#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2in0 s LEU 2 N 0.00 3.55 0.60 0.00 1.43 0.56 -1.28 118.68 123.53 2in0 s LEU 2 Ca 0.00 0.03 -0.15 0.00 -1.03 0.00 0.00 54.13 52.98 2in0 s LEU 2 Cb 0.00 -1.99 -0.03 0.00 0.03 0.00 0.00 46.19 44.20 2in0 s LEU 2 CO 0.00 0.30 1.05 0.00 0.23 0.00 0.00 176.35 177.93 2in0 s ALA 3 N -1.05 2.77 0.37 4.21 0.00 -0.47 0.54 121.76 128.13 2in0 s ALA 3 Ca 0.18 0.32 -0.28 0.00 0.00 0.00 0.00 51.96 52.18 2in0 s ALA 3 Cb -0.11 -3.21 -0.11 0.00 0.00 0.00 0.00 23.12 19.69 2in0 s ALA 3 CO 0.09 -0.82 1.51 -2.00 0.00 0.00 0.00 175.76 174.54 2in0 s GLU 4 N -4.24 4.10 0.00 0.00 2.12 -0.31 -1.68 118.70 118.68 2in0 s GLU 4 Ca 0.62 2.60 0.00 0.00 0.36 0.00 0.00 54.97 58.55 2in0 s GLU 4 Cb -0.15 -2.97 0.00 0.00 0.26 0.00 0.00 34.13 31.27 2in0 s GLU 4 CO 0.39 -0.57 0.00 0.41 -0.54 0.00 0.00 175.26 174.96 2in0 n GLY 5 N 0.67 3.29 3.69 -1.50 0.00 -1.26 -4.97 105.19 105.12 2in0 n GLY 5 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2in0 n GLY 5 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2in0 s THR 6 N -2.89 2.59 -0.04 2.61 2.01 -0.68 -4.79 115.64 114.45 2in0 s THR 6 Ca 0.00 0.14 -0.17 0.00 0.31 0.00 0.00 61.69 61.97 2in0 s THR 6 Cb 0.00 -3.09 -0.05 0.00 0.01 0.00 0.00 72.50 69.37 2in0 s THR 6 CO 0.00 0.00 0.45 -0.13 -0.69 0.00 0.00 174.62 174.25 2in0 s ARG 7 N 2.55 4.12 -0.13 4.92 0.52 -1.26 -0.85 118.95 128.82 2in0 s ARG 7 Ca 0.79 0.46 0.01 0.00 -0.52 0.00 0.00 55.73 56.47 2in0 s ARG 7 Cb -0.45 -3.30 0.02 0.00 0.52 0.00 0.00 34.95 31.73 2in0 s ARG 7 CO 0.35 0.48 -0.17 0.42 0.02 0.00 0.00 175.30 176.41 2in0 s ILE 8 N -0.44 1.68 -0.11 1.52 1.01 0.15 -0.53 121.20 124.47 2in0 s ILE 8 Ca 0.25 -0.74 -0.23 0.00 0.00 0.00 0.00 60.65 59.93 2in0 s ILE 8 Cb -0.16 -1.53 -0.03 0.00 0.01 0.00 0.00 42.46 40.74 2in0 s ILE 8 CO 0.13 0.48 0.71 0.12 0.00 0.00 0.00 174.94 176.38 2in0 s PHE 9 N 1.10 3.50 -0.46 3.97 5.36 -1.25 -1.02 117.98 129.17 2in0 s PHE 9 Ca -0.03 1.18 -0.16 0.00 -0.96 0.00 0.00 56.93 56.97 2in0 s PHE 9 Cb -0.14 -2.85 0.06 0.00 -0.34 0.00 0.00 43.02 39.75 2in0 s PHE 9 CO -0.05 -0.03 0.41 0.34 -1.46 0.00 0.00 175.22 174.43 2in0 s ASP 10 N 0.95 6.15 0.60 6.13 -1.08 -0.39 -3.60 116.67 125.44 2in0 s ASP 10 Ca 0.36 -1.17 0.38 0.00 -0.52 0.00 0.00 52.55 51.60 2in0 s ASP 10 Cb -0.17 -2.20 1.83 0.00 -1.46 0.00 0.00 42.92 40.92 2in0 s ASP 10 CO 0.15 -0.65 2.15 1.55 0.52 0.00 0.00 175.17 178.90 2in0 h PRO 11 N 8.77 0.00 0.00 4.34 0.13 -1.85 0.73 132.00 144.12 2in0 h PRO 11 Ca -0.28 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.84 2in0 h PRO 11 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2in0 h PRO 11 CO 0.86 0.00 -0.03 0.28 -0.23 0.00 0.00 178.00 178.88 2in0 h VAL 12 N 0.00 1.70 0.00 1.56 2.07 -1.92 -3.36 116.25 116.31 2in0 h VAL 12 Ca -0.00 -2.11 -0.02 0.00 0.82 0.00 0.00 66.70 65.39 2in0 h VAL 12 Cb 0.29 3.13 -0.00 0.00 -1.52 0.00 0.00 31.29 33.20 2in0 h VAL 12 CO 0.00 0.55 -1.22 0.35 0.02 0.00 0.00 177.57 177.27 2in0 n THR 13 N -4.64 0.59 -0.99 2.57 -2.24 -1.20 -4.95 114.28 103.43 2in0 n THR 13 Ca -0.10 -0.56 0.00 0.00 -2.27 0.00 0.00 64.05 61.12 2in0 n THR 13 Cb 0.45 -0.33 0.00 0.00 -2.10 0.00 0.00 70.33 68.35 2in0 n THR 13 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2in0 n GLY 14 N 1.22 0.54 3.82 3.38 0.00 0.25 -5.02 105.19 109.38 2in0 n GLY 14 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 2in0 n GLY 14 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2in0 s THR 15 N -2.12 4.98 -0.22 2.61 2.01 -1.18 -4.83 115.64 116.90 2in0 s THR 15 Ca 0.00 0.92 -0.09 0.00 0.31 0.00 0.00 61.69 62.84 2in0 s THR 15 Cb 0.00 -3.76 -0.04 0.00 0.01 0.00 0.00 72.50 68.71 2in0 s THR 15 CO 0.00 0.56 0.10 -0.89 -0.69 0.00 0.00 174.62 173.70 2in0 s THR 16 N -0.95 4.89 0.20 -0.82 2.01 -1.26 -1.26 115.64 118.45 2in0 s THR 16 Ca 0.25 0.01 0.09 0.00 0.31 0.00 0.00 61.69 62.35 2in0 s THR 16 Cb -0.17 -3.25 -0.04 0.00 0.01 0.00 0.00 72.50 69.04 2in0 s THR 16 CO 0.14 0.39 -0.08 -1.00 -0.69 0.00 0.00 174.62 173.38 2in0 s HIS 17 N 0.89 2.63 -0.09 4.92 3.76 -0.19 -4.90 115.29 122.32 2in0 s HIS 17 Ca 0.05 -0.23 -0.17 0.00 -0.15 0.00 0.00 55.06 54.56 2in0 s HIS 17 Cb -0.13 -1.25 -0.05 0.00 1.11 0.00 0.00 32.58 32.26 2in0 s HIS 17 CO 0.03 0.55 0.45 1.03 -0.85 0.00 0.00 174.74 175.95 2in0 s ARG 18 N -3.04 4.24 0.36 1.40 0.52 -1.26 0.31 118.95 121.47 2in0 s ARG 18 Ca 0.26 0.43 0.08 0.00 -0.52 0.00 0.00 55.73 55.98 2in0 s ARG 18 Cb -0.08 -3.38 0.80 0.00 0.52 0.00 0.00 34.95 32.81 2in0 s ARG 18 CO 0.16 0.31 1.91 0.97 0.02 0.00 0.00 175.30 178.67 2in0 h ILE 19 N 4.43 0.91 0.00 1.52 2.10 -1.30 -1.08 117.51 124.09 2in0 h ILE 19 Ca -0.44 -0.24 -0.04 0.00 1.08 0.00 0.00 64.86 65.22 2in0 h ILE 19 Cb 1.19 0.15 -0.01 0.00 -1.09 0.00 0.00 36.82 37.06 2in0 h ILE 19 CO 0.72 0.13 -0.19 1.05 -1.08 0.00 0.00 178.15 178.78 2in0 h GLU 20 N 0.70 0.00 0.00 2.19 9.09 -1.87 -1.42 114.58 123.27 2in0 h GLU 20 Ca 0.39 0.00 -0.20 0.00 0.05 0.00 0.00 59.36 59.59 2in0 h GLU 20 Cb 0.53 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.63 2in0 h GLU 20 CO -0.15 0.19 -0.89 -0.44 0.05 0.00 0.00 179.01 177.76 2in0 h ASP 21 N 0.00 0.31 -0.44 3.06 3.32 -1.62 -1.09 116.42 119.96 2in0 h ASP 21 Ca -0.00 -0.25 -0.09 0.00 0.02 0.00 0.00 57.03 56.71 2in0 h ASP 21 Cb 0.35 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 2in0 h ASP 21 CO 0.02 1.05 -0.07 0.58 -1.72 0.00 0.00 179.24 179.11 2in0 h VAL 22 N 0.13 1.27 0.05 -1.35 2.07 -1.03 -0.84 116.25 116.54 2in0 h VAL 22 Ca -0.05 -1.15 -0.00 0.00 0.82 0.00 0.00 66.70 66.31 2in0 h VAL 22 Cb 1.53 1.12 0.00 0.00 -1.52 0.00 0.00 31.29 32.41 2in0 h VAL 22 CO 0.14 0.39 -0.02 0.58 0.02 0.00 0.00 177.57 178.68 2in0 h VAL 23 N 0.66 1.30 -0.26 2.57 2.07 -1.33 0.22 116.25 121.49 2in0 h VAL 23 Ca 0.12 -1.61 0.01 0.00 0.82 0.00 0.00 66.70 66.04 2in0 h VAL 23 Cb 0.59 2.29 -0.01 0.00 -1.52 0.00 0.00 31.29 32.64 2in0 h VAL 23 CO 0.04 0.38 0.17 0.44 0.02 0.00 0.00 177.57 178.61 2in0 h ASP 24 N -0.83 0.28 -0.43 0.57 3.32 -1.27 -1.89 116.42 116.17 2in0 h ASP 24 Ca -0.01 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2in0 h ASP 24 Cb 0.67 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.15 2in0 h ASP 24 CO 0.01 0.20 0.00 0.61 -1.72 0.00 0.00 179.24 178.34 2in0 n GLY 25 N -1.50 1.83 4.33 2.75 0.00 -0.32 -4.97 105.19 107.31 2in0 n GLY 25 Ca 0.01 -0.75 -0.35 0.00 0.00 0.00 0.00 46.02 44.93 2in0 n GLY 25 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2in0 n ARG 26 N 1.52 -1.51 -2.32 1.61 1.74 -0.12 -4.85 116.66 112.72 2in0 n ARG 26 Ca 0.20 0.19 -0.42 0.00 -0.77 0.00 0.00 57.85 57.05 2in0 n ARG 26 Cb 0.61 -4.30 -0.03 0.00 -1.02 0.00 0.00 32.46 27.72 2in0 n ARG 26 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2in0 s LYS 27 N -7.16 4.38 -0.27 5.56 1.02 -0.17 -4.93 119.74 118.16 2in0 s LYS 27 Ca 0.38 1.88 -0.06 0.00 0.02 0.00 0.00 55.97 58.20 2in0 s LYS 27 Cb -0.22 -3.34 -0.22 0.00 -0.52 0.00 0.00 37.83 33.52 2in0 s LYS 27 CO 0.98 -0.35 3.33 -0.35 -0.92 0.00 0.00 175.35 178.04 2in0 n PRO 28 N 4.12 2.16 -1.89 -1.68 -0.04 -1.26 -4.93 135.00 131.49 2in0 n PRO 28 Ca 0.10 -1.14 -0.29 0.00 -0.04 0.00 0.00 63.50 62.13 2in0 n PRO 28 Cb 0.45 -2.11 0.07 0.00 -0.04 0.00 0.00 33.50 31.87 2in0 n PRO 28 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2in0 s ILE 29 N 1.35 2.66 0.27 0.52 -4.36 -1.26 -4.82 121.20 115.56 2in0 s ILE 29 Ca 0.63 0.21 0.08 0.00 -0.26 0.00 0.00 60.65 61.32 2in0 s ILE 29 Cb 0.28 -3.21 -0.04 0.00 1.25 0.00 0.00 42.46 40.74 2in0 s ILE 29 CO -0.01 -0.28 0.10 -1.00 0.24 0.00 0.00 174.94 173.99 2in0 s HIS 30 N -3.48 2.85 0.18 1.37 3.76 -1.26 -1.53 115.29 117.19 2in0 s HIS 30 Ca 0.60 -0.21 -0.00 0.00 -0.15 0.00 0.00 55.06 55.30 2in0 s HIS 30 Cb -0.11 -1.36 -0.04 0.00 1.11 0.00 0.00 32.58 32.18 2in0 s HIS 30 CO 0.50 0.53 0.08 0.14 -0.85 0.00 0.00 174.74 175.14 2in0 s VAL 31 N -2.27 0.25 -0.25 -0.90 -7.23 -0.00 -4.02 120.40 105.97 2in0 s VAL 31 Ca 0.33 -1.97 -0.20 0.00 -1.81 0.00 0.00 61.98 58.34 2in0 s VAL 31 Cb -0.06 -2.31 -0.02 0.00 0.56 0.00 0.00 36.38 34.55 2in0 s VAL 31 CO 0.22 -0.24 0.62 -0.69 -0.31 0.00 0.00 175.10 174.70 2in0 s VAL 32 N -3.96 4.99 0.18 1.32 1.01 -1.24 -1.34 120.40 121.36 2in0 s VAL 32 Ca 0.31 1.10 0.07 0.00 0.00 0.00 0.00 61.98 63.47 2in0 s VAL 32 Cb 0.07 -3.92 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 2in0 s VAL 32 CO 0.08 0.04 0.03 0.00 0.00 0.00 0.00 175.10 175.24 2in0 s ALA 33 N 2.48 3.28 -0.13 5.51 0.00 0.41 -1.90 121.76 131.41 2in0 s ALA 33 Ca 0.26 -1.35 -0.01 0.00 0.00 0.00 0.00 51.96 50.85 2in0 s ALA 33 Cb -0.15 -1.06 -0.02 0.00 0.00 0.00 0.00 23.12 21.88 2in0 s ALA 33 CO 0.09 0.47 -0.07 0.00 0.00 0.00 0.00 175.76 176.24 2in0 s ALA 34 N -1.77 2.87 0.98 0.00 0.00 -1.26 0.24 121.76 122.81 2in0 s ALA 34 Ca 0.28 -0.86 -0.10 0.00 0.00 0.00 0.00 51.96 51.28 2in0 s ALA 34 Cb -0.09 -1.37 0.14 0.00 0.00 0.00 0.00 23.12 21.80 2in0 s ALA 34 CO 0.20 0.31 0.85 0.00 0.00 0.00 0.00 175.76 177.12 2in0 n ALA 35 N 3.22 -0.93 0.06 0.00 0.00 0.80 -4.75 120.51 118.91 2in0 n ALA 35 Ca -0.18 -1.13 -0.11 0.00 0.00 0.00 0.00 53.44 52.02 2in0 n ALA 35 Cb 0.53 -0.04 -0.01 0.00 0.00 0.00 0.00 19.45 19.92 2in0 n ALA 35 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2in0 h LYS 36 N 0.00 0.39 0.00 0.00 1.57 -1.95 -3.00 116.57 113.58 2in0 h LYS 36 Ca -0.28 -0.37 0.00 0.00 -1.87 0.00 0.00 60.65 58.13 2in0 h LYS 36 Cb 0.77 0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.17 2in0 h LYS 36 CO 0.20 1.04 0.00 -0.40 -0.57 0.00 0.00 179.45 179.71 2in0 n ASP 37 N -3.77 0.00 0.00 0.86 5.68 -1.26 -4.87 116.55 113.18 2in0 n ASP 37 Ca -0.05 -1.70 0.00 0.00 -0.50 0.00 0.00 54.79 52.54 2in0 n ASP 37 Cb 0.78 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.76 2in0 n ASP 37 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2in0 n GLY 38 N 0.48 2.94 3.69 6.12 0.00 -1.13 -5.04 105.19 112.25 2in0 n GLY 38 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 2in0 n GLY 38 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2in0 n THR 39 N -0.54 3.61 -3.90 2.61 -2.24 -1.26 -4.50 114.28 108.06 2in0 n THR 39 Ca 0.00 -0.50 -0.36 0.00 -2.27 0.00 0.00 64.05 60.92 2in0 n THR 39 Cb 0.00 -1.46 -0.06 0.00 -2.10 0.00 0.00 70.33 66.71 2in0 n THR 39 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2in0 s LEU 40 N -2.67 4.36 0.06 3.22 1.43 -1.26 -0.14 118.68 123.68 2in0 s LEU 40 Ca 0.72 0.42 -0.09 0.00 -1.03 0.00 0.00 54.13 54.15 2in0 s LEU 40 Cb -0.44 -2.23 0.00 0.00 0.03 0.00 0.00 46.19 43.55 2in0 s LEU 40 CO 0.50 0.36 0.19 -1.00 0.23 0.00 0.00 176.35 176.63 2in0 s HIS 41 N -1.12 0.11 -0.04 0.29 3.76 0.14 -4.95 115.29 113.48 2in0 s HIS 41 Ca 0.19 -0.42 -0.22 0.00 -0.15 0.00 0.00 55.06 54.46 2in0 s HIS 41 Cb -0.12 -0.05 -0.04 0.00 1.11 0.00 0.00 32.58 33.47 2in0 s HIS 41 CO 0.08 -0.47 0.66 0.00 -0.85 0.00 0.00 174.74 174.17 2in0 s ALA 42 N -3.09 3.39 0.01 -1.40 0.00 -1.26 0.16 121.76 119.57 2in0 s ALA 42 Ca -0.01 0.10 -0.01 0.00 0.00 0.00 0.00 51.96 52.03 2in0 s ALA 42 Cb 0.01 -2.88 -0.01 0.00 0.00 0.00 0.00 23.12 20.24 2in0 s ALA 42 CO -0.07 -0.01 0.01 1.03 0.00 0.00 0.00 175.76 176.72 2in0 s ARG 43 N 0.44 0.29 0.39 0.00 1.81 -0.45 -4.90 118.95 116.53 2in0 s ARG 43 Ca 0.35 -0.46 -0.15 0.00 -1.72 0.00 0.00 55.73 53.75 2in0 s ARG 43 Cb -0.18 0.11 -0.08 0.00 -0.45 0.00 0.00 34.95 34.34 2in0 s ARG 43 CO 0.18 -0.05 0.82 -1.25 -0.68 0.00 0.00 175.30 174.32 2in0 s PRO 44 N -1.19 3.97 -0.12 3.54 0.04 -1.26 -0.82 135.00 139.16 2in0 s PRO 44 Ca -0.13 0.74 -0.21 0.00 0.04 0.00 0.00 61.00 61.44 2in0 s PRO 44 Cb -0.08 -2.33 -0.03 0.00 0.04 0.00 0.00 34.50 32.10 2in0 s PRO 44 CO -0.00 0.00 0.62 0.08 0.04 0.00 0.00 177.00 177.74 2in0 s VAL 45 N -2.22 5.08 -0.34 -0.36 1.01 -0.58 -1.43 120.40 121.56 2in0 s VAL 45 Ca 0.56 1.24 0.03 0.00 0.00 0.00 0.00 61.98 63.81 2in0 s VAL 45 Cb -0.10 -3.95 0.01 0.00 0.00 0.00 0.00 36.38 32.34 2in0 s VAL 45 CO 0.22 0.23 0.47 1.33 0.00 0.00 0.00 175.10 177.36 2in0 n VAL 46 N 4.02 0.00 -3.70 2.92 0.24 -0.26 -4.71 118.33 116.84 2in0 n VAL 46 Ca -0.03 -0.48 -0.14 0.00 -2.04 0.00 0.00 64.34 61.65 2in0 n VAL 46 Cb 0.51 1.05 -0.09 0.00 -1.47 0.00 0.00 33.84 33.84 2in0 n VAL 46 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2in0 s SER 47 N -0.54 -0.43 -0.08 -1.34 0.15 -1.24 -4.98 113.70 105.24 2in0 s SER 47 Ca 0.03 0.70 0.04 0.00 0.70 0.00 0.00 55.95 57.42 2in0 s SER 47 Cb 0.03 0.74 0.00 0.00 -1.71 0.00 0.00 66.02 65.08 2in0 s SER 47 CO 0.06 -0.29 -0.21 0.26 1.20 0.00 0.00 173.24 174.27 2in0 s TRP 48 N -0.33 2.18 -0.11 3.44 0.51 -1.26 -1.61 118.94 121.75 2in0 s TRP 48 Ca -0.05 -0.80 0.01 0.00 -2.12 0.00 0.00 56.10 53.14 2in0 s TRP 48 Cb -0.03 -1.47 0.02 0.00 -0.81 0.00 0.00 33.47 31.17 2in0 s TRP 48 CO 0.03 -0.32 -0.14 -0.06 -0.51 0.00 0.00 176.95 175.96 2in0 s PHE 49 N 0.28 1.86 -0.46 -1.98 0.40 -0.12 -5.02 117.98 112.94 2in0 s PHE 49 Ca -0.13 -0.89 -0.17 0.00 -0.60 0.00 0.00 56.93 55.14 2in0 s PHE 49 Cb -0.16 -1.37 0.05 0.00 0.51 0.00 0.00 43.02 42.05 2in0 s PHE 49 CO 0.06 -0.48 0.48 0.34 0.70 0.00 0.00 175.22 176.32 2in0 s ASP 50 N 1.12 6.19 0.00 1.36 -1.08 -1.26 -1.60 116.67 121.39 2in0 s ASP 50 Ca -0.04 -0.94 0.29 0.00 -0.52 0.00 0.00 52.55 51.33 2in0 s ASP 50 Cb -0.14 -2.23 1.20 0.00 -1.46 0.00 0.00 42.92 40.28 2in0 s ASP 50 CO -0.03 -0.69 1.83 0.00 0.52 0.00 0.00 175.17 176.80 2in0 n GLN 51 N 5.65 1.15 0.00 4.34 1.13 0.26 -5.01 117.38 124.90 2in0 n GLN 51 Ca -0.09 -0.52 0.00 0.00 -1.94 0.00 0.00 57.00 54.45 2in0 n GLN 51 Cb 0.46 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.32 2in0 n GLN 51 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2in0 n GLY 52 N 1.20 -2.12 3.71 1.08 0.00 -1.21 -4.80 105.19 103.05 2in0 n GLY 52 Ca 0.18 -1.57 -0.39 0.00 0.00 0.00 0.00 46.02 44.23 2in0 n GLY 52 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2in0 s THR 53 N -0.15 5.08 0.24 2.61 2.01 -1.26 0.13 115.64 124.29 2in0 s THR 53 Ca 0.00 1.31 -0.08 0.00 0.31 0.00 0.00 61.69 63.24 2in0 s THR 53 Cb 0.00 -3.98 -0.02 0.00 0.01 0.00 0.00 72.50 68.51 2in0 s THR 53 CO 0.00 0.25 0.36 -0.13 -0.69 0.00 0.00 174.62 174.41 2in0 s ARG 54 N 0.87 1.47 0.08 4.92 0.52 -0.58 -4.92 118.95 121.32 2in0 s ARG 54 Ca 0.34 -1.44 -0.30 0.00 -0.52 0.00 0.00 55.73 53.81 2in0 s ARG 54 Cb -0.17 0.40 -0.05 0.00 0.52 0.00 0.00 34.95 35.65 2in0 s ARG 54 CO 0.16 -0.58 1.03 -0.51 0.02 0.00 0.00 175.30 175.42 2in0 s ASP 55 N -3.09 7.35 -0.02 0.23 1.01 -1.26 -2.39 116.67 118.50 2in0 s ASP 55 Ca 0.29 1.85 0.04 0.00 0.71 0.00 0.00 52.55 55.44 2in0 s ASP 55 Cb 0.02 -2.58 -0.01 0.00 1.01 0.00 0.00 42.92 41.36 2in0 s ASP 55 CO 0.11 -0.22 -0.14 0.68 0.21 0.00 0.00 175.17 175.81 2in0 s VAL 56 N 0.41 1.14 0.30 -1.27 -7.23 -0.54 -4.34 120.40 108.87 2in0 s VAL 56 Ca 0.51 -0.61 0.06 0.00 -1.81 0.00 0.00 61.98 60.13 2in0 s VAL 56 Cb -0.25 -0.96 -0.02 0.00 0.56 0.00 0.00 36.38 35.71 2in0 s VAL 56 CO 0.30 0.33 0.38 0.27 -0.31 0.00 0.00 175.10 176.07 2in0 s ILE 57 N -0.27 4.35 -0.08 -0.62 -4.36 0.47 -1.47 121.20 119.23 2in0 s ILE 57 Ca 0.04 -1.10 0.03 0.00 -0.26 0.00 0.00 60.65 59.37 2in0 s ILE 57 Cb -0.06 -3.50 -0.02 0.00 1.25 0.00 0.00 42.46 40.13 2in0 s ILE 57 CO -0.00 -0.23 -0.18 -0.83 0.24 0.00 0.00 174.94 173.94 2in0 s GLY 58 N -4.06 1.44 -0.40 6.27 0.00 -1.18 -1.75 107.32 107.64 2in0 s GLY 58 Ca 0.40 -0.98 -0.03 0.00 0.00 0.00 0.00 44.72 44.11 2in0 s GLY 58 CO 0.29 -0.54 0.19 1.08 0.00 0.00 0.00 173.10 174.12 2in0 s LEU 59 N -0.18 5.11 -0.22 0.66 1.43 0.37 0.05 118.68 125.90 2in0 s LEU 59 Ca -0.01 -1.90 -0.29 0.00 -1.03 0.00 0.00 54.13 50.90 2in0 s LEU 59 Cb -0.14 -1.84 0.01 0.00 0.03 0.00 0.00 46.19 44.26 2in0 s LEU 59 CO 0.03 -0.52 1.03 -0.60 0.23 0.00 0.00 176.35 176.53 2in0 s ARG 60 N 1.18 4.27 0.11 1.70 6.06 0.08 -1.91 118.95 130.44 2in0 s ARG 60 Ca 0.06 1.36 0.02 0.00 -2.50 0.00 0.00 55.73 54.66 2in0 s ARG 60 Cb -0.23 -3.63 -0.04 0.00 0.06 0.00 0.00 34.95 31.11 2in0 s ARG 60 CO -0.03 -0.60 0.24 0.42 -2.50 0.00 0.00 175.30 172.82 2in0 s ILE 61 N 3.10 5.29 0.14 4.11 -1.09 0.75 0.51 121.20 134.01 2in0 s ILE 61 Ca 0.44 -0.58 -0.35 0.00 -2.23 0.00 0.00 60.65 57.93 2in0 s ILE 61 Cb -0.15 -3.65 -0.15 0.00 -1.58 0.00 0.00 42.46 36.92 2in0 s ILE 61 CO 0.07 0.01 1.48 0.00 -1.23 0.00 0.00 174.94 175.28 2in0 n ALA 62 N -0.14 0.52 0.00 9.38 0.00 -0.16 -0.61 120.51 129.49 2in0 n ALA 62 Ca -0.06 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.85 2in0 n ALA 62 Cb 0.53 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.73 2in0 n ALA 62 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2in0 n GLY 63 N 3.03 1.13 0.00 0.00 0.00 -1.26 -4.65 105.19 103.44 2in0 n GLY 63 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2in0 n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2in0 n GLY 64 N -0.03 2.03 3.74 -0.02 0.00 0.22 -5.11 105.19 106.01 2in0 n GLY 64 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2in0 n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2in0 s ALA 65 N -2.13 2.13 -0.08 4.61 0.00 -1.23 -4.74 121.76 120.32 2in0 s ALA 65 Ca 0.00 0.56 -0.03 0.00 0.00 0.00 0.00 51.96 52.48 2in0 s ALA 65 Cb 0.00 -3.37 0.04 0.00 0.00 0.00 0.00 23.12 19.79 2in0 s ALA 65 CO 0.00 -1.86 0.17 -1.50 0.00 0.00 0.00 175.76 172.57 2in0 s ILE 66 N -2.48 -0.11 -0.20 0.00 2.07 -1.26 -0.17 121.20 119.05 2in0 s ILE 66 Ca 0.67 0.21 -0.08 0.00 -1.41 0.00 0.00 60.65 60.05 2in0 s ILE 66 Cb -0.22 -0.28 -0.04 0.00 0.13 0.00 0.00 42.46 42.05 2in0 s ILE 66 CO 0.50 0.09 0.08 -0.22 -1.91 0.00 0.00 174.94 173.47 2in0 s LEU 67 N 1.47 3.82 -0.29 8.50 2.96 -0.80 -4.90 118.68 129.43 2in0 s LEU 67 Ca -0.06 0.06 -0.04 0.00 -0.22 0.00 0.00 54.13 53.86 2in0 s LEU 67 Cb -0.12 -1.98 0.02 0.00 0.50 0.00 0.00 46.19 44.62 2in0 s LEU 67 CO -0.06 0.14 0.03 0.26 -1.32 0.00 0.00 176.35 175.39 2in0 s TRP 68 N 0.59 3.15 0.17 5.38 0.52 -1.26 -0.48 118.94 127.00 2in0 s TRP 68 Ca 0.04 -1.33 -0.06 0.00 0.02 0.00 0.00 56.10 54.78 2in0 s TRP 68 Cb -0.13 -2.18 -0.02 0.00 -1.15 0.00 0.00 33.47 30.00 2in0 s TRP 68 CO 0.01 -0.67 0.21 0.00 0.02 0.00 0.00 176.95 176.52 2in0 s ALA 69 N 1.40 0.41 0.71 0.98 0.00 -0.72 -1.37 121.76 123.17 2in0 s ALA 69 Ca 0.00 -1.18 -0.14 0.00 0.00 0.00 0.00 51.96 50.64 2in0 s ALA 69 Cb -0.18 0.95 0.03 0.00 0.00 0.00 0.00 23.12 23.92 2in0 s ALA 69 CO -0.00 -0.61 1.14 0.95 0.00 0.00 0.00 175.76 177.24 2in0 s THR 70 N -4.02 2.88 0.57 0.00 -4.23 -0.41 -0.39 115.64 110.03 2in0 s THR 70 Ca 0.23 0.39 0.43 0.00 -1.18 0.00 0.00 61.69 61.55 2in0 s THR 70 Cb 0.05 -2.89 0.44 0.00 1.34 0.00 0.00 72.50 71.44 2in0 s THR 70 CO 0.03 -0.27 2.31 1.55 -0.54 0.00 0.00 174.62 177.70 2in0 h PRO 71 N -0.34 0.00 -0.13 3.99 0.13 -1.92 -1.94 132.00 131.79 2in0 h PRO 71 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2in0 h PRO 71 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2in0 h PRO 71 CO 0.51 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.89 2in0 n ASP 72 N -3.10 2.47 -4.74 1.44 5.75 -1.26 -0.04 116.55 117.08 2in0 n ASP 72 Ca -0.02 -1.82 -0.41 0.00 -0.01 0.00 0.00 54.79 52.53 2in0 n ASP 72 Cb 0.11 -0.08 -0.03 0.00 -1.03 0.00 0.00 41.12 40.09 2in0 n ASP 72 CO 0.00 0.00 0.00 -2.28 -0.11 0.00 0.00 177.20 174.81 2in0 s HIS 73 N -1.85 3.40 0.11 2.11 2.46 -0.73 -4.71 115.29 116.08 2in0 s HIS 73 Ca 0.34 1.38 -0.26 0.00 0.47 0.00 0.00 55.06 56.99 2in0 s HIS 73 Cb 0.20 -3.46 -0.07 0.00 -0.13 0.00 0.00 32.58 29.13 2in0 s HIS 73 CO 0.31 -1.32 0.79 0.15 -2.47 0.00 0.00 174.74 172.19 2in0 s LYS 74 N -0.15 4.55 0.01 2.88 1.02 -1.26 -0.27 119.74 126.53 2in0 s LYS 74 Ca 0.54 1.15 0.06 0.00 0.02 0.00 0.00 55.97 57.74 2in0 s LYS 74 Cb -0.33 -3.31 -0.02 0.00 -0.52 0.00 0.00 37.83 33.65 2in0 s LYS 74 CO 0.36 0.42 -0.20 0.08 -0.92 0.00 0.00 175.35 175.10 2in0 s VAL 75 N -0.61 1.56 -0.19 3.17 1.01 -0.04 -1.44 120.40 123.87 2in0 s VAL 75 Ca 0.38 -0.98 -0.28 0.00 0.00 0.00 0.00 61.98 61.10 2in0 s VAL 75 Cb -0.22 -1.33 -0.00 0.00 0.00 0.00 0.00 36.38 34.83 2in0 s VAL 75 CO 0.25 0.33 0.98 -0.22 0.00 0.00 0.00 175.10 176.44 2in0 s LEU 76 N -0.76 4.15 0.47 3.92 2.96 -0.52 -1.36 118.68 127.53 2in0 s LEU 76 Ca 0.07 1.37 0.02 0.00 -0.22 0.00 0.00 54.13 55.38 2in0 s LEU 76 Cb -0.08 -3.47 -0.02 0.00 0.50 0.00 0.00 46.19 43.11 2in0 s LEU 76 CO 0.00 -0.55 0.05 0.42 -1.32 0.00 0.00 176.35 174.95 2in0 s THR 77 N 2.67 0.99 0.34 3.68 -4.23 -0.02 -0.93 115.64 118.14 2in0 s THR 77 Ca 0.44 -2.00 0.37 0.00 -1.18 0.00 0.00 61.69 59.32 2in0 s THR 77 Cb -0.16 -2.28 0.38 0.00 1.34 0.00 0.00 72.50 71.78 2in0 s THR 77 CO 0.11 0.00 2.13 1.05 -0.54 0.00 0.00 174.62 177.36 2in0 h GLU 78 N 1.54 0.00 -0.23 3.99 4.11 -1.67 -0.95 114.58 121.36 2in0 h GLU 78 Ca -0.41 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 58.96 2in0 h GLU 78 Cb 1.30 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.51 2in0 h GLU 78 CO 0.68 0.00 -0.05 0.66 0.07 0.00 0.00 179.01 180.37 2in0 n TYR 79 N -2.85 0.78 -0.62 2.06 4.01 -1.26 -5.09 117.16 114.19 2in0 n TYR 79 Ca -0.02 -1.17 0.00 0.00 -0.16 0.00 0.00 57.90 56.55 2in0 n TYR 79 Cb 0.10 -0.34 0.00 0.00 -0.31 0.00 0.00 39.34 38.79 2in0 n TYR 79 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2in0 n GLY 80 N -0.91 -1.77 3.72 2.72 0.00 -0.36 -4.94 105.19 103.65 2in0 n GLY 80 Ca 0.24 -1.95 -0.42 0.00 0.00 0.00 0.00 46.02 43.90 2in0 n GLY 80 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2in0 s TRP 81 N 0.00 3.44 -0.04 1.61 0.52 -1.26 -0.84 118.94 122.37 2in0 s TRP 81 Ca 0.00 1.35 -0.12 0.00 0.02 0.00 0.00 56.10 57.35 2in0 s TRP 81 Cb 0.00 -3.42 0.02 0.00 -1.15 0.00 0.00 33.47 28.92 2in0 s TRP 81 CO 0.00 -1.23 0.27 1.03 0.02 0.00 0.00 176.95 177.04 2in0 s ARG 82 N 0.53 0.53 0.28 4.98 0.52 -0.46 -4.94 118.95 120.39 2in0 s ARG 82 Ca 0.56 -0.03 -0.30 0.00 -0.52 0.00 0.00 55.73 55.45 2in0 s ARG 82 Cb -0.31 0.24 -0.11 0.00 0.52 0.00 0.00 34.95 35.29 2in0 s ARG 82 CO 0.32 -0.12 1.48 0.00 0.02 0.00 0.00 175.30 176.99 2in0 s ALA 83 N -0.84 3.64 0.35 2.13 0.00 -1.26 -0.86 121.76 124.91 2in0 s ALA 83 Ca -0.09 1.42 0.10 0.00 0.00 0.00 0.00 51.96 53.39 2in0 s ALA 83 Cb -0.05 -3.58 0.86 0.00 0.00 0.00 0.00 23.12 20.35 2in0 s ALA 83 CO 0.02 -0.84 1.81 0.00 0.00 0.00 0.00 175.76 176.76 2in0 h ALA 84 N 4.59 1.87 0.00 0.00 0.00 -0.49 -0.30 119.26 124.92 2in0 h ALA 84 Ca -0.47 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2in0 h ALA 84 Cb 1.22 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2in0 h ALA 84 CO 0.75 -0.20 0.00 0.41 0.00 0.00 0.00 179.25 180.22 2in0 n GLY 85 N -1.40 -1.05 0.02 0.00 0.00 0.95 -2.01 105.19 101.69 2in0 n GLY 85 Ca 0.21 0.13 0.11 0.00 0.00 0.00 0.00 46.02 46.48 2in0 n GLY 85 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2in0 n GLU 86 N -2.19 0.22 -2.53 1.61 1.02 -0.13 -4.95 120.64 113.69 2in0 n GLU 86 Ca 0.00 -0.02 -0.37 0.00 -0.02 0.00 0.00 57.16 56.75 2in0 n GLU 86 Cb 0.13 -1.56 -0.04 0.00 -0.02 0.00 0.00 31.44 29.95 2in0 n GLU 86 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2in0 s LEU 87 N -3.66 4.24 0.21 -4.62 1.43 -0.85 -5.06 118.68 110.36 2in0 s LEU 87 Ca 0.04 2.10 0.02 0.00 -1.03 0.00 0.00 54.13 55.26 2in0 s LEU 87 Cb 0.15 -4.05 -0.05 0.00 0.03 0.00 0.00 46.19 42.28 2in0 s LEU 87 CO 0.81 -0.41 0.01 -0.13 0.23 0.00 0.00 176.35 176.87 2in0 s ARG 88 N -2.23 1.23 0.20 1.70 1.81 -1.26 -4.98 118.95 115.42 2in0 s ARG 88 Ca 0.54 -1.62 -0.32 0.00 -1.72 0.00 0.00 55.73 52.62 2in0 s ARG 88 Cb -0.25 -0.39 -0.15 0.00 -0.45 0.00 0.00 34.95 33.72 2in0 s ARG 88 CO 0.31 -0.14 1.22 1.17 -0.68 0.00 0.00 175.30 177.17 2in0 n LYS 89 N -0.34 1.41 0.00 3.54 4.81 -1.26 -1.44 118.16 124.88 2in0 n LYS 89 Ca -0.05 0.50 0.00 0.00 -0.87 0.00 0.00 58.31 57.89 2in0 n LYS 89 Cb 0.64 -2.03 0.00 0.00 0.02 0.00 0.00 35.03 33.66 2in0 n LYS 89 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2in0 n GLY 90 N 1.99 2.72 3.77 3.14 0.00 -0.40 -4.95 105.19 111.46 2in0 n GLY 90 Ca 0.14 -0.20 -0.40 0.00 0.00 0.00 0.00 46.02 45.56 2in0 n GLY 90 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2in0 s ASP 91 N 0.55 6.47 -0.16 1.61 1.01 -0.52 -4.56 116.67 121.06 2in0 s ASP 91 Ca 0.00 2.69 -0.07 0.00 0.71 0.00 0.00 52.55 55.89 2in0 s ASP 91 Cb 0.00 -2.64 -0.04 0.00 1.01 0.00 0.00 42.92 41.25 2in0 s ASP 91 CO 0.00 -0.75 0.08 -0.13 0.21 0.00 0.00 175.17 174.58 2in0 s ARG 92 N -2.08 3.77 0.18 8.23 0.52 -1.26 -0.53 118.95 127.79 2in0 s ARG 92 Ca 0.54 -0.29 0.07 0.00 -0.52 0.00 0.00 55.73 55.53 2in0 s ARG 92 Cb -0.39 -3.18 -0.04 0.00 0.52 0.00 0.00 34.95 31.85 2in0 s ARG 92 CO 0.51 0.43 -0.00 0.14 0.02 0.00 0.00 175.30 176.40 2in0 s VAL 93 N -0.07 3.69 -0.05 3.52 -7.23 0.29 -1.66 120.40 118.89 2in0 s VAL 93 Ca 0.07 -1.47 -0.30 0.00 -1.81 0.00 0.00 61.98 58.48 2in0 s VAL 93 Cb -0.12 -2.86 -0.03 0.00 0.56 0.00 0.00 36.38 33.93 2in0 s VAL 93 CO 0.01 -0.13 1.15 0.00 -0.31 0.00 0.00 175.10 175.81 2in0 s ALA 94 N -1.77 3.45 0.00 1.32 0.00 -0.10 -1.56 121.76 123.10 2in0 s ALA 94 Ca 0.28 0.58 0.04 0.00 0.00 0.00 0.00 51.96 52.85 2in0 s ALA 94 Cb -0.09 -3.48 -0.01 0.00 0.00 0.00 0.00 23.12 19.54 2in0 s ALA 94 CO 0.19 -0.67 -0.11 0.14 0.00 0.00 0.00 175.76 175.30 2in0 s VAL 95 N 2.00 0.90 -0.21 0.00 -7.23 0.36 -1.13 120.40 115.10 2in0 s VAL 95 Ca 0.54 -0.58 -0.16 0.00 -1.81 0.00 0.00 61.98 59.97 2in0 s VAL 95 Cb -0.23 -0.77 -0.04 0.00 0.56 0.00 0.00 36.38 35.90 2in0 s VAL 95 CO 0.22 0.18 0.42 -0.60 -0.31 0.00 0.00 175.10 175.01 2in0 s ARG 96 N -0.45 4.16 0.08 4.82 3.52 0.50 -1.19 118.95 130.39 2in0 s ARG 96 Ca 0.03 0.22 -0.31 0.00 -0.13 0.00 0.00 55.73 55.55 2in0 s ARG 96 Cb -0.05 -3.56 -0.09 0.00 -1.56 0.00 0.00 34.95 29.70 2in0 s ARG 96 CO -0.00 -0.09 1.72 0.34 -0.81 0.00 0.00 175.30 176.46 2in0 s ASP 97 N 1.13 6.55 0.56 -2.12 2.15 0.89 -4.85 116.67 120.99 2in0 s ASP 97 Ca 0.20 2.56 0.33 0.00 0.43 0.00 0.00 52.55 56.06 2in0 s ASP 97 Cb -0.15 -2.56 1.65 0.00 -0.30 0.00 0.00 42.92 41.55 2in0 s ASP 97 CO 0.08 -0.93 2.12 1.62 -0.17 0.00 0.00 175.17 177.89 2in0 h VAL 98 N 4.84 0.31 0.04 1.11 3.04 -1.96 0.26 116.25 123.89 2in0 h VAL 98 Ca -0.44 -0.42 -0.28 0.00 -1.01 0.00 0.00 66.70 64.55 2in0 h VAL 98 Cb 1.21 1.31 -0.03 0.00 -2.01 0.00 0.00 31.29 31.76 2in0 h VAL 98 CO 0.94 0.07 -1.56 1.21 -1.01 0.00 0.00 177.57 177.21 2in0 n GLU 99 N -3.39 0.62 -0.00 4.17 4.07 -1.26 -4.65 120.64 120.20 2in0 n GLU 99 Ca -0.01 0.47 0.07 0.00 -0.06 0.00 0.00 57.16 57.62 2in0 n GLU 99 Cb 0.22 -1.72 -0.09 0.00 -0.06 0.00 0.00 31.44 29.79 2in0 n GLU 99 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 2in0 n THR 100 N -4.14 0.00 -0.95 6.31 -2.24 -1.21 -4.98 114.28 107.06 2in0 n THR 100 Ca -0.34 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 2in0 n THR 100 Cb 0.80 0.90 0.00 0.00 -2.10 0.00 0.00 70.33 69.93 2in0 n THR 100 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2in0 n GLY 101 N 1.38 0.63 3.78 3.38 0.00 0.91 -4.97 105.19 110.30 2in0 n GLY 101 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 2in0 n GLY 101 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2in0 s GLU 102 N -0.27 4.30 -0.13 1.61 2.02 -1.26 -4.58 118.70 120.38 2in0 s GLU 102 Ca 0.00 1.51 -0.19 0.00 0.02 0.00 0.00 54.97 56.32 2in0 s GLU 102 Cb 0.00 -2.66 -0.04 0.00 0.10 0.00 0.00 34.13 31.53 2in0 s GLU 102 CO 0.00 -0.02 0.50 -1.17 0.02 0.00 0.00 175.26 174.59 2in0 s LEU 404 N -2.40 4.25 0.33 1.80 0.20 -1.26 -0.07 118.68 121.52 2in0 s LEU 404 Ca 0.55 0.80 0.06 0.00 0.69 0.00 0.00 54.13 56.24 2in0 s LEU 404 Cb -0.22 -2.72 -0.03 0.00 -0.43 0.00 0.00 46.19 42.78 2in0 s LEU 404 CO 0.28 -0.05 0.25 0.00 -0.29 0.00 0.00 176.35 176.54 2in0 s ARG 405 N 0.88 1.72 -0.08 1.98 1.70 -0.33 -4.99 118.95 119.84 2in0 s ARG 405 Ca 0.26 -2.00 0.03 0.00 -0.47 0.00 0.00 55.73 53.55 2in0 s ARG 405 Cb -0.15 0.23 0.01 0.00 -0.57 0.00 0.00 34.95 34.47 2in0 s ARG 405 CO 0.11 -0.61 -0.16 0.71 -1.08 0.00 0.00 175.30 174.27 2in0 s TYR 406 N -3.49 1.78 0.08 5.89 2.02 -1.26 -0.49 117.35 121.89 2in0 s TYR 406 Ca 0.39 -0.69 0.09 0.00 -0.37 0.00 0.00 57.07 56.49 2in0 s TYR 406 Cb 0.03 -1.26 -0.03 0.00 -0.40 0.00 0.00 41.96 40.30 2in0 s TYR 406 CO 0.25 -0.32 -0.24 -1.12 -1.57 0.00 0.00 175.55 172.55 2in0 s SER 407 N 0.58 2.85 0.44 2.29 0.01 -0.60 -4.88 113.70 114.40 2in0 s SER 407 Ca -0.16 -0.64 -0.21 0.00 1.31 0.00 0.00 55.95 56.25 2in0 s SER 407 Cb -0.16 -0.21 -0.10 0.00 0.21 0.00 0.00 66.02 65.76 2in0 s SER 407 CO 0.05 0.16 0.99 0.68 0.41 0.00 0.00 173.24 175.53 2in0 s VAL 408 N -0.97 4.08 -0.07 3.43 -7.23 -1.26 -0.55 120.40 117.84 2in0 s VAL 408 Ca 0.10 1.35 -0.29 0.00 -1.81 0.00 0.00 61.98 61.32 2in0 s VAL 408 Cb -0.10 -3.57 -0.02 0.00 0.56 0.00 0.00 36.38 33.25 2in0 s VAL 408 CO 0.04 -0.23 0.98 -0.63 -0.31 0.00 0.00 175.10 174.94 2in0 s ILE 409 N -2.02 4.83 -0.02 -0.62 1.01 0.31 -0.99 121.20 123.70 2in0 s ILE 409 Ca 0.63 2.01 -0.06 0.00 0.00 0.00 0.00 60.65 63.23 2in0 s ILE 409 Cb -0.14 -4.30 -0.29 0.00 0.01 0.00 0.00 42.46 37.75 2in0 s ILE 409 CO 0.18 0.07 0.78 -0.09 0.00 0.00 0.00 174.94 175.87 2in0 h ARG 410 N 6.99 0.31 -2.11 2.79 2.43 -0.22 -1.07 114.38 123.50 2in0 h ARG 410 Ca -0.35 -0.53 -0.06 0.00 -0.81 0.00 0.00 59.98 58.23 2in0 h ARG 410 Cb 1.17 0.20 -0.20 0.00 -0.42 0.00 0.00 29.97 30.72 2in0 h ARG 410 CO 0.81 1.19 0.12 -2.00 -1.51 0.00 0.00 179.97 178.59 2in0 s GLU 411 N -2.60 0.96 -0.26 0.20 2.12 -1.05 -4.84 118.70 113.22 2in0 s GLU 411 Ca -0.12 0.39 -0.06 0.00 0.36 0.00 0.00 54.97 55.55 2in0 s GLU 411 Cb 0.06 0.45 -0.01 0.00 0.26 0.00 0.00 34.13 34.90 2in0 s GLU 411 CO 0.85 -0.26 0.04 0.08 -0.54 0.00 0.00 175.26 175.43 2in0 s VAL 412 N -0.81 3.86 0.34 3.70 1.01 -1.26 -0.74 120.40 126.50 2in0 s VAL 412 Ca -0.08 -0.49 -0.06 0.00 0.00 0.00 0.00 61.98 61.34 2in0 s VAL 412 Cb -0.02 -2.87 -0.05 0.00 0.00 0.00 0.00 36.38 33.44 2in0 s VAL 412 CO 0.07 0.26 0.64 -0.76 0.00 0.00 0.00 175.10 175.31 2in0 s LEU 413 N 1.52 3.96 0.90 3.92 2.01 0.11 -4.95 118.68 126.14 2in0 s LEU 413 Ca 0.05 0.85 -0.11 0.00 0.01 0.00 0.00 54.13 54.92 2in0 s LEU 413 Cb -0.16 -3.70 0.13 0.00 0.01 0.00 0.00 46.19 42.48 2in0 s LEU 413 CO 0.01 -0.29 1.10 -2.84 1.01 0.00 0.00 176.35 175.34 2in0 s PRO 414 N -3.75 1.21 0.69 1.29 0.02 -1.26 -3.12 135.00 130.08 2in0 s PRO 414 Ca 0.46 1.08 -0.15 0.00 0.02 0.00 0.00 61.00 62.42 2in0 s PRO 414 Cb -0.10 -1.78 0.01 0.00 0.02 0.00 0.00 34.50 32.65 2in0 s PRO 414 CO 0.32 -2.34 1.13 0.95 -0.33 0.00 0.00 177.00 176.72 2in0 s THR 415 N -2.81 3.05 0.02 0.99 -4.23 -1.26 -4.35 115.64 107.05 2in0 s THR 415 Ca 0.64 0.48 -0.12 0.00 -1.18 0.00 0.00 61.69 61.51 2in0 s THR 415 Cb -0.20 -2.99 0.01 0.00 1.34 0.00 0.00 72.50 70.67 2in0 s THR 415 CO 0.58 -0.31 0.25 0.00 -0.54 0.00 0.00 174.62 174.59 2in0 s ARG 416 N -4.13 0.68 0.15 3.99 1.70 -0.54 -4.92 118.95 115.87 2in0 s ARG 416 Ca 0.68 -0.43 -0.27 0.00 -0.47 0.00 0.00 55.73 55.23 2in0 s ARG 416 Cb -0.22 0.29 -0.07 0.00 -0.57 0.00 0.00 34.95 34.38 2in0 s ARG 416 CO 0.44 -0.19 0.85 1.03 -1.08 0.00 0.00 175.30 176.34 2in0 s ARG 417 N -1.99 4.65 -0.08 3.89 1.81 -1.26 -1.46 118.95 124.50 2in0 s ARG 417 Ca -0.09 1.27 -0.30 0.00 -1.72 0.00 0.00 55.73 54.89 2in0 s ARG 417 Cb -0.03 -3.31 0.12 0.00 -0.45 0.00 0.00 34.95 31.27 2in0 s ARG 417 CO -0.00 0.43 0.97 0.00 -0.68 0.00 0.00 175.30 176.02 2in0 s ALA 418 N -0.69 -1.89 0.42 2.13 0.00 -1.01 -4.98 121.76 115.73 2in0 s ALA 418 Ca 0.40 1.28 -0.25 0.00 0.00 0.00 0.00 51.96 53.38 2in0 s ALA 418 Cb -0.23 -0.00 -0.08 0.00 0.00 0.00 0.00 23.12 22.80 2in0 s ALA 418 CO 0.28 -0.56 1.27 1.03 0.00 0.00 0.00 175.76 177.78 2in0 s ARG 419 N -2.42 3.92 0.13 0.00 0.52 -1.26 -1.52 118.95 118.31 2in0 s ARG 419 Ca 0.04 2.08 0.08 0.00 -0.52 0.00 0.00 55.73 57.40 2in0 s ARG 419 Cb -0.01 -2.69 -0.04 0.00 0.52 0.00 0.00 34.95 32.73 2in0 s ARG 419 CO -0.05 -0.51 -0.18 0.95 0.02 0.00 0.00 175.30 175.53 2in0 s THR 420 N -1.31 1.63 0.20 0.02 -4.23 0.12 -1.16 115.64 110.91 2in0 s THR 420 Ca 0.58 -1.70 0.00 0.00 -1.18 0.00 0.00 61.69 59.39 2in0 s THR 420 Cb -0.36 -1.62 -0.04 0.00 1.34 0.00 0.00 72.50 71.81 2in0 s THR 420 CO 0.46 -0.24 0.08 -0.36 -0.54 0.00 0.00 174.62 174.02 2in0 s PHE 421 N -1.70 1.24 0.02 3.99 0.40 0.19 -0.58 117.98 121.54 2in0 s PHE 421 Ca 0.10 -1.23 -0.09 0.00 -0.60 0.00 0.00 56.93 55.11 2in0 s PHE 421 Cb -0.07 -0.68 0.00 0.00 0.51 0.00 0.00 43.02 42.78 2in0 s PHE 421 CO 0.05 -0.44 0.18 0.34 0.70 0.00 0.00 175.22 176.04 2in0 s ASP 422 N -3.19 0.01 0.06 1.36 2.15 -0.63 -0.32 116.67 116.10 2in0 s ASP 422 Ca 0.33 -0.26 0.02 0.00 0.43 0.00 0.00 52.55 53.08 2in0 s ASP 422 Cb 0.07 0.25 -0.03 0.00 -0.30 0.00 0.00 42.92 42.91 2in0 s ASP 422 CO 0.09 -0.46 -0.08 -0.76 -0.17 0.00 0.00 175.17 173.79 2in0 s LEU 423 N -1.71 2.32 -0.32 -1.34 1.43 -1.26 -0.94 118.68 116.87 2in0 s LEU 423 Ca -0.10 -0.67 -0.08 0.00 -1.03 0.00 0.00 54.13 52.25 2in0 s LEU 423 Cb -0.04 -0.14 0.01 0.00 0.03 0.00 0.00 46.19 46.05 2in0 s LEU 423 CO -0.01 -0.27 0.12 -0.70 0.23 0.00 0.00 176.35 175.72 2in0 s GLU 424 N -2.18 3.01 -0.23 1.70 2.12 -0.64 -4.64 118.70 117.85 2in0 s GLU 424 Ca -0.04 -0.92 -0.12 0.00 0.36 0.00 0.00 54.97 54.25 2in0 s GLU 424 Cb -0.06 -3.47 -0.05 0.00 0.26 0.00 0.00 34.13 30.81 2in0 s GLU 424 CO -0.01 -0.52 0.23 0.08 -0.54 0.00 0.00 175.26 174.51 2in0 s VAL 425 N 1.51 5.31 0.12 3.70 1.01 -1.26 -1.10 120.40 129.69 2in0 s VAL 425 Ca 0.02 0.34 -0.35 0.00 0.00 0.00 0.00 61.98 61.99 2in0 s VAL 425 Cb -0.18 -3.57 -0.16 0.00 0.00 0.00 0.00 36.38 32.47 2in0 s VAL 425 CO 0.04 0.31 1.38 1.21 0.00 0.00 0.00 175.10 178.04 2in0 n GLU 426 N 4.42 1.44 0.00 2.72 2.13 -0.51 -1.81 120.64 129.02 2in0 n GLU 426 Ca -0.13 0.52 0.00 0.00 0.66 0.00 0.00 57.16 58.21 2in0 n GLU 426 Cb 0.52 -2.18 0.00 0.00 0.27 0.00 0.00 31.44 30.05 2in0 n GLU 426 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 2in0 n GLU 427 N 2.63 0.00 0.11 5.31 2.13 -1.26 -4.21 120.64 125.35 2in0 n GLU 427 Ca 0.17 0.00 0.12 0.00 0.66 0.00 0.00 57.16 58.11 2in0 n GLU 427 Cb 0.23 0.00 0.03 0.00 0.27 0.00 0.00 31.44 31.97 2in0 n GLU 427 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 2in0 h LEU 428 N 0.00 0.00 -1.54 4.31 3.38 -1.92 -3.49 115.31 116.05 2in0 h LEU 428 Ca 0.00 -0.02 -0.54 0.00 0.09 0.00 0.00 57.88 57.40 2in0 h LEU 428 Cb 0.00 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 40.59 2in0 h LEU 428 CO 0.00 0.01 -0.88 1.41 0.09 0.00 0.00 178.44 179.08 2in0 n HIS 429 N -2.66 -1.62 -3.89 1.13 8.25 -0.75 -4.86 115.22 110.82 2in0 n HIS 429 Ca 0.01 0.75 -0.09 0.00 -0.26 0.00 0.00 57.72 58.12 2in0 n HIS 429 Cb 0.54 -3.18 -0.06 0.00 1.12 0.00 0.00 29.99 28.40 2in0 n HIS 429 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2in0 s THR 430 N -3.69 0.07 0.20 1.59 -4.23 -1.26 -1.74 115.64 106.59 2in0 s THR 430 Ca 0.37 -1.21 -0.23 0.00 -1.18 0.00 0.00 61.69 59.43 2in0 s THR 430 Cb -0.20 -1.70 0.05 0.00 1.34 0.00 0.00 72.50 71.99 2in0 s THR 430 CO 0.93 -0.31 0.77 -1.48 -0.54 0.00 0.00 174.62 173.99 2in0 s LEU 431 N -2.93 -0.30 -0.31 4.79 2.34 -0.59 -4.33 118.68 117.35 2in0 s LEU 431 Ca 0.13 -0.40 -0.11 0.00 0.06 0.00 0.00 54.13 53.81 2in0 s LEU 431 Cb 0.03 2.50 -0.03 0.00 -0.56 0.00 0.00 46.19 48.13 2in0 s LEU 431 CO -0.03 -1.11 0.19 -0.69 -1.06 0.00 0.00 176.35 173.66 2in0 s VAL 432 N -3.66 5.12 -0.14 1.48 1.01 -0.80 -1.19 120.40 122.21 2in0 s VAL 432 Ca 0.09 -0.10 0.02 0.00 0.00 0.00 0.00 61.98 61.99 2in0 s VAL 432 Cb -0.04 -3.54 0.01 0.00 0.00 0.00 0.00 36.38 32.82 2in0 s VAL 432 CO 0.01 0.13 -0.20 0.00 0.00 0.00 0.00 175.10 175.03 2in0 s ALA 433 N 1.71 2.18 -1.26 5.51 0.00 0.70 -3.93 121.76 126.67 2in0 s ALA 433 Ca 0.06 -1.07 -0.04 0.00 0.00 0.00 0.00 51.96 50.91 2in0 s ALA 433 Cb -0.17 -1.02 0.03 0.00 0.00 0.00 0.00 23.12 21.96 2in0 s ALA 433 CO 0.10 -0.12 0.27 0.39 0.00 0.00 0.00 175.76 176.40 2in0 n GLU 434 N 4.23 -3.06 -0.27 0.00 -0.58 0.31 -0.19 120.64 121.09 2in0 n GLU 434 Ca -0.20 0.63 0.00 0.00 -0.42 0.00 0.00 57.16 57.17 2in0 n GLU 434 Cb 0.51 -5.32 0.00 0.00 -0.57 0.00 0.00 31.44 26.06 2in0 n GLU 434 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2in0 n GLY 435 N -1.07 2.16 3.84 0.62 0.00 -1.26 -4.80 105.19 104.68 2in0 n GLY 435 Ca -0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.55 2in0 n GLY 435 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2in0 s VAL 436 N -3.16 5.38 -0.26 1.61 1.01 0.74 -0.37 120.40 125.36 2in0 s VAL 436 Ca 0.00 0.36 -0.29 0.00 0.00 0.00 0.00 61.98 62.05 2in0 s VAL 436 Cb 0.00 -3.49 0.01 0.00 0.00 0.00 0.00 36.38 32.89 2in0 s VAL 436 CO 0.00 0.57 1.15 -0.69 0.00 0.00 0.00 175.10 176.12 2in0 s VAL 437 N -0.72 4.44 0.24 2.92 1.01 -0.28 -0.22 120.40 127.80 2in0 s VAL 437 Ca 0.16 1.70 0.02 0.00 0.00 0.00 0.00 61.98 63.86 2in0 s VAL 437 Cb -0.13 -4.25 -0.05 0.00 0.00 0.00 0.00 36.38 31.95 2in0 s VAL 437 CO 0.05 -0.31 0.06 0.68 0.00 0.00 0.00 175.10 175.58 2in0 s VAL 438 N 3.61 0.69 0.45 2.92 -7.23 -0.34 -1.44 120.40 119.07 2in0 s VAL 438 Ca 0.49 -2.00 -0.21 0.00 -1.81 0.00 0.00 61.98 58.45 2in0 s VAL 438 Cb -0.16 -2.52 -0.10 0.00 0.56 0.00 0.00 36.38 34.16 2in0 s VAL 438 CO 0.14 -0.13 0.98 -2.28 -0.31 0.00 0.00 175.10 173.50 2in0 s HIS 439 N -3.66 3.21 -2.00 2.82 5.65 -0.52 -1.54 115.29 119.24 2in0 s HIS 439 Ca 0.34 1.59 0.20 0.00 0.25 0.00 0.00 55.06 57.45 2in0 s HIS 439 Cb 0.07 -2.92 1.21 0.00 -1.18 0.00 0.00 32.58 29.77 2in0 s HIS 439 CO 0.11 -0.36 1.60 0.27 -0.65 0.00 0.00 174.74 175.71