#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qrj s VAL 4 N 0.00 0.42 -0.21 0.00 1.01 -1.26 -4.94 120.40 115.42 2qrj s VAL 4 Ca 0.00 -0.16 -0.07 0.00 0.00 0.00 0.00 61.98 61.75 2qrj s VAL 4 Cb 0.00 -0.41 -0.03 0.00 0.00 0.00 0.00 36.38 35.94 2qrj s VAL 4 CO 0.00 0.15 0.06 -0.89 0.00 0.00 0.00 175.10 174.42 2qrj s THR 5 N 0.32 4.47 -0.07 3.92 2.01 -1.26 -1.65 115.64 123.38 2qrj s THR 5 Ca -0.04 -0.13 -0.01 0.00 0.31 0.00 0.00 61.69 61.82 2qrj s THR 5 Cb -0.07 -3.05 -0.03 0.00 0.01 0.00 0.00 72.50 69.36 2qrj s THR 5 CO -0.00 0.40 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.56 2qrj s LEU 6 N 0.99 3.50 -0.27 4.42 1.43 0.77 -0.99 118.68 128.53 2qrj s LEU 6 Ca 0.04 0.09 0.02 0.00 -1.03 0.00 0.00 54.13 53.25 2qrj s LEU 6 Cb -0.14 -1.84 0.07 0.00 0.03 0.00 0.00 46.19 44.31 2qrj s LEU 6 CO 0.03 0.36 -0.05 -2.28 0.23 0.00 0.00 176.35 174.63 2qrj s HIS 7 N -0.91 2.96 -0.60 0.29 2.46 0.21 -0.67 115.29 119.02 2qrj s HIS 7 Ca 0.14 -2.21 -0.28 0.00 0.47 0.00 0.00 55.06 53.18 2qrj s HIS 7 Cb -0.11 -1.97 0.02 0.00 -0.13 0.00 0.00 32.58 30.38 2qrj s HIS 7 CO 0.04 -0.85 1.37 -1.17 -2.47 0.00 0.00 174.74 171.65 2qrj s LEU 8 N 1.20 3.36 0.19 8.88 2.96 0.32 -0.03 118.68 135.56 2qrj s LEU 8 Ca -0.03 0.11 -0.30 0.00 -0.22 0.00 0.00 54.13 53.68 2qrj s LEU 8 Cb -0.19 -2.96 -0.09 0.00 0.50 0.00 0.00 46.19 43.45 2qrj s LEU 8 CO -0.07 -1.72 1.39 -0.60 -1.32 0.00 0.00 176.35 174.02 2qrj s ARG 9 N 5.52 4.32 0.07 1.98 3.52 0.38 -1.64 118.95 133.10 2qrj s ARG 9 Ca 0.48 2.16 -0.31 0.00 -0.13 0.00 0.00 55.73 57.93 2qrj s ARG 9 Cb -0.10 -3.18 -0.08 0.00 -1.56 0.00 0.00 34.95 30.04 2qrj s ARG 9 CO 0.23 -0.37 1.56 0.00 -0.81 0.00 0.00 175.30 175.91 2qrj s ALA 10 N 0.38 3.66 0.44 6.12 0.00 -1.26 -4.75 121.76 126.35 2qrj s ALA 10 Ca 0.60 1.14 -0.25 0.00 0.00 0.00 0.00 51.96 53.45 2qrj s ALA 10 Cb -0.39 -3.65 -0.08 0.00 0.00 0.00 0.00 23.12 19.00 2qrj s ALA 10 CO 0.37 -0.98 1.41 -1.21 0.00 0.00 0.00 175.76 175.35 2qrj s GLU 11 N 2.27 3.75 -0.00 0.00 0.41 -1.26 -4.89 118.70 118.98 2qrj s GLU 11 Ca 0.70 2.37 0.03 0.00 -0.41 0.00 0.00 54.97 57.66 2qrj s GLU 11 Cb -0.38 -2.68 -0.05 0.00 -1.78 0.00 0.00 34.13 29.24 2qrj s GLU 11 CO 0.30 -0.75 0.07 0.25 -0.49 0.00 0.00 175.26 174.65 2qrj n THR 12 N -0.11 0.00 -1.65 3.63 -2.24 -1.26 -4.80 114.28 107.85 2qrj n THR 12 Ca 0.05 -0.11 -0.51 0.00 -2.27 0.00 0.00 64.05 61.20 2qrj n THR 12 Cb 0.42 0.50 -0.06 0.00 -2.10 0.00 0.00 70.33 69.09 2qrj n THR 12 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2qrj n LYS 13 N -1.54 1.51 -1.68 -0.78 4.76 -1.26 -4.80 118.16 114.37 2qrj n LYS 13 Ca -0.00 0.55 -0.46 0.00 -2.87 0.00 0.00 58.31 55.53 2qrj n LYS 13 Cb 0.08 -2.26 -0.04 0.00 -1.84 0.00 0.00 35.03 30.97 2qrj n LYS 13 CO 0.00 0.00 0.00 -2.30 -1.37 0.00 0.00 177.40 173.73 2qrj n PRO 14 N 3.92 2.28 -1.07 1.97 -0.02 -1.26 -1.95 135.00 138.86 2qrj n PRO 14 Ca 0.20 0.82 -0.02 0.00 -2.02 0.00 0.00 63.50 62.48 2qrj n PRO 14 Cb 0.21 -2.63 -0.01 0.00 -0.02 0.00 0.00 33.50 31.06 2qrj n PRO 14 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2qrj n LEU 15 N 4.24 0.23 -4.62 2.45 4.77 -1.26 -4.98 117.00 117.83 2qrj n LEU 15 Ca 0.18 0.06 -0.43 0.00 -0.03 0.00 0.00 56.01 55.79 2qrj n LEU 15 Cb 0.30 -1.60 -0.02 0.00 -2.33 0.00 0.00 43.42 39.77 2qrj n LEU 15 CO 0.65 -0.54 1.12 -0.70 -1.33 0.00 0.00 177.39 176.59 2qrj s GLU 16 N -1.48 3.80 0.00 3.23 2.56 -0.82 -4.89 118.70 121.10 2qrj s GLU 16 Ca 0.00 0.99 0.16 0.00 0.00 0.00 0.00 54.97 56.12 2qrj s GLU 16 Cb 0.00 -3.91 0.04 0.00 2.00 0.00 0.00 34.13 32.26 2qrj s GLU 16 CO 0.00 -1.27 0.89 0.00 -0.56 0.00 0.00 175.26 174.32 2qrj n ALA 17 N 7.90 2.93 -1.85 6.30 0.00 -1.26 -4.54 120.51 130.00 2qrj n ALA 17 Ca 0.14 -0.56 -0.30 0.00 0.00 0.00 0.00 53.44 52.72 2qrj n ALA 17 Cb 0.48 -0.55 0.06 0.00 0.00 0.00 0.00 19.45 19.44 2qrj n ALA 17 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2qrj s ARG 18 N -1.69 2.63 0.03 0.00 0.52 -1.26 -0.96 118.95 118.21 2qrj s ARG 18 Ca 0.15 0.43 0.03 0.00 -0.52 0.00 0.00 55.73 55.82 2qrj s ARG 18 Cb 0.13 -2.00 -0.02 0.00 0.52 0.00 0.00 34.95 33.58 2qrj s ARG 18 CO 0.33 -1.19 -0.10 0.00 0.02 0.00 0.00 175.30 174.36 2qrj s ALA 19 N -3.37 0.80 0.25 2.13 0.00 -1.26 -4.81 121.76 115.51 2qrj s ALA 19 Ca 0.59 -0.70 0.05 0.00 0.00 0.00 0.00 51.96 51.90 2qrj s ALA 19 Cb -0.11 -0.08 0.30 0.00 0.00 0.00 0.00 23.12 23.23 2qrj s ALA 19 CO 0.52 0.10 1.60 0.00 0.00 0.00 0.00 175.76 177.98 2qrj h ALA 20 N 4.93 0.92 -3.73 0.00 0.00 -1.91 -3.42 119.26 116.04 2qrj h ALA 20 Ca -0.35 -0.51 -0.68 0.00 0.00 0.00 0.00 54.91 53.36 2qrj h ALA 20 Cb 1.19 -0.09 -0.31 0.00 0.00 0.00 0.00 17.79 18.59 2qrj h ALA 20 CO 0.44 0.70 -0.86 -0.51 0.00 0.00 0.00 179.25 179.01 2qrj s LEU 21 N -7.99 2.21 0.25 0.00 1.43 -1.26 -4.52 118.68 108.79 2qrj s LEU 21 Ca -0.04 -0.48 0.05 0.00 -1.03 0.00 0.00 54.13 52.63 2qrj s LEU 21 Cb 0.12 -1.43 -0.03 0.00 0.03 0.00 0.00 46.19 44.89 2qrj s LEU 21 CO 0.79 0.22 0.38 0.42 0.23 0.00 0.00 176.35 178.38 2qrj s THR 22 N 0.00 5.10 0.32 5.49 -4.23 -1.26 -4.93 115.64 116.13 2qrj s THR 22 Ca -0.08 -0.99 0.09 0.00 -1.18 0.00 0.00 61.69 59.54 2qrj s THR 22 Cb -0.15 -3.80 0.31 0.00 1.34 0.00 0.00 72.50 70.20 2qrj s THR 22 CO 0.05 -0.31 1.73 -0.65 -0.54 0.00 0.00 174.62 174.90 2qrj h PRO 23 N 1.13 0.56 -0.31 3.99 0.11 -1.97 0.22 132.00 135.73 2qrj h PRO 23 Ca -0.51 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.53 2qrj h PRO 23 Cb 1.23 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 2qrj h PRO 23 CO 0.60 0.37 0.07 1.15 -0.21 0.00 0.00 178.00 179.98 2qrj h THR 24 N 0.57 1.22 -0.18 -1.15 2.02 -1.95 -1.06 112.91 112.39 2qrj h THR 24 Ca 0.64 -0.74 -0.13 0.00 0.77 0.00 0.00 66.41 66.95 2qrj h THR 24 Cb 1.23 1.11 -0.01 0.00 -1.74 0.00 0.00 68.15 68.74 2qrj h THR 24 CO -0.48 0.25 -0.46 0.71 0.37 0.00 0.00 175.52 175.90 2qrj h THR 25 N 0.34 1.32 -0.51 3.16 1.35 -1.72 -2.20 112.91 114.64 2qrj h THR 25 Ca 0.10 -1.66 0.04 0.00 -0.55 0.00 0.00 66.41 64.34 2qrj h THR 25 Cb 0.30 1.68 -0.04 0.00 -1.73 0.00 0.00 68.15 68.36 2qrj h THR 25 CO 0.00 0.51 0.27 0.58 -0.25 0.00 0.00 175.52 176.63 2qrj h VAL 26 N 0.36 0.98 -0.19 6.82 2.07 -0.83 -1.12 116.25 124.34 2qrj h VAL 26 Ca 0.02 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 2qrj h VAL 26 Cb 0.95 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.11 2qrj h VAL 26 CO 0.08 0.10 0.09 0.50 0.02 0.00 0.00 177.57 178.35 2qrj h LYS 27 N 0.53 0.27 -0.90 1.57 3.64 -0.95 -0.94 116.57 119.79 2qrj h LYS 27 Ca 0.22 -0.04 0.06 0.00 -1.27 0.00 0.00 60.65 59.62 2qrj h LYS 27 Cb 0.11 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 31.83 2qrj h LYS 27 CO -0.14 0.31 0.59 0.87 -2.27 0.00 0.00 179.45 178.80 2qrj h LYS 28 N 0.16 1.00 -0.22 1.90 1.57 -1.31 -1.56 116.57 118.12 2qrj h LYS 28 Ca 0.06 -0.06 -0.11 0.00 -1.87 0.00 0.00 60.65 58.67 2qrj h LYS 28 Cb 0.13 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.22 2qrj h LYS 28 CO -0.01 0.66 -0.29 -0.07 -0.57 0.00 0.00 179.45 179.17 2qrj h LEU 29 N 1.03 0.63 -1.82 2.94 3.38 -0.92 -2.66 115.31 117.90 2qrj h LEU 29 Ca 0.39 -0.51 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2qrj h LEU 29 Cb 0.19 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2qrj h LEU 29 CO -0.14 1.01 0.11 0.40 0.09 0.00 0.00 178.44 179.91 2qrj h ILE 30 N 0.26 1.05 -0.37 1.22 2.04 -0.92 -1.70 117.51 119.09 2qrj h ILE 30 Ca 0.02 -0.10 -0.11 0.00 1.00 0.00 0.00 64.86 65.68 2qrj h ILE 30 Cb 0.87 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 37.72 2qrj h ILE 30 CO 0.07 0.05 -0.20 0.00 0.00 0.00 0.00 178.15 178.06 2qrj h ALA 31 N 1.88 0.96 -0.01 1.87 0.00 -1.14 -2.44 119.26 120.37 2qrj h ALA 31 Ca 0.07 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2qrj h ALA 31 Cb -0.02 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2qrj h ALA 31 CO -0.01 0.61 0.00 1.63 0.00 0.00 0.00 179.25 181.47 2qrj n LYS 32 N -4.13 1.05 0.00 0.00 4.76 -0.76 -4.91 118.16 114.17 2qrj n LYS 32 Ca 0.00 -0.08 0.00 0.00 -2.87 0.00 0.00 58.31 55.36 2qrj n LYS 32 Cb 0.41 -1.28 0.00 0.00 -1.84 0.00 0.00 35.03 32.32 2qrj n LYS 32 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2qrj n GLY 33 N 0.80 0.70 3.79 0.72 0.00 -0.92 -4.84 105.19 105.44 2qrj n GLY 33 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 2qrj n GLY 33 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qrj s PHE 34 N -2.00 2.95 -0.16 1.61 2.99 -0.72 -4.10 117.98 118.55 2qrj s PHE 34 Ca 0.00 1.58 -0.11 0.00 0.00 0.00 0.00 56.93 58.40 2qrj s PHE 34 Cb 0.00 -3.13 -0.05 0.00 0.00 0.00 0.00 43.02 39.84 2qrj s PHE 34 CO 0.00 -0.99 0.19 0.21 -0.00 0.00 0.00 175.22 174.63 2qrj s LYS 35 N -3.14 4.04 -0.12 0.44 2.20 -0.66 -4.28 119.74 118.23 2qrj s LYS 35 Ca 0.67 -0.09 -0.01 0.00 -0.36 0.00 0.00 55.97 56.19 2qrj s LYS 35 Cb -0.19 -3.37 0.03 0.00 -1.51 0.00 0.00 37.83 32.79 2qrj s LYS 35 CO 0.23 0.40 -0.06 0.42 -0.36 0.00 0.00 175.35 175.98 2qrj s ILE 36 N 0.04 0.94 -0.05 5.43 1.01 -1.26 -0.17 121.20 127.14 2qrj s ILE 36 Ca 0.12 -0.29 -0.08 0.00 0.00 0.00 0.00 60.65 60.41 2qrj s ILE 36 Cb -0.12 -1.01 -0.04 0.00 0.01 0.00 0.00 42.46 41.29 2qrj s ILE 36 CO 0.01 0.30 0.22 -0.31 0.00 0.00 0.00 174.94 175.17 2qrj s TYR 37 N 1.74 3.61 -0.08 3.97 2.02 0.16 -1.32 117.35 127.44 2qrj s TYR 37 Ca 0.04 0.60 0.00 0.00 -0.37 0.00 0.00 57.07 57.34 2qrj s TYR 37 Cb -0.13 -2.00 0.02 0.00 -0.40 0.00 0.00 41.96 39.45 2qrj s TYR 37 CO -0.08 0.68 -0.06 0.08 -1.57 0.00 0.00 175.55 174.60 2qrj s VAL 38 N -1.15 0.75 0.38 0.71 1.01 -0.16 -0.52 120.40 121.42 2qrj s VAL 38 Ca 0.21 -0.17 -0.25 0.00 0.00 0.00 0.00 61.98 61.77 2qrj s VAL 38 Cb -0.13 -0.79 -0.09 0.00 0.00 0.00 0.00 36.38 35.37 2qrj s VAL 38 CO 0.11 0.30 1.07 -1.61 0.00 0.00 0.00 175.10 174.97 2qrj s GLU 39 N 1.40 4.24 -0.75 2.72 2.02 -0.65 -1.13 118.70 126.55 2qrj s GLU 39 Ca -0.02 1.60 -0.26 0.00 0.02 0.00 0.00 54.97 56.31 2qrj s GLU 39 Cb -0.13 -2.68 0.01 0.00 0.10 0.00 0.00 34.13 31.42 2qrj s GLU 39 CO -0.03 -0.10 1.59 0.34 0.02 0.00 0.00 175.26 177.08 2qrj s ASP 40 N -1.39 5.77 -0.31 -0.19 -1.08 0.17 -4.70 116.67 114.94 2qrj s ASP 40 Ca 0.55 -0.34 -0.10 0.00 -0.52 0.00 0.00 52.55 52.14 2qrj s ASP 40 Cb -0.25 -2.55 -0.02 0.00 -1.46 0.00 0.00 42.92 38.64 2qrj s ASP 40 CO 0.31 -2.10 0.17 -0.55 0.52 0.00 0.00 175.17 173.53 2qrj s SER 41 N 5.98 5.72 0.58 -0.34 0.15 -1.26 -4.04 113.70 120.49 2qrj s SER 41 Ca 0.52 -0.38 0.37 0.00 0.70 0.00 0.00 55.95 57.15 2qrj s SER 41 Cb -0.08 -2.05 1.71 0.00 -1.71 0.00 0.00 66.02 63.89 2qrj s SER 41 CO 0.12 -0.17 2.11 1.55 1.20 0.00 0.00 173.24 178.05 2qrj h PRO 42 N 8.38 0.00 0.00 5.44 0.13 -1.93 -3.13 132.00 140.89 2qrj h PRO 42 Ca -0.33 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.61 2qrj h PRO 42 Cb 1.16 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.26 2qrj h PRO 42 CO 0.61 0.02 -1.25 1.96 -0.23 0.00 0.00 178.00 179.11 2qrj h GLN 43 N 0.00 0.00 -6.81 0.86 4.20 -1.88 -3.48 115.11 108.01 2qrj h GLN 43 Ca -0.00 0.00 -0.52 0.00 0.06 0.00 0.00 58.65 58.19 2qrj h GLN 43 Cb 0.34 0.00 0.06 0.00 0.30 0.00 0.00 27.48 28.18 2qrj h GLN 43 CO 0.00 0.48 0.69 0.45 -0.67 0.00 0.00 178.83 179.79 2qrj s SER 44 N -6.12 6.72 0.42 1.46 0.15 -1.19 -4.16 113.70 110.99 2qrj s SER 44 Ca -0.01 2.66 0.29 0.00 0.70 0.00 0.00 55.95 59.59 2qrj s SER 44 Cb 0.08 -2.64 1.41 0.00 -1.71 0.00 0.00 66.02 63.17 2qrj s SER 44 CO 0.80 -0.61 1.89 0.00 1.20 0.00 0.00 173.24 176.52 2qrj h THR 45 N 3.31 0.00 -2.89 6.45 1.03 -1.36 -3.43 112.91 116.03 2qrj h THR 45 Ca -0.47 -0.18 -0.64 0.00 -0.01 0.00 0.00 66.41 65.11 2qrj h THR 45 Cb 1.22 0.94 -0.08 0.00 -1.07 0.00 0.00 68.15 69.16 2qrj h THR 45 CO 0.72 0.00 -0.43 -0.36 -0.01 0.00 0.00 175.52 175.43 2qrj s PHE 46 N -3.63 3.56 0.46 0.00 0.08 -1.26 -4.98 117.98 112.21 2qrj s PHE 46 Ca -0.00 0.55 -0.01 0.00 0.12 0.00 0.00 56.93 57.59 2qrj s PHE 46 Cb 0.09 -2.07 -0.01 0.00 -0.57 0.00 0.00 43.02 40.46 2qrj s PHE 46 CO 0.37 0.58 0.70 0.54 -0.10 0.00 0.00 175.22 177.31 2qrj s ASN 47 N -0.59 5.89 0.55 1.36 2.20 -1.26 -4.92 114.94 118.18 2qrj s ASN 47 Ca 0.15 0.41 0.31 0.00 -0.94 0.00 0.00 52.86 52.79 2qrj s ASN 47 Cb -0.12 -1.68 1.60 0.00 -2.00 0.00 0.00 41.25 39.05 2qrj s ASN 47 CO 0.04 -0.69 2.11 0.16 -2.94 0.00 0.00 177.10 175.78 2qrj h ILE 48 N 0.35 0.40 -0.59 0.54 3.07 -1.95 -2.30 117.51 117.03 2qrj h ILE 48 Ca -0.47 -0.43 -0.10 0.00 1.55 0.00 0.00 64.86 65.42 2qrj h ILE 48 Cb 1.24 1.30 -0.02 0.00 -0.27 0.00 0.00 36.82 39.08 2qrj h ILE 48 CO 0.59 0.08 -0.02 0.78 -1.05 0.00 0.00 178.15 178.52 2qrj h ASN 49 N 0.00 1.04 -0.55 2.16 2.35 -1.99 0.48 115.58 119.07 2qrj h ASN 49 Ca -0.00 -0.30 -0.00 0.00 -0.55 0.00 0.00 56.30 55.44 2qrj h ASN 49 Cb 0.30 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.36 2qrj h ASN 49 CO 0.01 1.10 0.33 -0.33 -1.65 0.00 0.00 177.43 176.89 2qrj h GLU 50 N 0.96 0.75 -0.18 0.81 5.08 -1.81 -0.89 114.58 119.31 2qrj h GLU 50 Ca 0.17 -0.07 -0.16 0.00 -1.00 0.00 0.00 59.36 58.29 2qrj h GLU 50 Cb 0.58 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 2qrj h GLU 50 CO 0.03 0.55 -0.56 1.88 -1.00 0.00 0.00 179.01 179.91 2qrj h TYR 51 N 0.74 0.68 -0.35 4.33 0.05 -1.36 -2.25 116.97 118.81 2qrj h TYR 51 Ca 0.20 -0.24 -0.02 0.00 0.05 0.00 0.00 58.73 58.72 2qrj h TYR 51 Cb -0.01 -0.13 -0.02 0.00 1.01 0.00 0.00 36.73 37.59 2qrj h TYR 51 CO -0.02 0.97 0.15 -0.09 -1.05 0.00 0.00 178.16 178.12 2qrj h ARG 52 N 0.41 0.52 0.00 4.88 2.43 -0.65 -0.36 114.38 121.61 2qrj h ARG 52 Ca 0.01 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 59.08 2qrj h ARG 52 Cb 1.10 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 30.56 2qrj h ARG 52 CO 0.10 0.49 -0.03 1.96 -1.51 0.00 0.00 179.97 180.98 2qrj h GLN 53 N 0.42 0.00 0.00 0.20 4.20 -1.05 0.11 115.11 118.99 2qrj h GLN 53 Ca 0.12 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.83 2qrj h GLN 53 Cb 0.16 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.94 2qrj h GLN 53 CO -0.01 0.03 0.00 0.00 -0.67 0.00 0.00 178.83 178.18 2qrj n ALA 54 N -2.47 1.97 -0.02 3.87 0.00 -0.86 -4.91 120.51 118.09 2qrj n ALA 54 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2qrj n ALA 54 Cb 0.12 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.17 2qrj n ALA 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qrj n GLY 55 N 0.68 0.89 3.76 0.00 0.00 0.37 -4.09 105.19 106.81 2qrj n GLY 55 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 2qrj n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qrj s ALA 56 N -2.01 3.02 -0.32 4.61 0.00 -0.19 -4.84 121.76 122.04 2qrj s ALA 56 Ca 0.00 1.17 -0.22 0.00 0.00 0.00 0.00 51.96 52.91 2qrj s ALA 56 Cb 0.00 -3.48 -0.00 0.00 0.00 0.00 0.00 23.12 19.64 2qrj s ALA 56 CO 0.00 -0.96 0.74 0.42 0.00 0.00 0.00 175.76 175.96 2qrj s ILE 57 N -1.37 4.83 -0.08 0.00 1.01 -0.44 -4.38 121.20 120.77 2qrj s ILE 57 Ca 0.64 1.03 -0.30 0.00 0.00 0.00 0.00 60.65 62.02 2qrj s ILE 57 Cb -0.36 -4.11 -0.02 0.00 0.01 0.00 0.00 42.46 37.98 2qrj s ILE 57 CO 0.44 -0.25 1.06 -0.63 0.00 0.00 0.00 174.94 175.56 2qrj s ILE 58 N 2.87 4.63 0.23 2.92 -1.09 -1.26 -0.99 121.20 128.51 2qrj s ILE 58 Ca 0.30 1.91 0.06 0.00 -2.23 0.00 0.00 60.65 60.69 2qrj s ILE 58 Cb -0.14 -4.23 -0.05 0.00 -1.58 0.00 0.00 42.46 36.46 2qrj s ILE 58 CO 0.13 0.02 -0.08 0.68 -1.23 0.00 0.00 174.94 174.45 2qrj s VAL 59 N 1.98 1.50 0.66 2.92 -7.23 -0.28 -4.92 120.40 115.02 2qrj s VAL 59 Ca 0.51 -2.13 -0.16 0.00 -1.81 0.00 0.00 61.98 58.39 2qrj s VAL 59 Cb -0.20 -2.21 0.00 0.00 0.56 0.00 0.00 36.38 34.52 2qrj s VAL 59 CO 0.20 -0.46 1.15 -2.84 -0.31 0.00 0.00 175.10 172.84 2qrj s PRO 60 N -3.73 2.68 0.20 4.82 0.02 -1.26 -0.65 135.00 137.08 2qrj s PRO 60 Ca 0.25 1.59 -0.32 0.00 0.02 0.00 0.00 61.00 62.54 2qrj s PRO 60 Cb 0.02 -1.92 -0.12 0.00 0.02 0.00 0.00 34.50 32.50 2qrj s PRO 60 CO 0.08 -1.38 1.70 0.00 -0.33 0.00 0.00 177.00 177.07 2qrj n ALA 61 N -2.28 2.61 -0.69 -1.55 0.00 -1.26 -2.43 120.51 114.92 2qrj n ALA 61 Ca 0.12 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.97 2qrj n ALA 61 Cb 0.51 -2.50 0.00 0.00 0.00 0.00 0.00 19.45 17.46 2qrj n ALA 61 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qrj n GLY 62 N 3.85 0.82 0.21 0.00 0.00 -1.26 -4.94 105.19 103.87 2qrj n GLY 62 Ca 0.16 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.33 2qrj n GLY 62 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2qrj h SER 63 N 0.00 0.00 -0.62 1.61 4.64 -1.86 -3.08 113.55 114.24 2qrj h SER 63 Ca 0.00 0.00 0.18 0.00 -0.47 0.00 0.00 61.79 61.50 2qrj h SER 63 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 2qrj h SER 63 CO 0.00 0.00 0.49 4.11 -0.87 0.00 0.00 176.83 180.56 2qrj h TRP 64 N 0.00 0.00 -0.17 4.77 5.08 -1.92 -2.73 115.95 120.98 2qrj h TRP 64 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 2qrj h TRP 64 Cb 0.40 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.56 2qrj h TRP 64 CO 0.00 0.00 0.00 0.36 -1.28 0.00 0.00 178.44 177.52 2qrj n LYS 65 N -4.15 1.42 0.00 0.12 2.85 -1.17 -2.39 118.16 114.85 2qrj n LYS 65 Ca 0.12 -0.65 0.00 0.00 -1.05 0.00 0.00 58.31 56.73 2qrj n LYS 65 Cb 0.73 -1.19 0.00 0.00 -0.65 0.00 0.00 35.03 33.92 2qrj n LYS 65 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 2qrj n THR 66 N -0.01 0.10 -2.36 0.58 -2.24 -1.05 -5.11 114.28 104.19 2qrj n THR 66 Ca 0.08 -0.12 -0.35 0.00 -2.27 0.00 0.00 64.05 61.40 2qrj n THR 66 Cb 0.17 1.18 -0.01 0.00 -2.10 0.00 0.00 70.33 69.57 2qrj n THR 66 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qrj s ALA 67 N -0.10 2.76 0.35 6.98 0.00 -1.00 -4.97 121.76 125.77 2qrj s ALA 67 Ca 0.00 0.74 -0.25 0.00 0.00 0.00 0.00 51.96 52.45 2qrj s ALA 67 Cb 0.00 -3.32 -0.13 0.00 0.00 0.00 0.00 23.12 19.67 2qrj s ALA 67 CO 0.00 -0.60 0.75 -2.30 0.00 0.00 0.00 175.76 173.60 2qrj n PRO 68 N -1.19 0.84 0.15 0.00 -0.02 -1.26 -4.84 135.00 128.67 2qrj n PRO 68 Ca 0.11 0.30 0.11 0.00 -2.02 0.00 0.00 63.50 61.99 2qrj n PRO 68 Cb 0.52 -1.61 0.54 0.00 -0.02 0.00 0.00 33.50 32.93 2qrj n PRO 68 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2qrj n ARG 69 N 0.64 0.15 0.03 -0.52 0.63 -1.26 -2.09 116.66 114.23 2qrj n ARG 69 Ca 0.12 0.57 0.12 0.00 -0.92 0.00 0.00 57.85 57.74 2qrj n ARG 69 Cb 0.35 -1.92 0.24 0.00 0.45 0.00 0.00 32.46 31.58 2qrj n ARG 69 CO 0.00 0.00 0.00 -0.40 -2.51 0.00 0.00 177.63 174.72 2qrj n ASP 70 N -2.22 0.55 -4.71 6.15 5.75 -1.26 -4.57 116.55 116.24 2qrj n ASP 70 Ca -0.00 -0.04 -0.42 0.00 -0.01 0.00 0.00 54.79 54.31 2qrj n ASP 70 Cb 0.09 0.17 -0.03 0.00 -1.03 0.00 0.00 41.12 40.32 2qrj n ASP 70 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2qrj s ARG 71 N -3.08 4.35 -0.32 0.11 0.52 -0.89 -4.66 118.95 114.99 2qrj s ARG 71 Ca 0.09 1.93 -0.28 0.00 -0.52 0.00 0.00 55.73 56.94 2qrj s ARG 71 Cb 0.16 -3.38 0.02 0.00 0.52 0.00 0.00 34.95 32.26 2qrj s ARG 71 CO 0.70 -0.42 1.04 0.42 0.02 0.00 0.00 175.30 177.06 2qrj s ILE 72 N 1.49 4.54 -0.24 1.52 1.01 -0.16 -4.48 121.20 124.87 2qrj s ILE 72 Ca 0.62 1.65 -0.20 0.00 0.00 0.00 0.00 60.65 62.72 2qrj s ILE 72 Cb -0.32 -4.39 -0.02 0.00 0.01 0.00 0.00 42.46 37.74 2qrj s ILE 72 CO 0.28 -0.46 0.61 -0.63 0.00 0.00 0.00 174.94 174.75 2qrj s ILE 73 N 3.57 5.00 -0.11 2.92 -1.09 -0.36 -0.62 121.20 130.52 2qrj s ILE 73 Ca 0.44 1.11 0.04 0.00 -2.23 0.00 0.00 60.65 60.00 2qrj s ILE 73 Cb -0.12 -3.92 0.00 0.00 -1.58 0.00 0.00 42.46 36.84 2qrj s ILE 73 CO 0.15 0.05 -0.23 -0.51 -1.23 0.00 0.00 174.94 173.17 2qrj s ILE 74 N 2.36 2.02 0.31 2.92 2.07 0.95 -0.87 121.20 130.96 2qrj s ILE 74 Ca 0.26 -0.98 -0.04 0.00 -1.41 0.00 0.00 60.65 58.48 2qrj s ILE 74 Cb -0.16 -1.75 -0.00 0.00 0.13 0.00 0.00 42.46 40.68 2qrj s ILE 74 CO 0.09 0.55 0.44 -0.83 -1.91 0.00 0.00 174.94 173.27 2qrj s GLY 75 N 0.48 1.35 -0.12 1.50 0.00 -0.42 -0.47 107.32 109.63 2qrj s GLY 75 Ca -0.16 -1.44 -0.10 0.00 0.00 0.00 0.00 44.72 43.02 2qrj s GLY 75 CO 0.06 -0.99 -0.20 1.04 0.00 0.00 0.00 173.10 173.01 2qrj n LEU 76 N -0.51 1.42 -5.03 0.66 4.77 -1.26 -3.88 117.00 113.17 2qrj n LEU 76 Ca 0.01 0.40 -0.20 0.00 -0.03 0.00 0.00 56.01 56.20 2qrj n LEU 76 Cb 0.62 -0.73 0.05 0.00 -2.33 0.00 0.00 43.42 41.03 2qrj n LEU 76 CO 0.29 -0.41 0.32 -0.54 -1.33 0.00 0.00 177.39 175.72 2qrj s LYS 77 N -2.19 2.35 0.81 3.23 -0.14 -1.26 -0.36 119.74 122.18 2qrj s LYS 77 Ca -0.16 -1.62 -0.11 0.00 -1.36 0.00 0.00 55.97 52.72 2qrj s LYS 77 Cb 0.02 -2.64 0.08 0.00 -1.68 0.00 0.00 37.83 33.61 2qrj s LYS 77 CO 0.24 -0.80 1.10 -1.21 -0.76 0.00 0.00 175.35 173.93 2qrj s GLU 78 N -4.63 1.91 0.46 1.68 8.01 -1.24 -4.72 118.70 120.17 2qrj s GLU 78 Ca 0.60 1.20 -0.04 0.00 0.01 0.00 0.00 54.97 56.75 2qrj s GLU 78 Cb -0.06 -1.85 -0.03 0.00 -4.31 0.00 0.00 34.13 27.88 2qrj s GLU 78 CO 0.38 -1.90 0.74 -1.64 0.01 0.00 0.00 175.26 172.85 2qrj s MET 79 N -4.86 3.42 0.14 1.61 -1.94 -1.26 -4.55 119.30 111.86 2qrj s MET 79 Ca 0.62 0.00 -0.34 0.00 -1.71 0.00 0.00 55.69 54.27 2qrj s MET 79 Cb -0.18 -2.44 -0.17 0.00 2.01 0.00 0.00 34.83 34.05 2qrj s MET 79 CO 0.57 -0.19 1.10 -2.30 -0.01 0.00 0.00 175.02 174.19 2qrj n PRO 80 N -2.18 0.87 0.01 2.03 -0.02 -1.26 -4.83 135.00 129.62 2qrj n PRO 80 Ca -0.00 0.31 0.13 0.00 -2.02 0.00 0.00 63.50 61.92 2qrj n PRO 80 Cb 0.56 -1.77 0.57 0.00 -0.02 0.00 0.00 33.50 32.84 2qrj n PRO 80 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2qrj h GLU 81 N 3.19 0.23 0.00 -0.52 4.39 -2.02 -0.92 114.58 118.93 2qrj h GLU 81 Ca -0.43 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.25 2qrj h GLU 81 Cb 1.37 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.96 2qrj h GLU 81 CO 0.69 0.15 0.00 -2.37 -1.16 0.00 0.00 179.01 176.32 2qrj n THR 82 N -4.46 0.94 -2.95 1.13 5.66 -1.26 -4.79 114.28 108.54 2qrj n THR 82 Ca 0.07 0.23 -0.41 0.00 -3.05 0.00 0.00 64.05 60.89 2qrj n THR 82 Cb 0.35 -1.01 -0.04 0.00 -1.55 0.00 0.00 70.33 68.08 2qrj n THR 82 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2qrj s ASP 83 N -3.22 6.91 -0.41 1.09 1.11 -0.35 -4.99 116.67 116.80 2qrj s ASP 83 Ca 0.07 1.11 0.04 0.00 0.18 0.00 0.00 52.55 53.94 2qrj s ASP 83 Cb 0.10 -2.43 0.17 0.00 1.07 0.00 0.00 42.92 41.83 2qrj s ASP 83 CO 0.30 -0.35 0.34 0.28 1.18 0.00 0.00 175.17 176.92 2qrj s THR 84 N 1.97 0.25 0.02 -1.27 -1.32 -1.26 -4.98 115.64 109.06 2qrj s THR 84 Ca 0.36 -2.48 -0.00 0.00 -1.21 0.00 0.00 61.69 58.36 2qrj s THR 84 Cb -0.17 -1.18 -0.02 0.00 -1.51 0.00 0.00 72.50 69.62 2qrj s THR 84 CO 0.13 -1.16 -0.03 0.72 -2.21 0.00 0.00 174.62 172.06 2qrj s PHE 85 N 0.20 0.29 0.19 9.09 -0.12 -1.26 -5.13 117.98 121.24 2qrj s PHE 85 Ca 0.31 -0.59 -0.32 0.00 -0.05 0.00 0.00 56.93 56.28 2qrj s PHE 85 Cb 0.01 -0.21 -0.16 0.00 -0.63 0.00 0.00 43.02 42.03 2qrj s PHE 85 CO -0.17 -0.21 1.11 -2.30 -0.05 0.00 0.00 175.22 173.59 2qrj n PRO 86 N 1.43 1.13 -3.20 1.99 -0.02 -1.26 -4.86 135.00 130.20 2qrj n PRO 86 Ca -0.23 0.40 -0.44 0.00 -2.02 0.00 0.00 63.50 61.21 2qrj n PRO 86 Cb 0.56 -1.86 -0.06 0.00 -0.02 0.00 0.00 33.50 32.12 2qrj n PRO 86 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2qrj s LEU 87 N 0.71 5.17 0.18 2.45 1.02 0.09 -4.82 118.68 123.49 2qrj s LEU 87 Ca 0.71 -1.08 0.23 0.00 0.02 0.00 0.00 54.13 54.01 2qrj s LEU 87 Cb -0.84 -2.37 0.03 0.00 0.02 0.00 0.00 46.19 43.03 2qrj s LEU 87 CO 0.54 -0.87 1.06 1.33 0.02 0.00 0.00 176.35 178.42 2qrj n VAL 88 N 5.52 0.55 -2.90 -1.59 0.24 -1.26 -1.66 118.33 117.24 2qrj n VAL 88 Ca -0.08 -0.50 -0.25 0.00 -2.04 0.00 0.00 64.34 61.47 2qrj n VAL 88 Cb 0.45 -0.28 0.00 0.00 -1.47 0.00 0.00 33.84 32.54 2qrj n VAL 88 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 2qrj s HIS 89 N -3.34 3.40 -0.02 6.34 3.76 -1.26 -4.16 115.29 120.00 2qrj s HIS 89 Ca 0.00 0.49 -0.30 0.00 -0.15 0.00 0.00 55.06 55.10 2qrj s HIS 89 Cb 0.10 -2.26 -0.04 0.00 1.11 0.00 0.00 32.58 31.48 2qrj s HIS 89 CO 0.79 -0.28 1.30 -1.21 -0.85 0.00 0.00 174.74 174.48 2qrj s GLU 90 N -4.61 4.32 -0.06 1.40 2.02 -1.26 -1.80 118.70 118.71 2qrj s GLU 90 Ca 0.47 1.82 0.04 0.00 0.02 0.00 0.00 54.97 57.32 2qrj s GLU 90 Cb -0.10 -3.55 -0.02 0.00 0.10 0.00 0.00 34.13 30.56 2qrj s GLU 90 CO 0.41 -0.50 -0.18 -1.01 0.02 0.00 0.00 175.26 174.00 2qrj s HIS 91 N 2.23 2.61 -0.19 1.61 3.76 0.78 -1.22 115.29 124.88 2qrj s HIS 91 Ca 0.60 -0.42 -0.01 0.00 -0.15 0.00 0.00 55.06 55.08 2qrj s HIS 91 Cb -0.28 -1.65 0.00 0.00 1.11 0.00 0.00 32.58 31.76 2qrj s HIS 91 CO 0.24 -0.01 -0.13 0.42 -0.85 0.00 0.00 174.74 174.41 2qrj s ILE 92 N -0.38 2.73 -0.04 0.60 1.01 -0.05 -0.58 121.20 124.50 2qrj s ILE 92 Ca 0.03 -0.72 -0.30 0.00 0.00 0.00 0.00 60.65 59.66 2qrj s ILE 92 Cb -0.12 -2.19 0.11 0.00 0.01 0.00 0.00 42.46 40.27 2qrj s ILE 92 CO 0.02 0.49 1.09 0.00 0.00 0.00 0.00 174.94 176.55 2qrj s GLN 93 N 1.19 0.63 -0.33 2.79 -2.07 -1.14 -1.30 119.66 119.43 2qrj s GLN 93 Ca 0.02 -0.29 -0.28 0.00 -1.82 0.00 0.00 55.36 52.99 2qrj s GLN 93 Cb -0.14 0.25 0.02 0.00 -1.09 0.00 0.00 33.01 32.05 2qrj s GLN 93 CO -0.05 -0.28 1.03 -0.06 -1.32 0.00 0.00 175.29 174.61 2qrj s PHE 94 N -2.77 3.13 -0.05 9.60 0.08 0.51 -0.89 117.98 127.58 2qrj s PHE 94 Ca 0.10 1.08 0.18 0.00 0.12 0.00 0.00 56.93 58.41 2qrj s PHE 94 Cb 0.00 -3.68 -0.27 0.00 -0.57 0.00 0.00 43.02 38.51 2qrj s PHE 94 CO -0.04 -0.78 0.34 0.00 -0.10 0.00 0.00 175.22 174.64 2qrj n ALA 95 N 6.84 2.49 -3.69 5.36 0.00 -1.26 -3.68 120.51 126.57 2qrj n ALA 95 Ca 0.11 -0.54 -0.31 0.00 0.00 0.00 0.00 53.44 52.69 2qrj n ALA 95 Cb 0.47 -0.53 0.04 0.00 0.00 0.00 0.00 19.45 19.43 2qrj n ALA 95 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2qrj n HIS 96 N -2.21 -1.90 -1.38 0.00 8.25 -1.26 -4.90 115.22 111.81 2qrj n HIS 96 Ca -0.07 0.48 0.00 0.00 -0.26 0.00 0.00 57.72 57.87 2qrj n HIS 96 Cb 0.57 -3.49 0.00 0.00 1.12 0.00 0.00 29.99 28.19 2qrj n HIS 96 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2qrj n TYR 98 N 0.00 0.00 -1.95 0.00 4.01 -1.26 -4.49 117.16 113.46 2qrj n TYR 98 Ca 0.00 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.55 2qrj n TYR 98 Cb 0.57 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.65 2qrj n TYR 98 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2qrj n LYS 99 N 0.35 3.30 -3.20 -0.72 5.02 -1.26 -4.95 118.16 116.70 2qrj n LYS 99 Ca 0.08 -4.04 -0.21 0.00 -2.02 0.00 0.00 58.31 52.13 2qrj n LYS 99 Cb 0.39 -2.18 -0.01 0.00 -0.02 0.00 0.00 35.03 33.22 2qrj n LYS 99 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2qrj n ASP 100 N -0.77 -3.57 -4.75 4.39 8.00 -1.26 -4.93 116.55 113.66 2qrj n ASP 100 Ca 0.40 -0.27 -0.35 0.00 0.71 0.00 0.00 54.79 55.29 2qrj n ASP 100 Cb 0.93 -2.98 0.06 0.00 -0.02 0.00 0.00 41.12 39.11 2qrj n ASP 100 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2qrj s GLN 101 N -5.83 2.62 -0.05 -1.24 1.11 -1.26 -4.88 119.66 110.13 2qrj s GLN 101 Ca 0.32 1.69 -0.38 0.00 0.01 0.00 0.00 55.36 57.01 2qrj s GLN 101 Cb -0.17 -1.90 -0.16 0.00 -1.01 0.00 0.00 33.01 29.77 2qrj s GLN 101 CO 0.40 -1.45 1.54 0.00 0.01 0.00 0.00 175.29 175.79 2qrj n ALA 102 N -2.20 -0.41 -1.11 6.09 0.00 -1.26 -1.83 120.51 119.78 2qrj n ALA 102 Ca 0.13 0.45 -0.04 0.00 0.00 0.00 0.00 53.44 53.98 2qrj n ALA 102 Cb 0.50 -2.18 -0.02 0.00 0.00 0.00 0.00 19.45 17.76 2qrj n ALA 102 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qrj n GLY 103 N 3.31 0.68 0.31 0.00 0.00 -1.26 -4.94 105.19 103.29 2qrj n GLY 103 Ca 0.21 -0.84 -0.02 0.00 0.00 0.00 0.00 46.02 45.37 2qrj n GLY 103 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 2qrj h TRP 104 N 0.00 0.90 -0.50 1.61 5.08 -1.70 -2.71 115.95 118.63 2qrj h TRP 104 Ca -0.08 -0.06 -0.01 0.00 1.08 0.00 0.00 58.89 59.83 2qrj h TRP 104 Cb 0.26 -0.27 -0.02 0.00 -3.00 0.00 0.00 29.16 26.12 2qrj h TRP 104 CO 0.11 0.71 0.29 1.96 -1.28 0.00 0.00 178.44 180.23 2qrj h GLN 105 N 0.87 0.68 -0.15 0.12 7.50 -1.89 -1.33 115.11 120.91 2qrj h GLN 105 Ca 0.20 -0.07 -0.05 0.00 0.50 0.00 0.00 58.65 59.23 2qrj h GLN 105 Cb 0.21 -0.14 -0.01 0.00 0.05 0.00 0.00 27.48 27.59 2qrj h GLN 105 CO -0.01 0.51 -0.13 -0.91 -1.50 0.00 0.00 178.83 176.79 2qrj h ASN 106 N 0.66 0.22 -0.10 1.46 -0.26 -1.92 0.25 115.58 115.90 2qrj h ASN 106 Ca 0.18 -0.05 -0.02 0.00 -0.56 0.00 0.00 56.30 55.85 2qrj h ASN 106 Cb 0.02 -0.06 -0.00 0.00 -1.06 0.00 0.00 38.32 37.22 2qrj h ASN 106 CO -0.03 0.38 -0.01 0.58 -1.06 0.00 0.00 177.43 177.29 2qrj h VAL 107 N 0.22 1.27 -0.22 2.81 2.07 -1.17 -3.23 116.25 118.00 2qrj h VAL 107 Ca 0.05 -0.88 -0.11 0.00 0.82 0.00 0.00 66.70 66.58 2qrj h VAL 107 Cb 0.38 1.66 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 2qrj h VAL 107 CO 0.02 0.25 -0.32 -0.07 0.02 0.00 0.00 177.57 177.47 2qrj h LEU 108 N -0.12 0.46 0.00 2.57 3.38 -0.83 -2.98 115.31 117.78 2qrj h LEU 108 Ca 0.03 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.82 2qrj h LEU 108 Cb 0.39 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.02 2qrj h LEU 108 CO 0.01 0.76 0.00 0.23 0.09 0.00 0.00 178.44 179.52 2qrj n MET 109 N -4.08 0.57 -0.07 1.13 2.81 0.85 -1.16 117.12 117.16 2qrj n MET 109 Ca -0.01 0.00 -0.22 0.00 -1.81 0.00 0.00 57.70 55.66 2qrj n MET 109 Cb 0.45 -1.48 -0.12 0.00 -0.71 0.00 0.00 33.22 31.36 2qrj n MET 109 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2qrj n ARG 110 N -0.98 0.65 -0.27 0.03 1.74 -1.13 -3.18 116.66 113.53 2qrj n ARG 110 Ca 0.13 0.36 -0.03 0.00 -0.77 0.00 0.00 57.85 57.54 2qrj n ARG 110 Cb 0.06 -1.67 0.13 0.00 -1.02 0.00 0.00 32.46 29.97 2qrj n ARG 110 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 2qrj h PHE 111 N -0.46 1.11 -0.05 -1.55 -1.00 -1.46 0.46 116.94 114.00 2qrj h PHE 111 Ca -0.46 -0.04 -0.02 0.00 2.81 0.00 0.00 57.97 60.26 2qrj h PHE 111 Cb 1.70 -0.35 -0.00 0.00 3.61 0.00 0.00 35.95 40.91 2qrj h PHE 111 CO 0.06 0.79 -0.05 0.82 -1.61 0.00 0.00 178.31 178.32 2qrj h ILE 112 N 1.12 1.38 -0.83 -0.55 2.04 -1.32 0.14 117.51 119.48 2qrj h ILE 112 Ca 0.27 -1.21 0.04 0.00 1.00 0.00 0.00 64.86 64.97 2qrj h ILE 112 Cb 0.08 2.09 -0.05 0.00 -0.74 0.00 0.00 36.82 38.20 2qrj h ILE 112 CO -0.04 0.33 0.53 0.50 0.00 0.00 0.00 178.15 179.47 2qrj h LYS 113 N -0.34 0.98 -0.01 2.37 1.63 -1.55 -2.91 116.57 116.74 2qrj h LYS 113 Ca 0.01 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.75 2qrj h LYS 113 Cb 0.55 -0.22 0.00 0.00 -0.60 0.00 0.00 32.23 31.96 2qrj h LYS 113 CO 0.01 0.65 -0.18 0.41 -3.45 0.00 0.00 179.45 176.89 2qrj n GLY 114 N -1.32 -0.53 2.87 5.01 0.00 -0.79 -4.94 105.19 105.49 2qrj n GLY 114 Ca 0.10 -0.39 -0.21 0.00 0.00 0.00 0.00 46.02 45.52 2qrj n GLY 114 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2qrj n HIS 115 N -0.52 -1.74 -2.21 1.61 8.25 -0.57 -4.22 115.22 115.82 2qrj n HIS 115 Ca 0.14 0.44 -0.27 0.00 -0.26 0.00 0.00 57.72 57.77 2qrj n HIS 115 Cb 0.34 -4.23 0.12 0.00 1.12 0.00 0.00 29.99 27.34 2qrj n HIS 115 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2qrj s GLY 116 N -2.67 1.73 0.00 -1.41 0.00 0.37 -4.82 107.32 100.53 2qrj s GLY 116 Ca 0.25 -1.22 0.04 0.00 0.00 0.00 0.00 44.72 43.79 2qrj s GLY 116 CO 0.31 -0.65 -0.11 -1.59 0.00 0.00 0.00 173.10 171.06 2qrj s THR 117 N -3.44 0.90 -0.20 0.90 2.01 -0.74 -4.72 115.64 110.35 2qrj s THR 117 Ca 0.66 -0.60 -0.03 0.00 0.31 0.00 0.00 61.69 62.03 2qrj s THR 117 Cb -0.07 -0.77 -0.00 0.00 0.01 0.00 0.00 72.50 71.66 2qrj s THR 117 CO 0.47 0.17 -0.08 -0.22 -0.69 0.00 0.00 174.62 174.28 2qrj s LEU 118 N -0.49 2.77 -0.44 4.42 2.96 -1.26 -0.16 118.68 126.47 2qrj s LEU 118 Ca 0.03 -0.42 -0.10 0.00 -0.22 0.00 0.00 54.13 53.42 2qrj s LEU 118 Cb -0.05 -1.69 0.09 0.00 0.50 0.00 0.00 46.19 45.04 2qrj s LEU 118 CO -0.00 0.01 0.31 -0.31 -1.32 0.00 0.00 176.35 175.03 2qrj s TYR 119 N 1.31 3.36 -0.26 5.38 1.51 0.25 -4.63 117.35 124.27 2qrj s TYR 119 Ca 0.04 -1.59 -0.26 0.00 -1.01 0.00 0.00 57.07 54.24 2qrj s TYR 119 Cb -0.14 -3.18 0.00 0.00 -0.11 0.00 0.00 41.96 38.53 2qrj s TYR 119 CO -0.04 -0.90 0.90 0.34 -1.11 0.00 0.00 175.55 174.74 2qrj s ASP 120 N 2.39 6.87 0.33 2.29 -1.08 -1.26 -2.87 116.67 123.34 2qrj s ASP 120 Ca 0.04 1.04 0.09 0.00 -0.52 0.00 0.00 52.55 53.20 2qrj s ASP 120 Cb -0.24 -2.47 0.82 0.00 -1.46 0.00 0.00 42.92 39.56 2qrj s ASP 120 CO 0.01 -0.62 1.80 -0.07 0.52 0.00 0.00 175.17 176.82 2qrj h LEU 121 N 9.41 0.70 -2.43 -1.34 3.38 -1.40 -1.62 115.31 122.02 2qrj h LEU 121 Ca -0.22 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 2qrj h LEU 121 Cb 1.08 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.79 2qrj h LEU 121 CO 0.92 0.26 -0.02 -0.08 0.09 0.00 0.00 178.44 179.61 2qrj h GLU 122 N 0.69 0.00 -0.00 1.13 4.81 -1.91 -3.04 114.58 116.26 2qrj h GLU 122 Ca 0.55 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.78 2qrj h GLU 122 Cb 0.96 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.34 2qrj h GLU 122 CO -0.33 0.02 -0.12 1.19 -0.73 0.00 0.00 179.01 179.05 2qrj n PHE 123 N -3.31 0.00 -1.68 0.92 3.01 -0.63 -4.97 117.46 110.80 2qrj n PHE 123 Ca -0.02 0.00 -0.49 0.00 1.01 0.00 0.00 57.45 57.95 2qrj n PHE 123 Cb 0.15 0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 39.57 2qrj n PHE 123 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 2qrj n LEU 124 N -0.33 3.27 -4.06 4.37 4.32 -1.09 -4.89 117.00 118.58 2qrj n LEU 124 Ca 0.02 1.00 -0.13 0.00 -0.02 0.00 0.00 56.01 56.89 2qrj n LEU 124 Cb 0.12 -1.36 -0.11 0.00 -1.62 0.00 0.00 43.42 40.45 2qrj n LEU 124 CO 0.07 -0.14 -0.40 -1.61 -1.22 0.00 0.00 177.39 174.09 2qrj s GLU 125 N 3.46 0.54 0.73 3.23 2.02 -1.26 -2.26 118.70 125.16 2qrj s GLU 125 Ca 0.91 -0.78 -0.12 0.00 0.02 0.00 0.00 54.97 54.99 2qrj s GLU 125 Cb -0.73 -0.27 0.17 0.00 0.10 0.00 0.00 34.13 33.40 2qrj s GLU 125 CO 0.50 0.04 0.97 0.27 0.02 0.00 0.00 175.26 177.07 2qrj n ASN 126 N 1.39 -0.04 0.10 -0.19 0.23 0.55 -4.52 115.26 112.78 2qrj n ASN 126 Ca -0.22 -1.33 0.11 0.00 -0.53 0.00 0.00 54.58 52.60 2qrj n ASN 126 Cb 0.55 -0.75 0.45 0.00 -2.08 0.00 0.00 39.78 37.95 2qrj n ASN 126 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2qrj n ASP 127 N -3.68 0.52 -1.51 0.53 8.00 -1.26 -2.01 116.55 117.14 2qrj n ASP 127 Ca 0.12 0.63 0.10 0.00 0.71 0.00 0.00 54.79 56.35 2qrj n ASP 127 Cb 0.43 -0.74 0.35 0.00 -0.02 0.00 0.00 41.12 41.14 2qrj n ASP 127 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qrj n GLN 128 N -2.07 3.42 -0.92 -1.24 3.00 -1.26 -4.96 117.38 113.36 2qrj n GLN 128 Ca 0.03 -2.82 0.00 0.00 -0.01 0.00 0.00 57.00 54.20 2qrj n GLN 128 Cb 0.22 -1.79 0.00 0.00 0.00 0.00 0.00 30.24 28.67 2qrj n GLN 128 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2qrj n GLY 129 N 1.28 0.69 3.74 1.08 0.00 -0.85 -5.02 105.19 106.11 2qrj n GLY 129 Ca 0.25 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.87 2qrj n GLY 129 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2qrj s ARG 130 N -0.27 4.64 0.32 1.61 6.06 -1.26 -4.76 118.95 125.29 2qrj s ARG 130 Ca 0.00 1.29 -0.29 0.00 -2.50 0.00 0.00 55.73 54.23 2qrj s ARG 130 Cb 0.00 -3.34 -0.12 0.00 0.06 0.00 0.00 34.95 31.55 2qrj s ARG 130 CO 0.00 0.33 1.48 0.54 -2.50 0.00 0.00 175.30 175.14 2qrj n ARG 131 N 2.46 2.50 0.08 5.12 1.74 -1.26 -0.33 116.66 126.97 2qrj n ARG 131 Ca -0.01 0.88 -0.11 0.00 -0.77 0.00 0.00 57.85 57.85 2qrj n ARG 131 Cb 0.49 -2.59 -0.05 0.00 -1.02 0.00 0.00 32.46 29.29 2qrj n ARG 131 CO 0.00 0.00 0.00 -0.39 -1.52 0.00 0.00 177.63 175.72 2qrj h VAL 132 N 3.02 1.51 -2.47 1.55 -1.51 -1.79 -3.45 116.25 113.11 2qrj h VAL 132 Ca -0.48 -2.77 -0.08 0.00 -1.23 0.00 0.00 66.70 62.14 2qrj h VAL 132 Cb 1.25 2.60 -0.25 0.00 -2.13 0.00 0.00 31.29 32.76 2qrj h VAL 132 CO 0.71 0.81 -0.20 0.00 -1.23 0.00 0.00 177.57 177.66 2qrj s ALA 133 N -3.05 -1.28 0.09 5.19 0.00 -1.26 -4.42 121.76 117.03 2qrj s ALA 133 Ca -0.03 1.73 -0.14 0.00 0.00 0.00 0.00 51.96 53.53 2qrj s ALA 133 Cb 0.09 -1.04 0.02 0.00 0.00 0.00 0.00 23.12 22.20 2qrj s ALA 133 CO 0.84 -0.29 0.33 0.00 0.00 0.00 0.00 175.76 176.64 2qrj s ALA 134 N 1.29 -0.70 -2.52 0.00 0.00 -1.26 -4.91 121.76 113.67 2qrj s ALA 134 Ca -0.08 -0.16 0.23 0.00 0.00 0.00 0.00 51.96 51.95 2qrj s ALA 134 Cb -0.07 0.53 0.49 0.00 0.00 0.00 0.00 23.12 24.07 2qrj s ALA 134 CO -0.13 -0.55 1.43 1.19 0.00 0.00 0.00 175.76 177.71 2qrj n PHE 135 N 0.04 0.34 -0.24 0.00 3.72 -1.26 -4.73 117.46 115.33 2qrj n PHE 135 Ca -0.16 -0.17 0.03 0.00 -0.05 0.00 0.00 57.45 57.09 2qrj n PHE 135 Cb 0.62 0.00 0.16 0.00 -0.94 0.00 0.00 39.48 39.32 2qrj n PHE 135 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 2qrj h GLY 136 N 4.69 1.07 0.61 1.37 0.00 -1.98 -1.45 103.07 107.38 2qrj h GLY 136 Ca 0.00 -0.16 0.03 0.00 0.00 0.00 0.00 47.33 47.20 2qrj h GLY 136 CO 0.00 -0.04 -0.10 -2.75 0.00 0.00 0.00 176.54 173.65 2qrj h PHE 137 N 0.48 -0.25 0.00 5.60 3.57 -1.85 -1.87 116.94 122.62 2qrj h PHE 137 Ca 0.38 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.86 2qrj h PHE 137 Cb 0.51 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.37 2qrj h PHE 137 CO -0.15 -0.15 -0.17 1.88 -2.23 0.00 0.00 178.31 177.48 2qrj h TYR 138 N -0.12 0.00 -0.08 0.41 0.05 -1.75 -0.22 116.97 115.26 2qrj h TYR 138 Ca 0.07 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.85 2qrj h TYR 138 Cb 0.23 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.97 2qrj h TYR 138 CO -0.21 0.17 0.03 0.00 -1.05 0.00 0.00 178.16 177.10 2qrj h ALA 139 N 1.83 0.10 -0.09 3.88 0.00 -0.83 -0.26 119.26 123.88 2qrj h ALA 139 Ca -0.00 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2qrj h ALA 139 Cb 0.82 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 2qrj h ALA 139 CO 0.02 -0.30 0.03 0.78 0.00 0.00 0.00 179.25 179.78 2qrj h GLY 140 N -0.04 0.15 0.56 0.00 0.00 -1.00 0.39 103.07 103.13 2qrj h GLY 140 Ca 0.03 -0.09 0.04 0.00 0.00 0.00 0.00 47.33 47.31 2qrj h GLY 140 CO -0.00 0.08 -0.07 -2.75 0.00 0.00 0.00 176.54 173.80 2qrj h PHE 141 N -0.03 -0.16 -0.55 5.60 3.57 -1.04 -0.53 116.94 123.79 2qrj h PHE 141 Ca 0.03 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.44 2qrj h PHE 141 Cb 0.20 0.10 -0.02 0.00 2.79 0.00 0.00 35.95 39.03 2qrj h PHE 141 CO -0.01 -0.12 -0.07 0.00 -2.23 0.00 0.00 178.31 175.89 2qrj h ALA 142 N 1.15 0.83 0.05 2.41 0.00 -0.97 -1.97 119.26 120.76 2qrj h ALA 142 Ca 0.10 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.69 2qrj h ALA 142 Cb 0.19 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2qrj h ALA 142 CO -0.22 0.66 -0.10 0.78 0.00 0.00 0.00 179.25 180.37 2qrj h GLY 143 N 0.96 -0.16 0.88 0.00 0.00 -0.74 -1.42 103.07 102.59 2qrj h GLY 143 Ca 0.15 0.12 0.05 0.00 0.00 0.00 0.00 47.33 47.64 2qrj h GLY 143 CO 0.04 -0.11 0.62 0.00 0.00 0.00 0.00 176.54 177.10 2qrj h ALA 144 N 0.73 1.41 -0.22 3.60 0.00 -1.04 0.46 119.26 124.19 2qrj h ALA 144 Ca 0.02 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2qrj h ALA 144 Cb 0.22 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2qrj h ALA 144 CO -0.07 0.48 0.13 0.00 0.00 0.00 0.00 179.25 179.79 2qrj h ALA 145 N 1.46 0.29 -0.43 0.00 0.00 -0.93 -0.43 119.26 119.21 2qrj h ALA 145 Ca 0.39 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 55.10 2qrj h ALA 145 Cb 0.07 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2qrj h ALA 145 CO -0.13 -0.19 -0.31 -0.07 0.00 0.00 0.00 179.25 178.55 2qrj h LEU 146 N 0.26 1.00 -0.40 0.00 3.38 -0.99 -1.98 115.31 116.58 2qrj h LEU 146 Ca 0.08 -0.42 0.03 0.00 0.09 0.00 0.00 57.88 57.66 2qrj h LEU 146 Cb 0.05 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 2qrj h LEU 146 CO -0.01 1.22 0.21 1.23 0.09 0.00 0.00 178.44 181.17 2qrj h GLY 147 N 0.83 0.55 0.99 0.83 0.00 -0.70 0.29 103.07 105.86 2qrj h GLY 147 Ca 0.08 -0.15 -0.04 0.00 0.00 0.00 0.00 47.33 47.22 2qrj h GLY 147 CO 0.08 0.11 0.18 -2.08 0.00 0.00 0.00 176.54 174.84 2qrj h VAL 148 N 0.42 1.23 -0.23 4.60 2.07 -1.09 -1.82 116.25 121.44 2qrj h VAL 148 Ca 0.17 -0.77 -0.06 0.00 0.82 0.00 0.00 66.70 66.86 2qrj h VAL 148 Cb 0.07 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 2qrj h VAL 148 CO -0.11 0.29 -0.10 0.03 0.02 0.00 0.00 177.57 177.70 2qrj h ARG 149 N 0.77 0.37 -0.02 1.57 3.08 -0.96 0.41 114.38 119.60 2qrj h ARG 149 Ca 0.18 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 60.14 2qrj h ARG 149 Cb 0.26 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.26 2qrj h ARG 149 CO -0.01 0.48 -0.00 0.22 -1.07 0.00 0.00 179.97 179.59 2qrj h ASP 150 N 0.35 0.04 -0.29 7.04 3.58 -0.70 0.70 116.42 127.15 2qrj h ASP 150 Ca 0.07 -0.36 0.01 0.00 0.42 0.00 0.00 57.03 57.18 2qrj h ASP 150 Cb 0.40 -0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.42 2qrj h ASP 150 CO 0.02 0.39 0.16 -0.25 -2.88 0.00 0.00 179.24 176.68 2qrj h TRP 151 N -0.31 0.30 -0.25 0.28 7.01 -1.16 -2.07 115.95 119.75 2qrj h TRP 151 Ca 0.01 0.01 0.05 0.00 2.11 0.00 0.00 58.89 61.07 2qrj h TRP 151 Cb 0.37 -0.09 -0.05 0.00 -2.10 0.00 0.00 29.16 27.29 2qrj h TRP 151 CO 0.05 0.17 -0.07 0.00 -2.79 0.00 0.00 178.44 175.81 2qrj h ALA 152 N 1.13 0.16 -0.88 2.65 0.00 -0.82 -2.81 119.26 118.68 2qrj h ALA 152 Ca 0.11 0.10 0.16 0.00 0.00 0.00 0.00 54.91 55.28 2qrj h ALA 152 Cb 0.01 0.20 -0.10 0.00 0.00 0.00 0.00 17.79 17.90 2qrj h ALA 152 CO -0.06 -0.47 0.47 0.35 0.00 0.00 0.00 179.25 179.54 2qrj h PHE 153 N -0.01 0.83 0.00 0.00 3.57 -0.49 -1.05 116.94 119.80 2qrj h PHE 153 Ca 0.12 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.64 2qrj h PHE 153 Cb 0.19 -0.23 -0.00 0.00 2.79 0.00 0.00 35.95 38.69 2qrj h PHE 153 CO -0.26 0.19 -0.09 0.87 -2.23 0.00 0.00 178.31 176.79 2qrj h LYS 154 N 0.65 0.00 0.09 1.11 1.57 -1.13 -0.56 116.57 118.30 2qrj h LYS 154 Ca 0.49 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 59.01 2qrj h LYS 154 Cb 0.71 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.02 2qrj h LYS 154 CO -0.37 0.09 -1.14 1.96 -0.57 0.00 0.00 179.45 179.42 2qrj h GLN 155 N 0.00 0.34 0.00 3.15 1.08 -1.07 -3.39 115.11 115.22 2qrj h GLN 155 Ca -0.00 -0.48 0.00 0.00 -1.45 0.00 0.00 58.65 56.71 2qrj h GLN 155 Cb 0.46 0.17 0.00 0.00 -0.05 0.00 0.00 27.48 28.06 2qrj h GLN 155 CO 0.01 1.19 -1.15 0.25 -0.95 0.00 0.00 178.83 178.18 2qrj n THR 156 N -3.62 0.00 -4.26 -0.54 -2.24 -1.00 -4.96 114.28 97.65 2qrj n THR 156 Ca -0.08 -0.14 -0.17 0.00 -2.27 0.00 0.00 64.05 61.39 2qrj n THR 156 Cb 0.96 0.77 -0.10 0.00 -2.10 0.00 0.00 70.33 69.86 2qrj n THR 156 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2qrj s HIS 157 N -2.96 1.39 0.73 4.78 3.76 -0.25 -5.08 115.29 117.66 2qrj s HIS 157 Ca 0.04 -0.64 -0.15 0.00 -0.15 0.00 0.00 55.06 54.16 2qrj s HIS 157 Cb 0.14 -0.70 0.04 0.00 1.11 0.00 0.00 32.58 33.16 2qrj s HIS 157 CO 0.81 0.16 1.22 -1.12 -0.85 0.00 0.00 174.74 174.95 2qrj s SER 158 N -2.87 4.19 0.63 1.40 0.01 -1.26 -4.68 113.70 111.11 2qrj s SER 158 Ca 0.14 2.40 0.42 0.00 1.31 0.00 0.00 55.95 60.22 2qrj s SER 158 Cb -0.01 -2.59 2.18 0.00 0.21 0.00 0.00 66.02 65.81 2qrj s SER 158 CO 0.03 -2.27 2.27 0.44 0.41 0.00 0.00 173.24 174.11 2qrj h ASP 159 N -0.23 0.00 -0.03 2.44 3.32 -1.97 -2.29 116.42 117.66 2qrj h ASP 159 Ca -0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 2qrj h ASP 159 Cb 1.30 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.85 2qrj h ASP 159 CO 0.50 0.00 0.00 -0.90 -1.72 0.00 0.00 179.24 177.12 2qrj n ASP 160 N -3.02 0.37 -4.37 6.45 5.68 -1.26 -4.78 116.55 115.62 2qrj n ASP 160 Ca -0.02 -1.40 -0.27 0.00 -0.50 0.00 0.00 54.79 52.60 2qrj n ASP 160 Cb 0.11 -0.02 -0.12 0.00 -1.14 0.00 0.00 41.12 39.95 2qrj n ASP 160 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 2qrj s GLU 161 N -1.96 1.37 0.24 0.11 2.02 -0.86 -5.15 118.70 114.46 2qrj s GLU 161 Ca 0.33 -1.37 0.10 0.00 0.02 0.00 0.00 54.97 54.05 2qrj s GLU 161 Cb 0.16 -1.73 -0.05 0.00 0.10 0.00 0.00 34.13 32.61 2qrj s GLU 161 CO 0.26 0.39 -0.18 -0.51 0.02 0.00 0.00 175.26 175.24 2qrj s ASP 162 N -2.27 3.10 -0.02 -0.19 1.01 -1.26 -4.86 116.67 112.18 2qrj s ASP 162 Ca 0.15 -1.01 -0.35 0.00 0.71 0.00 0.00 52.55 52.04 2qrj s ASP 162 Cb -0.09 -0.22 -0.14 0.00 1.01 0.00 0.00 42.92 43.48 2qrj s ASP 162 CO 0.07 -0.05 1.69 -0.11 0.21 0.00 0.00 175.17 176.98 2qrj n LEU 163 N -0.45 2.94 -4.64 1.23 7.94 -1.26 -4.93 117.00 117.83 2qrj n LEU 163 Ca -0.07 1.04 -0.29 0.00 -1.11 0.00 0.00 56.01 55.58 2qrj n LEU 163 Cb 0.60 -1.33 0.19 0.00 0.53 0.00 0.00 43.42 43.40 2qrj n LEU 163 CO 0.36 -0.32 0.62 -2.16 -1.11 0.00 0.00 177.39 174.78 2qrj s PRO 164 N 2.52 0.31 0.29 1.96 0.05 -1.26 -4.52 135.00 134.35 2qrj s PRO 164 Ca 0.88 0.75 -0.27 0.00 0.05 0.00 0.00 61.00 62.41 2qrj s PRO 164 Cb -0.78 -1.70 -0.14 0.00 0.05 0.00 0.00 34.50 31.92 2qrj s PRO 164 CO 0.49 -2.87 0.83 0.00 0.05 0.00 0.00 177.00 175.50 2qrj n ALA 165 N -4.31 -1.00 -2.41 8.56 0.00 -1.25 -4.63 120.51 115.47 2qrj n ALA 165 Ca 0.05 0.36 -0.31 0.00 0.00 0.00 0.00 53.44 53.55 2qrj n ALA 165 Cb 0.56 -1.89 -0.14 0.00 0.00 0.00 0.00 19.45 17.97 2qrj n ALA 165 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2qrj s VAL 166 N -1.11 2.59 0.06 0.00 0.11 -0.31 -5.00 120.40 116.74 2qrj s VAL 166 Ca 0.61 -1.08 -0.12 0.00 -2.93 0.00 0.00 61.98 58.45 2qrj s VAL 166 Cb -0.73 -2.02 -0.06 0.00 -1.53 0.00 0.00 36.38 32.04 2qrj s VAL 166 CO 0.59 0.47 0.43 -0.55 -3.33 0.00 0.00 175.10 172.70 2qrj s SER 167 N -1.03 6.74 0.28 3.54 0.15 -1.26 -4.50 113.70 117.61 2qrj s SER 167 Ca 0.12 0.91 -0.28 0.00 0.70 0.00 0.00 55.95 57.40 2qrj s SER 167 Cb -0.10 -2.22 -0.15 0.00 -1.71 0.00 0.00 66.02 61.84 2qrj s SER 167 CO 0.02 0.22 0.87 -2.65 1.20 0.00 0.00 173.24 172.90 2qrj n PRO 168 N 1.22 1.00 -2.76 5.44 -0.02 -1.26 -4.93 135.00 133.68 2qrj n PRO 168 Ca -0.10 0.35 -0.41 0.00 -2.02 0.00 0.00 63.50 61.32 2qrj n PRO 168 Cb 0.52 -1.63 -0.04 0.00 -0.02 0.00 0.00 33.50 32.33 2qrj n PRO 168 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 2qrj s TYR 169 N -1.07 3.75 -0.28 6.00 2.02 -0.17 -4.97 117.35 122.64 2qrj s TYR 169 Ca 0.60 1.71 0.28 0.00 -0.37 0.00 0.00 57.07 59.29 2qrj s TYR 169 Cb -0.75 -3.04 1.09 0.00 -0.40 0.00 0.00 41.96 38.86 2qrj s TYR 169 CO 0.59 0.15 1.82 -1.00 -1.57 0.00 0.00 175.55 175.53 2qrj h PRO 170 N 5.99 0.00 -2.76 -1.71 0.13 -1.91 -3.38 132.00 128.36 2qrj h PRO 170 Ca -0.42 0.00 0.07 0.00 -0.87 0.00 0.00 66.00 64.78 2qrj h PRO 170 Cb 1.21 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.25 2qrj h PRO 170 CO 0.73 0.00 0.32 0.54 -0.23 0.00 0.00 178.00 179.35 2qrj s ASN 171 N -4.91 -0.36 0.30 1.44 2.20 -1.26 -4.72 114.94 107.63 2qrj s ASN 171 Ca 0.04 -0.28 -0.00 0.00 -0.94 0.00 0.00 52.86 51.67 2qrj s ASN 171 Cb 0.09 0.59 0.49 0.00 -2.00 0.00 0.00 41.25 40.42 2qrj s ASN 171 CO 0.48 -1.03 1.93 -0.08 -2.94 0.00 0.00 177.10 175.47 2qrj h GLU 172 N 2.00 1.04 -0.46 3.55 4.81 -1.97 -2.57 114.58 120.98 2qrj h GLU 172 Ca -0.25 -0.06 0.05 0.00 -0.13 0.00 0.00 59.36 58.97 2qrj h GLU 172 Cb 1.26 -0.23 -0.05 0.00 0.63 0.00 0.00 28.75 30.36 2qrj h GLU 172 CO 0.29 0.69 0.19 -0.22 -0.73 0.00 0.00 179.01 179.23 2qrj h LYS 173 N 1.07 0.36 -0.31 1.92 3.64 -1.99 0.20 116.57 121.47 2qrj h LYS 173 Ca 0.36 -0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.75 2qrj h LYS 173 Cb 0.07 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 31.77 2qrj h LYS 173 CO -0.11 0.24 0.08 0.00 -2.27 0.00 0.00 179.45 177.39 2qrj h ALA 174 N 1.28 0.33 0.49 5.00 0.00 -1.91 0.45 119.26 124.90 2qrj h ALA 174 Ca 0.21 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 2qrj h ALA 174 Cb 0.18 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2qrj h ALA 174 CO -0.19 -0.32 -0.40 1.25 0.00 0.00 0.00 179.25 179.58 2qrj h LEU 175 N 0.21 -1.07 -0.88 0.00 6.46 -1.00 -1.77 115.31 117.26 2qrj h LEU 175 Ca 0.14 0.08 0.09 0.00 -0.12 0.00 0.00 57.88 58.07 2qrj h LEU 175 Cb 0.13 0.34 -0.07 0.00 -0.73 0.00 0.00 40.66 40.33 2qrj h LEU 175 CO -0.16 -0.58 0.53 0.58 -0.62 0.00 0.00 178.44 178.19 2qrj h VAL 176 N -0.88 0.95 -0.03 1.05 2.07 -0.90 -1.74 116.25 116.77 2qrj h VAL 176 Ca -0.05 -0.31 0.01 0.00 0.82 0.00 0.00 66.70 67.18 2qrj h VAL 176 Cb 0.76 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 2qrj h VAL 176 CO -0.02 0.16 -0.05 0.50 0.02 0.00 0.00 177.57 178.19 2qrj h LYS 177 N 0.89 -0.07 -0.08 1.57 3.64 -0.76 -1.06 116.57 120.71 2qrj h LYS 177 Ca 0.41 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.80 2qrj h LYS 177 Cb 0.33 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 2qrj h LYS 177 CO -0.23 -0.05 0.02 0.22 -2.27 0.00 0.00 179.45 177.14 2qrj h ASP 178 N -0.08 0.02 -0.34 4.20 3.58 -1.06 -1.60 116.42 121.15 2qrj h ASP 178 Ca 0.03 0.01 -0.05 0.00 0.42 0.00 0.00 57.03 57.44 2qrj h ASP 178 Cb 0.12 0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.16 2qrj h ASP 178 CO -0.07 0.03 0.03 0.58 -2.88 0.00 0.00 179.24 176.92 2qrj h VAL 179 N 0.06 1.25 -0.41 2.25 2.07 -1.26 -2.28 116.25 117.92 2qrj h VAL 179 Ca 0.03 -0.91 0.04 0.00 0.82 0.00 0.00 66.70 66.69 2qrj h VAL 179 Cb 0.02 1.17 -0.04 0.00 -1.52 0.00 0.00 31.29 30.92 2qrj h VAL 179 CO -0.04 0.30 0.17 0.74 0.02 0.00 0.00 177.57 178.76 2qrj h THR 180 N 0.41 0.91 -0.30 2.57 2.02 -1.16 0.73 112.91 118.10 2qrj h THR 180 Ca 0.10 -0.12 0.01 0.00 0.77 0.00 0.00 66.41 67.18 2qrj h THR 180 Cb 0.41 0.53 -0.02 0.00 -1.74 0.00 0.00 68.15 67.33 2qrj h THR 180 CO 0.01 0.06 0.16 0.50 0.37 0.00 0.00 175.52 176.63 2qrj h LYS 181 N 0.35 0.33 -0.53 6.66 3.64 -1.20 0.15 116.57 125.96 2qrj h LYS 181 Ca 0.18 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.50 2qrj h LYS 181 Cb 0.14 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.86 2qrj h LYS 181 CO -0.17 0.22 0.15 -0.44 -2.27 0.00 0.00 179.45 176.94 2qrj h ASP 182 N 0.34 0.79 0.04 4.20 3.32 -1.16 -1.46 116.42 122.49 2qrj h ASP 182 Ca 0.12 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 56.95 2qrj h ASP 182 Cb 0.01 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.36 2qrj h ASP 182 CO -0.07 0.80 -0.02 0.22 -1.72 0.00 0.00 179.24 178.46 2qrj h TYR 183 N 0.74 -0.04 -0.82 4.55 3.20 -0.61 -1.12 116.97 122.88 2qrj h TYR 183 Ca 0.17 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.07 2qrj h TYR 183 Cb 0.30 0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.54 2qrj h TYR 183 CO 0.02 0.05 0.54 0.87 -1.64 0.00 0.00 178.16 177.99 2qrj h LYS 184 N -0.12 1.01 -0.57 1.82 1.57 -0.61 -0.82 116.57 118.84 2qrj h LYS 184 Ca -0.00 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.64 2qrj h LYS 184 Cb 0.11 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 2qrj h LYS 184 CO 0.01 0.67 0.07 0.93 -0.57 0.00 0.00 179.45 180.56 2qrj h GLU 185 N 1.04 0.93 0.07 3.15 5.08 -1.09 -0.68 114.58 123.08 2qrj h GLU 185 Ca 0.32 -0.24 -0.00 0.00 -1.00 0.00 0.00 59.36 58.44 2qrj h GLU 185 Cb -0.02 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.12 2qrj h GLU 185 CO -0.09 0.88 -0.03 0.00 -1.00 0.00 0.00 179.01 178.77 2qrj h ALA 186 N 1.20 -0.10 -0.17 3.43 0.00 -0.76 -2.67 119.26 120.19 2qrj h ALA 186 Ca 0.18 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.00 2qrj h ALA 186 Cb 0.42 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2qrj h ALA 186 CO 0.01 -0.48 0.11 -0.07 0.00 0.00 0.00 179.25 178.83 2qrj h LEU 187 N -0.25 0.17 0.00 0.00 3.38 -0.94 -1.73 115.31 115.93 2qrj h LEU 187 Ca -0.01 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2qrj h LEU 187 Cb 0.21 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2qrj h LEU 187 CO 0.02 0.12 0.00 0.00 0.09 0.00 0.00 178.44 178.67 2qrj n ALA 188 N -2.52 1.80 1.60 1.53 0.00 -0.28 -1.12 120.51 121.52 2qrj n ALA 188 Ca -0.00 -0.06 0.14 0.00 0.00 0.00 0.00 53.44 53.51 2qrj n ALA 188 Cb 0.10 -1.27 0.60 0.00 0.00 0.00 0.00 19.45 18.89 2qrj n ALA 188 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2qrj n THR 189 N -1.43 0.03 -0.46 0.00 -2.24 -0.65 -4.92 114.28 104.60 2qrj n THR 189 Ca 0.05 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 2qrj n THR 189 Cb 0.17 0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.61 2qrj n THR 189 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qrj n GLY 190 N 1.11 0.74 3.76 3.38 0.00 -0.28 -5.04 105.19 108.86 2qrj n GLY 190 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 2qrj n GLY 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qrj n ALA 191 N -0.61 2.44 -1.78 4.61 0.00 -1.24 -4.97 120.51 118.95 2qrj n ALA 191 Ca 0.00 0.36 -0.41 0.00 0.00 0.00 0.00 53.44 53.39 2qrj n ALA 191 Cb 0.00 -2.44 -0.01 0.00 0.00 0.00 0.00 19.45 17.00 2qrj n ALA 191 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2qrj s ARG 192 N -1.38 4.19 0.23 0.00 0.52 -1.26 -4.73 118.95 116.51 2qrj s ARG 192 Ca 0.58 2.45 -0.32 0.00 -0.52 0.00 0.00 55.73 57.92 2qrj s ARG 192 Cb -0.49 -3.01 -0.12 0.00 0.52 0.00 0.00 34.95 31.85 2qrj s ARG 192 CO 0.57 -0.43 1.63 1.63 0.02 0.00 0.00 175.30 178.73 2qrj n LYS 193 N 0.76 2.57 -2.12 3.54 5.02 -1.26 -4.90 118.16 121.77 2qrj n LYS 193 Ca 0.01 0.92 -0.36 0.00 -2.02 0.00 0.00 58.31 56.87 2qrj n LYS 193 Cb 0.40 -2.72 0.02 0.00 -0.02 0.00 0.00 35.03 32.70 2qrj n LYS 193 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2qrj s PRO 194 N 0.51 3.21 -0.08 1.97 0.04 -1.26 -5.04 135.00 134.35 2qrj s PRO 194 Ca 0.72 1.76 -0.10 0.00 0.04 0.00 0.00 61.00 63.42 2qrj s PRO 194 Cb -0.55 -2.02 -0.05 0.00 0.04 0.00 0.00 34.50 31.92 2qrj s PRO 194 CO 0.39 -1.00 0.25 -0.08 0.04 0.00 0.00 177.00 176.60 2qrj s THR 195 N -1.64 5.31 -0.16 1.26 -1.32 -1.26 -4.86 115.64 112.98 2qrj s THR 195 Ca 0.74 0.47 0.00 0.00 -1.21 0.00 0.00 61.69 61.69 2qrj s THR 195 Cb -0.28 -3.53 0.03 0.00 -1.51 0.00 0.00 72.50 67.21 2qrj s THR 195 CO 0.32 0.59 -0.11 -0.69 -2.21 0.00 0.00 174.62 172.52 2qrj s VAL 196 N -0.97 1.47 -0.24 5.08 1.01 0.91 -1.47 120.40 126.18 2qrj s VAL 196 Ca 0.18 -0.69 -0.12 0.00 0.00 0.00 0.00 61.98 61.35 2qrj s VAL 196 Cb -0.14 -1.47 -0.05 0.00 0.00 0.00 0.00 36.38 34.73 2qrj s VAL 196 CO 0.08 0.33 0.23 -0.22 0.00 0.00 0.00 175.10 175.51 2qrj s LEU 197 N 1.51 4.10 -0.21 3.92 0.20 -0.13 -0.52 118.68 127.54 2qrj s LEU 197 Ca 0.03 0.18 -0.03 0.00 0.69 0.00 0.00 54.13 54.99 2qrj s LEU 197 Cb -0.14 -2.21 -0.01 0.00 -0.43 0.00 0.00 46.19 43.40 2qrj s LEU 197 CO -0.09 -0.01 -0.05 -0.63 -0.29 0.00 0.00 176.35 175.28 2qrj s ILE 198 N 1.34 3.29 -0.26 6.68 1.01 0.24 -1.04 121.20 132.45 2qrj s ILE 198 Ca 0.10 -0.52 -0.17 0.00 0.00 0.00 0.00 60.65 60.06 2qrj s ILE 198 Cb -0.14 -2.49 -0.03 0.00 0.01 0.00 0.00 42.46 39.81 2qrj s ILE 198 CO 0.07 0.43 0.47 -0.63 0.00 0.00 0.00 174.94 175.28 2qrj s ILE 199 N 1.41 5.10 0.00 2.92 1.01 -0.37 -0.15 121.20 131.12 2qrj s ILE 199 Ca 0.05 0.79 0.00 0.00 0.00 0.00 0.00 60.65 61.49 2qrj s ILE 199 Cb -0.14 -3.79 0.00 0.00 0.01 0.00 0.00 42.46 38.54 2qrj s ILE 199 CO -0.03 0.11 0.00 0.61 0.00 0.00 0.00 174.94 175.62 2qrj n GLY 200 N 4.47 1.13 0.28 6.18 0.00 0.11 -0.19 105.19 117.18 2qrj n GLY 200 Ca -0.05 -0.28 0.16 0.00 0.00 0.00 0.00 46.02 45.85 2qrj n GLY 200 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qrj h ALA 201 N 0.00 1.17 0.00 4.61 0.00 -1.28 -3.08 119.26 120.68 2qrj h ALA 201 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2qrj h ALA 201 Cb 0.37 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2qrj h ALA 201 CO 0.00 0.08 -0.80 1.28 0.00 0.00 0.00 179.25 179.81 2qrj n LEU 202 N -3.41 0.68 0.00 0.00 4.77 -1.26 -3.41 117.00 114.37 2qrj n LEU 202 Ca -0.02 0.16 -0.13 0.00 -0.03 0.00 0.00 56.01 56.00 2qrj n LEU 202 Cb 0.21 -0.14 0.08 0.00 -2.33 0.00 0.00 43.42 41.24 2qrj n LEU 202 CO 0.27 -0.04 0.36 0.61 -1.33 0.00 0.00 177.39 177.27 2qrj n GLY 203 N 1.33 -0.88 0.20 -0.72 0.00 -1.17 -4.78 105.19 99.16 2qrj n GLY 203 Ca 0.02 -1.75 -0.13 0.00 0.00 0.00 0.00 46.02 44.16 2qrj n GLY 203 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2qrj h ARG 204 N 0.00 -0.35 -0.39 1.61 3.08 -1.90 -1.05 114.38 115.38 2qrj h ARG 204 Ca -0.18 0.02 0.05 0.00 0.07 0.00 0.00 59.98 59.94 2qrj h ARG 204 Cb 0.53 0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.62 2qrj h ARG 204 CO 0.14 -0.23 0.14 0.00 -1.07 0.00 0.00 179.97 178.95 2qrj h GLY 206 N 0.30 0.62 0.97 0.00 0.00 -1.45 -0.91 103.07 102.60 2qrj h GLY 206 Ca 0.18 -0.11 -0.02 0.00 0.00 0.00 0.00 47.33 47.38 2qrj h GLY 206 CO -0.18 0.04 0.22 1.76 0.00 0.00 0.00 176.54 178.38 2qrj h SER 207 N 0.37 0.62 -0.19 0.19 0.02 -0.65 -1.16 113.55 112.76 2qrj h SER 207 Ca 0.22 -0.14 0.05 0.00 -0.84 0.00 0.00 61.79 61.08 2qrj h SER 207 Cb 0.19 -0.16 -0.06 0.00 0.14 0.00 0.00 62.40 62.51 2qrj h SER 207 CO -0.20 0.59 -0.19 1.23 -1.14 0.00 0.00 176.83 177.12 2qrj h GLY 208 N 0.62 -0.10 0.75 -3.77 0.00 -0.83 0.19 103.07 99.93 2qrj h GLY 208 Ca 0.16 0.23 0.03 0.00 0.00 0.00 0.00 47.33 47.75 2qrj h GLY 208 CO -0.02 -0.17 0.13 0.00 0.00 0.00 0.00 176.54 176.47 2qrj h ALA 209 N 0.86 0.39 -0.54 3.60 0.00 -0.90 -1.95 119.26 120.72 2qrj h ALA 209 Ca 0.12 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.08 2qrj h ALA 209 Cb 0.38 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 2qrj h ALA 209 CO -0.31 -0.27 0.34 0.82 0.00 0.00 0.00 179.25 179.83 2qrj h ILE 210 N 0.28 1.08 -0.44 0.00 2.04 -1.00 -1.22 117.51 118.25 2qrj h ILE 210 Ca 0.15 -0.23 0.04 0.00 1.00 0.00 0.00 64.86 65.81 2qrj h ILE 210 Cb 0.10 0.35 -0.04 0.00 -0.74 0.00 0.00 36.82 36.49 2qrj h ILE 210 CO -0.14 0.12 0.21 -0.78 0.00 0.00 0.00 178.15 177.56 2qrj h ASP 211 N 0.67 0.29 -0.10 1.72 3.58 -0.69 -1.99 116.42 119.91 2qrj h ASP 211 Ca 0.21 0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.69 2qrj h ASP 211 Cb -0.01 -0.02 -0.00 0.00 1.72 0.00 0.00 39.33 41.01 2qrj h ASP 211 CO -0.08 0.21 0.06 0.25 -2.88 0.00 0.00 179.24 176.80 2qrj h LEU 212 N 0.42 0.12 -0.77 2.28 7.12 -0.97 -2.03 115.31 121.48 2qrj h LEU 212 Ca 0.19 -0.05 0.01 0.00 0.13 0.00 0.00 57.88 58.15 2qrj h LEU 212 Cb 0.11 -0.03 -0.04 0.00 -0.53 0.00 0.00 40.66 40.18 2qrj h LEU 212 CO -0.15 0.14 0.50 -0.07 -0.13 0.00 0.00 178.44 178.74 2qrj h LEU 213 N 0.09 0.89 -0.08 2.25 3.38 -1.02 -1.19 115.31 119.63 2qrj h LEU 213 Ca 0.04 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2qrj h LEU 213 Cb 0.04 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 2qrj h LEU 213 CO -0.01 0.66 0.05 0.45 0.09 0.00 0.00 178.44 179.68 2qrj h HIS 214 N 1.05 0.10 -0.17 1.13 3.86 -1.22 -2.10 115.15 117.80 2qrj h HIS 214 Ca 0.28 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.50 2qrj h HIS 214 Cb -0.11 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 28.32 2qrj h HIS 214 CO -0.02 0.09 0.12 0.87 0.86 0.00 0.00 177.93 179.84 2qrj h LYS 215 N 0.09 0.22 -0.01 2.45 1.57 -0.75 -1.19 116.57 118.94 2qrj h LYS 215 Ca 0.03 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2qrj h LYS 215 Cb 0.01 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.27 2qrj h LYS 215 CO -0.01 0.15 -0.15 1.33 -0.57 0.00 0.00 179.45 180.20 2qrj n VAL 216 N -4.51 0.00 -0.39 0.50 0.24 -0.51 -4.96 118.33 108.70 2qrj n VAL 216 Ca -0.00 -0.19 0.00 0.00 -2.04 0.00 0.00 64.34 62.11 2qrj n VAL 216 Cb 0.08 0.47 0.00 0.00 -1.47 0.00 0.00 33.84 32.93 2qrj n VAL 216 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2qrj n GLY 217 N 1.27 0.76 3.69 7.63 0.00 -0.45 -4.84 105.19 113.24 2qrj n GLY 217 Ca 0.15 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 2qrj n GLY 217 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qrj s ILE 218 N -2.00 4.38 0.26 -0.61 1.01 -0.82 -4.97 121.20 118.45 2qrj s ILE 218 Ca 0.00 1.69 -0.31 0.00 0.00 0.00 0.00 60.65 62.03 2qrj s ILE 218 Cb 0.00 -4.09 -0.13 0.00 0.01 0.00 0.00 42.46 38.26 2qrj s ILE 218 CO 0.00 0.01 1.51 -0.81 0.00 0.00 0.00 174.94 175.65 2qrj n PRO 219 N 5.09 2.37 0.29 2.79 -0.04 -1.26 -4.51 135.00 139.73 2qrj n PRO 219 Ca 0.10 0.84 0.14 0.00 -0.04 0.00 0.00 63.50 64.55 2qrj n PRO 219 Cb 0.47 -2.57 0.88 0.00 -0.04 0.00 0.00 33.50 32.24 2qrj n PRO 219 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 2qrj h ASP 220 N 4.66 0.00 0.61 3.54 3.58 -1.95 1.00 116.42 127.85 2qrj h ASP 220 Ca -0.46 0.00 0.00 0.00 0.42 0.00 0.00 57.03 56.99 2qrj h ASP 220 Cb 1.25 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.30 2qrj h ASP 220 CO 0.79 0.02 0.00 0.00 -2.88 0.00 0.00 179.24 177.16 2qrj h ALA 221 N 1.98 1.00 -0.06 -0.78 0.00 -2.01 -2.36 119.26 117.03 2qrj h ALA 221 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2qrj h ALA 221 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2qrj h ALA 221 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.34 2qrj n ASN 222 N -2.36 2.11 -4.41 0.00 5.03 0.34 -4.84 115.26 111.13 2qrj n ASN 222 Ca 0.01 -1.71 -0.40 0.00 0.87 0.00 0.00 54.58 53.35 2qrj n ASN 222 Cb 0.20 -0.03 -0.11 0.00 -1.02 0.00 0.00 39.78 38.82 2qrj n ASN 222 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2qrj s ILE 223 N -1.94 4.63 -0.36 2.41 1.01 -0.89 -0.06 121.20 125.99 2qrj s ILE 223 Ca 0.34 -0.65 -0.21 0.00 0.00 0.00 0.00 60.65 60.13 2qrj s ILE 223 Cb 0.20 -3.48 0.00 0.00 0.01 0.00 0.00 42.46 39.19 2qrj s ILE 223 CO 0.31 -0.11 0.66 -0.76 0.00 0.00 0.00 174.94 175.05 2qrj s LEU 224 N 1.59 4.24 -0.43 2.97 1.02 0.32 -4.98 118.68 123.40 2qrj s LEU 224 Ca 0.03 0.18 -0.11 0.00 0.02 0.00 0.00 54.13 54.26 2qrj s LEU 224 Cb -0.18 -2.82 0.08 0.00 0.02 0.00 0.00 46.19 43.28 2qrj s LEU 224 CO 0.07 -0.61 0.29 -0.54 0.02 0.00 0.00 176.35 175.58 2qrj s LYS 225 N 2.76 2.70 -0.05 1.70 1.02 -1.26 -0.59 119.74 126.02 2qrj s LYS 225 Ca 0.25 -1.42 0.01 0.00 0.02 0.00 0.00 55.97 54.83 2qrj s LYS 225 Cb -0.14 -3.86 -0.03 0.00 -0.52 0.00 0.00 37.83 33.27 2qrj s LYS 225 CO 0.15 -0.96 -0.07 -1.58 -0.92 0.00 0.00 175.35 171.97 2qrj s TRP 226 N 1.48 2.93 0.00 3.18 0.52 0.78 -4.92 118.94 122.92 2qrj s TRP 226 Ca 0.03 0.01 0.00 0.00 0.02 0.00 0.00 56.10 56.17 2qrj s TRP 226 Cb -0.23 -1.69 0.00 0.00 -1.15 0.00 0.00 33.47 30.40 2qrj s TRP 226 CO 0.03 0.35 0.00 -3.47 0.02 0.00 0.00 176.95 173.88 2qrj n ASP 227 N 2.05 0.00 -0.06 2.95 -0.08 -1.26 0.07 116.55 120.22 2qrj n ASP 227 Ca -0.17 0.00 -0.08 0.00 -1.51 0.00 0.00 54.79 53.03 2qrj n ASP 227 Cb 0.53 0.00 -0.01 0.00 2.34 0.00 0.00 41.12 43.98 2qrj n ASP 227 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 2qrj h ILE 228 N 0.00 0.90 -0.88 5.18 1.08 -1.99 -1.73 117.51 120.07 2qrj h ILE 228 Ca 0.00 -0.06 0.24 0.00 -0.39 0.00 0.00 64.86 64.65 2qrj h ILE 228 Cb 0.00 0.72 -0.14 0.00 -3.07 0.00 0.00 36.82 34.32 2qrj h ILE 228 CO 0.00 0.03 0.21 0.50 -0.69 0.00 0.00 178.15 178.20 2qrj h LYS 229 N 0.17 0.18 0.15 2.37 3.64 -2.00 -1.46 116.57 119.62 2qrj h LYS 229 Ca 0.12 -0.01 -0.33 0.00 -1.27 0.00 0.00 60.65 59.16 2qrj h LYS 229 Cb 0.11 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 31.88 2qrj h LYS 229 CO -0.14 0.12 -1.69 0.93 -2.27 0.00 0.00 179.45 176.40 2qrj h GLU 230 N 0.18 0.31 0.00 1.90 3.07 -1.89 -3.38 114.58 114.78 2qrj h GLU 230 Ca 0.55 -0.53 -0.11 0.00 -0.50 0.00 0.00 59.36 58.77 2qrj h GLU 230 Cb 1.11 0.20 -0.02 0.00 -0.84 0.00 0.00 28.75 29.20 2qrj h GLU 230 CO -0.68 1.25 -0.54 1.79 -1.40 0.00 0.00 179.01 179.44 2qrj h THR 231 N -0.06 1.13 -0.23 1.13 1.35 -1.13 -3.08 112.91 112.02 2qrj h THR 231 Ca -0.35 -2.04 0.07 0.00 -0.55 0.00 0.00 66.41 63.54 2qrj h THR 231 Cb 1.96 2.19 -0.01 0.00 -1.73 0.00 0.00 68.15 70.56 2qrj h THR 231 CO 0.11 0.53 0.23 0.77 -0.25 0.00 0.00 175.52 176.91 2qrj h SER 232 N 0.00 0.00 -0.88 5.36 4.64 -1.44 -0.50 113.55 120.73 2qrj h SER 232 Ca -0.01 0.00 0.14 0.00 -0.47 0.00 0.00 61.79 61.46 2qrj h SER 232 Cb 1.14 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.16 2qrj h SER 232 CO 0.07 0.00 0.57 -0.09 -0.87 0.00 0.00 176.83 176.51 2qrj h ARG 233 N 0.00 0.66 0.00 4.77 2.43 -1.74 -3.49 114.38 117.01 2qrj h ARG 233 Ca 0.11 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 2qrj h ARG 233 Cb 0.57 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 2qrj h ARG 233 CO -0.00 0.44 0.00 0.41 -1.51 0.00 0.00 179.97 179.31 2qrj n GLY 234 N -1.44 0.98 2.66 2.80 0.00 -0.20 -5.11 105.19 104.90 2qrj n GLY 234 Ca 0.17 -1.48 -0.18 0.00 0.00 0.00 0.00 46.02 44.53 2qrj n GLY 234 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qrj n GLY 235 N 1.33 -0.31 3.81 -0.02 0.00 -1.26 -4.79 105.19 103.95 2qrj n GLY 235 Ca 0.00 -1.86 -0.34 0.00 0.00 0.00 0.00 46.02 43.82 2qrj n GLY 235 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qrj s PRO 236 N -4.61 4.17 -0.24 1.61 0.04 -1.15 -4.72 135.00 130.09 2qrj s PRO 236 Ca 0.49 1.24 -0.12 0.00 0.04 0.00 0.00 61.00 62.64 2qrj s PRO 236 Cb -0.02 -2.27 -0.05 0.00 0.04 0.00 0.00 34.50 32.21 2qrj s PRO 236 CO 0.33 -0.10 0.24 -0.06 0.04 0.00 0.00 177.00 177.46 2qrj s PHE 237 N -2.02 3.31 0.56 0.56 0.08 0.91 -4.97 117.98 116.42 2qrj s PHE 237 Ca 0.61 0.33 0.24 0.00 0.12 0.00 0.00 56.93 58.23 2qrj s PHE 237 Cb -0.13 -2.38 1.56 0.00 -0.57 0.00 0.00 43.02 41.50 2qrj s PHE 237 CO 0.17 -0.01 2.19 -0.44 -0.10 0.00 0.00 175.22 177.03 2qrj h ASP 238 N 7.66 0.00 0.12 1.36 3.32 -2.00 -2.62 116.42 124.27 2qrj h ASP 238 Ca -0.36 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.66 2qrj h ASP 238 Cb 1.17 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.72 2qrj h ASP 238 CO 0.66 0.00 -0.10 -0.33 -1.72 0.00 0.00 179.24 177.74 2qrj h GLU 239 N 0.00 0.00 0.72 3.56 3.07 -1.96 -2.88 114.58 117.10 2qrj h GLU 239 Ca 0.01 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.84 2qrj h GLU 239 Cb 0.06 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 27.98 2qrj h GLU 239 CO -0.00 0.10 -0.35 0.82 -1.40 0.00 0.00 179.01 178.19 2qrj h ILE 240 N 0.00 0.00 0.00 3.13 2.04 -1.82 -1.89 117.51 118.97 2qrj h ILE 240 Ca -0.00 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.76 2qrj h ILE 240 Cb 0.19 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.27 2qrj h ILE 240 CO 0.01 0.00 0.00 1.55 0.00 0.00 0.00 178.15 179.71 2qrj h PRO 241 N -1.07 0.00 0.00 2.37 0.13 -1.73 -2.37 132.00 129.32 2qrj h PRO 241 Ca -0.10 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.95 2qrj h PRO 241 Cb 0.75 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.86 2qrj h PRO 241 CO 0.16 0.00 -0.40 1.96 -0.23 0.00 0.00 178.00 179.50 2qrj h GLN 242 N 0.00 0.00 -7.31 0.86 4.20 -1.44 0.81 115.11 112.23 2qrj h GLN 242 Ca 0.00 0.00 -0.50 0.00 0.06 0.00 0.00 58.65 58.21 2qrj h GLN 242 Cb 0.13 0.00 0.06 0.00 0.30 0.00 0.00 27.48 27.97 2qrj h GLN 242 CO 0.00 0.40 0.40 0.00 -0.67 0.00 0.00 178.83 178.95 2qrj s ALA 243 N -3.04 2.98 0.00 3.87 0.00 -0.72 -4.63 121.76 120.23 2qrj s ALA 243 Ca 0.04 0.04 -0.19 0.00 0.00 0.00 0.00 51.96 51.86 2qrj s ALA 243 Cb 0.07 -3.12 -0.28 0.00 0.00 0.00 0.00 23.12 19.79 2qrj s ALA 243 CO 0.73 -0.71 1.02 -0.44 0.00 0.00 0.00 175.76 176.36 2qrj h ASP 244 N -0.07 0.63 -4.16 0.00 3.32 -1.50 -1.67 116.42 112.96 2qrj h ASP 244 Ca -0.45 -0.85 -0.45 0.00 0.02 0.00 0.00 57.03 55.30 2qrj h ASP 244 Cb 1.20 -0.20 -0.29 0.00 0.22 0.00 0.00 39.33 40.26 2qrj h ASP 244 CO 0.60 1.42 -0.80 -0.63 -1.72 0.00 0.00 179.24 178.11 2qrj s ILE 245 N -2.84 0.97 -0.10 0.35 1.01 -0.71 -0.49 121.20 119.39 2qrj s ILE 245 Ca -0.12 -0.55 0.01 0.00 0.00 0.00 0.00 60.65 59.98 2qrj s ILE 245 Cb 0.03 -0.82 0.02 0.00 0.01 0.00 0.00 42.46 41.70 2qrj s ILE 245 CO 0.86 0.26 -0.11 0.12 0.00 0.00 0.00 174.94 176.07 2qrj s PHE 246 N -0.32 1.62 -0.23 3.97 5.36 -0.21 -0.95 117.98 127.21 2qrj s PHE 246 Ca 0.04 -0.76 -0.01 0.00 -0.96 0.00 0.00 56.93 55.24 2qrj s PHE 246 Cb -0.05 -1.25 0.02 0.00 -0.34 0.00 0.00 43.02 41.40 2qrj s PHE 246 CO -0.00 -0.46 -0.09 0.42 -1.46 0.00 0.00 175.22 173.63 2qrj s ILE 247 N 1.29 2.76 -0.23 3.12 1.01 -0.21 -0.49 121.20 128.45 2qrj s ILE 247 Ca -0.02 -0.92 -0.10 0.00 0.00 0.00 0.00 60.65 59.61 2qrj s ILE 247 Cb -0.14 -2.33 -0.05 0.00 0.01 0.00 0.00 42.46 39.95 2qrj s ILE 247 CO -0.04 0.32 0.15 0.21 0.00 0.00 0.00 174.94 175.57 2qrj s ASN 248 N 1.34 6.09 0.00 3.58 2.47 -0.13 -1.24 114.94 127.05 2qrj s ASN 248 Ca 0.02 0.12 0.09 0.00 0.42 0.00 0.00 52.86 53.51 2qrj s ASN 248 Cb -0.15 -2.09 0.10 0.00 -1.45 0.00 0.00 41.25 37.65 2qrj s ASN 248 CO -0.06 0.09 0.85 0.00 -3.72 0.00 0.00 177.10 174.26 2qrj s ILE 250 N -0.77 4.74 -0.35 0.00 -1.09 -1.25 -4.78 121.20 117.70 2qrj s ILE 250 Ca 0.12 -0.03 -0.25 0.00 -2.23 0.00 0.00 60.65 58.26 2qrj s ILE 250 Cb 0.08 -3.23 0.01 0.00 -1.58 0.00 0.00 42.46 37.73 2qrj s ILE 250 CO 0.11 0.31 0.86 -0.47 -1.23 0.00 0.00 174.94 174.52 2qrj s TYR 251 N 1.62 3.13 -0.02 3.97 5.04 -1.26 -4.81 117.35 125.02 2qrj s TYR 251 Ca 0.07 0.76 0.02 0.00 -2.44 0.00 0.00 57.07 55.47 2qrj s TYR 251 Cb -0.15 -3.46 0.01 0.00 0.35 0.00 0.00 41.96 38.70 2qrj s TYR 251 CO 0.07 -0.72 -0.07 -1.17 -1.34 0.00 0.00 175.55 172.31 2qrj s LEU 252 N 3.24 1.73 -0.00 6.97 2.96 -1.26 -5.04 118.68 127.27 2qrj s LEU 252 Ca 0.35 -0.15 0.13 0.00 -0.22 0.00 0.00 54.13 54.23 2qrj s LEU 252 Cb -0.13 -0.47 0.21 0.00 0.50 0.00 0.00 46.19 46.30 2qrj s LEU 252 CO 0.16 0.04 1.08 -1.54 -1.32 0.00 0.00 176.35 174.77 2qrj n SER 253 N 3.39 0.50 -4.82 3.68 3.41 -1.26 -4.31 113.62 114.21 2qrj n SER 253 Ca -0.19 -2.02 -0.35 0.00 -0.26 0.00 0.00 58.87 56.06 2qrj n SER 253 Cb 0.54 -0.25 -0.06 0.00 -0.26 0.00 0.00 64.21 64.18 2qrj n SER 253 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2qrj s LYS 254 N -0.04 4.25 -0.98 4.33 -0.14 -1.26 -4.48 119.74 121.42 2qrj s LYS 254 Ca 0.17 0.95 -0.06 0.00 -1.36 0.00 0.00 55.97 55.67 2qrj s LYS 254 Cb 0.19 -2.63 -0.06 0.00 -1.68 0.00 0.00 37.83 33.64 2qrj s LYS 254 CO -0.08 0.24 2.26 -2.30 -0.76 0.00 0.00 175.35 174.71 2qrj n PRO 255 N 0.19 2.30 -3.09 -1.68 -0.02 -1.26 -4.83 135.00 126.61 2qrj n PRO 255 Ca 0.02 -1.53 -0.18 0.00 -2.02 0.00 0.00 63.50 59.78 2qrj n PRO 255 Cb 0.52 -2.47 0.01 0.00 -0.02 0.00 0.00 33.50 31.54 2qrj n PRO 255 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 2qrj s ILE 256 N 3.13 2.78 0.30 4.25 1.10 -1.26 -5.07 121.20 126.43 2qrj s ILE 256 Ca 0.44 -1.05 -0.30 0.00 -0.51 0.00 0.00 60.65 59.24 2qrj s ILE 256 Cb 0.12 -2.83 -0.11 0.00 0.15 0.00 0.00 42.46 39.79 2qrj s ILE 256 CO -0.04 0.00 1.57 0.00 -2.11 0.00 0.00 174.94 174.36 2qrj s ALA 257 N -2.43 3.71 0.75 1.50 0.00 -1.26 -4.99 121.76 119.04 2qrj s ALA 257 Ca 0.55 1.56 -0.11 0.00 0.00 0.00 0.00 51.96 53.96 2qrj s ALA 257 Cb -0.08 -3.64 0.05 0.00 0.00 0.00 0.00 23.12 19.45 2qrj s ALA 257 CO 0.33 -0.98 1.09 -1.25 0.00 0.00 0.00 175.76 174.96 2qrj s PRO 258 N -0.75 2.34 0.18 0.00 0.04 -1.26 -4.22 135.00 131.32 2qrj s PRO 258 Ca 0.61 1.21 -0.10 0.00 0.04 0.00 0.00 61.00 62.76 2qrj s PRO 258 Cb -0.47 -1.90 0.07 0.00 0.04 0.00 0.00 34.50 32.23 2qrj s PRO 258 CO 0.50 -1.59 1.66 0.74 0.04 0.00 0.00 177.00 178.36 2qrj h PHE 259 N -0.94 1.09 -3.75 0.56 0.04 -0.76 -3.05 116.94 110.13 2qrj h PHE 259 Ca -0.44 -0.16 -0.15 0.00 2.80 0.00 0.00 57.97 60.02 2qrj h PHE 259 Cb 1.23 -0.30 -0.07 0.00 2.20 0.00 0.00 35.95 39.02 2qrj h PHE 259 CO 0.57 0.94 -0.08 -0.08 -0.60 0.00 0.00 178.31 179.06 2qrj s THR 260 N -5.18 0.00 0.33 -1.55 -1.32 -1.23 -0.06 115.64 106.63 2qrj s THR 260 Ca -0.12 -1.42 -0.13 0.00 -1.21 0.00 0.00 61.69 58.81 2qrj s THR 260 Cb 0.13 -2.53 0.02 0.00 -1.51 0.00 0.00 72.50 68.62 2qrj s THR 260 CO 0.84 0.00 0.64 0.54 -2.21 0.00 0.00 174.62 174.42 2qrj s ASN 261 N -3.13 0.17 0.21 8.08 2.20 -1.26 -4.34 114.94 116.87 2qrj s ASN 261 Ca 0.25 -1.10 -0.09 0.00 -0.94 0.00 0.00 52.86 50.98 2qrj s ASN 261 Cb -0.01 0.73 0.16 0.00 -2.00 0.00 0.00 41.25 40.12 2qrj s ASN 261 CO 0.15 -1.42 1.83 0.24 -2.94 0.00 0.00 177.10 174.95 2qrj h MET 262 N 2.08 1.08 -0.44 3.55 2.86 -1.99 -1.30 114.93 120.77 2qrj h MET 262 Ca -0.28 -0.12 0.08 0.00 -2.06 0.00 0.00 59.70 57.32 2qrj h MET 262 Cb 1.25 -0.21 -0.07 0.00 0.06 0.00 0.00 31.60 32.63 2qrj h MET 262 CO 0.36 0.80 0.04 1.49 1.06 0.00 0.00 176.91 180.66 2qrj h GLU 263 N 1.07 0.16 -0.17 1.72 4.81 -1.97 0.13 114.58 120.33 2qrj h GLU 263 Ca 0.27 -0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.39 2qrj h GLU 263 Cb 0.03 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 2qrj h GLU 263 CO -0.04 0.10 -0.36 0.87 -0.73 0.00 0.00 179.01 178.85 2qrj h LYS 264 N 0.16 0.37 0.00 1.92 1.79 -1.90 -3.09 116.57 115.83 2qrj h LYS 264 Ca 0.22 -0.17 -0.09 0.00 -2.18 0.00 0.00 60.65 58.43 2qrj h LYS 264 Cb 0.30 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.93 2qrj h LYS 264 CO -0.32 0.68 -0.43 -0.07 -1.08 0.00 0.00 179.45 178.23 2qrj h LEU 265 N 0.31 0.00 -8.00 2.94 3.38 -0.57 -3.39 115.31 109.99 2qrj h LEU 265 Ca 0.03 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.38 2qrj h LEU 265 Cb 0.79 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.45 2qrj h LEU 265 CO 0.06 0.43 1.81 0.20 0.09 0.00 0.00 178.44 181.03 2qrj s ASN 266 N -6.41 6.62 -0.30 -0.43 0.01 0.39 -4.75 114.94 110.07 2qrj s ASN 266 Ca 0.03 -1.89 -0.11 0.00 -0.71 0.00 0.00 52.86 50.17 2qrj s ASN 266 Cb 0.09 -2.57 0.12 0.00 0.41 0.00 0.00 41.25 39.29 2qrj s ASN 266 CO 0.72 -1.39 0.66 0.21 -1.51 0.00 0.00 177.10 175.79 2qrj s ASN 267 N 4.70 -1.10 0.42 -1.22 3.84 -1.16 -4.76 114.94 115.65 2qrj s ASN 267 Ca 0.50 1.55 0.29 0.00 0.21 0.00 0.00 52.86 55.41 2qrj s ASN 267 Cb 0.02 2.12 1.50 0.00 -0.55 0.00 0.00 41.25 44.34 2qrj s ASN 267 CO -0.02 -0.22 1.88 1.55 -2.79 0.00 0.00 177.10 177.50 2qrj h PRO 268 N 7.80 0.00 -0.02 0.43 0.13 -1.89 -1.75 132.00 136.70 2qrj h PRO 268 Ca -0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 2qrj h PRO 268 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2qrj h PRO 268 CO 0.11 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 177.97 2qrj n ASN 269 N -2.52 1.45 -4.75 1.44 3.02 -1.26 -4.52 115.26 108.11 2qrj n ASN 269 Ca -0.01 -1.49 -0.41 0.00 -0.03 0.00 0.00 54.58 52.64 2qrj n ASN 269 Cb 0.08 -0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.22 2qrj n ASN 269 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 2qrj s ARG 270 N -2.00 4.42 -0.03 3.52 3.52 -0.66 -4.93 118.95 122.79 2qrj s ARG 270 Ca 0.38 2.06 0.20 0.00 -0.13 0.00 0.00 55.73 58.25 2qrj s ARG 270 Cb 0.21 -3.15 -0.24 0.00 -1.56 0.00 0.00 34.95 30.20 2qrj s ARG 270 CO 0.33 -0.16 0.50 0.54 -0.81 0.00 0.00 175.30 175.71 2qrj n ARG 271 N 1.82 0.65 -1.69 5.12 1.74 0.16 -4.47 116.66 120.00 2qrj n ARG 271 Ca 0.03 -0.04 -0.45 0.00 -0.77 0.00 0.00 57.85 56.62 2qrj n ARG 271 Cb 0.43 -1.60 -0.04 0.00 -1.02 0.00 0.00 32.46 30.23 2qrj n ARG 271 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2qrj n LEU 272 N -2.54 3.56 -0.04 0.55 7.94 -0.51 -4.57 117.00 121.40 2qrj n LEU 272 Ca -0.12 1.04 -0.04 0.00 -1.11 0.00 0.00 56.01 55.78 2qrj n LEU 272 Cb 0.77 -1.48 -0.05 0.00 0.53 0.00 0.00 43.42 43.18 2qrj n LEU 272 CO 0.44 -0.04 -0.74 0.54 -1.11 0.00 0.00 177.39 176.48 2qrj n ARG 273 N 4.51 2.53 -3.76 1.96 5.12 0.36 -4.69 116.66 122.69 2qrj n ARG 273 Ca 0.18 0.00 -0.14 0.00 -1.93 0.00 0.00 57.85 55.96 2qrj n ARG 273 Cb 0.32 -1.18 -0.15 0.00 -1.16 0.00 0.00 32.46 30.29 2qrj n ARG 273 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 2qrj s THR 274 N -2.17 -0.06 -0.15 0.55 2.01 -1.14 -1.69 115.64 113.00 2qrj s THR 274 Ca -0.05 0.20 0.01 0.00 0.31 0.00 0.00 61.69 62.17 2qrj s THR 274 Cb 0.02 -0.14 0.00 0.00 0.01 0.00 0.00 72.50 72.39 2qrj s THR 274 CO 0.28 0.08 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.44 2qrj s VAL 275 N 1.11 2.54 -0.40 3.82 1.01 -0.12 -1.05 120.40 127.30 2qrj s VAL 275 Ca -0.09 -0.81 -0.08 0.00 0.00 0.00 0.00 61.98 61.00 2qrj s VAL 275 Cb -0.12 -2.06 0.07 0.00 0.00 0.00 0.00 36.38 34.27 2qrj s VAL 275 CO -0.04 0.52 0.23 -0.69 0.00 0.00 0.00 175.10 175.12 2qrj s VAL 276 N 0.84 4.07 -0.80 2.92 1.01 0.35 -0.79 120.40 127.99 2qrj s VAL 276 Ca -0.05 -1.41 -0.16 0.00 0.00 0.00 0.00 61.98 60.36 2qrj s VAL 276 Cb -0.15 -3.48 0.17 0.00 0.00 0.00 0.00 36.38 32.92 2qrj s VAL 276 CO -0.01 -0.46 0.83 -0.62 0.00 0.00 0.00 175.10 174.84 2qrj s ASP 277 N 1.96 6.61 0.52 3.32 2.15 -0.35 -0.96 116.67 129.93 2qrj s ASP 277 Ca 0.03 -2.29 0.17 0.00 0.43 0.00 0.00 52.55 50.89 2qrj s ASP 277 Cb -0.22 -2.27 1.30 0.00 -0.30 0.00 0.00 42.92 41.43 2qrj s ASP 277 CO 0.02 -0.79 2.14 0.58 -0.17 0.00 0.00 175.17 176.94 2qrj h VAL 278 N 5.29 0.96 -0.05 1.11 2.07 -1.48 -1.84 116.25 122.30 2qrj h VAL 278 Ca 0.04 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.56 2qrj h VAL 278 Cb 1.05 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 31.80 2qrj h VAL 278 CO 0.91 0.00 0.00 -1.20 0.02 0.00 0.00 177.57 177.30 2qrj n SER 279 N -4.49 0.97 -4.66 0.57 7.64 -1.24 -4.93 113.62 107.48 2qrj n SER 279 Ca -0.02 -1.45 -0.45 0.00 1.01 0.00 0.00 58.87 57.96 2qrj n SER 279 Cb 0.13 -0.03 -0.03 0.00 -1.01 0.00 0.00 64.21 63.27 2qrj n SER 279 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2qrj n ALA 280 N -0.19 0.92 -3.41 -0.43 0.00 -0.69 -4.89 120.51 111.82 2qrj n ALA 280 Ca 0.18 0.42 -0.09 0.00 0.00 0.00 0.00 53.44 53.96 2qrj n ALA 280 Cb 0.25 -2.26 -0.08 0.00 0.00 0.00 0.00 19.45 17.36 2qrj n ALA 280 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2qrj s ASP 281 N 0.33 0.08 0.34 0.00 -1.08 -1.26 -4.79 116.67 110.29 2qrj s ASP 281 Ca 0.70 0.41 0.26 0.00 -0.52 0.00 0.00 52.55 53.41 2qrj s ASP 281 Cb -0.68 1.20 1.14 0.00 -1.46 0.00 0.00 42.92 43.12 2qrj s ASP 281 CO 0.49 -0.28 1.79 0.71 0.52 0.00 0.00 175.17 178.39 2qrj h THR 282 N 6.18 0.00 -0.00 1.71 1.35 -1.93 -2.03 112.91 118.18 2qrj h THR 282 Ca -0.19 -0.25 0.00 0.00 -0.55 0.00 0.00 66.41 65.42 2qrj h THR 282 Cb 1.15 1.02 0.00 0.00 -1.73 0.00 0.00 68.15 68.59 2qrj h THR 282 CO 0.24 0.00 -0.16 0.35 -0.25 0.00 0.00 175.52 175.70 2qrj n THR 283 N -2.45 0.00 -1.67 6.82 -2.24 -1.26 -4.90 114.28 108.57 2qrj n THR 283 Ca 0.01 -0.06 -0.47 0.00 -2.27 0.00 0.00 64.05 61.27 2qrj n THR 283 Cb 0.22 -0.02 -0.04 0.00 -2.10 0.00 0.00 70.33 68.38 2qrj n THR 283 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2qrj n ASN 284 N -1.01 3.62 0.20 3.42 2.85 -0.77 -4.88 115.26 118.69 2qrj n ASN 284 Ca 0.13 0.92 0.07 0.00 -0.11 0.00 0.00 54.58 55.59 2qrj n ASN 284 Cb 0.30 -1.41 0.37 0.00 1.24 0.00 0.00 39.78 40.27 2qrj n ASN 284 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2qrj h PRO 285 N 9.82 0.00 -2.15 1.20 0.13 -1.90 -3.35 132.00 135.74 2qrj h PRO 285 Ca -0.48 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.07 2qrj h PRO 285 Cb 1.26 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 32.00 2qrj h PRO 285 CO 0.95 0.33 -0.93 0.72 -0.23 0.00 0.00 178.00 178.84 2qrj n HIS 286 N -3.49 0.82 -2.28 1.56 8.25 -1.26 -5.09 115.22 113.73 2qrj n HIS 286 Ca -0.00 -3.73 -0.43 0.00 -0.26 0.00 0.00 57.72 53.30 2qrj n HIS 286 Cb 0.49 -0.35 -0.02 0.00 1.12 0.00 0.00 29.99 31.23 2qrj n HIS 286 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 2qrj s ASN 287 N -1.40 6.75 0.00 0.41 3.84 -1.26 -4.22 114.94 119.07 2qrj s ASN 287 Ca 0.36 1.74 0.15 0.00 0.21 0.00 0.00 52.86 55.32 2qrj s ASN 287 Cb 0.14 -2.54 0.78 0.00 -0.55 0.00 0.00 41.25 39.08 2qrj s ASN 287 CO -0.10 -0.92 1.42 -0.81 -2.79 0.00 0.00 177.10 173.90 2qrj n PRO 288 N 6.99 0.24 -3.32 0.43 -0.04 -1.26 -3.48 135.00 134.56 2qrj n PRO 288 Ca 0.16 0.13 -0.26 0.00 -0.04 0.00 0.00 63.50 63.49 2qrj n PRO 288 Cb 0.45 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.33 2qrj n PRO 288 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 2qrj n ILE 289 N -1.26 1.37 -1.44 0.52 5.41 -1.26 0.02 119.36 122.72 2qrj n ILE 289 Ca 0.08 -4.84 -0.40 0.00 1.00 0.00 0.00 62.75 58.59 2qrj n ILE 289 Cb 0.12 -1.97 -0.02 0.00 -0.71 0.00 0.00 39.64 37.05 2qrj n ILE 289 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 2qrj n PRO 290 N 0.95 3.61 -0.07 0.38 -0.04 -1.23 -4.20 135.00 134.41 2qrj n PRO 290 Ca 0.27 -2.36 0.01 0.00 -0.04 0.00 0.00 63.50 61.38 2qrj n PRO 290 Cb 0.45 -2.88 0.01 0.00 -0.04 0.00 0.00 33.50 31.05 2qrj n PRO 290 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 2qrj n ILE 291 N 3.73 0.52 -3.63 0.52 -5.35 -1.26 -4.60 119.36 109.28 2qrj n ILE 291 Ca 0.73 -0.55 -0.15 0.00 -0.27 0.00 0.00 62.75 62.50 2qrj n ILE 291 Cb 0.26 0.65 -0.07 0.00 -1.74 0.00 0.00 39.64 38.74 2qrj n ILE 291 CO 0.00 0.00 0.00 -0.72 -1.76 0.00 0.00 176.55 174.07 2qrj s TYR 292 N -0.61 -0.43 0.00 4.28 -0.85 -1.26 -4.73 117.35 113.75 2qrj s TYR 292 Ca 0.03 0.67 0.00 0.00 -0.52 0.00 0.00 57.07 57.25 2qrj s TYR 292 Cb 0.03 0.27 0.00 0.00 0.38 0.00 0.00 41.96 42.64 2qrj s TYR 292 CO 0.00 -0.53 0.07 0.25 -1.52 0.00 0.00 175.55 173.83 2qrj n THR 293 N 0.97 0.00 -4.35 -3.49 -2.24 -1.26 -5.04 114.28 98.86 2qrj n THR 293 Ca -0.20 -0.38 -0.35 0.00 -2.27 0.00 0.00 64.05 60.85 2qrj n THR 293 Cb 0.57 1.05 -0.09 0.00 -2.10 0.00 0.00 70.33 69.75 2qrj n THR 293 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2qrj s VAL 294 N -0.62 4.36 -0.45 2.28 1.01 -1.26 -4.94 120.40 120.78 2qrj s VAL 294 Ca 0.00 -0.23 -0.20 0.00 0.00 0.00 0.00 61.98 61.55 2qrj s VAL 294 Cb 0.00 -2.84 0.03 0.00 0.00 0.00 0.00 36.38 33.57 2qrj s VAL 294 CO 0.00 0.60 0.64 0.00 0.00 0.00 0.00 175.10 176.34 2qrj s ALA 295 N -0.89 3.35 0.89 5.51 0.00 -1.26 -4.78 121.76 124.57 2qrj s ALA 295 Ca 0.13 -1.33 -0.12 0.00 0.00 0.00 0.00 51.96 50.64 2qrj s ALA 295 Cb -0.11 -3.31 0.12 0.00 0.00 0.00 0.00 23.12 19.82 2qrj s ALA 295 CO 0.02 -1.84 1.12 0.95 0.00 0.00 0.00 175.76 176.02 2qrj s THR 296 N 2.78 2.28 0.15 0.00 -4.23 -1.21 -4.87 115.64 110.55 2qrj s THR 296 Ca 0.21 0.09 0.00 0.00 -1.18 0.00 0.00 61.69 60.81 2qrj s THR 296 Cb -0.15 -2.82 -0.04 0.00 1.34 0.00 0.00 72.50 70.83 2qrj s THR 296 CO 0.17 -0.12 0.04 0.68 -0.54 0.00 0.00 174.62 174.85 2qrj s VAL 297 N -3.22 0.35 0.40 2.29 -7.23 -1.03 -3.67 120.40 108.29 2qrj s VAL 297 Ca 0.63 -1.94 0.08 0.00 -1.81 0.00 0.00 61.98 58.94 2qrj s VAL 297 Cb -0.15 -2.10 0.28 0.00 0.56 0.00 0.00 36.38 34.97 2qrj s VAL 297 CO 0.54 -0.45 2.03 -0.26 -0.31 0.00 0.00 175.10 176.65 2qrj h PHE 298 N 2.78 0.55 0.00 2.82 0.04 -1.94 -1.47 116.94 119.72 2qrj h PHE 298 Ca -0.36 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.43 2qrj h PHE 298 Cb 1.20 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 39.17 2qrj h PHE 298 CO 0.47 0.33 0.00 0.27 -0.60 0.00 0.00 178.31 178.78 2qrj n ASN 299 N -4.47 0.51 -2.92 2.17 6.94 -1.26 -1.17 115.26 115.07 2qrj n ASN 299 Ca 0.06 0.58 -0.13 0.00 -0.02 0.00 0.00 54.58 55.07 2qrj n ASN 299 Cb 0.14 -0.71 0.00 0.00 -2.36 0.00 0.00 39.78 36.85 2qrj n ASN 299 CO 0.00 0.00 0.00 1.17 -1.03 0.00 0.00 177.26 177.40 2qrj n LYS 300 N -2.02 0.67 0.00 -3.83 4.81 -0.64 -3.91 118.16 113.24 2qrj n LYS 300 Ca 0.04 -2.28 0.14 0.00 -0.87 0.00 0.00 58.31 55.35 2qrj n LYS 300 Cb 0.31 -1.42 0.59 0.00 0.02 0.00 0.00 35.03 34.53 2qrj n LYS 300 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2qrj n PRO 301 N 1.92 0.03 -4.29 1.64 -0.04 -0.67 -2.47 135.00 131.12 2qrj n PRO 301 Ca 0.15 -0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.41 2qrj n PRO 301 Cb 0.58 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.43 2qrj n PRO 301 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2qrj s THR 302 N -2.97 1.60 -0.01 0.52 -4.23 -1.26 -4.39 115.64 104.89 2qrj s THR 302 Ca 0.15 -1.78 0.01 0.00 -1.18 0.00 0.00 61.69 58.89 2qrj s THR 302 Cb 0.19 -1.67 0.01 0.00 1.34 0.00 0.00 72.50 72.37 2qrj s THR 302 CO 0.54 -0.32 -0.04 0.54 -0.54 0.00 0.00 174.62 174.80 2qrj s VAL 303 N -1.95 0.37 0.27 2.29 0.11 -0.27 -4.96 120.40 116.27 2qrj s VAL 303 Ca 0.11 -0.15 -0.30 0.00 -2.93 0.00 0.00 61.98 58.72 2qrj s VAL 303 Cb -0.06 -0.35 -0.10 0.00 -1.53 0.00 0.00 36.38 34.33 2qrj s VAL 303 CO 0.05 0.13 1.46 -0.22 -3.33 0.00 0.00 175.10 173.19 2qrj s LEU 304 N 0.22 4.38 -0.23 2.54 2.96 -1.26 -0.28 118.68 127.01 2qrj s LEU 304 Ca -0.02 2.75 -0.19 0.00 -0.22 0.00 0.00 54.13 56.45 2qrj s LEU 304 Cb -0.06 -3.63 -0.03 0.00 0.50 0.00 0.00 46.19 42.97 2qrj s LEU 304 CO -0.00 -0.74 0.56 -0.69 -1.32 0.00 0.00 176.35 174.15 2qrj s VAL 305 N -0.19 5.05 -1.51 1.68 1.01 0.02 -4.84 120.40 121.63 2qrj s VAL 305 Ca 0.59 1.01 -0.10 0.00 0.00 0.00 0.00 61.98 63.47 2qrj s VAL 305 Cb -0.43 -3.87 -0.00 0.00 0.00 0.00 0.00 36.38 32.07 2qrj s VAL 305 CO 0.46 0.11 2.62 -0.81 0.00 0.00 0.00 175.10 177.48 2qrj n PRO 306 N 5.26 3.72 -2.10 2.72 -0.04 -1.26 -4.57 135.00 138.74 2qrj n PRO 306 Ca -0.03 -2.64 -0.36 0.00 -0.04 0.00 0.00 63.50 60.43 2qrj n PRO 306 Cb 0.50 -2.87 0.02 0.00 -0.04 0.00 0.00 33.50 31.11 2qrj n PRO 306 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2qrj s THR 307 N 1.54 2.79 -0.93 0.52 -4.23 -1.26 -4.97 115.64 109.09 2qrj s THR 307 Ca 0.60 0.53 0.17 0.00 -1.18 0.00 0.00 61.69 61.81 2qrj s THR 307 Cb 0.17 -3.24 -0.16 0.00 1.34 0.00 0.00 72.50 70.61 2qrj s THR 307 CO -0.07 -0.07 0.76 0.35 -0.54 0.00 0.00 174.62 175.05 2qrj n THR 308 N -1.18 0.00 -3.80 3.99 -2.24 -1.26 -4.98 114.28 104.81 2qrj n THR 308 Ca 0.11 -0.13 -0.11 0.00 -2.27 0.00 0.00 64.05 61.65 2qrj n THR 308 Cb 0.49 1.03 -0.08 0.00 -2.10 0.00 0.00 70.33 69.67 2qrj n THR 308 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qrj s ALA 309 N -2.53 -0.52 0.00 6.98 0.00 -1.26 -4.96 121.76 119.47 2qrj s ALA 309 Ca 0.08 -0.12 0.00 0.00 0.00 0.00 0.00 51.96 51.92 2qrj s ALA 309 Cb 0.13 0.28 0.00 0.00 0.00 0.00 0.00 23.12 23.53 2qrj s ALA 309 CO 0.66 -0.37 0.00 0.41 0.00 0.00 0.00 175.76 176.46 2qrj n GLY 310 N 0.71 0.05 3.78 0.00 0.00 -1.21 -3.00 105.19 105.51 2qrj n GLY 310 Ca -0.19 -1.86 -0.31 0.00 0.00 0.00 0.00 46.02 43.66 2qrj n GLY 310 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qrj s PRO 311 N -1.62 2.19 0.17 1.61 0.04 -1.26 -4.94 135.00 131.19 2qrj s PRO 311 Ca 0.00 0.95 -0.34 0.00 0.04 0.00 0.00 61.00 61.66 2qrj s PRO 311 Cb 0.00 -1.91 -0.14 0.00 0.04 0.00 0.00 34.50 32.50 2qrj s PRO 311 CO 0.00 -1.63 1.59 1.17 0.04 0.00 0.00 177.00 178.17 2qrj n LYS 312 N -3.48 2.21 -5.06 4.56 4.81 -1.26 -4.97 118.16 114.96 2qrj n LYS 312 Ca 0.08 0.80 -0.29 0.00 -0.87 0.00 0.00 58.31 58.02 2qrj n LYS 312 Cb 0.54 -2.57 -0.16 0.00 0.02 0.00 0.00 35.03 32.86 2qrj n LYS 312 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 2qrj s LEU 313 N 0.93 1.99 0.18 3.14 2.96 -1.26 -4.63 118.68 121.99 2qrj s LEU 313 Ca 0.78 -0.46 0.08 0.00 -0.22 0.00 0.00 54.13 54.32 2qrj s LEU 313 Cb -0.66 -1.21 -0.04 0.00 0.50 0.00 0.00 46.19 44.77 2qrj s LEU 313 CO 0.37 0.18 -0.17 -0.44 -1.32 0.00 0.00 176.35 174.97 2qrj s SER 314 N 0.10 2.69 -0.03 3.68 0.01 -0.68 -0.80 113.70 118.68 2qrj s SER 314 Ca -0.08 -0.92 0.05 0.00 1.31 0.00 0.00 55.95 56.30 2qrj s SER 314 Cb -0.14 -0.16 -0.03 0.00 0.21 0.00 0.00 66.02 65.90 2qrj s SER 314 CO 0.05 -0.08 -0.17 -0.69 0.41 0.00 0.00 173.24 172.76 2qrj s VAL 315 N -2.38 2.86 -0.20 3.43 1.01 0.62 -0.94 120.40 124.80 2qrj s VAL 315 Ca 0.19 -0.88 -0.04 0.00 0.00 0.00 0.00 61.98 61.25 2qrj s VAL 315 Cb -0.04 -2.13 -0.02 0.00 0.00 0.00 0.00 36.38 34.20 2qrj s VAL 315 CO 0.07 0.53 -0.03 -0.63 0.00 0.00 0.00 175.10 175.05 2qrj s ILE 316 N -0.76 3.66 -0.01 2.22 1.01 0.03 -1.11 121.20 126.25 2qrj s ILE 316 Ca 0.12 -0.41 0.25 0.00 0.00 0.00 0.00 60.65 60.61 2qrj s ILE 316 Cb -0.10 -2.65 0.42 0.00 0.01 0.00 0.00 42.46 40.14 2qrj s ILE 316 CO 0.01 0.44 1.17 -1.54 0.00 0.00 0.00 174.94 175.01 2qrj n SER 317 N 4.36 0.97 -4.71 3.58 3.41 -1.26 -1.21 113.62 118.76 2qrj n SER 317 Ca -0.18 -2.00 -0.42 0.00 -0.26 0.00 0.00 58.87 56.01 2qrj n SER 317 Cb 0.52 -0.29 -0.03 0.00 -0.26 0.00 0.00 64.21 64.14 2qrj n SER 317 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2qrj s ILE 318 N -0.10 2.31 -2.52 -1.33 1.01 -1.24 -3.35 121.20 115.98 2qrj s ILE 318 Ca 0.33 0.12 0.26 0.00 0.00 0.00 0.00 60.65 61.36 2qrj s ILE 318 Cb 0.38 -3.08 0.49 0.00 0.01 0.00 0.00 42.46 40.26 2qrj s ILE 318 CO -0.16 0.01 1.64 -0.90 0.00 0.00 0.00 174.94 175.52 2qrj n ASP 319 N 4.54 1.78 -2.60 3.58 5.68 -1.26 -4.12 116.55 124.14 2qrj n ASP 319 Ca 0.16 -1.61 -0.09 0.00 -0.50 0.00 0.00 54.79 52.75 2qrj n ASP 319 Cb 0.37 -0.03 0.04 0.00 -1.14 0.00 0.00 41.12 40.36 2qrj n ASP 319 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2qrj n HIS 320 N 0.39 1.74 -0.35 2.11 1.44 -1.26 -4.96 115.22 114.33 2qrj n HIS 320 Ca 0.18 -2.36 0.23 0.00 -2.01 0.00 0.00 57.72 53.76 2qrj n HIS 320 Cb 0.39 -0.27 0.47 0.00 0.12 0.00 0.00 29.99 30.70 2qrj n HIS 320 CO 0.00 0.00 0.00 -0.07 -2.81 0.00 0.00 176.34 173.46 2qrj h LEU 321 N 2.59 0.53 -2.31 2.39 3.38 -1.91 -0.18 115.31 119.80 2qrj h LEU 321 Ca 0.01 0.14 0.03 0.00 0.09 0.00 0.00 57.88 58.15 2qrj h LEU 321 Cb 1.28 0.07 -0.00 0.00 0.09 0.00 0.00 40.66 42.10 2qrj h LEU 321 CO 0.42 -0.01 0.11 -0.65 0.09 0.00 0.00 178.44 178.40 2qrj h PRO 322 N 0.40 0.00 0.00 1.13 0.11 -1.85 0.22 132.00 132.01 2qrj h PRO 322 Ca 0.68 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.79 2qrj h PRO 322 Cb 1.58 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.69 2qrj h PRO 322 CO -0.47 0.00 0.00 0.45 -0.21 0.00 0.00 178.00 177.77 2qrj n SER 323 N -3.88 0.00 0.22 -2.05 2.88 -0.08 -1.39 113.62 109.33 2qrj n SER 323 Ca -0.01 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.65 2qrj n SER 323 Cb 0.21 -0.23 0.36 0.00 -0.75 0.00 0.00 64.21 63.80 2qrj n SER 323 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 2qrj h LEU 324 N 0.00 0.00 -5.96 2.46 5.85 -0.72 -3.29 115.31 113.65 2qrj h LEU 324 Ca 0.00 0.00 -0.57 0.00 0.84 0.00 0.00 57.88 58.15 2qrj h LEU 324 Cb 0.09 0.00 -0.41 0.00 0.37 0.00 0.00 40.66 40.72 2qrj h LEU 324 CO 0.00 0.15 -0.87 -0.11 -0.34 0.00 0.00 178.44 177.27 2qrj n LEU 325 N -3.20 2.21 0.04 2.25 7.94 -0.48 -1.00 117.00 124.76 2qrj n LEU 325 Ca 0.02 -5.16 -0.03 0.00 -1.11 0.00 0.00 56.01 49.72 2qrj n LEU 325 Cb 0.48 0.01 0.21 0.00 0.53 0.00 0.00 43.42 44.64 2qrj n LEU 325 CO 0.33 2.15 0.70 1.55 -1.11 0.00 0.00 177.39 181.00 2qrj h PRO 326 N 3.75 0.40 0.41 1.96 0.13 -1.63 -1.53 132.00 135.50 2qrj h PRO 326 Ca 0.13 -0.17 -0.02 0.00 -0.87 0.00 0.00 66.00 65.07 2qrj h PRO 326 Cb 0.76 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.87 2qrj h PRO 326 CO 0.66 0.68 -0.20 -0.09 -0.23 0.00 0.00 178.00 178.82 2qrj h ARG 327 N 0.35 -0.53 -0.71 0.86 2.43 -1.84 -1.75 114.38 113.19 2qrj h ARG 327 Ca 0.05 0.04 0.11 0.00 -0.81 0.00 0.00 59.98 59.36 2qrj h ARG 327 Cb 0.73 0.12 -0.08 0.00 -0.42 0.00 0.00 29.97 30.32 2qrj h ARG 327 CO 0.06 -0.35 0.31 0.93 -1.51 0.00 0.00 179.97 179.41 2qrj h GLU 328 N -0.66 0.50 -0.54 0.20 3.07 -1.90 0.32 114.58 115.57 2qrj h GLU 328 Ca -0.06 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 58.75 2qrj h GLU 328 Cb 0.42 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.19 2qrj h GLU 328 CO 0.09 0.33 0.26 0.00 -1.40 0.00 0.00 179.01 178.29 2qrj h ALA 329 N 1.47 0.70 -0.39 3.43 0.00 -1.28 -1.61 119.26 121.57 2qrj h ALA 329 Ca 0.36 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 55.07 2qrj h ALA 329 Cb 0.46 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2qrj h ALA 329 CO -0.32 0.26 -0.05 0.77 0.00 0.00 0.00 179.25 179.91 2qrj h SER 330 N 0.73 0.72 -0.58 0.00 0.02 -1.03 -1.64 113.55 111.77 2qrj h SER 330 Ca 0.19 -0.34 0.03 0.00 -0.84 0.00 0.00 61.79 60.82 2qrj h SER 330 Cb 0.12 -0.19 -0.04 0.00 0.14 0.00 0.00 62.40 62.43 2qrj h SER 330 CO -0.02 0.89 0.35 -0.33 -1.14 0.00 0.00 176.83 176.58 2qrj h GLU 331 N 0.53 0.67 -0.19 3.45 4.39 -0.59 0.10 114.58 122.95 2qrj h GLU 331 Ca 0.10 -0.04 -0.21 0.00 0.34 0.00 0.00 59.36 59.55 2qrj h GLU 331 Cb 0.55 -0.15 0.01 0.00 -0.10 0.00 0.00 28.75 29.06 2qrj h GLU 331 CO 0.03 0.45 -0.69 0.74 -1.16 0.00 0.00 179.01 178.37 2qrj h PHE 332 N 0.69 1.07 -0.16 4.33 0.04 -1.27 -2.00 116.94 119.65 2qrj h PHE 332 Ca 0.24 -0.44 -0.03 0.00 2.80 0.00 0.00 57.97 60.53 2qrj h PHE 332 Cb 0.03 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 38.00 2qrj h PHE 332 CO -0.06 1.28 -0.03 0.35 -0.60 0.00 0.00 178.31 179.25 2qrj h PHE 333 N 0.56 0.33 -0.54 -0.55 3.57 -1.18 -1.98 116.94 117.15 2qrj h PHE 333 Ca -0.03 -0.07 -0.09 0.00 3.53 0.00 0.00 57.97 61.32 2qrj h PHE 333 Cb 1.32 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.95 2qrj h PHE 333 CO 0.08 0.55 -0.01 1.03 -2.23 0.00 0.00 178.31 177.74 2qrj h SER 334 N 0.01 0.89 -0.52 0.41 0.87 -0.83 -1.75 113.55 112.64 2qrj h SER 334 Ca 0.04 -0.24 -0.01 0.00 -1.23 0.00 0.00 61.79 60.35 2qrj h SER 334 Cb 0.44 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 62.14 2qrj h SER 334 CO 0.01 0.96 0.28 -0.74 -0.53 0.00 0.00 176.83 176.81 2qrj h HIS 335 N 0.85 0.72 -0.01 2.24 -0.00 -1.32 -0.43 115.15 117.21 2qrj h HIS 335 Ca 0.16 -0.02 -0.07 0.00 -0.00 0.00 0.00 60.37 60.43 2qrj h HIS 335 Cb 0.51 -0.23 -0.01 0.00 -0.00 0.00 0.00 27.41 27.68 2qrj h HIS 335 CO 0.03 0.54 -0.34 -0.44 -0.00 0.00 0.00 177.93 177.73 2qrj h ASP 336 N 0.70 0.02 1.58 3.26 3.32 -0.97 -2.76 116.42 121.56 2qrj h ASP 336 Ca 0.18 -0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.15 2qrj h ASP 336 Cb 0.06 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 2qrj h ASP 336 CO -0.03 0.36 -0.37 0.25 -1.72 0.00 0.00 179.24 177.73 2qrj h LEU 337 N 0.02 0.00 -0.36 1.55 5.85 -0.86 -3.40 115.31 118.11 2qrj h LEU 337 Ca -0.00 0.00 0.08 0.00 0.84 0.00 0.00 57.88 58.80 2qrj h LEU 337 Cb 0.61 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 41.55 2qrj h LEU 337 CO 0.04 0.37 -0.22 0.25 -0.34 0.00 0.00 178.44 178.54 2qrj h LEU 338 N 0.00 -0.75 -0.66 2.25 5.85 -0.78 -0.67 115.31 120.56 2qrj h LEU 338 Ca -0.00 0.16 0.12 0.00 0.84 0.00 0.00 57.88 58.99 2qrj h LEU 338 Cb 1.26 0.38 -0.09 0.00 0.37 0.00 0.00 40.66 42.58 2qrj h LEU 338 CO 0.05 -0.25 0.20 -0.65 -0.34 0.00 0.00 178.44 177.45 2qrj h PRO 339 N -0.17 0.33 -0.66 5.25 0.11 -1.77 0.21 132.00 135.31 2qrj h PRO 339 Ca 0.18 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.21 2qrj h PRO 339 Cb 0.45 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 31.46 2qrj h PRO 339 CO -0.46 0.22 0.20 0.77 -0.21 0.00 0.00 178.00 178.51 2qrj h SER 340 N 0.34 0.97 -0.88 -2.05 0.02 -1.72 -2.66 113.55 107.58 2qrj h SER 340 Ca 0.35 -0.21 -0.01 0.00 -0.84 0.00 0.00 61.79 61.08 2qrj h SER 340 Cb 0.51 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 62.76 2qrj h SER 340 CO -0.39 0.93 0.53 -0.07 -1.14 0.00 0.00 176.83 176.68 2qrj h LEU 341 N 0.96 1.06 -1.85 5.07 3.38 0.14 -1.86 115.31 122.21 2qrj h LEU 341 Ca 0.21 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2qrj h LEU 341 Cb 0.31 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2qrj h LEU 341 CO -0.00 0.81 0.00 -0.33 0.09 0.00 0.00 178.44 179.01 2qrj h GLU 342 N 1.22 0.00 -0.02 1.13 5.08 -0.37 -1.81 114.58 119.82 2qrj h GLU 342 Ca 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 2qrj h GLU 342 Cb -0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.20 2qrj h GLU 342 CO -0.06 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 179.23 2qrj n LEU 343 N -3.05 0.89 0.10 1.33 4.32 -0.71 -4.45 117.00 115.43 2qrj n LEU 343 Ca -0.00 -0.30 0.02 0.00 -0.02 0.00 0.00 56.01 55.71 2qrj n LEU 343 Cb 0.24 -0.00 0.39 0.00 -1.62 0.00 0.00 43.42 42.43 2qrj n LEU 343 CO 0.25 0.15 0.93 -0.07 -1.22 0.00 0.00 177.39 177.43 2qrj h LEU 344 N 1.37 0.27 -0.52 2.23 3.38 -1.27 -2.90 115.31 117.86 2qrj h LEU 344 Ca 0.00 -0.05 0.10 0.00 0.09 0.00 0.00 57.88 58.03 2qrj h LEU 344 Cb 0.29 -0.07 -0.09 0.00 0.09 0.00 0.00 40.66 40.88 2qrj h LEU 344 CO 0.00 0.38 -0.05 -0.65 0.09 0.00 0.00 178.44 178.21 2qrj h PRO 345 N 0.28 0.06 -2.01 1.13 0.11 -1.82 -2.77 132.00 126.99 2qrj h PRO 345 Ca 0.06 -0.00 -0.76 0.00 0.11 0.00 0.00 66.00 65.41 2qrj h PRO 345 Cb 0.31 -0.01 -0.29 0.00 0.11 0.00 0.00 31.00 31.12 2qrj h PRO 345 CO 0.01 0.04 0.88 0.00 -0.21 0.00 0.00 178.00 178.73 2qrj n GLN 346 N -5.30 3.27 0.21 1.05 10.64 -1.10 -4.76 117.38 121.40 2qrj n GLN 346 Ca 0.06 -3.82 0.14 0.00 -1.83 0.00 0.00 57.00 51.55 2qrj n GLN 346 Cb 0.29 -2.30 0.43 0.00 -0.86 0.00 0.00 30.24 27.80 2qrj n GLN 346 CO 0.00 0.00 0.00 0.07 -1.83 0.00 0.00 177.06 175.30 2qrj h ARG 347 N 3.16 0.00 0.00 2.61 0.11 -1.45 -0.94 114.38 117.88 2qrj h ARG 347 Ca 0.53 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.61 2qrj h ARG 347 Cb 0.15 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.23 2qrj h ARG 347 CO 1.34 0.00 0.00 1.63 0.10 0.00 0.00 179.97 183.04 2qrj n LYS 348 N -2.86 0.08 0.00 0.08 5.02 -1.26 -3.82 118.16 115.40 2qrj n LYS 348 Ca 0.03 0.26 0.00 0.00 -2.02 0.00 0.00 58.31 56.57 2qrj n LYS 348 Cb 0.40 -1.64 0.00 0.00 -0.02 0.00 0.00 35.03 33.77 2qrj n LYS 348 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2qrj n THR 349 N -1.79 0.00 -1.67 -0.18 -2.24 -1.12 -4.92 114.28 102.36 2qrj n THR 349 Ca 0.04 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.40 2qrj n THR 349 Cb 0.24 -0.50 -0.03 0.00 -2.10 0.00 0.00 70.33 67.94 2qrj n THR 349 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qrj s ALA 350 N -1.62 3.41 0.24 6.98 0.00 -0.37 -4.90 121.76 125.51 2qrj s ALA 350 Ca 0.00 1.20 -0.04 0.00 0.00 0.00 0.00 51.96 53.12 2qrj s ALA 350 Cb 0.00 -3.89 0.44 0.00 0.00 0.00 0.00 23.12 19.67 2qrj s ALA 350 CO 0.00 -1.81 1.75 -1.35 0.00 0.00 0.00 175.76 174.35 2qrj h PRO 351 N 11.43 0.49 -0.80 0.00 0.11 -1.91 -0.31 132.00 141.02 2qrj h PRO 351 Ca -0.47 -0.03 0.15 0.00 0.11 0.00 0.00 66.00 65.76 2qrj h PRO 351 Cb 1.24 -0.11 -0.10 0.00 0.11 0.00 0.00 31.00 32.13 2qrj h PRO 351 CO 0.95 0.32 0.34 -0.24 -0.21 0.00 0.00 178.00 179.16 2qrj h VAL 352 N 0.50 0.64 0.07 3.15 3.04 -1.91 0.62 116.25 122.37 2qrj h VAL 352 Ca 0.41 -0.16 -0.28 0.00 -1.01 0.00 0.00 66.70 65.66 2qrj h VAL 352 Cb 0.58 0.13 -0.02 0.00 -2.01 0.00 0.00 31.29 29.97 2qrj h VAL 352 CO -0.37 0.09 -1.41 -0.50 -1.01 0.00 0.00 177.57 174.37 2qrj h TRP 353 N 0.47 0.28 0.47 3.17 4.06 -1.72 -3.15 115.95 119.52 2qrj h TRP 353 Ca 0.45 -0.20 -0.02 0.00 2.06 0.00 0.00 58.89 61.17 2qrj h TRP 353 Cb 0.70 -0.01 0.00 0.00 -1.00 0.00 0.00 29.16 28.85 2qrj h TRP 353 CO -0.15 1.22 -0.23 0.28 -3.56 0.00 0.00 178.44 176.01 2qrj h VAL 354 N 0.04 0.54 -0.84 1.49 2.07 -0.60 -0.74 116.25 118.21 2qrj h VAL 354 Ca -0.19 -0.05 0.20 0.00 0.82 0.00 0.00 66.70 67.48 2qrj h VAL 354 Cb 1.95 0.56 -0.12 0.00 -1.52 0.00 0.00 31.29 32.16 2qrj h VAL 354 CO 0.14 0.01 0.28 0.03 0.02 0.00 0.00 177.57 178.05 2qrj h ARG 355 N -0.66 0.30 -0.19 1.57 3.08 -1.01 -1.66 114.38 115.81 2qrj h ARG 355 Ca -0.06 -0.02 -0.16 0.00 0.07 0.00 0.00 59.98 59.81 2qrj h ARG 355 Cb 0.50 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 2qrj h ARG 355 CO 0.11 0.20 -0.54 0.00 -1.07 0.00 0.00 179.97 178.66 2qrj h ALA 356 N 1.70 0.70 -0.42 0.04 0.00 -1.46 -2.76 119.26 117.06 2qrj h ALA 356 Ca 0.51 -0.51 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 2qrj h ALA 356 Cb 0.96 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 2qrj h ALA 356 CO -0.56 0.69 -0.18 -0.22 0.00 0.00 0.00 179.25 178.98 2qrj h LYS 357 N 0.43 0.87 -0.84 0.00 3.11 -0.41 -2.82 116.57 116.90 2qrj h LYS 357 Ca 0.01 -0.37 -0.02 0.00 -2.81 0.00 0.00 60.65 57.47 2qrj h LYS 357 Cb 1.09 -0.03 -0.04 0.00 -1.00 0.00 0.00 32.23 32.25 2qrj h LYS 357 CO 0.10 1.01 0.46 0.87 -2.81 0.00 0.00 179.45 179.08 2qrj h LYS 358 N 0.69 1.16 -0.39 1.90 1.57 -1.32 -0.27 116.57 119.91 2qrj h LYS 358 Ca 0.10 -0.13 -0.03 0.00 -1.87 0.00 0.00 60.65 58.72 2qrj h LYS 358 Cb 0.74 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.80 2qrj h LYS 358 CO 0.06 0.85 0.13 1.25 -0.57 0.00 0.00 179.45 181.16 2qrj h LEU 359 N 1.17 0.56 -0.46 2.94 6.46 -1.42 0.72 115.31 125.28 2qrj h LEU 359 Ca 0.29 -0.20 0.03 0.00 -0.12 0.00 0.00 57.88 57.89 2qrj h LEU 359 Cb 0.02 -0.15 -0.04 0.00 -0.73 0.00 0.00 40.66 39.77 2qrj h LEU 359 CO -0.05 0.61 0.25 0.15 -0.62 0.00 0.00 178.44 178.77 2qrj h PHE 360 N 0.48 0.45 -0.04 1.25 3.57 -1.30 -0.01 116.94 121.34 2qrj h PHE 360 Ca 0.13 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.66 2qrj h PHE 360 Cb 0.24 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 38.83 2qrj h PHE 360 CO 0.01 0.24 -0.05 -0.44 -2.23 0.00 0.00 178.31 175.84 2qrj h ASP 361 N 0.49 -0.15 -0.77 0.41 3.32 -0.61 0.45 116.42 119.55 2qrj h ASP 361 Ca 0.19 0.03 0.10 0.00 0.02 0.00 0.00 57.03 57.37 2qrj h ASP 361 Cb 0.07 0.07 -0.07 0.00 0.22 0.00 0.00 39.33 39.63 2qrj h ASP 361 CO -0.12 -0.07 0.42 -0.09 -1.72 0.00 0.00 179.24 177.66 2qrj h ARG 362 N -0.07 0.68 0.06 3.56 2.43 0.76 -1.95 114.38 119.85 2qrj h ARG 362 Ca 0.04 -0.04 -0.26 0.00 -0.81 0.00 0.00 59.98 58.91 2qrj h ARG 362 Cb 0.12 -0.15 0.01 0.00 -0.42 0.00 0.00 29.97 29.53 2qrj h ARG 362 CO -0.08 0.45 -1.09 0.45 -1.51 0.00 0.00 179.97 178.19 2qrj h HIS 363 N 0.70 0.68 -0.23 2.20 3.86 -0.86 -3.21 115.15 118.30 2qrj h HIS 363 Ca 0.38 -0.42 -0.01 0.00 -1.16 0.00 0.00 60.37 59.17 2qrj h HIS 363 Cb 0.38 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 28.77 2qrj h HIS 363 CO -0.08 1.26 0.11 0.00 0.86 0.00 0.00 177.93 180.08 2qrj h ALA 365 N 1.80 1.45 0.00 0.00 0.00 -1.36 -2.86 119.26 118.29 2qrj h ALA 365 Ca 0.08 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2qrj h ALA 365 Cb 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2qrj h ALA 365 CO -0.01 0.28 0.00 0.54 0.00 0.00 0.00 179.25 180.06 2qrj n ARG 366 N -4.02 0.48 0.00 0.00 1.74 -0.37 -5.13 116.66 109.37 2qrj n ARG 366 Ca -0.02 0.03 0.14 0.00 -0.77 0.00 0.00 57.85 57.23 2qrj n ARG 366 Cb 0.30 -1.50 0.48 0.00 -1.02 0.00 0.00 32.46 30.72 2qrj n ARG 366 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39