#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wug s THR 8 N 0.00 1.15 0.21 -5.08 -4.23 -1.26 -5.01 115.64 101.43 2wug s THR 8 Ca 0.00 -2.03 -0.09 0.00 -1.18 0.00 0.00 61.69 58.39 2wug s THR 8 Cb 0.00 -2.60 0.15 0.00 1.34 0.00 0.00 72.50 71.40 2wug s THR 8 CO 0.00 -0.14 1.75 0.15 -0.54 0.00 0.00 174.62 175.84 2wug h PHE 9 N 2.27 0.46 -0.11 3.99 3.57 -2.02 -2.55 116.94 122.57 2wug h PHE 9 Ca -0.40 0.03 -0.22 0.00 3.53 0.00 0.00 57.97 60.92 2wug h PHE 9 Cb 1.24 -0.11 0.01 0.00 2.79 0.00 0.00 35.95 39.87 2wug h PHE 9 CO 0.58 0.14 -0.80 0.93 -2.23 0.00 0.00 178.31 176.93 2wug h GLU 10 N 0.46 0.64 0.00 1.11 3.07 -1.96 -2.56 114.58 115.34 2wug h GLU 10 Ca 0.32 -0.55 -0.10 0.00 -0.50 0.00 0.00 59.36 58.53 2wug h GLU 10 Cb 0.38 0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 28.39 2wug h GLU 10 CO -0.29 1.16 -0.47 0.66 -1.40 0.00 0.00 179.01 178.67 2wug h SER 11 N 0.43 0.00 0.26 1.42 4.64 -1.90 -3.15 113.55 115.24 2wug h SER 11 Ca -0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 2wug h SER 11 Cb 1.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.51 2wug h SER 11 CO 0.15 0.47 -1.08 0.35 -0.87 0.00 0.00 176.83 175.86 2wug n THR 12 N -3.74 0.08 -1.75 2.95 -2.24 -0.98 -4.95 114.28 103.66 2wug n THR 12 Ca -0.01 -0.17 -0.42 0.00 -2.27 0.00 0.00 64.05 61.18 2wug n THR 12 Cb 0.53 0.43 -0.01 0.00 -2.10 0.00 0.00 70.33 69.17 2wug n THR 12 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2wug n SER 13 N -1.81 3.85 -3.96 3.42 2.88 -0.97 -0.85 113.62 116.18 2wug n SER 13 Ca 0.02 1.15 -0.08 0.00 -1.33 0.00 0.00 58.87 58.63 2wug n SER 13 Cb 0.41 -1.59 -0.09 0.00 -0.75 0.00 0.00 64.21 62.19 2wug n SER 13 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2wug s ARG 14 N -0.57 0.69 0.02 -1.46 1.81 0.89 -4.89 118.95 115.44 2wug s ARG 14 Ca 0.64 -0.99 0.04 0.00 -1.72 0.00 0.00 55.73 53.69 2wug s ARG 14 Cb -0.50 0.27 -0.02 0.00 -0.45 0.00 0.00 34.95 34.25 2wug s ARG 14 CO 0.49 -0.18 -0.11 -0.06 -0.68 0.00 0.00 175.30 174.76 2wug s PHE 15 N -3.53 0.96 0.03 -0.53 0.08 -1.26 -1.11 117.98 112.62 2wug s PHE 15 Ca 0.03 -0.30 0.01 0.00 0.12 0.00 0.00 56.93 56.79 2wug s PHE 15 Cb 0.04 -0.58 -0.02 0.00 -0.57 0.00 0.00 43.02 41.89 2wug s PHE 15 CO -0.09 -0.00 -0.05 0.00 -0.10 0.00 0.00 175.22 174.97 2wug s ALA 16 N -0.71 0.38 -0.25 5.36 0.00 -0.06 -4.99 121.76 121.49 2wug s ALA 16 Ca 0.00 -0.58 -0.06 0.00 0.00 0.00 0.00 51.96 51.33 2wug s ALA 16 Cb -0.07 0.05 -0.01 0.00 0.00 0.00 0.00 23.12 23.09 2wug s ALA 16 CO 0.01 -0.04 0.02 -2.00 0.00 0.00 0.00 175.76 173.75 2wug s GLU 17 N -1.21 3.41 0.44 0.00 2.12 -1.26 -0.47 118.70 121.73 2wug s GLU 17 Ca -0.09 -0.62 0.06 0.00 0.36 0.00 0.00 54.97 54.68 2wug s GLU 17 Cb -0.08 -3.20 -0.04 0.00 0.26 0.00 0.00 34.13 31.07 2wug s GLU 17 CO -0.00 -0.25 0.17 0.14 -0.54 0.00 0.00 175.26 174.78 2wug s VAL 18 N 1.53 2.09 -0.29 3.70 -7.23 -0.17 -4.89 120.40 115.14 2wug s VAL 18 Ca 0.05 -1.73 -0.06 0.00 -1.81 0.00 0.00 61.98 58.43 2wug s VAL 18 Cb -0.15 -2.82 0.01 0.00 0.56 0.00 0.00 36.38 33.98 2wug s VAL 18 CO 0.00 0.00 0.07 -0.62 -0.31 0.00 0.00 175.10 174.24 2wug s ASP 19 N -3.93 5.06 -0.36 4.85 2.15 -1.26 -0.23 116.67 122.96 2wug s ASP 19 Ca 0.36 -0.69 -0.00 0.00 0.43 0.00 0.00 52.55 52.65 2wug s ASP 19 Cb 0.03 -1.87 0.12 0.00 -0.30 0.00 0.00 42.92 40.91 2wug s ASP 19 CO 0.20 -0.18 0.18 -0.69 -0.17 0.00 0.00 175.17 174.52 2wug s VAL 20 N 1.49 0.55 -1.50 1.11 1.01 -1.26 -4.75 120.40 117.05 2wug s VAL 20 Ca 0.03 -1.70 -0.09 0.00 0.00 0.00 0.00 61.98 60.22 2wug s VAL 20 Cb -0.17 -1.41 0.07 0.00 0.00 0.00 0.00 36.38 34.87 2wug s VAL 20 CO 0.02 -0.87 0.74 0.47 0.00 0.00 0.00 175.10 175.47 2wug n ASP 21 N 4.27 -2.66 0.00 3.32 8.00 -1.26 -4.71 116.55 123.51 2wug n ASP 21 Ca 0.06 -0.90 0.00 0.00 0.71 0.00 0.00 54.79 54.66 2wug n ASP 21 Cb 0.38 -3.43 0.00 0.00 -0.02 0.00 0.00 41.12 38.05 2wug n ASP 21 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wug n GLY 22 N -1.68 2.48 3.58 0.44 0.00 -1.26 -5.03 105.19 103.72 2wug n GLY 22 Ca -0.10 -2.05 -0.51 0.00 0.00 0.00 0.00 46.02 43.36 2wug n GLY 22 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2wug n PRO 23 N -0.09 1.10 -3.70 1.61 -0.02 -1.26 -4.39 135.00 128.25 2wug n PRO 23 Ca 0.00 0.39 -0.22 0.00 -2.02 0.00 0.00 63.50 61.65 2wug n PRO 23 Cb 0.00 -1.97 -0.18 0.00 -0.02 0.00 0.00 33.50 31.34 2wug n PRO 23 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2wug s LEU 24 N 0.56 0.37 -0.11 2.45 2.96 0.68 -4.83 118.68 120.76 2wug s LEU 24 Ca 0.80 -0.10 -0.26 0.00 -0.22 0.00 0.00 54.13 54.35 2wug s LEU 24 Cb -0.93 -0.28 -0.02 0.00 0.50 0.00 0.00 46.19 45.47 2wug s LEU 24 CO 0.49 -0.25 0.82 -0.75 -1.32 0.00 0.00 176.35 175.35 2wug s LYS 25 N 2.08 4.38 -0.13 1.98 2.20 -1.26 -1.00 119.74 127.99 2wug s LYS 25 Ca 0.04 1.05 0.01 0.00 -0.36 0.00 0.00 55.97 56.72 2wug s LYS 25 Cb -0.13 -3.52 -0.01 0.00 -1.51 0.00 0.00 37.83 32.66 2wug s LYS 25 CO -0.05 -0.18 -0.17 -0.51 -0.36 0.00 0.00 175.35 174.08 2wug s LEU 26 N 1.62 2.44 -0.06 5.43 1.43 0.38 -0.65 118.68 129.27 2wug s LEU 26 Ca 0.40 -0.45 -0.08 0.00 -1.03 0.00 0.00 54.13 52.98 2wug s LEU 26 Cb -0.18 -1.53 -0.04 0.00 0.03 0.00 0.00 46.19 44.47 2wug s LEU 26 CO 0.16 0.14 0.22 -2.28 0.23 0.00 0.00 176.35 174.82 2wug s HIS 27 N 0.49 3.61 0.26 0.29 5.65 -1.26 -0.88 115.29 123.45 2wug s HIS 27 Ca -0.12 0.59 -0.11 0.00 0.25 0.00 0.00 55.06 55.68 2wug s HIS 27 Cb -0.16 -1.99 -0.00 0.00 -1.18 0.00 0.00 32.58 29.24 2wug s HIS 27 CO 0.05 0.68 0.47 1.52 -0.65 0.00 0.00 174.74 176.81 2wug s TYR 28 N -1.14 0.50 -0.06 3.88 1.13 -0.26 -0.88 117.35 120.52 2wug s TYR 28 Ca 0.21 -0.85 0.06 0.00 -1.41 0.00 0.00 57.07 55.08 2wug s TYR 28 Cb -0.13 0.13 -0.01 0.00 -1.10 0.00 0.00 41.96 40.85 2wug s TYR 28 CO 0.10 -1.02 -0.25 -1.01 -2.51 0.00 0.00 175.55 170.87 2wug s HIS 29 N -3.81 2.46 -0.06 -3.49 3.76 0.57 -0.08 115.29 114.64 2wug s HIS 29 Ca 0.24 -0.75 0.06 0.00 -0.15 0.00 0.00 55.06 54.46 2wug s HIS 29 Cb -0.00 -1.61 -0.01 0.00 1.11 0.00 0.00 32.58 32.06 2wug s HIS 29 CO 0.11 -0.23 -0.24 -2.00 -0.85 0.00 0.00 174.74 171.53 2wug s GLU 30 N -0.11 2.54 0.26 1.40 2.12 -0.03 -0.59 118.70 124.27 2wug s GLU 30 Ca -0.05 -0.88 -0.15 0.00 0.36 0.00 0.00 54.97 54.25 2wug s GLU 30 Cb -0.14 -2.19 0.00 0.00 0.26 0.00 0.00 34.13 32.06 2wug s GLU 30 CO 0.04 0.41 0.55 0.00 -0.54 0.00 0.00 175.26 175.72 2wug s ALA 31 N -0.24 -0.52 -1.37 6.30 0.00 -0.48 -4.57 121.76 120.88 2wug s ALA 31 Ca -0.01 -0.72 0.00 0.00 0.00 0.00 0.00 51.96 51.23 2wug s ALA 31 Cb -0.13 1.01 0.00 0.00 0.00 0.00 0.00 23.12 24.00 2wug s ALA 31 CO 0.03 -0.91 0.00 0.41 0.00 0.00 0.00 175.76 175.29 2wug n GLY 32 N -0.40 0.93 3.66 0.00 0.00 -1.26 -0.26 105.19 107.85 2wug n GLY 32 Ca -0.02 -0.36 -0.45 0.00 0.00 0.00 0.00 46.02 45.18 2wug n GLY 32 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2wug n VAL 33 N -3.04 0.96 0.00 1.61 0.31 -1.26 -0.74 118.33 116.17 2wug n VAL 33 Ca -0.15 -0.24 0.00 0.00 -0.01 0.00 0.00 64.34 63.95 2wug n VAL 33 Cb 0.50 -1.38 0.00 0.00 -0.91 0.00 0.00 33.84 32.06 2wug n VAL 33 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2wug n GLY 34 N 2.11 1.72 3.80 2.92 0.00 -1.26 -5.05 105.19 109.43 2wug n GLY 34 Ca 0.12 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 2wug n GLY 34 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wug s ASN 35 N -1.52 6.84 0.04 1.61 0.01 0.09 -5.00 114.94 117.00 2wug s ASN 35 Ca 0.00 1.88 -0.20 0.00 -0.71 0.00 0.00 52.86 53.83 2wug s ASN 35 Cb 0.00 -2.57 -0.15 0.00 0.41 0.00 0.00 41.25 38.94 2wug s ASN 35 CO 0.00 -0.43 1.30 -0.78 -1.51 0.00 0.00 177.10 175.68 2wug h ASP 36 N 2.26 0.44 -3.47 -1.22 3.58 -1.88 -3.39 116.42 112.73 2wug h ASP 36 Ca -0.48 -0.54 -0.62 0.00 0.42 0.00 0.00 57.03 55.81 2wug h ASP 36 Cb 1.20 -0.13 -0.15 0.00 1.72 0.00 0.00 39.33 41.97 2wug h ASP 36 CO 0.62 0.89 -0.53 -1.58 -2.88 0.00 0.00 179.24 175.76 2wug s GLN 37 N -4.08 4.03 0.23 0.28 0.74 -1.26 -4.93 119.66 114.67 2wug s GLN 37 Ca -0.14 -0.30 -0.21 0.00 0.05 0.00 0.00 55.36 54.76 2wug s GLN 37 Cb 0.05 -3.42 -0.08 0.00 1.10 0.00 0.00 33.01 30.65 2wug s GLN 37 CO 0.77 0.13 0.76 0.99 -0.55 0.00 0.00 175.29 177.39 2wug s THR 38 N 0.83 4.50 -0.01 -0.34 2.01 -1.26 -0.45 115.64 120.93 2wug s THR 38 Ca 0.06 1.40 0.00 0.00 0.31 0.00 0.00 61.69 63.47 2wug s THR 38 Cb -0.13 -3.90 0.01 0.00 0.01 0.00 0.00 72.50 68.48 2wug s THR 38 CO 0.02 0.22 -0.01 0.68 -0.69 0.00 0.00 174.62 174.85 2wug s VAL 39 N -1.51 0.09 -0.16 3.82 -7.23 0.20 -4.11 120.40 111.50 2wug s VAL 39 Ca 0.44 -0.00 -0.05 0.00 -1.81 0.00 0.00 61.98 60.55 2wug s VAL 39 Cb -0.17 -0.12 -0.03 0.00 0.56 0.00 0.00 36.38 36.61 2wug s VAL 39 CO 0.22 0.05 0.02 -0.69 -0.31 0.00 0.00 175.10 174.39 2wug s VAL 40 N 0.26 4.39 -0.12 1.32 1.01 -0.92 -1.17 120.40 125.17 2wug s VAL 40 Ca -0.02 -0.18 -0.02 0.00 0.00 0.00 0.00 61.98 61.75 2wug s VAL 40 Cb -0.04 -2.94 -0.03 0.00 0.00 0.00 0.00 36.38 33.37 2wug s VAL 40 CO -0.01 0.49 -0.04 -0.76 0.00 0.00 0.00 175.10 174.79 2wug s LEU 41 N 0.23 3.30 -0.17 3.92 1.43 0.10 -0.53 118.68 126.96 2wug s LEU 41 Ca 0.01 -0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.06 2wug s LEU 41 Cb -0.13 -1.77 0.03 0.00 0.03 0.00 0.00 46.19 44.35 2wug s LEU 41 CO 0.01 0.25 -0.12 -0.76 0.23 0.00 0.00 176.35 175.97 2wug s LEU 42 N -0.13 1.88 0.88 1.79 1.43 0.69 -1.67 118.68 123.55 2wug s LEU 42 Ca 0.03 -0.64 -0.13 0.00 -1.03 0.00 0.00 54.13 52.35 2wug s LEU 42 Cb -0.13 -1.16 0.13 0.00 0.03 0.00 0.00 46.19 45.06 2wug s LEU 42 CO 0.02 -0.10 1.22 -1.38 0.23 0.00 0.00 176.35 176.34 2wug s HIS 43 N 1.48 2.41 0.90 0.29 -3.43 -1.26 -1.81 115.29 113.87 2wug s HIS 43 Ca 0.02 0.62 -0.13 0.00 -0.80 0.00 0.00 55.06 54.77 2wug s HIS 43 Cb -0.14 -3.68 0.17 0.00 -1.43 0.00 0.00 32.58 27.49 2wug s HIS 43 CO -0.09 -2.18 1.25 0.20 -2.00 0.00 0.00 174.74 171.92 2wug s GLY 44 N -4.60 1.75 -0.25 -1.38 0.00 -1.20 -2.16 107.32 99.48 2wug s GLY 44 Ca 0.66 -1.18 0.13 0.00 0.00 0.00 0.00 44.72 44.34 2wug s GLY 44 CO 0.51 -0.48 1.66 0.61 0.00 0.00 0.00 173.10 175.40 2wug n GLY 45 N -3.56 3.63 3.73 0.20 0.00 -1.26 -4.71 105.19 103.21 2wug n GLY 45 Ca 0.14 -1.00 -0.31 0.00 0.00 0.00 0.00 46.02 44.85 2wug n GLY 45 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wug s GLY 46 N -1.31 1.67 0.14 -0.02 0.00 -1.26 -4.91 107.32 101.64 2wug s GLY 46 Ca 0.51 0.31 -0.31 0.00 0.00 0.00 0.00 44.72 45.22 2wug s GLY 46 CO 0.12 0.69 1.76 -4.14 0.00 0.00 0.00 173.10 171.54 2wug s PRO 47 N -4.83 4.15 0.00 2.90 0.02 -1.26 -1.42 135.00 134.55 2wug s PRO 47 Ca 0.63 2.55 0.00 0.00 0.02 0.00 0.00 61.00 64.20 2wug s PRO 47 Cb -0.19 -3.45 0.00 0.00 0.02 0.00 0.00 34.50 30.88 2wug s PRO 47 CO 0.57 -0.79 0.00 0.41 -0.33 0.00 0.00 177.00 176.86 2wug n GLY 48 N 4.11 0.43 3.79 0.52 0.00 -1.26 -4.69 105.19 108.09 2wug n GLY 48 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 2wug n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wug s ALA 49 N -1.96 3.03 0.36 4.61 0.00 -0.51 -4.82 121.76 122.46 2wug s ALA 49 Ca 0.00 0.66 -0.17 0.00 0.00 0.00 0.00 51.96 52.45 2wug s ALA 49 Cb 0.00 -3.26 0.05 0.00 0.00 0.00 0.00 23.12 19.91 2wug s ALA 49 CO 0.00 -0.22 0.79 0.00 0.00 0.00 0.00 175.76 176.33 2wug s ALA 50 N -1.77 -0.84 0.11 0.00 0.00 -1.26 -3.84 121.76 114.15 2wug s ALA 50 Ca 0.60 -0.67 -0.21 0.00 0.00 0.00 0.00 51.96 51.69 2wug s ALA 50 Cb -0.20 0.70 -0.10 0.00 0.00 0.00 0.00 23.12 23.52 2wug s ALA 50 CO 0.25 -1.00 1.76 0.77 0.00 0.00 0.00 175.76 177.54 2wug h SER 51 N 2.00 0.14 -0.22 0.00 0.02 -1.90 -1.19 113.55 112.40 2wug h SER 51 Ca -0.30 -0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 60.57 2wug h SER 51 Cb 1.25 -0.04 -0.00 0.00 0.14 0.00 0.00 62.40 63.75 2wug h SER 51 CO 0.38 0.11 -0.15 -0.25 -1.14 0.00 0.00 176.83 175.78 2wug h TRP 52 N 0.17 0.58 -0.37 3.45 2.91 -1.94 -0.28 115.95 120.46 2wug h TRP 52 Ca 0.05 -0.15 0.02 0.00 1.13 0.00 0.00 58.89 59.94 2wug h TRP 52 Cb -0.01 -0.13 -0.03 0.00 -0.51 0.00 0.00 29.16 28.48 2wug h TRP 52 CO -0.07 0.79 0.19 1.79 -1.03 0.00 0.00 178.44 180.12 2wug h THR 53 N 0.19 1.00 -0.29 2.65 1.35 -1.92 0.65 112.91 116.54 2wug h THR 53 Ca 0.04 -0.13 -0.17 0.00 -0.55 0.00 0.00 66.41 65.60 2wug h THR 53 Cb 0.66 0.57 -0.00 0.00 -1.73 0.00 0.00 68.15 67.65 2wug h THR 53 CO 0.04 0.07 -0.51 0.78 -0.25 0.00 0.00 175.52 175.65 2wug h ASN 54 N 0.39 0.90 0.00 5.36 -0.26 -1.12 -3.39 115.58 117.46 2wug h ASN 54 Ca 0.15 -0.47 0.00 0.00 -0.56 0.00 0.00 56.30 55.43 2wug h ASN 54 Cb 0.05 -0.26 0.00 0.00 -1.06 0.00 0.00 38.32 37.05 2wug h ASN 54 CO -0.10 1.25 0.00 0.49 -1.06 0.00 0.00 177.43 178.01 2wug n PHE 55 N -4.01 0.00 -0.29 1.19 3.72 -0.13 -4.88 117.46 113.07 2wug n PHE 55 Ca -0.04 0.00 0.09 0.00 -0.05 0.00 0.00 57.45 57.45 2wug n PHE 55 Cb 0.61 0.00 0.22 0.00 -0.94 0.00 0.00 39.48 39.36 2wug n PHE 55 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2wug h SER 56 N 0.00 -0.34 -0.30 4.37 4.64 -0.96 0.48 113.55 121.44 2wug h SER 56 Ca 0.00 0.22 -0.17 0.00 -0.47 0.00 0.00 61.79 61.37 2wug h SER 56 Cb 0.13 0.38 -0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2wug h SER 56 CO 0.00 -0.23 -0.47 0.03 -0.87 0.00 0.00 176.83 175.30 2wug h ARG 57 N 0.10 0.84 -0.59 4.77 2.47 -1.90 -2.93 114.38 117.14 2wug h ARG 57 Ca 0.49 -0.51 -0.02 0.00 -1.26 0.00 0.00 59.98 58.68 2wug h ARG 57 Cb 0.93 0.05 -0.03 0.00 -1.65 0.00 0.00 29.97 29.27 2wug h ARG 57 CO -0.74 1.14 0.27 -0.91 0.56 0.00 0.00 179.97 180.29 2wug h ASN 58 N 0.62 0.75 -0.51 7.04 4.21 -1.06 -2.99 115.58 123.64 2wug h ASN 58 Ca 0.03 -0.08 0.03 0.00 1.21 0.00 0.00 56.30 57.49 2wug h ASN 58 Cb 1.07 -0.19 -0.04 0.00 -1.12 0.00 0.00 38.32 38.04 2wug h ASN 58 CO 0.11 0.65 0.28 0.40 -1.29 0.00 0.00 177.43 177.58 2wug h ILE 59 N 0.83 1.01 -0.77 2.81 2.04 -0.07 0.90 117.51 124.25 2wug h ILE 59 Ca 0.21 -0.19 0.05 0.00 1.00 0.00 0.00 64.86 65.93 2wug h ILE 59 Cb 0.10 0.40 -0.06 0.00 -0.74 0.00 0.00 36.82 36.53 2wug h ILE 59 CO -0.03 0.10 0.47 0.00 0.00 0.00 0.00 178.15 178.70 2wug h ALA 60 N 1.25 1.04 -0.08 1.87 0.00 -1.37 -0.00 119.26 121.97 2wug h ALA 60 Ca 0.21 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.06 2wug h ALA 60 Cb 0.07 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2wug h ALA 60 CO -0.12 0.21 -0.19 0.28 0.00 0.00 0.00 179.25 179.43 2wug h VAL 61 N 0.88 1.42 0.00 0.00 2.07 -1.35 -3.18 116.25 116.08 2wug h VAL 61 Ca 0.33 -1.53 -0.05 0.00 0.82 0.00 0.00 66.70 66.28 2wug h VAL 61 Cb 0.13 2.22 -0.01 0.00 -1.52 0.00 0.00 31.29 32.12 2wug h VAL 61 CO -0.16 0.43 -0.23 -0.07 0.02 0.00 0.00 177.57 177.56 2wug h LEU 62 N -0.22 0.00 -0.31 2.57 3.38 -0.69 -2.29 115.31 117.75 2wug h LEU 62 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2wug h LEU 62 Cb 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 2wug h LEU 62 CO 0.04 0.23 0.00 0.00 0.09 0.00 0.00 178.44 178.81 2wug n ALA 63 N -2.49 1.59 0.21 1.53 0.00 -0.03 -0.52 120.51 120.80 2wug n ALA 63 Ca -0.02 0.01 0.08 0.00 0.00 0.00 0.00 53.44 53.51 2wug n ALA 63 Cb 0.29 -1.28 0.40 0.00 0.00 0.00 0.00 19.45 18.87 2wug n ALA 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wug h ARG 64 N 0.00 0.00 0.00 0.00 3.08 -1.46 -3.37 114.38 112.63 2wug h ARG 64 Ca 0.00 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.93 2wug h ARG 64 Cb 0.26 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 2wug h ARG 64 CO 0.00 0.28 -1.46 0.72 -1.07 0.00 0.00 179.97 178.44 2wug n HIS 65 N -3.43 0.00 -4.31 3.04 8.25 -0.11 -5.08 115.22 113.58 2wug n HIS 65 Ca 0.00 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.30 2wug n HIS 65 Cb 0.46 -0.33 -0.10 0.00 1.12 0.00 0.00 29.99 31.14 2wug n HIS 65 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2wug s PHE 66 N -2.16 1.51 -0.50 4.41 0.08 0.32 -4.70 117.98 116.94 2wug s PHE 66 Ca -0.04 -0.85 -0.24 0.00 0.12 0.00 0.00 56.93 55.92 2wug s PHE 66 Cb 0.02 -0.84 0.03 0.00 -0.57 0.00 0.00 43.02 41.67 2wug s PHE 66 CO 0.26 0.03 0.90 -1.58 -0.10 0.00 0.00 175.22 174.73 2wug s HIS 67 N -3.35 2.88 -0.20 0.36 5.65 0.41 -4.28 115.29 116.77 2wug s HIS 67 Ca 0.25 0.16 -0.12 0.00 0.25 0.00 0.00 55.06 55.60 2wug s HIS 67 Cb 0.04 -3.94 -0.05 0.00 -1.18 0.00 0.00 32.58 27.45 2wug s HIS 67 CO 0.06 -1.18 0.21 0.08 -0.65 0.00 0.00 174.74 173.26 2wug s VAL 68 N 3.72 5.35 -0.30 0.89 1.01 0.64 -0.63 120.40 131.07 2wug s VAL 68 Ca 0.32 0.33 0.03 0.00 0.00 0.00 0.00 61.98 62.67 2wug s VAL 68 Cb -0.12 -3.55 0.08 0.00 0.00 0.00 0.00 36.38 32.80 2wug s VAL 68 CO 0.22 0.38 -0.03 -0.76 0.00 0.00 0.00 175.10 174.92 2wug s LEU 69 N 0.70 4.04 -0.38 3.92 1.43 -0.32 -1.38 118.68 126.68 2wug s LEU 69 Ca 0.11 -1.76 -0.13 0.00 -1.03 0.00 0.00 54.13 51.32 2wug s LEU 69 Cb -0.13 -1.56 0.02 0.00 0.03 0.00 0.00 46.19 44.55 2wug s LEU 69 CO 0.02 -0.29 0.24 0.00 0.23 0.00 0.00 176.35 176.56 2wug s ALA 70 N 1.02 3.38 -0.21 4.21 0.00 0.24 -0.72 121.76 129.69 2wug s ALA 70 Ca 0.01 -1.67 -0.10 0.00 0.00 0.00 0.00 51.96 50.20 2wug s ALA 70 Cb -0.19 -2.71 -0.05 0.00 0.00 0.00 0.00 23.12 20.17 2wug s ALA 70 CO -0.07 -1.35 0.13 0.08 0.00 0.00 0.00 175.76 174.56 2wug s VAL 71 N 1.62 5.38 -0.16 0.00 1.01 -0.67 -0.31 120.40 127.26 2wug s VAL 71 Ca 0.04 0.18 -0.29 0.00 0.00 0.00 0.00 61.98 61.90 2wug s VAL 71 Cb -0.19 -3.47 -0.02 0.00 0.00 0.00 0.00 36.38 32.70 2wug s VAL 71 CO 0.08 0.42 1.38 -1.81 0.00 0.00 0.00 175.10 175.17 2wug s ASP 72 N 0.51 6.81 0.58 3.32 1.01 -0.06 -4.39 116.67 124.45 2wug s ASP 72 Ca 0.08 1.75 -0.18 0.00 0.71 0.00 0.00 52.55 54.91 2wug s ASP 72 Cb -0.12 -2.54 -0.04 0.00 1.01 0.00 0.00 42.92 41.24 2wug s ASP 72 CO -0.01 -0.87 1.11 -1.10 0.21 0.00 0.00 175.17 174.51 2wug s GLN 73 N 3.79 3.23 0.31 8.23 -0.21 -1.26 -4.44 119.66 129.30 2wug s GLN 73 Ca 0.60 1.47 -0.28 0.00 0.02 0.00 0.00 55.36 57.17 2wug s GLN 73 Cb -0.24 -2.00 -0.13 0.00 1.00 0.00 0.00 33.01 31.64 2wug s GLN 73 CO 0.20 -0.92 1.21 -2.30 -2.12 0.00 0.00 175.29 171.35 2wug n PRO 74 N -1.69 1.85 -0.05 2.91 -0.02 -1.26 -1.09 135.00 135.65 2wug n PRO 74 Ca 0.11 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 2wug n PRO 74 Cb 0.52 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 2wug n PRO 74 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wug n GLY 75 N 1.08 0.58 3.19 -1.23 0.00 -0.15 -5.00 105.19 103.65 2wug n GLY 75 Ca 0.07 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 2wug n GLY 75 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wug s TYR 76 N -2.24 1.04 0.00 1.61 1.51 -0.25 -4.75 117.35 114.27 2wug s TYR 76 Ca 0.00 -0.75 0.00 0.00 -1.01 0.00 0.00 57.07 55.31 2wug s TYR 76 Cb 0.00 -0.57 0.00 0.00 -0.11 0.00 0.00 41.96 41.28 2wug s TYR 76 CO 0.00 -0.03 0.00 0.41 -1.11 0.00 0.00 175.55 174.82 2wug n GLY 77 N 0.24 4.09 0.73 0.71 0.00 -1.25 -1.70 105.19 108.00 2wug n GLY 77 Ca -0.14 0.07 0.07 0.00 0.00 0.00 0.00 46.02 46.02 2wug n GLY 77 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2wug n HIS 78 N 14.00 0.68 -2.07 1.61 8.25 -1.26 -4.99 115.22 131.43 2wug n HIS 78 Ca 0.00 -0.70 -0.30 0.00 -0.26 0.00 0.00 57.72 56.46 2wug n HIS 78 Cb 0.00 -0.18 0.02 0.00 1.12 0.00 0.00 29.99 30.95 2wug n HIS 78 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2wug s SER 79 N -1.52 6.06 0.47 0.41 0.01 -0.69 -4.29 113.70 114.15 2wug s SER 79 Ca 0.32 1.22 -0.24 0.00 1.31 0.00 0.00 55.95 58.56 2wug s SER 79 Cb 0.23 -2.28 -0.09 0.00 0.21 0.00 0.00 66.02 64.10 2wug s SER 79 CO 0.11 -0.90 1.17 0.47 0.41 0.00 0.00 173.24 174.50 2wug n ASP 80 N -2.68 1.96 -3.72 2.44 8.00 0.18 -4.45 116.55 118.29 2wug n ASP 80 Ca 0.05 1.02 -0.28 0.00 0.71 0.00 0.00 54.79 56.30 2wug n ASP 80 Cb 0.55 -1.46 -0.11 0.00 -0.02 0.00 0.00 41.12 40.09 2wug n ASP 80 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2wug n LYS 81 N -0.24 1.93 -2.09 -1.24 5.02 -1.26 -0.98 118.16 119.30 2wug n LYS 81 Ca 0.09 -4.45 -0.35 0.00 -2.02 0.00 0.00 58.31 51.58 2wug n LYS 81 Cb 0.41 -2.22 0.02 0.00 -0.02 0.00 0.00 35.03 33.22 2wug n LYS 81 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2wug s ARG 82 N -1.69 3.12 0.00 1.97 0.52 -1.26 -4.76 118.95 116.85 2wug s ARG 82 Ca 0.30 1.67 0.27 0.00 -0.52 0.00 0.00 55.73 57.44 2wug s ARG 82 Cb 0.02 -1.97 0.82 0.00 0.52 0.00 0.00 34.95 34.35 2wug s ARG 82 CO -0.12 -1.05 1.63 0.00 0.02 0.00 0.00 175.30 175.77 2wug n ALA 83 N -1.57 3.07 -2.94 2.13 0.00 -1.26 -4.60 120.51 115.34 2wug n ALA 83 Ca 0.12 -0.27 -0.11 0.00 0.00 0.00 0.00 53.44 53.18 2wug n ALA 83 Cb 0.51 -1.25 -0.13 0.00 0.00 0.00 0.00 19.45 18.58 2wug n ALA 83 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2wug s GLU 84 N -2.90 0.14 -0.00 0.00 2.02 -1.26 -4.74 118.70 111.96 2wug s GLU 84 Ca 0.15 -0.15 -0.30 0.00 0.02 0.00 0.00 54.97 54.69 2wug s GLU 84 Cb 0.18 0.05 0.11 0.00 0.10 0.00 0.00 34.13 34.58 2wug s GLU 84 CO 0.61 -0.02 1.24 -3.38 0.02 0.00 0.00 175.26 173.73 2wug s HIS 85 N -0.45 -0.06 0.00 1.61 -3.43 -1.26 -5.16 115.29 106.54 2wug s HIS 85 Ca -0.05 -0.06 0.00 0.00 -0.80 0.00 0.00 55.06 54.14 2wug s HIS 85 Cb -0.03 0.56 0.00 0.00 -1.43 0.00 0.00 32.58 31.67 2wug s HIS 85 CO -0.00 -0.34 0.00 0.41 -2.00 0.00 0.00 174.74 172.81 2wug n GLY 86 N -0.46 -1.20 3.61 -1.38 0.00 -1.26 -4.86 105.19 99.64 2wug n GLY 86 Ca -0.08 -1.61 -0.52 0.00 0.00 0.00 0.00 46.02 43.80 2wug n GLY 86 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2wug n GLN 87 N -0.63 1.21 -0.14 1.61 0.00 -1.25 -4.73 117.38 113.46 2wug n GLN 87 Ca 0.00 0.44 -0.04 0.00 -0.00 0.00 0.00 57.00 57.40 2wug n GLN 87 Cb 0.00 -2.10 0.04 0.00 0.00 0.00 0.00 30.24 28.19 2wug n GLN 87 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.06 177.41 2wug h PHE 88 N 5.02 0.28 -0.37 3.69 3.57 -1.85 -1.40 116.94 125.88 2wug h PHE 88 Ca -0.47 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 60.98 2wug h PHE 88 Cb 1.33 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.99 2wug h PHE 88 CO 0.63 0.10 -0.07 -0.91 -2.23 0.00 0.00 178.31 175.82 2wug h ASN 89 N 0.32 0.60 -0.45 0.41 4.21 -1.92 0.18 115.58 118.94 2wug h ASN 89 Ca 0.21 -0.15 -0.14 0.00 1.21 0.00 0.00 56.30 57.42 2wug h ASN 89 Cb 0.20 -0.16 -0.01 0.00 -1.12 0.00 0.00 38.32 37.23 2wug h ASN 89 CO -0.21 0.72 -0.27 -0.09 -1.29 0.00 0.00 177.43 176.29 2wug h ARG 90 N 0.58 0.98 0.29 0.81 2.43 -1.77 0.13 114.38 117.83 2wug h ARG 90 Ca 0.11 -0.45 -0.01 0.00 -0.81 0.00 0.00 59.98 58.81 2wug h ARG 90 Cb 0.48 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 2wug h ARG 90 CO 0.03 1.12 -0.14 -0.92 -1.51 0.00 0.00 179.97 178.55 2wug h TYR 91 N 0.83 -0.36 -0.52 2.20 3.20 -0.83 -0.29 116.97 121.20 2wug h TYR 91 Ca 0.09 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.93 2wug h TYR 91 Cb 0.86 0.12 -0.03 0.00 1.54 0.00 0.00 36.73 39.23 2wug h TYR 91 CO 0.06 -0.18 0.21 0.00 -1.64 0.00 0.00 178.16 176.61 2wug h ALA 92 N 0.25 1.40 -0.30 1.82 0.00 -0.62 -1.77 119.26 120.03 2wug h ALA 92 Ca -0.04 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.60 2wug h ALA 92 Cb 0.34 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2wug h ALA 92 CO 0.07 0.46 -0.36 0.00 0.00 0.00 0.00 179.25 179.42 2wug h ALA 93 N 1.50 0.80 -0.81 0.00 0.00 -0.54 -0.44 119.26 119.78 2wug h ALA 93 Ca 0.18 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2wug h ALA 93 Cb 0.14 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 2wug h ALA 93 CO -0.02 0.65 0.52 0.52 0.00 0.00 0.00 179.25 180.92 2wug h MET 94 N 0.58 1.07 -0.48 0.00 2.07 -0.62 0.56 114.93 118.12 2wug h MET 94 Ca 0.06 -0.07 -0.01 0.00 -2.07 0.00 0.00 59.70 57.60 2wug h MET 94 Cb 0.88 -0.24 -0.02 0.00 -1.87 0.00 0.00 31.60 30.35 2wug h MET 94 CO 0.08 0.72 0.24 0.00 1.07 0.00 0.00 176.91 179.02 2wug h ALA 95 N 1.29 0.61 -0.79 6.32 0.00 -1.00 -1.78 119.26 123.90 2wug h ALA 95 Ca 0.29 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 2wug h ALA 95 Cb -0.10 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.46 2wug h ALA 95 CO -0.06 0.16 0.38 1.25 0.00 0.00 0.00 179.25 180.97 2wug h LEU 96 N 0.63 1.02 -0.64 0.00 5.85 -0.72 -0.78 115.31 120.66 2wug h LEU 96 Ca 0.17 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 2wug h LEU 96 Cb 0.09 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.83 2wug h LEU 96 CO -0.02 0.86 0.36 0.50 -0.34 0.00 0.00 178.44 179.80 2wug h LYS 97 N 1.12 0.89 -0.76 1.25 1.63 -0.66 0.13 116.57 120.17 2wug h LYS 97 Ca 0.27 -0.10 0.06 0.00 -0.85 0.00 0.00 60.65 60.03 2wug h LYS 97 Cb 0.11 -0.18 -0.06 0.00 -0.60 0.00 0.00 32.23 31.51 2wug h LYS 97 CO -0.03 0.67 0.45 0.78 -3.45 0.00 0.00 179.45 177.87 2wug h GLY 98 N 0.88 1.14 0.91 5.01 0.00 -0.61 -1.57 103.07 108.84 2wug h GLY 98 Ca 0.23 -0.32 -0.07 0.00 0.00 0.00 0.00 47.33 47.17 2wug h GLY 98 CO -0.04 0.21 -0.06 -2.00 0.00 0.00 0.00 176.54 174.64 2wug h LEU 99 N 0.82 0.63 -0.28 3.11 5.85 -0.29 -1.77 115.31 123.38 2wug h LEU 99 Ca 0.34 -0.35 0.06 0.00 0.84 0.00 0.00 57.88 58.76 2wug h LEU 99 Cb 0.19 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 40.99 2wug h LEU 99 CO -0.18 0.83 -0.09 -0.26 -0.34 0.00 0.00 178.44 178.41 2wug h PHE 100 N 0.41 -0.19 -0.33 1.25 0.05 -0.52 -0.09 116.94 117.52 2wug h PHE 100 Ca 0.09 0.03 -0.01 0.00 3.82 0.00 0.00 57.97 61.90 2wug h PHE 100 Cb 0.55 0.13 -0.02 0.00 2.00 0.00 0.00 35.95 38.61 2wug h PHE 100 CO 0.05 -0.14 0.18 -0.44 -0.18 0.00 0.00 178.31 177.78 2wug h ASP 101 N -0.02 0.41 -0.61 2.17 3.32 -1.18 0.63 116.42 121.14 2wug h ASP 101 Ca 0.14 -0.08 -0.04 0.00 0.02 0.00 0.00 57.03 57.07 2wug h ASP 101 Cb 0.24 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 2wug h ASP 101 CO -0.31 0.37 0.23 -0.61 -1.72 0.00 0.00 179.24 177.20 2wug h GLN 102 N 0.42 0.95 -0.01 3.56 4.15 -1.09 -2.70 115.11 120.39 2wug h GLN 102 Ca 0.12 -0.17 0.00 0.00 0.77 0.00 0.00 58.65 59.37 2wug h GLN 102 Cb 0.05 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 27.59 2wug h GLN 102 CO -0.02 0.80 -0.12 1.28 -1.93 0.00 0.00 178.83 178.84 2wug n LEU 103 N -4.29 1.01 -1.55 -2.39 4.77 -0.07 -4.94 117.00 109.54 2wug n LEU 103 Ca 0.05 -0.28 -0.12 0.00 -0.03 0.00 0.00 56.01 55.64 2wug n LEU 103 Cb 0.19 -0.08 0.01 0.00 -2.33 0.00 0.00 43.42 41.21 2wug n LEU 103 CO 0.40 0.18 -0.07 0.61 -1.33 0.00 0.00 177.39 177.17 2wug n GLY 104 N 1.24 -0.05 3.78 -0.72 0.00 -0.16 -5.01 105.19 104.27 2wug n GLY 104 Ca 0.16 -0.34 -0.38 0.00 0.00 0.00 0.00 46.02 45.46 2wug n GLY 104 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wug s LEU 105 N -3.64 4.50 0.00 0.99 1.43 0.03 -5.02 118.68 116.97 2wug s LEU 105 Ca 0.08 1.74 0.00 0.00 -1.03 0.00 0.00 54.13 54.93 2wug s LEU 105 Cb -0.04 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.56 2wug s LEU 105 CO 0.10 0.09 0.00 0.61 0.23 0.00 0.00 176.35 177.39 2wug n GLY 106 N 1.14 0.31 3.27 -3.19 0.00 -1.26 -4.68 105.19 100.80 2wug n GLY 106 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 2wug n GLY 106 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2wug s ARG 107 N 0.79 3.23 0.00 1.61 3.52 -1.26 -4.48 118.95 122.36 2wug s ARG 107 Ca 0.00 -0.72 0.04 0.00 -0.13 0.00 0.00 55.73 54.92 2wug s ARG 107 Cb 0.00 -2.98 -0.01 0.00 -1.56 0.00 0.00 34.95 30.39 2wug s ARG 107 CO 0.00 -0.25 -0.13 0.08 -0.81 0.00 0.00 175.30 174.19 2wug s VAL 108 N 1.44 1.05 0.59 7.11 1.01 -0.51 -4.71 120.40 126.38 2wug s VAL 108 Ca 0.05 -0.66 -0.17 0.00 0.00 0.00 0.00 61.98 61.19 2wug s VAL 108 Cb -0.15 -0.90 -0.03 0.00 0.00 0.00 0.00 36.38 35.30 2wug s VAL 108 CO -0.04 0.22 1.11 -2.16 0.00 0.00 0.00 175.10 174.23 2wug s PRO 109 N -0.50 3.14 -0.01 2.72 0.04 -1.26 -0.81 135.00 138.32 2wug s PRO 109 Ca 0.04 1.47 0.04 0.00 0.04 0.00 0.00 61.00 62.59 2wug s PRO 109 Cb -0.06 -1.99 -0.01 0.00 0.04 0.00 0.00 34.50 32.48 2wug s PRO 109 CO -0.00 -0.99 -0.13 -0.51 0.04 0.00 0.00 177.00 175.40 2wug s LEU 110 N -4.30 2.03 -0.17 -3.56 1.43 -0.59 -2.17 118.68 111.35 2wug s LEU 110 Ca 0.69 -0.25 0.01 0.00 -1.03 0.00 0.00 54.13 53.55 2wug s LEU 110 Cb -0.21 -0.68 0.01 0.00 0.03 0.00 0.00 46.19 45.33 2wug s LEU 110 CO 0.34 0.16 -0.18 -0.69 0.23 0.00 0.00 176.35 176.21 2wug s VAL 111 N -0.32 2.36 -0.03 -1.59 1.01 0.31 -0.97 120.40 121.16 2wug s VAL 111 Ca 0.05 -0.86 -0.01 0.00 0.00 0.00 0.00 61.98 61.16 2wug s VAL 111 Cb -0.05 -1.99 0.02 0.00 0.00 0.00 0.00 36.38 34.36 2wug s VAL 111 CO -0.00 0.52 0.05 -0.83 0.00 0.00 0.00 175.10 174.84 2wug s GLY 112 N 1.05 0.02 -0.06 4.51 0.00 -0.07 -0.22 107.32 112.55 2wug s GLY 112 Ca -0.01 0.29 -0.00 0.00 0.00 0.00 0.00 44.72 45.00 2wug s GLY 112 CO -0.06 0.50 -0.02 0.54 0.00 0.00 0.00 173.10 174.06 2wug s ASN 113 N 0.65 5.02 1.12 1.64 4.22 -0.75 -0.93 114.94 125.91 2wug s ASN 113 Ca -0.05 0.06 0.00 0.00 -2.14 0.00 0.00 52.86 50.73 2wug s ASN 113 Cb -0.07 -1.34 0.00 0.00 1.28 0.00 0.00 41.25 41.11 2wug s ASN 113 CO -0.02 0.36 0.00 0.00 -2.04 0.00 0.00 177.10 175.39 2wug n ALA 114 N 2.03 0.00 -0.24 3.54 0.00 -0.15 -0.91 120.51 124.79 2wug n ALA 114 Ca -0.18 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.31 2wug n ALA 114 Cb 0.53 0.00 0.29 0.00 0.00 0.00 0.00 19.45 20.27 2wug n ALA 114 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2wug h LEU 115 N 0.00 0.79 -1.24 0.00 5.85 -1.86 0.11 115.31 118.97 2wug h LEU 115 Ca 0.00 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.65 2wug h LEU 115 Cb 0.00 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 2wug h LEU 115 CO 0.00 0.52 -0.19 1.23 -0.34 0.00 0.00 178.44 179.66 2wug h GLY 116 N 0.91 0.31 1.03 3.75 0.00 -0.50 -0.29 103.07 108.27 2wug h GLY 116 Ca 0.34 -0.21 -0.05 0.00 0.00 0.00 0.00 47.33 47.40 2wug h GLY 116 CO -0.11 0.20 0.21 -1.33 0.00 0.00 0.00 176.54 175.50 2wug h GLY 117 N 0.89 1.12 1.00 4.60 0.00 -0.64 0.10 103.07 110.15 2wug h GLY 117 Ca 0.05 -0.66 -0.01 0.00 0.00 0.00 0.00 47.33 46.71 2wug h GLY 117 CO 0.03 0.62 0.41 -1.33 0.00 0.00 0.00 176.54 176.28 2wug h GLY 118 N 0.98 1.03 1.05 4.60 0.00 -0.37 -1.17 103.07 109.19 2wug h GLY 118 Ca 0.22 -0.44 -0.09 0.00 0.00 0.00 0.00 47.33 47.02 2wug h GLY 118 CO -0.01 0.43 0.00 -0.84 0.00 0.00 0.00 176.54 176.12 2wug h THR 119 N 0.96 1.26 -0.54 4.70 2.02 -0.88 0.03 112.91 120.46 2wug h THR 119 Ca 0.25 -1.11 0.03 0.00 0.77 0.00 0.00 66.41 66.35 2wug h THR 119 Cb -0.01 0.88 -0.04 0.00 -1.74 0.00 0.00 68.15 67.24 2wug h THR 119 CO -0.05 0.40 0.31 0.00 0.37 0.00 0.00 175.52 176.56 2wug h ALA 120 N 0.96 0.70 -0.40 6.16 0.00 -0.55 -0.12 119.26 126.02 2wug h ALA 120 Ca 0.16 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 2wug h ALA 120 Cb 0.53 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2wug h ALA 120 CO 0.03 0.01 -0.03 0.28 0.00 0.00 0.00 179.25 179.53 2wug h VAL 121 N 0.62 1.27 -0.91 0.00 2.07 -1.00 -1.00 116.25 117.29 2wug h VAL 121 Ca 0.23 -1.08 -0.00 0.00 0.82 0.00 0.00 66.70 66.66 2wug h VAL 121 Cb 0.06 1.16 -0.04 0.00 -1.52 0.00 0.00 31.29 30.95 2wug h VAL 121 CO -0.12 0.36 0.55 -0.09 0.02 0.00 0.00 177.57 178.30 2wug h ARG 122 N 0.55 1.24 -0.32 1.57 9.65 -0.63 -0.67 114.38 125.76 2wug h ARG 122 Ca 0.11 -0.11 -0.02 0.00 -1.10 0.00 0.00 59.98 58.86 2wug h ARG 122 Cb 0.53 -0.26 -0.01 0.00 -1.39 0.00 0.00 29.97 28.83 2wug h ARG 122 CO 0.03 0.86 0.14 0.35 2.80 0.00 0.00 179.97 184.15 2wug h PHE 123 N 1.26 0.47 0.00 2.20 3.57 -0.85 0.32 116.94 123.90 2wug h PHE 123 Ca 0.33 -0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.76 2wug h PHE 123 Cb -0.06 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.53 2wug h PHE 123 CO 0.00 0.44 -0.19 0.00 -2.23 0.00 0.00 178.31 176.33 2wug h ALA 124 N 0.99 1.54 0.21 2.41 0.00 -0.56 0.11 119.26 123.96 2wug h ALA 124 Ca 0.11 -0.17 -0.35 0.00 0.00 0.00 0.00 54.91 54.49 2wug h ALA 124 Cb 0.16 -0.03 0.02 0.00 0.00 0.00 0.00 17.79 17.94 2wug h ALA 124 CO -0.01 0.24 -1.66 -0.07 0.00 0.00 0.00 179.25 177.75 2wug h LEU 125 N 0.00 0.71 -0.09 0.00 3.38 -0.91 -3.24 115.31 115.16 2wug h LEU 125 Ca -0.00 -0.93 -0.21 0.00 0.09 0.00 0.00 57.88 56.83 2wug h LEU 125 Cb 0.37 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 2wug h LEU 125 CO 0.02 1.77 -0.97 0.44 0.09 0.00 0.00 178.44 179.79 2wug h ASP 126 N 0.12 0.04 -2.09 -0.43 3.32 -0.66 -3.38 116.42 113.35 2wug h ASP 126 Ca -0.31 -0.04 -0.56 0.00 0.02 0.00 0.00 57.03 56.13 2wug h ASP 126 Cb 2.13 -0.01 -0.40 0.00 0.22 0.00 0.00 39.33 41.26 2wug h ASP 126 CO 0.22 0.98 -0.90 -1.22 -1.72 0.00 0.00 179.24 176.60 2wug n TYR 127 N -3.43 1.52 0.22 4.55 4.01 0.35 -4.99 117.16 119.38 2wug n TYR 127 Ca -0.01 -3.84 0.07 0.00 -0.16 0.00 0.00 57.90 53.96 2wug n TYR 127 Cb 0.90 -0.44 0.59 0.00 -0.31 0.00 0.00 39.34 40.08 2wug n TYR 127 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 2wug h PRO 128 N 3.80 0.08 0.00 -0.72 0.11 -1.74 -0.14 132.00 133.39 2wug h PRO 128 Ca 0.12 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.23 2wug h PRO 128 Cb 0.78 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.87 2wug h PRO 128 CO 0.63 0.07 0.00 0.00 -0.21 0.00 0.00 178.00 178.49 2wug h ALA 129 N 1.94 1.00 0.00 -0.75 0.00 -1.93 -3.27 119.26 116.25 2wug h ALA 129 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2wug h ALA 129 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2wug h ALA 129 CO -0.00 0.00 -1.17 0.54 0.00 0.00 0.00 179.25 178.61 2wug n ARG 130 N -2.88 0.22 -4.02 0.00 5.12 -0.07 -4.40 116.66 110.64 2wug n ARG 130 Ca 0.02 -0.04 -0.35 0.00 -1.93 0.00 0.00 57.85 55.55 2wug n ARG 130 Cb 0.32 -1.53 -0.10 0.00 -1.16 0.00 0.00 32.46 29.99 2wug n ARG 130 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2wug s ALA 131 N -3.17 3.42 0.15 7.54 0.00 -1.23 -1.42 121.76 127.06 2wug s ALA 131 Ca 0.04 -0.74 0.00 0.00 0.00 0.00 0.00 51.96 51.25 2wug s ALA 131 Cb 0.15 -1.90 0.00 0.00 0.00 0.00 0.00 23.12 21.37 2wug s ALA 131 CO 0.84 0.22 0.00 0.41 0.00 0.00 0.00 175.76 177.23 2wug n GLY 132 N 3.41 1.61 3.70 0.00 0.00 0.01 -4.74 105.19 109.19 2wug n GLY 132 Ca -0.17 -1.71 -0.39 0.00 0.00 0.00 0.00 46.02 43.76 2wug n GLY 132 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wug n ARG 133 N 0.00 1.50 -5.06 1.61 1.74 -1.26 -4.68 116.66 110.51 2wug n ARG 133 Ca 0.00 0.55 -0.32 0.00 -0.77 0.00 0.00 57.85 57.31 2wug n ARG 133 Cb 0.00 -2.44 -0.14 0.00 -1.02 0.00 0.00 32.46 28.85 2wug n ARG 133 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2wug s LEU 134 N -2.88 2.45 -0.20 0.55 1.43 -1.07 -1.55 118.68 117.41 2wug s LEU 134 Ca 0.72 -0.33 0.01 0.00 -1.03 0.00 0.00 54.13 53.50 2wug s LEU 134 Cb -0.43 -1.47 0.02 0.00 0.03 0.00 0.00 46.19 44.34 2wug s LEU 134 CO 0.49 0.31 -0.17 -0.69 0.23 0.00 0.00 176.35 176.53 2wug s VAL 135 N -0.55 2.22 -0.15 -1.59 1.01 -0.14 -0.57 120.40 120.62 2wug s VAL 135 Ca 0.08 -0.98 0.00 0.00 0.00 0.00 0.00 61.98 61.08 2wug s VAL 135 Cb -0.11 -1.99 0.03 0.00 0.00 0.00 0.00 36.38 34.30 2wug s VAL 135 CO 0.01 0.45 -0.13 -0.76 0.00 0.00 0.00 175.10 174.67 2wug s LEU 136 N 1.29 1.73 -0.28 3.92 1.43 -0.16 -0.90 118.68 125.71 2wug s LEU 136 Ca 0.03 -0.54 -0.09 0.00 -1.03 0.00 0.00 54.13 52.50 2wug s LEU 136 Cb -0.14 -1.14 -0.03 0.00 0.03 0.00 0.00 46.19 44.91 2wug s LEU 136 CO -0.11 -0.08 0.13 -0.32 0.23 0.00 0.00 176.35 176.20 2wug s MET 137 N 1.50 3.62 -1.29 1.70 -2.45 -0.11 -0.62 119.30 121.65 2wug s MET 137 Ca 0.04 -0.53 -0.07 0.00 -1.25 0.00 0.00 55.69 53.88 2wug s MET 137 Cb -0.13 -3.51 0.01 0.00 1.25 0.00 0.00 34.83 32.45 2wug s MET 137 CO -0.10 -0.27 0.13 0.41 1.05 0.00 0.00 175.02 176.24 2wug n GLY 138 N 4.99 -0.24 3.77 2.11 0.00 -0.14 -0.97 105.19 114.70 2wug n GLY 138 Ca -0.15 0.19 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 2wug n GLY 138 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2wug s PRO 139 N -6.93 3.95 0.88 1.61 0.04 -1.26 -2.75 135.00 130.54 2wug s PRO 139 Ca 0.10 1.96 -0.11 0.00 0.04 0.00 0.00 61.00 62.98 2wug s PRO 139 Cb -0.05 -2.65 0.17 0.00 0.04 0.00 0.00 34.50 32.00 2wug s PRO 139 CO 0.87 -0.45 1.22 0.20 0.04 0.00 0.00 177.00 178.88 2wug s GLY 140 N -1.02 1.77 0.00 0.56 0.00 -0.23 -4.09 107.32 104.31 2wug s GLY 140 Ca 0.58 -1.32 0.00 0.00 0.00 0.00 0.00 44.72 43.98 2wug s GLY 140 CO 0.42 -0.63 0.00 0.61 0.00 0.00 0.00 173.10 173.50 2wug n GLY 141 N -3.47 2.02 0.03 0.20 0.00 -1.26 -3.08 105.19 99.63 2wug n GLY 141 Ca 0.15 -0.11 0.14 0.00 0.00 0.00 0.00 46.02 46.19 2wug n GLY 141 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2wug n LEU 142 N 0.00 0.24 -4.80 0.99 -0.00 -1.26 -1.32 117.00 110.85 2wug n LEU 142 Ca 0.00 0.23 -0.37 0.00 -0.00 0.00 0.00 56.01 55.86 2wug n LEU 142 Cb 0.00 -0.33 -0.06 0.00 -0.00 0.00 0.00 43.42 43.03 2wug n LEU 142 CO 0.00 0.05 0.48 -0.94 -0.00 0.00 0.00 177.39 176.98 2wug s SER 143 N -2.80 7.23 -0.04 1.45 1.04 -1.26 -4.07 113.70 115.25 2wug s SER 143 Ca 0.19 1.57 -0.02 0.00 0.48 0.00 0.00 55.95 58.17 2wug s SER 143 Cb 0.19 -2.47 0.03 0.00 0.10 0.00 0.00 66.02 63.87 2wug s SER 143 CO 0.54 0.08 0.06 -0.51 0.98 0.00 0.00 173.24 174.39 2wug s ILE 144 N -1.40 -0.09 -0.97 -1.02 2.07 -1.15 -4.82 121.20 113.83 2wug s ILE 144 Ca 0.41 0.41 -0.24 0.00 -1.41 0.00 0.00 60.65 59.83 2wug s ILE 144 Cb -0.19 -0.16 0.03 0.00 0.13 0.00 0.00 42.46 42.27 2wug s ILE 144 CO 0.23 0.18 1.51 0.20 -1.91 0.00 0.00 174.94 175.15 2wug s ASN 145 N 2.11 6.26 0.54 4.50 0.01 -1.26 -3.98 114.94 123.12 2wug s ASN 145 Ca 0.04 -1.21 0.26 0.00 -0.71 0.00 0.00 52.86 51.24 2wug s ASN 145 Cb -0.12 -2.57 1.55 0.00 0.41 0.00 0.00 41.25 40.52 2wug s ASN 145 CO -0.03 -1.72 2.16 -0.07 -1.51 0.00 0.00 177.10 175.92 2wug h LEU 146 N 13.56 0.00 0.00 0.60 3.38 -1.94 -3.27 115.31 127.64 2wug h LEU 146 Ca 0.13 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.00 2wug h LEU 146 Cb 1.02 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.75 2wug h LEU 146 CO 1.38 0.06 -1.38 0.49 0.09 0.00 0.00 178.44 179.08 2wug n PHE 147 N -3.92 0.00 -2.40 1.13 3.72 -1.26 -5.02 117.46 109.72 2wug n PHE 147 Ca -0.03 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.95 2wug n PHE 147 Cb 0.15 -0.26 -0.03 0.00 -0.94 0.00 0.00 39.48 38.40 2wug n PHE 147 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2wug s ALA 148 N -2.13 3.50 0.34 4.37 0.00 -1.23 -4.98 121.76 121.62 2wug s ALA 148 Ca -0.07 0.71 -0.29 0.00 0.00 0.00 0.00 51.96 52.32 2wug s ALA 148 Cb 0.02 -3.52 -0.11 0.00 0.00 0.00 0.00 23.12 19.50 2wug s ALA 148 CO 0.18 -0.75 1.51 -2.30 0.00 0.00 0.00 175.76 174.40 2wug n PRO 149 N 5.05 2.63 -4.08 0.00 -0.02 -1.26 -4.81 135.00 132.51 2wug n PRO 149 Ca 0.11 0.93 -0.34 0.00 -2.02 0.00 0.00 63.50 62.18 2wug n PRO 149 Cb 0.46 -2.67 -0.07 0.00 -0.02 0.00 0.00 33.50 31.20 2wug n PRO 149 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2wug s ASP 150 N 0.11 5.82 0.36 2.55 1.01 -1.26 -3.36 116.67 121.90 2wug s ASP 150 Ca 0.58 0.23 -0.26 0.00 0.71 0.00 0.00 52.55 53.81 2wug s ASP 150 Cb -0.49 -1.73 -0.09 0.00 1.01 0.00 0.00 42.92 41.62 2wug s ASP 150 CO 0.58 0.31 1.09 -2.16 0.21 0.00 0.00 175.17 175.20 2wug s PRO 151 N -1.49 4.27 1.01 8.23 0.04 -1.26 -5.15 135.00 140.65 2wug s PRO 151 Ca 0.20 1.68 -0.12 0.00 0.04 0.00 0.00 61.00 62.80 2wug s PRO 151 Cb -0.12 -2.77 0.19 0.00 0.04 0.00 0.00 34.50 31.85 2wug s PRO 151 CO 0.11 -0.08 1.08 0.95 0.04 0.00 0.00 177.00 179.09 2wug s THR 152 N -1.45 2.22 0.20 1.26 -4.23 -1.21 -4.72 115.64 107.71 2wug s THR 152 Ca 0.54 0.07 -0.12 0.00 -1.18 0.00 0.00 61.69 61.00 2wug s THR 152 Cb -0.27 -2.43 0.18 0.00 1.34 0.00 0.00 72.50 71.31 2wug s THR 152 CO 0.34 -0.09 1.67 -0.08 -0.54 0.00 0.00 174.62 175.91 2wug h GLU 153 N -1.98 0.10 -0.55 3.99 4.81 -1.87 0.02 114.58 119.10 2wug h GLU 153 Ca -0.54 -0.01 0.01 0.00 -0.13 0.00 0.00 59.36 58.69 2wug h GLU 153 Cb 1.31 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.64 2wug h GLU 153 CO 0.54 0.07 0.36 0.78 -0.73 0.00 0.00 179.01 180.03 2wug h GLY 154 N 0.10 0.77 1.07 1.92 0.00 -1.62 -1.32 103.07 104.01 2wug h GLY 154 Ca 0.30 -0.28 -0.11 0.00 0.00 0.00 0.00 47.33 47.24 2wug h GLY 154 CO -0.50 0.27 -0.08 -2.08 0.00 0.00 0.00 176.54 174.14 2wug h VAL 155 N 0.73 1.27 -0.45 4.60 2.07 -1.65 -2.11 116.25 120.71 2wug h VAL 155 Ca 0.21 -1.23 0.00 0.00 0.82 0.00 0.00 66.70 66.50 2wug h VAL 155 Cb -0.06 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 30.65 2wug h VAL 155 CO -0.05 0.43 0.28 0.11 0.02 0.00 0.00 177.57 178.36 2wug h LYS 156 N 0.88 0.60 -0.46 1.57 1.57 -0.80 -1.22 116.57 118.71 2wug h LYS 156 Ca 0.14 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.85 2wug h LYS 156 Cb 0.64 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.80 2wug h LYS 156 CO 0.04 0.43 0.18 0.00 -0.57 0.00 0.00 179.45 179.53 2wug h ARG 157 N 0.60 0.65 -0.39 3.15 2.47 -1.03 0.62 114.38 120.45 2wug h ARG 157 Ca 0.16 -0.09 -0.08 0.00 -1.26 0.00 0.00 59.98 58.72 2wug h ARG 157 Cb -0.03 -0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 28.16 2wug h ARG 157 CO -0.03 0.54 -0.05 1.25 0.56 0.00 0.00 179.97 182.23 2wug h LEU 158 N 0.65 0.72 -0.55 3.04 5.85 -1.01 -2.16 115.31 121.85 2wug h LEU 158 Ca 0.16 -0.34 -0.02 0.00 0.84 0.00 0.00 57.88 58.52 2wug h LEU 158 Cb 0.13 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 2wug h LEU 158 CO -0.02 0.89 0.27 0.28 -0.34 0.00 0.00 178.44 179.53 2wug h SER 159 N 0.54 0.71 -0.62 1.25 0.02 -0.51 -1.78 113.55 113.16 2wug h SER 159 Ca 0.10 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 2wug h SER 159 Cb 0.55 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.88 2wug h SER 159 CO 0.03 0.64 0.39 0.50 -1.14 0.00 0.00 176.83 177.25 2wug h LYS 160 N 0.74 0.83 -0.84 3.45 3.64 -0.79 -1.43 116.57 122.17 2wug h LYS 160 Ca 0.19 -0.07 0.01 0.00 -1.27 0.00 0.00 60.65 59.51 2wug h LYS 160 Cb 0.11 -0.18 -0.04 0.00 -0.41 0.00 0.00 32.23 31.70 2wug h LYS 160 CO -0.03 0.58 0.56 0.35 -2.27 0.00 0.00 179.45 178.64 2wug h PHE 161 N 0.84 1.06 0.00 1.91 3.57 -1.23 0.15 116.94 123.25 2wug h PHE 161 Ca 0.23 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.71 2wug h PHE 161 Cb -0.05 -0.36 -0.01 0.00 2.79 0.00 0.00 35.95 38.32 2wug h PHE 161 CO -0.02 0.67 -0.17 0.66 -2.23 0.00 0.00 178.31 177.21 2wug h SER 162 N 1.14 0.00 0.50 0.41 4.64 -0.39 -0.97 113.55 118.89 2wug h SER 162 Ca 0.31 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.33 2wug h SER 162 Cb -0.13 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 61.93 2wug h SER 162 CO -0.07 0.17 -1.62 0.58 -0.87 0.00 0.00 176.83 175.03 2wug h VAL 163 N 0.00 0.99 -2.39 0.95 2.07 -0.96 -3.42 116.25 113.49 2wug h VAL 163 Ca -0.00 -2.77 -0.59 0.00 0.82 0.00 0.00 66.70 64.16 2wug h VAL 163 Cb 0.44 2.55 -0.38 0.00 -1.52 0.00 0.00 31.29 32.38 2wug h VAL 163 CO 0.02 0.67 -0.96 0.00 0.02 0.00 0.00 177.57 177.32 2wug s ALA 164 N -2.61 1.47 -1.15 1.67 0.00 0.50 -5.06 121.76 116.59 2wug s ALA 164 Ca -0.07 -2.49 -0.19 0.00 0.00 0.00 0.00 51.96 49.21 2wug s ALA 164 Cb 0.08 -1.61 -0.05 0.00 0.00 0.00 0.00 23.12 21.54 2wug s ALA 164 CO 0.82 -1.98 2.00 -2.30 0.00 0.00 0.00 175.76 174.31 2wug n PRO 165 N 2.82 2.24 -4.14 0.00 -0.02 -0.42 -4.39 135.00 131.09 2wug n PRO 165 Ca 0.29 -2.41 -0.25 0.00 -2.02 0.00 0.00 63.50 59.12 2wug n PRO 165 Cb 0.47 -3.25 -0.06 0.00 -0.02 0.00 0.00 33.50 30.65 2wug n PRO 165 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2wug s THR 166 N 5.13 4.21 0.27 3.45 -4.23 -1.26 -4.98 115.64 118.22 2wug s THR 166 Ca 0.55 -1.34 -0.04 0.00 -1.18 0.00 0.00 61.69 59.68 2wug s THR 166 Cb 0.11 -3.19 0.27 0.00 1.34 0.00 0.00 72.50 71.02 2wug s THR 166 CO 0.04 -0.21 1.91 -0.09 -0.54 0.00 0.00 174.62 175.74 2wug h ARG 167 N 2.13 1.21 -0.40 3.99 2.43 -1.98 -0.74 114.38 121.02 2wug h ARG 167 Ca -0.47 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 58.61 2wug h ARG 167 Cb 1.22 -0.27 -0.02 0.00 -0.42 0.00 0.00 29.97 30.48 2wug h ARG 167 CO 0.61 0.80 0.21 0.93 -1.51 0.00 0.00 179.97 181.01 2wug h GLU 168 N 1.24 0.56 -0.31 0.20 3.07 -1.95 -0.11 114.58 117.28 2wug h GLU 168 Ca 0.39 -0.07 -0.09 0.00 -0.50 0.00 0.00 59.36 59.09 2wug h GLU 168 Cb -0.00 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 27.79 2wug h GLU 168 CO -0.12 0.47 -0.18 -0.91 -1.40 0.00 0.00 179.01 176.87 2wug h ASN 169 N 0.51 0.56 -0.28 1.42 2.35 -1.70 -1.34 115.58 117.10 2wug h ASN 169 Ca 0.14 -0.17 -0.05 0.00 -0.55 0.00 0.00 56.30 55.67 2wug h ASN 169 Cb 0.08 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.29 2wug h ASN 169 CO -0.02 0.75 -0.00 0.25 -1.65 0.00 0.00 177.43 176.76 2wug h LEU 170 N 0.51 0.49 -1.00 1.61 5.85 -0.81 -1.74 115.31 120.22 2wug h LEU 170 Ca 0.08 -0.31 0.00 0.00 0.84 0.00 0.00 57.88 58.49 2wug h LEU 170 Cb 0.60 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 41.46 2wug h LEU 170 CO 0.04 0.68 0.59 -0.08 -0.34 0.00 0.00 178.44 179.34 2wug h GLU 171 N 0.29 1.27 -0.54 1.25 4.81 -0.82 -0.84 114.58 120.00 2wug h GLU 171 Ca 0.08 -0.10 0.02 0.00 -0.13 0.00 0.00 59.36 59.23 2wug h GLU 171 Cb 0.43 -0.27 -0.04 0.00 0.63 0.00 0.00 28.75 29.50 2wug h GLU 171 CO 0.01 0.87 0.33 0.00 -0.73 0.00 0.00 179.01 179.50 2wug h ALA 172 N 1.35 0.69 -0.09 2.92 0.00 -0.99 -1.38 119.26 121.76 2wug h ALA 172 Ca 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2wug h ALA 172 Cb -0.09 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 2wug h ALA 172 CO -0.07 0.05 0.06 0.35 0.00 0.00 0.00 179.25 179.64 2wug h PHE 173 N 0.65 0.12 -0.65 0.00 3.57 -0.63 -3.04 116.94 116.95 2wug h PHE 173 Ca 0.22 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.72 2wug h PHE 173 Cb 0.02 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.68 2wug h PHE 173 CO -0.06 0.09 0.39 -0.07 -2.23 0.00 0.00 178.31 176.43 2wug h LEU 174 N 0.11 0.76 -1.96 0.59 3.38 -0.83 -2.13 115.31 115.24 2wug h LEU 174 Ca 0.03 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 2wug h LEU 174 Cb 0.00 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 2wug h LEU 174 CO -0.01 0.58 -0.11 0.03 0.09 0.00 0.00 178.44 179.03 2wug h ARG 175 N 0.89 0.00 -0.51 1.13 3.08 -1.15 -0.29 114.38 117.53 2wug h ARG 175 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.28 2wug h ARG 175 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.01 2wug h ARG 175 CO -0.04 0.11 0.00 1.33 -1.07 0.00 0.00 179.97 180.29 2wug n VAL 176 N -3.85 0.83 0.60 2.04 0.24 -0.80 -3.81 118.33 113.57 2wug n VAL 176 Ca -0.02 -0.64 0.11 0.00 -2.04 0.00 0.00 64.34 61.75 2wug n VAL 176 Cb 0.21 0.14 0.08 0.00 -1.47 0.00 0.00 33.84 32.79 2wug n VAL 176 CO 0.00 0.00 0.00 0.23 -2.14 0.00 0.00 176.83 174.92 2wug n MET 177 N 0.68 0.27 -4.15 7.34 2.81 -0.12 -4.19 117.12 119.77 2wug n MET 177 Ca 0.15 0.02 -0.14 0.00 -1.81 0.00 0.00 57.70 55.92 2wug n MET 177 Cb 0.47 -1.61 -0.11 0.00 -0.71 0.00 0.00 33.22 31.26 2wug n MET 177 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 2wug s VAL 178 N -3.17 0.83 -0.06 2.03 -7.23 -1.25 -1.09 120.40 110.46 2wug s VAL 178 Ca 0.05 -1.51 -0.24 0.00 -1.81 0.00 0.00 61.98 58.47 2wug s VAL 178 Cb 0.14 -1.20 -0.28 0.00 0.56 0.00 0.00 36.38 35.61 2wug s VAL 178 CO 0.77 -0.53 0.92 0.22 -0.31 0.00 0.00 175.10 176.18 2wug h TYR 179 N 3.77 0.39 -2.61 2.82 3.20 -1.87 -3.42 116.97 119.25 2wug h TYR 179 Ca -0.37 -0.26 -0.64 0.00 3.14 0.00 0.00 58.73 60.61 2wug h TYR 179 Cb 1.19 -0.03 -0.15 0.00 1.54 0.00 0.00 36.73 39.29 2wug h TYR 179 CO 0.63 1.15 0.58 0.34 -1.64 0.00 0.00 178.16 179.22 2wug s ASP 180 N -6.66 6.23 0.15 -2.11 2.15 -1.26 -4.89 116.67 110.28 2wug s ASP 180 Ca -0.15 -1.13 0.19 0.00 0.43 0.00 0.00 52.55 51.90 2wug s ASP 180 Cb 0.00 -2.42 0.82 0.00 -0.30 0.00 0.00 42.92 41.03 2wug s ASP 180 CO 0.78 -1.40 1.60 0.29 -0.17 0.00 0.00 175.17 176.28 2wug n LYS 181 N 7.57 0.11 0.19 4.34 5.02 -1.26 -1.53 118.16 132.60 2wug n LYS 181 Ca -0.00 0.35 0.13 0.00 -2.02 0.00 0.00 58.31 56.78 2wug n LYS 181 Cb 0.46 -1.71 0.67 0.00 -0.02 0.00 0.00 35.03 34.42 2wug n LYS 181 CO 0.00 0.00 0.00 -0.91 -0.52 0.00 0.00 177.40 175.97 2wug h ASN 182 N 0.00 0.00 1.15 4.39 2.35 -1.98 -1.08 115.58 120.41 2wug h ASN 182 Ca 0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 2wug h ASN 182 Cb 0.31 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.68 2wug h ASN 182 CO 0.00 0.00 -0.03 -0.07 -1.65 0.00 0.00 177.43 175.68 2wug h LEU 183 N 0.00 0.00 -7.80 1.61 3.38 -1.70 -3.37 115.31 107.43 2wug h LEU 183 Ca 0.00 0.00 -0.72 0.00 0.09 0.00 0.00 57.88 57.25 2wug h LEU 183 Cb 0.13 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 40.71 2wug h LEU 183 CO 0.00 0.03 1.29 -0.63 0.09 0.00 0.00 178.44 179.23 2wug s ILE 184 N -3.60 4.87 0.59 1.22 -1.09 -0.41 -4.92 121.20 117.87 2wug s ILE 184 Ca 0.02 -2.30 -0.08 0.00 -2.23 0.00 0.00 60.65 56.06 2wug s ILE 184 Cb 0.09 -4.90 -0.01 0.00 -1.58 0.00 0.00 42.46 36.05 2wug s ILE 184 CO 0.58 -1.63 0.94 0.42 -1.23 0.00 0.00 174.94 174.02 2wug s THR 185 N 2.10 4.20 0.31 2.92 -4.23 -1.26 -4.90 115.64 114.77 2wug s THR 185 Ca 0.41 0.37 0.00 0.00 -1.18 0.00 0.00 61.69 61.29 2wug s THR 185 Cb -0.03 -3.67 0.27 0.00 1.34 0.00 0.00 72.50 70.42 2wug s THR 185 CO -0.02 -0.77 1.94 -0.65 -0.54 0.00 0.00 174.62 174.59 2wug h PRO 186 N -0.21 0.99 -0.58 3.99 0.11 -1.96 -1.24 132.00 133.10 2wug h PRO 186 Ca -0.45 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 65.54 2wug h PRO 186 Cb 1.23 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 32.09 2wug h PRO 186 CO 0.62 0.66 0.16 0.93 -0.21 0.00 0.00 178.00 180.16 2wug h GLU 187 N 1.02 0.92 -0.36 1.05 3.07 -1.99 -0.13 114.58 118.17 2wug h GLU 187 Ca 0.34 -0.21 -0.02 0.00 -0.50 0.00 0.00 59.36 58.97 2wug h GLU 187 Cb 0.07 -0.13 -0.02 0.00 -0.84 0.00 0.00 28.75 27.84 2wug h GLU 187 CO -0.11 0.84 0.13 1.25 -1.40 0.00 0.00 179.01 179.72 2wug h LEU 188 N 0.83 0.51 -0.03 1.33 5.85 -1.76 -0.67 115.31 121.37 2wug h LEU 188 Ca 0.18 -0.19 0.01 0.00 0.84 0.00 0.00 57.88 58.73 2wug h LEU 188 Cb 0.32 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 2wug h LEU 188 CO -0.00 0.56 -0.01 0.58 -0.34 0.00 0.00 178.44 179.23 2wug h VAL 189 N 0.44 0.97 -0.41 1.05 2.07 -1.03 -0.70 116.25 118.64 2wug h VAL 189 Ca 0.12 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.65 2wug h VAL 189 Cb 0.22 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 2wug h VAL 189 CO -0.01 0.00 0.26 0.44 0.02 0.00 0.00 177.57 178.29 2wug h ASP 190 N -0.00 0.45 -0.21 0.57 3.32 -0.89 -0.67 116.42 118.99 2wug h ASP 190 Ca 0.02 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 2wug h ASP 190 Cb 0.02 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 2wug h ASP 190 CO -0.03 0.32 0.12 -0.61 -1.72 0.00 0.00 179.24 177.32 2wug h GLN 191 N 0.54 0.29 -0.30 3.56 4.15 -0.91 -2.14 115.11 120.30 2wug h GLN 191 Ca 0.16 -0.03 -0.09 0.00 0.77 0.00 0.00 58.65 59.45 2wug h GLN 191 Cb -0.04 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 27.58 2wug h GLN 191 CO -0.05 0.26 -0.20 0.00 -1.93 0.00 0.00 178.83 176.92 2wug h ARG 192 N 0.25 0.56 -0.51 1.69 2.47 -0.96 -2.99 114.38 114.88 2wug h ARG 192 Ca 0.08 -0.20 -0.07 0.00 -1.26 0.00 0.00 59.98 58.53 2wug h ARG 192 Cb 0.05 -0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.31 2wug h ARG 192 CO -0.01 0.73 0.05 0.35 0.56 0.00 0.00 179.97 181.64 2wug h PHE 193 N 0.50 0.94 -0.93 3.04 3.57 -0.96 0.13 116.94 123.23 2wug h PHE 193 Ca 0.08 -0.14 0.04 0.00 3.53 0.00 0.00 57.97 61.48 2wug h PHE 193 Cb 0.62 -0.25 -0.06 0.00 2.79 0.00 0.00 35.95 39.05 2wug h PHE 193 CO 0.02 0.86 0.61 0.00 -2.23 0.00 0.00 178.31 177.57 2wug h ALA 194 N 0.96 1.43 0.12 2.41 0.00 -1.25 -1.15 119.26 121.79 2wug h ALA 194 Ca 0.15 -0.04 -0.28 0.00 0.00 0.00 0.00 54.91 54.74 2wug h ALA 194 Cb 0.45 -0.31 0.03 0.00 0.00 0.00 0.00 17.79 17.96 2wug h ALA 194 CO 0.02 0.46 -1.16 -0.07 0.00 0.00 0.00 179.25 178.50 2wug h LEU 195 N 1.13 0.81 -0.69 0.00 3.38 -1.39 -3.36 115.31 115.20 2wug h LEU 195 Ca 0.38 -0.84 -0.09 0.00 0.09 0.00 0.00 57.88 57.41 2wug h LEU 195 Cb 0.07 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 2wug h LEU 195 CO -0.12 1.57 -0.44 0.00 0.09 0.00 0.00 178.44 179.53 2wug h ALA 196 N 0.25 0.89 -0.40 1.53 0.00 -0.48 -3.29 119.26 117.77 2wug h ALA 196 Ca -0.18 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.32 2wug h ALA 196 Cb 1.86 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.58 2wug h ALA 196 CO 0.22 0.56 0.00 -1.13 0.00 0.00 0.00 179.25 178.90 2wug n SER 197 N -3.47 2.93 -4.76 0.00 3.41 -0.46 -4.15 113.62 107.12 2wug n SER 197 Ca 0.00 -1.93 -0.32 0.00 -0.26 0.00 0.00 58.87 56.36 2wug n SER 197 Cb 0.58 -0.26 0.08 0.00 -0.26 0.00 0.00 64.21 64.35 2wug n SER 197 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2wug s THR 198 N -1.48 3.06 0.16 6.66 -4.23 -1.24 -4.87 115.64 113.70 2wug s THR 198 Ca 0.37 0.43 -0.16 0.00 -1.18 0.00 0.00 61.69 61.15 2wug s THR 198 Cb 0.21 -2.90 0.02 0.00 1.34 0.00 0.00 72.50 71.17 2wug s THR 198 CO 0.29 -0.37 1.78 -0.65 -0.54 0.00 0.00 174.62 175.13 2wug h PRO 199 N -0.58 0.37 -0.84 3.99 0.11 -1.94 -1.98 132.00 131.12 2wug h PRO 199 Ca -0.45 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 2wug h PRO 199 Cb 1.25 -0.08 -0.04 0.00 0.11 0.00 0.00 31.00 32.24 2wug h PRO 199 CO 0.51 0.24 0.48 1.05 -0.21 0.00 0.00 178.00 180.07 2wug h GLU 200 N 0.38 1.16 -0.37 1.05 9.09 -1.96 -1.90 114.58 122.04 2wug h GLU 200 Ca 0.16 -0.13 -0.09 0.00 0.05 0.00 0.00 59.36 59.35 2wug h GLU 200 Cb 0.07 -0.23 -0.01 0.00 -1.65 0.00 0.00 28.75 26.93 2wug h GLU 200 CO -0.11 0.85 -0.11 0.77 0.05 0.00 0.00 179.01 180.45 2wug h SER 201 N 1.17 0.73 -0.48 3.06 0.02 -1.81 -0.61 113.55 115.64 2wug h SER 201 Ca 0.30 -0.38 -0.06 0.00 -0.84 0.00 0.00 61.79 60.81 2wug h SER 201 Cb 0.01 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.33 2wug h SER 201 CO -0.05 0.94 0.07 -0.07 -1.14 0.00 0.00 176.83 176.58 2wug h LEU 202 N 0.52 0.77 -0.32 5.07 3.38 -1.16 -0.04 115.31 123.52 2wug h LEU 202 Ca 0.09 -0.27 0.07 0.00 0.09 0.00 0.00 57.88 57.87 2wug h LEU 202 Cb 0.63 -0.20 -0.08 0.00 0.09 0.00 0.00 40.66 41.10 2wug h LEU 202 CO 0.04 0.84 -0.21 0.74 0.09 0.00 0.00 178.44 179.94 2wug h THR 203 N 0.67 0.43 0.25 0.22 2.02 -1.27 -2.34 112.91 112.89 2wug h THR 203 Ca 0.14 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.31 2wug h THR 203 Cb 0.40 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 67.25 2wug h THR 203 CO 0.01 0.00 -0.12 0.00 0.37 0.00 0.00 175.52 175.78 2wug h ALA 204 N 1.01 -0.33 -0.49 6.16 0.00 -0.81 -2.62 119.26 122.17 2wug h ALA 204 Ca 0.17 -0.09 0.08 0.00 0.00 0.00 0.00 54.91 55.06 2wug h ALA 204 Cb 0.42 0.13 -0.07 0.00 0.00 0.00 0.00 17.79 18.28 2wug h ALA 204 CO -0.42 -0.66 0.12 1.79 0.00 0.00 0.00 179.25 180.07 2wug h THR 205 N -0.38 0.75 -0.26 0.00 1.35 -0.75 -1.26 112.91 112.35 2wug h THR 205 Ca -0.03 -0.09 0.06 0.00 -0.55 0.00 0.00 66.41 65.80 2wug h THR 205 Cb 0.29 0.47 -0.07 0.00 -1.73 0.00 0.00 68.15 67.11 2wug h THR 205 CO 0.06 0.05 -0.17 0.03 -0.25 0.00 0.00 175.52 175.24 2wug h ARG 206 N 0.26 -0.14 -0.48 4.72 3.08 -1.42 -1.56 114.38 118.83 2wug h ARG 206 Ca 0.24 0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.32 2wug h ARG 206 Cb 0.31 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.37 2wug h ARG 206 CO -0.30 -0.09 0.32 0.00 -1.07 0.00 0.00 179.97 178.82 2wug h ALA 207 N 1.02 1.70 0.41 0.04 0.00 -0.91 -1.99 119.26 119.53 2wug h ALA 207 Ca 0.14 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2wug h ALA 207 Cb 0.36 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2wug h ALA 207 CO -0.35 0.26 -0.20 1.98 0.00 0.00 0.00 179.25 180.94 2wug h MET 208 N 0.61 -0.53 -0.80 0.00 1.85 -0.47 -2.19 114.93 113.40 2wug h MET 208 Ca 0.18 0.04 0.09 0.00 -0.61 0.00 0.00 59.70 59.40 2wug h MET 208 Cb -0.00 0.12 -0.07 0.00 0.43 0.00 0.00 31.60 32.08 2wug h MET 208 CO -0.04 -0.23 0.46 0.78 -0.40 0.00 0.00 176.91 177.47 2wug h GLY 209 N -1.00 1.24 2.00 1.39 0.00 -1.20 -2.14 103.07 103.36 2wug h GLY 209 Ca -0.06 -0.30 -0.11 0.00 0.00 0.00 0.00 47.33 46.86 2wug h GLY 209 CO 0.09 0.13 -0.51 0.07 0.00 0.00 0.00 176.54 176.33 2wug h LYS 210 N 0.77 0.00 0.00 4.80 2.10 -1.40 -2.98 116.57 119.86 2wug h LYS 210 Ca 0.38 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.03 2wug h LYS 210 Cb 0.34 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.67 2wug h LYS 210 CO -0.24 0.51 0.00 0.66 -2.00 0.00 0.00 179.45 178.37 2wug h SER 211 N 0.00 0.00 1.11 7.07 4.64 -0.71 -0.86 113.55 124.80 2wug h SER 211 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2wug h SER 211 Cb 0.95 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 2wug h SER 211 CO 0.07 0.00 0.00 0.49 -0.87 0.00 0.00 176.83 176.52 2wug n PHE 212 N -2.75 0.42 -0.50 4.77 3.72 -1.12 -3.29 117.46 118.69 2wug n PHE 212 Ca -0.02 0.13 0.06 0.00 -0.05 0.00 0.00 57.45 57.57 2wug n PHE 212 Cb 0.06 -0.71 0.16 0.00 -0.94 0.00 0.00 39.48 38.06 2wug n PHE 212 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2wug n ALA 213 N -1.63 2.42 -1.14 4.37 0.00 -0.33 -4.59 120.51 119.61 2wug n ALA 213 Ca 0.06 -1.65 -0.03 0.00 0.00 0.00 0.00 53.44 51.82 2wug n ALA 213 Cb 0.35 -0.45 0.03 0.00 0.00 0.00 0.00 19.45 19.38 2wug n ALA 213 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wug n GLY 214 N -0.18 -1.16 0.25 0.00 0.00 -1.21 -4.88 105.19 98.01 2wug n GLY 214 Ca 0.13 -1.68 0.10 0.00 0.00 0.00 0.00 46.02 44.58 2wug n GLY 214 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wug h ALA 215 N -1.95 1.44 -0.96 4.61 0.00 -1.95 -2.25 119.26 118.19 2wug h ALA 215 Ca -0.06 -0.12 -0.51 0.00 0.00 0.00 0.00 54.91 54.23 2wug h ALA 215 Cb 0.16 -0.02 -0.30 0.00 0.00 0.00 0.00 17.79 17.64 2wug h ALA 215 CO 0.04 0.16 0.62 -0.40 0.00 0.00 0.00 179.25 179.67 2wug n ASP 216 N -3.88 3.83 0.25 0.00 5.68 -1.26 -4.66 116.55 116.51 2wug n ASP 216 Ca -0.02 -3.63 0.12 0.00 -0.50 0.00 0.00 54.79 50.76 2wug n ASP 216 Cb 0.23 -0.83 0.76 0.00 -1.14 0.00 0.00 41.12 40.13 2wug n ASP 216 CO 0.00 0.00 0.00 2.19 -1.33 0.00 0.00 177.20 178.06 2wug h PHE 217 N 1.04 0.00 0.00 2.11 -5.15 -1.65 -1.93 116.94 111.36 2wug h PHE 217 Ca 0.61 0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 58.38 2wug h PHE 217 Cb 2.72 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 38.89 2wug h PHE 217 CO 1.56 0.00 -0.03 0.93 -2.00 0.00 0.00 178.31 178.77 2wug h GLU 218 N 0.00 0.00 0.00 6.09 5.08 -1.87 0.15 114.58 124.03 2wug h GLU 218 Ca 0.02 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2wug h GLU 218 Cb 0.10 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 2wug h GLU 218 CO -0.00 0.03 -0.01 0.00 -1.00 0.00 0.00 179.01 178.02 2wug h ALA 219 N 1.97 1.38 0.00 3.43 0.00 -1.74 -0.63 119.26 123.67 2wug h ALA 219 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2wug h ALA 219 Cb 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2wug h ALA 219 CO 0.00 0.02 -0.18 0.41 0.00 0.00 0.00 179.25 179.50 2wug n GLY 220 N -1.17 -1.46 2.68 0.00 0.00 0.04 -4.44 105.19 100.83 2wug n GLY 220 Ca -0.03 -0.16 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 2wug n GLY 220 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2wug n MET 221 N -1.68 4.77 0.12 1.61 2.00 -0.24 -4.44 117.12 119.26 2wug n MET 221 Ca 0.06 -4.10 0.13 0.00 0.00 0.00 0.00 57.70 53.79 2wug n MET 221 Cb 0.36 -2.59 0.45 0.00 0.00 0.00 0.00 33.22 31.44 2wug n MET 221 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 175.97 174.64 2wug n MET 222 N 1.28 0.23 0.23 0.03 0.00 -0.44 -1.86 117.12 116.59 2wug n MET 222 Ca 0.48 0.32 0.16 0.00 0.00 0.00 0.00 57.70 58.65 2wug n MET 222 Cb 0.28 -1.84 0.82 0.00 0.00 0.00 0.00 33.22 32.48 2wug n MET 222 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 175.97 176.08 2wug h TRP 223 N 0.00 0.00 0.00 2.03 5.08 -1.69 0.46 115.95 121.84 2wug h TRP 223 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 2wug h TRP 223 Cb 0.56 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.72 2wug h TRP 223 CO 0.00 0.00 -0.11 0.54 -1.28 0.00 0.00 178.44 177.59 2wug n ARG 224 N -2.57 0.14 0.00 0.12 1.74 -0.78 -4.29 116.66 111.01 2wug n ARG 224 Ca -0.02 0.10 0.00 0.00 -0.77 0.00 0.00 57.85 57.16 2wug n ARG 224 Cb 0.06 -1.65 0.00 0.00 -1.02 0.00 0.00 32.46 29.85 2wug n ARG 224 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2wug n GLU 225 N -1.89 0.83 0.06 5.56 1.02 0.09 -4.76 120.64 121.56 2wug n GLU 225 Ca 0.06 0.00 0.08 0.00 -0.02 0.00 0.00 57.16 57.28 2wug n GLU 225 Cb 0.39 -0.93 0.35 0.00 -0.02 0.00 0.00 31.44 31.23 2wug n GLU 225 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 2wug n VAL 226 N -1.34 1.09 0.17 2.62 0.24 -0.83 -1.06 118.33 119.22 2wug n VAL 226 Ca 0.00 0.33 0.12 0.00 -2.04 0.00 0.00 64.34 62.74 2wug n VAL 226 Cb 0.00 -1.20 0.62 0.00 -1.47 0.00 0.00 33.84 31.79 2wug n VAL 226 CO 0.00 0.00 0.00 0.10 -2.14 0.00 0.00 176.83 174.79 2wug h TYR 227 N 0.00 0.00 0.00 6.34 -0.00 -1.86 -1.05 116.97 120.40 2wug h TYR 227 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 2wug h TYR 227 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.96 2wug h TYR 227 CO 0.00 0.00 -0.33 0.54 -0.00 0.00 0.00 178.16 178.37 2wug n ARG 228 N -2.30 0.21 -2.18 0.10 1.74 -0.22 -4.71 116.66 109.30 2wug n ARG 228 Ca -0.02 0.11 -0.42 0.00 -0.77 0.00 0.00 57.85 56.75 2wug n ARG 228 Cb 0.05 -1.68 -0.03 0.00 -1.02 0.00 0.00 32.46 29.77 2wug n ARG 228 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2wug s LEU 229 N -4.04 4.37 -0.01 0.55 1.43 -0.40 -4.92 118.68 115.66 2wug s LEU 229 Ca 0.09 2.32 0.20 0.00 -1.03 0.00 0.00 54.13 55.71 2wug s LEU 229 Cb 0.14 -3.59 -0.26 0.00 0.03 0.00 0.00 46.19 42.51 2wug s LEU 229 CO 0.65 -0.65 0.70 0.54 0.23 0.00 0.00 176.35 177.83 2wug n ARG 230 N 3.96 0.44 -2.56 1.70 1.74 -1.26 -4.37 116.66 116.31 2wug n ARG 230 Ca 0.11 -0.07 -0.28 0.00 -0.77 0.00 0.00 57.85 56.84 2wug n ARG 230 Cb 0.42 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.39 2wug n ARG 230 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 2wug s GLN 231 N -3.12 3.54 0.45 5.56 0.00 -1.26 -4.85 119.66 119.98 2wug s GLN 231 Ca 0.02 0.25 -0.25 0.00 -0.00 0.00 0.00 55.36 55.37 2wug s GLN 231 Cb 0.15 -2.35 -0.08 0.00 0.00 0.00 0.00 33.01 30.73 2wug s GLN 231 CO 0.85 -0.25 1.44 -2.14 0.00 0.00 0.00 175.29 175.19 2wug s PRO 232 N -4.79 3.70 -0.06 9.60 0.02 -1.26 -4.49 135.00 137.72 2wug s PRO 232 Ca 0.48 2.44 -0.01 0.00 0.02 0.00 0.00 61.00 63.94 2wug s PRO 232 Cb -0.10 -2.67 0.03 0.00 0.02 0.00 0.00 34.50 31.77 2wug s PRO 232 CO 0.46 -0.82 -0.01 0.08 -0.33 0.00 0.00 177.00 176.39 2wug s VAL 233 N -1.19 0.36 -0.38 3.83 1.01 -0.98 -2.61 120.40 120.44 2wug s VAL 233 Ca 0.61 0.08 -0.12 0.00 0.00 0.00 0.00 61.98 62.55 2wug s VAL 233 Cb -0.44 -0.49 0.02 0.00 0.00 0.00 0.00 36.38 35.47 2wug s VAL 233 CO 0.57 0.24 0.23 -0.22 0.00 0.00 0.00 175.10 175.92 2wug s LEU 234 N 1.66 4.78 -0.10 3.92 2.96 0.26 -0.40 118.68 131.75 2wug s LEU 234 Ca 0.00 -0.92 -0.24 0.00 -0.22 0.00 0.00 54.13 52.75 2wug s LEU 234 Cb -0.13 -2.06 -0.03 0.00 0.50 0.00 0.00 46.19 44.47 2wug s LEU 234 CO -0.04 -0.38 0.76 -0.76 -1.32 0.00 0.00 176.35 174.60 2wug s LEU 235 N 1.60 4.27 -0.10 -0.68 1.43 0.06 -0.99 118.68 124.25 2wug s LEU 235 Ca 0.03 1.19 0.03 0.00 -1.03 0.00 0.00 54.13 54.35 2wug s LEU 235 Cb -0.19 -3.15 0.01 0.00 0.03 0.00 0.00 46.19 42.89 2wug s LEU 235 CO 0.08 -0.22 -0.21 -0.63 0.23 0.00 0.00 176.35 175.60 2wug s ILE 236 N 1.30 1.85 0.00 -0.59 1.01 0.21 -0.15 121.20 124.84 2wug s ILE 236 Ca 0.38 -0.88 0.03 0.00 0.00 0.00 0.00 60.65 60.18 2wug s ILE 236 Cb -0.17 -1.63 -0.01 0.00 0.01 0.00 0.00 42.46 40.66 2wug s ILE 236 CO 0.17 0.51 -0.09 0.26 0.00 0.00 0.00 174.94 175.79 2wug s TRP 237 N 0.58 0.82 -0.03 3.97 0.51 0.09 -0.97 118.94 123.92 2wug s TRP 237 Ca -0.14 -0.20 -0.29 0.00 -2.12 0.00 0.00 56.10 53.36 2wug s TRP 237 Cb -0.17 -0.52 -0.03 0.00 -0.81 0.00 0.00 33.47 31.94 2wug s TRP 237 CO 0.04 -0.01 0.93 0.20 -0.51 0.00 0.00 176.95 177.60 2wug s GLY 238 N -0.42 2.78 0.42 0.98 0.00 -1.26 -0.92 107.32 108.90 2wug s GLY 238 Ca 0.02 0.43 0.12 0.00 0.00 0.00 0.00 44.72 45.30 2wug s GLY 238 CO -0.00 1.62 1.97 -0.09 0.00 0.00 0.00 173.10 176.60 2wug h ARG 239 N 6.84 0.46 -0.74 2.90 2.43 -0.70 -1.70 114.38 123.87 2wug h ARG 239 Ca -0.40 -0.03 -0.16 0.00 -0.81 0.00 0.00 59.98 58.59 2wug h ARG 239 Cb 1.21 -0.10 -0.09 0.00 -0.42 0.00 0.00 29.97 30.56 2wug h ARG 239 CO 0.76 0.30 0.20 0.39 -1.51 0.00 0.00 179.97 180.12 2wug n GLU 240 N -4.48 3.83 -1.73 0.20 4.71 0.20 -4.66 120.64 118.71 2wug n GLU 240 Ca 0.10 -2.88 -0.42 0.00 -0.01 0.00 0.00 57.16 53.95 2wug n GLU 240 Cb 0.36 -2.18 -0.03 0.00 -1.01 0.00 0.00 31.44 28.58 2wug n GLU 240 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 2wug s ASP 241 N -0.85 6.49 0.00 1.62 -1.08 -0.64 -4.56 116.67 117.65 2wug s ASP 241 Ca 0.51 2.60 0.19 0.00 -0.52 0.00 0.00 52.55 55.33 2wug s ASP 241 Cb 0.41 -2.53 0.19 0.00 -1.46 0.00 0.00 42.92 39.52 2wug s ASP 241 CO 0.13 -1.03 1.14 0.54 0.52 0.00 0.00 175.17 176.47 2wug n ARG 242 N 7.45 1.76 -0.09 4.34 1.74 -1.26 -3.78 116.66 126.82 2wug n ARG 242 Ca 0.19 -1.72 -0.12 0.00 -0.77 0.00 0.00 57.85 55.43 2wug n ARG 242 Cb 0.41 -1.38 -0.05 0.00 -1.02 0.00 0.00 32.46 30.43 2wug n ARG 242 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2wug n VAL 243 N 1.09 1.49 -3.93 1.55 0.31 -1.26 -1.71 118.33 115.87 2wug n VAL 243 Ca 0.12 0.06 -0.30 0.00 -0.01 0.00 0.00 64.34 64.21 2wug n VAL 243 Cb 0.49 -2.26 -0.14 0.00 -0.91 0.00 0.00 33.84 31.02 2wug n VAL 243 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 2wug s ASN 244 N -6.21 4.29 0.91 4.52 0.01 -1.26 -4.60 114.94 112.60 2wug s ASN 244 Ca -0.27 -3.06 -0.12 0.00 -0.71 0.00 0.00 52.86 48.71 2wug s ASN 244 Cb 0.05 -1.59 0.14 0.00 0.41 0.00 0.00 41.25 40.26 2wug s ASN 244 CO 0.40 -0.22 1.09 -2.16 -1.51 0.00 0.00 177.10 174.70 2wug s PRO 245 N -0.34 1.12 0.44 -0.60 0.05 -1.25 -4.82 135.00 129.60 2wug s PRO 245 Ca 0.18 0.71 0.14 0.00 0.05 0.00 0.00 61.00 62.08 2wug s PRO 245 Cb -0.24 -1.80 1.03 0.00 0.05 0.00 0.00 34.50 33.54 2wug s PRO 245 CO -0.01 -2.31 2.00 1.25 0.05 0.00 0.00 177.00 177.98 2wug h LEU 246 N -1.59 0.35 -2.37 -3.56 5.85 -1.83 -0.07 115.31 112.09 2wug h LEU 246 Ca -0.50 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.22 2wug h LEU 246 Cb 1.30 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.26 2wug h LEU 246 CO 0.56 0.22 0.06 -2.24 -0.34 0.00 0.00 178.44 176.70 2wug h ASP 247 N 0.40 0.00 0.69 1.25 2.03 -1.93 -1.15 116.42 117.71 2wug h ASP 247 Ca 0.25 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.55 2wug h ASP 247 Cb 0.47 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.97 2wug h ASP 247 CO -0.07 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 178.75 2wug n GLY 248 N -1.16 -1.22 0.19 7.15 0.00 -0.04 -3.08 105.19 107.03 2wug n GLY 248 Ca -0.02 0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.16 2wug n GLY 248 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wug h ALA 249 N 2.35 0.95 -0.38 4.61 0.00 -1.38 -3.04 119.26 122.37 2wug h ALA 249 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 2wug h ALA 249 Cb 0.35 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2wug h ALA 249 CO 0.00 0.00 -0.22 -0.07 0.00 0.00 0.00 179.25 178.96 2wug h LEU 250 N 0.00 0.85 -0.40 0.00 3.38 -1.73 -1.15 115.31 116.26 2wug h LEU 250 Ca 0.00 -0.42 -0.08 0.00 0.09 0.00 0.00 57.88 57.47 2wug h LEU 250 Cb 0.95 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 2wug h LEU 250 CO 0.00 1.09 -0.04 0.58 0.09 0.00 0.00 178.44 180.15 2wug h VAL 251 N 0.62 1.27 -0.44 1.22 2.07 -1.84 -0.98 116.25 118.17 2wug h VAL 251 Ca 0.08 -1.10 -0.00 0.00 0.82 0.00 0.00 66.70 66.50 2wug h VAL 251 Cb 0.79 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 31.70 2wug h VAL 251 CO 0.06 0.37 0.26 0.00 0.02 0.00 0.00 177.57 178.28 2wug h ALA 252 N 0.86 0.56 -0.70 1.67 0.00 -1.76 -0.84 119.26 119.06 2wug h ALA 252 Ca 0.11 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2wug h ALA 252 Cb 0.55 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 2wug h ALA 252 CO 0.03 0.07 0.45 1.25 0.00 0.00 0.00 179.25 181.05 2wug h LEU 253 N 0.58 0.82 -0.48 0.00 5.85 -1.06 -1.27 115.31 119.75 2wug h LEU 253 Ca 0.16 -0.03 -0.10 0.00 0.84 0.00 0.00 57.88 58.74 2wug h LEU 253 Cb 0.02 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.83 2wug h LEU 253 CO -0.03 0.61 -0.09 0.50 -0.34 0.00 0.00 178.44 179.09 2wug h LYS 254 N 0.96 0.91 0.00 1.25 1.63 -0.93 -3.38 116.57 117.02 2wug h LYS 254 Ca 0.26 -0.34 0.00 0.00 -0.85 0.00 0.00 60.65 59.72 2wug h LYS 254 Cb -0.09 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 31.48 2wug h LYS 254 CO -0.05 0.99 -1.90 0.25 -3.45 0.00 0.00 179.45 175.29 2wug n THR 255 N -4.24 0.00 -2.72 1.00 -2.24 -0.34 -4.80 114.28 100.94 2wug n THR 255 Ca 0.00 -0.45 -0.43 0.00 -2.27 0.00 0.00 64.05 60.90 2wug n THR 255 Cb 0.38 0.08 -0.03 0.00 -2.10 0.00 0.00 70.33 68.66 2wug n THR 255 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2wug s ILE 256 N -3.42 4.51 0.26 2.28 1.01 -0.50 -4.08 121.20 121.27 2wug s ILE 256 Ca -0.07 1.42 -0.02 0.00 0.00 0.00 0.00 60.65 61.99 2wug s ILE 256 Cb 0.13 -4.40 0.24 0.00 0.01 0.00 0.00 42.46 38.45 2wug s ILE 256 CO 0.87 -0.56 1.79 -0.65 0.00 0.00 0.00 174.94 176.39 2wug h PRO 257 N 8.40 0.73 -0.77 2.79 0.11 -1.84 -2.00 132.00 139.42 2wug h PRO 257 Ca -0.22 -0.04 -0.48 0.00 0.11 0.00 0.00 66.00 65.37 2wug h PRO 257 Cb 1.07 -0.16 -0.27 0.00 0.11 0.00 0.00 31.00 31.75 2wug h PRO 257 CO 1.02 0.48 0.23 0.54 -0.21 0.00 0.00 178.00 180.06 2wug n ARG 258 N -4.78 2.52 -2.35 1.05 1.74 -1.26 -5.01 116.66 108.58 2wug n ARG 258 Ca 0.16 -3.37 -0.34 0.00 -0.77 0.00 0.00 57.85 53.53 2wug n ARG 258 Cb 0.37 -2.13 -0.01 0.00 -1.02 0.00 0.00 32.46 29.66 2wug n ARG 258 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wug s ALA 259 N -3.51 2.77 0.12 7.54 0.00 -0.75 -2.31 121.76 125.61 2wug s ALA 259 Ca 0.55 0.66 0.04 0.00 0.00 0.00 0.00 51.96 53.21 2wug s ALA 259 Cb 0.46 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 20.24 2wug s ALA 259 CO 0.03 -0.58 -0.11 -0.65 0.00 0.00 0.00 175.76 174.45 2wug s GLN 260 N -3.38 0.94 -0.03 0.00 -0.21 0.47 -4.88 119.66 112.55 2wug s GLN 260 Ca 0.69 -1.26 0.03 0.00 0.02 0.00 0.00 55.36 54.84 2wug s GLN 260 Cb -0.19 -0.61 0.00 0.00 1.00 0.00 0.00 33.01 33.21 2wug s GLN 260 CO 0.25 0.09 -0.12 -1.17 -2.12 0.00 0.00 175.29 172.23 2wug s LEU 261 N -2.68 1.81 -0.10 2.90 2.96 -1.26 -0.77 118.68 121.54 2wug s LEU 261 Ca 0.10 -0.24 0.02 0.00 -0.22 0.00 0.00 54.13 53.79 2wug s LEU 261 Cb -0.01 -0.70 0.01 0.00 0.50 0.00 0.00 46.19 45.99 2wug s LEU 261 CO 0.00 0.09 -0.17 -2.28 -1.32 0.00 0.00 176.35 172.67 2wug s HIS 262 N 0.19 2.07 -0.09 5.38 5.65 0.79 -4.96 115.29 124.32 2wug s HIS 262 Ca -0.04 -0.91 0.02 0.00 0.25 0.00 0.00 55.06 54.38 2wug s HIS 262 Cb -0.10 -1.45 -0.02 0.00 -1.18 0.00 0.00 32.58 29.83 2wug s HIS 262 CO 0.01 -0.43 -0.16 0.08 -0.65 0.00 0.00 174.74 173.59 2wug s VAL 263 N 0.74 2.81 -0.23 0.89 1.01 -1.26 -0.73 120.40 123.63 2wug s VAL 263 Ca -0.11 -0.77 -0.07 0.00 0.00 0.00 0.00 61.98 61.02 2wug s VAL 263 Cb -0.16 -2.13 -0.03 0.00 0.00 0.00 0.00 36.38 34.06 2wug s VAL 263 CO 0.02 0.55 0.05 -0.36 0.00 0.00 0.00 175.10 175.36 2wug s PHE 264 N -0.02 3.08 0.58 5.22 0.08 -0.10 -4.92 117.98 121.89 2wug s PHE 264 Ca -0.05 -0.43 -0.18 0.00 0.12 0.00 0.00 56.93 56.39 2wug s PHE 264 Cb -0.14 -2.19 -0.04 0.00 -0.57 0.00 0.00 43.02 40.08 2wug s PHE 264 CO 0.04 -0.32 1.13 0.20 -0.10 0.00 0.00 175.22 176.17 2wug s GLY 265 N 1.42 2.48 -0.96 4.36 0.00 -1.26 -0.59 107.32 112.77 2wug s GLY 265 Ca 0.05 0.74 -0.00 0.00 0.00 0.00 0.00 44.72 45.51 2wug s GLY 265 CO 0.03 1.10 0.80 -1.06 0.00 0.00 0.00 173.10 173.97 2wug n GLN 266 N -1.67 -5.32 -3.67 2.90 6.02 -1.26 -4.88 117.38 109.49 2wug n GLN 266 Ca 0.11 0.67 -0.10 0.00 -0.01 0.00 0.00 57.00 57.67 2wug n GLN 266 Cb 0.51 -5.17 -0.09 0.00 1.02 0.00 0.00 30.24 26.51 2wug n GLN 266 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2wug n GLY 268 N 3.75 1.59 0.33 0.00 0.00 -1.26 -0.63 105.19 108.97 2wug n GLY 268 Ca -0.19 -1.84 -0.02 0.00 0.00 0.00 0.00 46.02 43.97 2wug n GLY 268 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 2wug h HIS 269 N 0.00 0.94 -0.35 1.61 2.76 -1.35 -3.32 115.15 115.44 2wug h HIS 269 Ca 0.00 -0.04 -0.71 0.00 -2.20 0.00 0.00 60.37 57.42 2wug h HIS 269 Cb 0.00 -0.30 -0.05 0.00 1.55 0.00 0.00 27.41 28.62 2wug h HIS 269 CO 0.00 0.70 3.08 0.91 -1.30 0.00 0.00 177.93 181.32 2wug n TRP 270 N -4.33 3.02 -0.26 5.26 8.01 -0.70 -4.73 117.44 123.72 2wug n TRP 270 Ca 0.06 -2.96 0.08 0.00 -1.31 0.00 0.00 57.50 53.37 2wug n TRP 270 Cb 0.14 -2.36 0.33 0.00 -2.01 0.00 0.00 31.31 27.40 2wug n TRP 270 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.69 176.96 2wug h VAL 271 N 3.53 0.96 0.00 -0.99 2.07 -1.90 -0.39 116.25 119.53 2wug h VAL 271 Ca 0.64 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.88 2wug h VAL 271 Cb 0.50 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 2wug h VAL 271 CO 1.78 0.15 0.00 0.06 0.02 0.00 0.00 177.57 179.58 2wug h GLN 272 N 0.82 0.00 0.00 1.57 -0.00 -1.87 -0.58 115.11 115.05 2wug h GLN 272 Ca 0.39 0.00 -0.30 0.00 -0.00 0.00 0.00 58.65 58.74 2wug h GLN 272 Cb 0.43 0.00 -0.05 0.00 -0.00 0.00 0.00 27.48 27.87 2wug h GLN 272 CO -0.16 0.00 -1.91 0.28 -0.00 0.00 0.00 178.83 177.03 2wug n VAL 273 N -2.47 1.52 0.17 1.86 0.31 -0.40 -3.88 118.33 115.45 2wug n VAL 273 Ca 0.01 -0.19 0.04 0.00 -0.01 0.00 0.00 64.34 64.20 2wug n VAL 273 Cb 0.23 -2.04 0.28 0.00 -0.91 0.00 0.00 33.84 31.39 2wug n VAL 273 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2wug h GLU 274 N -1.00 0.00 -0.94 5.55 5.08 -1.10 -3.08 114.58 119.09 2wug h GLU 274 Ca -0.46 0.00 -0.48 0.00 -1.00 0.00 0.00 59.36 57.42 2wug h GLU 274 Cb 1.37 0.00 -0.42 0.00 0.50 0.00 0.00 28.75 30.20 2wug h GLU 274 CO -0.28 0.43 -0.89 1.63 -1.00 0.00 0.00 179.01 178.90 2wug n LYS 275 N -3.52 2.93 -0.36 2.33 4.76 -0.23 -4.95 118.16 119.13 2wug n LYS 275 Ca -0.00 -4.04 -0.10 0.00 -2.87 0.00 0.00 58.31 51.30 2wug n LYS 275 Cb 0.55 -2.03 -0.09 0.00 -1.84 0.00 0.00 35.03 31.62 2wug n LYS 275 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 2wug h PHE 276 N 2.47 -1.71 -0.21 2.13 3.04 -1.59 0.94 116.94 122.01 2wug h PHE 276 Ca 0.20 0.11 -0.01 0.00 3.98 0.00 0.00 57.97 62.26 2wug h PHE 276 Cb 1.28 0.86 -0.01 0.00 2.56 0.00 0.00 35.95 40.63 2wug h PHE 276 CO 0.74 -0.35 0.11 -0.44 -2.02 0.00 0.00 178.31 176.35 2wug h ASP 277 N -0.03 0.27 -0.58 0.41 3.32 -1.90 -0.40 116.42 117.51 2wug h ASP 277 Ca 0.14 -0.11 -0.08 0.00 0.02 0.00 0.00 57.03 56.99 2wug h ASP 277 Cb 0.39 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.84 2wug h ASP 277 CO -0.83 0.31 0.05 -0.33 -1.72 0.00 0.00 179.24 176.72 2wug h GLU 278 N 0.22 1.02 -0.32 3.56 3.07 -1.85 -1.42 114.58 118.86 2wug h GLU 278 Ca 0.07 -0.29 -0.04 0.00 -0.50 0.00 0.00 59.36 58.61 2wug h GLU 278 Cb 0.11 -0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 27.89 2wug h GLU 278 CO -0.01 0.97 0.06 0.35 -1.40 0.00 0.00 179.01 178.98 2wug h PHE 279 N 0.95 0.56 -0.67 4.33 3.57 -0.64 -1.37 116.94 123.67 2wug h PHE 279 Ca 0.18 -0.08 -0.01 0.00 3.53 0.00 0.00 57.97 61.60 2wug h PHE 279 Cb 0.48 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 39.04 2wug h PHE 279 CO 0.03 0.60 0.39 -0.91 -2.23 0.00 0.00 178.31 176.19 2wug h ASN 280 N 0.36 0.83 -0.42 0.41 2.35 -0.80 -1.53 115.58 116.78 2wug h ASN 280 Ca 0.10 -0.08 -0.09 0.00 -0.55 0.00 0.00 56.30 55.68 2wug h ASN 280 Cb 0.34 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.48 2wug h ASN 280 CO 0.01 0.67 -0.08 0.11 -1.65 0.00 0.00 177.43 176.48 2wug h LYS 281 N 0.92 0.79 -0.29 0.81 1.57 -1.14 -0.34 116.57 118.90 2wug h LYS 281 Ca 0.24 -0.29 0.01 0.00 -1.87 0.00 0.00 60.65 58.74 2wug h LYS 281 Cb 0.01 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 2wug h LYS 281 CO -0.04 0.91 0.17 -0.07 -0.57 0.00 0.00 179.45 179.85 2wug h LEU 282 N 0.62 0.29 -0.32 2.94 3.38 -1.12 -1.53 115.31 119.56 2wug h LEU 282 Ca 0.11 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 2wug h LEU 282 Cb 0.60 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 2wug h LEU 282 CO 0.04 0.21 0.17 0.74 0.09 0.00 0.00 178.44 179.68 2wug h THR 283 N 0.36 1.14 -0.50 0.22 2.02 -1.13 0.14 112.91 115.16 2wug h THR 283 Ca 0.11 -0.39 -0.01 0.00 0.77 0.00 0.00 66.41 66.89 2wug h THR 283 Cb -0.01 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 2wug h THR 283 CO -0.04 0.15 0.29 0.40 0.37 0.00 0.00 175.52 176.68 2wug h ILE 284 N 0.39 1.16 -0.41 3.11 2.04 -0.93 -1.34 117.51 121.54 2wug h ILE 284 Ca 0.11 -0.40 -0.05 0.00 1.00 0.00 0.00 64.86 65.52 2wug h ILE 284 Cb 0.09 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 2wug h ILE 284 CO -0.02 0.17 0.06 -0.08 0.00 0.00 0.00 178.15 178.28 2wug h GLU 285 N 0.67 0.68 -0.52 2.37 4.57 -1.11 -1.57 114.58 119.66 2wug h GLU 285 Ca 0.18 -0.19 -0.10 0.00 -1.18 0.00 0.00 59.36 58.07 2wug h GLU 285 Cb 0.02 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.52 2wug h GLU 285 CO -0.03 0.73 -0.06 0.35 -1.18 0.00 0.00 179.01 178.82 2wug h PHE 286 N 0.53 1.02 -0.00 0.92 3.57 -0.74 -2.20 116.94 120.03 2wug h PHE 286 Ca 0.12 -0.18 0.00 0.00 3.53 0.00 0.00 57.97 61.44 2wug h PHE 286 Cb 0.39 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 38.86 2wug h PHE 286 CO 0.03 0.94 -0.01 1.28 -2.23 0.00 0.00 178.31 178.33 2wug n LEU 287 N -4.17 0.12 -0.86 0.59 4.77 -0.53 -4.92 117.00 112.01 2wug n LEU 287 Ca 0.02 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 2wug n LEU 287 Cb 0.36 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 2wug n LEU 287 CO 0.44 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 2wug n GLY 288 N 1.07 0.51 0.00 -0.72 0.00 -0.83 -5.07 105.19 100.15 2wug n GLY 288 Ca 0.22 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.77 2wug n GLY 288 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93