#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bqm n ILE 2 N 0.00 1.81 -3.75 0.52 -5.35 -1.26 -4.48 119.36 106.85 1bqm n ILE 2 Ca 0.00 -0.50 -0.28 0.00 -0.27 0.00 0.00 62.75 61.70 1bqm n ILE 2 Cb 0.00 -0.02 -0.03 0.00 -1.74 0.00 0.00 39.64 37.84 1bqm n ILE 2 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 1bqm s SER 3 N -0.99 6.39 -0.67 7.28 0.15 -0.20 -4.70 113.70 120.96 1bqm s SER 3 Ca 0.63 0.38 -0.02 0.00 0.70 0.00 0.00 55.95 57.64 1bqm s SER 3 Cb -0.88 -2.00 0.44 0.00 -1.71 0.00 0.00 66.02 61.87 1bqm s SER 3 CO 0.57 0.01 2.01 -0.81 1.20 0.00 0.00 173.24 176.22 1bqm n PRO 4 N -0.43 2.73 -3.63 5.44 -0.04 -1.26 -4.61 135.00 133.20 1bqm n PRO 4 Ca -0.05 -3.34 -0.32 0.00 -0.04 0.00 0.00 63.50 59.75 1bqm n PRO 4 Cb 0.53 -2.29 -0.05 0.00 -0.04 0.00 0.00 33.50 31.65 1bqm n PRO 4 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1bqm s ILE 5 N -4.85 5.13 -0.28 0.52 1.10 -1.26 -5.01 121.20 116.56 1bqm s ILE 5 Ca 0.63 0.19 -0.32 0.00 -0.51 0.00 0.00 60.65 60.64 1bqm s ILE 5 Cb 0.50 -3.63 -0.09 0.00 0.15 0.00 0.00 42.46 39.40 1bqm s ILE 5 CO -0.04 0.10 2.19 -0.62 -2.11 0.00 0.00 174.94 174.46 1bqm n GLU 6 N 0.31 1.53 -1.52 3.50 4.71 -1.26 -4.85 120.64 123.06 1bqm n GLU 6 Ca -0.04 0.43 -0.30 0.00 -0.01 0.00 0.00 57.16 57.23 1bqm n GLU 6 Cb 0.52 -2.82 0.08 0.00 -1.01 0.00 0.00 31.44 28.20 1bqm n GLU 6 CO 0.00 0.00 0.00 -0.08 0.09 0.00 0.00 177.13 177.14 1bqm s THR 7 N 7.60 3.50 -0.09 2.62 -1.32 -1.26 -5.01 115.64 121.68 1bqm s THR 7 Ca 1.05 0.49 -0.01 0.00 -1.21 0.00 0.00 61.69 62.00 1bqm s THR 7 Cb -0.62 -3.19 -0.03 0.00 -1.51 0.00 0.00 72.50 67.15 1bqm s THR 7 CO 0.43 -0.63 -0.02 -0.69 -2.21 0.00 0.00 174.62 171.50 1bqm s VAL 8 N -3.07 4.13 -0.51 5.08 1.01 -1.26 -4.96 120.40 120.82 1bqm s VAL 8 Ca 0.60 -0.31 -0.28 0.00 0.00 0.00 0.00 61.98 61.98 1bqm s VAL 8 Cb -0.15 -2.73 0.02 0.00 0.00 0.00 0.00 36.38 33.52 1bqm s VAL 8 CO 0.55 0.59 1.37 -2.16 0.00 0.00 0.00 175.10 175.45 1bqm s PRO 9 N -0.74 3.45 0.02 2.72 0.04 -1.26 -3.65 135.00 135.58 1bqm s PRO 9 Ca 0.11 0.60 0.01 0.00 0.04 0.00 0.00 61.00 61.76 1bqm s PRO 9 Cb -0.11 -4.06 -0.04 0.00 0.04 0.00 0.00 34.50 30.33 1bqm s PRO 9 CO 0.02 -1.74 0.07 0.08 0.04 0.00 0.00 177.00 175.47 1bqm s VAL 10 N 5.61 4.63 0.13 -0.36 1.01 -1.26 -5.11 120.40 125.04 1bqm s VAL 10 Ca 0.54 -0.53 -0.01 0.00 0.00 0.00 0.00 61.98 61.98 1bqm s VAL 10 Cb -0.11 -3.15 -0.04 0.00 0.00 0.00 0.00 36.38 33.08 1bqm s VAL 10 CO 0.28 0.28 0.05 -0.54 0.00 0.00 0.00 175.10 175.17 1bqm s LYS 11 N -1.92 0.91 -0.01 2.72 1.02 -1.26 -4.77 119.74 116.42 1bqm s LYS 11 Ca 0.25 -1.42 0.00 0.00 0.02 0.00 0.00 55.97 54.81 1bqm s LYS 11 Cb -0.12 0.21 -0.04 0.00 -0.52 0.00 0.00 37.83 37.37 1bqm s LYS 11 CO 0.16 -0.24 0.04 -0.51 -0.92 0.00 0.00 175.35 173.88 1bqm s LEU 12 N -3.04 3.72 0.16 3.17 1.43 -1.26 0.08 118.68 122.94 1bqm s LEU 12 Ca 0.23 0.08 -0.33 0.00 -1.03 0.00 0.00 54.13 53.08 1bqm s LEU 12 Cb 0.07 -2.13 -0.16 0.00 0.03 0.00 0.00 46.19 44.01 1bqm s LEU 12 CO 0.01 0.28 1.21 0.29 0.23 0.00 0.00 176.35 178.38 1bqm n LYS 13 N 1.35 1.23 -1.61 1.70 5.02 -0.70 -4.77 118.16 120.39 1bqm n LYS 13 Ca -0.14 0.44 -0.44 0.00 -2.02 0.00 0.00 58.31 56.15 1bqm n LYS 13 Cb 0.53 -1.97 -0.01 0.00 -0.02 0.00 0.00 35.03 33.55 1bqm n LYS 13 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1bqm n PRO 14 N 1.92 1.47 0.00 1.97 -0.04 -1.26 -1.73 135.00 137.33 1bqm n PRO 14 Ca 0.15 0.52 0.00 0.00 -0.04 0.00 0.00 63.50 64.13 1bqm n PRO 14 Cb 0.24 -1.93 0.00 0.00 -0.04 0.00 0.00 33.50 31.77 1bqm n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1bqm n GLY 15 N 1.15 3.23 4.01 0.55 0.00 -1.26 -5.04 105.19 107.82 1bqm n GLY 15 Ca 0.09 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.91 1bqm n GLY 15 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1bqm s MET 16 N -0.51 2.30 0.08 1.61 -1.94 -0.70 -5.14 119.30 115.00 1bqm s MET 16 Ca 0.00 -1.33 -0.10 0.00 -1.71 0.00 0.00 55.69 52.56 1bqm s MET 16 Cb 0.00 -2.58 0.00 0.00 2.01 0.00 0.00 34.83 34.27 1bqm s MET 16 CO 0.00 -0.86 0.21 0.34 -0.01 0.00 0.00 175.02 174.71 1bqm s ASP 17 N -4.59 0.06 0.90 3.03 2.15 -1.26 -4.95 116.67 112.02 1bqm s ASP 17 Ca 0.61 -0.55 -0.11 0.00 0.43 0.00 0.00 52.55 52.93 1bqm s ASP 17 Cb -0.07 0.34 0.13 0.00 -0.30 0.00 0.00 42.92 43.03 1bqm s ASP 17 CO 0.39 -0.70 1.14 0.61 -0.17 0.00 0.00 175.17 176.43 1bqm n GLY 18 N 0.08 -0.35 3.72 2.66 0.00 -1.26 -4.94 105.19 105.11 1bqm n GLY 18 Ca -0.16 -0.67 -0.30 0.00 0.00 0.00 0.00 46.02 44.89 1bqm n GLY 18 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1bqm s PRO 19 N -4.50 1.43 -0.23 1.61 0.04 -1.26 -5.02 135.00 127.06 1bqm s PRO 19 Ca 0.68 0.91 -0.10 0.00 0.04 0.00 0.00 61.00 62.53 1bqm s PRO 19 Cb -0.24 -1.82 0.09 0.00 0.04 0.00 0.00 34.50 32.57 1bqm s PRO 19 CO 0.57 -2.15 0.52 -1.59 0.04 0.00 0.00 177.00 174.39 1bqm s LYS 20 N -4.92 0.46 0.00 4.56 -2.85 -1.26 -3.51 119.74 112.22 1bqm s LYS 20 Ca 0.63 1.13 0.00 0.00 -1.00 0.00 0.00 55.97 56.73 1bqm s LYS 20 Cb -0.18 0.38 0.00 0.00 -2.06 0.00 0.00 37.83 35.97 1bqm s LYS 20 CO 0.57 -0.20 0.00 0.28 0.10 0.00 0.00 175.35 176.09 1bqm n VAL 21 N 5.02 0.00 0.00 1.79 0.31 -1.26 -4.87 118.33 119.31 1bqm n VAL 21 Ca -0.14 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.19 1bqm n VAL 21 Cb 0.52 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.45 1bqm n VAL 21 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1bqm n LYS 22 N 0.00 0.00 -2.36 5.55 5.02 -1.26 -4.71 118.16 120.40 1bqm n LYS 22 Ca 0.00 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.02 1bqm n LYS 22 Cb 0.00 0.00 0.04 0.00 -0.02 0.00 0.00 35.03 35.05 1bqm n LYS 22 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 1bqm s GLN 23 N 0.00 2.83 -0.66 1.97 -2.07 -1.26 -4.96 119.66 115.51 1bqm s GLN 23 Ca 0.00 -0.03 -0.26 0.00 -1.82 0.00 0.00 55.36 53.25 1bqm s GLN 23 Cb 0.00 -2.26 -0.12 0.00 -1.09 0.00 0.00 33.01 29.54 1bqm s GLN 23 CO 0.00 -0.77 2.43 -2.67 -1.32 0.00 0.00 175.29 172.96 1bqm n TRP 24 N -2.63 1.18 -1.55 9.60 -0.00 -1.26 -4.81 117.44 117.97 1bqm n TRP 24 Ca 0.05 0.10 -0.62 0.00 -0.00 0.00 0.00 57.50 57.03 1bqm n TRP 24 Cb 0.58 -2.49 -0.10 0.00 -0.00 0.00 0.00 31.31 29.30 1bqm n TRP 24 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 177.69 175.39 1bqm n PRO 25 N 8.71 0.00 -2.70 -2.67 -0.02 -1.26 -4.94 135.00 132.12 1bqm n PRO 25 Ca 0.45 0.00 -0.22 0.00 -2.02 0.00 0.00 63.50 61.70 1bqm n PRO 25 Cb 0.44 -1.41 0.03 0.00 -0.02 0.00 0.00 33.50 32.54 1bqm n PRO 25 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1bqm s LEU 26 N 3.43 3.35 0.35 2.45 2.01 -1.26 -5.13 118.68 123.89 1bqm s LEU 26 Ca 1.02 0.17 0.08 0.00 0.01 0.00 0.00 54.13 55.42 1bqm s LEU 26 Cb -1.41 -3.03 -0.05 0.00 0.01 0.00 0.00 46.19 41.71 1bqm s LEU 26 CO 0.74 -1.03 0.11 0.42 1.01 0.00 0.00 176.35 177.59 1bqm s THR 27 N -2.75 2.78 0.00 5.49 -4.23 -1.26 -4.50 115.64 111.17 1bqm s THR 27 Ca 0.54 -1.79 0.00 0.00 -1.18 0.00 0.00 61.69 59.27 1bqm s THR 27 Cb -0.10 -2.92 0.00 0.00 1.34 0.00 0.00 72.50 70.82 1bqm s THR 27 CO 0.39 -0.16 0.00 -1.84 -0.54 0.00 0.00 174.62 172.47 1bqm n GLU 28 N -1.10 0.00 -0.22 3.99 -0.00 -1.26 -1.34 120.64 120.71 1bqm n GLU 28 Ca -0.03 0.00 -0.00 0.00 -0.00 0.00 0.00 57.16 57.13 1bqm n GLU 28 Cb 0.62 0.00 0.11 0.00 -0.00 0.00 0.00 31.44 32.17 1bqm n GLU 28 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.13 178.18 1bqm h GLU 29 N 0.00 0.52 -0.53 3.44 -0.00 -1.98 -1.50 114.58 114.53 1bqm h GLU 29 Ca 0.00 -0.03 -0.04 0.00 -0.00 0.00 0.00 59.36 59.29 1bqm h GLU 29 Cb 0.00 -0.12 -0.03 0.00 -0.00 0.00 0.00 28.75 28.61 1bqm h GLU 29 CO 0.00 0.34 0.17 0.87 -0.00 0.00 0.00 179.01 180.39 1bqm h LYS 30 N 0.54 0.79 0.00 1.06 1.79 -1.62 -1.11 116.57 118.02 1bqm h LYS 30 Ca 0.31 -0.14 -0.11 0.00 -2.18 0.00 0.00 60.65 58.53 1bqm h LYS 30 Cb 0.32 -0.13 -0.02 0.00 -1.58 0.00 0.00 32.23 30.82 1bqm h LYS 30 CO -0.25 0.69 -0.52 0.82 -1.08 0.00 0.00 179.45 179.10 1bqm h ILE 31 N 0.77 1.14 0.00 1.86 2.04 -1.18 -2.24 117.51 119.90 1bqm h ILE 31 Ca 0.18 -1.96 -0.01 0.00 1.00 0.00 0.00 64.86 64.07 1bqm h ILE 31 Cb 0.23 2.13 -0.00 0.00 -0.74 0.00 0.00 36.82 38.43 1bqm h ILE 31 CO -0.01 0.51 -0.03 0.11 0.00 0.00 0.00 178.15 178.73 1bqm h LYS 32 N 0.00 0.00 0.00 2.37 1.79 -0.22 0.37 116.57 120.88 1bqm h LYS 32 Ca -0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 1bqm h LYS 32 Cb 1.09 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.74 1bqm h LYS 32 CO 0.07 0.03 -0.32 0.00 -1.08 0.00 0.00 179.45 178.15 1bqm n ALA 33 N -2.11 3.10 -0.09 3.86 0.00 -0.62 -3.55 120.51 121.10 1bqm n ALA 33 Ca 0.01 -0.26 -0.11 0.00 0.00 0.00 0.00 53.44 53.08 1bqm n ALA 33 Cb 0.37 -1.25 -0.09 0.00 0.00 0.00 0.00 19.45 18.48 1bqm n ALA 33 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1bqm n LEU 34 N -1.51 2.38 -0.06 0.00 4.77 -0.83 -4.22 117.00 117.53 1bqm n LEU 34 Ca 0.06 -0.08 -0.04 0.00 -0.03 0.00 0.00 56.01 55.92 1bqm n LEU 34 Cb 0.34 -0.44 0.17 0.00 -2.33 0.00 0.00 43.42 41.16 1bqm n LEU 34 CO 0.32 0.71 0.82 0.58 -1.33 0.00 0.00 177.39 178.50 1bqm h VAL 35 N 0.00 1.25 0.16 4.08 2.07 -1.09 -0.13 116.25 122.59 1bqm h VAL 35 Ca -0.40 -1.10 -0.01 0.00 0.82 0.00 0.00 66.70 66.01 1bqm h VAL 35 Cb 1.68 1.05 0.00 0.00 -1.52 0.00 0.00 31.29 32.50 1bqm h VAL 35 CO -0.05 0.37 -0.08 -0.08 0.02 0.00 0.00 177.57 177.76 1bqm h GLU 36 N 0.63 -0.21 -0.07 1.57 4.22 -1.79 -2.05 114.58 116.88 1bqm h GLU 36 Ca 0.11 0.01 -0.01 0.00 0.08 0.00 0.00 59.36 59.55 1bqm h GLU 36 Cb 0.54 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.83 1bqm h GLU 36 CO 0.03 0.03 -0.01 0.82 -2.18 0.00 0.00 179.01 177.70 1bqm h ILE 37 N -0.42 1.27 -0.79 2.32 5.03 -1.71 -3.29 117.51 119.92 1bqm h ILE 37 Ca -0.02 -0.85 -0.04 0.00 -0.12 0.00 0.00 64.86 63.83 1bqm h ILE 37 Cb 0.33 1.69 -0.04 0.00 -3.03 0.00 0.00 36.82 35.78 1bqm h ILE 37 CO 0.04 0.23 0.33 0.00 -0.68 0.00 0.00 178.15 178.07 1bqm n THR 39 N -4.29 0.05 -0.50 0.00 -1.04 -0.77 -1.92 114.28 105.81 1bqm n THR 39 Ca 0.07 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 1bqm n THR 39 Cb 0.17 -0.03 0.00 0.00 -1.82 0.00 0.00 70.33 68.66 1bqm n THR 39 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1bqm n GLU 40 N -0.44 -0.48 -0.03 -2.82 0.00 -1.12 -4.34 120.64 111.41 1bqm n GLU 40 Ca 0.05 -0.25 -0.01 0.00 0.00 0.00 0.00 57.16 56.94 1bqm n GLU 40 Cb 0.05 -0.75 -0.13 0.00 0.00 0.00 0.00 31.44 30.61 1bqm n GLU 40 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.13 177.01 1bqm n MET 41 N -0.00 0.66 0.07 5.31 1.56 -0.78 -3.47 117.12 120.47 1bqm n MET 41 Ca 0.00 0.04 -0.08 0.00 -0.27 0.00 0.00 57.70 57.38 1bqm n MET 41 Cb 0.13 -1.63 -0.10 0.00 2.15 0.00 0.00 33.22 33.76 1bqm n MET 41 CO 0.00 0.00 0.00 1.49 -0.73 0.00 0.00 175.97 176.73 1bqm h GLU 42 N 0.00 0.05 -0.18 2.12 4.81 -1.62 -0.10 114.58 119.67 1bqm h GLU 42 Ca -0.27 -0.09 -0.11 0.00 -0.13 0.00 0.00 59.36 58.76 1bqm h GLU 42 Cb 1.70 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 31.10 1bqm h GLU 42 CO 0.03 1.02 -0.35 0.87 -0.73 0.00 0.00 179.01 179.84 1bqm h LYS 43 N 0.02 0.38 -0.44 1.92 1.57 -1.76 -0.53 116.57 117.72 1bqm h LYS 43 Ca -0.03 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 1bqm h LYS 43 Cb 1.76 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 34.06 1bqm h LYS 43 CO 0.14 0.68 0.00 0.39 -0.57 0.00 0.00 179.45 180.09 1bqm n GLU 44 N -4.06 2.06 -1.58 3.15 1.02 -1.18 -4.92 120.64 115.13 1bqm n GLU 44 Ca -0.01 -1.50 -0.18 0.00 -0.02 0.00 0.00 57.16 55.45 1bqm n GLU 44 Cb 0.46 -1.38 -0.07 0.00 -0.02 0.00 0.00 31.44 30.43 1bqm n GLU 44 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1bqm n GLY 45 N 1.07 1.66 0.08 0.62 0.00 -0.21 -3.51 105.19 104.90 1bqm n GLY 45 Ca 0.14 -0.15 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 1bqm n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bqm h LYS 46 N 0.00 0.05 0.00 1.61 6.56 -1.24 -3.44 116.57 120.11 1bqm h LYS 46 Ca -0.38 -0.08 -0.55 0.00 -1.06 0.00 0.00 60.65 58.59 1bqm h LYS 46 Cb 1.19 0.03 -0.12 0.00 -0.57 0.00 0.00 32.23 32.76 1bqm h LYS 46 CO 0.54 0.98 -0.45 0.44 -2.06 0.00 0.00 179.45 178.90 1bqm n ILE 47 N -3.45 0.00 -3.65 1.86 -5.35 -1.23 -0.26 119.36 107.28 1bqm n ILE 47 Ca -0.01 -2.27 -0.05 0.00 -0.27 0.00 0.00 62.75 60.14 1bqm n ILE 47 Cb 0.90 0.74 -0.06 0.00 -1.74 0.00 0.00 39.64 39.48 1bqm n ILE 47 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 1bqm s SER 48 N -3.45 -1.00 -1.17 7.28 0.01 -0.25 -4.53 113.70 110.58 1bqm s SER 48 Ca 0.16 1.52 -0.20 0.00 1.31 0.00 0.00 55.95 58.73 1bqm s SER 48 Cb 0.01 1.72 0.06 0.00 0.21 0.00 0.00 66.02 68.02 1bqm s SER 48 CO 0.11 -0.23 1.61 -1.59 0.41 0.00 0.00 173.24 173.55 1bqm s LYS 49 N 2.13 3.81 -0.30 12.44 -2.85 -1.26 0.21 119.74 133.92 1bqm s LYS 49 Ca -0.08 -1.60 -0.17 0.00 -1.00 0.00 0.00 55.97 53.11 1bqm s LYS 49 Cb -0.08 -5.46 -0.02 0.00 -2.06 0.00 0.00 37.83 30.21 1bqm s LYS 49 CO -0.19 -2.24 0.49 -1.50 0.10 0.00 0.00 175.35 172.01 1bqm s ILE 50 N 4.58 5.06 0.00 3.79 2.07 -0.33 -4.88 121.20 131.49 1bqm s ILE 50 Ca 0.50 0.61 0.00 0.00 -1.41 0.00 0.00 60.65 60.35 1bqm s ILE 50 Cb 0.02 -3.86 0.00 0.00 0.13 0.00 0.00 42.46 38.75 1bqm s ILE 50 CO -0.00 -0.03 0.00 0.61 -1.91 0.00 0.00 174.94 173.61 1bqm n GLY 51 N 4.61 1.63 3.44 1.50 0.00 -1.26 -4.52 105.19 110.58 1bqm n GLY 51 Ca -0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.68 1bqm n GLY 51 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1bqm s PRO 52 N 0.00 -1.59 0.00 1.61 0.04 -1.26 -4.20 135.00 129.60 1bqm s PRO 52 Ca 0.00 0.55 0.00 0.00 0.04 0.00 0.00 61.00 61.59 1bqm s PRO 52 Cb 0.00 -1.50 0.00 0.00 0.04 0.00 0.00 34.50 33.04 1bqm s PRO 52 CO 0.00 -4.09 0.00 0.39 0.04 0.00 0.00 177.00 173.34 1bqm n GLU 53 N -5.14 0.00 -3.97 4.56 -0.58 -1.26 -4.96 120.64 109.30 1bqm n GLU 53 Ca 0.06 0.00 -0.34 0.00 -0.42 0.00 0.00 57.16 56.45 1bqm n GLU 53 Cb 0.56 -3.12 -0.14 0.00 -0.57 0.00 0.00 31.44 28.17 1bqm n GLU 53 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 1bqm s ASN 54 N -2.75 4.18 0.13 1.62 2.47 -1.26 -5.01 114.94 114.31 1bqm s ASN 54 Ca 0.00 -0.74 0.26 0.00 0.42 0.00 0.00 52.86 52.79 1bqm s ASN 54 Cb 0.00 -1.66 0.68 0.00 -1.45 0.00 0.00 41.25 38.82 1bqm s ASN 54 CO 0.00 -0.09 1.61 -2.65 -3.72 0.00 0.00 177.10 172.25 1bqm n PRO 55 N 4.69 0.21 0.00 0.43 -0.02 -1.26 -4.98 135.00 134.08 1bqm n PRO 55 Ca -0.17 0.12 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 1bqm n PRO 55 Cb 0.48 -1.69 0.00 0.00 -0.02 0.00 0.00 33.50 32.27 1bqm n PRO 55 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1bqm n TYR 56 N -2.03 -1.05 0.00 6.00 4.02 -1.26 -4.88 117.16 117.96 1bqm n TYR 56 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.94 1bqm n TYR 56 Cb 0.41 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.73 1bqm n TYR 56 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 1bqm n ASN 57 N -0.75 0.00 -3.57 7.72 2.85 -1.23 -4.66 115.26 115.61 1bqm n ASN 57 Ca 0.00 0.00 -0.09 0.00 -0.11 0.00 0.00 54.58 54.38 1bqm n ASN 57 Cb 0.00 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 40.98 1bqm n ASN 57 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 1bqm s THR 58 N -2.00 0.00 0.45 -0.44 2.01 -0.90 -4.21 115.64 110.54 1bqm s THR 58 Ca 0.00 0.00 -0.04 0.00 0.31 0.00 0.00 61.69 61.96 1bqm s THR 58 Cb 0.00 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.47 1bqm s THR 58 CO 0.00 0.00 0.73 -2.16 -0.69 0.00 0.00 174.62 172.50 1bqm s PRO 59 N -1.55 3.53 -0.19 4.92 0.04 -1.26 -3.89 135.00 136.60 1bqm s PRO 59 Ca 0.01 0.07 0.01 0.00 0.04 0.00 0.00 61.00 61.14 1bqm s PRO 59 Cb -0.01 -2.45 0.04 0.00 0.04 0.00 0.00 34.50 32.12 1bqm s PRO 59 CO -0.02 -0.11 -0.13 0.08 0.04 0.00 0.00 177.00 176.86 1bqm s VAL 60 N -2.63 1.74 -0.14 -0.36 1.01 -1.26 -2.99 120.40 115.77 1bqm s VAL 60 Ca 0.46 -0.97 -0.20 0.00 0.00 0.00 0.00 61.98 61.27 1bqm s VAL 60 Cb -0.10 -1.74 -0.04 0.00 0.00 0.00 0.00 36.38 34.51 1bqm s VAL 60 CO 0.42 0.28 0.55 -0.36 0.00 0.00 0.00 175.10 176.00 1bqm s PHE 61 N 1.37 3.47 -0.86 5.22 0.40 -0.09 -4.96 117.98 122.53 1bqm s PHE 61 Ca 0.00 0.93 -0.03 0.00 -0.60 0.00 0.00 56.93 57.24 1bqm s PHE 61 Cb -0.15 -2.67 0.20 0.00 0.51 0.00 0.00 43.02 40.91 1bqm s PHE 61 CO -0.09 0.03 2.31 0.00 0.70 0.00 0.00 175.22 178.18 1bqm n ALA 62 N 4.18 6.48 -2.12 5.36 0.00 -1.26 -0.59 120.51 132.56 1bqm n ALA 62 Ca -0.04 -3.85 -0.34 0.00 0.00 0.00 0.00 53.44 49.20 1bqm n ALA 62 Cb 0.51 -2.25 -0.04 0.00 0.00 0.00 0.00 19.45 17.67 1bqm n ALA 62 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1bqm s ILE 63 N -3.15 3.46 -1.38 0.00 -1.09 -1.18 -4.83 121.20 113.03 1bqm s ILE 63 Ca 0.52 -0.08 -0.14 0.00 -2.23 0.00 0.00 60.65 58.72 1bqm s ILE 63 Cb 0.32 -4.13 0.07 0.00 -1.58 0.00 0.00 42.46 37.14 1bqm s ILE 63 CO -0.23 -1.08 2.02 0.29 -1.23 0.00 0.00 174.94 174.71 1bqm n LYS 64 N 9.05 3.08 -1.53 2.79 5.02 -1.25 -4.58 118.16 130.74 1bqm n LYS 64 Ca 0.28 -2.97 -0.49 0.00 -2.02 0.00 0.00 58.31 53.11 1bqm n LYS 64 Cb 0.50 -3.26 -0.04 0.00 -0.02 0.00 0.00 35.03 32.20 1bqm n LYS 64 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1bqm n LYS 65 N 6.24 0.82 0.00 1.97 -0.00 -1.26 -3.26 118.16 122.67 1bqm n LYS 65 Ca 0.49 0.29 0.00 0.00 -0.00 0.00 0.00 58.31 59.08 1bqm n LYS 65 Cb 0.40 -1.65 0.00 0.00 -0.00 0.00 0.00 35.03 33.78 1bqm n LYS 65 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1bqm n LYS 66 N 1.34 0.00 0.00 -1.58 5.02 -1.26 -3.37 118.16 118.31 1bqm n LYS 66 Ca 0.15 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.44 1bqm n LYS 66 Cb 0.24 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.25 1bqm n LYS 66 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1bqm n ASP 67 N 2.60 0.00 -4.75 4.39 3.85 -1.20 -5.17 116.55 116.27 1bqm n ASP 67 Ca 0.00 0.00 -0.31 0.00 -0.71 0.00 0.00 54.79 53.77 1bqm n ASP 67 Cb 0.00 0.00 0.10 0.00 -1.35 0.00 0.00 41.12 39.87 1bqm n ASP 67 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.20 175.75 1bqm s SER 68 N 0.00 4.22 0.09 -1.12 0.01 -1.22 -4.97 113.70 110.71 1bqm s SER 68 Ca 0.00 1.96 0.02 0.00 1.31 0.00 0.00 55.95 59.24 1bqm s SER 68 Cb 0.00 -2.54 -0.24 0.00 0.21 0.00 0.00 66.02 63.45 1bqm s SER 68 CO 0.00 -2.23 1.17 0.71 0.41 0.00 0.00 173.24 173.30 1bqm h THR 69 N -1.09 1.56 -3.38 1.44 1.35 -1.99 -3.44 112.91 107.36 1bqm h THR 69 Ca -0.44 -3.22 -0.65 0.00 -0.55 0.00 0.00 66.41 61.55 1bqm h THR 69 Cb 1.24 2.86 -0.26 0.00 -1.73 0.00 0.00 68.15 70.26 1bqm h THR 69 CO 0.49 0.91 -0.71 -0.54 -0.25 0.00 0.00 175.52 175.43 1bqm s LYS 70 N -2.68 3.47 0.25 4.72 3.01 -1.26 -5.09 119.74 122.17 1bqm s LYS 70 Ca -0.02 -0.60 -0.31 0.00 -1.01 0.00 0.00 55.97 54.04 1bqm s LYS 70 Cb 0.09 -2.95 -0.13 0.00 -1.01 0.00 0.00 37.83 33.83 1bqm s LYS 70 CO 0.85 -0.02 1.46 0.91 0.51 0.00 0.00 175.35 179.06 1bqm n TRP 71 N 4.27 2.33 -4.15 3.18 8.01 -1.26 -5.02 117.44 124.80 1bqm n TRP 71 Ca -0.18 0.38 -0.17 0.00 -1.31 0.00 0.00 57.50 56.22 1bqm n TRP 71 Cb 0.52 -2.50 -0.12 0.00 -2.01 0.00 0.00 31.31 27.20 1bqm n TRP 71 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.69 177.71 1bqm s ARG 72 N -0.38 0.75 0.50 -0.99 0.52 -1.26 -4.99 118.95 113.10 1bqm s ARG 72 Ca 0.67 -0.89 0.02 0.00 -0.52 0.00 0.00 55.73 55.02 1bqm s ARG 72 Cb -0.61 -0.70 -0.01 0.00 0.52 0.00 0.00 34.95 34.14 1bqm s ARG 72 CO 0.49 0.15 0.05 -1.59 0.02 0.00 0.00 175.30 174.42 1bqm s LYS 73 N -1.66 2.18 -0.30 3.54 -2.85 -1.26 -3.12 119.74 116.27 1bqm s LYS 73 Ca -0.04 -2.32 -0.10 0.00 -1.00 0.00 0.00 55.97 52.51 1bqm s LYS 73 Cb -0.10 -1.62 0.16 0.00 -2.06 0.00 0.00 37.83 34.22 1bqm s LYS 73 CO 0.02 -0.36 0.81 -1.17 0.10 0.00 0.00 175.35 174.75 1bqm s LEU 74 N -3.91 -0.91 -0.36 2.77 0.20 0.24 -4.80 118.68 111.91 1bqm s LEU 74 Ca 0.12 0.98 -0.20 0.00 0.69 0.00 0.00 54.13 55.72 1bqm s LEU 74 Cb 0.02 1.93 0.00 0.00 -0.43 0.00 0.00 46.19 47.71 1bqm s LEU 74 CO 0.07 -0.17 0.63 -0.69 -0.29 0.00 0.00 176.35 175.89 1bqm s VAL 75 N 2.75 4.89 -0.58 1.68 1.01 -1.26 -0.91 120.40 127.97 1bqm s VAL 75 Ca 0.02 0.53 -0.28 0.00 0.00 0.00 0.00 61.98 62.25 1bqm s VAL 75 Cb -0.10 -4.08 0.03 0.00 0.00 0.00 0.00 36.38 32.22 1bqm s VAL 75 CO -0.18 -0.33 1.26 -1.81 0.00 0.00 0.00 175.10 174.04 1bqm s ASP 76 N 1.81 6.35 -1.03 3.32 1.01 -1.16 -4.89 116.67 122.08 1bqm s ASP 76 Ca 0.24 0.14 -0.13 0.00 0.71 0.00 0.00 52.55 53.50 1bqm s ASP 76 Cb -0.14 -2.55 0.21 0.00 1.01 0.00 0.00 42.92 41.45 1bqm s ASP 76 CO 0.15 -1.56 1.10 -0.36 0.21 0.00 0.00 175.17 174.71 1bqm s PHE 77 N 5.27 3.77 -0.23 4.23 0.08 -1.26 -4.56 117.98 125.29 1bqm s PHE 77 Ca 0.45 -2.17 0.02 0.00 0.12 0.00 0.00 56.93 55.35 1bqm s PHE 77 Cb -0.08 -4.02 -0.15 0.00 -0.57 0.00 0.00 43.02 38.20 1bqm s PHE 77 CO 0.25 -1.15 -0.21 2.89 -0.10 0.00 0.00 175.22 176.90 1bqm n ARG 78 N 4.34 0.58 0.08 0.44 -4.01 -1.26 -4.14 116.66 112.70 1bqm n ARG 78 Ca 0.24 0.13 -0.09 0.00 -1.04 0.00 0.00 57.85 57.09 1bqm n ARG 78 Cb 0.44 -1.46 -0.06 0.00 -3.04 0.00 0.00 32.46 28.34 1bqm n ARG 78 CO 0.00 0.00 0.00 1.49 -3.04 0.00 0.00 177.63 176.08 1bqm h GLU 79 N -0.01 0.13 -0.19 2.89 4.57 -2.01 -3.22 114.58 116.74 1bqm h GLU 79 Ca -0.52 -0.18 -0.10 0.00 -1.18 0.00 0.00 59.36 57.39 1bqm h GLU 79 Cb 1.80 0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 30.44 1bqm h GLU 79 CO -0.08 1.00 -0.28 1.25 -1.18 0.00 0.00 179.01 179.72 1bqm h LEU 80 N 0.06 0.57 -1.82 1.64 5.85 -1.92 -3.01 115.31 116.68 1bqm h LEU 80 Ca -0.05 -0.52 0.20 0.00 0.84 0.00 0.00 57.88 58.35 1bqm h LEU 80 Cb 1.66 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.50 1bqm h LEU 80 CO 0.14 0.98 0.66 0.78 -0.34 0.00 0.00 178.44 180.66 1bqm h ASN 81 N 0.18 0.00 0.07 1.25 -0.26 -1.71 0.15 115.58 115.25 1bqm h ASN 81 Ca 0.02 0.00 -0.13 0.00 -0.56 0.00 0.00 56.30 55.63 1bqm h ASN 81 Cb 0.85 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.11 1bqm h ASN 81 CO 0.06 0.00 -0.61 0.11 -1.06 0.00 0.00 177.43 175.94 1bqm h LYS 82 N 0.00 0.14 -0.30 0.81 1.57 -1.59 -3.38 116.57 113.82 1bqm h LYS 82 Ca 0.32 -0.24 -0.07 0.00 -1.87 0.00 0.00 60.65 58.80 1bqm h LYS 82 Cb 1.64 0.09 -0.02 0.00 0.08 0.00 0.00 32.23 34.02 1bqm h LYS 82 CO -0.00 1.11 -0.11 0.00 -0.57 0.00 0.00 179.45 179.88 1bqm h ARG 83 N -0.69 0.51 -7.31 3.15 3.08 -0.67 -3.46 114.38 109.00 1bqm h ARG 83 Ca -0.13 -0.14 -0.51 0.00 0.07 0.00 0.00 59.98 59.27 1bqm h ARG 83 Cb 1.36 -0.06 0.15 0.00 0.08 0.00 0.00 29.97 31.50 1bqm h ARG 83 CO 0.04 0.62 0.28 0.95 -1.07 0.00 0.00 179.97 180.78 1bqm s THR 84 N -4.77 2.94 1.24 2.04 -4.23 -0.53 -1.72 115.64 110.61 1bqm s THR 84 Ca -0.07 0.31 -0.20 0.00 -1.18 0.00 0.00 61.69 60.55 1bqm s THR 84 Cb 0.15 -2.70 0.30 0.00 1.34 0.00 0.00 72.50 71.58 1bqm s THR 84 CO 0.78 -0.40 1.07 0.00 -0.54 0.00 0.00 174.62 175.53 1bqm s GLN 85 N -4.86 -1.50 -0.07 3.99 -2.07 0.11 -4.39 119.66 110.88 1bqm s GLN 85 Ca 0.63 0.01 -0.12 0.00 -1.82 0.00 0.00 55.36 54.05 1bqm s GLN 85 Cb -0.18 -1.56 -0.05 0.00 -1.09 0.00 0.00 33.01 30.13 1bqm s GLN 85 CO 0.57 -3.91 0.30 -0.51 -1.32 0.00 0.00 175.29 170.42 1bqm s ASP 86 N -3.71 6.61 0.42 12.60 1.01 -1.26 -4.95 116.67 127.39 1bqm s ASP 86 Ca 0.70 0.73 0.07 0.00 0.71 0.00 0.00 52.55 54.77 1bqm s ASP 86 Cb -0.11 -2.18 -0.03 0.00 1.01 0.00 0.00 42.92 41.61 1bqm s ASP 86 CO 0.57 0.31 0.32 -0.36 0.21 0.00 0.00 175.17 176.22 1bqm s PHE 87 N -0.78 2.64 0.00 4.23 0.08 -1.26 -5.09 117.98 117.80 1bqm s PHE 87 Ca 0.20 -0.53 -0.28 0.00 0.12 0.00 0.00 56.93 56.44 1bqm s PHE 87 Cb -0.15 -2.10 -0.04 0.00 -0.57 0.00 0.00 43.02 40.16 1bqm s PHE 87 CO 0.09 -0.05 0.87 -0.46 -0.10 0.00 0.00 175.22 175.57 1bqm s TRP 88 N -2.52 3.67 -0.08 0.36 -0.00 -1.26 -4.98 118.94 114.12 1bqm s TRP 88 Ca 0.46 1.56 -0.30 0.00 -0.00 0.00 0.00 56.10 57.82 1bqm s TRP 88 Cb -0.01 -2.99 -0.05 0.00 -0.00 0.00 0.00 33.47 30.42 1bqm s TRP 88 CO 0.26 0.08 1.63 -1.21 -0.00 0.00 0.00 176.95 177.72 1bqm s GLU 89 N 0.68 4.13 0.14 5.86 2.02 -1.26 -4.89 118.70 125.38 1bqm s GLU 89 Ca 0.46 2.10 -0.11 0.00 0.02 0.00 0.00 54.97 57.44 1bqm s GLU 89 Cb -0.20 -3.98 -0.06 0.00 0.10 0.00 0.00 34.13 29.99 1bqm s GLU 89 CO 0.25 -0.90 1.43 -0.39 0.02 0.00 0.00 175.26 175.67 1bqm h VAL 90 N 5.65 1.28 0.00 2.63 -1.51 -1.94 -3.33 116.25 119.03 1bqm h VAL 90 Ca -0.38 -1.69 -0.64 0.00 -1.23 0.00 0.00 66.70 62.76 1bqm h VAL 90 Cb 1.17 1.58 0.02 0.00 -2.13 0.00 0.00 31.29 31.93 1bqm h VAL 90 CO 0.96 0.55 2.59 0.00 -1.23 0.00 0.00 177.57 180.44 1bqm n GLN 91 N -4.01 1.96 -0.36 5.19 3.00 -1.26 -4.54 117.38 117.35 1bqm n GLN 91 Ca -0.04 -2.00 0.00 0.00 -0.01 0.00 0.00 57.00 54.95 1bqm n GLN 91 Cb 0.61 -2.96 0.13 0.00 0.00 0.00 0.00 30.24 28.02 1bqm n GLN 91 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1bqm n LEU 92 N 6.70 3.13 0.00 1.08 4.77 -1.25 -4.97 117.00 126.45 1bqm n LEU 92 Ca 0.51 -1.60 0.00 0.00 -0.03 0.00 0.00 56.01 54.89 1bqm n LEU 92 Cb 0.37 -0.58 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 1bqm n LEU 92 CO 0.97 0.46 0.00 0.61 -1.33 0.00 0.00 177.39 178.10 1bqm n GLY 93 N 0.16 0.42 3.12 -0.72 0.00 -1.26 -5.06 105.19 101.85 1bqm n GLY 93 Ca 0.13 -1.87 -0.12 0.00 0.00 0.00 0.00 46.02 44.16 1bqm n GLY 93 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1bqm s ILE 94 N -1.47 -0.07 -0.25 -0.61 -4.36 -1.26 -5.11 121.20 108.07 1bqm s ILE 94 Ca 0.00 0.14 -0.29 0.00 -0.26 0.00 0.00 60.65 60.24 1bqm s ILE 94 Cb 0.00 -0.45 -0.02 0.00 1.25 0.00 0.00 42.46 43.23 1bqm s ILE 94 CO 0.00 0.06 1.70 -2.16 0.24 0.00 0.00 174.94 174.78 1bqm s PRO 95 N 1.39 3.62 0.04 0.37 0.04 -1.26 -4.92 135.00 134.29 1bqm s PRO 95 Ca -0.09 1.60 -0.30 0.00 0.04 0.00 0.00 61.00 62.25 1bqm s PRO 95 Cb -0.10 -4.10 -0.05 0.00 0.04 0.00 0.00 34.50 30.29 1bqm s PRO 95 CO -0.10 -1.51 1.17 -1.58 0.04 0.00 0.00 177.00 175.03 1bqm s HIS 96 N 5.84 3.45 0.39 0.56 2.46 -1.26 -4.92 115.29 121.81 1bqm s HIS 96 Ca 0.75 1.34 0.24 0.00 0.47 0.00 0.00 55.06 57.87 1bqm s HIS 96 Cb -0.24 -3.38 1.33 0.00 -0.13 0.00 0.00 32.58 30.16 1bqm s HIS 96 CO 0.31 -1.12 1.61 -1.35 -2.47 0.00 0.00 174.74 171.73 1bqm h PRO 97 N 6.86 0.10 -0.14 2.88 0.11 -1.99 -0.48 132.00 139.34 1bqm h PRO 97 Ca -0.41 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 65.73 1bqm h PRO 97 Cb 1.21 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1bqm h PRO 97 CO 0.81 0.07 0.16 0.00 -0.21 0.00 0.00 178.00 178.82 1bqm h ALA 98 N 1.79 1.72 -0.61 -0.75 0.00 -1.87 0.10 119.26 119.64 1bqm h ALA 98 Ca 0.82 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.68 1bqm h ALA 98 Cb 2.29 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 20.06 1bqm h ALA 98 CO -0.58 -0.23 0.06 0.41 0.00 0.00 0.00 179.25 178.91 1bqm n GLY 99 N -1.38 3.15 3.89 0.00 0.00 -0.19 -4.03 105.19 106.63 1bqm n GLY 99 Ca 0.00 -0.95 -0.31 0.00 0.00 0.00 0.00 46.02 44.77 1bqm n GLY 99 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bqm s LEU 100 N -2.83 4.13 0.23 0.99 1.43 0.02 -4.85 118.68 117.80 1bqm s LEU 100 Ca 0.55 0.81 0.06 0.00 -1.03 0.00 0.00 54.13 54.51 1bqm s LEU 100 Cb 0.42 -3.59 -0.03 0.00 0.03 0.00 0.00 46.19 43.02 1bqm s LEU 100 CO 0.15 -0.11 0.28 -0.54 0.23 0.00 0.00 176.35 176.37 1bqm s LYS 101 N -3.09 3.23 -1.18 1.70 1.02 -1.26 -0.26 119.74 119.89 1bqm s LYS 101 Ca 0.45 -0.86 -0.17 0.00 0.02 0.00 0.00 55.97 55.42 1bqm s LYS 101 Cb -0.11 -2.77 -0.05 0.00 -0.52 0.00 0.00 37.83 34.39 1bqm s LYS 101 CO 0.25 0.43 2.14 1.63 -0.92 0.00 0.00 175.35 178.88 1bqm n LYS 102 N -1.20 2.33 -1.39 1.68 5.02 -1.26 -4.86 118.16 118.48 1bqm n LYS 102 Ca -0.08 -2.25 -0.40 0.00 -2.02 0.00 0.00 58.31 53.55 1bqm n LYS 102 Cb 0.57 -3.10 -0.02 0.00 -0.02 0.00 0.00 35.03 32.46 1bqm n LYS 102 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1bqm n LYS 103 N 6.29 2.46 0.00 1.97 4.01 -1.26 -4.89 118.16 126.73 1bqm n LYS 103 Ca 0.52 -2.19 0.00 0.00 -0.51 0.00 0.00 58.31 56.13 1bqm n LYS 103 Cb 0.38 -3.02 0.00 0.00 -0.51 0.00 0.00 35.03 31.88 1bqm n LYS 103 CO 0.00 0.00 0.00 1.17 -1.11 0.00 0.00 177.40 177.46 1bqm n LYS 104 N 5.87 0.00 -4.25 1.97 3.00 -1.01 -3.56 118.16 120.17 1bqm n LYS 104 Ca 0.54 0.00 -0.35 0.00 -0.00 0.00 0.00 58.31 58.50 1bqm n LYS 104 Cb 0.35 0.00 -0.09 0.00 0.00 0.00 0.00 35.03 35.29 1bqm n LYS 104 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1bqm s SER 105 N 0.00 5.51 0.08 3.14 0.15 0.94 -4.95 113.70 118.57 1bqm s SER 105 Ca 0.00 0.21 0.02 0.00 0.70 0.00 0.00 55.95 56.88 1bqm s SER 105 Cb 0.00 -1.61 -0.04 0.00 -1.71 0.00 0.00 66.02 62.67 1bqm s SER 105 CO 0.00 0.38 -0.07 -0.69 1.20 0.00 0.00 173.24 174.06 1bqm s VAL 106 N -0.94 0.65 0.04 4.45 1.01 -1.26 0.46 120.40 124.82 1bqm s VAL 106 Ca 0.14 -1.71 -0.17 0.00 0.00 0.00 0.00 61.98 60.24 1bqm s VAL 106 Cb -0.11 -1.40 0.03 0.00 0.00 0.00 0.00 36.38 34.90 1bqm s VAL 106 CO 0.03 -0.74 0.39 -0.89 0.00 0.00 0.00 175.10 173.89 1bqm s THR 107 N -3.03 0.06 -0.11 3.92 2.01 0.21 -4.84 115.64 113.86 1bqm s THR 107 Ca 0.06 -0.50 0.01 0.00 0.31 0.00 0.00 61.69 61.57 1bqm s THR 107 Cb 0.01 -0.94 0.02 0.00 0.01 0.00 0.00 72.50 71.60 1bqm s THR 107 CO -0.03 -0.28 -0.14 -0.69 -0.69 0.00 0.00 174.62 172.79 1bqm s VAL 108 N -2.47 1.43 -0.18 3.82 1.01 -1.24 -0.44 120.40 122.33 1bqm s VAL 108 Ca -0.05 -0.59 -0.05 0.00 0.00 0.00 0.00 61.98 61.29 1bqm s VAL 108 Cb -0.01 -1.33 -0.03 0.00 0.00 0.00 0.00 36.38 35.01 1bqm s VAL 108 CO -0.02 0.43 -0.01 -0.76 0.00 0.00 0.00 175.10 174.74 1bqm s LEU 109 N 1.16 3.34 -0.83 3.92 1.02 0.75 -4.63 118.68 123.41 1bqm s LEU 109 Ca -0.03 -0.13 -0.25 0.00 0.02 0.00 0.00 54.13 53.74 1bqm s LEU 109 Cb -0.14 -1.83 0.01 0.00 0.02 0.00 0.00 46.19 44.25 1bqm s LEU 109 CO -0.04 0.13 1.56 -0.62 0.02 0.00 0.00 176.35 177.40 1bqm s ASP 110 N 0.63 5.92 -0.75 2.29 2.15 -1.26 -1.33 116.67 124.31 1bqm s ASP 110 Ca -0.01 -0.64 -0.03 0.00 0.43 0.00 0.00 52.55 52.30 1bqm s ASP 110 Cb -0.14 -2.56 0.23 0.00 -0.30 0.00 0.00 42.92 40.15 1bqm s ASP 110 CO 0.02 -2.00 2.31 1.33 -0.17 0.00 0.00 175.17 176.66 1bqm n VAL 111 N 6.96 3.83 0.21 1.11 0.24 -1.15 -4.71 118.33 124.82 1bqm n VAL 111 Ca 0.22 -3.97 -0.13 0.00 -2.04 0.00 0.00 64.34 58.42 1bqm n VAL 111 Cb 0.50 -1.45 -0.07 0.00 -1.47 0.00 0.00 33.84 31.34 1bqm n VAL 111 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1bqm h GLY 112 N 3.62 -0.59 -4.90 7.63 0.00 -1.89 -3.27 103.07 103.67 1bqm h GLY 112 Ca 0.51 0.22 -0.71 0.00 0.00 0.00 0.00 47.33 47.35 1bqm h GLY 112 CO 1.21 -0.22 0.44 1.22 0.00 0.00 0.00 176.54 179.19 1bqm n ASP 113 N -5.19 6.53 -1.31 0.19 9.92 -1.26 -4.39 116.55 121.04 1bqm n ASP 113 Ca -0.10 -3.79 0.12 0.00 -0.53 0.00 0.00 54.79 50.49 1bqm n ASP 113 Cb 0.29 -0.86 0.30 0.00 -0.64 0.00 0.00 41.12 40.20 1bqm n ASP 113 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1bqm n ALA 114 N -0.49 2.39 0.02 2.24 0.00 -1.23 -4.16 120.51 119.27 1bqm n ALA 114 Ca 0.48 -1.21 -0.22 0.00 0.00 0.00 0.00 53.44 52.49 1bqm n ALA 114 Cb 0.38 -0.92 -0.14 0.00 0.00 0.00 0.00 19.45 18.76 1bqm n ALA 114 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1bqm h TYR 115 N 4.37 0.53 0.00 0.00 -1.99 -1.84 -3.35 116.97 114.69 1bqm h TYR 115 Ca 0.00 -0.39 0.00 0.00 2.00 0.00 0.00 58.73 60.34 1bqm h TYR 115 Cb 0.99 -0.02 0.00 0.00 2.00 0.00 0.00 36.73 39.70 1bqm h TYR 115 CO 0.43 1.75 0.00 1.19 -0.00 0.00 0.00 178.16 181.53 1bqm n PHE 116 N -3.55 0.00 -0.12 4.88 3.01 -1.26 -3.09 117.46 117.33 1bqm n PHE 116 Ca -0.30 0.00 -0.22 0.00 1.01 0.00 0.00 57.45 57.94 1bqm n PHE 116 Cb 1.04 0.00 -0.11 0.00 -0.01 0.00 0.00 39.48 40.40 1bqm n PHE 116 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1bqm n SER 117 N -0.93 1.98 -4.76 4.37 3.41 -1.26 -4.52 113.62 111.92 1bqm n SER 117 Ca 0.13 0.07 -0.41 0.00 -0.26 0.00 0.00 58.87 58.40 1bqm n SER 117 Cb 0.06 -0.60 -0.02 0.00 -0.26 0.00 0.00 64.21 63.39 1bqm n SER 117 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1bqm s VAL 118 N -2.51 2.40 0.52 -3.33 1.01 -1.18 -1.03 120.40 116.28 1bqm s VAL 118 Ca -0.35 0.36 -0.06 0.00 0.00 0.00 0.00 61.98 61.92 1bqm s VAL 118 Cb 0.11 -3.23 -0.03 0.00 0.00 0.00 0.00 36.38 33.23 1bqm s VAL 118 CO 0.58 0.07 0.85 -2.16 0.00 0.00 0.00 175.10 174.43 1bqm s PRO 119 N -0.96 3.47 0.05 2.72 0.04 -1.26 -2.70 135.00 136.36 1bqm s PRO 119 Ca 0.57 0.29 0.01 0.00 0.04 0.00 0.00 61.00 61.91 1bqm s PRO 119 Cb -0.44 -2.30 -0.04 0.00 0.04 0.00 0.00 34.50 31.76 1bqm s PRO 119 CO 0.50 -0.34 0.14 -1.17 0.04 0.00 0.00 177.00 176.16 1bqm s LEU 120 N -4.86 4.07 0.44 -3.56 2.96 0.69 -4.65 118.68 113.77 1bqm s LEU 120 Ca 0.50 0.15 -0.24 0.00 -0.22 0.00 0.00 54.13 54.32 1bqm s LEU 120 Cb -0.10 -2.65 -0.10 0.00 0.50 0.00 0.00 46.19 43.84 1bqm s LEU 120 CO 0.47 0.19 0.99 -0.67 -1.32 0.00 0.00 176.35 176.01 1bqm n ASP 121 N 0.53 1.16 0.00 3.68 -0.08 -1.24 -4.84 116.55 115.75 1bqm n ASP 121 Ca -0.08 1.01 0.04 0.00 -1.51 0.00 0.00 54.79 54.25 1bqm n ASP 121 Cb 0.52 -1.35 0.22 0.00 2.34 0.00 0.00 41.12 42.85 1bqm n ASP 121 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1bqm n GLU 122 N 0.05 0.15 -0.11 -0.67 1.02 -1.26 -3.12 120.64 116.70 1bqm n GLU 122 Ca 0.10 0.16 -0.13 0.00 -0.02 0.00 0.00 57.16 57.27 1bqm n GLU 122 Cb 0.40 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 30.18 1bqm n GLU 122 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1bqm n ASP 123 N -1.22 0.78 0.22 1.62 8.00 -1.26 -4.51 116.55 120.17 1bqm n ASP 123 Ca 0.05 -0.05 0.11 0.00 0.71 0.00 0.00 54.79 55.60 1bqm n ASP 123 Cb 0.06 0.48 0.33 0.00 -0.02 0.00 0.00 41.12 41.97 1bqm n ASP 123 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1bqm h PHE 124 N 0.00 0.00 -1.07 1.24 3.04 -1.84 -3.33 116.94 114.97 1bqm h PHE 124 Ca -0.55 0.00 0.31 0.00 3.98 0.00 0.00 57.97 61.71 1bqm h PHE 124 Cb 2.11 0.00 -0.04 0.00 2.56 0.00 0.00 35.95 40.57 1bqm h PHE 124 CO 0.01 0.15 0.82 0.00 -2.02 0.00 0.00 178.31 177.27 1bqm h ARG 125 N 0.00 0.00 0.00 1.11 3.08 -1.79 0.59 114.38 117.37 1bqm h ARG 125 Ca -0.00 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.95 1bqm h ARG 125 Cb 0.90 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.93 1bqm h ARG 125 CO 0.02 0.00 -0.45 1.57 -1.07 0.00 0.00 179.97 180.04 1bqm h LYS 126 N 0.00 0.00 0.00 0.04 2.10 -1.89 -2.62 116.57 114.21 1bqm h LYS 126 Ca 0.51 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.16 1bqm h LYS 126 Cb 2.14 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.47 1bqm h LYS 126 CO -0.01 0.45 0.00 0.66 -2.00 0.00 0.00 179.45 178.56 1bqm n TYR 127 N -3.63 0.00 -1.05 0.07 4.01 0.20 -2.60 117.16 114.16 1bqm n TYR 127 Ca -0.01 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.82 1bqm n TYR 127 Cb 0.54 0.00 0.23 0.00 -0.31 0.00 0.00 39.34 39.80 1bqm n TYR 127 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1bqm n THR 128 N -0.89 2.20 -2.39 -0.72 -2.24 -0.98 -4.75 114.28 104.51 1bqm n THR 128 Ca 0.18 -2.04 -0.38 0.00 -2.27 0.00 0.00 64.05 59.54 1bqm n THR 128 Cb 0.08 -0.26 -0.03 0.00 -2.10 0.00 0.00 70.33 68.03 1bqm n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bqm s ALA 129 N -2.87 3.13 -0.05 6.98 0.00 -1.07 -4.01 121.76 123.86 1bqm s ALA 129 Ca 0.40 0.87 -0.07 0.00 0.00 0.00 0.00 51.96 53.16 1bqm s ALA 129 Cb 0.33 -3.34 0.01 0.00 0.00 0.00 0.00 23.12 20.12 1bqm s ALA 129 CO 0.07 -0.41 0.18 -0.59 0.00 0.00 0.00 175.76 175.01 1bqm s PHE 130 N -1.49 -0.13 0.16 0.00 -0.71 -1.21 -2.13 117.98 112.47 1bqm s PHE 130 Ca 0.57 0.31 0.09 0.00 -1.04 0.00 0.00 56.93 56.86 1bqm s PHE 130 Cb -0.28 0.04 -0.04 0.00 -1.21 0.00 0.00 43.02 41.53 1bqm s PHE 130 CO 0.35 -0.17 -0.19 0.99 -1.34 0.00 0.00 175.22 174.86 1bqm s THR 131 N -0.38 1.89 -0.29 -4.49 2.01 -1.25 -2.49 115.64 110.64 1bqm s THR 131 Ca -0.05 -1.89 -0.04 0.00 0.31 0.00 0.00 61.69 60.02 1bqm s THR 131 Cb -0.03 -1.86 0.10 0.00 0.01 0.00 0.00 72.50 70.72 1bqm s THR 131 CO 0.01 -0.25 0.13 0.27 -0.69 0.00 0.00 174.62 174.09 1bqm s ILE 132 N -1.89 -0.05 0.48 1.82 -4.36 -0.79 -4.79 121.20 111.62 1bqm s ILE 132 Ca 0.15 -0.82 -0.20 0.00 -0.26 0.00 0.00 60.65 59.52 1bqm s ILE 132 Cb -0.07 -0.99 -0.09 0.00 1.25 0.00 0.00 42.46 42.56 1bqm s ILE 132 CO 0.07 -0.75 1.03 -2.16 0.24 0.00 0.00 174.94 173.37 1bqm s PRO 133 N 2.03 3.85 0.74 0.37 0.04 -1.26 -4.44 135.00 136.33 1bqm s PRO 133 Ca 0.10 1.34 -0.11 0.00 0.04 0.00 0.00 61.00 62.36 1bqm s PRO 133 Cb -0.16 -2.11 0.04 0.00 0.04 0.00 0.00 34.50 32.31 1bqm s PRO 133 CO -0.35 -0.39 1.11 -1.54 0.04 0.00 0.00 177.00 175.88 1bqm s SER 134 N -2.00 5.08 0.03 6.66 1.04 -1.26 -4.65 113.70 118.60 1bqm s SER 134 Ca 0.67 0.94 -0.27 0.00 0.48 0.00 0.00 55.95 57.76 1bqm s SER 134 Cb -0.16 -1.63 -0.15 0.00 0.10 0.00 0.00 66.02 64.18 1bqm s SER 134 CO 0.19 -1.54 1.24 0.16 0.98 0.00 0.00 173.24 174.27 1bqm h ILE 135 N -0.76 0.00 0.00 -1.02 3.07 -1.95 -3.08 117.51 113.77 1bqm h ILE 135 Ca -0.45 -0.15 0.00 0.00 1.55 0.00 0.00 64.86 65.80 1bqm h ILE 135 Cb 1.28 0.00 0.00 0.00 -0.27 0.00 0.00 36.82 37.83 1bqm h ILE 135 CO 0.64 0.00 0.00 0.59 -1.05 0.00 0.00 178.15 178.33 1bqm n ASN 136 N -5.08 0.00 -2.91 2.16 3.02 -1.26 -4.83 115.26 106.36 1bqm n ASN 136 Ca -0.12 0.22 -0.22 0.00 -0.03 0.00 0.00 54.58 54.43 1bqm n ASN 136 Cb 0.39 -0.32 0.02 0.00 -0.61 0.00 0.00 39.78 39.26 1bqm n ASN 136 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1bqm n ASN 137 N -1.32 -5.71 0.03 6.41 4.05 -1.16 -4.90 115.26 112.65 1bqm n ASN 137 Ca 0.04 -0.22 -0.19 0.00 0.45 0.00 0.00 54.58 54.66 1bqm n ASN 137 Cb 0.08 -4.66 -0.14 0.00 1.23 0.00 0.00 39.78 36.28 1bqm n ASN 137 CO 0.00 0.00 0.00 -0.33 -3.05 0.00 0.00 177.26 173.88 1bqm h GLU 138 N -1.01 0.26 -2.02 1.20 4.39 -1.88 -3.43 114.58 112.10 1bqm h GLU 138 Ca -0.50 -0.44 -0.55 0.00 0.34 0.00 0.00 59.36 58.20 1bqm h GLU 138 Cb 1.35 0.16 -0.39 0.00 -0.10 0.00 0.00 28.75 29.77 1bqm h GLU 138 CO 0.56 1.12 -1.08 -2.37 -1.16 0.00 0.00 179.01 176.08 1bqm n THR 139 N -3.44 -0.37 -1.35 1.13 5.66 -1.26 -5.13 114.28 109.51 1bqm n THR 139 Ca -0.24 -4.19 -0.30 0.00 -3.05 0.00 0.00 64.05 56.26 1bqm n THR 139 Cb 1.05 -1.75 0.10 0.00 -1.55 0.00 0.00 70.33 68.18 1bqm n THR 139 CO 0.00 0.00 0.00 -2.84 -3.05 0.00 0.00 175.07 169.18 1bqm s PRO 140 N -1.46 2.05 0.00 1.09 0.02 -1.26 -4.40 135.00 131.04 1bqm s PRO 140 Ca 0.36 0.93 0.00 0.00 0.02 0.00 0.00 61.00 62.31 1bqm s PRO 140 Cb 0.19 -1.89 0.00 0.00 0.02 0.00 0.00 34.50 32.82 1bqm s PRO 140 CO -0.10 -1.72 0.00 0.41 -0.33 0.00 0.00 177.00 175.26 1bqm n GLY 141 N -1.49 1.00 3.58 0.52 0.00 -1.26 -5.00 105.19 102.53 1bqm n GLY 141 Ca 0.08 -0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 1bqm n GLY 141 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bqm s ILE 142 N -2.00 3.64 -0.12 -0.61 1.01 -1.26 -4.71 121.20 117.16 1bqm s ILE 142 Ca 0.00 -0.99 0.01 0.00 0.00 0.00 0.00 60.65 59.67 1bqm s ILE 142 Cb 0.00 -4.61 0.02 0.00 0.01 0.00 0.00 42.46 37.88 1bqm s ILE 142 CO 0.00 -1.21 -0.13 0.00 0.00 0.00 0.00 174.94 173.60 1bqm s ARG 143 N 6.11 2.10 0.79 2.79 1.70 -1.26 -1.89 118.95 129.29 1bqm s ARG 143 Ca 0.65 -0.50 -0.03 0.00 -0.47 0.00 0.00 55.73 55.38 1bqm s ARG 143 Cb -0.01 -1.89 0.16 0.00 -0.57 0.00 0.00 34.95 32.64 1bqm s ARG 143 CO 0.09 -0.16 1.08 0.71 -1.08 0.00 0.00 175.30 175.94 1bqm s TYR 144 N 1.28 1.25 -0.11 5.89 1.51 -1.04 -1.19 117.35 124.95 1bqm s TYR 144 Ca -0.01 -0.29 -0.06 0.00 -1.01 0.00 0.00 57.07 55.71 1bqm s TYR 144 Cb -0.14 -3.20 0.05 0.00 -0.11 0.00 0.00 41.96 38.56 1bqm s TYR 144 CO -0.06 -2.04 0.25 -1.14 -1.11 0.00 0.00 175.55 171.46 1bqm s GLN 145 N -5.32 0.22 0.05 -0.62 0.74 0.13 -3.36 119.66 111.51 1bqm s GLN 145 Ca 0.70 0.53 -0.31 0.00 0.05 0.00 0.00 55.36 56.33 1bqm s GLN 145 Cb -0.04 -0.10 -0.06 0.00 1.10 0.00 0.00 33.01 33.92 1bqm s GLN 145 CO 0.47 -0.15 1.23 0.71 -0.55 0.00 0.00 175.29 176.99 1bqm s TYR 146 N 1.18 3.36 -0.13 1.67 2.02 -1.26 -1.09 117.35 123.10 1bqm s TYR 146 Ca -0.09 1.23 0.06 0.00 -0.37 0.00 0.00 57.07 57.90 1bqm s TYR 146 Cb -0.10 -3.46 -0.23 0.00 -0.40 0.00 0.00 41.96 37.77 1bqm s TYR 146 CO -0.08 -1.46 0.33 0.09 -1.57 0.00 0.00 175.55 172.86 1bqm n ASN 147 N 4.14 1.27 -2.92 2.29 4.13 0.65 -4.59 115.26 120.23 1bqm n ASN 147 Ca 0.10 0.19 -0.08 0.00 1.68 0.00 0.00 54.58 56.47 1bqm n ASN 147 Cb 0.46 -0.17 0.00 0.00 -1.54 0.00 0.00 39.78 38.53 1bqm n ASN 147 CO 0.00 0.00 0.00 1.33 0.28 0.00 0.00 177.26 178.87 1bqm n VAL 148 N -3.16 0.00 -2.37 2.41 0.24 -1.22 -0.22 118.33 114.01 1bqm n VAL 148 Ca -0.29 -0.70 -0.43 0.00 -2.04 0.00 0.00 64.34 60.88 1bqm n VAL 148 Cb 1.06 -0.39 -0.02 0.00 -1.47 0.00 0.00 33.84 33.02 1bqm n VAL 148 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1bqm s LEU 149 N 0.00 4.22 0.67 1.34 1.43 -1.10 -4.48 118.68 120.77 1bqm s LEU 149 Ca 0.11 1.79 -0.11 0.00 -1.03 0.00 0.00 54.13 54.89 1bqm s LEU 149 Cb -0.01 -3.54 -0.01 0.00 0.03 0.00 0.00 46.19 42.66 1bqm s LEU 149 CO 0.07 -0.75 1.07 -2.84 0.23 0.00 0.00 176.35 174.13 1bqm s PRO 150 N 3.32 3.14 0.31 1.29 0.02 -1.26 -4.02 135.00 137.79 1bqm s PRO 150 Ca 0.57 0.60 -0.28 0.00 0.02 0.00 0.00 61.00 61.91 1bqm s PRO 150 Cb -0.24 -2.04 -0.09 0.00 0.02 0.00 0.00 34.50 32.15 1bqm s PRO 150 CO 0.18 -0.87 1.10 -0.65 -0.33 0.00 0.00 177.00 176.43 1bqm s GLN 151 N -5.27 4.53 0.00 5.54 -0.21 -1.26 -3.95 119.66 119.03 1bqm s GLN 151 Ca 0.57 1.77 0.00 0.00 0.02 0.00 0.00 55.36 57.72 1bqm s GLN 151 Cb -0.11 -3.06 0.00 0.00 1.00 0.00 0.00 33.01 30.84 1bqm s GLN 151 CO 0.53 0.12 0.00 0.41 -2.12 0.00 0.00 175.29 174.23 1bqm n GLY 152 N 1.02 2.05 0.00 3.09 0.00 -1.26 -4.76 105.19 105.33 1bqm n GLY 152 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.74 1bqm n GLY 152 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1bqm n TRP 153 N 0.00 0.00 -0.05 1.61 -0.00 -1.25 -4.70 117.44 113.04 1bqm n TRP 153 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.50 57.49 1bqm n TRP 153 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 31.31 31.30 1bqm n TRP 153 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 177.69 178.86 1bqm n LYS 154 N 0.00 -0.05 0.16 5.87 3.00 -1.26 0.13 118.16 126.01 1bqm n LYS 154 Ca 0.00 0.19 0.13 0.00 -0.00 0.00 0.00 58.31 58.63 1bqm n LYS 154 Cb 0.00 -0.28 0.39 0.00 0.00 0.00 0.00 35.03 35.14 1bqm n LYS 154 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 1bqm h GLY 155 N 0.00 0.00 0.00 3.14 0.00 -1.92 -3.39 103.07 100.89 1bqm h GLY 155 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.35 1bqm h GLY 155 CO -0.12 0.00 0.00 1.44 0.00 0.00 0.00 176.54 177.86 1bqm n SER 156 N -2.58 0.00 0.24 0.19 7.64 0.12 0.29 113.62 119.52 1bqm n SER 156 Ca 0.04 0.84 0.12 0.00 1.01 0.00 0.00 58.87 60.87 1bqm n SER 156 Cb 0.41 -0.34 0.64 0.00 -1.01 0.00 0.00 64.21 63.91 1bqm n SER 156 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1bqm h PRO 157 N 0.00 0.00 0.05 1.43 0.13 -1.76 0.10 132.00 131.95 1bqm h PRO 157 Ca 0.00 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1bqm h PRO 157 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1bqm h PRO 157 CO 0.00 0.00 -0.03 0.00 -0.23 0.00 0.00 178.00 177.74 1bqm h ALA 158 N 1.48 -0.07 -0.77 -0.56 0.00 -1.13 -2.97 119.26 115.23 1bqm h ALA 158 Ca 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1bqm h ALA 158 Cb 0.44 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 1bqm h ALA 158 CO 0.00 -0.08 0.43 0.82 0.00 0.00 0.00 179.25 180.42 1bqm h ILE 159 N -1.00 1.23 0.72 0.00 2.04 0.20 -2.77 117.51 117.93 1bqm h ILE 159 Ca -0.01 -0.56 -0.04 0.00 1.00 0.00 0.00 64.86 65.25 1bqm h ILE 159 Cb 0.29 0.18 0.01 0.00 -0.74 0.00 0.00 36.82 36.55 1bqm h ILE 159 CO 0.01 0.25 -0.35 0.15 0.00 0.00 0.00 178.15 178.22 1bqm h PHE 160 N 1.08 -0.90 0.00 1.37 3.57 -1.04 0.50 116.94 121.52 1bqm h PHE 160 Ca 0.27 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.75 1bqm h PHE 160 Cb 0.02 0.30 0.00 0.00 2.79 0.00 0.00 35.95 39.06 1bqm h PHE 160 CO 0.01 -0.54 0.02 0.94 -2.23 0.00 0.00 178.31 176.51 1bqm n GLN 161 N -5.44 0.00 -0.07 1.11 0.00 -1.10 -0.59 117.38 111.29 1bqm n GLN 161 Ca -0.13 0.21 -0.09 0.00 -0.00 0.00 0.00 57.00 57.00 1bqm n GLN 161 Cb 0.40 -1.52 -0.07 0.00 0.00 0.00 0.00 30.24 29.04 1bqm n GLN 161 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 1bqm n SER 162 N -1.19 2.71 -0.14 1.69 2.88 -0.93 -4.13 113.62 114.51 1bqm n SER 162 Ca 0.00 -0.06 -0.09 0.00 -1.33 0.00 0.00 58.87 57.39 1bqm n SER 162 Cb 0.02 0.01 -0.01 0.00 -0.75 0.00 0.00 64.21 63.49 1bqm n SER 162 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1bqm h SER 163 N 0.00 0.60 0.00 -3.46 0.02 0.25 -2.31 113.55 108.65 1bqm h SER 163 Ca -0.32 -0.21 0.00 0.00 -0.84 0.00 0.00 61.79 60.42 1bqm h SER 163 Cb 1.55 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.93 1bqm h SER 163 CO -0.03 0.65 0.00 0.23 -1.14 0.00 0.00 176.83 176.53 1bqm n MET 164 N -4.59 0.86 0.05 3.45 2.00 0.12 -1.64 117.12 117.36 1bqm n MET 164 Ca -0.00 0.00 0.10 0.00 0.00 0.00 0.00 57.70 57.79 1bqm n MET 164 Cb 0.18 -1.48 -0.08 0.00 0.00 0.00 0.00 33.22 31.85 1bqm n MET 164 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 175.97 178.38 1bqm n THR 165 N -0.98 0.46 0.04 2.03 -1.04 -0.88 -3.22 114.28 110.69 1bqm n THR 165 Ca 0.20 -0.55 -0.15 0.00 -2.04 0.00 0.00 64.05 61.50 1bqm n THR 165 Cb 0.09 -0.25 -0.14 0.00 -1.82 0.00 0.00 70.33 68.21 1bqm n THR 165 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 1bqm h LYS 166 N 0.00 0.18 -0.48 -2.82 1.57 -1.13 -3.14 116.57 110.76 1bqm h LYS 166 Ca -0.03 -0.32 -0.09 0.00 -1.87 0.00 0.00 60.65 58.35 1bqm h LYS 166 Cb 1.09 0.12 -0.02 0.00 0.08 0.00 0.00 32.23 33.50 1bqm h LYS 166 CO 0.00 1.00 -0.04 0.82 -0.57 0.00 0.00 179.45 180.67 1bqm h ILE 167 N 0.05 1.27 0.00 1.86 2.04 -1.44 -2.64 117.51 118.64 1bqm h ILE 167 Ca -0.25 -1.12 -0.07 0.00 1.00 0.00 0.00 64.86 64.42 1bqm h ILE 167 Cb 1.99 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 39.10 1bqm h ILE 167 CO 0.14 0.39 -0.36 -0.07 0.00 0.00 0.00 178.15 178.25 1bqm h LEU 168 N 0.71 0.00 -0.87 1.44 3.38 -1.68 -3.36 115.31 114.93 1bqm h LEU 168 Ca 0.13 0.00 0.22 0.00 0.09 0.00 0.00 57.88 58.32 1bqm h LEU 168 Cb 0.56 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.16 1bqm h LEU 168 CO 0.03 0.36 0.09 -0.08 0.09 0.00 0.00 178.44 178.93 1bqm h GLU 169 N 0.00 0.11 -0.23 1.13 4.81 -1.41 -0.59 114.58 118.39 1bqm h GLU 169 Ca -0.00 -0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.10 1bqm h GLU 169 Cb 0.96 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.30 1bqm h GLU 169 CO 0.05 0.07 -0.36 -1.00 -0.73 0.00 0.00 179.01 177.04 1bqm h PRO 170 N 0.11 0.51 0.94 0.92 0.13 -1.74 -1.56 132.00 131.31 1bqm h PRO 170 Ca 0.52 -0.24 -0.05 0.00 -0.87 0.00 0.00 66.00 65.36 1bqm h PRO 170 Cb 1.01 -0.01 0.01 0.00 0.13 0.00 0.00 31.00 32.15 1bqm h PRO 170 CO -0.74 0.80 -0.45 0.35 -0.23 0.00 0.00 178.00 177.73 1bqm h PHE 171 N 0.43 -1.17 -1.03 1.56 3.57 -1.42 0.14 116.94 119.01 1bqm h PHE 171 Ca 0.04 -0.03 0.26 0.00 3.53 0.00 0.00 57.97 61.77 1bqm h PHE 171 Cb 0.83 0.39 -0.11 0.00 2.79 0.00 0.00 35.95 39.86 1bqm h PHE 171 CO 0.03 -0.73 0.64 -0.22 -2.23 0.00 0.00 178.31 175.80 1bqm h LYS 172 N -1.28 0.46 0.15 1.11 3.64 -1.14 0.93 116.57 120.44 1bqm h LYS 172 Ca -0.13 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.22 1bqm h LYS 172 Cb 0.97 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.69 1bqm h LYS 172 CO 0.21 0.30 -0.07 0.87 -2.27 0.00 0.00 179.45 178.50 1bqm h LYS 173 N 0.47 -0.19 -0.18 1.90 1.57 -0.70 -3.02 116.57 116.42 1bqm h LYS 173 Ca 0.62 0.01 0.05 0.00 -1.87 0.00 0.00 60.65 59.46 1bqm h LYS 173 Cb 1.39 0.04 -0.06 0.00 0.08 0.00 0.00 32.23 33.68 1bqm h LYS 173 CO -0.37 0.25 -0.23 1.96 -0.57 0.00 0.00 179.45 180.50 1bqm h GLN 174 N -0.76 -0.26 -3.47 3.15 4.20 0.68 -3.36 115.11 115.29 1bqm h GLN 174 Ca -0.02 0.02 -0.63 0.00 0.06 0.00 0.00 58.65 58.08 1bqm h GLN 174 Cb 0.53 0.06 -0.41 0.00 0.30 0.00 0.00 27.48 27.96 1bqm h GLN 174 CO 0.03 -0.17 -0.68 0.54 -0.67 0.00 0.00 178.83 177.88 1bqm s ASN 175 N -5.01 4.17 0.92 1.46 2.20 0.18 -5.10 114.94 113.76 1bqm s ASN 175 Ca -0.15 -2.69 -0.09 0.00 -0.94 0.00 0.00 52.86 49.00 1bqm s ASN 175 Cb 0.11 -1.41 0.14 0.00 -2.00 0.00 0.00 41.25 38.10 1bqm s ASN 175 CO 0.68 -0.28 0.86 -0.81 -2.94 0.00 0.00 177.10 174.61 1bqm n PRO 176 N 3.52 -0.68 -0.55 3.55 -0.04 -1.14 -4.22 135.00 135.44 1bqm n PRO 176 Ca 0.05 -1.49 0.00 0.00 -0.04 0.00 0.00 63.50 62.02 1bqm n PRO 176 Cb 0.35 -0.83 0.00 0.00 -0.04 0.00 0.00 33.50 32.97 1bqm n PRO 176 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1bqm n ASP 177 N -3.45 0.00 -2.28 3.54 8.00 -1.26 -4.75 116.55 116.34 1bqm n ASP 177 Ca 0.11 0.00 -0.31 0.00 0.71 0.00 0.00 54.79 55.30 1bqm n ASP 177 Cb 0.40 -1.62 0.05 0.00 -0.02 0.00 0.00 41.12 39.93 1bqm n ASP 177 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bqm n ILE 178 N -2.00 3.21 -0.02 0.53 0.00 -1.26 -4.53 119.36 115.29 1bqm n ILE 178 Ca 0.00 -3.56 -0.01 0.00 0.00 0.00 0.00 62.75 59.18 1bqm n ILE 178 Cb 0.00 -1.17 -0.00 0.00 0.00 0.00 0.00 39.64 38.47 1bqm n ILE 178 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1bqm n VAL 179 N -0.80 0.00 -4.25 9.51 0.31 -1.22 -4.43 118.33 117.45 1bqm n VAL 179 Ca 0.55 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 64.59 1bqm n VAL 179 Cb 0.73 -0.00 -0.10 0.00 -0.91 0.00 0.00 33.84 33.56 1bqm n VAL 179 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1bqm s ILE 180 N 0.01 3.28 0.04 2.52 1.01 -1.26 -2.19 121.20 124.61 1bqm s ILE 180 Ca 0.01 -1.43 -0.05 0.00 0.00 0.00 0.00 60.65 59.18 1bqm s ILE 180 Cb -0.02 -2.57 -0.01 0.00 0.01 0.00 0.00 42.46 39.87 1bqm s ILE 180 CO 0.01 0.02 0.09 -0.47 0.00 0.00 0.00 174.94 174.59 1bqm s TYR 181 N -1.40 0.23 -0.18 3.97 5.04 -1.23 -5.00 117.35 118.78 1bqm s TYR 181 Ca 0.23 -0.57 -0.15 0.00 -2.44 0.00 0.00 57.07 54.14 1bqm s TYR 181 Cb -0.10 -0.16 0.05 0.00 0.35 0.00 0.00 41.96 42.10 1bqm s TYR 181 CO 0.14 -0.38 0.47 -1.14 -1.34 0.00 0.00 175.55 173.30 1bqm s GLN 182 N -2.87 0.52 -0.21 4.97 2.00 -1.26 -2.08 119.66 120.73 1bqm s GLN 182 Ca -0.03 0.72 -0.04 0.00 -2.00 0.00 0.00 55.36 54.01 1bqm s GLN 182 Cb 0.00 0.19 0.11 0.00 0.80 0.00 0.00 33.01 34.11 1bqm s GLN 182 CO -0.06 -0.09 0.33 -0.47 -0.50 0.00 0.00 175.29 174.50 1bqm s TYR 183 N 0.60 -0.64 0.00 1.67 5.04 -1.03 -5.01 117.35 117.97 1bqm s TYR 183 Ca -0.03 0.79 0.00 0.00 -2.44 0.00 0.00 57.07 55.39 1bqm s TYR 183 Cb -0.05 -0.04 0.00 0.00 0.35 0.00 0.00 41.96 42.22 1bqm s TYR 183 CO -0.04 -0.62 0.00 -1.33 -1.34 0.00 0.00 175.55 172.22 1bqm n MET 184 N 5.36 0.00 -1.38 4.97 2.81 -1.26 -1.70 117.12 125.92 1bqm n MET 184 Ca -0.05 0.00 0.01 0.00 -1.81 0.00 0.00 57.70 55.85 1bqm n MET 184 Cb 0.50 0.00 0.10 0.00 -0.71 0.00 0.00 33.22 33.10 1bqm n MET 184 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1bqm n ASP 185 N 1.59 1.81 -4.08 7.83 9.92 -1.26 -4.84 116.55 127.53 1bqm n ASP 185 Ca 0.00 -2.94 -0.14 0.00 -0.53 0.00 0.00 54.79 51.18 1bqm n ASP 185 Cb 0.00 -0.41 -0.12 0.00 -0.64 0.00 0.00 41.12 39.95 1bqm n ASP 185 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 1bqm s ASP 186 N -2.88 1.02 -0.32 -2.24 1.11 -0.69 -2.93 116.67 109.74 1bqm s ASP 186 Ca 0.37 -0.53 -0.00 0.00 0.18 0.00 0.00 52.55 52.57 1bqm s ASP 186 Cb 0.38 0.01 0.10 0.00 1.07 0.00 0.00 42.92 44.48 1bqm s ASP 186 CO -0.09 -0.15 0.11 -0.76 1.18 0.00 0.00 175.17 175.45 1bqm s LEU 187 N -1.48 2.47 -1.24 1.23 1.43 -0.44 -2.48 118.68 118.17 1bqm s LEU 187 Ca -0.07 -1.76 -0.13 0.00 -1.03 0.00 0.00 54.13 51.14 1bqm s LEU 187 Cb -0.09 -0.94 0.17 0.00 0.03 0.00 0.00 46.19 45.36 1bqm s LEU 187 CO 0.01 -0.40 1.57 -1.22 0.23 0.00 0.00 176.35 176.54 1bqm n TYR 188 N 4.70 4.43 -3.08 0.29 4.02 -0.88 -0.18 117.16 126.46 1bqm n TYR 188 Ca -0.01 -3.19 -0.39 0.00 -0.01 0.00 0.00 57.90 54.30 1bqm n TYR 188 Cb 0.41 -2.15 -0.05 0.00 -0.02 0.00 0.00 39.34 37.53 1bqm n TYR 188 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1bqm s VAL 189 N 1.38 4.86 -0.14 -0.72 1.01 0.41 -3.50 120.40 123.70 1bqm s VAL 189 Ca 0.42 1.45 -0.27 0.00 0.00 0.00 0.00 61.98 63.59 1bqm s VAL 189 Cb 0.01 -4.03 0.07 0.00 0.00 0.00 0.00 36.38 32.42 1bqm s VAL 189 CO 0.01 0.36 0.66 -0.83 0.00 0.00 0.00 175.10 175.30 1bqm s GLY 190 N 0.07 -0.53 0.00 4.51 0.00 -0.93 0.68 107.32 111.12 1bqm s GLY 190 Ca 0.36 1.53 0.00 0.00 0.00 0.00 0.00 44.72 46.60 1bqm s GLY 190 CO 0.20 1.21 0.00 -1.14 0.00 0.00 0.00 173.10 173.37 1bqm n SER 191 N 1.69 0.00 -3.15 1.64 3.41 0.17 -3.42 113.62 113.96 1bqm n SER 191 Ca -0.17 -0.72 -0.33 0.00 -0.26 0.00 0.00 58.87 57.40 1bqm n SER 191 Cb 0.56 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.50 1bqm n SER 191 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1bqm n ASP 192 N -1.58 5.68 -4.30 4.04 9.92 -1.26 -0.04 116.55 129.00 1bqm n ASP 192 Ca 0.00 -3.70 -0.28 0.00 -0.53 0.00 0.00 54.79 50.28 1bqm n ASP 192 Cb 0.00 -0.79 -0.15 0.00 -0.64 0.00 0.00 41.12 39.54 1bqm n ASP 192 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1bqm s LEU 193 N -3.82 2.15 -0.36 0.64 1.43 -1.26 -5.00 118.68 112.47 1bqm s LEU 193 Ca 0.46 -0.55 -0.29 0.00 -1.03 0.00 0.00 54.13 52.72 1bqm s LEU 193 Cb 0.26 -1.16 -0.00 0.00 0.03 0.00 0.00 46.19 45.32 1bqm s LEU 193 CO -0.15 0.23 1.49 -1.61 0.23 0.00 0.00 176.35 176.54 1bqm s GLU 194 N -1.14 3.61 0.00 1.70 0.41 -1.26 -4.51 118.70 117.51 1bqm s GLU 194 Ca 0.10 1.16 0.00 0.00 -0.41 0.00 0.00 54.97 55.82 1bqm s GLU 194 Cb -0.09 -4.04 0.00 0.00 -1.78 0.00 0.00 34.13 28.22 1bqm s GLU 194 CO 0.02 -1.52 0.00 -0.89 -0.49 0.00 0.00 175.26 172.37 1bqm n ILE 195 N 6.94 0.00 -0.14 -1.63 2.08 -1.26 0.13 119.36 125.47 1bqm n ILE 195 Ca 0.18 0.00 -0.11 0.00 0.56 0.00 0.00 62.75 63.38 1bqm n ILE 195 Cb 0.47 0.00 0.02 0.00 -0.75 0.00 0.00 39.64 39.38 1bqm n ILE 195 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 1bqm h GLY 196 N 0.00 1.04 2.00 7.39 0.00 -1.96 1.28 103.07 112.82 1bqm h GLY 196 Ca 0.00 -0.92 -0.06 0.00 0.00 0.00 0.00 47.33 46.35 1bqm h GLY 196 CO 0.00 0.84 -0.29 -1.61 0.00 0.00 0.00 176.54 175.48 1bqm h GLN 197 N 0.82 0.00 0.03 4.80 4.15 0.70 -2.20 115.11 123.42 1bqm h GLN 197 Ca 0.11 0.00 -0.26 0.00 0.77 0.00 0.00 58.65 59.27 1bqm h GLN 197 Cb 0.79 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.45 1bqm h GLN 197 CO 0.07 0.29 -1.35 1.25 -1.93 0.00 0.00 178.83 177.15 1bqm h HIS 198 N 0.00 0.12 0.00 3.99 2.76 -1.30 -3.20 115.15 117.52 1bqm h HIS 198 Ca -0.00 -0.08 0.00 0.00 -2.20 0.00 0.00 60.37 58.08 1bqm h HIS 198 Cb 0.77 -0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.73 1bqm h HIS 198 CO 0.00 1.10 0.00 0.54 -1.30 0.00 0.00 177.93 178.27 1bqm n ARG 199 N -3.28 0.07 -0.09 5.26 5.12 0.44 -2.72 116.66 121.46 1bqm n ARG 199 Ca -0.09 0.31 -0.18 0.00 -1.93 0.00 0.00 57.85 55.96 1bqm n ARG 199 Cb 1.00 -1.64 -0.12 0.00 -1.16 0.00 0.00 32.46 30.55 1bqm n ARG 199 CO 0.00 0.00 0.00 1.79 -1.93 0.00 0.00 177.63 177.49 1bqm h THR 200 N 0.00 1.25 -0.20 0.55 1.35 -1.41 -3.25 112.91 111.19 1bqm h THR 200 Ca 0.00 -2.20 0.06 0.00 -0.55 0.00 0.00 66.41 63.72 1bqm h THR 200 Cb 0.29 2.62 -0.01 0.00 -1.73 0.00 0.00 68.15 69.32 1bqm h THR 200 CO 0.00 0.42 0.19 0.11 -0.25 0.00 0.00 175.52 175.99 1bqm h LYS 201 N -1.00 0.00 0.07 4.72 1.79 -1.55 0.85 116.57 121.44 1bqm h LYS 201 Ca -0.18 0.00 -0.27 0.00 -2.18 0.00 0.00 60.65 58.01 1bqm h LYS 201 Cb 1.13 0.00 0.03 0.00 -1.58 0.00 0.00 32.23 31.80 1bqm h LYS 201 CO -0.11 0.00 -1.12 0.82 -1.08 0.00 0.00 179.45 177.96 1bqm h ILE 202 N 0.00 1.30 0.00 1.86 1.08 -1.65 -2.04 117.51 118.06 1bqm h ILE 202 Ca 0.10 -2.35 -0.06 0.00 -0.39 0.00 0.00 64.86 62.15 1bqm h ILE 202 Cb 0.48 2.58 -0.01 0.00 -3.07 0.00 0.00 36.82 36.80 1bqm h ILE 202 CO -0.00 0.72 -0.30 -0.08 -0.69 0.00 0.00 178.15 177.80 1bqm h GLU 203 N 0.28 0.00 -0.08 2.37 4.57 -1.28 0.17 114.58 120.61 1bqm h GLU 203 Ca -0.16 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.00 1bqm h GLU 203 Cb 1.79 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 30.38 1bqm h GLU 203 CO 0.22 0.30 -0.04 0.93 -1.18 0.00 0.00 179.01 179.24 1bqm h GLU 204 N 0.00 0.16 0.37 1.92 5.08 -0.85 -2.60 114.58 118.67 1bqm h GLU 204 Ca -0.00 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 1bqm h GLU 204 Cb 1.01 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.26 1bqm h GLU 204 CO 0.04 0.53 -0.18 1.25 -1.00 0.00 0.00 179.01 179.65 1bqm h LEU 205 N -0.21 -0.42 -1.96 1.33 5.85 -1.16 -1.29 115.31 117.46 1bqm h LEU 205 Ca 0.02 -0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.71 1bqm h LEU 205 Cb 0.48 0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.62 1bqm h LEU 205 CO 0.01 -0.23 0.35 -0.09 -0.34 0.00 0.00 178.44 178.15 1bqm h ARG 206 N -0.59 0.00 0.00 1.25 2.43 -0.67 0.16 114.38 116.97 1bqm h ARG 206 Ca -0.05 0.00 -0.17 0.00 -0.81 0.00 0.00 59.98 58.95 1bqm h ARG 206 Cb 0.43 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.95 1bqm h ARG 206 CO 0.08 0.00 -2.12 1.04 -1.51 0.00 0.00 179.97 177.47 1bqm n GLN 207 N -2.93 0.67 -0.09 0.20 1.13 -0.93 -2.81 117.38 112.62 1bqm n GLN 207 Ca -0.01 -0.09 -0.13 0.00 -1.94 0.00 0.00 57.00 54.82 1bqm n GLN 207 Cb 0.41 -1.54 -0.04 0.00 0.11 0.00 0.00 30.24 29.17 1bqm n GLN 207 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 1bqm h HIS 208 N 0.00 0.87 0.40 1.08 2.76 0.41 -1.83 115.15 118.84 1bqm h HIS 208 Ca -0.24 -0.27 -0.02 0.00 -2.20 0.00 0.00 60.37 57.64 1bqm h HIS 208 Cb 1.57 -0.18 0.00 0.00 1.55 0.00 0.00 27.41 30.35 1bqm h HIS 208 CO 0.00 1.02 -0.19 -0.07 -1.30 0.00 0.00 177.93 177.39 1bqm h LEU 209 N 0.46 -0.45 -2.10 0.26 3.38 -1.34 -0.09 115.31 115.43 1bqm h LEU 209 Ca 0.04 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1bqm h LEU 209 Cb 0.89 0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.76 1bqm h LEU 209 CO 0.08 -0.22 0.10 0.25 0.09 0.00 0.00 178.44 178.74 1bqm h LEU 210 N -0.67 0.00 0.00 1.67 7.12 -1.48 0.57 115.31 122.52 1bqm h LEU 210 Ca -0.05 0.00 -0.11 0.00 0.13 0.00 0.00 57.88 57.85 1bqm h LEU 210 Cb 0.48 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 40.59 1bqm h LEU 210 CO 0.09 0.00 -1.36 0.54 -0.13 0.00 0.00 178.44 177.58 1bqm n ARG 211 N -2.68 0.62 -0.04 1.25 1.74 -0.64 -3.90 116.66 113.00 1bqm n ARG 211 Ca -0.02 0.15 0.12 0.00 -0.77 0.00 0.00 57.85 57.33 1bqm n ARG 211 Cb 0.15 -1.78 0.44 0.00 -1.02 0.00 0.00 32.46 30.25 1bqm n ARG 211 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 1bqm n TRP 212 N -2.76 0.11 0.00 -1.55 5.03 0.19 -4.97 117.44 113.50 1bqm n TRP 212 Ca -0.07 -0.06 0.00 0.00 3.03 0.00 0.00 57.50 60.40 1bqm n TRP 212 Cb 0.73 0.00 0.00 0.00 -1.03 0.00 0.00 31.31 31.01 1bqm n TRP 212 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 1bqm n GLY 213 N 1.16 2.98 3.49 6.99 0.00 -0.78 -4.17 105.19 114.87 1bqm n GLY 213 Ca 0.18 -0.92 -0.42 0.00 0.00 0.00 0.00 46.02 44.85 1bqm n GLY 213 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1bqm s LEU 214 N 0.00 3.89 0.31 0.99 0.05 -1.21 -4.72 118.68 118.00 1bqm s LEU 214 Ca 0.00 -0.76 -0.29 0.00 0.05 0.00 0.00 54.13 53.13 1bqm s LEU 214 Cb 0.00 -2.48 -0.11 0.00 -2.05 0.00 0.00 46.19 41.55 1bqm s LEU 214 CO 0.00 -1.60 1.44 -0.89 -0.55 0.00 0.00 176.35 174.75 1bqm s THR 215 N 4.73 2.43 -0.40 5.48 2.01 -1.26 -4.07 115.64 124.55 1bqm s THR 215 Ca 0.27 0.39 0.01 0.00 0.31 0.00 0.00 61.69 62.68 1bqm s THR 215 Cb -0.13 -3.25 0.14 0.00 0.01 0.00 0.00 72.50 69.27 1bqm s THR 215 CO 0.12 0.08 0.24 -0.89 -0.69 0.00 0.00 174.62 173.48 1bqm s THR 216 N -0.59 0.79 0.00 -0.82 2.01 -1.26 -4.88 115.64 110.88 1bqm s THR 216 Ca 0.55 -2.20 0.00 0.00 0.31 0.00 0.00 61.69 60.35 1bqm s THR 216 Cb -0.43 -1.56 0.00 0.00 0.01 0.00 0.00 72.50 70.52 1bqm s THR 216 CO 0.52 -0.96 1.28 -2.65 -0.69 0.00 0.00 174.62 172.11 1bqm n PRO 217 N 3.71 0.66 -1.40 4.92 -0.02 -1.26 -4.61 135.00 136.99 1bqm n PRO 217 Ca 0.12 0.00 -0.36 0.00 -2.02 0.00 0.00 63.50 61.24 1bqm n PRO 217 Cb 0.36 -1.17 -0.04 0.00 -0.02 0.00 0.00 33.50 32.63 1bqm n PRO 217 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1bqm n ASP 218 N 1.60 8.15 0.00 2.55 10.43 -1.26 -4.89 116.55 133.13 1bqm n ASP 218 Ca 0.00 -2.69 0.00 0.00 2.57 0.00 0.00 54.79 54.67 1bqm n ASP 218 Cb 0.33 -1.50 0.00 0.00 1.84 0.00 0.00 41.12 41.80 1bqm n ASP 218 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 1bqm n LYS 219 N 3.02 0.00 -3.57 -1.24 4.01 -1.26 -0.42 118.16 118.70 1bqm n LYS 219 Ca 0.71 0.00 -0.25 0.00 -0.51 0.00 0.00 58.31 58.25 1bqm n LYS 219 Cb 0.33 0.00 0.04 0.00 -0.51 0.00 0.00 35.03 34.88 1bqm n LYS 219 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 1bqm n LYS 220 N 0.00 -1.36 -2.22 1.97 4.01 -1.26 -2.01 118.16 117.29 1bqm n LYS 220 Ca 0.00 0.66 -0.18 0.00 -0.51 0.00 0.00 58.31 58.27 1bqm n LYS 220 Cb 0.00 -4.32 -0.02 0.00 -0.51 0.00 0.00 35.03 30.18 1bqm n LYS 220 CO 0.00 0.00 0.00 0.72 -1.11 0.00 0.00 177.40 177.01 1bqm n HIS 221 N -3.63 -0.73 -0.41 2.13 -0.00 0.31 -4.83 115.22 108.06 1bqm n HIS 221 Ca -0.10 0.00 -0.10 0.00 -0.00 0.00 0.00 57.72 57.52 1bqm n HIS 221 Cb 0.59 -3.53 -0.03 0.00 -0.00 0.00 0.00 29.99 27.02 1bqm n HIS 221 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1bqm n GLN 222 N -2.71 0.00 -3.63 -0.41 -0.00 0.44 -4.69 117.38 106.38 1bqm n GLN 222 Ca -0.21 -0.40 -0.02 0.00 -0.00 0.00 0.00 57.00 56.37 1bqm n GLN 222 Cb 0.65 -1.69 -0.04 0.00 -0.00 0.00 0.00 30.24 29.16 1bqm n GLN 222 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.06 177.21 1bqm s LYS 223 N 4.07 0.57 0.33 2.61 -0.14 -1.26 -4.86 119.74 121.07 1bqm s LYS 223 Ca 0.15 1.36 -0.27 0.00 -1.36 0.00 0.00 55.97 55.85 1bqm s LYS 223 Cb 0.03 0.73 -0.09 0.00 -1.68 0.00 0.00 37.83 36.82 1bqm s LYS 223 CO 0.08 -0.18 1.02 -1.83 -0.76 0.00 0.00 175.35 173.68 1bqm s GLU 224 N 2.66 4.47 0.56 1.68 4.04 -1.26 -4.62 118.70 126.23 1bqm s GLU 224 Ca -0.06 1.54 0.46 0.00 0.04 0.00 0.00 54.97 56.95 1bqm s GLU 224 Cb -0.10 -2.86 1.67 0.00 0.02 0.00 0.00 34.13 32.86 1bqm s GLU 224 CO -0.19 0.13 1.62 -1.00 -1.84 0.00 0.00 175.26 173.98 1bqm h PRO 225 N 3.19 0.00 -5.58 -4.83 0.13 -1.94 -3.39 132.00 119.58 1bqm h PRO 225 Ca -0.47 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.05 1bqm h PRO 225 Cb 1.21 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.23 1bqm h PRO 225 CO 0.65 0.00 0.23 -1.25 -0.23 0.00 0.00 178.00 177.40 1bqm s PRO 226 N -4.86 4.04 0.02 1.56 0.04 -1.26 -4.11 135.00 130.43 1bqm s PRO 226 Ca -0.05 0.54 0.05 0.00 0.04 0.00 0.00 61.00 61.58 1bqm s PRO 226 Cb 0.25 -3.68 -0.03 0.00 0.04 0.00 0.00 34.50 31.08 1bqm s PRO 226 CO 0.86 -0.51 -0.13 -0.06 0.04 0.00 0.00 177.00 177.19 1bqm s PHE 227 N 2.65 2.70 -0.95 0.56 0.08 0.81 -4.94 117.98 118.88 1bqm s PHE 227 Ca 0.28 -0.17 -0.03 0.00 0.12 0.00 0.00 56.93 57.13 1bqm s PHE 227 Cb -0.15 -1.53 0.23 0.00 -0.57 0.00 0.00 43.02 41.01 1bqm s PHE 227 CO 0.10 0.30 0.86 -1.17 -0.10 0.00 0.00 175.22 175.21 1bqm s LEU 228 N -1.40 5.73 -0.47 -0.37 0.20 -1.26 -0.24 118.68 120.88 1bqm s LEU 228 Ca 0.16 -3.73 -0.17 0.00 0.69 0.00 0.00 54.13 51.08 1bqm s LEU 228 Cb -0.11 -1.98 0.05 0.00 -0.43 0.00 0.00 46.19 43.73 1bqm s LEU 228 CO 0.06 -0.20 0.49 0.86 -0.29 0.00 0.00 176.35 177.27 1bqm s TRP 229 N -1.38 3.15 -1.37 5.38 -0.11 0.27 -4.53 118.94 120.36 1bqm s TRP 229 Ca 0.29 -0.63 -0.11 0.00 1.22 0.00 0.00 56.10 56.87 1bqm s TRP 229 Cb -0.08 -3.22 0.01 0.00 -1.50 0.00 0.00 33.47 28.68 1bqm s TRP 229 CO -0.12 -0.85 0.41 -1.33 -4.62 0.00 0.00 176.95 170.44 1bqm n MET 230 N 5.66 -1.64 0.00 5.86 2.81 -1.26 -0.21 117.12 128.34 1bqm n MET 230 Ca -0.09 0.25 0.00 0.00 -1.81 0.00 0.00 57.70 56.05 1bqm n MET 230 Cb 0.45 -3.76 0.00 0.00 -0.71 0.00 0.00 33.22 29.20 1bqm n MET 230 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1bqm n GLY 231 N -2.14 1.96 3.73 3.03 0.00 -1.26 -4.99 105.19 105.52 1bqm n GLY 231 Ca -0.24 -0.36 -0.42 0.00 0.00 0.00 0.00 46.02 45.00 1bqm n GLY 231 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1bqm s TYR 232 N -0.48 2.92 -0.35 1.61 1.51 0.70 -4.32 117.35 118.95 1bqm s TYR 232 Ca 0.00 0.64 -0.15 0.00 -1.01 0.00 0.00 57.07 56.55 1bqm s TYR 232 Cb 0.00 -4.02 -0.01 0.00 -0.11 0.00 0.00 41.96 37.82 1bqm s TYR 232 CO 0.00 -3.64 0.38 -1.83 -1.11 0.00 0.00 175.55 169.35 1bqm s GLU 233 N 0.47 3.53 -0.15 -0.62 1.03 0.32 -0.57 118.70 122.71 1bqm s GLU 233 Ca 0.68 -0.43 -0.03 0.00 0.03 0.00 0.00 54.97 55.23 1bqm s GLU 233 Cb -0.46 -3.82 -0.02 0.00 -0.80 0.00 0.00 34.13 29.03 1bqm s GLU 233 CO 0.38 -0.55 -0.07 -0.51 -1.33 0.00 0.00 175.26 173.18 1bqm s LEU 234 N 2.04 3.08 0.05 1.83 1.43 0.67 -1.86 118.68 125.93 1bqm s LEU 234 Ca 0.12 -0.19 0.08 0.00 -1.03 0.00 0.00 54.13 53.11 1bqm s LEU 234 Cb -0.17 -1.73 -0.03 0.00 0.03 0.00 0.00 46.19 44.30 1bqm s LEU 234 CO 0.12 0.17 -0.23 -1.00 0.23 0.00 0.00 176.35 175.63 1bqm s HIS 235 N 0.37 2.05 -1.15 0.29 3.76 -0.87 -0.14 115.29 119.60 1bqm s HIS 235 Ca -0.06 -0.39 0.00 0.00 -0.15 0.00 0.00 55.06 54.46 1bqm s HIS 235 Cb -0.15 -1.22 0.00 0.00 1.11 0.00 0.00 32.58 32.32 1bqm s HIS 235 CO 0.04 0.11 0.17 -0.35 -0.85 0.00 0.00 174.74 173.86 1bqm n PRO 236 N 1.81 0.00 0.00 8.40 -0.04 -1.26 -2.53 135.00 141.38 1bqm n PRO 236 Ca -0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 1bqm n PRO 236 Cb 0.53 -1.30 0.00 0.00 -0.04 0.00 0.00 33.50 32.68 1bqm n PRO 236 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1bqm n ASP 237 N -0.59 0.00 -3.73 3.54 5.75 -1.26 -4.74 116.55 115.52 1bqm n ASP 237 Ca 0.00 -1.00 -0.06 0.00 -0.01 0.00 0.00 54.79 53.72 1bqm n ASP 237 Cb 0.00 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.07 1bqm n ASP 237 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 1bqm s LYS 238 N 0.00 1.33 0.14 0.11 -2.85 -1.05 -4.52 119.74 112.89 1bqm s LYS 238 Ca 0.00 -0.70 -0.05 0.00 -1.00 0.00 0.00 55.97 54.23 1bqm s LYS 238 Cb 0.00 0.48 -0.02 0.00 -2.06 0.00 0.00 37.83 36.22 1bqm s LYS 238 CO 0.00 -0.60 0.15 1.67 0.10 0.00 0.00 175.35 176.67 1bqm s TRP 239 N -3.48 0.62 -0.31 1.78 1.48 0.36 -2.06 118.94 117.33 1bqm s TRP 239 Ca 0.10 -1.00 0.00 0.00 -1.06 0.00 0.00 56.10 54.14 1bqm s TRP 239 Cb -0.03 -0.28 0.00 0.00 -1.16 0.00 0.00 33.47 32.01 1bqm s TRP 239 CO 0.01 -0.60 0.00 2.41 -4.06 0.00 0.00 176.95 174.71 1bqm n THR 240 N -0.13 0.00 -4.43 0.66 -1.04 -0.78 0.06 114.28 108.62 1bqm n THR 240 Ca -0.07 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.60 1bqm n THR 240 Cb 0.63 0.00 -0.14 0.00 -1.82 0.00 0.00 70.33 69.00 1bqm n THR 240 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1bqm s VAL 241 N -2.55 3.27 0.00 12.58 1.01 -1.26 0.12 120.40 133.57 1bqm s VAL 241 Ca 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.42 1bqm s VAL 241 Cb 0.00 -2.42 0.00 0.00 0.00 0.00 0.00 36.38 33.96 1bqm s VAL 241 CO 0.00 0.49 0.08 1.67 0.00 0.00 0.00 175.10 177.34 1bqm n GLN 242 N 3.93 0.00 -2.65 2.72 -0.06 -1.26 -4.77 117.38 115.28 1bqm n GLN 242 Ca -0.18 0.32 -0.43 0.00 -2.00 0.00 0.00 57.00 54.71 1bqm n GLN 242 Cb 0.52 -0.87 -0.02 0.00 -4.06 0.00 0.00 30.24 25.81 1bqm n GLN 242 CO 0.00 0.00 0.00 -2.14 -0.20 0.00 0.00 177.06 174.72 1bqm s PRO 243 N -0.80 4.26 -0.42 3.69 0.02 -1.26 -4.87 135.00 135.62 1bqm s PRO 243 Ca 0.00 1.37 0.09 0.00 0.02 0.00 0.00 61.00 62.48 1bqm s PRO 243 Cb 0.00 -3.64 0.35 0.00 0.02 0.00 0.00 34.50 31.23 1bqm s PRO 243 CO 0.00 -0.63 1.05 1.51 -0.33 0.00 0.00 177.00 178.60 1bqm n ILE 244 N 5.31 0.04 -3.06 2.83 0.13 -1.26 -5.10 119.36 118.26 1bqm n ILE 244 Ca 0.12 -2.38 -0.45 0.00 -1.10 0.00 0.00 62.75 58.94 1bqm n ILE 244 Cb 0.46 0.92 -0.03 0.00 -0.84 0.00 0.00 39.64 40.14 1bqm n ILE 244 CO 0.00 0.00 0.00 0.68 2.80 0.00 0.00 176.55 180.03 1bqm s VAL 245 N -0.68 4.87 -0.59 9.51 -7.23 -1.26 -5.02 120.40 120.00 1bqm s VAL 245 Ca 0.27 -1.36 -0.19 0.00 -1.81 0.00 0.00 61.98 58.88 1bqm s VAL 245 Cb 0.34 -4.60 0.10 0.00 0.56 0.00 0.00 36.38 32.77 1bqm s VAL 245 CO -0.06 -1.27 0.72 -1.48 -0.31 0.00 0.00 175.10 172.70 1bqm s LEU 246 N 2.42 5.28 1.34 1.32 0.05 -1.26 -5.05 118.68 122.77 1bqm s LEU 246 Ca 0.21 -1.35 -0.21 0.00 0.05 0.00 0.00 54.13 52.82 1bqm s LEU 246 Cb -0.15 -2.32 0.34 0.00 -2.05 0.00 0.00 46.19 42.01 1bqm s LEU 246 CO -0.01 -1.12 0.99 -2.16 -0.55 0.00 0.00 176.35 173.50 1bqm s PRO 247 N 2.79 -2.27 0.08 1.48 0.04 -1.26 -5.09 135.00 130.77 1bqm s PRO 247 Ca 0.13 0.14 0.02 0.00 0.04 0.00 0.00 61.00 61.32 1bqm s PRO 247 Cb -0.23 -1.45 -0.04 0.00 0.04 0.00 0.00 34.50 32.82 1bqm s PRO 247 CO 0.07 -4.44 -0.07 -1.21 0.04 0.00 0.00 177.00 171.39 1bqm s GLU 248 N -5.12 0.76 0.00 4.56 2.02 -1.26 -5.13 118.70 114.54 1bqm s GLU 248 Ca 0.69 -1.19 0.00 0.00 0.02 0.00 0.00 54.97 54.49 1bqm s GLU 248 Cb -0.13 -0.24 0.00 0.00 0.10 0.00 0.00 34.13 33.86 1bqm s GLU 248 CO 0.58 0.00 0.00 1.63 0.02 0.00 0.00 175.26 177.49 1bqm n LYS 249 N 0.34 1.46 0.00 1.61 4.76 -1.26 -5.08 118.16 119.99 1bqm n LYS 249 Ca -0.15 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.29 1bqm n LYS 249 Cb 0.59 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.78 1bqm n LYS 249 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1bqm n ASP 250 N 0.00 0.12 -2.71 4.39 5.75 -1.26 -4.96 116.55 117.88 1bqm n ASP 250 Ca 0.00 -0.43 -0.06 0.00 -0.01 0.00 0.00 54.79 54.29 1bqm n ASP 250 Cb 0.00 0.28 0.06 0.00 -1.03 0.00 0.00 41.12 40.43 1bqm n ASP 250 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1bqm n SER 251 N -0.28 -2.12 -4.86 -1.12 3.41 -1.26 -5.03 113.62 102.35 1bqm n SER 251 Ca 0.00 -2.45 -0.34 0.00 -0.26 0.00 0.00 58.87 55.81 1bqm n SER 251 Cb 0.04 1.26 -0.06 0.00 -0.26 0.00 0.00 64.21 65.19 1bqm n SER 251 CO 0.00 0.00 0.00 -1.66 -0.16 0.00 0.00 175.04 173.22 1bqm s TRP 252 N 0.46 3.57 0.91 7.33 -2.14 -1.26 -4.90 118.94 122.90 1bqm s TRP 252 Ca 0.29 0.89 -0.15 0.00 2.66 0.00 0.00 56.10 59.79 1bqm s TRP 252 Cb 0.20 -2.25 0.16 0.00 -3.10 0.00 0.00 33.47 28.49 1bqm s TRP 252 CO -0.15 0.45 1.28 0.95 -2.66 0.00 0.00 176.95 176.81 1bqm s THR 253 N -1.49 2.00 0.32 0.66 -4.23 -1.26 -2.40 115.64 109.24 1bqm s THR 253 Ca 0.37 0.00 0.05 0.00 -1.18 0.00 0.00 61.69 60.93 1bqm s THR 253 Cb -0.14 -3.00 0.10 0.00 1.34 0.00 0.00 72.50 70.80 1bqm s THR 253 CO 0.19 0.00 1.79 0.58 -0.54 0.00 0.00 174.62 176.65 1bqm h VAL 254 N -1.45 1.24 -0.93 2.29 2.07 -1.65 -2.19 116.25 115.63 1bqm h VAL 254 Ca -0.45 -1.10 0.25 0.00 0.82 0.00 0.00 66.70 66.22 1bqm h VAL 254 Cb 1.27 1.29 -0.05 0.00 -1.52 0.00 0.00 31.29 32.28 1bqm h VAL 254 CO 0.47 0.35 0.64 -1.13 0.02 0.00 0.00 177.57 177.92 1bqm h ASN 255 N 0.36 0.16 0.00 0.57 -0.73 -1.84 -0.82 115.58 113.28 1bqm h ASN 255 Ca 0.06 0.02 0.00 0.00 1.87 0.00 0.00 56.30 58.25 1bqm h ASN 255 Cb 0.56 -0.01 0.00 0.00 0.27 0.00 0.00 38.32 39.14 1bqm h ASN 255 CO 0.04 0.05 -1.30 0.47 -0.37 0.00 0.00 177.43 176.32 1bqm n ASP 256 N -4.37 0.70 0.17 1.15 8.00 -0.85 -4.14 116.55 117.20 1bqm n ASP 256 Ca 0.20 -0.66 0.11 0.00 0.71 0.00 0.00 54.79 55.15 1bqm n ASP 256 Cb 0.89 1.32 0.09 0.00 -0.02 0.00 0.00 41.12 43.40 1bqm n ASP 256 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1bqm h ILE 257 N 0.00 0.06 0.00 0.53 2.04 -0.93 -2.87 117.51 116.34 1bqm h ILE 257 Ca 0.00 -1.09 -0.15 0.00 1.00 0.00 0.00 64.86 64.62 1bqm h ILE 257 Cb 0.65 1.82 -0.02 0.00 -0.74 0.00 0.00 36.82 38.53 1bqm h ILE 257 CO 0.00 0.03 -0.72 1.56 0.00 0.00 0.00 178.15 179.02 1bqm h GLN 258 N 0.00 0.00 0.01 2.37 4.20 -1.59 0.72 115.11 120.82 1bqm h GLN 258 Ca -0.01 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.51 1bqm h GLN 258 Cb 1.04 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.80 1bqm h GLN 258 CO 0.00 0.72 -0.91 0.87 -0.67 0.00 0.00 178.83 178.84 1bqm h LYS 259 N 0.00 0.12 -0.12 1.46 1.57 -1.71 -2.55 116.57 115.34 1bqm h LYS 259 Ca -0.01 -0.15 -0.03 0.00 -1.87 0.00 0.00 60.65 58.59 1bqm h LYS 259 Cb 1.40 0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.76 1bqm h LYS 259 CO 0.09 0.95 -0.05 1.25 -0.57 0.00 0.00 179.45 181.12 1bqm h LEU 260 N 0.06 0.25 -0.43 2.94 5.85 -1.25 -1.46 115.31 121.26 1bqm h LEU 260 Ca -0.04 -0.41 0.00 0.00 0.84 0.00 0.00 57.88 58.28 1bqm h LEU 260 Cb 1.57 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.53 1bqm h LEU 260 CO 0.13 0.60 0.00 0.52 -0.34 0.00 0.00 178.44 179.35 1bqm n VAL 261 N -4.71 0.89 -0.01 1.05 0.31 0.22 -2.77 118.33 113.31 1bqm n VAL 261 Ca -0.06 0.23 -0.04 0.00 -0.01 0.00 0.00 64.34 64.46 1bqm n VAL 261 Cb 0.27 -1.10 -0.03 0.00 -0.91 0.00 0.00 33.84 32.08 1bqm n VAL 261 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1bqm h GLY 262 N 2.36 -0.11 0.75 2.92 0.00 -0.89 -3.21 103.07 104.89 1bqm h GLY 262 Ca 0.00 0.04 0.03 0.00 0.00 0.00 0.00 47.33 47.41 1bqm h GLY 262 CO 0.00 -0.04 0.15 0.50 0.00 0.00 0.00 176.54 177.15 1bqm h LYS 263 N -1.01 0.31 -0.28 4.80 1.57 -1.19 -0.92 116.57 119.84 1bqm h LYS 263 Ca -0.01 -0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.80 1bqm h LYS 263 Cb 0.24 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1bqm h LYS 263 CO 0.02 0.20 0.20 -0.07 -0.57 0.00 0.00 179.45 179.23 1bqm h LEU 264 N 0.32 0.15 0.24 2.94 3.38 -1.69 -0.79 115.31 119.86 1bqm h LEU 264 Ca 0.16 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 1bqm h LEU 264 Cb 0.10 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1bqm h LEU 264 CO -0.14 0.10 -0.12 -1.13 0.09 0.00 0.00 178.44 177.24 1bqm h ASN 265 N 0.17 -0.28 -0.76 -0.43 -0.00 -1.21 -3.12 115.58 109.95 1bqm h ASN 265 Ca 0.13 -0.23 0.06 0.00 -0.00 0.00 0.00 56.30 56.26 1bqm h ASN 265 Cb 0.29 0.07 -0.06 0.00 -0.00 0.00 0.00 38.32 38.62 1bqm h ASN 265 CO -0.02 0.12 0.45 -0.25 -0.00 0.00 0.00 177.43 177.73 1bqm h TRP 266 N -0.73 0.82 0.00 0.67 2.91 -0.68 0.93 115.95 119.87 1bqm h TRP 266 Ca -0.03 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.01 1bqm h TRP 266 Cb 0.49 -0.26 0.00 0.00 -0.51 0.00 0.00 29.16 28.89 1bqm h TRP 266 CO 0.04 0.40 0.00 0.00 -1.03 0.00 0.00 178.44 177.85 1bqm n ALA 267 N -2.35 1.26 0.27 2.65 0.00 -0.36 -2.30 120.51 119.69 1bqm n ALA 267 Ca 0.10 0.15 0.14 0.00 0.00 0.00 0.00 53.44 53.83 1bqm n ALA 267 Cb 0.18 -1.33 0.65 0.00 0.00 0.00 0.00 19.45 18.96 1bqm n ALA 267 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1bqm h SER 268 N 0.00 0.00 -0.47 0.00 0.02 -0.74 -3.00 113.55 109.36 1bqm h SER 268 Ca 0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 1bqm h SER 268 Cb 0.13 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.65 1bqm h SER 268 CO 0.00 0.00 0.23 1.56 -1.14 0.00 0.00 176.83 177.48 1bqm h GLN 269 N 0.00 0.68 0.00 3.45 4.20 -1.51 -3.09 115.11 118.85 1bqm h GLN 269 Ca 0.00 -0.10 -0.09 0.00 0.06 0.00 0.00 58.65 58.52 1bqm h GLN 269 Cb 0.17 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 1bqm h GLN 269 CO 0.00 0.58 -1.09 -0.89 -0.67 0.00 0.00 178.83 176.75 1bqm n ILE 270 N -4.63 1.34 -1.54 2.54 -0.00 -1.14 0.47 119.36 116.39 1bqm n ILE 270 Ca 0.01 0.08 -0.25 0.00 -0.00 0.00 0.00 62.75 62.60 1bqm n ILE 270 Cb 0.12 -2.03 -0.08 0.00 -0.00 0.00 0.00 39.64 37.64 1bqm n ILE 270 CO 0.00 0.00 0.00 -1.22 -0.00 0.00 0.00 176.55 175.33 1bqm n TYR 271 N -4.11 1.09 -1.39 1.39 4.02 -1.16 -4.63 117.16 112.38 1bqm n TYR 271 Ca -0.18 0.07 -0.52 0.00 -0.01 0.00 0.00 57.90 57.26 1bqm n TYR 271 Cb 0.48 -2.39 -0.09 0.00 -0.02 0.00 0.00 39.34 37.33 1bqm n TYR 271 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1bqm n PRO 272 N 8.51 0.68 -0.24 -0.72 -0.04 -1.26 -4.35 135.00 137.58 1bqm n PRO 272 Ca 0.47 0.17 0.00 0.00 -0.04 0.00 0.00 63.50 64.11 1bqm n PRO 272 Cb 0.41 -2.14 0.00 0.00 -0.04 0.00 0.00 33.50 31.72 1bqm n PRO 272 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1bqm n GLY 273 N 6.82 -0.13 3.62 0.55 0.00 -1.26 -5.05 105.19 109.74 1bqm n GLY 273 Ca 0.47 -0.93 -0.09 0.00 0.00 0.00 0.00 46.02 45.47 1bqm n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bqm s ILE 274 N 0.00 0.00 -0.10 -0.61 1.01 -1.26 -4.95 121.20 115.29 1bqm s ILE 274 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 60.65 60.60 1bqm s ILE 274 Cb 0.00 -1.00 0.04 0.00 0.01 0.00 0.00 42.46 41.51 1bqm s ILE 274 CO 0.00 0.00 0.22 -1.59 0.00 0.00 0.00 174.94 173.57 1bqm s LYS 275 N -0.37 0.18 -0.23 2.79 -2.85 -1.26 -4.91 119.74 113.09 1bqm s LYS 275 Ca 0.02 0.49 0.12 0.00 -1.00 0.00 0.00 55.97 55.60 1bqm s LYS 275 Cb -0.03 -0.13 0.46 0.00 -2.06 0.00 0.00 37.83 36.07 1bqm s LYS 275 CO -0.04 -0.16 1.36 0.28 0.10 0.00 0.00 175.35 176.89 1bqm n VAL 276 N 4.21 2.35 0.00 1.79 0.31 -1.26 -4.85 118.33 120.88 1bqm n VAL 276 Ca -0.25 -2.66 0.00 0.00 -0.01 0.00 0.00 64.34 61.41 1bqm n VAL 276 Cb 0.53 -0.28 0.00 0.00 -0.91 0.00 0.00 33.84 33.18 1bqm n VAL 276 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1bqm n ARG 277 N -1.07 0.00 0.29 5.55 1.74 -1.26 -3.19 116.66 118.72 1bqm n ARG 277 Ca 0.26 0.44 0.19 0.00 -0.77 0.00 0.00 57.85 57.97 1bqm n ARG 277 Cb 0.88 -1.37 0.98 0.00 -1.02 0.00 0.00 32.46 31.94 1bqm n ARG 277 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1bqm h GLN 278 N 0.00 0.00 0.00 5.56 4.20 -1.88 0.16 115.11 123.15 1bqm h GLN 278 Ca 0.00 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.57 1bqm h GLN 278 Cb 0.00 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 1bqm h GLN 278 CO 0.00 0.00 -0.65 -0.07 -0.67 0.00 0.00 178.83 177.44 1bqm h LEU 279 N 0.00 0.00 0.00 1.46 -0.00 -1.87 -3.25 115.31 111.66 1bqm h LEU 279 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1bqm h LEU 279 Cb 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.78 1bqm h LEU 279 CO 0.00 0.65 -1.80 -1.54 -0.00 0.00 0.00 178.44 175.75 1bqm n SER 280 N -3.44 0.60 -0.32 -0.43 3.41 -0.31 -4.47 113.62 108.65 1bqm n SER 280 Ca 0.00 -0.08 0.15 0.00 -0.26 0.00 0.00 58.87 58.68 1bqm n SER 280 Cb 0.72 1.81 0.38 0.00 -0.26 0.00 0.00 64.21 66.86 1bqm n SER 280 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1bqm h LYS 281 N 0.00 0.65 -0.00 4.33 3.64 -0.78 -0.23 116.57 124.18 1bqm h LYS 281 Ca 0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1bqm h LYS 281 Cb 0.85 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.52 1bqm h LYS 281 CO 0.00 0.43 -0.34 1.47 -2.27 0.00 0.00 179.45 178.74 1bqm n LEU 282 N -4.68 0.74 0.00 5.20 -0.00 -1.26 -4.10 117.00 112.91 1bqm n LEU 282 Ca 0.22 -0.12 0.04 0.00 -0.00 0.00 0.00 56.01 56.15 1bqm n LEU 282 Cb 0.60 -0.19 0.24 0.00 -0.00 0.00 0.00 43.42 44.07 1bqm n LEU 282 CO 0.25 0.15 0.48 -0.11 -0.00 0.00 0.00 177.39 178.16 1bqm n LEU 283 N -1.05 0.00 -0.33 1.47 7.94 -0.10 -3.74 117.00 121.20 1bqm n LEU 283 Ca 0.09 0.04 0.27 0.00 -1.11 0.00 0.00 56.01 55.30 1bqm n LEU 283 Cb 0.34 -0.04 0.51 0.00 0.53 0.00 0.00 43.42 44.76 1bqm n LEU 283 CO 0.30 -0.03 1.01 0.03 -1.11 0.00 0.00 177.39 177.59 1bqm h ARG 284 N 0.00 0.04 -5.66 1.96 3.08 -1.75 -3.25 114.38 108.80 1bqm h ARG 284 Ca 0.00 -0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.76 1bqm h ARG 284 Cb 0.01 -0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.00 1bqm h ARG 284 CO 0.00 0.03 0.76 0.20 -1.07 0.00 0.00 179.97 179.89 1bqm s GLY 285 N -4.43 0.14 0.00 0.04 0.00 -1.25 -4.76 107.32 97.07 1bqm s GLY 285 Ca -0.10 -1.60 0.00 0.00 0.00 0.00 0.00 44.72 43.02 1bqm s GLY 285 CO 0.78 3.53 1.09 2.41 0.00 0.00 0.00 173.10 180.91 1bqm n THR 286 N 7.90 1.09 0.00 0.90 -1.04 -1.23 -4.82 114.28 117.08 1bqm n THR 286 Ca 0.41 -0.16 0.00 0.00 -2.04 0.00 0.00 64.05 62.26 1bqm n THR 286 Cb 0.47 -1.10 0.00 0.00 -1.82 0.00 0.00 70.33 67.88 1bqm n THR 286 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1bqm n LYS 287 N 1.05 1.69 -2.24 -2.82 4.01 -1.26 -5.00 118.16 113.59 1bqm n LYS 287 Ca 0.00 0.00 -0.33 0.00 -0.51 0.00 0.00 58.31 57.47 1bqm n LYS 287 Cb 0.38 0.00 -0.01 0.00 -0.51 0.00 0.00 35.03 34.89 1bqm n LYS 287 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1bqm s ALA 288 N -2.71 2.87 -0.10 7.82 0.00 -1.26 -4.93 121.76 123.44 1bqm s ALA 288 Ca 0.00 0.35 -0.04 0.00 0.00 0.00 0.00 51.96 52.27 1bqm s ALA 288 Cb 0.00 -3.19 -0.12 0.00 0.00 0.00 0.00 23.12 19.81 1bqm s ALA 288 CO 0.00 -0.54 2.99 1.28 0.00 0.00 0.00 175.76 179.50 1bqm n LEU 289 N -1.73 5.57 0.00 0.00 7.99 -1.26 -2.96 117.00 124.61 1bqm n LEU 289 Ca 0.08 -3.16 0.00 0.00 -0.01 0.00 0.00 56.01 52.92 1bqm n LEU 289 Cb 0.53 -1.30 0.00 0.00 -0.11 0.00 0.00 43.42 42.55 1bqm n LEU 289 CO 0.46 1.51 0.00 1.07 -1.51 0.00 0.00 177.39 178.92 1bqm n THR 290 N 1.83 0.00 -2.74 -5.08 5.66 -1.26 -4.33 114.28 108.36 1bqm n THR 290 Ca 0.33 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.91 1bqm n THR 290 Cb 0.74 0.21 -0.03 0.00 -1.55 0.00 0.00 70.33 69.70 1bqm n THR 290 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 175.07 170.19 1bqm s GLU 291 N 0.00 4.53 0.10 1.09 4.04 -1.16 -4.83 118.70 122.47 1bqm s GLU 291 Ca 0.00 1.36 -0.21 0.00 0.04 0.00 0.00 54.97 56.16 1bqm s GLU 291 Cb 0.00 -3.47 -0.07 0.00 0.02 0.00 0.00 34.13 30.61 1bqm s GLU 291 CO 0.00 -0.07 0.63 0.54 -1.84 0.00 0.00 175.26 174.52 1bqm s VAL 292 N 1.10 4.64 -0.21 1.83 0.11 -1.26 -1.96 120.40 124.64 1bqm s VAL 292 Ca 0.50 1.36 0.00 0.00 -2.93 0.00 0.00 61.98 60.91 1bqm s VAL 292 Cb -0.20 -3.97 0.03 0.00 -1.53 0.00 0.00 36.38 30.70 1bqm s VAL 292 CO 0.26 0.54 -0.14 -0.63 -3.33 0.00 0.00 175.10 171.80 1bqm s ILE 293 N -1.09 2.37 -0.75 7.04 -1.09 -1.01 -4.94 121.20 121.72 1bqm s ILE 293 Ca 0.31 -1.04 -0.26 0.00 -2.23 0.00 0.00 60.65 57.43 1bqm s ILE 293 Cb -0.21 -2.12 -0.05 0.00 -1.58 0.00 0.00 42.46 38.51 1bqm s ILE 293 CO 0.21 0.36 1.98 -2.16 -1.23 0.00 0.00 174.94 174.10 1bqm s PRO 294 N 1.28 2.47 0.17 2.79 0.04 -1.26 -4.60 135.00 135.90 1bqm s PRO 294 Ca 0.02 0.23 -0.32 0.00 0.04 0.00 0.00 61.00 60.97 1bqm s PRO 294 Cb -0.15 -4.75 -0.16 0.00 0.04 0.00 0.00 34.50 29.48 1bqm s PRO 294 CO -0.09 -3.21 1.03 -0.11 0.04 0.00 0.00 177.00 174.65 1bqm n LEU 295 N 14.02 0.95 -4.62 -3.56 7.94 -1.26 -4.93 117.00 125.54 1bqm n LEU 295 Ca 0.33 1.15 -0.29 0.00 -1.11 0.00 0.00 56.01 56.08 1bqm n LEU 295 Cb 0.49 -1.15 0.19 0.00 0.53 0.00 0.00 43.42 43.48 1bqm n LEU 295 CO 0.64 -1.65 0.61 0.42 -1.11 0.00 0.00 177.39 176.30 1bqm s THR 296 N -0.43 2.25 -0.06 1.96 -4.23 -1.26 -4.93 115.64 108.94 1bqm s THR 296 Ca 0.71 0.08 0.19 0.00 -1.18 0.00 0.00 61.69 61.50 1bqm s THR 296 Cb -0.89 -2.36 0.16 0.00 1.34 0.00 0.00 72.50 70.75 1bqm s THR 296 CO 0.54 -0.10 1.62 1.05 -0.54 0.00 0.00 174.62 177.19 1bqm h GLU 297 N -2.04 0.00 0.00 3.99 9.09 -2.00 -2.97 114.58 120.64 1bqm h GLU 297 Ca -0.54 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.87 1bqm h GLU 297 Cb 1.31 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.41 1bqm h GLU 297 CO 0.52 0.35 0.00 0.39 0.05 0.00 0.00 179.01 180.32 1bqm n GLU 298 N -3.29 0.21 0.02 1.06 1.02 -1.26 -1.72 120.64 116.68 1bqm n GLU 298 Ca 0.01 0.21 -0.12 0.00 -0.02 0.00 0.00 57.16 57.24 1bqm n GLU 298 Cb 0.59 -1.76 -0.14 0.00 -0.02 0.00 0.00 31.44 30.12 1bqm n GLU 298 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1bqm h ALA 299 N 2.57 0.53 0.02 0.62 0.00 -1.78 -3.15 119.26 118.06 1bqm h ALA 299 Ca 0.00 -1.26 -0.24 0.00 0.00 0.00 0.00 54.91 53.41 1bqm h ALA 299 Cb 0.65 0.33 0.01 0.00 0.00 0.00 0.00 17.79 18.78 1bqm h ALA 299 CO 0.00 1.38 -0.99 1.49 0.00 0.00 0.00 179.25 181.13 1bqm h GLU 300 N 0.03 0.43 -0.03 0.00 4.81 -1.50 0.26 114.58 118.57 1bqm h GLU 300 Ca -0.24 -0.48 0.01 0.00 -0.13 0.00 0.00 59.36 58.52 1bqm h GLU 300 Cb 1.97 0.14 -0.00 0.00 0.63 0.00 0.00 28.75 31.49 1bqm h GLU 300 CO 0.11 1.14 0.08 -0.07 -0.73 0.00 0.00 179.01 179.55 1bqm h LEU 301 N 0.23 0.00 0.00 1.64 -0.00 -1.41 0.25 115.31 116.03 1bqm h LEU 301 Ca -0.09 0.00 -0.36 0.00 -0.00 0.00 0.00 57.88 57.43 1bqm h LEU 301 Cb 1.63 0.00 -0.07 0.00 -0.00 0.00 0.00 40.66 42.23 1bqm h LEU 301 CO 0.17 0.00 -2.36 1.21 -0.00 0.00 0.00 178.44 177.46 1bqm n GLU 302 N -3.38 0.72 0.03 1.13 2.13 -1.04 -2.95 120.64 117.28 1bqm n GLU 302 Ca -0.02 0.08 0.01 0.00 0.66 0.00 0.00 57.16 57.89 1bqm n GLU 302 Cb 0.16 -1.49 0.32 0.00 0.27 0.00 0.00 31.44 30.70 1bqm n GLU 302 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 1bqm h LEU 303 N 0.00 0.41 0.20 4.31 5.85 0.61 -0.62 115.31 126.07 1bqm h LEU 303 Ca -0.54 -0.08 -0.32 0.00 0.84 0.00 0.00 57.88 57.78 1bqm h LEU 303 Cb 1.98 -0.11 0.02 0.00 0.37 0.00 0.00 40.66 42.93 1bqm h LEU 303 CO -0.04 0.51 -1.49 0.00 -0.34 0.00 0.00 178.44 177.08 1bqm h ALA 304 N 1.54 -0.01 0.00 1.25 0.00 -0.73 -2.37 119.26 118.94 1bqm h ALA 304 Ca 0.09 -0.96 0.00 0.00 0.00 0.00 0.00 54.91 54.04 1bqm h ALA 304 Cb 0.35 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1bqm h ALA 304 CO 0.01 0.78 0.00 -1.91 0.00 0.00 0.00 179.25 178.14 1bqm n GLU 305 N -3.75 0.09 -0.09 0.00 2.13 -0.98 -1.49 120.64 116.56 1bqm n GLU 305 Ca -0.20 0.52 -0.16 0.00 0.66 0.00 0.00 57.16 57.98 1bqm n GLU 305 Cb 1.04 -1.76 -0.08 0.00 0.27 0.00 0.00 31.44 30.90 1bqm n GLU 305 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 1bqm h ASN 306 N 0.00 0.00 0.00 4.31 -0.26 -1.10 -3.39 115.58 115.14 1bqm h ASN 306 Ca 0.00 -0.34 0.00 0.00 -0.56 0.00 0.00 56.30 55.40 1bqm h ASN 306 Cb 0.09 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.35 1bqm h ASN 306 CO 0.00 1.23 0.65 0.03 -1.06 0.00 0.00 177.43 178.28 1bqm h ARG 307 N -1.00 0.00 0.00 0.81 3.08 -0.71 0.59 114.38 117.15 1bqm h ARG 307 Ca -0.23 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.80 1bqm h ARG 307 Cb 1.02 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.07 1bqm h ARG 307 CO -0.14 0.00 -0.15 1.49 -1.07 0.00 0.00 179.97 180.10 1bqm h GLU 308 N 0.00 0.00 0.00 0.04 4.81 -1.73 -1.52 114.58 116.18 1bqm h GLU 308 Ca 0.00 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1bqm h GLU 308 Cb 1.30 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.68 1bqm h GLU 308 CO 0.00 0.51 -0.12 0.82 -0.73 0.00 0.00 179.01 179.49 1bqm h ILE 309 N -1.00 1.02 0.09 2.32 2.04 -1.34 -1.84 117.51 118.80 1bqm h ILE 309 Ca -0.03 -0.42 -0.26 0.00 1.00 0.00 0.00 64.86 65.16 1bqm h ILE 309 Cb 0.58 1.23 0.00 0.00 -0.74 0.00 0.00 36.82 37.89 1bqm h ILE 309 CO -0.02 0.12 -1.14 0.25 0.00 0.00 0.00 178.15 177.36 1bqm h LEU 310 N 0.00 0.42 0.00 1.44 6.46 -1.06 -3.38 115.31 119.19 1bqm h LEU 310 Ca -0.00 -0.41 0.00 0.00 -0.12 0.00 0.00 57.88 57.35 1bqm h LEU 310 Cb 0.22 -0.13 0.00 0.00 -0.73 0.00 0.00 40.66 40.01 1bqm h LEU 310 CO 0.02 1.29 0.00 0.29 -0.62 0.00 0.00 178.44 179.41 1bqm n LYS 311 N -3.58 0.00 -2.02 1.25 5.02 -0.57 -4.38 118.16 113.88 1bqm n LYS 311 Ca -0.07 0.32 -0.43 0.00 -2.02 0.00 0.00 58.31 56.11 1bqm n LYS 311 Cb 0.96 -1.31 -0.03 0.00 -0.02 0.00 0.00 35.03 34.64 1bqm n LYS 311 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1bqm s GLU 312 N -2.22 3.43 0.71 1.97 4.04 -1.17 -4.92 118.70 120.53 1bqm s GLU 312 Ca 0.00 1.48 -0.17 0.00 0.04 0.00 0.00 54.97 56.32 1bqm s GLU 312 Cb 0.00 -4.17 -0.12 0.00 0.02 0.00 0.00 34.13 29.86 1bqm s GLU 312 CO 0.00 -1.75 -0.14 -0.35 -1.84 0.00 0.00 175.26 171.18 1bqm n PRO 313 N 8.30 0.07 -4.38 -4.83 -0.04 -1.26 -4.90 135.00 127.96 1bqm n PRO 313 Ca 0.22 0.04 -0.19 0.00 -0.04 0.00 0.00 63.50 63.52 1bqm n PRO 313 Cb 0.46 -1.23 -0.14 0.00 -0.04 0.00 0.00 33.50 32.56 1bqm n PRO 313 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1bqm s VAL 314 N -1.98 0.94 0.42 0.52 1.01 -1.26 -5.11 120.40 114.93 1bqm s VAL 314 Ca 0.54 -0.74 0.05 0.00 0.00 0.00 0.00 61.98 61.83 1bqm s VAL 314 Cb -0.36 -0.83 0.01 0.00 0.00 0.00 0.00 36.38 35.19 1bqm s VAL 314 CO 0.69 0.09 0.59 -1.38 0.00 0.00 0.00 175.10 175.08 1bqm s HIS 315 N -0.60 2.99 -0.04 5.22 -3.43 -1.26 -4.82 115.29 113.35 1bqm s HIS 315 Ca 0.02 -0.17 -0.02 0.00 -0.80 0.00 0.00 55.06 54.10 1bqm s HIS 315 Cb -0.06 -2.30 0.03 0.00 -1.43 0.00 0.00 32.58 28.82 1bqm s HIS 315 CO 0.00 -0.34 0.05 0.20 -2.00 0.00 0.00 174.74 172.65 1bqm s GLY 316 N -4.28 0.22 0.73 -1.38 0.00 0.11 -4.80 107.32 97.92 1bqm s GLY 316 Ca 0.51 0.17 -0.11 0.00 0.00 0.00 0.00 44.72 45.29 1bqm s GLY 316 CO 0.34 1.29 1.09 0.54 0.00 0.00 0.00 173.10 176.36 1bqm s VAL 317 N 2.03 3.50 0.55 1.40 0.11 0.03 0.13 120.40 128.16 1bqm s VAL 317 Ca 0.03 0.49 0.08 0.00 -2.93 0.00 0.00 61.98 59.65 1bqm s VAL 317 Cb -0.12 -3.38 0.06 0.00 -1.53 0.00 0.00 36.38 31.42 1bqm s VAL 317 CO -0.03 -0.64 0.65 -0.31 -3.33 0.00 0.00 175.10 171.44 1bqm s TYR 318 N -3.25 1.59 0.07 1.54 2.02 -1.26 -4.64 117.35 113.42 1bqm s TYR 318 Ca 0.59 -0.74 -0.10 0.00 -0.37 0.00 0.00 57.07 56.45 1bqm s TYR 318 Cb -0.12 -2.13 -0.06 0.00 -0.40 0.00 0.00 41.96 39.25 1bqm s TYR 318 CO 0.53 -0.88 0.40 -0.47 -1.57 0.00 0.00 175.55 173.56 1bqm s TYR 319 N -2.68 3.60 -0.34 2.71 5.04 0.64 -4.99 117.35 121.33 1bqm s TYR 319 Ca 0.53 0.82 0.01 0.00 -2.44 0.00 0.00 57.07 55.98 1bqm s TYR 319 Cb -0.05 -2.18 0.11 0.00 0.35 0.00 0.00 41.96 40.19 1bqm s TYR 319 CO 0.33 0.53 0.12 0.34 -1.34 0.00 0.00 175.55 175.53 1bqm s ASP 320 N -1.67 4.07 0.63 4.32 -1.08 -1.26 -4.24 116.67 117.44 1bqm s ASP 320 Ca 0.32 -1.93 0.17 0.00 -0.52 0.00 0.00 52.55 50.59 1bqm s ASP 320 Cb -0.14 -1.02 0.71 0.00 -1.46 0.00 0.00 42.92 41.00 1bqm s ASP 320 CO 0.17 -0.38 1.33 1.55 0.52 0.00 0.00 175.17 178.36 1bqm h PRO 321 N 7.73 0.00 0.05 4.34 0.13 -1.97 0.19 132.00 142.46 1bqm h PRO 321 Ca -0.09 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.72 1bqm h PRO 321 Cb 1.00 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.09 1bqm h PRO 321 CO 0.48 0.00 -1.80 -1.13 -0.23 0.00 0.00 178.00 175.32 1bqm n SER 322 N -2.95 1.32 -4.75 1.44 3.41 -1.26 -4.90 113.62 105.94 1bqm n SER 322 Ca 0.09 0.35 -0.41 0.00 -0.26 0.00 0.00 58.87 58.64 1bqm n SER 322 Cb 1.07 -0.35 -0.04 0.00 -0.26 0.00 0.00 64.21 64.62 1bqm n SER 322 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1bqm s LYS 323 N -2.58 4.60 0.94 4.33 3.01 0.65 -5.01 119.74 125.67 1bqm s LYS 323 Ca -0.11 1.77 -0.21 0.00 -1.01 0.00 0.00 55.97 56.41 1bqm s LYS 323 Cb 0.07 -3.24 -0.09 0.00 -1.01 0.00 0.00 37.83 33.56 1bqm s LYS 323 CO 0.81 0.10 -0.92 -0.25 0.51 0.00 0.00 175.35 175.60 1bqm n ASP 324 N 1.98 -2.73 -3.67 2.83 8.00 -1.26 -4.81 116.55 116.88 1bqm n ASP 324 Ca 0.02 -0.05 -0.23 0.00 0.71 0.00 0.00 54.79 55.23 1bqm n ASP 324 Cb 0.45 -0.59 -0.17 0.00 -0.02 0.00 0.00 41.12 40.79 1bqm n ASP 324 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1bqm s LEU 325 N 5.93 0.40 -0.02 0.64 1.43 -1.26 -4.32 118.68 121.47 1bqm s LEU 325 Ca 0.33 -0.29 0.00 0.00 -1.03 0.00 0.00 54.13 53.14 1bqm s LEU 325 Cb 0.04 -0.27 0.03 0.00 0.03 0.00 0.00 46.19 46.02 1bqm s LEU 325 CO 0.53 -0.28 0.02 -0.51 0.23 0.00 0.00 176.35 176.33 1bqm s ILE 326 N 2.09 0.04 0.15 -0.59 2.07 0.11 -0.48 121.20 124.58 1bqm s ILE 326 Ca 0.03 0.15 0.10 0.00 -1.41 0.00 0.00 60.65 59.52 1bqm s ILE 326 Cb -0.14 -0.15 -0.04 0.00 0.13 0.00 0.00 42.46 42.26 1bqm s ILE 326 CO -0.06 0.11 -0.22 0.00 -1.91 0.00 0.00 174.94 172.85 1bqm s ALA 327 N 1.00 2.17 0.07 1.50 0.00 -0.65 0.37 121.76 126.21 1bqm s ALA 327 Ca -0.09 -1.46 0.03 0.00 0.00 0.00 0.00 51.96 50.45 1bqm s ALA 327 Cb -0.13 -0.28 -0.03 0.00 0.00 0.00 0.00 23.12 22.68 1bqm s ALA 327 CO -0.02 0.39 -0.10 -1.21 0.00 0.00 0.00 175.76 174.82 1bqm s GLU 328 N -2.34 0.69 -0.10 0.00 2.02 -0.69 0.56 118.70 118.83 1bqm s GLU 328 Ca 0.14 -0.94 0.01 0.00 0.02 0.00 0.00 54.97 54.20 1bqm s GLU 328 Cb -0.08 -0.45 0.02 0.00 0.10 0.00 0.00 34.13 33.71 1bqm s GLU 328 CO 0.07 0.08 -0.13 0.42 0.02 0.00 0.00 175.26 175.71 1bqm s ILE 329 N -1.79 1.33 -0.08 -1.63 1.01 -1.16 -1.74 121.20 117.14 1bqm s ILE 329 Ca -0.03 -0.54 -0.03 0.00 0.00 0.00 0.00 60.65 60.06 1bqm s ILE 329 Cb -0.07 -1.24 -0.04 0.00 0.01 0.00 0.00 42.46 41.12 1bqm s ILE 329 CO 0.00 0.41 0.04 -1.10 0.00 0.00 0.00 174.94 174.29 1bqm s GLN 330 N 1.10 3.08 -0.37 2.79 -1.52 0.99 -4.49 119.66 121.24 1bqm s GLN 330 Ca -0.05 -0.36 -0.26 0.00 -1.95 0.00 0.00 55.36 52.74 1bqm s GLN 330 Cb -0.14 -2.88 0.01 0.00 -0.22 0.00 0.00 33.01 29.78 1bqm s GLN 330 CO -0.02 0.71 0.92 0.21 -0.25 0.00 0.00 175.29 176.86 1bqm s LYS 331 N -1.03 3.84 -0.26 2.91 2.20 -1.26 -1.44 119.74 124.71 1bqm s LYS 331 Ca 0.15 0.58 0.13 0.00 -0.36 0.00 0.00 55.97 56.46 1bqm s LYS 331 Cb -0.12 -3.80 0.75 0.00 -1.51 0.00 0.00 37.83 33.16 1bqm s LYS 331 CO 0.04 -0.94 1.73 0.94 -0.36 0.00 0.00 175.35 176.76 1bqm n GLN 332 N 6.75 4.18 -1.10 4.03 -0.06 -0.08 -4.98 117.38 126.10 1bqm n GLN 332 Ca 0.07 -3.11 0.15 0.00 -2.00 0.00 0.00 57.00 52.11 1bqm n GLN 332 Cb 0.48 -2.19 -0.05 0.00 -4.06 0.00 0.00 30.24 24.42 1bqm n GLN 332 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1bqm n GLY 333 N 0.16 -2.17 2.84 1.69 0.00 -1.16 -4.71 105.19 101.84 1bqm n GLY 333 Ca 0.32 -1.22 -0.18 0.00 0.00 0.00 0.00 46.02 44.94 1bqm n GLY 333 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bqm n GLN 334 N -3.70 -3.06 -3.35 1.61 0.00 -1.26 -0.74 117.38 106.88 1bqm n GLN 334 Ca -0.01 0.65 -0.18 0.00 0.00 0.00 0.00 57.00 57.46 1bqm n GLN 334 Cb 0.51 -5.34 0.07 0.00 0.00 0.00 0.00 30.24 25.47 1bqm n GLN 334 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1bqm n GLY 335 N -1.08 -0.25 2.90 2.61 0.00 -1.26 -4.98 105.19 103.13 1bqm n GLY 335 Ca -0.11 0.06 -0.24 0.00 0.00 0.00 0.00 46.02 45.74 1bqm n GLY 335 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1bqm s GLN 336 N -5.89 1.19 0.15 1.61 1.03 0.08 -3.45 119.66 114.37 1bqm s GLN 336 Ca 0.39 -0.18 0.10 0.00 0.04 0.00 0.00 55.36 55.71 1bqm s GLN 336 Cb -0.17 -1.21 -0.04 0.00 0.03 0.00 0.00 33.01 31.62 1bqm s GLN 336 CO 0.59 -0.15 -0.22 -1.58 -2.54 0.00 0.00 175.29 171.40 1bqm s TRP 337 N 1.28 2.42 -0.00 9.60 0.52 0.18 -0.91 118.94 132.02 1bqm s TRP 337 Ca -0.04 -0.32 0.02 0.00 0.02 0.00 0.00 56.10 55.78 1bqm s TRP 337 Cb -0.14 -1.26 -0.01 0.00 -1.15 0.00 0.00 33.47 30.92 1bqm s TRP 337 CO -0.02 0.41 -0.08 -0.08 0.02 0.00 0.00 176.95 177.20 1bqm s THR 338 N -1.30 0.62 0.09 2.01 -1.32 -0.52 -0.16 115.64 115.06 1bqm s THR 338 Ca 0.18 -0.38 0.04 0.00 -1.21 0.00 0.00 61.69 60.32 1bqm s THR 338 Cb -0.10 -0.53 -0.03 0.00 -1.51 0.00 0.00 72.50 70.33 1bqm s THR 338 CO 0.09 0.14 -0.12 -0.72 -2.21 0.00 0.00 174.62 171.80 1bqm s TYR 339 N -0.26 1.15 0.03 9.09 -0.85 0.10 -0.01 117.35 126.60 1bqm s TYR 339 Ca 0.02 -0.56 0.04 0.00 -0.52 0.00 0.00 57.07 56.05 1bqm s TYR 339 Cb -0.03 -0.63 -0.02 0.00 0.38 0.00 0.00 41.96 41.66 1bqm s TYR 339 CO -0.00 0.04 -0.11 -0.65 -1.52 0.00 0.00 175.55 173.31 1bqm s GLN 340 N -2.32 0.75 -0.13 -3.49 1.11 -0.71 -1.67 119.66 113.20 1bqm s GLN 340 Ca 0.02 -0.63 0.00 0.00 0.01 0.00 0.00 55.36 54.77 1bqm s GLN 340 Cb -0.06 -0.70 0.02 0.00 -1.01 0.00 0.00 33.01 31.26 1bqm s GLN 340 CO 0.01 0.17 -0.12 0.42 0.01 0.00 0.00 175.29 175.78 1bqm s ILE 341 N -0.80 1.39 0.16 1.08 1.01 0.19 -1.70 121.20 122.53 1bqm s ILE 341 Ca -0.01 -0.52 0.08 0.00 0.00 0.00 0.00 60.65 60.20 1bqm s ILE 341 Cb -0.07 -1.33 -0.04 0.00 0.01 0.00 0.00 42.46 41.03 1bqm s ILE 341 CO 0.01 0.43 -0.16 -0.72 0.00 0.00 0.00 174.94 174.49 1bqm s TYR 342 N 1.51 1.69 0.00 3.97 1.13 0.16 -2.86 117.35 122.95 1bqm s TYR 342 Ca 0.04 -0.51 0.00 0.00 -1.41 0.00 0.00 57.07 55.19 1bqm s TYR 342 Cb -0.13 -0.84 0.00 0.00 -1.10 0.00 0.00 41.96 39.89 1bqm s TYR 342 CO -0.09 0.28 0.00 1.04 -2.51 0.00 0.00 175.55 174.27 1bqm n GLN 343 N 0.23 0.00 -3.02 -3.49 6.02 -1.26 -0.72 117.38 115.15 1bqm n GLN 343 Ca -0.13 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.44 1bqm n GLN 343 Cb 0.58 -0.17 -0.06 0.00 1.02 0.00 0.00 30.24 31.61 1bqm n GLN 343 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1bqm s GLU 344 N -0.82 3.61 0.11 -1.09 2.02 -1.26 -4.78 118.70 116.48 1bqm s GLU 344 Ca 0.00 0.07 -0.05 0.00 0.02 0.00 0.00 54.97 55.02 1bqm s GLU 344 Cb 0.00 -3.85 -0.04 0.00 0.10 0.00 0.00 34.13 30.34 1bqm s GLU 344 CO 0.00 -0.89 -0.00 -0.35 0.02 0.00 0.00 175.26 174.04 1bqm n PRO 345 N 6.36 0.00 0.00 0.39 -0.04 -1.26 -3.57 135.00 136.88 1bqm n PRO 345 Ca 0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 1bqm n PRO 345 Cb 0.48 -0.24 0.00 0.00 -0.04 0.00 0.00 33.50 33.70 1bqm n PRO 345 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1bqm n PHE 346 N -0.29 0.00 -1.68 0.54 -0.00 -1.26 -4.87 117.46 109.90 1bqm n PHE 346 Ca 0.02 0.00 -0.45 0.00 -0.00 0.00 0.00 57.45 57.02 1bqm n PHE 346 Cb 0.10 0.00 -0.04 0.00 -0.00 0.00 0.00 39.48 39.54 1bqm n PHE 346 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 1bqm n LYS 347 N 0.00 2.32 -3.25 -4.13 4.76 -1.23 -4.92 118.16 111.70 1bqm n LYS 347 Ca 0.00 0.84 -0.37 0.00 -2.87 0.00 0.00 58.31 55.91 1bqm n LYS 347 Cb 0.00 -2.65 -0.06 0.00 -1.84 0.00 0.00 35.03 30.48 1bqm n LYS 347 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 1bqm s ASN 348 N 1.81 7.00 -0.22 4.39 0.01 -1.26 -4.68 114.94 121.99 1bqm s ASN 348 Ca 0.81 1.25 -0.16 0.00 -0.71 0.00 0.00 52.86 54.05 1bqm s ASN 348 Cb -0.63 -2.35 -0.09 0.00 0.41 0.00 0.00 41.25 38.58 1bqm s ASN 348 CO 0.40 0.17 -0.29 -0.11 -1.51 0.00 0.00 177.10 175.76 1bqm n LEU 349 N 1.22 1.93 -3.71 0.60 7.94 -1.14 -0.79 117.00 123.05 1bqm n LEU 349 Ca -0.07 0.37 -0.13 0.00 -1.11 0.00 0.00 56.01 55.07 1bqm n LEU 349 Cb 0.51 -0.80 -0.09 0.00 0.53 0.00 0.00 43.42 43.56 1bqm n LEU 349 CO 0.42 0.09 0.16 -0.54 -1.11 0.00 0.00 177.39 176.41 1bqm s LYS 350 N -2.64 0.57 0.12 1.96 -0.14 -1.24 -4.48 119.74 113.89 1bqm s LYS 350 Ca -0.32 0.60 0.04 0.00 -1.36 0.00 0.00 55.97 54.94 1bqm s LYS 350 Cb 0.08 0.28 -0.04 0.00 -1.68 0.00 0.00 37.83 36.47 1bqm s LYS 350 CO 0.45 -0.08 -0.10 0.95 -0.76 0.00 0.00 175.35 175.80 1bqm s THR 351 N 0.12 1.05 -0.06 2.17 -4.23 0.18 -0.64 115.64 114.22 1bqm s THR 351 Ca -0.01 -1.81 -0.32 0.00 -1.18 0.00 0.00 61.69 58.38 1bqm s THR 351 Cb -0.03 -1.56 0.13 0.00 1.34 0.00 0.00 72.50 72.38 1bqm s THR 351 CO 0.01 -0.62 1.33 -0.83 -0.54 0.00 0.00 174.62 173.97 1bqm s GLY 352 N -2.72 -0.42 0.03 3.99 0.00 -0.67 -3.56 107.32 103.97 1bqm s GLY 352 Ca 0.10 0.89 0.05 0.00 0.00 0.00 0.00 44.72 45.76 1bqm s GLY 352 CO 0.00 0.19 -0.14 -1.59 0.00 0.00 0.00 173.10 171.56 1bqm s LYS 353 N -2.30 0.99 -0.01 2.90 0.00 -1.26 -0.72 119.74 119.34 1bqm s LYS 353 Ca 0.14 -0.73 0.05 0.00 0.00 0.00 0.00 55.97 55.43 1bqm s LYS 353 Cb 0.05 -1.00 -0.03 0.00 0.00 0.00 0.00 37.83 36.85 1bqm s LYS 353 CO -0.05 0.25 -0.16 -0.47 0.00 0.00 0.00 175.35 174.93 1bqm s TYR 354 N -0.77 2.64 -0.28 1.78 5.04 0.78 -4.99 117.35 121.56 1bqm s TYR 354 Ca 0.03 -0.20 -0.02 0.00 -2.44 0.00 0.00 57.07 54.43 1bqm s TYR 354 Cb -0.08 -1.55 0.16 0.00 0.35 0.00 0.00 41.96 40.85 1bqm s TYR 354 CO 0.01 0.22 0.51 0.00 -1.34 0.00 0.00 175.55 174.94 1bqm s ALA 355 N -0.83 -1.76 0.19 3.97 0.00 -1.26 0.47 121.76 122.54 1bqm s ALA 355 Ca 0.13 1.46 -0.31 0.00 0.00 0.00 0.00 51.96 53.24 1bqm s ALA 355 Cb -0.11 -1.95 -0.10 0.00 0.00 0.00 0.00 23.12 20.96 1bqm s ALA 355 CO 0.03 -1.29 1.54 1.03 0.00 0.00 0.00 175.76 177.06 1bqm s ARG 356 N 2.73 4.22 0.06 0.00 1.81 -1.22 -5.01 118.95 121.53 1bqm s ARG 356 Ca 0.17 2.35 -0.04 0.00 -1.72 0.00 0.00 55.73 56.50 1bqm s ARG 356 Cb -0.15 -3.14 -0.02 0.00 -0.45 0.00 0.00 34.95 31.18 1bqm s ARG 356 CO -0.19 -0.56 0.04 -1.64 -0.68 0.00 0.00 175.30 172.27 1bqm s MET 357 N 0.75 0.65 -0.97 3.54 -1.94 -1.26 -4.97 119.30 115.10 1bqm s MET 357 Ca 0.67 -1.05 -0.08 0.00 -1.71 0.00 0.00 55.69 53.52 1bqm s MET 357 Cb -0.43 0.24 -0.03 0.00 2.01 0.00 0.00 34.83 36.62 1bqm s MET 357 CO 0.34 -0.15 0.80 0.54 -0.01 0.00 0.00 175.02 176.54 1bqm n ARG 358 N 0.24 -1.63 0.00 2.03 3.00 -1.26 -4.91 116.66 114.12 1bqm n ARG 358 Ca -0.15 0.91 0.00 0.00 -0.01 0.00 0.00 57.85 58.59 1bqm n ARG 358 Cb 0.61 -5.01 0.00 0.00 0.00 0.00 0.00 32.46 28.05 1bqm n ARG 358 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1bqm n GLY 359 N -1.55 -0.17 0.00 -0.13 0.00 -1.26 -5.19 105.19 96.90 1bqm n GLY 359 Ca -0.08 0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1bqm n GLY 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bqm n ALA 360 N 0.00 0.00 -0.92 4.61 0.00 -1.26 -4.56 120.51 118.38 1bqm n ALA 360 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 1bqm n ALA 360 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 1bqm n ALA 360 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1bqm n HIS 361 N -0.35 -0.01 -2.48 0.00 8.25 -1.26 -4.92 115.22 114.46 1bqm n HIS 361 Ca 0.00 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.09 1bqm n HIS 361 Cb 0.00 -1.90 -0.03 0.00 1.12 0.00 0.00 29.99 29.18 1bqm n HIS 361 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1bqm s THR 362 N -0.97 3.57 0.55 1.59 2.01 -1.26 -4.57 115.64 116.55 1bqm s THR 362 Ca 0.00 1.22 -0.17 0.00 0.31 0.00 0.00 61.69 63.05 1bqm s THR 362 Cb 0.00 -3.64 -0.06 0.00 0.01 0.00 0.00 72.50 68.81 1bqm s THR 362 CO 0.00 0.02 1.03 0.21 -0.69 0.00 0.00 174.62 175.20 1bqm s ASN 363 N -1.47 6.13 0.05 3.53 3.84 -1.26 -4.49 114.94 121.26 1bqm s ASN 363 Ca 0.58 1.77 -0.16 0.00 0.21 0.00 0.00 52.86 55.26 1bqm s ASN 363 Cb -0.24 -2.53 -0.23 0.00 -0.55 0.00 0.00 41.25 37.70 1bqm s ASN 363 CO 0.30 -0.93 1.16 0.44 -2.79 0.00 0.00 177.10 175.28 1bqm h ASP 364 N 0.81 0.76 -0.53 -4.21 5.19 -1.93 0.59 116.42 117.10 1bqm h ASP 364 Ca -0.47 -0.74 0.02 0.00 -0.62 0.00 0.00 57.03 55.22 1bqm h ASP 364 Cb 1.21 -0.23 -0.03 0.00 0.18 0.00 0.00 39.33 40.45 1bqm h ASP 364 CO 0.59 1.40 0.32 0.58 -3.12 0.00 0.00 179.24 179.01 1bqm h VAL 365 N 0.19 1.06 -0.59 -1.35 2.07 -1.94 0.20 116.25 115.89 1bqm h VAL 365 Ca -0.10 -0.22 -0.09 0.00 0.82 0.00 0.00 66.70 67.11 1bqm h VAL 365 Cb 1.52 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 1bqm h VAL 365 CO 0.17 0.12 0.00 0.11 0.02 0.00 0.00 177.57 177.99 1bqm h LYS 366 N 0.63 1.02 0.00 1.57 6.56 -1.93 -1.49 116.57 122.94 1bqm h LYS 366 Ca 0.21 -0.31 -0.04 0.00 -1.06 0.00 0.00 60.65 59.45 1bqm h LYS 366 Cb 0.02 -0.10 -0.01 0.00 -0.57 0.00 0.00 32.23 31.57 1bqm h LYS 366 CO -0.09 0.99 -0.17 0.37 -2.06 0.00 0.00 179.45 178.49 1bqm h GLN 367 N 0.93 0.00 0.43 3.15 4.15 1.00 -1.25 115.11 123.53 1bqm h GLN 367 Ca 0.17 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.57 1bqm h GLN 367 Cb 0.53 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.23 1bqm h GLN 367 CO 0.03 0.17 -0.21 1.25 -1.93 0.00 0.00 178.83 178.14 1bqm h LEU 368 N 0.00 -0.49 -2.63 -2.39 5.85 0.33 -2.91 115.31 113.07 1bqm h LEU 368 Ca -0.00 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.68 1bqm h LEU 368 Cb 0.62 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.77 1bqm h LEU 368 CO 0.02 -0.06 0.00 0.74 -0.34 0.00 0.00 178.44 178.80 1bqm h THR 369 N -1.11 0.00 0.02 1.05 2.02 -1.09 0.23 112.91 114.03 1bqm h THR 369 Ca -0.06 -0.05 -0.25 0.00 0.77 0.00 0.00 66.41 66.82 1bqm h THR 369 Cb 0.50 0.99 0.01 0.00 -1.74 0.00 0.00 68.15 67.91 1bqm h THR 369 CO 0.10 0.00 -1.03 -0.33 0.37 0.00 0.00 175.52 174.63 1bqm h GLU 370 N 0.00 0.52 -0.46 6.66 5.08 -1.21 -3.13 114.58 122.05 1bqm h GLU 370 Ca 0.00 -0.59 -0.08 0.00 -1.00 0.00 0.00 59.36 57.68 1bqm h GLU 370 Cb 0.06 0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 1bqm h GLU 370 CO 0.00 1.22 -0.03 0.00 -1.00 0.00 0.00 179.01 179.19 1bqm h ALA 371 N 0.57 0.62 -0.64 3.43 0.00 -0.37 -2.50 119.26 120.37 1bqm h ALA 371 Ca -0.11 -0.29 0.10 0.00 0.00 0.00 0.00 54.91 54.60 1bqm h ALA 371 Cb 1.68 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 19.23 1bqm h ALA 371 CO 0.19 0.45 0.25 0.28 0.00 0.00 0.00 179.25 180.42 1bqm h VAL 372 N 0.68 0.77 0.43 0.00 2.07 -1.45 -1.00 116.25 117.74 1bqm h VAL 372 Ca 0.13 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.47 1bqm h VAL 372 Cb 0.55 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 30.61 1bqm h VAL 372 CO 0.03 0.08 -0.21 -0.61 0.02 0.00 0.00 177.57 176.88 1bqm h GLN 373 N 0.44 -0.56 -1.34 1.57 5.75 -1.44 0.16 115.11 119.68 1bqm h GLN 373 Ca 0.32 0.04 0.41 0.00 -0.15 0.00 0.00 58.65 59.27 1bqm h GLN 373 Cb 0.40 0.13 -0.10 0.00 1.07 0.00 0.00 27.48 28.98 1bqm h GLN 373 CO -0.31 -0.36 0.90 -0.22 -2.65 0.00 0.00 178.83 176.20 1bqm h LYS 374 N -0.61 0.12 0.00 1.69 1.63 -0.76 0.81 116.57 119.44 1bqm h LYS 374 Ca -0.06 -0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 59.73 1bqm h LYS 374 Cb 0.46 -0.03 -0.00 0.00 -0.60 0.00 0.00 32.23 32.06 1bqm h LYS 374 CO 0.10 0.08 -0.02 0.82 -3.45 0.00 0.00 179.45 176.97 1bqm h ILE 375 N 0.12 1.56 -0.35 2.00 2.04 -0.77 -2.60 117.51 119.51 1bqm h ILE 375 Ca 0.75 -2.18 0.10 0.00 1.00 0.00 0.00 64.86 64.53 1bqm h ILE 375 Cb 2.49 2.95 -0.01 0.00 -0.74 0.00 0.00 36.82 41.51 1bqm h ILE 375 CO -0.25 0.53 0.33 0.74 0.00 0.00 0.00 178.15 179.50 1bqm h THR 376 N -1.00 0.51 0.01 -0.27 2.02 0.34 0.37 112.91 114.88 1bqm h THR 376 Ca -0.01 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.15 1bqm h THR 376 Cb 0.88 0.74 0.00 0.00 -1.74 0.00 0.00 68.15 68.04 1bqm h THR 376 CO -0.00 0.00 -0.09 0.74 0.37 0.00 0.00 175.52 176.54 1bqm h THR 377 N 0.00 1.74 0.00 3.16 2.02 -0.60 -3.27 112.91 115.97 1bqm h THR 377 Ca 0.17 -2.30 -0.01 0.00 0.77 0.00 0.00 66.41 65.04 1bqm h THR 377 Cb 0.83 3.30 -0.00 0.00 -1.74 0.00 0.00 68.15 70.54 1bqm h THR 377 CO -0.00 0.60 -0.06 -0.08 0.37 0.00 0.00 175.52 176.35 1bqm h GLU 378 N -0.90 0.00 0.52 6.66 4.81 -0.43 -2.04 114.58 123.21 1bqm h GLU 378 Ca -0.01 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 1bqm h GLU 378 Cb 1.04 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.42 1bqm h GLU 378 CO 0.02 0.06 -0.25 0.77 -0.73 0.00 0.00 179.01 178.88 1bqm h SER 379 N 0.00 -0.59 -0.61 1.04 0.02 -0.51 -2.83 113.55 110.07 1bqm h SER 379 Ca -0.00 0.02 0.11 0.00 -0.84 0.00 0.00 61.79 61.08 1bqm h SER 379 Cb 0.15 0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.81 1bqm h SER 379 CO 0.01 -0.21 0.41 0.40 -1.14 0.00 0.00 176.83 176.30 1bqm h ILE 380 N -1.14 0.86 0.00 3.27 2.04 -1.39 0.36 117.51 121.51 1bqm h ILE 380 Ca -0.07 -0.12 -0.07 0.00 1.00 0.00 0.00 64.86 65.60 1bqm h ILE 380 Cb 0.54 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 1bqm h ILE 380 CO 0.12 0.06 -0.36 0.58 0.00 0.00 0.00 178.15 178.55 1bqm h VAL 381 N 0.34 0.93 0.00 1.67 2.07 -1.41 -3.31 116.25 116.54 1bqm h VAL 381 Ca 0.29 -1.40 0.00 0.00 0.82 0.00 0.00 66.70 66.41 1bqm h VAL 381 Cb 0.65 1.83 0.00 0.00 -1.52 0.00 0.00 31.29 32.26 1bqm h VAL 381 CO -0.07 0.35 -0.15 -0.38 0.02 0.00 0.00 177.57 177.33 1bqm n ILE 382 N -3.64 0.32 0.09 4.57 5.41 0.10 -4.83 119.36 121.38 1bqm n ILE 382 Ca -0.01 0.31 -0.15 0.00 1.00 0.00 0.00 62.75 63.91 1bqm n ILE 382 Cb 0.47 -1.51 -0.09 0.00 -0.71 0.00 0.00 39.64 37.79 1bqm n ILE 382 CO 0.00 0.00 0.00 -0.50 0.00 0.00 0.00 176.55 176.05 1bqm h TRP 383 N -0.15 0.57 0.00 1.39 6.55 -1.16 -3.45 115.95 119.70 1bqm h TRP 383 Ca 0.00 -0.36 0.00 0.00 0.95 0.00 0.00 58.89 59.48 1bqm h TRP 383 Cb 0.15 -0.05 0.00 0.00 -0.86 0.00 0.00 29.16 28.41 1bqm h TRP 383 CO -0.07 1.22 0.00 0.41 -1.05 0.00 0.00 178.44 178.96 1bqm n GLY 384 N 1.23 0.97 1.57 1.49 0.00 -1.07 -5.02 105.19 104.36 1bqm n GLY 384 Ca -0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.84 1bqm n GLY 384 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1bqm n LYS 385 N -1.95 0.34 -5.13 1.61 5.02 -1.26 -4.88 118.16 111.91 1bqm n LYS 385 Ca 0.00 -1.63 -0.31 0.00 -2.02 0.00 0.00 58.31 54.36 1bqm n LYS 385 Cb 0.00 1.22 -0.17 0.00 -0.02 0.00 0.00 35.03 36.06 1bqm n LYS 385 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1bqm s THR 386 N -2.56 1.90 0.39 -0.18 -4.23 -1.26 -2.93 115.64 106.77 1bqm s THR 386 Ca 0.17 -0.94 -0.27 0.00 -1.18 0.00 0.00 61.69 59.46 1bqm s THR 386 Cb 0.01 -1.64 -0.10 0.00 1.34 0.00 0.00 72.50 72.11 1bqm s THR 386 CO 0.12 0.53 1.42 -2.84 -0.54 0.00 0.00 174.62 173.30 1bqm s PRO 387 N 0.24 4.02 -0.23 3.99 0.02 -1.26 -4.92 135.00 136.86 1bqm s PRO 387 Ca -0.14 2.42 -0.27 0.00 0.02 0.00 0.00 61.00 63.04 1bqm s PRO 387 Cb -0.16 -2.88 0.00 0.00 0.02 0.00 0.00 34.50 31.48 1bqm s PRO 387 CO 0.07 -0.54 0.93 0.21 -0.33 0.00 0.00 177.00 177.33 1bqm s LYS 388 N -2.16 4.23 0.32 5.54 2.20 0.37 -4.75 119.74 125.50 1bqm s LYS 388 Ca 0.55 1.14 -0.27 0.00 -0.36 0.00 0.00 55.97 57.03 1bqm s LYS 388 Cb -0.44 -3.63 -0.09 0.00 -1.51 0.00 0.00 37.83 32.16 1bqm s LYS 388 CO 0.58 -0.54 1.00 -0.06 -0.36 0.00 0.00 175.35 175.97 1bqm s PHE 389 N 2.91 3.60 -0.28 4.03 0.40 0.26 -1.64 117.98 127.25 1bqm s PHE 389 Ca 0.39 1.75 0.03 0.00 -0.60 0.00 0.00 56.93 58.51 1bqm s PHE 389 Cb -0.15 -3.06 0.07 0.00 0.51 0.00 0.00 43.02 40.39 1bqm s PHE 389 CO 0.07 -0.13 -0.06 0.15 0.70 0.00 0.00 175.22 175.95 1bqm s LYS 390 N -1.93 2.00 -0.05 0.44 -0.14 0.19 0.30 119.74 120.55 1bqm s LYS 390 Ca 0.50 -1.51 0.04 0.00 -1.36 0.00 0.00 55.97 53.64 1bqm s LYS 390 Cb -0.23 -2.98 -0.00 0.00 -1.68 0.00 0.00 37.83 32.93 1bqm s LYS 390 CO 0.29 -0.68 -0.17 -0.51 -0.76 0.00 0.00 175.35 173.52 1bqm s LEU 391 N 1.04 1.89 -0.33 3.17 1.43 0.12 -3.01 118.68 122.99 1bqm s LEU 391 Ca -0.03 -0.36 -0.05 0.00 -1.03 0.00 0.00 54.13 52.66 1bqm s LEU 391 Cb -0.20 -0.98 -0.16 0.00 0.03 0.00 0.00 46.19 44.88 1bqm s LEU 391 CO -0.06 0.14 2.70 -0.81 0.23 0.00 0.00 176.35 178.55 1bqm n PRO 392 N 3.27 1.81 -3.70 1.29 -0.04 -1.26 -2.28 135.00 134.09 1bqm n PRO 392 Ca -0.19 -1.01 -0.13 0.00 -0.04 0.00 0.00 63.50 62.13 1bqm n PRO 392 Cb 0.53 -2.06 -0.13 0.00 -0.04 0.00 0.00 33.50 31.79 1bqm n PRO 392 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1bqm s ILE 393 N 1.91 -0.18 0.17 0.52 2.07 -1.26 -1.81 121.20 122.62 1bqm s ILE 393 Ca 0.50 0.20 -0.31 0.00 -1.41 0.00 0.00 60.65 59.62 1bqm s ILE 393 Cb 0.21 -0.41 -0.10 0.00 0.13 0.00 0.00 42.46 42.29 1bqm s ILE 393 CO -0.01 0.08 1.52 -1.10 -1.91 0.00 0.00 174.94 173.52 1bqm s GLN 394 N 1.71 4.24 0.26 3.50 -0.21 -1.26 -4.82 119.66 123.09 1bqm s GLN 394 Ca -0.05 2.31 -0.01 0.00 0.02 0.00 0.00 55.36 57.62 1bqm s GLN 394 Cb -0.11 -3.16 0.51 0.00 1.00 0.00 0.00 33.01 31.25 1bqm s GLN 394 CO -0.09 -0.55 1.78 -0.22 -2.12 0.00 0.00 175.29 174.09 1bqm h LYS 395 N 6.55 0.69 0.00 2.91 3.64 -1.97 -0.68 116.57 127.71 1bqm h LYS 395 Ca -0.43 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1bqm h LYS 395 Cb 1.21 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 1bqm h LYS 395 CO 0.89 0.46 0.00 0.39 -2.27 0.00 0.00 179.45 178.91 1bqm n GLU 396 N -4.81 0.30 -0.00 1.90 1.02 -1.26 -1.30 120.64 116.50 1bqm n GLU 396 Ca 0.17 0.09 0.04 0.00 -0.02 0.00 0.00 57.16 57.44 1bqm n GLU 396 Cb 0.39 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 30.27 1bqm n GLU 396 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1bqm n THR 397 N -1.17 0.00 -0.10 2.62 -2.24 -0.32 -4.43 114.28 108.63 1bqm n THR 397 Ca 0.08 -0.30 -0.22 0.00 -2.27 0.00 0.00 64.05 61.35 1bqm n THR 397 Cb 0.09 0.94 -0.11 0.00 -2.10 0.00 0.00 70.33 69.15 1bqm n THR 397 CO 0.00 0.00 0.00 1.87 -0.57 0.00 0.00 175.07 176.37 1bqm n TRP 398 N -1.24 0.99 0.86 4.78 -0.00 -0.43 -3.86 117.44 118.54 1bqm n TRP 398 Ca 0.01 0.43 0.06 0.00 -0.00 0.00 0.00 57.50 58.00 1bqm n TRP 398 Cb 0.13 -1.09 0.34 0.00 -0.00 0.00 0.00 31.31 30.69 1bqm n TRP 398 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 177.69 178.08 1bqm n GLU 399 N -4.43 0.43 -0.40 5.87 1.02 -0.42 0.06 120.64 122.77 1bqm n GLU 399 Ca -0.32 0.00 0.08 0.00 -0.02 0.00 0.00 57.16 56.90 1bqm n GLU 399 Cb 0.68 -1.41 0.25 0.00 -0.02 0.00 0.00 31.44 30.94 1bqm n GLU 399 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1bqm n THR 400 N -0.91 1.65 -2.71 2.62 -2.24 -1.25 -3.09 114.28 108.34 1bqm n THR 400 Ca 0.09 -1.33 -0.05 0.00 -2.27 0.00 0.00 64.05 60.49 1bqm n THR 400 Cb 0.04 0.16 0.08 0.00 -2.10 0.00 0.00 70.33 68.51 1bqm n THR 400 CO 0.00 0.00 0.00 1.87 -0.57 0.00 0.00 175.07 176.37 1bqm n TRP 401 N 0.42 -0.55 0.02 4.78 -0.00 0.11 -4.23 117.44 118.00 1bqm n TRP 401 Ca 0.19 -2.17 0.00 0.00 -0.00 0.00 0.00 57.50 55.52 1bqm n TRP 401 Cb 0.72 0.63 0.00 0.00 -0.00 0.00 0.00 31.31 32.66 1bqm n TRP 401 CO 0.00 0.00 0.00 1.87 -0.00 0.00 0.00 177.69 179.56 1bqm n TRP 402 N -0.65 -1.49 1.32 5.87 -0.00 -1.14 -4.67 117.44 116.68 1bqm n TRP 402 Ca -0.01 0.09 0.14 0.00 -0.00 0.00 0.00 57.50 57.72 1bqm n TRP 402 Cb 0.84 0.67 0.49 0.00 -0.00 0.00 0.00 31.31 33.31 1bqm n TRP 402 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 177.69 180.10 1bqm n THR 403 N -2.58 0.00 -0.00 5.87 -1.04 -1.18 -4.03 114.28 111.32 1bqm n THR 403 Ca 0.00 -0.09 0.00 0.00 -2.04 0.00 0.00 64.05 61.92 1bqm n THR 403 Cb 0.00 0.15 -0.01 0.00 -1.82 0.00 0.00 70.33 68.65 1bqm n THR 403 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1bqm n GLU 404 N -0.81 0.68 -2.79 -2.82 2.13 -1.26 -5.03 120.64 110.74 1bqm n GLU 404 Ca 0.13 -0.01 -0.34 0.00 0.66 0.00 0.00 57.16 57.61 1bqm n GLU 404 Cb 0.31 -1.02 -0.07 0.00 0.27 0.00 0.00 31.44 30.94 1bqm n GLU 404 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 1bqm s TYR 405 N -2.05 3.36 -0.04 4.31 5.04 -1.26 -5.00 117.35 121.72 1bqm s TYR 405 Ca -0.00 1.64 -0.09 0.00 -2.44 0.00 0.00 57.07 56.18 1bqm s TYR 405 Cb 0.00 -2.88 -0.05 0.00 0.35 0.00 0.00 41.96 39.38 1bqm s TYR 405 CO 0.03 -0.11 0.45 0.11 -1.34 0.00 0.00 175.55 174.69 1bqm h TRP 406 N 2.13 -0.30 -4.16 4.97 5.08 -1.96 -3.45 115.95 118.26 1bqm h TRP 406 Ca -0.49 -0.01 -0.54 0.00 1.08 0.00 0.00 58.89 58.93 1bqm h TRP 406 Cb 1.19 0.10 0.16 0.00 -3.00 0.00 0.00 29.16 27.61 1bqm h TRP 406 CO 0.61 -0.19 0.43 -1.14 -1.28 0.00 0.00 178.44 176.87 1bqm s GLN 407 N -2.63 2.20 -0.07 0.12 0.74 -1.26 -4.97 119.66 113.78 1bqm s GLN 407 Ca -0.05 1.87 -0.17 0.00 0.05 0.00 0.00 55.36 57.07 1bqm s GLN 407 Cb 0.00 -1.83 -0.05 0.00 1.10 0.00 0.00 33.01 32.24 1bqm s GLN 407 CO 0.14 -1.82 0.45 0.00 -0.55 0.00 0.00 175.29 173.51 1bqm s ALA 408 N -1.79 3.56 0.33 1.58 0.00 -1.26 -5.00 121.76 119.18 1bqm s ALA 408 Ca 0.77 -0.20 0.07 0.00 0.00 0.00 0.00 51.96 52.60 1bqm s ALA 408 Cb -0.32 -2.54 -0.07 0.00 0.00 0.00 0.00 23.12 20.19 1bqm s ALA 408 CO 0.44 0.19 -0.05 0.95 0.00 0.00 0.00 175.76 177.30 1bqm s THR 409 N -0.07 1.89 -0.30 0.00 -4.23 -1.26 -5.15 115.64 106.52 1bqm s THR 409 Ca 0.25 -2.12 -0.03 0.00 -1.18 0.00 0.00 61.69 58.61 1bqm s THR 409 Cb -0.16 -2.67 0.18 0.00 1.34 0.00 0.00 72.50 71.20 1bqm s THR 409 CO 0.11 -0.17 0.66 0.86 -0.54 0.00 0.00 174.62 175.54 1bqm s TRP 410 N -2.83 -1.46 -0.16 3.99 -0.11 -1.26 -5.09 118.94 112.02 1bqm s TRP 410 Ca 0.32 1.64 0.01 0.00 1.22 0.00 0.00 56.10 59.30 1bqm s TRP 410 Cb 0.05 0.55 0.01 0.00 -1.50 0.00 0.00 33.47 32.58 1bqm s TRP 410 CO 0.15 -0.79 -0.18 0.96 -4.62 0.00 0.00 176.95 172.47 1bqm s ILE 411 N 2.87 2.34 0.00 5.86 -5.25 -1.26 -5.00 121.20 120.75 1bqm s ILE 411 Ca 0.16 -0.88 0.00 0.00 -0.99 0.00 0.00 60.65 58.94 1bqm s ILE 411 Cb -0.14 -1.97 0.00 0.00 2.95 0.00 0.00 42.46 43.30 1bqm s ILE 411 CO -0.20 0.53 0.00 -0.81 -1.79 0.00 0.00 174.94 172.67 1bqm n PRO 412 N 4.18 3.00 -2.04 0.37 -0.04 -1.26 -4.80 135.00 134.41 1bqm n PRO 412 Ca -0.20 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 62.84 1bqm n PRO 412 Cb 0.51 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.95 1bqm n PRO 412 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1bqm s GLU 413 N 0.00 4.08 -0.01 0.54 2.02 -1.26 -4.94 118.70 119.13 1bqm s GLU 413 Ca 0.00 2.05 -0.02 0.00 0.02 0.00 0.00 54.97 57.02 1bqm s GLU 413 Cb 0.00 -4.00 0.00 0.00 0.10 0.00 0.00 34.13 30.24 1bqm s GLU 413 CO 0.00 -0.96 0.04 1.67 0.02 0.00 0.00 175.26 176.03 1bqm s TRP 414 N 4.36 0.01 0.04 1.61 1.48 -1.26 0.93 118.94 126.11 1bqm s TRP 414 Ca 0.73 -0.00 0.05 0.00 -1.06 0.00 0.00 56.10 55.81 1bqm s TRP 414 Cb -0.31 -0.02 -0.02 0.00 -1.16 0.00 0.00 33.47 31.95 1bqm s TRP 414 CO 0.29 -0.08 -0.14 -2.00 -4.06 0.00 0.00 176.95 170.96 1bqm s GLU 415 N -0.36 0.88 0.14 3.25 2.12 0.15 -4.93 118.70 119.95 1bqm s GLU 415 Ca -0.04 -0.77 -0.31 0.00 0.36 0.00 0.00 54.97 54.20 1bqm s GLU 415 Cb -0.03 -0.88 -0.10 0.00 0.26 0.00 0.00 34.13 33.39 1bqm s GLU 415 CO 0.00 0.21 1.61 0.12 -0.54 0.00 0.00 175.26 176.66 1bqm s PHE 416 N -0.93 2.87 0.23 5.30 5.36 -1.26 0.15 117.98 129.70 1bqm s PHE 416 Ca 0.00 0.52 0.03 0.00 -0.96 0.00 0.00 56.93 56.52 1bqm s PHE 416 Cb -0.08 -3.96 0.03 0.00 -0.34 0.00 0.00 43.02 38.67 1bqm s PHE 416 CO 0.01 -3.62 0.22 0.28 -1.46 0.00 0.00 175.22 170.65 1bqm n VAL 417 N 4.18 0.00 -3.65 3.12 0.31 -0.97 -4.87 118.33 116.45 1bqm n VAL 417 Ca 0.15 -0.87 -0.17 0.00 -0.01 0.00 0.00 64.34 63.43 1bqm n VAL 417 Cb 0.39 -0.46 -0.16 0.00 -0.91 0.00 0.00 33.84 32.70 1bqm n VAL 417 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 1bqm s ASN 418 N -2.38 0.85 -0.22 4.52 3.84 -1.26 -4.83 114.94 115.45 1bqm s ASN 418 Ca 0.17 0.26 -0.17 0.00 0.21 0.00 0.00 52.86 53.33 1bqm s ASN 418 Cb -0.01 0.26 0.06 0.00 -0.55 0.00 0.00 41.25 41.01 1bqm s ASN 418 CO 0.11 -0.25 0.57 -0.89 -2.79 0.00 0.00 177.10 173.85 1bqm s THR 419 N 2.29 -0.01 0.33 -5.21 2.01 -1.26 -5.07 115.64 108.72 1bqm s THR 419 Ca 0.03 0.02 0.08 0.00 0.31 0.00 0.00 61.69 62.14 1bqm s THR 419 Cb -0.12 -0.82 0.39 0.00 0.01 0.00 0.00 72.50 71.96 1bqm s THR 419 CO -0.06 0.01 1.55 -0.81 -0.69 0.00 0.00 174.62 174.61 1bqm n PRO 420 N 3.47 -0.07 -2.73 4.92 -0.04 -1.26 -3.23 135.00 136.06 1bqm n PRO 420 Ca -0.17 1.43 -0.43 0.00 -0.04 0.00 0.00 63.50 64.29 1bqm n PRO 420 Cb 0.57 -2.38 -0.00 0.00 -0.04 0.00 0.00 33.50 31.65 1bqm n PRO 420 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1bqm s PRO 421 N -5.81 4.01 0.41 0.54 0.04 -1.26 -4.98 135.00 127.94 1bqm s PRO 421 Ca -0.11 -2.20 -0.24 0.00 0.04 0.00 0.00 61.00 58.49 1bqm s PRO 421 Cb 0.30 -5.33 -0.09 0.00 0.04 0.00 0.00 34.50 29.43 1bqm s PRO 421 CO 0.77 -2.05 1.05 -1.17 0.04 0.00 0.00 177.00 175.64 1bqm s LEU 422 N 3.16 4.12 -0.32 -3.56 2.96 -1.20 -4.84 118.68 119.00 1bqm s LEU 422 Ca 0.49 2.03 -0.13 0.00 -0.22 0.00 0.00 54.13 56.30 1bqm s LEU 422 Cb 0.01 -4.21 -0.03 0.00 0.50 0.00 0.00 46.19 42.46 1bqm s LEU 422 CO 0.04 -0.52 0.28 -0.69 -1.32 0.00 0.00 176.35 174.14 1bqm s VAL 423 N -1.68 5.25 0.19 1.68 1.01 -0.75 -5.04 120.40 121.06 1bqm s VAL 423 Ca 0.59 0.05 -0.23 0.00 0.00 0.00 0.00 61.98 62.38 1bqm s VAL 423 Cb -0.22 -3.70 0.06 0.00 0.00 0.00 0.00 36.38 32.53 1bqm s VAL 423 CO 0.27 0.05 0.94 -0.54 0.00 0.00 0.00 175.10 175.82 1bqm s LYS 424 N 1.86 1.37 -0.07 2.72 1.02 -1.26 -3.99 119.74 121.38 1bqm s LYS 424 Ca 0.09 -0.80 -0.30 0.00 0.02 0.00 0.00 55.97 54.99 1bqm s LYS 424 Cb -0.17 0.44 -0.03 0.00 -0.52 0.00 0.00 37.83 37.55 1bqm s LYS 424 CO 0.11 -0.63 1.28 -0.51 -0.92 0.00 0.00 175.35 174.68 1bqm s LEU 425 N -3.04 4.26 0.13 3.17 1.43 -1.26 -4.90 118.68 118.47 1bqm s LEU 425 Ca 0.14 1.87 0.11 0.00 -1.03 0.00 0.00 54.13 55.22 1bqm s LEU 425 Cb -0.02 -3.55 -0.14 0.00 0.03 0.00 0.00 46.19 42.51 1bqm s LEU 425 CO 0.04 -0.67 1.19 -0.50 0.23 0.00 0.00 176.35 176.64 1bqm h TRP 426 N 7.82 0.00 -3.15 0.29 4.06 -1.94 -3.49 115.95 119.54 1bqm h TRP 426 Ca -0.33 0.00 -0.13 0.00 2.06 0.00 0.00 58.89 60.48 1bqm h TRP 426 Cb 1.15 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 29.28 1bqm h TRP 426 CO 0.76 0.83 -0.00 2.48 -3.56 0.00 0.00 178.44 178.95 1bqm n TYR 427 N -3.23 -1.43 -3.65 0.49 4.11 -1.26 -4.83 117.16 107.37 1bqm n TYR 427 Ca -0.03 -1.51 -0.01 0.00 -0.00 0.00 0.00 57.90 56.34 1bqm n TYR 427 Cb 0.89 0.47 -0.06 0.00 -0.00 0.00 0.00 39.34 40.64 1bqm n TYR 427 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.86 175.72 1bqm s GLN 428 N -2.38 0.24 0.81 -3.48 0.74 -1.26 -5.07 119.66 109.25 1bqm s GLN 428 Ca 0.17 0.39 -0.12 0.00 0.05 0.00 0.00 55.36 55.85 1bqm s GLN 428 Cb -0.02 0.06 0.08 0.00 1.10 0.00 0.00 33.01 34.24 1bqm s GLN 428 CO 0.12 -0.05 1.17 -0.51 -0.55 0.00 0.00 175.29 175.47 1bqm s LEU 429 N 1.00 2.49 0.70 3.68 1.43 -1.26 -4.70 118.68 122.00 1bqm s LEU 429 Ca -0.06 0.84 -0.08 0.00 -1.03 0.00 0.00 54.13 53.81 1bqm s LEU 429 Cb -0.03 -3.34 0.05 0.00 0.03 0.00 0.00 46.19 42.89 1bqm s LEU 429 CO -0.12 -1.93 1.02 -1.61 0.23 0.00 0.00 176.35 173.94 1bqm s GLU 430 N -5.52 2.36 -0.08 1.70 0.41 0.11 -4.98 118.70 112.71 1bqm s GLU 430 Ca 0.62 -0.10 0.00 0.00 -0.41 0.00 0.00 54.97 55.08 1bqm s GLU 430 Cb -0.11 -2.15 -0.05 0.00 -1.78 0.00 0.00 34.13 30.04 1bqm s GLU 430 CO 0.50 -1.16 -0.07 0.36 -0.49 0.00 0.00 175.26 174.40 1bqm n LYS 431 N -2.91 0.19 -4.15 1.61 2.85 -1.26 -4.78 118.16 109.70 1bqm n LYS 431 Ca 0.07 0.04 -0.36 0.00 -1.05 0.00 0.00 58.31 57.02 1bqm n LYS 431 Cb 0.60 -1.13 -0.08 0.00 -0.65 0.00 0.00 35.03 33.77 1bqm n LYS 431 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 1bqm s GLU 432 N -2.15 3.18 0.44 -1.58 2.02 -1.26 -5.08 118.70 114.27 1bqm s GLU 432 Ca -0.10 -0.30 -0.26 0.00 0.02 0.00 0.00 54.97 54.33 1bqm s GLU 432 Cb 0.03 -2.96 -0.09 0.00 0.10 0.00 0.00 34.13 31.21 1bqm s GLU 432 CO 0.17 0.73 1.37 -0.35 0.02 0.00 0.00 175.26 177.21 1bqm n PRO 433 N 1.99 2.15 -2.58 0.39 -0.04 -1.26 -4.96 135.00 130.69 1bqm n PRO 433 Ca -0.19 0.77 -0.35 0.00 -0.04 0.00 0.00 63.50 63.68 1bqm n PRO 433 Cb 0.54 -2.54 -0.04 0.00 -0.04 0.00 0.00 33.50 31.42 1bqm n PRO 433 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1bqm s ILE 434 N -1.19 3.82 0.12 0.52 1.01 -1.26 -5.05 121.20 119.17 1bqm s ILE 434 Ca 0.61 1.29 -0.18 0.00 0.00 0.00 0.00 60.65 62.37 1bqm s ILE 434 Cb -0.47 -3.62 -0.07 0.00 0.01 0.00 0.00 42.46 38.31 1bqm s ILE 434 CO 0.58 -0.09 0.59 0.68 0.00 0.00 0.00 174.94 176.70 1bqm s VAL 435 N -1.80 4.74 0.00 2.92 -7.23 -1.26 -4.49 120.40 113.28 1bqm s VAL 435 Ca 0.61 1.13 0.00 0.00 -1.81 0.00 0.00 61.98 61.91 1bqm s VAL 435 Cb -0.19 -3.85 0.00 0.00 0.56 0.00 0.00 36.38 32.90 1bqm s VAL 435 CO 0.24 0.41 0.00 0.61 -0.31 0.00 0.00 175.10 176.05 1bqm n GLY 436 N 1.30 0.56 3.56 2.32 0.00 -1.26 -4.94 105.19 106.73 1bqm n GLY 436 Ca -0.08 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.51 1bqm n GLY 436 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bqm n ALA 437 N 0.00 -0.56 -1.81 4.61 0.00 -1.26 -4.86 120.51 116.62 1bqm n ALA 437 Ca 0.00 0.33 -0.42 0.00 0.00 0.00 0.00 53.44 53.35 1bqm n ALA 437 Cb 0.00 -1.96 -0.03 0.00 0.00 0.00 0.00 19.45 17.46 1bqm n ALA 437 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1bqm s GLU 438 N -1.61 4.16 -0.48 0.00 2.12 -1.26 -4.76 118.70 116.88 1bqm s GLU 438 Ca 0.61 2.50 -0.22 0.00 0.36 0.00 0.00 54.97 58.22 1bqm s GLU 438 Cb -0.67 -3.10 0.03 0.00 0.26 0.00 0.00 34.13 30.64 1bqm s GLU 438 CO 0.59 -0.68 0.75 0.99 -0.54 0.00 0.00 175.26 176.37 1bqm s THR 439 N 1.09 4.68 -0.48 -1.70 2.01 -1.26 -3.01 115.64 116.96 1bqm s THR 439 Ca 0.72 0.17 -0.18 0.00 0.31 0.00 0.00 61.69 62.71 1bqm s THR 439 Cb -0.47 -4.33 0.06 0.00 0.01 0.00 0.00 72.50 67.77 1bqm s THR 439 CO 0.33 -0.78 0.53 -0.36 -0.69 0.00 0.00 174.62 173.65 1bqm s PHE 440 N 3.19 3.13 -0.29 4.92 0.40 -0.35 -1.67 117.98 127.30 1bqm s PHE 440 Ca 0.26 -0.64 -0.29 0.00 -0.60 0.00 0.00 56.93 55.66 1bqm s PHE 440 Cb -0.14 -3.34 0.01 0.00 0.51 0.00 0.00 43.02 40.06 1bqm s PHE 440 CO 0.19 -0.92 1.11 0.71 0.70 0.00 0.00 175.22 177.01 1bqm s TYR 441 N 2.26 3.11 0.09 0.36 1.51 -0.14 -2.07 117.35 122.47 1bqm s TYR 441 Ca 0.11 1.19 -0.02 0.00 -1.01 0.00 0.00 57.07 57.35 1bqm s TYR 441 Cb -0.20 -3.64 -0.05 0.00 -0.11 0.00 0.00 41.96 37.96 1bqm s TYR 441 CO 0.10 -0.88 0.28 0.08 -1.11 0.00 0.00 175.55 174.02 1bqm s VAL 442 N 3.65 5.30 0.05 0.71 1.01 -0.94 -2.10 120.40 128.08 1bqm s VAL 442 Ca 0.47 -0.22 -0.08 0.00 0.00 0.00 0.00 61.98 62.15 1bqm s VAL 442 Cb -0.14 -3.63 -0.00 0.00 0.00 0.00 0.00 36.38 32.61 1bqm s VAL 442 CO 0.15 0.10 0.17 -0.62 0.00 0.00 0.00 175.10 174.89 1bqm s ASP 443 N -2.49 0.10 -0.23 3.32 -1.08 -1.21 -4.20 116.67 110.89 1bqm s ASP 443 Ca 0.37 -0.49 -0.25 0.00 -0.52 0.00 0.00 52.55 51.66 1bqm s ASP 443 Cb -0.13 0.29 0.07 0.00 -1.46 0.00 0.00 42.92 41.69 1bqm s ASP 443 CO 0.27 -0.59 0.70 -0.83 0.52 0.00 0.00 175.17 175.23 1bqm s GLY 444 N -2.31 -0.53 0.12 2.66 0.00 -1.26 -3.81 107.32 102.18 1bqm s GLY 444 Ca -0.02 1.86 -0.11 0.00 0.00 0.00 0.00 44.72 46.44 1bqm s GLY 444 CO -0.06 1.57 0.29 0.00 0.00 0.00 0.00 173.10 174.91 1bqm s ALA 445 N 0.09 -0.43 0.32 3.20 0.00 -1.12 -4.80 121.76 119.03 1bqm s ALA 445 Ca -0.02 -0.48 -0.10 0.00 0.00 0.00 0.00 51.96 51.36 1bqm s ALA 445 Cb -0.04 0.65 0.04 0.00 0.00 0.00 0.00 23.12 23.77 1bqm s ALA 445 CO 0.03 -0.60 0.60 0.00 0.00 0.00 0.00 175.76 175.79 1bqm n ALA 446 N -0.16 -1.21 -2.80 0.00 0.00 -1.26 -1.98 120.51 113.09 1bqm n ALA 446 Ca -0.13 -1.12 -0.35 0.00 0.00 0.00 0.00 53.44 51.83 1bqm n ALA 446 Cb 0.63 0.90 -0.08 0.00 0.00 0.00 0.00 19.45 20.89 1bqm n ALA 446 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1bqm s ASN 447 N -2.74 5.89 0.40 0.00 0.02 -1.26 -4.95 114.94 112.29 1bqm s ASN 447 Ca 0.16 0.25 0.21 0.00 -1.02 0.00 0.00 52.86 52.45 1bqm s ASN 447 Cb -0.03 -1.92 0.79 0.00 0.02 0.00 0.00 41.25 40.11 1bqm s ASN 447 CO 0.12 0.30 1.78 0.03 0.02 0.00 0.00 177.10 179.34 1bqm h ARG 448 N 5.79 0.00 0.00 -0.60 3.08 -2.00 -3.21 114.38 117.45 1bqm h ARG 448 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.59 1bqm h ARG 448 Cb 1.19 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.24 1bqm h ARG 448 CO 0.64 0.32 0.00 0.39 -1.07 0.00 0.00 179.97 180.24 1bqm n GLU 449 N -3.51 0.00 0.00 0.04 1.02 -1.26 -4.80 120.64 112.13 1bqm n GLU 449 Ca -0.00 -0.08 0.05 0.00 -0.02 0.00 0.00 57.16 57.10 1bqm n GLU 449 Cb 0.47 -0.50 -0.02 0.00 -0.02 0.00 0.00 31.44 31.38 1bqm n GLU 449 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1bqm n THR 450 N 0.00 0.00 -3.84 2.62 -2.24 -1.26 -5.04 114.28 104.52 1bqm n THR 450 Ca 0.00 -0.36 -0.30 0.00 -2.27 0.00 0.00 64.05 61.12 1bqm n THR 450 Cb 0.29 1.09 0.01 0.00 -2.10 0.00 0.00 70.33 69.62 1bqm n THR 450 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1bqm n LYS 451 N -0.52 -0.62 -3.36 -0.78 2.85 -1.21 -4.90 118.16 109.63 1bqm n LYS 451 Ca 0.04 0.05 -0.15 0.00 -1.05 0.00 0.00 58.31 57.19 1bqm n LYS 451 Cb 0.20 -1.47 -0.08 0.00 -0.65 0.00 0.00 35.03 33.03 1bqm n LYS 451 CO 0.00 0.00 0.00 -0.48 -0.05 0.00 0.00 177.40 176.87 1bqm s LEU 452 N -6.07 -0.30 0.00 -5.58 0.05 -1.26 -3.26 118.68 102.26 1bqm s LEU 452 Ca 0.26 -1.03 -0.16 0.00 0.05 0.00 0.00 54.13 53.25 1bqm s LEU 452 Cb -0.14 0.67 0.23 0.00 -2.05 0.00 0.00 46.19 44.89 1bqm s LEU 452 CO 0.68 -0.32 1.09 0.61 -0.55 0.00 0.00 176.35 177.86 1bqm n GLY 453 N 4.86 -1.96 3.29 -3.48 0.00 0.99 -4.35 105.19 104.54 1bqm n GLY 453 Ca 0.04 -1.62 -0.09 0.00 0.00 0.00 0.00 46.02 44.35 1bqm n GLY 453 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bqm s LYS 454 N -5.42 0.37 0.00 1.61 1.02 -0.84 -0.28 119.74 116.20 1bqm s LYS 454 Ca 0.65 0.97 0.00 0.00 0.02 0.00 0.00 55.97 57.61 1bqm s LYS 454 Cb -0.03 0.22 0.00 0.00 -0.52 0.00 0.00 37.83 37.49 1bqm s LYS 454 CO 0.47 -0.21 0.00 0.00 -0.92 0.00 0.00 175.35 174.69 1bqm n ALA 455 N 4.97 0.00 0.00 5.17 0.00 -0.76 -2.77 120.51 127.12 1bqm n ALA 455 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1bqm n ALA 455 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1bqm n ALA 455 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bqm n GLY 456 N 5.00 0.90 1.97 0.00 0.00 -1.25 -3.50 105.19 108.32 1bqm n GLY 456 Ca 0.00 -2.17 -0.03 0.00 0.00 0.00 0.00 46.02 43.81 1bqm n GLY 456 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1bqm n TYR 457 N -0.97 -1.39 -3.69 1.61 4.11 -0.81 -3.30 117.16 112.72 1bqm n TYR 457 Ca 0.00 -0.83 -0.14 0.00 -0.00 0.00 0.00 57.90 56.93 1bqm n TYR 457 Cb 0.00 0.41 -0.08 0.00 -0.00 0.00 0.00 39.34 39.67 1bqm n TYR 457 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.86 176.94 1bqm s VAL 458 N -2.43 0.01 0.34 -3.48 1.01 -0.89 -2.58 120.40 112.38 1bqm s VAL 458 Ca 0.10 -0.12 0.09 0.00 0.00 0.00 0.00 61.98 62.05 1bqm s VAL 458 Cb -0.02 -0.73 -0.06 0.00 0.00 0.00 0.00 36.38 35.57 1bqm s VAL 458 CO 0.05 -0.07 -0.05 0.42 0.00 0.00 0.00 175.10 175.45 1bqm s THR 459 N -0.40 2.45 0.07 3.92 -4.23 -1.10 -0.97 115.64 115.37 1bqm s THR 459 Ca -0.05 -2.11 0.25 0.00 -1.18 0.00 0.00 61.69 58.60 1bqm s THR 459 Cb -0.03 -2.70 0.25 0.00 1.34 0.00 0.00 72.50 71.36 1bqm s THR 459 CO 0.03 -0.21 1.74 -0.55 -0.54 0.00 0.00 174.62 175.09 1bqm h ASN 460 N 1.94 0.00 -2.16 3.99 7.08 -1.69 -2.77 115.58 121.96 1bqm h ASN 460 Ca -0.42 0.00 -0.59 0.00 -3.08 0.00 0.00 56.30 52.21 1bqm h ASN 460 Cb 1.25 0.00 -0.41 0.00 -2.08 0.00 0.00 38.32 37.08 1bqm h ASN 460 CO 0.68 0.00 -0.71 2.29 -2.08 0.00 0.00 177.43 177.61 1bqm n LYS 461 N -2.42 2.24 -3.31 4.14 2.85 -1.26 -4.97 118.16 115.43 1bqm n LYS 461 Ca -0.02 -4.39 -0.15 0.00 -1.05 0.00 0.00 58.31 52.70 1bqm n LYS 461 Cb 0.12 -2.05 0.00 0.00 -0.65 0.00 0.00 35.03 32.46 1bqm n LYS 461 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1bqm n GLY 462 N 0.80 -0.58 2.62 2.58 0.00 -1.05 -4.92 105.19 104.64 1bqm n GLY 462 Ca 0.28 0.26 -0.29 0.00 0.00 0.00 0.00 46.02 46.28 1bqm n GLY 462 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1bqm s ARG 463 N -4.07 1.24 0.83 1.61 3.52 -1.25 -4.94 118.95 115.88 1bqm s ARG 463 Ca 0.05 -2.10 -0.09 0.00 -0.13 0.00 0.00 55.73 53.46 1bqm s ARG 463 Cb -0.03 -2.10 0.14 0.00 -1.56 0.00 0.00 34.95 31.40 1bqm s ARG 463 CO 0.44 -1.24 1.15 -0.65 -0.81 0.00 0.00 175.30 174.20 1bqm s GLN 464 N 0.15 1.33 0.00 5.12 -0.21 -1.26 -2.71 119.66 122.08 1bqm s GLN 464 Ca 0.22 -0.57 0.00 0.00 0.02 0.00 0.00 55.36 55.03 1bqm s GLN 464 Cb -0.15 -2.06 0.00 0.00 1.00 0.00 0.00 33.01 31.80 1bqm s GLN 464 CO -0.07 -1.85 0.00 1.17 -2.12 0.00 0.00 175.29 172.43 1bqm n LYS 465 N -3.29 0.00 -3.65 2.91 4.81 -1.06 -4.94 118.16 112.93 1bqm n LYS 465 Ca 0.13 0.00 -0.05 0.00 -0.87 0.00 0.00 58.31 57.53 1bqm n LYS 465 Cb 0.60 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.59 1bqm n LYS 465 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1bqm s VAL 466 N -2.00 -0.55 -0.40 3.15 1.01 -1.26 -1.93 120.40 118.42 1bqm s VAL 466 Ca 0.00 0.03 0.01 0.00 0.00 0.00 0.00 61.98 62.03 1bqm s VAL 466 Cb 0.00 -0.92 0.11 0.00 0.00 0.00 0.00 36.38 35.57 1bqm s VAL 466 CO 0.00 0.01 0.15 -0.69 0.00 0.00 0.00 175.10 174.57 1bqm s VAL 467 N 2.33 2.75 0.24 2.92 1.01 -1.23 -4.91 120.40 123.51 1bqm s VAL 467 Ca -0.07 -2.40 -0.31 0.00 0.00 0.00 0.00 61.98 59.20 1bqm s VAL 467 Cb -0.09 -2.94 -0.14 0.00 0.00 0.00 0.00 36.38 33.20 1bqm s VAL 467 CO -0.18 -0.67 1.34 -0.81 0.00 0.00 0.00 175.10 174.78 1bqm n PRO 468 N 4.19 1.87 -4.34 2.72 -0.04 -1.26 -1.83 135.00 136.31 1bqm n PRO 468 Ca 0.02 0.66 -0.22 0.00 -0.04 0.00 0.00 63.50 63.92 1bqm n PRO 468 Cb 0.40 -2.27 -0.11 0.00 -0.04 0.00 0.00 33.50 31.48 1bqm n PRO 468 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1bqm s LEU 469 N 0.11 2.44 -0.00 1.53 1.43 0.62 -4.87 118.68 119.94 1bqm s LEU 469 Ca 0.67 -0.87 0.00 0.00 -1.03 0.00 0.00 54.13 52.91 1bqm s LEU 469 Cb -0.68 -0.85 0.00 0.00 0.03 0.00 0.00 46.19 44.69 1bqm s LEU 469 CO 0.52 -0.03 0.00 -0.89 0.23 0.00 0.00 176.35 176.18 1bqm s THR 470 N -2.05 0.02 -0.67 5.49 2.01 -1.26 -0.00 115.64 119.17 1bqm s THR 470 Ca 0.17 0.02 0.00 0.00 0.31 0.00 0.00 61.69 62.18 1bqm s THR 470 Cb -0.06 -0.04 0.00 0.00 0.01 0.00 0.00 72.50 72.41 1bqm s THR 470 CO 0.07 0.02 0.00 0.59 -0.69 0.00 0.00 174.62 174.61 1bqm n ASN 471 N 3.22 -3.12 -4.31 3.53 3.02 -1.20 -4.94 115.26 111.46 1bqm n ASN 471 Ca -0.14 0.06 -0.33 0.00 -0.03 0.00 0.00 54.58 54.14 1bqm n ASN 471 Cb 0.59 -2.02 -0.15 0.00 -0.61 0.00 0.00 39.78 37.58 1bqm n ASN 471 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1bqm s THR 472 N -2.33 2.65 0.60 3.41 -4.23 -1.26 -5.09 115.64 109.39 1bqm s THR 472 Ca 0.00 -0.80 -0.16 0.00 -1.18 0.00 0.00 61.69 59.55 1bqm s THR 472 Cb 0.00 -2.08 -0.03 0.00 1.34 0.00 0.00 72.50 71.73 1bqm s THR 472 CO 0.00 0.54 1.07 0.28 -0.54 0.00 0.00 174.62 175.96 1bqm s THR 473 N 0.37 3.70 0.26 3.99 -1.32 -1.26 -4.38 115.64 117.00 1bqm s THR 473 Ca -0.14 0.83 -0.02 0.00 -1.21 0.00 0.00 61.69 61.15 1bqm s THR 473 Cb -0.17 -3.34 0.23 0.00 -1.51 0.00 0.00 72.50 67.71 1bqm s THR 473 CO 0.07 -0.46 1.77 -1.13 -2.21 0.00 0.00 174.62 172.66 1bqm h ASN 474 N 0.46 0.52 0.02 8.08 -0.73 -1.92 0.15 115.58 122.17 1bqm h ASN 474 Ca -0.47 0.09 0.01 0.00 1.87 0.00 0.00 56.30 57.79 1bqm h ASN 474 Cb 1.23 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.80 1bqm h ASN 474 CO 0.57 0.23 -0.07 1.56 -0.37 0.00 0.00 177.43 179.35 1bqm h GLN 475 N 0.63 -0.13 -0.40 6.67 4.20 -1.99 -1.35 115.11 122.74 1bqm h GLN 475 Ca 0.44 0.01 0.03 0.00 0.06 0.00 0.00 58.65 59.19 1bqm h GLN 475 Cb 0.59 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.37 1bqm h GLN 475 CO -0.34 -0.09 0.20 -0.22 -0.67 0.00 0.00 178.83 177.71 1bqm h LYS 476 N -0.14 0.40 -0.46 1.46 3.64 -1.59 -2.47 116.57 117.41 1bqm h LYS 476 Ca 0.02 -0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.42 1bqm h LYS 476 Cb 0.16 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.84 1bqm h LYS 476 CO -0.06 0.27 0.22 1.15 -2.27 0.00 0.00 179.45 178.76 1bqm h THR 477 N 0.41 0.94 0.00 1.00 2.02 -0.38 0.53 112.91 117.43 1bqm h THR 477 Ca 0.17 -0.15 -0.01 0.00 0.77 0.00 0.00 66.41 67.19 1bqm h THR 477 Cb 0.07 0.47 -0.00 0.00 -1.74 0.00 0.00 68.15 66.94 1bqm h THR 477 CO -0.11 0.08 -0.02 -0.33 0.37 0.00 0.00 175.52 175.50 1bqm h GLU 478 N 0.43 0.00 0.04 6.66 5.08 -0.82 0.68 114.58 126.65 1bqm h GLU 478 Ca 0.20 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.46 1bqm h GLU 478 Cb 0.13 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.39 1bqm h GLU 478 CO -0.16 0.02 -0.44 1.25 -1.00 0.00 0.00 179.01 178.69 1bqm h LEU 479 N 0.00 0.32 -1.83 1.33 5.85 -0.64 -3.29 115.31 117.06 1bqm h LEU 479 Ca -0.00 -0.85 0.01 0.00 0.84 0.00 0.00 57.88 57.88 1bqm h LEU 479 Cb 0.05 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 1bqm h LEU 479 CO 0.00 1.14 0.12 -0.61 -0.34 0.00 0.00 178.44 178.75 1bqm h GLN 480 N -0.45 0.22 0.00 1.25 5.75 0.17 -2.17 115.11 119.89 1bqm h GLN 480 Ca -0.07 -0.01 -0.06 0.00 -0.15 0.00 0.00 58.65 58.36 1bqm h GLN 480 Cb 1.24 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 29.73 1bqm h GLN 480 CO 0.08 0.15 -0.28 0.00 -2.65 0.00 0.00 178.83 176.13 1bqm h ALA 481 N 1.89 1.52 0.19 3.38 0.00 -1.01 -1.47 119.26 123.76 1bqm h ALA 481 Ca 0.07 -0.26 -0.31 0.00 0.00 0.00 0.00 54.91 54.42 1bqm h ALA 481 Cb 0.00 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 17.77 1bqm h ALA 481 CO -0.01 0.35 -1.36 0.82 0.00 0.00 0.00 179.25 179.05 1bqm h ILE 482 N 0.00 1.39 -0.22 0.00 2.04 -1.49 -1.61 117.51 117.62 1bqm h ILE 482 Ca -0.00 -2.88 -0.00 0.00 1.00 0.00 0.00 64.86 62.98 1bqm h ILE 482 Cb 0.50 2.99 -0.01 0.00 -0.74 0.00 0.00 36.82 39.56 1bqm h ILE 482 CO 0.04 0.85 0.13 0.22 0.00 0.00 0.00 178.15 179.38 1bqm h TYR 483 N 0.12 0.30 0.20 1.37 3.20 -1.36 1.27 116.97 122.07 1bqm h TYR 483 Ca -0.20 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.68 1bqm h TYR 483 Cb 2.07 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 40.20 1bqm h TYR 483 CO 0.10 0.26 -0.41 1.25 -1.64 0.00 0.00 178.16 177.71 1bqm h LEU 484 N 0.26 -1.17 -2.12 2.82 7.12 -1.32 0.15 115.31 121.04 1bqm h LEU 484 Ca 0.08 0.12 0.07 0.00 0.13 0.00 0.00 57.88 58.28 1bqm h LEU 484 Cb 0.05 0.43 -0.01 0.00 -0.53 0.00 0.00 40.66 40.60 1bqm h LEU 484 CO -0.01 -0.50 0.22 0.00 -0.13 0.00 0.00 178.44 178.01 1bqm h ALA 485 N -0.24 2.04 0.05 1.25 0.00 -0.40 -1.27 119.26 120.69 1bqm h ALA 485 Ca 0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1bqm h ALA 485 Cb 0.69 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1bqm h ALA 485 CO -0.19 -0.35 -0.03 -0.07 0.00 0.00 0.00 179.25 178.62 1bqm h LEU 486 N 0.00 -0.06 -1.56 0.00 3.38 0.42 -3.29 115.31 114.20 1bqm h LEU 486 Ca 0.12 -0.49 0.20 0.00 0.09 0.00 0.00 57.88 57.80 1bqm h LEU 486 Cb 0.56 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 41.26 1bqm h LEU 486 CO -0.00 0.49 0.59 1.56 0.09 0.00 0.00 178.44 181.17 1bqm h GLN 487 N -0.63 0.36 -1.11 1.13 4.20 0.25 -2.36 115.11 116.96 1bqm h GLN 487 Ca -0.01 -0.02 -0.44 0.00 0.06 0.00 0.00 58.65 58.24 1bqm h GLN 487 Cb 0.55 -0.08 -0.23 0.00 0.30 0.00 0.00 27.48 28.02 1bqm h GLN 487 CO 0.01 0.24 0.57 -0.25 -0.67 0.00 0.00 178.83 178.72 1bqm n ASP 488 N -4.49 5.08 -4.26 1.46 8.00 -1.11 -4.91 116.55 116.33 1bqm n ASP 488 Ca 0.19 -3.31 -0.20 0.00 0.71 0.00 0.00 54.79 52.17 1bqm n ASP 488 Cb 0.71 -0.87 -0.12 0.00 -0.02 0.00 0.00 41.12 40.83 1bqm n ASP 488 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1bqm s SER 489 N -0.80 2.22 0.00 -2.24 0.01 -0.89 -5.08 113.70 106.93 1bqm s SER 489 Ca 0.45 -0.77 0.00 0.00 1.31 0.00 0.00 55.95 56.94 1bqm s SER 489 Cb 0.37 -0.10 0.00 0.00 0.21 0.00 0.00 66.02 66.50 1bqm s SER 489 CO 0.04 -0.07 0.00 0.61 0.41 0.00 0.00 173.24 174.24 1bqm n GLY 490 N 0.69 0.21 0.29 3.44 0.00 -1.26 -4.96 105.19 103.61 1bqm n GLY 490 Ca -0.17 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.73 1bqm n GLY 490 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1bqm n LEU 491 N 0.00 2.09 -4.34 0.99 4.77 -1.26 -4.93 117.00 114.32 1bqm n LEU 491 Ca 0.00 0.04 -0.32 0.00 -0.03 0.00 0.00 56.01 55.70 1bqm n LEU 491 Cb 0.00 -0.45 -0.15 0.00 -2.33 0.00 0.00 43.42 40.49 1bqm n LEU 491 CO 0.00 0.53 -0.51 -1.83 -1.33 0.00 0.00 177.39 174.25 1bqm s GLU 492 N -2.26 2.80 0.12 3.23 -1.05 -1.26 -1.71 118.70 118.56 1bqm s GLU 492 Ca -0.19 -0.80 -0.02 0.00 -0.15 0.00 0.00 54.97 53.81 1bqm s GLU 492 Cb 0.06 -2.35 -0.03 0.00 -0.44 0.00 0.00 34.13 31.37 1bqm s GLU 492 CO 0.28 0.38 0.08 0.54 0.95 0.00 0.00 175.26 177.48 1bqm s VAL 493 N -0.11 0.12 -0.05 1.83 0.11 -0.50 -4.47 120.40 117.33 1bqm s VAL 493 Ca -0.03 -1.79 0.04 0.00 -2.93 0.00 0.00 61.98 57.26 1bqm s VAL 493 Cb -0.14 -1.89 0.00 0.00 -1.53 0.00 0.00 36.38 32.82 1bqm s VAL 493 CO 0.04 -0.55 -0.15 0.20 -3.33 0.00 0.00 175.10 171.31 1bqm s ASN 494 N -3.01 1.99 -0.08 3.54 0.01 -1.16 -1.57 114.94 114.65 1bqm s ASN 494 Ca 0.19 -0.33 -0.02 0.00 -0.71 0.00 0.00 52.86 52.00 1bqm s ASN 494 Cb 0.07 -0.64 0.03 0.00 0.41 0.00 0.00 41.25 41.12 1bqm s ASN 494 CO -0.01 0.12 0.02 -0.63 -1.51 0.00 0.00 177.10 175.09 1bqm s ILE 495 N 0.21 0.27 -0.26 0.60 1.01 0.37 -1.22 121.20 122.18 1bqm s ILE 495 Ca -0.07 0.10 -0.18 0.00 0.00 0.00 0.00 60.65 60.50 1bqm s ILE 495 Cb -0.12 -0.51 -0.03 0.00 0.01 0.00 0.00 42.46 41.81 1bqm s ILE 495 CO 0.03 0.17 0.53 -0.69 0.00 0.00 0.00 174.94 174.98 1bqm s VAL 496 N 2.01 5.06 -0.10 2.92 1.01 -0.88 0.66 120.40 131.07 1bqm s VAL 496 Ca 0.04 0.93 -0.05 0.00 0.00 0.00 0.00 61.98 62.89 1bqm s VAL 496 Cb -0.13 -3.85 -0.04 0.00 0.00 0.00 0.00 36.38 32.37 1bqm s VAL 496 CO -0.05 0.08 0.11 -0.89 0.00 0.00 0.00 175.10 174.34 1bqm s THR 497 N 2.32 5.21 -0.00 3.92 2.01 -0.57 -2.20 115.64 126.32 1bqm s THR 497 Ca 0.22 0.07 -0.17 0.00 0.31 0.00 0.00 61.69 62.12 1bqm s THR 497 Cb -0.16 -3.26 -0.09 0.00 0.01 0.00 0.00 72.50 69.00 1bqm s THR 497 CO 0.09 0.59 0.85 -0.78 -0.69 0.00 0.00 174.62 174.69 1bqm h ASP 498 N 4.93 -0.51 -3.76 3.53 3.58 -1.74 -0.56 116.42 121.89 1bqm h ASP 498 Ca -0.54 0.02 -0.51 0.00 0.42 0.00 0.00 57.03 56.43 1bqm h ASP 498 Cb 1.22 0.13 0.02 0.00 1.72 0.00 0.00 39.33 42.41 1bqm h ASP 498 CO 0.58 -0.22 0.48 -0.55 -2.88 0.00 0.00 179.24 176.65 1bqm s SER 499 N -3.99 7.26 -0.05 2.28 0.15 -1.26 -4.32 113.70 113.77 1bqm s SER 499 Ca -0.09 2.25 -0.13 0.00 0.70 0.00 0.00 55.95 58.68 1bqm s SER 499 Cb 0.01 -2.62 -0.31 0.00 -1.71 0.00 0.00 66.02 61.39 1bqm s SER 499 CO 0.26 -0.16 0.70 -0.61 1.20 0.00 0.00 173.24 174.64 1bqm h GLN 500 N 4.02 0.38 -0.11 5.44 4.15 -1.91 -3.02 115.11 124.06 1bqm h GLN 500 Ca -0.46 -0.65 0.04 0.00 0.77 0.00 0.00 58.65 58.35 1bqm h GLN 500 Cb 1.21 0.24 -0.06 0.00 0.21 0.00 0.00 27.48 29.08 1bqm h GLN 500 CO 0.68 1.31 -0.40 -0.92 -1.93 0.00 0.00 178.83 177.58 1bqm h TYR 501 N -0.00 -1.12 -0.20 3.99 5.03 -1.97 0.45 116.97 123.14 1bqm h TYR 501 Ca -0.31 0.04 -0.06 0.00 2.58 0.00 0.00 58.73 60.98 1bqm h TYR 501 Cb 2.01 0.51 -0.01 0.00 1.55 0.00 0.00 36.73 40.79 1bqm h TYR 501 CO 0.12 -0.46 -0.14 0.00 -1.32 0.00 0.00 178.16 176.35 1bqm h ALA 502 N 0.17 1.39 0.72 1.82 0.00 -1.93 -1.71 119.26 119.70 1bqm h ALA 502 Ca 0.08 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1bqm h ALA 502 Cb 0.61 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.30 1bqm h ALA 502 CO -0.37 0.42 -0.34 1.25 0.00 0.00 0.00 179.25 180.21 1bqm h LEU 503 N 0.31 -0.81 0.00 0.00 5.85 -1.09 -2.05 115.31 117.52 1bqm h LEU 503 Ca 0.06 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1bqm h LEU 503 Cb 0.44 0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.68 1bqm h LEU 503 CO 0.03 -0.45 0.00 0.61 -0.34 0.00 0.00 178.44 178.28 1bqm n GLY 504 N -0.81 -0.59 0.07 3.75 0.00 0.15 -0.85 105.19 106.91 1bqm n GLY 504 Ca -0.12 -0.04 -0.01 0.00 0.00 0.00 0.00 46.02 45.85 1bqm n GLY 504 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1bqm n ILE 505 N -1.32 0.91 0.66 -0.61 5.41 -0.66 -4.25 119.36 119.50 1bqm n ILE 505 Ca 0.04 -0.71 0.11 0.00 1.00 0.00 0.00 62.75 63.19 1bqm n ILE 505 Cb 0.07 -0.38 -0.00 0.00 -0.71 0.00 0.00 39.64 38.61 1bqm n ILE 505 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 1bqm n ILE 506 N -2.63 0.10 -0.05 1.39 5.41 -0.26 -4.20 119.36 119.12 1bqm n ILE 506 Ca -0.19 -0.19 -0.15 0.00 1.00 0.00 0.00 62.75 63.23 1bqm n ILE 506 Cb 0.90 0.37 -0.07 0.00 -0.71 0.00 0.00 39.64 40.13 1bqm n ILE 506 CO 0.00 0.00 0.00 -0.61 0.00 0.00 0.00 176.55 175.94 1bqm h GLN 507 N 0.00 0.55 0.00 0.38 5.75 -1.17 -3.02 115.11 117.60 1bqm h GLN 507 Ca 0.00 -0.39 0.00 0.00 -0.15 0.00 0.00 58.65 58.11 1bqm h GLN 507 Cb 0.68 0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.29 1bqm h GLN 507 CO 0.00 1.01 0.00 0.00 -2.65 0.00 0.00 178.83 177.19 1bqm n ALA 508 N -2.52 1.53 -3.74 3.38 0.00 -1.26 -4.89 120.51 113.01 1bqm n ALA 508 Ca -0.07 -0.04 -0.27 0.00 0.00 0.00 0.00 53.44 53.07 1bqm n ALA 508 Cb 0.55 -1.12 0.01 0.00 0.00 0.00 0.00 19.45 18.88 1bqm n ALA 508 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bqm n GLN 509 N -1.29 -1.22 0.00 0.00 10.64 -1.14 -4.86 117.38 119.52 1bqm n GLN 509 Ca 0.04 0.68 0.00 0.00 -1.83 0.00 0.00 57.00 55.89 1bqm n GLN 509 Cb 0.06 -3.02 0.00 0.00 -0.86 0.00 0.00 30.24 26.42 1bqm n GLN 509 CO 0.00 0.00 0.00 -2.30 -1.83 0.00 0.00 177.06 172.93 1bqm n PRO 510 N -3.19 0.98 0.00 2.61 -0.02 -1.26 -4.90 135.00 129.22 1bqm n PRO 510 Ca -0.21 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.27 1bqm n PRO 510 Cb 0.63 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.11 1bqm n PRO 510 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1bqm n ASP 511 N -0.04 0.00 -4.77 2.55 5.68 -1.26 -4.97 116.55 113.73 1bqm n ASP 511 Ca 0.00 0.00 -0.28 0.00 -0.50 0.00 0.00 54.79 54.01 1bqm n ASP 511 Cb 0.00 0.24 -0.06 0.00 -1.14 0.00 0.00 41.12 40.16 1bqm n ASP 511 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1bqm s LYS 512 N -1.54 2.83 -0.24 0.11 1.02 -1.26 -4.88 119.74 115.77 1bqm s LYS 512 Ca 0.00 -0.82 -0.37 0.00 0.02 0.00 0.00 55.97 54.80 1bqm s LYS 512 Cb 0.00 -2.64 0.15 0.00 -0.52 0.00 0.00 37.83 34.82 1bqm s LYS 512 CO 0.00 0.52 1.33 -1.12 -0.92 0.00 0.00 175.35 175.15 1bqm s SER 513 N -2.76 -0.05 0.18 2.83 0.01 -1.26 -4.43 113.70 108.22 1bqm s SER 513 Ca 0.30 -0.01 0.21 0.00 1.31 0.00 0.00 55.95 57.76 1bqm s SER 513 Cb -0.11 0.06 -0.02 0.00 0.21 0.00 0.00 66.02 66.16 1bqm s SER 513 CO 0.22 -0.10 1.03 1.05 0.41 0.00 0.00 173.24 175.85 1bqm h GLU 514 N 2.00 0.00 -6.14 12.44 9.09 -2.02 -3.45 114.58 126.51 1bqm h GLU 514 Ca -0.07 0.00 -0.52 0.00 0.05 0.00 0.00 59.36 58.82 1bqm h GLU 514 Cb 1.14 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 28.20 1bqm h GLU 514 CO 0.21 0.10 1.26 0.45 0.05 0.00 0.00 179.01 181.08 1bqm s SER 515 N -5.57 5.61 0.60 3.06 0.15 -1.26 -4.82 113.70 111.47 1bqm s SER 515 Ca -0.01 0.35 0.29 0.00 0.70 0.00 0.00 55.95 57.28 1bqm s SER 515 Cb 0.09 -2.54 1.57 0.00 -1.71 0.00 0.00 66.02 63.44 1bqm s SER 515 CO 0.79 -2.11 1.98 -0.33 1.20 0.00 0.00 173.24 174.77 1bqm h GLU 516 N 13.40 0.00 0.15 5.44 4.39 -1.98 -0.10 114.58 135.87 1bqm h GLU 516 Ca -0.27 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.42 1bqm h GLU 516 Cb 1.14 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.79 1bqm h GLU 516 CO 1.20 0.00 -0.07 1.25 -1.16 0.00 0.00 179.01 180.22 1bqm h LEU 517 N 0.00 -0.17 -0.26 1.33 5.85 -1.98 0.13 115.31 120.21 1bqm h LEU 517 Ca 0.14 -0.09 -0.19 0.00 0.84 0.00 0.00 57.88 58.58 1bqm h LEU 517 Cb 0.84 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.89 1bqm h LEU 517 CO -0.00 -0.02 -0.89 0.58 -0.34 0.00 0.00 178.44 177.78 1bqm h VAL 518 N -0.31 1.57 -0.26 1.05 2.07 -1.62 -3.04 116.25 115.70 1bqm h VAL 518 Ca -0.02 -2.84 -0.07 0.00 0.82 0.00 0.00 66.70 64.58 1bqm h VAL 518 Cb 0.25 2.57 -0.01 0.00 -1.52 0.00 0.00 31.29 32.57 1bqm h VAL 518 CO 0.03 0.82 -0.15 0.78 0.02 0.00 0.00 177.57 179.07 1bqm h ASN 519 N 0.04 0.44 1.21 0.57 2.35 -0.92 -2.04 115.58 117.21 1bqm h ASN 519 Ca -0.03 -0.12 -0.03 0.00 -0.55 0.00 0.00 56.30 55.57 1bqm h ASN 519 Cb 1.54 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 39.79 1bqm h ASN 519 CO 0.12 0.62 -0.16 1.56 -1.65 0.00 0.00 177.43 177.92 1bqm h GLN 520 N 0.41 0.00 0.17 0.81 4.20 -0.63 -1.36 115.11 118.72 1bqm h GLN 520 Ca 0.08 0.00 -0.28 0.00 0.06 0.00 0.00 58.65 58.51 1bqm h GLN 520 Cb 0.51 0.00 0.03 0.00 0.30 0.00 0.00 27.48 28.32 1bqm h GLN 520 CO 0.03 0.16 -1.19 0.82 -0.67 0.00 0.00 178.83 177.98 1bqm h ILE 521 N 0.00 1.35 -0.04 2.54 2.04 -1.40 -3.19 117.51 118.81 1bqm h ILE 521 Ca -0.00 -2.54 0.03 0.00 1.00 0.00 0.00 64.86 63.35 1bqm h ILE 521 Cb 0.80 2.95 -0.04 0.00 -0.74 0.00 0.00 36.82 39.79 1bqm h ILE 521 CO 0.02 0.75 -0.19 0.40 0.00 0.00 0.00 178.15 179.14 1bqm h ILE 522 N 0.04 0.54 -0.75 -0.67 2.04 -0.95 0.10 117.51 117.88 1bqm h ILE 522 Ca -0.20 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.78 1bqm h ILE 522 Cb 1.91 0.54 -0.05 0.00 -0.74 0.00 0.00 36.82 38.48 1bqm h ILE 522 CO 0.22 0.00 0.49 -0.33 0.00 0.00 0.00 178.15 178.54 1bqm h GLU 523 N -0.28 0.53 -0.28 2.37 5.08 -1.36 0.97 114.58 121.62 1bqm h GLU 523 Ca 0.07 -0.03 -0.17 0.00 -1.00 0.00 0.00 59.36 58.23 1bqm h GLU 523 Cb 0.38 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.51 1bqm h GLU 523 CO -0.20 0.35 -0.48 1.96 -1.00 0.00 0.00 179.01 179.64 1bqm h GLN 524 N 0.55 0.81 -0.69 2.33 1.08 -1.22 -2.85 115.11 115.12 1bqm h GLN 524 Ca 0.36 -0.50 -0.04 0.00 -1.45 0.00 0.00 58.65 57.01 1bqm h GLN 524 Cb 0.63 0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 28.08 1bqm h GLN 524 CO -0.13 1.13 0.28 -0.07 -0.95 0.00 0.00 178.83 179.10 1bqm h LEU 525 N 0.57 0.95 -1.16 1.46 3.38 0.10 -1.42 115.31 119.20 1bqm h LEU 525 Ca 0.02 -0.17 -0.08 0.00 0.09 0.00 0.00 57.88 57.74 1bqm h LEU 525 Cb 1.08 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 1bqm h LEU 525 CO 0.11 0.86 -0.25 0.40 0.09 0.00 0.00 178.44 179.64 1bqm h ILE 526 N 0.98 1.24 0.00 1.22 2.04 -0.93 -2.91 117.51 119.16 1bqm h ILE 526 Ca 0.23 -1.14 -0.20 0.00 1.00 0.00 0.00 64.86 64.75 1bqm h ILE 526 Cb 0.20 1.41 -0.03 0.00 -0.74 0.00 0.00 36.82 37.66 1bqm h ILE 526 CO -0.02 0.35 -1.52 1.17 0.00 0.00 0.00 178.15 178.12 1bqm n LYS 527 N -4.15 0.63 -1.00 2.37 4.81 -1.08 -4.94 118.16 114.79 1bqm n LYS 527 Ca -0.01 0.23 -0.32 0.00 -0.87 0.00 0.00 58.31 57.33 1bqm n LYS 527 Cb 0.37 -1.79 0.14 0.00 0.02 0.00 0.00 35.03 33.76 1bqm n LYS 527 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1bqm s LYS 528 N -2.84 1.50 0.00 1.64 -0.14 -0.54 -5.01 119.74 114.34 1bqm s LYS 528 Ca -0.04 1.62 0.00 0.00 -1.36 0.00 0.00 55.97 56.19 1bqm s LYS 528 Cb 0.08 -1.77 0.00 0.00 -1.68 0.00 0.00 37.83 34.46 1bqm s LYS 528 CO 0.82 -2.29 0.00 -0.85 -0.76 0.00 0.00 175.35 172.27 1bqm n GLU 529 N -3.63 0.00 -3.82 1.68 0.28 -0.69 -4.91 120.64 109.54 1bqm n GLU 529 Ca 0.12 0.00 -0.36 0.00 -0.16 0.00 0.00 57.16 56.76 1bqm n GLU 529 Cb 0.51 -0.17 -0.13 0.00 1.43 0.00 0.00 31.44 33.09 1bqm n GLU 529 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 1bqm s LYS 530 N 0.00 2.81 -0.09 3.44 1.02 -1.23 -5.00 119.74 120.68 1bqm s LYS 530 Ca 0.00 -1.03 -0.02 0.00 0.02 0.00 0.00 55.97 54.93 1bqm s LYS 530 Cb 0.00 -3.28 -0.03 0.00 -0.52 0.00 0.00 37.83 34.00 1bqm s LYS 530 CO 0.00 -0.52 0.00 0.08 -0.92 0.00 0.00 175.35 173.99 1bqm s VAL 531 N 1.40 4.33 -0.09 3.17 1.01 -1.26 -1.41 120.40 127.55 1bqm s VAL 531 Ca -0.00 -0.24 0.01 0.00 0.00 0.00 0.00 61.98 61.75 1bqm s VAL 531 Cb -0.18 -2.83 0.02 0.00 0.00 0.00 0.00 36.38 33.39 1bqm s VAL 531 CO 0.00 0.59 -0.09 -0.47 0.00 0.00 0.00 175.10 175.14 1bqm s TYR 532 N -0.76 1.35 -0.30 5.22 6.14 -0.61 -0.71 117.35 127.68 1bqm s TYR 532 Ca 0.12 -0.58 -0.02 0.00 0.64 0.00 0.00 57.07 57.23 1bqm s TYR 532 Cb -0.12 -1.09 0.05 0.00 0.42 0.00 0.00 41.96 41.22 1bqm s TYR 532 CO 0.02 -0.38 0.00 -0.51 0.64 0.00 0.00 175.55 175.32 1bqm s LEU 533 N 1.24 3.86 0.00 6.97 1.02 -1.26 -0.48 118.68 130.02 1bqm s LEU 533 Ca -0.04 -1.21 -0.03 0.00 0.02 0.00 0.00 54.13 52.86 1bqm s LEU 533 Cb -0.14 -1.72 0.16 0.00 0.02 0.00 0.00 46.19 44.51 1bqm s LEU 533 CO -0.03 -0.25 1.07 0.00 0.02 0.00 0.00 176.35 177.16 1bqm n ALA 534 N 4.64 -0.11 -3.58 4.21 0.00 0.21 -4.95 120.51 120.93 1bqm n ALA 534 Ca -0.13 -1.93 -0.12 0.00 0.00 0.00 0.00 53.44 51.25 1bqm n ALA 534 Cb 0.44 0.25 -0.08 0.00 0.00 0.00 0.00 19.45 20.06 1bqm n ALA 534 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1bqm s TRP 535 N -3.26 -0.78 -0.00 0.00 -0.00 -1.26 -1.51 118.94 112.12 1bqm s TRP 535 Ca 0.68 1.79 -0.01 0.00 -0.00 0.00 0.00 56.10 58.56 1bqm s TRP 535 Cb -0.03 0.33 -0.00 0.00 -0.00 0.00 0.00 33.47 33.76 1bqm s TRP 535 CO 0.46 -0.38 0.02 0.14 -0.00 0.00 0.00 176.95 177.19 1bqm s VAL 536 N 0.69 0.04 0.31 5.86 -7.23 -0.22 -4.83 120.40 115.01 1bqm s VAL 536 Ca -0.03 -0.30 -0.29 0.00 -1.81 0.00 0.00 61.98 59.55 1bqm s VAL 536 Cb -0.05 -0.13 -0.10 0.00 0.56 0.00 0.00 36.38 36.66 1bqm s VAL 536 CO -0.04 -0.17 1.30 -2.16 -0.31 0.00 0.00 175.10 173.72 1bqm s PRO 537 N -0.49 4.38 0.74 4.82 0.04 -1.26 -4.25 135.00 138.97 1bqm s PRO 537 Ca -0.05 2.17 -0.09 0.00 0.04 0.00 0.00 61.00 63.06 1bqm s PRO 537 Cb -0.03 -3.10 0.06 0.00 0.04 0.00 0.00 34.50 31.47 1bqm s PRO 537 CO -0.00 -0.17 1.08 0.00 0.04 0.00 0.00 177.00 177.94 1bqm s ALA 538 N -0.93 2.95 -1.84 8.56 0.00 -1.26 -4.02 121.76 125.22 1bqm s ALA 538 Ca 0.50 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 51.69 1bqm s ALA 538 Cb -0.39 -2.77 0.00 0.00 0.00 0.00 0.00 23.12 19.96 1bqm s ALA 538 CO 0.50 -1.42 0.00 0.72 0.00 0.00 0.00 175.76 175.56 1bqm n HIS 539 N -3.07 -0.10 -2.05 0.00 8.25 -1.26 -4.75 115.22 112.24 1bqm n HIS 539 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 1bqm n HIS 539 Cb 0.60 -3.13 0.00 0.00 1.12 0.00 0.00 29.99 28.59 1bqm n HIS 539 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 1bqm n LYS 540 N -2.01 0.00 -0.83 -0.41 4.81 -1.26 -5.01 118.16 113.46 1bqm n LYS 540 Ca -0.17 -0.96 0.00 0.00 -0.87 0.00 0.00 58.31 56.30 1bqm n LYS 540 Cb 0.60 -0.37 0.00 0.00 0.02 0.00 0.00 35.03 35.29 1bqm n LYS 540 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1bqm n GLY 541 N 0.05 0.00 3.74 3.14 0.00 -1.26 -4.93 105.19 105.93 1bqm n GLY 541 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1bqm n GLY 541 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bqm s ILE 542 N -0.84 2.99 0.00 -0.61 -1.09 -1.26 -4.26 121.20 116.14 1bqm s ILE 542 Ca 0.00 0.81 0.00 0.00 -2.23 0.00 0.00 60.65 59.23 1bqm s ILE 542 Cb 0.00 -3.52 0.00 0.00 -1.58 0.00 0.00 42.46 37.36 1bqm s ILE 542 CO 0.00 0.12 0.00 0.61 -1.23 0.00 0.00 174.94 174.44 1bqm n GLY 543 N 2.47 1.82 0.37 6.18 0.00 -1.26 -3.84 105.19 110.92 1bqm n GLY 543 Ca 0.07 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.70 1bqm n GLY 543 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bqm n GLY 544 N 0.00 0.79 0.47 -0.02 0.00 -1.26 -4.98 105.19 100.19 1bqm n GLY 544 Ca 0.00 0.00 0.27 0.00 0.00 0.00 0.00 46.02 46.29 1bqm n GLY 544 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1bqm h ASN 545 N 0.00 0.00 -0.00 1.61 2.35 -1.74 0.76 115.58 118.56 1bqm h ASN 545 Ca 0.00 0.00 0.03 0.00 -0.55 0.00 0.00 56.30 55.78 1bqm h ASN 545 Cb 0.79 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 39.11 1bqm h ASN 545 CO 0.00 0.00 -0.27 -0.33 -1.65 0.00 0.00 177.43 175.18 1bqm h GLU 546 N 0.00 -0.40 0.00 0.81 4.39 -1.92 -0.63 114.58 116.83 1bqm h GLU 546 Ca 0.39 0.03 0.00 0.00 0.34 0.00 0.00 59.36 60.11 1bqm h GLU 546 Cb 1.93 0.09 0.00 0.00 -0.10 0.00 0.00 28.75 30.67 1bqm h GLU 546 CO -0.00 -0.27 -1.78 0.00 -1.16 0.00 0.00 179.01 175.80 1bqm n GLN 547 N -5.38 0.59 0.04 2.33 0.00 -0.92 -4.00 117.38 110.04 1bqm n GLN 547 Ca -0.05 -0.14 -0.08 0.00 0.00 0.00 0.00 57.00 56.73 1bqm n GLN 547 Cb 0.30 -1.55 0.08 0.00 0.00 0.00 0.00 30.24 29.06 1bqm n GLN 547 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 1bqm h VAL 548 N 0.00 1.35 -0.59 -0.39 2.07 -0.71 -3.12 116.25 114.86 1bqm h VAL 548 Ca 0.00 -1.88 0.00 0.00 0.82 0.00 0.00 66.70 65.64 1bqm h VAL 548 Cb 0.95 1.88 0.00 0.00 -1.52 0.00 0.00 31.29 32.60 1bqm h VAL 548 CO 0.00 0.57 0.00 -0.67 0.02 0.00 0.00 177.57 177.49 1bqm n ASP 549 N -3.92 3.77 0.03 0.57 -0.08 -0.26 -4.01 116.55 112.66 1bqm n ASP 549 Ca -0.03 -2.11 0.11 0.00 -1.51 0.00 0.00 54.79 51.25 1bqm n ASP 549 Cb 0.62 -0.43 -0.04 0.00 2.34 0.00 0.00 41.12 43.62 1bqm n ASP 549 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1bqm n LYS 550 N 1.14 0.43 -0.05 -0.67 4.76 -1.18 -3.95 118.16 118.64 1bqm n LYS 550 Ca 0.21 -0.02 -0.21 0.00 -2.87 0.00 0.00 58.31 55.41 1bqm n LYS 550 Cb 0.61 -1.62 -0.13 0.00 -1.84 0.00 0.00 35.03 32.05 1bqm n LYS 550 CO 0.00 0.00 0.00 1.47 -1.37 0.00 0.00 177.40 177.50 1bqm n LEU 551 N -2.17 2.59 -0.82 -0.35 -0.00 -1.21 -4.18 117.00 110.87 1bqm n LEU 551 Ca 0.00 0.16 0.00 0.00 -0.00 0.00 0.00 56.01 56.18 1bqm n LEU 551 Cb 0.49 -1.04 0.07 0.00 -0.00 0.00 0.00 43.42 42.93 1bqm n LEU 551 CO 0.42 0.79 0.40 1.33 -0.00 0.00 0.00 177.39 180.33 1bqm n VAL 552 N -3.59 0.63 -2.35 1.47 0.24 -1.26 -4.92 118.33 108.56 1bqm n VAL 552 Ca -0.36 -0.26 -0.42 0.00 -2.04 0.00 0.00 64.34 61.25 1bqm n VAL 552 Cb 0.98 -0.53 -0.03 0.00 -1.47 0.00 0.00 33.84 32.80 1bqm n VAL 552 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1bqm s SER 553 N -0.03 7.00 0.71 -1.34 1.04 -1.25 -4.79 113.70 115.03 1bqm s SER 553 Ca 0.10 2.08 -0.01 0.00 0.48 0.00 0.00 55.95 58.60 1bqm s SER 553 Cb 0.08 -2.58 0.12 0.00 0.10 0.00 0.00 66.02 63.74 1bqm s SER 553 CO 0.03 -0.54 0.98 0.00 0.98 0.00 0.00 173.24 174.69 1bqm s ALA 554 N 1.26 3.69 -0.97 5.32 0.00 -1.26 -5.02 121.76 124.78 1bqm s ALA 554 Ca 0.60 -1.67 -0.03 0.00 0.00 0.00 0.00 51.96 50.86 1bqm s ALA 554 Cb -0.31 -2.03 0.19 0.00 0.00 0.00 0.00 23.12 20.97 1bqm s ALA 554 CO 0.29 -1.40 2.29 0.41 0.00 0.00 0.00 175.76 177.35 1bqm n GLY 555 N -2.80 5.28 0.00 0.00 0.00 -1.26 -5.23 105.19 101.18 1bqm n GLY 555 Ca 0.14 -2.20 0.00 0.00 0.00 0.00 0.00 46.02 43.96 1bqm n GLY 555 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61