#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x1e n LEU 2 N 0.00 3.23 -4.48 -0.89 7.94 -1.26 -4.81 117.00 116.73 2x1e n LEU 2 Ca 0.00 1.02 -0.33 0.00 -1.11 0.00 0.00 56.01 55.59 2x1e n LEU 2 Cb 0.00 -1.38 -0.13 0.00 0.53 0.00 0.00 43.42 42.45 2x1e n LEU 2 CO 0.00 -0.18 -0.39 -2.28 -1.11 0.00 0.00 177.39 173.42 2x1e s HIS 3 N 2.84 2.92 -0.13 1.96 5.65 -1.26 -0.17 115.29 127.10 2x1e s HIS 3 Ca 0.88 -0.31 0.01 0.00 0.25 0.00 0.00 55.06 55.89 2x1e s HIS 3 Cb -0.71 -1.84 0.02 0.00 -1.18 0.00 0.00 32.58 28.87 2x1e s HIS 3 CO 0.47 0.02 -0.16 0.42 -0.65 0.00 0.00 174.74 174.85 2x1e s ILE 4 N -0.02 1.61 -0.34 0.89 1.01 -0.48 -4.98 121.20 118.89 2x1e s ILE 4 Ca -0.01 -0.69 -0.24 0.00 0.00 0.00 0.00 60.65 59.71 2x1e s ILE 4 Cb -0.14 -1.48 0.01 0.00 0.01 0.00 0.00 42.46 40.86 2x1e s ILE 4 CO 0.03 0.46 0.82 -0.22 0.00 0.00 0.00 174.94 176.04 2x1e s LEU 5 N 1.19 4.08 -0.09 2.97 2.96 -1.26 -1.68 118.68 126.85 2x1e s LEU 5 Ca -0.01 0.53 0.00 0.00 -0.22 0.00 0.00 54.13 54.43 2x1e s LEU 5 Cb -0.14 -3.11 -0.03 0.00 0.50 0.00 0.00 46.19 43.42 2x1e s LEU 5 CO -0.06 -0.72 -0.08 0.00 -1.32 0.00 0.00 176.35 174.17 2x1e s GLN 7 N -0.40 0.75 0.00 0.00 0.74 -1.26 -0.14 119.66 119.35 2x1e s GLN 7 Ca 0.06 0.15 0.00 0.00 0.05 0.00 0.00 55.36 55.62 2x1e s GLN 7 Cb -0.12 0.35 0.00 0.00 1.10 0.00 0.00 33.01 34.33 2x1e s GLN 7 CO 0.02 -0.19 0.00 0.41 -0.55 0.00 0.00 175.29 174.98 2x1e n GLY 8 N 1.57 0.23 3.78 2.59 0.00 -1.16 -4.12 105.19 108.08 2x1e n GLY 8 Ca -0.19 -1.91 -0.30 0.00 0.00 0.00 0.00 46.02 43.62 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 3.25 0.20 2.61 -4.23 -1.26 -4.76 115.64 111.45 2x1e s THR 9 Ca 0.00 0.41 -0.11 0.00 -1.18 0.00 0.00 61.69 60.81 2x1e s THR 9 Cb 0.00 -3.03 0.12 0.00 1.34 0.00 0.00 72.50 70.93 2x1e s THR 9 CO 0.00 -0.53 1.81 -0.65 -0.54 0.00 0.00 174.62 174.71 2x1e h PRO 10 N -1.12 0.63 -0.77 3.99 0.11 -1.93 -0.76 132.00 132.14 2x1e h PRO 10 Ca -0.46 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.62 2x1e h PRO 10 Cb 1.25 -0.14 -0.04 0.00 0.11 0.00 0.00 31.00 32.18 2x1e h PRO 10 CO 0.56 0.42 0.51 0.35 -0.21 0.00 0.00 178.00 179.62 2x1e h PHE 11 N 0.65 0.97 -0.54 0.65 3.04 -1.88 -1.50 116.94 118.33 2x1e h PHE 11 Ca 0.27 0.02 -0.05 0.00 3.98 0.00 0.00 57.97 62.19 2x1e h PHE 11 Cb 0.14 -0.33 -0.02 0.00 2.56 0.00 0.00 35.95 38.30 2x1e h PHE 11 CO -0.08 0.62 0.13 1.49 -2.02 0.00 0.00 178.31 178.45 2x1e h GLU 12 N 1.05 0.86 -0.43 1.11 4.81 -1.74 0.20 114.58 120.43 2x1e h GLU 12 Ca 0.28 -0.21 0.03 0.00 -0.13 0.00 0.00 59.36 59.33 2x1e h GLU 12 Cb -0.12 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.12 2x1e h GLU 12 CO -0.06 0.81 0.23 0.82 -0.73 0.00 0.00 179.01 180.08 2x1e h ILE 13 N 0.75 1.00 -0.32 2.32 2.04 -0.98 -1.15 117.51 121.18 2x1e h ILE 13 Ca 0.17 -0.16 -0.02 0.00 1.00 0.00 0.00 64.86 65.85 2x1e h ILE 13 Cb 0.34 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 2x1e h ILE 13 CO 0.00 0.09 0.14 1.23 0.00 0.00 0.00 178.15 179.61 2x1e h GLY 14 N 0.47 0.51 0.86 5.37 0.00 -0.96 -2.62 103.07 106.70 2x1e h GLY 14 Ca 0.18 -0.26 0.03 0.00 0.00 0.00 0.00 47.33 47.27 2x1e h GLY 14 CO -0.11 0.25 0.36 -1.82 0.00 0.00 0.00 176.54 175.23 2x1e h TYR 15 N 0.38 0.68 -0.08 5.60 5.03 -0.33 0.22 116.97 128.46 2x1e h TYR 15 Ca 0.11 0.02 0.02 0.00 2.58 0.00 0.00 58.73 61.45 2x1e h TYR 15 Cb 0.15 -0.22 -0.02 0.00 1.55 0.00 0.00 36.73 38.20 2x1e h TYR 15 CO -0.01 0.38 -0.02 1.49 -1.32 0.00 0.00 178.16 178.69 2x1e h GLU 16 N 0.71 0.01 0.16 1.82 4.57 -1.19 0.10 114.58 120.77 2x1e h GLU 16 Ca 0.24 -0.00 0.01 0.00 -1.18 0.00 0.00 59.36 58.43 2x1e h GLU 16 Cb 0.03 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.60 2x1e h GLU 16 CO -0.11 0.00 -0.22 1.25 -1.18 0.00 0.00 179.01 178.75 2x1e h HIS 17 N 0.01 -0.59 -0.38 0.92 2.76 -1.07 -2.06 115.15 114.74 2x1e h HIS 17 Ca 0.04 0.01 0.05 0.00 -2.20 0.00 0.00 60.37 58.27 2x1e h HIS 17 Cb 0.06 0.24 -0.04 0.00 1.55 0.00 0.00 27.41 29.21 2x1e h HIS 17 CO -0.13 -0.32 0.11 0.78 -1.30 0.00 0.00 177.93 177.07 2x1e h GLY 18 N -0.44 0.47 0.81 5.26 0.00 -0.31 -1.74 103.07 107.11 2x1e h GLY 18 Ca 0.01 -0.06 -0.14 0.00 0.00 0.00 0.00 47.33 47.15 2x1e h GLY 18 CO -0.09 0.01 -0.52 1.48 0.00 0.00 0.00 176.54 177.42 2x1e h SER 19 N 0.26 0.55 0.48 0.19 4.64 -0.73 -1.72 113.55 117.21 2x1e h SER 19 Ca 0.18 -0.69 -0.06 0.00 -0.47 0.00 0.00 61.79 60.74 2x1e h SER 19 Cb 0.17 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.09 2x1e h SER 19 CO -0.20 1.16 -0.31 0.00 -0.87 0.00 0.00 176.83 176.62 2x1e h ALA 20 N 0.40 1.28 -0.30 5.18 0.00 -1.39 -3.11 119.26 121.32 2x1e h ALA 20 Ca -0.05 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 2x1e h ALA 20 Cb 1.19 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 2x1e h ALA 20 CO 0.10 0.38 0.01 0.00 0.00 0.00 0.00 179.25 179.74 2x1e n ALA 21 N -2.38 3.19 -0.17 0.00 0.00 -0.66 -4.81 120.51 115.67 2x1e n ALA 21 Ca -0.01 -2.35 -0.03 0.00 0.00 0.00 0.00 53.44 51.05 2x1e n ALA 21 Cb 0.38 -0.76 0.03 0.00 0.00 0.00 0.00 19.45 19.11 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 1.91 -0.07 -0.62 0.00 3.64 -1.24 0.14 116.57 120.34 2x1e h LYS 22 Ca 0.02 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.32 2x1e h LYS 22 Cb 1.52 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.34 2x1e h LYS 22 CO 0.27 -0.05 0.04 0.00 -2.27 0.00 0.00 179.45 177.44 2x1e h ALA 23 N 1.34 0.90 -0.32 5.00 0.00 -1.87 -2.42 119.26 121.88 2x1e h ALA 23 Ca 0.25 -0.29 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 2x1e h ALA 23 Cb 0.45 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2x1e h ALA 23 CO -0.57 0.66 -0.22 0.28 0.00 0.00 0.00 179.25 179.40 2x1e h VAL 24 N 0.97 1.27 -0.34 0.00 2.07 -1.58 -2.89 116.25 115.74 2x1e h VAL 24 Ca 0.18 -1.27 -0.12 0.00 0.82 0.00 0.00 66.70 66.31 2x1e h VAL 24 Cb 0.51 1.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 2x1e h VAL 24 CO 0.02 0.41 -0.27 0.40 0.02 0.00 0.00 177.57 178.16 2x1e h ILE 25 N 0.54 1.28 -0.81 4.57 2.04 -0.61 -0.80 117.51 123.72 2x1e h ILE 25 Ca 0.08 -1.38 0.07 0.00 1.00 0.00 0.00 64.86 64.63 2x1e h ILE 25 Cb 0.67 1.30 -0.06 0.00 -0.74 0.00 0.00 36.82 38.00 2x1e h ILE 25 CO 0.05 0.45 0.48 0.00 0.00 0.00 0.00 178.15 179.14 2x1e h ALA 26 N 1.10 1.11 -0.52 1.87 0.00 -1.24 -0.87 119.26 120.71 2x1e h ALA 26 Ca 0.08 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 2x1e h ALA 26 Cb 0.77 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 2x1e h ALA 26 CO 0.06 0.19 -0.15 0.00 0.00 0.00 0.00 179.25 179.35 2x1e h ARG 27 N 0.87 1.01 -0.72 0.00 3.08 -1.27 -1.63 114.38 115.72 2x1e h ARG 27 Ca 0.36 -0.40 0.03 0.00 0.07 0.00 0.00 59.98 60.04 2x1e h ARG 27 Cb 0.21 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.16 2x1e h ARG 27 CO -0.19 1.08 0.46 0.77 -1.07 0.00 0.00 179.97 181.02 2x1e h SER 28 N 0.89 0.77 -0.08 7.04 0.02 -0.72 -0.53 113.55 120.94 2x1e h SER 28 Ca 0.13 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 2x1e h SER 28 Cb 0.72 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.09 2x1e h SER 28 CO 0.06 0.54 0.02 0.40 -1.14 0.00 0.00 176.83 176.70 2x1e h ILE 29 N 0.91 1.19 -0.33 3.27 2.04 -1.03 -0.91 117.51 122.65 2x1e h ILE 29 Ca 0.28 -0.57 0.04 0.00 1.00 0.00 0.00 64.86 65.61 2x1e h ILE 29 Cb -0.01 1.42 -0.04 0.00 -0.74 0.00 0.00 36.82 37.45 2x1e h ILE 29 CO -0.10 0.16 0.11 0.44 0.00 0.00 0.00 178.15 178.76 2x1e h ASP 30 N -0.08 0.12 -0.19 1.72 3.32 -1.06 -0.72 116.42 119.53 2x1e h ASP 30 Ca 0.02 0.04 0.02 0.00 0.02 0.00 0.00 57.03 57.13 2x1e h ASP 30 Cb 0.24 0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 2x1e h ASP 30 CO -0.00 0.10 0.05 0.15 -1.72 0.00 0.00 179.24 177.82 2x1e h PHE 31 N 0.25 0.08 -0.43 4.55 3.57 -1.05 -2.50 116.94 121.42 2x1e h PHE 31 Ca 0.15 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.65 2x1e h PHE 31 Cb 0.12 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.83 2x1e h PHE 31 CO -0.14 0.03 0.22 0.00 -2.23 0.00 0.00 178.31 176.20 2x1e h ALA 32 N 1.13 0.55 -0.30 2.41 0.00 -0.76 0.06 119.26 122.34 2x1e h ALA 32 Ca 0.08 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 54.97 2x1e h ALA 32 Cb 0.07 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 17.63 2x1e h ALA 32 CO -0.10 0.08 -0.12 0.28 0.00 0.00 0.00 179.25 179.39 2x1e h VAL 33 N 0.55 0.61 -0.12 0.00 2.07 -1.12 0.15 116.25 118.39 2x1e h VAL 33 Ca 0.15 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.70 2x1e h VAL 33 Cb 0.08 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.43 2x1e h VAL 33 CO -0.02 0.00 -0.05 0.44 0.02 0.00 0.00 177.57 177.96 2x1e h ASP 34 N -0.06 -0.17 -0.01 0.57 3.32 -1.03 -0.88 116.42 118.15 2x1e h ASP 34 Ca 0.15 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.25 2x1e h ASP 34 Cb 0.29 0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.94 2x1e h ASP 34 CO -0.35 -0.07 0.01 0.25 -1.72 0.00 0.00 179.24 177.37 2x1e h LEU 35 N -0.03 0.02 -0.26 1.55 5.85 -0.63 0.24 115.31 122.04 2x1e h LEU 35 Ca 0.06 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 2x1e h LEU 35 Cb 0.13 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 2x1e h LEU 35 CO -0.14 0.03 0.12 0.40 -0.34 0.00 0.00 178.44 178.51 2x1e h ILE 36 N 0.00 1.15 -0.45 4.05 2.04 -0.61 0.17 117.51 123.86 2x1e h ILE 36 Ca 0.01 -0.44 0.01 0.00 1.00 0.00 0.00 64.86 65.43 2x1e h ILE 36 Cb 0.02 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 2x1e h ILE 36 CO -0.00 0.15 0.28 0.03 0.00 0.00 0.00 178.15 178.61 2x1e h ARG 37 N 0.28 0.56 -0.02 2.37 3.08 -1.13 -1.76 114.38 117.76 2x1e h ARG 37 Ca 0.09 -0.03 -0.09 0.00 0.07 0.00 0.00 59.98 60.02 2x1e h ARG 37 Cb 0.13 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 2x1e h ARG 37 CO -0.01 0.37 -0.39 0.78 -1.07 0.00 0.00 179.97 179.65 2x1e h GLY 38 N 0.57 0.05 0.55 0.04 0.00 -0.63 -3.25 103.07 100.40 2x1e h GLY 38 Ca 0.17 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.46 2x1e h GLY 38 CO -0.05 0.04 -1.00 0.28 0.00 0.00 0.00 176.54 175.80 2x1e n LYS 39 N -4.07 0.24 -4.51 4.80 4.76 0.57 -4.96 118.16 114.98 2x1e n LYS 39 Ca -0.02 -0.01 -0.27 0.00 -2.87 0.00 0.00 58.31 55.15 2x1e n LYS 39 Cb 0.43 -1.57 -0.10 0.00 -1.84 0.00 0.00 35.03 31.95 2x1e n LYS 39 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2x1e s THR 40 N -3.16 2.20 0.00 -0.18 -4.23 -0.68 -4.46 115.64 105.13 2x1e s THR 40 Ca 0.05 -2.04 0.00 0.00 -1.18 0.00 0.00 61.69 58.51 2x1e s THR 40 Cb 0.15 -2.85 0.00 0.00 1.34 0.00 0.00 72.50 71.14 2x1e s THR 40 CO 0.80 -0.10 0.83 2.29 -0.54 0.00 0.00 174.62 177.90 2x1e n LYS 41 N -0.93 1.97 -1.75 3.99 2.85 -1.26 -4.84 118.16 118.19 2x1e n LYS 41 Ca -0.05 -1.17 -0.33 0.00 -1.05 0.00 0.00 58.31 55.71 2x1e n LYS 41 Cb 0.65 -0.89 0.05 0.00 -0.65 0.00 0.00 35.03 34.19 2x1e n LYS 41 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 2x1e s LYS 42 N -0.69 2.75 0.67 -1.58 -0.14 -1.26 -5.02 119.74 114.47 2x1e s LYS 42 Ca 0.00 1.47 -0.16 0.00 -1.36 0.00 0.00 55.97 55.92 2x1e s LYS 42 Cb 0.00 -1.94 0.01 0.00 -1.68 0.00 0.00 37.83 34.22 2x1e s LYS 42 CO 0.00 -1.31 1.19 0.95 -0.76 0.00 0.00 175.35 175.42 2x1e s THR 43 N -2.23 2.62 0.46 2.17 -4.23 -1.26 -4.79 115.64 108.38 2x1e s THR 43 Ca 0.69 0.33 0.30 0.00 -1.18 0.00 0.00 61.69 61.83 2x1e s THR 43 Cb -0.22 -2.95 0.33 0.00 1.34 0.00 0.00 72.50 71.00 2x1e s THR 43 CO 0.41 -0.14 2.14 -0.78 -0.54 0.00 0.00 174.62 175.71 2x1e h ASP 44 N 0.18 0.00 -0.30 3.99 3.58 -1.99 0.15 116.42 122.02 2x1e h ASP 44 Ca -0.48 0.00 -0.10 0.00 0.42 0.00 0.00 57.03 56.86 2x1e h ASP 44 Cb 1.29 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.33 2x1e h ASP 44 CO 0.52 0.07 -0.22 -0.08 -2.88 0.00 0.00 179.24 176.66 2x1e h GLU 45 N 0.00 0.69 -0.42 0.28 4.57 -2.00 -2.80 114.58 114.90 2x1e h GLU 45 Ca -0.00 -0.33 -0.14 0.00 -1.18 0.00 0.00 59.36 57.71 2x1e h GLU 45 Cb 0.24 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.82 2x1e h GLU 45 CO 0.01 0.93 -0.28 1.49 -1.18 0.00 0.00 179.01 179.98 2x1e h GLU 46 N 0.44 0.90 -0.56 1.92 4.22 -1.19 -2.37 114.58 117.94 2x1e h GLU 46 Ca 0.06 -0.41 -0.01 0.00 0.08 0.00 0.00 59.36 59.08 2x1e h GLU 46 Cb 0.77 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.97 2x1e h GLU 46 CO 0.06 1.06 0.30 -0.07 -2.18 0.00 0.00 179.01 178.18 2x1e h LEU 47 N 0.76 0.70 -0.83 1.64 3.38 -0.92 -2.11 115.31 117.95 2x1e h LEU 47 Ca 0.09 -0.10 0.08 0.00 0.09 0.00 0.00 57.88 58.04 2x1e h LEU 47 Cb 0.84 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 41.35 2x1e h LEU 47 CO 0.07 0.60 0.49 0.11 0.09 0.00 0.00 178.44 179.81 2x1e h LYS 48 N 0.75 0.83 -0.65 1.13 1.79 -1.34 0.26 116.57 119.34 2x1e h LYS 48 Ca 0.20 -0.05 -0.06 0.00 -2.18 0.00 0.00 60.65 58.56 2x1e h LYS 48 Cb 0.06 -0.19 -0.03 0.00 -1.58 0.00 0.00 32.23 30.49 2x1e h LYS 48 CO -0.03 0.55 0.17 1.96 -1.08 0.00 0.00 179.45 181.02 2x1e h GLN 49 N 0.86 1.01 -0.29 3.15 4.20 -1.01 -0.18 115.11 122.86 2x1e h GLN 49 Ca 0.38 -0.22 -0.08 0.00 0.06 0.00 0.00 58.65 58.79 2x1e h GLN 49 Cb 0.27 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 2x1e h GLN 49 CO -0.21 0.89 -0.14 0.28 -0.67 0.00 0.00 178.83 178.98 2x1e h VAL 50 N 0.97 1.29 -0.61 -0.54 2.07 -0.94 -2.80 116.25 115.70 2x1e h VAL 50 Ca 0.21 -1.24 0.04 0.00 0.82 0.00 0.00 66.70 66.53 2x1e h VAL 50 Cb 0.32 1.49 -0.05 0.00 -1.52 0.00 0.00 31.29 31.53 2x1e h VAL 50 CO -0.00 0.39 0.35 0.25 0.02 0.00 0.00 177.57 178.58 2x1e h LEU 51 N 0.35 0.53 -0.58 2.57 5.85 -0.64 -0.99 115.31 122.41 2x1e h LEU 51 Ca 0.06 0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.81 2x1e h LEU 51 Cb 0.66 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.57 2x1e h LEU 51 CO 0.04 0.36 0.38 -1.28 -0.34 0.00 0.00 178.44 177.60 2x1e h SER 52 N 0.66 0.65 -0.11 1.25 0.87 -1.03 -0.91 113.55 114.93 2x1e h SER 52 Ca 0.26 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.79 2x1e h SER 52 Cb 0.11 -0.16 -0.00 0.00 -0.44 0.00 0.00 62.40 61.91 2x1e h SER 52 CO -0.15 0.46 0.01 -0.61 -0.53 0.00 0.00 176.83 176.02 2x1e h GLN 53 N 0.77 0.19 -0.63 2.24 4.15 -1.21 -2.06 115.11 118.55 2x1e h GLN 53 Ca 0.22 -0.05 0.09 0.00 0.77 0.00 0.00 58.65 59.67 2x1e h GLN 53 Cb -0.07 -0.02 -0.07 0.00 0.21 0.00 0.00 27.48 27.53 2x1e h GLN 53 CO -0.06 0.41 0.28 -0.07 -1.93 0.00 0.00 178.83 177.47 2x1e h LEU 54 N -0.06 0.34 -0.30 -2.39 3.38 -1.04 0.58 115.31 115.82 2x1e h LEU 54 Ca 0.03 0.06 0.02 0.00 0.09 0.00 0.00 57.88 58.09 2x1e h LEU 54 Cb 0.32 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 2x1e h LEU 54 CO 0.00 0.21 0.14 1.23 0.09 0.00 0.00 178.44 180.11 2x1e h GLY 55 N 0.50 0.40 0.96 0.83 0.00 -1.11 -1.23 103.07 103.42 2x1e h GLY 55 Ca 0.31 -0.10 0.01 0.00 0.00 0.00 0.00 47.33 47.55 2x1e h GLY 55 CO -0.27 0.08 0.44 -0.09 0.00 0.00 0.00 176.54 176.70 2x1e h ARG 56 N 0.30 0.86 -0.01 4.80 2.43 -0.72 -1.13 114.38 120.91 2x1e h ARG 56 Ca 0.13 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 2x1e h ARG 56 Cb 0.05 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.40 2x1e h ARG 56 CO -0.09 0.57 -0.02 0.28 -1.51 0.00 0.00 179.97 179.20 2x1e h VAL 57 N 0.88 0.95 -0.53 0.20 2.07 -0.61 -2.04 116.25 117.17 2x1e h VAL 57 Ca 0.26 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.76 2x1e h VAL 57 Cb -0.06 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 2x1e h VAL 57 CO -0.07 0.00 0.27 0.40 0.02 0.00 0.00 177.57 178.19 2x1e h ILE 58 N -0.03 1.19 -0.22 4.57 2.04 -1.01 0.11 117.51 124.16 2x1e h ILE 58 Ca 0.01 -0.51 0.05 0.00 1.00 0.00 0.00 64.86 65.41 2x1e h ILE 58 Cb 0.05 0.56 -0.05 0.00 -0.74 0.00 0.00 36.82 36.64 2x1e h ILE 58 CO -0.03 0.21 -0.09 -0.08 0.00 0.00 0.00 178.15 178.16 2x1e h GLU 59 N 0.71 -0.05 0.04 2.37 4.81 -1.11 0.13 114.58 121.47 2x1e h GLU 59 Ca 0.18 0.00 -0.25 0.00 -0.13 0.00 0.00 59.36 59.17 2x1e h GLU 59 Cb 0.09 0.01 0.01 0.00 0.63 0.00 0.00 28.75 29.48 2x1e h GLU 59 CO -0.03 -0.03 -1.03 1.05 -0.73 0.00 0.00 179.01 178.23 2x1e h GLU 60 N -0.05 0.43 0.17 1.92 4.11 -1.26 -3.27 114.58 116.63 2x1e h GLU 60 Ca 0.11 -0.51 -0.34 0.00 0.07 0.00 0.00 59.36 58.69 2x1e h GLU 60 Cb 0.23 0.16 0.01 0.00 0.50 0.00 0.00 28.75 29.64 2x1e h GLU 60 CO -0.26 1.17 -1.71 0.00 0.07 0.00 0.00 179.01 178.29 2x1e h ARG 61 N 0.22 0.37 -2.27 1.06 3.08 -0.92 -3.41 114.38 112.51 2x1e h ARG 61 Ca -0.10 -0.63 -0.59 0.00 0.07 0.00 0.00 59.98 58.73 2x1e h ARG 61 Cb 1.69 0.23 -0.40 0.00 0.08 0.00 0.00 29.97 31.57 2x1e h ARG 61 CO 0.18 1.30 -0.87 0.91 -1.07 0.00 0.00 179.97 180.43 2x1e n TRP 62 N -3.65 1.13 0.04 3.04 8.01 0.03 -4.98 117.44 121.07 2x1e n TRP 62 Ca -0.25 -3.78 0.06 0.00 -1.31 0.00 0.00 57.50 52.22 2x1e n TRP 62 Cb 1.04 -0.32 0.49 0.00 -2.01 0.00 0.00 31.31 30.51 2x1e n TRP 62 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.69 175.33 2x1e h PRO 63 N 4.56 0.39 -0.23 -0.99 0.11 -1.66 -1.23 132.00 132.95 2x1e h PRO 63 Ca 0.16 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 66.27 2x1e h PRO 63 Cb 0.81 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 31.80 2x1e h PRO 63 CO 0.58 0.26 0.07 -0.22 -0.21 0.00 0.00 178.00 178.48 2x1e h LYS 64 N 0.41 0.16 -0.13 1.05 3.64 -1.91 -0.71 116.57 119.08 2x1e h LYS 64 Ca 0.14 -0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.38 2x1e h LYS 64 Cb 0.06 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 2x1e h LYS 64 CO -0.03 0.11 -0.49 1.88 -2.27 0.00 0.00 179.45 178.64 2x1e h TYR 65 N 0.16 0.43 -0.52 1.91 0.05 -1.62 -2.64 116.97 114.74 2x1e h TYR 65 Ca 0.10 -0.14 -0.08 0.00 0.05 0.00 0.00 58.73 58.66 2x1e h TYR 65 Cb 0.08 -0.09 -0.02 0.00 1.01 0.00 0.00 36.73 37.71 2x1e h TYR 65 CO -0.13 0.78 -0.00 -0.92 -1.05 0.00 0.00 178.16 176.83 2x1e h TYR 66 N 0.28 1.00 -0.62 4.88 3.20 -1.07 -0.67 116.97 123.97 2x1e h TYR 66 Ca 0.01 -0.17 0.05 0.00 3.14 0.00 0.00 58.73 61.76 2x1e h TYR 66 Cb 0.97 -0.26 -0.05 0.00 1.54 0.00 0.00 36.73 38.93 2x1e h TYR 66 CO 0.03 0.93 0.33 0.93 -1.64 0.00 0.00 178.16 178.73 2x1e h GLU 67 N 0.79 0.60 -0.70 1.82 4.39 -1.03 0.15 114.58 120.59 2x1e h GLU 67 Ca 0.15 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.78 2x1e h GLU 67 Cb 0.53 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 29.01 2x1e h GLU 67 CO 0.03 0.40 0.33 1.49 -1.16 0.00 0.00 179.01 180.10 2x1e h GLU 68 N 0.62 1.02 -0.55 2.33 4.81 -1.20 -0.70 114.58 120.91 2x1e h GLU 68 Ca 0.28 -0.15 -0.01 0.00 -0.13 0.00 0.00 59.36 59.34 2x1e h GLU 68 Cb 0.17 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 29.34 2x1e h GLU 68 CO -0.18 0.80 0.30 0.82 -0.73 0.00 0.00 179.01 180.03 2x1e h ILE 69 N 0.98 1.19 -0.72 2.32 2.04 -0.41 -0.09 117.51 122.82 2x1e h ILE 69 Ca 0.24 -0.48 0.06 0.00 1.00 0.00 0.00 64.86 65.69 2x1e h ILE 69 Cb 0.12 0.49 -0.06 0.00 -0.74 0.00 0.00 36.82 36.64 2x1e h ILE 69 CO -0.03 0.20 0.41 0.03 0.00 0.00 0.00 178.15 178.77 2x1e h ARG 70 N 0.74 0.73 -0.33 2.37 3.08 -0.42 -1.47 114.38 119.08 2x1e h ARG 70 Ca 0.19 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.20 2x1e h ARG 70 Cb 0.05 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 2x1e h ARG 70 CO -0.03 0.48 0.20 0.78 -1.07 0.00 0.00 179.97 180.33 2x1e h GLY 71 N 0.75 0.48 0.58 0.04 0.00 -0.55 -0.74 103.07 103.62 2x1e h GLY 71 Ca 0.33 -0.20 0.07 0.00 0.00 0.00 0.00 47.33 47.52 2x1e h GLY 71 CO -0.19 0.20 0.24 -2.22 0.00 0.00 0.00 176.54 174.56 2x1e h ILE 72 N 0.43 0.87 -0.10 2.60 2.04 -0.73 0.11 117.51 122.73 2x1e h ILE 72 Ca 0.12 -0.15 0.01 0.00 1.00 0.00 0.00 64.86 65.83 2x1e h ILE 72 Cb 0.01 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.47 2x1e h ILE 72 CO -0.02 0.08 0.05 0.00 0.00 0.00 0.00 178.15 178.26 2x1e h ALA 73 N 1.33 0.12 0.04 1.87 0.00 -0.97 0.14 119.26 121.79 2x1e h ALA 73 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2x1e h ALA 73 Cb 0.24 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2x1e h ALA 73 CO -0.22 -0.40 -0.04 -0.22 0.00 0.00 0.00 179.25 178.36 2x1e h LYS 74 N 0.11 -0.09 -0.88 0.00 1.63 -0.87 0.55 116.57 117.02 2x1e h LYS 74 Ca 0.04 0.01 0.01 0.00 -0.85 0.00 0.00 60.65 59.86 2x1e h LYS 74 Cb 0.01 0.02 -0.05 0.00 -0.60 0.00 0.00 32.23 31.61 2x1e h LYS 74 CO -0.03 -0.06 0.58 0.78 -3.45 0.00 0.00 179.45 177.27 2x1e h GLY 75 N -0.10 1.24 -0.44 5.01 0.00 -0.61 -2.58 103.07 105.60 2x1e h GLY 75 Ca 0.01 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 46.88 2x1e h GLY 75 CO -0.02 0.43 0.00 0.00 0.00 0.00 0.00 176.54 176.95 2x1e n ALA 76 N -2.34 2.57 -3.86 3.60 0.00 0.46 -3.20 120.51 117.73 2x1e n ALA 76 Ca 0.10 -0.44 -0.27 0.00 0.00 0.00 0.00 53.44 52.83 2x1e n ALA 76 Cb 0.03 -1.17 0.00 0.00 0.00 0.00 0.00 19.45 18.31 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 0.12 -2.87 -4.50 0.00 1.02 -0.32 -4.94 120.64 109.16 2x1e n GLU 77 Ca 0.19 0.43 -0.24 0.00 -0.02 0.00 0.00 57.16 57.52 2x1e n GLU 77 Cb 0.33 -4.44 -0.11 0.00 -0.02 0.00 0.00 31.44 27.20 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 -6.37 1.72 0.42 3.49 1.81 0.03 -5.04 118.95 115.01 2x1e s ARG 78 Ca 0.13 -1.93 -0.24 0.00 -1.72 0.00 0.00 55.73 51.97 2x1e s ARG 78 Cb -0.05 -1.22 -0.09 0.00 -0.45 0.00 0.00 34.95 33.15 2x1e s ARG 78 CO 0.88 -0.06 1.08 -0.51 -0.68 0.00 0.00 175.30 176.00 2x1e s ASP 79 N -3.54 6.58 0.26 0.23 1.01 -1.26 -4.45 116.67 115.48 2x1e s ASP 79 Ca 0.34 2.11 -0.03 0.00 0.71 0.00 0.00 52.55 55.68 2x1e s ASP 79 Cb 0.07 -2.59 0.42 0.00 1.01 0.00 0.00 42.92 41.84 2x1e s ASP 79 CO 0.15 -0.62 1.84 0.58 0.21 0.00 0.00 175.17 177.33 2x1e h VAL 80 N 2.08 0.98 -0.68 -1.27 2.07 -1.92 -1.94 116.25 115.57 2x1e h VAL 80 Ca -0.49 -0.33 0.08 0.00 0.82 0.00 0.00 66.70 66.78 2x1e h VAL 80 Cb 1.22 -0.07 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 2x1e h VAL 80 CO 0.62 0.18 0.45 0.77 0.02 0.00 0.00 177.57 179.60 2x1e h SER 81 N 0.97 0.54 -0.52 0.57 4.64 -1.97 -0.57 113.55 117.21 2x1e h SER 81 Ca 0.43 0.01 -0.07 0.00 -0.47 0.00 0.00 61.79 61.68 2x1e h SER 81 Cb 0.30 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 62.26 2x1e h SER 81 CO -0.22 0.33 0.07 -0.33 -0.87 0.00 0.00 176.83 175.82 2x1e h GLU 82 N 0.60 0.92 -0.07 4.77 5.08 -1.73 -0.35 114.58 123.80 2x1e h GLU 82 Ca 0.31 -0.23 -0.21 0.00 -1.00 0.00 0.00 59.36 58.22 2x1e h GLU 82 Cb 0.41 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.55 2x1e h GLU 82 CO -0.10 0.87 -0.82 0.82 -1.00 0.00 0.00 179.01 178.77 2x1e h ILE 83 N 0.87 1.35 -0.50 3.13 1.08 -1.26 -2.30 117.51 119.87 2x1e h ILE 83 Ca 0.17 -2.18 0.06 0.00 -0.39 0.00 0.00 64.86 62.53 2x1e h ILE 83 Cb 0.41 2.18 -0.05 0.00 -3.07 0.00 0.00 36.82 36.29 2x1e h ILE 83 CO 0.01 0.67 0.19 0.58 -0.69 0.00 0.00 178.15 178.91 2x1e h VAL 84 N 0.34 0.85 -0.24 1.67 2.07 -0.93 -1.97 116.25 118.05 2x1e h VAL 84 Ca -0.06 -0.13 0.04 0.00 0.82 0.00 0.00 66.70 67.37 2x1e h VAL 84 Cb 1.44 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 31.61 2x1e h VAL 84 CO 0.15 0.07 0.01 -0.03 0.02 0.00 0.00 177.57 177.79 2x1e h MET 85 N 0.38 0.09 -0.72 1.57 1.85 -0.92 -0.34 114.93 116.84 2x1e h MET 85 Ca 0.24 -0.01 0.11 0.00 -0.61 0.00 0.00 59.70 59.43 2x1e h MET 85 Cb 0.24 -0.02 -0.08 0.00 0.43 0.00 0.00 31.60 32.17 2x1e h MET 85 CO -0.23 0.06 0.34 -0.07 -0.40 0.00 0.00 176.91 176.61 2x1e h LEU 86 N 0.09 0.40 0.00 3.39 3.38 -1.16 -1.45 115.31 119.96 2x1e h LEU 86 Ca 0.11 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2x1e h LEU 86 Cb 0.14 0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2x1e h LEU 86 CO -0.18 0.21 0.00 0.59 0.09 0.00 0.00 178.44 179.15 2x1e n ASN 87 N -4.91 0.00 -0.62 -0.43 3.02 -0.69 -2.90 115.26 108.74 2x1e n ASN 87 Ca 0.12 0.29 0.06 0.00 -0.03 0.00 0.00 54.58 55.02 2x1e n ASN 87 Cb 0.31 -0.43 0.18 0.00 -0.61 0.00 0.00 39.78 39.23 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 -1.43 1.88 -0.25 3.41 -2.24 -0.22 -4.45 114.28 110.99 2x1e n THR 88 Ca 0.09 -2.80 -0.07 0.00 -2.27 0.00 0.00 64.05 58.99 2x1e n THR 88 Cb 0.30 -0.09 0.04 0.00 -2.10 0.00 0.00 70.33 68.48 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 0.84 1.09 -0.51 -0.78 2.43 -1.15 -2.58 114.38 113.71 2x1e h ARG 89 Ca -0.02 -0.25 0.02 0.00 -0.81 0.00 0.00 59.98 58.92 2x1e h ARG 89 Cb 1.10 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 30.47 2x1e h ARG 89 CO 0.01 0.96 0.31 1.15 -1.51 0.00 0.00 179.97 180.89 2x1e h THR 90 N 1.02 1.05 -0.79 0.20 2.02 -1.88 0.34 112.91 114.88 2x1e h THR 90 Ca 0.22 -0.21 0.05 0.00 0.77 0.00 0.00 66.41 67.24 2x1e h THR 90 Cb 0.35 0.39 -0.05 0.00 -1.74 0.00 0.00 68.15 67.10 2x1e h THR 90 CO -0.00 0.11 0.52 -0.33 0.37 0.00 0.00 175.52 176.19 2x1e h GLU 91 N 0.61 0.88 0.23 6.66 3.07 -1.85 0.18 114.58 124.36 2x1e h GLU 91 Ca 0.21 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 59.00 2x1e h GLU 91 Cb 0.02 -0.20 0.00 0.00 -0.84 0.00 0.00 28.75 27.74 2x1e h GLU 91 CO -0.09 0.58 -0.11 0.74 -1.40 0.00 0.00 179.01 178.72 2x1e h PHE 92 N 0.90 -0.29 -0.49 4.33 0.04 -1.10 -2.34 116.94 117.99 2x1e h PHE 92 Ca 0.33 -0.01 -0.05 0.00 2.80 0.00 0.00 57.97 61.05 2x1e h PHE 92 Cb 0.17 0.10 -0.02 0.00 2.20 0.00 0.00 35.95 38.39 2x1e h PHE 92 CO -0.00 -0.09 0.10 0.00 -0.60 0.00 0.00 178.31 177.73 2x1e h ALA 93 N -0.92 1.26 0.00 2.45 0.00 -0.19 -2.78 119.26 119.08 2x1e h ALA 93 Ca -0.03 -0.20 -0.25 0.00 0.00 0.00 0.00 54.91 54.42 2x1e h ALA 93 Cb 0.33 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 2x1e h ALA 93 CO 0.05 0.51 -1.90 0.66 0.00 0.00 0.00 179.25 178.57 2x1e n TYR 94 N -4.28 0.00 -0.07 0.00 4.02 0.58 -4.26 117.16 113.16 2x1e n TYR 94 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.93 2x1e n TYR 94 Cb 0.23 -0.59 0.29 0.00 -0.02 0.00 0.00 39.34 39.24 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 0.35 0.73 -1.92 2.72 0.00 -0.98 -2.84 103.07 101.13 2x1e h GLY 95 Ca -0.38 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 46.59 2x1e h GLY 95 CO -0.15 0.34 0.00 1.04 0.00 0.00 0.00 176.54 177.78 2x1e n LEU 96 N -4.35 3.88 0.00 3.11 4.77 -1.05 -3.60 117.00 119.76 2x1e n LEU 96 Ca 0.04 -2.57 0.00 0.00 -0.03 0.00 0.00 56.01 53.45 2x1e n LEU 96 Cb 0.16 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.79 2x1e n LEU 96 CO 0.38 0.72 0.00 1.17 -1.33 0.00 0.00 177.39 178.33 2x1e n LYS 97 N 0.23 0.00 -4.96 3.23 4.81 -1.07 -4.62 118.16 115.77 2x1e n LYS 97 Ca 0.20 0.00 -0.32 0.00 -0.87 0.00 0.00 58.31 57.31 2x1e n LYS 97 Cb 0.76 0.00 -0.15 0.00 0.02 0.00 0.00 35.03 35.66 2x1e n LYS 97 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 2x1e s THR 104 N 0.00 2.69 -0.01 3.15 2.01 -1.07 -5.01 115.64 117.40 2x1e s THR 104 Ca 0.00 -0.81 0.01 0.00 0.31 0.00 0.00 61.69 61.20 2x1e s THR 104 Cb 0.00 -2.08 0.00 0.00 0.01 0.00 0.00 72.50 70.43 2x1e s THR 104 CO 0.00 0.55 -0.03 -0.89 -0.69 0.00 0.00 174.62 173.56 2x1e s THR 105 N 0.12 0.27 -0.04 -0.82 2.01 -0.04 -0.92 115.64 116.22 2x1e s THR 105 Ca -0.09 -0.12 -0.09 0.00 0.31 0.00 0.00 61.69 61.70 2x1e s THR 105 Cb -0.15 -0.24 0.01 0.00 0.01 0.00 0.00 72.50 72.13 2x1e s THR 105 CO 0.05 0.09 0.21 0.00 -0.69 0.00 0.00 174.62 174.28 2x1e s ALA 106 N 0.07 -0.52 -0.04 7.40 0.00 -0.34 -0.82 121.76 127.50 2x1e s ALA 106 Ca -0.00 0.29 0.03 0.00 0.00 0.00 0.00 51.96 52.27 2x1e s ALA 106 Cb -0.03 -0.10 0.01 0.00 0.00 0.00 0.00 23.12 22.99 2x1e s ALA 106 CO -0.00 -0.18 -0.12 -0.47 0.00 0.00 0.00 175.76 174.99 2x1e s TYR 107 N -0.73 1.31 -0.10 0.00 6.14 0.32 -1.37 117.35 122.92 2x1e s TYR 107 Ca -0.08 -0.39 -0.01 0.00 0.64 0.00 0.00 57.07 57.23 2x1e s TYR 107 Cb -0.05 -0.93 0.03 0.00 0.42 0.00 0.00 41.96 41.43 2x1e s TYR 107 CO 0.02 -0.17 -0.05 0.00 0.64 0.00 0.00 175.55 175.98 2x1e s GLN 109 N 1.78 4.71 0.03 0.00 2.00 -0.41 -1.16 119.66 126.61 2x1e s GLN 109 Ca 0.05 1.70 -0.11 0.00 -2.00 0.00 0.00 55.36 55.00 2x1e s GLN 109 Cb -0.12 -3.22 0.01 0.00 0.80 0.00 0.00 33.01 30.47 2x1e s GLN 109 CO -0.07 0.31 0.23 -0.51 -0.50 0.00 0.00 175.29 174.75 2x1e s LEU 110 N -1.33 1.20 0.46 3.68 1.43 -1.26 -4.93 118.68 117.93 2x1e s LEU 110 Ca 0.43 -0.25 0.22 0.00 -1.03 0.00 0.00 54.13 53.51 2x1e s LEU 110 Cb -0.30 1.07 1.10 0.00 0.03 0.00 0.00 46.19 48.09 2x1e s LEU 110 CO 0.38 -0.54 1.94 1.55 0.23 0.00 0.00 176.35 179.91 2x1e h PRO 111 N 3.53 0.00 -0.00 1.29 0.13 -1.97 -1.74 132.00 133.24 2x1e h PRO 111 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 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 0.46 0.22 -0.03 0.09 -0.23 0.00 0.00 178.00 178.52 2x1e n ASN 112 N -3.72 0.05 0.00 1.44 3.02 -1.26 -5.00 115.26 109.79 2x1e n ASN 112 Ca -0.01 0.14 0.00 0.00 -0.03 0.00 0.00 54.58 54.68 2x1e n ASN 112 Cb 0.34 -0.36 0.00 0.00 -0.61 0.00 0.00 39.78 39.15 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 1.40 3.54 3.76 7.41 0.00 -0.65 -4.66 105.19 115.98 2x1e n GLY 113 Ca 0.10 -1.58 -0.36 0.00 0.00 0.00 0.00 46.02 44.19 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 -1.30 2.56 0.01 4.61 0.00 -1.26 -4.16 121.76 122.23 2x1e s ALA 114 Ca 0.00 0.99 0.08 0.00 0.00 0.00 0.00 51.96 53.03 2x1e s ALA 114 Cb 0.00 -3.44 -0.02 0.00 0.00 0.00 0.00 23.12 19.65 2x1e s ALA 114 CO 0.00 -1.12 -0.25 -0.51 0.00 0.00 0.00 175.76 173.89 2x1e s LEU 115 N -4.03 2.10 -0.02 0.00 1.43 -0.31 -2.53 118.68 115.32 2x1e s LEU 115 Ca 0.77 -0.50 -0.07 0.00 -1.03 0.00 0.00 54.13 53.29 2x1e s LEU 115 Cb -0.30 -1.24 0.01 0.00 0.03 0.00 0.00 46.19 44.69 2x1e s LEU 115 CO 0.32 0.27 0.16 -1.58 0.23 0.00 0.00 176.35 175.75 2x1e s GLN 116 N -0.88 0.42 0.02 1.70 0.74 -1.07 -0.52 119.66 120.07 2x1e s GLN 116 Ca 0.10 -0.21 -0.28 0.00 0.05 0.00 0.00 55.36 55.02 2x1e s GLN 116 Cb -0.10 0.18 0.10 0.00 1.10 0.00 0.00 33.01 34.29 2x1e s GLN 116 CO 0.00 -0.09 1.24 0.20 -0.55 0.00 0.00 175.29 176.09 2x1e s GLY 117 N -0.97 -0.16 0.03 2.59 0.00 -0.47 0.73 107.32 109.07 2x1e s GLY 117 Ca -0.11 0.14 -0.25 0.00 0.00 0.00 0.00 44.72 44.50 2x1e s GLY 117 CO 0.01 3.71 0.58 -0.86 0.00 0.00 0.00 173.10 176.54 2x1e s GLN 118 N -2.16 1.07 -0.05 2.90 -2.07 -0.71 -1.20 119.66 117.44 2x1e s GLN 118 Ca 0.24 -0.09 -0.14 0.00 -1.82 0.00 0.00 55.36 53.55 2x1e s GLN 118 Cb 0.00 0.50 -0.05 0.00 -1.09 0.00 0.00 33.01 32.37 2x1e s GLN 118 CO -0.01 -0.38 0.36 -0.80 -1.32 0.00 0.00 175.29 173.15 2x1e s ASN 119 N -1.79 6.69 -0.25 12.60 0.01 -0.10 -1.75 114.94 130.35 2x1e s ASN 119 Ca -0.07 0.82 -0.08 0.00 -0.71 0.00 0.00 52.86 52.83 2x1e s ASN 119 Cb -0.01 -2.22 -0.03 0.00 0.41 0.00 0.00 41.25 39.40 2x1e s ASN 119 CO 0.01 0.27 0.08 0.86 -1.51 0.00 0.00 177.10 176.81 2x1e s TRP 120 N -0.67 3.10 -0.15 2.20 -0.00 0.13 -2.61 118.94 120.95 2x1e s TRP 120 Ca 0.22 -0.35 -0.01 0.00 -0.00 0.00 0.00 56.10 55.96 2x1e s TRP 120 Cb -0.15 -2.25 -0.01 0.00 -0.00 0.00 0.00 33.47 31.06 2x1e s TRP 120 CO 0.10 -0.32 -0.12 -0.51 -0.00 0.00 0.00 176.95 176.11 2x1e s ASP 121 N 1.59 4.05 0.19 5.86 1.01 -1.26 -0.39 116.67 127.71 2x1e s ASP 121 Ca 0.06 -0.34 -0.20 0.00 0.71 0.00 0.00 52.55 52.78 2x1e s ASP 121 Cb -0.15 -1.63 0.07 0.00 1.01 0.00 0.00 42.92 42.22 2x1e s ASP 121 CO 0.04 0.13 0.94 0.33 0.21 0.00 0.00 175.17 176.83 2x1e n PHE 122 N 3.77 -1.40 -1.80 4.23 7.35 -0.87 -4.91 117.46 123.83 2x1e n PHE 122 Ca -0.18 -1.24 -0.42 0.00 -0.76 0.00 0.00 57.45 54.85 2x1e n PHE 122 Cb 0.52 0.60 -0.03 0.00 0.35 0.00 0.00 39.48 40.93 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 -2.39 2.47 0.49 -5.13 0.08 -1.26 -2.22 117.98 110.01 2x1e s PHE 123 Ca 0.21 0.22 0.26 0.00 0.12 0.00 0.00 56.93 57.74 2x1e s PHE 123 Cb -0.03 -4.08 1.32 0.00 -0.57 0.00 0.00 43.02 39.66 2x1e s PHE 123 CO 0.06 -4.31 1.86 0.77 -0.10 0.00 0.00 175.22 173.49 2x1e h SER 124 N 7.99 0.18 -0.38 1.36 0.02 -1.91 -0.89 113.55 119.92 2x1e h SER 124 Ca -0.44 0.02 0.11 0.00 -0.84 0.00 0.00 61.79 60.64 2x1e h SER 124 Cb 1.21 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.73 2x1e h SER 124 CO 0.94 0.06 0.31 0.00 -1.14 0.00 0.00 176.83 177.00 2x1e h ALA 125 N 1.57 2.22 -0.00 3.77 0.00 -1.98 -2.17 119.26 122.66 2x1e h ALA 125 Ca 0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.37 2x1e h ALA 125 Cb 1.57 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.39 2x1e h ALA 125 CO -0.09 -0.51 -0.16 0.25 0.00 0.00 0.00 179.25 178.74 2x1e n THR 126 N -4.14 0.00 -0.26 0.00 -2.24 -0.34 -3.98 114.28 103.33 2x1e n THR 126 Ca 0.06 -0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.77 2x1e n THR 126 Cb 0.49 -0.26 0.05 0.00 -2.10 0.00 0.00 70.33 68.51 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 0.01 1.09 0.00 -0.78 3.64 -1.55 -1.56 116.57 117.42 2x1e h LYS 127 Ca 0.00 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.15 2x1e h LYS 127 Cb 0.49 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 2x1e h LYS 127 CO 0.00 0.93 0.00 -0.85 -2.27 0.00 0.00 179.45 177.26 2x1e n GLU 128 N -4.31 0.03 0.00 1.90 0.28 -1.26 -2.46 120.64 114.82 2x1e n GLU 128 Ca 0.05 0.23 0.12 0.00 -0.16 0.00 0.00 57.16 57.40 2x1e n GLU 128 Cb 0.22 -1.50 0.11 0.00 1.43 0.00 0.00 31.44 31.70 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 -1.48 2.21 -4.70 -1.84 3.02 -0.60 -4.92 115.26 106.95 2x1e n ASN 129 Ca 0.04 -1.61 -0.42 0.00 -0.03 0.00 0.00 54.58 52.56 2x1e n ASN 129 Cb 0.17 0.25 -0.03 0.00 -0.61 0.00 0.00 39.78 39.56 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 -2.28 4.33 0.31 3.41 1.43 -1.03 -0.88 118.68 123.97 2x1e s LEU 130 Ca 0.24 1.95 0.03 0.00 -1.03 0.00 0.00 54.13 55.31 2x1e s LEU 130 Cb 0.19 -3.57 -0.06 0.00 0.03 0.00 0.00 46.19 42.78 2x1e s LEU 130 CO 0.46 -0.54 0.07 0.27 0.23 0.00 0.00 176.35 176.84 2x1e s ILE 131 N 1.67 0.96 -0.02 -0.59 -4.36 -0.39 -4.63 121.20 113.85 2x1e s ILE 131 Ca 0.58 -2.00 0.06 0.00 -0.26 0.00 0.00 60.65 59.03 2x1e s ILE 131 Cb -0.28 -2.72 -0.02 0.00 1.25 0.00 0.00 42.46 40.69 2x1e s ILE 131 CO 0.26 0.00 -0.21 0.00 0.24 0.00 0.00 174.94 175.23 2x1e s ARG 132 N -3.92 1.67 -0.04 0.37 1.70 0.76 -1.74 118.95 117.75 2x1e s ARG 132 Ca 0.36 -0.74 0.07 0.00 -0.47 0.00 0.00 55.73 54.95 2x1e s ARG 132 Cb 0.08 -1.61 -0.02 0.00 -0.57 0.00 0.00 34.95 32.83 2x1e s ARG 132 CO 0.15 0.44 -0.24 -0.51 -1.08 0.00 0.00 175.30 174.06 2x1e s LEU 133 N -0.48 2.16 -0.22 -1.89 1.43 -0.21 -1.38 118.68 118.08 2x1e s LEU 133 Ca 0.08 -0.44 -0.05 0.00 -1.03 0.00 0.00 54.13 52.69 2x1e s LEU 133 Cb -0.08 -1.38 -0.02 0.00 0.03 0.00 0.00 46.19 44.74 2x1e s LEU 133 CO -0.01 0.30 -0.00 -0.89 0.23 0.00 0.00 176.35 175.98 2x1e s THR 134 N -0.49 3.77 -0.21 5.49 2.01 -0.68 -1.55 115.64 123.99 2x1e s THR 134 Ca 0.06 -0.36 -0.03 0.00 0.31 0.00 0.00 61.69 61.67 2x1e s THR 134 Cb -0.11 -2.73 -0.01 0.00 0.01 0.00 0.00 72.50 69.66 2x1e s THR 134 CO 0.01 0.40 -0.06 -0.63 -0.69 0.00 0.00 174.62 173.65 2x1e s ILE 135 N 1.40 3.27 -0.23 1.82 1.01 0.65 0.31 121.20 129.42 2x1e s ILE 135 Ca 0.05 -0.53 -0.06 0.00 0.00 0.00 0.00 60.65 60.11 2x1e s ILE 135 Cb -0.15 -2.47 -0.02 0.00 0.01 0.00 0.00 42.46 39.83 2x1e s ILE 135 CO 0.00 0.44 0.02 -0.13 0.00 0.00 0.00 174.94 175.27 2x1e s ARG 136 N 1.35 3.57 -0.09 2.79 0.52 0.81 -1.26 118.95 126.62 2x1e s ARG 136 Ca 0.04 -0.53 -0.01 0.00 -0.52 0.00 0.00 55.73 54.71 2x1e s ARG 136 Cb -0.14 -3.18 0.03 0.00 0.52 0.00 0.00 34.95 32.17 2x1e s ARG 136 CO -0.03 -0.15 -0.04 -0.65 0.02 0.00 0.00 175.30 174.45 2x1e s GLN 137 N 1.44 1.08 -0.02 3.54 -0.21 -1.26 -3.01 119.66 121.22 2x1e s GLN 137 Ca 0.05 -0.08 -0.37 0.00 0.02 0.00 0.00 55.36 54.99 2x1e s GLN 137 Cb -0.15 -1.28 -0.15 0.00 1.00 0.00 0.00 33.01 32.43 2x1e s GLN 137 CO 0.01 -0.28 1.58 0.00 -2.12 0.00 0.00 175.29 174.48 2x1e n ALA 138 N 5.04 0.05 -0.67 6.09 0.00 -1.26 -1.32 120.51 128.44 2x1e n ALA 138 Ca -0.10 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.77 2x1e n ALA 138 Cb 0.50 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.70 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 3.45 1.10 3.47 0.00 0.00 -0.43 -4.89 105.19 107.89 2x1e n GLY 139 Ca 0.21 0.00 -0.27 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 2.61 0.35 0.99 1.43 -0.43 -4.88 118.68 118.76 2x1e s LEU 140 Ca 0.00 -0.79 -0.27 0.00 -1.03 0.00 0.00 54.13 52.04 2x1e s LEU 140 Cb 0.00 -1.32 -0.12 0.00 0.03 0.00 0.00 46.19 44.78 2x1e s LEU 140 CO 0.00 0.11 1.25 -2.65 0.23 0.00 0.00 176.35 175.29 2x1e n PRO 141 N 0.14 1.98 -2.39 1.29 -0.02 -1.26 -3.82 135.00 130.92 2x1e n PRO 141 Ca -0.12 0.70 -0.41 0.00 -2.02 0.00 0.00 63.50 61.65 2x1e n PRO 141 Cb 0.56 -2.28 -0.04 0.00 -0.02 0.00 0.00 33.50 31.73 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 -1.12 3.50 -0.10 3.45 2.01 -1.26 -4.72 115.64 117.39 2x1e s THR 142 Ca 0.57 1.34 0.01 0.00 0.31 0.00 0.00 61.69 63.92 2x1e s THR 142 Cb -0.57 -3.86 -0.02 0.00 0.01 0.00 0.00 72.50 68.06 2x1e s THR 142 CO 0.61 0.26 -0.12 -0.63 -0.69 0.00 0.00 174.62 174.05 2x1e s ILE 143 N -0.47 3.19 -0.18 1.82 1.01 -0.39 -1.11 121.20 125.06 2x1e s ILE 143 Ca 0.50 -0.64 0.01 0.00 0.00 0.00 0.00 60.65 60.52 2x1e s ILE 143 Cb -0.33 -2.32 0.03 0.00 0.01 0.00 0.00 42.46 39.86 2x1e s ILE 143 CO 0.39 0.55 -0.15 -0.54 0.00 0.00 0.00 174.94 175.19 2x1e s LYS 144 N -0.08 2.49 0.04 2.79 1.02 -0.09 -0.25 119.74 125.66 2x1e s LYS 144 Ca -0.02 -0.81 -0.16 0.00 0.02 0.00 0.00 55.97 55.00 2x1e s LYS 144 Cb -0.14 -2.44 0.03 0.00 -0.52 0.00 0.00 37.83 34.76 2x1e s LYS 144 CO 0.04 -0.31 0.36 -0.59 -0.92 0.00 0.00 175.35 173.93 2x1e s PHE 145 N 1.35 -0.19 -0.21 3.18 -0.71 -0.59 -0.91 117.98 119.90 2x1e s PHE 145 Ca 0.02 0.13 -0.12 0.00 -1.04 0.00 0.00 56.93 55.92 2x1e s PHE 145 Cb -0.14 0.16 -0.05 0.00 -1.21 0.00 0.00 43.02 41.78 2x1e s PHE 145 CO -0.10 -0.53 0.23 0.42 -1.34 0.00 0.00 175.22 173.90 2x1e s ILE 146 N -2.40 5.32 0.15 -4.49 -1.09 0.31 -1.04 121.20 117.96 2x1e s ILE 146 Ca -0.06 0.37 -0.01 0.00 -2.23 0.00 0.00 60.65 58.73 2x1e s ILE 146 Cb -0.01 -3.57 -0.04 0.00 -1.58 0.00 0.00 42.46 37.26 2x1e s ILE 146 CO -0.02 0.35 0.06 0.28 -1.23 0.00 0.00 174.94 174.39 2x1e s THR 147 N 0.85 0.17 0.08 2.92 -1.32 -0.71 -2.67 115.64 114.96 2x1e s THR 147 Ca 0.12 -1.94 -0.28 0.00 -1.21 0.00 0.00 61.69 58.38 2x1e s THR 147 Cb -0.13 -2.16 -0.06 0.00 -1.51 0.00 0.00 72.50 68.65 2x1e s THR 147 CO 0.04 -0.37 0.90 -1.61 -2.21 0.00 0.00 174.62 171.37 2x1e s GLU 148 N -4.05 4.62 0.07 7.08 2.02 -1.26 -1.26 118.70 125.92 2x1e s GLU 148 Ca 0.27 1.32 -0.36 0.00 0.02 0.00 0.00 54.97 56.22 2x1e s GLU 148 Cb 0.07 -3.38 -0.16 0.00 0.10 0.00 0.00 34.13 30.77 2x1e s GLU 148 CO 0.04 0.22 1.45 0.00 0.02 0.00 0.00 175.26 177.00 2x1e n ALA 149 N 2.86 -0.25 0.00 5.21 0.00 -0.05 -1.74 120.51 126.54 2x1e n ALA 149 Ca 0.01 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.93 2x1e n ALA 149 Cb 0.50 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 17.77 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 2.95 1.38 3.65 0.00 0.00 -1.26 -4.60 105.19 107.31 2x1e n GLY 150 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.29 4.92 -1.76 -0.61 1.01 -0.71 -4.72 121.20 117.03 2x1e s ILE 151 Ca 0.00 0.01 0.27 0.00 0.00 0.00 0.00 60.65 60.93 2x1e s ILE 151 Cb 0.00 -3.22 0.31 0.00 0.01 0.00 0.00 42.46 39.55 2x1e s ILE 151 CO 0.00 0.46 1.62 2.30 0.00 0.00 0.00 174.94 179.31 2x1e n ILE 152 N 3.52 0.00 -3.74 2.92 -5.35 -1.26 -4.75 119.36 110.71 2x1e n ILE 152 Ca -0.16 -0.12 -0.12 0.00 -0.27 0.00 0.00 62.75 62.07 2x1e n ILE 152 Cb 0.52 0.33 -0.13 0.00 -1.74 0.00 0.00 39.64 38.62 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 -2.48 -0.16 0.00 3.28 0.00 -1.25 -4.70 107.32 102.01 2x1e s GLY 153 Ca 0.25 0.98 0.00 0.00 0.00 0.00 0.00 44.72 45.96 2x1e s GLY 153 CO 0.51 1.16 0.00 1.17 0.00 0.00 0.00 173.10 175.94 2x1e n LYS 154 N 3.99 0.00 -4.18 2.90 3.00 -1.26 -4.76 118.16 117.85 2x1e n LYS 154 Ca -0.23 0.00 -0.34 0.00 -0.00 0.00 0.00 58.31 57.74 2x1e n LYS 154 Cb 0.54 0.00 -0.14 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 2.12 3.06 -1.66 3.15 1.01 -1.09 -4.84 120.40 122.15 2x1e s VAL 155 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 61.98 61.36 2x1e s VAL 155 Cb 0.00 -2.35 0.00 0.00 0.00 0.00 0.00 36.38 34.03 2x1e s VAL 155 CO 0.00 0.47 0.00 0.61 0.00 0.00 0.00 175.10 176.18 2x1e n GLY 156 N 4.41 -0.56 3.34 4.51 0.00 -1.15 -0.53 105.19 115.20 2x1e n GLY 156 Ca -0.19 -0.77 -0.16 0.00 0.00 0.00 0.00 46.02 44.90 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 1.36 0.31 1.61 -0.71 -0.09 -0.55 117.98 116.92 2x1e s PHE 157 Ca 0.00 -1.45 0.03 0.00 -1.04 0.00 0.00 56.93 54.47 2x1e s PHE 157 Cb 0.00 -0.46 -0.04 0.00 -1.21 0.00 0.00 43.02 41.31 2x1e s PHE 157 CO 0.00 -0.90 0.12 0.54 -1.34 0.00 0.00 175.22 173.64 2x1e s ASN 158 N -3.27 1.81 0.29 1.98 2.20 -0.50 -0.91 114.94 116.53 2x1e s ASN 158 Ca 0.37 -1.49 0.24 0.00 -0.94 0.00 0.00 52.86 51.03 2x1e s ASN 158 Cb 0.02 0.25 1.06 0.00 -2.00 0.00 0.00 41.25 40.58 2x1e s ASN 158 CO 0.21 -0.80 1.72 -1.54 -2.94 0.00 0.00 177.10 173.75 2x1e n SER 159 N -0.81 0.68 -0.10 3.54 3.41 -0.27 -0.62 113.62 119.44 2x1e n SER 159 Ca -0.01 0.70 0.14 0.00 -0.26 0.00 0.00 58.87 59.44 2x1e n SER 159 Cb 0.66 -0.83 0.68 0.00 -0.26 0.00 0.00 64.21 64.45 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 -1.79 2.69 -0.64 7.33 0.00 -1.26 -4.92 120.51 121.92 2x1e n ALA 160 Ca 0.01 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.21 2x1e n ALA 160 Cb 0.18 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.26 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 1.24 0.72 3.69 0.00 0.00 0.20 -4.86 105.19 106.18 2x1e n GLY 161 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.38 4.63 -0.04 1.61 1.01 -1.25 -4.30 120.40 119.68 2x1e s VAL 162 Ca 0.00 1.92 0.07 0.00 0.00 0.00 0.00 61.98 63.96 2x1e s VAL 162 Cb 0.00 -4.23 -0.02 0.00 0.00 0.00 0.00 36.38 32.13 2x1e s VAL 162 CO 0.00 -0.00 -0.25 0.00 0.00 0.00 0.00 175.10 174.85 2x1e s ALA 163 N 2.10 2.20 -0.06 5.51 0.00 0.65 -1.41 121.76 130.74 2x1e s ALA 163 Ca 0.50 -1.08 0.04 0.00 0.00 0.00 0.00 51.96 51.43 2x1e s ALA 163 Cb -0.20 -0.64 -0.00 0.00 0.00 0.00 0.00 23.12 22.28 2x1e s ALA 163 CO 0.19 0.47 -0.20 0.08 0.00 0.00 0.00 175.76 176.30 2x1e s VAL 164 N -0.39 1.70 0.20 0.00 1.01 0.29 -1.06 120.40 122.15 2x1e s VAL 164 Ca 0.03 -0.85 0.10 0.00 0.00 0.00 0.00 61.98 61.26 2x1e s VAL 164 Cb -0.12 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.75 2x1e s VAL 164 CO 0.01 0.48 -0.19 0.20 0.00 0.00 0.00 175.10 175.60 2x1e s ASN 165 N 0.16 2.99 -0.03 3.32 -0.87 -0.02 -2.94 114.94 117.54 2x1e s ASN 165 Ca -0.09 -0.91 -0.00 0.00 -1.57 0.00 0.00 52.86 50.28 2x1e s ASN 165 Cb -0.14 -0.20 0.03 0.00 -0.02 0.00 0.00 41.25 40.91 2x1e s ASN 165 CO 0.04 -0.01 0.02 -0.47 -2.57 0.00 0.00 177.10 174.12 2x1e s TYR 166 N -2.17 0.15 -0.03 2.20 5.04 -1.26 -1.24 117.35 120.04 2x1e s TYR 166 Ca 0.20 0.09 0.04 0.00 -2.44 0.00 0.00 57.07 54.97 2x1e s TYR 166 Cb -0.05 -0.35 -0.01 0.00 0.35 0.00 0.00 41.96 41.90 2x1e s TYR 166 CO 0.09 -0.13 -0.17 -0.80 -1.34 0.00 0.00 175.55 173.21 2x1e s ASN 167 N 1.24 2.06 0.35 4.32 -0.87 -0.12 -4.99 114.94 116.93 2x1e s ASN 167 Ca -0.07 -0.33 -0.28 0.00 -1.57 0.00 0.00 52.86 50.61 2x1e s ASN 167 Cb -0.13 -0.49 -0.12 0.00 -0.02 0.00 0.00 41.25 40.49 2x1e s ASN 167 CO -0.03 0.16 1.45 0.00 -2.57 0.00 0.00 177.10 176.11 2x1e n ALA 168 N 3.04 2.07 -3.01 0.60 0.00 -1.26 -0.60 120.51 121.36 2x1e n ALA 168 Ca -0.17 0.35 -0.10 0.00 0.00 0.00 0.00 53.44 53.52 2x1e n ALA 168 Cb 0.53 -2.38 -0.11 0.00 0.00 0.00 0.00 19.45 17.49 2x1e n ALA 168 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2x1e s LEU 169 N -1.48 2.01 -0.29 0.00 2.96 -1.26 -4.46 118.68 116.16 2x1e s LEU 169 Ca 0.56 -0.35 0.08 0.00 -0.22 0.00 0.00 54.13 54.20 2x1e s LEU 169 Cb -0.51 0.26 0.46 0.00 0.50 0.00 0.00 46.19 46.90 2x1e s LEU 169 CO 0.61 -0.29 1.33 1.41 -1.32 0.00 0.00 176.35 178.10 2x1e n HIS 170 N 1.73 1.34 -2.55 5.38 8.25 -1.26 -4.25 115.22 123.87 2x1e n HIS 170 Ca -0.22 -1.84 -0.34 0.00 -0.26 0.00 0.00 57.72 55.05 2x1e n HIS 170 Cb 0.56 -0.42 -0.03 0.00 1.12 0.00 0.00 29.99 31.21 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 -3.39 3.86 0.15 2.41 1.43 -1.26 0.11 118.68 121.99 2x1e s LEU 171 Ca 0.45 1.93 -0.21 0.00 -1.03 0.00 0.00 54.13 55.28 2x1e s LEU 171 Cb 0.40 -4.54 -0.08 0.00 0.03 0.00 0.00 46.19 42.00 2x1e s LEU 171 CO -0.01 -0.77 0.68 -1.58 0.23 0.00 0.00 176.35 174.90 2x1e s GLN 172 N -3.20 4.33 0.00 1.70 0.74 -0.36 -4.59 119.66 118.28 2x1e s GLN 172 Ca 0.67 0.90 0.00 0.00 0.05 0.00 0.00 55.36 56.98 2x1e s GLN 172 Cb -0.17 -3.13 0.00 0.00 1.10 0.00 0.00 33.01 30.82 2x1e s GLN 172 CO 0.20 0.54 0.00 0.41 -0.55 0.00 0.00 175.29 175.89 2x1e n GLY 173 N 1.34 4.50 3.05 2.59 0.00 -1.26 -4.70 105.19 110.70 2x1e n GLY 173 Ca -0.06 -1.22 -0.24 0.00 0.00 0.00 0.00 46.02 44.50 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 1.76 -0.34 0.99 2.96 -1.24 -4.51 118.68 118.31 2x1e s LEU 174 Ca 0.00 -0.28 0.01 0.00 -0.22 0.00 0.00 54.13 53.64 2x1e s LEU 174 Cb 0.00 -0.79 0.10 0.00 0.50 0.00 0.00 46.19 46.01 2x1e s LEU 174 CO 0.00 0.08 0.10 -0.60 -1.32 0.00 0.00 176.35 174.61 2x1e s ARG 175 N 0.35 1.00 0.65 1.98 3.52 0.12 -5.02 118.95 121.55 2x1e s ARG 175 Ca -0.08 -1.42 0.41 0.00 -0.13 0.00 0.00 55.73 54.51 2x1e s ARG 175 Cb -0.13 -2.37 2.27 0.00 -1.56 0.00 0.00 34.95 33.17 2x1e s ARG 175 CO 0.02 -1.00 2.34 -1.35 -0.81 0.00 0.00 175.30 174.51 2x1e h PRO 176 N 7.79 0.00 -0.01 5.12 0.11 -1.95 -0.92 132.00 142.14 2x1e h PRO 176 Ca -0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.01 2x1e h PRO 176 Cb 1.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.11 2x1e h PRO 176 CO 0.49 0.00 -0.23 0.25 -0.21 0.00 0.00 178.00 178.30 2x1e n THR 177 N -3.28 0.00 -1.94 -1.15 -2.24 -1.26 -4.68 114.28 99.72 2x1e n THR 177 Ca -0.03 -0.10 -0.23 0.00 -2.27 0.00 0.00 64.05 61.42 2x1e n THR 177 Cb 0.08 0.23 0.15 0.00 -2.10 0.00 0.00 70.33 68.69 2x1e n THR 177 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2x1e n GLY 178 N 1.34 -0.96 3.68 3.38 0.00 -0.35 -5.00 105.19 107.28 2x1e n GLY 178 Ca 0.12 -1.77 -0.41 0.00 0.00 0.00 0.00 46.02 43.96 2x1e n GLY 178 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x1e s VAL 179 N -3.21 4.93 0.52 1.61 0.11 -0.52 -4.36 120.40 119.48 2x1e s VAL 179 Ca 0.61 1.57 -0.22 0.00 -2.93 0.00 0.00 61.98 61.01 2x1e s VAL 179 Cb -0.02 -4.11 -0.06 0.00 -1.53 0.00 0.00 36.38 30.67 2x1e s VAL 179 CO 0.42 0.09 1.33 -2.84 -3.33 0.00 0.00 175.10 170.77 2x1e s PRO 180 N 1.77 3.30 0.22 1.54 0.02 -1.26 -0.78 135.00 139.81 2x1e s PRO 180 Ca 0.38 2.18 -0.08 0.00 0.02 0.00 0.00 61.00 63.50 2x1e s PRO 180 Cb -0.17 -2.33 0.28 0.00 0.02 0.00 0.00 34.50 32.31 2x1e s PRO 180 CO 0.14 -1.04 1.81 0.77 -0.33 0.00 0.00 177.00 178.36 2x1e h SER 181 N 1.65 0.61 0.62 2.53 0.02 -1.95 -0.68 113.55 116.36 2x1e h SER 181 Ca -0.51 0.03 -0.08 0.00 -0.84 0.00 0.00 61.79 60.40 2x1e h SER 181 Cb 1.29 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.73 2x1e h SER 181 CO 0.58 0.39 -0.37 0.45 -1.14 0.00 0.00 176.83 176.73 2x1e h HIS 182 N 0.75 0.00 -0.22 3.45 3.86 -1.87 -1.33 115.15 119.79 2x1e h HIS 182 Ca 0.33 0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 59.37 2x1e h HIS 182 Cb 0.22 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.69 2x1e h HIS 182 CO -0.07 0.37 -0.51 0.82 0.86 0.00 0.00 177.93 179.40 2x1e h ILE 183 N 0.00 1.30 -0.93 2.45 1.08 -1.59 -2.40 117.51 117.42 2x1e h ILE 183 Ca -0.00 -1.73 0.08 0.00 -0.39 0.00 0.00 64.86 62.81 2x1e h ILE 183 Cb 0.79 1.82 -0.06 0.00 -3.07 0.00 0.00 36.82 36.30 2x1e h ILE 183 CO 0.05 0.55 0.60 0.00 -0.69 0.00 0.00 178.15 178.66 2x1e h ALA 184 N 0.61 1.52 -0.37 1.87 0.00 -0.79 0.05 119.26 122.15 2x1e h ALA 184 Ca -0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2x1e h ALA 184 Cb 1.13 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 2x1e h ALA 184 CO 0.11 0.33 0.15 -0.07 0.00 0.00 0.00 179.25 179.77 2x1e h LEU 185 N 1.03 0.51 -0.90 0.00 3.38 -1.16 -1.67 115.31 116.50 2x1e h LEU 185 Ca 0.41 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 58.20 2x1e h LEU 185 Cb 0.26 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 2x1e h LEU 185 CO -0.17 0.53 0.47 -0.09 0.09 0.00 0.00 178.44 179.27 2x1e h ARG 186 N 0.46 1.25 -0.29 1.13 9.65 -0.85 0.46 114.38 126.19 2x1e h ARG 186 Ca 0.12 -0.16 0.03 0.00 -1.10 0.00 0.00 59.98 58.88 2x1e h ARG 186 Cb 0.18 -0.24 -0.03 0.00 -1.39 0.00 0.00 29.97 28.49 2x1e h ARG 186 CO -0.01 0.93 0.11 0.82 2.80 0.00 0.00 179.97 184.61 2x1e h ILE 187 N 1.25 0.94 -0.89 1.20 2.04 -0.85 -1.59 117.51 119.62 2x1e h ILE 187 Ca 0.31 -0.08 -0.01 0.00 1.00 0.00 0.00 64.86 66.08 2x1e h ILE 187 Cb 0.05 0.68 -0.04 0.00 -0.74 0.00 0.00 36.82 36.77 2x1e h ILE 187 CO -0.05 0.04 0.51 0.00 0.00 0.00 0.00 178.15 178.66 2x1e h ALA 188 N 1.17 1.23 0.00 1.87 0.00 -0.98 -2.29 119.26 120.27 2x1e h ALA 188 Ca 0.13 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2x1e h ALA 188 Cb 0.09 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 2x1e h ALA 188 CO -0.12 0.64 -0.02 -0.07 0.00 0.00 0.00 179.25 179.68 2x1e h LEU 189 N 1.23 0.00 -2.03 0.00 3.38 -0.47 -2.54 115.31 114.88 2x1e h LEU 189 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 2x1e h LEU 189 Cb -0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 2x1e h LEU 189 CO -0.05 0.02 0.00 -0.62 0.09 0.00 0.00 178.44 177.87 2x1e n GLU 190 N -3.14 2.34 -3.24 1.13 1.02 -0.64 -4.72 120.64 113.39 2x1e n GLU 190 Ca -0.01 -2.01 -0.30 0.00 -0.02 0.00 0.00 57.16 54.82 2x1e n GLU 190 Cb 0.24 -1.49 -0.04 0.00 -0.02 0.00 0.00 31.44 30.14 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 -1.60 6.51 0.00 1.62 0.01 -0.96 -4.55 113.70 114.73 2x1e s SER 191 Ca 0.36 0.87 0.25 0.00 1.31 0.00 0.00 55.95 58.73 2x1e s SER 191 Cb 0.21 -2.21 0.46 0.00 0.21 0.00 0.00 66.02 64.70 2x1e s SER 191 CO 0.31 -0.21 1.38 0.35 0.41 0.00 0.00 173.24 175.47 2x1e n THR 192 N -0.82 0.00 -3.68 1.44 -2.24 -1.26 -4.75 114.28 102.96 2x1e n THR 192 Ca -0.00 -0.05 -0.10 0.00 -2.27 0.00 0.00 64.05 61.63 2x1e n THR 192 Cb 0.54 0.43 -0.03 0.00 -2.10 0.00 0.00 70.33 69.16 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 -2.84 -0.33 0.33 3.42 1.04 -1.26 -4.81 113.70 109.26 2x1e s SER 193 Ca 0.15 -0.38 0.03 0.00 0.48 0.00 0.00 55.95 56.23 2x1e s SER 193 Cb 0.18 0.60 0.58 0.00 0.10 0.00 0.00 66.02 67.48 2x1e s SER 193 CO 0.67 -1.06 1.89 -0.65 0.98 0.00 0.00 173.24 175.06 2x1e h PRO 194 N 2.14 0.61 -0.41 4.02 0.11 -1.89 -0.81 132.00 135.77 2x1e h PRO 194 Ca -0.29 -0.11 0.01 0.00 0.11 0.00 0.00 66.00 65.72 2x1e h PRO 194 Cb 1.27 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 2x1e h PRO 194 CO 0.36 0.58 0.25 0.77 -0.21 0.00 0.00 178.00 179.75 2x1e h SER 195 N 0.59 0.41 -0.64 -2.05 0.02 -1.95 -0.09 113.55 109.84 2x1e h SER 195 Ca 0.13 -0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 61.01 2x1e h SER 195 Cb 0.26 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 62.69 2x1e h SER 195 CO 0.00 0.29 0.11 -0.61 -1.14 0.00 0.00 176.83 175.48 2x1e h GLN 196 N 0.50 1.05 -0.50 3.45 4.15 -1.90 -1.46 115.11 120.41 2x1e h GLN 196 Ca 0.16 -0.28 0.01 0.00 0.77 0.00 0.00 58.65 59.31 2x1e h GLN 196 Cb -0.01 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 27.53 2x1e h GLN 196 CO -0.07 0.97 0.32 0.00 -1.93 0.00 0.00 178.83 178.13 2x1e h ALA 197 N 1.04 0.63 0.18 3.38 0.00 -0.77 0.95 119.26 124.66 2x1e h ALA 197 Ca 0.19 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.08 2x1e h ALA 197 Cb 0.43 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2x1e h ALA 197 CO 0.01 0.06 -0.19 -0.92 0.00 0.00 0.00 179.25 178.21 2x1e h TYR 198 N 0.65 -0.50 -0.53 0.00 5.03 -0.88 -1.86 116.97 118.89 2x1e h TYR 198 Ca 0.19 0.00 0.08 0.00 2.58 0.00 0.00 58.73 61.58 2x1e h TYR 198 Cb -0.05 0.20 -0.06 0.00 1.55 0.00 0.00 36.73 38.36 2x1e h TYR 198 CO -0.05 -0.28 0.19 -0.44 -1.32 0.00 0.00 178.16 176.26 2x1e h ASP 199 N -0.40 0.18 0.31 -2.11 3.32 -0.97 -1.47 116.42 115.28 2x1e h ASP 199 Ca 0.00 0.07 -0.12 0.00 0.02 0.00 0.00 57.03 57.00 2x1e h ASP 199 Cb 0.39 0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 2x1e h ASP 199 CO -0.06 0.13 -0.50 0.03 -1.72 0.00 0.00 179.24 177.12 2x1e h ARG 200 N 0.37 0.22 -0.08 3.56 3.08 -0.63 0.22 114.38 121.12 2x1e h ARG 200 Ca 0.26 -0.13 -0.03 0.00 0.07 0.00 0.00 59.98 60.16 2x1e h ARG 200 Cb 0.30 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.35 2x1e h ARG 200 CO -0.27 0.68 -0.05 0.82 -1.07 0.00 0.00 179.97 180.08 2x1e h ILE 201 N 0.18 1.34 -0.54 2.04 2.04 -1.11 -3.19 117.51 118.26 2x1e h ILE 201 Ca 0.01 -1.11 -0.01 0.00 1.00 0.00 0.00 64.86 64.74 2x1e h ILE 201 Cb 0.95 1.92 -0.03 0.00 -0.74 0.00 0.00 36.82 38.92 2x1e h ILE 201 CO 0.08 0.31 0.30 0.58 0.00 0.00 0.00 178.15 179.41 2x1e h VAL 202 N -0.22 1.17 -0.06 1.67 2.07 -1.06 -2.31 116.25 117.51 2x1e h VAL 202 Ca 0.02 -0.42 0.02 0.00 0.82 0.00 0.00 66.70 67.14 2x1e h VAL 202 Cb 0.52 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 30.72 2x1e h VAL 202 CO 0.01 0.18 0.12 -0.33 0.02 0.00 0.00 177.57 177.58 2x1e h GLU 203 N 0.75 0.00 0.00 1.57 5.08 -0.56 -1.57 114.58 119.86 2x1e h GLU 203 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 2x1e h GLU 203 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2x1e h GLU 203 CO -0.03 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.02 2x1e n GLN 204 N -3.43 0.22 -1.05 2.33 1.13 -0.87 -4.90 117.38 110.81 2x1e n GLN 204 Ca -0.01 0.39 -0.02 0.00 -1.94 0.00 0.00 57.00 55.42 2x1e n GLN 204 Cb 0.20 -1.88 -0.01 0.00 0.11 0.00 0.00 30.24 28.67 2x1e n GLN 204 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2x1e n GLY 205 N 0.28 0.52 0.00 1.08 0.00 -0.59 -4.82 105.19 101.66 2x1e n GLY 205 Ca 0.03 -0.99 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 -2.78 4.96 3.83 -0.02 0.00 -1.26 -5.04 105.19 104.89 2x1e n GLY 206 Ca -0.02 -0.93 -0.33 0.00 0.00 0.00 0.00 46.02 44.74 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 -4.95 4.13 0.15 1.61 1.00 -1.26 -1.44 119.30 118.54 2x1e s MET 207 Ca 0.00 0.96 -0.05 0.00 0.00 0.00 0.00 55.69 56.60 2x1e s MET 207 Cb 0.00 -2.26 -0.03 0.00 0.00 0.00 0.00 34.83 32.55 2x1e s MET 207 CO 0.00 0.01 1.37 0.00 0.00 0.00 0.00 175.02 176.41 2x1e h ALA 208 N 1.94 0.48 -3.00 3.03 0.00 -1.14 -3.34 119.26 117.22 2x1e h ALA 208 Ca -0.48 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 53.80 2x1e h ALA 208 Cb 1.18 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2x1e h ALA 208 CO 0.62 0.75 0.00 0.00 0.00 0.00 0.00 179.25 180.63 2x1e n ALA 209 N -2.54 0.00 -2.42 0.00 0.00 -1.26 0.12 120.51 114.41 2x1e n ALA 209 Ca -0.06 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.11 2x1e n ALA 209 Cb 0.74 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 20.04 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 1.36 2.44 0.07 0.00 0.15 -1.26 -3.51 113.70 112.95 2x1e s SER 210 Ca 0.00 -0.38 -0.26 0.00 0.70 0.00 0.00 55.95 56.01 2x1e s SER 210 Cb 0.00 -0.27 0.09 0.00 -1.71 0.00 0.00 66.02 64.13 2x1e s SER 210 CO 0.00 0.25 1.18 0.00 1.20 0.00 0.00 173.24 175.87 2x1e s ALA 211 N -0.50 -2.08 -0.05 5.45 0.00 -1.18 -4.42 121.76 118.98 2x1e s ALA 211 Ca 0.08 -0.11 0.06 0.00 0.00 0.00 0.00 51.96 51.99 2x1e s ALA 211 Cb -0.08 0.82 -0.01 0.00 0.00 0.00 0.00 23.12 23.85 2x1e s ALA 211 CO -0.01 -1.11 -0.24 0.12 0.00 0.00 0.00 175.76 174.52 2x1e s PHE 212 N -2.09 2.28 -0.06 0.00 5.36 0.24 -2.48 117.98 121.23 2x1e s PHE 212 Ca 0.26 -0.63 0.03 0.00 -0.96 0.00 0.00 56.93 55.63 2x1e s PHE 212 Cb -0.01 -1.50 0.00 0.00 -0.34 0.00 0.00 43.02 41.17 2x1e s PHE 212 CO 0.02 -0.18 -0.16 0.42 -1.46 0.00 0.00 175.22 173.86 2x1e s ILE 213 N -0.21 1.38 -0.09 3.12 1.01 -0.59 -0.94 121.20 124.87 2x1e s ILE 213 Ca -0.01 -0.65 0.02 0.00 0.00 0.00 0.00 60.65 60.00 2x1e s ILE 213 Cb -0.13 -1.21 -0.02 0.00 0.01 0.00 0.00 42.46 41.11 2x1e s ILE 213 CO 0.03 0.40 -0.13 -0.32 0.00 0.00 0.00 174.94 174.92 2x1e s MET 214 N 0.32 2.90 -0.06 2.79 -2.45 -0.37 -0.10 119.30 122.32 2x1e s MET 214 Ca -0.10 -0.67 0.02 0.00 -1.25 0.00 0.00 55.69 53.69 2x1e s MET 214 Cb -0.14 -2.51 0.01 0.00 1.25 0.00 0.00 34.83 33.44 2x1e s MET 214 CO 0.04 0.46 -0.12 0.08 1.05 0.00 0.00 175.02 176.52 2x1e s VAL 215 N -0.29 1.13 0.08 10.11 1.01 -0.36 -0.84 120.40 131.24 2x1e s VAL 215 Ca 0.02 -0.48 -0.09 0.00 0.00 0.00 0.00 61.98 61.43 2x1e s VAL 215 Cb -0.13 -1.04 0.00 0.00 0.00 0.00 0.00 36.38 35.22 2x1e s VAL 215 CO 0.03 0.35 0.21 -0.83 0.00 0.00 0.00 175.10 174.86 2x1e s GLY 216 N 0.63 0.05 0.00 4.51 0.00 -0.22 -1.05 107.32 111.24 2x1e s GLY 216 Ca -0.14 -0.50 0.00 0.00 0.00 0.00 0.00 44.72 44.08 2x1e s GLY 216 CO 0.04 -0.69 0.00 1.16 0.00 0.00 0.00 173.10 173.60 2x1e n ASN 217 N 0.08 0.49 0.29 1.64 0.23 -0.44 -0.26 115.26 117.29 2x1e n ASN 217 Ca -0.16 -0.20 0.16 0.00 -0.53 0.00 0.00 54.58 53.86 2x1e n ASN 217 Cb 0.62 0.00 0.85 0.00 -2.08 0.00 0.00 39.78 39.17 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 -1.87 -3.32 103.07 102.71 2x1e h GLY 218 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.00 2x1e h GLY 218 CO 0.00 0.00 -2.26 1.57 0.00 0.00 0.00 176.54 175.85 2x1e n HIS 219 N -3.40 0.00 -3.55 5.60 -0.00 -1.26 -4.44 115.22 108.17 2x1e n HIS 219 Ca -0.02 0.00 -0.11 0.00 -0.00 0.00 0.00 57.72 57.59 2x1e n HIS 219 Cb 0.20 -0.88 -0.03 0.00 -0.00 0.00 0.00 29.99 29.28 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 -2.44 1.18 0.02 1.57 -1.05 -1.25 -5.15 118.70 111.57 2x1e s GLU 220 Ca -0.20 -0.61 -0.11 0.00 -0.15 0.00 0.00 54.97 53.89 2x1e s GLU 220 Cb 0.07 0.52 0.01 0.00 -0.44 0.00 0.00 34.13 34.29 2x1e s GLU 220 CO 0.63 -0.49 0.24 0.00 0.95 0.00 0.00 175.26 176.58 2x1e s ALA 221 N -3.78 -0.54 0.03 -0.84 0.00 -1.26 -1.33 121.76 114.04 2x1e s ALA 221 Ca 0.02 -0.01 -0.00 0.00 0.00 0.00 0.00 51.96 51.97 2x1e s ALA 221 Cb 0.00 0.19 -0.03 0.00 0.00 0.00 0.00 23.12 23.29 2x1e s ALA 221 CO -0.12 -0.31 -0.03 -0.59 0.00 0.00 0.00 175.76 174.71 2x1e s PHE 222 N -1.93 0.38 0.14 0.00 -0.12 -0.21 -4.46 117.98 111.77 2x1e s PHE 222 Ca -0.10 -0.69 0.07 0.00 -0.05 0.00 0.00 56.93 56.16 2x1e s PHE 222 Cb -0.04 -0.27 -0.04 0.00 -0.63 0.00 0.00 43.02 42.04 2x1e s PHE 222 CO -0.00 -0.24 -0.06 0.20 -0.05 0.00 0.00 175.22 175.07 2x1e s GLY 223 N -1.93 1.78 -0.18 1.99 0.00 0.02 -1.23 107.32 107.77 2x1e s GLY 223 Ca -0.08 -1.31 -0.02 0.00 0.00 0.00 0.00 44.72 43.31 2x1e s GLY 223 CO -0.04 -1.31 0.00 -2.27 0.00 0.00 0.00 173.10 169.49 2x1e s LEU 224 N -2.56 1.35 -0.26 0.66 2.96 0.86 -0.04 118.68 121.65 2x1e s LEU 224 Ca 0.24 -0.75 -0.11 0.00 -0.22 0.00 0.00 54.13 53.29 2x1e s LEU 224 Cb -0.10 -0.70 -0.05 0.00 0.50 0.00 0.00 46.19 45.84 2x1e s LEU 224 CO 0.16 -0.26 0.21 -1.61 -1.32 0.00 0.00 176.35 173.52 2x1e s GLU 225 N 1.78 4.01 0.06 1.98 2.02 -0.57 -1.54 118.70 126.43 2x1e s GLU 225 Ca -0.01 -0.25 -0.03 0.00 0.02 0.00 0.00 54.97 54.71 2x1e s GLU 225 Cb -0.16 -3.61 -0.03 0.00 0.10 0.00 0.00 34.13 30.43 2x1e s GLU 225 CO -0.07 -0.10 0.03 -0.59 0.02 0.00 0.00 175.26 174.55 2x1e s PHE 226 N 1.51 0.41 0.33 1.61 -0.12 -1.04 -1.01 117.98 119.68 2x1e s PHE 226 Ca 0.08 -0.92 0.06 0.00 -0.05 0.00 0.00 56.93 56.10 2x1e s PHE 226 Cb -0.15 -0.29 -0.03 0.00 -0.63 0.00 0.00 43.02 41.92 2x1e s PHE 226 CO 0.08 -0.42 0.30 -1.54 -0.05 0.00 0.00 175.22 173.59 2x1e s SER 227 N -2.89 1.59 0.66 1.98 1.04 0.63 -3.12 113.70 113.59 2x1e s SER 227 Ca 0.06 -1.73 0.34 0.00 0.48 0.00 0.00 55.95 55.10 2x1e s SER 227 Cb 0.07 0.56 1.88 0.00 0.10 0.00 0.00 66.02 68.63 2x1e s SER 227 CO -0.10 -1.08 2.07 -0.65 0.98 0.00 0.00 173.24 174.46 2x1e h PRO 228 N 2.14 0.00 0.00 4.02 0.11 -1.68 -3.05 132.00 133.54 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 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2x1e h PRO 228 CO 0.37 0.00 -0.04 0.25 -0.21 0.00 0.00 178.00 178.37 2x1e n THR 229 N -3.04 1.15 -3.65 -1.15 -2.24 -1.26 -4.63 114.28 99.47 2x1e n THR 229 Ca -0.02 -1.30 -0.09 0.00 -2.27 0.00 0.00 64.05 60.38 2x1e n THR 229 Cb 0.29 0.27 -0.08 0.00 -2.10 0.00 0.00 70.33 68.72 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 -1.60 -0.85 -0.25 3.42 0.15 -1.15 -5.00 113.70 108.42 2x1e s SER 230 Ca 0.12 1.40 -0.02 0.00 0.70 0.00 0.00 55.95 58.15 2x1e s SER 230 Cb 0.10 1.30 0.08 0.00 -1.71 0.00 0.00 66.02 65.79 2x1e s SER 230 CO 0.01 -0.23 0.06 -0.63 1.20 0.00 0.00 173.24 173.65 2x1e s ILE 231 N 1.39 0.73 -0.10 6.45 1.01 -1.26 -0.27 121.20 129.16 2x1e s ILE 231 Ca -0.08 -0.98 0.02 0.00 0.00 0.00 0.00 60.65 59.61 2x1e s ILE 231 Cb -0.05 -1.37 -0.02 0.00 0.01 0.00 0.00 42.46 41.03 2x1e s ILE 231 CO -0.16 -0.42 -0.16 -0.13 0.00 0.00 0.00 174.94 174.07 2x1e s ARG 232 N 1.73 3.02 -0.19 2.79 1.81 -0.18 -5.00 118.95 122.92 2x1e s ARG 232 Ca 0.04 -0.73 -0.15 0.00 -1.72 0.00 0.00 55.73 53.16 2x1e s ARG 232 Cb -0.17 -2.48 -0.04 0.00 -0.45 0.00 0.00 34.95 31.81 2x1e s ARG 232 CO -0.17 0.34 0.37 0.21 -0.68 0.00 0.00 175.30 175.38 2x1e s LYS 233 N -0.01 4.20 -0.06 3.54 2.20 -1.26 -1.51 119.74 126.84 2x1e s LYS 233 Ca -0.05 0.17 -0.17 0.00 -0.36 0.00 0.00 55.97 55.56 2x1e s LYS 233 Cb -0.14 -3.50 -0.05 0.00 -1.51 0.00 0.00 37.83 32.62 2x1e s LYS 233 CO 0.04 0.04 0.47 -1.14 -0.36 0.00 0.00 175.35 174.41 2x1e s GLN 234 N 1.05 4.21 0.39 4.03 0.74 0.94 -4.94 119.66 126.08 2x1e s GLN 234 Ca 0.18 0.48 0.08 0.00 0.05 0.00 0.00 55.36 56.15 2x1e s GLN 234 Cb -0.14 -3.35 -0.07 0.00 1.10 0.00 0.00 33.01 30.55 2x1e s GLN 234 CO 0.07 0.37 -0.01 0.14 -0.55 0.00 0.00 175.29 175.31 2x1e s VAL 235 N -0.08 2.14 0.32 1.34 -7.23 -1.26 -0.80 120.40 114.83 2x1e s VAL 235 Ca 0.26 -2.04 -0.29 0.00 -1.81 0.00 0.00 61.98 58.10 2x1e s VAL 235 Cb -0.16 -2.88 -0.11 0.00 0.56 0.00 0.00 36.38 33.79 2x1e s VAL 235 CO 0.12 -0.08 1.48 -0.76 -0.31 0.00 0.00 175.10 175.56 2x1e s LEU 236 N -3.70 4.36 0.00 1.32 1.43 -1.26 -4.86 118.68 115.97 2x1e s LEU 236 Ca 0.35 2.88 -0.12 0.00 -1.03 0.00 0.00 54.13 56.21 2x1e s LEU 236 Cb 0.07 -3.65 0.16 0.00 0.03 0.00 0.00 46.19 42.80 2x1e s LEU 236 CO 0.18 -0.79 0.79 -0.90 0.23 0.00 0.00 176.35 175.86 2x1e n ASP 237 N 1.45 -0.59 0.25 2.29 5.68 0.06 -4.83 116.55 120.86 2x1e n ASP 237 Ca 0.04 -1.16 0.17 0.00 -0.50 0.00 0.00 54.79 53.34 2x1e n ASP 237 Cb 0.39 -0.64 0.89 0.00 -1.14 0.00 0.00 41.12 40.62 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 -2.09 1.00 -0.70 2.12 0.00 -1.95 -0.29 119.26 117.34 2x1e h ALA 238 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2x1e h ALA 238 Cb 0.77 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2x1e h ALA 238 CO 0.18 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.52 2x1e n ASN 239 N -2.66 4.09 -1.25 0.00 5.03 -1.26 -4.93 115.26 114.29 2x1e n ASN 239 Ca -0.02 -2.13 -0.12 0.00 0.87 0.00 0.00 54.58 53.18 2x1e n ASN 239 Cb 0.06 -0.51 -0.02 0.00 -1.02 0.00 0.00 39.78 38.29 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 1.50 0.25 3.56 7.41 0.00 -0.12 -4.70 105.19 113.09 2x1e n GLY 240 Ca 0.24 -0.41 -0.27 0.00 0.00 0.00 0.00 46.02 45.59 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 -4.18 2.02 -0.05 1.61 0.52 -1.26 -1.28 118.95 116.32 2x1e s ARG 241 Ca 0.00 -1.25 -0.02 0.00 -0.52 0.00 0.00 55.73 53.94 2x1e s ARG 241 Cb 0.00 -2.15 0.04 0.00 0.52 0.00 0.00 34.95 33.35 2x1e s ARG 241 CO 0.00 0.44 0.11 1.41 0.02 0.00 0.00 175.30 177.29 2x1e s MET 242 N -2.71 0.05 -0.03 3.54 1.75 0.10 -0.76 119.30 121.24 2x1e s MET 242 Ca 0.24 0.33 0.04 0.00 -1.25 0.00 0.00 55.69 55.05 2x1e s MET 242 Cb -0.09 -0.21 -0.01 0.00 2.84 0.00 0.00 34.83 37.36 2x1e s MET 242 CO 0.14 -0.18 -0.16 0.08 -0.65 0.00 0.00 175.02 174.26 2x1e s VAL 243 N 1.24 1.29 -0.02 10.11 1.01 -1.26 -0.52 120.40 132.25 2x1e s VAL 243 Ca -0.08 -0.66 -0.04 0.00 0.00 0.00 0.00 61.98 61.19 2x1e s VAL 243 Cb -0.12 -1.09 0.00 0.00 0.00 0.00 0.00 36.38 35.17 2x1e s VAL 243 CO -0.05 0.37 0.10 -2.28 0.00 0.00 0.00 175.10 173.24 2x1e s HIS 244 N -0.13 -0.03 0.00 5.22 2.46 -0.00 -5.01 115.29 117.81 2x1e s HIS 244 Ca 0.01 0.07 0.00 0.00 0.47 0.00 0.00 55.06 55.61 2x1e s HIS 244 Cb -0.09 -0.01 0.00 0.00 -0.13 0.00 0.00 32.58 32.35 2x1e s HIS 244 CO 0.01 -0.13 0.00 0.25 -2.47 0.00 0.00 174.74 172.39 2x1e n THR 245 N 2.43 0.00 -1.52 0.89 -2.24 -1.26 -0.86 114.28 111.73 2x1e n THR 245 Ca -0.17 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.68 2x1e n THR 245 Cb 0.58 0.00 0.19 0.00 -2.10 0.00 0.00 70.33 69.00 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 1.81 -3.99 3.42 4.13 -1.26 -4.73 115.26 114.64 2x1e n ASN 246 Ca 0.00 -3.70 -0.08 0.00 1.68 0.00 0.00 54.58 52.47 2x1e n ASN 246 Cb 0.00 -0.50 -0.09 0.00 -1.54 0.00 0.00 39.78 37.64 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 -3.09 0.33 0.01 3.10 -3.43 -1.26 -4.59 115.29 106.36 2x1e s HIS 247 Ca 0.37 -0.77 -0.30 0.00 -0.80 0.00 0.00 55.06 53.56 2x1e s HIS 247 Cb 0.35 -0.23 -0.06 0.00 -1.43 0.00 0.00 32.58 31.20 2x1e s HIS 247 CO -0.05 -0.40 1.54 0.00 -2.00 0.00 0.00 174.74 173.83 2x1e n LEU 249 N 5.83 0.26 -4.93 0.00 4.77 -1.26 -4.99 117.00 116.68 2x1e n LEU 249 Ca 0.15 -0.15 -0.27 0.00 -0.03 0.00 0.00 56.01 55.71 2x1e n LEU 249 Cb 0.42 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.48 2x1e n LEU 249 CO 0.61 0.06 -0.11 -0.76 -1.33 0.00 0.00 177.39 175.86 2x1e s LEU 250 N -3.90 4.33 -0.54 2.23 1.43 -1.26 -5.04 118.68 115.92 2x1e s LEU 250 Ca -0.03 0.18 -0.28 0.00 -1.03 0.00 0.00 54.13 52.98 2x1e s LEU 250 Cb 0.13 -2.90 0.01 0.00 0.03 0.00 0.00 46.19 43.45 2x1e s LEU 250 CO 0.78 0.08 1.47 -1.58 0.23 0.00 0.00 176.35 177.33 2x1e s GLN 251 N -3.08 3.27 0.45 1.70 2.00 -1.26 -5.01 119.66 117.73 2x1e s GLN 251 Ca 0.34 0.54 0.03 0.00 -2.00 0.00 0.00 55.36 54.28 2x1e s GLN 251 Cb -0.11 -4.14 0.01 0.00 0.80 0.00 0.00 33.01 29.56 2x1e s GLN 251 CO 0.28 -1.97 0.64 -1.01 -0.50 0.00 0.00 175.29 172.73 2x1e s HIS 252 N 6.28 3.03 0.79 1.67 3.76 -1.26 -5.05 115.29 124.52 2x1e s HIS 252 Ca 0.55 -0.04 -0.13 0.00 -0.15 0.00 0.00 55.06 55.29 2x1e s HIS 252 Cb -0.12 -2.37 0.07 0.00 1.11 0.00 0.00 32.58 31.28 2x1e s HIS 252 CO 0.25 -0.43 1.19 0.20 -0.85 0.00 0.00 174.74 175.10 2x1e s GLY 253 N -4.29 2.12 0.56 -2.22 0.00 -1.26 -4.89 107.32 97.35 2x1e s GLY 253 Ca 0.51 0.78 0.27 0.00 0.00 0.00 0.00 44.72 46.28 2x1e s GLY 253 CO 0.36 1.19 1.99 0.50 0.00 0.00 0.00 173.10 177.14 2x1e h LYS 254 N -0.84 0.00 -0.00 2.90 1.57 -2.03 -2.31 116.57 115.85 2x1e h LYS 254 Ca -0.46 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 2x1e h LYS 254 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.60 2x1e h LYS 254 CO 0.47 0.00 -0.17 0.09 -0.57 0.00 0.00 179.45 179.27 2x1e n ASN 255 N -4.03 0.37 -4.73 0.86 4.13 -1.26 -4.79 115.26 105.82 2x1e n ASN 255 Ca 0.07 -0.26 -0.41 0.00 1.68 0.00 0.00 54.58 55.66 2x1e n ASN 255 Cb 0.56 -0.10 -0.04 0.00 -1.54 0.00 0.00 39.78 38.66 2x1e n ASN 255 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 2x1e s GLU 256 N -2.70 4.54 -0.21 3.52 0.41 -0.87 -5.03 118.70 118.36 2x1e s GLU 256 Ca 0.22 1.69 0.00 0.00 -0.41 0.00 0.00 54.97 56.47 2x1e s GLU 256 Cb 0.19 -3.32 0.02 0.00 -1.78 0.00 0.00 34.13 29.24 2x1e s GLU 256 CO 0.53 -0.03 -0.15 0.15 -0.49 0.00 0.00 175.26 175.27 2x1e s LYS 257 N 0.23 2.93 -0.35 1.61 -0.14 -1.26 -4.98 119.74 117.77 2x1e s LYS 257 Ca 0.52 -0.89 -0.24 0.00 -1.36 0.00 0.00 55.97 54.01 2x1e s LYS 257 Cb -0.28 -2.73 0.01 0.00 -1.68 0.00 0.00 37.83 33.14 2x1e s LYS 257 CO 0.32 -0.28 0.82 -2.00 -0.76 0.00 0.00 175.35 173.45 2x1e s GLU 258 N 1.30 3.81 -0.85 1.68 2.12 -1.26 -1.23 118.70 124.27 2x1e s GLU 258 Ca 0.03 0.42 -0.22 0.00 0.36 0.00 0.00 54.97 55.56 2x1e s GLU 258 Cb -0.15 -3.79 0.08 0.00 0.26 0.00 0.00 34.13 30.53 2x1e s GLU 258 CO -0.09 -0.84 1.17 -0.51 -0.54 0.00 0.00 175.26 174.45 2x1e s LEU 259 N 3.16 4.28 -0.70 2.70 1.43 0.29 -4.64 118.68 125.20 2x1e s LEU 259 Ca 0.33 -1.41 -0.12 0.00 -1.03 0.00 0.00 54.13 51.90 2x1e s LEU 259 Cb -0.13 -2.46 0.02 0.00 0.03 0.00 0.00 46.19 43.64 2x1e s LEU 259 CO 0.16 -1.37 0.63 0.47 0.23 0.00 0.00 176.35 176.47 2x1e n ASP 260 N 7.76 -5.34 -4.87 2.29 8.00 -1.26 -4.87 116.55 118.27 2x1e n ASP 260 Ca 0.16 -0.62 -0.31 0.00 0.71 0.00 0.00 54.79 54.73 2x1e n ASP 260 Cb 0.48 -2.03 0.02 0.00 -0.02 0.00 0.00 41.12 39.57 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 -4.00 3.40 0.22 -0.24 0.04 -1.26 -5.00 135.00 128.15 2x1e s PRO 261 Ca 0.12 0.73 -0.31 0.00 0.04 0.00 0.00 61.00 61.58 2x1e s PRO 261 Cb -0.01 -2.06 -0.11 0.00 0.04 0.00 0.00 34.50 32.36 2x1e s PRO 261 CO 0.88 -0.71 1.56 -0.51 0.04 0.00 0.00 177.00 178.26 2x1e s LEU 262 N -5.25 4.37 0.33 -3.56 1.43 -1.26 -4.91 118.68 109.82 2x1e s LEU 262 Ca 0.56 2.73 0.06 0.00 -1.03 0.00 0.00 54.13 56.45 2x1e s LEU 262 Cb -0.11 -3.61 0.71 0.00 0.03 0.00 0.00 46.19 43.21 2x1e s LEU 262 CO 0.54 -0.83 1.88 -0.65 0.23 0.00 0.00 176.35 177.51 2x1e h PRO 263 N 5.97 0.79 0.00 1.29 0.11 -2.01 -1.98 132.00 136.17 2x1e h PRO 263 Ca -0.44 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2x1e h PRO 263 Cb 1.21 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2x1e h PRO 263 CO 0.86 0.52 0.00 -0.40 -0.21 0.00 0.00 178.00 178.77 2x1e n ASP 264 N -4.55 0.49 0.01 -2.05 5.68 -1.26 -1.94 116.55 112.92 2x1e n ASP 264 Ca 0.16 0.68 0.05 0.00 -0.50 0.00 0.00 54.79 55.18 2x1e n ASP 264 Cb 0.38 -0.76 0.44 0.00 -1.14 0.00 0.00 41.12 40.04 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 0.44 -0.00 -1.12 0.87 -1.72 -0.11 113.55 111.91 2x1e h SER 265 Ca 0.00 -0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.55 2x1e h SER 265 Cb 0.15 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.00 2x1e h SER 265 CO 0.00 0.31 -0.00 -0.50 -0.53 0.00 0.00 176.83 176.11 2x1e h TRP 266 N 0.51 0.00 -0.32 2.24 6.55 -1.57 -2.78 115.95 120.59 2x1e h TRP 266 Ca 0.15 -0.00 0.07 0.00 0.95 0.00 0.00 58.89 60.06 2x1e h TRP 266 Cb -0.01 -0.00 -0.08 0.00 -0.86 0.00 0.00 29.16 28.21 2x1e h TRP 266 CO -0.00 0.75 -0.23 -0.91 -1.05 0.00 0.00 178.44 177.00 2x1e h ASN 267 N -0.74 -0.76 -0.87 -3.49 4.21 -1.61 -1.61 115.58 110.71 2x1e h ASN 267 Ca -0.00 0.15 -0.00 0.00 1.21 0.00 0.00 56.30 57.66 2x1e h ASN 267 Cb 0.75 0.38 -0.04 0.00 -1.12 0.00 0.00 38.32 38.28 2x1e h ASN 267 CO 0.00 -0.26 0.53 0.03 -1.29 0.00 0.00 177.43 176.44 2x1e h ARG 268 N -0.20 1.17 0.05 0.81 3.08 -1.11 0.31 114.38 118.49 2x1e h ARG 268 Ca 0.16 -0.10 -0.00 0.00 0.07 0.00 0.00 59.98 60.11 2x1e h ARG 268 Cb 0.45 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 30.26 2x1e h ARG 268 CO -0.44 0.82 -0.02 1.25 -1.07 0.00 0.00 179.97 180.51 2x1e h HIS 269 N 1.19 -0.06 -0.78 3.04 2.76 -1.23 -0.26 115.15 119.81 2x1e h HIS 269 Ca 0.31 -0.00 0.02 0.00 -2.20 0.00 0.00 60.37 58.50 2x1e h HIS 269 Cb -0.06 0.02 -0.04 0.00 1.55 0.00 0.00 27.41 28.88 2x1e h HIS 269 CO -0.00 0.03 0.50 1.96 -1.30 0.00 0.00 177.93 179.12 2x1e h GLN 270 N -0.13 0.97 -0.44 5.26 4.20 -0.91 -1.91 115.11 122.15 2x1e h GLN 270 Ca -0.01 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.60 2x1e h GLN 270 Cb 0.11 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 2x1e h GLN 270 CO 0.01 0.64 0.11 -0.09 -0.67 0.00 0.00 178.83 178.83 2x1e h ARG 271 N 1.00 0.71 -0.60 1.46 9.65 -0.22 -1.09 114.38 125.29 2x1e h ARG 271 Ca 0.30 -0.17 -0.05 0.00 -1.10 0.00 0.00 59.98 58.96 2x1e h ARG 271 Cb -0.03 -0.09 -0.03 0.00 -1.39 0.00 0.00 29.97 28.43 2x1e h ARG 271 CO -0.09 0.71 0.17 1.98 2.80 0.00 0.00 179.97 185.54 2x1e h MET 272 N 0.59 0.95 -0.92 0.20 4.05 -0.90 0.13 114.93 119.02 2x1e h MET 272 Ca 0.14 -0.21 -0.01 0.00 -0.28 0.00 0.00 59.70 59.34 2x1e h MET 272 Cb 0.32 -0.13 -0.04 0.00 -0.80 0.00 0.00 31.60 30.94 2x1e h MET 272 CO 0.00 0.85 0.54 0.93 0.23 0.00 0.00 176.91 179.47 2x1e h GLU 273 N 0.87 1.26 -0.10 0.39 5.08 -1.21 0.49 114.58 121.35 2x1e h GLU 273 Ca 0.19 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 2x1e h GLU 273 Cb 0.31 -0.26 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 2x1e h GLU 273 CO -0.00 0.89 0.04 0.35 -1.00 0.00 0.00 179.01 179.29 2x1e h PHE 274 N 1.28 0.15 -0.61 4.33 3.57 -0.80 -2.07 116.94 122.79 2x1e h PHE 274 Ca 0.33 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.82 2x1e h PHE 274 Cb -0.04 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.63 2x1e h PHE 274 CO 0.01 0.24 0.37 -0.07 -2.23 0.00 0.00 178.31 176.62 2x1e h LEU 275 N 0.02 0.73 -1.49 0.59 3.38 -0.61 -2.04 115.31 115.89 2x1e h LEU 275 Ca 0.03 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 2x1e h LEU 275 Cb 0.15 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2x1e h LEU 275 CO -0.00 0.58 -0.24 -0.07 0.09 0.00 0.00 178.44 178.80 2x1e h LEU 276 N 0.82 0.03 -1.15 1.67 3.38 -0.88 -0.47 115.31 118.71 2x1e h LEU 276 Ca 0.22 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.13 2x1e h LEU 276 Cb -0.02 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 2x1e h LEU 276 CO -0.04 0.26 0.02 0.44 0.09 0.00 0.00 178.44 179.22 2x1e h ASP 277 N 0.03 0.57 0.22 -0.43 3.32 -0.66 -3.26 116.42 116.20 2x1e h ASP 277 Ca 0.00 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.94 2x1e h ASP 277 Cb 0.43 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.83 2x1e h ASP 277 CO 0.03 0.63 -1.38 0.61 -1.72 0.00 0.00 179.24 177.41 2x1e n GLY 278 N -0.85 -1.11 3.81 2.75 0.00 -0.75 -4.99 105.19 104.05 2x1e n GLY 278 Ca 0.02 -0.47 -0.33 0.00 0.00 0.00 0.00 46.02 45.23 2x1e n GLY 278 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2x1e s PHE 279 N -3.29 3.13 -2.27 1.61 -0.12 -0.26 -4.96 117.98 111.82 2x1e s PHE 279 Ca -0.00 1.54 0.29 0.00 -0.05 0.00 0.00 56.93 58.71 2x1e s PHE 279 Cb 0.14 -2.96 1.25 0.00 -0.63 0.00 0.00 43.02 40.82 2x1e s PHE 279 CO 0.86 -0.71 1.86 -0.40 -0.05 0.00 0.00 175.22 176.77 2x1e n ASP 280 N -1.33 1.04 0.00 1.98 5.68 -1.26 -4.91 116.55 117.74 2x1e n ASP 280 Ca 0.08 -1.28 0.00 0.00 -0.50 0.00 0.00 54.79 53.10 2x1e n ASP 280 Cb 0.53 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.51 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 1.15 0.98 3.80 6.12 0.00 -1.26 -5.05 105.19 110.93 2x1e n GLY 281 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.51 3.82 0.31 2.61 -4.23 -1.26 -4.92 115.64 109.46 2x1e s THR 282 Ca 0.00 1.13 0.02 0.00 -1.18 0.00 0.00 61.69 61.66 2x1e s THR 282 Cb 0.00 -3.46 0.28 0.00 1.34 0.00 0.00 72.50 70.67 2x1e s THR 282 CO 0.00 -0.25 1.91 0.50 -0.54 0.00 0.00 174.62 176.24 2x1e h LYS 283 N 1.56 0.95 -0.30 3.99 3.64 -1.99 -1.42 116.57 123.00 2x1e h LYS 283 Ca -0.49 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 58.80 2x1e h LYS 283 Cb 1.22 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.81 2x1e h LYS 283 CO 0.59 0.63 0.07 1.96 -2.27 0.00 0.00 179.45 180.43 2x1e h GLN 284 N 0.98 0.48 -0.71 1.90 1.08 -2.00 -1.60 115.11 115.24 2x1e h GLN 284 Ca 0.40 -0.12 -0.06 0.00 -1.45 0.00 0.00 58.65 57.42 2x1e h GLN 284 Cb 0.27 -0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 27.60 2x1e h GLN 284 CO -0.16 0.56 0.19 0.00 -0.95 0.00 0.00 178.83 178.47 2x1e h ALA 285 N 0.90 0.93 -0.64 3.87 0.00 -1.89 -2.55 119.26 119.89 2x1e h ALA 285 Ca 0.09 -0.24 0.06 0.00 0.00 0.00 0.00 54.91 54.82 2x1e h ALA 285 Cb 0.29 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 2x1e h ALA 285 CO 0.00 0.64 0.34 0.35 0.00 0.00 0.00 179.25 180.59 2x1e h PHE 286 N 1.06 0.63 -0.90 0.00 3.57 -1.10 -2.20 116.94 118.00 2x1e h PHE 286 Ca 0.22 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.73 2x1e h PHE 286 Cb 0.35 -0.19 -0.04 0.00 2.79 0.00 0.00 35.95 38.86 2x1e h PHE 286 CO 0.03 0.30 0.49 0.00 -2.23 0.00 0.00 178.31 176.89 2x1e h ALA 287 N 1.34 1.15 0.00 2.41 0.00 -1.08 -2.81 119.26 120.27 2x1e h ALA 287 Ca 0.29 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 2x1e h ALA 287 Cb 0.19 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2x1e h ALA 287 CO -0.19 0.66 -0.22 1.96 0.00 0.00 0.00 179.25 181.47 2x1e h GLN 288 N 1.26 0.00 -0.52 0.00 4.20 -0.99 -3.10 115.11 115.95 2x1e h GLN 288 Ca 0.31 0.00 0.06 0.00 0.06 0.00 0.00 58.65 59.08 2x1e h GLN 288 Cb 0.04 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.79 2x1e h GLN 288 CO -0.05 0.22 0.35 -0.07 -0.67 0.00 0.00 178.83 178.61 2x1e h LEU 289 N 0.00 0.41 0.00 1.46 3.38 -1.19 -1.89 115.31 117.49 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 0.42 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.08 2x1e h LEU 289 CO 0.03 0.27 0.00 0.79 0.09 0.00 0.00 178.44 179.62 2x1e n TRP 290 N -4.47 0.00 1.20 1.13 7.02 -1.17 -2.31 117.44 118.83 2x1e n TRP 290 Ca 0.07 0.00 0.13 0.00 -1.02 0.00 0.00 57.50 56.68 2x1e n TRP 290 Cb 0.24 -0.43 0.34 0.00 -2.42 0.00 0.00 31.31 29.05 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 -1.43 2.52 -1.71 6.99 0.00 -0.71 -3.84 120.51 122.34 2x1e n ALA 291 Ca 0.08 -0.58 -0.43 0.00 0.00 0.00 0.00 53.44 52.50 2x1e n ALA 291 Cb 0.25 -1.02 -0.03 0.00 0.00 0.00 0.00 19.45 18.65 2x1e n ALA 291 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2x1e n ASP 292 N 0.68 3.66 -0.22 0.00 2.03 -0.98 -4.69 116.55 117.03 2x1e n ASP 292 Ca 0.17 1.09 0.09 0.00 0.52 0.00 0.00 54.79 56.66 2x1e n ASP 292 Cb 0.45 -1.53 0.16 0.00 -0.72 0.00 0.00 41.12 39.48 2x1e n ASP 292 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2x1e n GLU 293 N 3.35 1.34 -2.04 -0.67 1.02 -1.26 -1.15 120.64 121.24 2x1e n GLU 293 Ca 0.15 -2.75 -0.41 0.00 -0.02 0.00 0.00 57.16 54.12 2x1e n GLU 293 Cb 0.33 -1.52 -0.02 0.00 -0.02 0.00 0.00 31.44 30.21 2x1e n GLU 293 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2x1e s ASP 294 N -2.95 6.68 -1.13 1.62 2.15 -1.26 -1.90 116.67 119.87 2x1e s ASP 294 Ca 0.33 2.62 0.00 0.00 0.43 0.00 0.00 52.55 55.94 2x1e s ASP 294 Cb 0.30 -2.62 0.00 0.00 -0.30 0.00 0.00 42.92 40.30 2x1e s ASP 294 CO 0.00 -0.69 0.00 -3.20 -0.17 0.00 0.00 175.17 171.12 2x1e n ASN 295 N 2.51 -4.12 -4.61 -0.34 5.15 -1.26 -4.12 115.26 108.47 2x1e n ASN 295 Ca 0.07 -0.01 -0.46 0.00 -0.60 0.00 0.00 54.58 53.58 2x1e n ASN 295 Cb 0.40 -3.30 -0.03 0.00 -0.53 0.00 0.00 39.78 36.33 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 -3.99 1.52 1.29 1.20 4.19 -0.80 -1.00 117.16 119.57 2x1e n TYR 296 Ca -0.16 0.63 0.12 0.00 3.31 0.00 0.00 57.90 61.80 2x1e n TYR 296 Cb 0.62 -2.31 0.42 0.00 0.49 0.00 0.00 39.34 38.55 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 1.41 1.75 -0.18 2.98 -0.04 -1.26 -4.88 135.00 134.77 2x1e n PRO 297 Ca 0.12 -1.11 0.02 0.00 -0.04 0.00 0.00 63.50 62.48 2x1e n PRO 297 Cb 0.29 -1.43 0.09 0.00 -0.04 0.00 0.00 33.50 32.40 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 0.34 0.42 -1.54 0.54 3.72 -0.17 -1.72 117.46 119.06 2x1e n PHE 298 Ca 0.17 -0.15 -0.29 0.00 -0.05 0.00 0.00 57.45 57.13 2x1e n PHE 298 Cb 0.36 -0.17 0.13 0.00 -0.94 0.00 0.00 39.48 38.86 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 -0.27 3.62 0.17 4.37 1.04 -1.20 -4.87 113.70 116.56 2x1e s SER 299 Ca 0.12 0.99 -0.16 0.00 0.48 0.00 0.00 55.95 57.38 2x1e s SER 299 Cb 0.09 -1.58 0.12 0.00 0.10 0.00 0.00 66.02 64.74 2x1e s SER 299 CO 0.04 -2.48 1.67 0.40 0.98 0.00 0.00 173.24 173.85 2x1e h ILE 300 N -1.45 0.60 -1.68 -1.02 2.04 -1.78 -2.52 117.51 111.70 2x1e h ILE 300 Ca -0.50 -0.01 -0.65 0.00 1.00 0.00 0.00 64.86 64.70 2x1e h ILE 300 Cb 1.33 0.56 -0.13 0.00 -0.74 0.00 0.00 36.82 37.84 2x1e h ILE 300 CO 0.62 0.01 1.25 0.00 0.00 0.00 0.00 178.15 180.03 2x1e s ARG 302 N 3.85 4.31 0.04 0.00 3.52 -0.95 -4.77 118.95 124.95 2x1e s ARG 302 Ca 0.41 1.42 0.07 0.00 -0.13 0.00 0.00 55.73 57.50 2x1e s ARG 302 Cb -0.02 -2.59 -0.03 0.00 -1.56 0.00 0.00 34.95 30.75 2x1e s ARG 302 CO -0.08 0.00 -0.21 0.00 -0.81 0.00 0.00 175.30 174.20 2x1e s ALA 303 N -1.69 1.75 0.22 6.12 0.00 -0.70 -1.45 121.76 126.01 2x1e s ALA 303 Ca 0.56 -1.06 -0.30 0.00 0.00 0.00 0.00 51.96 51.16 2x1e s ALA 303 Cb -0.20 -0.34 -0.09 0.00 0.00 0.00 0.00 23.12 22.50 2x1e s ALA 303 CO 0.25 0.39 1.15 -0.47 0.00 0.00 0.00 175.76 177.08 2x1e s TYR 304 N -0.81 3.49 -0.24 0.00 5.04 -1.10 -4.68 117.35 119.05 2x1e s TYR 304 Ca 0.07 1.54 -0.06 0.00 -2.44 0.00 0.00 57.07 56.18 2x1e s TYR 304 Cb -0.09 -3.37 0.12 0.00 0.35 0.00 0.00 41.96 38.97 2x1e s TYR 304 CO 0.02 -0.92 0.48 -2.00 -1.34 0.00 0.00 175.55 171.78 2x1e s GLU 305 N -0.70 0.41 0.15 4.97 2.12 -0.48 -4.94 118.70 120.23 2x1e s GLU 305 Ca 0.49 1.01 -0.31 0.00 0.36 0.00 0.00 54.97 56.52 2x1e s GLU 305 Cb -0.32 0.30 -0.11 0.00 0.26 0.00 0.00 34.13 34.27 2x1e s GLU 305 CO 0.38 -0.36 1.73 -2.00 -0.54 0.00 0.00 175.26 174.47 2x1e s GLU 306 N 2.69 4.15 0.00 4.30 2.12 -1.26 0.20 118.70 130.89 2x1e s GLU 306 Ca 0.03 2.53 0.00 0.00 0.36 0.00 0.00 54.97 57.89 2x1e s GLU 306 Cb -0.13 -3.36 0.00 0.00 0.26 0.00 0.00 34.13 30.90 2x1e s GLU 306 CO -0.16 -0.76 0.00 0.41 -0.54 0.00 0.00 175.26 174.21 2x1e n GLY 307 N 4.05 1.18 1.45 -1.50 0.00 -1.26 -4.82 105.19 104.29 2x1e n GLY 307 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 -2.00 0.00 -5.00 1.61 4.76 -0.31 -5.09 118.16 112.13 2x1e n LYS 308 Ca 0.00 0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 55.12 2x1e n LYS 308 Cb 0.00 -0.11 -0.17 0.00 -1.84 0.00 0.00 35.03 32.92 2x1e n LYS 308 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2x1e s SER 309 N -4.94 3.22 0.11 4.39 0.15 0.13 -4.96 113.70 111.80 2x1e s SER 309 Ca 0.00 -0.54 0.16 0.00 0.70 0.00 0.00 55.95 56.27 2x1e s SER 309 Cb 0.00 -1.45 -0.09 0.00 -1.71 0.00 0.00 66.02 62.77 2x1e s SER 309 CO 0.00 0.14 0.98 -0.09 1.20 0.00 0.00 173.24 175.46 2x1e h ARG 310 N 6.89 0.00 -5.44 5.44 2.43 -1.87 -1.27 114.38 120.57 2x1e h ARG 310 Ca -0.24 0.00 -0.65 0.00 -0.81 0.00 0.00 59.98 58.28 2x1e h ARG 310 Cb 1.22 0.00 -0.11 0.00 -0.42 0.00 0.00 29.97 30.67 2x1e h ARG 310 CO 0.50 0.35 -0.46 0.20 -1.51 0.00 0.00 179.97 179.06 2x1e s GLY 311 N -4.71 2.81 0.12 2.80 0.00 -1.26 -4.62 107.32 102.45 2x1e s GLY 311 Ca -0.01 -0.75 -0.04 0.00 0.00 0.00 0.00 44.72 43.92 2x1e s GLY 311 CO 0.80 -2.12 0.12 0.00 0.00 0.00 0.00 173.10 171.90 2x1e s ALA 312 N -2.83 0.44 -0.07 3.20 0.00 -0.94 -2.71 121.76 118.84 2x1e s ALA 312 Ca 0.16 -1.17 -0.30 0.00 0.00 0.00 0.00 51.96 50.65 2x1e s ALA 312 Cb 0.01 0.72 -0.05 0.00 0.00 0.00 0.00 23.12 23.80 2x1e s ALA 312 CO 0.09 -0.51 1.54 0.99 0.00 0.00 0.00 175.76 177.87 2x1e s THR 313 N -3.98 3.75 -0.13 0.00 2.01 -0.53 -2.04 115.64 114.72 2x1e s THR 313 Ca 0.17 0.93 0.17 0.00 0.31 0.00 0.00 61.69 63.27 2x1e s THR 313 Cb 0.06 -3.60 -0.24 0.00 0.01 0.00 0.00 72.50 68.73 2x1e s THR 313 CO -0.02 -0.07 0.17 0.18 -0.69 0.00 0.00 174.62 174.18 2x1e n LEU 314 N 6.83 0.00 -3.45 4.42 4.77 0.47 -3.18 117.00 126.86 2x1e n LEU 314 Ca 0.16 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 56.01 2x1e n LEU 314 Cb 0.43 0.30 -0.03 0.00 -2.33 0.00 0.00 43.42 41.79 2x1e n LEU 314 CO 0.61 0.30 0.43 0.72 -1.33 0.00 0.00 177.39 178.12 2x1e s PHE 315 N -2.70 -0.56 0.00 -1.77 -0.12 -1.22 0.51 117.98 112.12 2x1e s PHE 315 Ca -0.08 0.55 0.07 0.00 -0.05 0.00 0.00 56.93 57.41 2x1e s PHE 315 Cb 0.07 0.52 -0.02 0.00 -0.63 0.00 0.00 43.02 42.96 2x1e s PHE 315 CO 0.74 -0.76 -0.21 1.21 -0.05 0.00 0.00 175.22 176.16 2x1e s ASN 316 N -2.28 2.42 0.02 1.98 3.84 0.27 -0.69 114.94 120.49 2x1e s ASN 316 Ca -0.02 -0.42 0.04 0.00 0.21 0.00 0.00 52.86 52.67 2x1e s ASN 316 Cb -0.01 -0.25 -0.01 0.00 -0.55 0.00 0.00 41.25 40.43 2x1e s ASN 316 CO -0.06 0.22 -0.11 -0.51 -2.79 0.00 0.00 177.10 173.85 2x1e s ILE 317 N -0.58 0.89 -0.08 -5.21 2.07 -0.72 -0.88 121.20 116.70 2x1e s ILE 317 Ca 0.08 -0.72 0.01 0.00 -1.41 0.00 0.00 60.65 58.61 2x1e s ILE 317 Cb -0.08 -0.79 0.02 0.00 0.13 0.00 0.00 42.46 41.74 2x1e s ILE 317 CO 0.00 0.08 -0.08 -0.63 -1.91 0.00 0.00 174.94 172.40 2x1e s ILE 318 N -0.59 0.91 -0.30 2.00 1.01 -0.26 -1.74 121.20 122.23 2x1e s ILE 318 Ca 0.02 -0.28 -0.14 0.00 0.00 0.00 0.00 60.65 60.25 2x1e s ILE 318 Cb -0.06 -0.90 -0.03 0.00 0.01 0.00 0.00 42.46 41.47 2x1e s ILE 318 CO 0.00 0.33 0.31 -0.31 0.00 0.00 0.00 174.94 175.27 2x1e s TYR 319 N 1.27 3.23 -0.80 3.97 2.02 0.22 -0.71 117.35 126.54 2x1e s TYR 319 Ca -0.04 0.18 -0.17 0.00 -0.37 0.00 0.00 57.07 56.67 2x1e s TYR 319 Cb -0.14 -2.53 0.16 0.00 -0.40 0.00 0.00 41.96 39.05 2x1e s TYR 319 CO -0.03 -0.27 0.88 0.34 -1.57 0.00 0.00 175.55 174.91 2x1e s ASP 320 N 1.71 6.57 0.24 2.29 -1.08 0.81 -2.60 116.67 124.60 2x1e s ASP 320 Ca 0.11 -2.14 -0.06 0.00 -0.52 0.00 0.00 52.55 49.94 2x1e s ASP 320 Cb -0.16 -2.30 0.23 0.00 -1.46 0.00 0.00 42.92 39.22 2x1e s ASP 320 CO 0.11 -0.89 1.87 0.45 0.52 0.00 0.00 175.17 177.22 2x1e h HIS 321 N 8.52 1.24 -0.95 -5.34 3.86 -1.76 -0.05 115.15 120.67 2x1e h HIS 321 Ca 0.02 -0.02 0.16 0.00 -1.16 0.00 0.00 60.37 59.37 2x1e h HIS 321 Cb 1.05 -0.40 -0.10 0.00 1.06 0.00 0.00 27.41 29.02 2x1e h HIS 321 CO 1.03 0.84 0.55 0.00 0.86 0.00 0.00 177.93 181.22 2x1e h ALA 322 N 1.29 1.50 -0.02 2.45 0.00 -1.83 -2.87 119.26 119.79 2x1e h ALA 322 Ca 0.32 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.30 2x1e h ALA 322 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2x1e h ALA 322 CO -0.05 -0.01 -0.22 0.54 0.00 0.00 0.00 179.25 179.50 2x1e n ARG 323 N -4.78 1.57 -3.79 0.00 1.74 -0.84 -4.99 116.66 105.58 2x1e n ARG 323 Ca 0.20 -1.13 -0.32 0.00 -0.77 0.00 0.00 57.85 55.84 2x1e n ARG 323 Cb 0.48 -1.33 0.03 0.00 -1.02 0.00 0.00 32.46 30.62 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 0.33 -1.68 -3.98 5.56 0.63 -0.09 -5.00 116.66 112.44 2x1e n ARG 324 Ca 0.08 0.40 -0.16 0.00 -0.92 0.00 0.00 57.85 57.26 2x1e n ARG 324 Cb 0.40 -4.07 -0.15 0.00 0.45 0.00 0.00 32.46 29.09 2x1e n ARG 324 CO 0.00 0.00 0.00 -2.00 -2.51 0.00 0.00 177.63 173.12 2x1e s GLU 325 N -6.27 0.31 -0.09 -0.14 2.12 -1.04 -4.43 118.70 109.14 2x1e s GLU 325 Ca 0.36 -0.00 0.01 0.00 0.36 0.00 0.00 54.97 55.70 2x1e s GLU 325 Cb -0.14 -0.41 -0.02 0.00 0.26 0.00 0.00 34.13 33.82 2x1e s GLU 325 CO 0.88 -0.06 -0.13 0.00 -0.54 0.00 0.00 175.26 175.41 2x1e s ALA 326 N 0.61 2.68 -0.17 6.30 0.00 -0.22 -0.14 121.76 130.83 2x1e s ALA 326 Ca -0.06 -0.92 -0.03 0.00 0.00 0.00 0.00 51.96 50.94 2x1e s ALA 326 Cb -0.09 -1.13 -0.02 0.00 0.00 0.00 0.00 23.12 21.88 2x1e s ALA 326 CO -0.01 0.40 -0.05 0.99 0.00 0.00 0.00 175.76 177.09 2x1e s THR 327 N -0.18 3.67 -0.10 0.00 2.01 0.11 -0.27 115.64 120.87 2x1e s THR 327 Ca 0.00 -0.43 0.02 0.00 0.31 0.00 0.00 61.69 61.59 2x1e s THR 327 Cb -0.13 -2.62 -0.02 0.00 0.01 0.00 0.00 72.50 69.75 2x1e s THR 327 CO 0.03 0.47 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.59 2x1e s VAL 328 N 0.66 2.87 -0.17 3.82 1.01 0.14 -1.10 120.40 127.63 2x1e s VAL 328 Ca -0.03 -0.75 0.01 0.00 0.00 0.00 0.00 61.98 61.21 2x1e s VAL 328 Cb -0.15 -2.16 0.01 0.00 0.00 0.00 0.00 36.38 34.08 2x1e s VAL 328 CO 0.02 0.55 -0.17 -0.13 0.00 0.00 0.00 175.10 175.37 2x1e s ARG 329 N 0.06 3.11 0.09 2.72 0.52 -0.06 -1.51 118.95 123.88 2x1e s ARG 329 Ca -0.06 -0.79 -0.24 0.00 -0.52 0.00 0.00 55.73 54.12 2x1e s ARG 329 Cb -0.15 -2.61 -0.07 0.00 0.52 0.00 0.00 34.95 32.65 2x1e s ARG 329 CO 0.05 -0.09 0.72 -1.17 0.02 0.00 0.00 175.30 174.82 2x1e s LEU 330 N 1.06 4.51 0.00 2.53 2.96 -0.04 -0.57 118.68 129.13 2x1e s LEU 330 Ca -0.01 1.46 0.00 0.00 -0.22 0.00 0.00 54.13 55.36 2x1e s LEU 330 Cb -0.14 -3.17 0.00 0.00 0.50 0.00 0.00 46.19 43.38 2x1e s LEU 330 CO -0.05 0.13 0.00 0.61 -1.32 0.00 0.00 176.35 175.72 2x1e n GLY 331 N 2.02 -1.31 3.69 7.98 0.00 0.18 0.13 105.19 117.89 2x1e n GLY 331 Ca -0.05 -1.58 -0.41 0.00 0.00 0.00 0.00 46.02 43.98 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 4.43 0.37 1.61 0.52 -1.19 -3.51 118.95 121.18 2x1e s ARG 332 Ca 0.00 1.20 0.22 0.00 -0.52 0.00 0.00 55.73 56.63 2x1e s ARG 332 Cb 0.00 -3.51 1.21 0.00 0.52 0.00 0.00 34.95 33.17 2x1e s ARG 332 CO 0.00 -0.17 1.66 -1.35 0.02 0.00 0.00 175.30 175.46 2x1e h PRO 333 N 7.01 0.00 0.00 3.54 0.11 -1.89 0.13 132.00 140.90 2x1e h PRO 333 Ca -0.35 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.68 2x1e h PRO 333 Cb 1.17 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 2x1e h PRO 333 CO 0.80 0.00 -0.36 1.79 -0.21 0.00 0.00 178.00 180.02 2x1e h THR 334 N 0.00 1.05 -0.39 -1.15 1.35 -1.86 -3.40 112.91 108.52 2x1e h THR 334 Ca 0.00 -1.33 -0.22 0.00 -0.55 0.00 0.00 66.41 64.31 2x1e h THR 334 Cb 0.17 1.76 -0.16 0.00 -1.73 0.00 0.00 68.15 68.19 2x1e h THR 334 CO 0.00 0.35 -0.52 -3.20 -0.25 0.00 0.00 175.52 171.90 2x1e n ASN 335 N -3.81 -2.92 -4.76 5.36 5.15 0.36 -5.15 115.26 109.48 2x1e n ASN 335 Ca -0.01 -3.16 -0.37 0.00 -0.60 0.00 0.00 54.58 50.43 2x1e n ASN 335 Cb 0.43 1.69 0.01 0.00 -0.53 0.00 0.00 39.78 41.39 2x1e n ASN 335 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 2x1e s PRO 336 N 0.67 3.50 0.16 1.20 0.02 -0.68 -4.39 135.00 135.49 2x1e s PRO 336 Ca 0.32 1.86 -0.12 0.00 0.02 0.00 0.00 61.00 63.07 2x1e s PRO 336 Cb 0.16 -2.28 0.05 0.00 0.02 0.00 0.00 34.50 32.45 2x1e s PRO 336 CO -0.19 -0.79 1.69 -0.44 -0.33 0.00 0.00 177.00 176.94 2x1e h ASP 337 N 1.70 0.80 -5.02 2.53 3.32 -0.59 -3.47 116.42 115.70 2x1e h ASP 337 Ca -0.50 -0.21 0.02 0.00 0.02 0.00 0.00 57.03 56.36 2x1e h ASP 337 Cb 1.27 -0.21 -0.09 0.00 0.22 0.00 0.00 39.33 40.52 2x1e h ASP 337 CO 0.59 0.80 0.18 -1.83 -1.72 0.00 0.00 179.24 177.25 2x1e s GLU 338 N -5.40 1.51 0.02 3.56 -1.05 -1.24 -5.00 118.70 111.10 2x1e s GLU 338 Ca -0.13 -0.77 0.02 0.00 -0.15 0.00 0.00 54.97 53.95 2x1e s GLU 338 Cb 0.12 0.58 -0.01 0.00 -0.44 0.00 0.00 34.13 34.38 2x1e s GLU 338 CO 0.80 -0.67 -0.08 1.41 0.95 0.00 0.00 175.26 177.67 2x1e s MET 339 N -3.85 0.55 0.21 -4.83 1.75 -1.26 -0.86 119.30 111.02 2x1e s MET 339 Ca 0.07 -0.50 -0.19 0.00 -1.25 0.00 0.00 55.69 53.82 2x1e s MET 339 Cb -0.03 -0.45 0.03 0.00 2.84 0.00 0.00 34.83 37.22 2x1e s MET 339 CO -0.03 0.11 0.57 -0.59 -0.65 0.00 0.00 175.02 174.43 2x1e s PHE 340 N -0.74 -0.17 0.13 4.11 -0.12 -0.57 -5.01 117.98 115.62 2x1e s PHE 340 Ca -0.03 -0.18 0.09 0.00 -0.05 0.00 0.00 56.93 56.77 2x1e s PHE 340 Cb -0.06 0.47 -0.04 0.00 -0.63 0.00 0.00 43.02 42.76 2x1e s PHE 340 CO 0.00 -0.97 -0.19 0.14 -0.05 0.00 0.00 175.22 174.15 2x1e s VAL 341 N -3.87 2.77 -0.06 -2.49 -7.23 -1.26 -0.69 120.40 107.57 2x1e s VAL 341 Ca 0.09 -1.61 0.06 0.00 -1.81 0.00 0.00 61.98 58.71 2x1e s VAL 341 Cb -0.02 -2.29 -0.01 0.00 0.56 0.00 0.00 36.38 34.63 2x1e s VAL 341 CO -0.02 0.05 -0.24 -0.04 -0.31 0.00 0.00 175.10 174.54 2x1e s MET 342 N -2.28 2.48 0.19 4.82 -1.94 0.63 -4.97 119.30 118.22 2x1e s MET 342 Ca 0.19 -0.86 -0.14 0.00 -1.71 0.00 0.00 55.69 53.17 2x1e s MET 342 Cb -0.10 -2.08 0.01 0.00 2.01 0.00 0.00 34.83 34.67 2x1e s MET 342 CO 0.10 0.34 0.42 -0.98 -0.01 0.00 0.00 175.02 174.89 2x1e s ARG 343 N -0.08 1.30 -0.14 2.03 1.70 -1.26 -1.05 118.95 121.44 2x1e s ARG 343 Ca -0.05 -1.02 -0.07 0.00 -0.47 0.00 0.00 55.73 54.12 2x1e s ARG 343 Cb -0.14 0.46 -0.04 0.00 -0.57 0.00 0.00 34.95 34.66 2x1e s ARG 343 CO 0.04 -0.52 0.12 -0.06 -1.08 0.00 0.00 175.30 173.80 2x1e s PHE 344 N -3.92 3.51 0.49 5.89 0.08 -1.26 -5.10 117.98 117.66 2x1e s PHE 344 Ca 0.13 0.44 0.07 0.00 0.12 0.00 0.00 56.93 57.69 2x1e s PHE 344 Cb 0.01 -1.98 0.08 0.00 -0.57 0.00 0.00 43.02 40.56 2x1e s PHE 344 CO -0.01 0.60 0.67 -0.40 -0.10 0.00 0.00 175.22 175.98 2x1e n ASP 345 N 2.38 1.67 0.19 1.36 5.75 -1.26 -4.98 116.55 121.67 2x1e n ASP 345 Ca -0.19 -2.23 0.04 0.00 -0.01 0.00 0.00 54.79 52.40 2x1e n ASP 345 Cb 0.54 -0.37 0.38 0.00 -1.03 0.00 0.00 41.12 40.65 2x1e n ASP 345 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 2x1e h GLU 346 N 0.00 0.00 -0.24 0.11 5.08 -1.99 -2.36 114.58 115.19 2x1e h GLU 346 Ca -0.23 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.00 2x1e h GLU 346 Cb 1.02 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.26 2x1e h GLU 346 CO 0.31 0.36 -0.40 0.93 -1.00 0.00 0.00 179.01 179.21 2x1e h GLU 347 N 0.00 0.56 -0.95 2.33 4.39 -1.98 0.27 114.58 119.21 2x1e h GLU 347 Ca -0.00 -0.29 0.04 0.00 0.34 0.00 0.00 59.36 59.45 2x1e h GLU 347 Cb 0.67 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 29.27 2x1e h GLU 347 CO 0.05 0.87 0.62 -0.44 -1.16 0.00 0.00 179.01 178.94 2x1e h ASP 348 N 0.46 1.02 -0.04 1.42 3.32 -1.82 -1.23 116.42 119.55 2x1e h ASP 348 Ca 0.04 -0.01 -0.23 0.00 0.02 0.00 0.00 57.03 56.85 2x1e h ASP 348 Cb 0.90 -0.23 0.01 0.00 0.22 0.00 0.00 39.33 40.23 2x1e h ASP 348 CO 0.08 0.70 -0.85 -0.33 -1.72 0.00 0.00 179.24 177.12 2x1e h GLU 349 N 1.19 0.71 -0.61 3.56 5.08 -1.15 -2.65 114.58 120.71 2x1e h GLU 349 Ca 0.38 -0.63 0.05 0.00 -1.00 0.00 0.00 59.36 58.15 2x1e h GLU 349 Cb 0.00 0.15 -0.05 0.00 0.50 0.00 0.00 28.75 29.35 2x1e h GLU 349 CO -0.12 1.24 0.34 -0.09 -1.00 0.00 0.00 179.01 179.37 2x1e h ARG 350 N 0.46 0.62 -0.25 2.33 2.43 -0.24 -1.86 114.38 117.87 2x1e h ARG 350 Ca -0.07 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.08 2x1e h ARG 350 Cb 1.48 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.87 2x1e h ARG 350 CO 0.17 0.41 0.13 1.03 -1.51 0.00 0.00 179.97 180.20 2x1e h SER 351 N 0.64 0.20 -0.00 -3.80 0.87 -1.22 -1.53 113.55 108.71 2x1e h SER 351 Ca 0.27 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.82 2x1e h SER 351 Cb 0.14 -0.03 -0.00 0.00 -0.44 0.00 0.00 62.40 62.06 2x1e h SER 351 CO -0.16 0.15 -0.02 0.00 -0.53 0.00 0.00 176.83 176.27 2x1e h ALA 352 N 1.12 1.85 0.00 6.23 0.00 -1.07 -0.76 119.26 126.62 2x1e h ALA 352 Ca 0.10 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2x1e h ALA 352 Cb 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2x1e h ALA 352 CO -0.06 0.12 -0.35 1.28 0.00 0.00 0.00 179.25 180.23 2x1e n LEU 353 N -4.46 0.43 -3.62 0.00 4.77 -0.74 -3.71 117.00 109.68 2x1e n LEU 353 Ca -0.02 0.23 -0.21 0.00 -0.03 0.00 0.00 56.01 55.98 2x1e n LEU 353 Cb 0.14 -0.31 0.06 0.00 -2.33 0.00 0.00 43.42 40.98 2x1e n LEU 353 CO 0.35 0.03 0.05 -3.20 -1.33 0.00 0.00 177.39 173.29 2x1e n ASN 354 N -1.69 -2.49 -0.37 -1.43 5.15 -0.42 -4.75 115.26 109.26 2x1e n ASN 354 Ca 0.05 -0.71 0.05 0.00 -0.60 0.00 0.00 54.58 53.37 2x1e n ASN 354 Cb 0.37 -4.52 0.04 0.00 -0.53 0.00 0.00 39.78 35.13 2x1e n ASN 354 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66