#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v5x s ARG 2 N 0.00 4.63 -0.04 2.12 0.52 -1.25 -4.97 118.95 119.96 1v5x s ARG 2 Ca 0.00 1.29 0.05 0.00 -0.52 0.00 0.00 55.73 56.54 1v5x s ARG 2 Cb 0.00 -3.35 -0.01 0.00 0.52 0.00 0.00 34.95 32.11 1v5x s ARG 2 CO 0.00 0.30 -0.17 0.08 0.02 0.00 0.00 175.30 175.52 1v5x s VAL 3 N -0.22 1.42 -0.09 3.52 1.01 -1.26 -0.42 120.40 124.37 1v5x s VAL 3 Ca 0.42 -0.73 0.04 0.00 0.00 0.00 0.00 61.98 61.71 1v5x s VAL 3 Cb -0.22 -1.21 -0.01 0.00 0.00 0.00 0.00 36.38 34.93 1v5x s VAL 3 CO 0.27 0.41 -0.20 -0.75 0.00 0.00 0.00 175.10 174.83 1v5x s LYS 4 N -0.06 2.88 -0.30 2.72 2.20 -0.29 -0.99 119.74 125.90 1v5x s LYS 4 Ca -0.01 -0.80 -0.08 0.00 -0.36 0.00 0.00 55.97 54.71 1v5x s LYS 4 Cb -0.10 -2.36 0.00 0.00 -1.51 0.00 0.00 37.83 33.86 1v5x s LYS 4 CO 0.02 0.33 0.11 0.42 -0.36 0.00 0.00 175.35 175.87 1v5x s ILE 5 N -0.01 4.23 0.51 5.43 -1.09 -0.42 -1.21 121.20 128.64 1v5x s ILE 5 Ca -0.06 -0.57 0.06 0.00 -2.23 0.00 0.00 60.65 57.84 1v5x s ILE 5 Cb -0.15 -3.17 0.04 0.00 -1.58 0.00 0.00 42.46 37.60 1v5x s ILE 5 CO 0.05 0.08 0.70 0.00 -1.23 0.00 0.00 174.94 174.54 1v5x n GLY 7 N -2.14 -0.16 3.71 0.00 0.00 -1.11 -4.68 105.19 100.81 1v5x n GLY 7 Ca 0.10 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 1v5x n GLY 7 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1v5x s ILE 8 N -2.80 3.69 0.00 -0.61 -1.09 -0.24 -4.37 121.20 115.78 1v5x s ILE 8 Ca 0.09 1.20 0.00 0.00 -2.23 0.00 0.00 60.65 59.70 1v5x s ILE 8 Cb -0.04 -3.77 0.00 0.00 -1.58 0.00 0.00 42.46 37.08 1v5x s ILE 8 CO 0.11 0.08 0.09 0.35 -1.23 0.00 0.00 174.94 174.34 1v5x n THR 9 N 4.04 0.00 -4.12 2.92 -2.24 -1.25 -4.63 114.28 109.00 1v5x n THR 9 Ca 0.11 -0.23 -0.15 0.00 -2.27 0.00 0.00 64.05 61.51 1v5x n THR 9 Cb 0.44 1.22 -0.14 0.00 -2.10 0.00 0.00 70.33 69.76 1v5x n THR 9 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1v5x s ARG 10 N -0.27 0.43 0.17 -0.78 0.52 -1.26 -5.06 118.95 112.70 1v5x s ARG 10 Ca 0.00 -0.34 -0.14 0.00 -0.52 0.00 0.00 55.73 54.73 1v5x s ARG 10 Cb 0.00 -0.35 0.12 0.00 0.52 0.00 0.00 34.95 35.24 1v5x s ARG 10 CO 0.00 0.09 1.75 1.25 0.02 0.00 0.00 175.30 178.41 1v5x h LEU 11 N 5.58 0.17 -0.97 2.53 5.85 -1.97 -2.12 115.31 124.38 1v5x h LEU 11 Ca -0.30 0.05 0.10 0.00 0.84 0.00 0.00 57.88 58.57 1v5x h LEU 11 Cb 1.20 0.03 -0.08 0.00 0.37 0.00 0.00 40.66 42.18 1v5x h LEU 11 CO 0.47 0.13 0.61 1.05 -0.34 0.00 0.00 178.44 180.36 1v5x h GLU 12 N 0.33 0.98 -0.42 1.25 4.11 -1.99 0.24 114.58 119.09 1v5x h GLU 12 Ca 0.21 -0.06 -0.10 0.00 0.07 0.00 0.00 59.36 59.48 1v5x h GLU 12 Cb 0.20 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 1v5x h GLU 12 CO -0.21 0.65 -0.12 -0.44 0.07 0.00 0.00 179.01 178.96 1v5x h ASP 13 N 1.01 0.83 -0.28 3.06 3.32 -1.83 -2.00 116.42 120.53 1v5x h ASP 13 Ca 0.46 -0.37 -0.00 0.00 0.02 0.00 0.00 57.03 57.14 1v5x h ASP 13 Cb 0.37 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 1v5x h ASP 13 CO -0.24 1.01 0.17 0.00 -1.72 0.00 0.00 179.24 178.46 1v5x h ALA 14 N 0.84 0.36 -0.70 3.45 0.00 -0.69 -1.47 119.26 121.06 1v5x h ALA 14 Ca 0.10 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1v5x h ALA 14 Cb 0.66 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1v5x h ALA 14 CO 0.05 -0.13 0.33 -0.07 0.00 0.00 0.00 179.25 179.42 1v5x h LEU 15 N 0.35 0.92 -0.12 0.00 3.38 -0.94 -0.57 115.31 118.32 1v5x h LEU 15 Ca 0.10 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 1v5x h LEU 15 Cb 0.02 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.53 1v5x h LEU 15 CO -0.02 0.80 -0.03 0.25 0.09 0.00 0.00 178.44 179.53 1v5x h LEU 16 N 0.97 0.23 -0.55 1.67 6.46 -1.26 0.20 115.31 123.04 1v5x h LEU 16 Ca 0.24 -0.36 0.06 0.00 -0.12 0.00 0.00 57.88 57.70 1v5x h LEU 16 Cb 0.13 -0.06 -0.05 0.00 -0.73 0.00 0.00 40.66 39.94 1v5x h LEU 16 CO -0.03 0.54 0.26 0.00 -0.62 0.00 0.00 178.44 178.59 1v5x h ALA 17 N 0.70 0.71 -0.14 1.25 0.00 -1.14 0.90 119.26 121.53 1v5x h ALA 17 Ca 0.03 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1v5x h ALA 17 Cb 0.44 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1v5x h ALA 17 CO 0.01 -0.10 0.08 1.49 0.00 0.00 0.00 179.25 180.73 1v5x h GLU 18 N 0.49 0.17 -0.82 0.00 4.81 -0.97 -2.28 114.58 115.99 1v5x h GLU 18 Ca 0.25 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.49 1v5x h GLU 18 Cb 0.20 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.50 1v5x h GLU 18 CO -0.20 0.11 0.54 0.00 -0.73 0.00 0.00 179.01 178.74 1v5x h ALA 19 N 1.05 1.45 0.00 2.92 0.00 -0.22 -1.76 119.26 122.70 1v5x h ALA 19 Ca 0.05 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1v5x h ALA 19 Cb -0.01 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.46 1v5x h ALA 19 CO -0.02 0.50 0.00 1.28 0.00 0.00 0.00 179.25 181.01 1v5x n LEU 20 N -4.43 0.12 0.00 0.00 4.77 0.24 -4.89 117.00 112.81 1v5x n LEU 20 Ca 0.10 0.52 0.00 0.00 -0.03 0.00 0.00 56.01 56.60 1v5x n LEU 20 Cb 0.06 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.65 1v5x n LEU 20 CO 0.36 -0.21 0.00 0.61 -1.33 0.00 0.00 177.39 176.82 1v5x n GLY 21 N 0.49 1.42 3.77 -0.72 0.00 -0.66 -4.94 105.19 104.56 1v5x n GLY 21 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 1v5x n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v5x s ALA 22 N -2.00 3.37 -0.15 4.61 0.00 -0.88 -4.81 121.76 121.90 1v5x s ALA 22 Ca 0.00 1.12 0.16 0.00 0.00 0.00 0.00 51.96 53.24 1v5x s ALA 22 Cb 0.00 -3.43 -0.03 0.00 0.00 0.00 0.00 23.12 19.66 1v5x s ALA 22 CO 0.00 -0.55 1.14 0.74 0.00 0.00 0.00 175.76 177.09 1v5x h PHE 23 N 3.21 0.00 -3.53 0.00 -1.00 -1.42 -3.45 116.94 110.75 1v5x h PHE 23 Ca -0.49 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.20 1v5x h PHE 23 Cb 1.23 0.00 -0.16 0.00 3.61 0.00 0.00 35.95 40.62 1v5x h PHE 23 CO 0.56 0.51 -0.34 0.00 -1.61 0.00 0.00 178.31 177.43 1v5x s ALA 24 N -2.97 -0.45 -0.04 2.45 0.00 -1.12 -0.89 121.76 118.75 1v5x s ALA 24 Ca 0.01 -0.25 0.03 0.00 0.00 0.00 0.00 51.96 51.74 1v5x s ALA 24 Cb 0.08 0.34 0.00 0.00 0.00 0.00 0.00 23.12 23.55 1v5x s ALA 24 CO 0.78 -0.41 -0.12 -0.51 0.00 0.00 0.00 175.76 175.50 1v5x s LEU 25 N -2.24 1.79 -0.13 0.00 1.43 0.01 -1.31 118.68 118.23 1v5x s LEU 25 Ca -0.03 -0.25 -0.10 0.00 -1.03 0.00 0.00 54.13 52.72 1v5x s LEU 25 Cb 0.00 -0.72 -0.05 0.00 0.03 0.00 0.00 46.19 45.46 1v5x s LEU 25 CO -0.05 0.09 0.20 -0.83 0.23 0.00 0.00 176.35 175.98 1v5x s GLY 26 N 0.23 2.18 -0.27 -3.19 0.00 0.44 -0.31 107.32 106.39 1v5x s GLY 26 Ca -0.05 -0.56 0.02 0.00 0.00 0.00 0.00 44.72 44.13 1v5x s GLY 26 CO 0.01 -0.04 -0.02 -1.36 0.00 0.00 0.00 173.10 171.69 1v5x s PHE 27 N -0.44 2.85 -0.14 1.90 0.08 0.10 -1.08 117.98 121.25 1v5x s PHE 27 Ca 0.15 -2.19 -0.29 0.00 0.12 0.00 0.00 56.93 54.71 1v5x s PHE 27 Cb -0.13 -2.01 -0.02 0.00 -0.57 0.00 0.00 43.02 40.30 1v5x s PHE 27 CO 0.04 -0.85 1.18 0.08 -0.10 0.00 0.00 175.22 175.56 1v5x s VAL 28 N 1.23 4.40 -0.12 -0.44 1.01 -1.26 -1.22 120.40 124.00 1v5x s VAL 28 Ca -0.01 1.70 0.17 0.00 0.00 0.00 0.00 61.98 63.84 1v5x s VAL 28 Cb -0.19 -4.09 0.27 0.00 0.00 0.00 0.00 36.38 32.37 1v5x s VAL 28 CO -0.09 -0.09 1.14 0.18 0.00 0.00 0.00 175.10 176.25 1v5x n LEU 29 N 5.94 2.19 -4.58 3.92 4.77 -0.26 -0.69 117.00 128.29 1v5x n LEU 29 Ca 0.12 -2.96 -0.41 0.00 -0.03 0.00 0.00 56.01 52.73 1v5x n LEU 29 Cb 0.46 -0.40 -0.08 0.00 -2.33 0.00 0.00 43.42 41.07 1v5x n LEU 29 CO 0.55 0.70 0.21 0.00 -1.33 0.00 0.00 177.39 177.52 1v5x s ALA 30 N -2.67 3.52 0.42 -1.18 0.00 -1.18 -4.92 121.76 115.75 1v5x s ALA 30 Ca 0.30 -0.89 -0.25 0.00 0.00 0.00 0.00 51.96 51.12 1v5x s ALA 30 Cb 0.26 -2.95 -0.10 0.00 0.00 0.00 0.00 23.12 20.34 1v5x s ALA 30 CO 0.02 -1.03 1.27 -2.30 0.00 0.00 0.00 175.76 173.73 1v5x n PRO 31 N 5.64 1.93 0.00 0.00 -0.02 -1.26 -2.18 135.00 139.11 1v5x n PRO 31 Ca -0.05 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 1v5x n PRO 31 Cb 0.49 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 1v5x n PRO 31 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1v5x n GLY 32 N 0.81 1.15 3.81 -1.23 0.00 -1.26 -5.02 105.19 103.44 1v5x n GLY 32 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 1v5x n GLY 32 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1v5x s SER 33 N -2.41 7.13 0.42 1.61 0.15 -0.93 -4.97 113.70 114.71 1v5x s SER 33 Ca 0.00 1.50 0.20 0.00 0.70 0.00 0.00 55.95 58.36 1v5x s SER 33 Cb 0.00 -2.45 0.94 0.00 -1.71 0.00 0.00 66.02 62.80 1v5x s SER 33 CO 0.00 0.03 1.86 0.03 1.20 0.00 0.00 173.24 176.37 1v5x h ARG 34 N 3.46 0.00 -0.56 5.44 3.08 -1.97 -3.08 114.38 120.76 1v5x h ARG 34 Ca -0.48 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.46 1v5x h ARG 34 Cb 1.19 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 31.18 1v5x h ARG 34 CO 0.65 0.28 0.12 0.54 -1.07 0.00 0.00 179.97 180.49 1v5x n ARG 35 N -3.69 3.63 -1.77 0.04 1.74 -1.26 -4.72 116.66 110.64 1v5x n ARG 35 Ca -0.01 -3.06 -0.40 0.00 -0.77 0.00 0.00 57.85 53.60 1v5x n ARG 35 Cb 0.40 -2.11 0.01 0.00 -1.02 0.00 0.00 32.46 29.74 1v5x n ARG 35 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1v5x n ARG 36 N -0.16 2.40 -4.17 5.56 0.63 -1.17 -4.36 116.66 115.39 1v5x n ARG 36 Ca 0.33 0.85 -0.16 0.00 -0.92 0.00 0.00 57.85 57.95 1v5x n ARG 36 Cb 1.20 -2.64 -0.13 0.00 0.45 0.00 0.00 32.46 31.35 1v5x n ARG 36 CO 0.00 0.00 0.00 -1.50 -2.51 0.00 0.00 177.63 173.62 1v5x s ILE 37 N -1.16 0.70 0.19 5.15 2.07 0.13 -4.98 121.20 123.31 1v5x s ILE 37 Ca 0.58 -0.88 -0.31 0.00 -1.41 0.00 0.00 60.65 58.64 1v5x s ILE 37 Cb -0.46 -0.69 -0.09 0.00 0.13 0.00 0.00 42.46 41.35 1v5x s ILE 37 CO 0.60 -0.15 1.41 0.00 -1.91 0.00 0.00 174.94 174.89 1v5x s ALA 38 N -0.94 3.62 0.33 1.50 0.00 -1.26 -4.61 121.76 120.39 1v5x s ALA 38 Ca -0.04 1.23 0.04 0.00 0.00 0.00 0.00 51.96 53.20 1v5x s ALA 38 Cb -0.08 -3.54 0.66 0.00 0.00 0.00 0.00 23.12 20.16 1v5x s ALA 38 CO 0.01 -0.66 1.90 -1.35 0.00 0.00 0.00 175.76 175.66 1v5x h PRO 39 N 5.78 0.85 0.00 0.00 0.11 -1.95 0.22 132.00 137.01 1v5x h PRO 39 Ca -0.44 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.57 1v5x h PRO 39 Cb 1.21 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 1v5x h PRO 39 CO 0.82 0.56 -0.22 0.93 -0.21 0.00 0.00 178.00 179.88 1v5x h GLU 40 N 0.87 0.00 -0.14 1.05 3.07 -1.91 -1.40 114.58 116.12 1v5x h GLU 40 Ca 0.40 0.00 -0.21 0.00 -0.50 0.00 0.00 59.36 59.05 1v5x h GLU 40 Cb 0.38 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.30 1v5x h GLU 40 CO -0.16 0.22 -0.74 0.00 -1.40 0.00 0.00 179.01 176.93 1v5x h ALA 41 N 1.78 0.28 -0.64 3.43 0.00 -0.99 -2.04 119.26 121.08 1v5x h ALA 41 Ca -0.00 -0.59 -0.02 0.00 0.00 0.00 0.00 54.91 54.30 1v5x h ALA 41 Cb 0.39 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1v5x h ALA 41 CO 0.03 0.63 0.31 0.00 0.00 0.00 0.00 179.25 180.21 1v5x h ALA 42 N 0.53 1.34 -0.15 0.00 0.00 -0.69 -0.40 119.26 119.89 1v5x h ALA 42 Ca -0.05 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 1v5x h ALA 42 Cb 1.37 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1v5x h ALA 42 CO 0.15 0.52 0.03 -0.09 0.00 0.00 0.00 179.25 179.86 1v5x h ARG 43 N 0.90 0.25 -0.24 0.00 2.43 -1.20 -0.20 114.38 116.32 1v5x h ARG 43 Ca 0.22 -0.06 0.03 0.00 -0.81 0.00 0.00 59.98 59.36 1v5x h ARG 43 Cb 0.09 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.58 1v5x h ARG 43 CO -0.03 0.41 0.05 0.00 -1.51 0.00 0.00 179.97 178.89 1v5x h ALA 44 N 0.83 0.25 -0.69 2.80 0.00 -0.82 -0.11 119.26 121.53 1v5x h ALA 44 Ca 0.05 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1v5x h ALA 44 Cb 0.27 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1v5x h ALA 44 CO 0.00 -0.37 0.42 0.82 0.00 0.00 0.00 179.25 180.12 1v5x h ILE 45 N 0.15 1.19 -0.97 0.00 2.04 -1.02 -1.90 117.51 117.00 1v5x h ILE 45 Ca 0.11 -0.41 0.07 0.00 1.00 0.00 0.00 64.86 65.63 1v5x h ILE 45 Cb 0.10 0.22 -0.07 0.00 -0.74 0.00 0.00 36.82 36.33 1v5x h ILE 45 CO -0.14 0.20 0.62 1.23 0.00 0.00 0.00 178.15 180.06 1v5x h GLY 46 N 0.97 1.47 2.00 5.37 0.00 0.75 -0.87 103.07 112.76 1v5x h GLY 46 Ca 0.25 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 47.13 1v5x h GLY 46 CO -0.05 0.31 0.00 0.83 0.00 0.00 0.00 176.54 177.64 1v5x h GLU 47 N 1.12 0.00 0.00 4.80 5.08 -0.39 -1.99 114.58 123.20 1v5x h GLU 47 Ca 0.42 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.78 1v5x h GLU 47 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1v5x h GLU 47 CO -0.18 0.00 -0.88 0.00 -1.00 0.00 0.00 179.01 176.95 1v5x n ALA 48 N -1.89 3.37 -2.19 3.43 0.00 -0.34 -4.96 120.51 117.92 1v5x n ALA 48 Ca -0.00 -0.37 -0.28 0.00 0.00 0.00 0.00 53.44 52.78 1v5x n ALA 48 Cb 0.14 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.57 1v5x n ALA 48 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1v5x s LEU 49 N -3.85 3.55 0.77 0.00 1.43 -0.75 -5.05 118.68 114.78 1v5x s LEU 49 Ca 0.05 1.02 -0.12 0.00 -1.03 0.00 0.00 54.13 54.06 1v5x s LEU 49 Cb 0.15 -3.99 0.05 0.00 0.03 0.00 0.00 46.19 42.42 1v5x s LEU 49 CO 0.78 -0.63 1.11 -0.83 0.23 0.00 0.00 176.35 177.01 1v5x s GLY 50 N -4.12 1.62 0.30 -3.19 0.00 -1.26 -4.97 107.32 95.69 1v5x s GLY 50 Ca 0.49 -0.37 0.25 0.00 0.00 0.00 0.00 44.72 45.09 1v5x s GLY 50 CO 0.47 0.05 1.76 -0.56 0.00 0.00 0.00 173.10 174.82 1v5x h PRO 51 N -0.91 0.00 -1.80 2.90 0.13 -1.98 -3.34 132.00 126.99 1v5x h PRO 51 Ca -0.46 0.00 -0.74 0.00 -0.87 0.00 0.00 66.00 63.93 1v5x h PRO 51 Cb 1.28 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 32.14 1v5x h PRO 51 CO 0.63 0.00 1.01 1.19 -0.23 0.00 0.00 178.00 180.60 1v5x n PHE 52 N -2.39 2.98 -3.76 1.56 3.72 -1.26 -4.84 117.46 113.47 1v5x n PHE 52 Ca 0.03 -2.45 -0.13 0.00 -0.05 0.00 0.00 57.45 54.85 1v5x n PHE 52 Cb 0.29 -1.25 -0.13 0.00 -0.94 0.00 0.00 39.48 37.45 1v5x n PHE 52 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1v5x s VAL 53 N -4.94 -0.03 -0.03 -4.37 0.11 -1.26 -4.95 120.40 104.94 1v5x s VAL 53 Ca 0.55 0.11 -0.26 0.00 -2.93 0.00 0.00 61.98 59.45 1v5x s VAL 53 Cb 0.45 -0.32 -0.04 0.00 -1.53 0.00 0.00 36.38 34.94 1v5x s VAL 53 CO -0.33 0.04 0.80 -0.69 -3.33 0.00 0.00 175.10 171.59 1v5x s VAL 54 N 0.88 4.94 -0.32 2.04 1.01 -0.07 -4.96 120.40 123.92 1v5x s VAL 54 Ca -0.06 1.67 -0.16 0.00 0.00 0.00 0.00 61.98 63.43 1v5x s VAL 54 Cb -0.08 -4.14 -0.02 0.00 0.00 0.00 0.00 36.38 32.14 1v5x s VAL 54 CO -0.05 0.24 0.42 -0.13 0.00 0.00 0.00 175.10 175.58 1v5x s ARG 55 N 0.73 3.71 -0.13 2.72 0.52 -1.26 -0.81 118.95 124.42 1v5x s ARG 55 Ca 0.42 -0.19 -0.03 0.00 -0.52 0.00 0.00 55.73 55.41 1v5x s ARG 55 Cb -0.19 -3.76 -0.03 0.00 0.52 0.00 0.00 34.95 31.48 1v5x s ARG 55 CO 0.22 -0.50 -0.02 0.08 0.02 0.00 0.00 175.30 175.11 1v5x s VAL 56 N 2.17 4.11 -0.16 3.52 1.01 0.57 -0.71 120.40 130.91 1v5x s VAL 56 Ca 0.15 -0.29 -0.09 0.00 0.00 0.00 0.00 61.98 61.74 1v5x s VAL 56 Cb -0.16 -2.78 -0.05 0.00 0.00 0.00 0.00 36.38 33.39 1v5x s VAL 56 CO 0.12 0.53 0.16 -0.83 0.00 0.00 0.00 175.10 175.07 1v5x s GLY 57 N -0.05 2.11 -0.16 4.51 0.00 0.68 0.01 107.32 114.42 1v5x s GLY 57 Ca 0.02 -0.64 -0.02 0.00 0.00 0.00 0.00 44.72 44.08 1v5x s GLY 57 CO 0.02 -0.00 -0.07 0.14 0.00 0.00 0.00 173.10 173.19 1v5x s VAL 58 N -0.12 3.47 0.28 1.40 1.01 -0.36 0.67 120.40 126.74 1v5x s VAL 58 Ca 0.11 -0.50 0.05 0.00 0.00 0.00 0.00 61.98 61.65 1v5x s VAL 58 Cb -0.12 -2.51 -0.06 0.00 0.00 0.00 0.00 36.38 33.69 1v5x s VAL 58 CO 0.01 0.49 -0.03 -0.36 0.00 0.00 0.00 175.10 175.21 1v5x s PHE 59 N 0.63 1.87 -0.20 5.22 0.08 0.10 -1.11 117.98 124.57 1v5x s PHE 59 Ca -0.04 -0.79 -0.04 0.00 0.12 0.00 0.00 56.93 56.17 1v5x s PHE 59 Cb -0.15 -1.10 0.10 0.00 -0.57 0.00 0.00 43.02 41.30 1v5x s PHE 59 CO 0.03 0.16 0.33 0.50 -0.10 0.00 0.00 175.22 176.13 1v5x s ARG 60 N -3.79 0.26 -1.43 0.44 3.52 -1.26 0.42 118.95 117.11 1v5x s ARG 60 Ca 0.30 0.60 -0.11 0.00 -0.13 0.00 0.00 55.73 56.40 1v5x s ARG 60 Cb 0.05 -0.39 0.08 0.00 -1.56 0.00 0.00 34.95 33.13 1v5x s ARG 60 CO 0.12 -0.49 0.68 -0.25 -0.81 0.00 0.00 175.30 174.54 1v5x n ASP 61 N 5.36 -4.31 -4.56 -2.12 8.00 -1.26 -4.88 116.55 112.77 1v5x n ASP 61 Ca -0.05 -0.55 -0.34 0.00 0.71 0.00 0.00 54.79 54.55 1v5x n ASP 61 Cb 0.50 -3.51 -0.11 0.00 -0.02 0.00 0.00 41.12 37.98 1v5x n ASP 61 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1v5x s GLN 62 N -6.25 3.25 0.71 -1.24 -0.21 -1.26 -5.07 119.66 109.60 1v5x s GLN 62 Ca 0.50 -0.50 -0.16 0.00 0.02 0.00 0.00 55.36 55.22 1v5x s GLN 62 Cb -0.26 -2.79 0.03 0.00 1.00 0.00 0.00 33.01 30.98 1v5x s GLN 62 CO 0.62 0.47 1.23 -1.25 -2.12 0.00 0.00 175.29 174.24 1v5x s PRO 63 N -0.26 2.22 0.25 2.91 0.04 -1.26 -4.68 135.00 134.22 1v5x s PRO 63 Ca 0.05 1.84 -0.10 0.00 0.04 0.00 0.00 61.00 62.83 1v5x s PRO 63 Cb -0.13 -1.83 0.38 0.00 0.04 0.00 0.00 34.50 32.96 1v5x s PRO 63 CO 0.02 -1.79 1.60 -1.35 0.04 0.00 0.00 177.00 175.52 1v5x h PRO 64 N -0.09 0.02 -0.41 0.56 0.11 -1.99 0.10 132.00 130.30 1v5x h PRO 64 Ca -0.48 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.62 1v5x h PRO 64 Cb 1.31 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.39 1v5x h PRO 64 CO 0.50 0.01 0.24 1.05 -0.21 0.00 0.00 178.00 179.60 1v5x h GLU 65 N 0.02 0.56 -0.04 1.05 9.09 -1.98 0.16 114.58 123.43 1v5x h GLU 65 Ca 0.40 -0.05 -0.04 0.00 0.05 0.00 0.00 59.36 59.73 1v5x h GLU 65 Cb 0.65 -0.12 0.00 0.00 -1.65 0.00 0.00 28.75 27.63 1v5x h GLU 65 CO -0.80 0.40 -0.11 1.49 0.05 0.00 0.00 179.01 180.04 1v5x h GLU 66 N 0.57 0.15 -0.39 1.06 4.81 -1.38 -1.88 114.58 117.53 1v5x h GLU 66 Ca 0.15 -0.11 0.07 0.00 -0.13 0.00 0.00 59.36 59.34 1v5x h GLU 66 Cb -0.01 0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.33 1v5x h GLU 66 CO -0.03 0.71 0.01 0.28 -0.73 0.00 0.00 179.01 179.25 1v5x h VAL 67 N -0.38 0.71 -0.52 0.32 2.07 -0.66 0.74 116.25 118.53 1v5x h VAL 67 Ca -0.00 -0.04 -0.05 0.00 0.82 0.00 0.00 66.70 67.42 1v5x h VAL 67 Cb 0.71 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 1v5x h VAL 67 CO 0.02 0.02 0.10 -0.07 0.02 0.00 0.00 177.57 177.66 1v5x h LEU 68 N 0.12 0.75 0.18 2.57 3.38 -0.74 0.11 115.31 121.67 1v5x h LEU 68 Ca 0.19 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1v5x h LEU 68 Cb 0.27 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1v5x h LEU 68 CO -0.31 0.76 -0.09 -0.09 0.09 0.00 0.00 178.44 178.80 1v5x h ARG 69 N 0.77 -0.23 -0.25 1.13 2.43 -0.44 -2.33 114.38 115.46 1v5x h ARG 69 Ca 0.17 0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.38 1v5x h ARG 69 Cb 0.32 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.90 1v5x h ARG 69 CO 0.00 0.01 0.07 -0.07 -1.51 0.00 0.00 179.97 178.47 1v5x h LEU 70 N -0.45 0.05 -0.91 3.80 3.38 -0.57 0.42 115.31 121.02 1v5x h LEU 70 Ca -0.02 0.03 0.16 0.00 0.09 0.00 0.00 57.88 58.14 1v5x h LEU 70 Cb 0.35 0.04 -0.10 0.00 0.09 0.00 0.00 40.66 41.04 1v5x h LEU 70 CO 0.04 0.06 0.51 0.24 0.09 0.00 0.00 178.44 179.38 1v5x h MET 71 N 0.17 0.67 -0.05 1.13 2.86 -0.77 0.12 114.93 119.06 1v5x h MET 71 Ca 0.11 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.69 1v5x h MET 71 Cb 0.10 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 31.61 1v5x h MET 71 CO -0.13 0.45 -0.04 1.49 1.06 0.00 0.00 176.91 179.73 1v5x h GLU 72 N 0.69 0.11 -0.61 1.72 4.57 -0.79 -0.19 114.58 120.09 1v5x h GLU 72 Ca 0.50 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.63 1v5x h GLU 72 Cb 0.72 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.28 1v5x h GLU 72 CO -0.36 0.54 0.39 1.49 -1.18 0.00 0.00 179.01 179.89 1v5x h GLU 73 N -0.31 0.82 -0.01 1.92 4.81 -0.11 -2.42 114.58 119.27 1v5x h GLU 73 Ca 0.01 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1v5x h GLU 73 Cb 0.52 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.72 1v5x h GLU 73 CO 0.01 0.56 -0.06 0.00 -0.73 0.00 0.00 179.01 178.78 1v5x n ALA 74 N -2.28 2.72 -3.62 2.92 0.00 0.35 -4.67 120.51 115.92 1v5x n ALA 74 Ca 0.04 -0.36 -0.20 0.00 0.00 0.00 0.00 53.44 52.92 1v5x n ALA 74 Cb 0.03 -1.26 0.05 0.00 0.00 0.00 0.00 19.45 18.27 1v5x n ALA 74 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1v5x n ARG 75 N -0.40 -5.26 -3.07 0.00 5.12 -0.23 -3.50 116.66 109.33 1v5x n ARG 75 Ca 0.18 0.68 -0.21 0.00 -1.93 0.00 0.00 57.85 56.57 1v5x n ARG 75 Cb 0.30 -5.35 0.01 0.00 -1.16 0.00 0.00 32.46 26.26 1v5x n ARG 75 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1v5x s LEU 76 N -6.57 3.68 -0.05 0.55 1.43 -0.37 -4.99 118.68 112.37 1v5x s LEU 76 Ca 0.01 -0.01 0.05 0.00 -1.03 0.00 0.00 54.13 53.15 1v5x s LEU 76 Cb -0.00 -2.91 -0.07 0.00 0.03 0.00 0.00 46.19 43.23 1v5x s LEU 76 CO 0.79 -0.71 0.04 0.00 0.23 0.00 0.00 176.35 176.70 1v5x n GLN 77 N -1.96 2.67 -4.59 1.70 6.02 0.12 -4.85 117.38 116.48 1v5x n GLN 77 Ca 0.03 -0.01 -0.23 0.00 -0.01 0.00 0.00 57.00 56.78 1v5x n GLN 77 Cb 0.58 -1.14 -0.14 0.00 1.02 0.00 0.00 30.24 30.56 1v5x n GLN 77 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1v5x s VAL 78 N -2.18 1.33 -0.22 5.09 1.01 -0.92 -4.04 120.40 120.47 1v5x s VAL 78 Ca -0.03 -0.93 -0.05 0.00 0.00 0.00 0.00 61.98 60.96 1v5x s VAL 78 Cb 0.02 -1.15 -0.02 0.00 0.00 0.00 0.00 36.38 35.23 1v5x s VAL 78 CO 0.23 0.20 0.01 0.00 0.00 0.00 0.00 175.10 175.54 1v5x s ALA 79 N -0.65 3.01 -0.32 5.51 0.00 -0.72 -0.23 121.76 128.36 1v5x s ALA 79 Ca 0.05 -1.08 -0.10 0.00 0.00 0.00 0.00 51.96 50.83 1v5x s ALA 79 Cb -0.07 -1.85 -0.01 0.00 0.00 0.00 0.00 23.12 21.19 1v5x s ALA 79 CO 0.01 -0.32 0.17 -1.14 0.00 0.00 0.00 175.76 174.47 1v5x s GLN 80 N 1.30 3.34 -0.48 0.00 0.74 0.21 -0.95 119.66 123.83 1v5x s GLN 80 Ca 0.04 -0.72 -0.18 0.00 0.05 0.00 0.00 55.36 54.55 1v5x s GLN 80 Cb -0.15 -3.60 0.05 0.00 1.10 0.00 0.00 33.01 30.41 1v5x s GLN 80 CO 0.01 -0.43 0.54 -0.51 -0.55 0.00 0.00 175.29 174.35 1v5x s LEU 81 N 1.63 5.07 -0.17 3.68 1.43 0.22 0.00 118.68 130.55 1v5x s LEU 81 Ca 0.05 -0.94 0.16 0.00 -1.03 0.00 0.00 54.13 52.37 1v5x s LEU 81 Cb -0.17 -2.39 0.69 0.00 0.03 0.00 0.00 46.19 44.35 1v5x s LEU 81 CO 0.07 -0.78 1.61 1.57 0.23 0.00 0.00 176.35 179.05 1v5x n HIS 82 N 5.86 1.52 0.00 0.29 -0.00 0.17 -2.00 115.22 121.05 1v5x n HIS 82 Ca -0.08 -0.71 0.00 0.00 0.46 0.00 0.00 57.72 57.40 1v5x n HIS 82 Cb 0.45 -0.34 0.00 0.00 -0.12 0.00 0.00 29.99 29.98 1v5x n HIS 82 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1v5x n GLY 83 N 0.54 1.87 1.68 1.57 0.00 -1.26 -4.86 105.19 104.73 1v5x n GLY 83 Ca 0.25 -0.23 -0.17 0.00 0.00 0.00 0.00 46.02 45.87 1v5x n GLY 83 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1v5x n GLU 84 N 0.00 2.89 -1.69 1.61 4.71 -1.26 -4.92 120.64 121.99 1v5x n GLU 84 Ca 0.00 -3.77 -0.45 0.00 -0.01 0.00 0.00 57.16 52.93 1v5x n GLU 84 Cb 0.00 -2.10 -0.04 0.00 -1.01 0.00 0.00 31.44 28.30 1v5x n GLU 84 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1v5x n GLU 85 N -0.87 2.44 -1.59 3.49 4.71 -1.26 -4.98 120.64 122.58 1v5x n GLU 85 Ca 0.40 0.89 -0.31 0.00 -0.01 0.00 0.00 57.16 58.13 1v5x n GLU 85 Cb 0.90 -2.71 0.05 0.00 -1.01 0.00 0.00 31.44 28.67 1v5x n GLU 85 CO 0.00 0.00 0.00 -1.25 0.09 0.00 0.00 177.13 175.97 1v5x s PRO 86 N 1.76 2.88 0.38 3.49 0.04 -1.26 -4.88 135.00 137.42 1v5x s PRO 86 Ca 0.80 1.03 0.14 0.00 0.04 0.00 0.00 61.00 63.01 1v5x s PRO 86 Cb -0.60 -1.98 0.97 0.00 0.04 0.00 0.00 34.50 32.93 1v5x s PRO 86 CO 0.38 -1.15 1.83 -1.35 0.04 0.00 0.00 177.00 176.75 1v5x h PRO 87 N -0.61 0.51 -0.90 0.56 0.11 -1.98 -1.03 132.00 128.67 1v5x h PRO 87 Ca -0.44 -0.03 0.09 0.00 0.11 0.00 0.00 66.00 65.73 1v5x h PRO 87 Cb 1.22 -0.12 -0.07 0.00 0.11 0.00 0.00 31.00 32.14 1v5x h PRO 87 CO 0.56 0.34 0.55 0.93 -0.21 0.00 0.00 178.00 180.16 1v5x h GLU 88 N 0.53 0.89 -0.31 1.05 3.07 -1.99 0.13 114.58 117.94 1v5x h GLU 88 Ca 0.51 -0.05 -0.09 0.00 -0.50 0.00 0.00 59.36 59.23 1v5x h GLU 88 Cb 1.10 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 28.80 1v5x h GLU 88 CO -0.24 0.59 -0.16 -1.49 -1.40 0.00 0.00 179.01 176.31 1v5x h TRP 89 N 0.92 0.76 -0.75 4.33 4.06 -1.55 -1.77 115.95 121.95 1v5x h TRP 89 Ca 0.43 -0.19 0.01 0.00 2.06 0.00 0.00 58.89 61.20 1v5x h TRP 89 Cb 0.35 -0.18 -0.04 0.00 -1.00 0.00 0.00 29.16 28.30 1v5x h TRP 89 CO -0.03 0.88 0.49 0.00 -3.56 0.00 0.00 178.44 176.22 1v5x h ALA 90 N 0.76 0.96 -0.77 1.49 0.00 -1.11 -1.06 119.26 119.53 1v5x h ALA 90 Ca 0.07 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1v5x h ALA 90 Cb 0.69 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1v5x h ALA 90 CO 0.05 0.35 0.26 0.93 0.00 0.00 0.00 179.25 180.84 1v5x h GLU 91 N 1.00 1.18 -0.47 0.00 4.39 -0.69 0.22 114.58 120.21 1v5x h GLU 91 Ca 0.28 -0.24 -0.06 0.00 0.34 0.00 0.00 59.36 59.67 1v5x h GLU 91 Cb -0.09 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 28.36 1v5x h GLU 91 CO -0.07 0.99 0.04 0.00 -1.16 0.00 0.00 179.01 178.81 1v5x h ALA 92 N 1.14 0.63 -0.08 3.43 0.00 -0.73 -2.73 119.26 120.92 1v5x h ALA 92 Ca 0.25 -0.25 -0.18 0.00 0.00 0.00 0.00 54.91 54.73 1v5x h ALA 92 Cb 0.28 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1v5x h ALA 92 CO -0.01 0.39 -0.72 0.28 0.00 0.00 0.00 179.25 179.18 1v5x h VAL 93 N 0.66 1.38 0.00 0.00 2.07 -1.06 -3.16 116.25 116.14 1v5x h VAL 93 Ca 0.14 -2.14 0.00 0.00 0.82 0.00 0.00 66.70 65.52 1v5x h VAL 93 Cb 0.44 2.11 0.00 0.00 -1.52 0.00 0.00 31.29 32.32 1v5x h VAL 93 CO 0.02 0.64 0.00 0.61 0.02 0.00 0.00 177.57 178.86 1v5x n GLY 94 N 0.54 -0.80 0.23 2.17 0.00 0.74 -1.67 105.19 106.40 1v5x n GLY 94 Ca -0.04 0.01 0.10 0.00 0.00 0.00 0.00 46.02 46.09 1v5x n GLY 94 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1v5x h ARG 95 N 0.00 0.00 0.00 1.61 3.08 -1.45 -3.34 114.38 114.27 1v5x h ARG 95 Ca 0.00 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.96 1v5x h ARG 95 Cb 0.13 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 1v5x h ARG 95 CO 0.00 0.21 -1.34 1.19 -1.07 0.00 0.00 179.97 178.96 1v5x n PHE 96 N -3.42 0.00 -4.06 3.04 3.72 -0.67 -5.08 117.46 110.99 1v5x n PHE 96 Ca -0.00 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.29 1v5x n PHE 96 Cb 0.40 -0.24 -0.11 0.00 -0.94 0.00 0.00 39.48 38.59 1v5x n PHE 96 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 1v5x s TYR 97 N -2.12 0.58 0.61 1.38 2.02 -0.81 -5.10 117.35 113.91 1v5x s TYR 97 Ca -0.03 -0.67 -0.18 0.00 -0.37 0.00 0.00 57.07 55.82 1v5x s TYR 97 Cb 0.02 -0.37 -0.02 0.00 -0.40 0.00 0.00 41.96 41.19 1v5x s TYR 97 CO 0.19 -0.17 1.20 -2.14 -1.57 0.00 0.00 175.55 173.06 1v5x s PRO 98 N -2.33 2.86 -0.03 -1.71 0.02 -1.26 -3.97 135.00 128.58 1v5x s PRO 98 Ca -0.05 1.79 0.05 0.00 0.02 0.00 0.00 61.00 62.81 1v5x s PRO 98 Cb -0.04 -1.92 -0.01 0.00 0.02 0.00 0.00 34.50 32.55 1v5x s PRO 98 CO -0.03 -1.28 -0.20 0.08 -0.33 0.00 0.00 177.00 175.24 1v5x s VAL 99 N -1.70 1.61 -0.12 3.83 1.01 -1.26 -1.76 120.40 122.00 1v5x s VAL 99 Ca 0.76 -0.84 0.01 0.00 0.00 0.00 0.00 61.98 61.91 1v5x s VAL 99 Cb -0.29 -1.36 -0.01 0.00 0.00 0.00 0.00 36.38 34.72 1v5x s VAL 99 CO 0.35 0.46 -0.16 -0.63 0.00 0.00 0.00 175.10 175.12 1v5x s ILE 100 N -0.20 2.82 -0.15 2.22 1.01 -0.13 -0.05 121.20 126.72 1v5x s ILE 100 Ca 0.01 -0.75 -0.02 0.00 0.00 0.00 0.00 60.65 59.90 1v5x s ILE 100 Cb -0.10 -2.16 -0.02 0.00 0.01 0.00 0.00 42.46 40.19 1v5x s ILE 100 CO 0.01 0.53 -0.09 -0.75 0.00 0.00 0.00 174.94 174.64 1v5x s LYS 101 N 0.37 3.47 0.09 2.79 2.47 -0.79 -0.61 119.74 127.53 1v5x s LYS 101 Ca -0.13 -0.63 -0.08 0.00 -1.56 0.00 0.00 55.97 53.58 1v5x s LYS 101 Cb -0.16 -2.78 -0.06 0.00 -1.46 0.00 0.00 37.83 33.37 1v5x s LYS 101 CO 0.06 0.15 0.38 0.00 0.16 0.00 0.00 175.35 176.10 1v5x s ALA 102 N 0.55 3.75 -0.13 3.13 0.00 -0.85 -0.37 121.76 127.84 1v5x s ALA 102 Ca -0.06 -0.45 -0.01 0.00 0.00 0.00 0.00 51.96 51.44 1v5x s ALA 102 Cb -0.15 -2.21 0.03 0.00 0.00 0.00 0.00 23.12 20.79 1v5x s ALA 102 CO 0.03 0.60 -0.04 -0.06 0.00 0.00 0.00 175.76 176.30 1v5x s PHE 103 N -1.47 1.34 -0.23 0.00 0.40 0.13 -4.79 117.98 113.36 1v5x s PHE 103 Ca 0.35 -0.75 -0.29 0.00 -0.60 0.00 0.00 56.93 55.64 1v5x s PHE 103 Cb -0.13 -1.15 -0.01 0.00 0.51 0.00 0.00 43.02 42.24 1v5x s PHE 103 CO 0.20 -0.52 1.35 -2.14 0.70 0.00 0.00 175.22 174.81 1v5x s PRO 104 N 1.75 4.01 -0.04 0.24 0.02 -1.26 -1.88 135.00 137.85 1v5x s PRO 104 Ca 0.03 1.49 -0.30 0.00 0.02 0.00 0.00 61.00 62.24 1v5x s PRO 104 Cb -0.14 -3.87 -0.03 0.00 0.02 0.00 0.00 34.50 30.48 1v5x s PRO 104 CO -0.07 -1.00 1.04 -0.51 -0.33 0.00 0.00 177.00 176.12 1v5x s LEU 105 N 4.21 4.31 0.00 -5.54 1.43 0.11 -4.78 118.68 118.42 1v5x s LEU 105 Ca 0.59 1.67 0.00 0.00 -1.03 0.00 0.00 54.13 55.36 1v5x s LEU 105 Cb -0.20 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.45 1v5x s LEU 105 CO 0.22 -0.39 0.50 1.21 0.23 0.00 0.00 176.35 178.12 1v5x n GLU 106 N 4.46 0.04 -3.04 1.70 2.13 -1.26 -2.57 120.64 122.11 1v5x n GLU 106 Ca 0.08 -0.60 0.00 0.00 0.66 0.00 0.00 57.16 57.30 1v5x n GLU 106 Cb 0.49 -0.87 0.00 0.00 0.27 0.00 0.00 31.44 31.33 1v5x n GLU 106 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1v5x n GLY 107 N -0.10 -1.20 3.59 8.31 0.00 -1.26 -5.10 105.19 109.42 1v5x n GLY 107 Ca 0.00 -0.90 -0.43 0.00 0.00 0.00 0.00 46.02 44.69 1v5x n GLY 107 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1v5x n PRO 108 N -0.01 1.33 -1.98 1.61 -0.02 -1.26 -4.89 135.00 129.77 1v5x n PRO 108 Ca 0.00 0.47 -0.39 0.00 -2.02 0.00 0.00 63.50 61.56 1v5x n PRO 108 Cb 0.00 -1.89 0.01 0.00 -0.02 0.00 0.00 33.50 31.60 1v5x n PRO 108 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1v5x s ALA 109 N -1.15 3.10 -0.26 3.55 0.00 -0.33 -4.98 121.76 121.69 1v5x s ALA 109 Ca 0.60 1.24 -0.28 0.00 0.00 0.00 0.00 51.96 53.52 1v5x s ALA 109 Cb -0.65 -3.51 0.01 0.00 0.00 0.00 0.00 23.12 18.97 1v5x s ALA 109 CO 0.59 -0.99 0.99 1.03 0.00 0.00 0.00 175.76 177.38 1v5x s ARG 110 N -2.52 4.18 0.55 0.00 1.81 -1.26 -4.45 118.95 117.26 1v5x s ARG 110 Ca 0.62 1.16 0.25 0.00 -1.72 0.00 0.00 55.73 56.05 1v5x s ARG 110 Cb -0.38 -3.67 1.57 0.00 -0.45 0.00 0.00 34.95 32.02 1v5x s ARG 110 CO 0.47 -0.67 2.18 -1.35 -0.68 0.00 0.00 175.30 175.25 1v5x h PRO 111 N 7.68 0.00 0.00 3.54 0.11 -1.94 -1.15 132.00 140.24 1v5x h PRO 111 Ca -0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.91 1v5x h PRO 111 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1v5x h PRO 111 CO 0.96 0.04 0.00 -0.85 -0.21 0.00 0.00 178.00 177.94 1v5x n GLU 112 N -4.00 0.07 0.16 1.05 0.00 -1.26 -1.83 120.64 114.82 1v5x n GLU 112 Ca -0.03 0.25 0.13 0.00 0.00 0.00 0.00 57.16 57.51 1v5x n GLU 112 Cb 0.13 -1.50 0.53 0.00 0.00 0.00 0.00 31.44 30.60 1v5x n GLU 112 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.13 175.64 1v5x h TRP 113 N 0.00 0.00 0.00 -1.84 6.55 -1.61 -1.81 115.95 117.23 1v5x h TRP 113 Ca 0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 1v5x h TRP 113 Cb 0.15 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.45 1v5x h TRP 113 CO 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 178.44 177.39 1v5x h ALA 114 N 2.21 1.00 0.00 1.49 0.00 -1.57 -1.66 119.26 120.73 1v5x h ALA 114 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1v5x h ALA 114 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1v5x h ALA 114 CO 0.00 0.00 -0.17 -0.25 0.00 0.00 0.00 179.25 178.83 1v5x n ASP 115 N -2.80 0.18 -4.75 0.00 8.00 -0.68 -4.86 116.55 111.64 1v5x n ASP 115 Ca -0.01 0.26 -0.41 0.00 0.71 0.00 0.00 54.79 55.34 1v5x n ASP 115 Cb 0.15 -0.26 -0.03 0.00 -0.02 0.00 0.00 41.12 40.96 1v5x n ASP 115 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1v5x s TYR 116 N -3.00 3.27 -1.20 1.24 6.14 -0.63 -4.91 117.35 118.26 1v5x s TYR 116 Ca 0.13 1.36 -0.21 0.00 0.64 0.00 0.00 57.07 58.98 1v5x s TYR 116 Cb 0.18 -3.56 -0.01 0.00 0.42 0.00 0.00 41.96 38.99 1v5x s TYR 116 CO 0.59 -1.62 1.82 -1.25 0.64 0.00 0.00 175.55 175.73 1v5x s PRO 117 N -0.72 3.16 -0.02 4.97 0.04 -1.26 -4.89 135.00 136.27 1v5x s PRO 117 Ca 0.53 -1.43 -0.13 0.00 0.04 0.00 0.00 61.00 60.01 1v5x s PRO 117 Cb -0.36 -5.35 0.02 0.00 0.04 0.00 0.00 34.50 28.84 1v5x s PRO 117 CO 0.42 -3.14 0.28 0.00 0.04 0.00 0.00 177.00 174.60 1v5x s ALA 118 N 7.87 -0.71 -0.75 8.56 0.00 -1.26 -4.54 121.76 130.93 1v5x s ALA 118 Ca 0.61 0.32 0.22 0.00 0.00 0.00 0.00 51.96 53.11 1v5x s ALA 118 Cb 0.01 0.01 0.88 0.00 0.00 0.00 0.00 23.12 24.02 1v5x s ALA 118 CO 0.09 -0.24 1.68 1.04 0.00 0.00 0.00 175.76 178.33 1v5x n GLN 119 N 1.49 0.12 -3.56 0.00 3.00 0.93 -4.78 117.38 114.60 1v5x n GLN 119 Ca -0.21 0.27 -0.17 0.00 -0.01 0.00 0.00 57.00 56.89 1v5x n GLN 119 Cb 0.56 -1.70 -0.06 0.00 0.00 0.00 0.00 30.24 29.04 1v5x n GLN 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1v5x s ALA 120 N -3.14 -1.78 -0.20 -1.58 0.00 -1.19 -4.65 121.76 109.22 1v5x s ALA 120 Ca 0.08 1.54 -0.02 0.00 0.00 0.00 0.00 51.96 53.56 1v5x s ALA 120 Cb 0.11 -0.38 -0.00 0.00 0.00 0.00 0.00 23.12 22.85 1v5x s ALA 120 CO 0.41 -0.36 -0.09 -0.51 0.00 0.00 0.00 175.76 175.21 1v5x s LEU 121 N -0.70 2.68 -0.19 0.00 1.43 -0.54 -1.89 118.68 119.47 1v5x s LEU 121 Ca -0.07 -0.45 -0.09 0.00 -1.03 0.00 0.00 54.13 52.49 1v5x s LEU 121 Cb -0.02 -1.66 -0.05 0.00 0.03 0.00 0.00 46.19 44.50 1v5x s LEU 121 CO 0.07 0.01 0.11 -0.22 0.23 0.00 0.00 176.35 176.55 1v5x s LEU 122 N 1.27 4.08 -0.36 1.79 0.20 0.50 -0.86 118.68 125.30 1v5x s LEU 122 Ca 0.03 0.19 -0.10 0.00 0.69 0.00 0.00 54.13 54.95 1v5x s LEU 122 Cb -0.14 -2.04 0.02 0.00 -0.43 0.00 0.00 46.19 43.60 1v5x s LEU 122 CO -0.04 0.19 0.18 -0.76 -0.29 0.00 0.00 176.35 175.63 1v5x s LEU 123 N 0.26 4.53 0.48 -0.68 1.43 -0.14 0.17 118.68 124.74 1v5x s LEU 123 Ca 0.07 -0.92 0.06 0.00 -1.03 0.00 0.00 54.13 52.31 1v5x s LEU 123 Cb -0.11 -1.99 0.00 0.00 0.03 0.00 0.00 46.19 44.11 1v5x s LEU 123 CO -0.01 -0.34 0.32 -0.62 0.23 0.00 0.00 176.35 175.94 1v5x s ASP 124 N 1.54 4.64 0.90 2.29 -1.08 -0.79 -1.36 116.67 122.82 1v5x s ASP 124 Ca 0.02 -1.12 -0.13 0.00 -0.52 0.00 0.00 52.55 50.80 1v5x s ASP 124 Cb -0.19 -0.01 0.14 0.00 -1.46 0.00 0.00 42.92 41.40 1v5x s ASP 124 CO 0.06 -0.86 1.18 -0.83 0.52 0.00 0.00 175.17 175.24 1v5x s GLY 125 N -4.14 1.62 0.46 2.66 0.00 -1.26 0.08 107.32 106.74 1v5x s GLY 125 Ca 0.37 -0.71 0.25 0.00 0.00 0.00 0.00 44.72 44.63 1v5x s GLY 125 CO 0.22 -0.12 1.83 1.70 0.00 0.00 0.00 173.10 176.73 1v5x h LYS 126 N -1.44 0.22 -3.30 2.90 3.64 -1.80 -3.30 116.57 113.48 1v5x h LYS 126 Ca -0.48 -0.01 -0.61 0.00 -1.27 0.00 0.00 60.65 58.28 1v5x h LYS 126 Cb 1.31 -0.05 -0.40 0.00 -0.41 0.00 0.00 32.23 32.68 1v5x h LYS 126 CO 0.57 0.15 -0.72 1.03 -2.27 0.00 0.00 179.45 178.21 1v5x s ARG 127 N -5.25 1.30 0.22 1.90 0.52 -1.26 -4.89 118.95 111.49 1v5x s ARG 127 Ca -0.07 -1.92 -0.31 0.00 -0.52 0.00 0.00 55.73 52.91 1v5x s ARG 127 Cb 0.23 -2.50 -0.15 0.00 0.52 0.00 0.00 34.95 33.05 1v5x s ARG 127 CO 0.79 -1.10 1.14 -2.30 0.02 0.00 0.00 175.30 173.85 1v5x n PRO 128 N 3.78 1.32 -0.06 3.54 -0.02 -1.24 -1.76 135.00 140.55 1v5x n PRO 128 Ca 0.06 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 1v5x n PRO 128 Cb 0.36 -1.94 0.00 0.00 -0.02 0.00 0.00 33.50 31.90 1v5x n PRO 128 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1v5x n GLY 129 N 1.80 1.86 0.17 -1.23 0.00 -1.26 -4.88 105.19 101.65 1v5x n GLY 129 Ca 0.13 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.20 1v5x n GLY 129 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1v5x h SER 130 N 0.00 0.00 0.00 1.61 4.64 -1.77 -3.47 113.55 114.56 1v5x h SER 130 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1v5x h SER 130 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1v5x h SER 130 CO 0.00 0.40 0.00 0.61 -0.87 0.00 0.00 176.83 176.97 1v5x n GLY 131 N 0.93 0.77 3.75 -0.77 0.00 -1.26 -5.01 105.19 103.60 1v5x n GLY 131 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 1v5x n GLY 131 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1v5x s GLU 132 N -0.16 4.52 0.51 1.61 2.02 -1.26 -3.62 118.70 122.32 1v5x s GLU 132 Ca 0.00 1.90 -0.01 0.00 0.02 0.00 0.00 54.97 56.88 1v5x s GLU 132 Cb 0.00 -3.20 0.10 0.00 0.10 0.00 0.00 34.13 31.14 1v5x s GLU 132 CO 0.00 0.00 0.70 0.00 0.02 0.00 0.00 175.26 175.98 1v5x n ALA 133 N 1.78 0.02 -3.44 5.21 0.00 -1.26 -2.92 120.51 119.90 1v5x n ALA 133 Ca 0.02 -1.31 -0.14 0.00 0.00 0.00 0.00 53.44 52.01 1v5x n ALA 133 Cb 0.44 0.19 -0.03 0.00 0.00 0.00 0.00 19.45 20.05 1v5x n ALA 133 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1v5x s TYR 134 N -2.10 -0.56 -0.11 0.00 1.13 -1.26 -4.87 117.35 109.57 1v5x s TYR 134 Ca 0.45 0.57 -0.34 0.00 -1.41 0.00 0.00 57.07 56.34 1v5x s TYR 134 Cb -0.02 0.50 -0.12 0.00 -1.10 0.00 0.00 41.96 41.22 1v5x s TYR 134 CO 0.30 -0.77 1.89 -2.30 -2.51 0.00 0.00 175.55 172.17 1v5x n PRO 135 N 0.05 2.09 0.05 -3.49 -0.02 -1.26 -4.85 135.00 127.57 1v5x n PRO 135 Ca -0.18 0.76 0.02 0.00 -2.02 0.00 0.00 63.50 62.08 1v5x n PRO 135 Cb 0.62 -2.62 0.36 0.00 -0.02 0.00 0.00 33.50 31.85 1v5x n PRO 135 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1v5x h ARG 136 N 9.27 0.40 -0.68 -0.52 2.47 -1.99 -2.59 114.38 120.75 1v5x h ARG 136 Ca -0.48 -0.08 0.20 0.00 -1.26 0.00 0.00 59.98 58.36 1v5x h ARG 136 Cb 1.28 -0.06 -0.03 0.00 -1.65 0.00 0.00 29.97 29.50 1v5x h ARG 136 CO 0.95 0.44 0.53 0.00 0.56 0.00 0.00 179.97 182.45 1v5x h ALA 137 N 1.61 2.58 0.00 0.04 0.00 -1.97 0.10 119.26 121.61 1v5x h ALA 137 Ca 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1v5x h ALA 137 Cb 0.27 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1v5x h ALA 137 CO 0.01 -0.88 0.35 -1.49 0.00 0.00 0.00 179.25 177.24 1v5x h TRP 138 N 0.00 0.00 0.00 0.00 4.06 -1.83 0.15 115.95 118.34 1v5x h TRP 138 Ca 0.32 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 61.21 1v5x h TRP 138 Cb 1.38 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.53 1v5x h TRP 138 CO 0.00 0.00 -0.34 0.00 -3.56 0.00 0.00 178.44 174.54 1v5x h ALA 139 N 1.25 0.79 -0.72 1.49 0.00 -1.02 -0.88 119.26 120.18 1v5x h ALA 139 Ca 0.00 -0.29 0.08 0.00 0.00 0.00 0.00 54.91 54.70 1v5x h ALA 139 Cb 0.69 -0.04 -0.11 0.00 0.00 0.00 0.00 17.79 18.33 1v5x h ALA 139 CO 0.00 0.39 -0.55 0.87 0.00 0.00 0.00 179.25 179.96 1v5x h LYS 140 N 0.00 -0.18 -1.01 0.00 6.56 -0.87 -0.83 116.57 120.25 1v5x h LYS 140 Ca -0.01 0.01 0.27 0.00 -1.06 0.00 0.00 60.65 59.86 1v5x h LYS 140 Cb 1.24 0.04 -0.13 0.00 -0.57 0.00 0.00 32.23 32.81 1v5x h LYS 140 CO 0.04 -0.12 0.60 -1.00 -2.06 0.00 0.00 179.45 176.91 1v5x h PRO 141 N -0.18 0.50 0.15 3.15 0.13 -1.79 0.17 132.00 134.12 1v5x h PRO 141 Ca 0.14 -0.03 -0.25 0.00 -0.87 0.00 0.00 66.00 64.99 1v5x h PRO 141 Cb 0.51 -0.11 0.01 0.00 0.13 0.00 0.00 31.00 31.54 1v5x h PRO 141 CO -0.78 0.33 -1.17 1.25 -0.23 0.00 0.00 178.00 177.40 1v5x h LEU 142 N 0.51 0.49 -1.20 1.56 5.85 -1.61 -3.29 115.31 117.62 1v5x h LEU 142 Ca 0.66 -0.91 0.11 0.00 0.84 0.00 0.00 57.88 58.58 1v5x h LEU 142 Cb 1.36 -0.16 -0.07 0.00 0.37 0.00 0.00 40.66 42.16 1v5x h LEU 142 CO -0.49 1.54 0.58 -0.07 -0.34 0.00 0.00 178.44 179.66 1v5x h LEU 143 N -0.26 0.78 -1.53 2.25 3.38 -0.51 -0.46 115.31 118.96 1v5x h LEU 143 Ca -0.23 0.03 0.14 0.00 0.09 0.00 0.00 57.88 57.91 1v5x h LEU 143 Cb 1.78 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 42.35 1v5x h LEU 143 CO 0.14 0.44 0.50 0.00 0.09 0.00 0.00 178.44 179.61 1v5x h ALA 144 N 1.56 2.04 0.00 1.53 0.00 -0.76 -1.30 119.26 122.34 1v5x h ALA 144 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.34 1v5x h ALA 144 Cb 0.48 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1v5x h ALA 144 CO -0.19 -0.24 0.00 0.25 0.00 0.00 0.00 179.25 179.07 1v5x n THR 145 N -4.49 1.00 -0.28 0.00 -2.24 -0.18 -4.86 114.28 103.24 1v5x n THR 145 Ca 0.14 0.58 0.00 0.00 -2.27 0.00 0.00 64.05 62.50 1v5x n THR 145 Cb 0.49 -1.55 0.00 0.00 -2.10 0.00 0.00 70.33 67.17 1v5x n THR 145 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1v5x n GLY 146 N -0.90 1.59 3.85 3.38 0.00 -0.49 -5.04 105.19 107.58 1v5x n GLY 146 Ca -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1v5x n GLY 146 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1v5x s ARG 147 N -0.31 3.07 -0.15 1.61 1.81 -1.26 -4.97 118.95 118.75 1v5x s ARG 147 Ca 0.00 0.73 -0.29 0.00 -1.72 0.00 0.00 55.73 54.44 1v5x s ARG 147 Cb 0.00 -2.02 -0.03 0.00 -0.45 0.00 0.00 34.95 32.45 1v5x s ARG 147 CO 0.00 -0.95 1.44 1.03 -0.68 0.00 0.00 175.30 176.15 1v5x s ARG 148 N -5.18 4.12 -0.08 3.54 0.52 -1.26 -4.87 118.95 115.74 1v5x s ARG 148 Ca 0.57 1.79 0.03 0.00 -0.52 0.00 0.00 55.73 57.61 1v5x s ARG 148 Cb -0.12 -3.89 -0.02 0.00 0.52 0.00 0.00 34.95 31.45 1v5x s ARG 148 CO 0.54 -0.87 -0.18 0.08 0.02 0.00 0.00 175.30 174.88 1v5x s VAL 149 N 4.00 2.66 -0.20 3.52 1.01 -1.26 -1.47 120.40 128.66 1v5x s VAL 149 Ca 0.63 -0.84 -0.03 0.00 0.00 0.00 0.00 61.98 61.74 1v5x s VAL 149 Cb -0.25 -2.04 -0.01 0.00 0.00 0.00 0.00 36.38 34.08 1v5x s VAL 149 CO 0.22 0.56 -0.06 -0.63 0.00 0.00 0.00 175.10 175.20 1v5x s ILE 150 N -0.18 3.33 -0.12 2.22 1.01 -0.04 -1.05 121.20 126.38 1v5x s ILE 150 Ca -0.01 -0.52 -0.17 0.00 0.00 0.00 0.00 60.65 59.95 1v5x s ILE 150 Cb -0.14 -2.49 -0.04 0.00 0.01 0.00 0.00 42.46 39.80 1v5x s ILE 150 CO 0.03 0.45 0.43 -0.76 0.00 0.00 0.00 174.94 175.09 1v5x s LEU 151 N 1.24 4.28 0.00 2.97 1.43 -0.62 -0.96 118.68 127.02 1v5x s LEU 151 Ca 0.03 0.75 0.00 0.00 -1.03 0.00 0.00 54.13 53.88 1v5x s LEU 151 Cb -0.14 -2.61 0.00 0.00 0.03 0.00 0.00 46.19 43.47 1v5x s LEU 151 CO -0.02 0.05 0.00 0.00 0.23 0.00 0.00 176.35 176.61 1v5x n ALA 152 N 3.51 0.00 -2.22 4.21 0.00 -0.47 -0.29 120.51 125.26 1v5x n ALA 152 Ca -0.09 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.35 1v5x n ALA 152 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1v5x n ALA 152 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1v5x n GLY 153 N 2.57 -3.44 4.10 0.00 0.00 -1.26 -4.44 105.19 102.72 1v5x n GLY 153 Ca 0.00 0.22 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 1v5x n GLY 153 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1v5x n GLY 154 N 0.33 -0.34 3.81 -0.02 0.00 -1.15 -4.27 105.19 103.55 1v5x n GLY 154 Ca 0.01 0.15 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 1v5x n GLY 154 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1v5x s ILE 155 N -3.61 4.55 0.17 -0.61 1.01 -1.26 -4.68 121.20 116.77 1v5x s ILE 155 Ca 0.40 1.35 -0.13 0.00 0.00 0.00 0.00 60.65 62.28 1v5x s ILE 155 Cb -0.22 -3.91 0.01 0.00 0.01 0.00 0.00 42.46 38.35 1v5x s ILE 155 CO 0.91 0.29 0.38 0.00 0.00 0.00 0.00 174.94 176.52 1v5x s ALA 156 N -1.43 -0.44 0.42 9.38 0.00 -1.26 -3.58 121.76 124.86 1v5x s ALA 156 Ca 0.41 -0.56 0.31 0.00 0.00 0.00 0.00 51.96 52.11 1v5x s ALA 156 Cb -0.18 0.82 1.68 0.00 0.00 0.00 0.00 23.12 25.45 1v5x s ALA 156 CO 0.22 -0.70 1.93 -1.35 0.00 0.00 0.00 175.76 175.86 1v5x h PRO 157 N 2.41 0.00 0.00 0.00 0.11 -1.92 -1.72 132.00 130.89 1v5x h PRO 157 Ca -0.31 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 65.61 1v5x h PRO 157 Cb 1.24 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.32 1v5x h PRO 157 CO 0.44 0.00 -0.97 0.93 -0.21 0.00 0.00 178.00 178.20 1v5x h GLU 158 N 0.00 0.00 -0.31 1.05 3.07 -1.95 -3.35 114.58 113.10 1v5x h GLU 158 Ca 0.00 0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 58.76 1v5x h GLU 158 Cb 0.32 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 28.17 1v5x h GLU 158 CO 0.00 0.81 -0.02 0.27 -1.40 0.00 0.00 179.01 178.67 1v5x n ASN 159 N -3.27 3.14 -0.25 1.42 0.23 -0.65 -4.75 115.26 111.12 1v5x n ASN 159 Ca -0.01 -3.39 -0.01 0.00 -0.53 0.00 0.00 54.58 50.63 1v5x n ASN 159 Cb 0.90 -0.59 0.19 0.00 -2.08 0.00 0.00 39.78 38.20 1v5x n ASN 159 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 1v5x h LEU 160 N 1.31 0.94 -0.37 -4.53 3.38 -1.67 -3.26 115.31 111.09 1v5x h LEU 160 Ca 0.12 -0.06 0.08 0.00 0.09 0.00 0.00 57.88 58.11 1v5x h LEU 160 Cb 1.56 -0.24 -0.09 0.00 0.09 0.00 0.00 40.66 41.98 1v5x h LEU 160 CO 0.31 0.73 -0.24 -0.33 0.09 0.00 0.00 178.44 179.00 1v5x h GLU 161 N 1.08 -0.18 0.26 1.13 3.07 -1.90 0.12 114.58 118.16 1v5x h GLU 161 Ca 0.28 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.15 1v5x h GLU 161 Cb -0.03 0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 27.90 1v5x h GLU 161 CO -0.05 -0.12 -0.29 1.49 -1.40 0.00 0.00 179.01 178.64 1v5x h GLU 162 N -0.18 -0.57 -0.18 2.33 4.81 -1.96 -0.64 114.58 118.18 1v5x h GLU 162 Ca 0.18 0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.34 1v5x h GLU 162 Cb 0.47 0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 1v5x h GLU 162 CO -0.48 -0.38 -0.38 -0.39 -0.73 0.00 0.00 179.01 176.65 1v5x h VAL 163 N -0.59 1.30 -0.46 0.32 -1.51 -1.66 -2.47 116.25 111.16 1v5x h VAL 163 Ca -0.01 -1.49 -0.02 0.00 -1.23 0.00 0.00 66.70 63.95 1v5x h VAL 163 Cb 0.56 1.58 -0.02 0.00 -2.13 0.00 0.00 31.29 31.27 1v5x h VAL 163 CO -0.08 0.46 0.20 0.25 -1.23 0.00 0.00 177.57 177.18 1v5x h LEU 164 N 0.33 0.59 -1.65 4.19 5.85 -0.54 -1.03 115.31 123.05 1v5x h LEU 164 Ca 0.03 -0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.65 1v5x h LEU 164 Cb 0.82 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 1v5x h LEU 164 CO 0.07 0.52 -0.20 0.00 -0.34 0.00 0.00 178.44 178.49 1v5x h ALA 165 N 1.57 1.41 0.00 1.25 0.00 -0.64 -1.96 119.26 120.89 1v5x h ALA 165 Ca 0.16 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1v5x h ALA 165 Cb 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1v5x h ALA 165 CO -0.02 0.25 0.00 1.28 0.00 0.00 0.00 179.25 180.76 1v5x n LEU 166 N -3.92 0.05 -4.00 0.00 4.77 -0.40 -4.94 117.00 108.57 1v5x n LEU 166 Ca -0.02 0.51 -0.29 0.00 -0.03 0.00 0.00 56.01 56.18 1v5x n LEU 166 Cb 0.29 -0.50 -0.01 0.00 -2.33 0.00 0.00 43.42 40.87 1v5x n LEU 166 CO 0.34 -0.13 -0.11 0.54 -1.33 0.00 0.00 177.39 176.70 1v5x n ARG 167 N -1.55 -3.75 -1.43 3.23 1.74 -0.74 -4.97 116.66 109.20 1v5x n ARG 167 Ca 0.05 0.44 -0.30 0.00 -0.77 0.00 0.00 57.85 57.28 1v5x n ARG 167 Cb 0.27 -4.89 0.20 0.00 -1.02 0.00 0.00 32.46 27.02 1v5x n ARG 167 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1v5x s PRO 168 N -6.62 -0.15 0.15 5.56 0.04 -1.26 -4.96 135.00 127.76 1v5x s PRO 168 Ca 0.31 -0.09 -0.14 0.00 0.04 0.00 0.00 61.00 61.11 1v5x s PRO 168 Cb -0.16 -1.72 0.02 0.00 0.04 0.00 0.00 34.50 32.68 1v5x s PRO 168 CO 0.88 -3.00 1.70 -0.92 0.04 0.00 0.00 177.00 175.71 1v5x h TYR 169 N -2.07 0.71 -3.03 0.56 3.20 -1.45 -3.47 116.97 111.43 1v5x h TYR 169 Ca -0.46 -0.05 0.05 0.00 3.14 0.00 0.00 58.73 61.40 1v5x h TYR 169 Cb 1.28 -0.21 -0.07 0.00 1.54 0.00 0.00 36.73 39.27 1v5x h TYR 169 CO -1.29 0.60 0.21 0.00 -1.64 0.00 0.00 178.16 176.04 1v5x s ALA 170 N -5.57 -1.26 -0.00 1.82 0.00 -1.17 -3.96 121.76 111.61 1v5x s ALA 170 Ca -0.13 -0.16 0.06 0.00 0.00 0.00 0.00 51.96 51.73 1v5x s ALA 170 Cb 0.11 0.86 -0.03 0.00 0.00 0.00 0.00 23.12 24.07 1v5x s ALA 170 CO 0.77 -0.97 -0.17 -0.51 0.00 0.00 0.00 175.76 174.88 1v5x s LEU 171 N -2.89 2.63 -0.14 0.00 1.43 0.44 -1.58 118.68 118.58 1v5x s LEU 171 Ca 0.09 -0.32 0.02 0.00 -1.03 0.00 0.00 54.13 52.89 1v5x s LEU 171 Cb -0.05 -1.53 0.00 0.00 0.03 0.00 0.00 46.19 44.64 1v5x s LEU 171 CO 0.03 0.30 -0.19 -0.62 0.23 0.00 0.00 176.35 176.09 1v5x s ASP 172 N -1.06 3.38 0.09 2.29 2.15 0.60 -1.13 116.67 122.98 1v5x s ASP 172 Ca 0.13 -0.53 0.08 0.00 0.43 0.00 0.00 52.55 52.66 1v5x s ASP 172 Cb -0.11 -1.50 -0.03 0.00 -0.30 0.00 0.00 42.92 40.99 1v5x s ASP 172 CO 0.03 0.10 -0.21 -0.76 -0.17 0.00 0.00 175.17 174.16 1v5x s LEU 173 N 0.70 2.27 0.00 -1.34 1.02 -0.35 -4.41 118.68 116.58 1v5x s LEU 173 Ca -0.09 -0.66 0.00 0.00 0.02 0.00 0.00 54.13 53.41 1v5x s LEU 173 Cb -0.16 -0.91 0.00 0.00 0.02 0.00 0.00 46.19 45.14 1v5x s LEU 173 CO 0.01 0.08 0.00 0.00 0.02 0.00 0.00 176.35 176.46 1v5x n ALA 174 N 1.23 0.91 -0.35 4.21 0.00 -1.26 -0.51 120.51 124.73 1v5x n ALA 174 Ca -0.19 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.29 1v5x n ALA 174 Cb 0.53 0.00 0.20 0.00 0.00 0.00 0.00 19.45 20.18 1v5x n ALA 174 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1v5x h SER 175 N 0.00 0.91 0.00 0.00 0.02 -1.93 -1.60 113.55 110.95 1v5x h SER 175 Ca 0.00 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1v5x h SER 175 Cb 0.00 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.39 1v5x h SER 175 CO 0.00 0.53 0.14 0.61 -1.14 0.00 0.00 176.83 176.98 1v5x n GLY 176 N -1.35 -0.67 0.50 -3.77 0.00 -1.23 -1.56 105.19 97.11 1v5x n GLY 176 Ca 0.16 0.13 0.05 0.00 0.00 0.00 0.00 46.02 46.36 1v5x n GLY 176 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1v5x n VAL 177 N -2.00 0.90 -4.25 1.61 0.24 -0.62 -4.53 118.33 109.68 1v5x n VAL 177 Ca -0.01 -1.27 -0.26 0.00 -2.04 0.00 0.00 64.34 60.75 1v5x n VAL 177 Cb 0.17 0.23 -0.08 0.00 -1.47 0.00 0.00 33.84 32.68 1v5x n VAL 177 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1v5x s GLU 178 N -1.35 2.27 -0.13 7.34 2.02 -0.60 -1.27 118.70 126.98 1v5x s GLU 178 Ca 0.20 -1.20 0.16 0.00 0.02 0.00 0.00 54.97 54.15 1v5x s GLU 178 Cb 0.19 -2.26 -0.24 0.00 0.10 0.00 0.00 34.13 31.91 1v5x s GLU 178 CO -0.02 0.44 0.33 -1.91 0.02 0.00 0.00 175.26 174.12 1v5x n GLU 179 N -0.14 0.66 -3.59 1.61 2.13 0.06 -4.68 120.64 116.68 1v5x n GLU 179 Ca -0.10 0.12 -0.14 0.00 0.66 0.00 0.00 57.16 57.70 1v5x n GLU 179 Cb 0.56 -1.64 -0.05 0.00 0.27 0.00 0.00 31.44 30.57 1v5x n GLU 179 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1v5x s ALA 180 N -2.56 -1.26 -0.07 4.31 0.00 -1.00 -5.04 121.76 116.14 1v5x s ALA 180 Ca -0.08 0.53 -0.35 0.00 0.00 0.00 0.00 51.96 52.06 1v5x s ALA 180 Cb 0.07 0.38 -0.12 0.00 0.00 0.00 0.00 23.12 23.45 1v5x s ALA 180 CO 0.83 -0.50 1.82 -0.35 0.00 0.00 0.00 175.76 177.56 1v5x n PRO 181 N 0.41 2.06 -0.20 0.00 -0.04 -1.26 -0.18 135.00 135.79 1v5x n PRO 181 Ca -0.18 0.75 0.00 0.00 -0.04 0.00 0.00 63.50 64.03 1v5x n PRO 181 Cb 0.60 -2.57 0.00 0.00 -0.04 0.00 0.00 33.50 31.49 1v5x n PRO 181 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1v5x n GLY 182 N 4.23 1.51 3.01 0.55 0.00 -1.26 -4.81 105.19 108.41 1v5x n GLY 182 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 1v5x n GLY 182 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1v5x s VAL 183 N -2.81 1.96 0.53 1.61 1.01 0.74 -3.95 120.40 119.49 1v5x s VAL 183 Ca 0.00 -1.69 -0.17 0.00 0.00 0.00 0.00 61.98 60.12 1v5x s VAL 183 Cb 0.00 -2.22 -0.07 0.00 0.00 0.00 0.00 36.38 34.10 1v5x s VAL 183 CO 0.00 -0.22 1.01 -0.54 0.00 0.00 0.00 175.10 175.35 1v5x s LYS 184 N 1.16 3.74 -0.28 2.72 -0.14 -1.26 -0.76 119.74 124.90 1v5x s LYS 184 Ca -0.02 1.09 -0.09 0.00 -1.36 0.00 0.00 55.97 55.59 1v5x s LYS 184 Cb -0.19 -2.10 -0.02 0.00 -1.68 0.00 0.00 37.83 33.84 1v5x s LYS 184 CO -0.07 -0.46 0.13 0.45 -0.76 0.00 0.00 175.35 174.65 1v5x s SER 185 N -2.79 5.51 0.22 2.83 0.15 -0.39 -4.53 113.70 114.69 1v5x s SER 185 Ca 0.62 -0.32 -0.08 0.00 0.70 0.00 0.00 55.95 56.87 1v5x s SER 185 Cb -0.13 -2.00 0.33 0.00 -1.71 0.00 0.00 66.02 62.51 1v5x s SER 185 CO 0.31 -0.11 1.76 0.00 1.20 0.00 0.00 173.24 176.39 1v5x h ALA 186 N 8.32 0.91 -0.12 5.45 0.00 -1.96 0.64 119.26 132.50 1v5x h ALA 186 Ca -0.35 0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.65 1v5x h ALA 186 Cb 1.16 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 1v5x h ALA 186 CO 0.59 -0.13 0.02 1.49 0.00 0.00 0.00 179.25 181.22 1v5x h GLU 187 N 0.50 0.07 -0.65 0.00 4.22 -1.96 -0.73 114.58 116.03 1v5x h GLU 187 Ca 0.34 -0.00 -0.05 0.00 0.08 0.00 0.00 59.36 59.73 1v5x h GLU 187 Cb 0.41 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 1v5x h GLU 187 CO -0.30 0.04 0.22 0.87 -2.18 0.00 0.00 179.01 177.66 1v5x h LYS 188 N 0.07 1.00 -0.35 1.92 1.57 -1.68 -0.04 116.57 119.05 1v5x h LYS 188 Ca 0.06 -0.21 -0.00 0.00 -1.87 0.00 0.00 60.65 58.63 1v5x h LYS 188 Cb 0.05 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 1v5x h LYS 188 CO -0.08 0.87 0.22 -0.07 -0.57 0.00 0.00 179.45 179.81 1v5x h LEU 189 N 0.94 0.42 -0.64 2.94 3.38 -0.62 0.23 115.31 121.96 1v5x h LEU 189 Ca 0.21 -0.05 -0.09 0.00 0.09 0.00 0.00 57.88 58.04 1v5x h LEU 189 Cb 0.27 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1v5x h LEU 189 CO -0.01 0.35 0.04 0.03 0.09 0.00 0.00 178.44 178.94 1v5x h ARG 190 N 0.46 1.10 -0.06 1.13 3.08 -0.98 -2.61 114.38 116.51 1v5x h ARG 190 Ca 0.13 -0.33 0.02 0.00 0.07 0.00 0.00 59.98 59.86 1v5x h ARG 190 Cb -0.00 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 1v5x h ARG 190 CO -0.02 1.04 -0.04 0.00 -1.07 0.00 0.00 179.97 179.88 1v5x h ALA 191 N 1.02 0.01 -0.08 0.04 0.00 -0.64 -1.34 119.26 118.27 1v5x h ALA 191 Ca 0.19 0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.16 1v5x h ALA 191 Cb 0.52 0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.34 1v5x h ALA 191 CO 0.02 -0.52 -0.28 1.25 0.00 0.00 0.00 179.25 179.73 1v5x h LEU 192 N -0.04 -0.85 -1.25 0.00 5.85 -0.76 0.71 115.31 118.97 1v5x h LEU 192 Ca 0.04 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.88 1v5x h LEU 192 Cb 0.10 0.36 0.00 0.00 0.37 0.00 0.00 40.66 41.49 1v5x h LEU 192 CO -0.09 -0.33 0.00 -0.26 -0.34 0.00 0.00 178.44 177.42 1v5x h PHE 193 N -0.38 0.00 0.10 1.25 0.04 -1.35 -1.61 116.94 115.00 1v5x h PHE 193 Ca 0.09 0.00 -0.22 0.00 2.80 0.00 0.00 57.97 60.63 1v5x h PHE 193 Cb 0.50 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.68 1v5x h PHE 193 CO -0.35 0.00 -0.94 0.00 -0.60 0.00 0.00 178.31 176.42 1v5x h ALA 194 N 2.02 -0.02 -0.37 2.45 0.00 -0.59 -2.56 119.26 120.19 1v5x h ALA 194 Ca 0.00 -0.69 -0.03 0.00 0.00 0.00 0.00 54.91 54.19 1v5x h ALA 194 Cb 0.55 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1v5x h ALA 194 CO 0.00 0.49 0.10 -0.09 0.00 0.00 0.00 179.25 179.75 1v5x h ARG 195 N -0.04 0.54 0.19 0.00 9.65 -0.55 -0.99 114.38 123.17 1v5x h ARG 195 Ca -0.15 -0.08 -0.01 0.00 -1.10 0.00 0.00 59.98 58.64 1v5x h ARG 195 Cb 1.67 -0.10 0.00 0.00 -1.39 0.00 0.00 29.97 30.16 1v5x h ARG 195 CO 0.18 0.49 -0.09 -0.07 2.80 0.00 0.00 179.97 183.28 1v5x h LEU 196 N 0.54 -0.22 -1.48 3.80 3.38 -1.32 -2.46 115.31 117.54 1v5x h LEU 196 Ca 0.13 -0.31 0.10 0.00 0.09 0.00 0.00 57.88 57.89 1v5x h LEU 196 Cb 0.19 0.06 -0.05 0.00 0.09 0.00 0.00 40.66 40.95 1v5x h LEU 196 CO -0.01 0.25 0.47 0.00 0.09 0.00 0.00 178.44 179.25 1v5x h ALA 197 N -0.14 1.88 0.00 1.53 0.00 -1.33 0.16 119.26 121.36 1v5x h ALA 197 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1v5x h ALA 197 Cb 0.51 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1v5x h ALA 197 CO 0.04 -0.04 0.00 0.45 0.00 0.00 0.00 179.25 179.71 1v5x n SER 198 N -4.49 0.63 -0.56 0.00 2.88 -0.39 -2.81 113.62 108.88 1v5x n SER 198 Ca 0.12 0.61 0.08 0.00 -1.33 0.00 0.00 58.87 58.36 1v5x n SER 198 Cb 0.35 -0.76 0.20 0.00 -0.75 0.00 0.00 64.21 63.25 1v5x n SER 198 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1v5x n LEU 199 N -2.15 3.22 0.00 2.46 4.77 0.50 -5.07 117.00 120.74 1v5x n LEU 199 Ca 0.04 -2.92 0.05 0.00 -0.03 0.00 0.00 56.01 53.14 1v5x n LEU 199 Cb 0.30 -0.46 0.30 0.00 -2.33 0.00 0.00 43.42 41.23 1v5x n LEU 199 CO 0.23 0.68 0.52 0.54 -1.33 0.00 0.00 177.39 178.04