#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dft s HIS 2 N 0.00 2.90 -0.19 0.54 3.76 -1.26 -5.11 115.29 115.93 3dft s HIS 2 Ca 0.00 -0.03 -0.19 0.00 -0.15 0.00 0.00 55.06 54.69 3dft s HIS 2 Cb 0.00 -1.62 -0.03 0.00 1.11 0.00 0.00 32.58 32.04 3dft s HIS 2 CO 0.00 0.37 0.54 0.45 -0.85 0.00 0.00 174.74 175.25 3dft s SER 3 N -1.35 6.60 -0.62 1.40 0.15 -1.26 -5.00 113.70 113.63 3dft s SER 3 Ca 0.17 0.72 0.05 0.00 0.70 0.00 0.00 55.95 57.59 3dft s SER 3 Cb -0.11 -2.30 0.20 0.00 -1.71 0.00 0.00 66.02 62.10 3dft s SER 3 CO 0.07 -0.18 0.56 1.41 1.20 0.00 0.00 173.24 176.30 3dft n HIS 4 N 4.73 2.55 -0.41 3.44 8.25 -1.26 -5.07 115.22 127.45 3dft n HIS 4 Ca -0.04 -4.07 -0.18 0.00 -0.26 0.00 0.00 57.72 53.16 3dft n HIS 4 Cb 0.50 -0.47 -0.03 0.00 1.12 0.00 0.00 29.99 31.11 3dft n HIS 4 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 3dft n PRO 5 N 1.65 0.00 0.10 -0.41 -0.02 -1.26 -4.83 135.00 130.23 3dft n PRO 5 Ca 0.25 0.00 -0.03 0.00 -2.02 0.00 0.00 63.50 61.70 3dft n PRO 5 Cb 0.40 -0.44 0.01 0.00 -0.02 0.00 0.00 33.50 33.45 3dft n PRO 5 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dft h ALA 6 N 2.24 0.59 -3.29 3.55 0.00 -1.97 -3.45 119.26 116.93 3dft h ALA 6 Ca -0.06 -0.71 -0.36 0.00 0.00 0.00 0.00 54.91 53.79 3dft h ALA 6 Cb 0.41 -0.12 -0.21 0.00 0.00 0.00 0.00 17.79 17.86 3dft h ALA 6 CO 0.31 0.97 -0.76 -0.51 0.00 0.00 0.00 179.25 179.26 3dft s LEU 7 N -6.87 2.28 0.45 0.00 1.43 -1.26 -4.96 118.68 109.74 3dft s LEU 7 Ca 0.01 -0.60 -0.00 0.00 -1.03 0.00 0.00 54.13 52.50 3dft s LEU 7 Cb 0.10 -0.37 -0.01 0.00 0.03 0.00 0.00 46.19 45.94 3dft s LEU 7 CO 0.78 -0.13 0.68 0.42 0.23 0.00 0.00 176.35 178.32 3dft s THR 8 N -1.37 4.19 0.38 5.49 -4.23 -1.26 -4.90 115.64 113.93 3dft s THR 8 Ca -0.05 -0.42 0.09 0.00 -1.18 0.00 0.00 61.69 60.14 3dft s THR 8 Cb -0.10 -3.56 0.31 0.00 1.34 0.00 0.00 72.50 70.50 3dft s THR 8 CO 0.01 -0.41 1.94 -0.65 -0.54 0.00 0.00 174.62 174.97 3dft h PRO 9 N 0.40 0.63 -0.23 3.99 0.11 -2.01 -0.12 132.00 134.76 3dft h PRO 9 Ca -0.47 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.58 3dft h PRO 9 Cb 1.24 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 3dft h PRO 9 CO 0.58 0.41 0.05 0.93 -0.21 0.00 0.00 178.00 179.76 3dft h GLU 10 N 0.65 0.38 -0.53 1.05 3.07 -1.99 -1.03 114.58 116.17 3dft h GLU 10 Ca 0.35 -0.10 -0.06 0.00 -0.50 0.00 0.00 59.36 59.05 3dft h GLU 10 Cb 0.48 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.32 3dft h GLU 10 CO -0.12 0.51 0.09 1.96 -1.40 0.00 0.00 179.01 180.04 3dft h GLN 11 N 0.19 0.83 -0.55 2.33 4.20 -1.68 -2.14 115.11 118.30 3dft h GLN 11 Ca 0.07 -0.19 -0.09 0.00 0.06 0.00 0.00 58.65 58.51 3dft h GLN 11 Cb 0.30 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.95 3dft h GLN 11 CO 0.00 0.77 0.00 0.87 -0.67 0.00 0.00 178.83 179.81 3dft h LYS 12 N 0.79 0.96 -0.39 1.46 1.57 -0.86 -2.27 116.57 117.82 3dft h LYS 12 Ca 0.17 -0.31 -0.01 0.00 -1.87 0.00 0.00 60.65 58.64 3dft h LYS 12 Cb 0.35 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 3dft h LYS 12 CO 0.01 0.97 0.22 -0.22 -0.57 0.00 0.00 179.45 179.86 3dft h LYS 13 N 0.84 0.55 -0.62 3.15 3.64 -0.84 0.14 116.57 123.42 3dft h LYS 13 Ca 0.16 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.47 3dft h LYS 13 Cb 0.53 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.21 3dft h LYS 13 CO 0.03 0.43 0.36 1.49 -2.27 0.00 0.00 179.45 179.49 3dft h GLU 14 N 0.51 0.85 -0.27 1.90 4.81 -1.31 0.73 114.58 121.80 3dft h GLU 14 Ca 0.14 -0.09 -0.05 0.00 -0.13 0.00 0.00 59.36 59.23 3dft h GLU 14 Cb 0.04 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.24 3dft h GLU 14 CO -0.02 0.63 -0.03 -0.07 -0.73 0.00 0.00 179.01 178.79 3dft h LEU 15 N 0.84 0.50 -0.50 1.64 3.38 -1.17 -2.07 115.31 117.93 3dft h LEU 15 Ca 0.22 -0.33 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 3dft h LEU 15 Cb 0.00 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 3dft h LEU 15 CO -0.04 0.71 0.20 -1.28 0.09 0.00 0.00 178.44 178.12 3dft h SER 16 N 0.27 0.70 -0.78 -0.43 0.87 -0.80 -1.65 113.55 111.72 3dft h SER 16 Ca 0.07 -0.17 -0.02 0.00 -1.23 0.00 0.00 61.79 60.44 3dft h SER 16 Cb 0.47 -0.18 -0.04 0.00 -0.44 0.00 0.00 62.40 62.22 3dft h SER 16 CO 0.02 0.68 0.40 0.44 -0.53 0.00 0.00 176.83 177.84 3dft h ASP 17 N 0.67 1.00 0.15 6.23 3.32 -0.81 -1.58 116.42 125.41 3dft h ASP 17 Ca 0.17 -0.12 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 3dft h ASP 17 Cb 0.20 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.49 3dft h ASP 17 CO -0.01 0.83 -0.07 0.40 -1.72 0.00 0.00 179.24 178.67 3dft h ILE 18 N 1.09 0.93 -0.99 0.35 2.04 -1.16 -2.09 117.51 117.69 3dft h ILE 18 Ca 0.27 -0.36 0.09 0.00 1.00 0.00 0.00 64.86 65.85 3dft h ILE 18 Cb 0.08 1.16 -0.07 0.00 -0.74 0.00 0.00 36.82 37.24 3dft h ILE 18 CO -0.04 0.09 0.63 0.00 0.00 0.00 0.00 178.15 178.83 3dft h ALA 19 N 0.44 1.42 -0.37 1.87 0.00 -1.16 -2.10 119.26 119.36 3dft h ALA 19 Ca -0.02 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 3dft h ALA 19 Cb 0.30 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3dft h ALA 19 CO 0.03 0.35 -0.32 0.45 0.00 0.00 0.00 179.25 179.76 3dft h HIS 20 N 1.09 0.96 -0.18 0.00 3.86 -1.20 -3.05 115.15 116.63 3dft h HIS 20 Ca 0.45 -0.26 -0.07 0.00 -1.16 0.00 0.00 60.37 59.33 3dft h HIS 20 Cb 0.29 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 28.53 3dft h HIS 20 CO -0.01 1.03 -0.20 0.00 0.86 0.00 0.00 177.93 179.62 3dft h ARG 21 N 0.69 0.31 -0.30 2.45 3.08 -0.74 -1.30 114.38 118.56 3dft h ARG 21 Ca 0.07 -0.09 -0.12 0.00 0.07 0.00 0.00 59.98 59.91 3dft h ARG 21 Cb 0.87 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.88 3dft h ARG 21 CO 0.08 0.50 -0.30 0.82 -1.07 0.00 0.00 179.97 180.00 3dft h ILE 22 N 0.28 1.28 -0.37 2.04 2.04 -1.31 -3.23 117.51 118.24 3dft h ILE 22 Ca 0.05 -1.41 -0.14 0.00 1.00 0.00 0.00 64.86 64.36 3dft h ILE 22 Cb 0.51 1.37 -0.09 0.00 -0.74 0.00 0.00 36.82 37.88 3dft h ILE 22 CO 0.03 0.46 0.01 1.33 0.00 0.00 0.00 178.15 179.98 3dft n VAL 23 N -4.08 2.51 -1.50 1.67 0.24 -1.08 -4.19 118.33 111.90 3dft n VAL 23 Ca -0.01 -2.38 -0.36 0.00 -2.04 0.00 0.00 64.34 59.55 3dft n VAL 23 Cb 0.46 -0.31 0.07 0.00 -1.47 0.00 0.00 33.84 32.59 3dft n VAL 23 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3dft n ALA 24 N -0.91 0.14 -1.44 2.33 0.00 -0.51 -4.72 120.51 115.39 3dft n ALA 24 Ca 0.31 -0.10 -0.57 0.00 0.00 0.00 0.00 53.44 53.09 3dft n ALA 24 Cb 1.04 -2.15 -0.08 0.00 0.00 0.00 0.00 19.45 18.26 3dft n ALA 24 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3dft n PRO 25 N -1.63 0.00 -0.45 0.00 -0.02 -1.26 -0.39 135.00 131.24 3dft n PRO 25 Ca 0.14 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 3dft n PRO 25 Cb 0.49 -1.42 0.00 0.00 -0.02 0.00 0.00 33.50 32.55 3dft n PRO 25 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dft n GLY 26 N 1.69 1.85 3.77 -1.23 0.00 -1.26 -5.01 105.19 105.01 3dft n GLY 26 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 3dft n GLY 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dft s LYS 27 N -0.05 2.99 0.00 1.61 1.02 0.47 -4.47 119.74 121.31 3dft s LYS 27 Ca 0.00 -0.56 0.00 0.00 0.02 0.00 0.00 55.97 55.43 3dft s LYS 27 Cb 0.00 -2.80 0.00 0.00 -0.52 0.00 0.00 37.83 34.51 3dft s LYS 27 CO 0.00 0.62 0.00 0.41 -0.92 0.00 0.00 175.35 175.46 3dft n GLY 28 N 0.96 4.26 3.36 -3.33 0.00 -0.02 -4.56 105.19 105.86 3dft n GLY 28 Ca -0.12 -1.70 -0.32 0.00 0.00 0.00 0.00 46.02 43.89 3dft n GLY 28 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dft s ILE 29 N -1.71 2.38 -0.37 -0.61 1.01 0.17 0.33 121.20 122.39 3dft s ILE 29 Ca 0.00 -0.99 -0.14 0.00 0.00 0.00 0.00 60.65 59.51 3dft s ILE 29 Cb 0.00 -1.86 -0.00 0.00 0.01 0.00 0.00 42.46 40.61 3dft s ILE 29 CO 0.00 0.58 0.30 -0.22 0.00 0.00 0.00 174.94 175.60 3dft s LEU 30 N -0.67 4.73 -0.84 2.97 2.96 -0.37 -2.24 118.68 125.23 3dft s LEU 30 Ca 0.11 -0.57 -0.19 0.00 -0.22 0.00 0.00 54.13 53.26 3dft s LEU 30 Cb -0.10 -2.21 0.12 0.00 0.50 0.00 0.00 46.19 44.50 3dft s LEU 30 CO -0.00 -0.36 1.03 0.00 -1.32 0.00 0.00 176.35 175.69 3dft s ALA 31 N 1.81 3.39 -0.31 5.97 0.00 0.66 -1.50 121.76 131.77 3dft s ALA 31 Ca 0.07 -2.60 0.08 0.00 0.00 0.00 0.00 51.96 49.51 3dft s ALA 31 Cb -0.18 -3.92 0.48 0.00 0.00 0.00 0.00 23.12 19.50 3dft s ALA 31 CO 0.11 -2.82 1.42 0.00 0.00 0.00 0.00 175.76 174.47 3dft n ALA 32 N 6.51 4.58 -0.97 0.00 0.00 -0.66 -4.06 120.51 125.90 3dft n ALA 32 Ca 0.15 -3.35 -0.23 0.00 0.00 0.00 0.00 53.44 50.01 3dft n ALA 32 Cb 0.48 -0.69 0.13 0.00 0.00 0.00 0.00 19.45 19.37 3dft n ALA 32 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3dft n SER 33 N -1.02 4.70 -4.76 0.00 3.41 -0.92 -4.20 113.62 110.83 3dft n SER 33 Ca 0.36 -3.42 -0.41 0.00 -0.26 0.00 0.00 58.87 55.14 3dft n SER 33 Cb 0.95 -0.85 -0.03 0.00 -0.26 0.00 0.00 64.21 64.02 3dft n SER 33 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3dft s GLU 34 N -2.92 4.43 1.07 4.33 8.01 -1.26 -4.52 118.70 127.85 3dft s GLU 34 Ca 0.50 2.07 -0.17 0.00 0.01 0.00 0.00 54.97 57.39 3dft s GLU 34 Cb 0.41 -3.13 0.23 0.00 -4.31 0.00 0.00 34.13 27.33 3dft s GLU 34 CO 0.06 -0.11 1.17 -1.54 0.01 0.00 0.00 175.26 174.85 3dft s SER 35 N -0.33 2.13 0.11 -0.19 1.04 -1.26 -4.70 113.70 110.50 3dft s SER 35 Ca 0.50 0.63 -0.17 0.00 0.48 0.00 0.00 55.95 57.39 3dft s SER 35 Cb -0.37 -0.91 -0.04 0.00 0.10 0.00 0.00 66.02 64.80 3dft s SER 35 CO 0.46 -3.38 1.63 0.74 0.98 0.00 0.00 173.24 173.67 3dft h THR 36 N -2.07 1.21 0.00 2.02 2.02 -1.97 0.23 112.91 114.34 3dft h THR 36 Ca -0.46 -0.67 -0.04 0.00 0.77 0.00 0.00 66.41 66.00 3dft h THR 36 Cb 1.29 1.05 -0.01 0.00 -1.74 0.00 0.00 68.15 68.74 3dft h THR 36 CO 0.42 0.23 -0.21 1.23 0.37 0.00 0.00 175.52 177.55 3dft h GLY 37 N 0.35 0.00 1.08 2.16 0.00 -1.99 0.13 103.07 104.80 3dft h GLY 37 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.11 3dft h GLY 37 CO -0.00 0.00 -1.65 0.23 0.00 0.00 0.00 176.54 175.12 3dft h SER 38 N 0.00 0.41 1.31 0.19 0.87 -1.83 -3.35 113.55 111.15 3dft h SER 38 Ca -0.00 -0.63 0.00 0.00 -1.23 0.00 0.00 61.79 59.93 3dft h SER 38 Cb 0.62 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.44 3dft h SER 38 CO 0.03 1.53 -0.51 -0.29 -0.53 0.00 0.00 176.83 177.06 3dft h ILE 39 N 0.07 0.00 -0.99 2.23 2.10 -0.46 -3.28 117.51 117.18 3dft h ILE 39 Ca -0.29 -0.82 0.08 0.00 1.08 0.00 0.00 64.86 64.90 3dft h ILE 39 Cb 2.04 1.54 -0.07 0.00 -1.09 0.00 0.00 36.82 39.24 3dft h ILE 39 CO 0.15 0.00 0.64 0.00 -1.08 0.00 0.00 178.15 177.86 3dft h ALA 40 N 2.18 1.45 -0.24 0.18 0.00 -0.85 -0.82 119.26 121.15 3dft h ALA 40 Ca 0.00 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.92 3dft h ALA 40 Cb 0.91 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 3dft h ALA 40 CO 0.00 0.39 0.07 -0.22 0.00 0.00 0.00 179.25 179.49 3dft h LYS 41 N 1.12 0.17 -0.91 0.00 3.64 -1.72 0.30 116.57 119.17 3dft h LYS 41 Ca 0.44 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.81 3dft h LYS 41 Cb 0.23 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 31.97 3dft h LYS 41 CO -0.18 0.11 0.57 0.00 -2.27 0.00 0.00 179.45 177.68 3dft h ARG 42 N 0.18 1.22 0.00 1.90 -0.00 -1.36 -1.63 114.38 114.69 3dft h ARG 42 Ca 0.10 -0.10 -0.04 0.00 -0.50 0.00 0.00 59.98 59.45 3dft h ARG 42 Cb 0.08 -0.26 -0.01 0.00 0.00 0.00 0.00 29.97 29.78 3dft h ARG 42 CO -0.11 0.84 -0.20 -0.07 0.00 0.00 0.00 179.97 180.42 3dft h LEU 43 N 1.24 0.00 -0.23 3.04 3.38 -0.80 -3.12 115.31 118.82 3dft h LEU 43 Ca 0.33 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.22 3dft h LEU 43 Cb -0.09 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 3dft h LEU 43 CO -0.07 0.20 -0.17 -0.61 0.09 0.00 0.00 178.44 177.89 3dft h GLN 44 N 0.00 0.51 -0.96 1.13 5.75 0.00 0.37 115.11 121.92 3dft h GLN 44 Ca -0.00 -0.25 0.10 0.00 -0.15 0.00 0.00 58.65 58.35 3dft h GLN 44 Cb 0.82 -0.00 -0.07 0.00 1.07 0.00 0.00 27.48 29.29 3dft h GLN 44 CO 0.03 0.82 0.62 0.66 -2.65 0.00 0.00 178.83 178.30 3dft h SER 45 N 0.21 0.90 -0.41 -0.69 4.64 -1.37 0.47 113.55 117.31 3dft h SER 45 Ca 0.04 0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 61.38 3dft h SER 45 Cb 0.70 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.62 3dft h SER 45 CO 0.04 0.52 0.01 2.30 -0.87 0.00 0.00 176.83 178.84 3dft n ILE 46 N -4.55 1.96 -4.04 0.95 -5.35 -1.20 -4.92 119.36 102.21 3dft n ILE 46 Ca 0.17 -0.99 -0.30 0.00 -0.27 0.00 0.00 62.75 61.35 3dft n ILE 46 Cb 0.30 -0.36 -0.02 0.00 -1.74 0.00 0.00 39.64 37.83 3dft n ILE 46 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3dft n GLY 47 N 0.40 -0.34 3.37 3.28 0.00 0.16 -4.59 105.19 107.48 3dft n GLY 47 Ca 0.20 0.15 -0.33 0.00 0.00 0.00 0.00 46.02 46.04 3dft n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dft s THR 48 N -3.63 2.89 0.21 2.61 2.01 0.13 -5.02 115.64 114.85 3dft s THR 48 Ca 0.36 -0.74 -0.31 0.00 0.31 0.00 0.00 61.69 61.31 3dft s THR 48 Cb -0.19 -2.18 -0.11 0.00 0.01 0.00 0.00 72.50 70.03 3dft s THR 48 CO 0.89 0.55 1.63 -0.70 -0.69 0.00 0.00 174.62 176.30 3dft s GLU 49 N 0.07 4.16 -1.27 4.92 2.12 -1.26 -4.18 118.70 123.26 3dft s GLU 49 Ca -0.06 2.50 -0.18 0.00 0.36 0.00 0.00 54.97 57.59 3dft s GLU 49 Cb -0.15 -3.09 0.08 0.00 0.26 0.00 0.00 34.13 31.22 3dft s GLU 49 CO 0.05 -0.66 1.69 1.21 -0.54 0.00 0.00 175.26 177.00 3dft s ASN 50 N 0.99 6.83 0.39 -1.70 2.47 -1.26 -4.75 114.94 117.91 3dft s ASN 50 Ca 0.70 -2.40 0.08 0.00 0.42 0.00 0.00 52.86 51.66 3dft s ASN 50 Cb -0.47 -2.56 -0.05 0.00 -1.45 0.00 0.00 41.25 36.72 3dft s ASN 50 CO 0.35 -1.17 0.15 0.42 -3.72 0.00 0.00 177.10 173.14 3dft s THR 51 N 4.08 2.45 0.24 -5.21 -4.23 -1.26 -5.02 115.64 106.68 3dft s THR 51 Ca 0.52 -1.73 -0.05 0.00 -1.18 0.00 0.00 61.69 59.25 3dft s THR 51 Cb 0.03 -2.97 0.16 0.00 1.34 0.00 0.00 72.50 71.06 3dft s THR 51 CO 0.06 -0.05 1.80 -0.08 -0.54 0.00 0.00 174.62 175.81 3dft h GLU 52 N 1.49 1.09 -0.40 3.99 4.81 -1.99 -1.82 114.58 121.75 3dft h GLU 52 Ca -0.43 -0.20 -0.08 0.00 -0.13 0.00 0.00 59.36 58.53 3dft h GLU 52 Cb 1.25 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 30.44 3dft h GLU 52 CO 0.69 0.89 -0.05 1.49 -0.73 0.00 0.00 179.01 181.30 3dft h GLU 53 N 1.06 0.74 -0.53 1.92 4.57 -1.96 0.28 114.58 120.66 3dft h GLU 53 Ca 0.24 -0.26 -0.08 0.00 -1.18 0.00 0.00 59.36 58.08 3dft h GLU 53 Cb 0.22 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.74 3dft h GLU 53 CO -0.02 0.86 -0.00 -0.91 -1.18 0.00 0.00 179.01 177.76 3dft h ASN 54 N 0.56 0.88 -0.32 1.04 2.35 -1.81 0.73 115.58 119.01 3dft h ASN 54 Ca 0.11 -0.23 -0.05 0.00 -0.55 0.00 0.00 56.30 55.58 3dft h ASN 54 Cb 0.56 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.68 3dft h ASN 54 CO 0.03 0.94 0.02 0.03 -1.65 0.00 0.00 177.43 176.80 3dft h ARG 55 N 0.84 0.56 -0.24 0.81 3.08 -1.21 -0.37 114.38 117.84 3dft h ARG 55 Ca 0.16 -0.17 0.03 0.00 0.07 0.00 0.00 59.98 60.07 3dft h ARG 55 Cb 0.50 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.46 3dft h ARG 55 CO 0.02 0.68 0.06 -0.09 -1.07 0.00 0.00 179.97 179.57 3dft h ARG 56 N 0.37 0.15 0.04 0.04 2.43 -0.60 -1.09 114.38 115.73 3dft h ARG 56 Ca 0.09 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.26 3dft h ARG 56 Cb 0.41 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.92 3dft h ARG 56 CO 0.01 0.10 -0.06 0.35 -1.51 0.00 0.00 179.97 178.86 3dft h PHE 57 N 0.16 -0.16 -0.30 2.20 3.57 -0.72 0.44 116.94 122.12 3dft h PHE 57 Ca 0.11 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.64 3dft h PHE 57 Cb 0.10 0.07 -0.03 0.00 2.79 0.00 0.00 35.95 38.87 3dft h PHE 57 CO -0.14 -0.10 0.11 -0.92 -2.23 0.00 0.00 178.31 175.03 3dft h TYR 58 N -0.13 0.21 -0.69 0.41 3.20 -0.84 0.95 116.97 120.07 3dft h TYR 58 Ca 0.01 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.87 3dft h TYR 58 Cb 0.14 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.33 3dft h TYR 58 CO -0.11 0.10 0.31 0.00 -1.64 0.00 0.00 178.16 176.81 3dft h ARG 59 N 0.25 1.00 -0.79 1.82 -0.00 -1.05 -1.59 114.38 114.02 3dft h ARG 59 Ca 0.13 -0.15 -0.02 0.00 -0.50 0.00 0.00 59.98 59.44 3dft h ARG 59 Cb 0.09 -0.18 -0.04 0.00 0.00 0.00 0.00 29.97 29.85 3dft h ARG 59 CO -0.13 0.79 0.40 0.37 0.00 0.00 0.00 179.97 181.40 3dft h GLN 60 N 0.99 1.12 -0.84 0.04 4.15 0.01 -0.59 115.11 119.99 3dft h GLN 60 Ca 0.24 -0.15 0.04 0.00 0.77 0.00 0.00 58.65 59.55 3dft h GLN 60 Cb 0.14 -0.21 -0.05 0.00 0.21 0.00 0.00 27.48 27.56 3dft h GLN 60 CO -0.03 0.85 0.53 1.25 -1.93 0.00 0.00 178.83 179.50 3dft h LEU 61 N 1.11 0.86 0.02 -2.39 6.46 0.14 -0.34 115.31 121.18 3dft h LEU 61 Ca 0.27 0.00 -0.14 0.00 -0.12 0.00 0.00 57.88 57.89 3dft h LEU 61 Cb 0.08 -0.18 0.01 0.00 -0.73 0.00 0.00 40.66 39.85 3dft h LEU 61 CO -0.04 0.57 -0.58 -0.07 -0.62 0.00 0.00 178.44 177.71 3dft h LEU 62 N 1.00 0.47 -1.39 2.25 3.38 -1.05 -3.29 115.31 116.68 3dft h LEU 62 Ca 0.35 -0.80 -0.04 0.00 0.09 0.00 0.00 57.88 57.47 3dft h LEU 62 Cb 0.07 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3dft h LEU 62 CO -0.14 1.21 -0.21 -0.07 0.09 0.00 0.00 178.44 179.32 3dft h LEU 63 N -0.22 0.00 -3.38 1.67 3.38 -0.98 -3.17 115.31 112.60 3dft h LEU 63 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 3dft h LEU 63 Cb 1.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.07 3dft h LEU 63 CO 0.11 0.21 0.00 0.35 0.09 0.00 0.00 178.44 179.20 3dft n THR 64 N -3.50 2.39 -0.76 0.22 -2.24 -0.15 -4.79 114.28 105.45 3dft n THR 64 Ca -0.01 -1.47 -0.32 0.00 -2.27 0.00 0.00 64.05 59.99 3dft n THR 64 Cb 0.37 -0.16 0.16 0.00 -2.10 0.00 0.00 70.33 68.60 3dft n THR 64 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dft n ALA 65 N 0.44 -0.99 -0.64 6.98 0.00 -1.20 -4.93 120.51 120.17 3dft n ALA 65 Ca 0.25 -0.53 -0.31 0.00 0.00 0.00 0.00 53.44 52.85 3dft n ALA 65 Cb 1.03 -2.14 0.19 0.00 0.00 0.00 0.00 19.45 18.53 3dft n ALA 65 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3dft n ASP 66 N -3.64 -1.28 0.00 0.00 5.68 -1.26 -4.83 116.55 111.22 3dft n ASP 66 Ca 0.11 0.14 0.00 0.00 -0.50 0.00 0.00 54.79 54.54 3dft n ASP 66 Cb 0.52 -1.27 0.00 0.00 -1.14 0.00 0.00 41.12 39.23 3dft n ASP 66 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 3dft n ASP 67 N -3.37 0.00 0.29 -1.12 8.00 -1.26 -2.70 116.55 116.39 3dft n ASP 67 Ca 0.06 0.26 0.19 0.00 0.71 0.00 0.00 54.79 56.01 3dft n ASP 67 Cb 0.55 -0.26 0.84 0.00 -0.02 0.00 0.00 41.12 42.22 3dft n ASP 67 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 3dft h ARG 68 N 0.00 0.00 0.00 -1.24 3.08 -2.00 -2.51 114.38 111.70 3dft h ARG 68 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3dft h ARG 68 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.11 3dft h ARG 68 CO 0.00 0.00 -0.55 -0.39 -1.07 0.00 0.00 179.97 177.96 3dft h VAL 69 N 0.00 0.00 -0.39 2.04 -1.51 -1.85 -3.39 116.25 111.15 3dft h VAL 69 Ca 0.00 -0.63 0.08 0.00 -1.23 0.00 0.00 66.70 64.93 3dft h VAL 69 Cb 0.37 1.29 -0.09 0.00 -2.13 0.00 0.00 31.29 30.73 3dft h VAL 69 CO 0.00 0.00 -0.28 0.78 -1.23 0.00 0.00 177.57 176.84 3dft h ASN 70 N 0.00 -0.93 0.58 4.19 4.21 -1.68 0.21 115.58 122.16 3dft h ASN 70 Ca 0.00 0.18 0.00 0.00 1.21 0.00 0.00 56.30 57.69 3dft h ASN 70 Cb 0.81 0.46 0.00 0.00 -1.12 0.00 0.00 38.32 38.47 3dft h ASN 70 CO 0.00 -0.29 0.00 -0.81 -1.29 0.00 0.00 177.43 175.04 3dft n PRO 71 N -5.41 0.02 -0.03 0.81 -0.04 -1.26 -3.27 135.00 125.83 3dft n PRO 71 Ca 0.01 0.19 -0.16 0.00 -0.04 0.00 0.00 63.50 63.51 3dft n PRO 71 Cb 0.32 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.14 3dft n PRO 71 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3dft s ILE 73 N -2.56 5.06 -0.14 0.00 -1.09 0.29 -0.84 121.20 121.92 3dft s ILE 73 Ca -0.17 -0.36 0.19 0.00 -2.23 0.00 0.00 60.65 58.08 3dft s ILE 73 Cb 0.07 -3.63 -0.16 0.00 -1.58 0.00 0.00 42.46 37.16 3dft s ILE 73 CO 0.77 -0.04 0.71 0.61 -1.23 0.00 0.00 174.94 175.77 3dft n GLY 74 N 5.07 -1.19 3.35 6.18 0.00 0.15 -4.46 105.19 114.30 3dft n GLY 74 Ca -0.13 -0.23 -0.12 0.00 0.00 0.00 0.00 46.02 45.54 3dft n GLY 74 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dft s GLY 75 N -4.77 -0.36 -0.08 -0.02 0.00 -1.11 -0.89 107.32 100.09 3dft s GLY 75 Ca -0.04 0.33 -0.02 0.00 0.00 0.00 0.00 44.72 44.99 3dft s GLY 75 CO 0.83 0.05 0.02 0.14 0.00 0.00 0.00 173.10 174.13 3dft s VAL 76 N -2.94 0.31 -0.14 1.40 1.01 0.03 -1.23 120.40 118.84 3dft s VAL 76 Ca -0.02 0.08 -0.21 0.00 0.00 0.00 0.00 61.98 61.83 3dft s VAL 76 Cb -0.00 -0.54 -0.03 0.00 0.00 0.00 0.00 36.38 35.81 3dft s VAL 76 CO -0.06 0.18 0.60 -0.63 0.00 0.00 0.00 175.10 175.20 3dft s ILE 77 N 1.99 5.08 0.28 2.22 1.01 -0.56 -0.36 121.20 130.86 3dft s ILE 77 Ca 0.04 1.18 0.11 0.00 0.00 0.00 0.00 60.65 61.99 3dft s ILE 77 Cb -0.13 -3.93 -0.05 0.00 0.01 0.00 0.00 42.46 38.36 3dft s ILE 77 CO -0.05 0.21 -0.15 -0.76 0.00 0.00 0.00 174.94 174.19 3dft s LEU 78 N 1.25 2.73 0.40 2.97 1.43 -0.42 -1.66 118.68 125.38 3dft s LEU 78 Ca 0.30 -0.96 -0.06 0.00 -1.03 0.00 0.00 54.13 52.37 3dft s LEU 78 Cb -0.16 -1.22 -0.05 0.00 0.03 0.00 0.00 46.19 44.79 3dft s LEU 78 CO 0.12 0.01 0.71 0.12 0.23 0.00 0.00 176.35 177.54 3dft s PHE 79 N -2.48 3.51 0.22 0.29 5.36 -1.26 -2.27 117.98 121.35 3dft s PHE 79 Ca 0.31 0.81 -0.16 0.00 -0.96 0.00 0.00 56.93 56.92 3dft s PHE 79 Cb -0.05 -2.27 0.23 0.00 -0.34 0.00 0.00 43.02 40.59 3dft s PHE 79 CO 0.16 -0.09 1.58 1.25 -1.46 0.00 0.00 175.22 176.67 3dft h HIS 80 N 0.93 -0.77 -0.37 10.12 6.17 -1.93 -1.30 115.15 128.00 3dft h HIS 80 Ca -0.47 0.08 0.08 0.00 0.71 0.00 0.00 60.37 60.76 3dft h HIS 80 Cb 1.20 0.45 -0.08 0.00 2.52 0.00 0.00 27.41 31.50 3dft h HIS 80 CO 0.58 -0.37 -0.13 1.49 0.71 0.00 0.00 177.93 180.21 3dft h GLU 81 N -0.07 -0.05 -0.29 5.26 4.81 -1.99 -2.41 114.58 119.85 3dft h GLU 81 Ca 0.31 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.51 3dft h GLU 81 Cb 0.57 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.95 3dft h GLU 81 CO -0.80 -0.03 0.02 1.15 -0.73 0.00 0.00 179.01 178.62 3dft h THR 82 N -0.05 1.16 0.00 0.32 2.02 -1.64 -2.26 112.91 112.46 3dft h THR 82 Ca 0.18 -0.61 -0.00 0.00 0.77 0.00 0.00 66.41 66.75 3dft h THR 82 Cb 0.33 0.92 -0.00 0.00 -1.74 0.00 0.00 68.15 67.66 3dft h THR 82 CO -0.41 0.21 -0.00 0.25 0.37 0.00 0.00 175.52 175.94 3dft h LEU 83 N 0.41 0.00 -3.16 2.58 5.85 -0.86 -2.00 115.31 118.13 3dft h LEU 83 Ca 0.10 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.82 3dft h LEU 83 Cb 0.24 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.27 3dft h LEU 83 CO 0.00 0.00 0.00 -1.22 -0.34 0.00 0.00 178.44 176.89 3dft n TYR 84 N -3.65 0.81 -3.37 1.25 4.01 -0.86 -4.61 117.16 110.75 3dft n TYR 84 Ca -0.03 -0.78 -0.19 0.00 -0.16 0.00 0.00 57.90 56.75 3dft n TYR 84 Cb 0.08 -0.24 -0.00 0.00 -0.31 0.00 0.00 39.34 38.87 3dft n TYR 84 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 3dft s GLN 85 N -2.34 2.98 0.13 -0.72 -0.21 -0.75 -5.01 119.66 113.73 3dft s GLN 85 Ca 0.37 -1.12 0.06 0.00 0.02 0.00 0.00 55.36 54.69 3dft s GLN 85 Cb 0.28 -2.76 -0.04 0.00 1.00 0.00 0.00 33.01 31.49 3dft s GLN 85 CO 0.10 -0.04 -0.14 0.15 -2.12 0.00 0.00 175.29 173.25 3dft s LYS 86 N -4.21 1.04 0.88 2.91 1.02 -1.26 -1.67 119.74 118.45 3dft s LYS 86 Ca 0.48 -1.27 -0.13 0.00 0.02 0.00 0.00 55.97 55.06 3dft s LYS 86 Cb -0.09 -0.88 0.13 0.00 -0.52 0.00 0.00 37.83 36.46 3dft s LYS 86 CO 0.31 0.16 1.20 0.00 -0.92 0.00 0.00 175.35 176.10 3dft s ALA 87 N -2.29 2.27 0.64 5.17 0.00 0.14 -4.87 121.76 122.82 3dft s ALA 87 Ca 0.10 -0.76 0.34 0.00 0.00 0.00 0.00 51.96 51.64 3dft s ALA 87 Cb -0.04 -2.93 1.87 0.00 0.00 0.00 0.00 23.12 22.02 3dft s ALA 87 CO 0.03 -2.07 2.12 -0.44 0.00 0.00 0.00 175.76 175.40 3dft h ASP 88 N -1.35 0.00 -0.38 0.00 3.32 -1.99 0.97 116.42 116.98 3dft h ASP 88 Ca -0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.58 3dft h ASP 88 Cb 1.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.86 3dft h ASP 88 CO 0.57 0.00 0.00 -0.90 -1.72 0.00 0.00 179.24 177.19 3dft n ASP 89 N -3.32 2.09 0.00 6.45 5.68 -1.26 -4.90 116.55 121.29 3dft n ASP 89 Ca -0.01 -1.98 0.00 0.00 -0.50 0.00 0.00 54.79 52.30 3dft n ASP 89 Cb 0.28 -0.25 0.00 0.00 -1.14 0.00 0.00 41.12 40.00 3dft n ASP 89 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3dft n GLY 90 N 1.13 1.53 3.70 6.12 0.00 0.33 -5.01 105.19 112.99 3dft n GLY 90 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 3dft n GLY 90 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dft s ARG 91 N -0.12 4.40 0.37 1.61 0.52 -1.26 -4.72 118.95 119.76 3dft s ARG 91 Ca 0.00 1.65 -0.28 0.00 -0.52 0.00 0.00 55.73 56.58 3dft s ARG 91 Cb 0.00 -3.49 -0.11 0.00 0.52 0.00 0.00 34.95 31.87 3dft s ARG 91 CO 0.00 -0.35 1.48 -2.30 0.02 0.00 0.00 175.30 174.15 3dft n PRO 92 N 4.73 2.65 -0.33 3.54 -0.02 -1.26 -0.68 135.00 143.62 3dft n PRO 92 Ca 0.10 0.93 0.15 0.00 -2.02 0.00 0.00 63.50 62.65 3dft n PRO 92 Cb 0.47 -2.65 0.37 0.00 -0.02 0.00 0.00 33.50 31.66 3dft n PRO 92 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 3dft h PHE 93 N 2.95 0.95 -0.78 6.00 0.04 -1.59 0.45 116.94 124.97 3dft h PHE 93 Ca -0.50 0.03 0.01 0.00 2.80 0.00 0.00 57.97 60.31 3dft h PHE 93 Cb 1.24 -0.29 -0.04 0.00 2.20 0.00 0.00 35.95 39.07 3dft h PHE 93 CO 0.53 0.22 0.51 -1.35 -0.60 0.00 0.00 178.31 177.62 3dft h PRO 94 N 0.68 1.01 -0.34 1.51 0.11 -1.85 0.30 132.00 133.42 3dft h PRO 94 Ca 0.56 -0.06 -0.12 0.00 0.11 0.00 0.00 66.00 66.48 3dft h PRO 94 Cb 0.97 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.84 3dft h PRO 94 CO -0.33 0.67 -0.29 0.37 -0.21 0.00 0.00 178.00 178.21 3dft h GLN 95 N 1.04 0.70 -0.06 1.05 4.15 -1.29 -0.72 115.11 119.97 3dft h GLN 95 Ca 0.29 -0.31 -0.00 0.00 0.77 0.00 0.00 58.65 59.40 3dft h GLN 95 Cb -0.10 -0.02 -0.00 0.00 0.21 0.00 0.00 27.48 27.57 3dft h GLN 95 CO -0.07 0.91 0.03 0.28 -1.93 0.00 0.00 178.83 178.05 3dft h VAL 96 N 0.60 1.14 -0.24 2.39 2.07 -0.37 -0.02 116.25 121.82 3dft h VAL 96 Ca 0.07 -0.42 0.01 0.00 0.82 0.00 0.00 66.70 67.18 3dft h VAL 96 Cb 0.80 1.31 -0.02 0.00 -1.52 0.00 0.00 31.29 31.85 3dft h VAL 96 CO 0.07 0.12 0.12 0.40 0.02 0.00 0.00 177.57 178.30 3dft h ILE 97 N -0.06 1.00 -0.76 4.57 2.04 -0.86 -2.78 117.51 120.66 3dft h ILE 97 Ca 0.02 -0.09 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 3dft h ILE 97 Cb 0.17 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 36.93 3dft h ILE 97 CO -0.00 0.05 0.34 0.50 0.00 0.00 0.00 178.15 179.04 3dft h LYS 98 N 0.26 1.10 0.00 2.37 3.64 -1.00 -2.12 116.57 120.83 3dft h LYS 98 Ca 0.10 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3dft h LYS 98 Cb 0.02 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.65 3dft h LYS 98 CO -0.06 0.87 0.00 0.66 -2.27 0.00 0.00 179.45 178.64 3dft h SER 99 N 1.09 0.00 -0.57 4.20 4.64 -0.72 -1.15 113.55 121.04 3dft h SER 99 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 3dft h SER 99 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 3dft h SER 99 CO -0.03 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.22 3dft n LYS 100 N -2.82 4.54 -1.37 4.77 5.02 -0.89 -4.93 118.16 122.48 3dft n LYS 100 Ca -0.01 -3.09 -0.07 0.00 -2.02 0.00 0.00 58.31 53.13 3dft n LYS 100 Cb 0.16 -2.16 -0.02 0.00 -0.02 0.00 0.00 35.03 32.99 3dft n LYS 100 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dft n GLY 101 N 0.67 0.73 3.68 0.72 0.00 -0.43 -4.62 105.19 105.94 3dft n GLY 101 Ca 0.27 -0.73 -0.28 0.00 0.00 0.00 0.00 46.02 45.28 3dft n GLY 101 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dft s GLY 102 N -2.89 1.81 -0.02 -0.02 0.00 -0.85 -4.81 107.32 100.54 3dft s GLY 102 Ca 0.00 -1.24 -0.15 0.00 0.00 0.00 0.00 44.72 43.33 3dft s GLY 102 CO 0.00 -1.23 0.41 0.14 0.00 0.00 0.00 173.10 172.42 3dft s VAL 103 N -1.52 5.06 -0.11 1.40 1.01 -0.07 -3.66 120.40 122.51 3dft s VAL 103 Ca 0.27 0.84 -0.20 0.00 0.00 0.00 0.00 61.98 62.88 3dft s VAL 103 Cb -0.10 -3.72 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 3dft s VAL 103 CO 0.19 0.54 0.55 -0.69 0.00 0.00 0.00 175.10 175.69 3dft s VAL 104 N -0.81 5.14 0.29 2.92 1.01 -1.26 -0.79 120.40 126.90 3dft s VAL 104 Ca 0.24 1.10 0.10 0.00 0.00 0.00 0.00 61.98 63.42 3dft s VAL 104 Cb -0.16 -3.89 -0.05 0.00 0.00 0.00 0.00 36.38 32.28 3dft s VAL 104 CO 0.13 0.29 -0.05 -0.83 0.00 0.00 0.00 175.10 174.63 3dft s GLY 105 N 0.72 1.85 -0.01 4.51 0.00 0.51 -0.71 107.32 114.20 3dft s GLY 105 Ca 0.29 -1.82 0.00 0.00 0.00 0.00 0.00 44.72 43.20 3dft s GLY 105 CO 0.12 -1.85 0.00 -1.50 0.00 0.00 0.00 173.10 169.88 3dft s ILE 106 N -2.44 0.07 -0.14 0.90 1.10 -0.52 -1.30 121.20 118.88 3dft s ILE 106 Ca 0.32 0.05 -0.29 0.00 -0.51 0.00 0.00 60.65 60.22 3dft s ILE 106 Cb -0.04 -0.13 -0.01 0.00 0.15 0.00 0.00 42.46 42.43 3dft s ILE 106 CO 0.18 0.07 1.06 -0.75 -2.11 0.00 0.00 174.94 173.40 3dft s LYS 107 N 0.51 4.35 -0.00 3.50 2.36 -0.96 -1.51 119.74 127.99 3dft s LYS 107 Ca -0.05 1.44 0.06 0.00 -2.55 0.00 0.00 55.97 54.87 3dft s LYS 107 Cb -0.07 -3.59 -0.06 0.00 -1.05 0.00 0.00 37.83 33.06 3dft s LYS 107 CO -0.01 -0.46 0.22 1.33 1.55 0.00 0.00 175.35 177.98 3dft n VAL 108 N 4.85 0.00 -1.54 4.02 0.24 -0.57 -4.65 118.33 120.68 3dft n VAL 108 Ca 0.10 -0.33 -0.31 0.00 -2.04 0.00 0.00 64.34 61.76 3dft n VAL 108 Cb 0.47 0.90 0.06 0.00 -1.47 0.00 0.00 33.84 33.81 3dft n VAL 108 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 3dft s ASP 109 N -1.70 5.16 -0.34 -1.34 1.47 -1.24 -4.86 116.67 113.81 3dft s ASP 109 Ca 0.01 1.72 0.07 0.00 1.18 0.00 0.00 52.55 55.53 3dft s ASP 109 Cb 0.04 -2.51 0.53 0.00 -0.34 0.00 0.00 42.92 40.65 3dft s ASP 109 CO 0.23 -1.59 1.57 0.29 0.68 0.00 0.00 175.17 176.35 3dft n LYS 110 N -3.08 2.05 0.00 2.11 5.02 0.53 -4.95 118.16 119.84 3dft n LYS 110 Ca 0.08 -3.23 0.00 0.00 -2.02 0.00 0.00 58.31 53.15 3dft n LYS 110 Cb 0.53 -1.94 0.00 0.00 -0.02 0.00 0.00 35.03 33.60 3dft n LYS 110 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dft n GLY 111 N -1.10 -0.94 3.90 0.72 0.00 -1.25 -4.74 105.19 101.78 3dft n GLY 111 Ca 0.41 -1.66 -0.28 0.00 0.00 0.00 0.00 46.02 44.49 3dft n GLY 111 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3dft s VAL 112 N -1.90 4.90 0.03 1.61 -7.23 -1.26 -1.45 120.40 115.10 3dft s VAL 112 Ca 0.00 0.26 0.01 0.00 -1.81 0.00 0.00 61.98 60.44 3dft s VAL 112 Cb 0.00 -3.80 -0.02 0.00 0.56 0.00 0.00 36.38 33.12 3dft s VAL 112 CO 0.00 -0.63 -0.05 0.68 -0.31 0.00 0.00 175.10 174.79 3dft s VAL 113 N -2.48 0.30 0.34 1.32 -7.23 -0.16 -4.88 120.40 107.61 3dft s VAL 113 Ca 0.47 -1.07 -0.28 0.00 -1.81 0.00 0.00 61.98 59.29 3dft s VAL 113 Cb -0.10 -0.53 -0.10 0.00 0.56 0.00 0.00 36.38 36.21 3dft s VAL 113 CO 0.37 -0.50 1.25 -2.16 -0.31 0.00 0.00 175.10 173.75 3dft s PRO 114 N -1.75 4.33 -0.43 4.82 0.04 -1.26 -1.72 135.00 139.04 3dft s PRO 114 Ca -0.11 2.09 -0.17 0.00 0.04 0.00 0.00 61.00 62.84 3dft s PRO 114 Cb -0.08 -3.01 0.02 0.00 0.04 0.00 0.00 34.50 31.47 3dft s PRO 114 CO -0.01 -0.16 0.45 -0.51 0.04 0.00 0.00 177.00 176.81 3dft s LEU 115 N -1.88 4.88 0.41 -3.56 1.43 -0.25 -4.84 118.68 114.88 3dft s LEU 115 Ca 0.50 -0.70 -0.26 0.00 -1.03 0.00 0.00 54.13 52.64 3dft s LEU 115 Cb -0.37 -2.39 -0.10 0.00 0.03 0.00 0.00 46.19 43.36 3dft s LEU 115 CO 0.49 -0.60 1.37 0.00 0.23 0.00 0.00 176.35 177.83 3dft n ALA 116 N 5.63 1.73 -0.67 4.21 0.00 -1.26 -2.52 120.51 127.63 3dft n ALA 116 Ca -0.07 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.65 3dft n ALA 116 Cb 0.47 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.59 3dft n ALA 116 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dft n GLY 117 N 0.66 0.75 3.66 0.00 0.00 -1.26 -5.05 105.19 103.95 3dft n GLY 117 Ca 0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.82 3dft n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dft s THR 118 N -2.66 2.48 -1.26 2.61 -4.23 -1.05 -5.05 115.64 106.49 3dft s THR 118 Ca 0.00 -1.91 -0.13 0.00 -1.18 0.00 0.00 61.69 58.48 3dft s THR 118 Cb 0.00 -2.87 0.15 0.00 1.34 0.00 0.00 72.50 71.12 3dft s THR 118 CO 0.00 -0.13 1.65 -3.20 -0.54 0.00 0.00 174.62 172.40 3dft n ASN 119 N -1.02 5.09 -1.15 3.99 5.15 -1.26 -4.46 115.26 121.60 3dft n ASN 119 Ca -0.04 -3.01 -0.13 0.00 -0.60 0.00 0.00 54.58 50.81 3dft n ASN 119 Cb 0.63 -1.56 -0.04 0.00 -0.53 0.00 0.00 39.78 38.29 3dft n ASN 119 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3dft n GLY 120 N 3.76 0.79 3.92 8.20 0.00 -1.26 -5.01 105.19 115.59 3dft n GLY 120 Ca 0.40 -0.41 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 3dft n GLY 120 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dft s GLU 121 N -3.65 3.42 0.29 1.61 2.02 -1.26 -4.98 118.70 116.14 3dft s GLU 121 Ca 0.00 -0.07 0.03 0.00 0.02 0.00 0.00 54.97 54.96 3dft s GLU 121 Cb 0.00 -2.48 -0.04 0.00 0.10 0.00 0.00 34.13 31.71 3dft s GLU 121 CO 0.00 -0.14 0.17 0.95 0.02 0.00 0.00 175.26 176.26 3dft s THR 122 N -2.61 0.22 0.32 3.63 -4.23 -1.26 -1.09 115.64 110.62 3dft s THR 122 Ca 0.46 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 59.01 3dft s THR 122 Cb -0.10 -2.51 -0.03 0.00 1.34 0.00 0.00 72.50 71.20 3dft s THR 122 CO 0.41 0.00 0.21 0.28 -0.54 0.00 0.00 174.62 174.98 3dft s THR 123 N -3.67 0.16 -0.01 3.99 -1.32 -0.70 -4.82 115.64 109.28 3dft s THR 123 Ca 0.37 -2.00 0.07 0.00 -1.21 0.00 0.00 61.69 58.92 3dft s THR 123 Cb 0.05 -2.48 -0.02 0.00 -1.51 0.00 0.00 72.50 68.54 3dft s THR 123 CO 0.18 0.00 -0.23 -0.89 -2.21 0.00 0.00 174.62 171.47 3dft s THR 124 N -3.54 2.32 0.39 5.08 2.01 -1.26 -0.98 115.64 119.65 3dft s THR 124 Ca 0.37 -1.11 0.08 0.00 0.31 0.00 0.00 61.69 61.33 3dft s THR 124 Cb 0.04 -1.86 -0.02 0.00 0.01 0.00 0.00 72.50 70.66 3dft s THR 124 CO 0.21 0.51 0.35 0.00 -0.69 0.00 0.00 174.62 175.01 3dft s GLN 125 N -0.84 2.62 0.00 4.92 -2.07 -0.53 -4.90 119.66 118.85 3dft s GLN 125 Ca 0.11 -1.43 0.00 0.00 -1.82 0.00 0.00 55.36 52.22 3dft s GLN 125 Cb -0.10 -2.43 0.00 0.00 -1.09 0.00 0.00 33.01 29.39 3dft s GLN 125 CO 0.01 -0.09 0.00 0.41 -1.32 0.00 0.00 175.29 174.30 3dft n GLY 126 N -1.49 -0.34 0.14 2.60 0.00 -1.26 -0.34 105.19 104.49 3dft n GLY 126 Ca 0.02 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.05 3dft n GLY 126 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3dft h LEU 127 N 0.00 0.00 -9.37 0.99 3.38 -1.91 -3.41 115.31 104.99 3dft h LEU 127 Ca 0.00 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.43 3dft h LEU 127 Cb 0.00 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.77 3dft h LEU 127 CO 0.00 0.54 1.21 0.47 0.09 0.00 0.00 178.44 180.75 3dft n ASP 128 N -3.31 4.08 -1.40 -0.43 10.43 -1.26 -1.62 116.55 123.05 3dft n ASP 128 Ca 0.01 0.92 -0.17 0.00 2.57 0.00 0.00 54.79 58.12 3dft n ASP 128 Cb 0.71 -1.51 -0.07 0.00 1.84 0.00 0.00 41.12 42.09 3dft n ASP 128 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3dft n GLY 129 N 4.50 1.55 0.27 0.44 0.00 -1.26 -4.88 105.19 105.81 3dft n GLY 129 Ca 0.20 -0.18 -0.03 0.00 0.00 0.00 0.00 46.02 46.01 3dft n GLY 129 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3dft h LEU 130 N 0.00 0.62 0.01 0.99 5.85 -1.54 -2.57 115.31 118.67 3dft h LEU 130 Ca -0.36 -0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.22 3dft h LEU 130 Cb 1.16 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 42.00 3dft h LEU 130 CO 0.52 0.72 -0.08 -1.28 -0.34 0.00 0.00 178.44 177.98 3dft h SER 131 N 0.60 -0.24 -0.35 1.25 0.87 -1.89 0.56 113.55 114.35 3dft h SER 131 Ca 0.12 0.03 -0.06 0.00 -1.23 0.00 0.00 61.79 60.66 3dft h SER 131 Cb 0.44 0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.48 3dft h SER 131 CO 0.02 -0.12 0.04 -0.33 -0.53 0.00 0.00 176.83 175.90 3dft h GLU 132 N -0.15 0.70 -0.43 2.24 3.07 -1.95 -1.59 114.58 116.46 3dft h GLU 132 Ca 0.03 -0.16 -0.07 0.00 -0.50 0.00 0.00 59.36 58.66 3dft h GLU 132 Cb 0.18 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 27.98 3dft h GLU 132 CO -0.08 0.69 -0.00 0.00 -1.40 0.00 0.00 179.01 178.22 3dft h ARG 133 N 0.66 0.75 -0.62 2.33 3.08 -1.04 -2.12 114.38 117.43 3dft h ARG 133 Ca 0.14 -0.24 -0.04 0.00 0.07 0.00 0.00 59.98 59.91 3dft h ARG 133 Cb 0.36 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.31 3dft h ARG 133 CO 0.01 0.83 0.24 0.00 -1.07 0.00 0.00 179.97 179.98 3dft h ALA 135 N 1.09 1.35 -0.07 0.00 0.00 -1.19 -0.39 119.26 120.05 3dft h ALA 135 Ca 0.21 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 3dft h ALA 135 Cb 0.22 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3dft h ALA 135 CO -0.02 0.55 -0.32 0.37 0.00 0.00 0.00 179.25 179.84 3dft h GLN 136 N 1.06 0.34 -0.81 0.00 5.75 -0.93 -2.88 115.11 117.63 3dft h GLN 136 Ca 0.27 -0.27 0.00 0.00 -0.15 0.00 0.00 58.65 58.51 3dft h GLN 136 Cb -0.02 0.05 -0.04 0.00 1.07 0.00 0.00 27.48 28.54 3dft h GLN 136 CO -0.05 0.91 0.51 1.88 -2.65 0.00 0.00 178.83 179.44 3dft h TYR 137 N -0.16 1.03 -0.34 3.99 0.05 -0.65 -1.03 116.97 119.87 3dft h TYR 137 Ca -0.02 0.01 0.02 0.00 0.05 0.00 0.00 58.73 58.80 3dft h TYR 137 Cb 0.97 -0.34 -0.03 0.00 1.01 0.00 0.00 36.73 38.34 3dft h TYR 137 CO 0.13 0.66 0.17 -0.22 -1.05 0.00 0.00 178.16 177.85 3dft h LYS 138 N 1.10 0.34 -0.50 4.88 1.63 -1.08 -0.66 116.57 122.28 3dft h LYS 138 Ca 0.29 -0.02 -0.03 0.00 -0.85 0.00 0.00 60.65 60.05 3dft h LYS 138 Cb -0.09 -0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 31.43 3dft h LYS 138 CO -0.06 0.23 0.20 0.87 -3.45 0.00 0.00 179.45 177.24 3dft h LYS 139 N 0.36 0.71 -0.60 1.90 1.57 -1.17 -2.32 116.57 117.02 3dft h LYS 139 Ca 0.14 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 3dft h LYS 139 Cb 0.05 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.23 3dft h LYS 139 CO -0.09 0.59 0.00 -0.25 -0.57 0.00 0.00 179.45 179.13 3dft n ASP 140 N -4.35 1.47 0.00 0.86 8.00 -0.45 -4.88 116.55 117.20 3dft n ASP 140 Ca 0.04 -2.11 0.00 0.00 0.71 0.00 0.00 54.79 53.43 3dft n ASP 140 Cb 0.16 -0.36 0.00 0.00 -0.02 0.00 0.00 41.12 40.90 3dft n ASP 140 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dft n GLY 141 N 0.38 0.37 3.80 0.44 0.00 -0.87 -4.92 105.19 104.38 3dft n GLY 141 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 3dft n GLY 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dft s ALA 142 N -2.00 3.46 0.00 4.61 0.00 -0.34 -4.45 121.76 123.03 3dft s ALA 142 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 51.96 52.15 3dft s ALA 142 Cb 0.00 -2.81 0.00 0.00 0.00 0.00 0.00 23.12 20.31 3dft s ALA 142 CO 0.00 0.34 0.00 -0.25 0.00 0.00 0.00 175.76 175.85 3dft n ASP 143 N 1.16 1.41 -4.07 0.00 8.00 0.11 -4.04 116.55 119.12 3dft n ASP 143 Ca -0.05 -0.32 -0.10 0.00 0.71 0.00 0.00 54.79 55.03 3dft n ASP 143 Cb 0.50 0.92 -0.08 0.00 -0.02 0.00 0.00 41.12 42.44 3dft n ASP 143 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 3dft s PHE 144 N -1.20 0.68 0.21 1.24 -0.71 -1.19 -0.99 117.98 116.02 3dft s PHE 144 Ca 0.00 -1.01 0.02 0.00 -1.04 0.00 0.00 56.93 54.90 3dft s PHE 144 Cb 0.00 -0.23 -0.05 0.00 -1.21 0.00 0.00 43.02 41.54 3dft s PHE 144 CO 0.00 -0.71 0.05 0.00 -1.34 0.00 0.00 175.22 173.22 3dft s ALA 145 N -4.04 1.54 -0.03 1.99 0.00 0.05 -1.44 121.76 119.83 3dft s ALA 145 Ca 0.25 -1.73 0.05 0.00 0.00 0.00 0.00 51.96 50.53 3dft s ALA 145 Cb 0.04 0.78 -0.01 0.00 0.00 0.00 0.00 23.12 23.94 3dft s ALA 145 CO 0.05 -0.38 -0.17 0.21 0.00 0.00 0.00 175.76 175.47 3dft s LYS 146 N -3.97 1.61 -0.17 0.00 2.20 -0.57 -1.87 119.74 116.97 3dft s LYS 146 Ca 0.31 -0.60 -0.04 0.00 -0.36 0.00 0.00 55.97 55.27 3dft s LYS 146 Cb 0.07 -1.46 0.08 0.00 -1.51 0.00 0.00 37.83 35.02 3dft s LYS 146 CO 0.09 0.29 0.26 -0.46 -0.36 0.00 0.00 175.35 175.16 3dft s TRP 147 N -0.12 -0.41 -0.25 4.03 -0.11 -1.26 -1.51 118.94 119.31 3dft s TRP 147 Ca 0.00 0.64 -0.10 0.00 1.22 0.00 0.00 56.10 57.86 3dft s TRP 147 Cb -0.10 -0.17 -0.05 0.00 -1.50 0.00 0.00 33.47 31.66 3dft s TRP 147 CO 0.01 -0.50 0.16 0.50 -4.62 0.00 0.00 176.95 172.49 3dft s ARG 148 N 2.40 4.00 0.00 5.86 3.52 -1.26 -3.63 118.95 129.83 3dft s ARG 148 Ca 0.05 -0.30 0.03 0.00 -0.13 0.00 0.00 55.73 55.37 3dft s ARG 148 Cb -0.14 -3.54 -0.03 0.00 -1.56 0.00 0.00 34.95 29.68 3dft s ARG 148 CO -0.11 -0.01 -0.05 0.00 -0.81 0.00 0.00 175.30 174.32 3dft s VAL 150 N -1.01 1.49 0.13 0.00 1.01 -1.26 -1.46 120.40 119.30 3dft s VAL 150 Ca 0.17 -0.67 0.08 0.00 0.00 0.00 0.00 61.98 61.56 3dft s VAL 150 Cb -0.11 -1.34 -0.04 0.00 0.00 0.00 0.00 36.38 34.89 3dft s VAL 150 CO 0.08 0.44 -0.20 -0.76 0.00 0.00 0.00 175.10 174.65 3dft s LEU 151 N 0.67 2.36 -0.00 3.92 1.43 0.67 -4.53 118.68 123.21 3dft s LEU 151 Ca -0.13 -0.76 0.04 0.00 -1.03 0.00 0.00 54.13 52.24 3dft s LEU 151 Cb -0.16 -0.88 -0.01 0.00 0.03 0.00 0.00 46.19 45.17 3dft s LEU 151 CO 0.04 0.03 -0.12 -0.75 0.23 0.00 0.00 176.35 175.77 3dft s LYS 152 N -2.29 0.94 -0.17 1.70 2.20 -1.26 -0.79 119.74 120.06 3dft s LYS 152 Ca 0.11 -0.48 -0.22 0.00 -0.36 0.00 0.00 55.97 55.02 3dft s LYS 152 Cb -0.08 -0.91 -0.03 0.00 -1.51 0.00 0.00 37.83 35.30 3dft s LYS 152 CO 0.05 0.24 0.67 0.42 -0.36 0.00 0.00 175.35 176.37 3dft s ILE 153 N -0.38 5.01 0.09 5.43 1.01 -1.26 -2.52 121.20 128.57 3dft s ILE 153 Ca 0.04 1.29 -0.02 0.00 0.00 0.00 0.00 60.65 61.95 3dft s ILE 153 Cb -0.05 -3.98 0.01 0.00 0.01 0.00 0.00 42.46 38.44 3dft s ILE 153 CO -0.00 0.12 0.16 0.61 0.00 0.00 0.00 174.94 175.83 3dft n GLY 154 N 3.62 2.09 0.24 6.18 0.00 -0.44 -4.77 105.19 112.11 3dft n GLY 154 Ca -0.01 -1.17 -0.02 0.00 0.00 0.00 0.00 46.02 44.83 3dft n GLY 154 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3dft h GLU 155 N 0.00 0.53 -0.05 1.61 4.39 -2.02 -3.14 114.58 115.91 3dft h GLU 155 Ca -0.07 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.60 3dft h GLU 155 Cb 0.27 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.80 3dft h GLU 155 CO 0.09 0.35 0.00 0.72 -1.16 0.00 0.00 179.01 179.01 3dft n HIS 156 N -4.88 0.12 -4.22 4.33 8.25 -1.26 -5.03 115.22 112.53 3dft n HIS 156 Ca 0.08 -0.73 -0.20 0.00 -0.26 0.00 0.00 57.72 56.60 3dft n HIS 156 Cb 0.20 -0.11 -0.12 0.00 1.12 0.00 0.00 29.99 31.08 3dft n HIS 156 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3dft s THR 157 N -1.90 1.35 0.21 1.59 -4.23 -1.19 -3.48 115.64 107.99 3dft s THR 157 Ca 0.18 -1.43 -0.30 0.00 -1.18 0.00 0.00 61.69 58.96 3dft s THR 157 Cb 0.15 -1.29 -0.08 0.00 1.34 0.00 0.00 72.50 72.62 3dft s THR 157 CO 0.03 -0.19 1.10 -2.16 -0.54 0.00 0.00 174.62 172.87 3dft s PRO 158 N -1.90 4.61 0.84 3.99 0.04 -1.05 -1.33 135.00 140.20 3dft s PRO 158 Ca 0.02 1.74 -0.12 0.00 0.04 0.00 0.00 61.00 62.68 3dft s PRO 158 Cb -0.09 -3.25 0.09 0.00 0.04 0.00 0.00 34.50 31.29 3dft s PRO 158 CO 0.03 0.12 1.15 -1.54 0.04 0.00 0.00 177.00 176.80 3dft s SER 159 N -0.34 4.23 0.20 6.66 1.04 -1.23 -4.84 113.70 119.42 3dft s SER 159 Ca 0.48 0.94 -0.11 0.00 0.48 0.00 0.00 55.95 57.74 3dft s SER 159 Cb -0.30 -1.51 0.20 0.00 0.10 0.00 0.00 66.02 64.51 3dft s SER 159 CO 0.37 -2.10 1.79 0.00 0.98 0.00 0.00 173.24 174.28 3dft h ALA 160 N -1.18 0.79 0.32 5.32 0.00 -2.00 -1.84 119.26 120.67 3dft h ALA 160 Ca -0.48 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 3dft h ALA 160 Cb 1.32 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.02 3dft h ALA 160 CO 0.64 -0.03 -0.15 1.25 0.00 0.00 0.00 179.25 180.96 3dft h LEU 161 N 0.59 -0.36 -0.54 0.00 5.85 -1.99 -1.35 115.31 117.50 3dft h LEU 161 Ca 0.27 -0.02 0.10 0.00 0.84 0.00 0.00 57.88 59.07 3dft h LEU 161 Cb 0.18 0.09 -0.08 0.00 0.37 0.00 0.00 40.66 41.23 3dft h LEU 161 CO -0.18 -0.22 0.10 0.00 -0.34 0.00 0.00 178.44 177.79 3dft h ALA 162 N 0.20 0.62 -0.03 1.25 0.00 -1.87 0.96 119.26 120.38 3dft h ALA 162 Ca -0.04 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 3dft h ALA 162 Cb 0.36 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 3dft h ALA 162 CO 0.07 -0.32 0.01 0.82 0.00 0.00 0.00 179.25 179.84 3dft h ILE 163 N 0.23 1.13 -0.30 0.00 2.04 -1.23 -1.93 117.51 117.45 3dft h ILE 163 Ca 0.28 -0.40 -0.02 0.00 1.00 0.00 0.00 64.86 65.72 3dft h ILE 163 Cb 0.40 1.36 -0.01 0.00 -0.74 0.00 0.00 36.82 37.82 3dft h ILE 163 CO -0.37 0.11 0.12 -0.03 0.00 0.00 0.00 178.15 177.97 3dft h MET 164 N -0.12 0.45 -0.37 2.37 4.05 -0.81 -1.81 114.93 118.69 3dft h MET 164 Ca 0.01 -0.08 -0.04 0.00 -0.28 0.00 0.00 59.70 59.30 3dft h MET 164 Cb 0.16 -0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 30.88 3dft h MET 164 CO -0.00 0.47 0.06 1.49 0.23 0.00 0.00 176.91 179.16 3dft h GLU 165 N 0.33 0.61 -0.45 0.39 4.57 -0.84 -0.91 114.58 118.28 3dft h GLU 165 Ca 0.10 -0.16 -0.09 0.00 -1.18 0.00 0.00 59.36 58.03 3dft h GLU 165 Cb 0.19 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.69 3dft h GLU 165 CO -0.01 0.67 -0.10 -0.91 -1.18 0.00 0.00 179.01 177.48 3dft h ASN 166 N 0.45 0.79 -0.63 1.04 2.35 -1.35 -0.60 115.58 117.63 3dft h ASN 166 Ca 0.11 -0.23 -0.09 0.00 -0.55 0.00 0.00 56.30 55.54 3dft h ASN 166 Cb 0.35 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.49 3dft h ASN 166 CO 0.01 0.91 0.04 0.00 -1.65 0.00 0.00 177.43 176.74 3dft h ALA 167 N 1.16 0.87 -0.26 -0.83 0.00 -1.18 -1.69 119.26 117.33 3dft h ALA 167 Ca 0.12 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 3dft h ALA 167 Cb 0.58 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3dft h ALA 167 CO 0.04 0.67 -0.11 -0.97 0.00 0.00 0.00 179.25 178.88 3dft h ASN 168 N 1.00 0.54 -0.31 0.00 -1.24 -0.85 -2.20 115.58 112.53 3dft h ASN 168 Ca 0.19 -0.40 -0.09 0.00 0.71 0.00 0.00 56.30 56.71 3dft h ASN 168 Cb 0.52 -0.15 -0.02 0.00 0.73 0.00 0.00 38.32 39.40 3dft h ASN 168 CO 0.02 0.82 -0.12 1.62 -1.29 0.00 0.00 177.43 178.48 3dft h VAL 169 N 0.27 1.26 -0.80 2.57 3.04 -1.05 -1.45 116.25 120.09 3dft h VAL 169 Ca 0.06 -1.16 -0.00 0.00 -1.01 0.00 0.00 66.70 64.58 3dft h VAL 169 Cb 0.60 1.07 -0.04 0.00 -2.01 0.00 0.00 31.29 30.91 3dft h VAL 169 CO 0.03 0.39 0.48 -0.07 -1.01 0.00 0.00 177.57 177.40 3dft h LEU 170 N 0.67 0.96 -0.94 3.16 3.38 -1.25 -1.09 115.31 120.20 3dft h LEU 170 Ca 0.11 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 3dft h LEU 170 Cb 0.59 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 3dft h LEU 170 CO 0.04 0.74 0.31 0.00 0.09 0.00 0.00 178.44 179.62 3dft h ALA 171 N 1.26 1.16 -0.19 1.53 0.00 -0.74 0.05 119.26 122.33 3dft h ALA 171 Ca 0.29 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 3dft h ALA 171 Cb -0.04 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 3dft h ALA 171 CO -0.05 0.61 0.02 0.00 0.00 0.00 0.00 179.25 179.83 3dft h ARG 172 N 1.06 0.33 -0.44 0.00 2.47 -0.69 -1.39 114.38 115.70 3dft h ARG 172 Ca 0.25 -0.09 0.04 0.00 -1.26 0.00 0.00 59.98 58.91 3dft h ARG 172 Cb 0.17 -0.03 -0.04 0.00 -1.65 0.00 0.00 29.97 28.42 3dft h ARG 172 CO -0.02 0.51 0.21 -0.92 0.56 0.00 0.00 179.97 180.30 3dft h TYR 173 N 0.11 0.39 -0.65 3.04 3.20 -0.96 -1.73 116.97 120.36 3dft h TYR 173 Ca 0.06 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.91 3dft h TYR 173 Cb 0.34 -0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.47 3dft h TYR 173 CO 0.03 0.19 0.24 0.00 -1.64 0.00 0.00 178.16 176.98 3dft h ALA 174 N 1.24 1.20 -0.16 1.82 0.00 -0.87 -1.85 119.26 120.64 3dft h ALA 174 Ca 0.19 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3dft h ALA 174 Cb 0.12 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3dft h ALA 174 CO -0.15 0.57 0.06 1.03 0.00 0.00 0.00 179.25 180.77 3dft h SER 175 N 0.94 0.23 -0.55 0.00 0.87 -0.64 -2.18 113.55 112.22 3dft h SER 175 Ca 0.22 -0.17 -0.08 0.00 -1.23 0.00 0.00 61.79 60.53 3dft h SER 175 Cb 0.21 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.08 3dft h SER 175 CO -0.02 0.34 0.06 0.40 -0.53 0.00 0.00 176.83 177.08 3dft h ILE 176 N 0.11 1.25 -0.16 2.23 2.04 -1.19 -2.73 117.51 119.07 3dft h ILE 176 Ca 0.05 -1.03 -0.00 0.00 1.00 0.00 0.00 64.86 64.89 3dft h ILE 176 Cb 0.18 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 36.99 3dft h ILE 176 CO -0.00 0.38 0.09 0.00 0.00 0.00 0.00 178.15 178.62 3dft h GLN 178 N 0.17 0.00 0.00 0.00 4.20 -1.29 -0.51 115.11 117.69 3dft h GLN 178 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 3dft h GLN 178 Cb 0.04 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.82 3dft h GLN 178 CO -0.01 0.13 0.00 1.96 -0.67 0.00 0.00 178.83 180.24 3dft h GLN 179 N 0.00 0.00 -0.16 1.46 1.08 -1.20 -3.12 115.11 113.17 3dft h GLN 179 Ca -0.00 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.18 3dft h GLN 179 Cb 0.29 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.71 3dft h GLN 179 CO 0.02 0.00 -0.03 0.09 -0.95 0.00 0.00 178.83 177.96 3dft n ASN 180 N -2.55 3.08 -0.96 1.46 4.13 -0.37 -4.96 115.26 115.09 3dft n ASN 180 Ca 0.03 -3.17 -0.11 0.00 1.68 0.00 0.00 54.58 53.00 3dft n ASN 180 Cb 0.32 -0.51 -0.04 0.00 -1.54 0.00 0.00 39.78 38.01 3dft n ASN 180 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3dft n GLY 181 N -0.94 0.92 3.44 7.41 0.00 -1.14 -4.74 105.19 110.13 3dft n GLY 181 Ca 0.21 -0.49 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 3dft n GLY 181 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dft s ILE 182 N -2.45 3.68 -0.25 -0.61 -1.09 -0.34 -4.82 121.20 115.31 3dft s ILE 182 Ca 0.00 -0.42 -0.29 0.00 -2.23 0.00 0.00 60.65 57.71 3dft s ILE 182 Cb 0.00 -2.62 0.01 0.00 -1.58 0.00 0.00 42.46 38.27 3dft s ILE 182 CO 0.00 0.48 1.03 -0.69 -1.23 0.00 0.00 174.94 174.53 3dft s VAL 183 N 0.63 4.65 -0.06 2.92 1.01 -0.16 -3.00 120.40 126.38 3dft s VAL 183 Ca -0.03 1.93 -0.23 0.00 0.00 0.00 0.00 61.98 63.65 3dft s VAL 183 Cb -0.15 -4.32 -0.04 0.00 0.00 0.00 0.00 36.38 31.88 3dft s VAL 183 CO 0.02 -0.24 0.68 -2.16 0.00 0.00 0.00 175.10 173.40 3dft s PRO 184 N 3.28 4.43 -0.32 2.72 0.04 -1.26 -0.77 135.00 143.11 3dft s PRO 184 Ca 0.44 0.84 -0.19 0.00 0.04 0.00 0.00 61.00 62.13 3dft s PRO 184 Cb -0.14 -3.44 -0.01 0.00 0.04 0.00 0.00 34.50 30.95 3dft s PRO 184 CO 0.08 0.10 0.56 0.42 0.04 0.00 0.00 177.00 178.20 3dft s ILE 185 N 0.70 4.98 -0.34 0.56 1.01 -0.78 -2.72 121.20 124.62 3dft s ILE 185 Ca 0.36 0.61 -0.27 0.00 0.00 0.00 0.00 60.65 61.35 3dft s ILE 185 Cb -0.18 -3.97 0.01 0.00 0.01 0.00 0.00 42.46 38.34 3dft s ILE 185 CO 0.17 -0.16 0.97 -0.69 0.00 0.00 0.00 174.94 175.24 3dft s VAL 186 N 2.49 4.57 -0.44 2.92 1.01 0.34 -4.09 120.40 127.20 3dft s VAL 186 Ca 0.22 1.41 0.04 0.00 0.00 0.00 0.00 61.98 63.64 3dft s VAL 186 Cb -0.15 -4.35 0.12 0.00 0.00 0.00 0.00 36.38 32.00 3dft s VAL 186 CO 0.12 -0.49 0.17 -0.70 0.00 0.00 0.00 175.10 174.21 3dft s GLU 187 N 3.50 1.77 -1.04 2.72 2.12 -1.24 -0.52 118.70 126.01 3dft s GLU 187 Ca 0.40 -2.30 -0.07 0.00 0.36 0.00 0.00 54.97 53.36 3dft s GLU 187 Cb -0.12 -3.28 0.26 0.00 0.26 0.00 0.00 34.13 31.25 3dft s GLU 187 CO 0.17 -1.04 1.01 -1.25 -0.54 0.00 0.00 175.26 173.61 3dft s PRO 188 N 0.23 3.91 -0.01 4.30 0.04 -1.25 -1.65 135.00 140.57 3dft s PRO 188 Ca 0.14 -3.23 -0.30 0.00 0.04 0.00 0.00 61.00 57.66 3dft s PRO 188 Cb -0.23 -4.37 -0.04 0.00 0.04 0.00 0.00 34.50 29.90 3dft s PRO 188 CO -0.03 -1.25 1.17 -2.00 0.04 0.00 0.00 177.00 174.93 3dft s GLU 189 N -1.27 4.40 -0.36 4.56 2.12 -0.54 -4.59 118.70 123.02 3dft s GLU 189 Ca 0.29 1.67 -0.11 0.00 0.36 0.00 0.00 54.97 57.19 3dft s GLU 189 Cb -0.09 -3.48 0.02 0.00 0.26 0.00 0.00 34.13 30.85 3dft s GLU 189 CO -0.09 -0.34 0.19 0.42 -0.54 0.00 0.00 175.26 174.90 3dft s ILE 190 N 1.70 4.53 0.67 -3.70 1.01 -1.26 -0.24 121.20 123.91 3dft s ILE 190 Ca 0.56 -0.83 -0.17 0.00 0.00 0.00 0.00 60.65 60.22 3dft s ILE 190 Cb -0.26 -3.51 -0.01 0.00 0.01 0.00 0.00 42.46 38.69 3dft s ILE 190 CO 0.25 -0.20 1.01 0.18 0.00 0.00 0.00 174.94 176.18 3dft n LEU 191 N 4.98 3.97 -0.21 2.97 4.77 0.03 -4.85 117.00 128.66 3dft n LEU 191 Ca -0.12 0.74 0.13 0.00 -0.03 0.00 0.00 56.01 56.73 3dft n LEU 191 Cb 0.46 -1.42 0.45 0.00 -2.33 0.00 0.00 43.42 40.58 3dft n LEU 191 CO 0.36 -1.83 0.72 -0.81 -1.33 0.00 0.00 177.39 174.50 3dft n PRO 192 N -1.58 0.81 -1.64 3.23 -0.04 -1.26 -4.51 135.00 130.00 3dft n PRO 192 Ca 0.14 -0.43 -0.43 0.00 -0.04 0.00 0.00 63.50 62.74 3dft n PRO 192 Cb 0.49 -1.49 -0.00 0.00 -0.04 0.00 0.00 33.50 32.45 3dft n PRO 192 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3dft n ASP 193 N -0.72 1.89 0.00 3.54 9.92 -1.26 -0.39 116.55 129.53 3dft n ASP 193 Ca 0.13 1.15 0.00 0.00 -0.53 0.00 0.00 54.79 55.54 3dft n ASP 193 Cb 0.33 -1.39 0.00 0.00 -0.64 0.00 0.00 41.12 39.42 3dft n ASP 193 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3dft n GLY 194 N 1.02 1.09 0.52 0.44 0.00 -1.26 -4.57 105.19 102.43 3dft n GLY 194 Ca 0.08 -2.25 0.07 0.00 0.00 0.00 0.00 46.02 43.91 3dft n GLY 194 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3dft n ASP 195 N 0.00 3.04 -4.64 1.61 5.75 -1.26 -0.62 116.55 120.43 3dft n ASP 195 Ca 0.00 -2.61 -0.30 0.00 -0.01 0.00 0.00 54.79 51.87 3dft n ASP 195 Cb 0.00 -0.36 0.18 0.00 -1.03 0.00 0.00 41.12 39.91 3dft n ASP 195 CO 0.00 0.00 0.00 -1.38 -0.11 0.00 0.00 177.20 175.71 3dft s HIS 196 N -2.08 1.85 0.36 2.11 -3.43 -1.26 -4.29 115.29 108.55 3dft s HIS 196 Ca 0.29 1.40 0.06 0.00 -0.80 0.00 0.00 55.06 56.00 3dft s HIS 196 Cb 0.22 -3.19 0.06 0.00 -1.43 0.00 0.00 32.58 28.24 3dft s HIS 196 CO 0.08 -2.92 0.49 -0.40 -2.00 0.00 0.00 174.74 169.99 3dft n ASP 197 N -4.27 1.30 -0.01 7.38 5.68 -1.26 -0.19 116.55 125.17 3dft n ASP 197 Ca 0.07 -1.95 -0.10 0.00 -0.50 0.00 0.00 54.79 52.32 3dft n ASP 197 Cb 0.54 -0.26 -0.04 0.00 -1.14 0.00 0.00 41.12 40.22 3dft n ASP 197 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 3dft h LEU 198 N 0.00 -0.03 -1.71 -2.12 5.85 -1.91 -2.33 115.31 113.07 3dft h LEU 198 Ca -0.17 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.54 3dft h LEU 198 Cb 0.77 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.83 3dft h LEU 198 CO 0.24 0.01 -0.18 0.07 -0.34 0.00 0.00 178.44 178.24 3dft h LYS 199 N 0.06 0.00 -0.27 1.25 2.10 -1.96 -0.91 116.57 116.84 3dft h LYS 199 Ca 0.06 0.00 -0.07 0.00 -2.00 0.00 0.00 60.65 58.64 3dft h LYS 199 Cb 0.07 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.39 3dft h LYS 199 CO -0.10 0.18 -0.11 -0.09 -2.00 0.00 0.00 179.45 177.33 3dft h ARG 200 N 0.00 0.56 -0.64 0.07 9.65 -1.83 -0.84 114.38 121.34 3dft h ARG 200 Ca -0.00 -0.24 -0.07 0.00 -1.10 0.00 0.00 59.98 58.57 3dft h ARG 200 Cb 0.36 -0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 28.89 3dft h ARG 200 CO 0.02 0.80 0.12 0.00 2.80 0.00 0.00 179.97 183.71 3dft h GLN 202 N 0.98 0.77 -0.07 0.00 4.15 -1.01 0.26 115.11 120.19 3dft h GLN 202 Ca 0.20 -0.15 0.00 0.00 0.77 0.00 0.00 58.65 59.48 3dft h GLN 202 Cb 0.40 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.96 3dft h GLN 202 CO 0.01 0.69 0.04 -0.92 -1.93 0.00 0.00 178.83 176.72 3dft h TYR 203 N 0.68 0.07 -0.63 3.99 3.20 -0.94 -1.27 116.97 122.08 3dft h TYR 203 Ca 0.17 0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.97 3dft h TYR 203 Cb 0.22 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.44 3dft h TYR 203 CO 0.01 0.05 0.10 0.28 -1.64 0.00 0.00 178.16 176.95 3dft h VAL 204 N 0.09 1.26 -0.81 1.81 2.07 -1.27 -2.20 116.25 117.19 3dft h VAL 204 Ca 0.03 -1.01 -0.02 0.00 0.82 0.00 0.00 66.70 66.52 3dft h VAL 204 Cb -0.00 0.70 -0.04 0.00 -1.52 0.00 0.00 31.29 30.43 3dft h VAL 204 CO -0.02 0.38 0.44 0.74 0.02 0.00 0.00 177.57 179.14 3dft h THR 205 N 0.95 1.24 -0.49 2.57 2.02 -0.74 0.03 112.91 118.49 3dft h THR 205 Ca 0.19 -0.60 -0.05 0.00 0.77 0.00 0.00 66.41 66.72 3dft h THR 205 Cb 0.43 0.16 -0.02 0.00 -1.74 0.00 0.00 68.15 66.98 3dft h THR 205 CO 0.01 0.27 0.11 -0.33 0.37 0.00 0.00 175.52 175.95 3dft h GLU 206 N 1.13 0.80 -0.39 6.66 5.08 -1.03 -0.99 114.58 125.83 3dft h GLU 206 Ca 0.29 -0.20 -0.07 0.00 -1.00 0.00 0.00 59.36 58.37 3dft h GLU 206 Cb 0.03 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 3dft h GLU 206 CO -0.05 0.78 -0.04 0.87 -1.00 0.00 0.00 179.01 179.57 3dft h LYS 207 N 0.68 0.72 -0.36 2.33 1.79 -1.10 -1.90 116.57 118.73 3dft h LYS 207 Ca 0.15 -0.25 -0.02 0.00 -2.18 0.00 0.00 60.65 58.35 3dft h LYS 207 Cb 0.35 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 30.93 3dft h LYS 207 CO 0.00 0.84 0.15 0.28 -1.08 0.00 0.00 179.45 179.64 3dft h VAL 208 N 0.53 1.18 -0.16 0.50 2.07 -0.91 -2.34 116.25 117.12 3dft h VAL 208 Ca 0.10 -0.55 -0.09 0.00 0.82 0.00 0.00 66.70 66.98 3dft h VAL 208 Cb 0.54 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 3dft h VAL 208 CO 0.03 0.20 -0.30 -0.07 0.02 0.00 0.00 177.57 177.44 3dft h LEU 209 N 0.44 0.31 -0.53 2.57 3.38 -1.15 -0.74 115.31 119.59 3dft h LEU 209 Ca 0.12 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 3dft h LEU 209 Cb 0.17 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 3dft h LEU 209 CO -0.01 0.61 0.15 0.00 0.09 0.00 0.00 178.44 179.28 3dft h ALA 210 N 1.42 0.69 -0.50 1.53 0.00 -1.18 -1.52 119.26 119.71 3dft h ALA 210 Ca 0.04 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.63 3dft h ALA 210 Cb 0.67 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 3dft h ALA 210 CO 0.05 0.37 -0.14 0.00 0.00 0.00 0.00 179.25 179.53 3dft h ALA 211 N 1.02 0.82 -0.05 0.00 0.00 -1.11 -2.33 119.26 117.61 3dft h ALA 211 Ca 0.17 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 3dft h ALA 211 Cb 0.30 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 3dft h ALA 211 CO -0.00 0.66 0.03 0.28 0.00 0.00 0.00 179.25 180.21 3dft h VAL 212 N 0.84 1.08 0.00 0.00 2.07 -0.78 -1.99 116.25 117.47 3dft h VAL 212 Ca 0.13 -0.23 -0.08 0.00 0.82 0.00 0.00 66.70 67.34 3dft h VAL 212 Cb 0.68 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.58 3dft h VAL 212 CO 0.05 0.07 -0.36 1.88 0.02 0.00 0.00 177.57 179.23 3dft h TYR 213 N -0.01 0.00 -0.32 1.57 0.05 -1.28 -1.44 116.97 115.54 3dft h TYR 213 Ca 0.02 0.00 -0.15 0.00 0.05 0.00 0.00 58.73 58.65 3dft h TYR 213 Cb 0.08 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.82 3dft h TYR 213 CO -0.05 0.36 -0.41 -0.22 -1.05 0.00 0.00 178.16 176.80 3dft h LYS 214 N 0.00 0.78 -0.57 4.88 1.63 -1.28 -1.46 116.57 120.56 3dft h LYS 214 Ca -0.00 -0.41 -0.09 0.00 -0.85 0.00 0.00 60.65 59.29 3dft h LYS 214 Cb 0.88 0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.50 3dft h LYS 214 CO 0.05 1.04 0.00 0.00 -3.45 0.00 0.00 179.45 177.09 3dft h ALA 215 N 0.90 0.76 -0.32 5.00 0.00 -1.03 -0.50 119.26 124.07 3dft h ALA 215 Ca 0.05 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 3dft h ALA 215 Cb 0.97 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 3dft h ALA 215 CO 0.09 0.59 0.00 -0.07 0.00 0.00 0.00 179.25 179.87 3dft h LEU 216 N 0.89 0.46 -0.14 0.00 3.38 -1.15 -1.29 115.31 117.46 3dft h LEU 216 Ca 0.16 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 3dft h LEU 216 Cb 0.54 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 3dft h LEU 216 CO 0.03 0.53 -0.11 -1.28 0.09 0.00 0.00 178.44 177.69 3dft h SER 217 N 0.48 0.35 -0.51 -0.43 0.87 -0.79 -0.27 113.55 113.25 3dft h SER 217 Ca 0.10 -0.46 0.05 0.00 -1.23 0.00 0.00 61.79 60.26 3dft h SER 217 Cb 0.31 -0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 62.14 3dft h SER 217 CO 0.01 0.73 0.34 0.44 -0.53 0.00 0.00 176.83 177.82 3dft h ASP 218 N -0.03 0.42 -0.42 6.23 3.32 -0.66 -1.57 116.42 123.72 3dft h ASP 218 Ca 0.03 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 3dft h ASP 218 Cb 0.62 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.08 3dft h ASP 218 CO 0.03 0.28 0.00 1.41 -1.72 0.00 0.00 179.24 179.24 3dft n HIS 219 N -4.47 0.66 -3.65 4.55 8.25 -0.53 -4.94 115.22 115.09 3dft n HIS 219 Ca 0.07 -0.30 -0.24 0.00 -0.26 0.00 0.00 57.72 56.98 3dft n HIS 219 Cb 0.22 -0.05 0.07 0.00 1.12 0.00 0.00 29.99 31.35 3dft n HIS 219 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3dft n HIS 220 N 0.70 -2.60 -2.77 4.41 8.25 -0.59 -4.90 115.22 117.72 3dft n HIS 220 Ca 0.15 0.97 -0.41 0.00 -0.26 0.00 0.00 57.72 58.17 3dft n HIS 220 Cb 0.42 -4.78 -0.05 0.00 1.12 0.00 0.00 29.99 26.70 3dft n HIS 220 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3dft s ILE 221 N -3.35 4.50 -0.86 1.59 -1.09 -0.13 -4.89 121.20 116.96 3dft s ILE 221 Ca 0.48 2.01 -0.22 0.00 -2.23 0.00 0.00 60.65 60.69 3dft s ILE 221 Cb -0.22 -4.29 0.09 0.00 -1.58 0.00 0.00 42.46 36.45 3dft s ILE 221 CO 0.76 0.34 1.18 -0.47 -1.23 0.00 0.00 174.94 175.52 3dft s TYR 222 N -0.12 2.77 0.31 3.97 5.04 -1.26 -4.83 117.35 123.24 3dft s TYR 222 Ca 0.45 -0.90 0.05 0.00 -2.44 0.00 0.00 57.07 54.23 3dft s TYR 222 Cb -0.23 -4.42 0.69 0.00 0.35 0.00 0.00 41.96 38.35 3dft s TYR 222 CO 0.29 -1.70 1.82 -0.07 -1.34 0.00 0.00 175.55 174.55 3dft h LEU 223 N 11.50 0.81 -2.59 6.97 3.38 -1.94 0.14 115.31 133.58 3dft h LEU 223 Ca 0.01 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 3dft h LEU 223 Cb 1.04 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 3dft h LEU 223 CO 1.22 0.38 -0.02 -0.33 0.09 0.00 0.00 178.44 179.78 3dft h GLU 224 N 0.83 0.00 -0.93 1.13 3.07 -1.90 -0.84 114.58 115.95 3dft h GLU 224 Ca 0.51 0.00 -0.48 0.00 -0.50 0.00 0.00 59.36 58.89 3dft h GLU 224 Cb 0.70 0.00 -0.29 0.00 -0.84 0.00 0.00 28.75 28.33 3dft h GLU 224 CO -0.29 0.02 0.58 0.41 -1.40 0.00 0.00 179.01 178.32 3dft n GLY 225 N -1.04 4.55 3.22 -3.84 0.00 0.04 -4.42 105.19 103.70 3dft n GLY 225 Ca -0.03 -1.11 -0.13 0.00 0.00 0.00 0.00 46.02 44.76 3dft n GLY 225 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dft s THR 226 N -3.30 0.25 0.10 2.61 -4.23 -0.32 -4.11 115.64 106.63 3dft s THR 226 Ca 0.56 -1.97 0.03 0.00 -1.18 0.00 0.00 61.69 59.12 3dft s THR 226 Cb 0.47 -2.36 -0.04 0.00 1.34 0.00 0.00 72.50 71.91 3dft s THR 226 CO 0.10 -0.18 -0.08 -0.76 -0.54 0.00 0.00 174.62 173.15 3dft s LEU 227 N -3.17 2.47 -0.11 4.79 1.43 -1.10 -3.62 118.68 119.37 3dft s LEU 227 Ca 0.33 -0.93 0.03 0.00 -1.03 0.00 0.00 54.13 52.53 3dft s LEU 227 Cb 0.07 -0.17 -0.01 0.00 0.03 0.00 0.00 46.19 46.12 3dft s LEU 227 CO 0.09 -0.38 -0.20 -0.22 0.23 0.00 0.00 176.35 175.86 3dft s LEU 228 N -2.81 2.30 -0.65 1.79 2.96 -0.37 -0.50 118.68 121.39 3dft s LEU 228 Ca 0.09 -0.48 0.04 0.00 -0.22 0.00 0.00 54.13 53.57 3dft s LEU 228 Cb 0.02 -1.47 0.16 0.00 0.50 0.00 0.00 46.19 45.39 3dft s LEU 228 CO -0.03 0.17 0.43 -0.75 -1.32 0.00 0.00 176.35 174.85 3dft s LYS 229 N 0.30 2.34 0.42 1.98 2.20 0.32 0.32 119.74 127.62 3dft s LYS 229 Ca -0.15 -3.12 0.08 0.00 -0.36 0.00 0.00 55.97 52.42 3dft s LYS 229 Cb -0.17 -3.41 0.00 0.00 -1.51 0.00 0.00 37.83 32.74 3dft s LYS 229 CO 0.08 -1.23 0.51 -1.25 -0.36 0.00 0.00 175.35 173.10 3dft s PRO 230 N -1.08 2.73 0.52 4.03 0.04 -1.26 -3.84 135.00 136.14 3dft s PRO 230 Ca 0.22 -1.34 -0.16 0.00 0.04 0.00 0.00 61.00 59.77 3dft s PRO 230 Cb -0.11 -2.64 -0.08 0.00 0.04 0.00 0.00 34.50 31.71 3dft s PRO 230 CO -0.11 -0.25 0.99 0.54 0.04 0.00 0.00 177.00 178.20 3dft s ASN 231 N -4.28 6.60 0.72 6.66 4.22 -1.26 -2.44 114.94 125.16 3dft s ASN 231 Ca 0.53 1.56 -0.11 0.00 -2.14 0.00 0.00 52.86 52.69 3dft s ASN 231 Cb -0.08 -2.50 0.02 0.00 1.28 0.00 0.00 41.25 39.97 3dft s ASN 231 CO 0.31 -0.60 1.08 -0.04 -2.04 0.00 0.00 177.10 175.82 3dft s MET 232 N -4.12 2.76 -0.43 3.55 -1.94 -1.26 -4.94 119.30 112.92 3dft s MET 232 Ca 0.59 0.59 -0.21 0.00 -1.71 0.00 0.00 55.69 54.95 3dft s MET 232 Cb -0.10 -2.00 0.02 0.00 2.01 0.00 0.00 34.83 34.76 3dft s MET 232 CO 0.32 -1.14 0.68 0.08 -0.01 0.00 0.00 175.02 174.96 3dft s VAL 233 N -3.25 4.79 0.16 -6.03 1.01 -1.26 -5.01 120.40 110.80 3dft s VAL 233 Ca 0.58 0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.81 3dft s VAL 233 Cb -0.12 -4.22 -0.04 0.00 0.00 0.00 0.00 36.38 32.00 3dft s VAL 233 CO 0.53 -0.60 0.04 0.42 0.00 0.00 0.00 175.10 175.50 3dft s THR 234 N 2.92 0.31 0.94 3.92 -4.23 -1.26 -4.46 115.64 113.78 3dft s THR 234 Ca 0.25 -1.94 -0.12 0.00 -1.18 0.00 0.00 61.69 58.69 3dft s THR 234 Cb -0.14 -2.13 0.15 0.00 1.34 0.00 0.00 72.50 71.73 3dft s THR 234 CO 0.19 -0.42 1.12 -2.16 -0.54 0.00 0.00 174.62 172.82 3dft s PRO 235 N -4.01 0.92 0.59 3.99 0.04 -1.26 -4.59 135.00 130.68 3dft s PRO 235 Ca 0.26 0.38 -0.19 0.00 0.04 0.00 0.00 61.00 61.49 3dft s PRO 235 Cb 0.07 -1.81 -0.03 0.00 0.04 0.00 0.00 34.50 32.77 3dft s PRO 235 CO 0.04 -2.37 1.20 0.20 0.04 0.00 0.00 177.00 176.11 3dft s GLY 236 N -3.82 2.71 0.60 0.56 0.00 0.73 -4.88 107.32 103.22 3dft s GLY 236 Ca 0.64 0.98 0.30 0.00 0.00 0.00 0.00 44.72 46.65 3dft s GLY 236 CO 0.55 1.37 2.12 0.84 0.00 0.00 0.00 173.10 177.98 3dft h HIS 237 N 0.85 0.00 -0.45 1.90 2.76 -0.53 0.65 115.15 120.34 3dft h HIS 237 Ca -0.50 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.67 3dft h HIS 237 Cb 1.29 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.25 3dft h HIS 237 CO 0.47 0.00 0.00 0.00 -1.30 0.00 0.00 177.93 177.10 3dft n ALA 238 N -2.27 2.39 -1.77 5.26 0.00 0.21 -4.98 120.51 119.35 3dft n ALA 238 Ca 0.01 -1.07 -0.40 0.00 0.00 0.00 0.00 53.44 51.98 3dft n ALA 238 Cb 0.29 -0.81 -0.02 0.00 0.00 0.00 0.00 19.45 18.91 3dft n ALA 238 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dft h THR 240 N 2.83 0.94 -2.92 0.00 1.35 -1.88 -3.47 112.91 109.76 3dft h THR 240 Ca -0.49 -2.47 -0.52 0.00 -0.55 0.00 0.00 66.41 62.38 3dft h THR 240 Cb 1.23 2.73 0.07 0.00 -1.73 0.00 0.00 68.15 70.46 3dft h THR 240 CO 0.64 0.82 0.97 -1.58 -0.25 0.00 0.00 175.52 176.13 3dft s GLN 241 N -2.55 4.12 0.20 4.72 0.74 -1.26 -4.99 119.66 120.64 3dft s GLN 241 Ca -0.18 2.61 -0.06 0.00 0.05 0.00 0.00 55.36 57.79 3dft s GLN 241 Cb 0.05 -3.05 -0.06 0.00 1.10 0.00 0.00 33.01 31.05 3dft s GLN 241 CO 0.82 -0.72 0.46 0.15 -0.55 0.00 0.00 175.29 175.46 3dft s LYS 242 N 0.53 3.67 0.07 1.67 3.01 -1.26 -5.01 119.74 122.43 3dft s LYS 242 Ca 0.71 0.03 0.02 0.00 -1.01 0.00 0.00 55.97 55.72 3dft s LYS 242 Cb -0.49 -2.75 -0.03 0.00 -1.01 0.00 0.00 37.83 33.55 3dft s LYS 242 CO 0.38 0.37 -0.08 0.71 0.51 0.00 0.00 175.35 177.24 3dft s TYR 243 N -1.80 0.84 0.61 3.18 2.02 -1.26 -5.14 117.35 115.79 3dft s TYR 243 Ca 0.43 -0.69 -0.02 0.00 -0.37 0.00 0.00 57.07 56.42 3dft s TYR 243 Cb -0.11 -0.48 0.04 0.00 -0.40 0.00 0.00 41.96 41.00 3dft s TYR 243 CO 0.25 -0.09 0.87 -1.54 -1.57 0.00 0.00 175.55 173.46 3dft s SER 244 N -2.31 5.16 0.34 2.29 1.04 -1.26 -4.96 113.70 114.00 3dft s SER 244 Ca 0.02 0.24 0.10 0.00 0.48 0.00 0.00 55.95 56.78 3dft s SER 244 Cb -0.03 -1.06 0.61 0.00 0.10 0.00 0.00 66.02 65.64 3dft s SER 244 CO -0.02 -1.28 1.78 0.45 0.98 0.00 0.00 173.24 175.15 3dft h HIS 245 N -0.18 0.15 -0.20 5.02 3.86 -1.99 -2.23 115.15 119.58 3dft h HIS 245 Ca -0.43 -0.03 -0.09 0.00 -1.16 0.00 0.00 60.37 58.65 3dft h HIS 245 Cb 1.30 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 29.72 3dft h HIS 245 CO 0.37 0.48 -0.27 0.93 0.86 0.00 0.00 177.93 180.30 3dft h GLU 246 N 0.11 0.37 -0.11 2.45 3.07 -1.94 -0.67 114.58 117.87 3dft h GLU 246 Ca 0.01 -0.14 -0.23 0.00 -0.50 0.00 0.00 59.36 58.51 3dft h GLU 246 Cb 0.70 -0.02 0.01 0.00 -0.84 0.00 0.00 28.75 28.59 3dft h GLU 246 CO 0.05 0.61 -0.84 0.93 -1.40 0.00 0.00 179.01 178.37 3dft h GLU 247 N 0.33 0.73 -0.61 2.33 5.08 -1.83 -1.03 114.58 119.58 3dft h GLU 247 Ca 0.05 -0.63 -0.05 0.00 -1.00 0.00 0.00 59.36 57.72 3dft h GLU 247 Cb 0.65 0.15 -0.03 0.00 0.50 0.00 0.00 28.75 30.02 3dft h GLU 247 CO 0.05 1.24 0.17 0.82 -1.00 0.00 0.00 179.01 180.29 3dft h ILE 248 N 0.48 1.25 -0.60 3.13 2.04 -1.21 -1.23 117.51 121.36 3dft h ILE 248 Ca -0.07 -0.88 -0.09 0.00 1.00 0.00 0.00 64.86 64.82 3dft h ILE 248 Cb 1.47 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 38.18 3dft h ILE 248 CO 0.17 0.33 0.01 0.00 0.00 0.00 0.00 178.15 178.66 3dft h ALA 249 N 1.05 0.81 -0.40 1.87 0.00 -1.07 -0.87 119.26 120.66 3dft h ALA 249 Ca 0.19 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 3dft h ALA 249 Cb 0.32 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3dft h ALA 249 CO -0.00 0.65 0.09 1.98 0.00 0.00 0.00 179.25 181.97 3dft h MET 250 N 0.96 0.64 -0.43 0.00 1.85 -0.93 -0.03 114.93 117.00 3dft h MET 250 Ca 0.17 -0.16 -0.06 0.00 -0.61 0.00 0.00 59.70 59.04 3dft h MET 250 Cb 0.55 -0.08 -0.02 0.00 0.43 0.00 0.00 31.60 32.48 3dft h MET 250 CO 0.03 0.67 0.02 0.00 -0.40 0.00 0.00 176.91 177.23 3dft h ALA 251 N 0.95 0.57 0.29 0.39 0.00 -1.16 -1.28 119.26 119.02 3dft h ALA 251 Ca 0.13 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 3dft h ALA 251 Cb 0.32 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3dft h ALA 251 CO 0.00 0.34 -0.14 1.15 0.00 0.00 0.00 179.25 180.60 3dft h THR 252 N 0.58 0.74 -0.19 0.00 2.02 -1.01 -1.53 112.91 113.52 3dft h THR 252 Ca 0.12 -0.28 -0.06 0.00 0.77 0.00 0.00 66.41 66.96 3dft h THR 252 Cb 0.46 0.90 -0.01 0.00 -1.74 0.00 0.00 68.15 67.75 3dft h THR 252 CO 0.02 0.06 -0.15 0.58 0.37 0.00 0.00 175.52 176.40 3dft h VAL 253 N -0.55 1.21 -0.24 3.16 2.07 -1.03 -2.17 116.25 118.70 3dft h VAL 253 Ca -0.04 -0.91 -0.05 0.00 0.82 0.00 0.00 66.70 66.51 3dft h VAL 253 Cb 0.40 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 3dft h VAL 253 CO 0.07 0.29 -0.06 0.74 0.02 0.00 0.00 177.57 178.63 3dft h THR 254 N 0.30 1.28 -0.87 2.57 2.02 -1.13 -0.16 112.91 116.91 3dft h THR 254 Ca 0.06 -1.05 -0.01 0.00 0.77 0.00 0.00 66.41 66.17 3dft h THR 254 Cb 0.44 1.49 -0.04 0.00 -1.74 0.00 0.00 68.15 68.30 3dft h THR 254 CO 0.03 0.33 0.50 0.00 0.37 0.00 0.00 175.52 176.74 3dft h ALA 255 N 0.76 1.24 -0.12 6.16 0.00 -1.08 -2.03 119.26 124.18 3dft h ALA 255 Ca 0.06 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 3dft h ALA 255 Cb 0.52 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 3dft h ALA 255 CO 0.02 0.63 -0.05 -0.07 0.00 0.00 0.00 179.25 179.78 3dft h LEU 256 N 1.21 0.26 -2.03 0.00 3.38 -1.23 -3.01 115.31 113.89 3dft h LEU 256 Ca 0.31 -0.40 0.01 0.00 0.09 0.00 0.00 57.88 57.88 3dft h LEU 256 Cb -0.01 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 3dft h LEU 256 CO -0.05 0.61 0.02 0.03 0.09 0.00 0.00 178.44 179.13 3dft h ARG 257 N -0.09 0.00 -0.00 1.13 3.08 -0.85 0.15 114.38 117.80 3dft h ARG 257 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.08 3dft h ARG 257 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.56 3dft h ARG 257 CO 0.02 0.00 -0.12 0.54 -1.07 0.00 0.00 179.97 179.33 3dft n ARG 258 N -4.48 0.32 0.00 0.04 1.74 -0.78 -4.52 116.66 108.98 3dft n ARG 258 Ca -0.02 -0.08 0.00 0.00 -0.77 0.00 0.00 57.85 56.97 3dft n ARG 258 Cb 0.12 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.06 3dft n ARG 258 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3dft n THR 259 N -1.27 0.00 -3.05 0.55 -2.24 -0.78 -5.01 114.28 102.49 3dft n THR 259 Ca 0.11 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.46 3dft n THR 259 Cb 0.30 -0.07 -0.06 0.00 -2.10 0.00 0.00 70.33 68.40 3dft n THR 259 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3dft s VAL 260 N -0.95 4.77 0.48 2.28 1.01 0.46 -4.79 120.40 123.65 3dft s VAL 260 Ca 0.00 0.35 -0.24 0.00 0.00 0.00 0.00 61.98 62.10 3dft s VAL 260 Cb 0.00 -4.23 -0.08 0.00 0.00 0.00 0.00 36.38 32.07 3dft s VAL 260 CO 0.00 -0.59 1.26 -2.65 0.00 0.00 0.00 175.10 173.12 3dft n PRO 261 N 6.41 1.75 0.08 2.72 -0.02 -1.26 -4.82 135.00 139.85 3dft n PRO 261 Ca 0.00 0.63 0.19 0.00 -2.02 0.00 0.00 63.50 62.30 3dft n PRO 261 Cb 0.48 -2.41 0.73 0.00 -0.02 0.00 0.00 33.50 32.28 3dft n PRO 261 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3dft h PRO 262 N 1.72 0.00 0.00 0.52 0.11 -1.96 -1.96 132.00 130.43 3dft h PRO 262 Ca -0.49 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 3dft h PRO 262 Cb 1.31 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.41 3dft h PRO 262 CO 0.58 0.00 -0.03 0.00 -0.21 0.00 0.00 178.00 178.34 3dft h ALA 263 N 1.72 1.28 -2.38 -0.75 0.00 -1.90 -3.42 119.26 113.81 3dft h ALA 263 Ca 0.18 -0.03 -0.53 0.00 0.00 0.00 0.00 54.91 54.53 3dft h ALA 263 Cb 0.83 -0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.63 3dft h ALA 263 CO -0.00 0.04 1.13 0.08 0.00 0.00 0.00 179.25 180.49 3dft s VAL 264 N -4.33 3.08 0.20 0.00 1.01 -0.74 -3.17 120.40 116.46 3dft s VAL 264 Ca -0.04 0.29 -0.10 0.00 0.00 0.00 0.00 61.98 62.12 3dft s VAL 264 Cb 0.14 -3.18 0.15 0.00 0.00 0.00 0.00 36.38 33.48 3dft s VAL 264 CO 0.51 -0.02 1.85 0.74 0.00 0.00 0.00 175.10 178.19 3dft h THR 265 N 5.30 1.20 -2.38 3.92 2.02 -1.68 -3.43 112.91 117.86 3dft h THR 265 Ca -0.45 -0.43 0.05 0.00 0.77 0.00 0.00 66.41 66.35 3dft h THR 265 Cb 1.21 0.16 -0.15 0.00 -1.74 0.00 0.00 68.15 67.63 3dft h THR 265 CO 0.94 0.21 0.39 -0.83 0.37 0.00 0.00 175.52 176.60 3dft s GLY 266 N -2.95 -0.50 -0.21 2.16 0.00 -1.26 -3.23 107.32 101.33 3dft s GLY 266 Ca -0.13 1.00 -0.03 0.00 0.00 0.00 0.00 44.72 45.56 3dft s GLY 266 CO 0.79 0.42 -0.07 0.14 0.00 0.00 0.00 173.10 174.37 3dft s VAL 267 N -2.91 3.12 -0.49 1.40 1.01 0.71 -1.24 120.40 122.00 3dft s VAL 267 Ca 0.02 -0.58 -0.01 0.00 0.00 0.00 0.00 61.98 61.41 3dft s VAL 267 Cb -0.01 -2.40 0.13 0.00 0.00 0.00 0.00 36.38 34.10 3dft s VAL 267 CO -0.07 0.45 0.27 0.42 0.00 0.00 0.00 175.10 176.17 3dft s THR 268 N 1.42 3.19 0.45 3.92 -4.23 0.15 -0.81 115.64 119.72 3dft s THR 268 Ca 0.05 -2.60 -0.25 0.00 -1.18 0.00 0.00 61.69 57.71 3dft s THR 268 Cb -0.14 -3.17 -0.08 0.00 1.34 0.00 0.00 72.50 70.45 3dft s THR 268 CO -0.05 -0.76 1.40 -0.36 -0.54 0.00 0.00 174.62 174.31 3dft s PHE 269 N 0.48 2.51 0.03 3.99 0.08 -0.62 -4.15 117.98 120.31 3dft s PHE 269 Ca 0.13 1.30 -0.10 0.00 0.12 0.00 0.00 56.93 58.38 3dft s PHE 269 Cb -0.22 -3.86 -0.05 0.00 -0.57 0.00 0.00 43.02 38.31 3dft s PHE 269 CO -0.04 -2.78 0.36 -0.48 -0.10 0.00 0.00 175.22 172.19 3dft s LEU 270 N -2.73 4.38 0.43 -0.37 0.05 -1.02 -1.80 118.68 117.63 3dft s LEU 270 Ca 0.61 0.76 0.23 0.00 0.05 0.00 0.00 54.13 55.79 3dft s LEU 270 Cb -0.42 -2.78 0.49 0.00 -2.05 0.00 0.00 46.19 41.43 3dft s LEU 270 CO 0.54 0.24 1.66 0.77 -0.55 0.00 0.00 176.35 179.00 3dft h SER 271 N 4.06 0.00 0.00 1.48 4.64 -1.91 -3.39 113.55 118.43 3dft h SER 271 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 3dft h SER 271 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 3dft h SER 271 CO 0.65 0.10 0.00 0.61 -0.87 0.00 0.00 176.83 177.32 3dft n GLY 272 N 0.89 3.36 0.81 -0.77 0.00 -1.26 -2.02 105.19 106.21 3dft n GLY 272 Ca 0.03 -0.12 0.07 0.00 0.00 0.00 0.00 46.02 46.00 3dft n GLY 272 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dft n GLY 273 N 0.00 2.20 3.76 -0.02 0.00 -1.26 -4.77 105.19 105.09 3dft n GLY 273 Ca 0.00 -0.49 -0.38 0.00 0.00 0.00 0.00 46.02 45.15 3dft n GLY 273 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dft s GLN 274 N -1.05 3.33 1.00 1.61 -0.21 -0.85 -1.19 119.66 122.31 3dft s GLN 274 Ca 0.29 2.02 -0.14 0.00 0.02 0.00 0.00 55.36 57.55 3dft s GLN 274 Cb 0.15 -2.27 0.19 0.00 1.00 0.00 0.00 33.01 32.09 3dft s GLN 274 CO 0.21 -0.97 1.13 -1.54 -2.12 0.00 0.00 175.29 172.00 3dft s SER 275 N -1.18 2.66 0.20 5.90 1.04 -1.26 -4.21 113.70 116.86 3dft s SER 275 Ca 0.70 0.90 -0.10 0.00 0.48 0.00 0.00 55.95 57.92 3dft s SER 275 Cb -0.35 -1.40 0.19 0.00 0.10 0.00 0.00 66.02 64.56 3dft s SER 275 CO 0.41 -3.07 1.82 -0.33 0.98 0.00 0.00 173.24 173.05 3dft h GLU 276 N -1.86 0.71 -0.17 4.02 5.08 -1.72 -0.53 114.58 120.12 3dft h GLU 276 Ca -0.50 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 57.73 3dft h GLU 276 Cb 1.32 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 30.41 3dft h GLU 276 CO 0.53 0.47 -0.22 0.93 -1.00 0.00 0.00 179.01 179.72 3dft h GLU 277 N 0.73 0.46 -0.73 2.33 4.39 -1.39 -2.69 114.58 117.68 3dft h GLU 277 Ca 0.27 -0.26 0.04 0.00 0.34 0.00 0.00 59.36 59.75 3dft h GLU 277 Cb 0.09 0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 28.71 3dft h GLU 277 CO -0.14 0.84 0.45 1.49 -1.16 0.00 0.00 179.01 180.50 3dft h GLU 278 N 0.10 0.83 -0.76 2.33 4.57 -1.75 0.28 114.58 120.19 3dft h GLU 278 Ca 0.02 -0.05 -0.04 0.00 -1.18 0.00 0.00 59.36 58.11 3dft h GLU 278 Cb 0.78 -0.19 -0.03 0.00 -0.16 0.00 0.00 28.75 29.15 3dft h GLU 278 CO 0.05 0.55 0.30 0.00 -1.18 0.00 0.00 179.01 178.73 3dft h ALA 279 N 1.33 0.99 -0.14 2.92 0.00 -1.10 -1.25 119.26 122.01 3dft h ALA 279 Ca 0.31 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 3dft h ALA 279 Cb 0.08 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.57 3dft h ALA 279 CO -0.14 0.62 -0.31 0.77 0.00 0.00 0.00 179.25 180.19 3dft h SER 280 N 1.10 0.52 -0.58 0.00 0.02 -1.02 -2.33 113.55 111.26 3dft h SER 280 Ca 0.25 -0.57 -0.03 0.00 -0.84 0.00 0.00 61.79 60.60 3dft h SER 280 Cb 0.22 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.59 3dft h SER 280 CO -0.02 0.99 0.24 0.40 -1.14 0.00 0.00 176.83 177.30 3dft h ILE 281 N 0.06 1.22 -0.48 3.27 2.04 -0.39 -1.28 117.51 121.96 3dft h ILE 281 Ca -0.00 -0.69 -0.10 0.00 1.00 0.00 0.00 64.86 65.08 3dft h ILE 281 Cb 0.92 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 37.58 3dft h ILE 281 CO 0.07 0.27 -0.08 0.78 0.00 0.00 0.00 178.15 179.19 3dft h ASN 282 N 0.80 0.89 -0.36 1.72 2.35 -1.29 -1.61 115.58 118.08 3dft h ASN 282 Ca 0.19 -0.34 -0.03 0.00 -0.55 0.00 0.00 56.30 55.57 3dft h ASN 282 Cb 0.19 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 3dft h ASN 282 CO -0.02 1.02 0.13 0.25 -1.65 0.00 0.00 177.43 177.17 3dft h LEU 283 N 0.74 0.56 -0.18 1.61 5.85 -1.22 -1.15 115.31 121.52 3dft h LEU 283 Ca 0.13 -0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.73 3dft h LEU 283 Cb 0.61 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 3dft h LEU 283 CO 0.04 0.54 -0.06 -1.13 -0.34 0.00 0.00 178.44 177.49 3dft h ASN 284 N 0.61 0.37 -0.85 1.25 -0.73 -0.99 -2.60 115.58 112.64 3dft h ASN 284 Ca 0.14 -0.38 0.01 0.00 1.87 0.00 0.00 56.30 57.94 3dft h ASN 284 Cb 0.19 -0.10 -0.04 0.00 0.27 0.00 0.00 38.32 38.63 3dft h ASN 284 CO -0.01 0.67 0.57 0.00 -0.37 0.00 0.00 177.43 178.29 3dft h ALA 285 N 0.71 1.39 -0.41 1.57 0.00 -0.87 -1.50 119.26 120.16 3dft h ALA 285 Ca 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3dft h ALA 285 Cb 0.52 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 3dft h ALA 285 CO 0.02 0.56 0.27 0.82 0.00 0.00 0.00 179.25 180.92 3dft h ILE 286 N 1.15 1.11 0.00 0.00 2.04 -1.12 -0.87 117.51 119.82 3dft h ILE 286 Ca 0.31 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.97 3dft h ILE 286 Cb -0.13 0.51 0.00 0.00 -0.74 0.00 0.00 36.82 36.46 3dft h ILE 286 CO -0.07 0.10 0.00 0.78 0.00 0.00 0.00 178.15 178.97 3dft h ASN 287 N 0.55 0.00 0.11 1.72 2.35 -1.00 -2.37 115.58 116.94 3dft h ASN 287 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 3dft h ASN 287 Cb -0.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.31 3dft h ASN 287 CO -0.03 0.00 -0.45 0.29 -1.65 0.00 0.00 177.43 175.58 3dft n LYS 288 N -2.55 0.87 -1.80 0.81 5.02 -0.60 -4.71 118.16 115.20 3dft n LYS 288 Ca 0.02 -0.64 -0.42 0.00 -2.02 0.00 0.00 58.31 55.24 3dft n LYS 288 Cb 0.27 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.76 3dft n LYS 288 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3dft h PRO 290 N 6.83 0.62 -6.64 0.00 0.11 -1.91 -3.45 132.00 127.56 3dft h PRO 290 Ca -0.43 -0.04 -0.58 0.00 0.11 0.00 0.00 66.00 65.07 3dft h PRO 290 Cb 1.20 -0.14 0.16 0.00 0.11 0.00 0.00 31.00 32.34 3dft h PRO 290 CO 0.94 0.41 -0.14 1.28 -0.21 0.00 0.00 178.00 180.29 3dft n LEU 291 N -4.49 2.07 -4.72 2.35 4.77 -1.26 -4.90 117.00 110.82 3dft n LEU 291 Ca 0.12 0.80 -0.42 0.00 -0.03 0.00 0.00 56.01 56.48 3dft n LEU 291 Cb 0.32 -1.27 -0.03 0.00 -2.33 0.00 0.00 43.42 40.11 3dft n LEU 291 CO 0.33 -2.44 0.99 -0.22 -1.33 0.00 0.00 177.39 174.72 3dft s LEU 292 N -0.44 4.38 -0.32 2.23 2.96 -1.26 -5.01 118.68 121.22 3dft s LEU 292 Ca 0.71 2.24 0.01 0.00 -0.22 0.00 0.00 54.13 56.88 3dft s LEU 292 Cb -0.45 -3.59 0.10 0.00 0.50 0.00 0.00 46.19 42.75 3dft s LEU 292 CO 0.52 -0.56 0.08 -0.54 -1.32 0.00 0.00 176.35 174.52 3dft s LYS 293 N 0.82 1.05 0.00 1.98 1.02 -1.26 -4.96 119.74 118.39 3dft s LYS 293 Ca 0.61 -1.41 0.04 0.00 0.02 0.00 0.00 55.97 55.23 3dft s LYS 293 Cb -0.34 -2.51 0.25 0.00 -0.52 0.00 0.00 37.83 34.71 3dft s LYS 293 CO 0.32 -0.96 0.87 -0.35 -0.92 0.00 0.00 175.35 174.31 3dft n PRO 294 N 4.60 0.68 -4.13 -1.68 -0.04 -1.26 -4.79 135.00 128.37 3dft n PRO 294 Ca 0.00 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.36 3dft n PRO 294 Cb 0.42 -1.10 -0.10 0.00 -0.04 0.00 0.00 33.50 32.68 3dft n PRO 294 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 3dft s TRP 295 N -2.00 0.79 0.34 0.54 0.51 -1.26 -4.89 118.94 112.97 3dft s TRP 295 Ca 0.06 -0.84 -0.28 0.00 -2.12 0.00 0.00 56.10 52.92 3dft s TRP 295 Cb 0.03 -0.47 -0.10 0.00 -0.81 0.00 0.00 33.47 32.12 3dft s TRP 295 CO 0.05 -0.16 1.28 0.00 -0.51 0.00 0.00 176.95 177.61 3dft s ALA 296 N -3.15 3.43 -0.39 0.98 0.00 -1.20 -4.85 121.76 116.57 3dft s ALA 296 Ca 0.06 1.21 0.03 0.00 0.00 0.00 0.00 51.96 53.26 3dft s ALA 296 Cb 0.02 -3.46 0.11 0.00 0.00 0.00 0.00 23.12 19.79 3dft s ALA 296 CO -0.04 -0.63 0.13 -0.51 0.00 0.00 0.00 175.76 174.71 3dft s LEU 297 N -1.92 4.16 0.00 0.00 1.43 -1.26 -0.21 118.68 120.88 3dft s LEU 297 Ca 0.50 -2.36 0.00 0.00 -1.03 0.00 0.00 54.13 51.24 3dft s LEU 297 Cb -0.38 -1.49 0.00 0.00 0.03 0.00 0.00 46.19 44.35 3dft s LEU 297 CO 0.50 -0.34 0.00 1.07 0.23 0.00 0.00 176.35 177.82 3dft n THR 298 N 3.96 0.00 -4.48 5.49 5.66 0.01 -4.67 114.28 120.25 3dft n THR 298 Ca 0.04 0.00 -0.25 0.00 -3.05 0.00 0.00 64.05 60.79 3dft n THR 298 Cb 0.39 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.07 3dft n THR 298 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 175.07 172.74 3dft s PHE 299 N 0.45 2.38 -0.46 1.09 -0.71 -1.26 -1.59 117.98 117.87 3dft s PHE 299 Ca 0.00 -0.40 0.06 0.00 -1.04 0.00 0.00 56.93 55.55 3dft s PHE 299 Cb 0.00 -1.20 0.22 0.00 -1.21 0.00 0.00 43.02 40.83 3dft s PHE 299 CO 0.00 0.64 0.69 0.45 -1.34 0.00 0.00 175.22 175.66 3dft n SER 300 N -0.73 -1.99 -4.90 1.98 2.88 -0.74 0.42 113.62 110.53 3dft n SER 300 Ca -0.05 -2.95 -0.33 0.00 -1.33 0.00 0.00 58.87 54.21 3dft n SER 300 Cb 0.62 0.92 -0.05 0.00 -0.75 0.00 0.00 64.21 64.95 3dft n SER 300 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 3dft s TYR 301 N 0.21 3.54 0.00 0.66 2.02 -0.95 -4.45 117.35 118.38 3dft s TYR 301 Ca 0.32 0.49 0.00 0.00 -0.37 0.00 0.00 57.07 57.51 3dft s TYR 301 Cb 0.14 -1.93 0.00 0.00 -0.40 0.00 0.00 41.96 39.77 3dft s TYR 301 CO -0.17 0.58 0.00 0.41 -1.57 0.00 0.00 175.55 174.80 3dft n GLY 302 N 0.75 -0.04 0.28 0.71 0.00 -1.26 -0.25 105.19 105.40 3dft n GLY 302 Ca -0.08 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.09 3dft n GLY 302 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3dft h ARG 303 N 0.00 0.00 0.00 1.61 3.08 -1.96 -1.33 114.38 115.78 3dft h ARG 303 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3dft h ARG 303 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3dft h ARG 303 CO 0.00 0.07 0.00 0.00 -1.07 0.00 0.00 179.97 178.97 3dft n ALA 304 N -2.23 1.70 0.04 0.04 0.00 -1.26 -0.77 120.51 118.02 3dft n ALA 304 Ca -0.02 -0.06 0.01 0.00 0.00 0.00 0.00 53.44 53.37 3dft n ALA 304 Cb 0.19 -1.22 -0.01 0.00 0.00 0.00 0.00 19.45 18.41 3dft n ALA 304 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3dft n LEU 305 N -1.41 0.04 -0.00 0.00 4.77 -0.54 -4.62 117.00 115.25 3dft n LEU 305 Ca 0.05 -0.26 0.03 0.00 -0.03 0.00 0.00 56.01 55.80 3dft n LEU 305 Cb 0.14 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.19 3dft n LEU 305 CO 0.12 0.01 -0.05 0.00 -1.33 0.00 0.00 177.39 176.14 3dft n GLN 306 N -1.29 4.58 -0.04 3.23 6.02 -0.93 -4.62 117.38 124.33 3dft n GLN 306 Ca 0.00 -0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 56.92 3dft n GLN 306 Cb 0.04 -0.83 -0.05 0.00 1.02 0.00 0.00 30.24 30.42 3dft n GLN 306 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3dft h ALA 307 N 0.90 -0.59 -0.42 -1.58 0.00 -1.23 -0.18 119.26 116.17 3dft h ALA 307 Ca 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 3dft h ALA 307 Cb 0.16 0.86 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 3dft h ALA 307 CO 0.00 -0.71 0.13 0.77 0.00 0.00 0.00 179.25 179.44 3dft h SER 308 N -0.24 0.55 0.30 0.00 0.02 -1.85 -2.89 113.55 109.44 3dft h SER 308 Ca 0.03 -0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 60.89 3dft h SER 308 Cb 0.31 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 62.71 3dft h SER 308 CO -0.26 0.53 -0.16 0.00 -1.14 0.00 0.00 176.83 175.81 3dft h ALA 309 N 1.55 -0.42 -0.61 3.77 0.00 -1.64 -1.20 119.26 120.71 3dft h ALA 309 Ca 0.14 -0.09 0.09 0.00 0.00 0.00 0.00 54.91 55.05 3dft h ALA 309 Cb 0.18 0.18 -0.07 0.00 0.00 0.00 0.00 17.79 18.09 3dft h ALA 309 CO -0.01 -0.74 0.25 -0.07 0.00 0.00 0.00 179.25 178.69 3dft h LEU 310 N -0.42 0.29 -0.22 0.00 3.38 -0.92 -1.31 115.31 116.11 3dft h LEU 310 Ca -0.04 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3dft h LEU 310 Cb 0.34 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 3dft h LEU 310 CO 0.05 0.18 0.14 0.50 0.09 0.00 0.00 178.44 179.40 3dft h LYS 311 N 0.46 0.28 -0.46 1.13 3.64 -1.30 -0.83 116.57 119.49 3dft h LYS 311 Ca 0.30 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.63 3dft h LYS 311 Cb 0.34 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 3dft h LYS 311 CO -0.28 0.19 0.16 0.00 -2.27 0.00 0.00 179.45 177.25 3dft h ALA 312 N 1.09 1.41 0.10 5.00 0.00 -0.75 -3.11 119.26 123.00 3dft h ALA 312 Ca 0.08 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 3dft h ALA 312 Cb -0.03 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.57 3dft h ALA 312 CO -0.02 0.44 -0.05 2.35 0.00 0.00 0.00 179.25 181.97 3dft h TRP 313 N 0.66 -0.12 0.00 0.00 7.01 -0.91 -3.42 115.95 119.18 3dft h TRP 313 Ca 0.16 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.15 3dft h TRP 313 Cb 0.18 0.04 0.00 0.00 -2.10 0.00 0.00 29.16 27.28 3dft h TRP 313 CO 0.01 0.36 0.00 0.41 -2.79 0.00 0.00 178.44 176.43 3dft n GLY 314 N 0.38 0.02 0.47 2.65 0.00 -0.35 -1.12 105.19 107.24 3dft n GLY 314 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 3dft n GLY 314 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dft n GLY 315 N -1.27 0.57 3.62 -0.02 0.00 -1.26 -4.78 105.19 102.06 3dft n GLY 315 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 3dft n GLY 315 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dft s LYS 316 N -0.84 4.07 0.63 1.61 -0.14 -0.28 -4.93 119.74 119.86 3dft s LYS 316 Ca 0.00 0.31 0.36 0.00 -1.36 0.00 0.00 55.97 55.28 3dft s LYS 316 Cb 0.00 -3.65 2.06 0.00 -1.68 0.00 0.00 37.83 34.57 3dft s LYS 316 CO 0.00 -0.33 2.26 0.87 -0.76 0.00 0.00 175.35 177.39 3dft h LYS 317 N 7.98 0.00 0.00 1.68 1.57 -1.97 0.21 116.57 126.04 3dft h LYS 317 Ca -0.29 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.49 3dft h LYS 317 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.45 3dft h LYS 317 CO 0.71 0.00 0.00 -0.85 -0.57 0.00 0.00 179.45 178.74 3dft n GLU 318 N -3.41 0.11 -0.79 3.15 0.28 -1.26 -2.95 120.64 115.77 3dft n GLU 318 Ca -0.02 0.17 0.08 0.00 -0.16 0.00 0.00 57.16 57.22 3dft n GLU 318 Cb 0.14 -1.65 0.39 0.00 1.43 0.00 0.00 31.44 31.75 3dft n GLU 318 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 3dft n ASN 319 N -1.84 5.37 0.19 -1.84 3.02 0.06 -4.63 115.26 115.59 3dft n ASN 319 Ca 0.05 -2.76 -0.15 0.00 -0.03 0.00 0.00 54.58 51.69 3dft n ASN 319 Cb 0.33 -0.65 -0.09 0.00 -0.61 0.00 0.00 39.78 38.76 3dft n ASN 319 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 3dft h LEU 320 N 4.02 -1.30 -0.69 3.41 5.85 -1.65 0.81 115.31 125.76 3dft h LEU 320 Ca 0.00 0.12 0.10 0.00 0.84 0.00 0.00 57.88 58.94 3dft h LEU 320 Cb 1.78 0.45 -0.08 0.00 0.37 0.00 0.00 40.66 43.19 3dft h LEU 320 CO 0.39 -0.55 0.31 0.11 -0.34 0.00 0.00 178.44 178.36 3dft h LYS 321 N -0.80 0.50 -0.63 1.25 1.79 -1.87 -0.28 116.57 116.52 3dft h LYS 321 Ca -0.04 -0.03 -0.04 0.00 -2.18 0.00 0.00 60.65 58.37 3dft h LYS 321 Cb 0.73 -0.11 -0.03 0.00 -1.58 0.00 0.00 32.23 31.24 3dft h LYS 321 CO -0.14 0.33 0.25 0.00 -1.08 0.00 0.00 179.45 178.81 3dft h ALA 322 N 1.45 0.83 0.28 3.86 0.00 -1.82 -1.45 119.26 122.39 3dft h ALA 322 Ca 0.35 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3dft h ALA 322 Cb 0.42 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3dft h ALA 322 CO -0.30 0.45 -0.13 0.00 0.00 0.00 0.00 179.25 179.26 3dft h ALA 323 N 1.10 -0.37 -0.72 0.00 0.00 -0.00 -2.96 119.26 116.30 3dft h ALA 323 Ca 0.21 -0.14 0.07 0.00 0.00 0.00 0.00 54.91 55.05 3dft h ALA 323 Cb 0.22 0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 3dft h ALA 323 CO -0.02 -0.62 0.48 1.96 0.00 0.00 0.00 179.25 181.05 3dft h GLN 324 N -0.54 0.72 -1.01 0.00 4.20 -1.02 -1.87 115.11 115.60 3dft h GLN 324 Ca -0.04 -0.04 0.03 0.00 0.06 0.00 0.00 58.65 58.66 3dft h GLN 324 Cb 0.40 -0.16 -0.06 0.00 0.30 0.00 0.00 27.48 27.96 3dft h GLN 324 CO 0.06 0.48 0.66 1.49 -0.67 0.00 0.00 178.83 180.85 3dft h GLU 325 N 0.75 1.26 -0.35 1.46 4.57 -1.11 0.45 114.58 121.61 3dft h GLU 325 Ca 0.31 -0.08 -0.08 0.00 -1.18 0.00 0.00 59.36 58.33 3dft h GLU 325 Cb 0.27 -0.29 -0.01 0.00 -0.16 0.00 0.00 28.75 28.57 3dft h GLU 325 CO -0.10 0.84 -0.11 0.93 -1.18 0.00 0.00 179.01 179.38 3dft h GLU 326 N 1.30 0.69 -0.01 1.92 4.39 -1.19 -1.70 114.58 119.98 3dft h GLU 326 Ca 0.39 -0.28 0.00 0.00 0.34 0.00 0.00 59.36 59.82 3dft h GLU 326 Cb -0.04 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.57 3dft h GLU 326 CO -0.11 0.87 -0.01 -0.92 -1.16 0.00 0.00 179.01 177.68 3dft h TYR 327 N 0.47 -0.02 -0.86 4.33 3.20 -1.12 -2.13 116.97 120.84 3dft h TYR 327 Ca 0.08 0.00 0.13 0.00 3.14 0.00 0.00 58.73 62.09 3dft h TYR 327 Cb 0.63 0.01 -0.09 0.00 1.54 0.00 0.00 36.73 38.82 3dft h TYR 327 CO 0.05 -0.01 0.47 0.28 -1.64 0.00 0.00 178.16 177.31 3dft h VAL 328 N -0.01 0.80 -0.42 1.81 2.07 -0.83 -0.04 116.25 119.63 3dft h VAL 328 Ca 0.01 -0.24 0.03 0.00 0.82 0.00 0.00 66.70 67.31 3dft h VAL 328 Cb 0.02 0.02 -0.03 0.00 -1.52 0.00 0.00 31.29 29.78 3dft h VAL 328 CO -0.02 0.13 0.22 0.11 0.02 0.00 0.00 177.57 178.03 3dft h LYS 329 N 0.71 0.43 -0.13 1.57 1.57 -0.69 -0.66 116.57 119.37 3dft h LYS 329 Ca 0.45 -0.03 -0.12 0.00 -1.87 0.00 0.00 60.65 59.08 3dft h LYS 329 Cb 0.56 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.77 3dft h LYS 329 CO -0.32 0.28 -0.45 0.00 -0.57 0.00 0.00 179.45 178.40 3dft h ARG 330 N 0.44 0.32 -0.63 3.15 2.47 -0.65 -1.43 114.38 118.06 3dft h ARG 330 Ca 0.18 -0.17 -0.07 0.00 -1.26 0.00 0.00 59.98 58.66 3dft h ARG 330 Cb 0.06 0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.36 3dft h ARG 330 CO -0.11 0.71 0.11 0.00 0.56 0.00 0.00 179.97 181.24 3dft h ALA 331 N 1.27 0.84 -0.34 0.04 0.00 -0.53 -1.13 119.26 119.41 3dft h ALA 331 Ca 0.02 -0.26 -0.11 0.00 0.00 0.00 0.00 54.91 54.56 3dft h ALA 331 Cb 0.90 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 3dft h ALA 331 CO 0.07 0.60 -0.21 -0.07 0.00 0.00 0.00 179.25 179.64 3dft h LEU 332 N 0.96 0.77 0.01 0.00 3.38 -0.96 -1.08 115.31 118.39 3dft h LEU 332 Ca 0.19 -0.43 0.01 0.00 0.09 0.00 0.00 57.88 57.74 3dft h LEU 332 Cb 0.42 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 3dft h LEU 332 CO 0.01 1.03 -0.04 0.00 0.09 0.00 0.00 178.44 179.53 3dft h ALA 333 N 0.76 -0.05 0.00 1.53 0.00 -1.07 -1.83 119.26 118.60 3dft h ALA 333 Ca 0.07 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 3dft h ALA 333 Cb 0.77 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 3dft h ALA 333 CO 0.06 -0.54 -0.31 -0.91 0.00 0.00 0.00 179.25 177.55 3dft h ASN 334 N -0.08 0.00 -0.44 0.00 2.35 -1.20 -0.30 115.58 115.91 3dft h ASN 334 Ca 0.02 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.67 3dft h ASN 334 Cb 0.10 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.45 3dft h ASN 334 CO -0.04 0.31 -0.06 -1.28 -1.65 0.00 0.00 177.43 174.71 3dft h SER 335 N 0.00 0.86 -0.12 5.81 0.87 -0.77 -1.19 113.55 119.01 3dft h SER 335 Ca -0.00 -0.25 -0.23 0.00 -1.23 0.00 0.00 61.79 60.08 3dft h SER 335 Cb 0.68 -0.23 0.01 0.00 -0.44 0.00 0.00 62.40 62.42 3dft h SER 335 CO 0.04 0.96 -0.80 -0.07 -0.53 0.00 0.00 176.83 176.43 3dft h LEU 336 N 0.80 0.93 -0.68 2.23 3.38 -0.84 -3.28 115.31 117.85 3dft h LEU 336 Ca 0.14 -0.62 0.02 0.00 0.09 0.00 0.00 57.88 57.51 3dft h LEU 336 Cb 0.57 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.00 3dft h LEU 336 CO 0.03 1.42 0.43 0.00 0.09 0.00 0.00 178.44 180.41 3dft h ALA 337 N 0.56 0.88 0.00 1.53 0.00 -0.73 -0.51 119.26 120.98 3dft h ALA 337 Ca -0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3dft h ALA 337 Cb 1.43 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3dft h ALA 337 CO 0.16 0.21 0.00 0.00 0.00 0.00 0.00 179.25 179.62 3dft n GLN 339 N -0.43 -0.33 -2.24 0.00 6.02 -0.34 -4.63 117.38 115.45 3dft n GLN 339 Ca 0.00 -0.36 -0.13 0.00 -0.01 0.00 0.00 57.00 56.49 3dft n GLN 339 Cb 0.02 -0.78 -0.01 0.00 1.02 0.00 0.00 30.24 30.49 3dft n GLN 339 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3dft n GLY 340 N -0.03 -0.15 0.71 1.08 0.00 0.00 -4.92 105.19 101.89 3dft n GLY 340 Ca 0.00 -0.32 0.06 0.00 0.00 0.00 0.00 46.02 45.75 3dft n GLY 340 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3dft n LYS 341 N -2.29 1.28 -3.79 1.61 5.02 -0.41 -4.89 118.16 114.68 3dft n LYS 341 Ca -0.16 -3.01 -0.35 0.00 -2.02 0.00 0.00 58.31 52.77 3dft n LYS 341 Cb 0.62 -1.33 -0.08 0.00 -0.02 0.00 0.00 35.03 34.22 3dft n LYS 341 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 3dft s TYR 342 N -2.63 3.40 -0.28 2.13 5.04 -1.24 -4.76 117.35 119.01 3dft s TYR 342 Ca 0.36 0.31 -0.04 0.00 -2.44 0.00 0.00 57.07 55.26 3dft s TYR 342 Cb 0.36 -2.12 0.10 0.00 0.35 0.00 0.00 41.96 40.65 3dft s TYR 342 CO -0.08 0.32 0.13 0.99 -1.34 0.00 0.00 175.55 175.57 3dft s THR 343 N 0.21 -0.08 0.00 4.34 2.01 -1.26 -4.97 115.64 115.89 3dft s THR 343 Ca 0.08 -0.70 0.00 0.00 0.31 0.00 0.00 61.69 61.38 3dft s THR 343 Cb -0.11 -0.95 0.00 0.00 0.01 0.00 0.00 72.50 71.45 3dft s THR 343 CO -0.01 -0.68 0.00 -0.81 -0.69 0.00 0.00 174.62 172.43 3dft n PRO 344 N 5.25 0.00 -3.19 4.92 -0.04 -1.26 -4.94 135.00 135.75 3dft n PRO 344 Ca -0.06 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.21 3dft n PRO 344 Cb 0.43 0.00 0.02 0.00 -0.04 0.00 0.00 33.50 33.91 3dft n PRO 344 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3dft n SER 345 N 0.00 -6.81 0.00 3.54 2.88 -1.26 -4.97 113.62 107.00 3dft n SER 345 Ca 0.00 0.08 0.00 0.00 -1.33 0.00 0.00 58.87 57.62 3dft n SER 345 Cb 0.00 -3.76 0.00 0.00 -0.75 0.00 0.00 64.21 59.70 3dft n SER 345 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3dft n GLY 346 N -0.57 -0.83 3.00 0.46 0.00 -1.26 -5.05 105.19 100.94 3dft n GLY 346 Ca -0.01 -0.24 -0.42 0.00 0.00 0.00 0.00 46.02 45.36 3dft n GLY 346 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3dft n GLN 347 N 0.00 4.14 0.22 1.61 3.00 -1.26 -4.74 117.38 120.34 3dft n GLN 347 Ca 0.00 -4.55 0.12 0.00 -0.01 0.00 0.00 57.00 52.55 3dft n GLN 347 Cb 0.00 -2.49 0.16 0.00 0.00 0.00 0.00 30.24 27.91 3dft n GLN 347 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3dft h ALA 348 N 5.49 0.98 0.00 -1.58 0.00 -1.98 -3.50 119.26 118.67 3dft h ALA 348 Ca 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3dft h ALA 348 Cb 0.66 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.44 3dft h ALA 348 CO 1.24 0.01 0.00 0.41 0.00 0.00 0.00 179.25 180.91 3dft n GLY 349 N 1.10 1.07 0.19 0.00 0.00 -1.26 -4.33 105.19 101.96 3dft n GLY 349 Ca 0.04 -1.67 -0.00 0.00 0.00 0.00 0.00 46.02 44.39 3dft n GLY 349 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dft h ALA 350 N 0.00 1.21 0.00 4.61 0.00 -2.00 -2.71 119.26 120.38 3dft h ALA 350 Ca 0.00 -0.39 -0.04 0.00 0.00 0.00 0.00 54.91 54.48 3dft h ALA 350 Cb 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3dft h ALA 350 CO 0.00 0.55 -0.21 0.00 0.00 0.00 0.00 179.25 179.59 3dft h ALA 351 N 1.48 1.48 0.00 0.00 0.00 -1.97 -1.26 119.26 118.99 3dft h ALA 351 Ca 0.01 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3dft h ALA 351 Cb 0.76 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.52 3dft h ALA 351 CO 0.06 0.27 0.00 0.00 0.00 0.00 0.00 179.25 179.57 3dft n ALA 352 N -2.42 2.43 0.09 0.00 0.00 -1.02 -3.30 120.51 116.29 3dft n ALA 352 Ca -0.02 -0.13 0.07 0.00 0.00 0.00 0.00 53.44 53.36 3dft n ALA 352 Cb 0.29 -1.48 -0.11 0.00 0.00 0.00 0.00 19.45 18.15 3dft n ALA 352 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3dft n SER 353 N -1.33 1.57 -4.75 0.00 2.88 -0.52 -0.94 113.62 110.54 3dft n SER 353 Ca 0.13 -0.12 -0.41 0.00 -1.33 0.00 0.00 58.87 57.14 3dft n SER 353 Cb 0.26 1.56 -0.03 0.00 -0.75 0.00 0.00 64.21 65.25 3dft n SER 353 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 3dft s GLU 354 N -2.90 4.33 0.15 -1.46 2.02 -0.93 -4.82 118.70 115.10 3dft s GLU 354 Ca -0.04 2.19 -0.31 0.00 0.02 0.00 0.00 54.97 56.83 3dft s GLU 354 Cb 0.09 -3.13 -0.10 0.00 0.10 0.00 0.00 34.13 31.09 3dft s GLU 354 CO 0.59 -0.30 1.55 0.45 0.02 0.00 0.00 175.26 177.57 3dft s SER 355 N 0.16 6.62 -0.25 -0.19 0.15 -1.26 -4.28 113.70 114.65 3dft s SER 355 Ca 0.56 2.57 0.13 0.00 0.70 0.00 0.00 55.95 59.91 3dft s SER 355 Cb -0.39 -2.59 0.81 0.00 -1.71 0.00 0.00 66.02 62.14 3dft s SER 355 CO 0.43 -0.81 1.75 0.18 1.20 0.00 0.00 173.24 176.00 3dft n LEU 356 N 4.12 5.79 -4.74 3.45 4.77 -0.33 -4.94 117.00 125.12 3dft n LEU 356 Ca 0.14 -2.95 -0.41 0.00 -0.03 0.00 0.00 56.01 52.76 3dft n LEU 356 Cb 0.39 -0.70 -0.04 0.00 -2.33 0.00 0.00 43.42 40.75 3dft n LEU 356 CO 0.61 0.65 0.87 0.12 -1.33 0.00 0.00 177.39 178.31 3dft s PHE 357 N -2.79 3.46 -0.12 -1.77 2.19 -0.63 -4.59 117.98 113.73 3dft s PHE 357 Ca 0.54 1.46 -0.01 0.00 0.33 0.00 0.00 56.93 59.25 3dft s PHE 357 Cb 0.42 -3.40 0.03 0.00 -1.31 0.00 0.00 43.02 38.76 3dft s PHE 357 CO 0.15 -1.09 -0.03 0.42 1.83 0.00 0.00 175.22 176.51 3dft s ILE 358 N -0.09 0.76 0.40 3.12 1.01 -1.26 -5.05 121.20 120.09 3dft s ILE 358 Ca 0.52 -0.26 -0.26 0.00 0.00 0.00 0.00 60.65 60.65 3dft s ILE 358 Cb -0.32 -0.93 -0.10 0.00 0.01 0.00 0.00 42.46 41.12 3dft s ILE 358 CO 0.36 0.21 1.21 -0.24 0.00 0.00 0.00 174.94 176.48 3dft n SER 359 N 5.01 2.29 -0.70 3.58 2.88 -1.26 -5.06 113.62 120.36 3dft n SER 359 Ca -0.10 1.11 0.13 0.00 -1.33 0.00 0.00 58.87 58.68 3dft n SER 359 Cb 0.49 -1.46 0.33 0.00 -0.75 0.00 0.00 64.21 62.82 3dft n SER 359 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61