#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h3g n THR 4 N 0.00 0.00 0.14 0.52 5.66 -1.26 -3.73 114.28 115.61 1h3g n THR 4 Ca 0.00 -0.07 0.10 0.00 -3.05 0.00 0.00 64.05 61.03 1h3g n THR 4 Cb 0.00 -0.02 0.61 0.00 -1.55 0.00 0.00 70.33 69.37 1h3g n THR 4 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1h3g h ALA 5 N -1.03 2.06 -2.73 1.79 0.00 -1.93 -1.84 119.26 115.58 1h3g h ALA 5 Ca -0.40 -0.01 -0.55 0.00 0.00 0.00 0.00 54.91 53.95 1h3g h ALA 5 Cb 1.39 -0.02 -0.40 0.00 0.00 0.00 0.00 17.79 18.76 1h3g h ALA 5 CO 0.22 -0.11 -0.80 0.42 0.00 0.00 0.00 179.25 178.98 1h3g s ILE 6 N -5.14 0.05 -0.10 0.00 1.01 -1.26 -3.89 121.20 111.86 1h3g s ILE 6 Ca -0.06 -1.12 0.15 0.00 0.00 0.00 0.00 60.65 59.62 1h3g s ILE 6 Cb 0.18 -1.06 -0.23 0.00 0.01 0.00 0.00 42.46 41.36 1h3g s ILE 6 CO 0.70 -0.82 0.47 1.21 0.00 0.00 0.00 174.94 176.50 1h3g n GLU 7 N 4.81 0.65 -2.56 2.79 4.07 0.20 -4.95 120.64 125.65 1h3g n GLU 7 Ca 0.00 0.18 -0.05 0.00 -0.06 0.00 0.00 57.16 57.23 1h3g n GLU 7 Cb 0.40 -1.70 -0.02 0.00 -0.06 0.00 0.00 31.44 30.07 1h3g n GLU 7 CO 0.00 0.00 0.00 0.72 -0.06 0.00 0.00 177.13 177.79 1h3g n HIS 8 N -2.92 -0.42 0.00 4.31 8.25 -0.53 -4.98 115.22 118.94 1h3g n HIS 8 Ca -0.22 -0.81 0.00 0.00 -0.26 0.00 0.00 57.72 56.43 1h3g n HIS 8 Cb 1.07 0.12 0.00 0.00 1.12 0.00 0.00 29.99 32.29 1h3g n HIS 8 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1h3g n GLU 10 N -0.19 0.00 -2.06 -0.41 1.02 -1.26 -0.47 120.64 117.28 1h3g n GLU 10 Ca 0.02 0.00 -0.33 0.00 -0.02 0.00 0.00 57.16 56.82 1h3g n GLU 10 Cb 0.18 0.00 0.01 0.00 -0.02 0.00 0.00 31.44 31.62 1h3g n GLU 10 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1h3g s PRO 11 N -0.37 3.23 0.56 3.49 0.04 -1.26 -4.40 135.00 136.29 1h3g s PRO 11 Ca 0.00 1.34 0.33 0.00 0.04 0.00 0.00 61.00 62.71 1h3g s PRO 11 Cb 0.00 -2.01 1.60 0.00 0.04 0.00 0.00 34.50 34.12 1h3g s PRO 11 CO 0.00 -0.90 2.09 -1.00 0.04 0.00 0.00 177.00 177.23 1h3g h PRO 12 N 0.58 0.00 -2.47 0.56 0.13 -1.99 -3.44 132.00 125.37 1h3g h PRO 12 Ca -0.48 0.00 0.14 0.00 -0.87 0.00 0.00 66.00 64.80 1h3g h PRO 12 Cb 1.23 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.28 1h3g h PRO 12 CO 0.57 0.06 0.43 -0.59 -0.23 0.00 0.00 178.00 178.24 1h3g s PHE 13 N -3.96 -0.19 0.00 1.56 -0.12 -1.26 -4.60 117.98 109.41 1h3g s PHE 13 Ca -0.02 -0.12 0.00 0.00 -0.05 0.00 0.00 56.93 56.75 1h3g s PHE 13 Cb 0.11 0.63 0.00 0.00 -0.63 0.00 0.00 43.02 43.14 1h3g s PHE 13 CO 0.54 -0.86 0.00 1.87 -0.05 0.00 0.00 175.22 176.72 1h3g n TRP 14 N -0.44 -0.03 -4.21 3.49 -0.00 -0.63 -5.02 117.44 110.60 1h3g n TRP 14 Ca -0.07 0.00 -0.19 0.00 -0.00 0.00 0.00 57.50 57.24 1h3g n TRP 14 Cb 0.61 0.00 -0.12 0.00 -0.00 0.00 0.00 31.31 31.80 1h3g n TRP 14 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 177.69 176.11 1h3g s TRP 15 N -2.01 1.39 0.53 5.87 0.51 -1.26 -0.28 118.94 123.68 1h3g s TRP 15 Ca 0.00 -0.47 -0.18 0.00 -2.12 0.00 0.00 56.10 53.33 1h3g s TRP 15 Cb 0.00 -0.76 -0.07 0.00 -0.81 0.00 0.00 33.47 31.83 1h3g s TRP 15 CO 0.00 0.11 1.03 0.00 -0.51 0.00 0.00 176.95 177.58 1h3g s ALA 16 N -1.45 2.86 -0.06 0.98 0.00 -0.15 -4.80 121.76 119.14 1h3g s ALA 16 Ca 0.02 0.45 -0.03 0.00 0.00 0.00 0.00 51.96 52.40 1h3g s ALA 16 Cb -0.09 -3.22 0.01 0.00 0.00 0.00 0.00 23.12 19.83 1h3g s ALA 16 CO 0.03 -0.45 0.06 0.41 0.00 0.00 0.00 175.76 175.80 1h3g n GLY 17 N -0.76 -3.56 0.15 0.00 0.00 -1.26 -4.44 105.19 95.33 1h3g n GLY 17 Ca 0.08 0.20 -0.22 0.00 0.00 0.00 0.00 46.02 46.08 1h3g n GLY 17 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1h3g n GLN 19 N 0.44 0.55 -2.85 1.61 -0.06 -1.26 -5.05 117.38 110.75 1h3g n GLN 19 Ca -0.10 0.23 -0.41 0.00 -2.00 0.00 0.00 57.00 54.72 1h3g n GLN 19 Cb 0.15 -1.44 -0.04 0.00 -4.06 0.00 0.00 30.24 24.86 1h3g n GLN 19 CO 0.00 0.00 0.00 -1.58 -0.20 0.00 0.00 177.06 175.28 1h3g s HIS 20 N -2.62 3.49 0.14 3.69 2.46 -1.26 -4.96 115.29 116.22 1h3g s HIS 20 Ca -0.34 1.37 -0.03 0.00 0.47 0.00 0.00 55.06 56.53 1h3g s HIS 20 Cb 0.11 -3.03 -0.08 0.00 -0.13 0.00 0.00 32.58 29.45 1h3g s HIS 20 CO 0.45 -0.16 1.32 0.87 -2.47 0.00 0.00 174.74 174.75 1h3g h LYS 21 N 7.14 0.37 -6.92 2.88 1.79 -1.97 -3.46 116.57 116.39 1h3g h LYS 21 Ca -0.33 -0.40 -0.52 0.00 -2.18 0.00 0.00 60.65 57.23 1h3g h LYS 21 Cb 1.15 0.11 0.07 0.00 -1.58 0.00 0.00 32.23 31.98 1h3g h LYS 21 CO 0.82 1.08 0.58 0.20 -1.08 0.00 0.00 179.45 181.05 1h3g s GLY 22 N -4.44 2.93 -0.04 3.86 0.00 -1.26 -0.70 107.32 107.68 1h3g s GLY 22 Ca -0.05 1.15 0.00 0.00 0.00 0.00 0.00 44.72 45.82 1h3g s GLY 22 CO 0.86 1.73 0.00 -2.27 0.00 0.00 0.00 173.10 173.42 1h3g s LEU 23 N -2.27 1.01 -0.32 0.66 2.96 0.71 -4.91 118.68 116.52 1h3g s LEU 23 Ca 0.55 -0.03 -0.03 0.00 -0.22 0.00 0.00 54.13 54.40 1h3g s LEU 23 Cb -0.36 -0.25 0.05 0.00 0.50 0.00 0.00 46.19 46.13 1h3g s LEU 23 CO 0.47 -0.12 0.05 -1.58 -1.32 0.00 0.00 176.35 173.84 1h3g s GLN 24 N 1.23 2.45 0.00 1.98 0.74 -1.26 0.15 119.66 124.95 1h3g s GLN 24 Ca -0.07 -1.29 0.00 0.00 0.05 0.00 0.00 55.36 54.05 1h3g s GLN 24 Cb -0.13 -3.30 0.00 0.00 1.10 0.00 0.00 33.01 30.68 1h3g s GLN 24 CO -0.02 -0.68 0.00 1.28 -0.55 0.00 0.00 175.29 175.32 1h3g n LEU 25 N 4.68 0.00 0.00 3.68 4.77 0.15 -4.61 117.00 125.67 1h3g n LEU 25 Ca -0.12 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.86 1h3g n LEU 25 Cb 0.44 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 1h3g n LEU 25 CO 0.28 0.00 0.00 0.52 -1.33 0.00 0.00 177.39 176.86 1h3g n VAL 27 N 0.00 0.00 -5.22 4.08 0.31 0.10 -0.58 118.33 117.02 1h3g n VAL 27 Ca 0.00 0.00 -0.32 0.00 -0.01 0.00 0.00 64.34 64.01 1h3g n VAL 27 Cb 0.00 0.00 -0.17 0.00 -0.91 0.00 0.00 33.84 32.76 1h3g n VAL 27 CO 0.00 0.00 0.00 -2.28 -1.32 0.00 0.00 176.83 173.23 1h3g s HIS 28 N -0.01 2.52 0.00 3.52 5.65 0.38 -0.58 115.29 126.78 1h3g s HIS 28 Ca 0.00 -0.98 0.00 0.00 0.25 0.00 0.00 55.06 54.33 1h3g s HIS 28 Cb 0.00 -1.68 0.00 0.00 -1.18 0.00 0.00 32.58 29.72 1h3g s HIS 28 CO 0.00 -0.38 0.00 0.41 -0.65 0.00 0.00 174.74 174.12 1h3g n GLY 29 N 3.41 1.07 3.63 1.59 0.00 0.13 0.63 105.19 115.64 1h3g n GLY 29 Ca -0.19 -0.52 -0.50 0.00 0.00 0.00 0.00 46.02 44.81 1h3g n GLY 29 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1h3g n ARG 30 N -0.12 1.78 -1.64 1.61 0.63 -0.69 -1.56 116.66 116.66 1h3g n ARG 30 Ca 0.00 0.61 -0.14 0.00 -0.92 0.00 0.00 57.85 57.40 1h3g n ARG 30 Cb 0.00 -2.59 -0.05 0.00 0.45 0.00 0.00 32.46 30.27 1h3g n ARG 30 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1h3g n ASP 31 N 7.68 -3.93 0.29 6.15 8.00 -1.19 -4.75 116.55 128.80 1h3g n ASP 31 Ca 0.28 0.31 0.13 0.00 0.71 0.00 0.00 54.79 56.22 1h3g n ASP 31 Cb 0.27 -3.55 0.84 0.00 -0.02 0.00 0.00 41.12 38.66 1h3g n ASP 31 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 1h3g h ILE 32 N 0.00 0.64 0.00 0.53 6.09 -0.99 -1.58 117.51 122.19 1h3g h ILE 32 Ca -0.31 -0.04 0.00 0.00 -1.37 0.00 0.00 64.86 63.14 1h3g h ILE 32 Cb 1.01 1.03 0.00 0.00 0.47 0.00 0.00 36.82 39.32 1h3g h ILE 32 CO 0.43 0.01 0.00 0.61 -3.07 0.00 0.00 178.15 176.13 1h3g n GLY 33 N -1.33 -0.87 2.65 8.18 0.00 0.15 -4.76 105.19 109.21 1h3g n GLY 33 Ca -0.03 0.02 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 1h3g n GLY 33 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h3g n ARG 34 N -1.72 3.43 -3.87 1.61 1.74 -0.60 -4.86 116.66 112.40 1h3g n ARG 34 Ca 0.02 -3.32 -0.11 0.00 -0.77 0.00 0.00 57.85 53.66 1h3g n ARG 34 Cb 0.11 -2.33 -0.11 0.00 -1.02 0.00 0.00 32.46 29.12 1h3g n ARG 34 CO 0.00 0.00 0.00 -1.83 -1.52 0.00 0.00 177.63 174.28 1h3g s GLU 36 N -2.84 0.38 0.22 5.56 -1.05 0.74 -4.29 118.70 117.43 1h3g s GLU 36 Ca 0.52 -0.26 0.08 0.00 -0.15 0.00 0.00 54.97 55.17 1h3g s GLU 36 Cb 0.33 0.16 -0.04 0.00 -0.44 0.00 0.00 34.13 34.14 1h3g s GLU 36 CO -0.25 -0.08 -0.01 0.00 0.95 0.00 0.00 175.26 175.87 1h3g s ALA 37 N -1.00 3.16 0.17 -0.84 0.00 -1.26 -1.38 121.76 120.61 1h3g s ALA 37 Ca -0.11 -1.51 -0.21 0.00 0.00 0.00 0.00 51.96 50.14 1h3g s ALA 37 Cb -0.06 -0.87 0.05 0.00 0.00 0.00 0.00 23.12 22.24 1h3g s ALA 37 CO 0.01 0.38 0.56 0.00 0.00 0.00 0.00 175.76 176.71 1h3g s ALA 38 N -1.99 -1.32 0.14 0.00 0.00 -0.48 -5.00 121.76 113.12 1h3g s ALA 38 Ca 0.29 0.18 -0.24 0.00 0.00 0.00 0.00 51.96 52.19 1h3g s ALA 38 Cb -0.08 0.84 0.07 0.00 0.00 0.00 0.00 23.12 23.95 1h3g s ALA 38 CO 0.19 -0.78 0.74 -0.48 0.00 0.00 0.00 175.76 175.43 1h3g s LEU 39 N -2.80 -0.40 -0.21 0.00 0.05 -1.26 -0.73 118.68 113.33 1h3g s LEU 39 Ca 0.04 -0.18 -0.04 0.00 0.05 0.00 0.00 54.13 53.99 1h3g s LEU 39 Cb -0.01 2.43 0.08 0.00 -2.05 0.00 0.00 46.19 46.64 1h3g s LEU 39 CO -0.09 -0.96 0.13 -0.62 -0.55 0.00 0.00 176.35 174.27 1h3g s ASP 40 N -2.75 2.46 -0.24 1.48 3.68 -1.26 -4.89 116.67 115.15 1h3g s ASP 40 Ca 0.06 -0.73 -0.18 0.00 2.13 0.00 0.00 52.55 53.83 1h3g s ASP 40 Cb -0.02 -0.13 0.07 0.00 -1.45 0.00 0.00 42.92 41.39 1h3g s ASP 40 CO -0.06 -0.37 0.61 -0.47 0.13 0.00 0.00 175.17 175.01 1h3g s TYR 41 N 2.17 -0.80 0.07 -5.34 5.04 -1.26 -4.88 117.35 112.36 1h3g s TYR 41 Ca 0.05 1.76 -0.31 0.00 -2.44 0.00 0.00 57.07 56.14 1h3g s TYR 41 Cb -0.16 0.37 -0.09 0.00 0.35 0.00 0.00 41.96 42.44 1h3g s TYR 41 CO -0.18 -0.40 1.75 -2.14 -1.34 0.00 0.00 175.55 173.24 1h3g s PRO 42 N 0.93 4.17 0.00 4.97 0.02 -1.26 -2.33 135.00 141.50 1h3g s PRO 42 Ca -0.05 2.44 0.00 0.00 0.02 0.00 0.00 61.00 63.41 1h3g s PRO 42 Cb -0.05 -3.70 0.00 0.00 0.02 0.00 0.00 34.50 30.77 1h3g s PRO 42 CO -0.08 -0.81 0.00 0.41 -0.33 0.00 0.00 177.00 176.19 1h3g n GLY 43 N 4.15 0.71 3.13 0.52 0.00 -1.26 -4.27 105.19 108.17 1h3g n GLY 43 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 1h3g n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h3g s VAL 44 N -2.70 1.58 -0.05 1.61 1.01 -0.98 -0.09 120.40 120.78 1h3g s VAL 44 Ca 0.00 -0.75 0.06 0.00 0.00 0.00 0.00 61.98 61.29 1h3g s VAL 44 Cb 0.00 -1.39 -0.01 0.00 0.00 0.00 0.00 36.38 34.98 1h3g s VAL 44 CO 0.00 0.45 -0.23 -0.60 0.00 0.00 0.00 175.10 174.72 1h3g s ARG 45 N 0.42 2.27 -0.50 2.72 3.52 -0.14 -4.53 118.95 122.71 1h3g s ARG 45 Ca -0.15 -0.83 -0.27 0.00 -0.13 0.00 0.00 55.73 54.36 1h3g s ARG 45 Cb -0.16 -1.97 0.03 0.00 -1.56 0.00 0.00 34.95 31.29 1h3g s ARG 45 CO 0.06 0.37 1.05 -1.17 -0.81 0.00 0.00 175.30 174.80 1h3g s LEU 46 N -0.18 3.78 -0.14 -0.88 1.98 -1.26 -0.88 118.68 121.10 1h3g s LEU 46 Ca -0.02 0.16 -0.28 0.00 -2.89 0.00 0.00 54.13 51.11 1h3g s LEU 46 Cb -0.12 -3.26 -0.26 0.00 0.66 0.00 0.00 46.19 43.21 1h3g s LEU 46 CO 0.03 -1.23 0.75 0.58 -1.89 0.00 0.00 176.35 174.58 1h3g h VAL 47 N 6.14 1.73 -1.91 1.68 2.07 -0.75 -3.49 116.25 121.73 1h3g h VAL 47 Ca -0.24 -2.35 0.27 0.00 0.82 0.00 0.00 66.70 65.20 1h3g h VAL 47 Cb 1.07 3.33 -0.09 0.00 -1.52 0.00 0.00 31.29 34.07 1h3g h VAL 47 CO 1.10 0.60 0.72 -0.94 0.02 0.00 0.00 177.57 179.08 1h3g s SER 48 N -6.30 -0.07 0.02 0.57 1.04 -1.07 -5.01 113.70 102.88 1h3g s SER 48 Ca -0.19 -0.29 0.01 0.00 0.48 0.00 0.00 55.95 55.97 1h3g s SER 48 Cb -0.02 0.28 -0.01 0.00 0.10 0.00 0.00 66.02 66.37 1h3g s SER 48 CO 0.69 -0.54 -0.05 0.42 0.98 0.00 0.00 173.24 174.75 1h3g s THR 49 N -2.53 0.35 -0.04 2.02 -4.23 -1.26 -0.06 115.64 109.89 1h3g s THR 49 Ca 0.17 -0.57 0.07 0.00 -1.18 0.00 0.00 61.69 60.18 1h3g s THR 49 Cb 0.02 -0.37 -0.01 0.00 1.34 0.00 0.00 72.50 73.47 1h3g s THR 49 CO -0.01 -0.15 -0.25 -0.89 -0.54 0.00 0.00 174.62 172.78 1h3g s THR 50 N -0.71 2.00 0.18 3.99 2.01 0.16 -4.97 115.64 118.30 1h3g s THR 50 Ca -0.05 -1.06 0.11 0.00 0.31 0.00 0.00 61.69 61.01 1h3g s THR 50 Cb -0.05 -1.68 -0.04 0.00 0.01 0.00 0.00 72.50 70.73 1h3g s THR 50 CO -0.00 0.56 -0.25 0.00 -0.69 0.00 0.00 174.62 174.24 1h3g s ARG 51 N -0.32 1.48 0.39 4.92 1.70 -1.26 -1.41 118.95 124.46 1h3g s ARG 51 Ca 0.01 -1.48 0.04 0.00 -0.47 0.00 0.00 55.73 53.84 1h3g s ARG 51 Cb -0.12 -1.85 -0.05 0.00 -0.57 0.00 0.00 34.95 32.35 1h3g s ARG 51 CO 0.02 0.41 0.04 0.14 -1.08 0.00 0.00 175.30 174.83 1h3g s VAL 52 N -1.51 1.36 0.40 4.99 -7.23 -1.26 -5.04 120.40 112.10 1h3g s VAL 52 Ca 0.19 -2.00 0.13 0.00 -1.81 0.00 0.00 61.98 58.48 1h3g s VAL 52 Cb -0.08 -2.69 0.34 0.00 0.56 0.00 0.00 36.38 34.50 1h3g s VAL 52 CO 0.09 0.00 1.91 -0.65 -0.31 0.00 0.00 175.10 176.14 1h3g h PRO 53 N 1.83 0.52 -6.55 4.82 0.11 -1.97 -3.36 132.00 127.40 1h3g h PRO 53 Ca -0.42 -0.03 -0.56 0.00 0.11 0.00 0.00 66.00 65.10 1h3g h PRO 53 Cb 1.26 -0.12 -0.06 0.00 0.11 0.00 0.00 31.00 32.20 1h3g h PRO 53 CO 0.72 0.34 1.06 1.21 -0.21 0.00 0.00 178.00 181.12 1h3g s ASN 54 N -5.93 6.35 0.00 -2.05 3.84 -1.26 -4.88 114.94 111.01 1h3g s ASN 54 Ca -0.09 0.71 0.15 0.00 0.21 0.00 0.00 52.86 53.85 1h3g s ASN 54 Cb 0.21 -2.54 0.88 0.00 -0.55 0.00 0.00 41.25 39.25 1h3g s ASN 54 CO 0.77 -1.44 1.36 0.00 -2.79 0.00 0.00 177.10 175.00 1h3g n ALA 55 N 8.79 2.01 0.80 1.71 0.00 -1.26 -2.87 120.51 129.69 1h3g n ALA 55 Ca 0.15 -0.09 0.07 0.00 0.00 0.00 0.00 53.44 53.57 1h3g n ALA 55 Cb 0.48 -1.25 0.20 0.00 0.00 0.00 0.00 19.45 18.88 1h3g n ALA 55 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1h3g n ASN 56 N -1.08 2.08 -4.12 0.00 3.02 -1.26 -0.68 115.26 113.22 1h3g n ASN 56 Ca 0.10 -1.96 -0.17 0.00 -0.03 0.00 0.00 54.58 52.52 1h3g n ASN 56 Cb 0.07 -0.24 -0.12 0.00 -0.61 0.00 0.00 39.78 38.87 1h3g n ASN 56 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1h3g s TYR 57 N -1.51 1.04 -0.11 3.10 2.02 -1.14 -0.69 117.35 120.06 1h3g s TYR 57 Ca 0.27 -0.41 -0.06 0.00 -0.37 0.00 0.00 57.07 56.50 1h3g s TYR 57 Cb 0.14 -0.61 0.05 0.00 -0.40 0.00 0.00 41.96 41.14 1h3g s TYR 57 CO 0.19 0.01 0.26 -1.17 -1.57 0.00 0.00 175.55 173.28 1h3g s LEU 58 N -1.41 0.42 -0.23 -1.29 2.96 0.25 -3.38 118.68 116.00 1h3g s LEU 58 Ca -0.03 0.56 -0.07 0.00 -0.22 0.00 0.00 54.13 54.38 1h3g s LEU 58 Cb -0.09 0.82 -0.03 0.00 0.50 0.00 0.00 46.19 47.39 1h3g s LEU 58 CO 0.01 -0.16 0.05 -0.36 -1.32 0.00 0.00 176.35 174.58 1h3g s PHE 59 N 1.17 3.10 -0.19 5.38 0.40 -0.50 0.02 117.98 127.35 1h3g s PHE 59 Ca -0.08 -0.34 -0.02 0.00 -0.60 0.00 0.00 56.93 55.89 1h3g s PHE 59 Cb -0.09 -2.18 0.00 0.00 0.51 0.00 0.00 43.02 41.26 1h3g s PHE 59 CO -0.08 -0.25 -0.11 0.08 0.70 0.00 0.00 175.22 175.56 1h3g s VAL 60 N 1.27 2.84 -0.30 -0.44 1.01 0.25 0.39 120.40 125.42 1h3g s VAL 60 Ca 0.05 -0.68 -0.11 0.00 0.00 0.00 0.00 61.98 61.23 1h3g s VAL 60 Cb -0.15 -2.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.94 1h3g s VAL 60 CO 0.03 0.48 0.20 -1.81 0.00 0.00 0.00 175.10 174.00 1h3g s ASP 61 N 1.28 5.99 0.12 3.32 1.11 0.91 0.32 116.67 129.71 1h3g s ASP 61 Ca 0.03 -0.16 0.07 0.00 0.18 0.00 0.00 52.55 52.67 1h3g s ASP 61 Cb -0.14 -2.12 -0.04 0.00 1.07 0.00 0.00 42.92 41.69 1h3g s ASP 61 CO -0.06 -0.11 -0.08 -0.76 1.18 0.00 0.00 175.17 175.35 1h3g s LEU 62 N 1.74 3.12 -0.23 1.23 1.02 0.12 0.01 118.68 125.70 1h3g s LEU 62 Ca 0.07 -0.38 0.00 0.00 0.02 0.00 0.00 54.13 53.84 1h3g s LEU 62 Cb -0.16 -1.88 0.03 0.00 0.02 0.00 0.00 46.19 44.20 1h3g s LEU 62 CO 0.10 0.16 -0.12 -0.70 0.02 0.00 0.00 176.35 175.81 1h3g s GLU 63 N -2.37 2.77 -0.40 1.70 2.56 -0.06 -0.21 118.70 122.70 1h3g s GLU 63 Ca 0.23 -1.00 -0.13 0.00 0.00 0.00 0.00 54.97 54.07 1h3g s GLU 63 Cb -0.11 -2.81 0.02 0.00 2.00 0.00 0.00 34.13 33.23 1h3g s GLU 63 CO 0.15 -0.36 0.26 0.42 -0.56 0.00 0.00 175.26 175.17 1h3g s ILE 64 N 1.26 4.99 0.81 -3.70 1.01 0.12 -0.96 121.20 124.74 1h3g s ILE 64 Ca -0.00 -0.74 -0.12 0.00 0.00 0.00 0.00 60.65 59.80 1h3g s ILE 64 Cb -0.16 -3.78 0.08 0.00 0.01 0.00 0.00 42.46 38.60 1h3g s ILE 64 CO -0.08 -0.28 1.12 -0.83 0.00 0.00 0.00 174.94 174.88 1h3g s GLY 65 N 1.63 1.61 0.51 6.18 0.00 0.88 -4.61 107.32 113.52 1h3g s GLY 65 Ca 0.04 -0.39 0.24 0.00 0.00 0.00 0.00 44.72 44.61 1h3g s GLY 65 CO 0.09 0.07 2.08 -2.55 0.00 0.00 0.00 173.10 172.79 1h3g h PRO 66 N -1.10 0.00 0.00 2.90 0.11 -1.98 -1.49 132.00 130.45 1h3g h PRO 66 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1h3g h PRO 66 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1h3g h PRO 66 CO 0.62 0.11 0.00 1.05 -0.21 0.00 0.00 178.00 179.57 1h3g h GLU 67 N 0.00 0.00 -6.53 1.05 9.09 -1.92 -3.45 114.58 112.82 1h3g h GLU 67 Ca -0.00 0.00 -0.60 0.00 0.05 0.00 0.00 59.36 58.81 1h3g h GLU 67 Cb 0.26 0.00 0.08 0.00 -1.65 0.00 0.00 28.75 27.44 1h3g h GLU 67 CO 0.01 0.00 0.58 0.00 0.05 0.00 0.00 179.01 179.66 1h3g n ALA 68 N -2.01 0.79 -2.73 1.06 0.00 -0.56 -4.79 120.51 112.27 1h3g n ALA 68 Ca 0.03 0.43 -0.23 0.00 0.00 0.00 0.00 53.44 53.67 1h3g n ALA 68 Cb 0.43 -2.24 -0.06 0.00 0.00 0.00 0.00 19.45 17.58 1h3g n ALA 68 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1h3g s GLN 69 N -0.18 2.60 0.31 0.00 2.00 -1.26 -4.65 119.66 118.48 1h3g s GLN 69 Ca 0.71 -1.20 -0.29 0.00 -2.00 0.00 0.00 55.36 52.58 1h3g s GLN 69 Cb -0.69 -2.38 -0.12 0.00 0.80 0.00 0.00 33.01 30.62 1h3g s GLN 69 CO 0.48 0.40 1.55 -2.30 -0.50 0.00 0.00 175.29 174.92 1h3g n PRO 70 N -0.87 2.64 -3.75 1.67 -0.02 -1.26 -4.86 135.00 128.56 1h3g n PRO 70 Ca -0.08 0.93 0.00 0.00 -2.02 0.00 0.00 63.50 62.34 1h3g n PRO 70 Cb 0.58 -2.69 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 1h3g n PRO 70 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1h3g n GLY 71 N 1.65 -0.75 3.08 -1.23 0.00 -0.07 -4.99 105.19 102.88 1h3g n GLY 71 Ca 0.07 -1.02 -0.08 0.00 0.00 0.00 0.00 46.02 44.98 1h3g n GLY 71 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1h3g s SER 72 N -4.00 0.39 -0.01 1.61 1.04 -1.26 -0.40 113.70 111.06 1h3g s SER 72 Ca 0.00 -0.84 -0.21 0.00 0.48 0.00 0.00 55.95 55.38 1h3g s SER 72 Cb 0.00 0.20 0.04 0.00 0.10 0.00 0.00 66.02 66.36 1h3g s SER 72 CO 0.00 -0.55 0.45 0.72 0.98 0.00 0.00 173.24 174.84 1h3g s PHE 73 N -3.35 -0.35 0.25 5.02 -0.12 -0.05 -4.97 117.98 114.40 1h3g s PHE 73 Ca 0.02 0.53 -0.30 0.00 -0.05 0.00 0.00 56.93 57.12 1h3g s PHE 73 Cb 0.04 0.23 -0.09 0.00 -0.63 0.00 0.00 43.02 42.56 1h3g s PHE 73 CO -0.08 -0.51 0.97 -0.51 -0.05 0.00 0.00 175.22 175.04 1h3g s ASP 74 N -1.46 7.59 -0.23 1.98 1.01 -1.26 -0.28 116.67 124.02 1h3g s ASP 74 Ca -0.11 2.00 -0.09 0.00 0.71 0.00 0.00 52.55 55.06 1h3g s ASP 74 Cb -0.03 -2.61 -0.04 0.00 1.01 0.00 0.00 42.92 41.25 1h3g s ASP 74 CO 0.04 0.11 0.12 -0.63 0.21 0.00 0.00 175.17 175.03 1h3g s ILE 75 N -1.18 5.07 -0.11 0.77 1.01 0.94 -4.40 121.20 123.30 1h3g s ILE 75 Ca 0.42 0.08 0.00 0.00 0.00 0.00 0.00 60.65 61.14 1h3g s ILE 75 Cb -0.27 -3.35 -0.02 0.00 0.01 0.00 0.00 42.46 38.83 1h3g s ILE 75 CO 0.33 0.37 -0.10 0.54 0.00 0.00 0.00 174.94 176.08 1h3g s VAL 76 N 0.99 3.35 -0.08 2.92 0.11 0.09 -1.12 120.40 126.67 1h3g s VAL 76 Ca 0.06 -0.58 0.00 0.00 -2.93 0.00 0.00 61.98 58.54 1h3g s VAL 76 Cb -0.14 -2.40 -0.03 0.00 -1.53 0.00 0.00 36.38 32.29 1h3g s VAL 76 CO 0.04 0.55 -0.07 -0.36 -3.33 0.00 0.00 175.10 171.92 1h3g s PHE 77 N -0.08 2.94 0.01 1.54 0.40 0.12 -1.38 117.98 121.53 1h3g s PHE 77 Ca -0.01 -0.01 0.02 0.00 -0.60 0.00 0.00 56.93 56.33 1h3g s PHE 77 Cb -0.14 -1.73 -0.01 0.00 0.51 0.00 0.00 43.02 41.65 1h3g s PHE 77 CO 0.03 0.29 -0.07 0.15 0.70 0.00 0.00 175.22 176.33 1h3g s LYS 78 N -0.70 0.54 0.00 0.44 3.01 -0.48 -0.45 119.74 122.10 1h3g s LYS 78 Ca 0.11 -0.35 0.00 0.00 -1.01 0.00 0.00 55.97 54.71 1h3g s LYS 78 Cb -0.11 -0.48 0.00 0.00 -1.01 0.00 0.00 37.83 36.23 1h3g s LYS 78 CO 0.02 0.12 0.00 0.41 0.51 0.00 0.00 175.35 176.41 1h3g n GLY 79 N 2.60 0.96 2.41 -3.33 0.00 -0.24 -0.18 105.19 107.39 1h3g n GLY 79 Ca -0.15 -2.04 -0.10 0.00 0.00 0.00 0.00 46.02 43.72 1h3g n GLY 79 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1h3g n ASP 80 N 2.22 -3.40 -0.98 1.61 2.03 -1.26 0.69 116.55 117.46 1h3g n ASP 80 Ca 0.00 0.24 -0.10 0.00 0.52 0.00 0.00 54.79 55.46 1h3g n ASP 80 Cb 0.00 -2.93 -0.02 0.00 -0.72 0.00 0.00 41.12 37.45 1h3g n ASP 80 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1h3g n GLY 81 N -0.72 0.39 2.84 0.27 0.00 -1.26 -5.01 105.19 101.70 1h3g n GLY 81 Ca -0.12 -0.52 -0.09 0.00 0.00 0.00 0.00 46.02 45.29 1h3g n GLY 81 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1h3g n ARG 82 N -2.22 0.75 -3.81 1.61 1.85 0.22 -5.17 116.66 109.88 1h3g n ARG 82 Ca -0.11 -1.96 -0.12 0.00 -1.00 0.00 0.00 57.85 54.65 1h3g n ARG 82 Cb 0.49 2.17 -0.12 0.00 -1.05 0.00 0.00 32.46 33.95 1h3g n ARG 82 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1h3g s SER 83 N -2.67 -0.18 0.04 2.89 0.15 -1.26 -1.08 113.70 111.59 1h3g s SER 83 Ca 0.17 0.34 0.03 0.00 0.70 0.00 0.00 55.95 57.18 1h3g s SER 83 Cb -0.03 0.35 -0.02 0.00 -1.71 0.00 0.00 66.02 64.61 1h3g s SER 83 CO 0.13 -0.07 -0.08 -1.61 1.20 0.00 0.00 173.24 172.80 1h3g s GLU 84 N 0.06 0.56 -0.00 5.44 0.41 0.41 -4.96 118.70 120.62 1h3g s GLU 84 Ca -0.00 -0.73 0.05 0.00 -0.41 0.00 0.00 54.97 53.88 1h3g s GLU 84 Cb -0.01 -0.38 -0.01 0.00 -1.78 0.00 0.00 34.13 31.94 1h3g s GLU 84 CO 0.00 0.08 -0.17 1.03 -0.49 0.00 0.00 175.26 175.70 1h3g s ARG 85 N -1.45 1.37 -0.06 1.61 0.52 -1.26 0.15 118.95 119.83 1h3g s ARG 85 Ca -0.08 -0.66 -0.03 0.00 -0.52 0.00 0.00 55.73 54.45 1h3g s ARG 85 Cb -0.09 -1.35 0.04 0.00 0.52 0.00 0.00 34.95 34.07 1h3g s ARG 85 CO 0.01 0.37 0.11 -0.47 0.02 0.00 0.00 175.30 175.34 1h3g s TYR 86 N -0.47 -0.08 -0.08 -0.53 6.14 -0.27 -4.95 117.35 117.12 1h3g s TYR 86 Ca 0.06 0.44 -0.30 0.00 0.64 0.00 0.00 57.07 57.92 1h3g s TYR 86 Cb -0.07 -0.33 -0.03 0.00 0.42 0.00 0.00 41.96 41.95 1h3g s TYR 86 CO -0.00 -0.22 1.18 0.50 0.64 0.00 0.00 175.55 177.64 1h3g s ARG 87 N 2.11 4.35 -0.04 4.97 3.52 -1.26 -0.04 118.95 132.55 1h3g s ARG 87 Ca 0.02 1.63 0.07 0.00 -0.13 0.00 0.00 55.73 57.33 1h3g s ARG 87 Cb -0.12 -3.58 -0.02 0.00 -1.56 0.00 0.00 34.95 29.68 1h3g s ARG 87 CO -0.05 -0.46 -0.25 -0.47 -0.81 0.00 0.00 175.30 173.26 1h3g s TYR 88 N 2.34 2.38 -0.05 5.12 5.04 0.61 -4.94 117.35 127.86 1h3g s TYR 88 Ca 0.55 -0.56 0.04 0.00 -2.44 0.00 0.00 57.07 54.65 1h3g s TYR 88 Cb -0.23 -1.55 -0.03 0.00 0.35 0.00 0.00 41.96 40.51 1h3g s TYR 88 CO 0.20 -0.11 -0.14 0.50 -1.34 0.00 0.00 175.55 174.66 1h3g s ARG 89 N -0.42 2.50 -0.20 4.97 3.52 -1.26 -0.88 118.95 127.18 1h3g s ARG 89 Ca 0.04 -0.70 -0.01 0.00 -0.13 0.00 0.00 55.73 54.93 1h3g s ARG 89 Cb -0.12 -2.37 0.01 0.00 -1.56 0.00 0.00 34.95 30.91 1h3g s ARG 89 CO 0.01 0.62 -0.13 -0.51 -0.81 0.00 0.00 175.30 174.48 1h3g s LEU 90 N -0.73 2.49 0.35 -0.88 1.02 0.46 -1.61 118.68 119.78 1h3g s LEU 90 Ca 0.11 -0.56 -0.02 0.00 0.02 0.00 0.00 54.13 53.68 1h3g s LEU 90 Cb -0.11 -1.59 -0.04 0.00 0.02 0.00 0.00 46.19 44.47 1h3g s LEU 90 CO 0.00 -0.02 0.59 -0.76 0.02 0.00 0.00 176.35 176.19 1h3g s LEU 91 N 1.37 3.96 0.26 1.79 1.02 0.61 -0.89 118.68 126.79 1h3g s LEU 91 Ca 0.05 0.61 -0.24 0.00 0.02 0.00 0.00 54.13 54.57 1h3g s LEU 91 Cb -0.14 -3.48 -0.09 0.00 0.02 0.00 0.00 46.19 42.51 1h3g s LEU 91 CO -0.09 -0.32 0.84 0.00 0.02 0.00 0.00 176.35 176.81 1h3g s ALA 92 N -2.32 3.33 0.33 4.21 0.00 -1.26 -0.98 121.76 125.06 1h3g s ALA 92 Ca 0.42 0.39 -0.24 0.00 0.00 0.00 0.00 51.96 52.53 1h3g s ALA 92 Cb -0.10 -3.03 -0.10 0.00 0.00 0.00 0.00 23.12 19.89 1h3g s ALA 92 CO 0.36 0.25 0.91 1.03 0.00 0.00 0.00 175.76 178.30 1h3g s ARG 93 N -1.81 4.45 0.73 0.00 0.52 -1.26 -4.94 118.95 116.64 1h3g s ARG 93 Ca 0.45 1.20 -0.14 0.00 -0.52 0.00 0.00 55.73 56.71 1h3g s ARG 93 Cb -0.19 -2.68 0.04 0.00 0.52 0.00 0.00 34.95 32.63 1h3g s ARG 93 CO 0.24 0.23 1.17 -1.21 0.02 0.00 0.00 175.30 175.75 1h3g s GLU 94 N -2.29 2.24 0.12 3.54 0.41 -1.26 -4.91 118.70 116.55 1h3g s GLU 94 Ca 0.52 1.63 -0.31 0.00 -0.41 0.00 0.00 54.97 56.39 1h3g s GLU 94 Cb -0.16 -1.86 -0.09 0.00 -1.78 0.00 0.00 34.13 30.23 1h3g s GLU 94 CO 0.21 -1.73 1.64 -1.14 -0.49 0.00 0.00 175.26 173.75 1h3g s GLN 95 N -4.04 4.19 -0.02 1.61 -0.44 -1.26 -1.96 119.66 117.74 1h3g s GLN 95 Ca 0.71 2.39 0.00 0.00 -2.50 0.00 0.00 55.36 55.96 1h3g s GLN 95 Cb -0.26 -3.38 0.00 0.00 -1.64 0.00 0.00 33.01 27.73 1h3g s GLN 95 CO 0.45 -0.69 0.00 0.41 0.50 0.00 0.00 175.29 175.96 1h3g n GLY 96 N 3.92 0.46 0.21 2.59 0.00 -1.26 -4.96 105.19 106.14 1h3g n GLY 96 Ca 0.15 -0.40 -0.12 0.00 0.00 0.00 0.00 46.02 45.66 1h3g n GLY 96 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1h3g h SER 97 N 0.00 -0.46 -0.73 1.61 0.87 -1.75 -2.32 113.55 110.77 1h3g h SER 97 Ca -0.00 0.06 0.01 0.00 -1.23 0.00 0.00 61.79 60.62 1h3g h SER 97 Cb 0.02 0.18 -0.04 0.00 -0.44 0.00 0.00 62.40 62.12 1h3g h SER 97 CO 0.01 -0.24 0.48 0.00 -0.53 0.00 0.00 176.83 176.55 1h3g h ALA 98 N 0.54 1.49 -0.51 6.23 0.00 -1.85 -2.20 119.26 122.97 1h3g h ALA 98 Ca 0.03 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1h3g h ALA 98 Cb 0.34 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1h3g h ALA 98 CO -0.10 0.46 0.00 1.04 0.00 0.00 0.00 179.25 180.66 1h3g n GLN 99 N -4.43 3.51 -1.60 0.00 1.13 -1.08 -3.90 117.38 111.00 1h3g n GLN 99 Ca 0.08 -2.39 -0.46 0.00 -1.94 0.00 0.00 57.00 52.29 1h3g n GLN 99 Cb 0.05 -1.88 -0.02 0.00 0.11 0.00 0.00 30.24 28.49 1h3g n GLN 99 CO 0.00 0.00 0.00 2.89 -1.44 0.00 0.00 177.06 178.51 1h3g n ARG 100 N 0.77 1.42 -2.76 -1.09 1.85 -0.83 -4.78 116.66 111.24 1h3g n ARG 100 Ca 0.21 0.50 -0.43 0.00 -1.00 0.00 0.00 57.85 57.14 1h3g n ARG 100 Cb 0.83 -1.96 -0.03 0.00 -1.05 0.00 0.00 32.46 30.25 1h3g n ARG 100 CO 0.00 0.00 0.00 -1.14 -0.01 0.00 0.00 177.63 176.48 1h3g s GLN 101 N -1.07 4.08 0.92 2.89 2.00 -1.26 -3.97 119.66 123.25 1h3g s GLN 101 Ca 0.64 0.96 -0.12 0.00 -2.00 0.00 0.00 55.36 54.84 1h3g s GLN 101 Cb -0.73 -3.71 0.14 0.00 0.80 0.00 0.00 33.01 29.51 1h3g s GLN 101 CO 0.56 -0.75 1.11 0.20 -0.50 0.00 0.00 175.29 175.91 1h3g s GLY 102 N 1.54 1.59 0.56 2.59 0.00 0.54 -4.84 107.32 109.29 1h3g s GLY 102 Ca 0.40 -0.31 -0.20 0.00 0.00 0.00 0.00 44.72 44.61 1h3g s GLY 102 CO 0.12 0.22 1.23 -0.11 0.00 0.00 0.00 173.10 174.56 1h3g s PHE 103 N -3.08 2.44 0.00 1.90 -0.12 -1.06 -4.78 117.98 113.28 1h3g s PHE 103 Ca 0.64 1.49 0.00 0.00 -0.05 0.00 0.00 56.93 59.01 1h3g s PHE 103 Cb -0.17 -3.53 0.00 0.00 -0.63 0.00 0.00 43.02 38.70 1h3g s PHE 103 CO 0.56 -2.24 0.00 0.41 -0.05 0.00 0.00 175.22 173.90 1h3g n GLY 104 N 0.55 3.70 0.35 1.99 0.00 -1.26 -4.64 105.19 105.87 1h3g n GLY 104 Ca 0.12 -1.50 0.18 0.00 0.00 0.00 0.00 46.02 44.82 1h3g n GLY 104 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1h3g h PRO 105 N 0.00 0.00 0.00 1.61 0.11 -1.86 0.17 132.00 132.03 1h3g h PRO 105 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1h3g h PRO 105 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1h3g h PRO 105 CO 0.00 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.20 1h3g n GLY 106 N -1.53 -1.39 3.90 -0.55 0.00 -1.26 -4.65 105.19 99.71 1h3g n GLY 106 Ca 0.05 -0.11 -0.28 0.00 0.00 0.00 0.00 46.02 45.68 1h3g n GLY 106 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1h3g s ASP 107 N -2.88 6.42 -0.09 1.61 1.01 0.61 -4.75 116.67 118.60 1h3g s ASP 107 Ca 0.17 0.79 0.02 0.00 0.71 0.00 0.00 52.55 54.25 1h3g s ASP 107 Cb 0.18 -2.18 0.01 0.00 1.01 0.00 0.00 42.92 41.95 1h3g s ASP 107 CO 0.49 -0.30 -0.16 0.00 0.21 0.00 0.00 175.17 175.41 1h3g s ALA 108 N -2.25 1.58 -0.18 5.23 0.00 -1.26 -4.13 121.76 120.74 1h3g s ALA 108 Ca 0.45 -0.62 -0.09 0.00 0.00 0.00 0.00 51.96 51.70 1h3g s ALA 108 Cb -0.10 -0.70 -0.05 0.00 0.00 0.00 0.00 23.12 22.27 1h3g s ALA 108 CO 0.33 0.09 0.11 0.42 0.00 0.00 0.00 175.76 176.71 1h3g s ILE 109 N 0.70 5.26 -0.28 0.00 1.01 0.55 -1.07 121.20 127.37 1h3g s ILE 109 Ca -0.13 0.13 -0.06 0.00 0.00 0.00 0.00 60.65 60.59 1h3g s ILE 109 Cb -0.16 -3.37 0.01 0.00 0.01 0.00 0.00 42.46 38.95 1h3g s ILE 109 CO 0.03 0.48 0.04 -0.47 0.00 0.00 0.00 174.94 175.02 1h3g s TYR 110 N 0.10 3.11 -0.17 3.97 5.04 -0.03 0.12 117.35 129.48 1h3g s TYR 110 Ca 0.08 -1.05 -0.12 0.00 -2.44 0.00 0.00 57.07 53.54 1h3g s TYR 110 Cb -0.11 -2.20 -0.05 0.00 0.35 0.00 0.00 41.96 39.95 1h3g s TYR 110 CO -0.00 -0.59 0.23 -1.14 -1.34 0.00 0.00 175.55 172.70 1h3g s GLN 111 N 1.47 4.16 0.00 4.97 0.74 0.10 -1.10 119.66 130.00 1h3g s GLN 111 Ca 0.03 -0.03 0.00 0.00 0.05 0.00 0.00 55.36 55.41 1h3g s GLN 111 Cb -0.17 -3.40 0.00 0.00 1.10 0.00 0.00 33.01 30.54 1h3g s GLN 111 CO 0.01 0.31 0.00 0.44 -0.55 0.00 0.00 175.29 175.50 1h3g n ILE 112 N 3.39 0.00 0.00 -2.34 -5.35 -0.16 -0.40 119.36 114.49 1h3g n ILE 112 Ca -0.14 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.34 1h3g n ILE 112 Cb 0.52 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.42 1h3g n ILE 112 CO 0.00 0.00 0.00 -2.65 -1.76 0.00 0.00 176.55 172.14 1h3g n PRO 114 N 0.00 0.00 0.30 6.28 -0.02 -1.26 -1.37 135.00 138.93 1h3g n PRO 114 Ca 0.00 0.00 0.18 0.00 -2.02 0.00 0.00 63.50 61.66 1h3g n PRO 114 Cb 0.00 -0.81 0.95 0.00 -0.02 0.00 0.00 33.50 33.62 1h3g n PRO 114 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1h3g h ASP 115 N 0.00 0.00 -0.14 2.55 1.82 -1.85 -3.06 116.42 115.75 1h3g h ASP 115 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1h3g h ASP 115 Cb 0.98 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.99 1h3g h ASP 115 CO 0.00 0.03 0.00 0.54 -1.61 0.00 0.00 179.24 178.20 1h3g n ARG 116 N -3.40 1.68 -0.02 0.28 5.12 -1.26 -0.39 116.66 118.68 1h3g n ARG 116 Ca -0.02 -1.47 -0.01 0.00 -1.93 0.00 0.00 57.85 54.42 1h3g n ARG 116 Cb 0.15 -1.16 -0.00 0.00 -1.16 0.00 0.00 32.46 30.28 1h3g n ARG 116 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1h3g n PHE 117 N 0.28 0.18 -3.71 -1.55 7.35 -1.16 -1.04 117.46 117.81 1h3g n PHE 117 Ca 0.06 0.08 -0.11 0.00 -0.76 0.00 0.00 57.45 56.72 1h3g n PHE 117 Cb 0.29 -0.32 -0.12 0.00 0.35 0.00 0.00 39.48 39.67 1h3g n PHE 117 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1h3g s ALA 118 N -2.94 -0.79 -0.94 3.13 0.00 -1.26 -4.06 121.76 114.90 1h3g s ALA 118 Ca -0.04 1.24 -0.17 0.00 0.00 0.00 0.00 51.96 52.99 1h3g s ALA 118 Cb 0.01 -0.82 0.16 0.00 0.00 0.00 0.00 23.12 22.47 1h3g s ALA 118 CO 0.06 -0.29 1.07 1.21 0.00 0.00 0.00 175.76 177.81 1h3g s ASN 119 N 1.48 6.75 0.05 0.00 3.84 -0.11 -0.81 114.94 126.14 1h3g s ASN 119 Ca -0.08 -2.39 0.27 0.00 0.21 0.00 0.00 52.86 50.87 1h3g s ASN 119 Cb -0.10 -2.34 0.92 0.00 -0.55 0.00 0.00 41.25 39.18 1h3g s ASN 119 CO -0.11 -0.87 1.73 0.61 -2.79 0.00 0.00 177.10 175.68 1h3g n GLY 120 N 4.82 -1.47 2.77 1.21 0.00 -1.26 -4.56 105.19 106.69 1h3g n GLY 120 Ca 0.23 -0.15 -0.17 0.00 0.00 0.00 0.00 46.02 45.93 1h3g n GLY 120 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1h3g s ASP 121 N -3.39 1.25 0.65 1.61 -1.08 -1.26 -4.71 116.67 109.74 1h3g s ASP 121 Ca 0.12 -1.31 0.41 0.00 -0.52 0.00 0.00 52.55 51.25 1h3g s ASP 121 Cb 0.17 0.58 2.27 0.00 -1.46 0.00 0.00 42.92 44.47 1h3g s ASP 121 CO 0.60 -0.30 2.34 -0.65 0.52 0.00 0.00 175.17 177.68 1h3g h PRO 122 N 7.42 0.00 0.00 4.34 0.11 -1.89 -2.63 132.00 139.35 1h3g h PRO 122 Ca -0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1h3g h PRO 122 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1h3g h PRO 122 CO 0.24 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.90 1h3g n SER 123 N -3.28 0.61 -0.86 -2.05 3.41 -1.26 -2.14 113.62 108.04 1h3g n SER 123 Ca -0.03 0.64 0.09 0.00 -0.26 0.00 0.00 58.87 59.31 1h3g n SER 123 Cb 0.08 -0.77 0.14 0.00 -0.26 0.00 0.00 64.21 63.39 1h3g n SER 123 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1h3g n ASN 124 N -2.16 2.90 -0.26 4.04 0.23 -0.99 -4.41 115.26 114.61 1h3g n ASN 124 Ca 0.03 -1.85 0.06 0.00 -0.53 0.00 0.00 54.58 52.29 1h3g n ASN 124 Cb 0.24 -0.13 0.30 0.00 -2.08 0.00 0.00 39.78 38.11 1h3g n ASN 124 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1h3g h ASP 125 N 3.58 0.78 -4.31 0.53 3.32 -1.56 -3.39 116.42 115.38 1h3g h ASP 125 Ca 0.00 0.01 -0.63 0.00 0.02 0.00 0.00 57.03 56.44 1h3g h ASP 125 Cb 0.82 -0.15 -0.26 0.00 0.22 0.00 0.00 39.33 39.95 1h3g h ASP 125 CO 0.00 0.48 -0.86 0.20 -1.72 0.00 0.00 179.24 177.34 1h3g s ASN 126 N -6.02 2.73 -0.05 6.45 0.01 -1.26 -4.33 114.94 112.48 1h3g s ASN 126 Ca -0.11 -0.54 0.01 0.00 -0.71 0.00 0.00 52.86 51.51 1h3g s ASN 126 Cb 0.20 -0.24 0.02 0.00 0.41 0.00 0.00 41.25 41.64 1h3g s ASN 126 CO 0.79 0.21 -0.03 -0.69 -1.51 0.00 0.00 177.10 175.87 1h3g s VAL 127 N -0.77 0.44 0.19 1.60 1.01 -1.26 -4.98 120.40 116.62 1h3g s VAL 127 Ca 0.09 -0.04 -0.33 0.00 0.00 0.00 0.00 61.98 61.70 1h3g s VAL 127 Cb -0.09 -0.50 -0.14 0.00 0.00 0.00 0.00 36.38 35.65 1h3g s VAL 127 CO 0.02 0.21 1.52 0.00 0.00 0.00 0.00 175.10 176.85 1h3g n ALA 128 N 4.24 1.27 -0.79 5.51 0.00 -1.26 -4.78 120.51 124.70 1h3g n ALA 128 Ca -0.22 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.65 1h3g n ALA 128 Cb 0.51 -2.32 0.00 0.00 0.00 0.00 0.00 19.45 17.63 1h3g n ALA 128 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h3g n GLY 129 N 2.96 0.61 0.91 0.00 0.00 -1.26 -5.18 105.19 103.22 1h3g n GLY 129 Ca 0.15 -0.50 -0.03 0.00 0.00 0.00 0.00 46.02 45.64 1h3g n GLY 129 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h3g n ARG 131 N -0.68 0.07 -2.73 1.61 1.74 -1.26 -5.13 116.66 110.28 1h3g n ARG 131 Ca 0.00 0.03 -0.42 0.00 -0.77 0.00 0.00 57.85 56.69 1h3g n ARG 131 Cb 0.26 -0.62 -0.03 0.00 -1.02 0.00 0.00 32.46 31.06 1h3g n ARG 131 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1h3g s GLU 132 N -2.07 4.54 0.07 5.56 2.12 -1.24 -4.98 118.70 122.70 1h3g s GLU 132 Ca -0.04 1.38 -0.21 0.00 0.36 0.00 0.00 54.97 56.46 1h3g s GLU 132 Cb 0.02 -3.46 -0.06 0.00 0.26 0.00 0.00 34.13 30.88 1h3g s GLU 132 CO 0.06 -0.06 0.61 -0.65 -0.54 0.00 0.00 175.26 174.68 1h3g s GLN 133 N 1.06 4.29 0.54 4.30 -1.52 -1.26 -4.86 119.66 122.21 1h3g s GLN 133 Ca 0.51 0.80 -0.21 0.00 -1.95 0.00 0.00 55.36 54.51 1h3g s GLN 133 Cb -0.21 -3.27 -0.06 0.00 -0.22 0.00 0.00 33.01 29.25 1h3g s GLN 133 CO 0.27 0.56 1.05 0.00 -0.25 0.00 0.00 175.29 176.91 1h3g n ALA 134 N 1.97 0.45 -3.21 6.09 0.00 -1.26 -4.66 120.51 119.89 1h3g n ALA 134 Ca -0.09 0.09 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 1h3g n ALA 134 Cb 0.50 -2.15 -0.02 0.00 0.00 0.00 0.00 19.45 17.79 1h3g n ALA 134 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1h3g s ASP 135 N -1.05 -0.94 0.44 0.00 -1.08 0.68 -4.89 116.67 109.83 1h3g s ASP 135 Ca 0.72 -0.19 0.30 0.00 -0.52 0.00 0.00 52.55 52.86 1h3g s ASP 135 Cb -0.45 1.70 1.39 0.00 -1.46 0.00 0.00 42.92 44.10 1h3g s ASP 135 CO 0.50 -0.29 1.91 -0.09 0.52 0.00 0.00 175.17 177.71 1h3g h ARG 136 N 7.86 0.00 0.00 4.34 2.43 -1.86 -2.07 114.38 125.09 1h3g h ARG 136 Ca -0.02 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1h3g h ARG 136 Cb 1.16 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.71 1h3g h ARG 136 CO 0.18 0.00 -0.32 0.00 -1.51 0.00 0.00 179.97 178.32 1h3g h ARG 137 N 0.00 0.00 -5.36 0.20 3.08 -1.95 -3.45 114.38 106.90 1h3g h ARG 137 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 1h3g h ARG 137 Cb 0.30 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 30.22 1h3g h ARG 137 CO 0.00 0.00 -0.03 -1.58 -1.07 0.00 0.00 179.97 177.29 1h3g s HIS 138 N -3.17 3.28 0.50 3.04 2.46 -0.78 -4.96 115.29 115.67 1h3g s HIS 138 Ca 0.07 0.64 0.21 0.00 0.47 0.00 0.00 55.06 56.46 1h3g s HIS 138 Cb 0.11 -2.70 1.28 0.00 -0.13 0.00 0.00 32.58 31.14 1h3g s HIS 138 CO 0.67 -0.25 1.99 0.78 -2.47 0.00 0.00 174.74 175.46 1h3g h GLY 139 N 8.64 0.20 -2.26 1.59 0.00 -1.86 0.07 103.07 109.44 1h3g h GLY 139 Ca -0.30 -0.05 -0.06 0.00 0.00 0.00 0.00 47.33 46.92 1h3g h GLY 139 CO 0.71 0.03 0.04 0.61 0.00 0.00 0.00 176.54 177.93 1h3g n GLY 140 N -1.60 3.96 3.87 4.60 0.00 -1.26 -4.70 105.19 110.06 1h3g n GLY 140 Ca 0.09 -1.05 -0.21 0.00 0.00 0.00 0.00 46.02 44.86 1h3g n GLY 140 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h3g n GLY 141 N -0.39 2.15 3.70 -0.02 0.00 0.01 -3.97 105.19 106.67 1h3g n GLY 141 Ca 0.27 -2.24 -0.40 0.00 0.00 0.00 0.00 46.02 43.65 1h3g n GLY 141 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1h3g s ARG 142 N -4.53 4.40 -0.00 1.61 0.52 -1.26 -4.75 118.95 114.94 1h3g s ARG 142 Ca 0.53 0.90 0.22 0.00 -0.52 0.00 0.00 55.73 56.87 1h3g s ARG 142 Cb -0.04 -3.48 -0.28 0.00 0.52 0.00 0.00 34.95 31.67 1h3g s ARG 142 CO 0.34 -0.03 0.61 0.72 0.02 0.00 0.00 175.30 176.96 1h3g n HIS 143 N 4.11 0.10 0.00 -0.53 8.25 -1.26 -0.23 115.22 125.66 1h3g n HIS 143 Ca -0.00 0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 1h3g n HIS 143 Cb 0.51 -0.48 0.00 0.00 1.12 0.00 0.00 29.99 31.14 1h3g n HIS 143 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1h3g n GLY 144 N 1.29 0.94 3.74 -1.41 0.00 -1.24 -4.75 105.19 103.76 1h3g n GLY 144 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 1h3g n GLY 144 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1h3g s GLY 145 N -1.41 2.87 0.33 -0.02 0.00 0.48 -4.34 107.32 105.22 1h3g s GLY 145 Ca 0.00 1.26 -0.11 0.00 0.00 0.00 0.00 44.72 45.87 1h3g s GLY 145 CO 0.00 1.73 0.59 0.51 0.00 0.00 0.00 173.10 175.94 1h3g s ASP 146 N -1.18 0.28 0.17 1.64 3.84 0.01 -4.03 116.67 117.40 1h3g s ASP 146 Ca 0.76 -1.16 -0.11 0.00 -0.00 0.00 0.00 52.55 52.04 1h3g s ASP 146 Cb -0.38 0.71 0.07 0.00 -1.38 0.00 0.00 42.92 41.93 1h3g s ASP 146 CO 0.43 -1.38 1.67 0.40 -0.00 0.00 0.00 175.17 176.30 1h3g h ILE 147 N 2.10 1.25 -0.60 2.11 2.04 -1.62 -1.82 117.51 120.98 1h3g h ILE 147 Ca -0.28 -0.94 0.07 0.00 1.00 0.00 0.00 64.86 64.71 1h3g h ILE 147 Cb 1.25 0.72 -0.06 0.00 -0.74 0.00 0.00 36.82 37.98 1h3g h ILE 147 CO 0.37 0.35 0.28 -0.09 0.00 0.00 0.00 178.15 179.06 1h3g h ARG 148 N 0.88 0.50 -0.76 2.37 9.65 -1.90 0.14 114.38 125.25 1h3g h ARG 148 Ca 0.18 -0.03 0.01 0.00 -1.10 0.00 0.00 59.98 59.04 1h3g h ARG 148 Cb 0.38 -0.11 -0.04 0.00 -1.39 0.00 0.00 29.97 28.81 1h3g h ARG 148 CO 0.01 0.33 0.51 0.78 2.80 0.00 0.00 179.97 184.39 1h3g h GLY 149 N 0.51 1.08 0.80 2.80 0.00 -1.52 -0.75 103.07 105.98 1h3g h GLY 149 Ca 0.28 -0.40 -0.00 0.00 0.00 0.00 0.00 47.33 47.21 1h3g h GLY 149 CO -0.23 0.39 0.01 -0.84 0.00 0.00 0.00 176.54 175.87 1h3g h THR 150 N 1.03 1.17 -0.78 4.70 2.02 -0.46 -2.89 112.91 117.71 1h3g h THR 150 Ca 0.28 -0.52 0.08 0.00 0.77 0.00 0.00 66.41 67.02 1h3g h THR 150 Cb -0.11 1.47 -0.07 0.00 -1.74 0.00 0.00 68.15 67.70 1h3g h THR 150 CO -0.06 0.14 0.45 0.40 0.37 0.00 0.00 175.52 176.81 1h3g h ILE 151 N -0.16 0.95 0.00 3.11 2.04 -0.55 -0.45 117.51 122.44 1h3g h ILE 151 Ca 0.01 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.60 1h3g h ILE 151 Cb 0.22 0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.39 1h3g h ILE 151 CO -0.00 0.14 0.00 0.44 0.00 0.00 0.00 178.15 178.73 1h3g h ASP 152 N 0.78 0.00 0.00 1.72 3.32 -0.94 -2.55 116.42 118.75 1h3g h ASP 152 Ca 0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.41 1h3g h ASP 152 Cb 0.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.82 1h3g h ASP 152 CO -0.22 0.00 -0.03 1.41 -1.72 0.00 0.00 179.24 178.69 1h3g n HIS 153 N -2.79 0.00 -0.11 4.55 8.25 -0.23 -4.65 115.22 120.23 1h3g n HIS 153 Ca -0.02 -0.77 0.04 0.00 -0.26 0.00 0.00 57.72 56.71 1h3g n HIS 153 Cb 0.07 -0.11 0.36 0.00 1.12 0.00 0.00 29.99 31.42 1h3g n HIS 153 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1h3g h LEU 154 N 0.00 0.63 -0.67 2.41 3.38 -0.98 -1.87 115.31 118.21 1h3g h LEU 154 Ca 0.00 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 57.99 1h3g h LEU 154 Cb 0.87 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.43 1h3g h LEU 154 CO 0.00 0.44 0.41 0.44 0.09 0.00 0.00 178.44 179.83 1h3g h ASP 155 N 0.74 0.67 0.02 -0.43 3.45 -1.82 0.21 116.42 119.26 1h3g h ASP 155 Ca 0.23 0.00 0.01 0.00 0.43 0.00 0.00 57.03 57.71 1h3g h ASP 155 Cb 0.03 -0.14 -0.02 0.00 -0.56 0.00 0.00 39.33 38.64 1h3g h ASP 155 CO -0.06 0.46 -0.08 0.22 -1.57 0.00 0.00 179.24 178.22 1h3g h TYR 156 N 0.81 -0.20 -0.09 4.55 3.20 -1.70 0.22 116.97 123.76 1h3g h TYR 156 Ca 0.27 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.15 1h3g h TYR 156 Cb 0.04 0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.39 1h3g h TYR 156 CO -0.05 -0.12 0.05 0.82 -1.64 0.00 0.00 178.16 177.22 1h3g h ILE 157 N -0.14 1.01 -0.69 1.81 2.04 -0.84 -0.49 117.51 120.19 1h3g h ILE 157 Ca 0.03 -0.04 -0.00 0.00 1.00 0.00 0.00 64.86 65.85 1h3g h ILE 157 Cb 0.17 0.89 -0.03 0.00 -0.74 0.00 0.00 36.82 37.11 1h3g h ILE 157 CO -0.07 0.02 0.42 0.00 0.00 0.00 0.00 178.15 178.53 1h3g h ALA 158 N 1.04 0.88 -0.03 1.87 0.00 -0.51 -2.53 119.26 119.98 1h3g h ALA 158 Ca 0.04 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1h3g h ALA 158 Cb -0.00 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.51 1h3g h ALA 158 CO -0.02 0.35 -0.08 0.78 0.00 0.00 0.00 179.25 180.28 1h3g h GLY 159 N 0.95 0.05 2.00 0.00 0.00 -0.07 0.12 103.07 106.12 1h3g h GLY 159 Ca 0.25 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.55 1h3g h GLY 159 CO -0.05 0.02 0.00 1.41 0.00 0.00 0.00 176.54 177.93 1h3g h LEU 160 N 0.05 0.00 0.00 3.11 3.38 -0.66 -3.47 115.31 117.72 1h3g h LEU 160 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1h3g h LEU 160 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1h3g h LEU 160 CO 0.01 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.15 1h3g n GLY 161 N 0.05 1.12 3.87 0.83 0.00 0.43 -3.95 105.19 107.54 1h3g n GLY 161 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 1h3g n GLY 161 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1h3g s PHE 162 N -2.00 3.44 0.00 1.61 0.08 -1.14 -4.56 117.98 115.41 1h3g s PHE 162 Ca 0.00 1.05 0.00 0.00 0.12 0.00 0.00 56.93 58.10 1h3g s PHE 162 Cb 0.00 -2.43 0.00 0.00 -0.57 0.00 0.00 43.02 40.02 1h3g s PHE 162 CO 0.00 0.01 0.52 0.25 -0.10 0.00 0.00 175.22 175.90 1h3g n THR 163 N -0.89 0.27 -3.79 0.64 -2.24 -0.23 -4.37 114.28 103.67 1h3g n THR 163 Ca 0.02 -0.36 -0.13 0.00 -2.27 0.00 0.00 64.05 61.32 1h3g n THR 163 Cb 0.54 1.09 -0.12 0.00 -2.10 0.00 0.00 70.33 69.73 1h3g n THR 163 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1h3g s GLN 164 N -0.27 0.23 -0.17 -0.78 -1.52 -0.97 -0.72 119.66 115.47 1h3g s GLN 164 Ca 0.00 0.33 -0.02 0.00 -1.95 0.00 0.00 55.36 53.72 1h3g s GLN 164 Cb 0.00 0.06 -0.01 0.00 -0.22 0.00 0.00 33.01 32.84 1h3g s GLN 164 CO 0.00 -0.06 -0.08 -1.17 -0.25 0.00 0.00 175.29 173.73 1h3g s LEU 165 N 0.35 2.89 -0.35 2.90 2.96 0.24 -0.85 118.68 126.81 1h3g s LEU 165 Ca -0.02 -0.31 0.03 0.00 -0.22 0.00 0.00 54.13 53.61 1h3g s LEU 165 Cb -0.03 -1.69 0.10 0.00 0.50 0.00 0.00 46.19 45.07 1h3g s LEU 165 CO -0.01 0.10 0.07 0.86 -1.32 0.00 0.00 176.35 176.05 1h3g s TRP 166 N 0.75 3.44 0.09 5.38 -0.00 -0.26 -0.56 118.94 127.77 1h3g s TRP 166 Ca -0.04 -2.85 -0.15 0.00 -0.00 0.00 0.00 56.10 53.06 1h3g s TRP 166 Cb -0.15 -2.75 -0.06 0.00 -0.00 0.00 0.00 33.47 30.50 1h3g s TRP 166 CO 0.02 -0.92 0.51 -1.25 -0.00 0.00 0.00 176.95 175.30 1h3g s PRO 167 N 0.89 3.99 1.03 5.86 0.04 -1.25 -0.99 135.00 144.58 1h3g s PRO 167 Ca 0.11 0.50 -0.12 0.00 0.04 0.00 0.00 61.00 61.53 1h3g s PRO 167 Cb -0.19 -3.06 0.21 0.00 0.04 0.00 0.00 34.50 31.49 1h3g s PRO 167 CO -0.09 0.56 1.08 0.95 0.04 0.00 0.00 177.00 179.54 1h3g s THR 168 N -1.30 2.13 0.39 1.26 -4.23 -0.47 -3.76 115.64 109.65 1h3g s THR 168 Ca 0.33 0.04 -0.25 0.00 -1.18 0.00 0.00 61.69 60.62 1h3g s THR 168 Cb -0.16 -2.14 -0.11 0.00 1.34 0.00 0.00 72.50 71.43 1h3g s THR 168 CO 0.18 -0.05 1.11 -2.65 -0.54 0.00 0.00 174.62 172.67 1h3g n PRO 169 N -4.52 1.60 0.00 3.99 -0.02 -1.26 -4.64 135.00 130.14 1h3g n PRO 169 Ca 0.07 0.57 0.04 0.00 -2.02 0.00 0.00 63.50 62.16 1h3g n PRO 169 Cb 0.53 -2.14 0.03 0.00 -0.02 0.00 0.00 33.50 31.90 1h3g n PRO 169 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1h3g n LEU 170 N 0.54 1.59 -4.76 2.45 4.77 -1.26 -4.48 117.00 115.85 1h3g n LEU 170 Ca 0.08 -0.96 -0.37 0.00 -0.03 0.00 0.00 56.01 54.72 1h3g n LEU 170 Cb 0.38 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.48 1h3g n LEU 170 CO 0.58 0.32 0.89 0.54 -1.33 0.00 0.00 177.39 178.39 1h3g s VAL 171 N -0.76 2.70 -0.00 4.08 0.11 -1.26 0.23 120.40 125.50 1h3g s VAL 171 Ca 0.09 0.52 -0.39 0.00 -2.93 0.00 0.00 61.98 59.27 1h3g s VAL 171 Cb 0.07 -3.26 -0.18 0.00 -1.53 0.00 0.00 36.38 31.48 1h3g s VAL 171 CO 0.12 -0.01 1.25 1.21 -3.33 0.00 0.00 175.10 174.33 1h3g n GLU 172 N -0.77 0.55 -3.55 1.54 2.13 0.22 -4.27 120.64 116.49 1h3g n GLU 172 Ca 0.09 0.20 -0.27 0.00 0.66 0.00 0.00 57.16 57.84 1h3g n GLU 172 Cb 0.47 -1.77 -0.10 0.00 0.27 0.00 0.00 31.44 30.31 1h3g n GLU 172 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1h3g n ASN 173 N 2.26 1.44 -2.93 4.31 5.03 -1.26 -0.53 115.26 123.58 1h3g n ASN 173 Ca 0.20 -2.86 -0.31 0.00 0.87 0.00 0.00 54.58 52.47 1h3g n ASN 173 Cb 0.12 -0.65 -0.06 0.00 -1.02 0.00 0.00 39.78 38.17 1h3g n ASN 173 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 1h3g n ASP 174 N 2.05 7.38 -4.92 6.41 2.03 -1.26 -4.69 116.55 123.54 1h3g n ASP 174 Ca 0.25 -2.85 -0.26 0.00 0.52 0.00 0.00 54.79 52.45 1h3g n ASP 174 Cb 0.43 -1.41 0.00 0.00 -0.72 0.00 0.00 41.12 39.43 1h3g n ASP 174 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1h3g s ALA 175 N 0.17 3.45 0.21 -1.67 0.00 -1.26 -4.69 121.76 117.97 1h3g s ALA 175 Ca 0.62 -0.63 0.02 0.00 0.00 0.00 0.00 51.96 51.97 1h3g s ALA 175 Cb 0.25 -2.50 0.17 0.00 0.00 0.00 0.00 23.12 21.04 1h3g s ALA 175 CO -0.09 -0.40 1.51 0.00 0.00 0.00 0.00 175.76 176.78 1h3g h ALA 176 N 0.23 0.75 -2.74 0.00 0.00 -1.94 -3.27 119.26 112.28 1h3g h ALA 176 Ca -0.47 -0.57 -0.24 0.00 0.00 0.00 0.00 54.91 53.64 1h3g h ALA 176 Cb 1.22 -0.08 -0.18 0.00 0.00 0.00 0.00 17.79 18.75 1h3g h ALA 176 CO 0.61 0.74 -0.71 0.00 0.00 0.00 0.00 179.25 179.89 1h3g s ALA 177 N -3.72 0.70 -1.43 0.00 0.00 -1.26 -4.48 121.76 111.57 1h3g s ALA 177 Ca -0.05 -1.01 -0.09 0.00 0.00 0.00 0.00 51.96 50.81 1h3g s ALA 177 Cb 0.11 0.11 0.05 0.00 0.00 0.00 0.00 23.12 23.39 1h3g s ALA 177 CO 0.82 -0.13 0.68 0.66 0.00 0.00 0.00 175.76 177.78 1h3g n TYR 178 N 0.81 -2.02 0.25 0.00 4.01 -1.25 -4.84 117.16 114.12 1h3g n TYR 178 Ca -0.18 0.62 0.14 0.00 -0.16 0.00 0.00 57.90 58.32 1h3g n TYR 178 Cb 0.57 -3.77 0.52 0.00 -0.31 0.00 0.00 39.34 36.35 1h3g n TYR 178 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1h3g h SER 179 N -1.45 0.00 -0.29 7.72 4.64 -1.83 -3.30 113.55 119.04 1h3g h SER 179 Ca -0.50 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 60.83 1h3g h SER 179 Cb 1.34 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.41 1h3g h SER 179 CO 0.58 0.05 0.19 0.10 -0.87 0.00 0.00 176.83 176.89 1h3g h TYR 180 N 0.00 0.34 0.00 4.77 -0.00 -1.85 -3.00 116.97 117.23 1h3g h TYR 180 Ca -0.00 0.01 -0.07 0.00 -0.00 0.00 0.00 58.73 58.66 1h3g h TYR 180 Cb 0.68 -0.12 -0.01 0.00 -0.00 0.00 0.00 36.73 37.29 1h3g h TYR 180 CO 0.00 0.21 -0.35 1.12 -0.00 0.00 0.00 178.16 179.14 1h3g h HIS 181 N 0.36 0.00 0.00 0.10 2.07 -1.94 -3.44 115.15 112.31 1h3g h HIS 181 Ca 0.11 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.63 1h3g h HIS 181 Cb 0.00 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.98 1h3g h HIS 181 CO -0.00 0.35 0.00 0.41 -3.07 0.00 0.00 177.93 175.62 1h3g n GLY 182 N 0.22 1.77 0.22 6.13 0.00 -1.14 -4.37 105.19 108.03 1h3g n GLY 182 Ca -0.00 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 1h3g n GLY 182 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1h3g n TYR 183 N -2.00 0.16 -3.50 1.61 4.01 -1.26 -4.29 117.16 111.89 1h3g n TYR 183 Ca 0.00 -0.08 -0.27 0.00 -0.16 0.00 0.00 57.90 57.39 1h3g n TYR 183 Cb 0.00 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 38.93 1h3g n TYR 183 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1h3g n ALA 184 N -0.15 3.10 -1.79 -0.72 0.00 -1.26 -4.82 120.51 114.86 1h3g n ALA 184 Ca 0.04 -3.77 -0.41 0.00 0.00 0.00 0.00 53.44 49.30 1h3g n ALA 184 Cb 0.10 -0.86 -0.01 0.00 0.00 0.00 0.00 19.45 18.68 1h3g n ALA 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h3g s ALA 185 N -0.93 3.65 -0.87 0.00 0.00 -1.26 -3.65 121.76 118.71 1h3g s ALA 185 Ca 0.32 1.49 0.09 0.00 0.00 0.00 0.00 51.96 53.86 1h3g s ALA 185 Cb 0.06 -3.60 0.02 0.00 0.00 0.00 0.00 23.12 19.59 1h3g s ALA 185 CO -0.15 -0.92 0.63 0.25 0.00 0.00 0.00 175.76 175.57 1h3g n THR 186 N 1.61 0.00 -3.15 0.00 -2.24 0.31 -0.40 114.28 110.40 1h3g n THR 186 Ca 0.05 -0.44 0.05 0.00 -2.27 0.00 0.00 64.05 61.44 1h3g n THR 186 Cb 0.39 1.12 -0.00 0.00 -2.10 0.00 0.00 70.33 69.74 1h3g n THR 186 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1h3g s ASP 187 N -1.08 -1.10 0.16 3.42 -1.08 -1.24 -3.38 116.67 112.39 1h3g s ASP 187 Ca 0.08 0.31 0.22 0.00 -0.52 0.00 0.00 52.55 52.64 1h3g s ASP 187 Cb 0.07 1.77 0.88 0.00 -1.46 0.00 0.00 42.92 44.18 1h3g s ASP 187 CO 0.18 -0.20 1.67 1.41 0.52 0.00 0.00 175.17 178.75 1h3g n HIS 188 N 5.35 0.55 -0.38 -5.34 8.25 -1.26 -2.62 115.22 119.78 1h3g n HIS 188 Ca 0.03 0.20 0.09 0.00 -0.26 0.00 0.00 57.72 57.78 1h3g n HIS 188 Cb 0.54 -0.83 0.27 0.00 1.12 0.00 0.00 29.99 31.09 1h3g n HIS 188 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1h3g n TYR 189 N -1.99 0.89 -3.98 4.41 4.01 -1.26 -4.94 117.16 114.30 1h3g n TYR 189 Ca 0.03 -0.54 -0.20 0.00 -0.16 0.00 0.00 57.90 57.03 1h3g n TYR 189 Cb 0.25 -0.06 -0.17 0.00 -0.31 0.00 0.00 39.34 39.05 1h3g n TYR 189 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 1h3g s ARG 190 N -1.22 0.65 0.44 -0.72 3.52 -1.08 -5.01 118.95 115.53 1h3g s ARG 190 Ca 0.40 0.00 -0.25 0.00 -0.13 0.00 0.00 55.73 55.76 1h3g s ARG 190 Cb 0.23 -0.81 -0.08 0.00 -1.56 0.00 0.00 34.95 32.73 1h3g s ARG 190 CO 0.25 -0.17 1.34 0.42 -0.81 0.00 0.00 175.30 176.33 1h3g s ILE 191 N 1.29 2.41 0.15 4.11 -1.09 -1.26 0.71 121.20 127.51 1h3g s ILE 191 Ca -0.05 0.35 -0.31 0.00 -2.23 0.00 0.00 60.65 58.41 1h3g s ILE 191 Cb -0.13 -3.20 -0.10 0.00 -1.58 0.00 0.00 42.46 37.44 1h3g s ILE 191 CO -0.02 0.04 1.63 -0.62 -1.23 0.00 0.00 174.94 174.74 1h3g s ASP 192 N -0.74 6.55 0.58 3.58 2.15 0.13 -4.35 116.67 124.58 1h3g s ASP 192 Ca 0.61 2.63 0.28 0.00 0.43 0.00 0.00 52.55 56.50 1h3g s ASP 192 Cb -0.39 -2.59 1.68 0.00 -0.30 0.00 0.00 42.92 41.32 1h3g s ASP 192 CO 0.50 -0.87 2.14 -0.65 -0.17 0.00 0.00 175.17 176.12 1h3g h PRO 193 N 7.30 0.00 0.00 4.34 0.11 -1.90 0.24 132.00 142.08 1h3g h PRO 193 Ca -0.43 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.66 1h3g h PRO 193 Cb 1.20 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 1h3g h PRO 193 CO 0.93 0.00 -0.11 0.00 -0.21 0.00 0.00 178.00 178.61 1h3g h ARG 194 N 0.00 0.00 0.00 1.05 -0.00 -1.88 -2.73 114.38 110.82 1h3g h ARG 194 Ca 0.06 0.00 -0.30 0.00 -0.50 0.00 0.00 59.98 59.25 1h3g h ARG 194 Cb 0.34 0.00 -0.05 0.00 0.00 0.00 0.00 29.97 30.26 1h3g h ARG 194 CO -0.00 0.11 -1.89 0.66 0.00 0.00 0.00 179.97 178.85 1h3g n TYR 195 N -3.44 0.68 -1.43 3.04 4.01 0.80 -4.56 117.16 116.27 1h3g n TYR 195 Ca -0.01 0.24 0.00 0.00 -0.16 0.00 0.00 57.90 57.97 1h3g n TYR 195 Cb 0.27 -1.11 0.00 0.00 -0.31 0.00 0.00 39.34 38.19 1h3g n TYR 195 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1h3g n GLY 196 N 1.59 0.38 3.88 2.72 0.00 -0.93 -1.70 105.19 111.14 1h3g n GLY 196 Ca -0.21 -1.62 -0.21 0.00 0.00 0.00 0.00 46.02 43.99 1h3g n GLY 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1h3g s SER 197 N -4.00 5.33 0.29 1.61 1.04 -1.26 -3.82 113.70 112.89 1h3g s SER 197 Ca 0.00 -0.51 0.04 0.00 0.48 0.00 0.00 55.95 55.96 1h3g s SER 197 Cb 0.00 -0.90 0.66 0.00 0.10 0.00 0.00 66.02 65.88 1h3g s SER 197 CO 0.00 -0.45 1.80 0.78 0.98 0.00 0.00 173.24 176.35 1h3g h ASN 198 N 1.13 0.83 -0.19 7.02 4.21 -1.95 -0.40 115.58 126.23 1h3g h ASN 198 Ca -0.44 0.08 -0.08 0.00 1.21 0.00 0.00 56.30 57.07 1h3g h ASN 198 Cb 1.26 -0.08 -0.02 0.00 -1.12 0.00 0.00 38.32 38.37 1h3g h ASN 198 CO 0.57 0.35 -0.13 -0.33 -1.29 0.00 0.00 177.43 176.60 1h3g h GLU 199 N 0.85 0.58 -0.37 0.81 3.07 -1.99 -2.03 114.58 115.49 1h3g h GLU 199 Ca 0.55 -0.18 -0.07 0.00 -0.50 0.00 0.00 59.36 59.16 1h3g h GLU 199 Cb 0.74 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.57 1h3g h GLU 199 CO -0.34 0.69 -0.06 -0.44 -1.40 0.00 0.00 179.01 177.46 1h3g h ASP 200 N 0.53 0.60 -0.31 1.42 3.32 -1.46 -1.31 116.42 119.22 1h3g h ASP 200 Ca 0.09 -0.15 -0.03 0.00 0.02 0.00 0.00 57.03 56.96 1h3g h ASP 200 Cb 0.53 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 1h3g h ASP 200 CO 0.03 0.72 0.06 0.15 -1.72 0.00 0.00 179.24 178.48 1h3g h PHE 201 N 0.58 0.53 -0.78 4.55 3.57 -0.89 0.27 116.94 124.77 1h3g h PHE 201 Ca 0.11 -0.07 0.02 0.00 3.53 0.00 0.00 57.97 61.56 1h3g h PHE 201 Cb 0.47 -0.15 -0.04 0.00 2.79 0.00 0.00 35.95 39.02 1h3g h PHE 201 CO 0.02 0.57 0.52 0.28 -2.23 0.00 0.00 178.31 177.47 1h3g h VAL 202 N 0.33 1.18 -0.59 1.41 2.07 -1.23 -1.47 116.25 117.95 1h3g h VAL 202 Ca 0.09 -0.35 -0.08 0.00 0.82 0.00 0.00 66.70 67.18 1h3g h VAL 202 Cb 0.32 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.12 1h3g h VAL 202 CO 0.00 0.19 0.05 -0.09 0.02 0.00 0.00 177.57 177.75 1h3g h ARG 203 N 1.03 1.00 -0.40 1.57 2.43 -0.32 0.23 114.38 119.93 1h3g h ARG 203 Ca 0.30 -0.29 0.08 0.00 -0.81 0.00 0.00 59.98 59.25 1h3g h ARG 203 Cb -0.07 -0.10 -0.07 0.00 -0.42 0.00 0.00 29.97 29.30 1h3g h ARG 203 CO -0.07 0.97 -0.07 1.25 -1.51 0.00 0.00 179.97 180.54 1h3g h LEU 204 N 0.90 -0.31 -0.40 3.80 5.85 0.41 0.39 115.31 125.96 1h3g h LEU 204 Ca 0.17 0.11 0.00 0.00 0.84 0.00 0.00 57.88 59.01 1h3g h LEU 204 Cb 0.48 0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 1h3g h LEU 204 CO 0.02 -0.11 0.25 -1.28 -0.34 0.00 0.00 178.44 176.98 1h3g h SER 205 N 0.03 0.47 -0.17 1.25 0.87 -0.70 0.91 113.55 116.21 1h3g h SER 205 Ca 0.20 -0.04 -0.16 0.00 -1.23 0.00 0.00 61.79 60.56 1h3g h SER 205 Cb 0.30 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.13 1h3g h SER 205 CO -0.39 0.36 -0.46 0.71 -0.53 0.00 0.00 176.83 176.52 1h3g h THR 206 N 0.53 1.29 -0.21 2.23 1.35 -0.31 -0.45 112.91 117.34 1h3g h THR 206 Ca 0.14 -1.66 -0.10 0.00 -0.55 0.00 0.00 66.41 64.25 1h3g h THR 206 Cb -0.03 1.57 -0.01 0.00 -1.73 0.00 0.00 68.15 67.95 1h3g h THR 206 CO -0.03 0.53 -0.28 -0.33 -0.25 0.00 0.00 175.52 175.16 1h3g h GLU 207 N 0.58 0.41 -0.31 4.72 4.39 -0.05 -1.79 114.58 122.53 1h3g h GLU 207 Ca 0.03 -0.16 -0.07 0.00 0.34 0.00 0.00 59.36 59.51 1h3g h GLU 207 Cb 1.02 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.64 1h3g h GLU 207 CO 0.10 0.66 -0.06 0.00 -1.16 0.00 0.00 179.01 178.54 1h3g h ALA 208 N 1.34 0.42 -0.92 3.43 0.00 -0.55 -3.01 119.26 119.98 1h3g h ALA 208 Ca 0.05 -0.28 0.03 0.00 0.00 0.00 0.00 54.91 54.71 1h3g h ALA 208 Cb 0.69 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.31 1h3g h ALA 208 CO 0.05 0.24 0.61 -0.09 0.00 0.00 0.00 179.25 180.06 1h3g h ARG 209 N 0.36 1.13 -0.43 0.00 2.43 -0.71 -0.51 114.38 116.66 1h3g h ARG 209 Ca 0.08 -0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1h3g h ARG 209 Cb 0.55 -0.26 -0.02 0.00 -0.42 0.00 0.00 29.97 29.82 1h3g h ARG 209 CO 0.03 0.75 0.27 0.87 -1.51 0.00 0.00 179.97 180.37 1h3g h LYS 210 N 1.17 0.57 -0.58 0.20 1.57 -1.20 -0.74 116.57 117.55 1h3g h LYS 210 Ca 0.36 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 59.10 1h3g h LYS 210 Cb -0.00 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.18 1h3g h LYS 210 CO -0.11 0.40 0.00 0.54 -0.57 0.00 0.00 179.45 179.71 1h3g n ARG 211 N -4.45 2.45 -1.69 3.15 1.74 -0.23 -5.13 116.66 112.49 1h3g n ARG 211 Ca 0.03 -1.50 -0.00 0.00 -0.77 0.00 0.00 57.85 55.61 1h3g n ARG 211 Cb 0.07 -1.59 0.00 0.00 -1.02 0.00 0.00 32.46 29.92 1h3g n ARG 211 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1h3g n GLY 212 N 0.72 -0.51 3.19 -0.13 0.00 -0.29 -4.92 105.19 103.25 1h3g n GLY 212 Ca 0.14 -0.07 -0.10 0.00 0.00 0.00 0.00 46.02 45.99 1h3g n GLY 212 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1h3g s GLY 214 N -1.89 0.93 -0.13 -0.02 0.00 0.10 -4.76 107.32 101.55 1h3g s GLY 214 Ca 0.01 -1.38 0.02 0.00 0.00 0.00 0.00 44.72 43.37 1h3g s GLY 214 CO 0.10 -1.27 -0.19 -2.27 0.00 0.00 0.00 173.10 169.48 1h3g s LEU 215 N -3.04 1.92 -0.19 0.66 2.96 -1.26 -0.60 118.68 119.13 1h3g s LEU 215 Ca 0.24 -0.52 -0.04 0.00 -0.22 0.00 0.00 54.13 53.59 1h3g s LEU 215 Cb 0.07 -1.28 -0.02 0.00 0.50 0.00 0.00 46.19 45.46 1h3g s LEU 215 CO 0.02 0.04 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.44 1h3g s ILE 216 N 0.94 3.72 -0.10 6.68 1.01 0.27 -0.93 121.20 132.78 1h3g s ILE 216 Ca -0.06 -0.40 -0.13 0.00 0.00 0.00 0.00 60.65 60.07 1h3g s ILE 216 Cb -0.15 -2.66 -0.05 0.00 0.01 0.00 0.00 42.46 39.61 1h3g s ILE 216 CO -0.03 0.45 0.30 -1.58 0.00 0.00 0.00 174.94 174.08 1h3g s GLN 217 N 0.94 3.98 -0.35 2.79 0.74 -0.62 -3.77 119.66 123.37 1h3g s GLN 217 Ca 0.00 0.15 -0.22 0.00 0.05 0.00 0.00 55.36 55.35 1h3g s GLN 217 Cb -0.14 -3.31 0.00 0.00 1.10 0.00 0.00 33.01 30.66 1h3g s GLN 217 CO 0.01 0.50 0.71 0.34 -0.55 0.00 0.00 175.29 176.29 1h3g s ASP 218 N -0.33 6.50 0.11 6.67 -1.08 -1.25 -1.02 116.67 126.27 1h3g s ASP 218 Ca 0.19 0.30 0.09 0.00 -0.52 0.00 0.00 52.55 52.60 1h3g s ASP 218 Cb -0.14 -2.36 -0.04 0.00 -1.46 0.00 0.00 42.92 38.92 1h3g s ASP 218 CO 0.07 -0.64 -0.19 0.68 0.52 0.00 0.00 175.17 175.61 1h3g s VAL 219 N 2.87 2.77 -0.17 1.11 -7.23 0.78 -4.24 120.40 116.30 1h3g s VAL 219 Ca 0.28 -1.48 -0.00 0.00 -1.81 0.00 0.00 61.98 58.96 1h3g s VAL 219 Cb -0.14 -2.25 -0.00 0.00 0.56 0.00 0.00 36.38 34.55 1h3g s VAL 219 CO 0.15 0.14 -0.14 -0.69 -0.31 0.00 0.00 175.10 174.25 1h3g s VAL 220 N -1.10 2.73 -0.11 1.32 1.01 -1.26 -1.00 120.40 121.98 1h3g s VAL 220 Ca 0.17 -0.74 0.14 0.00 0.00 0.00 0.00 61.98 61.55 1h3g s VAL 220 Cb -0.10 -2.17 -0.19 0.00 0.00 0.00 0.00 36.38 33.91 1h3g s VAL 220 CO 0.09 0.50 0.12 0.18 0.00 0.00 0.00 175.10 175.99 1h3g n LEU 221 N 4.22 0.00 0.09 3.92 4.77 -1.26 -4.75 117.00 123.99 1h3g n LEU 221 Ca -0.19 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.64 1h3g n LEU 221 Cb 0.51 0.27 -0.09 0.00 -2.33 0.00 0.00 43.42 41.79 1h3g n LEU 221 CO 0.28 0.27 0.07 -1.28 -1.33 0.00 0.00 177.39 175.41 1h3g h SER 222 N 0.00 0.52 -5.45 -1.43 0.87 -1.89 -3.45 113.55 102.72 1h3g h SER 222 Ca -0.30 -0.47 -0.18 0.00 -1.23 0.00 0.00 61.79 59.61 1h3g h SER 222 Cb 1.61 -0.16 -0.11 0.00 -0.44 0.00 0.00 62.40 63.30 1h3g h SER 222 CO 0.02 1.31 -0.34 -1.38 -0.53 0.00 0.00 176.83 175.91 1h3g s HIS 223 N -3.01 0.83 0.39 2.24 -3.43 -1.26 -0.47 115.29 110.58 1h3g s HIS 223 Ca -0.05 -1.10 0.05 0.00 -0.80 0.00 0.00 55.06 53.16 1h3g s HIS 223 Cb 0.08 -0.18 -0.02 0.00 -1.43 0.00 0.00 32.58 31.03 1h3g s HIS 223 CO 0.88 -0.88 0.18 0.44 -2.00 0.00 0.00 174.74 173.36 1h3g n ILE 224 N -0.38 0.00 -3.12 -5.38 -5.35 -0.41 -4.68 119.36 100.05 1h3g n ILE 224 Ca 0.01 -2.40 -0.34 0.00 -0.27 0.00 0.00 62.75 59.74 1h3g n ILE 224 Cb 0.63 0.95 -0.06 0.00 -1.74 0.00 0.00 39.64 39.42 1h3g n ILE 224 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1h3g s GLY 225 N -3.47 2.47 0.43 3.28 0.00 0.46 -2.86 107.32 107.63 1h3g s GLY 225 Ca 0.26 0.10 0.29 0.00 0.00 0.00 0.00 44.72 45.37 1h3g s GLY 225 CO 0.18 0.39 1.89 0.07 0.00 0.00 0.00 173.10 175.63 1h3g h LYS 226 N 2.83 0.00 -0.62 2.90 2.10 -1.59 0.33 116.57 122.51 1h3g h LYS 226 Ca -0.48 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 1h3g h LYS 226 Cb 1.18 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.51 1h3g h LYS 226 CO 0.65 0.00 0.00 0.72 -2.00 0.00 0.00 179.45 178.82 1h3g n HIS 227 N -2.54 0.94 -1.73 0.07 8.25 -1.26 -4.89 115.22 114.06 1h3g n HIS 227 Ca -0.01 -0.44 -0.41 0.00 -0.26 0.00 0.00 57.72 56.60 1h3g n HIS 227 Cb 0.08 -0.06 0.01 0.00 1.12 0.00 0.00 29.99 31.14 1h3g n HIS 227 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 1h3g n HIS 228 N 1.21 2.54 0.29 4.41 -0.00 0.10 -4.84 115.22 118.93 1h3g n HIS 228 Ca 0.21 0.48 0.16 0.00 -0.00 0.00 0.00 57.72 58.58 1h3g n HIS 228 Cb 0.59 -2.45 0.94 0.00 -0.00 0.00 0.00 29.99 29.07 1h3g n HIS 228 CO 0.00 0.00 0.00 0.11 -0.00 0.00 0.00 176.34 176.45 1h3g h TRP 229 N 2.49 0.00 0.00 1.57 5.08 -1.90 -3.35 115.95 119.85 1h3g h TRP 229 Ca -0.49 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.48 1h3g h TRP 229 Cb 1.27 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.43 1h3g h TRP 229 CO 0.50 0.00 0.00 0.91 -1.28 0.00 0.00 178.44 178.57 1h3g n TRP 230 N -3.73 0.00 0.00 0.12 8.01 -1.26 -3.82 117.44 116.76 1h3g n TRP 230 Ca -0.02 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.17 1h3g n TRP 230 Cb 0.13 -0.22 0.00 0.00 -2.01 0.00 0.00 31.31 29.21 1h3g n TRP 230 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 1h3g n LYS 232 N 1.79 0.00 -2.72 -0.99 5.02 -1.26 -1.03 118.16 118.97 1h3g n LYS 232 Ca 0.00 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.22 1h3g n LYS 232 Cb 0.00 -0.01 0.05 0.00 -0.02 0.00 0.00 35.03 35.06 1h3g n LYS 232 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1h3g n ASP 233 N 0.00 -2.42 -4.68 4.39 2.03 -1.25 -5.13 116.55 109.49 1h3g n ASP 233 Ca 0.00 -2.76 -0.44 0.00 0.52 0.00 0.00 54.79 52.11 1h3g n ASP 233 Cb 0.00 1.46 -0.03 0.00 -0.72 0.00 0.00 41.12 41.83 1h3g n ASP 233 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1h3g n LEU 234 N 1.71 3.86 -0.28 -2.67 4.77 -0.20 -4.86 117.00 119.33 1h3g n LEU 234 Ca 0.07 0.98 0.08 0.00 -0.03 0.00 0.00 56.01 57.11 1h3g n LEU 234 Cb 0.65 -1.50 0.23 0.00 -2.33 0.00 0.00 43.42 40.47 1h3g n LEU 234 CO -0.02 0.09 1.06 -0.65 -1.33 0.00 0.00 177.39 176.54 1h3g h PRO 235 N 8.69 0.50 -3.96 3.23 0.11 -1.97 -3.44 132.00 135.17 1h3g h PRO 235 Ca -0.47 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.50 1h3g h PRO 235 Cb 1.24 -0.11 -0.14 0.00 0.11 0.00 0.00 31.00 32.10 1h3g h PRO 235 CO 0.94 0.33 -0.41 0.95 -0.21 0.00 0.00 178.00 179.60 1h3g s THR 236 N -5.97 0.11 0.45 -1.15 -4.23 -1.26 -4.18 115.64 99.41 1h3g s THR 236 Ca -0.12 -1.42 0.34 0.00 -1.18 0.00 0.00 61.69 59.31 1h3g s THR 236 Cb 0.22 -1.66 0.36 0.00 1.34 0.00 0.00 72.50 72.76 1h3g s THR 236 CO 0.77 -0.50 2.17 -0.65 -0.54 0.00 0.00 174.62 175.87 1h3g h PRO 237 N 2.71 0.00 -0.77 3.99 0.11 -1.97 -2.73 132.00 133.34 1h3g h PRO 237 Ca -0.33 0.00 -0.56 0.00 0.11 0.00 0.00 66.00 65.22 1h3g h PRO 237 Cb 1.21 0.00 -0.41 0.00 0.11 0.00 0.00 31.00 31.91 1h3g h PRO 237 CO 0.54 0.05 -0.61 -0.40 -0.21 0.00 0.00 178.00 177.36 1h3g n ASP 238 N -3.39 5.23 0.13 -2.05 5.75 -1.26 -4.63 116.55 116.34 1h3g n ASP 238 Ca -0.02 -3.76 -0.23 0.00 -0.01 0.00 0.00 54.79 50.78 1h3g n ASP 238 Cb 0.18 -0.42 -0.15 0.00 -1.03 0.00 0.00 41.12 39.71 1h3g n ASP 238 CO 0.00 0.00 0.00 -0.25 -0.11 0.00 0.00 177.20 176.84 1h3g h TRP 239 N 2.15 0.89 -2.85 2.11 2.91 -1.84 -3.43 115.95 115.90 1h3g h TRP 239 Ca 0.40 -0.64 -0.63 0.00 1.13 0.00 0.00 58.89 59.14 1h3g h TRP 239 Cb 1.45 -0.04 -0.16 0.00 -0.51 0.00 0.00 29.16 29.90 1h3g h TRP 239 CO 0.92 1.50 -0.77 0.96 -1.03 0.00 0.00 178.44 180.02 1h3g s ILE 240 N -2.65 2.67 0.36 2.65 -4.36 -1.26 -1.02 121.20 117.59 1h3g s ILE 240 Ca -0.08 -2.02 -0.21 0.00 -0.26 0.00 0.00 60.65 58.08 1h3g s ILE 240 Cb 0.05 -2.33 -0.10 0.00 1.25 0.00 0.00 42.46 41.33 1h3g s ILE 240 CO 0.93 -0.20 0.88 0.20 0.24 0.00 0.00 174.94 177.00 1h3g s ASN 241 N -2.98 7.01 -1.26 4.36 0.02 0.37 -4.54 114.94 117.93 1h3g s ASN 241 Ca 0.25 1.62 -0.25 0.00 -1.02 0.00 0.00 52.86 53.46 1h3g s ASN 241 Cb -0.07 -2.50 0.03 0.00 0.02 0.00 0.00 41.25 38.72 1h3g s ASN 241 CO 0.13 -0.22 0.59 -1.22 0.02 0.00 0.00 177.10 176.40 1h3g n TYR 242 N -0.17 -1.50 -0.15 2.20 4.01 -1.26 -4.59 117.16 115.70 1h3g n TYR 242 Ca 0.04 0.27 -0.04 0.00 -0.16 0.00 0.00 57.90 58.01 1h3g n TYR 242 Cb 0.53 -3.00 0.15 0.00 -0.31 0.00 0.00 39.34 36.71 1h3g n TYR 242 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1h3g h GLY 243 N -2.32 0.95 0.00 2.72 0.00 -1.92 -3.42 103.07 99.08 1h3g h GLY 243 Ca -0.69 -0.59 0.00 0.00 0.00 0.00 0.00 47.33 46.04 1h3g h GLY 243 CO 0.54 0.55 0.00 0.61 0.00 0.00 0.00 176.54 178.25 1h3g n GLY 244 N -0.72 -2.00 3.67 4.60 0.00 -1.26 -4.81 105.19 104.67 1h3g n GLY 244 Ca 0.04 -0.10 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 1h3g n GLY 244 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1h3g n LYS 245 N 0.00 1.69 -2.31 1.61 2.85 -1.26 -4.91 118.16 115.82 1h3g n LYS 245 Ca 0.00 0.60 -0.42 0.00 -1.05 0.00 0.00 58.31 57.44 1h3g n LYS 245 Cb 0.00 -2.29 -0.03 0.00 -0.65 0.00 0.00 35.03 32.06 1h3g n LYS 245 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 177.40 177.47 1h3g s PHE 246 N -1.24 3.09 -0.36 5.58 5.36 -1.26 -4.91 117.98 124.23 1h3g s PHE 246 Ca 0.63 1.02 0.04 0.00 -0.96 0.00 0.00 56.93 57.66 1h3g s PHE 246 Cb -0.51 -3.56 0.10 0.00 -0.34 0.00 0.00 43.02 38.72 1h3g s PHE 246 CO 0.56 -1.94 0.08 0.08 -1.46 0.00 0.00 175.22 172.55 1h3g s VAL 247 N 1.97 2.17 0.44 3.12 1.01 -1.26 -5.10 120.40 122.75 1h3g s VAL 247 Ca 0.61 -2.38 -0.22 0.00 0.00 0.00 0.00 61.98 59.99 1h3g s VAL 247 Cb -0.30 -2.59 -0.10 0.00 0.00 0.00 0.00 36.38 33.39 1h3g s VAL 247 CO 0.26 -0.64 1.00 -2.16 0.00 0.00 0.00 175.10 173.57 1h3g s PRO 248 N 0.81 4.06 0.47 2.72 0.04 -1.26 -1.29 135.00 140.56 1h3g s PRO 248 Ca 0.12 1.30 -0.20 0.00 0.04 0.00 0.00 61.00 62.26 1h3g s PRO 248 Cb -0.20 -2.25 -0.09 0.00 0.04 0.00 0.00 34.50 32.01 1h3g s PRO 248 CO -0.08 -0.20 1.02 -0.08 0.04 0.00 0.00 177.00 177.70 1h3g s THR 249 N -1.97 3.93 -2.24 1.26 -1.32 0.99 -4.53 115.64 111.75 1h3g s THR 249 Ca 0.63 1.20 0.21 0.00 -1.21 0.00 0.00 61.69 62.52 1h3g s THR 249 Cb -0.15 -3.48 0.40 0.00 -1.51 0.00 0.00 72.50 67.76 1h3g s THR 249 CO 0.19 -0.26 1.35 0.00 -2.21 0.00 0.00 174.62 173.69 1h3g n GLN 250 N -0.90 2.41 -2.78 7.08 1.13 -1.26 -4.89 117.38 118.17 1h3g n GLN 250 Ca 0.09 -2.21 -0.19 0.00 -1.94 0.00 0.00 57.00 52.74 1h3g n GLN 250 Cb 0.53 -1.48 0.02 0.00 0.11 0.00 0.00 30.24 29.42 1h3g n GLN 250 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 1h3g n HIS 251 N 1.36 -1.52 -2.40 1.08 8.25 -1.26 -4.91 115.22 115.82 1h3g n HIS 251 Ca 0.18 0.35 -0.43 0.00 -0.26 0.00 0.00 57.72 57.56 1h3g n HIS 251 Cb 0.57 -3.97 0.00 0.00 1.12 0.00 0.00 29.99 27.71 1h3g n HIS 251 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1h3g n HIS 252 N -4.28 4.22 0.15 4.41 8.25 -1.26 -4.79 115.22 121.92 1h3g n HIS 252 Ca -0.13 -2.97 0.05 0.00 -0.26 0.00 0.00 57.72 54.41 1h3g n HIS 252 Cb 0.62 -2.44 0.49 0.00 1.12 0.00 0.00 29.99 29.78 1h3g n HIS 252 CO 0.00 0.00 0.00 0.07 0.64 0.00 0.00 176.34 177.05 1h3g h ARG 253 N 6.85 0.20 0.00 -0.41 0.11 -1.93 -1.72 114.38 117.48 1h3g h ARG 253 Ca 0.45 -0.03 0.00 0.00 0.10 0.00 0.00 59.98 60.50 1h3g h ARG 253 Cb 0.78 -0.04 0.00 0.00 1.11 0.00 0.00 29.97 31.82 1h3g h ARG 253 CO 1.55 0.23 0.00 -0.39 0.10 0.00 0.00 179.97 181.46 1h3g h VAL 254 N 0.20 0.00 0.00 0.08 -1.51 -1.93 -3.16 116.25 109.93 1h3g h VAL 254 Ca 0.05 -0.29 -0.00 0.00 -1.23 0.00 0.00 66.70 65.23 1h3g h VAL 254 Cb 0.16 1.07 -0.00 0.00 -2.13 0.00 0.00 31.29 30.39 1h3g h VAL 254 CO 0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 177.57 176.34 1h3g h ALA 255 N 2.25 1.05 -0.00 5.19 0.00 -1.65 0.23 119.26 126.33 1h3g h ALA 255 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1h3g h ALA 255 Cb 0.41 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1h3g h ALA 255 CO 0.00 0.01 -0.25 1.33 0.00 0.00 0.00 179.25 180.34 1h3g n VAL 256 N -3.17 0.00 -2.91 0.00 0.24 -1.20 -4.28 118.33 107.01 1h3g n VAL 256 Ca -0.02 -0.03 -0.13 0.00 -2.04 0.00 0.00 64.34 62.11 1h3g n VAL 256 Cb 0.11 0.01 0.02 0.00 -1.47 0.00 0.00 33.84 32.52 1h3g n VAL 256 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1h3g n GLN 257 N -1.23 1.05 -3.71 7.34 10.64 0.77 -5.08 117.38 127.16 1h3g n GLN 257 Ca 0.09 -2.96 -0.13 0.00 -1.83 0.00 0.00 57.00 52.17 1h3g n GLN 257 Cb 0.32 -1.30 -0.14 0.00 -0.86 0.00 0.00 30.24 28.27 1h3g n GLN 257 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 1h3g s ASP 258 N -2.33 0.03 0.52 2.61 3.68 -0.99 -4.95 116.67 115.24 1h3g s ASP 258 Ca 0.32 0.47 0.24 0.00 2.13 0.00 0.00 52.55 55.71 1h3g s ASP 258 Cb 0.38 0.41 1.41 0.00 -1.45 0.00 0.00 42.92 43.67 1h3g s ASP 258 CO -0.04 -0.19 2.10 -0.65 0.13 0.00 0.00 175.17 176.52 1h3g h PRO 259 N 7.60 0.00 -0.60 4.34 0.11 -1.94 -2.64 132.00 138.87 1h3g h PRO 259 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1h3g h PRO 259 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1h3g h PRO 259 CO 0.30 0.10 0.00 0.66 -0.21 0.00 0.00 178.00 178.85 1h3g n TYR 260 N -3.92 1.36 -2.00 0.65 4.01 -1.26 -5.02 117.16 110.98 1h3g n TYR 260 Ca -0.02 -0.62 -0.37 0.00 -0.16 0.00 0.00 57.90 56.72 1h3g n TYR 260 Cb 0.20 -0.23 0.02 0.00 -0.31 0.00 0.00 39.34 39.02 1h3g n TYR 260 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1h3g s ALA 261 N -1.85 2.80 -0.07 -0.72 0.00 -1.00 -5.01 121.76 115.90 1h3g s ALA 261 Ca 0.48 1.12 -0.13 0.00 0.00 0.00 0.00 51.96 53.43 1h3g s ALA 261 Cb 0.31 -3.48 -0.05 0.00 0.00 0.00 0.00 23.12 19.91 1h3g s ALA 261 CO 0.23 -1.08 0.31 0.00 0.00 0.00 0.00 175.76 175.22 1h3g s ALA 262 N -1.46 3.72 0.30 0.00 0.00 -1.26 -4.97 121.76 118.09 1h3g s ALA 262 Ca 0.70 -0.38 0.05 0.00 0.00 0.00 0.00 51.96 52.34 1h3g s ALA 262 Cb -0.34 -2.28 0.71 0.00 0.00 0.00 0.00 23.12 21.21 1h3g s ALA 262 CO 0.40 0.42 1.79 1.96 0.00 0.00 0.00 175.76 180.33 1h3g h GLN 263 N 5.25 0.78 -0.89 0.00 4.20 -1.95 -1.45 115.11 121.05 1h3g h GLN 263 Ca -0.50 -0.05 0.09 0.00 0.06 0.00 0.00 58.65 58.25 1h3g h GLN 263 Cb 1.21 -0.18 -0.07 0.00 0.30 0.00 0.00 27.48 28.74 1h3g h GLN 263 CO 0.64 0.52 0.54 0.00 -0.67 0.00 0.00 178.83 179.86 1h3g h ALA 264 N 1.63 1.27 -0.24 3.87 0.00 -1.98 0.15 119.26 123.95 1h3g h ALA 264 Ca 0.57 0.01 -0.15 0.00 0.00 0.00 0.00 54.91 55.34 1h3g h ALA 264 Cb 0.83 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1h3g h ALA 264 CO -0.36 0.21 -0.43 -0.44 0.00 0.00 0.00 179.25 178.23 1h3g h ASP 265 N 0.92 0.79 0.08 0.00 3.32 -1.67 0.29 116.42 120.16 1h3g h ASP 265 Ca 0.42 -0.53 -0.00 0.00 0.02 0.00 0.00 57.03 56.93 1h3g h ASP 265 Cb 0.32 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.64 1h3g h ASP 265 CO -0.22 1.17 -0.04 -1.28 -1.72 0.00 0.00 179.24 177.15 1h3g h SER 266 N 0.43 -0.10 -0.96 6.45 0.87 -1.17 0.14 113.55 119.22 1h3g h SER 266 Ca 0.01 -0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.52 1h3g h SER 266 Cb 1.03 0.02 -0.05 0.00 -0.44 0.00 0.00 62.40 62.97 1h3g h SER 266 CO 0.10 -0.01 0.61 -0.33 -0.53 0.00 0.00 176.83 176.67 1h3g h GLU 267 N -0.18 1.29 -0.53 2.24 5.08 -0.95 -1.02 114.58 120.50 1h3g h GLU 267 Ca -0.01 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.25 1h3g h GLU 267 Cb 0.15 -0.28 -0.03 0.00 0.50 0.00 0.00 28.75 29.09 1h3g h GLU 267 CO 0.02 0.88 0.31 -0.97 -1.00 0.00 0.00 179.01 178.25 1h3g h ASN 268 N 1.31 0.63 -0.29 1.42 -0.73 -0.50 0.95 115.58 118.37 1h3g h ASN 268 Ca 0.35 -0.03 -0.05 0.00 1.87 0.00 0.00 56.30 58.44 1h3g h ASN 268 Cb -0.10 -0.16 -0.01 0.00 0.27 0.00 0.00 38.32 38.32 1h3g h ASN 268 CO -0.07 0.49 -0.01 0.15 -0.37 0.00 0.00 177.43 177.62 1h3g h PHE 269 N 0.73 0.56 0.00 0.67 3.57 0.34 -0.02 116.94 122.79 1h3g h PHE 269 Ca 0.19 -0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.59 1h3g h PHE 269 Cb -0.02 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 38.58 1h3g h PHE 269 CO 0.00 0.67 -0.86 0.25 -2.23 0.00 0.00 178.31 176.14 1h3g n THR 270 N -4.57 0.16 0.03 4.41 -2.24 -0.89 -4.36 114.28 106.81 1h3g n THR 270 Ca -0.03 -0.19 0.03 0.00 -2.27 0.00 0.00 64.05 61.59 1h3g n THR 270 Cb 0.26 0.21 -0.05 0.00 -2.10 0.00 0.00 70.33 68.66 1h3g n THR 270 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1h3g n LYS 271 N -1.87 0.75 -1.88 -0.78 5.02 0.31 -4.57 118.16 115.14 1h3g n LYS 271 Ca 0.03 -0.05 -0.35 0.00 -2.02 0.00 0.00 58.31 55.92 1h3g n LYS 271 Cb 0.41 -1.10 0.04 0.00 -0.02 0.00 0.00 35.03 34.36 1h3g n LYS 271 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1h3g s GLY 272 N -2.57 2.47 0.21 0.72 0.00 -0.02 -4.76 107.32 103.35 1h3g s GLY 272 Ca -0.02 0.81 -0.05 0.00 0.00 0.00 0.00 44.72 45.46 1h3g s GLY 272 CO 0.25 1.18 0.46 -0.98 0.00 0.00 0.00 173.10 174.01 1h3g s TRP 273 N -1.93 3.47 -0.05 1.90 0.52 -0.41 -4.33 118.94 118.11 1h3g s TRP 273 Ca 0.73 0.59 -0.26 0.00 0.02 0.00 0.00 56.10 57.18 1h3g s TRP 273 Cb -0.26 -2.05 -0.21 0.00 -1.15 0.00 0.00 33.47 29.80 1h3g s TRP 273 CO 0.37 0.32 1.15 0.74 0.02 0.00 0.00 176.95 179.55 1h3g h PHE 274 N 2.29 0.03 -3.83 -1.98 0.04 -1.91 0.28 116.94 111.86 1h3g h PHE 274 Ca -0.47 -0.01 -0.09 0.00 2.80 0.00 0.00 57.97 60.20 1h3g h PHE 274 Cb 1.18 -0.01 -0.14 0.00 2.20 0.00 0.00 35.95 39.19 1h3g h PHE 274 CO 0.59 0.63 -0.36 0.14 -0.60 0.00 0.00 178.31 178.71 1h3g s VAL 275 N -3.76 0.12 0.48 -0.55 -7.23 -1.26 -4.79 120.40 103.41 1h3g s VAL 275 Ca -0.17 -1.23 0.40 0.00 -1.81 0.00 0.00 61.98 59.17 1h3g s VAL 275 Cb 0.01 -1.47 0.40 0.00 0.56 0.00 0.00 36.38 35.88 1h3g s VAL 275 CO 0.68 -0.56 2.22 1.05 -0.31 0.00 0.00 175.10 178.19 1h3g h GLU 276 N 2.69 0.00 -2.01 4.82 9.09 -1.99 -3.40 114.58 123.78 1h3g h GLU 276 Ca -0.33 0.00 -0.30 0.00 0.05 0.00 0.00 59.36 58.78 1h3g h GLU 276 Cb 1.21 0.00 -0.10 0.00 -1.65 0.00 0.00 28.75 28.20 1h3g h GLU 276 CO 0.54 0.00 -0.09 0.41 0.05 0.00 0.00 179.01 179.92 1h3g n GLY 277 N -1.13 3.46 3.05 1.06 0.00 -1.26 -4.84 105.19 105.53 1h3g n GLY 277 Ca -0.03 -1.44 -0.13 0.00 0.00 0.00 0.00 46.02 44.43 1h3g n GLY 277 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1h3g s PRO 279 N 0.11 0.20 -0.15 1.61 0.02 -1.14 -1.53 135.00 134.13 1h3g s PRO 279 Ca 0.64 0.29 -0.21 0.00 0.02 0.00 0.00 61.00 61.73 1h3g s PRO 279 Cb 0.34 0.06 -0.03 0.00 0.02 0.00 0.00 34.50 34.89 1h3g s PRO 279 CO -0.07 -0.05 0.64 0.34 -0.33 0.00 0.00 177.00 177.53 1h3g s ASP 280 N 0.29 6.79 0.19 2.53 -1.08 -1.26 -1.29 116.67 122.84 1h3g s ASP 280 Ca -0.02 0.95 -0.30 0.00 -0.52 0.00 0.00 52.55 52.67 1h3g s ASP 280 Cb -0.03 -2.36 -0.08 0.00 -1.46 0.00 0.00 42.92 38.99 1h3g s ASP 280 CO -0.01 -0.19 1.20 -0.76 0.52 0.00 0.00 175.17 175.93 1h3g s LEU 281 N 1.41 4.45 -1.05 -1.34 1.43 0.38 -0.47 118.68 123.49 1h3g s LEU 281 Ca 0.31 2.25 -0.21 0.00 -1.03 0.00 0.00 54.13 55.45 1h3g s LEU 281 Cb -0.16 -3.61 0.07 0.00 0.03 0.00 0.00 46.19 42.52 1h3g s LEU 281 CO 0.13 -0.37 1.42 0.21 0.23 0.00 0.00 176.35 177.97 1h3g s ASN 282 N 0.08 6.60 0.00 2.29 2.47 -0.18 -4.69 114.94 121.51 1h3g s ASN 282 Ca 0.52 -1.78 0.23 0.00 0.42 0.00 0.00 52.86 52.25 1h3g s ASN 282 Cb -0.33 -2.53 1.16 0.00 -1.45 0.00 0.00 41.25 38.10 1h3g s ASN 282 CO 0.37 -1.34 1.73 0.00 -3.72 0.00 0.00 177.10 174.15 1h3g n GLN 283 N 8.20 0.36 0.02 0.43 6.02 -1.26 -1.49 117.38 129.67 1h3g n GLN 283 Ca 0.34 0.07 0.13 0.00 -0.01 0.00 0.00 57.00 57.53 1h3g n GLN 283 Cb 0.50 -1.50 0.49 0.00 1.02 0.00 0.00 30.24 30.75 1h3g n GLN 283 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1h3g n THR 284 N -1.26 0.14 -2.63 5.09 -2.24 -1.26 -4.34 114.28 107.78 1h3g n THR 284 Ca 0.11 -0.07 -0.43 0.00 -2.27 0.00 0.00 64.05 61.39 1h3g n THR 284 Cb 0.17 -0.38 -0.02 0.00 -2.10 0.00 0.00 70.33 68.00 1h3g n THR 284 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1h3g s ASN 285 N -3.37 7.04 0.42 3.42 3.84 -0.55 -4.92 114.94 120.82 1h3g s ASN 285 Ca 0.12 1.33 0.10 0.00 0.21 0.00 0.00 52.86 54.63 1h3g s ASN 285 Cb 0.17 -2.54 0.94 0.00 -0.55 0.00 0.00 41.25 39.27 1h3g s ASN 285 CO 0.58 -0.74 2.02 -0.65 -2.79 0.00 0.00 177.10 175.52 1h3g h PRO 286 N 7.71 0.47 -0.55 0.43 0.11 -1.87 -0.95 132.00 137.36 1h3g h PRO 286 Ca -0.20 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.81 1h3g h PRO 286 Cb 1.06 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.04 1h3g h PRO 286 CO 0.99 0.31 0.06 -0.07 -0.21 0.00 0.00 178.00 179.09 1h3g h LEU 287 N 0.49 0.84 -0.15 2.35 3.38 -1.93 -1.40 115.31 118.88 1h3g h LEU 287 Ca 0.22 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 1h3g h LEU 287 Cb 0.24 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 1h3g h LEU 287 CO -0.06 0.87 -0.12 0.58 0.09 0.00 0.00 178.44 179.80 1h3g h VAL 288 N 0.84 1.34 -0.24 1.22 2.07 -1.48 -2.05 116.25 117.94 1h3g h VAL 288 Ca 0.17 -1.25 0.05 0.00 0.82 0.00 0.00 66.70 66.49 1h3g h VAL 288 Cb 0.41 1.82 -0.05 0.00 -1.52 0.00 0.00 31.29 31.95 1h3g h VAL 288 CO 0.01 0.37 -0.07 0.00 0.02 0.00 0.00 177.57 177.90 1h3g h ALA 289 N 0.63 0.14 -0.70 1.67 0.00 -1.11 -0.97 119.26 118.93 1h3g h ALA 289 Ca 0.03 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1h3g h ALA 289 Cb 0.64 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 1h3g h ALA 289 CO 0.03 -0.48 0.29 -0.91 0.00 0.00 0.00 179.25 178.18 1h3g h ASN 290 N -0.02 0.93 -0.12 0.00 4.21 -1.28 -0.71 115.58 118.60 1h3g h ASN 290 Ca 0.12 -0.12 0.02 0.00 1.21 0.00 0.00 56.30 57.52 1h3g h ASN 290 Cb 0.20 -0.24 -0.02 0.00 -1.12 0.00 0.00 38.32 37.14 1h3g h ASN 290 CO -0.26 0.82 0.02 0.22 -1.29 0.00 0.00 177.43 176.94 1h3g h TYR 291 N 1.00 0.03 -0.39 1.19 5.03 -0.73 -0.84 116.97 122.25 1h3g h TYR 291 Ca 0.24 0.01 -0.09 0.00 2.58 0.00 0.00 58.73 61.47 1h3g h TYR 291 Cb 0.17 0.01 -0.01 0.00 1.55 0.00 0.00 36.73 38.44 1h3g h TYR 291 CO 0.01 0.01 -0.10 -0.07 -1.32 0.00 0.00 178.16 176.69 1h3g h LEU 292 N 0.06 0.77 -0.12 2.82 3.38 -0.82 -1.47 115.31 119.93 1h3g h LEU 292 Ca 0.05 -0.36 -0.00 0.00 0.09 0.00 0.00 57.88 57.66 1h3g h LEU 292 Cb 0.05 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 1h3g h LEU 292 CO -0.08 0.96 0.07 0.40 0.09 0.00 0.00 178.44 179.88 1h3g h ILE 293 N 0.57 1.08 -0.89 1.22 2.04 -1.04 -2.29 117.51 118.21 1h3g h ILE 293 Ca 0.10 -0.23 -0.00 0.00 1.00 0.00 0.00 64.86 65.73 1h3g h ILE 293 Cb 0.62 1.02 -0.04 0.00 -0.74 0.00 0.00 36.82 37.68 1h3g h ILE 293 CO 0.04 0.08 0.55 1.56 0.00 0.00 0.00 178.15 180.37 1h3g h GLN 294 N 0.10 1.19 -0.55 2.37 4.20 -1.02 -2.19 115.11 119.22 1h3g h GLN 294 Ca 0.04 -0.10 -0.04 0.00 0.06 0.00 0.00 58.65 58.61 1h3g h GLN 294 Cb 0.07 -0.26 -0.02 0.00 0.30 0.00 0.00 27.48 27.57 1h3g h GLN 294 CO -0.01 0.82 0.18 -0.97 -0.67 0.00 0.00 178.83 178.19 1h3g h ASN 295 N 1.22 0.79 0.02 1.46 -0.73 -0.98 0.74 115.58 118.11 1h3g h ASN 295 Ca 0.32 -0.20 -0.13 0.00 1.87 0.00 0.00 56.30 58.16 1h3g h ASN 295 Cb -0.07 -0.21 -0.01 0.00 0.27 0.00 0.00 38.32 38.30 1h3g h ASN 295 CO -0.06 0.78 -0.41 0.78 -0.37 0.00 0.00 177.43 178.15 1h3g h ASN 296 N 0.76 0.52 -0.32 1.15 4.21 -1.18 -1.33 115.58 119.39 1h3g h ASN 296 Ca 0.18 -0.23 -0.06 0.00 1.21 0.00 0.00 56.30 57.40 1h3g h ASN 296 Cb 0.27 -0.15 -0.01 0.00 -1.12 0.00 0.00 38.32 37.31 1h3g h ASN 296 CO -0.01 0.87 -0.04 0.40 -1.29 0.00 0.00 177.43 177.36 1h3g h ILE 297 N 0.40 1.27 -0.36 2.81 2.04 -1.13 -2.17 117.51 120.37 1h3g h ILE 297 Ca 0.03 -1.06 0.07 0.00 1.00 0.00 0.00 64.86 64.91 1h3g h ILE 297 Cb 0.89 1.31 -0.06 0.00 -0.74 0.00 0.00 36.82 38.22 1h3g h ILE 297 CO 0.08 0.34 -0.04 -0.25 0.00 0.00 0.00 178.15 178.28 1h3g h TRP 298 N 0.38 -0.10 -0.57 1.37 7.01 -0.55 -0.50 115.95 123.00 1h3g h TRP 298 Ca 0.09 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.11 1h3g h TRP 298 Cb 0.52 0.10 -0.03 0.00 -2.10 0.00 0.00 29.16 27.65 1h3g h TRP 298 CO 0.04 -0.11 0.35 -1.49 -2.79 0.00 0.00 178.44 174.45 1h3g h TRP 299 N 0.05 0.74 0.05 2.65 4.06 -1.08 0.28 115.95 122.70 1h3g h TRP 299 Ca 0.18 0.00 0.01 0.00 2.06 0.00 0.00 58.89 61.14 1h3g h TRP 299 Cb 0.26 -0.24 -0.01 0.00 -1.00 0.00 0.00 29.16 28.16 1h3g h TRP 299 CO -0.29 0.50 -0.09 0.82 -3.56 0.00 0.00 178.44 175.82 1h3g h ILE 300 N 0.76 0.79 -0.29 1.49 2.04 -0.69 0.68 117.51 122.29 1h3g h ILE 300 Ca 0.20 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 66.01 1h3g h ILE 300 Cb -0.03 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 1h3g h ILE 300 CO -0.04 0.00 -0.04 -0.08 0.00 0.00 0.00 178.15 177.99 1h3g h GLU 301 N -0.17 0.54 -0.22 2.37 4.57 -0.96 -0.00 114.58 120.70 1h3g h GLU 301 Ca 0.02 -0.19 -0.03 0.00 -1.18 0.00 0.00 59.36 57.98 1h3g h GLU 301 Cb 0.19 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.73 1h3g h GLU 301 CO -0.05 0.72 0.04 -0.92 -1.18 0.00 0.00 179.01 177.61 1h3g h TYR 302 N 0.31 0.38 -0.34 0.92 3.20 -0.33 -3.23 116.97 117.88 1h3g h TYR 302 Ca 0.08 -0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.89 1h3g h TYR 302 Cb 0.50 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.67 1h3g h TYR 302 CO 0.04 0.49 0.00 0.00 -1.64 0.00 0.00 178.16 177.06 1h3g n ALA 303 N -2.30 2.44 -3.53 1.82 0.00 0.22 -4.92 120.51 114.24 1h3g n ALA 303 Ca -0.04 -0.91 -0.21 0.00 0.00 0.00 0.00 53.44 52.29 1h3g n ALA 303 Cb 0.19 -0.91 0.08 0.00 0.00 0.00 0.00 19.45 18.82 1h3g n ALA 303 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h3g n GLY 304 N 1.45 -0.44 3.80 0.00 0.00 -0.07 -4.72 105.19 105.20 1h3g n GLY 304 Ca 0.19 0.17 -0.33 0.00 0.00 0.00 0.00 46.02 46.05 1h3g n GLY 304 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h3g s LEU 305 N -6.82 3.54 0.00 0.99 1.43 -0.85 -4.72 118.68 112.26 1h3g s LEU 305 Ca 0.28 1.87 0.21 0.00 -1.03 0.00 0.00 54.13 55.45 1h3g s LEU 305 Cb -0.12 -4.54 0.21 0.00 0.03 0.00 0.00 46.19 41.76 1h3g s LEU 305 CO 0.74 -1.17 1.19 -1.54 0.23 0.00 0.00 176.35 175.80 1h3g n SER 306 N -1.90 2.84 0.00 2.29 3.41 -0.11 -4.93 113.62 115.21 1h3g n SER 306 Ca 0.09 -1.88 0.00 0.00 -0.26 0.00 0.00 58.87 56.82 1h3g n SER 306 Cb 0.53 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.43 1h3g n SER 306 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1h3g n GLY 307 N 1.19 0.66 3.21 5.00 0.00 -1.24 -2.57 105.19 111.45 1h3g n GLY 307 Ca 0.13 -1.10 -0.20 0.00 0.00 0.00 0.00 46.02 44.84 1h3g n GLY 307 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h3g s LEU 308 N 0.00 2.29 -0.17 0.99 1.43 -1.09 -1.59 118.68 120.54 1h3g s LEU 308 Ca 0.00 -0.64 0.00 0.00 -1.03 0.00 0.00 54.13 52.46 1h3g s LEU 308 Cb 0.00 -0.65 0.01 0.00 0.03 0.00 0.00 46.19 45.58 1h3g s LEU 308 CO 0.00 -0.03 -0.17 -0.60 0.23 0.00 0.00 176.35 175.78 1h3g s ARG 309 N -1.80 3.08 -0.37 1.70 3.00 -0.19 -0.69 118.95 123.68 1h3g s ARG 309 Ca 0.01 -0.79 -0.12 0.00 -1.00 0.00 0.00 55.73 53.83 1h3g s ARG 309 Cb -0.10 -2.61 0.02 0.00 0.00 0.00 0.00 34.95 32.25 1h3g s ARG 309 CO 0.03 -0.14 0.22 0.42 0.00 0.00 0.00 175.30 175.83 1h3g s ILE 310 N 1.16 4.82 0.70 4.11 1.01 0.69 -0.15 121.20 133.53 1h3g s ILE 310 Ca 0.01 -0.67 -0.15 0.00 0.00 0.00 0.00 60.65 59.85 1h3g s ILE 310 Cb -0.14 -3.63 0.02 0.00 0.01 0.00 0.00 42.46 38.73 1h3g s ILE 310 CO -0.08 -0.18 1.14 -0.62 0.00 0.00 0.00 174.94 175.21 1h3g s ASP 311 N 1.61 4.67 -0.84 3.58 2.15 -0.17 -0.80 116.67 126.87 1h3g s ASP 311 Ca 0.04 2.12 -0.18 0.00 0.43 0.00 0.00 52.55 54.96 1h3g s ASP 311 Cb -0.19 -2.56 0.02 0.00 -0.30 0.00 0.00 42.92 39.90 1h3g s ASP 311 CO 0.08 -1.93 0.33 0.35 -0.17 0.00 0.00 175.17 173.83 1h3g n THR 312 N -2.66 -1.42 -0.09 1.71 -2.24 -1.24 -4.66 114.28 103.68 1h3g n THR 312 Ca 0.11 -0.37 -0.13 0.00 -2.27 0.00 0.00 64.05 61.40 1h3g n THR 312 Cb 0.51 -1.23 -0.09 0.00 -2.10 0.00 0.00 70.33 67.42 1h3g n THR 312 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 1h3g h TYR 313 N -0.66 -1.53 0.00 4.78 3.20 -1.08 -2.13 116.97 119.55 1h3g h TYR 313 Ca -0.45 0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.49 1h3g h TYR 313 Cb 0.91 0.71 0.00 0.00 1.54 0.00 0.00 36.73 39.88 1h3g h TYR 313 CO 0.26 -0.46 0.00 0.41 -1.64 0.00 0.00 178.16 176.73 1h3g n GLY 314 N -1.36 -0.83 0.00 1.82 0.00 -1.26 -2.59 105.19 100.98 1h3g n GLY 314 Ca -0.04 -0.08 0.15 0.00 0.00 0.00 0.00 46.02 46.05 1h3g n GLY 314 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1h3g n TYR 315 N -1.29 0.00 -3.23 1.61 4.01 -0.80 -4.72 117.16 112.74 1h3g n TYR 315 Ca 0.08 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.53 1h3g n TYR 315 Cb 0.13 -0.25 -0.03 0.00 -0.31 0.00 0.00 39.34 38.88 1h3g n TYR 315 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1h3g s SER 316 N -2.51 6.43 0.26 7.72 0.01 -1.07 -4.35 113.70 120.19 1h3g s SER 316 Ca 0.30 0.75 -0.31 0.00 1.31 0.00 0.00 55.95 58.01 1h3g s SER 316 Cb 0.20 -2.16 -0.13 0.00 0.21 0.00 0.00 66.02 64.14 1h3g s SER 316 CO 0.44 -0.26 1.48 -0.67 0.41 0.00 0.00 173.24 174.64 1h3g n ASP 317 N -1.17 3.17 -0.22 2.44 -0.08 -1.26 -4.85 116.55 114.59 1h3g n ASP 317 Ca -0.01 1.14 -0.04 0.00 -1.51 0.00 0.00 54.79 54.37 1h3g n ASP 317 Cb 0.54 -1.49 0.06 0.00 2.34 0.00 0.00 41.12 42.57 1h3g n ASP 317 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 1h3g h GLY 318 N 4.43 0.89 1.11 0.27 0.00 -1.95 -0.55 103.07 107.27 1h3g h GLY 318 Ca -0.46 -0.29 -0.10 0.00 0.00 0.00 0.00 47.33 46.48 1h3g h GLY 318 CO 0.77 0.25 -0.02 0.00 0.00 0.00 0.00 176.54 177.55 1h3g h ALA 319 N 1.27 0.84 -0.36 3.60 0.00 -1.98 -1.65 119.26 120.98 1h3g h ALA 319 Ca 0.25 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1h3g h ALA 319 Cb 0.01 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1h3g h ALA 319 CO -0.10 0.67 0.22 0.35 0.00 0.00 0.00 179.25 180.40 1h3g h PHE 320 N 0.96 0.42 -0.91 0.00 3.57 -1.74 -1.82 116.94 117.42 1h3g h PHE 320 Ca 0.17 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.70 1h3g h PHE 320 Cb 0.57 -0.14 -0.05 0.00 2.79 0.00 0.00 35.95 39.13 1h3g h PHE 320 CO 0.04 0.26 0.60 -0.07 -2.23 0.00 0.00 178.31 176.91 1h3g h LEU 321 N 0.45 1.01 0.03 0.59 3.38 -0.71 0.37 115.31 120.43 1h3g h LEU 321 Ca 0.14 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.09 1h3g h LEU 321 Cb -0.02 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 1h3g h LEU 321 CO -0.05 0.71 -0.05 0.74 0.09 0.00 0.00 178.44 179.88 1h3g h THR 322 N 1.19 0.87 -0.48 0.22 2.02 -0.86 -0.52 112.91 115.34 1h3g h THR 322 Ca 0.35 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.45 1h3g h THR 322 Cb -0.05 0.87 -0.02 0.00 -1.74 0.00 0.00 68.15 67.21 1h3g h THR 322 CO -0.09 0.00 -0.03 -0.08 0.37 0.00 0.00 175.52 175.68 1h3g h GLU 323 N -0.10 0.87 0.18 6.66 4.57 -0.73 -1.58 114.58 124.45 1h3g h GLU 323 Ca 0.01 -0.29 -0.01 0.00 -1.18 0.00 0.00 59.36 57.89 1h3g h GLU 323 Cb 0.12 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.64 1h3g h GLU 323 CO -0.03 0.93 -0.09 -0.92 -1.18 0.00 0.00 179.01 177.72 1h3g h TYR 324 N 0.72 -0.23 -0.71 0.92 5.03 -0.15 0.77 116.97 123.33 1h3g h TYR 324 Ca 0.13 -0.01 -0.05 0.00 2.58 0.00 0.00 58.73 61.39 1h3g h TYR 324 Cb 0.56 0.08 -0.03 0.00 1.55 0.00 0.00 36.73 38.88 1h3g h TYR 324 CO 0.04 -0.12 0.24 1.79 -1.32 0.00 0.00 178.16 178.79 1h3g h THR 325 N -0.27 1.25 -0.18 1.81 1.35 -1.10 -1.28 112.91 114.49 1h3g h THR 325 Ca -0.03 -0.85 0.02 0.00 -0.55 0.00 0.00 66.41 65.01 1h3g h THR 325 Cb 0.21 0.45 -0.02 0.00 -1.73 0.00 0.00 68.15 67.06 1h3g h THR 325 CO 0.04 0.33 0.05 -0.09 -0.25 0.00 0.00 175.52 175.61 1h3g h ARG 326 N 1.04 0.13 -0.49 4.72 2.43 -0.99 -2.99 114.38 118.23 1h3g h ARG 326 Ca 0.23 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.41 1h3g h ARG 326 Cb 0.27 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.76 1h3g h ARG 326 CO -0.01 0.09 0.32 0.00 -1.51 0.00 0.00 179.97 178.85 1h3g h ARG 327 N 0.14 0.62 -0.93 0.20 2.47 -0.49 -0.96 114.38 115.43 1h3g h ARG 327 Ca 0.08 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.76 1h3g h ARG 327 Cb 0.06 -0.14 0.00 0.00 -1.65 0.00 0.00 29.97 28.23 1h3g h ARG 327 CO -0.09 0.41 0.00 1.28 0.56 0.00 0.00 179.97 182.13 1h3g n LEU 328 N -4.77 0.64 0.00 3.04 4.32 -0.52 -2.27 117.00 117.45 1h3g n LEU 328 Ca 0.03 -0.32 0.00 0.00 -0.02 0.00 0.00 56.01 55.70 1h3g n LEU 328 Cb 0.04 -0.17 0.00 0.00 -1.62 0.00 0.00 43.42 41.67 1h3g n LEU 328 CO 0.34 0.12 0.00 0.00 -1.22 0.00 0.00 177.39 176.63 1h3g n ALA 330 N 0.56 0.00 0.09 -1.18 0.00 -0.37 -1.20 120.51 118.41 1h3g n ALA 330 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.23 1h3g n ALA 330 Cb 0.12 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.45 1h3g n ALA 330 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1h3g h GLU 331 N 0.00 0.57 -2.59 0.00 4.39 -1.72 -3.41 114.58 111.82 1h3g h GLU 331 Ca 0.00 -0.76 -0.60 0.00 0.34 0.00 0.00 59.36 58.34 1h3g h GLU 331 Cb 0.00 0.25 -0.40 0.00 -0.10 0.00 0.00 28.75 28.50 1h3g h GLU 331 CO 0.00 1.34 -0.81 0.66 -1.16 0.00 0.00 179.01 179.04 1h3g n TYR 332 N -3.76 0.95 0.26 4.33 4.01 -0.34 -4.62 117.16 117.98 1h3g n TYR 332 Ca -0.13 -3.75 0.16 0.00 -0.16 0.00 0.00 57.90 54.02 1h3g n TYR 332 Cb 0.98 -0.16 0.80 0.00 -0.31 0.00 0.00 39.34 40.64 1h3g n TYR 332 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1h3g h PRO 333 N 5.32 0.00 -0.42 -0.72 0.13 -1.80 0.01 132.00 134.52 1h3g h PRO 333 Ca 0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.34 1h3g h PRO 333 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 1h3g h PRO 333 CO 0.54 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 178.85 1h3g n ARG 334 N -2.59 2.96 -1.48 0.86 1.74 -1.26 -4.99 116.66 111.90 1h3g n ARG 334 Ca -0.01 -2.35 -0.32 0.00 -0.77 0.00 0.00 57.85 54.40 1h3g n ARG 334 Cb 0.09 -1.47 0.07 0.00 -1.02 0.00 0.00 32.46 30.13 1h3g n ARG 334 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1h3g s LEU 335 N -1.37 3.16 0.00 0.55 2.96 -0.01 -0.34 118.68 123.63 1h3g s LEU 335 Ca 0.33 1.82 0.01 0.00 -0.22 0.00 0.00 54.13 56.07 1h3g s LEU 335 Cb 0.20 -4.52 -0.00 0.00 0.50 0.00 0.00 46.19 42.36 1h3g s LEU 335 CO 0.18 -1.77 0.03 -3.20 -1.32 0.00 0.00 176.35 170.28 1h3g n ASN 336 N -3.10 2.78 -3.59 3.68 2.85 -1.26 -4.73 115.26 111.89 1h3g n ASN 336 Ca 0.09 -3.05 -0.02 0.00 -0.11 0.00 0.00 54.58 51.48 1h3g n ASN 336 Cb 0.53 0.49 -0.05 0.00 1.24 0.00 0.00 39.78 41.98 1h3g n ASN 336 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 1h3g s VAL 338 N -2.77 -0.48 0.06 3.44 0.11 0.13 -2.66 120.40 118.23 1h3g s VAL 338 Ca 0.05 0.00 -0.14 0.00 -2.93 0.00 0.00 61.98 58.95 1h3g s VAL 338 Cb 0.00 -1.00 -0.06 0.00 -1.53 0.00 0.00 36.38 33.79 1h3g s VAL 338 CO 0.03 0.00 0.47 -0.83 -3.33 0.00 0.00 175.10 171.44 1h3g s GLY 339 N 2.23 2.48 -0.64 6.54 0.00 0.70 -0.23 107.32 118.41 1h3g s GLY 339 Ca -0.07 -0.19 -0.18 0.00 0.00 0.00 0.00 44.72 44.28 1h3g s GLY 339 CO -0.18 0.14 0.74 1.85 0.00 0.00 0.00 173.10 175.65 1h3g s GLU 340 N -1.45 3.13 -0.44 2.90 2.12 0.02 -4.32 118.70 120.66 1h3g s GLU 340 Ca 0.30 -1.45 -0.07 0.00 0.36 0.00 0.00 54.97 54.11 1h3g s GLU 340 Cb -0.16 -4.33 0.11 0.00 0.26 0.00 0.00 34.13 30.00 1h3g s GLU 340 CO 0.17 -1.54 0.27 -2.00 -0.54 0.00 0.00 175.26 171.62 1h3g s GLU 341 N 2.48 2.36 -1.04 4.30 2.56 -1.26 -0.78 118.70 127.32 1h3g s GLU 341 Ca 0.14 -1.70 -0.23 0.00 0.00 0.00 0.00 54.97 53.17 1h3g s GLU 341 Cb -0.22 -3.77 0.02 0.00 2.00 0.00 0.00 34.13 32.16 1h3g s GLU 341 CO 0.04 -1.09 1.66 -0.46 -0.56 0.00 0.00 175.26 174.85 1h3g s TRP 342 N 1.30 2.33 -0.13 5.30 -0.11 -1.26 -4.83 118.94 121.54 1h3g s TRP 342 Ca 0.06 -0.46 -0.14 0.00 1.22 0.00 0.00 56.10 56.78 1h3g s TRP 342 Cb -0.24 -4.48 0.04 0.00 -1.50 0.00 0.00 33.47 27.28 1h3g s TRP 342 CO -0.01 -1.81 0.39 0.45 -4.62 0.00 0.00 176.95 171.34 1h3g s SER 343 N 5.81 -0.38 -0.03 5.86 0.15 -1.26 -5.01 113.70 118.83 1h3g s SER 343 Ca 0.55 0.70 0.14 0.00 0.70 0.00 0.00 55.95 58.04 1h3g s SER 343 Cb -0.01 0.73 0.45 0.00 -1.71 0.00 0.00 66.02 65.48 1h3g s SER 343 CO -0.03 -0.18 1.35 0.35 1.20 0.00 0.00 173.24 175.93 1h3g n THR 344 N 2.64 0.87 -3.64 6.45 -2.24 -1.26 -3.79 114.28 113.30 1h3g n THR 344 Ca -0.14 -0.70 -0.38 0.00 -2.27 0.00 0.00 64.05 60.55 1h3g n THR 344 Cb 0.57 0.20 -0.11 0.00 -2.10 0.00 0.00 70.33 68.89 1h3g n THR 344 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1h3g s ARG 345 N -1.49 3.68 0.20 -0.78 0.52 -1.26 -4.38 118.95 115.44 1h3g s ARG 345 Ca 0.33 -0.49 -0.11 0.00 -0.52 0.00 0.00 55.73 54.95 1h3g s ARG 345 Cb 0.19 -3.58 0.23 0.00 0.52 0.00 0.00 34.95 32.32 1h3g s ARG 345 CO 0.20 -0.27 1.74 0.28 0.02 0.00 0.00 175.30 177.28 1h3g h VAL 346 N 5.49 0.79 -0.33 3.52 2.07 -1.98 -1.78 116.25 124.03 1h3g h VAL 346 Ca -0.35 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.02 1h3g h VAL 346 Cb 1.17 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 1h3g h VAL 346 CO 0.58 0.07 0.11 -0.65 0.02 0.00 0.00 177.57 177.70 1h3g h PRO 347 N 0.38 0.46 -0.40 1.57 0.11 -1.95 0.15 132.00 132.32 1h3g h PRO 347 Ca 0.28 -0.06 -0.15 0.00 0.11 0.00 0.00 66.00 66.18 1h3g h PRO 347 Cb 0.33 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.35 1h3g h PRO 347 CO -0.29 0.40 -0.32 0.28 -0.21 0.00 0.00 178.00 177.86 1h3g h VAL 348 N 0.46 1.27 -0.06 3.15 2.07 -1.75 -2.81 116.25 118.58 1h3g h VAL 348 Ca 0.11 -1.49 -0.16 0.00 0.82 0.00 0.00 66.70 65.98 1h3g h VAL 348 Cb 0.13 1.34 0.01 0.00 -1.52 0.00 0.00 31.29 31.25 1h3g h VAL 348 CO -0.01 0.50 -0.59 0.58 0.02 0.00 0.00 177.57 178.07 1h3g h VAL 349 N 0.74 1.38 -0.04 2.57 2.07 -0.98 -3.31 116.25 118.68 1h3g h VAL 349 Ca 0.07 -1.95 0.01 0.00 0.82 0.00 0.00 66.70 65.65 1h3g h VAL 349 Cb 0.91 2.34 -0.00 0.00 -1.52 0.00 0.00 31.29 33.03 1h3g h VAL 349 CO 0.08 0.58 0.03 0.00 0.02 0.00 0.00 177.57 178.29 1h3g h ALA 350 N 0.42 1.98 -1.02 1.67 0.00 -0.68 -2.54 119.26 119.08 1h3g h ALA 350 Ca -0.06 -0.00 0.26 0.00 0.00 0.00 0.00 54.91 55.11 1h3g h ALA 350 Cb 1.26 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.96 1h3g h ALA 350 CO 0.12 -0.05 0.66 -0.09 0.00 0.00 0.00 179.25 179.89 1h3g h ARG 351 N 0.00 0.37 -0.00 0.00 1.12 -1.59 -2.18 114.38 112.10 1h3g h ARG 351 Ca 0.02 -0.02 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 1h3g h ARG 351 Cb 0.08 -0.08 0.00 0.00 -0.01 0.00 0.00 29.97 29.96 1h3g h ARG 351 CO -0.00 0.25 -0.30 0.91 -3.11 0.00 0.00 179.97 177.71 1h3g n TRP 352 N -4.59 0.00 -2.73 2.20 7.02 -0.96 -4.84 117.44 113.55 1h3g n TRP 352 Ca 0.24 0.00 -0.39 0.00 -1.02 0.00 0.00 57.50 56.33 1h3g n TRP 352 Cb 0.86 -0.35 -0.06 0.00 -2.42 0.00 0.00 31.31 29.34 1h3g n TRP 352 CO 0.00 0.00 0.00 -1.14 -2.02 0.00 0.00 177.69 174.53 1h3g s GLN 353 N -3.00 4.76 0.39 -0.99 0.74 -0.82 -4.31 119.66 116.43 1h3g s GLN 353 Ca 0.12 1.48 -0.27 0.00 0.05 0.00 0.00 55.36 56.74 1h3g s GLN 353 Cb 0.18 -3.15 -0.11 0.00 1.10 0.00 0.00 33.01 31.03 1h3g s GLN 353 CO 0.63 0.42 1.39 2.89 -0.55 0.00 0.00 175.29 180.07 1h3g n ARG 354 N 1.22 2.33 -0.46 1.67 1.85 0.14 -1.87 116.66 121.55 1h3g n ARG 354 Ca -0.01 0.82 0.00 0.00 -1.00 0.00 0.00 57.85 57.66 1h3g n ARG 354 Cb 0.48 -2.52 0.00 0.00 -1.05 0.00 0.00 32.46 29.37 1h3g n ARG 354 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1h3g n GLY 355 N 0.62 0.96 3.66 2.89 0.00 -1.25 -4.71 105.19 107.36 1h3g n GLY 355 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 1h3g n GLY 355 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1h3g s LYS 356 N -0.43 4.24 -0.52 1.61 2.47 -0.78 -4.85 119.74 121.47 1h3g s LYS 356 Ca 0.00 1.75 -0.28 0.00 -1.56 0.00 0.00 55.97 55.88 1h3g s LYS 356 Cb 0.00 -3.77 0.02 0.00 -1.46 0.00 0.00 37.83 32.62 1h3g s LYS 356 CO 0.00 -0.70 1.33 0.00 0.16 0.00 0.00 175.35 176.14 1h3g s ALA 357 N 3.41 2.94 0.02 3.13 0.00 -1.26 -4.84 121.76 125.16 1h3g s ALA 357 Ca 0.58 -0.57 -0.01 0.00 0.00 0.00 0.00 51.96 51.96 1h3g s ALA 357 Cb -0.24 -4.03 -0.04 0.00 0.00 0.00 0.00 23.12 18.81 1h3g s ALA 357 CO 0.18 -2.67 0.18 -0.80 0.00 0.00 0.00 175.76 172.64 1h3g s ASN 358 N 3.75 6.25 0.48 0.00 0.02 -1.26 -5.00 114.94 119.19 1h3g s ASN 358 Ca 0.52 0.28 0.23 0.00 -1.02 0.00 0.00 52.86 52.86 1h3g s ASN 358 Cb -0.10 -1.92 1.24 0.00 0.02 0.00 0.00 41.25 40.49 1h3g s ASN 358 CO 0.28 0.23 2.02 2.19 0.02 0.00 0.00 177.10 181.83 1h3g h PHE 359 N 3.56 0.00 -0.41 2.20 -0.00 -1.94 -1.17 116.94 119.17 1h3g h PHE 359 Ca -0.47 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.50 1h3g h PHE 359 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.13 1h3g h PHE 359 CO 0.64 0.17 0.00 -0.40 -0.00 0.00 0.00 178.31 178.72 1h3g n ASP 360 N -3.84 3.44 0.00 -0.68 5.75 -1.26 -4.95 116.55 115.02 1h3g n ASP 360 Ca -0.02 -1.97 0.00 0.00 -0.01 0.00 0.00 54.79 52.79 1h3g n ASP 360 Cb 0.27 -0.27 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1h3g n ASP 360 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1h3g n GLY 361 N 1.43 0.68 3.74 6.12 0.00 -0.44 -5.00 105.19 111.72 1h3g n GLY 361 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 1h3g n GLY 361 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1h3g s TYR 362 N -2.50 2.91 0.21 1.61 5.04 -1.26 -4.90 117.35 118.45 1h3g s TYR 362 Ca 0.00 0.86 0.08 0.00 -2.44 0.00 0.00 57.07 55.58 1h3g s TYR 362 Cb 0.00 -3.94 -0.05 0.00 0.35 0.00 0.00 41.96 38.32 1h3g s TYR 362 CO 0.00 -3.18 -0.16 0.95 -1.34 0.00 0.00 175.55 171.82 1h3g s THR 363 N 0.15 1.84 0.12 4.34 -4.23 -1.26 -4.32 115.64 112.28 1h3g s THR 363 Ca 0.63 -2.19 -0.23 0.00 -1.18 0.00 0.00 61.69 58.71 1h3g s THR 363 Cb -0.45 -2.04 0.07 0.00 1.34 0.00 0.00 72.50 71.41 1h3g s THR 363 CO 0.44 -0.53 0.58 -0.55 -0.54 0.00 0.00 174.62 174.02 1h3g s SER 364 N -3.24 -0.54 -0.06 3.99 0.15 -1.26 -4.60 113.70 108.13 1h3g s SER 364 Ca 0.22 0.07 0.10 0.00 0.70 0.00 0.00 55.95 57.04 1h3g s SER 364 Cb -0.02 0.57 0.25 0.00 -1.71 0.00 0.00 66.02 65.11 1h3g s SER 364 CO 0.08 -0.90 1.18 1.41 1.20 0.00 0.00 173.24 176.21 1h3g n HIS 365 N -0.15 0.31 -2.10 3.44 8.25 -1.26 -3.87 115.22 119.83 1h3g n HIS 365 Ca -0.17 -0.68 -0.43 0.00 -0.26 0.00 0.00 57.72 56.18 1h3g n HIS 365 Cb 0.64 -0.12 -0.03 0.00 1.12 0.00 0.00 29.99 31.60 1h3g n HIS 365 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1h3g s LEU 366 N -1.76 3.82 0.37 2.41 2.96 -1.26 -4.70 118.68 120.52 1h3g s LEU 366 Ca 0.21 1.55 0.20 0.00 -0.22 0.00 0.00 54.13 55.87 1h3g s LEU 366 Cb 0.16 -3.53 0.43 0.00 0.50 0.00 0.00 46.19 43.75 1h3g s LEU 366 CO 0.07 -1.34 1.61 1.55 -1.32 0.00 0.00 176.35 176.92 1h3g h PRO 367 N 11.08 0.00 -3.64 0.98 0.13 -1.93 0.41 132.00 139.02 1h3g h PRO 367 Ca -0.34 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.68 1h3g h PRO 367 Cb 1.15 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.11 1h3g h PRO 367 CO 1.01 0.31 -0.43 0.45 -0.23 0.00 0.00 178.00 179.10 1h3g s SER 368 N -6.31 0.08 0.00 1.44 0.15 -1.26 -4.77 113.70 103.03 1h3g s SER 368 Ca 0.03 -0.43 0.00 0.00 0.70 0.00 0.00 55.95 56.26 1h3g s SER 368 Cb 0.08 0.27 0.00 0.00 -1.71 0.00 0.00 66.02 64.66 1h3g s SER 368 CO 0.69 -0.55 0.00 0.18 1.20 0.00 0.00 173.24 174.76 1h3g n LEU 369 N 0.69 0.00 -3.17 3.45 4.32 -1.26 -0.22 117.00 120.81 1h3g n LEU 369 Ca -0.19 0.00 -0.21 0.00 -0.02 0.00 0.00 56.01 55.60 1h3g n LEU 369 Cb 0.59 0.00 -0.05 0.00 -1.62 0.00 0.00 43.42 42.34 1h3g n LEU 369 CO 0.22 0.00 -0.25 -0.67 -1.22 0.00 0.00 177.39 175.48 1h3g n ASP 371 N 0.00 0.38 -0.27 -1.43 -0.08 0.46 -1.78 116.55 113.83 1h3g n ASP 371 Ca 0.00 -2.87 0.00 0.00 -1.51 0.00 0.00 54.79 50.41 1h3g n ASP 371 Cb 0.00 -0.54 0.13 0.00 2.34 0.00 0.00 41.12 43.05 1h3g n ASP 371 CO 0.00 0.00 0.00 -0.26 0.12 0.00 0.00 177.20 177.06 1h3g h PHE 372 N 3.51 0.81 -0.45 -0.67 0.04 -1.86 -1.76 116.94 116.55 1h3g h PHE 372 Ca 0.08 0.03 0.07 0.00 2.80 0.00 0.00 57.97 60.95 1h3g h PHE 372 Cb 0.93 -0.25 -0.06 0.00 2.20 0.00 0.00 35.95 38.77 1h3g h PHE 372 CO 0.41 0.38 0.09 -1.35 -0.60 0.00 0.00 178.31 177.23 1h3g h PRO 373 N 0.79 0.22 -0.40 1.51 0.11 -1.76 0.17 132.00 132.64 1h3g h PRO 373 Ca 0.35 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 66.31 1h3g h PRO 373 Cb 0.23 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.28 1h3g h PRO 373 CO -0.20 0.14 -0.28 1.25 -0.21 0.00 0.00 178.00 178.71 1h3g h LEU 374 N 0.22 0.93 -0.55 2.35 5.85 -1.81 -0.59 115.31 121.72 1h3g h LEU 374 Ca 0.22 -0.43 -0.07 0.00 0.84 0.00 0.00 57.88 58.44 1h3g h LEU 374 Cb 0.29 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 1h3g h LEU 374 CO -0.30 1.17 0.06 0.58 -0.34 0.00 0.00 178.44 179.61 1h3g h VAL 375 N 0.70 1.26 -0.63 1.05 2.07 -0.92 -2.60 116.25 117.18 1h3g h VAL 375 Ca 0.08 -1.00 -0.01 0.00 0.82 0.00 0.00 66.70 66.58 1h3g h VAL 375 Cb 0.86 0.84 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 1h3g h VAL 375 CO 0.08 0.36 0.34 -0.78 0.02 0.00 0.00 177.57 177.58 1h3g h ASP 376 N 0.80 0.80 0.00 0.57 1.82 -0.53 -0.36 116.42 119.52 1h3g h ASP 376 Ca 0.16 -0.10 0.00 0.00 -0.39 0.00 0.00 57.03 56.70 1h3g h ASP 376 Cb 0.44 -0.20 0.00 0.00 0.68 0.00 0.00 39.33 40.25 1h3g h ASP 376 CO 0.02 0.67 0.00 0.00 -1.61 0.00 0.00 179.24 178.32 1h3g n ALA 377 N -2.33 1.17 0.00 -0.78 0.00 -0.24 -1.01 120.51 117.32 1h3g n ALA 377 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1h3g n ALA 377 Cb 0.10 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.55 1h3g n ALA 377 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1h3g n ARG 379 N 0.50 0.00 -0.09 0.00 1.74 -0.15 -0.74 116.66 117.93 1h3g n ARG 379 Ca 0.00 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.98 1h3g n ARG 379 Cb 0.02 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.44 1h3g n ARG 379 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 1h3g h ASN 380 N 0.00 0.41 -0.20 0.55 2.35 -1.31 -0.48 115.58 116.91 1h3g h ASN 380 Ca 0.00 -0.17 -0.05 0.00 -0.55 0.00 0.00 56.30 55.53 1h3g h ASN 380 Cb 0.00 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.25 1h3g h ASN 380 CO 0.00 0.47 -0.01 0.00 -1.65 0.00 0.00 177.43 176.24 1h3g h ALA 381 N 0.96 1.42 0.04 -0.83 0.00 -1.14 0.10 119.26 119.80 1h3g h ALA 381 Ca 0.10 -0.19 -0.23 0.00 0.00 0.00 0.00 54.91 54.59 1h3g h ALA 381 Cb 0.19 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1h3g h ALA 381 CO -0.01 0.41 -1.06 -0.07 0.00 0.00 0.00 179.25 178.52 1h3g h LEU 382 N 0.46 0.13 0.02 0.00 3.38 -1.77 -3.37 115.31 114.16 1h3g h LEU 382 Ca 0.10 -0.14 -0.31 0.00 0.09 0.00 0.00 57.88 57.62 1h3g h LEU 382 Cb 0.31 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 40.97 1h3g h LEU 382 CO 0.01 1.10 -1.85 -1.54 0.09 0.00 0.00 178.44 176.24 1h3g n SER 383 N -3.42 0.98 -3.99 -0.43 3.41 -0.21 -4.54 113.62 105.43 1h3g n SER 383 Ca -0.03 0.32 -0.42 0.00 -0.26 0.00 0.00 58.87 58.48 1h3g n SER 383 Cb 0.95 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.84 1h3g n SER 383 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1h3g n LYS 384 N -3.08 3.05 0.12 4.33 5.02 -0.00 -4.70 118.16 122.90 1h3g n LYS 384 Ca -0.22 -2.93 0.05 0.00 -2.02 0.00 0.00 58.31 53.19 1h3g n LYS 384 Cb 1.06 -3.29 0.48 0.00 -0.02 0.00 0.00 35.03 33.26 1h3g n LYS 384 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1h3g h THR 385 N 4.38 1.10 0.00 -0.18 2.02 -1.85 -1.37 112.91 117.01 1h3g h THR 385 Ca 0.51 -0.33 0.00 0.00 0.77 0.00 0.00 66.41 67.36 1h3g h THR 385 Cb 0.71 0.88 0.00 0.00 -1.74 0.00 0.00 68.15 68.00 1h3g h THR 385 CO 1.73 0.12 0.00 0.61 0.37 0.00 0.00 175.52 178.34 1h3g n GLY 386 N -1.30 -0.83 3.85 2.16 0.00 -1.26 -4.68 105.19 103.13 1h3g n GLY 386 Ca -0.00 -0.03 -0.36 0.00 0.00 0.00 0.00 46.02 45.62 1h3g n GLY 386 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1h3g s GLU 387 N -2.99 3.90 0.10 1.61 2.56 -0.52 -5.00 118.70 118.36 1h3g s GLU 387 Ca 0.05 0.38 0.14 0.00 0.00 0.00 0.00 54.97 55.54 1h3g s GLU 387 Cb 0.06 -3.10 -0.12 0.00 2.00 0.00 0.00 34.13 32.98 1h3g s GLU 387 CO 0.18 0.61 1.01 1.49 -0.56 0.00 0.00 175.26 177.98 1h3g h GLU 388 N 4.17 0.00 -0.79 4.30 4.81 -1.85 -3.39 114.58 121.83 1h3g h GLU 388 Ca -0.50 0.00 -0.33 0.00 -0.13 0.00 0.00 59.36 58.40 1h3g h GLU 388 Cb 1.21 0.00 -0.36 0.00 0.63 0.00 0.00 28.75 30.23 1h3g h GLU 388 CO 0.64 0.49 -1.06 -1.71 -0.73 0.00 0.00 179.01 176.64 1h3g n ASN 389 N -3.07 0.93 0.12 1.04 5.15 -1.26 -2.05 115.26 116.12 1h3g n ASN 389 Ca -0.07 -2.60 0.15 0.00 -0.60 0.00 0.00 54.58 51.46 1h3g n ASN 389 Cb 0.87 -0.28 0.67 0.00 -0.53 0.00 0.00 39.78 40.51 1h3g n ASN 389 CO 0.00 0.00 0.00 1.23 1.40 0.00 0.00 177.26 179.89 1h3g h GLY 390 N 2.79 0.00 1.85 8.20 0.00 -1.87 -0.29 103.07 113.75 1h3g h GLY 390 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.19 1h3g h GLY 390 CO 0.38 0.00 0.07 1.41 0.00 0.00 0.00 176.54 178.40 1h3g h LEU 391 N 0.00 0.00 -1.36 3.11 3.38 -1.92 -1.71 115.31 116.81 1h3g h LEU 391 Ca 0.14 0.00 0.13 0.00 0.09 0.00 0.00 57.88 58.23 1h3g h LEU 391 Cb 0.56 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.25 1h3g h LEU 391 CO -0.00 0.00 0.54 -1.13 0.09 0.00 0.00 178.44 177.94 1h3g h ASN 392 N 0.00 0.61 -0.87 -0.43 -1.24 -1.37 -0.61 115.58 111.66 1h3g h ASN 392 Ca 0.00 0.03 0.01 0.00 0.71 0.00 0.00 56.30 57.05 1h3g h ASN 392 Cb 0.14 -0.10 -0.04 0.00 0.73 0.00 0.00 38.32 39.05 1h3g h ASN 392 CO 0.00 0.33 0.58 -0.33 -1.29 0.00 0.00 177.43 176.72 1h3g h GLU 393 N 0.66 1.15 -0.05 6.67 5.08 -1.53 0.22 114.58 126.79 1h3g h GLU 393 Ca 0.40 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.68 1h3g h GLU 393 Cb 0.63 -0.26 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 1h3g h GLU 393 CO -0.17 0.76 -0.02 0.28 -1.00 0.00 0.00 179.01 178.86 1h3g h VAL 394 N 1.19 1.32 -0.21 3.13 2.07 -1.31 -0.41 116.25 122.02 1h3g h VAL 394 Ca 0.32 -1.00 0.06 0.00 0.82 0.00 0.00 66.70 66.89 1h3g h VAL 394 Cb -0.14 1.90 -0.07 0.00 -1.52 0.00 0.00 31.29 31.46 1h3g h VAL 394 CO -0.07 0.27 -0.27 0.22 0.02 0.00 0.00 177.57 177.74 1h3g h TYR 395 N -0.28 -0.74 -0.59 1.57 3.20 -0.96 0.98 116.97 120.15 1h3g h TYR 395 Ca 0.01 0.04 -0.09 0.00 3.14 0.00 0.00 58.73 61.83 1h3g h TYR 395 Cb 0.45 0.36 -0.02 0.00 1.54 0.00 0.00 36.73 39.06 1h3g h TYR 395 CO 0.07 -0.35 0.01 0.93 -1.64 0.00 0.00 178.16 177.17 1h3g h GLU 396 N -0.30 1.03 -0.60 1.82 5.08 -0.50 -0.97 114.58 120.13 1h3g h GLU 396 Ca 0.12 -0.32 -0.01 0.00 -1.00 0.00 0.00 59.36 58.15 1h3g h GLU 396 Cb 0.49 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.62 1h3g h GLU 396 CO -0.38 1.01 0.34 1.15 -1.00 0.00 0.00 179.01 180.13 1h3g h THR 397 N 0.92 1.19 -0.46 1.13 2.02 -0.68 -1.63 112.91 115.40 1h3g h THR 397 Ca 0.17 -0.47 -0.02 0.00 0.77 0.00 0.00 66.41 66.86 1h3g h THR 397 Cb 0.54 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 67.33 1h3g h THR 397 CO 0.03 0.20 0.21 -0.07 0.37 0.00 0.00 175.52 176.26 1h3g h LEU 398 N 0.82 0.58 -2.44 2.58 3.38 -0.44 -1.20 115.31 118.58 1h3g h LEU 398 Ca 0.21 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 1h3g h LEU 398 Cb 0.03 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 1h3g h LEU 398 CO -0.04 0.50 -0.03 0.77 0.09 0.00 0.00 178.44 179.74 1h3g h SER 399 N 0.64 0.00 -0.13 -0.43 4.64 -0.19 -1.32 113.55 116.76 1h3g h SER 399 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1h3g h SER 399 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 1h3g h SER 399 CO -0.02 0.03 0.00 0.18 -0.87 0.00 0.00 176.83 176.15 1h3g n LEU 400 N -3.40 0.91 0.16 5.97 4.77 -0.45 -4.16 117.00 120.79 1h3g n LEU 400 Ca -0.02 -0.42 0.19 0.00 -0.03 0.00 0.00 56.01 55.73 1h3g n LEU 400 Cb 0.14 -0.09 0.79 0.00 -2.33 0.00 0.00 43.42 41.93 1h3g n LEU 400 CO 0.25 0.21 1.16 0.44 -1.33 0.00 0.00 177.39 178.12 1h3g h ASP 401 N 1.10 0.00 0.34 -1.43 5.19 -1.35 0.89 116.42 121.16 1h3g h ASP 401 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1h3g h ASP 401 Cb 0.25 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.76 1h3g h ASP 401 CO 0.00 0.00 0.00 0.10 -3.12 0.00 0.00 179.24 176.22 1h3g h TYR 402 N 0.00 0.00 0.00 4.55 -0.00 -1.84 -1.37 116.97 118.31 1h3g h TYR 402 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.86 1h3g h TYR 402 Cb 0.81 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.54 1h3g h TYR 402 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 178.16 178.09 1h3g h LEU 403 N 0.00 0.00 -9.66 0.10 3.38 -1.16 -3.43 115.31 104.55 1h3g h LEU 403 Ca 0.00 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.34 1h3g h LEU 403 Cb 0.17 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.86 1h3g h LEU 403 CO 0.00 0.00 -0.28 -0.31 0.09 0.00 0.00 178.44 177.94 1h3g s TYR 404 N -3.56 3.69 0.34 1.13 2.02 -0.52 -4.84 117.35 115.61 1h3g s TYR 404 Ca 0.03 0.85 0.06 0.00 -0.37 0.00 0.00 57.07 57.64 1h3g s TYR 404 Cb 0.08 -2.19 0.60 0.00 -0.40 0.00 0.00 41.96 40.05 1h3g s TYR 404 CO 0.57 0.66 1.83 -1.00 -1.57 0.00 0.00 175.55 176.04 1h3g h PRO 405 N 4.84 0.36 -1.84 -1.71 0.13 -1.84 -3.36 132.00 128.58 1h3g h PRO 405 Ca -0.52 -0.11 -0.53 0.00 -0.87 0.00 0.00 66.00 63.97 1h3g h PRO 405 Cb 1.22 -0.04 -0.37 0.00 0.13 0.00 0.00 31.00 31.94 1h3g h PRO 405 CO 0.61 0.53 -1.07 0.39 -0.23 0.00 0.00 178.00 178.23 1h3g n GLU 406 N -4.20 0.73 0.26 0.86 1.02 -1.26 -4.98 120.64 113.06 1h3g n GLU 406 Ca -0.00 -3.11 0.08 0.00 -0.02 0.00 0.00 57.16 54.11 1h3g n GLU 406 Cb 0.33 -1.26 0.64 0.00 -0.02 0.00 0.00 31.44 31.13 1h3g n GLU 406 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1h3g h PRO 407 N 3.94 0.00 -0.00 3.49 0.13 -1.80 -1.68 132.00 136.08 1h3g h PRO 407 Ca 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 1h3g h PRO 407 Cb 0.90 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.03 1h3g h PRO 407 CO 0.45 0.03 -0.00 1.04 -0.23 0.00 0.00 178.00 179.29 1h3g n GLN 408 N -4.44 1.01 0.00 0.86 6.02 -1.26 -1.74 117.38 117.84 1h3g n GLN 408 Ca -0.03 -0.04 0.12 0.00 -0.01 0.00 0.00 57.00 57.05 1h3g n GLN 408 Cb 0.12 -1.50 0.18 0.00 1.02 0.00 0.00 30.24 30.06 1h3g n GLN 408 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1h3g n ASN 409 N -0.96 2.69 -4.80 1.08 5.15 -0.63 -4.01 115.26 113.78 1h3g n ASN 409 Ca 0.24 -1.89 -0.32 0.00 -0.60 0.00 0.00 54.58 52.00 1h3g n ASN 409 Cb 0.12 0.01 0.02 0.00 -0.53 0.00 0.00 39.78 39.40 1h3g n ASN 409 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1h3g s LEU 410 N -2.01 3.44 -0.25 1.20 1.43 -0.71 -4.61 118.68 117.17 1h3g s LEU 410 Ca 0.30 1.80 -0.13 0.00 -1.03 0.00 0.00 54.13 55.07 1h3g s LEU 410 Cb 0.20 -4.53 -0.04 0.00 0.03 0.00 0.00 46.19 41.85 1h3g s LEU 410 CO 0.31 -1.24 0.27 -0.69 0.23 0.00 0.00 176.35 175.24 1h3g s VAL 411 N -2.52 5.27 -0.19 -1.59 1.01 -0.73 -0.65 120.40 121.00 1h3g s VAL 411 Ca 0.63 0.39 -0.07 0.00 0.00 0.00 0.00 61.98 62.93 1h3g s VAL 411 Cb -0.16 -3.60 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 1h3g s VAL 411 CO 0.39 0.26 0.05 -0.22 0.00 0.00 0.00 175.10 175.58 1h3g s LEU 412 N 1.51 3.69 0.12 3.92 2.96 0.69 -0.41 118.68 131.16 1h3g s LEU 412 Ca 0.12 0.01 0.09 0.00 -0.22 0.00 0.00 54.13 54.13 1h3g s LEU 412 Cb -0.15 -1.93 -0.04 0.00 0.50 0.00 0.00 46.19 44.57 1h3g s LEU 412 CO 0.08 0.14 -0.23 0.72 -1.32 0.00 0.00 176.35 175.74 1h3g s PHE 413 N 0.54 2.02 0.00 5.38 -0.12 -1.26 0.09 117.98 124.63 1h3g s PHE 413 Ca 0.02 -0.40 0.15 0.00 -0.05 0.00 0.00 56.93 56.65 1h3g s PHE 413 Cb -0.13 -1.10 0.24 0.00 -0.63 0.00 0.00 43.02 41.40 1h3g s PHE 413 CO 0.01 0.27 1.52 0.78 -0.05 0.00 0.00 175.22 177.75 1h3g h GLY 414 N 3.97 0.00 0.00 1.99 0.00 -1.73 -3.46 103.07 103.84 1h3g h GLY 414 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 1h3g h GLY 414 CO 0.40 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.55 1h3g n GLY 415 N 0.89 -1.47 2.49 4.60 0.00 -1.26 -4.98 105.19 105.46 1h3g n GLY 415 Ca 0.01 -1.08 -0.06 0.00 0.00 0.00 0.00 46.02 44.89 1h3g n GLY 415 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1h3g n ASN 416 N 0.62 -1.51 0.00 1.61 0.23 -1.26 -4.24 115.26 110.71 1h3g n ASN 416 Ca 0.00 -2.07 0.11 0.00 -0.53 0.00 0.00 54.58 52.09 1h3g n ASN 416 Cb 0.00 2.52 0.63 0.00 -2.08 0.00 0.00 39.78 40.86 1h3g n ASN 416 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1h3g n HIS 417 N -0.36 0.00 -1.34 -2.53 1.44 -1.26 -4.72 115.22 106.45 1h3g n HIS 417 Ca -0.06 0.00 -0.05 0.00 -2.01 0.00 0.00 57.72 55.60 1h3g n HIS 417 Cb 0.39 -0.01 0.21 0.00 0.12 0.00 0.00 29.99 30.70 1h3g n HIS 417 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 1h3g n ASP 418 N -1.01 2.95 -4.80 4.39 8.00 -1.26 -4.79 116.55 120.03 1h3g n ASP 418 Ca 0.16 -3.62 -0.35 0.00 0.71 0.00 0.00 54.79 51.69 1h3g n ASP 418 Cb 0.08 -0.66 -0.06 0.00 -0.02 0.00 0.00 41.12 40.46 1h3g n ASP 418 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1h3g s ALA 420 N -3.18 3.12 0.69 2.24 0.00 -1.26 -5.04 121.76 118.32 1h3g s ALA 420 Ca 0.46 0.49 0.00 0.00 0.00 0.00 0.00 51.96 52.91 1h3g s ALA 420 Cb 0.41 -3.18 0.00 0.00 0.00 0.00 0.00 23.12 20.35 1h3g s ALA 420 CO 0.03 0.11 0.00 0.54 0.00 0.00 0.00 175.76 176.44 1h3g n ARG 421 N -0.03 2.47 0.00 0.00 5.12 -1.26 -4.73 116.66 118.24 1h3g n ARG 421 Ca 0.04 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.96 1h3g n ARG 421 Cb 0.52 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.82 1h3g n ARG 421 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1h3g n PHE 423 N 0.00 0.00 0.02 -1.55 7.35 -1.26 0.18 117.46 122.20 1h3g n PHE 423 Ca 0.00 0.00 -0.18 0.00 -0.76 0.00 0.00 57.45 56.51 1h3g n PHE 423 Cb 0.00 0.00 -0.08 0.00 0.35 0.00 0.00 39.48 39.75 1h3g n PHE 423 CO 0.00 0.00 0.00 0.77 -0.76 0.00 0.00 176.76 176.77 1h3g h SER 424 N 0.00 0.86 -0.31 -2.13 0.02 -1.92 0.67 113.55 110.75 1h3g h SER 424 Ca 0.00 -0.65 0.01 0.00 -0.84 0.00 0.00 61.79 60.32 1h3g h SER 424 Cb 0.00 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.26 1h3g h SER 424 CO 0.00 1.44 0.20 0.00 -1.14 0.00 0.00 176.83 177.34 1h3g h ALA 425 N 0.51 1.82 -0.01 3.77 0.00 -0.56 0.34 119.26 125.13 1h3g h ALA 425 Ca -0.10 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1h3g h ALA 425 Cb 1.58 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.26 1h3g h ALA 425 CO 0.18 0.15 0.00 0.00 0.00 0.00 0.00 179.25 179.59 1h3g n ALA 426 N -2.50 2.59 -1.36 0.00 0.00 -1.03 -4.34 120.51 113.87 1h3g n ALA 426 Ca 0.02 -0.13 -0.04 0.00 0.00 0.00 0.00 53.44 53.29 1h3g n ALA 426 Cb 0.09 -1.25 -0.01 0.00 0.00 0.00 0.00 19.45 18.28 1h3g n ALA 426 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h3g n GLY 427 N 0.78 0.56 3.68 0.00 0.00 0.12 -3.41 105.19 106.93 1h3g n GLY 427 Ca 0.13 -0.85 -0.23 0.00 0.00 0.00 0.00 46.02 45.06 1h3g n GLY 427 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1h3g n GLU 428 N -2.50 -6.04 -4.06 1.61 1.02 0.23 -4.97 120.64 105.93 1h3g n GLU 428 Ca -0.04 0.70 -0.32 0.00 -0.02 0.00 0.00 57.16 57.48 1h3g n GLU 428 Cb 0.23 -5.54 -0.15 0.00 -0.02 0.00 0.00 31.44 25.96 1h3g n GLU 428 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1h3g s ASP 429 N -3.89 4.25 0.25 1.62 -1.08 -1.22 -5.01 116.67 111.59 1h3g s ASP 429 Ca 0.29 -1.30 -0.03 0.00 -0.52 0.00 0.00 52.55 50.99 1h3g s ASP 429 Cb -0.14 -1.51 0.50 0.00 -1.46 0.00 0.00 42.92 40.31 1h3g s ASP 429 CO 0.78 -0.17 1.70 0.15 0.52 0.00 0.00 175.17 178.16 1h3g h PHE 430 N 7.80 0.42 -0.66 -5.34 3.57 -1.93 -0.04 116.94 120.77 1h3g h PHE 430 Ca -0.22 0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.35 1h3g h PHE 430 Cb 1.05 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 39.68 1h3g h PHE 430 CO 0.61 -0.02 0.42 -0.44 -2.23 0.00 0.00 178.31 176.64 1h3g h ASP 431 N 0.36 0.69 -0.05 0.41 3.32 -1.95 0.14 116.42 119.33 1h3g h ASP 431 Ca 0.44 -0.00 -0.22 0.00 0.02 0.00 0.00 57.03 57.26 1h3g h ASP 431 Cb 0.73 -0.15 0.01 0.00 0.22 0.00 0.00 39.33 40.14 1h3g h ASP 431 CO -0.47 0.48 -0.80 0.03 -1.72 0.00 0.00 179.24 176.76 1h3g h ARG 432 N 0.82 0.71 -0.84 3.56 3.08 -1.59 -2.85 114.38 117.27 1h3g h ARG 432 Ca 0.26 -0.60 0.10 0.00 0.07 0.00 0.00 59.98 59.81 1h3g h ARG 432 Cb -0.00 0.13 -0.07 0.00 0.08 0.00 0.00 29.97 30.10 1h3g h ARG 432 CO -0.10 1.21 0.49 2.35 -1.07 0.00 0.00 179.97 182.85 1h3g h TRP 433 N 0.48 0.88 0.00 3.04 7.01 -0.67 -1.56 115.95 125.13 1h3g h TRP 433 Ca -0.06 0.03 0.00 0.00 2.11 0.00 0.00 58.89 60.97 1h3g h TRP 433 Cb 1.42 -0.27 0.00 0.00 -2.10 0.00 0.00 29.16 28.21 1h3g h TRP 433 CO 0.08 0.35 0.00 -2.13 -2.79 0.00 0.00 178.44 173.95 1h3g n ARG 434 N -4.73 0.35 0.00 2.65 0.63 0.46 -1.18 116.66 114.83 1h3g n ARG 434 Ca 0.14 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.07 1h3g n ARG 434 Cb 0.29 -1.33 0.00 0.00 0.45 0.00 0.00 32.46 31.87 1h3g n ARG 434 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 1h3g n ASN 436 N 0.99 0.00 0.13 6.15 4.05 -0.59 -1.10 115.26 124.89 1h3g n ASN 436 Ca 0.00 0.00 -0.14 0.00 0.45 0.00 0.00 54.58 54.89 1h3g n ASN 436 Cb 0.17 0.00 -0.08 0.00 1.23 0.00 0.00 39.78 41.11 1h3g n ASN 436 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 177.26 174.46 1h3g h LEU 437 N 0.00 -0.21 -0.96 1.20 5.85 -1.41 0.83 115.31 120.60 1h3g h LEU 437 Ca 0.00 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.72 1h3g h LEU 437 Cb 0.00 0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.03 1h3g h LEU 437 CO 0.00 -0.12 0.63 0.58 -0.34 0.00 0.00 178.44 179.19 1h3g h VAL 438 N -0.29 1.20 0.06 1.05 2.07 -1.39 -2.07 116.25 116.88 1h3g h VAL 438 Ca -0.03 -0.43 0.01 0.00 0.82 0.00 0.00 66.70 67.07 1h3g h VAL 438 Cb 0.22 -0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 29.81 1h3g h VAL 438 CO 0.04 0.23 -0.11 0.15 0.02 0.00 0.00 177.57 177.91 1h3g h PHE 439 N 1.25 -0.27 0.00 1.57 3.57 -1.72 0.24 116.94 121.59 1h3g h PHE 439 Ca 0.37 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.88 1h3g h PHE 439 Cb -0.06 0.11 0.00 0.00 2.79 0.00 0.00 35.95 38.79 1h3g h PHE 439 CO -0.01 -0.16 0.00 -0.11 -2.23 0.00 0.00 178.31 175.80 1h3g n LEU 440 N -5.23 0.00 0.00 0.59 7.94 0.25 -4.92 117.00 115.63 1h3g n LEU 440 Ca -0.07 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.83 1h3g n LEU 440 Cb 0.15 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.10 1h3g n LEU 440 CO 0.30 0.00 0.00 0.35 -1.11 0.00 0.00 177.39 176.93 1h3g n THR 442 N 0.43 0.00 -3.55 1.96 -2.24 0.07 -4.59 114.28 106.36 1h3g n THR 442 Ca 0.00 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.48 1h3g n THR 442 Cb 0.00 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.15 1h3g n THR 442 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1h3g n PRO 444 N 0.00 2.50 -3.97 -0.78 -0.04 -1.26 -4.91 135.00 126.53 1h3g n PRO 444 Ca 0.00 -4.59 -0.09 0.00 -0.04 0.00 0.00 63.50 58.77 1h3g n PRO 444 Cb 0.00 -2.31 -0.04 0.00 -0.04 0.00 0.00 33.50 31.11 1h3g n PRO 444 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1h3g s ARG 445 N -2.10 1.68 -0.34 0.54 1.81 -1.26 -4.12 118.95 115.17 1h3g s ARG 445 Ca 0.33 -1.29 -0.18 0.00 -1.72 0.00 0.00 55.73 52.88 1h3g s ARG 445 Cb 0.06 0.50 -0.01 0.00 -0.45 0.00 0.00 34.95 35.06 1h3g s ARG 445 CO -0.06 -0.72 0.49 0.42 -0.68 0.00 0.00 175.30 174.75 1h3g s ILE 446 N -3.75 5.04 0.23 1.52 1.01 0.18 -4.78 121.20 120.65 1h3g s ILE 446 Ca 0.21 0.34 -0.30 0.00 0.00 0.00 0.00 60.65 60.90 1h3g s ILE 446 Cb -0.02 -3.94 -0.09 0.00 0.01 0.00 0.00 42.46 38.43 1h3g s ILE 446 CO 0.10 -0.18 0.98 -2.16 0.00 0.00 0.00 174.94 173.68 1h3g s PRO 447 N 2.34 4.78 -0.04 2.79 0.04 -1.26 -0.22 135.00 143.44 1h3g s PRO 447 Ca 0.18 1.56 0.04 0.00 0.04 0.00 0.00 61.00 62.82 1h3g s PRO 447 Cb -0.16 -3.27 -0.00 0.00 0.04 0.00 0.00 34.50 31.11 1h3g s PRO 447 CO 0.13 0.40 -0.15 -1.14 0.04 0.00 0.00 177.00 176.28 1h3g s GLN 448 N -1.06 1.52 -0.02 4.56 -0.44 0.11 -0.33 119.66 124.00 1h3g s GLN 448 Ca 0.43 -0.53 0.06 0.00 -2.50 0.00 0.00 55.36 52.82 1h3g s GLN 448 Cb -0.27 -1.36 -0.01 0.00 -1.64 0.00 0.00 33.01 29.73 1h3g s GLN 448 CO 0.34 0.23 -0.21 0.12 0.50 0.00 0.00 175.29 176.26 1h3g s PHE 449 N 0.02 1.91 -0.27 1.67 2.19 0.32 -1.75 117.98 122.07 1h3g s PHE 449 Ca -0.02 -0.39 -0.14 0.00 0.33 0.00 0.00 56.93 56.71 1h3g s PHE 449 Cb -0.10 -1.23 -0.04 0.00 -1.31 0.00 0.00 43.02 40.33 1h3g s PHE 449 CO 0.01 -0.06 0.32 -0.47 1.83 0.00 0.00 175.22 176.85 1h3g s TYR 450 N -0.43 3.24 0.09 10.12 5.04 -1.26 0.01 117.35 134.17 1h3g s TYR 450 Ca 0.06 0.33 -0.36 0.00 -2.44 0.00 0.00 57.07 54.66 1h3g s TYR 450 Cb -0.09 -2.51 -0.17 0.00 0.35 0.00 0.00 41.96 39.54 1h3g s TYR 450 CO -0.00 -0.20 1.21 0.45 -1.34 0.00 0.00 175.55 175.66 1h3g n SER 451 N 5.22 1.08 0.00 4.32 2.88 0.46 -1.07 113.62 126.51 1h3g n SER 451 Ca -0.10 1.13 0.00 0.00 -1.33 0.00 0.00 58.87 58.57 1h3g n SER 451 Cb 0.51 -1.12 0.00 0.00 -0.75 0.00 0.00 64.21 62.85 1h3g n SER 451 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1h3g n GLY 452 N 2.15 2.71 0.18 0.46 0.00 -1.26 -4.89 105.19 104.55 1h3g n GLY 452 Ca 0.18 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.34 1h3g n GLY 452 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1h3g h ASP 453 N 0.27 0.00 1.09 1.61 3.32 -1.50 -2.29 116.42 118.92 1h3g h ASP 453 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1h3g h ASP 453 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1h3g h ASP 453 CO 0.00 0.00 0.00 -1.84 -1.72 0.00 0.00 179.24 175.68 1h3g n GLU 454 N -2.65 0.17 -0.43 3.56 0.00 -1.26 -2.64 120.64 117.38 1h3g n GLU 454 Ca 0.03 0.23 0.07 0.00 0.00 0.00 0.00 57.16 57.49 1h3g n GLU 454 Cb 0.35 -1.73 0.17 0.00 0.00 0.00 0.00 31.44 30.23 1h3g n GLU 454 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.13 177.57 1h3g n ILE 455 N -2.03 1.93 -1.80 3.84 -5.35 -0.88 -1.58 119.36 113.50 1h3g n ILE 455 Ca 0.05 -2.68 0.00 0.00 -0.27 0.00 0.00 62.75 59.85 1h3g n ILE 455 Cb 0.33 -0.17 0.00 0.00 -1.74 0.00 0.00 39.64 38.07 1h3g n ILE 455 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1h3g n LEU 456 N -1.14 -4.19 -3.72 7.28 4.77 -1.08 -4.79 117.00 114.12 1h3g n LEU 456 Ca 0.17 3.09 -0.10 0.00 -0.03 0.00 0.00 56.01 59.14 1h3g n LEU 456 Cb 0.69 -3.16 -0.04 0.00 -2.33 0.00 0.00 43.42 38.58 1h3g n LEU 456 CO -0.02 -0.12 0.29 0.42 -1.33 0.00 0.00 177.39 176.63 1h3g s THR 458 N -2.66 0.02 0.34 -5.08 -4.23 -1.26 -4.91 115.64 97.86 1h3g s THR 458 Ca 0.00 -0.74 -0.13 0.00 -1.18 0.00 0.00 61.69 59.64 1h3g s THR 458 Cb 0.00 -1.56 0.03 0.00 1.34 0.00 0.00 72.50 72.31 1h3g s THR 458 CO 0.00 -0.11 0.66 -0.94 -0.54 0.00 0.00 174.62 173.69 1h3g s SER 459 N -2.87 0.19 0.80 3.99 1.04 -1.26 -4.85 113.70 110.74 1h3g s SER 459 Ca 0.09 -1.13 -0.12 0.00 0.48 0.00 0.00 55.95 55.27 1h3g s SER 459 Cb -0.01 0.75 0.07 0.00 0.10 0.00 0.00 66.02 66.94 1h3g s SER 459 CO -0.03 -1.47 1.14 0.42 0.98 0.00 0.00 173.24 174.28 1h3g s THR 460 N -2.94 2.50 0.00 2.02 -4.23 -1.26 -4.84 115.64 106.88 1h3g s THR 460 Ca 0.19 0.16 0.00 0.00 -1.18 0.00 0.00 61.69 60.87 1h3g s THR 460 Cb -0.04 -3.09 0.00 0.00 1.34 0.00 0.00 72.50 70.72 1h3g s THR 460 CO 0.13 -0.21 0.43 1.33 -0.54 0.00 0.00 174.62 175.75 1h3g n VAL 461 N -3.33 0.08 -4.22 2.29 0.24 -1.26 -4.61 118.33 107.53 1h3g n VAL 461 Ca 0.07 -0.41 -0.12 0.00 -2.04 0.00 0.00 64.34 61.84 1h3g n VAL 461 Cb 0.59 1.18 -0.10 0.00 -1.47 0.00 0.00 33.84 34.05 1h3g n VAL 461 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 1h3g s LYS 462 N -0.08 1.03 1.06 7.34 -2.85 -1.26 -4.99 119.74 119.99 1h3g s LYS 462 Ca 0.00 -1.48 0.00 0.00 -1.00 0.00 0.00 55.97 53.49 1h3g s LYS 462 Cb 0.00 -0.18 0.00 0.00 -2.06 0.00 0.00 37.83 35.59 1h3g s LYS 462 CO 0.00 -0.13 0.00 0.41 0.10 0.00 0.00 175.35 175.73 1h3g n GLY 463 N -0.19 -1.57 3.68 0.59 0.00 -1.26 -4.67 105.19 101.77 1h3g n GLY 463 Ca -0.07 -1.17 -0.39 0.00 0.00 0.00 0.00 46.02 44.39 1h3g n GLY 463 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1h3g s ARG 464 N -0.90 4.26 -0.40 1.61 1.70 -1.26 -4.92 118.95 119.04 1h3g s ARG 464 Ca 0.00 0.49 0.06 0.00 -0.47 0.00 0.00 55.73 55.81 1h3g s ARG 464 Cb 0.00 -3.52 0.31 0.00 -0.57 0.00 0.00 34.95 31.18 1h3g s ARG 464 CO 0.00 -0.05 1.23 -3.47 -1.08 0.00 0.00 175.30 171.93 1h3g n ASP 465 N 4.40 -1.90 -0.28 -2.89 -0.08 -1.26 -5.00 116.55 109.54 1h3g n ASP 465 Ca -0.05 -2.80 0.08 0.00 -1.51 0.00 0.00 54.79 50.52 1h3g n ASP 465 Cb 0.51 1.42 0.31 0.00 2.34 0.00 0.00 41.12 45.70 1h3g n ASP 465 CO 0.00 0.00 0.00 0.44 0.12 0.00 0.00 177.20 177.76 1h3g h ASP 466 N 2.34 0.77 -1.00 1.67 5.19 -1.93 -1.43 116.42 122.04 1h3g h ASP 466 Ca -0.25 0.03 0.10 0.00 -0.62 0.00 0.00 57.03 56.29 1h3g h ASP 466 Cb 1.20 -0.13 -0.08 0.00 0.18 0.00 0.00 39.33 40.50 1h3g h ASP 466 CO 0.01 0.44 0.64 0.00 -3.12 0.00 0.00 179.24 177.21 1h3g h ALA 467 N 1.56 1.46 0.00 3.45 0.00 -1.93 0.20 119.26 124.01 1h3g h ALA 467 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.34 1h3g h ALA 467 Cb 0.47 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1h3g h ALA 467 CO -0.18 0.31 0.00 0.66 0.00 0.00 0.00 179.25 180.04 1h3g h SER 468 N 1.07 0.00 0.43 0.00 4.64 -1.61 -1.42 113.55 116.65 1h3g h SER 468 Ca 0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.79 1h3g h SER 468 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 1h3g h SER 468 CO -0.23 0.00 -0.30 -1.22 -0.87 0.00 0.00 176.83 174.21 1h3g n TYR 469 N -2.90 0.00 -1.94 4.77 4.01 0.05 -4.34 117.16 116.81 1h3g n TYR 469 Ca -0.01 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.75 1h3g n TYR 469 Cb 0.19 -0.22 0.13 0.00 -0.31 0.00 0.00 39.34 39.13 1h3g n TYR 469 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1h3g n ARG 470 N -1.11 1.42 -1.76 -0.72 1.74 -0.54 -4.79 116.66 110.90 1h3g n ARG 470 Ca 0.10 -3.08 -0.35 0.00 -0.77 0.00 0.00 57.85 53.74 1h3g n ARG 470 Cb 0.33 -1.28 0.06 0.00 -1.02 0.00 0.00 32.46 30.55 1h3g n ARG 470 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1h3g s ARG 471 N -2.48 2.62 0.31 5.56 0.52 -1.24 -4.86 118.95 119.38 1h3g s ARG 471 Ca 0.38 1.81 -0.29 0.00 -0.52 0.00 0.00 55.73 57.11 1h3g s ARG 471 Cb 0.38 -1.89 -0.12 0.00 0.52 0.00 0.00 34.95 33.84 1h3g s ARG 471 CO -0.08 -1.48 1.38 -0.25 0.02 0.00 0.00 175.30 174.89 1h3g n ASP 472 N -2.07 2.98 -4.69 0.23 8.00 -1.26 -4.90 116.55 114.85 1h3g n ASP 472 Ca 0.14 1.18 -0.42 0.00 0.71 0.00 0.00 54.79 56.40 1h3g n ASP 472 Cb 0.50 -1.49 -0.03 0.00 -0.02 0.00 0.00 41.12 40.08 1h3g n ASP 472 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1h3g s PHE 473 N -0.63 2.62 -0.08 1.24 5.36 -0.21 -4.91 117.98 121.38 1h3g s PHE 473 Ca 0.60 0.58 -0.29 0.00 -0.96 0.00 0.00 56.93 56.86 1h3g s PHE 473 Cb -0.58 -3.80 -0.06 0.00 -0.34 0.00 0.00 43.02 38.24 1h3g s PHE 473 CO 0.57 -3.11 1.81 -1.25 -1.46 0.00 0.00 175.22 171.78 1h3g s PRO 474 N 2.60 3.97 0.00 10.12 0.04 -1.26 -1.28 135.00 149.20 1h3g s PRO 474 Ca 0.68 2.20 0.00 0.00 0.04 0.00 0.00 61.00 63.93 1h3g s PRO 474 Cb -0.35 -4.10 0.00 0.00 0.04 0.00 0.00 34.50 30.09 1h3g s PRO 474 CO 0.29 -1.11 0.00 0.41 0.04 0.00 0.00 177.00 176.62 1h3g n GLY 475 N 4.55 0.84 0.18 0.56 0.00 -0.84 -0.30 105.19 110.18 1h3g n GLY 475 Ca 0.20 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.28 1h3g n GLY 475 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1h3g h GLY 476 N 0.00 0.00 -4.56 -0.02 0.00 -1.34 -3.45 103.07 93.70 1h3g h GLY 476 Ca 0.00 0.00 -0.69 0.00 0.00 0.00 0.00 47.33 46.64 1h3g h GLY 476 CO 0.00 0.00 -0.81 -0.98 0.00 0.00 0.00 176.54 174.75 1h3g s TRP 477 N -3.43 2.54 0.26 5.60 0.51 -1.26 -0.93 118.94 122.23 1h3g s TRP 477 Ca 0.01 -0.27 -0.31 0.00 -2.12 0.00 0.00 56.10 53.42 1h3g s TRP 477 Cb 0.10 -1.50 -0.13 0.00 -0.81 0.00 0.00 33.47 31.13 1h3g s TRP 477 CO 0.69 0.19 1.48 0.00 -0.51 0.00 0.00 176.95 178.81 1h3g n ALA 478 N 1.84 1.69 -0.63 0.98 0.00 -1.26 -2.25 120.51 120.88 1h3g n ALA 478 Ca -0.16 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1h3g n ALA 478 Cb 0.52 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.62 1h3g n ALA 478 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h3g n GLY 479 N 2.18 0.65 3.75 0.00 0.00 -1.26 -5.04 105.19 105.47 1h3g n GLY 479 Ca 0.10 -0.34 -0.41 0.00 0.00 0.00 0.00 46.02 45.38 1h3g n GLY 479 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1h3g s ASP 480 N -2.31 7.17 0.02 1.61 1.01 -0.95 -4.95 116.67 118.27 1h3g s ASP 480 Ca 0.00 2.29 -0.27 0.00 0.71 0.00 0.00 52.55 55.29 1h3g s ASP 480 Cb 0.00 -2.62 -0.16 0.00 1.01 0.00 0.00 42.92 41.15 1h3g s ASP 480 CO 0.00 -0.24 1.20 0.11 0.21 0.00 0.00 175.17 176.45 1h3g h LYS 481 N 4.21 -0.72 -5.66 8.23 1.79 -1.95 -3.42 116.57 119.05 1h3g h LYS 481 Ca -0.46 0.05 -0.59 0.00 -2.18 0.00 0.00 60.65 57.47 1h3g h LYS 481 Cb 1.21 0.16 -0.09 0.00 -1.58 0.00 0.00 32.23 31.94 1h3g h LYS 481 CO 0.69 -0.42 -0.24 0.00 -1.08 0.00 0.00 179.45 178.40 1h3g s ALA 482 N -5.02 3.56 -0.32 3.86 0.00 -1.26 -4.52 121.76 118.06 1h3g s ALA 482 Ca -0.14 -0.32 0.03 0.00 0.00 0.00 0.00 51.96 51.52 1h3g s ALA 482 Cb 0.02 -2.48 0.09 0.00 0.00 0.00 0.00 23.12 20.75 1h3g s ALA 482 CO 0.48 0.12 0.04 1.21 0.00 0.00 0.00 175.76 177.61 1h3g s ASN 483 N 0.30 4.50 0.55 0.00 3.84 0.46 -1.99 114.94 122.61 1h3g s ASN 483 Ca 0.21 -1.91 0.33 0.00 0.21 0.00 0.00 52.86 51.71 1h3g s ASN 483 Cb -0.14 -1.41 1.50 0.00 -0.55 0.00 0.00 41.25 40.65 1h3g s ASN 483 CO 0.08 -0.36 2.04 0.00 -2.79 0.00 0.00 177.10 176.06 1h3g h ALA 484 N 7.76 1.04 -0.32 1.71 0.00 -0.92 0.37 119.26 128.91 1h3g h ALA 484 Ca -0.08 -0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.61 1h3g h ALA 484 Cb 1.02 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 1h3g h ALA 484 CO 0.50 0.06 -0.50 0.74 0.00 0.00 0.00 179.25 180.05 1h3g h PHE 485 N 0.00 1.10 0.00 0.00 0.05 -1.92 -3.30 116.94 112.87 1h3g h PHE 485 Ca -0.00 -0.37 -0.03 0.00 3.82 0.00 0.00 57.97 61.39 1h3g h PHE 485 Cb 0.43 -0.22 -0.01 0.00 2.00 0.00 0.00 35.95 38.16 1h3g h PHE 485 CO 0.00 1.20 -1.88 -1.13 -0.18 0.00 0.00 178.31 176.32 1h3g n SER 486 N -4.02 0.13 0.00 2.17 3.41 -1.04 -4.98 113.62 109.30 1h3g n SER 486 Ca -0.04 0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.62 1h3g n SER 486 Cb 0.60 1.70 0.00 0.00 -0.26 0.00 0.00 64.21 66.25 1h3g n SER 486 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1h3g n GLY 487 N 1.28 0.70 3.72 5.00 0.00 0.13 -5.04 105.19 110.98 1h3g n GLY 487 Ca -0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 1h3g n GLY 487 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h3g s ALA 488 N -2.28 3.62 0.00 4.61 0.00 -1.08 -2.47 121.76 124.16 1h3g s ALA 488 Ca 0.00 1.18 0.00 0.00 0.00 0.00 0.00 51.96 53.14 1h3g s ALA 488 Cb 0.00 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.57 1h3g s ALA 488 CO 0.00 -0.64 0.00 0.41 0.00 0.00 0.00 175.76 175.53 1h3g n GLY 489 N 3.28 0.95 3.77 0.00 0.00 -1.26 -0.40 105.19 111.53 1h3g n GLY 489 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 1h3g n GLY 489 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h3g s LEU 490 N 0.00 4.46 0.68 0.99 1.02 -1.03 -4.72 118.68 120.08 1h3g s LEU 490 Ca 0.00 1.84 -0.12 0.00 0.02 0.00 0.00 54.13 55.87 1h3g s LEU 490 Cb 0.00 -3.82 0.01 0.00 0.02 0.00 0.00 46.19 42.40 1h3g s LEU 490 CO 0.00 0.03 1.07 0.28 0.02 0.00 0.00 176.35 177.75 1h3g s THR 491 N -1.44 3.79 0.24 5.49 -1.32 -1.26 -4.83 115.64 116.31 1h3g s THR 491 Ca 0.46 0.66 -0.06 0.00 -1.21 0.00 0.00 61.69 61.53 1h3g s THR 491 Cb -0.21 -3.28 0.24 0.00 -1.51 0.00 0.00 72.50 67.74 1h3g s THR 491 CO 0.27 -0.68 1.91 0.77 -2.21 0.00 0.00 174.62 174.67 1h3g h SER 492 N -0.48 1.07 -0.64 8.08 4.64 -1.99 -0.12 113.55 124.12 1h3g h SER 492 Ca -0.45 -0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 60.85 1h3g h SER 492 Cb 1.22 -0.26 -0.03 0.00 -0.31 0.00 0.00 62.40 63.02 1h3g h SER 492 CO 0.56 0.76 0.38 -0.61 -0.87 0.00 0.00 176.83 177.04 1h3g h GLN 493 N 1.26 0.87 -0.48 4.77 4.15 -1.99 0.85 115.11 124.54 1h3g h GLN 493 Ca 0.36 -0.09 -0.07 0.00 0.77 0.00 0.00 58.65 59.62 1h3g h GLN 493 Cb -0.10 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 27.39 1h3g h GLN 493 CO -0.09 0.63 0.02 1.96 -1.93 0.00 0.00 178.83 179.42 1h3g h GLN 494 N 0.87 0.79 -0.37 1.69 4.20 -1.71 -0.40 115.11 120.18 1h3g h GLN 494 Ca 0.23 -0.20 -0.08 0.00 0.06 0.00 0.00 58.65 58.65 1h3g h GLN 494 Cb -0.01 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 1h3g h GLN 494 CO -0.04 0.78 -0.10 0.00 -0.67 0.00 0.00 178.83 178.81 1h3g h ARG 495 N 0.74 0.71 -0.84 1.46 3.08 -0.53 -0.23 114.38 118.78 1h3g h ARG 495 Ca 0.15 -0.28 0.00 0.00 0.07 0.00 0.00 59.98 59.92 1h3g h ARG 495 Cb 0.42 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.39 1h3g h ARG 495 CO 0.02 0.87 0.52 0.00 -1.07 0.00 0.00 179.97 180.31 1h3g h ALA 496 N 0.82 1.35 -0.28 0.04 0.00 -0.47 0.11 119.26 120.82 1h3g h ALA 496 Ca 0.09 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 1h3g h ALA 496 Cb 0.61 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1h3g h ALA 496 CO 0.04 0.58 -0.04 0.00 0.00 0.00 0.00 179.25 179.83 1h3g h ALA 497 N 1.43 0.38 -0.67 0.00 0.00 -0.83 -0.04 119.26 119.54 1h3g h ALA 497 Ca 0.30 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1h3g h ALA 497 Cb -0.08 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 1h3g h ALA 497 CO -0.06 0.17 0.24 0.37 0.00 0.00 0.00 179.25 179.97 1h3g h GLN 498 N 0.29 1.02 -0.62 0.00 4.15 -0.02 -0.87 115.11 119.07 1h3g h GLN 498 Ca 0.08 -0.20 -0.09 0.00 0.77 0.00 0.00 58.65 59.20 1h3g h GLN 498 Cb 0.50 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 28.01 1h3g h GLN 498 CO 0.02 0.86 0.03 -0.44 -1.93 0.00 0.00 178.83 177.37 1h3g h ASP 499 N 0.96 1.04 -0.54 -0.69 3.45 -0.67 -1.03 116.42 118.95 1h3g h ASP 499 Ca 0.22 -0.28 -0.05 0.00 0.43 0.00 0.00 57.03 57.35 1h3g h ASP 499 Cb 0.25 -0.28 -0.02 0.00 -0.56 0.00 0.00 39.33 38.71 1h3g h ASP 499 CO -0.01 1.08 0.15 0.25 -1.57 0.00 0.00 179.24 179.13 1h3g h LEU 500 N 0.99 0.81 -0.60 1.55 5.85 -0.56 0.12 115.31 123.46 1h3g h LEU 500 Ca 0.18 -0.22 -0.04 0.00 0.84 0.00 0.00 57.88 58.64 1h3g h LEU 500 Cb 0.53 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.32 1h3g h LEU 500 CO 0.03 0.82 0.22 0.58 -0.34 0.00 0.00 178.44 179.75 1h3g h VAL 501 N 0.76 1.23 -0.19 1.05 2.07 -0.92 0.31 116.25 120.56 1h3g h VAL 501 Ca 0.17 -0.75 -0.01 0.00 0.82 0.00 0.00 66.70 66.93 1h3g h VAL 501 Cb 0.32 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 1h3g h VAL 501 CO -0.00 0.29 0.09 -0.09 0.02 0.00 0.00 177.57 177.88 1h3g h ARG 502 N 0.84 0.28 -0.13 1.57 2.43 -0.79 0.14 114.38 118.72 1h3g h ARG 502 Ca 0.20 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 1h3g h ARG 502 Cb 0.23 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.72 1h3g h ARG 502 CO -0.01 0.30 0.08 -0.22 -1.51 0.00 0.00 179.97 178.61 1h3g h LYS 503 N 0.18 0.17 -0.07 0.20 3.64 -0.57 -0.99 116.57 119.13 1h3g h LYS 503 Ca 0.07 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.41 1h3g h LYS 503 Cb 0.11 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 31.90 1h3g h LYS 503 CO -0.01 0.14 -0.03 -0.07 -2.27 0.00 0.00 179.45 177.20 1h3g h LEU 504 N 0.16 0.15 -0.55 5.20 4.07 -0.78 -0.21 115.31 123.35 1h3g h LEU 504 Ca 0.05 -0.42 -0.06 0.00 0.08 0.00 0.00 57.88 57.53 1h3g h LEU 504 Cb 0.01 -0.04 -0.02 0.00 1.08 0.00 0.00 40.66 41.68 1h3g h LEU 504 CO -0.01 0.53 0.10 0.00 -1.08 0.00 0.00 178.44 177.98 1h3g h ALA 505 N 0.62 0.72 -0.42 1.53 0.00 -0.73 0.22 119.26 121.19 1h3g h ALA 505 Ca 0.01 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.59 1h3g h ALA 505 Cb 0.48 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1h3g h ALA 505 CO 0.01 0.46 -0.13 -0.91 0.00 0.00 0.00 179.25 178.67 1h3g h ASN 506 N 0.79 0.77 -0.46 0.00 2.35 -1.17 -2.51 115.58 115.35 1h3g h ASN 506 Ca 0.17 -0.24 -0.06 0.00 -0.55 0.00 0.00 56.30 55.62 1h3g h ASN 506 Cb 0.40 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.54 1h3g h ASN 506 CO 0.01 0.92 0.07 -0.25 -1.65 0.00 0.00 177.43 176.52 1h3g h TRP 507 N 0.70 0.83 -0.78 1.19 7.01 -0.55 -3.08 115.95 121.27 1h3g h TRP 507 Ca 0.11 -0.12 0.05 0.00 2.11 0.00 0.00 58.89 61.05 1h3g h TRP 507 Cb 0.62 -0.22 -0.05 0.00 -2.10 0.00 0.00 29.16 27.41 1h3g h TRP 507 CO 0.03 0.77 0.51 -0.09 -2.79 0.00 0.00 178.44 176.88 1h3g h ARG 508 N 0.64 0.86 -0.08 2.65 2.43 -0.22 -1.08 114.38 119.58 1h3g h ARG 508 Ca 0.14 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.28 1h3g h ARG 508 Cb 0.40 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 29.75 1h3g h ARG 508 CO 0.01 0.57 0.13 0.87 -1.51 0.00 0.00 179.97 180.05 1h3g h LYS 509 N 0.89 0.00 -0.50 0.20 1.57 -1.36 -0.39 116.57 116.98 1h3g h LYS 509 Ca 0.32 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 59.04 1h3g h LYS 509 Cb 0.15 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.42 1h3g h LYS 509 CO -0.10 0.00 0.06 0.09 -0.57 0.00 0.00 179.45 178.93 1h3g n ASN 510 N -3.50 4.73 -3.79 0.86 4.13 -0.41 -4.76 115.26 112.52 1h3g n ASN 510 Ca -0.01 -3.09 -0.28 0.00 1.68 0.00 0.00 54.58 52.89 1h3g n ASN 510 Cb 0.23 -0.65 -0.11 0.00 -1.54 0.00 0.00 39.78 37.70 1h3g n ASN 510 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1h3g n GLN 511 N -0.05 1.58 0.06 3.52 1.13 -0.16 -4.91 117.38 118.55 1h3g n GLN 511 Ca 0.29 -4.27 0.21 0.00 -1.94 0.00 0.00 57.00 51.29 1h3g n GLN 511 Cb 1.14 -2.17 0.74 0.00 0.11 0.00 0.00 30.24 30.06 1h3g n GLN 511 CO 0.00 0.00 0.00 -1.35 -1.44 0.00 0.00 177.06 174.27 1h3g h PRO 512 N 5.36 0.00 -0.44 -1.09 0.10 -1.86 0.11 132.00 134.18 1h3g h PRO 512 Ca 0.17 0.00 -0.04 0.00 0.10 0.00 0.00 66.00 66.23 1h3g h PRO 512 Cb 0.78 0.00 -0.02 0.00 0.10 0.00 0.00 31.00 31.85 1h3g h PRO 512 CO 0.66 0.00 0.12 -0.24 0.10 0.00 0.00 178.00 178.64 1h3g h VAL 513 N 0.00 1.19 -0.14 3.15 3.04 -1.94 0.32 116.25 121.87 1h3g h VAL 513 Ca 0.22 -0.67 -0.21 0.00 -1.01 0.00 0.00 66.70 65.03 1h3g h VAL 513 Cb 1.07 0.73 0.01 0.00 -2.01 0.00 0.00 31.29 31.08 1h3g h VAL 513 CO -0.00 0.25 -0.71 0.40 -1.01 0.00 0.00 177.57 176.49 1h3g h ILE 514 N 0.64 1.30 -0.41 3.17 2.04 -1.15 0.42 117.51 123.52 1h3g h ILE 514 Ca 0.15 -1.94 -0.04 0.00 1.00 0.00 0.00 64.86 64.04 1h3g h ILE 514 Cb 0.22 2.03 -0.02 0.00 -0.74 0.00 0.00 36.82 38.32 1h3g h ILE 514 CO -0.01 0.61 0.11 0.45 0.00 0.00 0.00 178.15 179.31 1h3g h HIS 515 N 0.44 0.68 0.00 1.37 3.86 -0.88 -3.38 115.15 117.24 1h3g h HIS 515 Ca -0.05 -0.08 0.00 0.00 -1.16 0.00 0.00 60.37 59.08 1h3g h HIS 515 Cb 1.35 -0.19 0.00 0.00 1.06 0.00 0.00 27.41 29.63 1h3g h HIS 515 CO 0.09 0.64 0.00 0.09 0.86 0.00 0.00 177.93 179.62 1h3g n ASN 516 N -4.56 0.04 -4.39 2.45 5.03 0.11 -4.71 115.26 109.23 1h3g n ASN 516 Ca -0.00 -0.38 -0.29 0.00 0.87 0.00 0.00 54.58 54.78 1h3g n ASN 516 Cb 0.20 0.64 0.21 0.00 -1.02 0.00 0.00 39.78 39.81 1h3g n ASN 516 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1h3g s GLY 517 N -0.64 1.55 0.78 7.41 0.00 0.15 -5.00 107.32 111.57 1h3g s GLY 517 Ca 0.00 -0.52 -0.11 0.00 0.00 0.00 0.00 44.72 44.10 1h3g s GLY 517 CO 0.00 0.20 1.14 0.50 0.00 0.00 0.00 173.10 174.94 1h3g s ARG 518 N -5.01 2.10 0.30 2.90 0.52 0.94 -4.80 118.95 115.91 1h3g s ARG 518 Ca 0.67 0.07 0.03 0.00 -0.52 0.00 0.00 55.73 55.98 1h3g s ARG 518 Cb -0.17 -2.00 -0.01 0.00 0.52 0.00 0.00 34.95 33.28 1h3g s ARG 518 CO 0.58 -1.46 0.11 -0.11 0.02 0.00 0.00 175.30 174.44 1h3g n LEU 519 N -3.20 0.00 -3.58 2.53 7.94 -1.26 -1.56 117.00 117.87 1h3g n LEU 519 Ca 0.08 -2.34 -0.06 0.00 -1.11 0.00 0.00 56.01 52.58 1h3g n LEU 519 Cb 0.60 0.78 -0.03 0.00 0.53 0.00 0.00 43.42 45.31 1h3g n LEU 519 CO 0.56 -0.36 0.92 -1.38 -1.11 0.00 0.00 177.39 176.02 1h3g s HIS 521 N -2.70 -0.21 0.02 1.96 -3.43 -1.26 -4.99 115.29 104.68 1h3g s HIS 521 Ca 0.16 0.22 0.04 0.00 -0.80 0.00 0.00 55.06 54.68 1h3g s HIS 521 Cb 0.01 0.50 -0.03 0.00 -1.43 0.00 0.00 32.58 31.63 1h3g s HIS 521 CO 0.11 -0.28 -0.07 -0.06 -2.00 0.00 0.00 174.74 172.44 1h3g s PHE 522 N -2.07 2.86 0.16 0.38 0.08 -0.34 -4.99 117.98 114.05 1h3g s PHE 522 Ca 0.06 -0.07 -0.33 0.00 0.12 0.00 0.00 56.93 56.71 1h3g s PHE 522 Cb -0.01 -1.58 -0.13 0.00 -0.57 0.00 0.00 43.02 40.74 1h3g s PHE 522 CO -0.05 0.38 1.67 0.41 -0.10 0.00 0.00 175.22 177.53 1h3g n GLY 523 N 1.41 1.33 3.77 4.36 0.00 -1.26 -4.41 105.19 110.38 1h3g n GLY 523 Ca -0.15 0.66 -0.38 0.00 0.00 0.00 0.00 46.02 46.15 1h3g n GLY 523 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1h3g s PRO 524 N 1.32 3.90 -0.08 1.61 0.04 -1.26 -4.86 135.00 135.68 1h3g s PRO 524 Ca 0.78 1.93 0.00 0.00 0.04 0.00 0.00 61.00 63.76 1h3g s PRO 524 Cb -0.60 -2.61 0.02 0.00 0.04 0.00 0.00 34.50 31.35 1h3g s PRO 524 CO 0.37 -0.47 -0.07 -1.21 0.04 0.00 0.00 177.00 175.66 1h3g s GLU 525 N -2.41 1.23 -1.33 4.56 2.02 -0.49 -4.81 118.70 117.47 1h3g s GLU 525 Ca 0.59 -0.19 -0.02 0.00 0.02 0.00 0.00 54.97 55.37 1h3g s GLU 525 Cb -0.33 -1.25 0.01 0.00 0.10 0.00 0.00 34.13 32.67 1h3g s GLU 525 CO 0.41 -0.16 0.78 0.39 0.02 0.00 0.00 175.26 176.70 1h3g n GLU 526 N 4.49 -5.23 -2.68 1.61 1.02 -1.26 -1.38 120.64 117.20 1h3g n GLU 526 Ca -0.17 0.64 -0.17 0.00 -0.02 0.00 0.00 57.16 57.44 1h3g n GLU 526 Cb 0.51 -5.30 -0.00 0.00 -0.02 0.00 0.00 31.44 26.63 1h3g n GLU 526 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1h3g n ASN 527 N -3.03 -4.59 -4.46 1.62 3.02 -0.87 -4.83 115.26 102.12 1h3g n ASN 527 Ca -0.25 -0.02 -0.30 0.00 -0.03 0.00 0.00 54.58 53.98 1h3g n ASN 527 Cb 0.65 -3.83 -0.12 0.00 -0.61 0.00 0.00 39.78 35.87 1h3g n ASN 527 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1h3g s THR 528 N -2.84 2.73 -0.12 3.41 -4.23 -0.48 -0.09 115.64 114.02 1h3g s THR 528 Ca 0.12 -1.35 -0.11 0.00 -1.18 0.00 0.00 61.69 59.17 1h3g s THR 528 Cb -0.06 -2.19 0.03 0.00 1.34 0.00 0.00 72.50 71.63 1h3g s THR 528 CO 0.14 0.24 0.32 0.86 -0.54 0.00 0.00 174.62 175.64 1h3g s TRP 529 N -1.01 -0.36 -0.06 3.99 -0.00 -1.26 -1.40 118.94 118.84 1h3g s TRP 529 Ca 0.16 0.87 0.02 0.00 -0.00 0.00 0.00 56.10 57.15 1h3g s TRP 529 Cb -0.10 0.12 0.01 0.00 -0.00 0.00 0.00 33.47 33.50 1h3g s TRP 529 CO 0.07 -0.18 -0.11 0.08 -0.00 0.00 0.00 176.95 176.80 1h3g s VAL 530 N 0.30 1.05 0.09 5.86 1.01 -1.26 -4.21 120.40 123.24 1h3g s VAL 530 Ca -0.01 -0.45 -0.03 0.00 0.00 0.00 0.00 61.98 61.50 1h3g s VAL 530 Cb -0.03 -0.96 -0.03 0.00 0.00 0.00 0.00 36.38 35.36 1h3g s VAL 530 CO -0.01 0.33 0.05 -0.72 0.00 0.00 0.00 175.10 174.76 1h3g s TYR 531 N 0.58 0.56 0.03 5.22 1.13 -0.37 -1.19 117.35 123.31 1h3g s TYR 531 Ca -0.12 -1.03 0.05 0.00 -1.41 0.00 0.00 57.07 54.56 1h3g s TYR 531 Cb -0.14 -0.34 -0.02 0.00 -1.10 0.00 0.00 41.96 40.35 1h3g s TYR 531 CO 0.03 -0.47 -0.14 -0.06 -2.51 0.00 0.00 175.55 172.40 1h3g s PHE 532 N -3.96 1.19 -0.11 -3.49 0.40 -1.26 -0.36 117.98 110.40 1h3g s PHE 532 Ca 0.13 -0.32 -0.02 0.00 -0.60 0.00 0.00 56.93 56.12 1h3g s PHE 532 Cb 0.07 -0.72 -0.03 0.00 0.51 0.00 0.00 43.02 42.85 1h3g s PHE 532 CO -0.06 0.02 -0.04 1.03 0.70 0.00 0.00 175.22 176.88 1h3g s ARG 533 N -0.92 3.16 0.13 0.44 1.81 0.24 -4.22 118.95 119.60 1h3g s ARG 533 Ca 0.02 -0.50 -0.20 0.00 -1.72 0.00 0.00 55.73 53.34 1h3g s ARG 533 Cb -0.07 -2.77 0.05 0.00 -0.45 0.00 0.00 34.95 31.71 1h3g s ARG 533 CO 0.01 0.52 0.51 1.52 -0.68 0.00 0.00 175.30 177.18 1h3g s TYR 534 N -0.40 -0.39 0.04 -0.53 1.13 -0.60 -0.13 117.35 116.47 1h3g s TYR 534 Ca 0.07 0.16 -0.01 0.00 -1.41 0.00 0.00 57.07 55.87 1h3g s TYR 534 Cb -0.12 0.41 0.01 0.00 -1.10 0.00 0.00 41.96 41.16 1h3g s TYR 534 CO 0.02 -0.77 0.08 0.27 -2.51 0.00 0.00 175.55 172.64 1h3g n ASN 535 N -0.24 -0.22 0.00 -0.18 0.23 -0.81 -0.04 115.26 114.00 1h3g n ASN 535 Ca -0.17 -1.17 0.08 0.00 -0.53 0.00 0.00 54.58 52.80 1h3g n ASN 535 Cb 0.64 0.37 0.43 0.00 -2.08 0.00 0.00 39.78 39.14 1h3g n ASN 535 CO 0.00 0.00 0.00 2.29 -0.93 0.00 0.00 177.26 178.62 1h3g n LYS 536 N -0.06 0.26 -0.05 -3.83 2.85 -1.26 -3.16 118.16 112.91 1h3g n LYS 536 Ca -0.01 0.12 -0.03 0.00 -1.05 0.00 0.00 58.31 57.35 1h3g n LYS 536 Cb 0.06 -1.50 -0.12 0.00 -0.65 0.00 0.00 35.03 32.83 1h3g n LYS 536 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1h3g n ASP 537 N -1.26 1.46 -3.47 -5.58 8.00 -1.26 -4.26 116.55 110.17 1h3g n ASP 537 Ca 0.08 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.44 1h3g n ASP 537 Cb 0.13 1.12 -0.04 0.00 -0.02 0.00 0.00 41.12 42.31 1h3g n ASP 537 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1h3g s LYS 538 N -2.57 1.12 -0.04 -1.24 2.20 -1.19 -2.86 119.74 115.17 1h3g s LYS 538 Ca -0.07 -0.15 0.05 0.00 -0.36 0.00 0.00 55.97 55.44 1h3g s LYS 538 Cb 0.06 0.52 -0.01 0.00 -1.51 0.00 0.00 37.83 36.90 1h3g s LYS 538 CO 0.60 -0.44 -0.19 1.03 -0.36 0.00 0.00 175.35 176.00 1h3g s ARG 539 N -2.60 1.82 0.29 4.03 0.52 -0.33 -1.92 118.95 120.75 1h3g s ARG 539 Ca -0.03 -0.67 0.01 0.00 -0.52 0.00 0.00 55.73 54.51 1h3g s ARG 539 Cb -0.01 -1.62 -0.00 0.00 0.52 0.00 0.00 34.95 33.84 1h3g s ARG 539 CO -0.03 0.31 0.02 -0.89 0.02 0.00 0.00 175.30 174.73 1h3g n ILE 540 N 2.96 0.00 -3.60 1.52 5.41 0.82 -0.23 119.36 126.25 1h3g n ILE 540 Ca -0.17 -1.42 -0.00 0.00 1.00 0.00 0.00 62.75 62.16 1h3g n ILE 540 Cb 0.53 0.34 -0.06 0.00 -0.71 0.00 0.00 39.64 39.74 1h3g n ILE 540 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1h3g s VAL 542 N -2.18 -0.06 0.25 1.39 1.01 0.51 -0.59 120.40 120.73 1h3g s VAL 542 Ca 0.03 0.00 0.02 0.00 0.00 0.00 0.00 61.98 62.03 1h3g s VAL 542 Cb 0.00 -1.00 -0.05 0.00 0.00 0.00 0.00 36.38 35.33 1h3g s VAL 542 CO 0.02 0.00 0.07 0.00 0.00 0.00 0.00 175.10 175.19 1h3g s ALA 543 N 1.42 1.73 -0.32 5.51 0.00 -0.31 -1.23 121.76 128.57 1h3g s ALA 543 Ca -0.08 -1.83 -0.02 0.00 0.00 0.00 0.00 51.96 50.04 1h3g s ALA 543 Cb -0.03 0.87 0.19 0.00 0.00 0.00 0.00 23.12 24.14 1h3g s ALA 543 CO -0.14 -0.40 0.82 1.21 0.00 0.00 0.00 175.76 177.25 1h3g s ASN 545 N -3.31 -1.02 -0.78 0.00 2.47 0.43 0.48 114.94 113.22 1h3g s ASN 545 Ca 0.34 -0.06 -0.06 0.00 0.42 0.00 0.00 52.86 53.51 1h3g s ASN 545 Cb 0.07 1.54 -0.01 0.00 -1.45 0.00 0.00 41.25 41.40 1h3g s ASN 545 CO 0.12 -0.17 2.87 -3.20 -3.72 0.00 0.00 177.10 173.00 1h3g n ASN 546 N 4.92 7.01 -3.94 -4.21 5.15 0.88 -2.64 115.26 122.41 1h3g n ASN 546 Ca 0.08 -2.94 -0.10 0.00 -0.60 0.00 0.00 54.58 51.02 1h3g n ASN 546 Cb 0.57 -1.36 -0.10 0.00 -0.53 0.00 0.00 39.78 38.36 1h3g n ASN 546 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 1h3g s ASN 547 N 0.97 0.17 -0.45 1.20 0.01 -1.26 -4.85 114.94 110.73 1h3g s ASN 547 Ca 0.61 -0.42 -0.04 0.00 -0.71 0.00 0.00 52.86 52.30 1h3g s ASN 547 Cb 0.28 0.14 0.08 0.00 0.41 0.00 0.00 41.25 42.17 1h3g s ASN 547 CO -0.12 -0.34 2.70 -0.67 -1.51 0.00 0.00 177.10 177.16 1h3g n ASP 548 N 1.46 6.50 -3.50 -1.22 2.03 -1.26 0.01 116.55 120.57 1h3g n ASP 548 Ca -0.23 -3.21 -0.15 0.00 0.52 0.00 0.00 54.79 51.72 1h3g n ASP 548 Cb 0.56 -1.22 -0.05 0.00 -0.72 0.00 0.00 41.12 39.69 1h3g n ASP 548 CO 0.00 0.00 0.00 -1.59 -1.92 0.00 0.00 177.20 173.69 1h3g s LYS 549 N -1.77 1.12 0.09 -0.67 -2.85 -1.26 -4.93 119.74 109.47 1h3g s LYS 549 Ca 0.57 -0.08 -0.02 0.00 -1.00 0.00 0.00 55.97 55.44 1h3g s LYS 549 Cb 0.38 0.52 0.02 0.00 -2.06 0.00 0.00 37.83 36.69 1h3g s LYS 549 CO -0.21 -0.41 0.07 -2.30 0.10 0.00 0.00 175.35 172.60 1h3g n PRO 550 N 0.39 -1.53 -3.64 1.78 -0.02 -1.26 -4.06 135.00 126.65 1h3g n PRO 550 Ca -0.18 -0.12 -0.06 0.00 -2.02 0.00 0.00 63.50 61.12 1h3g n PRO 550 Cb 0.60 -0.12 -0.07 0.00 -0.02 0.00 0.00 33.50 33.90 1h3g n PRO 550 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1h3g s THR 552 N -1.12 -0.16 -0.20 3.45 2.01 -1.26 -4.95 115.64 113.41 1h3g s THR 552 Ca 0.05 0.00 -0.01 0.00 0.31 0.00 0.00 61.69 62.04 1h3g s THR 552 Cb -0.01 -1.00 0.01 0.00 0.01 0.00 0.00 72.50 71.52 1h3g s THR 552 CO 0.04 0.00 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.07 1h3g s LEU 553 N 1.85 2.52 0.19 4.42 2.01 -0.26 -4.92 118.68 124.49 1h3g s LEU 553 Ca -0.09 -0.63 -0.33 0.00 0.01 0.00 0.00 54.13 53.09 1h3g s LEU 553 Cb -0.06 -1.58 -0.13 0.00 0.01 0.00 0.00 46.19 44.43 1h3g s LEU 553 CO -0.20 -0.03 1.68 -2.65 1.01 0.00 0.00 176.35 176.16 1h3g n PRO 554 N 4.67 2.59 0.00 1.29 -0.02 -1.26 -0.15 135.00 142.12 1h3g n PRO 554 Ca -0.19 0.93 0.15 0.00 -2.02 0.00 0.00 63.50 62.37 1h3g n PRO 554 Cb 0.50 -2.76 0.87 0.00 -0.02 0.00 0.00 33.50 32.08 1h3g n PRO 554 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1h3g n THR 555 N 3.79 0.01 -0.24 3.45 -2.24 -0.50 -3.36 114.28 115.19 1h3g n THR 555 Ca 0.16 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.95 1h3g n THR 555 Cb 0.33 -0.51 0.23 0.00 -2.10 0.00 0.00 70.33 68.28 1h3g n THR 555 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1h3g h ALA 556 N 3.76 1.45 -0.72 6.98 0.00 -1.88 -1.87 119.26 126.99 1h3g h ALA 556 Ca 0.00 -0.05 0.13 0.00 0.00 0.00 0.00 54.91 54.99 1h3g h ALA 556 Cb 0.10 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 17.53 1h3g h ALA 556 CO 0.00 0.50 0.48 -0.09 0.00 0.00 0.00 179.25 180.14 1h3g h ARG 557 N 1.05 0.44 -0.55 0.00 2.43 -1.96 -2.47 114.38 113.32 1h3g h ARG 557 Ca 0.29 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.44 1h3g h ARG 557 Cb -0.10 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.35 1h3g h ARG 557 CO -0.07 0.29 0.00 1.19 -1.51 0.00 0.00 179.97 179.87 1h3g n PHE 558 N -4.48 1.42 0.15 2.20 3.72 -0.71 -4.62 117.46 115.13 1h3g n PHE 558 Ca 0.13 -0.67 0.09 0.00 -0.05 0.00 0.00 57.45 56.95 1h3g n PHE 558 Cb 0.46 -0.29 0.58 0.00 -0.94 0.00 0.00 39.48 39.30 1h3g n PHE 558 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 1h3g h GLN 559 N 3.52 0.16 -0.03 -1.08 1.08 -1.37 0.10 115.11 117.48 1h3g h GLN 559 Ca 0.00 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 1h3g h GLN 559 Cb 1.49 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 28.88 1h3g h GLN 559 CO 0.26 0.11 0.00 -0.85 -0.95 0.00 0.00 178.83 177.39 1h3g n GLU 560 N -4.50 0.06 0.00 1.46 0.28 -1.26 0.53 120.64 117.20 1h3g n GLU 560 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.01 1h3g n GLU 560 Cb 0.16 -1.02 0.00 0.00 1.43 0.00 0.00 31.44 32.01 1h3g n GLU 560 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1h3g n LEU 562 N 0.11 0.00 -4.33 -1.84 4.32 0.35 -5.11 117.00 110.50 1h3g n LEU 562 Ca 0.00 0.00 -0.31 0.00 -0.02 0.00 0.00 56.01 55.68 1h3g n LEU 562 Cb 0.01 0.00 -0.10 0.00 -1.62 0.00 0.00 43.42 41.71 1h3g n LEU 562 CO 0.00 0.00 -0.46 0.29 -1.22 0.00 0.00 177.39 176.00 1h3g n LYS 563 N 0.00 -0.95 -0.97 3.23 4.76 0.19 -0.41 118.16 124.00 1h3g n LYS 563 Ca 0.00 0.09 0.00 0.00 -2.87 0.00 0.00 58.31 55.53 1h3g n LYS 563 Cb 0.00 -3.63 0.00 0.00 -1.84 0.00 0.00 35.03 29.56 1h3g n LYS 563 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1h3g n GLY 564 N -2.52 0.56 3.68 0.72 0.00 -1.26 -4.97 105.19 101.40 1h3g n GLY 564 Ca -0.31 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.25 1h3g n GLY 564 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h3g n ALA 565 N 1.00 1.29 0.06 4.61 0.00 0.45 -4.86 120.51 123.06 1h3g n ALA 565 Ca 0.00 0.33 -0.08 0.00 0.00 0.00 0.00 53.44 53.69 1h3g n ALA 565 Cb 0.05 -2.49 0.06 0.00 0.00 0.00 0.00 19.45 17.08 1h3g n ALA 565 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1h3g h PRO 566 N 8.24 0.36 -2.49 0.00 0.13 -1.89 -3.36 132.00 132.99 1h3g h PRO 566 Ca -0.47 -0.27 0.17 0.00 -0.87 0.00 0.00 66.00 64.56 1h3g h PRO 566 Cb 1.26 0.05 -0.04 0.00 0.13 0.00 0.00 31.00 32.40 1h3g h PRO 566 CO 0.93 0.90 0.59 -1.54 -0.23 0.00 0.00 178.00 178.66 1h3g s SER 567 N -6.94 -0.01 0.06 1.44 1.04 -1.26 0.14 113.70 108.17 1h3g s SER 567 Ca -0.05 -0.63 -0.27 0.00 0.48 0.00 0.00 55.95 55.48 1h3g s SER 567 Cb 0.11 0.48 0.09 0.00 0.10 0.00 0.00 66.02 66.80 1h3g s SER 567 CO 0.83 -0.95 0.79 -0.83 0.98 0.00 0.00 173.24 174.06 1h3g s GLY 568 N -3.38 -0.50 -0.06 7.32 0.00 -0.46 -4.88 107.32 105.35 1h3g s GLY 568 Ca 0.21 0.79 -0.19 0.00 0.00 0.00 0.00 44.72 45.53 1h3g s GLY 568 CO 0.05 0.26 0.54 0.14 0.00 0.00 0.00 173.10 174.09 1h3g s VAL 569 N -3.35 5.07 -0.48 1.40 1.01 -1.26 -0.30 120.40 122.49 1h3g s VAL 569 Ca 0.04 1.11 -0.29 0.00 0.00 0.00 0.00 61.98 62.84 1h3g s VAL 569 Cb -0.01 -3.88 0.03 0.00 0.00 0.00 0.00 36.38 32.52 1h3g s VAL 569 CO -0.10 0.37 1.17 -0.62 0.00 0.00 0.00 175.10 175.92 1h3g s ASP 570 N 0.25 6.59 0.51 3.32 2.15 0.98 -2.80 116.67 127.67 1h3g s ASP 570 Ca 0.29 0.46 0.27 0.00 0.43 0.00 0.00 52.55 54.00 1h3g s ASP 570 Cb -0.17 -2.55 1.37 0.00 -0.30 0.00 0.00 42.92 41.28 1h3g s ASP 570 CO 0.14 -1.29 1.91 0.15 -0.17 0.00 0.00 175.17 175.90 1h3g h PHE 571 N 9.39 0.12 -0.01 -5.34 3.57 -0.80 0.88 116.94 124.76 1h3g h PHE 571 Ca -0.24 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.26 1h3g h PHE 571 Cb 1.06 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.77 1h3g h PHE 571 CO 0.98 0.03 -0.02 -0.07 -2.23 0.00 0.00 178.31 177.01 1h3g h LEU 572 N 0.09 0.04 0.00 0.59 3.38 -1.91 -3.35 115.31 114.15 1h3g h LEU 572 Ca 0.40 -0.55 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1h3g h LEU 572 Cb 1.44 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.18 1h3g h LEU 572 CO -0.04 0.57 -1.06 -1.54 0.09 0.00 0.00 178.44 176.46 1h3g n SER 573 N -4.80 0.86 0.00 -0.43 3.41 -1.02 -4.96 113.62 106.68 1h3g n SER 573 Ca -0.08 -0.84 0.00 0.00 -0.26 0.00 0.00 58.87 57.68 1h3g n SER 573 Cb 0.29 1.12 0.00 0.00 -0.26 0.00 0.00 64.21 65.36 1h3g n SER 573 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1h3g n GLY 574 N 1.45 2.20 3.73 5.00 0.00 0.30 -4.98 105.19 112.89 1h3g n GLY 574 Ca 0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 1h3g n GLY 574 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h3g s LYS 575 N 0.00 2.45 0.01 1.61 1.02 -1.25 -4.56 119.74 119.02 1h3g s LYS 575 Ca 0.00 1.90 -0.23 0.00 0.02 0.00 0.00 55.97 57.66 1h3g s LYS 575 Cb 0.00 -1.85 -0.05 0.00 -0.52 0.00 0.00 37.83 35.40 1h3g s LYS 575 CO 0.00 -1.63 0.68 0.99 -0.92 0.00 0.00 175.35 174.47 1h3g s THR 576 N -1.67 4.85 -0.12 2.17 2.01 -1.26 -0.01 115.64 121.61 1h3g s THR 576 Ca 0.78 1.44 0.01 0.00 0.31 0.00 0.00 61.69 64.24 1h3g s THR 576 Cb -0.33 -4.03 -0.01 0.00 0.01 0.00 0.00 72.50 68.14 1h3g s THR 576 CO 0.41 0.37 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.85 1h3g s VAL 577 N 0.02 2.69 0.14 3.82 1.01 0.59 -4.91 120.40 123.76 1h3g s VAL 577 Ca 0.35 -0.79 -0.29 0.00 0.00 0.00 0.00 61.98 61.25 1h3g s VAL 577 Cb -0.19 -2.10 -0.07 0.00 0.00 0.00 0.00 36.38 34.02 1h3g s VAL 577 CO 0.20 0.54 0.94 -0.83 0.00 0.00 0.00 175.10 175.94 1h3g s GLY 578 N 0.35 3.01 0.00 4.51 0.00 -1.26 -1.36 107.32 112.57 1h3g s GLY 578 Ca -0.14 0.56 0.00 0.00 0.00 0.00 0.00 44.72 45.14 1h3g s GLY 578 CO 0.07 1.35 0.73 1.04 0.00 0.00 0.00 173.10 176.29 1h3g n LEU 579 N 2.45 1.28 0.18 0.66 4.77 0.36 -4.55 117.00 122.15 1h3g n LEU 579 Ca 0.01 -1.28 -0.14 0.00 -0.03 0.00 0.00 56.01 54.56 1h3g n LEU 579 Cb 0.49 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.50 1h3g n LEU 579 CO 0.50 0.32 0.78 1.23 -1.33 0.00 0.00 177.39 178.89 1h3g h GLY 580 N 0.00 -0.39 0.00 -0.72 0.00 -1.59 -3.41 103.07 96.96 1h3g h GLY 580 Ca 0.00 0.15 -0.05 0.00 0.00 0.00 0.00 47.33 47.42 1h3g h GLY 580 CO 0.00 -0.14 -1.19 -2.13 0.00 0.00 0.00 176.54 173.07 1h3g n ARG 581 N -5.25 0.08 -3.67 4.80 0.63 -1.26 -4.79 116.66 107.19 1h3g n ARG 581 Ca -0.10 0.02 -0.12 0.00 -0.92 0.00 0.00 57.85 56.74 1h3g n ARG 581 Cb 0.17 -0.90 -0.06 0.00 0.45 0.00 0.00 32.46 32.12 1h3g n ARG 581 CO 0.00 0.00 0.00 -1.83 -2.51 0.00 0.00 177.63 173.29 1h3g s GLU 582 N -2.07 0.93 -0.23 -0.14 -1.05 -1.26 -1.41 118.70 113.47 1h3g s GLU 582 Ca -0.05 -0.45 -0.05 0.00 -0.15 0.00 0.00 54.97 54.28 1h3g s GLU 582 Cb 0.01 0.41 -0.01 0.00 -0.44 0.00 0.00 34.13 34.10 1h3g s GLU 582 CO 0.07 -0.32 -0.01 -1.17 0.95 0.00 0.00 175.26 174.78 1h3g s LEU 583 N -2.15 3.08 -0.42 1.83 2.96 0.79 -4.55 118.68 120.23 1h3g s LEU 583 Ca -0.04 -0.34 -0.15 0.00 -0.22 0.00 0.00 54.13 53.38 1h3g s LEU 583 Cb -0.00 -1.80 0.02 0.00 0.50 0.00 0.00 46.19 44.91 1h3g s LEU 583 CO -0.04 -0.03 0.33 -0.60 -1.32 0.00 0.00 176.35 174.69 1h3g s ARG 584 N 1.52 2.99 -0.19 1.98 3.00 -1.26 -1.10 118.95 125.89 1h3g s ARG 584 Ca 0.06 -1.01 -0.08 0.00 -1.00 0.00 0.00 55.73 53.70 1h3g s ARG 584 Cb -0.15 -3.99 -0.04 0.00 0.00 0.00 0.00 34.95 30.77 1h3g s ARG 584 CO -0.01 -0.79 0.09 -0.51 0.00 0.00 0.00 175.30 174.08 1h3g s LEU 585 N 1.75 3.95 0.93 -0.88 1.43 -1.26 -5.02 118.68 119.57 1h3g s LEU 585 Ca 0.06 0.13 -0.12 0.00 -1.03 0.00 0.00 54.13 53.17 1h3g s LEU 585 Cb -0.19 -2.01 0.15 0.00 0.03 0.00 0.00 46.19 44.17 1h3g s LEU 585 CO 0.10 0.17 1.09 0.00 0.23 0.00 0.00 176.35 177.94 1h3g s ALA 586 N 0.41 1.31 0.33 4.21 0.00 -1.26 -4.42 121.76 122.33 1h3g s ALA 586 Ca 0.05 -0.07 -0.29 0.00 0.00 0.00 0.00 51.96 51.65 1h3g s ALA 586 Cb -0.12 -3.20 -0.11 0.00 0.00 0.00 0.00 23.12 19.69 1h3g s ALA 586 CO -0.00 -2.55 1.52 -2.14 0.00 0.00 0.00 175.76 172.59 1h3g s PRO 587 N -4.88 4.14 -1.50 0.00 0.02 -1.26 -2.81 135.00 128.71 1h3g s PRO 587 Ca 0.64 2.54 -0.13 0.00 0.02 0.00 0.00 61.00 64.07 1h3g s PRO 587 Cb -0.19 -3.01 0.08 0.00 0.02 0.00 0.00 34.50 31.41 1h3g s PRO 587 CO 0.58 -0.55 0.82 1.63 -0.33 0.00 0.00 177.00 179.14 1h3g n LYS 588 N 1.33 -4.73 -3.87 5.54 5.02 0.10 -4.90 118.16 116.65 1h3g n LYS 588 Ca 0.04 0.57 -0.22 0.00 -2.02 0.00 0.00 58.31 56.68 1h3g n LYS 588 Cb 0.39 -5.41 -0.05 0.00 -0.02 0.00 0.00 35.03 29.94 1h3g n LYS 588 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1h3g s SER 589 N -3.10 4.85 -0.06 4.39 1.04 -1.12 -4.70 113.70 115.00 1h3g s SER 589 Ca 0.58 -0.79 -0.06 0.00 0.48 0.00 0.00 55.95 56.17 1h3g s SER 589 Cb -0.30 -0.66 0.02 0.00 0.10 0.00 0.00 66.02 65.18 1h3g s SER 589 CO 0.72 -0.48 0.17 0.54 0.98 0.00 0.00 173.24 175.17 1h3g s VAL 590 N -2.46 0.01 0.02 5.02 0.11 -1.26 -0.42 120.40 121.41 1h3g s VAL 590 Ca 0.43 -0.04 0.05 0.00 -2.93 0.00 0.00 61.98 59.49 1h3g s VAL 590 Cb -0.02 -0.26 -0.02 0.00 -1.53 0.00 0.00 36.38 34.55 1h3g s VAL 590 CO 0.25 -0.02 -0.16 -0.69 -3.33 0.00 0.00 175.10 171.14 1h3g s VAL 591 N 0.00 1.30 -0.31 2.04 1.01 0.18 -4.96 120.40 119.66 1h3g s VAL 591 Ca -0.01 -0.94 0.01 0.00 0.00 0.00 0.00 61.98 61.05 1h3g s VAL 591 Cb -0.02 -1.13 0.09 0.00 0.00 0.00 0.00 36.38 35.32 1h3g s VAL 591 CO 0.00 0.18 0.05 -0.69 0.00 0.00 0.00 175.10 174.64 1h3g s VAL 592 N -0.67 1.56 -0.18 2.92 1.01 -1.26 -1.17 120.40 122.62 1h3g s VAL 592 Ca 0.05 -1.75 -0.07 0.00 0.00 0.00 0.00 61.98 60.21 1h3g s VAL 592 Cb -0.07 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.16 1h3g s VAL 592 CO 0.01 -0.54 0.05 -0.63 0.00 0.00 0.00 175.10 173.99 1h3g s ILE 593 N 1.29 4.66 -0.16 2.22 1.01 -1.26 -0.07 121.20 128.89 1h3g s ILE 593 Ca 0.07 -0.08 -0.08 0.00 0.00 0.00 0.00 60.65 60.57 1h3g s ILE 593 Cb -0.18 -3.09 -0.04 0.00 0.01 0.00 0.00 42.46 39.15 1h3g s ILE 593 CO -0.15 0.47 0.11 -1.61 0.00 0.00 0.00 174.94 173.76 1h3g s GLU 594 N 0.33 3.76 0.09 2.79 2.02 -1.12 -4.18 118.70 122.39 1h3g s GLU 594 Ca 0.02 -0.23 0.02 0.00 0.02 0.00 0.00 54.97 54.80 1h3g s GLU 594 Cb -0.13 -3.24 -0.04 0.00 0.10 0.00 0.00 34.13 30.83 1h3g s GLU 594 CO 0.01 0.51 -0.07 -0.51 0.02 0.00 0.00 175.26 175.22 1h3g s LEU 595 N -0.26 2.49 1.00 1.80 1.43 0.68 -4.06 118.68 121.76 1h3g s LEU 595 Ca 0.10 -0.97 -0.11 0.00 -1.03 0.00 0.00 54.13 52.12 1h3g s LEU 595 Cb -0.12 -0.08 0.19 0.00 0.03 0.00 0.00 46.19 46.22 1h3g s LEU 595 CO 0.01 -0.44 1.09 -2.84 0.23 0.00 0.00 176.35 174.39 1h3g s PRO 596 N -3.64 0.36 1.13 1.29 0.02 -1.26 -1.19 135.00 131.71 1h3g s PRO 596 Ca 0.10 1.11 -0.15 0.00 0.02 0.00 0.00 61.00 62.08 1h3g s PRO 596 Cb 0.04 -1.68 0.25 0.00 0.02 0.00 0.00 34.50 33.13 1h3g s PRO 596 CO -0.04 -2.94 1.07 0.20 -0.33 0.00 0.00 177.00 174.95 1h3g s GLY 597 N -2.79 1.55 1.14 0.52 0.00 -1.14 -3.65 107.32 102.94 1h3g s GLY 597 Ca 0.66 -0.52 -0.19 0.00 0.00 0.00 0.00 44.72 44.67 1h3g s GLY 597 CO 0.60 0.23 1.21 -2.27 0.00 0.00 0.00 173.10 172.87 1h3g s LEU 598 N -6.89 1.46 0.32 0.66 2.96 -1.25 -4.79 118.68 111.16 1h3g s LEU 598 Ca 0.68 0.38 0.17 0.00 -0.22 0.00 0.00 54.13 55.13 1h3g s LEU 598 Cb -0.17 -2.16 1.14 0.00 0.50 0.00 0.00 46.19 45.50 1h3g s LEU 598 CO 0.59 -3.71 1.42 -0.81 -1.32 0.00 0.00 176.35 172.51 1h3g n PRO 599 N -4.44 -0.06 0.00 0.98 -0.04 -1.26 -4.91 135.00 125.27 1h3g n PRO 599 Ca 0.16 1.25 0.00 0.00 -0.04 0.00 0.00 63.50 64.87 1h3g n PRO 599 Cb 0.60 -2.21 0.00 0.00 -0.04 0.00 0.00 33.50 31.84 1h3g n PRO 599 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85