#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wua n ASP 48 N 0.00 4.81 -4.58 1.61 -0.08 -1.26 -4.98 116.55 112.07 2wua n ASP 48 Ca 0.00 -2.94 -0.34 0.00 -1.51 0.00 0.00 54.79 50.00 2wua n ASP 48 Cb 0.00 -1.65 0.12 0.00 2.34 0.00 0.00 41.12 41.93 2wua n ASP 48 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 2wua n ASP 49 N 6.66 -0.20 -4.65 1.67 8.00 -1.26 -4.47 116.55 122.30 2wua n ASP 49 Ca 0.45 0.51 -0.41 0.00 0.71 0.00 0.00 54.79 56.05 2wua n ASP 49 Cb 0.42 -1.38 -0.04 0.00 -0.02 0.00 0.00 41.12 40.10 2wua n ASP 49 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2wua s VAL 50 N -2.21 4.87 0.29 2.53 1.01 -1.26 -0.44 120.40 125.19 2wua s VAL 50 Ca 0.67 1.55 0.10 0.00 0.00 0.00 0.00 61.98 64.30 2wua s VAL 50 Cb -0.28 -4.11 -0.05 0.00 0.00 0.00 0.00 36.38 31.95 2wua s VAL 50 CO 0.57 -0.01 -0.05 0.68 0.00 0.00 0.00 175.10 176.29 2wua s VAL 51 N 2.47 2.95 -0.20 2.92 -7.23 0.17 -1.31 120.40 120.18 2wua s VAL 51 Ca 0.35 -2.06 -0.05 0.00 -1.81 0.00 0.00 61.98 58.42 2wua s VAL 51 Cb -0.16 -2.69 -0.02 0.00 0.56 0.00 0.00 36.38 34.07 2wua s VAL 51 CO 0.10 -0.33 0.00 -0.63 -0.31 0.00 0.00 175.10 173.93 2wua s ILE 52 N -2.43 3.98 -0.43 -0.62 1.09 0.15 -1.74 121.20 121.20 2wua s ILE 52 Ca 0.32 -0.30 0.17 0.00 -1.10 0.00 0.00 60.65 59.74 2wua s ILE 52 Cb -0.04 -2.80 -0.23 0.00 -1.06 0.00 0.00 42.46 38.33 2wua s ILE 52 CO 0.18 0.43 0.56 1.33 -0.10 0.00 0.00 174.94 177.35 2wua n VAL 53 N 4.21 0.00 -3.57 2.92 0.24 -0.57 -0.50 118.33 121.05 2wua n VAL 53 Ca -0.17 -0.24 -0.15 0.00 -2.04 0.00 0.00 64.34 61.73 2wua n VAL 53 Cb 0.52 0.56 -0.06 0.00 -1.47 0.00 0.00 33.84 33.39 2wua n VAL 53 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2wua s ALA 54 N -2.91 -1.81 -0.20 2.33 0.00 -1.24 -4.59 121.76 113.34 2wua s ALA 54 Ca 0.00 1.64 -0.08 0.00 0.00 0.00 0.00 51.96 53.53 2wua s ALA 54 Cb 0.12 -0.60 0.09 0.00 0.00 0.00 0.00 23.12 22.72 2wua s ALA 54 CO 0.72 -0.34 0.43 0.00 0.00 0.00 0.00 175.76 176.56 2wua s ALA 55 N -0.53 -1.16 0.24 0.00 0.00 -1.26 -0.73 121.76 118.33 2wua s ALA 55 Ca -0.05 1.54 0.01 0.00 0.00 0.00 0.00 51.96 53.46 2wua s ALA 55 Cb -0.02 -1.26 -0.05 0.00 0.00 0.00 0.00 23.12 21.79 2wua s ALA 55 CO 0.05 -0.66 0.12 0.71 0.00 0.00 0.00 175.76 175.97 2wua s TYR 56 N 2.37 1.41 0.13 0.00 2.02 -0.21 -4.77 117.35 118.31 2wua s TYR 56 Ca -0.03 -1.28 -0.11 0.00 -0.37 0.00 0.00 57.07 55.28 2wua s TYR 56 Cb -0.11 -0.77 0.00 0.00 -0.40 0.00 0.00 41.96 40.68 2wua s TYR 56 CO -0.13 -0.47 0.28 -0.98 -1.57 0.00 0.00 175.55 172.68 2wua s ARG 57 N -4.05 1.03 0.76 -0.62 1.70 -0.02 -0.93 118.95 116.82 2wua s ARG 57 Ca 0.38 -0.99 -0.11 0.00 -0.47 0.00 0.00 55.73 54.54 2wua s ARG 57 Cb 0.07 0.39 0.06 0.00 -0.57 0.00 0.00 34.95 34.90 2wua s ARG 57 CO 0.14 -0.37 1.12 -1.54 -1.08 0.00 0.00 175.30 173.57 2wua s SER 58 N -2.89 4.85 0.69 -2.89 1.04 -0.23 -0.38 113.70 113.89 2wua s SER 58 Ca 0.09 0.84 -0.16 0.00 0.48 0.00 0.00 55.95 57.20 2wua s SER 58 Cb 0.03 -1.46 0.01 0.00 0.10 0.00 0.00 66.02 64.71 2wua s SER 58 CO -0.07 -1.67 1.22 -2.84 0.98 0.00 0.00 173.24 170.86 2wua s PRO 59 N -5.45 2.40 -0.18 4.02 0.02 -1.26 -4.70 135.00 129.84 2wua s PRO 59 Ca 0.60 1.82 -0.09 0.00 0.02 0.00 0.00 61.00 63.35 2wua s PRO 59 Cb -0.11 -1.86 -0.05 0.00 0.02 0.00 0.00 34.50 32.51 2wua s PRO 59 CO 0.49 -1.65 0.12 -0.51 -0.33 0.00 0.00 177.00 175.12 2wua s LEU 60 N -4.79 4.19 0.12 -5.54 1.43 -1.26 -4.63 118.68 108.20 2wua s LEU 60 Ca 0.76 0.27 0.07 0.00 -1.03 0.00 0.00 54.13 54.20 2wua s LEU 60 Cb -0.31 -2.07 -0.04 0.00 0.03 0.00 0.00 46.19 43.81 2wua s LEU 60 CO 0.42 0.24 -0.18 0.00 0.23 0.00 0.00 176.35 177.05 2wua s LYS 62 N -2.25 4.12 0.54 0.00 1.02 -1.26 -0.42 119.74 121.48 2wua s LYS 62 Ca 0.08 2.60 -0.22 0.00 0.02 0.00 0.00 55.97 58.46 2wua s LYS 62 Cb -0.08 -3.05 -0.05 0.00 -0.52 0.00 0.00 37.83 34.13 2wua s LYS 62 CO 0.04 -0.70 1.32 0.00 -0.92 0.00 0.00 175.35 175.09 2wua s ALA 63 N 0.61 2.81 0.00 5.17 0.00 -0.39 -0.57 121.76 129.39 2wua s ALA 63 Ca 0.69 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.92 2wua s ALA 63 Cb -0.49 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.09 2wua s ALA 63 CO 0.40 -1.28 0.00 1.63 0.00 0.00 0.00 175.76 176.51 2wua n LYS 64 N -1.01 0.00 -0.00 0.00 5.02 -1.26 -4.10 118.16 116.81 2wua n LYS 64 Ca 0.10 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 2wua n LYS 64 Cb 0.46 -0.11 -0.00 0.00 -0.02 0.00 0.00 35.03 35.35 2wua n LYS 64 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2wua n ARG 65 N 0.00 4.72 -0.93 1.97 1.74 -1.24 -4.90 116.66 118.02 2wua n ARG 65 Ca 0.00 -0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.97 2wua n ARG 65 Cb 0.00 -0.67 0.07 0.00 -1.02 0.00 0.00 32.46 30.84 2wua n ARG 65 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wua n GLY 66 N 1.48 -0.75 0.27 -0.13 0.00 0.27 -4.94 105.19 101.39 2wua n GLY 66 Ca 0.00 -1.77 0.15 0.00 0.00 0.00 0.00 46.02 44.41 2wua n GLY 66 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2wua h GLY 67 N -0.57 0.00 -2.66 -0.02 0.00 -1.90 -2.56 103.07 95.35 2wua h GLY 67 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.17 2wua h GLY 67 CO 0.13 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.71 2wua n LEU 68 N -3.26 3.94 0.29 3.11 4.77 -1.26 -4.60 117.00 119.99 2wua n LEU 68 Ca -0.00 -2.00 0.15 0.00 -0.03 0.00 0.00 56.01 54.12 2wua n LEU 68 Cb 0.29 -0.48 0.88 0.00 -2.33 0.00 0.00 43.42 41.78 2wua n LEU 68 CO 0.28 0.98 1.09 0.07 -1.33 0.00 0.00 177.39 178.48 2wua h LYS 69 N 4.23 0.00 -0.20 3.23 2.10 -1.75 -1.05 116.57 123.13 2wua h LYS 69 Ca 0.00 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.62 2wua h LYS 69 Cb 0.99 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.29 2wua h LYS 69 CO 0.00 0.03 -0.03 -0.25 -2.00 0.00 0.00 179.45 177.20 2wua n ASP 70 N -3.74 3.14 -4.49 7.07 8.00 -1.26 -4.93 116.55 120.34 2wua n ASP 70 Ca -0.03 -3.22 -0.34 0.00 0.71 0.00 0.00 54.79 51.91 2wua n ASP 70 Cb 0.13 -0.53 -0.12 0.00 -0.02 0.00 0.00 41.12 40.57 2wua n ASP 70 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2wua s THR 71 N -2.94 3.96 0.62 -3.53 2.01 -0.40 -4.75 115.64 110.61 2wua s THR 71 Ca 0.40 -0.33 -0.17 0.00 0.31 0.00 0.00 61.69 61.90 2wua s THR 71 Cb 0.34 -2.75 -0.02 0.00 0.01 0.00 0.00 72.50 70.08 2wua s THR 71 CO 0.05 0.47 1.15 -0.31 -0.69 0.00 0.00 174.62 175.29 2wua s TYR 72 N 0.55 2.51 0.24 4.92 2.02 -1.26 -4.88 117.35 121.45 2wua s TYR 72 Ca -0.02 1.55 -0.05 0.00 -0.37 0.00 0.00 57.07 58.18 2wua s TYR 72 Cb -0.14 -3.30 0.38 0.00 -0.40 0.00 0.00 41.96 38.50 2wua s TYR 72 CO 0.02 -1.87 1.82 -1.35 -1.57 0.00 0.00 175.55 172.60 2wua h PRO 73 N 0.47 0.80 -0.38 -1.71 0.11 -1.98 -1.60 132.00 127.71 2wua h PRO 73 Ca -0.48 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.57 2wua h PRO 73 Cb 1.27 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 2wua h PRO 73 CO 0.54 0.53 0.18 0.38 -0.21 0.00 0.00 178.00 179.43 2wua h ASP 74 N 0.82 0.46 1.08 -2.05 3.04 -1.92 -1.92 116.42 115.93 2wua h ASP 74 Ca 0.39 -0.03 0.00 0.00 -3.24 0.00 0.00 57.03 54.15 2wua h ASP 74 Cb 0.32 -0.12 0.00 0.00 -1.04 0.00 0.00 39.33 38.49 2wua h ASP 74 CO -0.23 0.39 0.00 0.47 -2.04 0.00 0.00 179.24 177.83 2wua n ASP 75 N -4.42 0.64 0.07 4.15 8.00 -0.62 -1.03 116.55 123.34 2wua n ASP 75 Ca 0.02 0.60 -0.21 0.00 0.71 0.00 0.00 54.79 55.91 2wua n ASP 75 Cb 0.11 -0.76 -0.14 0.00 -0.02 0.00 0.00 41.12 40.31 2wua n ASP 75 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 2wua h ILE 76 N 0.00 1.42 0.02 0.53 2.04 -1.10 -3.39 117.51 117.03 2wua h ILE 76 Ca 0.00 -2.51 -0.22 0.00 1.00 0.00 0.00 64.86 63.13 2wua h ILE 76 Cb 0.54 3.03 0.02 0.00 -0.74 0.00 0.00 36.82 39.68 2wua h ILE 76 CO 0.00 0.73 -0.88 0.25 0.00 0.00 0.00 178.15 178.25 2wua h LEU 77 N -0.14 0.74 -0.47 1.44 5.85 -1.34 -3.39 115.31 118.00 2wua h LEU 77 Ca -0.17 -0.77 0.09 0.00 0.84 0.00 0.00 57.88 57.87 2wua h LEU 77 Cb 1.76 -0.23 -0.07 0.00 0.37 0.00 0.00 40.66 42.49 2wua h LEU 77 CO 0.19 1.42 0.02 0.00 -0.34 0.00 0.00 178.44 179.73 2wua h ALA 78 N 0.34 0.46 -0.12 1.25 0.00 -1.27 -0.87 119.26 119.04 2wua h ALA 78 Ca -0.12 0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2wua h ALA 78 Cb 1.57 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.57 2wua h ALA 78 CO 0.17 -0.37 -0.06 -1.35 0.00 0.00 0.00 179.25 177.64 2wua h PRO 79 N 0.14 0.18 -0.09 0.00 0.11 -1.77 -0.45 132.00 130.12 2wua h PRO 79 Ca 0.24 -0.03 -0.21 0.00 0.11 0.00 0.00 66.00 66.11 2wua h PRO 79 Cb 0.34 -0.03 0.01 0.00 0.11 0.00 0.00 31.00 31.43 2wua h PRO 79 CO -0.37 0.25 -0.77 0.28 -0.21 0.00 0.00 178.00 177.18 2wua h VAL 80 N 0.18 1.31 -0.56 3.15 2.07 -1.38 -1.73 116.25 119.28 2wua h VAL 80 Ca 0.04 -2.02 0.00 0.00 0.82 0.00 0.00 66.70 65.55 2wua h VAL 80 Cb 0.22 2.19 -0.03 0.00 -1.52 0.00 0.00 31.29 32.15 2wua h VAL 80 CO 0.01 0.62 0.36 -0.07 0.02 0.00 0.00 177.57 178.51 2wua h LEU 81 N 0.35 0.65 -1.01 2.57 3.38 -1.04 -3.03 115.31 117.19 2wua h LEU 81 Ca -0.07 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.79 2wua h LEU 81 Cb 1.42 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.98 2wua h LEU 81 CO 0.16 0.49 -0.06 0.50 0.09 0.00 0.00 178.44 179.62 2wua h LYS 82 N 0.76 0.64 -0.09 1.13 3.64 -0.97 -2.55 116.57 119.12 2wua h LYS 82 Ca 0.20 -0.18 -0.03 0.00 -1.27 0.00 0.00 60.65 59.37 2wua h LYS 82 Cb -0.06 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 2wua h LYS 82 CO -0.04 0.71 -0.10 0.00 -2.27 0.00 0.00 179.45 177.74 2wua h ALA 83 N 1.34 1.67 -0.97 5.00 0.00 -1.19 0.29 119.26 125.40 2wua h ALA 83 Ca 0.11 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2wua h ALA 83 Cb 0.47 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.16 2wua h ALA 83 CO 0.02 0.24 0.61 -0.07 0.00 0.00 0.00 179.25 180.06 2wua h LEU 84 N 0.13 1.15 0.03 0.00 3.38 -1.42 -0.13 115.31 118.44 2wua h LEU 84 Ca 0.03 -0.05 -0.20 0.00 0.09 0.00 0.00 57.88 57.74 2wua h LEU 84 Cb 0.26 -0.29 0.02 0.00 0.09 0.00 0.00 40.66 40.74 2wua h LEU 84 CO 0.02 0.86 -0.81 0.40 0.09 0.00 0.00 178.44 179.00 2wua h ILE 85 N 1.33 1.38 -0.90 1.22 1.08 -1.31 -2.92 117.51 117.38 2wua h ILE 85 Ca 0.35 -2.20 0.04 0.00 -0.39 0.00 0.00 64.86 62.65 2wua h ILE 85 Cb -0.10 2.61 -0.05 0.00 -3.07 0.00 0.00 36.82 36.21 2wua h ILE 85 CO -0.07 0.65 0.58 -0.33 -0.69 0.00 0.00 178.15 178.30 2wua h GLU 86 N 0.04 1.10 -0.33 2.37 5.08 -0.85 0.28 114.58 122.27 2wua h GLU 86 Ca -0.11 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.15 2wua h GLU 86 Cb 1.51 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 2wua h GLU 86 CO 0.16 0.73 0.07 -0.22 -1.00 0.00 0.00 179.01 178.74 2wua h LYS 87 N 1.13 0.54 0.00 2.33 1.63 -1.06 -3.32 116.57 117.82 2wua h LYS 87 Ca 0.36 -0.14 0.00 0.00 -0.85 0.00 0.00 60.65 60.02 2wua h LYS 87 Cb 0.01 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 31.58 2wua h LYS 87 CO -0.12 0.61 -1.40 0.25 -3.45 0.00 0.00 179.45 175.34 2wua n THR 88 N -4.61 0.02 -2.49 1.00 -2.24 -1.11 -4.98 114.28 99.87 2wua n THR 88 Ca -0.02 -0.23 -0.15 0.00 -2.27 0.00 0.00 64.05 61.38 2wua n THR 88 Cb 0.21 0.50 -0.01 0.00 -2.10 0.00 0.00 70.33 68.93 2wua n THR 88 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2wua n ASN 89 N -1.86 -4.38 -4.83 3.42 3.02 0.95 -4.98 115.26 106.59 2wua n ASN 89 Ca 0.01 0.11 -0.31 0.00 -0.03 0.00 0.00 54.58 54.35 2wua n ASN 89 Cb 0.44 -3.69 0.02 0.00 -0.61 0.00 0.00 39.78 35.94 2wua n ASN 89 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2wua s ILE 90 N -2.73 4.25 0.02 2.41 -4.36 -1.26 -5.00 121.20 114.53 2wua s ILE 90 Ca 0.03 0.81 -0.30 0.00 -0.26 0.00 0.00 60.65 60.93 2wua s ILE 90 Cb -0.01 -3.57 -0.06 0.00 1.25 0.00 0.00 42.46 40.07 2wua s ILE 90 CO 0.03 -0.87 1.42 0.21 0.24 0.00 0.00 174.94 175.97 2wua s ASN 91 N -3.68 6.83 0.56 4.36 3.84 -1.26 -4.89 114.94 120.70 2wua s ASN 91 Ca 0.58 2.17 0.25 0.00 0.21 0.00 0.00 52.86 56.06 2wua s ASN 91 Cb -0.13 -2.56 1.55 0.00 -0.55 0.00 0.00 41.25 39.56 2wua s ASN 91 CO 0.49 -0.72 2.14 -0.65 -2.79 0.00 0.00 177.10 175.58 2wua h PRO 92 N 7.76 0.00 0.00 0.43 0.11 -1.94 -1.17 132.00 137.18 2wua h PRO 92 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 2wua h PRO 92 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2wua h PRO 92 CO 0.90 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.69 2wua h ALA 93 N 1.90 1.00 0.00 -0.75 0.00 -1.92 -2.42 119.26 117.07 2wua h ALA 93 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2wua h ALA 93 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2wua h ALA 93 CO -0.00 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.64 2wua n GLU 94 N -2.72 0.19 -2.29 0.00 1.02 -0.44 -4.78 120.64 111.61 2wua n GLU 94 Ca -0.01 0.26 -0.42 0.00 -0.02 0.00 0.00 57.16 56.97 2wua n GLU 94 Cb 0.14 -1.77 -0.03 0.00 -0.02 0.00 0.00 31.44 29.76 2wua n GLU 94 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2wua s VAL 95 N -3.15 3.80 -0.20 2.62 1.01 -0.91 -4.51 120.40 119.05 2wua s VAL 95 Ca 0.09 1.22 0.18 0.00 0.00 0.00 0.00 61.98 63.47 2wua s VAL 95 Cb 0.12 -3.78 0.05 0.00 0.00 0.00 0.00 36.38 32.77 2wua s VAL 95 CO 0.50 0.03 1.27 1.23 0.00 0.00 0.00 175.10 178.13 2wua h GLY 96 N 7.74 0.00 -4.11 4.51 0.00 -0.43 -3.44 103.07 107.34 2wua h GLY 96 Ca -0.39 0.00 0.04 0.00 0.00 0.00 0.00 47.33 46.99 2wua h GLY 96 CO 0.87 0.00 0.43 -0.35 0.00 0.00 0.00 176.54 177.49 2wua s ASP 97 N -6.11 -0.46 -0.25 0.19 2.15 -1.26 -4.53 116.67 106.41 2wua s ASP 97 Ca 0.02 0.42 0.03 0.00 0.43 0.00 0.00 52.55 53.44 2wua s ASP 97 Cb 0.08 0.39 0.06 0.00 -0.30 0.00 0.00 42.92 43.14 2wua s ASP 97 CO 0.76 -0.48 -0.12 -0.63 -0.17 0.00 0.00 175.17 174.53 2wua s ILE 98 N -1.52 2.10 -0.26 4.11 1.01 -0.57 -1.60 121.20 124.48 2wua s ILE 98 Ca -0.03 -1.52 -0.06 0.00 0.00 0.00 0.00 60.65 59.04 2wua s ILE 98 Cb -0.00 -2.19 -0.01 0.00 0.01 0.00 0.00 42.46 40.27 2wua s ILE 98 CO 0.02 0.03 0.04 -0.69 0.00 0.00 0.00 174.94 174.35 2wua s VAL 99 N 1.15 3.93 -0.23 2.92 1.01 -0.05 -1.35 120.40 127.77 2wua s VAL 99 Ca -0.07 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.47 2wua s VAL 99 Cb -0.19 -2.90 0.03 0.00 0.00 0.00 0.00 36.38 33.32 2wua s VAL 99 CO -0.06 0.27 -0.11 -0.69 0.00 0.00 0.00 175.10 174.51 2wua s VAL 100 N 1.54 2.48 0.07 2.92 1.01 -0.15 -0.15 120.40 128.12 2wua s VAL 100 Ca 0.05 -1.15 -0.31 0.00 0.00 0.00 0.00 61.98 60.57 2wua s VAL 100 Cb -0.16 -2.25 -0.07 0.00 0.00 0.00 0.00 36.38 33.91 2wua s VAL 100 CO 0.01 0.24 1.35 -0.83 0.00 0.00 0.00 175.10 175.88 2wua s GLY 101 N 1.26 2.03 -0.17 4.51 0.00 0.05 -1.67 107.32 113.34 2wua s GLY 101 Ca -0.01 1.00 -0.27 0.00 0.00 0.00 0.00 44.72 45.44 2wua s GLY 101 CO -0.07 2.32 0.69 -0.45 0.00 0.00 0.00 173.10 175.60 2wua s SER 102 N 1.30 -0.70 -0.05 1.64 0.15 -0.94 -1.04 113.70 114.06 2wua s SER 102 Ca 0.63 1.11 -0.01 0.00 0.70 0.00 0.00 55.95 58.38 2wua s SER 102 Cb -0.34 1.04 -0.03 0.00 -1.71 0.00 0.00 66.02 64.99 2wua s SER 102 CO 0.29 -0.41 -0.05 0.52 1.20 0.00 0.00 173.24 174.79 2wua n VAL 103 N 1.90 0.27 -0.03 4.45 0.31 -1.26 -4.48 118.33 119.48 2wua n VAL 103 Ca -0.16 -0.09 0.03 0.00 -0.01 0.00 0.00 64.34 64.11 2wua n VAL 103 Cb 0.56 -1.08 -0.15 0.00 -0.91 0.00 0.00 33.84 32.26 2wua n VAL 103 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2wua n LEU 104 N -2.91 0.10 -4.69 7.52 4.77 -1.26 -4.98 117.00 115.56 2wua n LEU 104 Ca -0.09 0.04 -0.31 0.00 -0.03 0.00 0.00 56.01 55.62 2wua n LEU 104 Cb 0.58 0.17 0.15 0.00 -2.33 0.00 0.00 43.42 41.99 2wua n LEU 104 CO 0.03 0.17 0.68 -0.83 -1.33 0.00 0.00 177.39 176.11 2wua s GLY 105 N -4.85 1.68 0.25 -0.72 0.00 -1.26 -4.85 107.32 97.57 2wua s GLY 105 Ca -0.08 0.52 -0.31 0.00 0.00 0.00 0.00 44.72 44.85 2wua s GLY 105 CO 0.87 0.92 1.45 0.00 0.00 0.00 0.00 173.10 176.35 2wua n ALA 106 N -4.10 1.46 0.32 3.20 0.00 -1.26 -4.89 120.51 115.24 2wua n ALA 106 Ca 0.11 0.40 -0.18 0.00 0.00 0.00 0.00 53.44 53.77 2wua n ALA 106 Cb 0.52 -2.32 -0.10 0.00 0.00 0.00 0.00 19.45 17.56 2wua n ALA 106 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2wua h GLY 107 N 4.38 -1.28 0.83 0.00 0.00 -1.96 -1.56 103.07 103.47 2wua h GLY 107 Ca -0.45 0.58 0.04 0.00 0.00 0.00 0.00 47.33 47.49 2wua h GLY 107 CO 0.77 -0.39 0.43 0.23 0.00 0.00 0.00 176.54 177.57 2wua h SER 108 N -1.04 0.69 -0.24 0.19 0.87 -2.00 -1.97 113.55 110.05 2wua h SER 108 Ca -0.07 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.49 2wua h SER 108 Cb 0.88 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.69 2wua h SER 108 CO -0.02 0.47 0.15 -0.61 -0.53 0.00 0.00 176.83 176.29 2wua h GLN 109 N 0.82 0.31 -0.58 2.24 4.15 -1.92 -1.77 115.11 118.36 2wua h GLN 109 Ca 0.29 -0.02 -0.06 0.00 0.77 0.00 0.00 58.65 59.63 2wua h GLN 109 Cb 0.06 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.65 2wua h GLN 109 CO -0.12 0.22 0.13 -0.09 -1.93 0.00 0.00 178.83 177.04 2wua h ARG 110 N 0.31 0.91 -0.43 1.69 9.65 -1.01 0.51 114.38 126.02 2wua h ARG 110 Ca 0.09 -0.20 -0.06 0.00 -1.10 0.00 0.00 59.98 58.71 2wua h ARG 110 Cb -0.02 -0.13 -0.02 0.00 -1.39 0.00 0.00 29.97 28.41 2wua h ARG 110 CO -0.02 0.82 0.01 0.00 2.80 0.00 0.00 179.97 183.59 2wua h ALA 111 N 1.27 1.22 -0.30 2.80 0.00 -1.12 -1.03 119.26 122.09 2wua h ALA 111 Ca 0.19 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 2wua h ALA 111 Cb 0.33 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2wua h ALA 111 CO 0.00 0.52 -0.07 1.03 0.00 0.00 0.00 179.25 180.73 2wua h SER 112 N 0.65 0.58 -0.91 0.00 0.87 -0.76 -2.31 113.55 111.68 2wua h SER 112 Ca 0.13 -0.36 0.10 0.00 -1.23 0.00 0.00 61.79 60.44 2wua h SER 112 Cb 0.39 -0.16 -0.07 0.00 -0.44 0.00 0.00 62.40 62.12 2wua h SER 112 CO 0.01 0.81 0.58 -0.33 -0.53 0.00 0.00 176.83 177.38 2wua h GLU 113 N 0.35 0.86 -0.47 2.24 5.08 -0.55 -0.58 114.58 121.51 2wua h GLU 113 Ca 0.08 -0.05 -0.12 0.00 -1.00 0.00 0.00 59.36 58.26 2wua h GLU 113 Cb 0.55 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 2wua h GLU 113 CO 0.03 0.57 -0.19 0.00 -1.00 0.00 0.00 179.01 178.42 2wua h ARG 115 N 0.81 0.37 -0.37 0.00 9.65 -0.82 -1.26 114.38 122.75 2wua h ARG 115 Ca 0.11 -0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.96 2wua h ARG 115 Cb 0.76 -0.08 -0.02 0.00 -1.39 0.00 0.00 29.97 29.24 2wua h ARG 115 CO 0.06 0.24 0.18 0.52 2.80 0.00 0.00 179.97 183.78 2wua h MET 116 N 0.38 0.52 -0.94 0.20 2.86 -0.95 -1.95 114.93 115.05 2wua h MET 116 Ca 0.20 -0.07 0.10 0.00 -2.06 0.00 0.00 59.70 57.87 2wua h MET 116 Cb 0.16 -0.10 -0.08 0.00 0.06 0.00 0.00 31.60 31.64 2wua h MET 116 CO -0.18 0.46 0.58 0.00 1.06 0.00 0.00 176.91 178.83 2wua h ALA 117 N 1.04 1.38 -0.59 6.32 0.00 -0.66 0.51 119.26 127.25 2wua h ALA 117 Ca 0.13 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 2wua h ALA 117 Cb 0.10 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2wua h ALA 117 CO -0.02 0.22 -0.03 0.00 0.00 0.00 0.00 179.25 179.41 2wua h ALA 118 N 1.50 0.82 -0.37 0.00 0.00 -0.95 -1.13 119.26 119.13 2wua h ALA 118 Ca 0.45 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2wua h ALA 118 Cb 0.40 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2wua h ALA 118 CO -0.25 0.67 0.23 0.74 0.00 0.00 0.00 179.25 180.65 2wua h PHE 119 N 0.96 0.49 -0.83 0.00 0.04 -0.63 -1.44 116.94 115.52 2wua h PHE 119 Ca 0.16 0.00 0.07 0.00 2.80 0.00 0.00 57.97 61.01 2wua h PHE 119 Cb 0.60 -0.16 -0.05 0.00 2.20 0.00 0.00 35.95 38.53 2wua h PHE 119 CO 0.04 0.34 0.54 1.88 -0.60 0.00 0.00 178.31 180.51 2wua h TYR 120 N 0.49 0.91 0.00 -0.55 0.05 -0.49 -1.88 116.97 115.50 2wua h TYR 120 Ca 0.13 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.94 2wua h TYR 120 Cb -0.01 -0.30 0.00 0.00 1.01 0.00 0.00 36.73 37.43 2wua h TYR 120 CO -0.04 0.46 0.00 0.00 -1.05 0.00 0.00 178.16 177.53 2wua n ALA 121 N -2.42 2.44 0.00 3.88 0.00 -0.47 -4.89 120.51 119.06 2wua n ALA 121 Ca 0.13 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2wua n ALA 121 Cb 0.24 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.22 2wua n ALA 121 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wua n GLY 122 N 1.20 1.05 3.76 0.00 0.00 -0.71 -4.61 105.19 105.89 2wua n GLY 122 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 2wua n GLY 122 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wua s PHE 123 N -2.00 3.76 0.80 1.61 0.08 -0.59 -4.89 117.98 116.76 2wua s PHE 123 Ca 0.00 1.82 -0.12 0.00 0.12 0.00 0.00 56.93 58.75 2wua s PHE 123 Cb 0.00 -3.03 0.07 0.00 -0.57 0.00 0.00 43.02 39.49 2wua s PHE 123 CO 0.00 0.10 1.13 -1.25 -0.10 0.00 0.00 175.22 175.09 2wua s PRO 124 N -1.60 2.05 0.30 0.24 0.04 -1.26 -4.39 135.00 130.38 2wua s PRO 124 Ca 0.46 0.39 0.24 0.00 0.04 0.00 0.00 61.00 62.13 2wua s PRO 124 Cb -0.25 -1.93 1.09 0.00 0.04 0.00 0.00 34.50 33.45 2wua s PRO 124 CO 0.31 -1.59 1.73 1.05 0.04 0.00 0.00 177.00 178.54 2wua h GLU 125 N -1.06 0.00 0.00 4.56 4.11 -1.99 -2.51 114.58 117.69 2wua h GLU 125 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 2wua h GLU 125 Cb 1.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 2wua h GLU 125 CO 0.63 0.00 0.00 1.79 0.07 0.00 0.00 179.01 181.50 2wua h THR 126 N 0.00 0.00 -3.34 -1.06 1.35 -1.98 -3.42 112.91 104.47 2wua h THR 126 Ca 0.00 -0.64 -0.60 0.00 -0.55 0.00 0.00 66.41 64.62 2wua h THR 126 Cb 0.27 1.60 -0.09 0.00 -1.73 0.00 0.00 68.15 68.20 2wua h THR 126 CO 0.00 0.00 0.47 -0.69 -0.25 0.00 0.00 175.52 175.05 2wua s VAL 127 N -3.32 4.80 0.54 6.82 1.01 -0.95 -5.04 120.40 124.26 2wua s VAL 127 Ca 0.06 1.45 -0.07 0.00 0.00 0.00 0.00 61.98 63.42 2wua s VAL 127 Cb 0.08 -4.15 -0.03 0.00 0.00 0.00 0.00 36.38 32.29 2wua s VAL 127 CO 0.58 -0.16 0.88 -2.16 0.00 0.00 0.00 175.10 174.24 2wua s PRO 128 N 2.93 3.43 0.08 2.72 0.05 -1.26 -4.93 135.00 138.02 2wua s PRO 128 Ca 0.35 0.31 0.02 0.00 0.05 0.00 0.00 61.00 61.73 2wua s PRO 128 Cb -0.15 -2.27 -0.04 0.00 0.05 0.00 0.00 34.50 32.09 2wua s PRO 128 CO 0.09 -0.40 -0.07 0.14 0.05 0.00 0.00 177.00 176.81 2wua s VAL 129 N -2.91 0.67 0.22 -0.36 -7.23 -1.26 -1.51 120.40 108.03 2wua s VAL 129 Ca 0.51 -1.63 -0.17 0.00 -1.81 0.00 0.00 61.98 58.88 2wua s VAL 129 Cb -0.11 -1.31 0.02 0.00 0.56 0.00 0.00 36.38 35.55 2wua s VAL 129 CO 0.47 -0.68 0.55 0.00 -0.31 0.00 0.00 175.10 175.13 2wua s ARG 130 N -3.00 1.50 0.31 4.82 1.70 -0.46 -4.94 118.95 118.88 2wua s ARG 130 Ca 0.04 -0.99 0.11 0.00 -0.47 0.00 0.00 55.73 54.42 2wua s ARG 130 Cb -0.01 0.52 -0.05 0.00 -0.57 0.00 0.00 34.95 34.84 2wua s ARG 130 CO -0.03 -0.64 -0.12 0.95 -1.08 0.00 0.00 175.30 174.38 2wua s THR 131 N -3.92 2.50 0.03 4.99 -4.23 -1.26 -0.98 115.64 112.78 2wua s THR 131 Ca 0.13 -2.25 0.01 0.00 -1.18 0.00 0.00 61.69 58.40 2wua s THR 131 Cb -0.02 -2.52 -0.02 0.00 1.34 0.00 0.00 72.50 71.28 2wua s THR 131 CO 0.02 -0.31 -0.04 0.68 -0.54 0.00 0.00 174.62 174.43 2wua s VAL 132 N -2.53 0.26 -0.19 2.29 -7.23 -0.67 -4.86 120.40 107.47 2wua s VAL 132 Ca 0.32 -1.11 -0.04 0.00 -1.81 0.00 0.00 61.98 59.34 2wua s VAL 132 Cb -0.02 -0.57 0.06 0.00 0.56 0.00 0.00 36.38 36.41 2wua s VAL 132 CO 0.16 -0.55 0.06 0.21 -0.31 0.00 0.00 175.10 174.68 2wua s ASN 133 N -1.74 2.76 -0.46 4.85 3.84 -1.26 -2.20 114.94 120.72 2wua s ASN 133 Ca -0.10 -0.79 0.08 0.00 0.21 0.00 0.00 52.86 52.26 2wua s ASN 133 Cb -0.07 -0.45 0.39 0.00 -0.55 0.00 0.00 41.25 40.56 2wua s ASN 133 CO -0.02 -0.33 0.98 -1.14 -2.79 0.00 0.00 177.10 173.79 2wua n ARG 134 N 5.14 2.65 0.00 0.43 0.63 -1.26 -5.00 116.66 119.24 2wua n ARG 134 Ca -0.08 -4.27 0.00 0.00 -0.92 0.00 0.00 57.85 52.58 2wua n ARG 134 Cb 0.47 -2.01 0.00 0.00 0.45 0.00 0.00 32.46 31.38 2wua n ARG 134 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 2wua n GLN 135 N -0.23 0.00 0.33 -0.14 1.13 -1.26 -1.67 117.38 115.54 2wua n GLN 135 Ca 0.30 0.00 0.22 0.00 -1.94 0.00 0.00 57.00 55.58 2wua n GLN 135 Cb 0.59 0.00 1.18 0.00 0.11 0.00 0.00 30.24 32.13 2wua n GLN 135 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2wua n SER 137 N -3.03 2.57 -0.32 0.00 3.41 -0.67 -4.45 113.62 111.13 2wua n SER 137 Ca -0.03 -1.86 0.04 0.00 -0.26 0.00 0.00 58.87 56.76 2wua n SER 137 Cb 0.07 -0.16 0.18 0.00 -0.26 0.00 0.00 64.21 64.05 2wua n SER 137 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2wua h SER 138 N 3.42 0.81 -0.44 4.04 0.02 -1.40 -0.09 113.55 119.91 2wua h SER 138 Ca 0.00 0.04 -0.06 0.00 -0.84 0.00 0.00 61.79 60.93 2wua h SER 138 Cb 0.75 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.14 2wua h SER 138 CO 0.00 0.47 0.08 1.23 -1.14 0.00 0.00 176.83 177.47 2wua h GLY 139 N 0.92 0.86 1.37 -3.77 0.00 -1.55 -1.10 103.07 99.80 2wua h GLY 139 Ca 0.43 -0.52 -0.24 0.00 0.00 0.00 0.00 47.33 46.99 2wua h GLY 139 CO -0.23 0.49 -0.97 -2.00 0.00 0.00 0.00 176.54 173.83 2wua h LEU 140 N 0.76 0.73 -1.04 3.11 5.85 -1.34 -3.09 115.31 120.30 2wua h LEU 140 Ca 0.16 -0.57 0.09 0.00 0.84 0.00 0.00 57.88 58.40 2wua h LEU 140 Cb 0.35 -0.22 -0.07 0.00 0.37 0.00 0.00 40.66 41.08 2wua h LEU 140 CO 0.01 1.37 0.63 -0.61 -0.34 0.00 0.00 178.44 179.50 2wua h GLN 141 N 0.33 1.03 -0.67 1.25 5.75 -0.77 -0.57 115.11 121.45 2wua h GLN 141 Ca -0.10 -0.06 -0.06 0.00 -0.15 0.00 0.00 58.65 58.28 2wua h GLN 141 Cb 1.61 -0.23 -0.03 0.00 1.07 0.00 0.00 27.48 29.89 2wua h GLN 141 CO 0.18 0.68 0.20 0.00 -2.65 0.00 0.00 178.83 177.24 2wua h ALA 142 N 1.51 1.08 -0.41 3.38 0.00 -1.14 0.74 119.26 124.40 2wua h ALA 142 Ca 0.46 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 2wua h ALA 142 Cb 0.34 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2wua h ALA 142 CO -0.21 0.62 0.11 0.28 0.00 0.00 0.00 179.25 180.06 2wua h VAL 143 N 1.00 1.22 -0.45 0.00 2.07 -1.26 -1.97 116.25 116.87 2wua h VAL 143 Ca 0.22 -0.75 -0.04 0.00 0.82 0.00 0.00 66.70 66.94 2wua h VAL 143 Cb 0.30 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 30.99 2wua h VAL 143 CO -0.01 0.27 0.10 0.00 0.02 0.00 0.00 177.57 177.95 2wua h ALA 144 N 0.97 1.34 -0.50 1.67 0.00 -0.67 -1.78 119.26 120.29 2wua h ALA 144 Ca 0.13 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 2wua h ALA 144 Cb 0.29 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2wua h ALA 144 CO -0.00 0.47 -0.10 -0.44 0.00 0.00 0.00 179.25 179.18 2wua h ASP 145 N 0.66 0.95 -0.43 0.00 3.32 -0.63 0.11 116.42 120.40 2wua h ASP 145 Ca 0.15 -0.35 -0.03 0.00 0.02 0.00 0.00 57.03 56.82 2wua h ASP 145 Cb 0.26 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 2wua h ASP 145 CO -0.00 1.08 0.15 0.58 -1.72 0.00 0.00 179.24 179.33 2wua h VAL 146 N 0.80 1.21 -0.61 -1.35 2.07 -1.14 -0.48 116.25 116.76 2wua h VAL 146 Ca 0.13 -0.68 0.00 0.00 0.82 0.00 0.00 66.70 66.97 2wua h VAL 146 Cb 0.65 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 2wua h VAL 146 CO 0.05 0.25 0.39 0.00 0.02 0.00 0.00 177.57 178.27 2wua h ALA 147 N 1.00 0.78 -0.61 1.67 0.00 -1.05 -0.26 119.26 120.79 2wua h ALA 147 Ca 0.14 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2wua h ALA 147 Cb 0.23 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2wua h ALA 147 CO -0.01 0.23 0.35 0.00 0.00 0.00 0.00 179.25 179.82 2wua h ALA 148 N 1.21 0.78 -0.55 0.00 0.00 -0.65 -0.62 119.26 119.43 2wua h ALA 148 Ca 0.22 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 2wua h ALA 148 Cb -0.07 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 2wua h ALA 148 CO -0.05 0.28 0.14 0.00 0.00 0.00 0.00 179.25 179.62 2wua h ALA 149 N 1.17 0.73 -0.41 0.00 0.00 -0.56 -0.09 119.26 120.10 2wua h ALA 149 Ca 0.22 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 2wua h ALA 149 Cb 0.02 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2wua h ALA 149 CO -0.04 0.43 -0.03 0.82 0.00 0.00 0.00 179.25 180.43 2wua h ILE 150 N 0.79 1.27 -0.30 0.00 2.04 -0.81 -0.59 117.51 119.91 2wua h ILE 150 Ca 0.17 -1.07 -0.01 0.00 1.00 0.00 0.00 64.86 64.94 2wua h ILE 150 Cb 0.34 1.14 -0.02 0.00 -0.74 0.00 0.00 36.82 37.55 2wua h ILE 150 CO 0.00 0.36 0.12 0.11 0.00 0.00 0.00 178.15 178.74 2wua h LYS 151 N 0.57 0.41 -0.00 2.37 1.57 -0.84 -2.05 116.57 118.60 2wua h LYS 151 Ca 0.11 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2wua h LYS 151 Cb 0.53 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.75 2wua h LYS 151 CO 0.03 0.34 -0.02 0.00 -0.57 0.00 0.00 179.45 179.23 2wua n ALA 152 N -2.49 2.58 -1.00 3.86 0.00 -0.07 -4.89 120.51 118.50 2wua n ALA 152 Ca 0.01 -0.18 -0.00 0.00 0.00 0.00 0.00 53.44 53.27 2wua n ALA 152 Cb 0.13 -1.46 -0.00 0.00 0.00 0.00 0.00 19.45 18.12 2wua n ALA 152 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wua n GLY 153 N 1.23 0.45 0.28 0.00 0.00 -0.77 -4.94 105.19 101.44 2wua n GLY 153 Ca 0.16 -0.46 -0.03 0.00 0.00 0.00 0.00 46.02 45.69 2wua n GLY 153 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2wua h PHE 154 N 0.00 0.73 -2.15 1.61 -1.00 -1.33 -3.47 116.94 111.33 2wua h PHE 154 Ca -0.00 -0.09 0.21 0.00 2.81 0.00 0.00 57.97 60.90 2wua h PHE 154 Cb 0.01 -0.20 -0.08 0.00 3.61 0.00 0.00 35.95 39.29 2wua h PHE 154 CO 0.01 0.69 0.59 1.52 -1.61 0.00 0.00 178.31 179.51 2wua s TYR 155 N -4.97 -0.07 -0.05 -0.55 -0.85 -1.25 -5.04 117.35 104.56 2wua s TYR 155 Ca -0.09 -0.19 0.18 0.00 -0.52 0.00 0.00 57.07 56.45 2wua s TYR 155 Cb 0.15 0.63 -0.27 0.00 0.38 0.00 0.00 41.96 42.84 2wua s TYR 155 CO 0.79 -0.70 0.34 -0.25 -1.52 0.00 0.00 175.55 174.22 2wua n ASP 156 N -0.60 0.82 -3.81 -0.18 8.00 -1.26 -4.19 116.55 115.33 2wua n ASP 156 Ca -0.06 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.31 2wua n ASP 156 Cb 0.61 1.68 -0.15 0.00 -0.02 0.00 0.00 41.12 43.25 2wua n ASP 156 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2wua s ILE 157 N -3.13 -0.03 0.27 0.53 1.01 -1.26 -2.34 121.20 116.26 2wua s ILE 157 Ca -0.07 0.11 -0.14 0.00 0.00 0.00 0.00 60.65 60.54 2wua s ILE 157 Cb 0.11 -0.09 0.01 0.00 0.01 0.00 0.00 42.46 42.49 2wua s ILE 157 CO 0.75 0.04 0.57 -0.83 0.00 0.00 0.00 174.94 175.47 2wua s GLY 158 N 0.59 0.42 -0.12 6.18 0.00 -0.43 0.33 107.32 114.29 2wua s GLY 158 Ca -0.05 -0.76 0.03 0.00 0.00 0.00 0.00 44.72 43.94 2wua s GLY 158 CO -0.02 -0.48 -0.22 -0.42 0.00 0.00 0.00 173.10 171.96 2wua s ILE 159 N -3.78 1.99 -0.18 0.90 1.01 -0.63 -0.90 121.20 119.62 2wua s ILE 159 Ca 0.19 -0.95 -0.05 0.00 0.00 0.00 0.00 60.65 59.84 2wua s ILE 159 Cb -0.02 -1.76 -0.03 0.00 0.01 0.00 0.00 42.46 40.66 2wua s ILE 159 CO 0.10 0.54 -0.00 -0.83 0.00 0.00 0.00 174.94 174.74 2wua s GLY 160 N 0.70 1.74 0.31 6.18 0.00 -0.38 -0.87 107.32 115.00 2wua s GLY 160 Ca -0.10 -0.90 0.04 0.00 0.00 0.00 0.00 44.72 43.76 2wua s GLY 160 CO 0.01 0.12 0.21 0.00 0.00 0.00 0.00 173.10 173.44 2wua s ALA 161 N 0.72 1.84 -0.06 3.20 0.00 0.79 -0.13 121.76 128.12 2wua s ALA 161 Ca -0.00 -1.86 -0.18 0.00 0.00 0.00 0.00 51.96 49.92 2wua s ALA 161 Cb -0.14 1.33 0.04 0.00 0.00 0.00 0.00 23.12 24.34 2wua s ALA 161 CO 0.02 -0.59 0.41 0.20 0.00 0.00 0.00 175.76 175.81 2wua s GLY 162 N -3.35 -0.28 -0.15 0.00 0.00 0.37 -0.77 107.32 103.14 2wua s GLY 162 Ca 0.38 0.73 -0.10 0.00 0.00 0.00 0.00 44.72 45.73 2wua s GLY 162 CO 0.21 0.50 0.37 -2.27 0.00 0.00 0.00 173.10 171.91 2wua s LEU 163 N -0.95 0.26 -0.12 0.66 2.96 -0.21 -1.03 118.68 120.26 2wua s LEU 163 Ca -0.10 0.78 -0.08 0.00 -0.22 0.00 0.00 54.13 54.51 2wua s LEU 163 Cb -0.04 1.23 0.04 0.00 0.50 0.00 0.00 46.19 47.92 2wua s LEU 163 CO 0.05 -0.16 0.29 -0.70 -1.32 0.00 0.00 176.35 174.50 2wua s GLU 164 N 0.89 0.29 -0.47 1.98 2.56 -0.70 -4.17 118.70 119.08 2wua s GLU 164 Ca -0.06 0.51 0.01 0.00 0.00 0.00 0.00 54.97 55.44 2wua s GLU 164 Cb -0.06 0.02 0.12 0.00 2.00 0.00 0.00 34.13 36.21 2wua s GLU 164 CO -0.07 -0.11 0.23 0.45 -0.56 0.00 0.00 175.26 175.20 2wua s SER 165 N 0.78 4.83 0.07 -1.70 0.15 -1.26 -1.39 113.70 115.17 2wua s SER 165 Ca -0.05 -2.54 0.20 0.00 0.70 0.00 0.00 55.95 54.26 2wua s SER 165 Cb -0.06 -1.72 0.84 0.00 -1.71 0.00 0.00 66.02 63.37 2wua s SER 165 CO -0.05 -0.37 1.64 0.23 1.20 0.00 0.00 173.24 175.89 2wua n MET 166 N 3.81 0.06 -0.01 5.44 0.00 -1.18 -1.81 117.12 123.43 2wua n MET 166 Ca 0.04 0.23 -0.13 0.00 0.00 0.00 0.00 57.70 57.84 2wua n MET 166 Cb 0.38 -1.60 -0.09 0.00 0.00 0.00 0.00 33.22 31.91 2wua n MET 166 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 175.97 177.12 2wua h THR 167 N 0.00 1.33 -0.01 2.03 2.02 -1.92 -3.35 112.91 113.01 2wua h THR 167 Ca 0.00 -1.00 -0.18 0.00 0.77 0.00 0.00 66.41 66.00 2wua h THR 167 Cb 0.37 1.97 -0.01 0.00 -1.74 0.00 0.00 68.15 68.73 2wua h THR 167 CO 0.00 0.26 -0.80 0.00 0.37 0.00 0.00 175.52 175.36 2wua h ALA 168 N 0.59 0.63 -3.31 6.16 0.00 -1.79 -3.43 119.26 118.11 2wua h ALA 168 Ca 0.00 -0.68 -0.62 0.00 0.00 0.00 0.00 54.91 53.61 2wua h ALA 168 Cb 0.43 -0.08 -0.40 0.00 0.00 0.00 0.00 17.79 17.74 2wua h ALA 168 CO 0.00 0.88 -0.71 -0.80 0.00 0.00 0.00 179.25 178.62 2wua s ASN 169 N -6.90 4.20 0.60 0.00 0.02 -0.75 -5.09 114.94 107.01 2wua s ASN 169 Ca -0.03 -2.35 -0.19 0.00 -1.02 0.00 0.00 52.86 49.27 2wua s ASN 169 Cb 0.11 -1.30 -0.03 0.00 0.02 0.00 0.00 41.25 40.05 2wua s ASN 169 CO 0.81 -0.33 1.21 -2.84 0.02 0.00 0.00 177.10 175.98 2wua s PRO 170 N 0.66 2.92 0.08 -0.60 0.02 -1.26 -4.69 135.00 132.13 2wua s PRO 170 Ca 0.14 1.83 -0.31 0.00 0.02 0.00 0.00 61.00 62.68 2wua s PRO 170 Cb -0.22 -1.92 -0.07 0.00 0.02 0.00 0.00 34.50 32.31 2wua s PRO 170 CO -0.08 -1.25 1.34 1.41 -0.33 0.00 0.00 177.00 178.09 2wua s MET 171 N -3.37 4.34 -0.17 5.54 -2.45 -1.26 -4.95 119.30 116.99 2wua s MET 171 Ca 0.77 1.97 -0.28 0.00 -1.25 0.00 0.00 55.69 56.91 2wua s MET 171 Cb -0.31 -3.32 0.09 0.00 1.25 0.00 0.00 34.83 32.54 2wua s MET 171 CO 0.34 -0.41 0.79 0.00 1.05 0.00 0.00 175.02 176.79 2wua s ALA 172 N 1.29 -1.82 -0.17 4.11 0.00 -1.26 -5.15 121.76 118.75 2wua s ALA 172 Ca 0.63 1.67 -0.06 0.00 0.00 0.00 0.00 51.96 54.20 2wua s ALA 172 Cb -0.34 -0.68 -0.04 0.00 0.00 0.00 0.00 23.12 22.06 2wua s ALA 172 CO 0.29 -0.33 0.02 -0.46 0.00 0.00 0.00 175.76 175.28 2wua s TRP 173 N -0.47 3.16 -0.33 0.00 -0.11 -1.26 -5.08 118.94 114.84 2wua s TRP 173 Ca -0.04 -0.09 -0.16 0.00 1.22 0.00 0.00 56.10 57.03 2wua s TRP 173 Cb -0.02 -2.04 -0.01 0.00 -1.50 0.00 0.00 33.47 29.90 2wua s TRP 173 CO 0.04 0.06 0.39 -2.00 -4.62 0.00 0.00 176.95 170.82 2wua s GLU 174 N 0.40 3.64 0.46 5.86 2.56 -1.26 -4.98 118.70 125.39 2wua s GLU 174 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.97 54.67 2wua s GLU 174 Cb -0.13 -3.78 0.00 0.00 2.00 0.00 0.00 34.13 32.22 2wua s GLU 174 CO 0.01 -0.51 0.00 0.41 -0.56 0.00 0.00 175.26 174.62 2wua n GLY 175 N 4.89 -2.10 3.91 -1.50 0.00 -1.26 -4.97 105.19 104.17 2wua n GLY 175 Ca -0.08 -1.73 -0.27 0.00 0.00 0.00 0.00 46.02 43.93 2wua n GLY 175 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wua s SER 176 N -3.59 5.28 -0.07 1.61 1.04 -1.26 -5.05 113.70 111.66 2wua s SER 176 Ca 0.00 0.75 -0.19 0.00 0.48 0.00 0.00 55.95 57.00 2wua s SER 176 Cb 0.00 -1.58 -0.05 0.00 0.10 0.00 0.00 66.02 64.50 2wua s SER 176 CO 0.00 -1.33 0.52 -0.69 0.98 0.00 0.00 173.24 172.72 2wua s VAL 177 N -3.19 5.08 -0.24 5.02 1.01 -1.26 -5.01 120.40 121.82 2wua s VAL 177 Ca 0.57 1.05 -0.37 0.00 0.00 0.00 0.00 61.98 63.23 2wua s VAL 177 Cb -0.11 -3.85 -0.14 0.00 0.00 0.00 0.00 36.38 32.29 2wua s VAL 177 CO 0.47 0.38 1.88 -3.20 0.00 0.00 0.00 175.10 174.62 2wua n ASN 178 N 3.17 2.68 0.29 3.32 2.85 -1.26 -4.79 115.26 121.51 2wua n ASN 178 Ca -0.08 0.92 0.18 0.00 -0.11 0.00 0.00 54.58 55.49 2wua n ASN 178 Cb 0.51 -1.23 0.94 0.00 1.24 0.00 0.00 39.78 41.24 2wua n ASN 178 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2wua h PRO 179 N 8.82 0.00 -0.10 1.20 0.13 -2.04 -1.59 132.00 138.42 2wua h PRO 179 Ca -0.43 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.72 2wua h PRO 179 Cb 1.30 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.43 2wua h PRO 179 CO 0.97 0.00 0.19 -0.22 -0.23 0.00 0.00 178.00 178.71 2wua h LYS 180 N 0.00 0.00 0.00 0.86 3.64 -2.02 -1.61 116.57 117.44 2wua h LYS 180 Ca 0.00 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 2wua h LYS 180 Cb 0.21 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.03 2wua h LYS 180 CO 0.00 0.00 -0.09 -0.39 -2.27 0.00 0.00 179.45 176.70 2wua h VAL 181 N 0.00 0.93 0.00 2.00 -1.51 -1.61 -0.70 116.25 115.35 2wua h VAL 181 Ca 0.05 -0.33 0.00 0.00 -1.23 0.00 0.00 66.70 65.18 2wua h VAL 181 Cb 0.43 1.19 0.00 0.00 -2.13 0.00 0.00 31.29 30.77 2wua h VAL 181 CO -0.00 0.09 0.00 0.29 -1.23 0.00 0.00 177.57 176.72 2wua n LYS 182 N -4.23 0.13 0.00 5.19 5.02 -0.60 -2.56 118.16 121.11 2wua n LYS 182 Ca -0.03 0.17 0.10 0.00 -2.02 0.00 0.00 58.31 56.53 2wua n LYS 182 Cb 0.17 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.58 2wua n LYS 182 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2wua n THR 183 N -1.38 0.00 -3.44 -0.18 -2.24 -0.27 -4.87 114.28 101.89 2wua n THR 183 Ca 0.06 -0.06 -0.16 0.00 -2.27 0.00 0.00 64.05 61.62 2wua n THR 183 Cb 0.16 1.04 -0.11 0.00 -2.10 0.00 0.00 70.33 69.32 2wua n THR 183 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 2wua s MET 184 N -2.83 0.25 0.29 -0.78 -2.45 -1.06 -5.04 119.30 107.68 2wua s MET 184 Ca 0.09 0.20 0.01 0.00 -1.25 0.00 0.00 55.69 54.74 2wua s MET 184 Cb 0.16 -0.95 0.55 0.00 1.25 0.00 0.00 34.83 35.84 2wua s MET 184 CO 0.79 -0.73 1.86 0.00 1.05 0.00 0.00 175.02 177.98 2wua h ALA 185 N 8.28 1.52 -0.66 4.11 0.00 -1.90 -1.48 119.26 129.13 2wua h ALA 185 Ca -0.17 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 2wua h ALA 185 Cb 1.14 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 2wua h ALA 185 CO 0.29 0.26 0.15 1.96 0.00 0.00 0.00 179.25 181.92 2wua h GLN 186 N 1.01 1.05 -0.13 0.00 4.20 -1.96 0.67 115.11 119.96 2wua h GLN 186 Ca 0.47 -0.25 -0.01 0.00 0.06 0.00 0.00 58.65 58.93 2wua h GLN 186 Cb 0.41 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.05 2wua h GLN 186 CO -0.23 0.93 0.05 0.00 -0.67 0.00 0.00 178.83 178.91 2wua h ALA 187 N 1.16 0.16 -0.87 3.87 0.00 -1.60 -2.72 119.26 119.26 2wua h ALA 187 Ca 0.21 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2wua h ALA 187 Cb 0.36 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 2wua h ALA 187 CO 0.00 -0.25 0.47 0.37 0.00 0.00 0.00 179.25 179.84 2wua h GLN 188 N 0.04 1.22 0.00 0.00 4.15 -1.18 -2.20 115.11 117.15 2wua h GLN 188 Ca 0.04 -0.15 -0.00 0.00 0.77 0.00 0.00 58.65 59.31 2wua h GLN 188 Cb 0.17 -0.24 -0.00 0.00 0.21 0.00 0.00 27.48 27.63 2wua h GLN 188 CO -0.00 0.90 -0.02 -0.44 -1.93 0.00 0.00 178.83 177.34 2wua h ASP 189 N 1.23 0.00 -0.01 -0.69 3.32 -0.71 -0.53 116.42 119.03 2wua h ASP 189 Ca 0.31 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.36 2wua h ASP 189 Cb 0.04 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.59 2wua h ASP 189 CO -0.05 0.02 0.01 0.00 -1.72 0.00 0.00 179.24 177.50 2wua n LEU 191 N -3.66 2.53 -4.77 0.00 4.77 -0.21 -4.58 117.00 111.09 2wua n LEU 191 Ca -0.03 -0.88 -0.41 0.00 -0.03 0.00 0.00 56.01 54.66 2wua n LEU 191 Cb 0.09 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.14 2wua n LEU 191 CO 0.26 0.44 1.13 -0.76 -1.33 0.00 0.00 177.39 177.13 2wua s LEU 192 N -1.92 4.35 0.37 2.23 1.43 -0.87 -4.94 118.68 119.32 2wua s LEU 192 Ca 0.32 2.92 -0.27 0.00 -1.03 0.00 0.00 54.13 56.08 2wua s LEU 192 Cb 0.20 -3.65 -0.11 0.00 0.03 0.00 0.00 46.19 42.66 2wua s LEU 192 CO 0.31 -0.81 1.26 -2.65 0.23 0.00 0.00 176.35 174.69 2wua n PRO 193 N 1.12 1.99 -0.15 1.29 -0.02 -1.26 -4.86 135.00 133.11 2wua n PRO 193 Ca 0.03 0.70 0.06 0.00 -2.02 0.00 0.00 63.50 62.27 2wua n PRO 193 Cb 0.39 -2.31 0.37 0.00 -0.02 0.00 0.00 33.50 31.93 2wua n PRO 193 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 2wua h MET 194 N 2.31 0.69 -0.15 -0.52 2.86 -1.98 -1.22 114.93 116.92 2wua h MET 194 Ca -0.46 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.10 2wua h MET 194 Cb 1.29 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.79 2wua h MET 194 CO 0.61 0.46 -0.05 0.78 1.06 0.00 0.00 176.91 179.77 2wua h GLY 195 N 0.71 0.24 1.11 8.32 0.00 -2.00 -1.47 103.07 109.98 2wua h GLY 195 Ca 0.28 -0.12 -0.13 0.00 0.00 0.00 0.00 47.33 47.36 2wua h GLY 195 CO -0.09 0.12 -0.21 -2.22 0.00 0.00 0.00 176.54 174.14 2wua h ILE 196 N 0.22 1.27 0.00 2.60 1.08 -1.58 -2.25 117.51 118.85 2wua h ILE 196 Ca 0.05 -1.37 -0.03 0.00 -0.39 0.00 0.00 64.86 63.12 2wua h ILE 196 Cb 0.24 1.12 -0.00 0.00 -3.07 0.00 0.00 36.82 35.10 2wua h ILE 196 CO 0.01 0.48 -0.14 0.71 -0.69 0.00 0.00 178.15 178.51 2wua h THR 197 N 0.86 0.99 -0.06 -0.27 1.35 -1.07 -0.83 112.91 113.88 2wua h THR 197 Ca 0.11 -0.51 -0.01 0.00 -0.55 0.00 0.00 66.41 65.46 2wua h THR 197 Cb 0.79 1.28 -0.00 0.00 -1.73 0.00 0.00 68.15 68.49 2wua h THR 197 CO 0.07 0.14 0.00 -1.28 -0.25 0.00 0.00 175.52 174.20 2wua h SER 198 N 0.00 0.10 -0.86 5.36 0.87 -0.94 -1.98 113.55 116.10 2wua h SER 198 Ca -0.00 -0.29 0.01 0.00 -1.23 0.00 0.00 61.79 60.28 2wua h SER 198 Cb 0.27 -0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 62.16 2wua h SER 198 CO 0.02 0.36 0.57 -0.33 -0.53 0.00 0.00 176.83 176.92 2wua h GLU 199 N -0.16 1.14 -0.64 2.24 4.39 -0.85 -1.04 114.58 119.64 2wua h GLU 199 Ca 0.02 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.65 2wua h GLU 199 Cb 0.31 -0.26 -0.03 0.00 -0.10 0.00 0.00 28.75 28.67 2wua h GLU 199 CO 0.00 0.75 0.41 -0.91 -1.16 0.00 0.00 179.01 178.10 2wua h ASN 200 N 1.17 0.76 -0.39 1.42 2.35 -1.01 -0.46 115.58 119.41 2wua h ASN 200 Ca 0.32 -0.04 -0.06 0.00 -0.55 0.00 0.00 56.30 55.97 2wua h ASN 200 Cb -0.14 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.03 2wua h ASN 200 CO -0.07 0.57 0.01 0.58 -1.65 0.00 0.00 177.43 176.87 2wua h VAL 201 N 0.87 1.26 -0.66 2.81 2.07 -0.84 -1.15 116.25 120.61 2wua h VAL 201 Ca 0.23 -0.98 -0.05 0.00 0.82 0.00 0.00 66.70 66.73 2wua h VAL 201 Cb -0.06 1.13 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 2wua h VAL 201 CO -0.05 0.33 0.24 0.00 0.02 0.00 0.00 177.57 178.11 2wua h ALA 202 N 0.89 0.86 0.13 1.67 0.00 -0.91 -1.67 119.26 120.23 2wua h ALA 202 Ca 0.11 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2wua h ALA 202 Cb 0.45 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2wua h ALA 202 CO 0.02 0.51 -0.06 1.96 0.00 0.00 0.00 179.25 181.67 2wua h GLN 203 N 0.95 -0.17 -0.82 0.00 1.08 -1.06 -1.21 115.11 113.87 2wua h GLN 203 Ca 0.22 0.01 0.03 0.00 -1.45 0.00 0.00 58.65 57.46 2wua h GLN 203 Cb 0.25 0.04 -0.05 0.00 -0.05 0.00 0.00 27.48 27.68 2wua h GLN 203 CO -0.01 0.21 0.54 -0.22 -0.95 0.00 0.00 178.83 178.40 2wua h LYS 204 N -0.60 1.00 -0.39 1.46 3.64 -1.16 -3.03 116.57 117.50 2wua h LYS 204 Ca -0.02 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 2wua h LYS 204 Cb 0.47 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 2wua h LYS 204 CO 0.03 0.66 0.00 1.19 -2.27 0.00 0.00 179.45 179.06 2wua n PHE 205 N -4.44 0.52 -3.65 1.91 3.72 -0.63 -4.99 117.46 109.90 2wua n PHE 205 Ca 0.10 -0.48 -0.21 0.00 -0.05 0.00 0.00 57.45 56.82 2wua n PHE 205 Cb 0.09 -0.02 0.04 0.00 -0.94 0.00 0.00 39.48 38.66 2wua n PHE 205 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2wua n SER 206 N 0.69 -1.43 -4.60 4.37 7.64 -0.56 -4.96 113.62 114.77 2wua n SER 206 Ca 0.13 -0.78 -0.42 0.00 1.01 0.00 0.00 58.87 58.82 2wua n SER 206 Cb 0.45 -4.28 -0.06 0.00 -1.01 0.00 0.00 64.21 59.32 2wua n SER 206 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2wua s ILE 207 N -3.60 4.83 0.64 0.44 -1.09 -0.57 -5.04 121.20 116.81 2wua s ILE 207 Ca 0.02 0.92 -0.13 0.00 -2.23 0.00 0.00 60.65 59.23 2wua s ILE 207 Cb -0.01 -4.12 -0.02 0.00 -1.58 0.00 0.00 42.46 36.74 2wua s ILE 207 CO 0.79 -0.28 1.06 0.42 -1.23 0.00 0.00 174.94 175.70 2wua s THR 208 N 2.87 3.93 0.23 2.92 -4.23 -1.26 -4.79 115.64 115.32 2wua s THR 208 Ca 0.29 0.77 -0.06 0.00 -1.18 0.00 0.00 61.69 61.51 2wua s THR 208 Cb -0.14 -3.39 0.19 0.00 1.34 0.00 0.00 72.50 70.50 2wua s THR 208 CO 0.14 -0.68 1.81 -0.09 -0.54 0.00 0.00 174.62 175.26 2wua h ARG 209 N -0.11 0.74 -0.70 3.99 9.65 -1.96 -1.83 114.38 124.15 2wua h ARG 209 Ca -0.45 -0.04 -0.04 0.00 -1.10 0.00 0.00 59.98 58.34 2wua h ARG 209 Cb 1.21 -0.17 -0.03 0.00 -1.39 0.00 0.00 29.97 29.60 2wua h ARG 209 CO 0.57 0.49 0.27 0.37 2.80 0.00 0.00 179.97 184.47 2wua h GLN 210 N 0.76 1.06 -0.86 0.20 4.15 -1.97 -0.79 115.11 117.67 2wua h GLN 210 Ca 0.37 -0.20 -0.00 0.00 0.77 0.00 0.00 58.65 59.59 2wua h GLN 210 Cb 0.31 -0.17 -0.04 0.00 0.21 0.00 0.00 27.48 27.79 2wua h GLN 210 CO -0.23 0.89 0.53 0.93 -1.93 0.00 0.00 178.83 179.02 2wua h GLU 211 N 1.01 1.15 -0.23 1.69 5.08 -1.81 -0.09 114.58 121.38 2wua h GLU 211 Ca 0.23 -0.09 -0.06 0.00 -1.00 0.00 0.00 59.36 58.43 2wua h GLU 211 Cb 0.23 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 2wua h GLU 211 CO -0.02 0.80 -0.11 1.96 -1.00 0.00 0.00 179.01 180.64 2wua h GLN 212 N 1.17 0.48 -0.80 2.33 4.20 -1.04 -2.55 115.11 118.90 2wua h GLN 212 Ca 0.31 -0.21 -0.04 0.00 0.06 0.00 0.00 58.65 58.77 2wua h GLN 212 Cb -0.07 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 27.66 2wua h GLN 212 CO -0.06 0.75 0.35 -0.44 -0.67 0.00 0.00 178.83 178.76 2wua h ASP 213 N 0.20 1.07 -0.40 1.46 3.32 -0.85 -2.50 116.42 118.72 2wua h ASP 213 Ca 0.05 -0.15 -0.04 0.00 0.02 0.00 0.00 57.03 56.91 2wua h ASP 213 Cb 0.60 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.85 2wua h ASP 213 CO 0.03 0.93 0.11 1.56 -1.72 0.00 0.00 179.24 180.16 2wua h GLN 214 N 1.15 0.69 -0.73 3.56 4.20 -0.98 -1.46 115.11 121.55 2wua h GLN 214 Ca 0.27 -0.13 -0.06 0.00 0.06 0.00 0.00 58.65 58.79 2wua h GLN 214 Cb 0.17 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 27.80 2wua h GLN 214 CO -0.03 0.63 0.21 0.00 -0.67 0.00 0.00 178.83 178.98 2wua h ALA 215 N 1.45 0.95 -0.53 3.87 0.00 -1.06 -1.76 119.26 122.18 2wua h ALA 215 Ca 0.15 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 2wua h ALA 215 Cb 0.25 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2wua h ALA 215 CO -0.00 0.65 0.17 0.00 0.00 0.00 0.00 179.25 180.07 2wua h ALA 216 N 1.11 0.70 -0.47 0.00 0.00 -0.98 -1.16 119.26 118.46 2wua h ALA 216 Ca 0.23 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 54.98 2wua h ALA 216 Cb 0.33 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 2wua h ALA 216 CO -0.00 0.35 0.28 0.28 0.00 0.00 0.00 179.25 180.16 2wua h VAL 217 N 0.73 1.05 -0.95 0.00 2.07 -1.09 -1.96 116.25 116.10 2wua h VAL 217 Ca 0.17 -0.19 -0.00 0.00 0.82 0.00 0.00 66.70 67.50 2wua h VAL 217 Cb 0.27 0.44 -0.05 0.00 -1.52 0.00 0.00 31.29 30.43 2wua h VAL 217 CO -0.01 0.10 0.58 1.23 0.02 0.00 0.00 177.57 179.49 2wua h GLY 218 N 0.56 1.38 1.02 2.17 0.00 -1.07 -1.79 103.07 105.34 2wua h GLY 218 Ca 0.19 -0.57 -0.07 0.00 0.00 0.00 0.00 47.33 46.87 2wua h GLY 218 CO -0.08 0.55 0.04 0.23 0.00 0.00 0.00 176.54 177.29 2wua h SER 219 N 1.31 0.88 -0.55 0.19 0.87 -0.64 0.52 113.55 116.15 2wua h SER 219 Ca 0.34 -0.28 -0.06 0.00 -1.23 0.00 0.00 61.79 60.56 2wua h SER 219 Cb -0.06 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 61.64 2wua h SER 219 CO -0.06 0.95 0.13 0.45 -0.53 0.00 0.00 176.83 177.76 2wua h HIS 220 N 0.79 0.92 -0.44 2.24 3.86 -1.17 -1.08 115.15 120.28 2wua h HIS 220 Ca 0.16 -0.11 -0.07 0.00 -1.16 0.00 0.00 60.37 59.18 2wua h HIS 220 Cb 0.47 -0.26 -0.02 0.00 1.06 0.00 0.00 27.41 28.66 2wua h HIS 220 CO 0.03 0.81 -0.02 0.00 0.86 0.00 0.00 177.93 179.61 2wua h ARG 221 N 0.77 0.79 -0.31 2.45 3.08 -1.09 -1.48 114.38 118.58 2wua h ARG 221 Ca 0.17 -0.26 -0.15 0.00 0.07 0.00 0.00 59.98 59.81 2wua h ARG 221 Cb 0.35 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 2wua h ARG 221 CO 0.00 0.86 -0.41 0.87 -1.07 0.00 0.00 179.97 180.22 2wua h LYS 222 N 0.63 0.76 -0.31 0.04 1.57 -0.83 -0.03 116.57 118.40 2wua h LYS 222 Ca 0.12 -0.40 -0.16 0.00 -1.87 0.00 0.00 60.65 58.34 2wua h LYS 222 Cb 0.52 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.84 2wua h LYS 222 CO 0.03 1.03 -0.44 1.79 -0.57 0.00 0.00 179.45 181.29 2wua h THR 223 N 0.62 1.28 -0.22 -0.16 1.35 -1.16 -1.08 112.91 113.53 2wua h THR 223 Ca 0.05 -1.62 0.01 0.00 -0.55 0.00 0.00 66.41 64.30 2wua h THR 223 Cb 0.97 1.57 -0.01 0.00 -1.73 0.00 0.00 68.15 68.94 2wua h THR 223 CO 0.09 0.53 0.13 0.00 -0.25 0.00 0.00 175.52 176.02 2wua h ALA 224 N 0.70 0.28 -0.28 6.62 0.00 -1.17 -0.81 119.26 124.60 2wua h ALA 224 Ca 0.03 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.95 2wua h ALA 224 Cb 1.04 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 2wua h ALA 224 CO 0.10 -0.27 0.15 0.00 0.00 0.00 0.00 179.25 179.24 2wua h ALA 225 N 1.10 0.35 -0.83 0.00 0.00 -0.98 -1.30 119.26 117.59 2wua h ALA 225 Ca 0.09 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 2wua h ALA 225 Cb -0.01 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 2wua h ALA 225 CO -0.04 -0.23 0.51 0.00 0.00 0.00 0.00 179.25 179.49 2wua h ALA 226 N 1.13 1.06 0.05 0.00 0.00 -1.05 0.25 119.26 120.70 2wua h ALA 226 Ca 0.11 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2wua h ALA 226 Cb 0.02 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.47 2wua h ALA 226 CO -0.07 0.51 -0.02 1.15 0.00 0.00 0.00 179.25 180.82 2wua h THR 227 N 1.14 1.02 -0.45 0.00 2.02 -0.87 -0.46 112.91 115.31 2wua h THR 227 Ca 0.30 -0.22 -0.04 0.00 0.77 0.00 0.00 66.41 67.21 2wua h THR 227 Cb -0.07 1.17 -0.02 0.00 -1.74 0.00 0.00 68.15 67.49 2wua h THR 227 CO -0.06 0.06 0.10 0.00 0.37 0.00 0.00 175.52 175.98 2wua h ALA 228 N 0.79 1.34 0.00 6.16 0.00 -1.01 -2.48 119.26 124.06 2wua h ALA 228 Ca -0.01 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2wua h ALA 228 Cb 0.14 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2wua h ALA 228 CO 0.01 0.47 0.00 0.00 0.00 0.00 0.00 179.25 179.73 2wua n ALA 229 N -2.47 2.22 -0.96 0.00 0.00 0.05 -4.90 120.51 114.46 2wua n ALA 229 Ca 0.03 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2wua n ALA 229 Cb 0.21 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.26 2wua n ALA 229 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wua n GLY 230 N 0.90 0.45 0.02 0.00 0.00 -0.93 -4.94 105.19 100.69 2wua n GLY 230 Ca 0.10 -0.60 0.10 0.00 0.00 0.00 0.00 46.02 45.63 2wua n GLY 230 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wua n ARG 231 N -2.96 0.04 0.00 1.61 1.74 -0.22 -2.19 116.66 114.68 2wua n ARG 231 Ca 0.00 0.17 0.09 0.00 -0.77 0.00 0.00 57.85 57.34 2wua n ARG 231 Cb 0.00 -1.56 0.00 0.00 -1.02 0.00 0.00 32.46 29.89 2wua n ARG 231 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 2wua n PHE 232 N -1.62 0.00 -0.31 -1.55 3.72 -1.25 -4.65 117.46 111.79 2wua n PHE 232 Ca 0.05 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.42 2wua n PHE 232 Cb 0.26 0.00 0.12 0.00 -0.94 0.00 0.00 39.48 38.92 2wua n PHE 232 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2wua h LYS 233 N 2.20 1.21 -0.39 -1.08 1.57 -1.78 -2.29 116.57 116.00 2wua h LYS 233 Ca 0.00 -0.13 -0.15 0.00 -1.87 0.00 0.00 60.65 58.50 2wua h LYS 233 Cb 0.65 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 2wua h LYS 233 CO 0.00 0.87 -0.33 -0.44 -0.57 0.00 0.00 179.45 178.98 2wua h ASP 234 N 1.22 0.97 1.12 0.86 3.32 -1.83 -3.27 116.42 118.81 2wua h ASP 234 Ca 0.31 -0.45 -0.15 0.00 0.02 0.00 0.00 57.03 56.76 2wua h ASP 234 Cb -0.00 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.26 2wua h ASP 234 CO -0.05 1.22 -0.73 1.05 -1.72 0.00 0.00 179.24 179.00 2wua h GLU 235 N 0.73 0.00 -6.15 3.56 4.11 -1.82 -3.45 114.58 111.55 2wua h GLU 235 Ca 0.07 0.00 -0.55 0.00 0.07 0.00 0.00 59.36 58.95 2wua h GLU 235 Cb 0.92 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.13 2wua h GLU 235 CO 0.09 0.73 0.16 0.42 0.07 0.00 0.00 179.01 180.48 2wua s ILE 236 N -2.97 4.97 -0.32 -1.06 1.01 -0.88 -0.84 121.20 121.11 2wua s ILE 236 Ca 0.02 1.60 -0.12 0.00 0.00 0.00 0.00 60.65 62.15 2wua s ILE 236 Cb 0.10 -4.11 -0.02 0.00 0.01 0.00 0.00 42.46 38.43 2wua s ILE 236 CO 0.78 0.25 0.21 -0.63 0.00 0.00 0.00 174.94 175.54 2wua s ILE 237 N 0.74 5.15 0.59 2.92 -1.09 0.49 -4.93 121.20 125.07 2wua s ILE 237 Ca 0.41 -0.16 -0.20 0.00 -2.23 0.00 0.00 60.65 58.47 2wua s ILE 237 Cb -0.19 -3.59 -0.03 0.00 -1.58 0.00 0.00 42.46 37.07 2wua s ILE 237 CO 0.21 0.07 1.27 -2.84 -1.23 0.00 0.00 174.94 172.42 2wua s PRO 238 N 1.71 2.93 -0.28 2.79 0.02 -1.26 -4.19 135.00 136.72 2wua s PRO 238 Ca 0.06 2.01 -0.06 0.00 0.02 0.00 0.00 61.00 63.03 2wua s PRO 238 Cb -0.17 -2.02 0.00 0.00 0.02 0.00 0.00 34.50 32.33 2wua s PRO 238 CO 0.10 -1.29 0.06 0.42 -0.33 0.00 0.00 177.00 175.96 2wua s ILE 239 N -1.44 3.91 -0.45 2.83 -1.09 -0.42 -4.96 121.20 119.59 2wua s ILE 239 Ca 0.77 -0.59 -0.23 0.00 -2.23 0.00 0.00 60.65 58.37 2wua s ILE 239 Cb -0.35 -2.96 0.03 0.00 -1.58 0.00 0.00 42.46 37.59 2wua s ILE 239 CO 0.39 0.17 0.78 -0.54 -1.23 0.00 0.00 174.94 174.52 2wua s LYS 240 N 1.51 3.41 0.00 2.79 1.02 -1.26 -1.34 119.74 125.87 2wua s LYS 240 Ca 0.04 -0.10 0.00 0.00 0.02 0.00 0.00 55.97 55.93 2wua s LYS 240 Cb -0.16 -3.94 0.00 0.00 -0.52 0.00 0.00 37.83 33.21 2wua s LYS 240 CO 0.02 -1.11 0.00 -2.37 -0.92 0.00 0.00 175.35 170.97 2wua n THR 241 N 6.13 0.00 -3.74 2.17 5.66 -0.32 -5.02 114.28 119.16 2wua n THR 241 Ca 0.02 0.00 -0.11 0.00 -3.05 0.00 0.00 64.05 60.91 2wua n THR 241 Cb 0.48 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.20 2wua n THR 241 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 175.07 170.43 2wua s LYS 242 N 3.14 0.88 -0.14 1.09 -2.85 -1.26 -1.74 119.74 118.86 2wua s LYS 242 Ca 0.00 -0.63 0.00 0.00 -1.00 0.00 0.00 55.97 54.34 2wua s LYS 242 Cb 0.00 0.38 -0.01 0.00 -2.06 0.00 0.00 37.83 36.14 2wua s LYS 242 CO 0.00 -0.30 -0.14 0.42 0.10 0.00 0.00 175.35 175.43 2wua s ILE 243 N -3.07 2.92 -0.18 3.79 -1.09 0.78 -4.47 121.20 119.87 2wua s ILE 243 Ca -0.01 -0.70 -0.05 0.00 -2.23 0.00 0.00 60.65 57.66 2wua s ILE 243 Cb 0.01 -2.23 -0.03 0.00 -1.58 0.00 0.00 42.46 38.64 2wua s ILE 243 CO -0.07 0.52 -0.01 -0.69 -1.23 0.00 0.00 174.94 173.46 2wua s VAL 244 N 0.48 3.99 -0.20 2.92 1.01 -1.26 -1.29 120.40 126.05 2wua s VAL 244 Ca -0.10 -0.31 -0.29 0.00 0.00 0.00 0.00 61.98 61.28 2wua s VAL 244 Cb -0.16 -2.78 -0.02 0.00 0.00 0.00 0.00 36.38 33.42 2wua s VAL 244 CO 0.04 0.46 1.49 -0.62 0.00 0.00 0.00 175.10 176.47 2wua s ASP 245 N 0.67 6.59 0.49 3.32 2.15 -0.32 -4.89 116.67 124.68 2wua s ASP 245 Ca -0.01 1.64 0.15 0.00 0.43 0.00 0.00 52.55 54.76 2wua s ASP 245 Cb -0.14 -2.53 1.19 0.00 -0.30 0.00 0.00 42.92 41.13 2wua s ASP 245 CO 0.02 -1.08 2.11 -0.65 -0.17 0.00 0.00 175.17 175.40 2wua h PRO 246 N 9.76 0.13 0.03 4.34 0.11 -1.96 0.31 132.00 144.73 2wua h PRO 246 Ca -0.31 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.79 2wua h PRO 246 Cb 1.14 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2wua h PRO 246 CO 1.00 0.09 -0.01 -0.22 -0.21 0.00 0.00 178.00 178.64 2wua h LYS 247 N 0.13 -0.04 0.05 1.05 3.64 -1.98 -3.40 116.57 116.02 2wua h LYS 247 Ca 0.07 0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 59.16 2wua h LYS 247 Cb 0.11 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.91 2wua h LYS 247 CO -0.01 0.08 -1.58 1.79 -2.27 0.00 0.00 179.45 177.46 2wua h THR 248 N -1.01 1.04 0.00 1.00 1.35 -1.97 -3.48 112.91 109.85 2wua h THR 248 Ca -0.00 -2.80 0.00 0.00 -0.55 0.00 0.00 66.41 63.05 2wua h THR 248 Cb 0.13 2.59 0.00 0.00 -1.73 0.00 0.00 68.15 69.14 2wua h THR 248 CO 0.01 0.70 0.00 0.61 -0.25 0.00 0.00 175.52 176.59 2wua n GLY 249 N 1.60 0.76 3.73 5.82 0.00 0.11 -5.03 105.19 112.19 2wua n GLY 249 Ca -0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 2wua n GLY 249 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wua n ASP 250 N 0.00 3.52 -4.49 1.61 9.92 -1.26 -4.63 116.55 121.22 2wua n ASP 250 Ca 0.00 1.17 -0.33 0.00 -0.53 0.00 0.00 54.79 55.10 2wua n ASP 250 Cb 0.00 -1.56 -0.13 0.00 -0.64 0.00 0.00 41.12 38.80 2wua n ASP 250 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2wua s GLU 251 N -1.01 3.03 -0.06 -1.24 2.02 -1.26 -1.17 118.70 119.01 2wua s GLU 251 Ca 0.61 -0.61 0.03 0.00 0.02 0.00 0.00 54.97 55.03 2wua s GLU 251 Cb -0.53 -2.61 0.00 0.00 0.10 0.00 0.00 34.13 31.09 2wua s GLU 251 CO 0.54 0.46 -0.16 0.21 0.02 0.00 0.00 175.26 176.33 2wua s LYS 252 N -0.28 1.85 0.21 1.61 2.20 -0.41 -4.98 119.74 119.93 2wua s LYS 252 Ca 0.03 -0.55 -0.30 0.00 -0.36 0.00 0.00 55.97 54.80 2wua s LYS 252 Cb -0.13 -1.54 -0.08 0.00 -1.51 0.00 0.00 37.83 34.57 2wua s LYS 252 CO 0.03 0.15 1.15 -1.25 -0.36 0.00 0.00 175.35 175.06 2wua s PRO 253 N 0.32 4.56 0.03 4.03 0.04 -1.26 -0.16 135.00 142.56 2wua s PRO 253 Ca -0.10 1.82 -0.00 0.00 0.04 0.00 0.00 61.00 62.76 2wua s PRO 253 Cb -0.14 -3.24 -0.03 0.00 0.04 0.00 0.00 34.50 31.14 2wua s PRO 253 CO 0.03 0.03 -0.03 0.14 0.04 0.00 0.00 177.00 177.21 2wua s VAL 254 N -0.39 0.16 -0.21 -0.36 -7.23 -0.71 -4.88 120.40 106.78 2wua s VAL 254 Ca 0.50 -1.25 -0.03 0.00 -1.81 0.00 0.00 61.98 59.39 2wua s VAL 254 Cb -0.32 -0.74 -0.00 0.00 0.56 0.00 0.00 36.38 35.88 2wua s VAL 254 CO 0.37 -0.68 -0.07 -0.89 -0.31 0.00 0.00 175.10 173.52 2wua s THR 255 N -2.37 3.10 -0.16 5.32 2.01 -1.26 -1.17 115.64 121.11 2wua s THR 255 Ca -0.07 -0.59 -0.18 0.00 0.31 0.00 0.00 61.69 61.16 2wua s THR 255 Cb -0.03 -2.40 -0.04 0.00 0.01 0.00 0.00 72.50 70.04 2wua s THR 255 CO -0.04 0.45 0.47 -0.63 -0.69 0.00 0.00 174.62 174.17 2wua s ILE 256 N 1.44 5.17 0.00 1.82 -1.09 -0.45 -4.91 121.20 123.18 2wua s ILE 256 Ca 0.06 0.90 0.00 0.00 -2.23 0.00 0.00 60.65 59.38 2wua s ILE 256 Cb -0.14 -3.80 0.00 0.00 -1.58 0.00 0.00 42.46 36.94 2wua s ILE 256 CO -0.05 0.27 0.02 -1.54 -1.23 0.00 0.00 174.94 172.40 2wua n SER 257 N 4.17 0.04 -4.17 3.58 3.41 -1.26 -1.30 113.62 118.09 2wua n SER 257 Ca -0.07 -0.28 -0.16 0.00 -0.26 0.00 0.00 58.87 58.11 2wua n SER 257 Cb 0.51 0.15 -0.11 0.00 -0.26 0.00 0.00 64.21 64.50 2wua n SER 257 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2wua s VAL 258 N -0.15 0.97 0.02 -3.33 -7.23 -1.26 -4.86 120.40 104.56 2wua s VAL 258 Ca 0.00 -1.48 -0.30 0.00 -1.81 0.00 0.00 61.98 58.38 2wua s VAL 258 Cb 0.00 -1.20 -0.06 0.00 0.56 0.00 0.00 36.38 35.68 2wua s VAL 258 CO 0.00 -0.43 1.37 -1.81 -0.31 0.00 0.00 175.10 173.92 2wua s ASP 259 N -2.14 6.87 0.00 4.85 1.01 -1.26 -4.72 116.67 121.28 2wua s ASP 259 Ca 0.02 2.13 0.22 0.00 0.71 0.00 0.00 52.55 55.62 2wua s ASP 259 Cb -0.06 -2.57 0.32 0.00 1.01 0.00 0.00 42.92 41.62 2wua s ASP 259 CO 0.01 -0.68 1.30 -0.90 0.21 0.00 0.00 175.17 175.10 2wua n ASP 260 N 5.03 3.16 0.01 0.27 5.68 -1.08 -4.15 116.55 125.46 2wua n ASP 260 Ca 0.12 -1.94 0.13 0.00 -0.50 0.00 0.00 54.79 52.60 2wua n ASP 260 Cb 0.44 -0.15 0.46 0.00 -1.14 0.00 0.00 41.12 40.72 2wua n ASP 260 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wua n GLY 261 N 1.32 -1.43 3.74 6.12 0.00 -1.26 -4.82 105.19 108.87 2wua n GLY 261 Ca 0.16 -0.19 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 2wua n GLY 261 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wua s ILE 262 N -3.02 2.97 -0.46 -0.61 1.01 -0.99 -4.79 121.20 115.31 2wua s ILE 262 Ca 0.12 0.83 0.03 0.00 0.00 0.00 0.00 60.65 61.63 2wua s ILE 262 Cb 0.18 -3.53 0.14 0.00 0.01 0.00 0.00 42.46 39.26 2wua s ILE 262 CO 0.60 0.14 0.28 -0.13 0.00 0.00 0.00 174.94 175.83 2wua s ARG 263 N -0.45 1.37 0.54 2.79 1.81 -1.26 -5.01 118.95 118.74 2wua s ARG 263 Ca 0.56 -2.16 0.23 0.00 -1.72 0.00 0.00 55.73 52.64 2wua s ARG 263 Cb -0.39 -2.36 1.43 0.00 -0.45 0.00 0.00 34.95 33.19 2wua s ARG 263 CO 0.42 -1.20 2.09 -1.35 -0.68 0.00 0.00 175.30 174.58 2wua h PRO 264 N 6.47 0.00 -0.06 3.54 0.11 -1.95 -1.21 132.00 138.90 2wua h PRO 264 Ca 0.04 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.15 2wua h PRO 264 Cb 0.91 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.02 2wua h PRO 264 CO 0.50 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.70 2wua n GLY 265 N -1.53 -0.24 3.66 -0.55 0.00 -1.26 -4.60 105.19 100.67 2wua n GLY 265 Ca 0.02 -0.34 -0.54 0.00 0.00 0.00 0.00 46.02 45.17 2wua n GLY 265 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2wua n THR 266 N -0.14 0.21 -4.49 2.61 -1.04 -0.46 -4.95 114.28 106.02 2wua n THR 266 Ca 0.18 -0.04 -0.25 0.00 -2.04 0.00 0.00 64.05 61.91 2wua n THR 266 Cb 0.25 -1.17 -0.10 0.00 -1.82 0.00 0.00 70.33 67.49 2wua n THR 266 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 2wua s SER 267 N 2.33 3.62 0.29 8.00 1.04 -1.26 -4.78 113.70 122.94 2wua s SER 267 Ca 0.91 -1.08 0.01 0.00 0.48 0.00 0.00 55.95 56.27 2wua s SER 267 Cb -0.96 -0.31 0.54 0.00 0.10 0.00 0.00 66.02 65.38 2wua s SER 267 CO 0.55 -0.03 1.88 -0.07 0.98 0.00 0.00 173.24 176.55 2wua h LEU 268 N 2.20 0.92 -0.50 2.42 3.38 -1.92 -1.71 115.31 120.10 2wua h LEU 268 Ca -0.41 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.56 2wua h LEU 268 Cb 1.26 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.81 2wua h LEU 268 CO 0.63 0.55 0.22 0.00 0.09 0.00 0.00 178.44 179.93 2wua h ALA 269 N 1.51 0.65 -0.27 1.53 0.00 -1.99 0.13 119.26 120.83 2wua h ALA 269 Ca 0.43 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 55.24 2wua h ALA 269 Cb 0.32 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 2wua h ALA 269 CO -0.19 0.24 0.06 -0.44 0.00 0.00 0.00 179.25 178.92 2wua h ASP 270 N 0.66 0.04 0.46 0.00 3.32 -1.85 -3.13 116.42 115.91 2wua h ASP 270 Ca 0.17 0.04 -0.13 0.00 0.02 0.00 0.00 57.03 57.12 2wua h ASP 270 Cb 0.17 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 2wua h ASP 270 CO -0.02 0.05 -0.59 -0.07 -1.72 0.00 0.00 179.24 176.90 2wua h LEU 271 N 0.17 0.15 -1.46 1.55 3.38 -0.78 -2.92 115.31 115.40 2wua h LEU 271 Ca 0.12 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2wua h LEU 271 Cb 0.11 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2wua h LEU 271 CO -0.15 0.71 0.00 0.00 0.09 0.00 0.00 178.44 179.09 2wua h ALA 272 N 1.30 1.00 0.00 1.53 0.00 -0.70 -2.52 119.26 119.86 2wua h ALA 272 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2wua h ALA 272 Cb 1.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2wua h ALA 272 CO 0.08 0.00 -0.47 1.63 0.00 0.00 0.00 179.25 180.50 2wua n LYS 273 N -2.77 0.15 -2.35 0.00 5.02 -1.10 -4.91 118.16 112.21 2wua n LYS 273 Ca 0.00 0.05 -0.37 0.00 -2.02 0.00 0.00 58.31 55.98 2wua n LYS 273 Cb 0.23 -1.61 -0.02 0.00 -0.02 0.00 0.00 35.03 33.61 2wua n LYS 273 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2wua s LEU 274 N -3.66 4.04 0.08 -0.35 1.43 -0.95 -5.03 118.68 114.24 2wua s LEU 274 Ca 0.09 2.22 -0.07 0.00 -1.03 0.00 0.00 54.13 55.34 2wua s LEU 274 Cb 0.15 -4.23 -0.05 0.00 0.03 0.00 0.00 46.19 42.09 2wua s LEU 274 CO 0.68 -0.79 0.35 -0.54 0.23 0.00 0.00 176.35 176.28 2wua s LYS 275 N -2.65 3.64 0.44 1.70 1.02 -1.26 -5.00 119.74 117.63 2wua s LYS 275 Ca 0.62 -0.02 -0.26 0.00 0.02 0.00 0.00 55.97 56.34 2wua s LYS 275 Cb -0.26 -2.97 -0.08 0.00 -0.52 0.00 0.00 37.83 33.99 2wua s LYS 275 CO 0.32 0.56 1.41 -2.14 -0.92 0.00 0.00 175.35 174.58 2wua s PRO 276 N -2.15 3.75 -0.02 -1.68 0.02 -1.26 -4.56 135.00 129.09 2wua s PRO 276 Ca 0.34 2.39 0.20 0.00 0.02 0.00 0.00 61.00 63.96 2wua s PRO 276 Cb -0.13 -2.69 -0.30 0.00 0.02 0.00 0.00 34.50 31.40 2wua s PRO 276 CO 0.20 -0.76 0.50 1.55 -0.33 0.00 0.00 177.00 178.16 2wua n VAL 277 N -0.11 0.00 -0.01 3.83 3.14 -1.17 -4.62 118.33 119.38 2wua n VAL 277 Ca 0.05 -0.41 0.00 0.00 -2.96 0.00 0.00 64.34 61.02 2wua n VAL 277 Cb 0.42 0.16 -0.04 0.00 -1.06 0.00 0.00 33.84 33.31 2wua n VAL 277 CO 0.00 0.00 0.00 0.49 -6.46 0.00 0.00 176.83 170.86 2wua n PHE 278 N -2.12 0.00 -3.69 1.45 3.72 -1.26 -4.98 117.46 110.59 2wua n PHE 278 Ca -0.03 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.23 2wua n PHE 278 Cb 0.50 -0.18 -0.14 0.00 -0.94 0.00 0.00 39.48 38.72 2wua n PHE 278 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2wua s ARG 279 N -2.25 0.11 0.44 -1.08 0.52 -1.26 -4.99 118.95 110.44 2wua s ARG 279 Ca -0.02 0.60 0.20 0.00 -0.52 0.00 0.00 55.73 55.99 2wua s ARG 279 Cb 0.03 -0.15 1.16 0.00 0.52 0.00 0.00 34.95 36.50 2wua s ARG 279 CO 0.22 -0.26 1.86 -0.22 0.02 0.00 0.00 175.30 176.92 2wua h LYS 280 N 8.01 0.31 -0.58 3.54 3.64 -1.93 0.86 116.57 130.42 2wua h LYS 280 Ca -0.22 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.15 2wua h LYS 280 Cb 1.12 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 2wua h LYS 280 CO 0.21 0.21 0.00 -0.40 -2.27 0.00 0.00 179.45 177.20 2wua n ASP 281 N -4.47 4.86 -1.86 4.20 5.68 -1.26 -4.80 116.55 118.90 2wua n ASP 281 Ca 0.19 -2.61 0.00 0.00 -0.50 0.00 0.00 54.79 51.87 2wua n ASP 281 Cb 0.74 -0.59 0.00 0.00 -1.14 0.00 0.00 41.12 40.13 2wua n ASP 281 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wua n GLY 282 N 0.82 0.28 0.00 6.12 0.00 0.30 -5.06 105.19 107.64 2wua n GLY 282 Ca 0.25 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.44 2wua n GLY 282 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wua n SER 283 N -1.53 0.14 -4.69 1.61 3.41 -1.26 -4.78 113.62 106.51 2wua n SER 283 Ca 0.00 -0.88 -0.40 0.00 -0.26 0.00 0.00 58.87 57.33 2wua n SER 283 Cb 0.00 0.02 -0.05 0.00 -0.26 0.00 0.00 64.21 63.92 2wua n SER 283 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2wua s THR 284 N -0.02 5.02 0.40 6.66 2.01 -1.26 -4.88 115.64 123.56 2wua s THR 284 Ca 0.00 1.35 0.04 0.00 0.31 0.00 0.00 61.69 63.39 2wua s THR 284 Cb 0.00 -4.00 -0.05 0.00 0.01 0.00 0.00 72.50 68.46 2wua s THR 284 CO 0.00 0.17 0.05 0.42 -0.69 0.00 0.00 174.62 174.57 2wua s THR 285 N 1.41 1.22 0.44 -0.82 -4.23 -1.26 -3.05 115.64 109.34 2wua s THR 285 Ca 0.34 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 58.98 2wua s THR 285 Cb -0.17 -2.61 0.32 0.00 1.34 0.00 0.00 72.50 71.38 2wua s THR 285 CO 0.14 0.00 2.00 0.00 -0.54 0.00 0.00 174.62 176.22 2wua h ALA 286 N 1.82 1.98 0.00 3.99 0.00 -1.93 -1.90 119.26 123.21 2wua h ALA 286 Ca -0.41 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2wua h ALA 286 Cb 1.26 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2wua h ALA 286 CO 0.70 -0.09 0.00 0.78 0.00 0.00 0.00 179.25 180.64 2wua h GLY 287 N 0.41 0.00 -0.94 0.00 0.00 -1.95 -2.90 103.07 97.69 2wua h GLY 287 Ca 0.24 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.56 2wua h GLY 287 CO -0.06 0.00 -0.36 -1.30 0.00 0.00 0.00 176.54 174.81 2wua n THR 288 N -2.59 2.19 -4.43 4.70 -2.24 -0.75 -4.79 114.28 106.37 2wua n THR 288 Ca 0.03 -3.00 -0.23 0.00 -2.27 0.00 0.00 64.05 58.58 2wua n THR 288 Cb 0.35 -0.25 -0.10 0.00 -2.10 0.00 0.00 70.33 68.23 2wua n THR 288 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2wua s SER 289 N -3.08 3.29 0.70 3.42 0.01 -1.01 -1.00 113.70 116.03 2wua s SER 289 Ca 0.38 -1.00 -0.16 0.00 1.31 0.00 0.00 55.95 56.48 2wua s SER 289 Cb 0.36 -0.25 0.02 0.00 0.21 0.00 0.00 66.02 66.36 2wua s SER 289 CO -0.04 -0.00 1.24 -0.94 0.41 0.00 0.00 173.24 173.90 2wua s SER 290 N -3.33 4.32 0.42 2.44 1.04 0.15 -4.59 113.70 114.15 2wua s SER 290 Ca 0.27 2.45 -0.21 0.00 0.48 0.00 0.00 55.95 58.94 2wua s SER 290 Cb -0.04 -2.60 -0.11 0.00 0.10 0.00 0.00 66.02 63.37 2wua s SER 290 CO 0.12 -2.18 0.93 -1.10 0.98 0.00 0.00 173.24 171.99 2wua s GLN 291 N -3.72 4.22 0.00 4.02 -0.21 -1.00 -4.91 119.66 118.06 2wua s GLN 291 Ca 0.77 1.08 -0.26 0.00 0.02 0.00 0.00 55.36 56.97 2wua s GLN 291 Cb -0.32 -2.23 -0.04 0.00 1.00 0.00 0.00 33.01 31.42 2wua s GLN 291 CO 0.43 -0.00 0.82 0.14 -2.12 0.00 0.00 175.29 174.56 2wua s VAL 292 N -2.14 4.85 0.21 1.09 -7.23 -1.26 -1.51 120.40 114.41 2wua s VAL 292 Ca 0.61 1.74 -0.11 0.00 -1.81 0.00 0.00 61.98 62.40 2wua s VAL 292 Cb -0.09 -4.17 -0.00 0.00 0.56 0.00 0.00 36.38 32.67 2wua s VAL 292 CO 0.14 0.26 0.39 -0.44 -0.31 0.00 0.00 175.10 175.15 2wua s SER 293 N 0.53 -0.05 0.01 4.85 0.01 -1.26 -1.26 113.70 116.52 2wua s SER 293 Ca 0.43 -0.88 0.06 0.00 1.31 0.00 0.00 55.95 56.87 2wua s SER 293 Cb -0.20 0.52 -0.03 0.00 0.21 0.00 0.00 66.02 66.52 2wua s SER 293 CO 0.23 -1.02 -0.17 -1.81 0.41 0.00 0.00 173.24 170.89 2wua s ASP 294 N -2.99 3.88 0.00 2.44 1.01 0.44 -3.10 116.67 118.36 2wua s ASP 294 Ca 0.20 -0.33 0.00 0.00 0.71 0.00 0.00 52.55 53.12 2wua s ASP 294 Cb 0.01 -0.70 0.00 0.00 1.01 0.00 0.00 42.92 43.24 2wua s ASP 294 CO 0.04 0.29 0.00 0.61 0.21 0.00 0.00 175.17 176.32 2wua n GLY 295 N 1.84 -0.26 3.26 0.21 0.00 -0.49 -1.65 105.19 108.11 2wua n GLY 295 Ca -0.16 -1.13 -0.10 0.00 0.00 0.00 0.00 46.02 44.62 2wua n GLY 295 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wua s ALA 296 N -2.00 -0.62 0.03 4.61 0.00 -1.26 -1.72 121.76 120.80 2wua s ALA 296 Ca 0.00 -0.25 -0.08 0.00 0.00 0.00 0.00 51.96 51.63 2wua s ALA 296 Cb 0.00 0.54 0.00 0.00 0.00 0.00 0.00 23.12 23.66 2wua s ALA 296 CO 0.00 -0.55 0.16 0.20 0.00 0.00 0.00 175.76 175.57 2wua s GLY 297 N -2.68 0.07 -0.17 0.00 0.00 -0.20 -1.06 107.32 103.27 2wua s GLY 297 Ca 0.02 -0.30 -0.20 0.00 0.00 0.00 0.00 44.72 44.24 2wua s GLY 297 CO -0.10 -0.46 0.55 0.00 0.00 0.00 0.00 173.10 173.09 2wua s ALA 298 N -2.28 -1.36 -0.04 3.20 0.00 -0.10 -0.48 121.76 120.70 2wua s ALA 298 Ca -0.07 1.43 0.02 0.00 0.00 0.00 0.00 51.96 53.33 2wua s ALA 298 Cb -0.03 -0.72 0.01 0.00 0.00 0.00 0.00 23.12 22.38 2wua s ALA 298 CO -0.03 -0.27 -0.08 0.08 0.00 0.00 0.00 175.76 175.46 2wua s VAL 299 N -0.01 0.75 -0.28 0.00 1.01 0.82 -1.05 120.40 121.64 2wua s VAL 299 Ca -0.02 -0.28 -0.10 0.00 0.00 0.00 0.00 61.98 61.58 2wua s VAL 299 Cb -0.04 -0.71 -0.03 0.00 0.00 0.00 0.00 36.38 35.61 2wua s VAL 299 CO 0.02 0.26 0.15 -0.22 0.00 0.00 0.00 175.10 175.31 2wua s LEU 300 N 0.59 3.91 0.11 3.92 2.96 0.09 -1.24 118.68 129.02 2wua s LEU 300 Ca -0.09 -0.22 0.10 0.00 -0.22 0.00 0.00 54.13 53.69 2wua s LEU 300 Cb -0.13 -2.04 -0.04 0.00 0.50 0.00 0.00 46.19 44.49 2wua s LEU 300 CO 0.01 -0.10 -0.22 -0.76 -1.32 0.00 0.00 176.35 173.96 2wua s LEU 301 N 1.68 2.51 0.20 -0.68 1.02 -0.08 -1.52 118.68 121.81 2wua s LEU 301 Ca 0.06 -0.63 -0.23 0.00 0.02 0.00 0.00 54.13 53.36 2wua s LEU 301 Cb -0.16 -1.40 0.05 0.00 0.02 0.00 0.00 46.19 44.70 2wua s LEU 301 CO 0.08 0.19 0.74 0.00 0.02 0.00 0.00 176.35 177.37 2wua s MET 302 N -1.99 1.44 0.40 1.70 0.23 -0.71 -1.31 119.30 119.05 2wua s MET 302 Ca 0.16 -0.71 -0.27 0.00 -1.03 0.00 0.00 55.69 53.84 2wua s MET 302 Cb -0.10 0.55 -0.10 0.00 -1.53 0.00 0.00 34.83 33.64 2wua s MET 302 CO 0.08 -0.65 1.34 1.63 -2.03 0.00 0.00 175.02 175.39 2wua n LYS 303 N -0.42 2.18 -0.29 3.16 5.02 -0.99 -0.66 118.16 126.16 2wua n LYS 303 Ca -0.09 0.77 0.05 0.00 -2.02 0.00 0.00 58.31 57.02 2wua n LYS 303 Cb 0.61 -2.47 0.20 0.00 -0.02 0.00 0.00 35.03 33.36 2wua n LYS 303 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 2wua h ARG 304 N 2.40 0.68 -0.64 1.97 2.43 -0.98 -1.17 114.38 119.07 2wua h ARG 304 Ca -0.48 -0.04 0.02 0.00 -0.81 0.00 0.00 59.98 58.67 2wua h ARG 304 Cb 1.28 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 30.64 2wua h ARG 304 CO 0.61 0.45 0.42 0.66 -1.51 0.00 0.00 179.97 180.60 2wua h SER 305 N 0.70 0.68 -0.25 -3.80 4.64 -1.90 0.17 113.55 113.78 2wua h SER 305 Ca 0.43 -0.01 -0.18 0.00 -0.47 0.00 0.00 61.79 61.56 2wua h SER 305 Cb 0.52 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 2wua h SER 305 CO -0.31 0.48 -0.55 0.40 -0.87 0.00 0.00 176.83 175.98 2wua h ILE 306 N 0.79 1.29 -0.57 0.95 1.08 -1.59 -0.49 117.51 118.96 2wua h ILE 306 Ca 0.25 -1.74 -0.03 0.00 -0.39 0.00 0.00 64.86 62.94 2wua h ILE 306 Cb 0.01 1.74 -0.03 0.00 -3.07 0.00 0.00 36.82 35.48 2wua h ILE 306 CO -0.06 0.56 0.23 0.00 -0.69 0.00 0.00 178.15 178.19 2wua h ALA 307 N 0.64 0.75 -0.60 1.87 0.00 -0.87 -1.72 119.26 119.33 2wua h ALA 307 Ca 0.00 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 2wua h ALA 307 Cb 1.16 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 2wua h ALA 307 CO 0.12 0.36 0.26 -0.07 0.00 0.00 0.00 179.25 179.92 2wua h LEU 308 N 0.79 0.81 -1.48 0.00 3.38 -0.91 -0.70 115.31 117.20 2wua h LEU 308 Ca 0.19 -0.15 0.04 0.00 0.09 0.00 0.00 57.88 58.05 2wua h LEU 308 Cb 0.20 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 2wua h LEU 308 CO -0.02 0.74 0.39 -0.61 0.09 0.00 0.00 178.44 179.03 2wua h GLN 309 N 0.82 0.65 -0.00 1.13 4.15 -0.82 -1.90 115.11 119.14 2wua h GLN 309 Ca 0.20 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.58 2wua h GLN 309 Cb 0.16 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 27.71 2wua h GLN 309 CO -0.02 0.43 -0.36 1.63 -1.93 0.00 0.00 178.83 178.58 2wua n LYS 310 N -4.47 0.39 -2.02 1.69 5.02 -0.67 -4.93 118.16 113.16 2wua n LYS 310 Ca 0.07 -0.22 -0.12 0.00 -2.02 0.00 0.00 58.31 56.03 2wua n LYS 310 Cb 0.16 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.65 2wua n LYS 310 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wua n GLY 311 N 1.42 0.21 3.73 0.72 0.00 -0.48 -5.00 105.19 105.79 2wua n GLY 311 Ca 0.09 -0.41 -0.40 0.00 0.00 0.00 0.00 46.02 45.30 2wua n GLY 311 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wua s LEU 312 N -3.25 4.39 0.36 0.99 1.43 -0.39 -5.03 118.68 117.19 2wua s LEU 312 Ca 0.00 1.36 -0.27 0.00 -1.03 0.00 0.00 54.13 54.19 2wua s LEU 312 Cb 0.00 -3.20 -0.09 0.00 0.03 0.00 0.00 46.19 42.93 2wua s LEU 312 CO 0.00 -0.06 1.25 -2.84 0.23 0.00 0.00 176.35 174.94 2wua s PRO 313 N 0.35 4.21 -0.28 1.29 0.02 -1.26 -4.62 135.00 134.72 2wua s PRO 313 Ca 0.39 2.07 -0.16 0.00 0.02 0.00 0.00 61.00 63.32 2wua s PRO 313 Cb -0.19 -2.91 -0.03 0.00 0.02 0.00 0.00 34.50 31.39 2wua s PRO 313 CO 0.21 -0.26 0.43 0.42 -0.33 0.00 0.00 177.00 177.48 2wua s ILE 314 N -1.24 5.13 0.07 2.83 1.01 -0.72 -4.70 121.20 123.58 2wua s ILE 314 Ca 0.52 0.64 -0.09 0.00 0.00 0.00 0.00 60.65 61.72 2wua s ILE 314 Cb -0.36 -3.77 -0.28 0.00 0.01 0.00 0.00 42.46 38.06 2wua s ILE 314 CO 0.47 0.10 1.14 0.25 0.00 0.00 0.00 174.94 176.90 2wua h LEU 315 N 8.71 0.65 -7.69 2.97 5.85 -1.05 0.74 115.31 125.49 2wua h LEU 315 Ca -0.30 -0.63 0.12 0.00 0.84 0.00 0.00 57.88 57.90 2wua h LEU 315 Cb 1.15 -0.21 -0.08 0.00 0.37 0.00 0.00 40.66 41.90 2wua h LEU 315 CO 0.68 1.47 0.37 -0.83 -0.34 0.00 0.00 178.44 179.79 2wua s GLY 316 N -4.54 -0.23 -0.10 3.75 0.00 -0.97 -2.74 107.32 102.50 2wua s GLY 316 Ca -0.07 0.06 0.03 0.00 0.00 0.00 0.00 44.72 44.74 2wua s GLY 316 CO 0.91 0.01 -0.19 0.14 0.00 0.00 0.00 173.10 173.96 2wua s VAL 317 N -3.53 1.70 0.02 1.40 1.01 0.67 0.34 120.40 122.01 2wua s VAL 317 Ca 0.10 -0.80 -0.30 0.00 0.00 0.00 0.00 61.98 60.98 2wua s VAL 317 Cb -0.03 -1.50 -0.05 0.00 0.00 0.00 0.00 36.38 34.80 2wua s VAL 317 CO 0.02 0.48 1.24 0.12 0.00 0.00 0.00 175.10 176.96 2wua s PHE 318 N 0.58 3.27 -0.07 5.22 5.36 -0.42 -0.10 117.98 131.82 2wua s PHE 318 Ca -0.15 1.18 -0.09 0.00 -0.96 0.00 0.00 56.93 56.92 2wua s PHE 318 Cb -0.17 -3.47 -0.03 0.00 -0.34 0.00 0.00 43.02 39.01 2wua s PHE 318 CO 0.05 -1.53 -0.17 0.54 -1.46 0.00 0.00 175.22 172.65 2wua n ARG 319 N 4.51 0.26 -3.99 10.12 5.12 -0.31 -4.53 116.66 127.84 2wua n ARG 319 Ca 0.10 0.10 -0.09 0.00 -1.93 0.00 0.00 57.85 56.04 2wua n ARG 319 Cb 0.46 -0.91 -0.08 0.00 -1.16 0.00 0.00 32.46 30.76 2wua n ARG 319 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 2wua s THR 320 N -2.11 0.14 -0.04 0.55 -4.23 -1.13 -4.98 115.64 103.84 2wua s THR 320 Ca -0.14 -1.51 -0.03 0.00 -1.18 0.00 0.00 61.69 58.83 2wua s THR 320 Cb 0.02 -1.62 0.01 0.00 1.34 0.00 0.00 72.50 72.26 2wua s THR 320 CO 0.21 -0.63 0.09 0.12 -0.54 0.00 0.00 174.62 173.87 2wua s PHE 321 N -3.93 -0.09 -0.02 3.99 5.36 -1.26 -1.28 117.98 120.74 2wua s PHE 321 Ca 0.11 0.26 0.03 0.00 -0.96 0.00 0.00 56.93 56.38 2wua s PHE 321 Cb 0.06 -0.00 -0.00 0.00 -0.34 0.00 0.00 43.02 42.73 2wua s PHE 321 CO -0.06 -0.07 -0.12 0.00 -1.46 0.00 0.00 175.22 173.51 2wua s ALA 322 N 0.28 1.07 -0.08 11.12 0.00 0.68 -4.89 121.76 129.94 2wua s ALA 322 Ca -0.02 -0.49 0.01 0.00 0.00 0.00 0.00 51.96 51.46 2wua s ALA 322 Cb -0.03 -0.34 0.02 0.00 0.00 0.00 0.00 23.12 22.77 2wua s ALA 322 CO -0.01 0.22 -0.09 0.00 0.00 0.00 0.00 175.76 175.88 2wua s ALA 323 N -0.04 1.21 0.12 0.00 0.00 -1.26 -0.92 121.76 120.87 2wua s ALA 323 Ca 0.00 -0.43 0.04 0.00 0.00 0.00 0.00 51.96 51.58 2wua s ALA 323 Cb -0.08 -0.71 -0.04 0.00 0.00 0.00 0.00 23.12 22.29 2wua s ALA 323 CO 0.00 -0.15 -0.11 0.14 0.00 0.00 0.00 175.76 175.64 2wua s VAL 324 N 1.20 1.07 0.05 0.00 -7.23 0.28 -4.97 120.40 110.80 2wua s VAL 324 Ca -0.05 -1.80 -0.11 0.00 -1.81 0.00 0.00 61.98 58.21 2wua s VAL 324 Cb -0.14 -1.56 -0.06 0.00 0.56 0.00 0.00 36.38 35.18 2wua s VAL 324 CO -0.02 -0.61 0.39 -0.83 -0.31 0.00 0.00 175.10 173.72 2wua s GLY 325 N -2.70 2.37 0.32 2.32 0.00 -1.26 -0.55 107.32 107.82 2wua s GLY 325 Ca 0.10 -0.35 0.03 0.00 0.00 0.00 0.00 44.72 44.51 2wua s GLY 325 CO 0.01 -0.08 0.15 -1.34 0.00 0.00 0.00 173.10 171.83 2wua s VAL 326 N -1.29 0.43 0.14 1.40 -7.23 -0.16 -4.90 120.40 108.79 2wua s VAL 326 Ca 0.29 -2.00 -0.31 0.00 -1.81 0.00 0.00 61.98 58.15 2wua s VAL 326 Cb -0.15 -2.51 -0.10 0.00 0.56 0.00 0.00 36.38 34.19 2wua s VAL 326 CO 0.16 0.00 1.64 -2.84 -0.31 0.00 0.00 175.10 173.75 2wua s PRO 327 N -3.79 4.19 0.43 4.82 0.02 -1.26 -4.55 135.00 134.86 2wua s PRO 327 Ca 0.34 2.40 0.12 0.00 0.02 0.00 0.00 61.00 63.88 2wua s PRO 327 Cb 0.05 -3.33 0.99 0.00 0.02 0.00 0.00 34.50 32.23 2wua s PRO 327 CO 0.17 -0.68 2.00 -1.35 -0.33 0.00 0.00 177.00 176.81 2wua h PRO 328 N 7.44 0.43 0.00 5.54 0.11 -1.84 -2.01 132.00 141.67 2wua h PRO 328 Ca -0.43 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2wua h PRO 328 Cb 1.20 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2wua h PRO 328 CO 0.93 0.28 0.00 0.66 -0.21 0.00 0.00 178.00 179.66 2wua h SER 329 N 0.44 0.00 -1.24 -2.05 4.64 -1.90 -2.90 113.55 110.54 2wua h SER 329 Ca 0.24 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 61.07 2wua h SER 329 Cb 0.38 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 62.06 2wua h SER 329 CO -0.06 0.00 -0.91 2.30 -0.87 0.00 0.00 176.83 177.28 2wua n ILE 330 N -2.93 1.87 0.21 0.95 -5.35 -0.78 -4.37 119.36 108.97 2wua n ILE 330 Ca 0.01 -4.17 0.18 0.00 -0.27 0.00 0.00 62.75 58.51 2wua n ILE 330 Cb 0.30 -0.50 0.83 0.00 -1.74 0.00 0.00 39.64 38.54 2wua n ILE 330 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2wua h MET 331 N 2.69 0.00 0.00 6.28 -0.00 -1.28 -1.84 114.93 120.78 2wua h MET 331 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.85 2wua h MET 331 Cb 1.07 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.67 2wua h MET 331 CO 0.70 0.00 0.06 0.78 -0.00 0.00 0.00 176.91 178.45 2wua h GLY 332 N 0.00 0.00 1.24 -3.00 0.00 -1.88 -1.35 103.07 98.08 2wua h GLY 332 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.42 2wua h GLY 332 CO -0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.54 176.83 2wua n ILE 333 N -2.72 0.05 -0.37 2.60 -5.35 -0.69 -4.37 119.36 108.50 2wua n ILE 333 Ca -0.02 0.01 -0.06 0.00 -0.27 0.00 0.00 62.75 62.41 2wua n ILE 333 Cb 0.12 -0.56 -0.03 0.00 -1.74 0.00 0.00 39.64 37.43 2wua n ILE 333 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2wua n GLY 334 N 0.89 -2.16 0.27 3.28 0.00 -0.51 -0.50 105.19 106.46 2wua n GLY 334 Ca 0.18 1.07 0.04 0.00 0.00 0.00 0.00 46.02 47.32 2wua n GLY 334 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2wua h PRO 335 N 0.00 0.29 0.00 1.61 0.11 -1.76 0.92 132.00 133.17 2wua h PRO 335 Ca 0.24 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.31 2wua h PRO 335 Cb 0.47 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 31.52 2wua h PRO 335 CO -0.90 0.27 -0.00 0.00 -0.21 0.00 0.00 178.00 177.16 2wua h ALA 336 N 1.77 1.21 0.00 -0.75 0.00 -1.10 -0.92 119.26 119.47 2wua h ALA 336 Ca 0.07 -0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.63 2wua h ALA 336 Cb 0.12 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.85 2wua h ALA 336 CO -0.00 0.00 -2.28 0.28 0.00 0.00 0.00 179.25 177.25 2wua n VAL 337 N -3.39 1.28 -0.04 0.00 0.31 -0.47 -4.53 118.33 111.49 2wua n VAL 337 Ca -0.03 -0.46 -0.10 0.00 -0.01 0.00 0.00 64.34 63.74 2wua n VAL 337 Cb 0.08 -1.39 0.04 0.00 -0.91 0.00 0.00 33.84 31.66 2wua n VAL 337 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2wua h ALA 338 N -0.17 0.69 0.01 3.52 0.00 -0.76 -3.15 119.26 119.39 2wua h ALA 338 Ca -0.52 -0.48 -0.00 0.00 0.00 0.00 0.00 54.91 53.92 2wua h ALA 338 Cb 1.72 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.41 2wua h ALA 338 CO -0.14 0.67 -0.00 0.82 0.00 0.00 0.00 179.25 180.60 2wua h ILE 339 N 0.55 1.08 -0.74 0.00 2.04 -1.40 -0.99 117.51 118.05 2wua h ILE 339 Ca 0.03 -0.25 0.07 0.00 1.00 0.00 0.00 64.86 65.72 2wua h ILE 339 Cb 1.02 1.25 -0.05 0.00 -0.74 0.00 0.00 36.82 38.30 2wua h ILE 339 CO 0.10 0.06 0.49 -0.65 0.00 0.00 0.00 178.15 178.15 2wua h PRO 340 N -0.11 0.71 -0.31 2.37 0.11 -1.78 0.25 132.00 133.24 2wua h PRO 340 Ca -0.00 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.03 2wua h PRO 340 Cb 0.11 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.05 2wua h PRO 340 CO 0.00 0.47 0.03 0.00 -0.21 0.00 0.00 178.00 178.30 2wua h ALA 341 N 1.61 0.41 -0.40 -0.75 0.00 -1.42 0.63 119.26 119.34 2wua h ALA 341 Ca 0.33 -0.21 -0.14 0.00 0.00 0.00 0.00 54.91 54.89 2wua h ALA 341 Cb 0.32 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2wua h ALA 341 CO -0.11 0.13 -0.30 0.00 0.00 0.00 0.00 179.25 178.96 2wua h ALA 342 N 0.87 0.72 -0.09 0.00 0.00 -0.83 -1.47 119.26 118.46 2wua h ALA 342 Ca 0.09 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 2wua h ALA 342 Cb 0.38 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 2wua h ALA 342 CO 0.01 0.66 -0.02 0.28 0.00 0.00 0.00 179.25 180.18 2wua h VAL 343 N 0.74 1.30 -0.45 0.00 2.07 -0.88 -2.13 116.25 116.89 2wua h VAL 343 Ca 0.08 -0.95 0.08 0.00 0.82 0.00 0.00 66.70 66.73 2wua h VAL 343 Cb 0.86 1.75 -0.07 0.00 -1.52 0.00 0.00 31.29 32.31 2wua h VAL 343 CO 0.08 0.27 0.01 0.50 0.02 0.00 0.00 177.57 178.44 2wua h LYS 344 N -0.17 0.12 0.00 1.57 3.64 -0.85 -0.77 116.57 120.11 2wua h LYS 344 Ca 0.02 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 2wua h LYS 344 Cb 0.43 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.22 2wua h LYS 344 CO 0.01 0.08 -0.03 0.00 -2.27 0.00 0.00 179.45 177.24 2wua h ALA 345 N 1.39 1.32 -0.01 5.00 0.00 -1.13 -0.15 119.26 125.68 2wua h ALA 345 Ca 0.22 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2wua h ALA 345 Cb 0.32 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2wua h ALA 345 CO -0.36 0.04 -0.05 0.00 0.00 0.00 0.00 179.25 178.88 2wua n ALA 346 N -2.25 2.68 -1.66 0.00 0.00 -0.37 -4.93 120.51 113.99 2wua n ALA 346 Ca -0.03 -0.41 -0.08 0.00 0.00 0.00 0.00 53.44 52.93 2wua n ALA 346 Cb 0.13 -1.20 -0.02 0.00 0.00 0.00 0.00 19.45 18.36 2wua n ALA 346 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wua n GLY 347 N 1.19 0.57 3.73 0.00 0.00 -0.07 -5.03 105.19 105.58 2wua n GLY 347 Ca 0.18 -0.61 -0.29 0.00 0.00 0.00 0.00 46.02 45.31 2wua n GLY 347 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wua s LEU 348 N -2.12 2.73 0.35 0.99 1.43 -0.78 -5.03 118.68 116.25 2wua s LEU 348 Ca 0.00 -1.37 0.09 0.00 -1.03 0.00 0.00 54.13 51.82 2wua s LEU 348 Cb 0.00 -1.02 -0.05 0.00 0.03 0.00 0.00 46.19 45.15 2wua s LEU 348 CO 0.00 -0.68 0.03 -1.10 0.23 0.00 0.00 176.35 174.83 2wua s GLN 349 N -3.88 2.09 0.34 1.70 -1.52 -1.26 -4.05 119.66 113.08 2wua s GLN 349 Ca 0.27 -1.77 0.02 0.00 -1.95 0.00 0.00 55.36 51.94 2wua s GLN 349 Cb 0.04 -1.92 0.62 0.00 -0.22 0.00 0.00 33.01 31.53 2wua s GLN 349 CO 0.15 0.11 1.98 0.82 -0.25 0.00 0.00 175.29 178.10 2wua h ILE 350 N 1.78 1.12 0.00 1.08 2.04 -1.96 -0.22 117.51 121.35 2wua h ILE 350 Ca -0.43 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.13 2wua h ILE 350 Cb 1.25 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 37.48 2wua h ILE 350 CO 0.68 0.16 0.00 0.44 0.00 0.00 0.00 178.15 179.43 2wua h ASP 351 N 0.89 0.00 1.15 1.72 3.32 -1.95 -1.82 116.42 119.73 2wua h ASP 351 Ca 0.28 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.33 2wua h ASP 351 Cb 0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.57 2wua h ASP 351 CO -0.08 0.00 0.00 0.47 -1.72 0.00 0.00 179.24 177.91 2wua n ASP 352 N -2.88 0.77 -4.69 6.45 8.00 -0.09 -4.75 116.55 119.36 2wua n ASP 352 Ca -0.01 0.62 -0.40 0.00 0.71 0.00 0.00 54.79 55.70 2wua n ASP 352 Cb 0.14 -0.81 -0.05 0.00 -0.02 0.00 0.00 41.12 40.39 2wua n ASP 352 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2wua s ILE 353 N -3.20 4.99 -0.04 0.53 -1.09 -0.69 -4.53 121.20 117.16 2wua s ILE 353 Ca 0.08 1.45 0.04 0.00 -2.23 0.00 0.00 60.65 59.99 2wua s ILE 353 Cb 0.11 -4.05 -0.25 0.00 -1.58 0.00 0.00 42.46 36.69 2wua s ILE 353 CO 0.51 0.15 0.66 0.44 -1.23 0.00 0.00 174.94 175.47 2wua h ASP 354 N 7.11 0.19 -3.87 3.58 3.32 -1.46 -3.48 116.42 121.82 2wua h ASP 354 Ca -0.35 -0.37 -0.22 0.00 0.02 0.00 0.00 57.03 56.11 2wua h ASP 354 Cb 1.16 -0.06 -0.27 0.00 0.22 0.00 0.00 39.33 40.38 2wua h ASP 354 CO 0.78 1.33 -0.70 -0.76 -1.72 0.00 0.00 179.24 178.17 2wua s LEU 355 N -6.57 1.96 -0.04 1.55 1.43 -1.10 -4.78 118.68 111.13 2wua s LEU 355 Ca -0.10 -0.02 0.05 0.00 -1.03 0.00 0.00 54.13 53.03 2wua s LEU 355 Cb 0.07 0.07 -0.01 0.00 0.03 0.00 0.00 46.19 46.36 2wua s LEU 355 CO 0.82 -0.04 -0.18 -0.36 0.23 0.00 0.00 176.35 176.81 2wua s PHE 356 N -0.14 1.81 -0.47 0.29 0.08 0.05 -1.14 117.98 118.47 2wua s PHE 356 Ca -0.02 -0.51 -0.07 0.00 0.12 0.00 0.00 56.93 56.45 2wua s PHE 356 Cb -0.01 -1.21 0.12 0.00 -0.57 0.00 0.00 43.02 41.35 2wua s PHE 356 CO -0.00 -0.16 0.32 -1.21 -0.10 0.00 0.00 175.22 174.07 2wua s GLU 357 N -0.04 2.39 -0.25 0.44 0.41 0.90 -0.58 118.70 121.97 2wua s GLU 357 Ca -0.03 -1.83 -0.06 0.00 -0.41 0.00 0.00 54.97 52.65 2wua s GLU 357 Cb -0.11 -3.85 -0.01 0.00 -1.78 0.00 0.00 34.13 28.38 2wua s GLU 357 CO 0.02 -1.17 0.03 0.42 -0.49 0.00 0.00 175.26 174.07 2wua s ILE 358 N 1.23 3.84 0.29 -1.63 1.01 -1.26 -0.81 121.20 123.86 2wua s ILE 358 Ca 0.07 -0.45 -0.30 0.00 0.00 0.00 0.00 60.65 59.97 2wua s ILE 358 Cb -0.25 -2.83 -0.12 0.00 0.01 0.00 0.00 42.46 39.27 2wua s ILE 358 CO -0.02 0.30 1.52 -3.20 0.00 0.00 0.00 174.94 173.54 2wua n ASN 359 N 4.86 3.53 -3.73 3.58 5.15 -0.60 -4.88 115.26 123.17 2wua n ASN 359 Ca -0.16 1.16 -0.42 0.00 -0.60 0.00 0.00 54.58 54.56 2wua n ASN 359 Cb 0.50 -1.55 0.00 0.00 -0.53 0.00 0.00 39.78 38.20 2wua n ASN 359 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2wua n GLU 360 N 1.87 3.80 0.03 1.20 1.02 -1.26 -4.74 120.64 122.55 2wua n GLU 360 Ca 0.08 -3.37 -0.12 0.00 -0.02 0.00 0.00 57.16 53.73 2wua n GLU 360 Cb 0.36 -2.88 -0.08 0.00 -0.02 0.00 0.00 31.44 28.82 2wua n GLU 360 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2wua h ALA 361 N 5.45 -0.01 -3.29 0.62 0.00 -1.95 -3.27 119.26 116.81 2wua h ALA 361 Ca 0.50 -0.08 -0.19 0.00 0.00 0.00 0.00 54.91 55.14 2wua h ALA 361 Cb 0.54 0.00 -0.25 0.00 0.00 0.00 0.00 17.79 18.08 2wua h ALA 361 CO 1.62 -0.43 -0.59 -0.06 0.00 0.00 0.00 179.25 179.79 2wua s PHE 362 N -5.56 -0.03 0.32 0.00 0.08 -1.26 -0.67 117.98 110.86 2wua s PHE 362 Ca -0.14 0.09 0.03 0.00 0.12 0.00 0.00 56.93 57.03 2wua s PHE 362 Cb 0.05 -0.01 0.61 0.00 -0.57 0.00 0.00 43.02 43.10 2wua s PHE 362 CO 0.66 -0.11 1.91 0.00 -0.10 0.00 0.00 175.22 177.58 2wua h ALA 363 N 5.50 1.60 -0.13 5.36 0.00 -1.38 -1.03 119.26 129.18 2wua h ALA 363 Ca -0.27 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.67 2wua h ALA 363 Cb 1.20 -0.23 -0.07 0.00 0.00 0.00 0.00 17.79 18.70 2wua h ALA 363 CO 0.43 0.25 -0.48 0.66 0.00 0.00 0.00 179.25 180.11 2wua h SER 364 N 0.93 -1.51 0.84 0.00 4.64 -1.90 0.18 113.55 116.72 2wua h SER 364 Ca 0.39 0.19 -0.19 0.00 -0.47 0.00 0.00 61.79 61.71 2wua h SER 364 Cb 0.31 0.60 -0.02 0.00 -0.31 0.00 0.00 62.40 62.98 2wua h SER 364 CO -0.16 -0.46 -0.90 0.06 -0.87 0.00 0.00 176.83 174.51 2wua h GLN 365 N -0.54 0.03 -0.17 4.77 -0.00 -1.80 -1.49 115.11 115.91 2wua h GLN 365 Ca 0.06 -0.04 -0.00 0.00 -0.00 0.00 0.00 58.65 58.67 2wua h GLN 365 Cb 0.66 0.01 -0.01 0.00 -0.00 0.00 0.00 27.48 28.14 2wua h GLN 365 CO -0.42 0.90 0.09 0.35 -0.00 0.00 0.00 178.83 179.75 2wua h PHE 366 N 0.01 0.23 -0.41 0.06 3.57 -0.92 -0.01 116.94 119.48 2wua h PHE 366 Ca -0.02 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.40 2wua h PHE 366 Cb 1.57 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 40.23 2wua h PHE 366 CO 0.01 0.23 -0.06 0.28 -2.23 0.00 0.00 178.31 176.54 2wua h VAL 367 N 0.16 1.27 -0.39 1.41 2.07 -0.63 -2.73 116.25 117.42 2wua h VAL 367 Ca 0.06 -1.12 0.03 0.00 0.82 0.00 0.00 66.70 66.48 2wua h VAL 367 Cb 0.08 1.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 2wua h VAL 367 CO -0.01 0.38 0.20 0.22 0.02 0.00 0.00 177.57 178.38 2wua h TYR 368 N 0.58 0.38 -0.90 1.57 3.20 -1.05 -1.75 116.97 119.00 2wua h TYR 368 Ca 0.11 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.00 2wua h TYR 368 Cb 0.56 -0.11 -0.04 0.00 1.54 0.00 0.00 36.73 38.68 2wua h TYR 368 CO 0.04 0.21 0.57 0.00 -1.64 0.00 0.00 178.16 177.34 2wua h GLN 370 N 1.23 0.11 -0.30 0.00 -0.00 -1.13 -1.68 115.11 113.33 2wua h GLN 370 Ca 0.33 -0.01 -0.03 0.00 -0.00 0.00 0.00 58.65 58.93 2wua h GLN 370 Cb -0.09 -0.02 -0.01 0.00 0.00 0.00 0.00 27.48 27.35 2wua h GLN 370 CO -0.07 0.07 0.05 0.87 0.00 0.00 0.00 178.83 179.76 2wua h LYS 371 N 0.11 0.50 -0.59 1.69 1.57 -0.87 -1.68 116.57 117.29 2wua h LYS 371 Ca 0.03 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 2wua h LYS 371 Cb -0.01 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.21 2wua h LYS 371 CO -0.01 0.59 0.32 -0.22 -0.57 0.00 0.00 179.45 179.56 2wua h LYS 372 N 0.32 0.83 -0.00 3.15 1.63 -0.53 -2.26 116.57 119.72 2wua h LYS 372 Ca 0.09 -0.10 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 2wua h LYS 372 Cb 0.33 -0.16 0.00 0.00 -0.60 0.00 0.00 32.23 31.80 2wua h LYS 372 CO 0.00 0.65 -0.11 1.28 -3.45 0.00 0.00 179.45 177.82 2wua n LEU 373 N -4.57 0.22 -3.30 5.20 4.77 -0.64 -4.93 117.00 113.75 2wua n LEU 373 Ca 0.04 0.24 -0.20 0.00 -0.03 0.00 0.00 56.01 56.05 2wua n LEU 373 Cb 0.10 -0.33 0.08 0.00 -2.33 0.00 0.00 43.42 40.94 2wua n LEU 373 CO 0.37 0.05 0.19 -0.62 -1.33 0.00 0.00 177.39 176.05 2wua n GLU 374 N -1.30 -6.95 -3.43 3.23 1.02 -0.68 -4.99 120.64 107.54 2wua n GLU 374 Ca 0.10 0.76 -0.38 0.00 -0.02 0.00 0.00 57.16 57.63 2wua n GLU 374 Cb 0.30 -5.59 -0.06 0.00 -0.02 0.00 0.00 31.44 26.06 2wua n GLU 374 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2wua s ILE 375 N -3.30 5.14 -0.03 -3.67 1.01 -0.90 -5.03 121.20 114.43 2wua s ILE 375 Ca 0.38 0.83 -0.34 0.00 0.00 0.00 0.00 60.65 61.52 2wua s ILE 375 Cb -0.17 -3.74 -0.12 0.00 0.01 0.00 0.00 42.46 38.44 2wua s ILE 375 CO 0.67 0.44 1.79 -0.67 0.00 0.00 0.00 174.94 177.17 2wua n ASP 376 N 2.90 3.30 0.34 3.58 -0.08 -1.26 -4.78 116.55 120.54 2wua n ASP 376 Ca -0.11 1.01 0.23 0.00 -1.51 0.00 0.00 54.79 54.40 2wua n ASP 376 Cb 0.52 -1.38 1.20 0.00 2.34 0.00 0.00 41.12 43.81 2wua n ASP 376 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2wua h PRO 377 N 8.23 0.00 0.00 -0.67 0.11 -1.95 -1.00 132.00 136.71 2wua h PRO 377 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2wua h PRO 377 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2wua h PRO 377 CO 0.93 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.76 2wua n GLN 378 N -3.07 0.20 0.00 1.05 6.02 -1.26 -2.47 117.38 117.85 2wua n GLN 378 Ca -0.03 0.48 0.12 0.00 -0.01 0.00 0.00 57.00 57.56 2wua n GLN 378 Cb 0.08 -1.92 0.12 0.00 1.02 0.00 0.00 30.24 29.53 2wua n GLN 378 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2wua n LYS 379 N -2.29 1.24 -4.48 -1.09 5.02 -0.38 -4.80 118.16 111.38 2wua n LYS 379 Ca 0.01 -0.96 -0.34 0.00 -2.02 0.00 0.00 58.31 55.00 2wua n LYS 379 Cb 0.19 -1.48 -0.12 0.00 -0.02 0.00 0.00 35.03 33.60 2wua n LYS 379 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2wua s ILE 380 N -2.42 3.81 -1.21 -0.18 1.01 -1.03 -0.77 121.20 120.40 2wua s ILE 380 Ca 0.21 -0.40 -0.30 0.00 0.00 0.00 0.00 60.65 60.16 2wua s ILE 380 Cb 0.19 -2.64 0.03 0.00 0.01 0.00 0.00 42.46 40.05 2wua s ILE 380 CO 0.53 0.53 0.68 0.59 0.00 0.00 0.00 174.94 177.26 2wua n ASN 381 N 3.16 -4.15 0.29 3.58 4.13 0.25 -4.80 115.26 117.71 2wua n ASN 381 Ca -0.18 -1.24 0.18 0.00 1.68 0.00 0.00 54.58 55.02 2wua n ASN 381 Cb 0.53 -2.05 0.77 0.00 -1.54 0.00 0.00 39.78 37.49 2wua n ASN 381 CO 0.00 0.00 0.00 -0.37 0.28 0.00 0.00 177.26 177.17 2wua h VAL 382 N -2.45 0.06 -0.46 2.41 -1.51 -1.84 0.13 116.25 112.60 2wua h VAL 382 Ca -0.70 -0.46 -0.05 0.00 -1.23 0.00 0.00 66.70 64.26 2wua h VAL 382 Cb 1.40 1.43 -0.03 0.00 -2.13 0.00 0.00 31.29 31.95 2wua h VAL 382 CO 0.52 0.02 0.05 0.59 -1.23 0.00 0.00 177.57 177.52 2wua n ASN 383 N -3.13 4.57 0.00 4.19 3.02 -1.26 -4.90 115.26 117.74 2wua n ASN 383 Ca -0.00 -3.08 0.00 0.00 -0.03 0.00 0.00 54.58 51.46 2wua n ASN 383 Cb 0.27 -0.63 0.00 0.00 -0.61 0.00 0.00 39.78 38.80 2wua n ASN 383 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wua n GLY 384 N -0.13 -2.82 0.00 7.41 0.00 0.03 -3.34 105.19 106.34 2wua n GLY 384 Ca 0.28 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.59 2wua n GLY 384 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wua n GLY 385 N -0.61 3.47 0.30 -0.02 0.00 -1.26 -4.80 105.19 102.27 2wua n GLY 385 Ca 0.00 -0.87 0.18 0.00 0.00 0.00 0.00 46.02 45.33 2wua n GLY 385 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wua h ALA 386 N 1.80 1.17 0.00 4.61 0.00 -1.80 0.12 119.26 125.16 2wua h ALA 386 Ca 0.00 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2wua h ALA 386 Cb 0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 2wua h ALA 386 CO 0.00 0.04 -0.16 0.52 0.00 0.00 0.00 179.25 179.65 2wua h MET 387 N 0.00 0.00 0.00 0.00 2.86 -1.81 -0.49 114.93 115.49 2wua h MET 387 Ca -0.00 0.00 -0.29 0.00 -2.06 0.00 0.00 59.70 57.35 2wua h MET 387 Cb 0.17 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.78 2wua h MET 387 CO 0.00 0.16 -2.09 0.00 1.06 0.00 0.00 176.91 176.04 2wua n ALA 388 N -2.46 1.60 -0.01 6.32 0.00 -0.22 -4.45 120.51 121.29 2wua n ALA 388 Ca -0.02 -0.91 0.04 0.00 0.00 0.00 0.00 53.44 52.55 2wua n ALA 388 Cb 0.23 -0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.55 2wua n ALA 388 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 2wua n ILE 389 N -2.87 0.62 0.00 0.00 0.13 -0.14 -2.34 119.36 114.75 2wua n ILE 389 Ca -0.31 -0.62 0.00 0.00 -1.10 0.00 0.00 62.75 60.72 2wua n ILE 389 Cb 0.92 -0.28 0.00 0.00 -0.84 0.00 0.00 39.64 39.44 2wua n ILE 389 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 2wua n GLY 390 N 1.39 1.04 2.41 4.50 0.00 -0.22 -4.63 105.19 109.67 2wua n GLY 390 Ca -0.11 -1.92 -0.27 0.00 0.00 0.00 0.00 46.02 43.72 2wua n GLY 390 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2wua n HIS 391 N 1.45 -0.37 -2.32 1.61 -0.00 -0.57 -4.40 115.22 110.62 2wua n HIS 391 Ca 0.00 -3.45 -0.42 0.00 0.46 0.00 0.00 57.72 54.31 2wua n HIS 391 Cb 0.00 0.08 -0.02 0.00 -0.12 0.00 0.00 29.99 29.92 2wua n HIS 391 CO 0.00 0.00 0.00 -1.25 0.46 0.00 0.00 176.34 175.55 2wua s PRO 392 N -0.32 3.35 0.07 1.57 0.05 -1.26 -4.31 135.00 134.15 2wua s PRO 392 Ca 0.33 0.70 -0.14 0.00 0.05 0.00 0.00 61.00 61.94 2wua s PRO 392 Cb 0.05 -4.11 -0.03 0.00 0.05 0.00 0.00 34.50 30.46 2wua s PRO 392 CO -0.18 -1.86 1.14 1.28 0.05 0.00 0.00 177.00 177.42 2wua n LEU 393 N 9.60 -0.48 0.19 -3.56 4.77 -1.26 -0.74 117.00 125.53 2wua n LEU 393 Ca 0.15 1.25 0.05 0.00 -0.03 0.00 0.00 56.01 57.43 2wua n LEU 393 Cb 0.49 -0.32 0.38 0.00 -2.33 0.00 0.00 43.42 41.63 2wua n LEU 393 CO 0.71 -0.88 0.71 1.23 -1.33 0.00 0.00 177.39 177.83 2wua h GLY 394 N 0.00 0.00 1.60 -0.72 0.00 -1.82 -3.07 103.07 99.06 2wua h GLY 394 Ca 0.07 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.24 2wua h GLY 394 CO -0.43 0.00 -0.61 0.00 0.00 0.00 0.00 176.54 175.50 2wua h ALA 395 N 1.64 0.72 -0.42 3.60 0.00 -1.10 -1.69 119.26 122.02 2wua h ALA 395 Ca -0.00 -0.54 0.09 0.00 0.00 0.00 0.00 54.91 54.45 2wua h ALA 395 Cb 0.78 -0.08 -0.09 0.00 0.00 0.00 0.00 17.79 18.41 2wua h ALA 395 CO 0.05 0.72 -0.23 1.15 0.00 0.00 0.00 179.25 180.93 2wua h THR 396 N 0.31 0.35 -0.14 0.00 2.02 -1.30 0.52 112.91 114.67 2wua h THR 396 Ca -0.01 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 2wua h THR 396 Cb 1.15 0.35 -0.01 0.00 -1.74 0.00 0.00 68.15 67.90 2wua h THR 396 CO 0.11 0.00 -0.08 1.23 0.37 0.00 0.00 175.52 177.14 2wua h GLY 397 N -0.16 0.22 0.83 2.16 0.00 -1.78 -0.53 103.07 103.82 2wua h GLY 397 Ca 0.20 -0.12 -0.22 0.00 0.00 0.00 0.00 47.33 47.19 2wua h GLY 397 CO -0.51 0.11 -0.93 0.00 0.00 0.00 0.00 176.54 175.21 2wua h ALA 398 N 1.72 -0.08 0.00 3.60 0.00 -1.40 -3.24 119.26 119.86 2wua h ALA 398 Ca 0.04 -0.72 -0.07 0.00 0.00 0.00 0.00 54.91 54.17 2wua h ALA 398 Cb 0.28 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2wua h ALA 398 CO 0.01 0.45 -0.33 0.07 0.00 0.00 0.00 179.25 179.45 2wua h ARG 399 N -0.21 0.00 0.00 0.00 -0.00 -0.65 -2.24 114.38 111.27 2wua h ARG 399 Ca -0.16 0.00 -0.05 0.00 -0.00 0.00 0.00 59.98 59.77 2wua h ARG 399 Cb 1.72 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 31.68 2wua h ARG 399 CO 0.18 0.33 -0.26 0.00 -0.00 0.00 0.00 179.97 180.22 2wua h VAL 401 N 0.00 1.26 -0.38 0.00 2.07 -1.42 -0.37 116.25 117.41 2wua h VAL 401 Ca -0.00 -1.07 -0.03 0.00 0.82 0.00 0.00 66.70 66.41 2wua h VAL 401 Cb 0.68 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 2wua h VAL 401 CO 0.03 0.37 0.12 0.00 0.02 0.00 0.00 177.57 178.11 2wua h ALA 402 N 0.92 0.50 -0.34 1.67 0.00 -1.35 -0.70 119.26 119.96 2wua h ALA 402 Ca 0.13 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2wua h ALA 402 Cb 0.52 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2wua h ALA 402 CO 0.03 0.14 0.19 1.15 0.00 0.00 0.00 179.25 180.76 2wua h THR 403 N 0.47 1.13 0.30 0.00 2.02 -1.11 -1.10 112.91 114.62 2wua h THR 403 Ca 0.12 -0.34 -0.01 0.00 0.77 0.00 0.00 66.41 66.94 2wua h THR 403 Cb 0.26 0.74 0.00 0.00 -1.74 0.00 0.00 68.15 67.41 2wua h THR 403 CO -0.00 0.14 -0.15 0.25 0.37 0.00 0.00 175.52 176.13 2wua h LEU 404 N 0.43 -0.35 -0.55 2.58 5.85 -1.00 -2.48 115.31 119.79 2wua h LEU 404 Ca 0.12 -0.06 -0.10 0.00 0.84 0.00 0.00 57.88 58.68 2wua h LEU 404 Cb 0.05 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 2wua h LEU 404 CO -0.02 -0.15 -0.04 -0.07 -0.34 0.00 0.00 178.44 177.81 2wua h LEU 405 N -0.52 1.00 -0.85 2.25 3.38 -0.96 0.28 115.31 119.89 2wua h LEU 405 Ca -0.04 -0.33 -0.08 0.00 0.09 0.00 0.00 57.88 57.52 2wua h LEU 405 Cb 0.39 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 2wua h LEU 405 CO 0.07 1.08 -0.03 0.45 0.09 0.00 0.00 178.44 180.11 2wua h HIS 406 N 0.89 0.89 -0.34 1.13 3.86 -1.27 -1.25 115.15 119.05 2wua h HIS 406 Ca 0.15 -0.14 -0.15 0.00 -1.16 0.00 0.00 60.37 59.07 2wua h HIS 406 Cb 0.60 -0.24 -0.01 0.00 1.06 0.00 0.00 27.41 28.82 2wua h HIS 406 CO 0.04 0.83 -0.39 1.49 0.86 0.00 0.00 177.93 180.76 2wua h GLU 407 N 0.77 0.83 -0.78 2.45 4.57 -1.07 -1.97 114.58 119.38 2wua h GLU 407 Ca 0.14 -0.44 0.03 0.00 -1.18 0.00 0.00 59.36 57.92 2wua h GLU 407 Cb 0.50 0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 29.06 2wua h GLU 407 CO 0.03 1.07 0.50 0.52 -1.18 0.00 0.00 179.01 179.95 2wua h MET 408 N 0.68 0.94 -0.24 1.92 2.86 -0.77 -1.17 114.93 119.16 2wua h MET 408 Ca 0.06 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 2wua h MET 408 Cb 0.96 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 32.40 2wua h MET 408 CO 0.09 0.62 0.13 -0.22 1.06 0.00 0.00 176.91 178.59 2wua h LYS 409 N 0.97 0.33 0.00 1.72 3.64 -1.09 -2.75 116.57 119.39 2wua h LYS 409 Ca 0.31 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.60 2wua h LYS 409 Cb 0.02 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 2wua h LYS 409 CO -0.11 0.31 -0.25 -0.09 -2.27 0.00 0.00 179.45 177.03 2wua h ARG 410 N 0.27 0.00 0.00 1.90 2.43 -0.95 -2.29 114.38 115.75 2wua h ARG 410 Ca 0.08 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 2wua h ARG 410 Cb 0.07 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 2wua h ARG 410 CO -0.01 0.25 -0.01 0.54 -1.51 0.00 0.00 179.97 179.23 2wua n ARG 411 N -4.21 0.20 0.00 0.20 1.74 -0.48 -5.03 116.66 109.07 2wua n ARG 411 Ca -0.02 0.16 0.00 0.00 -0.77 0.00 0.00 57.85 57.22 2wua n ARG 411 Cb 0.31 -1.73 0.00 0.00 -1.02 0.00 0.00 32.46 30.02 2wua n ARG 411 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wua n GLY 412 N 1.36 -2.70 0.40 -0.13 0.00 -0.86 -4.55 105.19 98.70 2wua n GLY 412 Ca 0.06 -1.71 0.19 0.00 0.00 0.00 0.00 46.02 44.55 2wua n GLY 412 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2wua h ARG 413 N 0.00 0.37 0.00 1.61 3.08 -1.88 0.29 114.38 117.86 2wua h ARG 413 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2wua h ARG 413 Cb 0.00 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 29.97 2wua h ARG 413 CO 0.00 0.25 0.00 -0.44 -1.07 0.00 0.00 179.97 178.71 2wua h ASP 414 N 0.38 0.00 -2.36 7.04 3.32 -1.95 -3.35 116.42 119.50 2wua h ASP 414 Ca 0.44 0.00 -0.72 0.00 0.02 0.00 0.00 57.03 56.77 2wua h ASP 414 Cb 1.10 0.00 -0.18 0.00 0.22 0.00 0.00 39.33 40.47 2wua h ASP 414 CO -0.15 0.00 1.06 0.00 -1.72 0.00 0.00 179.24 178.43 2wua n ARG 416 N 5.93 0.71 -5.02 0.00 0.63 -1.26 -4.55 116.66 113.10 2wua n ARG 416 Ca 0.30 0.21 -0.28 0.00 -0.92 0.00 0.00 57.85 57.16 2wua n ARG 416 Cb 0.46 -1.63 -0.15 0.00 0.45 0.00 0.00 32.46 31.59 2wua n ARG 416 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 2wua s PHE 417 N -2.54 2.04 0.09 -0.14 0.08 -1.26 0.04 117.98 116.28 2wua s PHE 417 Ca -0.28 -0.39 0.02 0.00 0.12 0.00 0.00 56.93 56.40 2wua s PHE 417 Cb 0.08 -1.28 -0.04 0.00 -0.57 0.00 0.00 43.02 41.20 2wua s PHE 417 CO 0.70 0.01 -0.07 0.20 -0.10 0.00 0.00 175.22 175.96 2wua s GLY 418 N -0.73 0.74 -0.02 4.36 0.00 -0.18 -1.22 107.32 110.28 2wua s GLY 418 Ca 0.09 -1.30 0.03 0.00 0.00 0.00 0.00 44.72 43.53 2wua s GLY 418 CO -0.00 -1.41 -0.10 0.14 0.00 0.00 0.00 173.10 171.73 2wua s VAL 419 N -3.48 0.86 -0.15 1.40 1.01 -0.29 -0.24 120.40 119.51 2wua s VAL 419 Ca 0.10 -0.43 -0.04 0.00 0.00 0.00 0.00 61.98 61.62 2wua s VAL 419 Cb 0.04 -0.74 -0.03 0.00 0.00 0.00 0.00 36.38 35.65 2wua s VAL 419 CO -0.05 0.26 -0.03 -0.69 0.00 0.00 0.00 175.10 174.59 2wua s VAL 420 N 0.00 3.98 0.02 2.92 1.01 -0.69 -0.07 120.40 127.57 2wua s VAL 420 Ca -0.00 -0.33 -0.14 0.00 0.00 0.00 0.00 61.98 61.50 2wua s VAL 420 Cb -0.07 -2.74 0.02 0.00 0.00 0.00 0.00 36.38 33.59 2wua s VAL 420 CO 0.00 0.50 0.31 -0.55 0.00 0.00 0.00 175.10 175.36 2wua s SER 421 N 0.26 -0.15 0.02 3.32 0.15 0.01 -1.06 113.70 116.24 2wua s SER 421 Ca -0.02 -0.07 -0.21 0.00 0.70 0.00 0.00 55.95 56.35 2wua s SER 421 Cb -0.14 0.34 0.04 0.00 -1.71 0.00 0.00 66.02 64.55 2wua s SER 421 CO 0.03 -0.54 0.47 0.00 1.20 0.00 0.00 173.24 174.39 2wua s MET 422 N -2.02 0.93 0.73 5.44 0.23 -0.84 -1.55 119.30 122.22 2wua s MET 422 Ca -0.09 -0.20 -0.11 0.00 -1.03 0.00 0.00 55.69 54.26 2wua s MET 422 Cb -0.03 0.42 0.03 0.00 -1.53 0.00 0.00 34.83 33.72 2wua s MET 422 CO 0.00 -0.31 1.08 0.00 -2.03 0.00 0.00 175.02 173.76 2wua s ILE 424 N -3.14 -0.10 0.49 0.00 1.01 -0.39 -4.62 121.20 114.45 2wua s ILE 424 Ca 0.59 0.30 -0.22 0.00 0.00 0.00 0.00 60.65 61.31 2wua s ILE 424 Cb -0.14 -0.15 -0.08 0.00 0.01 0.00 0.00 42.46 42.10 2wua s ILE 424 CO 0.54 0.12 1.02 0.61 0.00 0.00 0.00 174.94 177.24 2wua n GLY 425 N 4.67 -0.16 2.61 6.18 0.00 -1.26 -1.83 105.19 115.40 2wua n GLY 425 Ca -0.17 0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.90 2wua n GLY 425 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wua n THR 426 N -0.89 0.00 -0.44 2.61 -2.24 -1.26 -4.54 114.28 107.52 2wua n THR 426 Ca 0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 2wua n THR 426 Cb 0.42 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.65 2wua n THR 426 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wua n GLY 427 N -2.14 0.75 3.19 3.38 0.00 -0.76 -4.36 105.19 105.24 2wua n GLY 427 Ca 0.00 -0.64 -0.11 0.00 0.00 0.00 0.00 46.02 45.28 2wua n GLY 427 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2wua s MET 428 N -2.29 1.09 0.04 1.61 1.00 -0.78 -0.98 119.30 118.99 2wua s MET 428 Ca 0.00 -1.53 0.00 0.00 0.00 0.00 0.00 55.69 54.17 2wua s MET 428 Cb 0.00 0.27 -0.03 0.00 0.00 0.00 0.00 34.83 35.07 2wua s MET 428 CO 0.00 -0.34 -0.04 0.20 0.00 0.00 0.00 175.02 174.84 2wua s GLY 429 N -3.10 0.41 0.02 -0.03 0.00 0.29 -1.26 107.32 103.64 2wua s GLY 429 Ca 0.32 -0.86 -0.01 0.00 0.00 0.00 0.00 44.72 44.17 2wua s GLY 429 CO 0.07 -0.94 -0.01 0.00 0.00 0.00 0.00 173.10 172.22 2wua s ALA 430 N -2.29 0.06 -0.13 3.20 0.00 -0.99 -0.55 121.76 121.05 2wua s ALA 430 Ca -0.06 -0.47 -0.15 0.00 0.00 0.00 0.00 51.96 51.28 2wua s ALA 430 Cb -0.04 0.12 0.04 0.00 0.00 0.00 0.00 23.12 23.24 2wua s ALA 430 CO -0.03 -0.14 0.41 0.00 0.00 0.00 0.00 175.76 176.00 2wua s ALA 431 N -1.26 -1.03 0.02 0.00 0.00 -0.10 -1.98 121.76 117.42 2wua s ALA 431 Ca -0.14 1.07 0.06 0.00 0.00 0.00 0.00 51.96 52.95 2wua s ALA 431 Cb -0.08 -0.56 -0.02 0.00 0.00 0.00 0.00 23.12 22.46 2wua s ALA 431 CO -0.01 -0.21 -0.17 0.00 0.00 0.00 0.00 175.76 175.37 2wua s ALA 432 N -0.05 1.43 -0.19 0.00 0.00 -0.23 -0.23 121.76 122.50 2wua s ALA 432 Ca -0.02 -0.86 -0.07 0.00 0.00 0.00 0.00 51.96 51.00 2wua s ALA 432 Cb -0.03 -0.29 -0.04 0.00 0.00 0.00 0.00 23.12 22.76 2wua s ALA 432 CO 0.01 0.32 0.05 0.08 0.00 0.00 0.00 175.76 176.23 2wua s VAL 433 N -0.68 4.66 0.15 0.00 1.01 -0.40 -1.71 120.40 123.44 2wua s VAL 433 Ca 0.05 -0.08 0.10 0.00 0.00 0.00 0.00 61.98 62.06 2wua s VAL 433 Cb -0.08 -3.10 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 2wua s VAL 433 CO 0.01 0.45 -0.22 -0.36 0.00 0.00 0.00 175.10 174.98 2wua s PHE 434 N 0.49 2.40 0.09 5.22 0.08 0.66 -1.16 117.98 125.77 2wua s PHE 434 Ca 0.02 -0.33 0.07 0.00 0.12 0.00 0.00 56.93 56.81 2wua s PHE 434 Cb -0.13 -1.25 -0.04 0.00 -0.57 0.00 0.00 43.02 41.04 2wua s PHE 434 CO 0.01 0.42 -0.10 -2.00 -0.10 0.00 0.00 175.22 173.45 2wua s GLU 435 N -2.35 2.18 0.50 0.44 2.12 0.86 -1.01 118.70 121.44 2wua s GLU 435 Ca 0.18 -0.99 -0.19 0.00 0.36 0.00 0.00 54.97 54.33 2wua s GLU 435 Cb -0.09 -2.33 -0.12 0.00 0.26 0.00 0.00 34.13 31.85 2wua s GLU 435 CO 0.09 0.52 0.25 2.89 -0.54 0.00 0.00 175.26 178.47 2wua n ARG 436 N 0.81 0.29 0.00 4.30 1.85 0.11 -0.24 116.66 123.77 2wua n ARG 436 Ca -0.14 0.11 0.00 0.00 -1.00 0.00 0.00 57.85 56.82 2wua n ARG 436 Cb 0.52 -1.34 0.00 0.00 -1.05 0.00 0.00 32.46 30.59 2wua n ARG 436 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2wua n GLY 437 N 2.10 2.53 0.00 2.89 0.00 -1.11 -4.27 105.19 107.33 2wua n GLY 437 Ca 0.10 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 44.11 2wua n GLY 437 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54