#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sb3 n THR 10 N 0.00 0.73 -2.00 2.61 -2.24 -1.26 -4.86 114.28 107.26 1sb3 n THR 10 Ca 0.00 -0.31 -0.41 0.00 -2.27 0.00 0.00 64.05 61.06 1sb3 n THR 10 Cb 0.00 -0.92 -0.02 0.00 -2.10 0.00 0.00 70.33 67.29 1sb3 n THR 10 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1sb3 s VAL 11 N -2.26 2.66 0.00 2.28 1.01 -1.26 -2.25 120.40 120.58 1sb3 s VAL 11 Ca -0.15 0.54 0.00 0.00 0.00 0.00 0.00 61.98 62.37 1sb3 s VAL 11 Cb 0.04 -3.35 0.00 0.00 0.00 0.00 0.00 36.38 33.08 1sb3 s VAL 11 CO 0.32 0.08 0.00 0.61 0.00 0.00 0.00 175.10 176.11 1sb3 n GLY 12 N 2.35 1.76 3.78 4.51 0.00 0.76 -5.03 105.19 113.32 1sb3 n GLY 12 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 1sb3 n GLY 12 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1sb3 s VAL 13 N -2.88 4.84 -0.26 1.61 1.01 -0.96 -4.65 120.40 119.12 1sb3 s VAL 13 Ca 0.00 1.26 -0.29 0.00 0.00 0.00 0.00 61.98 62.96 1sb3 s VAL 13 Cb 0.00 -3.93 -0.03 0.00 0.00 0.00 0.00 36.38 32.42 1sb3 s VAL 13 CO 0.00 0.46 1.81 -0.13 0.00 0.00 0.00 175.10 177.24 1sb3 s ARG 14 N -0.48 3.49 -0.16 2.72 0.52 -1.26 -4.38 118.95 119.40 1sb3 s ARG 14 Ca 0.31 1.65 0.00 0.00 -0.52 0.00 0.00 55.73 57.17 1sb3 s ARG 14 Cb -0.19 -4.17 0.03 0.00 0.52 0.00 0.00 34.95 31.14 1sb3 s ARG 14 CO 0.18 -1.67 -0.14 0.99 0.02 0.00 0.00 175.30 174.68 1sb3 s THR 15 N 6.44 1.63 0.42 0.02 2.01 -1.26 -4.95 115.64 119.95 1sb3 s THR 15 Ca 0.81 -0.73 -0.26 0.00 0.31 0.00 0.00 61.69 61.82 1sb3 s THR 15 Cb -0.26 -1.56 -0.10 0.00 0.01 0.00 0.00 72.50 70.60 1sb3 s THR 15 CO 0.33 0.41 1.35 -2.65 -0.69 0.00 0.00 174.62 173.37 1sb3 n PRO 16 N 4.74 2.12 -1.76 4.92 -0.02 -1.26 -4.76 135.00 138.98 1sb3 n PRO 16 Ca -0.17 0.75 -0.41 0.00 -2.02 0.00 0.00 63.50 61.65 1sb3 n PRO 16 Cb 0.49 -2.49 -0.00 0.00 -0.02 0.00 0.00 33.50 31.48 1sb3 n PRO 16 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1sb3 n LEU 17 N 0.13 4.49 0.12 2.45 4.77 -1.26 -4.86 117.00 122.85 1sb3 n LEU 17 Ca 0.06 1.22 0.09 0.00 -0.03 0.00 0.00 56.01 57.34 1sb3 n LEU 17 Cb 0.40 -1.59 0.45 0.00 -2.33 0.00 0.00 43.42 40.35 1sb3 n LEU 17 CO 0.60 0.02 0.76 1.33 -1.33 0.00 0.00 177.39 178.77 1sb3 n VAL 18 N 0.54 1.25 -0.40 4.08 0.24 -1.26 -1.14 118.33 121.64 1sb3 n VAL 18 Ca 0.02 0.65 0.06 0.00 -2.04 0.00 0.00 64.34 63.03 1sb3 n VAL 18 Cb 0.38 -1.64 0.16 0.00 -1.47 0.00 0.00 33.84 31.26 1sb3 n VAL 18 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1sb3 n ASP 19 N -2.07 3.01 -0.01 -1.34 5.75 -1.26 -4.72 116.55 115.91 1sb3 n ASP 19 Ca -0.01 -2.30 -0.02 0.00 -0.01 0.00 0.00 54.79 52.45 1sb3 n ASP 19 Cb 0.04 -0.29 0.25 0.00 -1.03 0.00 0.00 41.12 40.09 1sb3 n ASP 19 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1sb3 h GLY 20 N 1.61 0.59 0.47 6.12 0.00 -1.49 -3.07 103.07 107.30 1sb3 h GLY 20 Ca 0.00 -0.39 0.05 0.00 0.00 0.00 0.00 47.33 47.00 1sb3 h GLY 20 CO 0.05 0.36 -0.05 -2.08 0.00 0.00 0.00 176.54 174.83 1sb3 h VAL 21 N 0.51 0.74 0.00 4.60 2.07 -1.84 -1.64 116.25 120.68 1sb3 h VAL 21 Ca 0.10 -0.01 -0.03 0.00 0.82 0.00 0.00 66.70 67.58 1sb3 h VAL 21 Cb 0.44 0.71 -0.00 0.00 -1.52 0.00 0.00 31.29 30.92 1sb3 h VAL 21 CO 0.02 0.01 -0.14 -0.33 0.02 0.00 0.00 177.57 177.15 1sb3 h GLU 22 N 0.03 0.00 -0.23 1.57 3.07 -1.91 -2.89 114.58 114.22 1sb3 h GLU 22 Ca 0.14 0.00 -0.18 0.00 -0.50 0.00 0.00 59.36 58.81 1sb3 h GLU 22 Cb 0.20 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.11 1sb3 h GLU 22 CO -0.27 0.14 -0.57 0.87 -1.40 0.00 0.00 179.01 177.77 1sb3 h LYS 23 N 0.00 0.80 0.00 2.33 1.57 -1.32 -1.04 116.57 118.91 1sb3 h LYS 23 Ca -0.00 -0.55 0.00 0.00 -1.87 0.00 0.00 60.65 58.23 1sb3 h LYS 23 Cb 0.27 0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.67 1sb3 h LYS 23 CO 0.02 1.17 -0.00 1.33 -0.57 0.00 0.00 179.45 181.40 1sb3 n VAL 24 N -4.05 0.01 0.79 0.50 0.24 -0.94 -3.13 118.33 111.75 1sb3 n VAL 24 Ca -0.06 -0.01 0.08 0.00 -2.04 0.00 0.00 64.34 62.32 1sb3 n VAL 24 Cb 0.64 -0.50 -0.09 0.00 -1.47 0.00 0.00 33.84 32.43 1sb3 n VAL 24 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1sb3 n THR 25 N -1.52 0.00 -1.00 3.34 -2.24 -1.11 -4.97 114.28 106.79 1sb3 n THR 25 Ca 0.07 -0.12 -0.00 0.00 -2.27 0.00 0.00 64.05 61.73 1sb3 n THR 25 Cb 0.34 1.02 -0.00 0.00 -2.10 0.00 0.00 70.33 69.59 1sb3 n THR 25 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1sb3 n GLY 26 N 1.38 0.49 0.17 3.38 0.00 -1.06 -4.91 105.19 104.64 1sb3 n GLY 26 Ca 0.03 -0.03 0.06 0.00 0.00 0.00 0.00 46.02 46.09 1sb3 n GLY 26 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1sb3 h LYS 27 N 0.95 0.00 -6.53 1.61 1.57 -1.63 -3.45 116.57 109.09 1sb3 h LYS 27 Ca -0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 1sb3 h LYS 27 Cb 0.03 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.37 1sb3 h LYS 27 CO 0.00 0.28 0.98 0.00 -0.57 0.00 0.00 179.45 180.15 1sb3 s ALA 28 N -3.07 3.75 -0.32 3.86 0.00 -0.48 -4.95 121.76 120.56 1sb3 s ALA 28 Ca 0.05 1.34 -0.12 0.00 0.00 0.00 0.00 51.96 53.22 1sb3 s ALA 28 Cb 0.07 -3.69 -0.03 0.00 0.00 0.00 0.00 23.12 19.47 1sb3 s ALA 28 CO 0.72 -1.01 0.23 0.15 0.00 0.00 0.00 175.76 175.85 1sb3 s LYS 29 N 2.06 3.68 0.58 0.00 -0.14 -1.26 -4.99 119.74 119.66 1sb3 s LYS 29 Ca 0.74 -0.50 0.00 0.00 -1.36 0.00 0.00 55.97 54.86 1sb3 s LYS 29 Cb -0.43 -3.75 0.04 0.00 -1.68 0.00 0.00 37.83 32.01 1sb3 s LYS 29 CO 0.33 -0.35 0.81 0.71 -0.76 0.00 0.00 175.35 176.09 1sb3 s TYR 30 N 1.76 2.77 0.24 3.18 1.51 -1.26 -2.34 117.35 123.21 1sb3 s TYR 30 Ca 0.07 0.01 -0.12 0.00 -1.01 0.00 0.00 57.07 56.02 1sb3 s TYR 30 Cb -0.17 -2.81 0.32 0.00 -0.11 0.00 0.00 41.96 39.18 1sb3 s TYR 30 CO 0.11 -0.99 1.59 1.15 -1.11 0.00 0.00 175.55 176.30 1sb3 h THR 31 N -0.04 0.19 0.00 -0.71 2.02 -1.92 0.30 112.91 112.74 1sb3 h THR 31 Ca -0.42 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.76 1sb3 h THR 31 Cb 1.30 0.19 0.00 0.00 -1.74 0.00 0.00 68.15 67.89 1sb3 h THR 31 CO 0.52 0.00 0.00 0.00 0.37 0.00 0.00 175.52 176.41 1sb3 n ALA 32 N -3.31 1.99 0.72 6.16 0.00 -1.26 -2.70 120.51 122.11 1sb3 n ALA 32 Ca 0.11 -0.08 0.11 0.00 0.00 0.00 0.00 53.44 53.58 1sb3 n ALA 32 Cb 0.40 -1.32 0.10 0.00 0.00 0.00 0.00 19.45 18.64 1sb3 n ALA 32 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1sb3 n ASP 33 N -1.35 0.63 -4.68 0.00 8.00 0.10 -4.92 116.55 114.32 1sb3 n ASP 33 Ca 0.08 -0.21 -0.42 0.00 0.71 0.00 0.00 54.79 54.94 1sb3 n ASP 33 Cb 0.18 0.53 -0.03 0.00 -0.02 0.00 0.00 41.12 41.78 1sb3 n ASP 33 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1sb3 s ILE 34 N -3.12 3.61 0.28 0.53 1.01 -1.10 -4.90 121.20 117.51 1sb3 s ILE 34 Ca 0.07 0.96 -0.29 0.00 0.00 0.00 0.00 60.65 61.38 1sb3 s ILE 34 Cb 0.15 -3.62 -0.10 0.00 0.01 0.00 0.00 42.46 38.91 1sb3 s ILE 34 CO 0.76 -0.02 1.25 0.00 0.00 0.00 0.00 174.94 176.94 1sb3 s ALA 35 N 2.78 3.48 -0.49 9.38 0.00 -1.26 -4.97 121.76 130.69 1sb3 s ALA 35 Ca 0.66 1.12 0.07 0.00 0.00 0.00 0.00 51.96 53.82 1sb3 s ALA 35 Cb -0.32 -3.44 0.19 0.00 0.00 0.00 0.00 23.12 19.54 1sb3 s ALA 35 CO 0.27 -0.49 0.71 0.00 0.00 0.00 0.00 175.76 176.25 1sb3 s ALA 36 N -0.76 -2.20 0.44 0.00 0.00 -1.26 -5.04 121.76 112.94 1sb3 s ALA 36 Ca 0.50 -0.23 0.18 0.00 0.00 0.00 0.00 51.96 52.41 1sb3 s ALA 36 Cb -0.37 -2.73 1.12 0.00 0.00 0.00 0.00 23.12 21.15 1sb3 s ALA 36 CO 0.45 -2.24 1.92 -1.35 0.00 0.00 0.00 175.76 174.55 1sb3 h PRO 37 N 5.55 0.33 -0.01 0.00 0.11 -2.03 -1.56 132.00 134.39 1sb3 h PRO 37 Ca 0.06 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.15 1sb3 h PRO 37 Cb 1.13 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1sb3 h PRO 37 CO 0.03 0.22 0.00 -0.25 -0.21 0.00 0.00 178.00 177.79 1sb3 n ASP 38 N -4.46 0.45 -4.72 -2.05 10.43 -1.26 -4.95 116.55 109.99 1sb3 n ASP 38 Ca 0.15 -1.19 -0.42 0.00 2.57 0.00 0.00 54.79 55.90 1sb3 n ASP 38 Cb 0.58 -0.00 -0.03 0.00 1.84 0.00 0.00 41.12 43.51 1sb3 n ASP 38 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1sb3 s ALA 39 N -1.99 3.78 0.52 2.24 0.00 -0.59 -4.59 121.76 121.13 1sb3 s ALA 39 Ca 0.43 1.40 -0.06 0.00 0.00 0.00 0.00 51.96 53.74 1sb3 s ALA 39 Cb 0.21 -3.63 -0.02 0.00 0.00 0.00 0.00 23.12 19.68 1sb3 s ALA 39 CO 0.34 -0.80 0.83 -0.51 0.00 0.00 0.00 175.76 175.62 1sb3 s LEU 40 N 0.92 3.48 -0.21 0.00 1.43 0.94 -4.85 118.68 120.39 1sb3 s LEU 40 Ca 0.69 0.86 -0.16 0.00 -1.03 0.00 0.00 54.13 54.50 1sb3 s LEU 40 Cb -0.44 -3.78 -0.04 0.00 0.03 0.00 0.00 46.19 41.96 1sb3 s LEU 40 CO 0.33 -0.75 0.39 -0.69 0.23 0.00 0.00 176.35 175.86 1sb3 s VAL 41 N -2.84 5.20 -0.00 -1.59 1.01 0.69 -0.79 120.40 122.08 1sb3 s VAL 41 Ca 0.50 0.68 -0.02 0.00 0.00 0.00 0.00 61.98 63.14 1sb3 s VAL 41 Cb -0.10 -3.72 -0.04 0.00 0.00 0.00 0.00 36.38 32.51 1sb3 s VAL 41 CO 0.45 0.24 0.18 -0.83 0.00 0.00 0.00 175.10 175.14 1sb3 s GLY 42 N 1.12 2.18 -0.02 4.51 0.00 -0.36 -1.17 107.32 113.57 1sb3 s GLY 42 Ca 0.18 -0.77 -0.09 0.00 0.00 0.00 0.00 44.72 44.04 1sb3 s GLY 42 CO 0.08 -0.67 0.19 0.50 0.00 0.00 0.00 173.10 173.20 1sb3 s ARG 43 N -1.98 0.46 -0.11 2.90 1.81 -0.42 -4.38 118.95 117.22 1sb3 s ARG 43 Ca 0.28 -0.19 -0.02 0.00 -1.72 0.00 0.00 55.73 54.08 1sb3 s ARG 43 Cb -0.13 0.20 -0.03 0.00 -0.45 0.00 0.00 34.95 34.54 1sb3 s ARG 43 CO 0.19 -0.11 -0.05 0.42 -0.68 0.00 0.00 175.30 175.08 1sb3 s ILE 44 N -1.00 3.84 -0.31 1.52 1.01 -1.26 -0.82 121.20 124.18 1sb3 s ILE 44 Ca -0.11 -0.40 -0.21 0.00 0.00 0.00 0.00 60.65 59.92 1sb3 s ILE 44 Cb -0.06 -2.63 -0.00 0.00 0.01 0.00 0.00 42.46 39.78 1sb3 s ILE 44 CO 0.02 0.55 0.69 -0.22 0.00 0.00 0.00 174.94 175.98 1sb3 s LEU 45 N -0.25 4.14 0.01 2.97 2.96 0.18 -4.97 118.68 123.72 1sb3 s LEU 45 Ca 0.04 0.48 0.01 0.00 -0.22 0.00 0.00 54.13 54.44 1sb3 s LEU 45 Cb -0.13 -2.91 -0.04 0.00 0.50 0.00 0.00 46.19 43.62 1sb3 s LEU 45 CO 0.02 -0.54 0.05 -0.13 -1.32 0.00 0.00 176.35 174.43 1sb3 s ARG 46 N 2.75 2.90 0.16 1.98 0.52 -1.26 -0.49 118.95 125.52 1sb3 s ARG 46 Ca 0.28 -0.58 -0.32 0.00 -0.52 0.00 0.00 55.73 54.59 1sb3 s ARG 46 Cb -0.15 -2.75 -0.11 0.00 0.52 0.00 0.00 34.95 32.46 1sb3 s ARG 46 CO 0.12 0.62 1.75 0.45 0.02 0.00 0.00 175.30 178.27 1sb3 s SER 47 N -1.79 6.42 0.00 0.23 0.15 0.68 -4.77 113.70 114.63 1sb3 s SER 47 Ca 0.23 2.79 0.28 0.00 0.70 0.00 0.00 55.95 59.95 1sb3 s SER 47 Cb -0.12 -2.58 1.11 0.00 -1.71 0.00 0.00 66.02 62.72 1sb3 s SER 47 CO 0.14 -0.97 1.80 -0.81 1.20 0.00 0.00 173.24 174.60 1sb3 n PRO 48 N 4.73 0.46 -4.27 5.44 -0.04 -1.26 -0.72 135.00 139.34 1sb3 n PRO 48 Ca 0.16 -0.16 -0.31 0.00 -0.04 0.00 0.00 63.50 63.16 1sb3 n PRO 48 Cb 0.37 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.24 1sb3 n PRO 48 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1sb3 s HIS 49 N -2.65 2.91 0.23 0.54 3.76 -1.26 -4.90 115.29 113.93 1sb3 s HIS 49 Ca 0.23 -0.05 0.08 0.00 -0.15 0.00 0.00 55.06 55.18 1sb3 s HIS 49 Cb 0.19 -1.55 0.21 0.00 1.11 0.00 0.00 32.58 32.54 1sb3 s HIS 49 CO 0.52 0.43 1.53 0.00 -0.85 0.00 0.00 174.74 176.37 1sb3 h ALA 50 N 3.93 0.81 -2.25 -1.40 0.00 -1.88 -3.13 119.26 115.33 1sb3 h ALA 50 Ca -0.48 -0.63 -0.02 0.00 0.00 0.00 0.00 54.91 53.77 1sb3 h ALA 50 Cb 1.17 -0.10 -0.23 0.00 0.00 0.00 0.00 17.79 18.62 1sb3 h ALA 50 CO 0.56 0.86 -0.18 -1.58 0.00 0.00 0.00 179.25 178.91 1sb3 s HIS 51 N -3.44 -0.99 -0.17 0.00 5.65 -1.26 -0.50 115.29 114.58 1sb3 s HIS 51 Ca -0.01 1.88 -0.32 0.00 0.25 0.00 0.00 55.06 56.85 1sb3 s HIS 51 Cb 0.12 0.53 0.14 0.00 -1.18 0.00 0.00 32.58 32.19 1sb3 s HIS 51 CO 0.78 -0.52 1.14 0.00 -0.65 0.00 0.00 174.74 175.49 1sb3 s ALA 52 N 2.19 -2.01 0.10 1.58 0.00 -0.99 -0.67 121.76 121.97 1sb3 s ALA 52 Ca -0.07 1.54 -0.11 0.00 0.00 0.00 0.00 51.96 53.32 1sb3 s ALA 52 Cb -0.09 -0.32 -0.06 0.00 0.00 0.00 0.00 23.12 22.65 1sb3 s ALA 52 CO -0.17 -0.51 0.45 1.03 0.00 0.00 0.00 175.76 176.56 1sb3 s ARG 53 N -2.12 3.83 -0.30 0.00 0.52 -0.39 -0.61 118.95 119.87 1sb3 s ARG 53 Ca 0.07 0.27 -0.15 0.00 -0.52 0.00 0.00 55.73 55.39 1sb3 s ARG 53 Cb -0.01 -2.97 -0.02 0.00 0.52 0.00 0.00 34.95 32.47 1sb3 s ARG 53 CO -0.05 0.53 0.39 0.42 0.02 0.00 0.00 175.30 176.61 1sb3 s ILE 54 N -1.43 5.15 -0.13 1.52 1.01 0.14 -1.00 121.20 126.47 1sb3 s ILE 54 Ca 0.35 0.36 -0.10 0.00 0.00 0.00 0.00 60.65 61.26 1sb3 s ILE 54 Cb -0.14 -3.77 -0.26 0.00 0.01 0.00 0.00 42.46 38.30 1sb3 s ILE 54 CO 0.18 0.02 0.37 -0.07 0.00 0.00 0.00 174.94 175.45 1sb3 h LEU 55 N 8.72 0.37 -7.40 2.97 3.38 -0.25 -3.44 115.31 119.66 1sb3 h LEU 55 Ca -0.31 -0.88 -0.04 0.00 0.09 0.00 0.00 57.88 56.74 1sb3 h LEU 55 Cb 1.15 -0.12 -0.12 0.00 0.09 0.00 0.00 40.66 41.66 1sb3 h LEU 55 CO 0.68 1.79 0.01 0.00 0.09 0.00 0.00 178.44 181.01 1sb3 s ALA 56 N -2.53 -1.05 -0.14 1.53 0.00 -1.11 -4.97 121.76 113.49 1sb3 s ALA 56 Ca -0.23 0.00 -0.06 0.00 0.00 0.00 0.00 51.96 51.67 1sb3 s ALA 56 Cb 0.06 0.78 0.06 0.00 0.00 0.00 0.00 23.12 24.02 1sb3 s ALA 56 CO 0.75 -0.71 0.31 -1.50 0.00 0.00 0.00 175.76 174.61 1sb3 s ILE 57 N -3.81 -0.15 -0.18 0.00 2.07 -1.26 -0.74 121.20 117.13 1sb3 s ILE 57 Ca 0.04 0.16 0.01 0.00 -1.41 0.00 0.00 60.65 59.45 1sb3 s ILE 57 Cb 0.01 -0.48 0.03 0.00 0.13 0.00 0.00 42.46 42.15 1sb3 s ILE 57 CO -0.10 0.06 -0.12 -0.62 -1.91 0.00 0.00 174.94 172.26 1sb3 s ASP 58 N 1.60 3.15 0.00 4.50 2.15 0.12 -4.98 116.67 123.22 1sb3 s ASP 58 Ca -0.07 -0.74 0.16 0.00 0.43 0.00 0.00 52.55 52.33 1sb3 s ASP 58 Cb -0.10 -1.23 0.17 0.00 -0.30 0.00 0.00 42.92 41.46 1sb3 s ASP 58 CO -0.10 -0.11 1.06 0.35 -0.17 0.00 0.00 175.17 176.20 1sb3 n THR 59 N 4.71 0.13 -0.29 1.71 -2.24 -1.26 -1.26 114.28 115.78 1sb3 n THR 59 Ca -0.16 -0.57 0.04 0.00 -2.27 0.00 0.00 64.05 61.09 1sb3 n THR 59 Cb 0.48 1.23 0.24 0.00 -2.10 0.00 0.00 70.33 70.18 1sb3 n THR 59 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1sb3 h SER 60 N 3.16 0.90 0.13 3.42 4.64 -1.93 -0.31 113.55 123.54 1sb3 h SER 60 Ca 0.00 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.19 1sb3 h SER 60 Cb 0.70 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.59 1sb3 h SER 60 CO 0.00 0.58 -0.46 0.00 -0.87 0.00 0.00 176.83 176.08 1sb3 h ALA 61 N 1.51 0.91 -0.41 5.18 0.00 -1.84 -2.02 119.26 122.59 1sb3 h ALA 61 Ca 0.38 -0.46 -0.14 0.00 0.00 0.00 0.00 54.91 54.69 1sb3 h ALA 61 Cb 0.18 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1sb3 h ALA 61 CO -0.14 0.65 -0.28 0.00 0.00 0.00 0.00 179.25 179.48 1sb3 h ALA 62 N 1.18 0.59 0.00 0.00 0.00 -1.47 -2.84 119.26 116.72 1sb3 h ALA 62 Ca 0.02 -0.41 -0.03 0.00 0.00 0.00 0.00 54.91 54.49 1sb3 h ALA 62 Cb 0.94 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1sb3 h ALA 62 CO 0.08 0.61 -0.16 0.93 0.00 0.00 0.00 179.25 180.71 1sb3 h GLU 63 N 0.74 0.00 0.00 0.00 5.08 -0.95 -2.51 114.58 116.94 1sb3 h GLU 63 Ca 0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1sb3 h GLU 63 Cb 0.86 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.11 1sb3 h GLU 63 CO 0.08 0.16 -0.49 0.00 -1.00 0.00 0.00 179.01 177.75 1sb3 n ALA 64 N -2.25 3.12 -2.03 3.43 0.00 -0.77 -4.87 120.51 117.13 1sb3 n ALA 64 Ca -0.01 -0.27 -0.42 0.00 0.00 0.00 0.00 53.44 52.74 1sb3 n ALA 64 Cb 0.31 -1.19 -0.03 0.00 0.00 0.00 0.00 19.45 18.54 1sb3 n ALA 64 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1sb3 s LEU 65 N -3.57 4.37 0.17 0.00 2.96 -0.95 -4.92 118.68 116.74 1sb3 s LEU 65 Ca 0.09 2.49 -0.32 0.00 -0.22 0.00 0.00 54.13 56.17 1sb3 s LEU 65 Cb 0.16 -3.59 -0.11 0.00 0.50 0.00 0.00 46.19 43.15 1sb3 s LEU 65 CO 0.69 -0.73 1.67 -0.70 -1.32 0.00 0.00 176.35 175.96 1sb3 s GLU 66 N 1.00 4.17 0.00 1.98 2.12 -1.26 -1.82 118.70 124.88 1sb3 s GLU 66 Ca 0.67 2.49 0.00 0.00 0.36 0.00 0.00 54.97 58.48 1sb3 s GLU 66 Cb -0.40 -3.23 0.00 0.00 0.26 0.00 0.00 34.13 30.76 1sb3 s GLU 66 CO 0.32 -0.71 0.00 0.41 -0.54 0.00 0.00 175.26 174.74 1sb3 n GLY 67 N 3.93 0.21 3.62 -1.50 0.00 -1.26 -5.00 105.19 105.19 1sb3 n GLY 67 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1sb3 n GLY 67 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1sb3 s VAL 68 N -2.00 5.15 -0.16 1.61 1.01 -0.75 -1.06 120.40 124.19 1sb3 s VAL 68 Ca 0.00 0.68 0.12 0.00 0.00 0.00 0.00 61.98 62.78 1sb3 s VAL 68 Cb 0.00 -3.74 -0.23 0.00 0.00 0.00 0.00 36.38 32.41 1sb3 s VAL 68 CO 0.00 0.16 0.20 -0.38 0.00 0.00 0.00 175.10 175.07 1sb3 n ILE 69 N 4.98 1.49 -3.65 2.22 2.08 0.08 -4.91 119.36 121.66 1sb3 n ILE 69 Ca -0.07 -0.78 -0.15 0.00 0.56 0.00 0.00 62.75 62.30 1sb3 n ILE 69 Cb 0.50 -0.86 -0.07 0.00 -0.75 0.00 0.00 39.64 38.46 1sb3 n ILE 69 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1sb3 s ALA 70 N -2.53 -1.23 -0.01 -1.39 0.00 -1.01 -4.71 121.76 110.87 1sb3 s ALA 70 Ca -0.14 0.80 0.00 0.00 0.00 0.00 0.00 51.96 52.63 1sb3 s ALA 70 Cb 0.07 0.01 0.02 0.00 0.00 0.00 0.00 23.12 23.22 1sb3 s ALA 70 CO 0.79 -0.31 0.01 0.08 0.00 0.00 0.00 175.76 176.33 1sb3 s VAL 71 N -1.21 -0.01 0.08 0.00 1.01 -1.26 -0.95 120.40 118.05 1sb3 s VAL 71 Ca -0.12 0.12 0.04 0.00 0.00 0.00 0.00 61.98 62.01 1sb3 s VAL 71 Cb -0.03 -0.07 -0.03 0.00 0.00 0.00 0.00 36.38 36.25 1sb3 s VAL 71 CO 0.07 0.06 -0.10 0.00 0.00 0.00 0.00 175.10 175.12 1sb3 s THR 73 N -1.98 0.33 0.65 0.00 -4.23 -1.26 -1.19 115.64 107.95 1sb3 s THR 73 Ca 0.00 -2.00 0.38 0.00 -1.18 0.00 0.00 61.69 58.89 1sb3 s THR 73 Cb -0.06 -2.45 0.40 0.00 1.34 0.00 0.00 72.50 71.73 1sb3 s THR 73 CO 0.00 0.00 2.24 1.23 -0.54 0.00 0.00 174.62 177.55 1sb3 h GLY 74 N 2.05 0.00 1.69 3.99 0.00 -1.69 -1.46 103.07 107.66 1sb3 h GLY 74 Ca -0.32 0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.05 1sb3 h GLY 74 CO 0.49 0.00 0.12 0.00 0.00 0.00 0.00 176.54 177.15 1sb3 h ALA 75 N 1.83 1.74 -0.01 3.60 0.00 -1.88 -1.10 119.26 123.44 1sb3 h ALA 75 Ca 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1sb3 h ALA 75 Cb 0.20 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1sb3 h ALA 75 CO -0.00 -0.18 -0.14 0.39 0.00 0.00 0.00 179.25 179.32 1sb3 n GLU 76 N -3.89 1.44 -3.37 0.00 1.02 -0.55 -4.48 120.64 110.81 1sb3 n GLU 76 Ca -0.00 -0.96 -0.26 0.00 -0.02 0.00 0.00 57.16 55.92 1sb3 n GLU 76 Cb 0.23 -1.48 -0.08 0.00 -0.02 0.00 0.00 31.44 30.09 1sb3 n GLU 76 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1sb3 n THR 77 N 0.06 1.54 1.40 2.62 -2.24 -0.41 -4.93 114.28 112.31 1sb3 n THR 77 Ca 0.15 -4.89 0.13 0.00 -2.27 0.00 0.00 64.05 57.16 1sb3 n THR 77 Cb 0.40 -2.06 0.70 0.00 -2.10 0.00 0.00 70.33 67.27 1sb3 n THR 77 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1sb3 n PRO 78 N 1.03 0.59 -3.97 -0.78 -0.04 -1.26 -4.69 135.00 125.89 1sb3 n PRO 78 Ca 0.27 0.03 -0.35 0.00 -0.04 0.00 0.00 63.50 63.41 1sb3 n PRO 78 Cb 0.44 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.27 1sb3 n PRO 78 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1sb3 s VAL 79 N -2.28 3.93 0.83 0.52 1.01 -1.26 -5.11 120.40 118.04 1sb3 s VAL 79 Ca 0.31 -0.31 -0.12 0.00 0.00 0.00 0.00 61.98 61.86 1sb3 s VAL 79 Cb 0.17 -2.79 0.09 0.00 0.00 0.00 0.00 36.38 33.85 1sb3 s VAL 79 CO 0.34 0.41 1.17 -2.16 0.00 0.00 0.00 175.10 174.85 1sb3 s PRO 80 N 1.23 1.83 0.04 2.72 0.04 -1.26 -4.57 135.00 135.03 1sb3 s PRO 80 Ca 0.03 0.16 -0.04 0.00 0.04 0.00 0.00 61.00 61.20 1sb3 s PRO 80 Cb -0.15 -1.93 -0.02 0.00 0.04 0.00 0.00 34.50 32.45 1sb3 s PRO 80 CO 0.01 -1.70 0.05 -0.59 0.04 0.00 0.00 177.00 174.81 1sb3 s PHE 81 N -3.51 0.29 -0.12 0.56 -0.12 0.63 -4.86 117.98 110.85 1sb3 s PHE 81 Ca 0.62 -0.65 -0.30 0.00 -0.05 0.00 0.00 56.93 56.55 1sb3 s PHE 81 Cb -0.12 -0.21 0.10 0.00 -0.63 0.00 0.00 43.02 42.17 1sb3 s PHE 81 CO 0.50 -0.36 0.86 0.20 -0.05 0.00 0.00 175.22 176.38 1sb3 s GLY 82 N -2.28 -0.40 0.43 1.99 0.00 -1.26 -2.27 107.32 103.52 1sb3 s GLY 82 Ca -0.03 1.76 0.21 0.00 0.00 0.00 0.00 44.72 46.66 1sb3 s GLY 82 CO -0.06 1.04 1.86 -0.24 0.00 0.00 0.00 173.10 175.70 1sb3 h VAL 83 N 2.79 0.83 -3.42 1.40 3.04 -1.82 -3.41 116.25 115.65 1sb3 h VAL 83 Ca -0.22 -1.13 -0.61 0.00 -1.01 0.00 0.00 66.70 63.72 1sb3 h VAL 83 Cb 1.15 1.69 -0.15 0.00 -2.01 0.00 0.00 31.29 31.98 1sb3 h VAL 83 CO 0.33 0.28 -0.52 -0.76 -1.01 0.00 0.00 177.57 175.89 1sb3 s LEU 84 N -7.32 4.03 0.48 3.16 1.02 -1.26 -4.99 118.68 113.80 1sb3 s LEU 84 Ca -0.01 0.12 0.22 0.00 0.02 0.00 0.00 54.13 54.47 1sb3 s LEU 84 Cb 0.12 -2.06 1.25 0.00 0.02 0.00 0.00 46.19 45.53 1sb3 s LEU 84 CO 0.66 0.12 1.95 -0.65 0.02 0.00 0.00 176.35 178.44 1sb3 h PRO 85 N 7.11 0.18 -0.00 1.29 0.11 -1.86 -1.00 132.00 137.83 1sb3 h PRO 85 Ca -0.39 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1sb3 h PRO 85 Cb 1.16 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1sb3 h PRO 85 CO 0.69 0.12 -0.06 0.44 -0.21 0.00 0.00 178.00 178.99 1sb3 n ILE 86 N -4.41 0.00 -3.17 4.15 -5.35 -1.26 -4.34 119.36 104.98 1sb3 n ILE 86 Ca 0.13 -0.01 -0.22 0.00 -0.27 0.00 0.00 62.75 62.38 1sb3 n ILE 86 Cb 0.62 -0.35 -0.06 0.00 -1.74 0.00 0.00 39.64 38.11 1sb3 n ILE 86 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1sb3 n ALA 87 N -1.26 2.16 -3.40 -1.28 0.00 -0.38 -5.04 120.51 111.31 1sb3 n ALA 87 Ca 0.12 -3.29 -0.44 0.00 0.00 0.00 0.00 53.44 49.82 1sb3 n ALA 87 Cb 0.28 -0.86 -0.05 0.00 0.00 0.00 0.00 19.45 18.82 1sb3 n ALA 87 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1sb3 s GLU 88 N -1.29 3.01 -0.05 0.00 2.02 -1.25 -4.38 118.70 116.76 1sb3 s GLU 88 Ca 0.36 -1.98 0.08 0.00 0.02 0.00 0.00 54.97 53.44 1sb3 s GLU 88 Cb 0.20 -4.21 0.12 0.00 0.10 0.00 0.00 34.13 30.34 1sb3 s GLU 88 CO -0.11 -1.28 1.00 0.27 0.02 0.00 0.00 175.26 175.17 1sb3 n ASN 89 N 4.71 1.20 -4.52 -0.19 0.23 -1.20 -4.45 115.26 111.03 1sb3 n ASN 89 Ca -0.04 -2.33 -0.34 0.00 -0.53 0.00 0.00 54.58 51.35 1sb3 n ASN 89 Cb 0.42 -0.25 -0.12 0.00 -2.08 0.00 0.00 39.78 37.76 1sb3 n ASN 89 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 1sb3 s GLU 90 N -1.29 3.73 0.03 -3.83 2.12 -0.96 -4.91 118.70 113.60 1sb3 s GLU 90 Ca 0.13 -0.48 -0.09 0.00 0.36 0.00 0.00 54.97 54.90 1sb3 s GLU 90 Cb 0.11 -3.01 -0.05 0.00 0.26 0.00 0.00 34.13 31.44 1sb3 s GLU 90 CO 0.01 0.21 0.33 0.71 -0.54 0.00 0.00 175.26 175.98 1sb3 s TYR 91 N 0.47 3.59 0.23 5.30 2.02 -1.26 -0.27 117.35 127.43 1sb3 s TYR 91 Ca -0.02 0.69 -0.06 0.00 -0.37 0.00 0.00 57.07 57.32 1sb3 s TYR 91 Cb -0.14 -2.08 0.37 0.00 -0.40 0.00 0.00 41.96 39.71 1sb3 s TYR 91 CO 0.02 0.58 1.77 -1.35 -1.57 0.00 0.00 175.55 175.00 1sb3 h PRO 92 N 3.95 0.57 -5.02 -1.71 0.11 -1.84 -3.38 132.00 124.68 1sb3 h PRO 92 Ca -0.50 -0.03 -0.52 0.00 0.11 0.00 0.00 66.00 65.06 1sb3 h PRO 92 Cb 1.20 -0.13 -0.31 0.00 0.11 0.00 0.00 31.00 31.87 1sb3 h PRO 92 CO 0.66 0.38 -0.82 -0.51 -0.21 0.00 0.00 178.00 177.49 1sb3 s LEU 93 N -10.35 1.85 0.35 2.35 1.43 -1.26 -4.76 118.68 108.30 1sb3 s LEU 93 Ca -0.13 -0.30 -0.27 0.00 -1.03 0.00 0.00 54.13 52.41 1sb3 s LEU 93 Cb 0.19 -0.83 -0.12 0.00 0.03 0.00 0.00 46.19 45.46 1sb3 s LEU 93 CO 0.76 0.12 1.16 0.00 0.23 0.00 0.00 176.35 178.63 1sb3 n ALA 94 N 3.24 0.70 -3.67 4.21 0.00 0.28 -4.19 120.51 121.08 1sb3 n ALA 94 Ca -0.18 0.34 -0.26 0.00 0.00 0.00 0.00 53.44 53.34 1sb3 n ALA 94 Cb 0.53 -2.16 -0.17 0.00 0.00 0.00 0.00 19.45 17.65 1sb3 n ALA 94 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1sb3 s ARG 95 N -1.85 1.63 0.00 0.00 0.52 -1.26 -3.73 118.95 114.25 1sb3 s ARG 95 Ca 0.58 -0.35 0.00 0.00 -0.52 0.00 0.00 55.73 55.45 1sb3 s ARG 95 Cb -0.60 -1.49 0.00 0.00 0.52 0.00 0.00 34.95 33.39 1sb3 s ARG 95 CO 0.60 -0.10 0.00 -0.25 0.02 0.00 0.00 175.30 175.57 1sb3 n ASP 96 N 4.31 0.00 -3.71 0.23 8.00 -1.26 -4.86 116.55 119.26 1sb3 n ASP 96 Ca -0.19 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.21 1sb3 n ASP 96 Cb 0.51 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.55 1sb3 n ASP 96 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 1sb3 s LYS 97 N 0.00 0.94 0.09 -1.24 -2.85 -1.26 0.27 119.74 115.69 1sb3 s LYS 97 Ca 0.00 -0.64 0.04 0.00 -1.00 0.00 0.00 55.97 54.37 1sb3 s LYS 97 Cb 0.00 0.41 -0.04 0.00 -2.06 0.00 0.00 37.83 36.14 1sb3 s LYS 97 CO 0.00 -0.34 0.03 0.14 0.10 0.00 0.00 175.35 175.28 1sb3 s VAL 98 N -3.28 4.17 0.00 1.79 -7.23 0.22 -4.89 120.40 111.18 1sb3 s VAL 98 Ca -0.00 -0.94 0.00 0.00 -1.81 0.00 0.00 61.98 59.23 1sb3 s VAL 98 Cb 0.01 -3.00 0.00 0.00 0.56 0.00 0.00 36.38 33.95 1sb3 s VAL 98 CO -0.08 0.11 0.72 0.54 -0.31 0.00 0.00 175.10 176.08 1sb3 n ARG 99 N 0.50 1.33 -3.55 4.82 1.74 -1.26 -2.34 116.66 117.91 1sb3 n ARG 99 Ca -0.10 -0.97 -0.10 0.00 -0.77 0.00 0.00 57.85 55.91 1sb3 n ARG 99 Cb 0.52 -0.86 -0.04 0.00 -1.02 0.00 0.00 32.46 31.06 1sb3 n ARG 99 CO 0.00 0.00 0.00 1.52 -1.52 0.00 0.00 177.63 177.63 1sb3 s TYR 100 N -0.51 -0.37 -0.25 -1.55 1.13 0.34 -4.08 117.35 112.06 1sb3 s TYR 100 Ca 0.00 0.49 -0.29 0.00 -1.41 0.00 0.00 57.07 55.86 1sb3 s TYR 100 Cb 0.00 0.48 -0.02 0.00 -1.10 0.00 0.00 41.96 41.33 1sb3 s TYR 100 CO 0.00 -0.43 1.50 0.50 -2.51 0.00 0.00 175.55 174.62 1sb3 s ARG 101 N -1.88 3.82 0.00 -3.49 3.52 -1.18 -1.66 118.95 118.08 1sb3 s ARG 101 Ca 0.01 1.49 0.00 0.00 -0.13 0.00 0.00 55.73 57.10 1sb3 s ARG 101 Cb -0.01 -3.98 0.00 0.00 -1.56 0.00 0.00 34.95 29.40 1sb3 s ARG 101 CO -0.02 -1.25 0.00 0.41 -0.81 0.00 0.00 175.30 173.63 1sb3 n GLY 102 N 4.56 1.48 3.69 8.12 0.00 0.10 -4.81 105.19 118.33 1sb3 n GLY 102 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1sb3 n GLY 102 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1sb3 n ASP 103 N 0.00 4.07 -4.69 1.61 4.64 -0.66 -4.35 116.55 117.16 1sb3 n ASP 103 Ca 0.00 0.98 -0.44 0.00 -1.38 0.00 0.00 54.79 53.95 1sb3 n ASP 103 Cb 0.00 -1.54 -0.04 0.00 -1.04 0.00 0.00 41.12 38.50 1sb3 n ASP 103 CO 0.00 0.00 0.00 -2.65 -0.82 0.00 0.00 177.20 173.73 1sb3 n PRO 104 N 5.86 2.55 -0.04 -0.67 -0.02 -1.26 -0.23 135.00 141.18 1sb3 n PRO 104 Ca 0.18 0.92 -0.06 0.00 -2.02 0.00 0.00 63.50 62.53 1sb3 n PRO 104 Cb 0.38 -2.77 -0.05 0.00 -0.02 0.00 0.00 33.50 31.04 1sb3 n PRO 104 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1sb3 n VAL 105 N 4.20 0.53 -3.97 -1.45 0.31 0.36 -0.56 118.33 117.75 1sb3 n VAL 105 Ca 0.18 -0.23 -0.12 0.00 -0.01 0.00 0.00 64.34 64.15 1sb3 n VAL 105 Cb 0.33 -0.82 -0.02 0.00 -0.91 0.00 0.00 33.84 32.42 1sb3 n VAL 105 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1sb3 s ALA 106 N -2.18 0.12 0.07 3.52 0.00 -1.10 -3.97 121.76 118.21 1sb3 s ALA 106 Ca -0.10 -1.18 -0.24 0.00 0.00 0.00 0.00 51.96 50.43 1sb3 s ALA 106 Cb 0.03 0.96 0.06 0.00 0.00 0.00 0.00 23.12 24.17 1sb3 s ALA 106 CO 0.24 -0.87 0.57 0.00 0.00 0.00 0.00 175.76 175.70 1sb3 s ALA 107 N -2.80 -1.49 0.04 0.00 0.00 -0.33 -0.64 121.76 116.54 1sb3 s ALA 107 Ca 0.24 0.68 -0.00 0.00 0.00 0.00 0.00 51.96 52.88 1sb3 s ALA 107 Cb -0.02 0.49 -0.03 0.00 0.00 0.00 0.00 23.12 23.55 1sb3 s ALA 107 CO 0.16 -0.57 -0.04 0.54 0.00 0.00 0.00 175.76 175.86 1sb3 s VAL 108 N -2.69 0.24 -0.11 0.00 0.11 0.00 -0.95 120.40 117.00 1sb3 s VAL 108 Ca -0.04 -1.47 -0.00 0.00 -2.93 0.00 0.00 61.98 57.54 1sb3 s VAL 108 Cb -0.00 -1.05 0.02 0.00 -1.53 0.00 0.00 36.38 33.82 1sb3 s VAL 108 CO -0.04 -0.78 -0.09 0.00 -3.33 0.00 0.00 175.10 170.86 1sb3 s ALA 109 N -2.90 1.38 0.21 1.54 0.00 -0.13 -1.30 121.76 120.55 1sb3 s ALA 109 Ca -0.02 -0.57 0.01 0.00 0.00 0.00 0.00 51.96 51.39 1sb3 s ALA 109 Cb 0.01 -0.88 -0.05 0.00 0.00 0.00 0.00 23.12 22.19 1sb3 s ALA 109 CO -0.06 -0.35 0.05 0.00 0.00 0.00 0.00 175.76 175.40 1sb3 s ALA 110 N 1.55 1.50 0.47 0.00 0.00 -0.32 -0.74 121.76 124.22 1sb3 s ALA 110 Ca 0.03 -1.72 0.26 0.00 0.00 0.00 0.00 51.96 50.53 1sb3 s ALA 110 Cb -0.13 0.80 1.48 0.00 0.00 0.00 0.00 23.12 25.27 1sb3 s ALA 110 CO -0.07 -0.39 2.11 -0.84 0.00 0.00 0.00 175.76 176.57 1sb3 h ILE 111 N 2.56 0.65 -3.51 0.00 3.07 -1.40 0.20 117.51 119.07 1sb3 h ILE 111 Ca -0.37 -0.39 -0.09 0.00 1.55 0.00 0.00 64.86 65.56 1sb3 h ILE 111 Cb 1.22 1.24 -0.06 0.00 -0.27 0.00 0.00 36.82 38.96 1sb3 h ILE 111 CO 0.61 0.09 0.02 1.51 -1.05 0.00 0.00 178.15 179.33 1sb3 s ASP 112 N -6.31 0.19 0.12 2.16 1.47 -1.26 -4.57 116.67 108.47 1sb3 s ASP 112 Ca -0.04 -1.10 -0.18 0.00 1.18 0.00 0.00 52.55 52.41 1sb3 s ASP 112 Cb 0.14 0.70 -0.05 0.00 -0.34 0.00 0.00 42.92 43.37 1sb3 s ASP 112 CO 0.59 -1.36 1.69 -0.33 0.68 0.00 0.00 175.17 176.44 1sb3 h GLU 113 N 2.11 0.41 -0.53 2.11 3.07 -1.93 -1.61 114.58 118.20 1sb3 h GLU 113 Ca -0.27 -0.06 0.02 0.00 -0.50 0.00 0.00 59.36 58.55 1sb3 h GLU 113 Cb 1.25 -0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 29.05 1sb3 h GLU 113 CO 0.36 0.40 0.32 0.28 -1.40 0.00 0.00 179.01 178.97 1sb3 h VAL 114 N 0.33 1.06 -0.48 3.13 2.07 -1.99 -0.89 116.25 119.47 1sb3 h VAL 114 Ca 0.10 -0.22 -0.13 0.00 0.82 0.00 0.00 66.70 67.27 1sb3 h VAL 114 Cb 0.12 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 1sb3 h VAL 114 CO -0.01 0.12 -0.20 0.74 0.02 0.00 0.00 177.57 178.24 1sb3 h THR 115 N 0.64 1.27 -0.76 2.57 2.02 -1.94 -1.76 112.91 114.95 1sb3 h THR 115 Ca 0.21 -1.35 -0.05 0.00 0.77 0.00 0.00 66.41 65.99 1sb3 h THR 115 Cb 0.02 1.11 -0.03 0.00 -1.74 0.00 0.00 68.15 67.50 1sb3 h THR 115 CO -0.09 0.47 0.28 0.00 0.37 0.00 0.00 175.52 176.54 1sb3 h ALA 116 N 0.93 1.06 0.02 6.16 0.00 -0.89 0.36 119.26 126.91 1sb3 h ALA 116 Ca 0.11 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 1sb3 h ALA 116 Cb 0.76 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1sb3 h ALA 116 CO 0.06 0.65 -0.01 1.49 0.00 0.00 0.00 179.25 181.44 1sb3 h GLU 117 N 1.11 -0.03 -0.99 0.00 4.57 -1.00 -1.51 114.58 116.73 1sb3 h GLU 117 Ca 0.25 0.00 0.02 0.00 -1.18 0.00 0.00 59.36 58.45 1sb3 h GLU 117 Cb 0.24 0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 28.79 1sb3 h GLU 117 CO -0.02 0.04 0.65 0.87 -1.18 0.00 0.00 179.01 179.38 1sb3 h LYS 118 N -0.08 1.27 -0.52 1.92 1.79 -0.99 -2.51 116.57 117.45 1sb3 h LYS 118 Ca -0.00 -0.08 0.03 0.00 -2.18 0.00 0.00 60.65 58.42 1sb3 h LYS 118 Cb 0.08 -0.29 -0.04 0.00 -1.58 0.00 0.00 32.23 30.40 1sb3 h LYS 118 CO 0.00 0.84 0.29 0.00 -1.08 0.00 0.00 179.45 179.51 1sb3 h ALA 119 N 1.38 0.67 -0.80 3.86 0.00 -0.51 -2.52 119.26 121.34 1sb3 h ALA 119 Ca 0.38 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.30 1sb3 h ALA 119 Cb -0.10 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 1sb3 h ALA 119 CO -0.10 -0.03 0.52 -0.07 0.00 0.00 0.00 179.25 179.58 1sb3 h LEU 120 N 0.57 0.92 -1.75 0.00 3.38 -0.85 -2.07 115.31 115.52 1sb3 h LEU 120 Ca 0.22 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.13 1sb3 h LEU 120 Cb 0.08 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.59 1sb3 h LEU 120 CO -0.12 0.67 -0.17 0.00 0.09 0.00 0.00 178.44 178.91 1sb3 h ALA 121 N 1.29 1.38 -0.00 1.53 0.00 -1.24 -2.45 119.26 119.77 1sb3 h ALA 121 Ca 0.29 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1sb3 h ALA 121 Cb -0.12 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1sb3 h ALA 121 CO -0.06 0.21 -0.00 1.28 0.00 0.00 0.00 179.25 180.67 1sb3 n LEU 122 N -3.84 0.01 -4.68 0.00 4.77 -0.78 -4.78 117.00 107.69 1sb3 n LEU 122 Ca -0.02 0.40 -0.42 0.00 -0.03 0.00 0.00 56.01 55.95 1sb3 n LEU 122 Cb 0.26 -0.41 -0.04 0.00 -2.33 0.00 0.00 43.42 40.91 1sb3 n LEU 122 CO 0.33 0.00 0.64 -0.63 -1.33 0.00 0.00 177.39 176.40 1sb3 s ILE 123 N -2.82 4.87 -0.23 -0.08 1.01 -0.92 -4.22 121.20 118.80 1sb3 s ILE 123 Ca 0.20 1.75 -0.09 0.00 0.00 0.00 0.00 60.65 62.51 1sb3 s ILE 123 Cb 0.20 -4.19 -0.04 0.00 0.01 0.00 0.00 42.46 38.43 1sb3 s ILE 123 CO 0.50 0.06 0.13 -0.75 0.00 0.00 0.00 174.94 174.87 1sb3 s LYS 124 N 1.88 3.97 -0.10 2.79 2.20 -0.39 -4.96 119.74 125.13 1sb3 s LYS 124 Ca 0.42 -0.33 0.03 0.00 -0.36 0.00 0.00 55.97 55.73 1sb3 s LYS 124 Cb -0.17 -3.44 0.01 0.00 -1.51 0.00 0.00 37.83 32.71 1sb3 s LYS 124 CO 0.16 0.04 -0.19 0.08 -0.36 0.00 0.00 175.35 175.08 1sb3 s VAL 125 N 1.07 1.71 -0.23 4.02 1.01 -1.26 0.13 120.40 126.85 1sb3 s VAL 125 Ca 0.06 -0.80 -0.08 0.00 0.00 0.00 0.00 61.98 61.16 1sb3 s VAL 125 Cb -0.14 -1.51 -0.04 0.00 0.00 0.00 0.00 36.38 34.69 1sb3 s VAL 125 CO 0.04 0.48 0.09 -1.81 0.00 0.00 0.00 175.10 173.90 1sb3 s ASP 126 N 0.59 5.47 0.18 3.32 -0.00 0.08 -4.98 116.67 121.34 1sb3 s ASP 126 Ca -0.14 -0.06 0.10 0.00 -0.00 0.00 0.00 52.55 52.44 1sb3 s ASP 126 Cb -0.17 -1.97 -0.04 0.00 -0.00 0.00 0.00 42.92 40.74 1sb3 s ASP 126 CO 0.05 0.05 -0.13 -0.31 -0.00 0.00 0.00 175.17 174.82 1sb3 s TYR 127 N 1.14 2.54 -0.36 4.23 1.51 -1.26 0.50 117.35 125.66 1sb3 s TYR 127 Ca 0.05 -0.26 -0.01 0.00 -1.01 0.00 0.00 57.07 55.84 1sb3 s TYR 127 Cb -0.14 -1.25 0.09 0.00 -0.11 0.00 0.00 41.96 40.55 1sb3 s TYR 127 CO 0.04 0.51 0.11 -2.00 -1.11 0.00 0.00 175.55 173.09 1sb3 s GLU 128 N -2.78 1.99 0.29 -0.62 2.12 -0.17 -4.89 118.70 114.63 1sb3 s GLU 128 Ca 0.24 -1.68 -0.30 0.00 0.36 0.00 0.00 54.97 53.59 1sb3 s GLU 128 Cb -0.09 -3.37 -0.10 0.00 0.26 0.00 0.00 34.13 30.83 1sb3 s GLU 128 CO 0.14 -0.91 1.44 0.08 -0.54 0.00 0.00 175.26 175.46 1sb3 s VAL 129 N 1.11 2.52 0.33 3.70 1.01 -1.26 -1.26 120.40 126.54 1sb3 s VAL 129 Ca 0.05 0.46 0.10 0.00 0.00 0.00 0.00 61.98 62.58 1sb3 s VAL 129 Cb -0.21 -3.29 -0.05 0.00 0.00 0.00 0.00 36.38 32.82 1sb3 s VAL 129 CO -0.04 0.08 -0.05 -0.76 0.00 0.00 0.00 175.10 174.33 1sb3 s LEU 130 N -0.86 2.88 0.31 3.92 1.43 0.15 -4.91 118.68 121.61 1sb3 s LEU 130 Ca 0.57 -1.02 -0.29 0.00 -1.03 0.00 0.00 54.13 52.37 1sb3 s LEU 130 Cb -0.43 -1.26 -0.10 0.00 0.03 0.00 0.00 46.19 44.43 1sb3 s LEU 130 CO 0.48 -0.17 1.36 -2.84 0.23 0.00 0.00 176.35 175.41 1sb3 s PRO 131 N -3.66 4.31 0.02 1.29 0.02 -1.26 -4.54 135.00 131.18 1sb3 s PRO 131 Ca 0.33 2.27 0.03 0.00 0.02 0.00 0.00 61.00 63.66 1sb3 s PRO 131 Cb -0.01 -3.07 -0.04 0.00 0.02 0.00 0.00 34.50 31.40 1sb3 s PRO 131 CO 0.18 -0.29 -0.05 0.00 -0.33 0.00 0.00 177.00 176.51 1sb3 s ALA 132 N -0.80 3.09 -0.18 -1.55 0.00 -1.26 -4.84 121.76 116.21 1sb3 s ALA 132 Ca 0.52 -1.04 0.00 0.00 0.00 0.00 0.00 51.96 51.45 1sb3 s ALA 132 Cb -0.41 -1.15 0.01 0.00 0.00 0.00 0.00 23.12 21.57 1sb3 s ALA 132 CO 0.51 0.63 -0.17 0.71 0.00 0.00 0.00 175.76 177.44 1sb3 s TYR 133 N -1.06 2.80 -0.16 0.00 1.51 -1.26 -5.00 117.35 114.17 1sb3 s TYR 133 Ca 0.19 -1.49 0.19 0.00 -1.01 0.00 0.00 57.07 54.94 1sb3 s TYR 133 Cb -0.11 -1.94 -0.09 0.00 -0.11 0.00 0.00 41.96 39.71 1sb3 s TYR 133 CO 0.10 -0.74 0.91 0.52 -1.11 0.00 0.00 175.55 175.22 1sb3 h MET 134 N 7.90 0.00 -5.96 -0.62 2.86 -1.95 -0.43 114.93 116.72 1sb3 h MET 134 Ca -0.44 0.00 -0.54 0.00 -2.06 0.00 0.00 59.70 56.66 1sb3 h MET 134 Cb 1.15 0.00 -0.15 0.00 0.06 0.00 0.00 31.60 32.66 1sb3 h MET 134 CO 0.63 0.19 -0.76 0.95 1.06 0.00 0.00 176.91 178.98 1sb3 s THR 135 N -3.07 2.11 0.14 2.22 -4.23 -1.26 -4.89 115.64 106.66 1sb3 s THR 135 Ca -0.02 -2.25 -0.18 0.00 -1.18 0.00 0.00 61.69 58.07 1sb3 s THR 135 Cb 0.09 -2.13 -0.02 0.00 1.34 0.00 0.00 72.50 71.77 1sb3 s THR 135 CO 0.80 -0.44 1.79 -0.65 -0.54 0.00 0.00 174.62 175.58 1sb3 h PRO 136 N 2.57 0.36 -0.95 3.99 0.11 -1.91 -1.26 132.00 134.91 1sb3 h PRO 136 Ca -0.40 -0.02 0.10 0.00 0.11 0.00 0.00 66.00 65.79 1sb3 h PRO 136 Cb 1.23 -0.08 -0.08 0.00 0.11 0.00 0.00 31.00 32.19 1sb3 h PRO 136 CO 0.59 0.24 0.59 0.87 -0.21 0.00 0.00 178.00 180.07 1sb3 h LYS 137 N 0.37 0.95 -0.32 1.05 1.57 -1.98 0.88 116.57 119.09 1sb3 h LYS 137 Ca 0.12 -0.06 -0.14 0.00 -1.87 0.00 0.00 60.65 58.70 1sb3 h LYS 137 Cb -0.01 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.09 1sb3 h LYS 137 CO -0.05 0.63 -0.34 0.00 -0.57 0.00 0.00 179.45 179.11 1sb3 h ALA 138 N 1.50 0.48 0.00 3.86 0.00 -1.85 -2.86 119.26 120.38 1sb3 h ALA 138 Ca 0.46 -0.43 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1sb3 h ALA 138 Cb 0.39 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1sb3 h ALA 138 CO -0.24 0.54 -0.19 0.00 0.00 0.00 0.00 179.25 179.36 1sb3 h ALA 139 N 0.72 1.16 -0.00 0.00 0.00 -0.38 -3.00 119.26 117.76 1sb3 h ALA 139 Ca 0.05 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1sb3 h ALA 139 Cb 0.93 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1sb3 h ALA 139 CO 0.08 0.24 -0.48 -1.33 0.00 0.00 0.00 179.25 177.76 1sb3 n MET 140 N -3.54 0.30 -1.72 0.00 2.00 0.22 -4.56 117.12 109.82 1sb3 n MET 140 Ca -0.01 -0.19 -0.42 0.00 0.00 0.00 0.00 57.70 57.08 1sb3 n MET 140 Cb 0.34 -1.50 -0.00 0.00 0.00 0.00 0.00 33.22 32.06 1sb3 n MET 140 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 1sb3 n LYS 141 N -1.18 2.20 -1.68 0.03 4.81 -1.09 -4.87 118.16 116.38 1sb3 n LYS 141 Ca 0.07 0.77 -0.45 0.00 -0.87 0.00 0.00 58.31 57.84 1sb3 n LYS 141 Cb 0.34 -2.42 -0.04 0.00 0.02 0.00 0.00 35.03 32.94 1sb3 n LYS 141 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1sb3 n ALA 142 N 0.22 1.63 0.00 3.14 0.00 -1.26 -0.91 120.51 123.33 1sb3 n ALA 142 Ca 0.04 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1sb3 n ALA 142 Cb 0.38 -2.38 0.00 0.00 0.00 0.00 0.00 19.45 17.45 1sb3 n ALA 142 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sb3 n GLY 143 N 3.39 2.11 3.67 0.00 0.00 -1.26 -5.03 105.19 108.07 1sb3 n GLY 143 Ca 0.16 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.74 1sb3 n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sb3 n ALA 144 N -1.27 1.13 -2.06 4.61 0.00 -0.09 -4.89 120.51 117.94 1sb3 n ALA 144 Ca 0.00 0.40 -0.42 0.00 0.00 0.00 0.00 53.44 53.43 1sb3 n ALA 144 Cb 0.00 -2.27 -0.03 0.00 0.00 0.00 0.00 19.45 17.15 1sb3 n ALA 144 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1sb3 s ILE 145 N -0.19 3.11 -0.00 0.00 1.01 -1.26 -4.95 121.20 118.91 1sb3 s ILE 145 Ca 0.66 0.84 -0.30 0.00 0.00 0.00 0.00 60.65 61.86 1sb3 s ILE 145 Cb -0.64 -3.54 -0.05 0.00 0.01 0.00 0.00 42.46 38.24 1sb3 s ILE 145 CO 0.51 0.09 1.40 0.00 0.00 0.00 0.00 174.94 176.94 1sb3 s ALA 146 N 0.72 3.58 0.19 9.38 0.00 -1.26 -4.92 121.76 129.44 1sb3 s ALA 146 Ca 0.63 0.87 -0.10 0.00 0.00 0.00 0.00 51.96 53.36 1sb3 s ALA 146 Cb -0.38 -3.60 0.11 0.00 0.00 0.00 0.00 23.12 19.25 1sb3 s ALA 146 CO 0.34 -0.92 1.75 -0.07 0.00 0.00 0.00 175.76 176.86 1sb3 h LEU 147 N 8.38 0.95 -8.15 0.00 4.07 -1.92 -3.41 115.31 115.23 1sb3 h LEU 147 Ca -0.38 -0.17 -0.59 0.00 0.08 0.00 0.00 57.88 56.82 1sb3 h LEU 147 Cb 1.18 -0.25 -0.33 0.00 1.08 0.00 0.00 40.66 42.34 1sb3 h LEU 147 CO 0.90 0.86 -0.84 -1.00 -1.08 0.00 0.00 178.44 177.28 1sb3 s HIS 148 N -5.56 1.94 0.54 1.13 3.76 -1.26 -5.04 115.29 110.80 1sb3 s HIS 148 Ca -0.13 -0.76 0.21 0.00 -0.15 0.00 0.00 55.06 54.24 1sb3 s HIS 148 Cb 0.14 -1.35 1.40 0.00 1.11 0.00 0.00 32.58 33.88 1sb3 s HIS 148 CO 0.81 -0.33 2.12 -0.44 -0.85 0.00 0.00 174.74 176.05 1sb3 h ASP 149 N 6.83 0.00 0.06 1.40 3.32 -2.00 -2.12 116.42 123.92 1sb3 h ASP 149 Ca -0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.79 1sb3 h ASP 149 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.76 1sb3 h ASP 149 CO 0.47 0.00 0.00 -0.90 -1.72 0.00 0.00 179.24 177.09 1sb3 n ASP 150 N -4.35 0.00 -3.36 6.45 3.85 -1.26 -3.91 116.55 113.96 1sb3 n ASP 150 Ca 0.01 -0.79 -0.26 0.00 -0.71 0.00 0.00 54.79 53.04 1sb3 n ASP 150 Cb 0.24 -0.03 -0.09 0.00 -1.35 0.00 0.00 41.12 39.89 1sb3 n ASP 150 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 1sb3 n LYS 151 N -1.03 0.76 -0.33 0.11 4.76 -0.80 -5.01 118.16 116.62 1sb3 n LYS 151 Ca 0.20 -3.45 0.30 0.00 -2.87 0.00 0.00 58.31 52.48 1sb3 n LYS 151 Cb 0.11 -1.60 0.63 0.00 -1.84 0.00 0.00 35.03 32.33 1sb3 n LYS 151 CO 0.00 0.00 0.00 -1.35 -1.37 0.00 0.00 177.40 174.68 1sb3 h PRO 152 N 4.84 0.18 -0.63 1.97 0.11 -1.72 -0.47 132.00 136.28 1sb3 h PRO 152 Ca 0.17 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1sb3 h PRO 152 Cb 0.86 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.93 1sb3 h PRO 152 CO 0.48 0.12 0.00 0.27 -0.21 0.00 0.00 178.00 178.66 1sb3 n ASN 153 N -4.42 3.95 -1.68 -2.05 6.94 -1.26 -4.43 115.26 112.31 1sb3 n ASN 153 Ca 0.26 -2.33 -0.21 0.00 -0.02 0.00 0.00 54.58 52.29 1sb3 n ASN 153 Cb 1.10 -0.51 -0.08 0.00 -2.36 0.00 0.00 39.78 37.92 1sb3 n ASN 153 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1sb3 n ASN 154 N 0.95 -5.45 -4.35 0.53 3.02 -0.19 -4.54 115.26 105.24 1sb3 n ASN 154 Ca 0.21 0.46 -0.38 0.00 -0.03 0.00 0.00 54.58 54.84 1sb3 n ASN 154 Cb 0.73 -4.79 -0.12 0.00 -0.61 0.00 0.00 39.78 34.99 1sb3 n ASN 154 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1sb3 s ILE 155 N -2.77 4.12 0.09 2.41 1.01 -1.26 -1.01 121.20 123.78 1sb3 s ILE 155 Ca 0.00 -0.78 -0.16 0.00 0.00 0.00 0.00 60.65 59.71 1sb3 s ILE 155 Cb 0.00 -3.19 -0.10 0.00 0.01 0.00 0.00 42.46 39.18 1sb3 s ILE 155 CO 0.00 -0.03 1.41 0.25 0.00 0.00 0.00 174.94 176.57 1sb3 h LEU 156 N 8.28 0.64 -7.05 2.97 5.85 -1.13 -3.47 115.31 121.41 1sb3 h LEU 156 Ca -0.29 -0.46 -0.05 0.00 0.84 0.00 0.00 57.88 57.92 1sb3 h LEU 156 Cb 1.12 -0.18 -0.21 0.00 0.37 0.00 0.00 40.66 41.75 1sb3 h LEU 156 CO 0.62 0.97 0.07 -0.60 -0.34 0.00 0.00 178.44 179.16 1sb3 s ARG 157 N -4.40 0.79 0.08 1.25 6.06 -1.17 -5.02 118.95 116.54 1sb3 s ARG 157 Ca -0.13 0.89 0.10 0.00 -2.50 0.00 0.00 55.73 54.09 1sb3 s ARG 157 Cb 0.08 0.39 -0.03 0.00 0.06 0.00 0.00 34.95 35.44 1sb3 s ARG 157 CO 0.81 -0.10 -0.26 -1.21 -2.50 0.00 0.00 175.30 172.03 1sb3 s GLU 158 N 0.28 1.67 -0.05 5.12 2.02 -1.26 -0.87 118.70 125.60 1sb3 s GLU 158 Ca -0.01 -1.19 0.04 0.00 0.02 0.00 0.00 54.97 53.83 1sb3 s GLU 158 Cb -0.04 -1.96 -0.00 0.00 0.10 0.00 0.00 34.13 32.22 1sb3 s GLU 158 CO 0.01 0.49 -0.17 0.08 0.02 0.00 0.00 175.26 175.69 1sb3 s VAL 159 N -0.90 1.47 -0.24 2.63 1.01 -0.16 -4.97 120.40 119.24 1sb3 s VAL 159 Ca 0.13 -0.72 -0.04 0.00 0.00 0.00 0.00 61.98 61.35 1sb3 s VAL 159 Cb -0.10 -1.27 0.09 0.00 0.00 0.00 0.00 36.38 35.10 1sb3 s VAL 159 CO 0.04 0.42 0.14 -1.00 0.00 0.00 0.00 175.10 174.70 1sb3 s HIS 160 N 0.16 0.13 0.06 5.22 3.76 -1.25 -0.89 115.29 122.48 1sb3 s HIS 160 Ca -0.07 -0.49 0.00 0.00 -0.15 0.00 0.00 55.06 54.35 1sb3 s HIS 160 Cb -0.13 -0.72 -0.04 0.00 1.11 0.00 0.00 32.58 32.80 1sb3 s HIS 160 CO 0.03 -0.71 -0.05 0.00 -0.85 0.00 0.00 174.74 173.17 1sb3 s ALA 161 N 2.17 0.59 -0.05 -1.40 0.00 0.52 -5.01 121.76 118.58 1sb3 s ALA 161 Ca 0.06 -1.09 -0.02 0.00 0.00 0.00 0.00 51.96 50.91 1sb3 s ALA 161 Cb -0.16 0.19 0.03 0.00 0.00 0.00 0.00 23.12 23.18 1sb3 s ALA 161 CO -0.24 -0.25 0.10 -1.21 0.00 0.00 0.00 175.76 174.16 1sb3 s GLU 162 N -3.19 0.07 -0.25 0.00 2.02 -1.26 -0.52 118.70 115.57 1sb3 s GLU 162 Ca 0.02 0.25 0.02 0.00 0.02 0.00 0.00 54.97 55.28 1sb3 s GLU 162 Cb 0.02 -0.11 0.06 0.00 0.10 0.00 0.00 34.13 34.20 1sb3 s GLU 162 CO -0.06 -0.11 -0.11 -0.06 0.02 0.00 0.00 175.26 174.95 1sb3 s PHE 163 N 0.74 3.05 0.00 1.61 0.08 0.14 -4.98 117.98 118.62 1sb3 s PHE 163 Ca -0.06 -2.16 0.00 0.00 0.12 0.00 0.00 56.93 54.83 1sb3 s PHE 163 Cb -0.08 -1.86 0.00 0.00 -0.57 0.00 0.00 43.02 40.52 1sb3 s PHE 163 CO -0.03 -0.85 0.00 0.41 -0.10 0.00 0.00 175.22 174.65 1sb3 n GLY 164 N 4.49 -2.16 3.37 4.36 0.00 -1.26 -0.85 105.19 113.14 1sb3 n GLY 164 Ca -0.14 -1.61 -0.45 0.00 0.00 0.00 0.00 46.02 43.82 1sb3 n GLY 164 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1sb3 s ASP 165 N -3.52 6.33 0.06 1.61 -1.08 -1.26 -4.85 116.67 113.96 1sb3 s ASP 165 Ca 0.00 -1.76 -0.21 0.00 -0.52 0.00 0.00 52.55 50.06 1sb3 s ASP 165 Cb 0.00 -2.28 -0.12 0.00 -1.46 0.00 0.00 42.92 39.06 1sb3 s ASP 165 CO 0.00 -0.98 1.51 0.58 0.52 0.00 0.00 175.17 176.80 1sb3 h VAL 166 N 5.72 1.24 -0.60 1.11 2.07 -1.92 -0.49 116.25 123.38 1sb3 h VAL 166 Ca -0.18 -0.77 0.08 0.00 0.82 0.00 0.00 66.70 66.65 1sb3 h VAL 166 Cb 1.07 1.44 -0.07 0.00 -1.52 0.00 0.00 31.29 32.22 1sb3 h VAL 166 CO 1.04 0.23 0.26 0.00 0.02 0.00 0.00 177.57 179.11 1sb3 h ALA 167 N 0.79 0.79 -0.30 1.67 0.00 -2.00 0.11 119.26 120.33 1sb3 h ALA 167 Ca 0.05 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1sb3 h ALA 167 Cb 0.34 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1sb3 h ALA 167 CO 0.01 -0.14 0.07 0.00 0.00 0.00 0.00 179.25 179.19 1sb3 h ALA 168 N 1.39 0.40 -0.99 0.00 0.00 -1.95 -2.06 119.26 116.04 1sb3 h ALA 168 Ca 0.29 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 55.10 1sb3 h ALA 168 Cb 0.32 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 17.92 1sb3 h ALA 168 CO -0.26 0.06 0.64 0.00 0.00 0.00 0.00 179.25 179.69 1sb3 h ALA 169 N 0.90 1.41 -0.08 0.00 0.00 -0.25 -1.91 119.26 119.34 1sb3 h ALA 169 Ca 0.10 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.84 1sb3 h ALA 169 Cb 0.29 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1sb3 h ALA 169 CO 0.00 0.44 -0.57 0.74 0.00 0.00 0.00 179.25 179.86 1sb3 h PHE 170 N 1.17 0.32 0.00 0.00 0.04 -0.80 -2.72 116.94 114.95 1sb3 h PHE 170 Ca 0.43 -0.12 -0.03 0.00 2.80 0.00 0.00 57.97 61.05 1sb3 h PHE 170 Cb 0.16 -0.06 -0.00 0.00 2.20 0.00 0.00 35.95 38.25 1sb3 h PHE 170 CO -0.00 0.76 -0.16 0.00 -0.60 0.00 0.00 178.31 178.31 1sb3 h ALA 171 N 1.21 1.46 -0.02 2.45 0.00 -0.64 -1.82 119.26 121.91 1sb3 h ALA 171 Ca -0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1sb3 h ALA 171 Cb 1.06 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1sb3 h ALA 171 CO 0.09 0.20 0.00 -1.91 0.00 0.00 0.00 179.25 177.63 1sb3 n GLU 172 N -3.95 1.44 -3.12 0.00 2.13 -0.92 -4.90 120.64 111.32 1sb3 n GLU 172 Ca -0.02 -0.64 -0.33 0.00 0.66 0.00 0.00 57.16 56.83 1sb3 n GLU 172 Cb 0.25 -1.48 -0.06 0.00 0.27 0.00 0.00 31.44 30.42 1sb3 n GLU 172 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1sb3 s ALA 173 N -1.99 3.32 -0.14 4.31 0.00 -0.69 -4.91 121.76 121.67 1sb3 s ALA 173 Ca 0.41 0.07 0.18 0.00 0.00 0.00 0.00 51.96 52.62 1sb3 s ALA 173 Cb 0.21 -2.79 -0.14 0.00 0.00 0.00 0.00 23.12 20.40 1sb3 s ALA 173 CO 0.34 0.32 0.78 -0.25 0.00 0.00 0.00 175.76 176.95 1sb3 n ASP 174 N -0.27 0.75 -3.73 0.00 8.00 0.48 -4.89 116.55 116.89 1sb3 n ASP 174 Ca 0.03 0.32 -0.14 0.00 0.71 0.00 0.00 54.79 55.72 1sb3 n ASP 174 Cb 0.53 0.37 -0.14 0.00 -0.02 0.00 0.00 41.12 41.86 1sb3 n ASP 174 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1sb3 s LEU 175 N -5.62 0.51 -0.07 0.64 2.96 -0.46 -4.95 118.68 111.69 1sb3 s LEU 175 Ca -0.03 0.36 0.01 0.00 -0.22 0.00 0.00 54.13 54.25 1sb3 s LEU 175 Cb 0.09 0.44 0.02 0.00 0.50 0.00 0.00 46.19 47.24 1sb3 s LEU 175 CO 0.82 -0.17 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.95 1sb3 s ILE 176 N 1.39 0.95 0.03 6.68 1.01 -1.26 -0.37 121.20 129.63 1sb3 s ILE 176 Ca -0.07 -0.35 0.01 0.00 0.00 0.00 0.00 60.65 60.24 1sb3 s ILE 176 Cb -0.11 -0.90 -0.02 0.00 0.01 0.00 0.00 42.46 41.43 1sb3 s ILE 176 CO -0.07 0.32 -0.04 -0.13 0.00 0.00 0.00 174.94 175.02 1sb3 s ARG 177 N 0.90 0.40 -0.02 2.79 1.81 -1.06 -5.02 118.95 118.74 1sb3 s ARG 177 Ca -0.11 -0.71 -0.02 0.00 -1.72 0.00 0.00 55.73 53.17 1sb3 s ARG 177 Cb -0.15 0.01 0.00 0.00 -0.45 0.00 0.00 34.95 34.37 1sb3 s ARG 177 CO 0.01 -0.03 0.06 -1.83 -0.68 0.00 0.00 175.30 172.83 1sb3 s GLU 178 N -1.74 0.10 0.01 3.54 -1.05 -1.26 -1.64 118.70 116.66 1sb3 s GLU 178 Ca -0.12 0.02 -0.07 0.00 -0.15 0.00 0.00 54.97 54.65 1sb3 s GLU 178 Cb -0.08 0.04 -0.00 0.00 -0.44 0.00 0.00 34.13 33.65 1sb3 s GLU 178 CO -0.01 -0.01 0.13 0.21 0.95 0.00 0.00 175.26 176.52 1sb3 s LYS 179 N -0.11 0.50 -0.14 -4.83 2.20 0.11 -4.98 119.74 112.48 1sb3 s LYS 179 Ca -0.02 -0.46 -0.04 0.00 -0.36 0.00 0.00 55.97 55.10 1sb3 s LYS 179 Cb -0.01 0.20 -0.03 0.00 -1.51 0.00 0.00 37.83 36.48 1sb3 s LYS 179 CO 0.00 -0.12 -0.02 0.99 -0.36 0.00 0.00 175.35 175.84 1sb3 s THR 180 N -1.56 4.07 0.04 3.43 2.01 -1.26 -0.53 115.64 121.84 1sb3 s THR 180 Ca -0.14 -0.30 0.07 0.00 0.31 0.00 0.00 61.69 61.63 1sb3 s THR 180 Cb -0.07 -2.77 -0.02 0.00 0.01 0.00 0.00 72.50 69.65 1sb3 s THR 180 CO 0.01 0.51 -0.21 -0.31 -0.69 0.00 0.00 174.62 173.93 1sb3 s TYR 181 N 0.08 1.82 0.05 4.92 2.02 0.28 -4.89 117.35 121.64 1sb3 s TYR 181 Ca 0.01 -0.37 0.08 0.00 -0.37 0.00 0.00 57.07 56.41 1sb3 s TYR 181 Cb -0.13 -1.09 -0.03 0.00 -0.40 0.00 0.00 41.96 40.31 1sb3 s TYR 181 CO 0.02 0.08 -0.23 0.95 -1.57 0.00 0.00 175.55 174.81 1sb3 s THR 182 N -0.77 1.82 -0.10 -0.71 -4.23 0.19 0.48 115.64 112.32 1sb3 s THR 182 Ca 0.07 -1.27 0.01 0.00 -1.18 0.00 0.00 61.69 59.32 1sb3 s THR 182 Cb -0.09 -1.58 0.02 0.00 1.34 0.00 0.00 72.50 72.20 1sb3 s THR 182 CO 0.01 0.25 -0.11 -0.36 -0.54 0.00 0.00 174.62 173.87 1sb3 s PHE 183 N -0.81 1.64 0.76 3.99 0.40 0.60 -1.01 117.98 123.56 1sb3 s PHE 183 Ca 0.09 -0.78 -0.13 0.00 -0.60 0.00 0.00 56.93 55.51 1sb3 s PHE 183 Cb -0.09 -1.27 0.06 0.00 0.51 0.00 0.00 43.02 42.23 1sb3 s PHE 183 CO 0.02 -0.46 1.17 0.00 0.70 0.00 0.00 175.22 176.64 1sb3 s ALA 184 N 1.28 2.05 0.31 5.36 0.00 -0.55 -0.91 121.76 129.29 1sb3 s ALA 184 Ca -0.02 0.71 -0.28 0.00 0.00 0.00 0.00 51.96 52.37 1sb3 s ALA 184 Cb -0.14 -3.42 -0.09 0.00 0.00 0.00 0.00 23.12 19.46 1sb3 s ALA 184 CO -0.04 -1.97 1.08 -2.00 0.00 0.00 0.00 175.76 172.83 1sb3 s GLU 185 N -4.19 4.51 0.20 0.00 2.12 -1.26 -4.55 118.70 115.52 1sb3 s GLU 185 Ca 0.70 1.72 0.06 0.00 0.36 0.00 0.00 54.97 57.81 1sb3 s GLU 185 Cb -0.25 -3.01 -0.05 0.00 0.26 0.00 0.00 34.13 31.08 1sb3 s GLU 185 CO 0.48 0.12 -0.10 0.14 -0.54 0.00 0.00 175.26 175.36 1sb3 s VAL 186 N -1.30 1.48 0.18 3.70 -7.23 -0.68 -1.64 120.40 114.91 1sb3 s VAL 186 Ca 0.48 -2.14 0.10 0.00 -1.81 0.00 0.00 61.98 58.61 1sb3 s VAL 186 Cb -0.29 -2.09 -0.04 0.00 0.56 0.00 0.00 36.38 34.52 1sb3 s VAL 186 CO 0.37 -0.56 -0.16 0.21 -0.31 0.00 0.00 175.10 174.65 1sb3 s ASN 187 N -3.29 3.89 0.26 4.85 3.84 -1.26 -1.76 114.94 121.46 1sb3 s ASN 187 Ca 0.23 -0.70 0.01 0.00 0.21 0.00 0.00 52.86 52.61 1sb3 s ASN 187 Cb 0.02 -0.51 0.34 0.00 -0.55 0.00 0.00 41.25 40.55 1sb3 s ASN 187 CO 0.06 0.11 1.68 0.45 -2.79 0.00 0.00 177.10 176.61 1sb3 h HIS 188 N 3.07 0.57 -6.90 0.43 3.86 -1.91 -3.48 115.15 110.81 1sb3 h HIS 188 Ca -0.47 -0.14 -0.59 0.00 -1.16 0.00 0.00 60.37 58.02 1sb3 h HIS 188 Cb 1.20 -0.13 -0.09 0.00 1.06 0.00 0.00 27.41 29.45 1sb3 h HIS 188 CO 0.66 0.76 -0.98 0.28 0.86 0.00 0.00 177.93 179.51 1sb3 n VAL 189 N -4.08 -2.35 -2.03 2.45 0.31 -1.26 -4.90 118.33 106.47 1sb3 n VAL 189 Ca -0.01 -0.58 -0.39 0.00 -0.01 0.00 0.00 64.34 63.35 1sb3 n VAL 189 Cb 0.45 -2.00 0.00 0.00 -0.91 0.00 0.00 33.84 31.38 1sb3 n VAL 189 CO 0.00 0.00 0.00 -1.38 -1.32 0.00 0.00 176.83 174.13 1sb3 s HIS 190 N -3.90 2.75 0.19 3.52 -3.43 -1.26 -4.89 115.29 108.28 1sb3 s HIS 190 Ca 0.25 1.40 0.34 0.00 -0.80 0.00 0.00 55.06 56.26 1sb3 s HIS 190 Cb -0.13 -3.68 1.47 0.00 -1.43 0.00 0.00 32.58 28.81 1sb3 s HIS 190 CO 0.97 -2.17 2.03 0.52 -2.00 0.00 0.00 174.74 174.08 1sb3 h MET 191 N 2.51 0.00 -6.13 -0.38 2.86 -1.91 -3.42 114.93 108.46 1sb3 h MET 191 Ca -0.50 0.00 -0.56 0.00 -2.06 0.00 0.00 59.70 56.59 1sb3 h MET 191 Cb 1.25 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.86 1sb3 h MET 191 CO 0.62 0.03 0.11 -2.00 1.06 0.00 0.00 176.91 176.73 1sb3 s GLU 192 N -3.76 4.45 0.47 1.72 2.12 -1.23 -5.04 118.70 117.43 1sb3 s GLU 192 Ca 0.00 0.95 -0.22 0.00 0.36 0.00 0.00 54.97 56.06 1sb3 s GLU 192 Cb 0.10 -3.42 -0.08 0.00 0.26 0.00 0.00 34.13 30.99 1sb3 s GLU 192 CO 0.54 0.14 1.09 -0.51 -0.54 0.00 0.00 175.26 175.98 1sb3 s LEU 193 N 0.49 3.95 0.52 2.70 1.43 -1.26 -4.96 118.68 121.55 1sb3 s LEU 193 Ca 0.38 2.09 -0.22 0.00 -1.03 0.00 0.00 54.13 55.35 1sb3 s LEU 193 Cb -0.19 -4.39 -0.05 0.00 0.03 0.00 0.00 46.19 41.59 1sb3 s LEU 193 CO 0.20 -0.82 1.33 0.20 0.23 0.00 0.00 176.35 177.49 1sb3 s ASN 194 N -1.68 5.46 -0.15 2.29 0.01 -1.26 -4.86 114.94 114.73 1sb3 s ASN 194 Ca 0.65 2.70 -0.30 0.00 -0.71 0.00 0.00 52.86 55.20 1sb3 s ASN 194 Cb -0.22 -2.63 0.12 0.00 0.41 0.00 0.00 41.25 38.93 1sb3 s ASN 194 CO 0.27 -1.44 0.96 0.00 -1.51 0.00 0.00 177.10 175.37 1sb3 s ALA 195 N -1.33 -1.91 -0.03 0.60 0.00 -1.26 -1.16 121.76 116.66 1sb3 s ALA 195 Ca 0.69 1.57 -0.02 0.00 0.00 0.00 0.00 51.96 54.21 1sb3 s ALA 195 Cb -0.39 -0.67 0.02 0.00 0.00 0.00 0.00 23.12 22.08 1sb3 s ALA 195 CO 0.46 -0.31 0.08 0.99 0.00 0.00 0.00 175.76 176.98 1sb3 s THR 196 N -1.02 -0.03 -0.26 0.00 2.01 -0.55 -1.91 115.64 113.89 1sb3 s THR 196 Ca -0.03 0.10 -0.04 0.00 0.31 0.00 0.00 61.69 62.03 1sb3 s THR 196 Cb -0.01 -0.13 0.01 0.00 0.01 0.00 0.00 72.50 72.38 1sb3 s THR 196 CO 0.02 0.04 -0.00 -0.22 -0.69 0.00 0.00 174.62 173.77 1sb3 s LEU 197 N 0.57 3.40 -0.19 4.42 2.96 0.77 -0.83 118.68 129.78 1sb3 s LEU 197 Ca -0.04 -0.73 -0.00 0.00 -0.22 0.00 0.00 54.13 53.14 1sb3 s LEU 197 Cb -0.06 -1.76 0.01 0.00 0.50 0.00 0.00 46.19 44.88 1sb3 s LEU 197 CO -0.02 -0.13 -0.15 0.00 -1.32 0.00 0.00 176.35 174.72 1sb3 s ALA 198 N 1.42 2.47 -0.33 5.97 0.00 0.14 -1.43 121.76 130.00 1sb3 s ALA 198 Ca 0.02 -1.18 -0.03 0.00 0.00 0.00 0.00 51.96 50.77 1sb3 s ALA 198 Cb -0.16 -1.31 0.06 0.00 0.00 0.00 0.00 23.12 21.71 1sb3 s ALA 198 CO -0.02 -0.33 0.07 -2.00 0.00 0.00 0.00 175.76 173.49 1sb3 s GLU 199 N 1.27 2.33 -0.21 0.00 2.12 0.06 -0.37 118.70 123.91 1sb3 s GLU 199 Ca 0.04 -1.40 -0.10 0.00 0.36 0.00 0.00 54.97 53.86 1sb3 s GLU 199 Cb -0.14 -3.33 -0.05 0.00 0.26 0.00 0.00 34.13 30.88 1sb3 s GLU 199 CO -0.09 -0.75 0.13 -0.47 -0.54 0.00 0.00 175.26 173.55 1sb3 s TYR 200 N 1.24 3.37 -0.50 5.30 5.04 -0.23 -1.08 117.35 130.49 1sb3 s TYR 200 Ca -0.01 0.28 -0.14 0.00 -2.44 0.00 0.00 57.07 54.75 1sb3 s TYR 200 Cb -0.20 -2.19 0.10 0.00 0.35 0.00 0.00 41.96 40.02 1sb3 s TYR 200 CO -0.01 0.21 0.42 0.34 -1.34 0.00 0.00 175.55 175.16 1sb3 s ASP 201 N 0.58 6.06 0.50 4.32 -1.08 0.40 -3.82 116.67 123.64 1sb3 s ASP 201 Ca 0.08 -1.61 0.31 0.00 -0.52 0.00 0.00 52.55 50.81 1sb3 s ASP 201 Cb -0.12 -2.16 1.20 0.00 -1.46 0.00 0.00 42.92 40.39 1sb3 s ASP 201 CO 0.00 -0.73 1.91 1.55 0.52 0.00 0.00 175.17 178.42 1sb3 h PRO 202 N 8.74 0.00 -0.42 4.34 0.13 -1.85 0.42 132.00 143.37 1sb3 h PRO 202 Ca -0.28 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.75 1sb3 h PRO 202 Cb 1.10 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 1sb3 h PRO 202 CO 0.93 0.00 -0.12 0.28 -0.23 0.00 0.00 178.00 178.86 1sb3 h VAL 203 N 0.00 1.28 -0.00 1.56 2.07 -1.95 -3.26 116.25 115.94 1sb3 h VAL 203 Ca 0.00 -1.23 0.00 0.00 0.82 0.00 0.00 66.70 66.29 1sb3 h VAL 203 Cb 0.55 1.20 0.00 0.00 -1.52 0.00 0.00 31.29 31.52 1sb3 h VAL 203 CO 0.00 0.42 -0.76 0.54 0.02 0.00 0.00 177.57 177.78 1sb3 n ARG 204 N -4.29 1.61 -3.30 1.57 1.74 -1.14 -5.02 116.66 107.83 1sb3 n ARG 204 Ca -0.01 -0.01 -0.16 0.00 -0.77 0.00 0.00 57.85 56.89 1sb3 n ARG 204 Cb 0.38 -1.27 0.06 0.00 -1.02 0.00 0.00 32.46 30.61 1sb3 n ARG 204 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1sb3 n ASP 205 N -1.36 -6.55 -4.15 0.55 2.03 0.15 -5.04 116.55 102.17 1sb3 n ASP 205 Ca 0.03 -0.70 -0.19 0.00 0.52 0.00 0.00 54.79 54.45 1sb3 n ASP 205 Cb 0.26 -4.93 -0.13 0.00 -0.72 0.00 0.00 41.12 35.60 1sb3 n ASP 205 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 1sb3 s MET 206 N -4.51 0.88 -0.05 -0.67 -1.94 -1.01 -4.88 119.30 107.11 1sb3 s MET 206 Ca 0.42 -0.83 0.04 0.00 -1.71 0.00 0.00 55.69 53.60 1sb3 s MET 206 Cb -0.07 -0.88 0.00 0.00 2.01 0.00 0.00 34.83 35.89 1sb3 s MET 206 CO 0.76 0.21 -0.15 -1.17 -0.01 0.00 0.00 175.02 174.66 1sb3 s LEU 207 N -1.38 1.84 -0.13 -0.03 2.96 0.79 -0.45 118.68 122.28 1sb3 s LEU 207 Ca -0.00 -0.33 0.02 0.00 -0.22 0.00 0.00 54.13 53.60 1sb3 s LEU 207 Cb -0.09 -0.91 0.01 0.00 0.50 0.00 0.00 46.19 45.71 1sb3 s LEU 207 CO 0.02 0.11 -0.18 -0.89 -1.32 0.00 0.00 176.35 174.09 1sb3 s THR 208 N 0.22 1.73 0.00 3.68 2.01 -0.24 -0.74 115.64 122.30 1sb3 s THR 208 Ca -0.07 -0.77 0.07 0.00 0.31 0.00 0.00 61.69 61.23 1sb3 s THR 208 Cb -0.12 -1.56 -0.03 0.00 0.01 0.00 0.00 72.50 70.80 1sb3 s THR 208 CO 0.03 0.49 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.46 1sb3 s LEU 209 N 1.00 2.32 -0.15 4.42 1.43 0.06 -0.76 118.68 127.00 1sb3 s LEU 209 Ca -0.05 -0.43 0.01 0.00 -1.03 0.00 0.00 54.13 52.63 1sb3 s LEU 209 Cb -0.15 -1.41 0.02 0.00 0.03 0.00 0.00 46.19 44.68 1sb3 s LEU 209 CO -0.03 0.30 -0.17 0.20 0.23 0.00 0.00 176.35 176.88 1sb3 s ASN 210 N -0.94 2.81 0.08 2.29 0.01 -0.52 -0.20 114.94 118.48 1sb3 s ASN 210 Ca 0.12 -0.53 -0.09 0.00 -0.71 0.00 0.00 52.86 51.65 1sb3 s ASN 210 Cb -0.10 -1.27 -0.00 0.00 0.41 0.00 0.00 41.25 40.28 1sb3 s ASN 210 CO 0.01 -0.01 0.19 0.28 -1.51 0.00 0.00 177.10 176.07 1sb3 s THR 211 N 1.23 0.14 -1.31 1.60 -1.32 -1.11 -0.16 115.64 114.70 1sb3 s THR 211 Ca 0.01 -1.14 -0.16 0.00 -1.21 0.00 0.00 61.69 59.19 1sb3 s THR 211 Cb -0.14 -1.29 0.09 0.00 -1.51 0.00 0.00 72.50 69.65 1sb3 s THR 211 CO -0.08 -0.63 1.78 0.35 -2.21 0.00 0.00 174.62 173.83 1sb3 n THR 212 N 0.02 3.94 -4.17 5.08 -2.24 -0.80 -4.51 114.28 111.60 1sb3 n THR 212 Ca -0.15 -4.05 -0.16 0.00 -2.27 0.00 0.00 64.05 57.42 1sb3 n THR 212 Cb 0.62 -2.41 -0.11 0.00 -2.10 0.00 0.00 70.33 66.33 1sb3 n THR 212 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1sb3 s THR 213 N 3.44 0.98 -1.31 4.28 -1.32 -1.26 -4.87 115.64 115.57 1sb3 s THR 213 Ca 0.50 -1.47 0.22 0.00 -1.21 0.00 0.00 61.69 59.73 1sb3 s THR 213 Cb 0.05 -1.19 -0.10 0.00 -1.51 0.00 0.00 72.50 69.74 1sb3 s THR 213 CO 0.04 -0.42 1.07 0.00 -2.21 0.00 0.00 174.62 173.10 1sb3 n GLN 214 N 0.89 0.36 -3.24 7.08 6.02 0.18 -4.65 117.38 124.02 1sb3 n GLN 214 Ca -0.18 -0.28 -0.25 0.00 -0.01 0.00 0.00 57.00 56.28 1sb3 n GLN 214 Cb 0.56 -1.49 -0.07 0.00 1.02 0.00 0.00 30.24 30.26 1sb3 n GLN 214 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 1sb3 n VAL 215 N -1.08 0.77 0.07 5.09 0.24 -1.18 -1.72 118.33 120.53 1sb3 n VAL 215 Ca 0.06 -4.65 0.17 0.00 -2.04 0.00 0.00 64.34 57.89 1sb3 n VAL 215 Cb 0.37 -1.74 0.69 0.00 -1.47 0.00 0.00 33.84 31.68 1sb3 n VAL 215 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 1sb3 h PRO 216 N 3.83 0.00 -0.09 7.34 0.13 -1.91 -1.31 132.00 139.99 1sb3 h PRO 216 Ca 0.12 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.25 1sb3 h PRO 216 Cb 0.78 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.91 1sb3 h PRO 216 CO 0.63 0.00 0.03 -0.92 -0.23 0.00 0.00 178.00 177.51 1sb3 h TYR 217 N 0.00 0.15 -0.72 1.56 -0.00 -1.89 -0.38 116.97 115.68 1sb3 h TYR 217 Ca 0.19 -0.02 -0.00 0.00 -0.00 0.00 0.00 58.73 58.90 1sb3 h TYR 217 Cb 0.76 -0.04 -0.03 0.00 -0.00 0.00 0.00 36.73 37.42 1sb3 h TYR 217 CO 0.00 0.30 0.44 1.88 -0.00 0.00 0.00 178.16 180.78 1sb3 h TYR 218 N -0.04 0.95 -0.67 -3.82 0.05 -1.57 -1.21 116.97 110.66 1sb3 h TYR 218 Ca 0.03 0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.83 1sb3 h TYR 218 Cb 0.22 -0.31 -0.04 0.00 1.01 0.00 0.00 36.73 37.61 1sb3 h TYR 218 CO -0.00 0.63 0.43 0.28 -1.05 0.00 0.00 178.16 178.45 1sb3 h VAL 219 N 0.98 1.12 -0.44 -2.88 2.07 -1.19 0.47 116.25 116.38 1sb3 h VAL 219 Ca 0.26 -0.29 0.04 0.00 0.82 0.00 0.00 66.70 67.53 1sb3 h VAL 219 Cb -0.04 0.20 -0.04 0.00 -1.52 0.00 0.00 31.29 29.88 1sb3 h VAL 219 CO -0.05 0.16 0.20 -0.74 0.02 0.00 0.00 177.57 177.16 1sb3 h HIS 220 N 0.85 0.37 -0.24 1.57 6.17 -0.38 0.10 115.15 123.59 1sb3 h HIS 220 Ca 0.26 0.02 -0.03 0.00 0.71 0.00 0.00 60.37 61.33 1sb3 h HIS 220 Cb -0.03 -0.10 -0.01 0.00 2.52 0.00 0.00 27.41 29.79 1sb3 h HIS 220 CO -0.04 0.18 0.02 -0.07 0.71 0.00 0.00 177.93 178.73 1sb3 h LEU 221 N 0.41 0.39 -0.54 0.26 3.38 -0.62 -2.39 115.31 116.20 1sb3 h LEU 221 Ca 0.20 -0.28 -0.16 0.00 0.09 0.00 0.00 57.88 57.72 1sb3 h LEU 221 Cb 0.13 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1sb3 h LEU 221 CO -0.16 0.58 -0.66 0.11 0.09 0.00 0.00 178.44 178.40 1sb3 h LYS 222 N 0.20 0.30 -0.38 1.13 1.79 -0.62 -1.44 116.57 117.54 1sb3 h LYS 222 Ca 0.07 -0.23 -0.09 0.00 -2.18 0.00 0.00 60.65 58.23 1sb3 h LYS 222 Cb 0.36 0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.04 1sb3 h LYS 222 CO 0.01 0.86 -0.10 0.28 -1.08 0.00 0.00 179.45 179.42 1sb3 h VAL 223 N 0.22 1.28 -0.23 0.50 2.07 -0.82 0.29 116.25 119.54 1sb3 h VAL 223 Ca -0.02 -1.18 -0.01 0.00 0.82 0.00 0.00 66.70 66.31 1sb3 h VAL 223 Cb 1.20 1.26 -0.01 0.00 -1.52 0.00 0.00 31.29 32.22 1sb3 h VAL 223 CO 0.11 0.39 0.11 0.00 0.02 0.00 0.00 177.57 178.20 1sb3 h ALA 224 N 0.83 0.30 -0.26 1.67 0.00 -1.34 -0.02 119.26 120.44 1sb3 h ALA 224 Ca 0.10 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 1sb3 h ALA 224 Cb 0.62 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1sb3 h ALA 224 CO 0.04 -0.13 -0.13 0.00 0.00 0.00 0.00 179.25 179.03 1sb3 h ALA 225 N 0.96 0.37 0.00 0.00 0.00 -1.20 0.16 119.26 119.56 1sb3 h ALA 225 Ca 0.08 -0.32 -0.11 0.00 0.00 0.00 0.00 54.91 54.56 1sb3 h ALA 225 Cb 0.14 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1sb3 h ALA 225 CO -0.01 0.24 -0.55 0.00 0.00 0.00 0.00 179.25 178.94 1sb3 n LEU 227 N -3.89 1.86 -3.78 0.00 4.77 -0.03 -4.58 117.00 111.35 1sb3 n LEU 227 Ca -0.01 -0.61 -0.23 0.00 -0.03 0.00 0.00 56.01 55.13 1sb3 n LEU 227 Cb 0.56 -0.03 0.01 0.00 -2.33 0.00 0.00 43.42 41.63 1sb3 n LEU 227 CO 0.41 0.32 -0.12 0.00 -1.33 0.00 0.00 177.39 176.67 1sb3 n GLN 228 N 0.27 -4.36 -5.11 3.23 6.02 -0.22 -4.97 117.38 112.23 1sb3 n GLN 228 Ca 0.15 0.55 -0.29 0.00 -0.01 0.00 0.00 57.00 57.39 1sb3 n GLN 228 Cb 0.43 -4.96 -0.16 0.00 1.02 0.00 0.00 30.24 26.57 1sb3 n GLN 228 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.06 177.46 1sb3 s MET 229 N -6.16 2.25 0.30 -1.09 1.75 0.40 -5.03 119.30 111.72 1sb3 s MET 229 Ca 0.00 -0.80 -0.30 0.00 -1.25 0.00 0.00 55.69 53.35 1sb3 s MET 229 Cb -0.00 -1.93 -0.12 0.00 2.84 0.00 0.00 34.83 35.61 1sb3 s MET 229 CO 0.84 0.34 1.43 -3.47 -0.65 0.00 0.00 175.02 173.50 1sb3 n ASP 230 N 2.99 3.14 0.30 1.11 2.03 -1.26 -4.49 116.55 120.37 1sb3 n ASP 230 Ca -0.18 1.17 0.18 0.00 0.52 0.00 0.00 54.79 56.49 1sb3 n ASP 230 Cb 0.52 -1.51 0.98 0.00 -0.72 0.00 0.00 41.12 40.39 1sb3 n ASP 230 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1sb3 h SER 231 N 3.69 0.00 0.17 1.67 4.64 -1.93 -1.46 113.55 120.32 1sb3 h SER 231 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1sb3 h SER 231 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1sb3 h SER 231 CO 0.71 0.02 0.00 0.00 -0.87 0.00 0.00 176.83 176.70 1sb3 n ALA 232 N -2.21 2.40 0.42 5.18 0.00 -1.26 -2.31 120.51 122.73 1sb3 n ALA 232 Ca -0.02 -0.15 0.07 0.00 0.00 0.00 0.00 53.44 53.34 1sb3 n ALA 232 Cb 0.12 -1.42 0.10 0.00 0.00 0.00 0.00 19.45 18.25 1sb3 n ALA 232 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1sb3 n ARG 233 N -1.10 1.49 -5.05 0.00 1.74 -0.55 -4.95 116.66 108.23 1sb3 n ARG 233 Ca 0.17 -1.59 -0.32 0.00 -0.77 0.00 0.00 57.85 55.33 1sb3 n ARG 233 Cb 0.13 -1.30 -0.15 0.00 -1.02 0.00 0.00 32.46 30.12 1sb3 n ARG 233 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1sb3 s ILE 234 N -1.19 2.63 -0.07 0.55 1.01 -0.98 -0.15 121.20 122.99 1sb3 s ILE 234 Ca 0.21 -0.87 0.02 0.00 0.00 0.00 0.00 60.65 60.00 1sb3 s ILE 234 Cb 0.13 -2.00 0.02 0.00 0.01 0.00 0.00 42.46 40.62 1sb3 s ILE 234 CO 0.19 0.58 -0.11 -0.60 0.00 0.00 0.00 174.94 175.00 1sb3 s ARG 235 N -0.46 1.67 -0.11 2.79 3.52 0.08 -4.98 118.95 121.46 1sb3 s ARG 235 Ca 0.05 -0.38 0.03 0.00 -0.13 0.00 0.00 55.73 55.30 1sb3 s ARG 235 Cb -0.12 -1.44 -0.00 0.00 -1.56 0.00 0.00 34.95 31.83 1sb3 s ARG 235 CO 0.01 -0.03 -0.21 0.08 -0.81 0.00 0.00 175.30 174.35 1sb3 s VAL 236 N 0.86 2.33 -0.07 7.11 1.01 -1.26 -0.76 120.40 129.62 1sb3 s VAL 236 Ca -0.11 -0.92 0.04 0.00 0.00 0.00 0.00 61.98 60.99 1sb3 s VAL 236 Cb -0.15 -1.92 0.00 0.00 0.00 0.00 0.00 36.38 34.31 1sb3 s VAL 236 CO 0.01 0.55 -0.18 -0.63 0.00 0.00 0.00 175.10 174.85 1sb3 s ILE 237 N 0.39 1.53 -0.37 2.22 1.01 0.73 -1.53 121.20 125.18 1sb3 s ILE 237 Ca -0.16 -0.74 -0.12 0.00 0.00 0.00 0.00 60.65 59.63 1sb3 s ILE 237 Cb -0.17 -1.34 0.01 0.00 0.01 0.00 0.00 42.46 40.97 1sb3 s ILE 237 CO 0.07 0.44 0.23 -0.75 0.00 0.00 0.00 174.94 174.93 1sb3 s LYS 238 N 0.30 3.06 0.00 2.79 2.20 -0.54 -2.76 119.74 124.79 1sb3 s LYS 238 Ca -0.11 -0.93 0.00 0.00 -0.36 0.00 0.00 55.97 54.57 1sb3 s LYS 238 Cb -0.15 -3.78 0.00 0.00 -1.51 0.00 0.00 37.83 32.40 1sb3 s LYS 238 CO 0.04 -0.62 0.00 -0.35 -0.36 0.00 0.00 175.35 174.06 1sb3 n PRO 239 N 5.05 2.57 -1.95 4.03 -0.04 -1.26 -4.85 135.00 138.55 1sb3 n PRO 239 Ca -0.12 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 62.96 1sb3 n PRO 239 Cb 0.47 0.00 0.02 0.00 -0.04 0.00 0.00 33.50 33.95 1sb3 n PRO 239 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1sb3 s PHE 240 N 0.06 2.55 -0.10 0.54 0.08 -0.99 -4.94 117.98 115.18 1sb3 s PHE 240 Ca 0.00 1.41 0.02 0.00 0.12 0.00 0.00 56.93 58.48 1sb3 s PHE 240 Cb 0.00 -3.68 0.01 0.00 -0.57 0.00 0.00 43.02 38.78 1sb3 s PHE 240 CO 0.00 -2.41 -0.18 -1.17 -0.10 0.00 0.00 175.22 171.37 1sb3 s LEU 241 N -3.11 1.84 -1.25 -0.37 2.96 -1.26 -3.91 118.68 113.59 1sb3 s LEU 241 Ca 0.66 -0.46 -0.08 0.00 -0.22 0.00 0.00 54.13 54.03 1sb3 s LEU 241 Cb -0.37 -1.16 -0.05 0.00 0.50 0.00 0.00 46.19 45.11 1sb3 s LEU 241 CO 0.46 0.06 2.89 0.61 -1.32 0.00 0.00 176.35 179.04 1sb3 n GLY 242 N 3.97 4.35 0.14 7.98 0.00 -1.26 -4.49 105.19 115.88 1sb3 n GLY 242 Ca -0.20 -1.64 0.02 0.00 0.00 0.00 0.00 46.02 44.20 1sb3 n GLY 242 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sb3 n GLY 243 N 2.75 -1.39 0.78 -0.02 0.00 -1.20 -3.50 105.19 102.63 1sb3 n GLY 243 Ca 0.68 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 45.20 1sb3 n GLY 243 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sb3 n GLY 244 N -1.43 -0.24 2.30 -0.02 0.00 -1.26 -4.93 105.19 99.61 1sb3 n GLY 244 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.87 1sb3 n GLY 244 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1sb3 n PHE 245 N -1.91 -0.68 0.00 1.61 3.72 -1.26 -1.51 117.46 117.43 1sb3 n PHE 245 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1sb3 n PHE 245 Cb 0.00 -3.04 0.00 0.00 -0.94 0.00 0.00 39.48 35.50 1sb3 n PHE 245 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1sb3 n GLY 246 N -0.55 1.33 0.38 1.37 0.00 -1.26 -1.22 105.19 105.24 1sb3 n GLY 246 Ca -0.17 -0.22 0.16 0.00 0.00 0.00 0.00 46.02 45.79 1sb3 n GLY 246 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sb3 h ALA 247 N 0.00 2.10 -0.68 4.61 0.00 -1.32 -2.15 119.26 121.82 1sb3 h ALA 247 Ca 0.00 0.01 -0.41 0.00 0.00 0.00 0.00 54.91 54.51 1sb3 h ALA 247 Cb 0.00 -0.06 -0.24 0.00 0.00 0.00 0.00 17.79 17.50 1sb3 h ALA 247 CO 0.00 -0.34 0.15 0.54 0.00 0.00 0.00 179.25 179.60 1sb3 n ARG 248 N -4.50 2.35 -0.68 0.00 1.74 -1.26 -4.48 116.66 109.84 1sb3 n ARG 248 Ca 0.16 -3.32 0.08 0.00 -0.77 0.00 0.00 57.85 54.00 1sb3 n ARG 248 Cb 0.57 -2.06 0.35 0.00 -1.02 0.00 0.00 32.46 30.31 1sb3 n ARG 248 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1sb3 n THR 249 N -1.03 2.03 -3.93 0.55 -2.24 -0.81 -0.65 114.28 108.21 1sb3 n THR 249 Ca 0.46 -1.17 -0.10 0.00 -2.27 0.00 0.00 64.05 60.97 1sb3 n THR 249 Cb 1.09 -0.05 -0.11 0.00 -2.10 0.00 0.00 70.33 69.16 1sb3 n THR 249 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1sb3 s GLU 250 N -2.13 0.31 0.16 -0.78 -1.05 -1.26 -4.89 118.70 109.05 1sb3 s GLU 250 Ca 0.49 -0.42 -0.32 0.00 -0.15 0.00 0.00 54.97 54.57 1sb3 s GLU 250 Cb 0.34 0.12 -0.10 0.00 -0.44 0.00 0.00 34.13 34.05 1sb3 s GLU 250 CO 0.20 -0.06 1.56 0.00 0.95 0.00 0.00 175.26 177.91 1sb3 s ALA 251 N -1.15 3.77 0.05 -0.84 0.00 -1.26 -4.95 121.76 117.38 1sb3 s ALA 251 Ca -0.13 1.35 -0.00 0.00 0.00 0.00 0.00 51.96 53.19 1sb3 s ALA 251 Cb -0.07 -3.62 -0.04 0.00 0.00 0.00 0.00 23.12 19.38 1sb3 s ALA 251 CO -0.00 -0.78 0.19 -0.51 0.00 0.00 0.00 175.76 174.65 1sb3 s LEU 252 N 1.19 4.29 0.27 0.00 1.43 -1.26 -4.93 118.68 119.67 1sb3 s LEU 252 Ca 0.70 0.25 -0.00 0.00 -1.03 0.00 0.00 54.13 54.04 1sb3 s LEU 252 Cb -0.43 -2.83 0.55 0.00 0.03 0.00 0.00 46.19 43.51 1sb3 s LEU 252 CO 0.31 0.19 1.77 1.12 0.23 0.00 0.00 176.35 179.97 1sb3 h HIS 253 N 3.26 0.82 0.00 0.29 2.07 -1.93 -1.62 115.15 118.04 1sb3 h HIS 253 Ca -0.46 0.03 -0.02 0.00 -2.85 0.00 0.00 60.37 57.07 1sb3 h HIS 253 Cb 1.17 -0.23 -0.00 0.00 2.57 0.00 0.00 27.41 30.91 1sb3 h HIS 253 CO 0.62 0.21 -0.12 0.27 -3.07 0.00 0.00 177.93 175.84 1sb3 h PHE 254 N 0.66 0.00 -0.21 6.12 -0.00 -1.96 0.11 116.94 121.66 1sb3 h PHE 254 Ca 0.47 0.00 -0.15 0.00 -0.00 0.00 0.00 57.97 58.29 1sb3 h PHE 254 Cb 0.66 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.61 1sb3 h PHE 254 CO -0.08 0.12 -0.46 0.93 -0.00 0.00 0.00 178.31 178.82 1sb3 h GLU 255 N 0.00 0.68 -0.26 6.09 5.08 -1.68 -0.34 114.58 124.14 1sb3 h GLU 255 Ca -0.00 -0.45 -0.08 0.00 -1.00 0.00 0.00 59.36 57.82 1sb3 h GLU 255 Cb 0.27 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 1sb3 h GLU 255 CO 0.02 1.07 -0.15 0.82 -1.00 0.00 0.00 179.01 179.76 1sb3 h ILE 256 N 0.37 1.30 -0.83 3.13 2.04 -1.30 -2.80 117.51 119.43 1sb3 h ILE 256 Ca 0.00 -1.26 0.00 0.00 1.00 0.00 0.00 64.86 64.60 1sb3 h ILE 256 Cb 1.07 1.55 -0.04 0.00 -0.74 0.00 0.00 36.82 38.66 1sb3 h ILE 256 CO 0.10 0.40 0.53 0.40 0.00 0.00 0.00 178.15 179.58 1sb3 h ILE 257 N 0.30 1.22 -0.51 -0.67 2.04 -0.80 -0.02 117.51 119.07 1sb3 h ILE 257 Ca 0.06 -0.43 0.05 0.00 1.00 0.00 0.00 64.86 65.53 1sb3 h ILE 257 Cb 0.68 0.02 -0.05 0.00 -0.74 0.00 0.00 36.82 36.73 1sb3 h ILE 257 CO 0.04 0.22 0.25 0.00 0.00 0.00 0.00 178.15 178.67 1sb3 h ALA 258 N 1.29 0.65 -0.64 1.87 0.00 -0.98 0.64 119.26 122.10 1sb3 h ALA 258 Ca 0.30 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.20 1sb3 h ALA 258 Cb -0.10 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1sb3 h ALA 258 CO -0.06 -0.10 0.24 0.78 0.00 0.00 0.00 179.25 180.11 1sb3 h GLY 259 N 0.49 1.03 0.98 0.00 0.00 -1.17 -0.35 103.07 104.05 1sb3 h GLY 259 Ca 0.23 -0.58 0.01 0.00 0.00 0.00 0.00 47.33 46.99 1sb3 h GLY 259 CO -0.16 0.54 0.20 -2.00 0.00 0.00 0.00 176.54 175.12 1sb3 h LEU 260 N 0.90 0.34 -0.48 3.11 5.85 -0.43 -1.53 115.31 123.08 1sb3 h LEU 260 Ca 0.21 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.88 1sb3 h LEU 260 Cb 0.23 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 1sb3 h LEU 260 CO -0.01 0.25 0.11 -0.07 -0.34 0.00 0.00 178.44 178.38 1sb3 h LEU 261 N 0.41 0.73 -0.43 2.25 3.38 -0.63 -0.49 115.31 120.54 1sb3 h LEU 261 Ca 0.12 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1sb3 h LEU 261 Cb -0.03 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 1sb3 h LEU 261 CO -0.04 0.77 0.28 0.00 0.09 0.00 0.00 178.44 179.55 1sb3 h ALA 262 N 0.98 0.54 -0.17 1.53 0.00 -0.86 0.17 119.26 121.45 1sb3 h ALA 262 Ca 0.15 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1sb3 h ALA 262 Cb 0.33 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1sb3 h ALA 262 CO 0.00 -0.00 0.08 -0.09 0.00 0.00 0.00 179.25 179.24 1sb3 h ARG 263 N 0.58 0.25 -0.96 0.00 2.43 -1.10 0.17 114.38 115.74 1sb3 h ARG 263 Ca 0.16 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 1sb3 h ARG 263 Cb -0.06 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 29.40 1sb3 h ARG 263 CO -0.03 0.30 0.60 -0.22 -1.51 0.00 0.00 179.97 179.10 1sb3 h LYS 264 N 0.14 1.29 -0.00 0.20 1.63 -0.70 -1.07 116.57 118.06 1sb3 h LYS 264 Ca 0.06 -0.10 0.00 0.00 -0.85 0.00 0.00 60.65 59.76 1sb3 h LYS 264 Cb 0.13 -0.28 0.00 0.00 -0.60 0.00 0.00 32.23 31.48 1sb3 h LYS 264 CO -0.01 0.89 -0.01 0.00 -3.45 0.00 0.00 179.45 176.86 1sb3 n ALA 265 N -2.39 2.43 -3.49 5.00 0.00 0.57 -4.91 120.51 117.73 1sb3 n ALA 265 Ca 0.11 -0.13 -0.25 0.00 0.00 0.00 0.00 53.44 53.17 1sb3 n ALA 265 Cb 0.04 -1.47 0.05 0.00 0.00 0.00 0.00 19.45 18.07 1sb3 n ALA 265 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1sb3 n LYS 266 N -1.41 -6.07 0.00 0.00 5.02 0.49 -4.88 118.16 111.31 1sb3 n LYS 266 Ca 0.10 0.76 0.00 0.00 -2.02 0.00 0.00 58.31 57.15 1sb3 n LYS 266 Cb 0.30 -5.69 0.00 0.00 -0.02 0.00 0.00 35.03 29.62 1sb3 n LYS 266 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1sb3 n GLY 267 N -1.72 3.56 3.43 0.72 0.00 -0.53 -4.55 105.19 106.10 1sb3 n GLY 267 Ca -0.02 -0.27 -0.33 0.00 0.00 0.00 0.00 46.02 45.40 1sb3 n GLY 267 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1sb3 s THR 268 N -0.39 3.27 -0.08 2.61 2.01 -1.26 -1.07 115.64 120.75 1sb3 s THR 268 Ca 0.00 -0.60 0.02 0.00 0.31 0.00 0.00 61.69 61.43 1sb3 s THR 268 Cb 0.00 -2.37 0.01 0.00 0.01 0.00 0.00 72.50 70.15 1sb3 s THR 268 CO 0.00 0.53 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.65 1sb3 s VAL 269 N 0.09 1.22 -0.34 3.82 1.01 0.50 -0.04 120.40 126.66 1sb3 s VAL 269 Ca -0.04 -0.52 -0.11 0.00 0.00 0.00 0.00 61.98 61.31 1sb3 s VAL 269 Cb -0.14 -1.12 0.00 0.00 0.00 0.00 0.00 36.38 35.12 1sb3 s VAL 269 CO 0.04 0.38 0.19 -0.60 0.00 0.00 0.00 175.10 175.11 1sb3 s ARG 270 N 0.75 3.17 -0.42 2.72 3.52 0.03 -0.68 118.95 128.04 1sb3 s ARG 270 Ca -0.13 -0.85 -0.04 0.00 -0.13 0.00 0.00 55.73 54.58 1sb3 s ARG 270 Cb -0.16 -3.68 0.11 0.00 -1.56 0.00 0.00 34.95 29.66 1sb3 s ARG 270 CO 0.03 -0.53 0.23 -1.17 -0.81 0.00 0.00 175.30 173.04 1sb3 s LEU 271 N 1.61 5.27 0.22 -0.88 2.96 -0.01 -1.22 118.68 126.64 1sb3 s LEU 271 Ca 0.04 -1.94 -0.05 0.00 -0.22 0.00 0.00 54.13 51.97 1sb3 s LEU 271 Cb -0.18 -1.87 -0.05 0.00 0.50 0.00 0.00 46.19 44.59 1sb3 s LEU 271 CO 0.07 -0.56 0.46 -0.76 -1.32 0.00 0.00 176.35 174.24 1sb3 s LEU 272 N 1.21 4.17 0.05 -0.68 1.43 -1.26 -1.47 118.68 122.13 1sb3 s LEU 272 Ca 0.07 0.63 0.09 0.00 -1.03 0.00 0.00 54.13 53.89 1sb3 s LEU 272 Cb -0.23 -3.41 -0.03 0.00 0.03 0.00 0.00 46.19 42.55 1sb3 s LEU 272 CO -0.03 -0.07 -0.24 -1.10 0.23 0.00 0.00 176.35 175.14 1sb3 s GLN 273 N -3.14 1.83 0.84 1.70 -1.52 -0.31 -4.94 119.66 114.13 1sb3 s GLN 273 Ca 0.42 -1.10 -0.12 0.00 -1.95 0.00 0.00 55.36 52.62 1sb3 s GLN 273 Cb -0.11 -2.03 0.13 0.00 -0.22 0.00 0.00 33.01 30.78 1sb3 s GLN 273 CO 0.27 0.51 1.19 0.95 -0.25 0.00 0.00 175.29 177.96 1sb3 s THR 274 N -0.86 2.06 0.22 -0.19 -4.23 -1.26 -4.46 115.64 106.92 1sb3 s THR 274 Ca 0.13 -0.10 -0.06 0.00 -1.18 0.00 0.00 61.69 60.48 1sb3 s THR 274 Cb -0.10 -2.96 0.09 0.00 1.34 0.00 0.00 72.50 70.87 1sb3 s THR 274 CO 0.03 0.00 1.70 -0.09 -0.54 0.00 0.00 174.62 175.72 1sb3 h ARG 275 N -1.15 0.94 -0.52 3.99 9.65 -1.98 -0.36 114.38 124.94 1sb3 h ARG 275 Ca -0.44 -0.28 0.00 0.00 -1.10 0.00 0.00 59.98 58.16 1sb3 h ARG 275 Cb 1.28 -0.10 -0.03 0.00 -1.39 0.00 0.00 29.97 29.74 1sb3 h ARG 275 CO 0.52 0.93 0.33 1.49 2.80 0.00 0.00 179.97 186.04 1sb3 h GLU 276 N 0.87 0.70 -0.02 0.20 4.81 -1.94 -0.36 114.58 118.83 1sb3 h GLU 276 Ca 0.16 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.28 1sb3 h GLU 276 Cb 0.51 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 1sb3 h GLU 276 CO 0.03 0.50 -0.22 0.93 -0.73 0.00 0.00 179.01 179.51 1sb3 h GLU 277 N 0.71 0.03 -0.39 1.92 5.08 -1.80 0.08 114.58 120.22 1sb3 h GLU 277 Ca 0.19 -0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 58.42 1sb3 h GLU 277 Cb -0.04 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 1sb3 h GLU 277 CO -0.04 0.26 -0.23 1.15 -1.00 0.00 0.00 179.01 179.15 1sb3 h THR 278 N 0.03 1.28 -0.20 1.13 2.02 -0.31 -0.96 112.91 115.91 1sb3 h THR 278 Ca 0.00 -1.37 -0.02 0.00 0.77 0.00 0.00 66.41 65.79 1sb3 h THR 278 Cb 0.42 1.33 -0.01 0.00 -1.74 0.00 0.00 68.15 68.14 1sb3 h THR 278 CO 0.03 0.46 0.02 -0.26 0.37 0.00 0.00 175.52 176.13 1sb3 h PHE 279 N 0.64 0.28 -0.12 3.16 -1.00 -0.36 -2.46 116.94 117.07 1sb3 h PHE 279 Ca 0.08 -0.01 -0.17 0.00 2.81 0.00 0.00 57.97 60.68 1sb3 h PHE 279 Cb 0.79 -0.09 -0.01 0.00 3.61 0.00 0.00 35.95 40.26 1sb3 h PHE 279 CO 0.06 0.28 -0.64 0.82 -1.61 0.00 0.00 178.31 177.22 1sb3 h ILE 280 N 0.28 1.35 -0.87 -0.55 2.04 -0.39 -2.59 117.51 116.78 1sb3 h ILE 280 Ca 0.07 -1.97 0.01 0.00 1.00 0.00 0.00 64.86 63.97 1sb3 h ILE 280 Cb 0.17 1.95 -0.04 0.00 -0.74 0.00 0.00 36.82 38.15 1sb3 h ILE 280 CO 0.00 0.60 0.58 0.00 0.00 0.00 0.00 178.15 179.33 1sb3 h ALA 281 N 0.98 1.10 -0.47 1.87 0.00 -0.93 -3.44 119.26 118.37 1sb3 h ALA 281 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1sb3 h ALA 281 Cb 1.19 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1sb3 h ALA 281 CO 0.11 0.50 0.00 1.58 0.00 0.00 0.00 179.25 181.44 1sb3 n HIS 282 N -4.48 0.00 -2.35 0.00 -0.00 -0.95 -4.69 115.22 102.74 1sb3 n HIS 282 Ca 0.09 0.00 -0.13 0.00 -0.00 0.00 0.00 57.72 57.68 1sb3 n HIS 282 Cb 0.02 0.00 -0.00 0.00 -0.00 0.00 0.00 29.99 30.01 1sb3 n HIS 282 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 1sb3 n ARG 283 N 0.00 -1.46 -0.16 1.57 5.12 0.16 -4.78 116.66 117.11 1sb3 n ARG 283 Ca 0.00 0.62 0.00 0.00 -1.93 0.00 0.00 57.85 56.54 1sb3 n ARG 283 Cb 0.00 -4.83 0.00 0.00 -1.16 0.00 0.00 32.46 26.47 1sb3 n ARG 283 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1sb3 n GLY 284 N -1.06 0.15 3.67 -0.13 0.00 -1.26 -1.75 105.19 104.81 1sb3 n GLY 284 Ca -0.14 -1.81 -0.43 0.00 0.00 0.00 0.00 46.02 43.65 1sb3 n GLY 284 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1sb3 s ARG 285 N -0.45 4.29 0.56 1.61 3.52 -0.72 -0.63 118.95 127.13 1sb3 s ARG 285 Ca 0.00 1.49 -0.19 0.00 -0.13 0.00 0.00 55.73 56.90 1sb3 s ARG 285 Cb 0.00 -3.65 -0.05 0.00 -1.56 0.00 0.00 34.95 29.69 1sb3 s ARG 285 CO 0.00 -0.58 1.17 -1.25 -0.81 0.00 0.00 175.30 173.82 1sb3 s PRO 286 N 2.99 3.23 0.24 5.12 0.04 -1.26 -1.68 135.00 143.67 1sb3 s PRO 286 Ca 0.49 1.72 -0.31 0.00 0.04 0.00 0.00 61.00 62.93 1sb3 s PRO 286 Cb -0.19 -2.00 -0.12 0.00 0.04 0.00 0.00 34.50 32.23 1sb3 s PRO 286 CO 0.12 -0.97 1.65 1.87 0.04 0.00 0.00 177.00 179.71 1sb3 n TRP 287 N -1.36 2.72 -4.14 0.56 -0.00 -1.25 -4.50 117.44 109.46 1sb3 n TRP 287 Ca 0.12 0.15 -0.17 0.00 -0.00 0.00 0.00 57.50 57.61 1sb3 n TRP 287 Cb 0.50 -2.63 -0.15 0.00 -0.00 0.00 0.00 31.31 29.04 1sb3 n TRP 287 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 177.69 178.68 1sb3 s THR 288 N 0.68 0.42 -0.20 5.87 2.01 -0.09 -1.86 115.64 122.46 1sb3 s THR 288 Ca 0.71 -0.17 -0.05 0.00 0.31 0.00 0.00 61.69 62.49 1sb3 s THR 288 Cb -0.53 -0.39 -0.02 0.00 0.01 0.00 0.00 72.50 71.57 1sb3 s THR 288 CO 0.39 0.14 -0.01 -0.70 -0.69 0.00 0.00 174.62 173.76 1sb3 s GLU 289 N 0.20 3.59 -0.15 4.92 2.12 -0.51 -0.29 118.70 128.58 1sb3 s GLU 289 Ca -0.02 -0.53 0.02 0.00 0.36 0.00 0.00 54.97 54.79 1sb3 s GLU 289 Cb -0.06 -3.06 0.02 0.00 0.26 0.00 0.00 34.13 31.29 1sb3 s GLU 289 CO -0.00 0.00 -0.19 0.08 -0.54 0.00 0.00 175.26 174.61 1sb3 s VAL 290 N 1.01 1.91 -0.27 3.70 1.01 0.18 -1.49 120.40 126.45 1sb3 s VAL 290 Ca 0.02 -0.87 -0.11 0.00 0.00 0.00 0.00 61.98 61.01 1sb3 s VAL 290 Cb -0.14 -1.72 -0.05 0.00 0.00 0.00 0.00 36.38 34.47 1sb3 s VAL 290 CO 0.01 0.52 0.21 -0.75 0.00 0.00 0.00 175.10 175.09 1sb3 s LYS 291 N 1.06 3.97 -0.16 2.72 2.20 0.47 -0.56 119.74 129.45 1sb3 s LYS 291 Ca -0.02 -0.27 -0.01 0.00 -0.36 0.00 0.00 55.97 55.32 1sb3 s LYS 291 Cb -0.14 -3.64 -0.01 0.00 -1.51 0.00 0.00 37.83 32.53 1sb3 s LYS 291 CO -0.06 -0.16 -0.13 1.41 -0.36 0.00 0.00 175.35 176.05 1sb3 s MET 292 N 1.71 3.28 -0.14 4.03 -2.45 0.31 -1.04 119.30 125.00 1sb3 s MET 292 Ca 0.08 -0.71 -0.00 0.00 -1.25 0.00 0.00 55.69 53.80 1sb3 s MET 292 Cb -0.16 -2.69 0.03 0.00 1.25 0.00 0.00 34.83 33.27 1sb3 s MET 292 CO 0.10 0.02 -0.07 0.21 1.05 0.00 0.00 175.02 176.34 1sb3 s LYS 293 N 0.82 1.51 -0.06 4.11 2.20 -0.25 -0.71 119.74 127.35 1sb3 s LYS 293 Ca -0.04 -0.37 0.04 0.00 -0.36 0.00 0.00 55.97 55.24 1sb3 s LYS 293 Cb -0.15 -1.78 -0.00 0.00 -1.51 0.00 0.00 37.83 34.39 1sb3 s LYS 293 CO 0.00 -0.34 -0.20 0.42 -0.36 0.00 0.00 175.35 174.88 1sb3 s ILE 294 N 1.67 1.70 -0.19 5.43 1.01 -0.65 -0.73 121.20 129.44 1sb3 s ILE 294 Ca 0.03 -0.85 -0.03 0.00 0.00 0.00 0.00 60.65 59.80 1sb3 s ILE 294 Cb -0.14 -1.46 -0.01 0.00 0.01 0.00 0.00 42.46 40.85 1sb3 s ILE 294 CO -0.08 0.48 -0.05 -0.83 0.00 0.00 0.00 174.94 174.46 1sb3 s GLY 295 N 0.14 1.63 0.28 6.18 0.00 0.20 -2.57 107.32 113.18 1sb3 s GLY 295 Ca -0.09 -1.04 0.10 0.00 0.00 0.00 0.00 44.72 43.70 1sb3 s GLY 295 CO 0.04 0.22 -0.16 1.08 0.00 0.00 0.00 173.10 174.28 1sb3 s LEU 296 N 1.04 2.61 0.49 0.66 1.43 0.51 0.97 118.68 126.39 1sb3 s LEU 296 Ca 0.01 -1.08 -0.02 0.00 -1.03 0.00 0.00 54.13 52.01 1sb3 s LEU 296 Cb -0.15 -0.97 -0.01 0.00 0.03 0.00 0.00 46.19 45.10 1sb3 s LEU 296 CO 0.00 -0.08 0.75 -0.54 0.23 0.00 0.00 176.35 176.71 1sb3 s LYS 297 N -3.57 3.10 0.50 1.70 -0.14 0.45 -0.39 119.74 121.39 1sb3 s LYS 297 Ca 0.29 -0.26 0.15 0.00 -1.36 0.00 0.00 55.97 54.79 1sb3 s LYS 297 Cb -0.02 -2.46 1.20 0.00 -1.68 0.00 0.00 37.83 34.87 1sb3 s LYS 297 CO 0.14 -0.37 2.13 0.87 -0.76 0.00 0.00 175.35 177.36 1sb3 h LYS 298 N 0.23 0.10 0.00 1.68 1.57 -1.92 -0.18 116.57 118.04 1sb3 h LYS 298 Ca -0.46 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 1sb3 h LYS 298 Cb 1.25 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.53 1sb3 h LYS 298 CO 0.59 0.06 0.00 -0.40 -0.57 0.00 0.00 179.45 179.13 1sb3 n ASP 299 N -4.53 0.00 0.00 0.86 5.68 -1.26 -4.90 116.55 112.41 1sb3 n ASP 299 Ca -0.02 -0.49 0.00 0.00 -0.50 0.00 0.00 54.79 53.78 1sb3 n ASP 299 Cb 0.09 -0.17 0.00 0.00 -1.14 0.00 0.00 41.12 39.91 1sb3 n ASP 299 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1sb3 n GLY 300 N 1.13 1.40 3.77 6.12 0.00 -0.08 -5.06 105.19 112.47 1sb3 n GLY 300 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 1sb3 n GLY 300 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sb3 s LYS 301 N -0.93 3.81 0.12 1.61 -0.14 -1.26 -4.65 119.74 118.30 1sb3 s LYS 301 Ca 0.00 2.39 -0.30 0.00 -1.36 0.00 0.00 55.97 56.70 1sb3 s LYS 301 Cb 0.00 -2.73 -0.06 0.00 -1.68 0.00 0.00 37.83 33.36 1sb3 s LYS 301 CO 0.00 -0.70 0.97 0.42 -0.76 0.00 0.00 175.35 175.28 1sb3 s ILE 302 N -1.20 4.43 -0.11 2.17 1.01 -1.26 -0.41 121.20 125.83 1sb3 s ILE 302 Ca 0.59 2.04 0.06 0.00 0.00 0.00 0.00 60.65 63.33 1sb3 s ILE 302 Cb -0.43 -4.30 -0.11 0.00 0.01 0.00 0.00 42.46 37.63 1sb3 s ILE 302 CO 0.56 0.32 -0.02 0.00 0.00 0.00 0.00 174.94 175.80 1sb3 n ALA 303 N 2.71 1.74 -3.49 9.38 0.00 0.27 -4.43 120.51 126.69 1sb3 n ALA 303 Ca 0.02 -0.63 -0.10 0.00 0.00 0.00 0.00 53.44 52.73 1sb3 n ALA 303 Cb 0.49 0.10 -0.02 0.00 0.00 0.00 0.00 19.45 20.01 1sb3 n ALA 303 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sb3 s ALA 304 N -2.25 -1.77 -0.03 0.00 0.00 -0.88 -3.82 121.76 113.01 1sb3 s ALA 304 Ca -0.10 0.94 -0.01 0.00 0.00 0.00 0.00 51.96 52.79 1sb3 s ALA 304 Cb 0.04 0.43 0.02 0.00 0.00 0.00 0.00 23.12 23.60 1sb3 s ALA 304 CO 0.37 -0.66 0.06 -1.17 0.00 0.00 0.00 175.76 174.36 1sb3 s LEU 305 N -2.38 1.32 -0.07 0.00 2.96 -0.58 -0.62 118.68 119.31 1sb3 s LEU 305 Ca 0.03 0.11 -0.00 0.00 -0.22 0.00 0.00 54.13 54.04 1sb3 s LEU 305 Cb -0.01 0.10 0.02 0.00 0.50 0.00 0.00 46.19 46.80 1sb3 s LEU 305 CO -0.08 -0.09 -0.03 0.00 -1.32 0.00 0.00 176.35 174.83 1sb3 s ALA 306 N 0.66 0.83 0.08 5.97 0.00 0.09 -0.18 121.76 129.22 1sb3 s ALA 306 Ca -0.05 -0.19 0.02 0.00 0.00 0.00 0.00 51.96 51.74 1sb3 s ALA 306 Cb -0.08 -0.65 -0.03 0.00 0.00 0.00 0.00 23.12 22.36 1sb3 s ALA 306 CO -0.02 -0.27 -0.08 -0.48 0.00 0.00 0.00 175.76 174.91 1sb3 s LEU 307 N 1.49 2.40 -0.02 0.00 2.34 -0.23 -1.09 118.68 123.58 1sb3 s LEU 307 Ca -0.02 -0.82 0.03 0.00 0.06 0.00 0.00 54.13 53.39 1sb3 s LEU 307 Cb -0.13 -0.15 -0.00 0.00 -0.56 0.00 0.00 46.19 45.35 1sb3 s LEU 307 CO -0.03 -0.34 -0.10 -1.61 -1.06 0.00 0.00 176.35 173.21 1sb3 s GLU 308 N -2.87 0.94 -0.03 1.48 2.02 -0.21 -1.63 118.70 118.40 1sb3 s GLU 308 Ca 0.03 -0.33 0.01 0.00 0.02 0.00 0.00 54.97 54.70 1sb3 s GLU 308 Cb -0.01 -0.88 0.02 0.00 0.10 0.00 0.00 34.13 33.35 1sb3 s GLU 308 CO -0.02 0.15 -0.02 0.00 0.02 0.00 0.00 175.26 175.39 1sb3 s ALA 309 N 0.04 0.43 -0.11 5.21 0.00 -0.44 -0.40 121.76 126.49 1sb3 s ALA 309 Ca -0.01 0.06 0.03 0.00 0.00 0.00 0.00 51.96 52.03 1sb3 s ALA 309 Cb -0.07 -0.31 0.01 0.00 0.00 0.00 0.00 23.12 22.75 1sb3 s ALA 309 CO 0.00 -0.02 -0.19 0.99 0.00 0.00 0.00 175.76 176.54 1sb3 s THR 310 N 0.82 1.75 -0.06 0.00 2.01 -0.55 -0.67 115.64 118.94 1sb3 s THR 310 Ca -0.09 -0.81 0.04 0.00 0.31 0.00 0.00 61.69 61.14 1sb3 s THR 310 Cb -0.12 -1.56 -0.02 0.00 0.01 0.00 0.00 72.50 70.81 1sb3 s THR 310 CO -0.01 0.49 -0.18 -1.10 -0.69 0.00 0.00 174.62 173.13 1sb3 s GLN 311 N 0.74 2.58 -0.50 4.92 -0.21 -0.12 -1.42 119.66 125.64 1sb3 s GLN 311 Ca -0.11 -0.77 -0.21 0.00 0.02 0.00 0.00 55.36 54.29 1sb3 s GLN 311 Cb -0.16 -2.32 0.04 0.00 1.00 0.00 0.00 33.01 31.57 1sb3 s GLN 311 CO 0.02 0.51 0.72 0.00 -2.12 0.00 0.00 175.29 174.42 1sb3 s ALA 312 N -0.45 3.31 -2.13 6.09 0.00 -0.78 -1.21 121.76 126.60 1sb3 s ALA 312 Ca 0.05 -1.46 0.19 0.00 0.00 0.00 0.00 51.96 50.74 1sb3 s ALA 312 Cb -0.12 -3.45 0.51 0.00 0.00 0.00 0.00 23.12 20.06 1sb3 s ALA 312 CO 0.02 -2.06 1.42 0.41 0.00 0.00 0.00 175.76 175.55 1sb3 n GLY 313 N 5.12 1.38 6.32 0.00 0.00 0.35 -3.91 105.19 114.46 1sb3 n GLY 313 Ca -0.03 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.40 1sb3 n GLY 313 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sb3 n GLY 314 N 1.35 -2.00 0.16 -0.02 0.00 -1.26 -1.48 105.19 101.95 1sb3 n GLY 314 Ca 0.18 -1.39 0.13 0.00 0.00 0.00 0.00 46.02 44.94 1sb3 n GLY 314 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sb3 h ALA 315 N -0.12 1.00 -2.35 4.61 0.00 0.11 -1.82 119.26 120.70 1sb3 h ALA 315 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.55 1sb3 h ALA 315 Cb 0.02 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 17.65 1sb3 h ALA 315 CO 0.00 0.00 -0.73 0.71 0.00 0.00 0.00 179.25 179.23 1sb3 s TYR 316 N -3.17 1.37 0.11 0.00 1.51 -1.26 -4.92 117.35 110.98 1sb3 s TYR 316 Ca 0.09 -0.69 -0.31 0.00 -1.01 0.00 0.00 57.07 55.15 1sb3 s TYR 316 Cb 0.09 -0.68 -0.11 0.00 -0.11 0.00 0.00 41.96 41.15 1sb3 s TYR 316 CO 0.61 0.14 1.60 0.00 -1.11 0.00 0.00 175.55 176.80 1sb3 h ALA 317 N 2.88 -0.72 -0.45 3.71 0.00 -1.90 -3.44 119.26 119.34 1sb3 h ALA 317 Ca -0.37 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1sb3 h ALA 317 Cb 1.20 0.60 0.00 0.00 0.00 0.00 0.00 17.79 19.59 1sb3 h ALA 317 CO 0.61 -0.96 0.00 0.41 0.00 0.00 0.00 179.25 179.31 1sb3 n GLY 318 N -1.46 2.67 0.11 0.00 0.00 -1.26 -1.05 105.19 104.20 1sb3 n GLY 318 Ca -0.08 -0.14 0.15 0.00 0.00 0.00 0.00 46.02 45.95 1sb3 n GLY 318 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1sb3 n TYR 319 N 14.00 0.00 -0.30 1.61 4.02 -1.26 -4.37 117.16 130.86 1sb3 n TYR 319 Ca 0.00 0.00 0.03 0.00 -0.01 0.00 0.00 57.90 57.92 1sb3 n TYR 319 Cb 0.00 -0.10 0.10 0.00 -0.02 0.00 0.00 39.34 39.31 1sb3 n TYR 319 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1sb3 n GLY 320 N 1.16 -1.47 0.20 2.72 0.00 -0.22 -0.31 105.19 107.27 1sb3 n GLY 320 Ca 0.19 0.89 -0.07 0.00 0.00 0.00 0.00 46.02 47.03 1sb3 n GLY 320 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1sb3 h ILE 321 N 0.00 1.09 -0.26 -0.61 2.04 -1.81 -0.38 117.51 117.59 1sb3 h ILE 321 Ca 0.37 -0.21 -0.05 0.00 1.00 0.00 0.00 64.86 65.97 1sb3 h ILE 321 Cb 0.58 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 37.08 1sb3 h ILE 321 CO -0.84 0.11 -0.04 0.40 0.00 0.00 0.00 178.15 177.77 1sb3 h ILE 322 N 0.60 1.28 -0.53 -0.67 2.04 -1.01 -2.68 117.51 116.54 1sb3 h ILE 322 Ca 0.18 -1.03 0.07 0.00 1.00 0.00 0.00 64.86 65.08 1sb3 h ILE 322 Cb -0.04 1.43 -0.06 0.00 -0.74 0.00 0.00 36.82 37.41 1sb3 h ILE 322 CO -0.06 0.32 0.20 0.74 0.00 0.00 0.00 178.15 179.36 1sb3 h THR 323 N 0.24 0.83 -0.24 -0.27 2.02 -0.24 -1.14 112.91 114.11 1sb3 h THR 323 Ca 0.07 -0.13 -0.12 0.00 0.77 0.00 0.00 66.41 67.00 1sb3 h THR 323 Cb 0.50 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 67.31 1sb3 h THR 323 CO 0.02 0.07 -0.35 -0.29 0.37 0.00 0.00 175.52 175.35 1sb3 h ILE 324 N 0.39 1.29 -0.51 3.11 6.09 -1.05 -2.10 117.51 124.73 1sb3 h ILE 324 Ca 0.25 -1.46 -0.05 0.00 -1.37 0.00 0.00 64.86 62.24 1sb3 h ILE 324 Cb 0.27 1.49 -0.02 0.00 0.47 0.00 0.00 36.82 39.02 1sb3 h ILE 324 CO -0.25 0.46 0.13 -0.07 -3.07 0.00 0.00 178.15 175.36 1sb3 h LEU 325 N 0.43 0.72 -1.90 2.19 3.38 -1.07 -2.36 115.31 116.70 1sb3 h LEU 325 Ca 0.05 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 1sb3 h LEU 325 Cb 0.81 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 1sb3 h LEU 325 CO 0.07 0.70 -0.12 1.88 0.09 0.00 0.00 178.44 181.05 1sb3 h TYR 326 N 0.75 0.00 0.00 1.13 0.99 -0.52 -1.81 116.97 117.51 1sb3 h TYR 326 Ca 0.17 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.90 1sb3 h TYR 326 Cb 0.26 0.00 -0.00 0.00 1.00 0.00 0.00 36.73 37.99 1sb3 h TYR 326 CO 0.01 0.12 -0.01 1.79 -0.00 0.00 0.00 178.16 180.08 1sb3 h THR 327 N 0.00 0.11 0.00 -2.88 1.35 -1.25 -3.21 112.91 107.03 1sb3 h THR 327 Ca -0.00 -0.09 -0.11 0.00 -0.55 0.00 0.00 66.41 65.66 1sb3 h THR 327 Cb 0.32 1.08 -0.02 0.00 -1.73 0.00 0.00 68.15 67.80 1sb3 h THR 327 CO 0.02 0.01 -1.42 0.61 -0.25 0.00 0.00 175.52 174.48 1sb3 n GLY 328 N -0.97 -0.23 0.38 5.82 0.00 -0.91 -4.73 105.19 104.55 1sb3 n GLY 328 Ca -0.03 -0.08 0.18 0.00 0.00 0.00 0.00 46.02 46.09 1sb3 n GLY 328 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sb3 h ALA 329 N 0.19 1.96 -0.76 4.61 0.00 -1.35 -0.59 119.26 123.32 1sb3 h ALA 329 Ca -0.17 0.07 -0.25 0.00 0.00 0.00 0.00 54.91 54.56 1sb3 h ALA 329 Cb 1.33 -0.03 -0.15 0.00 0.00 0.00 0.00 17.79 18.95 1sb3 h ALA 329 CO -0.00 -0.34 0.32 1.28 0.00 0.00 0.00 179.25 180.50 1sb3 n LEU 330 N -4.69 6.10 0.08 0.00 4.32 -1.25 -3.44 117.00 118.12 1sb3 n LEU 330 Ca 0.24 -3.18 0.13 0.00 -0.02 0.00 0.00 56.01 53.17 1sb3 n LEU 330 Cb 0.71 -0.75 0.39 0.00 -1.62 0.00 0.00 43.42 42.15 1sb3 n LEU 330 CO 0.24 0.82 0.79 0.23 -1.22 0.00 0.00 177.39 178.25 1sb3 n MET 331 N -0.24 0.22 -3.63 3.23 2.81 -0.23 -4.84 117.12 114.44 1sb3 n MET 331 Ca 0.42 0.15 -0.20 0.00 -1.81 0.00 0.00 57.70 56.27 1sb3 n MET 331 Cb 1.40 -1.73 -0.01 0.00 -0.71 0.00 0.00 33.22 32.17 1sb3 n MET 331 CO 0.00 0.00 0.00 -1.01 1.51 0.00 0.00 175.97 176.47 1sb3 s HIS 332 N -3.09 3.15 0.00 2.03 3.76 -1.22 -4.67 115.29 115.25 1sb3 s HIS 332 Ca 0.10 -0.19 0.00 0.00 -0.15 0.00 0.00 55.06 54.83 1sb3 s HIS 332 Cb 0.14 -1.87 0.00 0.00 1.11 0.00 0.00 32.58 31.96 1sb3 s HIS 332 CO 0.61 0.12 0.00 0.41 -0.85 0.00 0.00 174.74 175.03 1sb3 n GLY 333 N -1.54 1.51 0.63 -2.22 0.00 -1.26 -4.85 105.19 97.46 1sb3 n GLY 333 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 1sb3 n GLY 333 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1sb3 n LEU 334 N 0.00 1.05 -4.55 0.99 7.94 -1.26 -5.02 117.00 116.16 1sb3 n LEU 334 Ca 0.00 0.17 -0.27 0.00 -1.11 0.00 0.00 56.01 54.80 1sb3 n LEU 334 Cb 0.00 -0.41 -0.10 0.00 0.53 0.00 0.00 43.42 43.45 1sb3 n LEU 334 CO 0.00 -0.02 -0.43 -0.31 -1.11 0.00 0.00 177.39 175.52 1sb3 s TYR 335 N -2.28 2.59 -0.17 1.96 2.02 -1.26 -4.12 117.35 116.09 1sb3 s TYR 335 Ca -0.15 -0.24 -0.27 0.00 -0.37 0.00 0.00 57.07 56.04 1sb3 s TYR 335 Cb 0.05 -1.28 -0.01 0.00 -0.40 0.00 0.00 41.96 40.32 1sb3 s TYR 335 CO 0.20 0.50 0.89 -1.58 -1.57 0.00 0.00 175.55 174.00 1sb3 s HIS 336 N -1.66 3.42 -0.10 2.71 5.65 0.02 -4.83 115.29 120.50 1sb3 s HIS 336 Ca 0.24 1.34 0.00 0.00 0.25 0.00 0.00 55.06 56.90 1sb3 s HIS 336 Cb -0.09 -3.09 0.02 0.00 -1.18 0.00 0.00 32.58 28.25 1sb3 s HIS 336 CO 0.14 -0.28 -0.09 0.42 -0.65 0.00 0.00 174.74 174.29 1sb3 s ILE 337 N 2.30 1.06 0.17 0.89 1.01 -1.26 -4.74 121.20 120.64 1sb3 s ILE 337 Ca 0.41 -0.33 -0.14 0.00 0.00 0.00 0.00 60.65 60.58 1sb3 s ILE 337 Cb -0.17 -1.05 0.07 0.00 0.01 0.00 0.00 42.46 41.32 1sb3 s ILE 337 CO 0.12 0.37 1.75 -0.65 0.00 0.00 0.00 174.94 176.53 1sb3 h PRO 338 N 7.93 0.31 -3.29 2.79 0.11 -1.78 -3.45 132.00 134.63 1sb3 h PRO 338 Ca -0.31 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 65.64 1sb3 h PRO 338 Cb 1.14 -0.07 -0.22 0.00 0.11 0.00 0.00 31.00 31.96 1sb3 h PRO 338 CO 0.43 0.21 -0.43 0.00 -0.21 0.00 0.00 178.00 178.00 1sb3 s ALA 339 N -6.14 -0.52 -0.02 -0.75 0.00 -1.25 -4.69 121.76 108.40 1sb3 s ALA 339 Ca -0.13 0.24 0.00 0.00 0.00 0.00 0.00 51.96 52.07 1sb3 s ALA 339 Cb 0.14 -0.06 0.02 0.00 0.00 0.00 0.00 23.12 23.21 1sb3 s ALA 339 CO 0.72 -0.19 0.00 0.42 0.00 0.00 0.00 175.76 176.72 1sb3 s ILE 340 N -0.86 0.12 -0.09 0.00 1.01 -0.03 -1.52 121.20 119.84 1sb3 s ILE 340 Ca -0.09 0.07 0.02 0.00 0.00 0.00 0.00 60.65 60.65 1sb3 s ILE 340 Cb -0.05 -0.20 -0.02 0.00 0.01 0.00 0.00 42.46 42.20 1sb3 s ILE 340 CO 0.02 0.11 -0.16 -0.75 0.00 0.00 0.00 174.94 174.16 1sb3 s LYS 341 N 0.76 2.93 -0.06 2.79 2.20 0.75 0.25 119.74 129.36 1sb3 s LYS 341 Ca -0.07 -0.73 -0.02 0.00 -0.36 0.00 0.00 55.97 54.80 1sb3 s LYS 341 Cb -0.10 -2.46 0.03 0.00 -1.51 0.00 0.00 37.83 33.78 1sb3 s LYS 341 CO -0.02 0.39 0.03 -1.58 -0.36 0.00 0.00 175.35 173.81 1sb3 s HIS 342 N -0.13 0.42 -0.05 4.03 5.65 0.32 -1.06 115.29 124.46 1sb3 s HIS 342 Ca -0.02 -0.00 0.03 0.00 0.25 0.00 0.00 55.06 55.32 1sb3 s HIS 342 Cb -0.14 -0.67 0.01 0.00 -1.18 0.00 0.00 32.58 30.60 1sb3 s HIS 342 CO 0.04 -0.28 -0.14 -0.51 -0.65 0.00 0.00 174.74 173.20 1sb3 s ASP 343 N 2.05 1.85 -0.02 9.88 1.01 -0.65 -0.36 116.67 130.44 1sb3 s ASP 343 Ca 0.05 -0.31 -0.17 0.00 0.71 0.00 0.00 52.55 52.84 1sb3 s ASP 343 Cb -0.12 -0.71 0.03 0.00 1.01 0.00 0.00 42.92 43.13 1sb3 s ASP 343 CO -0.04 0.08 0.35 0.00 0.21 0.00 0.00 175.17 175.77 1sb3 s ALA 344 N 0.40 -0.90 -0.07 5.23 0.00 -0.07 -1.33 121.76 125.02 1sb3 s ALA 344 Ca -0.10 0.47 0.01 0.00 0.00 0.00 0.00 51.96 52.33 1sb3 s ALA 344 Cb -0.14 0.04 0.02 0.00 0.00 0.00 0.00 23.12 23.05 1sb3 s ALA 344 CO 0.03 -0.27 -0.06 -1.58 0.00 0.00 0.00 175.76 173.88 1sb3 s TRP 345 N -1.25 1.10 -0.36 0.00 0.51 0.15 -0.99 118.94 118.11 1sb3 s TRP 345 Ca -0.13 -0.42 -0.10 0.00 -2.12 0.00 0.00 56.10 53.33 1sb3 s TRP 345 Cb -0.05 -0.94 0.02 0.00 -0.81 0.00 0.00 33.47 31.70 1sb3 s TRP 345 CO 0.05 -0.32 0.18 0.50 -0.51 0.00 0.00 176.95 176.84 1sb3 s ARG 346 N 1.24 2.87 -0.12 4.98 6.06 -0.05 -0.95 118.95 132.98 1sb3 s ARG 346 Ca -0.05 -1.04 -0.02 0.00 -2.50 0.00 0.00 55.73 52.12 1sb3 s ARG 346 Cb -0.14 -3.64 -0.03 0.00 0.06 0.00 0.00 34.95 31.20 1sb3 s ARG 346 CO -0.02 -0.64 -0.06 0.08 -2.50 0.00 0.00 175.30 172.16 1sb3 s VAL 347 N 1.53 3.74 0.26 7.11 1.01 -0.35 -0.47 120.40 133.24 1sb3 s VAL 347 Ca 0.02 -0.43 -0.29 0.00 0.00 0.00 0.00 61.98 61.27 1sb3 s VAL 347 Cb -0.19 -2.59 -0.09 0.00 0.00 0.00 0.00 36.38 33.51 1sb3 s VAL 347 CO 0.06 0.54 1.21 -0.31 0.00 0.00 0.00 175.10 176.60 1sb3 s TYR 348 N -0.11 3.35 0.06 5.22 2.02 -0.18 -0.49 117.35 127.22 1sb3 s TYR 348 Ca 0.02 1.49 0.01 0.00 -0.37 0.00 0.00 57.07 58.21 1sb3 s TYR 348 Cb -0.13 -3.47 -0.03 0.00 -0.40 0.00 0.00 41.96 37.92 1sb3 s TYR 348 CO 0.03 -1.26 -0.05 0.95 -1.57 0.00 0.00 175.55 173.65 1sb3 s THR 349 N -0.71 0.41 -1.30 -0.71 -4.23 -0.68 -4.79 115.64 103.62 1sb3 s THR 349 Ca 0.49 -1.56 -0.08 0.00 -1.18 0.00 0.00 61.69 59.36 1sb3 s THR 349 Cb -0.35 -1.19 -0.06 0.00 1.34 0.00 0.00 72.50 72.24 1sb3 s THR 349 CO 0.43 -0.76 2.92 0.59 -0.54 0.00 0.00 174.62 177.26 1sb3 n ASN 350 N 0.57 8.07 -4.15 3.99 4.13 -0.17 -0.93 115.26 126.77 1sb3 n ASN 350 Ca -0.17 -2.71 -0.10 0.00 1.68 0.00 0.00 54.58 53.29 1sb3 n ASN 350 Cb 0.59 -1.48 -0.10 0.00 -1.54 0.00 0.00 39.78 37.24 1sb3 n ASN 350 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 1sb3 s THR 351 N 1.11 0.20 0.16 3.41 -4.23 -1.26 -4.48 115.64 110.56 1sb3 s THR 351 Ca 0.66 -1.90 -0.33 0.00 -1.18 0.00 0.00 61.69 58.94 1sb3 s THR 351 Cb 0.21 -1.96 -0.16 0.00 1.34 0.00 0.00 72.50 71.93 1sb3 s THR 351 CO -0.07 -0.57 1.11 -2.65 -0.54 0.00 0.00 174.62 171.90 1sb3 n PRO 352 N -0.07 1.01 -1.69 3.99 -0.02 -1.26 -0.43 135.00 136.53 1sb3 n PRO 352 Ca -0.07 0.36 -0.43 0.00 -2.02 0.00 0.00 63.50 61.33 1sb3 n PRO 352 Cb 0.63 -1.82 -0.01 0.00 -0.02 0.00 0.00 33.50 32.28 1sb3 n PRO 352 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1sb3 n PRO 353 N 1.65 2.08 -2.24 0.52 -0.02 -1.26 -4.32 135.00 131.41 1sb3 n PRO 353 Ca 0.15 0.73 -0.26 0.00 -2.02 0.00 0.00 63.50 62.11 1sb3 n PRO 353 Cb 0.24 -2.34 0.06 0.00 -0.02 0.00 0.00 33.50 31.44 1sb3 n PRO 353 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1sb3 n GLY 355 N -2.87 3.48 3.72 0.00 0.00 0.20 -4.51 105.19 105.22 1sb3 n GLY 355 Ca 0.08 -0.20 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 1sb3 n GLY 355 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sb3 s ALA 356 N -1.00 3.37 -0.03 4.61 0.00 -1.09 -4.48 121.76 123.14 1sb3 s ALA 356 Ca 0.00 0.07 -0.02 0.00 0.00 0.00 0.00 51.96 52.01 1sb3 s ALA 356 Cb 0.00 -2.88 0.01 0.00 0.00 0.00 0.00 23.12 20.25 1sb3 s ALA 356 CO 0.00 -0.06 0.07 1.41 0.00 0.00 0.00 175.76 177.19 1sb3 s MET 357 N 0.66 0.07 0.00 0.00 0.00 -1.26 -3.57 119.30 115.20 1sb3 s MET 357 Ca 0.35 0.14 0.00 0.00 0.00 0.00 0.00 55.69 56.18 1sb3 s MET 357 Cb -0.17 -0.03 0.00 0.00 0.00 0.00 0.00 34.83 34.63 1sb3 s MET 357 CO 0.17 -0.05 0.00 -2.13 0.00 0.00 0.00 175.02 173.01 1sb3 n ARG 358 N 3.34 0.00 -0.19 4.11 0.63 -0.35 0.22 116.66 124.41 1sb3 n ARG 358 Ca -0.16 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.77 1sb3 n ARG 358 Cb 0.57 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.48 1sb3 n ARG 358 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1sb3 n GLY 359 N 0.00 0.89 0.00 5.14 0.00 -1.26 -4.93 105.19 105.03 1sb3 n GLY 359 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1sb3 n GLY 359 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1sb3 n HIS 360 N -2.19 0.00 -0.00 1.61 -0.00 0.13 -1.49 115.22 113.28 1sb3 n HIS 360 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 1sb3 n HIS 360 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 1sb3 n HIS 360 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1sb3 n GLY 361 N 0.00 1.57 0.00 1.57 0.00 -1.26 -4.77 105.19 102.30 1sb3 n GLY 361 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 1sb3 n GLY 361 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1sb3 n THR 362 N -2.00 0.00 0.26 2.61 -2.24 -0.56 -2.94 114.28 109.42 1sb3 n THR 362 Ca 0.00 -0.17 -0.16 0.00 -2.27 0.00 0.00 64.05 61.45 1sb3 n THR 362 Cb 0.00 0.72 -0.08 0.00 -2.10 0.00 0.00 70.33 68.87 1sb3 n THR 362 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1sb3 h VAL 363 N 0.00 0.54 -0.15 2.28 2.07 -1.86 -2.43 116.25 116.70 1sb3 h VAL 363 Ca 0.00 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.37 1sb3 h VAL 363 Cb 0.58 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 1sb3 h VAL 363 CO 0.00 0.02 0.03 0.44 0.02 0.00 0.00 177.57 178.09 1sb3 h ASP 364 N -0.70 0.24 -0.07 0.57 3.45 -1.93 -1.08 116.42 116.89 1sb3 h ASP 364 Ca -0.06 -0.24 -0.06 0.00 0.43 0.00 0.00 57.03 57.09 1sb3 h ASP 364 Cb 0.52 -0.06 -0.01 0.00 -0.56 0.00 0.00 39.33 39.21 1sb3 h ASP 364 CO 0.11 0.42 -0.12 0.71 -1.57 0.00 0.00 179.24 178.78 1sb3 h THR 365 N 0.05 1.21 -0.38 0.35 1.35 -1.84 -1.35 112.91 112.30 1sb3 h THR 365 Ca 0.05 -0.91 -0.03 0.00 -0.55 0.00 0.00 66.41 64.96 1sb3 h THR 365 Cb 0.28 1.17 -0.02 0.00 -1.73 0.00 0.00 68.15 67.85 1sb3 h THR 365 CO 0.00 0.29 0.10 -0.09 -0.25 0.00 0.00 175.52 175.58 1sb3 h ARG 366 N 0.36 0.60 -0.53 4.72 9.65 -1.22 -0.95 114.38 127.01 1sb3 h ARG 366 Ca 0.07 -0.14 -0.01 0.00 -1.10 0.00 0.00 59.98 58.80 1sb3 h ARG 366 Cb 0.43 -0.08 -0.03 0.00 -1.39 0.00 0.00 29.97 28.91 1sb3 h ARG 366 CO 0.02 0.63 0.31 0.00 2.80 0.00 0.00 179.97 183.73 1sb3 h ALA 367 N 0.95 0.68 0.11 2.80 0.00 -0.83 -0.60 119.26 122.37 1sb3 h ALA 367 Ca 0.12 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1sb3 h ALA 367 Cb 0.29 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1sb3 h ALA 367 CO -0.00 0.18 -0.08 0.00 0.00 0.00 0.00 179.25 179.35 1sb3 h ALA 368 N 1.14 -0.18 -0.18 0.00 0.00 -1.06 -1.21 119.26 117.77 1sb3 h ALA 368 Ca 0.19 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.10 1sb3 h ALA 368 Cb 0.01 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1sb3 h ALA 368 CO -0.03 -0.61 0.01 0.35 0.00 0.00 0.00 179.25 178.96 1sb3 h PHE 369 N -0.20 0.00 -0.80 0.00 3.57 -1.03 -1.71 116.94 116.77 1sb3 h PHE 369 Ca -0.00 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.51 1sb3 h PHE 369 Cb 0.18 0.03 -0.04 0.00 2.79 0.00 0.00 35.95 38.91 1sb3 h PHE 369 CO -0.10 -0.02 0.49 0.93 -2.23 0.00 0.00 178.31 177.38 1sb3 h GLU 370 N 0.07 1.09 -0.19 1.11 4.39 -0.97 -0.99 114.58 119.09 1sb3 h GLU 370 Ca 0.09 -0.10 -0.02 0.00 0.34 0.00 0.00 59.36 59.67 1sb3 h GLU 370 Cb 0.10 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 28.51 1sb3 h GLU 370 CO -0.14 0.77 0.05 0.00 -1.16 0.00 0.00 179.01 178.52 1sb3 h ALA 371 N 1.26 0.25 -0.54 3.43 0.00 -1.01 -2.13 119.26 120.52 1sb3 h ALA 371 Ca 0.29 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 1sb3 h ALA 371 Cb -0.04 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1sb3 h ALA 371 CO -0.05 -0.11 -0.05 1.25 0.00 0.00 0.00 179.25 180.29 1sb3 h LEU 372 N 0.13 0.95 -0.74 0.00 5.85 -1.18 -0.51 115.31 119.80 1sb3 h LEU 372 Ca 0.06 -0.28 0.01 0.00 0.84 0.00 0.00 57.88 58.52 1sb3 h LEU 372 Cb 0.26 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 1sb3 h LEU 372 CO 0.00 1.03 0.49 0.25 -0.34 0.00 0.00 178.44 179.87 1sb3 h LEU 373 N 0.87 0.84 -0.23 2.25 5.85 -1.12 0.61 115.31 124.39 1sb3 h LEU 373 Ca 0.15 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 1sb3 h LEU 373 Cb 0.58 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 1sb3 h LEU 373 CO 0.03 0.61 0.05 0.74 -0.34 0.00 0.00 178.44 179.53 1sb3 h THR 374 N 1.00 1.22 -0.79 1.05 2.02 -1.04 -0.59 112.91 115.77 1sb3 h THR 374 Ca 0.28 -0.72 0.00 0.00 0.77 0.00 0.00 66.41 66.74 1sb3 h THR 374 Cb -0.10 1.26 -0.04 0.00 -1.74 0.00 0.00 68.15 67.53 1sb3 h THR 374 CO -0.07 0.23 0.50 -0.08 0.37 0.00 0.00 175.52 176.47 1sb3 h GLU 375 N 0.19 1.06 -0.36 6.66 4.81 -0.57 -1.81 114.58 124.56 1sb3 h GLU 375 Ca 0.07 -0.08 -0.13 0.00 -0.13 0.00 0.00 59.36 59.09 1sb3 h GLU 375 Cb 0.30 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 1sb3 h GLU 375 CO 0.00 0.73 -0.29 0.52 -0.73 0.00 0.00 179.01 179.24 1sb3 h MET 376 N 1.08 0.75 0.00 1.92 2.86 -0.80 -2.45 114.93 118.29 1sb3 h MET 376 Ca 0.29 -0.33 -0.02 0.00 -2.06 0.00 0.00 59.70 57.57 1sb3 h MET 376 Cb -0.08 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 31.56 1sb3 h MET 376 CO -0.06 0.95 -0.09 0.78 1.06 0.00 0.00 176.91 179.55 1sb3 h GLY 377 N 0.96 0.00 1.08 8.32 0.00 -0.48 -1.67 103.07 111.27 1sb3 h GLY 377 Ca 0.08 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.22 1sb3 h GLY 377 CO 0.07 0.00 -0.64 -2.09 0.00 0.00 0.00 176.54 173.87 1sb3 h GLU 378 N 0.00 0.73 0.00 4.80 4.81 -0.89 0.46 114.58 124.49 1sb3 h GLU 378 Ca -0.00 -0.56 -0.02 0.00 -0.13 0.00 0.00 59.36 58.65 1sb3 h GLU 378 Cb 0.19 0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.67 1sb3 h GLU 378 CO 0.01 1.18 -0.08 1.49 -0.73 0.00 0.00 179.01 180.88 1sb3 h GLU 379 N 0.43 0.00 -0.02 1.92 4.81 -1.00 -0.90 114.58 119.83 1sb3 h GLU 379 Ca -0.03 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1sb3 h GLU 379 Cb 1.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.65 1sb3 h GLU 379 CO 0.14 0.08 -0.01 1.28 -0.73 0.00 0.00 179.01 179.76 1sb3 n LEU 380 N -4.39 1.62 -0.25 1.64 4.77 -0.74 -4.93 117.00 114.72 1sb3 n LEU 380 Ca -0.03 -0.54 -0.03 0.00 -0.03 0.00 0.00 56.01 55.38 1sb3 n LEU 380 Cb 0.16 -0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.23 1sb3 n LEU 380 CO 0.34 0.27 -0.03 0.61 -1.33 0.00 0.00 177.39 177.25 1sb3 n GLY 381 N 1.20 0.63 3.81 -0.72 0.00 -0.34 -5.02 105.19 104.75 1sb3 n GLY 381 Ca 0.18 -0.52 -0.36 0.00 0.00 0.00 0.00 46.02 45.32 1sb3 n GLY 381 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1sb3 s ILE 382 N -2.03 5.42 0.35 -0.61 1.01 0.16 -5.00 121.20 120.50 1sb3 s ILE 382 Ca 0.00 0.29 -0.28 0.00 0.00 0.00 0.00 60.65 60.65 1sb3 s ILE 382 Cb 0.00 -3.47 -0.11 0.00 0.01 0.00 0.00 42.46 38.89 1sb3 s ILE 382 CO 0.00 0.53 1.46 -0.62 0.00 0.00 0.00 174.94 176.31 1sb3 s ASP 383 N -0.42 6.45 0.39 3.58 2.15 -1.26 -3.99 116.67 123.57 1sb3 s ASP 383 Ca 0.13 2.95 0.06 0.00 0.43 0.00 0.00 52.55 56.12 1sb3 s ASP 383 Cb -0.12 -2.66 0.78 0.00 -0.30 0.00 0.00 42.92 40.62 1sb3 s ASP 383 CO 0.03 -0.80 2.00 0.77 -0.17 0.00 0.00 175.17 177.00 1sb3 h SER 384 N 3.37 0.47 -0.08 -0.34 4.64 -1.91 0.22 113.55 119.92 1sb3 h SER 384 Ca -0.50 -0.04 -0.23 0.00 -0.47 0.00 0.00 61.79 60.56 1sb3 h SER 384 Cb 1.23 -0.12 0.01 0.00 -0.31 0.00 0.00 62.40 63.21 1sb3 h SER 384 CO 0.67 0.41 -0.81 0.25 -0.87 0.00 0.00 176.83 176.47 1sb3 h LEU 385 N 0.53 0.89 -0.35 5.97 6.46 -1.94 -3.21 115.31 123.67 1sb3 h LEU 385 Ca 0.14 -0.60 -0.03 0.00 -0.12 0.00 0.00 57.88 57.26 1sb3 h LEU 385 Cb 0.06 -0.27 -0.01 0.00 -0.73 0.00 0.00 40.66 39.71 1sb3 h LEU 385 CO -0.02 1.40 0.09 0.50 -0.62 0.00 0.00 178.44 179.79 1sb3 h LYS 386 N 0.50 0.56 0.00 1.25 1.63 -1.75 -2.18 116.57 116.58 1sb3 h LYS 386 Ca -0.06 -0.13 -0.00 0.00 -0.85 0.00 0.00 60.65 59.61 1sb3 h LYS 386 Cb 1.44 -0.07 -0.00 0.00 -0.60 0.00 0.00 32.23 32.99 1sb3 h LYS 386 CO 0.16 0.61 -0.01 0.97 -3.45 0.00 0.00 179.45 177.73 1sb3 h ILE 387 N 0.41 0.15 0.12 2.00 2.10 -0.63 -0.05 117.51 121.61 1sb3 h ILE 387 Ca 0.11 -0.06 -0.23 0.00 1.08 0.00 0.00 64.86 65.76 1sb3 h ILE 387 Cb 0.30 1.05 0.01 0.00 -1.09 0.00 0.00 36.82 37.08 1sb3 h ILE 387 CO 0.00 0.01 -1.10 0.03 -1.08 0.00 0.00 178.15 176.01 1sb3 h ARG 388 N 0.00 0.25 -0.69 2.19 3.08 -1.49 -3.15 114.38 114.57 1sb3 h ARG 388 Ca -0.00 -0.42 0.13 0.00 0.07 0.00 0.00 59.98 59.76 1sb3 h ARG 388 Cb 0.05 0.16 -0.04 0.00 0.08 0.00 0.00 29.97 30.21 1sb3 h ARG 388 CO 0.00 1.20 0.46 1.96 -1.07 0.00 0.00 179.97 182.52 1sb3 h GLN 389 N -0.39 0.37 -0.03 0.04 4.20 -0.55 -1.29 115.11 117.46 1sb3 h GLN 389 Ca -0.23 -0.02 -0.09 0.00 0.06 0.00 0.00 58.65 58.37 1sb3 h GLN 389 Cb 1.66 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 29.35 1sb3 h GLN 389 CO 0.08 0.25 -0.41 0.82 -0.67 0.00 0.00 178.83 178.90 1sb3 h ILE 390 N 0.38 1.30 -0.70 2.54 2.04 -1.11 -3.25 117.51 118.72 1sb3 h ILE 390 Ca 0.33 -1.44 0.00 0.00 1.00 0.00 0.00 64.86 64.75 1sb3 h ILE 390 Cb 0.75 1.74 0.00 0.00 -0.74 0.00 0.00 36.82 38.57 1sb3 h ILE 390 CO -0.09 0.42 0.00 0.59 0.00 0.00 0.00 178.15 179.06 1sb3 n ASN 391 N -4.04 3.93 -4.69 1.72 3.02 -0.50 -4.94 115.26 109.75 1sb3 n ASN 391 Ca -0.02 -2.00 -0.33 0.00 -0.03 0.00 0.00 54.58 52.21 1sb3 n ASN 391 Cb 0.45 -0.47 0.14 0.00 -0.61 0.00 0.00 39.78 39.29 1sb3 n ASN 391 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1sb3 s MET 392 N -1.06 1.49 0.16 3.52 -1.94 -1.16 -0.80 119.30 119.51 1sb3 s MET 392 Ca 0.48 1.66 -0.33 0.00 -1.71 0.00 0.00 55.69 55.79 1sb3 s MET 392 Cb 0.26 -1.77 -0.13 0.00 2.01 0.00 0.00 34.83 35.20 1sb3 s MET 392 CO 0.34 -2.30 1.66 1.28 -0.01 0.00 0.00 175.02 175.98 1sb3 n LEU 393 N -3.58 3.44 -0.21 -0.03 4.77 -1.26 -4.34 117.00 115.79 1sb3 n LEU 393 Ca 0.13 1.06 -0.05 0.00 -0.03 0.00 0.00 56.01 57.12 1sb3 n LEU 393 Cb 0.51 -1.47 0.06 0.00 -2.33 0.00 0.00 43.42 40.19 1sb3 n LEU 393 CO 0.49 -0.11 1.11 1.55 -1.33 0.00 0.00 177.39 179.10 1sb3 h PRO 394 N 6.57 0.73 -4.07 3.23 0.13 -1.97 -3.46 132.00 133.17 1sb3 h PRO 394 Ca -0.45 -0.04 -0.11 0.00 -0.87 0.00 0.00 66.00 64.53 1sb3 h PRO 394 Cb 1.24 -0.17 -0.14 0.00 0.13 0.00 0.00 31.00 32.06 1sb3 h PRO 394 CO 0.92 0.49 -0.54 1.14 -0.23 0.00 0.00 178.00 179.77 1sb3 s GLN 395 N -6.13 0.74 -0.03 0.86 0.00 -1.26 -5.16 119.66 108.68 1sb3 s GLN 395 Ca -0.13 -1.13 0.02 0.00 -0.00 0.00 0.00 55.36 54.12 1sb3 s GLN 395 Cb 0.14 0.27 0.01 0.00 0.00 0.00 0.00 33.01 33.43 1sb3 s GLN 395 CO 0.76 -0.19 -0.08 0.42 0.00 0.00 0.00 175.29 176.19 1sb3 s ILE 396 N -3.91 0.77 0.75 3.63 -1.09 -1.26 -3.89 121.20 116.21 1sb3 s ILE 396 Ca 0.08 -0.33 -0.14 0.00 -2.23 0.00 0.00 60.65 58.03 1sb3 s ILE 396 Cb 0.07 -0.70 0.05 0.00 -1.58 0.00 0.00 42.46 40.30 1sb3 s ILE 396 CO -0.09 0.25 1.18 -2.16 -1.23 0.00 0.00 174.94 172.89 1sb3 s PRO 397 N 0.38 2.04 -0.07 2.79 0.04 -1.26 -5.08 135.00 133.84 1sb3 s PRO 397 Ca -0.06 1.65 -0.01 0.00 0.04 0.00 0.00 61.00 62.62 1sb3 s PRO 397 Cb -0.10 -1.83 0.03 0.00 0.04 0.00 0.00 34.50 32.63 1sb3 s PRO 397 CO 0.01 -1.89 -0.01 -0.47 0.04 0.00 0.00 177.00 174.69 1sb3 s TYR 398 N -2.18 0.72 -0.34 0.56 5.04 -0.72 -5.00 117.35 115.42 1sb3 s TYR 398 Ca 0.71 -0.20 -0.15 0.00 -2.44 0.00 0.00 57.07 54.99 1sb3 s TYR 398 Cb -0.26 -0.81 -0.01 0.00 0.35 0.00 0.00 41.96 41.22 1sb3 s TYR 398 CO 0.47 -0.33 0.36 0.08 -1.34 0.00 0.00 175.55 174.79 1sb3 s VAL 399 N 1.87 5.17 0.92 3.14 1.01 -1.26 -1.38 120.40 129.88 1sb3 s VAL 399 Ca 0.04 0.08 -0.12 0.00 0.00 0.00 0.00 61.98 61.97 1sb3 s VAL 399 Cb -0.12 -3.80 0.15 0.00 0.00 0.00 0.00 36.38 32.60 1sb3 s VAL 399 CO -0.05 -0.07 1.12 0.42 0.00 0.00 0.00 175.10 176.52 1sb3 s THR 400 N 2.01 2.19 -0.43 3.92 -4.23 -0.43 -4.90 115.64 113.78 1sb3 s THR 400 Ca 0.12 0.06 0.26 0.00 -1.18 0.00 0.00 61.69 60.94 1sb3 s THR 400 Cb -0.16 -2.72 0.28 0.00 1.34 0.00 0.00 72.50 71.24 1sb3 s THR 400 CO 0.11 -0.08 1.76 0.24 -0.54 0.00 0.00 174.62 176.12 1sb3 h MET 401 N -1.58 0.00 -0.01 3.99 2.86 -1.95 -1.27 114.93 116.98 1sb3 h MET 401 Ca -0.51 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.13 1sb3 h MET 401 Cb 1.32 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.98 1sb3 h MET 401 CO 0.60 0.00 -0.10 0.98 1.06 0.00 0.00 176.91 179.45 1sb3 n TYR 402 N -2.40 0.00 -0.84 -0.22 4.19 -1.26 -4.92 117.16 111.71 1sb3 n TYR 402 Ca 0.02 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.23 1sb3 n TYR 402 Cb 0.28 -0.09 0.00 0.00 0.49 0.00 0.00 39.34 40.02 1sb3 n TYR 402 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1sb3 n ALA 403 N -0.55 0.00 -1.98 2.98 0.00 -0.48 -4.64 120.51 115.84 1sb3 n ALA 403 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.22 1sb3 n ALA 403 Cb 0.30 -0.33 -0.06 0.00 0.00 0.00 0.00 19.45 19.35 1sb3 n ALA 403 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1sb3 s GLN 404 N -1.36 4.50 -0.46 0.00 -0.21 -1.26 -4.40 119.66 116.46 1sb3 s GLN 404 Ca 0.00 1.11 -0.07 0.00 0.02 0.00 0.00 55.36 56.43 1sb3 s GLN 404 Cb 0.00 -3.11 0.12 0.00 1.00 0.00 0.00 33.01 31.02 1sb3 s GLN 404 CO 0.00 0.49 0.30 1.03 -2.12 0.00 0.00 175.29 174.99 1sb3 s ARG 405 N -1.48 2.31 -0.48 2.91 0.52 -1.26 -1.31 118.95 120.16 1sb3 s ARG 405 Ca 0.40 -1.82 -0.28 0.00 -0.52 0.00 0.00 55.73 53.51 1sb3 s ARG 405 Cb -0.21 -3.80 0.03 0.00 0.52 0.00 0.00 34.95 31.49 1sb3 s ARG 405 CO 0.25 -1.15 1.07 0.08 0.02 0.00 0.00 175.30 175.56 1sb3 s VAL 406 N 1.21 4.29 -1.30 3.52 1.01 -0.48 -4.74 120.40 123.92 1sb3 s VAL 406 Ca 0.07 1.02 0.20 0.00 0.00 0.00 0.00 61.98 63.28 1sb3 s VAL 406 Cb -0.25 -4.56 -0.14 0.00 0.00 0.00 0.00 36.38 31.44 1sb3 s VAL 406 CO -0.02 -0.98 0.91 0.23 0.00 0.00 0.00 175.10 175.24 1sb3 n MET 407 N 7.65 0.83 -3.71 2.72 0.00 -1.26 -1.76 117.12 121.58 1sb3 n MET 407 Ca 0.10 -0.37 -0.14 0.00 0.00 0.00 0.00 57.70 57.29 1sb3 n MET 407 Cb 0.49 -1.43 -0.09 0.00 0.00 0.00 0.00 33.22 32.19 1sb3 n MET 407 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 1sb3 s SER 408 N -2.65 -0.38 -0.29 7.83 1.04 -1.26 -4.66 113.70 113.32 1sb3 s SER 408 Ca 0.11 0.55 0.00 0.00 0.48 0.00 0.00 55.95 57.10 1sb3 s SER 408 Cb 0.16 0.62 0.18 0.00 0.10 0.00 0.00 66.02 67.08 1sb3 s SER 408 CO 0.70 -0.33 0.53 -0.47 0.98 0.00 0.00 173.24 174.65 1sb3 s TYR 409 N -0.57 -1.44 -1.38 5.02 5.04 -1.26 -4.79 117.35 117.96 1sb3 s TYR 409 Ca -0.07 1.28 0.19 0.00 -2.44 0.00 0.00 57.07 56.03 1sb3 s TYR 409 Cb -0.03 0.34 0.62 0.00 0.35 0.00 0.00 41.96 43.24 1sb3 s TYR 409 CO 0.03 -0.90 1.53 0.41 -1.34 0.00 0.00 175.55 175.29 1sb3 n GLY 410 N 5.41 2.72 0.28 8.97 0.00 -1.26 -4.63 105.19 116.69 1sb3 n GLY 410 Ca -0.00 -0.77 0.06 0.00 0.00 0.00 0.00 46.02 45.31 1sb3 n GLY 410 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1sb3 h VAL 411 N 3.75 0.63 -0.12 1.61 2.07 -1.96 -0.35 116.25 121.87 1sb3 h VAL 411 Ca 0.00 -0.15 0.04 0.00 0.82 0.00 0.00 66.70 67.42 1sb3 h VAL 411 Cb 1.16 0.16 -0.05 0.00 -1.52 0.00 0.00 31.29 31.04 1sb3 h VAL 411 CO 0.10 0.08 -0.19 -0.65 0.02 0.00 0.00 177.57 176.93 1sb3 h PRO 412 N 0.43 -0.24 -0.64 1.57 0.11 -2.00 0.06 132.00 131.29 1sb3 h PRO 412 Ca 0.43 0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.50 1sb3 h PRO 412 Cb 0.68 0.05 -0.03 0.00 0.11 0.00 0.00 31.00 31.81 1sb3 h PRO 412 CO -0.43 -0.16 0.16 1.49 -0.21 0.00 0.00 178.00 178.86 1sb3 h GLU 413 N -0.25 1.01 -0.18 1.05 4.81 -1.77 -2.14 114.58 117.11 1sb3 h GLU 413 Ca 0.10 -0.24 0.05 0.00 -0.13 0.00 0.00 59.36 59.14 1sb3 h GLU 413 Cb 0.39 -0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.58 1sb3 h GLU 413 CO -0.27 0.91 -0.16 0.00 -0.73 0.00 0.00 179.01 178.77 1sb3 h LEU 415 N -0.17 0.09 -0.91 0.00 3.38 -0.84 -1.37 115.31 115.49 1sb3 h LEU 415 Ca 0.11 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1sb3 h LEU 415 Cb 0.34 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.04 1sb3 h LEU 415 CO -0.28 0.07 0.55 -0.33 0.09 0.00 0.00 178.44 178.54 1sb3 h GLU 416 N 0.14 1.24 -0.15 1.13 4.39 -1.07 0.15 114.58 120.41 1sb3 h GLU 416 Ca 0.06 -0.11 -0.01 0.00 0.34 0.00 0.00 59.36 59.64 1sb3 h GLU 416 Cb 0.02 -0.26 -0.01 0.00 -0.10 0.00 0.00 28.75 28.40 1sb3 h GLU 416 CO -0.05 0.87 0.06 -0.22 -1.16 0.00 0.00 179.01 178.51 1sb3 h LYS 417 N 1.26 0.22 0.00 2.33 1.63 -0.32 -1.40 116.57 120.29 1sb3 h LYS 417 Ca 0.33 -0.04 -0.07 0.00 -0.85 0.00 0.00 60.65 60.02 1sb3 h LYS 417 Cb -0.05 -0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 31.53 1sb3 h LYS 417 CO -0.06 0.31 -0.33 -0.39 -3.45 0.00 0.00 179.45 175.53 1sb3 h VAL 418 N 0.09 0.70 0.02 2.00 -1.51 -1.12 -0.03 116.25 116.40 1sb3 h VAL 418 Ca 0.05 -1.50 -0.00 0.00 -1.23 0.00 0.00 66.70 64.01 1sb3 h VAL 418 Cb 0.17 1.99 0.00 0.00 -2.13 0.00 0.00 31.29 31.32 1sb3 h VAL 418 CO -0.00 0.32 -0.01 0.50 -1.23 0.00 0.00 177.57 177.15 1sb3 h LYS 419 N 0.00 -0.03 0.04 5.19 3.64 -0.73 -2.11 116.57 122.57 1sb3 h LYS 419 Ca -0.00 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1sb3 h LYS 419 Cb 0.96 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.79 1sb3 h LYS 419 CO 0.04 0.24 -0.02 0.00 -2.27 0.00 0.00 179.45 177.44 1sb3 h ALA 420 N 0.68 -0.05 -0.65 5.00 0.00 -1.15 -1.76 119.26 121.32 1sb3 h ALA 420 Ca -0.00 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 54.78 1sb3 h ALA 420 Cb 0.28 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 1sb3 h ALA 420 CO 0.00 -0.35 0.43 0.00 0.00 0.00 0.00 179.25 179.33 1sb3 h ALA 421 N 0.53 1.72 -0.00 0.00 0.00 -1.05 -1.77 119.26 118.70 1sb3 h ALA 421 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1sb3 h ALA 421 Cb 0.37 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1sb3 h ALA 421 CO 0.01 0.18 -0.30 -1.13 0.00 0.00 0.00 179.25 178.02 1sb3 n SER 422 N -4.47 0.53 -2.40 0.00 3.41 -0.80 -4.92 113.62 104.98 1sb3 n SER 422 Ca 0.09 -0.34 -0.17 0.00 -0.26 0.00 0.00 58.87 58.19 1sb3 n SER 422 Cb 0.20 0.05 0.03 0.00 -0.26 0.00 0.00 64.21 64.23 1sb3 n SER 422 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1sb3 n GLY 423 N 1.42 -0.20 0.39 5.00 0.00 -0.66 -4.89 105.19 106.24 1sb3 n GLY 423 Ca 0.09 -0.08 -0.11 0.00 0.00 0.00 0.00 46.02 45.92 1sb3 n GLY 423 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1sb3 h TRP 424 N -1.23 -1.17 -0.46 1.61 2.91 -1.58 -1.05 115.95 114.98 1sb3 h TRP 424 Ca -0.40 0.06 0.07 0.00 1.13 0.00 0.00 58.89 59.74 1sb3 h TRP 424 Cb 1.27 0.55 -0.09 0.00 -0.51 0.00 0.00 29.16 30.38 1sb3 h TRP 424 CO 0.39 -0.45 -0.46 0.93 -1.03 0.00 0.00 178.44 177.82 1sb3 h GLU 425 N -0.41 -0.30 0.00 2.65 4.39 -1.92 0.58 114.58 119.58 1sb3 h GLU 425 Ca 0.11 0.02 -0.06 0.00 0.34 0.00 0.00 59.36 59.76 1sb3 h GLU 425 Cb 0.60 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.31 1sb3 h GLU 425 CO -0.47 -0.20 -0.31 0.93 -1.16 0.00 0.00 179.01 177.80 1sb3 h GLU 426 N -0.31 0.00 0.00 2.33 3.07 -1.92 -3.37 114.58 114.38 1sb3 h GLU 426 Ca 0.14 0.00 -0.21 0.00 -0.50 0.00 0.00 59.36 58.78 1sb3 h GLU 426 Cb 0.58 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.45 1sb3 h GLU 426 CO -0.61 0.31 -1.81 0.54 -1.40 0.00 0.00 179.01 176.04 1sb3 n ARG 427 N -3.61 1.85 -1.67 2.33 1.74 -0.41 -4.79 116.66 112.10 1sb3 n ARG 427 Ca -0.01 0.01 -0.46 0.00 -0.77 0.00 0.00 57.85 56.62 1sb3 n ARG 427 Cb 0.43 -1.30 -0.04 0.00 -1.02 0.00 0.00 32.46 30.53 1sb3 n ARG 427 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1sb3 n LYS 428 N -2.50 2.48 -0.75 5.56 3.00 0.20 -0.56 118.16 125.58 1sb3 n LYS 428 Ca -0.20 0.91 0.00 0.00 -0.00 0.00 0.00 58.31 59.02 1sb3 n LYS 428 Cb 0.86 -2.80 0.00 0.00 0.00 0.00 0.00 35.03 33.09 1sb3 n LYS 428 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1sb3 n GLY 429 N 4.48 0.79 2.62 3.14 0.00 -1.26 -4.91 105.19 110.04 1sb3 n GLY 429 Ca 0.22 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.14 1sb3 n GLY 429 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1sb3 n LYS 430 N -2.27 1.98 -3.96 1.61 5.02 0.28 -5.09 118.16 115.74 1sb3 n LYS 430 Ca 0.00 -3.63 -0.22 0.00 -2.02 0.00 0.00 58.31 52.44 1sb3 n LYS 430 Cb 0.00 -1.65 -0.05 0.00 -0.02 0.00 0.00 35.03 33.32 1sb3 n LYS 430 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1sb3 s LEU 431 N -3.51 3.54 0.91 -0.35 1.43 -1.24 -4.90 118.68 114.55 1sb3 s LEU 431 Ca 0.33 -0.52 -0.11 0.00 -1.03 0.00 0.00 54.13 52.80 1sb3 s LEU 431 Cb 0.39 -2.10 0.13 0.00 0.03 0.00 0.00 46.19 44.64 1sb3 s LEU 431 CO -0.02 -0.27 1.08 -2.65 0.23 0.00 0.00 176.35 174.73 1sb3 n PRO 432 N -1.26 -0.38 -1.67 1.29 -0.02 -1.26 -4.88 135.00 126.82 1sb3 n PRO 432 Ca -0.03 -0.04 -0.46 0.00 -2.02 0.00 0.00 63.50 60.94 1sb3 n PRO 432 Cb 0.60 -2.34 -0.04 0.00 -0.02 0.00 0.00 33.50 31.70 1sb3 n PRO 432 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1sb3 n LYS 433 N -3.91 2.13 -0.19 -0.52 3.00 -1.26 -2.35 118.16 115.06 1sb3 n LYS 433 Ca 0.12 0.76 0.00 0.00 -0.00 0.00 0.00 58.31 59.19 1sb3 n LYS 433 Cb 0.52 -2.51 0.00 0.00 0.00 0.00 0.00 35.03 33.04 1sb3 n LYS 433 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1sb3 n GLY 434 N 3.09 0.78 3.51 3.14 0.00 -1.11 -5.02 105.19 109.58 1sb3 n GLY 434 Ca 0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 1sb3 n GLY 434 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1sb3 s ARG 435 N -0.68 1.82 0.21 1.61 0.52 -0.99 -1.11 118.95 120.33 1sb3 s ARG 435 Ca 0.00 -1.44 -0.15 0.00 -0.52 0.00 0.00 55.73 53.62 1sb3 s ARG 435 Cb 0.00 -1.99 0.01 0.00 0.52 0.00 0.00 34.95 33.49 1sb3 s ARG 435 CO 0.00 0.40 0.49 0.20 0.02 0.00 0.00 175.30 176.41 1sb3 s GLY 436 N -2.91 0.15 -0.00 -3.53 0.00 0.15 -3.63 107.32 97.55 1sb3 s GLY 436 Ca 0.24 -0.49 0.04 0.00 0.00 0.00 0.00 44.72 44.51 1sb3 s GLY 436 CO 0.13 -0.42 -0.13 1.08 0.00 0.00 0.00 173.10 173.76 1sb3 s LEU 437 N -2.93 2.05 0.07 0.66 1.43 -1.26 -1.91 118.68 116.79 1sb3 s LEU 437 Ca 0.14 -0.27 0.01 0.00 -1.03 0.00 0.00 54.13 52.98 1sb3 s LEU 437 Cb -0.01 -0.64 -0.03 0.00 0.03 0.00 0.00 46.19 45.54 1sb3 s LEU 437 CO 0.01 0.13 -0.06 -0.83 0.23 0.00 0.00 176.35 175.83 1sb3 s GLY 438 N -0.46 0.60 0.03 -3.19 0.00 -0.54 -3.79 107.32 99.97 1sb3 s GLY 438 Ca 0.04 -1.07 0.05 0.00 0.00 0.00 0.00 44.72 43.74 1sb3 s GLY 438 CO -0.00 -1.16 -0.14 -1.50 0.00 0.00 0.00 173.10 170.30 1sb3 s ILE 439 N -2.72 1.13 0.06 0.90 1.10 -1.26 -1.03 121.20 119.37 1sb3 s ILE 439 Ca 0.02 -0.96 -0.22 0.00 -0.51 0.00 0.00 60.65 58.97 1sb3 s ILE 439 Cb -0.01 -1.01 0.05 0.00 0.15 0.00 0.00 42.46 41.64 1sb3 s ILE 439 CO -0.03 0.04 0.52 0.00 -2.11 0.00 0.00 174.94 173.36 1sb3 s ALA 440 N -0.79 -1.32 0.21 1.50 0.00 -0.79 -4.33 121.76 116.24 1sb3 s ALA 440 Ca 0.02 0.55 0.11 0.00 0.00 0.00 0.00 51.96 52.64 1sb3 s ALA 440 Cb -0.08 0.42 -0.04 0.00 0.00 0.00 0.00 23.12 23.42 1sb3 s ALA 440 CO 0.01 -0.53 -0.19 -0.51 0.00 0.00 0.00 175.76 174.55 1sb3 s LEU 441 N -2.05 2.63 0.18 0.00 1.43 -1.26 -1.50 118.68 118.11 1sb3 s LEU 441 Ca -0.05 -0.81 -0.22 0.00 -1.03 0.00 0.00 54.13 52.02 1sb3 s LEU 441 Cb -0.01 -1.31 0.06 0.00 0.03 0.00 0.00 46.19 44.97 1sb3 s LEU 441 CO -0.03 0.10 0.62 -0.94 0.23 0.00 0.00 176.35 176.33 1sb3 s SER 442 N -2.88 -0.50 0.22 2.29 1.04 -0.67 -4.50 113.70 108.69 1sb3 s SER 442 Ca 0.24 -0.12 -0.17 0.00 0.48 0.00 0.00 55.95 56.37 1sb3 s SER 442 Cb -0.08 0.62 0.02 0.00 0.10 0.00 0.00 66.02 66.68 1sb3 s SER 442 CO 0.12 -1.04 0.55 -1.38 0.98 0.00 0.00 173.24 172.47 1sb3 s HIS 443 N -3.78 -0.02 0.16 5.02 -3.43 -1.13 -0.84 115.29 111.27 1sb3 s HIS 443 Ca 0.03 -0.35 -0.17 0.00 -0.80 0.00 0.00 55.06 53.77 1sb3 s HIS 443 Cb -0.02 0.40 0.03 0.00 -1.43 0.00 0.00 32.58 31.56 1sb3 s HIS 443 CO -0.09 -0.99 0.46 0.12 -2.00 0.00 0.00 174.74 172.24 1sb3 s PHE 444 N -3.92 -0.18 0.73 0.38 5.36 -0.81 -4.68 117.98 114.86 1sb3 s PHE 444 Ca 0.13 -0.14 -0.11 0.00 -0.96 0.00 0.00 56.93 55.84 1sb3 s PHE 444 Cb -0.02 0.32 0.03 0.00 -0.34 0.00 0.00 43.02 43.01 1sb3 s PHE 444 CO 0.02 -0.79 1.08 0.14 -1.46 0.00 0.00 175.22 174.20 1sb3 s VAL 445 N -3.83 3.57 -0.73 3.12 -7.23 -1.26 -0.99 120.40 113.05 1sb3 s VAL 445 Ca 0.06 0.55 0.02 0.00 -1.81 0.00 0.00 61.98 60.79 1sb3 s VAL 445 Cb 0.01 -3.12 0.36 0.00 0.56 0.00 0.00 36.38 34.19 1sb3 s VAL 445 CO -0.08 -0.63 1.50 -1.20 -0.31 0.00 0.00 175.10 174.37 1sb3 n SER 446 N -3.20 6.08 0.00 4.85 7.64 -0.50 -4.64 113.62 123.84 1sb3 n SER 446 Ca 0.09 -3.74 0.00 0.00 1.01 0.00 0.00 58.87 56.23 1sb3 n SER 446 Cb 0.53 -0.82 0.00 0.00 -1.01 0.00 0.00 64.21 62.91 1sb3 n SER 446 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1sb3 n GLY 447 N -0.33 2.04 3.65 0.23 0.00 0.12 -4.45 105.19 106.45 1sb3 n GLY 447 Ca 0.43 -1.41 -0.43 0.00 0.00 0.00 0.00 46.02 44.61 1sb3 n GLY 447 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1sb3 s THR 448 N -0.16 4.06 -1.76 2.61 2.01 -1.26 -4.20 115.64 116.94 1sb3 s THR 448 Ca 0.00 1.26 0.15 0.00 0.31 0.00 0.00 61.69 63.41 1sb3 s THR 448 Cb 0.00 -3.87 0.35 0.00 0.01 0.00 0.00 72.50 68.99 1sb3 s THR 448 CO 0.00 -0.17 1.33 -1.54 -0.69 0.00 0.00 174.62 173.55 1sb3 n SER 449 N 7.01 0.00 -4.10 3.53 3.41 -0.90 -4.58 113.62 117.98 1sb3 n SER 449 Ca 0.15 -0.23 -0.31 0.00 -0.26 0.00 0.00 58.87 58.22 1sb3 n SER 449 Cb 0.45 -0.12 -0.16 0.00 -0.26 0.00 0.00 64.21 64.11 1sb3 n SER 449 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1sb3 s THR 450 N -2.24 1.83 0.67 6.66 2.01 -1.26 -4.73 115.64 118.57 1sb3 s THR 450 Ca 0.18 -0.82 -0.16 0.00 0.31 0.00 0.00 61.69 61.20 1sb3 s THR 450 Cb 0.10 -1.65 0.01 0.00 0.01 0.00 0.00 72.50 70.97 1sb3 s THR 450 CO 0.19 0.50 1.19 -2.84 -0.69 0.00 0.00 174.62 172.97 1sb3 s PRO 451 N 1.06 2.54 0.37 4.92 0.02 -1.26 -4.90 135.00 137.75 1sb3 s PRO 451 Ca -0.03 1.72 0.13 0.00 0.02 0.00 0.00 61.00 62.84 1sb3 s PRO 451 Cb -0.14 -1.89 0.73 0.00 0.02 0.00 0.00 34.50 33.21 1sb3 s PRO 451 CO -0.05 -1.52 1.82 0.87 -0.33 0.00 0.00 177.00 177.79 1sb3 h LYS 452 N 0.16 0.00 -5.15 5.54 1.57 -1.97 -3.41 116.57 113.32 1sb3 h LYS 452 Ca -0.48 0.00 -0.65 0.00 -1.87 0.00 0.00 60.65 57.65 1sb3 h LYS 452 Cb 1.29 0.00 -0.25 0.00 0.08 0.00 0.00 32.23 33.35 1sb3 h LYS 452 CO 0.52 0.38 -0.70 -1.01 -0.57 0.00 0.00 179.45 178.07 1sb3 s HIS 453 N -4.14 2.97 -0.69 -1.35 3.76 -1.26 -4.78 115.29 109.81 1sb3 s HIS 453 Ca -0.03 -0.61 -0.24 0.00 -0.15 0.00 0.00 55.06 54.03 1sb3 s HIS 453 Cb 0.14 -2.03 0.05 0.00 1.11 0.00 0.00 32.58 31.86 1sb3 s HIS 453 CO 0.72 -0.29 1.08 -0.46 -0.85 0.00 0.00 174.74 174.94 1sb3 s TRP 454 N 0.93 2.53 -0.06 1.40 -0.11 -1.26 -4.71 118.94 117.65 1sb3 s TRP 454 Ca -0.00 -0.35 0.01 0.00 1.22 0.00 0.00 56.10 56.97 1sb3 s TRP 454 Cb -0.15 -4.42 0.00 0.00 -1.50 0.00 0.00 33.47 27.41 1sb3 s TRP 454 CO 0.01 -1.80 0.46 0.25 -4.62 0.00 0.00 176.95 171.24 1sb3 n THR 455 N 6.10 0.00 -1.32 5.86 -2.24 -1.26 -5.00 114.28 116.42 1sb3 n THR 455 Ca -0.01 -0.50 -0.11 0.00 -2.27 0.00 0.00 64.05 61.16 1sb3 n THR 455 Cb 0.47 1.01 -0.05 0.00 -2.10 0.00 0.00 70.33 69.66 1sb3 n THR 455 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1sb3 n GLY 456 N 0.15 1.21 3.94 3.38 0.00 -1.26 -5.01 105.19 107.60 1sb3 n GLY 456 Ca 0.00 -0.36 -0.24 0.00 0.00 0.00 0.00 46.02 45.41 1sb3 n GLY 456 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1sb3 s GLU 457 N -2.83 3.24 0.95 1.61 2.02 -1.26 -5.06 118.70 117.38 1sb3 s GLU 457 Ca 0.00 -0.27 -0.11 0.00 0.02 0.00 0.00 54.97 54.61 1sb3 s GLU 457 Cb 0.00 -2.52 0.17 0.00 0.10 0.00 0.00 34.13 31.87 1sb3 s GLU 457 CO 0.00 -0.20 1.11 -1.25 0.02 0.00 0.00 175.26 174.94 1sb3 s PRO 458 N -4.57 0.74 0.03 0.39 0.04 -1.26 -4.89 135.00 125.48 1sb3 s PRO 458 Ca 0.47 1.27 0.27 0.00 0.04 0.00 0.00 61.00 63.04 1sb3 s PRO 458 Cb -0.10 -1.72 0.88 0.00 0.04 0.00 0.00 34.50 33.60 1sb3 s PRO 458 CO 0.39 -2.73 1.69 0.72 0.04 0.00 0.00 177.00 177.12 1sb3 n HIS 459 N -4.27 0.15 -3.63 0.56 8.25 0.10 -4.83 115.22 111.55 1sb3 n HIS 459 Ca 0.09 0.04 -0.12 0.00 -0.26 0.00 0.00 57.72 57.47 1sb3 n HIS 459 Cb 0.53 -0.48 -0.07 0.00 1.12 0.00 0.00 29.99 31.09 1sb3 n HIS 459 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1sb3 s ALA 460 N -3.03 -1.87 -0.03 -1.41 0.00 -0.95 -4.63 121.76 109.83 1sb3 s ALA 460 Ca 0.12 1.90 0.00 0.00 0.00 0.00 0.00 51.96 53.99 1sb3 s ALA 460 Cb 0.17 -1.21 0.03 0.00 0.00 0.00 0.00 23.12 22.11 1sb3 s ALA 460 CO 0.61 -0.29 -0.01 0.99 0.00 0.00 0.00 175.76 177.05 1sb3 s THR 461 N 0.16 0.27 -0.03 0.00 2.01 -1.26 -1.44 115.64 115.35 1sb3 s THR 461 Ca 0.01 0.04 0.04 0.00 0.31 0.00 0.00 61.69 62.08 1sb3 s THR 461 Cb -0.05 -0.35 -0.00 0.00 0.01 0.00 0.00 72.50 72.11 1sb3 s THR 461 CO -0.02 0.17 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.25 1sb3 s VAL 462 N 1.04 1.18 0.05 3.82 1.01 0.13 -4.61 120.40 123.01 1sb3 s VAL 462 Ca -0.09 -0.60 0.05 0.00 0.00 0.00 0.00 61.98 61.34 1sb3 s VAL 462 Cb -0.14 -1.01 -0.04 0.00 0.00 0.00 0.00 36.38 35.20 1sb3 s VAL 462 CO -0.01 0.34 -0.09 0.20 0.00 0.00 0.00 175.10 175.54 1sb3 s ASN 463 N -0.05 4.48 0.04 3.32 0.01 -0.81 -0.42 114.94 121.51 1sb3 s ASN 463 Ca -0.00 -0.26 0.06 0.00 -0.71 0.00 0.00 52.86 51.95 1sb3 s ASN 463 Cb -0.09 -0.95 -0.02 0.00 0.41 0.00 0.00 41.25 40.60 1sb3 s ASN 463 CO 0.01 0.24 -0.17 -0.76 -1.51 0.00 0.00 177.10 174.91 1sb3 s LEU 464 N -1.75 2.17 -0.04 0.60 1.43 -0.54 -0.53 118.68 120.02 1sb3 s LEU 464 Ca 0.19 -0.48 0.02 0.00 -1.03 0.00 0.00 54.13 52.84 1sb3 s LEU 464 Cb -0.11 -0.75 0.01 0.00 0.03 0.00 0.00 46.19 45.36 1sb3 s LEU 464 CO 0.10 0.09 -0.10 -0.75 0.23 0.00 0.00 176.35 175.91 1sb3 s LYS 465 N -1.13 1.27 -0.05 1.70 2.20 -0.30 -1.34 119.74 122.09 1sb3 s LYS 465 Ca 0.04 -0.35 -0.01 0.00 -0.36 0.00 0.00 55.97 55.28 1sb3 s LYS 465 Cb -0.08 -1.13 0.03 0.00 -1.51 0.00 0.00 37.83 35.14 1sb3 s LYS 465 CO 0.01 0.08 0.03 -1.17 -0.36 0.00 0.00 175.35 173.94 1sb3 s LEU 466 N 0.40 0.44 0.00 5.43 2.96 0.71 -1.21 118.68 127.40 1sb3 s LEU 466 Ca -0.08 -0.00 0.00 0.00 -0.22 0.00 0.00 54.13 53.83 1sb3 s LEU 466 Cb -0.12 -0.28 -0.00 0.00 0.50 0.00 0.00 46.19 46.29 1sb3 s LEU 466 CO 0.02 -0.21 0.02 -0.67 -1.32 0.00 0.00 176.35 174.18 1sb3 n ASP 467 N 5.12 2.37 -0.36 3.68 4.64 -1.26 -0.12 116.55 130.62 1sb3 n ASP 467 Ca -0.07 -2.12 0.36 0.00 -1.38 0.00 0.00 54.79 51.58 1sb3 n ASP 467 Cb 0.50 0.25 0.75 0.00 -1.04 0.00 0.00 41.12 41.58 1sb3 n ASP 467 CO 0.00 0.00 0.00 2.19 -0.82 0.00 0.00 177.20 178.57 1sb3 h PHE 468 N 1.18 0.04 0.00 -0.67 -5.15 -1.94 -1.71 116.94 108.70 1sb3 h PHE 468 Ca -0.20 0.00 -0.03 0.00 -0.20 0.00 0.00 57.97 57.54 1sb3 h PHE 468 Cb 0.64 -0.01 -0.00 0.00 0.22 0.00 0.00 35.95 36.79 1sb3 h PHE 468 CO 0.00 -0.00 -0.13 0.38 -2.00 0.00 0.00 178.31 176.56 1sb3 h ASP 469 N 0.02 0.00 0.00 -0.68 3.04 -1.98 -3.46 116.42 113.36 1sb3 h ASP 469 Ca 0.60 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.39 1sb3 h ASP 469 Cb 2.38 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 40.67 1sb3 h ASP 469 CO -0.03 0.13 0.00 0.61 -2.04 0.00 0.00 179.24 177.91 1sb3 n GLY 470 N 0.09 0.64 3.72 7.15 0.00 -0.64 -5.05 105.19 111.11 1sb3 n GLY 470 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 1sb3 n GLY 470 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1sb3 s GLY 471 N -1.88 2.84 -0.18 -0.02 0.00 -1.26 -4.97 107.32 101.85 1sb3 s GLY 471 Ca 0.00 0.40 -0.12 0.00 0.00 0.00 0.00 44.72 45.00 1sb3 s GLY 471 CO 0.00 1.38 0.20 -0.42 0.00 0.00 0.00 173.10 174.27 1sb3 s ILE 472 N 0.49 5.37 -0.18 0.90 1.01 -0.44 -4.26 121.20 124.08 1sb3 s ILE 472 Ca 0.44 0.35 -0.05 0.00 0.00 0.00 0.00 60.65 61.40 1sb3 s ILE 472 Cb -0.21 -3.54 -0.03 0.00 0.01 0.00 0.00 42.46 38.70 1sb3 s ILE 472 CO 0.25 0.43 -0.00 -0.89 0.00 0.00 0.00 174.94 174.72 1sb3 s THR 473 N 0.32 4.03 -0.23 2.92 2.01 -0.35 -0.73 115.64 123.61 1sb3 s THR 473 Ca 0.12 -0.30 -0.06 0.00 0.31 0.00 0.00 61.69 61.76 1sb3 s THR 473 Cb -0.12 -2.80 -0.03 0.00 0.01 0.00 0.00 72.50 69.56 1sb3 s THR 473 CO 0.01 0.45 0.04 -0.22 -0.69 0.00 0.00 174.62 174.21 1sb3 s LEU 474 N 0.73 3.38 -0.26 4.42 0.20 0.76 -1.14 118.68 126.76 1sb3 s LEU 474 Ca -0.00 -0.19 -0.06 0.00 0.69 0.00 0.00 54.13 54.57 1sb3 s LEU 474 Cb -0.14 -1.88 -0.01 0.00 -0.43 0.00 0.00 46.19 43.73 1sb3 s LEU 474 CO 0.02 0.02 0.04 -0.76 -0.29 0.00 0.00 176.35 175.37 1sb3 s LEU 475 N 1.30 3.42 0.03 -0.68 1.02 0.31 -0.97 118.68 123.11 1sb3 s LEU 475 Ca 0.04 -0.46 0.04 0.00 0.02 0.00 0.00 54.13 53.78 1sb3 s LEU 475 Cb -0.15 -1.85 -0.02 0.00 0.02 0.00 0.00 46.19 44.20 1sb3 s LEU 475 CO 0.02 -0.09 -0.12 0.28 0.02 0.00 0.00 176.35 176.47 1sb3 s THR 476 N 1.53 0.93 -1.89 5.49 -1.32 -0.84 -1.92 115.64 117.63 1sb3 s THR 476 Ca 0.05 -0.87 0.30 0.00 -1.21 0.00 0.00 61.69 59.95 1sb3 s THR 476 Cb -0.16 -0.85 0.59 0.00 -1.51 0.00 0.00 72.50 70.57 1sb3 s THR 476 CO 0.01 -0.01 1.94 0.61 -2.21 0.00 0.00 174.62 174.96 1sb3 n GLY 477 N 2.05 -0.80 3.77 6.08 0.00 -0.66 -1.47 105.19 114.17 1sb3 n GLY 477 Ca -0.18 -0.28 -0.40 0.00 0.00 0.00 0.00 46.02 45.17 1sb3 n GLY 477 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sb3 s ALA 478 N -2.27 3.37 -0.33 4.61 0.00 -1.26 -4.08 121.76 121.81 1sb3 s ALA 478 Ca 0.35 1.37 -0.15 0.00 0.00 0.00 0.00 51.96 53.53 1sb3 s ALA 478 Cb 0.21 -3.54 -0.02 0.00 0.00 0.00 0.00 23.12 19.77 1sb3 s ALA 478 CO 0.42 -0.92 0.37 0.00 0.00 0.00 0.00 175.76 175.64 1sb3 s ALA 479 N -1.19 3.51 -0.25 0.00 0.00 -1.26 -4.05 121.76 118.51 1sb3 s ALA 479 Ca 0.55 -1.10 -0.21 0.00 0.00 0.00 0.00 51.96 51.20 1sb3 s ALA 479 Cb -0.41 -2.81 -0.02 0.00 0.00 0.00 0.00 23.12 19.88 1sb3 s ALA 479 CO 0.54 -0.98 0.65 0.34 0.00 0.00 0.00 175.76 176.32 1sb3 s ASP 480 N 1.72 6.61 -0.10 0.00 -1.08 -1.26 -4.77 116.67 117.79 1sb3 s ASP 480 Ca 0.13 0.75 0.14 0.00 -0.52 0.00 0.00 52.55 53.05 1sb3 s ASP 480 Cb -0.16 -2.35 0.30 0.00 -1.46 0.00 0.00 42.92 39.25 1sb3 s ASP 480 CO 0.11 -0.39 1.21 2.30 0.52 0.00 0.00 175.17 178.93 1sb3 n ILE 481 N 5.18 1.73 0.00 4.11 -5.35 -1.26 -4.49 119.36 119.28 1sb3 n ILE 481 Ca 0.00 -1.78 0.00 0.00 -0.27 0.00 0.00 62.75 60.70 1sb3 n ILE 481 Cb 0.49 -0.02 0.00 0.00 -1.74 0.00 0.00 39.64 38.37 1sb3 n ILE 481 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1sb3 n GLY 482 N -0.78 1.28 0.17 3.28 0.00 -1.26 -3.21 105.19 104.66 1sb3 n GLY 482 Ca 0.14 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.22 1sb3 n GLY 482 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1sb3 h GLN 483 N 1.33 0.00 0.00 1.61 -0.00 -1.93 -3.48 115.11 112.64 1sb3 h GLN 483 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1sb3 h GLN 483 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.48 1sb3 h GLN 483 CO 0.00 0.34 0.00 0.41 -0.00 0.00 0.00 178.83 179.58 1sb3 n GLY 484 N 1.13 1.40 0.35 0.06 0.00 -1.26 -4.99 105.19 101.88 1sb3 n GLY 484 Ca 0.02 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.14 1sb3 n GLY 484 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1sb3 h SER 485 N 0.00 0.47 -0.31 1.61 4.64 -1.93 0.84 113.55 118.87 1sb3 h SER 485 Ca 0.00 0.01 -0.04 0.00 -0.47 0.00 0.00 61.79 61.29 1sb3 h SER 485 Cb 0.00 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 61.98 1sb3 h SER 485 CO 0.00 0.29 0.09 0.78 -0.87 0.00 0.00 176.83 177.12 1sb3 h ASN 486 N 0.53 0.53 0.00 4.97 2.35 -1.93 -0.33 115.58 121.70 1sb3 h ASN 486 Ca 0.29 -0.08 -0.02 0.00 -0.55 0.00 0.00 56.30 55.94 1sb3 h ASN 486 Cb 0.43 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.66 1sb3 h ASN 486 CO -0.09 0.54 -0.07 0.74 -1.65 0.00 0.00 177.43 176.91 1sb3 h THR 487 N 0.57 1.62 -0.38 2.81 2.02 -1.43 -2.91 112.91 115.20 1sb3 h THR 487 Ca 0.13 -1.90 0.08 0.00 0.77 0.00 0.00 66.41 65.49 1sb3 h THR 487 Cb 0.23 2.88 -0.09 0.00 -1.74 0.00 0.00 68.15 69.44 1sb3 h THR 487 CO -0.00 0.50 -0.27 -0.03 0.37 0.00 0.00 175.52 176.09 1sb3 h MET 488 N -0.72 -0.20 -0.61 6.66 1.85 -0.74 0.11 114.93 121.27 1sb3 h MET 488 Ca -0.01 0.01 -0.01 0.00 -0.61 0.00 0.00 59.70 59.09 1sb3 h MET 488 Cb 0.86 0.05 -0.03 0.00 0.43 0.00 0.00 31.60 32.90 1sb3 h MET 488 CO 0.01 -0.13 0.35 0.00 -0.40 0.00 0.00 176.91 176.74 1sb3 h ALA 489 N 0.91 1.46 -0.21 0.39 0.00 -1.15 -2.32 119.26 118.34 1sb3 h ALA 489 Ca 0.18 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1sb3 h ALA 489 Cb 0.50 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1sb3 h ALA 489 CO -0.50 0.46 0.00 0.77 0.00 0.00 0.00 179.25 179.98 1sb3 h SER 490 N 0.85 0.37 -0.12 0.00 0.02 -1.01 -2.51 113.55 111.14 1sb3 h SER 490 Ca 0.22 -0.31 0.03 0.00 -0.84 0.00 0.00 61.79 60.90 1sb3 h SER 490 Cb 0.00 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 62.41 1sb3 h SER 490 CO -0.04 0.58 -0.08 1.56 -1.14 0.00 0.00 176.83 177.71 1sb3 h GLN 491 N 0.14 -0.09 -0.16 3.45 4.20 -0.43 0.73 115.11 122.96 1sb3 h GLN 491 Ca 0.06 0.01 -0.14 0.00 0.06 0.00 0.00 58.65 58.63 1sb3 h GLN 491 Cb 0.39 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.18 1sb3 h GLN 491 CO 0.01 -0.06 -0.51 -0.39 -0.67 0.00 0.00 178.83 177.22 1sb3 h VAL 492 N -0.09 1.33 -0.30 -0.54 -1.51 -1.46 -1.42 116.25 112.26 1sb3 h VAL 492 Ca 0.08 -1.75 -0.12 0.00 -1.23 0.00 0.00 66.70 63.67 1sb3 h VAL 492 Cb 0.20 1.76 -0.00 0.00 -2.13 0.00 0.00 31.29 31.12 1sb3 h VAL 492 CO -0.18 0.53 -0.30 0.00 -1.23 0.00 0.00 177.57 176.39 1sb3 h ALA 493 N 1.11 0.44 -0.73 5.19 0.00 -1.29 -2.45 119.26 121.52 1sb3 h ALA 493 Ca 0.01 -0.41 -0.06 0.00 0.00 0.00 0.00 54.91 54.45 1sb3 h ALA 493 Cb 1.01 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 1sb3 h ALA 493 CO 0.09 0.46 0.21 0.00 0.00 0.00 0.00 179.25 180.01 1sb3 h ALA 494 N 0.71 1.00 0.13 0.00 0.00 -0.74 -2.08 119.26 118.27 1sb3 h ALA 494 Ca 0.05 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.73 1sb3 h ALA 494 Cb 0.88 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1sb3 h ALA 494 CO 0.07 0.66 -0.14 1.49 0.00 0.00 0.00 179.25 181.34 1sb3 h GLU 495 N 1.09 -0.29 -0.76 0.00 4.57 -1.22 0.30 114.58 118.28 1sb3 h GLU 495 Ca 0.23 0.02 0.05 0.00 -1.18 0.00 0.00 59.36 58.48 1sb3 h GLU 495 Cb 0.33 0.06 -0.05 0.00 -0.16 0.00 0.00 28.75 28.93 1sb3 h GLU 495 CO -0.00 -0.19 0.46 0.28 -1.18 0.00 0.00 179.01 178.38 1sb3 h VAL 496 N -0.30 1.05 -0.00 0.32 2.07 -1.31 -2.47 116.25 115.61 1sb3 h VAL 496 Ca 0.01 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1sb3 h VAL 496 Cb 0.29 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.16 1sb3 h VAL 496 CO -0.04 0.16 -0.02 0.18 0.02 0.00 0.00 177.57 177.87 1sb3 n LEU 497 N -4.67 0.02 -0.84 2.57 4.77 -0.80 -4.91 117.00 113.15 1sb3 n LEU 497 Ca 0.10 0.45 -0.10 0.00 -0.03 0.00 0.00 56.01 56.42 1sb3 n LEU 497 Cb 0.14 -0.46 -0.04 0.00 -2.33 0.00 0.00 43.42 40.73 1sb3 n LEU 497 CO 0.31 0.01 -0.10 0.61 -1.33 0.00 0.00 177.39 176.89 1sb3 n GLY 498 N 1.47 0.93 3.92 -0.72 0.00 0.97 -4.86 105.19 106.90 1sb3 n GLY 498 Ca 0.08 -0.55 -0.21 0.00 0.00 0.00 0.00 46.02 45.33 1sb3 n GLY 498 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1sb3 s VAL 499 N -2.40 2.37 0.37 1.61 -7.23 -0.62 -1.69 120.40 112.81 1sb3 s VAL 499 Ca 0.00 -1.28 -0.18 0.00 -1.81 0.00 0.00 61.98 58.71 1sb3 s VAL 499 Cb 0.00 -2.66 -0.10 0.00 0.56 0.00 0.00 36.38 34.18 1sb3 s VAL 499 CO 0.00 0.00 0.84 -0.13 -0.31 0.00 0.00 175.10 175.50 1sb3 s ARG 500 N -4.28 4.12 0.28 4.82 0.52 -1.26 -4.56 118.95 118.58 1sb3 s ARG 500 Ca 0.48 0.89 0.02 0.00 -0.52 0.00 0.00 55.73 56.59 1sb3 s ARG 500 Cb -0.04 -2.33 0.65 0.00 0.52 0.00 0.00 34.95 33.75 1sb3 s ARG 500 CO 0.29 0.07 1.71 1.25 0.02 0.00 0.00 175.30 178.64 1sb3 h LEU 501 N 2.12 0.34 -1.57 2.53 5.85 -1.94 -0.65 115.31 122.00 1sb3 h LEU 501 Ca -0.48 0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.37 1sb3 h LEU 501 Cb 1.18 0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.32 1sb3 h LEU 501 CO 0.63 0.05 0.00 0.77 -0.34 0.00 0.00 178.44 179.55 1sb3 h SER 502 N 0.44 0.00 0.59 1.25 4.64 -1.98 -1.49 113.55 116.99 1sb3 h SER 502 Ca 0.52 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.84 1sb3 h SER 502 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 1sb3 h SER 502 CO -0.49 0.00 -0.06 -1.14 -0.87 0.00 0.00 176.83 174.27 1sb3 n ARG 503 N -2.33 0.40 -3.96 4.77 0.63 -0.25 -4.78 116.66 111.14 1sb3 n ARG 503 Ca -0.02 -0.07 -0.35 0.00 -0.92 0.00 0.00 57.85 56.50 1sb3 n ARG 503 Cb 0.04 -1.50 -0.12 0.00 0.45 0.00 0.00 32.46 31.33 1sb3 n ARG 503 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1sb3 s ILE 504 N -2.65 4.25 -0.24 5.15 1.01 -0.56 -1.33 121.20 126.82 1sb3 s ILE 504 Ca 0.25 -0.21 -0.08 0.00 0.00 0.00 0.00 60.65 60.61 1sb3 s ILE 504 Cb 0.20 -2.94 -0.04 0.00 0.01 0.00 0.00 42.46 39.69 1sb3 s ILE 504 CO 0.49 0.40 0.10 -0.13 0.00 0.00 0.00 174.94 175.81 1sb3 s ARG 505 N 1.09 3.85 -0.20 2.79 0.52 0.09 -4.96 118.95 122.12 1sb3 s ARG 505 Ca 0.03 -0.38 -0.12 0.00 -0.52 0.00 0.00 55.73 54.74 1sb3 s ARG 505 Cb -0.14 -3.39 -0.05 0.00 0.52 0.00 0.00 34.95 31.89 1sb3 s ARG 505 CO 0.02 -0.03 0.21 0.08 0.02 0.00 0.00 175.30 175.60 1sb3 s VAL 506 N 1.24 5.34 -0.16 3.52 1.01 -1.26 -0.17 120.40 129.92 1sb3 s VAL 506 Ca 0.06 0.33 -0.02 0.00 0.00 0.00 0.00 61.98 62.35 1sb3 s VAL 506 Cb -0.14 -3.55 -0.01 0.00 0.00 0.00 0.00 36.38 32.67 1sb3 s VAL 506 CO 0.05 0.37 -0.09 -0.63 0.00 0.00 0.00 175.10 174.80 1sb3 s ILE 507 N 0.73 3.31 0.03 2.22 -1.09 -0.14 -4.95 121.20 121.31 1sb3 s ILE 507 Ca 0.11 -0.55 -0.02 0.00 -2.23 0.00 0.00 60.65 57.96 1sb3 s ILE 507 Cb -0.13 -2.44 -0.02 0.00 -1.58 0.00 0.00 42.46 38.29 1sb3 s ILE 507 CO 0.03 0.49 -0.00 -0.94 -1.23 0.00 0.00 174.94 173.28 1sb3 s SER 508 N 0.70 0.30 -1.19 3.58 1.04 -1.26 -1.99 113.70 114.89 1sb3 s SER 508 Ca -0.04 -0.66 -0.15 0.00 0.48 0.00 0.00 55.95 55.58 1sb3 s SER 508 Cb -0.15 0.16 -0.01 0.00 0.10 0.00 0.00 66.02 66.12 1sb3 s SER 508 CO 0.02 -0.44 0.73 0.00 0.98 0.00 0.00 173.24 174.53 1sb3 n ALA 509 N 0.95 -2.41 -3.54 5.32 0.00 -0.54 -4.80 120.51 115.49 1sb3 n ALA 509 Ca -0.20 -0.22 -0.25 0.00 0.00 0.00 0.00 53.44 52.77 1sb3 n ALA 509 Cb 0.58 -3.59 -0.15 0.00 0.00 0.00 0.00 19.45 16.29 1sb3 n ALA 509 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1sb3 s ASP 510 N -3.69 2.59 0.62 0.00 -1.08 -1.26 -1.47 116.67 112.37 1sb3 s ASP 510 Ca 0.35 -0.83 0.28 0.00 -0.52 0.00 0.00 52.55 51.83 1sb3 s ASP 510 Cb -0.12 -0.11 1.45 0.00 -1.46 0.00 0.00 42.92 42.68 1sb3 s ASP 510 CO 0.86 -0.39 1.85 0.77 0.52 0.00 0.00 175.17 178.78 1sb3 h SER 511 N 8.38 0.00 1.58 -0.34 4.64 -1.55 0.95 113.55 127.22 1sb3 h SER 511 Ca -0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 1sb3 h SER 511 Cb 1.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 1sb3 h SER 511 CO 0.35 0.00 -0.26 0.00 -0.87 0.00 0.00 176.83 176.05 1sb3 h ALA 512 N 1.32 0.86 0.00 5.18 0.00 -1.94 -3.39 119.26 121.29 1sb3 h ALA 512 Ca 0.13 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 1sb3 h ALA 512 Cb 1.07 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1sb3 h ALA 512 CO -0.00 0.00 -1.24 1.28 0.00 0.00 0.00 179.25 179.29 1sb3 n LEU 513 N -2.75 1.19 -4.84 0.00 4.77 0.11 -5.07 117.00 110.41 1sb3 n LEU 513 Ca 0.03 -0.01 -0.31 0.00 -0.03 0.00 0.00 56.01 55.70 1sb3 n LEU 513 Cb 0.50 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 41.53 1sb3 n LEU 513 CO 0.35 0.28 -0.22 0.42 -1.33 0.00 0.00 177.39 176.89 1sb3 s THR 514 N -2.08 4.90 0.40 -5.08 -4.23 0.04 -4.98 115.64 104.61 1sb3 s THR 514 Ca -0.03 -0.59 -0.26 0.00 -1.18 0.00 0.00 61.69 59.62 1sb3 s THR 514 Cb 0.01 -3.37 -0.09 0.00 1.34 0.00 0.00 72.50 70.40 1sb3 s THR 514 CO 0.12 0.14 1.31 -2.16 -0.54 0.00 0.00 174.62 173.50 1sb3 s PRO 515 N -2.41 3.98 0.41 3.99 0.04 -1.26 -4.67 135.00 135.08 1sb3 s PRO 515 Ca 0.31 2.18 -0.26 0.00 0.04 0.00 0.00 61.00 63.27 1sb3 s PRO 515 Cb -0.13 -2.77 -0.10 0.00 0.04 0.00 0.00 34.50 31.54 1sb3 s PRO 515 CO 0.24 -0.49 1.33 1.17 0.04 0.00 0.00 177.00 179.29 1sb3 n LYS 516 N 0.16 2.11 -4.52 4.56 0.00 -1.26 -1.65 118.16 117.55 1sb3 n LYS 516 Ca 0.03 0.75 -0.22 0.00 0.00 0.00 0.00 58.31 58.87 1sb3 n LYS 516 Cb 0.43 -2.46 -0.14 0.00 0.00 0.00 0.00 35.03 32.87 1sb3 n LYS 516 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 1sb3 s ASP 517 N -0.44 1.87 0.44 3.14 -1.08 -1.26 -4.45 116.67 114.89 1sb3 s ASP 517 Ca 0.59 -0.41 0.30 0.00 -0.52 0.00 0.00 52.55 52.51 1sb3 s ASP 517 Cb -0.50 -0.16 1.40 0.00 -1.46 0.00 0.00 42.92 42.20 1sb3 s ASP 517 CO 0.59 0.11 1.91 0.78 0.52 0.00 0.00 175.17 179.08 1sb3 h ASN 518 N 5.18 0.00 -4.84 -0.34 2.35 -1.92 -3.41 115.58 112.60 1sb3 h ASN 518 Ca -0.38 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.37 1sb3 h ASN 518 Cb 1.17 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.54 1sb3 h ASN 518 CO 0.45 0.00 0.00 0.61 -1.65 0.00 0.00 177.43 176.84 1sb3 n GLY 519 N -0.39 3.44 3.43 2.83 0.00 -1.26 -4.78 105.19 108.45 1sb3 n GLY 519 Ca 0.00 -1.90 -0.44 0.00 0.00 0.00 0.00 46.02 43.68 1sb3 n GLY 519 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1sb3 s SER 520 N 0.00 7.00 0.07 1.61 0.01 -0.70 -4.73 113.70 116.95 1sb3 s SER 520 Ca 0.00 -2.87 -0.09 0.00 1.31 0.00 0.00 55.95 54.29 1sb3 s SER 520 Cb 0.00 -2.35 0.00 0.00 0.21 0.00 0.00 66.02 63.88 1sb3 s SER 520 CO 0.00 -0.72 0.20 -0.72 0.41 0.00 0.00 173.24 172.42 1sb3 s TYR 521 N 1.17 0.09 -1.40 2.43 -0.85 -1.26 -4.89 117.35 112.64 1sb3 s TYR 521 Ca 0.36 -0.42 0.00 0.00 -0.52 0.00 0.00 57.07 56.49 1sb3 s TYR 521 Cb -0.05 -0.03 0.00 0.00 0.38 0.00 0.00 41.96 42.26 1sb3 s TYR 521 CO -0.04 -0.50 0.00 -1.13 -1.52 0.00 0.00 175.55 172.36 1sb3 n SER 522 N 0.28 -3.84 -3.79 -0.18 3.41 -1.26 -2.40 113.62 105.83 1sb3 n SER 522 Ca -0.17 0.29 -0.25 0.00 -0.26 0.00 0.00 58.87 58.49 1sb3 n SER 522 Cb 0.61 -3.47 0.03 0.00 -0.26 0.00 0.00 64.21 61.12 1sb3 n SER 522 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1sb3 n SER 523 N -0.93 -2.55 0.03 4.04 7.64 -1.26 0.16 113.62 120.74 1sb3 n SER 523 Ca -0.15 -0.81 0.11 0.00 1.01 0.00 0.00 58.87 59.04 1sb3 n SER 523 Cb 0.50 -3.96 0.07 0.00 -1.01 0.00 0.00 64.21 59.82 1sb3 n SER 523 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1sb3 n ARG 524 N -4.44 0.27 0.21 1.43 1.85 -1.01 -1.95 116.66 113.02 1sb3 n ARG 524 Ca -0.17 0.02 -0.14 0.00 -1.00 0.00 0.00 57.85 56.56 1sb3 n ARG 524 Cb 0.62 -1.61 -0.08 0.00 -1.05 0.00 0.00 32.46 30.34 1sb3 n ARG 524 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 1sb3 h VAL 525 N 0.00 0.58 -0.30 8.89 2.07 -1.85 -1.56 116.25 124.08 1sb3 h VAL 525 Ca 0.00 -0.43 0.05 0.00 0.82 0.00 0.00 66.70 67.15 1sb3 h VAL 525 Cb 0.72 0.77 -0.05 0.00 -1.52 0.00 0.00 31.29 31.22 1sb3 h VAL 525 CO 0.00 0.08 -0.00 0.74 0.02 0.00 0.00 177.57 178.40 1sb3 h THR 526 N -0.79 0.78 0.39 2.57 2.02 -1.96 0.69 112.91 116.61 1sb3 h THR 526 Ca -0.05 -0.03 -0.02 0.00 0.77 0.00 0.00 66.41 67.08 1sb3 h THR 526 Cb 0.53 0.69 0.00 0.00 -1.74 0.00 0.00 68.15 67.63 1sb3 h THR 526 CO 0.09 0.02 -0.19 0.15 0.37 0.00 0.00 175.52 175.96 1sb3 h PHE 527 N 0.09 -0.48 0.00 3.16 3.57 -1.83 0.20 116.94 121.64 1sb3 h PHE 527 Ca 0.14 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.63 1sb3 h PHE 527 Cb 0.19 0.16 0.00 0.00 2.79 0.00 0.00 35.95 39.09 1sb3 h PHE 527 CO -0.22 -0.28 -0.00 0.52 -2.23 0.00 0.00 178.31 176.10 1sb3 h MET 528 N -0.56 -0.00 0.00 1.11 2.86 -1.21 -2.71 114.93 114.41 1sb3 h MET 528 Ca -0.05 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.47 1sb3 h MET 528 Cb 0.42 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.07 1sb3 h MET 528 CO 0.09 0.92 -0.56 0.28 1.06 0.00 0.00 176.91 178.70 1sb3 h VAL 529 N -0.95 1.40 -0.51 -2.22 2.07 -0.99 -0.70 116.25 114.36 1sb3 h VAL 529 Ca -0.00 -1.93 -0.09 0.00 0.82 0.00 0.00 66.70 65.50 1sb3 h VAL 529 Cb 0.93 2.04 -0.02 0.00 -1.52 0.00 0.00 31.29 32.72 1sb3 h VAL 529 CO 0.00 0.55 -0.05 1.23 0.02 0.00 0.00 177.57 179.32 1sb3 h GLY 530 N 1.69 1.01 1.26 2.17 0.00 -0.84 0.78 103.07 109.13 1sb3 h GLY 530 Ca -0.01 -0.78 -0.13 0.00 0.00 0.00 0.00 47.33 46.42 1sb3 h GLY 530 CO 0.07 0.71 -0.27 3.43 0.00 0.00 0.00 176.54 180.49 1sb3 h ASN 531 N 0.79 0.87 -0.14 0.19 -0.26 -1.18 -0.75 115.58 115.10 1sb3 h ASN 531 Ca 0.14 -0.34 -0.10 0.00 -0.56 0.00 0.00 56.30 55.44 1sb3 h ASN 531 Cb 0.59 -0.24 -0.01 0.00 -1.06 0.00 0.00 38.32 37.59 1sb3 h ASN 531 CO 0.04 1.08 -0.22 0.00 -1.06 0.00 0.00 177.43 177.26 1sb3 h ALA 532 N 0.97 1.05 -0.30 -0.83 0.00 -0.90 -0.45 119.26 118.80 1sb3 h ALA 532 Ca 0.09 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.56 1sb3 h ALA 532 Cb 0.81 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1sb3 h ALA 532 CO 0.07 0.58 -0.18 1.03 0.00 0.00 0.00 179.25 180.75 1sb3 h SER 533 N 0.51 0.67 -0.44 0.00 0.87 -0.52 -0.99 113.55 113.65 1sb3 h SER 533 Ca 0.08 -0.43 0.03 0.00 -1.23 0.00 0.00 61.79 60.24 1sb3 h SER 533 Cb 0.67 -0.19 -0.03 0.00 -0.44 0.00 0.00 62.40 62.41 1sb3 h SER 533 CO 0.05 0.95 0.24 0.40 -0.53 0.00 0.00 176.83 177.94 1sb3 h ILE 534 N 0.40 1.01 -0.76 2.23 2.04 -0.88 -0.07 117.51 121.48 1sb3 h ILE 534 Ca 0.06 -0.17 0.02 0.00 1.00 0.00 0.00 64.86 65.77 1sb3 h ILE 534 Cb 0.72 0.48 -0.04 0.00 -0.74 0.00 0.00 36.82 37.24 1sb3 h ILE 534 CO 0.05 0.09 0.49 -1.28 0.00 0.00 0.00 178.15 177.50 1sb3 h SER 535 N 0.49 0.84 -0.42 1.72 0.87 -0.81 -0.51 113.55 115.73 1sb3 h SER 535 Ca 0.18 -0.01 -0.06 0.00 -1.23 0.00 0.00 61.79 60.67 1sb3 h SER 535 Cb 0.05 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 61.79 1sb3 h SER 535 CO -0.10 0.59 0.04 0.00 -0.53 0.00 0.00 176.83 176.83 1sb3 h ALA 536 N 1.30 0.57 -0.68 6.23 0.00 -0.68 -2.12 119.26 123.86 1sb3 h ALA 536 Ca 0.29 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1sb3 h ALA 536 Cb -0.06 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 1sb3 h ALA 536 CO -0.08 0.31 0.42 0.00 0.00 0.00 0.00 179.25 179.91 1sb3 h ALA 537 N 0.92 1.46 -0.59 0.00 0.00 -0.52 -1.33 119.26 119.20 1sb3 h ALA 537 Ca 0.13 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 1sb3 h ALA 537 Cb 0.42 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1sb3 h ALA 537 CO 0.01 0.48 0.06 0.93 0.00 0.00 0.00 179.25 180.73 1sb3 h GLU 538 N 0.94 1.01 -0.08 0.00 4.39 -0.74 0.16 114.58 120.26 1sb3 h GLU 538 Ca 0.25 -0.29 0.03 0.00 0.34 0.00 0.00 59.36 59.69 1sb3 h GLU 538 Cb -0.06 -0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 28.45 1sb3 h GLU 538 CO -0.05 0.97 -0.10 0.93 -1.16 0.00 0.00 179.01 179.60 1sb3 h GLU 539 N 0.91 -0.14 -0.64 2.33 4.39 -0.65 -0.90 114.58 119.88 1sb3 h GLU 539 Ca 0.18 0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.85 1sb3 h GLU 539 Cb 0.48 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.13 1sb3 h GLU 539 CO 0.02 -0.09 0.25 1.25 -1.16 0.00 0.00 179.01 179.28 1sb3 h LEU 540 N -0.14 0.88 -0.76 1.33 5.85 -1.03 -2.53 115.31 118.92 1sb3 h LEU 540 Ca 0.07 -0.17 0.05 0.00 0.84 0.00 0.00 57.88 58.67 1sb3 h LEU 540 Cb 0.24 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 40.98 1sb3 h LEU 540 CO -0.16 0.81 0.46 0.50 -0.34 0.00 0.00 178.44 179.71 1sb3 h LYS 541 N 0.90 0.83 -0.53 1.25 3.64 -0.36 -1.64 116.57 120.66 1sb3 h LYS 541 Ca 0.21 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.51 1sb3 h LYS 541 Cb 0.21 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 31.81 1sb3 h LYS 541 CO -0.02 0.55 0.20 0.78 -2.27 0.00 0.00 179.45 178.69 1sb3 h GLY 542 N 0.86 0.82 1.28 5.01 0.00 -0.76 1.00 103.07 111.28 1sb3 h GLY 542 Ca 0.33 -0.42 -0.11 0.00 0.00 0.00 0.00 47.33 47.13 1sb3 h GLY 542 CO -0.16 0.40 -0.17 -2.08 0.00 0.00 0.00 176.54 174.53 1sb3 h VAL 543 N 0.76 1.27 -0.05 4.60 2.07 -1.01 -2.45 116.25 121.44 1sb3 h VAL 543 Ca 0.18 -1.27 -0.16 0.00 0.82 0.00 0.00 66.70 66.26 1sb3 h VAL 543 Cb 0.17 1.11 0.01 0.00 -1.52 0.00 0.00 31.29 31.06 1sb3 h VAL 543 CO -0.01 0.43 -0.61 -0.07 0.02 0.00 0.00 177.57 177.33 1sb3 h LEU 544 N 0.74 0.62 -1.07 2.57 3.38 -0.93 -2.95 115.31 117.67 1sb3 h LEU 544 Ca 0.11 -0.71 -0.00 0.00 0.09 0.00 0.00 57.88 57.37 1sb3 h LEU 544 Cb 0.68 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.20 1sb3 h LEU 544 CO 0.05 1.24 0.52 0.58 0.09 0.00 0.00 178.44 180.92 1sb3 h VAL 545 N 0.06 1.23 -0.60 1.22 2.07 -0.84 0.26 116.25 119.65 1sb3 h VAL 545 Ca -0.06 -0.51 -0.03 0.00 0.82 0.00 0.00 66.70 66.92 1sb3 h VAL 545 Cb 1.29 0.02 -0.03 0.00 -1.52 0.00 0.00 31.29 31.05 1sb3 h VAL 545 CO 0.12 0.24 0.24 0.50 0.02 0.00 0.00 177.57 178.70 1sb3 h LYS 546 N 1.18 0.90 -0.38 1.57 3.64 -1.46 0.20 116.57 122.22 1sb3 h LYS 546 Ca 0.31 -0.16 -0.16 0.00 -1.27 0.00 0.00 60.65 59.37 1sb3 h LYS 546 Cb -0.06 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.61 1sb3 h LYS 546 CO -0.06 0.76 -0.40 0.00 -2.27 0.00 0.00 179.45 177.49 1sb3 h ALA 547 N 1.09 0.57 -0.55 5.00 0.00 -1.19 -1.84 119.26 122.34 1sb3 h ALA 547 Ca 0.20 -0.46 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 1sb3 h ALA 547 Cb 0.20 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1sb3 h ALA 547 CO -0.02 0.68 0.17 0.00 0.00 0.00 0.00 179.25 180.09 1sb3 h ALA 548 N 0.78 0.71 -0.54 0.00 0.00 -0.25 -1.68 119.26 118.29 1sb3 h ALA 548 Ca 0.06 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1sb3 h ALA 548 Cb 0.99 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 1sb3 h ALA 548 CO 0.10 0.37 0.33 0.00 0.00 0.00 0.00 179.25 180.05 1sb3 h ALA 549 N 1.04 0.68 -0.74 0.00 0.00 -0.52 0.13 119.26 119.86 1sb3 h ALA 549 Ca 0.18 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 1sb3 h ALA 549 Cb 0.27 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1sb3 h ALA 549 CO -0.01 0.16 0.23 -0.22 0.00 0.00 0.00 179.25 179.41 1sb3 h LYS 550 N 0.72 1.15 0.02 0.00 3.64 -1.18 0.92 116.57 121.84 1sb3 h LYS 550 Ca 0.19 -0.25 -0.20 0.00 -1.27 0.00 0.00 60.65 59.12 1sb3 h LYS 550 Cb -0.02 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.62 1sb3 h LYS 550 CO -0.04 0.99 -0.93 -0.22 -2.27 0.00 0.00 179.45 176.98 1sb3 h LYS 551 N 1.10 0.12 -0.01 1.90 3.64 -0.87 -3.13 116.57 119.32 1sb3 h LYS 551 Ca 0.24 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1sb3 h LYS 551 Cb 0.32 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 1sb3 h LYS 551 CO -0.01 0.96 -0.11 1.28 -2.27 0.00 0.00 179.45 179.30 1sb3 n LEU 552 N -3.56 0.74 -3.67 5.20 4.77 0.43 -4.92 117.00 115.98 1sb3 n LEU 552 Ca -0.03 -0.15 -0.24 0.00 -0.03 0.00 0.00 56.01 55.57 1sb3 n LEU 552 Cb 0.85 -0.12 0.06 0.00 -2.33 0.00 0.00 43.42 41.88 1sb3 n LEU 552 CO 0.48 0.13 0.13 0.47 -1.33 0.00 0.00 177.39 177.27 1sb3 n ASP 553 N -0.68 -4.26 -4.50 -1.43 8.00 0.13 -4.99 116.55 108.81 1sb3 n ASP 553 Ca 0.16 -0.67 -0.29 0.00 0.71 0.00 0.00 54.79 54.71 1sb3 n ASP 553 Cb 0.29 -4.58 -0.09 0.00 -0.02 0.00 0.00 41.12 36.72 1sb3 n ASP 553 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1sb3 s ALA 554 N -3.38 3.39 0.32 2.24 0.00 -0.10 -5.04 121.76 119.19 1sb3 s ALA 554 Ca 0.40 -1.13 -0.14 0.00 0.00 0.00 0.00 51.96 51.09 1sb3 s ALA 554 Cb -0.19 0.35 -0.09 0.00 0.00 0.00 0.00 23.12 23.20 1sb3 s ALA 554 CO 0.77 -0.17 0.72 1.03 0.00 0.00 0.00 175.76 178.11 1sb3 s ARG 555 N -3.80 3.97 0.30 0.00 0.52 -1.26 -4.50 118.95 114.17 1sb3 s ARG 555 Ca 0.19 0.61 -0.01 0.00 -0.52 0.00 0.00 55.73 56.01 1sb3 s ARG 555 Cb 0.04 -2.45 0.45 0.00 0.52 0.00 0.00 34.95 33.51 1sb3 s ARG 555 CO 0.10 0.16 1.89 0.93 0.02 0.00 0.00 175.30 178.40 1sb3 h GLU 556 N 2.22 0.89 0.00 3.54 5.08 -1.93 -2.05 114.58 122.33 1sb3 h GLU 556 Ca -0.48 -0.13 -0.02 0.00 -1.00 0.00 0.00 59.36 57.73 1sb3 h GLU 556 Cb 1.17 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 30.26 1sb3 h GLU 556 CO 0.66 0.71 -0.11 0.93 -1.00 0.00 0.00 179.01 180.20 1sb3 h GLU 557 N 0.88 0.00 0.00 2.33 3.07 -1.97 -2.55 114.58 116.33 1sb3 h GLU 557 Ca 0.21 0.00 -0.09 0.00 -0.50 0.00 0.00 59.36 58.98 1sb3 h GLU 557 Cb 0.14 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.03 1sb3 h GLU 557 CO -0.02 0.11 -0.42 -0.44 -1.40 0.00 0.00 179.01 176.83 1sb3 h ASP 558 N 0.00 0.00 -3.13 1.42 3.45 -1.76 -3.46 116.42 112.93 1sb3 h ASP 558 Ca -0.00 0.00 -0.53 0.00 0.43 0.00 0.00 57.03 56.93 1sb3 h ASP 558 Cb 0.31 0.00 0.02 0.00 -0.56 0.00 0.00 39.33 39.10 1sb3 h ASP 558 CO 0.01 0.42 0.69 -0.63 -1.57 0.00 0.00 179.24 178.17 1sb3 s ILE 559 N -3.42 3.34 -0.04 0.35 -1.09 -0.96 -0.22 121.20 119.15 1sb3 s ILE 559 Ca 0.01 1.00 0.07 0.00 -2.23 0.00 0.00 60.65 59.50 1sb3 s ILE 559 Cb 0.10 -3.64 -0.01 0.00 -1.58 0.00 0.00 42.46 37.33 1sb3 s ILE 559 CO 0.70 0.10 -0.25 -1.61 -1.23 0.00 0.00 174.94 172.66 1sb3 s GLU 560 N 0.73 2.24 -0.30 2.79 2.02 0.12 -4.90 118.70 121.40 1sb3 s GLU 560 Ca 0.62 -0.88 -0.05 0.00 0.02 0.00 0.00 54.97 54.67 1sb3 s GLU 560 Cb -0.36 -2.03 0.03 0.00 0.10 0.00 0.00 34.13 31.87 1sb3 s GLU 560 CO 0.33 0.46 0.05 0.08 0.02 0.00 0.00 175.26 176.19 1sb3 s VAL 561 N -0.37 3.56 -0.09 2.63 1.01 -1.26 -1.32 120.40 124.55 1sb3 s VAL 561 Ca 0.03 -1.00 -0.00 0.00 0.00 0.00 0.00 61.98 61.02 1sb3 s VAL 561 Cb -0.12 -2.92 0.02 0.00 0.00 0.00 0.00 36.38 33.37 1sb3 s VAL 561 CO 0.01 -0.01 -0.07 -0.63 0.00 0.00 0.00 175.10 174.41 1sb3 s ILE 562 N 1.40 0.91 -1.31 2.22 1.01 -0.63 -4.73 121.20 120.07 1sb3 s ILE 562 Ca -0.00 -0.24 -0.19 0.00 0.00 0.00 0.00 60.65 60.21 1sb3 s ILE 562 Cb -0.18 -0.93 0.02 0.00 0.01 0.00 0.00 42.46 41.38 1sb3 s ILE 562 CO 0.01 0.34 0.51 0.47 0.00 0.00 0.00 174.94 176.26 1sb3 n ASP 563 N 4.74 -2.62 -2.01 3.58 9.92 -1.23 -1.51 116.55 127.42 1sb3 n ASP 563 Ca -0.14 -1.20 -0.18 0.00 -0.53 0.00 0.00 54.79 52.73 1sb3 n ASP 563 Cb 0.50 -2.16 -0.01 0.00 -0.64 0.00 0.00 41.12 38.81 1sb3 n ASP 563 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1sb3 n GLU 564 N -4.70 -1.43 -4.79 -1.24 1.02 -0.68 -4.98 120.64 103.83 1sb3 n GLU 564 Ca -0.19 0.90 -0.26 0.00 -0.02 0.00 0.00 57.16 57.58 1sb3 n GLU 564 Cb 0.62 -5.38 -0.16 0.00 -0.02 0.00 0.00 31.44 26.49 1sb3 n GLU 564 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 1sb3 s MET 565 N -4.79 1.97 -0.30 3.49 -1.94 -0.57 -0.75 119.30 116.41 1sb3 s MET 565 Ca 0.00 -0.57 -0.10 0.00 -1.71 0.00 0.00 55.69 53.31 1sb3 s MET 565 Cb 0.00 -1.62 -0.02 0.00 2.01 0.00 0.00 34.83 35.21 1sb3 s MET 565 CO 0.00 0.14 0.16 -0.06 -0.01 0.00 0.00 175.02 175.24 1sb3 s PHE 566 N 0.37 3.18 0.20 -0.03 0.40 0.14 -1.60 117.98 120.63 1sb3 s PHE 566 Ca -0.11 -0.41 0.01 0.00 -0.60 0.00 0.00 56.93 55.82 1sb3 s PHE 566 Cb -0.15 -2.36 -0.05 0.00 0.51 0.00 0.00 43.02 40.98 1sb3 s PHE 566 CO 0.04 -0.39 0.06 0.00 0.70 0.00 0.00 175.22 175.63 1sb3 s MET 567 N 1.65 1.19 -0.06 0.44 0.23 -0.44 -0.19 119.30 122.12 1sb3 s MET 567 Ca 0.05 -1.61 -0.24 0.00 -1.03 0.00 0.00 55.69 52.87 1sb3 s MET 567 Cb -0.17 -0.12 -0.04 0.00 -1.53 0.00 0.00 34.83 32.98 1sb3 s MET 567 CO 0.07 -0.24 0.71 0.08 -2.03 0.00 0.00 175.02 173.61 1sb3 s VAL 568 N -3.82 5.04 -0.28 5.16 1.01 -1.26 0.14 120.40 126.39 1sb3 s VAL 568 Ca 0.31 1.46 -0.41 0.00 0.00 0.00 0.00 61.98 63.34 1sb3 s VAL 568 Cb 0.07 -4.05 -0.17 0.00 0.00 0.00 0.00 36.38 32.24 1sb3 s VAL 568 CO 0.08 0.25 1.67 -0.24 0.00 0.00 0.00 175.10 176.86 1sb3 n SER 569 N 3.77 2.06 -3.54 3.32 2.88 0.69 -2.37 113.62 120.42 1sb3 n SER 569 Ca -0.01 1.10 -0.17 0.00 -1.33 0.00 0.00 58.87 58.46 1sb3 n SER 569 Cb 0.51 -1.09 0.00 0.00 -0.75 0.00 0.00 64.21 62.88 1sb3 n SER 569 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1sb3 n GLY 570 N 3.96 -1.26 3.06 0.46 0.00 -1.26 -5.00 105.19 105.15 1sb3 n GLY 570 Ca 0.27 0.58 -0.08 0.00 0.00 0.00 0.00 46.02 46.79 1sb3 n GLY 570 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1sb3 s SER 571 N -2.96 0.36 0.11 1.61 0.15 -1.00 -5.05 113.70 106.93 1sb3 s SER 571 Ca 0.01 -0.77 -0.13 0.00 0.70 0.00 0.00 55.95 55.76 1sb3 s SER 571 Cb -0.00 0.17 -0.10 0.00 -1.71 0.00 0.00 66.02 64.38 1sb3 s SER 571 CO 0.85 -0.49 1.38 0.06 1.20 0.00 0.00 173.24 176.24 1sb3 h GLN 572 N 3.69 0.84 -6.08 5.44 3.07 -1.94 -3.45 115.11 116.67 1sb3 h GLN 572 Ca -0.33 -0.55 -0.75 0.00 0.09 0.00 0.00 58.65 57.11 1sb3 h GLN 572 Cb 1.17 0.07 0.05 0.00 0.08 0.00 0.00 27.48 28.85 1sb3 h GLN 572 CO 0.56 1.18 0.14 -3.47 0.09 0.00 0.00 178.83 177.33 1sb3 n ASP 573 N -4.04 0.40 0.07 0.06 -0.08 -1.26 -4.84 116.55 106.85 1sb3 n ASP 573 Ca -0.05 1.15 0.01 0.00 -1.51 0.00 0.00 54.79 54.39 1sb3 n ASP 573 Cb 0.63 -1.00 0.35 0.00 2.34 0.00 0.00 41.12 43.44 1sb3 n ASP 573 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1sb3 h PRO 574 N 3.33 0.36 0.00 -0.67 0.11 -1.97 -3.44 132.00 129.73 1sb3 h PRO 574 Ca -0.49 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 65.54 1sb3 h PRO 574 Cb 1.40 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.46 1sb3 h PRO 574 CO 0.68 0.45 0.00 0.41 -0.21 0.00 0.00 178.00 179.33 1sb3 n GLY 575 N -0.89 -2.61 3.60 -0.55 0.00 -1.26 -4.81 105.19 98.67 1sb3 n GLY 575 Ca 0.00 -2.11 -0.32 0.00 0.00 0.00 0.00 46.02 43.59 1sb3 n GLY 575 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1sb3 s LEU 576 N 0.00 3.18 0.76 0.99 1.43 0.73 -4.91 118.68 120.86 1sb3 s LEU 576 Ca 0.00 -0.15 -0.11 0.00 -1.03 0.00 0.00 54.13 52.84 1sb3 s LEU 576 Cb 0.00 -1.83 0.05 0.00 0.03 0.00 0.00 46.19 44.44 1sb3 s LEU 576 CO 0.00 0.28 1.08 -0.94 0.23 0.00 0.00 176.35 177.00 1sb3 s SER 577 N -1.46 4.76 0.21 2.29 1.04 -1.26 0.24 113.70 119.51 1sb3 s SER 577 Ca 0.17 1.52 -0.10 0.00 0.48 0.00 0.00 55.95 58.02 1sb3 s SER 577 Cb -0.11 -2.30 0.18 0.00 0.10 0.00 0.00 66.02 63.89 1sb3 s SER 577 CO 0.08 -1.83 1.86 0.15 0.98 0.00 0.00 173.24 174.48 1sb3 h PHE 578 N -0.99 0.89 -0.82 5.02 3.57 -1.32 -1.94 116.94 121.34 1sb3 h PHE 578 Ca -0.45 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.04 1sb3 h PHE 578 Cb 1.24 -0.29 -0.04 0.00 2.79 0.00 0.00 35.95 39.65 1sb3 h PHE 578 CO 0.54 0.53 0.40 0.37 -2.23 0.00 0.00 178.31 177.91 1sb3 h GLN 579 N 0.94 1.18 -0.81 1.11 5.75 -1.92 0.33 115.11 121.68 1sb3 h GLN 579 Ca 0.28 -0.17 -0.04 0.00 -0.15 0.00 0.00 58.65 58.58 1sb3 h GLN 579 Cb -0.04 -0.21 -0.04 0.00 1.07 0.00 0.00 27.48 28.26 1sb3 h GLN 579 CO -0.09 0.90 0.35 0.93 -2.65 0.00 0.00 178.83 178.28 1sb3 h GLU 580 N 1.17 1.19 -0.49 1.69 5.08 -1.78 -0.37 114.58 121.07 1sb3 h GLU 580 Ca 0.28 -0.20 -0.11 0.00 -1.00 0.00 0.00 59.36 58.33 1sb3 h GLU 580 Cb 0.11 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 1sb3 h GLU 580 CO -0.04 0.94 -0.14 0.28 -1.00 0.00 0.00 179.01 179.05 1sb3 h VAL 581 N 1.17 1.27 -0.33 3.13 2.07 -0.71 -0.83 116.25 122.02 1sb3 h VAL 581 Ca 0.27 -1.27 0.00 0.00 0.82 0.00 0.00 66.70 66.52 1sb3 h VAL 581 Cb 0.17 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 1sb3 h VAL 581 CO -0.03 0.44 0.21 0.58 0.02 0.00 0.00 177.57 178.79 1sb3 h VAL 582 N 0.82 1.10 -0.33 2.57 2.07 -0.58 0.46 116.25 122.36 1sb3 h VAL 582 Ca 0.12 -0.21 0.03 0.00 0.82 0.00 0.00 66.70 67.46 1sb3 h VAL 582 Cb 0.68 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 1sb3 h VAL 582 CO 0.05 0.10 0.16 0.50 0.02 0.00 0.00 177.57 178.40 1sb3 h LYS 583 N 0.43 0.32 -0.50 1.57 3.64 -0.80 -0.89 116.57 120.34 1sb3 h LYS 583 Ca 0.12 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.46 1sb3 h LYS 583 Cb -0.02 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.70 1sb3 h LYS 583 CO -0.02 0.21 0.25 0.00 -2.27 0.00 0.00 179.45 177.62 1sb3 h ALA 584 N 1.18 0.65 0.00 5.00 0.00 -0.51 -2.68 119.26 122.90 1sb3 h ALA 584 Ca 0.14 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1sb3 h ALA 584 Cb 0.06 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 1sb3 h ALA 584 CO -0.10 0.21 -0.04 0.00 0.00 0.00 0.00 179.25 179.32 1sb3 h ALA 585 N 1.09 1.62 0.00 0.00 0.00 0.52 -2.18 119.26 120.31 1sb3 h ALA 585 Ca 0.17 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 1sb3 h ALA 585 Cb 0.11 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1sb3 h ALA 585 CO -0.02 0.04 -0.47 0.52 0.00 0.00 0.00 179.25 179.33 1sb3 h MET 586 N 0.00 0.00 -6.48 0.00 2.07 -0.82 -3.41 114.93 106.30 1sb3 h MET 586 Ca -0.00 0.00 -0.57 0.00 -2.07 0.00 0.00 59.70 57.06 1sb3 h MET 586 Cb 0.08 0.00 0.05 0.00 -1.87 0.00 0.00 31.60 29.86 1sb3 h MET 586 CO 0.00 0.47 0.95 0.28 1.07 0.00 0.00 176.91 179.68 1sb3 n VAL 587 N -3.77 0.20 -1.17 -2.22 0.31 -0.82 -0.05 118.33 110.80 1sb3 n VAL 587 Ca -0.01 -0.04 -0.06 0.00 -0.01 0.00 0.00 64.34 64.23 1sb3 n VAL 587 Cb 0.52 -1.79 -0.03 0.00 -0.91 0.00 0.00 33.84 31.64 1sb3 n VAL 587 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1sb3 n ASP 588 N 4.62 -5.40 0.01 4.52 10.43 -1.26 -4.70 116.55 124.77 1sb3 n ASP 588 Ca 0.18 0.14 0.00 0.00 2.57 0.00 0.00 54.79 57.69 1sb3 n ASP 588 Cb 0.31 -3.42 0.00 0.00 1.84 0.00 0.00 41.12 39.86 1sb3 n ASP 588 CO 0.00 0.00 0.00 -0.24 -1.07 0.00 0.00 177.20 175.89 1sb3 n SER 589 N -0.85 0.05 -0.27 -2.24 2.88 0.34 -5.14 113.62 108.39 1sb3 n SER 589 Ca -0.06 0.05 0.00 0.00 -1.33 0.00 0.00 58.87 57.53 1sb3 n SER 589 Cb 0.47 0.01 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 1sb3 n SER 589 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1sb3 n GLY 590 N 2.15 -1.41 2.97 0.46 0.00 0.93 -4.85 105.19 105.44 1sb3 n GLY 590 Ca 0.00 -1.24 -0.52 0.00 0.00 0.00 0.00 46.02 44.26 1sb3 n GLY 590 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1sb3 n THR 591 N -0.54 0.00 -3.62 2.61 -1.04 -1.26 -4.77 114.28 105.66 1sb3 n THR 591 Ca 0.00 0.00 -0.36 0.00 -2.04 0.00 0.00 64.05 61.65 1sb3 n THR 591 Cb 0.00 -0.20 -0.07 0.00 -1.82 0.00 0.00 70.33 68.24 1sb3 n THR 591 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1sb3 s ILE 592 N 1.23 5.32 -0.04 12.58 1.01 0.83 -4.95 121.20 137.18 1sb3 s ILE 592 Ca 0.80 0.46 0.01 0.00 0.00 0.00 0.00 60.65 61.92 1sb3 s ILE 592 Cb -1.13 -3.57 0.02 0.00 0.01 0.00 0.00 42.46 37.79 1sb3 s ILE 592 CO 0.57 0.46 -0.02 0.42 0.00 0.00 0.00 174.94 176.37 1sb3 s THR 593 N 0.00 0.34 0.20 2.92 -4.23 -1.26 -0.21 115.64 113.41 1sb3 s THR 593 Ca 0.16 -0.00 0.06 0.00 -1.18 0.00 0.00 61.69 60.73 1sb3 s THR 593 Cb -0.13 -0.41 -0.05 0.00 1.34 0.00 0.00 72.50 73.26 1sb3 s THR 593 CO 0.04 0.18 -0.11 0.68 -0.54 0.00 0.00 174.62 174.88 1sb3 s VAL 594 N 1.01 1.52 -0.05 2.29 -7.23 -0.45 -4.99 120.40 112.50 1sb3 s VAL 594 Ca -0.10 -2.15 0.03 0.00 -1.81 0.00 0.00 61.98 57.95 1sb3 s VAL 594 Cb -0.14 -2.09 0.01 0.00 0.56 0.00 0.00 36.38 34.72 1sb3 s VAL 594 CO -0.01 -0.56 -0.14 -0.75 -0.31 0.00 0.00 175.10 173.33 1sb3 s LYS 595 N -3.70 1.70 0.05 4.82 2.20 -1.26 -1.46 119.74 122.08 1sb3 s LYS 595 Ca 0.23 -0.49 0.08 0.00 -0.36 0.00 0.00 55.97 55.43 1sb3 s LYS 595 Cb 0.01 -1.43 -0.03 0.00 -1.51 0.00 0.00 37.83 34.87 1sb3 s LYS 595 CO 0.06 0.12 -0.24 0.20 -0.36 0.00 0.00 175.35 175.14 1sb3 s GLY 596 N 0.36 1.27 0.13 5.54 0.00 0.44 -4.58 107.32 110.48 1sb3 s GLY 596 Ca -0.10 -1.17 -0.02 0.00 0.00 0.00 0.00 44.72 43.43 1sb3 s GLY 596 CO 0.03 -1.09 0.09 -0.51 0.00 0.00 0.00 173.10 171.62 1sb3 s THR 597 N -0.82 0.10 -0.08 0.90 -4.23 -1.26 -0.70 115.64 109.56 1sb3 s THR 597 Ca 0.10 -1.82 -0.09 0.00 -1.18 0.00 0.00 61.69 58.69 1sb3 s THR 597 Cb -0.09 -1.98 0.02 0.00 1.34 0.00 0.00 72.50 71.79 1sb3 s THR 597 CO 0.02 -0.47 0.25 -0.47 -0.54 0.00 0.00 174.62 173.42 1sb3 s TYR 598 N -4.03 -0.24 -0.06 3.99 5.04 -0.52 -4.47 117.35 117.05 1sb3 s TYR 598 Ca 0.22 0.58 -0.03 0.00 -2.44 0.00 0.00 57.07 55.40 1sb3 s TYR 598 Cb 0.07 0.08 0.04 0.00 0.35 0.00 0.00 41.96 42.50 1sb3 s TYR 598 CO 0.01 -0.17 0.14 0.99 -1.34 0.00 0.00 175.55 175.17 1sb3 s THR 599 N -0.14 -0.05 0.14 4.34 2.01 -1.26 0.02 115.64 120.70 1sb3 s THR 599 Ca -0.03 0.17 -0.31 0.00 0.31 0.00 0.00 61.69 61.83 1sb3 s THR 599 Cb -0.03 -0.23 -0.09 0.00 0.01 0.00 0.00 72.50 72.17 1sb3 s THR 599 CO 0.01 0.07 1.45 0.00 -0.69 0.00 0.00 174.62 175.46 1sb3 s PRO 601 N 1.05 3.48 0.42 0.00 0.02 -1.26 -4.88 135.00 133.83 1sb3 s PRO 601 Ca 0.66 2.24 0.20 0.00 0.02 0.00 0.00 61.00 64.12 1sb3 s PRO 601 Cb -0.39 -2.46 1.15 0.00 0.02 0.00 0.00 34.50 32.81 1sb3 s PRO 601 CO 0.31 -0.92 1.80 1.15 -0.33 0.00 0.00 177.00 179.01 1sb3 h THR 602 N 1.89 0.55 0.00 0.99 2.02 -1.97 -0.51 112.91 115.88 1sb3 h THR 602 Ca -0.51 -0.12 -0.00 0.00 0.77 0.00 0.00 66.41 66.55 1sb3 h THR 602 Cb 1.28 0.17 -0.00 0.00 -1.74 0.00 0.00 68.15 67.86 1sb3 h THR 602 CO 0.59 0.06 -0.01 1.05 0.37 0.00 0.00 175.52 177.58 1sb3 h GLU 603 N 0.35 0.00 -0.45 6.66 4.11 -1.90 -0.24 114.58 123.11 1sb3 h GLU 603 Ca 0.55 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.98 1sb3 h GLU 603 Cb 1.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.74 1sb3 h GLU 603 CO -0.23 0.01 0.00 1.19 0.07 0.00 0.00 179.01 180.05 1sb3 n PHE 604 N -3.59 0.60 -1.21 2.06 3.01 -0.20 -4.32 117.46 113.81 1sb3 n PHE 604 Ca -0.03 -0.30 -0.17 0.00 1.01 0.00 0.00 57.45 57.97 1sb3 n PHE 604 Cb 0.10 0.00 0.21 0.00 -0.01 0.00 0.00 39.48 39.78 1sb3 n PHE 604 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1sb3 n GLN 605 N 1.06 2.56 0.00 -1.08 6.02 -0.10 -3.48 117.38 122.35 1sb3 n GLN 605 Ca 0.18 -3.05 0.00 0.00 -0.01 0.00 0.00 57.00 54.12 1sb3 n GLN 605 Cb 0.47 -2.14 0.00 0.00 1.02 0.00 0.00 30.24 29.59 1sb3 n GLN 605 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1sb3 n GLY 606 N -0.90 -1.27 3.10 1.08 0.00 -1.26 -4.47 105.19 101.47 1sb3 n GLY 606 Ca 0.51 -1.38 -0.32 0.00 0.00 0.00 0.00 46.02 44.83 1sb3 n GLY 606 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1sb3 s ASP 607 N -4.00 3.09 0.43 1.61 -1.08 -1.26 -4.90 116.67 110.55 1sb3 s ASP 607 Ca 0.00 -0.64 0.16 0.00 -0.52 0.00 0.00 52.55 51.54 1sb3 s ASP 607 Cb 0.00 -1.43 1.05 0.00 -1.46 0.00 0.00 42.92 41.08 1sb3 s ASP 607 CO 0.00 -0.02 1.92 0.11 0.52 0.00 0.00 175.17 177.70 1sb3 h LYS 608 N 7.96 0.41 -0.18 4.34 1.57 -1.98 -1.48 116.57 127.20 1sb3 h LYS 608 Ca -0.44 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 1sb3 h LYS 608 Cb 1.14 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.35 1sb3 h LYS 608 CO 0.61 0.27 0.00 0.36 -0.57 0.00 0.00 179.45 180.12 1sb3 n LYS 609 N -4.48 1.52 -4.37 3.15 2.85 -1.26 -4.77 118.16 110.80 1sb3 n LYS 609 Ca 0.14 -0.80 -0.34 0.00 -1.05 0.00 0.00 58.31 56.27 1sb3 n LYS 609 Cb 0.53 -1.27 -0.15 0.00 -0.65 0.00 0.00 35.03 33.49 1sb3 n LYS 609 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 1sb3 s ILE 610 N -1.77 2.86 -0.23 0.58 1.01 -0.56 -5.08 121.20 118.02 1sb3 s ILE 610 Ca 0.23 -0.69 -0.30 0.00 0.00 0.00 0.00 60.65 59.89 1sb3 s ILE 610 Cb 0.12 -2.23 -0.06 0.00 0.01 0.00 0.00 42.46 40.29 1sb3 s ILE 610 CO 0.18 0.50 2.21 0.54 0.00 0.00 0.00 174.94 178.36 1sb3 n ARG 611 N 4.19 1.83 -1.03 2.79 5.12 -1.26 -2.71 116.66 125.59 1sb3 n ARG 611 Ca -0.19 0.51 -0.01 0.00 -1.93 0.00 0.00 57.85 56.23 1sb3 n ARG 611 Cb 0.51 -3.09 -0.00 0.00 -1.16 0.00 0.00 32.46 28.72 1sb3 n ARG 611 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1sb3 n GLY 612 N 5.86 0.40 0.00 -0.13 0.00 -1.26 -4.89 105.19 105.17 1sb3 n GLY 612 Ca 0.32 -0.09 0.01 0.00 0.00 0.00 0.00 46.02 46.25 1sb3 n GLY 612 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1sb3 n SER 613 N -0.22 0.00 0.20 1.61 3.41 -1.10 -1.22 113.62 116.29 1sb3 n SER 613 Ca -0.01 0.23 0.04 0.00 -0.26 0.00 0.00 58.87 58.87 1sb3 n SER 613 Cb 0.20 -0.25 0.40 0.00 -0.26 0.00 0.00 64.21 64.30 1sb3 n SER 613 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1sb3 h ALA 614 N 2.07 1.34 -1.87 7.33 0.00 -1.86 -3.27 119.26 123.00 1sb3 h ALA 614 Ca 0.00 -0.31 -0.58 0.00 0.00 0.00 0.00 54.91 54.02 1sb3 h ALA 614 Cb 0.01 -0.05 -0.09 0.00 0.00 0.00 0.00 17.79 17.66 1sb3 h ALA 614 CO 0.00 0.42 0.72 0.42 0.00 0.00 0.00 179.25 180.81 1sb3 s ILE 615 N -4.14 4.39 0.00 0.00 -1.09 -0.36 -2.21 121.20 117.79 1sb3 s ILE 615 Ca -0.02 1.02 0.00 0.00 -2.23 0.00 0.00 60.65 59.41 1sb3 s ILE 615 Cb 0.14 -4.48 0.00 0.00 -1.58 0.00 0.00 42.46 36.54 1sb3 s ILE 615 CO 0.70 -0.84 0.00 0.61 -1.23 0.00 0.00 174.94 174.18 1sb3 n GLY 616 N 4.78 2.07 3.71 6.18 0.00 -1.26 -4.79 105.19 115.88 1sb3 n GLY 616 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 1sb3 n GLY 616 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sb3 s ALA 617 N -2.20 3.29 0.27 4.61 0.00 -0.94 -4.93 121.76 121.86 1sb3 s ALA 617 Ca 0.00 0.29 -0.10 0.00 0.00 0.00 0.00 51.96 52.15 1sb3 s ALA 617 Cb 0.00 -3.15 -0.00 0.00 0.00 0.00 0.00 23.12 19.97 1sb3 s ALA 617 CO 0.00 -0.23 0.47 -0.08 0.00 0.00 0.00 175.76 175.92 1sb3 s THR 618 N 1.08 0.00 0.11 0.00 -1.32 -1.23 -2.12 115.64 112.16 1sb3 s THR 618 Ca 0.43 -1.47 0.13 0.00 -1.21 0.00 0.00 61.69 59.58 1sb3 s THR 618 Cb -0.19 -2.36 -0.01 0.00 -1.51 0.00 0.00 72.50 68.43 1sb3 s THR 618 CO 0.21 0.00 1.52 0.24 -2.21 0.00 0.00 174.62 174.38 1sb3 h MET 619 N 2.23 0.00 -1.34 7.08 2.86 -1.81 -3.43 114.93 120.51 1sb3 h MET 619 Ca -0.28 0.00 0.32 0.00 -2.06 0.00 0.00 59.70 57.68 1sb3 h MET 619 Cb 1.25 0.00 -0.15 0.00 0.06 0.00 0.00 31.60 32.75 1sb3 h MET 619 CO 0.38 0.62 0.87 0.20 1.06 0.00 0.00 176.91 180.03 1sb3 s GLY 620 N -4.50 -0.37 0.06 8.32 0.00 -1.26 -4.70 107.32 104.87 1sb3 s GLY 620 Ca 0.01 1.14 0.07 0.00 0.00 0.00 0.00 44.72 45.94 1sb3 s GLY 620 CO 0.75 0.31 -0.16 -1.36 0.00 0.00 0.00 173.10 172.65 1sb3 s PHE 621 N -2.32 2.62 0.00 1.90 0.40 -1.26 -1.41 117.98 117.91 1sb3 s PHE 621 Ca 0.13 -0.22 -0.19 0.00 -0.60 0.00 0.00 56.93 56.05 1sb3 s PHE 621 Cb 0.03 -1.46 -0.06 0.00 0.51 0.00 0.00 43.02 42.04 1sb3 s PHE 621 CO -0.04 0.31 0.55 0.00 0.70 0.00 0.00 175.22 176.73 1sb3 s TYR 623 N -0.49 2.34 -0.00 0.00 1.51 -1.03 -1.92 117.35 117.76 1sb3 s TYR 623 Ca 0.29 -0.40 0.01 0.00 -1.01 0.00 0.00 57.07 55.95 1sb3 s TYR 623 Cb -0.18 -1.41 -0.00 0.00 -0.11 0.00 0.00 41.96 40.26 1sb3 s TYR 623 CO 0.16 0.12 -0.02 0.00 -1.11 0.00 0.00 175.55 174.71 1sb3 s ALA 624 N -0.80 0.15 -0.05 3.71 0.00 -0.02 -0.17 121.76 124.58 1sb3 s ALA 624 Ca 0.12 -0.08 0.06 0.00 0.00 0.00 0.00 51.96 52.06 1sb3 s ALA 624 Cb -0.10 -0.04 -0.01 0.00 0.00 0.00 0.00 23.12 22.97 1sb3 s ALA 624 CO 0.02 0.03 -0.23 0.00 0.00 0.00 0.00 175.76 175.58 1sb3 s ALA 625 N -0.05 2.01 -0.02 0.00 0.00 -0.46 -1.68 121.76 121.56 1sb3 s ALA 625 Ca 0.01 -0.97 -0.05 0.00 0.00 0.00 0.00 51.96 50.95 1sb3 s ALA 625 Cb -0.01 -0.62 0.01 0.00 0.00 0.00 0.00 23.12 22.49 1sb3 s ALA 625 CO -0.00 0.39 0.11 1.14 0.00 0.00 0.00 175.76 177.40 1sb3 s GLN 626 N -0.15 0.27 -0.12 0.00 -2.07 -0.56 -0.67 119.66 116.37 1sb3 s GLN 626 Ca -0.03 -0.10 0.01 0.00 -1.82 0.00 0.00 55.36 53.42 1sb3 s GLN 626 Cb -0.13 0.12 -0.02 0.00 -1.09 0.00 0.00 33.01 31.89 1sb3 s GLN 626 CO 0.03 -0.05 -0.14 0.08 -1.32 0.00 0.00 175.29 173.89 1sb3 s VAL 627 N -0.56 3.00 -0.10 3.63 1.01 0.25 -1.89 120.40 125.73 1sb3 s VAL 627 Ca -0.06 -0.69 0.02 0.00 0.00 0.00 0.00 61.98 61.25 1sb3 s VAL 627 Cb -0.04 -2.24 -0.01 0.00 0.00 0.00 0.00 36.38 34.09 1sb3 s VAL 627 CO 0.00 0.54 -0.17 -0.69 0.00 0.00 0.00 175.10 174.78 1sb3 s VAL 628 N 0.19 2.73 -0.22 2.92 1.01 -0.20 -1.10 120.40 125.73 1sb3 s VAL 628 Ca -0.08 -0.79 -0.05 0.00 0.00 0.00 0.00 61.98 61.06 1sb3 s VAL 628 Cb -0.15 -2.10 -0.01 0.00 0.00 0.00 0.00 36.38 34.11 1sb3 s VAL 628 CO 0.05 0.55 -0.02 -0.70 0.00 0.00 0.00 175.10 174.98 1sb3 s GLU 629 N 0.11 3.44 0.24 2.72 2.12 -0.10 -1.47 118.70 125.75 1sb3 s GLU 629 Ca -0.08 -0.59 0.01 0.00 0.36 0.00 0.00 54.97 54.66 1sb3 s GLU 629 Cb -0.15 -3.07 -0.05 0.00 0.26 0.00 0.00 34.13 31.12 1sb3 s GLU 629 CO 0.05 -0.18 0.10 0.00 -0.54 0.00 0.00 175.26 174.70 1sb3 s ALA 630 N 1.47 1.55 0.04 6.30 0.00 -0.80 -0.53 121.76 129.78 1sb3 s ALA 630 Ca 0.06 -1.81 -0.02 0.00 0.00 0.00 0.00 51.96 50.18 1sb3 s ALA 630 Cb -0.14 1.14 -0.02 0.00 0.00 0.00 0.00 23.12 24.09 1sb3 s ALA 630 CO -0.02 -0.50 0.02 -1.54 0.00 0.00 0.00 175.76 173.73 1sb3 s SER 631 N -3.26 0.32 -0.04 0.00 1.04 -0.45 -0.67 113.70 110.63 1sb3 s SER 631 Ca 0.38 -0.73 0.04 0.00 0.48 0.00 0.00 55.95 56.12 1sb3 s SER 631 Cb 0.08 0.19 -0.00 0.00 0.10 0.00 0.00 66.02 66.39 1sb3 s SER 631 CO 0.13 -0.51 -0.16 -0.69 0.98 0.00 0.00 173.24 172.99 1sb3 s VAL 632 N -2.97 1.37 -0.36 5.02 1.01 -0.27 -0.78 120.40 123.42 1sb3 s VAL 632 Ca -0.02 -0.68 -0.18 0.00 0.00 0.00 0.00 61.98 61.10 1sb3 s VAL 632 Cb 0.01 -1.18 -0.00 0.00 0.00 0.00 0.00 36.38 35.20 1sb3 s VAL 632 CO -0.06 0.40 0.51 -0.62 0.00 0.00 0.00 175.10 175.32 1sb3 s ASP 633 N 0.10 6.31 0.50 3.32 -1.08 -0.70 -4.86 116.67 120.26 1sb3 s ASP 633 Ca -0.05 -0.07 0.29 0.00 -0.52 0.00 0.00 52.55 52.20 1sb3 s ASP 633 Cb -0.12 -2.27 1.10 0.00 -1.46 0.00 0.00 42.92 40.17 1sb3 s ASP 633 CO 0.02 -0.49 1.89 -0.33 0.52 0.00 0.00 175.17 176.78 1sb3 h GLU 634 N 8.48 0.00 0.13 4.34 5.08 -1.93 0.75 114.58 131.44 1sb3 h GLU 634 Ca -0.28 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.08 1sb3 h GLU 634 Cb 1.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.38 1sb3 h GLU 634 CO 0.77 0.08 -0.06 0.82 -1.00 0.00 0.00 179.01 179.62 1sb3 h ILE 635 N 0.00 1.03 0.00 3.13 2.04 -1.99 -3.34 117.51 118.38 1sb3 h ILE 635 Ca -0.00 -0.71 -0.11 0.00 1.00 0.00 0.00 64.86 65.05 1sb3 h ILE 635 Cb 0.65 1.46 -0.02 0.00 -0.74 0.00 0.00 36.82 38.18 1sb3 h ILE 635 CO 0.01 0.17 -1.60 0.35 0.00 0.00 0.00 178.15 177.08 1sb3 n THR 636 N -5.01 0.74 -0.45 -0.27 -2.24 -1.20 -4.98 114.28 100.87 1sb3 n THR 636 Ca -0.09 -0.62 0.00 0.00 -2.27 0.00 0.00 64.05 61.07 1sb3 n THR 636 Cb 0.22 -0.40 0.00 0.00 -2.10 0.00 0.00 70.33 68.05 1sb3 n THR 636 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1sb3 n GLY 637 N 1.35 1.10 3.70 3.38 0.00 0.26 -4.75 105.19 110.24 1sb3 n GLY 637 Ca -0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 1sb3 n GLY 637 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1sb3 s LYS 638 N -0.38 4.32 -0.05 1.61 2.20 -1.20 -4.35 119.74 121.89 1sb3 s LYS 638 Ca 0.00 1.98 -0.17 0.00 -0.36 0.00 0.00 55.97 57.42 1sb3 s LYS 638 Cb 0.00 -3.41 -0.05 0.00 -1.51 0.00 0.00 37.83 32.86 1sb3 s LYS 638 CO 0.00 -0.48 0.48 0.08 -0.36 0.00 0.00 175.35 175.07 1sb3 s VAL 639 N 1.69 5.06 -0.14 4.02 1.01 -1.26 -1.73 120.40 129.06 1sb3 s VAL 639 Ca 0.63 0.97 0.02 0.00 0.00 0.00 0.00 61.98 63.61 1sb3 s VAL 639 Cb -0.33 -3.81 0.02 0.00 0.00 0.00 0.00 36.38 32.26 1sb3 s VAL 639 CO 0.28 0.44 -0.18 -0.89 0.00 0.00 0.00 175.10 174.75 1sb3 s THR 640 N -0.15 1.78 -0.26 3.92 2.01 0.04 -4.99 115.64 117.99 1sb3 s THR 640 Ca 0.26 -0.80 -0.20 0.00 0.31 0.00 0.00 61.69 61.27 1sb3 s THR 640 Cb -0.16 -1.61 -0.02 0.00 0.01 0.00 0.00 72.50 70.71 1sb3 s THR 640 CO 0.13 0.50 0.59 0.00 -0.69 0.00 0.00 174.62 175.15 1sb3 s ALA 641 N 1.07 3.61 -0.17 7.40 0.00 -1.26 -1.34 121.76 131.06 1sb3 s ALA 641 Ca -0.03 -0.48 -0.16 0.00 0.00 0.00 0.00 51.96 51.29 1sb3 s ALA 641 Cb -0.14 -2.99 -0.22 0.00 0.00 0.00 0.00 23.12 19.77 1sb3 s ALA 641 CO -0.05 -0.78 0.28 0.72 0.00 0.00 0.00 175.76 175.92 1sb3 n HIS 642 N 5.65 1.12 -3.59 0.00 8.25 0.31 -3.64 115.22 123.32 1sb3 n HIS 642 Ca -0.02 0.37 -0.12 0.00 -0.26 0.00 0.00 57.72 57.69 1sb3 n HIS 642 Cb 0.49 -1.13 -0.05 0.00 1.12 0.00 0.00 29.99 30.43 1sb3 n HIS 642 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 1sb3 s LYS 643 N -2.44 1.07 -0.02 -0.41 2.20 -1.03 -1.72 119.74 117.37 1sb3 s LYS 643 Ca -0.26 -0.47 0.02 0.00 -0.36 0.00 0.00 55.97 54.89 1sb3 s LYS 643 Cb 0.06 0.48 0.01 0.00 -1.51 0.00 0.00 37.83 36.87 1sb3 s LYS 643 CO 0.66 -0.41 -0.06 0.08 -0.36 0.00 0.00 175.35 175.26 1sb3 s VAL 644 N -3.17 0.57 -0.17 4.02 1.01 -0.45 -0.93 120.40 121.30 1sb3 s VAL 644 Ca -0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 61.98 61.72 1sb3 s VAL 644 Cb 0.00 -0.54 -0.01 0.00 0.00 0.00 0.00 36.38 35.84 1sb3 s VAL 644 CO -0.07 0.20 -0.10 0.26 0.00 0.00 0.00 175.10 175.38 1sb3 s TRP 645 N 0.35 2.86 -0.05 5.22 0.51 -0.26 -0.76 118.94 126.82 1sb3 s TRP 645 Ca -0.05 -0.82 0.00 0.00 -2.12 0.00 0.00 56.10 53.11 1sb3 s TRP 645 Cb -0.09 -1.94 0.02 0.00 -0.81 0.00 0.00 33.47 30.66 1sb3 s TRP 645 CO 0.00 -0.37 -0.02 0.54 -0.51 0.00 0.00 176.95 176.59 1sb3 s VAL 646 N 0.81 0.39 -0.16 4.03 0.11 -0.15 -0.58 120.40 124.84 1sb3 s VAL 646 Ca -0.04 0.00 -0.02 0.00 -2.93 0.00 0.00 61.98 59.00 1sb3 s VAL 646 Cb -0.15 -0.47 -0.02 0.00 -1.53 0.00 0.00 36.38 34.22 1sb3 s VAL 646 CO 0.01 0.21 -0.09 0.00 -3.33 0.00 0.00 175.10 171.90 1sb3 s ALA 647 N 1.20 2.74 -0.10 1.54 0.00 0.16 -0.55 121.76 126.75 1sb3 s ALA 647 Ca -0.07 -0.95 0.04 0.00 0.00 0.00 0.00 51.96 50.98 1sb3 s ALA 647 Cb -0.14 -1.40 0.00 0.00 0.00 0.00 0.00 23.12 21.59 1sb3 s ALA 647 CO -0.02 0.07 -0.23 0.14 0.00 0.00 0.00 175.76 175.72 1sb3 s VAL 648 N 0.64 1.99 -0.53 0.00 -7.23 -0.36 -1.36 120.40 113.54 1sb3 s VAL 648 Ca -0.05 -0.98 -0.24 0.00 -1.81 0.00 0.00 61.98 58.90 1sb3 s VAL 648 Cb -0.15 -1.73 0.04 0.00 0.56 0.00 0.00 36.38 35.11 1sb3 s VAL 648 CO 0.03 0.54 0.90 -0.62 -0.31 0.00 0.00 175.10 175.64 1sb3 s ASP 649 N 0.39 6.34 -0.09 4.85 3.68 0.76 -0.43 116.67 132.17 1sb3 s ASP 649 Ca -0.18 -0.36 0.13 0.00 2.13 0.00 0.00 52.55 54.27 1sb3 s ASP 649 Cb -0.18 -2.42 0.38 0.00 -1.45 0.00 0.00 42.92 39.25 1sb3 s ASP 649 CO 0.08 -1.17 1.30 1.33 0.13 0.00 0.00 175.17 176.84 1sb3 n VAL 650 N 6.16 1.63 0.00 1.11 0.24 -0.69 -2.47 118.33 124.31 1sb3 n VAL 650 Ca 0.01 -1.47 0.00 0.00 -2.04 0.00 0.00 64.34 60.84 1sb3 n VAL 650 Cb 0.47 0.12 0.00 0.00 -1.47 0.00 0.00 33.84 32.96 1sb3 n VAL 650 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1sb3 n GLY 651 N -0.15 1.51 3.39 7.63 0.00 -1.25 -0.47 105.19 115.85 1sb3 n GLY 651 Ca 0.15 -0.02 0.02 0.00 0.00 0.00 0.00 46.02 46.17 1sb3 n GLY 651 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1sb3 s LYS 652 N 0.00 0.35 -0.54 1.61 2.47 -1.22 -0.22 119.74 122.19 1sb3 s LYS 652 Ca 0.00 0.82 -0.28 0.00 -1.56 0.00 0.00 55.97 54.96 1sb3 s LYS 652 Cb 0.00 0.49 0.00 0.00 -1.46 0.00 0.00 37.83 36.86 1sb3 s LYS 652 CO 0.00 -0.17 1.56 0.00 0.16 0.00 0.00 175.35 176.91 1sb3 s ALA 653 N 2.61 2.68 0.21 3.13 0.00 -1.26 -4.36 121.76 124.77 1sb3 s ALA 653 Ca -0.01 -0.54 -0.07 0.00 0.00 0.00 0.00 51.96 51.34 1sb3 s ALA 653 Cb -0.08 -4.13 0.15 0.00 0.00 0.00 0.00 23.12 19.06 1sb3 s ALA 653 CO -0.17 -3.09 1.68 -0.07 0.00 0.00 0.00 175.76 174.10 1sb3 h LEU 654 N 13.87 0.96 -6.76 0.00 3.38 -1.95 -3.32 115.31 121.50 1sb3 h LEU 654 Ca -0.28 -0.26 -0.57 0.00 0.09 0.00 0.00 57.88 56.86 1sb3 h LEU 654 Cb 1.12 -0.26 -0.40 0.00 0.09 0.00 0.00 40.66 41.21 1sb3 h LEU 654 CO 1.17 1.02 -0.80 0.21 0.09 0.00 0.00 178.44 180.12 1sb3 s ASN 655 N -6.60 3.35 0.44 -0.43 2.47 -1.26 -0.17 114.94 112.74 1sb3 s ASN 655 Ca -0.11 -1.87 0.19 0.00 0.42 0.00 0.00 52.86 51.49 1sb3 s ASN 655 Cb 0.14 -0.50 1.13 0.00 -1.45 0.00 0.00 41.25 40.57 1sb3 s ASN 655 CO 0.84 -0.36 1.88 -0.65 -3.72 0.00 0.00 177.10 175.09 1sb3 h PRO 656 N 7.58 0.34 -0.22 0.43 0.11 -1.76 0.05 132.00 138.52 1sb3 h PRO 656 Ca -0.06 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.02 1sb3 h PRO 656 Cb 0.98 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.01 1sb3 h PRO 656 CO 0.37 0.22 0.09 1.25 -0.21 0.00 0.00 178.00 179.72 1sb3 h LEU 657 N 0.35 0.31 -0.43 2.35 5.85 -1.91 -1.46 115.31 120.36 1sb3 h LEU 657 Ca 0.43 -0.16 -0.12 0.00 0.84 0.00 0.00 57.88 58.87 1sb3 h LEU 657 Cb 1.14 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.08 1sb3 h LEU 657 CO -0.14 0.39 -0.18 0.00 -0.34 0.00 0.00 178.44 178.16 1sb3 h ALA 658 N 0.93 0.60 -0.92 1.25 0.00 -1.44 -2.44 119.26 117.25 1sb3 h ALA 658 Ca 0.07 -0.37 0.03 0.00 0.00 0.00 0.00 54.91 54.65 1sb3 h ALA 658 Cb 0.18 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 1sb3 h ALA 658 CO -0.01 0.55 0.59 0.28 0.00 0.00 0.00 179.25 180.67 1sb3 h VAL 659 N 0.71 1.15 -0.44 0.00 2.07 -0.96 0.26 116.25 119.05 1sb3 h VAL 659 Ca 0.10 -0.39 -0.03 0.00 0.82 0.00 0.00 66.70 67.20 1sb3 h VAL 659 Cb 0.75 -0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.40 1sb3 h VAL 659 CO 0.06 0.21 0.17 -0.33 0.02 0.00 0.00 177.57 177.69 1sb3 h GLU 660 N 1.15 0.66 -0.53 1.57 5.08 -1.12 -0.76 114.58 120.62 1sb3 h GLU 660 Ca 0.37 -0.12 -0.09 0.00 -1.00 0.00 0.00 59.36 58.51 1sb3 h GLU 660 Cb 0.01 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 1sb3 h GLU 660 CO -0.12 0.61 -0.03 0.78 -1.00 0.00 0.00 179.01 179.25 1sb3 h GLY 661 N 0.56 1.03 0.97 -3.84 0.00 -0.89 -0.94 103.07 99.97 1sb3 h GLY 661 Ca 0.14 -0.78 -0.03 0.00 0.00 0.00 0.00 47.33 46.66 1sb3 h GLY 661 CO -0.01 0.72 0.18 1.46 0.00 0.00 0.00 176.54 178.89 1sb3 h GLN 662 N 0.83 0.77 -0.59 4.80 1.08 -0.39 -0.88 115.11 120.74 1sb3 h GLN 662 Ca 0.15 -0.15 -0.07 0.00 -1.45 0.00 0.00 58.65 57.13 1sb3 h GLN 662 Cb 0.57 -0.12 -0.02 0.00 -0.05 0.00 0.00 27.48 27.86 1sb3 h GLN 662 CO 0.03 0.70 0.11 1.15 -0.95 0.00 0.00 178.83 179.87 1sb3 h THR 663 N 0.68 1.26 -0.62 -0.54 2.02 -0.98 -0.87 112.91 113.87 1sb3 h THR 663 Ca 0.17 -0.97 -0.10 0.00 0.77 0.00 0.00 66.41 66.28 1sb3 h THR 663 Cb 0.23 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 67.36 1sb3 h THR 663 CO -0.01 0.36 0.00 1.56 0.37 0.00 0.00 175.52 177.80 1sb3 h GLN 664 N 0.87 1.08 -0.55 6.66 4.20 -1.01 -0.80 115.11 125.56 1sb3 h GLN 664 Ca 0.18 -0.34 -0.07 0.00 0.06 0.00 0.00 58.65 58.48 1sb3 h GLN 664 Cb 0.40 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.06 1sb3 h GLN 664 CO 0.01 1.05 0.07 0.78 -0.67 0.00 0.00 178.83 180.07 1sb3 h GLY 665 N 0.99 1.00 0.84 3.46 0.00 -0.88 -0.87 103.07 107.61 1sb3 h GLY 665 Ca 0.17 -0.68 -0.01 0.00 0.00 0.00 0.00 47.33 46.82 1sb3 h GLY 665 CO 0.03 0.63 -0.05 -1.33 0.00 0.00 0.00 176.54 175.82 1sb3 h GLY 666 N 0.81 -0.15 0.66 4.60 0.00 -0.93 -0.23 103.07 107.84 1sb3 h GLY 666 Ca 0.17 0.06 0.05 0.00 0.00 0.00 0.00 47.33 47.60 1sb3 h GLY 666 CO 0.01 -0.06 0.17 -2.08 0.00 0.00 0.00 176.54 174.59 1sb3 h VAL 667 N -0.31 0.90 -0.58 4.60 2.07 -1.13 -1.93 116.25 119.87 1sb3 h VAL 667 Ca -0.02 -0.12 -0.04 0.00 0.82 0.00 0.00 66.70 67.34 1sb3 h VAL 667 Cb 0.25 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 1sb3 h VAL 667 CO 0.02 0.06 0.18 -0.25 0.02 0.00 0.00 177.57 177.61 1sb3 h TRP 668 N 0.35 0.88 -0.10 1.57 7.01 -1.00 0.17 115.95 124.82 1sb3 h TRP 668 Ca 0.19 -0.07 -0.07 0.00 2.11 0.00 0.00 58.89 61.06 1sb3 h TRP 668 Cb 0.16 -0.26 -0.01 0.00 -2.10 0.00 0.00 29.16 26.95 1sb3 h TRP 668 CO -0.14 0.71 -0.26 1.98 -2.79 0.00 0.00 178.44 177.95 1sb3 h MET 669 N 0.84 0.18 -0.51 2.65 4.05 -0.54 -1.14 114.93 120.46 1sb3 h MET 669 Ca 0.19 -0.06 -0.12 0.00 -0.28 0.00 0.00 59.70 59.44 1sb3 h MET 669 Cb 0.24 -0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.01 1sb3 h MET 669 CO -0.01 0.44 -0.13 0.78 0.23 0.00 0.00 176.91 178.21 1sb3 h GLY 670 N 0.94 1.07 1.40 1.39 0.00 -0.37 -2.15 103.07 105.36 1sb3 h GLY 670 Ca 0.03 -0.89 -0.02 0.00 0.00 0.00 0.00 47.33 46.45 1sb3 h GLY 670 CO 0.04 0.82 0.28 1.98 0.00 0.00 0.00 176.54 179.66 1sb3 h MET 671 N 0.85 0.78 -0.40 4.80 -1.53 -0.43 0.29 114.93 119.29 1sb3 h MET 671 Ca 0.13 -0.09 -0.06 0.00 -3.44 0.00 0.00 59.70 56.24 1sb3 h MET 671 Cb 0.70 -0.15 -0.02 0.00 -0.55 0.00 0.00 31.60 31.58 1sb3 h MET 671 CO 0.05 0.60 0.03 0.78 0.14 0.00 0.00 176.91 178.51 1sb3 h GLY 672 N 0.88 0.75 1.73 1.39 0.00 -0.88 0.20 103.07 107.13 1sb3 h GLY 672 Ca 0.20 -0.53 -0.10 0.00 0.00 0.00 0.00 47.33 46.90 1sb3 h GLY 672 CO -0.03 0.49 -0.37 -1.61 0.00 0.00 0.00 176.54 175.02 1sb3 h GLN 673 N 0.53 0.31 -0.18 4.80 4.15 -0.92 0.78 115.11 124.58 1sb3 h GLN 673 Ca 0.12 -0.14 -0.18 0.00 0.77 0.00 0.00 58.65 59.22 1sb3 h GLN 673 Cb 0.43 -0.01 -0.00 0.00 0.21 0.00 0.00 27.48 28.11 1sb3 h GLN 673 CO 0.01 0.64 -0.62 0.00 -1.93 0.00 0.00 178.83 176.94 1sb3 h ALA 674 N 1.35 0.58 0.00 3.38 0.00 -0.00 -3.36 119.26 121.21 1sb3 h ALA 674 Ca 0.03 -0.54 -0.18 0.00 0.00 0.00 0.00 54.91 54.22 1sb3 h ALA 674 Cb 0.77 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 1sb3 h ALA 674 CO 0.06 0.70 -1.67 1.28 0.00 0.00 0.00 179.25 179.62 1sb3 n LEU 675 N -3.94 0.37 0.00 0.00 4.77 0.02 0.42 117.00 118.65 1sb3 n LEU 675 Ca -0.04 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 1sb3 n LEU 675 Cb 0.65 0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.89 1sb3 n LEU 675 CO 0.49 0.30 -0.00 -1.54 -1.33 0.00 0.00 177.39 175.30 1sb3 n SER 676 N -2.42 0.02 -4.78 -1.43 3.41 -0.66 -3.43 113.62 104.34 1sb3 n SER 676 Ca -0.16 -0.02 -0.38 0.00 -0.26 0.00 0.00 58.87 58.05 1sb3 n SER 676 Cb 0.80 0.03 -0.06 0.00 -0.26 0.00 0.00 64.21 64.73 1sb3 n SER 676 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1sb3 s GLU 677 N -0.04 4.21 -0.28 4.33 2.02 0.18 -4.20 118.70 124.92 1sb3 s GLU 677 Ca 0.00 0.57 -0.25 0.00 0.02 0.00 0.00 54.97 55.31 1sb3 s GLU 677 Cb 0.00 -3.33 0.14 0.00 0.10 0.00 0.00 34.13 31.04 1sb3 s GLU 677 CO 0.00 0.43 1.12 -1.83 0.02 0.00 0.00 175.26 174.99 1sb3 s GLU 678 N -0.30 0.41 0.45 1.61 -1.05 -1.26 -4.43 118.70 114.12 1sb3 s GLU 678 Ca 0.27 0.48 -0.05 0.00 -0.15 0.00 0.00 54.97 55.52 1sb3 s GLU 678 Cb -0.17 0.20 -0.04 0.00 -0.44 0.00 0.00 34.13 33.68 1sb3 s GLU 678 CO 0.14 -0.05 0.74 0.95 0.95 0.00 0.00 175.26 177.99 1sb3 s THR 679 N 0.15 4.93 -0.08 1.83 -4.23 -0.65 -4.82 115.64 112.77 1sb3 s THR 679 Ca 0.04 0.14 -0.03 0.00 -1.18 0.00 0.00 61.69 60.65 1sb3 s THR 679 Cb -0.05 -3.85 0.05 0.00 1.34 0.00 0.00 72.50 69.99 1sb3 s THR 679 CO -0.08 -0.75 0.15 -0.69 -0.54 0.00 0.00 174.62 172.71 1sb3 s VAL 680 N -2.61 -0.23 0.09 2.29 1.01 -1.26 -4.76 120.40 114.92 1sb3 s VAL 680 Ca 0.46 0.35 0.07 0.00 0.00 0.00 0.00 61.98 62.86 1sb3 s VAL 680 Cb -0.10 -0.28 -0.04 0.00 0.00 0.00 0.00 36.38 35.96 1sb3 s VAL 680 CO 0.42 0.14 -0.10 -0.31 0.00 0.00 0.00 175.10 175.25 1sb3 s TYR 681 N 2.19 2.76 -0.30 5.22 1.51 -1.26 -0.59 117.35 126.88 1sb3 s TYR 681 Ca 0.02 -0.14 -0.01 0.00 -1.01 0.00 0.00 57.07 55.92 1sb3 s TYR 681 Cb -0.12 -1.46 0.10 0.00 -0.11 0.00 0.00 41.96 40.37 1sb3 s TYR 681 CO -0.06 0.41 0.10 0.34 -1.11 0.00 0.00 175.55 175.23 1sb3 s ASP 682 N -2.08 3.86 -1.51 2.29 3.68 0.21 -4.80 116.67 118.31 1sb3 s ASP 682 Ca 0.21 -1.51 -0.09 0.00 2.13 0.00 0.00 52.55 53.28 1sb3 s ASP 682 Cb -0.11 -0.76 0.07 0.00 -1.45 0.00 0.00 42.92 40.67 1sb3 s ASP 682 CO 0.13 -0.41 0.75 -3.20 0.13 0.00 0.00 175.17 172.57 1sb3 n ASN 683 N 4.93 -2.74 0.00 -0.34 4.05 -1.26 -1.14 115.26 118.77 1sb3 n ASN 683 Ca -0.03 -0.90 0.00 0.00 0.45 0.00 0.00 54.58 54.10 1sb3 n ASN 683 Cb 0.42 -3.43 0.00 0.00 1.23 0.00 0.00 39.78 38.01 1sb3 n ASN 683 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1sb3 n GLY 684 N -1.67 3.23 3.73 8.20 0.00 -1.26 -4.84 105.19 112.57 1sb3 n GLY 684 Ca -0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 1sb3 n GLY 684 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1sb3 s ARG 685 N -0.53 4.65 0.14 1.61 0.52 -0.29 -4.40 118.95 120.65 1sb3 s ARG 685 Ca 0.00 1.40 -0.30 0.00 -0.52 0.00 0.00 55.73 56.31 1sb3 s ARG 685 Cb 0.00 -3.39 -0.07 0.00 0.52 0.00 0.00 34.95 32.01 1sb3 s ARG 685 CO 0.00 0.17 1.05 1.41 0.02 0.00 0.00 175.30 177.96 1sb3 s MET 686 N 0.19 4.61 -0.08 3.54 -2.45 -1.26 -0.62 119.30 123.23 1sb3 s MET 686 Ca 0.47 1.62 0.12 0.00 -1.25 0.00 0.00 55.69 56.65 1sb3 s MET 686 Cb -0.23 -3.33 -0.18 0.00 1.25 0.00 0.00 34.83 32.35 1sb3 s MET 686 CO 0.29 0.09 0.15 0.28 1.05 0.00 0.00 175.02 176.87 1sb3 n VAL 687 N 2.73 0.51 -0.14 10.11 0.31 0.24 -4.62 118.33 127.47 1sb3 n VAL 687 Ca 0.03 -0.44 0.05 0.00 -0.01 0.00 0.00 64.34 63.96 1sb3 n VAL 687 Cb 0.47 -0.32 0.25 0.00 -0.91 0.00 0.00 33.84 33.34 1sb3 n VAL 687 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1sb3 n HIS 688 N -2.27 1.27 -0.29 3.52 1.44 -1.25 -4.81 115.22 112.83 1sb3 n HIS 688 Ca -0.13 -0.44 -0.01 0.00 -2.01 0.00 0.00 57.72 55.12 1sb3 n HIS 688 Cb 0.68 -0.34 -0.02 0.00 0.12 0.00 0.00 29.99 30.44 1sb3 n HIS 688 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1sb3 n GLY 689 N 0.45 1.58 3.72 -1.39 0.00 -1.26 -4.06 105.19 104.22 1sb3 n GLY 689 Ca 0.17 -0.13 -0.08 0.00 0.00 0.00 0.00 46.02 45.99 1sb3 n GLY 689 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sb3 s ASN 690 N 2.11 -0.34 -0.17 1.61 2.20 -1.26 -4.10 114.94 114.99 1sb3 s ASN 690 Ca 0.07 -0.41 0.09 0.00 -0.94 0.00 0.00 52.86 51.67 1sb3 s ASN 690 Cb 0.03 0.66 0.53 0.00 -2.00 0.00 0.00 41.25 40.48 1sb3 s ASN 690 CO 0.00 -1.18 1.34 -0.38 -2.94 0.00 0.00 177.10 173.94 1sb3 n ILE 691 N -0.43 1.87 -0.12 0.54 5.41 -1.26 -2.13 119.36 123.23 1sb3 n ILE 691 Ca -0.08 -0.95 -0.22 0.00 1.00 0.00 0.00 62.75 62.50 1sb3 n ILE 691 Cb 0.61 -0.38 -0.07 0.00 -0.71 0.00 0.00 39.64 39.08 1sb3 n ILE 691 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 176.55 176.44 1sb3 n LEU 692 N 0.33 1.95 -0.01 1.39 7.94 -1.26 -4.57 117.00 122.78 1sb3 n LEU 692 Ca 0.20 0.34 0.13 0.00 -1.11 0.00 0.00 56.01 55.57 1sb3 n LEU 692 Cb 0.91 -0.79 0.44 0.00 0.53 0.00 0.00 43.42 44.50 1sb3 n LEU 692 CO 0.23 0.27 0.71 0.47 -1.11 0.00 0.00 177.39 177.95 1sb3 n ASP 693 N -4.33 0.28 -4.28 1.96 8.00 -1.25 -4.29 116.55 112.64 1sb3 n ASP 693 Ca -0.40 0.06 -0.41 0.00 0.71 0.00 0.00 54.79 54.76 1sb3 n ASP 693 Cb 0.75 -0.10 -0.10 0.00 -0.02 0.00 0.00 41.12 41.65 1sb3 n ASP 693 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1sb3 s TYR 694 N -2.97 3.33 -1.28 1.24 5.04 -0.91 -4.86 117.35 116.96 1sb3 s TYR 694 Ca 0.13 -1.49 -0.17 0.00 -2.44 0.00 0.00 57.07 53.11 1sb3 s TYR 694 Cb 0.18 -2.98 0.09 0.00 0.35 0.00 0.00 41.96 39.61 1sb3 s TYR 694 CO 0.61 -0.84 1.66 1.03 -1.34 0.00 0.00 175.55 176.67 1sb3 s ARG 695 N 1.44 4.01 0.10 4.97 0.52 -1.26 -4.54 118.95 124.20 1sb3 s ARG 695 Ca 0.03 -2.14 -0.31 0.00 -0.52 0.00 0.00 55.73 52.79 1sb3 s ARG 695 Cb -0.23 -5.42 -0.08 0.00 0.52 0.00 0.00 34.95 29.74 1sb3 s ARG 695 CO 0.02 -2.14 1.46 0.08 0.02 0.00 0.00 175.30 174.74 1sb3 s VAL 696 N 3.57 3.20 0.37 3.52 1.01 -1.26 -4.12 120.40 126.69 1sb3 s VAL 696 Ca 0.51 0.81 -0.28 0.00 0.00 0.00 0.00 61.98 63.03 1sb3 s VAL 696 Cb 0.02 -3.52 -0.11 0.00 0.00 0.00 0.00 36.38 32.77 1sb3 s VAL 696 CO 0.06 0.05 1.37 -2.65 0.00 0.00 0.00 175.10 173.93 1sb3 n PRO 697 N 4.34 2.33 -2.34 2.72 -0.02 -1.26 -5.01 135.00 135.77 1sb3 n PRO 697 Ca 0.13 0.82 -0.25 0.00 -2.02 0.00 0.00 63.50 62.18 1sb3 n PRO 697 Cb 0.42 -2.48 0.07 0.00 -0.02 0.00 0.00 33.50 31.49 1sb3 n PRO 697 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1sb3 s THR 698 N -1.12 2.33 0.40 3.45 -4.23 -1.26 -4.97 115.64 110.24 1sb3 s THR 698 Ca 0.55 -0.39 0.35 0.00 -1.18 0.00 0.00 61.69 61.02 1sb3 s THR 698 Cb -0.52 -2.94 0.38 0.00 1.34 0.00 0.00 72.50 70.76 1sb3 s THR 698 CO 0.62 0.00 2.14 -0.29 -0.54 0.00 0.00 174.62 176.56 1sb3 h ILE 699 N -0.51 0.20 0.03 2.99 2.10 -1.95 -3.00 117.51 117.37 1sb3 h ILE 699 Ca -0.43 -0.35 -0.00 0.00 1.08 0.00 0.00 64.86 65.16 1sb3 h ILE 699 Cb 1.30 1.29 0.00 0.00 -1.09 0.00 0.00 36.82 38.32 1sb3 h ILE 699 CO 0.54 0.04 -0.01 0.58 -1.08 0.00 0.00 178.15 178.22 1sb3 h VAL 700 N 0.00 1.24 -0.00 2.19 2.07 -2.02 -3.21 116.25 116.51 1sb3 h VAL 700 Ca -0.00 -0.84 0.00 0.00 0.82 0.00 0.00 66.70 66.68 1sb3 h VAL 700 Cb 0.28 1.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.85 1sb3 h VAL 700 CO 0.01 0.21 -0.27 -1.84 0.02 0.00 0.00 177.57 175.71 1sb3 n GLU 701 N -4.93 0.51 -2.15 1.57 0.00 -1.22 -4.91 120.64 109.51 1sb3 n GLU 701 Ca -0.08 -0.26 -0.41 0.00 0.00 0.00 0.00 57.16 56.41 1sb3 n GLU 701 Cb 0.20 -1.49 -0.03 0.00 0.00 0.00 0.00 31.44 30.12 1sb3 n GLU 701 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.13 176.01 1sb3 s SER 702 N -2.66 6.82 0.77 -1.84 0.01 -1.14 -4.51 113.70 111.15 1sb3 s SER 702 Ca 0.21 2.49 -0.11 0.00 1.31 0.00 0.00 55.95 59.86 1sb3 s SER 702 Cb 0.19 -2.62 0.06 0.00 0.21 0.00 0.00 66.02 63.86 1sb3 s SER 702 CO 0.56 -0.58 1.10 -2.16 0.41 0.00 0.00 173.24 172.57 1sb3 s PRO 703 N -0.27 2.20 0.43 12.44 0.04 -1.24 -4.99 135.00 143.61 1sb3 s PRO 703 Ca 0.57 1.24 -0.21 0.00 0.04 0.00 0.00 61.00 62.64 1sb3 s PRO 703 Cb -0.38 -1.89 -0.10 0.00 0.04 0.00 0.00 34.50 32.17 1sb3 s PRO 703 CO 0.40 -1.70 0.97 0.34 0.04 0.00 0.00 177.00 177.06 1sb3 s ASP 704 N -3.22 6.84 -0.09 6.66 3.68 -0.70 -4.93 116.67 124.91 1sb3 s ASP 704 Ca 0.62 1.75 -0.01 0.00 2.13 0.00 0.00 52.55 57.04 1sb3 s ASP 704 Cb -0.18 -2.55 0.03 0.00 -1.45 0.00 0.00 42.92 38.77 1sb3 s ASP 704 CO 0.54 -0.43 -0.01 -0.63 0.13 0.00 0.00 175.17 174.78 1sb3 s ILE 705 N -2.11 0.48 -0.23 4.11 1.01 -1.26 -1.34 121.20 121.87 1sb3 s ILE 705 Ca 0.62 -0.01 -0.08 0.00 0.00 0.00 0.00 60.65 61.18 1sb3 s ILE 705 Cb -0.11 -0.66 -0.04 0.00 0.01 0.00 0.00 42.46 41.66 1sb3 s ILE 705 CO 0.15 0.22 0.10 -0.70 0.00 0.00 0.00 174.94 174.71 1sb3 s GLU 706 N 1.92 3.88 -0.15 2.79 2.12 0.06 -4.98 118.70 124.34 1sb3 s GLU 706 Ca 0.04 -0.37 -0.06 0.00 0.36 0.00 0.00 54.97 54.94 1sb3 s GLU 706 Cb -0.13 -3.36 -0.04 0.00 0.26 0.00 0.00 34.13 30.86 1sb3 s GLU 706 CO -0.06 0.02 0.05 0.08 -0.54 0.00 0.00 175.26 174.81 1sb3 s VAL 707 N 1.09 4.68 -0.18 3.70 1.01 -1.26 -0.98 120.40 128.46 1sb3 s VAL 707 Ca 0.05 -0.08 0.01 0.00 0.00 0.00 0.00 61.98 61.96 1sb3 s VAL 707 Cb -0.14 -3.06 0.02 0.00 0.00 0.00 0.00 36.38 33.19 1sb3 s VAL 707 CO 0.04 0.52 -0.19 -0.63 0.00 0.00 0.00 175.10 174.83 1sb3 s ILE 708 N -0.10 2.15 -0.11 2.22 1.01 0.29 -4.97 121.20 121.69 1sb3 s ILE 708 Ca 0.06 -0.91 -0.21 0.00 0.00 0.00 0.00 60.65 59.59 1sb3 s ILE 708 Cb -0.12 -1.90 -0.04 0.00 0.01 0.00 0.00 42.46 40.41 1sb3 s ILE 708 CO 0.01 0.53 0.58 -0.63 0.00 0.00 0.00 174.94 175.44 1sb3 s ILE 709 N 1.28 5.11 -0.10 2.92 1.01 -1.26 -1.22 121.20 128.94 1sb3 s ILE 709 Ca 0.04 1.17 0.01 0.00 0.00 0.00 0.00 60.65 61.88 1sb3 s ILE 709 Cb -0.13 -3.92 -0.02 0.00 0.01 0.00 0.00 42.46 38.40 1sb3 s ILE 709 CO -0.12 0.27 -0.14 -0.69 0.00 0.00 0.00 174.94 174.27 1sb3 s VAL 710 N 0.86 3.05 -0.50 2.92 1.01 0.43 -4.91 120.40 123.25 1sb3 s VAL 710 Ca 0.31 -0.69 0.03 0.00 0.00 0.00 0.00 61.98 61.63 1sb3 s VAL 710 Cb -0.16 -2.25 0.13 0.00 0.00 0.00 0.00 36.38 34.11 1sb3 s VAL 710 CO 0.13 0.55 0.26 -1.61 0.00 0.00 0.00 175.10 174.44 1sb3 s GLU 711 N -0.06 1.79 0.00 2.72 2.02 -1.26 -1.70 118.70 122.21 1sb3 s GLU 711 Ca -0.03 -2.47 0.22 0.00 0.02 0.00 0.00 54.97 52.72 1sb3 s GLU 711 Cb -0.14 -3.02 1.15 0.00 0.10 0.00 0.00 34.13 32.22 1sb3 s GLU 711 CO 0.04 -1.13 1.73 -1.13 0.02 0.00 0.00 175.26 174.78 1sb3 n SER 712 N 3.18 0.00 -3.02 -0.19 3.41 -1.16 -4.85 113.62 110.98 1sb3 n SER 712 Ca 0.07 -0.10 -0.13 0.00 -0.26 0.00 0.00 58.87 58.45 1sb3 n SER 712 Cb 0.33 -0.26 0.01 0.00 -0.26 0.00 0.00 64.21 64.04 1sb3 n SER 712 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1sb3 n MET 713 N -1.26 -2.26 -2.26 4.33 2.81 0.69 -4.76 117.12 114.41 1sb3 n MET 713 Ca 0.11 1.94 -0.42 0.00 -1.81 0.00 0.00 57.70 57.53 1sb3 n MET 713 Cb 0.17 -4.16 -0.03 0.00 -0.71 0.00 0.00 33.22 28.49 1sb3 n MET 713 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1sb3 s ASP 714 N -1.92 6.94 0.63 7.83 -1.08 0.24 -4.91 116.67 124.39 1sb3 s ASP 714 Ca 0.20 2.28 0.39 0.00 -0.52 0.00 0.00 52.55 54.90 1sb3 s ASP 714 Cb -0.04 -2.60 2.14 0.00 -1.46 0.00 0.00 42.92 40.96 1sb3 s ASP 714 CO 0.71 -0.53 2.30 1.55 0.52 0.00 0.00 175.17 179.71 1sb3 h PRO 715 N 6.04 0.00 -0.00 4.34 0.13 -1.87 -3.07 132.00 137.56 1sb3 h PRO 715 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1sb3 h PRO 715 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1sb3 h PRO 715 CO 0.80 0.01 -0.54 0.09 -0.23 0.00 0.00 178.00 178.13 1sb3 n ASN 716 N -3.33 0.69 -4.83 1.44 4.13 -1.26 -4.95 115.26 107.15 1sb3 n ASN 716 Ca -0.03 -0.84 -0.32 0.00 1.68 0.00 0.00 54.58 55.07 1sb3 n ASN 716 Cb 0.10 0.93 0.01 0.00 -1.54 0.00 0.00 39.78 39.28 1sb3 n ASN 716 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 1sb3 s GLY 717 N -2.09 1.84 -0.12 7.41 0.00 -1.16 -4.94 107.32 108.27 1sb3 s GLY 717 Ca 0.05 0.12 -0.29 0.00 0.00 0.00 0.00 44.72 44.61 1sb3 s GLY 717 CO 0.48 0.41 2.01 2.56 0.00 0.00 0.00 173.10 178.56 1sb3 s PRO 718 N -4.68 3.66 -1.74 2.90 0.04 -1.26 -0.81 135.00 133.10 1sb3 s PRO 718 Ca 0.59 2.19 0.00 0.00 0.04 0.00 0.00 61.00 63.82 1sb3 s PRO 718 Cb -0.13 -4.23 0.00 0.00 0.04 0.00 0.00 34.50 30.18 1sb3 s PRO 718 CO 0.46 -1.50 0.00 1.19 0.04 0.00 0.00 177.00 177.19 1sb3 n PHE 719 N 9.44 -0.58 -0.47 0.56 3.72 -1.26 -1.35 117.46 127.52 1sb3 n PHE 719 Ca 0.24 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.64 1sb3 n PHE 719 Cb 0.43 -3.32 0.00 0.00 -0.94 0.00 0.00 39.48 35.65 1sb3 n PHE 719 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1sb3 n GLY 720 N -0.60 0.75 3.78 1.37 0.00 0.01 -4.76 105.19 105.74 1sb3 n GLY 720 Ca -0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.48 1sb3 n GLY 720 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sb3 s ALA 721 N -2.95 2.82 0.38 4.61 0.00 -0.46 -0.60 121.76 125.57 1sb3 s ALA 721 Ca 0.00 0.73 0.04 0.00 0.00 0.00 0.00 51.96 52.72 1sb3 s ALA 721 Cb 0.00 -3.31 -0.04 0.00 0.00 0.00 0.00 23.12 19.77 1sb3 s ALA 721 CO 0.00 -0.52 0.09 0.15 0.00 0.00 0.00 175.76 175.48 1sb3 s LYS 722 N -3.17 1.84 1.21 0.00 1.02 0.38 -4.06 119.74 116.97 1sb3 s LYS 722 Ca 0.69 -2.09 -0.14 0.00 0.02 0.00 0.00 55.97 54.45 1sb3 s LYS 722 Cb -0.21 -0.80 0.31 0.00 -0.52 0.00 0.00 37.83 36.61 1sb3 s LYS 722 CO 0.24 -0.35 1.01 -1.83 -0.92 0.00 0.00 175.35 173.50 1sb3 s GLU 723 N -3.80 -1.32 0.00 1.68 4.04 -1.26 -4.71 118.70 113.32 1sb3 s GLU 723 Ca 0.27 0.75 0.09 0.00 0.04 0.00 0.00 54.97 56.12 1sb3 s GLU 723 Cb 0.05 -1.51 0.15 0.00 0.02 0.00 0.00 34.13 32.83 1sb3 s GLU 723 CO 0.14 -3.97 1.05 0.00 -1.84 0.00 0.00 175.26 170.64 1sb3 n ALA 724 N -5.08 3.24 0.00 -0.84 0.00 -1.26 -4.58 120.51 111.99 1sb3 n ALA 724 Ca 0.03 -1.25 0.00 0.00 0.00 0.00 0.00 53.44 52.22 1sb3 n ALA 724 Cb 0.55 -0.47 0.00 0.00 0.00 0.00 0.00 19.45 19.53 1sb3 n ALA 724 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1sb3 n SER 725 N 0.17 1.55 -0.04 0.00 3.41 -1.26 -3.95 113.62 113.51 1sb3 n SER 725 Ca -0.16 -0.01 -0.05 0.00 -0.26 0.00 0.00 58.87 58.39 1sb3 n SER 725 Cb 0.85 0.33 -0.04 0.00 -0.26 0.00 0.00 64.21 65.08 1sb3 n SER 725 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1sb3 n GLU 726 N -0.48 1.02 0.11 4.33 1.02 -1.26 -4.58 120.64 120.79 1sb3 n GLU 726 Ca 0.00 0.03 0.05 0.00 -0.02 0.00 0.00 57.16 57.23 1sb3 n GLU 726 Cb 0.00 -1.17 0.28 0.00 -0.02 0.00 0.00 31.44 30.53 1sb3 n GLU 726 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1sb3 n GLY 727 N 2.94 -0.58 0.38 0.62 0.00 -1.26 -2.22 105.19 105.06 1sb3 n GLY 727 Ca -0.14 0.10 0.08 0.00 0.00 0.00 0.00 46.02 46.06 1sb3 n GLY 727 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1sb3 n MET 728 N -1.86 1.59 0.03 1.61 0.00 -1.26 -2.83 117.12 114.39 1sb3 n MET 728 Ca -0.01 -0.81 -0.13 0.00 0.00 0.00 0.00 57.70 56.75 1sb3 n MET 728 Cb 0.20 -1.31 -0.09 0.00 0.00 0.00 0.00 33.22 32.02 1sb3 n MET 728 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 175.97 177.22 1sb3 h LEU 729 N 1.84 -0.08 -0.86 3.17 6.46 -1.64 -3.34 115.31 120.86 1sb3 h LEU 729 Ca 0.00 -0.39 0.07 0.00 -0.12 0.00 0.00 57.88 57.44 1sb3 h LEU 729 Cb 0.58 0.02 -0.07 0.00 -0.73 0.00 0.00 40.66 40.46 1sb3 h LEU 729 CO 0.00 0.36 0.52 0.00 -0.62 0.00 0.00 178.44 178.71 1sb3 h ALA 730 N 0.33 1.20 -0.75 1.25 0.00 -1.84 -3.03 119.26 116.42 1sb3 h ALA 730 Ca -0.01 0.00 0.22 0.00 0.00 0.00 0.00 54.91 55.12 1sb3 h ALA 730 Cb 0.47 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1sb3 h ALA 730 CO 0.02 0.23 0.59 0.78 0.00 0.00 0.00 179.25 180.86 1sb3 h GLY 731 N 0.92 0.00 1.19 0.00 0.00 -1.79 -2.36 103.07 101.04 1sb3 h GLY 731 Ca 0.39 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.68 1sb3 h GLY 731 CO -0.20 0.00 0.28 -2.75 0.00 0.00 0.00 176.54 173.87 1sb3 h PHE 732 N 0.00 1.04 0.45 5.60 3.57 -1.72 -2.37 116.94 123.51 1sb3 h PHE 732 Ca 0.36 -0.07 -0.01 0.00 3.53 0.00 0.00 57.97 61.78 1sb3 h PHE 732 Cb 1.54 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 39.94 1sb3 h PHE 732 CO 0.00 0.79 -0.38 -0.07 -2.23 0.00 0.00 178.31 176.43 1sb3 h LEU 733 N 1.01 -1.00 -0.67 0.59 4.07 -1.64 -1.49 115.31 116.17 1sb3 h LEU 733 Ca 0.24 0.08 -0.09 0.00 0.08 0.00 0.00 57.88 58.18 1sb3 h LEU 733 Cb 0.19 0.32 -0.02 0.00 1.08 0.00 0.00 40.66 42.23 1sb3 h LEU 733 CO -0.02 -0.54 0.01 1.55 -1.08 0.00 0.00 178.44 178.36 1sb3 h PRO 734 N -0.83 1.04 -0.44 1.13 0.13 -1.72 -1.64 132.00 129.68 1sb3 h PRO 734 Ca -0.04 -0.32 0.06 0.00 -0.87 0.00 0.00 66.00 64.83 1sb3 h PRO 734 Cb 0.71 -0.10 -0.05 0.00 0.13 0.00 0.00 31.00 31.69 1sb3 h PRO 734 CO -0.02 1.01 0.15 0.00 -0.23 0.00 0.00 178.00 178.91 1sb3 h ALA 735 N 1.04 0.52 0.00 -0.56 0.00 -1.30 -0.30 119.26 118.66 1sb3 h ALA 735 Ca 0.17 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1sb3 h ALA 735 Cb 0.53 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 1sb3 h ALA 735 CO 0.03 -0.25 -0.01 0.97 0.00 0.00 0.00 179.25 179.99 1sb3 h ILE 736 N 0.31 0.02 -0.17 0.00 2.10 -1.21 -2.05 117.51 116.51 1sb3 h ILE 736 Ca 0.21 -0.85 -0.01 0.00 1.08 0.00 0.00 64.86 65.28 1sb3 h ILE 736 Cb 0.21 1.84 -0.01 0.00 -1.09 0.00 0.00 36.82 37.77 1sb3 h ILE 736 CO -0.22 0.01 0.05 -0.74 -1.08 0.00 0.00 178.15 176.17 1sb3 h HIS 737 N 0.00 0.27 -0.46 2.19 2.76 -0.20 -1.27 115.15 118.45 1sb3 h HIS 737 Ca -0.00 -0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.12 1sb3 h HIS 737 Cb 0.84 -0.08 -0.02 0.00 1.55 0.00 0.00 27.41 29.70 1sb3 h HIS 737 CO 0.00 0.37 0.21 1.49 -1.30 0.00 0.00 177.93 178.71 1sb3 h GLU 738 N 0.10 0.67 -0.71 5.26 4.81 -0.91 -2.01 114.58 121.78 1sb3 h GLU 738 Ca 0.05 -0.10 0.07 0.00 -0.13 0.00 0.00 59.36 59.25 1sb3 h GLU 738 Cb 0.23 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 29.45 1sb3 h GLU 738 CO -0.00 0.58 0.47 0.00 -0.73 0.00 0.00 179.01 179.32 1sb3 h ALA 739 N 1.06 1.72 -0.05 2.92 0.00 -1.18 -0.40 119.26 123.32 1sb3 h ALA 739 Ca 0.16 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.91 1sb3 h ALA 739 Cb 0.13 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1sb3 h ALA 739 CO -0.02 0.17 -0.59 0.28 0.00 0.00 0.00 179.25 179.08 1sb3 h VAL 740 N 0.73 1.39 -0.25 0.00 2.07 -0.86 -0.71 116.25 118.62 1sb3 h VAL 740 Ca 0.31 -1.98 -0.08 0.00 0.82 0.00 0.00 66.70 65.77 1sb3 h VAL 740 Cb 0.27 2.01 -0.01 0.00 -1.52 0.00 0.00 31.29 32.05 1sb3 h VAL 740 CO -0.10 0.58 -0.14 0.22 0.02 0.00 0.00 177.57 178.15 1sb3 h TYR 741 N 0.13 0.63 -0.04 1.57 3.20 -0.40 -1.37 116.97 120.68 1sb3 h TYR 741 Ca -0.01 -0.16 -0.09 0.00 3.14 0.00 0.00 58.73 61.62 1sb3 h TYR 741 Cb 1.08 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 39.20 1sb3 h TYR 741 CO 0.02 0.81 -0.38 1.49 -1.64 0.00 0.00 178.16 178.45 1sb3 h GLU 742 N 0.26 0.08 -0.06 1.82 4.81 -1.10 0.19 114.58 120.58 1sb3 h GLU 742 Ca 0.05 -0.03 -0.22 0.00 -0.13 0.00 0.00 59.36 59.03 1sb3 h GLU 742 Cb 0.65 -0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.04 1sb3 h GLU 742 CO 0.04 0.45 -0.83 0.00 -0.73 0.00 0.00 179.01 177.94 1sb3 h ALA 743 N 1.55 0.18 0.00 2.92 0.00 -0.97 -3.42 119.26 119.52 1sb3 h ALA 743 Ca 0.01 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.29 1sb3 h ALA 743 Cb 0.71 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1sb3 h ALA 743 CO 0.05 0.60 0.00 1.33 0.00 0.00 0.00 179.25 181.23 1sb3 n VAL 744 N -3.98 0.06 -1.08 0.00 0.24 -0.53 -2.76 118.33 110.27 1sb3 n VAL 744 Ca -0.09 -0.08 -0.03 0.00 -2.04 0.00 0.00 64.34 62.10 1sb3 n VAL 744 Cb 0.77 1.37 -0.01 0.00 -1.47 0.00 0.00 33.84 34.51 1sb3 n VAL 744 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1sb3 n GLY 745 N -0.03 0.60 3.54 7.63 0.00 0.65 -5.02 105.19 112.57 1sb3 n GLY 745 Ca 0.00 -0.65 -0.28 0.00 0.00 0.00 0.00 46.02 45.10 1sb3 n GLY 745 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1sb3 s VAL 746 N -2.05 3.09 -0.37 1.61 -7.23 -1.26 -5.00 120.40 109.19 1sb3 s VAL 746 Ca 0.00 -1.58 -0.01 0.00 -1.81 0.00 0.00 61.98 58.58 1sb3 s VAL 746 Cb 0.00 -2.49 0.10 0.00 0.56 0.00 0.00 36.38 34.55 1sb3 s VAL 746 CO 0.00 -0.02 0.12 -0.13 -0.31 0.00 0.00 175.10 174.75 1sb3 s ARG 747 N -2.56 1.95 0.50 4.82 0.52 -1.26 -3.70 118.95 119.22 1sb3 s ARG 747 Ca 0.22 -1.72 -0.22 0.00 -0.52 0.00 0.00 55.73 53.50 1sb3 s ARG 747 Cb -0.10 -3.39 -0.06 0.00 0.52 0.00 0.00 34.95 31.92 1sb3 s ARG 747 CO 0.13 -0.94 1.18 0.00 0.02 0.00 0.00 175.30 175.69 1sb3 s ALA 748 N 1.10 2.85 0.00 2.13 0.00 -1.26 -4.94 121.76 121.64 1sb3 s ALA 748 Ca 0.06 0.95 0.00 0.00 0.00 0.00 0.00 51.96 52.97 1sb3 s ALA 748 Cb -0.21 -3.40 0.00 0.00 0.00 0.00 0.00 23.12 19.51 1sb3 s ALA 748 CO -0.05 -0.79 0.00 0.25 0.00 0.00 0.00 175.76 175.17 1sb3 n THR 749 N -0.84 0.00 -4.99 0.00 -2.24 -1.26 -5.03 114.28 99.92 1sb3 n THR 749 Ca 0.09 -0.37 -0.29 0.00 -2.27 0.00 0.00 64.05 61.21 1sb3 n THR 749 Cb 0.49 0.98 -0.17 0.00 -2.10 0.00 0.00 70.33 69.53 1sb3 n THR 749 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1sb3 s ASP 750 N -0.79 2.60 0.01 3.42 1.01 -1.26 -0.64 116.67 121.03 1sb3 s ASP 750 Ca 0.00 -0.46 0.01 0.00 0.71 0.00 0.00 52.55 52.80 1sb3 s ASP 750 Cb 0.00 -1.18 -0.04 0.00 1.01 0.00 0.00 42.92 42.72 1sb3 s ASP 750 CO 0.00 0.12 0.06 -0.36 0.21 0.00 0.00 175.17 175.20 1sb3 s PHE 751 N 0.44 3.22 0.72 4.23 0.40 -0.18 -4.16 117.98 122.64 1sb3 s PHE 751 Ca -0.17 0.16 -0.11 0.00 -0.60 0.00 0.00 56.93 56.21 1sb3 s PHE 751 Cb -0.17 -1.70 0.02 0.00 0.51 0.00 0.00 43.02 41.68 1sb3 s PHE 751 CO 0.07 0.53 1.07 -1.25 0.70 0.00 0.00 175.22 176.34 1sb3 s PRO 752 N -1.79 2.71 -0.61 0.24 0.04 -1.26 -1.49 135.00 132.85 1sb3 s PRO 752 Ca 0.23 1.05 -0.06 0.00 0.04 0.00 0.00 61.00 62.26 1sb3 s PRO 752 Cb -0.12 -1.96 -0.08 0.00 0.04 0.00 0.00 34.50 32.38 1sb3 s PRO 752 CO 0.14 -1.28 3.07 1.28 0.04 0.00 0.00 177.00 180.25 1sb3 n LEU 753 N -3.20 6.64 -4.71 -3.56 4.77 0.17 -4.85 117.00 112.25 1sb3 n LEU 753 Ca 0.08 -3.91 -0.29 0.00 -0.03 0.00 0.00 56.01 51.86 1sb3 n LEU 753 Cb 0.53 -1.38 0.15 0.00 -2.33 0.00 0.00 43.42 40.40 1sb3 n LEU 753 CO 0.54 1.83 0.66 -0.94 -1.33 0.00 0.00 177.39 178.16 1sb3 s SER 754 N 1.27 3.22 0.25 -1.43 1.04 -1.22 -4.65 113.70 112.18 1sb3 s SER 754 Ca 0.63 1.31 -0.02 0.00 0.48 0.00 0.00 55.95 58.34 1sb3 s SER 754 Cb 0.30 -1.98 0.50 0.00 0.10 0.00 0.00 66.02 64.94 1sb3 s SER 754 CO -0.09 -2.77 1.74 -0.65 0.98 0.00 0.00 173.24 172.44 1sb3 h PRO 755 N -1.64 0.49 -0.84 4.02 0.11 -1.85 -2.22 132.00 130.07 1sb3 h PRO 755 Ca -0.51 -0.03 0.04 0.00 0.11 0.00 0.00 66.00 65.60 1sb3 h PRO 755 Cb 1.30 -0.11 -0.05 0.00 0.11 0.00 0.00 31.00 32.25 1sb3 h PRO 755 CO 0.57 0.33 0.54 0.38 -0.21 0.00 0.00 178.00 179.60 1sb3 h ASP 756 N 0.51 0.88 0.24 -2.05 2.03 -1.89 -0.07 116.42 116.08 1sb3 h ASP 756 Ca 0.44 -0.00 -0.22 0.00 -0.73 0.00 0.00 57.03 56.52 1sb3 h ASP 756 Cb 0.66 -0.19 0.00 0.00 -0.83 0.00 0.00 39.33 38.97 1sb3 h ASP 756 CO -0.39 0.60 -0.87 0.03 -1.03 0.00 0.00 179.24 177.58 1sb3 h ARG 757 N 1.03 0.47 -0.25 4.15 3.08 -1.75 -2.77 114.38 118.34 1sb3 h ARG 757 Ca 0.34 -0.45 -0.06 0.00 0.07 0.00 0.00 59.98 59.88 1sb3 h ARG 757 Cb 0.04 0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 1sb3 h ARG 757 CO -0.13 1.09 -0.08 0.82 -1.07 0.00 0.00 179.97 180.61 1sb3 h ILE 758 N 0.29 1.29 -0.11 2.04 1.08 -1.17 -1.75 117.51 119.17 1sb3 h ILE 758 Ca -0.06 -1.11 -0.04 0.00 -0.39 0.00 0.00 64.86 63.25 1sb3 h ILE 758 Cb 1.48 1.50 -0.01 0.00 -3.07 0.00 0.00 36.82 36.73 1sb3 h ILE 758 CO 0.15 0.35 -0.13 0.71 -0.69 0.00 0.00 178.15 178.54 1sb3 h THR 759 N 0.23 1.16 -0.52 -0.27 1.35 -1.07 0.25 112.91 114.04 1sb3 h THR 759 Ca 0.06 -0.72 -0.10 0.00 -0.55 0.00 0.00 66.41 65.11 1sb3 h THR 759 Cb 0.56 1.22 -0.02 0.00 -1.73 0.00 0.00 68.15 68.19 1sb3 h THR 759 CO 0.03 0.22 -0.05 -0.33 -0.25 0.00 0.00 175.52 175.14 1sb3 h GLU 760 N 0.17 0.96 -0.56 4.72 5.08 -1.23 -0.34 114.58 123.38 1sb3 h GLU 760 Ca 0.04 -0.33 -0.08 0.00 -1.00 0.00 0.00 59.36 57.98 1sb3 h GLU 760 Cb 0.34 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 1sb3 h GLU 760 CO 0.02 1.00 0.01 -0.07 -1.00 0.00 0.00 179.01 178.97 1sb3 h LEU 761 N 0.83 0.92 -0.81 1.33 3.38 -0.47 -2.16 115.31 118.32 1sb3 h LEU 761 Ca 0.14 -0.24 -0.10 0.00 0.09 0.00 0.00 57.88 57.77 1sb3 h LEU 761 Cb 0.60 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1sb3 h LEU 761 CO 0.04 0.97 -0.22 -0.07 0.09 0.00 0.00 178.44 179.24 1sb3 h LEU 762 N 0.88 0.65 -0.76 1.67 3.38 -0.71 -2.04 115.31 118.37 1sb3 h LEU 762 Ca 0.16 -0.22 -0.13 0.00 0.09 0.00 0.00 57.88 57.79 1sb3 h LEU 762 Cb 0.50 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 1sb3 h LEU 762 CO 0.02 0.86 -0.60 0.44 0.09 0.00 0.00 178.44 179.26 1sb3 h ASP 763 N 0.57 0.00 0.08 -0.43 3.32 -0.77 -2.62 116.42 116.56 1sb3 h ASP 763 Ca 0.08 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.96 1sb3 h ASP 763 Cb 0.69 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.25 1sb3 h ASP 763 CO 0.05 0.60 -0.71 0.00 -1.72 0.00 0.00 179.24 177.46 1sb3 h ALA 764 N 1.40 -0.02 0.00 3.45 0.00 -1.27 -2.56 119.26 120.27 1sb3 h ALA 764 Ca -0.01 -0.64 -0.01 0.00 0.00 0.00 0.00 54.91 54.25 1sb3 h ALA 764 Cb 1.09 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 1sb3 h ALA 764 CO 0.08 0.36 -0.06 -0.22 0.00 0.00 0.00 179.25 179.41 1sb3 h LYS 765 N -0.26 0.00 0.00 0.00 3.64 -1.40 -0.46 116.57 118.09 1sb3 h LYS 765 Ca -0.11 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 1sb3 h LYS 765 Cb 1.49 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.31 1sb3 h LYS 765 CO 0.14 0.06 -0.77 1.49 -2.27 0.00 0.00 179.45 178.10 1sb3 h GLU 766 N 0.00 0.00 0.00 1.90 4.81 -1.46 -3.24 114.58 116.59 1sb3 h GLU 766 Ca -0.00 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.12 1sb3 h GLU 766 Cb 0.21 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 1sb3 h GLU 766 CO 0.01 0.00 -0.50 0.00 -0.73 0.00 0.00 179.01 177.78 1sb3 h ALA 767 N 2.39 0.90 -0.03 2.92 0.00 -0.65 -3.51 119.26 121.29 1sb3 h ALA 767 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1sb3 h ALA 767 Cb 0.81 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1sb3 h ALA 767 CO 0.00 0.63 0.00 0.00 0.00 0.00 0.00 179.25 179.88