#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bqn s ILE 2 N 0.00 2.21 -0.47 0.52 -4.36 -1.26 -5.10 121.20 112.74 1bqn s ILE 2 Ca 0.00 -1.94 0.04 0.00 -0.26 0.00 0.00 60.65 58.48 1bqn s ILE 2 Cb 0.00 -2.02 0.17 0.00 1.25 0.00 0.00 42.46 41.85 1bqn s ILE 2 CO 0.00 -0.12 0.36 -0.94 0.24 0.00 0.00 174.94 174.48 1bqn s SER 3 N -2.54 2.34 -0.46 4.36 1.04 -1.26 -5.11 113.70 112.06 1bqn s SER 3 Ca 0.18 -3.14 -0.33 0.00 0.48 0.00 0.00 55.95 53.14 1bqn s SER 3 Cb -0.08 -0.71 -0.12 0.00 0.10 0.00 0.00 66.02 65.21 1bqn s SER 3 CO 0.08 -0.17 2.31 -2.65 0.98 0.00 0.00 173.24 173.79 1bqn n PRO 4 N 2.78 0.94 -2.22 4.02 -0.02 -1.26 -4.97 135.00 134.27 1bqn n PRO 4 Ca 0.25 0.20 -0.27 0.00 -2.02 0.00 0.00 63.50 61.66 1bqn n PRO 4 Cb 0.44 -2.53 0.15 0.00 -0.02 0.00 0.00 33.50 31.54 1bqn n PRO 4 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1bqn s ILE 5 N 8.51 2.06 0.28 4.25 1.01 -1.26 -5.10 121.20 130.95 1bqn s ILE 5 Ca 1.11 -0.26 0.09 0.00 0.00 0.00 0.00 60.65 61.59 1bqn s ILE 5 Cb -0.78 -2.80 -0.04 0.00 0.01 0.00 0.00 42.46 38.85 1bqn s ILE 5 CO 0.44 0.00 0.01 -0.70 0.00 0.00 0.00 174.94 174.70 1bqn s GLU 6 N -5.55 2.30 0.02 2.79 2.56 -1.26 -4.88 118.70 114.68 1bqn s GLU 6 Ca 0.70 -1.44 -0.01 0.00 0.00 0.00 0.00 54.97 54.23 1bqn s GLU 6 Cb -0.05 -2.16 -0.04 0.00 2.00 0.00 0.00 34.13 33.88 1bqn s GLU 6 CO 0.49 0.33 0.14 0.95 -0.56 0.00 0.00 175.26 176.61 1bqn s THR 7 N -2.34 5.06 -0.48 -1.70 -4.23 -1.26 -4.85 115.64 105.84 1bqn s THR 7 Ca 0.32 -0.37 -0.16 0.00 -1.18 0.00 0.00 61.69 60.29 1bqn s THR 7 Cb -0.06 -3.38 0.06 0.00 1.34 0.00 0.00 72.50 70.47 1bqn s THR 7 CO 0.20 0.27 0.45 -0.69 -0.54 0.00 0.00 174.62 174.31 1bqn s VAL 8 N -1.32 5.14 -0.30 2.29 1.01 -1.26 -5.01 120.40 120.95 1bqn s VAL 8 Ca 0.27 -0.88 -0.37 0.00 0.00 0.00 0.00 61.98 61.00 1bqn s VAL 8 Cb -0.12 -4.16 -0.13 0.00 0.00 0.00 0.00 36.38 31.96 1bqn s VAL 8 CO 0.19 -0.62 1.98 -2.65 0.00 0.00 0.00 175.10 174.00 1bqn n PRO 9 N 5.46 1.20 -3.57 2.72 -0.02 -1.26 -4.72 135.00 134.81 1bqn n PRO 9 Ca -0.11 0.39 -0.37 0.00 -2.02 0.00 0.00 63.50 61.39 1bqn n PRO 9 Cb 0.44 -2.30 -0.09 0.00 -0.02 0.00 0.00 33.50 31.53 1bqn n PRO 9 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1bqn s VAL 10 N 5.41 5.30 0.20 -1.45 1.01 -1.26 -5.08 120.40 124.53 1bqn s VAL 10 Ca 1.04 0.33 0.07 0.00 0.00 0.00 0.00 61.98 63.41 1bqn s VAL 10 Cb -0.95 -3.57 -0.05 0.00 0.00 0.00 0.00 36.38 31.81 1bqn s VAL 10 CO 0.57 0.29 -0.13 -0.75 0.00 0.00 0.00 175.10 175.08 1bqn s LYS 11 N 1.33 1.29 -0.17 2.72 2.47 -1.26 -4.69 119.74 121.43 1bqn s LYS 11 Ca 0.11 -1.58 -0.29 0.00 -1.56 0.00 0.00 55.97 52.65 1bqn s LYS 11 Cb -0.14 -1.01 -0.04 0.00 -1.46 0.00 0.00 37.83 35.18 1bqn s LYS 11 CO 0.07 0.15 1.64 -0.51 0.16 0.00 0.00 175.35 176.86 1bqn s LEU 12 N -3.29 4.02 1.19 5.43 1.43 -1.26 -4.88 118.68 121.31 1bqn s LEU 12 Ca 0.22 1.83 -0.14 0.00 -1.03 0.00 0.00 54.13 55.01 1bqn s LEU 12 Cb 0.00 -3.53 0.27 0.00 0.03 0.00 0.00 46.19 42.97 1bqn s LEU 12 CO 0.06 -1.17 0.85 2.29 0.23 0.00 0.00 176.35 178.61 1bqn n LYS 13 N 7.51 -2.52 -0.02 1.70 -0.00 -1.26 -4.13 118.16 119.45 1bqn n LYS 13 Ca 0.19 -0.71 0.00 0.00 -0.00 0.00 0.00 58.31 57.79 1bqn n LYS 13 Cb 0.44 -2.08 0.00 0.00 -0.00 0.00 0.00 35.03 33.39 1bqn n LYS 13 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.40 175.10 1bqn n PRO 14 N -4.59 -0.01 -0.78 -1.58 -0.02 -1.26 -0.59 135.00 126.17 1bqn n PRO 14 Ca 0.02 -0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.50 1bqn n PRO 14 Cb 0.55 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.04 1bqn n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bqn n GLY 15 N -0.00 0.33 3.43 -1.23 0.00 -1.26 -5.00 105.19 101.46 1bqn n GLY 15 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1bqn n GLY 15 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1bqn s MET 16 N -0.79 -1.49 0.50 1.61 -1.94 0.24 -5.07 119.30 112.36 1bqn s MET 16 Ca 0.00 0.72 0.05 0.00 -1.71 0.00 0.00 55.69 54.75 1bqn s MET 16 Cb 0.00 -1.50 0.01 0.00 2.01 0.00 0.00 34.83 35.35 1bqn s MET 16 CO 0.00 -4.07 0.29 0.34 -0.01 0.00 0.00 175.02 171.57 1bqn s ASP 17 N -2.53 4.54 0.43 3.03 -1.08 -1.26 -4.83 116.67 114.97 1bqn s ASP 17 Ca 0.69 -1.24 -0.11 0.00 -0.52 0.00 0.00 52.55 51.37 1bqn s ASP 17 Cb -0.24 0.17 -0.06 0.00 -1.46 0.00 0.00 42.92 41.33 1bqn s ASP 17 CO 0.64 -0.91 0.80 -0.83 0.52 0.00 0.00 175.17 175.39 1bqn s GLY 18 N -4.13 1.90 0.18 2.66 0.00 -1.26 -5.01 107.32 101.67 1bqn s GLY 18 Ca 0.32 -0.19 -0.33 0.00 0.00 0.00 0.00 44.72 44.51 1bqn s GLY 18 CO 0.19 0.01 1.46 -1.55 0.00 0.00 0.00 173.10 173.21 1bqn n PRO 19 N -1.46 1.90 -2.85 2.90 -0.04 -1.26 -4.92 135.00 129.28 1bqn n PRO 19 Ca 0.03 0.68 -0.25 0.00 -0.04 0.00 0.00 63.50 63.92 1bqn n PRO 19 Cb 0.54 -2.38 -0.03 0.00 -0.04 0.00 0.00 33.50 31.60 1bqn n PRO 19 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1bqn n LYS 20 N 2.73 2.97 -1.28 0.54 5.02 -1.26 -1.29 118.16 125.59 1bqn n LYS 20 Ca 0.15 -4.56 -0.30 0.00 -2.02 0.00 0.00 58.31 51.58 1bqn n LYS 20 Cb 0.28 -2.15 0.13 0.00 -0.02 0.00 0.00 35.03 33.27 1bqn n LYS 20 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1bqn s VAL 21 N -4.46 2.76 -0.08 -0.18 1.01 -1.26 -4.84 120.40 113.35 1bqn s VAL 21 Ca 0.47 0.25 0.01 0.00 0.00 0.00 0.00 61.98 62.70 1bqn s VAL 21 Cb 0.32 -2.79 -0.03 0.00 0.00 0.00 0.00 36.38 33.89 1bqn s VAL 21 CO -0.14 -0.32 -0.09 -0.54 0.00 0.00 0.00 175.10 174.01 1bqn s LYS 22 N -4.98 2.89 -0.22 2.72 -0.14 -1.26 -4.46 119.74 114.29 1bqn s LYS 22 Ca 0.63 -0.59 -0.27 0.00 -1.36 0.00 0.00 55.97 54.38 1bqn s LYS 22 Cb -0.17 -2.59 0.00 0.00 -1.68 0.00 0.00 37.83 33.39 1bqn s LYS 22 CO 0.56 0.55 0.94 -1.14 -0.76 0.00 0.00 175.35 175.50 1bqn s GLN 23 N -0.52 4.25 0.10 1.68 2.00 -1.26 -4.74 119.66 121.16 1bqn s GLN 23 Ca 0.08 1.17 -0.31 0.00 -2.00 0.00 0.00 55.36 54.29 1bqn s GLN 23 Cb -0.12 -3.63 -0.09 0.00 0.80 0.00 0.00 33.01 29.98 1bqn s GLN 23 CO 0.02 -0.54 1.60 -1.58 -0.50 0.00 0.00 175.29 174.29 1bqn s TRP 24 N 2.88 2.70 0.77 1.67 0.52 -1.26 -4.95 118.94 121.27 1bqn s TRP 24 Ca 0.40 0.48 -0.12 0.00 0.02 0.00 0.00 56.10 56.89 1bqn s TRP 24 Cb -0.15 -3.92 0.06 0.00 -1.15 0.00 0.00 33.47 28.31 1bqn s TRP 24 CO 0.08 -3.56 1.11 -1.25 0.02 0.00 0.00 176.95 173.35 1bqn s PRO 25 N 2.06 2.13 0.33 4.98 0.04 -1.26 -4.94 135.00 138.33 1bqn s PRO 25 Ca 0.72 1.32 -0.00 0.00 0.04 0.00 0.00 61.00 63.08 1bqn s PRO 25 Cb -0.40 -1.87 -0.01 0.00 0.04 0.00 0.00 34.50 32.26 1bqn s PRO 25 CO 0.31 -1.76 0.40 -0.48 0.04 0.00 0.00 177.00 175.52 1bqn s LEU 26 N -5.79 1.19 0.82 -3.56 0.05 -1.26 -5.13 118.68 105.00 1bqn s LEU 26 Ca 0.64 -1.53 -0.15 0.00 0.05 0.00 0.00 54.13 53.14 1bqn s LEU 26 Cb -0.20 1.18 -0.03 0.00 -2.05 0.00 0.00 46.19 45.09 1bqn s LEU 26 CO 0.53 -1.20 0.31 0.41 -0.55 0.00 0.00 176.35 175.85 1bqn n THR 27 N -0.56 0.89 0.01 5.48 -1.04 -1.26 -4.68 114.28 113.12 1bqn n THR 27 Ca 0.03 -0.34 -0.19 0.00 -2.04 0.00 0.00 64.05 61.51 1bqn n THR 27 Cb 0.62 -0.59 -0.14 0.00 -1.82 0.00 0.00 70.33 68.40 1bqn n THR 27 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 1bqn h GLU 28 N -0.84 0.21 -0.78 -2.82 4.81 -2.00 0.95 114.58 114.11 1bqn h GLU 28 Ca -0.44 -0.36 0.16 0.00 -0.13 0.00 0.00 59.36 58.58 1bqn h GLU 28 Cb 1.32 0.13 -0.15 0.00 0.63 0.00 0.00 28.75 30.69 1bqn h GLU 28 CO 0.38 1.17 -0.20 1.49 -0.73 0.00 0.00 179.01 181.12 1bqn h GLU 29 N -0.54 -0.00 -0.15 1.92 4.81 -1.99 0.55 114.58 119.17 1bqn h GLU 29 Ca -0.12 0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 58.91 1bqn h GLU 29 Cb 1.48 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.87 1bqn h GLU 29 CO 0.10 -0.00 -0.69 0.87 -0.73 0.00 0.00 179.01 178.56 1bqn h LYS 30 N -0.00 0.73 -0.07 1.92 1.57 -1.91 -1.85 116.57 116.95 1bqn h LYS 30 Ca 0.37 -0.58 0.02 0.00 -1.87 0.00 0.00 60.65 58.59 1bqn h LYS 30 Cb 0.57 0.12 -0.00 0.00 0.08 0.00 0.00 32.23 33.00 1bqn h LYS 30 CO -0.81 1.20 0.13 0.82 -0.57 0.00 0.00 179.45 180.22 1bqn h ILE 31 N 0.44 0.28 0.18 1.86 2.04 0.51 -1.35 117.51 121.46 1bqn h ILE 31 Ca -0.04 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.81 1bqn h ILE 31 Cb 1.32 0.88 0.00 0.00 -0.74 0.00 0.00 36.82 38.28 1bqn h ILE 31 CO 0.14 0.00 -0.09 0.11 0.00 0.00 0.00 178.15 178.32 1bqn h LYS 32 N 0.00 -0.23 -1.94 2.37 1.57 0.09 -3.31 116.57 115.11 1bqn h LYS 32 Ca 0.04 0.02 0.56 0.00 -1.87 0.00 0.00 60.65 59.40 1bqn h LYS 32 Cb 0.30 0.05 -0.08 0.00 0.08 0.00 0.00 32.23 32.59 1bqn h LYS 32 CO -0.00 -0.16 1.42 0.00 -0.57 0.00 0.00 179.45 180.14 1bqn n ALA 33 N -2.76 1.87 0.31 3.86 0.00 -0.57 0.34 120.51 123.56 1bqn n ALA 33 Ca -0.03 0.64 0.12 0.00 0.00 0.00 0.00 53.44 54.17 1bqn n ALA 33 Cb 0.10 -1.12 0.15 0.00 0.00 0.00 0.00 19.45 18.57 1bqn n ALA 33 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1bqn h LEU 34 N 0.00 0.00 0.16 0.00 3.38 -1.49 -2.83 115.31 114.53 1bqn h LEU 34 Ca 0.92 -0.04 -0.34 0.00 0.09 0.00 0.00 57.88 58.51 1bqn h LEU 34 Cb 3.75 0.00 0.00 0.00 0.09 0.00 0.00 40.66 44.50 1bqn h LEU 34 CO -0.01 0.02 -1.76 0.58 0.09 0.00 0.00 178.44 177.36 1bqn h VAL 35 N 0.00 0.87 0.00 1.22 2.07 -0.22 -0.66 116.25 119.53 1bqn h VAL 35 Ca 0.00 -2.45 0.00 0.00 0.82 0.00 0.00 66.70 65.07 1bqn h VAL 35 Cb 0.91 2.69 0.00 0.00 -1.52 0.00 0.00 31.29 33.37 1bqn h VAL 35 CO 0.00 0.84 0.00 1.21 0.02 0.00 0.00 177.57 179.65 1bqn n GLU 36 N -3.63 0.11 -0.06 1.57 2.13 -0.73 -1.96 120.64 118.08 1bqn n GLU 36 Ca -0.27 0.60 -0.06 0.00 0.66 0.00 0.00 57.16 58.09 1bqn n GLU 36 Cb 1.04 -1.86 -0.02 0.00 0.27 0.00 0.00 31.44 30.87 1bqn n GLU 36 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 1bqn n ILE 37 N -2.08 1.27 0.22 6.31 5.41 -1.07 -4.51 119.36 124.92 1bqn n ILE 37 Ca -0.01 0.22 0.18 0.00 1.00 0.00 0.00 62.75 64.14 1bqn n ILE 37 Cb 0.03 -2.11 0.82 0.00 -0.71 0.00 0.00 39.64 37.67 1bqn n ILE 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1bqn h THR 39 N 0.00 1.18 0.00 0.00 2.02 -1.63 -1.53 112.91 112.95 1bqn h THR 39 Ca 0.09 -2.35 -0.00 0.00 0.77 0.00 0.00 66.41 64.92 1bqn h THR 39 Cb 0.74 2.76 -0.00 0.00 -1.74 0.00 0.00 68.15 69.91 1bqn h THR 39 CO -0.00 0.59 -0.01 -0.33 0.37 0.00 0.00 175.52 176.14 1bqn h GLU 40 N -0.61 0.00 0.00 6.66 5.08 -1.66 0.29 114.58 124.34 1bqn h GLU 40 Ca -0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 1bqn h GLU 40 Cb 1.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.75 1bqn h GLU 40 CO -0.01 0.01 -0.85 -0.12 -1.00 0.00 0.00 179.01 177.04 1bqn n MET 41 N -3.86 0.02 0.03 2.33 0.00 -0.92 -2.45 117.12 112.26 1bqn n MET 41 Ca -0.03 -0.00 -0.04 0.00 0.00 0.00 0.00 57.70 57.63 1bqn n MET 41 Cb 0.09 -1.50 -0.10 0.00 0.00 0.00 0.00 33.22 31.71 1bqn n MET 41 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 175.97 177.46 1bqn h GLU 42 N 0.00 0.00 0.68 2.12 4.81 0.52 -2.72 114.58 119.99 1bqn h GLU 42 Ca 0.00 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 1bqn h GLU 42 Cb 0.51 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.90 1bqn h GLU 42 CO 0.00 0.49 -0.33 0.87 -0.73 0.00 0.00 179.01 179.31 1bqn h LYS 43 N 0.00 -0.88 0.00 1.92 1.57 -0.77 -3.14 116.57 115.26 1bqn h LYS 43 Ca -0.17 0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 1bqn h LYS 43 Cb 1.75 0.20 0.00 0.00 0.08 0.00 0.00 32.23 34.26 1bqn h LYS 43 CO 0.07 -0.59 0.00 0.39 -0.57 0.00 0.00 179.45 178.75 1bqn n GLU 44 N -4.87 0.00 -0.58 3.15 1.02 -1.03 -4.68 120.64 113.66 1bqn n GLU 44 Ca -0.11 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.03 1bqn n GLU 44 Cb 0.36 -0.90 0.00 0.00 -0.02 0.00 0.00 31.44 30.88 1bqn n GLU 44 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1bqn n GLY 45 N 0.01 0.14 0.18 0.62 0.00 -1.19 -4.84 105.19 100.12 1bqn n GLY 45 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1bqn n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bqn h LYS 46 N 0.43 -0.35 -6.06 1.61 1.57 -1.73 -3.44 116.57 108.60 1bqn h LYS 46 Ca 0.00 0.02 -0.56 0.00 -1.87 0.00 0.00 60.65 58.25 1bqn h LYS 46 Cb 0.01 0.08 -0.09 0.00 0.08 0.00 0.00 32.23 32.32 1bqn h LYS 46 CO 0.00 -0.01 -0.56 0.96 -0.57 0.00 0.00 179.45 179.27 1bqn s ILE 47 N -4.42 2.87 -0.16 1.86 -4.36 -1.06 -1.86 121.20 114.07 1bqn s ILE 47 Ca -0.14 -1.78 -0.22 0.00 -0.26 0.00 0.00 60.65 58.25 1bqn s ILE 47 Cb 0.02 -2.92 0.06 0.00 1.25 0.00 0.00 42.46 40.86 1bqn s ILE 47 CO 0.53 -0.18 0.58 -0.44 0.24 0.00 0.00 174.94 175.67 1bqn s SER 48 N -3.81 -0.58 0.51 4.36 0.01 -0.70 -4.59 113.70 108.91 1bqn s SER 48 Ca 0.37 0.97 -0.21 0.00 1.31 0.00 0.00 55.95 58.39 1bqn s SER 48 Cb -0.01 0.97 -0.07 0.00 0.21 0.00 0.00 66.02 67.11 1bqn s SER 48 CO 0.22 -0.32 1.12 -0.54 0.41 0.00 0.00 173.24 174.13 1bqn s LYS 49 N -0.19 3.53 0.27 12.44 1.02 -1.26 0.11 119.74 135.67 1bqn s LYS 49 Ca -0.04 1.61 0.06 0.00 0.02 0.00 0.00 55.97 57.62 1bqn s LYS 49 Cb -0.03 -2.13 -0.06 0.00 -0.52 0.00 0.00 37.83 35.09 1bqn s LYS 49 CO 0.03 -0.70 -0.05 0.42 -0.92 0.00 0.00 175.35 174.13 1bqn s ILE 50 N -1.74 1.52 0.00 2.17 1.09 -1.17 -4.78 121.20 118.28 1bqn s ILE 50 Ca 0.69 -2.10 0.00 0.00 -1.10 0.00 0.00 60.65 58.14 1bqn s ILE 50 Cb -0.24 -2.43 0.00 0.00 -1.06 0.00 0.00 42.46 38.73 1bqn s ILE 50 CO 0.28 -0.30 0.00 0.61 -0.10 0.00 0.00 174.94 175.42 1bqn n GLY 51 N -0.55 1.27 0.14 6.18 0.00 -1.26 -4.95 105.19 106.02 1bqn n GLY 51 Ca -0.05 -1.85 0.12 0.00 0.00 0.00 0.00 46.02 44.23 1bqn n GLY 51 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1bqn h PRO 52 N 0.00 0.00 0.00 1.61 0.13 -2.02 -3.33 132.00 128.39 1bqn h PRO 52 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1bqn h PRO 52 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1bqn h PRO 52 CO 0.00 0.00 0.06 0.39 -0.23 0.00 0.00 178.00 178.22 1bqn n GLU 53 N -2.73 0.00 -3.88 0.86 4.71 -1.26 -4.14 120.64 114.20 1bqn n GLU 53 Ca 0.02 0.27 -0.35 0.00 -0.01 0.00 0.00 57.16 57.09 1bqn n GLU 53 Cb 0.52 -1.56 -0.13 0.00 -1.01 0.00 0.00 31.44 29.27 1bqn n GLU 53 CO 0.00 0.00 0.00 1.21 0.09 0.00 0.00 177.13 178.43 1bqn s ASN 54 N -2.47 5.01 0.24 1.62 3.84 -1.25 -4.98 114.94 116.95 1bqn s ASN 54 Ca 0.00 -1.74 0.23 0.00 0.21 0.00 0.00 52.86 51.56 1bqn s ASN 54 Cb 0.00 -1.74 0.23 0.00 -0.55 0.00 0.00 41.25 39.19 1bqn s ASN 54 CO 0.00 -0.40 1.31 1.55 -2.79 0.00 0.00 177.10 176.77 1bqn h PRO 55 N 7.95 0.00 -6.67 0.43 0.13 -1.92 -3.48 132.00 128.44 1bqn h PRO 55 Ca -0.15 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.42 1bqn h PRO 55 Cb 1.05 0.00 0.18 0.00 0.13 0.00 0.00 31.00 32.36 1bqn h PRO 55 CO 0.60 0.00 -0.28 0.66 -0.23 0.00 0.00 178.00 178.75 1bqn n TYR 56 N -2.61 -0.42 -4.19 1.56 4.01 -1.26 -4.92 117.16 109.32 1bqn n TYR 56 Ca 0.02 0.39 -0.17 0.00 -0.16 0.00 0.00 57.90 57.98 1bqn n TYR 56 Cb 0.51 -1.97 -0.06 0.00 -0.31 0.00 0.00 39.34 37.51 1bqn n TYR 56 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1bqn s ASN 57 N -1.39 1.33 0.00 7.72 3.84 -0.41 -4.74 114.94 121.29 1bqn s ASN 57 Ca 0.69 -1.64 0.00 0.00 0.21 0.00 0.00 52.86 52.12 1bqn s ASN 57 Cb -0.38 0.61 0.00 0.00 -0.55 0.00 0.00 41.25 40.93 1bqn s ASN 57 CO 0.55 -1.18 0.00 0.41 -2.79 0.00 0.00 177.10 174.09 1bqn n THR 58 N -0.60 0.00 -1.63 -5.21 -1.04 -1.15 -4.18 114.28 100.48 1bqn n THR 58 Ca 0.04 0.00 -0.40 0.00 -2.04 0.00 0.00 64.05 61.66 1bqn n THR 58 Cb 0.62 0.00 0.03 0.00 -1.82 0.00 0.00 70.33 69.16 1bqn n THR 58 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1bqn n PRO 59 N -0.03 1.29 -3.87 -2.82 -0.02 -1.26 -3.99 135.00 124.31 1bqn n PRO 59 Ca 0.00 0.47 -0.14 0.00 -2.02 0.00 0.00 63.50 61.81 1bqn n PRO 59 Cb 0.00 -2.16 -0.15 0.00 -0.02 0.00 0.00 33.50 31.17 1bqn n PRO 59 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1bqn s VAL 60 N -1.36 0.04 0.00 -1.45 1.01 -1.26 -2.58 120.40 114.80 1bqn s VAL 60 Ca 0.68 0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.72 1bqn s VAL 60 Cb -0.49 -0.10 0.00 0.00 0.00 0.00 0.00 36.38 35.79 1bqn s VAL 60 CO 0.53 0.06 0.00 0.49 0.00 0.00 0.00 175.10 176.18 1bqn n PHE 61 N 3.59 0.00 -3.15 5.22 3.72 -0.14 -4.95 117.46 121.75 1bqn n PHE 61 Ca -0.20 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.26 1bqn n PHE 61 Cb 0.55 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.07 1bqn n PHE 61 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1bqn s ALA 62 N -2.07 -3.65 0.49 4.37 0.00 -1.26 -4.46 121.76 115.19 1bqn s ALA 62 Ca 0.00 1.37 0.01 0.00 0.00 0.00 0.00 51.96 53.34 1bqn s ALA 62 Cb 0.00 -2.56 0.01 0.00 0.00 0.00 0.00 23.12 20.57 1bqn s ALA 62 CO 0.00 -1.50 0.09 -0.89 0.00 0.00 0.00 175.76 173.46 1bqn n ILE 63 N 5.47 0.00 -3.59 0.00 5.41 -0.62 -4.89 119.36 121.14 1bqn n ILE 63 Ca -0.08 -2.23 -0.29 0.00 1.00 0.00 0.00 62.75 61.15 1bqn n ILE 63 Cb 0.54 0.34 -0.15 0.00 -0.71 0.00 0.00 39.64 39.66 1bqn n ILE 63 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 1bqn s LYS 64 N -3.83 0.35 -0.00 0.38 1.02 -1.26 0.50 119.74 116.90 1bqn s LYS 64 Ca 0.07 -0.71 -0.01 0.00 0.02 0.00 0.00 55.97 55.34 1bqn s LYS 64 Cb -0.01 -1.39 -0.01 0.00 -0.52 0.00 0.00 37.83 35.90 1bqn s LYS 64 CO 0.04 -1.02 0.37 1.57 -0.92 0.00 0.00 175.35 175.40 1bqn h LYS 65 N 8.27 -0.04 0.00 1.68 2.10 -1.91 -3.38 116.57 123.28 1bqn h LYS 65 Ca -0.17 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.48 1bqn h LYS 65 Cb 1.01 0.01 -0.00 0.00 -0.90 0.00 0.00 32.23 32.35 1bqn h LYS 65 CO 0.44 -0.03 -0.01 0.87 -2.00 0.00 0.00 179.45 178.73 1bqn h LYS 66 N -0.10 0.00 0.00 0.07 1.79 -1.93 -3.47 116.57 112.94 1bqn h LYS 66 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1bqn h LYS 66 Cb 0.03 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.68 1bqn h LYS 66 CO 0.01 0.01 0.00 -3.47 -1.08 0.00 0.00 179.45 174.92 1bqn n ASP 67 N -3.12 0.00 -4.28 0.86 2.03 -1.26 -4.63 116.55 106.15 1bqn n ASP 67 Ca -0.01 0.00 -0.39 0.00 0.52 0.00 0.00 54.79 54.91 1bqn n ASP 67 Cb 0.22 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.51 1bqn n ASP 67 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1bqn s SER 68 N -4.00 5.55 0.22 1.67 1.04 -1.26 -4.70 113.70 112.21 1bqn s SER 68 Ca 0.00 -1.32 0.00 0.00 0.48 0.00 0.00 55.95 55.11 1bqn s SER 68 Cb 0.00 -1.95 0.00 0.00 0.10 0.00 0.00 66.02 64.17 1bqn s SER 68 CO 0.00 -0.45 0.00 0.35 0.98 0.00 0.00 173.24 174.12 1bqn n THR 69 N 4.89 0.00 -4.16 2.02 -2.24 -1.26 -5.15 114.28 108.38 1bqn n THR 69 Ca -0.11 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.57 1bqn n THR 69 Cb 0.44 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.57 1bqn n THR 69 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1bqn s LYS 70 N -2.00 0.80 0.66 -0.78 0.00 -1.26 -5.16 119.74 111.99 1bqn s LYS 70 Ca 0.00 -1.29 -0.08 0.00 0.00 0.00 0.00 55.97 54.60 1bqn s LYS 70 Cb 0.00 -0.18 0.02 0.00 0.00 0.00 0.00 37.83 37.67 1bqn s LYS 70 CO 0.00 -0.02 1.00 -1.58 0.00 0.00 0.00 175.35 174.75 1bqn s TRP 71 N -3.49 3.22 0.08 1.78 0.52 -1.26 -4.52 118.94 115.26 1bqn s TRP 71 Ca 0.10 0.76 0.06 0.00 0.02 0.00 0.00 56.10 57.04 1bqn s TRP 71 Cb 0.04 -2.95 -0.03 0.00 -1.15 0.00 0.00 33.47 29.38 1bqn s TRP 71 CO -0.05 -1.07 -0.16 1.03 0.02 0.00 0.00 176.95 176.72 1bqn s ARG 72 N -5.18 0.89 0.45 4.98 1.81 0.18 -4.89 118.95 117.19 1bqn s ARG 72 Ca 0.57 -1.01 0.06 0.00 -1.72 0.00 0.00 55.73 53.63 1bqn s ARG 72 Cb -0.11 -0.94 0.02 0.00 -0.45 0.00 0.00 34.95 33.47 1bqn s ARG 72 CO 0.47 0.21 0.62 0.21 -0.68 0.00 0.00 175.30 176.14 1bqn s LYS 73 N -1.81 2.75 -0.19 3.54 2.20 -1.26 -1.59 119.74 123.38 1bqn s LYS 73 Ca 0.00 -1.14 -0.28 0.00 -0.36 0.00 0.00 55.97 54.18 1bqn s LYS 73 Cb -0.10 -2.70 0.11 0.00 -1.51 0.00 0.00 37.83 33.64 1bqn s LYS 73 CO 0.03 -0.38 0.95 -1.17 -0.36 0.00 0.00 175.35 174.42 1bqn s LEU 74 N -4.45 -0.45 0.01 5.43 2.96 -1.26 -4.79 118.68 116.12 1bqn s LEU 74 Ca 0.56 0.64 0.00 0.00 -0.22 0.00 0.00 54.13 55.10 1bqn s LEU 74 Cb -0.10 1.99 -0.01 0.00 0.50 0.00 0.00 46.19 48.58 1bqn s LEU 74 CO 0.34 -0.32 -0.02 0.68 -1.32 0.00 0.00 176.35 175.72 1bqn s VAL 75 N -0.65 0.09 -1.17 1.68 -7.23 -1.26 -0.97 120.40 110.89 1bqn s VAL 75 Ca -0.01 -0.27 -0.08 0.00 -1.81 0.00 0.00 61.98 59.81 1bqn s VAL 75 Cb -0.02 -0.13 0.24 0.00 0.56 0.00 0.00 36.38 37.03 1bqn s VAL 75 CO 0.00 -0.11 1.57 -0.67 -0.31 0.00 0.00 175.10 175.58 1bqn n ASP 76 N 2.67 5.68 0.00 4.85 2.03 -1.07 -4.74 116.55 125.97 1bqn n ASP 76 Ca -0.15 -3.20 0.04 0.00 0.52 0.00 0.00 54.79 52.00 1bqn n ASP 76 Cb 0.58 -1.40 0.24 0.00 -0.72 0.00 0.00 41.12 39.82 1bqn n ASP 76 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1bqn n PHE 77 N 2.96 0.00 0.16 -0.67 3.72 -1.26 -4.16 117.46 118.22 1bqn n PHE 77 Ca 0.32 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.83 1bqn n PHE 77 Cb 0.36 0.00 0.25 0.00 -0.94 0.00 0.00 39.48 39.15 1bqn n PHE 77 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1bqn h ARG 78 N 0.00 0.00 0.00 -1.08 3.08 -1.91 0.92 114.38 115.39 1bqn h ARG 78 Ca 0.00 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.82 1bqn h ARG 78 Cb 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.01 1bqn h ARG 78 CO 0.00 0.00 -1.84 -1.91 -1.07 0.00 0.00 179.97 175.15 1bqn n GLU 79 N -2.81 0.65 -0.05 0.04 4.07 -1.26 -2.99 120.64 118.28 1bqn n GLU 79 Ca 0.07 0.11 -0.14 0.00 -0.06 0.00 0.00 57.16 57.13 1bqn n GLU 79 Cb 1.07 -1.68 -0.07 0.00 -0.06 0.00 0.00 31.44 30.70 1bqn n GLU 79 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 1bqn h LEU 80 N 0.00 0.54 0.24 4.31 5.85 0.52 0.73 115.31 127.49 1bqn h LEU 80 Ca -0.28 -0.57 -0.01 0.00 0.84 0.00 0.00 57.88 57.86 1bqn h LEU 80 Cb 1.78 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.66 1bqn h LEU 80 CO 0.04 1.01 -0.11 0.78 -0.34 0.00 0.00 178.44 179.81 1bqn h ASN 81 N 0.09 -0.27 0.00 1.25 4.21 -1.51 0.66 115.58 120.00 1bqn h ASN 81 Ca -0.00 -0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1bqn h ASN 81 Cb 0.93 0.07 0.00 0.00 -1.12 0.00 0.00 38.32 38.20 1bqn h ASN 81 CO 0.07 -0.18 0.11 0.29 -1.29 0.00 0.00 177.43 176.43 1bqn n LYS 82 N -5.22 0.05 0.00 0.81 5.02 -1.16 -2.02 118.16 115.63 1bqn n LYS 82 Ca -0.09 0.49 0.00 0.00 -2.02 0.00 0.00 58.31 56.69 1bqn n LYS 82 Cb 0.15 -1.78 0.00 0.00 -0.02 0.00 0.00 35.03 33.38 1bqn n LYS 82 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1bqn n ARG 83 N -1.74 0.00 0.31 1.97 5.12 0.84 -4.88 116.66 118.28 1bqn n ARG 83 Ca -0.01 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.78 1bqn n ARG 83 Cb 0.13 -0.05 -0.07 0.00 -1.16 0.00 0.00 32.46 31.31 1bqn n ARG 83 CO 0.00 0.00 0.00 1.79 -1.93 0.00 0.00 177.63 177.49 1bqn h THR 84 N 0.00 0.00 0.00 0.55 1.35 0.35 -3.33 112.91 111.83 1bqn h THR 84 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1bqn h THR 84 Cb 0.00 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.42 1bqn h THR 84 CO 0.00 0.00 0.00 1.67 -0.25 0.00 0.00 175.52 176.94 1bqn n GLN 85 N -4.46 0.00 -0.55 4.72 0.00 -0.86 -0.89 117.38 115.34 1bqn n GLN 85 Ca -0.10 0.00 0.03 0.00 -0.00 0.00 0.00 57.00 56.93 1bqn n GLN 85 Cb 0.34 -0.94 0.22 0.00 0.00 0.00 0.00 30.24 29.86 1bqn n GLN 85 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 1bqn n ASP 86 N -0.13 3.08 0.00 1.69 2.03 -1.25 -3.59 116.55 118.38 1bqn n ASP 86 Ca 0.00 -3.36 0.00 0.00 0.52 0.00 0.00 54.79 51.95 1bqn n ASP 86 Cb 0.00 -0.57 0.00 0.00 -0.72 0.00 0.00 41.12 39.83 1bqn n ASP 86 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 1bqn n PHE 87 N -0.89 0.00 -0.91 -0.67 7.35 -0.07 -4.77 117.46 117.50 1bqn n PHE 87 Ca 0.26 0.00 -0.17 0.00 -0.76 0.00 0.00 57.45 56.78 1bqn n PHE 87 Cb 0.92 0.00 0.19 0.00 0.35 0.00 0.00 39.48 40.94 1bqn n PHE 87 CO 0.00 0.00 0.00 0.91 -0.76 0.00 0.00 176.76 176.91 1bqn n TRP 88 N -0.60 2.57 -0.01 -5.13 7.02 -1.12 -0.44 117.44 119.73 1bqn n TRP 88 Ca 0.00 -1.53 0.01 0.00 -1.02 0.00 0.00 57.50 54.96 1bqn n TRP 88 Cb 0.01 -0.80 -0.04 0.00 -2.42 0.00 0.00 31.31 28.05 1bqn n TRP 88 CO 0.00 0.00 0.00 -1.91 -2.02 0.00 0.00 177.69 173.76 1bqn n GLU 89 N -0.72 1.37 0.00 -0.99 2.13 -1.24 -4.13 120.64 117.06 1bqn n GLU 89 Ca 0.48 -0.03 0.00 0.00 0.66 0.00 0.00 57.16 58.27 1bqn n GLU 89 Cb 1.47 -1.14 0.00 0.00 0.27 0.00 0.00 31.44 32.04 1bqn n GLU 89 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1bqn n VAL 90 N -1.91 0.00 -0.33 6.31 0.31 -0.81 -3.50 118.33 118.40 1bqn n VAL 90 Ca -0.04 0.00 0.29 0.00 -0.01 0.00 0.00 64.34 64.58 1bqn n VAL 90 Cb 0.37 -0.81 0.55 0.00 -0.91 0.00 0.00 33.84 33.04 1bqn n VAL 90 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 1bqn h GLN 91 N 0.00 0.12 -2.10 5.55 4.20 -1.06 -0.90 115.11 120.92 1bqn h GLN 91 Ca 0.00 -0.01 -0.56 0.00 0.06 0.00 0.00 58.65 58.14 1bqn h GLN 91 Cb 0.00 -0.03 -0.40 0.00 0.30 0.00 0.00 27.48 27.35 1bqn h GLN 91 CO 0.00 0.08 -0.90 -0.11 -0.67 0.00 0.00 178.83 177.23 1bqn n LEU 92 N -5.17 1.96 -4.80 1.46 -0.00 -1.26 -5.02 117.00 104.17 1bqn n LEU 92 Ca 0.36 -5.11 -0.30 0.00 -0.00 0.00 0.00 56.01 50.96 1bqn n LEU 92 Cb 1.19 0.09 0.08 0.00 -0.00 0.00 0.00 43.42 44.78 1bqn n LEU 92 CO 0.05 2.14 0.71 -0.83 -0.00 0.00 0.00 177.39 179.45 1bqn s GLY 93 N -2.08 1.64 -0.20 -3.96 0.00 -0.34 -4.14 107.32 98.24 1bqn s GLY 93 Ca 0.39 -0.09 -0.04 0.00 0.00 0.00 0.00 44.72 44.98 1bqn s GLY 93 CO -0.08 0.31 0.13 -0.42 0.00 0.00 0.00 173.10 173.04 1bqn s ILE 94 N -3.09 -0.15 0.35 0.90 1.01 -1.26 -5.02 121.20 113.93 1bqn s ILE 94 Ca 0.60 -0.23 -0.27 0.00 0.00 0.00 0.00 60.65 60.75 1bqn s ILE 94 Cb -0.15 -0.66 -0.09 0.00 0.01 0.00 0.00 42.46 41.57 1bqn s ILE 94 CO 0.55 -0.32 1.23 -2.84 0.00 0.00 0.00 174.94 173.56 1bqn s PRO 95 N 2.19 4.25 -0.49 2.79 0.02 -1.26 -5.04 135.00 137.45 1bqn s PRO 95 Ca 0.04 2.03 -0.23 0.00 0.02 0.00 0.00 61.00 62.86 1bqn s PRO 95 Cb -0.16 -2.93 0.04 0.00 0.02 0.00 0.00 34.50 31.47 1bqn s PRO 95 CO -0.14 -0.21 0.83 -1.58 -0.33 0.00 0.00 177.00 175.57 1bqn s HIS 96 N -1.24 2.92 -0.90 6.54 2.46 -1.26 -4.93 115.29 118.88 1bqn s HIS 96 Ca 0.52 0.02 -0.25 0.00 0.47 0.00 0.00 55.06 55.82 1bqn s HIS 96 Cb -0.36 -3.81 -0.07 0.00 -0.13 0.00 0.00 32.58 28.21 1bqn s HIS 96 CO 0.46 -1.13 2.04 -1.25 -2.47 0.00 0.00 174.74 172.39 1bqn s PRO 97 N 3.47 2.35 0.00 2.88 0.04 -1.26 -4.86 135.00 137.63 1bqn s PRO 97 Ca 0.28 -0.18 0.00 0.00 0.04 0.00 0.00 61.00 61.14 1bqn s PRO 97 Cb -0.13 -5.02 0.00 0.00 0.04 0.00 0.00 34.50 29.39 1bqn s PRO 97 CO 0.20 -3.64 0.26 0.00 0.04 0.00 0.00 177.00 173.86 1bqn n ALA 98 N 14.96 1.11 1.04 8.56 0.00 -1.26 0.58 120.51 145.50 1bqn n ALA 98 Ca 0.42 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.98 1bqn n ALA 98 Cb 0.46 -0.74 0.12 0.00 0.00 0.00 0.00 19.45 19.29 1bqn n ALA 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bqn n GLY 99 N -0.72 0.78 0.40 0.00 0.00 -1.26 -4.31 105.19 100.09 1bqn n GLY 99 Ca 0.00 -0.66 -0.12 0.00 0.00 0.00 0.00 46.02 45.24 1bqn n GLY 99 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1bqn h LEU 100 N 4.21 -1.39 -0.90 0.99 5.85 -0.15 0.65 115.31 124.56 1bqn h LEU 100 Ca 0.00 0.19 -0.05 0.00 0.84 0.00 0.00 57.88 58.86 1bqn h LEU 100 Cb 0.93 0.58 -0.03 0.00 0.37 0.00 0.00 40.66 42.50 1bqn h LEU 100 CO 0.00 -0.41 0.20 0.07 -0.34 0.00 0.00 178.44 177.95 1bqn h LYS 101 N -0.44 1.00 0.00 1.25 2.10 -1.75 -2.87 116.57 115.86 1bqn h LYS 101 Ca 0.09 -0.20 0.00 0.00 -2.00 0.00 0.00 60.65 58.54 1bqn h LYS 101 Cb 0.62 -0.15 0.00 0.00 -0.90 0.00 0.00 32.23 31.79 1bqn h LYS 101 CO -0.46 0.86 0.13 0.87 -2.00 0.00 0.00 179.45 178.85 1bqn h LYS 102 N 0.97 0.00 -6.94 0.07 1.79 -1.09 -3.42 116.57 107.94 1bqn h LYS 102 Ca 0.21 0.00 -0.48 0.00 -2.18 0.00 0.00 60.65 58.20 1bqn h LYS 102 Cb 0.29 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.93 1bqn h LYS 102 CO -0.01 0.00 0.22 0.15 -1.08 0.00 0.00 179.45 178.73 1bqn s LYS 103 N -3.51 3.95 0.14 3.15 -0.14 -1.01 -4.91 119.74 117.41 1bqn s LYS 103 Ca -0.02 0.75 -0.21 0.00 -1.36 0.00 0.00 55.97 55.13 1bqn s LYS 103 Cb 0.06 -2.30 -0.00 0.00 -1.68 0.00 0.00 37.83 33.90 1bqn s LYS 103 CO 0.18 -0.05 1.68 -0.22 -0.76 0.00 0.00 175.35 176.17 1bqn h LYS 104 N 1.51 -0.11 -2.99 1.68 3.64 -1.64 -3.37 116.57 115.28 1bqn h LYS 104 Ca -0.47 0.01 -0.19 0.00 -1.27 0.00 0.00 60.65 58.72 1bqn h LYS 104 Cb 1.18 0.02 -0.30 0.00 -0.41 0.00 0.00 32.23 32.73 1bqn h LYS 104 CO 0.63 -0.07 -0.47 -1.12 -2.27 0.00 0.00 179.45 176.14 1bqn s SER 105 N -5.12 -0.26 -0.24 4.20 0.01 -0.47 -3.56 113.70 108.26 1bqn s SER 105 Ca -0.14 0.55 -0.07 0.00 1.31 0.00 0.00 55.95 57.60 1bqn s SER 105 Cb 0.11 0.44 -0.03 0.00 0.21 0.00 0.00 66.02 66.75 1bqn s SER 105 CO 0.68 -0.17 0.06 -0.69 0.41 0.00 0.00 173.24 173.53 1bqn s VAL 106 N 1.31 4.25 0.35 3.43 1.01 0.11 -2.47 120.40 128.38 1bqn s VAL 106 Ca -0.09 -0.20 0.07 0.00 0.00 0.00 0.00 61.98 61.77 1bqn s VAL 106 Cb -0.10 -2.98 -0.02 0.00 0.00 0.00 0.00 36.38 33.28 1bqn s VAL 106 CO -0.09 0.36 0.34 -0.89 0.00 0.00 0.00 175.10 174.82 1bqn s THR 107 N 1.48 3.41 -0.04 3.92 2.01 -0.62 -0.79 115.64 125.02 1bqn s THR 107 Ca 0.06 -1.31 -0.05 0.00 0.31 0.00 0.00 61.69 60.70 1bqn s THR 107 Cb -0.15 -3.17 0.01 0.00 0.01 0.00 0.00 72.50 69.20 1bqn s THR 107 CO 0.03 -0.13 0.13 -0.69 -0.69 0.00 0.00 174.62 173.26 1bqn s VAL 108 N -2.32 0.02 0.02 3.82 1.01 -1.26 -1.38 120.40 120.31 1bqn s VAL 108 Ca 0.43 -0.20 0.05 0.00 0.00 0.00 0.00 61.98 62.26 1bqn s VAL 108 Cb -0.06 -0.25 -0.02 0.00 0.00 0.00 0.00 36.38 36.05 1bqn s VAL 108 CO 0.28 -0.11 -0.15 -0.76 0.00 0.00 0.00 175.10 174.36 1bqn s LEU 109 N -0.32 2.12 -1.22 3.92 1.43 -1.24 -4.72 118.68 118.65 1bqn s LEU 109 Ca -0.04 -0.39 -0.08 0.00 -1.03 0.00 0.00 54.13 52.59 1bqn s LEU 109 Cb -0.03 -0.67 -0.08 0.00 0.03 0.00 0.00 46.19 45.44 1bqn s LEU 109 CO 0.00 0.09 2.61 -0.67 0.23 0.00 0.00 176.35 178.61 1bqn n ASP 110 N 2.17 6.86 -3.79 2.29 2.03 -1.26 -3.32 116.55 121.53 1bqn n ASP 110 Ca -0.17 -2.45 -0.42 0.00 0.52 0.00 0.00 54.79 52.28 1bqn n ASP 110 Cb 0.55 -1.34 0.00 0.00 -0.72 0.00 0.00 41.12 39.61 1bqn n ASP 110 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1bqn n VAL 111 N 3.78 3.49 0.00 5.18 0.31 -1.13 -3.57 118.33 126.39 1bqn n VAL 111 Ca 0.61 -3.10 0.00 0.00 -0.01 0.00 0.00 64.34 61.85 1bqn n VAL 111 Cb 0.22 -2.59 0.00 0.00 -0.91 0.00 0.00 33.84 30.56 1bqn n VAL 111 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1bqn n GLY 112 N 4.19 0.34 0.25 2.92 0.00 -1.26 -4.57 105.19 107.07 1bqn n GLY 112 Ca 0.52 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.63 1bqn n GLY 112 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1bqn h ASP 113 N 0.00 0.00 0.00 1.61 3.32 -1.84 -3.16 116.42 116.36 1bqn h ASP 113 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1bqn h ASP 113 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1bqn h ASP 113 CO 0.00 0.13 0.21 0.00 -1.72 0.00 0.00 179.24 177.87 1bqn n ALA 114 N -2.39 0.63 -0.13 3.45 0.00 -1.26 -2.26 120.51 118.55 1bqn n ALA 114 Ca -0.02 0.03 0.09 0.00 0.00 0.00 0.00 53.44 53.54 1bqn n ALA 114 Cb 0.22 -0.68 0.22 0.00 0.00 0.00 0.00 19.45 19.21 1bqn n ALA 114 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1bqn n TYR 115 N -1.51 0.63 0.40 0.00 4.01 -1.19 -4.34 117.16 115.16 1bqn n TYR 115 Ca -0.00 -0.43 0.13 0.00 -0.16 0.00 0.00 57.90 57.45 1bqn n TYR 115 Cb 0.22 -0.01 0.47 0.00 -0.31 0.00 0.00 39.34 39.71 1bqn n TYR 115 CO 0.00 0.00 0.00 0.74 -0.46 0.00 0.00 176.86 177.14 1bqn h PHE 116 N 3.29 0.00 0.00 -0.72 0.04 -1.66 -3.03 116.94 114.86 1bqn h PHE 116 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1bqn h PHE 116 Cb 0.85 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.00 1bqn h PHE 116 CO 0.32 0.00 0.00 -1.13 -0.60 0.00 0.00 178.31 176.90 1bqn n SER 117 N -2.56 0.46 -4.65 2.17 3.41 -1.26 -4.66 113.62 106.53 1bqn n SER 117 Ca 0.03 0.54 -0.38 0.00 -0.26 0.00 0.00 58.87 58.80 1bqn n SER 117 Cb 0.34 -0.67 -0.08 0.00 -0.26 0.00 0.00 64.21 63.54 1bqn n SER 117 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1bqn s VAL 118 N -3.06 5.23 0.71 -3.33 1.01 -1.15 -4.94 120.40 114.88 1bqn s VAL 118 Ca 0.12 0.53 -0.14 0.00 0.00 0.00 0.00 61.98 62.49 1bqn s VAL 118 Cb 0.15 -3.66 0.03 0.00 0.00 0.00 0.00 36.38 32.90 1bqn s VAL 118 CO 0.56 0.25 1.14 -2.84 0.00 0.00 0.00 175.10 174.21 1bqn s PRO 119 N 1.48 2.41 0.10 2.72 0.02 -1.26 -2.73 135.00 137.74 1bqn s PRO 119 Ca 0.15 1.49 0.04 0.00 0.02 0.00 0.00 61.00 62.70 1bqn s PRO 119 Cb -0.15 -1.89 -0.04 0.00 0.02 0.00 0.00 34.50 32.44 1bqn s PRO 119 CO 0.08 -1.57 0.04 -1.17 -0.33 0.00 0.00 177.00 174.05 1bqn s LEU 120 N -5.19 3.60 -0.25 -5.54 2.96 -0.59 -4.70 118.68 108.97 1bqn s LEU 120 Ca 0.69 -0.14 -0.28 0.00 -0.22 0.00 0.00 54.13 54.17 1bqn s LEU 120 Cb -0.23 -2.29 -0.06 0.00 0.50 0.00 0.00 46.19 44.11 1bqn s LEU 120 CO 0.45 0.15 2.24 -0.90 -1.32 0.00 0.00 176.35 176.98 1bqn n ASP 121 N 0.37 3.11 -0.37 3.68 3.85 -1.26 -4.86 116.55 121.07 1bqn n ASP 121 Ca -0.10 0.15 0.01 0.00 -0.71 0.00 0.00 54.79 54.14 1bqn n ASP 121 Cb 0.52 -1.54 0.06 0.00 -1.35 0.00 0.00 41.12 38.82 1bqn n ASP 121 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.20 177.40 1bqn n GLU 122 N 8.76 -0.19 0.00 0.11 2.13 -1.26 0.69 120.64 130.88 1bqn n GLU 122 Ca 0.31 1.50 0.04 0.00 0.66 0.00 0.00 57.16 59.68 1bqn n GLU 122 Cb 0.44 -2.23 0.20 0.00 0.27 0.00 0.00 31.44 30.13 1bqn n GLU 122 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1bqn n ASP 123 N -5.47 0.00 -0.13 4.31 8.00 -1.26 -3.00 116.55 119.01 1bqn n ASP 123 Ca 0.11 0.44 -0.28 0.00 0.71 0.00 0.00 54.79 55.77 1bqn n ASP 123 Cb 0.41 -0.46 -0.10 0.00 -0.02 0.00 0.00 41.12 40.96 1bqn n ASP 123 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1bqn n PHE 124 N -1.46 0.00 0.00 1.24 7.35 0.22 -4.66 117.46 120.15 1bqn n PHE 124 Ca 0.03 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.72 1bqn n PHE 124 Cb 0.10 -0.95 0.00 0.00 0.35 0.00 0.00 39.48 38.99 1bqn n PHE 124 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1bqn n ARG 125 N -4.14 0.00 -0.08 -4.13 1.74 -0.73 -0.73 116.66 108.59 1bqn n ARG 125 Ca -0.52 0.00 0.25 0.00 -0.77 0.00 0.00 57.85 56.81 1bqn n ARG 125 Cb 0.87 0.00 0.72 0.00 -1.02 0.00 0.00 32.46 33.03 1bqn n ARG 125 CO 0.00 0.00 0.00 1.57 -1.52 0.00 0.00 177.63 177.68 1bqn h LYS 126 N 0.00 0.00 0.00 5.56 2.10 -1.83 0.31 116.57 122.71 1bqn h LYS 126 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1bqn h LYS 126 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1bqn h LYS 126 CO 0.00 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 178.11 1bqn n TYR 127 N -4.12 0.00 0.01 0.07 4.01 0.09 -3.03 117.16 114.19 1bqn n TYR 127 Ca 0.14 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.92 1bqn n TYR 127 Cb 0.82 0.00 0.09 0.00 -0.31 0.00 0.00 39.34 39.94 1bqn n TYR 127 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1bqn n THR 128 N -0.60 0.71 -1.67 -0.72 -2.24 0.11 -4.84 114.28 105.02 1bqn n THR 128 Ca 0.05 -0.85 -0.45 0.00 -2.27 0.00 0.00 64.05 60.53 1bqn n THR 128 Cb 0.02 0.70 -0.04 0.00 -2.10 0.00 0.00 70.33 68.92 1bqn n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bqn n ALA 129 N 0.34 1.47 -3.69 6.98 0.00 -1.17 -4.20 120.51 120.25 1bqn n ALA 129 Ca 0.08 0.28 -0.04 0.00 0.00 0.00 0.00 53.44 53.75 1bqn n ALA 129 Cb 0.34 -2.58 -0.00 0.00 0.00 0.00 0.00 19.45 17.21 1bqn n ALA 129 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 1bqn n PHE 130 N 6.50 -1.00 -3.67 0.00 -1.74 0.29 -2.91 117.46 114.92 1bqn n PHE 130 Ca 0.20 -0.32 -0.14 0.00 -0.56 0.00 0.00 57.45 56.63 1bqn n PHE 130 Cb 0.35 -0.06 -0.07 0.00 1.52 0.00 0.00 39.48 41.22 1bqn n PHE 130 CO 0.00 0.00 0.00 0.99 -0.56 0.00 0.00 176.76 177.19 1bqn s THR 131 N -0.58 0.04 -0.08 1.97 2.01 -1.26 -3.38 115.64 114.37 1bqn s THR 131 Ca 0.03 -0.34 0.03 0.00 0.31 0.00 0.00 61.69 61.72 1bqn s THR 131 Cb -0.00 -0.80 -0.01 0.00 0.01 0.00 0.00 72.50 71.69 1bqn s THR 131 CO 0.02 -0.19 -0.18 -0.63 -0.69 0.00 0.00 174.62 172.95 1bqn s ILE 132 N -1.59 2.63 0.65 1.82 1.01 0.20 -4.71 121.20 121.21 1bqn s ILE 132 Ca -0.11 -0.84 -0.16 0.00 0.00 0.00 0.00 60.65 59.54 1bqn s ILE 132 Cb -0.03 -2.04 -0.00 0.00 0.01 0.00 0.00 42.46 40.40 1bqn s ILE 132 CO 0.04 0.56 1.14 -2.16 0.00 0.00 0.00 174.94 174.52 1bqn s PRO 133 N -0.09 2.75 0.07 2.79 0.04 -1.26 -0.84 135.00 138.47 1bqn s PRO 133 Ca -0.04 1.53 0.07 0.00 0.04 0.00 0.00 61.00 62.60 1bqn s PRO 133 Cb -0.14 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.43 1bqn s PRO 133 CO 0.04 -1.31 -0.15 -1.54 0.04 0.00 0.00 177.00 174.08 1bqn s SER 134 N -2.29 4.03 0.37 6.66 1.04 -1.26 -4.81 113.70 117.45 1bqn s SER 134 Ca 0.70 -0.42 -0.27 0.00 0.48 0.00 0.00 55.95 56.44 1bqn s SER 134 Cb -0.23 -0.69 -0.09 0.00 0.10 0.00 0.00 66.02 65.11 1bqn s SER 134 CO 0.40 0.22 1.24 -0.63 0.98 0.00 0.00 173.24 175.44 1bqn s ILE 135 N -1.05 2.92 -1.59 -1.02 1.09 -1.26 -3.44 121.20 116.85 1bqn s ILE 135 Ca 0.17 0.84 -0.16 0.00 -1.10 0.00 0.00 60.65 60.40 1bqn s ILE 135 Cb -0.11 -3.50 0.13 0.00 -1.06 0.00 0.00 42.46 37.92 1bqn s ILE 135 CO 0.08 0.14 0.79 -3.20 -0.10 0.00 0.00 174.94 172.65 1bqn n ASN 136 N 0.39 -3.78 -2.51 3.58 5.15 -1.26 -2.50 115.26 114.33 1bqn n ASN 136 Ca 0.02 -0.84 -0.05 0.00 -0.60 0.00 0.00 54.58 53.11 1bqn n ASN 136 Cb 0.44 -3.08 -0.00 0.00 -0.53 0.00 0.00 39.78 36.61 1bqn n ASN 136 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1bqn n ASN 137 N -2.63 -1.99 0.00 1.20 5.15 -1.22 -4.87 115.26 110.90 1bqn n ASN 137 Ca 0.06 0.37 0.00 0.00 -0.60 0.00 0.00 54.58 54.41 1bqn n ASN 137 Cb 0.50 -1.79 0.00 0.00 -0.53 0.00 0.00 39.78 37.96 1bqn n ASN 137 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1bqn n GLU 138 N -2.63 0.00 -2.33 1.20 1.02 -1.04 -4.86 120.64 112.00 1bqn n GLU 138 Ca -0.05 0.00 -0.38 0.00 -0.02 0.00 0.00 57.16 56.71 1bqn n GLU 138 Cb 0.54 -0.61 -0.02 0.00 -0.02 0.00 0.00 31.44 31.32 1bqn n GLU 138 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1bqn s THR 139 N -0.35 3.22 0.09 2.62 2.01 -1.26 -4.98 115.64 116.99 1bqn s THR 139 Ca 0.00 1.03 -0.31 0.00 0.31 0.00 0.00 61.69 62.73 1bqn s THR 139 Cb 0.00 -3.58 -0.08 0.00 0.01 0.00 0.00 72.50 68.85 1bqn s THR 139 CO 0.00 0.10 1.45 -2.16 -0.69 0.00 0.00 174.62 173.32 1bqn s PRO 140 N -2.25 4.28 0.22 4.92 0.04 -1.26 -4.66 135.00 136.29 1bqn s PRO 140 Ca 0.56 2.13 -0.21 0.00 0.04 0.00 0.00 61.00 63.52 1bqn s PRO 140 Cb -0.30 -3.35 -0.14 0.00 0.04 0.00 0.00 34.50 30.75 1bqn s PRO 140 CO 0.38 -0.53 0.31 0.41 0.04 0.00 0.00 177.00 177.60 1bqn n GLY 141 N 3.63 -1.73 3.58 0.56 0.00 -1.26 -4.86 105.19 105.12 1bqn n GLY 141 Ca 0.13 0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.90 1bqn n GLY 141 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bqn s ILE 142 N -1.02 4.29 -0.31 -0.61 1.01 -0.02 -4.79 121.20 119.75 1bqn s ILE 142 Ca 0.51 0.97 -0.10 0.00 0.00 0.00 0.00 60.65 62.04 1bqn s ILE 142 Cb -0.68 -4.56 -0.01 0.00 0.01 0.00 0.00 42.46 37.22 1bqn s ILE 142 CO 0.48 -0.99 0.16 -0.60 0.00 0.00 0.00 174.94 173.99 1bqn s ARG 143 N 4.24 3.41 0.17 2.79 3.52 -1.26 0.61 118.95 132.43 1bqn s ARG 143 Ca 0.43 -0.67 0.10 0.00 -0.13 0.00 0.00 55.73 55.46 1bqn s ARG 143 Cb -0.08 -3.58 -0.04 0.00 -1.56 0.00 0.00 34.95 29.68 1bqn s ARG 143 CO 0.29 -0.39 -0.23 0.71 -0.81 0.00 0.00 175.30 174.87 1bqn s TYR 144 N 1.64 2.15 0.39 5.12 2.02 -1.22 -3.06 117.35 124.40 1bqn s TYR 144 Ca 0.05 -0.39 0.08 0.00 -0.37 0.00 0.00 57.07 56.44 1bqn s TYR 144 Cb -0.17 -1.09 -0.04 0.00 -0.40 0.00 0.00 41.96 40.26 1bqn s TYR 144 CO 0.07 0.42 0.25 -1.14 -1.57 0.00 0.00 175.55 173.58 1bqn s GLN 145 N -2.54 2.42 -0.25 -0.62 0.74 0.31 -0.55 119.66 119.17 1bqn s GLN 145 Ca 0.17 -1.61 -0.05 0.00 0.05 0.00 0.00 55.36 53.92 1bqn s GLN 145 Cb -0.08 -2.21 -0.01 0.00 1.10 0.00 0.00 33.01 31.81 1bqn s GLN 145 CO 0.08 -0.07 0.01 0.71 -0.55 0.00 0.00 175.29 175.47 1bqn s TYR 146 N -2.49 3.04 -0.03 1.67 2.02 -1.26 -1.71 117.35 118.59 1bqn s TYR 146 Ca 0.43 -0.90 0.00 0.00 -0.37 0.00 0.00 57.07 56.23 1bqn s TYR 146 Cb -0.01 -2.16 -0.26 0.00 -0.40 0.00 0.00 41.96 39.13 1bqn s TYR 146 CO 0.25 -0.53 0.72 -0.91 -1.57 0.00 0.00 175.55 173.51 1bqn h ASN 147 N 8.16 0.29 -1.81 2.29 2.35 -1.67 -3.44 115.58 121.75 1bqn h ASN 147 Ca -0.38 -0.48 0.00 0.00 -0.55 0.00 0.00 56.30 54.89 1bqn h ASN 147 Cb 1.15 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.43 1bqn h ASN 147 CO 0.60 1.41 0.00 1.33 -1.65 0.00 0.00 177.43 179.12 1bqn n VAL 148 N -3.36 0.00 -3.04 2.81 0.24 -1.20 -1.55 118.33 112.23 1bqn n VAL 148 Ca -0.19 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 61.69 1bqn n VAL 148 Cb 1.04 -0.83 -0.06 0.00 -1.47 0.00 0.00 33.84 32.52 1bqn n VAL 148 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1bqn s LEU 149 N 0.00 4.18 0.20 1.34 1.43 -1.11 -4.24 118.68 120.48 1bqn s LEU 149 Ca 0.00 0.31 -0.32 0.00 -1.03 0.00 0.00 54.13 53.08 1bqn s LEU 149 Cb 0.00 -2.90 -0.13 0.00 0.03 0.00 0.00 46.19 43.19 1bqn s LEU 149 CO 0.00 -0.63 1.62 -2.65 0.23 0.00 0.00 176.35 174.92 1bqn n PRO 150 N 6.16 2.44 0.28 1.29 -0.02 -1.26 -4.40 135.00 139.49 1bqn n PRO 150 Ca 0.01 0.88 0.19 0.00 -2.02 0.00 0.00 63.50 62.55 1bqn n PRO 150 Cb 0.48 -2.66 0.94 0.00 -0.02 0.00 0.00 33.50 32.24 1bqn n PRO 150 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1bqn h GLN 151 N 5.91 0.00 0.18 -0.52 4.15 -1.94 -3.24 115.11 119.65 1bqn h GLN 151 Ca -0.44 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 58.97 1bqn h GLN 151 Cb 1.23 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.92 1bqn h GLN 151 CO 0.89 0.00 -0.09 0.78 -1.93 0.00 0.00 178.83 178.48 1bqn h GLY 152 N 0.61 -0.25 -0.93 2.39 0.00 -1.89 -3.45 103.07 99.54 1bqn h GLY 152 Ca 0.00 0.09 -0.14 0.00 0.00 0.00 0.00 47.33 47.28 1bqn h GLY 152 CO 0.00 -0.09 -0.31 1.87 0.00 0.00 0.00 176.54 178.01 1bqn n TRP 153 N -3.65 -0.80 0.16 5.60 -0.00 -1.22 -4.91 117.44 112.61 1bqn n TRP 153 Ca -0.03 0.09 0.11 0.00 -0.00 0.00 0.00 57.50 57.67 1bqn n TRP 153 Cb 0.09 -0.40 -0.11 0.00 -0.00 0.00 0.00 31.31 30.89 1bqn n TRP 153 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 177.69 179.32 1bqn n LYS 154 N 0.41 0.56 0.00 5.87 5.02 -1.26 -4.05 118.16 124.71 1bqn n LYS 154 Ca 0.02 -0.10 0.14 0.00 -2.02 0.00 0.00 58.31 56.35 1bqn n LYS 154 Cb 0.12 -1.59 0.64 0.00 -0.02 0.00 0.00 35.03 34.18 1bqn n LYS 154 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1bqn n GLY 155 N 1.28 -1.35 0.00 0.72 0.00 -1.26 -4.10 105.19 100.47 1bqn n GLY 155 Ca -0.02 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1bqn n GLY 155 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1bqn n SER 156 N -1.37 0.00 0.03 1.61 7.64 -1.26 -3.28 113.62 116.99 1bqn n SER 156 Ca 0.10 0.60 0.02 0.00 1.01 0.00 0.00 58.87 60.60 1bqn n SER 156 Cb 0.30 -0.36 0.09 0.00 -1.01 0.00 0.00 64.21 63.23 1bqn n SER 156 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1bqn n PRO 157 N -1.57 0.02 0.36 1.43 -0.04 -1.26 0.91 135.00 134.85 1bqn n PRO 157 Ca 0.00 0.44 -0.16 0.00 -0.04 0.00 0.00 63.50 63.74 1bqn n PRO 157 Cb 0.00 -1.68 -0.08 0.00 -0.04 0.00 0.00 33.50 31.70 1bqn n PRO 157 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1bqn h ALA 158 N 1.61 -1.22 -0.66 0.55 0.00 -1.71 0.19 119.26 118.03 1bqn h ALA 158 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1bqn h ALA 158 Cb 0.21 0.50 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1bqn h ALA 158 CO 0.00 -1.17 0.00 -0.89 0.00 0.00 0.00 179.25 177.19 1bqn n ILE 159 N -4.92 0.00 0.00 0.00 5.41 0.26 -2.37 119.36 117.73 1bqn n ILE 159 Ca -0.12 1.39 0.00 0.00 1.00 0.00 0.00 62.75 65.02 1bqn n ILE 159 Cb 0.41 -2.34 0.00 0.00 -0.71 0.00 0.00 39.64 37.00 1bqn n ILE 159 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 176.55 176.88 1bqn n PHE 160 N -1.75 0.00 -0.20 1.39 -0.00 -0.98 -2.47 117.46 113.45 1bqn n PHE 160 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 57.45 57.34 1bqn n PHE 160 Cb 0.00 -0.10 -0.07 0.00 -0.00 0.00 0.00 39.48 39.31 1bqn n PHE 160 CO 0.00 0.00 0.00 0.37 -0.00 0.00 0.00 176.76 177.13 1bqn h GLN 161 N 0.00 -0.26 -0.32 -4.13 4.15 -0.23 0.71 115.11 115.02 1bqn h GLN 161 Ca 0.00 0.02 0.03 0.00 0.77 0.00 0.00 58.65 59.47 1bqn h GLN 161 Cb 0.07 0.06 -0.04 0.00 0.21 0.00 0.00 27.48 27.78 1bqn h GLN 161 CO 0.00 -0.18 -0.19 -1.13 -1.93 0.00 0.00 178.83 175.40 1bqn n SER 162 N -5.38 -0.34 -0.15 -0.69 3.41 -1.03 0.20 113.62 109.64 1bqn n SER 162 Ca -0.00 1.14 0.14 0.00 -0.26 0.00 0.00 58.87 59.89 1bqn n SER 162 Cb 0.34 -0.36 0.49 0.00 -0.26 0.00 0.00 64.21 64.42 1bqn n SER 162 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1bqn h SER 163 N 0.00 0.41 -0.08 4.04 0.02 -1.62 -0.03 113.55 116.29 1bqn h SER 163 Ca 0.05 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 1bqn h SER 163 Cb 0.13 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 62.61 1bqn h SER 163 CO -0.30 0.22 0.05 -0.03 -1.14 0.00 0.00 176.83 175.63 1bqn h MET 164 N 0.44 0.10 0.12 3.45 -1.53 0.46 0.27 114.93 118.24 1bqn h MET 164 Ca 0.35 -0.01 -0.01 0.00 -3.44 0.00 0.00 59.70 56.60 1bqn h MET 164 Cb 0.76 -0.02 0.00 0.00 -0.55 0.00 0.00 31.60 31.79 1bqn h MET 164 CO -0.11 0.07 -0.06 1.15 0.14 0.00 0.00 176.91 178.09 1bqn h THR 165 N 0.10 0.88 -1.00 -0.77 2.02 0.30 -0.56 112.91 113.88 1bqn h THR 165 Ca 0.03 -0.01 0.05 0.00 0.77 0.00 0.00 66.41 67.25 1bqn h THR 165 Cb -0.01 0.89 -0.06 0.00 -1.74 0.00 0.00 68.15 67.23 1bqn h THR 165 CO -0.01 0.00 0.65 0.50 0.37 0.00 0.00 175.52 177.04 1bqn h LYS 166 N -0.17 1.18 0.00 6.66 3.64 -0.89 -0.00 116.57 126.99 1bqn h LYS 166 Ca -0.02 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.27 1bqn h LYS 166 Cb 0.13 -0.27 -0.00 0.00 -0.41 0.00 0.00 32.23 31.68 1bqn h LYS 166 CO 0.03 0.78 -0.09 0.82 -2.27 0.00 0.00 179.45 178.71 1bqn h ILE 167 N 1.22 0.19 0.00 2.00 2.04 -0.08 -3.23 117.51 119.65 1bqn h ILE 167 Ca 0.42 -0.99 -0.28 0.00 1.00 0.00 0.00 64.86 65.01 1bqn h ILE 167 Cb 0.10 1.84 -0.05 0.00 -0.74 0.00 0.00 36.82 37.97 1bqn h ILE 167 CO -0.15 0.09 -1.81 0.18 0.00 0.00 0.00 178.15 176.46 1bqn n LEU 168 N -3.16 0.67 -0.04 1.44 4.77 -0.25 -4.68 117.00 115.74 1bqn n LEU 168 Ca 0.02 0.31 -0.01 0.00 -0.03 0.00 0.00 56.01 56.30 1bqn n LEU 168 Cb 0.46 0.22 -0.01 0.00 -2.33 0.00 0.00 43.42 41.76 1bqn n LEU 168 CO 0.32 0.36 0.10 1.21 -1.33 0.00 0.00 177.39 178.05 1bqn n GLU 169 N -2.94 -0.05 -0.10 3.23 4.07 -0.14 0.78 120.64 125.49 1bqn n GLU 169 Ca -0.19 0.26 0.18 0.00 -0.06 0.00 0.00 57.16 57.35 1bqn n GLU 169 Cb 1.03 -0.38 0.59 0.00 -0.06 0.00 0.00 31.44 32.62 1bqn n GLU 169 CO 0.00 0.00 0.00 -1.35 -0.06 0.00 0.00 177.13 175.72 1bqn h PRO 170 N 0.00 0.23 -0.00 5.31 0.11 -1.83 -2.25 132.00 133.56 1bqn h PRO 170 Ca 0.02 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.11 1bqn h PRO 170 Cb 0.04 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.10 1bqn h PRO 170 CO -0.10 0.15 -0.01 0.35 -0.21 0.00 0.00 178.00 178.18 1bqn h PHE 171 N 0.23 0.02 -0.96 0.65 3.57 0.05 -3.03 116.94 117.47 1bqn h PHE 171 Ca 0.33 -0.01 0.18 0.00 3.53 0.00 0.00 57.97 62.00 1bqn h PHE 171 Cb 0.97 -0.00 -0.09 0.00 2.79 0.00 0.00 35.95 39.62 1bqn h PHE 171 CO -0.00 0.61 0.61 0.87 -2.23 0.00 0.00 178.31 178.16 1bqn h LYS 172 N -0.58 0.65 -0.00 1.11 1.57 -0.87 -0.40 116.57 118.04 1bqn h LYS 172 Ca -0.00 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1bqn h LYS 172 Cb 0.61 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.77 1bqn h LYS 172 CO 0.00 0.43 -0.38 1.63 -0.57 0.00 0.00 179.45 180.56 1bqn n LYS 173 N -4.63 0.46 0.04 3.15 4.76 -1.07 -1.59 118.16 119.27 1bqn n LYS 173 Ca 0.21 -0.27 -0.14 0.00 -2.87 0.00 0.00 58.31 55.23 1bqn n LYS 173 Cb 0.57 -1.49 -0.14 0.00 -1.84 0.00 0.00 35.03 32.13 1bqn n LYS 173 CO 0.00 0.00 0.00 1.96 -1.37 0.00 0.00 177.40 177.99 1bqn h GLN 174 N 0.67 0.17 -3.00 1.97 7.50 -1.00 -3.40 115.11 118.02 1bqn h GLN 174 Ca 0.00 -0.29 -0.55 0.00 0.50 0.00 0.00 58.65 58.31 1bqn h GLN 174 Cb 0.51 0.11 -0.40 0.00 0.05 0.00 0.00 27.48 27.74 1bqn h GLN 174 CO 0.00 0.97 -0.78 -0.80 -1.50 0.00 0.00 178.83 176.72 1bqn s ASN 175 N -6.75 3.63 0.16 1.46 0.01 -0.44 -5.04 114.94 107.98 1bqn s ASN 175 Ca -0.09 -1.52 0.22 0.00 -0.71 0.00 0.00 52.86 50.77 1bqn s ASN 175 Cb 0.07 -0.53 -0.06 0.00 0.41 0.00 0.00 41.25 41.15 1bqn s ASN 175 CO 0.83 -0.42 0.95 -0.81 -1.51 0.00 0.00 177.10 176.14 1bqn n PRO 176 N 4.97 0.61 0.15 -0.60 -0.05 -0.62 -4.20 135.00 135.25 1bqn n PRO 176 Ca -0.03 0.06 0.02 0.00 -0.05 0.00 0.00 63.50 63.50 1bqn n PRO 176 Cb 0.41 -1.77 0.16 0.00 -0.05 0.00 0.00 33.50 32.25 1bqn n PRO 176 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 175.50 175.01 1bqn h ASP 177 N 0.00 0.00 -3.70 3.54 5.19 -1.96 -3.44 116.42 116.05 1bqn h ASP 177 Ca 0.00 0.00 -0.51 0.00 -0.62 0.00 0.00 57.03 55.90 1bqn h ASP 177 Cb 0.99 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.51 1bqn h ASP 177 CO 0.00 0.55 0.47 -0.63 -3.12 0.00 0.00 179.24 176.51 1bqn s ILE 178 N -3.31 3.66 0.35 0.35 1.01 -1.26 -4.88 121.20 117.12 1bqn s ILE 178 Ca 0.01 1.57 0.09 0.00 0.00 0.00 0.00 60.65 62.32 1bqn s ILE 178 Cb 0.10 -4.00 -0.06 0.00 0.01 0.00 0.00 42.46 38.51 1bqn s ILE 178 CO 0.74 0.33 -0.06 -0.69 0.00 0.00 0.00 174.94 175.26 1bqn s VAL 179 N -0.79 2.28 -0.08 2.92 1.01 -1.21 -5.01 120.40 119.53 1bqn s VAL 179 Ca 0.46 -2.14 -0.05 0.00 0.00 0.00 0.00 61.98 60.25 1bqn s VAL 179 Cb -0.31 -2.71 0.03 0.00 0.00 0.00 0.00 36.38 33.39 1bqn s VAL 179 CO 0.38 -0.18 0.20 -0.63 0.00 0.00 0.00 175.10 174.87 1bqn s ILE 180 N -2.60 -0.03 -0.12 2.22 1.01 -1.26 -3.18 121.20 117.25 1bqn s ILE 180 Ca 0.33 0.10 0.01 0.00 0.00 0.00 0.00 60.65 61.09 1bqn s ILE 180 Cb 0.03 -0.30 -0.02 0.00 0.01 0.00 0.00 42.46 42.18 1bqn s ILE 180 CO 0.17 0.04 -0.14 -0.47 0.00 0.00 0.00 174.94 174.55 1bqn s TYR 181 N 0.82 2.78 -0.80 3.97 5.04 0.53 -4.92 117.35 124.78 1bqn s TYR 181 Ca -0.06 -0.60 -0.15 0.00 -2.44 0.00 0.00 57.07 53.83 1bqn s TYR 181 Cb -0.07 -1.81 0.20 0.00 0.35 0.00 0.00 41.96 40.63 1bqn s TYR 181 CO -0.05 -0.17 0.77 -1.14 -1.34 0.00 0.00 175.55 173.63 1bqn s GLN 182 N 0.20 3.52 -0.11 4.97 0.74 -1.25 0.91 119.66 128.64 1bqn s GLN 182 Ca -0.08 -2.28 -0.01 0.00 0.05 0.00 0.00 55.36 53.04 1bqn s GLN 182 Cb -0.15 -4.45 -0.03 0.00 1.10 0.00 0.00 33.01 29.48 1bqn s GLN 182 CO 0.05 -1.35 -0.08 -0.47 -0.55 0.00 0.00 175.29 172.90 1bqn s TYR 183 N 0.62 2.92 0.00 1.67 5.04 0.12 -4.93 117.35 122.80 1bqn s TYR 183 Ca 0.17 -0.22 0.00 0.00 -2.44 0.00 0.00 57.07 54.58 1bqn s TYR 183 Cb -0.12 -1.81 0.00 0.00 0.35 0.00 0.00 41.96 40.38 1bqn s TYR 183 CO -0.07 0.10 0.00 -0.12 -1.34 0.00 0.00 175.55 174.12 1bqn n MET 184 N 2.89 0.00 -0.76 4.97 1.56 -1.26 0.17 117.12 124.69 1bqn n MET 184 Ca -0.18 0.00 0.03 0.00 -0.27 0.00 0.00 57.70 57.29 1bqn n MET 184 Cb 0.53 0.00 0.05 0.00 2.15 0.00 0.00 33.22 35.95 1bqn n MET 184 CO 0.00 0.00 0.00 -0.25 -0.73 0.00 0.00 175.97 174.99 1bqn n ASP 185 N 6.35 0.87 -4.54 6.12 8.00 -1.26 -4.54 116.55 127.54 1bqn n ASP 185 Ca 0.00 -2.38 -0.34 0.00 0.71 0.00 0.00 54.79 52.78 1bqn n ASP 185 Cb 0.00 -0.30 -0.11 0.00 -0.02 0.00 0.00 41.12 40.68 1bqn n ASP 185 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1bqn s ASP 186 N -1.86 5.09 -0.74 -2.24 1.11 0.45 -2.84 116.67 115.64 1bqn s ASP 186 Ca 0.20 -0.06 -0.03 0.00 0.18 0.00 0.00 52.55 52.84 1bqn s ASP 186 Cb 0.21 -1.85 0.19 0.00 1.07 0.00 0.00 42.92 42.54 1bqn s ASP 186 CO -0.06 0.16 0.59 -0.22 1.18 0.00 0.00 175.17 176.83 1bqn s LEU 187 N 0.42 5.43 -0.24 1.23 2.96 -1.21 0.15 118.68 127.42 1bqn s LEU 187 Ca -0.01 -3.21 -0.29 0.00 -0.22 0.00 0.00 54.13 50.39 1bqn s LEU 187 Cb -0.14 -1.89 -0.01 0.00 0.50 0.00 0.00 46.19 44.66 1bqn s LEU 187 CO 0.02 -0.30 1.31 -0.76 -1.32 0.00 0.00 176.35 175.30 1bqn s LEU 188 N -0.59 4.00 -0.18 -0.68 1.43 0.26 -3.62 118.68 119.31 1bqn s LEU 188 Ca 0.21 1.43 0.01 0.00 -1.03 0.00 0.00 54.13 54.75 1bqn s LEU 188 Cb -0.14 -3.54 0.03 0.00 0.03 0.00 0.00 46.19 42.56 1bqn s LEU 188 CO -0.07 -0.97 -0.17 -0.69 0.23 0.00 0.00 176.35 174.68 1bqn s VAL 189 N 4.09 1.87 0.19 -1.59 1.01 -0.48 -0.35 120.40 125.16 1bqn s VAL 189 Ca 0.57 -0.89 0.08 0.00 0.00 0.00 0.00 61.98 61.74 1bqn s VAL 189 Cb -0.19 -1.75 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 1bqn s VAL 189 CO 0.20 0.45 -0.16 -0.83 0.00 0.00 0.00 175.10 174.75 1bqn s GLY 190 N 1.35 1.44 0.20 4.51 0.00 -1.19 -1.59 107.32 112.04 1bqn s GLY 190 Ca 0.04 -1.60 -0.17 0.00 0.00 0.00 0.00 44.72 42.99 1bqn s GLY 190 CO -0.11 -1.67 0.51 -1.35 0.00 0.00 0.00 173.10 170.48 1bqn s SER 191 N -3.03 -0.25 -0.32 1.64 1.04 -1.03 -3.30 113.70 108.45 1bqn s SER 191 Ca 0.20 -0.50 0.05 0.00 0.48 0.00 0.00 55.95 56.18 1bqn s SER 191 Cb -0.03 0.57 0.57 0.00 0.10 0.00 0.00 66.02 67.23 1bqn s SER 191 CO 0.07 -1.05 1.69 0.47 0.98 0.00 0.00 173.24 175.40 1bqn n ASP 192 N -0.34 3.91 -4.98 7.02 8.00 -1.26 -1.37 116.55 127.53 1bqn n ASP 192 Ca -0.10 -3.17 -0.21 0.00 0.71 0.00 0.00 54.79 52.03 1bqn n ASP 192 Cb 0.62 -0.74 0.01 0.00 -0.02 0.00 0.00 41.12 40.99 1bqn n ASP 192 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1bqn s LEU 193 N -2.56 3.64 0.86 0.64 1.43 -1.26 -4.93 118.68 116.51 1bqn s LEU 193 Ca 0.46 -0.01 -0.11 0.00 -1.03 0.00 0.00 54.13 53.43 1bqn s LEU 193 Cb 0.37 -2.91 0.11 0.00 0.03 0.00 0.00 46.19 43.80 1bqn s LEU 193 CO 0.10 -0.75 1.17 -1.61 0.23 0.00 0.00 176.35 175.49 1bqn s GLU 194 N -4.48 1.35 0.00 1.70 2.02 -1.26 -4.44 118.70 113.60 1bqn s GLU 194 Ca 0.51 1.62 0.06 0.00 0.02 0.00 0.00 54.97 57.17 1bqn s GLU 194 Cb -0.10 -1.76 0.27 0.00 0.10 0.00 0.00 34.13 32.64 1bqn s GLU 194 CO 0.35 -2.40 1.06 0.44 0.02 0.00 0.00 175.26 174.74 1bqn n ILE 195 N -3.79 1.12 -0.09 -1.63 -0.00 -1.26 -0.33 119.36 113.39 1bqn n ILE 195 Ca 0.12 0.28 -0.10 0.00 -0.00 0.00 0.00 62.75 63.06 1bqn n ILE 195 Cb 0.51 -1.19 -0.12 0.00 -0.00 0.00 0.00 39.64 38.85 1bqn n ILE 195 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1bqn n GLY 196 N -0.85 -0.63 0.10 3.28 0.00 -1.26 -4.12 105.19 101.71 1bqn n GLY 196 Ca 0.02 -0.23 -0.16 0.00 0.00 0.00 0.00 46.02 45.65 1bqn n GLY 196 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1bqn h GLN 197 N 0.00 0.19 0.00 1.61 1.08 -0.99 -2.47 115.11 114.53 1bqn h GLN 197 Ca -0.44 -0.25 -0.08 0.00 -1.45 0.00 0.00 58.65 56.43 1bqn h GLN 197 Cb 1.89 0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 29.40 1bqn h GLN 197 CO -0.01 1.05 -0.37 1.25 -0.95 0.00 0.00 178.83 179.80 1bqn h HIS 198 N -0.55 0.00 -0.47 2.96 2.76 -1.03 0.56 115.15 119.37 1bqn h HIS 198 Ca -0.06 0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.07 1bqn h HIS 198 Cb 1.21 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.15 1bqn h HIS 198 CO 0.21 0.37 0.15 -0.09 -1.30 0.00 0.00 177.93 177.27 1bqn h ARG 199 N 0.00 0.74 0.01 5.26 2.43 -1.70 -1.81 114.38 119.31 1bqn h ARG 199 Ca -0.00 -0.16 -0.10 0.00 -0.81 0.00 0.00 59.98 58.91 1bqn h ARG 199 Cb 0.69 -0.11 0.01 0.00 -0.42 0.00 0.00 29.97 30.15 1bqn h ARG 199 CO 0.05 0.70 -0.39 1.79 -1.51 0.00 0.00 179.97 180.61 1bqn h THR 200 N 0.63 1.52 0.00 0.20 1.35 -0.94 -2.99 112.91 112.69 1bqn h THR 200 Ca 0.15 -2.06 0.00 0.00 -0.55 0.00 0.00 66.41 63.95 1bqn h THR 200 Cb 0.27 2.80 0.00 0.00 -1.73 0.00 0.00 68.15 69.49 1bqn h THR 200 CO -0.00 0.58 0.46 0.11 -0.25 0.00 0.00 175.52 176.41 1bqn h LYS 201 N -0.41 0.00 0.00 4.72 6.56 0.24 0.65 116.57 128.34 1bqn h LYS 201 Ca -0.05 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.54 1bqn h LYS 201 Cb 1.15 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.81 1bqn h LYS 201 CO 0.08 0.00 -0.14 0.82 -2.06 0.00 0.00 179.45 178.14 1bqn h ILE 202 N 0.00 0.00 -1.01 1.86 1.08 -1.18 -3.24 117.51 115.02 1bqn h ILE 202 Ca 0.00 -0.79 0.25 0.00 -0.39 0.00 0.00 64.86 63.93 1bqn h ILE 202 Cb 0.92 0.00 -0.12 0.00 -3.07 0.00 0.00 36.82 34.55 1bqn h ILE 202 CO 0.00 0.00 0.60 -0.33 -0.69 0.00 0.00 178.15 177.73 1bqn h GLU 203 N -0.79 0.55 -0.64 2.37 4.39 -0.88 1.90 114.58 121.47 1bqn h GLU 203 Ca 0.00 -0.03 0.13 0.00 0.34 0.00 0.00 59.36 59.80 1bqn h GLU 203 Cb 0.14 -0.12 -0.11 0.00 -0.10 0.00 0.00 28.75 28.56 1bqn h GLU 203 CO 0.00 0.36 0.04 1.49 -1.16 0.00 0.00 179.01 179.74 1bqn h GLU 204 N 0.56 0.15 -0.23 2.33 4.81 -1.36 1.02 114.58 121.87 1bqn h GLU 204 Ca 0.65 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.80 1bqn h GLU 204 Cb 1.26 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 1bqn h GLU 204 CO -0.48 0.10 -0.18 1.25 -0.73 0.00 0.00 179.01 178.97 1bqn h LEU 205 N 0.15 0.39 0.16 1.64 5.85 0.28 -2.25 115.31 121.53 1bqn h LEU 205 Ca 0.34 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.95 1bqn h LEU 205 Cb 0.56 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.49 1bqn h LEU 205 CO -0.52 0.59 -0.08 0.03 -0.34 0.00 0.00 178.44 178.12 1bqn h ARG 206 N 0.36 -0.21 -0.04 1.25 3.08 0.33 -0.20 114.38 118.96 1bqn h ARG 206 Ca 0.06 0.01 0.01 0.00 0.07 0.00 0.00 59.98 60.14 1bqn h ARG 206 Cb 0.53 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.59 1bqn h ARG 206 CO 0.03 0.03 -0.32 1.96 -1.07 0.00 0.00 179.97 180.61 1bqn h GLN 207 N -0.42 -0.36 -0.94 0.04 7.50 0.02 -0.27 115.11 120.68 1bqn h GLN 207 Ca -0.02 0.02 0.26 0.00 0.50 0.00 0.00 58.65 59.41 1bqn h GLN 207 Cb 0.33 0.08 -0.17 0.00 0.05 0.00 0.00 27.48 27.77 1bqn h GLN 207 CO 0.04 -0.24 0.07 1.25 -1.50 0.00 0.00 178.83 178.45 1bqn h HIS 208 N -0.37 0.04 0.00 2.96 2.76 -1.40 0.80 115.15 119.94 1bqn h HIS 208 Ca 0.01 0.06 -0.01 0.00 -2.20 0.00 0.00 60.37 58.24 1bqn h HIS 208 Cb 0.41 0.13 -0.00 0.00 1.55 0.00 0.00 27.41 29.50 1bqn h HIS 208 CO -0.49 -0.37 -0.05 -0.07 -1.30 0.00 0.00 177.93 175.65 1bqn h LEU 209 N 0.05 0.00 0.06 0.26 3.38 0.61 -1.77 115.31 117.90 1bqn h LEU 209 Ca 0.57 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.54 1bqn h LEU 209 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1bqn h LEU 209 CO -0.84 0.05 -0.03 -0.07 0.09 0.00 0.00 178.44 177.65 1bqn h LEU 210 N 0.00 -0.07 0.00 1.67 4.07 0.20 -2.07 115.31 119.11 1bqn h LEU 210 Ca -0.00 -0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.93 1bqn h LEU 210 Cb 0.12 0.02 0.00 0.00 1.08 0.00 0.00 40.66 41.87 1bqn h LEU 210 CO 0.01 0.43 0.00 0.54 -1.08 0.00 0.00 178.44 178.34 1bqn n ARG 211 N -4.83 0.00 0.00 1.13 1.74 -0.75 0.18 116.66 114.13 1bqn n ARG 211 Ca -0.01 0.53 0.00 0.00 -0.77 0.00 0.00 57.85 57.60 1bqn n ARG 211 Cb 0.05 -1.12 0.00 0.00 -1.02 0.00 0.00 32.46 30.37 1bqn n ARG 211 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 1bqn n TRP 212 N -1.37 0.00 0.00 -1.55 7.02 -0.69 -3.45 117.44 117.40 1bqn n TRP 212 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 1bqn n TRP 212 Cb 0.00 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 28.89 1bqn n TRP 212 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1bqn n GLY 213 N 0.09 -0.03 3.83 6.99 0.00 -1.09 -4.91 105.19 110.08 1bqn n GLY 213 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 1bqn n GLY 213 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1bqn n LEU 214 N 0.00 -0.70 -4.90 0.99 7.94 0.48 -4.89 117.00 115.93 1bqn n LEU 214 Ca 0.00 -0.94 -0.30 0.00 -1.11 0.00 0.00 56.01 53.66 1bqn n LEU 214 Cb 0.00 -1.18 -0.04 0.00 0.53 0.00 0.00 43.42 42.73 1bqn n LEU 214 CO 0.00 0.32 0.16 0.42 -1.11 0.00 0.00 177.39 177.18 1bqn s THR 215 N -3.88 5.04 -0.01 1.96 -4.23 -0.78 -4.96 115.64 108.78 1bqn s THR 215 Ca 0.07 0.14 0.00 0.00 -1.18 0.00 0.00 61.69 60.72 1bqn s THR 215 Cb -0.04 -3.68 0.02 0.00 1.34 0.00 0.00 72.50 70.14 1bqn s THR 215 CO 0.74 -0.18 0.00 -0.89 -0.54 0.00 0.00 174.62 173.75 1bqn s THR 216 N -1.92 0.09 -0.22 3.99 2.01 -1.26 -3.59 115.64 114.73 1bqn s THR 216 Ca 0.44 0.06 -0.22 0.00 0.31 0.00 0.00 61.69 62.28 1bqn s THR 216 Cb -0.11 -0.15 -0.02 0.00 0.01 0.00 0.00 72.50 72.23 1bqn s THR 216 CO 0.27 0.08 0.70 -2.84 -0.69 0.00 0.00 174.62 172.13 1bqn s PRO 217 N 0.58 4.19 0.38 4.92 0.02 -1.26 -4.46 135.00 139.35 1bqn s PRO 217 Ca -0.05 0.71 -0.28 0.00 0.02 0.00 0.00 61.00 61.41 1bqn s PRO 217 Cb -0.08 -3.61 -0.10 0.00 0.02 0.00 0.00 34.50 30.73 1bqn s PRO 217 CO -0.01 -0.36 1.40 -0.51 -0.33 0.00 0.00 177.00 177.18 1bqn s ASP 218 N 1.31 6.42 0.06 2.53 1.11 -1.26 -4.89 116.67 121.93 1bqn s ASP 218 Ca 0.30 2.87 -0.36 0.00 0.18 0.00 0.00 52.55 55.55 1bqn s ASP 218 Cb -0.16 -2.66 -0.15 0.00 1.07 0.00 0.00 42.92 41.03 1bqn s ASP 218 CO 0.09 -0.80 1.55 0.29 1.18 0.00 0.00 175.17 177.49 1bqn n LYS 219 N 0.44 1.71 -2.83 8.23 5.02 -1.26 -4.91 118.16 124.57 1bqn n LYS 219 Ca 0.01 0.62 -0.43 0.00 -2.02 0.00 0.00 58.31 56.50 1bqn n LYS 219 Cb 0.41 -2.35 -0.04 0.00 -0.02 0.00 0.00 35.03 33.03 1bqn n LYS 219 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1bqn s LYS 220 N 1.46 3.34 -0.23 1.97 0.00 -1.26 -5.00 119.74 120.03 1bqn s LYS 220 Ca 0.85 -0.24 -0.10 0.00 0.00 0.00 0.00 55.97 56.48 1bqn s LYS 220 Cb -0.81 -4.05 0.09 0.00 0.00 0.00 0.00 37.83 33.05 1bqn s LYS 220 CO 0.46 -1.49 0.51 -1.01 0.00 0.00 0.00 175.35 173.82 1bqn s HIS 221 N 3.98 -0.90 0.00 1.78 4.02 -1.26 -4.75 115.29 118.15 1bqn s HIS 221 Ca 0.31 1.73 0.00 0.00 1.02 0.00 0.00 55.06 58.12 1bqn s HIS 221 Cb -0.12 0.45 0.00 0.00 -1.02 0.00 0.00 32.58 31.89 1bqn s HIS 221 CO 0.20 -0.49 0.00 1.04 1.02 0.00 0.00 174.74 176.50 1bqn n GLN 222 N 4.92 0.00 -3.40 1.40 1.13 -1.26 -4.68 117.38 115.49 1bqn n GLN 222 Ca -0.15 0.00 -0.21 0.00 -1.94 0.00 0.00 57.00 54.70 1bqn n GLN 222 Cb 0.52 0.00 -0.09 0.00 0.11 0.00 0.00 30.24 30.78 1bqn n GLN 222 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 1bqn s LYS 223 N -2.00 0.60 0.42 -1.09 2.20 -1.26 -4.48 119.74 114.12 1bqn s LYS 223 Ca 0.00 -1.02 -0.03 0.00 -0.36 0.00 0.00 55.97 54.57 1bqn s LYS 223 Cb 0.00 -0.93 -0.04 0.00 -1.51 0.00 0.00 37.83 35.35 1bqn s LYS 223 CO 0.00 -1.20 0.67 -2.00 -0.36 0.00 0.00 175.35 172.47 1bqn s GLU 224 N 1.32 3.52 0.57 4.03 2.12 -1.26 -4.96 118.70 124.04 1bqn s GLU 224 Ca 0.17 -0.04 0.28 0.00 0.36 0.00 0.00 54.97 55.74 1bqn s GLU 224 Cb -0.18 -2.51 1.49 0.00 0.26 0.00 0.00 34.13 33.19 1bqn s GLU 224 CO -0.03 -0.03 1.96 -1.00 -0.54 0.00 0.00 175.26 175.62 1bqn h PRO 225 N 0.50 0.00 -1.23 4.30 0.13 -2.00 -1.27 132.00 132.44 1bqn h PRO 225 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1bqn h PRO 225 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1bqn h PRO 225 CO 0.62 0.00 0.00 -0.35 -0.23 0.00 0.00 178.00 178.04 1bqn n PRO 226 N -3.94 0.92 -3.29 1.56 -0.04 -1.26 -4.88 135.00 124.07 1bqn n PRO 226 Ca 0.08 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.40 1bqn n PRO 226 Cb 0.60 -1.04 0.00 0.00 -0.04 0.00 0.00 33.50 33.03 1bqn n PRO 226 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 1bqn n PHE 227 N 0.70 -0.87 -2.89 0.54 -1.74 -0.48 -4.87 117.46 107.85 1bqn n PHE 227 Ca 0.00 0.30 -0.43 0.00 -0.56 0.00 0.00 57.45 56.76 1bqn n PHE 227 Cb 0.46 -1.28 -0.03 0.00 1.52 0.00 0.00 39.48 40.15 1bqn n PHE 227 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 1bqn s LEU 228 N -4.04 4.72 0.00 5.98 1.43 -1.25 -4.91 118.68 120.61 1bqn s LEU 228 Ca 0.05 -1.52 0.00 0.00 -1.03 0.00 0.00 54.13 51.63 1bqn s LEU 228 Cb -0.03 -2.41 0.00 0.00 0.03 0.00 0.00 46.19 43.78 1bqn s LEU 228 CO 0.43 -1.25 0.00 0.79 0.23 0.00 0.00 176.35 176.55 1bqn n TRP 229 N 7.13 0.00 -3.98 0.29 8.01 -1.26 -4.29 117.44 123.34 1bqn n TRP 229 Ca 0.10 0.00 -0.29 0.00 -1.31 0.00 0.00 57.50 56.00 1bqn n TRP 229 Cb 0.47 0.00 -0.16 0.00 -2.01 0.00 0.00 31.31 29.61 1bqn n TRP 229 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.69 175.04 1bqn s MET 230 N 0.01 2.00 0.00 -0.99 1.00 -1.26 -4.43 119.30 115.62 1bqn s MET 230 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 55.69 55.11 1bqn s MET 230 Cb 0.00 -2.09 0.00 0.00 0.00 0.00 0.00 34.83 32.74 1bqn s MET 230 CO 0.00 -0.32 0.00 0.41 0.00 0.00 0.00 175.02 175.11 1bqn n GLY 231 N 4.79 2.46 2.70 -0.03 0.00 -1.26 -4.96 105.19 108.90 1bqn n GLY 231 Ca -0.15 -1.03 -0.41 0.00 0.00 0.00 0.00 46.02 44.42 1bqn n GLY 231 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1bqn n TYR 232 N 0.86 2.67 -2.78 1.61 9.36 -1.26 -4.97 117.16 122.64 1bqn n TYR 232 Ca 0.00 -2.74 -0.43 0.00 3.32 0.00 0.00 57.90 58.05 1bqn n TYR 232 Cb 0.00 -1.72 -0.03 0.00 -0.63 0.00 0.00 39.34 36.96 1bqn n TYR 232 CO 0.00 0.00 0.00 -1.21 0.22 0.00 0.00 176.86 175.87 1bqn s GLU 233 N -1.23 3.31 0.11 2.98 2.02 -1.25 -4.09 118.70 120.54 1bqn s GLU 233 Ca 0.44 -1.00 -0.30 0.00 0.02 0.00 0.00 54.97 54.12 1bqn s GLU 233 Cb 0.14 -4.54 -0.07 0.00 0.10 0.00 0.00 34.13 29.76 1bqn s GLU 233 CO -0.04 -1.91 1.22 -0.51 0.02 0.00 0.00 175.26 174.05 1bqn s LEU 234 N 4.12 4.40 -0.73 1.80 1.43 0.03 -4.73 118.68 125.00 1bqn s LEU 234 Ca 0.30 2.13 -0.08 0.00 -1.03 0.00 0.00 54.13 55.45 1bqn s LEU 234 Cb -0.10 -3.59 0.19 0.00 0.03 0.00 0.00 46.19 42.72 1bqn s LEU 234 CO 0.03 -0.46 0.61 -1.00 0.23 0.00 0.00 176.35 175.76 1bqn s HIS 235 N 0.70 3.58 0.59 0.29 3.76 -1.26 0.07 115.29 123.02 1bqn s HIS 235 Ca 0.58 -2.36 0.29 0.00 -0.15 0.00 0.00 55.06 53.41 1bqn s HIS 235 Cb -0.32 -3.51 1.61 0.00 1.11 0.00 0.00 32.58 31.48 1bqn s HIS 235 CO 0.32 -0.91 2.03 -1.35 -0.85 0.00 0.00 174.74 173.97 1bqn h PRO 236 N 7.38 0.00 0.00 8.40 0.11 -1.72 -0.72 132.00 145.45 1bqn h PRO 236 Ca 0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.16 1bqn h PRO 236 Cb 0.99 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.10 1bqn h PRO 236 CO 0.73 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.27 1bqn n ASP 237 N -3.71 0.00 -0.48 -2.05 9.92 -1.26 -1.31 116.55 117.66 1bqn n ASP 237 Ca 0.03 -0.20 0.12 0.00 -0.53 0.00 0.00 54.79 54.22 1bqn n ASP 237 Cb 0.43 -0.16 0.48 0.00 -0.64 0.00 0.00 41.12 41.23 1bqn n ASP 237 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1bqn n LYS 238 N -1.16 1.65 -1.46 -1.24 5.02 -0.28 -4.83 118.16 115.86 1bqn n LYS 238 Ca 0.10 -0.95 -0.38 0.00 -2.02 0.00 0.00 58.31 55.06 1bqn n LYS 238 Cb 0.10 -1.44 -0.06 0.00 -0.02 0.00 0.00 35.03 33.61 1bqn n LYS 238 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 1bqn n TRP 239 N 0.16 2.10 -4.83 2.13 5.03 -0.42 -4.94 117.44 116.67 1bqn n TRP 239 Ca 0.18 -1.61 -0.31 0.00 3.03 0.00 0.00 57.50 58.79 1bqn n TRP 239 Cb 0.33 -2.01 -0.14 0.00 -1.03 0.00 0.00 31.31 28.46 1bqn n TRP 239 CO 0.00 0.00 0.00 0.95 -0.03 0.00 0.00 177.69 178.61 1bqn s THR 240 N 7.40 2.51 -0.14 -0.99 -4.23 -1.26 -5.13 115.64 113.79 1bqn s THR 240 Ca 0.62 -1.22 -0.15 0.00 -1.18 0.00 0.00 61.69 59.77 1bqn s THR 240 Cb 0.09 -2.01 -0.05 0.00 1.34 0.00 0.00 72.50 71.88 1bqn s THR 240 CO 0.14 0.39 0.34 -0.69 -0.54 0.00 0.00 174.62 174.26 1bqn s VAL 241 N -0.84 5.26 -0.13 2.29 1.01 -1.26 -4.97 120.40 121.77 1bqn s VAL 241 Ca 0.13 0.66 0.15 0.00 0.00 0.00 0.00 61.98 62.92 1bqn s VAL 241 Cb -0.10 -3.68 0.31 0.00 0.00 0.00 0.00 36.38 32.91 1bqn s VAL 241 CO 0.03 0.39 1.19 -0.62 0.00 0.00 0.00 175.10 176.09 1bqn n GLU 242 N 3.48 0.64 0.00 2.72 4.71 -1.26 -5.05 120.64 125.88 1bqn n GLU 242 Ca -0.11 -1.82 0.00 0.00 -0.01 0.00 0.00 57.16 55.22 1bqn n GLU 242 Cb 0.52 -0.07 0.00 0.00 -1.01 0.00 0.00 31.44 30.88 1bqn n GLU 242 CO 0.00 0.00 0.00 -2.30 0.09 0.00 0.00 177.13 174.92 1bqn n PRO 243 N -0.32 0.00 -1.25 3.49 -0.02 -1.26 -4.71 135.00 130.93 1bqn n PRO 243 Ca -0.09 0.01 -0.10 0.00 -2.02 0.00 0.00 63.50 61.29 1bqn n PRO 243 Cb 0.88 -0.66 -0.07 0.00 -0.02 0.00 0.00 33.50 33.64 1bqn n PRO 243 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1bqn n ILE 244 N -0.53 0.00 -2.94 4.25 5.41 -1.12 -4.67 119.36 119.76 1bqn n ILE 244 Ca 0.00 -0.22 -0.42 0.00 1.00 0.00 0.00 62.75 63.12 1bqn n ILE 244 Cb 0.00 -1.14 -0.05 0.00 -0.71 0.00 0.00 39.64 37.74 1bqn n ILE 244 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1bqn s VAL 245 N 9.35 4.80 0.24 1.39 1.01 -1.26 -5.05 120.40 130.88 1bqn s VAL 245 Ca 0.46 1.22 -0.26 0.00 0.00 0.00 0.00 61.98 63.39 1bqn s VAL 245 Cb -0.01 -4.14 -0.09 0.00 0.00 0.00 0.00 36.38 32.14 1bqn s VAL 245 CO 0.12 -0.23 0.86 -0.76 0.00 0.00 0.00 175.10 175.09 1bqn s LEU 246 N 2.95 4.50 0.14 3.92 1.43 -1.26 -4.96 118.68 125.39 1bqn s LEU 246 Ca 0.33 1.75 -0.31 0.00 -1.03 0.00 0.00 54.13 54.86 1bqn s LEU 246 Cb -0.14 -3.64 -0.09 0.00 0.03 0.00 0.00 46.19 42.35 1bqn s LEU 246 CO 0.12 0.09 1.46 -2.84 0.23 0.00 0.00 176.35 175.41 1bqn s PRO 247 N -1.55 4.28 0.05 1.29 0.02 -1.26 -4.92 135.00 132.91 1bqn s PRO 247 Ca 0.43 2.19 -0.19 0.00 0.02 0.00 0.00 61.00 63.45 1bqn s PRO 247 Cb -0.22 -3.21 -0.08 0.00 0.02 0.00 0.00 34.50 31.01 1bqn s PRO 247 CO 0.26 -0.51 1.30 1.05 -0.33 0.00 0.00 177.00 178.77 1bqn h GLU 248 N 6.80 -0.43 -0.39 5.54 9.09 -2.05 -3.24 114.58 129.91 1bqn h GLU 248 Ca -0.42 0.03 0.00 0.00 0.05 0.00 0.00 59.36 59.02 1bqn h GLU 248 Cb 1.21 0.10 0.00 0.00 -1.65 0.00 0.00 28.75 28.41 1bqn h GLU 248 CO 0.89 -0.29 0.00 0.36 0.05 0.00 0.00 179.01 180.02 1bqn n LYS 249 N -4.06 1.91 -2.16 1.06 0.00 -1.26 -4.74 118.16 108.91 1bqn n LYS 249 Ca -0.05 -1.41 -0.41 0.00 -0.00 0.00 0.00 58.31 56.44 1bqn n LYS 249 Cb 0.23 -1.31 -0.00 0.00 -0.00 0.00 0.00 35.03 33.95 1bqn n LYS 249 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 1bqn n ASP 250 N 0.65 6.93 -0.81 -5.58 5.75 -1.22 -3.92 116.55 118.34 1bqn n ASP 250 Ca 0.13 -3.15 0.01 0.00 -0.01 0.00 0.00 54.79 51.77 1bqn n ASP 250 Cb 0.33 -1.40 0.00 0.00 -1.03 0.00 0.00 41.12 39.03 1bqn n ASP 250 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1bqn n SER 251 N 2.43 0.24 -0.01 -1.12 3.41 -1.26 -4.37 113.62 112.94 1bqn n SER 251 Ca 0.53 -1.91 -0.00 0.00 -0.26 0.00 0.00 58.87 57.22 1bqn n SER 251 Cb 0.29 -0.19 -0.00 0.00 -0.26 0.00 0.00 64.21 64.05 1bqn n SER 251 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 1bqn h TRP 252 N 0.29 0.00 -3.62 7.33 6.55 -1.86 -3.41 115.95 121.23 1bqn h TRP 252 Ca -0.09 0.00 -0.46 0.00 0.95 0.00 0.00 58.89 59.29 1bqn h TRP 252 Cb 1.51 0.00 0.08 0.00 -0.86 0.00 0.00 29.16 29.89 1bqn h TRP 252 CO 0.08 0.00 0.22 0.95 -1.05 0.00 0.00 178.44 178.64 1bqn s THR 253 N -1.12 2.27 0.18 1.49 -4.23 -1.26 -1.79 115.64 111.17 1bqn s THR 253 Ca -0.01 -0.29 -0.08 0.00 -1.18 0.00 0.00 61.69 60.12 1bqn s THR 253 Cb 0.00 -2.97 0.02 0.00 1.34 0.00 0.00 72.50 70.89 1bqn s THR 253 CO 0.01 0.00 1.58 0.58 -0.54 0.00 0.00 174.62 176.26 1bqn h VAL 254 N -0.62 1.27 0.59 2.29 2.07 -1.52 -2.67 116.25 117.66 1bqn h VAL 254 Ca -0.44 -1.35 -0.02 0.00 0.82 0.00 0.00 66.70 65.72 1bqn h VAL 254 Cb 1.31 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 32.17 1bqn h VAL 254 CO 0.57 0.46 -0.41 -1.13 0.02 0.00 0.00 177.57 177.08 1bqn h ASN 255 N 0.83 -1.07 -0.54 0.57 -1.24 -1.88 0.90 115.58 113.14 1bqn h ASN 255 Ca 0.11 0.07 0.10 0.00 0.71 0.00 0.00 56.30 57.30 1bqn h ASN 255 Cb 0.75 0.33 -0.11 0.00 0.73 0.00 0.00 38.32 40.03 1bqn h ASN 255 CO 0.06 -0.62 -0.28 0.44 -1.29 0.00 0.00 177.43 175.74 1bqn h ASP 256 N -0.96 -0.98 0.42 1.15 5.19 -1.86 0.78 116.42 120.15 1bqn h ASP 256 Ca -0.07 0.21 -0.05 0.00 -0.62 0.00 0.00 57.03 56.49 1bqn h ASP 256 Cb 0.80 0.51 -0.01 0.00 0.18 0.00 0.00 39.33 40.81 1bqn h ASP 256 CO 0.04 -0.28 -0.26 0.40 -3.12 0.00 0.00 179.24 176.02 1bqn h ILE 257 N -0.15 0.94 0.00 0.35 2.04 -1.33 0.25 117.51 119.61 1bqn h ILE 257 Ca 0.23 -0.96 -0.11 0.00 1.00 0.00 0.00 64.86 65.02 1bqn h ILE 257 Cb 0.52 1.56 -0.02 0.00 -0.74 0.00 0.00 36.82 38.15 1bqn h ILE 257 CO -0.63 0.25 -0.55 1.56 0.00 0.00 0.00 178.15 178.79 1bqn h GLN 258 N 0.00 0.00 0.24 2.37 4.20 0.71 -2.54 115.11 120.09 1bqn h GLN 258 Ca -0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 1bqn h GLN 258 Cb 0.54 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.32 1bqn h GLN 258 CO 0.03 0.55 -0.12 0.87 -0.67 0.00 0.00 178.83 179.49 1bqn h LYS 259 N 0.00 -0.31 -1.15 1.46 1.57 0.70 -3.30 116.57 115.54 1bqn h LYS 259 Ca -0.01 0.02 0.37 0.00 -1.87 0.00 0.00 60.65 59.17 1bqn h LYS 259 Cb 0.97 0.07 -0.09 0.00 0.08 0.00 0.00 32.23 33.26 1bqn h LYS 259 CO 0.07 -0.21 0.77 -0.11 -0.57 0.00 0.00 179.45 179.40 1bqn n LEU 260 N -3.76 0.11 0.01 2.94 7.94 0.78 0.79 117.00 125.81 1bqn n LEU 260 Ca -0.04 0.94 -0.07 0.00 -1.11 0.00 0.00 56.01 55.73 1bqn n LEU 260 Cb 0.13 -0.46 -0.13 0.00 0.53 0.00 0.00 43.42 43.49 1bqn n LEU 260 CO 0.10 -1.00 -0.26 0.58 -1.11 0.00 0.00 177.39 175.70 1bqn h VAL 261 N 0.00 1.12 -0.33 1.96 2.07 -1.55 -2.83 116.25 116.69 1bqn h VAL 261 Ca 0.66 -2.89 -0.16 0.00 0.82 0.00 0.00 66.70 65.13 1bqn h VAL 261 Cb 2.31 2.54 -0.00 0.00 -1.52 0.00 0.00 31.29 34.61 1bqn h VAL 261 CO -0.25 0.64 -0.44 1.23 0.02 0.00 0.00 177.57 178.76 1bqn h GLY 262 N 3.35 0.92 0.88 2.17 0.00 0.31 0.20 103.07 110.90 1bqn h GLY 262 Ca -0.18 -0.99 -0.02 0.00 0.00 0.00 0.00 47.33 46.15 1bqn h GLY 262 CO 0.09 0.89 -0.19 0.50 0.00 0.00 0.00 176.54 177.83 1bqn h LYS 263 N 0.68 -0.51 0.00 4.80 1.57 -1.52 -1.30 116.57 120.28 1bqn h LYS 263 Ca 0.04 0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1bqn h LYS 263 Cb 1.03 0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.45 1bqn h LYS 263 CO 0.10 -0.27 0.29 -0.07 -0.57 0.00 0.00 179.45 178.93 1bqn h LEU 264 N -0.66 0.00 0.00 2.94 3.38 -1.23 0.71 115.31 120.45 1bqn h LEU 264 Ca -0.05 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 1bqn h LEU 264 Cb 0.48 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 1bqn h LEU 264 CO 0.09 0.00 -0.54 -1.13 0.09 0.00 0.00 178.44 176.95 1bqn h ASN 265 N 0.00 0.00 0.11 -0.43 -1.24 0.54 -3.15 115.58 111.42 1bqn h ASN 265 Ca 0.00 0.00 -0.17 0.00 0.71 0.00 0.00 56.30 56.84 1bqn h ASN 265 Cb 0.58 0.00 0.01 0.00 0.73 0.00 0.00 38.32 39.64 1bqn h ASN 265 CO 0.00 0.07 -0.80 -0.25 -1.29 0.00 0.00 177.43 175.16 1bqn h TRP 266 N 0.00 0.44 -0.57 0.67 -0.00 0.96 -3.30 115.95 114.14 1bqn h TRP 266 Ca -0.01 -0.32 0.17 0.00 -0.00 0.00 0.00 58.89 58.73 1bqn h TRP 266 Cb 1.06 -0.02 -0.02 0.00 -0.00 0.00 0.00 29.16 30.18 1bqn h TRP 266 CO 0.00 1.31 0.61 0.00 -0.00 0.00 0.00 178.44 180.36 1bqn h ALA 267 N 0.03 2.34 -0.36 2.65 0.00 -1.54 -2.02 119.26 120.37 1bqn h ALA 267 Ca -0.15 -0.02 0.10 0.00 0.00 0.00 0.00 54.91 54.84 1bqn h ALA 267 Cb 1.56 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.38 1bqn h ALA 267 CO 0.11 -0.91 0.35 0.77 0.00 0.00 0.00 179.25 179.57 1bqn h SER 268 N 0.00 0.00 0.03 0.00 0.02 -1.62 0.79 113.55 112.76 1bqn h SER 268 Ca 0.27 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 1bqn h SER 268 Cb 1.49 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.03 1bqn h SER 268 CO -0.00 0.00 -0.69 0.00 -1.14 0.00 0.00 176.83 175.00 1bqn n GLN 269 N -3.87 0.63 -0.08 3.45 1.13 -0.76 -3.00 117.38 114.89 1bqn n GLN 269 Ca 0.06 -0.51 -0.07 0.00 -1.94 0.00 0.00 57.00 54.55 1bqn n GLN 269 Cb 0.52 -1.49 -0.02 0.00 0.11 0.00 0.00 30.24 29.36 1bqn n GLN 269 CO 0.00 0.00 0.00 -0.89 -1.44 0.00 0.00 177.06 174.73 1bqn n ILE 270 N -0.74 1.40 -3.60 5.09 5.41 0.69 -4.63 119.36 122.97 1bqn n ILE 270 Ca 0.07 0.19 -0.40 0.00 1.00 0.00 0.00 62.75 63.62 1bqn n ILE 270 Cb 0.40 -2.34 -0.07 0.00 -0.71 0.00 0.00 39.64 36.92 1bqn n ILE 270 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 1bqn s TYR 271 N -2.51 3.51 0.42 1.39 2.02 0.24 -4.96 117.35 117.46 1bqn s TYR 271 Ca -0.21 -2.48 0.11 0.00 -0.37 0.00 0.00 57.07 54.12 1bqn s TYR 271 Cb 0.03 -3.38 0.96 0.00 -0.40 0.00 0.00 41.96 39.17 1bqn s TYR 271 CO 0.31 -0.89 2.00 -1.00 -1.57 0.00 0.00 175.55 174.40 1bqn h PRO 272 N 7.29 0.46 -2.98 -1.71 0.13 -1.72 -3.22 132.00 130.25 1bqn h PRO 272 Ca 0.01 -0.03 -0.42 0.00 -0.87 0.00 0.00 66.00 64.69 1bqn h PRO 272 Cb 0.98 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.01 1bqn h PRO 272 CO 0.73 0.31 2.34 0.41 -0.23 0.00 0.00 178.00 181.56 1bqn n GLY 273 N -1.50 3.36 3.63 1.56 0.00 -1.26 -4.86 105.19 106.12 1bqn n GLY 273 Ca 0.08 -1.09 -0.34 0.00 0.00 0.00 0.00 46.02 44.66 1bqn n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bqn s ILE 274 N 2.48 4.76 -0.38 -0.61 1.01 -1.22 -4.99 121.20 122.25 1bqn s ILE 274 Ca 0.53 -0.05 -0.07 0.00 0.00 0.00 0.00 60.65 61.06 1bqn s ILE 274 Cb 0.17 -3.14 0.06 0.00 0.01 0.00 0.00 42.46 39.56 1bqn s ILE 274 CO -0.03 0.46 0.18 -0.54 0.00 0.00 0.00 174.94 175.01 1bqn s LYS 275 N 0.36 2.54 -0.04 2.79 -0.14 -1.26 -4.98 119.74 119.01 1bqn s LYS 275 Ca 0.03 -1.36 0.06 0.00 -1.36 0.00 0.00 55.97 53.34 1bqn s LYS 275 Cb -0.12 -3.60 0.10 0.00 -1.68 0.00 0.00 37.83 32.52 1bqn s LYS 275 CO 0.00 -0.83 0.99 1.33 -0.76 0.00 0.00 175.35 176.08 1bqn n VAL 276 N 4.83 0.71 0.02 3.17 0.24 -1.26 -4.52 118.33 121.52 1bqn n VAL 276 Ca -0.10 -0.84 -0.01 0.00 -2.04 0.00 0.00 64.34 61.35 1bqn n VAL 276 Cb 0.44 0.32 -0.00 0.00 -1.47 0.00 0.00 33.84 33.12 1bqn n VAL 276 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 1bqn h ARG 277 N 0.00 -0.04 0.00 7.34 3.08 -1.98 -2.69 114.38 120.09 1bqn h ARG 277 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1bqn h ARG 277 Cb 1.14 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.20 1bqn h ARG 277 CO 0.00 -0.03 0.13 0.00 -1.07 0.00 0.00 179.97 179.00 1bqn n ALA 278 N -2.03 0.48 -0.12 0.04 0.00 -1.26 0.23 120.51 117.84 1bqn n ALA 278 Ca -0.01 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.22 1bqn n ALA 278 Cb 0.02 -0.37 -0.08 0.00 0.00 0.00 0.00 19.45 19.02 1bqn n ALA 278 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1bqn n LEU 279 N -0.88 1.92 -0.11 0.00 7.94 -1.23 -4.15 117.00 120.48 1bqn n LEU 279 Ca 0.00 0.38 0.11 0.00 -1.11 0.00 0.00 56.01 55.39 1bqn n LEU 279 Cb 0.13 -0.84 0.47 0.00 0.53 0.00 0.00 43.42 43.71 1bqn n LEU 279 CO 0.00 0.25 1.19 0.77 -1.11 0.00 0.00 177.39 178.49 1bqn h SER 280 N -1.00 0.43 -0.84 1.96 4.64 0.32 0.21 113.55 119.27 1bqn h SER 280 Ca -0.43 0.01 0.02 0.00 -0.47 0.00 0.00 61.79 60.92 1bqn h SER 280 Cb 1.33 -0.08 -0.04 0.00 -0.31 0.00 0.00 62.40 63.29 1bqn h SER 280 CO -0.26 0.26 0.55 0.11 -0.87 0.00 0.00 176.83 176.63 1bqn h LYS 281 N 0.48 1.07 -0.27 4.77 6.56 -1.22 0.55 116.57 128.52 1bqn h LYS 281 Ca 0.29 -0.06 0.08 0.00 -1.06 0.00 0.00 60.65 59.89 1bqn h LYS 281 Cb 0.50 -0.24 -0.01 0.00 -0.57 0.00 0.00 32.23 31.91 1bqn h LYS 281 CO -0.09 0.71 0.43 1.25 -2.06 0.00 0.00 179.45 179.70 1bqn h LEU 282 N 1.10 0.00 -3.02 2.94 5.85 -0.74 0.80 115.31 122.25 1bqn h LEU 282 Ca 0.31 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.03 1bqn h LEU 282 Cb -0.08 0.00 0.00 0.00 0.37 0.00 0.00 40.66 40.95 1bqn h LEU 282 CO -0.08 0.00 0.00 0.18 -0.34 0.00 0.00 178.44 178.20 1bqn n LEU 283 N -3.37 2.39 0.00 2.25 4.32 0.13 -4.71 117.00 118.00 1bqn n LEU 283 Ca 0.04 -2.76 0.00 0.00 -0.02 0.00 0.00 56.01 53.27 1bqn n LEU 283 Cb 0.56 -0.32 0.02 0.00 -1.62 0.00 0.00 43.42 42.06 1bqn n LEU 283 CO 0.22 0.65 0.46 -2.11 -1.22 0.00 0.00 177.39 175.38 1bqn n ARG 284 N -1.06 0.01 -4.21 3.23 1.85 0.27 -4.64 116.66 112.11 1bqn n ARG 284 Ca 0.12 0.38 -0.31 0.00 -1.00 0.00 0.00 57.85 57.03 1bqn n ARG 284 Cb 0.55 -1.50 -0.08 0.00 -1.05 0.00 0.00 32.46 30.38 1bqn n ARG 284 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 1bqn s GLY 285 N -2.77 1.90 -0.81 2.89 0.00 -1.26 -5.04 107.32 102.22 1bqn s GLY 285 Ca 0.01 -1.03 -0.25 0.00 0.00 0.00 0.00 44.72 43.44 1bqn s GLY 285 CO 0.01 -0.96 1.89 -0.51 0.00 0.00 0.00 173.10 173.53 1bqn s THR 286 N -1.20 3.44 0.34 0.90 -4.23 -1.26 -4.93 115.64 108.70 1bqn s THR 286 Ca 0.23 -0.19 0.07 0.00 -1.18 0.00 0.00 61.69 60.61 1bqn s THR 286 Cb -0.12 -4.04 -0.07 0.00 1.34 0.00 0.00 72.50 69.62 1bqn s THR 286 CO 0.15 -0.99 -0.02 -0.54 -0.54 0.00 0.00 174.62 172.68 1bqn s LYS 287 N 6.92 1.75 0.14 3.99 1.02 -1.26 -5.12 119.74 127.18 1bqn s LYS 287 Ca 0.68 -1.94 -0.30 0.00 0.02 0.00 0.00 55.97 54.42 1bqn s LYS 287 Cb -0.08 -1.36 -0.07 0.00 -0.52 0.00 0.00 37.83 35.80 1bqn s LYS 287 CO 0.06 -0.01 1.16 0.00 -0.92 0.00 0.00 175.35 175.64 1bqn s ALA 288 N -2.90 3.39 0.31 5.17 0.00 -1.26 -4.95 121.76 121.53 1bqn s ALA 288 Ca 0.33 0.87 0.05 0.00 0.00 0.00 0.00 51.96 53.21 1bqn s ALA 288 Cb 0.06 -3.40 0.51 0.00 0.00 0.00 0.00 23.12 20.29 1bqn s ALA 288 CO 0.15 -0.34 1.76 -0.07 0.00 0.00 0.00 175.76 177.27 1bqn h LEU 289 N 5.74 0.37 0.00 0.00 3.38 -2.00 -2.17 115.31 120.63 1bqn h LEU 289 Ca -0.43 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.42 1bqn h LEU 289 Cb 1.21 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.86 1bqn h LEU 289 CO 0.76 0.63 0.00 0.41 0.09 0.00 0.00 178.44 180.33 1bqn n THR 290 N -4.13 0.00 -2.68 0.22 -1.04 -1.26 -3.17 114.28 102.22 1bqn n THR 290 Ca -0.01 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.58 1bqn n THR 290 Cb 0.39 -0.07 -0.03 0.00 -1.82 0.00 0.00 70.33 68.80 1bqn n THR 290 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1bqn s GLU 291 N -2.00 3.34 -0.88 -2.82 2.12 -0.82 -4.93 118.70 112.71 1bqn s GLU 291 Ca 0.05 -0.14 -0.24 0.00 0.36 0.00 0.00 54.97 55.00 1bqn s GLU 291 Cb 0.02 -4.09 -0.18 0.00 0.26 0.00 0.00 34.13 30.14 1bqn s GLU 291 CO 0.04 -1.75 2.23 0.28 -0.54 0.00 0.00 175.26 175.52 1bqn n VAL 292 N 6.38 0.00 -3.67 3.70 0.31 -1.26 -3.26 118.33 120.53 1bqn n VAL 292 Ca 0.04 -0.32 -0.39 0.00 -0.01 0.00 0.00 64.34 63.66 1bqn n VAL 292 Cb 0.48 -1.80 -0.12 0.00 -0.91 0.00 0.00 33.84 31.50 1bqn n VAL 292 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 1bqn s ILE 293 N 14.40 4.24 1.03 2.52 -4.36 -0.74 -4.95 121.20 133.34 1bqn s ILE 293 Ca 0.87 -0.88 -0.12 0.00 -0.26 0.00 0.00 60.65 60.27 1bqn s ILE 293 Cb -0.14 -3.33 0.21 0.00 1.25 0.00 0.00 42.46 40.45 1bqn s ILE 293 CO 0.15 -0.14 1.07 -2.84 0.24 0.00 0.00 174.94 173.42 1bqn s PRO 294 N 1.50 0.18 0.75 0.37 0.02 -1.26 -4.60 135.00 131.97 1bqn s PRO 294 Ca 0.01 0.75 -0.11 0.00 0.02 0.00 0.00 61.00 61.67 1bqn s PRO 294 Cb -0.19 -1.69 0.04 0.00 0.02 0.00 0.00 34.50 32.69 1bqn s PRO 294 CO 0.05 -2.96 1.08 -0.51 -0.33 0.00 0.00 177.00 174.33 1bqn s LEU 295 N -6.67 2.86 0.63 -5.54 1.43 -1.26 -5.06 118.68 105.07 1bqn s LEU 295 Ca 0.66 1.49 -0.06 0.00 -1.03 0.00 0.00 54.13 55.20 1bqn s LEU 295 Cb -0.21 -4.22 0.03 0.00 0.03 0.00 0.00 46.19 41.82 1bqn s LEU 295 CO 0.60 -1.76 0.93 0.42 0.23 0.00 0.00 176.35 176.77 1bqn s THR 296 N -3.08 3.02 0.04 5.49 -4.23 -1.26 -5.01 115.64 110.62 1bqn s THR 296 Ca 0.60 -0.17 -0.29 0.00 -1.18 0.00 0.00 61.69 60.65 1bqn s THR 296 Cb -0.15 -3.24 -0.17 0.00 1.34 0.00 0.00 72.50 70.29 1bqn s THR 296 CO 0.55 -0.24 1.43 1.05 -0.54 0.00 0.00 174.62 176.87 1bqn h GLU 297 N -0.32 -0.66 0.00 3.99 4.11 -1.98 -3.16 114.58 116.56 1bqn h GLU 297 Ca -0.45 0.04 0.00 0.00 0.07 0.00 0.00 59.36 59.03 1bqn h GLU 297 Cb 1.28 0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.68 1bqn h GLU 297 CO 0.60 -0.37 0.00 1.05 0.07 0.00 0.00 179.01 180.36 1bqn h GLU 298 N -0.84 0.00 -0.24 1.06 4.11 -1.95 -3.16 114.58 113.56 1bqn h GLU 298 Ca -0.07 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.27 1bqn h GLU 298 Cb 0.59 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.83 1bqn h GLU 298 CO 0.11 0.00 -0.22 0.00 0.07 0.00 0.00 179.01 178.97 1bqn h ALA 299 N 2.25 0.34 -1.05 1.06 0.00 -1.71 -3.13 119.26 117.02 1bqn h ALA 299 Ca 0.00 -0.37 0.28 0.00 0.00 0.00 0.00 54.91 54.82 1bqn h ALA 299 Cb 0.43 -0.07 -0.10 0.00 0.00 0.00 0.00 17.79 18.05 1bqn h ALA 299 CO 0.00 0.30 0.68 1.49 0.00 0.00 0.00 179.25 181.72 1bqn h GLU 300 N 0.27 0.36 -0.27 0.00 4.57 -1.60 -0.05 114.58 117.86 1bqn h GLU 300 Ca 0.04 -0.02 0.04 0.00 -1.18 0.00 0.00 59.36 58.24 1bqn h GLU 300 Cb 0.77 -0.08 -0.04 0.00 -0.16 0.00 0.00 28.75 29.24 1bqn h GLU 300 CO 0.06 0.24 0.03 -0.07 -1.18 0.00 0.00 179.01 178.09 1bqn h LEU 301 N 0.37 -0.04 -1.81 1.64 3.38 -1.74 0.74 115.31 117.85 1bqn h LEU 301 Ca 0.61 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.60 1bqn h LEU 301 Cb 1.56 0.08 -0.00 0.00 0.09 0.00 0.00 40.66 42.39 1bqn h LEU 301 CO -0.30 0.02 -0.15 -0.33 0.09 0.00 0.00 178.44 177.77 1bqn h GLU 302 N 0.13 0.00 0.00 1.13 4.39 -1.13 0.80 114.58 119.90 1bqn h GLU 302 Ca 0.13 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.80 1bqn h GLU 302 Cb 0.15 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.79 1bqn h GLU 302 CO -0.19 0.15 -0.15 1.25 -1.16 0.00 0.00 179.01 178.90 1bqn h LEU 303 N 0.00 0.00 -0.34 1.33 5.85 -0.98 -3.23 115.31 117.93 1bqn h LEU 303 Ca -0.00 -0.83 0.02 0.00 0.84 0.00 0.00 57.88 57.91 1bqn h LEU 303 Cb 0.31 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 1bqn h LEU 303 CO 0.02 1.00 0.19 0.00 -0.34 0.00 0.00 178.44 179.31 1bqn h ALA 304 N -0.17 0.42 0.66 1.25 0.00 0.11 1.03 119.26 122.56 1bqn h ALA 304 Ca -0.04 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1bqn h ALA 304 Cb 0.93 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.64 1bqn h ALA 304 CO -0.02 -0.17 -0.32 1.05 0.00 0.00 0.00 179.25 179.79 1bqn h GLU 305 N 0.39 -0.85 0.00 0.00 -0.00 0.43 -2.15 114.58 112.40 1bqn h GLU 305 Ca 0.14 0.06 -0.03 0.00 -0.00 0.00 0.00 59.36 59.53 1bqn h GLU 305 Cb 0.02 0.19 -0.00 0.00 -0.00 0.00 0.00 28.75 28.96 1bqn h GLU 305 CO -0.07 -0.54 -0.13 -0.91 -0.00 0.00 0.00 179.01 177.36 1bqn h ASN 306 N -0.97 0.00 0.03 3.06 2.35 -1.56 -0.02 115.58 118.47 1bqn h ASN 306 Ca -0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 1bqn h ASN 306 Cb 0.70 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.07 1bqn h ASN 306 CO 0.15 0.13 0.00 -1.14 -1.65 0.00 0.00 177.43 174.92 1bqn n ARG 307 N -4.27 0.54 0.00 0.81 0.63 0.36 -2.41 116.66 112.32 1bqn n ARG 307 Ca -0.03 0.01 0.00 0.00 -0.92 0.00 0.00 57.85 56.92 1bqn n ARG 307 Cb 0.20 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 31.61 1bqn n ARG 307 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1bqn n GLU 308 N -1.03 -0.39 0.20 -0.14 -0.58 -0.04 -4.59 120.64 114.08 1bqn n GLU 308 Ca 0.13 -0.52 0.10 0.00 -0.42 0.00 0.00 57.16 56.46 1bqn n GLU 308 Cb 0.07 -0.90 0.15 0.00 -0.57 0.00 0.00 31.44 30.19 1bqn n GLU 308 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 1bqn h ILE 309 N 0.25 0.18 0.52 -3.67 2.04 -1.28 -3.32 117.51 112.22 1bqn h ILE 309 Ca 0.00 -1.24 -0.03 0.00 1.00 0.00 0.00 64.86 64.59 1bqn h ILE 309 Cb 0.16 2.08 0.01 0.00 -0.74 0.00 0.00 36.82 38.32 1bqn h ILE 309 CO 0.00 0.10 -0.25 -0.07 0.00 0.00 0.00 178.15 177.93 1bqn h LEU 310 N 0.00 -0.59 -0.07 1.44 -0.00 -1.81 -3.16 115.31 111.13 1bqn h LEU 310 Ca -0.00 0.02 0.00 0.00 -0.00 0.00 0.00 57.88 57.90 1bqn h LEU 310 Cb 1.07 0.15 0.00 0.00 -0.00 0.00 0.00 40.66 41.88 1bqn h LEU 310 CO 0.01 -0.41 0.00 0.29 -0.00 0.00 0.00 178.44 178.33 1bqn n LYS 311 N -3.92 0.00 -2.68 1.13 4.01 -1.25 -3.96 118.16 111.49 1bqn n LYS 311 Ca -0.09 0.00 -0.04 0.00 -0.51 0.00 0.00 58.31 57.67 1bqn n LYS 311 Cb 0.27 -0.99 0.05 0.00 -0.51 0.00 0.00 35.03 33.85 1bqn n LYS 311 CO 0.00 0.00 0.00 0.39 -1.11 0.00 0.00 177.40 176.68 1bqn n GLU 312 N -0.35 0.17 -2.01 1.97 4.71 -1.19 -5.18 120.64 118.76 1bqn n GLU 312 Ca 0.00 -0.90 -0.28 0.00 -0.01 0.00 0.00 57.16 55.97 1bqn n GLU 312 Cb 0.00 -0.17 0.07 0.00 -1.01 0.00 0.00 31.44 30.33 1bqn n GLU 312 CO 0.00 0.00 0.00 -2.14 0.09 0.00 0.00 177.13 175.08 1bqn s PRO 313 N 0.70 2.27 0.11 3.49 0.02 -1.25 -4.96 135.00 135.38 1bqn s PRO 313 Ca 0.25 0.08 -0.06 0.00 0.02 0.00 0.00 61.00 61.29 1bqn s PRO 313 Cb 0.15 -2.05 -0.01 0.00 0.02 0.00 0.00 34.50 32.61 1bqn s PRO 313 CO -0.10 -1.32 0.16 0.14 -0.33 0.00 0.00 177.00 175.55 1bqn s VAL 314 N -3.41 0.13 -0.01 3.83 -7.23 -1.26 -5.01 120.40 107.45 1bqn s VAL 314 Ca 0.60 -1.44 -0.00 0.00 -1.81 0.00 0.00 61.98 59.33 1bqn s VAL 314 Cb -0.11 -1.61 0.00 0.00 0.56 0.00 0.00 36.38 35.22 1bqn s VAL 314 CO 0.48 -0.58 0.01 1.57 -0.31 0.00 0.00 175.10 176.27 1bqn n HIS 315 N -0.08 -0.03 0.00 2.82 -0.00 -1.26 -4.82 115.22 111.85 1bqn n HIS 315 Ca -0.11 0.01 0.00 0.00 -0.00 0.00 0.00 57.72 57.62 1bqn n HIS 315 Cb 0.63 -0.36 0.00 0.00 -0.00 0.00 0.00 29.99 30.26 1bqn n HIS 315 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1bqn n GLY 316 N 0.74 -0.81 2.59 1.57 0.00 -1.26 -5.00 105.19 103.02 1bqn n GLY 316 Ca -0.00 0.24 -0.10 0.00 0.00 0.00 0.00 46.02 46.15 1bqn n GLY 316 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1bqn n VAL 317 N -0.93 0.00 -3.17 1.61 0.31 -1.26 -4.76 118.33 110.13 1bqn n VAL 317 Ca 0.00 -0.39 0.03 0.00 -0.01 0.00 0.00 64.34 63.96 1bqn n VAL 317 Cb 0.00 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 32.91 1bqn n VAL 317 CO 0.00 0.00 0.00 -0.47 -1.32 0.00 0.00 176.83 175.04 1bqn s TYR 318 N 0.00 -1.54 -0.09 3.52 5.04 -1.26 -5.16 117.35 117.87 1bqn s TYR 318 Ca 0.62 1.62 -0.06 0.00 -2.44 0.00 0.00 57.07 56.81 1bqn s TYR 318 Cb -0.40 0.51 -0.04 0.00 0.35 0.00 0.00 41.96 42.38 1bqn s TYR 318 CO 0.27 -0.87 0.15 -0.47 -1.34 0.00 0.00 175.55 173.29 1bqn s TYR 319 N 2.83 3.58 -0.29 4.97 5.04 -1.26 -5.04 117.35 127.17 1bqn s TYR 319 Ca 0.20 0.48 -0.03 0.00 -2.44 0.00 0.00 57.07 55.28 1bqn s TYR 319 Cb -0.15 -1.91 0.04 0.00 0.35 0.00 0.00 41.96 40.29 1bqn s TYR 319 CO -0.21 0.71 0.01 0.34 -1.34 0.00 0.00 175.55 175.06 1bqn s ASP 320 N -1.28 4.84 0.00 4.32 2.15 -1.26 -4.98 116.67 120.45 1bqn s ASP 320 Ca 0.18 -1.09 0.21 0.00 0.43 0.00 0.00 52.55 52.29 1bqn s ASP 320 Cb -0.12 -1.74 1.23 0.00 -0.30 0.00 0.00 42.92 41.99 1bqn s ASP 320 CO 0.08 -0.23 1.67 -2.65 -0.17 0.00 0.00 175.17 173.87 1bqn n PRO 321 N 4.69 0.57 -0.58 4.34 -0.02 -1.26 -2.65 135.00 140.09 1bqn n PRO 321 Ca -0.14 0.03 0.03 0.00 -2.02 0.00 0.00 63.50 61.39 1bqn n PRO 321 Cb 0.45 -1.50 0.22 0.00 -0.02 0.00 0.00 33.50 32.65 1bqn n PRO 321 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1bqn n SER 322 N -1.08 3.14 -4.08 2.55 7.64 -1.26 -4.99 113.62 115.54 1bqn n SER 322 Ca 0.14 -3.36 -0.11 0.00 1.01 0.00 0.00 58.87 56.55 1bqn n SER 322 Cb 0.10 -0.58 -0.08 0.00 -1.01 0.00 0.00 64.21 62.64 1bqn n SER 322 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1bqn s LYS 323 N -3.02 1.38 -0.15 1.43 3.01 -1.08 -5.18 119.74 116.13 1bqn s LYS 323 Ca 0.43 -1.46 0.01 0.00 -1.01 0.00 0.00 55.97 53.94 1bqn s LYS 323 Cb 0.37 0.37 0.02 0.00 -1.01 0.00 0.00 37.83 37.57 1bqn s LYS 323 CO 0.04 -0.52 -0.19 -0.51 0.51 0.00 0.00 175.35 174.68 1bqn s ASP 324 N -3.10 2.97 0.57 2.83 1.11 -1.26 -4.90 116.67 114.90 1bqn s ASP 324 Ca 0.31 -0.58 -0.19 0.00 0.18 0.00 0.00 52.55 52.27 1bqn s ASP 324 Cb 0.03 -1.37 -0.07 0.00 1.07 0.00 0.00 42.92 42.58 1bqn s ASP 324 CO 0.11 0.02 0.78 0.18 1.18 0.00 0.00 175.17 177.44 1bqn n LEU 325 N 4.41 2.38 -3.95 1.23 4.77 -1.26 -4.81 117.00 119.75 1bqn n LEU 325 Ca -0.20 0.80 -0.24 0.00 -0.03 0.00 0.00 56.01 56.34 1bqn n LEU 325 Cb 0.51 -1.29 -0.17 0.00 -2.33 0.00 0.00 43.42 40.14 1bqn n LEU 325 CO 0.25 -2.33 -0.44 -0.63 -1.33 0.00 0.00 177.39 172.91 1bqn s ILE 326 N -1.58 0.92 0.09 -0.08 1.01 -1.02 -1.15 121.20 119.39 1bqn s ILE 326 Ca 0.72 -0.32 0.05 0.00 0.00 0.00 0.00 60.65 61.10 1bqn s ILE 326 Cb -0.44 -0.89 -0.04 0.00 0.01 0.00 0.00 42.46 41.09 1bqn s ILE 326 CO 0.51 0.32 -0.03 0.00 0.00 0.00 0.00 174.94 175.74 1bqn s ALA 327 N 1.00 3.19 -0.07 9.38 0.00 0.33 -2.25 121.76 133.34 1bqn s ALA 327 Ca -0.09 -1.14 -0.05 0.00 0.00 0.00 0.00 51.96 50.69 1bqn s ALA 327 Cb -0.15 -1.12 0.03 0.00 0.00 0.00 0.00 23.12 21.88 1bqn s ALA 327 CO -0.00 0.68 0.17 -1.83 0.00 0.00 0.00 175.76 174.78 1bqn s GLU 328 N -2.21 0.16 0.35 0.00 -1.05 -1.14 -0.42 118.70 114.39 1bqn s GLU 328 Ca 0.24 0.31 0.09 0.00 -0.15 0.00 0.00 54.97 55.46 1bqn s GLU 328 Cb -0.11 -0.02 -0.07 0.00 -0.44 0.00 0.00 34.13 33.49 1bqn s GLU 328 CO 0.16 -0.09 -0.08 0.42 0.95 0.00 0.00 175.26 176.63 1bqn s ILE 329 N 0.58 2.14 -0.18 1.83 1.01 -0.99 -1.67 121.20 123.92 1bqn s ILE 329 Ca -0.04 -2.17 -0.20 0.00 0.00 0.00 0.00 60.65 58.24 1bqn s ILE 329 Cb -0.06 -2.68 0.05 0.00 0.01 0.00 0.00 42.46 39.79 1bqn s ILE 329 CO -0.03 -0.18 0.56 0.00 0.00 0.00 0.00 174.94 175.29 1bqn s GLN 330 N -3.64 0.69 0.59 2.79 0.00 0.11 -4.43 119.66 115.76 1bqn s GLN 330 Ca 0.33 0.67 -0.15 0.00 -0.00 0.00 0.00 55.36 56.20 1bqn s GLN 330 Cb 0.04 0.33 -0.04 0.00 0.00 0.00 0.00 33.01 33.34 1bqn s GLN 330 CO 0.16 -0.11 1.04 0.21 0.00 0.00 0.00 175.29 176.59 1bqn s LYS 331 N 0.05 3.46 0.00 9.60 2.20 -1.26 -0.26 119.74 133.53 1bqn s LYS 331 Ca -0.02 1.08 0.00 0.00 -0.36 0.00 0.00 55.97 56.67 1bqn s LYS 331 Cb -0.04 -2.06 0.00 0.00 -1.51 0.00 0.00 37.83 34.22 1bqn s LYS 331 CO 0.02 -0.68 0.00 0.94 -0.36 0.00 0.00 175.35 175.27 1bqn n GLN 332 N -2.08 0.00 0.00 4.03 -0.06 -0.52 -4.87 117.38 113.88 1bqn n GLN 332 Ca 0.08 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.08 1bqn n GLN 332 Cb 0.53 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.71 1bqn n GLN 332 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1bqn n GLY 333 N 0.18 0.06 3.32 1.69 0.00 -1.10 -4.88 105.19 104.45 1bqn n GLY 333 Ca 0.00 -1.50 -0.44 0.00 0.00 0.00 0.00 46.02 44.08 1bqn n GLY 333 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1bqn n GLN 334 N 0.00 3.42 0.00 1.61 3.00 -1.26 -3.90 117.38 120.25 1bqn n GLN 334 Ca 0.00 -3.74 0.00 0.00 -0.01 0.00 0.00 57.00 53.25 1bqn n GLN 334 Cb 0.00 -3.03 0.00 0.00 0.00 0.00 0.00 30.24 27.21 1bqn n GLN 334 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1bqn n GLY 335 N 3.82 1.53 2.76 1.08 0.00 -1.26 -4.52 105.19 108.60 1bqn n GLY 335 Ca 0.38 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.14 1bqn n GLY 335 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1bqn s GLN 336 N -0.04 0.70 0.14 1.61 -0.21 -1.25 -0.91 119.66 119.70 1bqn s GLN 336 Ca 0.00 -0.22 0.00 0.00 0.02 0.00 0.00 55.36 55.16 1bqn s GLN 336 Cb 0.00 -1.67 0.00 0.00 1.00 0.00 0.00 33.01 32.34 1bqn s GLN 336 CO 0.00 -0.50 0.01 0.91 -2.12 0.00 0.00 175.29 173.60 1bqn n TRP 337 N 5.08 0.16 -3.59 0.91 7.02 -0.22 -1.43 117.44 125.37 1bqn n TRP 337 Ca -0.08 -0.69 -0.17 0.00 -1.02 0.00 0.00 57.50 55.54 1bqn n TRP 337 Cb 0.48 -0.10 -0.07 0.00 -2.42 0.00 0.00 31.31 29.21 1bqn n TRP 337 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 1bqn s THR 338 N -1.42 0.02 0.10 -0.99 -4.23 0.64 -1.99 115.64 107.76 1bqn s THR 338 Ca 0.01 -0.13 0.02 0.00 -1.18 0.00 0.00 61.69 60.41 1bqn s THR 338 Cb -0.00 -0.89 -0.04 0.00 1.34 0.00 0.00 72.50 72.91 1bqn s THR 338 CO 0.01 -0.07 -0.08 -0.72 -0.54 0.00 0.00 174.62 173.22 1bqn s TYR 339 N -1.21 0.94 -0.13 3.99 1.13 -0.65 0.04 117.35 121.46 1bqn s TYR 339 Ca -0.12 -0.82 -0.04 0.00 -1.41 0.00 0.00 57.07 54.69 1bqn s TYR 339 Cb -0.01 -0.53 0.06 0.00 -1.10 0.00 0.00 41.96 40.38 1bqn s TYR 339 CO 0.08 -0.09 0.20 -0.65 -2.51 0.00 0.00 175.55 172.58 1bqn s GLN 340 N -3.44 0.10 -0.40 -3.49 1.11 -0.67 -2.78 119.66 110.08 1bqn s GLN 340 Ca 0.09 0.47 -0.12 0.00 0.01 0.00 0.00 55.36 55.82 1bqn s GLN 340 Cb 0.02 -0.56 0.04 0.00 -1.01 0.00 0.00 33.01 31.50 1bqn s GLN 340 CO -0.03 -0.42 0.25 0.42 0.01 0.00 0.00 175.29 175.52 1bqn s ILE 341 N 2.32 4.66 0.00 1.08 1.01 0.03 -2.86 121.20 127.44 1bqn s ILE 341 Ca 0.04 -0.99 0.00 0.00 0.00 0.00 0.00 60.65 59.70 1bqn s ILE 341 Cb -0.13 -3.68 0.00 0.00 0.01 0.00 0.00 42.46 38.66 1bqn s ILE 341 CO -0.08 -0.35 0.00 0.00 0.00 0.00 0.00 174.94 174.51 1bqn n TYR 342 N 5.02 0.00 0.00 3.97 0.18 -0.95 -0.00 117.16 125.38 1bqn n TYR 342 Ca -0.11 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.67 1bqn n TYR 342 Cb 0.45 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.41 1bqn n TYR 342 CO 0.00 0.00 0.00 0.94 -2.08 0.00 0.00 176.86 175.72 1bqn n GLN 343 N 0.00 0.00 -3.58 -3.48 7.27 -1.25 -2.43 117.38 113.91 1bqn n GLN 343 Ca 0.00 0.00 -0.19 0.00 0.07 0.00 0.00 57.00 56.88 1bqn n GLN 343 Cb 0.00 0.00 -0.15 0.00 2.41 0.00 0.00 30.24 32.50 1bqn n GLN 343 CO 0.00 0.00 0.00 -2.00 0.07 0.00 0.00 177.06 175.13 1bqn s GLU 344 N -0.63 0.11 0.00 3.69 2.56 -1.26 -4.84 118.70 118.33 1bqn s GLU 344 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 54.97 55.25 1bqn s GLU 344 Cb 0.00 -1.00 0.00 0.00 2.00 0.00 0.00 34.13 35.13 1bqn s GLU 344 CO 0.00 -0.54 0.00 -2.30 -0.56 0.00 0.00 175.26 171.86 1bqn n PRO 345 N 5.31 0.00 0.00 4.30 -0.02 -1.26 -1.64 135.00 141.69 1bqn n PRO 345 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 1bqn n PRO 345 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.98 1bqn n PRO 345 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1bqn n PHE 346 N 0.00 0.00 -2.82 6.00 3.01 -1.26 -4.87 117.46 117.52 1bqn n PHE 346 Ca 0.00 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.03 1bqn n PHE 346 Cb 0.00 -0.41 -0.01 0.00 -0.01 0.00 0.00 39.48 39.05 1bqn n PHE 346 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1bqn s LYS 347 N 0.00 3.88 0.31 -1.08 -0.14 -0.65 -4.93 119.74 117.12 1bqn s LYS 347 Ca 0.00 -2.06 -0.29 0.00 -1.36 0.00 0.00 55.97 52.26 1bqn s LYS 347 Cb 0.00 -5.15 -0.10 0.00 -1.68 0.00 0.00 37.83 30.89 1bqn s LYS 347 CO 0.00 -1.92 1.30 -0.80 -0.76 0.00 0.00 175.35 173.17 1bqn s ASN 348 N 3.59 6.82 -0.10 2.83 0.01 -1.26 -3.79 114.94 123.04 1bqn s ASN 348 Ca 0.43 2.62 0.04 0.00 -0.71 0.00 0.00 52.86 55.24 1bqn s ASN 348 Cb -0.02 -2.64 -0.09 0.00 0.41 0.00 0.00 41.25 38.91 1bqn s ASN 348 CO -0.02 -0.52 -0.03 0.18 -1.51 0.00 0.00 177.10 175.20 1bqn n LEU 349 N 1.17 1.39 -3.64 0.60 4.77 0.99 -4.08 117.00 118.21 1bqn n LEU 349 Ca 0.01 -0.03 -0.08 0.00 -0.03 0.00 0.00 56.01 55.89 1bqn n LEU 349 Cb 0.42 -0.07 -0.07 0.00 -2.33 0.00 0.00 43.42 41.37 1bqn n LEU 349 CO 0.59 0.43 0.61 -0.75 -1.33 0.00 0.00 177.39 176.94 1bqn s LYS 350 N -2.21 0.55 0.09 3.23 2.36 -0.96 -4.97 119.74 117.83 1bqn s LYS 350 Ca -0.09 0.78 0.03 0.00 -2.55 0.00 0.00 55.97 54.13 1bqn s LYS 350 Cb 0.03 0.20 -0.04 0.00 -1.05 0.00 0.00 37.83 36.98 1bqn s LYS 350 CO 0.31 -0.09 -0.08 0.95 1.55 0.00 0.00 175.35 177.99 1bqn s THR 351 N 0.80 0.77 -0.15 3.43 -4.23 -1.26 -0.79 115.64 114.22 1bqn s THR 351 Ca -0.03 -1.69 -0.34 0.00 -1.18 0.00 0.00 61.69 58.46 1bqn s THR 351 Cb -0.05 -1.38 0.14 0.00 1.34 0.00 0.00 72.50 72.55 1bqn s THR 351 CO -0.10 -0.67 1.26 -0.83 -0.54 0.00 0.00 174.62 173.74 1bqn s GLY 352 N -2.58 -0.33 -0.48 3.99 0.00 -1.12 -4.96 107.32 101.85 1bqn s GLY 352 Ca 0.06 1.35 -0.11 0.00 0.00 0.00 0.00 44.72 46.02 1bqn s GLY 352 CO -0.02 0.41 0.37 1.25 0.00 0.00 0.00 173.10 175.11 1bqn s LYS 353 N -2.37 2.62 -0.67 2.90 2.20 -1.26 -1.63 119.74 121.53 1bqn s LYS 353 Ca 0.11 -1.69 -0.26 0.00 -0.36 0.00 0.00 55.97 53.77 1bqn s LYS 353 Cb 0.01 -3.99 -0.04 0.00 -1.51 0.00 0.00 37.83 32.29 1bqn s LYS 353 CO -0.04 -1.18 2.02 -0.47 -0.36 0.00 0.00 175.35 175.32 1bqn s TYR 354 N 1.43 1.54 0.00 4.03 5.04 -0.84 -4.81 117.35 123.75 1bqn s TYR 354 Ca 0.05 0.99 0.00 0.00 -2.44 0.00 0.00 57.07 55.67 1bqn s TYR 354 Cb -0.26 -3.94 0.00 0.00 0.35 0.00 0.00 41.96 38.11 1bqn s TYR 354 CO 0.01 -2.17 0.00 0.00 -1.34 0.00 0.00 175.55 172.05 1bqn n ALA 355 N 14.06 0.00 0.00 3.97 0.00 -1.26 -1.05 120.51 136.24 1bqn n ALA 355 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.74 1bqn n ALA 355 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 1bqn n ALA 355 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1bqn n ARG 356 N -0.89 0.00 -0.64 0.00 5.12 -0.09 -4.75 116.66 115.42 1bqn n ARG 356 Ca 0.00 0.00 -0.29 0.00 -1.93 0.00 0.00 57.85 55.63 1bqn n ARG 356 Cb 0.00 0.00 0.22 0.00 -1.16 0.00 0.00 32.46 31.52 1bqn n ARG 356 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1bqn s MET 357 N -2.30 -0.34 -0.07 5.56 0.00 -1.26 -4.63 119.30 116.25 1bqn s MET 357 Ca 0.00 0.98 -0.02 0.00 0.00 0.00 0.00 55.69 56.65 1bqn s MET 357 Cb 0.00 -1.61 -0.26 0.00 0.00 0.00 0.00 34.83 32.96 1bqn s MET 357 CO 0.00 -3.38 0.55 0.07 0.00 0.00 0.00 175.02 172.26 1bqn h ARG 358 N -2.38 0.21 -0.02 3.16 0.11 -1.97 -3.36 114.38 110.13 1bqn h ARG 358 Ca -0.57 -0.36 0.00 0.00 0.10 0.00 0.00 59.98 59.15 1bqn h ARG 358 Cb 1.32 0.14 0.00 0.00 1.11 0.00 0.00 29.97 32.53 1bqn h ARG 358 CO 0.49 1.04 0.00 0.41 0.10 0.00 0.00 179.97 182.01 1bqn n GLY 359 N 1.82 0.09 3.89 0.08 0.00 -1.26 -4.95 105.19 104.86 1bqn n GLY 359 Ca -0.25 -0.47 -0.29 0.00 0.00 0.00 0.00 46.02 45.01 1bqn n GLY 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bqn s ALA 360 N -1.99 2.86 -0.55 4.61 0.00 -1.26 -4.93 121.76 120.50 1bqn s ALA 360 Ca 0.37 -0.47 -0.26 0.00 0.00 0.00 0.00 51.96 51.60 1bqn s ALA 360 Cb 0.21 -2.97 -0.06 0.00 0.00 0.00 0.00 23.12 20.30 1bqn s ALA 360 CO 0.33 -1.28 2.24 -3.38 0.00 0.00 0.00 175.76 173.67 1bqn s HIS 361 N -3.40 1.26 0.00 0.00 -3.43 -1.26 -4.78 115.29 103.68 1bqn s HIS 361 Ca 0.59 1.34 0.00 0.00 -0.80 0.00 0.00 55.06 56.19 1bqn s HIS 361 Cb -0.11 -3.73 0.00 0.00 -1.43 0.00 0.00 32.58 27.31 1bqn s HIS 361 CO 0.50 -2.41 0.71 2.41 -2.00 0.00 0.00 174.74 173.96 1bqn n THR 362 N 7.80 0.71 -2.45 -5.38 -1.04 -1.26 -4.85 114.28 107.80 1bqn n THR 362 Ca 0.32 -0.13 -0.43 0.00 -2.04 0.00 0.00 64.05 61.78 1bqn n THR 362 Cb 0.53 -1.01 -0.02 0.00 -1.82 0.00 0.00 70.33 68.01 1bqn n THR 362 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1bqn s ASN 363 N 1.57 6.70 0.09 8.00 3.84 -1.26 -4.88 114.94 129.00 1bqn s ASN 363 Ca 0.00 1.16 -0.22 0.00 0.21 0.00 0.00 52.86 54.00 1bqn s ASN 363 Cb 0.00 -2.54 -0.07 0.00 -0.55 0.00 0.00 41.25 38.09 1bqn s ASN 363 CO 0.00 -1.07 1.37 0.44 -2.79 0.00 0.00 177.10 175.06 1bqn h ASP 364 N 9.16 -1.29 0.09 -4.21 3.32 -2.00 0.15 116.42 121.65 1bqn h ASP 364 Ca -0.25 0.17 0.00 0.00 0.02 0.00 0.00 57.03 56.97 1bqn h ASP 364 Cb 1.09 0.53 0.00 0.00 0.22 0.00 0.00 39.33 41.17 1bqn h ASP 364 CO 1.04 -0.27 0.00 0.58 -1.72 0.00 0.00 179.24 178.87 1bqn h VAL 365 N -0.25 0.00 0.18 -1.35 2.07 -1.98 0.22 116.25 115.14 1bqn h VAL 365 Ca 0.05 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.53 1bqn h VAL 365 Cb 0.40 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1bqn h VAL 365 CO -0.42 0.00 -0.09 0.50 0.02 0.00 0.00 177.57 177.58 1bqn h LYS 366 N 0.00 -0.24 0.06 1.57 3.64 -1.09 -2.70 116.57 117.82 1bqn h LYS 366 Ca 0.00 0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.42 1bqn h LYS 366 Cb 0.05 0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.87 1bqn h LYS 366 CO 0.00 0.17 -0.33 1.96 -2.27 0.00 0.00 179.45 178.97 1bqn h GLN 367 N -0.76 -0.51 0.02 1.90 4.20 -0.38 0.26 115.11 119.84 1bqn h GLN 367 Ca -0.03 0.03 0.03 0.00 0.06 0.00 0.00 58.65 58.75 1bqn h GLN 367 Cb 0.51 0.12 -0.04 0.00 0.30 0.00 0.00 27.48 28.37 1bqn h GLN 367 CO 0.04 -0.34 -0.23 1.25 -0.67 0.00 0.00 178.83 178.88 1bqn h LEU 368 N -0.53 -0.68 0.19 1.46 5.85 -0.78 2.39 115.31 123.22 1bqn h LEU 368 Ca 0.04 0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.85 1bqn h LEU 368 Cb 0.58 0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.89 1bqn h LEU 368 CO -0.23 -0.30 -0.09 0.74 -0.34 0.00 0.00 178.44 178.21 1bqn h THR 369 N -0.38 0.88 0.00 1.05 2.02 -1.18 -0.13 112.91 115.17 1bqn h THR 369 Ca 0.06 -0.34 -0.01 0.00 0.77 0.00 0.00 66.41 66.88 1bqn h THR 369 Cb 0.45 1.09 -0.00 0.00 -1.74 0.00 0.00 68.15 67.94 1bqn h THR 369 CO -0.20 0.08 -0.07 -0.33 0.37 0.00 0.00 175.52 175.37 1bqn h GLU 370 N -0.42 0.00 0.06 6.66 5.08 -0.31 -1.25 114.58 124.39 1bqn h GLU 370 Ca -0.03 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1bqn h GLU 370 Cb 0.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1bqn h GLU 370 CO 0.04 0.07 -0.03 0.00 -1.00 0.00 0.00 179.01 178.09 1bqn h ALA 371 N 1.93 -0.08 -0.81 3.43 0.00 0.49 -3.22 119.26 121.01 1bqn h ALA 371 Ca -0.00 -0.22 0.20 0.00 0.00 0.00 0.00 54.91 54.89 1bqn h ALA 371 Cb 0.20 0.03 -0.13 0.00 0.00 0.00 0.00 17.79 17.89 1bqn h ALA 371 CO 0.01 -0.32 0.13 0.28 0.00 0.00 0.00 179.25 179.35 1bqn h VAL 372 N -0.53 0.36 0.61 0.00 2.07 0.17 -1.41 116.25 117.53 1bqn h VAL 372 Ca -0.01 -0.06 -0.03 0.00 0.82 0.00 0.00 66.70 67.42 1bqn h VAL 372 Cb 0.46 0.17 0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1bqn h VAL 372 CO 0.01 0.03 -0.29 1.56 0.02 0.00 0.00 177.57 178.90 1bqn h GLN 373 N 0.18 -0.79 -1.63 1.57 4.20 -1.58 -2.41 115.11 114.65 1bqn h GLN 373 Ca 0.47 0.05 0.52 0.00 0.06 0.00 0.00 58.65 59.75 1bqn h GLN 373 Cb 0.88 0.18 -0.11 0.00 0.30 0.00 0.00 27.48 28.73 1bqn h GLN 373 CO -0.63 -0.48 1.12 1.63 -0.67 0.00 0.00 178.83 179.80 1bqn n LYS 374 N -5.37 -0.02 0.04 1.46 5.02 -0.60 0.12 118.16 118.82 1bqn n LYS 374 Ca -0.12 1.16 -0.01 0.00 -2.02 0.00 0.00 58.31 57.32 1bqn n LYS 374 Cb 0.35 -2.45 -0.01 0.00 -0.02 0.00 0.00 35.03 32.90 1bqn n LYS 374 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1bqn h ILE 375 N 0.00 0.00 -0.79 -0.18 1.08 -1.12 -3.34 117.51 113.17 1bqn h ILE 375 Ca 0.90 -0.02 0.16 0.00 -0.39 0.00 0.00 64.86 65.51 1bqn h ILE 375 Cb 3.23 0.00 -0.15 0.00 -3.07 0.00 0.00 36.82 36.83 1bqn h ILE 375 CO -0.26 0.00 -0.19 0.74 -0.69 0.00 0.00 178.15 177.75 1bqn h THR 376 N -0.11 0.21 0.00 -0.27 2.02 0.15 -0.51 112.91 114.39 1bqn h THR 376 Ca -0.01 -0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.13 1bqn h THR 376 Cb 0.07 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 66.68 1bqn h THR 376 CO 0.02 0.00 -0.17 0.71 0.37 0.00 0.00 175.52 176.44 1bqn h THR 377 N 0.00 1.12 -0.19 3.16 1.35 -1.38 -0.45 112.91 116.52 1bqn h THR 377 Ca 0.38 -0.59 -0.07 0.00 -0.55 0.00 0.00 66.41 65.58 1bqn h THR 377 Cb 0.59 1.32 -0.00 0.00 -1.73 0.00 0.00 68.15 68.32 1bqn h THR 377 CO -0.81 0.17 -0.17 -0.33 -0.25 0.00 0.00 175.52 174.13 1bqn h GLU 378 N 0.00 0.46 0.00 4.72 5.08 -1.25 0.19 114.58 123.77 1bqn h GLU 378 Ca -0.00 -0.23 0.00 0.00 -1.00 0.00 0.00 59.36 58.12 1bqn h GLU 378 Cb 0.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1bqn h GLU 378 CO 0.02 0.80 0.00 0.45 -1.00 0.00 0.00 179.01 179.28 1bqn n SER 379 N -4.48 0.31 0.00 1.42 2.88 -0.54 -0.40 113.62 112.80 1bqn n SER 379 Ca -0.05 0.61 0.00 0.00 -1.33 0.00 0.00 58.87 58.10 1bqn n SER 379 Cb 0.38 -0.66 0.00 0.00 -0.75 0.00 0.00 64.21 63.18 1bqn n SER 379 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 1bqn n ILE 380 N -1.88 0.00 -0.39 2.46 2.08 -0.29 -1.17 119.36 120.17 1bqn n ILE 380 Ca 0.01 0.50 0.32 0.00 0.56 0.00 0.00 62.75 64.14 1bqn n ILE 380 Cb 0.10 -1.49 0.54 0.00 -0.75 0.00 0.00 39.64 38.03 1bqn n ILE 380 CO 0.00 0.00 0.00 0.52 0.56 0.00 0.00 176.55 177.63 1bqn n VAL 381 N -2.26 -0.17 -0.12 1.39 0.31 0.63 0.14 118.33 118.25 1bqn n VAL 381 Ca 0.00 1.36 -0.24 0.00 -0.01 0.00 0.00 64.34 65.45 1bqn n VAL 381 Cb 0.00 -2.24 -0.09 0.00 -0.91 0.00 0.00 33.84 30.60 1bqn n VAL 381 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1bqn n ILE 382 N -4.15 1.52 -0.05 2.52 5.41 0.46 -3.57 119.36 121.50 1bqn n ILE 382 Ca 0.32 -0.20 -0.04 0.00 1.00 0.00 0.00 62.75 63.83 1bqn n ILE 382 Cb 1.25 -2.00 -0.09 0.00 -0.71 0.00 0.00 39.64 38.08 1bqn n ILE 382 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 176.55 177.34 1bqn n TRP 383 N -4.34 0.00 -2.41 1.39 8.01 -0.84 -4.94 117.44 114.32 1bqn n TRP 383 Ca -0.42 0.00 -0.00 0.00 -1.31 0.00 0.00 57.50 55.77 1bqn n TRP 383 Cb 0.76 -0.53 0.00 0.00 -2.01 0.00 0.00 31.31 29.53 1bqn n TRP 383 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1bqn n GLY 384 N 2.23 0.80 3.44 6.99 0.00 0.38 -4.95 105.19 114.07 1bqn n GLY 384 Ca -0.17 -0.71 -0.09 0.00 0.00 0.00 0.00 46.02 45.05 1bqn n GLY 384 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bqn s LYS 385 N -4.80 1.30 -0.21 1.61 -2.85 -0.89 -4.95 119.74 108.95 1bqn s LYS 385 Ca 0.01 -1.07 -0.08 0.00 -1.00 0.00 0.00 55.97 53.83 1bqn s LYS 385 Cb -0.00 0.44 -0.04 0.00 -2.06 0.00 0.00 37.83 36.17 1bqn s LYS 385 CO 0.01 -0.52 0.10 0.95 0.10 0.00 0.00 175.35 175.99 1bqn s THR 386 N -3.94 4.91 0.47 3.79 -4.23 -1.26 -4.07 115.64 111.30 1bqn s THR 386 Ca 0.15 0.02 -0.23 0.00 -1.18 0.00 0.00 61.69 60.44 1bqn s THR 386 Cb 0.01 -3.25 -0.07 0.00 1.34 0.00 0.00 72.50 70.53 1bqn s THR 386 CO 0.00 0.40 1.21 -2.84 -0.54 0.00 0.00 174.62 172.85 1bqn s PRO 387 N 0.84 3.68 -0.18 3.99 0.02 -1.26 -4.73 135.00 137.36 1bqn s PRO 387 Ca 0.05 1.89 -0.28 0.00 0.02 0.00 0.00 61.00 62.67 1bqn s PRO 387 Cb -0.13 -2.42 -0.00 0.00 0.02 0.00 0.00 34.50 31.96 1bqn s PRO 387 CO 0.02 -0.65 0.98 0.21 -0.33 0.00 0.00 177.00 177.24 1bqn s LYS 388 N -2.68 4.32 -0.23 5.54 2.20 -0.30 -4.21 119.74 124.38 1bqn s LYS 388 Ca 0.64 1.29 -0.18 0.00 -0.36 0.00 0.00 55.97 57.36 1bqn s LYS 388 Cb -0.31 -3.59 -0.03 0.00 -1.51 0.00 0.00 37.83 32.38 1bqn s LYS 388 CO 0.38 -0.46 0.50 -0.06 -0.36 0.00 0.00 175.35 175.35 1bqn s PHE 389 N 2.58 3.32 -0.54 4.03 0.08 -1.06 0.12 117.98 126.51 1bqn s PHE 389 Ca 0.44 0.69 -0.16 0.00 0.12 0.00 0.00 56.93 58.02 1bqn s PHE 389 Cb -0.16 -2.68 0.13 0.00 -0.57 0.00 0.00 43.02 39.73 1bqn s PHE 389 CO 0.11 -0.18 0.50 0.15 -0.10 0.00 0.00 175.22 175.71 1bqn s LYS 390 N 1.92 2.99 -0.13 0.44 1.02 0.44 -0.79 119.74 125.63 1bqn s LYS 390 Ca 0.22 -1.67 -0.23 0.00 0.02 0.00 0.00 55.97 54.30 1bqn s LYS 390 Cb -0.15 -4.29 -0.03 0.00 -0.52 0.00 0.00 37.83 32.84 1bqn s LYS 390 CO 0.09 -1.32 0.72 -0.51 -0.92 0.00 0.00 175.35 173.41 1bqn s LEU 391 N 1.65 4.23 -1.46 3.17 1.43 0.25 -2.34 118.68 125.61 1bqn s LEU 391 Ca 0.03 1.09 -0.14 0.00 -1.03 0.00 0.00 54.13 54.09 1bqn s LEU 391 Cb -0.29 -3.08 0.04 0.00 0.03 0.00 0.00 46.19 42.89 1bqn s LEU 391 CO 0.03 -0.23 2.25 -0.81 0.23 0.00 0.00 176.35 177.82 1bqn n PRO 392 N 4.50 2.87 -3.56 1.29 -0.04 -1.26 -0.31 135.00 138.49 1bqn n PRO 392 Ca 0.00 -2.59 -0.06 0.00 -0.04 0.00 0.00 63.50 60.81 1bqn n PRO 392 Cb 0.50 -3.28 -0.02 0.00 -0.04 0.00 0.00 33.50 30.66 1bqn n PRO 392 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1bqn s ILE 393 N 3.18 0.00 0.19 0.52 2.07 -1.26 -5.02 121.20 120.88 1bqn s ILE 393 Ca 0.48 0.00 -0.31 0.00 -1.41 0.00 0.00 60.65 59.41 1bqn s ILE 393 Cb 0.14 -1.00 -0.10 0.00 0.13 0.00 0.00 42.46 41.64 1bqn s ILE 393 CO -0.09 0.00 1.47 -1.58 -1.91 0.00 0.00 174.94 172.83 1bqn s GLN 394 N -2.52 4.27 0.01 3.50 0.74 -1.26 -4.60 119.66 119.80 1bqn s GLN 394 Ca 0.07 2.26 -0.02 0.00 0.05 0.00 0.00 55.36 57.71 1bqn s GLN 394 Cb -0.01 -3.16 -0.01 0.00 1.10 0.00 0.00 33.01 30.93 1bqn s GLN 394 CO -0.06 -0.48 1.04 -0.22 -0.55 0.00 0.00 175.29 175.02 1bqn h LYS 395 N 6.04 -0.04 0.00 1.67 3.64 -1.96 -0.79 116.57 125.12 1bqn h LYS 395 Ca -0.44 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.94 1bqn h LYS 395 Cb 1.21 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 1bqn h LYS 395 CO 0.84 -0.03 0.22 0.93 -2.27 0.00 0.00 179.45 179.15 1bqn h GLU 396 N -0.04 0.00 0.13 1.90 3.07 -1.94 0.25 114.58 117.94 1bqn h GLU 396 Ca 0.00 0.00 -0.32 0.00 -0.50 0.00 0.00 59.36 58.54 1bqn h GLU 396 Cb 0.05 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 27.95 1bqn h GLU 396 CO -0.03 0.00 -1.62 1.15 -1.40 0.00 0.00 179.01 177.11 1bqn h THR 397 N 0.00 1.05 -0.04 1.13 2.02 -1.74 -3.14 112.91 112.19 1bqn h THR 397 Ca 0.00 -2.70 -0.10 0.00 0.77 0.00 0.00 66.41 64.39 1bqn h THR 397 Cb 0.45 2.72 0.01 0.00 -1.74 0.00 0.00 68.15 69.59 1bqn h THR 397 CO 0.00 0.81 -0.35 -0.25 0.37 0.00 0.00 175.52 176.10 1bqn h TRP 398 N 0.07 0.42 0.00 3.16 2.91 0.78 -2.06 115.95 121.24 1bqn h TRP 398 Ca -0.28 -0.20 0.00 0.00 1.13 0.00 0.00 58.89 59.54 1bqn h TRP 398 Cb 2.03 -0.06 0.00 0.00 -0.51 0.00 0.00 29.16 30.63 1bqn h TRP 398 CO 0.07 0.97 0.00 0.39 -1.03 0.00 0.00 178.44 178.84 1bqn n GLU 399 N -4.41 0.21 0.00 2.65 1.02 0.25 -1.19 120.64 119.17 1bqn n GLU 399 Ca -0.09 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.05 1bqn n GLU 399 Cb 0.53 -1.07 0.00 0.00 -0.02 0.00 0.00 31.44 30.88 1bqn n GLU 399 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1bqn n THR 400 N -0.57 0.00 -0.52 2.62 -1.04 -1.06 -4.95 114.28 108.76 1bqn n THR 400 Ca 0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 1bqn n THR 400 Cb 0.00 -0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1bqn n THR 400 CO 0.00 0.00 0.00 0.79 -0.64 0.00 0.00 175.07 175.22 1bqn n TRP 401 N -1.19 0.00 -0.05 -1.42 7.02 -0.34 -4.85 117.44 116.62 1bqn n TRP 401 Ca 0.00 -0.12 -0.13 0.00 -1.02 0.00 0.00 57.50 56.23 1bqn n TRP 401 Cb 0.11 -0.01 -0.08 0.00 -2.42 0.00 0.00 31.31 28.92 1bqn n TRP 401 CO 0.00 0.00 0.00 0.11 -2.02 0.00 0.00 177.69 175.78 1bqn h TRP 402 N 0.00 0.35 0.00 -5.99 5.08 -1.76 -2.92 115.95 110.70 1bqn h TRP 402 Ca 0.00 -0.10 0.00 0.00 1.08 0.00 0.00 58.89 59.87 1bqn h TRP 402 Cb 0.52 -0.07 0.00 0.00 -3.00 0.00 0.00 29.16 26.60 1bqn h TRP 402 CO 0.00 0.70 0.35 -2.37 -1.28 0.00 0.00 178.44 175.84 1bqn n THR 403 N -4.61 0.66 0.04 0.12 5.66 -1.26 -0.37 114.28 114.52 1bqn n THR 403 Ca -0.07 0.63 -0.22 0.00 -3.05 0.00 0.00 64.05 61.35 1bqn n THR 403 Cb 0.34 -1.63 -0.14 0.00 -1.55 0.00 0.00 70.33 67.35 1bqn n THR 403 CO 0.00 0.00 0.00 -0.08 -3.05 0.00 0.00 175.07 171.94 1bqn h GLU 404 N 0.00 0.31 -0.29 1.09 4.57 -1.86 -3.40 114.58 115.00 1bqn h GLU 404 Ca 0.00 -0.53 0.00 0.00 -1.18 0.00 0.00 59.36 57.65 1bqn h GLU 404 Cb 0.69 0.20 0.00 0.00 -0.16 0.00 0.00 28.75 29.48 1bqn h GLU 404 CO 0.00 1.26 0.00 0.66 -1.18 0.00 0.00 179.01 179.75 1bqn n TYR 405 N -3.73 0.56 -1.51 0.92 4.02 0.50 -4.86 117.16 113.07 1bqn n TYR 405 Ca -0.26 -0.63 -0.40 0.00 -0.01 0.00 0.00 57.90 56.60 1bqn n TYR 405 Cb 1.00 -0.12 -0.01 0.00 -0.02 0.00 0.00 39.34 40.18 1bqn n TYR 405 CO 0.00 0.00 0.00 1.87 -1.01 0.00 0.00 176.86 177.72 1bqn n TRP 406 N 0.07 2.96 -1.60 -0.72 -0.00 -0.86 -4.68 117.44 112.62 1bqn n TRP 406 Ca 0.14 -2.90 -0.40 0.00 -0.00 0.00 0.00 57.50 54.34 1bqn n TRP 406 Cb 0.56 -2.45 -0.01 0.00 -0.00 0.00 0.00 31.31 29.41 1bqn n TRP 406 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 177.69 178.73 1bqn n GLN 407 N 5.24 3.48 -3.71 5.87 6.02 -1.26 -4.86 117.38 128.16 1bqn n GLN 407 Ca 0.60 -2.56 -0.11 0.00 -0.01 0.00 0.00 57.00 54.92 1bqn n GLN 407 Cb 0.33 -2.97 -0.06 0.00 1.02 0.00 0.00 30.24 28.56 1bqn n GLN 407 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1bqn s ALA 408 N 2.08 -0.76 0.00 -1.58 0.00 -1.26 -5.03 121.76 115.22 1bqn s ALA 408 Ca 0.58 -0.07 0.00 0.00 0.00 0.00 0.00 51.96 52.47 1bqn s ALA 408 Cb 0.16 0.50 0.00 0.00 0.00 0.00 0.00 23.12 23.78 1bqn s ALA 408 CO -0.07 -0.53 0.07 0.25 0.00 0.00 0.00 175.76 175.48 1bqn n THR 409 N 0.13 0.00 -1.72 0.00 -2.24 -1.26 -4.91 114.28 104.28 1bqn n THR 409 Ca -0.17 0.14 -0.43 0.00 -2.27 0.00 0.00 64.05 61.32 1bqn n THR 409 Cb 0.62 -0.28 -0.02 0.00 -2.10 0.00 0.00 70.33 68.55 1bqn n THR 409 CO 0.00 0.00 0.00 -2.67 -0.57 0.00 0.00 175.07 171.83 1bqn n TRP 410 N -0.47 2.56 -3.59 4.78 4.27 -1.26 -4.93 117.44 118.80 1bqn n TRP 410 Ca 0.00 0.38 -0.40 0.00 -3.89 0.00 0.00 57.50 53.59 1bqn n TRP 410 Cb 0.00 -2.52 -0.08 0.00 -1.36 0.00 0.00 31.31 27.35 1bqn n TRP 410 CO 0.00 0.00 0.00 0.42 -2.29 0.00 0.00 177.69 175.82 1bqn s ILE 411 N -0.36 4.19 0.76 -1.67 1.01 -1.26 -5.06 121.20 118.82 1bqn s ILE 411 Ca 0.62 -2.29 -0.15 0.00 0.00 0.00 0.00 60.65 58.84 1bqn s ILE 411 Cb -0.55 -3.73 0.04 0.00 0.01 0.00 0.00 42.46 38.23 1bqn s ILE 411 CO 0.53 -0.84 1.13 -0.81 0.00 0.00 0.00 174.94 174.95 1bqn n PRO 412 N 4.29 0.42 -1.69 2.79 -0.04 -1.26 -4.91 135.00 134.60 1bqn n PRO 412 Ca 0.01 0.21 -0.33 0.00 -0.04 0.00 0.00 63.50 63.35 1bqn n PRO 412 Cb 0.41 -2.38 0.06 0.00 -0.04 0.00 0.00 33.50 31.55 1bqn n PRO 412 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1bqn s GLU 413 N -3.75 2.66 0.05 0.54 0.41 -1.26 -5.00 118.70 112.36 1bqn s GLU 413 Ca 0.75 1.47 -0.16 0.00 -0.41 0.00 0.00 54.97 56.62 1bqn s GLU 413 Cb -0.32 -1.93 0.03 0.00 -1.78 0.00 0.00 34.13 30.13 1bqn s GLU 413 CO 0.49 -1.37 0.37 1.67 -0.49 0.00 0.00 175.26 175.93 1bqn s TRP 414 N -2.25 -0.20 0.05 1.61 -2.14 -1.26 -2.57 118.94 112.17 1bqn s TRP 414 Ca 0.69 0.09 -0.02 0.00 2.66 0.00 0.00 56.10 59.52 1bqn s TRP 414 Cb -0.22 0.18 -0.03 0.00 -3.10 0.00 0.00 33.47 30.29 1bqn s TRP 414 CO 0.42 -0.56 0.00 -2.00 -2.66 0.00 0.00 176.95 172.15 1bqn s GLU 415 N -2.67 0.62 -0.08 3.25 2.12 0.03 -4.92 118.70 117.04 1bqn s GLU 415 Ca -0.04 -1.14 0.03 0.00 0.36 0.00 0.00 54.97 54.18 1bqn s GLU 415 Cb -0.00 0.22 0.01 0.00 0.26 0.00 0.00 34.13 34.62 1bqn s GLU 415 CO -0.04 -0.13 -0.18 -0.06 -0.54 0.00 0.00 175.26 174.32 1bqn s PHE 416 N -3.73 1.98 0.03 5.30 0.08 -1.26 -0.59 117.98 119.79 1bqn s PHE 416 Ca 0.05 -0.79 -0.30 0.00 0.12 0.00 0.00 56.93 56.02 1bqn s PHE 416 Cb 0.06 -1.38 -0.09 0.00 -0.57 0.00 0.00 43.02 41.05 1bqn s PHE 416 CO -0.09 -0.35 1.95 0.08 -0.10 0.00 0.00 175.22 176.71 1bqn s VAL 417 N 0.53 3.04 -0.00 -0.44 1.01 0.58 -4.85 120.40 120.26 1bqn s VAL 417 Ca -0.16 0.06 -0.00 0.00 0.00 0.00 0.00 61.98 61.87 1bqn s VAL 417 Cb -0.17 -3.04 -0.00 0.00 0.00 0.00 0.00 36.38 33.17 1bqn s VAL 417 CO 0.06 -0.01 0.20 0.78 0.00 0.00 0.00 175.10 176.13 1bqn h ASN 418 N 10.53 -0.01 -3.43 3.32 4.21 -1.96 -3.44 115.58 124.80 1bqn h ASN 418 Ca -0.49 0.00 -0.51 0.00 1.21 0.00 0.00 56.30 56.51 1bqn h ASN 418 Cb 1.23 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 38.43 1bqn h ASN 418 CO 0.94 0.01 -0.04 0.42 -1.29 0.00 0.00 177.43 177.47 1bqn s THR 419 N -1.42 4.91 0.99 2.81 -4.23 -1.26 -5.08 115.64 112.35 1bqn s THR 419 Ca -0.00 0.36 -0.12 0.00 -1.18 0.00 0.00 61.69 60.74 1bqn s THR 419 Cb 0.00 -3.71 0.18 0.00 1.34 0.00 0.00 72.50 70.31 1bqn s THR 419 CO 0.00 -0.34 1.09 -2.84 -0.54 0.00 0.00 174.62 171.99 1bqn s PRO 420 N -3.51 0.51 0.13 3.99 0.02 -1.26 -5.08 135.00 129.80 1bqn s PRO 420 Ca 0.47 0.63 0.09 0.00 0.02 0.00 0.00 61.00 62.22 1bqn s PRO 420 Cb -0.11 -1.74 -0.04 0.00 0.02 0.00 0.00 34.50 32.64 1bqn s PRO 420 CO 0.28 -2.70 -0.23 -2.14 -0.33 0.00 0.00 177.00 171.88 1bqn s PRO 421 N -4.91 1.26 0.02 5.54 0.02 -1.26 -5.02 135.00 130.65 1bqn s PRO 421 Ca 0.65 -1.28 -0.06 0.00 0.02 0.00 0.00 61.00 60.33 1bqn s PRO 421 Cb -0.19 -1.59 -0.29 0.00 0.02 0.00 0.00 34.50 32.45 1bqn s PRO 421 CO 0.58 0.36 0.94 1.37 -0.33 0.00 0.00 177.00 179.93 1bqn h LEU 422 N 3.85 0.49 -0.44 -5.54 -0.00 -2.04 -3.38 115.31 108.27 1bqn h LEU 422 Ca -0.47 -0.61 0.12 0.00 -0.00 0.00 0.00 57.88 56.91 1bqn h LEU 422 Cb 1.18 -0.16 -0.08 0.00 -0.00 0.00 0.00 40.66 41.60 1bqn h LEU 422 CO 0.41 1.50 0.00 0.52 -0.00 0.00 0.00 178.44 180.87 1bqn n VAL 423 N -3.53 -0.18 -0.34 0.15 0.31 -1.26 -0.79 118.33 112.69 1bqn n VAL 423 Ca -0.15 0.97 0.19 0.00 -0.01 0.00 0.00 64.34 65.34 1bqn n VAL 423 Cb 1.05 -1.41 0.42 0.00 -0.91 0.00 0.00 33.84 32.99 1bqn n VAL 423 CO 0.00 0.00 0.00 0.07 -1.32 0.00 0.00 176.83 175.58 1bqn h LYS 424 N 0.00 0.52 0.00 5.55 2.10 -1.88 -3.31 116.57 119.54 1bqn h LYS 424 Ca 0.26 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.88 1bqn h LYS 424 Cb 0.53 -0.12 0.00 0.00 -0.90 0.00 0.00 32.23 31.75 1bqn h LYS 424 CO -0.42 0.34 0.00 1.47 -2.00 0.00 0.00 179.45 178.85 1bqn n LEU 425 N -4.82 0.00 -3.95 7.07 -0.00 0.03 -3.87 117.00 111.45 1bqn n LEU 425 Ca 0.27 0.00 -0.09 0.00 -0.00 0.00 0.00 56.01 56.19 1bqn n LEU 425 Cb 0.78 0.00 -0.08 0.00 -0.00 0.00 0.00 43.42 44.13 1bqn n LEU 425 CO 0.19 0.00 -0.13 0.26 -0.00 0.00 0.00 177.39 177.71 1bqn s TRP 426 N 0.00 0.36 -0.84 1.47 0.52 -1.25 -5.05 118.94 114.16 1bqn s TRP 426 Ca 0.00 -0.78 -0.24 0.00 0.02 0.00 0.00 56.10 55.10 1bqn s TRP 426 Cb 0.00 -0.15 -0.19 0.00 -1.15 0.00 0.00 33.47 31.97 1bqn s TRP 426 CO 0.00 -0.58 2.21 2.48 0.02 0.00 0.00 176.95 181.09 1bqn n TYR 427 N -0.09 0.42 -4.34 -1.98 0.18 -1.25 -4.91 117.16 105.19 1bqn n TYR 427 Ca -0.11 0.28 -0.19 0.00 1.88 0.00 0.00 57.90 59.76 1bqn n TYR 427 Cb 0.63 -1.83 -0.13 0.00 -0.38 0.00 0.00 39.34 37.62 1bqn n TYR 427 CO 0.00 0.00 0.00 -0.65 -2.08 0.00 0.00 176.86 174.13 1bqn s GLN 428 N 7.36 0.87 -0.30 -3.48 -0.21 -1.25 -2.78 119.66 119.88 1bqn s GLN 428 Ca 1.14 -0.67 -0.07 0.00 0.02 0.00 0.00 55.36 55.77 1bqn s GLN 428 Cb -1.02 -0.85 0.02 0.00 1.00 0.00 0.00 33.01 32.15 1bqn s GLN 428 CO 0.42 0.21 0.09 -0.48 -2.12 0.00 0.00 175.29 173.41 1bqn s LEU 429 N -0.99 3.95 0.00 2.90 2.34 -1.26 -4.83 118.68 120.78 1bqn s LEU 429 Ca 0.01 -0.80 0.29 0.00 0.06 0.00 0.00 54.13 53.70 1bqn s LEU 429 Cb -0.07 -1.88 1.33 0.00 -0.56 0.00 0.00 46.19 45.01 1bqn s LEU 429 CO 0.01 -0.22 1.90 1.21 -1.06 0.00 0.00 176.35 178.19