#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 3.15 -3.96 -0.89 7.94 -1.26 -4.85 117.00 117.12 2x1e n LEU 2 Ca 0.00 1.05 -0.30 0.00 -1.11 0.00 0.00 56.01 55.65 2x1e n LEU 2 Cb 0.00 -1.40 -0.16 0.00 0.53 0.00 0.00 43.42 42.39 2x1e n LEU 2 CO 0.00 -0.24 -0.45 -2.28 -1.11 0.00 0.00 177.39 173.31 2x1e s HIS 3 N 1.97 2.16 -0.15 1.96 5.65 -1.26 -0.72 115.29 124.90 2x1e s HIS 3 Ca 0.84 -1.40 -0.02 0.00 0.25 0.00 0.00 55.06 54.73 2x1e s HIS 3 Cb -0.70 -1.53 -0.02 0.00 -1.18 0.00 0.00 32.58 29.15 2x1e s HIS 3 CO 0.43 -0.70 -0.08 0.42 -0.65 0.00 0.00 174.74 174.16 2x1e s ILE 4 N 1.48 3.39 -0.32 0.89 1.01 -0.35 -5.00 121.20 122.30 2x1e s ILE 4 Ca -0.00 -0.53 -0.18 0.00 0.00 0.00 0.00 60.65 59.94 2x1e s ILE 4 Cb -0.16 -2.47 -0.01 0.00 0.01 0.00 0.00 42.46 39.83 2x1e s ILE 4 CO -0.08 0.50 0.49 -0.22 0.00 0.00 0.00 174.94 175.62 2x1e s LEU 5 N 0.55 4.23 -0.13 2.97 2.96 -1.26 -0.87 118.68 127.13 2x1e s LEU 5 Ca -0.06 0.14 -0.00 0.00 -0.22 0.00 0.00 54.13 53.99 2x1e s LEU 5 Cb -0.15 -2.57 -0.02 0.00 0.50 0.00 0.00 46.19 43.95 2x1e s LEU 5 CO 0.03 -0.39 -0.12 0.00 -1.32 0.00 0.00 176.35 174.55 2x1e s GLN 7 N 0.28 0.85 0.00 0.00 -2.07 -1.26 -0.78 119.66 116.68 2x1e s GLN 7 Ca -0.09 -0.52 0.00 0.00 -1.82 0.00 0.00 55.36 52.94 2x1e s GLN 7 Cb -0.15 0.37 0.00 0.00 -1.09 0.00 0.00 33.01 32.13 2x1e s GLN 7 CO 0.05 -0.28 0.00 0.41 -1.32 0.00 0.00 175.29 174.15 2x1e n GLY 8 N 0.48 0.26 3.73 2.60 0.00 -1.24 -4.19 105.19 106.82 2x1e n GLY 8 Ca -0.18 -1.89 -0.30 0.00 0.00 0.00 0.00 46.02 43.64 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 2.90 0.23 2.61 -4.23 -1.26 -4.74 115.64 111.15 2x1e s THR 9 Ca 0.00 0.29 -0.07 0.00 -1.18 0.00 0.00 61.69 60.73 2x1e s THR 9 Cb 0.00 -2.72 0.20 0.00 1.34 0.00 0.00 72.50 71.31 2x1e s THR 9 CO 0.00 -0.38 1.71 -0.65 -0.54 0.00 0.00 174.62 174.76 2x1e h PRO 10 N -1.41 0.32 -0.72 3.99 0.11 -1.93 0.42 132.00 132.77 2x1e h PRO 10 Ca -0.46 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 65.66 2x1e h PRO 10 Cb 1.26 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.25 2x1e h PRO 10 CO 0.52 0.21 0.46 0.35 -0.21 0.00 0.00 178.00 179.32 2x1e h PHE 11 N 0.33 0.86 -0.42 0.65 3.57 -1.89 -0.86 116.94 119.18 2x1e h PHE 11 Ca 0.37 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.78 2x1e h PHE 11 Cb 0.58 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 39.02 2x1e h PHE 11 CO -0.22 0.49 -0.19 0.93 -2.23 0.00 0.00 178.31 177.10 2x1e h GLU 12 N 0.90 0.81 0.11 1.11 5.08 -1.68 0.15 114.58 121.06 2x1e h GLU 12 Ca 0.29 -0.31 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2x1e h GLU 12 Cb 0.01 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.21 2x1e h GLU 12 CO -0.11 0.94 -0.05 0.82 -1.00 0.00 0.00 179.01 179.61 2x1e h ILE 13 N 0.72 0.89 -0.64 3.13 2.04 -0.62 -1.77 117.51 121.26 2x1e h ILE 13 Ca 0.11 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.97 2x1e h ILE 13 Cb 0.70 0.89 -0.03 0.00 -0.74 0.00 0.00 36.82 37.63 2x1e h ILE 13 CO 0.05 0.00 0.40 1.23 0.00 0.00 0.00 178.15 179.83 2x1e h GLY 14 N -0.15 0.92 0.92 5.37 0.00 -0.93 -2.86 103.07 106.34 2x1e h GLY 14 Ca -0.01 -0.37 0.02 0.00 0.00 0.00 0.00 47.33 46.97 2x1e h GLY 14 CO 0.02 0.36 0.43 -1.82 0.00 0.00 0.00 176.54 175.52 2x1e h TYR 15 N 0.86 0.80 -0.34 5.60 5.03 -0.77 0.10 116.97 128.25 2x1e h TYR 15 Ca 0.23 0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.54 2x1e h TYR 15 Cb -0.05 -0.27 -0.02 0.00 1.55 0.00 0.00 36.73 37.95 2x1e h TYR 15 CO -0.02 0.48 0.14 1.49 -1.32 0.00 0.00 178.16 178.92 2x1e h GLU 16 N 0.85 0.51 0.09 1.82 4.57 -1.19 0.99 114.58 122.22 2x1e h GLU 16 Ca 0.26 -0.09 0.02 0.00 -1.18 0.00 0.00 59.36 58.36 2x1e h GLU 16 Cb -0.03 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 28.45 2x1e h GLU 16 CO -0.09 0.51 -0.20 1.25 -1.18 0.00 0.00 179.01 179.30 2x1e h HIS 17 N 0.41 -0.52 -0.55 0.92 2.76 -1.27 -1.07 115.15 115.82 2x1e h HIS 17 Ca 0.11 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.29 2x1e h HIS 17 Cb 0.19 0.22 -0.03 0.00 1.55 0.00 0.00 27.41 29.34 2x1e h HIS 17 CO -0.00 -0.29 0.30 0.78 -1.30 0.00 0.00 177.93 177.42 2x1e h GLY 18 N -0.37 0.81 0.68 5.26 0.00 -0.59 -1.73 103.07 107.14 2x1e h GLY 18 Ca 0.03 -0.37 -0.01 0.00 0.00 0.00 0.00 47.33 46.98 2x1e h GLY 18 CO -0.13 0.35 -0.14 1.76 0.00 0.00 0.00 176.54 178.38 2x1e h SER 19 N 0.74 -0.33 0.87 0.19 0.02 -0.74 -1.97 113.55 112.33 2x1e h SER 19 Ca 0.19 -0.18 -0.03 0.00 -0.84 0.00 0.00 61.79 60.93 2x1e h SER 19 Cb 0.04 0.09 -0.00 0.00 0.14 0.00 0.00 62.40 62.66 2x1e h SER 19 CO -0.03 0.02 -0.16 0.00 -1.14 0.00 0.00 176.83 175.52 2x1e h ALA 20 N -0.14 1.05 -0.24 3.77 0.00 -1.22 -2.88 119.26 119.60 2x1e h ALA 20 Ca -0.04 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 2x1e h ALA 20 Cb 0.49 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2x1e h ALA 20 CO 0.07 0.20 -0.02 0.00 0.00 0.00 0.00 179.25 179.50 2x1e n ALA 21 N -2.20 3.18 -0.18 0.00 0.00 -0.65 -4.84 120.51 115.82 2x1e n ALA 21 Ca -0.00 -2.55 -0.08 0.00 0.00 0.00 0.00 53.44 50.81 2x1e n ALA 21 Cb 0.38 -0.67 -0.03 0.00 0.00 0.00 0.00 19.45 19.12 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 1.35 -0.24 -0.17 0.00 3.64 -1.12 0.11 116.57 120.13 2x1e h LYS 22 Ca 0.05 0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.37 2x1e h LYS 22 Cb 1.43 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.29 2x1e h LYS 22 CO 0.23 -0.16 -0.23 0.00 -2.27 0.00 0.00 179.45 177.01 2x1e h ALA 23 N 0.61 1.29 -0.30 5.00 0.00 -1.87 -2.38 119.26 121.61 2x1e h ALA 23 Ca 0.17 -0.30 -0.14 0.00 0.00 0.00 0.00 54.91 54.64 2x1e h ALA 23 Cb 0.57 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 2x1e h ALA 23 CO -0.64 0.48 -0.37 0.28 0.00 0.00 0.00 179.25 179.00 2x1e h VAL 24 N 0.28 1.29 -0.93 0.00 2.07 -1.49 -2.94 116.25 114.54 2x1e h VAL 24 Ca 0.05 -1.55 0.00 0.00 0.82 0.00 0.00 66.70 66.02 2x1e h VAL 24 Cb 0.57 1.58 -0.05 0.00 -1.52 0.00 0.00 31.29 31.88 2x1e h VAL 24 CO 0.04 0.50 0.58 0.40 0.02 0.00 0.00 177.57 179.12 2x1e h ILE 25 N 0.54 1.25 -0.92 4.57 2.04 -0.56 -0.39 117.51 124.04 2x1e h ILE 25 Ca 0.04 -0.50 0.10 0.00 1.00 0.00 0.00 64.86 65.50 2x1e h ILE 25 Cb 0.96 -0.09 -0.08 0.00 -0.74 0.00 0.00 36.82 36.87 2x1e h ILE 25 CO 0.09 0.25 0.56 0.00 0.00 0.00 0.00 178.15 179.05 2x1e h ALA 26 N 1.32 1.34 -0.35 1.87 0.00 -1.40 0.50 119.26 122.54 2x1e h ALA 26 Ca 0.34 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 55.15 2x1e h ALA 26 Cb -0.09 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 2x1e h ALA 26 CO -0.07 0.19 -0.24 0.00 0.00 0.00 0.00 179.25 179.13 2x1e h ARG 27 N 0.91 0.77 -0.32 0.00 3.08 -1.11 -1.38 114.38 116.33 2x1e h ARG 27 Ca 0.44 -0.37 0.05 0.00 0.07 0.00 0.00 59.98 60.18 2x1e h ARG 27 Cb 0.40 -0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.39 2x1e h ARG 27 CO -0.25 0.99 0.04 0.77 -1.07 0.00 0.00 179.97 180.45 2x1e h SER 28 N 0.56 -0.04 -0.32 7.04 0.02 -0.49 -0.35 113.55 119.97 2x1e h SER 28 Ca 0.07 0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 61.06 2x1e h SER 28 Cb 0.80 0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.41 2x1e h SER 28 CO 0.06 0.02 0.14 0.40 -1.14 0.00 0.00 176.83 176.31 2x1e h ILE 29 N 0.15 1.17 -0.19 3.27 2.04 -0.87 -0.68 117.51 122.40 2x1e h ILE 29 Ca 0.15 -0.51 0.05 0.00 1.00 0.00 0.00 64.86 65.54 2x1e h ILE 29 Cb 0.18 0.93 -0.05 0.00 -0.74 0.00 0.00 36.82 37.15 2x1e h ILE 29 CO -0.22 0.18 -0.10 0.44 0.00 0.00 0.00 178.15 178.45 2x1e h ASP 30 N 0.37 -0.34 -0.38 1.72 3.32 -0.93 0.14 116.42 120.32 2x1e h ASP 30 Ca 0.11 0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.23 2x1e h ASP 30 Cb 0.16 0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.87 2x1e h ASP 30 CO -0.01 -0.14 0.22 0.15 -1.72 0.00 0.00 179.24 177.75 2x1e h PHE 31 N -0.09 0.50 -0.79 4.55 3.57 -0.90 -2.14 116.94 121.65 2x1e h PHE 31 Ca 0.11 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.60 2x1e h PHE 31 Cb 0.25 -0.16 -0.04 0.00 2.79 0.00 0.00 35.95 38.78 2x1e h PHE 31 CO -0.26 0.37 0.49 0.00 -2.23 0.00 0.00 178.31 176.68 2x1e h ALA 32 N 1.09 1.01 -0.34 2.41 0.00 -0.76 -1.33 119.26 121.33 2x1e h ALA 32 Ca 0.13 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2x1e h ALA 32 Cb 0.02 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 2x1e h ALA 32 CO -0.02 0.46 0.22 0.28 0.00 0.00 0.00 179.25 180.19 2x1e h VAL 33 N 1.08 1.08 -0.09 0.00 2.07 -0.46 0.11 116.25 120.05 2x1e h VAL 33 Ca 0.28 -0.16 0.02 0.00 0.82 0.00 0.00 66.70 67.67 2x1e h VAL 33 Cb -0.06 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 2x1e h VAL 33 CO -0.06 0.08 -0.03 0.44 0.02 0.00 0.00 177.57 178.02 2x1e h ASP 34 N 0.46 -0.12 0.03 0.57 3.32 -1.20 -0.50 116.42 118.98 2x1e h ASP 34 Ca 0.13 0.03 0.02 0.00 0.02 0.00 0.00 57.03 57.23 2x1e h ASP 34 Cb -0.05 0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.55 2x1e h ASP 34 CO -0.03 -0.05 -0.13 0.25 -1.72 0.00 0.00 179.24 177.56 2x1e h LEU 35 N -0.02 -0.39 -0.52 1.55 6.46 -0.98 -2.43 115.31 118.98 2x1e h LEU 35 Ca 0.05 0.05 0.04 0.00 -0.12 0.00 0.00 57.88 57.90 2x1e h LEU 35 Cb 0.09 0.16 -0.04 0.00 -0.73 0.00 0.00 40.66 40.14 2x1e h LEU 35 CO -0.10 -0.19 0.28 0.40 -0.62 0.00 0.00 178.44 178.20 2x1e h ILE 36 N -0.24 0.98 0.00 4.05 1.08 -0.66 -2.07 117.51 120.65 2x1e h ILE 36 Ca 0.04 -0.18 -0.02 0.00 -0.39 0.00 0.00 64.86 64.30 2x1e h ILE 36 Cb 0.29 0.39 -0.00 0.00 -3.07 0.00 0.00 36.82 34.43 2x1e h ILE 36 CO -0.11 0.10 -0.12 0.03 -0.69 0.00 0.00 178.15 177.36 2x1e h ARG 37 N 0.54 0.00 0.00 2.37 3.08 -0.96 -1.21 114.38 118.20 2x1e h ARG 37 Ca 0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.27 2x1e h ARG 37 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.16 2x1e h ARG 37 CO -0.14 0.12 0.00 0.41 -1.07 0.00 0.00 179.97 179.28 2x1e n GLY 38 N -1.04 -1.12 0.59 0.04 0.00 -0.78 -3.46 105.19 99.41 2x1e n GLY 38 Ca -0.02 -0.04 0.08 0.00 0.00 0.00 0.00 46.02 46.03 2x1e n GLY 38 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2x1e n LYS 39 N -1.62 1.21 -3.82 1.61 4.76 -0.46 -5.04 118.16 114.80 2x1e n LYS 39 Ca 0.04 -1.36 -0.10 0.00 -2.87 0.00 0.00 58.31 54.03 2x1e n LYS 39 Cb 0.21 -1.29 -0.07 0.00 -1.84 0.00 0.00 35.03 32.03 2x1e n LYS 39 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 2x1e s THR 40 N -1.34 0.12 -1.42 -0.18 -1.32 -1.23 -3.21 115.64 107.07 2x1e s THR 40 Ca 0.17 -1.01 0.15 0.00 -1.21 0.00 0.00 61.69 59.80 2x1e s THR 40 Cb 0.13 -1.20 0.01 0.00 -1.51 0.00 0.00 72.50 69.93 2x1e s THR 40 CO 0.21 -0.56 0.83 0.29 -2.21 0.00 0.00 174.62 173.18 2x1e n LYS 41 N 0.13 1.70 -1.89 7.08 4.76 -1.26 -4.92 118.16 123.76 2x1e n LYS 41 Ca -0.16 -0.83 -0.38 0.00 -2.87 0.00 0.00 58.31 54.06 2x1e n LYS 41 Cb 0.62 -1.24 0.03 0.00 -1.84 0.00 0.00 35.03 32.59 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 -1.74 3.25 0.80 1.97 1.02 -1.26 -5.02 119.74 118.77 2x1e s LYS 42 Ca 0.13 2.12 -0.10 0.00 0.02 0.00 0.00 55.97 58.14 2x1e s LYS 42 Cb 0.12 -2.27 0.08 0.00 -0.52 0.00 0.00 37.83 35.24 2x1e s LYS 42 CO 0.36 -1.06 1.10 0.95 -0.92 0.00 0.00 175.35 175.78 2x1e s THR 43 N -1.36 3.05 0.27 2.17 -4.23 -1.26 -4.89 115.64 109.38 2x1e s THR 43 Ca 0.70 0.34 -0.04 0.00 -1.18 0.00 0.00 61.69 61.51 2x1e s THR 43 Cb -0.38 -2.73 0.23 0.00 1.34 0.00 0.00 72.50 70.97 2x1e s THR 43 CO 0.44 -0.45 1.91 0.44 -0.54 0.00 0.00 174.62 176.43 2x1e h ASP 44 N -1.29 1.04 -0.62 3.99 3.32 -1.99 -2.18 116.42 118.69 2x1e h ASP 44 Ca -0.43 -0.06 0.07 0.00 0.02 0.00 0.00 57.03 56.62 2x1e h ASP 44 Cb 1.24 -0.26 -0.06 0.00 0.22 0.00 0.00 39.33 40.47 2x1e h ASP 44 CO 0.49 0.80 0.30 -0.33 -1.72 0.00 0.00 179.24 178.79 2x1e h GLU 45 N 1.19 0.54 -0.46 3.56 3.07 -1.99 0.15 114.58 120.63 2x1e h GLU 45 Ca 0.31 -0.03 -0.05 0.00 -0.50 0.00 0.00 59.36 59.09 2x1e h GLU 45 Cb -0.04 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 27.73 2x1e h GLU 45 CO -0.06 0.36 0.11 1.49 -1.40 0.00 0.00 179.01 179.51 2x1e h GLU 46 N 0.56 0.73 -0.84 2.33 4.81 -1.86 -2.42 114.58 117.88 2x1e h GLU 46 Ca 0.29 -0.18 0.04 0.00 -0.13 0.00 0.00 59.36 59.38 2x1e h GLU 46 Cb 0.25 -0.10 -0.05 0.00 0.63 0.00 0.00 28.75 29.48 2x1e h GLU 46 CO -0.22 0.73 0.54 -0.07 -0.73 0.00 0.00 179.01 179.26 2x1e h LEU 47 N 0.61 0.89 -0.72 1.64 3.38 -0.75 -1.52 115.31 118.84 2x1e h LEU 47 Ca 0.14 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.15 2x1e h LEU 47 Cb 0.33 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.83 2x1e h LEU 47 CO 0.00 0.61 0.44 0.11 0.09 0.00 0.00 178.44 179.69 2x1e h LYS 48 N 1.04 0.83 -0.62 1.13 1.79 -0.51 -1.75 116.57 118.48 2x1e h LYS 48 Ca 0.34 -0.05 -0.07 0.00 -2.18 0.00 0.00 60.65 58.69 2x1e h LYS 48 Cb 0.02 -0.19 -0.02 0.00 -1.58 0.00 0.00 32.23 30.46 2x1e h LYS 48 CO -0.12 0.55 0.11 1.96 -1.08 0.00 0.00 179.45 180.86 2x1e h GLN 49 N 0.85 1.03 -0.57 3.15 1.08 -0.93 -0.65 115.11 119.06 2x1e h GLN 49 Ca 0.30 -0.27 0.03 0.00 -1.45 0.00 0.00 58.65 57.26 2x1e h GLN 49 Cb 0.06 -0.12 -0.04 0.00 -0.05 0.00 0.00 27.48 27.33 2x1e h GLN 49 CO -0.13 0.95 0.34 0.28 -0.95 0.00 0.00 178.83 179.32 2x1e h VAL 50 N 0.94 1.04 -0.37 -0.54 2.07 -1.01 -0.85 116.25 117.52 2x1e h VAL 50 Ca 0.19 -0.23 -0.06 0.00 0.82 0.00 0.00 66.70 67.42 2x1e h VAL 50 Cb 0.42 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 2x1e h VAL 50 CO 0.01 0.12 -0.03 -0.07 0.02 0.00 0.00 177.57 177.62 2x1e h LEU 51 N 0.66 0.57 -0.51 2.57 3.38 -1.03 -0.33 115.31 120.61 2x1e h LEU 51 Ca 0.24 -0.12 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 2x1e h LEU 51 Cb 0.06 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 2x1e h LEU 51 CO -0.12 0.66 0.13 -1.28 0.09 0.00 0.00 178.44 177.92 2x1e h SER 52 N 0.57 0.77 -0.35 -0.43 0.87 -0.68 0.11 113.55 114.41 2x1e h SER 52 Ca 0.12 -0.23 0.02 0.00 -1.23 0.00 0.00 61.79 60.47 2x1e h SER 52 Cb 0.40 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 62.13 2x1e h SER 52 CO 0.02 0.80 0.19 1.56 -0.53 0.00 0.00 176.83 178.87 2x1e h GLN 53 N 0.71 0.38 -0.71 2.24 4.20 -0.61 -1.64 115.11 119.68 2x1e h GLN 53 Ca 0.16 -0.02 -0.06 0.00 0.06 0.00 0.00 58.65 58.79 2x1e h GLN 53 Cb 0.32 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.99 2x1e h GLN 53 CO 0.00 0.25 0.21 -0.07 -0.67 0.00 0.00 178.83 178.56 2x1e h LEU 54 N 0.39 1.04 -0.72 1.46 3.38 -0.88 -2.52 115.31 117.46 2x1e h LEU 54 Ca 0.14 -0.21 0.08 0.00 0.09 0.00 0.00 57.88 57.98 2x1e h LEU 54 Cb 0.02 -0.27 -0.07 0.00 0.09 0.00 0.00 40.66 40.43 2x1e h LEU 54 CO -0.08 0.98 0.38 1.23 0.09 0.00 0.00 178.44 181.04 2x1e h GLY 55 N 1.05 1.07 1.47 0.83 0.00 -0.63 -1.98 103.07 104.88 2x1e h GLY 55 Ca 0.23 -0.25 -0.04 0.00 0.00 0.00 0.00 47.33 47.27 2x1e h GLY 55 CO -0.01 0.11 0.12 3.21 0.00 0.00 0.00 176.54 179.97 2x1e h ARG 56 N 0.67 0.67 -0.23 4.80 3.08 -0.95 -0.17 114.38 122.24 2x1e h ARG 56 Ca 0.34 -0.12 -0.01 0.00 0.07 0.00 0.00 59.98 60.26 2x1e h ARG 56 Cb 0.30 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 2x1e h ARG 56 CO -0.23 0.61 0.11 0.28 -1.07 0.00 0.00 179.97 179.67 2x1e h VAL 57 N 0.65 1.14 -0.58 2.04 2.07 -1.01 -1.50 116.25 119.06 2x1e h VAL 57 Ca 0.15 -0.38 -0.10 0.00 0.82 0.00 0.00 66.70 67.18 2x1e h VAL 57 Cb 0.24 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 2x1e h VAL 57 CO -0.00 0.13 -0.04 0.40 0.02 0.00 0.00 177.57 178.08 2x1e h ILE 58 N 0.25 1.27 -0.43 4.57 2.04 -1.01 0.39 117.51 124.58 2x1e h ILE 58 Ca 0.08 -1.19 0.01 0.00 1.00 0.00 0.00 64.86 64.76 2x1e h ILE 58 Cb 0.11 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 37.03 2x1e h ILE 58 CO -0.01 0.43 0.27 -0.08 0.00 0.00 0.00 178.15 178.76 2x1e h GLU 59 N 0.94 0.53 -0.05 2.37 4.81 -0.97 0.13 114.58 122.34 2x1e h GLU 59 Ca 0.16 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.34 2x1e h GLU 59 Cb 0.60 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.86 2x1e h GLU 59 CO 0.04 0.35 -0.03 0.93 -0.73 0.00 0.00 179.01 179.57 2x1e h GLU 60 N 0.55 0.11 0.17 1.92 4.39 -1.07 -3.25 114.58 117.40 2x1e h GLU 60 Ca 0.16 -0.05 -0.33 0.00 0.34 0.00 0.00 59.36 59.48 2x1e h GLU 60 Cb -0.03 -0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.63 2x1e h GLU 60 CO -0.06 0.52 -1.60 0.00 -1.16 0.00 0.00 179.01 176.72 2x1e h ARG 61 N -0.29 0.36 -2.07 2.33 3.08 -0.86 -3.40 114.38 113.52 2x1e h ARG 61 Ca 0.01 -0.61 -0.56 0.00 0.07 0.00 0.00 59.98 58.88 2x1e h ARG 61 Cb 0.49 0.23 -0.40 0.00 0.08 0.00 0.00 29.97 30.37 2x1e h ARG 61 CO 0.01 1.26 -0.94 0.91 -1.07 0.00 0.00 179.97 180.14 2x1e n TRP 62 N -3.56 1.17 -0.29 3.04 8.01 0.43 -4.97 117.44 121.27 2x1e n TRP 62 Ca -0.19 -3.79 0.14 0.00 -1.31 0.00 0.00 57.50 52.34 2x1e n TRP 62 Cb 1.07 -0.43 0.39 0.00 -2.01 0.00 0.00 31.31 30.33 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 3.87 0.63 -0.69 -0.99 0.13 -1.62 0.42 132.00 133.74 2x1e h PRO 63 Ca 0.12 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 65.20 2x1e h PRO 63 Cb 0.80 -0.14 -0.03 0.00 0.13 0.00 0.00 31.00 31.76 2x1e h PRO 63 CO 0.60 0.42 0.41 -0.22 -0.23 0.00 0.00 178.00 178.98 2x1e h LYS 64 N 0.65 0.94 -0.06 0.86 3.64 -1.90 0.29 116.57 120.99 2x1e h LYS 64 Ca 0.49 -0.09 -0.18 0.00 -1.27 0.00 0.00 60.65 59.60 2x1e h LYS 64 Cb 0.88 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.49 2x1e h LYS 64 CO -0.24 0.68 -0.74 1.88 -2.27 0.00 0.00 179.45 178.75 2x1e h TYR 65 N 0.94 0.45 -0.55 1.91 0.05 -1.35 -2.89 116.97 115.53 2x1e h TYR 65 Ca 0.25 -0.20 -0.06 0.00 0.05 0.00 0.00 58.73 58.77 2x1e h TYR 65 Cb -0.02 -0.07 -0.02 0.00 1.01 0.00 0.00 36.73 37.63 2x1e h TYR 65 CO -0.01 0.95 0.12 -0.92 -1.05 0.00 0.00 178.16 177.25 2x1e h TYR 66 N 0.22 0.94 -0.88 4.88 3.20 -0.65 -1.17 116.97 123.51 2x1e h TYR 66 Ca -0.03 -0.12 0.04 0.00 3.14 0.00 0.00 58.73 61.76 2x1e h TYR 66 Cb 1.31 -0.26 -0.05 0.00 1.54 0.00 0.00 36.73 39.27 2x1e h TYR 66 CO 0.04 0.82 0.57 0.93 -1.64 0.00 0.00 178.16 178.87 2x1e h GLU 67 N 0.79 1.06 -0.46 1.82 5.08 -0.93 0.16 114.58 122.11 2x1e h GLU 67 Ca 0.17 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.43 2x1e h GLU 67 Cb 0.37 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 2x1e h GLU 67 CO 0.01 0.70 0.14 1.49 -1.00 0.00 0.00 179.01 180.35 2x1e h GLU 68 N 1.09 0.71 -0.60 2.33 4.81 -1.28 -1.30 114.58 120.33 2x1e h GLU 68 Ca 0.35 -0.15 0.04 0.00 -0.13 0.00 0.00 59.36 59.47 2x1e h GLU 68 Cb 0.02 -0.10 -0.05 0.00 0.63 0.00 0.00 28.75 29.25 2x1e h GLU 68 CO -0.12 0.68 0.34 0.82 -0.73 0.00 0.00 179.01 180.00 2x1e h ILE 69 N 0.60 1.00 -0.96 2.32 2.04 -0.59 -0.40 117.51 121.53 2x1e h ILE 69 Ca 0.15 -0.22 0.05 0.00 1.00 0.00 0.00 64.86 65.83 2x1e h ILE 69 Cb 0.26 0.29 -0.06 0.00 -0.74 0.00 0.00 36.82 36.58 2x1e h ILE 69 CO -0.01 0.12 0.62 0.03 0.00 0.00 0.00 178.15 178.91 2x1e h ARG 70 N 0.65 1.14 -0.48 2.37 3.08 -0.38 -1.30 114.38 119.47 2x1e h ARG 70 Ca 0.26 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 60.21 2x1e h ARG 70 Cb 0.11 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 29.89 2x1e h ARG 70 CO -0.15 0.75 0.19 0.78 -1.07 0.00 0.00 179.97 180.48 2x1e h GLY 71 N 1.17 0.77 0.79 0.04 0.00 -0.58 -1.00 103.07 104.26 2x1e h GLY 71 Ca 0.39 -0.42 0.02 0.00 0.00 0.00 0.00 47.33 47.32 2x1e h GLY 71 CO -0.14 0.40 -0.06 -2.22 0.00 0.00 0.00 176.54 174.51 2x1e h ILE 72 N 0.64 0.82 -0.54 2.60 2.04 -0.71 0.59 117.51 122.95 2x1e h ILE 72 Ca 0.16 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.10 2x1e h ILE 72 Cb 0.20 0.82 -0.07 0.00 -0.74 0.00 0.00 36.82 37.04 2x1e h ILE 72 CO -0.01 0.00 0.17 0.00 0.00 0.00 0.00 178.15 178.31 2x1e h ALA 73 N 0.93 0.66 0.09 1.87 0.00 -1.16 0.11 119.26 121.76 2x1e h ALA 73 Ca 0.04 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2x1e h ALA 73 Cb 0.15 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2x1e h ALA 73 CO -0.09 -0.23 -0.04 -0.22 0.00 0.00 0.00 179.25 178.66 2x1e h LYS 74 N 0.34 -0.12 -0.48 0.00 1.63 -0.82 0.07 116.57 117.19 2x1e h LYS 74 Ca 0.27 0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 60.05 2x1e h LYS 74 Cb 0.32 0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 31.96 2x1e h LYS 74 CO -0.29 0.11 0.20 0.78 -3.45 0.00 0.00 179.45 176.79 2x1e h GLY 75 N -0.33 0.72 0.87 5.01 0.00 -0.68 -2.46 103.07 106.20 2x1e h GLY 75 Ca -0.01 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 46.97 2x1e h GLY 75 CO 0.02 0.33 -0.28 0.00 0.00 0.00 0.00 176.54 176.61 2x1e n ALA 76 N -2.46 3.08 -3.48 3.60 0.00 0.35 -3.10 120.51 118.49 2x1e n ALA 76 Ca 0.04 -0.32 -0.19 0.00 0.00 0.00 0.00 53.44 52.97 2x1e n ALA 76 Cb 0.15 -1.21 0.08 0.00 0.00 0.00 0.00 19.45 18.47 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 -1.12 -6.77 -4.39 0.00 1.02 -0.26 -4.95 120.64 104.17 2x1e n GLU 77 Ca 0.10 0.83 -0.20 0.00 -0.02 0.00 0.00 57.16 57.87 2x1e n GLU 77 Cb 0.33 -5.83 -0.10 0.00 -0.02 0.00 0.00 31.44 25.81 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 -5.58 1.48 0.39 3.49 1.81 -0.15 -5.04 118.95 115.34 2x1e s ARG 78 Ca 0.11 -1.75 -0.25 0.00 -1.72 0.00 0.00 55.73 52.13 2x1e s ARG 78 Cb -0.05 -0.96 -0.09 0.00 -0.45 0.00 0.00 34.95 33.40 2x1e s ARG 78 CO 0.74 -0.02 1.07 -0.51 -0.68 0.00 0.00 175.30 175.90 2x1e s ASP 79 N -3.40 6.75 0.26 0.23 1.01 -1.26 -4.47 116.67 115.79 2x1e s ASP 79 Ca 0.29 2.11 -0.02 0.00 0.71 0.00 0.00 52.55 55.64 2x1e s ASP 79 Cb 0.05 -2.59 0.44 0.00 1.01 0.00 0.00 42.92 41.82 2x1e s ASP 79 CO 0.11 -0.50 1.83 0.58 0.21 0.00 0.00 175.17 177.40 2x1e h VAL 80 N 2.28 0.94 -0.50 -1.27 2.07 -1.93 -1.29 116.25 116.56 2x1e h VAL 80 Ca -0.48 -0.31 0.07 0.00 0.82 0.00 0.00 66.70 66.79 2x1e h VAL 80 Cb 1.22 -0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 2x1e h VAL 80 CO 0.63 0.17 0.34 0.77 0.02 0.00 0.00 177.57 179.49 2x1e h SER 81 N 0.91 0.36 -0.65 0.57 4.64 -1.92 0.13 113.55 117.59 2x1e h SER 81 Ca 0.43 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.68 2x1e h SER 81 Cb 0.36 -0.07 -0.03 0.00 -0.31 0.00 0.00 62.40 62.35 2x1e h SER 81 CO -0.24 0.23 0.12 -0.33 -0.87 0.00 0.00 176.83 175.74 2x1e h GLU 82 N 0.40 1.08 -0.07 4.77 5.08 -1.61 0.43 114.58 124.67 2x1e h GLU 82 Ca 0.22 -0.27 -0.24 0.00 -1.00 0.00 0.00 59.36 58.06 2x1e h GLU 82 Cb 0.36 -0.13 0.01 0.00 0.50 0.00 0.00 28.75 29.49 2x1e h GLU 82 CO -0.06 0.98 -0.92 0.82 -1.00 0.00 0.00 179.01 178.84 2x1e h ILE 83 N 1.01 1.29 -0.54 3.13 1.08 -1.13 -2.30 117.51 120.06 2x1e h ILE 83 Ca 0.20 -2.14 0.08 0.00 -0.39 0.00 0.00 64.86 62.61 2x1e h ILE 83 Cb 0.41 2.20 -0.06 0.00 -3.07 0.00 0.00 36.82 36.30 2x1e h ILE 83 CO 0.01 0.67 0.20 0.58 -0.69 0.00 0.00 178.15 178.91 2x1e h VAL 84 N 0.44 0.81 -0.39 1.67 2.07 -0.70 -1.24 116.25 118.91 2x1e h VAL 84 Ca -0.09 -0.13 0.08 0.00 0.82 0.00 0.00 66.70 67.38 2x1e h VAL 84 Cb 1.55 0.40 -0.07 0.00 -1.52 0.00 0.00 31.29 31.65 2x1e h VAL 84 CO 0.18 0.07 -0.04 -0.03 0.02 0.00 0.00 177.57 177.77 2x1e h MET 85 N 0.38 0.06 -0.63 1.57 1.85 -0.74 -1.52 114.93 115.90 2x1e h MET 85 Ca 0.26 -0.00 0.06 0.00 -0.61 0.00 0.00 59.70 59.41 2x1e h MET 85 Cb 0.30 -0.01 -0.05 0.00 0.43 0.00 0.00 31.60 32.26 2x1e h MET 85 CO -0.27 0.04 0.34 -0.07 -0.40 0.00 0.00 176.91 176.55 2x1e h LEU 86 N 0.06 0.50 0.00 3.39 3.38 -0.78 -1.40 115.31 120.46 2x1e h LEU 86 Ca 0.19 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.19 2x1e h LEU 86 Cb 0.28 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2x1e h LEU 86 CO -0.36 0.33 0.00 0.59 0.09 0.00 0.00 178.44 179.09 2x1e n ASN 87 N -4.82 0.00 -0.52 -0.43 3.02 -0.54 -3.15 115.26 108.83 2x1e n ASN 87 Ca 0.07 0.38 0.06 0.00 -0.03 0.00 0.00 54.58 55.07 2x1e n ASN 87 Cb 0.17 -0.46 0.13 0.00 -0.61 0.00 0.00 39.78 39.00 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 -1.46 1.46 -0.06 3.41 -2.24 -0.63 -4.55 114.28 110.20 2x1e n THR 88 Ca 0.08 -2.10 -0.09 0.00 -2.27 0.00 0.00 64.05 59.67 2x1e n THR 88 Cb 0.31 0.04 -0.02 0.00 -2.10 0.00 0.00 70.33 68.56 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 0.49 0.21 0.44 -0.78 2.43 -1.21 0.19 114.38 116.16 2x1e h ARG 89 Ca -0.03 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.10 2x1e h ARG 89 Cb 1.19 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.69 2x1e h ARG 89 CO 0.01 0.14 -0.21 1.15 -1.51 0.00 0.00 179.97 179.55 2x1e h THR 90 N 0.22 0.57 -0.33 0.20 2.02 -1.88 0.13 112.91 113.83 2x1e h THR 90 Ca 0.10 -0.07 0.07 0.00 0.77 0.00 0.00 66.41 67.27 2x1e h THR 90 Cb 0.06 0.61 -0.06 0.00 -1.74 0.00 0.00 68.15 67.01 2x1e h THR 90 CO -0.09 0.01 -0.08 -0.33 0.37 0.00 0.00 175.52 175.41 2x1e h GLU 91 N -0.63 0.01 -0.24 6.66 3.07 -1.90 -0.02 114.58 121.53 2x1e h GLU 91 Ca -0.06 -0.00 0.02 0.00 -0.50 0.00 0.00 59.36 58.82 2x1e h GLU 91 Cb 0.48 -0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.36 2x1e h GLU 91 CO 0.10 0.00 0.08 0.35 -1.40 0.00 0.00 179.01 178.14 2x1e h PHE 92 N 0.01 0.14 -0.28 4.33 3.57 -0.53 -1.13 116.94 123.05 2x1e h PHE 92 Ca 0.16 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.67 2x1e h PHE 92 Cb 0.24 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.94 2x1e h PHE 92 CO -0.30 0.07 0.16 0.00 -2.23 0.00 0.00 178.31 176.01 2x1e h ALA 93 N 1.15 0.35 -0.49 2.41 0.00 -0.30 -1.86 119.26 120.52 2x1e h ALA 93 Ca 0.10 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 2x1e h ALA 93 Cb 0.07 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2x1e h ALA 93 CO -0.11 -0.14 -0.11 -0.92 0.00 0.00 0.00 179.25 177.98 2x1e h TYR 94 N 0.35 1.00 -0.52 0.00 3.20 -0.89 -1.84 116.97 118.28 2x1e h TYR 94 Ca 0.10 -0.20 -0.01 0.00 3.14 0.00 0.00 58.73 61.77 2x1e h TYR 94 Cb 0.02 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.01 2x1e h TYR 94 CO -0.04 0.96 0.30 0.78 -1.64 0.00 0.00 178.16 178.51 2x1e h GLY 95 N 0.96 0.76 1.00 1.82 0.00 -1.09 -1.22 103.07 105.31 2x1e h GLY 95 Ca 0.13 -0.33 -0.04 0.00 0.00 0.00 0.00 47.33 47.08 2x1e h GLY 95 CO 0.04 0.32 0.20 1.41 0.00 0.00 0.00 176.54 178.51 2x1e h LEU 96 N 0.69 0.85 -0.67 3.11 3.38 -1.21 -1.21 115.31 120.26 2x1e h LEU 96 Ca 0.18 -0.20 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 2x1e h LEU 96 Cb 0.02 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 2x1e h LEU 96 CO -0.03 0.82 -0.33 0.50 0.09 0.00 0.00 178.44 179.49 2x1e h LYS 97 N 0.83 0.67 -0.36 1.13 3.64 -1.17 -0.95 116.57 120.36 2x1e h LYS 97 Ca 0.19 -0.31 -0.09 0.00 -1.27 0.00 0.00 60.65 59.17 2x1e h LYS 97 Cb 0.27 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 2x1e h LYS 97 CO -0.01 0.91 -0.12 0.00 -2.27 0.00 0.00 179.45 177.96 2x1e h ALA 98 N 1.07 0.50 -0.77 5.00 0.00 -1.12 -1.68 119.26 122.26 2x1e h ALA 98 Ca 0.06 -0.32 0.05 0.00 0.00 0.00 0.00 54.91 54.69 2x1e h ALA 98 Cb 0.84 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.45 2x1e h ALA 98 CO 0.07 0.38 0.47 0.00 0.00 0.00 0.00 179.25 180.17 2x1e h ALA 99 N 0.81 1.02 -0.31 0.00 0.00 -1.07 -3.08 119.26 116.63 2x1e h ALA 99 Ca 0.09 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.82 2x1e h ALA 99 Cb 0.64 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 2x1e h ALA 99 CO 0.04 0.23 -0.47 -0.09 0.00 0.00 0.00 179.25 178.96 2x1e h ARG 100 N 0.89 0.83 0.00 0.00 2.43 -1.03 -3.51 114.38 113.98 2x1e h ARG 100 Ca 0.32 -0.48 0.00 0.00 -0.81 0.00 0.00 59.98 59.01 2x1e h ARG 100 Cb 0.09 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 2x1e h ARG 100 CO -0.14 1.11 0.00 -0.25 -1.51 0.00 0.00 179.97 179.18 2x1e n ASP 101 N -4.02 0.00 -4.08 -3.80 8.00 -0.64 -5.07 116.55 106.94 2x1e n ASP 101 Ca -0.03 0.00 -0.27 0.00 0.71 0.00 0.00 54.79 55.20 2x1e n ASP 101 Cb 0.58 0.00 -0.17 0.00 -0.02 0.00 0.00 41.12 41.52 2x1e n ASP 101 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2x1e s THR 104 N 0.77 1.43 0.00 -3.53 2.01 -1.07 -4.90 115.64 110.36 2x1e s THR 104 Ca 0.00 -0.64 0.03 0.00 0.31 0.00 0.00 61.69 61.38 2x1e s THR 104 Cb 0.00 -1.28 -0.01 0.00 0.01 0.00 0.00 72.50 71.22 2x1e s THR 104 CO 0.00 0.42 -0.08 -0.89 -0.69 0.00 0.00 174.62 173.38 2x1e s THR 105 N 0.65 0.66 -0.02 -0.82 2.01 0.19 -0.99 115.64 117.33 2x1e s THR 105 Ca -0.14 -0.48 -0.08 0.00 0.31 0.00 0.00 61.69 61.30 2x1e s THR 105 Cb -0.16 -0.58 0.01 0.00 0.01 0.00 0.00 72.50 71.78 2x1e s THR 105 CO 0.04 0.10 0.18 0.00 -0.69 0.00 0.00 174.62 174.25 2x1e s ALA 106 N -0.37 -0.43 -0.02 7.40 0.00 0.02 -0.76 121.76 127.59 2x1e s ALA 106 Ca 0.02 0.14 0.04 0.00 0.00 0.00 0.00 51.96 52.15 2x1e s ALA 106 Cb -0.04 -0.03 -0.01 0.00 0.00 0.00 0.00 23.12 23.04 2x1e s ALA 106 CO -0.00 -0.18 -0.14 -0.47 0.00 0.00 0.00 175.76 174.98 2x1e s TYR 107 N -0.91 1.26 -0.16 0.00 6.14 0.04 -0.97 117.35 122.74 2x1e s TYR 107 Ca -0.10 -0.27 -0.04 0.00 0.64 0.00 0.00 57.07 57.30 2x1e s TYR 107 Cb -0.05 -0.83 0.06 0.00 0.42 0.00 0.00 41.96 41.56 2x1e s TYR 107 CO 0.01 -0.05 0.07 0.00 0.64 0.00 0.00 175.55 176.22 2x1e s GLN 109 N 2.07 4.40 0.09 0.00 2.00 0.17 -1.35 119.66 127.04 2x1e s GLN 109 Ca 0.02 1.87 -0.00 0.00 -2.00 0.00 0.00 55.36 55.25 2x1e s GLN 109 Cb -0.16 -3.31 -0.04 0.00 0.80 0.00 0.00 33.01 30.30 2x1e s GLN 109 CO -0.08 -0.32 -0.01 -0.51 -0.50 0.00 0.00 175.29 173.88 2x1e s LEU 110 N 1.07 2.25 0.11 3.68 1.43 -1.26 -4.88 118.68 121.08 2x1e s LEU 110 Ca 0.61 -1.08 -0.14 0.00 -1.03 0.00 0.00 54.13 52.49 2x1e s LEU 110 Cb -0.32 0.16 -0.06 0.00 0.03 0.00 0.00 46.19 46.00 2x1e s LEU 110 CO 0.30 -0.61 1.46 1.55 0.23 0.00 0.00 176.35 179.27 2x1e h PRO 111 N 2.99 0.75 -0.88 1.29 0.13 -1.97 -2.95 132.00 131.37 2x1e h PRO 111 Ca -0.35 -0.36 -0.18 0.00 -0.87 0.00 0.00 66.00 64.24 2x1e h PRO 111 Cb 1.17 -0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.19 2x1e h PRO 111 CO 0.63 0.98 0.23 0.27 -0.23 0.00 0.00 178.00 179.89 2x1e n ASN 112 N -4.26 3.72 0.00 1.44 2.04 -1.26 -4.96 115.26 111.98 2x1e n ASN 112 Ca -0.03 -2.83 0.00 0.00 -0.44 0.00 0.00 54.58 51.28 2x1e n ASN 112 Cb 0.45 -0.67 0.00 0.00 -2.53 0.00 0.00 39.78 37.03 2x1e n ASN 112 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2x1e n GLY 113 N -0.12 3.51 3.74 4.83 0.00 -1.11 -4.75 105.19 111.29 2x1e n GLY 113 Ca 0.29 -1.44 -0.36 0.00 0.00 0.00 0.00 46.02 44.51 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 -0.56 2.44 -0.02 4.61 0.00 -1.26 -4.12 121.76 122.85 2x1e s ALA 114 Ca 0.00 1.05 0.06 0.00 0.00 0.00 0.00 51.96 53.07 2x1e s ALA 114 Cb 0.00 -3.48 -0.01 0.00 0.00 0.00 0.00 23.12 19.63 2x1e s ALA 114 CO 0.00 -1.38 -0.19 -0.51 0.00 0.00 0.00 175.76 173.68 2x1e s LEU 115 N -4.30 2.01 -0.01 0.00 1.43 -0.46 -2.76 118.68 114.59 2x1e s LEU 115 Ca 0.78 -0.36 -0.02 0.00 -1.03 0.00 0.00 54.13 53.50 2x1e s LEU 115 Cb -0.32 -1.03 -0.00 0.00 0.03 0.00 0.00 46.19 44.87 2x1e s LEU 115 CO 0.37 0.22 0.04 -1.58 0.23 0.00 0.00 176.35 175.63 2x1e s GLN 116 N -0.34 0.19 0.05 1.70 0.74 -1.02 -0.24 119.66 120.74 2x1e s GLN 116 Ca 0.05 -0.17 -0.28 0.00 0.05 0.00 0.00 55.36 55.01 2x1e s GLN 116 Cb -0.09 0.08 0.09 0.00 1.10 0.00 0.00 33.01 34.19 2x1e s GLN 116 CO 0.00 -0.03 1.10 0.20 -0.55 0.00 0.00 175.29 176.01 2x1e s GLY 117 N -0.56 -0.32 0.13 2.59 0.00 -0.14 0.13 107.32 109.15 2x1e s GLY 117 Ca -0.06 0.50 -0.15 0.00 0.00 0.00 0.00 44.72 45.00 2x1e s GLY 117 CO -0.00 0.10 0.40 -0.86 0.00 0.00 0.00 173.10 172.74 2x1e s GLN 118 N -2.88 1.10 -0.14 2.90 -2.07 -0.78 -0.80 119.66 116.98 2x1e s GLN 118 Ca 0.12 -0.77 -0.07 0.00 -1.82 0.00 0.00 55.36 52.82 2x1e s GLN 118 Cb 0.01 0.46 -0.04 0.00 -1.09 0.00 0.00 33.01 32.35 2x1e s GLN 118 CO -0.01 -0.43 0.12 -0.80 -1.32 0.00 0.00 175.29 172.84 2x1e s ASN 119 N -2.83 6.18 -0.26 12.60 0.01 -0.16 -1.78 114.94 128.70 2x1e s ASN 119 Ca 0.05 0.36 -0.09 0.00 -0.71 0.00 0.00 52.86 52.46 2x1e s ASN 119 Cb 0.02 -2.01 -0.04 0.00 0.41 0.00 0.00 41.25 39.63 2x1e s ASN 119 CO -0.10 0.34 0.12 0.86 -1.51 0.00 0.00 177.10 176.81 2x1e s TRP 120 N -0.61 3.15 -0.17 2.20 -0.11 0.21 -2.60 118.94 121.00 2x1e s TRP 120 Ca 0.12 -0.17 -0.02 0.00 1.22 0.00 0.00 56.10 57.25 2x1e s TRP 120 Cb -0.12 -2.29 -0.01 0.00 -1.50 0.00 0.00 33.47 29.55 2x1e s TRP 120 CO 0.02 -0.25 -0.10 -0.51 -4.62 0.00 0.00 176.95 171.49 2x1e s ASP 121 N 1.63 4.07 0.19 5.86 1.01 -1.26 -0.14 116.67 128.03 2x1e s ASP 121 Ca 0.07 -0.38 -0.08 0.00 0.71 0.00 0.00 52.55 52.87 2x1e s ASP 121 Cb -0.15 -1.66 0.03 0.00 1.01 0.00 0.00 42.92 42.15 2x1e s ASP 121 CO 0.07 0.08 0.40 0.33 0.21 0.00 0.00 175.17 176.25 2x1e n PHE 122 N 4.14 -1.64 -1.95 4.23 7.35 -0.71 -4.92 117.46 123.94 2x1e n PHE 122 Ca -0.18 -0.91 -0.42 0.00 -0.76 0.00 0.00 57.45 55.18 2x1e n PHE 122 Cb 0.52 0.45 -0.03 0.00 0.35 0.00 0.00 39.48 40.77 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 -5.51 3.05 0.56 -5.13 0.08 -1.26 -1.95 117.98 107.82 2x1e s PHE 123 Ca 0.08 0.71 0.23 0.00 0.12 0.00 0.00 56.93 58.08 2x1e s PHE 123 Cb -0.02 -3.90 1.55 0.00 -0.57 0.00 0.00 43.02 40.07 2x1e s PHE 123 CO 0.06 -3.25 2.19 0.77 -0.10 0.00 0.00 175.22 174.88 2x1e h SER 124 N 6.42 0.00 -0.82 1.36 0.02 -1.91 -1.96 113.55 116.66 2x1e h SER 124 Ca -0.43 0.00 0.22 0.00 -0.84 0.00 0.00 61.79 60.74 2x1e h SER 124 Cb 1.21 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.71 2x1e h SER 124 CO 0.88 0.00 0.57 0.00 -1.14 0.00 0.00 176.83 177.15 2x1e h ALA 125 N 1.97 2.58 0.00 3.77 0.00 -1.97 -1.29 119.26 124.32 2x1e h ALA 125 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2x1e h ALA 125 Cb 0.08 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2x1e h ALA 125 CO -0.00 -0.82 0.00 0.25 0.00 0.00 0.00 179.25 178.68 2x1e n THR 126 N -4.37 0.63 -0.23 0.00 -2.24 -0.74 -3.89 114.28 103.45 2x1e n THR 126 Ca 0.17 -0.25 -0.07 0.00 -2.27 0.00 0.00 64.05 61.63 2x1e n THR 126 Cb 0.80 -0.64 0.04 0.00 -2.10 0.00 0.00 70.33 68.43 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 0.93 0.00 -0.78 3.64 -1.40 -1.04 116.57 117.92 2x1e h LYS 127 Ca 0.00 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 2x1e h LYS 127 Cb 0.71 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.38 2x1e h LYS 127 CO 0.00 0.77 0.00 -0.85 -2.27 0.00 0.00 179.45 177.10 2x1e n GLU 128 N -4.46 0.04 -0.00 1.90 0.28 -1.25 -2.02 120.64 115.13 2x1e n GLU 128 Ca 0.04 0.38 0.11 0.00 -0.16 0.00 0.00 57.16 57.53 2x1e n GLU 128 Cb 0.15 -1.58 0.09 0.00 1.43 0.00 0.00 31.44 31.53 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 -1.65 2.85 -4.69 -1.84 3.02 -0.41 -4.93 115.26 107.59 2x1e n ASN 129 Ca 0.02 -1.92 -0.42 0.00 -0.03 0.00 0.00 54.58 52.22 2x1e n ASN 129 Cb 0.12 -0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.26 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 -1.84 4.31 0.36 3.41 1.43 -0.85 -0.94 118.68 124.55 2x1e s LEU 130 Ca 0.26 1.92 0.04 0.00 -1.03 0.00 0.00 54.13 55.32 2x1e s LEU 130 Cb 0.18 -3.56 -0.05 0.00 0.03 0.00 0.00 46.19 42.79 2x1e s LEU 130 CO 0.28 -0.59 0.08 0.27 0.23 0.00 0.00 176.35 176.62 2x1e s ILE 131 N 2.00 0.97 0.04 -0.59 -4.36 0.27 -4.60 121.20 114.93 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 -0.27 -2.62 -0.02 0.00 1.25 0.00 0.00 42.46 40.80 2x1e s ILE 131 CO 0.24 0.00 -0.16 0.00 0.24 0.00 0.00 174.94 175.26 2x1e s ARG 132 N -3.84 1.10 -0.03 0.37 1.70 0.10 -1.06 118.95 117.29 2x1e s ARG 132 Ca 0.31 -0.80 0.07 0.00 -0.47 0.00 0.00 55.73 54.84 2x1e s ARG 132 Cb 0.06 -1.14 -0.02 0.00 -0.57 0.00 0.00 34.95 33.28 2x1e s ARG 132 CO 0.15 0.29 -0.24 -0.51 -1.08 0.00 0.00 175.30 173.91 2x1e s LEU 133 N -1.10 2.19 -0.23 -1.89 1.43 -0.64 -1.22 118.68 117.22 2x1e s LEU 133 Ca 0.04 -0.42 -0.06 0.00 -1.03 0.00 0.00 54.13 52.66 2x1e s LEU 133 Cb -0.08 -1.39 -0.02 0.00 0.03 0.00 0.00 46.19 44.73 2x1e s LEU 133 CO 0.01 0.32 0.03 -0.89 0.23 0.00 0.00 176.35 176.05 2x1e s THR 134 N -0.59 4.06 -0.22 5.49 2.01 -0.05 -1.90 115.64 124.43 2x1e s THR 134 Ca 0.09 -0.26 -0.00 0.00 0.31 0.00 0.00 61.69 61.82 2x1e s THR 134 Cb -0.10 -2.87 0.02 0.00 0.01 0.00 0.00 72.50 69.56 2x1e s THR 134 CO -0.00 0.38 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.57 2x1e s ILE 135 N 1.38 2.56 -0.24 1.82 1.01 0.12 -0.19 121.20 127.67 2x1e s ILE 135 Ca 0.05 -1.01 -0.10 0.00 0.00 0.00 0.00 60.65 59.59 2x1e s ILE 135 Cb -0.15 -2.24 -0.05 0.00 0.01 0.00 0.00 42.46 40.04 2x1e s ILE 135 CO 0.02 0.32 0.15 -0.13 0.00 0.00 0.00 174.94 175.29 2x1e s ARG 136 N 1.30 4.02 -0.09 2.79 0.52 0.04 -1.85 118.95 125.69 2x1e s ARG 136 Ca 0.01 -0.30 -0.00 0.00 -0.52 0.00 0.00 55.73 54.93 2x1e s ARG 136 Cb -0.15 -3.51 0.02 0.00 0.52 0.00 0.00 34.95 31.83 2x1e s ARG 136 CO -0.07 0.03 -0.06 -0.65 0.02 0.00 0.00 175.30 174.57 2x1e s GLN 137 N 1.13 1.25 -0.02 3.54 -0.21 -1.26 -3.69 119.66 120.39 2x1e s GLN 137 Ca 0.07 -0.17 -0.35 0.00 0.02 0.00 0.00 55.36 54.93 2x1e s GLN 137 Cb -0.14 -1.32 -0.13 0.00 1.00 0.00 0.00 33.01 32.42 2x1e s GLN 137 CO 0.05 -0.21 1.73 0.00 -2.12 0.00 0.00 175.29 174.74 2x1e n ALA 138 N 4.70 0.76 -0.71 6.09 0.00 -1.26 -1.30 120.51 128.79 2x1e n ALA 138 Ca -0.14 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.66 2x1e n ALA 138 Cb 0.50 -2.39 0.00 0.00 0.00 0.00 0.00 19.45 17.56 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 3.93 0.85 3.43 0.00 0.00 0.18 -4.89 105.19 108.69 2x1e n GLY 139 Ca 0.21 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 2.47 0.47 0.99 1.43 -0.42 -4.89 118.68 118.73 2x1e s LEU 140 Ca 0.00 -0.88 -0.23 0.00 -1.03 0.00 0.00 54.13 51.98 2x1e s LEU 140 Cb 0.00 -1.17 -0.09 0.00 0.03 0.00 0.00 46.19 44.96 2x1e s LEU 140 CO 0.00 0.11 1.15 -2.65 0.23 0.00 0.00 176.35 175.19 2x1e n PRO 141 N 0.14 1.56 -2.45 1.29 -0.02 -1.26 -3.85 135.00 130.40 2x1e n PRO 141 Ca -0.11 0.56 -0.41 0.00 -2.02 0.00 0.00 63.50 61.52 2x1e n PRO 141 Cb 0.56 -2.27 -0.04 0.00 -0.02 0.00 0.00 33.50 31.74 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 -1.28 3.70 -0.09 3.45 2.01 -1.26 -4.65 115.64 117.52 2x1e s THR 142 Ca 0.65 1.48 0.01 0.00 0.31 0.00 0.00 61.69 64.14 2x1e s THR 142 Cb -0.50 -3.94 -0.02 0.00 0.01 0.00 0.00 72.50 68.05 2x1e s THR 142 CO 0.55 0.26 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.99 2x1e s ILE 143 N -0.28 3.26 -0.17 1.82 1.01 -0.77 -0.40 121.20 125.66 2x1e s ILE 143 Ca 0.50 -0.62 0.01 0.00 0.00 0.00 0.00 60.65 60.53 2x1e s ILE 143 Cb -0.31 -2.33 0.03 0.00 0.01 0.00 0.00 42.46 39.86 2x1e s ILE 143 CO 0.36 0.56 -0.12 -0.54 0.00 0.00 0.00 174.94 175.21 2x1e s LYS 144 N -0.33 2.17 0.02 2.79 1.02 0.01 -0.70 119.74 124.71 2x1e s LYS 144 Ca 0.04 -0.68 -0.07 0.00 0.02 0.00 0.00 55.97 55.28 2x1e s LYS 144 Cb -0.13 -2.24 -0.00 0.00 -0.52 0.00 0.00 37.83 34.94 2x1e s LYS 144 CO 0.02 -0.32 0.12 -0.59 -0.92 0.00 0.00 175.35 173.67 2x1e s PHE 145 N 1.45 0.11 -0.10 3.18 -0.71 -0.80 -1.37 117.98 119.75 2x1e s PHE 145 Ca 0.02 -0.32 -0.15 0.00 -1.04 0.00 0.00 56.93 55.45 2x1e s PHE 145 Cb -0.14 -0.09 -0.05 0.00 -1.21 0.00 0.00 43.02 41.53 2x1e s PHE 145 CO -0.10 -0.34 0.37 0.42 -1.34 0.00 0.00 175.22 174.23 2x1e s ILE 146 N -2.06 5.20 0.17 -4.49 -1.09 0.21 -1.62 121.20 117.53 2x1e s ILE 146 Ca -0.09 0.73 -0.10 0.00 -2.23 0.00 0.00 60.65 58.95 2x1e s ILE 146 Cb -0.04 -3.69 -0.00 0.00 -1.58 0.00 0.00 42.46 37.14 2x1e s ILE 146 CO -0.02 0.44 0.33 0.28 -1.23 0.00 0.00 174.94 174.74 2x1e s THR 147 N -0.01 0.06 0.17 2.92 -1.32 -0.22 -2.66 115.64 114.58 2x1e s THR 147 Ca 0.21 -1.30 -0.30 0.00 -1.21 0.00 0.00 61.69 59.09 2x1e s THR 147 Cb -0.15 -1.82 -0.07 0.00 -1.51 0.00 0.00 72.50 68.96 2x1e s THR 147 CO 0.08 -0.26 1.03 -1.61 -2.21 0.00 0.00 174.62 171.65 2x1e s GLU 148 N -3.96 4.67 0.15 7.08 2.02 -1.26 -0.57 118.70 126.84 2x1e s GLU 148 Ca 0.16 1.60 -0.34 0.00 0.02 0.00 0.00 54.97 56.41 2x1e s GLU 148 Cb 0.03 -3.31 -0.15 0.00 0.10 0.00 0.00 34.13 30.80 2x1e s GLU 148 CO -0.00 0.19 1.45 0.00 0.02 0.00 0.00 175.26 176.92 2x1e n ALA 149 N 2.35 0.51 0.00 5.21 0.00 -0.11 -2.21 120.51 126.25 2x1e n ALA 149 Ca 0.02 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.92 2x1e n ALA 149 Cb 0.47 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.69 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 2.86 1.96 3.69 0.00 0.00 -1.26 -4.60 105.19 107.84 2x1e n GLY 150 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.38 4.68 -1.94 -0.61 1.01 -0.94 -4.74 121.20 116.28 2x1e s ILE 151 Ca 0.00 -0.09 0.27 0.00 0.00 0.00 0.00 60.65 60.82 2x1e s ILE 151 Cb 0.00 -3.03 0.33 0.00 0.01 0.00 0.00 42.46 39.77 2x1e s ILE 151 CO 0.00 0.55 1.60 2.30 0.00 0.00 0.00 174.94 179.40 2x1e n ILE 152 N 2.66 0.00 -3.67 2.92 -5.35 -1.26 -4.82 119.36 109.84 2x1e n ILE 152 Ca -0.18 -0.16 -0.10 0.00 -0.27 0.00 0.00 62.75 62.04 2x1e n ILE 152 Cb 0.53 0.44 -0.09 0.00 -1.74 0.00 0.00 39.64 38.79 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 -2.38 -0.48 0.00 3.28 0.00 -1.25 -4.71 107.32 101.77 2x1e s GLY 153 Ca 0.27 1.94 0.00 0.00 0.00 0.00 0.00 44.72 46.94 2x1e s GLY 153 CO 0.47 1.94 0.00 1.17 0.00 0.00 0.00 173.10 176.69 2x1e n LYS 154 N 3.98 0.00 -4.00 2.90 3.00 -1.26 -4.70 118.16 118.08 2x1e n LYS 154 Ca -0.20 0.00 -0.35 0.00 -0.00 0.00 0.00 58.31 57.76 2x1e n LYS 154 Cb 0.57 0.00 -0.14 0.00 0.00 0.00 0.00 35.03 35.46 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 1.79 3.37 -0.41 3.15 1.01 -1.09 -4.85 120.40 123.37 2x1e s VAL 155 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 61.48 2x1e s VAL 155 Cb 0.00 -2.52 0.00 0.00 0.00 0.00 0.00 36.38 33.86 2x1e s VAL 155 CO 0.00 0.43 0.00 0.61 0.00 0.00 0.00 175.10 176.14 2x1e n GLY 156 N 4.64 -0.58 3.35 4.51 0.00 -1.15 -0.62 105.19 115.34 2x1e n GLY 156 Ca -0.18 -0.59 -0.11 0.00 0.00 0.00 0.00 46.02 45.13 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 -3.12 0.90 0.35 1.61 -0.71 -0.47 -0.36 117.98 116.18 2x1e s PHE 157 Ca 0.00 -1.16 0.04 0.00 -1.04 0.00 0.00 56.93 54.77 2x1e s PHE 157 Cb 0.00 -0.29 -0.06 0.00 -1.21 0.00 0.00 43.02 41.46 2x1e s PHE 157 CO 0.00 -0.78 0.06 0.54 -1.34 0.00 0.00 175.22 173.70 2x1e s ASN 158 N -3.12 2.60 0.22 1.98 2.20 -0.34 -0.81 114.94 117.67 2x1e s ASN 158 Ca 0.33 -1.43 0.21 0.00 -0.94 0.00 0.00 52.86 51.03 2x1e s ASN 158 Cb 0.04 -0.01 0.92 0.00 -2.00 0.00 0.00 41.25 40.20 2x1e s ASN 158 CO 0.12 -0.65 1.63 -1.54 -2.94 0.00 0.00 177.10 173.72 2x1e n SER 159 N -0.81 0.52 -0.17 3.54 3.41 0.46 -0.81 113.62 119.77 2x1e n SER 159 Ca -0.04 0.66 0.14 0.00 -0.26 0.00 0.00 58.87 59.37 2x1e n SER 159 Cb 0.66 -0.76 0.60 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 -1.73 2.77 -0.40 7.33 0.00 -1.26 -4.92 120.51 122.31 2x1e n ALA 160 Ca 0.01 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.15 2x1e n ALA 160 Cb 0.17 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.32 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 1.25 0.76 3.66 0.00 0.00 0.01 -4.87 105.19 106.01 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 -2.34 4.76 -0.07 1.61 1.01 -1.25 -4.26 120.40 119.86 2x1e s VAL 162 Ca 0.00 1.89 0.04 0.00 0.00 0.00 0.00 61.98 63.91 2x1e s VAL 162 Cb 0.00 -4.25 -0.01 0.00 0.00 0.00 0.00 36.38 32.12 2x1e s VAL 162 CO 0.00 -0.09 -0.19 0.00 0.00 0.00 0.00 175.10 174.82 2x1e s ALA 163 N 2.70 2.40 -0.06 5.51 0.00 0.75 -1.20 121.76 131.86 2x1e s ALA 163 Ca 0.42 -0.99 0.04 0.00 0.00 0.00 0.00 51.96 51.43 2x1e s ALA 163 Cb -0.16 -0.88 0.00 0.00 0.00 0.00 0.00 23.12 22.08 2x1e s ALA 163 CO 0.10 0.41 -0.18 0.08 0.00 0.00 0.00 175.76 176.16 2x1e s VAL 164 N -0.16 1.57 0.18 0.00 1.01 0.51 -0.84 120.40 122.67 2x1e s VAL 164 Ca -0.02 -0.77 0.08 0.00 0.00 0.00 0.00 61.98 61.28 2x1e s VAL 164 Cb -0.14 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.84 2x1e s VAL 164 CO 0.04 0.45 -0.17 0.20 0.00 0.00 0.00 175.10 175.61 2x1e s ASN 165 N 0.22 2.69 -0.03 3.32 -0.87 0.00 -2.91 114.94 117.37 2x1e s ASN 165 Ca -0.09 -0.90 0.01 0.00 -1.57 0.00 0.00 52.86 50.30 2x1e s ASN 165 Cb -0.14 -0.16 0.02 0.00 -0.02 0.00 0.00 41.25 40.95 2x1e s ASN 165 CO 0.04 -0.06 -0.03 -0.47 -2.57 0.00 0.00 177.10 174.01 2x1e s TYR 166 N -2.27 0.50 -0.04 2.20 6.14 -1.26 -1.01 117.35 121.61 2x1e s TYR 166 Ca 0.18 -0.09 0.04 0.00 0.64 0.00 0.00 57.07 57.84 2x1e s TYR 166 Cb -0.05 -0.48 -0.00 0.00 0.42 0.00 0.00 41.96 41.85 2x1e s TYR 166 CO 0.07 -0.13 -0.15 -0.80 0.64 0.00 0.00 175.55 175.18 2x1e s ASN 167 N 0.78 1.88 0.42 4.32 -0.87 -0.01 -4.96 114.94 116.51 2x1e s ASN 167 Ca -0.09 -0.30 -0.26 0.00 -1.57 0.00 0.00 52.86 50.64 2x1e s ASN 167 Cb -0.12 -0.48 -0.09 0.00 -0.02 0.00 0.00 41.25 40.53 2x1e s ASN 167 CO -0.01 0.14 1.43 0.00 -2.57 0.00 0.00 177.10 176.09 2x1e s ALA 168 N 0.03 3.34 -0.05 0.60 0.00 -1.26 -0.72 121.76 123.70 2x1e s ALA 168 Ca -0.02 1.47 -0.14 0.00 0.00 0.00 0.00 51.96 53.27 2x1e s ALA 168 Cb -0.10 -3.58 0.03 0.00 0.00 0.00 0.00 23.12 19.46 2x1e s ALA 168 CO 0.01 -1.11 0.32 -1.17 0.00 0.00 0.00 175.76 173.81 2x1e s LEU 169 N -2.50 0.81 -0.44 0.00 2.96 -1.26 -4.38 118.68 113.87 2x1e s LEU 169 Ca 0.58 0.29 0.07 0.00 -0.22 0.00 0.00 54.13 54.84 2x1e s LEU 169 Cb -0.44 1.22 0.41 0.00 0.50 0.00 0.00 46.19 47.88 2x1e s LEU 169 CO 0.57 -0.33 1.06 1.41 -1.32 0.00 0.00 176.35 177.74 2x1e n HIS 170 N 1.84 3.13 -2.87 5.38 8.25 -1.26 -3.89 115.22 125.80 2x1e n HIS 170 Ca -0.19 -3.22 -0.37 0.00 -0.26 0.00 0.00 57.72 53.69 2x1e n HIS 170 Cb 0.57 -0.19 -0.06 0.00 1.12 0.00 0.00 29.99 31.43 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 -3.45 4.33 0.31 2.41 1.43 -1.26 0.32 118.68 122.78 2x1e s LEU 171 Ca 0.45 1.72 -0.28 0.00 -1.03 0.00 0.00 54.13 55.00 2x1e s LEU 171 Cb 0.39 -3.92 -0.09 0.00 0.03 0.00 0.00 46.19 42.60 2x1e s LEU 171 CO -0.15 -0.05 1.07 -1.58 0.23 0.00 0.00 176.35 175.87 2x1e s GLN 172 N -2.06 4.52 0.00 1.70 0.74 0.60 -4.53 119.66 120.63 2x1e s GLN 172 Ca 0.49 1.68 0.00 0.00 0.05 0.00 0.00 55.36 57.57 2x1e s GLN 172 Cb -0.18 -3.00 0.00 0.00 1.10 0.00 0.00 33.01 30.94 2x1e s GLN 172 CO 0.23 0.14 0.00 0.41 -0.55 0.00 0.00 175.29 175.52 2x1e n GLY 173 N 0.95 4.12 2.78 2.59 0.00 -1.26 -4.74 105.19 109.64 2x1e n GLY 173 Ca 0.01 -1.38 -0.15 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 1.18 -0.33 0.99 2.96 -1.26 -4.57 118.68 117.65 2x1e s LEU 174 Ca 0.00 0.04 0.02 0.00 -0.22 0.00 0.00 54.13 53.96 2x1e s LEU 174 Cb 0.00 -0.06 0.10 0.00 0.50 0.00 0.00 46.19 46.73 2x1e s LEU 174 CO 0.00 -0.11 0.07 -0.60 -1.32 0.00 0.00 176.35 174.39 2x1e s ARG 175 N 0.95 1.15 0.57 1.98 3.52 0.41 -5.01 118.95 122.53 2x1e s ARG 175 Ca -0.08 -1.54 0.28 0.00 -0.13 0.00 0.00 55.73 54.27 2x1e s ARG 175 Cb -0.11 -2.68 1.50 0.00 -1.56 0.00 0.00 34.95 32.10 2x1e s ARG 175 CO -0.03 -0.96 1.96 -1.35 -0.81 0.00 0.00 175.30 174.11 2x1e h PRO 176 N 7.81 0.00 -0.01 5.12 0.11 -1.94 -0.34 132.00 142.74 2x1e h PRO 176 Ca -0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.03 2x1e h PRO 176 Cb 1.02 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.13 2x1e h PRO 176 CO 0.50 0.00 -0.20 0.25 -0.21 0.00 0.00 178.00 178.34 2x1e n THR 177 N -3.91 0.00 -1.68 -1.15 -2.24 -1.26 -4.94 114.28 99.10 2x1e n THR 177 Ca 0.08 -0.20 -0.30 0.00 -2.27 0.00 0.00 64.05 61.36 2x1e n THR 177 Cb 0.60 0.60 0.19 0.00 -2.10 0.00 0.00 70.33 69.61 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 -2.33 1.71 -0.12 3.38 0.00 -0.14 -4.99 107.32 104.82 2x1e s GLY 178 Ca 0.28 -1.07 -0.29 0.00 0.00 0.00 0.00 44.72 43.64 2x1e s GLY 178 CO 0.46 -0.29 0.98 0.54 0.00 0.00 0.00 173.10 174.79 2x1e s VAL 179 N -3.60 4.79 0.56 1.40 0.11 -0.51 -4.33 120.40 118.83 2x1e s VAL 179 Ca 0.72 1.99 -0.20 0.00 -2.93 0.00 0.00 61.98 61.55 2x1e s VAL 179 Cb -0.06 -4.29 -0.04 0.00 -1.53 0.00 0.00 36.38 30.45 2x1e s VAL 179 CO 0.54 -0.00 1.23 -2.84 -3.33 0.00 0.00 175.10 170.69 2x1e s PRO 180 N 2.11 3.14 0.26 1.54 0.02 -1.26 -1.13 135.00 139.68 2x1e s PRO 180 Ca 0.47 1.90 -0.03 0.00 0.02 0.00 0.00 61.00 63.35 2x1e s PRO 180 Cb -0.18 -2.08 0.41 0.00 0.02 0.00 0.00 34.50 32.67 2x1e s PRO 180 CO 0.16 -1.09 1.85 0.77 -0.33 0.00 0.00 177.00 178.37 2x1e h SER 181 N 1.20 0.90 1.03 2.53 0.02 -1.96 -1.33 113.55 115.95 2x1e h SER 181 Ca -0.50 0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 60.41 2x1e h SER 181 Cb 1.29 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 63.66 2x1e h SER 181 CO 0.56 0.55 -0.27 0.45 -1.14 0.00 0.00 176.83 176.98 2x1e h HIS 182 N 1.02 0.00 -0.20 3.45 3.86 -1.84 -0.85 115.15 120.60 2x1e h HIS 182 Ca 0.42 0.00 -0.18 0.00 -1.16 0.00 0.00 60.37 59.45 2x1e h HIS 182 Cb 0.25 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.73 2x1e h HIS 182 CO -0.02 0.27 -0.58 0.82 0.86 0.00 0.00 177.93 179.28 2x1e h ILE 183 N 0.00 1.30 -0.69 2.45 1.08 -1.60 -2.31 117.51 117.74 2x1e h ILE 183 Ca -0.00 -1.80 -0.02 0.00 -0.39 0.00 0.00 64.86 62.64 2x1e h ILE 183 Cb 0.86 1.88 -0.03 0.00 -3.07 0.00 0.00 36.82 36.46 2x1e h ILE 183 CO 0.04 0.57 0.33 0.00 -0.69 0.00 0.00 178.15 178.40 2x1e h ALA 184 N 0.59 1.28 -0.57 1.87 0.00 -0.97 0.77 119.26 122.23 2x1e h ALA 184 Ca -0.02 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 2x1e h ALA 184 Cb 1.21 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 2x1e h ALA 184 CO 0.13 0.55 0.30 -0.07 0.00 0.00 0.00 179.25 180.16 2x1e h LEU 185 N 0.98 0.71 -0.62 0.00 3.38 -1.12 -0.67 115.31 117.97 2x1e h LEU 185 Ca 0.24 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 2x1e h LEU 185 Cb 0.10 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 2x1e h LEU 185 CO -0.03 0.61 0.15 -0.09 0.09 0.00 0.00 178.44 179.16 2x1e h ARG 186 N 0.76 1.00 -0.35 1.13 9.65 -0.90 -0.90 114.38 124.77 2x1e h ARG 186 Ca 0.20 -0.24 0.04 0.00 -1.10 0.00 0.00 59.98 58.87 2x1e h ARG 186 Cb 0.06 -0.13 -0.04 0.00 -1.39 0.00 0.00 29.97 28.47 2x1e h ARG 186 CO -0.03 0.91 0.13 0.82 2.80 0.00 0.00 179.97 184.60 2x1e h ILE 187 N 0.91 0.92 -0.86 1.20 2.04 -0.56 -1.62 117.51 119.55 2x1e h ILE 187 Ca 0.19 -0.10 0.01 0.00 1.00 0.00 0.00 64.86 65.96 2x1e h ILE 187 Cb 0.36 0.61 -0.04 0.00 -0.74 0.00 0.00 36.82 37.00 2x1e h ILE 187 CO 0.00 0.05 0.57 0.00 0.00 0.00 0.00 178.15 178.77 2x1e h ALA 188 N 1.21 1.08 0.00 1.87 0.00 -0.85 -2.43 119.26 120.14 2x1e h ALA 188 Ca 0.15 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2x1e h ALA 188 Cb 0.11 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.56 2x1e h ALA 188 CO -0.15 0.49 0.00 -0.07 0.00 0.00 0.00 179.25 179.53 2x1e h LEU 189 N 1.16 0.00 -1.95 0.00 3.38 -0.65 -2.39 115.31 114.87 2x1e h LEU 189 Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.28 2x1e h LEU 189 Cb -0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.61 2x1e h LEU 189 CO -0.07 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.84 2x1e n GLU 190 N -2.52 2.29 -3.46 1.13 1.02 -0.66 -4.72 120.64 113.72 2x1e n GLU 190 Ca 0.01 -1.93 -0.30 0.00 -0.02 0.00 0.00 57.16 54.92 2x1e n GLU 190 Cb 0.24 -1.48 -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 -1.64 6.50 0.02 1.62 0.01 -0.90 -4.50 113.70 114.81 2x1e s SER 191 Ca 0.35 0.72 0.25 0.00 1.31 0.00 0.00 55.95 58.58 2x1e s SER 191 Cb 0.21 -2.14 0.49 0.00 0.21 0.00 0.00 66.02 64.79 2x1e s SER 191 CO 0.30 -0.09 1.40 0.35 0.41 0.00 0.00 173.24 175.61 2x1e n THR 192 N -0.46 0.05 -3.71 1.44 -2.24 -1.26 -4.78 114.28 103.32 2x1e n THR 192 Ca -0.01 -0.04 -0.10 0.00 -2.27 0.00 0.00 64.05 61.62 2x1e n THR 192 Cb 0.53 0.18 -0.04 0.00 -2.10 0.00 0.00 70.33 68.90 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 -3.18 -0.23 0.32 3.42 1.04 -1.26 -4.82 113.70 108.99 2x1e s SER 193 Ca 0.10 -0.45 -0.00 0.00 0.48 0.00 0.00 55.95 56.08 2x1e s SER 193 Cb 0.17 0.53 0.53 0.00 0.10 0.00 0.00 66.02 67.35 2x1e s SER 193 CO 0.70 -0.96 1.99 -0.65 0.98 0.00 0.00 173.24 175.30 2x1e h PRO 194 N 2.29 0.97 -0.44 4.02 0.11 -1.91 -0.46 132.00 136.58 2x1e h PRO 194 Ca -0.31 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 65.75 2x1e h PRO 194 Cb 1.26 -0.22 -0.03 0.00 0.11 0.00 0.00 31.00 32.12 2x1e h PRO 194 CO 0.42 0.64 0.28 0.77 -0.21 0.00 0.00 178.00 179.90 2x1e h SER 195 N 1.00 0.46 -0.66 -2.05 0.02 -1.96 0.96 113.55 111.32 2x1e h SER 195 Ca 0.27 -0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 61.15 2x1e h SER 195 Cb -0.11 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 62.30 2x1e h SER 195 CO -0.06 0.33 0.13 -0.61 -1.14 0.00 0.00 176.83 175.48 2x1e h GLN 196 N 0.56 1.08 -0.18 3.45 4.15 -1.88 -0.82 115.11 121.46 2x1e h GLN 196 Ca 0.17 -0.28 0.03 0.00 0.77 0.00 0.00 58.65 59.35 2x1e h GLN 196 Cb -0.02 -0.13 -0.03 0.00 0.21 0.00 0.00 27.48 27.50 2x1e h GLN 196 CO -0.06 0.98 -0.02 0.00 -1.93 0.00 0.00 178.83 177.80 2x1e h ALA 197 N 1.05 0.14 0.15 3.38 0.00 -0.75 0.88 119.26 124.12 2x1e h ALA 197 Ca 0.20 0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.19 2x1e h ALA 197 Cb 0.41 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 2x1e h ALA 197 CO 0.01 -0.46 -0.31 -0.92 0.00 0.00 0.00 179.25 177.57 2x1e h TYR 198 N 0.03 -0.85 -0.77 0.00 3.20 -0.61 -1.16 116.97 116.81 2x1e h TYR 198 Ca 0.09 0.02 0.14 0.00 3.14 0.00 0.00 58.73 62.11 2x1e h TYR 198 Cb 0.12 0.35 -0.09 0.00 1.54 0.00 0.00 36.73 38.65 2x1e h TYR 198 CO -0.18 -0.42 0.33 -0.44 -1.64 0.00 0.00 178.16 175.80 2x1e h ASP 199 N -0.56 0.35 0.77 -2.11 3.32 -0.94 -1.46 116.42 115.78 2x1e h ASP 199 Ca 0.02 0.10 -0.21 0.00 0.02 0.00 0.00 57.03 56.97 2x1e h ASP 199 Cb 0.57 0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.17 2x1e h ASP 199 CO -0.16 0.14 -0.96 0.03 -1.72 0.00 0.00 179.24 176.57 2x1e h ARG 200 N 0.49 0.11 -0.02 3.56 3.08 -0.54 0.31 114.38 121.37 2x1e h ARG 200 Ca 0.42 -0.14 -0.00 0.00 0.07 0.00 0.00 59.98 60.32 2x1e h ARG 200 Cb 0.61 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.71 2x1e h ARG 200 CO -0.38 0.98 -0.00 0.82 -1.07 0.00 0.00 179.97 180.32 2x1e h ILE 201 N 0.05 1.26 -0.90 2.04 2.04 -0.98 -3.06 117.51 117.95 2x1e h ILE 201 Ca -0.04 -0.76 0.07 0.00 1.00 0.00 0.00 64.86 65.13 2x1e h ILE 201 Cb 1.65 1.74 -0.06 0.00 -0.74 0.00 0.00 36.82 39.40 2x1e h ILE 201 CO 0.14 0.20 0.59 0.58 0.00 0.00 0.00 178.15 179.66 2x1e h VAL 202 N -0.28 1.05 -0.92 1.67 2.07 -1.26 -2.29 116.25 116.29 2x1e h VAL 202 Ca 0.01 -0.35 0.24 0.00 0.82 0.00 0.00 66.70 67.42 2x1e h VAL 202 Cb 0.33 -0.05 -0.05 0.00 -1.52 0.00 0.00 31.29 30.00 2x1e h VAL 202 CO 0.00 0.18 0.64 -0.08 0.02 0.00 0.00 177.57 178.33 2x1e h GLU 203 N 1.01 0.18 0.00 1.57 4.81 -0.82 -0.87 114.58 120.45 2x1e h GLU 203 Ca 0.39 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.61 2x1e h GLU 203 Cb 0.23 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.57 2x1e h GLU 203 CO -0.15 0.12 -0.01 1.96 -0.73 0.00 0.00 179.01 180.20 2x1e h GLN 204 N 0.18 0.00 0.00 1.92 1.08 -1.42 -3.46 115.11 113.42 2x1e h GLN 204 Ca 0.47 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.67 2x1e h GLN 204 Cb 1.52 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.95 2x1e h GLN 204 CO -0.10 0.01 0.00 0.41 -0.95 0.00 0.00 178.83 178.20 2x1e n GLY 205 N -0.65 0.41 0.00 3.46 0.00 -0.33 -4.85 105.19 103.23 2x1e n GLY 205 Ca -0.02 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.16 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 -3.00 4.92 3.83 -0.02 0.00 -1.26 -5.04 105.19 104.62 2x1e n GLY 206 Ca 0.00 -0.88 -0.33 0.00 0.00 0.00 0.00 46.02 44.81 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 -4.70 4.12 0.22 1.61 1.00 -1.26 -1.42 119.30 118.87 2x1e s MET 207 Ca 0.00 0.97 0.03 0.00 0.00 0.00 0.00 55.69 56.69 2x1e s MET 207 Cb 0.00 -2.24 0.19 0.00 0.00 0.00 0.00 34.83 32.78 2x1e s MET 207 CO 0.00 -0.02 1.52 0.00 0.00 0.00 0.00 175.02 176.52 2x1e h ALA 208 N 1.83 0.77 -3.00 3.03 0.00 -1.31 -3.35 119.26 117.24 2x1e h ALA 208 Ca -0.48 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 53.86 2x1e h ALA 208 Cb 1.18 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2x1e h ALA 208 CO 0.62 0.75 0.00 0.00 0.00 0.00 0.00 179.25 180.62 2x1e n ALA 209 N -2.48 0.00 -2.45 0.00 0.00 -1.26 -0.44 120.51 113.87 2x1e n ALA 209 Ca -0.03 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.12 2x1e n ALA 209 Cb 0.64 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.94 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 1.72 2.79 0.19 0.00 0.15 -1.26 -3.47 113.70 113.83 2x1e s SER 210 Ca 0.00 -0.44 -0.22 0.00 0.70 0.00 0.00 55.95 56.00 2x1e s SER 210 Cb 0.00 -0.42 0.08 0.00 -1.71 0.00 0.00 66.02 63.97 2x1e s SER 210 CO 0.00 0.28 1.04 0.00 1.20 0.00 0.00 173.24 175.75 2x1e s ALA 211 N -0.46 -1.56 -0.06 5.45 0.00 -1.19 -4.41 121.76 119.53 2x1e s ALA 211 Ca 0.06 -0.40 0.04 0.00 0.00 0.00 0.00 51.96 51.67 2x1e s ALA 211 Cb -0.10 0.78 -0.00 0.00 0.00 0.00 0.00 23.12 23.80 2x1e s ALA 211 CO 0.00 -1.06 -0.19 0.12 0.00 0.00 0.00 175.76 174.63 2x1e s PHE 212 N -2.08 1.97 -0.08 0.00 5.36 0.10 -2.49 117.98 120.76 2x1e s PHE 212 Ca 0.23 -0.67 0.03 0.00 -0.96 0.00 0.00 56.93 55.56 2x1e s PHE 212 Cb -0.03 -1.34 0.01 0.00 -0.34 0.00 0.00 43.02 41.32 2x1e s PHE 212 CO 0.06 -0.26 -0.18 0.42 -1.46 0.00 0.00 175.22 173.80 2x1e s ILE 213 N 0.21 1.56 -0.14 3.12 1.01 -0.76 -0.83 121.20 125.37 2x1e s ILE 213 Ca -0.10 -0.73 -0.04 0.00 0.00 0.00 0.00 60.65 59.78 2x1e s ILE 213 Cb -0.14 -1.37 -0.03 0.00 0.01 0.00 0.00 42.46 40.92 2x1e s ILE 213 CO 0.04 0.45 -0.01 -0.32 0.00 0.00 0.00 174.94 175.10 2x1e s MET 214 N 0.45 3.50 -0.08 2.79 -2.45 -0.18 -0.11 119.30 123.21 2x1e s MET 214 Ca -0.15 -0.46 0.02 0.00 -1.25 0.00 0.00 55.69 53.85 2x1e s MET 214 Cb -0.16 -2.91 0.01 0.00 1.25 0.00 0.00 34.83 33.02 2x1e s MET 214 CO 0.06 0.39 -0.15 0.08 1.05 0.00 0.00 175.02 176.45 2x1e s VAL 215 N -0.02 1.38 0.07 10.11 1.01 -0.28 -0.82 120.40 131.86 2x1e s VAL 215 Ca 0.02 -0.61 -0.10 0.00 0.00 0.00 0.00 61.98 61.29 2x1e s VAL 215 Cb -0.13 -1.25 0.01 0.00 0.00 0.00 0.00 36.38 35.01 2x1e s VAL 215 CO 0.02 0.41 0.22 -0.83 0.00 0.00 0.00 175.10 174.93 2x1e s GLY 216 N 0.71 0.02 0.00 4.51 0.00 -0.02 -1.34 107.32 111.20 2x1e s GLY 216 Ca -0.13 -0.42 0.00 0.00 0.00 0.00 0.00 44.72 44.17 2x1e s GLY 216 CO 0.03 -0.61 0.00 1.16 0.00 0.00 0.00 173.10 173.68 2x1e n ASN 217 N 0.18 0.96 0.08 1.64 0.23 -0.51 -0.18 115.26 117.66 2x1e n ASN 217 Ca -0.16 -0.07 0.09 0.00 -0.53 0.00 0.00 54.58 53.91 2x1e n ASN 217 Cb 0.61 0.00 0.41 0.00 -2.08 0.00 0.00 39.78 38.72 2x1e n ASN 217 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2x1e n GLY 218 N 2.41 -1.11 0.00 4.83 0.00 -1.26 -4.04 105.19 106.02 2x1e n GLY 218 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2x1e n GLY 218 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2x1e n HIS 219 N -1.95 0.00 -3.53 1.61 8.25 -1.26 -4.46 115.22 113.88 2x1e n HIS 219 Ca 0.02 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.37 2x1e n HIS 219 Cb 0.18 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.27 2x1e n HIS 219 CO 0.00 0.00 0.00 -1.83 0.64 0.00 0.00 176.34 175.15 2x1e s GLU 220 N -1.21 1.38 -0.01 -0.41 -1.05 -1.26 -5.19 118.70 110.96 2x1e s GLU 220 Ca 0.00 -0.60 -0.24 0.00 -0.15 0.00 0.00 54.97 53.98 2x1e s GLU 220 Cb 0.00 0.59 0.05 0.00 -0.44 0.00 0.00 34.13 34.33 2x1e s GLU 220 CO 0.00 -0.61 0.52 0.00 0.95 0.00 0.00 175.26 176.12 2x1e s ALA 221 N -3.79 -1.34 0.02 -0.84 0.00 -1.26 -1.43 121.76 113.12 2x1e s ALA 221 Ca 0.03 0.79 -0.06 0.00 0.00 0.00 0.00 51.96 52.73 2x1e s ALA 221 Cb -0.02 0.15 -0.01 0.00 0.00 0.00 0.00 23.12 23.25 2x1e s ALA 221 CO -0.08 -0.39 0.11 -0.59 0.00 0.00 0.00 175.76 174.81 2x1e s PHE 222 N -1.67 0.14 0.09 0.00 -0.12 -0.45 -4.49 117.98 111.48 2x1e s PHE 222 Ca -0.10 -0.36 0.05 0.00 -0.05 0.00 0.00 56.93 56.48 2x1e s PHE 222 Cb -0.02 -0.10 -0.04 0.00 -0.63 0.00 0.00 43.02 42.23 2x1e s PHE 222 CO 0.04 -0.33 -0.03 0.20 -0.05 0.00 0.00 175.22 175.05 2x1e s GLY 223 N -1.81 1.89 -0.17 1.99 0.00 0.11 -1.13 107.32 108.19 2x1e s GLY 223 Ca -0.09 -1.15 0.01 0.00 0.00 0.00 0.00 44.72 43.48 2x1e s GLY 223 CO -0.02 -1.13 -0.17 1.08 0.00 0.00 0.00 173.10 172.86 2x1e s LEU 224 N -2.28 1.99 -0.22 0.66 1.43 0.85 0.48 118.68 121.59 2x1e s LEU 224 Ca 0.24 -0.61 -0.11 0.00 -1.03 0.00 0.00 54.13 52.63 2x1e s LEU 224 Cb -0.12 -1.36 -0.05 0.00 0.03 0.00 0.00 46.19 44.70 2x1e s LEU 224 CO 0.17 -0.03 0.16 -1.61 0.23 0.00 0.00 176.35 175.27 2x1e s GLU 225 N 1.37 4.12 0.03 1.70 2.02 -0.20 -1.83 118.70 125.89 2x1e s GLU 225 Ca 0.05 -0.23 -0.03 0.00 0.02 0.00 0.00 54.97 54.77 2x1e s GLU 225 Cb -0.13 -3.50 -0.02 0.00 0.10 0.00 0.00 34.13 30.59 2x1e s GLU 225 CO -0.12 0.14 0.04 -0.59 0.02 0.00 0.00 175.26 174.75 2x1e s PHE 226 N 0.82 0.24 0.36 1.61 -0.12 -1.04 -0.74 117.98 119.11 2x1e s PHE 226 Ca 0.08 -0.53 0.04 0.00 -0.05 0.00 0.00 56.93 56.48 2x1e s PHE 226 Cb -0.13 -0.18 -0.02 0.00 -0.63 0.00 0.00 43.02 42.07 2x1e s PHE 226 CO 0.02 -0.29 0.15 -1.13 -0.05 0.00 0.00 175.22 173.93 2x1e n SER 227 N 1.11 0.86 0.03 1.98 3.41 0.69 -3.16 113.62 118.55 2x1e n SER 227 Ca -0.21 -2.97 0.05 0.00 -0.26 0.00 0.00 58.87 55.48 2x1e n SER 227 Cb 0.57 1.04 0.22 0.00 -0.26 0.00 0.00 64.21 65.79 2x1e n SER 227 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 2x1e n PRO 228 N -0.79 0.04 -0.06 4.33 -0.02 -1.23 -2.73 135.00 134.55 2x1e n PRO 228 Ca -0.03 0.43 0.03 0.00 -2.02 0.00 0.00 63.50 61.90 2x1e n PRO 228 Cb 0.55 -1.59 0.04 0.00 -0.02 0.00 0.00 33.50 32.48 2x1e n PRO 228 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2x1e n THR 229 N -1.67 1.02 -3.66 3.45 -2.24 -1.26 -4.60 114.28 105.33 2x1e n THR 229 Ca 0.01 -1.12 -0.07 0.00 -2.27 0.00 0.00 64.05 60.60 2x1e n THR 229 Cb 0.08 0.37 -0.08 0.00 -2.10 0.00 0.00 70.33 68.61 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 -1.36 -0.80 -0.31 3.42 0.15 -1.11 -4.96 113.70 108.73 2x1e s SER 230 Ca 0.09 1.32 0.00 0.00 0.70 0.00 0.00 55.95 58.06 2x1e s SER 230 Cb 0.08 1.44 0.10 0.00 -1.71 0.00 0.00 66.02 65.93 2x1e s SER 230 CO 0.01 -0.22 0.09 -0.63 1.20 0.00 0.00 173.24 173.68 2x1e s ILE 231 N 1.99 1.16 -0.10 6.45 1.01 -1.26 -0.22 121.20 130.23 2x1e s ILE 231 Ca -0.08 -1.58 -0.01 0.00 0.00 0.00 0.00 60.65 58.98 2x1e s ILE 231 Cb -0.08 -1.87 -0.03 0.00 0.01 0.00 0.00 42.46 40.49 2x1e s ILE 231 CO -0.17 -0.65 -0.05 -0.13 0.00 0.00 0.00 174.94 173.94 2x1e s ARG 232 N 1.47 3.07 -0.21 2.79 1.81 0.08 -4.97 118.95 122.99 2x1e s ARG 232 Ca 0.10 -0.53 -0.12 0.00 -1.72 0.00 0.00 55.73 53.46 2x1e s ARG 232 Cb -0.18 -2.71 -0.05 0.00 -0.45 0.00 0.00 34.95 31.56 2x1e s ARG 232 CO -0.21 0.53 0.23 0.21 -0.68 0.00 0.00 175.30 175.38 2x1e s LYS 233 N -0.44 4.16 -0.09 3.54 2.20 -1.26 -1.04 119.74 126.81 2x1e s LYS 233 Ca 0.07 -0.09 -0.14 0.00 -0.36 0.00 0.00 55.97 55.44 2x1e s LYS 233 Cb -0.12 -3.49 -0.05 0.00 -1.51 0.00 0.00 37.83 32.66 2x1e s LYS 233 CO 0.02 0.13 0.36 -1.14 -0.36 0.00 0.00 175.35 174.36 2x1e s GLN 234 N 0.83 4.06 0.36 4.03 0.74 0.18 -4.93 119.66 124.93 2x1e s GLN 234 Ca 0.12 0.26 0.09 0.00 0.05 0.00 0.00 55.36 55.88 2x1e s GLN 234 Cb -0.13 -3.33 -0.07 0.00 1.10 0.00 0.00 33.01 30.59 2x1e s GLN 234 CO 0.04 0.45 -0.06 0.14 -0.55 0.00 0.00 175.29 175.31 2x1e s VAL 235 N -0.25 2.24 0.34 1.34 -7.23 -1.26 -0.71 120.40 114.86 2x1e s VAL 235 Ca 0.21 -2.13 -0.28 0.00 -1.81 0.00 0.00 61.98 57.97 2x1e s VAL 235 Cb -0.15 -2.74 -0.12 0.00 0.56 0.00 0.00 36.38 33.93 2x1e s VAL 235 CO 0.09 -0.16 1.34 0.18 -0.31 0.00 0.00 175.10 176.24 2x1e n LEU 236 N -0.86 3.71 0.00 1.32 4.77 -1.26 -4.84 117.00 119.85 2x1e n LEU 236 Ca -0.05 1.20 -0.01 0.00 -0.03 0.00 0.00 56.01 57.12 2x1e n LEU 236 Cb 0.64 -1.50 0.01 0.00 -2.33 0.00 0.00 43.42 40.24 2x1e n LEU 236 CO 0.45 -0.37 0.03 -0.90 -1.33 0.00 0.00 177.39 175.26 2x1e n ASP 237 N 0.89 0.01 0.32 -1.43 5.68 -0.10 -4.85 116.55 117.07 2x1e n ASP 237 Ca 0.05 -1.02 0.20 0.00 -0.50 0.00 0.00 54.79 53.52 2x1e n ASP 237 Cb 0.36 -0.04 1.03 0.00 -1.14 0.00 0.00 41.12 41.34 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 -1.86 1.04 -0.42 2.12 0.00 -1.95 -1.84 119.26 116.34 2x1e h ALA 238 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2x1e h ALA 238 Cb 0.04 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2x1e h ALA 238 CO 0.01 0.01 0.00 0.09 0.00 0.00 0.00 179.25 179.36 2x1e n ASN 239 N -3.15 2.84 -0.83 0.00 3.02 -1.26 -4.93 115.26 110.96 2x1e n ASN 239 Ca -0.02 -1.94 -0.08 0.00 -0.03 0.00 0.00 54.58 52.52 2x1e n ASN 239 Cb 0.15 -0.28 -0.01 0.00 -0.61 0.00 0.00 39.78 39.03 2x1e n ASN 239 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2x1e n GLY 240 N 1.37 0.24 3.41 7.41 0.00 -0.69 -4.76 105.19 112.17 2x1e n GLY 240 Ca 0.18 -0.59 -0.29 0.00 0.00 0.00 0.00 46.02 45.32 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 -4.04 1.48 -0.03 1.61 0.52 -1.26 -0.65 118.95 116.58 2x1e s ARG 241 Ca 0.00 -1.32 -0.00 0.00 -0.52 0.00 0.00 55.73 53.89 2x1e s ARG 241 Cb 0.00 -1.94 0.03 0.00 0.52 0.00 0.00 34.95 33.55 2x1e s ARG 241 CO 0.00 0.46 0.01 1.41 0.02 0.00 0.00 175.30 177.20 2x1e s MET 242 N -2.09 0.22 -0.03 3.54 1.75 -0.36 -0.93 119.30 121.40 2x1e s MET 242 Ca 0.15 0.14 0.04 0.00 -1.25 0.00 0.00 55.69 54.77 2x1e s MET 242 Cb -0.10 -0.49 -0.01 0.00 2.84 0.00 0.00 34.83 37.08 2x1e s MET 242 CO 0.07 -0.18 -0.16 0.08 -0.65 0.00 0.00 175.02 174.17 2x1e s VAL 243 N 1.26 1.35 -0.03 10.11 1.01 -1.26 -0.78 120.40 132.06 2x1e s VAL 243 Ca -0.06 -0.69 -0.04 0.00 0.00 0.00 0.00 61.98 61.19 2x1e s VAL 243 Cb -0.13 -1.15 0.01 0.00 0.00 0.00 0.00 36.38 35.11 2x1e s VAL 243 CO -0.02 0.39 0.10 -2.28 0.00 0.00 0.00 175.10 173.29 2x1e s HIS 244 N -0.07 -0.07 0.00 5.22 2.46 0.06 -5.00 115.29 117.89 2x1e s HIS 244 Ca -0.01 0.18 0.00 0.00 0.47 0.00 0.00 55.06 55.70 2x1e s HIS 244 Cb -0.10 0.01 0.00 0.00 -0.13 0.00 0.00 32.58 32.36 2x1e s HIS 244 CO 0.01 -0.10 0.00 0.25 -2.47 0.00 0.00 174.74 172.43 2x1e n THR 245 N 2.71 0.00 -1.46 0.89 -2.24 -1.26 -0.64 114.28 112.29 2x1e n THR 245 Ca -0.15 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.71 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 1.85 -4.11 3.42 4.13 -1.26 -4.70 115.26 114.60 2x1e n ASN 246 Ca 0.00 -3.40 -0.08 0.00 1.68 0.00 0.00 54.58 52.78 2x1e n ASN 246 Cb 0.00 -0.46 -0.10 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 -2.79 0.60 -0.01 3.10 -3.43 -1.26 -4.56 115.29 106.94 2x1e s HIS 247 Ca 0.34 -1.04 -0.30 0.00 -0.80 0.00 0.00 55.06 53.26 2x1e s HIS 247 Cb 0.32 -0.42 -0.06 0.00 -1.43 0.00 0.00 32.58 31.00 2x1e s HIS 247 CO -0.03 -0.34 1.45 0.00 -2.00 0.00 0.00 174.74 173.82 2x1e n LEU 249 N 5.66 0.04 -4.92 0.00 4.77 -1.26 -4.98 117.00 116.31 2x1e n LEU 249 Ca 0.14 0.01 -0.29 0.00 -0.03 0.00 0.00 56.01 55.84 2x1e n LEU 249 Cb 0.43 0.07 -0.04 0.00 -2.33 0.00 0.00 43.42 41.55 2x1e n LEU 249 CO 0.59 0.06 -0.06 -0.76 -1.33 0.00 0.00 177.39 175.89 2x1e s LEU 250 N -4.69 4.30 -0.10 2.23 1.43 -1.26 -5.06 118.68 115.53 2x1e s LEU 250 Ca -0.08 0.34 -0.30 0.00 -1.03 0.00 0.00 54.13 53.07 2x1e s LEU 250 Cb 0.13 -3.07 -0.02 0.00 0.03 0.00 0.00 46.19 43.26 2x1e s LEU 250 CO 0.89 0.07 1.17 0.00 0.23 0.00 0.00 176.35 178.71 2x1e s GLN 251 N -2.89 4.33 0.45 1.70 -2.07 -1.26 -5.03 119.66 114.89 2x1e s GLN 251 Ca 0.37 1.60 0.08 0.00 -1.82 0.00 0.00 55.36 55.58 2x1e s GLN 251 Cb -0.12 -3.61 0.00 0.00 -1.09 0.00 0.00 33.01 28.19 2x1e s GLN 251 CO 0.28 -0.50 0.46 -1.01 -1.32 0.00 0.00 175.29 173.19 2x1e s HIS 252 N 2.55 2.49 1.04 9.60 3.76 -1.26 -5.03 115.29 128.44 2x1e s HIS 252 Ca 0.53 -0.54 -0.14 0.00 -0.15 0.00 0.00 55.06 54.77 2x1e s HIS 252 Cb -0.22 -2.19 0.12 0.00 1.11 0.00 0.00 32.58 31.40 2x1e s HIS 252 CO 0.18 -0.32 0.50 0.41 -0.85 0.00 0.00 174.74 174.67 2x1e n GLY 253 N -1.70 -1.91 0.33 -2.22 0.00 -1.26 -4.87 105.19 93.56 2x1e n GLY 253 Ca 0.05 -0.83 0.01 0.00 0.00 0.00 0.00 46.02 45.24 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 -1.98 0.86 0.00 1.61 1.57 -2.01 -2.49 116.57 114.13 2x1e h LYS 254 Ca -0.50 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.21 2x1e h LYS 254 Cb 1.31 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.44 2x1e h LYS 254 CO 0.39 0.61 0.00 -1.71 -0.57 0.00 0.00 179.45 178.17 2x1e n ASN 255 N -4.40 0.72 -4.76 0.86 5.15 -1.26 -4.84 115.26 106.72 2x1e n ASN 255 Ca 0.06 0.64 -0.39 0.00 -0.60 0.00 0.00 54.58 54.29 2x1e n ASN 255 Cb 0.08 -0.81 -0.04 0.00 -0.53 0.00 0.00 39.78 38.48 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 -3.26 4.45 -0.04 1.20 0.41 -0.94 -5.04 118.70 115.48 2x1e s GLU 256 Ca 0.06 1.80 -0.02 0.00 -0.41 0.00 0.00 54.97 56.40 2x1e s GLU 256 Cb 0.10 -3.00 0.03 0.00 -1.78 0.00 0.00 34.13 29.48 2x1e s GLU 256 CO 0.45 0.04 0.05 0.21 -0.49 0.00 0.00 175.26 175.52 2x1e s LYS 257 N -1.77 0.04 -0.08 1.61 2.20 -1.26 -4.96 119.74 115.52 2x1e s LYS 257 Ca 0.49 0.32 -0.24 0.00 -0.36 0.00 0.00 55.97 56.18 2x1e s LYS 257 Cb -0.31 -0.57 -0.03 0.00 -1.51 0.00 0.00 37.83 35.41 2x1e s LYS 257 CO 0.40 -0.31 0.72 -2.00 -0.36 0.00 0.00 175.35 173.79 2x1e s GLU 258 N 2.07 4.42 -0.37 4.03 2.12 -1.26 -0.29 118.70 129.41 2x1e s GLU 258 Ca 0.04 0.90 -0.09 0.00 0.36 0.00 0.00 54.97 56.18 2x1e s GLU 258 Cb -0.12 -3.47 0.04 0.00 0.26 0.00 0.00 34.13 30.84 2x1e s GLU 258 CO -0.03 0.01 0.18 -0.51 -0.54 0.00 0.00 175.26 174.36 2x1e s LEU 259 N 0.99 4.64 -1.40 2.70 1.43 0.15 -4.79 118.68 122.41 2x1e s LEU 259 Ca 0.38 -1.12 -0.02 0.00 -1.03 0.00 0.00 54.13 52.33 2x1e s LEU 259 Cb -0.18 -1.96 0.00 0.00 0.03 0.00 0.00 46.19 44.08 2x1e s LEU 259 CO 0.17 -0.39 0.39 0.47 0.23 0.00 0.00 176.35 177.23 2x1e n ASP 260 N 4.92 -0.52 -4.78 2.29 8.00 -1.26 -4.81 116.55 120.39 2x1e n ASP 260 Ca -0.12 -1.05 -0.34 0.00 0.71 0.00 0.00 54.79 54.00 2x1e n ASP 260 Cb 0.45 -2.86 0.02 0.00 -0.02 0.00 0.00 41.12 38.71 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 -6.64 3.14 0.27 -0.24 0.04 -1.26 -4.97 135.00 125.34 2x1e s PRO 261 Ca 0.04 1.47 -0.29 0.00 0.04 0.00 0.00 61.00 62.26 2x1e s PRO 261 Cb -0.02 -1.99 -0.10 0.00 0.04 0.00 0.00 34.50 32.44 2x1e s PRO 261 CO 0.90 -1.00 1.24 -0.51 0.04 0.00 0.00 177.00 177.68 2x1e s LEU 262 N -4.29 4.46 0.27 -3.56 1.43 -1.26 -4.93 118.68 110.80 2x1e s LEU 262 Ca 0.69 2.47 0.00 0.00 -1.03 0.00 0.00 54.13 56.26 2x1e s LEU 262 Cb -0.21 -3.63 0.55 0.00 0.03 0.00 0.00 46.19 42.92 2x1e s LEU 262 CO 0.34 -0.42 1.81 -0.65 0.23 0.00 0.00 176.35 177.66 2x1e h PRO 263 N 4.19 0.83 0.00 1.29 0.11 -2.01 -1.36 132.00 135.04 2x1e h PRO 263 Ca -0.47 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2x1e h PRO 263 Cb 1.22 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2x1e h PRO 263 CO 0.70 0.55 0.00 0.38 -0.21 0.00 0.00 178.00 179.41 2x1e h ASP 264 N 0.85 0.00 -1.00 -2.05 3.04 -1.91 -2.24 116.42 113.11 2x1e h ASP 264 Ca 0.48 0.00 0.07 0.00 -3.24 0.00 0.00 57.03 54.34 2x1e h ASP 264 Cb 0.56 0.00 -0.07 0.00 -1.04 0.00 0.00 39.33 38.78 2x1e h ASP 264 CO -0.30 0.00 0.65 -1.28 -2.04 0.00 0.00 179.24 176.27 2x1e h SER 265 N 0.00 1.03 -0.31 4.15 0.87 -1.61 0.24 113.55 117.93 2x1e h SER 265 Ca 0.00 0.01 -0.07 0.00 -1.23 0.00 0.00 61.79 60.50 2x1e h SER 265 Cb 0.11 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 61.86 2x1e h SER 265 CO 0.00 0.65 -0.09 -0.50 -0.53 0.00 0.00 176.83 176.36 2x1e h TRP 266 N 1.17 0.69 -0.36 2.24 6.55 -1.56 -2.84 115.95 121.83 2x1e h TRP 266 Ca 0.43 -0.15 0.00 0.00 0.95 0.00 0.00 58.89 60.12 2x1e h TRP 266 Cb 0.18 -0.17 -0.02 0.00 -0.86 0.00 0.00 29.16 28.29 2x1e h TRP 266 CO -0.00 0.81 0.23 -0.97 -1.05 0.00 0.00 178.44 177.45 2x1e h ASN 267 N 0.38 0.42 -0.23 -3.49 -0.73 -1.38 -2.33 115.58 108.22 2x1e h ASN 267 Ca 0.08 -0.03 -0.08 0.00 1.87 0.00 0.00 56.30 58.14 2x1e h ASN 267 Cb 0.59 -0.11 -0.02 0.00 0.27 0.00 0.00 38.32 39.06 2x1e h ASN 267 CO 0.03 0.32 -0.11 0.03 -0.37 0.00 0.00 177.43 177.33 2x1e h ARG 268 N 0.48 0.63 -0.04 6.67 3.08 -0.61 -0.08 114.38 124.51 2x1e h ARG 268 Ca 0.13 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 59.98 2x1e h ARG 268 Cb -0.03 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 29.96 2x1e h ARG 268 CO -0.03 0.73 -0.01 1.25 -1.07 0.00 0.00 179.97 180.84 2x1e h HIS 269 N 0.58 0.09 -0.51 3.04 2.76 -1.33 0.19 115.15 119.97 2x1e h HIS 269 Ca 0.10 -0.02 0.05 0.00 -2.20 0.00 0.00 60.37 58.30 2x1e h HIS 269 Cb 0.54 -0.02 -0.05 0.00 1.55 0.00 0.00 27.41 29.43 2x1e h HIS 269 CO 0.02 0.42 0.24 0.37 -1.30 0.00 0.00 177.93 177.68 2x1e h GLN 270 N -0.27 0.45 -0.11 5.26 4.15 -1.35 -1.55 115.11 121.70 2x1e h GLN 270 Ca 0.01 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.40 2x1e h GLN 270 Cb 0.39 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.97 2x1e h GLN 270 CO 0.00 0.30 0.07 -0.09 -1.93 0.00 0.00 178.83 177.18 2x1e h ARG 271 N 0.47 0.14 -0.75 1.69 9.65 -0.90 -1.66 114.38 123.02 2x1e h ARG 271 Ca 0.23 -0.01 -0.03 0.00 -1.10 0.00 0.00 59.98 59.07 2x1e h ARG 271 Cb 0.16 -0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 28.68 2x1e h ARG 271 CO -0.18 0.11 0.36 1.98 2.80 0.00 0.00 179.97 185.04 2x1e h MET 272 N 0.13 1.08 -0.70 0.20 4.05 -0.73 0.15 114.93 119.11 2x1e h MET 272 Ca 0.04 -0.16 -0.02 0.00 -0.28 0.00 0.00 59.70 59.28 2x1e h MET 272 Cb 0.00 -0.19 -0.03 0.00 -0.80 0.00 0.00 31.60 30.58 2x1e h MET 272 CO -0.01 0.84 0.36 0.93 0.23 0.00 0.00 176.91 179.26 2x1e h GLU 273 N 1.06 0.99 -0.09 0.39 5.08 -1.21 0.10 114.58 120.91 2x1e h GLU 273 Ca 0.26 -0.13 0.02 0.00 -1.00 0.00 0.00 59.36 58.50 2x1e h GLU 273 Cb 0.12 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 2x1e h GLU 273 CO -0.03 0.76 -0.02 0.35 -1.00 0.00 0.00 179.01 179.08 2x1e h PHE 274 N 0.97 -0.03 -0.67 4.33 3.57 -0.98 -2.50 116.94 121.63 2x1e h PHE 274 Ca 0.24 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.77 2x1e h PHE 274 Cb 0.08 0.03 -0.04 0.00 2.79 0.00 0.00 35.95 38.81 2x1e h PHE 274 CO 0.00 -0.03 0.42 -0.07 -2.23 0.00 0.00 178.31 176.40 2x1e h LEU 275 N 0.01 0.70 -1.92 0.59 3.38 -0.54 -2.10 115.31 115.44 2x1e h LEU 275 Ca 0.04 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 2x1e h LEU 275 Cb 0.06 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 2x1e h LEU 275 CO -0.08 0.49 -0.09 -0.07 0.09 0.00 0.00 178.44 178.78 2x1e h LEU 276 N 0.84 0.00 -1.02 1.67 3.38 -0.74 -2.48 115.31 116.96 2x1e h LEU 276 Ca 0.26 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.18 2x1e h LEU 276 Cb -0.01 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 2x1e h LEU 276 CO -0.09 0.09 0.16 0.44 0.09 0.00 0.00 178.44 179.13 2x1e h ASP 277 N 0.00 0.81 -0.60 -0.43 3.32 -0.91 -2.98 116.42 115.63 2x1e h ASP 277 Ca -0.00 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 56.91 2x1e h ASP 277 Cb 0.36 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.70 2x1e h ASP 277 CO 0.01 0.77 0.00 0.61 -1.72 0.00 0.00 179.24 178.92 2x1e n GLY 278 N -0.89 2.05 3.69 2.75 0.00 -0.96 -4.95 105.19 106.88 2x1e n GLY 278 Ca 0.04 -0.74 -0.42 0.00 0.00 0.00 0.00 46.02 44.90 2x1e n GLY 278 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2x1e s PHE 279 N -1.21 3.32 -1.71 1.61 5.36 -1.02 -4.94 117.98 119.40 2x1e s PHE 279 Ca 0.44 1.35 0.29 0.00 -0.96 0.00 0.00 56.93 58.05 2x1e s PHE 279 Cb 0.24 -3.34 1.32 0.00 -0.34 0.00 0.00 43.02 40.90 2x1e s PHE 279 CO 0.32 -0.94 1.91 -0.40 -1.46 0.00 0.00 175.22 174.65 2x1e n ASP 280 N 5.04 0.42 0.00 6.13 5.68 -1.26 -4.93 116.55 127.64 2x1e n ASP 280 Ca 0.10 -0.62 0.00 0.00 -0.50 0.00 0.00 54.79 53.77 2x1e n ASP 280 Cb 0.47 -0.09 0.00 0.00 -1.14 0.00 0.00 41.12 40.37 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 1.24 1.92 3.80 6.12 0.00 -1.26 -5.07 105.19 111.94 2x1e n GLY 281 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.52 3.70 0.30 2.61 -4.23 -1.26 -4.91 115.64 109.34 2x1e s THR 282 Ca 0.00 0.99 0.01 0.00 -1.18 0.00 0.00 61.69 61.51 2x1e s THR 282 Cb 0.00 -3.41 0.15 0.00 1.34 0.00 0.00 72.50 70.59 2x1e s THR 282 CO 0.00 -0.30 1.84 0.50 -0.54 0.00 0.00 174.62 176.12 2x1e h LYS 283 N 1.19 0.69 -0.13 3.99 3.64 -1.99 -1.30 116.57 122.66 2x1e h LYS 283 Ca -0.49 -0.15 0.01 0.00 -1.27 0.00 0.00 60.65 58.76 2x1e h LYS 283 Cb 1.23 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.93 2x1e h LYS 283 CO 0.58 0.67 0.05 0.37 -2.27 0.00 0.00 179.45 178.85 2x1e h GLN 284 N 0.67 0.11 -0.38 1.90 4.15 -2.00 -1.18 115.11 118.38 2x1e h GLN 284 Ca 0.14 -0.01 -0.11 0.00 0.77 0.00 0.00 58.65 59.45 2x1e h GLN 284 Cb 0.32 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.97 2x1e h GLN 284 CO 0.01 0.07 -0.19 0.00 -1.93 0.00 0.00 178.83 176.79 2x1e h ALA 285 N 1.08 0.94 -0.47 3.38 0.00 -1.90 -2.51 119.26 119.77 2x1e h ALA 285 Ca 0.06 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2x1e h ALA 285 Cb 0.03 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2x1e h ALA 285 CO -0.05 0.61 0.30 0.35 0.00 0.00 0.00 179.25 180.46 2x1e h PHE 286 N 0.65 0.61 -0.87 0.00 3.57 -1.01 -2.51 116.94 117.38 2x1e h PHE 286 Ca 0.10 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.61 2x1e h PHE 286 Cb 0.68 -0.20 -0.04 0.00 2.79 0.00 0.00 35.95 39.18 2x1e h PHE 286 CO 0.03 0.40 0.58 0.00 -2.23 0.00 0.00 178.31 177.09 2x1e h ALA 287 N 1.16 1.38 0.00 2.41 0.00 -1.08 -2.85 119.26 120.27 2x1e h ALA 287 Ca 0.17 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 2x1e h ALA 287 Cb -0.05 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.38 2x1e h ALA 287 CO -0.04 0.58 -0.28 1.96 0.00 0.00 0.00 179.25 181.47 2x1e h GLN 288 N 1.18 0.00 -0.94 0.00 1.08 -1.05 -3.04 115.11 112.34 2x1e h GLN 288 Ca 0.32 0.00 0.17 0.00 -1.45 0.00 0.00 58.65 57.69 2x1e h GLN 288 Cb -0.14 0.00 -0.08 0.00 -0.05 0.00 0.00 27.48 27.21 2x1e h GLN 288 CO -0.07 0.28 0.60 -0.07 -0.95 0.00 0.00 178.83 178.62 2x1e h LEU 289 N 0.00 0.67 0.00 1.46 3.38 -1.21 -1.82 115.31 117.80 2x1e h LEU 289 Ca -0.00 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2x1e h LEU 289 Cb 0.64 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.32 2x1e h LEU 289 CO 0.04 0.30 0.00 0.79 0.09 0.00 0.00 178.44 179.65 2x1e n TRP 290 N -4.62 0.00 -0.13 1.13 7.02 -1.15 -2.35 117.44 117.35 2x1e n TRP 290 Ca 0.20 0.00 0.11 0.00 -1.02 0.00 0.00 57.50 56.79 2x1e n TRP 290 Cb 0.54 -0.24 0.27 0.00 -2.42 0.00 0.00 31.31 29.46 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 -1.24 2.38 -1.82 6.99 0.00 -0.68 -3.93 120.51 122.20 2x1e n ALA 291 Ca 0.14 -1.19 -0.42 0.00 0.00 0.00 0.00 53.44 51.98 2x1e n ALA 291 Cb 0.20 -0.87 -0.02 0.00 0.00 0.00 0.00 19.45 18.76 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 -1.16 6.50 -0.08 0.00 2.15 -0.99 -4.71 116.67 118.38 2x1e s ASP 292 Ca 0.44 2.80 0.11 0.00 0.43 0.00 0.00 52.55 56.33 2x1e s ASP 292 Cb 0.24 -2.62 0.19 0.00 -0.30 0.00 0.00 42.92 40.43 2x1e s ASP 292 CO 0.32 -0.84 1.12 -0.62 -0.17 0.00 0.00 175.17 174.98 2x1e n GLU 293 N 2.68 2.15 -1.85 4.34 1.02 -1.26 -1.28 120.64 126.44 2x1e n GLU 293 Ca 0.09 -2.15 -0.42 0.00 -0.02 0.00 0.00 57.16 54.66 2x1e n GLU 293 Cb 0.38 -1.32 -0.03 0.00 -0.02 0.00 0.00 31.44 30.46 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 -1.98 6.49 -0.75 1.62 2.15 -1.26 -1.60 116.67 121.34 2x1e s ASP 294 Ca 0.20 2.75 0.00 0.00 0.43 0.00 0.00 52.55 55.93 2x1e s ASP 294 Cb 0.17 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 40.18 2x1e s ASP 294 CO 0.03 -0.88 0.00 -3.20 -0.17 0.00 0.00 175.17 170.95 2x1e n ASN 295 N 3.64 -3.75 -4.50 -0.34 5.15 -1.26 -4.15 115.26 110.04 2x1e n ASN 295 Ca 0.13 0.16 -0.47 0.00 -0.60 0.00 0.00 54.58 53.80 2x1e n ASN 295 Cb 0.37 -2.00 -0.03 0.00 -0.53 0.00 0.00 39.78 37.60 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 -2.91 0.50 1.59 1.20 4.19 -0.63 -1.04 117.16 120.07 2x1e n TYR 296 Ca -0.07 0.83 0.15 0.00 3.31 0.00 0.00 57.90 62.11 2x1e n TYR 296 Cb 0.27 -2.12 0.70 0.00 0.49 0.00 0.00 39.34 38.68 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 0.99 0.92 -0.35 2.98 -0.04 -1.26 -4.86 135.00 133.38 2x1e n PRO 297 Ca 0.14 -0.27 -0.06 0.00 -0.04 0.00 0.00 63.50 63.27 2x1e n PRO 297 Cb 0.27 -1.49 0.06 0.00 -0.04 0.00 0.00 33.50 32.30 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 -0.80 0.86 -2.11 0.54 3.72 -0.20 -1.47 117.46 117.99 2x1e n PHE 298 Ca 0.18 -0.78 -0.27 0.00 -0.05 0.00 0.00 57.45 56.53 2x1e n PHE 298 Cb 0.24 -0.42 0.09 0.00 -0.94 0.00 0.00 39.48 38.45 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 0.23 4.50 0.19 4.37 1.04 -1.22 -4.85 113.70 117.96 2x1e s SER 299 Ca 0.17 0.47 -0.12 0.00 0.48 0.00 0.00 55.95 56.94 2x1e s SER 299 Cb 0.14 -0.98 0.22 0.00 0.10 0.00 0.00 66.02 65.49 2x1e s SER 299 CO 0.03 -1.83 1.72 0.40 0.98 0.00 0.00 173.24 174.53 2x1e h ILE 300 N -0.84 0.71 -2.45 -1.02 2.04 -1.77 -2.63 117.51 111.54 2x1e h ILE 300 Ca -0.44 -0.09 -0.68 0.00 1.00 0.00 0.00 64.86 64.65 2x1e h ILE 300 Cb 1.31 0.44 -0.17 0.00 -0.74 0.00 0.00 36.82 37.65 2x1e h ILE 300 CO 0.58 0.05 0.78 0.00 0.00 0.00 0.00 178.15 179.56 2x1e s ARG 302 N 2.81 4.77 0.02 0.00 3.52 -0.99 -4.78 118.95 124.31 2x1e s ARG 302 Ca 0.31 1.61 0.06 0.00 -0.13 0.00 0.00 55.73 57.58 2x1e s ARG 302 Cb -0.07 -3.25 -0.03 0.00 -1.56 0.00 0.00 34.95 30.05 2x1e s ARG 302 CO -0.07 0.40 -0.16 0.00 -0.81 0.00 0.00 175.30 174.65 2x1e s ALA 303 N -1.16 2.65 -0.07 6.12 0.00 -0.54 -0.85 121.76 127.91 2x1e s ALA 303 Ca 0.42 -1.13 -0.30 0.00 0.00 0.00 0.00 51.96 50.96 2x1e s ALA 303 Cb -0.28 -0.83 -0.02 0.00 0.00 0.00 0.00 23.12 21.99 2x1e s ALA 303 CO 0.35 0.57 1.05 -0.47 0.00 0.00 0.00 175.76 177.27 2x1e s TYR 304 N -0.89 3.47 -0.22 0.00 5.04 -1.08 -4.61 117.35 119.07 2x1e s TYR 304 Ca 0.14 1.52 -0.04 0.00 -2.44 0.00 0.00 57.07 56.25 2x1e s TYR 304 Cb -0.11 -3.24 0.10 0.00 0.35 0.00 0.00 41.96 39.06 2x1e s TYR 304 CO 0.04 -0.48 0.21 -2.00 -1.34 0.00 0.00 175.55 171.99 2x1e s GLU 305 N 1.83 0.19 0.04 4.97 2.12 -0.88 -4.99 118.70 121.99 2x1e s GLU 305 Ca 0.51 0.08 -0.34 0.00 0.36 0.00 0.00 54.97 55.59 2x1e s GLU 305 Cb -0.21 -1.21 -0.12 0.00 0.26 0.00 0.00 34.13 32.85 2x1e s GLU 305 CO 0.21 -0.73 1.76 -1.91 -0.54 0.00 0.00 175.26 174.05 2x1e n GLU 306 N 5.31 2.27 -0.08 4.30 4.07 -1.26 -0.68 120.64 134.57 2x1e n GLU 306 Ca -0.05 0.83 0.00 0.00 -0.06 0.00 0.00 57.16 57.87 2x1e n GLU 306 Cb 0.49 -2.65 0.00 0.00 -0.06 0.00 0.00 31.44 29.21 2x1e n GLU 306 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2x1e n GLY 307 N 4.00 0.73 1.42 8.31 0.00 -1.26 -4.87 105.19 113.51 2x1e n GLY 307 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 -5.05 1.61 5.02 0.15 -5.08 118.16 112.81 2x1e n LYS 308 Ca 0.00 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.99 2x1e n LYS 308 Cb 0.00 -0.25 -0.17 0.00 -0.02 0.00 0.00 35.03 34.59 2x1e n LYS 308 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2x1e s SER 309 N -5.42 2.69 0.30 4.39 1.04 -0.28 -5.00 113.70 111.42 2x1e s SER 309 Ca 0.00 -0.47 0.23 0.00 0.48 0.00 0.00 55.95 56.19 2x1e s SER 309 Cb 0.00 -1.10 0.22 0.00 0.10 0.00 0.00 66.02 65.24 2x1e s SER 309 CO 0.00 0.14 1.36 0.03 0.98 0.00 0.00 173.24 175.75 2x1e h ARG 310 N 6.62 0.00 -5.06 4.02 3.08 -1.87 -2.34 114.38 118.82 2x1e h ARG 310 Ca -0.25 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.23 2x1e h ARG 310 Cb 1.21 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 31.13 2x1e h ARG 310 CO 0.47 0.00 -0.52 0.20 -1.07 0.00 0.00 179.97 179.06 2x1e s GLY 311 N -4.20 2.65 0.17 0.04 0.00 -1.26 -4.58 107.32 100.14 2x1e s GLY 311 Ca 0.04 -1.17 -0.02 0.00 0.00 0.00 0.00 44.72 43.56 2x1e s GLY 311 CO 0.72 -1.87 0.13 0.00 0.00 0.00 0.00 173.10 172.09 2x1e s ALA 312 N -3.18 0.91 -0.05 3.20 0.00 -0.82 -2.64 121.76 119.18 2x1e s ALA 312 Ca 0.22 -1.52 -0.30 0.00 0.00 0.00 0.00 51.96 50.36 2x1e s ALA 312 Cb 0.02 1.15 -0.05 0.00 0.00 0.00 0.00 23.12 24.25 2x1e s ALA 312 CO 0.14 -0.57 1.44 0.99 0.00 0.00 0.00 175.76 177.75 2x1e s THR 313 N -4.10 3.81 -0.12 0.00 2.01 -0.03 -1.75 115.64 115.47 2x1e s THR 313 Ca 0.31 1.10 0.20 0.00 0.31 0.00 0.00 61.69 63.61 2x1e s THR 313 Cb 0.07 -3.71 -0.29 0.00 0.01 0.00 0.00 72.50 68.58 2x1e s THR 313 CO 0.07 -0.05 0.25 0.18 -0.69 0.00 0.00 174.62 174.38 2x1e n LEU 314 N 6.14 0.00 -3.47 4.42 4.77 0.80 -3.44 117.00 126.23 2x1e n LEU 314 Ca 0.14 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 56.02 2x1e n LEU 314 Cb 0.44 0.28 -0.02 0.00 -2.33 0.00 0.00 43.42 41.78 2x1e n LEU 314 CO 0.59 0.28 0.55 0.72 -1.33 0.00 0.00 177.39 178.19 2x1e s PHE 315 N -2.94 -0.45 -0.02 -1.77 -0.71 -1.20 -0.39 117.98 110.51 2x1e s PHE 315 Ca -0.09 0.31 0.06 0.00 -1.04 0.00 0.00 56.93 56.17 2x1e s PHE 315 Cb 0.09 0.54 -0.01 0.00 -1.21 0.00 0.00 43.02 42.43 2x1e s PHE 315 CO 0.86 -0.68 -0.20 1.21 -1.34 0.00 0.00 175.22 175.07 2x1e s ASN 316 N -2.53 2.34 -0.02 1.98 3.84 0.21 -0.62 114.94 120.14 2x1e s ASN 316 Ca 0.02 -0.36 0.03 0.00 0.21 0.00 0.00 52.86 52.76 2x1e s ASN 316 Cb -0.01 -0.30 -0.00 0.00 -0.55 0.00 0.00 41.25 40.39 2x1e s ASN 316 CO -0.10 0.24 -0.12 -0.51 -2.79 0.00 0.00 177.10 173.82 2x1e s ILE 317 N -0.42 0.99 -0.15 -5.21 2.07 -0.73 -0.48 121.20 117.26 2x1e s ILE 317 Ca 0.07 -0.49 -0.00 0.00 -1.41 0.00 0.00 60.65 58.81 2x1e s ILE 317 Cb -0.08 -0.86 0.03 0.00 0.13 0.00 0.00 42.46 41.69 2x1e s ILE 317 CO -0.00 0.29 -0.09 -0.63 -1.91 0.00 0.00 174.94 172.60 2x1e s ILE 318 N 0.01 1.31 -0.36 2.00 1.01 0.14 -1.87 121.20 123.44 2x1e s ILE 318 Ca -0.01 -0.60 -0.19 0.00 0.00 0.00 0.00 60.65 59.85 2x1e s ILE 318 Cb -0.08 -1.35 0.00 0.00 0.01 0.00 0.00 42.46 41.04 2x1e s ILE 318 CO 0.01 0.30 0.57 -0.31 0.00 0.00 0.00 174.94 175.50 2x1e s TYR 319 N 1.57 3.16 -0.94 3.97 2.02 0.35 -0.73 117.35 126.75 2x1e s TYR 319 Ca 0.03 0.20 -0.18 0.00 -0.37 0.00 0.00 57.07 56.75 2x1e s TYR 319 Cb -0.14 -3.04 0.14 0.00 -0.40 0.00 0.00 41.96 38.51 2x1e s TYR 319 CO -0.09 -0.61 1.12 0.34 -1.57 0.00 0.00 175.55 174.75 2x1e s ASP 320 N 1.80 6.67 0.32 2.29 -1.08 0.39 -2.43 116.67 124.61 2x1e s ASP 320 Ca 0.21 -2.14 0.01 0.00 -0.52 0.00 0.00 52.55 50.11 2x1e s ASP 320 Cb -0.15 -2.39 0.56 0.00 -1.46 0.00 0.00 42.92 39.49 2x1e s ASP 320 CO 0.14 -1.01 1.94 0.45 0.52 0.00 0.00 175.17 177.22 2x1e h HIS 321 N 8.66 0.96 -0.93 -5.34 3.86 -1.78 -0.49 115.15 120.09 2x1e h HIS 321 Ca 0.16 0.02 0.14 0.00 -1.16 0.00 0.00 60.37 59.54 2x1e h HIS 321 Cb 1.02 -0.32 -0.09 0.00 1.06 0.00 0.00 27.41 29.07 2x1e h HIS 321 CO 1.15 0.54 0.55 0.00 0.86 0.00 0.00 177.93 181.03 2x1e h ALA 322 N 1.53 1.44 -0.01 2.45 0.00 -1.85 -3.05 119.26 119.77 2x1e h ALA 322 Ca 0.34 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.30 2x1e h ALA 322 Cb 0.11 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2x1e h ALA 322 CO -0.11 0.05 -0.21 0.54 0.00 0.00 0.00 179.25 179.52 2x1e n ARG 323 N -4.75 1.68 -3.70 0.00 1.74 -0.90 -5.00 116.66 105.73 2x1e n ARG 323 Ca 0.19 -0.82 -0.21 0.00 -0.77 0.00 0.00 57.85 56.24 2x1e n ARG 323 Cb 0.42 -1.18 0.03 0.00 -1.02 0.00 0.00 32.46 30.71 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 0.00 -4.80 -4.91 5.56 0.63 -0.24 -5.01 116.66 107.89 2x1e n ARG 324 Ca 0.06 0.61 -0.26 0.00 -0.92 0.00 0.00 57.85 57.34 2x1e n ARG 324 Cb 0.28 -5.15 -0.15 0.00 0.45 0.00 0.00 32.46 27.88 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 -5.98 1.53 -0.20 -0.14 2.02 -1.08 -4.53 118.70 110.32 2x1e s GLU 325 Ca 0.01 -0.67 -0.02 0.00 0.02 0.00 0.00 54.97 54.31 2x1e s GLU 325 Cb -0.00 -1.48 0.00 0.00 0.10 0.00 0.00 34.13 32.75 2x1e s GLU 325 CO 0.81 0.40 -0.11 0.00 0.02 0.00 0.00 175.26 176.38 2x1e s ALA 326 N -0.43 2.60 -0.21 5.21 0.00 -0.81 -0.46 121.76 127.66 2x1e s ALA 326 Ca 0.07 -1.17 -0.14 0.00 0.00 0.00 0.00 51.96 50.72 2x1e s ALA 326 Cb -0.07 -1.46 -0.04 0.00 0.00 0.00 0.00 23.12 21.55 2x1e s ALA 326 CO -0.01 -0.35 0.33 0.99 0.00 0.00 0.00 175.76 176.73 2x1e s THR 327 N 1.32 5.25 -0.13 0.00 2.01 0.09 -0.40 115.64 123.78 2x1e s THR 327 Ca 0.04 0.56 -0.01 0.00 0.31 0.00 0.00 61.69 62.58 2x1e s THR 327 Cb -0.14 -3.66 -0.02 0.00 0.01 0.00 0.00 72.50 68.69 2x1e s THR 327 CO -0.06 0.28 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.37 2x1e s VAL 328 N 1.21 3.42 -0.20 3.82 1.01 0.11 -0.68 120.40 129.09 2x1e s VAL 328 Ca 0.16 -0.53 0.01 0.00 0.00 0.00 0.00 61.98 61.61 2x1e s VAL 328 Cb -0.14 -2.46 0.02 0.00 0.00 0.00 0.00 36.38 33.80 2x1e s VAL 328 CO 0.07 0.52 -0.17 -0.13 0.00 0.00 0.00 175.10 175.39 2x1e s ARG 329 N 0.26 2.94 0.23 2.72 0.52 0.37 -1.65 118.95 124.34 2x1e s ARG 329 Ca -0.07 -0.88 -0.28 0.00 -0.52 0.00 0.00 55.73 53.99 2x1e s ARG 329 Cb -0.15 -2.67 -0.09 0.00 0.52 0.00 0.00 34.95 32.56 2x1e s ARG 329 CO 0.04 -0.26 0.89 -1.17 0.02 0.00 0.00 175.30 174.82 2x1e s LEU 330 N 1.29 4.57 0.00 2.53 2.96 -0.23 -0.62 118.68 129.18 2x1e s LEU 330 Ca 0.03 1.83 0.00 0.00 -0.22 0.00 0.00 54.13 55.77 2x1e s LEU 330 Cb -0.14 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 42.95 2x1e s LEU 330 CO -0.11 0.13 0.00 0.61 -1.32 0.00 0.00 176.35 175.66 2x1e n GLY 331 N 1.33 -0.90 3.70 7.98 0.00 0.48 0.07 105.19 117.85 2x1e n GLY 331 Ca -0.02 -1.22 -0.40 0.00 0.00 0.00 0.00 46.02 44.37 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 4.40 0.62 1.61 0.52 -1.22 -3.61 118.95 121.27 2x1e s ARG 332 Ca 0.00 0.95 0.36 0.00 -0.52 0.00 0.00 55.73 56.52 2x1e s ARG 332 Cb 0.00 -3.49 1.97 0.00 0.52 0.00 0.00 34.95 33.95 2x1e s ARG 332 CO 0.00 -0.06 2.11 -1.35 0.02 0.00 0.00 175.30 176.01 2x1e h PRO 333 N 6.95 0.00 -0.14 3.54 0.11 -1.88 -0.49 132.00 140.09 2x1e h PRO 333 Ca -0.37 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.71 2x1e h PRO 333 Cb 1.18 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2x1e h PRO 333 CO 0.77 0.00 -0.02 1.79 -0.21 0.00 0.00 178.00 180.33 2x1e h THR 334 N 0.00 1.11 -1.05 -1.15 1.35 -1.85 -3.38 112.91 107.93 2x1e h THR 334 Ca 0.00 -0.42 -0.18 0.00 -0.55 0.00 0.00 66.41 65.26 2x1e h THR 334 Cb 0.27 1.03 -0.17 0.00 -1.73 0.00 0.00 68.15 67.55 2x1e h THR 334 CO 0.00 0.14 -0.52 -0.46 -0.25 0.00 0.00 175.52 174.43 2x1e n ASN 335 N -4.40 -3.27 -4.76 5.36 6.94 -0.26 -5.14 115.26 109.74 2x1e n ASN 335 Ca -0.01 -2.90 -0.39 0.00 -0.02 0.00 0.00 54.58 51.27 2x1e n ASN 335 Cb 0.17 1.62 0.03 0.00 -2.36 0.00 0.00 39.78 39.24 2x1e n ASN 335 CO 0.00 0.00 0.00 -2.84 -1.03 0.00 0.00 177.26 173.39 2x1e s PRO 336 N 0.81 3.40 0.22 -0.53 0.02 -0.82 -4.48 135.00 133.62 2x1e s PRO 336 Ca 0.30 2.21 -0.02 0.00 0.02 0.00 0.00 61.00 63.52 2x1e s PRO 336 Cb 0.01 -2.40 0.22 0.00 0.02 0.00 0.00 34.50 32.35 2x1e s PRO 336 CO -0.07 -0.98 1.60 -0.44 -0.33 0.00 0.00 177.00 176.79 2x1e h ASP 337 N 1.81 0.61 -5.04 2.53 3.32 -0.64 -3.47 116.42 115.55 2x1e h ASP 337 Ca -0.51 -0.26 -0.09 0.00 0.02 0.00 0.00 57.03 56.19 2x1e h ASP 337 Cb 1.28 -0.17 -0.17 0.00 0.22 0.00 0.00 39.33 40.49 2x1e h ASP 337 CO 0.59 0.93 -0.20 -1.61 -1.72 0.00 0.00 179.24 177.23 2x1e s GLU 338 N -4.29 0.83 -0.06 3.56 2.02 -1.24 -4.98 118.70 114.54 2x1e s GLU 338 Ca -0.08 -0.42 -0.04 0.00 0.02 0.00 0.00 54.97 54.46 2x1e s GLU 338 Cb 0.12 0.36 0.03 0.00 0.10 0.00 0.00 34.13 34.74 2x1e s GLU 338 CO 0.82 -0.27 0.15 1.41 0.02 0.00 0.00 175.26 177.39 2x1e s MET 339 N -2.37 0.14 0.17 1.61 1.75 -1.26 -1.07 119.30 118.27 2x1e s MET 339 Ca -0.06 0.28 -0.17 0.00 -1.25 0.00 0.00 55.69 54.49 2x1e s MET 339 Cb -0.01 -0.03 0.03 0.00 2.84 0.00 0.00 34.83 37.66 2x1e s MET 339 CO -0.02 -0.08 0.49 -0.59 -0.65 0.00 0.00 175.02 174.16 2x1e s PHE 340 N 0.57 -0.19 -0.12 4.11 -0.12 -0.66 -5.01 117.98 116.56 2x1e s PHE 340 Ca -0.04 -0.13 0.01 0.00 -0.05 0.00 0.00 56.93 56.72 2x1e s PHE 340 Cb -0.06 0.36 -0.01 0.00 -0.63 0.00 0.00 43.02 42.68 2x1e s PHE 340 CO -0.03 -0.83 -0.17 0.08 -0.05 0.00 0.00 175.22 174.22 2x1e s VAL 341 N -3.84 2.62 -0.08 -2.49 1.01 -1.26 -0.71 120.40 115.65 2x1e s VAL 341 Ca 0.06 -0.81 -0.12 0.00 0.00 0.00 0.00 61.98 61.11 2x1e s VAL 341 Cb 0.00 -2.07 -0.05 0.00 0.00 0.00 0.00 36.38 34.26 2x1e s VAL 341 CO -0.07 0.54 0.28 -0.04 0.00 0.00 0.00 175.10 175.81 2x1e s MET 342 N 0.43 3.81 -0.03 2.72 1.00 0.47 -4.95 119.30 122.75 2x1e s MET 342 Ca -0.13 0.14 -0.19 0.00 0.00 0.00 0.00 55.69 55.51 2x1e s MET 342 Cb -0.17 -3.25 0.04 0.00 0.00 0.00 0.00 34.83 31.45 2x1e s MET 342 CO 0.06 0.63 0.41 -0.98 0.00 0.00 0.00 175.02 175.14 2x1e s ARG 343 N -0.75 0.76 -0.00 2.03 1.70 -1.26 -1.93 118.95 119.50 2x1e s ARG 343 Ca 0.19 -0.06 -0.21 0.00 -0.47 0.00 0.00 55.73 55.18 2x1e s ARG 343 Cb -0.14 0.35 -0.05 0.00 -0.57 0.00 0.00 34.95 34.53 2x1e s ARG 343 CO 0.08 -0.22 0.61 -0.06 -1.08 0.00 0.00 175.30 174.63 2x1e s PHE 344 N -1.25 3.69 0.47 5.89 0.08 -1.26 -5.09 117.98 120.52 2x1e s PHE 344 Ca -0.13 1.22 0.06 0.00 0.12 0.00 0.00 56.93 58.21 2x1e s PHE 344 Cb -0.04 -2.62 0.08 0.00 -0.57 0.00 0.00 43.02 39.87 2x1e s PHE 344 CO 0.06 0.35 0.65 -0.40 -0.10 0.00 0.00 175.22 175.78 2x1e n ASP 345 N 2.73 1.57 0.23 1.36 5.68 -1.26 -4.97 116.55 121.88 2x1e n ASP 345 Ca -0.07 -2.16 0.09 0.00 -0.50 0.00 0.00 54.79 52.15 2x1e n ASP 345 Cb 0.51 -0.36 0.52 0.00 -1.14 0.00 0.00 41.12 40.65 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 -0.37 0.11 5.08 -1.99 -2.32 114.58 115.10 2x1e h GLU 346 Ca -0.22 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.07 2x1e h GLU 346 Cb 0.98 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 2x1e h GLU 346 CO 0.30 0.23 -0.03 1.49 -1.00 0.00 0.00 179.01 180.01 2x1e h GLU 347 N 0.00 0.67 -0.80 2.33 4.57 -1.99 0.16 114.58 119.52 2x1e h GLU 347 Ca -0.00 -0.23 0.08 0.00 -1.18 0.00 0.00 59.36 58.03 2x1e h GLU 347 Cb 0.62 -0.05 -0.07 0.00 -0.16 0.00 0.00 28.75 29.09 2x1e h GLU 347 CO 0.03 0.79 0.46 -0.44 -1.18 0.00 0.00 179.01 178.67 2x1e h ASP 348 N 0.48 0.68 -0.08 1.04 3.32 -1.85 -1.76 116.42 118.25 2x1e h ASP 348 Ca 0.10 0.04 -0.17 0.00 0.02 0.00 0.00 57.03 57.02 2x1e h ASP 348 Cb 0.50 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 39.96 2x1e h ASP 348 CO 0.02 0.41 -0.55 -0.33 -1.72 0.00 0.00 179.24 177.07 2x1e h GLU 349 N 0.80 0.67 -0.50 3.56 5.08 -1.16 -2.70 114.58 120.34 2x1e h GLU 349 Ca 0.38 -0.42 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2x1e h GLU 349 Cb 0.30 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 2x1e h GLU 349 CO -0.22 1.04 0.30 0.00 -1.00 0.00 0.00 179.01 179.13 2x1e h ARG 350 N 0.51 0.68 -0.62 2.33 3.08 -0.30 -2.08 114.38 117.98 2x1e h ARG 350 Ca 0.01 -0.06 0.03 0.00 0.07 0.00 0.00 59.98 60.03 2x1e h ARG 350 Cb 1.12 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.99 2x1e h ARG 350 CO 0.11 0.50 0.38 1.03 -1.07 0.00 0.00 179.97 180.92 2x1e h SER 351 N 0.66 0.62 -0.41 7.04 0.87 -1.32 0.42 113.55 121.43 2x1e h SER 351 Ca 0.18 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.73 2x1e h SER 351 Cb -0.00 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 61.81 2x1e h SER 351 CO -0.03 0.43 0.21 0.00 -0.53 0.00 0.00 176.83 176.90 2x1e h ALA 352 N 1.28 1.53 0.00 6.23 0.00 -1.23 0.82 119.26 127.89 2x1e h ALA 352 Ca 0.25 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2x1e h ALA 352 Cb 0.04 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.64 2x1e h ALA 352 CO -0.11 0.38 -0.14 1.28 0.00 0.00 0.00 179.25 180.65 2x1e n LEU 353 N -4.39 0.16 -3.11 0.00 4.77 -0.80 -3.76 117.00 109.86 2x1e n LEU 353 Ca 0.03 0.36 -0.21 0.00 -0.03 0.00 0.00 56.01 56.17 2x1e n LEU 353 Cb 0.12 -0.43 0.06 0.00 -2.33 0.00 0.00 43.42 40.85 2x1e n LEU 353 CO 0.37 0.03 0.19 -3.20 -1.33 0.00 0.00 177.39 173.45 2x1e n ASN 354 N -1.52 -5.79 -0.54 -1.43 5.15 -0.58 -4.77 115.26 105.79 2x1e n ASN 354 Ca 0.07 -0.44 0.07 0.00 -0.60 0.00 0.00 54.58 53.67 2x1e n ASN 354 Cb 0.34 -4.43 0.06 0.00 -0.53 0.00 0.00 39.78 35.22 2x1e n ASN 354 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66