#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ud9 s HIS 2 N 0.00 -0.30 -0.01 0.00 5.65 0.16 -1.28 115.29 119.51 1ud9 s HIS 2 Ca 0.00 0.78 0.01 0.00 0.25 0.00 0.00 55.06 56.10 1ud9 s HIS 2 Cb 0.00 -0.16 0.01 0.00 -1.18 0.00 0.00 32.58 31.25 1ud9 s HIS 2 CO 0.00 -0.32 -0.02 0.42 -0.65 0.00 0.00 174.74 174.17 1ud9 s ILE 3 N 2.35 0.22 -0.09 0.89 1.01 -0.06 -0.49 121.20 125.04 1ud9 s ILE 3 Ca 0.02 -0.07 0.02 0.00 0.00 0.00 0.00 60.65 60.63 1ud9 s ILE 3 Cb -0.12 -0.22 0.01 0.00 0.01 0.00 0.00 42.46 42.14 1ud9 s ILE 3 CO -0.07 0.09 -0.14 -0.69 0.00 0.00 0.00 174.94 174.13 1ud9 s VAL 4 N 0.24 1.32 -0.04 2.92 1.01 0.93 -0.74 120.40 126.04 1ud9 s VAL 4 Ca -0.02 -0.56 0.05 0.00 0.00 0.00 0.00 61.98 61.45 1ud9 s VAL 4 Cb -0.05 -1.21 -0.02 0.00 0.00 0.00 0.00 36.38 35.10 1ud9 s VAL 4 CO -0.01 0.40 -0.17 -0.47 0.00 0.00 0.00 175.10 174.86 1ud9 s TYR 5 N 0.86 2.62 -0.86 5.22 5.04 -0.13 -0.95 117.35 129.14 1ud9 s TYR 5 Ca -0.10 -0.24 0.22 0.00 -2.44 0.00 0.00 57.07 54.51 1ud9 s TYR 5 Cb -0.15 -1.61 0.90 0.00 0.35 0.00 0.00 41.96 41.45 1ud9 s TYR 5 CO 0.01 0.12 1.70 -0.40 -1.34 0.00 0.00 175.55 175.64 1ud9 n ASP 6 N 2.38 0.25 -3.43 4.32 5.75 -1.26 -1.62 116.55 122.94 1ud9 n ASP 6 Ca -0.17 0.54 -0.23 0.00 -0.01 0.00 0.00 54.79 54.93 1ud9 n ASP 6 Cb 0.52 -0.60 -0.11 0.00 -1.03 0.00 0.00 41.12 39.90 1ud9 n ASP 6 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1ud9 s ASP 7 N -3.48 2.25 0.62 -1.12 -1.08 -1.24 -3.76 116.67 108.86 1ud9 s ASP 7 Ca 0.09 -1.46 0.35 0.00 -0.52 0.00 0.00 52.55 51.01 1ud9 s ASP 7 Cb 0.13 0.12 2.01 0.00 -1.46 0.00 0.00 42.92 43.71 1ud9 s ASP 7 CO 0.42 -0.34 2.27 1.62 0.52 0.00 0.00 175.17 179.66 1ud9 h VAL 8 N 5.64 0.33 -0.50 1.11 3.04 -1.11 -1.89 116.25 122.88 1ud9 h VAL 8 Ca -0.05 0.00 0.06 0.00 -1.01 0.00 0.00 66.70 65.70 1ud9 h VAL 8 Cb 1.03 0.97 -0.03 0.00 -2.01 0.00 0.00 31.29 31.25 1ud9 h VAL 8 CO 0.30 0.00 0.34 0.03 -1.01 0.00 0.00 177.57 177.23 1ud9 h ARG 9 N 0.00 0.42 -0.50 4.17 3.08 -1.83 -1.06 114.38 118.66 1ud9 h ARG 9 Ca 0.01 -0.03 -0.09 0.00 0.07 0.00 0.00 59.98 59.94 1ud9 h ARG 9 Cb 0.07 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.01 1ud9 h ARG 9 CO -0.00 0.28 -0.05 -0.44 -1.07 0.00 0.00 179.97 178.68 1ud9 h ASP 10 N 0.43 0.91 -0.64 7.04 3.32 -1.74 -1.37 116.42 124.37 1ud9 h ASP 10 Ca 0.22 -0.33 -0.07 0.00 0.02 0.00 0.00 57.03 56.86 1ud9 h ASP 10 Cb 0.31 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.59 1ud9 h ASP 10 CO -0.06 1.03 0.12 0.25 -1.72 0.00 0.00 179.24 178.86 1ud9 h LEU 11 N 0.78 1.01 -0.74 1.55 6.46 -1.46 -1.17 115.31 121.74 1ud9 h LEU 11 Ca 0.13 -0.25 0.07 0.00 -0.12 0.00 0.00 57.88 57.71 1ud9 h LEU 11 Cb 0.59 -0.27 -0.06 0.00 -0.73 0.00 0.00 40.66 40.19 1ud9 h LEU 11 CO 0.04 1.01 0.42 0.50 -0.62 0.00 0.00 178.44 179.78 1ud9 h LYS 12 N 0.98 0.72 -0.38 1.25 3.64 -1.02 -0.11 116.57 121.65 1ud9 h LYS 12 Ca 0.20 -0.04 -0.12 0.00 -1.27 0.00 0.00 60.65 59.41 1ud9 h LYS 12 Cb 0.42 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 1ud9 h LYS 12 CO 0.01 0.47 -0.24 0.00 -2.27 0.00 0.00 179.45 177.42 1ud9 h ALA 13 N 1.40 0.85 -0.18 5.00 0.00 -0.82 -1.41 119.26 124.10 1ud9 h ALA 13 Ca 0.34 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1ud9 h ALA 13 Cb 0.26 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1ud9 h ALA 13 CO -0.21 0.64 -0.00 0.82 0.00 0.00 0.00 179.25 180.49 1ud9 h ILE 14 N 0.67 1.25 -0.77 0.00 2.04 -0.67 -2.81 117.51 117.22 1ud9 h ILE 14 Ca 0.09 -0.86 -0.04 0.00 1.00 0.00 0.00 64.86 65.05 1ud9 h ILE 14 Cb 0.76 1.46 -0.04 0.00 -0.74 0.00 0.00 36.82 38.27 1ud9 h ILE 14 CO 0.06 0.26 0.34 0.40 0.00 0.00 0.00 178.15 179.21 1ud9 h ILE 15 N 0.08 1.25 -0.94 -0.67 1.08 -0.90 -0.49 117.51 116.91 1ud9 h ILE 15 Ca 0.05 -0.74 0.05 0.00 -0.39 0.00 0.00 64.86 63.83 1ud9 h ILE 15 Cb 0.39 0.29 -0.06 0.00 -3.07 0.00 0.00 36.82 34.38 1ud9 h ILE 15 CO 0.01 0.31 0.61 1.56 -0.69 0.00 0.00 178.15 179.95 1ud9 h GLN 16 N 1.10 1.10 -0.08 2.37 4.20 -1.22 -0.70 115.11 121.88 1ud9 h GLN 16 Ca 0.26 -0.07 -0.21 0.00 0.06 0.00 0.00 58.65 58.69 1ud9 h GLN 16 Cb 0.16 -0.25 0.01 0.00 0.30 0.00 0.00 27.48 27.70 1ud9 h GLN 16 CO -0.03 0.73 -0.79 0.00 -0.67 0.00 0.00 178.83 178.07 1ud9 h ALA 17 N 1.47 0.20 -0.50 3.87 0.00 -1.16 -3.31 119.26 119.84 1ud9 h ALA 17 Ca 0.39 -0.61 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1ud9 h ALA 17 Cb 0.10 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1ud9 h ALA 17 CO -0.13 0.58 0.16 -0.07 0.00 0.00 0.00 179.25 179.79 1ud9 h LEU 18 N 0.34 0.67 -1.37 0.00 3.38 -0.61 -2.39 115.31 115.33 1ud9 h LEU 18 Ca -0.08 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1ud9 h LEU 18 Cb 1.44 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 42.01 1ud9 h LEU 18 CO 0.16 0.64 0.00 0.17 0.09 0.00 0.00 178.44 179.50 1ud9 h LEU 19 N 0.72 0.00 -0.01 1.67 8.10 -1.22 -0.91 115.31 123.65 1ud9 h LEU 19 Ca 0.17 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 58.15 1ud9 h LEU 19 Cb 0.21 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.43 1ud9 h LEU 19 CO -0.01 0.00 -0.03 0.11 -4.11 0.00 0.00 178.44 174.40 1ud9 h LYS 20 N 0.00 0.00 0.03 0.17 1.79 -1.56 -3.35 116.57 113.65 1ud9 h LYS 20 Ca 0.00 0.00 -0.39 0.00 -2.18 0.00 0.00 60.65 58.08 1ud9 h LYS 20 Cb 0.37 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 30.96 1ud9 h LYS 20 CO 0.00 0.03 -2.31 1.28 -1.08 0.00 0.00 179.45 177.37 1ud9 n LEU 21 N -3.11 2.65 -4.04 2.94 4.32 -0.55 -5.06 117.00 114.15 1ud9 n LEU 21 Ca 0.04 0.06 -0.09 0.00 -0.02 0.00 0.00 56.01 56.00 1ud9 n LEU 21 Cb 0.54 -0.94 -0.11 0.00 -1.62 0.00 0.00 43.42 41.29 1ud9 n LEU 21 CO 0.34 0.81 -0.37 0.68 -1.22 0.00 0.00 177.39 177.64 1ud9 s VAL 22 N -2.52 0.24 -0.21 4.08 -7.23 -0.46 -4.37 120.40 109.94 1ud9 s VAL 22 Ca -0.33 -1.35 0.18 0.00 -1.81 0.00 0.00 61.98 58.68 1ud9 s VAL 22 Cb 0.09 -0.88 0.05 0.00 0.56 0.00 0.00 36.38 36.20 1ud9 s VAL 22 CO 0.62 -0.70 1.24 0.44 -0.31 0.00 0.00 175.10 176.38 1ud9 h ASP 23 N 3.94 0.00 -4.83 4.85 3.32 -1.85 -3.38 116.42 118.47 1ud9 h ASP 23 Ca -0.33 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.51 1ud9 h ASP 23 Cb 1.18 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.51 1ud9 h ASP 23 CO 0.52 0.35 -0.71 -1.61 -1.72 0.00 0.00 179.24 176.07 1ud9 s GLU 24 N -3.06 0.35 0.29 3.56 2.02 -1.26 -1.21 118.70 119.39 1ud9 s GLU 24 Ca 0.02 -0.60 -0.07 0.00 0.02 0.00 0.00 54.97 54.34 1ud9 s GLU 24 Cb 0.08 -0.01 -0.00 0.00 0.10 0.00 0.00 34.13 34.30 1ud9 s GLU 24 CO 0.76 -0.02 0.45 0.00 0.02 0.00 0.00 175.26 176.47 1ud9 s ALA 25 N -1.32 0.30 -0.09 5.21 0.00 -0.39 -4.91 121.76 120.57 1ud9 s ALA 25 Ca -0.13 -1.22 0.00 0.00 0.00 0.00 0.00 51.96 50.60 1ud9 s ALA 25 Cb -0.09 1.12 0.02 0.00 0.00 0.00 0.00 23.12 24.17 1ud9 s ALA 25 CO -0.01 -0.81 -0.06 -1.17 0.00 0.00 0.00 175.76 173.71 1ud9 s LEU 26 N -3.13 1.15 -0.26 0.00 2.96 -1.26 -1.10 118.68 117.05 1ud9 s LEU 26 Ca 0.27 -0.23 -0.21 0.00 -0.22 0.00 0.00 54.13 53.74 1ud9 s LEU 26 Cb 0.00 -0.70 -0.02 0.00 0.50 0.00 0.00 46.19 45.97 1ud9 s LEU 26 CO 0.14 -0.10 0.66 -0.36 -1.32 0.00 0.00 176.35 175.37 1ud9 s PHE 27 N 1.49 3.27 -0.55 5.38 2.99 0.20 -4.44 117.98 126.33 1ud9 s PHE 27 Ca -0.00 0.83 -0.20 0.00 0.00 0.00 0.00 56.93 57.56 1ud9 s PHE 27 Cb -0.13 -2.90 0.07 0.00 0.00 0.00 0.00 43.02 40.06 1ud9 s PHE 27 CO -0.05 -0.36 0.70 0.34 -0.00 0.00 0.00 175.22 175.85 1ud9 s ASP 28 N 1.48 6.22 -0.55 1.36 -1.08 0.13 -1.28 116.67 122.95 1ud9 s ASP 28 Ca 0.27 -1.03 -0.19 0.00 -0.52 0.00 0.00 52.55 51.08 1ud9 s ASP 28 Cb -0.15 -2.31 0.08 0.00 -1.46 0.00 0.00 42.92 39.07 1ud9 s ASP 28 CO 0.09 -1.03 0.67 -0.63 0.52 0.00 0.00 175.17 174.79 1ud9 s ILE 29 N 2.86 4.83 0.38 4.11 1.01 0.10 -1.41 121.20 133.07 1ud9 s ILE 29 Ca 0.16 -0.67 0.08 0.00 0.00 0.00 0.00 60.65 60.21 1ud9 s ILE 29 Cb -0.20 -4.39 -0.04 0.00 0.01 0.00 0.00 42.46 37.84 1ud9 s ILE 29 CO 0.11 -0.96 0.25 -0.54 0.00 0.00 0.00 174.94 173.79 1ud9 s LYS 30 N 2.72 2.45 0.53 2.79 1.02 -0.42 -1.21 119.74 127.62 1ud9 s LYS 30 Ca 0.14 -1.57 0.19 0.00 0.02 0.00 0.00 55.97 54.75 1ud9 s LYS 30 Cb -0.21 -2.24 1.34 0.00 -0.52 0.00 0.00 37.83 36.20 1ud9 s LYS 30 CO 0.10 -0.03 2.13 -1.35 -0.92 0.00 0.00 175.35 175.27 1ud9 h PRO 31 N 1.31 0.00 -0.00 -1.68 0.11 -1.89 -1.86 132.00 127.99 1ud9 h PRO 31 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1ud9 h PRO 31 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1ud9 h PRO 31 CO 0.62 0.00 -0.46 -0.85 -0.21 0.00 0.00 178.00 177.10 1ud9 n GLU 32 N -4.44 0.39 -2.61 1.05 0.00 -1.26 -4.77 120.64 108.99 1ud9 n GLU 32 Ca -0.00 -0.25 0.00 0.00 0.00 0.00 0.00 57.16 56.91 1ud9 n GLU 32 Cb 0.19 -1.49 0.00 0.00 0.00 0.00 0.00 31.44 30.14 1ud9 n GLU 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1ud9 n GLY 33 N 1.44 -1.22 3.62 -1.84 0.00 -0.70 -1.44 105.19 105.05 1ud9 n GLY 33 Ca 0.08 -1.52 -0.34 0.00 0.00 0.00 0.00 46.02 44.24 1ud9 n GLY 33 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ud9 s ILE 34 N -2.00 3.99 0.06 -0.61 1.01 0.81 -1.30 121.20 123.16 1ud9 s ILE 34 Ca 0.00 -0.37 0.05 0.00 0.00 0.00 0.00 60.65 60.33 1ud9 s ILE 34 Cb 0.00 -2.66 -0.03 0.00 0.01 0.00 0.00 42.46 39.79 1ud9 s ILE 34 CO 0.00 0.60 -0.15 -1.10 0.00 0.00 0.00 174.94 174.29 1ud9 s GLN 35 N -0.79 0.86 -0.13 2.79 -0.21 -0.50 -0.55 119.66 121.12 1ud9 s GLN 35 Ca 0.12 -0.91 -0.12 0.00 0.02 0.00 0.00 55.36 54.46 1ud9 s GLN 35 Cb -0.11 -0.89 0.04 0.00 1.00 0.00 0.00 33.01 33.05 1ud9 s GLN 35 CO 0.02 0.20 0.36 -1.17 -2.12 0.00 0.00 175.29 172.58 1ud9 s LEU 36 N -1.59 0.62 -0.02 2.90 0.20 -0.58 0.20 118.68 120.42 1ud9 s LEU 36 Ca -0.01 0.72 0.02 0.00 0.69 0.00 0.00 54.13 55.55 1ud9 s LEU 36 Cb -0.09 1.23 0.00 0.00 -0.43 0.00 0.00 46.19 46.90 1ud9 s LEU 36 CO 0.02 -0.13 -0.05 -0.69 -0.29 0.00 0.00 176.35 175.21 1ud9 s VAL 37 N 0.21 0.47 -0.02 1.68 1.01 -1.26 0.10 120.40 122.59 1ud9 s VAL 37 Ca -0.00 -0.20 0.00 0.00 0.00 0.00 0.00 61.98 61.79 1ud9 s VAL 37 Cb -0.03 -0.44 0.02 0.00 0.00 0.00 0.00 36.38 35.94 1ud9 s VAL 37 CO 0.00 0.16 -0.00 0.00 0.00 0.00 0.00 175.10 175.26 1ud9 s ALA 38 N 0.22 0.24 0.02 5.51 0.00 0.04 -4.51 121.76 123.28 1ud9 s ALA 38 Ca -0.02 0.09 0.07 0.00 0.00 0.00 0.00 51.96 52.09 1ud9 s ALA 38 Cb -0.07 -0.21 -0.02 0.00 0.00 0.00 0.00 23.12 22.83 1ud9 s ALA 38 CO -0.00 -0.03 -0.19 -1.50 0.00 0.00 0.00 175.76 174.03 1ud9 s ILE 39 N 0.61 1.55 0.90 0.00 2.07 -1.26 -0.52 121.20 124.55 1ud9 s ILE 39 Ca -0.06 -1.03 -0.12 0.00 -1.41 0.00 0.00 60.65 58.03 1ud9 s ILE 39 Cb -0.09 -1.33 0.13 0.00 0.13 0.00 0.00 42.46 41.30 1ud9 s ILE 39 CO -0.01 0.27 1.10 1.51 -1.91 0.00 0.00 174.94 175.90 1ud9 s ASP 40 N -0.90 3.49 0.21 4.50 1.47 -0.34 -4.84 116.67 120.26 1ud9 s ASP 40 Ca 0.07 1.31 -0.09 0.00 1.18 0.00 0.00 52.55 55.02 1ud9 s ASP 40 Cb -0.08 -1.99 0.30 0.00 -0.34 0.00 0.00 42.92 40.81 1ud9 s ASP 40 CO 0.01 -2.61 1.73 0.50 0.68 0.00 0.00 175.17 175.48 1ud9 h LYS 41 N -1.53 0.34 0.00 2.11 1.63 -1.92 -1.31 116.57 115.89 1ud9 h LYS 41 Ca -0.50 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.28 1ud9 h LYS 41 Cb 1.30 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 32.85 1ud9 h LYS 41 CO 0.57 0.22 0.00 0.00 -3.45 0.00 0.00 179.45 176.80 1ud9 n ALA 42 N -2.52 1.95 -3.82 5.00 0.00 -1.26 -4.89 120.51 114.97 1ud9 n ALA 42 Ca 0.09 -0.08 -0.28 0.00 0.00 0.00 0.00 53.44 53.17 1ud9 n ALA 42 Cb 0.31 -1.29 0.04 0.00 0.00 0.00 0.00 19.45 18.51 1ud9 n ALA 42 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1ud9 n HIS 43 N -1.29 -2.45 -0.08 0.00 8.25 -0.50 -4.91 115.22 114.24 1ud9 n HIS 43 Ca 0.08 0.94 -0.07 0.00 -0.26 0.00 0.00 57.72 58.41 1ud9 n HIS 43 Cb 0.14 -4.29 -0.14 0.00 1.12 0.00 0.00 29.99 26.83 1ud9 n HIS 43 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 1ud9 n ILE 44 N -4.76 1.07 -3.90 1.59 2.08 -1.26 -4.94 119.36 109.23 1ud9 n ILE 44 Ca 0.02 -0.70 -0.11 0.00 0.56 0.00 0.00 62.75 62.53 1ud9 n ILE 44 Cb 0.54 -0.49 -0.11 0.00 -0.75 0.00 0.00 39.64 38.84 1ud9 n ILE 44 CO 0.00 0.00 0.00 -0.94 0.56 0.00 0.00 176.55 176.17 1ud9 s SER 45 N -5.02 0.08 0.00 4.38 1.04 -1.26 -1.04 113.70 111.89 1ud9 s SER 45 Ca -0.08 -0.26 -0.09 0.00 0.48 0.00 0.00 55.95 55.99 1ud9 s SER 45 Cb 0.06 0.17 0.01 0.00 0.10 0.00 0.00 66.02 66.35 1ud9 s SER 45 CO 0.71 -0.31 0.18 -0.22 0.98 0.00 0.00 173.24 174.58 1ud9 s LEU 46 N -1.24 1.38 -0.07 2.42 0.20 -0.72 -1.20 118.68 119.44 1ud9 s LEU 46 Ca -0.13 -0.14 0.03 0.00 0.69 0.00 0.00 54.13 54.58 1ud9 s LEU 46 Cb -0.08 0.83 0.01 0.00 -0.43 0.00 0.00 46.19 46.52 1ud9 s LEU 46 CO 0.01 -0.40 -0.16 -0.63 -0.29 0.00 0.00 176.35 174.88 1ud9 s ILE 47 N -1.41 1.43 -0.04 6.68 1.01 0.32 -1.34 121.20 127.85 1ud9 s ILE 47 Ca -0.14 -0.67 0.07 0.00 0.00 0.00 0.00 60.65 59.90 1ud9 s ILE 47 Cb -0.07 -1.26 -0.01 0.00 0.01 0.00 0.00 42.46 41.13 1ud9 s ILE 47 CO 0.02 0.42 -0.24 -0.75 0.00 0.00 0.00 174.94 174.39 1ud9 s LYS 48 N 0.40 2.22 -0.04 2.79 2.20 0.72 -0.78 119.74 127.25 1ud9 s LYS 48 Ca -0.12 -0.86 0.05 0.00 -0.36 0.00 0.00 55.97 54.67 1ud9 s LYS 48 Cb -0.15 -1.99 -0.01 0.00 -1.51 0.00 0.00 37.83 34.17 1ud9 s LYS 48 CO 0.04 0.43 -0.19 0.42 -0.36 0.00 0.00 175.35 175.70 1ud9 s ILE 49 N -0.32 1.57 -0.13 5.43 1.01 0.12 -0.23 121.20 128.64 1ud9 s ILE 49 Ca 0.02 -0.80 -0.02 0.00 0.00 0.00 0.00 60.65 59.84 1ud9 s ILE 49 Cb -0.12 -1.33 0.04 0.00 0.01 0.00 0.00 42.46 41.06 1ud9 s ILE 49 CO 0.01 0.45 0.02 -1.61 0.00 0.00 0.00 174.94 173.82 1ud9 s GLU 50 N -0.09 0.57 -0.44 2.79 2.02 -0.32 -1.52 118.70 121.70 1ud9 s GLU 50 Ca -0.02 -0.13 0.03 0.00 0.02 0.00 0.00 54.97 54.88 1ud9 s GLU 50 Cb -0.11 -1.52 0.12 0.00 0.10 0.00 0.00 34.13 32.72 1ud9 s GLU 50 CO 0.02 -0.48 0.20 -0.51 0.02 0.00 0.00 175.26 174.52 1ud9 s LEU 51 N 1.94 3.62 0.82 1.80 1.43 0.29 -0.45 118.68 128.13 1ud9 s LEU 51 Ca 0.02 -2.61 -0.10 0.00 -1.03 0.00 0.00 54.13 50.41 1ud9 s LEU 51 Cb -0.15 -1.35 0.09 0.00 0.03 0.00 0.00 46.19 44.81 1ud9 s LEU 51 CO -0.07 -0.28 1.11 -2.16 0.23 0.00 0.00 176.35 175.17 1ud9 s PRO 52 N 0.30 1.84 0.44 1.29 0.05 -1.26 -0.14 135.00 137.52 1ud9 s PRO 52 Ca 0.16 1.25 0.10 0.00 0.05 0.00 0.00 61.00 62.56 1ud9 s PRO 52 Cb -0.24 -1.84 0.96 0.00 0.05 0.00 0.00 34.50 33.43 1ud9 s PRO 52 CO -0.04 -1.96 2.06 1.57 0.05 0.00 0.00 177.00 178.68 1ud9 h LYS 53 N -1.36 0.33 0.00 4.56 2.10 -1.58 -0.77 116.57 119.85 1ud9 h LYS 53 Ca -0.44 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.18 1ud9 h LYS 53 Cb 1.24 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 32.50 1ud9 h LYS 53 CO 0.49 0.26 0.03 0.93 -2.00 0.00 0.00 179.45 179.16 1ud9 h GLU 54 N 0.34 0.00 -0.02 0.07 3.07 -1.84 -1.80 114.58 114.39 1ud9 h GLU 54 Ca 0.09 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.95 1ud9 h GLU 54 Cb 0.04 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.95 1ud9 h GLU 54 CO -0.01 0.00 -0.05 0.00 -1.40 0.00 0.00 179.01 177.55 1ud9 n MET 55 N -2.31 1.77 -4.04 2.33 0.00 -0.29 -4.86 117.12 109.72 1ud9 n MET 55 Ca -0.02 -1.22 -0.31 0.00 0.00 0.00 0.00 57.70 56.15 1ud9 n MET 55 Cb 0.07 -1.47 -0.06 0.00 0.00 0.00 0.00 33.22 31.75 1ud9 n MET 55 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 175.97 175.91 1ud9 s PHE 56 N -2.07 3.28 0.21 3.17 0.40 -0.68 -4.79 117.98 117.49 1ud9 s PHE 56 Ca 0.33 0.15 -0.09 0.00 -0.60 0.00 0.00 56.93 56.71 1ud9 s PHE 56 Cb 0.20 -1.68 0.15 0.00 0.51 0.00 0.00 43.02 42.20 1ud9 s PHE 56 CO 0.35 0.54 1.80 -0.22 0.70 0.00 0.00 175.22 178.40 1ud9 h LYS 57 N 3.50 1.09 -3.86 0.44 3.64 -1.36 -3.43 116.57 116.60 1ud9 h LYS 57 Ca -0.47 -0.15 -0.26 0.00 -1.27 0.00 0.00 60.65 58.49 1ud9 h LYS 57 Cb 1.17 -0.20 -0.29 0.00 -0.41 0.00 0.00 32.23 32.50 1ud9 h LYS 57 CO 0.67 0.84 -0.73 -1.21 -2.27 0.00 0.00 179.45 176.75 1ud9 s GLU 58 N -5.73 0.11 -0.29 1.90 2.02 -1.10 -4.94 118.70 110.67 1ud9 s GLU 58 Ca -0.13 -0.03 0.02 0.00 0.02 0.00 0.00 54.97 54.85 1ud9 s GLU 58 Cb 0.15 -0.13 0.16 0.00 0.10 0.00 0.00 34.13 34.41 1ud9 s GLU 58 CO 0.81 0.01 0.42 -0.47 0.02 0.00 0.00 175.26 176.05 1ud9 s TYR 59 N 0.06 -1.03 -0.33 1.61 5.04 -1.26 -0.05 117.35 121.39 1ud9 s TYR 59 Ca -0.00 0.32 0.00 0.00 -2.44 0.00 0.00 57.07 54.96 1ud9 s TYR 59 Cb -0.02 -0.14 0.10 0.00 0.35 0.00 0.00 41.96 42.25 1ud9 s TYR 59 CO -0.00 -0.99 0.10 0.34 -1.34 0.00 0.00 175.55 173.66 1ud9 s ASP 60 N 2.53 4.13 -0.42 4.32 -1.08 0.36 -5.02 116.67 121.49 1ud9 s ASP 60 Ca 0.10 -1.85 0.02 0.00 -0.52 0.00 0.00 52.55 50.29 1ud9 s ASP 60 Cb -0.12 -1.03 0.14 0.00 -1.46 0.00 0.00 42.92 40.44 1ud9 s ASP 60 CO -0.30 -0.39 0.23 -0.69 0.52 0.00 0.00 175.17 174.54 1ud9 s VAL 61 N 1.33 1.21 0.04 1.11 1.01 -1.26 -0.67 120.40 123.18 1ud9 s VAL 61 Ca 0.11 -2.41 0.21 0.00 0.00 0.00 0.00 61.98 59.89 1ud9 s VAL 61 Cb -0.18 -1.85 0.19 0.00 0.00 0.00 0.00 36.38 34.53 1ud9 s VAL 61 CO -0.19 -0.90 1.71 1.55 0.00 0.00 0.00 175.10 177.27 1ud9 h PRO 62 N 6.80 0.00 -4.47 2.72 0.13 -1.95 -3.35 132.00 131.87 1ud9 h PRO 62 Ca -0.00 0.00 -0.39 0.00 -0.87 0.00 0.00 66.00 64.73 1ud9 h PRO 62 Cb 0.94 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 31.76 1ud9 h PRO 62 CO 0.45 0.29 -0.78 -1.21 -0.23 0.00 0.00 178.00 176.53 1ud9 s GLU 63 N -3.46 0.76 0.68 0.86 2.02 -1.26 -4.91 118.70 113.39 1ud9 s GLU 63 Ca 0.02 -0.25 -0.15 0.00 0.02 0.00 0.00 54.97 54.61 1ud9 s GLU 63 Cb 0.09 -0.73 0.01 0.00 0.10 0.00 0.00 34.13 33.61 1ud9 s GLU 63 CO 0.67 0.10 1.13 -1.83 0.02 0.00 0.00 175.26 175.35 1ud9 s GLU 64 N 0.14 2.61 -0.05 1.61 -1.05 -1.26 -4.84 118.70 115.85 1ud9 s GLU 64 Ca -0.02 1.44 -0.31 0.00 -0.15 0.00 0.00 54.97 55.94 1ud9 s GLU 64 Cb -0.07 -1.92 0.07 0.00 -0.44 0.00 0.00 34.13 31.78 1ud9 s GLU 64 CO 0.00 -1.41 0.71 -0.59 0.95 0.00 0.00 175.26 174.92 1ud9 s PHE 65 N -2.32 -0.63 -0.22 4.83 -0.12 -0.35 -5.02 117.98 114.15 1ud9 s PHE 65 Ca 0.68 1.06 -0.07 0.00 -0.05 0.00 0.00 56.93 58.55 1ud9 s PHE 65 Cb -0.22 0.42 -0.04 0.00 -0.63 0.00 0.00 43.02 42.55 1ud9 s PHE 65 CO 0.43 -0.59 0.07 0.15 -0.05 0.00 0.00 175.22 175.23 1ud9 s LYS 66 N -1.26 3.81 -0.39 1.99 1.02 -1.26 -0.72 119.74 122.93 1ud9 s LYS 66 Ca -0.10 -0.41 -0.06 0.00 0.02 0.00 0.00 55.97 55.42 1ud9 s LYS 66 Cb -0.00 -3.28 0.08 0.00 -0.52 0.00 0.00 37.83 34.11 1ud9 s LYS 66 CO 0.09 0.03 0.18 0.12 -0.92 0.00 0.00 175.35 174.85 1ud9 s PHE 67 N 1.03 3.40 0.02 3.18 5.36 -0.40 -4.97 117.98 125.59 1ud9 s PHE 67 Ca 0.04 -1.87 -0.16 0.00 -0.96 0.00 0.00 56.93 53.98 1ud9 s PHE 67 Cb -0.14 -2.84 -0.06 0.00 -0.34 0.00 0.00 43.02 39.64 1ud9 s PHE 67 CO 0.03 -0.87 0.45 0.20 -1.46 0.00 0.00 175.22 173.57 1ud9 s GLY 68 N 1.82 2.53 0.12 13.12 0.00 -1.22 -0.63 107.32 123.05 1ud9 s GLY 68 Ca 0.03 -0.15 -0.13 0.00 0.00 0.00 0.00 44.72 44.47 1ud9 s GLY 68 CO -0.01 0.24 0.33 -0.11 0.00 0.00 0.00 173.10 173.55 1ud9 s PHE 69 N -1.07 -0.06 -0.23 1.90 -0.12 -0.26 -2.82 117.98 115.32 1ud9 s PHE 69 Ca 0.25 -0.30 -0.15 0.00 -0.05 0.00 0.00 56.93 56.68 1ud9 s PHE 69 Cb -0.17 0.14 -0.04 0.00 -0.63 0.00 0.00 43.02 42.32 1ud9 s PHE 69 CO 0.15 -0.66 0.36 1.21 -0.05 0.00 0.00 175.22 176.23 1ud9 s ASN 70 N -2.83 6.34 0.23 1.98 3.84 -1.26 -1.26 114.94 121.97 1ud9 s ASN 70 Ca 0.04 0.39 -0.08 0.00 0.21 0.00 0.00 52.86 53.43 1ud9 s ASN 70 Cb 0.03 -2.21 0.20 0.00 -0.55 0.00 0.00 41.25 38.72 1ud9 s ASN 70 CO -0.11 -0.10 1.87 0.71 -2.79 0.00 0.00 177.10 176.68 1ud9 h THR 71 N 5.15 1.24 -0.10 -5.21 1.35 -1.43 -1.74 112.91 112.17 1ud9 h THR 71 Ca -0.35 -0.55 -0.13 0.00 -0.55 0.00 0.00 66.41 64.83 1ud9 h THR 71 Cb 1.16 0.03 -0.01 0.00 -1.73 0.00 0.00 68.15 67.60 1ud9 h THR 71 CO 0.69 0.26 -0.52 1.56 -0.25 0.00 0.00 175.52 177.25 1ud9 h GLN 72 N 1.20 0.29 -0.25 4.72 4.20 -1.89 0.02 115.11 123.40 1ud9 h GLN 72 Ca 0.31 -0.17 -0.01 0.00 0.06 0.00 0.00 58.65 58.84 1ud9 h GLN 72 Cb -0.03 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 1ud9 h GLN 72 CO -0.06 0.74 0.13 -0.92 -0.67 0.00 0.00 178.83 178.06 1ud9 h TYR 73 N 0.23 0.34 -0.32 2.96 3.20 -1.86 -1.94 116.97 119.58 1ud9 h TYR 73 Ca 0.01 -0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.76 1ud9 h TYR 73 Cb 1.00 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 39.15 1ud9 h TYR 73 CO 0.02 0.30 -0.23 0.52 -1.64 0.00 0.00 178.16 177.14 1ud9 h MET 74 N 0.28 0.62 -0.38 1.82 2.86 -1.11 -1.50 114.93 117.52 1ud9 h MET 74 Ca 0.09 -0.24 -0.00 0.00 -2.06 0.00 0.00 59.70 57.48 1ud9 h MET 74 Cb 0.08 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 1ud9 h MET 74 CO -0.01 0.80 0.23 1.03 1.06 0.00 0.00 176.91 180.02 1ud9 h SER 75 N 0.55 0.46 -0.36 1.22 0.87 -0.68 -0.82 113.55 114.79 1ud9 h SER 75 Ca 0.08 -0.06 -0.06 0.00 -1.23 0.00 0.00 61.79 60.52 1ud9 h SER 75 Cb 0.69 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.51 1ud9 h SER 75 CO 0.05 0.39 0.02 0.11 -0.53 0.00 0.00 176.83 176.87 1ud9 h LYS 76 N 0.50 0.72 -0.89 2.24 1.79 -1.11 -0.42 116.57 119.41 1ud9 h LYS 76 Ca 0.14 -0.17 -0.02 0.00 -2.18 0.00 0.00 60.65 58.42 1ud9 h LYS 76 Cb 0.01 -0.09 -0.04 0.00 -1.58 0.00 0.00 32.23 30.53 1ud9 h LYS 76 CO -0.03 0.72 0.48 -0.07 -1.08 0.00 0.00 179.45 179.48 1ud9 h LEU 77 N 0.68 1.11 -0.03 2.94 3.38 -0.63 -2.58 115.31 120.18 1ud9 h LEU 77 Ca 0.14 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1ud9 h LEU 77 Cb 0.39 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1ud9 h LEU 77 CO 0.01 0.89 -0.21 0.18 0.09 0.00 0.00 178.44 179.40 1ud9 n LEU 78 N -4.34 0.26 -0.30 1.67 4.77 -0.37 -4.34 117.00 114.34 1ud9 n LEU 78 Ca 0.09 0.23 0.13 0.00 -0.03 0.00 0.00 56.01 56.44 1ud9 n LEU 78 Cb 0.10 -0.36 0.29 0.00 -2.33 0.00 0.00 43.42 41.12 1ud9 n LEU 78 CO 0.39 0.06 0.91 0.50 -1.33 0.00 0.00 177.39 177.92 1ud9 h LYS 79 N 0.08 0.15 -2.28 3.23 3.64 -0.66 -1.96 116.57 118.77 1ud9 h LYS 79 Ca 0.00 -0.01 -0.70 0.00 -1.27 0.00 0.00 60.65 58.67 1ud9 h LYS 79 Cb 0.48 -0.03 -0.19 0.00 -0.41 0.00 0.00 32.23 32.07 1ud9 h LYS 79 CO 0.00 0.10 1.37 0.00 -2.27 0.00 0.00 179.45 178.65 1ud9 n ALA 80 N -2.78 6.51 -3.12 5.00 0.00 -1.26 -4.59 120.51 120.27 1ud9 n ALA 80 Ca 0.22 -3.95 -0.18 0.00 0.00 0.00 0.00 53.44 49.53 1ud9 n ALA 80 Cb 0.70 -2.36 -0.03 0.00 0.00 0.00 0.00 19.45 17.77 1ud9 n ALA 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ud9 n ALA 81 N 0.74 2.39 -0.09 0.00 0.00 -0.74 -4.98 120.51 117.84 1ud9 n ALA 81 Ca 0.54 -3.50 -0.01 0.00 0.00 0.00 0.00 53.44 50.47 1ud9 n ALA 81 Cb 0.32 -0.91 0.25 0.00 0.00 0.00 0.00 19.45 19.12 1ud9 n ALA 81 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1ud9 h LYS 82 N 2.99 0.73 -6.43 0.00 1.63 -1.86 -3.43 116.57 110.22 1ud9 h LYS 82 Ca 0.09 -0.12 -0.48 0.00 -0.85 0.00 0.00 60.65 59.28 1ud9 h LYS 82 Cb 0.95 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 32.45 1ud9 h LYS 82 CO 0.53 0.64 -0.25 1.03 -3.45 0.00 0.00 179.45 177.95 1ud9 s ARG 83 N -5.26 3.49 -0.19 1.90 0.52 -1.26 -5.00 118.95 113.15 1ud9 s ARG 83 Ca -0.09 -0.40 -0.29 0.00 -0.52 0.00 0.00 55.73 54.43 1ud9 s ARG 83 Cb 0.16 -2.72 -0.04 0.00 0.52 0.00 0.00 34.95 32.87 1ud9 s ARG 83 CO 0.78 0.23 1.73 0.21 0.02 0.00 0.00 175.30 178.27 1ud9 s LYS 84 N -4.13 3.75 0.05 3.54 2.20 -1.26 -4.66 119.74 119.23 1ud9 s LYS 84 Ca 0.39 1.81 -0.08 0.00 -0.36 0.00 0.00 55.97 57.72 1ud9 s LYS 84 Cb -0.10 -4.09 -0.00 0.00 -1.51 0.00 0.00 37.83 32.13 1ud9 s LYS 84 CO 0.34 -1.36 0.17 -1.21 -0.36 0.00 0.00 175.35 172.92 1ud9 s GLU 85 N 4.86 0.71 0.52 4.03 0.41 -1.26 -4.97 118.70 123.00 1ud9 s GLU 85 Ca 0.77 -0.76 -0.19 0.00 -0.41 0.00 0.00 54.97 54.37 1ud9 s GLU 85 Cb -0.28 0.29 -0.07 0.00 -1.78 0.00 0.00 34.13 32.29 1ud9 s GLU 85 CO 0.31 -0.20 1.07 -1.21 -0.49 0.00 0.00 175.26 174.74 1ud9 s GLU 86 N -2.96 3.59 -0.05 1.61 2.02 -1.25 -0.59 118.70 121.07 1ud9 s GLU 86 Ca -0.02 1.43 0.03 0.00 0.02 0.00 0.00 54.97 56.43 1ud9 s GLU 86 Cb 0.01 -2.06 0.00 0.00 0.10 0.00 0.00 34.13 32.19 1ud9 s GLU 86 CO -0.06 -0.62 -0.14 -1.50 0.02 0.00 0.00 175.26 172.96 1ud9 s ILE 87 N -1.97 1.20 -0.10 -1.63 2.07 -0.64 -1.12 121.20 119.01 1ud9 s ILE 87 Ca 0.69 -0.57 0.00 0.00 -1.41 0.00 0.00 60.65 59.37 1ud9 s ILE 87 Cb -0.19 -1.05 -0.02 0.00 0.13 0.00 0.00 42.46 41.33 1ud9 s ILE 87 CO 0.24 0.36 -0.11 -0.63 -1.91 0.00 0.00 174.94 172.89 1ud9 s ILE 88 N 0.25 3.30 -0.11 2.00 1.01 0.21 -0.96 121.20 126.91 1ud9 s ILE 88 Ca -0.07 -0.60 0.02 0.00 0.00 0.00 0.00 60.65 60.01 1ud9 s ILE 88 Cb -0.12 -2.37 0.01 0.00 0.01 0.00 0.00 42.46 39.99 1ud9 s ILE 88 CO 0.02 0.55 -0.18 -0.63 0.00 0.00 0.00 174.94 174.70 1ud9 s ILE 89 N -0.14 1.70 -0.04 2.92 1.01 0.08 -1.02 121.20 125.72 1ud9 s ILE 89 Ca -0.00 -0.78 0.00 0.00 0.00 0.00 0.00 60.65 59.87 1ud9 s ILE 89 Cb -0.13 -1.52 0.03 0.00 0.01 0.00 0.00 42.46 40.84 1ud9 s ILE 89 CO 0.03 0.48 -0.01 -0.62 0.00 0.00 0.00 174.94 174.82 1ud9 s ASP 90 N 0.75 0.86 -0.10 3.58 -1.08 -0.28 -0.88 116.67 119.53 1ud9 s ASP 90 Ca -0.11 -0.07 -0.02 0.00 -0.52 0.00 0.00 52.55 51.84 1ud9 s ASP 90 Cb -0.16 -0.34 0.03 0.00 -1.46 0.00 0.00 42.92 40.99 1ud9 s ASP 90 CO 0.02 -0.11 0.00 0.00 0.52 0.00 0.00 175.17 175.60 1ud9 s ALA 91 N 1.21 0.79 -0.91 3.66 0.00 -0.40 -1.07 121.76 125.04 1ud9 s ALA 91 Ca -0.07 -0.25 0.19 0.00 0.00 0.00 0.00 51.96 51.83 1ud9 s ALA 91 Cb -0.14 -0.83 -0.21 0.00 0.00 0.00 0.00 23.12 21.94 1ud9 s ALA 91 CO -0.02 -0.59 0.82 -0.25 0.00 0.00 0.00 175.76 175.72 1ud9 n ASP 92 N 5.12 0.91 -3.82 0.00 10.43 -1.26 -1.98 116.55 125.94 1ud9 n ASP 92 Ca -0.08 -0.95 -0.10 0.00 2.57 0.00 0.00 54.79 56.23 1ud9 n ASP 92 Cb 0.49 1.00 -0.07 0.00 1.84 0.00 0.00 41.12 44.38 1ud9 n ASP 92 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 1ud9 s SER 93 N -2.83 0.03 0.19 -2.24 1.04 -1.26 -5.00 113.70 103.64 1ud9 s SER 93 Ca 0.07 -0.46 -0.11 0.00 0.48 0.00 0.00 55.95 55.93 1ud9 s SER 93 Cb 0.15 0.33 0.22 0.00 0.10 0.00 0.00 66.02 66.82 1ud9 s SER 93 CO 0.79 -0.66 1.74 -0.65 0.98 0.00 0.00 173.24 175.44 1ud9 h PRO 94 N 3.04 0.34 -0.97 4.02 0.11 -1.98 -3.28 132.00 133.28 1ud9 h PRO 94 Ca -0.33 -0.02 0.24 0.00 0.11 0.00 0.00 66.00 66.00 1ud9 h PRO 94 Cb 1.20 -0.08 -0.07 0.00 0.11 0.00 0.00 31.00 32.17 1ud9 h PRO 94 CO 0.51 0.22 0.65 0.93 -0.21 0.00 0.00 178.00 180.10 1ud9 h GLU 95 N 0.35 0.30 -3.23 1.05 4.39 -1.96 -3.42 114.58 112.04 1ud9 h GLU 95 Ca 0.27 -0.02 -0.13 0.00 0.34 0.00 0.00 59.36 59.82 1ud9 h GLU 95 Cb 0.33 -0.07 -0.21 0.00 -0.10 0.00 0.00 28.75 28.70 1ud9 h GLU 95 CO -0.29 0.20 -0.38 0.08 -1.16 0.00 0.00 179.01 177.46 1ud9 s VAL 96 N -5.34 0.06 -0.10 3.13 1.01 -1.24 -0.84 120.40 117.09 1ud9 s VAL 96 Ca -0.08 -0.50 0.03 0.00 0.00 0.00 0.00 61.98 61.43 1ud9 s VAL 96 Cb 0.23 -0.51 0.01 0.00 0.00 0.00 0.00 36.38 36.11 1ud9 s VAL 96 CO 0.79 -0.28 -0.19 -0.69 0.00 0.00 0.00 175.10 174.73 1ud9 s VAL 97 N -1.17 1.72 -0.25 2.92 1.01 -0.12 -4.55 120.40 119.96 1ud9 s VAL 97 Ca -0.12 -0.80 -0.14 0.00 0.00 0.00 0.00 61.98 60.91 1ud9 s VAL 97 Cb -0.06 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.76 1ud9 s VAL 97 CO 0.03 0.48 0.32 -0.75 0.00 0.00 0.00 175.10 175.18 1ud9 s LYS 98 N 0.63 4.05 -0.18 2.72 2.20 -0.23 -0.52 119.74 128.41 1ud9 s LYS 98 Ca -0.14 -0.02 -0.04 0.00 -0.36 0.00 0.00 55.97 55.42 1ud9 s LYS 98 Cb -0.16 -3.61 -0.02 0.00 -1.51 0.00 0.00 37.83 32.52 1ud9 s LYS 98 CO 0.04 -0.15 -0.04 -0.51 -0.36 0.00 0.00 175.35 174.33 1ud9 s LEU 99 N 1.68 3.15 -0.13 5.43 1.43 0.76 -1.13 118.68 129.86 1ud9 s LEU 99 Ca 0.14 -0.21 0.02 0.00 -1.03 0.00 0.00 54.13 53.04 1ud9 s LEU 99 Cb -0.15 -1.77 -0.00 0.00 0.03 0.00 0.00 46.19 44.30 1ud9 s LEU 99 CO 0.09 0.11 -0.19 -0.89 0.23 0.00 0.00 176.35 175.70 1ud9 s THR 100 N 0.73 2.43 -0.19 5.49 2.01 -0.19 0.35 115.64 126.27 1ud9 s THR 100 Ca -0.02 -0.87 -0.10 0.00 0.31 0.00 0.00 61.69 61.02 1ud9 s THR 100 Cb -0.14 -1.99 -0.05 0.00 0.01 0.00 0.00 72.50 70.33 1ud9 s THR 100 CO 0.02 0.54 0.13 -0.76 -0.69 0.00 0.00 174.62 173.85 1ud9 s LEU 101 N 0.61 4.19 0.00 4.42 1.43 0.11 -0.62 118.68 128.83 1ud9 s LEU 101 Ca -0.10 0.24 0.03 0.00 -1.03 0.00 0.00 54.13 53.27 1ud9 s LEU 101 Cb -0.16 -2.08 0.05 0.00 0.03 0.00 0.00 46.19 44.03 1ud9 s LEU 101 CO 0.03 0.20 0.39 -1.54 0.23 0.00 0.00 176.35 175.65 1ud9 n SER 102 N 3.41 0.89 0.00 2.29 3.41 -0.28 -2.55 113.62 120.79 1ud9 n SER 102 Ca -0.16 -1.67 0.00 0.00 -0.26 0.00 0.00 58.87 56.78 1ud9 n SER 102 Cb 0.52 -0.22 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 1ud9 n SER 102 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ud9 n GLY 103 N 1.70 0.68 2.20 5.00 0.00 -1.26 -4.48 105.19 109.03 1ud9 n GLY 103 Ca 0.08 -0.85 -0.04 0.00 0.00 0.00 0.00 46.02 45.20 1ud9 n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ud9 n ALA 104 N 1.51 -0.55 -0.04 4.61 0.00 -1.26 -2.68 120.51 122.09 1ud9 n ALA 104 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1ud9 n ALA 104 Cb 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 19.45 19.25 1ud9 n ALA 104 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ud9 n LEU 105 N -1.11 -0.04 0.00 0.00 7.99 -1.26 -4.79 117.00 117.79 1ud9 n LEU 105 Ca -0.01 0.02 0.00 0.00 -0.01 0.00 0.00 56.01 56.01 1ud9 n LEU 105 Cb 0.06 -0.03 0.00 0.00 -0.11 0.00 0.00 43.42 43.35 1ud9 n LEU 105 CO 0.10 -0.04 0.00 -3.20 -1.51 0.00 0.00 177.39 172.75 1ud9 n ASN 106 N 1.27 0.00 -4.04 -1.43 2.85 -1.09 -5.05 115.26 107.76 1ud9 n ASN 106 Ca 0.00 0.00 -0.24 0.00 -0.11 0.00 0.00 54.58 54.23 1ud9 n ASN 106 Cb 0.00 0.00 -0.16 0.00 1.24 0.00 0.00 39.78 40.86 1ud9 n ASN 106 CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 1ud9 s ARG 107 N 0.00 1.51 -0.11 1.20 0.52 -1.06 -5.00 118.95 116.01 1ud9 s ARG 107 Ca 0.00 -0.43 0.02 0.00 -0.52 0.00 0.00 55.73 54.81 1ud9 s ARG 107 Cb 0.00 -1.30 0.01 0.00 0.52 0.00 0.00 34.95 34.18 1ud9 s ARG 107 CO 0.00 0.10 -0.18 0.08 0.02 0.00 0.00 175.30 175.32 1ud9 s VAL 108 N 0.38 1.69 -0.06 3.52 1.01 -1.26 0.08 120.40 125.77 1ud9 s VAL 108 Ca -0.09 -0.78 0.04 0.00 0.00 0.00 0.00 61.98 61.16 1ud9 s VAL 108 Cb -0.13 -1.51 -0.00 0.00 0.00 0.00 0.00 36.38 34.74 1ud9 s VAL 108 CO 0.02 0.48 -0.19 -0.36 0.00 0.00 0.00 175.10 175.05 1ud9 s PHE 109 N 0.75 1.99 -0.47 5.22 0.40 0.16 -4.98 117.98 121.05 1ud9 s PHE 109 Ca -0.11 -0.65 -0.12 0.00 -0.60 0.00 0.00 56.93 55.46 1ud9 s PHE 109 Cb -0.16 -1.34 0.10 0.00 0.51 0.00 0.00 43.02 42.13 1ud9 s PHE 109 CO 0.02 -0.24 0.35 -0.80 0.70 0.00 0.00 175.22 175.25 1ud9 s ASN 110 N 0.13 5.85 -0.27 1.36 0.01 -1.26 -0.17 114.94 120.59 1ud9 s ASN 110 Ca -0.08 -1.64 -0.13 0.00 -0.71 0.00 0.00 52.86 50.29 1ud9 s ASN 110 Cb -0.14 -2.07 -0.04 0.00 0.41 0.00 0.00 41.25 39.41 1ud9 s ASN 110 CO 0.04 -0.66 0.30 -0.69 -1.51 0.00 0.00 177.10 174.58 1ud9 s VAL 111 N 1.48 5.23 0.02 1.60 1.01 0.32 -4.90 120.40 125.16 1ud9 s VAL 111 Ca 0.04 0.42 -0.30 0.00 0.00 0.00 0.00 61.98 62.14 1ud9 s VAL 111 Cb -0.25 -3.63 -0.05 0.00 0.00 0.00 0.00 36.38 32.44 1ud9 s VAL 111 CO 0.02 0.20 1.24 0.20 0.00 0.00 0.00 175.10 176.77 1ud9 s ASN 112 N 1.62 7.02 0.37 3.32 0.01 -1.26 -0.95 114.94 125.07 1ud9 s ASN 112 Ca 0.12 1.98 -0.27 0.00 -0.71 0.00 0.00 52.86 53.98 1ud9 s ASN 112 Cb -0.16 -2.57 -0.10 0.00 0.41 0.00 0.00 41.25 38.84 1ud9 s ASN 112 CO 0.10 -0.56 1.32 0.21 -1.51 0.00 0.00 177.10 176.66 1ud9 s ASN 113 N 1.34 6.50 0.12 -1.22 2.47 -0.02 -4.95 114.94 119.19 1ud9 s ASN 113 Ca 0.59 2.71 0.06 0.00 0.42 0.00 0.00 52.86 56.64 1ud9 s ASN 113 Cb -0.29 -2.65 -0.04 0.00 -1.45 0.00 0.00 41.25 36.83 1ud9 s ASN 113 CO 0.26 -0.73 -0.15 0.27 -3.72 0.00 0.00 177.10 173.04 1ud9 s ILE 114 N -1.20 1.35 -0.03 -5.21 -4.36 -1.13 -4.94 121.20 105.69 1ud9 s ILE 114 Ca 0.53 -1.69 -0.30 0.00 -0.26 0.00 0.00 60.65 58.94 1ud9 s ILE 114 Cb -0.40 -1.51 -0.05 0.00 1.25 0.00 0.00 42.46 41.76 1ud9 s ILE 114 CO 0.52 -0.38 1.40 -1.83 0.24 0.00 0.00 174.94 174.88 1ud9 s GLU 115 N -2.57 4.27 -0.14 0.37 -1.05 -1.26 -3.42 118.70 114.90 1ud9 s GLU 115 Ca 0.08 1.93 -0.04 0.00 -0.15 0.00 0.00 54.97 56.79 1ud9 s GLU 115 Cb -0.06 -3.63 0.07 0.00 -0.44 0.00 0.00 34.13 30.07 1ud9 s GLU 115 CO 0.03 -0.61 0.20 0.08 0.95 0.00 0.00 175.26 175.91 1ud9 s VAL 116 N 2.66 -0.31 0.10 1.83 1.01 -1.26 -4.98 120.40 119.46 1ud9 s VAL 116 Ca 0.63 0.15 -0.25 0.00 0.00 0.00 0.00 61.98 62.51 1ud9 s VAL 116 Cb -0.30 -0.47 -0.07 0.00 0.00 0.00 0.00 36.38 35.54 1ud9 s VAL 116 CO 0.25 -0.00 0.77 -0.76 0.00 0.00 0.00 175.10 175.36 1ud9 s LEU 117 N 2.32 4.52 0.37 3.92 1.43 -1.26 -4.85 118.68 125.13 1ud9 s LEU 117 Ca 0.04 1.54 -0.26 0.00 -1.03 0.00 0.00 54.13 54.41 1ud9 s LEU 117 Cb -0.14 -3.26 -0.09 0.00 0.03 0.00 0.00 46.19 42.74 1ud9 s LEU 117 CO -0.09 0.11 1.17 -2.84 0.23 0.00 0.00 176.35 174.93 1ud9 s PRO 118 N -0.56 4.21 0.52 1.29 0.02 -1.26 -4.96 135.00 134.25 1ud9 s PRO 118 Ca 0.37 1.87 -0.21 0.00 0.02 0.00 0.00 61.00 63.06 1ud9 s PRO 118 Cb -0.22 -2.82 -0.08 0.00 0.02 0.00 0.00 34.50 31.41 1ud9 s PRO 118 CO 0.24 -0.20 0.92 -2.30 -0.33 0.00 0.00 177.00 175.34 1ud9 n PRO 119 N 0.37 1.05 -2.38 5.54 -0.02 -1.26 -4.77 135.00 133.53 1ud9 n PRO 119 Ca 0.03 0.39 -0.37 0.00 -2.02 0.00 0.00 63.50 61.53 1ud9 n PRO 119 Cb 0.46 -2.05 -0.02 0.00 -0.02 0.00 0.00 33.50 31.86 1ud9 n PRO 119 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1ud9 s GLU 120 N -2.33 3.39 0.06 -0.52 0.41 -1.26 -4.92 118.70 113.53 1ud9 s GLU 120 Ca 0.69 -1.66 -0.31 0.00 -0.41 0.00 0.00 54.97 53.28 1ud9 s GLU 120 Cb -0.48 -5.42 -0.07 0.00 -1.78 0.00 0.00 34.13 26.38 1ud9 s GLU 120 CO 0.53 -2.95 1.49 0.54 -0.49 0.00 0.00 175.26 174.38 1ud9 s VAL 121 N 6.95 3.33 0.00 2.63 0.11 -1.26 -5.20 120.40 126.95 1ud9 s VAL 121 Ca 0.60 0.82 0.00 0.00 -2.93 0.00 0.00 61.98 60.47 1ud9 s VAL 121 Cb 0.02 -3.53 0.00 0.00 -1.53 0.00 0.00 36.38 31.34 1ud9 s VAL 121 CO 0.10 0.02 0.00 -2.65 -3.33 0.00 0.00 175.10 169.24 1ud9 n PRO 122 N 5.02 0.00 0.00 1.54 -0.02 -1.26 -5.28 135.00 135.00 1ud9 n PRO 122 Ca 0.14 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 1ud9 n PRO 122 Cb 0.42 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.90 1ud9 n PRO 122 CO 0.00 0.00 0.00 1.47 1.98 0.00 0.00 175.50 178.95 1ud9 n LEU 126 N 0.00 0.00 -4.84 2.45 -0.00 -1.26 -5.29 117.00 108.06 1ud9 n LEU 126 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 56.01 55.68 1ud9 n LEU 126 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.36 1ud9 n LEU 126 CO 0.00 0.00 0.48 -1.61 -0.00 0.00 0.00 177.39 176.26 1ud9 s GLU 127 N 0.00 4.10 0.08 1.47 2.02 -1.26 -5.06 118.70 120.05 1ud9 s GLU 127 Ca 0.00 0.82 0.03 0.00 0.02 0.00 0.00 54.97 55.83 1ud9 s GLU 127 Cb 0.00 -2.44 -0.03 0.00 0.10 0.00 0.00 34.13 31.75 1ud9 s GLU 127 CO 0.00 0.15 -0.08 -0.59 0.02 0.00 0.00 175.26 174.76 1ud9 s PHE 128 N -1.96 0.88 -0.03 1.61 -0.12 -1.26 -4.76 117.98 112.34 1ud9 s PHE 128 Ca 0.54 -0.70 0.09 0.00 -0.05 0.00 0.00 56.93 56.81 1ud9 s PHE 128 Cb -0.11 -0.50 -0.24 0.00 -0.63 0.00 0.00 43.02 41.54 1ud9 s PHE 128 CO 0.17 -0.08 0.70 -0.44 -0.05 0.00 0.00 175.22 175.52 1ud9 h ASP 129 N 3.63 0.07 -3.74 1.98 3.32 -1.29 -3.45 116.42 116.93 1ud9 h ASP 129 Ca -0.36 -0.15 -0.19 0.00 0.02 0.00 0.00 57.03 56.35 1ud9 h ASP 129 Cb 1.18 -0.02 -0.27 0.00 0.22 0.00 0.00 39.33 40.44 1ud9 h ASP 129 CO 0.54 1.13 -0.53 -0.63 -1.72 0.00 0.00 179.24 178.03 1ud9 s ILE 130 N -2.60 -0.01 -0.18 0.35 1.01 -1.01 -1.14 121.20 117.61 1ud9 s ILE 130 Ca -0.06 0.02 -0.03 0.00 0.00 0.00 0.00 60.65 60.58 1ud9 s ILE 130 Cb 0.08 -0.25 0.06 0.00 0.01 0.00 0.00 42.46 42.36 1ud9 s ILE 130 CO 0.82 0.01 0.04 -0.75 0.00 0.00 0.00 174.94 175.06 1ud9 s LYS 131 N 0.23 0.59 -0.09 2.79 2.20 -0.76 -1.60 119.74 123.11 1ud9 s LYS 131 Ca -0.01 -0.36 0.03 0.00 -0.36 0.00 0.00 55.97 55.27 1ud9 s LYS 131 Cb -0.02 -2.02 -0.02 0.00 -1.51 0.00 0.00 37.83 34.26 1ud9 s LYS 131 CO -0.01 -0.62 -0.17 0.00 -0.36 0.00 0.00 175.35 174.19 1ud9 s ALA 132 N 1.89 2.52 -0.42 3.13 0.00 0.25 -0.84 121.76 128.28 1ud9 s ALA 132 Ca -0.00 -0.96 -0.18 0.00 0.00 0.00 0.00 51.96 50.82 1ud9 s ALA 132 Cb -0.17 -1.00 0.02 0.00 0.00 0.00 0.00 23.12 21.98 1ud9 s ALA 132 CO -0.08 0.39 0.51 0.99 0.00 0.00 0.00 175.76 177.57 1ud9 s THR 133 N -0.13 5.00 0.22 0.00 2.01 0.12 -0.14 115.64 122.72 1ud9 s THR 133 Ca -0.02 -0.16 0.08 0.00 0.31 0.00 0.00 61.69 61.90 1ud9 s THR 133 Cb -0.14 -4.09 -0.05 0.00 0.01 0.00 0.00 72.50 68.23 1ud9 s THR 133 CO 0.04 -0.47 -0.15 0.27 -0.69 0.00 0.00 174.62 173.62 1ud9 s ILE 134 N 2.38 1.84 0.10 1.82 -4.36 -0.10 -0.39 121.20 122.50 1ud9 s ILE 134 Ca 0.16 -2.24 -0.32 0.00 -0.26 0.00 0.00 60.65 57.99 1ud9 s ILE 134 Cb -0.16 -2.10 -0.12 0.00 1.25 0.00 0.00 42.46 41.34 1ud9 s ILE 134 CO 0.15 -0.56 1.77 -3.20 0.24 0.00 0.00 174.94 173.35 1ud9 n ASN 135 N -0.42 3.70 -0.16 4.36 2.85 0.07 -0.65 115.26 125.01 1ud9 n ASN 135 Ca -0.07 1.01 -0.07 0.00 -0.11 0.00 0.00 54.58 55.34 1ud9 n ASN 135 Cb 0.60 -1.49 0.09 0.00 1.24 0.00 0.00 39.78 40.23 1ud9 n ASN 135 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1ud9 h ALA 136 N 7.86 0.96 -0.13 5.20 0.00 -0.68 -1.47 119.26 131.00 1ud9 h ALA 136 Ca -0.46 -0.30 -0.15 0.00 0.00 0.00 0.00 54.91 54.01 1ud9 h ALA 136 Cb 1.24 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1ud9 h ALA 136 CO 0.93 0.63 -0.55 0.66 0.00 0.00 0.00 179.25 180.92 1ud9 h SER 137 N 0.85 0.42 -0.35 0.00 4.64 -1.86 -0.62 113.55 116.63 1ud9 h SER 137 Ca 0.15 -0.22 -0.03 0.00 -0.47 0.00 0.00 61.79 61.22 1ud9 h SER 137 Cb 0.53 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 62.48 1ud9 h SER 137 CO 0.03 0.89 0.12 1.23 -0.87 0.00 0.00 176.83 178.23 1ud9 h GLY 138 N 1.26 0.58 0.98 -0.77 0.00 -1.85 -0.03 103.07 103.24 1ud9 h GLY 138 Ca 0.00 -0.34 -0.03 0.00 0.00 0.00 0.00 47.33 46.97 1ud9 h GLY 138 CO 0.09 0.32 0.23 -2.00 0.00 0.00 0.00 176.54 175.18 1ud9 h LEU 139 N 0.42 0.72 -0.53 3.11 5.85 -1.10 -0.88 115.31 122.90 1ud9 h LEU 139 Ca 0.12 -0.15 0.08 0.00 0.84 0.00 0.00 57.88 58.76 1ud9 h LEU 139 Cb 0.23 -0.19 -0.07 0.00 0.37 0.00 0.00 40.66 41.01 1ud9 h LEU 139 CO -0.01 0.68 0.17 0.50 -0.34 0.00 0.00 178.44 179.44 1ud9 h LYS 140 N 0.72 0.33 -0.60 1.25 3.11 -0.74 -0.06 116.57 120.58 1ud9 h LYS 140 Ca 0.18 -0.02 -0.00 0.00 -2.81 0.00 0.00 60.65 58.00 1ud9 h LYS 140 Cb 0.17 -0.07 -0.03 0.00 -1.00 0.00 0.00 32.23 31.29 1ud9 h LYS 140 CO -0.02 0.22 0.36 -0.91 -2.81 0.00 0.00 179.45 176.28 1ud9 h ASN 141 N 0.33 0.72 -0.33 4.20 2.35 -0.59 -1.78 115.58 120.49 1ud9 h ASN 141 Ca 0.26 -0.06 -0.03 0.00 -0.55 0.00 0.00 56.30 55.92 1ud9 h ASN 141 Cb 0.32 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.49 1ud9 h ASN 141 CO -0.29 0.58 0.10 0.00 -1.65 0.00 0.00 177.43 176.17 1ud9 h ALA 142 N 1.18 0.43 -0.53 -0.83 0.00 -0.54 -1.35 119.26 117.63 1ud9 h ALA 142 Ca 0.21 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1ud9 h ALA 142 Cb -0.01 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1ud9 h ALA 142 CO -0.04 0.07 0.25 0.82 0.00 0.00 0.00 179.25 180.35 1ud9 h ILE 143 N 0.38 1.20 -0.50 0.00 2.04 -0.85 -1.62 117.51 118.16 1ud9 h ILE 143 Ca 0.11 -0.57 -0.05 0.00 1.00 0.00 0.00 64.86 65.34 1ud9 h ILE 143 Cb 0.25 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 1ud9 h ILE 143 CO -0.00 0.23 0.11 1.23 0.00 0.00 0.00 178.15 179.72 1ud9 h GLY 144 N 0.70 0.87 1.40 5.37 0.00 -1.13 -0.52 103.07 109.77 1ud9 h GLY 144 Ca 0.18 -0.55 -0.12 0.00 0.00 0.00 0.00 47.33 46.84 1ud9 h GLY 144 CO -0.02 0.51 -0.29 0.83 0.00 0.00 0.00 176.54 177.57 1ud9 h GLU 145 N 0.69 0.68 -0.24 4.80 5.08 -1.15 -2.07 114.58 122.37 1ud9 h GLU 145 Ca 0.16 -0.30 -0.20 0.00 -1.00 0.00 0.00 59.36 58.02 1ud9 h GLU 145 Cb 0.35 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1ud9 h GLU 145 CO 0.00 0.89 -0.64 0.82 -1.00 0.00 0.00 179.01 179.08 1ud9 h ILE 146 N 0.58 1.27 -0.15 3.13 2.04 -1.18 -3.00 117.51 120.19 1ud9 h ILE 146 Ca 0.07 -1.82 -0.05 0.00 1.00 0.00 0.00 64.86 64.06 1ud9 h ILE 146 Cb 0.79 1.76 -0.01 0.00 -0.74 0.00 0.00 36.82 38.62 1ud9 h ILE 146 CO 0.07 0.59 -0.12 0.00 0.00 0.00 0.00 178.15 178.68 1ud9 h ALA 147 N 0.63 1.51 0.00 1.87 0.00 -0.95 0.27 119.26 122.60 1ud9 h ALA 147 Ca -0.01 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 1ud9 h ALA 147 Cb 1.26 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 1ud9 h ALA 147 CO 0.14 0.35 -0.12 1.05 0.00 0.00 0.00 179.25 180.66 1ud9 h GLU 148 N 0.23 0.00 0.00 0.00 4.11 -1.23 -3.33 114.58 114.36 1ud9 h GLU 148 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.48 1ud9 h GLU 148 Cb 0.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 1ud9 h GLU 148 CO 0.02 0.12 0.00 1.33 0.07 0.00 0.00 179.01 180.55 1ud9 n VAL 149 N -3.39 0.00 -4.08 -1.06 0.24 -0.53 -5.08 118.33 104.42 1ud9 n VAL 149 Ca -0.01 -0.45 -0.10 0.00 -2.04 0.00 0.00 64.34 61.74 1ud9 n VAL 149 Cb 0.31 1.05 -0.09 0.00 -1.47 0.00 0.00 33.84 33.64 1ud9 n VAL 149 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ud9 s ALA 150 N -0.47 0.55 -0.62 2.33 0.00 0.86 -5.04 121.76 119.37 1ud9 s ALA 150 Ca 0.00 -1.27 0.17 0.00 0.00 0.00 0.00 51.96 50.85 1ud9 s ALA 150 Cb 0.00 0.96 -0.20 0.00 0.00 0.00 0.00 23.12 23.88 1ud9 s ALA 150 CO 0.00 -0.58 0.64 -0.40 0.00 0.00 0.00 175.76 175.42 1ud9 n ASP 151 N -0.18 0.85 -4.11 0.00 5.68 -1.26 -4.45 116.55 113.08 1ud9 n ASP 151 Ca -0.05 -0.70 -0.24 0.00 -0.50 0.00 0.00 54.79 53.30 1ud9 n ASP 151 Cb 0.64 1.17 -0.16 0.00 -1.14 0.00 0.00 41.12 41.63 1ud9 n ASP 151 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1ud9 s THR 152 N -2.71 1.24 -0.17 2.12 2.01 -1.26 -2.06 115.64 114.81 1ud9 s THR 152 Ca 0.04 -0.63 -0.06 0.00 0.31 0.00 0.00 61.69 61.35 1ud9 s THR 152 Cb 0.12 -1.06 -0.03 0.00 0.01 0.00 0.00 72.50 71.54 1ud9 s THR 152 CO 0.69 0.36 0.02 -0.22 -0.69 0.00 0.00 174.62 174.78 1ud9 s LEU 153 N -0.04 3.52 -0.08 4.42 0.20 0.21 -1.38 118.68 125.53 1ud9 s LEU 153 Ca -0.01 -0.04 -0.03 0.00 0.69 0.00 0.00 54.13 54.75 1ud9 s LEU 153 Cb -0.09 -1.88 -0.04 0.00 -0.43 0.00 0.00 46.19 43.76 1ud9 s LEU 153 CO 0.01 0.16 0.04 -0.76 -0.29 0.00 0.00 176.35 175.51 1ud9 s LEU 154 N 0.44 3.78 -0.01 -0.68 1.43 0.53 -1.33 118.68 122.85 1ud9 s LEU 154 Ca -0.00 0.21 0.02 0.00 -1.03 0.00 0.00 54.13 53.33 1ud9 s LEU 154 Cb -0.13 -1.91 -0.00 0.00 0.03 0.00 0.00 46.19 44.17 1ud9 s LEU 154 CO 0.02 0.38 -0.07 -0.51 0.23 0.00 0.00 176.35 176.39 1ud9 s ILE 155 N -0.95 0.58 0.03 -0.59 2.07 -0.69 -1.64 121.20 120.01 1ud9 s ILE 155 Ca 0.15 -0.31 -0.00 0.00 -1.41 0.00 0.00 60.65 59.08 1ud9 s ILE 155 Cb -0.12 -0.49 -0.03 0.00 0.13 0.00 0.00 42.46 41.96 1ud9 s ILE 155 CO 0.04 0.17 -0.04 -0.94 -1.91 0.00 0.00 174.94 172.26 1ud9 s SER 156 N -0.13 0.39 0.01 4.50 1.04 -0.63 -0.74 113.70 118.14 1ud9 s SER 156 Ca 0.02 -0.65 -0.13 0.00 0.48 0.00 0.00 55.95 55.67 1ud9 s SER 156 Cb -0.03 0.12 0.02 0.00 0.10 0.00 0.00 66.02 66.23 1ud9 s SER 156 CO -0.00 -0.37 0.29 -0.83 0.98 0.00 0.00 173.24 173.30 1ud9 s GLY 157 N -1.90 -0.11 0.00 7.32 0.00 -0.28 -0.43 107.32 111.93 1ud9 s GLY 157 Ca -0.09 0.12 0.00 0.00 0.00 0.00 0.00 44.72 44.75 1ud9 s GLY 157 CO -0.03 -0.09 0.00 1.16 0.00 0.00 0.00 173.10 174.14 1ud9 n ASN 158 N 0.96 0.18 0.21 1.64 0.23 -0.35 -2.27 115.26 115.86 1ud9 n ASN 158 Ca -0.20 -0.38 0.15 0.00 -0.53 0.00 0.00 54.58 53.62 1ud9 n ASN 158 Cb 0.58 0.00 0.68 0.00 -2.08 0.00 0.00 39.78 38.95 1ud9 n ASN 158 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 1ud9 h GLU 159 N 0.00 0.00 0.00 -3.83 4.11 -1.98 -3.25 114.58 109.63 1ud9 h GLU 159 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.43 1ud9 h GLU 159 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1ud9 h GLU 159 CO 0.00 0.00 -1.34 0.39 0.07 0.00 0.00 179.01 178.13 1ud9 n GLU 160 N -2.63 0.27 -3.70 1.06 1.02 -1.26 -4.94 120.64 110.46 1ud9 n GLU 160 Ca 0.00 -0.07 -0.10 0.00 -0.02 0.00 0.00 57.16 56.98 1ud9 n GLU 160 Cb 0.20 -1.17 -0.04 0.00 -0.02 0.00 0.00 31.44 30.41 1ud9 n GLU 160 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 1ud9 s LYS 161 N -2.51 1.34 -0.07 3.49 -2.85 -1.23 -4.42 119.74 113.49 1ud9 s LYS 161 Ca -0.03 -0.81 0.05 0.00 -1.00 0.00 0.00 55.97 54.19 1ud9 s LYS 161 Cb 0.05 0.52 -0.01 0.00 -2.06 0.00 0.00 37.83 36.33 1ud9 s LYS 161 CO 0.31 -0.56 -0.23 0.08 0.10 0.00 0.00 175.35 175.04 1ud9 s VAL 162 N -3.85 1.94 -0.05 1.79 1.01 -0.65 -1.21 120.40 119.38 1ud9 s VAL 162 Ca 0.08 -0.99 0.06 0.00 0.00 0.00 0.00 61.98 61.13 1ud9 s VAL 162 Cb -0.01 -1.66 -0.01 0.00 0.00 0.00 0.00 36.38 34.71 1ud9 s VAL 162 CO -0.05 0.54 -0.23 -0.69 0.00 0.00 0.00 175.10 174.67 1ud9 s VAL 163 N 0.04 1.85 0.00 2.92 1.01 0.43 -0.65 120.40 126.01 1ud9 s VAL 163 Ca -0.08 -0.96 0.07 0.00 0.00 0.00 0.00 61.98 61.00 1ud9 s VAL 163 Cb -0.15 -1.57 -0.02 0.00 0.00 0.00 0.00 36.38 34.64 1ud9 s VAL 163 CO 0.05 0.52 -0.21 0.68 0.00 0.00 0.00 175.10 176.14 1ud9 s VAL 164 N -0.13 1.64 0.24 2.92 -7.23 -0.41 -1.61 120.40 115.82 1ud9 s VAL 164 Ca -0.03 -0.98 -0.20 0.00 -1.81 0.00 0.00 61.98 58.96 1ud9 s VAL 164 Cb -0.13 -1.38 0.03 0.00 0.56 0.00 0.00 36.38 35.45 1ud9 s VAL 164 CO 0.03 0.38 0.63 -1.59 -0.31 0.00 0.00 175.10 174.24 1ud9 s LYS 165 N -0.70 1.61 0.32 4.82 -2.85 -0.65 -0.24 119.74 122.04 1ud9 s LYS 165 Ca 0.08 -0.92 -0.08 0.00 -1.00 0.00 0.00 55.97 54.04 1ud9 s LYS 165 Cb -0.08 0.57 -0.06 0.00 -2.06 0.00 0.00 37.83 36.20 1ud9 s LYS 165 CO 0.00 -0.71 0.64 0.20 0.10 0.00 0.00 175.35 175.58 1ud9 s GLY 166 N -2.90 2.00 0.23 0.59 0.00 -1.26 -0.34 107.32 105.64 1ud9 s GLY 166 Ca 0.11 -0.34 -0.30 0.00 0.00 0.00 0.00 44.72 44.19 1ud9 s GLY 166 CO 0.02 -0.19 1.04 1.85 0.00 0.00 0.00 173.10 175.82 1ud9 s GLU 167 N -3.48 4.71 0.00 2.90 2.12 -0.48 -4.82 118.70 119.64 1ud9 s GLU 167 Ca 0.48 1.66 0.00 0.00 0.36 0.00 0.00 54.97 57.47 1ud9 s GLU 167 Cb -0.11 -3.25 0.00 0.00 0.26 0.00 0.00 34.13 31.03 1ud9 s GLU 167 CO 0.28 0.28 0.00 0.41 -0.54 0.00 0.00 175.26 175.69 1ud9 n GLY 168 N 1.55 0.48 0.00 -1.50 0.00 -1.26 -4.77 105.19 99.69 1ud9 n GLY 168 Ca -0.00 -2.19 0.00 0.00 0.00 0.00 0.00 46.02 43.82 1ud9 n GLY 168 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1ud9 n GLU 169 N 0.00 0.00 -0.64 1.61 0.28 -1.26 -4.77 120.64 115.87 1ud9 n GLU 169 Ca 0.00 0.00 -0.31 0.00 -0.16 0.00 0.00 57.16 56.69 1ud9 n GLU 169 Cb 0.00 0.00 0.19 0.00 1.43 0.00 0.00 31.44 33.06 1ud9 n GLU 169 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 1ud9 n ASN 170 N 0.00 -1.63 -3.91 -1.84 0.23 -1.26 -5.02 115.26 101.83 1ud9 n ASN 170 Ca 0.00 0.06 -0.24 0.00 -0.53 0.00 0.00 54.58 53.87 1ud9 n ASN 170 Cb 0.00 -1.20 -0.17 0.00 -2.08 0.00 0.00 39.78 36.33 1ud9 n ASN 170 CO 0.00 0.00 0.00 -1.59 -0.93 0.00 0.00 177.26 174.74 1ud9 s LYS 171 N -4.00 1.21 0.00 -3.83 0.00 -1.26 -4.90 119.74 106.96 1ud9 s LYS 171 Ca 0.62 -0.19 0.00 0.00 0.00 0.00 0.00 55.97 56.40 1ud9 s LYS 171 Cb -0.20 -1.22 0.00 0.00 0.00 0.00 0.00 37.83 36.41 1ud9 s LYS 171 CO 0.65 -0.14 0.47 1.33 0.00 0.00 0.00 175.35 177.66 1ud9 n VAL 172 N 4.43 0.23 -0.93 1.79 0.24 -1.26 -4.93 118.33 117.90 1ud9 n VAL 172 Ca -0.18 0.00 -0.37 0.00 -2.04 0.00 0.00 64.34 61.76 1ud9 n VAL 172 Cb 0.51 -0.52 -0.05 0.00 -1.47 0.00 0.00 33.84 32.30 1ud9 n VAL 172 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 1ud9 n GLU 173 N 0.31 0.00 -4.45 7.34 2.13 -1.26 -4.85 120.64 119.86 1ud9 n GLU 173 Ca 0.00 0.00 -0.25 0.00 0.66 0.00 0.00 57.16 57.57 1ud9 n GLU 173 Cb 0.24 -0.88 -0.17 0.00 0.27 0.00 0.00 31.44 30.90 1ud9 n GLU 173 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1ud9 s VAL 174 N 0.67 1.14 -0.17 6.31 1.01 0.66 -4.99 120.40 125.03 1ud9 s VAL 174 Ca 0.56 -0.45 -0.06 0.00 0.00 0.00 0.00 61.98 62.03 1ud9 s VAL 174 Cb -0.79 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 34.49 1ud9 s VAL 174 CO 0.39 0.36 0.04 -0.70 0.00 0.00 0.00 175.10 175.20 1ud9 s GLU 175 N 0.88 3.83 -0.24 2.72 2.12 -1.26 -1.29 118.70 125.46 1ud9 s GLU 175 Ca -0.10 -0.37 -0.04 0.00 0.36 0.00 0.00 54.97 54.82 1ud9 s GLU 175 Cb -0.15 -3.13 0.01 0.00 0.26 0.00 0.00 34.13 31.12 1ud9 s GLU 175 CO 0.01 0.33 -0.03 -0.06 -0.54 0.00 0.00 175.26 174.97 1ud9 s PHE 176 N 0.20 3.02 0.17 5.30 0.40 0.18 -4.86 117.98 122.39 1ud9 s PHE 176 Ca 0.03 -1.15 -0.24 0.00 -0.60 0.00 0.00 56.93 54.97 1ud9 s PHE 176 Cb -0.12 -2.11 0.06 0.00 0.51 0.00 0.00 43.02 41.35 1ud9 s PHE 176 CO 0.01 -0.62 0.95 -1.54 0.70 0.00 0.00 175.22 174.72 1ud9 s SER 177 N 1.43 -0.16 0.31 1.36 1.04 -1.26 -1.63 113.70 114.78 1ud9 s SER 177 Ca 0.03 -0.47 -0.00 0.00 0.48 0.00 0.00 55.95 55.99 1ud9 s SER 177 Cb -0.15 0.52 0.49 0.00 0.10 0.00 0.00 66.02 66.97 1ud9 s SER 177 CO -0.03 -0.97 1.91 0.11 0.98 0.00 0.00 173.24 175.24 1ud9 h LYS 178 N 2.00 0.87 0.00 4.02 1.57 -1.77 -1.24 116.57 122.02 1ud9 h LYS 178 Ca -0.24 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.43 1ud9 h LYS 178 Cb 1.23 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.38 1ud9 h LYS 178 CO 0.27 0.68 0.00 -0.25 -0.57 0.00 0.00 179.45 179.57 1ud9 n ASP 179 N -4.35 0.00 0.00 0.86 8.00 -1.26 -1.10 116.55 118.70 1ud9 n ASP 179 Ca 0.06 -0.87 0.00 0.00 0.71 0.00 0.00 54.79 54.69 1ud9 n ASP 179 Cb 0.13 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.23 1ud9 n ASP 179 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1ud9 n THR 180 N -0.90 0.40 -2.16 -3.53 -1.04 -0.55 -4.98 114.28 101.52 1ud9 n THR 180 Ca 0.14 -0.60 -0.18 0.00 -2.04 0.00 0.00 64.05 61.37 1ud9 n THR 180 Cb 0.06 0.90 -0.03 0.00 -1.82 0.00 0.00 70.33 69.45 1ud9 n THR 180 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ud9 n GLY 181 N -0.20 0.13 0.00 3.41 0.00 -0.26 -4.83 105.19 103.43 1ud9 n GLY 181 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1ud9 n GLY 181 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ud9 n SER 182 N -1.70 1.12 -4.06 1.61 3.41 -0.69 -4.96 113.62 108.35 1ud9 n SER 182 Ca -0.21 -1.51 -0.29 0.00 -0.26 0.00 0.00 58.87 56.60 1ud9 n SER 182 Cb 0.64 0.00 -0.17 0.00 -0.26 0.00 0.00 64.21 64.43 1ud9 n SER 182 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1ud9 s LEU 183 N -0.51 1.76 0.03 1.04 1.98 -1.14 -0.75 118.68 121.10 1ud9 s LEU 183 Ca 0.00 -0.46 0.21 0.00 -2.89 0.00 0.00 54.13 50.99 1ud9 s LEU 183 Cb 0.00 -1.16 -0.21 0.00 0.66 0.00 0.00 46.19 45.48 1ud9 s LEU 183 CO 0.00 0.01 0.64 0.00 -1.89 0.00 0.00 176.35 175.10 1ud9 n ALA 184 N 4.31 2.50 -3.57 5.97 0.00 0.48 -4.24 120.51 125.96 1ud9 n ALA 184 Ca -0.19 -0.52 -0.06 0.00 0.00 0.00 0.00 53.44 52.67 1ud9 n ALA 184 Cb 0.51 -0.82 -0.03 0.00 0.00 0.00 0.00 19.45 19.11 1ud9 n ALA 184 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1ud9 s ASP 185 N -5.00 -0.23 -0.17 0.00 3.68 -1.24 -5.00 116.67 108.71 1ud9 s ASP 185 Ca -0.06 0.09 -0.13 0.00 2.13 0.00 0.00 52.55 54.58 1ud9 s ASP 185 Cb 0.11 0.22 0.05 0.00 -1.45 0.00 0.00 42.92 41.86 1ud9 s ASP 185 CO 0.86 -0.33 0.45 -0.51 0.13 0.00 0.00 175.17 175.77 1ud9 s ILE 186 N -2.14 -0.01 -0.28 4.11 2.07 -1.26 -0.70 121.20 122.98 1ud9 s ILE 186 Ca 0.06 0.04 -0.05 0.00 -1.41 0.00 0.00 60.65 59.28 1ud9 s ILE 186 Cb -0.01 -0.64 0.01 0.00 0.13 0.00 0.00 42.46 41.96 1ud9 s ILE 186 CO -0.05 0.01 0.04 -1.61 -1.91 0.00 0.00 174.94 171.43 1ud9 s GLU 187 N 0.75 3.02 -0.19 3.50 2.02 -0.02 -4.99 118.70 122.79 1ud9 s GLU 187 Ca -0.04 -0.89 -0.03 0.00 0.02 0.00 0.00 54.97 54.03 1ud9 s GLU 187 Cb -0.05 -3.27 -0.01 0.00 0.10 0.00 0.00 34.13 30.89 1ud9 s GLU 187 CO -0.05 -0.43 -0.07 0.12 0.02 0.00 0.00 175.26 174.85 1ud9 s PHE 188 N 1.45 2.93 -0.09 1.61 5.36 -1.26 -1.83 117.98 126.15 1ud9 s PHE 188 Ca 0.02 -0.77 -0.02 0.00 -0.96 0.00 0.00 56.93 55.20 1ud9 s PHE 188 Cb -0.17 -2.01 -0.05 0.00 -0.34 0.00 0.00 43.02 40.45 1ud9 s PHE 188 CO 0.01 -0.38 -0.10 0.09 -1.46 0.00 0.00 175.22 173.38 1ud9 n ASN 189 N 4.27 2.22 -3.55 6.13 3.02 -0.29 -5.04 115.26 122.01 1ud9 n ASN 189 Ca -0.18 0.02 -0.17 0.00 -0.03 0.00 0.00 54.58 54.22 1ud9 n ASN 189 Cb 0.52 -0.20 -0.06 0.00 -0.61 0.00 0.00 39.78 39.42 1ud9 n ASN 189 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1ud9 s LYS 190 N -2.18 1.01 0.40 3.52 2.20 -1.01 -5.08 119.74 118.61 1ud9 s LYS 190 Ca -0.13 0.42 -0.26 0.00 -0.36 0.00 0.00 55.97 55.64 1ud9 s LYS 190 Cb 0.04 0.48 -0.09 0.00 -1.51 0.00 0.00 37.83 36.75 1ud9 s LYS 190 CO 0.19 -0.28 1.34 -1.21 -0.36 0.00 0.00 175.35 175.03 1ud9 s GLU 191 N -0.84 3.97 0.08 4.03 2.02 -1.26 -4.47 118.70 122.23 1ud9 s GLU 191 Ca -0.09 2.25 -0.12 0.00 0.02 0.00 0.00 54.97 57.03 1ud9 s GLU 191 Cb -0.01 -2.79 0.01 0.00 0.10 0.00 0.00 34.13 31.44 1ud9 s GLU 191 CO 0.08 -0.52 0.27 0.45 0.02 0.00 0.00 175.26 175.56 1ud9 s SER 192 N -0.61 -0.04 -0.09 -0.19 0.15 -0.96 -4.96 113.70 107.00 1ud9 s SER 192 Ca 0.56 -0.42 -0.09 0.00 0.70 0.00 0.00 55.95 56.71 1ud9 s SER 192 Cb -0.40 0.37 0.02 0.00 -1.71 0.00 0.00 66.02 64.30 1ud9 s SER 192 CO 0.52 -0.71 0.25 -0.94 1.20 0.00 0.00 173.24 173.56 1ud9 s SER 193 N -2.55 -0.26 0.33 5.45 1.04 -1.26 -1.13 113.70 115.32 1ud9 s SER 193 Ca 0.01 0.50 -0.02 0.00 0.48 0.00 0.00 55.95 56.92 1ud9 s SER 193 Cb 0.02 0.51 -0.00 0.00 0.10 0.00 0.00 66.02 66.65 1ud9 s SER 193 CO -0.08 -0.09 0.44 -0.55 0.98 0.00 0.00 173.24 173.94 1ud9 s SER 194 N 0.14 0.86 -0.03 7.02 0.15 0.08 -4.15 113.70 117.77 1ud9 s SER 194 Ca -0.00 -1.46 -0.05 0.00 0.70 0.00 0.00 55.95 55.14 1ud9 s SER 194 Cb -0.02 0.64 0.01 0.00 -1.71 0.00 0.00 66.02 64.93 1ud9 s SER 194 CO 0.00 -1.25 0.12 0.00 1.20 0.00 0.00 173.24 173.32 1ud9 s ALA 195 N -3.21 -0.30 0.03 5.45 0.00 -1.26 -1.70 121.76 120.76 1ud9 s ALA 195 Ca 0.31 0.12 -0.10 0.00 0.00 0.00 0.00 51.96 52.28 1ud9 s ALA 195 Cb 0.00 -0.07 0.01 0.00 0.00 0.00 0.00 23.12 23.06 1ud9 s ALA 195 CO 0.20 -0.13 0.22 0.71 0.00 0.00 0.00 175.76 176.76 1ud9 s TYR 196 N -0.59 -0.00 -0.23 0.00 1.51 -0.44 -0.95 117.35 116.65 1ud9 s TYR 196 Ca -0.07 -0.15 -0.29 0.00 -1.01 0.00 0.00 57.07 55.55 1ud9 s TYR 196 Cb -0.04 0.00 -0.02 0.00 -0.11 0.00 0.00 41.96 41.79 1ud9 s TYR 196 CO 0.01 -0.42 1.47 0.34 -1.11 0.00 0.00 175.55 175.84 1ud9 s ASP 197 N -1.89 6.56 0.29 2.29 -1.08 -1.26 -0.62 116.67 120.96 1ud9 s ASP 197 Ca -0.08 1.52 0.26 0.00 -0.52 0.00 0.00 52.55 53.73 1ud9 s ASP 197 Cb -0.02 -2.54 0.95 0.00 -1.46 0.00 0.00 42.92 39.85 1ud9 s ASP 197 CO -0.02 -1.12 1.76 1.62 0.52 0.00 0.00 175.17 177.93 1ud9 h VAL 198 N 5.98 0.00 -0.51 1.11 3.04 -1.74 -2.89 116.25 121.24 1ud9 h VAL 198 Ca -0.31 -0.38 -0.10 0.00 -1.01 0.00 0.00 66.70 64.90 1ud9 h VAL 198 Cb 1.13 1.24 -0.02 0.00 -2.01 0.00 0.00 31.29 31.63 1ud9 h VAL 198 CO 1.01 0.00 -0.09 -0.08 -1.01 0.00 0.00 177.57 177.40 1ud9 h GLU 199 N 0.00 0.93 -0.39 4.17 4.81 -1.90 0.30 114.58 122.50 1ud9 h GLU 199 Ca 0.00 -0.32 -0.06 0.00 -0.13 0.00 0.00 59.36 58.85 1ud9 h GLU 199 Cb 0.53 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 1ud9 h GLU 199 CO 0.00 0.98 -0.01 1.88 -0.73 0.00 0.00 179.01 181.13 1ud9 h TYR 200 N 0.84 0.75 -0.61 0.92 -1.99 -1.90 -2.14 116.97 112.84 1ud9 h TYR 200 Ca 0.14 -0.13 -0.09 0.00 2.00 0.00 0.00 58.73 60.64 1ud9 h TYR 200 Cb 0.62 -0.19 -0.02 0.00 2.00 0.00 0.00 36.73 39.13 1ud9 h TYR 200 CO 0.04 0.78 0.02 -0.07 -0.00 0.00 0.00 178.16 178.93 1ud9 h LEU 201 N 0.51 1.03 -1.47 3.88 3.38 -1.45 -2.67 115.31 118.52 1ud9 h LEU 201 Ca 0.11 -0.30 -0.03 0.00 0.09 0.00 0.00 57.88 57.75 1ud9 h LEU 201 Cb 0.48 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1ud9 h LEU 201 CO 0.02 1.07 -0.01 -1.13 0.09 0.00 0.00 178.44 178.48 1ud9 h ASN 202 N 0.96 0.30 -0.27 -0.43 -1.24 -0.89 -2.42 115.58 111.59 1ud9 h ASN 202 Ca 0.17 -0.04 0.00 0.00 0.71 0.00 0.00 56.30 57.14 1ud9 h ASN 202 Cb 0.53 -0.08 -0.01 0.00 0.73 0.00 0.00 38.32 39.49 1ud9 h ASN 202 CO 0.03 0.37 0.18 0.44 -1.29 0.00 0.00 177.43 177.15 1ud9 h ASP 203 N 0.32 0.32 -0.51 1.15 3.32 -1.02 -2.74 116.42 117.26 1ud9 h ASP 203 Ca 0.07 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1ud9 h ASP 203 Cb 0.24 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.71 1ud9 h ASP 203 CO 0.01 0.23 0.00 2.30 -1.72 0.00 0.00 179.24 180.06 1ud9 n ILE 204 N -4.49 1.46 0.15 0.35 -6.64 -0.93 -4.62 119.36 104.64 1ud9 n ILE 204 Ca 0.01 -1.19 0.19 0.00 -1.77 0.00 0.00 62.75 59.99 1ud9 n ILE 204 Cb 0.07 0.27 0.77 0.00 -1.44 0.00 0.00 39.64 39.32 1ud9 n ILE 204 CO 0.00 0.00 0.00 -0.29 -1.77 0.00 0.00 176.55 174.49 1ud9 h ILE 205 N 3.10 0.33 0.00 7.28 2.10 -1.25 -1.07 117.51 128.00 1ud9 h ILE 205 Ca 0.00 0.00 -0.01 0.00 1.08 0.00 0.00 64.86 65.93 1ud9 h ILE 205 Cb 1.12 0.68 -0.00 0.00 -1.09 0.00 0.00 36.82 37.53 1ud9 h ILE 205 CO 0.11 0.00 -0.06 0.77 -1.08 0.00 0.00 178.15 177.89 1ud9 h SER 206 N 0.00 0.00 0.15 2.19 4.64 -1.85 -1.62 113.55 117.07 1ud9 h SER 206 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1ud9 h SER 206 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 1ud9 h SER 206 CO -0.00 0.06 0.00 -0.07 -0.87 0.00 0.00 176.83 175.95 1ud9 h LEU 207 N 0.00 0.00 -0.68 5.97 3.38 -1.39 -1.97 115.31 120.62 1ud9 h LEU 207 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ud9 h LEU 207 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1ud9 h LEU 207 CO 0.01 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.89 1ud9 n THR 208 N -2.72 0.79 0.68 0.22 -2.24 -0.61 -1.50 114.28 108.90 1ud9 n THR 208 Ca -0.02 0.17 0.12 0.00 -2.27 0.00 0.00 64.05 62.06 1ud9 n THR 208 Cb 0.09 -1.11 0.47 0.00 -2.10 0.00 0.00 70.33 67.68 1ud9 n THR 208 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1ud9 n LYS 209 N -2.29 0.13 0.21 -0.78 5.02 -0.74 -3.42 118.16 116.29 1ud9 n LYS 209 Ca 0.02 0.20 0.08 0.00 -2.02 0.00 0.00 58.31 56.59 1ud9 n LYS 209 Cb 0.25 -1.68 0.40 0.00 -0.02 0.00 0.00 35.03 33.98 1ud9 n LYS 209 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1ud9 h LEU 210 N 0.00 0.00 -7.18 -0.35 3.38 -1.45 -3.46 115.31 106.24 1ud9 h LEU 210 Ca 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1ud9 h LEU 210 Cb 0.53 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.13 1ud9 h LEU 210 CO 0.00 0.27 0.06 -0.94 0.09 0.00 0.00 178.44 177.93 1ud9 s SER 211 N -6.27 -0.44 0.23 -0.43 1.04 -1.22 -4.72 113.70 101.89 1ud9 s SER 211 Ca 0.01 0.07 -0.04 0.00 0.48 0.00 0.00 55.95 56.46 1ud9 s SER 211 Cb 0.10 0.51 0.23 0.00 0.10 0.00 0.00 66.02 66.97 1ud9 s SER 211 CO 0.66 -0.79 1.69 0.44 0.98 0.00 0.00 173.24 176.21 1ud9 h ASP 212 N 2.54 0.82 -3.09 7.02 3.32 -1.89 -3.42 116.42 121.72 1ud9 h ASP 212 Ca -0.32 -0.24 -0.65 0.00 0.02 0.00 0.00 57.03 55.85 1ud9 h ASP 212 Cb 1.24 -0.22 -0.17 0.00 0.22 0.00 0.00 39.33 40.40 1ud9 h ASP 212 CO 0.41 0.94 -0.79 -0.31 -1.72 0.00 0.00 179.24 177.77 1ud9 s TYR 213 N -4.86 2.39 -0.04 4.55 1.51 -1.26 -0.00 117.35 119.64 1ud9 s TYR 213 Ca -0.10 -0.32 0.03 0.00 -1.01 0.00 0.00 57.07 55.68 1ud9 s TYR 213 Cb 0.14 -1.17 0.00 0.00 -0.11 0.00 0.00 41.96 40.82 1ud9 s TYR 213 CO 0.83 0.51 -0.14 0.54 -1.11 0.00 0.00 175.55 176.18 1ud9 s VAL 214 N -1.72 1.19 -0.19 0.71 0.11 0.18 -4.54 120.40 116.13 1ud9 s VAL 214 Ca 0.22 -0.57 -0.21 0.00 -2.93 0.00 0.00 61.98 58.50 1ud9 s VAL 214 Cb -0.08 -1.04 -0.02 0.00 -1.53 0.00 0.00 36.38 33.70 1ud9 s VAL 214 CO 0.12 0.35 0.64 -0.54 -3.33 0.00 0.00 175.10 172.34 1ud9 s LYS 215 N 0.22 4.22 -0.22 1.54 1.02 -0.39 -0.92 119.74 125.20 1ud9 s LYS 215 Ca -0.06 0.65 -0.04 0.00 0.02 0.00 0.00 55.97 56.54 1ud9 s LYS 215 Cb -0.12 -3.57 -0.01 0.00 -0.52 0.00 0.00 37.83 33.61 1ud9 s LYS 215 CO 0.02 -0.24 -0.03 0.08 -0.92 0.00 0.00 175.35 174.26 1ud9 s VAL 216 N 1.90 3.48 0.02 3.17 1.01 0.80 -0.69 120.40 130.09 1ud9 s VAL 216 Ca 0.29 -0.46 0.07 0.00 0.00 0.00 0.00 61.98 61.89 1ud9 s VAL 216 Cb -0.16 -2.59 -0.02 0.00 0.00 0.00 0.00 36.38 33.61 1ud9 s VAL 216 CO 0.11 0.41 -0.21 0.00 0.00 0.00 0.00 175.10 175.41 1ud9 s ALA 217 N 1.48 1.73 0.25 5.51 0.00 -0.01 -0.59 121.76 130.14 1ud9 s ALA 217 Ca 0.06 -0.98 -0.21 0.00 0.00 0.00 0.00 51.96 50.83 1ud9 s ALA 217 Cb -0.14 -0.38 0.06 0.00 0.00 0.00 0.00 23.12 22.66 1ud9 s ALA 217 CO -0.02 0.40 0.93 -0.59 0.00 0.00 0.00 175.76 176.48 1ud9 s PHE 218 N -0.65 0.03 0.16 0.00 -0.12 -0.63 -0.83 117.98 115.93 1ud9 s PHE 218 Ca 0.08 -0.50 -0.18 0.00 -0.05 0.00 0.00 56.93 56.28 1ud9 s PHE 218 Cb -0.08 0.73 0.04 0.00 -0.63 0.00 0.00 43.02 43.08 1ud9 s PHE 218 CO 0.01 -1.12 0.49 0.00 -0.05 0.00 0.00 175.22 174.54 1ud9 s ALA 219 N -2.56 -1.06 -0.04 1.99 0.00 -1.26 -0.83 121.76 118.01 1ud9 s ALA 219 Ca 0.17 -0.02 -0.36 0.00 0.00 0.00 0.00 51.96 51.76 1ud9 s ALA 219 Cb -0.03 0.80 -0.14 0.00 0.00 0.00 0.00 23.12 23.75 1ud9 s ALA 219 CO 0.07 -0.73 1.70 -0.25 0.00 0.00 0.00 175.76 176.54 1ud9 n ASP 220 N -0.30 2.88 -2.97 0.00 10.43 -1.26 -1.73 116.55 123.59 1ud9 n ASP 220 Ca -0.14 1.04 -0.20 0.00 2.57 0.00 0.00 54.79 58.07 1ud9 n ASP 220 Cb 0.63 -1.31 0.01 0.00 1.84 0.00 0.00 41.12 42.29 1ud9 n ASP 220 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1ud9 n GLN 221 N 4.94 -3.37 -4.51 -1.24 3.00 -1.26 -4.98 117.38 109.97 1ud9 n GLN 221 Ca 0.21 0.65 -0.24 0.00 -0.01 0.00 0.00 57.00 57.61 1ud9 n GLN 221 Cb 0.24 -5.37 -0.11 0.00 0.00 0.00 0.00 30.24 25.01 1ud9 n GLN 221 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.06 177.21 1ud9 s LYS 222 N -5.61 1.74 0.70 -1.09 1.02 -0.71 -4.84 119.74 110.96 1ud9 s LYS 222 Ca 0.24 -1.93 -0.16 0.00 0.02 0.00 0.00 55.97 54.14 1ud9 s LYS 222 Cb -0.12 -1.39 0.02 0.00 -0.52 0.00 0.00 37.83 35.82 1ud9 s LYS 222 CO 0.30 0.01 1.22 -2.30 -0.92 0.00 0.00 175.35 173.66 1ud9 n PRO 223 N -0.75 0.75 -3.51 -1.68 -0.02 -1.26 -4.35 135.00 124.18 1ud9 n PRO 223 Ca -0.05 0.32 -0.38 0.00 -2.02 0.00 0.00 63.50 61.37 1ud9 n PRO 223 Cb 0.65 -2.46 -0.06 0.00 -0.02 0.00 0.00 33.50 31.61 1ud9 n PRO 223 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 1ud9 s MET 224 N -3.57 3.95 -0.15 -0.52 1.75 -0.19 -4.35 119.30 116.23 1ud9 s MET 224 Ca 0.79 0.36 0.02 0.00 -1.25 0.00 0.00 55.69 55.61 1ud9 s MET 224 Cb -0.35 -3.25 0.01 0.00 2.84 0.00 0.00 34.83 34.08 1ud9 s MET 224 CO 0.45 0.62 -0.20 -1.14 -0.65 0.00 0.00 175.02 174.09 1ud9 s GLN 225 N -0.82 3.06 -0.15 4.11 0.74 -0.01 -0.97 119.66 125.62 1ud9 s GLN 225 Ca 0.23 -0.83 -0.03 0.00 0.05 0.00 0.00 55.36 54.78 1ud9 s GLN 225 Cb -0.16 -2.48 -0.02 0.00 1.10 0.00 0.00 33.01 31.44 1ud9 s GLN 225 CO 0.12 -0.02 -0.07 -0.51 -0.55 0.00 0.00 175.29 174.26 1ud9 s LEU 226 N 0.84 3.09 -0.11 3.68 1.43 0.91 -0.83 118.68 127.70 1ud9 s LEU 226 Ca -0.06 -0.19 0.03 0.00 -1.03 0.00 0.00 54.13 52.88 1ud9 s LEU 226 Cb -0.15 -1.73 0.01 0.00 0.03 0.00 0.00 46.19 44.34 1ud9 s LEU 226 CO -0.02 0.17 -0.20 -0.70 0.23 0.00 0.00 176.35 175.83 1ud9 s GLU 227 N 0.35 2.67 -0.34 1.70 2.12 0.13 -0.64 118.70 124.70 1ud9 s GLU 227 Ca -0.06 -0.73 -0.06 0.00 0.36 0.00 0.00 54.97 54.48 1ud9 s GLU 227 Cb -0.15 -2.14 0.05 0.00 0.26 0.00 0.00 34.13 32.15 1ud9 s GLU 227 CO 0.04 0.03 0.11 -0.06 -0.54 0.00 0.00 175.26 174.83 1ud9 s PHE 228 N 0.72 3.29 -0.23 5.30 0.40 0.68 -1.26 117.98 126.89 1ud9 s PHE 228 Ca -0.11 -1.59 -0.18 0.00 -0.60 0.00 0.00 56.93 54.45 1ud9 s PHE 228 Cb -0.16 -2.38 -0.03 0.00 0.51 0.00 0.00 43.02 40.96 1ud9 s PHE 228 CO 0.02 -0.77 0.50 -0.80 0.70 0.00 0.00 175.22 174.86 1ud9 s ASN 229 N 1.48 6.49 0.32 1.36 0.01 -1.26 -1.21 114.94 122.12 1ud9 s ASN 229 Ca -0.01 0.58 0.07 0.00 -0.71 0.00 0.00 52.86 52.79 1ud9 s ASN 229 Cb -0.20 -2.28 -0.02 0.00 0.41 0.00 0.00 41.25 39.17 1ud9 s ASN 229 CO 0.02 -0.21 0.42 -0.04 -1.51 0.00 0.00 177.10 175.77 1ud9 s MET 230 N 1.87 3.09 0.31 -0.60 -1.94 0.20 -4.73 119.30 117.49 1ud9 s MET 230 Ca 0.22 -1.03 -0.29 0.00 -1.71 0.00 0.00 55.69 52.88 1ud9 s MET 230 Cb -0.15 -2.76 -0.10 0.00 2.01 0.00 0.00 34.83 33.82 1ud9 s MET 230 CO 0.09 0.13 1.38 -1.21 -0.01 0.00 0.00 175.02 175.40 1ud9 s GLU 231 N -4.11 4.29 0.00 2.03 2.02 -1.26 -2.74 118.70 118.93 1ud9 s GLU 231 Ca 0.43 2.30 0.00 0.00 0.02 0.00 0.00 54.97 57.71 1ud9 s GLU 231 Cb -0.09 -3.07 0.00 0.00 0.10 0.00 0.00 34.13 31.07 1ud9 s GLU 231 CO 0.30 -0.32 0.00 0.41 0.02 0.00 0.00 175.26 175.67 1ud9 n GLY 232 N 1.24 0.75 0.00 -1.39 0.00 -1.26 -4.10 105.19 100.44 1ud9 n GLY 232 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1ud9 n GLY 232 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ud9 n GLY 233 N -2.00 0.72 3.74 -0.02 0.00 -1.11 -3.85 105.19 102.68 1ud9 n GLY 233 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1ud9 n GLY 233 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ud9 s GLY 234 N -0.64 2.64 -0.17 -0.02 0.00 -1.20 -4.65 107.32 103.27 1ud9 s GLY 234 Ca 0.00 0.99 -0.10 0.00 0.00 0.00 0.00 44.72 45.61 1ud9 s GLY 234 CO 0.00 1.39 0.41 1.25 0.00 0.00 0.00 173.10 176.15 1ud9 s LYS 235 N -3.52 0.41 -0.11 2.90 2.20 0.40 -0.63 119.74 121.39 1ud9 s LYS 235 Ca 0.77 0.75 0.02 0.00 -0.36 0.00 0.00 55.97 57.15 1ud9 s LYS 235 Cb -0.31 0.02 -0.01 0.00 -1.51 0.00 0.00 37.83 36.02 1ud9 s LYS 235 CO 0.37 -0.14 -0.17 0.08 -0.36 0.00 0.00 175.35 175.13 1ud9 s VAL 236 N 1.20 2.72 -0.08 4.02 1.01 -0.35 -1.18 120.40 127.74 1ud9 s VAL 236 Ca -0.08 -0.79 0.04 0.00 0.00 0.00 0.00 61.98 61.16 1ud9 s VAL 236 Cb -0.07 -2.11 -0.00 0.00 0.00 0.00 0.00 36.38 34.20 1ud9 s VAL 236 CO -0.11 0.54 -0.23 -0.89 0.00 0.00 0.00 175.10 174.42 1ud9 s THR 237 N 0.23 1.94 -0.10 3.92 2.01 0.68 -0.23 115.64 124.09 1ud9 s THR 237 Ca -0.11 -0.96 0.03 0.00 0.31 0.00 0.00 61.69 60.95 1ud9 s THR 237 Cb -0.16 -1.67 -0.01 0.00 0.01 0.00 0.00 72.50 70.67 1ud9 s THR 237 CO 0.06 0.54 -0.19 -0.47 -0.69 0.00 0.00 174.62 173.86 1ud9 s TYR 238 N 0.24 2.64 -0.06 4.92 5.04 0.19 -0.20 117.35 130.12 1ud9 s TYR 238 Ca -0.14 -0.75 0.04 0.00 -2.44 0.00 0.00 57.07 53.78 1ud9 s TYR 238 Cb -0.16 -1.73 0.00 0.00 0.35 0.00 0.00 41.96 40.42 1ud9 s TYR 238 CO 0.07 -0.24 -0.18 -0.51 -1.34 0.00 0.00 175.55 173.35 1ud9 s LEU 239 N 0.13 1.88 -0.07 6.97 1.43 -0.45 -0.06 118.68 128.51 1ud9 s LEU 239 Ca -0.10 -0.39 -0.00 0.00 -1.03 0.00 0.00 54.13 52.61 1ud9 s LEU 239 Cb -0.16 -1.05 0.02 0.00 0.03 0.00 0.00 46.19 45.04 1ud9 s LEU 239 CO 0.06 0.13 -0.04 -0.22 0.23 0.00 0.00 176.35 176.50 1ud9 s LEU 240 N 0.27 1.03 0.65 1.79 2.96 -0.14 -1.76 118.68 123.48 1ud9 s LEU 240 Ca -0.10 -0.17 -0.18 0.00 -0.22 0.00 0.00 54.13 53.47 1ud9 s LEU 240 Cb -0.14 -0.57 -0.01 0.00 0.50 0.00 0.00 46.19 45.97 1ud9 s LEU 240 CO 0.04 -0.12 1.25 0.00 -1.32 0.00 0.00 176.35 176.20 1ud9 s ALA 241 N 1.51 2.37 0.43 5.97 0.00 -0.20 -1.02 121.76 130.82 1ud9 s ALA 241 Ca -0.01 1.07 -0.04 0.00 0.00 0.00 0.00 51.96 52.98 1ud9 s ALA 241 Cb -0.13 -3.50 -0.04 0.00 0.00 0.00 0.00 23.12 19.45 1ud9 s ALA 241 CO -0.04 -1.52 0.71 -1.25 0.00 0.00 0.00 175.76 173.66 1ud9 s PRO 242 N -3.49 3.56 0.51 0.00 0.04 -1.26 -4.71 135.00 129.66 1ud9 s PRO 242 Ca 0.79 0.09 0.03 0.00 0.04 0.00 0.00 61.00 61.95 1ud9 s PRO 242 Cb -0.33 -2.46 0.03 0.00 0.04 0.00 0.00 34.50 31.77 1ud9 s PRO 242 CO 0.39 -0.08 0.72 0.15 0.04 0.00 0.00 177.00 178.22 1ud9 s LYS 243 N -4.48 2.64 0.23 4.56 1.02 -0.12 -5.00 119.74 118.59 1ud9 s LYS 243 Ca 0.46 -0.87 0.06 0.00 0.02 0.00 0.00 55.97 55.64 1ud9 s LYS 243 Cb -0.10 -2.55 0.21 0.00 -0.52 0.00 0.00 37.83 34.86 1ud9 s LYS 243 CO 0.41 -0.58 1.53 -0.07 -0.92 0.00 0.00 175.35 175.71 1ud9 h LEU 244 N 0.22 0.19 0.00 3.17 3.38 -1.98 -3.40 115.31 116.89 1ud9 h LEU 244 Ca -0.42 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.43 1ud9 h LEU 244 Cb 1.29 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.98 1ud9 h LEU 244 CO 0.51 0.81 0.00 -1.54 0.09 0.00 0.00 178.44 178.31