#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s9g s ILE 2 N 0.00 -0.45 -0.12 4.25 1.01 -1.23 -4.26 121.20 120.40 1s9g s ILE 2 Ca 0.00 0.16 0.11 0.00 0.00 0.00 0.00 60.65 60.91 1s9g s ILE 2 Cb 0.00 -0.55 -0.24 0.00 0.01 0.00 0.00 42.46 41.68 1s9g s ILE 2 CO 0.00 0.03 0.35 -1.20 0.00 0.00 0.00 174.94 174.11 1s9g n SER 3 N 5.35 0.86 0.29 3.58 7.64 -1.26 -3.98 113.62 126.10 1s9g n SER 3 Ca -0.06 0.20 0.17 0.00 1.01 0.00 0.00 58.87 60.19 1s9g n SER 3 Cb 0.50 0.14 0.86 0.00 -1.01 0.00 0.00 64.21 64.69 1s9g n SER 3 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1s9g h PRO 4 N 0.01 0.00 -6.57 1.43 0.13 -1.99 -3.41 132.00 121.59 1s9g h PRO 4 Ca -0.42 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.19 1s9g h PRO 4 Cb 2.08 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 33.20 1s9g h PRO 4 CO 0.05 0.05 0.40 0.42 -0.23 0.00 0.00 178.00 178.69 1s9g s ILE 5 N -4.03 4.35 -0.12 -3.56 1.01 -1.26 -4.99 121.20 112.61 1s9g s ILE 5 Ca -0.02 1.93 -0.26 0.00 0.00 0.00 0.00 60.65 62.30 1s9g s ILE 5 Cb 0.12 -4.23 -0.02 0.00 0.01 0.00 0.00 42.46 38.34 1s9g s ILE 5 CO 0.52 0.28 0.83 -0.70 0.00 0.00 0.00 174.94 175.88 1s9g s GLU 6 N 0.06 4.36 0.37 2.79 2.12 -1.26 -4.86 118.70 122.28 1s9g s GLU 6 Ca 0.49 1.05 -0.22 0.00 0.36 0.00 0.00 54.97 56.65 1s9g s GLU 6 Cb -0.25 -3.53 -0.10 0.00 0.26 0.00 0.00 34.13 30.51 1s9g s GLU 6 CO 0.31 -0.21 0.92 0.95 -0.54 0.00 0.00 175.26 176.68 1s9g s THR 7 N 1.72 4.36 -0.40 -1.70 -4.23 -1.26 -4.94 115.64 109.20 1s9g s THR 7 Ca 0.40 1.55 -0.20 0.00 -1.18 0.00 0.00 61.69 62.26 1s9g s THR 7 Cb -0.17 -3.77 0.01 0.00 1.34 0.00 0.00 72.50 69.91 1s9g s THR 7 CO 0.16 -0.11 0.64 -0.69 -0.54 0.00 0.00 174.62 174.07 1s9g s VAL 8 N -1.92 4.86 -0.12 2.29 1.01 -1.26 -4.93 120.40 120.34 1s9g s VAL 8 Ca 0.56 0.35 -0.36 0.00 0.00 0.00 0.00 61.98 62.52 1s9g s VAL 8 Cb -0.13 -4.14 -0.13 0.00 0.00 0.00 0.00 36.38 31.98 1s9g s VAL 8 CO 0.18 -0.45 1.78 -0.81 0.00 0.00 0.00 175.10 175.80 1s9g n PRO 9 N 6.15 1.79 -4.15 2.72 -0.04 -1.26 -4.46 135.00 135.74 1s9g n PRO 9 Ca -0.02 0.66 -0.22 0.00 -0.04 0.00 0.00 63.50 63.88 1s9g n PRO 9 Cb 0.48 -2.43 -0.06 0.00 -0.04 0.00 0.00 33.50 31.45 1s9g n PRO 9 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1s9g s VAL 10 N 3.45 3.68 0.06 0.52 1.01 -1.26 -5.08 120.40 122.77 1s9g s VAL 10 Ca 0.93 -1.66 -0.08 0.00 0.00 0.00 0.00 61.98 61.17 1s9g s VAL 10 Cb -0.83 -3.08 -0.00 0.00 0.00 0.00 0.00 36.38 32.47 1s9g s VAL 10 CO 0.55 -0.31 0.17 -0.54 0.00 0.00 0.00 175.10 174.97 1s9g s LYS 11 N -3.79 0.72 -0.02 2.72 1.02 -1.26 -4.74 119.74 114.40 1s9g s LYS 11 Ca 0.34 -0.78 -0.15 0.00 0.02 0.00 0.00 55.97 55.41 1s9g s LYS 11 Cb -0.06 0.29 -0.05 0.00 -0.52 0.00 0.00 37.83 37.49 1s9g s LYS 11 CO 0.23 -0.21 0.40 -0.51 -0.92 0.00 0.00 175.35 174.33 1s9g s LEU 12 N -2.38 4.45 0.12 3.17 1.43 -1.26 -0.77 118.68 123.44 1s9g s LEU 12 Ca -0.01 0.92 -0.27 0.00 -1.03 0.00 0.00 54.13 53.74 1s9g s LEU 12 Cb 0.01 -2.56 -0.15 0.00 0.03 0.00 0.00 46.19 43.51 1s9g s LEU 12 CO -0.07 0.30 0.59 0.29 0.23 0.00 0.00 176.35 177.70 1s9g n LYS 13 N 1.99 0.00 0.00 1.70 5.02 -0.46 -4.72 118.16 121.69 1s9g n LYS 13 Ca -0.14 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.15 1s9g n LYS 13 Cb 0.52 -0.99 0.00 0.00 -0.02 0.00 0.00 35.03 34.55 1s9g n LYS 13 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1s9g n PRO 14 N 0.99 0.00 -0.69 1.97 -0.04 -1.26 -1.26 135.00 134.70 1s9g n PRO 14 Ca 0.16 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.66 1s9g n PRO 14 Cb 0.17 0.00 0.29 0.00 -0.04 0.00 0.00 33.50 33.92 1s9g n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1s9g n GLY 15 N -0.37 3.89 3.99 0.55 0.00 -1.26 -5.01 105.19 106.98 1s9g n GLY 15 Ca 0.00 -1.04 -0.20 0.00 0.00 0.00 0.00 46.02 44.78 1s9g n GLY 15 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1s9g s MET 16 N -2.91 2.55 0.44 1.61 -1.94 -0.39 -5.13 119.30 113.53 1s9g s MET 16 Ca 0.48 -1.01 0.03 0.00 -1.71 0.00 0.00 55.69 53.47 1s9g s MET 16 Cb 0.38 -2.58 -0.02 0.00 2.01 0.00 0.00 34.83 34.63 1s9g s MET 16 CO 0.10 -0.63 0.09 0.34 -0.01 0.00 0.00 175.02 174.91 1s9g s ASP 17 N -4.44 3.20 0.44 3.03 2.15 -1.26 -4.85 116.67 114.93 1s9g s ASP 17 Ca 0.58 -1.66 -0.24 0.00 0.43 0.00 0.00 52.55 51.65 1s9g s ASP 17 Cb -0.10 0.50 -0.08 0.00 -0.30 0.00 0.00 42.92 42.94 1s9g s ASP 17 CO 0.37 -0.90 1.18 -0.83 -0.17 0.00 0.00 175.17 174.82 1s9g s GLY 18 N -3.69 2.83 0.45 2.66 0.00 -1.26 -4.96 107.32 103.34 1s9g s GLY 18 Ca 0.19 0.98 -0.24 0.00 0.00 0.00 0.00 44.72 45.65 1s9g s GLY 18 CO 0.11 1.47 1.09 -1.55 0.00 0.00 0.00 173.10 174.22 1s9g n PRO 19 N -0.25 1.46 -3.46 2.90 -0.04 -1.26 -4.82 135.00 129.53 1s9g n PRO 19 Ca 0.06 0.53 -0.25 0.00 -0.04 0.00 0.00 63.50 63.80 1s9g n PRO 19 Cb 0.47 -2.17 -0.12 0.00 -0.04 0.00 0.00 33.50 31.64 1s9g n PRO 19 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1s9g s LYS 20 N -2.20 0.41 -0.32 0.54 1.02 -1.23 -1.49 119.74 116.47 1s9g s LYS 20 Ca 0.65 -0.79 -0.02 0.00 0.02 0.00 0.00 55.97 55.82 1s9g s LYS 20 Cb -0.52 -1.05 0.11 0.00 -0.52 0.00 0.00 37.83 35.86 1s9g s LYS 20 CO 0.56 -1.12 0.15 0.08 -0.92 0.00 0.00 175.35 174.10 1s9g s VAL 21 N 1.68 0.32 0.48 3.17 1.01 -0.92 -4.90 120.40 121.24 1s9g s VAL 21 Ca 0.13 -1.28 -0.22 0.00 0.00 0.00 0.00 61.98 60.62 1s9g s VAL 21 Cb -0.18 -1.25 -0.09 0.00 0.00 0.00 0.00 36.38 34.85 1s9g s VAL 21 CO -0.18 -0.79 0.88 0.29 0.00 0.00 0.00 175.10 175.31 1s9g n LYS 22 N 4.73 1.06 -2.92 2.72 4.76 -1.26 -4.01 118.16 123.24 1s9g n LYS 22 Ca 0.00 0.39 -0.40 0.00 -2.87 0.00 0.00 58.31 55.43 1s9g n LYS 22 Cb 0.40 -1.96 -0.05 0.00 -1.84 0.00 0.00 35.03 31.58 1s9g n LYS 22 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 1s9g s GLN 23 N -2.12 4.56 0.49 1.97 2.00 -1.26 -4.85 119.66 120.45 1s9g s GLN 23 Ca 0.66 1.18 -0.16 0.00 -2.00 0.00 0.00 55.36 55.04 1s9g s GLN 23 Cb -0.52 -3.36 -0.08 0.00 0.80 0.00 0.00 33.01 29.85 1s9g s GLN 23 CO 0.55 0.29 0.95 -1.58 -0.50 0.00 0.00 175.29 175.00 1s9g s TRP 24 N -0.14 3.44 0.46 1.67 0.51 -1.26 -5.02 118.94 118.60 1s9g s TRP 24 Ca 0.40 1.43 -0.21 0.00 -2.12 0.00 0.00 56.10 55.61 1s9g s TRP 24 Cb -0.21 -2.75 -0.10 0.00 -0.81 0.00 0.00 33.47 29.60 1s9g s TRP 24 CO 0.25 -0.31 1.00 -1.25 -0.51 0.00 0.00 176.95 176.13 1s9g s PRO 25 N -3.95 4.00 0.44 4.98 0.04 -1.26 -4.94 135.00 134.30 1s9g s PRO 25 Ca 0.58 1.25 0.05 0.00 0.04 0.00 0.00 61.00 62.92 1s9g s PRO 25 Cb -0.10 -2.14 -0.05 0.00 0.04 0.00 0.00 34.50 32.25 1s9g s PRO 25 CO 0.29 -0.25 0.02 -0.51 0.04 0.00 0.00 177.00 176.59 1s9g s LEU 26 N -3.34 2.58 0.37 -3.56 1.43 -1.26 -5.11 118.68 109.78 1s9g s LEU 26 Ca 0.65 -1.48 -0.27 0.00 -1.03 0.00 0.00 54.13 51.99 1s9g s LEU 26 Cb -0.13 -0.76 -0.10 0.00 0.03 0.00 0.00 46.19 45.23 1s9g s LEU 26 CO 0.17 -0.62 1.33 0.42 0.23 0.00 0.00 176.35 177.88 1s9g s THR 27 N -2.84 2.57 0.55 5.49 -4.23 -1.26 -4.86 115.64 111.06 1s9g s THR 27 Ca 0.25 0.55 0.26 0.00 -1.18 0.00 0.00 61.69 61.56 1s9g s THR 27 Cb 0.07 -3.34 0.38 0.00 1.34 0.00 0.00 72.50 70.95 1s9g s THR 27 CO 0.13 0.11 2.02 1.05 -0.54 0.00 0.00 174.62 177.38 1s9g h GLU 28 N 3.02 0.00 -0.61 3.99 4.11 -2.00 -0.26 114.58 122.82 1s9g h GLU 28 Ca -0.49 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 58.92 1s9g h GLU 28 Cb 1.24 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.46 1s9g h GLU 28 CO 0.64 0.00 0.32 1.49 0.07 0.00 0.00 179.01 181.53 1s9g h GLU 29 N 0.00 0.86 -0.43 1.06 4.57 -2.01 -3.01 114.58 115.61 1s9g h GLU 29 Ca 0.20 -0.11 -0.13 0.00 -1.18 0.00 0.00 59.36 58.14 1s9g h GLU 29 Cb 0.85 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 29.27 1s9g h GLU 29 CO -0.00 0.67 -0.25 0.87 -1.18 0.00 0.00 179.01 179.12 1s9g h LYS 30 N 0.83 0.90 -0.55 1.92 1.57 -1.41 -1.78 116.57 118.03 1s9g h LYS 30 Ca 0.21 -0.39 0.11 0.00 -1.87 0.00 0.00 60.65 58.71 1s9g h LYS 30 Cb 0.07 -0.03 -0.11 0.00 0.08 0.00 0.00 32.23 32.24 1s9g h LYS 30 CO -0.03 1.04 -0.22 0.97 -0.57 0.00 0.00 179.45 180.64 1s9g h ILE 31 N 0.77 0.32 0.00 1.86 6.09 -1.34 0.87 117.51 126.07 1s9g h ILE 31 Ca 0.10 0.00 -0.18 0.00 -1.37 0.00 0.00 64.86 63.40 1s9g h ILE 31 Cb 0.80 0.32 -0.03 0.00 0.47 0.00 0.00 36.82 38.38 1s9g h ILE 31 CO 0.07 0.00 -0.88 0.50 -3.07 0.00 0.00 178.15 174.77 1s9g h LYS 32 N -0.09 0.00 -0.91 2.19 3.64 -1.61 0.12 116.57 119.91 1s9g h LYS 32 Ca 0.25 0.00 0.07 0.00 -1.27 0.00 0.00 60.65 59.70 1s9g h LYS 32 Cb 0.49 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.25 1s9g h LYS 32 CO -0.61 0.88 0.59 0.00 -2.27 0.00 0.00 179.45 178.04 1s9g h ALA 33 N 1.12 1.51 0.18 5.00 0.00 0.26 0.39 119.26 127.72 1s9g h ALA 33 Ca -0.01 -0.02 -0.25 0.00 0.00 0.00 0.00 54.91 54.63 1s9g h ALA 33 Cb 1.57 -0.27 0.02 0.00 0.00 0.00 0.00 17.79 19.11 1s9g h ALA 33 CO 0.11 0.35 -1.12 -0.07 0.00 0.00 0.00 179.25 178.53 1s9g h LEU 34 N 1.04 0.59 -2.03 0.00 3.38 0.79 -3.05 115.31 116.03 1s9g h LEU 34 Ca 0.39 -0.93 0.12 0.00 0.09 0.00 0.00 57.88 57.56 1s9g h LEU 34 Cb 0.20 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1s9g h LEU 34 CO -0.15 1.53 0.38 0.58 0.09 0.00 0.00 178.44 180.88 1s9g h VAL 35 N -0.18 0.53 0.00 1.22 2.07 0.13 1.68 116.25 121.70 1s9g h VAL 35 Ca -0.20 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 1s9g h VAL 35 Cb 1.85 0.71 0.00 0.00 -1.52 0.00 0.00 31.29 32.33 1s9g h VAL 35 CO 0.19 0.00 -0.02 -0.33 0.02 0.00 0.00 177.57 177.42 1s9g h GLU 36 N 0.00 0.01 0.00 1.57 5.08 -0.30 -1.96 114.58 118.98 1s9g h GLU 36 Ca 0.20 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.53 1s9g h GLU 36 Cb 0.97 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.22 1s9g h GLU 36 CO -0.00 0.94 -0.09 0.82 -1.00 0.00 0.00 179.01 179.67 1s9g h ILE 37 N -0.90 1.03 0.15 3.13 1.08 -0.78 -2.71 117.51 118.51 1s9g h ILE 37 Ca -0.00 -0.32 -0.29 0.00 -0.39 0.00 0.00 64.86 63.86 1s9g h ILE 37 Cb 0.95 1.17 0.01 0.00 -3.07 0.00 0.00 36.82 35.88 1s9g h ILE 37 CO 0.00 0.09 -1.40 0.00 -0.69 0.00 0.00 178.15 176.15 1s9g h THR 39 N -0.16 1.31 0.00 0.00 1.35 -1.33 1.35 112.91 115.43 1s9g h THR 39 Ca -0.28 -1.59 0.00 0.00 -0.55 0.00 0.00 66.41 63.99 1s9g h THR 39 Cb 1.87 1.62 0.00 0.00 -1.73 0.00 0.00 68.15 69.91 1s9g h THR 39 CO 0.13 0.49 0.00 -0.62 -0.25 0.00 0.00 175.52 175.27 1s9g n GLU 40 N -4.02 0.14 -0.10 4.72 -0.58 -1.03 -0.41 120.64 119.37 1s9g n GLU 40 Ca -0.02 0.20 -0.20 0.00 -0.42 0.00 0.00 57.16 56.73 1s9g n GLU 40 Cb 0.52 -1.69 -0.11 0.00 -0.57 0.00 0.00 31.44 29.58 1s9g n GLU 40 CO 0.00 0.00 0.00 1.98 -0.48 0.00 0.00 177.13 178.63 1s9g h MET 41 N 0.00 0.00 -0.17 3.49 4.05 -0.61 -2.93 114.93 118.77 1s9g h MET 41 Ca 0.00 0.00 -0.04 0.00 -0.28 0.00 0.00 59.70 59.38 1s9g h MET 41 Cb 0.53 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.32 1s9g h MET 41 CO 0.00 0.94 -0.07 1.49 0.23 0.00 0.00 176.91 179.50 1s9g h GLU 42 N -1.00 0.26 -0.15 0.39 4.81 0.17 -1.33 114.58 117.72 1s9g h GLU 42 Ca -0.27 -0.05 0.02 0.00 -0.13 0.00 0.00 59.36 58.92 1s9g h GLU 42 Cb 1.21 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.53 1s9g h GLU 42 CO -0.17 0.35 0.04 -0.22 -0.73 0.00 0.00 179.01 178.29 1s9g h LYS 43 N 0.25 0.11 0.00 1.92 3.64 -0.85 0.14 116.57 121.79 1s9g h LYS 43 Ca 0.05 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1s9g h LYS 43 Cb 0.30 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 1s9g h LYS 43 CO 0.01 0.07 0.00 0.39 -2.27 0.00 0.00 179.45 177.66 1s9g n GLU 44 N -5.06 0.60 -0.77 1.90 1.02 -0.56 -4.84 120.64 112.92 1s9g n GLU 44 Ca -0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.10 1s9g n GLU 44 Cb 0.06 -1.32 0.00 0.00 -0.02 0.00 0.00 31.44 30.17 1s9g n GLU 44 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1s9g n GLY 45 N 0.16 0.27 0.32 0.62 0.00 0.49 -4.68 105.19 102.37 1s9g n GLY 45 Ca 0.09 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.09 1s9g n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1s9g h LYS 46 N 0.77 0.90 -5.18 1.61 1.57 -1.69 -3.44 116.57 111.10 1s9g h LYS 46 Ca 0.00 -0.14 -0.55 0.00 -1.87 0.00 0.00 60.65 58.10 1s9g h LYS 46 Cb 0.22 -0.16 -0.13 0.00 0.08 0.00 0.00 32.23 32.23 1s9g h LYS 46 CO 0.00 0.72 -0.56 0.96 -0.57 0.00 0.00 179.45 180.01 1s9g s ILE 47 N -5.44 1.02 -0.15 1.86 -4.36 -1.25 -1.74 121.20 111.15 1s9g s ILE 47 Ca -0.10 -2.00 -0.11 0.00 -0.26 0.00 0.00 60.65 58.17 1s9g s ILE 47 Cb 0.16 -2.54 0.05 0.00 1.25 0.00 0.00 42.46 41.37 1s9g s ILE 47 CO 0.80 0.00 0.38 -0.44 0.24 0.00 0.00 174.94 175.92 1s9g s SER 48 N -3.61 -0.43 0.26 4.36 0.01 0.69 -4.32 113.70 110.66 1s9g s SER 48 Ca 0.27 0.80 -0.30 0.00 1.31 0.00 0.00 55.95 58.02 1s9g s SER 48 Cb 0.05 0.76 -0.13 0.00 0.21 0.00 0.00 66.02 66.91 1s9g s SER 48 CO 0.13 -0.16 1.39 1.17 0.41 0.00 0.00 173.24 176.18 1s9g n LYS 49 N 3.46 2.07 -4.83 12.44 4.81 -1.26 -1.08 118.16 133.77 1s9g n LYS 49 Ca -0.18 0.74 -0.25 0.00 -0.87 0.00 0.00 58.31 57.75 1s9g n LYS 49 Cb 0.56 -2.38 -0.16 0.00 0.02 0.00 0.00 35.03 33.08 1s9g n LYS 49 CO 0.00 0.00 0.00 -1.50 1.17 0.00 0.00 177.40 177.07 1s9g s ILE 50 N -0.29 1.39 0.73 3.15 2.07 0.52 -4.86 121.20 123.93 1s9g s ILE 50 Ca 0.65 -0.73 -0.12 0.00 -1.41 0.00 0.00 60.65 59.05 1s9g s ILE 50 Cb -0.63 -1.18 0.03 0.00 0.13 0.00 0.00 42.46 40.82 1s9g s ILE 50 CO 0.52 0.40 1.11 -0.83 -1.91 0.00 0.00 174.94 174.23 1s9g s GLY 51 N -0.21 1.62 0.78 1.50 0.00 -1.26 -4.69 107.32 105.07 1s9g s GLY 51 Ca 0.02 -0.36 -0.17 0.00 0.00 0.00 0.00 44.72 44.21 1s9g s GLY 51 CO 0.01 0.03 -0.53 -1.05 0.00 0.00 0.00 173.10 171.55 1s9g n PRO 52 N -3.12 0.00 -3.55 2.90 -0.02 -1.26 -4.35 135.00 125.61 1s9g n PRO 52 Ca 0.07 0.00 -0.24 0.00 -2.02 0.00 0.00 63.50 61.31 1s9g n PRO 52 Cb 0.58 -0.96 0.03 0.00 -0.02 0.00 0.00 33.50 33.13 1s9g n PRO 52 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1s9g n GLU 53 N 2.05 -1.37 -3.25 -0.52 -0.58 -1.26 -4.94 120.64 110.77 1s9g n GLU 53 Ca 0.02 0.70 -0.27 0.00 -0.42 0.00 0.00 57.16 57.19 1s9g n GLU 53 Cb 0.51 -4.33 -0.07 0.00 -0.57 0.00 0.00 31.44 26.98 1s9g n GLU 53 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1s9g n ASN 54 N -2.58 3.74 0.07 1.62 5.15 -1.26 -4.94 115.26 117.05 1s9g n ASN 54 Ca -0.10 -3.47 0.00 0.00 -0.60 0.00 0.00 54.58 50.40 1s9g n ASN 54 Cb 0.59 -0.63 0.00 0.00 -0.53 0.00 0.00 39.78 39.21 1s9g n ASN 54 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1s9g n PRO 55 N 0.51 0.01 -3.27 1.20 -0.04 -1.26 -4.38 135.00 127.76 1s9g n PRO 55 Ca 0.30 0.19 -0.38 0.00 -0.04 0.00 0.00 63.50 63.56 1s9g n PRO 55 Cb 0.42 -1.25 -0.06 0.00 -0.04 0.00 0.00 33.50 32.57 1s9g n PRO 55 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1s9g s TYR 56 N -1.69 3.48 0.06 0.54 1.51 -1.26 -4.68 117.35 115.31 1s9g s TYR 56 Ca 0.00 0.89 -0.00 0.00 -1.01 0.00 0.00 57.07 56.95 1s9g s TYR 56 Cb 0.00 -2.61 -0.04 0.00 -0.11 0.00 0.00 41.96 39.20 1s9g s TYR 56 CO 0.00 0.09 -0.04 1.21 -1.11 0.00 0.00 175.55 175.69 1s9g s ASN 57 N 0.78 0.65 0.01 2.29 2.47 -0.55 -4.41 114.94 116.18 1s9g s ASN 57 Ca 0.26 -0.94 -0.02 0.00 0.42 0.00 0.00 52.86 52.58 1s9g s ASN 57 Cb -0.15 0.16 -0.01 0.00 -1.45 0.00 0.00 41.25 39.79 1s9g s ASN 57 CO 0.11 -0.52 0.03 -0.89 -3.72 0.00 0.00 177.10 172.10 1s9g s THR 58 N -3.53 0.10 0.19 -5.21 2.01 0.17 -2.16 115.64 107.21 1s9g s THR 58 Ca 0.06 -0.82 -0.31 0.00 0.31 0.00 0.00 61.69 60.93 1s9g s THR 58 Cb 0.05 -0.31 -0.09 0.00 0.01 0.00 0.00 72.50 72.16 1s9g s THR 58 CO -0.07 -0.45 1.42 -2.84 -0.69 0.00 0.00 174.62 171.99 1s9g s PRO 59 N -1.40 4.30 0.15 4.92 0.02 -1.26 -3.78 135.00 137.96 1s9g s PRO 59 Ca -0.15 2.20 0.07 0.00 0.02 0.00 0.00 61.00 63.13 1s9g s PRO 59 Cb -0.09 -3.17 -0.04 0.00 0.02 0.00 0.00 34.50 31.22 1s9g s PRO 59 CO -0.00 -0.42 0.02 0.08 -0.33 0.00 0.00 177.00 176.35 1s9g s VAL 60 N 0.52 3.87 -0.36 3.83 1.01 -1.26 -2.03 120.40 125.97 1s9g s VAL 60 Ca 0.62 -1.29 0.06 0.00 0.00 0.00 0.00 61.98 61.37 1s9g s VAL 60 Cb -0.40 -2.93 0.18 0.00 0.00 0.00 0.00 36.38 33.24 1s9g s VAL 60 CO 0.36 -0.06 0.57 -0.36 0.00 0.00 0.00 175.10 175.61 1s9g s PHE 61 N -1.64 -1.52 0.19 5.22 0.40 0.06 -4.94 117.98 115.74 1s9g s PHE 61 Ca 0.27 0.35 -0.32 0.00 -0.60 0.00 0.00 56.93 56.63 1s9g s PHE 61 Cb -0.10 0.18 -0.15 0.00 0.51 0.00 0.00 43.02 43.46 1s9g s PHE 61 CO 0.19 -1.11 1.17 0.00 0.70 0.00 0.00 175.22 176.17 1s9g n ALA 62 N 4.75 -0.59 -2.71 5.36 0.00 -1.26 -3.74 120.51 122.32 1s9g n ALA 62 Ca 0.08 0.45 -0.26 0.00 0.00 0.00 0.00 53.44 53.72 1s9g n ALA 62 Cb 0.54 -2.05 -0.16 0.00 0.00 0.00 0.00 19.45 17.79 1s9g n ALA 62 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1s9g s ILE 63 N -0.24 1.42 0.09 0.00 1.01 -0.47 -4.95 121.20 118.06 1s9g s ILE 63 Ca 0.72 -0.74 -0.21 0.00 0.00 0.00 0.00 60.65 60.42 1s9g s ILE 63 Cb -0.83 -1.20 -0.07 0.00 0.01 0.00 0.00 42.46 40.38 1s9g s ILE 63 CO 0.52 0.41 0.62 -0.75 0.00 0.00 0.00 174.94 175.74 1s9g s LYS 64 N -0.18 4.29 0.45 2.79 2.47 -1.26 -2.28 119.74 126.02 1s9g s LYS 64 Ca 0.01 0.83 0.31 0.00 -1.56 0.00 0.00 55.97 55.56 1s9g s LYS 64 Cb -0.09 -3.25 1.46 0.00 -1.46 0.00 0.00 37.83 34.49 1s9g s LYS 64 CO 0.01 0.60 1.93 -0.22 0.16 0.00 0.00 175.35 177.83 1s9g h LYS 65 N 4.58 0.00 0.00 4.03 1.63 -1.96 -3.45 116.57 121.40 1s9g h LYS 65 Ca -0.49 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.31 1s9g h LYS 65 Cb 1.21 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.84 1s9g h LYS 65 CO 0.64 0.00 0.00 1.63 -3.45 0.00 0.00 179.45 178.27 1s9g n LYS 66 N -2.67 -0.01 -0.00 1.90 5.02 -1.26 -4.63 118.16 116.51 1s9g n LYS 66 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1s9g n LYS 66 Cb 0.17 -2.85 -0.00 0.00 -0.02 0.00 0.00 35.03 32.33 1s9g n LYS 66 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1s9g n ASP 67 N -0.00 0.21 -4.00 4.39 2.03 -1.26 -5.05 116.55 112.87 1s9g n ASP 67 Ca 0.00 -0.50 -0.35 0.00 0.52 0.00 0.00 54.79 54.46 1s9g n ASP 67 Cb 0.00 1.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.41 1s9g n ASP 67 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1s9g n SER 68 N -1.04 -2.57 -0.01 1.67 2.88 -1.26 -4.84 113.62 108.46 1s9g n SER 68 Ca 0.00 -1.01 0.02 0.00 -1.33 0.00 0.00 58.87 56.56 1s9g n SER 68 Cb 0.01 -1.21 -0.12 0.00 -0.75 0.00 0.00 64.21 62.14 1s9g n SER 68 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1s9g n THR 69 N -4.08 0.79 -3.85 2.46 -1.04 -1.26 -5.01 114.28 102.29 1s9g n THR 69 Ca -0.11 -0.66 -0.01 0.00 -2.04 0.00 0.00 64.05 61.23 1s9g n THR 69 Cb 0.44 -0.38 0.01 0.00 -1.82 0.00 0.00 70.33 68.58 1s9g n THR 69 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 1s9g s LYS 70 N -3.06 0.99 0.32 -2.82 0.00 -1.26 -5.19 119.74 108.72 1s9g s LYS 70 Ca -0.06 -0.62 0.07 0.00 0.00 0.00 0.00 55.97 55.37 1s9g s LYS 70 Cb 0.10 0.29 -0.03 0.00 0.00 0.00 0.00 37.83 38.19 1s9g s LYS 70 CO 0.85 -0.46 0.27 -1.58 0.00 0.00 0.00 175.35 174.42 1s9g s TRP 71 N -2.33 2.93 -0.02 1.78 0.51 -1.26 -4.34 118.94 116.20 1s9g s TRP 71 Ca 0.21 -0.27 0.03 0.00 -2.12 0.00 0.00 56.10 53.95 1s9g s TRP 71 Cb -0.01 -1.72 -0.00 0.00 -0.81 0.00 0.00 33.47 30.93 1s9g s TRP 71 CO 0.02 0.25 -0.10 0.50 -0.51 0.00 0.00 176.95 177.12 1s9g s ARG 72 N -3.96 0.92 0.14 4.98 3.52 -0.97 -5.01 118.95 118.57 1s9g s ARG 72 Ca 0.39 -0.34 -0.25 0.00 -0.13 0.00 0.00 55.73 55.40 1s9g s ARG 72 Cb -0.06 -0.87 -0.07 0.00 -1.56 0.00 0.00 34.95 32.38 1s9g s ARG 72 CO 0.26 0.17 0.75 0.21 -0.81 0.00 0.00 175.30 175.88 1s9g s LYS 73 N -0.02 4.52 -0.08 5.12 2.20 -1.26 -1.37 119.74 128.85 1s9g s LYS 73 Ca 0.00 1.10 -0.03 0.00 -0.36 0.00 0.00 55.97 56.68 1s9g s LYS 73 Cb -0.06 -3.28 0.04 0.00 -1.51 0.00 0.00 37.83 33.02 1s9g s LYS 73 CO 0.00 0.53 0.16 -1.17 -0.36 0.00 0.00 175.35 174.51 1s9g s LEU 74 N -0.96 0.30 0.09 5.43 2.96 -1.25 -4.93 118.68 120.33 1s9g s LEU 74 Ca 0.36 0.34 0.03 0.00 -0.22 0.00 0.00 54.13 54.64 1s9g s LEU 74 Cb -0.22 0.36 -0.04 0.00 0.50 0.00 0.00 46.19 46.79 1s9g s LEU 74 CO 0.25 -0.20 0.09 -0.69 -1.32 0.00 0.00 176.35 174.48 1s9g s VAL 75 N 1.74 4.55 -0.76 1.68 1.01 -1.26 -0.76 120.40 126.59 1s9g s VAL 75 Ca -0.03 -0.79 -0.04 0.00 0.00 0.00 0.00 61.98 61.12 1s9g s VAL 75 Cb -0.12 -3.21 0.19 0.00 0.00 0.00 0.00 36.38 33.25 1s9g s VAL 75 CO -0.06 0.10 0.62 -0.62 0.00 0.00 0.00 175.10 175.14 1s9g s ASP 76 N -2.47 5.71 0.00 3.32 2.15 -0.86 -4.92 116.67 119.60 1s9g s ASP 76 Ca 0.30 -3.21 0.20 0.00 0.43 0.00 0.00 52.55 50.27 1s9g s ASP 76 Cb -0.12 -1.91 1.07 0.00 -0.30 0.00 0.00 42.92 41.66 1s9g s ASP 76 CO 0.22 -0.31 1.70 0.49 -0.17 0.00 0.00 175.17 177.11 1s9g n PHE 77 N 3.04 0.04 -0.29 -5.34 0.99 -1.26 -4.39 117.46 110.25 1s9g n PHE 77 Ca 0.14 -0.02 0.07 0.00 -0.00 0.00 0.00 57.45 57.64 1s9g n PHE 77 Cb 0.38 0.00 0.15 0.00 -1.00 0.00 0.00 39.48 39.02 1s9g n PHE 77 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 1s9g n ARG 78 N -0.57 -0.07 0.09 -1.08 1.74 -1.26 0.37 116.66 115.89 1s9g n ARG 78 Ca 0.15 1.28 -0.03 0.00 -0.77 0.00 0.00 57.85 58.47 1s9g n ARG 78 Cb 0.12 -1.94 0.18 0.00 -1.02 0.00 0.00 32.46 29.80 1s9g n ARG 78 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 1s9g h GLU 79 N 0.00 0.22 0.14 5.56 4.57 -1.99 -1.42 114.58 121.66 1s9g h GLU 79 Ca 0.43 -0.12 -0.01 0.00 -1.18 0.00 0.00 59.36 58.48 1s9g h GLU 79 Cb 0.73 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.33 1s9g h GLU 79 CO -0.83 0.68 -0.07 1.25 -1.18 0.00 0.00 179.01 178.86 1s9g h LEU 80 N 0.17 -0.16 -0.68 1.64 5.85 -0.40 -3.07 115.31 118.67 1s9g h LEU 80 Ca 0.01 -0.36 0.13 0.00 0.84 0.00 0.00 57.88 58.50 1s9g h LEU 80 Cb 0.95 0.04 -0.13 0.00 0.37 0.00 0.00 40.66 41.90 1s9g h LEU 80 CO 0.08 0.32 -0.25 0.78 -0.34 0.00 0.00 178.44 179.03 1s9g h ASN 81 N -0.68 -0.90 0.05 1.25 4.21 -0.79 1.01 115.58 119.73 1s9g h ASN 81 Ca -0.02 0.22 0.00 0.00 1.21 0.00 0.00 56.30 57.72 1s9g h ASN 81 Cb 0.50 0.51 0.00 0.00 -1.12 0.00 0.00 38.32 38.21 1s9g h ASN 81 CO 0.03 -0.27 0.00 1.17 -1.29 0.00 0.00 177.43 177.07 1s9g n LYS 82 N -5.46 0.01 0.00 0.81 3.00 -0.54 -2.33 118.16 113.64 1s9g n LYS 82 Ca 0.07 0.39 0.00 0.00 -0.00 0.00 0.00 58.31 58.78 1s9g n LYS 82 Cb 0.37 -1.50 -0.00 0.00 0.00 0.00 0.00 35.03 33.89 1s9g n LYS 82 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 1s9g n ARG 83 N -1.41 4.12 -3.63 1.64 1.74 0.33 -4.98 116.66 114.47 1s9g n ARG 83 Ca 0.01 -0.19 -0.33 0.00 -0.77 0.00 0.00 57.85 56.57 1s9g n ARG 83 Cb 0.02 -0.69 -0.05 0.00 -1.02 0.00 0.00 32.46 30.72 1s9g n ARG 83 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1s9g s THR 84 N -0.69 5.14 1.02 0.55 -4.23 -0.21 -1.36 115.64 115.86 1s9g s THR 84 Ca 0.00 0.20 -0.13 0.00 -1.18 0.00 0.00 61.69 60.58 1s9g s THR 84 Cb 0.00 -3.63 0.14 0.00 1.34 0.00 0.00 72.50 70.36 1s9g s THR 84 CO 0.01 0.13 0.70 0.00 -0.54 0.00 0.00 174.62 174.92 1s9g n GLN 85 N 0.38 -1.03 -1.98 3.99 10.64 0.05 -4.56 117.38 124.87 1s9g n GLN 85 Ca -0.04 -0.26 -0.32 0.00 -1.83 0.00 0.00 57.00 54.55 1s9g n GLN 85 Cb 0.52 -2.06 0.01 0.00 -0.86 0.00 0.00 30.24 27.84 1s9g n GLN 85 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1s9g s ASP 86 N -2.26 6.11 0.43 2.61 1.01 -1.26 -4.86 116.67 118.45 1s9g s ASP 86 Ca 0.62 1.55 0.03 0.00 0.71 0.00 0.00 52.55 55.47 1s9g s ASP 86 Cb -0.21 -2.49 -0.03 0.00 1.01 0.00 0.00 42.92 41.20 1s9g s ASP 86 CO 0.64 -0.94 0.08 -0.36 0.21 0.00 0.00 175.17 174.79 1s9g s PHE 87 N -2.91 1.87 -0.47 4.23 0.40 -1.26 -5.07 117.98 114.78 1s9g s PHE 87 Ca 0.58 -1.11 -0.28 0.00 -0.60 0.00 0.00 56.93 55.51 1s9g s PHE 87 Cb -0.12 -1.33 0.01 0.00 0.51 0.00 0.00 43.02 42.08 1s9g s PHE 87 CO 0.46 -0.07 1.50 -0.46 0.70 0.00 0.00 175.22 177.34 1s9g s TRP 88 N -3.10 2.23 -0.41 0.36 -0.00 -1.26 -4.89 118.94 111.87 1s9g s TRP 88 Ca 0.21 0.61 -0.43 0.00 -0.00 0.00 0.00 56.10 56.49 1s9g s TRP 88 Cb 0.04 -4.30 -0.18 0.00 -0.00 0.00 0.00 33.47 29.03 1s9g s TRP 88 CO 0.12 -2.13 1.74 0.39 -0.00 0.00 0.00 176.95 177.06 1s9g n GLU 89 N 8.40 0.51 -3.04 5.86 1.02 -1.26 -4.90 120.64 127.23 1s9g n GLU 89 Ca 0.16 0.18 -0.21 0.00 -0.02 0.00 0.00 57.16 57.28 1s9g n GLU 89 Cb 0.49 -1.79 0.01 0.00 -0.02 0.00 0.00 31.44 30.13 1s9g n GLU 89 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1s9g s VAL 90 N 3.71 3.61 -0.70 2.62 -7.23 -1.26 -4.36 120.40 116.79 1s9g s VAL 90 Ca 1.04 -0.72 0.00 0.00 -1.81 0.00 0.00 61.98 60.49 1s9g s VAL 90 Cb -1.30 -3.30 0.00 0.00 0.56 0.00 0.00 36.38 32.34 1s9g s VAL 90 CO 0.73 -0.18 0.00 1.67 -0.31 0.00 0.00 175.10 177.01 1s9g n GLN 91 N -2.00 -1.22 0.32 4.82 7.27 -1.26 -4.75 117.38 120.57 1s9g n GLN 91 Ca 0.03 0.40 0.19 0.00 0.07 0.00 0.00 57.00 57.70 1s9g n GLN 91 Cb 0.58 -4.46 1.02 0.00 2.41 0.00 0.00 30.24 29.79 1s9g n GLN 91 CO 0.00 0.00 0.00 -0.07 0.07 0.00 0.00 177.06 177.06 1s9g h LEU 92 N 0.00 0.00 -8.04 1.69 3.38 -1.98 -3.37 115.31 106.98 1s9g h LEU 92 Ca -0.14 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.47 1s9g h LEU 92 Cb 0.46 0.00 -0.27 0.00 0.09 0.00 0.00 40.66 40.93 1s9g h LEU 92 CO 0.20 0.00 -0.77 -0.83 0.09 0.00 0.00 178.44 177.13 1s9g s GLY 93 N -3.98 0.44 0.02 0.83 0.00 -1.26 -5.15 107.32 98.21 1s9g s GLY 93 Ca -0.04 -0.43 0.08 0.00 0.00 0.00 0.00 44.72 44.33 1s9g s GLY 93 CO 0.37 -0.39 -0.25 -1.50 0.00 0.00 0.00 173.10 171.34 1s9g s ILE 94 N -0.37 2.22 0.51 0.90 2.07 -1.26 -5.12 121.20 120.15 1s9g s ILE 94 Ca 0.02 -1.23 -0.23 0.00 -1.41 0.00 0.00 60.65 57.80 1s9g s ILE 94 Cb -0.04 -1.84 -0.06 0.00 0.13 0.00 0.00 42.46 40.65 1s9g s ILE 94 CO -0.00 0.45 1.32 -2.16 -1.91 0.00 0.00 174.94 172.64 1s9g s PRO 95 N -1.00 3.38 -0.15 3.50 0.04 -1.26 -5.00 135.00 134.50 1s9g s PRO 95 Ca 0.11 2.14 -0.08 0.00 0.04 0.00 0.00 61.00 63.22 1s9g s PRO 95 Cb -0.10 -2.36 -0.04 0.00 0.04 0.00 0.00 34.50 32.04 1s9g s PRO 95 CO 0.01 -0.97 0.13 -1.58 0.04 0.00 0.00 177.00 174.63 1s9g s HIS 96 N -1.34 3.50 0.34 0.56 2.46 -1.26 -4.98 115.29 114.56 1s9g s HIS 96 Ca 0.68 0.42 0.09 0.00 0.47 0.00 0.00 55.06 56.72 1s9g s HIS 96 Cb -0.38 -2.03 0.82 0.00 -0.13 0.00 0.00 32.58 30.86 1s9g s HIS 96 CO 0.46 0.53 1.83 -1.35 -2.47 0.00 0.00 174.74 173.73 1s9g h PRO 97 N 5.73 0.67 0.00 2.88 0.11 -1.97 -0.49 132.00 138.94 1s9g h PRO 97 Ca -0.49 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.58 1s9g h PRO 97 Cb 1.19 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1s9g h PRO 97 CO 0.66 0.44 0.00 0.00 -0.21 0.00 0.00 178.00 178.89 1s9g n ALA 98 N -2.40 1.04 0.72 -0.75 0.00 -1.26 -1.61 120.51 116.25 1s9g n ALA 98 Ca 0.20 0.03 0.08 0.00 0.00 0.00 0.00 53.44 53.75 1s9g n ALA 98 Cb 0.55 -1.06 -0.05 0.00 0.00 0.00 0.00 19.45 18.89 1s9g n ALA 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s9g n GLY 99 N -1.39 -0.25 3.77 0.00 0.00 -0.19 -4.27 105.19 102.85 1s9g n GLY 99 Ca -0.00 -0.45 -0.40 0.00 0.00 0.00 0.00 46.02 45.17 1s9g n GLY 99 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1s9g s LEU 100 N -2.39 4.43 0.03 0.99 1.43 -0.63 -4.76 118.68 117.77 1s9g s LEU 100 Ca 0.09 2.46 -0.25 0.00 -1.03 0.00 0.00 54.13 55.41 1s9g s LEU 100 Cb 0.12 -3.72 -0.05 0.00 0.03 0.00 0.00 46.19 42.58 1s9g s LEU 100 CO 0.52 -0.41 0.75 -0.75 0.23 0.00 0.00 176.35 176.70 1s9g s LYS 101 N -1.76 4.48 -0.29 1.70 2.20 -1.26 -0.96 119.74 123.85 1s9g s LYS 101 Ca 0.49 1.03 -0.43 0.00 -0.36 0.00 0.00 55.97 56.70 1s9g s LYS 101 Cb -0.35 -3.38 -0.18 0.00 -1.51 0.00 0.00 37.83 32.41 1s9g s LYS 101 CO 0.45 0.25 1.52 1.63 -0.36 0.00 0.00 175.35 178.84 1s9g n LYS 102 N 2.96 0.43 -4.20 4.03 5.02 -0.23 -4.81 118.16 121.36 1s9g n LYS 102 Ca -0.02 0.16 -0.12 0.00 -2.02 0.00 0.00 58.31 56.31 1s9g n LYS 102 Cb 0.50 -1.72 -0.10 0.00 -0.02 0.00 0.00 35.03 33.69 1s9g n LYS 102 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1s9g s LYS 103 N 2.36 0.99 0.00 1.97 -0.14 -1.26 -5.01 119.74 118.65 1s9g s LYS 103 Ca 0.99 -1.46 0.00 0.00 -1.36 0.00 0.00 55.97 54.14 1s9g s LYS 103 Cb -1.29 -0.12 0.00 0.00 -1.68 0.00 0.00 37.83 34.75 1s9g s LYS 103 CO 0.70 -0.14 0.00 1.63 -0.76 0.00 0.00 175.35 176.78 1s9g n LYS 104 N -0.16 0.00 -3.65 1.68 5.02 -1.14 -4.86 118.16 115.05 1s9g n LYS 104 Ca -0.08 0.14 -0.30 0.00 -2.02 0.00 0.00 58.31 56.05 1s9g n LYS 104 Cb 0.63 -0.59 -0.04 0.00 -0.02 0.00 0.00 35.03 35.01 1s9g n LYS 104 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1s9g s SER 105 N -1.74 6.47 -0.18 4.39 1.04 -1.17 -4.94 113.70 117.56 1s9g s SER 105 Ca 0.00 0.57 -0.08 0.00 0.48 0.00 0.00 55.95 56.92 1s9g s SER 105 Cb 0.00 -2.08 0.07 0.00 0.10 0.00 0.00 66.02 64.11 1s9g s SER 105 CO 0.00 0.01 0.42 -0.69 0.98 0.00 0.00 173.24 173.96 1s9g s VAL 106 N -1.73 -0.32 -0.08 5.02 1.01 -1.26 -1.79 120.40 121.25 1s9g s VAL 106 Ca 0.41 0.13 -0.00 0.00 0.00 0.00 0.00 61.98 62.52 1s9g s VAL 106 Cb -0.12 -0.64 0.02 0.00 0.00 0.00 0.00 36.38 35.65 1s9g s VAL 106 CO 0.26 0.05 -0.04 0.42 0.00 0.00 0.00 175.10 175.79 1s9g s THR 107 N 1.99 0.70 0.78 3.92 -4.23 0.26 -4.95 115.64 114.11 1s9g s THR 107 Ca -0.06 -0.11 -0.11 0.00 -1.18 0.00 0.00 61.69 60.23 1s9g s THR 107 Cb -0.10 -0.77 0.06 0.00 1.34 0.00 0.00 72.50 73.03 1s9g s THR 107 CO -0.13 0.30 1.10 0.54 -0.54 0.00 0.00 174.62 175.89 1s9g s VAL 108 N 1.64 3.17 -0.25 2.29 0.11 -1.26 -0.92 120.40 125.17 1s9g s VAL 108 Ca 0.01 0.38 -0.03 0.00 -2.93 0.00 0.00 61.98 59.41 1s9g s VAL 108 Cb -0.13 -3.16 0.10 0.00 -1.53 0.00 0.00 36.38 31.66 1s9g s VAL 108 CO -0.05 -0.50 0.17 -0.76 -3.33 0.00 0.00 175.10 170.63 1s9g s LEU 109 N -5.70 0.22 -0.80 2.54 1.43 0.87 -4.73 118.68 112.52 1s9g s LEU 109 Ca 0.60 -0.87 -0.24 0.00 -1.03 0.00 0.00 54.13 52.59 1s9g s LEU 109 Cb -0.14 -0.02 -0.18 0.00 0.03 0.00 0.00 46.19 45.88 1s9g s LEU 109 CO 0.54 -0.39 1.89 -0.67 0.23 0.00 0.00 176.35 177.95 1s9g n ASP 110 N 5.28 2.37 -4.56 2.29 2.03 -1.26 -2.49 116.55 120.21 1s9g n ASP 110 Ca -0.05 -2.64 -0.38 0.00 0.52 0.00 0.00 54.79 52.23 1s9g n ASP 110 Cb 0.45 -1.25 -0.03 0.00 -0.72 0.00 0.00 41.12 39.57 1s9g n ASP 110 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1s9g s VAL 111 N 8.01 3.12 0.00 5.18 1.01 -1.03 -4.48 120.40 132.22 1s9g s VAL 111 Ca 0.64 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.71 1s9g s VAL 111 Cb 0.09 -3.28 0.00 0.00 0.00 0.00 0.00 36.38 33.19 1s9g s VAL 111 CO 0.16 -0.25 0.00 0.61 0.00 0.00 0.00 175.10 175.62 1s9g n GLY 112 N 5.85 -3.17 3.23 4.51 0.00 -1.16 -4.35 105.19 110.11 1s9g n GLY 112 Ca 0.31 -0.36 -0.06 0.00 0.00 0.00 0.00 46.02 45.90 1s9g n GLY 112 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1s9g n ASP 113 N 0.00 -0.64 -0.09 1.61 -0.08 -1.26 -4.51 116.55 111.58 1s9g n ASP 113 Ca 0.00 -1.81 -0.10 0.00 -1.51 0.00 0.00 54.79 51.37 1s9g n ASP 113 Cb 0.00 -1.00 -0.04 0.00 2.34 0.00 0.00 41.12 42.42 1s9g n ASP 113 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1s9g n ALA 114 N 10.44 0.66 0.32 -1.67 0.00 -1.26 -3.78 120.51 125.22 1s9g n ALA 114 Ca 0.17 -0.59 0.19 0.00 0.00 0.00 0.00 53.44 53.21 1s9g n ALA 114 Cb 0.48 -0.05 1.03 0.00 0.00 0.00 0.00 19.45 20.91 1s9g n ALA 114 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1s9g h TYR 115 N -1.00 0.00 -0.19 0.00 -1.99 -1.87 0.26 116.97 112.18 1s9g h TYR 115 Ca -0.10 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.63 1s9g h TYR 115 Cb 0.83 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.56 1s9g h TYR 115 CO -0.23 0.00 0.00 1.19 -0.00 0.00 0.00 178.16 179.12 1s9g n PHE 116 N -2.92 0.23 -0.07 4.88 0.99 -1.26 -1.01 117.46 118.29 1s9g n PHE 116 Ca -0.03 -0.11 -0.11 0.00 -0.00 0.00 0.00 57.45 57.20 1s9g n PHE 116 Cb 0.17 0.00 -0.15 0.00 -1.00 0.00 0.00 39.48 38.50 1s9g n PHE 116 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.76 177.19 1s9g n SER 117 N 1.38 0.62 -4.74 4.37 7.64 0.89 -4.08 113.62 119.71 1s9g n SER 117 Ca 0.17 0.12 -0.40 0.00 1.01 0.00 0.00 58.87 59.77 1s9g n SER 117 Cb 0.60 0.40 -0.05 0.00 -1.01 0.00 0.00 64.21 64.15 1s9g n SER 117 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1s9g s VAL 118 N -2.53 4.80 1.29 0.44 1.01 -1.04 -3.56 120.40 120.81 1s9g s VAL 118 Ca -0.12 1.62 -0.21 0.00 0.00 0.00 0.00 61.98 63.27 1s9g s VAL 118 Cb 0.07 -4.11 0.33 0.00 0.00 0.00 0.00 36.38 32.66 1s9g s VAL 118 CO 0.80 0.33 0.90 -2.65 0.00 0.00 0.00 175.10 174.48 1s9g n PRO 119 N 3.06 -4.01 -3.82 2.72 -0.02 -1.26 -2.29 135.00 129.38 1s9g n PRO 119 Ca -0.02 -1.48 -0.13 0.00 -2.02 0.00 0.00 63.50 59.85 1s9g n PRO 119 Cb 0.50 -1.68 -0.14 0.00 -0.02 0.00 0.00 33.50 32.17 1s9g n PRO 119 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1s9g s LEU 120 N 0.00 1.44 -0.33 2.45 2.96 -0.53 -4.21 118.68 120.46 1s9g s LEU 120 Ca 0.64 0.16 -0.43 0.00 -0.22 0.00 0.00 54.13 54.29 1s9g s LEU 120 Cb -0.09 0.23 -0.19 0.00 0.50 0.00 0.00 46.19 46.64 1s9g s LEU 120 CO 0.52 -0.06 1.37 -0.67 -1.32 0.00 0.00 176.35 176.18 1s9g n ASP 121 N 3.41 0.80 -0.17 3.68 2.03 -1.26 -4.80 116.55 120.24 1s9g n ASP 121 Ca -0.17 1.12 -0.06 0.00 0.52 0.00 0.00 54.79 56.20 1s9g n ASP 121 Cb 0.57 -0.85 -0.01 0.00 -0.72 0.00 0.00 41.12 40.11 1s9g n ASP 121 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 1s9g h GLU 122 N 4.17 -0.20 0.00 -0.67 4.57 -1.96 -2.06 114.58 118.44 1s9g h GLU 122 Ca -0.44 0.01 -0.04 0.00 -1.18 0.00 0.00 59.36 57.72 1s9g h GLU 122 Cb 1.32 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.95 1s9g h GLU 122 CO 0.84 -0.13 -0.18 -0.44 -1.18 0.00 0.00 179.01 177.92 1s9g h ASP 123 N -0.20 0.00 -0.10 1.04 3.32 -1.95 -1.13 116.42 117.38 1s9g h ASP 123 Ca 0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1s9g h ASP 123 Cb 0.55 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.10 1s9g h ASP 123 CO -0.63 0.18 0.00 0.33 -1.72 0.00 0.00 179.24 177.40 1s9g n PHE 124 N -4.23 0.14 -0.03 4.55 7.35 -0.79 -3.76 117.46 120.68 1s9g n PHE 124 Ca -0.02 -0.07 -0.13 0.00 -0.76 0.00 0.00 57.45 56.47 1s9g n PHE 124 Cb 0.25 0.00 -0.01 0.00 0.35 0.00 0.00 39.48 40.07 1s9g n PHE 124 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1s9g h ARG 125 N 0.93 0.73 0.00 -4.13 3.08 -1.00 -3.26 114.38 110.72 1s9g h ARG 125 Ca 0.00 -0.48 0.00 0.00 0.07 0.00 0.00 59.98 59.57 1s9g h ARG 125 Cb 0.21 0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.32 1s9g h ARG 125 CO 0.00 1.11 0.00 0.36 -1.07 0.00 0.00 179.97 180.37 1s9g n LYS 126 N -3.97 0.07 0.00 0.04 2.85 -1.25 -1.74 118.16 114.17 1s9g n LYS 126 Ca -0.04 0.53 0.11 0.00 -1.05 0.00 0.00 58.31 57.85 1s9g n LYS 126 Cb 0.64 -1.72 -0.03 0.00 -0.65 0.00 0.00 35.03 33.27 1s9g n LYS 126 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1s9g n TYR 127 N -1.88 0.02 1.29 5.58 4.02 -1.23 -3.87 117.16 121.10 1s9g n TYR 127 Ca -0.00 0.01 0.14 0.00 -0.01 0.00 0.00 57.90 58.03 1s9g n TYR 127 Cb 0.05 -0.11 0.69 0.00 -0.02 0.00 0.00 39.34 39.95 1s9g n TYR 127 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 1s9g n THR 128 N -1.57 0.09 -1.59 -0.72 -2.24 -0.71 -4.70 114.28 102.83 1s9g n THR 128 Ca 0.04 0.02 -0.58 0.00 -2.27 0.00 0.00 64.05 61.26 1s9g n THR 128 Cb 0.35 -0.56 -0.08 0.00 -2.10 0.00 0.00 70.33 67.95 1s9g n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1s9g n ALA 129 N -1.31 -2.08 -2.95 6.98 0.00 -1.25 -4.58 120.51 115.32 1s9g n ALA 129 Ca 0.13 0.53 -0.10 0.00 0.00 0.00 0.00 53.44 54.00 1s9g n ALA 129 Cb 0.23 -1.93 -0.12 0.00 0.00 0.00 0.00 19.45 17.63 1s9g n ALA 129 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1s9g s PHE 130 N 1.03 0.19 -0.08 0.00 -0.12 -1.20 0.42 117.98 118.22 1s9g s PHE 130 Ca 0.92 -0.38 0.05 0.00 -0.05 0.00 0.00 56.93 57.47 1s9g s PHE 130 Cb -1.19 -0.14 -0.01 0.00 -0.63 0.00 0.00 43.02 41.06 1s9g s PHE 130 CO 0.59 -0.14 -0.24 0.99 -0.05 0.00 0.00 175.22 176.37 1s9g s THR 131 N -1.07 2.11 -0.27 -4.49 2.01 -1.25 -2.49 115.64 110.20 1s9g s THR 131 Ca -0.12 -1.03 -0.11 0.00 0.31 0.00 0.00 61.69 60.75 1s9g s THR 131 Cb -0.07 -1.78 -0.05 0.00 0.01 0.00 0.00 72.50 70.61 1s9g s THR 131 CO -0.01 0.57 0.17 -0.51 -0.69 0.00 0.00 174.62 174.15 1s9g s ILE 132 N 0.02 5.24 0.71 1.82 2.07 0.31 -4.62 121.20 126.75 1s9g s ILE 132 Ca -0.09 0.14 -0.16 0.00 -1.41 0.00 0.00 60.65 59.13 1s9g s ILE 132 Cb -0.15 -3.48 0.03 0.00 0.13 0.00 0.00 42.46 38.99 1s9g s ILE 132 CO 0.06 0.28 1.24 -2.16 -1.91 0.00 0.00 174.94 172.45 1s9g s PRO 133 N 1.55 2.22 -0.54 3.50 0.05 -1.26 -0.80 135.00 139.72 1s9g s PRO 133 Ca 0.07 1.88 0.02 0.00 0.05 0.00 0.00 61.00 63.01 1s9g s PRO 133 Cb -0.15 -1.83 0.44 0.00 0.05 0.00 0.00 34.50 33.01 1s9g s PRO 133 CO 0.09 -1.80 1.67 -1.13 0.05 0.00 0.00 177.00 175.88 1s9g n SER 134 N -2.49 6.49 -1.69 6.66 3.41 -1.26 -4.70 113.62 120.04 1s9g n SER 134 Ca 0.14 -3.78 -0.07 0.00 -0.26 0.00 0.00 58.87 54.91 1s9g n SER 134 Cb 0.49 -0.73 0.03 0.00 -0.26 0.00 0.00 64.21 63.74 1s9g n SER 134 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1s9g n ILE 135 N -0.76 -1.54 -2.24 -1.33 5.41 -1.26 -3.37 119.36 114.26 1s9g n ILE 135 Ca 0.53 -0.09 -0.06 0.00 1.00 0.00 0.00 62.75 64.14 1s9g n ILE 135 Cb 0.71 -2.86 0.03 0.00 -0.71 0.00 0.00 39.64 36.81 1s9g n ILE 135 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 1s9g n ASN 136 N -0.90 -3.17 0.00 4.38 3.02 -1.26 -4.22 115.26 113.10 1s9g n ASN 136 Ca -0.05 -0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.26 1s9g n ASN 136 Cb 0.54 -2.19 0.00 0.00 -0.61 0.00 0.00 39.78 37.52 1s9g n ASN 136 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1s9g n ASN 137 N -2.01 -2.91 0.27 6.41 4.05 -1.26 -4.94 115.26 114.86 1s9g n ASN 137 Ca -0.05 0.00 0.15 0.00 0.45 0.00 0.00 54.58 55.13 1s9g n ASN 137 Cb 0.55 -0.49 0.74 0.00 1.23 0.00 0.00 39.78 41.81 1s9g n ASN 137 CO 0.00 0.00 0.00 -0.08 -3.05 0.00 0.00 177.26 174.13 1s9g h GLU 138 N 0.72 0.00 -2.72 1.20 4.81 -1.73 -3.47 114.58 113.40 1s9g h GLU 138 Ca 0.00 0.00 0.09 0.00 -0.13 0.00 0.00 59.36 59.32 1s9g h GLU 138 Cb 0.00 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 1s9g h GLU 138 CO 0.00 0.10 0.45 0.95 -0.73 0.00 0.00 179.01 179.78 1s9g s THR 139 N -3.98 0.00 0.00 0.32 -4.23 -1.26 -5.02 115.64 101.47 1s9g s THR 139 Ca -0.02 -0.76 0.00 0.00 -1.18 0.00 0.00 61.69 59.73 1s9g s THR 139 Cb 0.12 -2.81 0.00 0.00 1.34 0.00 0.00 72.50 71.15 1s9g s THR 139 CO 0.56 0.00 0.55 -0.81 -0.54 0.00 0.00 174.62 174.39 1s9g n PRO 140 N -0.61 0.47 -1.77 3.99 -0.04 -1.26 -4.74 135.00 131.03 1s9g n PRO 140 Ca -0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 1s9g n PRO 140 Cb 0.60 -1.26 0.00 0.00 -0.04 0.00 0.00 33.50 32.79 1s9g n PRO 140 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1s9g n GLY 141 N 0.94 -2.60 3.62 0.55 0.00 -1.26 -4.56 105.19 101.88 1s9g n GLY 141 Ca 0.00 -0.14 -0.43 0.00 0.00 0.00 0.00 46.02 45.45 1s9g n GLY 141 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s9g s ILE 142 N -0.84 3.25 -0.17 -0.61 1.01 0.02 -4.82 121.20 119.04 1s9g s ILE 142 Ca 0.00 0.28 -0.00 0.00 0.00 0.00 0.00 60.65 60.93 1s9g s ILE 142 Cb 0.00 -3.27 0.00 0.00 0.01 0.00 0.00 42.46 39.20 1s9g s ILE 142 CO 0.00 -0.13 -0.15 -0.60 0.00 0.00 0.00 174.94 174.06 1s9g s ARG 143 N 5.37 3.19 0.52 2.79 3.52 -1.26 -0.53 118.95 132.54 1s9g s ARG 143 Ca 0.87 -0.75 0.06 0.00 -0.13 0.00 0.00 55.73 55.79 1s9g s ARG 143 Cb -0.32 -2.66 0.03 0.00 -1.56 0.00 0.00 34.95 30.44 1s9g s ARG 143 CO 0.35 -0.05 0.42 0.71 -0.81 0.00 0.00 175.30 175.92 1s9g s TYR 144 N 0.98 1.85 -0.04 5.12 2.02 -1.04 -0.35 117.35 125.88 1s9g s TYR 144 Ca -0.02 -0.76 -0.15 0.00 -0.37 0.00 0.00 57.07 55.77 1s9g s TYR 144 Cb -0.15 -1.99 0.03 0.00 -0.40 0.00 0.00 41.96 39.45 1s9g s TYR 144 CO -0.03 -0.44 0.34 -1.14 -1.57 0.00 0.00 175.55 172.72 1s9g s GLN 145 N -4.27 0.64 0.05 -0.62 0.74 -0.24 -3.27 119.66 112.70 1s9g s GLN 145 Ca 0.39 -0.03 -0.17 0.00 0.05 0.00 0.00 55.36 55.61 1s9g s GLN 145 Cb -0.02 0.29 -0.06 0.00 1.10 0.00 0.00 33.01 34.31 1s9g s GLN 145 CO 0.24 -0.17 0.49 0.71 -0.55 0.00 0.00 175.29 176.02 1s9g s TYR 146 N -1.02 3.75 0.00 1.67 2.02 -1.26 -0.22 117.35 122.28 1s9g s TYR 146 Ca -0.11 1.12 0.00 0.00 -0.37 0.00 0.00 57.07 57.72 1s9g s TYR 146 Cb -0.04 -2.39 0.00 0.00 -0.40 0.00 0.00 41.96 39.13 1s9g s TYR 146 CO 0.04 0.60 0.17 0.09 -1.57 0.00 0.00 175.55 174.87 1s9g n ASN 147 N 1.64 0.34 -1.44 2.29 3.02 -0.71 -4.68 115.26 115.71 1s9g n ASN 147 Ca -0.11 -0.66 0.00 0.00 -0.03 0.00 0.00 54.58 53.78 1s9g n ASN 147 Cb 0.52 0.58 0.00 0.00 -0.61 0.00 0.00 39.78 40.26 1s9g n ASN 147 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 1s9g n VAL 148 N -0.58 0.00 -2.96 2.41 0.24 -1.13 -1.45 118.33 114.86 1s9g n VAL 148 Ca 0.00 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.87 1s9g n VAL 148 Cb 0.01 -0.17 -0.05 0.00 -1.47 0.00 0.00 33.84 32.15 1s9g n VAL 148 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1s9g s LEU 149 N 0.00 4.25 -0.14 1.34 1.43 -0.18 -4.43 118.68 120.95 1s9g s LEU 149 Ca 0.00 -0.09 -0.39 0.00 -1.03 0.00 0.00 54.13 52.62 1s9g s LEU 149 Cb 0.00 -2.97 -0.16 0.00 0.03 0.00 0.00 46.19 43.10 1s9g s LEU 149 CO 0.00 -0.91 1.61 -2.65 0.23 0.00 0.00 176.35 174.63 1s9g n PRO 150 N 6.71 1.21 0.00 1.29 -0.02 -1.26 -4.33 135.00 138.59 1s9g n PRO 150 Ca 0.02 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 1s9g n PRO 150 Cb 0.48 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 1s9g n PRO 150 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1s9g n GLN 151 N 4.41 0.00 -0.53 -0.52 7.27 -1.26 -2.50 117.38 124.25 1s9g n GLN 151 Ca 0.23 0.00 -0.02 0.00 0.07 0.00 0.00 57.00 57.29 1s9g n GLN 151 Cb 0.16 -0.95 -0.02 0.00 2.41 0.00 0.00 30.24 31.84 1s9g n GLN 151 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1s9g n GLY 152 N 0.21 0.61 3.93 1.69 0.00 -1.26 -5.08 105.19 105.29 1s9g n GLY 152 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1s9g n GLY 152 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1s9g s TRP 153 N 0.00 2.35 -0.05 1.61 -0.00 -1.04 -4.66 118.94 117.14 1s9g s TRP 153 Ca 0.00 0.41 -0.23 0.00 -0.00 0.00 0.00 56.10 56.28 1s9g s TRP 153 Cb 0.00 -3.56 -0.17 0.00 -0.00 0.00 0.00 33.47 29.74 1s9g s TRP 153 CO 0.00 -1.95 0.96 -0.22 -0.00 0.00 0.00 176.95 175.74 1s9g h LYS 154 N -1.06 -0.17 -1.10 5.86 3.64 -1.91 -3.31 116.57 118.53 1s9g h LYS 154 Ca -0.44 0.01 -0.37 0.00 -1.27 0.00 0.00 60.65 58.58 1s9g h LYS 154 Cb 1.29 0.04 -0.20 0.00 -0.41 0.00 0.00 32.23 32.95 1s9g h LYS 154 CO 0.52 0.30 0.47 0.41 -2.27 0.00 0.00 179.45 178.89 1s9g n GLY 155 N 0.55 3.94 0.07 5.01 0.00 -1.26 -4.47 105.19 109.02 1s9g n GLY 155 Ca -0.08 -0.94 -0.09 0.00 0.00 0.00 0.00 46.02 44.91 1s9g n GLY 155 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1s9g h SER 156 N 0.94 0.00 -0.64 1.61 0.02 -1.90 -2.55 113.55 111.02 1s9g h SER 156 Ca 0.41 -0.50 0.09 0.00 -0.84 0.00 0.00 61.79 60.96 1s9g h SER 156 Cb 1.85 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 64.32 1s9g h SER 156 CO 0.82 0.86 0.28 -0.65 -1.14 0.00 0.00 176.83 177.00 1s9g h PRO 157 N -1.00 0.48 0.00 3.45 0.11 -1.84 0.33 132.00 133.53 1s9g h PRO 157 Ca -0.04 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.04 1s9g h PRO 157 Cb 0.64 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.64 1s9g h PRO 157 CO -0.03 0.32 0.00 0.00 -0.21 0.00 0.00 178.00 178.08 1s9g n ALA 158 N -2.43 -0.40 -0.46 -0.75 0.00 -1.26 -0.90 120.51 114.31 1s9g n ALA 158 Ca 0.09 0.00 0.39 0.00 0.00 0.00 0.00 53.44 53.93 1s9g n ALA 158 Cb 0.26 0.01 0.72 0.00 0.00 0.00 0.00 19.45 20.44 1s9g n ALA 158 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1s9g h ILE 159 N 0.00 0.24 0.12 0.00 2.04 -1.35 0.49 117.51 119.05 1s9g h ILE 159 Ca 0.00 -0.02 -0.01 0.00 1.00 0.00 0.00 64.86 65.83 1s9g h ILE 159 Cb 0.00 0.16 0.00 0.00 -0.74 0.00 0.00 36.82 36.24 1s9g h ILE 159 CO 0.00 0.01 -0.06 0.15 0.00 0.00 0.00 178.15 178.25 1s9g h PHE 160 N 0.07 -0.15 -1.00 1.37 3.57 0.01 -1.89 116.94 118.92 1s9g h PHE 160 Ca 0.74 -0.00 0.24 0.00 3.53 0.00 0.00 57.97 62.47 1s9g h PHE 160 Cb 2.69 0.05 -0.12 0.00 2.79 0.00 0.00 35.95 41.35 1s9g h PHE 160 CO -0.00 -0.09 0.58 0.37 -2.23 0.00 0.00 178.31 176.94 1s9g h GLN 161 N -0.22 0.57 0.00 1.11 4.15 0.57 0.29 115.11 121.59 1s9g h GLN 161 Ca -0.02 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.37 1s9g h GLN 161 Cb 0.12 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 27.68 1s9g h GLN 161 CO 0.03 0.38 0.00 0.45 -1.93 0.00 0.00 178.83 177.76 1s9g n SER 162 N -4.88 0.00 -0.32 -0.69 2.88 0.16 -1.37 113.62 109.40 1s9g n SER 162 Ca 0.26 0.89 0.17 0.00 -1.33 0.00 0.00 58.87 58.86 1s9g n SER 162 Cb 0.72 -0.39 0.34 0.00 -0.75 0.00 0.00 64.21 64.13 1s9g n SER 162 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1s9g n SER 163 N -1.82 -0.01 0.28 -3.46 7.64 -0.39 -0.81 113.62 115.05 1s9g n SER 163 Ca 0.00 1.57 -0.14 0.00 1.01 0.00 0.00 58.87 61.31 1s9g n SER 163 Cb 0.00 -0.62 -0.07 0.00 -1.01 0.00 0.00 64.21 62.51 1s9g n SER 163 CO 0.00 0.00 0.00 -0.03 -3.01 0.00 0.00 175.04 172.00 1s9g h MET 164 N 0.00 -0.81 -0.79 1.43 -1.53 -0.17 -1.86 114.93 111.20 1s9g h MET 164 Ca 0.62 0.05 0.19 0.00 -3.44 0.00 0.00 59.70 57.12 1s9g h MET 164 Cb 1.37 0.18 -0.15 0.00 -0.55 0.00 0.00 31.60 32.46 1s9g h MET 164 CO -0.84 -0.54 -0.09 2.41 0.14 0.00 0.00 176.91 178.00 1s9g n THR 165 N -4.65 -0.33 0.09 -0.77 -1.04 0.01 0.28 114.28 107.86 1s9g n THR 165 Ca -0.10 1.78 0.03 0.00 -2.04 0.00 0.00 64.05 63.71 1s9g n THR 165 Cb 0.36 -2.53 0.40 0.00 -1.82 0.00 0.00 70.33 66.74 1s9g n THR 165 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 1s9g h LYS 166 N 0.00 0.31 -0.03 -2.82 1.57 -1.01 -0.78 116.57 113.81 1s9g h LYS 166 Ca 0.43 -0.06 -0.18 0.00 -1.87 0.00 0.00 60.65 58.98 1s9g h LYS 166 Cb 0.79 -0.05 0.01 0.00 0.08 0.00 0.00 32.23 33.07 1s9g h LYS 166 CO -0.78 0.38 -0.68 0.82 -0.57 0.00 0.00 179.45 178.62 1s9g h ILE 167 N 0.30 1.38 0.41 1.86 2.04 0.48 -3.35 117.51 120.62 1s9g h ILE 167 Ca 0.07 -2.05 -0.02 0.00 1.00 0.00 0.00 64.86 63.85 1s9g h ILE 167 Cb 0.28 2.44 0.00 0.00 -0.74 0.00 0.00 36.82 38.80 1s9g h ILE 167 CO 0.01 0.61 -0.20 -0.07 0.00 0.00 0.00 178.15 178.51 1s9g h LEU 168 N 0.08 -0.47 0.00 1.44 3.38 -0.91 -3.34 115.31 115.49 1s9g h LEU 168 Ca -0.08 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1s9g h LEU 168 Cb 1.36 0.12 0.00 0.00 0.09 0.00 0.00 40.66 42.23 1s9g h LEU 168 CO 0.14 -0.26 0.00 1.21 0.09 0.00 0.00 178.44 179.61 1s9g n GLU 169 N -3.89 0.00 0.00 1.13 2.13 -0.31 -0.42 120.64 119.28 1s9g n GLU 169 Ca -0.07 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.75 1s9g n GLU 169 Cb 0.22 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.93 1s9g n GLU 169 CO 0.00 0.00 0.00 -2.30 -0.41 0.00 0.00 177.13 174.42 1s9g n PRO 170 N -1.71 0.00 -0.33 5.31 -0.02 -1.25 -1.54 135.00 135.45 1s9g n PRO 170 Ca 0.00 0.14 -0.01 0.00 -2.02 0.00 0.00 63.50 61.61 1s9g n PRO 170 Cb 0.00 -0.97 0.03 0.00 -0.02 0.00 0.00 33.50 32.54 1s9g n PRO 170 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1s9g n PHE 171 N -0.61 0.01 -0.37 6.00 7.35 0.44 0.11 117.46 130.40 1s9g n PHE 171 Ca 0.00 1.06 0.28 0.00 -0.76 0.00 0.00 57.45 58.02 1s9g n PHE 171 Cb 0.00 -0.81 0.55 0.00 0.35 0.00 0.00 39.48 39.57 1s9g n PHE 171 CO 0.00 0.00 0.00 -0.22 -0.76 0.00 0.00 176.76 175.78 1s9g h LYS 172 N 0.00 0.27 0.06 -4.13 3.64 -1.21 0.39 116.57 115.59 1s9g h LYS 172 Ca 0.29 -0.02 -0.25 0.00 -1.27 0.00 0.00 60.65 59.40 1s9g h LYS 172 Cb 0.51 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.25 1s9g h LYS 172 CO -0.85 0.18 -1.22 -0.22 -2.27 0.00 0.00 179.45 175.07 1s9g h LYS 173 N 0.28 0.14 -0.07 1.90 3.64 0.19 -2.95 116.57 119.70 1s9g h LYS 173 Ca 0.70 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.85 1s9g h LYS 173 Cb 1.91 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 33.81 1s9g h LYS 173 CO -0.40 1.06 0.00 0.94 -2.27 0.00 0.00 179.45 178.79 1s9g n GLN 174 N -3.41 0.52 -2.75 1.90 0.00 0.13 -4.14 117.38 109.64 1s9g n GLN 174 Ca -0.07 0.00 -0.04 0.00 -0.00 0.00 0.00 57.00 56.89 1s9g n GLN 174 Cb 0.99 -1.03 0.01 0.00 0.00 0.00 0.00 30.24 30.21 1s9g n GLN 174 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 1s9g n ASN 175 N -0.40 -3.33 0.00 1.69 3.02 -1.01 -4.95 115.26 110.27 1s9g n ASN 175 Ca 0.00 -2.81 0.06 0.00 -0.03 0.00 0.00 54.58 51.80 1s9g n ASN 175 Cb 0.02 1.70 0.38 0.00 -0.61 0.00 0.00 39.78 41.27 1s9g n ASN 175 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1s9g n PRO 176 N 2.88 0.60 0.14 3.52 -0.04 -1.26 -1.68 135.00 139.17 1s9g n PRO 176 Ca 0.17 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.75 1s9g n PRO 176 Cb 0.57 -1.34 0.11 0.00 -0.04 0.00 0.00 33.50 32.80 1s9g n PRO 176 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1s9g h ASP 177 N 0.00 0.00 -3.86 3.54 3.32 -1.92 -3.44 116.42 114.06 1s9g h ASP 177 Ca 0.00 -0.02 -0.69 0.00 0.02 0.00 0.00 57.03 56.34 1s9g h ASP 177 Cb 0.00 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 39.33 1s9g h ASP 177 CO 0.00 0.01 -0.74 -0.63 -1.72 0.00 0.00 179.24 176.16 1s9g s ILE 178 N -3.27 3.33 0.09 0.35 1.01 -0.68 -4.11 121.20 117.93 1s9g s ILE 178 Ca 0.04 -0.62 0.10 0.00 0.00 0.00 0.00 60.65 60.16 1s9g s ILE 178 Cb 0.08 -2.33 -0.03 0.00 0.01 0.00 0.00 42.46 40.19 1s9g s ILE 178 CO 0.73 0.59 -0.25 -0.69 0.00 0.00 0.00 174.94 175.32 1s9g s VAL 179 N -0.72 2.06 0.03 2.92 1.01 -1.05 -4.93 120.40 119.73 1s9g s VAL 179 Ca 0.11 -1.55 0.04 0.00 0.00 0.00 0.00 61.98 60.58 1s9g s VAL 179 Cb -0.11 -1.81 -0.02 0.00 0.00 0.00 0.00 36.38 34.44 1s9g s VAL 179 CO 0.01 0.16 -0.12 -0.63 0.00 0.00 0.00 175.10 174.52 1s9g s ILE 180 N -0.97 0.95 -0.13 2.22 1.01 -1.26 -2.27 121.20 120.75 1s9g s ILE 180 Ca 0.11 -0.91 -0.00 0.00 0.00 0.00 0.00 60.65 59.85 1s9g s ILE 180 Cb -0.10 -0.88 0.03 0.00 0.01 0.00 0.00 42.46 41.53 1s9g s ILE 180 CO 0.04 -0.02 -0.07 -0.47 0.00 0.00 0.00 174.94 174.41 1s9g s TYR 181 N -0.82 1.62 0.04 3.97 5.04 -0.62 -5.01 117.35 121.56 1s9g s TYR 181 Ca 0.00 -0.90 -0.22 0.00 -2.44 0.00 0.00 57.07 53.52 1s9g s TYR 181 Cb -0.07 -1.29 -0.06 0.00 0.35 0.00 0.00 41.96 40.88 1s9g s TYR 181 CO 0.01 -0.56 0.65 -0.65 -1.34 0.00 0.00 175.55 173.66 1s9g s GLN 182 N 1.66 4.36 -0.29 4.97 -0.21 -1.26 -1.55 119.66 127.35 1s9g s GLN 182 Ca 0.04 0.86 -0.03 0.00 0.02 0.00 0.00 55.36 56.24 1s9g s GLN 182 Cb -0.13 -3.32 0.11 0.00 1.00 0.00 0.00 33.01 30.66 1s9g s GLN 182 CO -0.08 0.42 0.15 -0.47 -2.12 0.00 0.00 175.29 173.19 1s9g s TYR 183 N -0.43 0.24 0.00 0.91 5.04 -0.85 -4.98 117.35 117.29 1s9g s TYR 183 Ca 0.33 -0.82 0.00 0.00 -2.44 0.00 0.00 57.07 54.14 1s9g s TYR 183 Cb -0.19 -0.85 0.00 0.00 0.35 0.00 0.00 41.96 41.26 1s9g s TYR 183 CO 0.20 -0.84 0.00 -1.33 -1.34 0.00 0.00 175.55 172.24 1s9g n MET 184 N 5.22 0.00 0.04 4.97 2.81 -1.26 0.21 117.12 129.10 1s9g n MET 184 Ca -0.05 0.00 0.11 0.00 -1.81 0.00 0.00 57.70 55.95 1s9g n MET 184 Cb 0.42 0.00 0.04 0.00 -0.71 0.00 0.00 33.22 32.98 1s9g n MET 184 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1s9g n ASP 185 N 6.00 0.62 -4.86 7.83 8.00 -1.26 -4.87 116.55 128.01 1s9g n ASP 185 Ca 0.00 -0.12 -0.30 0.00 0.71 0.00 0.00 54.79 55.08 1s9g n ASP 185 Cb 0.00 0.70 0.06 0.00 -0.02 0.00 0.00 41.12 41.86 1s9g n ASP 185 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1s9g s ASP 186 N -4.06 5.17 -0.34 -2.24 1.01 0.55 -2.46 116.67 114.29 1s9g s ASP 186 Ca 0.04 1.19 0.05 0.00 0.71 0.00 0.00 52.55 54.54 1s9g s ASP 186 Cb 0.14 -1.97 0.18 0.00 1.01 0.00 0.00 42.92 42.27 1s9g s ASP 186 CO 0.79 -1.53 0.54 -0.22 0.21 0.00 0.00 175.17 174.96 1s9g s LEU 187 N -5.49 -1.20 -0.28 1.23 2.96 -1.04 -2.00 118.68 112.87 1s9g s LEU 187 Ca 0.59 -0.52 -0.18 0.00 -0.22 0.00 0.00 54.13 53.80 1s9g s LEU 187 Cb -0.12 1.61 -0.02 0.00 0.50 0.00 0.00 46.19 48.15 1s9g s LEU 187 CO 0.53 -0.26 0.50 -0.31 -1.32 0.00 0.00 176.35 175.49 1s9g s TYR 188 N 2.23 3.25 -0.13 5.38 1.51 -0.59 -0.09 117.35 128.91 1s9g s TYR 188 Ca 0.13 0.54 -0.03 0.00 -1.01 0.00 0.00 57.07 56.70 1s9g s TYR 188 Cb -0.09 -2.75 -0.03 0.00 -0.11 0.00 0.00 41.96 38.98 1s9g s TYR 188 CO -0.17 -0.33 -0.03 0.08 -1.11 0.00 0.00 175.55 174.00 1s9g s VAL 189 N 2.31 4.01 0.10 0.71 1.01 -0.10 -1.60 120.40 126.85 1s9g s VAL 189 Ca 0.20 -0.33 0.02 0.00 0.00 0.00 0.00 61.98 61.87 1s9g s VAL 189 Cb -0.16 -2.72 -0.04 0.00 0.00 0.00 0.00 36.38 33.46 1s9g s VAL 189 CO 0.10 0.53 -0.08 -0.83 0.00 0.00 0.00 175.10 174.83 1s9g s GLY 190 N -0.10 0.81 0.23 4.51 0.00 -0.96 0.93 107.32 112.74 1s9g s GLY 190 Ca 0.03 -1.33 -0.21 0.00 0.00 0.00 0.00 44.72 43.21 1s9g s GLY 190 CO 0.02 -1.43 0.95 -1.35 0.00 0.00 0.00 173.10 171.30 1s9g s SER 191 N -2.93 -0.04 -0.14 1.64 1.04 -0.74 -2.52 113.70 110.00 1s9g s SER 191 Ca 0.11 -0.72 0.15 0.00 0.48 0.00 0.00 55.95 55.96 1s9g s SER 191 Cb 0.03 0.59 0.34 0.00 0.10 0.00 0.00 66.02 67.08 1s9g s SER 191 CO -0.03 -1.15 1.17 0.47 0.98 0.00 0.00 173.24 174.68 1s9g n ASP 192 N -1.07 1.73 -4.84 7.02 8.00 -1.26 -2.88 116.55 123.25 1s9g n ASP 192 Ca -0.05 -3.27 -0.35 0.00 0.71 0.00 0.00 54.79 51.83 1s9g n ASP 192 Cb 0.60 -0.44 -0.06 0.00 -0.02 0.00 0.00 41.12 41.19 1s9g n ASP 192 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1s9g s LEU 193 N -2.53 4.32 -0.01 0.64 1.43 -1.26 -4.97 118.68 116.30 1s9g s LEU 193 Ca 0.32 1.14 -0.37 0.00 -1.03 0.00 0.00 54.13 54.19 1s9g s LEU 193 Cb 0.31 -3.39 -0.16 0.00 0.03 0.00 0.00 46.19 42.98 1s9g s LEU 193 CO -0.04 0.07 1.45 1.21 0.23 0.00 0.00 176.35 179.27 1s9g n GLU 194 N 0.68 1.18 -0.12 1.70 0.00 -1.26 -4.27 120.64 118.55 1s9g n GLU 194 Ca -0.04 0.43 0.18 0.00 0.00 0.00 0.00 57.16 57.73 1s9g n GLU 194 Cb 0.52 -2.09 0.27 0.00 0.00 0.00 0.00 31.44 30.14 1s9g n GLU 194 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.13 178.64 1s9g n ILE 195 N 3.09 0.00 -0.10 6.31 3.06 -1.26 0.16 119.36 130.62 1s9g n ILE 195 Ca 0.20 0.84 -0.13 0.00 -2.50 0.00 0.00 62.75 61.16 1s9g n ILE 195 Cb 0.18 -1.51 -0.04 0.00 0.54 0.00 0.00 39.64 38.81 1s9g n ILE 195 CO 0.00 0.00 0.00 1.23 -2.50 0.00 0.00 176.55 175.28 1s9g h GLY 196 N 0.00 0.80 0.31 4.50 0.00 -2.00 -2.60 103.07 104.07 1s9g h GLY 196 Ca 0.31 -0.80 -0.01 0.00 0.00 0.00 0.00 47.33 46.84 1s9g h GLY 196 CO -0.00 0.72 -0.10 1.46 0.00 0.00 0.00 176.54 178.61 1s9g h GLN 197 N 0.49 -0.28 -1.59 4.80 4.20 0.13 -2.93 115.11 119.93 1s9g h GLN 197 Ca 0.06 0.02 0.50 0.00 0.06 0.00 0.00 58.65 59.28 1s9g h GLN 197 Cb 0.83 0.06 -0.11 0.00 0.30 0.00 0.00 27.48 28.57 1s9g h GLN 197 CO 0.07 0.03 1.09 1.25 -0.67 0.00 0.00 178.83 180.60 1s9g h HIS 198 N -0.99 0.28 0.00 2.96 2.76 -1.59 3.86 115.15 122.43 1s9g h HIS 198 Ca -0.03 0.01 -0.05 0.00 -2.20 0.00 0.00 60.37 58.10 1s9g h HIS 198 Cb 0.43 -0.07 -0.01 0.00 1.55 0.00 0.00 27.41 29.32 1s9g h HIS 198 CO 0.05 -0.13 -0.35 0.00 -1.30 0.00 0.00 177.93 176.20 1s9g h ARG 199 N 0.03 0.00 0.00 5.26 3.08 -1.47 -2.07 114.38 119.21 1s9g h ARG 199 Ca 0.87 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 60.68 1s9g h ARG 199 Cb 3.11 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 33.12 1s9g h ARG 199 CO -0.24 0.23 -1.25 1.15 -1.07 0.00 0.00 179.97 178.79 1s9g h THR 200 N 0.00 1.36 0.10 2.04 2.02 0.71 -2.94 112.91 116.20 1s9g h THR 200 Ca -0.01 -3.11 -0.26 0.00 0.77 0.00 0.00 66.41 63.80 1s9g h THR 200 Cb 1.19 2.67 0.00 0.00 -1.74 0.00 0.00 68.15 70.27 1s9g h THR 200 CO 0.03 0.77 -1.18 0.50 0.37 0.00 0.00 175.52 176.01 1s9g h LYS 201 N 0.00 0.25 -0.34 6.66 1.63 0.80 -2.70 116.57 122.87 1s9g h LYS 201 Ca -0.11 -0.40 -0.10 0.00 -0.85 0.00 0.00 60.65 59.18 1s9g h LYS 201 Cb 1.85 0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 33.61 1s9g h LYS 201 CO 0.11 1.18 -0.21 0.82 -3.45 0.00 0.00 179.45 177.90 1s9g h ILE 202 N 0.08 1.27 -0.22 2.00 1.08 -1.45 0.08 117.51 120.33 1s9g h ILE 202 Ca -0.11 -1.27 0.06 0.00 -0.39 0.00 0.00 64.86 63.15 1s9g h ILE 202 Cb 1.91 1.24 -0.06 0.00 -3.07 0.00 0.00 36.82 36.83 1s9g h ILE 202 CO 0.19 0.42 -0.20 -0.08 -0.69 0.00 0.00 178.15 177.78 1s9g h GLU 203 N 0.57 -0.20 0.17 2.37 4.81 -1.43 0.13 114.58 121.00 1s9g h GLU 203 Ca 0.09 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1s9g h GLU 203 Cb 0.67 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.08 1s9g h GLU 203 CO 0.05 -0.14 -0.24 0.93 -0.73 0.00 0.00 179.01 178.89 1s9g h GLU 204 N -0.21 -0.41 -0.54 1.92 5.08 -1.00 -0.86 114.58 118.56 1s9g h GLU 204 Ca 0.13 0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.57 1s9g h GLU 204 Cb 0.41 0.09 -0.07 0.00 0.50 0.00 0.00 28.75 29.69 1s9g h GLU 204 CO -0.35 -0.27 -0.32 -0.11 -1.00 0.00 0.00 179.01 176.96 1s9g n LEU 205 N -3.78 -0.58 -0.29 1.33 7.94 -0.07 0.90 117.00 122.45 1s9g n LEU 205 Ca -0.05 1.21 0.09 0.00 -1.11 0.00 0.00 56.01 56.15 1s9g n LEU 205 Cb 0.21 -0.25 0.21 0.00 0.53 0.00 0.00 43.42 44.12 1s9g n LEU 205 CO 0.10 -0.91 0.83 -0.09 -1.11 0.00 0.00 177.39 176.21 1s9g h ARG 206 N 0.00 0.08 -0.41 1.96 2.43 -0.69 0.38 114.38 118.13 1s9g h ARG 206 Ca 0.09 -0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 59.18 1s9g h ARG 206 Cb 0.22 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.74 1s9g h ARG 206 CO -0.51 0.06 -0.04 1.96 -1.51 0.00 0.00 179.97 179.92 1s9g h GLN 207 N 0.09 0.75 0.15 0.20 1.08 0.20 0.11 115.11 117.68 1s9g h GLN 207 Ca 0.49 -0.26 0.02 0.00 -1.45 0.00 0.00 58.65 57.45 1s9g h GLN 207 Cb 0.92 -0.06 -0.04 0.00 -0.05 0.00 0.00 27.48 28.26 1s9g h GLN 207 CO -0.76 0.85 -0.38 1.25 -0.95 0.00 0.00 178.83 178.84 1s9g h HIS 208 N 0.57 -1.06 -0.16 2.96 2.76 0.26 -0.80 115.15 119.69 1s9g h HIS 208 Ca 0.11 0.02 0.03 0.00 -2.20 0.00 0.00 60.37 58.33 1s9g h HIS 208 Cb 0.54 0.44 -0.06 0.00 1.55 0.00 0.00 27.41 29.89 1s9g h HIS 208 CO 0.04 -0.49 -0.45 -0.07 -1.30 0.00 0.00 177.93 175.66 1s9g h LEU 209 N -0.63 -1.45 -1.22 0.26 3.38 -0.27 -1.50 115.31 113.89 1s9g h LEU 209 Ca 0.02 0.18 0.44 0.00 0.09 0.00 0.00 57.88 58.61 1s9g h LEU 209 Cb 0.65 0.57 -0.15 0.00 0.09 0.00 0.00 40.66 41.81 1s9g h LEU 209 CO -0.21 -0.39 0.73 0.25 0.09 0.00 0.00 178.44 178.92 1s9g h LEU 210 N -0.45 0.27 -0.57 1.67 5.85 -0.01 1.81 115.31 123.88 1s9g h LEU 210 Ca 0.03 0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.95 1s9g h LEU 210 Cb 0.55 0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.77 1s9g h LEU 210 CO -0.39 -0.32 0.00 0.54 -0.34 0.00 0.00 178.44 177.94 1s9g n ARG 211 N -4.96 0.19 -1.33 1.25 1.74 -0.38 -2.73 116.66 110.45 1s9g n ARG 211 Ca 0.39 0.38 -0.32 0.00 -0.77 0.00 0.00 57.85 57.53 1s9g n ARG 211 Cb 1.41 -1.84 0.10 0.00 -1.02 0.00 0.00 32.46 31.11 1s9g n ARG 211 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 1s9g n TRP 212 N -2.19 3.15 0.00 -1.55 7.02 0.61 -4.88 117.44 119.61 1s9g n TRP 212 Ca 0.03 -2.73 0.00 0.00 -1.02 0.00 0.00 57.50 53.77 1s9g n TRP 212 Cb 0.25 -1.29 0.00 0.00 -2.42 0.00 0.00 31.31 27.85 1s9g n TRP 212 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1s9g n GLY 213 N -0.96 0.10 3.61 6.99 0.00 -1.10 -4.87 105.19 108.95 1s9g n GLY 213 Ca 0.61 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 46.20 1s9g n GLY 213 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1s9g s LEU 214 N 0.00 3.90 0.48 0.99 1.43 -1.23 -4.88 118.68 119.36 1s9g s LEU 214 Ca 0.00 0.65 0.02 0.00 -1.03 0.00 0.00 54.13 53.77 1s9g s LEU 214 Cb 0.00 -3.40 0.01 0.00 0.03 0.00 0.00 46.19 42.83 1s9g s LEU 214 CO 0.00 -0.97 0.69 -0.89 0.23 0.00 0.00 176.35 175.41 1s9g s THR 215 N 3.76 3.44 -0.41 5.49 2.01 -1.26 -2.54 115.64 126.14 1s9g s THR 215 Ca 0.42 -0.62 0.07 0.00 0.31 0.00 0.00 61.69 61.86 1s9g s THR 215 Cb -0.11 -3.27 0.17 0.00 0.01 0.00 0.00 72.50 69.31 1s9g s THR 215 CO 0.21 -0.18 0.56 0.42 -0.69 0.00 0.00 174.62 174.95 1s9g s THR 216 N -2.59 -0.80 -0.15 -0.82 -4.23 -1.26 -2.96 115.64 102.83 1s9g s THR 216 Ca 0.52 -0.37 0.14 0.00 -1.18 0.00 0.00 61.69 60.80 1s9g s THR 216 Cb -0.10 -0.20 0.14 0.00 1.34 0.00 0.00 72.50 73.68 1s9g s THR 216 CO 0.37 -0.18 1.37 -2.65 -0.54 0.00 0.00 174.62 173.00 1s9g n PRO 217 N 4.26 0.10 -2.39 3.99 -0.02 -1.26 -3.81 135.00 135.86 1s9g n PRO 217 Ca 0.12 0.57 -0.37 0.00 -2.02 0.00 0.00 63.50 61.80 1s9g n PRO 217 Cb 0.54 -1.99 -0.04 0.00 -0.02 0.00 0.00 33.50 31.99 1s9g n PRO 217 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1s9g s ASP 218 N -3.55 6.03 0.00 2.55 1.11 -1.26 -4.88 116.67 116.67 1s9g s ASP 218 Ca -0.02 -1.06 0.00 0.00 0.18 0.00 0.00 52.55 51.65 1s9g s ASP 218 Cb 0.04 -2.56 0.00 0.00 1.07 0.00 0.00 42.92 41.47 1s9g s ASP 218 CO 0.13 -1.92 0.00 0.29 1.18 0.00 0.00 175.17 174.85 1s9g n LYS 219 N 8.94 0.00 0.00 8.23 4.01 -1.25 -4.31 118.16 133.78 1s9g n LYS 219 Ca 0.32 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 58.12 1s9g n LYS 219 Cb 0.50 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.02 1s9g n LYS 219 CO 0.00 0.00 0.00 1.17 -1.11 0.00 0.00 177.40 177.46 1s9g n LYS 220 N 0.00 0.00 -1.96 1.97 4.81 -1.26 -4.29 118.16 117.43 1s9g n LYS 220 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1s9g n LYS 220 Cb 0.00 -1.30 0.00 0.00 0.02 0.00 0.00 35.03 33.75 1s9g n LYS 220 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1s9g n HIS 221 N -0.34 0.00 0.00 5.64 8.25 -1.26 -5.01 115.22 122.50 1s9g n HIS 221 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1s9g n HIS 221 Cb 0.00 -1.24 0.00 0.00 1.12 0.00 0.00 29.99 29.87 1s9g n HIS 221 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1s9g n GLN 222 N -0.62 0.00 -0.90 -0.41 1.13 -1.26 -4.59 117.38 110.73 1s9g n GLN 222 Ca 0.00 0.00 -0.35 0.00 -1.94 0.00 0.00 57.00 54.71 1s9g n GLN 222 Cb 0.43 -0.00 -0.05 0.00 0.11 0.00 0.00 30.24 30.73 1s9g n GLN 222 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1s9g n LYS 223 N 0.00 0.00 -4.20 -1.09 5.02 -1.26 -4.98 118.16 111.65 1s9g n LYS 223 Ca 0.00 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.04 1s9g n LYS 223 Cb 0.00 -0.89 -0.08 0.00 -0.02 0.00 0.00 35.03 34.04 1s9g n LYS 223 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1s9g s GLU 224 N 0.10 2.20 0.70 1.97 2.02 -1.26 -4.57 118.70 119.85 1s9g s GLU 224 Ca 0.54 -1.80 -0.11 0.00 0.02 0.00 0.00 54.97 53.63 1s9g s GLU 224 Cb -0.76 -1.98 0.01 0.00 0.10 0.00 0.00 34.13 31.50 1s9g s GLU 224 CO 0.35 -0.03 1.06 -1.25 0.02 0.00 0.00 175.26 175.41 1s9g s PRO 225 N -3.85 2.95 0.10 0.39 0.04 -1.26 -4.33 135.00 129.03 1s9g s PRO 225 Ca 0.39 0.80 -0.30 0.00 0.04 0.00 0.00 61.00 61.92 1s9g s PRO 225 Cb 0.03 -2.00 -0.06 0.00 0.04 0.00 0.00 34.50 32.50 1s9g s PRO 225 CO 0.22 -1.05 1.21 -2.14 0.04 0.00 0.00 177.00 175.27 1s9g s PRO 226 N -5.13 4.45 0.08 0.56 0.02 -1.26 -5.04 135.00 128.67 1s9g s PRO 226 Ca 0.58 1.81 -0.30 0.00 0.02 0.00 0.00 61.00 63.11 1s9g s PRO 226 Cb -0.13 -3.31 -0.06 0.00 0.02 0.00 0.00 34.50 31.02 1s9g s PRO 226 CO 0.54 -0.22 1.16 -0.06 -0.33 0.00 0.00 177.00 178.10 1s9g s PHE 227 N 0.75 3.49 -0.19 6.54 0.08 0.26 -4.67 117.98 124.25 1s9g s PHE 227 Ca 0.57 1.40 -0.18 0.00 0.12 0.00 0.00 56.93 58.84 1s9g s PHE 227 Cb -0.31 -3.37 -0.04 0.00 -0.57 0.00 0.00 43.02 38.74 1s9g s PHE 227 CO 0.31 -1.03 0.47 -0.51 -0.10 0.00 0.00 175.22 174.36 1s9g s LEU 228 N 0.78 4.17 -0.25 -0.37 1.43 -1.26 -0.78 118.68 122.41 1s9g s LEU 228 Ca 0.56 0.65 -0.13 0.00 -1.03 0.00 0.00 54.13 54.19 1s9g s LEU 228 Cb -0.29 -2.64 0.08 0.00 0.03 0.00 0.00 46.19 43.38 1s9g s LEU 228 CO 0.30 -0.11 0.59 0.86 0.23 0.00 0.00 176.35 178.22 1s9g s TRP 229 N 1.34 -0.98 -0.42 0.29 -0.00 -0.98 -4.91 118.94 113.28 1s9g s TRP 229 Ca 0.23 1.91 -0.05 0.00 -0.00 0.00 0.00 56.10 58.19 1s9g s TRP 229 Cb -0.15 0.55 0.05 0.00 -0.00 0.00 0.00 33.47 33.92 1s9g s TRP 229 CO 0.09 -0.50 0.13 -1.33 -0.00 0.00 0.00 176.95 175.34 1s9g n MET 230 N 4.59 -2.47 -1.89 5.86 2.81 -1.26 0.78 117.12 125.55 1s9g n MET 230 Ca -0.18 0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.74 1s9g n MET 230 Cb 0.56 -4.49 0.00 0.00 -0.71 0.00 0.00 33.22 28.58 1s9g n MET 230 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1s9g n GLY 231 N -0.62 0.74 3.17 3.03 0.00 -1.26 -5.03 105.19 105.22 1s9g n GLY 231 Ca 0.03 -0.69 -0.23 0.00 0.00 0.00 0.00 46.02 45.13 1s9g n GLY 231 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1s9g s TYR 232 N -2.34 1.44 -0.44 1.61 1.51 0.23 -2.10 117.35 117.27 1s9g s TYR 232 Ca 0.00 -0.33 -0.16 0.00 -1.01 0.00 0.00 57.07 55.58 1s9g s TYR 232 Cb 0.00 -0.88 0.04 0.00 -0.11 0.00 0.00 41.96 41.01 1s9g s TYR 232 CO 0.00 0.03 0.36 -2.00 -1.11 0.00 0.00 175.55 172.83 1s9g s GLU 233 N -0.89 2.99 -0.42 -0.62 2.12 0.37 -2.32 118.70 119.92 1s9g s GLU 233 Ca 0.05 -1.10 -0.08 0.00 0.36 0.00 0.00 54.97 54.19 1s9g s GLU 233 Cb -0.07 -4.03 0.09 0.00 0.26 0.00 0.00 34.13 30.37 1s9g s GLU 233 CO 0.01 -0.87 0.26 -0.51 -0.54 0.00 0.00 175.26 173.61 1s9g s LEU 234 N 1.75 5.22 0.34 2.70 1.43 0.04 -0.78 118.68 129.38 1s9g s LEU 234 Ca 0.06 -1.62 0.01 0.00 -1.03 0.00 0.00 54.13 51.56 1s9g s LEU 234 Cb -0.21 -1.97 -0.03 0.00 0.03 0.00 0.00 46.19 44.02 1s9g s LEU 234 CO 0.09 -0.56 0.52 -1.00 0.23 0.00 0.00 176.35 175.64 1s9g s HIS 235 N 1.38 3.45 0.30 0.29 3.76 0.14 -0.57 115.29 124.05 1s9g s HIS 235 Ca 0.04 0.26 0.05 0.00 -0.15 0.00 0.00 55.06 55.25 1s9g s HIS 235 Cb -0.23 -1.88 0.81 0.00 1.11 0.00 0.00 32.58 32.39 1s9g s HIS 235 CO 0.01 0.13 1.48 -2.30 -0.85 0.00 0.00 174.74 173.20 1s9g n PRO 236 N -1.74 -0.07 -0.22 8.40 -0.02 -1.26 -2.17 135.00 137.91 1s9g n PRO 236 Ca -0.05 1.39 0.03 0.00 -2.02 0.00 0.00 63.50 62.86 1s9g n PRO 236 Cb 0.56 -2.25 0.05 0.00 -0.02 0.00 0.00 33.50 31.84 1s9g n PRO 236 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1s9g n ASP 237 N -5.35 1.03 -4.05 2.55 5.75 -1.26 -4.76 116.55 110.46 1s9g n ASP 237 Ca 0.24 -2.22 -0.10 0.00 -0.01 0.00 0.00 54.79 52.71 1s9g n ASP 237 Cb 0.81 -0.22 -0.07 0.00 -1.03 0.00 0.00 41.12 40.61 1s9g n ASP 237 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 1s9g s LYS 238 N -1.08 1.38 0.17 0.11 -2.85 -0.92 -4.46 119.74 112.09 1s9g s LYS 238 Ca 0.11 -1.35 -0.17 0.00 -1.00 0.00 0.00 55.97 53.57 1s9g s LYS 238 Cb 0.09 0.40 0.03 0.00 -2.06 0.00 0.00 37.83 36.29 1s9g s LYS 238 CO 0.01 -0.53 0.47 1.67 0.10 0.00 0.00 175.35 177.07 1s9g s TRP 239 N -4.05 -0.12 0.12 1.78 1.48 0.46 -0.68 118.94 117.93 1s9g s TRP 239 Ca 0.26 -0.21 -0.25 0.00 -1.06 0.00 0.00 56.10 54.84 1s9g s TRP 239 Cb 0.02 0.32 0.08 0.00 -1.16 0.00 0.00 33.47 32.73 1s9g s TRP 239 CO 0.08 -0.83 1.10 -0.08 -4.06 0.00 0.00 176.95 173.17 1s9g s THR 240 N -3.86 0.00 0.20 0.66 -1.32 0.04 -0.34 115.64 111.03 1s9g s THR 240 Ca 0.08 -0.47 -0.28 0.00 -1.21 0.00 0.00 61.69 59.80 1s9g s THR 240 Cb 0.00 -2.67 -0.08 0.00 -1.51 0.00 0.00 72.50 68.24 1s9g s THR 240 CO -0.06 0.00 0.86 -0.69 -2.21 0.00 0.00 174.62 172.53 1s9g s VAL 241 N -2.33 4.22 0.02 5.08 1.01 -1.26 0.14 120.40 127.27 1s9g s VAL 241 Ca 0.21 1.91 -0.30 0.00 0.00 0.00 0.00 61.98 63.80 1s9g s VAL 241 Cb -0.01 -4.24 -0.09 0.00 0.00 0.00 0.00 36.38 32.04 1s9g s VAL 241 CO 0.03 0.51 1.99 0.00 0.00 0.00 0.00 175.10 177.62 1s9g n GLN 242 N 1.58 2.80 -0.35 2.72 6.02 -0.89 -4.50 117.38 124.75 1s9g n GLN 242 Ca -0.04 1.02 -0.12 0.00 -0.01 0.00 0.00 57.00 57.85 1s9g n GLN 242 Cb 0.48 -3.01 -0.01 0.00 1.02 0.00 0.00 30.24 28.72 1s9g n GLN 242 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 1s9g n PRO 243 N 7.58 0.00 -4.31 -1.09 -0.02 -1.26 -4.96 135.00 130.95 1s9g n PRO 243 Ca 0.21 0.00 -0.23 0.00 -2.02 0.00 0.00 63.50 61.46 1s9g n PRO 243 Cb 0.41 -0.27 -0.07 0.00 -0.02 0.00 0.00 33.50 33.54 1s9g n PRO 243 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 1s9g s ILE 244 N -0.21 3.33 -0.18 4.25 -4.36 -1.26 -5.13 121.20 117.65 1s9g s ILE 244 Ca 0.17 -1.96 -0.02 0.00 -0.26 0.00 0.00 60.65 58.59 1s9g s ILE 244 Cb -0.25 -2.79 0.05 0.00 1.25 0.00 0.00 42.46 40.72 1s9g s ILE 244 CO 0.14 -0.37 -0.01 -0.69 0.24 0.00 0.00 174.94 174.25 1s9g s VAL 245 N -2.35 0.81 -0.74 8.37 1.01 -1.26 -5.07 120.40 121.18 1s9g s VAL 245 Ca 0.31 -0.60 -0.18 0.00 0.00 0.00 0.00 61.98 61.52 1s9g s VAL 245 Cb -0.06 -1.16 0.14 0.00 0.00 0.00 0.00 36.38 35.30 1s9g s VAL 245 CO 0.19 -0.05 0.83 -0.76 0.00 0.00 0.00 175.10 175.31 1s9g s LEU 246 N 1.74 5.67 0.84 3.92 1.43 -1.26 -5.03 118.68 126.00 1s9g s LEU 246 Ca -0.01 -1.92 -0.13 0.00 -1.03 0.00 0.00 54.13 51.04 1s9g s LEU 246 Cb -0.16 -2.30 0.08 0.00 0.03 0.00 0.00 46.19 43.84 1s9g s LEU 246 CO -0.07 -0.96 1.05 -0.81 0.23 0.00 0.00 176.35 175.78 1s9g n PRO 247 N 5.77 -0.02 -4.15 1.29 -0.04 -1.26 -5.00 135.00 131.60 1s9g n PRO 247 Ca 0.05 0.07 -0.34 0.00 -0.04 0.00 0.00 63.50 63.24 1s9g n PRO 247 Cb 0.45 -2.31 -0.14 0.00 -0.04 0.00 0.00 33.50 31.46 1s9g n PRO 247 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1s9g s GLU 248 N -4.07 3.38 0.24 0.54 2.02 -1.26 -5.10 118.70 114.44 1s9g s GLU 248 Ca 0.69 -0.64 0.05 0.00 0.02 0.00 0.00 54.97 55.09 1s9g s GLU 248 Cb -0.27 -2.89 -0.05 0.00 0.10 0.00 0.00 34.13 31.01 1s9g s GLU 248 CO 0.55 -0.07 -0.04 0.15 0.02 0.00 0.00 175.26 175.87 1s9g s LYS 249 N 1.13 1.38 -0.07 1.61 1.02 -1.26 -5.07 119.74 118.48 1s9g s LYS 249 Ca 0.01 -1.68 -0.00 0.00 0.02 0.00 0.00 55.97 54.32 1s9g s LYS 249 Cb -0.14 -0.82 -0.00 0.00 -0.52 0.00 0.00 37.83 36.35 1s9g s LYS 249 CO -0.02 -0.02 -0.01 -0.44 -0.92 0.00 0.00 175.35 173.95 1s9g h ASP 250 N 2.45 0.00 -3.54 2.83 3.45 -2.05 -3.46 116.42 116.10 1s9g h ASP 250 Ca -0.39 0.00 -0.68 0.00 0.43 0.00 0.00 57.03 56.39 1s9g h ASP 250 Cb 1.22 0.00 -0.18 0.00 -0.56 0.00 0.00 39.33 39.81 1s9g h ASP 250 CO 0.65 0.34 -0.67 -0.94 -1.57 0.00 0.00 179.24 177.05 1s9g s SER 251 N -4.72 4.81 -0.15 6.45 1.04 -1.26 -4.99 113.70 114.88 1s9g s SER 251 Ca -0.01 0.01 -0.02 0.00 0.48 0.00 0.00 55.95 56.41 1s9g s SER 251 Cb 0.00 -1.31 -0.02 0.00 0.10 0.00 0.00 66.02 64.79 1s9g s SER 251 CO 0.01 0.35 -0.08 0.26 0.98 0.00 0.00 173.24 174.76 1s9g s TRP 252 N -0.71 2.93 0.31 5.02 0.52 -1.26 -5.04 118.94 120.72 1s9g s TRP 252 Ca 0.11 -0.52 0.07 0.00 0.02 0.00 0.00 56.10 55.79 1s9g s TRP 252 Cb -0.11 -1.93 -0.03 0.00 -1.15 0.00 0.00 33.47 30.24 1s9g s TRP 252 CO 0.02 -0.17 0.25 -0.08 0.02 0.00 0.00 176.95 176.98 1s9g s THR 253 N 0.50 3.72 0.15 2.01 -1.32 -1.26 -0.12 115.64 119.32 1s9g s THR 253 Ca -0.06 -1.42 -0.21 0.00 -1.21 0.00 0.00 61.69 58.79 1s9g s THR 253 Cb -0.15 -3.21 0.03 0.00 -1.51 0.00 0.00 72.50 67.66 1s9g s THR 253 CO 0.03 -0.23 1.64 0.58 -2.21 0.00 0.00 174.62 174.44 1s9g h VAL 254 N 1.35 0.47 -0.01 5.08 2.07 -1.60 0.30 116.25 123.91 1s9g h VAL 254 Ca -0.46 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.07 1s9g h VAL 254 Cb 1.25 0.47 -0.00 0.00 -1.52 0.00 0.00 31.29 31.49 1s9g h VAL 254 CO 0.59 0.00 0.05 -1.13 0.02 0.00 0.00 177.57 177.11 1s9g h ASN 255 N -0.19 0.00 0.00 0.57 -0.73 -1.73 -0.95 115.58 112.55 1s9g h ASN 255 Ca 0.14 0.00 -0.00 0.00 1.87 0.00 0.00 56.30 58.31 1s9g h ASN 255 Cb 0.40 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.99 1s9g h ASN 255 CO -0.36 0.00 -0.00 0.44 -0.37 0.00 0.00 177.43 177.14 1s9g h ASP 256 N 0.00 -0.00 0.02 1.15 3.45 -0.82 -3.15 116.42 117.08 1s9g h ASP 256 Ca 0.00 -0.94 -0.03 0.00 0.43 0.00 0.00 57.03 56.49 1s9g h ASP 256 Cb 0.11 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 38.87 1s9g h ASP 256 CO -0.00 0.97 -0.08 0.40 -1.57 0.00 0.00 179.24 178.96 1s9g h ILE 257 N -1.00 1.13 0.03 0.35 2.04 -0.38 -2.52 117.51 117.15 1s9g h ILE 257 Ca -0.00 -0.54 -0.00 0.00 1.00 0.00 0.00 64.86 65.32 1s9g h ILE 257 Cb 0.94 1.14 0.00 0.00 -0.74 0.00 0.00 36.82 38.17 1s9g h ILE 257 CO 0.00 0.17 -0.01 1.56 0.00 0.00 0.00 178.15 179.86 1s9g h GLN 258 N 0.15 -0.04 0.00 2.37 4.20 -1.29 0.06 115.11 120.57 1s9g h GLN 258 Ca 0.03 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.72 1s9g h GLN 258 Cb 0.25 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.04 1s9g h GLN 258 CO 0.01 0.31 -0.11 0.87 -0.67 0.00 0.00 178.83 179.24 1s9g h LYS 259 N -0.39 0.00 0.37 1.46 1.57 -1.49 0.87 116.57 118.96 1s9g h LYS 259 Ca -0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1s9g h LYS 259 Cb 0.36 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.68 1s9g h LYS 259 CO 0.01 0.11 -0.18 1.25 -0.57 0.00 0.00 179.45 180.07 1s9g h LEU 260 N 0.00 -0.42 -0.87 2.94 5.85 -1.10 0.12 115.31 121.83 1s9g h LEU 260 Ca -0.00 -0.13 0.08 0.00 0.84 0.00 0.00 57.88 58.67 1s9g h LEU 260 Cb 0.26 0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.33 1s9g h LEU 260 CO 0.01 0.01 0.52 0.58 -0.34 0.00 0.00 178.44 179.22 1s9g h VAL 261 N -0.96 0.98 -0.10 1.05 2.07 -0.70 0.38 116.25 118.96 1s9g h VAL 261 Ca -0.05 -0.31 0.03 0.00 0.82 0.00 0.00 66.70 67.18 1s9g h VAL 261 Cb 0.53 -0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.26 1s9g h VAL 261 CO 0.08 0.17 -0.06 1.23 0.02 0.00 0.00 177.57 179.01 1s9g h GLY 262 N 0.91 0.02 0.99 2.17 0.00 -0.76 0.71 103.07 107.11 1s9g h GLY 262 Ca 0.40 0.08 -0.00 0.00 0.00 0.00 0.00 47.33 47.80 1s9g h GLY 262 CO -0.21 -0.08 0.26 0.50 0.00 0.00 0.00 176.54 177.02 1s9g h LYS 263 N -0.07 0.58 -0.20 4.80 1.57 0.36 -1.16 116.57 122.45 1s9g h LYS 263 Ca 0.06 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 1s9g h LYS 263 Cb 0.15 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1s9g h LYS 263 CO -0.14 0.43 0.08 -0.07 -0.57 0.00 0.00 179.45 179.18 1s9g h LEU 264 N 0.57 0.28 0.01 2.94 3.38 0.33 -1.32 115.31 121.50 1s9g h LEU 264 Ca 0.16 -0.17 0.03 0.00 0.09 0.00 0.00 57.88 57.98 1s9g h LEU 264 Cb -0.01 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 1s9g h LEU 264 CO -0.03 0.37 -0.19 0.78 0.09 0.00 0.00 178.44 179.46 1s9g h ASN 265 N 0.17 -0.56 -0.87 -0.43 2.35 0.53 -2.45 115.58 114.33 1s9g h ASN 265 Ca 0.07 0.08 0.16 0.00 -0.55 0.00 0.00 56.30 56.06 1s9g h ASN 265 Cb 0.18 0.23 -0.10 0.00 0.05 0.00 0.00 38.32 38.68 1s9g h ASN 265 CO -0.01 -0.26 0.44 -0.25 -1.65 0.00 0.00 177.43 175.71 1s9g h TRP 266 N -0.32 0.77 0.00 1.19 2.91 -1.04 0.21 115.95 119.67 1s9g h TRP 266 Ca 0.05 0.04 0.00 0.00 1.13 0.00 0.00 58.89 60.11 1s9g h TRP 266 Cb 0.38 -0.21 0.00 0.00 -0.51 0.00 0.00 29.16 28.82 1s9g h TRP 266 CO -0.23 0.15 0.00 0.00 -1.03 0.00 0.00 178.44 177.33 1s9g h ALA 267 N 1.59 1.00 0.00 2.65 0.00 -0.81 -3.09 119.26 120.60 1s9g h ALA 267 Ca 0.49 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.40 1s9g h ALA 267 Cb 0.73 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 1s9g h ALA 267 CO -0.39 0.00 -0.00 1.03 0.00 0.00 0.00 179.25 179.89 1s9g h SER 268 N 0.00 0.00 -0.94 0.00 0.87 -0.12 -0.90 113.55 112.46 1s9g h SER 268 Ca 0.00 0.00 0.19 0.00 -1.23 0.00 0.00 61.79 60.75 1s9g h SER 268 Cb 0.45 0.00 -0.08 0.00 -0.44 0.00 0.00 62.40 62.33 1s9g h SER 268 CO 0.00 0.00 0.60 1.56 -0.53 0.00 0.00 176.83 178.46 1s9g h GLN 269 N 0.00 0.53 0.00 2.24 4.20 -1.67 -3.03 115.11 117.39 1s9g h GLN 269 Ca -0.00 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.68 1s9g h GLN 269 Cb 0.00 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.66 1s9g h GLN 269 CO 0.00 0.35 -0.10 1.51 -0.67 0.00 0.00 178.83 179.91 1s9g n ILE 270 N -4.58 0.00 -3.15 2.54 0.13 -1.08 0.42 119.36 113.64 1s9g n ILE 270 Ca 0.20 -0.13 -0.43 0.00 -1.10 0.00 0.00 62.75 61.29 1s9g n ILE 270 Cb 0.64 0.76 -0.07 0.00 -0.84 0.00 0.00 39.64 40.13 1s9g n ILE 270 CO 0.00 0.00 0.00 -0.31 2.80 0.00 0.00 176.55 179.04 1s9g s TYR 271 N -0.46 3.05 0.58 9.51 1.51 -0.36 -4.78 117.35 126.40 1s9g s TYR 271 Ca 0.00 -0.37 -0.04 0.00 -1.01 0.00 0.00 57.07 55.65 1s9g s TYR 271 Cb 0.00 -3.44 -0.02 0.00 -0.11 0.00 0.00 41.96 38.39 1s9g s TYR 271 CO 0.00 -0.97 -0.19 -2.30 -1.11 0.00 0.00 175.55 170.98 1s9g n PRO 272 N 6.19 -0.09 -1.26 -1.71 -0.02 -1.26 -3.77 135.00 133.09 1s9g n PRO 272 Ca -0.05 -0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.41 1s9g n PRO 272 Cb 0.46 -1.02 0.00 0.00 -0.02 0.00 0.00 33.50 32.93 1s9g n PRO 272 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1s9g n GLY 273 N 3.04 0.00 3.68 -1.23 0.00 -1.26 -4.87 105.19 104.55 1s9g n GLY 273 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1s9g n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s9g s ILE 274 N -1.00 4.91 0.32 -0.61 1.01 -1.25 -4.93 121.20 119.65 1s9g s ILE 274 Ca 0.00 1.62 0.06 0.00 0.00 0.00 0.00 60.65 62.34 1s9g s ILE 274 Cb 0.00 -4.13 -0.01 0.00 0.01 0.00 0.00 42.46 38.33 1s9g s ILE 274 CO 0.00 0.08 0.44 -0.54 0.00 0.00 0.00 174.94 174.92 1s9g s LYS 275 N 1.82 3.14 0.00 2.79 1.02 -1.26 -4.93 119.74 122.32 1s9g s LYS 275 Ca 0.39 -0.99 0.00 0.00 0.02 0.00 0.00 55.97 55.39 1s9g s LYS 275 Cb -0.17 -2.81 0.00 0.00 -0.52 0.00 0.00 37.83 34.33 1s9g s LYS 275 CO 0.15 0.12 0.01 0.28 -0.92 0.00 0.00 175.35 174.99 1s9g n VAL 276 N -1.59 0.00 0.03 3.17 0.31 -1.26 -4.98 118.33 114.01 1s9g n VAL 276 Ca -0.01 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.17 1s9g n VAL 276 Cb 0.58 0.28 -0.09 0.00 -0.91 0.00 0.00 33.84 33.69 1s9g n VAL 276 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1s9g h ARG 277 N 0.00 -0.58 -0.54 5.55 2.43 -1.97 -2.47 114.38 116.80 1s9g h ARG 277 Ca 0.00 0.04 0.05 0.00 -0.81 0.00 0.00 59.98 59.26 1s9g h ARG 277 Cb 0.59 0.13 -0.05 0.00 -0.42 0.00 0.00 29.97 30.23 1s9g h ARG 277 CO 0.00 -0.39 0.27 1.96 -1.51 0.00 0.00 179.97 180.30 1s9g h GLN 278 N -0.60 0.49 -0.07 0.20 1.08 -1.94 0.57 115.11 114.84 1s9g h GLN 278 Ca 0.02 -0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 57.16 1s9g h GLN 278 Cb 0.66 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.97 1s9g h GLN 278 CO -0.35 0.33 -0.06 -0.07 -0.95 0.00 0.00 178.83 177.72 1s9g h LEU 279 N 0.51 0.09 0.13 1.46 3.38 -1.85 -2.94 115.31 116.09 1s9g h LEU 279 Ca 0.25 -0.01 -0.35 0.00 0.09 0.00 0.00 57.88 57.86 1s9g h LEU 279 Cb 0.18 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1s9g h LEU 279 CO -0.18 0.17 -1.87 0.28 0.09 0.00 0.00 178.44 176.94 1s9g h SER 280 N 0.10 0.44 -1.14 -0.43 0.02 -0.94 -3.31 113.55 108.29 1s9g h SER 280 Ca 0.02 -0.84 0.33 0.00 -0.84 0.00 0.00 61.79 60.47 1s9g h SER 280 Cb 0.18 -0.14 -0.05 0.00 0.14 0.00 0.00 62.40 62.53 1s9g h SER 280 CO 0.01 1.73 0.99 0.50 -1.14 0.00 0.00 176.83 178.93 1s9g h LYS 281 N 0.08 0.00 -0.16 3.45 3.64 0.32 1.86 116.57 125.76 1s9g h LYS 281 Ca -0.37 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 58.80 1s9g h LYS 281 Cb 2.05 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.88 1s9g h LYS 281 CO 0.12 0.00 -0.70 -0.07 -2.27 0.00 0.00 179.45 176.53 1s9g h LEU 282 N 0.00 0.88 -0.77 5.20 3.38 -1.62 -3.29 115.31 119.09 1s9g h LEU 282 Ca 0.54 -0.62 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1s9g h LEU 282 Cb 2.53 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 43.02 1s9g h LEU 282 CO -0.01 1.36 0.00 0.18 0.09 0.00 0.00 178.44 180.06 1s9g n LEU 283 N -4.01 0.33 -1.85 1.67 4.77 0.63 -3.86 117.00 114.69 1s9g n LEU 283 Ca -0.07 -0.17 -0.02 0.00 -0.03 0.00 0.00 56.01 55.72 1s9g n LEU 283 Cb 0.70 -0.17 -0.03 0.00 -2.33 0.00 0.00 43.42 41.60 1s9g n LEU 283 CO 0.51 0.08 0.78 -1.14 -1.33 0.00 0.00 177.39 176.29 1s9g n ARG 284 N 0.10 0.79 -1.65 3.23 0.63 -1.24 -4.73 116.66 113.79 1s9g n ARG 284 Ca 0.00 -0.18 -0.55 0.00 -0.92 0.00 0.00 57.85 56.20 1s9g n ARG 284 Cb 0.08 -1.38 -0.07 0.00 0.45 0.00 0.00 32.46 31.55 1s9g n ARG 284 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1s9g n GLY 285 N 2.00 0.66 2.19 5.14 0.00 -1.25 -4.65 105.19 109.28 1s9g n GLY 285 Ca 0.08 0.82 -0.20 0.00 0.00 0.00 0.00 46.02 46.72 1s9g n GLY 285 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1s9g n THR 286 N 3.55 3.29 -2.17 2.61 -1.04 -1.26 -4.72 114.28 114.54 1s9g n THR 286 Ca 0.22 -2.16 -0.07 0.00 -2.04 0.00 0.00 64.05 60.00 1s9g n THR 286 Cb 0.16 -1.92 -0.01 0.00 -1.82 0.00 0.00 70.33 66.73 1s9g n THR 286 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 1s9g n LYS 287 N 2.05 -0.95 -2.62 -2.82 2.85 -1.26 -4.89 118.16 110.51 1s9g n LYS 287 Ca 0.48 0.02 -0.41 0.00 -1.05 0.00 0.00 58.31 57.35 1s9g n LYS 287 Cb 0.73 -0.81 -0.03 0.00 -0.65 0.00 0.00 35.03 34.26 1s9g n LYS 287 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1s9g s ALA 288 N -1.69 2.82 0.28 0.58 0.00 -1.26 -4.93 121.76 117.57 1s9g s ALA 288 Ca 0.13 -1.95 0.06 0.00 0.00 0.00 0.00 51.96 50.20 1s9g s ALA 288 Cb -0.07 -4.33 0.80 0.00 0.00 0.00 0.00 23.12 19.52 1s9g s ALA 288 CO 0.18 -3.37 1.35 -0.11 0.00 0.00 0.00 175.76 173.81 1s9g n LEU 289 N 8.74 0.02 -0.72 0.00 7.94 -1.26 -0.50 117.00 131.21 1s9g n LEU 289 Ca 0.18 1.45 0.07 0.00 -1.11 0.00 0.00 56.01 56.60 1s9g n LEU 289 Cb 0.50 -0.58 0.22 0.00 0.53 0.00 0.00 43.42 44.09 1s9g n LEU 289 CO 0.66 -1.51 0.67 0.41 -1.11 0.00 0.00 177.39 176.51 1s9g n THR 290 N -5.15 2.23 -1.82 1.96 -1.04 -1.26 -2.01 114.28 107.18 1s9g n THR 290 Ca 0.24 -2.09 -0.42 0.00 -2.04 0.00 0.00 64.05 59.73 1s9g n THR 290 Cb 0.79 -0.26 -0.03 0.00 -1.82 0.00 0.00 70.33 69.01 1s9g n THR 290 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1s9g s GLU 291 N -2.90 3.14 0.07 -2.82 2.12 0.34 -4.74 118.70 113.90 1s9g s GLU 291 Ca 0.40 1.61 -0.31 0.00 0.36 0.00 0.00 54.97 57.04 1s9g s GLU 291 Cb 0.34 -4.30 -0.08 0.00 0.26 0.00 0.00 34.13 30.35 1s9g s GLU 291 CO 0.06 -2.09 1.59 0.08 -0.54 0.00 0.00 175.26 174.36 1s9g s VAL 292 N 7.91 3.13 -0.12 3.70 1.01 -1.26 -2.97 120.40 131.80 1s9g s VAL 292 Ca 0.88 0.61 0.01 0.00 0.00 0.00 0.00 61.98 63.48 1s9g s VAL 292 Cb -0.26 -3.39 0.02 0.00 0.00 0.00 0.00 36.38 32.75 1s9g s VAL 292 CO 0.33 0.00 -0.13 -0.63 0.00 0.00 0.00 175.10 174.68 1s9g s ILE 293 N 2.40 1.38 -0.18 2.22 1.01 0.83 -4.98 121.20 123.88 1s9g s ILE 293 Ca 0.71 -0.54 -0.29 0.00 0.00 0.00 0.00 60.65 60.53 1s9g s ILE 293 Cb -0.38 -1.30 -0.03 0.00 0.01 0.00 0.00 42.46 40.75 1s9g s ILE 293 CO 0.31 0.42 1.51 -2.16 0.00 0.00 0.00 174.94 175.03 1s9g s PRO 294 N 1.31 3.99 0.19 2.79 0.04 -1.26 -4.06 135.00 137.99 1s9g s PRO 294 Ca -0.00 1.73 -0.32 0.00 0.04 0.00 0.00 61.00 62.44 1s9g s PRO 294 Cb -0.14 -3.95 -0.15 0.00 0.04 0.00 0.00 34.50 30.30 1s9g s PRO 294 CO -0.06 -1.05 1.16 1.28 0.04 0.00 0.00 177.00 178.37 1s9g n LEU 295 N 7.68 1.64 0.00 -3.56 4.32 -1.26 -4.94 117.00 120.88 1s9g n LEU 295 Ca 0.17 1.15 -0.25 0.00 -0.02 0.00 0.00 56.01 57.05 1s9g n LEU 295 Cb 0.45 -1.24 0.18 0.00 -1.62 0.00 0.00 43.42 41.19 1s9g n LEU 295 CO 0.62 -1.27 0.75 0.35 -1.22 0.00 0.00 177.39 176.62 1s9g n THR 296 N 1.38 0.00 0.07 -5.08 -2.24 -1.26 -4.83 114.28 102.31 1s9g n THR 296 Ca 0.14 -0.82 -0.13 0.00 -2.27 0.00 0.00 64.05 60.97 1s9g n THR 296 Cb 0.26 -1.56 -0.08 0.00 -2.10 0.00 0.00 70.33 66.85 1s9g n THR 296 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1s9g h GLU 297 N 0.00 -0.12 -0.45 -0.78 3.07 -2.00 -1.79 114.58 112.51 1s9g h GLU 297 Ca -0.37 0.01 -0.10 0.00 -0.50 0.00 0.00 59.36 58.40 1s9g h GLU 297 Cb 1.02 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.95 1s9g h GLU 297 CO 0.26 0.07 -0.12 0.93 -1.40 0.00 0.00 179.01 178.75 1s9g h GLU 298 N -0.29 0.88 -0.87 2.33 3.07 -1.98 -2.03 114.58 115.69 1s9g h GLU 298 Ca -0.01 -0.34 0.16 0.00 -0.50 0.00 0.00 59.36 58.67 1s9g h GLU 298 Cb 0.25 -0.05 -0.07 0.00 -0.84 0.00 0.00 28.75 28.04 1s9g h GLU 298 CO 0.02 0.98 0.56 0.00 -1.40 0.00 0.00 179.01 179.18 1s9g h ALA 299 N 0.87 1.97 -0.39 3.43 0.00 -1.83 3.09 119.26 126.41 1s9g h ALA 299 Ca 0.11 0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.89 1s9g h ALA 299 Cb 0.66 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1s9g h ALA 299 CO 0.05 -0.22 -0.36 0.93 0.00 0.00 0.00 179.25 179.65 1s9g h GLU 300 N 0.57 0.93 -0.07 0.00 5.08 -0.70 -1.16 114.58 119.23 1s9g h GLU 300 Ca 0.44 -0.48 -0.07 0.00 -1.00 0.00 0.00 59.36 58.25 1s9g h GLU 300 Cb 0.86 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.12 1s9g h GLU 300 CO -0.19 1.14 -0.23 1.25 -1.00 0.00 0.00 179.01 179.98 1s9g h LEU 301 N 0.75 0.32 0.03 1.33 5.85 0.00 -2.80 115.31 120.80 1s9g h LEU 301 Ca 0.06 -0.62 0.03 0.00 0.84 0.00 0.00 57.88 58.19 1s9g h LEU 301 Cb 0.95 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.84 1s9g h LEU 301 CO 0.09 0.88 -0.43 -0.08 -0.34 0.00 0.00 178.44 178.56 1s9g h GLU 302 N -0.22 -0.59 -0.52 1.25 4.81 0.55 0.11 114.58 119.97 1s9g h GLU 302 Ca -0.01 0.04 0.15 0.00 -0.13 0.00 0.00 59.36 59.41 1s9g h GLU 302 Cb 0.86 0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.35 1s9g h GLU 302 CO 0.05 -0.39 0.39 1.25 -0.73 0.00 0.00 179.01 179.58 1s9g h LEU 303 N -0.61 0.00 0.23 1.64 5.85 -1.28 -2.46 115.31 118.68 1s9g h LEU 303 Ca 0.04 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 1s9g h LEU 303 Cb 0.67 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.70 1s9g h LEU 303 CO -0.30 0.00 -0.11 0.00 -0.34 0.00 0.00 178.44 177.68 1s9g h ALA 304 N 1.70 -1.07 -1.11 1.25 0.00 -0.52 -2.48 119.26 117.03 1s9g h ALA 304 Ca 0.24 -0.07 0.32 0.00 0.00 0.00 0.00 54.91 55.41 1s9g h ALA 304 Cb 1.03 0.14 -0.12 0.00 0.00 0.00 0.00 17.79 18.84 1s9g h ALA 304 CO -0.00 -1.05 0.70 0.93 0.00 0.00 0.00 179.25 179.83 1s9g h GLU 305 N -0.31 0.29 -0.32 0.00 5.08 -1.02 0.61 114.58 118.91 1s9g h GLU 305 Ca -0.03 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1s9g h GLU 305 Cb 0.24 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 1s9g h GLU 305 CO 0.05 0.19 0.05 -0.91 -1.00 0.00 0.00 179.01 177.39 1s9g h ASN 306 N 0.30 0.44 0.11 1.42 2.35 -1.25 -1.28 115.58 117.67 1s9g h ASN 306 Ca 0.69 -0.06 -0.01 0.00 -0.55 0.00 0.00 56.30 56.37 1s9g h ASN 306 Cb 1.84 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 40.09 1s9g h ASN 306 CO -0.40 0.47 -0.05 0.03 -1.65 0.00 0.00 177.43 175.83 1s9g h ARG 307 N 0.47 -0.14 -1.00 0.81 3.08 0.67 0.16 114.38 118.42 1s9g h ARG 307 Ca 0.11 0.01 0.27 0.00 0.07 0.00 0.00 59.98 60.44 1s9g h ARG 307 Cb 0.23 0.03 -0.13 0.00 0.08 0.00 0.00 29.97 30.18 1s9g h ARG 307 CO 0.00 0.28 0.59 1.49 -1.07 0.00 0.00 179.97 181.26 1s9g h GLU 308 N -0.60 0.49 -0.04 0.04 4.57 -0.96 0.14 114.58 118.22 1s9g h GLU 308 Ca -0.01 -0.03 -0.04 0.00 -1.18 0.00 0.00 59.36 58.09 1s9g h GLU 308 Cb 0.48 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 28.96 1s9g h GLU 308 CO 0.02 0.32 -0.14 0.82 -1.18 0.00 0.00 179.01 178.85 1s9g h ILE 309 N 0.50 1.47 -0.27 2.32 2.04 -1.06 -3.37 117.51 119.15 1s9g h ILE 309 Ca 0.67 -1.59 -0.13 0.00 1.00 0.00 0.00 64.86 64.81 1s9g h ILE 309 Cb 1.37 2.42 -0.01 0.00 -0.74 0.00 0.00 36.82 39.85 1s9g h ILE 309 CO -0.51 0.44 -0.38 -0.07 0.00 0.00 0.00 178.15 177.62 1s9g h LEU 310 N -0.40 0.65 -0.52 1.44 3.38 0.10 -3.33 115.31 116.63 1s9g h LEU 310 Ca -0.01 -0.28 0.10 0.00 0.09 0.00 0.00 57.88 57.78 1s9g h LEU 310 Cb 0.79 -0.18 -0.11 0.00 0.09 0.00 0.00 40.66 41.25 1s9g h LEU 310 CO 0.03 0.97 -0.23 0.50 0.09 0.00 0.00 178.44 179.80 1s9g h LYS 311 N 0.51 -0.10 -6.49 1.13 1.63 -0.96 -3.38 116.57 108.91 1s9g h LYS 311 Ca 0.05 0.01 -0.55 0.00 -0.85 0.00 0.00 60.65 59.31 1s9g h LYS 311 Cb 0.89 0.02 -0.08 0.00 -0.60 0.00 0.00 32.23 32.47 1s9g h LYS 311 CO 0.08 -0.07 1.01 -2.00 -3.45 0.00 0.00 179.45 175.01 1s9g s GLU 312 N -6.13 3.39 0.09 1.90 2.56 -1.25 -5.01 118.70 114.25 1s9g s GLU 312 Ca -0.14 0.05 -0.36 0.00 0.00 0.00 0.00 54.97 54.52 1s9g s GLU 312 Cb 0.16 -4.08 -0.16 0.00 2.00 0.00 0.00 34.13 32.06 1s9g s GLU 312 CO 0.71 -1.86 1.41 -0.35 -0.56 0.00 0.00 175.26 174.61 1s9g n PRO 313 N 8.79 1.40 -4.82 4.30 -0.04 -1.26 -5.00 135.00 138.37 1s9g n PRO 313 Ca 0.06 0.50 -0.25 0.00 -0.04 0.00 0.00 63.50 63.77 1s9g n PRO 313 Cb 0.49 -2.18 -0.16 0.00 -0.04 0.00 0.00 33.50 31.61 1s9g n PRO 313 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1s9g s VAL 314 N 0.69 1.39 0.40 0.52 1.01 -1.26 -5.15 120.40 118.00 1s9g s VAL 314 Ca 0.83 -0.72 0.08 0.00 0.00 0.00 0.00 61.98 62.17 1s9g s VAL 314 Cb -0.89 -1.19 -0.07 0.00 0.00 0.00 0.00 36.38 34.24 1s9g s VAL 314 CO 0.45 0.40 0.06 -1.00 0.00 0.00 0.00 175.10 175.01 1s9g s HIS 315 N -0.12 2.55 0.04 5.22 3.76 -1.26 -4.82 115.29 120.66 1s9g s HIS 315 Ca -0.00 -0.59 0.05 0.00 -0.15 0.00 0.00 55.06 54.36 1s9g s HIS 315 Cb -0.10 -1.77 -0.02 0.00 1.11 0.00 0.00 32.58 31.80 1s9g s HIS 315 CO 0.01 0.37 -0.14 0.20 -0.85 0.00 0.00 174.74 174.33 1s9g s GLY 316 N -3.77 0.81 0.71 -2.22 0.00 0.54 -4.47 107.32 98.91 1s9g s GLY 316 Ca 0.37 -0.85 0.02 0.00 0.00 0.00 0.00 44.72 44.26 1s9g s GLY 316 CO 0.20 -0.82 0.97 1.55 0.00 0.00 0.00 173.10 174.99 1s9g n VAL 317 N 1.85 0.00 -3.19 1.40 3.14 0.13 -0.40 118.33 121.26 1s9g n VAL 317 Ca -0.18 -1.65 -0.14 0.00 -2.96 0.00 0.00 64.34 59.41 1s9g n VAL 317 Cb 0.55 -0.82 0.04 0.00 -1.06 0.00 0.00 33.84 32.54 1s9g n VAL 317 CO 0.00 0.00 0.00 -1.22 -6.46 0.00 0.00 176.83 169.15 1s9g n TYR 318 N -2.76 -2.17 -3.53 1.45 0.53 -1.26 -4.61 117.16 104.80 1s9g n TYR 318 Ca 0.17 -1.44 -0.36 0.00 -1.02 0.00 0.00 57.90 55.24 1s9g n TYR 318 Cb 0.60 -0.35 -0.07 0.00 -1.03 0.00 0.00 39.34 38.48 1s9g n TYR 318 CO 0.00 0.00 0.00 -0.47 -1.02 0.00 0.00 176.86 175.37 1s9g s TYR 319 N -1.49 3.47 -0.36 -0.72 5.04 -0.13 -4.79 117.35 118.38 1s9g s TYR 319 Ca 0.36 0.62 0.04 0.00 -2.44 0.00 0.00 57.07 55.64 1s9g s TYR 319 Cb -0.03 -2.34 0.10 0.00 0.35 0.00 0.00 41.96 40.04 1s9g s TYR 319 CO 0.23 0.25 0.08 0.34 -1.34 0.00 0.00 175.55 175.11 1s9g s ASP 320 N 0.41 4.74 0.33 4.32 2.15 -1.26 -1.07 116.67 126.28 1s9g s ASP 320 Ca 0.17 -2.25 0.11 0.00 0.43 0.00 0.00 52.55 51.02 1s9g s ASP 320 Cb -0.13 -1.64 0.99 0.00 -0.30 0.00 0.00 42.92 41.84 1s9g s ASP 320 CO 0.04 -0.37 1.66 1.55 -0.17 0.00 0.00 175.17 177.89 1s9g h PRO 321 N 7.51 0.31 0.00 4.34 0.13 -1.96 0.96 132.00 143.28 1s9g h PRO 321 Ca -0.05 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 1s9g h PRO 321 Cb 1.01 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.07 1s9g h PRO 321 CO 0.54 0.20 0.00 -1.13 -0.23 0.00 0.00 178.00 177.38 1s9g n SER 322 N -5.08 0.21 -4.74 1.44 3.41 -1.26 -4.70 113.62 102.89 1s9g n SER 322 Ca 0.29 0.59 -0.23 0.00 -0.26 0.00 0.00 58.87 59.26 1s9g n SER 322 Cb 0.90 -0.62 -0.06 0.00 -0.26 0.00 0.00 64.21 64.17 1s9g n SER 322 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1s9g s LYS 323 N -3.19 2.32 0.99 4.33 1.02 0.33 -5.13 119.74 120.42 1s9g s LYS 323 Ca -0.00 -1.66 -0.17 0.00 0.02 0.00 0.00 55.97 54.16 1s9g s LYS 323 Cb 0.03 -2.12 0.25 0.00 -0.52 0.00 0.00 37.83 35.48 1s9g s LYS 323 CO 0.10 0.00 0.68 -0.25 -0.92 0.00 0.00 175.35 174.96 1s9g n ASP 324 N -1.21 -2.92 -3.57 2.83 8.00 -1.26 -4.92 116.55 113.50 1s9g n ASP 324 Ca -0.02 -0.76 -0.28 0.00 0.71 0.00 0.00 54.79 54.44 1s9g n ASP 324 Cb 0.62 -0.72 -0.16 0.00 -0.02 0.00 0.00 41.12 40.85 1s9g n ASP 324 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1s9g s LEU 325 N 0.00 0.48 0.15 0.64 2.96 -1.26 -4.54 118.68 117.11 1s9g s LEU 325 Ca 0.49 -1.01 0.06 0.00 -0.22 0.00 0.00 54.13 53.46 1s9g s LEU 325 Cb -0.07 -0.31 -0.04 0.00 0.50 0.00 0.00 46.19 46.27 1s9g s LEU 325 CO 0.40 -0.40 0.01 -0.63 -1.32 0.00 0.00 176.35 174.41 1s9g s ILE 326 N 2.11 3.88 -0.00 6.68 1.09 0.10 -0.33 121.20 134.73 1s9g s ILE 326 Ca 0.06 -1.27 0.01 0.00 -1.10 0.00 0.00 60.65 58.34 1s9g s ILE 326 Cb -0.16 -2.93 0.00 0.00 -1.06 0.00 0.00 42.46 38.31 1s9g s ILE 326 CO -0.25 -0.05 -0.02 0.00 -0.10 0.00 0.00 174.94 174.52 1s9g s ALA 327 N -1.62 0.21 0.01 9.38 0.00 0.90 0.51 121.76 131.16 1s9g s ALA 327 Ca 0.27 -0.08 0.03 0.00 0.00 0.00 0.00 51.96 52.18 1s9g s ALA 327 Cb -0.10 -0.07 -0.01 0.00 0.00 0.00 0.00 23.12 22.93 1s9g s ALA 327 CO 0.19 0.04 -0.08 -1.21 0.00 0.00 0.00 175.76 174.69 1s9g s GLU 328 N 0.04 0.62 0.09 0.00 2.02 -0.50 -0.30 118.70 120.66 1s9g s GLU 328 Ca -0.00 -0.47 0.07 0.00 0.02 0.00 0.00 54.97 54.59 1s9g s GLU 328 Cb -0.02 -0.55 -0.03 0.00 0.10 0.00 0.00 34.13 33.63 1s9g s GLU 328 CO -0.00 0.14 -0.18 0.42 0.02 0.00 0.00 175.26 175.65 1s9g s ILE 329 N -0.59 1.48 -0.13 -1.63 1.01 -1.21 -1.97 121.20 118.16 1s9g s ILE 329 Ca -0.01 -1.42 -0.07 0.00 0.00 0.00 0.00 60.65 59.15 1s9g s ILE 329 Cb -0.05 -1.37 0.05 0.00 0.01 0.00 0.00 42.46 41.10 1s9g s ILE 329 CO 0.00 -0.10 0.31 0.00 0.00 0.00 0.00 174.94 175.15 1s9g s GLN 330 N -1.78 0.28 0.05 2.79 0.00 -0.71 -4.39 119.66 115.90 1s9g s GLN 330 Ca 0.03 0.61 -0.30 0.00 -0.00 0.00 0.00 55.36 55.70 1s9g s GLN 330 Cb -0.10 -0.06 -0.05 0.00 0.00 0.00 0.00 33.01 32.80 1s9g s GLN 330 CO 0.03 -0.15 1.20 0.21 0.00 0.00 0.00 175.29 176.58 1s9g s LYS 331 N 1.21 4.42 -0.09 9.60 2.20 -1.26 -2.47 119.74 133.35 1s9g s LYS 331 Ca -0.09 1.76 -0.03 0.00 -0.36 0.00 0.00 55.97 57.25 1s9g s LYS 331 Cb -0.09 -3.37 -0.01 0.00 -1.51 0.00 0.00 37.83 32.84 1s9g s LYS 331 CO -0.09 -0.28 -0.06 1.96 -0.36 0.00 0.00 175.35 176.52 1s9g h GLN 332 N 6.89 0.00 0.00 4.03 4.20 -1.53 -3.42 115.11 125.29 1s9g h GLN 332 Ca -0.41 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.30 1s9g h GLN 332 Cb 1.21 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.99 1s9g h GLN 332 CO 0.82 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 179.39 1s9g n GLY 333 N 1.75 0.82 1.86 3.46 0.00 -1.09 -4.97 105.19 107.02 1s9g n GLY 333 Ca -0.03 0.06 -0.15 0.00 0.00 0.00 0.00 46.02 45.91 1s9g n GLY 333 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1s9g n GLN 334 N 0.00 1.72 -0.27 1.61 1.13 -1.26 -4.51 117.38 115.80 1s9g n GLN 334 Ca 0.00 -1.38 0.00 0.00 -1.94 0.00 0.00 57.00 53.68 1s9g n GLN 334 Cb 0.00 -1.55 0.00 0.00 0.11 0.00 0.00 30.24 28.80 1s9g n GLN 334 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1s9g n GLY 335 N 0.51 0.86 3.86 1.08 0.00 -1.26 -4.96 105.19 105.28 1s9g n GLY 335 Ca 0.27 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.94 1s9g n GLY 335 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1s9g s GLN 336 N -0.73 3.36 0.02 1.61 -0.21 -1.26 -2.54 119.66 119.90 1s9g s GLN 336 Ca 0.00 -0.27 -0.01 0.00 0.02 0.00 0.00 55.36 55.10 1s9g s GLN 336 Cb 0.00 -3.08 -0.02 0.00 1.00 0.00 0.00 33.01 30.91 1s9g s GLN 336 CO 0.00 0.72 0.00 -1.58 -2.12 0.00 0.00 175.29 172.31 1s9g s TRP 337 N -1.15 0.21 0.04 0.91 0.52 0.30 -1.25 118.94 118.52 1s9g s TRP 337 Ca 0.21 -0.44 0.01 0.00 0.02 0.00 0.00 56.10 55.89 1s9g s TRP 337 Cb -0.12 -0.16 -0.03 0.00 -1.15 0.00 0.00 33.47 32.01 1s9g s TRP 337 CO 0.11 -0.20 -0.05 -0.08 0.02 0.00 0.00 176.95 176.74 1s9g s THR 338 N -1.40 0.33 0.05 2.01 -1.32 -1.03 -0.73 115.64 113.54 1s9g s THR 338 Ca -0.15 -1.16 -0.12 0.00 -1.21 0.00 0.00 61.69 59.05 1s9g s THR 338 Cb -0.09 -0.65 0.01 0.00 -1.51 0.00 0.00 72.50 70.26 1s9g s THR 338 CO -0.01 -0.54 0.27 -0.72 -2.21 0.00 0.00 174.62 171.41 1s9g s TYR 339 N -1.88 -0.04 0.02 9.09 1.13 0.17 -1.73 117.35 124.10 1s9g s TYR 339 Ca -0.09 -0.14 0.02 0.00 -1.41 0.00 0.00 57.07 55.44 1s9g s TYR 339 Cb -0.07 0.05 -0.01 0.00 -1.10 0.00 0.00 41.96 40.83 1s9g s TYR 339 CO -0.02 -0.49 -0.06 1.14 -2.51 0.00 0.00 175.55 173.61 1s9g s GLN 340 N -2.69 0.44 -0.11 -3.49 0.00 -0.83 0.66 119.66 113.63 1s9g s GLN 340 Ca -0.04 -0.46 0.02 0.00 -0.00 0.00 0.00 55.36 54.88 1s9g s GLN 340 Cb -0.00 -0.30 -0.01 0.00 0.00 0.00 0.00 33.01 32.70 1s9g s GLN 340 CO -0.04 0.07 -0.18 0.42 0.00 0.00 0.00 175.29 175.55 1s9g s ILE 341 N -0.77 2.61 0.17 3.63 1.01 0.26 -1.41 121.20 126.70 1s9g s ILE 341 Ca -0.05 -0.83 -0.10 0.00 0.00 0.00 0.00 60.65 59.68 1s9g s ILE 341 Cb -0.06 -2.05 -0.00 0.00 0.01 0.00 0.00 42.46 40.35 1s9g s ILE 341 CO 0.00 0.54 0.32 -0.72 0.00 0.00 0.00 174.94 175.08 1s9g s TYR 342 N 0.27 0.34 -0.08 3.97 -0.85 0.18 -1.16 117.35 120.03 1s9g s TYR 342 Ca -0.13 -0.70 -0.00 0.00 -0.52 0.00 0.00 57.07 55.71 1s9g s TYR 342 Cb -0.16 -0.00 -0.05 0.00 0.38 0.00 0.00 41.96 42.13 1s9g s TYR 342 CO 0.07 -0.75 -0.08 1.04 -1.52 0.00 0.00 175.55 174.31 1s9g n GLN 343 N -0.24 0.19 -3.57 -3.49 6.02 -1.26 0.02 117.38 115.06 1s9g n GLN 343 Ca -0.07 0.05 -0.20 0.00 -0.01 0.00 0.00 57.00 56.76 1s9g n GLN 343 Cb 0.63 -1.10 -0.03 0.00 1.02 0.00 0.00 30.24 30.77 1s9g n GLN 343 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1s9g s GLU 344 N -2.16 2.62 0.05 -1.09 0.41 -1.26 -4.80 118.70 112.47 1s9g s GLU 344 Ca -0.11 -1.44 -0.22 0.00 -0.41 0.00 0.00 54.97 52.79 1s9g s GLU 344 Cb 0.03 -2.45 -0.14 0.00 -1.78 0.00 0.00 34.13 29.79 1s9g s GLU 344 CO 0.18 -0.13 1.50 -1.35 -0.49 0.00 0.00 175.26 174.97 1s9g h PRO 345 N 1.04 0.16 0.00 0.39 0.11 -2.03 -3.41 132.00 128.26 1s9g h PRO 345 Ca -0.42 -0.05 -0.31 0.00 0.11 0.00 0.00 66.00 65.34 1s9g h PRO 345 Cb 1.26 -0.02 -0.06 0.00 0.11 0.00 0.00 31.00 32.30 1s9g h PRO 345 CO 0.56 0.39 -2.15 1.19 -0.21 0.00 0.00 178.00 177.78 1s9g n PHE 346 N -4.85 0.00 -3.40 0.65 3.01 -1.26 -4.93 117.46 106.69 1s9g n PHE 346 Ca -0.06 0.00 -0.37 0.00 1.01 0.00 0.00 57.45 58.02 1s9g n PHE 346 Cb 0.18 -0.80 -0.06 0.00 -0.01 0.00 0.00 39.48 38.79 1s9g n PHE 346 CO 0.00 0.00 0.00 0.21 1.01 0.00 0.00 176.76 177.98 1s9g s LYS 347 N -2.41 4.27 0.67 -1.08 2.47 -1.26 -5.07 119.74 117.34 1s9g s LYS 347 Ca -0.21 0.35 -0.07 0.00 -1.56 0.00 0.00 55.97 54.49 1s9g s LYS 347 Cb 0.06 -3.41 0.04 0.00 -1.46 0.00 0.00 37.83 33.07 1s9g s LYS 347 CO 0.54 0.24 0.99 -0.80 0.16 0.00 0.00 175.35 176.48 1s9g s ASN 348 N 0.38 5.05 -0.22 1.43 0.01 -1.26 -4.49 114.94 115.84 1s9g s ASN 348 Ca 0.23 0.55 0.01 0.00 -0.71 0.00 0.00 52.86 52.94 1s9g s ASN 348 Cb -0.15 -1.30 -0.20 0.00 0.41 0.00 0.00 41.25 40.02 1s9g s ASN 348 CO 0.09 -1.44 -0.05 -0.11 -1.51 0.00 0.00 177.10 174.07 1s9g n LEU 349 N -2.83 2.65 -3.62 0.60 7.94 -0.31 0.17 117.00 121.60 1s9g n LEU 349 Ca 0.07 -0.04 -0.02 0.00 -1.11 0.00 0.00 56.01 54.91 1s9g n LEU 349 Cb 0.60 -0.84 -0.02 0.00 0.53 0.00 0.00 43.42 43.69 1s9g n LEU 349 CO 0.52 0.88 1.10 -0.75 -1.11 0.00 0.00 177.39 178.04 1s9g s LYS 350 N -2.53 0.18 0.25 1.96 2.20 -1.16 -4.39 119.74 116.25 1s9g s LYS 350 Ca -0.30 -0.07 0.04 0.00 -0.36 0.00 0.00 55.97 55.28 1s9g s LYS 350 Cb 0.08 0.08 -0.02 0.00 -1.51 0.00 0.00 37.83 36.46 1s9g s LYS 350 CO 0.66 -0.08 0.15 0.25 -0.36 0.00 0.00 175.35 175.97 1s9g n THR 351 N -0.13 0.00 -0.20 3.43 -2.24 1.41 -0.57 114.28 115.98 1s9g n THR 351 Ca 0.01 -1.64 0.00 0.00 -2.27 0.00 0.00 64.05 60.15 1s9g n THR 351 Cb 0.58 0.71 0.00 0.00 -2.10 0.00 0.00 70.33 69.53 1s9g n THR 351 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1s9g n GLY 352 N -0.15 -1.68 3.26 3.38 0.00 0.21 -4.08 105.19 106.13 1s9g n GLY 352 Ca 0.01 -1.11 -0.16 0.00 0.00 0.00 0.00 46.02 44.76 1s9g n GLY 352 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1s9g s LYS 353 N -1.92 1.48 -0.26 1.61 -2.85 -1.26 0.43 119.74 116.97 1s9g s LYS 353 Ca 0.00 -1.83 -0.21 0.00 -1.00 0.00 0.00 55.97 52.93 1s9g s LYS 353 Cb 0.00 0.18 0.07 0.00 -2.06 0.00 0.00 37.83 36.02 1s9g s LYS 353 CO 0.00 -0.49 0.69 -0.47 0.10 0.00 0.00 175.35 175.18 1s9g s TYR 354 N -3.78 -0.85 -0.00 1.78 5.04 0.09 -4.92 117.35 114.70 1s9g s TYR 354 Ca 0.39 1.93 -0.03 0.00 -2.44 0.00 0.00 57.07 56.91 1s9g s TYR 354 Cb 0.05 0.37 -0.00 0.00 0.35 0.00 0.00 41.96 42.73 1s9g s TYR 354 CO 0.18 -0.41 0.06 0.00 -1.34 0.00 0.00 175.55 174.04 1s9g s ALA 355 N 0.77 -0.13 -0.37 3.97 0.00 -1.26 -0.54 121.76 124.20 1s9g s ALA 355 Ca -0.03 -0.13 -0.28 0.00 0.00 0.00 0.00 51.96 51.51 1s9g s ALA 355 Cb -0.05 0.03 -0.02 0.00 0.00 0.00 0.00 23.12 23.08 1s9g s ALA 355 CO -0.06 -0.12 1.84 0.50 0.00 0.00 0.00 175.76 177.92 1s9g s ARG 356 N -0.83 3.19 -0.08 0.00 6.06 -1.05 -4.88 118.95 121.36 1s9g s ARG 356 Ca -0.09 1.33 -0.34 0.00 -2.50 0.00 0.00 55.73 54.12 1s9g s ARG 356 Cb -0.06 -4.24 -0.12 0.00 0.06 0.00 0.00 34.95 30.59 1s9g s ARG 356 CO 0.00 -2.03 1.85 -1.33 -2.50 0.00 0.00 175.30 171.29 1s9g n MET 357 N 8.56 2.12 0.00 5.12 2.81 -1.26 -4.59 117.12 129.88 1s9g n MET 357 Ca 0.23 0.77 0.00 0.00 -1.81 0.00 0.00 57.70 56.90 1s9g n MET 357 Cb 0.48 -2.60 0.00 0.00 -0.71 0.00 0.00 33.22 30.38 1s9g n MET 357 CO 0.00 0.00 0.00 2.89 1.51 0.00 0.00 175.97 180.37 1s9g n ARG 358 N 6.30 0.00 -3.47 0.03 1.85 -1.26 -4.94 116.66 115.18 1s9g n ARG 358 Ca 0.22 0.00 0.01 0.00 -1.00 0.00 0.00 57.85 57.08 1s9g n ARG 358 Cb 0.28 0.00 -0.04 0.00 -1.05 0.00 0.00 32.46 31.65 1s9g n ARG 358 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 1s9g s GLY 359 N 0.00 -0.32 0.00 2.89 0.00 -1.26 -5.06 107.32 103.57 1s9g s GLY 359 Ca 0.00 2.87 0.00 0.00 0.00 0.00 0.00 44.72 47.59 1s9g s GLY 359 CO 0.00 3.17 0.57 0.00 0.00 0.00 0.00 173.10 176.84 1s9g n ALA 360 N 5.06 1.06 -3.29 3.20 0.00 -1.26 -4.69 120.51 120.59 1s9g n ALA 360 Ca -0.10 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.21 1s9g n ALA 360 Cb 0.52 -0.80 -0.10 0.00 0.00 0.00 0.00 19.45 19.07 1s9g n ALA 360 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1s9g s HIS 361 N -2.13 -0.42 0.00 0.00 3.76 -1.26 -4.78 115.29 110.45 1s9g s HIS 361 Ca 0.00 1.02 0.00 0.00 -0.15 0.00 0.00 55.06 55.93 1s9g s HIS 361 Cb 0.00 0.15 0.00 0.00 1.11 0.00 0.00 32.58 33.84 1s9g s HIS 361 CO 0.00 -0.23 0.00 2.41 -0.85 0.00 0.00 174.74 176.07 1s9g n THR 362 N 2.74 0.00 -4.16 1.30 -1.04 -1.26 -5.10 114.28 106.76 1s9g n THR 362 Ca -0.14 0.00 -0.23 0.00 -2.04 0.00 0.00 64.05 61.64 1s9g n THR 362 Cb 0.57 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 69.03 1s9g n THR 362 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1s9g s ASN 363 N 0.00 5.23 0.20 8.00 3.84 -1.26 -3.73 114.94 127.22 1s9g s ASN 363 Ca 0.00 -0.33 -0.11 0.00 0.21 0.00 0.00 52.86 52.63 1s9g s ASN 363 Cb 0.00 -1.25 0.14 0.00 -0.55 0.00 0.00 41.25 39.59 1s9g s ASN 363 CO 0.00 0.00 1.86 0.44 -2.79 0.00 0.00 177.10 176.61 1s9g h ASP 364 N 1.84 0.83 -0.65 -4.21 3.32 -1.94 0.15 116.42 115.77 1s9g h ASP 364 Ca -0.47 -0.04 -0.07 0.00 0.02 0.00 0.00 57.03 56.47 1s9g h ASP 364 Cb 1.23 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 40.55 1s9g h ASP 364 CO 0.61 0.62 0.15 0.58 -1.72 0.00 0.00 179.24 179.48 1s9g h VAL 365 N 0.97 1.26 0.09 -1.35 2.07 -1.96 0.37 116.25 117.69 1s9g h VAL 365 Ca 0.26 -0.96 -0.00 0.00 0.82 0.00 0.00 66.70 66.82 1s9g h VAL 365 Cb -0.08 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 1s9g h VAL 365 CO -0.05 0.36 -0.04 0.50 0.02 0.00 0.00 177.57 178.35 1s9g h LYS 366 N 0.97 -0.12 -0.79 1.57 3.64 -1.88 -1.63 116.57 118.33 1s9g h LYS 366 Ca 0.20 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.65 1s9g h LYS 366 Cb 0.38 0.03 -0.06 0.00 -0.41 0.00 0.00 32.23 32.17 1s9g h LYS 366 CO 0.00 0.04 0.48 1.96 -2.27 0.00 0.00 179.45 179.66 1s9g h GLN 367 N -0.26 0.84 0.00 1.90 4.20 -0.50 -0.73 115.11 120.55 1s9g h GLN 367 Ca -0.01 -0.05 -0.06 0.00 0.06 0.00 0.00 58.65 58.59 1s9g h GLN 367 Cb 0.22 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 1s9g h GLN 367 CO 0.02 0.56 -0.26 1.25 -0.67 0.00 0.00 178.83 179.73 1s9g h LEU 368 N 0.87 0.00 0.11 1.46 5.85 0.09 -0.99 115.31 122.70 1s9g h LEU 368 Ca 0.35 0.00 -0.29 0.00 0.84 0.00 0.00 57.88 58.78 1s9g h LEU 368 Cb 0.18 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.22 1s9g h LEU 368 CO -0.17 0.26 -1.25 0.74 -0.34 0.00 0.00 178.44 177.67 1s9g h THR 369 N 0.00 1.39 -0.77 1.05 2.02 -0.30 -0.96 112.91 115.33 1s9g h THR 369 Ca -0.00 -2.75 0.02 0.00 0.77 0.00 0.00 66.41 64.45 1s9g h THR 369 Cb 0.48 2.83 -0.04 0.00 -1.74 0.00 0.00 68.15 69.68 1s9g h THR 369 CO 0.03 0.82 0.51 -0.33 0.37 0.00 0.00 175.52 176.92 1s9g h GLU 370 N 0.16 0.98 0.31 6.66 5.08 -0.76 0.45 114.58 127.46 1s9g h GLU 370 Ca -0.17 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.12 1s9g h GLU 370 Cb 1.95 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 30.98 1s9g h GLU 370 CO 0.22 0.65 -0.15 0.00 -1.00 0.00 0.00 179.01 178.73 1s9g h ALA 371 N 1.53 -0.42 -0.90 3.43 0.00 -1.07 -1.34 119.26 120.49 1s9g h ALA 371 Ca 0.29 -0.14 0.16 0.00 0.00 0.00 0.00 54.91 55.22 1s9g h ALA 371 Cb -0.05 0.16 -0.07 0.00 0.00 0.00 0.00 17.79 17.83 1s9g h ALA 371 CO -0.07 -0.67 0.58 0.28 0.00 0.00 0.00 179.25 179.37 1s9g h VAL 372 N -0.56 0.80 0.14 0.00 2.07 -0.56 -1.28 116.25 116.86 1s9g h VAL 372 Ca -0.04 -0.22 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 1s9g h VAL 372 Cb 0.41 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.28 1s9g h VAL 372 CO 0.07 0.12 -0.07 -0.61 0.02 0.00 0.00 177.57 177.10 1s9g h GLN 373 N 0.65 -0.18 -0.25 1.57 5.75 0.53 -1.93 115.11 121.24 1s9g h GLN 373 Ca 0.46 0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.95 1s9g h GLN 373 Cb 0.80 0.04 -0.01 0.00 1.07 0.00 0.00 27.48 29.38 1s9g h GLN 373 CO -0.21 -0.07 0.05 -0.22 -2.65 0.00 0.00 178.83 175.72 1s9g h LYS 374 N -0.24 0.36 -0.02 1.69 3.64 -0.53 -1.81 116.57 119.67 1s9g h LYS 374 Ca -0.02 -0.05 -0.14 0.00 -1.27 0.00 0.00 60.65 59.17 1s9g h LYS 374 Cb 0.19 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.92 1s9g h LYS 374 CO 0.03 0.34 -0.64 0.82 -2.27 0.00 0.00 179.45 177.74 1s9g h ILE 375 N 0.35 1.44 -0.24 2.00 2.04 -0.96 -1.64 117.51 120.49 1s9g h ILE 375 Ca 0.09 -2.14 -0.08 0.00 1.00 0.00 0.00 64.86 63.72 1s9g h ILE 375 Cb 0.16 2.14 -0.01 0.00 -0.74 0.00 0.00 36.82 38.37 1s9g h ILE 375 CO -0.00 0.62 -0.16 0.74 0.00 0.00 0.00 178.15 179.34 1s9g h THR 376 N 0.06 1.31 -0.49 -0.27 2.02 -0.56 0.33 112.91 115.30 1s9g h THR 376 Ca -0.01 -1.28 -0.10 0.00 0.77 0.00 0.00 66.41 65.79 1s9g h THR 376 Cb 1.14 1.61 -0.02 0.00 -1.74 0.00 0.00 68.15 69.15 1s9g h THR 376 CO 0.09 0.40 -0.08 0.74 0.37 0.00 0.00 175.52 177.04 1s9g h THR 377 N 0.25 1.26 -0.32 3.16 2.02 -1.33 -0.98 112.91 116.97 1s9g h THR 377 Ca 0.05 -1.18 -0.05 0.00 0.77 0.00 0.00 66.41 66.00 1s9g h THR 377 Cb 0.69 0.97 -0.01 0.00 -1.74 0.00 0.00 68.15 68.05 1s9g h THR 377 CO 0.04 0.41 0.01 -0.08 0.37 0.00 0.00 175.52 176.28 1s9g h GLU 378 N 0.81 0.56 -0.38 6.66 4.81 -1.04 -1.97 114.58 124.03 1s9g h GLU 378 Ca 0.14 -0.17 0.02 0.00 -0.13 0.00 0.00 59.36 59.22 1s9g h GLU 378 Cb 0.59 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.89 1s9g h GLU 378 CO 0.04 0.68 0.21 0.77 -0.73 0.00 0.00 179.01 179.98 1s9g h SER 379 N 0.37 0.33 -0.59 1.04 0.02 -0.11 0.16 113.55 114.77 1s9g h SER 379 Ca 0.09 0.01 0.02 0.00 -0.84 0.00 0.00 61.79 61.07 1s9g h SER 379 Cb 0.42 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 62.88 1s9g h SER 379 CO 0.01 0.24 0.39 0.40 -1.14 0.00 0.00 176.83 176.73 1s9g h ILE 380 N 0.43 1.12 -0.00 3.27 2.04 -1.01 0.33 117.51 123.68 1s9g h ILE 380 Ca 0.16 -0.26 -0.19 0.00 1.00 0.00 0.00 64.86 65.56 1s9g h ILE 380 Cb 0.03 0.30 0.02 0.00 -0.74 0.00 0.00 36.82 36.43 1s9g h ILE 380 CO -0.09 0.14 -0.76 0.58 0.00 0.00 0.00 178.15 178.02 1s9g h VAL 381 N 0.75 1.37 -0.01 1.67 2.07 -0.76 -2.57 116.25 118.78 1s9g h VAL 381 Ca 0.23 -2.13 -0.04 0.00 0.82 0.00 0.00 66.70 65.57 1s9g h VAL 381 Cb -0.01 2.51 0.00 0.00 -1.52 0.00 0.00 31.29 32.27 1s9g h VAL 381 CO -0.06 0.64 -0.17 0.40 0.02 0.00 0.00 177.57 178.40 1s9g h ILE 382 N 0.08 1.56 0.00 4.57 2.04 -0.52 -3.40 117.51 121.83 1s9g h ILE 382 Ca -0.09 -1.87 0.00 0.00 1.00 0.00 0.00 64.86 63.89 1s9g h ILE 382 Cb 1.45 2.75 0.00 0.00 -0.74 0.00 0.00 36.82 40.28 1s9g h ILE 382 CO 0.15 0.51 -1.04 0.79 0.00 0.00 0.00 178.15 178.56 1s9g n TRP 383 N -4.58 0.00 -1.15 1.37 8.01 0.11 -4.67 117.44 116.53 1s9g n TRP 383 Ca -0.09 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.10 1s9g n TRP 383 Cb 0.46 -0.12 0.00 0.00 -2.01 0.00 0.00 31.31 29.64 1s9g n TRP 383 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1s9g n GLY 384 N 1.79 0.58 3.55 6.99 0.00 -0.73 -4.99 105.19 112.38 1s9g n GLY 384 Ca -0.01 -0.81 -0.13 0.00 0.00 0.00 0.00 46.02 45.08 1s9g n GLY 384 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1s9g s LYS 385 N -2.39 0.75 0.73 1.61 -2.85 -1.24 -4.92 119.74 111.43 1s9g s LYS 385 Ca 0.00 0.15 -0.11 0.00 -1.00 0.00 0.00 55.97 55.01 1s9g s LYS 385 Cb 0.00 0.35 0.03 0.00 -2.06 0.00 0.00 37.83 36.16 1s9g s LYS 385 CO 0.00 -0.24 1.07 0.95 0.10 0.00 0.00 175.35 177.23 1s9g s THR 386 N -1.26 3.70 0.48 3.79 -4.23 -1.26 -3.73 115.64 113.13 1s9g s THR 386 Ca -0.04 0.55 0.07 0.00 -1.18 0.00 0.00 61.69 61.09 1s9g s THR 386 Cb -0.00 -3.21 0.01 0.00 1.34 0.00 0.00 72.50 70.64 1s9g s THR 386 CO 0.03 -0.72 0.40 -2.16 -0.54 0.00 0.00 174.62 171.63 1s9g s PRO 387 N -5.01 2.36 -0.27 3.99 0.04 -1.26 -4.93 135.00 129.91 1s9g s PRO 387 Ca 0.59 -1.80 -0.22 0.00 0.04 0.00 0.00 61.00 59.62 1s9g s PRO 387 Cb -0.15 -2.22 -0.01 0.00 0.04 0.00 0.00 34.50 32.16 1s9g s PRO 387 CO 0.55 -0.42 0.71 0.15 0.04 0.00 0.00 177.00 178.03 1s9g s LYS 388 N -4.21 4.05 0.13 4.56 1.02 0.55 -4.81 119.74 121.04 1s9g s LYS 388 Ca 0.42 0.60 -0.18 0.00 0.02 0.00 0.00 55.97 56.83 1s9g s LYS 388 Cb -0.02 -3.68 -0.07 0.00 -0.52 0.00 0.00 37.83 33.54 1s9g s LYS 388 CO 0.25 -0.53 0.60 -0.06 -0.92 0.00 0.00 175.35 174.69 1s9g s PHE 389 N 2.71 3.70 -0.26 3.18 0.08 -1.10 -0.07 117.98 126.21 1s9g s PHE 389 Ca 0.29 1.23 0.03 0.00 0.12 0.00 0.00 56.93 58.59 1s9g s PHE 389 Cb -0.15 -2.48 0.06 0.00 -0.57 0.00 0.00 43.02 39.88 1s9g s PHE 389 CO 0.10 0.48 -0.09 0.15 -0.10 0.00 0.00 175.22 175.76 1s9g s LYS 390 N -1.61 2.06 0.08 0.44 1.02 0.59 -0.93 119.74 121.38 1s9g s LYS 390 Ca 0.35 -1.32 0.09 0.00 0.02 0.00 0.00 55.97 55.11 1s9g s LYS 390 Cb -0.17 -2.85 -0.03 0.00 -0.52 0.00 0.00 37.83 34.26 1s9g s LYS 390 CO 0.20 -0.61 -0.24 -0.51 -0.92 0.00 0.00 175.35 173.28 1s9g s LEU 391 N 1.15 2.23 0.00 3.17 1.43 -0.08 -3.29 118.68 123.28 1s9g s LEU 391 Ca -0.07 -0.63 -0.02 0.00 -1.03 0.00 0.00 54.13 52.39 1s9g s LEU 391 Cb -0.20 -1.08 -0.07 0.00 0.03 0.00 0.00 46.19 44.87 1s9g s LEU 391 CO -0.06 0.16 1.88 -0.81 0.23 0.00 0.00 176.35 177.76 1s9g n PRO 392 N 1.44 0.96 -3.88 1.29 -0.04 -1.26 -2.08 135.00 131.43 1s9g n PRO 392 Ca -0.18 -0.28 -0.11 0.00 -0.04 0.00 0.00 63.50 62.89 1s9g n PRO 392 Cb 0.53 -1.44 -0.11 0.00 -0.04 0.00 0.00 33.50 32.44 1s9g n PRO 392 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1s9g s ILE 393 N 1.04 0.06 -0.26 0.52 2.07 -1.26 -1.38 121.20 121.99 1s9g s ILE 393 Ca 0.19 -0.52 -0.13 0.00 -1.41 0.00 0.00 60.65 58.77 1s9g s ILE 393 Cb 0.09 -0.31 -0.04 0.00 0.13 0.00 0.00 42.46 42.32 1s9g s ILE 393 CO 0.00 -0.29 0.28 0.00 -1.91 0.00 0.00 174.94 173.03 1s9g s GLN 394 N -0.95 4.02 0.03 3.50 0.00 -1.26 -4.61 119.66 120.38 1s9g s GLN 394 Ca -0.10 -0.11 -0.00 0.00 -0.00 0.00 0.00 55.36 55.15 1s9g s GLN 394 Cb -0.06 -3.63 0.06 0.00 0.00 0.00 0.00 33.01 29.39 1s9g s GLN 394 CO 0.01 -0.17 0.18 1.63 0.00 0.00 0.00 175.29 176.93 1s9g n LYS 395 N 5.00 -0.01 -0.36 9.60 4.76 -1.26 0.29 118.16 136.17 1s9g n LYS 395 Ca -0.11 0.17 0.01 0.00 -2.87 0.00 0.00 58.31 55.51 1s9g n LYS 395 Cb 0.51 -0.26 0.16 0.00 -1.84 0.00 0.00 35.03 33.60 1s9g n LYS 395 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 1s9g h GLU 396 N 0.00 1.20 0.01 1.97 4.39 -1.98 0.11 114.58 120.29 1s9g h GLU 396 Ca 0.06 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 1s9g h GLU 396 Cb 0.10 -0.27 0.00 0.00 -0.10 0.00 0.00 28.75 28.48 1s9g h GLU 396 CO -0.11 0.80 -0.00 1.15 -1.16 0.00 0.00 179.01 179.68 1s9g h THR 397 N 1.24 1.52 0.69 1.13 2.02 0.38 -2.74 112.91 117.14 1s9g h THR 397 Ca 0.40 -1.61 -0.03 0.00 0.77 0.00 0.00 66.41 65.94 1s9g h THR 397 Cb 0.03 2.60 -0.01 0.00 -1.74 0.00 0.00 68.15 69.04 1s9g h THR 397 CO -0.13 0.41 -0.50 -0.25 0.37 0.00 0.00 175.52 175.42 1s9g h TRP 398 N -0.71 -1.37 0.00 3.16 2.91 -1.25 -2.24 115.95 116.46 1s9g h TRP 398 Ca -0.00 -0.00 -0.00 0.00 1.13 0.00 0.00 58.89 60.01 1s9g h TRP 398 Cb 0.69 0.51 -0.00 0.00 -0.51 0.00 0.00 29.16 29.84 1s9g h TRP 398 CO 0.17 -0.72 -0.01 1.49 -1.03 0.00 0.00 178.44 178.34 1s9g h GLU 399 N -1.14 0.00 0.00 2.65 4.81 -0.91 -0.10 114.58 119.89 1s9g h GLU 399 Ca -0.09 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.09 1s9g h GLU 399 Cb 0.94 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.32 1s9g h GLU 399 CO 0.04 0.01 -0.47 0.00 -0.73 0.00 0.00 179.01 177.86 1s9g h THR 400 N 0.00 0.31 0.08 0.32 1.03 -1.20 -3.04 112.91 110.41 1s9g h THR 400 Ca -0.00 -1.46 -0.16 0.00 -0.01 0.00 0.00 66.41 64.78 1s9g h THR 400 Cb 0.10 2.04 0.00 0.00 -1.07 0.00 0.00 68.15 69.23 1s9g h THR 400 CO 0.00 0.17 -0.76 -0.25 -0.01 0.00 0.00 175.52 174.68 1s9g h TRP 401 N 0.00 0.31 0.00 0.00 7.01 -0.45 -3.08 115.95 119.75 1s9g h TRP 401 Ca -0.02 -0.23 -0.01 0.00 2.11 0.00 0.00 58.89 60.74 1s9g h TRP 401 Cb 1.17 -0.01 -0.00 0.00 -2.10 0.00 0.00 29.16 28.22 1s9g h TRP 401 CO 0.00 1.29 -0.06 0.11 -2.79 0.00 0.00 178.44 176.99 1s9g h TRP 402 N -0.60 0.00 0.09 2.65 -0.00 -1.44 1.00 115.95 117.65 1s9g h TRP 402 Ca -0.16 0.00 -0.26 0.00 -0.00 0.00 0.00 58.89 58.48 1s9g h TRP 402 Cb 1.45 0.00 -0.00 0.00 -0.00 0.00 0.00 29.16 30.61 1s9g h TRP 402 CO 0.20 0.06 -1.16 1.15 -0.00 0.00 0.00 178.44 178.68 1s9g h THR 403 N 0.00 1.52 -0.00 0.12 2.02 -1.63 -3.20 112.91 111.74 1s9g h THR 403 Ca -0.00 -3.03 0.00 0.00 0.77 0.00 0.00 66.41 64.15 1s9g h THR 403 Cb 0.44 2.86 0.00 0.00 -1.74 0.00 0.00 68.15 69.71 1s9g h THR 403 CO 0.01 0.88 -0.43 -0.62 0.37 0.00 0.00 175.52 175.73 1s9g n GLU 404 N -3.54 0.23 -2.62 6.66 1.02 -0.88 -4.89 120.64 116.62 1s9g n GLU 404 Ca -0.07 -0.13 -0.41 0.00 -0.02 0.00 0.00 57.16 56.53 1s9g n GLU 404 Cb 0.98 -1.50 -0.04 0.00 -0.02 0.00 0.00 31.44 30.86 1s9g n GLU 404 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 1s9g s TYR 405 N -2.86 3.71 0.14 -0.32 5.04 0.29 -4.93 117.35 118.42 1s9g s TYR 405 Ca 0.15 1.69 0.23 0.00 -2.44 0.00 0.00 57.07 56.70 1s9g s TYR 405 Cb 0.18 -3.16 0.87 0.00 0.35 0.00 0.00 41.96 40.19 1s9g s TYR 405 CO 0.65 -0.20 1.81 0.11 -1.34 0.00 0.00 175.55 176.57 1s9g h TRP 406 N 5.40 0.00 -3.21 4.97 5.08 -1.90 -3.44 115.95 122.86 1s9g h TRP 406 Ca -0.43 0.00 -0.58 0.00 1.08 0.00 0.00 58.89 58.96 1s9g h TRP 406 Cb 1.21 0.00 -0.04 0.00 -3.00 0.00 0.00 29.16 27.33 1s9g h TRP 406 CO 0.64 0.26 -0.18 -1.14 -1.28 0.00 0.00 178.44 176.74 1s9g s GLN 407 N -3.65 3.84 0.28 0.12 0.74 -1.26 -5.07 119.66 114.66 1s9g s GLN 407 Ca 0.00 0.30 -0.26 0.00 0.05 0.00 0.00 55.36 55.45 1s9g s GLN 407 Cb 0.10 -2.95 -0.09 0.00 1.10 0.00 0.00 33.01 31.17 1s9g s GLN 407 CO 0.65 0.51 0.90 0.00 -0.55 0.00 0.00 175.29 176.80 1s9g s ALA 408 N -1.45 3.28 0.22 1.58 0.00 -1.26 -5.04 121.76 119.09 1s9g s ALA 408 Ca 0.36 0.49 -0.00 0.00 0.00 0.00 0.00 51.96 52.81 1s9g s ALA 408 Cb -0.14 -3.13 -0.04 0.00 0.00 0.00 0.00 23.12 19.81 1s9g s ALA 408 CO 0.19 0.21 0.12 0.95 0.00 0.00 0.00 175.76 177.23 1s9g s THR 409 N -1.47 0.23 -0.23 0.00 -4.23 -1.26 -5.14 115.64 103.54 1s9g s THR 409 Ca 0.46 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 58.93 1s9g s THR 409 Cb -0.20 -2.55 0.09 0.00 1.34 0.00 0.00 72.50 71.17 1s9g s THR 409 CO 0.25 -0.00 0.15 0.86 -0.54 0.00 0.00 174.62 175.34 1s9g s TRP 410 N -3.99 0.08 -0.90 3.99 -0.00 -1.26 -5.10 118.94 111.75 1s9g s TRP 410 Ca 0.38 -0.38 -0.18 0.00 -0.00 0.00 0.00 56.10 55.93 1s9g s TRP 410 Cb 0.07 -0.67 0.15 0.00 -0.00 0.00 0.00 33.47 33.03 1s9g s TRP 410 CO 0.13 -0.67 1.03 0.96 -0.00 0.00 0.00 176.95 178.39 1s9g s ILE 411 N 2.19 4.96 0.80 5.86 -4.36 -1.26 -5.02 121.20 124.36 1s9g s ILE 411 Ca 0.06 -1.79 -0.11 0.00 -0.26 0.00 0.00 60.65 58.54 1s9g s ILE 411 Cb -0.16 -4.69 0.18 0.00 1.25 0.00 0.00 42.46 39.04 1s9g s ILE 411 CO -0.21 -1.38 0.40 -0.81 0.24 0.00 0.00 174.94 173.18 1s9g n PRO 412 N 5.88 -1.98 -1.92 0.37 -0.04 -1.26 -4.79 135.00 131.25 1s9g n PRO 412 Ca 0.21 -0.67 -0.42 0.00 -0.04 0.00 0.00 63.50 62.58 1s9g n PRO 412 Cb 0.48 -1.11 -0.03 0.00 -0.04 0.00 0.00 33.50 32.81 1s9g n PRO 412 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1s9g s GLU 413 N -3.40 4.21 0.10 0.54 8.01 -1.26 -4.97 118.70 121.94 1s9g s GLU 413 Ca 0.31 2.39 -0.07 0.00 0.01 0.00 0.00 54.97 57.60 1s9g s GLU 413 Cb -0.05 -3.12 -0.01 0.00 -4.31 0.00 0.00 34.13 26.64 1s9g s GLU 413 CO 0.26 -0.56 0.17 1.67 0.01 0.00 0.00 175.26 176.81 1s9g s TRP 414 N 0.66 0.27 0.19 1.61 1.48 -1.26 -2.73 118.94 119.17 1s9g s TRP 414 Ca 0.66 -0.70 0.10 0.00 -1.06 0.00 0.00 56.10 55.10 1s9g s TRP 414 Cb -0.44 -0.12 -0.04 0.00 -1.16 0.00 0.00 33.47 31.71 1s9g s TRP 414 CO 0.37 -0.55 -0.20 -1.21 -4.06 0.00 0.00 176.95 171.30 1s9g s GLU 415 N -3.90 1.41 0.25 3.25 2.02 -0.11 -4.98 118.70 116.65 1s9g s GLU 415 Ca 0.08 -1.52 -0.20 0.00 0.02 0.00 0.00 54.97 53.35 1s9g s GLU 415 Cb 0.05 -1.53 -0.09 0.00 0.10 0.00 0.00 34.13 32.66 1s9g s GLU 415 CO -0.08 0.31 0.76 0.12 0.02 0.00 0.00 175.26 176.39 1s9g s PHE 416 N -2.09 3.64 -0.30 1.61 5.36 -1.26 -0.91 117.98 124.02 1s9g s PHE 416 Ca 0.20 1.44 -0.03 0.00 -0.96 0.00 0.00 56.93 57.58 1s9g s PHE 416 Cb -0.06 -2.66 0.11 0.00 -0.34 0.00 0.00 43.02 40.07 1s9g s PHE 416 CO 0.09 0.30 0.14 0.08 -1.46 0.00 0.00 175.22 174.37 1s9g s VAL 417 N -1.57 0.01 -0.34 3.12 1.01 -0.88 -4.81 120.40 116.94 1s9g s VAL 417 Ca 0.45 -0.97 -0.29 0.00 0.00 0.00 0.00 61.98 61.17 1s9g s VAL 417 Cb -0.17 -1.04 -0.01 0.00 0.00 0.00 0.00 36.38 35.17 1s9g s VAL 417 CO 0.21 -0.78 1.62 0.21 0.00 0.00 0.00 175.10 176.36 1s9g s ASN 418 N 1.88 6.15 -0.31 3.32 2.47 -1.26 -4.30 114.94 122.89 1s9g s ASN 418 Ca 0.11 1.18 -0.12 0.00 0.42 0.00 0.00 52.86 54.45 1s9g s ASN 418 Cb -0.17 -2.53 0.19 0.00 -1.45 0.00 0.00 41.25 37.28 1s9g s ASN 418 CO -0.29 -1.52 1.11 0.28 -3.72 0.00 0.00 177.10 172.96 1s9g s THR 419 N 6.02 -0.09 1.02 -5.21 -1.32 -1.26 -5.16 115.64 109.63 1s9g s THR 419 Ca 0.71 -0.00 -0.20 0.00 -1.21 0.00 0.00 61.69 60.99 1s9g s THR 419 Cb -0.19 0.00 -0.08 0.00 -1.51 0.00 0.00 72.50 70.72 1s9g s THR 419 CO 0.32 0.00 -0.65 -2.65 -2.21 0.00 0.00 174.62 169.43 1s9g n PRO 420 N 3.56 -0.39 -0.76 7.08 -0.02 -1.26 -4.74 135.00 138.47 1s9g n PRO 420 Ca 0.05 -0.10 -0.28 0.00 -2.02 0.00 0.00 63.50 61.14 1s9g n PRO 420 Cb 0.64 -1.30 0.23 0.00 -0.02 0.00 0.00 33.50 33.05 1s9g n PRO 420 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1s9g s PRO 421 N -2.60 -0.77 -0.09 0.52 0.04 -1.26 -4.95 135.00 125.89 1s9g s PRO 421 Ca 0.45 0.59 0.03 0.00 0.04 0.00 0.00 61.00 62.11 1s9g s PRO 421 Cb -0.08 -1.59 -0.02 0.00 0.04 0.00 0.00 34.50 32.85 1s9g s PRO 421 CO 0.71 -3.56 -0.16 -1.17 0.04 0.00 0.00 177.00 172.86 1s9g s LEU 422 N -7.04 2.56 -0.19 -3.56 2.96 -1.26 -4.85 118.68 107.30 1s9g s LEU 422 Ca 0.68 -0.33 -0.29 0.00 -0.22 0.00 0.00 54.13 53.97 1s9g s LEU 422 Cb -0.21 -1.54 0.00 0.00 0.50 0.00 0.00 46.19 44.94 1s9g s LEU 422 CO 0.62 0.24 1.01 -0.69 -1.32 0.00 0.00 176.35 176.20 1s9g s VAL 423 N -0.10 4.73 0.05 1.68 1.01 -0.48 -4.99 120.40 122.30 1s9g s VAL 423 Ca -0.03 1.98 -0.26 0.00 0.00 0.00 0.00 61.98 63.68 1s9g s VAL 423 Cb -0.14 -4.29 0.07 0.00 0.00 0.00 0.00 36.38 32.02 1s9g s VAL 423 CO 0.04 -0.11 0.61 -1.59 0.00 0.00 0.00 175.10 174.05 1s9g s LYS 424 N 2.77 1.13 -0.59 2.72 -2.85 -1.26 -4.52 119.74 117.14 1s9g s LYS 424 Ca 0.44 -0.12 -0.26 0.00 -1.00 0.00 0.00 55.97 55.03 1s9g s LYS 424 Cb -0.16 0.52 0.04 0.00 -2.06 0.00 0.00 37.83 36.17 1s9g s LYS 424 CO 0.10 -0.42 1.10 -0.51 0.10 0.00 0.00 175.35 175.72 1s9g s LEU 425 N -1.94 3.70 0.00 2.77 1.43 -1.26 -4.89 118.68 118.49 1s9g s LEU 425 Ca -0.05 -0.17 0.08 0.00 -1.03 0.00 0.00 54.13 52.95 1s9g s LEU 425 Cb -0.01 -2.95 0.45 0.00 0.03 0.00 0.00 46.19 43.72 1s9g s LEU 425 CO -0.01 -1.43 0.86 0.79 0.23 0.00 0.00 176.35 176.79 1s9g n TRP 426 N 8.16 0.00 0.00 0.29 7.02 -1.26 -4.75 117.44 126.90 1s9g n TRP 426 Ca 0.05 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.53 1s9g n TRP 426 Cb 0.48 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.37 1s9g n TRP 426 CO 0.00 0.00 0.00 2.48 -2.02 0.00 0.00 177.69 178.15 1s9g n TYR 427 N -0.83 0.00 -5.22 -5.99 0.18 -1.26 -4.55 117.16 99.49 1s9g n TYR 427 Ca 0.06 0.00 -0.32 0.00 1.88 0.00 0.00 57.90 59.52 1s9g n TYR 427 Cb 0.03 0.00 -0.16 0.00 -0.38 0.00 0.00 39.34 38.83 1s9g n TYR 427 CO 0.00 0.00 0.00 -0.65 -2.08 0.00 0.00 176.86 174.13 1s9g s GLN 428 N -1.05 2.52 0.43 -3.48 -0.21 -1.26 -5.03 119.66 111.58 1s9g s GLN 428 Ca 0.00 -0.88 -0.21 0.00 0.02 0.00 0.00 55.36 54.29 1s9g s GLN 428 Cb 0.00 -2.18 -0.11 0.00 1.00 0.00 0.00 33.01 31.72 1s9g s GLN 428 CO 0.00 0.42 0.96 -0.51 -2.12 0.00 0.00 175.29 174.03 1s9g s LEU 429 N -0.25 3.93 0.03 2.90 1.43 -1.26 -4.71 118.68 120.75 1s9g s LEU 429 Ca -0.01 1.70 -0.30 0.00 -1.03 0.00 0.00 54.13 54.49 1s9g s LEU 429 Cb -0.13 -4.54 -0.06 0.00 0.03 0.00 0.00 46.19 41.49 1s9g s LEU 429 CO 0.03 -0.39 1.39 -1.61 0.23 0.00 0.00 176.35 176.00 1s9g s GLU 430 N -3.19 4.30 0.15 1.70 0.41 0.17 -4.93 118.70 117.31 1s9g s GLU 430 Ca 0.62 1.97 -0.11 0.00 -0.41 0.00 0.00 54.97 57.05 1s9g s GLU 430 Cb -0.09 -3.49 -0.00 0.00 -1.78 0.00 0.00 34.13 28.76 1s9g s GLU 430 CO 0.14 -0.53 1.54 0.87 -0.49 0.00 0.00 175.26 176.79 1s9g h LYS 431 N 7.56 0.98 -6.48 1.61 6.56 -1.95 -3.44 116.57 121.42 1s9g h LYS 431 Ca -0.39 -0.42 -0.68 0.00 -1.06 0.00 0.00 60.65 58.10 1s9g h LYS 431 Cb 1.19 -0.03 -0.18 0.00 -0.57 0.00 0.00 32.23 32.63 1s9g h LYS 431 CO 0.89 1.09 -0.75 -2.00 -2.06 0.00 0.00 179.45 176.62 1s9g s GLU 432 N -4.67 2.24 0.75 3.15 2.56 -1.26 -5.12 118.70 116.35 1s9g s GLU 432 Ca -0.11 -0.92 -0.10 0.00 0.00 0.00 0.00 54.97 53.84 1s9g s GLU 432 Cb 0.12 -2.32 0.15 0.00 2.00 0.00 0.00 34.13 34.08 1s9g s GLU 432 CO 0.87 0.55 0.35 -0.35 -0.56 0.00 0.00 175.26 176.12 1s9g n PRO 433 N 1.28 -1.44 -4.10 4.30 -0.04 -1.26 -4.96 135.00 128.78 1s9g n PRO 433 Ca -0.15 -0.59 -0.33 0.00 -0.04 0.00 0.00 63.50 62.40 1s9g n PRO 433 Cb 0.52 -1.07 -0.16 0.00 -0.04 0.00 0.00 33.50 32.76 1s9g n PRO 433 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1s9g s ILE 434 N -1.61 2.04 0.07 0.52 1.01 -1.26 -5.07 121.20 116.90 1s9g s ILE 434 Ca 0.27 -1.06 -0.33 0.00 0.00 0.00 0.00 60.65 59.52 1s9g s ILE 434 Cb -0.05 -1.92 -0.13 0.00 0.01 0.00 0.00 42.46 40.38 1s9g s ILE 434 CO 0.23 0.41 1.73 1.33 0.00 0.00 0.00 174.94 178.64 1s9g n VAL 435 N 4.59 0.27 0.00 2.92 0.24 -1.26 -2.48 118.33 122.61 1s9g n VAL 435 Ca -0.19 -0.05 0.00 0.00 -2.04 0.00 0.00 64.34 62.06 1s9g n VAL 435 Cb 0.48 -1.76 0.00 0.00 -1.47 0.00 0.00 33.84 31.09 1s9g n VAL 435 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1s9g n GLY 436 N 3.91 2.79 3.73 7.63 0.00 -1.26 -5.02 105.19 116.97 1s9g n GLY 436 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1s9g n GLY 436 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s9g s ALA 437 N -1.56 3.86 -0.03 4.61 0.00 -1.04 -4.90 121.76 122.70 1s9g s ALA 437 Ca 0.00 1.57 -0.30 0.00 0.00 0.00 0.00 51.96 53.23 1s9g s ALA 437 Cb 0.00 -3.67 -0.08 0.00 0.00 0.00 0.00 23.12 19.37 1s9g s ALA 437 CO 0.00 -0.93 2.00 -2.00 0.00 0.00 0.00 175.76 174.82 1s9g s GLU 438 N 0.55 3.91 0.02 0.00 2.12 -1.26 -4.61 118.70 119.42 1s9g s GLU 438 Ca 0.70 2.44 -0.30 0.00 0.36 0.00 0.00 54.97 58.17 1s9g s GLU 438 Cb -0.49 -4.20 -0.04 0.00 0.26 0.00 0.00 34.13 29.67 1s9g s GLU 438 CO 0.38 -1.21 0.96 0.99 -0.54 0.00 0.00 175.26 175.83 1s9g s THR 439 N 5.29 4.81 -0.38 -1.70 2.01 -1.26 -3.12 115.64 121.29 1s9g s THR 439 Ca 0.90 2.02 -0.10 0.00 0.31 0.00 0.00 61.69 64.81 1s9g s THR 439 Cb -0.40 -4.30 0.03 0.00 0.01 0.00 0.00 72.50 67.85 1s9g s THR 439 CO 0.39 0.20 0.21 -0.36 -0.69 0.00 0.00 174.62 174.37 1s9g s PHE 440 N 0.79 3.25 -1.07 4.92 0.40 0.56 -2.81 117.98 124.04 1s9g s PHE 440 Ca 0.50 -1.06 -0.20 0.00 -0.60 0.00 0.00 56.93 55.57 1s9g s PHE 440 Cb -0.21 -2.49 0.09 0.00 0.51 0.00 0.00 43.02 40.92 1s9g s PHE 440 CO 0.28 -0.68 1.41 0.71 0.70 0.00 0.00 175.22 177.63 1s9g s TYR 441 N 1.53 2.85 0.33 0.36 1.51 0.09 -1.05 117.35 122.97 1s9g s TYR 441 Ca 0.02 -1.29 -0.26 0.00 -1.01 0.00 0.00 57.07 54.53 1s9g s TYR 441 Cb -0.20 -4.55 -0.10 0.00 -0.11 0.00 0.00 41.96 37.01 1s9g s TYR 441 CO 0.06 -1.73 0.95 0.54 -1.11 0.00 0.00 175.55 174.27 1s9g s VAL 442 N 3.80 4.17 -0.03 0.71 0.11 -1.00 -1.91 120.40 126.25 1s9g s VAL 442 Ca 0.43 1.80 -0.29 0.00 -2.93 0.00 0.00 61.98 60.99 1s9g s VAL 442 Cb -0.01 -3.99 0.09 0.00 -1.53 0.00 0.00 36.38 30.94 1s9g s VAL 442 CO -0.06 0.14 0.78 -0.62 -3.33 0.00 0.00 175.10 172.01 1s9g s ASP 443 N -1.60 -0.53 0.00 3.54 3.68 -1.16 -4.43 116.67 116.17 1s9g s ASP 443 Ca 0.50 0.40 0.00 0.00 2.13 0.00 0.00 52.55 55.58 1s9g s ASP 443 Cb -0.19 0.47 0.00 0.00 -1.45 0.00 0.00 42.92 41.75 1s9g s ASP 443 CO 0.24 -0.61 0.00 0.61 0.13 0.00 0.00 175.17 175.54 1s9g n GLY 444 N 0.45 0.98 0.31 2.66 0.00 -1.26 -1.58 105.19 106.76 1s9g n GLY 444 Ca -0.15 0.57 -0.02 0.00 0.00 0.00 0.00 46.02 46.41 1s9g n GLY 444 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s9g n ALA 445 N 0.00 0.05 -3.37 4.61 0.00 -1.21 -3.03 120.51 117.56 1s9g n ALA 445 Ca 0.00 -0.19 -0.09 0.00 0.00 0.00 0.00 53.44 53.16 1s9g n ALA 445 Cb 0.00 0.12 -0.04 0.00 0.00 0.00 0.00 19.45 19.54 1s9g n ALA 445 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1s9g s ALA 446 N -2.09 -0.42 -0.54 0.00 0.00 -1.26 -2.41 121.76 115.03 1s9g s ALA 446 Ca 0.01 -0.80 -0.17 0.00 0.00 0.00 0.00 51.96 51.01 1s9g s ALA 446 Cb 0.00 0.99 0.11 0.00 0.00 0.00 0.00 23.12 24.22 1s9g s ALA 446 CO 0.01 -0.90 0.55 1.21 0.00 0.00 0.00 175.76 176.63 1s9g s ASN 447 N -3.02 6.18 0.39 0.00 3.84 0.20 -4.79 114.94 117.74 1s9g s ASN 447 Ca 0.20 -1.58 0.26 0.00 0.21 0.00 0.00 52.86 51.95 1s9g s ASN 447 Cb -0.02 -2.24 1.36 0.00 -0.55 0.00 0.00 41.25 39.80 1s9g s ASN 447 CO 0.10 -0.91 1.49 0.54 -2.79 0.00 0.00 177.10 175.53 1s9g n ARG 448 N 5.60 -0.04 -0.03 0.43 1.74 -1.26 -0.40 116.66 122.70 1s9g n ARG 448 Ca -0.12 1.24 -0.01 0.00 -0.77 0.00 0.00 57.85 58.19 1s9g n ARG 448 Cb 0.41 -2.35 -0.00 0.00 -1.02 0.00 0.00 32.46 29.50 1s9g n ARG 448 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1s9g h GLU 449 N 0.00 0.00 0.00 5.56 4.39 -1.96 -3.36 114.58 119.21 1s9g h GLU 449 Ca 0.82 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.52 1s9g h GLU 449 Cb 2.46 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 31.11 1s9g h GLU 449 CO -0.56 0.00 0.22 0.25 -1.16 0.00 0.00 179.01 177.76 1s9g n THR 450 N -3.66 0.73 -2.64 1.13 -2.24 -0.83 -4.79 114.28 101.98 1s9g n THR 450 Ca -0.01 0.74 -0.17 0.00 -2.27 0.00 0.00 64.05 62.34 1s9g n THR 450 Cb 0.05 -1.74 -0.00 0.00 -2.10 0.00 0.00 70.33 66.54 1s9g n THR 450 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1s9g n LYS 451 N -2.10 -2.62 -4.86 -0.78 -0.00 0.47 -4.82 118.16 103.46 1s9g n LYS 451 Ca -0.01 0.69 -0.25 0.00 -0.00 0.00 0.00 58.31 58.74 1s9g n LYS 451 Cb 0.24 -5.35 -0.15 0.00 -0.00 0.00 0.00 35.03 29.77 1s9g n LYS 451 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1s9g s LEU 452 N -5.95 2.02 0.00 -5.58 1.43 -1.24 0.71 118.68 110.06 1s9g s LEU 452 Ca 0.10 -0.33 0.00 0.00 -1.03 0.00 0.00 54.13 52.87 1s9g s LEU 452 Cb -0.05 -0.93 0.00 0.00 0.03 0.00 0.00 46.19 45.24 1s9g s LEU 452 CO 0.12 0.21 0.00 0.61 0.23 0.00 0.00 176.35 177.52 1s9g n GLY 453 N 2.70 3.00 3.51 -3.19 0.00 -0.73 -0.63 105.19 109.85 1s9g n GLY 453 Ca -0.15 -1.21 -0.13 0.00 0.00 0.00 0.00 46.02 44.53 1s9g n GLY 453 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s9g s LYS 454 N -1.38 0.68 -0.08 1.61 1.02 -1.01 -0.92 119.74 119.66 1s9g s LYS 454 Ca 0.00 0.88 0.05 0.00 0.02 0.00 0.00 55.97 56.92 1s9g s LYS 454 Cb 0.00 0.29 -0.01 0.00 -0.52 0.00 0.00 37.83 37.60 1s9g s LYS 454 CO 0.00 -0.10 -0.24 0.00 -0.92 0.00 0.00 175.35 174.09 1s9g s ALA 455 N 0.56 2.18 0.00 5.17 0.00 0.34 -3.33 121.76 126.67 1s9g s ALA 455 Ca -0.02 -1.01 0.00 0.00 0.00 0.00 0.00 51.96 50.93 1s9g s ALA 455 Cb -0.05 -0.75 0.00 0.00 0.00 0.00 0.00 23.12 22.32 1s9g s ALA 455 CO -0.03 0.35 0.00 0.41 0.00 0.00 0.00 175.76 176.49 1s9g n GLY 456 N 3.24 4.01 0.00 0.00 0.00 -0.61 -0.18 105.19 111.65 1s9g n GLY 456 Ca -0.18 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.33 1s9g n GLY 456 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1s9g n TYR 457 N 0.00 0.00 -3.71 1.61 4.11 0.15 -2.97 117.16 116.34 1s9g n TYR 457 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 57.90 57.76 1s9g n TYR 457 Cb 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 39.34 39.20 1s9g n TYR 457 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.86 176.94 1s9g s VAL 458 N -2.00 -0.15 0.31 -3.48 1.01 -0.80 -1.67 120.40 113.62 1s9g s VAL 458 Ca 0.00 0.23 0.08 0.00 0.00 0.00 0.00 61.98 62.29 1s9g s VAL 458 Cb 0.00 -0.32 -0.03 0.00 0.00 0.00 0.00 36.38 36.03 1s9g s VAL 458 CO 0.00 0.09 0.21 0.42 0.00 0.00 0.00 175.10 175.83 1s9g s THR 459 N 1.63 3.58 0.11 3.92 -4.23 0.19 -0.73 115.64 120.11 1s9g s THR 459 Ca -0.05 -1.50 -0.26 0.00 -1.18 0.00 0.00 61.69 58.70 1s9g s THR 459 Cb -0.11 -3.15 -0.08 0.00 1.34 0.00 0.00 72.50 70.49 1s9g s THR 459 CO -0.07 -0.23 1.44 -0.55 -0.54 0.00 0.00 174.62 174.67 1s9g h ASN 460 N 1.42 -1.54 0.00 3.99 -0.00 -1.85 0.24 115.58 117.84 1s9g h ASN 460 Ca -0.45 0.21 0.00 0.00 -0.00 0.00 0.00 56.30 56.06 1s9g h ASN 460 Cb 1.25 0.64 0.00 0.00 -0.00 0.00 0.00 38.32 40.21 1s9g h ASN 460 CO 0.60 -0.31 0.00 0.29 -0.00 0.00 0.00 177.43 178.01 1s9g n LYS 461 N -4.85 0.00 -3.09 4.14 5.02 -1.26 -4.64 118.16 113.48 1s9g n LYS 461 Ca -0.02 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.07 1s9g n LYS 461 Cb 0.27 -1.18 0.00 0.00 -0.02 0.00 0.00 35.03 34.10 1s9g n LYS 461 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1s9g n GLY 462 N 0.75 -0.49 3.70 0.72 0.00 0.84 -4.96 105.19 105.74 1s9g n GLY 462 Ca 0.00 0.07 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 1s9g n GLY 462 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1s9g s ARG 463 N -5.73 4.17 -0.05 1.61 3.52 -1.22 -4.86 118.95 116.38 1s9g s ARG 463 Ca 0.29 -0.11 0.01 0.00 -0.13 0.00 0.00 55.73 55.79 1s9g s ARG 463 Cb -0.15 -3.48 0.02 0.00 -1.56 0.00 0.00 34.95 29.79 1s9g s ARG 463 CO 0.35 0.16 -0.04 -0.65 -0.81 0.00 0.00 175.30 174.32 1s9g s GLN 464 N 0.74 0.87 0.09 5.12 -0.21 -1.26 0.54 119.66 125.56 1s9g s GLN 464 Ca 0.11 -0.09 0.07 0.00 0.02 0.00 0.00 55.36 55.47 1s9g s GLN 464 Cb -0.13 -0.94 -0.03 0.00 1.00 0.00 0.00 33.01 32.91 1s9g s GLN 464 CO 0.03 -0.13 -0.17 0.21 -2.12 0.00 0.00 175.29 173.10 1s9g s LYS 465 N 1.16 0.97 -0.18 2.91 2.20 -0.67 -4.96 119.74 121.17 1s9g s LYS 465 Ca -0.07 -1.06 -0.04 0.00 -0.36 0.00 0.00 55.97 54.44 1s9g s LYS 465 Cb -0.14 -1.10 0.09 0.00 -1.51 0.00 0.00 37.83 35.17 1s9g s LYS 465 CO -0.01 0.25 0.26 0.08 -0.36 0.00 0.00 175.35 175.57 1s9g s VAL 466 N -1.24 -0.40 -0.03 4.02 1.01 -1.26 0.30 120.40 122.79 1s9g s VAL 466 Ca 0.02 0.07 0.02 0.00 0.00 0.00 0.00 61.98 62.09 1s9g s VAL 466 Cb -0.10 -0.59 -0.03 0.00 0.00 0.00 0.00 36.38 35.66 1s9g s VAL 466 CO 0.03 -0.05 -0.06 -0.69 0.00 0.00 0.00 175.10 174.34 1s9g s VAL 467 N 2.40 3.77 -0.09 2.92 1.01 0.74 -4.95 120.40 126.20 1s9g s VAL 467 Ca 0.05 -0.60 -0.14 0.00 0.00 0.00 0.00 61.98 61.29 1s9g s VAL 467 Cb -0.14 -2.60 -0.05 0.00 0.00 0.00 0.00 36.38 33.59 1s9g s VAL 467 CO -0.11 0.49 0.36 -2.16 0.00 0.00 0.00 175.10 173.68 1s9g s PRO 468 N -1.15 4.07 -0.02 2.72 0.04 -1.26 -0.50 135.00 138.90 1s9g s PRO 468 Ca 0.15 0.26 0.06 0.00 0.04 0.00 0.00 61.00 61.51 1s9g s PRO 468 Cb -0.11 -3.33 -0.02 0.00 0.04 0.00 0.00 34.50 31.08 1s9g s PRO 468 CO 0.05 0.44 -0.21 -0.51 0.04 0.00 0.00 177.00 176.81 1s9g s LEU 469 N -0.21 2.03 -0.23 -3.56 1.43 -0.10 -4.97 118.68 113.08 1s9g s LEU 469 Ca 0.21 -0.39 0.01 0.00 -1.03 0.00 0.00 54.13 52.93 1s9g s LEU 469 Cb -0.15 -1.10 0.03 0.00 0.03 0.00 0.00 46.19 45.01 1s9g s LEU 469 CO 0.09 0.25 -0.12 0.42 0.23 0.00 0.00 176.35 177.22 1s9g s THR 470 N -0.44 2.41 0.00 5.49 -4.23 -1.26 -1.78 115.64 115.83 1s9g s THR 470 Ca 0.07 -1.17 0.00 0.00 -1.18 0.00 0.00 61.69 59.40 1s9g s THR 470 Cb -0.09 -2.21 0.00 0.00 1.34 0.00 0.00 72.50 71.54 1s9g s THR 470 CO -0.00 0.24 0.00 -3.20 -0.54 0.00 0.00 174.62 171.12 1s9g n ASN 471 N 4.58 -1.35 -3.89 3.99 5.15 0.22 -5.02 115.26 118.93 1s9g n ASN 471 Ca -0.17 0.00 -0.09 0.00 -0.60 0.00 0.00 54.58 53.71 1s9g n ASN 471 Cb 0.47 -0.36 -0.05 0.00 -0.53 0.00 0.00 39.78 39.30 1s9g n ASN 471 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1s9g s THR 472 N -2.68 0.03 0.26 -0.44 -4.23 -1.13 -5.05 115.64 102.40 1s9g s THR 472 Ca 0.00 -1.18 0.10 0.00 -1.18 0.00 0.00 61.69 59.43 1s9g s THR 472 Cb 0.00 -1.87 -0.04 0.00 1.34 0.00 0.00 72.50 71.93 1s9g s THR 472 CO 0.00 -0.14 -0.05 0.28 -0.54 0.00 0.00 174.62 174.17 1s9g s THR 473 N -3.95 3.26 0.35 3.99 -1.32 -1.26 -4.41 115.64 112.30 1s9g s THR 473 Ca 0.16 -1.97 0.16 0.00 -1.21 0.00 0.00 61.69 58.83 1s9g s THR 473 Cb 0.00 -2.72 0.36 0.00 -1.51 0.00 0.00 72.50 68.64 1s9g s THR 473 CO 0.02 -0.35 1.58 0.78 -2.21 0.00 0.00 174.62 174.44 1s9g h ASN 474 N 2.07 0.15 0.44 8.08 2.35 -1.88 1.60 115.58 128.39 1s9g h ASN 474 Ca -0.44 0.26 -0.02 0.00 -0.55 0.00 0.00 56.30 55.55 1s9g h ASN 474 Cb 1.25 0.31 0.00 0.00 0.05 0.00 0.00 38.32 39.93 1s9g h ASN 474 CO 0.60 -0.41 -0.21 1.56 -1.65 0.00 0.00 177.43 177.32 1s9g h GLN 475 N 0.02 -0.58 -0.94 0.81 4.20 -1.94 -1.00 115.11 115.68 1s9g h GLN 475 Ca 0.79 0.04 0.16 0.00 0.06 0.00 0.00 58.65 59.70 1s9g h GLN 475 Cb 1.99 0.13 -0.10 0.00 0.30 0.00 0.00 27.48 29.81 1s9g h GLN 475 CO -0.80 -0.30 0.54 0.87 -0.67 0.00 0.00 178.83 178.48 1s9g h LYS 476 N -0.79 0.71 -0.21 1.46 1.57 0.17 -1.85 116.57 117.64 1s9g h LYS 476 Ca -0.06 -0.04 -0.19 0.00 -1.87 0.00 0.00 60.65 58.48 1s9g h LYS 476 Cb 0.55 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.70 1s9g h LYS 476 CO 0.10 0.47 -0.63 1.79 -0.57 0.00 0.00 179.45 180.61 1s9g h THR 477 N 0.74 1.29 -0.40 -0.16 1.35 -0.38 -1.42 112.91 113.93 1s9g h THR 477 Ca 0.52 -1.86 0.11 0.00 -0.55 0.00 0.00 66.41 64.64 1s9g h THR 477 Cb 0.73 1.81 -0.02 0.00 -1.73 0.00 0.00 68.15 68.94 1s9g h THR 477 CO -0.36 0.59 0.35 -0.33 -0.25 0.00 0.00 175.52 175.52 1s9g h GLU 478 N 0.54 0.00 0.05 4.72 5.08 -0.31 0.52 114.58 125.19 1s9g h GLU 478 Ca -0.01 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 58.00 1s9g h GLU 478 Cb 1.23 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.44 1s9g h GLU 478 CO 0.13 0.00 -2.08 1.28 -1.00 0.00 0.00 179.01 177.34 1s9g n LEU 479 N -4.03 1.80 -0.28 1.33 4.77 -1.16 -3.12 117.00 116.31 1s9g n LEU 479 Ca 0.07 0.16 0.06 0.00 -0.03 0.00 0.00 56.01 56.27 1s9g n LEU 479 Cb 0.53 -0.46 0.20 0.00 -2.33 0.00 0.00 43.42 41.36 1s9g n LEU 479 CO 0.32 0.69 1.07 -0.61 -1.33 0.00 0.00 177.39 177.52 1s9g h GLN 480 N 0.03 0.55 0.08 3.23 5.75 0.21 0.39 115.11 125.35 1s9g h GLN 480 Ca -0.44 -0.03 -0.00 0.00 -0.15 0.00 0.00 58.65 58.02 1s9g h GLN 480 Cb 2.04 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 30.46 1s9g h GLN 480 CO 0.04 0.36 -0.04 0.00 -2.65 0.00 0.00 178.83 176.54 1s9g h ALA 481 N 1.54 -0.88 -0.93 3.38 0.00 -0.19 -0.77 119.26 121.40 1s9g h ALA 481 Ca 0.43 -0.02 0.14 0.00 0.00 0.00 0.00 54.91 55.46 1s9g h ALA 481 Cb 0.61 0.04 -0.15 0.00 0.00 0.00 0.00 17.79 18.29 1s9g h ALA 481 CO -0.36 -0.88 -0.37 -0.89 0.00 0.00 0.00 179.25 176.75 1s9g n ILE 482 N -2.34 -0.50 -0.10 0.00 5.41 -0.92 -0.13 119.36 120.78 1s9g n ILE 482 Ca -0.01 2.19 -0.10 0.00 1.00 0.00 0.00 62.75 65.83 1s9g n ILE 482 Cb 0.04 -2.89 -0.07 0.00 -0.71 0.00 0.00 39.64 36.01 1s9g n ILE 482 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 176.55 176.77 1s9g h TYR 483 N 0.00 -1.21 -0.84 1.39 3.20 -0.20 -1.06 116.97 118.25 1s9g h TYR 483 Ca 0.32 0.06 0.08 0.00 3.14 0.00 0.00 58.73 62.33 1s9g h TYR 483 Cb 0.56 0.57 -0.10 0.00 1.54 0.00 0.00 36.73 39.29 1s9g h TYR 483 CO -0.82 -0.35 -0.49 -0.11 -1.64 0.00 0.00 178.16 174.75 1s9g n LEU 484 N -4.59 -0.89 -0.31 2.82 7.94 0.82 0.48 117.00 123.27 1s9g n LEU 484 Ca -0.02 1.55 0.15 0.00 -1.11 0.00 0.00 56.01 56.58 1s9g n LEU 484 Cb 0.24 -0.22 0.33 0.00 0.53 0.00 0.00 43.42 44.30 1s9g n LEU 484 CO 0.00 -1.24 1.00 0.00 -1.11 0.00 0.00 177.39 176.03 1s9g h ALA 485 N 0.36 1.45 -0.23 1.96 0.00 0.05 0.23 119.26 123.08 1s9g h ALA 485 Ca 0.13 0.21 -0.05 0.00 0.00 0.00 0.00 54.91 55.20 1s9g h ALA 485 Cb 0.34 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1s9g h ALA 485 CO -0.79 -0.47 -0.05 -0.07 0.00 0.00 0.00 179.25 177.87 1s9g h LEU 486 N 0.26 0.44 -0.12 0.00 3.38 0.12 -1.54 115.31 117.85 1s9g h LEU 486 Ca 0.59 -0.36 0.02 0.00 0.09 0.00 0.00 57.88 58.22 1s9g h LEU 486 Cb 1.23 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.82 1s9g h LEU 486 CO -0.63 0.70 -0.33 1.56 0.09 0.00 0.00 178.44 179.83 1s9g h GLN 487 N 0.18 -0.31 -0.56 1.13 4.20 0.14 -2.92 115.11 116.96 1s9g h GLN 487 Ca 0.06 0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.74 1s9g h GLN 487 Cb 0.51 0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.33 1s9g h GLN 487 CO 0.02 -0.21 0.15 -0.44 -0.67 0.00 0.00 178.83 177.68 1s9g h ASP 488 N -0.32 0.79 -3.86 1.46 5.19 -1.40 -3.45 116.42 114.83 1s9g h ASP 488 Ca 0.03 -0.14 -0.50 0.00 -0.62 0.00 0.00 57.03 55.80 1s9g h ASP 488 Cb 0.40 -0.21 0.21 0.00 0.18 0.00 0.00 39.33 39.91 1s9g h ASP 488 CO -0.29 0.77 0.07 -1.54 -3.12 0.00 0.00 179.24 175.13 1s9g n SER 489 N -4.28 -0.48 -2.87 6.45 3.41 -0.58 -5.03 113.62 110.23 1s9g n SER 489 Ca 0.04 0.23 0.00 0.00 -0.26 0.00 0.00 58.87 58.88 1s9g n SER 489 Cb 0.22 -1.39 0.00 0.00 -0.26 0.00 0.00 64.21 62.78 1s9g n SER 489 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1s9g n GLY 490 N 0.61 -0.11 0.00 5.00 0.00 -1.26 -4.92 105.19 104.50 1s9g n GLY 490 Ca 0.09 -1.60 0.12 0.00 0.00 0.00 0.00 46.02 44.62 1s9g n GLY 490 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1s9g n LEU 491 N 0.00 0.00 -3.79 0.99 4.32 -1.26 -4.66 117.00 112.60 1s9g n LEU 491 Ca 0.00 0.00 -0.15 0.00 -0.02 0.00 0.00 56.01 55.84 1s9g n LEU 491 Cb 0.00 0.00 -0.16 0.00 -1.62 0.00 0.00 43.42 41.64 1s9g n LEU 491 CO 0.00 0.00 -0.35 -1.61 -1.22 0.00 0.00 177.39 174.21 1s9g s GLU 492 N -2.00 0.01 0.01 3.23 2.02 -1.26 0.44 118.70 121.15 1s9g s GLU 492 Ca 0.35 0.15 -0.18 0.00 0.02 0.00 0.00 54.97 55.31 1s9g s GLU 492 Cb 0.16 -0.25 0.03 0.00 0.10 0.00 0.00 34.13 34.18 1s9g s GLU 492 CO 0.27 -0.14 0.39 0.54 0.02 0.00 0.00 175.26 176.34 1s9g s VAL 493 N 0.93 0.05 -0.16 2.63 0.11 0.54 -4.54 120.40 119.96 1s9g s VAL 493 Ca -0.08 -0.43 0.00 0.00 -2.93 0.00 0.00 61.98 58.54 1s9g s VAL 493 Cb -0.11 -0.81 -0.00 0.00 -1.53 0.00 0.00 36.38 33.92 1s9g s VAL 493 CO -0.02 -0.24 -0.15 0.20 -3.33 0.00 0.00 175.10 171.56 1s9g s ASN 494 N -1.61 3.69 -0.06 3.54 -0.87 -1.18 -1.82 114.94 116.63 1s9g s ASN 494 Ca -0.10 -0.46 0.03 0.00 -1.57 0.00 0.00 52.86 50.76 1s9g s ASN 494 Cb -0.03 -1.57 0.01 0.00 -0.02 0.00 0.00 41.25 39.64 1s9g s ASN 494 CO 0.02 0.08 -0.15 -0.63 -2.57 0.00 0.00 177.10 173.86 1s9g s ILE 495 N 0.83 1.32 -0.28 0.60 1.01 0.96 0.21 121.20 125.85 1s9g s ILE 495 Ca -0.05 -0.60 -0.07 0.00 0.00 0.00 0.00 60.65 59.93 1s9g s ILE 495 Cb -0.15 -1.18 -0.00 0.00 0.01 0.00 0.00 42.46 41.14 1s9g s ILE 495 CO -0.00 0.39 0.07 -0.69 0.00 0.00 0.00 174.94 174.71 1s9g s VAL 496 N 0.48 4.08 0.01 2.92 1.01 -0.21 -1.01 120.40 127.67 1s9g s VAL 496 Ca -0.13 -0.50 0.04 0.00 0.00 0.00 0.00 61.98 61.39 1s9g s VAL 496 Cb -0.15 -3.02 -0.03 0.00 0.00 0.00 0.00 36.38 33.17 1s9g s VAL 496 CO 0.04 0.18 -0.07 0.42 0.00 0.00 0.00 175.10 175.67 1s9g s THR 497 N 1.54 3.61 -0.97 3.92 -4.23 -0.37 -2.37 115.64 116.77 1s9g s THR 497 Ca 0.04 -0.82 0.24 0.00 -1.18 0.00 0.00 61.69 59.98 1s9g s THR 497 Cb -0.16 -2.58 -0.02 0.00 1.34 0.00 0.00 72.50 71.08 1s9g s THR 497 CO 0.03 0.37 1.34 -0.90 -0.54 0.00 0.00 174.62 174.91 1s9g n ASP 498 N 1.49 0.57 -4.31 3.99 5.75 -1.26 -1.81 116.55 120.96 1s9g n ASP 498 Ca -0.15 -0.32 -0.35 0.00 -0.01 0.00 0.00 54.79 53.96 1s9g n ASP 498 Cb 0.52 0.35 -0.14 0.00 -1.03 0.00 0.00 41.12 40.83 1s9g n ASP 498 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1s9g s SER 499 N -3.09 4.49 0.27 -1.12 1.04 -1.26 -3.92 113.70 110.11 1s9g s SER 499 Ca 0.10 -0.48 -0.02 0.00 0.48 0.00 0.00 55.95 56.03 1s9g s SER 499 Cb 0.17 -1.76 0.43 0.00 0.10 0.00 0.00 66.02 64.95 1s9g s SER 499 CO 0.72 -0.06 1.87 1.56 0.98 0.00 0.00 173.24 178.32 1s9g h GLN 500 N 8.13 1.11 -0.20 4.02 4.20 -1.93 0.24 115.11 130.68 1s9g h GLN 500 Ca -0.39 -0.07 0.03 0.00 0.06 0.00 0.00 58.65 58.29 1s9g h GLN 500 Cb 1.15 -0.25 -0.06 0.00 0.30 0.00 0.00 27.48 28.62 1s9g h GLN 500 CO 0.60 0.73 -0.48 -0.92 -0.67 0.00 0.00 178.83 178.09 1s9g h TYR 501 N 1.14 -1.45 -0.86 2.96 3.20 -1.99 0.59 116.97 120.57 1s9g h TYR 501 Ca 0.44 0.06 0.05 0.00 3.14 0.00 0.00 58.73 62.42 1s9g h TYR 501 Cb 0.22 0.66 -0.06 0.00 1.54 0.00 0.00 36.73 39.09 1s9g h TYR 501 CO -0.00 -0.46 0.54 0.00 -1.64 0.00 0.00 178.16 176.60 1s9g h ALA 502 N -0.36 1.15 -2.41 1.82 0.00 -1.66 -1.53 119.26 116.26 1s9g h ALA 502 Ca 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1s9g h ALA 502 Cb 0.57 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1s9g h ALA 502 CO -0.43 0.33 0.00 -0.11 0.00 0.00 0.00 179.25 179.04 1s9g n LEU 503 N -4.59 0.00 -0.34 0.00 7.94 0.74 -2.43 117.00 118.32 1s9g n LEU 503 Ca 0.12 0.60 0.02 0.00 -1.11 0.00 0.00 56.01 55.63 1s9g n LEU 503 Cb 0.14 -0.10 0.08 0.00 0.53 0.00 0.00 43.42 44.07 1s9g n LEU 503 CO 0.32 -0.10 0.64 1.23 -1.11 0.00 0.00 177.39 178.37 1s9g h GLY 504 N 0.00 0.38 -0.56 -3.96 0.00 0.16 0.64 103.07 99.74 1s9g h GLY 504 Ca 0.00 0.40 0.12 0.00 0.00 0.00 0.00 47.33 47.85 1s9g h GLY 504 CO 0.00 -0.29 -0.33 -2.22 0.00 0.00 0.00 176.54 173.70 1s9g h ILE 505 N -0.02 0.14 0.05 2.60 1.08 -1.24 -1.77 117.51 118.35 1s9g h ILE 505 Ca 0.39 0.00 -0.23 0.00 -0.39 0.00 0.00 64.86 64.63 1s9g h ILE 505 Cb 0.64 0.14 0.02 0.00 -3.07 0.00 0.00 36.82 34.55 1s9g h ILE 505 CO -0.94 0.00 -0.92 0.40 -0.69 0.00 0.00 178.15 175.99 1s9g h ILE 506 N -0.11 1.36 -0.82 -0.67 5.03 -0.61 -3.34 117.51 118.34 1s9g h ILE 506 Ca 0.27 -2.28 0.23 0.00 -0.12 0.00 0.00 64.86 62.96 1s9g h ILE 506 Cb 0.56 2.63 -0.04 0.00 -3.03 0.00 0.00 36.82 36.95 1s9g h ILE 506 CO -0.76 0.68 0.58 -0.61 -0.68 0.00 0.00 178.15 177.37 1s9g h GLN 507 N 0.11 0.05 0.00 2.37 4.15 0.10 1.07 115.11 122.96 1s9g h GLN 507 Ca -0.13 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.29 1s9g h GLN 507 Cb 1.62 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 29.30 1s9g h GLN 507 CO 0.18 0.03 0.00 0.00 -1.93 0.00 0.00 178.83 177.11 1s9g n ALA 508 N -2.67 2.18 -3.11 3.38 0.00 -0.76 -4.88 120.51 114.65 1s9g n ALA 508 Ca 0.17 -0.11 -0.22 0.00 0.00 0.00 0.00 53.44 53.28 1s9g n ALA 508 Cb 0.85 -1.38 0.02 0.00 0.00 0.00 0.00 19.45 18.95 1s9g n ALA 508 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1s9g n GLN 509 N -1.30 -4.32 -1.41 0.00 6.02 0.37 -4.76 117.38 111.97 1s9g n GLN 509 Ca 0.11 0.76 -0.41 0.00 -0.01 0.00 0.00 57.00 57.45 1s9g n GLN 509 Cb 0.19 -5.57 0.01 0.00 1.02 0.00 0.00 30.24 25.89 1s9g n GLN 509 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 1s9g n PRO 510 N -3.90 0.41 -0.00 -1.09 -0.04 -1.26 -4.84 135.00 124.28 1s9g n PRO 510 Ca -0.08 0.15 0.09 0.00 -0.04 0.00 0.00 63.50 63.62 1s9g n PRO 510 Cb 0.60 -1.39 -0.12 0.00 -0.04 0.00 0.00 33.50 32.55 1s9g n PRO 510 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1s9g n ASP 511 N 1.49 0.90 -3.69 3.54 5.68 -1.24 -4.96 116.55 118.26 1s9g n ASP 511 Ca 0.11 -0.91 -0.06 0.00 -0.50 0.00 0.00 54.79 53.44 1s9g n ASP 511 Cb 0.41 1.06 -0.02 0.00 -1.14 0.00 0.00 41.12 41.43 1s9g n ASP 511 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1s9g s LYS 512 N -2.92 1.20 0.00 0.11 1.02 -1.26 -5.04 119.74 112.85 1s9g s LYS 512 Ca 0.07 -0.62 0.00 0.00 0.02 0.00 0.00 55.97 55.44 1s9g s LYS 512 Cb 0.15 0.44 0.00 0.00 -0.52 0.00 0.00 37.83 37.90 1s9g s LYS 512 CO 0.82 -0.55 0.00 0.45 -0.92 0.00 0.00 175.35 175.16 1s9g n SER 513 N -0.42 0.00 0.00 2.83 2.88 -1.26 -4.37 113.62 113.28 1s9g n SER 513 Ca -0.07 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 1s9g n SER 513 Cb 0.61 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.07 1s9g n SER 513 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 1s9g n GLU 514 N 0.00 0.00 -1.58 -1.46 0.00 -1.26 -4.19 120.64 112.15 1s9g n GLU 514 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 57.16 56.74 1s9g n GLU 514 Cb 0.00 -1.47 -0.02 0.00 0.00 0.00 0.00 31.44 29.95 1s9g n GLU 514 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 1s9g n SER 515 N -0.95 3.43 0.00 -1.84 2.88 -1.26 -4.86 113.62 111.02 1s9g n SER 515 Ca 0.00 -2.78 0.00 0.00 -1.33 0.00 0.00 58.87 54.76 1s9g n SER 515 Cb 0.00 -1.48 0.00 0.00 -0.75 0.00 0.00 64.21 61.98 1s9g n SER 515 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1s9g n GLU 516 N 6.58 0.00 0.22 -1.46 2.13 -1.26 -0.33 120.64 126.52 1s9g n GLU 516 Ca 0.51 0.00 -0.09 0.00 0.66 0.00 0.00 57.16 58.24 1s9g n GLU 516 Cb 0.40 0.00 -0.04 0.00 0.27 0.00 0.00 31.44 32.07 1s9g n GLU 516 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 1s9g h LEU 517 N 0.00 -0.52 -1.52 4.31 5.85 -1.91 -1.68 115.31 119.85 1s9g h LEU 517 Ca 0.00 0.02 0.19 0.00 0.84 0.00 0.00 57.88 58.93 1s9g h LEU 517 Cb 0.00 0.13 -0.06 0.00 0.37 0.00 0.00 40.66 41.10 1s9g h LEU 517 CO 0.00 -0.19 0.58 0.58 -0.34 0.00 0.00 178.44 179.07 1s9g h VAL 518 N -0.97 0.70 0.17 1.05 2.07 -1.01 0.28 116.25 118.54 1s9g h VAL 518 Ca -0.06 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 1s9g h VAL 518 Cb 0.47 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1s9g h VAL 518 CO 0.10 0.08 -0.08 0.78 0.02 0.00 0.00 177.57 178.47 1s9g h ASN 519 N 0.42 -0.19 -0.17 0.57 2.35 -1.48 0.83 115.58 117.90 1s9g h ASN 519 Ca 0.45 -0.00 0.05 0.00 -0.55 0.00 0.00 56.30 56.24 1s9g h ASN 519 Cb 1.10 0.05 -0.05 0.00 0.05 0.00 0.00 38.32 39.47 1s9g h ASN 519 CO -0.17 -0.13 -0.12 1.56 -1.65 0.00 0.00 177.43 176.92 1s9g h GLN 520 N -0.24 -0.12 0.08 0.81 4.20 0.42 0.65 115.11 120.91 1s9g h GLN 520 Ca -0.02 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.70 1s9g h GLN 520 Cb 0.18 0.03 -0.00 0.00 0.30 0.00 0.00 27.48 27.99 1s9g h GLN 520 CO 0.04 -0.08 -0.06 0.82 -0.67 0.00 0.00 178.83 178.88 1s9g h ILE 521 N -0.12 0.87 -0.45 2.54 2.04 -0.70 -0.83 117.51 120.85 1s9g h ILE 521 Ca 0.10 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.04 1s9g h ILE 521 Cb 0.28 0.87 -0.06 0.00 -0.74 0.00 0.00 36.82 37.17 1s9g h ILE 521 CO -0.25 0.00 0.10 0.40 0.00 0.00 0.00 178.15 178.40 1s9g h ILE 522 N -0.14 0.77 -0.36 -0.67 2.04 0.14 0.17 117.51 119.46 1s9g h ILE 522 Ca -0.00 -0.08 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 1s9g h ILE 522 Cb 0.13 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 1s9g h ILE 522 CO -0.01 0.04 0.19 -0.33 0.00 0.00 0.00 178.15 178.04 1s9g h GLU 523 N 0.24 0.49 -0.09 2.37 4.39 0.54 -1.61 114.58 120.90 1s9g h GLU 523 Ca 0.22 -0.05 -0.19 0.00 0.34 0.00 0.00 59.36 59.68 1s9g h GLU 523 Cb 0.27 -0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 28.81 1s9g h GLU 523 CO -0.28 0.37 -0.74 1.96 -1.16 0.00 0.00 179.01 179.16 1s9g h GLN 524 N 0.50 0.49 -0.52 2.33 1.08 0.34 -2.84 115.11 116.49 1s9g h GLN 524 Ca 0.13 -0.40 -0.01 0.00 -1.45 0.00 0.00 58.65 56.92 1s9g h GLN 524 Cb 0.03 0.08 -0.02 0.00 -0.05 0.00 0.00 27.48 27.52 1s9g h GLN 524 CO -0.02 1.03 0.28 -0.07 -0.95 0.00 0.00 178.83 179.10 1s9g h LEU 525 N 0.33 0.65 -1.32 1.46 3.38 0.19 -2.46 115.31 117.53 1s9g h LEU 525 Ca -0.04 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 1s9g h LEU 525 Cb 1.33 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.89 1s9g h LEU 525 CO 0.13 0.55 0.24 0.40 0.09 0.00 0.00 178.44 179.86 1s9g h ILE 526 N 0.69 1.17 -0.26 1.22 2.04 -1.35 -2.99 117.51 118.02 1s9g h ILE 526 Ca 0.18 -0.48 -0.06 0.00 1.00 0.00 0.00 64.86 65.50 1s9g h ILE 526 Cb 0.05 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 36.65 1s9g h ILE 526 CO -0.03 0.20 -0.07 0.50 0.00 0.00 0.00 178.15 178.75 1s9g h LYS 527 N 0.71 0.51 -7.12 2.37 3.64 -1.20 -3.45 116.57 112.03 1s9g h LYS 527 Ca 0.18 -0.20 -0.46 0.00 -1.27 0.00 0.00 60.65 58.90 1s9g h LYS 527 Cb 0.08 -0.03 0.21 0.00 -0.41 0.00 0.00 32.23 32.08 1s9g h LYS 527 CO -0.02 0.73 -0.05 1.63 -2.27 0.00 0.00 179.45 179.47 1s9g n LYS 528 N -4.53 -1.89 -0.01 1.90 4.76 -1.03 -4.99 118.16 112.38 1s9g n LYS 528 Ca -0.04 -0.51 0.07 0.00 -2.87 0.00 0.00 58.31 54.96 1s9g n LYS 528 Cb 0.31 -2.18 -0.11 0.00 -1.84 0.00 0.00 35.03 31.21 1s9g n LYS 528 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 1s9g n GLU 529 N -4.51 0.46 -3.19 1.97 4.07 0.17 -4.94 120.64 114.67 1s9g n GLU 529 Ca 0.05 -0.13 0.02 0.00 -0.06 0.00 0.00 57.16 57.04 1s9g n GLU 529 Cb 0.54 -1.34 -0.02 0.00 -0.06 0.00 0.00 31.44 30.56 1s9g n GLU 529 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 1s9g s LYS 530 N -2.99 0.53 -0.03 5.31 1.02 -1.14 -5.02 119.74 117.43 1s9g s LYS 530 Ca -0.05 0.91 0.07 0.00 0.02 0.00 0.00 55.97 56.92 1s9g s LYS 530 Cb 0.09 0.37 -0.02 0.00 -0.52 0.00 0.00 37.83 37.75 1s9g s LYS 530 CO 0.60 -0.64 -0.23 0.08 -0.92 0.00 0.00 175.35 174.24 1s9g s VAL 531 N 2.80 1.87 -0.14 3.17 1.01 -1.26 -0.34 120.40 127.51 1s9g s VAL 531 Ca 0.19 -1.00 -0.03 0.00 0.00 0.00 0.00 61.98 61.14 1s9g s VAL 531 Cb -0.15 -1.56 0.05 0.00 0.00 0.00 0.00 36.38 34.72 1s9g s VAL 531 CO -0.20 0.53 0.06 -0.47 0.00 0.00 0.00 175.10 175.01 1s9g s TYR 532 N -0.47 0.43 -0.12 5.22 6.14 -0.75 0.43 117.35 128.24 1s9g s TYR 532 Ca 0.07 -0.31 -0.05 0.00 0.64 0.00 0.00 57.07 57.41 1s9g s TYR 532 Cb -0.10 -0.75 -0.04 0.00 0.42 0.00 0.00 41.96 41.50 1s9g s TYR 532 CO -0.00 -0.45 0.08 -0.51 0.64 0.00 0.00 175.55 175.31 1s9g s LEU 533 N 2.05 4.02 -0.01 6.97 1.43 -1.26 -0.03 118.68 131.87 1s9g s LEU 533 Ca 0.02 0.30 0.01 0.00 -1.03 0.00 0.00 54.13 53.43 1s9g s LEU 533 Cb -0.15 -1.97 0.00 0.00 0.03 0.00 0.00 46.19 44.11 1s9g s LEU 533 CO -0.07 0.37 -0.03 0.00 0.23 0.00 0.00 176.35 176.85 1s9g s ALA 534 N -0.79 0.27 -0.05 4.21 0.00 -0.18 -4.95 121.76 120.26 1s9g s ALA 534 Ca 0.13 -0.08 -0.13 0.00 0.00 0.00 0.00 51.96 51.88 1s9g s ALA 534 Cb -0.12 -0.11 -0.05 0.00 0.00 0.00 0.00 23.12 22.84 1s9g s ALA 534 CO 0.03 0.04 0.33 -0.46 0.00 0.00 0.00 175.76 175.70 1s9g s TRP 535 N 0.13 3.66 -0.01 0.00 -0.00 -1.26 -1.23 118.94 120.23 1s9g s TRP 535 Ca -0.01 0.84 0.01 0.00 -0.00 0.00 0.00 56.10 56.93 1s9g s TRP 535 Cb -0.04 -2.22 0.01 0.00 -0.00 0.00 0.00 33.47 31.22 1s9g s TRP 535 CO -0.00 0.61 -0.01 0.08 -0.00 0.00 0.00 176.95 177.62 1s9g s VAL 536 N -0.84 0.17 0.29 5.86 1.01 -0.75 -4.97 120.40 121.17 1s9g s VAL 536 Ca 0.21 -0.02 -0.27 0.00 0.00 0.00 0.00 61.98 61.90 1s9g s VAL 536 Cb -0.15 -0.20 -0.15 0.00 0.00 0.00 0.00 36.38 35.89 1s9g s VAL 536 CO 0.10 0.09 0.77 -2.65 0.00 0.00 0.00 175.10 173.41 1s9g n PRO 537 N 3.47 0.79 0.00 2.72 -0.02 -1.26 -4.22 135.00 136.48 1s9g n PRO 537 Ca -0.18 0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 1s9g n PRO 537 Cb 0.56 -1.52 0.00 0.00 -0.02 0.00 0.00 33.50 32.51 1s9g n PRO 537 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1s9g n ALA 538 N -0.06 0.00 -0.49 3.55 0.00 -1.25 -3.34 120.51 118.91 1s9g n ALA 538 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1s9g n ALA 538 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.76 1s9g n ALA 538 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1s9g n HIS 539 N 0.00 0.00 -0.07 0.00 8.25 -1.26 -2.04 115.22 120.10 1s9g n HIS 539 Ca 0.00 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.39 1s9g n HIS 539 Cb 0.00 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.10 1s9g n HIS 539 CO 0.00 0.00 0.00 1.57 0.64 0.00 0.00 176.34 178.55 1s9g h LYS 540 N 0.00 -0.18 0.00 -0.41 2.10 -2.02 -3.37 116.57 112.69 1s9g h LYS 540 Ca 0.00 0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.66 1s9g h LYS 540 Cb 0.00 0.04 0.00 0.00 -0.90 0.00 0.00 32.23 31.37 1s9g h LYS 540 CO 0.00 -0.12 0.00 0.41 -2.00 0.00 0.00 179.45 177.74 1s9g n GLY 541 N -1.36 0.00 3.81 0.07 0.00 -0.86 -4.73 105.19 102.11 1s9g n GLY 541 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1s9g n GLY 541 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1s9g s ILE 542 N 0.00 1.21 0.00 -0.61 2.07 -1.24 -4.96 121.20 117.67 1s9g s ILE 542 Ca 0.00 -1.88 0.00 0.00 -1.41 0.00 0.00 60.65 57.36 1s9g s ILE 542 Cb 0.00 -2.09 0.00 0.00 0.13 0.00 0.00 42.46 40.50 1s9g s ILE 542 CO 0.00 0.00 0.47 0.61 -1.91 0.00 0.00 174.94 174.11