#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x1e s LEU 2 N 0.00 4.35 -0.21 -0.89 2.96 -1.26 -4.89 118.68 118.74 2x1e s LEU 2 Ca 0.00 2.36 -0.01 0.00 -0.22 0.00 0.00 54.13 56.26 2x1e s LEU 2 Cb 0.00 -3.55 0.02 0.00 0.50 0.00 0.00 46.19 43.16 2x1e s LEU 2 CO 0.00 -0.88 -0.13 -2.28 -1.32 0.00 0.00 176.35 171.74 2x1e s HIS 3 N 3.10 2.92 -0.19 5.38 5.65 -1.26 -1.13 115.29 129.76 2x1e s HIS 3 Ca 0.73 -1.51 -0.03 0.00 0.25 0.00 0.00 55.06 54.50 2x1e s HIS 3 Cb -0.37 -1.99 -0.01 0.00 -1.18 0.00 0.00 32.58 29.03 2x1e s HIS 3 CO 0.31 -0.74 -0.08 0.42 -0.65 0.00 0.00 174.74 174.00 2x1e s ILE 4 N 1.33 3.20 -0.29 0.89 1.01 -0.32 -5.01 121.20 122.01 2x1e s ILE 4 Ca 0.03 -0.57 -0.20 0.00 0.00 0.00 0.00 60.65 59.91 2x1e s ILE 4 Cb -0.15 -2.42 -0.01 0.00 0.01 0.00 0.00 42.46 39.89 2x1e s ILE 4 CO -0.08 0.46 0.64 -0.22 0.00 0.00 0.00 174.94 175.73 2x1e s LEU 5 N 1.16 4.11 -0.13 2.97 2.96 -1.26 -1.21 118.68 127.27 2x1e s LEU 5 Ca 0.02 0.54 0.00 0.00 -0.22 0.00 0.00 54.13 54.47 2x1e s LEU 5 Cb -0.14 -2.84 -0.01 0.00 0.50 0.00 0.00 46.19 43.69 2x1e s LEU 5 CO -0.02 -0.44 -0.15 0.00 -1.32 0.00 0.00 176.35 174.42 2x1e s GLN 7 N 0.45 0.96 0.00 0.00 -2.07 -1.26 -0.82 119.66 116.92 2x1e s GLN 7 Ca -0.11 -0.83 0.00 0.00 -1.82 0.00 0.00 55.36 52.60 2x1e s GLN 7 Cb -0.16 0.41 0.00 0.00 -1.09 0.00 0.00 33.01 32.17 2x1e s GLN 7 CO 0.05 -0.35 0.00 0.41 -1.32 0.00 0.00 175.29 174.08 2x1e n GLY 8 N -0.15 -0.03 3.70 2.60 0.00 -1.25 -4.05 105.19 106.01 2x1e n GLY 8 Ca -0.15 -2.00 -0.30 0.00 0.00 0.00 0.00 46.02 43.57 2x1e n GLY 8 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2x1e s THR 9 N 0.00 2.67 0.28 2.61 -4.23 -1.26 -4.71 115.64 110.99 2x1e s THR 9 Ca 0.00 0.22 0.01 0.00 -1.18 0.00 0.00 61.69 60.74 2x1e s THR 9 Cb 0.00 -2.57 0.28 0.00 1.34 0.00 0.00 72.50 71.55 2x1e s THR 9 CO 0.00 -0.28 1.82 -0.65 -0.54 0.00 0.00 174.62 174.97 2x1e h PRO 10 N -1.60 0.92 -0.04 3.99 0.11 -1.93 -0.65 132.00 132.79 2x1e h PRO 10 Ca -0.48 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.58 2x1e h PRO 10 Cb 1.27 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 2x1e h PRO 10 CO 0.51 0.61 0.00 0.35 -0.21 0.00 0.00 178.00 179.26 2x1e h PHE 11 N 0.95 0.01 -0.59 0.65 3.04 -1.89 -0.64 116.94 118.46 2x1e h PHE 11 Ca 0.50 0.00 -0.00 0.00 3.98 0.00 0.00 57.97 62.45 2x1e h PHE 11 Cb 0.53 0.00 -0.03 0.00 2.56 0.00 0.00 35.95 39.02 2x1e h PHE 11 CO -0.01 0.00 0.36 0.93 -2.02 0.00 0.00 178.31 177.57 2x1e h GLU 12 N 0.02 0.79 -0.35 1.11 5.08 -1.74 0.52 114.58 120.01 2x1e h GLU 12 Ca 0.02 -0.07 0.06 0.00 -1.00 0.00 0.00 59.36 58.37 2x1e h GLU 12 Cb 0.02 -0.17 -0.05 0.00 0.50 0.00 0.00 28.75 29.05 2x1e h GLU 12 CO -0.02 0.56 0.03 0.82 -1.00 0.00 0.00 179.01 179.40 2x1e h ILE 13 N 0.79 0.78 0.06 3.13 2.04 -1.00 -0.94 117.51 122.37 2x1e h ILE 13 Ca 0.21 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 66.02 2x1e h ILE 13 Cb -0.03 0.63 -0.00 0.00 -0.74 0.00 0.00 36.82 36.67 2x1e h ILE 13 CO -0.04 0.03 -0.05 1.23 0.00 0.00 0.00 178.15 179.31 2x1e h GLY 14 N 0.14 -0.11 0.49 5.37 0.00 -0.29 -2.79 103.07 105.89 2x1e h GLY 14 Ca 0.17 0.06 0.07 0.00 0.00 0.00 0.00 47.33 47.62 2x1e h GLY 14 CO -0.25 -0.06 0.11 -1.82 0.00 0.00 0.00 176.54 174.52 2x1e h TYR 15 N -0.12 0.19 -0.74 5.60 5.03 0.40 0.13 116.97 127.46 2x1e h TYR 15 Ca 0.00 0.03 0.04 0.00 2.58 0.00 0.00 58.73 61.37 2x1e h TYR 15 Cb 0.12 -0.02 -0.05 0.00 1.55 0.00 0.00 36.73 38.33 2x1e h TYR 15 CO -0.10 0.04 0.46 1.49 -1.32 0.00 0.00 178.16 178.73 2x1e h GLU 16 N 0.26 0.85 0.31 1.82 4.57 -1.18 0.60 114.58 121.80 2x1e h GLU 16 Ca 0.22 -0.05 -0.02 0.00 -1.18 0.00 0.00 59.36 58.33 2x1e h GLU 16 Cb 0.25 -0.19 0.00 0.00 -0.16 0.00 0.00 28.75 28.66 2x1e h GLU 16 CO -0.26 0.56 -0.15 1.25 -1.18 0.00 0.00 179.01 179.23 2x1e h HIS 17 N 0.88 -0.38 -0.30 0.92 2.76 -1.10 -2.45 115.15 115.48 2x1e h HIS 17 Ca 0.30 -0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.47 2x1e h HIS 17 Cb 0.06 0.13 -0.02 0.00 1.55 0.00 0.00 27.41 29.13 2x1e h HIS 17 CO -0.04 -0.20 0.18 0.78 -1.30 0.00 0.00 177.93 177.35 2x1e h GLY 18 N -0.47 0.41 0.83 5.26 0.00 -0.32 -2.02 103.07 106.76 2x1e h GLY 18 Ca -0.04 -0.14 -0.14 0.00 0.00 0.00 0.00 47.33 47.01 2x1e h GLY 18 CO 0.07 0.13 -0.48 1.48 0.00 0.00 0.00 176.54 177.73 2x1e h SER 19 N 0.37 0.57 0.94 0.19 4.64 -0.84 -1.60 113.55 117.81 2x1e h SER 19 Ca 0.12 -0.66 -0.04 0.00 -0.47 0.00 0.00 61.79 60.74 2x1e h SER 19 Cb -0.01 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 61.90 2x1e h SER 19 CO -0.05 1.14 -0.18 0.00 -0.87 0.00 0.00 176.83 176.86 2x1e h ALA 20 N 0.45 1.02 -0.23 5.18 0.00 -1.46 -2.96 119.26 121.26 2x1e h ALA 20 Ca -0.04 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2x1e h ALA 20 Cb 1.14 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2x1e h ALA 20 CO 0.10 0.23 0.00 0.00 0.00 0.00 0.00 179.25 179.58 2x1e n ALA 21 N -2.20 2.90 -0.13 0.00 0.00 -0.76 -4.86 120.51 115.47 2x1e n ALA 21 Ca 0.00 -2.33 -0.09 0.00 0.00 0.00 0.00 53.44 51.03 2x1e n ALA 21 Cb 0.41 -0.67 -0.03 0.00 0.00 0.00 0.00 19.45 19.15 2x1e n ALA 21 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2x1e h LYS 22 N 1.61 -0.28 -0.14 0.00 3.64 -1.11 0.69 116.57 120.98 2x1e h LYS 22 Ca 0.00 0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.35 2x1e h LYS 22 Cb 1.39 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.26 2x1e h LYS 22 CO 0.20 -0.19 -0.12 0.00 -2.27 0.00 0.00 179.45 177.07 2x1e h ALA 23 N 0.60 1.55 -0.07 5.00 0.00 -1.87 -2.55 119.26 121.91 2x1e h ALA 23 Ca 0.16 -0.19 -0.22 0.00 0.00 0.00 0.00 54.91 54.65 2x1e h ALA 23 Cb 0.57 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.28 2x1e h ALA 23 CO -0.56 0.33 -0.86 0.28 0.00 0.00 0.00 179.25 178.43 2x1e h VAL 24 N 0.21 1.33 -0.71 0.00 2.07 -1.36 -3.13 116.25 114.66 2x1e h VAL 24 Ca 0.04 -2.17 -0.05 0.00 0.82 0.00 0.00 66.70 65.34 2x1e h VAL 24 Cb 0.34 2.19 -0.03 0.00 -1.52 0.00 0.00 31.29 32.27 2x1e h VAL 24 CO 0.02 0.67 0.25 0.40 0.02 0.00 0.00 177.57 178.93 2x1e h ILE 25 N 0.38 1.25 -0.84 4.57 2.04 -0.64 -0.79 117.51 123.47 2x1e h ILE 25 Ca -0.07 -0.83 0.07 0.00 1.00 0.00 0.00 64.86 65.04 2x1e h ILE 25 Cb 1.49 0.43 -0.07 0.00 -0.74 0.00 0.00 36.82 37.93 2x1e h ILE 25 CO 0.16 0.33 0.51 0.00 0.00 0.00 0.00 178.15 179.15 2x1e h ALA 26 N 1.23 1.18 -0.42 1.87 0.00 -1.46 0.33 119.26 121.99 2x1e h ALA 26 Ca 0.23 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.08 2x1e h ALA 26 Cb 0.25 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2x1e h ALA 26 CO -0.01 0.21 -0.03 0.00 0.00 0.00 0.00 179.25 179.42 2x1e h ARG 27 N 0.91 0.76 -0.61 0.00 3.08 -1.37 -1.77 114.38 115.37 2x1e h ARG 27 Ca 0.38 -0.26 0.05 0.00 0.07 0.00 0.00 59.98 60.23 2x1e h ARG 27 Cb 0.24 -0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.17 2x1e h ARG 27 CO -0.20 0.85 0.33 0.77 -1.07 0.00 0.00 179.97 180.65 2x1e h SER 28 N 0.58 0.48 -0.10 7.04 0.02 -0.56 -0.65 113.55 120.37 2x1e h SER 28 Ca 0.11 0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 61.09 2x1e h SER 28 Cb 0.53 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.00 2x1e h SER 28 CO 0.03 0.32 0.05 0.40 -1.14 0.00 0.00 176.83 176.48 2x1e h ILE 29 N 0.62 1.12 -0.56 3.27 2.04 -0.84 -0.08 117.51 123.08 2x1e h ILE 29 Ca 0.27 -0.35 0.06 0.00 1.00 0.00 0.00 64.86 65.85 2x1e h ILE 29 Cb 0.17 1.17 -0.05 0.00 -0.74 0.00 0.00 36.82 37.37 2x1e h ILE 29 CO -0.18 0.10 0.26 0.44 0.00 0.00 0.00 178.15 178.78 2x1e h ASP 30 N 0.03 0.35 -0.01 1.72 3.32 -1.11 -0.76 116.42 119.95 2x1e h ASP 30 Ca 0.03 0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.13 2x1e h ASP 30 Cb 0.13 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 39.66 2x1e h ASP 30 CO -0.00 0.23 0.00 0.15 -1.72 0.00 0.00 179.24 177.90 2x1e h PHE 31 N 0.49 0.02 -0.74 4.55 3.57 -0.97 -2.62 116.94 121.25 2x1e h PHE 31 Ca 0.26 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.82 2x1e h PHE 31 Cb 0.21 -0.01 -0.06 0.00 2.79 0.00 0.00 35.95 38.89 2x1e h PHE 31 CO -0.12 0.30 0.43 0.00 -2.23 0.00 0.00 178.31 176.68 2x1e h ALA 32 N 0.72 1.00 -0.36 2.41 0.00 -0.80 0.36 119.26 122.60 2x1e h ALA 32 Ca 0.00 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2x1e h ALA 32 Cb 0.29 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2x1e h ALA 32 CO 0.00 0.12 0.22 0.28 0.00 0.00 0.00 179.25 179.87 2x1e h VAL 33 N 0.78 1.12 -0.69 0.00 2.07 -1.15 -0.50 116.25 117.89 2x1e h VAL 33 Ca 0.33 -0.29 -0.04 0.00 0.82 0.00 0.00 66.70 67.52 2x1e h VAL 33 Cb 0.20 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 2x1e h VAL 33 CO -0.19 0.12 0.29 0.44 0.02 0.00 0.00 177.57 178.26 2x1e h ASP 34 N 0.47 0.94 0.26 0.57 3.32 -1.02 -1.13 116.42 119.83 2x1e h ASP 34 Ca 0.13 -0.16 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 2x1e h ASP 34 Cb 0.01 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.32 2x1e h ASP 34 CO -0.02 0.84 -0.12 0.25 -1.72 0.00 0.00 179.24 178.46 2x1e h LEU 35 N 0.97 -0.29 -0.38 1.55 5.85 -0.79 -1.45 115.31 120.77 2x1e h LEU 35 Ca 0.23 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.91 2x1e h LEU 35 Cb 0.18 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.27 2x1e h LEU 35 CO -0.02 -0.15 0.25 0.40 -0.34 0.00 0.00 178.44 178.58 2x1e h ILE 36 N -0.42 1.10 -0.83 4.05 2.04 -0.99 0.32 117.51 122.79 2x1e h ILE 36 Ca -0.04 -0.19 -0.04 0.00 1.00 0.00 0.00 64.86 65.60 2x1e h ILE 36 Cb 0.32 0.54 -0.04 0.00 -0.74 0.00 0.00 36.82 36.90 2x1e h ILE 36 CO 0.06 0.10 0.37 0.03 0.00 0.00 0.00 178.15 178.71 2x1e h ARG 37 N 0.52 1.22 -0.22 2.37 3.08 -1.23 -1.84 114.38 118.27 2x1e h ARG 37 Ca 0.14 -0.20 -0.18 0.00 0.07 0.00 0.00 59.98 59.82 2x1e h ARG 37 Cb -0.05 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 29.79 2x1e h ARG 37 CO -0.03 0.95 -0.56 0.78 -1.07 0.00 0.00 179.97 180.05 2x1e h GLY 38 N 1.20 0.85 2.00 0.04 0.00 -0.78 -2.96 103.07 103.42 2x1e h GLY 38 Ca 0.28 -1.05 -0.16 0.00 0.00 0.00 0.00 47.33 46.40 2x1e h GLY 38 CO -0.03 0.94 -0.76 0.50 0.00 0.00 0.00 176.54 177.19 2x1e h LYS 39 N 0.51 0.00 0.00 4.80 1.79 -0.30 -3.38 116.57 119.99 2x1e h LYS 39 Ca -0.01 0.00 -0.31 0.00 -2.18 0.00 0.00 60.65 58.15 2x1e h LYS 39 Cb 1.17 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 31.77 2x1e h LYS 39 CO 0.12 0.76 -2.17 0.25 -1.08 0.00 0.00 179.45 177.33 2x1e n THR 40 N -3.49 1.18 -0.60 -0.16 -2.24 -0.70 -1.54 114.28 106.73 2x1e n THR 40 Ca -0.00 -0.68 -0.01 0.00 -2.27 0.00 0.00 64.05 61.09 2x1e n THR 40 Cb 0.77 -0.66 -0.01 0.00 -2.10 0.00 0.00 70.33 68.34 2x1e n THR 40 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2x1e n LYS 41 N -2.71 -1.91 -1.75 -0.78 4.76 -1.12 -4.30 118.16 110.35 2x1e n LYS 41 Ca -0.29 0.30 -0.33 0.00 -2.87 0.00 0.00 58.31 55.11 2x1e n LYS 41 Cb 1.03 -3.88 0.05 0.00 -1.84 0.00 0.00 35.03 30.39 2x1e n LYS 41 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2x1e s LYS 42 N -1.23 2.76 0.55 1.97 -0.14 -1.26 -5.00 119.74 117.38 2x1e s LYS 42 Ca 0.00 1.45 -0.21 0.00 -1.36 0.00 0.00 55.97 55.85 2x1e s LYS 42 Cb 0.00 -1.94 -0.05 0.00 -1.68 0.00 0.00 37.83 34.16 2x1e s LYS 42 CO 0.00 -1.29 1.33 0.95 -0.76 0.00 0.00 175.35 175.58 2x1e s THR 43 N -2.25 2.18 0.34 2.17 -4.23 -1.26 -4.84 115.64 107.75 2x1e s THR 43 Ca 0.68 0.13 0.04 0.00 -1.18 0.00 0.00 61.69 61.37 2x1e s THR 43 Cb -0.22 -3.07 0.29 0.00 1.34 0.00 0.00 72.50 70.85 2x1e s THR 43 CO 0.41 -0.00 1.93 -0.78 -0.54 0.00 0.00 174.62 175.63 2x1e h ASP 44 N 1.41 0.76 -0.63 3.99 3.58 -1.99 -0.93 116.42 122.61 2x1e h ASP 44 Ca -0.51 0.01 -0.03 0.00 0.42 0.00 0.00 57.03 56.92 2x1e h ASP 44 Cb 1.30 -0.15 -0.03 0.00 1.72 0.00 0.00 39.33 42.17 2x1e h ASP 44 CO 0.57 0.48 0.27 -0.33 -2.88 0.00 0.00 179.24 177.35 2x1e h GLU 45 N 0.86 0.93 -0.82 0.28 4.39 -1.99 0.14 114.58 118.37 2x1e h GLU 45 Ca 0.36 -0.16 0.00 0.00 0.34 0.00 0.00 59.36 59.90 2x1e h GLU 45 Cb 0.28 -0.16 -0.04 0.00 -0.10 0.00 0.00 28.75 28.74 2x1e h GLU 45 CO -0.13 0.77 0.52 0.93 -1.16 0.00 0.00 179.01 179.94 2x1e h GLU 46 N 0.88 1.09 -0.60 2.33 5.08 -1.66 -2.03 114.58 119.66 2x1e h GLU 46 Ca 0.21 -0.08 -0.08 0.00 -1.00 0.00 0.00 59.36 58.41 2x1e h GLU 46 Cb 0.17 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 2x1e h GLU 46 CO -0.02 0.74 0.06 -0.07 -1.00 0.00 0.00 179.01 178.71 2x1e h LEU 47 N 1.11 0.99 -0.97 1.33 3.38 -0.72 -2.74 115.31 117.70 2x1e h LEU 47 Ca 0.30 -0.28 0.05 0.00 0.09 0.00 0.00 57.88 58.04 2x1e h LEU 47 Cb -0.10 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.33 2x1e h LEU 47 CO -0.06 1.03 0.63 0.50 0.09 0.00 0.00 178.44 180.62 2x1e h LYS 48 N 0.93 1.14 -0.38 1.13 3.64 -0.49 -0.78 116.57 121.76 2x1e h LYS 48 Ca 0.18 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.47 2x1e h LYS 48 Cb 0.48 -0.26 -0.02 0.00 -0.41 0.00 0.00 32.23 32.03 2x1e h LYS 48 CO 0.02 0.75 0.16 1.96 -2.27 0.00 0.00 179.45 180.08 2x1e h GLN 49 N 1.17 0.56 -0.59 1.90 1.08 -1.09 0.26 115.11 118.40 2x1e h GLN 49 Ca 0.40 -0.09 -0.07 0.00 -1.45 0.00 0.00 58.65 57.44 2x1e h GLN 49 Cb 0.09 -0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 27.40 2x1e h GLN 49 CO -0.15 0.52 0.09 0.28 -0.95 0.00 0.00 178.83 178.62 2x1e h VAL 50 N 0.47 1.26 -0.79 -0.54 2.07 -1.25 -2.41 116.25 115.06 2x1e h VAL 50 Ca 0.13 -1.01 -0.04 0.00 0.82 0.00 0.00 66.70 66.60 2x1e h VAL 50 Cb 0.16 0.76 -0.04 0.00 -1.52 0.00 0.00 31.29 30.66 2x1e h VAL 50 CO -0.01 0.37 0.35 0.25 0.02 0.00 0.00 177.57 178.54 2x1e h LEU 51 N 0.88 1.07 -0.21 2.57 5.85 -0.75 -1.30 115.31 123.42 2x1e h LEU 51 Ca 0.18 -0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.77 2x1e h LEU 51 Cb 0.44 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.16 2x1e h LEU 51 CO 0.01 0.93 0.05 -1.28 -0.34 0.00 0.00 178.44 177.81 2x1e h SER 52 N 1.14 0.03 -0.22 1.25 0.87 -0.71 -1.75 113.55 114.15 2x1e h SER 52 Ca 0.27 0.03 -0.05 0.00 -1.23 0.00 0.00 61.79 60.81 2x1e h SER 52 Cb 0.17 0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.16 2x1e h SER 52 CO -0.03 0.05 -0.05 -0.61 -0.53 0.00 0.00 176.83 175.66 2x1e h GLN 53 N 0.14 0.43 -0.60 2.24 4.15 -1.22 -2.35 115.11 117.89 2x1e h GLN 53 Ca 0.09 -0.16 0.08 0.00 0.77 0.00 0.00 58.65 59.43 2x1e h GLN 53 Cb 0.08 -0.03 -0.07 0.00 0.21 0.00 0.00 27.48 27.68 2x1e h GLN 53 CO -0.12 0.67 0.25 -0.07 -1.93 0.00 0.00 178.83 177.63 2x1e h LEU 54 N 0.16 0.29 -0.33 -2.39 3.38 -1.18 0.96 115.31 116.20 2x1e h LEU 54 Ca 0.06 0.06 0.04 0.00 0.09 0.00 0.00 57.88 58.13 2x1e h LEU 54 Cb 0.50 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.24 2x1e h LEU 54 CO 0.02 0.18 0.11 1.23 0.09 0.00 0.00 178.44 180.07 2x1e h GLY 55 N 0.45 0.42 0.99 0.83 0.00 -1.26 -0.47 103.07 104.03 2x1e h GLY 55 Ca 0.29 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.56 2x1e h GLY 55 CO -0.27 0.03 0.11 3.21 0.00 0.00 0.00 176.54 179.62 2x1e h ARG 56 N 0.25 0.23 -0.18 4.80 3.08 -0.85 -2.23 114.38 119.48 2x1e h ARG 56 Ca 0.15 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.19 2x1e h ARG 56 Cb 0.13 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 2x1e h ARG 56 CO -0.16 0.15 0.11 0.28 -1.07 0.00 0.00 179.97 179.28 2x1e h VAL 57 N 0.23 1.07 -0.22 2.04 2.07 -0.58 -1.76 116.25 119.11 2x1e h VAL 57 Ca 0.07 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.41 2x1e h VAL 57 Cb -0.02 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 2x1e h VAL 57 CO -0.02 0.07 0.11 0.40 0.02 0.00 0.00 177.57 178.15 2x1e h ILE 58 N 0.22 1.13 -0.54 4.57 2.04 -1.04 0.31 117.51 124.20 2x1e h ILE 58 Ca 0.07 -0.36 0.06 0.00 1.00 0.00 0.00 64.86 65.63 2x1e h ILE 58 Cb 0.02 0.96 -0.05 0.00 -0.74 0.00 0.00 36.82 37.00 2x1e h ILE 58 CO -0.01 0.12 0.24 -0.08 0.00 0.00 0.00 178.15 178.42 2x1e h GLU 59 N 0.24 0.44 -0.16 2.37 4.81 -1.32 0.93 114.58 121.89 2x1e h GLU 59 Ca 0.08 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.20 2x1e h GLU 59 Cb 0.10 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.37 2x1e h GLU 59 CO -0.01 0.29 -0.19 1.49 -0.73 0.00 0.00 179.01 179.86 2x1e h GLU 60 N 0.46 0.42 0.17 1.92 4.81 -0.97 -3.27 114.58 118.10 2x1e h GLU 60 Ca 0.25 -0.23 -0.35 0.00 -0.13 0.00 0.00 59.36 58.90 2x1e h GLU 60 Cb 0.22 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.62 2x1e h GLU 60 CO -0.21 0.81 -1.80 0.00 -0.73 0.00 0.00 179.01 177.07 2x1e h ARG 61 N 0.06 0.35 -2.24 1.92 3.08 -0.26 -3.41 114.38 113.89 2x1e h ARG 61 Ca 0.02 -0.60 -0.59 0.00 0.07 0.00 0.00 59.98 58.88 2x1e h ARG 61 Cb 0.75 0.22 -0.41 0.00 0.08 0.00 0.00 29.97 30.61 2x1e h ARG 61 CO 0.05 1.29 -0.75 0.91 -1.07 0.00 0.00 179.97 180.40 2x1e n TRP 62 N -3.59 2.32 -0.11 3.04 8.01 0.31 -4.96 117.44 122.46 2x1e n TRP 62 Ca -0.27 -3.97 0.03 0.00 -1.31 0.00 0.00 57.50 51.98 2x1e n TRP 62 Cb 1.06 -0.47 0.35 0.00 -2.01 0.00 0.00 31.31 30.23 2x1e n TRP 62 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 2x1e h PRO 63 N 4.32 0.73 -0.83 -0.99 0.13 -1.66 -0.46 132.00 133.24 2x1e h PRO 63 Ca 0.16 -0.04 -0.02 0.00 -0.87 0.00 0.00 66.00 65.23 2x1e h PRO 63 Cb 0.74 -0.17 -0.04 0.00 0.13 0.00 0.00 31.00 31.67 2x1e h PRO 63 CO 0.70 0.49 0.45 0.87 -0.23 0.00 0.00 178.00 180.28 2x1e h LYS 64 N 0.76 1.15 -0.05 0.86 1.57 -1.91 0.11 116.57 119.04 2x1e h LYS 64 Ca 0.23 -0.13 -0.19 0.00 -1.87 0.00 0.00 60.65 58.68 2x1e h LYS 64 Cb -0.02 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.06 2x1e h LYS 64 CO -0.05 0.84 -0.79 1.88 -0.57 0.00 0.00 179.45 180.76 2x1e h TYR 65 N 1.16 0.55 -0.67 -1.35 0.05 -1.66 -2.86 116.97 112.18 2x1e h TYR 65 Ca 0.29 -0.26 -0.07 0.00 0.05 0.00 0.00 58.73 58.74 2x1e h TYR 65 Cb 0.03 -0.08 -0.03 0.00 1.01 0.00 0.00 36.73 37.66 2x1e h TYR 65 CO 0.01 1.03 0.13 -0.92 -1.05 0.00 0.00 178.16 177.36 2x1e h TYR 66 N 0.26 1.16 -0.81 4.88 3.20 -0.71 -0.48 116.97 124.45 2x1e h TYR 66 Ca -0.04 -0.15 0.01 0.00 3.14 0.00 0.00 58.73 61.68 2x1e h TYR 66 Cb 1.38 -0.32 -0.04 0.00 1.54 0.00 0.00 36.73 39.29 2x1e h TYR 66 CO 0.05 0.96 0.54 1.49 -1.64 0.00 0.00 178.16 179.55 2x1e h GLU 67 N 1.02 1.07 -0.44 1.82 4.81 -0.80 0.12 114.58 122.17 2x1e h GLU 67 Ca 0.21 -0.07 -0.06 0.00 -0.13 0.00 0.00 59.36 59.31 2x1e h GLU 67 Cb 0.41 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 2x1e h GLU 67 CO 0.01 0.71 0.04 1.49 -0.73 0.00 0.00 179.01 180.53 2x1e h GLU 68 N 1.10 0.75 -0.69 1.92 4.81 -1.26 -0.94 114.58 120.28 2x1e h GLU 68 Ca 0.30 -0.22 0.03 0.00 -0.13 0.00 0.00 59.36 59.34 2x1e h GLU 68 Cb -0.12 -0.08 -0.05 0.00 0.63 0.00 0.00 28.75 29.13 2x1e h GLU 68 CO -0.06 0.80 0.43 0.82 -0.73 0.00 0.00 179.01 180.26 2x1e h ILE 69 N 0.61 1.07 -0.93 2.32 2.04 -0.68 -0.18 117.51 121.77 2x1e h ILE 69 Ca 0.13 -0.28 -0.01 0.00 1.00 0.00 0.00 64.86 65.70 2x1e h ILE 69 Cb 0.44 0.18 -0.04 0.00 -0.74 0.00 0.00 36.82 36.65 2x1e h ILE 69 CO 0.02 0.15 0.54 0.03 0.00 0.00 0.00 178.15 178.88 2x1e h ARG 70 N 0.82 1.27 -0.52 2.37 3.08 -0.52 -0.96 114.38 119.93 2x1e h ARG 70 Ca 0.28 -0.13 -0.03 0.00 0.07 0.00 0.00 59.98 60.17 2x1e h ARG 70 Cb 0.05 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 29.81 2x1e h ARG 70 CO -0.12 0.91 0.20 0.78 -1.07 0.00 0.00 179.97 180.66 2x1e h GLY 71 N 1.28 0.85 1.00 0.04 0.00 -0.57 -0.56 103.07 105.11 2x1e h GLY 71 Ca 0.33 -0.48 0.00 0.00 0.00 0.00 0.00 47.33 47.19 2x1e h GLY 71 CO -0.06 0.45 0.21 -2.22 0.00 0.00 0.00 176.54 174.92 2x1e h ILE 72 N 0.71 1.08 -0.25 2.60 2.04 -0.75 -0.54 117.51 122.40 2x1e h ILE 72 Ca 0.17 -0.14 0.02 0.00 1.00 0.00 0.00 64.86 65.91 2x1e h ILE 72 Cb 0.22 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 36.90 2x1e h ILE 72 CO -0.01 0.08 0.10 0.00 0.00 0.00 0.00 178.15 178.31 2x1e h ALA 73 N 1.11 0.28 -0.16 1.87 0.00 -0.98 0.14 119.26 121.52 2x1e h ALA 73 Ca 0.11 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.05 2x1e h ALA 73 Cb -0.05 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2x1e h ALA 73 CO -0.03 -0.31 0.09 -0.22 0.00 0.00 0.00 179.25 178.78 2x1e h LYS 74 N 0.22 0.18 -0.70 0.00 1.63 -0.96 0.36 116.57 117.30 2x1e h LYS 74 Ca 0.11 -0.01 -0.07 0.00 -0.85 0.00 0.00 60.65 59.82 2x1e h LYS 74 Cb 0.06 -0.04 -0.03 0.00 -0.60 0.00 0.00 32.23 31.62 2x1e h LYS 74 CO -0.10 0.12 0.14 0.78 -3.45 0.00 0.00 179.45 176.95 2x1e h GLY 75 N 0.19 1.22 -0.13 5.01 0.00 -0.85 -2.80 103.07 105.71 2x1e h GLY 75 Ca 0.06 -0.79 0.00 0.00 0.00 0.00 0.00 47.33 46.61 2x1e h GLY 75 CO -0.03 0.73 0.00 0.00 0.00 0.00 0.00 176.54 177.24 2x1e n ALA 76 N -2.46 2.60 -3.63 3.60 0.00 0.02 -3.14 120.51 117.49 2x1e n ALA 76 Ca 0.05 -0.39 -0.23 0.00 0.00 0.00 0.00 53.44 52.87 2x1e n ALA 76 Cb 0.28 -1.24 0.07 0.00 0.00 0.00 0.00 19.45 18.55 2x1e n ALA 76 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2x1e n GLU 77 N -0.11 -6.74 -4.50 0.00 1.02 -0.42 -4.95 120.64 104.95 2x1e n GLU 77 Ca 0.20 0.76 -0.26 0.00 -0.02 0.00 0.00 57.16 57.84 2x1e n GLU 77 Cb 0.29 -5.71 -0.10 0.00 -0.02 0.00 0.00 31.44 25.90 2x1e n GLU 77 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2x1e s ARG 78 N -6.09 1.89 0.35 3.49 1.81 -0.02 -5.04 118.95 115.35 2x1e s ARG 78 Ca 0.37 -1.90 -0.27 0.00 -1.72 0.00 0.00 55.73 52.21 2x1e s ARG 78 Cb -0.17 -1.76 -0.09 0.00 -0.45 0.00 0.00 34.95 32.48 2x1e s ARG 78 CO 0.76 0.12 1.12 -0.51 -0.68 0.00 0.00 175.30 176.11 2x1e s ASP 79 N -3.64 6.88 0.29 0.23 1.01 -1.26 -4.39 116.67 115.79 2x1e s ASP 79 Ca 0.33 2.26 0.04 0.00 0.71 0.00 0.00 52.55 55.89 2x1e s ASP 79 Cb 0.02 -2.61 0.70 0.00 1.01 0.00 0.00 42.92 42.04 2x1e s ASP 79 CO 0.17 -0.42 1.76 0.58 0.21 0.00 0.00 175.17 177.48 2x1e h VAL 80 N 2.62 0.68 -0.49 -1.27 2.07 -1.92 -1.56 116.25 116.38 2x1e h VAL 80 Ca -0.48 -0.23 0.07 0.00 0.82 0.00 0.00 66.70 66.87 2x1e h VAL 80 Cb 1.22 -0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.90 2x1e h VAL 80 CO 0.64 0.12 0.33 0.77 0.02 0.00 0.00 177.57 179.46 2x1e h SER 81 N 0.68 0.35 -0.47 0.57 4.64 -1.98 -1.11 113.55 116.23 2x1e h SER 81 Ca 0.55 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.74 2x1e h SER 81 Cb 0.87 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.88 2x1e h SER 81 CO -0.40 0.23 -0.22 -0.33 -0.87 0.00 0.00 176.83 175.24 2x1e h GLU 82 N 0.40 0.99 -0.18 4.77 5.08 -1.67 -1.02 114.58 122.96 2x1e h GLU 82 Ca 0.22 -0.43 -0.18 0.00 -1.00 0.00 0.00 59.36 57.98 2x1e h GLU 82 Cb 0.35 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 2x1e h GLU 82 CO -0.05 1.10 -0.61 0.82 -1.00 0.00 0.00 179.01 179.26 2x1e h ILE 83 N 0.86 1.32 -0.47 3.13 1.08 -1.37 -2.16 117.51 119.90 2x1e h ILE 83 Ca 0.11 -1.88 0.04 0.00 -0.39 0.00 0.00 64.86 62.74 2x1e h ILE 83 Cb 0.80 1.84 -0.04 0.00 -3.07 0.00 0.00 36.82 36.35 2x1e h ILE 83 CO 0.07 0.58 0.23 0.58 -0.69 0.00 0.00 178.15 178.93 2x1e h VAL 84 N 0.45 0.96 -0.53 1.67 2.07 -1.12 -1.89 116.25 117.86 2x1e h VAL 84 Ca -0.01 -0.16 0.05 0.00 0.82 0.00 0.00 66.70 67.41 2x1e h VAL 84 Cb 1.18 0.46 -0.05 0.00 -1.52 0.00 0.00 31.29 31.36 2x1e h VAL 84 CO 0.12 0.08 0.26 -0.03 0.02 0.00 0.00 177.57 178.02 2x1e h MET 85 N 0.46 0.48 -0.57 1.57 1.85 -1.00 -0.41 114.93 117.32 2x1e h MET 85 Ca 0.20 -0.03 0.05 0.00 -0.61 0.00 0.00 59.70 59.32 2x1e h MET 85 Cb 0.11 -0.11 -0.05 0.00 0.43 0.00 0.00 31.60 31.99 2x1e h MET 85 CO -0.15 0.32 0.29 -0.07 -0.40 0.00 0.00 176.91 176.90 2x1e h LEU 86 N 0.49 0.41 0.00 3.39 3.38 -1.14 -0.81 115.31 121.03 2x1e h LEU 86 Ca 0.24 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.24 2x1e h LEU 86 Cb 0.17 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2x1e h LEU 86 CO -0.18 0.27 0.00 0.59 0.09 0.00 0.00 178.44 179.22 2x1e n ASN 87 N -4.86 0.00 -0.38 -0.43 3.02 -0.73 -2.69 115.26 109.19 2x1e n ASN 87 Ca 0.06 -0.12 0.07 0.00 -0.03 0.00 0.00 54.58 54.57 2x1e n ASN 87 Cb 0.16 -0.28 0.13 0.00 -0.61 0.00 0.00 39.78 39.18 2x1e n ASN 87 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2x1e n THR 88 N -1.28 1.56 -0.22 3.41 -2.24 -0.23 -4.44 114.28 110.83 2x1e n THR 88 Ca 0.13 -2.11 0.05 0.00 -2.27 0.00 0.00 64.05 59.85 2x1e n THR 88 Cb 0.22 -0.04 0.31 0.00 -2.10 0.00 0.00 70.33 68.72 2x1e n THR 88 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 2x1e h ARG 89 N 0.34 0.83 -0.38 -0.78 2.43 -0.94 -1.60 114.38 114.28 2x1e h ARG 89 Ca -0.02 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.08 2x1e h ARG 89 Cb 1.12 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 30.47 2x1e h ARG 89 CO 0.01 0.55 0.13 1.15 -1.51 0.00 0.00 179.97 180.30 2x1e h THR 90 N 0.86 1.20 -0.76 0.20 2.02 -1.87 0.19 112.91 114.75 2x1e h THR 90 Ca 0.33 -0.65 0.05 0.00 0.77 0.00 0.00 66.41 66.91 2x1e h THR 90 Cb 0.22 0.93 -0.05 0.00 -1.74 0.00 0.00 68.15 67.51 2x1e h THR 90 CO -0.11 0.23 0.50 -0.33 0.37 0.00 0.00 175.52 176.18 2x1e h GLU 91 N 0.46 0.84 0.30 6.66 3.07 -1.68 0.18 114.58 124.41 2x1e h GLU 91 Ca 0.12 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 58.92 2x1e h GLU 91 Cb 0.23 -0.19 0.00 0.00 -0.84 0.00 0.00 28.75 27.95 2x1e h GLU 91 CO -0.01 0.56 -0.15 0.74 -1.40 0.00 0.00 179.01 178.75 2x1e h PHE 92 N 0.87 -0.38 0.00 4.33 0.04 -1.15 -2.62 116.94 118.03 2x1e h PHE 92 Ca 0.32 -0.01 -0.09 0.00 2.80 0.00 0.00 57.97 60.99 2x1e h PHE 92 Cb 0.15 0.12 -0.01 0.00 2.20 0.00 0.00 35.95 38.41 2x1e h PHE 92 CO -0.00 -0.23 -0.42 0.00 -0.60 0.00 0.00 178.31 177.06 2x1e h ALA 93 N -1.10 1.08 0.00 2.45 0.00 -0.48 -1.70 119.26 119.52 2x1e h ALA 93 Ca -0.04 -0.38 -0.18 0.00 0.00 0.00 0.00 54.91 54.31 2x1e h ALA 93 Cb 0.32 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2x1e h ALA 93 CO 0.07 0.52 -1.66 0.66 0.00 0.00 0.00 179.25 178.84 2x1e n TYR 94 N -3.71 0.00 0.07 0.00 4.02 0.57 -3.99 117.16 114.12 2x1e n TYR 94 Ca -0.01 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 57.86 2x1e n TYR 94 Cb 0.50 -0.45 0.22 0.00 -0.02 0.00 0.00 39.34 39.59 2x1e n TYR 94 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 2x1e h GLY 95 N 0.86 0.33 -2.09 2.72 0.00 -1.06 -3.07 103.07 100.76 2x1e h GLY 95 Ca -0.26 -0.31 -0.08 0.00 0.00 0.00 0.00 47.33 46.68 2x1e h GLY 95 CO -0.04 0.28 0.03 1.04 0.00 0.00 0.00 176.54 177.85 2x1e n LEU 96 N -4.05 4.36 -4.71 3.11 4.77 -0.64 -4.10 117.00 115.75 2x1e n LEU 96 Ca -0.01 -3.23 -0.42 0.00 -0.03 0.00 0.00 56.01 52.31 2x1e n LEU 96 Cb 0.46 -0.60 -0.03 0.00 -2.33 0.00 0.00 43.42 40.92 2x1e n LEU 96 CO 0.42 0.83 1.38 -0.75 -1.33 0.00 0.00 177.39 177.94 2x1e s LYS 97 N -2.96 4.14 0.30 3.23 2.20 -1.16 -4.44 119.74 121.05 2x1e s LYS 97 Ca 0.45 2.57 0.24 0.00 -0.36 0.00 0.00 55.97 58.87 2x1e s LYS 97 Cb 0.38 -3.22 1.10 0.00 -1.51 0.00 0.00 37.83 34.58 2x1e s LYS 97 CO 0.08 -0.76 1.72 0.00 -0.36 0.00 0.00 175.35 176.03 2x1e h ALA 98 N 7.27 1.00 -3.62 3.13 0.00 -1.46 -3.49 119.26 122.08 2x1e h ALA 98 Ca -0.44 0.00 -0.50 0.00 0.00 0.00 0.00 54.91 53.97 2x1e h ALA 98 Cb 1.20 0.00 -0.32 0.00 0.00 0.00 0.00 17.79 18.67 2x1e h ALA 98 CO 0.95 0.00 -0.81 0.99 0.00 0.00 0.00 179.25 180.38 2x1e s THR 104 N -3.44 1.11 -0.00 0.00 2.01 -1.09 -5.03 115.64 109.20 2x1e s THR 104 Ca 0.01 -0.50 0.02 0.00 0.31 0.00 0.00 61.69 61.53 2x1e s THR 104 Cb 0.08 -1.00 -0.01 0.00 0.01 0.00 0.00 72.50 71.59 2x1e s THR 104 CO 0.33 0.34 -0.06 -0.89 -0.69 0.00 0.00 174.62 173.65 2x1e s THR 105 N 0.42 0.44 -0.01 -0.82 2.01 0.44 -0.80 115.64 117.31 2x1e s THR 105 Ca -0.09 -0.31 -0.05 0.00 0.31 0.00 0.00 61.69 61.55 2x1e s THR 105 Cb -0.13 -0.39 0.00 0.00 0.01 0.00 0.00 72.50 71.99 2x1e s THR 105 CO 0.03 0.08 0.10 0.00 -0.69 0.00 0.00 174.62 174.14 2x1e s ALA 106 N -0.24 -0.24 -0.05 7.40 0.00 -0.27 -0.69 121.76 127.67 2x1e s ALA 106 Ca 0.01 -0.03 0.02 0.00 0.00 0.00 0.00 51.96 51.96 2x1e s ALA 106 Cb -0.03 -0.00 0.01 0.00 0.00 0.00 0.00 23.12 23.10 2x1e s ALA 106 CO -0.00 -0.14 -0.11 -0.47 0.00 0.00 0.00 175.76 175.04 2x1e s TYR 107 N -0.84 1.30 -0.12 0.00 6.14 -0.44 -0.61 117.35 122.78 2x1e s TYR 107 Ca -0.09 -0.44 -0.01 0.00 0.64 0.00 0.00 57.07 57.17 2x1e s TYR 107 Cb -0.05 -0.96 0.03 0.00 0.42 0.00 0.00 41.96 41.40 2x1e s TYR 107 CO 0.01 -0.23 -0.05 0.00 0.64 0.00 0.00 175.55 175.92 2x1e s GLN 109 N 1.77 4.49 0.04 0.00 2.00 -0.11 -1.42 119.66 126.42 2x1e s GLN 109 Ca 0.04 1.98 -0.06 0.00 -2.00 0.00 0.00 55.36 55.31 2x1e s GLN 109 Cb -0.13 -3.17 -0.01 0.00 0.80 0.00 0.00 33.01 30.50 2x1e s GLN 109 CO -0.07 -0.04 0.11 -0.51 -0.50 0.00 0.00 175.29 174.28 2x1e s LEU 110 N -1.04 1.73 0.58 3.68 1.43 -1.26 -4.91 118.68 118.89 2x1e s LEU 110 Ca 0.50 -0.53 0.36 0.00 -1.03 0.00 0.00 54.13 53.42 2x1e s LEU 110 Cb -0.35 0.67 1.64 0.00 0.03 0.00 0.00 46.19 48.19 2x1e s LEU 110 CO 0.43 -0.53 2.09 1.55 0.23 0.00 0.00 176.35 180.11 2x1e h PRO 111 N 3.55 0.00 -0.01 1.29 0.13 -1.97 -1.95 132.00 133.04 2x1e h PRO 111 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 2x1e h PRO 111 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2x1e h PRO 111 CO 0.51 0.02 -0.20 0.09 -0.23 0.00 0.00 178.00 178.18 2x1e n ASN 112 N -3.14 0.86 0.00 1.44 3.02 -1.26 -5.02 115.26 111.16 2x1e n ASN 112 Ca -0.01 -0.80 0.00 0.00 -0.03 0.00 0.00 54.58 53.74 2x1e n ASN 112 Cb 0.24 0.06 0.00 0.00 -0.61 0.00 0.00 39.78 39.48 2x1e n ASN 112 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2x1e n GLY 113 N 1.32 3.38 3.75 7.41 0.00 -0.73 -4.69 105.19 115.64 2x1e n GLY 113 Ca 0.13 -1.62 -0.35 0.00 0.00 0.00 0.00 46.02 44.18 2x1e n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x1e s ALA 114 N -1.38 2.51 -0.03 4.61 0.00 -1.26 -4.06 121.76 122.15 2x1e s ALA 114 Ca 0.00 0.93 0.07 0.00 0.00 0.00 0.00 51.96 52.95 2x1e s ALA 114 Cb 0.00 -3.43 -0.02 0.00 0.00 0.00 0.00 23.12 19.68 2x1e s ALA 114 CO 0.00 -1.21 -0.23 -0.51 0.00 0.00 0.00 175.76 173.81 2x1e s LEU 115 N -4.24 2.04 0.01 0.00 1.43 -0.51 -2.77 118.68 114.63 2x1e s LEU 115 Ca 0.75 -0.44 0.01 0.00 -1.03 0.00 0.00 54.13 53.42 2x1e s LEU 115 Cb -0.28 -1.23 -0.01 0.00 0.03 0.00 0.00 46.19 44.70 2x1e s LEU 115 CO 0.34 0.27 -0.03 -1.58 0.23 0.00 0.00 176.35 175.59 2x1e s GLN 116 N -0.41 0.21 0.16 1.70 0.74 -1.05 -0.48 119.66 120.53 2x1e s GLN 116 Ca 0.05 -0.22 -0.24 0.00 0.05 0.00 0.00 55.36 55.01 2x1e s GLN 116 Cb -0.10 -0.11 0.07 0.00 1.10 0.00 0.00 33.01 33.97 2x1e s GLN 116 CO 0.00 0.03 1.02 0.20 -0.55 0.00 0.00 175.29 175.99 2x1e s GLY 117 N -0.42 -0.04 0.09 2.59 0.00 0.22 0.80 107.32 110.56 2x1e s GLY 117 Ca -0.03 -0.11 -0.22 0.00 0.00 0.00 0.00 44.72 44.36 2x1e s GLY 117 CO -0.00 1.38 0.54 -0.86 0.00 0.00 0.00 173.10 174.16 2x1e s GLN 118 N -2.59 1.12 -0.08 2.90 -2.07 -0.73 -1.12 119.66 117.09 2x1e s GLN 118 Ca 0.18 -0.35 -0.14 0.00 -1.82 0.00 0.00 55.36 53.23 2x1e s GLN 118 Cb -0.02 0.51 -0.05 0.00 -1.09 0.00 0.00 33.01 32.36 2x1e s GLN 118 CO 0.04 -0.43 0.35 -0.80 -1.32 0.00 0.00 175.29 173.12 2x1e s ASN 119 N -2.28 6.63 -0.28 12.60 0.01 0.02 -1.87 114.94 129.76 2x1e s ASN 119 Ca -0.02 0.74 -0.10 0.00 -0.71 0.00 0.00 52.86 52.77 2x1e s ASN 119 Cb -0.00 -2.21 -0.03 0.00 0.41 0.00 0.00 41.25 39.41 2x1e s ASN 119 CO -0.06 0.22 0.16 0.86 -1.51 0.00 0.00 177.10 176.77 2x1e s TRP 120 N -0.35 3.18 -0.15 2.20 -0.11 -0.13 -2.68 118.94 120.90 2x1e s TRP 120 Ca 0.21 -0.19 -0.02 0.00 1.22 0.00 0.00 56.10 57.32 2x1e s TRP 120 Cb -0.15 -2.35 -0.02 0.00 -1.50 0.00 0.00 33.47 29.46 2x1e s TRP 120 CO 0.09 -0.29 -0.08 -0.51 -4.62 0.00 0.00 176.95 171.54 2x1e s ASP 121 N 1.69 4.35 0.19 5.86 1.01 -1.26 -0.97 116.67 127.54 2x1e s ASP 121 Ca 0.06 -0.26 -0.10 0.00 0.71 0.00 0.00 52.55 52.97 2x1e s ASP 121 Cb -0.16 -1.69 0.04 0.00 1.01 0.00 0.00 42.92 42.11 2x1e s ASP 121 CO 0.08 0.14 0.49 0.33 0.21 0.00 0.00 175.17 176.43 2x1e n PHE 122 N 3.69 -1.58 -1.83 4.23 7.35 -0.81 -4.93 117.46 123.59 2x1e n PHE 122 Ca -0.18 -0.97 -0.42 0.00 -0.76 0.00 0.00 57.45 55.12 2x1e n PHE 122 Cb 0.52 0.48 -0.03 0.00 0.35 0.00 0.00 39.48 40.81 2x1e n PHE 122 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 2x1e s PHE 123 N -4.71 2.98 0.60 -5.13 0.08 -1.26 -1.92 117.98 108.61 2x1e s PHE 123 Ca 0.10 0.47 0.31 0.00 0.12 0.00 0.00 56.93 57.94 2x1e s PHE 123 Cb -0.03 -4.04 1.86 0.00 -0.57 0.00 0.00 43.02 40.25 2x1e s PHE 123 CO 0.06 -3.90 2.24 0.77 -0.10 0.00 0.00 175.22 174.29 2x1e h SER 124 N 6.81 0.00 0.16 1.36 0.02 -1.91 -1.42 113.55 118.57 2x1e h SER 124 Ca -0.43 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.51 2x1e h SER 124 Cb 1.20 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.74 2x1e h SER 124 CO 0.94 0.00 -0.04 0.00 -1.14 0.00 0.00 176.83 176.59 2x1e h ALA 125 N 1.96 1.35 0.00 3.77 0.00 -1.95 -2.47 119.26 121.91 2x1e h ALA 125 Ca 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2x1e h ALA 125 Cb 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2x1e h ALA 125 CO -0.00 0.05 -0.39 0.25 0.00 0.00 0.00 179.25 179.17 2x1e n THR 126 N -3.64 0.44 -0.18 0.00 -2.24 -0.53 -4.08 114.28 104.06 2x1e n THR 126 Ca -0.02 -0.28 -0.01 0.00 -2.27 0.00 0.00 64.05 61.47 2x1e n THR 126 Cb 0.14 -0.30 0.08 0.00 -2.10 0.00 0.00 70.33 68.16 2x1e n THR 126 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2x1e h LYS 127 N 0.00 0.22 0.00 -0.78 3.64 -1.58 -0.48 116.57 117.59 2x1e h LYS 127 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2x1e h LYS 127 Cb 0.74 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 2x1e h LYS 127 CO 0.00 0.15 0.00 -0.85 -2.27 0.00 0.00 179.45 176.48 2x1e n GLU 128 N -5.14 0.04 0.00 1.90 0.28 -1.26 -2.15 120.64 114.32 2x1e n GLU 128 Ca 0.07 0.38 0.12 0.00 -0.16 0.00 0.00 57.16 57.57 2x1e n GLU 128 Cb 0.28 -1.59 0.09 0.00 1.43 0.00 0.00 31.44 31.65 2x1e n GLU 128 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2x1e n ASN 129 N -1.66 2.87 -4.71 -1.84 3.02 -0.20 -4.95 115.26 107.78 2x1e n ASN 129 Ca 0.02 -1.93 -0.42 0.00 -0.03 0.00 0.00 54.58 52.21 2x1e n ASN 129 Cb 0.11 0.06 -0.03 0.00 -0.61 0.00 0.00 39.78 39.32 2x1e n ASN 129 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2x1e s LEU 130 N -2.05 4.36 0.30 3.41 1.43 -0.91 -1.62 118.68 123.60 2x1e s LEU 130 Ca 0.27 1.97 0.03 0.00 -1.03 0.00 0.00 54.13 55.37 2x1e s LEU 130 Cb 0.20 -3.58 -0.04 0.00 0.03 0.00 0.00 46.19 42.80 2x1e s LEU 130 CO 0.33 -0.47 0.15 0.27 0.23 0.00 0.00 176.35 176.86 2x1e s ILE 131 N 1.22 0.36 0.01 -0.59 -4.36 0.35 -4.62 121.20 113.57 2x1e s ILE 131 Ca 0.58 -2.00 0.04 0.00 -0.26 0.00 0.00 60.65 59.01 2x1e s ILE 131 Cb -0.28 -2.53 -0.01 0.00 1.25 0.00 0.00 42.46 40.89 2x1e s ILE 131 CO 0.28 0.00 -0.11 0.00 0.24 0.00 0.00 174.94 175.35 2x1e s ARG 132 N -3.85 0.85 -0.02 0.37 1.70 -0.28 -1.17 118.95 116.55 2x1e s ARG 132 Ca 0.36 -0.49 0.06 0.00 -0.47 0.00 0.00 55.73 55.19 2x1e s ARG 132 Cb 0.05 -0.82 -0.03 0.00 -0.57 0.00 0.00 34.95 33.59 2x1e s ARG 132 CO 0.17 0.22 -0.20 -0.51 -1.08 0.00 0.00 175.30 173.90 2x1e s LEU 133 N -0.54 2.45 -0.23 -1.89 1.43 -0.36 -1.18 118.68 118.36 2x1e s LEU 133 Ca 0.03 -0.36 -0.05 0.00 -1.03 0.00 0.00 54.13 52.72 2x1e s LEU 133 Cb -0.05 -1.46 -0.02 0.00 0.03 0.00 0.00 46.19 44.69 2x1e s LEU 133 CO 0.00 0.31 0.00 -0.89 0.23 0.00 0.00 176.35 176.00 2x1e s THR 134 N -0.74 3.75 -0.23 5.49 2.01 -0.35 -1.63 115.64 123.94 2x1e s THR 134 Ca 0.12 -0.37 -0.02 0.00 0.31 0.00 0.00 61.69 61.73 2x1e s THR 134 Cb -0.10 -2.72 0.02 0.00 0.01 0.00 0.00 72.50 69.70 2x1e s THR 134 CO 0.01 0.39 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.63 2x1e s ILE 135 N 1.50 2.87 -0.22 1.82 1.01 0.97 -0.01 121.20 129.14 2x1e s ILE 135 Ca 0.06 -0.89 -0.08 0.00 0.00 0.00 0.00 60.65 59.74 2x1e s ILE 135 Cb -0.15 -2.39 -0.04 0.00 0.01 0.00 0.00 42.46 39.90 2x1e s ILE 135 CO -0.00 0.30 0.09 -0.13 0.00 0.00 0.00 174.94 175.20 2x1e s ARG 136 N 1.36 3.90 -0.09 2.79 0.52 -0.00 -1.37 118.95 126.05 2x1e s ARG 136 Ca 0.02 -0.37 -0.01 0.00 -0.52 0.00 0.00 55.73 54.85 2x1e s ARG 136 Cb -0.16 -3.32 0.03 0.00 0.52 0.00 0.00 34.95 32.02 2x1e s ARG 136 CO -0.05 0.08 -0.01 -0.65 0.02 0.00 0.00 175.30 174.69 2x1e s GLN 137 N 0.92 0.74 0.02 3.54 -0.21 -1.26 -3.83 119.66 119.57 2x1e s GLN 137 Ca 0.05 0.01 -0.36 0.00 0.02 0.00 0.00 55.36 55.08 2x1e s GLN 137 Cb -0.14 -1.16 -0.15 0.00 1.00 0.00 0.00 33.01 32.57 2x1e s GLN 137 CO 0.03 -0.33 1.57 0.00 -2.12 0.00 0.00 175.29 174.44 2x1e n ALA 138 N 5.11 0.16 -0.50 6.09 0.00 -1.26 -1.03 120.51 129.09 2x1e n ALA 138 Ca -0.08 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.80 2x1e n ALA 138 Cb 0.50 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.69 2x1e n ALA 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x1e n GLY 139 N 3.39 1.71 3.54 0.00 0.00 -0.36 -4.90 105.19 108.56 2x1e n GLY 139 Ca 0.20 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.96 2x1e n GLY 139 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x1e s LEU 140 N 0.00 2.86 0.42 0.99 1.43 -0.20 -4.88 118.68 119.29 2x1e s LEU 140 Ca 0.00 -0.69 -0.25 0.00 -1.03 0.00 0.00 54.13 52.16 2x1e s LEU 140 Cb 0.00 -1.51 -0.10 0.00 0.03 0.00 0.00 46.19 44.61 2x1e s LEU 140 CO 0.00 0.09 1.26 -2.65 0.23 0.00 0.00 176.35 175.28 2x1e n PRO 141 N -0.10 1.91 -2.47 1.29 -0.02 -1.26 -3.86 135.00 130.49 2x1e n PRO 141 Ca -0.10 0.68 -0.42 0.00 -2.02 0.00 0.00 63.50 61.65 2x1e n PRO 141 Cb 0.56 -2.37 -0.03 0.00 -0.02 0.00 0.00 33.50 31.64 2x1e n PRO 141 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2x1e s THR 142 N -1.20 3.95 -0.09 3.45 2.01 -1.26 -4.66 115.64 117.85 2x1e s THR 142 Ca 0.61 1.53 0.00 0.00 0.31 0.00 0.00 61.69 64.14 2x1e s THR 142 Cb -0.51 -3.98 -0.03 0.00 0.01 0.00 0.00 72.50 67.99 2x1e s THR 142 CO 0.58 0.19 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.99 2x1e s ILE 143 N 0.42 3.54 -0.14 1.82 1.01 -0.47 -1.03 121.20 126.35 2x1e s ILE 143 Ca 0.54 -0.52 -0.00 0.00 0.00 0.00 0.00 60.65 60.66 2x1e s ILE 143 Cb -0.29 -2.46 0.03 0.00 0.01 0.00 0.00 42.46 39.74 2x1e s ILE 143 CO 0.32 0.57 -0.10 -0.54 0.00 0.00 0.00 174.94 175.19 2x1e s LYS 144 N -0.43 1.82 0.05 2.79 1.02 -0.55 -0.02 119.74 124.42 2x1e s LYS 144 Ca 0.06 -0.43 -0.10 0.00 0.02 0.00 0.00 55.97 55.52 2x1e s LYS 144 Cb -0.12 -1.87 0.00 0.00 -0.52 0.00 0.00 37.83 35.32 2x1e s LYS 144 CO 0.02 -0.29 0.21 -0.59 -0.92 0.00 0.00 175.35 173.78 2x1e s PHE 145 N 1.60 0.06 -0.16 3.18 -0.71 -0.65 -1.55 117.98 119.76 2x1e s PHE 145 Ca 0.04 -0.32 -0.15 0.00 -1.04 0.00 0.00 56.93 55.46 2x1e s PHE 145 Cb -0.13 -0.02 -0.05 0.00 -1.21 0.00 0.00 43.02 41.61 2x1e s PHE 145 CO -0.09 -0.47 0.33 0.42 -1.34 0.00 0.00 175.22 174.07 2x1e s ILE 146 N -2.88 5.28 0.10 -4.49 -1.09 0.65 -1.22 121.20 117.56 2x1e s ILE 146 Ca -0.03 0.62 -0.07 0.00 -2.23 0.00 0.00 60.65 58.94 2x1e s ILE 146 Cb 0.00 -3.67 -0.01 0.00 -1.58 0.00 0.00 42.46 37.21 2x1e s ILE 146 CO -0.06 0.37 0.17 0.28 -1.23 0.00 0.00 174.94 174.48 2x1e s THR 147 N 0.53 0.14 0.12 2.92 -1.32 -0.32 -2.49 115.64 115.23 2x1e s THR 147 Ca 0.18 -1.36 -0.30 0.00 -1.21 0.00 0.00 61.69 59.00 2x1e s THR 147 Cb -0.13 -1.51 -0.07 0.00 -1.51 0.00 0.00 72.50 69.28 2x1e s THR 147 CO 0.05 -0.62 1.12 -1.61 -2.21 0.00 0.00 174.62 171.35 2x1e s GLU 148 N -3.90 4.54 0.22 7.08 2.02 -1.26 -0.49 118.70 126.90 2x1e s GLU 148 Ca 0.09 1.71 -0.32 0.00 0.02 0.00 0.00 54.97 56.47 2x1e s GLU 148 Cb 0.05 -3.32 -0.13 0.00 0.10 0.00 0.00 34.13 30.83 2x1e s GLU 148 CO -0.08 -0.05 1.49 0.00 0.02 0.00 0.00 175.26 176.65 2x1e n ALA 149 N 3.02 1.45 0.00 5.21 0.00 -0.64 -2.11 120.51 127.44 2x1e n ALA 149 Ca 0.05 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.91 2x1e n ALA 149 Cb 0.47 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.59 2x1e n ALA 149 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x1e n GLY 150 N 2.58 0.97 3.59 0.00 0.00 -1.26 -4.56 105.19 106.51 2x1e n GLY 150 Ca 0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 2x1e n GLY 150 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2x1e s ILE 151 N -2.19 4.48 -1.56 -0.61 1.01 -0.90 -4.72 121.20 116.72 2x1e s ILE 151 Ca 0.00 -0.15 0.25 0.00 0.00 0.00 0.00 60.65 60.76 2x1e s ILE 151 Cb 0.00 -3.00 0.16 0.00 0.01 0.00 0.00 42.46 39.63 2x1e s ILE 151 CO 0.00 0.48 1.46 2.30 0.00 0.00 0.00 174.94 179.17 2x1e n ILE 152 N 3.49 0.00 -3.74 2.92 -5.35 -1.26 -4.80 119.36 110.63 2x1e n ILE 152 Ca -0.17 -0.10 -0.12 0.00 -0.27 0.00 0.00 62.75 62.09 2x1e n ILE 152 Cb 0.52 0.46 -0.13 0.00 -1.74 0.00 0.00 39.64 38.76 2x1e n ILE 152 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2x1e s GLY 153 N -2.64 -0.15 0.00 3.28 0.00 -1.26 -4.74 107.32 101.81 2x1e s GLY 153 Ca 0.20 0.97 0.00 0.00 0.00 0.00 0.00 44.72 45.89 2x1e s GLY 153 CO 0.58 1.18 0.00 1.17 0.00 0.00 0.00 173.10 176.03 2x1e n LYS 154 N 4.06 0.00 -3.84 2.90 3.00 -1.26 -4.80 118.16 118.22 2x1e n LYS 154 Ca -0.24 0.00 -0.36 0.00 -0.00 0.00 0.00 58.31 57.72 2x1e n LYS 154 Cb 0.54 0.00 -0.13 0.00 0.00 0.00 0.00 35.03 35.43 2x1e n LYS 154 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 2x1e s VAL 155 N 1.67 3.72 -0.47 3.15 1.01 -1.04 -4.84 120.40 123.60 2x1e s VAL 155 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 61.98 61.52 2x1e s VAL 155 Cb 0.00 -2.76 0.00 0.00 0.00 0.00 0.00 36.38 33.62 2x1e s VAL 155 CO 0.00 0.33 0.00 0.61 0.00 0.00 0.00 175.10 176.04 2x1e n GLY 156 N 4.84 -0.59 3.33 4.51 0.00 -1.13 -0.25 105.19 115.91 2x1e n GLY 156 Ca -0.17 -0.65 -0.13 0.00 0.00 0.00 0.00 46.02 45.08 2x1e n GLY 156 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2x1e s PHE 157 N -3.00 1.05 0.32 1.61 -0.71 -0.59 -0.05 117.98 116.59 2x1e s PHE 157 Ca 0.00 -1.26 0.03 0.00 -1.04 0.00 0.00 56.93 54.66 2x1e s PHE 157 Cb 0.00 -0.35 -0.05 0.00 -1.21 0.00 0.00 43.02 41.41 2x1e s PHE 157 CO 0.00 -0.81 0.09 0.54 -1.34 0.00 0.00 175.22 173.70 2x1e s ASN 158 N -3.16 1.98 0.20 1.98 2.20 -0.32 -1.48 114.94 116.33 2x1e s ASN 158 Ca 0.34 -1.45 0.20 0.00 -0.94 0.00 0.00 52.86 51.01 2x1e s ASN 158 Cb 0.04 0.15 0.87 0.00 -2.00 0.00 0.00 41.25 40.31 2x1e s ASN 158 CO 0.14 -0.73 1.61 -1.54 -2.94 0.00 0.00 177.10 173.64 2x1e n SER 159 N -0.75 0.47 -0.17 3.54 3.41 -0.20 -0.65 113.62 119.27 2x1e n SER 159 Ca -0.02 0.63 0.14 0.00 -0.26 0.00 0.00 58.87 59.37 2x1e n SER 159 Cb 0.66 -0.73 0.64 0.00 -0.26 0.00 0.00 64.21 64.52 2x1e n SER 159 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2x1e n ALA 160 N -1.70 2.73 -0.73 7.33 0.00 -1.26 -4.92 120.51 121.96 2x1e n ALA 160 Ca 0.02 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.16 2x1e n ALA 160 Cb 0.18 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.31 2x1e n ALA 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x1e n GLY 161 N 1.21 0.62 3.67 0.00 0.00 0.17 -4.87 105.19 106.00 2x1e n GLY 161 Ca 0.17 -0.16 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 2x1e n GLY 161 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2x1e s VAL 162 N -2.00 4.78 -0.06 1.61 1.01 -1.25 -4.31 120.40 120.18 2x1e s VAL 162 Ca 0.00 1.94 0.04 0.00 0.00 0.00 0.00 61.98 63.96 2x1e s VAL 162 Cb 0.00 -4.27 -0.02 0.00 0.00 0.00 0.00 36.38 32.09 2x1e s VAL 162 CO 0.00 -0.04 -0.19 0.00 0.00 0.00 0.00 175.10 174.86 2x1e s ALA 163 N 2.39 2.42 -0.06 5.51 0.00 0.61 -1.18 121.76 131.44 2x1e s ALA 163 Ca 0.45 -1.01 0.03 0.00 0.00 0.00 0.00 51.96 51.43 2x1e s ALA 163 Cb -0.17 -0.85 0.01 0.00 0.00 0.00 0.00 23.12 22.11 2x1e s ALA 163 CO 0.13 0.45 -0.16 0.08 0.00 0.00 0.00 175.76 176.27 2x1e s VAL 164 N -0.34 1.37 0.21 0.00 1.01 0.92 -1.05 120.40 122.52 2x1e s VAL 164 Ca 0.02 -0.64 0.10 0.00 0.00 0.00 0.00 61.98 61.47 2x1e s VAL 164 Cb -0.12 -1.21 -0.05 0.00 0.00 0.00 0.00 36.38 35.00 2x1e s VAL 164 CO 0.02 0.40 -0.19 0.20 0.00 0.00 0.00 175.10 175.54 2x1e s ASN 165 N 0.41 3.04 -0.03 3.32 -0.87 0.10 -2.84 114.94 118.07 2x1e s ASN 165 Ca -0.12 -0.95 0.00 0.00 -1.57 0.00 0.00 52.86 50.23 2x1e s ASN 165 Cb -0.15 -0.21 0.03 0.00 -0.02 0.00 0.00 41.25 40.90 2x1e s ASN 165 CO 0.04 -0.02 0.01 -0.47 -2.57 0.00 0.00 177.10 174.09 2x1e s TYR 166 N -2.32 0.30 -0.02 2.20 5.04 -1.26 -1.11 117.35 120.17 2x1e s TYR 166 Ca 0.22 0.02 0.06 0.00 -2.44 0.00 0.00 57.07 54.93 2x1e s TYR 166 Cb -0.05 -0.43 -0.02 0.00 0.35 0.00 0.00 41.96 41.82 2x1e s TYR 166 CO 0.10 -0.14 -0.20 -0.80 -1.34 0.00 0.00 175.55 173.16 2x1e s ASN 167 N 1.16 2.38 0.34 4.32 -0.87 -0.07 -4.98 114.94 117.22 2x1e s ASN 167 Ca -0.08 -0.37 -0.29 0.00 -1.57 0.00 0.00 52.86 50.56 2x1e s ASN 167 Cb -0.13 -0.28 -0.11 0.00 -0.02 0.00 0.00 41.25 40.71 2x1e s ASN 167 CO -0.02 0.25 1.40 0.00 -2.57 0.00 0.00 177.10 176.16 2x1e s ALA 168 N -0.45 3.55 0.01 0.60 0.00 -1.26 -0.79 121.76 123.41 2x1e s ALA 168 Ca 0.07 1.41 0.00 0.00 0.00 0.00 0.00 51.96 53.45 2x1e s ALA 168 Cb -0.08 -3.55 -0.01 0.00 0.00 0.00 0.00 23.12 19.49 2x1e s ALA 168 CO -0.01 -0.84 -0.02 -1.17 0.00 0.00 0.00 175.76 173.73 2x1e s LEU 169 N -1.76 2.07 -0.34 0.00 2.96 -1.26 -4.47 118.68 115.88 2x1e s LEU 169 Ca 0.52 -0.15 0.08 0.00 -0.22 0.00 0.00 54.13 54.35 2x1e s LEU 169 Cb -0.43 -0.02 0.57 0.00 0.50 0.00 0.00 46.19 46.81 2x1e s LEU 169 CO 0.56 -0.07 1.62 1.41 -1.32 0.00 0.00 176.35 178.56 2x1e n HIS 170 N 2.64 1.78 -2.31 5.38 8.25 -1.26 -4.13 115.22 125.57 2x1e n HIS 170 Ca -0.15 -1.63 -0.37 0.00 -0.26 0.00 0.00 57.72 55.30 2x1e n HIS 170 Cb 0.58 -0.64 -0.02 0.00 1.12 0.00 0.00 29.99 31.04 2x1e n HIS 170 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2x1e s LEU 171 N -3.24 4.06 0.38 2.41 1.43 -1.26 -0.66 118.68 121.80 2x1e s LEU 171 Ca 0.49 2.26 -0.24 0.00 -1.03 0.00 0.00 54.13 55.61 2x1e s LEU 171 Cb 0.43 -4.21 -0.10 0.00 0.03 0.00 0.00 46.19 42.35 2x1e s LEU 171 CO 0.04 -0.81 0.98 -1.58 0.23 0.00 0.00 176.35 175.22 2x1e s GLN 172 N -2.62 4.32 0.00 1.70 0.74 -0.02 -4.53 119.66 119.26 2x1e s GLN 172 Ca 0.62 1.34 0.00 0.00 0.05 0.00 0.00 55.36 57.37 2x1e s GLN 172 Cb -0.28 -2.53 0.00 0.00 1.10 0.00 0.00 33.01 31.31 2x1e s GLN 172 CO 0.34 0.03 0.00 0.41 -0.55 0.00 0.00 175.29 175.52 2x1e n GLY 173 N 0.15 3.91 2.74 2.59 0.00 -1.26 -4.64 105.19 108.68 2x1e n GLY 173 Ca 0.05 -1.46 -0.19 0.00 0.00 0.00 0.00 46.02 44.41 2x1e n GLY 173 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2x1e s LEU 174 N 0.00 0.64 -0.40 0.99 2.96 -1.26 -4.54 118.68 117.07 2x1e s LEU 174 Ca 0.00 0.02 0.03 0.00 -0.22 0.00 0.00 54.13 53.97 2x1e s LEU 174 Cb 0.00 -0.18 0.11 0.00 0.50 0.00 0.00 46.19 46.62 2x1e s LEU 174 CO 0.00 -0.18 0.14 -0.60 -1.32 0.00 0.00 176.35 174.39 2x1e s ARG 175 N 1.64 1.53 0.39 1.98 3.52 0.68 -5.00 118.95 123.70 2x1e s ARG 175 Ca -0.01 -2.04 0.27 0.00 -0.13 0.00 0.00 55.73 53.81 2x1e s ARG 175 Cb -0.13 -3.01 1.41 0.00 -1.56 0.00 0.00 34.95 31.66 2x1e s ARG 175 CO -0.03 -1.02 1.82 -1.35 -0.81 0.00 0.00 175.30 173.90 2x1e h PRO 176 N 7.22 0.00 0.00 5.12 0.11 -1.94 0.02 132.00 142.52 2x1e h PRO 176 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 2x1e h PRO 176 Cb 0.97 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.08 2x1e h PRO 176 CO 0.56 0.00 -0.44 0.25 -0.21 0.00 0.00 178.00 178.16 2x1e n THR 177 N -2.44 0.15 -1.54 -1.15 -2.24 -1.26 -4.59 114.28 101.20 2x1e n THR 177 Ca -0.01 -0.11 -0.30 0.00 -2.27 0.00 0.00 64.05 61.36 2x1e n THR 177 Cb 0.06 -0.03 0.21 0.00 -2.10 0.00 0.00 70.33 68.47 2x1e n THR 177 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2x1e s GLY 178 N -3.25 1.69 -0.15 3.38 0.00 -0.01 -4.99 107.32 104.00 2x1e s GLY 178 Ca 0.10 -1.10 -0.26 0.00 0.00 0.00 0.00 44.72 43.46 2x1e s GLY 178 CO 0.68 -0.27 0.87 0.54 0.00 0.00 0.00 173.10 174.91 2x1e s VAL 179 N -3.49 4.86 0.59 1.40 0.11 -0.64 -4.32 120.40 118.92 2x1e s VAL 179 Ca 0.73 1.72 -0.20 0.00 -2.93 0.00 0.00 61.98 61.30 2x1e s VAL 179 Cb -0.06 -4.18 -0.03 0.00 -1.53 0.00 0.00 36.38 30.58 2x1e s VAL 179 CO 0.54 0.03 1.30 -2.84 -3.33 0.00 0.00 175.10 170.80 2x1e s PRO 180 N 2.07 2.89 0.25 1.54 0.02 -1.26 -0.69 135.00 139.83 2x1e s PRO 180 Ca 0.41 2.08 -0.05 0.00 0.02 0.00 0.00 61.00 63.46 2x1e s PRO 180 Cb -0.17 -2.04 0.28 0.00 0.02 0.00 0.00 34.50 32.59 2x1e s PRO 180 CO 0.14 -1.34 1.90 0.66 -0.33 0.00 0.00 177.00 178.03 2x1e h SER 181 N 1.02 1.09 0.56 2.53 4.64 -1.94 -0.28 113.55 121.17 2x1e h SER 181 Ca -0.51 -0.06 -0.10 0.00 -0.47 0.00 0.00 61.79 60.65 2x1e h SER 181 Cb 1.31 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 63.11 2x1e h SER 181 CO 0.55 0.84 -0.47 0.45 -0.87 0.00 0.00 176.83 177.33 2x1e h HIS 182 N 1.26 0.00 -0.40 4.77 3.86 -1.87 -0.70 115.15 122.06 2x1e h HIS 182 Ca 0.33 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.43 2x1e h HIS 182 Cb -0.06 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.40 2x1e h HIS 182 CO 0.01 0.47 -0.16 0.82 0.86 0.00 0.00 177.93 179.92 2x1e h ILE 183 N 0.00 1.28 -0.99 2.45 1.08 -1.64 -2.53 117.51 117.15 2x1e h ILE 183 Ca -0.00 -1.29 0.02 0.00 -0.39 0.00 0.00 64.86 63.19 2x1e h ILE 183 Cb 0.88 1.27 -0.05 0.00 -3.07 0.00 0.00 36.82 35.85 2x1e h ILE 183 CO 0.06 0.43 0.66 0.00 -0.69 0.00 0.00 178.15 178.61 2x1e h ALA 184 N 0.82 1.28 -0.73 1.87 0.00 -0.53 -0.30 119.26 121.67 2x1e h ALA 184 Ca 0.09 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.99 2x1e h ALA 184 Cb 0.71 -0.38 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 2x1e h ALA 184 CO 0.05 0.61 0.44 -0.07 0.00 0.00 0.00 179.25 180.29 2x1e h LEU 185 N 1.31 0.70 -0.57 0.00 3.38 -1.03 -1.39 115.31 117.71 2x1e h LEU 185 Ca 0.38 0.01 -0.15 0.00 0.09 0.00 0.00 57.88 58.21 2x1e h LEU 185 Cb -0.10 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 2x1e h LEU 185 CO -0.10 0.47 -0.48 -0.09 0.09 0.00 0.00 178.44 178.33 2x1e h ARG 186 N 0.84 0.59 -0.40 1.13 9.65 -0.96 -1.04 114.38 124.19 2x1e h ARG 186 Ca 0.31 -0.34 0.05 0.00 -1.10 0.00 0.00 59.98 58.90 2x1e h ARG 186 Cb 0.10 0.03 -0.05 0.00 -1.39 0.00 0.00 29.97 28.65 2x1e h ARG 186 CO -0.14 0.94 0.12 0.82 2.80 0.00 0.00 179.97 184.51 2x1e h ILE 187 N 0.47 0.85 -0.70 1.20 2.04 -0.73 -1.74 117.51 118.90 2x1e h ILE 187 Ca 0.02 -0.09 -0.02 0.00 1.00 0.00 0.00 64.86 65.77 2x1e h ILE 187 Cb 1.01 0.56 -0.03 0.00 -0.74 0.00 0.00 36.82 37.63 2x1e h ILE 187 CO 0.09 0.05 0.35 0.00 0.00 0.00 0.00 178.15 178.64 2x1e h ALA 188 N 1.27 0.90 0.00 1.87 0.00 -1.07 -2.63 119.26 119.61 2x1e h ALA 188 Ca 0.19 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2x1e h ALA 188 Cb 0.19 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 2x1e h ALA 188 CO -0.21 0.45 -0.01 -0.07 0.00 0.00 0.00 179.25 179.41 2x1e h LEU 189 N 0.97 0.00 -1.81 0.00 3.38 -0.74 -1.75 115.31 115.36 2x1e h LEU 189 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 2x1e h LEU 189 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2x1e h LEU 189 CO -0.03 0.01 0.00 -0.62 0.09 0.00 0.00 178.44 177.89 2x1e n GLU 190 N -3.12 2.21 -2.86 1.13 1.02 -0.69 -4.72 120.64 113.60 2x1e n GLU 190 Ca -0.00 -1.80 -0.30 0.00 -0.02 0.00 0.00 57.16 55.04 2x1e n GLU 190 Cb 0.25 -1.47 -0.03 0.00 -0.02 0.00 0.00 31.44 30.17 2x1e n GLU 190 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2x1e s SER 191 N -1.73 6.50 0.01 1.62 0.01 -0.66 -4.52 113.70 114.93 2x1e s SER 191 Ca 0.34 1.10 0.23 0.00 1.31 0.00 0.00 55.95 58.93 2x1e s SER 191 Cb 0.21 -2.31 0.20 0.00 0.21 0.00 0.00 66.02 64.33 2x1e s SER 191 CO 0.30 -0.40 1.19 0.35 0.41 0.00 0.00 173.24 175.10 2x1e n THR 192 N -1.34 0.03 -3.59 1.44 -2.24 -1.26 -4.75 114.28 102.57 2x1e n THR 192 Ca 0.02 -0.04 -0.11 0.00 -2.27 0.00 0.00 64.05 61.65 2x1e n THR 192 Cb 0.54 0.47 -0.04 0.00 -2.10 0.00 0.00 70.33 69.20 2x1e n THR 192 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2x1e s SER 193 N -3.16 -0.31 0.28 3.42 1.04 -1.26 -4.78 113.70 108.92 2x1e s SER 193 Ca 0.09 -0.25 -0.01 0.00 0.48 0.00 0.00 55.95 56.26 2x1e s SER 193 Cb 0.16 0.51 0.46 0.00 0.10 0.00 0.00 66.02 67.25 2x1e s SER 193 CO 0.77 -0.89 1.89 -0.65 0.98 0.00 0.00 173.24 175.34 2x1e h PRO 194 N 2.27 1.09 -0.34 4.02 0.11 -1.89 -0.91 132.00 136.35 2x1e h PRO 194 Ca -0.34 -0.07 0.04 0.00 0.11 0.00 0.00 66.00 65.75 2x1e h PRO 194 Cb 1.27 -0.25 -0.04 0.00 0.11 0.00 0.00 31.00 32.09 2x1e h PRO 194 CO 0.44 0.72 0.11 0.77 -0.21 0.00 0.00 178.00 179.83 2x1e h SER 195 N 1.12 0.10 -0.58 -2.05 0.02 -1.96 0.19 113.55 110.39 2x1e h SER 195 Ca 0.42 0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 61.37 2x1e h SER 195 Cb 0.19 0.04 -0.03 0.00 0.14 0.00 0.00 62.40 62.74 2x1e h SER 195 CO -0.17 0.09 0.21 -0.61 -1.14 0.00 0.00 176.83 175.21 2x1e h GLN 196 N 0.25 0.89 -0.36 3.45 4.15 -1.86 -1.39 115.11 120.24 2x1e h GLN 196 Ca 0.16 -0.18 0.03 0.00 0.77 0.00 0.00 58.65 59.43 2x1e h GLN 196 Cb 0.14 -0.14 -0.03 0.00 0.21 0.00 0.00 27.48 27.66 2x1e h GLN 196 CO -0.17 0.78 0.16 0.00 -1.93 0.00 0.00 178.83 177.67 2x1e h ALA 197 N 1.06 0.43 0.16 3.38 0.00 -0.80 0.55 119.26 124.05 2x1e h ALA 197 Ca 0.19 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.14 2x1e h ALA 197 Cb 0.25 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 2x1e h ALA 197 CO -0.01 -0.22 -0.27 -0.92 0.00 0.00 0.00 179.25 177.83 2x1e h TYR 198 N 0.33 -0.71 -0.64 0.00 3.20 -0.78 -1.63 116.97 116.73 2x1e h TYR 198 Ca 0.15 0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.15 2x1e h TYR 198 Cb 0.09 0.29 -0.08 0.00 1.54 0.00 0.00 36.73 38.57 2x1e h TYR 198 CO -0.12 -0.37 0.21 -0.44 -1.64 0.00 0.00 178.16 175.80 2x1e h ASP 199 N -0.50 0.15 0.10 -2.11 5.19 -0.92 -0.26 116.42 118.07 2x1e h ASP 199 Ca 0.02 0.10 -0.17 0.00 -0.62 0.00 0.00 57.03 56.36 2x1e h ASP 199 Cb 0.51 0.10 -0.00 0.00 0.18 0.00 0.00 39.33 40.11 2x1e h ASP 199 CO -0.13 0.08 -0.62 0.03 -3.12 0.00 0.00 179.24 175.49 2x1e h ARG 200 N 0.36 0.51 0.13 3.56 3.08 -0.72 0.14 114.38 121.45 2x1e h ARG 200 Ca 0.33 -0.36 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 2x1e h ARG 200 Cb 0.46 0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.57 2x1e h ARG 200 CO -0.36 0.97 -0.06 0.82 -1.07 0.00 0.00 179.97 180.27 2x1e h ILE 201 N 0.38 0.99 -0.25 2.04 2.04 -1.02 -3.17 117.51 118.52 2x1e h ILE 201 Ca -0.01 -0.54 0.00 0.00 1.00 0.00 0.00 64.86 65.32 2x1e h ILE 201 Cb 1.17 1.33 -0.01 0.00 -0.74 0.00 0.00 36.82 38.57 2x1e h ILE 201 CO 0.11 0.13 0.17 0.58 0.00 0.00 0.00 178.15 179.14 2x1e h VAL 202 N -0.43 1.07 -0.01 1.67 2.07 -0.93 -2.37 116.25 117.31 2x1e h VAL 202 Ca -0.02 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.38 2x1e h VAL 202 Cb 0.35 0.70 -0.00 0.00 -1.52 0.00 0.00 31.29 30.81 2x1e h VAL 202 CO 0.03 0.06 0.01 -0.08 0.02 0.00 0.00 177.57 177.62 2x1e h GLU 203 N 0.34 0.00 0.00 1.57 4.81 -0.68 -2.40 114.58 118.21 2x1e h GLU 203 Ca 0.09 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 2x1e h GLU 203 Cb -0.04 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.34 2x1e h GLU 203 CO -0.02 0.00 0.00 1.96 -0.73 0.00 0.00 179.01 180.22 2x1e h GLN 204 N 0.00 0.00 0.00 1.92 1.08 -1.47 -3.47 115.11 113.17 2x1e h GLN 204 Ca 0.01 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.21 2x1e h GLN 204 Cb 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.46 2x1e h GLN 204 CO -0.00 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.29 2x1e n GLY 205 N -0.32 0.43 0.00 3.46 0.00 -0.90 -4.87 105.19 102.99 2x1e n GLY 205 Ca -0.00 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.05 2x1e n GLY 205 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x1e n GLY 206 N -2.93 4.85 3.87 -0.02 0.00 -1.26 -5.05 105.19 104.65 2x1e n GLY 206 Ca 0.00 -1.03 -0.31 0.00 0.00 0.00 0.00 46.02 44.68 2x1e n GLY 206 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2x1e s MET 207 N -4.85 3.81 0.13 1.61 1.00 -1.26 -1.62 119.30 118.13 2x1e s MET 207 Ca 0.00 0.60 0.02 0.00 0.00 0.00 0.00 55.69 56.31 2x1e s MET 207 Cb 0.00 -2.31 -0.11 0.00 0.00 0.00 0.00 34.83 32.41 2x1e s MET 207 CO 0.00 -0.12 1.30 0.00 0.00 0.00 0.00 175.02 176.20 2x1e h ALA 208 N 1.08 0.39 -3.00 3.03 0.00 -1.09 -3.36 119.26 116.31 2x1e h ALA 208 Ca -0.47 -0.80 0.00 0.00 0.00 0.00 0.00 54.91 53.64 2x1e h ALA 208 Cb 1.19 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2x1e h ALA 208 CO 0.63 1.01 0.00 0.00 0.00 0.00 0.00 179.25 180.89 2x1e n ALA 209 N -2.45 0.00 -2.88 0.00 0.00 -1.26 -0.23 120.51 113.69 2x1e n ALA 209 Ca -0.04 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.09 2x1e n ALA 209 Cb 0.89 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 20.17 2x1e n ALA 209 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2x1e s SER 210 N 1.63 3.04 0.23 0.00 0.15 -1.26 -3.68 113.70 113.82 2x1e s SER 210 Ca 0.00 -0.52 -0.14 0.00 0.70 0.00 0.00 55.95 55.99 2x1e s SER 210 Cb 0.00 -0.99 0.05 0.00 -1.71 0.00 0.00 66.02 63.37 2x1e s SER 210 CO 0.00 0.22 0.73 0.00 1.20 0.00 0.00 173.24 175.38 2x1e n ALA 211 N 3.12 -1.78 -2.99 5.45 0.00 -1.18 -4.35 120.51 118.77 2x1e n ALA 211 Ca -0.18 -0.91 -0.27 0.00 0.00 0.00 0.00 53.44 52.08 2x1e n ALA 211 Cb 0.52 0.63 -0.16 0.00 0.00 0.00 0.00 19.45 20.44 2x1e n ALA 211 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2x1e s PHE 212 N -3.24 1.89 -0.07 0.00 5.36 0.03 -2.48 117.98 119.47 2x1e s PHE 212 Ca 0.15 -0.60 0.04 0.00 -0.96 0.00 0.00 56.93 55.56 2x1e s PHE 212 Cb -0.03 -1.28 0.00 0.00 -0.34 0.00 0.00 43.02 41.37 2x1e s PHE 212 CO 0.07 -0.22 -0.20 0.42 -1.46 0.00 0.00 175.22 173.83 2x1e s ILE 213 N 0.13 1.71 -0.14 3.12 1.01 -0.68 -0.89 121.20 125.46 2x1e s ILE 213 Ca -0.07 -0.83 -0.02 0.00 0.00 0.00 0.00 60.65 59.72 2x1e s ILE 213 Cb -0.13 -1.49 -0.02 0.00 0.01 0.00 0.00 42.46 40.83 2x1e s ILE 213 CO 0.03 0.48 -0.07 -0.32 0.00 0.00 0.00 174.94 175.06 2x1e s MET 214 N 0.30 3.54 -0.10 2.79 -2.45 -0.27 -0.34 119.30 122.77 2x1e s MET 214 Ca -0.13 -0.58 0.02 0.00 -1.25 0.00 0.00 55.69 53.75 2x1e s MET 214 Cb -0.16 -2.80 0.01 0.00 1.25 0.00 0.00 34.83 33.14 2x1e s MET 214 CO 0.06 0.25 -0.16 0.08 1.05 0.00 0.00 175.02 176.29 2x1e s VAL 215 N 0.31 1.52 0.05 10.11 1.01 -0.47 -0.72 120.40 132.21 2x1e s VAL 215 Ca -0.06 -0.67 -0.09 0.00 0.00 0.00 0.00 61.98 61.15 2x1e s VAL 215 Cb -0.15 -1.37 0.00 0.00 0.00 0.00 0.00 36.38 34.87 2x1e s VAL 215 CO 0.04 0.44 0.18 -0.83 0.00 0.00 0.00 175.10 174.94 2x1e s GLY 216 N 0.78 0.06 0.00 4.51 0.00 -0.22 -1.09 107.32 111.36 2x1e s GLY 216 Ca -0.11 -0.41 0.00 0.00 0.00 0.00 0.00 44.72 44.20 2x1e s GLY 216 CO 0.02 -0.58 0.00 1.16 0.00 0.00 0.00 173.10 173.69 2x1e n ASN 217 N 0.46 0.91 0.27 1.64 0.23 -0.08 -0.29 115.26 118.40 2x1e n ASN 217 Ca -0.18 -0.02 0.15 0.00 -0.53 0.00 0.00 54.58 54.00 2x1e n ASN 217 Cb 0.60 0.00 0.69 0.00 -2.08 0.00 0.00 39.78 38.99 2x1e n ASN 217 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 2x1e h GLY 218 N 0.00 0.00 0.00 4.83 0.00 -1.86 -3.34 103.07 102.70 2x1e h GLY 218 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 47.33 46.97 2x1e h GLY 218 CO 0.00 0.00 -2.37 1.57 0.00 0.00 0.00 176.54 175.74 2x1e n HIS 219 N -3.26 0.00 -3.85 5.60 -0.00 -1.26 -4.52 115.22 107.94 2x1e n HIS 219 Ca -0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 57.72 57.63 2x1e n HIS 219 Cb 0.30 -0.93 -0.07 0.00 -0.00 0.00 0.00 29.99 29.29 2x1e n HIS 219 CO 0.00 0.00 0.00 -1.83 -0.00 0.00 0.00 176.34 174.51 2x1e s GLU 220 N -2.48 0.96 -0.08 1.57 -1.05 -1.26 -5.15 118.70 111.21 2x1e s GLU 220 Ca -0.31 -0.97 -0.22 0.00 -0.15 0.00 0.00 54.97 53.33 2x1e s GLU 220 Cb 0.08 0.37 0.05 0.00 -0.44 0.00 0.00 34.13 34.19 2x1e s GLU 220 CO 0.58 -0.33 0.51 0.00 0.95 0.00 0.00 175.26 176.97 2x1e s ALA 221 N -3.88 -1.30 0.04 -0.84 0.00 -1.26 -0.90 121.76 113.63 2x1e s ALA 221 Ca 0.07 1.02 0.00 0.00 0.00 0.00 0.00 51.96 53.06 2x1e s ALA 221 Cb 0.04 -0.22 -0.03 0.00 0.00 0.00 0.00 23.12 22.91 2x1e s ALA 221 CO -0.09 -0.30 -0.04 -0.59 0.00 0.00 0.00 175.76 174.75 2x1e s PHE 222 N -0.82 0.47 0.14 0.00 -0.12 -0.25 -4.46 117.98 112.94 2x1e s PHE 222 Ca -0.09 -0.78 0.07 0.00 -0.05 0.00 0.00 56.93 56.08 2x1e s PHE 222 Cb -0.03 -0.33 -0.04 0.00 -0.63 0.00 0.00 43.02 41.99 2x1e s PHE 222 CO 0.05 -0.25 -0.03 0.20 -0.05 0.00 0.00 175.22 175.14 2x1e s GLY 223 N -2.22 1.78 -0.19 1.99 0.00 0.10 -1.36 107.32 107.41 2x1e s GLY 223 Ca -0.03 -1.30 -0.02 0.00 0.00 0.00 0.00 44.72 43.36 2x1e s GLY 223 CO -0.05 -1.31 0.01 -2.27 0.00 0.00 0.00 173.10 169.49 2x1e s LEU 224 N -2.66 1.37 -0.22 0.66 2.96 0.54 -0.13 118.68 121.20 2x1e s LEU 224 Ca 0.26 -0.81 -0.14 0.00 -0.22 0.00 0.00 54.13 53.22 2x1e s LEU 224 Cb -0.10 -0.69 -0.04 0.00 0.50 0.00 0.00 46.19 45.86 2x1e s LEU 224 CO 0.17 -0.28 0.31 -1.61 -1.32 0.00 0.00 176.35 173.62 2x1e s GLU 225 N 1.78 4.12 0.04 1.98 2.02 -0.21 -1.69 118.70 126.75 2x1e s GLU 225 Ca -0.01 0.01 -0.03 0.00 0.02 0.00 0.00 54.97 54.96 2x1e s GLU 225 Cb -0.17 -3.55 -0.02 0.00 0.10 0.00 0.00 34.13 30.50 2x1e s GLU 225 CO -0.07 -0.02 0.04 -0.59 0.02 0.00 0.00 175.26 174.64 2x1e s PHE 226 N 1.26 0.28 0.33 1.61 -0.12 -1.03 -0.73 117.98 119.59 2x1e s PHE 226 Ca 0.14 -0.63 0.05 0.00 -0.05 0.00 0.00 56.93 56.44 2x1e s PHE 226 Cb -0.14 -0.21 -0.02 0.00 -0.63 0.00 0.00 43.02 42.02 2x1e s PHE 226 CO 0.07 -0.33 0.19 -1.13 -0.05 0.00 0.00 175.22 173.97 2x1e n SER 227 N 0.81 0.29 0.17 1.98 3.41 0.34 -3.11 113.62 117.51 2x1e n SER 227 Ca -0.19 -2.97 0.12 0.00 -0.26 0.00 0.00 58.87 55.57 2x1e n SER 227 Cb 0.58 1.22 0.61 0.00 -0.26 0.00 0.00 64.21 66.36 2x1e n SER 227 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 2x1e h PRO 228 N 0.00 0.00 0.00 4.33 0.11 -1.70 -3.05 132.00 131.69 2x1e h PRO 228 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 2x1e h PRO 228 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2x1e h PRO 228 CO 0.38 0.00 -0.04 0.25 -0.21 0.00 0.00 178.00 178.38 2x1e n THR 229 N -2.34 1.70 -3.64 -1.15 -2.24 -1.26 -4.60 114.28 100.74 2x1e n THR 229 Ca -0.00 -2.03 -0.04 0.00 -2.27 0.00 0.00 64.05 59.70 2x1e n THR 229 Cb 0.11 -0.15 -0.07 0.00 -2.10 0.00 0.00 70.33 68.12 2x1e n THR 229 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2x1e s SER 230 N -2.65 -0.70 -0.27 3.42 0.15 -1.15 -4.89 113.70 107.61 2x1e s SER 230 Ca 0.28 1.12 -0.02 0.00 0.70 0.00 0.00 55.95 58.03 2x1e s SER 230 Cb 0.25 1.29 0.09 0.00 -1.71 0.00 0.00 66.02 65.93 2x1e s SER 230 CO 0.03 -0.18 0.08 -0.63 1.20 0.00 0.00 173.24 173.74 2x1e s ILE 231 N 1.46 0.60 -0.12 6.45 1.01 -1.26 -0.51 121.20 128.83 2x1e s ILE 231 Ca -0.09 -0.99 -0.01 0.00 0.00 0.00 0.00 60.65 59.55 2x1e s ILE 231 Cb -0.04 -1.33 -0.02 0.00 0.01 0.00 0.00 42.46 41.08 2x1e s ILE 231 CO -0.17 -0.52 -0.09 -0.13 0.00 0.00 0.00 174.94 174.04 2x1e s ARG 232 N 1.78 3.34 -0.23 2.79 1.81 0.09 -4.98 118.95 123.56 2x1e s ARG 232 Ca 0.06 -0.60 -0.15 0.00 -1.72 0.00 0.00 55.73 53.31 2x1e s ARG 232 Cb -0.17 -2.71 -0.04 0.00 -0.45 0.00 0.00 34.95 31.58 2x1e s ARG 232 CO -0.21 0.32 0.38 0.21 -0.68 0.00 0.00 175.30 175.32 2x1e s LYS 233 N 0.11 4.12 0.01 3.54 2.20 -1.26 -1.04 119.74 127.42 2x1e s LYS 233 Ca -0.04 0.13 -0.18 0.00 -0.36 0.00 0.00 55.97 55.52 2x1e s LYS 233 Cb -0.14 -3.58 -0.06 0.00 -1.51 0.00 0.00 37.83 32.54 2x1e s LYS 233 CO 0.04 -0.12 0.52 -1.14 -0.36 0.00 0.00 175.35 174.29 2x1e s GLN 234 N 1.57 4.18 0.36 4.03 0.74 0.81 -4.92 119.66 126.44 2x1e s GLN 234 Ca 0.17 0.62 0.07 0.00 0.05 0.00 0.00 55.36 56.27 2x1e s GLN 234 Cb -0.15 -3.29 -0.07 0.00 1.10 0.00 0.00 33.01 30.60 2x1e s GLN 234 CO 0.08 0.52 -0.01 0.14 -0.55 0.00 0.00 175.29 175.48 2x1e s VAL 235 N -0.64 1.79 0.34 1.34 -7.23 -1.26 -0.73 120.40 114.01 2x1e s VAL 235 Ca 0.28 -2.05 -0.29 0.00 -1.81 0.00 0.00 61.98 58.11 2x1e s VAL 235 Cb -0.18 -2.81 -0.11 0.00 0.56 0.00 0.00 36.38 33.84 2x1e s VAL 235 CO 0.16 -0.08 1.46 -0.76 -0.31 0.00 0.00 175.10 175.57 2x1e s LEU 236 N -3.60 4.35 0.00 1.32 1.43 -1.26 -4.81 118.68 116.11 2x1e s LEU 236 Ca 0.34 2.91 -0.08 0.00 -1.03 0.00 0.00 54.13 56.28 2x1e s LEU 236 Cb 0.08 -3.65 0.11 0.00 0.03 0.00 0.00 46.19 42.76 2x1e s LEU 236 CO 0.16 -0.79 0.69 -0.90 0.23 0.00 0.00 176.35 175.74 2x1e n ASP 237 N 1.03 0.15 0.23 2.29 5.68 -0.07 -4.84 116.55 121.01 2x1e n ASP 237 Ca 0.03 -1.31 0.16 0.00 -0.50 0.00 0.00 54.79 53.16 2x1e n ASP 237 Cb 0.40 -0.52 0.79 0.00 -1.14 0.00 0.00 41.12 40.65 2x1e n ASP 237 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2x1e h ALA 238 N -1.70 1.00 -0.66 2.12 0.00 -1.95 -0.50 119.26 117.57 2x1e h ALA 238 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2x1e h ALA 238 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2x1e h ALA 238 CO 0.17 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.51 2x1e n ASN 239 N -2.59 3.64 -0.96 0.00 5.03 -1.26 -4.93 115.26 114.19 2x1e n ASN 239 Ca -0.01 -2.04 -0.10 0.00 0.87 0.00 0.00 54.58 53.30 2x1e n ASN 239 Cb 0.09 -0.46 -0.02 0.00 -1.02 0.00 0.00 39.78 38.37 2x1e n ASN 239 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2x1e n GLY 240 N 1.51 0.58 3.42 7.41 0.00 -0.19 -4.73 105.19 113.17 2x1e n GLY 240 Ca 0.22 -0.52 -0.28 0.00 0.00 0.00 0.00 46.02 45.44 2x1e n GLY 240 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2x1e s ARG 241 N -3.65 1.49 -0.01 1.61 0.52 -1.26 -0.93 118.95 116.72 2x1e s ARG 241 Ca 0.00 -1.41 0.02 0.00 -0.52 0.00 0.00 55.73 53.82 2x1e s ARG 241 Cb 0.00 -1.90 0.00 0.00 0.52 0.00 0.00 34.95 33.57 2x1e s ARG 241 CO 0.00 0.43 -0.06 -1.64 0.02 0.00 0.00 175.30 174.05 2x1e s MET 242 N -2.34 0.61 -0.03 3.54 -1.94 -0.22 -0.90 119.30 118.03 2x1e s MET 242 Ca 0.17 -0.21 0.03 0.00 -1.71 0.00 0.00 55.69 53.97 2x1e s MET 242 Cb -0.09 -0.60 0.00 0.00 2.01 0.00 0.00 34.83 36.15 2x1e s MET 242 CO 0.08 0.10 -0.10 0.08 -0.01 0.00 0.00 175.02 175.17 2x1e s VAL 243 N 0.07 0.84 0.01 -6.03 1.01 -1.26 -1.33 120.40 113.71 2x1e s VAL 243 Ca -0.00 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 61.59 2x1e s VAL 243 Cb -0.05 -0.75 -0.01 0.00 0.00 0.00 0.00 36.38 35.57 2x1e s VAL 243 CO -0.00 0.26 -0.02 -2.28 0.00 0.00 0.00 175.10 173.06 2x1e s HIS 244 N 0.20 0.15 0.00 5.22 2.46 0.13 -5.00 115.29 118.45 2x1e s HIS 244 Ca -0.03 -0.15 0.00 0.00 0.47 0.00 0.00 55.06 55.34 2x1e s HIS 244 Cb -0.09 -0.10 0.00 0.00 -0.13 0.00 0.00 32.58 32.26 2x1e s HIS 244 CO 0.01 -0.05 0.00 0.25 -2.47 0.00 0.00 174.74 172.48 2x1e n THR 245 N 2.65 0.00 -1.40 0.89 -2.24 -1.26 -0.42 114.28 112.50 2x1e n THR 245 Ca -0.15 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.70 2x1e n THR 245 Cb 0.58 0.00 0.16 0.00 -2.10 0.00 0.00 70.33 68.98 2x1e n THR 245 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2x1e n ASN 246 N 0.00 1.92 -4.06 3.42 4.13 -1.26 -4.72 115.26 114.69 2x1e n ASN 246 Ca 0.00 -3.38 -0.08 0.00 1.68 0.00 0.00 54.58 52.80 2x1e n ASN 246 Cb 0.00 -0.46 -0.09 0.00 -1.54 0.00 0.00 39.78 37.68 2x1e n ASN 246 CO 0.00 0.00 0.00 -1.38 0.28 0.00 0.00 177.26 176.16 2x1e s HIS 247 N -2.82 0.51 -0.06 3.10 -3.43 -1.26 -4.54 115.29 106.79 2x1e s HIS 247 Ca 0.34 -1.01 -0.30 0.00 -0.80 0.00 0.00 55.06 53.29 2x1e s HIS 247 Cb 0.31 -0.34 -0.04 0.00 -1.43 0.00 0.00 32.58 31.08 2x1e s HIS 247 CO -0.02 -0.44 1.43 0.00 -2.00 0.00 0.00 174.74 173.70 2x1e n LEU 249 N 6.11 0.45 -4.83 0.00 4.77 -1.26 -4.98 117.00 117.25 2x1e n LEU 249 Ca 0.14 -0.06 -0.26 0.00 -0.03 0.00 0.00 56.01 55.80 2x1e n LEU 249 Cb 0.44 -0.03 -0.05 0.00 -2.33 0.00 0.00 43.42 41.45 2x1e n LEU 249 CO 0.59 0.04 -0.18 -0.76 -1.33 0.00 0.00 177.39 175.74 2x1e s LEU 250 N -4.16 3.93 -0.14 2.23 1.43 -1.26 -5.07 118.68 115.64 2x1e s LEU 250 Ca -0.01 -0.07 -0.29 0.00 -1.03 0.00 0.00 54.13 52.73 2x1e s LEU 250 Cb 0.14 -2.52 -0.02 0.00 0.03 0.00 0.00 46.19 43.82 2x1e s LEU 250 CO 0.86 0.05 1.28 -1.58 0.23 0.00 0.00 176.35 177.19 2x1e s GLN 251 N -3.21 4.25 0.48 1.70 0.74 -1.26 -5.02 119.66 117.33 2x1e s GLN 251 Ca 0.32 1.69 0.08 0.00 0.05 0.00 0.00 55.36 57.50 2x1e s GLN 251 Cb -0.10 -3.74 0.02 0.00 1.10 0.00 0.00 33.01 30.29 2x1e s GLN 251 CO 0.25 -0.68 0.54 -1.01 -0.55 0.00 0.00 175.29 173.84 2x1e s HIS 252 N 3.32 2.25 1.06 1.67 3.76 -1.26 -5.01 115.29 121.08 2x1e s HIS 252 Ca 0.56 -0.58 -0.12 0.00 -0.15 0.00 0.00 55.06 54.77 2x1e s HIS 252 Cb -0.23 -2.20 0.20 0.00 1.11 0.00 0.00 32.58 31.46 2x1e s HIS 252 CO 0.17 -0.51 0.93 0.41 -0.85 0.00 0.00 174.74 174.88 2x1e n GLY 253 N -1.84 -1.43 0.33 -2.22 0.00 -1.26 -4.91 105.19 93.87 2x1e n GLY 253 Ca 0.07 -0.93 0.04 0.00 0.00 0.00 0.00 46.02 45.20 2x1e n GLY 253 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2x1e h LYS 254 N -2.25 0.68 0.00 1.61 1.79 -1.99 -2.81 116.57 113.61 2x1e h LYS 254 Ca -0.52 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 57.91 2x1e h LYS 254 Cb 1.31 -0.15 0.00 0.00 -1.58 0.00 0.00 32.23 31.80 2x1e h LYS 254 CO 0.44 0.45 -0.24 -1.71 -1.08 0.00 0.00 179.45 177.31 2x1e n ASN 255 N -4.46 0.31 -4.74 0.86 5.15 -1.26 -4.90 115.26 106.22 2x1e n ASN 255 Ca 0.07 0.19 -0.41 0.00 -0.60 0.00 0.00 54.58 53.82 2x1e n ASN 255 Cb 0.12 -0.19 -0.02 0.00 -0.53 0.00 0.00 39.78 39.16 2x1e n ASN 255 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2x1e s GLU 256 N -3.02 4.24 -0.10 1.20 0.41 -1.06 -5.01 118.70 115.35 2x1e s GLU 256 Ca 0.12 2.34 0.01 0.00 -0.41 0.00 0.00 54.97 57.03 2x1e s GLU 256 Cb 0.17 -3.11 0.02 0.00 -1.78 0.00 0.00 34.13 29.43 2x1e s GLU 256 CO 0.61 -0.48 -0.10 0.21 -0.49 0.00 0.00 175.26 175.01 2x1e s LYS 257 N -0.11 1.69 -0.22 1.61 2.20 -1.26 -4.99 119.74 118.66 2x1e s LYS 257 Ca 0.62 -0.36 -0.22 0.00 -0.36 0.00 0.00 55.97 55.65 2x1e s LYS 257 Cb -0.43 -1.57 -0.02 0.00 -1.51 0.00 0.00 37.83 34.30 2x1e s LYS 257 CO 0.42 -0.14 0.72 -2.00 -0.36 0.00 0.00 175.35 173.99 2x1e s GLU 258 N 1.25 4.19 -0.37 4.03 2.12 -1.26 -0.84 118.70 127.81 2x1e s GLU 258 Ca -0.03 0.76 -0.12 0.00 0.36 0.00 0.00 54.97 55.94 2x1e s GLU 258 Cb -0.14 -3.62 0.01 0.00 0.26 0.00 0.00 34.13 30.64 2x1e s GLU 258 CO -0.03 -0.39 0.23 -0.51 -0.54 0.00 0.00 175.26 174.02 2x1e s LEU 259 N 2.41 4.70 -1.29 2.70 1.43 0.17 -4.68 118.68 124.12 2x1e s LEU 259 Ca 0.31 -0.79 -0.10 0.00 -1.03 0.00 0.00 54.13 52.52 2x1e s LEU 259 Cb -0.16 -2.08 -0.00 0.00 0.03 0.00 0.00 46.19 43.98 2x1e s LEU 259 CO 0.09 -0.35 0.58 0.47 0.23 0.00 0.00 176.35 177.38 2x1e n ASP 260 N 5.06 -2.44 -4.81 2.29 8.00 -1.26 -4.82 116.55 118.56 2x1e n ASP 260 Ca -0.12 -1.02 -0.32 0.00 0.71 0.00 0.00 54.79 54.04 2x1e n ASP 260 Cb 0.47 -3.13 0.02 0.00 -0.02 0.00 0.00 41.12 38.46 2x1e n ASP 260 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 2x1e s PRO 261 N -6.37 3.28 0.02 -0.24 0.04 -1.26 -4.98 135.00 125.49 2x1e s PRO 261 Ca 0.21 1.12 -0.30 0.00 0.04 0.00 0.00 61.00 62.07 2x1e s PRO 261 Cb -0.08 -2.03 -0.07 0.00 0.04 0.00 0.00 34.50 32.36 2x1e s PRO 261 CO 0.88 -0.84 1.53 -0.51 0.04 0.00 0.00 177.00 178.11 2x1e s LEU 262 N -4.72 4.33 0.33 -3.56 1.43 -1.26 -4.92 118.68 110.31 2x1e s LEU 262 Ca 0.62 2.27 0.05 0.00 -1.03 0.00 0.00 54.13 56.04 2x1e s LEU 262 Cb -0.15 -3.56 0.68 0.00 0.03 0.00 0.00 46.19 43.19 2x1e s LEU 262 CO 0.41 -0.81 1.90 -0.65 0.23 0.00 0.00 176.35 177.43 2x1e h PRO 263 N 8.26 0.82 0.00 1.29 0.11 -2.00 -0.98 132.00 139.50 2x1e h PRO 263 Ca -0.40 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2x1e h PRO 263 Cb 1.19 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.11 2x1e h PRO 263 CO 0.92 0.54 0.00 -0.40 -0.21 0.00 0.00 178.00 178.85 2x1e n ASP 264 N -4.52 0.45 -0.22 -2.05 5.68 -1.26 -2.09 116.55 112.54 2x1e n ASP 264 Ca 0.15 0.66 0.04 0.00 -0.50 0.00 0.00 54.79 55.14 2x1e n ASP 264 Cb 0.31 -0.74 0.29 0.00 -1.14 0.00 0.00 41.12 39.84 2x1e n ASP 264 CO 0.00 0.00 0.00 -1.28 -1.33 0.00 0.00 177.20 174.59 2x1e h SER 265 N 0.00 0.78 0.05 -1.12 0.87 -1.53 -0.66 113.55 111.94 2x1e h SER 265 Ca 0.00 -0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2x1e h SER 265 Cb 0.15 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 61.94 2x1e h SER 265 CO 0.00 0.52 -0.02 -0.50 -0.53 0.00 0.00 176.83 176.30 2x1e h TRP 266 N 0.90 -0.06 -0.63 2.24 6.55 -1.59 -2.28 115.95 121.07 2x1e h TRP 266 Ca 0.32 -0.00 0.11 0.00 0.95 0.00 0.00 58.89 60.27 2x1e h TRP 266 Cb 0.14 0.02 -0.08 0.00 -0.86 0.00 0.00 29.16 28.38 2x1e h TRP 266 CO -0.00 0.40 0.21 -0.91 -1.05 0.00 0.00 178.44 177.09 2x1e h ASN 267 N -0.55 0.17 -0.41 -3.49 4.21 -1.58 -1.98 115.58 111.95 2x1e h ASN 267 Ca -0.01 0.09 -0.13 0.00 1.21 0.00 0.00 56.30 57.46 2x1e h ASN 267 Cb 0.49 0.09 -0.01 0.00 -1.12 0.00 0.00 38.32 37.77 2x1e h ASN 267 CO 0.01 0.09 -0.24 0.03 -1.29 0.00 0.00 177.43 176.03 2x1e h ARG 268 N 0.37 0.93 0.10 0.81 3.08 -1.17 0.22 114.38 118.72 2x1e h ARG 268 Ca 0.33 -0.41 0.01 0.00 0.07 0.00 0.00 59.98 59.98 2x1e h ARG 268 Cb 0.45 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 2x1e h ARG 268 CO -0.35 1.06 -0.11 1.25 -1.07 0.00 0.00 179.97 180.76 2x1e h HIS 269 N 0.80 -0.27 -0.41 3.04 2.76 -1.08 -0.33 115.15 119.65 2x1e h HIS 269 Ca 0.10 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.24 2x1e h HIS 269 Cb 0.81 0.11 -0.02 0.00 1.55 0.00 0.00 27.41 29.86 2x1e h HIS 269 CO 0.05 -0.16 0.14 1.96 -1.30 0.00 0.00 177.93 178.61 2x1e h GLN 270 N -0.23 0.64 -0.25 5.26 1.08 -1.22 -2.07 115.11 118.32 2x1e h GLN 270 Ca 0.01 -0.13 0.05 0.00 -1.45 0.00 0.00 58.65 57.13 2x1e h GLN 270 Cb 0.23 -0.09 -0.05 0.00 -0.05 0.00 0.00 27.48 27.51 2x1e h GLN 270 CO -0.04 0.63 -0.09 -0.09 -0.95 0.00 0.00 178.83 178.29 2x1e h ARG 271 N 0.53 -0.04 -0.73 1.46 9.65 -0.48 0.06 114.38 124.82 2x1e h ARG 271 Ca 0.13 0.00 -0.07 0.00 -1.10 0.00 0.00 59.98 58.95 2x1e h ARG 271 Cb 0.25 0.01 -0.03 0.00 -1.39 0.00 0.00 29.97 28.81 2x1e h ARG 271 CO -0.01 -0.03 0.19 1.98 2.80 0.00 0.00 179.97 184.91 2x1e h MET 272 N -0.05 1.16 -0.58 0.20 4.05 -0.97 0.25 114.93 119.00 2x1e h MET 272 Ca 0.13 -0.27 0.00 0.00 -0.28 0.00 0.00 59.70 59.28 2x1e h MET 272 Cb 0.24 -0.16 -0.03 0.00 -0.80 0.00 0.00 31.60 30.85 2x1e h MET 272 CO -0.28 1.00 0.36 0.93 0.23 0.00 0.00 176.91 179.15 2x1e h GLU 273 N 1.10 0.77 -0.32 0.39 5.08 -1.06 0.01 114.58 120.55 2x1e h GLU 273 Ca 0.23 -0.06 0.02 0.00 -1.00 0.00 0.00 59.36 58.55 2x1e h GLU 273 Cb 0.36 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 2x1e h GLU 273 CO -0.00 0.54 0.18 0.35 -1.00 0.00 0.00 179.01 179.08 2x1e h PHE 274 N 0.78 0.33 -0.58 4.33 3.57 -0.63 -2.19 116.94 122.55 2x1e h PHE 274 Ca 0.21 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.71 2x1e h PHE 274 Cb -0.04 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 38.57 2x1e h PHE 274 CO -0.03 0.19 0.32 -0.07 -2.23 0.00 0.00 178.31 176.49 2x1e h LEU 275 N 0.36 0.73 -1.90 0.59 3.38 -0.57 -2.17 115.31 115.73 2x1e h LEU 275 Ca 0.13 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 2x1e h LEU 275 Cb 0.02 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 2x1e h LEU 275 CO -0.08 0.61 -0.12 -0.07 0.09 0.00 0.00 178.44 178.87 2x1e h LEU 276 N 0.78 0.00 -1.07 1.67 3.38 -0.90 -1.21 115.31 117.97 2x1e h LEU 276 Ca 0.20 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.11 2x1e h LEU 276 Cb 0.05 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 2x1e h LEU 276 CO -0.03 0.12 -0.07 0.44 0.09 0.00 0.00 178.44 178.99 2x1e h ASP 277 N 0.00 0.55 0.09 -0.43 3.32 -0.73 -3.15 116.42 116.07 2x1e h ASP 277 Ca -0.00 -0.13 0.00 0.00 0.02 0.00 0.00 57.03 56.92 2x1e h ASP 277 Cb 0.31 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.72 2x1e h ASP 277 CO 0.02 0.67 -0.95 0.61 -1.72 0.00 0.00 179.24 177.87 2x1e n GLY 278 N -0.68 -1.04 3.66 2.75 0.00 -0.93 -4.98 105.19 103.97 2x1e n GLY 278 Ca 0.01 -0.56 -0.47 0.00 0.00 0.00 0.00 46.02 45.00 2x1e n GLY 278 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2x1e n PHE 279 N -1.53 2.16 1.24 1.61 7.35 -0.50 -4.92 117.46 122.88 2x1e n PHE 279 Ca 0.04 0.30 0.14 0.00 -0.76 0.00 0.00 57.45 57.17 2x1e n PHE 279 Cb 0.34 -2.52 0.61 0.00 0.35 0.00 0.00 39.48 38.26 2x1e n PHE 279 CO 0.00 0.00 0.00 -0.40 -0.76 0.00 0.00 176.76 175.60 2x1e n ASP 280 N 3.65 0.21 0.00 -2.13 5.68 -1.26 -4.93 116.55 117.76 2x1e n ASP 280 Ca 0.18 -0.10 0.00 0.00 -0.50 0.00 0.00 54.79 54.37 2x1e n ASP 280 Cb 0.27 -0.22 0.00 0.00 -1.14 0.00 0.00 41.12 40.03 2x1e n ASP 280 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2x1e n GLY 281 N 1.37 1.61 3.78 6.12 0.00 -1.26 -5.06 105.19 111.75 2x1e n GLY 281 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 2x1e n GLY 281 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2x1e s THR 282 N -2.42 3.35 0.29 2.61 -4.23 -1.26 -4.88 115.64 109.10 2x1e s THR 282 Ca 0.00 0.79 -0.02 0.00 -1.18 0.00 0.00 61.69 61.28 2x1e s THR 282 Cb 0.00 -3.30 0.21 0.00 1.34 0.00 0.00 72.50 70.75 2x1e s THR 282 CO 0.00 -0.24 1.89 0.50 -0.54 0.00 0.00 174.62 176.24 2x1e h LYS 283 N 1.00 0.96 -0.06 3.99 3.64 -1.99 -0.64 116.57 123.47 2x1e h LYS 283 Ca -0.49 -0.12 -0.00 0.00 -1.27 0.00 0.00 60.65 58.77 2x1e h LYS 283 Cb 1.25 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 32.88 2x1e h LYS 283 CO 0.57 0.73 0.04 0.37 -2.27 0.00 0.00 179.45 178.89 2x1e h GLN 284 N 0.95 0.08 -0.80 1.90 4.15 -2.00 -1.02 115.11 118.37 2x1e h GLN 284 Ca 0.24 -0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.63 2x1e h GLN 284 Cb 0.09 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 27.72 2x1e h GLN 284 CO -0.03 0.10 0.41 0.00 -1.93 0.00 0.00 178.83 177.38 2x1e h ALA 285 N 0.98 1.21 -0.68 3.38 0.00 -1.90 -2.39 119.26 119.88 2x1e h ALA 285 Ca 0.02 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2x1e h ALA 285 Cb 0.03 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.47 2x1e h ALA 285 CO -0.00 0.62 0.35 0.35 0.00 0.00 0.00 179.25 180.56 2x1e h PHE 286 N 1.13 0.95 -0.87 0.00 3.57 -0.83 -2.66 116.94 118.23 2x1e h PHE 286 Ca 0.28 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.75 2x1e h PHE 286 Cb 0.07 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 38.47 2x1e h PHE 286 CO 0.01 0.69 0.54 0.00 -2.23 0.00 0.00 178.31 177.33 2x1e h ALA 287 N 1.17 1.11 0.00 2.41 0.00 -0.90 -2.90 119.26 120.14 2x1e h ALA 287 Ca 0.24 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 2x1e h ALA 287 Cb 0.07 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 2x1e h ALA 287 CO -0.03 0.55 -0.22 1.96 0.00 0.00 0.00 179.25 181.50 2x1e h GLN 288 N 1.19 0.00 -0.87 0.00 4.20 -1.10 -3.07 115.11 115.47 2x1e h GLN 288 Ca 0.32 0.00 0.05 0.00 0.06 0.00 0.00 58.65 59.08 2x1e h GLN 288 Cb -0.08 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 27.65 2x1e h GLN 288 CO -0.06 0.22 0.57 -0.07 -0.67 0.00 0.00 178.83 178.82 2x1e h LEU 289 N 0.00 0.89 -0.16 1.46 3.38 -1.28 -2.24 115.31 117.35 2x1e h LEU 289 Ca -0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2x1e h LEU 289 Cb 0.51 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2x1e h LEU 289 CO 0.03 0.59 0.00 0.79 0.09 0.00 0.00 178.44 179.93 2x1e n TRP 290 N -4.47 0.20 0.72 1.13 7.02 -1.16 -1.85 117.44 119.03 2x1e n TRP 290 Ca 0.12 0.08 0.10 0.00 -1.02 0.00 0.00 57.50 56.78 2x1e n TRP 290 Cb 0.17 -0.62 0.28 0.00 -2.42 0.00 0.00 31.31 28.71 2x1e n TRP 290 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2x1e n ALA 291 N -1.57 2.46 -1.76 6.99 0.00 -0.84 -3.78 120.51 122.02 2x1e n ALA 291 Ca 0.03 -0.77 -0.42 0.00 0.00 0.00 0.00 53.44 52.29 2x1e n ALA 291 Cb 0.19 -0.98 -0.02 0.00 0.00 0.00 0.00 19.45 18.64 2x1e n ALA 291 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2x1e s ASP 292 N -1.40 6.38 -0.08 0.00 2.15 -0.77 -4.68 116.67 118.28 2x1e s ASP 292 Ca 0.35 2.90 0.12 0.00 0.43 0.00 0.00 52.55 56.35 2x1e s ASP 292 Cb 0.19 -2.62 0.20 0.00 -0.30 0.00 0.00 42.92 40.39 2x1e s ASP 292 CO 0.27 -0.93 1.11 -0.62 -0.17 0.00 0.00 175.17 174.83 2x1e n GLU 293 N 2.95 2.00 -1.71 4.34 1.02 -1.26 -1.05 120.64 126.93 2x1e n GLU 293 Ca 0.11 -2.20 -0.43 0.00 -0.02 0.00 0.00 57.16 54.63 2x1e n GLU 293 Cb 0.37 -1.33 -0.03 0.00 -0.02 0.00 0.00 31.44 30.42 2x1e n GLU 293 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2x1e n ASP 294 N -1.02 3.72 -1.11 1.62 2.03 -1.26 -1.31 116.55 119.23 2x1e n ASP 294 Ca 0.10 1.09 -0.11 0.00 0.52 0.00 0.00 54.79 56.40 2x1e n ASP 294 Cb 0.51 -1.54 -0.02 0.00 -0.72 0.00 0.00 41.12 39.35 2x1e n ASP 294 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 2x1e n ASN 295 N 3.35 -3.78 -4.55 1.67 5.15 -1.26 -4.24 115.26 111.59 2x1e n ASN 295 Ca 0.14 0.08 -0.46 0.00 -0.60 0.00 0.00 54.58 53.74 2x1e n ASN 295 Cb 0.34 -2.78 -0.02 0.00 -0.53 0.00 0.00 39.78 36.79 2x1e n ASN 295 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2x1e n TYR 296 N -3.60 0.95 1.61 1.20 4.19 -0.43 -1.14 117.16 119.94 2x1e n TYR 296 Ca -0.12 0.75 0.15 0.00 3.31 0.00 0.00 57.90 61.99 2x1e n TYR 296 Cb 0.52 -2.20 0.67 0.00 0.49 0.00 0.00 39.34 38.83 2x1e n TYR 296 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 2x1e n PRO 297 N 0.91 1.12 -0.29 2.98 -0.04 -1.26 -4.87 135.00 133.55 2x1e n PRO 297 Ca 0.12 -0.42 -0.03 0.00 -0.04 0.00 0.00 63.50 63.12 2x1e n PRO 297 Cb 0.30 -1.49 0.07 0.00 -0.04 0.00 0.00 33.50 32.33 2x1e n PRO 297 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2x1e n PHE 298 N -0.57 0.71 -1.87 0.54 3.72 -0.29 -1.70 117.46 117.99 2x1e n PHE 298 Ca 0.19 -0.60 -0.29 0.00 -0.05 0.00 0.00 57.45 56.69 2x1e n PHE 298 Cb 0.26 -0.35 0.09 0.00 -0.94 0.00 0.00 39.48 38.53 2x1e n PHE 298 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 2x1e s SER 299 N 0.17 4.57 0.20 4.37 1.04 -1.21 -4.87 113.70 117.98 2x1e s SER 299 Ca 0.15 0.85 -0.11 0.00 0.48 0.00 0.00 55.95 57.32 2x1e s SER 299 Cb 0.12 -1.39 0.26 0.00 0.10 0.00 0.00 66.02 65.10 2x1e s SER 299 CO 0.03 -1.87 1.71 0.40 0.98 0.00 0.00 173.24 174.50 2x1e h ILE 300 N -1.03 0.68 -2.38 -1.02 2.04 -1.78 -2.80 117.51 111.23 2x1e h ILE 300 Ca -0.46 -0.09 -0.68 0.00 1.00 0.00 0.00 64.86 64.62 2x1e h ILE 300 Cb 1.32 0.39 -0.17 0.00 -0.74 0.00 0.00 36.82 37.62 2x1e h ILE 300 CO 0.65 0.05 0.83 0.00 0.00 0.00 0.00 178.15 179.68 2x1e s ARG 302 N 2.89 4.54 0.06 0.00 3.52 -1.06 -4.79 118.95 124.12 2x1e s ARG 302 Ca 0.32 1.48 0.07 0.00 -0.13 0.00 0.00 55.73 57.48 2x1e s ARG 302 Cb -0.06 -2.89 -0.03 0.00 -1.56 0.00 0.00 34.95 30.42 2x1e s ARG 302 CO -0.08 0.21 -0.20 0.00 -0.81 0.00 0.00 175.30 174.42 2x1e s ALA 303 N -1.47 1.70 0.01 6.12 0.00 -0.69 -0.84 121.76 126.59 2x1e s ALA 303 Ca 0.49 -1.08 -0.30 0.00 0.00 0.00 0.00 51.96 51.07 2x1e s ALA 303 Cb -0.23 -0.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.55 2x1e s ALA 303 CO 0.29 0.36 1.12 -0.47 0.00 0.00 0.00 175.76 177.07 2x1e s TYR 304 N -0.90 3.46 -0.08 0.00 5.04 -1.15 -4.65 117.35 119.07 2x1e s TYR 304 Ca 0.06 1.42 -0.01 0.00 -2.44 0.00 0.00 57.07 56.10 2x1e s TYR 304 Cb -0.09 -3.32 0.03 0.00 0.35 0.00 0.00 41.96 38.93 2x1e s TYR 304 CO 0.02 -0.85 -0.01 -1.21 -1.34 0.00 0.00 175.55 172.17 2x1e s GLU 305 N 1.33 0.72 -0.50 4.97 2.02 -1.05 -4.97 118.70 121.20 2x1e s GLU 305 Ca 0.56 0.07 -0.26 0.00 0.02 0.00 0.00 54.97 55.35 2x1e s GLU 305 Cb -0.25 -1.04 -0.06 0.00 0.10 0.00 0.00 34.13 32.87 2x1e s GLU 305 CO 0.27 -0.30 2.30 -2.00 0.02 0.00 0.00 175.26 175.55 2x1e s GLU 306 N 1.94 2.23 0.00 1.61 2.12 -1.26 -0.99 118.70 124.34 2x1e s GLU 306 Ca 0.05 1.28 0.00 0.00 0.36 0.00 0.00 54.97 56.66 2x1e s GLU 306 Cb -0.12 -4.54 0.00 0.00 0.26 0.00 0.00 34.13 29.73 2x1e s GLU 306 CO -0.06 -3.14 0.00 0.41 -0.54 0.00 0.00 175.26 171.93 2x1e n GLY 307 N 5.94 1.78 1.12 -1.50 0.00 -1.26 -4.97 105.19 106.30 2x1e n GLY 307 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.35 2x1e n GLY 307 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2x1e n LYS 308 N 0.00 0.00 -4.68 1.61 5.02 -0.17 -5.08 118.16 114.87 2x1e n LYS 308 Ca 0.00 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.01 2x1e n LYS 308 Cb 0.00 -0.46 -0.17 0.00 -0.02 0.00 0.00 35.03 34.39 2x1e n LYS 308 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2x1e s SER 309 N -5.73 2.42 0.29 4.39 0.15 -0.78 -4.98 113.70 109.45 2x1e s SER 309 Ca 0.00 -0.43 0.17 0.00 0.70 0.00 0.00 55.95 56.39 2x1e s SER 309 Cb 0.00 -1.10 0.10 0.00 -1.71 0.00 0.00 66.02 63.31 2x1e s SER 309 CO 0.00 0.06 1.40 0.03 1.20 0.00 0.00 173.24 175.93 2x1e h ARG 310 N 7.12 0.00 -5.07 5.44 3.08 -1.88 -2.78 114.38 120.30 2x1e h ARG 310 Ca -0.28 0.00 -0.63 0.00 0.07 0.00 0.00 59.98 59.13 2x1e h ARG 310 Cb 1.19 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 31.11 2x1e h ARG 310 CO 0.48 0.36 -0.50 0.20 -1.07 0.00 0.00 179.97 179.45 2x1e s GLY 311 N -4.44 2.92 0.18 0.04 0.00 -1.26 -4.43 107.32 100.33 2x1e s GLY 311 Ca 0.04 -0.61 -0.04 0.00 0.00 0.00 0.00 44.72 44.10 2x1e s GLY 311 CO 0.74 -2.01 0.20 0.00 0.00 0.00 0.00 173.10 172.02 2x1e s ALA 312 N -3.04 0.66 -0.13 3.20 0.00 -0.81 -2.94 121.76 118.69 2x1e s ALA 312 Ca 0.12 -1.37 -0.29 0.00 0.00 0.00 0.00 51.96 50.42 2x1e s ALA 312 Cb 0.01 1.12 -0.03 0.00 0.00 0.00 0.00 23.12 24.22 2x1e s ALA 312 CO 0.08 -0.62 1.46 0.99 0.00 0.00 0.00 175.76 177.67 2x1e s THR 313 N -4.08 3.93 -0.19 0.00 2.01 -0.02 -1.93 115.64 115.35 2x1e s THR 313 Ca 0.29 1.11 0.17 0.00 0.31 0.00 0.00 61.69 63.57 2x1e s THR 313 Cb 0.05 -3.76 -0.25 0.00 0.01 0.00 0.00 72.50 68.56 2x1e s THR 313 CO 0.07 -0.14 0.09 0.18 -0.69 0.00 0.00 174.62 174.12 2x1e n LEU 314 N 7.09 0.13 -3.62 4.42 4.77 -0.14 -3.44 117.00 126.20 2x1e n LEU 314 Ca 0.16 0.01 -0.10 0.00 -0.03 0.00 0.00 56.01 56.05 2x1e n LEU 314 Cb 0.44 0.44 -0.03 0.00 -2.33 0.00 0.00 43.42 41.95 2x1e n LEU 314 CO 0.60 0.51 0.37 0.72 -1.33 0.00 0.00 177.39 178.26 2x1e s PHE 315 N -2.50 -0.32 0.01 -1.77 -0.12 -1.22 0.38 117.98 112.45 2x1e s PHE 315 Ca -0.11 0.01 0.06 0.00 -0.05 0.00 0.00 56.93 56.85 2x1e s PHE 315 Cb 0.06 0.54 -0.02 0.00 -0.63 0.00 0.00 43.02 42.97 2x1e s PHE 315 CO 0.82 -0.96 -0.18 1.21 -0.05 0.00 0.00 175.22 176.07 2x1e s ASN 316 N -2.83 2.12 -0.01 1.98 3.84 0.51 -0.95 114.94 119.61 2x1e s ASN 316 Ca 0.06 -0.40 0.03 0.00 0.21 0.00 0.00 52.86 52.75 2x1e s ASN 316 Cb -0.02 -0.20 -0.01 0.00 -0.55 0.00 0.00 41.25 40.47 2x1e s ASN 316 CO -0.05 0.17 -0.09 -0.51 -2.79 0.00 0.00 177.10 173.83 2x1e s ILE 317 N -0.61 0.68 -0.11 -5.21 2.07 -0.78 -0.90 121.20 116.34 2x1e s ILE 317 Ca 0.06 -0.38 0.00 0.00 -1.41 0.00 0.00 60.65 58.92 2x1e s ILE 317 Cb -0.08 -0.57 0.02 0.00 0.13 0.00 0.00 42.46 41.97 2x1e s ILE 317 CO 0.00 0.18 -0.10 -0.63 -1.91 0.00 0.00 174.94 172.49 2x1e s ILE 318 N -0.22 1.14 -0.27 2.00 1.01 -0.29 -1.77 121.20 122.80 2x1e s ILE 318 Ca 0.03 -0.38 -0.16 0.00 0.00 0.00 0.00 60.65 60.14 2x1e s ILE 318 Cb -0.03 -1.11 -0.03 0.00 0.01 0.00 0.00 42.46 41.29 2x1e s ILE 318 CO -0.00 0.38 0.41 -0.31 0.00 0.00 0.00 174.94 175.42 2x1e s TYR 319 N 1.43 3.25 -0.78 3.97 2.02 0.24 -0.95 117.35 126.53 2x1e s TYR 319 Ca 0.00 0.46 -0.18 0.00 -0.37 0.00 0.00 57.07 56.98 2x1e s TYR 319 Cb -0.13 -2.62 0.14 0.00 -0.40 0.00 0.00 41.96 38.95 2x1e s TYR 319 CO -0.06 -0.25 0.89 0.34 -1.57 0.00 0.00 175.55 174.90 2x1e s ASP 320 N 1.62 6.49 0.31 2.29 -1.08 0.32 -2.52 116.67 124.10 2x1e s ASP 320 Ca 0.17 -1.95 0.00 0.00 -0.52 0.00 0.00 52.55 50.25 2x1e s ASP 320 Cb -0.16 -2.32 0.49 0.00 -1.46 0.00 0.00 42.92 39.48 2x1e s ASP 320 CO 0.10 -0.98 1.89 0.45 0.52 0.00 0.00 175.17 177.15 2x1e h HIS 321 N 8.73 0.81 -0.70 -5.34 3.86 -1.79 0.31 115.15 121.03 2x1e h HIS 321 Ca -0.03 -0.04 0.08 0.00 -1.16 0.00 0.00 60.37 59.22 2x1e h HIS 321 Cb 1.05 -0.25 -0.07 0.00 1.06 0.00 0.00 27.41 29.21 2x1e h HIS 321 CO 1.01 0.63 0.36 0.00 0.86 0.00 0.00 177.93 180.79 2x1e h ALA 322 N 1.44 0.95 -0.02 2.45 0.00 -1.84 -3.16 119.26 119.10 2x1e h ALA 322 Ca 0.19 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2x1e h ALA 322 Cb 0.17 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2x1e h ALA 322 CO -0.02 -0.01 -0.35 0.54 0.00 0.00 0.00 179.25 179.41 2x1e n ARG 323 N -4.84 1.50 -3.87 0.00 1.74 -0.94 -4.99 116.66 105.27 2x1e n ARG 323 Ca 0.10 -1.04 -0.25 0.00 -0.77 0.00 0.00 57.85 55.89 2x1e n ARG 323 Cb 0.24 -1.39 -0.00 0.00 -1.02 0.00 0.00 32.46 30.29 2x1e n ARG 323 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 2x1e n ARG 324 N 0.12 -3.43 -4.74 5.56 0.63 0.06 -5.01 116.66 109.84 2x1e n ARG 324 Ca 0.09 0.46 -0.26 0.00 -0.92 0.00 0.00 57.85 57.21 2x1e n ARG 324 Cb 0.43 -4.63 -0.14 0.00 0.45 0.00 0.00 32.46 28.57 2x1e n ARG 324 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 2x1e s GLU 325 N -6.36 1.47 -0.18 -0.14 2.02 -1.07 -4.52 118.70 109.92 2x1e s GLU 325 Ca 0.05 -0.89 0.01 0.00 0.02 0.00 0.00 54.97 54.16 2x1e s GLU 325 Cb -0.02 -1.54 0.02 0.00 0.10 0.00 0.00 34.13 32.69 2x1e s GLU 325 CO 0.87 0.40 -0.19 0.00 0.02 0.00 0.00 175.26 176.36 2x1e s ALA 326 N -0.72 2.35 -0.24 5.21 0.00 -0.64 -0.52 121.76 127.20 2x1e s ALA 326 Ca 0.08 -1.20 -0.14 0.00 0.00 0.00 0.00 51.96 50.70 2x1e s ALA 326 Cb -0.09 -1.18 -0.04 0.00 0.00 0.00 0.00 23.12 21.81 2x1e s ALA 326 CO 0.01 -0.30 0.32 0.99 0.00 0.00 0.00 175.76 176.77 2x1e s THR 327 N 1.22 5.24 -0.17 0.00 2.01 -0.13 0.05 115.64 123.86 2x1e s THR 327 Ca 0.03 0.48 -0.04 0.00 0.31 0.00 0.00 61.69 62.48 2x1e s THR 327 Cb -0.13 -3.65 -0.02 0.00 0.01 0.00 0.00 72.50 68.70 2x1e s THR 327 CO -0.11 0.24 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.33 2x1e s VAL 328 N 1.59 3.80 -0.23 3.82 1.01 0.33 -1.13 120.40 129.59 2x1e s VAL 328 Ca 0.14 -0.38 -0.01 0.00 0.00 0.00 0.00 61.98 61.72 2x1e s VAL 328 Cb -0.15 -2.68 0.02 0.00 0.00 0.00 0.00 36.38 33.58 2x1e s VAL 328 CO 0.08 0.48 -0.10 -0.13 0.00 0.00 0.00 175.10 175.43 2x1e s ARG 329 N 0.57 2.91 0.26 2.72 0.52 -0.08 -1.47 118.95 124.38 2x1e s ARG 329 Ca -0.03 -0.92 -0.22 0.00 -0.52 0.00 0.00 55.73 54.05 2x1e s ARG 329 Cb -0.14 -2.88 -0.09 0.00 0.52 0.00 0.00 34.95 32.36 2x1e s ARG 329 CO 0.03 -0.34 0.80 -1.17 0.02 0.00 0.00 175.30 174.64 2x1e s LEU 330 N 1.32 4.33 0.00 2.53 2.96 -0.09 -0.36 118.68 129.37 2x1e s LEU 330 Ca 0.01 1.56 0.00 0.00 -0.22 0.00 0.00 54.13 55.48 2x1e s LEU 330 Cb -0.16 -3.75 0.00 0.00 0.50 0.00 0.00 46.19 42.78 2x1e s LEU 330 CO -0.06 -0.01 0.00 0.61 -1.32 0.00 0.00 176.35 175.57 2x1e n GLY 331 N 0.63 -1.07 3.72 7.98 0.00 0.16 0.27 105.19 116.87 2x1e n GLY 331 Ca -0.01 -1.31 -0.40 0.00 0.00 0.00 0.00 46.02 44.30 2x1e n GLY 331 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2x1e s ARG 332 N 0.00 4.46 0.64 1.61 0.52 -1.22 -3.59 118.95 121.37 2x1e s ARG 332 Ca 0.00 0.98 0.40 0.00 -0.52 0.00 0.00 55.73 56.60 2x1e s ARG 332 Cb 0.00 -3.45 2.19 0.00 0.52 0.00 0.00 34.95 34.22 2x1e s ARG 332 CO 0.00 0.05 2.23 -1.35 0.02 0.00 0.00 175.30 176.25 2x1e h PRO 333 N 6.75 0.00 -0.46 3.54 0.11 -1.89 -0.66 132.00 139.39 2x1e h PRO 333 Ca -0.41 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.68 2x1e h PRO 333 Cb 1.20 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 2x1e h PRO 333 CO 0.75 0.00 0.21 1.79 -0.21 0.00 0.00 178.00 180.54 2x1e h THR 334 N 0.00 1.17 -1.27 -1.15 1.35 -1.86 -3.40 112.91 107.75 2x1e h THR 334 Ca 0.00 -0.49 -0.15 0.00 -0.55 0.00 0.00 66.41 65.22 2x1e h THR 334 Cb 0.11 0.59 -0.22 0.00 -1.73 0.00 0.00 68.15 66.90 2x1e h THR 334 CO 0.00 0.20 -0.52 0.54 -0.25 0.00 0.00 175.52 175.48 2x1e s ASN 335 N -6.63 -0.78 0.45 5.36 2.20 -0.31 -5.12 114.94 110.10 2x1e s ASN 335 Ca -0.09 -1.07 -0.24 0.00 -0.94 0.00 0.00 52.86 50.52 2x1e s ASN 335 Cb 0.17 1.56 -0.08 0.00 -2.00 0.00 0.00 41.25 40.90 2x1e s ASN 335 CO 0.76 -0.19 1.25 -2.84 -2.94 0.00 0.00 177.10 173.14 2x1e s PRO 336 N 1.66 3.76 0.22 3.55 0.02 -0.87 -4.37 135.00 138.97 2x1e s PRO 336 Ca 0.17 2.00 -0.09 0.00 0.02 0.00 0.00 61.00 63.10 2x1e s PRO 336 Cb -0.07 -2.54 0.19 0.00 0.02 0.00 0.00 34.50 32.11 2x1e s PRO 336 CO -0.06 -0.61 1.89 -0.44 -0.33 0.00 0.00 177.00 177.45 2x1e h ASP 337 N 2.24 0.91 -5.04 2.53 3.45 -0.46 -3.46 116.42 116.59 2x1e h ASP 337 Ca -0.50 -0.02 0.09 0.00 0.43 0.00 0.00 57.03 57.04 2x1e h ASP 337 Cb 1.25 -0.22 -0.09 0.00 -0.56 0.00 0.00 39.33 39.71 2x1e h ASP 337 CO 0.61 0.65 0.35 -1.83 -1.57 0.00 0.00 179.24 177.45 2x1e s GLU 338 N -6.13 1.33 -0.01 3.56 -1.05 -1.25 -5.00 118.70 110.17 2x1e s GLU 338 Ca -0.13 -0.66 0.00 0.00 -0.15 0.00 0.00 54.97 54.03 2x1e s GLU 338 Cb 0.16 0.50 0.01 0.00 -0.44 0.00 0.00 34.13 34.36 2x1e s GLU 338 CO 0.79 -0.60 0.00 1.41 0.95 0.00 0.00 175.26 177.81 2x1e s MET 339 N -3.55 0.08 0.22 -4.83 -2.45 -1.26 -0.91 119.30 106.60 2x1e s MET 339 Ca 0.08 0.03 -0.10 0.00 -1.25 0.00 0.00 55.69 54.45 2x1e s MET 339 Cb -0.03 -0.16 -0.01 0.00 1.25 0.00 0.00 34.83 35.88 2x1e s MET 339 CO -0.01 -0.04 0.38 -0.59 1.05 0.00 0.00 175.02 175.81 2x1e s PHE 340 N 0.35 0.50 -0.10 4.11 -0.71 -0.54 -5.01 117.98 116.58 2x1e s PHE 340 Ca -0.03 -0.83 0.03 0.00 -1.04 0.00 0.00 56.93 55.06 2x1e s PHE 340 Cb -0.05 0.02 0.00 0.00 -1.21 0.00 0.00 43.02 41.78 2x1e s PHE 340 CO -0.01 -0.88 -0.21 0.08 -1.34 0.00 0.00 175.22 172.86 2x1e s VAL 341 N -4.03 1.86 -0.18 -2.49 1.01 -1.26 -0.51 120.40 114.80 2x1e s VAL 341 Ca 0.24 -0.90 -0.10 0.00 0.00 0.00 0.00 61.98 61.22 2x1e s VAL 341 Cb 0.01 -1.63 -0.05 0.00 0.00 0.00 0.00 36.38 34.72 2x1e s VAL 341 CO 0.08 0.52 0.16 -0.04 0.00 0.00 0.00 175.10 175.82 2x1e s MET 342 N 0.45 4.13 0.05 2.72 -1.94 0.11 -4.94 119.30 119.88 2x1e s MET 342 Ca -0.17 -0.14 0.02 0.00 -1.71 0.00 0.00 55.69 53.68 2x1e s MET 342 Cb -0.17 -3.40 -0.03 0.00 2.01 0.00 0.00 34.83 33.24 2x1e s MET 342 CO 0.07 0.34 -0.07 1.03 -0.01 0.00 0.00 175.02 176.38 2x1e s ARG 343 N 0.23 0.54 -0.02 2.03 0.52 -1.26 -1.62 118.95 119.37 2x1e s ARG 343 Ca 0.10 -0.83 -0.16 0.00 -0.52 0.00 0.00 55.73 54.32 2x1e s ARG 343 Cb -0.12 -0.22 -0.05 0.00 0.52 0.00 0.00 34.95 35.09 2x1e s ARG 343 CO -0.00 0.02 0.45 -0.06 0.02 0.00 0.00 175.30 175.73 2x1e s PHE 344 N -1.77 3.68 0.24 -0.53 0.08 -1.26 -5.10 117.98 113.32 2x1e s PHE 344 Ca -0.07 1.00 0.03 0.00 0.12 0.00 0.00 56.93 58.01 2x1e s PHE 344 Cb -0.07 -2.40 0.04 0.00 -0.57 0.00 0.00 43.02 40.02 2x1e s PHE 344 CO -0.01 0.50 0.33 -0.40 -0.10 0.00 0.00 175.22 175.54 2x1e n ASP 345 N 2.35 0.80 0.17 1.36 5.68 -1.26 -4.98 116.55 120.68 2x1e n ASP 345 Ca -0.11 -1.59 0.04 0.00 -0.50 0.00 0.00 54.79 52.63 2x1e n ASP 345 Cb 0.52 -0.18 0.23 0.00 -1.14 0.00 0.00 41.12 40.55 2x1e n ASP 345 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2x1e h GLU 346 N 0.00 0.00 -0.49 0.11 5.08 -1.99 -2.47 114.58 114.82 2x1e h GLU 346 Ca -0.11 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.12 2x1e h GLU 346 Cb 0.50 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 2x1e h GLU 346 CO 0.15 0.43 -0.19 0.93 -1.00 0.00 0.00 179.01 179.34 2x1e h GLU 347 N 0.00 0.98 -0.98 2.33 4.39 -1.99 -0.19 114.58 119.13 2x1e h GLU 347 Ca -0.00 -0.40 0.07 0.00 0.34 0.00 0.00 59.36 59.37 2x1e h GLU 347 Cb 1.07 -0.04 -0.07 0.00 -0.10 0.00 0.00 28.75 29.61 2x1e h GLU 347 CO 0.06 1.07 0.62 -0.44 -1.16 0.00 0.00 179.01 179.16 2x1e h ASP 348 N 0.85 0.98 -0.12 1.42 3.32 -1.89 -1.89 116.42 119.10 2x1e h ASP 348 Ca 0.12 0.02 -0.11 0.00 0.02 0.00 0.00 57.03 57.08 2x1e h ASP 348 Cb 0.76 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.12 2x1e h ASP 348 CO 0.06 0.61 -0.34 -0.33 -1.72 0.00 0.00 179.24 177.53 2x1e h GLU 349 N 1.11 0.45 -0.32 3.56 5.08 -1.24 -3.00 114.58 120.23 2x1e h GLU 349 Ca 0.43 -0.31 0.06 0.00 -1.00 0.00 0.00 59.36 58.54 2x1e h GLU 349 Cb 0.22 0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.46 2x1e h GLU 349 CO -0.19 0.93 -0.02 0.00 -1.00 0.00 0.00 179.01 178.74 2x1e h ARG 350 N 0.04 0.07 -0.68 2.33 3.08 -0.86 -1.98 114.38 116.36 2x1e h ARG 350 Ca -0.01 -0.00 0.13 0.00 0.07 0.00 0.00 59.98 60.17 2x1e h ARG 350 Cb 0.95 -0.02 -0.10 0.00 0.08 0.00 0.00 29.97 30.89 2x1e h ARG 350 CO 0.07 0.05 0.19 1.03 -1.07 0.00 0.00 179.97 180.24 2x1e h SER 351 N 0.07 0.08 0.19 7.04 0.87 -1.41 -0.31 113.55 120.08 2x1e h SER 351 Ca 0.15 0.12 -0.04 0.00 -1.23 0.00 0.00 61.79 60.80 2x1e h SER 351 Cb 0.21 0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.32 2x1e h SER 351 CO -0.27 0.02 -0.18 0.00 -0.53 0.00 0.00 176.83 175.87 2x1e h ALA 352 N 1.54 1.67 -0.00 6.23 0.00 -1.23 -0.80 119.26 126.66 2x1e h ALA 352 Ca 0.37 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2x1e h ALA 352 Cb 0.58 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2x1e h ALA 352 CO -0.44 0.22 -0.50 1.28 0.00 0.00 0.00 179.25 179.81 2x1e n LEU 353 N -4.27 0.89 -3.71 0.00 4.77 -0.45 -3.83 117.00 110.40 2x1e n LEU 353 Ca -0.02 -0.24 -0.25 0.00 -0.03 0.00 0.00 56.01 55.47 2x1e n LEU 353 Cb 0.24 -0.15 0.03 0.00 -2.33 0.00 0.00 43.42 41.21 2x1e n LEU 353 CO 0.36 0.19 -0.10 -3.20 -1.33 0.00 0.00 177.39 173.31 2x1e n ASN 354 N -1.09 -2.79 0.00 -1.43 5.15 -0.26 -4.77 115.26 110.08 2x1e n ASN 354 Ca 0.08 -0.92 0.00 0.00 -0.60 0.00 0.00 54.58 53.14 2x1e n ASN 354 Cb 0.35 -3.71 0.00 0.00 -0.53 0.00 0.00 39.78 35.89 2x1e n ASN 354 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66