#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w54 n VAL 3 N 0.00 2.05 0.00 2.46 0.31 -1.23 -2.95 118.33 118.97 2w54 n VAL 3 Ca 0.00 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.83 2w54 n VAL 3 Cb 0.00 -1.59 0.00 0.00 -0.91 0.00 0.00 33.84 31.34 2w54 n VAL 3 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2w54 n GLY 4 N 0.75 2.10 3.80 2.92 0.00 0.99 -5.01 105.19 110.75 2w54 n GLY 4 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 2w54 n GLY 4 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w54 s LYS 5 N -0.62 4.00 -1.38 1.61 1.02 -1.15 -4.40 119.74 118.82 2w54 s LYS 5 Ca 0.00 1.33 -0.10 0.00 0.02 0.00 0.00 55.97 57.22 2w54 s LYS 5 Cb 0.00 -2.23 0.09 0.00 -0.52 0.00 0.00 37.83 35.17 2w54 s LYS 5 CO 0.00 -0.25 2.24 -0.35 -0.92 0.00 0.00 175.35 176.06 2w54 n PRO 6 N -0.66 3.67 -2.92 -1.68 -0.04 -1.26 -4.15 135.00 127.96 2w54 n PRO 6 Ca 0.08 -3.10 -0.33 0.00 -0.04 0.00 0.00 63.50 60.11 2w54 n PRO 6 Cb 0.52 -2.93 -0.07 0.00 -0.04 0.00 0.00 33.50 30.99 2w54 n PRO 6 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2w54 s LEU 7 N 0.01 3.98 0.77 1.53 1.43 -1.26 -4.76 118.68 120.38 2w54 s LEU 7 Ca 0.49 1.54 -0.10 0.00 -1.03 0.00 0.00 54.13 55.02 2w54 s LEU 7 Cb 0.14 -4.37 0.06 0.00 0.03 0.00 0.00 46.19 42.04 2w54 s LEU 7 CO -0.05 -0.31 1.09 -2.16 0.23 0.00 0.00 176.35 175.15 2w54 s PRO 8 N -3.13 2.24 0.44 1.29 0.04 -1.26 -4.59 135.00 130.03 2w54 s PRO 8 Ca 0.59 1.17 -0.23 0.00 0.04 0.00 0.00 61.00 62.57 2w54 s PRO 8 Cb -0.09 -1.89 -0.10 0.00 0.04 0.00 0.00 34.50 32.45 2w54 s PRO 8 CO 0.15 -1.66 1.00 1.58 0.04 0.00 0.00 177.00 178.11 2w54 n HIS 9 N -3.53 1.11 -0.08 0.56 -0.00 -1.26 -4.88 115.22 107.13 2w54 n HIS 9 Ca 0.09 0.54 0.16 0.00 -0.00 0.00 0.00 57.72 58.51 2w54 n HIS 9 Cb 0.53 -2.21 0.58 0.00 -0.00 0.00 0.00 29.99 28.88 2w54 n HIS 9 CO 0.00 0.00 0.00 0.38 -0.00 0.00 0.00 176.34 176.72 2w54 h ASP 10 N 1.40 0.23 -0.17 0.26 2.03 -1.92 -1.95 116.42 116.30 2w54 h ASP 10 Ca -0.45 0.01 -0.01 0.00 -0.73 0.00 0.00 57.03 55.85 2w54 h ASP 10 Cb 1.34 -0.04 -0.00 0.00 -0.83 0.00 0.00 39.33 39.80 2w54 h ASP 10 CO 0.56 0.13 -0.01 -1.20 -1.03 0.00 0.00 179.24 177.69 2w54 n SER 11 N -4.44 3.25 -0.33 4.15 7.64 -1.26 -4.78 113.62 117.85 2w54 n SER 11 Ca 0.11 -3.09 0.14 0.00 1.01 0.00 0.00 58.87 57.05 2w54 n SER 11 Cb 0.52 -0.51 0.36 0.00 -1.01 0.00 0.00 64.21 63.58 2w54 n SER 11 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2w54 h ALA 12 N 1.12 1.79 0.13 -0.43 0.00 -1.71 0.24 119.26 120.40 2w54 h ALA 12 Ca 0.01 0.06 -0.29 0.00 0.00 0.00 0.00 54.91 54.70 2w54 h ALA 12 Cb 1.29 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 19.02 2w54 h ALA 12 CO 0.15 -0.14 -1.24 -0.09 0.00 0.00 0.00 179.25 177.93 2w54 h ARG 13 N 0.70 0.44 -0.18 0.00 2.43 -1.86 -2.57 114.38 113.34 2w54 h ARG 13 Ca 0.55 -0.65 -0.06 0.00 -0.81 0.00 0.00 59.98 59.02 2w54 h ARG 13 Cb 0.95 0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 30.72 2w54 h ARG 13 CO -0.33 1.29 -0.14 0.00 -1.51 0.00 0.00 179.97 179.27 2w54 h ALA 14 N 0.45 1.44 0.05 2.80 0.00 -1.58 -2.57 119.26 119.86 2w54 h ALA 14 Ca -0.16 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 2w54 h ALA 14 Cb 1.93 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.62 2w54 h ALA 14 CO 0.22 0.39 -0.03 0.45 0.00 0.00 0.00 179.25 180.29 2w54 h HIS 15 N 0.27 -0.07 0.00 0.00 3.86 -0.60 0.21 115.15 118.82 2w54 h HIS 15 Ca 0.05 -0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.26 2w54 h HIS 15 Cb 0.42 0.02 -0.00 0.00 1.06 0.00 0.00 27.41 28.91 2w54 h HIS 15 CO 0.01 0.23 -0.01 -0.24 0.86 0.00 0.00 177.93 178.78 2w54 h VAL 16 N -0.36 0.05 -0.16 2.45 3.04 -1.17 -2.49 116.25 117.61 2w54 h VAL 16 Ca -0.01 -0.25 0.00 0.00 -1.01 0.00 0.00 66.70 65.44 2w54 h VAL 16 Cb 0.32 1.23 0.00 0.00 -2.01 0.00 0.00 31.29 30.83 2w54 h VAL 16 CO 0.01 0.01 0.00 0.35 -1.01 0.00 0.00 177.57 176.93 2w54 n THR 17 N -3.14 1.37 -1.07 3.17 -2.24 -0.99 -4.98 114.28 106.40 2w54 n THR 17 Ca -0.01 -1.36 -0.02 0.00 -2.27 0.00 0.00 64.05 60.38 2w54 n THR 17 Cb 0.18 0.25 -0.01 0.00 -2.10 0.00 0.00 70.33 68.64 2w54 n THR 17 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2w54 n GLY 18 N -0.32 0.28 0.19 3.38 0.00 -0.94 -4.85 105.19 102.93 2w54 n GLY 18 Ca 0.10 -0.02 0.08 0.00 0.00 0.00 0.00 46.02 46.19 2w54 n GLY 18 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2w54 h GLN 19 N 0.11 0.00 -6.51 1.61 4.20 -1.49 -3.44 115.11 109.59 2w54 h GLN 19 Ca -0.05 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.13 2w54 h GLN 19 Cb 0.92 0.00 0.03 0.00 0.30 0.00 0.00 27.48 28.73 2w54 h GLN 19 CO 0.07 0.18 0.98 0.00 -0.67 0.00 0.00 178.83 179.39 2w54 s ALA 20 N -3.12 3.73 0.09 3.87 0.00 -0.06 -4.99 121.76 121.27 2w54 s ALA 20 Ca 0.05 1.30 -0.13 0.00 0.00 0.00 0.00 51.96 53.18 2w54 s ALA 20 Cb 0.06 -3.68 -0.06 0.00 0.00 0.00 0.00 23.12 19.44 2w54 s ALA 20 CO 0.70 -1.02 0.47 1.03 0.00 0.00 0.00 175.76 176.94 2w54 s ARG 21 N 2.17 3.91 0.36 0.00 0.52 -1.26 -4.97 118.95 119.69 2w54 s ARG 21 Ca 0.74 0.39 0.01 0.00 -0.52 0.00 0.00 55.73 56.35 2w54 s ARG 21 Cb -0.42 -3.04 0.01 0.00 0.52 0.00 0.00 34.95 32.03 2w54 s ARG 21 CO 0.32 0.56 0.12 0.66 0.02 0.00 0.00 175.30 176.99 2w54 n TYR 22 N 1.12 0.10 -0.03 -0.53 4.02 -1.26 -4.81 117.16 115.77 2w54 n TYR 22 Ca -0.08 -1.68 -0.08 0.00 -0.01 0.00 0.00 57.90 56.04 2w54 n TYR 22 Cb 0.52 -0.26 -0.03 0.00 -0.02 0.00 0.00 39.34 39.55 2w54 n TYR 22 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 2w54 h LEU 23 N 0.00 -0.23 -1.87 7.72 6.46 -1.95 -1.84 115.31 123.61 2w54 h LEU 23 Ca -0.27 0.06 -0.02 0.00 -0.12 0.00 0.00 57.88 57.53 2w54 h LEU 23 Cb 0.88 0.14 -0.00 0.00 -0.73 0.00 0.00 40.66 40.95 2w54 h LEU 23 CO 0.44 -0.09 -0.10 -0.78 -0.62 0.00 0.00 178.44 177.29 2w54 h ASP 24 N -0.03 0.00 0.66 1.25 -0.00 -1.98 -2.22 116.42 114.11 2w54 h ASP 24 Ca 0.10 0.00 -0.12 0.00 -0.00 0.00 0.00 57.03 57.01 2w54 h ASP 24 Cb 0.17 0.00 -0.02 0.00 -0.00 0.00 0.00 39.33 39.49 2w54 h ASP 24 CO -0.21 0.10 -0.56 0.44 -0.00 0.00 0.00 179.24 179.00 2w54 h ASP 25 N 0.00 0.00 -2.46 2.28 3.32 -1.72 -3.45 116.42 114.39 2w54 h ASP 25 Ca -0.00 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.49 2w54 h ASP 25 Cb 0.38 0.00 0.06 0.00 0.22 0.00 0.00 39.33 39.99 2w54 h ASP 25 CO 0.01 0.56 0.86 0.18 -1.72 0.00 0.00 179.24 179.14 2w54 n LEU 26 N -3.75 3.45 -4.78 1.55 4.77 -0.84 -4.93 117.00 112.47 2w54 n LEU 26 Ca -0.01 1.08 -0.37 0.00 -0.03 0.00 0.00 56.01 56.68 2w54 n LEU 26 Cb 0.59 -1.48 -0.03 0.00 -2.33 0.00 0.00 43.42 40.16 2w54 n LEU 26 CO 0.41 -0.12 0.76 -2.16 -1.33 0.00 0.00 177.39 174.95 2w54 s PRO 27 N 0.88 4.09 0.15 3.23 0.04 -1.26 -5.06 135.00 137.07 2w54 s PRO 27 Ca 0.76 1.59 -0.14 0.00 0.04 0.00 0.00 61.00 63.26 2w54 s PRO 27 Cb -0.61 -2.54 0.02 0.00 0.04 0.00 0.00 34.50 31.41 2w54 s PRO 27 CO 0.37 -0.23 0.38 0.00 0.04 0.00 0.00 177.00 177.56 2w54 n PRO 29 N -0.24 0.20 -0.22 0.00 -0.02 -1.26 -4.86 135.00 128.60 2w54 n PRO 29 Ca -0.12 0.13 0.14 0.00 -2.02 0.00 0.00 63.50 61.63 2w54 n PRO 29 Cb 0.63 -2.18 0.44 0.00 -0.02 0.00 0.00 33.50 32.36 2w54 n PRO 29 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2w54 h ALA 30 N -0.77 1.97 0.00 3.55 0.00 -2.02 -1.92 119.26 120.07 2w54 h ALA 30 Ca -0.46 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2w54 h ALA 30 Cb 1.31 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2w54 h ALA 30 CO 0.44 -0.19 0.00 0.27 0.00 0.00 0.00 179.25 179.77 2w54 n ASN 31 N -4.52 0.00 -4.59 0.00 6.94 -1.26 -4.91 115.26 106.92 2w54 n ASN 31 Ca 0.16 0.32 -0.59 0.00 -0.02 0.00 0.00 54.58 54.45 2w54 n ASN 31 Cb 0.50 -0.43 -0.08 0.00 -2.36 0.00 0.00 39.78 37.41 2w54 n ASN 31 CO 0.00 0.00 0.00 0.41 -1.03 0.00 0.00 177.26 176.64 2w54 n THR 32 N -1.43 0.03 -3.63 5.53 -1.04 -0.72 -4.71 114.28 108.31 2w54 n THR 32 Ca 0.08 -0.01 -0.24 0.00 -2.04 0.00 0.00 64.05 61.84 2w54 n THR 32 Cb 0.26 -0.43 -0.02 0.00 -1.82 0.00 0.00 70.33 68.32 2w54 n THR 32 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2w54 s LEU 33 N 1.02 4.15 -0.05 -4.42 1.43 0.84 -4.86 118.68 116.80 2w54 s LEU 33 Ca 0.93 0.33 0.04 0.00 -1.03 0.00 0.00 54.13 54.39 2w54 s LEU 33 Cb -1.21 -3.15 -0.00 0.00 0.03 0.00 0.00 46.19 41.86 2w54 s LEU 33 CO 0.60 -0.17 -0.17 -1.00 0.23 0.00 0.00 176.35 175.84 2w54 s HIS 34 N -2.11 1.70 0.12 0.29 3.76 0.11 -0.63 115.29 118.53 2w54 s HIS 34 Ca 0.38 -0.52 0.07 0.00 -0.15 0.00 0.00 55.06 54.84 2w54 s HIS 34 Cb -0.10 -1.16 -0.04 0.00 1.11 0.00 0.00 32.58 32.39 2w54 s HIS 34 CO 0.32 -0.19 -0.09 -0.51 -0.85 0.00 0.00 174.74 173.42 2w54 s LEU 35 N 0.14 3.05 -0.06 0.89 1.43 -0.60 -0.07 118.68 123.47 2w54 s LEU 35 Ca -0.06 -0.42 -0.09 0.00 -1.03 0.00 0.00 54.13 52.53 2w54 s LEU 35 Cb -0.12 -1.82 0.02 0.00 0.03 0.00 0.00 46.19 44.30 2w54 s LEU 35 CO 0.03 0.16 0.23 0.00 0.23 0.00 0.00 176.35 177.00 2w54 s ALA 36 N -1.33 -0.57 0.37 4.21 0.00 -0.71 -4.48 121.76 119.25 2w54 s ALA 36 Ca 0.22 0.45 -0.20 0.00 0.00 0.00 0.00 51.96 52.44 2w54 s ALA 36 Cb -0.11 -0.21 -0.10 0.00 0.00 0.00 0.00 23.12 22.70 2w54 s ALA 36 CO 0.14 -0.16 0.87 -0.06 0.00 0.00 0.00 175.76 176.56 2w54 s PHE 37 N -0.44 3.38 -0.30 0.00 2.99 -1.26 -0.56 117.98 121.79 2w54 s PHE 37 Ca -0.05 1.49 -0.12 0.00 0.00 0.00 0.00 56.93 58.24 2w54 s PHE 37 Cb -0.04 -2.75 -0.04 0.00 0.00 0.00 0.00 43.02 40.20 2w54 s PHE 37 CO 0.01 0.01 0.25 0.20 -0.00 0.00 0.00 175.22 175.69 2w54 s GLY 38 N -2.13 1.93 0.34 4.36 0.00 -0.43 -4.86 107.32 106.54 2w54 s GLY 38 Ca 0.57 -1.11 -0.01 0.00 0.00 0.00 0.00 44.72 44.17 2w54 s GLY 38 CO 0.16 0.77 0.56 1.08 0.00 0.00 0.00 173.10 175.66 2w54 s LEU 39 N 1.83 4.00 0.24 0.66 1.43 -1.26 -0.61 118.68 124.98 2w54 s LEU 39 Ca 0.09 0.52 -0.30 0.00 -1.03 0.00 0.00 54.13 53.41 2w54 s LEU 39 Cb -0.16 -3.38 -0.09 0.00 0.03 0.00 0.00 46.19 42.59 2w54 s LEU 39 CO 0.11 -0.29 1.11 -0.55 0.23 0.00 0.00 176.35 176.95 2w54 s SER 40 N -3.89 7.25 0.00 2.29 0.15 0.75 -4.83 113.70 115.42 2w54 s SER 40 Ca 0.41 2.22 0.22 0.00 0.70 0.00 0.00 55.95 59.50 2w54 s SER 40 Cb -0.10 -2.62 -0.13 0.00 -1.71 0.00 0.00 66.02 61.46 2w54 s SER 40 CO 0.36 -0.18 0.90 0.35 1.20 0.00 0.00 173.24 175.86 2w54 n THR 41 N 1.62 0.03 -3.92 6.45 -2.24 -1.26 -1.21 114.28 113.75 2w54 n THR 41 Ca 0.00 -0.12 -0.34 0.00 -2.27 0.00 0.00 64.05 61.32 2w54 n THR 41 Cb 0.45 0.63 -0.05 0.00 -2.10 0.00 0.00 70.33 69.26 2w54 n THR 41 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2w54 s GLU 42 N -3.12 3.40 0.07 -0.78 0.41 -1.26 -4.83 118.70 112.59 2w54 s GLU 42 Ca 0.05 -0.29 -0.15 0.00 -0.41 0.00 0.00 54.97 54.17 2w54 s GLU 42 Cb 0.16 -3.10 -0.24 0.00 -1.78 0.00 0.00 34.13 29.17 2w54 s GLU 42 CO 0.85 0.70 1.17 0.00 -0.49 0.00 0.00 175.26 177.49 2w54 h ALA 43 N 4.15 0.11 -1.40 5.21 0.00 -1.83 -3.08 119.26 122.43 2w54 h ALA 43 Ca -0.50 -0.69 -0.05 0.00 0.00 0.00 0.00 54.91 53.67 2w54 h ALA 43 Cb 1.20 0.06 -0.25 0.00 0.00 0.00 0.00 17.79 18.80 2w54 h ALA 43 CO 0.65 0.65 -0.41 0.45 0.00 0.00 0.00 179.25 180.60 2w54 s SER 44 N -7.25 -0.60 0.17 0.00 0.15 -1.26 -2.00 113.70 102.91 2w54 s SER 44 Ca -0.10 0.28 -0.21 0.00 0.70 0.00 0.00 55.95 56.62 2w54 s SER 44 Cb 0.06 1.62 0.06 0.00 -1.71 0.00 0.00 66.02 66.05 2w54 s SER 44 CO 0.91 -0.30 0.56 0.00 1.20 0.00 0.00 173.24 175.62 2w54 s ALA 45 N 2.70 -1.38 0.02 5.45 0.00 -0.94 -0.15 121.76 127.46 2w54 s ALA 45 Ca 0.14 0.26 -0.07 0.00 0.00 0.00 0.00 51.96 52.29 2w54 s ALA 45 Cb -0.14 0.85 -0.05 0.00 0.00 0.00 0.00 23.12 23.78 2w54 s ALA 45 CO -0.23 -0.77 0.30 0.00 0.00 0.00 0.00 175.76 175.06 2w54 s ALA 46 N -3.78 3.83 -0.54 0.00 0.00 -0.77 -0.12 121.76 120.38 2w54 s ALA 46 Ca 0.03 -0.54 -0.23 0.00 0.00 0.00 0.00 51.96 51.22 2w54 s ALA 46 Cb -0.01 -2.10 0.04 0.00 0.00 0.00 0.00 23.12 21.05 2w54 s ALA 46 CO -0.10 0.63 0.86 0.42 0.00 0.00 0.00 175.76 177.57 2w54 s ILE 47 N -1.33 4.51 0.11 0.00 1.01 0.69 0.20 121.20 126.39 2w54 s ILE 47 Ca 0.29 0.11 0.07 0.00 0.00 0.00 0.00 60.65 61.11 2w54 s ILE 47 Cb -0.13 -4.47 -0.22 0.00 0.01 0.00 0.00 42.46 37.65 2w54 s ILE 47 CO 0.17 -1.02 1.23 0.74 0.00 0.00 0.00 174.94 176.06 2w54 h THR 48 N 5.98 1.65 -1.94 2.92 2.02 -1.50 -3.47 112.91 118.57 2w54 h THR 48 Ca -0.26 -3.36 -0.04 0.00 0.77 0.00 0.00 66.41 63.52 2w54 h THR 48 Cb 1.08 2.83 -0.20 0.00 -1.74 0.00 0.00 68.15 70.12 2w54 h THR 48 CO 1.05 0.94 0.24 -0.83 0.37 0.00 0.00 175.52 177.29 2w54 s GLY 49 N -4.73 -0.53 -0.30 2.16 0.00 -1.15 -4.99 107.32 97.77 2w54 s GLY 49 Ca 0.00 1.46 -0.02 0.00 0.00 0.00 0.00 44.72 46.16 2w54 s GLY 49 CO 0.82 1.02 0.19 -2.27 0.00 0.00 0.00 173.10 172.86 2w54 s LEU 50 N -1.09 0.36 -0.39 0.66 2.96 -1.26 -1.07 118.68 118.86 2w54 s LEU 50 Ca -0.09 -1.26 -0.20 0.00 -0.22 0.00 0.00 54.13 52.36 2w54 s LEU 50 Cb -0.00 -0.10 0.01 0.00 0.50 0.00 0.00 46.19 46.59 2w54 s LEU 50 CO 0.08 -0.41 0.60 -0.62 -1.32 0.00 0.00 176.35 174.68 2w54 s ASP 51 N 2.03 6.35 -0.05 3.68 2.15 -0.07 -4.89 116.67 125.86 2w54 s ASP 51 Ca 0.10 -0.12 0.12 0.00 0.43 0.00 0.00 52.55 53.09 2w54 s ASP 51 Cb -0.16 -2.30 0.36 0.00 -0.30 0.00 0.00 42.92 40.51 2w54 s ASP 51 CO -0.31 -0.63 1.29 0.18 -0.17 0.00 0.00 175.17 175.54 2w54 n LEU 52 N 6.02 3.16 0.02 -1.34 4.77 -1.26 -1.85 117.00 126.52 2w54 n LEU 52 Ca -0.03 -2.28 -0.12 0.00 -0.03 0.00 0.00 56.01 53.55 2w54 n LEU 52 Cb 0.48 -0.31 -0.08 0.00 -2.33 0.00 0.00 43.42 41.18 2w54 n LEU 52 CO 0.49 0.71 0.79 -0.08 -1.33 0.00 0.00 177.39 177.97 2w54 h GLU 53 N 1.89 -0.00 0.00 3.23 4.57 -1.92 -1.84 114.58 120.51 2w54 h GLU 53 Ca 0.00 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.15 2w54 h GLU 53 Cb 0.92 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.51 2w54 h GLU 53 CO 0.06 0.16 -0.14 -1.35 -1.18 0.00 0.00 179.01 176.56 2w54 h PRO 54 N -0.17 0.00 -0.30 0.92 0.11 -1.83 -1.75 132.00 128.99 2w54 h PRO 54 Ca -0.00 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.00 2w54 h PRO 54 Cb 0.17 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.27 2w54 h PRO 54 CO 0.00 0.14 -0.25 0.28 -0.21 0.00 0.00 178.00 177.96 2w54 h VAL 55 N 0.00 1.30 -0.28 3.15 2.07 -1.65 -2.51 116.25 118.33 2w54 h VAL 55 Ca -0.00 -1.40 -0.12 0.00 0.82 0.00 0.00 66.70 66.00 2w54 h VAL 55 Cb 0.40 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 2w54 h VAL 55 CO 0.02 0.45 -0.32 0.03 0.02 0.00 0.00 177.57 177.76 2w54 h ARG 56 N 0.45 0.61 0.00 1.57 3.08 -0.83 -3.10 114.38 116.15 2w54 h ARG 56 Ca 0.05 -0.27 0.00 0.00 0.07 0.00 0.00 59.98 59.83 2w54 h ARG 56 Cb 0.81 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.84 2w54 h ARG 56 CO 0.06 0.85 0.00 0.93 -1.07 0.00 0.00 179.97 180.75 2w54 h GLU 57 N 0.51 0.00 -6.92 0.04 5.08 -1.35 -3.44 114.58 108.51 2w54 h GLU 57 Ca 0.06 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.85 2w54 h GLU 57 Cb 0.81 0.00 0.15 0.00 0.50 0.00 0.00 28.75 30.21 2w54 h GLU 57 CO 0.07 0.00 0.36 0.45 -1.00 0.00 0.00 179.01 178.88 2w54 n SER 58 N -2.99 1.73 -4.69 1.42 2.88 -0.95 -4.89 113.62 106.13 2w54 n SER 58 Ca 0.03 0.91 -0.44 0.00 -1.33 0.00 0.00 58.87 58.04 2w54 n SER 58 Cb 0.46 -1.48 -0.03 0.00 -0.75 0.00 0.00 64.21 62.42 2w54 n SER 58 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 2w54 n PRO 59 N -0.94 2.22 -0.99 -1.46 -0.02 -1.26 -3.17 135.00 129.37 2w54 n PRO 59 Ca 0.12 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 2w54 n PRO 59 Cb 0.45 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 2w54 n PRO 59 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2w54 n GLY 60 N 2.43 0.46 3.71 -1.23 0.00 -1.26 -4.83 105.19 104.46 2w54 n GLY 60 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 2w54 n GLY 60 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2w54 s VAL 61 N -2.02 4.92 -0.21 1.61 1.01 -1.19 -0.07 120.40 124.45 2w54 s VAL 61 Ca 0.00 1.83 0.02 0.00 0.00 0.00 0.00 61.98 63.83 2w54 s VAL 61 Cb 0.00 -4.22 -0.14 0.00 0.00 0.00 0.00 36.38 32.03 2w54 s VAL 61 CO 0.00 0.16 -0.18 -0.38 0.00 0.00 0.00 175.10 174.70 2w54 n ILE 62 N 4.00 1.19 -3.75 2.22 2.08 0.90 -4.98 119.36 121.03 2w54 n ILE 62 Ca 0.04 -0.46 -0.13 0.00 0.56 0.00 0.00 62.75 62.76 2w54 n ILE 62 Cb 0.51 -1.24 -0.08 0.00 -0.75 0.00 0.00 39.64 38.08 2w54 n ILE 62 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2w54 s ALA 63 N -2.42 -0.77 -0.04 -1.39 0.00 -1.04 -5.03 121.76 111.07 2w54 s ALA 63 Ca -0.28 0.25 0.02 0.00 0.00 0.00 0.00 51.96 51.95 2w54 s ALA 63 Cb 0.07 0.15 0.01 0.00 0.00 0.00 0.00 23.12 23.35 2w54 s ALA 63 CO 0.48 -0.31 -0.11 0.08 0.00 0.00 0.00 175.76 175.91 2w54 s VAL 64 N -1.67 0.96 -0.09 0.00 1.01 -1.26 -1.06 120.40 118.29 2w54 s VAL 64 Ca -0.11 -0.42 0.04 0.00 0.00 0.00 0.00 61.98 61.49 2w54 s VAL 64 Cb -0.04 -0.87 0.00 0.00 0.00 0.00 0.00 36.38 35.47 2w54 s VAL 64 CO 0.02 0.30 -0.21 -0.36 0.00 0.00 0.00 175.10 174.85 2w54 s PHE 65 N 0.43 2.27 0.36 5.22 0.40 0.25 -4.95 117.98 121.97 2w54 s PHE 65 Ca -0.08 -0.89 0.07 0.00 -0.60 0.00 0.00 56.93 55.44 2w54 s PHE 65 Cb -0.12 -1.54 -0.02 0.00 0.51 0.00 0.00 43.02 41.85 2w54 s PHE 65 CO 0.02 -0.36 0.33 0.99 0.70 0.00 0.00 175.22 176.90 2w54 s THR 66 N 0.35 3.29 0.56 0.64 2.01 -1.26 -0.71 115.64 120.52 2w54 s THR 66 Ca -0.16 -1.33 0.28 0.00 0.31 0.00 0.00 61.69 60.78 2w54 s THR 66 Cb -0.17 -3.14 0.40 0.00 0.01 0.00 0.00 72.50 69.60 2w54 s THR 66 CO 0.07 -0.12 1.97 0.00 -0.69 0.00 0.00 174.62 175.85 2w54 h ALA 67 N 1.15 2.31 -0.07 7.40 0.00 -1.77 0.20 119.26 128.48 2w54 h ALA 67 Ca -0.44 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.39 2w54 h ALA 67 Cb 1.26 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 2w54 h ALA 67 CO 0.57 -0.66 -0.27 0.00 0.00 0.00 0.00 179.25 178.89 2w54 h ALA 68 N 1.63 1.42 -0.00 0.00 0.00 -1.94 -3.15 119.26 117.21 2w54 h ALA 68 Ca 0.23 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2w54 h ALA 68 Cb 1.05 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2w54 h ALA 68 CO -0.00 0.42 -0.12 -0.25 0.00 0.00 0.00 179.25 179.29 2w54 n ASP 69 N -4.17 0.33 -4.74 0.00 8.00 0.69 -4.87 116.55 111.79 2w54 n ASP 69 Ca -0.01 -0.29 -0.41 0.00 0.71 0.00 0.00 54.79 54.78 2w54 n ASP 69 Cb 0.35 -0.14 -0.03 0.00 -0.02 0.00 0.00 41.12 41.28 2w54 n ASP 69 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2w54 s LEU 70 N -2.64 4.43 0.14 0.64 1.43 -1.19 -4.94 118.68 116.55 2w54 s LEU 70 Ca 0.24 2.31 -0.13 0.00 -1.03 0.00 0.00 54.13 55.53 2w54 s LEU 70 Cb 0.20 -3.61 0.01 0.00 0.03 0.00 0.00 46.19 42.82 2w54 s LEU 70 CO 0.51 -0.46 1.59 -0.65 0.23 0.00 0.00 176.35 177.57 2w54 h PRO 71 N 5.40 0.84 0.00 1.29 0.11 -1.89 -3.47 132.00 134.27 2w54 h PRO 71 Ca -0.44 -0.27 0.00 0.00 0.11 0.00 0.00 66.00 65.39 2w54 h PRO 71 Cb 1.21 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2w54 h PRO 71 CO 0.76 0.89 0.00 0.72 -0.21 0.00 0.00 178.00 180.16 2w54 n HIS 72 N -4.35 0.00 -1.68 0.65 8.25 -1.22 -5.03 115.22 111.85 2w54 n HIS 72 Ca 0.00 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.06 2w54 n HIS 72 Cb 0.32 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.45 2w54 n HIS 72 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 2w54 n ASP 73 N 0.00 1.98 -3.12 0.41 9.92 -1.19 -4.98 116.55 119.58 2w54 n ASP 73 Ca 0.00 1.01 -0.26 0.00 -0.53 0.00 0.00 54.79 55.01 2w54 n ASP 73 Cb 0.00 -1.47 -0.05 0.00 -0.64 0.00 0.00 41.12 38.96 2w54 n ASP 73 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 2w54 n ASN 74 N -0.18 3.68 -3.68 -2.24 5.15 -1.26 -4.59 115.26 112.14 2w54 n ASN 74 Ca 0.09 -3.50 -0.19 0.00 -0.60 0.00 0.00 54.58 50.38 2w54 n ASN 74 Cb 0.42 -0.60 -0.18 0.00 -0.53 0.00 0.00 39.78 38.89 2w54 n ASN 74 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2w54 s ASP 75 N -2.96 1.02 0.00 1.20 2.15 -1.26 -3.58 116.67 113.24 2w54 s ASP 75 Ca 0.45 0.07 0.07 0.00 0.43 0.00 0.00 52.55 53.57 2w54 s ASP 75 Cb 0.24 -0.14 0.07 0.00 -0.30 0.00 0.00 42.92 42.80 2w54 s ASP 75 CO -0.09 -0.24 0.76 0.00 -0.17 0.00 0.00 175.17 175.43 2w54 n ALA 76 N 5.17 2.47 -1.96 3.66 0.00 -0.26 -4.91 120.51 124.67 2w54 n ALA 76 Ca -0.06 -0.59 -0.41 0.00 0.00 0.00 0.00 53.44 52.38 2w54 n ALA 76 Cb 0.50 -0.25 -0.03 0.00 0.00 0.00 0.00 19.45 19.67 2w54 n ALA 76 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2w54 s SER 77 N -0.64 6.89 0.43 0.00 0.15 -1.25 -4.83 113.70 114.46 2w54 s SER 77 Ca 0.09 2.44 0.28 0.00 0.70 0.00 0.00 55.95 59.46 2w54 s SER 77 Cb 0.06 -2.62 0.90 0.00 -1.71 0.00 0.00 66.02 62.66 2w54 s SER 77 CO 0.09 -0.52 1.80 1.55 1.20 0.00 0.00 173.24 177.37 2w54 h PRO 78 N 5.06 0.00 -7.14 5.44 0.13 -1.90 -3.45 132.00 130.13 2w54 h PRO 78 Ca -0.45 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.18 2w54 h PRO 78 Cb 1.22 0.00 0.05 0.00 0.13 0.00 0.00 31.00 32.40 2w54 h PRO 78 CO 0.75 0.00 0.24 0.00 -0.23 0.00 0.00 178.00 178.76 2w54 s ALA 79 N -3.40 3.25 0.43 -0.56 0.00 -1.23 -4.99 121.76 115.26 2w54 s ALA 79 Ca 0.05 -0.42 0.25 0.00 0.00 0.00 0.00 51.96 51.83 2w54 s ALA 79 Cb 0.08 -2.77 1.37 0.00 0.00 0.00 0.00 23.12 21.81 2w54 s ALA 79 CO 0.57 -0.62 2.06 -1.35 0.00 0.00 0.00 175.76 176.42 2w54 h PRO 80 N -0.10 0.00 -6.87 0.00 0.11 -1.93 -3.44 132.00 119.78 2w54 h PRO 80 Ca -0.46 0.00 -0.50 0.00 0.11 0.00 0.00 66.00 65.15 2w54 h PRO 80 Cb 1.22 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.35 2w54 h PRO 80 CO 0.62 0.13 0.47 -1.54 -0.21 0.00 0.00 178.00 177.47 2w54 s SER 81 N -6.33 7.02 0.15 -2.05 1.04 -1.26 -5.00 113.70 107.27 2w54 s SER 81 Ca -0.03 2.24 -0.30 0.00 0.48 0.00 0.00 55.95 58.34 2w54 s SER 81 Cb 0.14 -2.62 -0.07 0.00 0.10 0.00 0.00 66.02 63.57 2w54 s SER 81 CO 0.61 -0.32 1.08 -2.16 0.98 0.00 0.00 173.24 173.43 2w54 s PRO 82 N -1.83 4.59 -0.20 4.02 0.04 -1.26 -4.72 135.00 135.64 2w54 s PRO 82 Ca 0.50 1.67 -0.01 0.00 0.04 0.00 0.00 61.00 63.20 2w54 s PRO 82 Cb -0.30 -3.31 0.05 0.00 0.04 0.00 0.00 34.50 30.99 2w54 s PRO 82 CO 0.38 0.05 -0.03 -2.00 0.04 0.00 0.00 177.00 175.45 2w54 s GLU 83 N -0.08 1.26 0.44 4.56 2.12 -1.26 -4.98 118.70 120.76 2w54 s GLU 83 Ca 0.50 -0.68 -0.23 0.00 0.36 0.00 0.00 54.97 54.92 2w54 s GLU 83 Cb -0.28 -2.27 -0.08 0.00 0.26 0.00 0.00 34.13 31.76 2w54 s GLU 83 CO 0.33 -0.56 1.12 -1.25 -0.54 0.00 0.00 175.26 174.36 2w54 s PRO 84 N 1.61 3.87 -0.05 4.30 0.04 -1.23 -1.11 135.00 142.42 2w54 s PRO 84 Ca -0.03 1.67 -0.23 0.00 0.04 0.00 0.00 61.00 62.45 2w54 s PRO 84 Cb -0.17 -2.42 -0.18 0.00 0.04 0.00 0.00 34.50 31.77 2w54 s PRO 84 CO -0.07 -0.43 0.95 0.28 0.04 0.00 0.00 177.00 177.77 2w54 h VAL 85 N 1.93 1.06 -3.33 -0.36 2.07 -1.91 -3.44 116.25 112.27 2w54 h VAL 85 Ca -0.49 -1.26 -0.64 0.00 0.82 0.00 0.00 66.70 65.13 2w54 h VAL 85 Cb 1.24 1.79 -0.20 0.00 -1.52 0.00 0.00 31.29 32.59 2w54 h VAL 85 CO 0.61 0.28 -0.66 -0.76 0.02 0.00 0.00 177.57 177.06 2w54 s LEU 86 N -8.96 3.32 0.25 2.57 1.43 -1.26 -4.50 118.68 111.53 2w54 s LEU 86 Ca -0.14 -0.07 -0.30 0.00 -1.03 0.00 0.00 54.13 52.59 2w54 s LEU 86 Cb 0.00 -1.79 -0.14 0.00 0.03 0.00 0.00 46.19 44.29 2w54 s LEU 86 CO 0.54 0.21 1.17 0.00 0.23 0.00 0.00 176.35 178.50 2w54 n ALA 87 N 3.26 0.08 -3.27 4.21 0.00 0.37 -4.62 120.51 120.54 2w54 n ALA 87 Ca -0.17 0.41 -0.40 0.00 0.00 0.00 0.00 53.44 53.28 2w54 n ALA 87 Cb 0.53 -2.10 -0.02 0.00 0.00 0.00 0.00 19.45 17.85 2w54 n ALA 87 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2w54 n THR 88 N 0.94 4.30 -0.16 0.00 -2.24 -1.26 -4.42 114.28 111.44 2w54 n THR 88 Ca 0.11 -5.55 0.00 0.00 -2.27 0.00 0.00 64.05 56.34 2w54 n THR 88 Cb 0.30 -2.26 0.00 0.00 -2.10 0.00 0.00 70.33 66.27 2w54 n THR 88 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2w54 n GLY 89 N 1.76 2.22 3.31 3.38 0.00 -1.26 -4.97 105.19 109.63 2w54 n GLY 89 Ca 0.25 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.16 2w54 n GLY 89 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2w54 s GLU 90 N -0.16 0.98 0.04 1.61 -1.05 -1.26 -0.22 118.70 118.64 2w54 s GLU 90 Ca 0.00 -0.56 0.09 0.00 -0.15 0.00 0.00 54.97 54.35 2w54 s GLU 90 Cb 0.00 0.43 -0.03 0.00 -0.44 0.00 0.00 34.13 34.09 2w54 s GLU 90 CO 0.00 -0.36 -0.24 0.14 0.95 0.00 0.00 175.26 175.75 2w54 s VAL 91 N -3.16 2.31 -0.06 1.83 -7.23 0.83 -4.80 120.40 110.12 2w54 s VAL 91 Ca -0.01 -1.34 0.01 0.00 -1.81 0.00 0.00 61.98 58.83 2w54 s VAL 91 Cb 0.01 -1.92 -0.01 0.00 0.56 0.00 0.00 36.38 35.02 2w54 s VAL 91 CO -0.07 0.36 0.11 1.41 -0.31 0.00 0.00 175.10 176.59 2w54 n HIS 92 N 1.71 0.00 -3.44 2.82 -0.00 -1.26 -2.22 115.22 112.84 2w54 n HIS 92 Ca -0.17 0.00 -0.13 0.00 -0.00 0.00 0.00 57.72 57.42 2w54 n HIS 92 Cb 0.52 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.48 2w54 n HIS 92 CO 0.00 0.00 0.00 -0.59 -0.00 0.00 0.00 176.34 175.75 2w54 s PHE 93 N -0.95 -0.56 -0.52 4.41 -0.12 -0.84 -4.14 117.98 115.25 2w54 s PHE 93 Ca 0.00 0.46 -0.27 0.00 -0.05 0.00 0.00 56.93 57.08 2w54 s PHE 93 Cb 0.01 0.53 -0.02 0.00 -0.63 0.00 0.00 43.02 42.91 2w54 s PHE 93 CO 0.04 -0.80 1.82 0.08 -0.05 0.00 0.00 175.22 176.30 2w54 s VAL 94 N -3.31 3.42 0.00 -2.49 1.01 -1.16 -2.50 120.40 115.37 2w54 s VAL 94 Ca -0.01 0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.30 2w54 s VAL 94 Cb -0.01 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 32.51 2w54 s VAL 94 CO -0.09 -0.75 0.00 0.61 0.00 0.00 0.00 175.10 174.87 2w54 n GLY 95 N 5.58 1.07 3.71 4.51 0.00 -0.35 -4.80 105.19 114.92 2w54 n GLY 95 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 2w54 n GLY 95 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2w54 s GLN 96 N 0.00 4.52 0.22 1.61 0.74 -1.04 -4.45 119.66 121.26 2w54 s GLN 96 Ca 0.00 1.48 -0.31 0.00 0.05 0.00 0.00 55.36 56.58 2w54 s GLN 96 Cb 0.00 -3.45 -0.12 0.00 1.10 0.00 0.00 33.01 30.54 2w54 s GLN 96 CO 0.00 -0.12 1.67 -2.14 -0.55 0.00 0.00 175.29 174.16 2w54 s PRO 97 N 1.13 4.14 -0.14 1.67 0.02 -1.26 -0.18 135.00 140.38 2w54 s PRO 97 Ca 0.53 2.57 -0.01 0.00 0.02 0.00 0.00 61.00 64.11 2w54 s PRO 97 Cb -0.22 -3.07 -0.08 0.00 0.02 0.00 0.00 34.50 31.14 2w54 s PRO 97 CO 0.27 -0.71 -0.14 -0.89 -0.33 0.00 0.00 177.00 175.21 2w54 n ILE 98 N 3.56 0.78 -4.30 2.83 5.41 0.22 -0.48 119.36 127.39 2w54 n ILE 98 Ca 0.14 -0.27 -0.18 0.00 1.00 0.00 0.00 62.75 63.43 2w54 n ILE 98 Cb 0.36 -1.17 -0.09 0.00 -0.71 0.00 0.00 39.64 38.04 2w54 n ILE 98 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 176.55 177.27 2w54 s PHE 99 N -2.27 1.59 -0.06 1.39 -0.12 -1.19 -4.07 117.98 113.24 2w54 s PHE 99 Ca -0.19 -1.47 -0.00 0.00 -0.05 0.00 0.00 56.93 55.22 2w54 s PHE 99 Cb 0.06 -0.77 0.03 0.00 -0.63 0.00 0.00 43.02 41.70 2w54 s PHE 99 CO 0.30 -0.65 -0.02 -1.17 -0.05 0.00 0.00 175.22 173.63 2w54 s LEU 100 N -3.35 0.97 -0.21 -1.99 2.96 0.11 -1.31 118.68 115.86 2w54 s LEU 100 Ca 0.37 -0.11 -0.08 0.00 -0.22 0.00 0.00 54.13 54.10 2w54 s LEU 100 Cb 0.04 -0.44 -0.04 0.00 0.50 0.00 0.00 46.19 46.25 2w54 s LEU 100 CO 0.20 -0.13 0.07 -0.69 -1.32 0.00 0.00 176.35 174.49 2w54 s VAL 101 N 1.45 4.71 -0.44 1.68 1.01 0.27 -0.58 120.40 128.50 2w54 s VAL 101 Ca -0.03 -0.05 -0.08 0.00 0.00 0.00 0.00 61.98 61.82 2w54 s VAL 101 Cb -0.13 -3.15 0.10 0.00 0.00 0.00 0.00 36.38 33.20 2w54 s VAL 101 CO -0.03 0.41 0.28 0.00 0.00 0.00 0.00 175.10 175.76 2w54 s ALA 102 N 0.78 3.30 0.41 5.51 0.00 -0.22 -1.74 121.76 129.79 2w54 s ALA 102 Ca 0.04 -2.35 0.07 0.00 0.00 0.00 0.00 51.96 49.72 2w54 s ALA 102 Cb -0.13 -2.67 -0.05 0.00 0.00 0.00 0.00 23.12 20.27 2w54 s ALA 102 CO 0.02 -1.76 0.18 0.00 0.00 0.00 0.00 175.76 174.20 2w54 s ALA 103 N 1.35 3.59 -1.77 0.00 0.00 0.91 -0.07 121.76 125.77 2w54 s ALA 103 Ca 0.05 -2.11 0.30 0.00 0.00 0.00 0.00 51.96 50.20 2w54 s ALA 103 Cb -0.24 -0.37 1.56 0.00 0.00 0.00 0.00 23.12 24.07 2w54 s ALA 103 CO -0.00 -0.17 2.05 0.25 0.00 0.00 0.00 175.76 177.89 2w54 n THR 104 N -1.24 0.00 -3.80 0.00 -2.24 0.90 0.07 114.28 107.98 2w54 n THR 104 Ca -0.01 -0.03 -0.09 0.00 -2.27 0.00 0.00 64.05 61.64 2w54 n THR 104 Cb 0.65 -0.33 -0.07 0.00 -2.10 0.00 0.00 70.33 68.47 2w54 n THR 104 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2w54 s SER 105 N -2.30 0.01 0.28 3.42 1.04 -1.26 -4.81 113.70 110.08 2w54 s SER 105 Ca 0.36 -0.52 0.01 0.00 0.48 0.00 0.00 55.95 56.29 2w54 s SER 105 Cb 0.21 0.37 0.40 0.00 0.10 0.00 0.00 66.02 67.09 2w54 s SER 105 CO 0.42 -0.73 1.74 -0.74 0.98 0.00 0.00 173.24 174.91 2w54 h HIS 106 N 2.75 0.64 -0.27 5.02 2.76 -1.87 -2.15 115.15 122.03 2w54 h HIS 106 Ca -0.34 -0.12 -0.12 0.00 -2.20 0.00 0.00 60.37 57.60 2w54 h HIS 106 Cb 1.21 -0.16 -0.00 0.00 1.55 0.00 0.00 27.41 30.00 2w54 h HIS 106 CO 0.41 0.72 -0.28 0.00 -1.30 0.00 0.00 177.93 177.48 2w54 h ARG 107 N 0.53 0.67 -0.27 5.26 2.47 -1.97 -2.78 114.38 118.29 2w54 h ARG 107 Ca 0.09 -0.36 -0.04 0.00 -1.26 0.00 0.00 59.98 58.41 2w54 h ARG 107 Cb 0.59 0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.91 2w54 h ARG 107 CO 0.04 0.97 -0.01 0.00 0.56 0.00 0.00 179.97 181.52 2w54 h ALA 108 N 0.69 1.49 0.07 0.04 0.00 -1.86 -1.69 119.26 118.00 2w54 h ALA 108 Ca 0.04 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 2w54 h ALA 108 Cb 0.85 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2w54 h ALA 108 CO 0.07 0.37 -0.03 0.00 0.00 0.00 0.00 179.25 179.65 2w54 h ALA 109 N 1.61 -0.09 -0.15 0.00 0.00 -1.28 -1.12 119.26 118.22 2w54 h ALA 109 Ca 0.09 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 2w54 h ALA 109 Cb 0.28 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2w54 h ALA 109 CO 0.01 -0.43 -0.48 0.00 0.00 0.00 0.00 179.25 178.35 2w54 h ARG 110 N -0.33 0.39 -0.33 0.00 3.08 -1.35 -0.66 114.38 115.19 2w54 h ARG 110 Ca -0.01 -0.22 -0.01 0.00 0.07 0.00 0.00 59.98 59.81 2w54 h ARG 110 Cb 0.29 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 2w54 h ARG 110 CO 0.02 0.79 0.16 0.82 -1.07 0.00 0.00 179.97 180.69 2w54 h ILE 111 N 0.32 1.15 -0.24 2.04 2.04 -1.30 -2.86 117.51 118.66 2w54 h ILE 111 Ca 0.02 -0.43 -0.09 0.00 1.00 0.00 0.00 64.86 65.37 2w54 h ILE 111 Cb 0.96 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.86 2w54 h ILE 111 CO 0.08 0.16 -0.22 0.00 0.00 0.00 0.00 178.15 178.17 2w54 h ALA 112 N 1.02 1.18 -0.85 1.87 0.00 -0.95 -3.16 119.26 118.37 2w54 h ALA 112 Ca 0.11 -0.32 0.10 0.00 0.00 0.00 0.00 54.91 54.81 2w54 h ALA 112 Cb 0.10 -0.12 -0.08 0.00 0.00 0.00 0.00 17.79 17.70 2w54 h ALA 112 CO -0.02 0.52 0.49 0.00 0.00 0.00 0.00 179.25 180.25 2w54 h ALA 113 N 1.38 1.23 0.00 0.00 0.00 -0.88 -2.16 119.26 118.81 2w54 h ALA 113 Ca 0.06 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 2w54 h ALA 113 Cb 0.60 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 2w54 h ALA 113 CO 0.04 0.10 -0.02 0.00 0.00 0.00 0.00 179.25 179.37 2w54 h ARG 114 N 0.80 0.00 -0.29 0.00 3.08 -1.53 -3.32 114.38 113.11 2w54 h ARG 114 Ca 0.42 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.47 2w54 h ARG 114 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.45 2w54 h ARG 114 CO -0.26 0.02 0.00 1.63 -1.07 0.00 0.00 179.97 180.29 2w54 n LYS 115 N -3.11 0.94 -2.74 0.04 5.02 -0.81 -4.86 118.16 112.64 2w54 n LYS 115 Ca 0.02 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.98 2w54 n LYS 115 Cb 0.40 -1.15 -0.06 0.00 -0.02 0.00 0.00 35.03 34.20 2w54 n LYS 115 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2w54 s ALA 116 N -1.69 3.06 -0.44 7.82 0.00 -1.25 -4.00 121.76 125.25 2w54 s ALA 116 Ca 0.00 0.34 0.01 0.00 0.00 0.00 0.00 51.96 52.31 2w54 s ALA 116 Cb 0.00 -3.13 0.12 0.00 0.00 0.00 0.00 23.12 20.11 2w54 s ALA 116 CO 0.00 0.06 0.20 1.03 0.00 0.00 0.00 175.76 177.05 2w54 s ARG 117 N -3.37 1.90 -0.16 0.00 0.52 -0.77 -5.02 118.95 112.06 2w54 s ARG 117 Ca 0.61 -2.11 -0.04 0.00 -0.52 0.00 0.00 55.73 53.67 2w54 s ARG 117 Cb -0.09 -3.42 -0.03 0.00 0.52 0.00 0.00 34.95 31.92 2w54 s ARG 117 CO 0.17 -1.05 -0.02 0.42 0.02 0.00 0.00 175.30 174.84 2w54 s ILE 118 N 0.59 4.07 -0.08 1.52 1.01 -1.26 -0.90 121.20 126.14 2w54 s ILE 118 Ca 0.12 -0.30 -0.04 0.00 0.00 0.00 0.00 60.65 60.44 2w54 s ILE 118 Cb -0.22 -2.79 -0.04 0.00 0.01 0.00 0.00 42.46 39.42 2w54 s ILE 118 CO -0.05 0.49 0.08 0.42 0.00 0.00 0.00 174.94 175.88 2w54 s THR 119 N 0.33 4.93 0.23 2.92 -4.23 -0.23 -5.00 115.64 114.58 2w54 s THR 119 Ca -0.03 -0.08 0.11 0.00 -1.18 0.00 0.00 61.69 60.52 2w54 s THR 119 Cb -0.14 -3.14 -0.05 0.00 1.34 0.00 0.00 72.50 70.51 2w54 s THR 119 CO 0.02 0.56 -0.21 -0.31 -0.54 0.00 0.00 174.62 174.14 2w54 s TYR 120 N -1.01 2.23 -0.59 3.99 1.51 -1.26 -1.32 117.35 120.89 2w54 s TYR 120 Ca 0.16 -0.37 -0.03 0.00 -1.01 0.00 0.00 57.07 55.83 2w54 s TYR 120 Cb -0.12 -1.04 0.15 0.00 -0.11 0.00 0.00 41.96 40.84 2w54 s TYR 120 CO 0.06 0.57 0.40 0.00 -1.11 0.00 0.00 175.55 175.47 2w54 s ALA 121 N -2.12 3.52 0.32 3.71 0.00 0.13 -4.77 121.76 122.55 2w54 s ALA 121 Ca 0.24 -3.15 -0.29 0.00 0.00 0.00 0.00 51.96 48.76 2w54 s ALA 121 Cb -0.06 -2.62 -0.11 0.00 0.00 0.00 0.00 23.12 20.32 2w54 s ALA 121 CO 0.12 -2.06 1.50 -2.14 0.00 0.00 0.00 175.76 173.18 2w54 s PRO 122 N 0.12 4.16 0.28 0.00 0.02 -1.26 -1.85 135.00 136.48 2w54 s PRO 122 Ca 0.16 2.50 0.11 0.00 0.02 0.00 0.00 61.00 63.78 2w54 s PRO 122 Cb -0.21 -3.02 -0.05 0.00 0.02 0.00 0.00 34.50 31.24 2w54 s PRO 122 CO -0.03 -0.52 -0.15 1.03 -0.33 0.00 0.00 177.00 177.00 2w54 s ARG 123 N -1.22 1.81 0.07 5.54 0.52 0.79 -4.94 118.95 121.52 2w54 s ARG 123 Ca 0.57 -1.71 -0.31 0.00 -0.52 0.00 0.00 55.73 53.76 2w54 s ARG 123 Cb -0.46 -1.84 -0.09 0.00 0.52 0.00 0.00 34.95 33.08 2w54 s ARG 123 CO 0.53 0.32 1.79 -1.25 0.02 0.00 0.00 175.30 176.71 2w54 s PRO 124 N -3.55 4.16 0.40 3.54 0.04 -1.26 -4.53 135.00 133.79 2w54 s PRO 124 Ca 0.31 2.48 -0.11 0.00 0.04 0.00 0.00 61.00 63.71 2w54 s PRO 124 Cb -0.05 -3.75 -0.07 0.00 0.04 0.00 0.00 34.50 30.68 2w54 s PRO 124 CO 0.16 -0.83 0.77 0.00 0.04 0.00 0.00 177.00 177.14 2w54 s ALA 125 N 3.18 3.33 -0.56 8.56 0.00 -1.26 -4.93 121.76 130.08 2w54 s ALA 125 Ca 0.80 -0.15 -0.04 0.00 0.00 0.00 0.00 51.96 52.57 2w54 s ALA 125 Cb -0.42 -2.73 0.15 0.00 0.00 0.00 0.00 23.12 20.11 2w54 s ALA 125 CO 0.35 0.03 0.38 0.42 0.00 0.00 0.00 175.76 176.94 2w54 s ILE 126 N -2.33 3.70 -0.19 0.00 1.01 -1.26 -4.94 121.20 117.18 2w54 s ILE 126 Ca 0.52 -2.60 0.12 0.00 0.00 0.00 0.00 60.65 58.69 2w54 s ILE 126 Cb -0.10 -3.44 -0.20 0.00 0.01 0.00 0.00 42.46 38.73 2w54 s ILE 126 CO 0.29 -0.82 -0.02 0.18 0.00 0.00 0.00 174.94 174.57 2w54 n LEU 127 N 3.92 0.88 -4.95 2.97 4.77 -1.26 -0.56 117.00 122.77 2w54 n LEU 127 Ca 0.04 -0.04 -0.23 0.00 -0.03 0.00 0.00 56.01 55.75 2w54 n LEU 127 Cb 0.39 0.08 -0.03 0.00 -2.33 0.00 0.00 43.42 41.53 2w54 n LEU 127 CO 0.34 0.58 -0.07 0.42 -1.33 0.00 0.00 177.39 177.33 2w54 s THR 128 N -2.44 5.26 0.22 -5.08 -4.23 -1.26 -4.84 115.64 103.27 2w54 s THR 128 Ca -0.15 -0.86 -0.08 0.00 -1.18 0.00 0.00 61.69 59.42 2w54 s THR 128 Cb 0.06 -3.79 0.17 0.00 1.34 0.00 0.00 72.50 70.28 2w54 s THR 128 CO 0.68 -0.22 1.77 -0.07 -0.54 0.00 0.00 174.62 176.24 2w54 h LEU 129 N 1.65 0.41 -0.33 4.79 4.07 -1.98 -0.30 115.31 123.61 2w54 h LEU 129 Ca -0.50 0.06 0.06 0.00 0.08 0.00 0.00 57.88 57.58 2w54 h LEU 129 Cb 1.21 -0.00 -0.05 0.00 1.08 0.00 0.00 40.66 42.90 2w54 h LEU 129 CO 0.65 0.23 0.00 0.44 -1.08 0.00 0.00 178.44 178.68 2w54 h ASP 130 N 0.56 -0.13 -0.03 -0.43 3.32 -1.98 0.12 116.42 117.84 2w54 h ASP 130 Ca 0.34 0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.46 2w54 h ASP 130 Cb 0.37 0.13 -0.00 0.00 0.22 0.00 0.00 39.33 40.05 2w54 h ASP 130 CO -0.27 -0.03 0.02 1.56 -1.72 0.00 0.00 179.24 178.79 2w54 h GLN 131 N 0.10 0.05 -0.92 3.56 4.20 -1.82 0.14 115.11 120.41 2w54 h GLN 131 Ca 0.16 -0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.87 2w54 h GLN 131 Cb 0.22 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 27.94 2w54 h GLN 131 CO -0.27 0.11 0.61 0.00 -0.67 0.00 0.00 178.83 178.61 2w54 h ALA 132 N 0.93 1.34 -0.21 3.87 0.00 -0.74 0.31 119.26 124.75 2w54 h ALA 132 Ca 0.01 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.72 2w54 h ALA 132 Cb 0.08 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.50 2w54 h ALA 132 CO -0.00 0.61 -0.41 1.25 0.00 0.00 0.00 179.25 180.70 2w54 h LEU 133 N 1.24 0.73 -0.82 0.00 5.85 -0.58 0.40 115.31 122.13 2w54 h LEU 133 Ca 0.34 -0.54 -0.10 0.00 0.84 0.00 0.00 57.88 58.41 2w54 h LEU 133 Cb -0.14 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.66 2w54 h LEU 133 CO -0.07 1.13 -0.48 0.00 -0.34 0.00 0.00 178.44 178.68 2w54 h ALA 134 N 0.61 0.96 0.00 1.25 0.00 -0.17 -2.90 119.26 119.01 2w54 h ALA 134 Ca 0.01 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2w54 h ALA 134 Cb 1.00 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.72 2w54 h ALA 134 CO 0.09 0.60 -0.54 0.00 0.00 0.00 0.00 179.25 179.41 2w54 n ALA 135 N -2.34 3.43 -2.95 0.00 0.00 0.10 -4.95 120.51 113.79 2w54 n ALA 135 Ca -0.00 -0.33 -0.18 0.00 0.00 0.00 0.00 53.44 52.92 2w54 n ALA 135 Cb 0.57 -1.13 0.04 0.00 0.00 0.00 0.00 19.45 18.92 2w54 n ALA 135 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2w54 n ASP 136 N -1.61 -5.33 -4.56 0.00 2.03 -0.72 -4.98 116.55 101.37 2w54 n ASP 136 Ca 0.05 -0.26 -0.43 0.00 0.52 0.00 0.00 54.79 54.67 2w54 n ASP 136 Cb 0.36 -4.13 -0.03 0.00 -0.72 0.00 0.00 41.12 36.59 2w54 n ASP 136 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2w54 s SER 137 N -2.84 6.47 0.33 1.67 0.15 0.13 -4.97 113.70 114.63 2w54 s SER 137 Ca 0.28 0.05 -0.16 0.00 0.70 0.00 0.00 55.95 56.83 2w54 s SER 137 Cb -0.12 -2.49 0.03 0.00 -1.71 0.00 0.00 66.02 61.72 2w54 s SER 137 CO 0.35 -1.25 0.68 0.00 1.20 0.00 0.00 173.24 174.23 2w54 s ARG 138 N 4.25 1.95 0.20 5.44 1.70 -1.26 -0.68 118.95 130.55 2w54 s ARG 138 Ca 0.39 -1.30 0.10 0.00 -0.47 0.00 0.00 55.73 54.45 2w54 s ARG 138 Cb -0.09 0.58 -0.04 0.00 -0.57 0.00 0.00 34.95 34.82 2w54 s ARG 138 CO 0.25 -0.88 -0.14 -0.06 -1.08 0.00 0.00 175.30 173.39 2w54 s PHE 139 N -3.18 2.51 0.00 5.89 0.40 0.85 -4.60 117.98 119.85 2w54 s PHE 139 Ca 0.17 -0.27 0.00 0.00 -0.60 0.00 0.00 56.93 56.23 2w54 s PHE 139 Cb -0.04 -1.21 0.00 0.00 0.51 0.00 0.00 43.02 42.28 2w54 s PHE 139 CO 0.11 0.54 0.00 0.39 0.70 0.00 0.00 175.22 176.96 2w54 n GLU 140 N -0.06 -0.72 -3.53 0.44 1.02 -1.26 -4.18 120.64 112.34 2w54 n GLU 140 Ca -0.10 0.18 -0.26 0.00 -0.02 0.00 0.00 57.16 56.96 2w54 n GLU 140 Cb 0.56 -3.97 0.05 0.00 -0.02 0.00 0.00 31.44 28.07 2w54 n GLU 140 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2w54 n GLY 141 N -1.18 -1.03 0.00 0.62 0.00 -1.26 -4.88 105.19 97.45 2w54 n GLY 141 Ca 0.00 0.49 0.00 0.00 0.00 0.00 0.00 46.02 46.51 2w54 n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w54 n GLY 142 N -1.52 3.67 3.77 -0.02 0.00 -1.26 -5.08 105.19 104.74 2w54 n GLY 142 Ca -0.09 -1.78 -0.39 0.00 0.00 0.00 0.00 46.02 43.76 2w54 n GLY 142 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2w54 s PRO 143 N -3.15 4.40 -0.05 1.61 0.04 -1.26 -4.83 135.00 131.77 2w54 s PRO 143 Ca 0.00 1.72 -0.28 0.00 0.04 0.00 0.00 61.00 62.48 2w54 s PRO 143 Cb 0.00 -2.91 -0.03 0.00 0.04 0.00 0.00 34.50 31.60 2w54 s PRO 143 CO 0.00 0.02 0.91 0.08 0.04 0.00 0.00 177.00 178.05 2w54 s VAL 144 N -1.36 4.90 -0.11 -0.36 1.01 -0.63 -4.86 120.40 118.99 2w54 s VAL 144 Ca 0.51 1.89 0.01 0.00 0.00 0.00 0.00 61.98 64.38 2w54 s VAL 144 Cb -0.29 -4.24 0.02 0.00 0.00 0.00 0.00 36.38 31.87 2w54 s VAL 144 CO 0.37 0.14 -0.13 -0.63 0.00 0.00 0.00 175.10 174.85 2w54 s ILE 145 N 1.22 1.32 -0.03 2.22 1.01 -1.26 -0.26 121.20 125.42 2w54 s ILE 145 Ca 0.47 -0.52 0.07 0.00 0.00 0.00 0.00 60.65 60.67 2w54 s ILE 145 Cb -0.19 -1.24 -0.02 0.00 0.01 0.00 0.00 42.46 41.02 2w54 s ILE 145 CO 0.23 0.41 -0.25 0.26 0.00 0.00 0.00 174.94 175.59 2w54 s TRP 146 N 1.19 2.38 -0.01 3.97 0.51 -0.60 -4.96 118.94 121.43 2w54 s TRP 146 Ca -0.03 -0.48 0.02 0.00 -2.12 0.00 0.00 56.10 53.49 2w54 s TRP 146 Cb -0.14 -1.53 -0.01 0.00 -0.81 0.00 0.00 33.47 30.98 2w54 s TRP 146 CO -0.04 -0.06 -0.07 0.00 -0.51 0.00 0.00 176.95 176.28 2w54 s ALA 147 N -0.53 0.55 -0.17 0.98 0.00 -1.26 -1.05 121.76 120.28 2w54 s ALA 147 Ca 0.07 -0.28 -0.02 0.00 0.00 0.00 0.00 51.96 51.73 2w54 s ALA 147 Cb -0.11 -0.14 0.05 0.00 0.00 0.00 0.00 23.12 22.92 2w54 s ALA 147 CO 0.00 0.13 0.01 0.50 0.00 0.00 0.00 175.76 176.40 2w54 s ARG 148 N -0.15 0.85 2.30 0.00 3.00 -0.14 -5.00 118.95 119.81 2w54 s ARG 148 Ca 0.03 -0.39 0.00 0.00 -1.00 0.00 0.00 55.73 54.37 2w54 s ARG 148 Cb -0.03 -1.93 0.00 0.00 0.00 0.00 0.00 34.95 32.99 2w54 s ARG 148 CO -0.00 -0.54 0.00 0.41 0.00 0.00 0.00 175.30 175.16 2w54 n GLY 149 N 5.01 -1.12 2.88 8.12 0.00 -1.26 -1.17 105.19 117.65 2w54 n GLY 149 Ca -0.09 -1.24 -0.30 0.00 0.00 0.00 0.00 46.02 44.39 2w54 n GLY 149 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2w54 s ASP 150 N -4.00 4.29 0.13 1.61 -1.08 -1.26 -4.85 116.67 111.50 2w54 s ASP 150 Ca 0.00 -2.31 -0.19 0.00 -0.52 0.00 0.00 52.55 49.53 2w54 s ASP 150 Cb 0.00 -1.34 -0.03 0.00 -1.46 0.00 0.00 42.92 40.09 2w54 s ASP 150 CO 0.00 -0.33 1.75 -0.37 0.52 0.00 0.00 175.17 176.73 2w54 h VAL 151 N 6.08 0.94 -0.27 1.11 -1.51 -1.88 -2.19 116.25 118.54 2w54 h VAL 151 Ca -0.07 -0.06 0.06 0.00 -1.23 0.00 0.00 66.70 65.41 2w54 h VAL 151 Cb 0.97 0.75 -0.06 0.00 -2.13 0.00 0.00 31.29 30.82 2w54 h VAL 151 CO 0.54 0.03 -0.15 -0.33 -1.23 0.00 0.00 177.57 176.43 2w54 h GLU 152 N 0.17 -0.12 0.28 5.19 4.39 -1.99 0.17 114.58 122.68 2w54 h GLU 152 Ca 0.10 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.81 2w54 h GLU 152 Cb 0.07 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.72 2w54 h GLU 152 CO -0.10 -0.08 -0.28 1.15 -1.16 0.00 0.00 179.01 178.54 2w54 h THR 153 N -0.12 0.40 0.11 1.13 2.02 -1.98 -1.19 112.91 113.28 2w54 h THR 153 Ca 0.14 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.34 2w54 h THR 153 Cb 0.34 0.40 -0.04 0.00 -1.74 0.00 0.00 68.15 67.11 2w54 h THR 153 CO -0.34 0.00 -0.29 0.00 0.37 0.00 0.00 175.52 175.26 2w54 h ALA 154 N 0.00 -0.49 -0.75 6.16 0.00 -0.87 -2.84 119.26 120.47 2w54 h ALA 154 Ca -0.01 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 2w54 h ALA 154 Cb 0.55 0.47 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 2w54 h ALA 154 CO -0.06 -0.83 0.31 -0.07 0.00 0.00 0.00 179.25 178.60 2w54 h LEU 155 N -0.50 1.02 -0.60 0.00 3.38 -0.69 -2.50 115.31 115.41 2w54 h LEU 155 Ca 0.03 -0.14 0.05 0.00 0.09 0.00 0.00 57.88 57.91 2w54 h LEU 155 Cb 0.54 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.97 2w54 h LEU 155 CO -0.17 0.89 0.32 0.00 0.09 0.00 0.00 178.44 179.57 2w54 h ALA 156 N 1.25 0.78 -0.86 1.53 0.00 -1.00 -2.22 119.26 118.75 2w54 h ALA 156 Ca 0.25 0.02 -0.43 0.00 0.00 0.00 0.00 54.91 54.75 2w54 h ALA 156 Cb 0.19 -0.09 -0.26 0.00 0.00 0.00 0.00 17.79 17.62 2w54 h ALA 156 CO -0.02 -0.02 0.49 0.41 0.00 0.00 0.00 179.25 180.11 2w54 n GLY 157 N -1.27 4.50 3.77 0.00 0.00 -1.09 -4.99 105.19 106.11 2w54 n GLY 157 Ca 0.07 -1.11 -0.39 0.00 0.00 0.00 0.00 46.02 44.59 2w54 n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w54 s ALA 158 N -3.27 3.30 0.22 4.61 0.00 -0.84 -4.98 121.76 120.80 2w54 s ALA 158 Ca 0.55 0.54 0.02 0.00 0.00 0.00 0.00 51.96 53.07 2w54 s ALA 158 Cb 0.46 -3.16 0.19 0.00 0.00 0.00 0.00 23.12 20.61 2w54 s ALA 158 CO 0.09 0.21 1.53 0.00 0.00 0.00 0.00 175.76 177.59 2w54 h ALA 159 N 3.73 0.78 -3.49 0.00 0.00 -1.71 -3.43 119.26 115.14 2w54 h ALA 159 Ca -0.46 -0.55 -0.39 0.00 0.00 0.00 0.00 54.91 53.51 2w54 h ALA 159 Cb 1.20 -0.08 -0.34 0.00 0.00 0.00 0.00 17.79 18.57 2w54 h ALA 159 CO 0.66 0.73 -0.77 -1.01 0.00 0.00 0.00 179.25 178.87 2w54 s HIS 160 N -3.77 0.67 0.09 0.00 3.76 -0.38 -4.93 115.29 110.73 2w54 s HIS 160 Ca -0.05 -0.17 0.09 0.00 -0.15 0.00 0.00 55.06 54.78 2w54 s HIS 160 Cb 0.12 -0.61 -0.03 0.00 1.11 0.00 0.00 32.58 33.17 2w54 s HIS 160 CO 0.81 -0.17 -0.23 -1.17 -0.85 0.00 0.00 174.74 173.13 2w54 s LEU 161 N 0.86 2.27 -0.20 0.89 2.96 -1.26 -0.84 118.68 123.36 2w54 s LEU 161 Ca -0.11 -0.66 -0.04 0.00 -0.22 0.00 0.00 54.13 53.10 2w54 s LEU 161 Cb -0.14 -1.02 0.08 0.00 0.50 0.00 0.00 46.19 45.61 2w54 s LEU 161 CO 0.00 0.13 0.17 0.00 -1.32 0.00 0.00 176.35 175.33 2w54 s ALA 162 N -1.03 0.03 -0.19 5.97 0.00 0.91 -4.97 121.76 122.47 2w54 s ALA 162 Ca 0.09 -0.04 -0.09 0.00 0.00 0.00 0.00 51.96 51.92 2w54 s ALA 162 Cb -0.10 -1.24 -0.05 0.00 0.00 0.00 0.00 23.12 21.74 2w54 s ALA 162 CO 0.04 -1.24 0.10 -1.21 0.00 0.00 0.00 175.76 173.46 2w54 s GLU 163 N 2.25 4.05 0.29 0.00 2.02 -1.26 -1.46 118.70 124.59 2w54 s GLU 163 Ca 0.05 -0.26 -0.14 0.00 0.02 0.00 0.00 54.97 54.64 2w54 s GLU 163 Cb -0.16 -3.32 0.01 0.00 0.10 0.00 0.00 34.13 30.76 2w54 s GLU 163 CO -0.13 0.33 0.59 0.20 0.02 0.00 0.00 175.26 176.27 2w54 s GLY 164 N 0.26 0.48 -0.28 -1.39 0.00 -0.84 -5.03 107.32 100.51 2w54 s GLY 164 Ca 0.07 -0.80 -0.17 0.00 0.00 0.00 0.00 44.72 43.82 2w54 s GLY 164 CO -0.01 -0.49 0.69 0.00 0.00 0.00 0.00 173.10 173.29 2w54 s PHE 166 N 1.49 -0.38 0.05 0.00 -0.00 -0.93 -5.00 117.98 113.21 2w54 s PHE 166 Ca -0.09 0.67 -0.22 0.00 -0.00 0.00 0.00 56.93 57.29 2w54 s PHE 166 Cb -0.05 0.22 -0.06 0.00 -0.00 0.00 0.00 43.02 43.12 2w54 s PHE 166 CO -0.18 -0.46 0.65 -1.21 -0.00 0.00 0.00 175.22 174.03 2w54 s GLU 167 N -1.13 4.37 -0.26 1.99 0.41 -1.26 -2.10 118.70 120.71 2w54 s GLU 167 Ca -0.11 0.87 0.03 0.00 -0.41 0.00 0.00 54.97 55.34 2w54 s GLU 167 Cb -0.03 -3.31 0.06 0.00 -1.78 0.00 0.00 34.13 29.07 2w54 s GLU 167 CO 0.06 0.45 -0.08 0.42 -0.49 0.00 0.00 175.26 175.61 2w54 s ILE 168 N -0.54 2.03 0.83 -1.63 1.01 0.41 -1.64 121.20 121.67 2w54 s ILE 168 Ca 0.33 -1.60 -0.10 0.00 0.00 0.00 0.00 60.65 59.28 2w54 s ILE 168 Cb -0.20 -2.20 0.09 0.00 0.01 0.00 0.00 42.46 40.17 2w54 s ILE 168 CO 0.20 -0.09 1.11 -0.83 0.00 0.00 0.00 174.94 175.34 2w54 s GLY 169 N 1.15 1.68 0.00 6.18 0.00 -1.03 -0.51 107.32 114.80 2w54 s GLY 169 Ca -0.07 0.40 0.00 0.00 0.00 0.00 0.00 44.72 45.05 2w54 s GLY 169 CO -0.06 0.77 0.00 0.61 0.00 0.00 0.00 173.10 174.43 2w54 n GLY 170 N -0.65 -1.27 3.64 0.20 0.00 -1.26 -4.65 105.19 101.20 2w54 n GLY 170 Ca 0.10 -1.49 -0.06 0.00 0.00 0.00 0.00 46.02 44.57 2w54 n GLY 170 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2w54 s GLN 171 N 0.00 0.54 -0.06 1.61 0.74 -1.24 -4.79 119.66 116.46 2w54 s GLN 171 Ca 0.00 0.86 -0.19 0.00 0.05 0.00 0.00 55.36 56.08 2w54 s GLN 171 Cb 0.00 0.14 -0.05 0.00 1.10 0.00 0.00 33.01 34.21 2w54 s GLN 171 CO 0.00 -0.10 0.54 -2.00 -0.55 0.00 0.00 175.29 173.18 2w54 s GLU 172 N 1.21 4.30 0.10 1.67 2.56 -1.26 -0.75 118.70 126.53 2w54 s GLU 172 Ca -0.07 0.60 -0.23 0.00 0.00 0.00 0.00 54.97 55.27 2w54 s GLU 172 Cb -0.04 -3.38 -0.11 0.00 2.00 0.00 0.00 34.13 32.60 2w54 s GLU 172 CO -0.14 0.28 1.72 0.45 -0.56 0.00 0.00 175.26 177.01 2w54 h HIS 173 N 6.11 -0.11 -6.26 5.30 3.86 -1.96 -3.47 115.15 118.61 2w54 h HIS 173 Ca -0.44 0.01 -0.44 0.00 -1.16 0.00 0.00 60.37 58.34 2w54 h HIS 173 Cb 1.19 0.05 0.08 0.00 1.06 0.00 0.00 27.41 29.80 2w54 h HIS 173 CO 0.65 -0.07 -0.94 0.34 0.86 0.00 0.00 177.93 178.76 2w54 n PHE 174 N -5.16 -1.88 -2.21 2.45 7.35 -1.26 -4.97 117.46 111.79 2w54 n PHE 174 Ca -0.06 0.44 -0.42 0.00 -0.76 0.00 0.00 57.45 56.65 2w54 n PHE 174 Cb 0.09 -3.42 -0.03 0.00 0.35 0.00 0.00 39.48 36.47 2w54 n PHE 174 CO 0.00 0.00 0.00 1.52 -0.76 0.00 0.00 176.76 177.52 2w54 s TYR 175 N -3.48 3.26 0.43 -5.13 -0.85 -1.26 -4.95 117.35 105.37 2w54 s TYR 175 Ca 0.46 1.09 0.13 0.00 -0.52 0.00 0.00 57.07 58.23 2w54 s TYR 175 Cb -0.17 -3.63 0.93 0.00 0.38 0.00 0.00 41.96 39.47 2w54 s TYR 175 CO 0.87 -2.10 1.97 -0.07 -1.52 0.00 0.00 175.55 174.70 2w54 h LEU 176 N 6.16 0.08 -8.95 -3.49 -0.00 -1.86 -3.35 115.31 103.90 2w54 h LEU 176 Ca -0.43 -0.01 -0.62 0.00 -0.00 0.00 0.00 57.88 56.81 2w54 h LEU 176 Cb 1.21 -0.02 -0.13 0.00 -0.00 0.00 0.00 40.66 41.72 2w54 h LEU 176 CO 0.82 0.25 0.02 -0.70 -0.00 0.00 0.00 178.44 178.82 2w54 s GLU 177 N -4.69 4.02 0.91 1.13 2.12 -1.09 -5.08 118.70 116.03 2w54 s GLU 177 Ca -0.04 0.30 -0.13 0.00 0.36 0.00 0.00 54.97 55.46 2w54 s GLU 177 Cb 0.16 -3.67 0.14 0.00 0.26 0.00 0.00 34.13 31.01 2w54 s GLU 177 CO 0.71 -0.40 1.16 0.20 -0.54 0.00 0.00 175.26 176.39 2w54 s GLY 178 N 1.57 1.60 0.17 -1.50 0.00 -1.26 -4.72 107.32 103.18 2w54 s GLY 178 Ca 0.22 -0.65 -0.33 0.00 0.00 0.00 0.00 44.72 43.96 2w54 s GLY 178 CO 0.10 -0.06 1.37 -1.06 0.00 0.00 0.00 173.10 173.44 2w54 n GLN 179 N -3.72 1.64 -3.77 2.90 1.13 -1.26 -4.85 117.38 109.44 2w54 n GLN 179 Ca 0.08 0.59 -0.13 0.00 -1.94 0.00 0.00 57.00 55.60 2w54 n GLN 179 Cb 0.60 -2.23 -0.11 0.00 0.11 0.00 0.00 30.24 28.61 2w54 n GLN 179 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2w54 s ALA 180 N 0.25 -0.72 -0.01 -1.58 0.00 -1.26 -1.91 121.76 116.53 2w54 s ALA 180 Ca 0.76 0.72 -0.14 0.00 0.00 0.00 0.00 51.96 53.30 2w54 s ALA 180 Cb -0.78 -0.38 0.02 0.00 0.00 0.00 0.00 23.12 21.98 2w54 s ALA 180 CO 0.47 -0.16 0.29 0.00 0.00 0.00 0.00 175.76 176.36 2w54 s ALA 181 N -0.12 -0.73 -0.04 0.00 0.00 0.00 -1.13 121.76 119.75 2w54 s ALA 181 Ca -0.03 0.27 -0.02 0.00 0.00 0.00 0.00 51.96 52.18 2w54 s ALA 181 Cb -0.03 0.09 0.03 0.00 0.00 0.00 0.00 23.12 23.21 2w54 s ALA 181 CO 0.01 -0.26 0.09 -1.17 0.00 0.00 0.00 175.76 174.43 2w54 s LEU 182 N -1.35 1.07 -0.21 0.00 2.96 0.13 -0.49 118.68 120.78 2w54 s LEU 182 Ca -0.14 0.17 0.01 0.00 -0.22 0.00 0.00 54.13 53.95 2w54 s LEU 182 Cb -0.05 0.18 0.05 0.00 0.50 0.00 0.00 46.19 46.87 2w54 s LEU 182 CO 0.04 -0.11 -0.07 0.00 -1.32 0.00 0.00 176.35 174.89 2w54 s ALA 183 N 0.89 1.91 -0.31 5.97 0.00 0.91 -1.39 121.76 129.74 2w54 s ALA 183 Ca -0.07 -1.24 -0.10 0.00 0.00 0.00 0.00 51.96 50.55 2w54 s ALA 183 Cb -0.10 -1.34 -0.01 0.00 0.00 0.00 0.00 23.12 21.67 2w54 s ALA 183 CO -0.04 -1.02 0.17 -0.51 0.00 0.00 0.00 175.76 174.36 2w54 s LEU 184 N 1.43 4.18 -0.40 0.00 1.43 -0.23 -1.59 118.68 123.50 2w54 s LEU 184 Ca -0.04 -0.47 -0.29 0.00 -1.03 0.00 0.00 54.13 52.31 2w54 s LEU 184 Cb -0.18 -2.04 0.01 0.00 0.03 0.00 0.00 46.19 44.02 2w54 s LEU 184 CO -0.07 -0.19 1.36 -2.16 0.23 0.00 0.00 176.35 175.52 2w54 s PRO 185 N 1.65 3.65 -0.89 1.29 0.04 -1.26 -0.48 135.00 138.99 2w54 s PRO 185 Ca 0.05 0.95 -0.07 0.00 0.04 0.00 0.00 61.00 61.97 2w54 s PRO 185 Cb -0.17 -3.98 0.23 0.00 0.04 0.00 0.00 34.50 30.61 2w54 s PRO 185 CO 0.07 -1.46 0.81 0.00 0.04 0.00 0.00 177.00 176.46 2w54 s ALA 186 N 5.12 4.23 0.00 8.56 0.00 0.30 -4.95 121.76 135.01 2w54 s ALA 186 Ca 0.59 -3.63 0.00 0.00 0.00 0.00 0.00 51.96 48.92 2w54 s ALA 186 Cb -0.13 -3.15 0.00 0.00 0.00 0.00 0.00 23.12 19.83 2w54 s ALA 186 CO 0.31 -2.19 0.00 -0.85 0.00 0.00 0.00 175.76 173.03 2w54 n GLU 187 N 2.99 -0.38 0.00 0.00 0.28 -1.26 -2.77 120.64 119.51 2w54 n GLU 187 Ca 0.18 0.40 0.00 0.00 -0.16 0.00 0.00 57.16 57.58 2w54 n GLU 187 Cb 0.40 -0.30 0.00 0.00 1.43 0.00 0.00 31.44 32.97 2w54 n GLU 187 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2w54 n GLY 188 N 1.38 2.97 0.00 -1.84 0.00 -1.26 -4.97 105.19 101.47 2w54 n GLY 188 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2w54 n GLY 188 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w54 n GLY 189 N -0.33 3.30 3.34 -0.02 0.00 -1.11 -5.01 105.19 105.36 2w54 n GLY 189 Ca 0.00 -1.42 -0.23 0.00 0.00 0.00 0.00 46.02 44.37 2w54 n GLY 189 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2w54 s VAL 190 N -2.36 1.91 -0.17 1.61 -7.23 -0.80 -0.54 120.40 112.82 2w54 s VAL 190 Ca 0.00 -1.88 -0.04 0.00 -1.81 0.00 0.00 61.98 58.26 2w54 s VAL 190 Cb 0.00 -1.85 -0.02 0.00 0.56 0.00 0.00 36.38 35.06 2w54 s VAL 190 CO 0.00 -0.23 -0.04 -0.69 -0.31 0.00 0.00 175.10 173.83 2w54 s VAL 191 N -1.82 3.75 -0.20 1.32 1.01 0.37 -2.26 120.40 122.57 2w54 s VAL 191 Ca 0.15 -0.40 -0.05 0.00 0.00 0.00 0.00 61.98 61.69 2w54 s VAL 191 Cb -0.07 -2.66 -0.02 0.00 0.00 0.00 0.00 36.38 33.63 2w54 s VAL 191 CO 0.07 0.47 -0.00 -0.63 0.00 0.00 0.00 175.10 175.01 2w54 s ILE 192 N 0.65 3.94 -0.11 2.22 -1.09 0.13 -1.07 121.20 125.88 2w54 s ILE 192 Ca -0.02 -0.32 -0.02 0.00 -2.23 0.00 0.00 60.65 58.06 2w54 s ILE 192 Cb -0.14 -2.78 -0.03 0.00 -1.58 0.00 0.00 42.46 37.92 2w54 s ILE 192 CO 0.02 0.43 -0.02 -1.00 -1.23 0.00 0.00 174.94 173.14 2w54 s HIS 193 N 1.02 3.08 0.00 3.97 3.76 -0.49 -0.05 115.29 126.59 2w54 s HIS 193 Ca 0.02 0.01 -0.28 0.00 -0.15 0.00 0.00 55.06 54.66 2w54 s HIS 193 Cb -0.14 -1.84 0.09 0.00 1.11 0.00 0.00 32.58 31.79 2w54 s HIS 193 CO 0.02 0.27 0.78 0.00 -0.85 0.00 0.00 174.74 174.96 2w54 s SER 195 N -1.99 6.22 -0.14 0.00 0.15 -0.28 -4.68 113.70 112.97 2w54 s SER 195 Ca -0.01 -0.70 -0.23 0.00 0.70 0.00 0.00 55.95 55.70 2w54 s SER 195 Cb -0.01 -2.45 0.06 0.00 -1.71 0.00 0.00 66.02 61.91 2w54 s SER 195 CO -0.04 -1.47 0.59 -0.55 1.20 0.00 0.00 173.24 172.97 2w54 s SER 196 N 3.47 -0.58 0.00 5.45 0.15 -1.26 -4.52 113.70 116.41 2w54 s SER 196 Ca 0.27 0.91 0.28 0.00 0.70 0.00 0.00 55.95 58.11 2w54 s SER 196 Cb -0.14 0.90 1.10 0.00 -1.71 0.00 0.00 66.02 66.17 2w54 s SER 196 CO 0.14 -0.37 1.77 0.00 1.20 0.00 0.00 173.24 175.98 2w54 n GLN 197 N 1.98 1.19 -3.30 5.44 6.02 0.48 -4.59 117.38 124.60 2w54 n GLN 197 Ca -0.16 -0.60 -0.23 0.00 -0.01 0.00 0.00 57.00 56.00 2w54 n GLN 197 Cb 0.56 -1.49 -0.08 0.00 1.02 0.00 0.00 30.24 30.25 2w54 n GLN 197 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 2w54 s HIS 198 N -2.22 0.57 0.35 1.08 2.46 -1.25 -0.81 115.29 115.46 2w54 s HIS 198 Ca 0.34 -1.94 0.11 0.00 0.47 0.00 0.00 55.06 54.03 2w54 s HIS 198 Cb 0.20 -0.69 0.63 0.00 -0.13 0.00 0.00 32.58 32.59 2w54 s HIS 198 CO 0.41 -0.91 1.79 -1.35 -2.47 0.00 0.00 174.74 172.22 2w54 h PRO 199 N 5.69 0.09 -0.55 2.88 0.11 -1.91 -2.69 132.00 135.61 2w54 h PRO 199 Ca 0.21 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 66.20 2w54 h PRO 199 Cb 0.95 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.04 2w54 h PRO 199 CO 0.30 0.45 0.00 0.77 -0.21 0.00 0.00 178.00 179.31 2w54 h SER 200 N 0.08 0.96 -0.23 -2.05 0.02 -1.92 -1.32 113.55 109.08 2w54 h SER 200 Ca 0.01 -0.31 -0.10 0.00 -0.84 0.00 0.00 61.79 60.55 2w54 h SER 200 Cb 0.70 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.96 2w54 h SER 200 CO 0.05 1.03 -0.21 -0.08 -1.14 0.00 0.00 176.83 176.49 2w54 h GLU 201 N 0.86 0.69 0.13 3.45 4.81 -1.82 -0.28 114.58 122.42 2w54 h GLU 201 Ca 0.16 -0.26 0.01 0.00 -0.13 0.00 0.00 59.36 59.14 2w54 h GLU 201 Cb 0.54 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.85 2w54 h GLU 201 CO 0.03 0.84 -0.20 0.82 -0.73 0.00 0.00 179.01 179.77 2w54 h ILE 202 N 0.61 0.55 -0.30 2.32 1.08 -1.14 0.12 117.51 120.75 2w54 h ILE 202 Ca 0.09 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.63 2w54 h ILE 202 Cb 0.68 0.55 -0.07 0.00 -3.07 0.00 0.00 36.82 34.91 2w54 h ILE 202 CO 0.05 0.00 -0.20 -0.61 -0.69 0.00 0.00 178.15 176.70 2w54 h GLN 203 N -0.39 -0.17 -0.23 2.37 4.15 -1.06 0.15 115.11 119.93 2w54 h GLN 203 Ca 0.02 0.01 0.06 0.00 0.77 0.00 0.00 58.65 59.51 2w54 h GLN 203 Cb 0.40 0.04 -0.07 0.00 0.21 0.00 0.00 27.48 28.06 2w54 h GLN 203 CO -0.10 -0.11 -0.29 1.25 -1.93 0.00 0.00 178.83 177.65 2w54 h HIS 204 N -0.18 -0.81 -0.14 3.99 2.76 -0.69 -0.09 115.15 120.00 2w54 h HIS 204 Ca 0.16 0.04 -0.05 0.00 -2.20 0.00 0.00 60.37 58.32 2w54 h HIS 204 Cb 0.42 0.39 -0.00 0.00 1.55 0.00 0.00 27.41 29.76 2w54 h HIS 204 CO -0.39 -0.37 -0.10 0.87 -1.30 0.00 0.00 177.93 176.64 2w54 h LYS 205 N -0.32 0.31 -0.89 5.26 1.79 -0.35 -2.46 116.57 119.92 2w54 h LYS 205 Ca 0.13 -0.15 0.01 0.00 -2.18 0.00 0.00 60.65 58.46 2w54 h LYS 205 Cb 0.52 -0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 31.12 2w54 h LYS 205 CO -0.40 0.67 0.59 0.28 -1.08 0.00 0.00 179.45 179.50 2w54 h VAL 206 N -0.04 1.22 -0.09 0.50 2.07 -0.66 -0.12 116.25 119.12 2w54 h VAL 206 Ca 0.03 -0.41 0.03 0.00 0.82 0.00 0.00 66.70 67.17 2w54 h VAL 206 Cb 0.59 -0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.25 2w54 h VAL 206 CO 0.03 0.22 -0.09 0.00 0.02 0.00 0.00 177.57 177.75 2w54 h ALA 207 N 1.33 -0.01 -0.48 1.67 0.00 -0.93 -0.57 119.26 120.26 2w54 h ALA 207 Ca 0.33 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.21 2w54 h ALA 207 Cb -0.12 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2w54 h ALA 207 CO -0.08 -0.55 0.00 0.45 0.00 0.00 0.00 179.25 179.07 2w54 h HIS 208 N -0.11 0.85 -0.50 0.00 -0.00 -1.08 0.76 115.15 115.08 2w54 h HIS 208 Ca 0.06 -0.12 0.01 0.00 -0.00 0.00 0.00 60.37 60.33 2w54 h HIS 208 Cb 0.20 -0.23 -0.03 0.00 -0.00 0.00 0.00 27.41 27.35 2w54 h HIS 208 CO -0.19 0.79 0.32 0.00 -0.00 0.00 0.00 177.93 178.84 2w54 h ALA 209 N 1.25 0.64 0.00 2.45 0.00 -0.66 -2.97 119.26 119.97 2w54 h ALA 209 Ca 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2w54 h ALA 209 Cb 0.45 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2w54 h ALA 209 CO 0.02 0.05 -0.40 -0.07 0.00 0.00 0.00 179.25 178.84 2w54 h LEU 210 N 0.65 0.00 -1.82 0.00 3.38 -0.82 -3.24 115.31 113.45 2w54 h LEU 210 Ca 0.19 -0.11 -0.17 0.00 0.09 0.00 0.00 57.88 57.88 2w54 h LEU 210 Cb -0.04 0.00 0.09 0.00 0.09 0.00 0.00 40.66 40.80 2w54 h LEU 210 CO -0.06 0.06 -0.40 0.61 0.09 0.00 0.00 178.44 178.74 2w54 n GLY 211 N 1.30 0.03 3.32 0.83 0.00 0.07 -4.86 105.19 105.88 2w54 n GLY 211 Ca 0.04 -0.18 -0.22 0.00 0.00 0.00 0.00 46.02 45.66 2w54 n GLY 211 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2w54 s LEU 212 N -4.26 2.40 0.47 0.99 1.43 -0.13 -5.04 118.68 114.55 2w54 s LEU 212 Ca 0.00 -0.81 -0.22 0.00 -1.03 0.00 0.00 54.13 52.07 2w54 s LEU 212 Cb -0.00 -0.85 -0.08 0.00 0.03 0.00 0.00 46.19 45.29 2w54 s LEU 212 CO 0.38 -0.01 1.10 0.00 0.23 0.00 0.00 176.35 178.05 2w54 s ALA 213 N -1.79 2.91 0.57 4.21 0.00 -1.26 -4.44 121.76 121.95 2w54 s ALA 213 Ca 0.13 0.78 0.29 0.00 0.00 0.00 0.00 51.96 53.16 2w54 s ALA 213 Cb -0.07 -3.32 1.47 0.00 0.00 0.00 0.00 23.12 21.20 2w54 s ALA 213 CO 0.06 -0.50 1.91 0.74 0.00 0.00 0.00 175.76 177.97 2w54 h PHE 214 N 1.84 0.00 0.00 0.00 -1.00 -1.93 0.11 116.94 115.95 2w54 h PHE 214 Ca -0.49 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.29 2w54 h PHE 214 Cb 1.24 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.80 2w54 h PHE 214 CO 0.55 0.00 0.00 -2.39 -1.61 0.00 0.00 178.31 174.86 2w54 n HIS 215 N -3.92 0.00 0.94 -0.55 1.44 -1.26 -2.64 115.22 109.23 2w54 n HIS 215 Ca 0.11 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.94 2w54 n HIS 215 Cb 0.73 -0.40 0.28 0.00 0.12 0.00 0.00 29.99 30.72 2w54 n HIS 215 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 2w54 n ASP 216 N -1.40 2.53 -4.02 4.39 8.00 0.36 -4.81 116.55 121.61 2w54 n ASP 216 Ca 0.09 -1.84 -0.30 0.00 0.71 0.00 0.00 54.79 53.46 2w54 n ASP 216 Cb 0.26 -0.10 -0.16 0.00 -0.02 0.00 0.00 41.12 41.09 2w54 n ASP 216 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2w54 s VAL 217 N -1.79 1.58 -0.11 2.53 1.01 -1.08 -1.90 120.40 120.63 2w54 s VAL 217 Ca 0.34 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.69 2w54 s VAL 217 Cb 0.20 -1.49 -0.01 0.00 0.00 0.00 0.00 36.38 35.09 2w54 s VAL 217 CO 0.30 0.44 -0.20 -0.60 0.00 0.00 0.00 175.10 175.05 2w54 s ARG 218 N 1.48 3.18 -0.21 2.72 3.52 -0.96 -4.91 118.95 123.77 2w54 s ARG 218 Ca 0.05 -0.80 0.02 0.00 -0.13 0.00 0.00 55.73 54.86 2w54 s ARG 218 Cb -0.13 -2.44 0.04 0.00 -1.56 0.00 0.00 34.95 30.86 2w54 s ARG 218 CO -0.11 0.19 -0.16 0.08 -0.81 0.00 0.00 175.30 174.50 2w54 s VAL 219 N 0.35 2.05 -0.10 7.11 1.01 -1.26 0.23 120.40 129.79 2w54 s VAL 219 Ca -0.16 -1.20 -0.02 0.00 0.00 0.00 0.00 61.98 60.60 2w54 s VAL 219 Cb -0.17 -1.99 -0.03 0.00 0.00 0.00 0.00 36.38 34.18 2w54 s VAL 219 CO 0.08 0.29 -0.01 -1.61 0.00 0.00 0.00 175.10 173.84 2w54 s GLU 220 N 1.23 3.11 -0.31 2.72 2.02 0.93 -1.66 118.70 126.75 2w54 s GLU 220 Ca -0.01 -0.45 0.01 0.00 0.02 0.00 0.00 54.97 54.55 2w54 s GLU 220 Cb -0.16 -2.80 0.15 0.00 0.10 0.00 0.00 34.13 31.42 2w54 s GLU 220 CO -0.09 0.59 0.35 1.41 0.02 0.00 0.00 175.26 177.54 2w54 s MET 221 N -0.59 0.43 -0.12 1.61 -2.45 0.11 -3.36 119.30 114.93 2w54 s MET 221 Ca 0.09 -0.25 -0.24 0.00 -1.25 0.00 0.00 55.69 54.04 2w54 s MET 221 Cb -0.12 -0.57 -0.21 0.00 1.25 0.00 0.00 34.83 35.18 2w54 s MET 221 CO 0.02 -1.08 0.70 -0.09 1.05 0.00 0.00 175.02 175.63 2w54 h ARG 222 N 7.91 -0.02 -2.28 4.11 9.65 -1.84 -2.61 114.38 129.31 2w54 h ARG 222 Ca -0.07 0.00 -0.05 0.00 -1.10 0.00 0.00 59.98 58.76 2w54 h ARG 222 Cb 1.08 0.00 -0.17 0.00 -1.39 0.00 0.00 29.97 29.49 2w54 h ARG 222 CO 0.28 0.75 0.18 -0.98 2.80 0.00 0.00 179.97 183.00 2w54 s ARG 223 N -2.36 1.10 0.12 0.20 1.70 -1.26 -4.45 118.95 114.00 2w54 s ARG 223 Ca -0.15 0.07 0.07 0.00 -0.47 0.00 0.00 55.73 55.25 2w54 s ARG 223 Cb -0.02 0.51 -0.04 0.00 -0.57 0.00 0.00 34.95 34.83 2w54 s ARG 223 CO 0.57 -0.38 -0.08 -1.64 -1.08 0.00 0.00 175.30 172.69 2w54 s MET 224 N -1.82 2.16 -0.69 3.89 -1.94 -0.30 -4.72 119.30 115.88 2w54 s MET 224 Ca -0.08 -1.07 -0.05 0.00 -1.71 0.00 0.00 55.69 52.78 2w54 s MET 224 Cb -0.00 -2.30 -0.01 0.00 2.01 0.00 0.00 34.83 34.53 2w54 s MET 224 CO 0.04 0.49 2.89 0.41 -0.01 0.00 0.00 175.02 178.84 2w54 n GLY 225 N 0.49 4.25 0.00 -0.03 0.00 -1.26 -4.47 105.19 104.16 2w54 n GLY 225 Ca -0.12 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.16 2w54 n GLY 225 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w54 n GLY 226 N 1.73 -0.46 1.58 -0.02 0.00 -1.16 -2.68 105.19 104.18 2w54 n GLY 226 Ca 0.54 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 45.13 2w54 n GLY 226 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w54 n GLY 227 N 0.34 -0.04 2.30 -0.02 0.00 -1.26 -4.82 105.19 101.68 2w54 n GLY 227 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 2w54 n GLY 227 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2w54 n PHE 228 N -2.87 -0.26 0.00 1.61 3.01 -1.26 -0.07 117.46 117.62 2w54 n PHE 228 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 2w54 n PHE 228 Cb 0.17 -3.03 0.00 0.00 -0.01 0.00 0.00 39.48 36.62 2w54 n PHE 228 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2w54 n GLY 229 N -0.35 2.00 0.22 1.37 0.00 -1.26 -1.29 105.19 105.88 2w54 n GLY 229 Ca -0.17 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.98 2w54 n GLY 229 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w54 n GLY 230 N -1.99 -0.52 0.19 -0.02 0.00 0.90 -3.10 105.19 100.65 2w54 n GLY 230 Ca 0.00 -0.28 0.06 0.00 0.00 0.00 0.00 46.02 45.80 2w54 n GLY 230 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2w54 n LYS 231 N -0.41 0.95 0.02 1.61 5.02 -1.24 -4.28 118.16 119.82 2w54 n LYS 231 Ca 0.19 -2.01 -0.15 0.00 -2.02 0.00 0.00 58.31 54.32 2w54 n LYS 231 Cb 0.20 -1.15 -0.05 0.00 -0.02 0.00 0.00 35.03 34.01 2w54 n LYS 231 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 2w54 h GLU 232 N 0.00 0.62 0.00 1.97 4.81 -1.89 0.14 114.58 120.23 2w54 h GLU 232 Ca 0.00 -0.55 0.00 0.00 -0.13 0.00 0.00 59.36 58.68 2w54 h GLU 232 Cb 1.10 0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.61 2w54 h GLU 232 CO 0.00 1.17 -0.18 -1.13 -0.73 0.00 0.00 179.01 178.15 2w54 n SER 233 N -3.87 0.88 0.16 1.04 3.41 -1.26 -4.51 113.62 109.47 2w54 n SER 233 Ca -0.07 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.67 2w54 n SER 233 Cb 0.77 0.15 0.53 0.00 -0.26 0.00 0.00 64.21 65.40 2w54 n SER 233 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 2w54 h GLN 234 N 0.00 0.00 -0.71 4.33 1.08 -1.81 -2.80 115.11 115.20 2w54 h GLN 234 Ca 0.00 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.15 2w54 h GLN 234 Cb 0.06 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.46 2w54 h GLN 234 CO 0.00 0.00 0.22 0.78 -0.95 0.00 0.00 178.83 178.88 2w54 h GLY 235 N 2.32 1.16 -0.77 3.46 0.00 -1.81 -3.34 103.07 104.09 2w54 h GLY 235 Ca 0.00 -0.67 0.11 0.00 0.00 0.00 0.00 47.33 46.77 2w54 h GLY 235 CO 0.00 0.63 -0.45 3.43 0.00 0.00 0.00 176.54 180.15 2w54 h ASN 236 N 1.04 -1.61 -0.93 0.19 -0.26 -1.82 -1.93 115.58 110.26 2w54 h ASN 236 Ca 0.23 0.28 0.19 0.00 -0.56 0.00 0.00 56.30 56.45 2w54 h ASN 236 Cb 0.29 0.76 -0.18 0.00 -1.06 0.00 0.00 38.32 38.13 2w54 h ASN 236 CO -0.01 -0.30 -0.20 0.45 -1.06 0.00 0.00 177.43 176.31 2w54 h HIS 237 N -0.10 -0.44 -0.20 1.19 3.86 -1.80 0.24 115.15 117.89 2w54 h HIS 237 Ca 0.23 0.08 -0.11 0.00 -1.16 0.00 0.00 60.37 59.41 2w54 h HIS 237 Cb 0.54 0.34 -0.00 0.00 1.06 0.00 0.00 27.41 29.35 2w54 h HIS 237 CO -0.83 -0.40 -0.32 -0.07 0.86 0.00 0.00 177.93 177.17 2w54 h LEU 238 N 0.00 0.63 -0.41 2.43 4.07 -1.59 -1.96 115.31 118.49 2w54 h LEU 238 Ca 0.46 -0.53 -0.01 0.00 0.08 0.00 0.00 57.88 57.88 2w54 h LEU 238 Cb 0.73 -0.18 -0.02 0.00 1.08 0.00 0.00 40.66 42.27 2w54 h LEU 238 CO -0.95 1.04 0.21 0.00 -1.08 0.00 0.00 178.44 177.66 2w54 h ALA 239 N 0.61 0.52 -0.18 1.53 0.00 -1.16 -0.78 119.26 119.81 2w54 h ALA 239 Ca 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2w54 h ALA 239 Cb 0.91 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2w54 h ALA 239 CO 0.07 0.06 0.11 0.82 0.00 0.00 0.00 179.25 180.32 2w54 h ILE 240 N 0.52 1.06 -0.57 0.00 2.04 -1.03 -0.58 117.51 118.96 2w54 h ILE 240 Ca 0.14 -0.13 0.06 0.00 1.00 0.00 0.00 64.86 65.93 2w54 h ILE 240 Cb 0.08 0.83 -0.05 0.00 -0.74 0.00 0.00 36.82 36.94 2w54 h ILE 240 CO -0.02 0.06 0.28 0.00 0.00 0.00 0.00 178.15 178.47 2w54 h ALA 241 N 1.04 0.74 0.21 1.87 0.00 -1.14 -0.71 119.26 121.27 2w54 h ALA 241 Ca 0.06 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2w54 h ALA 241 Cb -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2w54 h ALA 241 CO -0.01 -0.08 -0.10 0.00 0.00 0.00 0.00 179.25 179.06 2w54 h ALA 243 N 0.27 1.15 -0.05 0.00 0.00 -0.93 0.33 119.26 120.03 2w54 h ALA 243 Ca -0.03 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2w54 h ALA 243 Cb 0.36 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 2w54 h ALA 243 CO 0.05 0.17 0.02 0.28 0.00 0.00 0.00 179.25 179.77 2w54 h VAL 244 N 0.85 1.12 -0.21 0.00 2.07 -1.06 -1.41 116.25 117.61 2w54 h VAL 244 Ca 0.38 -0.34 -0.16 0.00 0.82 0.00 0.00 66.70 67.39 2w54 h VAL 244 Cb 0.27 1.25 -0.00 0.00 -1.52 0.00 0.00 31.29 31.28 2w54 h VAL 244 CO -0.21 0.10 -0.54 0.00 0.02 0.00 0.00 177.57 176.93 2w54 h ALA 245 N 0.89 0.66 -0.31 1.67 0.00 -0.76 -1.93 119.26 119.49 2w54 h ALA 245 Ca 0.02 -0.51 -0.03 0.00 0.00 0.00 0.00 54.91 54.39 2w54 h ALA 245 Cb 0.13 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2w54 h ALA 245 CO -0.00 0.69 0.09 0.00 0.00 0.00 0.00 179.25 180.02 2w54 h ALA 246 N 0.92 0.40 -0.50 0.00 0.00 -0.36 -0.17 119.26 119.55 2w54 h ALA 246 Ca 0.01 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 54.79 2w54 h ALA 246 Cb 1.10 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.73 2w54 h ALA 246 CO 0.11 0.05 0.27 -0.09 0.00 0.00 0.00 179.25 179.59 2w54 h ARG 247 N 0.34 0.51 0.06 0.00 2.43 -1.12 0.42 114.38 117.02 2w54 h ARG 247 Ca 0.10 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.23 2w54 h ARG 247 Cb 0.27 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 2w54 h ARG 247 CO -0.00 0.34 -0.03 0.00 -1.51 0.00 0.00 179.97 178.77 2w54 h ALA 248 N 1.26 -0.08 0.00 2.80 0.00 -1.24 -3.27 119.26 118.72 2w54 h ALA 248 Ca 0.22 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2w54 h ALA 248 Cb 0.10 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2w54 h ALA 248 CO -0.14 -0.35 -0.05 1.79 0.00 0.00 0.00 179.25 180.51 2w54 h THR 249 N -0.48 0.00 0.00 0.00 1.35 -0.99 -3.47 112.91 109.32 2w54 h THR 249 Ca -0.01 -0.86 0.00 0.00 -0.55 0.00 0.00 66.41 65.00 2w54 h THR 249 Cb 0.42 1.83 0.00 0.00 -1.73 0.00 0.00 68.15 68.67 2w54 h THR 249 CO 0.01 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.89 2w54 n GLY 250 N 1.16 0.60 3.17 5.82 0.00 0.15 -5.01 105.19 111.07 2w54 n GLY 250 Ca 0.04 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.96 2w54 n GLY 250 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2w54 s ARG 251 N -0.05 0.89 0.48 1.61 1.70 -1.17 -4.95 118.95 117.47 2w54 s ARG 251 Ca 0.00 -1.39 -0.24 0.00 -0.47 0.00 0.00 55.73 53.63 2w54 s ARG 251 Cb 0.00 -0.07 -0.08 0.00 -0.57 0.00 0.00 34.95 34.24 2w54 s ARG 251 CO 0.00 -0.11 1.30 -2.30 -1.08 0.00 0.00 175.30 173.10 2w54 n PRO 252 N -0.08 1.82 -3.90 3.89 -0.02 -1.26 -4.31 135.00 131.13 2w54 n PRO 252 Ca -0.10 0.66 -0.25 0.00 -2.02 0.00 0.00 63.50 61.79 2w54 n PRO 252 Cb 0.62 -2.46 -0.17 0.00 -0.02 0.00 0.00 33.50 31.46 2w54 n PRO 252 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2w54 s LYS 254 N 1.72 2.91 -0.08 0.00 2.20 0.20 -0.06 119.74 126.63 2w54 s LYS 254 Ca 0.03 -0.52 -0.04 0.00 -0.36 0.00 0.00 55.97 55.09 2w54 s LYS 254 Cb -0.13 -2.75 0.04 0.00 -1.51 0.00 0.00 37.83 33.48 2w54 s LYS 254 CO -0.06 0.65 0.18 1.41 -0.36 0.00 0.00 175.35 177.17 2w54 s MET 255 N -1.42 0.11 -0.03 4.03 1.75 0.36 -1.56 119.30 122.54 2w54 s MET 255 Ca 0.19 0.49 0.01 0.00 -1.25 0.00 0.00 55.69 55.12 2w54 s MET 255 Cb -0.12 -0.18 0.02 0.00 2.84 0.00 0.00 34.83 37.39 2w54 s MET 255 CO 0.09 -0.21 -0.03 -0.98 -0.65 0.00 0.00 175.02 173.24 2w54 s ARG 256 N 1.57 0.52 0.31 4.11 1.70 -1.26 -0.82 118.95 125.08 2w54 s ARG 256 Ca -0.05 -0.07 -0.29 0.00 -0.47 0.00 0.00 55.73 54.85 2w54 s ARG 256 Cb -0.11 -0.58 -0.10 0.00 -0.57 0.00 0.00 34.95 33.59 2w54 s ARG 256 CO -0.07 -0.04 1.28 0.71 -1.08 0.00 0.00 175.30 176.11 2w54 s TYR 257 N 0.62 3.14 0.43 5.89 4.12 -0.80 -5.00 117.35 125.75 2w54 s TYR 257 Ca -0.07 1.42 -0.23 0.00 0.02 0.00 0.00 57.07 58.21 2w54 s TYR 257 Cb -0.10 -3.62 -0.08 0.00 -1.52 0.00 0.00 41.96 36.63 2w54 s TYR 257 CO -0.01 -1.71 1.07 0.34 0.02 0.00 0.00 175.55 175.27 2w54 s ASP 258 N -0.42 6.53 0.41 2.29 -1.08 -1.26 -4.70 116.67 118.43 2w54 s ASP 258 Ca 0.49 2.06 0.19 0.00 -0.52 0.00 0.00 52.55 54.78 2w54 s ASP 258 Cb -0.38 -2.58 1.12 0.00 -1.46 0.00 0.00 42.92 39.61 2w54 s ASP 258 CO 0.49 -0.66 1.79 -0.09 0.52 0.00 0.00 175.17 177.23 2w54 h ARG 259 N 2.16 0.37 -0.38 4.34 9.65 -1.95 0.57 114.38 129.14 2w54 h ARG 259 Ca -0.49 -0.02 -0.16 0.00 -1.10 0.00 0.00 59.98 58.21 2w54 h ARG 259 Cb 1.22 -0.08 -0.01 0.00 -1.39 0.00 0.00 29.97 29.71 2w54 h ARG 259 CO 0.61 0.25 -0.39 -0.44 2.80 0.00 0.00 179.97 182.79 2w54 h ASP 260 N 0.38 1.00 -0.02 -3.80 3.45 -1.92 -2.80 116.42 112.72 2w54 h ASP 260 Ca 0.56 -0.46 -0.00 0.00 0.43 0.00 0.00 57.03 57.55 2w54 h ASP 260 Cb 1.46 -0.28 -0.00 0.00 -0.56 0.00 0.00 39.33 39.94 2w54 h ASP 260 CO -0.25 1.26 -0.01 0.44 -1.57 0.00 0.00 179.24 179.12 2w54 h ASP 261 N 0.76 0.04 -0.75 6.45 3.32 -1.11 -3.06 116.42 122.08 2w54 h ASP 261 Ca 0.06 -0.38 0.10 0.00 0.02 0.00 0.00 57.03 56.83 2w54 h ASP 261 Cb 0.99 -0.01 -0.12 0.00 0.22 0.00 0.00 39.33 40.41 2w54 h ASP 261 CO 0.10 0.42 -0.45 -0.78 -1.72 0.00 0.00 179.24 176.80 2w54 h ASP 262 N -0.34 -1.59 0.24 6.45 -0.00 0.04 0.35 116.42 121.58 2w54 h ASP 262 Ca 0.00 0.28 -0.12 0.00 -0.00 0.00 0.00 57.03 57.19 2w54 h ASP 262 Cb 0.40 0.74 -0.01 0.00 -0.00 0.00 0.00 39.33 40.46 2w54 h ASP 262 CO 0.00 -0.31 -0.45 0.24 -0.00 0.00 0.00 179.24 178.73 2w54 h MET 263 N -0.13 0.26 -0.13 0.28 2.86 -1.58 -1.13 114.93 115.35 2w54 h MET 263 Ca 0.22 -0.13 -0.23 0.00 -2.06 0.00 0.00 59.70 57.49 2w54 h MET 263 Cb 0.55 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.22 2w54 h MET 263 CO -0.80 0.66 -0.83 0.28 1.06 0.00 0.00 176.91 177.28 2w54 h VAL 264 N 0.21 1.28 0.00 -2.22 2.07 -1.07 -3.37 116.25 113.15 2w54 h VAL 264 Ca 0.01 -2.02 -0.00 0.00 0.82 0.00 0.00 66.70 65.51 2w54 h VAL 264 Cb 0.88 2.05 -0.00 0.00 -1.52 0.00 0.00 31.29 32.70 2w54 h VAL 264 CO 0.07 0.64 -0.02 0.40 0.02 0.00 0.00 177.57 178.68 2w54 h ILE 265 N 0.52 1.52 -4.15 4.57 2.04 -0.26 -3.43 117.51 118.31 2w54 h ILE 265 Ca -0.07 -2.14 -0.49 0.00 1.00 0.00 0.00 64.86 63.16 2w54 h ILE 265 Cb 1.46 2.87 0.06 0.00 -0.74 0.00 0.00 36.82 40.48 2w54 h ILE 265 CO 0.17 0.51 0.33 0.42 0.00 0.00 0.00 178.15 179.58 2w54 s THR 266 N -2.12 4.06 0.96 -0.27 -4.23 -0.44 -4.77 115.64 108.83 2w54 s THR 266 Ca -0.16 0.46 -0.16 0.00 -1.18 0.00 0.00 61.69 60.64 2w54 s THR 266 Cb -0.02 -3.64 0.22 0.00 1.34 0.00 0.00 72.50 70.40 2w54 s THR 266 CO 0.59 -0.78 1.23 0.61 -0.54 0.00 0.00 174.62 175.73 2w54 n GLY 267 N -2.75 -1.67 3.29 3.99 0.00 -1.26 -4.79 105.19 102.00 2w54 n GLY 267 Ca 0.05 -1.68 -0.19 0.00 0.00 0.00 0.00 46.02 44.21 2w54 n GLY 267 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w54 s LYS 268 N -5.70 1.69 0.31 1.61 1.02 -1.26 -4.78 119.74 112.63 2w54 s LYS 268 Ca 0.71 -1.97 -0.29 0.00 0.02 0.00 0.00 55.97 54.43 2w54 s LYS 268 Cb -0.03 0.26 -0.11 0.00 -0.52 0.00 0.00 37.83 37.44 2w54 s LYS 268 CO 0.50 -0.60 1.52 0.50 -0.92 0.00 0.00 175.35 176.35 2w54 s ARG 269 N -3.56 4.15 -0.03 1.68 3.52 0.07 -1.01 118.95 123.77 2w54 s ARG 269 Ca 0.40 2.51 -0.30 0.00 -0.13 0.00 0.00 55.73 58.21 2w54 s ARG 269 Cb 0.03 -3.02 -0.07 0.00 -1.56 0.00 0.00 34.95 30.32 2w54 s ARG 269 CO 0.25 -0.55 1.96 -1.01 -0.81 0.00 0.00 175.30 175.14 2w54 s HIS 270 N -0.40 1.38 0.33 5.12 3.76 -1.26 -3.65 115.29 120.57 2w54 s HIS 270 Ca 0.59 -0.16 -0.26 0.00 -0.15 0.00 0.00 55.06 55.07 2w54 s HIS 270 Cb -0.46 -4.14 -0.10 0.00 1.11 0.00 0.00 32.58 28.99 2w54 s HIS 270 CO 0.52 -4.99 0.96 0.16 -0.85 0.00 0.00 174.74 170.54 2w54 s ASP 271 N 4.97 7.29 0.17 1.40 -4.77 -1.26 -4.68 116.67 119.79 2w54 s ASP 271 Ca 0.88 1.87 0.10 0.00 -3.30 0.00 0.00 52.55 52.10 2w54 s ASP 271 Cb -0.39 -2.58 -0.04 0.00 -1.09 0.00 0.00 42.92 38.82 2w54 s ASP 271 CO 0.38 -0.11 -0.21 -0.36 0.70 0.00 0.00 175.17 175.57 2w54 s PHE 272 N -1.60 2.07 -0.17 2.11 0.08 0.33 -1.70 117.98 119.11 2w54 s PHE 272 Ca 0.51 -0.41 -0.00 0.00 0.12 0.00 0.00 56.93 57.15 2w54 s PHE 272 Cb -0.19 -1.03 0.00 0.00 -0.57 0.00 0.00 43.02 41.22 2w54 s PHE 272 CO 0.25 0.41 -0.15 0.50 -0.10 0.00 0.00 175.22 176.13 2w54 s ARG 273 N -2.66 3.18 -0.27 0.44 3.52 -0.15 -0.45 118.95 122.56 2w54 s ARG 273 Ca 0.18 -0.76 0.02 0.00 -0.13 0.00 0.00 55.73 55.04 2w54 s ARG 273 Cb -0.07 -2.66 0.06 0.00 -1.56 0.00 0.00 34.95 30.72 2w54 s ARG 273 CO 0.08 -0.07 -0.08 0.42 -0.81 0.00 0.00 175.30 174.84 2w54 s ILE 274 N 1.01 2.36 -0.15 4.11 1.01 -0.89 -1.24 121.20 127.41 2w54 s ILE 274 Ca -0.02 -1.60 -0.11 0.00 0.00 0.00 0.00 60.65 58.93 2w54 s ILE 274 Cb -0.15 -2.39 -0.05 0.00 0.01 0.00 0.00 42.46 39.89 2w54 s ILE 274 CO -0.03 -0.06 0.21 -0.60 0.00 0.00 0.00 174.94 174.45 2w54 s ARG 275 N 1.13 3.97 0.07 2.79 3.52 -0.79 -2.19 118.95 127.45 2w54 s ARG 275 Ca -0.08 -0.04 0.02 0.00 -0.13 0.00 0.00 55.73 55.50 2w54 s ARG 275 Cb -0.20 -3.34 -0.03 0.00 -1.56 0.00 0.00 34.95 29.82 2w54 s ARG 275 CO -0.04 0.46 -0.07 1.52 -0.81 0.00 0.00 175.30 176.36 2w54 s TYR 276 N -0.14 0.75 -0.14 5.12 -0.85 0.08 -0.10 117.35 122.07 2w54 s TYR 276 Ca 0.14 -0.74 -0.04 0.00 -0.52 0.00 0.00 57.07 55.91 2w54 s TYR 276 Cb -0.12 -0.45 0.05 0.00 0.38 0.00 0.00 41.96 41.82 2w54 s TYR 276 CO 0.03 -0.14 0.09 1.03 -1.52 0.00 0.00 175.55 175.04 2w54 s ARG 277 N -2.84 0.03 0.03 -3.49 0.52 0.06 -1.99 118.95 111.27 2w54 s ARG 277 Ca 0.02 0.07 0.08 0.00 -0.52 0.00 0.00 55.73 55.37 2w54 s ARG 277 Cb -0.01 -1.43 -0.02 0.00 0.52 0.00 0.00 34.95 34.00 2w54 s ARG 277 CO -0.03 -0.58 -0.23 -1.50 0.02 0.00 0.00 175.30 172.99 2w54 s ILE 278 N 2.16 1.82 0.02 1.52 2.07 -0.53 -0.51 121.20 127.75 2w54 s ILE 278 Ca 0.03 -1.18 0.01 0.00 -1.41 0.00 0.00 60.65 58.10 2w54 s ILE 278 Cb -0.15 -1.56 -0.02 0.00 0.13 0.00 0.00 42.46 40.87 2w54 s ILE 278 CO -0.08 0.33 -0.05 -0.83 -1.91 0.00 0.00 174.94 172.41 2w54 s GLY 279 N -1.01 0.31 0.22 1.50 0.00 -0.36 -0.06 107.32 107.92 2w54 s GLY 279 Ca 0.09 -0.51 -0.00 0.00 0.00 0.00 0.00 44.72 44.30 2w54 s GLY 279 CO 0.01 -0.54 0.12 0.00 0.00 0.00 0.00 173.10 172.69 2w54 s ALA 280 N -0.98 1.38 0.64 3.20 0.00 -0.02 -0.76 121.76 125.22 2w54 s ALA 280 Ca -0.08 -1.76 0.04 0.00 0.00 0.00 0.00 51.96 50.15 2w54 s ALA 280 Cb -0.07 1.27 0.11 0.00 0.00 0.00 0.00 23.12 24.44 2w54 s ALA 280 CO -0.00 -0.55 0.85 -0.40 0.00 0.00 0.00 175.76 175.66 2w54 n ASP 281 N -0.37 1.54 -0.22 0.00 5.68 -0.34 -1.25 116.55 121.58 2w54 n ASP 281 Ca 0.01 -2.20 0.02 0.00 -0.50 0.00 0.00 54.79 52.12 2w54 n ASP 281 Cb 0.66 -0.51 0.14 0.00 -1.14 0.00 0.00 41.12 40.27 2w54 n ASP 281 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2w54 h ALA 282 N -0.29 0.86 0.00 2.12 0.00 -1.91 -1.28 119.26 118.76 2w54 h ALA 282 Ca -0.28 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 2w54 h ALA 282 Cb 1.14 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 2w54 h ALA 282 CO 0.34 -0.23 -0.02 0.66 0.00 0.00 0.00 179.25 179.99 2w54 h SER 283 N 0.37 0.00 0.00 0.00 4.64 -2.03 -3.47 113.55 113.07 2w54 h SER 283 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 2w54 h SER 283 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2w54 h SER 283 CO -0.37 0.02 0.00 0.61 -0.87 0.00 0.00 176.83 176.22 2w54 n GLY 284 N 0.19 1.20 3.79 -0.77 0.00 -0.48 -5.10 105.19 104.03 2w54 n GLY 284 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 2w54 n GLY 284 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w54 s LYS 285 N -0.20 4.15 0.21 1.61 -0.14 -1.26 -4.80 119.74 119.30 2w54 s LYS 285 Ca 0.00 0.57 -0.31 0.00 -1.36 0.00 0.00 55.97 54.87 2w54 s LYS 285 Cb 0.00 -3.29 -0.11 0.00 -1.68 0.00 0.00 37.83 32.76 2w54 s LYS 285 CO 0.00 0.52 1.58 -0.51 -0.76 0.00 0.00 175.35 176.18 2w54 s LEU 286 N -0.61 4.37 -0.21 3.17 1.43 -1.26 -1.20 118.68 124.36 2w54 s LEU 286 Ca 0.27 2.73 0.09 0.00 -1.03 0.00 0.00 54.13 56.19 2w54 s LEU 286 Cb -0.17 -3.61 -0.19 0.00 0.03 0.00 0.00 46.19 42.25 2w54 s LEU 286 CO 0.15 -0.85 -0.07 0.18 0.23 0.00 0.00 176.35 176.00 2w54 n LEU 287 N 3.39 1.45 -3.55 1.79 4.77 0.06 -4.44 117.00 120.46 2w54 n LEU 287 Ca 0.12 -0.06 -0.06 0.00 -0.03 0.00 0.00 56.01 55.97 2w54 n LEU 287 Cb 0.38 -0.17 -0.02 0.00 -2.33 0.00 0.00 43.42 41.28 2w54 n LEU 287 CO 0.62 0.67 0.86 -0.83 -1.33 0.00 0.00 177.39 177.38 2w54 s GLY 288 N -5.76 -0.36 -0.17 -0.72 0.00 -1.12 -3.01 107.32 96.18 2w54 s GLY 288 Ca -0.20 1.37 -0.07 0.00 0.00 0.00 0.00 44.72 45.82 2w54 s GLY 288 CO 0.65 0.47 0.37 0.00 0.00 0.00 0.00 173.10 174.60 2w54 s ALA 289 N -2.66 -0.96 -0.21 3.20 0.00 0.23 -1.23 121.76 120.14 2w54 s ALA 289 Ca 0.07 1.38 0.01 0.00 0.00 0.00 0.00 51.96 53.41 2w54 s ALA 289 Cb -0.01 -1.04 0.03 0.00 0.00 0.00 0.00 23.12 22.09 2w54 s ALA 289 CO -0.06 -0.48 -0.14 0.34 0.00 0.00 0.00 175.76 175.42 2w54 s ASP 290 N 1.94 3.74 0.00 0.00 2.15 0.33 -1.43 116.67 123.41 2w54 s ASP 290 Ca -0.05 -0.84 0.04 0.00 0.43 0.00 0.00 52.55 52.13 2w54 s ASP 290 Cb -0.10 -1.55 -0.03 0.00 -0.30 0.00 0.00 42.92 40.93 2w54 s ASP 290 CO -0.12 -0.07 -0.12 -0.36 -0.17 0.00 0.00 175.17 174.34 2w54 s PHE 291 N 1.27 2.75 -0.16 -5.34 0.40 0.42 -0.76 117.98 116.56 2w54 s PHE 291 Ca 0.01 -0.13 0.01 0.00 -0.60 0.00 0.00 56.93 56.22 2w54 s PHE 291 Cb -0.15 -1.57 0.02 0.00 0.51 0.00 0.00 43.02 41.83 2w54 s PHE 291 CO -0.09 0.30 -0.18 0.08 0.70 0.00 0.00 175.22 176.04 2w54 s VAL 292 N -0.92 1.83 -0.23 -0.44 1.01 0.86 -1.58 120.40 120.92 2w54 s VAL 292 Ca 0.15 -0.80 -0.08 0.00 0.00 0.00 0.00 61.98 61.25 2w54 s VAL 292 Cb -0.11 -1.67 -0.04 0.00 0.00 0.00 0.00 36.38 34.56 2w54 s VAL 292 CO 0.05 0.50 0.09 -1.00 0.00 0.00 0.00 175.10 174.75 2w54 s HIS 293 N 1.31 3.16 -0.34 5.22 3.76 0.10 -1.89 115.29 126.61 2w54 s HIS 293 Ca 0.03 -0.15 -0.00 0.00 -0.15 0.00 0.00 55.06 54.79 2w54 s HIS 293 Cb -0.13 -2.21 0.08 0.00 1.11 0.00 0.00 32.58 31.43 2w54 s HIS 293 CO -0.11 -0.15 0.07 -0.51 -0.85 0.00 0.00 174.74 173.20 2w54 s LEU 294 N 1.22 4.54 -0.16 0.89 1.43 -0.38 0.29 118.68 126.52 2w54 s LEU 294 Ca 0.05 -1.77 -0.07 0.00 -1.03 0.00 0.00 54.13 51.31 2w54 s LEU 294 Cb -0.14 -1.72 -0.04 0.00 0.03 0.00 0.00 46.19 44.32 2w54 s LEU 294 CO 0.04 -0.38 0.08 0.00 0.23 0.00 0.00 176.35 176.32 2w54 s ALA 295 N 1.11 3.54 -0.22 4.21 0.00 -0.29 -0.98 121.76 129.13 2w54 s ALA 295 Ca 0.03 -0.72 -0.24 0.00 0.00 0.00 0.00 51.96 51.04 2w54 s ALA 295 Cb -0.21 -1.91 -0.01 0.00 0.00 0.00 0.00 23.12 20.99 2w54 s ALA 295 CO -0.04 0.33 0.77 0.50 0.00 0.00 0.00 175.76 177.32 2w54 s ARG 296 N -0.11 4.20 -0.01 0.00 3.52 -0.69 -1.26 118.95 124.60 2w54 s ARG 296 Ca 0.08 0.85 0.11 0.00 -0.13 0.00 0.00 55.73 56.64 2w54 s ARG 296 Cb -0.12 -3.62 -0.16 0.00 -1.56 0.00 0.00 34.95 29.49 2w54 s ARG 296 CO 0.01 -0.42 0.29 0.00 -0.81 0.00 0.00 175.30 174.37 2w54 n GLY 298 N 1.73 -2.09 0.24 0.00 0.00 -1.25 -1.00 105.19 102.81 2w54 n GLY 298 Ca -0.01 -1.62 0.10 0.00 0.00 0.00 0.00 46.02 44.49 2w54 n GLY 298 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 2w54 h TRP 299 N 0.00 0.00 -3.87 1.61 5.08 0.27 -2.74 115.95 116.30 2w54 h TRP 299 Ca 0.00 0.00 -0.36 0.00 1.08 0.00 0.00 58.89 59.61 2w54 h TRP 299 Cb 0.00 0.00 -0.20 0.00 -3.00 0.00 0.00 29.16 25.96 2w54 h TRP 299 CO 0.00 0.19 -0.76 0.45 -1.28 0.00 0.00 178.44 177.04 2w54 s SER 300 N -6.30 1.48 0.14 0.11 0.15 -1.26 -4.90 113.70 103.12 2w54 s SER 300 Ca -0.02 -0.67 -0.19 0.00 0.70 0.00 0.00 55.95 55.78 2w54 s SER 300 Cb 0.13 -0.02 0.01 0.00 -1.71 0.00 0.00 66.02 64.43 2w54 s SER 300 CO 0.62 -0.15 1.70 0.00 1.20 0.00 0.00 173.24 176.61 2w54 h ALA 301 N 4.10 0.20 -0.39 5.45 0.00 -1.88 -3.43 119.26 123.31 2w54 h ALA 301 Ca -0.39 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2w54 h ALA 301 Cb 1.19 0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.14 2w54 h ALA 301 CO 0.44 -0.44 0.00 -3.47 0.00 0.00 0.00 179.25 175.78 2w54 n ASP 302 N -5.19 0.00 -0.73 0.00 -0.08 -1.26 -1.28 116.55 108.02 2w54 n ASP 302 Ca -0.01 0.00 0.03 0.00 -1.51 0.00 0.00 54.79 53.30 2w54 n ASP 302 Cb 0.14 0.00 0.20 0.00 2.34 0.00 0.00 41.12 43.80 2w54 n ASP 302 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 2w54 n LEU 303 N 0.00 3.21 -0.14 -2.67 4.77 -1.26 -3.56 117.00 117.35 2w54 n LEU 303 Ca 0.00 -3.67 -0.10 0.00 -0.03 0.00 0.00 56.01 52.21 2w54 n LEU 303 Cb 0.00 -0.55 -0.01 0.00 -2.33 0.00 0.00 43.42 40.53 2w54 n LEU 303 CO 0.00 1.20 0.84 0.28 -1.33 0.00 0.00 177.39 178.37 2w54 h SER 304 N 0.91 0.63 0.23 -1.43 0.02 -1.42 -2.78 113.55 109.71 2w54 h SER 304 Ca 0.07 -0.26 0.01 0.00 -0.84 0.00 0.00 61.79 60.77 2w54 h SER 304 Cb 1.25 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 63.59 2w54 h SER 304 CO 0.15 0.73 -0.47 0.25 -1.14 0.00 0.00 176.83 176.34 2w54 h LEU 305 N 0.51 -1.36 -1.19 5.07 6.46 -1.87 -0.78 115.31 122.14 2w54 h LEU 305 Ca 0.12 0.14 -0.06 0.00 -0.12 0.00 0.00 57.88 57.96 2w54 h LEU 305 Cb 0.37 0.49 -0.02 0.00 -0.73 0.00 0.00 40.66 40.77 2w54 h LEU 305 CO 0.01 -0.56 -0.09 1.55 -0.62 0.00 0.00 178.44 178.73 2w54 h PRO 306 N -0.78 0.45 0.21 5.25 0.13 -1.94 -1.51 132.00 133.80 2w54 h PRO 306 Ca -0.01 -0.11 -0.01 0.00 -0.87 0.00 0.00 66.00 65.00 2w54 h PRO 306 Cb 0.75 -0.06 -0.00 0.00 0.13 0.00 0.00 31.00 31.82 2w54 h PRO 306 CO -0.20 0.55 -0.13 0.28 -0.23 0.00 0.00 178.00 178.26 2w54 h VAL 307 N 0.42 0.72 0.00 1.56 2.07 -1.18 -1.48 116.25 118.36 2w54 h VAL 307 Ca 0.08 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.57 2w54 h VAL 307 Cb 0.42 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 2w54 h VAL 307 CO 0.02 0.00 -0.17 0.00 0.02 0.00 0.00 177.57 177.44 2w54 h ASP 309 N 0.00 0.38 -0.02 0.00 3.32 -1.02 -2.51 116.42 116.57 2w54 h ASP 309 Ca -0.00 -0.29 -0.10 0.00 0.02 0.00 0.00 57.03 56.66 2w54 h ASP 309 Cb 0.66 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.10 2w54 h ASP 309 CO 0.02 0.58 -0.27 -0.09 -1.72 0.00 0.00 179.24 177.76 2w54 h ARG 310 N 0.17 0.45 -0.03 3.56 2.43 -0.61 -0.37 114.38 119.98 2w54 h ARG 310 Ca 0.07 -0.17 0.02 0.00 -0.81 0.00 0.00 59.98 59.09 2w54 h ARG 310 Cb 0.37 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.87 2w54 h ARG 310 CO 0.01 0.68 -0.11 0.00 -1.51 0.00 0.00 179.97 179.04 2w54 h ALA 311 N 1.32 -0.10 -0.53 2.80 0.00 -1.02 -1.14 119.26 120.59 2w54 h ALA 311 Ca 0.06 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2w54 h ALA 311 Cb 0.68 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 2w54 h ALA 311 CO 0.05 -0.60 0.28 0.52 0.00 0.00 0.00 179.25 179.51 2w54 h MET 312 N -0.18 0.75 -0.74 0.00 2.86 -1.24 -2.19 114.93 114.20 2w54 h MET 312 Ca 0.05 -0.10 0.17 0.00 -2.06 0.00 0.00 59.70 57.76 2w54 h MET 312 Cb 0.24 -0.14 -0.05 0.00 0.06 0.00 0.00 31.60 31.72 2w54 h MET 312 CO -0.13 0.60 0.50 -0.07 1.06 0.00 0.00 176.91 178.87 2w54 h LEU 313 N 0.71 0.28 -2.21 1.22 4.07 -0.72 -1.83 115.31 116.83 2w54 h LEU 313 Ca 0.19 0.02 0.00 0.00 0.08 0.00 0.00 57.88 58.16 2w54 h LEU 313 Cb 0.07 -0.04 0.00 0.00 1.08 0.00 0.00 40.66 41.78 2w54 h LEU 313 CO -0.03 0.14 0.00 1.41 -1.08 0.00 0.00 178.44 178.88 2w54 n HIS 314 N -4.44 0.36 0.34 1.13 8.25 -0.46 -4.48 115.22 115.91 2w54 n HIS 314 Ca 0.14 -0.19 0.03 0.00 -0.26 0.00 0.00 57.72 57.44 2w54 n HIS 314 Cb 0.61 -0.00 0.18 0.00 1.12 0.00 0.00 29.99 31.89 2w54 n HIS 314 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2w54 n ALA 315 N 1.36 1.53 1.09 -1.41 0.00 -0.69 -0.89 120.51 121.49 2w54 n ALA 315 Ca 0.17 -0.03 0.12 0.00 0.00 0.00 0.00 53.44 53.70 2w54 n ALA 315 Cb 0.57 -1.11 0.32 0.00 0.00 0.00 0.00 19.45 19.23 2w54 n ALA 315 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2w54 n ASP 316 N -1.25 0.62 0.00 0.00 5.75 -1.26 -4.52 116.55 115.88 2w54 n ASP 316 Ca 0.03 -0.40 0.00 0.00 -0.01 0.00 0.00 54.79 54.41 2w54 n ASP 316 Cb 0.05 0.17 0.00 0.00 -1.03 0.00 0.00 41.12 40.31 2w54 n ASP 316 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2w54 n GLY 317 N 1.45 3.60 1.08 6.12 0.00 -0.07 -1.66 105.19 115.71 2w54 n GLY 317 Ca 0.08 -0.02 0.10 0.00 0.00 0.00 0.00 46.02 46.18 2w54 n GLY 317 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2w54 n SER 318 N 5.21 3.45 -4.27 1.61 7.64 -1.26 -4.60 113.62 121.41 2w54 n SER 318 Ca 0.00 -1.96 -0.32 0.00 1.01 0.00 0.00 58.87 57.60 2w54 n SER 318 Cb 0.00 -0.32 -0.16 0.00 -1.01 0.00 0.00 64.21 62.71 2w54 n SER 318 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2w54 s TYR 319 N -1.17 2.45 -0.01 1.43 1.51 -0.66 -3.36 117.35 117.54 2w54 s TYR 319 Ca 0.38 -0.73 -0.30 0.00 -1.01 0.00 0.00 57.07 55.40 2w54 s TYR 319 Cb 0.21 -1.60 -0.06 0.00 -0.11 0.00 0.00 41.96 40.40 2w54 s TYR 319 CO 0.28 -0.22 1.47 0.12 -1.11 0.00 0.00 175.55 176.09 2w54 s PHE 320 N -0.15 2.63 -0.16 2.71 5.36 -0.65 -4.86 117.98 122.86 2w54 s PHE 320 Ca -0.04 0.65 0.00 0.00 -0.96 0.00 0.00 56.93 56.58 2w54 s PHE 320 Cb -0.14 -3.74 0.03 0.00 -0.34 0.00 0.00 43.02 38.83 2w54 s PHE 320 CO 0.04 -2.84 -0.12 0.08 -1.46 0.00 0.00 175.22 170.92 2w54 s VAL 321 N 2.82 1.51 0.23 3.12 1.01 -1.26 -4.77 120.40 123.05 2w54 s VAL 321 Ca 0.66 -0.71 -0.08 0.00 0.00 0.00 0.00 61.98 61.85 2w54 s VAL 321 Cb -0.32 -1.49 0.19 0.00 0.00 0.00 0.00 36.38 34.76 2w54 s VAL 321 CO 0.27 0.34 1.88 -0.65 0.00 0.00 0.00 175.10 176.94 2w54 h PRO 322 N 8.05 1.02 -5.01 2.72 0.11 -1.78 -3.40 132.00 133.71 2w54 h PRO 322 Ca -0.33 -0.06 -0.64 0.00 0.11 0.00 0.00 66.00 65.08 2w54 h PRO 322 Cb 1.12 -0.23 -0.34 0.00 0.11 0.00 0.00 31.00 31.66 2w54 h PRO 322 CO 0.49 0.67 -0.86 0.00 -0.21 0.00 0.00 178.00 178.10 2w54 s ALA 323 N -6.11 2.01 -0.15 -0.75 0.00 -1.16 -4.36 121.76 111.24 2w54 s ALA 323 Ca -0.13 -0.94 -0.06 0.00 0.00 0.00 0.00 51.96 50.83 2w54 s ALA 323 Cb 0.17 -0.92 0.06 0.00 0.00 0.00 0.00 23.12 22.43 2w54 s ALA 323 CO 0.79 -0.04 0.32 -1.17 0.00 0.00 0.00 175.76 175.66 2w54 s LEU 324 N 0.88 -0.16 -0.08 0.00 0.20 -0.32 -0.60 118.68 118.60 2w54 s LEU 324 Ca -0.07 0.72 0.01 0.00 0.69 0.00 0.00 54.13 55.48 2w54 s LEU 324 Cb -0.15 0.98 0.02 0.00 -0.43 0.00 0.00 46.19 46.60 2w54 s LEU 324 CO -0.02 -0.21 -0.09 -0.60 -0.29 0.00 0.00 176.35 175.15 2w54 s ARG 325 N 1.97 1.45 -0.06 1.98 3.52 -0.51 -0.96 118.95 126.34 2w54 s ARG 325 Ca -0.04 -0.28 0.04 0.00 -0.13 0.00 0.00 55.73 55.32 2w54 s ARG 325 Cb -0.11 -1.37 -0.02 0.00 -1.56 0.00 0.00 34.95 31.89 2w54 s ARG 325 CO -0.10 -0.12 -0.16 0.42 -0.81 0.00 0.00 175.30 174.53 2w54 s ILE 326 N 1.18 2.89 -0.25 4.11 1.01 -0.21 -0.43 121.20 129.49 2w54 s ILE 326 Ca -0.05 -0.78 0.01 0.00 0.00 0.00 0.00 60.65 59.83 2w54 s ILE 326 Cb -0.14 -2.13 0.07 0.00 0.01 0.00 0.00 42.46 40.27 2w54 s ILE 326 CO -0.02 0.58 -0.03 -0.70 0.00 0.00 0.00 174.94 174.77 2w54 s GLU 327 N -0.54 1.57 -0.36 2.79 2.12 -0.61 -1.55 118.70 122.12 2w54 s GLU 327 Ca 0.07 -1.12 -0.06 0.00 0.36 0.00 0.00 54.97 54.23 2w54 s GLU 327 Cb -0.11 -2.62 0.06 0.00 0.26 0.00 0.00 34.13 31.71 2w54 s GLU 327 CO 0.01 -0.67 0.13 0.45 -0.54 0.00 0.00 175.26 174.64 2w54 s SER 328 N 1.34 5.31 -0.40 -1.70 0.15 0.64 0.00 113.70 119.04 2w54 s SER 328 Ca -0.03 -1.32 -0.18 0.00 0.70 0.00 0.00 55.95 55.12 2w54 s SER 328 Cb -0.19 -1.86 0.01 0.00 -1.71 0.00 0.00 66.02 62.27 2w54 s SER 328 CO -0.08 -0.38 0.48 -1.00 1.20 0.00 0.00 173.24 173.46 2w54 s HIS 329 N 1.36 3.16 -0.83 3.44 3.76 0.15 -1.60 115.29 124.72 2w54 s HIS 329 Ca -0.00 -0.20 -0.17 0.00 -0.15 0.00 0.00 55.06 54.54 2w54 s HIS 329 Cb -0.21 -2.95 0.15 0.00 1.11 0.00 0.00 32.58 30.68 2w54 s HIS 329 CO 0.01 -0.68 0.93 -0.98 -0.85 0.00 0.00 174.74 173.18 2w54 s ARG 330 N 2.28 3.49 0.12 1.40 3.03 -1.26 -1.13 118.95 126.88 2w54 s ARG 330 Ca 0.15 -1.89 -0.20 0.00 2.03 0.00 0.00 55.73 55.82 2w54 s ARG 330 Cb -0.16 -4.63 -0.07 0.00 -1.03 0.00 0.00 34.95 29.06 2w54 s ARG 330 CO 0.14 -1.58 0.63 -0.51 -1.13 0.00 0.00 175.30 172.85 2w54 s LEU 331 N 1.89 4.49 -0.13 -1.89 1.43 -0.39 -0.10 118.68 123.98 2w54 s LEU 331 Ca 0.24 1.33 -0.16 0.00 -1.03 0.00 0.00 54.13 54.51 2w54 s LEU 331 Cb -0.10 -3.12 -0.04 0.00 0.03 0.00 0.00 46.19 42.95 2w54 s LEU 331 CO -0.06 0.21 0.39 -0.60 0.23 0.00 0.00 176.35 176.52 2w54 s ARG 332 N -1.35 4.27 0.18 1.70 3.52 0.15 -1.45 118.95 125.97 2w54 s ARG 332 Ca 0.33 0.29 0.06 0.00 -0.13 0.00 0.00 55.73 56.28 2w54 s ARG 332 Cb -0.19 -3.41 -0.05 0.00 -1.56 0.00 0.00 34.95 29.74 2w54 s ARG 332 CO 0.21 0.23 -0.11 0.95 -0.81 0.00 0.00 175.30 175.77 2w54 s THR 333 N 0.43 1.39 -0.43 4.11 -4.23 -1.03 -4.57 115.64 111.30 2w54 s THR 333 Ca 0.22 -2.12 -0.06 0.00 -1.18 0.00 0.00 61.69 58.55 2w54 s THR 333 Cb -0.14 -1.99 -0.15 0.00 1.34 0.00 0.00 72.50 71.56 2w54 s THR 333 CO 0.08 -0.63 3.27 0.59 -0.54 0.00 0.00 174.62 177.38 2w54 n ASN 334 N -0.30 6.23 -3.48 3.99 4.13 0.28 -0.42 115.26 125.69 2w54 n ASN 334 Ca -0.09 -2.69 -0.21 0.00 1.68 0.00 0.00 54.58 53.27 2w54 n ASN 334 Cb 0.61 -1.40 -0.06 0.00 -1.54 0.00 0.00 39.78 37.39 2w54 n ASN 334 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 2w54 n THR 335 N 2.28 0.00 -1.60 3.41 -2.24 -1.26 -4.42 114.28 110.46 2w54 n THR 335 Ca 0.51 -2.08 -0.47 0.00 -2.27 0.00 0.00 64.05 59.73 2w54 n THR 335 Cb 0.69 0.79 -0.03 0.00 -2.10 0.00 0.00 70.33 69.68 2w54 n THR 335 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2w54 n GLN 336 N -0.77 1.35 -2.02 -0.78 3.00 -1.26 -1.59 117.38 115.31 2w54 n GLN 336 Ca -0.03 0.48 -0.29 0.00 -0.01 0.00 0.00 57.00 57.15 2w54 n GLN 336 Cb 0.53 -1.97 -0.05 0.00 0.00 0.00 0.00 30.24 28.75 2w54 n GLN 336 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2w54 s SER 337 N -0.07 5.11 0.49 1.08 0.15 -1.26 -3.83 113.70 115.36 2w54 s SER 337 Ca 0.69 -0.42 -0.22 0.00 0.70 0.00 0.00 55.95 56.70 2w54 s SER 337 Cb -0.79 -2.55 -0.08 0.00 -1.71 0.00 0.00 66.02 60.89 2w54 s SER 337 CO 0.53 -2.72 1.03 0.59 1.20 0.00 0.00 173.24 173.88 2w54 n ASN 338 N 13.93 1.30 -0.31 5.45 3.02 -0.17 -4.00 115.26 134.47 2w54 n ASN 338 Ca 0.36 0.96 0.00 0.00 -0.03 0.00 0.00 54.58 55.88 2w54 n ASN 338 Cb 0.48 -1.39 0.00 0.00 -0.61 0.00 0.00 39.78 38.26 2w54 n ASN 338 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 2w54 n THR 339 N -0.89 0.00 -2.12 3.41 5.66 -0.18 -4.33 114.28 115.83 2w54 n THR 339 Ca 0.10 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.70 2w54 n THR 339 Cb 0.42 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.18 2w54 n THR 339 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2w54 s ALA 340 N -2.00 3.50 -0.21 1.79 0.00 -1.26 -4.43 121.76 119.16 2w54 s ALA 340 Ca 0.00 1.25 -0.10 0.00 0.00 0.00 0.00 51.96 53.11 2w54 s ALA 340 Cb 0.00 -3.48 0.08 0.00 0.00 0.00 0.00 23.12 19.72 2w54 s ALA 340 CO 0.00 -0.63 0.48 0.12 0.00 0.00 0.00 175.76 175.73 2w54 s PHE 341 N -1.04 -0.79 0.00 0.00 5.99 -1.26 -3.57 117.98 117.31 2w54 s PHE 341 Ca 0.50 1.58 0.00 0.00 0.00 0.00 0.00 56.93 59.00 2w54 s PHE 341 Cb -0.40 0.38 0.00 0.00 0.00 0.00 0.00 43.02 43.00 2w54 s PHE 341 CO 0.52 -0.44 0.00 -2.13 -0.00 0.00 0.00 175.22 173.17 2w54 n ARG 342 N 4.71 0.00 0.00 10.12 0.63 -0.41 -0.01 116.66 131.69 2w54 n ARG 342 Ca -0.17 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.76 2w54 n ARG 342 Cb 0.54 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.45 2w54 n ARG 342 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2w54 n GLY 343 N 0.00 1.58 3.71 5.14 0.00 -1.26 -4.86 105.19 109.50 2w54 n GLY 343 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 2w54 n GLY 343 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2w54 n PHE 344 N -0.01 -1.90 0.00 1.61 7.35 0.99 -1.04 117.46 124.46 2w54 n PHE 344 Ca 0.00 0.71 0.00 0.00 -0.76 0.00 0.00 57.45 57.40 2w54 n PHE 344 Cb 0.00 -3.96 0.00 0.00 0.35 0.00 0.00 39.48 35.87 2w54 n PHE 344 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2w54 n GLY 345 N -1.66 3.07 0.14 7.13 0.00 -1.26 -4.46 105.19 108.14 2w54 n GLY 345 Ca -0.22 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.73 2w54 n GLY 345 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2w54 h GLY 346 N 0.00 0.28 1.05 -0.02 0.00 -1.28 -2.16 103.07 100.93 2w54 h GLY 346 Ca 0.00 0.05 -0.00 0.00 0.00 0.00 0.00 47.33 47.38 2w54 h GLY 346 CO 0.00 -0.08 0.58 -2.55 0.00 0.00 0.00 176.54 174.50 2w54 h PRO 347 N 0.07 1.26 0.36 4.80 0.11 -1.90 -0.52 132.00 136.17 2w54 h PRO 347 Ca 0.14 -0.10 -0.02 0.00 0.11 0.00 0.00 66.00 66.13 2w54 h PRO 347 Cb 0.20 -0.27 0.00 0.00 0.11 0.00 0.00 31.00 31.04 2w54 h PRO 347 CO -0.26 0.87 -0.17 1.96 -0.21 0.00 0.00 178.00 180.19 2w54 h GLN 348 N 1.29 -0.46 -0.79 1.05 7.50 -1.91 -0.55 115.11 121.25 2w54 h GLN 348 Ca 0.34 0.03 0.08 0.00 0.50 0.00 0.00 58.65 59.60 2w54 h GLN 348 Cb -0.08 0.10 -0.05 0.00 0.05 0.00 0.00 27.48 27.50 2w54 h GLN 348 CO -0.07 -0.26 0.51 0.78 -1.50 0.00 0.00 178.83 178.30 2w54 h GLY 349 N -0.55 1.06 1.36 3.46 0.00 -1.10 -1.45 103.07 105.84 2w54 h GLY 349 Ca -0.05 -0.32 -0.25 0.00 0.00 0.00 0.00 47.33 46.70 2w54 h GLY 349 CO 0.08 0.22 -1.03 0.00 0.00 0.00 0.00 176.54 175.80 2w54 h ALA 350 N 1.59 0.21 -0.08 3.60 0.00 -1.01 -3.14 119.26 120.42 2w54 h ALA 350 Ca 0.35 -0.72 -0.05 0.00 0.00 0.00 0.00 54.91 54.49 2w54 h ALA 350 Cb 0.32 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2w54 h ALA 350 CO -0.13 0.75 -0.18 1.25 0.00 0.00 0.00 179.25 180.94 2w54 h LEU 351 N 0.31 0.11 -0.45 0.00 5.85 -0.56 0.23 115.31 120.80 2w54 h LEU 351 Ca -0.12 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.60 2w54 h LEU 351 Cb 1.68 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 42.65 2w54 h LEU 351 CO 0.19 0.31 0.27 1.23 -0.34 0.00 0.00 178.44 180.10 2w54 h GLY 352 N 0.72 0.63 1.32 3.75 0.00 -1.25 -0.52 103.07 107.73 2w54 h GLY 352 Ca 0.02 -0.20 -0.18 0.00 0.00 0.00 0.00 47.33 46.97 2w54 h GLY 352 CO 0.03 0.18 -0.58 1.98 0.00 0.00 0.00 176.54 178.14 2w54 h MET 353 N 0.54 0.70 -0.43 4.80 1.85 -1.30 -2.77 114.93 118.33 2w54 h MET 353 Ca 0.18 -0.46 -0.09 0.00 -0.61 0.00 0.00 59.70 58.71 2w54 h MET 353 Cb 0.00 0.06 -0.01 0.00 0.43 0.00 0.00 31.60 32.08 2w54 h MET 353 CO -0.08 1.08 -0.09 0.93 -0.40 0.00 0.00 176.91 178.36 2w54 h GLU 354 N 0.53 0.82 -0.63 0.39 4.39 -0.83 -1.26 114.58 117.98 2w54 h GLU 354 Ca 0.00 -0.31 -0.07 0.00 0.34 0.00 0.00 59.36 59.32 2w54 h GLU 354 Cb 1.16 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 29.74 2w54 h GLU 354 CO 0.12 0.93 0.11 -0.09 -1.16 0.00 0.00 179.01 178.92 2w54 h ARG 355 N 0.64 1.02 0.13 2.33 1.12 -1.16 -1.47 114.38 117.00 2w54 h ARG 355 Ca 0.11 -0.25 -0.01 0.00 -1.11 0.00 0.00 59.98 58.72 2w54 h ARG 355 Cb 0.62 -0.13 0.00 0.00 -0.01 0.00 0.00 29.97 30.45 2w54 h ARG 355 CO 0.04 0.93 -0.06 0.00 -3.11 0.00 0.00 179.97 177.76 2w54 h ALA 356 N 1.16 -0.18 0.00 2.80 0.00 -1.29 -0.43 119.26 121.32 2w54 h ALA 356 Ca 0.20 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 2w54 h ALA 356 Cb 0.40 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2w54 h ALA 356 CO 0.01 -0.48 -0.35 0.97 0.00 0.00 0.00 179.25 179.40 2w54 h ILE 357 N -0.43 1.20 -0.00 0.00 2.10 -1.23 -0.72 117.51 118.42 2w54 h ILE 357 Ca -0.02 -1.24 -0.00 0.00 1.08 0.00 0.00 64.86 64.69 2w54 h ILE 357 Cb 0.34 1.68 -0.00 0.00 -1.09 0.00 0.00 36.82 37.75 2w54 h ILE 357 CO 0.03 0.35 0.00 -0.08 -1.08 0.00 0.00 178.15 177.37 2w54 h GLU 358 N 0.00 0.00 -0.73 2.19 4.57 -1.15 -1.10 114.58 118.36 2w54 h GLU 358 Ca -0.00 -0.00 0.05 0.00 -1.18 0.00 0.00 59.36 58.23 2w54 h GLU 358 Cb 0.65 -0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 29.18 2w54 h GLU 358 CO 0.05 0.28 0.43 1.25 -1.18 0.00 0.00 179.01 179.84 2w54 h HIS 359 N -0.28 0.80 -0.63 0.92 2.76 -0.72 -2.12 115.15 115.88 2w54 h HIS 359 Ca 0.00 0.03 -0.08 0.00 -2.20 0.00 0.00 60.37 58.12 2w54 h HIS 359 Cb 0.28 -0.25 -0.03 0.00 1.55 0.00 0.00 27.41 28.96 2w54 h HIS 359 CO 0.02 0.41 0.09 1.25 -1.30 0.00 0.00 177.93 178.40 2w54 h LEU 360 N 0.80 0.98 0.21 0.26 5.85 -1.07 -1.17 115.31 121.17 2w54 h LEU 360 Ca 0.32 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 2w54 h LEU 360 Cb 0.14 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 40.92 2w54 h LEU 360 CO -0.16 0.98 -0.10 0.00 -0.34 0.00 0.00 178.44 178.82 2w54 h ALA 361 N 1.13 -0.29 -0.58 1.25 0.00 -0.69 -2.18 119.26 117.90 2w54 h ALA 361 Ca 0.19 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2w54 h ALA 361 Cb 0.43 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 2w54 h ALA 361 CO 0.01 -0.64 0.27 0.00 0.00 0.00 0.00 179.25 178.89 2w54 h ARG 362 N -0.33 0.82 -0.20 0.00 2.47 -1.32 -0.67 114.38 115.15 2w54 h ARG 362 Ca -0.03 -0.11 0.03 0.00 -1.26 0.00 0.00 59.98 58.61 2w54 h ARG 362 Cb 0.25 -0.16 -0.03 0.00 -1.65 0.00 0.00 29.97 28.39 2w54 h ARG 362 CO 0.05 0.64 0.04 0.78 0.56 0.00 0.00 179.97 182.04 2w54 h GLY 363 N 0.92 0.22 -1.47 0.04 0.00 -1.03 -2.89 103.07 98.87 2w54 h GLY 363 Ca 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.52 2w54 h GLY 363 CO -0.03 -0.00 0.00 1.15 0.00 0.00 0.00 176.54 177.66 2w54 n MET 364 N -5.09 2.03 -3.31 4.80 0.00 -0.84 -4.95 117.12 109.77 2w54 n MET 364 Ca -0.02 -1.57 -0.20 0.00 0.00 0.00 0.00 57.70 55.91 2w54 n MET 364 Cb 0.09 -1.41 0.06 0.00 0.00 0.00 0.00 33.22 31.96 2w54 n MET 364 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2w54 n GLY 365 N 1.26 -0.29 3.42 3.17 0.00 -0.34 -5.03 105.19 107.38 2w54 n GLY 365 Ca 0.17 0.07 -0.29 0.00 0.00 0.00 0.00 46.02 45.97 2w54 n GLY 365 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2w54 s ARG 366 N -5.97 1.50 0.01 1.61 3.52 -0.75 -5.03 118.95 113.84 2w54 s ARG 366 Ca 0.44 -1.34 -0.30 0.00 -0.13 0.00 0.00 55.73 54.40 2w54 s ARG 366 Cb -0.19 -1.94 -0.08 0.00 -1.56 0.00 0.00 34.95 31.18 2w54 s ARG 366 CO 0.55 0.45 1.84 0.34 -0.81 0.00 0.00 175.30 177.67 2w54 s ASP 367 N -2.18 6.53 0.52 -2.12 2.15 -1.26 -4.36 116.67 115.94 2w54 s ASP 367 Ca 0.16 2.52 0.23 0.00 0.43 0.00 0.00 52.55 55.89 2w54 s ASP 367 Cb -0.10 -2.53 1.35 0.00 -0.30 0.00 0.00 42.92 41.34 2w54 s ASP 367 CO 0.07 -1.00 2.02 -0.65 -0.17 0.00 0.00 175.17 175.44 2w54 h PRO 368 N 10.06 0.03 0.00 4.34 0.11 -1.94 0.07 132.00 144.67 2w54 h PRO 368 Ca -0.46 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.59 2w54 h PRO 368 Cb 1.22 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 2w54 h PRO 368 CO 0.94 0.02 -0.30 0.00 -0.21 0.00 0.00 178.00 178.45 2w54 h ALA 369 N 1.77 1.34 0.00 -0.75 0.00 -1.91 -1.96 119.26 117.75 2w54 h ALA 369 Ca 0.22 -0.28 -0.28 0.00 0.00 0.00 0.00 54.91 54.58 2w54 h ALA 369 Cb 0.84 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.54 2w54 h ALA 369 CO -0.01 0.38 -1.67 0.39 0.00 0.00 0.00 179.25 178.34 2w54 n GLU 370 N -3.95 0.63 -0.18 0.00 -0.58 -0.04 -2.38 120.64 114.14 2w54 n GLU 370 Ca -0.02 0.29 -0.09 0.00 -0.42 0.00 0.00 57.16 56.92 2w54 n GLU 370 Cb 0.37 -1.80 0.01 0.00 -0.57 0.00 0.00 31.44 29.45 2w54 n GLU 370 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 2w54 h LEU 371 N 0.00 0.80 -0.34 -4.62 5.85 -1.29 -2.38 115.31 113.33 2w54 h LEU 371 Ca -0.27 -0.27 -0.06 0.00 0.84 0.00 0.00 57.88 58.13 2w54 h LEU 371 Cb 1.96 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 42.77 2w54 h LEU 371 CO 0.08 0.86 -0.01 0.03 -0.34 0.00 0.00 178.44 179.06 2w54 h ARG 372 N 0.71 0.61 -0.97 1.25 3.08 -1.47 -3.01 114.38 114.58 2w54 h ARG 372 Ca 0.15 -0.20 0.11 0.00 0.07 0.00 0.00 59.98 60.12 2w54 h ARG 372 Cb 0.41 -0.05 -0.08 0.00 0.08 0.00 0.00 29.97 30.33 2w54 h ARG 372 CO 0.01 0.73 0.62 0.00 -1.07 0.00 0.00 179.97 180.26 2w54 h ALA 373 N 0.85 1.56 0.00 0.04 0.00 -1.41 -1.64 119.26 118.66 2w54 h ALA 373 Ca 0.10 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2w54 h ALA 373 Cb 0.46 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 2w54 h ALA 373 CO 0.02 0.21 -0.01 1.25 0.00 0.00 0.00 179.25 180.72 2w54 h LEU 374 N 0.97 0.00 -2.51 0.00 5.85 -1.30 -3.32 115.31 115.00 2w54 h LEU 374 Ca 0.47 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.19 2w54 h LEU 374 Cb 0.46 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.49 2w54 h LEU 374 CO -0.23 0.01 0.00 0.59 -0.34 0.00 0.00 178.44 178.47 2w54 n ASN 375 N -3.11 2.01 -4.71 1.25 3.02 -0.64 -4.95 115.26 108.13 2w54 n ASN 375 Ca 0.01 -1.78 -0.31 0.00 -0.03 0.00 0.00 54.58 52.46 2w54 n ASN 375 Cb 0.31 -0.05 0.13 0.00 -0.61 0.00 0.00 39.78 39.56 2w54 n ASN 375 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2w54 s PHE 376 N -0.82 2.01 0.61 3.10 2.99 -1.09 -1.64 117.98 123.14 2w54 s PHE 376 Ca 0.06 1.69 -0.19 0.00 0.00 0.00 0.00 56.93 58.49 2w54 s PHE 376 Cb 0.03 -3.26 -0.03 0.00 0.00 0.00 0.00 43.02 39.77 2w54 s PHE 376 CO 0.04 -2.43 1.27 0.71 -0.00 0.00 0.00 175.22 174.82 2w54 s TYR 377 N -2.64 2.23 0.48 0.36 1.51 -1.21 -4.51 117.35 113.56 2w54 s TYR 377 Ca 0.66 1.48 -0.22 0.00 -1.01 0.00 0.00 57.07 57.98 2w54 s TYR 377 Cb -0.22 -3.63 -0.07 0.00 -0.11 0.00 0.00 41.96 37.93 2w54 s TYR 377 CO 0.55 -2.66 1.18 -0.51 -1.11 0.00 0.00 175.55 173.00 2w54 s ASP 378 N -1.40 5.99 0.46 2.29 1.01 -1.26 -4.79 116.67 118.97 2w54 s ASP 378 Ca 0.79 2.34 -0.22 0.00 0.71 0.00 0.00 52.55 56.17 2w54 s ASP 378 Cb -0.35 -2.60 -0.08 0.00 1.01 0.00 0.00 42.92 40.89 2w54 s ASP 378 CO 0.38 -1.04 1.09 -2.84 0.21 0.00 0.00 175.17 172.97 2w54 s PRO 379 N -2.81 3.85 0.23 8.23 0.02 -1.26 -4.43 135.00 138.82 2w54 s PRO 379 Ca 0.66 1.55 -0.31 0.00 0.02 0.00 0.00 61.00 62.93 2w54 s PRO 379 Cb -0.29 -2.31 -0.15 0.00 0.02 0.00 0.00 34.50 31.77 2w54 s PRO 379 CO 0.35 -0.42 1.15 -0.35 -0.33 0.00 0.00 177.00 177.39 2w54 n PRO 380 N -0.59 1.39 -2.04 5.54 -0.04 -1.26 -4.99 135.00 133.01 2w54 n PRO 380 Ca 0.08 0.49 -0.02 0.00 -0.04 0.00 0.00 63.50 64.00 2w54 n PRO 380 Cb 0.50 -1.97 -0.02 0.00 -0.04 0.00 0.00 33.50 31.97 2w54 n PRO 380 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2w54 n GLU 381 N 1.41 -2.88 -2.86 0.54 4.71 -1.26 -5.11 120.64 115.20 2w54 n GLU 381 Ca 0.12 2.34 -0.01 0.00 -0.01 0.00 0.00 57.16 59.60 2w54 n GLU 381 Cb 0.29 -3.31 -0.01 0.00 -1.01 0.00 0.00 31.44 27.40 2w54 n GLU 381 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2w54 n LYS 398 N 1.04 -2.67 -2.53 3.49 4.01 -1.26 -5.18 118.16 115.07 2w54 n LYS 398 Ca -0.18 2.25 -0.00 0.00 -0.51 0.00 0.00 58.31 59.87 2w54 n LYS 398 Cb 0.27 -3.72 -0.00 0.00 -0.51 0.00 0.00 35.03 31.07 2w54 n LYS 398 CO 0.00 0.00 0.00 0.36 -1.11 0.00 0.00 177.40 176.65 2w54 n LYS 399 N 1.25 -0.88 -3.56 1.97 0.00 -1.26 -5.01 118.16 110.67 2w54 n LYS 399 Ca -0.08 0.78 -0.37 0.00 -0.00 0.00 0.00 58.31 58.63 2w54 n LYS 399 Cb 0.26 -0.89 -0.06 0.00 -0.00 0.00 0.00 35.03 34.33 2w54 n LYS 399 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 2w54 s THR 400 N -0.03 5.21 0.76 0.58 -4.23 -1.26 -5.07 115.64 111.60 2w54 s THR 400 Ca -0.01 0.65 -0.15 0.00 -1.18 0.00 0.00 61.69 61.00 2w54 s THR 400 Cb 0.00 -3.64 0.01 0.00 1.34 0.00 0.00 72.50 70.21 2w54 s THR 400 CO 0.02 0.50 0.85 0.00 -0.54 0.00 0.00 174.62 175.45 2w54 n GLN 401 N 2.56 0.31 -4.41 3.99 6.02 -1.26 -4.79 117.38 119.80 2w54 n GLN 401 Ca -0.14 0.16 -0.26 0.00 -0.01 0.00 0.00 57.00 56.76 2w54 n GLN 401 Cb 0.53 -2.13 -0.11 0.00 1.02 0.00 0.00 30.24 29.55 2w54 n GLN 401 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2w54 s THR 402 N -1.96 2.56 1.16 5.09 -4.23 -1.26 -1.82 115.64 115.17 2w54 s THR 402 Ca 0.70 -2.08 -0.19 0.00 -1.18 0.00 0.00 61.69 58.94 2w54 s THR 402 Cb -0.32 -2.27 0.27 0.00 1.34 0.00 0.00 72.50 71.52 2w54 s THR 402 CO 0.54 -0.21 1.16 0.42 -0.54 0.00 0.00 174.62 175.99 2w54 s THR 403 N -1.94 1.67 -0.40 3.99 -4.23 0.33 -4.84 115.64 110.23 2w54 s THR 403 Ca 0.24 0.00 0.25 0.00 -1.18 0.00 0.00 61.69 61.00 2w54 s THR 403 Cb -0.07 -2.61 0.26 0.00 1.34 0.00 0.00 72.50 71.43 2w54 s THR 403 CO 0.12 0.00 1.74 1.12 -0.54 0.00 0.00 174.62 177.07 2w54 h HIS 404 N -2.41 0.00 -0.66 3.99 2.07 -1.90 -0.28 115.15 115.96 2w54 h HIS 404 Ca -0.44 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.08 2w54 h HIS 404 Cb 1.28 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.26 2w54 h HIS 404 CO -2.06 0.00 0.00 2.48 -3.07 0.00 0.00 177.93 175.28 2w54 n TYR 405 N -2.34 0.99 -0.97 6.12 0.18 -1.26 -4.64 117.16 115.25 2w54 n TYR 405 Ca 0.02 -0.47 0.00 0.00 1.88 0.00 0.00 57.90 59.33 2w54 n TYR 405 Cb 0.23 -0.04 0.00 0.00 -0.38 0.00 0.00 39.34 39.15 2w54 n TYR 405 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2w54 n GLY 406 N 1.48 0.50 3.73 -7.48 0.00 -0.12 -1.70 105.19 101.60 2w54 n GLY 406 Ca 0.23 -0.16 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 2w54 n GLY 406 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2w54 s GLN 407 N -0.31 4.37 0.27 1.61 0.74 -1.23 -4.72 119.66 120.38 2w54 s GLN 407 Ca 0.00 0.63 -0.30 0.00 0.05 0.00 0.00 55.36 55.75 2w54 s GLN 407 Cb 0.00 -3.43 -0.10 0.00 1.10 0.00 0.00 33.01 30.58 2w54 s GLN 407 CO 0.00 0.15 1.39 -1.21 -0.55 0.00 0.00 175.29 175.07 2w54 s GLU 408 N 0.58 4.30 -0.84 1.67 2.02 -1.26 -0.51 118.70 124.66 2w54 s GLU 408 Ca 0.31 2.26 -0.07 0.00 0.02 0.00 0.00 54.97 57.49 2w54 s GLU 408 Cb -0.16 -3.10 0.21 0.00 0.10 0.00 0.00 34.13 31.18 2w54 s GLU 408 CO 0.14 -0.35 0.74 0.08 0.02 0.00 0.00 175.26 175.90 2w54 s VAL 409 N -0.34 4.85 -1.50 2.63 1.01 -0.76 -4.88 120.40 121.42 2w54 s VAL 409 Ca 0.56 -3.13 0.20 0.00 0.00 0.00 0.00 61.98 59.61 2w54 s VAL 409 Cb -0.41 -4.02 0.70 0.00 0.00 0.00 0.00 36.38 32.65 2w54 s VAL 409 CO 0.46 -1.03 1.60 0.00 0.00 0.00 0.00 175.10 176.13 2w54 n ALA 410 N 3.19 2.79 -1.87 5.51 0.00 -1.26 -4.35 120.51 124.52 2w54 n ALA 410 Ca 0.16 -1.48 0.04 0.00 0.00 0.00 0.00 53.44 52.16 2w54 n ALA 410 Cb 0.41 -0.98 0.07 0.00 0.00 0.00 0.00 19.45 18.95 2w54 n ALA 410 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2w54 n ASP 411 N 1.37 1.09 -4.58 0.00 5.75 -1.26 -4.40 116.55 114.52 2w54 n ASP 411 Ca 0.25 -2.58 -0.42 0.00 -0.01 0.00 0.00 54.79 52.04 2w54 n ASP 411 Cb 0.78 -0.34 -0.02 0.00 -1.03 0.00 0.00 41.12 40.51 2w54 n ASP 411 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2w54 n VAL 413 N 6.82 0.02 -0.32 0.00 0.24 -1.26 -4.16 118.33 119.67 2w54 n VAL 413 Ca 0.12 -0.02 0.07 0.00 -2.04 0.00 0.00 64.34 62.47 2w54 n VAL 413 Cb 0.49 0.42 0.17 0.00 -1.47 0.00 0.00 33.84 33.45 2w54 n VAL 413 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 2w54 h LEU 414 N 0.00 -0.68 -0.18 1.34 3.38 -1.91 -1.35 115.31 115.92 2w54 h LEU 414 Ca 0.00 0.27 0.03 0.00 0.09 0.00 0.00 57.88 58.26 2w54 h LEU 414 Cb 0.52 0.52 -0.05 0.00 0.09 0.00 0.00 40.66 41.73 2w54 h LEU 414 CO 0.00 -0.30 -0.39 1.23 0.09 0.00 0.00 178.44 179.07 2w54 h GLY 415 N 0.02 -1.26 1.05 0.83 0.00 -1.87 0.17 103.07 102.01 2w54 h GLY 415 Ca 0.48 0.71 -0.09 0.00 0.00 0.00 0.00 47.33 48.43 2w54 h GLY 415 CO -0.90 -0.31 -0.02 -2.09 0.00 0.00 0.00 176.54 173.22 2w54 h GLU 416 N -0.36 0.97 -0.24 4.80 4.81 -1.80 -2.77 114.58 119.99 2w54 h GLU 416 Ca 0.03 -0.32 0.04 0.00 -0.13 0.00 0.00 59.36 58.98 2w54 h GLU 416 Cb 0.46 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.72 2w54 h GLU 416 CO -0.36 0.99 0.01 1.25 -0.73 0.00 0.00 179.01 180.17 2w54 h LEU 417 N 0.84 -0.06 -0.15 1.64 6.46 -0.91 -0.96 115.31 122.16 2w54 h LEU 417 Ca 0.15 0.05 -0.00 0.00 -0.12 0.00 0.00 57.88 57.95 2w54 h LEU 417 Cb 0.57 0.08 -0.01 0.00 -0.73 0.00 0.00 40.66 40.57 2w54 h LEU 417 CO 0.03 -0.00 0.08 0.58 -0.62 0.00 0.00 178.44 178.51 2w54 h VAL 418 N 0.09 1.11 -0.90 1.05 2.07 -0.66 -1.83 116.25 117.19 2w54 h VAL 418 Ca 0.11 -0.31 0.08 0.00 0.82 0.00 0.00 66.70 67.40 2w54 h VAL 418 Cb 0.13 1.04 -0.06 0.00 -1.52 0.00 0.00 31.29 30.89 2w54 h VAL 418 CO -0.18 0.10 0.58 0.74 0.02 0.00 0.00 177.57 178.84 2w54 h THR 419 N 0.13 1.01 -0.18 2.57 2.02 -1.21 0.20 112.91 117.45 2w54 h THR 419 Ca 0.05 -0.33 -0.03 0.00 0.77 0.00 0.00 66.41 66.88 2w54 h THR 419 Cb 0.10 -0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.48 2w54 h THR 419 CO -0.01 0.17 -0.01 -0.09 0.37 0.00 0.00 175.52 175.96 2w54 h ARG 420 N 0.95 0.32 -0.36 6.66 2.43 -1.02 -2.80 114.38 120.57 2w54 h ARG 420 Ca 0.40 -0.11 -0.04 0.00 -0.81 0.00 0.00 59.98 59.42 2w54 h ARG 420 Cb 0.31 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 2w54 h ARG 420 CO -0.16 0.55 0.06 1.25 -1.51 0.00 0.00 179.97 180.15 2w54 h LEU 421 N 0.07 0.57 -0.41 3.80 5.85 -0.32 -0.87 115.31 123.99 2w54 h LEU 421 Ca 0.05 -0.26 0.05 0.00 0.84 0.00 0.00 57.88 58.56 2w54 h LEU 421 Cb 0.41 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.24 2w54 h LEU 421 CO 0.01 0.68 0.16 1.56 -0.34 0.00 0.00 178.44 180.51 2w54 h GLN 422 N 0.44 0.32 -0.04 1.25 4.20 -0.74 0.28 115.11 120.81 2w54 h GLN 422 Ca 0.11 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.80 2w54 h GLN 422 Cb 0.35 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 28.06 2w54 h GLN 422 CO 0.01 0.21 0.02 0.87 -0.67 0.00 0.00 178.83 179.27 2w54 h LYS 423 N 0.33 0.06 -0.01 1.46 6.56 -1.28 0.92 116.57 124.61 2w54 h LYS 423 Ca 0.19 -0.01 -0.12 0.00 -1.06 0.00 0.00 60.65 59.65 2w54 h LYS 423 Cb 0.16 -0.01 -0.02 0.00 -0.57 0.00 0.00 32.23 31.79 2w54 h LYS 423 CO -0.18 0.09 -0.57 0.66 -2.06 0.00 0.00 179.45 177.40 2w54 h SER 424 N 0.01 0.04 0.03 0.86 4.64 -0.96 -2.64 113.55 115.53 2w54 h SER 424 Ca 0.02 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2w54 h SER 424 Cb 0.05 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 2w54 h SER 424 CO -0.00 0.60 -0.01 0.00 -0.87 0.00 0.00 176.83 176.55 2w54 n ALA 425 N -2.44 2.65 -3.55 5.18 0.00 0.96 -4.92 120.51 118.39 2w54 n ALA 425 Ca -0.01 -0.31 -0.21 0.00 0.00 0.00 0.00 53.44 52.90 2w54 n ALA 425 Cb 0.57 -1.35 0.08 0.00 0.00 0.00 0.00 19.45 18.76 2w54 n ALA 425 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2w54 n ASN 426 N -0.48 -4.32 -0.00 0.00 5.15 -0.72 -4.92 115.26 109.96 2w54 n ASN 426 Ca 0.21 -0.59 -0.11 0.00 -0.60 0.00 0.00 54.58 53.48 2w54 n ASN 426 Cb 0.23 -5.00 -0.06 0.00 -0.53 0.00 0.00 39.78 34.43 2w54 n ASN 426 CO 0.00 0.00 0.00 0.15 1.40 0.00 0.00 177.26 178.81 2w54 h PHE 427 N -2.32 0.12 0.43 1.20 3.57 -1.09 -1.87 116.94 116.98 2w54 h PHE 427 Ca -0.58 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 60.90 2w54 h PHE 427 Cb 1.36 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 40.06 2w54 h PHE 427 CO 0.48 0.15 -0.21 1.15 -2.23 0.00 0.00 178.31 177.64 2w54 h THR 428 N 0.06 0.57 -0.55 4.41 2.02 -1.92 -0.08 112.91 117.42 2w54 h THR 428 Ca 0.03 -0.15 0.02 0.00 0.77 0.00 0.00 66.41 67.08 2w54 h THR 428 Cb 0.07 0.65 -0.03 0.00 -1.74 0.00 0.00 68.15 67.09 2w54 h THR 428 CO -0.01 0.03 0.34 0.74 0.37 0.00 0.00 175.52 177.00 2w54 h THR 429 N -0.67 1.09 -0.88 3.16 2.02 -1.96 -1.72 112.91 113.95 2w54 h THR 429 Ca -0.06 -0.24 -0.00 0.00 0.77 0.00 0.00 66.41 66.88 2w54 h THR 429 Cb 0.49 0.34 -0.04 0.00 -1.74 0.00 0.00 68.15 67.20 2w54 h THR 429 CO 0.10 0.13 0.54 0.03 0.37 0.00 0.00 175.52 176.68 2w54 h ARG 430 N 0.69 1.18 -0.43 6.66 3.08 -1.25 0.24 114.38 124.54 2w54 h ARG 430 Ca 0.21 -0.10 -0.08 0.00 0.07 0.00 0.00 59.98 60.08 2w54 h ARG 430 Cb -0.02 -0.25 -0.02 0.00 0.08 0.00 0.00 29.97 29.76 2w54 h ARG 430 CO -0.08 0.82 -0.07 -0.09 -1.07 0.00 0.00 179.97 179.48 2w54 h ARG 431 N 1.20 0.73 -0.19 0.04 2.43 -0.61 -1.64 114.38 116.35 2w54 h ARG 431 Ca 0.32 -0.22 -0.18 0.00 -0.81 0.00 0.00 59.98 59.09 2w54 h ARG 431 Cb -0.07 -0.07 0.01 0.00 -0.42 0.00 0.00 29.97 29.41 2w54 h ARG 431 CO -0.06 0.80 -0.58 0.00 -1.51 0.00 0.00 179.97 178.61 2w54 h ALA 432 N 1.24 0.32 -0.79 2.80 0.00 -1.00 -2.99 119.26 118.85 2w54 h ALA 432 Ca 0.12 -0.53 0.01 0.00 0.00 0.00 0.00 54.91 54.51 2w54 h ALA 432 Cb 0.52 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 2w54 h ALA 432 CO 0.03 0.56 0.52 0.93 0.00 0.00 0.00 179.25 181.28 2w54 h GLU 433 N 0.43 1.04 -0.17 0.00 5.08 -0.81 -2.85 114.58 117.30 2w54 h GLU 433 Ca -0.02 -0.07 0.02 0.00 -1.00 0.00 0.00 59.36 58.29 2w54 h GLU 433 Cb 1.21 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 30.20 2w54 h GLU 433 CO 0.12 0.70 0.04 0.82 -1.00 0.00 0.00 179.01 179.69 2w54 h ILE 434 N 1.07 0.94 -0.56 3.13 2.04 -1.33 -1.98 117.51 120.82 2w54 h ILE 434 Ca 0.29 -0.04 0.11 0.00 1.00 0.00 0.00 64.86 66.22 2w54 h ILE 434 Cb -0.11 0.81 -0.10 0.00 -0.74 0.00 0.00 36.82 36.68 2w54 h ILE 434 CO -0.06 0.02 -0.05 0.00 0.00 0.00 0.00 178.15 178.06 2w54 h ALA 435 N 1.11 0.48 -0.24 1.87 0.00 -1.35 0.16 119.26 121.29 2w54 h ALA 435 Ca 0.07 0.19 0.01 0.00 0.00 0.00 0.00 54.91 55.18 2w54 h ALA 435 Cb 0.06 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2w54 h ALA 435 CO -0.09 -0.41 0.15 0.00 0.00 0.00 0.00 179.25 178.90 2w54 h ALA 436 N 1.53 0.30 -0.85 0.00 0.00 -1.35 -2.91 119.26 115.98 2w54 h ALA 436 Ca 0.28 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 2w54 h ALA 436 Cb 0.44 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 2w54 h ALA 436 CO -0.51 -0.24 0.51 2.35 0.00 0.00 0.00 179.25 181.36 2w54 h TRP 437 N 0.30 1.11 -0.62 0.00 7.01 -0.40 -2.77 115.95 120.58 2w54 h TRP 437 Ca 0.09 0.00 -0.05 0.00 2.11 0.00 0.00 58.89 61.04 2w54 h TRP 437 Cb -0.01 -0.37 -0.03 0.00 -2.10 0.00 0.00 29.16 26.65 2w54 h TRP 437 CO -0.07 0.74 0.19 -0.91 -2.79 0.00 0.00 178.44 175.59 2w54 h ASN 438 N 1.17 0.88 0.79 2.65 2.35 -0.57 -2.54 115.58 120.31 2w54 h ASN 438 Ca 0.30 -0.15 -0.03 0.00 -0.55 0.00 0.00 56.30 55.88 2w54 h ASN 438 Cb -0.05 -0.23 -0.00 0.00 0.05 0.00 0.00 38.32 38.08 2w54 h ASN 438 CO -0.06 0.83 -0.13 0.77 -1.65 0.00 0.00 177.43 177.19 2w54 h SER 439 N 0.92 0.00 0.14 5.81 4.64 -1.33 -2.99 113.55 120.74 2w54 h SER 439 Ca 0.20 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.24 2w54 h SER 439 Cb 0.27 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.39 2w54 h SER 439 CO -0.01 0.13 -1.21 0.74 -0.87 0.00 0.00 176.83 175.61 2w54 h THR 440 N 0.00 1.31 -3.51 2.95 2.02 -1.40 -3.46 112.91 110.82 2w54 h THR 440 Ca -0.00 -2.48 -0.49 0.00 0.77 0.00 0.00 66.41 64.21 2w54 h THR 440 Cb 0.56 2.81 0.04 0.00 -1.74 0.00 0.00 68.15 69.81 2w54 h THR 440 CO 0.02 0.75 0.10 0.20 0.37 0.00 0.00 175.52 176.95 2w54 s ASN 441 N -7.37 6.10 0.00 4.18 -0.87 -1.02 -4.99 114.94 110.97 2w54 s ASN 441 Ca -0.10 0.83 0.00 0.00 -1.57 0.00 0.00 52.86 52.02 2w54 s ASN 441 Cb 0.05 -2.09 0.00 0.00 -0.02 0.00 0.00 41.25 39.19 2w54 s ASN 441 CO 0.92 -0.67 0.00 -2.11 -2.57 0.00 0.00 177.10 172.67 2w54 n ARG 442 N -2.30 0.74 -0.11 -0.60 1.85 -1.26 -4.82 116.66 110.17 2w54 n ARG 442 Ca 0.01 0.00 -0.13 0.00 -1.00 0.00 0.00 57.85 56.73 2w54 n ARG 442 Cb 0.56 -0.06 -0.14 0.00 -1.05 0.00 0.00 32.46 31.76 2w54 n ARG 442 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 2w54 n THR 443 N 0.00 1.43 -4.10 8.89 -1.04 -1.26 -4.86 114.28 113.33 2w54 n THR 443 Ca 0.00 -0.73 -0.26 0.00 -2.04 0.00 0.00 64.05 61.02 2w54 n THR 443 Cb 0.00 -0.88 -0.06 0.00 -1.82 0.00 0.00 70.33 67.57 2w54 n THR 443 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2w54 s LEU 444 N -5.94 3.71 -0.15 -4.42 1.43 -1.26 0.47 118.68 112.52 2w54 s LEU 444 Ca -0.21 -0.17 -0.08 0.00 -1.03 0.00 0.00 54.13 52.63 2w54 s LEU 444 Cb 0.07 -2.33 0.05 0.00 0.03 0.00 0.00 46.19 44.02 2w54 s LEU 444 CO 0.72 0.08 0.37 0.00 0.23 0.00 0.00 176.35 177.75 2w54 s ALA 445 N -1.73 -0.92 0.02 4.21 0.00 -0.82 -4.71 121.76 117.82 2w54 s ALA 445 Ca 0.30 1.38 -0.00 0.00 0.00 0.00 0.00 51.96 53.64 2w54 s ALA 445 Cb -0.10 -0.84 -0.04 0.00 0.00 0.00 0.00 23.12 22.14 2w54 s ALA 445 CO 0.22 -0.25 0.13 1.03 0.00 0.00 0.00 175.76 176.89 2w54 s ARG 446 N 1.32 3.17 0.00 0.00 0.52 -1.26 -0.70 118.95 122.01 2w54 s ARG 446 Ca -0.09 -0.49 -0.00 0.00 -0.52 0.00 0.00 55.73 54.63 2w54 s ARG 446 Cb -0.09 -2.92 -0.00 0.00 0.52 0.00 0.00 34.95 32.47 2w54 s ARG 446 CO -0.11 0.63 -0.00 0.20 0.02 0.00 0.00 175.30 176.04 2w54 s GLY 447 N -2.06 0.02 0.04 -3.53 0.00 -0.36 -4.40 107.32 97.02 2w54 s GLY 447 Ca 0.27 -0.04 0.06 0.00 0.00 0.00 0.00 44.72 45.01 2w54 s GLY 447 CO 0.19 -0.04 -0.17 -1.50 0.00 0.00 0.00 173.10 171.58 2w54 s ILE 448 N -0.10 1.33 -0.02 0.90 2.07 -1.26 -0.26 121.20 123.86 2w54 s ILE 448 Ca -0.01 -1.06 -0.24 0.00 -1.41 0.00 0.00 60.65 57.93 2w54 s ILE 448 Cb -0.01 -1.18 0.05 0.00 0.13 0.00 0.00 42.46 41.45 2w54 s ILE 448 CO -0.00 0.10 0.51 0.00 -1.91 0.00 0.00 174.94 173.64 2w54 s ALA 449 N -0.81 -1.33 -0.16 1.50 0.00 -0.48 -4.72 121.76 115.76 2w54 s ALA 449 Ca 0.04 0.83 -0.01 0.00 0.00 0.00 0.00 51.96 52.82 2w54 s ALA 449 Cb -0.08 0.09 -0.01 0.00 0.00 0.00 0.00 23.12 23.12 2w54 s ALA 449 CO 0.01 -0.35 -0.12 -1.17 0.00 0.00 0.00 175.76 174.14 2w54 s LEU 450 N -1.37 2.65 -0.07 0.00 2.96 -1.26 -1.02 118.68 120.57 2w54 s LEU 450 Ca -0.11 -0.41 0.04 0.00 -0.22 0.00 0.00 54.13 53.43 2w54 s LEU 450 Cb -0.02 -1.62 0.00 0.00 0.50 0.00 0.00 46.19 45.05 2w54 s LEU 450 CO 0.06 0.08 -0.20 -0.55 -1.32 0.00 0.00 176.35 174.42 2w54 s SER 451 N 0.86 2.57 0.27 3.68 0.15 -0.59 -4.91 113.70 115.73 2w54 s SER 451 Ca -0.03 -0.45 0.03 0.00 0.70 0.00 0.00 55.95 56.20 2w54 s SER 451 Cb -0.15 -1.02 -0.03 0.00 -1.71 0.00 0.00 66.02 63.11 2w54 s SER 451 CO 0.00 0.14 0.43 -2.16 1.20 0.00 0.00 173.24 172.85 2w54 s PRO 452 N 0.29 3.46 -0.07 5.44 0.04 -1.26 -1.51 135.00 141.39 2w54 s PRO 452 Ca -0.13 -0.56 0.02 0.00 0.04 0.00 0.00 61.00 60.38 2w54 s PRO 452 Cb -0.16 -2.80 0.01 0.00 0.04 0.00 0.00 34.50 31.59 2w54 s PRO 452 CO 0.06 0.32 -0.14 0.08 0.04 0.00 0.00 177.00 177.36 2w54 s VAL 453 N -2.09 1.25 -0.19 -0.36 1.01 0.13 -4.85 120.40 115.30 2w54 s VAL 453 Ca 0.37 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 61.80 2w54 s VAL 453 Cb -0.09 -1.13 0.04 0.00 0.00 0.00 0.00 36.38 35.20 2w54 s VAL 453 CO 0.32 0.38 -0.07 -0.75 0.00 0.00 0.00 175.10 174.98 2w54 s LYS 454 N 0.62 1.66 -0.15 2.72 2.20 -1.26 -2.55 119.74 122.98 2w54 s LYS 454 Ca -0.15 -0.69 -0.00 0.00 -0.36 0.00 0.00 55.97 54.77 2w54 s LYS 454 Cb -0.16 -2.23 0.03 0.00 -1.51 0.00 0.00 37.83 33.96 2w54 s LYS 454 CO 0.04 -0.46 -0.09 0.12 -0.36 0.00 0.00 175.35 174.61 2w54 s PHE 455 N 1.52 1.85 0.29 4.03 5.36 -0.59 -4.88 117.98 125.56 2w54 s PHE 455 Ca -0.01 -1.07 -0.29 0.00 -0.96 0.00 0.00 56.93 54.60 2w54 s PHE 455 Cb -0.16 -1.41 -0.10 0.00 -0.34 0.00 0.00 43.02 41.02 2w54 s PHE 455 CO -0.08 -0.61 1.20 0.20 -1.46 0.00 0.00 175.22 174.47 2w54 s GLY 456 N 1.59 2.99 -0.17 13.12 0.00 -1.26 -0.51 107.32 123.07 2w54 s GLY 456 Ca 0.03 1.07 -0.02 0.00 0.00 0.00 0.00 44.72 45.80 2w54 s GLY 456 CO -0.09 1.73 -0.09 -0.42 0.00 0.00 0.00 173.10 174.23 2w54 s ILE 457 N -1.03 3.17 0.00 0.90 -1.09 -0.45 -4.92 121.20 117.77 2w54 s ILE 457 Ca 0.47 -0.59 0.00 0.00 -2.23 0.00 0.00 60.65 58.30 2w54 s ILE 457 Cb -0.36 -2.39 0.00 0.00 -1.58 0.00 0.00 42.46 38.14 2w54 s ILE 457 CO 0.46 0.48 0.00 -1.20 -1.23 0.00 0.00 174.94 173.45 2w54 n SER 458 N 4.14 0.00 -4.73 3.58 7.64 -1.26 -1.94 113.62 121.05 2w54 n SER 458 Ca -0.18 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.28 2w54 n SER 458 Cb 0.52 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.69 2w54 n SER 458 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2w54 s PHE 459 N -1.75 2.91 0.30 1.43 0.40 -1.26 -4.89 117.98 115.11 2w54 s PHE 459 Ca 0.00 0.61 0.04 0.00 -0.60 0.00 0.00 56.93 56.98 2w54 s PHE 459 Cb 0.00 -4.04 0.47 0.00 0.51 0.00 0.00 43.02 39.96 2w54 s PHE 459 CO 0.00 -3.73 1.75 1.79 0.70 0.00 0.00 175.22 175.74 2w54 h THR 460 N 3.70 1.26 -2.16 0.64 1.35 -1.96 -3.35 112.91 112.39 2w54 h THR 460 Ca -0.44 -1.20 -0.53 0.00 -0.55 0.00 0.00 66.41 63.68 2w54 h THR 460 Cb 1.21 1.33 -0.07 0.00 -1.73 0.00 0.00 68.15 68.89 2w54 h THR 460 CO 0.88 0.38 1.14 -0.22 -0.25 0.00 0.00 175.52 177.45 2w54 s LEU 461 N -8.67 3.21 0.29 3.87 1.98 -1.26 -4.90 118.68 113.20 2w54 s LEU 461 Ca -0.07 -0.40 -0.02 0.00 -2.89 0.00 0.00 54.13 50.75 2w54 s LEU 461 Cb 0.14 -2.56 0.42 0.00 0.66 0.00 0.00 46.19 44.86 2w54 s LEU 461 CO 0.78 -1.93 1.96 0.74 -1.89 0.00 0.00 176.35 176.01 2w54 h THR 462 N 6.27 1.21 0.00 3.68 2.02 -1.97 -2.18 112.91 121.94 2w54 h THR 462 Ca -0.23 -0.40 0.00 0.00 0.77 0.00 0.00 66.41 66.55 2w54 h THR 462 Cb 1.07 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.43 2w54 h THR 462 CO 1.28 0.21 0.00 0.00 0.37 0.00 0.00 175.52 177.38 2w54 n HIS 463 N -4.41 0.00 1.03 3.16 1.44 -1.26 -1.87 115.22 113.31 2w54 n HIS 463 Ca 0.10 0.00 0.14 0.00 -2.01 0.00 0.00 57.72 55.95 2w54 n HIS 463 Cb 0.03 -0.45 0.58 0.00 0.12 0.00 0.00 29.99 30.27 2w54 n HIS 463 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2w54 n LEU 464 N -1.45 0.07 -2.43 2.39 4.77 -0.82 -4.24 117.00 115.29 2w54 n LEU 464 Ca 0.04 0.42 -0.21 0.00 -0.03 0.00 0.00 56.01 56.22 2w54 n LEU 464 Cb 0.14 -0.45 -0.12 0.00 -2.33 0.00 0.00 43.42 40.66 2w54 n LEU 464 CO 0.12 0.02 2.15 0.59 -1.33 0.00 0.00 177.39 178.94 2w54 n ASN 465 N -1.48 6.37 -4.25 -1.43 3.02 -0.78 -4.71 115.26 112.00 2w54 n ASN 465 Ca 0.07 -2.55 -0.20 0.00 -0.03 0.00 0.00 54.58 51.88 2w54 n ASN 465 Cb 0.33 -1.45 -0.12 0.00 -0.61 0.00 0.00 39.78 37.94 2w54 n ASN 465 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2w54 s GLN 466 N 1.18 1.04 0.08 3.52 -2.07 -1.26 -1.71 119.66 120.44 2w54 s GLN 466 Ca 0.67 -1.19 -0.15 0.00 -1.82 0.00 0.00 55.36 52.87 2w54 s GLN 466 Cb 0.28 -1.03 0.03 0.00 -1.09 0.00 0.00 33.01 31.20 2w54 s GLN 466 CO -0.03 0.21 0.36 0.00 -1.32 0.00 0.00 175.29 174.51 2w54 s ALA 467 N -1.79 -0.82 0.01 2.60 0.00 -0.05 -4.44 121.76 117.27 2w54 s ALA 467 Ca 0.07 0.01 -0.08 0.00 0.00 0.00 0.00 51.96 51.96 2w54 s ALA 467 Cb -0.07 0.49 0.00 0.00 0.00 0.00 0.00 23.12 23.54 2w54 s ALA 467 CO 0.04 -0.52 0.16 0.20 0.00 0.00 0.00 175.76 175.64 2w54 s GLY 468 N -2.41 0.03 0.08 0.00 0.00 -1.26 -1.27 107.32 102.49 2w54 s GLY 468 Ca -0.01 -0.12 0.01 0.00 0.00 0.00 0.00 44.72 44.59 2w54 s GLY 468 CO -0.07 -0.28 -0.05 0.00 0.00 0.00 0.00 173.10 172.70 2w54 s ALA 469 N -1.60 0.80 -0.08 3.20 0.00 0.73 -2.17 121.76 122.64 2w54 s ALA 469 Ca -0.13 -1.28 -0.02 0.00 0.00 0.00 0.00 51.96 50.53 2w54 s ALA 469 Cb -0.06 0.20 0.04 0.00 0.00 0.00 0.00 23.12 23.29 2w54 s ALA 469 CO 0.01 -0.28 0.05 -1.17 0.00 0.00 0.00 175.76 174.37 2w54 s LEU 470 N -2.95 0.33 -0.07 0.00 2.96 0.21 -0.43 118.68 118.72 2w54 s LEU 470 Ca 0.09 -0.13 0.03 0.00 -0.22 0.00 0.00 54.13 53.91 2w54 s LEU 470 Cb 0.06 -0.25 -0.02 0.00 0.50 0.00 0.00 46.19 46.48 2w54 s LEU 470 CO -0.06 -0.26 -0.16 -0.69 -1.32 0.00 0.00 176.35 173.86 2w54 s VAL 471 N 2.10 2.86 -0.03 1.68 1.01 -0.35 -1.81 120.40 125.86 2w54 s VAL 471 Ca 0.04 -0.78 0.07 0.00 0.00 0.00 0.00 61.98 61.32 2w54 s VAL 471 Cb -0.13 -2.13 -0.02 0.00 0.00 0.00 0.00 36.38 34.10 2w54 s VAL 471 CO -0.05 0.57 -0.25 -1.10 0.00 0.00 0.00 175.10 174.27 2w54 s GLN 472 N -0.33 2.23 -0.18 2.72 -1.52 -0.11 -2.32 119.66 120.15 2w54 s GLN 472 Ca 0.03 -0.91 0.01 0.00 -1.95 0.00 0.00 55.36 52.53 2w54 s GLN 472 Cb -0.13 -2.08 0.02 0.00 -0.22 0.00 0.00 33.01 30.60 2w54 s GLN 472 CO 0.02 0.52 -0.18 0.42 -0.25 0.00 0.00 175.29 175.82 2w54 s ILE 473 N -0.51 1.96 0.43 1.08 1.01 -0.52 -0.40 121.20 124.25 2w54 s ILE 473 Ca 0.07 -0.92 -0.02 0.00 0.00 0.00 0.00 60.65 59.78 2w54 s ILE 473 Cb -0.11 -1.81 -0.03 0.00 0.01 0.00 0.00 42.46 40.53 2w54 s ILE 473 CO 0.00 0.48 0.68 -0.31 0.00 0.00 0.00 174.94 175.80 2w54 s TYR 474 N 1.32 3.46 -0.72 3.97 1.51 0.07 -4.80 117.35 122.15 2w54 s TYR 474 Ca 0.04 0.52 0.14 0.00 -1.01 0.00 0.00 57.07 56.76 2w54 s TYR 474 Cb -0.13 -2.18 0.64 0.00 -0.11 0.00 0.00 41.96 40.18 2w54 s TYR 474 CO -0.12 -0.18 1.43 0.25 -1.11 0.00 0.00 175.55 175.82 2w54 n THR 475 N -2.07 1.25 1.02 -0.71 -2.24 -1.26 -0.21 114.28 110.05 2w54 n THR 475 Ca -0.01 0.41 0.12 0.00 -2.27 0.00 0.00 64.05 62.31 2w54 n THR 475 Cb 0.56 -1.32 0.32 0.00 -2.10 0.00 0.00 70.33 67.78 2w54 n THR 475 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2w54 n ASP 476 N -1.82 0.46 0.00 3.42 3.85 -1.26 -4.13 116.55 117.07 2w54 n ASP 476 Ca 0.01 -0.19 0.00 0.00 -0.71 0.00 0.00 54.79 53.90 2w54 n ASP 476 Cb 0.11 0.13 0.00 0.00 -1.35 0.00 0.00 41.12 40.01 2w54 n ASP 476 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2w54 n GLY 477 N 1.49 0.57 3.77 6.12 0.00 0.71 -4.69 105.19 113.16 2w54 n GLY 477 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 2w54 n GLY 477 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2w54 s SER 478 N -2.00 6.94 -0.09 1.61 1.04 -1.24 -4.78 113.70 115.19 2w54 s SER 478 Ca 0.00 2.15 0.02 0.00 0.48 0.00 0.00 55.95 58.60 2w54 s SER 478 Cb 0.00 -2.60 -0.02 0.00 0.10 0.00 0.00 66.02 63.50 2w54 s SER 478 CO 0.00 -0.37 -0.14 -0.69 0.98 0.00 0.00 173.24 173.03 2w54 s VAL 479 N -1.44 3.05 -0.31 5.02 1.01 0.61 -0.75 120.40 127.59 2w54 s VAL 479 Ca 0.52 -0.69 -0.04 0.00 0.00 0.00 0.00 61.98 61.77 2w54 s VAL 479 Cb -0.27 -2.24 0.04 0.00 0.00 0.00 0.00 36.38 33.92 2w54 s VAL 479 CO 0.34 0.56 0.03 0.00 0.00 0.00 0.00 175.10 176.03 2w54 s ALA 480 N -0.19 2.89 -0.10 5.51 0.00 0.46 -0.68 121.76 129.66 2w54 s ALA 480 Ca 0.00 -1.69 -0.09 0.00 0.00 0.00 0.00 51.96 50.18 2w54 s ALA 480 Cb -0.13 -2.03 -0.04 0.00 0.00 0.00 0.00 23.12 20.92 2w54 s ALA 480 CO 0.03 -1.21 0.19 -1.17 0.00 0.00 0.00 175.76 173.61 2w54 s LEU 481 N 1.33 4.41 -0.16 0.00 2.96 0.66 -0.93 118.68 126.94 2w54 s LEU 481 Ca -0.03 0.57 -0.05 0.00 -0.22 0.00 0.00 54.13 54.40 2w54 s LEU 481 Cb -0.19 -2.18 0.08 0.00 0.50 0.00 0.00 46.19 44.40 2w54 s LEU 481 CO 0.00 0.39 0.29 0.21 -1.32 0.00 0.00 176.35 175.92 2w54 s ASN 482 N -1.04 0.41 0.25 3.68 3.84 -0.75 -1.22 114.94 120.11 2w54 s ASN 482 Ca 0.17 0.50 0.00 0.00 0.21 0.00 0.00 52.86 53.74 2w54 s ASN 482 Cb -0.13 0.77 -0.00 0.00 -0.55 0.00 0.00 41.25 41.34 2w54 s ASN 482 CO 0.06 -0.26 0.01 0.00 -2.79 0.00 0.00 177.10 174.12 2w54 n HIS 483 N 5.35 0.54 0.06 0.43 1.44 -1.26 0.64 115.22 122.42 2w54 n HIS 483 Ca -0.06 -1.29 0.09 0.00 -2.01 0.00 0.00 57.72 54.45 2w54 n HIS 483 Cb 0.50 -0.15 -0.06 0.00 0.12 0.00 0.00 29.99 30.40 2w54 n HIS 483 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2w54 n GLY 484 N 1.77 -1.31 3.77 -1.39 0.00 -0.92 -4.69 105.19 102.42 2w54 n GLY 484 Ca -0.10 -0.29 -0.37 0.00 0.00 0.00 0.00 46.02 45.26 2w54 n GLY 484 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2w54 s GLY 485 N -4.49 2.78 -0.12 -0.02 0.00 -1.26 -4.90 107.32 99.32 2w54 s GLY 485 Ca -0.03 0.93 -0.05 0.00 0.00 0.00 0.00 44.72 45.58 2w54 s GLY 485 CO 0.82 1.39 0.06 -0.51 0.00 0.00 0.00 173.10 174.86 2w54 s THR 486 N -1.54 4.79 -0.25 0.90 -4.23 -1.26 -4.79 115.64 109.26 2w54 s THR 486 Ca 0.63 -0.06 -0.27 0.00 -1.18 0.00 0.00 61.69 60.81 2w54 s THR 486 Cb -0.29 -3.07 0.01 0.00 1.34 0.00 0.00 72.50 70.49 2w54 s THR 486 CO 0.35 0.58 0.95 -0.70 -0.54 0.00 0.00 174.62 175.26 2w54 s GLU 487 N -0.62 4.19 0.00 3.99 2.56 -1.26 -4.88 118.70 122.69 2w54 s GLU 487 Ca 0.11 1.14 0.00 0.00 0.00 0.00 0.00 54.97 56.22 2w54 s GLU 487 Cb -0.12 -3.66 0.00 0.00 2.00 0.00 0.00 34.13 32.35 2w54 s GLU 487 CO 0.02 -0.62 0.81 0.00 -0.56 0.00 0.00 175.26 174.91 2w54 n MET 488 N 6.26 1.85 0.00 4.30 0.00 -1.26 -1.15 117.12 127.12 2w54 n MET 488 Ca 0.09 -1.13 0.00 0.00 0.00 0.00 0.00 57.70 56.66 2w54 n MET 488 Cb 0.47 -0.87 0.00 0.00 0.00 0.00 0.00 33.22 32.82 2w54 n MET 488 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2w54 n GLY 489 N -0.32 1.64 0.00 3.17 0.00 -1.26 -2.99 105.19 105.42 2w54 n GLY 489 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 2w54 n GLY 489 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w54 n GLN 490 N 0.00 0.18 -2.61 1.61 0.00 -1.26 -4.80 117.38 110.49 2w54 n GLN 490 Ca 0.00 0.08 -0.07 0.00 0.00 0.00 0.00 57.00 57.01 2w54 n GLN 490 Cb 0.00 -1.50 0.02 0.00 0.00 0.00 0.00 30.24 28.76 2w54 n GLN 490 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2w54 n GLY 491 N -0.61 0.37 0.06 2.61 0.00 -1.26 -4.95 105.19 101.40 2w54 n GLY 491 Ca 0.05 -0.46 -0.12 0.00 0.00 0.00 0.00 46.02 45.48 2w54 n GLY 491 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2w54 h LEU 492 N -0.57 0.05 -0.90 0.99 5.85 -1.91 -2.87 115.31 115.95 2w54 h LEU 492 Ca -0.17 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.31 2w54 h LEU 492 Cb 1.11 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 42.09 2w54 h LEU 492 CO 0.18 0.25 0.49 0.45 -0.34 0.00 0.00 178.44 179.47 2w54 h HIS 493 N -0.16 1.24 -0.46 1.25 3.86 -1.93 -1.14 115.15 117.81 2w54 h HIS 493 Ca 0.01 -0.03 0.06 0.00 -1.16 0.00 0.00 60.37 59.25 2w54 h HIS 493 Cb 0.22 -0.40 -0.05 0.00 1.06 0.00 0.00 27.41 28.25 2w54 h HIS 493 CO -0.00 0.86 0.17 0.00 0.86 0.00 0.00 177.93 179.81 2w54 h ALA 494 N 1.27 0.56 -0.40 2.45 0.00 -1.90 0.14 119.26 121.37 2w54 h ALA 494 Ca 0.32 0.06 -0.13 0.00 0.00 0.00 0.00 54.91 55.15 2w54 h ALA 494 Cb 0.03 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2w54 h ALA 494 CO -0.05 -0.22 -0.27 0.87 0.00 0.00 0.00 179.25 179.58 2w54 h LYS 495 N 0.34 0.86 -0.33 0.00 1.57 -1.26 -1.05 116.57 116.69 2w54 h LYS 495 Ca 0.22 -0.38 -0.10 0.00 -1.87 0.00 0.00 60.65 58.51 2w54 h LYS 495 Cb 0.21 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 2w54 h LYS 495 CO -0.22 1.02 -0.22 0.52 -0.57 0.00 0.00 179.45 179.98 2w54 h MET 496 N 0.73 0.64 -0.59 3.15 2.86 -0.69 -0.36 114.93 120.68 2w54 h MET 496 Ca 0.09 -0.24 -0.06 0.00 -2.06 0.00 0.00 59.70 57.42 2w54 h MET 496 Cb 0.82 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.42 2w54 h MET 496 CO 0.07 0.81 0.13 0.28 1.06 0.00 0.00 176.91 179.26 2w54 h VAL 497 N 0.56 1.25 -0.84 -2.22 2.07 -0.59 -1.43 116.25 115.05 2w54 h VAL 497 Ca 0.08 -0.92 -0.02 0.00 0.82 0.00 0.00 66.70 66.66 2w54 h VAL 497 Cb 0.69 0.72 -0.04 0.00 -1.52 0.00 0.00 31.29 31.14 2w54 h VAL 497 CO 0.05 0.34 0.43 1.56 0.02 0.00 0.00 177.57 179.97 2w54 h GLN 498 N 0.85 1.19 0.06 1.57 4.20 -0.63 -0.33 115.11 122.03 2w54 h GLN 498 Ca 0.18 -0.15 -0.00 0.00 0.06 0.00 0.00 58.65 58.73 2w54 h GLN 498 Cb 0.37 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 27.92 2w54 h GLN 498 CO 0.00 0.89 -0.03 0.28 -0.67 0.00 0.00 178.83 179.30 2w54 h VAL 499 N 1.18 1.20 -0.66 -0.54 2.07 -0.99 -2.17 116.25 116.35 2w54 h VAL 499 Ca 0.29 -0.97 0.09 0.00 0.82 0.00 0.00 66.70 66.93 2w54 h VAL 499 Cb 0.07 1.82 -0.07 0.00 -1.52 0.00 0.00 31.29 31.60 2w54 h VAL 499 CO -0.04 0.24 0.31 0.00 0.02 0.00 0.00 177.57 178.09 2w54 h ALA 500 N 0.36 0.88 -0.43 1.67 0.00 -1.13 -0.40 119.26 120.23 2w54 h ALA 500 Ca -0.01 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 2w54 h ALA 500 Cb 0.46 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2w54 h ALA 500 CO 0.01 -0.09 -0.03 0.00 0.00 0.00 0.00 179.25 179.15 2w54 h ALA 501 N 1.40 0.58 0.19 0.00 0.00 -1.10 -2.13 119.26 118.20 2w54 h ALA 501 Ca 0.32 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2w54 h ALA 501 Cb 0.33 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2w54 h ALA 501 CO -0.26 0.39 -0.10 0.00 0.00 0.00 0.00 179.25 179.28 2w54 h ALA 502 N 0.89 -0.27 -0.23 0.00 0.00 -0.90 0.69 119.26 119.44 2w54 h ALA 502 Ca 0.12 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 2w54 h ALA 502 Cb 0.52 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2w54 h ALA 502 CO 0.03 -0.65 -0.05 0.28 0.00 0.00 0.00 179.25 178.85 2w54 h VAL 503 N -0.27 1.17 0.00 0.00 2.07 -1.07 -2.46 116.25 115.69 2w54 h VAL 503 Ca -0.02 -0.72 0.00 0.00 0.82 0.00 0.00 66.70 66.78 2w54 h VAL 503 Cb 0.22 1.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 2w54 h VAL 503 CO 0.03 0.24 -0.57 -0.07 0.02 0.00 0.00 177.57 177.22 2w54 h LEU 504 N 0.34 0.00 -0.66 2.57 3.38 -1.27 -3.45 115.31 116.22 2w54 h LEU 504 Ca 0.07 -0.04 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 2w54 h LEU 504 Cb 0.32 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.09 2w54 h LEU 504 CO 0.01 0.02 -0.13 0.61 0.09 0.00 0.00 178.44 179.04 2w54 n GLY 505 N 1.20 0.56 3.37 0.83 0.00 0.13 -4.75 105.19 106.53 2w54 n GLY 505 Ca 0.02 -0.53 -0.19 0.00 0.00 0.00 0.00 46.02 45.32 2w54 n GLY 505 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2w54 s ILE 506 N -2.90 1.31 0.18 -0.61 -4.36 -0.59 -1.07 121.20 113.16 2w54 s ILE 506 Ca 0.10 -2.08 -0.31 0.00 -0.26 0.00 0.00 60.65 58.10 2w54 s ILE 506 Cb -0.04 -2.35 -0.09 0.00 1.25 0.00 0.00 42.46 41.22 2w54 s ILE 506 CO 0.12 -0.35 1.44 -0.62 0.24 0.00 0.00 174.94 175.77 2w54 s ASP 507 N -3.35 6.72 0.27 4.36 -1.08 -1.26 -4.49 116.67 117.83 2w54 s ASP 507 Ca 0.28 2.52 0.15 0.00 -0.52 0.00 0.00 52.55 54.97 2w54 s ASP 507 Cb 0.05 -2.60 0.79 0.00 -1.46 0.00 0.00 42.92 39.70 2w54 s ASP 507 CO 0.09 -0.69 1.39 -0.81 0.52 0.00 0.00 175.17 175.67 2w54 n PRO 508 N 3.26 0.10 -0.19 4.34 -0.04 -1.26 -0.68 135.00 140.52 2w54 n PRO 508 Ca 0.10 0.57 -0.04 0.00 -0.04 0.00 0.00 63.50 64.09 2w54 n PRO 508 Cb 0.41 -1.96 0.14 0.00 -0.04 0.00 0.00 33.50 32.05 2w54 n PRO 508 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2w54 h VAL 509 N 0.00 1.24 0.00 0.52 2.07 -1.97 -2.89 116.25 115.22 2w54 h VAL 509 Ca 0.00 -0.83 0.00 0.00 0.82 0.00 0.00 66.70 66.69 2w54 h VAL 509 Cb 0.28 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 2w54 h VAL 509 CO 0.00 0.32 0.00 1.56 0.02 0.00 0.00 177.57 179.47 2w54 h GLN 510 N 0.94 0.00 -5.82 1.57 1.08 -1.28 -3.42 115.11 108.18 2w54 h GLN 510 Ca 0.21 0.00 -0.59 0.00 -1.45 0.00 0.00 58.65 56.82 2w54 h GLN 510 Cb 0.27 0.00 -0.07 0.00 -0.05 0.00 0.00 27.48 27.63 2w54 h GLN 510 CO -0.01 0.00 -0.19 0.08 -0.95 0.00 0.00 178.83 177.76 2w54 s VAL 511 N -3.68 5.13 -0.07 -0.54 1.01 -1.09 -0.29 120.40 120.87 2w54 s VAL 511 Ca 0.01 0.85 0.04 0.00 0.00 0.00 0.00 61.98 62.88 2w54 s VAL 511 Cb 0.09 -3.75 0.00 0.00 0.00 0.00 0.00 36.38 32.73 2w54 s VAL 511 CO 0.50 0.44 -0.19 -0.60 0.00 0.00 0.00 175.10 175.26 2w54 s ARG 512 N -0.10 2.23 -0.07 2.72 6.06 0.14 -4.96 118.95 124.97 2w54 s ARG 512 Ca 0.24 -0.67 -0.23 0.00 -2.50 0.00 0.00 55.73 52.57 2w54 s ARG 512 Cb -0.15 -1.81 -0.04 0.00 0.06 0.00 0.00 34.95 33.01 2w54 s ARG 512 CO 0.11 0.18 0.69 -1.50 -2.50 0.00 0.00 175.30 172.27 2w54 s ILE 513 N 0.29 5.05 0.21 4.11 1.10 -1.26 -0.25 121.20 130.45 2w54 s ILE 513 Ca -0.12 1.42 0.01 0.00 -0.51 0.00 0.00 60.65 61.45 2w54 s ILE 513 Cb -0.15 -4.03 -0.04 0.00 0.15 0.00 0.00 42.46 38.39 2w54 s ILE 513 CO 0.05 0.26 0.37 0.42 -2.11 0.00 0.00 174.94 173.93 2w54 s THR 514 N 0.77 5.23 0.51 4.00 -4.23 -0.35 -4.94 115.64 116.63 2w54 s THR 514 Ca 0.37 -0.53 -0.23 0.00 -1.18 0.00 0.00 61.69 60.12 2w54 s THR 514 Cb -0.18 -3.76 -0.06 0.00 1.34 0.00 0.00 72.50 69.84 2w54 s THR 514 CO 0.18 -0.20 1.34 0.00 -0.54 0.00 0.00 174.62 175.39 2w54 s ALA 515 N -1.89 2.92 0.31 3.99 0.00 -1.26 -4.77 121.76 121.06 2w54 s ALA 515 Ca 0.37 1.29 -0.29 0.00 0.00 0.00 0.00 51.96 53.32 2w54 s ALA 515 Cb -0.11 -3.54 -0.12 0.00 0.00 0.00 0.00 23.12 19.35 2w54 s ALA 515 CO 0.29 -1.22 1.46 2.41 0.00 0.00 0.00 175.76 178.71 2w54 n THR 516 N -0.78 1.44 -3.68 0.00 -1.04 -0.98 -4.80 114.28 104.43 2w54 n THR 516 Ca 0.09 -0.36 -0.10 0.00 -2.04 0.00 0.00 64.05 61.64 2w54 n THR 516 Cb 0.45 -1.76 -0.10 0.00 -1.82 0.00 0.00 70.33 67.09 2w54 n THR 516 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2w54 s ASP 517 N 0.13 -0.53 0.43 8.00 3.68 -1.26 0.05 116.67 127.17 2w54 s ASP 517 Ca 0.61 0.99 0.23 0.00 2.13 0.00 0.00 52.55 56.50 2w54 s ASP 517 Cb -0.54 0.95 0.89 0.00 -1.45 0.00 0.00 42.92 42.76 2w54 s ASP 517 CO 0.55 -0.20 1.82 0.71 0.13 0.00 0.00 175.17 178.18 2w54 h THR 518 N 5.59 0.66 -0.04 1.71 1.35 -1.52 -2.66 112.91 117.99 2w54 h THR 518 Ca -0.33 -1.19 0.00 0.00 -0.55 0.00 0.00 66.41 64.35 2w54 h THR 518 Cb 1.18 1.78 0.00 0.00 -1.73 0.00 0.00 68.15 69.37 2w54 h THR 518 CO 0.25 0.25 0.00 -1.54 -0.25 0.00 0.00 175.52 174.24 2w54 n SER 519 N -3.46 1.00 -0.08 5.36 3.41 -1.26 -3.57 113.62 115.02 2w54 n SER 519 Ca -0.00 -1.41 -0.15 0.00 -0.26 0.00 0.00 58.87 57.05 2w54 n SER 519 Cb 0.44 -0.02 -0.06 0.00 -0.26 0.00 0.00 64.21 64.31 2w54 n SER 519 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2w54 n LYS 520 N -0.19 0.33 -3.97 4.33 5.02 -1.08 -4.92 118.16 117.68 2w54 n LYS 520 Ca 0.19 0.13 -0.31 0.00 -2.02 0.00 0.00 58.31 56.30 2w54 n LYS 520 Cb 0.26 -1.11 -0.16 0.00 -0.02 0.00 0.00 35.03 34.01 2w54 n LYS 520 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2w54 s VAL 521 N -2.28 1.63 0.47 -0.18 1.01 -1.03 -4.83 120.40 115.20 2w54 s VAL 521 Ca -0.21 -1.23 -0.01 0.00 0.00 0.00 0.00 61.98 60.53 2w54 s VAL 521 Cb 0.07 -1.84 -0.01 0.00 0.00 0.00 0.00 36.38 34.61 2w54 s VAL 521 CO 0.29 -0.04 0.72 -2.16 0.00 0.00 0.00 175.10 173.91 2w54 s PRO 522 N 1.36 3.11 -1.82 2.72 0.04 -1.23 -4.40 135.00 134.77 2w54 s PRO 522 Ca -0.05 -0.32 0.00 0.00 0.04 0.00 0.00 61.00 60.67 2w54 s PRO 522 Cb -0.18 -2.49 0.00 0.00 0.04 0.00 0.00 34.50 31.86 2w54 s PRO 522 CO -0.06 -0.32 0.00 0.09 0.04 0.00 0.00 177.00 176.75 2w54 n ASN 523 N -2.17 -5.94 -4.78 6.66 3.02 -1.26 -4.94 115.26 105.85 2w54 n ASN 523 Ca 0.01 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.19 2w54 n ASN 523 Cb 0.57 -4.96 -0.05 0.00 -0.61 0.00 0.00 39.78 34.74 2w54 n ASN 523 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2w54 s THR 524 N -3.04 3.80 0.81 3.41 -4.23 -1.26 -5.01 115.64 110.12 2w54 s THR 524 Ca 0.00 1.49 -0.12 0.00 -1.18 0.00 0.00 61.69 61.88 2w54 s THR 524 Cb 0.00 -3.83 0.08 0.00 1.34 0.00 0.00 72.50 70.09 2w54 s THR 524 CO 0.00 0.12 1.14 -0.44 -0.54 0.00 0.00 174.62 174.90 2w54 s SER 525 N -1.43 4.42 0.53 3.99 0.01 -1.26 -4.56 113.70 115.39 2w54 s SER 525 Ca 0.53 0.99 -0.22 0.00 1.31 0.00 0.00 55.95 58.56 2w54 s SER 525 Cb -0.23 -1.61 -0.05 0.00 0.21 0.00 0.00 66.02 64.34 2w54 s SER 525 CO 0.29 -1.98 1.29 0.00 0.41 0.00 0.00 173.24 173.25 2w54 s ALA 526 N -3.38 2.83 -0.92 1.44 0.00 -1.26 -4.89 121.76 115.57 2w54 s ALA 526 Ca 0.61 1.19 -0.24 0.00 0.00 0.00 0.00 51.96 53.52 2w54 s ALA 526 Cb -0.13 -3.50 0.01 0.00 0.00 0.00 0.00 23.12 19.49 2w54 s ALA 526 CO 0.52 -1.15 1.66 0.99 0.00 0.00 0.00 175.76 177.77 2w54 s THR 527 N -1.40 3.68 0.11 0.00 2.01 0.01 -4.84 115.64 115.20 2w54 s THR 527 Ca 0.70 -0.44 -0.02 0.00 0.31 0.00 0.00 61.69 62.23 2w54 s THR 527 Cb -0.36 -4.56 0.01 0.00 0.01 0.00 0.00 72.50 67.60 2w54 s THR 527 CO 0.43 -1.48 0.18 0.00 -0.69 0.00 0.00 174.62 173.06 2w54 n ALA 528 N 11.16 -0.30 -1.67 7.40 0.00 -1.26 -4.95 120.51 130.89 2w54 n ALA 528 Ca 0.32 -0.41 -0.18 0.00 0.00 0.00 0.00 53.44 53.17 2w54 n ALA 528 Cb 0.49 0.33 -0.07 0.00 0.00 0.00 0.00 19.45 20.21 2w54 n ALA 528 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2w54 n ALA 529 N -2.33 -0.34 -1.00 0.00 0.00 -1.26 -1.71 120.51 113.88 2w54 n ALA 529 Ca -0.04 0.27 -0.02 0.00 0.00 0.00 0.00 53.44 53.65 2w54 n ALA 529 Cb 0.17 -1.85 -0.01 0.00 0.00 0.00 0.00 19.45 17.76 2w54 n ALA 529 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2w54 n SER 530 N -1.21 -5.53 -0.95 0.00 7.64 -1.26 -3.98 113.62 108.33 2w54 n SER 530 Ca -0.19 0.05 0.08 0.00 1.01 0.00 0.00 58.87 59.82 2w54 n SER 530 Cb 0.61 -3.42 0.23 0.00 -1.01 0.00 0.00 64.21 60.61 2w54 n SER 530 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2w54 n SER 531 N -0.77 2.74 0.19 6.43 3.41 -0.69 -4.52 113.62 120.41 2w54 n SER 531 Ca -0.02 -2.00 -0.15 0.00 -0.26 0.00 0.00 58.87 56.43 2w54 n SER 531 Cb 0.48 -0.34 -0.09 0.00 -0.26 0.00 0.00 64.21 64.00 2w54 n SER 531 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2w54 h GLY 532 N 4.88 -1.19 1.96 5.00 0.00 -1.88 -1.98 103.07 109.86 2w54 h GLY 532 Ca 0.00 0.59 -0.15 0.00 0.00 0.00 0.00 47.33 47.77 2w54 h GLY 532 CO 0.00 -0.33 -0.73 0.00 0.00 0.00 0.00 176.54 175.48 2w54 h ALA 533 N -0.88 0.55 0.04 3.60 0.00 -1.93 -2.89 119.26 117.74 2w54 h ALA 533 Ca -0.04 -0.65 0.02 0.00 0.00 0.00 0.00 54.91 54.24 2w54 h ALA 533 Cb 0.72 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 2w54 h ALA 533 CO -0.13 0.89 -0.20 -0.44 0.00 0.00 0.00 179.25 179.36 2w54 h ASP 534 N 0.00 -0.57 0.07 0.00 5.19 -1.77 -1.25 116.42 118.08 2w54 h ASP 534 Ca -0.01 0.08 -0.29 0.00 -0.62 0.00 0.00 57.03 56.19 2w54 h ASP 534 Cb 1.55 0.23 -0.02 0.00 0.18 0.00 0.00 39.33 41.27 2w54 h ASP 534 CO 0.09 -0.27 -1.54 0.24 -3.12 0.00 0.00 179.24 174.64 2w54 h MET 535 N -0.34 0.14 -0.59 3.56 2.86 -1.48 -3.30 114.93 115.78 2w54 h MET 535 Ca 0.05 -0.24 -0.05 0.00 -2.06 0.00 0.00 59.70 57.40 2w54 h MET 535 Cb 0.40 0.09 -0.03 0.00 0.06 0.00 0.00 31.60 32.12 2w54 h MET 535 CO -0.16 1.12 0.17 -0.91 1.06 0.00 0.00 176.91 178.19 2w54 h ASN 536 N -0.49 0.84 -0.94 1.22 2.35 -1.63 -1.12 115.58 115.80 2w54 h ASN 536 Ca -0.36 -0.14 0.09 0.00 -0.55 0.00 0.00 56.30 55.33 2w54 h ASN 536 Cb 1.65 -0.22 -0.07 0.00 0.05 0.00 0.00 38.32 39.73 2w54 h ASN 536 CO -0.05 0.80 0.59 1.23 -1.65 0.00 0.00 177.43 178.35 2w54 h GLY 537 N 1.00 1.48 0.65 2.83 0.00 -1.38 0.27 103.07 107.93 2w54 h GLY 537 Ca 0.19 -0.41 -0.03 0.00 0.00 0.00 0.00 47.33 47.08 2w54 h GLY 537 CO -0.01 0.22 -0.07 -0.33 0.00 0.00 0.00 176.54 176.36 2w54 h MET 538 N 1.01 0.20 -0.73 4.80 2.86 -1.52 -1.54 114.93 120.00 2w54 h MET 538 Ca 0.44 -0.10 0.08 0.00 -2.06 0.00 0.00 59.70 58.06 2w54 h MET 538 Cb 0.32 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 31.91 2w54 h MET 538 CO -0.22 0.60 0.40 0.00 1.06 0.00 0.00 176.91 178.75 2w54 h ALA 539 N 0.59 1.00 0.05 6.32 0.00 -0.74 0.16 119.26 126.65 2w54 h ALA 539 Ca 0.02 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2w54 h ALA 539 Cb 0.56 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2w54 h ALA 539 CO 0.02 0.04 -0.02 0.28 0.00 0.00 0.00 179.25 179.56 2w54 h VAL 540 N 0.69 1.04 -0.65 0.00 2.07 -0.48 -2.40 116.25 116.53 2w54 h VAL 540 Ca 0.34 -0.29 0.08 0.00 0.82 0.00 0.00 66.70 67.65 2w54 h VAL 540 Cb 0.29 1.24 -0.04 0.00 -1.52 0.00 0.00 31.29 31.25 2w54 h VAL 540 CO -0.23 0.07 0.43 0.50 0.02 0.00 0.00 177.57 178.37 2w54 h LYS 541 N -0.19 0.53 -0.45 1.57 3.64 -0.77 -1.55 116.57 119.35 2w54 h LYS 541 Ca -0.01 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.32 2w54 h LYS 541 Cb 0.17 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 2w54 h LYS 541 CO 0.01 0.35 0.19 0.22 -2.27 0.00 0.00 179.45 177.95 2w54 h ASP 542 N 0.55 0.60 0.10 4.20 3.58 -0.42 -1.63 116.42 123.40 2w54 h ASP 542 Ca 0.29 -0.15 -0.11 0.00 0.42 0.00 0.00 57.03 57.47 2w54 h ASP 542 Cb 0.42 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 41.30 2w54 h ASP 542 CO -0.09 0.59 -0.38 0.00 -2.88 0.00 0.00 179.24 176.48 2w54 h ALA 543 N 1.04 1.03 0.02 -0.78 0.00 -0.83 -2.89 119.26 116.85 2w54 h ALA 543 Ca 0.15 -0.41 -0.17 0.00 0.00 0.00 0.00 54.91 54.48 2w54 h ALA 543 Cb 0.17 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.87 2w54 h ALA 543 CO -0.01 0.60 -0.69 0.00 0.00 0.00 0.00 179.25 179.15 2w54 h GLU 545 N -0.08 0.57 0.15 0.00 5.08 -1.37 1.12 114.58 120.04 2w54 h GLU 545 Ca -0.09 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.21 2w54 h GLU 545 Cb 1.40 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.54 2w54 h GLU 545 CO 0.13 0.42 -0.07 1.15 -1.00 0.00 0.00 179.01 179.65 2w54 h THR 546 N 0.58 0.89 -0.21 1.13 2.02 -1.49 0.45 112.91 116.27 2w54 h THR 546 Ca 0.15 -0.12 -0.03 0.00 0.77 0.00 0.00 66.41 67.18 2w54 h THR 546 Cb 0.02 0.97 -0.01 0.00 -1.74 0.00 0.00 68.15 67.39 2w54 h THR 546 CO -0.02 0.03 0.02 -0.07 0.37 0.00 0.00 175.52 175.85 2w54 h LEU 547 N -0.25 0.35 -1.15 2.58 3.38 -0.70 -1.37 115.31 118.15 2w54 h LEU 547 Ca -0.02 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 2w54 h LEU 547 Cb 0.20 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 2w54 h LEU 547 CO 0.03 0.54 0.46 -0.09 0.09 0.00 0.00 178.44 179.47 2w54 h ARG 548 N 0.15 1.04 -0.29 1.13 2.43 0.12 -1.79 114.38 117.16 2w54 h ARG 548 Ca 0.06 -0.09 0.02 0.00 -0.81 0.00 0.00 59.98 59.16 2w54 h ARG 548 Cb 0.34 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.65 2w54 h ARG 548 CO 0.01 0.73 0.14 0.78 -1.51 0.00 0.00 179.97 180.12 2w54 h GLY 549 N 1.08 0.39 0.96 2.80 0.00 -0.69 0.20 103.07 107.81 2w54 h GLY 549 Ca 0.28 -0.10 0.02 0.00 0.00 0.00 0.00 47.33 47.52 2w54 h GLY 549 CO -0.05 0.08 0.48 3.21 0.00 0.00 0.00 176.54 180.26 2w54 h ARG 550 N 0.30 0.94 -0.20 4.80 3.08 -0.65 0.37 114.38 123.02 2w54 h ARG 550 Ca 0.12 -0.06 -0.10 0.00 0.07 0.00 0.00 59.98 60.01 2w54 h ARG 550 Cb 0.04 -0.21 -0.00 0.00 0.08 0.00 0.00 29.97 29.88 2w54 h ARG 550 CO -0.09 0.62 -0.28 -0.07 -1.07 0.00 0.00 179.97 179.09 2w54 h LEU 551 N 0.97 0.58 -0.67 3.04 3.38 -1.15 -1.85 115.31 119.62 2w54 h LEU 551 Ca 0.28 -0.51 0.02 0.00 0.09 0.00 0.00 57.88 57.75 2w54 h LEU 551 Cb -0.07 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.48 2w54 h LEU 551 CO -0.08 0.98 0.43 0.00 0.09 0.00 0.00 178.44 179.87 2w54 h ALA 552 N 0.62 0.86 -0.70 1.53 0.00 -0.43 -0.89 119.26 120.25 2w54 h ALA 552 Ca 0.02 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2w54 h ALA 552 Cb 0.85 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 2w54 h ALA 552 CO 0.06 0.23 0.34 0.78 0.00 0.00 0.00 179.25 180.66 2w54 h GLY 553 N 0.86 1.08 0.98 0.00 0.00 -0.92 -0.43 103.07 104.64 2w54 h GLY 553 Ca 0.26 -0.54 -0.00 0.00 0.00 0.00 0.00 47.33 47.05 2w54 h GLY 553 CO -0.08 0.51 -0.01 -2.75 0.00 0.00 0.00 176.54 174.22 2w54 h PHE 554 N 0.97 -0.02 -0.33 5.60 3.57 -0.95 -1.58 116.94 124.21 2w54 h PHE 554 Ca 0.24 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.74 2w54 h PHE 554 Cb 0.12 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.85 2w54 h PHE 554 CO 0.01 0.01 0.20 0.28 -2.23 0.00 0.00 178.31 176.57 2w54 h VAL 555 N -0.03 1.11 -1.01 1.41 2.07 -1.04 -1.71 116.25 117.05 2w54 h VAL 555 Ca -0.00 -0.23 0.01 0.00 0.82 0.00 0.00 66.70 67.29 2w54 h VAL 555 Cb 0.03 0.68 -0.05 0.00 -1.52 0.00 0.00 31.29 30.42 2w54 h VAL 555 CO 0.00 0.10 0.67 0.00 0.02 0.00 0.00 177.57 178.36 2w54 h ALA 556 N 1.09 1.29 0.35 1.67 0.00 -0.97 0.34 119.26 123.02 2w54 h ALA 556 Ca 0.12 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 2w54 h ALA 556 Cb -0.01 -0.41 0.00 0.00 0.00 0.00 0.00 17.79 17.38 2w54 h ALA 556 CO -0.02 0.66 -0.17 0.00 0.00 0.00 0.00 179.25 179.72 2w54 h ALA 557 N 1.37 -0.47 -0.95 0.00 0.00 -1.15 0.40 119.26 118.47 2w54 h ALA 557 Ca 0.37 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 2w54 h ALA 557 Cb -0.15 0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 2w54 h ALA 557 CO -0.08 -0.59 0.59 -0.09 0.00 0.00 0.00 179.25 179.08 2w54 h ARG 558 N -0.81 1.29 -0.02 0.00 1.12 -1.10 -1.68 114.38 113.17 2w54 h ARG 558 Ca -0.05 -0.11 0.00 0.00 -1.11 0.00 0.00 59.98 58.71 2w54 h ARG 558 Cb 0.52 -0.27 0.00 0.00 -0.01 0.00 0.00 29.97 30.21 2w54 h ARG 558 CO 0.08 0.89 -0.03 0.39 -3.11 0.00 0.00 179.97 178.19 2w54 n GLU 559 N -4.36 1.73 -3.01 0.20 -0.58 0.12 -5.01 120.64 109.73 2w54 n GLU 559 Ca 0.11 -1.12 -0.01 0.00 -0.42 0.00 0.00 57.16 55.71 2w54 n GLU 559 Cb 0.05 -1.48 0.01 0.00 -0.57 0.00 0.00 31.44 29.45 2w54 n GLU 559 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2w54 n GLY 560 N 1.22 -1.19 1.29 0.62 0.00 0.73 -4.98 105.19 102.89 2w54 n GLY 560 Ca 0.17 0.45 -0.01 0.00 0.00 0.00 0.00 46.02 46.64 2w54 n GLY 560 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w54 s ALA 562 N -1.35 2.63 0.16 0.00 0.00 -1.26 -4.44 121.76 117.49 2w54 s ALA 562 Ca 0.08 1.11 -0.05 0.00 0.00 0.00 0.00 51.96 53.10 2w54 s ALA 562 Cb -0.01 -3.49 -0.00 0.00 0.00 0.00 0.00 23.12 19.62 2w54 s ALA 562 CO 0.02 -1.23 1.40 0.00 0.00 0.00 0.00 175.76 175.95 2w54 h ALA 563 N 1.09 0.52 0.00 0.00 0.00 -1.92 -3.14 119.26 115.81 2w54 h ALA 563 Ca -0.51 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 53.81 2w54 h ALA 563 Cb 1.30 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2w54 h ALA 563 CO 0.56 0.73 0.00 2.89 0.00 0.00 0.00 179.25 183.43 2w54 n ARG 564 N -3.88 0.28 0.00 0.00 1.85 -1.26 -2.29 116.66 111.36 2w54 n ARG 564 Ca -0.05 0.11 0.13 0.00 -1.00 0.00 0.00 57.85 57.04 2w54 n ARG 564 Cb 0.71 -1.50 0.42 0.00 -1.05 0.00 0.00 32.46 31.03 2w54 n ARG 564 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2w54 n ASP 565 N -1.26 1.75 -4.65 2.89 8.00 -1.19 -4.82 116.55 117.28 2w54 n ASP 565 Ca 0.09 -1.53 -0.40 0.00 0.71 0.00 0.00 54.79 53.66 2w54 n ASP 565 Cb 0.13 0.03 -0.07 0.00 -0.02 0.00 0.00 41.12 41.19 2w54 n ASP 565 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2w54 s VAL 566 N -2.06 5.08 -0.14 2.53 1.01 -0.97 -4.49 120.40 121.36 2w54 s VAL 566 Ca 0.34 0.99 -0.03 0.00 0.00 0.00 0.00 61.98 63.29 2w54 s VAL 566 Cb 0.21 -3.86 -0.03 0.00 0.00 0.00 0.00 36.38 32.70 2w54 s VAL 566 CO 0.35 0.14 -0.05 -0.63 0.00 0.00 0.00 175.10 174.91 2w54 s ILE 567 N 1.84 3.77 -0.36 2.22 1.01 0.49 -4.94 121.20 125.23 2w54 s ILE 567 Ca 0.24 -0.41 -0.04 0.00 0.00 0.00 0.00 60.65 60.44 2w54 s ILE 567 Cb -0.16 -2.63 0.07 0.00 0.01 0.00 0.00 42.46 39.75 2w54 s ILE 567 CO 0.10 0.51 0.12 -0.36 0.00 0.00 0.00 174.94 175.31 2w54 s PHE 568 N 0.20 3.36 -0.13 3.97 0.40 -1.26 -0.74 117.98 123.78 2w54 s PHE 568 Ca -0.03 -1.85 -0.05 0.00 -0.60 0.00 0.00 56.93 54.39 2w54 s PHE 568 Cb -0.14 -2.58 0.06 0.00 0.51 0.00 0.00 43.02 40.87 2w54 s PHE 568 CO 0.03 -0.84 0.28 0.34 0.70 0.00 0.00 175.22 175.74 2w54 s ASP 569 N 1.57 0.08 -1.08 1.36 3.68 -0.60 -4.35 116.67 117.34 2w54 s ASP 569 Ca 0.01 0.63 -0.16 0.00 2.13 0.00 0.00 52.55 55.15 2w54 s ASP 569 Cb -0.21 0.68 -0.02 0.00 -1.45 0.00 0.00 42.92 41.92 2w54 s ASP 569 CO -0.00 -0.22 0.81 0.00 0.13 0.00 0.00 175.17 175.89 2w54 n ALA 570 N 4.99 -2.55 -1.13 3.66 0.00 -0.57 -1.91 120.51 122.99 2w54 n ALA 570 Ca -0.13 -0.15 -0.04 0.00 0.00 0.00 0.00 53.44 53.12 2w54 n ALA 570 Cb 0.51 -4.17 -0.02 0.00 0.00 0.00 0.00 19.45 15.77 2w54 n ALA 570 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w54 n GLY 571 N -1.60 0.44 3.36 0.00 0.00 -0.23 -4.93 105.19 102.23 2w54 n GLY 571 Ca -0.09 -0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.61 2w54 n GLY 571 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2w54 s GLN 572 N -2.33 2.08 -0.12 1.61 -1.52 -0.80 -1.53 119.66 117.05 2w54 s GLN 572 Ca 0.00 -0.95 0.02 0.00 -1.95 0.00 0.00 55.36 52.48 2w54 s GLN 572 Cb 0.00 -2.08 -0.00 0.00 -0.22 0.00 0.00 33.01 30.70 2w54 s GLN 572 CO 0.00 0.55 -0.20 0.08 -0.25 0.00 0.00 175.29 175.47 2w54 s VAL 573 N -0.71 2.35 -0.05 1.09 1.01 0.11 -1.55 120.40 122.65 2w54 s VAL 573 Ca 0.11 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.20 2w54 s VAL 573 Cb -0.10 -1.94 0.01 0.00 0.00 0.00 0.00 36.38 34.36 2w54 s VAL 573 CO 0.01 0.55 -0.09 -1.58 0.00 0.00 0.00 175.10 173.98 2w54 s GLN 574 N 0.46 1.30 -0.20 2.72 0.74 0.08 -0.91 119.66 123.84 2w54 s GLN 574 Ca -0.14 -0.29 -0.28 0.00 0.05 0.00 0.00 55.36 54.70 2w54 s GLN 574 Cb -0.17 -1.14 0.10 0.00 1.10 0.00 0.00 33.01 32.91 2w54 s GLN 574 CO 0.06 0.01 0.90 0.00 -0.55 0.00 0.00 175.29 175.70 2w54 s ALA 575 N 0.67 -1.89 -1.62 1.58 0.00 -0.63 -0.38 121.76 119.50 2w54 s ALA 575 Ca -0.12 1.72 -0.02 0.00 0.00 0.00 0.00 51.96 53.54 2w54 s ALA 575 Cb -0.14 -0.91 0.00 0.00 0.00 0.00 0.00 23.12 22.07 2w54 s ALA 575 CO 0.02 -0.30 0.17 0.43 0.00 0.00 0.00 175.76 176.08 2w54 n SER 576 N 1.63 -5.63 -2.74 0.00 7.64 -1.26 -1.67 113.62 111.58 2w54 n SER 576 Ca -0.13 -0.07 -0.20 0.00 1.01 0.00 0.00 58.87 59.48 2w54 n SER 576 Cb 0.56 -4.66 0.04 0.00 -1.01 0.00 0.00 64.21 59.14 2w54 n SER 576 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2w54 n GLY 577 N -1.12 -0.35 3.03 0.23 0.00 -1.26 -5.02 105.19 100.69 2w54 n GLY 577 Ca -0.19 0.03 -0.11 0.00 0.00 0.00 0.00 46.02 45.75 2w54 n GLY 577 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w54 s LYS 578 N -5.66 0.43 0.04 1.61 1.02 -0.67 -5.17 119.74 111.33 2w54 s LYS 578 Ca 0.31 -0.72 0.03 0.00 0.02 0.00 0.00 55.97 55.61 2w54 s LYS 578 Cb -0.14 -0.07 -0.02 0.00 -0.52 0.00 0.00 37.83 37.08 2w54 s LYS 578 CO 0.39 -0.01 -0.09 -1.54 -0.92 0.00 0.00 175.35 173.18 2w54 s SER 579 N -1.62 0.96 0.18 2.83 1.04 -1.26 -1.60 113.70 114.24 2w54 s SER 579 Ca -0.12 -0.48 0.02 0.00 0.48 0.00 0.00 55.95 55.85 2w54 s SER 579 Cb -0.09 0.00 -0.05 0.00 0.10 0.00 0.00 66.02 65.99 2w54 s SER 579 CO -0.01 -0.13 0.00 0.26 0.98 0.00 0.00 173.24 174.34 2w54 s TRP 580 N -1.14 1.27 0.49 5.02 0.51 -0.09 -4.98 118.94 120.02 2w54 s TRP 580 Ca -0.06 -1.00 -0.16 0.00 -2.12 0.00 0.00 56.10 52.75 2w54 s TRP 580 Cb -0.09 -0.72 -0.08 0.00 -0.81 0.00 0.00 33.47 31.77 2w54 s TRP 580 CO 0.01 -0.18 0.95 1.03 -0.51 0.00 0.00 176.95 178.25 2w54 s ARG 581 N -3.91 3.97 0.34 4.98 0.52 -1.26 0.06 118.95 123.65 2w54 s ARG 581 Ca 0.25 0.92 0.04 0.00 -0.52 0.00 0.00 55.73 56.42 2w54 s ARG 581 Cb 0.06 -2.17 0.66 0.00 0.52 0.00 0.00 34.95 34.02 2w54 s ARG 581 CO 0.05 -0.21 1.94 0.35 0.02 0.00 0.00 175.30 177.45 2w54 h PHE 582 N 1.10 0.86 -0.63 -0.53 3.57 -1.59 -0.49 116.94 119.23 2w54 h PHE 582 Ca -0.47 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.00 2w54 h PHE 582 Cb 1.18 -0.28 -0.03 0.00 2.79 0.00 0.00 35.95 39.61 2w54 h PHE 582 CO 0.63 0.46 0.17 0.00 -2.23 0.00 0.00 178.31 177.35 2w54 h ALA 583 N 1.57 1.12 -0.71 2.41 0.00 -1.85 -1.64 119.26 120.16 2w54 h ALA 583 Ca 0.34 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 2w54 h ALA 583 Cb 0.22 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 2w54 h ALA 583 CO -0.11 0.60 0.20 0.93 0.00 0.00 0.00 179.25 180.87 2w54 h GLU 584 N 0.93 1.11 -0.17 0.00 5.08 -1.47 -1.52 114.58 118.55 2w54 h GLU 584 Ca 0.20 -0.25 -0.20 0.00 -1.00 0.00 0.00 59.36 58.12 2w54 h GLU 584 Cb 0.30 -0.16 0.01 0.00 0.50 0.00 0.00 28.75 29.40 2w54 h GLU 584 CO -0.00 0.96 -0.67 0.82 -1.00 0.00 0.00 179.01 179.12 2w54 h ILE 585 N 1.06 1.30 -0.04 3.13 1.08 -1.26 -2.48 117.51 120.29 2w54 h ILE 585 Ca 0.23 -1.88 -0.00 0.00 -0.39 0.00 0.00 64.86 62.82 2w54 h ILE 585 Cb 0.33 1.96 -0.00 0.00 -3.07 0.00 0.00 36.82 36.03 2w54 h ILE 585 CO -0.00 0.59 0.03 0.58 -0.69 0.00 0.00 178.15 178.66 2w54 h VAL 586 N 0.47 1.06 -0.53 1.67 2.07 -1.18 0.17 116.25 119.98 2w54 h VAL 586 Ca -0.04 -0.16 -0.03 0.00 0.82 0.00 0.00 66.70 67.29 2w54 h VAL 586 Cb 1.29 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 32.13 2w54 h VAL 586 CO 0.14 0.05 0.20 0.00 0.02 0.00 0.00 177.57 177.98 2w54 h ALA 587 N 0.96 1.36 -0.51 1.67 0.00 -1.36 0.05 119.26 121.44 2w54 h ALA 587 Ca 0.02 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.65 2w54 h ALA 587 Cb 0.06 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2w54 h ALA 587 CO -0.00 0.47 -0.17 0.00 0.00 0.00 0.00 179.25 179.55 2w54 h ALA 588 N 1.47 0.73 -0.25 0.00 0.00 -1.14 -2.43 119.26 117.64 2w54 h ALA 588 Ca 0.18 -0.38 -0.10 0.00 0.00 0.00 0.00 54.91 54.61 2w54 h ALA 588 Cb 0.17 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2w54 h ALA 588 CO -0.02 0.67 -0.29 0.00 0.00 0.00 0.00 179.25 179.62 2w54 h ALA 589 N 0.91 1.03 -0.30 0.00 0.00 -0.06 -1.12 119.26 119.72 2w54 h ALA 589 Ca 0.12 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 2w54 h ALA 589 Cb 0.74 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2w54 h ALA 589 CO 0.06 0.58 0.15 -0.92 0.00 0.00 0.00 179.25 179.12 2w54 h TYR 590 N 0.44 0.43 -0.81 0.00 3.20 -0.92 -1.50 116.97 117.81 2w54 h TYR 590 Ca 0.06 -0.02 0.03 0.00 3.14 0.00 0.00 58.73 61.93 2w54 h TYR 590 Cb 0.73 -0.13 -0.04 0.00 1.54 0.00 0.00 36.73 38.82 2w54 h TYR 590 CO 0.03 0.39 0.53 0.52 -1.64 0.00 0.00 178.16 177.99 2w54 h MET 591 N 0.36 1.00 0.00 1.82 2.86 -1.19 -0.34 114.93 119.44 2w54 h MET 591 Ca 0.10 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 2w54 h MET 591 Cb 0.12 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 31.55 2w54 h MET 591 CO -0.01 0.66 0.00 0.00 1.06 0.00 0.00 176.91 178.62 2w54 n ALA 592 N -2.41 2.49 -3.47 6.32 0.00 -0.44 -4.92 120.51 118.07 2w54 n ALA 592 Ca 0.10 -0.12 -0.19 0.00 0.00 0.00 0.00 53.44 53.23 2w54 n ALA 592 Cb 0.08 -1.31 0.07 0.00 0.00 0.00 0.00 19.45 18.29 2w54 n ALA 592 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2w54 n ARG 593 N -0.85 -4.61 -4.36 0.00 1.74 -0.14 -5.03 116.66 103.41 2w54 n ARG 593 Ca 0.15 0.76 -0.34 0.00 -0.77 0.00 0.00 57.85 57.65 2w54 n ARG 593 Cb 0.07 -5.54 -0.11 0.00 -1.02 0.00 0.00 32.46 25.86 2w54 n ARG 593 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2w54 s ILE 594 N -3.46 4.12 0.13 0.55 1.01 -0.62 -5.04 121.20 117.90 2w54 s ILE 594 Ca 0.16 -0.29 -0.31 0.00 0.00 0.00 0.00 60.65 60.20 2w54 s ILE 594 Cb -0.03 -2.78 -0.10 0.00 0.01 0.00 0.00 42.46 39.56 2w54 s ILE 594 CO 0.76 0.53 1.65 -0.55 0.00 0.00 0.00 174.94 177.34 2w54 s SER 595 N -0.13 6.55 -0.43 3.58 0.15 -1.26 -4.57 113.70 117.59 2w54 s SER 595 Ca 0.04 2.62 0.04 0.00 0.70 0.00 0.00 55.95 59.35 2w54 s SER 595 Cb -0.13 -2.58 0.51 0.00 -1.71 0.00 0.00 66.02 62.11 2w54 s SER 595 CO 0.02 -0.89 1.65 0.18 1.20 0.00 0.00 173.24 175.40 2w54 n LEU 596 N 4.80 5.77 -3.79 3.45 4.77 -1.26 -4.94 117.00 125.79 2w54 n LEU 596 Ca 0.15 -4.10 -0.18 0.00 -0.03 0.00 0.00 56.01 51.85 2w54 n LEU 596 Cb 0.39 -0.71 -0.16 0.00 -2.33 0.00 0.00 43.42 40.61 2w54 n LEU 596 CO 0.63 1.47 -0.37 -0.55 -1.33 0.00 0.00 177.39 177.24 2w54 s SER 597 N -2.35 0.55 -0.07 -1.43 0.15 -1.26 -1.44 113.70 107.85 2w54 s SER 597 Ca 0.54 -0.01 -0.09 0.00 0.70 0.00 0.00 55.95 57.09 2w54 s SER 597 Cb 0.45 -0.21 0.02 0.00 -1.71 0.00 0.00 66.02 64.57 2w54 s SER 597 CO 0.02 -0.13 0.23 0.00 1.20 0.00 0.00 173.24 174.57 2w54 s ALA 598 N 1.22 -0.58 0.61 5.45 0.00 -0.98 -5.03 121.76 122.45 2w54 s ALA 598 Ca -0.07 0.56 -0.00 0.00 0.00 0.00 0.00 51.96 52.45 2w54 s ALA 598 Cb -0.13 -0.30 0.06 0.00 0.00 0.00 0.00 23.12 22.74 2w54 s ALA 598 CO -0.02 -0.14 0.85 0.95 0.00 0.00 0.00 175.76 177.40 2w54 s THR 599 N -0.16 2.50 -0.17 0.00 -4.23 -1.26 -1.21 115.64 111.11 2w54 s THR 599 Ca -0.03 -0.60 -0.15 0.00 -1.18 0.00 0.00 61.69 59.73 2w54 s THR 599 Cb -0.03 -2.91 0.05 0.00 1.34 0.00 0.00 72.50 70.95 2w54 s THR 599 CO 0.01 0.00 0.46 -0.83 -0.54 0.00 0.00 174.62 173.72 2w54 s GLY 600 N -4.50 -0.35 -0.00 3.99 0.00 0.42 -3.97 107.32 102.91 2w54 s GLY 600 Ca 0.60 1.33 -0.01 0.00 0.00 0.00 0.00 44.72 46.64 2w54 s GLY 600 CO 0.40 1.19 0.01 -0.12 0.00 0.00 0.00 173.10 174.58 2w54 s PHE 601 N 0.37 0.01 -0.01 1.90 5.36 -1.26 -0.19 117.98 124.16 2w54 s PHE 601 Ca -0.01 -0.01 0.01 0.00 -0.96 0.00 0.00 56.93 55.97 2w54 s PHE 601 Cb -0.04 -0.01 0.01 0.00 -0.34 0.00 0.00 43.02 42.64 2w54 s PHE 601 CO -0.01 -0.02 -0.03 -0.47 -1.46 0.00 0.00 175.22 173.22 2w54 s TYR 602 N -0.12 0.38 -0.03 10.12 5.04 -0.39 -4.67 117.35 127.68 2w54 s TYR 602 Ca -0.01 -0.06 0.03 0.00 -2.44 0.00 0.00 57.07 54.58 2w54 s TYR 602 Cb -0.01 -0.31 0.00 0.00 0.35 0.00 0.00 41.96 42.00 2w54 s TYR 602 CO -0.00 -0.05 -0.13 0.00 -1.34 0.00 0.00 175.55 174.04 2w54 s ALA 603 N 0.22 1.17 -0.09 3.97 0.00 -1.26 -0.87 121.76 124.90 2w54 s ALA 603 Ca -0.02 -0.50 -0.30 0.00 0.00 0.00 0.00 51.96 51.15 2w54 s ALA 603 Cb -0.05 -0.41 -0.03 0.00 0.00 0.00 0.00 23.12 22.63 2w54 s ALA 603 CO -0.00 0.20 1.31 0.99 0.00 0.00 0.00 175.76 178.26 2w54 s THR 604 N 0.13 4.09 0.81 0.00 2.01 -0.69 -5.01 115.64 116.98 2w54 s THR 604 Ca -0.04 1.38 -0.12 0.00 0.31 0.00 0.00 61.69 63.22 2w54 s THR 604 Cb -0.10 -3.89 0.08 0.00 0.01 0.00 0.00 72.50 68.60 2w54 s THR 604 CO 0.01 -0.06 1.12 -2.16 -0.69 0.00 0.00 174.62 172.83 2w54 s PRO 605 N 2.98 1.96 0.00 4.92 0.04 -1.26 -4.32 135.00 139.32 2w54 s PRO 605 Ca 0.59 0.47 0.00 0.00 0.04 0.00 0.00 61.00 62.10 2w54 s PRO 605 Cb -0.26 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.36 2w54 s PRO 605 CO 0.21 -1.67 0.00 1.63 0.04 0.00 0.00 177.00 177.21 2w54 n LYS 606 N -3.44 0.00 -2.97 4.56 5.02 -1.26 -4.89 118.16 115.19 2w54 n LYS 606 Ca 0.07 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 55.96 2w54 n LYS 606 Cb 0.58 -1.75 -0.04 0.00 -0.02 0.00 0.00 35.03 33.79 2w54 n LYS 606 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2w54 s LEU 607 N 0.00 4.31 -0.30 -0.35 1.43 -1.26 -4.84 118.68 117.67 2w54 s LEU 607 Ca 0.00 1.27 -0.14 0.00 -1.03 0.00 0.00 54.13 54.23 2w54 s LEU 607 Cb 0.00 -3.19 0.18 0.00 0.03 0.00 0.00 46.19 43.21 2w54 s LEU 607 CO 0.00 -0.17 1.09 -0.55 0.23 0.00 0.00 176.35 176.95 2w54 s SER 608 N 0.88 -0.36 -0.02 2.29 0.15 -0.46 -5.03 113.70 111.14 2w54 s SER 608 Ca 0.40 0.20 -0.10 0.00 0.70 0.00 0.00 55.95 57.15 2w54 s SER 608 Cb -0.18 1.29 0.01 0.00 -1.71 0.00 0.00 66.02 65.44 2w54 s SER 608 CO 0.19 -0.07 0.23 -1.66 1.20 0.00 0.00 173.24 173.13 2w54 s TRP 609 N 2.96 -0.11 -0.38 3.44 1.48 -1.26 -0.87 118.94 124.20 2w54 s TRP 609 Ca 0.01 0.19 -0.17 0.00 -1.06 0.00 0.00 56.10 55.07 2w54 s TRP 609 Cb -0.09 0.04 0.01 0.00 -1.16 0.00 0.00 33.47 32.27 2w54 s TRP 609 CO -0.12 -0.29 0.47 0.34 -4.06 0.00 0.00 176.95 173.29 2w54 s ASP 610 N -1.03 6.25 0.21 -2.66 3.68 0.54 -4.97 116.67 118.69 2w54 s ASP 610 Ca -0.11 -0.32 -0.09 0.00 2.13 0.00 0.00 52.55 54.16 2w54 s ASP 610 Cb -0.05 -2.24 0.25 0.00 -1.45 0.00 0.00 42.92 39.43 2w54 s ASP 610 CO 0.02 -0.52 1.82 -0.09 0.13 0.00 0.00 175.17 176.53 2w54 h ARG 611 N 8.60 0.71 -0.02 4.34 2.43 -1.97 -1.47 114.38 127.00 2w54 h ARG 611 Ca -0.28 -0.04 -0.20 0.00 -0.81 0.00 0.00 59.98 58.65 2w54 h ARG 611 Cb 1.12 -0.16 0.01 0.00 -0.42 0.00 0.00 29.97 30.53 2w54 h ARG 611 CO 0.78 0.47 -0.77 -0.07 -1.51 0.00 0.00 179.97 178.87 2w54 h LEU 612 N 0.73 0.72 -0.60 3.80 3.38 -1.95 -3.00 115.31 118.39 2w54 h LEU 612 Ca 0.31 -0.73 -0.10 0.00 0.09 0.00 0.00 57.88 57.46 2w54 h LEU 612 Cb 0.18 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2w54 h LEU 612 CO -0.18 1.35 -0.46 0.03 0.09 0.00 0.00 178.44 179.27 2w54 h ARG 613 N 0.16 0.00 -2.95 1.13 3.08 -1.94 -3.47 114.38 110.38 2w54 h ARG 613 Ca -0.09 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.85 2w54 h ARG 613 Cb 1.45 0.00 0.05 0.00 0.08 0.00 0.00 29.97 31.55 2w54 h ARG 613 CO 0.15 0.46 -0.23 0.41 -1.07 0.00 0.00 179.97 179.69 2w54 n GLY 614 N 0.60 0.28 3.08 0.04 0.00 -0.57 -4.81 105.19 103.80 2w54 n GLY 614 Ca 0.00 -0.33 -0.14 0.00 0.00 0.00 0.00 46.02 45.55 2w54 n GLY 614 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2w54 s GLN 615 N -4.73 0.59 0.00 1.61 -1.52 -1.08 -4.36 119.66 110.17 2w54 s GLN 615 Ca 0.06 -0.77 0.00 0.00 -1.95 0.00 0.00 55.36 52.70 2w54 s GLN 615 Cb -0.03 -0.42 0.00 0.00 -0.22 0.00 0.00 33.01 32.34 2w54 s GLN 615 CO 0.23 0.08 0.00 0.41 -0.25 0.00 0.00 175.29 175.76 2w54 n GLY 616 N 1.52 0.74 2.96 3.09 0.00 -0.69 -0.34 105.19 112.46 2w54 n GLY 616 Ca -0.22 -2.11 -0.30 0.00 0.00 0.00 0.00 46.02 43.39 2w54 n GLY 616 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2w54 s ARG 617 N -0.87 1.81 0.31 1.61 3.52 -0.05 -3.50 118.95 121.77 2w54 s ARG 617 Ca 0.00 -2.40 0.16 0.00 -0.13 0.00 0.00 55.73 53.36 2w54 s ARG 617 Cb 0.00 -3.24 0.29 0.00 -1.56 0.00 0.00 34.95 30.44 2w54 s ARG 617 CO 0.00 -1.07 1.55 -1.00 -0.81 0.00 0.00 175.30 173.97 2w54 h PRO 618 N 6.81 0.00 -6.37 5.12 0.13 -1.92 -1.21 132.00 134.55 2w54 h PRO 618 Ca -0.07 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 64.37 2w54 h PRO 618 Cb 0.93 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 31.79 2w54 h PRO 618 CO 0.64 0.49 -0.82 -0.06 -0.23 0.00 0.00 178.00 178.02 2w54 s PHE 619 N -3.19 2.56 0.09 1.56 0.40 -1.26 -4.71 117.98 113.43 2w54 s PHE 619 Ca 0.02 -0.31 -0.15 0.00 -0.60 0.00 0.00 56.93 55.90 2w54 s PHE 619 Cb 0.09 -1.59 -0.10 0.00 0.51 0.00 0.00 43.02 41.94 2w54 s PHE 619 CO 0.73 0.07 1.40 1.25 0.70 0.00 0.00 175.22 179.37 2w54 h LEU 620 N 5.48 0.74 -8.36 -0.37 5.85 -1.73 -3.47 115.31 113.45 2w54 h LEU 620 Ca -0.44 -0.49 -0.20 0.00 0.84 0.00 0.00 57.88 57.59 2w54 h LEU 620 Cb 1.14 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.92 2w54 h LEU 620 CO 0.49 1.08 -0.03 -0.72 -0.34 0.00 0.00 178.44 178.92 2w54 s TYR 621 N -4.29 0.78 -0.08 1.25 -0.85 -1.26 -4.94 117.35 107.97 2w54 s TYR 621 Ca -0.12 -1.16 0.04 0.00 -0.52 0.00 0.00 57.07 55.31 2w54 s TYR 621 Cb 0.08 0.23 -0.00 0.00 0.38 0.00 0.00 41.96 42.65 2w54 s TYR 621 CO 0.83 -1.30 -0.21 -0.06 -1.52 0.00 0.00 175.55 173.28 2w54 s PHE 622 N -2.73 2.26 0.41 -3.49 0.40 -1.26 -1.35 117.98 112.22 2w54 s PHE 622 Ca 0.26 -0.84 -0.21 0.00 -0.60 0.00 0.00 56.93 55.53 2w54 s PHE 622 Cb -0.02 -1.52 -0.11 0.00 0.51 0.00 0.00 43.02 41.88 2w54 s PHE 622 CO 0.18 -0.33 0.94 0.00 0.70 0.00 0.00 175.22 176.70 2w54 s ALA 623 N 0.27 3.08 0.22 5.36 0.00 0.34 -4.87 121.76 126.15 2w54 s ALA 623 Ca -0.14 0.39 0.04 0.00 0.00 0.00 0.00 51.96 52.25 2w54 s ALA 623 Cb -0.16 -3.13 -0.05 0.00 0.00 0.00 0.00 23.12 19.78 2w54 s ALA 623 CO 0.06 0.15 -0.02 0.71 0.00 0.00 0.00 175.76 176.66 2w54 s TYR 624 N -2.10 1.51 0.00 0.00 1.51 -1.26 -1.54 117.35 115.47 2w54 s TYR 624 Ca 0.60 -0.90 0.00 0.00 -1.01 0.00 0.00 57.07 55.76 2w54 s TYR 624 Cb -0.10 -0.86 0.00 0.00 -0.11 0.00 0.00 41.96 40.89 2w54 s TYR 624 CO 0.15 -0.02 0.00 0.41 -1.11 0.00 0.00 175.55 174.97 2w54 n GLY 625 N -0.38 1.60 3.20 0.71 0.00 -1.06 -0.36 105.19 108.90 2w54 n GLY 625 Ca -0.06 -0.82 -0.13 0.00 0.00 0.00 0.00 46.02 45.01 2w54 n GLY 625 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w54 s ALA 626 N -2.00 -0.68 -0.03 4.61 0.00 -0.73 0.17 121.76 123.10 2w54 s ALA 626 Ca 0.00 0.31 0.00 0.00 0.00 0.00 0.00 51.96 52.28 2w54 s ALA 626 Cb 0.00 -0.01 0.03 0.00 0.00 0.00 0.00 23.12 23.14 2w54 s ALA 626 CO 0.00 -0.23 0.01 0.00 0.00 0.00 0.00 175.76 175.54 2w54 s ALA 627 N -1.09 0.29 -0.28 0.00 0.00 -0.57 -1.22 121.76 118.89 2w54 s ALA 627 Ca -0.12 0.18 -0.08 0.00 0.00 0.00 0.00 51.96 51.94 2w54 s ALA 627 Cb -0.05 -0.34 -0.02 0.00 0.00 0.00 0.00 23.12 22.71 2w54 s ALA 627 CO 0.03 -0.11 0.10 0.42 0.00 0.00 0.00 175.76 176.20 2w54 s ILE 628 N 1.12 4.40 -0.10 0.00 1.01 0.46 -1.53 121.20 126.55 2w54 s ILE 628 Ca -0.08 -0.30 0.01 0.00 0.00 0.00 0.00 60.65 60.27 2w54 s ILE 628 Cb -0.13 -3.14 -0.02 0.00 0.01 0.00 0.00 42.46 39.17 2w54 s ILE 628 CO -0.02 0.22 -0.12 -0.89 0.00 0.00 0.00 174.94 174.12 2w54 s THR 629 N 1.61 3.16 -0.07 2.92 2.01 -0.19 -1.09 115.64 123.98 2w54 s THR 629 Ca 0.05 -0.65 0.01 0.00 0.31 0.00 0.00 61.69 61.42 2w54 s THR 629 Cb -0.16 -2.30 -0.03 0.00 0.01 0.00 0.00 72.50 70.02 2w54 s THR 629 CO 0.05 0.55 -0.10 -0.70 -0.69 0.00 0.00 174.62 173.72 2w54 s GLU 630 N -0.06 2.78 0.06 4.92 2.12 0.60 -1.39 118.70 127.73 2w54 s GLU 630 Ca -0.02 -0.61 -0.01 0.00 0.36 0.00 0.00 54.97 54.68 2w54 s GLU 630 Cb -0.14 -2.54 -0.04 0.00 0.26 0.00 0.00 34.13 31.68 2w54 s GLU 630 CO 0.04 0.58 -0.01 0.14 -0.54 0.00 0.00 175.26 175.47 2w54 s VAL 631 N -0.60 0.20 -0.04 3.70 -7.23 0.64 -0.64 120.40 116.43 2w54 s VAL 631 Ca 0.09 -1.79 0.06 0.00 -1.81 0.00 0.00 61.98 58.52 2w54 s VAL 631 Cb -0.12 -1.58 -0.01 0.00 0.56 0.00 0.00 36.38 35.23 2w54 s VAL 631 CO 0.02 -0.91 -0.22 0.68 -0.31 0.00 0.00 175.10 174.36 2w54 s VAL 632 N -3.93 1.75 -0.01 1.32 -7.23 -0.83 -1.22 120.40 110.25 2w54 s VAL 632 Ca 0.09 -0.92 0.07 0.00 -1.81 0.00 0.00 61.98 59.42 2w54 s VAL 632 Cb 0.08 -1.48 -0.02 0.00 0.56 0.00 0.00 36.38 35.52 2w54 s VAL 632 CO -0.08 0.50 -0.22 0.27 -0.31 0.00 0.00 175.10 175.25 2w54 s ILE 633 N -0.22 1.74 -0.31 -0.62 -4.36 0.12 -2.00 121.20 115.56 2w54 s ILE 633 Ca 0.00 -0.98 -0.21 0.00 -0.26 0.00 0.00 60.65 59.20 2w54 s ILE 633 Cb -0.11 -1.46 -0.01 0.00 1.25 0.00 0.00 42.46 42.14 2w54 s ILE 633 CO 0.02 0.46 0.66 -0.62 0.24 0.00 0.00 174.94 175.70 2w54 s ASP 634 N -0.61 6.52 0.54 4.36 2.15 0.19 -1.95 116.67 127.87 2w54 s ASP 634 Ca 0.09 0.44 0.35 0.00 0.43 0.00 0.00 52.55 53.85 2w54 s ASP 634 Cb -0.09 -2.35 1.57 0.00 -0.30 0.00 0.00 42.92 41.76 2w54 s ASP 634 CO -0.00 -0.53 2.04 0.03 -0.17 0.00 0.00 175.17 176.54 2w54 h ARG 635 N 8.21 0.00 0.01 4.34 3.08 -0.30 0.16 114.38 129.88 2w54 h ARG 635 Ca -0.26 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.74 2w54 h ARG 635 Cb 1.11 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.16 2w54 h ARG 635 CO 0.82 0.00 -0.23 -0.07 -1.07 0.00 0.00 179.97 179.42 2w54 h LEU 636 N 0.00 0.03 0.00 3.04 3.38 -1.93 -3.42 115.31 116.42 2w54 h LEU 636 Ca 0.00 -0.93 -0.05 0.00 0.09 0.00 0.00 57.88 56.99 2w54 h LEU 636 Cb 0.36 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 2w54 h LEU 636 CO 0.00 1.10 -1.56 0.35 0.09 0.00 0.00 178.44 178.42 2w54 n THR 637 N -4.55 0.17 -0.27 0.22 -2.24 -1.19 -5.01 114.28 101.42 2w54 n THR 637 Ca -0.13 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 2w54 n THR 637 Cb 0.53 0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 2w54 n THR 637 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2w54 n GLY 638 N 1.98 0.65 3.73 3.38 0.00 0.54 -4.49 105.19 110.99 2w54 n GLY 638 Ca -0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 2w54 n GLY 638 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2w54 n GLU 639 N -2.02 2.24 -3.53 1.61 1.02 -1.25 -4.28 120.64 114.43 2w54 n GLU 639 Ca 0.00 0.79 -0.13 0.00 -0.02 0.00 0.00 57.16 57.80 2w54 n GLU 639 Cb 0.00 -2.50 -0.04 0.00 -0.02 0.00 0.00 31.44 28.88 2w54 n GLU 639 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2w54 s ASN 640 N -0.37 -0.46 0.08 1.62 2.20 -1.26 0.55 114.94 117.30 2w54 s ASN 640 Ca 0.58 0.06 -0.12 0.00 -0.94 0.00 0.00 52.86 52.44 2w54 s ASN 640 Cb -0.50 0.53 0.01 0.00 -2.00 0.00 0.00 41.25 39.29 2w54 s ASN 640 CO 0.60 -0.82 0.26 0.00 -2.94 0.00 0.00 177.10 174.21 2w54 s ARG 641 N -3.05 0.86 -0.53 3.55 1.70 -0.85 -5.01 118.95 115.62 2w54 s ARG 641 Ca -0.02 -0.73 -0.24 0.00 -0.47 0.00 0.00 55.73 54.27 2w54 s ARG 641 Cb -0.00 0.36 0.04 0.00 -0.57 0.00 0.00 34.95 34.78 2w54 s ARG 641 CO -0.07 -0.28 0.90 0.42 -1.08 0.00 0.00 175.30 175.19 2w54 s ILE 642 N -3.29 4.46 -0.05 4.99 1.01 -1.26 -1.96 121.20 125.10 2w54 s ILE 642 Ca 0.00 0.29 -0.25 0.00 0.00 0.00 0.00 60.65 60.69 2w54 s ILE 642 Cb 0.02 -4.48 -0.20 0.00 0.01 0.00 0.00 42.46 37.80 2w54 s ILE 642 CO -0.08 -1.01 1.05 -0.07 0.00 0.00 0.00 174.94 174.83 2w54 h LEU 643 N 10.74 -0.06 -7.40 2.97 3.38 -1.23 -3.24 115.31 120.46 2w54 h LEU 643 Ca -0.26 -0.54 -0.14 0.00 0.09 0.00 0.00 57.88 57.03 2w54 h LEU 643 Cb 1.08 0.02 -0.24 0.00 0.09 0.00 0.00 40.66 41.60 2w54 h LEU 643 CO 1.06 0.54 -0.33 -0.60 0.09 0.00 0.00 178.44 179.20 2w54 s ARG 644 N -3.61 0.40 -0.03 1.13 3.52 -1.14 -1.04 118.95 118.18 2w54 s ARG 644 Ca -0.15 0.41 0.03 0.00 -0.13 0.00 0.00 55.73 55.89 2w54 s ARG 644 Cb 0.00 0.20 0.00 0.00 -1.56 0.00 0.00 34.95 33.59 2w54 s ARG 644 CO 0.61 -0.06 -0.11 0.99 -0.81 0.00 0.00 175.30 175.93 2w54 s THR 645 N 0.07 0.90 -0.11 4.11 2.01 0.22 -0.29 115.64 122.55 2w54 s THR 645 Ca -0.01 -0.43 0.04 0.00 0.31 0.00 0.00 61.69 61.60 2w54 s THR 645 Cb -0.03 -0.79 0.00 0.00 0.01 0.00 0.00 72.50 71.69 2w54 s THR 645 CO 0.01 0.28 -0.23 -1.81 -0.69 0.00 0.00 174.62 172.17 2w54 s ASP 646 N 0.15 3.04 -0.09 3.53 1.01 -0.25 -1.24 116.67 122.82 2w54 s ASP 646 Ca -0.03 -0.56 0.02 0.00 0.71 0.00 0.00 52.55 52.70 2w54 s ASP 646 Cb -0.09 -1.39 0.01 0.00 1.01 0.00 0.00 42.92 42.46 2w54 s ASP 646 CO 0.01 0.14 -0.16 -0.63 0.21 0.00 0.00 175.17 174.74 2w54 s ILE 647 N 0.44 1.48 -0.43 0.77 1.01 0.14 -0.40 121.20 124.21 2w54 s ILE 647 Ca -0.17 -0.65 0.04 0.00 0.00 0.00 0.00 60.65 59.87 2w54 s ILE 647 Cb -0.17 -1.34 0.12 0.00 0.01 0.00 0.00 42.46 41.07 2w54 s ILE 647 CO 0.07 0.43 0.16 -0.22 0.00 0.00 0.00 174.94 175.38 2w54 s LEU 648 N 0.78 4.47 0.01 2.97 2.96 -0.35 -0.42 118.68 129.10 2w54 s LEU 648 Ca -0.11 -2.58 0.01 0.00 -0.22 0.00 0.00 54.13 51.22 2w54 s LEU 648 Cb -0.16 -1.61 -0.04 0.00 0.50 0.00 0.00 46.19 44.88 2w54 s LEU 648 CO 0.02 -0.31 0.06 -2.28 -1.32 0.00 0.00 176.35 172.52 2w54 s HIS 649 N 0.31 3.21 -0.30 5.38 5.65 -0.91 -1.78 115.29 126.86 2w54 s HIS 649 Ca 0.14 0.15 -0.14 0.00 0.25 0.00 0.00 55.06 55.47 2w54 s HIS 649 Cb -0.23 -1.70 -0.03 0.00 -1.18 0.00 0.00 32.58 29.44 2w54 s HIS 649 CO -0.04 0.52 0.30 0.34 -0.65 0.00 0.00 174.74 175.21 2w54 s ASP 650 N -1.78 6.14 -0.16 9.88 2.15 0.51 -0.37 116.67 133.04 2w54 s ASP 650 Ca 0.23 -0.03 0.18 0.00 0.43 0.00 0.00 52.55 53.35 2w54 s ASP 650 Cb -0.12 -2.17 0.41 0.00 -0.30 0.00 0.00 42.92 40.75 2w54 s ASP 650 CO 0.14 -0.19 1.29 0.00 -0.17 0.00 0.00 175.17 176.24 2w54 n ALA 651 N 5.24 2.69 -0.78 3.66 0.00 -1.25 -4.22 120.51 125.85 2w54 n ALA 651 Ca -0.11 -2.50 0.00 0.00 0.00 0.00 0.00 53.44 50.83 2w54 n ALA 651 Cb 0.51 -0.55 0.00 0.00 0.00 0.00 0.00 19.45 19.41 2w54 n ALA 651 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w54 n GLY 652 N -0.98 3.26 2.97 0.00 0.00 -1.26 -1.01 105.19 108.18 2w54 n GLY 652 Ca 0.19 -0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 2w54 n GLY 652 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w54 n ALA 653 N 11.76 4.84 -0.72 4.61 0.00 -0.40 -2.20 120.51 138.40 2w54 n ALA 653 Ca 0.00 -4.77 -0.27 0.00 0.00 0.00 0.00 53.44 48.39 2w54 n ALA 653 Cb 0.00 -2.13 -0.03 0.00 0.00 0.00 0.00 19.45 17.29 2w54 n ALA 653 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2w54 n SER 654 N 1.48 -0.22 0.14 0.00 2.88 -1.13 -3.64 113.62 113.13 2w54 n SER 654 Ca 0.26 0.57 0.01 0.00 -1.33 0.00 0.00 58.87 58.37 2w54 n SER 654 Cb 0.35 -0.46 0.17 0.00 -0.75 0.00 0.00 64.21 63.53 2w54 n SER 654 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2w54 h LEU 655 N 1.13 0.00 -6.06 2.46 3.38 -1.90 -3.36 115.31 110.96 2w54 h LEU 655 Ca -0.21 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 2w54 h LEU 655 Cb 0.71 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.24 2w54 h LEU 655 CO 0.31 0.57 -0.43 0.21 0.09 0.00 0.00 178.44 179.19 2w54 s ASN 656 N -6.64 -1.23 0.23 -0.43 3.84 -1.26 -0.00 114.94 109.44 2w54 s ASN 656 Ca 0.00 -0.17 -0.06 0.00 0.21 0.00 0.00 52.86 52.85 2w54 s ASN 656 Cb 0.11 1.84 0.40 0.00 -0.55 0.00 0.00 41.25 43.05 2w54 s ASN 656 CO 0.74 -0.28 1.74 -0.65 -2.79 0.00 0.00 177.10 175.86 2w54 h PRO 657 N 7.77 0.44 0.47 0.43 0.11 -1.77 -1.38 132.00 138.07 2w54 h PRO 657 Ca -0.01 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.07 2w54 h PRO 657 Cb 1.17 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 2w54 h PRO 657 CO 0.16 0.29 -0.48 0.00 -0.21 0.00 0.00 178.00 177.76 2w54 h ALA 658 N 1.50 -1.07 -0.87 -0.75 0.00 -1.86 -0.51 119.26 115.70 2w54 h ALA 658 Ca 0.38 -0.18 0.09 0.00 0.00 0.00 0.00 54.91 55.20 2w54 h ALA 658 Cb 0.53 0.70 -0.06 0.00 0.00 0.00 0.00 17.79 18.96 2w54 h ALA 658 CO -0.36 -1.14 0.57 -0.07 0.00 0.00 0.00 179.25 178.24 2w54 h LEU 659 N -0.96 0.80 -0.19 0.00 3.38 -1.73 -2.16 115.31 114.45 2w54 h LEU 659 Ca -0.05 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 2w54 h LEU 659 Cb 0.84 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 2w54 h LEU 659 CO -0.07 0.48 -0.04 0.44 0.09 0.00 0.00 178.44 179.34 2w54 h ASP 660 N 0.89 0.36 -0.90 -0.43 5.19 -0.92 -1.65 116.42 118.97 2w54 h ASP 660 Ca 0.40 -0.36 0.05 0.00 -0.62 0.00 0.00 57.03 56.50 2w54 h ASP 660 Cb 0.36 -0.10 -0.06 0.00 0.18 0.00 0.00 39.33 39.71 2w54 h ASP 660 CO -0.16 0.64 0.57 0.40 -3.12 0.00 0.00 179.24 177.56 2w54 h ILE 661 N 0.09 1.09 -0.49 0.35 1.08 -0.88 -1.75 117.51 117.01 2w54 h ILE 661 Ca 0.05 -0.37 0.05 0.00 -0.39 0.00 0.00 64.86 64.21 2w54 h ILE 661 Cb 0.47 -0.07 -0.05 0.00 -3.07 0.00 0.00 36.82 34.10 2w54 h ILE 661 CO 0.02 0.19 0.21 1.23 -0.69 0.00 0.00 178.15 179.11 2w54 h GLY 662 N 1.07 0.66 1.00 5.37 0.00 -1.10 0.97 103.07 111.05 2w54 h GLY 662 Ca 0.38 -0.14 -0.02 0.00 0.00 0.00 0.00 47.33 47.55 2w54 h GLY 662 CO -0.15 0.06 0.34 1.46 0.00 0.00 0.00 176.54 178.25 2w54 h GLN 663 N 0.42 0.93 -0.38 4.80 1.08 -0.80 -1.10 115.11 120.06 2w54 h GLN 663 Ca 0.22 -0.12 -0.03 0.00 -1.45 0.00 0.00 58.65 57.27 2w54 h GLN 663 Cb 0.18 -0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 27.42 2w54 h GLN 663 CO -0.19 0.72 0.13 0.82 -0.95 0.00 0.00 178.83 179.36 2w54 h ILE 664 N 0.90 1.21 0.03 2.54 2.04 -0.93 0.14 117.51 123.43 2w54 h ILE 664 Ca 0.23 -0.66 0.02 0.00 1.00 0.00 0.00 64.86 65.44 2w54 h ILE 664 Cb 0.08 0.93 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 2w54 h ILE 664 CO -0.03 0.23 -0.14 -0.33 0.00 0.00 0.00 178.15 177.88 2w54 h GLU 665 N 0.46 -0.23 -0.45 2.37 5.08 -0.55 -1.29 114.58 119.97 2w54 h GLU 665 Ca 0.12 0.02 -0.13 0.00 -1.00 0.00 0.00 59.36 58.37 2w54 h GLU 665 Cb 0.23 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 2w54 h GLU 665 CO -0.01 -0.16 -0.24 0.78 -1.00 0.00 0.00 179.01 178.39 2w54 h GLY 666 N -0.24 1.03 1.02 -3.84 0.00 -1.17 -2.67 103.07 97.19 2w54 h GLY 666 Ca 0.04 -0.92 -0.01 0.00 0.00 0.00 0.00 47.33 46.44 2w54 h GLY 666 CO -0.11 0.84 0.52 0.00 0.00 0.00 0.00 176.54 177.79 2w54 h ALA 667 N 0.90 1.13 -0.10 3.60 0.00 -0.58 -1.12 119.26 123.09 2w54 h ALA 667 Ca 0.10 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2w54 h ALA 667 Cb 0.81 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 2w54 h ALA 667 CO 0.07 0.60 0.02 -0.92 0.00 0.00 0.00 179.25 179.02 2w54 h TYR 668 N 1.22 0.18 -0.92 0.00 3.20 -1.16 0.29 116.97 119.78 2w54 h TYR 668 Ca 0.32 -0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.17 2w54 h TYR 668 Cb -0.03 -0.05 -0.05 0.00 1.54 0.00 0.00 36.73 38.14 2w54 h TYR 668 CO 0.00 0.36 0.60 0.28 -1.64 0.00 0.00 178.16 177.76 2w54 h VAL 669 N -0.06 1.24 -0.19 1.81 2.07 -1.25 0.42 116.25 120.29 2w54 h VAL 669 Ca 0.03 -0.44 -0.16 0.00 0.82 0.00 0.00 66.70 66.96 2w54 h VAL 669 Cb 0.27 -0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 29.93 2w54 h VAL 669 CO 0.00 0.23 -0.53 -0.61 0.02 0.00 0.00 177.57 176.68 2w54 h GLN 670 N 1.25 0.54 0.25 1.57 4.15 -1.18 -1.45 115.11 120.24 2w54 h GLN 670 Ca 0.34 -0.33 -0.01 0.00 0.77 0.00 0.00 58.65 59.41 2w54 h GLN 670 Cb -0.14 0.03 0.00 0.00 0.21 0.00 0.00 27.48 27.59 2w54 h GLN 670 CO -0.07 0.94 -0.12 0.78 -1.93 0.00 0.00 178.83 178.43 2w54 h GLY 671 N 1.08 -0.35 0.84 2.39 0.00 0.78 -2.07 103.07 105.74 2w54 h GLY 671 Ca 0.01 0.13 0.03 0.00 0.00 0.00 0.00 47.33 47.50 2w54 h GLY 671 CO 0.10 -0.13 0.40 0.00 0.00 0.00 0.00 176.54 176.91 2w54 h ALA 672 N -0.03 0.85 -0.91 3.60 0.00 -0.30 -2.80 119.26 119.67 2w54 h ALA 672 Ca -0.03 -0.01 0.11 0.00 0.00 0.00 0.00 54.91 54.97 2w54 h ALA 672 Cb 0.47 -0.19 -0.08 0.00 0.00 0.00 0.00 17.79 17.99 2w54 h ALA 672 CO 0.06 0.14 0.54 0.78 0.00 0.00 0.00 179.25 180.77 2w54 h GLY 673 N 0.77 1.45 1.89 0.00 0.00 -1.22 -1.01 103.07 104.96 2w54 h GLY 673 Ca 0.27 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 47.24 2w54 h GLY 673 CO -0.12 0.14 0.06 -0.25 0.00 0.00 0.00 176.54 176.38 2w54 h TRP 674 N 0.88 0.10 -0.24 5.60 7.01 -1.10 -2.54 115.95 125.66 2w54 h TRP 674 Ca 0.45 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.45 2w54 h TRP 674 Cb 0.43 -0.03 0.00 0.00 -2.10 0.00 0.00 29.16 27.45 2w54 h TRP 674 CO -0.04 0.06 0.00 1.28 -2.79 0.00 0.00 178.44 176.96 2w54 n LEU 675 N -4.52 2.93 0.00 0.65 4.77 -0.47 -4.63 117.00 115.73 2w54 n LEU 675 Ca -0.01 -1.39 0.00 0.00 -0.03 0.00 0.00 56.01 54.57 2w54 n LEU 675 Cb 0.10 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 2w54 n LEU 675 CO 0.34 0.62 0.00 0.35 -1.33 0.00 0.00 177.39 177.37 2w54 n THR 676 N 1.10 0.00 0.02 -5.08 -2.24 -0.67 0.99 114.28 108.40 2w54 n THR 676 Ca 0.14 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.96 2w54 n THR 676 Cb 0.49 -0.39 -0.09 0.00 -2.10 0.00 0.00 70.33 68.24 2w54 n THR 676 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2w54 n THR 677 N -0.74 0.86 -2.41 4.28 -2.24 -1.13 -1.75 114.28 111.14 2w54 n THR 677 Ca 0.00 -0.64 -0.43 0.00 -2.27 0.00 0.00 64.05 60.71 2w54 n THR 677 Cb 0.00 -0.48 -0.02 0.00 -2.10 0.00 0.00 70.33 67.73 2w54 n THR 677 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2w54 s GLU 678 N -3.08 4.22 -0.06 -0.78 2.02 -0.99 -4.36 118.70 115.66 2w54 s GLU 678 Ca -0.04 1.66 -0.03 0.00 0.02 0.00 0.00 54.97 56.58 2w54 s GLU 678 Cb 0.10 -3.78 0.03 0.00 0.10 0.00 0.00 34.13 30.58 2w54 s GLU 678 CO 0.83 -0.73 0.15 -2.00 0.02 0.00 0.00 175.26 173.52 2w54 s GLU 679 N 3.55 0.11 -0.25 1.61 2.12 -1.26 -4.72 118.70 119.86 2w54 s GLU 679 Ca 0.55 0.33 -0.09 0.00 0.36 0.00 0.00 54.97 56.12 2w54 s GLU 679 Cb -0.22 -0.11 -0.04 0.00 0.26 0.00 0.00 34.13 34.02 2w54 s GLU 679 CO 0.15 -0.13 0.13 -0.51 -0.54 0.00 0.00 175.26 174.37 2w54 s LEU 680 N 0.88 3.84 -0.14 2.70 1.43 -1.26 -4.80 118.68 121.32 2w54 s LEU 680 Ca -0.07 -0.03 0.02 0.00 -1.03 0.00 0.00 54.13 53.02 2w54 s LEU 680 Cb -0.09 -2.04 0.01 0.00 0.03 0.00 0.00 46.19 44.11 2w54 s LEU 680 CO -0.04 0.01 -0.22 -0.69 0.23 0.00 0.00 176.35 175.63 2w54 s VAL 681 N 1.40 2.07 0.11 -1.59 1.01 -1.26 -4.98 120.40 117.16 2w54 s VAL 681 Ca 0.06 -0.97 0.03 0.00 0.00 0.00 0.00 61.98 61.10 2w54 s VAL 681 Cb -0.15 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.37 2w54 s VAL 681 CO 0.06 0.55 0.14 0.26 0.00 0.00 0.00 175.10 176.11 2w54 s TRP 682 N 0.86 3.25 0.00 5.22 0.51 -1.26 0.08 118.94 127.60 2w54 s TRP 682 Ca -0.06 0.07 0.00 0.00 -2.12 0.00 0.00 56.10 53.99 2w54 s TRP 682 Cb -0.15 -1.61 0.00 0.00 -0.81 0.00 0.00 33.47 30.90 2w54 s TRP 682 CO -0.03 0.53 0.00 -0.40 -0.51 0.00 0.00 176.95 176.54 2w54 n ASP 683 N 0.06 0.00 0.28 2.95 5.75 -0.19 -4.86 116.55 120.54 2w54 n ASP 683 Ca -0.08 -0.73 0.19 0.00 -0.01 0.00 0.00 54.79 54.16 2w54 n ASP 683 Cb 0.53 0.00 0.87 0.00 -1.03 0.00 0.00 41.12 41.48 2w54 n ASP 683 CO 0.00 0.00 0.00 1.12 -0.11 0.00 0.00 177.20 178.21 2w54 h HIS 684 N -0.29 0.00 -0.38 2.11 2.07 -2.01 -2.39 115.15 114.26 2w54 h HIS 684 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2w54 h HIS 684 Cb 0.00 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.98 2w54 h HIS 684 CO 0.00 0.00 0.00 0.00 -3.07 0.00 0.00 177.93 174.86 2w54 n GLY 686 N 1.45 0.44 3.71 0.00 0.00 -0.90 -4.37 105.19 105.53 2w54 n GLY 686 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2w54 n GLY 686 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2w54 s ARG 687 N -0.46 4.46 -0.35 1.61 0.52 -1.26 -4.59 118.95 118.88 2w54 s ARG 687 Ca 0.00 1.71 -0.29 0.00 -0.52 0.00 0.00 55.73 56.63 2w54 s ARG 687 Cb 0.00 -3.36 -0.00 0.00 0.52 0.00 0.00 34.95 32.10 2w54 s ARG 687 CO 0.00 -0.21 1.52 -1.17 0.02 0.00 0.00 175.30 175.46 2w54 s LEU 688 N 1.00 3.65 0.06 2.53 2.96 -1.26 -1.02 118.68 126.59 2w54 s LEU 688 Ca 0.57 1.10 -0.13 0.00 -0.22 0.00 0.00 54.13 55.45 2w54 s LEU 688 Cb -0.28 -3.54 -0.27 0.00 0.50 0.00 0.00 46.19 42.60 2w54 s LEU 688 CO 0.29 -1.43 1.12 0.24 -1.32 0.00 0.00 176.35 175.25 2w54 h MET 689 N 11.03 0.57 -4.95 1.98 2.86 -0.69 -3.38 114.93 122.35 2w54 h MET 689 Ca -0.30 -0.77 -0.70 0.00 -2.06 0.00 0.00 59.70 55.87 2w54 h MET 689 Cb 1.13 0.26 -0.18 0.00 0.06 0.00 0.00 31.60 32.86 2w54 h MET 689 CO 1.05 1.34 0.96 0.95 1.06 0.00 0.00 176.91 182.28 2w54 s THR 690 N -2.95 4.81 -0.06 2.22 -4.23 -1.17 -4.76 115.64 109.49 2w54 s THR 690 Ca -0.08 -1.85 0.09 0.00 -1.18 0.00 0.00 61.69 58.66 2w54 s THR 690 Cb 0.06 -4.81 0.14 0.00 1.34 0.00 0.00 72.50 69.23 2w54 s THR 690 CO 0.92 -1.53 1.05 0.00 -0.54 0.00 0.00 174.62 174.52 2w54 n HIS 691 N 6.30 0.00 -3.89 3.99 1.44 -1.26 -4.74 115.22 117.05 2w54 n HIS 691 Ca 0.27 -0.50 -0.09 0.00 -2.01 0.00 0.00 57.72 55.39 2w54 n HIS 691 Cb 0.47 -0.09 -0.06 0.00 0.12 0.00 0.00 29.99 30.43 2w54 n HIS 691 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2w54 s ALA 692 N -1.41 -0.23 -1.45 1.59 0.00 -1.26 -4.30 121.76 114.70 2w54 s ALA 692 Ca 0.15 -0.70 0.17 0.00 0.00 0.00 0.00 51.96 51.57 2w54 s ALA 692 Cb 0.13 0.81 0.84 0.00 0.00 0.00 0.00 23.12 24.90 2w54 s ALA 692 CO 0.01 -0.66 1.48 -0.35 0.00 0.00 0.00 175.76 176.25 2w54 n PRO 693 N -0.22 0.25 0.00 0.00 -0.05 -1.26 -0.56 135.00 133.16 2w54 n PRO 693 Ca -0.09 0.12 0.13 0.00 -0.05 0.00 0.00 63.50 63.62 2w54 n PRO 693 Cb 0.63 -1.50 0.45 0.00 -0.05 0.00 0.00 33.50 33.03 2w54 n PRO 693 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 175.50 174.32 2w54 n SER 694 N -1.27 0.78 0.00 3.54 3.41 -1.26 -4.29 113.62 114.52 2w54 n SER 694 Ca 0.08 -0.71 0.00 0.00 -0.26 0.00 0.00 58.87 57.98 2w54 n SER 694 Cb 0.13 0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 2w54 n SER 694 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2w54 n THR 695 N -0.82 0.00 -3.72 6.66 -2.24 -0.76 -4.99 114.28 108.40 2w54 n THR 695 Ca 0.12 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.53 2w54 n THR 695 Cb 0.32 -0.04 -0.12 0.00 -2.10 0.00 0.00 70.33 68.39 2w54 n THR 695 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2w54 s TYR 696 N -1.23 3.13 -0.63 4.78 5.04 0.28 -4.82 117.35 123.90 2w54 s TYR 696 Ca 0.00 -0.63 -0.08 0.00 -2.44 0.00 0.00 57.07 53.92 2w54 s TYR 696 Cb 0.00 -2.28 0.16 0.00 0.35 0.00 0.00 41.96 40.19 2w54 s TYR 696 CO 0.00 -0.45 0.50 0.15 -1.34 0.00 0.00 175.55 174.41 2w54 s LYS 697 N 1.58 2.83 0.60 4.97 -0.14 -1.26 -4.47 119.74 123.85 2w54 s LYS 697 Ca 0.05 -2.26 -0.14 0.00 -1.36 0.00 0.00 55.97 52.27 2w54 s LYS 697 Cb -0.16 -4.00 -0.04 0.00 -1.68 0.00 0.00 37.83 31.95 2w54 s LYS 697 CO 0.04 -1.21 1.03 0.96 -0.76 0.00 0.00 175.35 175.40 2w54 s ILE 698 N 0.48 4.36 -0.01 2.17 -4.36 -1.26 -3.09 121.20 119.48 2w54 s ILE 698 Ca 0.13 0.94 -0.35 0.00 -0.26 0.00 0.00 60.65 61.12 2w54 s ILE 698 Cb -0.19 -3.64 -0.14 0.00 1.25 0.00 0.00 42.46 39.74 2w54 s ILE 698 CO -0.04 -0.83 1.70 -2.65 0.24 0.00 0.00 174.94 173.36 2w54 n PRO 699 N -2.32 1.91 -2.50 0.37 -0.02 -1.26 -4.98 135.00 126.20 2w54 n PRO 699 Ca 0.07 0.70 -0.24 0.00 -2.02 0.00 0.00 63.50 62.01 2w54 n PRO 699 Cb 0.54 -2.47 0.04 0.00 -0.02 0.00 0.00 33.50 31.59 2w54 n PRO 699 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2w54 s ALA 700 N 2.57 3.55 0.23 3.55 0.00 -1.26 -4.96 121.76 125.45 2w54 s ALA 700 Ca 0.88 -1.07 -0.09 0.00 0.00 0.00 0.00 51.96 51.69 2w54 s ALA 700 Cb -0.77 -2.33 0.38 0.00 0.00 0.00 0.00 23.12 20.40 2w54 s ALA 700 CO 0.49 -0.89 1.64 0.35 0.00 0.00 0.00 175.76 177.34 2w54 h PHE 701 N -0.15 -0.08 0.00 0.00 3.57 -2.01 0.36 116.94 118.64 2w54 h PHE 701 Ca -0.44 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.12 2w54 h PHE 701 Cb 1.29 0.15 0.00 0.00 2.79 0.00 0.00 35.95 40.18 2w54 h PHE 701 CO 0.38 -0.23 0.00 -1.13 -2.23 0.00 0.00 178.31 175.11 2w54 n SER 702 N -5.34 0.51 0.14 0.41 3.41 -1.26 -2.99 113.62 108.49 2w54 n SER 702 Ca 0.12 0.61 0.13 0.00 -0.26 0.00 0.00 58.87 59.46 2w54 n SER 702 Cb 0.43 -0.72 0.48 0.00 -0.26 0.00 0.00 64.21 64.13 2w54 n SER 702 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2w54 h ASP 703 N 0.00 0.00 -3.62 4.04 3.32 -1.29 -3.45 116.42 115.42 2w54 h ASP 703 Ca 0.00 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.49 2w54 h ASP 703 Cb 0.39 0.00 0.14 0.00 0.22 0.00 0.00 39.33 40.08 2w54 h ASP 703 CO 0.00 0.00 0.42 -2.11 -1.72 0.00 0.00 179.24 175.83 2w54 n ARG 704 N -2.34 1.64 -1.66 3.56 1.85 -1.16 -4.69 116.66 113.87 2w54 n ARG 704 Ca 0.03 0.60 -0.46 0.00 -1.00 0.00 0.00 57.85 57.02 2w54 n ARG 704 Cb 0.30 -2.36 -0.03 0.00 -1.05 0.00 0.00 32.46 29.32 2w54 n ARG 704 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 2w54 n PRO 705 N -0.37 1.93 -0.33 2.89 -0.02 -1.26 -4.87 135.00 132.97 2w54 n PRO 705 Ca 0.09 0.69 -0.01 0.00 -2.02 0.00 0.00 63.50 62.24 2w54 n PRO 705 Cb 0.42 -2.36 0.11 0.00 -0.02 0.00 0.00 33.50 31.65 2w54 n PRO 705 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2w54 h ARG 706 N 4.61 1.11 -4.87 -0.52 2.47 -1.11 -3.35 114.38 112.72 2w54 h ARG 706 Ca -0.45 -0.07 -0.67 0.00 -1.26 0.00 0.00 59.98 57.53 2w54 h ARG 706 Cb 1.28 -0.25 -0.32 0.00 -1.65 0.00 0.00 29.97 29.03 2w54 h ARG 706 CO 0.79 0.73 -0.73 0.42 0.56 0.00 0.00 179.97 181.75 2w54 s ILE 707 N -6.10 3.00 -0.30 2.04 1.01 -0.88 -5.02 121.20 114.95 2w54 s ILE 707 Ca -0.13 -1.07 0.02 0.00 0.00 0.00 0.00 60.65 59.47 2w54 s ILE 707 Cb 0.17 -2.57 0.07 0.00 0.01 0.00 0.00 42.46 40.15 2w54 s ILE 707 CO 0.80 0.12 -0.03 0.12 0.00 0.00 0.00 174.94 175.96 2w54 s PHE 708 N 1.33 3.40 -0.24 3.97 5.99 -1.26 -0.61 117.98 130.56 2w54 s PHE 708 Ca -0.01 -2.37 -0.02 0.00 0.00 0.00 0.00 56.93 54.53 2w54 s PHE 708 Cb -0.17 -2.28 0.02 0.00 0.00 0.00 0.00 43.02 40.59 2w54 s PHE 708 CO -0.03 -0.88 -0.07 -0.80 -0.00 0.00 0.00 175.22 173.43 2w54 s ASN 709 N 1.15 4.20 -0.13 6.13 0.01 -0.37 -5.03 114.94 120.90 2w54 s ASN 709 Ca -0.03 -0.78 0.02 0.00 -0.71 0.00 0.00 52.86 51.36 2w54 s ASN 709 Cb -0.20 -1.66 0.01 0.00 0.41 0.00 0.00 41.25 39.82 2w54 s ASN 709 CO -0.05 -0.10 -0.19 -0.69 -1.51 0.00 0.00 177.10 174.57 2w54 s VAL 710 N 1.34 1.78 -0.02 1.60 1.01 -1.26 0.27 120.40 125.13 2w54 s VAL 710 Ca 0.01 -0.81 0.05 0.00 0.00 0.00 0.00 61.98 61.23 2w54 s VAL 710 Cb -0.16 -1.60 -0.01 0.00 0.00 0.00 0.00 36.38 34.61 2w54 s VAL 710 CO -0.05 0.50 -0.16 0.00 0.00 0.00 0.00 175.10 175.39 2w54 s ALA 711 N 0.93 1.32 -0.10 5.51 0.00 0.44 -4.99 121.76 124.88 2w54 s ALA 711 Ca -0.06 -0.67 -0.21 0.00 0.00 0.00 0.00 51.96 51.02 2w54 s ALA 711 Cb -0.15 -0.35 -0.04 0.00 0.00 0.00 0.00 23.12 22.58 2w54 s ALA 711 CO -0.02 0.31 0.60 -0.51 0.00 0.00 0.00 175.76 176.14 2w54 s LEU 712 N -0.32 4.29 -0.62 0.00 1.43 -1.26 -2.13 118.68 120.07 2w54 s LEU 712 Ca 0.05 1.01 -0.28 0.00 -1.03 0.00 0.00 54.13 53.88 2w54 s LEU 712 Cb -0.07 -2.91 0.02 0.00 0.03 0.00 0.00 46.19 43.27 2w54 s LEU 712 CO -0.00 -0.08 1.36 0.86 0.23 0.00 0.00 176.35 178.72 2w54 s TRP 713 N 0.80 2.30 -0.66 0.29 -0.11 0.50 -4.93 118.94 117.13 2w54 s TRP 713 Ca 0.32 0.34 -0.16 0.00 1.22 0.00 0.00 56.10 57.82 2w54 s TRP 713 Cb -0.16 -4.46 0.16 0.00 -1.50 0.00 0.00 33.47 27.50 2w54 s TRP 713 CO 0.14 -1.95 0.65 0.34 -4.62 0.00 0.00 176.95 171.51 2w54 s ASP 714 N 4.21 6.41 -0.13 5.86 2.15 -1.26 -3.84 116.67 130.05 2w54 s ASP 714 Ca 0.47 -2.06 -0.07 0.00 0.43 0.00 0.00 52.55 51.32 2w54 s ASP 714 Cb -0.09 -2.23 0.05 0.00 -0.30 0.00 0.00 42.92 40.35 2w54 s ASP 714 CO 0.22 -0.81 0.31 -1.10 -0.17 0.00 0.00 175.17 173.62 2w54 s GLN 715 N 1.32 0.27 0.54 4.34 -0.21 -0.93 -5.00 119.66 119.98 2w54 s GLN 715 Ca 0.11 0.66 -0.21 0.00 0.02 0.00 0.00 55.36 55.94 2w54 s GLN 715 Cb -0.21 -0.06 -0.07 0.00 1.00 0.00 0.00 33.01 33.67 2w54 s GLN 715 CO -0.01 -0.17 1.03 -2.30 -2.12 0.00 0.00 175.29 171.71 2w54 n PRO 716 N 4.38 1.16 -2.02 2.91 -0.02 -1.26 -3.41 135.00 136.74 2w54 n PRO 716 Ca -0.22 0.43 -0.41 0.00 -2.02 0.00 0.00 63.50 61.28 2w54 n PRO 716 Cb 0.53 -2.19 -0.02 0.00 -0.02 0.00 0.00 33.50 31.81 2w54 n PRO 716 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2w54 s ASN 717 N -1.03 6.65 0.15 2.55 3.84 0.34 -4.80 114.94 122.65 2w54 s ASN 717 Ca 0.71 2.76 -0.15 0.00 0.21 0.00 0.00 52.86 56.39 2w54 s ASN 717 Cb -0.46 -2.65 0.03 0.00 -0.55 0.00 0.00 41.25 37.63 2w54 s ASN 717 CO 0.51 -0.65 1.77 0.03 -2.79 0.00 0.00 177.10 175.96 2w54 h ARG 718 N 3.81 0.64 -7.09 0.43 3.08 -1.91 -3.44 114.38 109.90 2w54 h ARG 718 Ca -0.48 -0.07 -0.47 0.00 0.07 0.00 0.00 59.98 59.02 2w54 h ARG 718 Cb 1.23 -0.13 0.03 0.00 0.08 0.00 0.00 29.97 31.18 2w54 h ARG 718 CO 0.69 0.50 0.39 -1.21 -1.07 0.00 0.00 179.97 179.27 2w54 s GLU 719 N -5.88 3.72 -1.40 0.04 0.41 -1.26 -4.94 118.70 109.39 2w54 s GLU 719 Ca -0.13 1.34 -0.13 0.00 -0.41 0.00 0.00 54.97 55.64 2w54 s GLU 719 Cb 0.11 -2.08 0.07 0.00 -1.78 0.00 0.00 34.13 30.45 2w54 s GLU 719 CO 0.75 -0.50 2.10 0.39 -0.49 0.00 0.00 175.26 177.51 2w54 n GLU 720 N -1.13 3.06 -2.36 1.61 1.02 -1.26 -4.79 120.64 116.79 2w54 n GLU 720 Ca 0.09 -2.89 -0.25 0.00 -0.02 0.00 0.00 57.16 54.10 2w54 n GLU 720 Cb 0.52 -3.22 0.09 0.00 -0.02 0.00 0.00 31.44 28.82 2w54 n GLU 720 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2w54 s THR 721 N 2.59 2.28 -0.32 2.62 -4.23 -1.26 -4.93 115.64 112.40 2w54 s THR 721 Ca 0.46 -0.41 -0.30 0.00 -1.18 0.00 0.00 61.69 60.26 2w54 s THR 721 Cb 0.12 -2.88 -0.08 0.00 1.34 0.00 0.00 72.50 71.00 2w54 s THR 721 CO -0.05 0.00 2.25 0.00 -0.54 0.00 0.00 174.62 176.28 2w54 n ILE 722 N -2.88 0.23 -4.04 2.99 0.13 -1.26 -1.03 119.36 113.50 2w54 n ILE 722 Ca 0.11 -0.43 -0.31 0.00 -1.10 0.00 0.00 62.75 61.01 2w54 n ILE 722 Cb 0.60 -2.25 -0.00 0.00 -0.84 0.00 0.00 39.64 37.15 2w54 n ILE 722 CO 0.00 0.00 0.00 0.49 2.80 0.00 0.00 176.55 179.84 2w54 n PHE 723 N 11.64 -1.92 -1.50 9.51 3.01 -1.26 -2.44 117.46 134.50 2w54 n PHE 723 Ca 0.35 0.83 -0.16 0.00 1.01 0.00 0.00 57.45 59.48 2w54 n PHE 723 Cb 0.38 -3.54 -0.06 0.00 -0.01 0.00 0.00 39.48 36.25 2w54 n PHE 723 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2w54 n ARG 724 N -4.48 -1.37 -1.89 -1.08 5.12 -0.20 -4.64 116.66 108.12 2w54 n ARG 724 Ca -0.04 0.92 -0.30 0.00 -1.93 0.00 0.00 57.85 56.50 2w54 n ARG 724 Cb 0.55 -5.23 0.04 0.00 -1.16 0.00 0.00 32.46 26.66 2w54 n ARG 724 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2w54 s SER 725 N -2.32 5.61 0.16 0.55 1.04 -1.02 -0.50 113.70 117.22 2w54 s SER 725 Ca 0.00 1.18 0.09 0.00 0.48 0.00 0.00 55.95 57.71 2w54 s SER 725 Cb 0.00 -2.03 -0.04 0.00 0.10 0.00 0.00 66.02 64.04 2w54 s SER 725 CO 0.00 -1.24 -0.15 -0.54 0.98 0.00 0.00 173.24 172.29 2w54 s LYS 726 N -5.32 1.87 0.29 4.02 1.02 -0.18 -4.68 119.74 116.77 2w54 s LYS 726 Ca 0.57 -1.29 -0.29 0.00 0.02 0.00 0.00 55.97 54.98 2w54 s LYS 726 Cb -0.11 -2.09 -0.10 0.00 -0.52 0.00 0.00 37.83 35.01 2w54 s LYS 726 CO 0.52 0.44 1.40 0.00 -0.92 0.00 0.00 175.35 176.79 2w54 s ALA 727 N -1.53 3.58 0.00 5.17 0.00 -1.26 -4.69 121.76 123.03 2w54 s ALA 727 Ca 0.22 1.32 0.00 0.00 0.00 0.00 0.00 51.96 53.50 2w54 s ALA 727 Cb -0.09 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.49 2w54 s ALA 727 CO 0.13 -0.73 0.58 1.55 0.00 0.00 0.00 175.76 177.29 2w54 n VAL 728 N 1.66 0.32 0.22 0.00 3.14 -1.26 -4.77 118.33 117.65 2w54 n VAL 728 Ca 0.04 -0.39 -0.14 0.00 -2.96 0.00 0.00 64.34 60.89 2w54 n VAL 728 Cb 0.41 0.99 -0.08 0.00 -1.06 0.00 0.00 33.84 34.10 2w54 n VAL 728 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 2w54 h GLY 729 N 0.00 -0.59 0.00 7.55 0.00 -1.92 -3.40 103.07 104.71 2w54 h GLY 729 Ca 0.00 0.22 -0.34 0.00 0.00 0.00 0.00 47.33 47.21 2w54 h GLY 729 CO 0.00 -0.22 -2.29 1.18 0.00 0.00 0.00 176.54 175.21 2w54 n GLU 730 N -5.25 0.58 -0.31 4.80 1.02 -1.26 -4.73 120.64 115.49 2w54 n GLU 730 Ca -0.11 0.13 0.16 0.00 -0.02 0.00 0.00 57.16 57.33 2w54 n GLU 730 Cb 0.29 -1.46 0.34 0.00 -0.02 0.00 0.00 31.44 30.59 2w54 n GLU 730 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 2w54 h PRO 731 N 0.00 0.15 0.00 3.49 0.11 -1.86 -0.05 132.00 133.84 2w54 h PRO 731 Ca -0.51 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2w54 h PRO 731 Cb 1.79 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.87 2w54 h PRO 731 CO -0.08 0.10 0.00 -0.35 -0.21 0.00 0.00 178.00 177.46 2w54 n PRO 732 N -5.27 0.04 0.11 1.05 -0.04 -1.26 -2.77 135.00 126.85 2w54 n PRO 732 Ca 0.25 0.14 0.13 0.00 -0.04 0.00 0.00 63.50 63.98 2w54 n PRO 732 Cb 0.80 -1.56 0.64 0.00 -0.04 0.00 0.00 33.50 33.34 2w54 n PRO 732 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 2w54 h PHE 733 N 0.00 0.06 0.00 0.54 3.57 -1.17 -1.48 116.94 118.47 2w54 h PHE 733 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2w54 h PHE 733 Cb 0.42 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.14 2w54 h PHE 733 CO 0.00 0.03 0.00 1.28 -2.23 0.00 0.00 178.31 177.39 2w54 n LEU 734 N -4.46 0.00 0.23 0.59 4.32 -1.12 -2.54 117.00 114.02 2w54 n LEU 734 Ca 0.04 0.17 0.15 0.00 -0.02 0.00 0.00 56.01 56.35 2w54 n LEU 734 Cb 0.33 -0.17 0.49 0.00 -1.62 0.00 0.00 43.42 42.45 2w54 n LEU 734 CO 0.35 -0.01 0.92 -0.07 -1.22 0.00 0.00 177.39 177.35 2w54 h LEU 735 N 0.00 0.00 -1.20 2.23 3.38 -1.46 -3.03 115.31 115.23 2w54 h LEU 735 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2w54 h LEU 735 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2w54 h LEU 735 CO 0.00 0.00 0.00 1.23 0.09 0.00 0.00 178.44 179.76 2w54 h GLY 736 N 2.85 0.00 2.00 0.83 0.00 -1.67 -2.42 103.07 104.66 2w54 h GLY 736 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 2w54 h GLY 736 CO 0.00 0.00 -0.10 -2.22 0.00 0.00 0.00 176.54 174.22 2w54 h ILE 737 N 0.00 0.94 -0.42 2.60 2.04 -1.76 -1.96 117.51 118.95 2w54 h ILE 737 Ca 0.00 -0.35 -0.08 0.00 1.00 0.00 0.00 64.86 65.43 2w54 h ILE 737 Cb 0.26 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 37.52 2w54 h ILE 737 CO 0.00 0.10 -0.05 0.77 0.00 0.00 0.00 178.15 178.96 2w54 h SER 738 N 0.00 0.68 -0.72 1.72 4.64 -1.67 -1.46 113.55 116.73 2w54 h SER 738 Ca -0.00 -0.17 -0.02 0.00 -0.47 0.00 0.00 61.79 61.13 2w54 h SER 738 Cb 0.19 -0.18 -0.03 0.00 -0.31 0.00 0.00 62.40 62.07 2w54 h SER 738 CO 0.01 0.78 0.37 0.00 -0.87 0.00 0.00 176.83 177.13 2w54 h ALA 739 N 1.29 0.93 -0.38 5.18 0.00 -1.53 0.01 119.26 124.77 2w54 h ALA 739 Ca 0.12 -0.13 -0.14 0.00 0.00 0.00 0.00 54.91 54.76 2w54 h ALA 739 Cb 0.48 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2w54 h ALA 739 CO 0.03 0.47 -0.33 0.35 0.00 0.00 0.00 179.25 179.77 2w54 h PHE 740 N 1.01 1.00 -0.33 0.00 3.57 -1.45 -2.25 116.94 118.48 2w54 h PHE 740 Ca 0.25 -0.27 -0.07 0.00 3.53 0.00 0.00 57.97 61.41 2w54 h PHE 740 Cb 0.08 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.59 2w54 h PHE 740 CO 0.00 1.06 -0.11 -0.07 -2.23 0.00 0.00 178.31 176.96 2w54 h LEU 741 N 0.71 0.53 -0.13 0.59 4.07 -0.95 -2.10 115.31 118.03 2w54 h LEU 741 Ca 0.07 -0.14 -0.04 0.00 0.08 0.00 0.00 57.88 57.86 2w54 h LEU 741 Cb 0.89 -0.14 -0.00 0.00 1.08 0.00 0.00 40.66 42.48 2w54 h LEU 741 CO 0.08 0.68 -0.06 0.00 -1.08 0.00 0.00 178.44 178.06 2w54 h ALA 742 N 1.38 0.19 -0.86 1.53 0.00 -0.89 -0.93 119.26 119.68 2w54 h ALA 742 Ca 0.10 -0.26 0.17 0.00 0.00 0.00 0.00 54.91 54.91 2w54 h ALA 742 Cb 0.49 -0.05 -0.10 0.00 0.00 0.00 0.00 17.79 18.13 2w54 h ALA 742 CO 0.03 -0.02 0.42 -0.07 0.00 0.00 0.00 179.25 179.60 2w54 h LEU 743 N -0.06 0.47 -0.40 0.00 4.07 -1.31 0.12 115.31 118.19 2w54 h LEU 743 Ca 0.03 0.11 -0.03 0.00 0.08 0.00 0.00 57.88 58.07 2w54 h LEU 743 Cb 0.52 0.04 -0.02 0.00 1.08 0.00 0.00 40.66 42.29 2w54 h LEU 743 CO 0.02 0.16 0.13 -0.74 -1.08 0.00 0.00 178.44 176.92 2w54 h HIS 744 N 0.56 0.64 -0.75 1.13 -0.00 -1.23 -2.40 115.15 113.09 2w54 h HIS 744 Ca 0.49 -0.06 -0.02 0.00 -0.00 0.00 0.00 60.37 60.78 2w54 h HIS 744 Cb 0.76 -0.18 -0.04 0.00 -0.00 0.00 0.00 27.41 27.95 2w54 h HIS 744 CO -0.11 0.59 0.39 0.22 -0.00 0.00 0.00 177.93 179.03 2w54 h ASP 745 N 0.50 0.94 -0.67 3.26 3.58 -0.06 0.03 116.42 123.99 2w54 h ASP 745 Ca 0.13 -0.08 -0.03 0.00 0.42 0.00 0.00 57.03 57.47 2w54 h ASP 745 Cb 0.25 -0.24 -0.03 0.00 1.72 0.00 0.00 39.33 41.03 2w54 h ASP 745 CO -0.00 0.76 0.31 0.00 -2.88 0.00 0.00 179.24 177.43 2w54 h ALA 746 N 1.39 0.87 -0.65 -0.78 0.00 -0.73 -2.67 119.26 116.68 2w54 h ALA 746 Ca 0.26 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 2w54 h ALA 746 Cb 0.05 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 2w54 h ALA 746 CO -0.04 0.45 0.08 0.00 0.00 0.00 0.00 179.25 179.74 2w54 h ALA 748 N 1.05 1.31 -0.08 0.00 0.00 -0.72 -1.86 119.26 118.96 2w54 h ALA 748 Ca 0.20 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2w54 h ALA 748 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2w54 h ALA 748 CO 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 179.25 179.22 2w54 n ALA 749 N -2.19 2.50 0.35 0.00 0.00 -1.00 -3.72 120.51 116.45 2w54 n ALA 749 Ca -0.02 -0.17 0.04 0.00 0.00 0.00 0.00 53.44 53.29 2w54 n ALA 749 Cb 0.12 -1.04 -0.01 0.00 0.00 0.00 0.00 19.45 18.51 2w54 n ALA 749 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2w54 n GLY 751 N 0.91 0.98 0.19 0.00 0.00 -1.24 -4.28 105.19 101.74 2w54 n GLY 751 Ca 0.03 -0.78 0.14 0.00 0.00 0.00 0.00 46.02 45.41 2w54 n GLY 751 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2w54 h PRO 752 N 0.00 0.00 -7.12 1.61 0.13 -1.85 -3.45 132.00 121.31 2w54 h PRO 752 Ca 0.00 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.67 2w54 h PRO 752 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2w54 h PRO 752 CO 0.00 0.00 0.35 -1.01 -0.23 0.00 0.00 178.00 177.11 2w54 s HIS 753 N -3.44 3.40 -0.16 1.56 3.76 -1.16 -5.00 115.29 114.25 2w54 s HIS 753 Ca 0.03 1.50 -0.29 0.00 -0.15 0.00 0.00 55.06 56.16 2w54 s HIS 753 Cb 0.09 -2.80 -0.03 0.00 1.11 0.00 0.00 32.58 30.95 2w54 s HIS 753 CO 0.46 -0.25 1.52 -0.46 -0.85 0.00 0.00 174.74 175.16 2w54 s TRP 754 N -2.44 2.28 0.21 1.40 -0.11 -1.26 -4.29 118.94 114.73 2w54 s TRP 754 Ca 0.60 0.56 -0.10 0.00 1.22 0.00 0.00 56.10 58.38 2w54 s TRP 754 Cb -0.10 -3.84 0.20 0.00 -1.50 0.00 0.00 33.47 28.23 2w54 s TRP 754 CO 0.24 -2.85 1.85 -1.35 -4.62 0.00 0.00 176.95 170.21 2w54 h PRO 755 N 9.65 0.83 -5.51 5.86 0.11 -1.88 -3.39 132.00 137.67 2w54 h PRO 755 Ca -0.33 -0.05 -0.33 0.00 0.11 0.00 0.00 66.00 65.40 2w54 h PRO 755 Cb 1.15 -0.19 0.16 0.00 0.11 0.00 0.00 31.00 32.22 2w54 h PRO 755 CO 0.98 0.55 -0.72 -3.47 -0.21 0.00 0.00 178.00 175.13 2w54 n ASP 756 N -4.67 -2.84 -4.73 -2.05 2.03 -1.26 -4.56 116.55 98.47 2w54 n ASP 756 Ca 0.08 -0.58 -0.42 0.00 0.52 0.00 0.00 54.79 54.40 2w54 n ASP 756 Cb 0.09 -4.90 -0.03 0.00 -0.72 0.00 0.00 41.12 35.57 2w54 n ASP 756 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 2w54 s LEU 757 N -6.32 4.38 0.20 -2.67 2.96 -1.26 -4.89 118.68 111.08 2w54 s LEU 757 Ca 0.11 2.56 0.04 0.00 -0.22 0.00 0.00 54.13 56.62 2w54 s LEU 757 Cb -0.05 -3.61 -0.03 0.00 0.50 0.00 0.00 46.19 43.00 2w54 s LEU 757 CO 0.70 -0.70 0.30 -1.10 -1.32 0.00 0.00 176.35 174.22 2w54 s GLN 758 N 0.33 3.35 -0.11 1.98 -1.52 -1.26 -4.95 119.66 117.48 2w54 s GLN 758 Ca 0.63 -0.74 -0.09 0.00 -1.95 0.00 0.00 55.36 53.21 2w54 s GLN 758 Cb -0.41 -2.87 -0.04 0.00 -0.22 0.00 0.00 33.01 29.47 2w54 s GLN 758 CO 0.37 0.46 0.21 0.00 -0.25 0.00 0.00 175.29 176.08 2w54 s ALA 759 N -1.89 3.80 0.49 6.09 0.00 -0.65 -3.14 121.76 126.45 2w54 s ALA 759 Ca 0.34 -0.54 -0.19 0.00 0.00 0.00 0.00 51.96 51.56 2w54 s ALA 759 Cb -0.10 -2.11 -0.09 0.00 0.00 0.00 0.00 23.12 20.83 2w54 s ALA 759 CO 0.28 0.50 1.01 -1.25 0.00 0.00 0.00 175.76 176.29 2w54 s PRO 760 N -0.77 3.90 -1.28 0.00 0.04 -1.26 -2.45 135.00 133.18 2w54 s PRO 760 Ca 0.16 1.21 -0.07 0.00 0.04 0.00 0.00 61.00 62.35 2w54 s PRO 760 Cb -0.13 -2.12 0.04 0.00 0.04 0.00 0.00 34.50 32.33 2w54 s PRO 760 CO 0.05 -0.33 2.63 0.00 0.04 0.00 0.00 177.00 179.39 2w54 n ALA 761 N -1.08 6.98 -0.78 8.56 0.00 0.28 -4.77 120.51 129.70 2w54 n ALA 761 Ca 0.08 -3.75 -0.32 0.00 0.00 0.00 0.00 53.44 49.45 2w54 n ALA 761 Cb 0.53 -2.87 0.16 0.00 0.00 0.00 0.00 19.45 17.28 2w54 n ALA 761 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2w54 s THR 762 N -0.25 2.00 0.39 0.00 -4.23 -0.72 -4.53 115.64 108.29 2w54 s THR 762 Ca 0.59 0.00 0.17 0.00 -1.18 0.00 0.00 61.69 61.28 2w54 s THR 762 Cb 0.21 -2.10 0.38 0.00 1.34 0.00 0.00 72.50 72.32 2w54 s THR 762 CO -0.09 -0.00 1.76 -0.65 -0.54 0.00 0.00 174.62 175.09 2w54 h PRO 763 N -1.66 0.40 -0.39 3.99 0.11 -1.85 0.26 132.00 132.86 2w54 h PRO 763 Ca -0.44 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.58 2w54 h PRO 763 Cb 1.28 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2w54 h PRO 763 CO 0.42 0.27 -0.03 1.49 -0.21 0.00 0.00 178.00 179.94 2w54 h GLU 764 N 0.42 0.70 -0.57 1.05 4.81 -1.84 -1.72 114.58 117.42 2w54 h GLU 764 Ca 0.61 -0.24 -0.06 0.00 -0.13 0.00 0.00 59.36 59.55 2w54 h GLU 764 Cb 1.49 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.79 2w54 h GLU 764 CO -0.33 0.82 0.13 0.00 -0.73 0.00 0.00 179.01 178.90 2w54 h ALA 765 N 0.86 1.15 -0.04 2.92 0.00 -0.90 -0.00 119.26 123.26 2w54 h ALA 765 Ca 0.11 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2w54 h ALA 765 Cb 0.52 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 2w54 h ALA 765 CO 0.03 0.57 -0.00 0.28 0.00 0.00 0.00 179.25 180.12 2w54 h VAL 766 N 0.85 1.26 -0.84 0.00 2.07 -0.92 -2.06 116.25 116.62 2w54 h VAL 766 Ca 0.18 -0.80 0.01 0.00 0.82 0.00 0.00 66.70 66.91 2w54 h VAL 766 Cb 0.32 1.72 -0.04 0.00 -1.52 0.00 0.00 31.29 31.76 2w54 h VAL 766 CO 0.00 0.22 0.56 0.25 0.02 0.00 0.00 177.57 178.61 2w54 h LEU 767 N -0.23 0.96 -0.43 2.57 5.85 -1.05 0.27 115.31 123.24 2w54 h LEU 767 Ca 0.01 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.73 2w54 h LEU 767 Cb 0.35 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.11 2w54 h LEU 767 CO 0.00 0.69 0.25 0.00 -0.34 0.00 0.00 178.44 179.05 2w54 h ALA 768 N 1.48 0.55 -0.48 1.25 0.00 -0.96 -2.17 119.26 118.93 2w54 h ALA 768 Ca 0.31 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.13 2w54 h ALA 768 Cb -0.12 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 2w54 h ALA 768 CO -0.07 -0.07 -0.01 0.00 0.00 0.00 0.00 179.25 179.11 2w54 h ALA 769 N 1.19 0.64 -0.19 0.00 0.00 -0.50 -2.76 119.26 117.65 2w54 h ALA 769 Ca 0.17 -0.28 0.05 0.00 0.00 0.00 0.00 54.91 54.85 2w54 h ALA 769 Cb 0.02 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 17.57 2w54 h ALA 769 CO -0.08 0.45 -0.21 0.28 0.00 0.00 0.00 179.25 179.69 2w54 h VAL 770 N 0.70 0.47 0.00 0.00 2.07 -0.36 -2.02 116.25 117.11 2w54 h VAL 770 Ca 0.13 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.64 2w54 h VAL 770 Cb 0.52 0.47 -0.00 0.00 -1.52 0.00 0.00 31.29 30.75 2w54 h VAL 770 CO 0.03 0.00 -0.09 0.03 0.02 0.00 0.00 177.57 177.55 2w54 h ARG 771 N -0.23 0.00 -0.06 1.57 3.08 -1.31 0.14 114.38 117.57 2w54 h ARG 771 Ca 0.12 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.09 2w54 h ARG 771 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.46 2w54 h ARG 771 CO -0.32 0.09 -0.28 0.00 -1.07 0.00 0.00 179.97 178.39 2w54 h ARG 772 N 0.00 0.29 -0.71 0.04 3.08 -1.14 0.75 114.38 116.69 2w54 h ARG 772 Ca -0.00 -0.24 0.04 0.00 0.07 0.00 0.00 59.98 59.85 2w54 h ARG 772 Cb 0.42 0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.47 2w54 h ARG 772 CO 0.01 0.89 0.44 0.00 -1.07 0.00 0.00 179.97 180.23 2w54 h ALA 773 N 0.41 0.93 0.00 0.04 0.00 -0.67 -1.28 119.26 118.69 2w54 h ALA 773 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2w54 h ALA 773 Cb 0.94 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2w54 h ALA 773 CO 0.06 0.20 0.00 0.39 0.00 0.00 0.00 179.25 179.90 2w54 n GLU 774 N -4.68 0.14 -3.19 0.00 1.02 0.42 -2.97 120.64 111.38 2w54 n GLU 774 Ca 0.08 0.30 -0.15 0.00 -0.02 0.00 0.00 57.16 57.37 2w54 n GLU 774 Cb 0.10 -1.73 0.06 0.00 -0.02 0.00 0.00 31.44 29.85 2w54 n GLU 774 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2w54 n GLY 775 N 0.37 -0.11 2.98 0.62 0.00 -0.03 -4.97 105.19 104.04 2w54 n GLY 775 Ca 0.04 -0.04 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 2w54 n GLY 775 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w54 n ARG 776 N -3.53 3.57 -0.07 1.61 1.74 0.24 -5.01 116.66 115.22 2w54 n ARG 776 Ca -0.06 -4.55 0.00 0.00 -0.77 0.00 0.00 57.85 52.47 2w54 n ARG 776 Cb 0.57 -2.45 0.00 0.00 -1.02 0.00 0.00 32.46 29.56 2w54 n ARG 776 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11