.00 23.12 22.72 2c9b s ALA 75 CO 0.78 -0.24 -0.21 0.08 0.00 0.00 0.00 175.76 176.17 2c9b s VAL 76 N -0.25 1.76 -0.14 0.00 1.01 -0.96 -1.84 120.40 119.97 2c9b s VAL 76 Ca -0.04 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 61.05 2c9b s VAL 76 Cb -0.03 -1.51 -0.02 0.00 0.00 0.00 0.00 36.38 34.82 2c9b s VAL 76 CO 0.02 0.49 -0.10 -0.69 0.00 0.00 0.00 175.10 174.82 2c9b s VAL 77 N 0.13 3.26 -0.24 2.92 1.01 -0.37 -0.37 120.40 126.75 2c9b s VAL 77 Ca -0.09 -0.58 -0.04 0.00 0.00 0.00 0.00 61.98 61.26 2c9b s VAL 77 Cb -0.14 -2.39 -0.00 0.00 0.00 0.00 0.00 36.38 33.84 2c9b s VAL 77 CO 0.05 0.51 -0.01 0.00 0.00 0.00 0.00 175.10 175.64 2c9b s ALA 78 N 0.43 2.88 -0.06 5.51 0.00 -0.52 -0.68 121.76 129.32 2c9b s ALA 78 Ca -0.08 -1.23 0.06 0.00 0.00 0.00 0.00 51.96 50.70 2c9b s ALA 78 Cb -0.15 -1.81 -0.01 0.00 0.00 0.00 0.00 23.12 21.15 2c9b s ALA 78 CO 0.04 -0.54 -0.24 -0.51 0.00 0.00 0.00 175.76 174.51 2c9b s LEU 79 N 1.48 2.04 0.13 0.00 1.43 -0.66 -0.32 118.68 122.78 2c9b s LEU 79 Ca 0.05 -0.49 -0.24 0.00 -1.03 0.00 0.00 54.13 52.42 2c9b s LEU 79 Cb -0.15 -1.31 0.08 0.00 0.03 0.00 0.00 46.19 44.85 2c9b s LEU 79 CO -0.02 0.22 1.10 -0.83 0.23 0.00 0.00 176.35 177.05 2c9b s GLY 80 N -0.07 0.01 -0.04 -3.19 0.00 -1.22 -0.50 107.32 102.30 2c9b s GLY 80 Ca -0.05 -0.16 0.01 0.00 0.00 0.00 0.00 44.72 44.51 2c9b s GLY 80 CO 0.04 2.80 -0.02 0.14 0.00 0.00 0.00 173.10 176.06 2c9b s VAL 81 N -2.23 0.38 -0.14 1.40 1.01 -1.26 -0.29 120.40 119.26 2c9b s VAL 81 Ca 0.22 -0.02 -0.00 0.00 0.00 0.00 0.00 61.98 62.18 2c9b s VAL 81 Cb -0.02 -0.44 0.03 0.00 0.00 0.00 0.00 36.38 35.95 2c9b s VAL 81 CO 0.03 0.19 -0.09 -0.69 0.00 0.00 0.00 175.10 174.54 2c9b s VAL 82 N 1.03 1.24 -0.02 2.92 1.01 0.42 -4.86 120.40 122.14 2c9b s VAL 82 Ca -0.10 -0.50 0.06 0.00 0.00 0.00 0.00 61.98 61.44 2c9b s VAL 82 Cb -0.14 -1.26 -0.03 0.00 0.00 0.00 0.00 36.38 34.96 2c9b s VAL 82 CO -0.01 0.34 -0.19 -0.63 0.00 0.00 0.00 175.10 174.61 2c9b s ILE 83 N 1.61 2.65 0.22 2.22 1.01 -1.26 -2.39 121.20 125.26 2c9b s ILE 83 Ca 0.04 -0.95 -0.30 0.00 0.00 0.00 0.00 60.65 59.44 2c9b s ILE 83 Cb -0.13 -2.02 -0.08 0.00 0.01 0.00 0.00 42.46 40.24 2c9b s ILE 83 CO -0.09 0.54 1.05 -0.60 0.00 0.00 0.00 174.94 175.84 2c9b s ARG 84 N -0.83 4.68 0.00 2.79 3.52 -1.15 -4.88 118.95 123.08 2c9b s ARG 84 Ca 0.12 1.67 0.00 0.00 -0.13 0.00 0.00 55.73 57.39 2c9b s ARG 84 Cb -0.10 -3.26 0.00 0.00 -1.56 0.00 0.00 34.95 30.03 2c9b s ARG 84 CO 0.01 0.24 0.00 0.41 -0.81 0.00 0.00 175.30 175.15 2c9b n GLY 85 N 1.64 4.96 0.06 8.12 0.00 -1.26 -4.91 105.19 113.80 2c9b n GLY 85 Ca 0.00 -1.89 0.13 0.00 0.00 0.00 0.00 46.02 44.27 2c9b n GLY 85 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2c9b n GLN 86 N 0.00 0.29 -4.40 1.61 3.00 -1.26 -4.90 117.38 111.72 2c9b n GLN 86 Ca 0.00 -0.13 -0.26 0.00 -0.01 0.00 0.00 57.00 56.60 2c9b n GLN 86 Cb 0.00 -1.50 -0.11 0.00 0.00 0.00 0.00 30.24 28.64 2c9b n GLN 86 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.06 178.01 2c9b s THR 87 N -2.80 2.60 -1.95 5.09 -4.23 -1.26 -5.01 115.64 108.08 2c9b s THR 87 Ca 0.18 -2.06 0.00 0.00 -1.18 0.00 0.00 61.69 58.63 2c9b s THR 87 Cb 0.19 -2.30 0.00 0.00 1.34 0.00 0.00 72.50 71.73 2c9b s THR 87 CO 0.58 -0.21 0.15 -2.65 -0.54 0.00 0.00 174.62 171.96 2c9b n PRO 88 N -0.09 0.16 0.04 3.99 -0.02 -1.26 -3.68 135.00 134.15 2c9b n PRO 88 Ca -0.10 0.00 0.04 0.00 -2.02 0.00 0.00 63.50 61.43 2c9b n PRO 88 Cb 0.57 -1.00 0.46 0.00 -0.02 0.00 0.00 33.50 33.50 2c9b n PRO 88 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2c9b h HIS 89 N 0.04 0.43 -0.55 6.00 2.76 -1.95 -2.75 115.15 119.12 2c9b h HIS 89 Ca 0.00 0.01 0.09 0.00 -2.20 0.00 0.00 60.37 58.27 2c9b h HIS 89 Cb 0.00 -0.14 -0.07 0.00 1.55 0.00 0.00 27.41 28.75 2c9b h HIS 89 CO 0.00 0.28 0.17 0.35 -1.30 0.00 0.00 177.93 177.42 2c9b h PHE 90 N 0.46 0.28 -0.80 5.26 3.57 -1.90 -2.78 116.94 121.03 2c9b h PHE 90 Ca 0.12 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.64 2c9b h PHE 90 Cb -0.04 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 38.62 2c9b h PHE 90 CO 0.00 0.05 0.46 -0.44 -2.23 0.00 0.00 178.31 176.15 2c9b h ASP 91 N 0.33 0.98 1.08 0.41 3.32 -1.80 -2.90 116.42 117.83 2c9b h ASP 91 Ca 0.28 -0.07 -0.19 0.00 0.02 0.00 0.00 57.03 57.07 2c9b h ASP 91 Cb 0.36 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.63 2c9b h ASP 91 CO -0.31 0.78 -0.89 1.88 -1.72 0.00 0.00 179.24 178.97 2c9b h TYR 92 N 1.12 0.00 -0.36 4.55 0.05 -1.59 -1.78 116.97 118.95 2c9b h TYR 92 Ca 0.29 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 59.04 2c9b h TYR 92 Cb -0.00 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.72 2c9b h TYR 92 CO 0.01 0.89 0.10 0.28 -1.05 0.00 0.00 178.16 178.40 2c9b h VAL 93 N 0.00 1.21 -0.53 -2.88 2.07 -1.43 -2.41 116.25 112.29 2c9b h VAL 93 Ca -0.01 -0.71 -0.08 0.00 0.82 0.00 0.00 66.70 66.72 2c9b h VAL 93 Cb 1.68 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 32.42 2c9b h VAL 93 CO 0.12 0.24 -0.01 0.00 0.02 0.00 0.00 177.57 177.94 2c9b h ASP 95 N 0.83 0.67 -0.21 0.00 5.19 -1.20 -0.66 116.42 121.03 2c9b h ASP 95 Ca 0.15 -0.08 -0.00 0.00 -0.62 0.00 0.00 57.03 56.48 2c9b h ASP 95 Cb 0.51 -0.17 -0.01 0.00 0.18 0.00 0.00 39.33 39.84 2c9b h ASP 95 CO 0.03 0.56 0.12 0.00 -3.12 0.00 0.00 179.24 176.82 2c9b h ALA 96 N 1.14 0.28 -0.86 3.45 0.00 -1.39 -1.91 119.26 119.96 2c9b h ALA 96 Ca 0.19 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.05 2c9b h ALA 96 Cb 0.03 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 2c9b h ALA 96 CO -0.03 -0.19 0.57 0.28 0.00 0.00 0.00 179.25 179.87 2c9b h VAL 97 N 0.24 1.21 0.27 0.00 2.07 -1.29 -0.79 116.25 117.96 2c9b h VAL 97 Ca 0.08 -0.40 -0.01 0.00 0.82 0.00 0.00 66.70 67.19 2c9b h VAL 97 Cb 0.06 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 29.79 2c9b h VAL 97 CO -0.01 0.21 -0.13 0.74 0.02 0.00 0.00 177.57 178.40 2c9b h THR 98 N 1.16 0.74 -0.29 2.57 2.02 -0.95 -2.84 112.91 115.32 2c9b h THR 98 Ca 0.32 -0.07 -0.09 0.00 0.77 0.00 0.00 66.41 67.34 2c9b h THR 98 Cb -0.12 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 67.06 2c9b h THR 98 CO -0.07 0.02 -0.21 1.56 0.37 0.00 0.00 175.52 177.18 2c9b h GLN 99 N -0.40 0.55 0.46 6.66 4.20 -1.16 -2.93 115.11 122.47 2c9b h GLN 99 Ca -0.04 -0.19 -0.02 0.00 0.06 0.00 0.00 58.65 58.46 2c9b h GLN 99 Cb 0.31 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.05 2c9b h GLN 99 CO 0.06 0.72 -0.22 0.78 -0.67 0.00 0.00 178.83 179.50 2c9b h GLY 100 N 0.99 -0.64 1.47 3.46 0.00 -1.14 -2.56 103.07 104.65 2c9b h GLY 100 Ca 0.08 0.24 -0.03 0.00 0.00 0.00 0.00 47.33 47.62 2c9b h GLY 100 CO 0.04 -0.23 0.18 1.41 0.00 0.00 0.00 176.54 177.94 2c9b h LEU 101 N -1.05 0.62 -0.82 3.11 3.38 -1.60 0.90 115.31 119.85 2c9b h LEU 101 Ca -0.06 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 57.80 2c9b h LEU 101 Cb 0.56 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.11 2c9b h LEU 101 CO 0.10 0.57 0.37 0.74 0.09 0.00 0.00 178.44 180.31 2c9b h THR 102 N 0.67 1.26 0.00 0.22 2.02 -1.61 -1.55 112.91 113.93 2c9b h THR 102 Ca 0.16 -0.77 -0.12 0.00 0.77 0.00 0.00 66.41 66.46 2c9b h THR 102 Cb 0.16 0.24 -0.02 0.00 -1.74 0.00 0.00 68.15 66.79 2c9b h THR 102 CO -0.01 0.32 -0.56 -0.09 0.37 0.00 0.00 175.52 175.55 2c9b h ARG 103 N 1.17 0.00 0.03 6.66 2.43 -0.82 -3.17 114.38 120.68 2c9b h ARG 103 Ca 0.28 0.00 -0.25 0.00 -0.81 0.00 0.00 59.98 59.19 2c9b h ARG 103 Cb 0.16 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.72 2c9b h ARG 103 CO -0.03 0.56 -1.04 0.28 -1.51 0.00 0.00 179.97 178.22 2c9b h VAL 104 N 0.00 1.36 -0.35 0.20 2.07 -0.70 -2.78 116.25 116.04 2c9b h VAL 104 Ca -0.01 -2.44 -0.07 0.00 0.82 0.00 0.00 66.70 65.00 2c9b h VAL 104 Cb 1.34 2.49 -0.02 0.00 -1.52 0.00 0.00 31.29 33.58 2c9b h VAL 104 CO 0.07 0.74 -0.08 0.77 0.02 0.00 0.00 177.57 179.09 2c9b h SER 105 N 0.27 0.57 0.77 0.57 4.64 -1.34 -3.00 113.55 116.04 2c9b h SER 105 Ca -0.12 -0.14 -0.19 0.00 -0.47 0.00 0.00 61.79 60.87 2c9b h SER 105 Cb 1.70 -0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 63.60 2c9b h SER 105 CO 0.19 0.70 -1.34 -0.07 -0.87 0.00 0.00 176.83 175.44 2c9b h LEU 106 N 0.55 0.00 -0.30 5.97 3.38 -1.61 -2.00 115.31 121.30 2c9b h LEU 106 Ca 0.10 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.89 2c9b h LEU 106 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 2c9b h LEU 106 CO 0.03 0.67 -0.54 0.44 0.09 0.00 0.00 178.44 179.13 2c9b h ASP 107 N 0.00 0.99 -0.18 -0.43 3.45 -1.52 -3.33 116.42 115.40 2c9b h ASP 107 Ca -0.16 -0.53 0.00 0.00 0.43 0.00 0.00 57.03 56.78 2c9b h ASP 107 Cb 1.65 -0.28 0.00 0.00 -0.56 0.00 0.00 39.33 40.14 2c9b h ASP 107 CO 0.06 1.33 0.00 -1.54 -1.57 0.00 0.00 179.24 177.52 2c9b n SER 108 N -4.01 2.97 -4.11 6.45 3.41 -1.13 -4.98 113.62 112.22 2c9b n SER 108 Ca -0.04 -1.90 -0.32 0.00 -0.26 0.00 0.00 58.87 56.35 2c9b n SER 108 Cb 0.63 -0.11 -0.02 0.00 -0.26 0.00 0.00 64.21 64.45 2c9b n SER 108 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2c9b n SER 109 N 1.22 -2.50 -4.10 4.04 7.64 -0.81 -4.98 113.62 114.14 2c9b n SER 109 Ca 0.14 -0.99 -0.26 0.00 1.01 0.00 0.00 58.87 58.78 2c9b n SER 109 Cb 0.53 -2.96 -0.16 0.00 -1.01 0.00 0.00 64.21 60.61 2c9b n SER 109 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2c9b s THR 110 N -3.51 1.36 0.15 0.44 2.01 -0.87 -5.05 115.64 110.17 2c9b s THR 110 Ca 0.50 -0.66 -0.31 0.00 0.31 0.00 0.00 61.69 61.53 2c9b s THR 110 Cb -0.27 -1.19 -0.09 0.00 0.01 0.00 0.00 72.50 70.96 2c9b s THR 110 CO 0.91 0.40 1.54 -2.16 -0.69 0.00 0.00 174.62 174.61 2c9b s PRO 111 N 0.25 4.23 -0.34 4.92 0.04 -1.26 -4.37 135.00 138.47 2c9b s PRO 111 Ca -0.08 2.30 0.02 0.00 0.04 0.00 0.00 61.00 63.28 2c9b s PRO 111 Cb -0.13 -3.20 0.09 0.00 0.04 0.00 0.00 34.50 31.30 2c9b s PRO 111 CO 0.03 -0.58 0.05 0.42 0.04 0.00 0.00 177.00 176.96 2c9b s ILE 112 N 1.24 2.48 0.14 0.56 -1.09 -1.26 -2.27 121.20 121.00 2c9b s ILE 112 Ca 0.69 -2.14 -0.31 0.00 -2.23 0.00 0.00 60.65 56.67 2c9b s ILE 112 Cb -0.42 -2.73 -0.08 0.00 -1.58 0.00 0.00 42.46 37.65 2c9b s ILE 112 CO 0.31 -0.50 1.30 0.00 -1.23 0.00 0.00 174.94 174.82 2c9b s ALA 113 N 0.99 3.51 -0.91 9.38 0.00 0.51 -4.93 121.76 130.31 2c9b s ALA 113 Ca 0.07 1.04 -0.16 0.00 0.00 0.00 0.00 51.96 52.91 2c9b s ALA 113 Cb -0.20 -3.49 0.17 0.00 0.00 0.00 0.00 23.12 19.61 2c9b s ALA 113 CO -0.06 -0.52 1.01 1.21 0.00 0.00 0.00 175.76 177.39 2c9b s ASN 114 N 0.73 6.73 -0.31 0.00 2.47 -1.26 -1.44 114.94 121.85 2c9b s ASN 114 Ca 0.59 -2.39 0.10 0.00 0.42 0.00 0.00 52.86 51.59 2c9b s ASN 114 Cb -0.35 -2.32 0.63 0.00 -1.45 0.00 0.00 41.25 37.76 2c9b s ASN 114 CO 0.33 -0.84 1.66 0.61 -3.72 0.00 0.00 177.10 175.15 2c9b n GLY 115 N 4.77 4.22 3.65 1.21 0.00 0.57 -4.95 105.19 114.65 2c9b n GLY 115 Ca 0.21 -1.09 -0.42 0.00 0.00 0.00 0.00 46.02 44.73 2c9b n GLY 115 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c9b s VAL 116 N -3.09 4.85 0.14 1.61 1.01 -1.15 -3.41 120.40 120.37 2c9b s VAL 116 Ca 0.50 1.58 -0.29 0.00 0.00 0.00 0.00 61.98 63.77 2c9b s VAL 116 Cb 0.42 -4.12 -0.07 0.00 0.00 0.00 0.00 36.38 32.61 2c9b s VAL 116 CO 0.08 -0.04 0.92 -0.76 0.00 0.00 0.00 175.10 175.31 2c9b s LEU 117 N 2.59 4.54 -0.25 3.92 1.43 0.60 -4.90 118.68 126.62 2c9b s LEU 117 Ca 0.36 1.78 -0.01 0.00 -1.03 0.00 0.00 54.13 55.23 2c9b s LEU 117 Cb -0.16 -3.53 0.07 0.00 0.03 0.00 0.00 46.19 42.61 2c9b s LEU 117 CO 0.09 0.02 0.03 0.42 0.23 0.00 0.00 176.35 177.14 2c9b s THR 118 N -0.39 1.01 0.31 5.49 -4.23 -1.26 -0.44 115.64 116.13 2c9b s THR 118 Ca 0.44 -1.08 0.05 0.00 -1.18 0.00 0.00 61.69 59.91 2c9b s THR 118 Cb -0.24 -1.52 -0.06 0.00 1.34 0.00 0.00 72.50 72.02 2c9b s THR 118 CO 0.29 -0.32 0.02 0.42 -0.54 0.00 0.00 174.62 174.49 2c9b s THR 119 N 1.61 1.33 -0.18 3.99 -4.23 -1.01 -5.04 115.64 112.12 2c9b s THR 119 Ca 0.01 -2.03 -0.19 0.00 -1.18 0.00 0.00 61.69 58.31 2c9b s THR 119 Cb -0.18 -2.69 -0.15 0.00 1.34 0.00 0.00 72.50 70.81 2c9b s THR 119 CO -0.12 -0.09 0.20 0.78 -0.54 0.00 0.00 174.62 174.84 2c9b h ASN 120 N 2.16 0.00 -1.95 3.99 2.35 -1.94 -3.04 115.58 117.15 2c9b h ASN 120 Ca -0.41 -0.44 -0.51 0.00 -0.55 0.00 0.00 56.30 54.39 2c9b h ASN 120 Cb 1.24 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 39.56 2c9b h ASN 120 CO 0.69 1.19 -0.50 0.42 -1.65 0.00 0.00 177.43 177.58 2c9b s THR 121 N -2.26 3.57 0.27 2.81 -4.23 -1.26 -3.90 115.64 110.64 2c9b s THR 121 Ca -0.22 -1.50 0.10 0.00 -1.18 0.00 0.00 61.69 58.89 2c9b s THR 121 Cb 0.03 -3.15 -0.03 0.00 1.34 0.00 0.00 72.50 70.70 2c9b s THR 121 CO 0.48 -0.22 1.60 -0.08 -0.54 0.00 0.00 174.62 175.87 2c9b h GLU 122 N 1.42 0.02 -0.21 3.99 4.81 -1.96 -3.03 114.58 119.61 2c9b h GLU 122 Ca -0.45 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 58.72 2c9b h GLU 122 Cb 1.25 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.62 2c9b h GLU 122 CO 0.60 0.64 -0.04 1.49 -0.73 0.00 0.00 179.01 180.97 2c9b h GLU 123 N 0.02 0.32 -0.21 1.92 4.81 -2.00 -2.19 114.58 117.25 2c9b h GLU 123 Ca -0.01 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.14 2c9b h GLU 123 Cb 1.10 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.42 2c9b h GLU 123 CO 0.08 0.38 0.06 1.96 -0.73 0.00 0.00 179.01 180.76 2c9b h GLN 124 N 0.31 0.34 0.00 1.92 4.20 -1.96 -2.37 115.11 117.55 2c9b h GLN 124 Ca 0.07 -0.08 -0.06 0.00 0.06 0.00 0.00 58.65 58.64 2c9b h GLN 124 Cb 0.28 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.01 2c9b h GLN 124 CO 0.01 0.45 -0.28 0.00 -0.67 0.00 0.00 178.83 178.34 2c9b h ALA 125 N 0.87 1.47 -0.27 3.87 0.00 -1.49 -2.29 119.26 121.42 2c9b h ALA 125 Ca 0.07 -0.26 -0.18 0.00 0.00 0.00 0.00 54.91 54.54 2c9b h ALA 125 Cb 0.26 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2c9b h ALA 125 CO -0.00 0.36 -0.54 -0.07 0.00 0.00 0.00 179.25 179.00 2c9b h LEU 126 N 0.00 0.94 -1.37 0.00 3.38 -1.37 -3.25 115.31 113.64 2c9b h LEU 126 Ca -0.00 -0.54 0.00 0.00 0.09 0.00 0.00 57.88 57.43 2c9b h LEU 126 Cb 0.52 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2c9b h LEU 126 CO 0.04 1.30 0.00 -0.78 0.09 0.00 0.00 178.44 179.09 2c9b h ASP 127 N 0.61 0.00 -0.39 -0.43 3.58 -0.86 -2.51 116.42 116.42 2c9b h ASP 127 Ca 0.01 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.46 2c9b h ASP 127 Cb 1.15 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.20 2c9b h ASP 127 CO 0.12 0.00 0.00 0.54 -2.88 0.00 0.00 179.24 177.02 2c9b n ARG 128 N -2.68 2.92 0.07 0.28 1.74 -1.08 -1.84 116.66 116.06 2c9b n ARG 128 Ca 0.00 -2.25 0.11 0.00 -0.77 0.00 0.00 57.85 54.94 2c9b n ARG 128 Cb 0.22 -1.40 -0.06 0.00 -1.02 0.00 0.00 32.46 30.20 2c9b n ARG 128 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2c9b n ALA 129 N 0.51 2.60 -1.02 7.54 0.00 -0.95 -2.29 120.51 126.91 2c9b n ALA 129 Ca 0.15 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.25 2c9b n ALA 129 Cb 0.53 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.99 2c9b n ALA 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c9b n GLY 130 N 1.21 1.14 3.88 0.00 0.00 -1.17 -3.97 105.19 106.29 2c9b n GLY 130 Ca -0.02 -0.38 -0.30 0.00 0.00 0.00 0.00 46.02 45.33 2c9b n GLY 130 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2c9b s LEU 131 N -0.18 3.50 0.18 0.99 1.43 -1.26 -4.93 118.68 118.41 2c9b s LEU 131 Ca 0.00 1.20 0.03 0.00 -1.03 0.00 0.00 54.13 54.33 2c9b s LEU 131 Cb 0.00 -4.18 0.49 0.00 0.03 0.00 0.00 46.19 42.53 2c9b s LEU 131 CO 0.00 -0.67 0.87 -2.65 0.23 0.00 0.00 176.35 174.13 2c9b n PRO 132 N -2.27 -0.04 -0.39 1.29 -0.02 -1.26 -0.51 135.00 131.80 2c9b n PRO 132 Ca 0.03 0.81 0.08 0.00 -2.02 0.00 0.00 63.50 62.40 2c9b n PRO 132 Cb 0.54 -1.33 0.17 0.00 -0.02 0.00 0.00 33.50 32.87 2c9b n PRO 132 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2c9b n THR 133 N -4.58 1.99 -2.25 3.45 -2.24 -1.26 -5.05 114.28 104.33 2c9b n THR 133 Ca 0.15 -2.72 -0.28 0.00 -2.27 0.00 0.00 64.05 58.92 2c9b n THR 133 Cb 0.49 -0.20 0.02 0.00 -2.10 0.00 0.00 70.33 68.54 2c9b n THR 133 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2c9b s SER 134 N -3.02 5.86 -0.03 3.42 1.04 0.33 -5.03 113.70 116.27 2c9b s SER 134 Ca 0.35 0.99 -0.23 0.00 0.48 0.00 0.00 55.95 57.53 2c9b s SER 134 Cb 0.32 -2.04 -0.17 0.00 0.10 0.00 0.00 66.02 64.23 2c9b s SER 134 CO -0.03 -0.95 1.04 0.00 0.98 0.00 0.00 173.24 174.28 2c9b h ALA 135 N -0.20 -0.19 -2.81 5.32 0.00 -1.68 -3.46 119.26 116.23 2c9b h ALA 135 Ca -0.45 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.14 2c9b h ALA 135 Cb 1.23 0.07 -0.10 0.00 0.00 0.00 0.00 17.79 19.00 2c9b h ALA 135 CO 0.62 -0.33 -0.17 -1.83 0.00 0.00 0.00 179.25 177.54 2c9b s GLU 136 N -3.84 1.53 -0.27 0.00 4.04 -1.18 -5.08 118.70 113.90 2c9b s GLU 136 Ca -0.14 -1.30 0.02 0.00 0.04 0.00 0.00 54.97 53.59 2c9b s GLU 136 Cb 0.01 0.45 0.07 0.00 0.02 0.00 0.00 34.13 34.68 2c9b s GLU 136 CO 0.55 -0.63 -0.06 0.34 -1.84 0.00 0.00 175.26 173.62 2c9b s ASP 137 N -3.04 4.34 0.47 0.83 -1.08 -1.26 -3.05 116.67 113.89 2c9b s ASP 137 Ca 0.24 -1.49 0.27 0.00 -0.52 0.00 0.00 52.55 51.04 2c9b s ASP 137 Cb 0.00 -1.45 0.68 0.00 -1.46 0.00 0.00 42.92 40.70 2c9b s ASP 137 CO 0.10 -0.25 1.73 0.11 0.52 0.00 0.00 175.17 177.39 2c9b h LYS 138 N 7.80 0.00 -0.50 4.34 1.79 -1.74 -2.96 116.57 125.30 2c9b h LYS 138 Ca -0.16 0.00 -0.10 0.00 -2.18 0.00 0.00 60.65 58.21 2c9b h LYS 138 Cb 1.04 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.67 2c9b h LYS 138 CO 0.46 0.00 -0.09 0.78 -1.08 0.00 0.00 179.45 179.52 2c9b h GLY 139 N 3.36 0.99 1.23 3.86 0.00 -1.82 -1.25 103.07 109.43 2c9b h GLY 139 Ca 0.00 -0.76 -0.24 0.00 0.00 0.00 0.00 47.33 46.34 2c9b h GLY 139 CO 0.00 0.69 -0.87 0.00 0.00 0.00 0.00 176.54 176.36 2c9b h ALA 140 N 1.07 0.27 -0.70 3.60 0.00 -1.73 -3.20 119.26 118.56 2c9b h ALA 140 Ca 0.14 -0.64 0.01 0.00 0.00 0.00 0.00 54.91 54.42 2c9b h ALA 140 Cb 0.61 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 2c9b h ALA 140 CO 0.04 0.69 0.46 1.96 0.00 0.00 0.00 179.25 182.40 2c9b h GLN 141 N 0.47 0.93 -0.21 0.00 4.20 -1.41 -2.39 115.11 116.70 2c9b h GLN 141 Ca -0.08 -0.06 -0.06 0.00 0.06 0.00 0.00 58.65 58.51 2c9b h GLN 141 Cb 1.51 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 29.07 2c9b h GLN 141 CO 0.17 0.62 -0.15 0.00 -0.67 0.00 0.00 178.83 178.80 2c9b h ALA 142 N 1.25 1.36 -0.07 3.87 0.00 -1.30 -1.66 119.26 122.70 2c9b h ALA 142 Ca 0.26 -0.25 -0.17 0.00 0.00 0.00 0.00 54.91 54.74 2c9b h ALA 142 Cb -0.10 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.60 2c9b h ALA 142 CO -0.05 0.44 -0.61 1.15 0.00 0.00 0.00 179.25 180.17 2c9b h THR 143 N 0.32 1.36 -0.79 0.00 2.02 -1.50 -2.29 112.91 112.04 2c9b h THR 143 Ca 0.06 -1.95 0.06 0.00 0.77 0.00 0.00 66.41 65.35 2c9b h THR 143 Cb 0.47 2.29 -0.05 0.00 -1.74 0.00 0.00 68.15 69.12 2c9b h THR 143 CO 0.03 0.59 0.52 0.58 0.37 0.00 0.00 175.52 177.60 2c9b h VAL 144 N 0.14 1.06 -0.62 3.16 2.07 -1.31 -0.36 116.25 120.38 2c9b h VAL 144 Ca -0.06 -0.30 -0.03 0.00 0.82 0.00 0.00 66.70 67.13 2c9b h VAL 144 Cb 1.28 0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 31.12 2c9b h VAL 144 CO 0.12 0.16 0.26 0.00 0.02 0.00 0.00 177.57 178.13 2c9b h ALA 145 N 1.57 0.80 -0.09 1.67 0.00 -1.18 -2.09 119.26 119.95 2c9b h ALA 145 Ca 0.33 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.98 2c9b h ALA 145 Cb 0.19 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2c9b h ALA 145 CO -0.11 0.41 -0.34 0.00 0.00 0.00 0.00 179.25 179.20 2c9b h ALA 146 N 1.10 0.16 -0.37 0.00 0.00 -0.81 -2.88 119.26 116.46 2c9b h ALA 146 Ca 0.21 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 2c9b h ALA 146 Cb 0.19 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2c9b h ALA 146 CO -0.02 0.23 0.17 -0.07 0.00 0.00 0.00 179.25 179.56 2c9b h LEU 147 N -0.07 0.49 -0.55 0.00 3.38 -1.10 -1.22 115.31 116.25 2c9b h LEU 147 Ca -0.02 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.76 2c9b h LEU 147 Cb 0.98 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 2c9b h LEU 147 CO 0.07 0.49 0.12 0.00 0.09 0.00 0.00 178.44 179.21 2c9b h ALA 148 N 1.02 0.72 -0.41 1.53 0.00 -1.48 -1.06 119.26 119.58 2c9b h ALA 148 Ca 0.13 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 2c9b h ALA 148 Cb 0.13 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2c9b h ALA 148 CO -0.02 0.43 -0.22 1.15 0.00 0.00 0.00 179.25 180.59 2c9b h THR 149 N 0.78 1.27 -0.37 0.00 2.02 -1.42 0.33 112.91 115.52 2c9b h THR 149 Ca 0.17 -1.34 -0.00 0.00 0.77 0.00 0.00 66.41 66.01 2c9b h THR 149 Cb 0.35 1.19 -0.02 0.00 -1.74 0.00 0.00 68.15 67.93 2c9b h THR 149 CO 0.00 0.45 0.23 0.00 0.37 0.00 0.00 175.52 176.57 2c9b h ALA 150 N 1.03 0.47 0.00 6.16 0.00 -1.10 -0.86 119.26 124.96 2c9b h ALA 150 Ca 0.10 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 2c9b h ALA 150 Cb 0.75 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2c9b h ALA 150 CO 0.06 -0.04 -0.21 -0.07 0.00 0.00 0.00 179.25 178.99 2c9b h LEU 151 N 0.49 0.00 -0.09 0.00 3.38 -0.92 -1.91 115.31 116.26 2c9b h LEU 151 Ca 0.13 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.01 2c9b h LEU 151 Cb -0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 2c9b h LEU 151 CO -0.03 0.21 -0.31 0.74 0.09 0.00 0.00 178.44 179.14 2c9b h THR 152 N 0.00 1.41 0.00 0.22 2.02 -0.56 -3.10 112.91 112.90 2c9b h THR 152 Ca -0.00 -1.67 -0.05 0.00 0.77 0.00 0.00 66.41 65.45 2c9b h THR 152 Cb 0.43 2.24 -0.01 0.00 -1.74 0.00 0.00 68.15 69.07 2c9b h THR 152 CO 0.03 0.49 -0.24 -0.07 0.37 0.00 0.00 175.52 176.10 2c9b h LEU 153 N -0.09 0.00 -0.31 2.58 3.38 -0.95 -2.51 115.31 117.40 2c9b h LEU 153 Ca -0.01 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 2c9b h LEU 153 Cb 0.95 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.68 2c9b h LEU 153 CO 0.07 0.24 0.04 -0.09 0.09 0.00 0.00 178.44 178.78 2c9b h ARG 154 N 0.00 0.53 -0.01 1.13 2.43 -1.38 -1.92 114.38 115.17 2c9b h ARG 154 Ca -0.00 -0.15 -0.12 0.00 -0.81 0.00 0.00 59.98 58.90 2c9b h ARG 154 Cb 0.46 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.94 2c9b h ARG 154 CO 0.03 0.64 -0.57 1.49 -1.51 0.00 0.00 179.97 180.05 2c9b h GLU 155 N 0.35 0.03 -0.02 0.20 4.57 -1.42 -3.18 114.58 115.10 2c9b h GLU 155 Ca 0.09 -0.02 -0.25 0.00 -1.18 0.00 0.00 59.36 58.01 2c9b h GLU 155 Cb 0.37 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 28.98 2c9b h GLU 155 CO 0.01 0.58 -0.98 -0.07 -1.18 0.00 0.00 179.01 177.38 2c9b h LEU 156 N 0.02 0.80 0.00 1.64 3.38 -1.43 -3.47 115.31 116.24 2c9b h LEU 156 Ca -0.01 -0.62 -0.19 0.00 0.09 0.00 0.00 57.88 57.15 2c9b h LEU 156 Cb 1.01 -0.24 0.08 0.00 0.09 0.00 0.00 40.66 41.60 2c9b h LEU 156 CO 0.08 1.42 0.13 0.54 0.09 0.00 0.00 178.44 180.69 2c9b n ARG 157 N -3.83 -1.23 -2.19 1.13 1.74 -0.72 -4.94 116.66 106.61 2c9b n ARG 157 Ca -0.09 -0.87 -0.43 0.00 -0.77 0.00 0.00 57.85 55.69 2c9b n ARG 157 Cb 0.85 -0.68 -0.02 0.00 -1.02 0.00 0.00 32.46 31.58 2c9b n ARG 157 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2c9b s ALA 158 N -3.54 3.57 -0.27 7.54 0.00 -1.26 -4.97 121.76 122.84 2c9b s ALA 158 Ca 0.33 0.66 -0.30 0.00 0.00 0.00 0.00 51.96 52.65 2c9b s ALA 158 Cb -0.02 -3.72 0.18 0.00 0.00 0.00 0.00 23.12 19.56 2c9b s ALA 158 CO 0.24 -1.43 1.31 -3.38 0.00 0.00 0.00 175.76 172.51 2c9b s HIS 159 N 4.06 -0.08 0.00 0.00 -3.43 -1.26 -5.12 115.29 109.46 2c9b s HIS 159 Ca 0.66 0.12 0.00 0.00 -0.80 0.00 0.00 55.06 55.04 2c9b s HIS 159 Cb -0.27 0.49 0.00 0.00 -1.43 0.00 0.00 32.58 31.37 2c9b s HIS 159 CO 0.24 -0.08 0.07 -1.13 -2.00 0.00 0.00 174.74 171.84