#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 2.20 -0.08 6.00 3.76 -1.26 -5.12 115.29 120.79 3dft s HIS 2 Ca 0.00 -0.90 -0.29 0.00 -0.15 0.00 0.00 55.06 53.72 3dft s HIS 2 Cb 0.00 -1.51 -0.02 0.00 1.11 0.00 0.00 32.58 32.16 3dft s HIS 2 CO 0.00 -0.39 0.95 0.45 -0.85 0.00 0.00 174.74 174.91 3dft s SER 3 N 0.49 7.22 -0.55 1.40 0.15 -1.26 -4.98 113.70 116.17 3dft s SER 3 Ca -0.17 1.49 0.06 0.00 0.70 0.00 0.00 55.95 58.04 3dft s SER 3 Cb -0.17 -2.54 0.23 0.00 -1.71 0.00 0.00 66.02 61.83 3dft s SER 3 CO 0.07 -0.37 0.60 1.41 1.20 0.00 0.00 173.24 176.15 3dft n HIS 4 N 4.66 1.91 0.00 3.44 8.25 -1.26 -5.07 115.22 127.15 3dft n HIS 4 Ca 0.07 -3.91 0.00 0.00 -0.26 0.00 0.00 57.72 53.61 3dft n HIS 4 Cb 0.49 -0.42 0.00 0.00 1.12 0.00 0.00 29.99 31.18 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 1.37 0.00 0.07 -0.41 -0.02 -1.26 -4.82 135.00 129.94 3dft n PRO 5 Ca 0.26 0.00 -0.12 0.00 -2.02 0.00 0.00 63.50 61.62 3dft n PRO 5 Cb 0.45 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 33.89 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 0.00 0.41 -3.38 3.55 0.00 -1.98 -3.45 119.26 114.42 3dft h ALA 6 Ca 0.00 -0.72 -0.47 0.00 0.00 0.00 0.00 54.91 53.73 3dft h ALA 6 Cb 0.00 -0.04 -0.21 0.00 0.00 0.00 0.00 17.79 17.54 3dft h ALA 6 CO 0.00 0.85 -0.79 -0.51 0.00 0.00 0.00 179.25 178.80 3dft s LEU 7 N -7.61 2.32 0.51 0.00 1.43 -1.26 -4.97 118.68 109.09 3dft s LEU 7 Ca -0.05 -0.69 0.00 0.00 -1.03 0.00 0.00 54.13 52.37 3dft s LEU 7 Cb 0.09 -0.66 0.01 0.00 0.03 0.00 0.00 46.19 45.67 3dft s LEU 7 CO 0.85 -0.04 0.74 0.42 0.23 0.00 0.00 176.35 178.55 3dft s THR 8 N -1.44 3.38 0.25 5.49 -4.23 -1.26 -4.91 115.64 112.92 3dft s THR 8 Ca 0.04 -0.53 -0.04 0.00 -1.18 0.00 0.00 61.69 59.97 3dft s THR 8 Cb -0.09 -3.27 0.22 0.00 1.34 0.00 0.00 72.50 70.71 3dft s THR 8 CO 0.03 -0.19 1.83 -0.65 -0.54 0.00 0.00 174.62 175.10 3dft h PRO 9 N 0.20 0.85 -0.17 3.99 0.11 -2.01 -0.82 132.00 134.15 3dft h PRO 9 Ca -0.44 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 3dft h PRO 9 Cb 1.27 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 3dft h PRO 9 CO 0.55 0.57 0.09 0.93 -0.21 0.00 0.00 178.00 179.93 3dft h GLU 10 N 0.88 0.24 -0.94 1.05 3.07 -1.99 -0.61 114.58 116.29 3dft h GLU 10 Ca 0.40 -0.03 -0.00 0.00 -0.50 0.00 0.00 59.36 59.22 3dft h GLU 10 Cb 0.29 -0.05 -0.05 0.00 -0.84 0.00 0.00 28.75 28.11 3dft h GLU 10 CO -0.22 0.25 0.58 1.96 -1.40 0.00 0.00 179.01 180.19 3dft h GLN 11 N 0.17 1.27 -0.24 2.33 4.20 -1.80 -1.64 115.11 119.39 3dft h GLN 11 Ca 0.06 -0.10 -0.02 0.00 0.06 0.00 0.00 58.65 58.65 3dft h GLN 11 Cb 0.08 -0.27 -0.01 0.00 0.30 0.00 0.00 27.48 27.58 3dft h GLN 11 CO -0.01 0.87 0.09 0.87 -0.67 0.00 0.00 178.83 179.98 3dft h LYS 12 N 1.29 0.37 -0.66 1.46 1.57 -0.82 -2.07 116.57 117.70 3dft h LYS 12 Ca 0.34 -0.07 0.04 0.00 -1.87 0.00 0.00 60.65 59.09 3dft h LYS 12 Cb -0.08 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.13 3dft h LYS 12 CO -0.07 0.42 0.39 -0.22 -0.57 0.00 0.00 179.45 179.41 3dft h LYS 13 N 0.23 0.73 0.13 3.15 3.64 -0.77 0.94 116.57 124.61 3dft h LYS 13 Ca 0.08 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 3dft h LYS 13 Cb 0.20 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 3dft h LYS 13 CO -0.01 0.48 -0.11 1.49 -2.27 0.00 0.00 179.45 179.04 3dft h GLU 14 N 0.75 -0.24 -0.52 1.90 4.81 -1.10 0.34 114.58 120.51 3dft h GLU 14 Ca 0.28 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.50 3dft h GLU 14 Cb 0.09 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.50 3dft h GLU 14 CO -0.14 -0.16 0.25 -0.07 -0.73 0.00 0.00 179.01 178.16 3dft h LEU 15 N -0.25 0.69 -0.73 1.64 3.38 -1.03 -1.77 115.31 117.24 3dft h LEU 15 Ca -0.00 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 3dft h LEU 15 Cb 0.23 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 3dft h LEU 15 CO -0.01 0.62 0.37 -1.28 0.09 0.00 0.00 178.44 178.23 3dft h SER 16 N 0.70 0.94 -0.65 -0.43 0.87 -0.67 -1.09 113.55 113.22 3dft h SER 16 Ca 0.18 -0.12 -0.08 0.00 -1.23 0.00 0.00 61.79 60.54 3dft h SER 16 Cb 0.12 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 61.81 3dft h SER 16 CO -0.02 0.79 0.09 0.44 -0.53 0.00 0.00 176.83 177.59 3dft h ASP 17 N 1.01 1.05 0.01 6.23 3.32 -0.70 -1.81 116.42 125.53 3dft h ASP 17 Ca 0.25 -0.26 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 3dft h ASP 17 Cb 0.09 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.36 3dft h ASP 17 CO -0.04 1.05 -0.00 0.40 -1.72 0.00 0.00 179.24 178.93 3dft h ILE 18 N 1.02 1.18 -0.61 0.35 2.04 -1.06 -2.00 117.51 118.42 3dft h ILE 18 Ca 0.20 -0.56 0.08 0.00 1.00 0.00 0.00 64.86 65.57 3dft h ILE 18 Cb 0.46 1.56 -0.06 0.00 -0.74 0.00 0.00 36.82 38.04 3dft h ILE 18 CO 0.02 0.14 0.28 0.00 0.00 0.00 0.00 178.15 178.59 3dft h ALA 19 N 0.75 0.81 -0.48 1.87 0.00 -1.12 -2.18 119.26 118.91 3dft h ALA 19 Ca -0.00 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 3dft h ALA 19 Cb 0.24 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3dft h ALA 19 CO 0.00 -0.11 -0.02 0.45 0.00 0.00 0.00 179.25 179.57 3dft h HIS 20 N 0.51 0.87 -0.61 0.00 3.86 -1.27 -2.98 115.15 115.54 3dft h HIS 20 Ca 0.30 -0.13 -0.06 0.00 -1.16 0.00 0.00 60.37 59.31 3dft h HIS 20 Cb 0.29 -0.23 -0.03 0.00 1.06 0.00 0.00 27.41 28.50 3dft h HIS 20 CO -0.13 0.81 0.14 0.00 0.86 0.00 0.00 177.93 179.61 3dft h ARG 21 N 0.75 0.96 -0.71 2.45 3.08 -0.75 -2.15 114.38 118.02 3dft h ARG 21 Ca 0.14 -0.22 -0.04 0.00 0.07 0.00 0.00 59.98 59.93 3dft h ARG 21 Cb 0.49 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.37 3dft h ARG 21 CO 0.02 0.86 0.27 0.82 -1.07 0.00 0.00 179.97 180.87 3dft h ILE 22 N 0.91 1.25 -0.65 2.04 2.04 -1.30 -3.08 117.51 118.72 3dft h ILE 22 Ca 0.19 -0.80 -0.27 0.00 1.00 0.00 0.00 64.86 64.98 3dft h ILE 22 Cb 0.34 0.44 -0.16 0.00 -0.74 0.00 0.00 36.82 36.70 3dft h ILE 22 CO 0.00 0.32 0.25 1.33 0.00 0.00 0.00 178.15 180.06 3dft n VAL 23 N -4.35 2.84 -1.48 1.67 0.24 -1.15 -4.21 118.33 111.89 3dft n VAL 23 Ca 0.06 -2.08 -0.36 0.00 -2.04 0.00 0.00 64.34 59.92 3dft n VAL 23 Cb 0.19 -0.37 0.08 0.00 -1.47 0.00 0.00 33.84 32.26 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 -0.78 0.04 -1.58 2.33 0.00 -0.82 -4.74 120.51 114.96 3dft n ALA 24 Ca 0.42 -0.11 -0.60 0.00 0.00 0.00 0.00 53.44 53.15 3dft n ALA 24 Cb 1.32 -2.14 -0.08 0.00 0.00 0.00 0.00 19.45 18.55 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 0.29 -0.36 0.00 -0.02 -1.26 -0.44 135.00 131.58 3dft n PRO 25 Ca 0.14 0.10 0.00 0.00 -2.02 0.00 0.00 63.50 61.72 3dft n PRO 25 Cb 0.49 -1.64 0.00 0.00 -0.02 0.00 0.00 33.50 32.32 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 2.39 2.17 3.83 -1.23 0.00 -1.26 -5.02 105.19 106.07 3dft n GLY 26 Ca 0.22 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.04 3.08 0.00 1.61 1.02 0.42 -4.46 119.74 121.37 3dft s LYS 27 Ca 0.00 -0.63 0.00 0.00 0.02 0.00 0.00 55.97 55.36 3dft s LYS 27 Cb 0.00 -2.83 0.00 0.00 -0.52 0.00 0.00 37.83 34.48 3dft s LYS 27 CO 0.00 0.57 0.00 0.41 -0.92 0.00 0.00 175.35 175.41 3dft n GLY 28 N 0.25 4.33 3.25 -3.33 0.00 -0.26 -4.60 105.19 104.83 3dft n GLY 28 Ca -0.07 -1.55 -0.30 0.00 0.00 0.00 0.00 46.02 44.10 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 -1.72 1.92 -0.40 -0.61 1.01 0.15 -0.03 121.20 121.53 3dft s ILE 29 Ca 0.00 -1.01 -0.17 0.00 0.00 0.00 0.00 60.65 59.47 3dft s ILE 29 Cb 0.00 -1.61 0.01 0.00 0.01 0.00 0.00 42.46 40.87 3dft s ILE 29 CO 0.00 0.54 0.45 -0.22 0.00 0.00 0.00 174.94 175.71 3dft s LEU 30 N -0.28 4.67 -0.75 2.97 2.96 -0.65 -2.02 118.68 125.59 3dft s LEU 30 Ca 0.01 -0.46 -0.22 0.00 -0.22 0.00 0.00 54.13 53.23 3dft s LEU 30 Cb -0.12 -2.44 0.08 0.00 0.50 0.00 0.00 46.19 44.21 3dft s LEU 30 CO 0.02 -0.54 1.06 0.00 -1.32 0.00 0.00 176.35 175.57 3dft s ALA 31 N 2.21 3.10 -0.21 5.97 0.00 0.46 -1.33 121.76 131.97 3dft s ALA 31 Ca 0.14 -2.01 0.11 0.00 0.00 0.00 0.00 51.96 50.20 3dft s ALA 31 Cb -0.16 -3.98 0.43 0.00 0.00 0.00 0.00 23.12 19.40 3dft s ALA 31 CO 0.14 -2.92 1.21 0.00 0.00 0.00 0.00 175.76 174.18 3dft n ALA 32 N 7.71 3.80 -1.07 0.00 0.00 -0.69 -4.24 120.51 126.03 3dft n ALA 32 Ca 0.05 -3.33 -0.26 0.00 0.00 0.00 0.00 53.44 49.91 3dft n ALA 32 Cb 0.47 -0.38 0.09 0.00 0.00 0.00 0.00 19.45 19.63 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 -0.95 6.21 -4.76 0.00 3.41 -0.92 -4.17 113.62 112.44 3dft n SER 33 Ca 0.22 -3.46 -0.40 0.00 -0.26 0.00 0.00 58.87 54.97 3dft n SER 33 Cb 0.77 -0.94 -0.03 0.00 -0.26 0.00 0.00 64.21 63.74 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 -2.98 4.45 0.78 4.33 8.01 -1.26 -4.50 118.70 127.53 3dft s GLU 34 Ca 0.51 1.89 -0.08 0.00 0.01 0.00 0.00 54.97 57.29 3dft s GLU 34 Cb 0.41 -3.04 0.11 0.00 -4.31 0.00 0.00 34.13 27.30 3dft s GLU 34 CO 0.02 0.01 1.10 -1.54 0.01 0.00 0.00 175.26 174.86 3dft s SER 35 N -0.87 4.26 0.33 -0.19 1.04 -1.26 -4.77 113.70 112.23 3dft s SER 35 Ca 0.48 0.26 0.03 0.00 0.48 0.00 0.00 55.95 57.20 3dft s SER 35 Cb -0.33 -0.69 0.61 0.00 0.10 0.00 0.00 66.02 65.72 3dft s SER 35 CO 0.43 -1.96 1.94 0.74 0.98 0.00 0.00 173.24 175.37 3dft h THR 36 N -0.88 1.07 -0.27 2.02 2.02 -1.97 0.14 112.91 115.05 3dft h THR 36 Ca -0.43 -0.31 -0.18 0.00 0.77 0.00 0.00 66.41 66.26 3dft h THR 36 Cb 1.29 0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 67.77 3dft h THR 36 CO 0.51 0.17 -0.53 1.23 0.37 0.00 0.00 175.52 177.26 3dft h GLY 37 N 0.92 0.86 1.76 2.16 0.00 -2.00 -2.27 103.07 104.48 3dft h GLY 37 Ca 0.34 -0.99 -0.01 0.00 0.00 0.00 0.00 47.33 46.67 3dft h GLY 37 CO -0.11 0.89 -0.29 1.48 0.00 0.00 0.00 176.54 178.51 3dft h SER 38 N 0.61 0.00 1.03 0.19 4.64 -1.76 -3.23 113.55 115.03 3dft h SER 38 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 3dft h SER 38 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 3dft h SER 38 CO 0.11 0.05 -0.81 -0.29 -0.87 0.00 0.00 176.83 175.02 3dft h ILE 39 N 0.00 0.00 -0.24 0.95 6.09 -0.75 -3.39 117.51 120.17 3dft h ILE 39 Ca -0.00 -0.85 0.06 0.00 -1.37 0.00 0.00 64.86 62.70 3dft h ILE 39 Cb 1.04 1.41 -0.07 0.00 0.47 0.00 0.00 36.82 39.66 3dft h ILE 39 CO 0.01 0.00 -0.30 0.00 -3.07 0.00 0.00 178.15 174.78 3dft h ALA 40 N 2.15 -0.26 -0.13 0.18 0.00 -1.43 -2.33 119.26 117.45 3dft h ALA 40 Ca 0.00 0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.02 3dft h ALA 40 Cb 0.92 0.62 -0.06 0.00 0.00 0.00 0.00 17.79 19.27 3dft h ALA 40 CO 0.00 -0.75 -0.25 -0.22 0.00 0.00 0.00 179.25 178.03 3dft h LYS 41 N -0.32 -0.31 -0.60 0.00 3.64 -1.77 -0.67 116.57 116.54 3dft h LYS 41 Ca 0.13 0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.55 3dft h LYS 41 Cb 0.52 0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.38 3dft h LYS 41 CO -0.42 -0.21 0.40 0.07 -2.27 0.00 0.00 179.45 177.02 3dft h ARG 42 N -0.32 0.71 -0.05 1.90 0.11 -1.77 -0.07 114.38 114.89 3dft h ARG 42 Ca 0.10 -0.04 -0.16 0.00 0.10 0.00 0.00 59.98 59.98 3dft h ARG 42 Cb 0.47 -0.16 -0.01 0.00 1.11 0.00 0.00 29.97 31.38 3dft h ARG 42 CO -0.31 0.47 -0.67 -0.07 0.10 0.00 0.00 179.97 179.50 3dft h LEU 43 N 0.74 0.28 -0.73 0.08 3.38 -0.95 -2.95 115.31 115.16 3dft h LEU 43 Ca 0.23 -0.17 -0.08 0.00 0.09 0.00 0.00 57.88 57.95 3dft h LEU 43 Cb 0.03 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 3dft h LEU 43 CO -0.06 0.86 0.04 -0.61 0.09 0.00 0.00 178.44 178.76 3dft h GLN 44 N 0.17 1.02 0.00 1.13 5.75 0.14 -0.60 115.11 122.72 3dft h GLN 44 Ca -0.01 -0.29 -0.01 0.00 -0.15 0.00 0.00 58.65 58.18 3dft h GLN 44 Cb 1.20 -0.11 -0.00 0.00 1.07 0.00 0.00 27.48 29.64 3dft h GLN 44 CO 0.10 0.97 -0.06 0.66 -2.65 0.00 0.00 178.83 177.86 3dft h SER 45 N 0.94 0.00 -0.40 -0.69 4.64 -0.89 -1.51 113.55 115.65 3dft h SER 45 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 3dft h SER 45 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 3dft h SER 45 CO 0.02 0.06 0.00 2.30 -0.87 0.00 0.00 176.83 178.34 3dft n ILE 46 N -3.99 1.90 -3.43 0.95 -5.35 -1.00 -4.99 119.36 103.45 3dft n ILE 46 Ca -0.03 -1.46 -0.19 0.00 -0.27 0.00 0.00 62.75 60.80 3dft n ILE 46 Cb 0.14 0.02 0.04 0.00 -1.74 0.00 0.00 39.64 38.10 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 0.21 -1.13 2.85 3.28 0.00 -0.57 -4.67 105.19 105.16 3dft n GLY 47 Ca 0.20 0.51 -0.19 0.00 0.00 0.00 0.00 46.02 46.55 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 -3.30 0.38 0.17 2.61 2.01 -0.28 -4.94 115.64 112.29 3dft s THR 48 Ca 0.32 -0.02 -0.32 0.00 0.31 0.00 0.00 61.69 61.99 3dft s THR 48 Cb -0.09 -0.44 -0.11 0.00 0.01 0.00 0.00 72.50 71.87 3dft s THR 48 CO 0.81 0.20 1.73 -0.70 -0.69 0.00 0.00 174.62 175.96 3dft s GLU 49 N 1.06 4.14 -1.26 4.92 2.12 -1.26 -4.33 118.70 124.09 3dft s GLU 49 Ca -0.09 2.56 -0.19 0.00 0.36 0.00 0.00 54.97 57.61 3dft s GLU 49 Cb -0.14 -3.25 0.01 0.00 0.26 0.00 0.00 34.13 31.02 3dft s GLU 49 CO -0.01 -0.76 1.84 -1.71 -0.54 0.00 0.00 175.26 174.08 3dft n ASN 50 N 4.51 4.22 -4.62 -1.70 5.15 -1.26 -4.76 115.26 116.80 3dft n ASN 50 Ca 0.16 -2.84 -0.24 0.00 -0.60 0.00 0.00 54.58 51.06 3dft n ASN 50 Cb 0.37 -1.72 -0.08 0.00 -0.53 0.00 0.00 39.78 37.82 3dft n ASN 50 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 3dft s THR 51 N 6.25 3.37 0.49 -0.44 -4.23 -1.26 -5.02 115.64 114.80 3dft s THR 51 Ca 0.58 -1.84 0.14 0.00 -1.18 0.00 0.00 61.69 59.39 3dft s THR 51 Cb 0.04 -2.76 0.26 0.00 1.34 0.00 0.00 72.50 71.37 3dft s THR 51 CO 0.09 -0.30 2.11 -0.08 -0.54 0.00 0.00 174.62 175.90 3dft h GLU 52 N 2.20 0.14 0.01 3.99 4.81 -1.99 -1.57 114.58 122.17 3dft h GLU 52 Ca -0.45 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 58.77 3dft h GLU 52 Cb 1.24 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.59 3dft h GLU 52 CO 0.59 0.11 -0.01 1.49 -0.73 0.00 0.00 179.01 180.46 3dft h GLU 53 N 0.14 -0.02 -0.77 1.92 4.22 -1.95 0.96 114.58 119.08 3dft h GLU 53 Ca 0.04 0.00 -0.04 0.00 0.08 0.00 0.00 59.36 59.44 3dft h GLU 53 Cb 0.02 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 3dft h GLU 53 CO -0.01 0.28 0.31 -0.91 -2.18 0.00 0.00 179.01 176.51 3dft h ASN 54 N -0.32 1.05 -0.55 1.04 2.35 -1.77 0.17 115.58 117.55 3dft h ASN 54 Ca -0.00 -0.15 -0.04 0.00 -0.55 0.00 0.00 56.30 55.55 3dft h ASN 54 Cb 0.31 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.38 3dft h ASN 54 CO 0.00 0.92 0.17 0.03 -1.65 0.00 0.00 177.43 176.91 3dft h ARG 55 N 1.11 0.85 -0.53 0.81 3.08 -1.20 0.23 114.38 118.72 3dft h ARG 55 Ca 0.26 -0.18 -0.04 0.00 0.07 0.00 0.00 59.98 60.08 3dft h ARG 55 Cb 0.20 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.10 3dft h ARG 55 CO -0.02 0.77 0.16 -0.09 -1.07 0.00 0.00 179.97 179.72 3dft h ARG 56 N 0.76 0.83 -0.47 0.04 2.43 -0.28 -0.28 114.38 117.42 3dft h ARG 56 Ca 0.18 -0.18 -0.05 0.00 -0.81 0.00 0.00 59.98 59.11 3dft h ARG 56 Cb 0.28 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.69 3dft h ARG 56 CO -0.01 0.77 0.09 0.35 -1.51 0.00 0.00 179.97 179.67 3dft h PHE 57 N 0.74 0.81 0.07 2.20 3.57 -0.36 0.29 116.94 124.26 3dft h PHE 57 Ca 0.17 -0.11 -0.00 0.00 3.53 0.00 0.00 57.97 61.56 3dft h PHE 57 Cb 0.29 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 38.80 3dft h PHE 57 CO 0.02 0.75 -0.03 -0.92 -2.23 0.00 0.00 178.31 175.89 3dft h TYR 58 N 0.65 -0.09 -0.82 0.41 3.20 -0.32 0.11 116.97 120.11 3dft h TYR 58 Ca 0.15 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.01 3dft h TYR 58 Cb 0.36 0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.62 3dft h TYR 58 CO 0.02 0.01 0.49 0.00 -1.64 0.00 0.00 178.16 177.05 3dft h ARG 59 N -0.17 1.12 -0.73 1.82 -0.00 -0.94 -1.91 114.38 113.56 3dft h ARG 59 Ca -0.01 -0.10 0.03 0.00 -0.50 0.00 0.00 59.98 59.40 3dft h ARG 59 Cb 0.14 -0.23 -0.05 0.00 0.00 0.00 0.00 29.97 29.83 3dft h ARG 59 CO 0.02 0.79 0.46 0.37 0.00 0.00 0.00 179.97 181.60 3dft h GLN 60 N 1.13 0.87 -0.95 0.04 4.15 -0.06 0.07 115.11 120.36 3dft h GLN 60 Ca 0.29 -0.05 0.08 0.00 0.77 0.00 0.00 58.65 59.75 3dft h GLN 60 Cb -0.04 -0.20 -0.07 0.00 0.21 0.00 0.00 27.48 27.38 3dft h GLN 60 CO -0.05 0.58 0.59 1.25 -1.93 0.00 0.00 178.83 179.26 3dft h LEU 61 N 0.90 0.91 0.00 -2.39 6.46 -0.01 -0.05 115.31 121.14 3dft h LEU 61 Ca 0.30 0.03 -0.12 0.00 -0.12 0.00 0.00 57.88 57.97 3dft h LEU 61 Cb 0.02 -0.16 0.01 0.00 -0.73 0.00 0.00 40.66 39.80 3dft h LEU 61 CO -0.11 0.55 -0.45 -0.07 -0.62 0.00 0.00 178.44 177.73 3dft h LEU 62 N 1.03 0.40 -1.46 2.25 3.38 -0.91 -3.28 115.31 116.72 3dft h LEU 62 Ca 0.43 -0.77 -0.05 0.00 0.09 0.00 0.00 57.88 57.58 3dft h LEU 62 Cb 0.28 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 3dft h LEU 62 CO -0.21 1.12 -0.22 -0.07 0.09 0.00 0.00 178.44 179.15 3dft h LEU 63 N -0.28 0.00 -3.18 1.67 3.38 -0.75 -3.01 115.31 113.14 3dft h LEU 63 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 3dft h LEU 63 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 3dft h LEU 63 CO 0.09 0.22 0.00 0.35 0.09 0.00 0.00 178.44 179.19 3dft n THR 64 N -3.61 2.08 -1.58 0.22 -2.24 -0.05 -4.77 114.28 104.32 3dft n THR 64 Ca -0.01 -1.21 -0.37 0.00 -2.27 0.00 0.00 64.05 60.19 3dft n THR 64 Cb 0.35 -0.03 0.07 0.00 -2.10 0.00 0.00 70.33 68.62 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 0.94 0.33 -0.70 6.98 0.00 -1.14 -4.91 120.51 122.02 3dft n ALA 65 Ca 0.26 -0.05 -0.32 0.00 0.00 0.00 0.00 53.44 53.33 3dft n ALA 65 Cb 0.97 -2.17 0.16 0.00 0.00 0.00 0.00 19.45 18.41 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 -1.33 -1.26 0.00 0.00 5.68 -1.26 -4.81 116.55 113.57 3dft n ASP 66 Ca 0.14 0.24 0.00 0.00 -0.50 0.00 0.00 54.79 54.68 3dft n ASP 66 Cb 0.48 -1.28 0.00 0.00 -1.14 0.00 0.00 41.12 39.19 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 -2.82 0.00 0.24 -1.12 10.43 -1.26 -2.49 116.55 119.53 3dft n ASP 67 Ca 0.07 0.25 0.09 0.00 2.57 0.00 0.00 54.79 57.77 3dft n ASP 67 Cb 0.54 -0.25 0.58 0.00 1.84 0.00 0.00 41.12 43.84 3dft n ASP 67 CO 0.00 0.00 0.00 0.03 -1.07 0.00 0.00 177.20 176.16 3dft h ARG 68 N 0.00 0.00 0.00 -1.24 3.08 -2.00 -2.63 114.38 111.59 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 0.37 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.42 3dft h ARG 68 CO 0.00 0.20 0.00 -0.39 -1.07 0.00 0.00 179.97 178.71 3dft h VAL 69 N 0.00 0.00 -0.58 2.04 -1.51 -1.81 -3.37 116.25 111.02 3dft h VAL 69 Ca -0.00 -0.85 0.12 0.00 -1.23 0.00 0.00 66.70 64.74 3dft h VAL 69 Cb 0.47 1.84 -0.11 0.00 -2.13 0.00 0.00 31.29 31.36 3dft h VAL 69 CO 0.03 0.00 -0.18 0.78 -1.23 0.00 0.00 177.57 176.97 3dft h ASN 70 N 0.00 -0.65 0.28 4.19 4.21 -1.69 0.26 115.58 122.18 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 0.91 0.40 0.00 0.00 -1.12 0.00 0.00 38.32 38.51 3dft h ASN 70 CO 0.00 -0.22 0.00 -0.81 -1.29 0.00 0.00 177.43 175.11 3dft n PRO 71 N -5.42 0.60 -0.09 0.81 -0.04 -1.26 -3.37 135.00 126.24 3dft n PRO 71 Ca 0.06 0.02 -0.10 0.00 -0.04 0.00 0.00 63.50 63.44 3dft n PRO 71 Cb 0.32 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.12 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 -2.51 4.27 -0.15 0.00 -1.09 -0.09 -1.11 121.20 120.52 3dft s ILE 73 Ca -0.10 -0.75 0.21 0.00 -2.23 0.00 0.00 60.65 57.79 3dft s ILE 73 Cb 0.06 -3.28 -0.14 0.00 -1.58 0.00 0.00 42.46 37.52 3dft s ILE 73 CO 0.82 -0.06 0.78 0.61 -1.23 0.00 0.00 174.94 175.87 3dft n GLY 74 N 4.92 -1.25 3.37 6.18 0.00 0.96 -4.42 105.19 114.96 3dft n GLY 74 Ca -0.13 -0.32 -0.13 0.00 0.00 0.00 0.00 46.02 45.44 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 -4.53 -0.40 -0.06 -0.02 0.00 -1.04 -0.94 107.32 100.34 3dft s GLY 75 Ca -0.04 0.42 -0.01 0.00 0.00 0.00 0.00 44.72 45.09 3dft s GLY 75 CO 0.83 0.13 0.02 0.14 0.00 0.00 0.00 173.10 174.22 3dft s VAL 76 N -2.86 0.20 -0.20 1.40 1.01 -0.04 -1.63 120.40 118.27 3dft s VAL 76 Ca -0.03 0.23 -0.20 0.00 0.00 0.00 0.00 61.98 61.98 3dft s VAL 76 Cb -0.00 -0.39 -0.03 0.00 0.00 0.00 0.00 36.38 35.96 3dft s VAL 76 CO -0.05 0.23 0.59 -0.63 0.00 0.00 0.00 175.10 175.23 3dft s ILE 77 N 1.99 5.05 0.20 2.22 1.01 -0.44 -0.62 121.20 130.62 3dft s ILE 77 Ca 0.04 1.09 0.08 0.00 0.00 0.00 0.00 60.65 61.87 3dft s ILE 77 Cb -0.12 -3.90 -0.04 0.00 0.01 0.00 0.00 42.46 38.40 3dft s ILE 77 CO -0.04 0.13 -0.03 -0.76 0.00 0.00 0.00 174.94 174.24 3dft s LEU 78 N 1.82 3.16 0.41 2.97 1.43 -0.38 -1.71 118.68 126.39 3dft s LEU 78 Ca 0.27 -0.52 -0.08 0.00 -1.03 0.00 0.00 54.13 52.77 3dft s LEU 78 Cb -0.16 -1.79 -0.05 0.00 0.03 0.00 0.00 46.19 44.22 3dft s LEU 78 CO 0.10 0.07 0.73 0.12 0.23 0.00 0.00 176.35 177.60 3dft s PHE 79 N -1.87 3.50 0.18 0.29 5.36 -1.26 -2.09 117.98 122.09 3dft s PHE 79 Ca 0.28 0.89 -0.23 0.00 -0.96 0.00 0.00 56.93 56.90 3dft s PHE 79 Cb -0.08 -2.33 0.09 0.00 -0.34 0.00 0.00 43.02 40.36 3dft s PHE 79 CO 0.18 -0.10 1.57 1.25 -1.46 0.00 0.00 175.22 176.65 3dft h HIS 80 N 1.01 -1.19 -0.44 10.12 6.17 -1.92 -1.91 115.15 126.97 3dft h HIS 80 Ca -0.47 0.09 0.09 0.00 0.71 0.00 0.00 60.37 60.78 3dft h HIS 80 Cb 1.19 0.62 -0.10 0.00 2.52 0.00 0.00 27.41 31.65 3dft h HIS 80 CO 0.59 -0.41 -0.30 1.49 0.71 0.00 0.00 177.93 180.01 3dft h GLU 81 N -0.15 -0.20 -0.28 5.26 4.81 -1.98 -1.96 114.58 120.08 3dft h GLU 81 Ca 0.22 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.46 3dft h GLU 81 Cb 0.56 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 3dft h GLU 81 CO -0.76 -0.13 0.13 1.15 -0.73 0.00 0.00 179.01 178.67 3dft h THR 82 N -0.21 1.10 0.00 0.32 2.02 -1.75 -2.31 112.91 112.07 3dft h THR 82 Ca 0.19 -0.29 -0.00 0.00 0.77 0.00 0.00 66.41 67.08 3dft h THR 82 Cb 0.52 0.75 -0.00 0.00 -1.74 0.00 0.00 68.15 67.68 3dft h THR 82 CO -0.56 0.11 -0.02 0.25 0.37 0.00 0.00 175.52 175.67 3dft h LEU 83 N 0.39 0.00 -2.94 2.58 5.85 -0.81 -2.26 115.31 118.12 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 0.05 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.08 3dft h LEU 83 CO -0.01 0.02 0.00 -1.22 -0.34 0.00 0.00 178.44 176.89 3dft n TYR 84 N -3.84 0.71 -2.88 1.25 4.01 -0.88 -4.55 117.16 110.98 3dft n TYR 84 Ca -0.03 -0.56 -0.22 0.00 -0.16 0.00 0.00 57.90 56.94 3dft n TYR 84 Cb 0.11 -0.08 0.02 0.00 -0.31 0.00 0.00 39.34 39.08 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 -1.32 2.85 0.13 -0.72 -0.21 -0.85 -4.98 119.66 114.56 3dft s GLN 85 Ca 0.32 -0.69 0.06 0.00 0.02 0.00 0.00 55.36 55.08 3dft s GLN 85 Cb 0.19 -2.56 -0.04 0.00 1.00 0.00 0.00 33.01 31.60 3dft s GLN 85 CO 0.18 -0.42 -0.13 0.15 -2.12 0.00 0.00 175.29 172.95 3dft s LYS 86 N -4.60 1.05 0.96 2.91 1.02 -1.26 -1.62 119.74 118.20 3dft s LYS 86 Ca 0.52 -1.30 -0.14 0.00 0.02 0.00 0.00 55.97 55.07 3dft s LYS 86 Cb -0.10 -0.87 0.17 0.00 -0.52 0.00 0.00 37.83 36.50 3dft s LYS 86 CO 0.37 0.16 1.15 0.00 -0.92 0.00 0.00 175.35 176.11 3dft s ALA 87 N -2.40 1.62 0.36 5.17 0.00 0.08 -4.88 121.76 121.71 3dft s ALA 87 Ca 0.11 -0.64 0.05 0.00 0.00 0.00 0.00 51.96 51.47 3dft s ALA 87 Cb -0.03 -2.99 0.71 0.00 0.00 0.00 0.00 23.12 20.80 3dft s ALA 87 CO 0.03 -2.51 1.98 -0.44 0.00 0.00 0.00 175.76 174.82 3dft h ASP 88 N -1.68 0.69 0.00 0.00 3.32 -1.99 -0.83 116.42 115.93 3dft h ASP 88 Ca -0.49 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.55 3dft h ASP 88 Cb 1.32 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.71 3dft h ASP 88 CO 0.56 0.46 0.00 -0.90 -1.72 0.00 0.00 179.24 177.64 3dft n ASP 89 N -4.47 0.00 0.00 6.45 3.85 -1.26 -4.87 116.55 116.25 3dft n ASP 89 Ca 0.09 -0.94 0.00 0.00 -0.71 0.00 0.00 54.79 53.24 3dft n ASP 89 Cb 0.17 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 39.94 3dft n ASP 89 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3dft n GLY 90 N 0.45 1.26 3.72 6.12 0.00 -0.32 -5.05 105.19 111.37 3dft n GLY 90 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.69 4.43 0.36 1.61 0.52 -1.26 -4.69 118.95 119.22 3dft s ARG 91 Ca 0.00 1.82 -0.28 0.00 -0.52 0.00 0.00 55.73 56.75 3dft s ARG 91 Cb 0.00 -3.32 -0.11 0.00 0.52 0.00 0.00 34.95 32.04 3dft s ARG 91 CO 0.00 -0.25 1.49 -2.14 0.02 0.00 0.00 175.30 174.42 3dft s PRO 92 N 0.87 4.13 0.27 3.54 0.02 -1.26 -0.74 135.00 141.83 3dft s PRO 92 Ca 0.59 2.54 0.01 0.00 0.02 0.00 0.00 61.00 64.16 3dft s PRO 92 Cb -0.31 -2.99 0.61 0.00 0.02 0.00 0.00 34.50 31.83 3dft s PRO 92 CO 0.30 -0.53 1.73 0.74 -0.33 0.00 0.00 177.00 178.92 3dft h PHE 93 N 3.40 0.68 -0.98 6.54 0.04 -1.58 0.33 116.94 125.36 3dft h PHE 93 Ca -0.50 0.04 0.11 0.00 2.80 0.00 0.00 57.97 60.42 3dft h PHE 93 Cb 1.23 -0.17 -0.08 0.00 2.20 0.00 0.00 35.95 39.13 3dft h PHE 93 CO 0.54 0.06 0.61 -1.35 -0.60 0.00 0.00 178.31 177.58 3dft h PRO 94 N 0.50 0.95 -0.60 1.51 0.11 -1.84 -0.77 132.00 131.86 3dft h PRO 94 Ca 0.50 -0.06 -0.10 0.00 0.11 0.00 0.00 66.00 66.45 3dft h PRO 94 Cb 0.83 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 31.70 3dft h PRO 94 CO -0.44 0.63 -0.01 0.37 -0.21 0.00 0.00 178.00 178.34 3dft h GLN 95 N 0.98 1.07 -0.14 1.05 4.15 -1.32 -1.47 115.11 119.43 3dft h GLN 95 Ca 0.48 -0.34 0.01 0.00 0.77 0.00 0.00 58.65 59.56 3dft h GLN 95 Cb 0.44 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 28.02 3dft h GLN 95 CO -0.25 1.05 0.05 0.28 -1.93 0.00 0.00 178.83 178.02 3dft h VAL 96 N 0.97 0.97 -0.38 2.39 2.07 -0.36 -0.46 116.25 121.46 3dft h VAL 96 Ca 0.17 -0.04 0.02 0.00 0.82 0.00 0.00 66.70 67.67 3dft h VAL 96 Cb 0.57 0.84 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 3dft h VAL 96 CO 0.03 0.02 0.21 0.40 0.02 0.00 0.00 177.57 178.25 3dft h ILE 97 N 0.12 1.01 -0.22 4.57 2.04 -1.00 -2.92 117.51 121.12 3dft h ILE 97 Ca 0.06 -0.14 -0.13 0.00 1.00 0.00 0.00 64.86 65.64 3dft h ILE 97 Cb 0.03 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 36.66 3dft h ILE 97 CO -0.06 0.08 -0.41 0.11 0.00 0.00 0.00 178.15 177.87 3dft h LYS 98 N 0.42 0.53 0.00 2.37 1.57 -1.07 -1.12 116.57 119.26 3dft h LYS 98 Ca 0.15 -0.27 -0.01 0.00 -1.87 0.00 0.00 60.65 58.66 3dft h LYS 98 Cb 0.03 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.34 3dft h LYS 98 CO -0.09 0.84 -0.04 0.66 -0.57 0.00 0.00 179.45 180.26 3dft h SER 99 N 0.43 0.00 -0.54 0.86 4.64 -0.89 0.53 113.55 118.58 3dft h SER 99 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 3dft h SER 99 Cb 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 3dft h SER 99 CO 0.08 0.04 0.00 0.29 -0.87 0.00 0.00 176.83 176.36 3dft n LYS 100 N -3.50 2.31 -0.91 4.77 5.02 -1.02 -4.91 118.16 119.92 3dft n LYS 100 Ca -0.02 -1.96 0.00 0.00 -2.02 0.00 0.00 58.31 54.31 3dft n LYS 100 Cb 0.15 -1.44 0.00 0.00 -0.02 0.00 0.00 35.03 33.71 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 1.33 0.47 3.85 0.72 0.00 0.18 -4.61 105.19 107.12 3dft n GLY 101 Ca 0.18 -0.67 -0.30 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.60 2.06 0.01 -0.02 0.00 -0.45 -4.81 107.32 101.51 3dft s GLY 102 Ca 0.00 -0.95 -0.17 0.00 0.00 0.00 0.00 44.72 43.60 3dft s GLY 102 CO 0.00 -0.93 0.47 0.14 0.00 0.00 0.00 173.10 172.78 3dft s VAL 103 N -1.47 4.95 -0.11 1.40 1.01 -0.11 -3.53 120.40 122.53 3dft s VAL 103 Ca 0.32 0.98 -0.20 0.00 0.00 0.00 0.00 61.98 63.08 3dft s VAL 103 Cb -0.12 -3.79 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 3dft s VAL 103 CO 0.25 0.54 0.54 -0.69 0.00 0.00 0.00 175.10 175.74 3dft s VAL 104 N -0.91 5.15 0.29 2.92 1.01 -1.26 -0.86 120.40 126.73 3dft s VAL 104 Ca 0.26 1.08 0.11 0.00 0.00 0.00 0.00 61.98 63.43 3dft s VAL 104 Cb -0.17 -3.88 -0.05 0.00 0.00 0.00 0.00 36.38 32.28 3dft s VAL 104 CO 0.15 0.29 -0.12 -0.83 0.00 0.00 0.00 175.10 174.60 3dft s GLY 105 N 0.71 1.86 -0.02 4.51 0.00 0.21 -0.57 107.32 114.02 3dft s GLY 105 Ca 0.29 -1.84 0.00 0.00 0.00 0.00 0.00 44.72 43.18 3dft s GLY 105 CO 0.12 -1.90 0.00 -1.50 0.00 0.00 0.00 173.10 169.83 3dft s ILE 106 N -2.46 0.10 -0.03 0.90 1.10 -0.30 -1.25 121.20 119.26 3dft s ILE 106 Ca 0.31 0.08 -0.30 0.00 -0.51 0.00 0.00 60.65 60.23 3dft s ILE 106 Cb -0.04 -0.18 -0.03 0.00 0.15 0.00 0.00 42.46 42.35 3dft s ILE 106 CO 0.17 0.10 1.13 -0.75 -2.11 0.00 0.00 174.94 173.48 3dft s LYS 107 N 0.75 4.41 0.00 3.50 2.36 -0.89 -1.59 119.74 128.28 3dft s LYS 107 Ca -0.07 1.60 0.02 0.00 -2.55 0.00 0.00 55.97 54.97 3dft s LYS 107 Cb -0.10 -3.50 -0.01 0.00 -1.05 0.00 0.00 37.83 33.18 3dft s LYS 107 CO -0.02 -0.32 0.27 1.33 1.55 0.00 0.00 175.35 178.17 3dft n VAL 108 N 4.35 0.00 -1.79 4.02 0.24 -0.31 -4.66 118.33 120.18 3dft n VAL 108 Ca 0.09 -0.46 -0.31 0.00 -2.04 0.00 0.00 64.34 61.62 3dft n VAL 108 Cb 0.47 1.02 0.02 0.00 -1.47 0.00 0.00 33.84 33.89 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 -0.86 5.86 -0.39 -1.34 1.47 -1.24 -4.86 116.67 115.31 3dft s ASP 109 Ca 0.02 1.54 0.05 0.00 1.18 0.00 0.00 52.55 55.34 3dft s ASP 109 Cb 0.02 -2.49 0.50 0.00 -0.34 0.00 0.00 42.92 40.61 3dft s ASP 109 CO 0.07 -1.12 1.56 0.29 0.68 0.00 0.00 175.17 176.66 3dft n LYS 110 N -2.78 2.53 0.00 2.11 5.02 0.77 -4.95 118.16 120.85 3dft n LYS 110 Ca 0.07 -3.46 0.00 0.00 -2.02 0.00 0.00 58.31 52.90 3dft n LYS 110 Cb 0.54 -2.08 0.00 0.00 -0.02 0.00 0.00 35.03 33.47 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 -0.97 -1.50 3.89 0.72 0.00 -1.25 -4.68 105.19 101.39 3dft n GLY 111 Ca 0.45 -1.55 -0.29 0.00 0.00 0.00 0.00 46.02 44.63 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 -1.61 4.84 0.01 1.61 -7.23 -1.26 -1.18 120.40 115.58 3dft s VAL 112 Ca 0.00 0.45 0.01 0.00 -1.81 0.00 0.00 61.98 60.63 3dft s VAL 112 Cb 0.00 -3.76 -0.01 0.00 0.56 0.00 0.00 36.38 33.17 3dft s VAL 112 CO 0.00 -0.56 -0.03 0.68 -0.31 0.00 0.00 175.10 174.88 3dft s VAL 113 N -2.41 0.24 0.37 1.32 -7.23 0.02 -4.87 120.40 107.85 3dft s VAL 113 Ca 0.49 -0.36 -0.27 0.00 -1.81 0.00 0.00 61.98 60.03 3dft s VAL 113 Cb -0.10 -0.25 -0.10 0.00 0.56 0.00 0.00 36.38 36.49 3dft s VAL 113 CO 0.34 -0.08 1.32 -2.16 -0.31 0.00 0.00 175.10 174.20 3dft s PRO 114 N -0.47 4.17 -0.43 4.82 0.04 -1.26 -1.26 135.00 140.61 3dft s PRO 114 Ca -0.03 2.22 -0.18 0.00 0.04 0.00 0.00 61.00 63.05 3dft s PRO 114 Cb -0.04 -2.93 0.02 0.00 0.04 0.00 0.00 34.50 31.60 3dft s PRO 114 CO -0.00 -0.34 0.46 -0.51 0.04 0.00 0.00 177.00 176.64 3dft s LEU 115 N -2.09 4.86 0.38 -3.56 1.43 -0.40 -4.83 118.68 114.46 3dft s LEU 115 Ca 0.53 -0.67 -0.27 0.00 -1.03 0.00 0.00 54.13 52.68 3dft s LEU 115 Cb -0.39 -2.41 -0.11 0.00 0.03 0.00 0.00 46.19 43.30 3dft s LEU 115 CO 0.52 -0.61 1.35 0.00 0.23 0.00 0.00 176.35 177.84 3dft n ALA 116 N 5.67 1.67 -0.79 4.21 0.00 -1.26 -2.54 120.51 127.46 3dft n ALA 116 Ca -0.07 0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.69 3dft n ALA 116 Cb 0.47 -2.32 0.00 0.00 0.00 0.00 0.00 19.45 17.61 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 0.67 0.62 3.53 0.00 0.00 -1.26 -5.05 105.19 103.70 3dft n GLY 117 Ca 0.04 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.08 2.25 -1.33 2.61 -4.23 -1.05 -5.04 115.64 106.77 3dft s THR 118 Ca 0.00 -2.23 -0.14 0.00 -1.18 0.00 0.00 61.69 58.14 3dft s THR 118 Cb 0.00 -2.59 0.10 0.00 1.34 0.00 0.00 72.50 71.35 3dft s THR 118 CO 0.00 -0.23 1.86 -3.20 -0.54 0.00 0.00 174.62 172.51 3dft n ASN 119 N -0.76 4.70 -1.36 3.99 4.05 -1.26 -4.43 115.26 120.18 3dft n ASN 119 Ca -0.05 -2.95 -0.15 0.00 0.45 0.00 0.00 54.58 51.89 3dft n ASN 119 Cb 0.63 -1.63 -0.04 0.00 1.23 0.00 0.00 39.78 39.97 3dft n ASN 119 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 3dft n GLY 120 N 4.22 0.72 3.92 8.20 0.00 -1.26 -5.01 105.19 115.97 3dft n GLY 120 Ca 0.46 -0.31 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 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 -3.90 3.18 0.23 1.61 2.02 -1.26 -4.98 118.70 115.60 3dft s GLU 121 Ca 0.00 -0.07 0.00 0.00 0.02 0.00 0.00 54.97 54.92 3dft s GLU 121 Cb 0.00 -2.39 -0.04 0.00 0.10 0.00 0.00 34.13 31.79 3dft s GLU 121 CO 0.00 -0.40 0.13 0.95 0.02 0.00 0.00 175.26 175.96 3dft s THR 122 N -2.77 0.21 0.43 3.63 -4.23 -1.26 -1.28 115.64 110.37 3dft s THR 122 Ca 0.50 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 59.05 3dft s THR 122 Cb -0.10 -2.55 -0.02 0.00 1.34 0.00 0.00 72.50 71.17 3dft s THR 122 CO 0.43 0.00 0.15 0.28 -0.54 0.00 0.00 174.62 174.94 3dft s THR 123 N -3.96 0.50 0.02 3.99 -1.32 -0.39 -4.79 115.64 109.69 3dft s THR 123 Ca 0.38 -2.00 0.08 0.00 -1.21 0.00 0.00 61.69 58.94 3dft s THR 123 Cb 0.07 -2.26 -0.02 0.00 -1.51 0.00 0.00 72.50 68.77 3dft s THR 123 CO 0.13 0.00 -0.23 -0.89 -2.21 0.00 0.00 174.62 171.43 3dft s THR 124 N -3.16 1.84 0.38 5.08 2.01 -1.26 -0.80 115.64 119.73 3dft s THR 124 Ca 0.21 -1.16 0.08 0.00 0.31 0.00 0.00 61.69 61.13 3dft s THR 124 Cb 0.01 -1.56 -0.03 0.00 0.01 0.00 0.00 72.50 70.93 3dft s THR 124 CO 0.15 0.37 0.30 0.00 -0.69 0.00 0.00 174.62 174.75 3dft s GLN 125 N -0.94 2.56 0.00 4.92 -2.07 -0.32 -4.91 119.66 118.89 3dft s GLN 125 Ca 0.09 -1.47 0.00 0.00 -1.82 0.00 0.00 55.36 52.16 3dft s GLN 125 Cb -0.09 -2.36 0.00 0.00 -1.09 0.00 0.00 33.01 29.47 3dft s GLN 125 CO 0.01 -0.05 0.00 0.41 -1.32 0.00 0.00 175.29 174.34 3dft n GLY 126 N -1.41 -0.75 0.12 2.60 0.00 -1.26 -0.16 105.19 104.32 3dft n GLY 126 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.02 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 -9.43 0.99 3.38 -1.91 -3.41 115.31 104.94 3dft h LEU 127 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 3dft h LEU 127 Cb 0.00 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.78 3dft h LEU 127 CO 0.00 0.66 1.18 -1.81 0.09 0.00 0.00 178.44 178.56 3dft s ASP 128 N -6.63 6.43 -0.81 -0.43 1.01 -1.26 -1.71 116.67 113.27 3dft s ASP 128 Ca 0.01 2.72 0.00 0.00 0.71 0.00 0.00 52.55 55.98 3dft s ASP 128 Cb 0.10 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.49 3dft s ASP 128 CO 0.76 -1.04 0.00 0.61 0.21 0.00 0.00 175.17 175.72 3dft n GLY 129 N 4.41 0.83 0.33 0.21 0.00 -1.26 -4.87 105.19 104.83 3dft n GLY 129 Ca 0.19 -0.11 0.02 0.00 0.00 0.00 0.00 46.02 46.12 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 0.67 0.17 0.99 5.85 -1.56 -2.39 115.31 119.04 3dft h LEU 130 Ca -0.16 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.54 3dft h LEU 130 Cb 0.92 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.77 3dft h LEU 130 CO 0.23 0.50 -0.12 -1.28 -0.34 0.00 0.00 178.44 177.43 3dft h SER 131 N 0.79 -0.32 -0.62 1.25 0.87 -1.90 0.10 113.55 113.73 3dft h SER 131 Ca 0.21 0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.79 3dft h SER 131 Cb -0.06 0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 61.97 3dft h SER 131 CO -0.04 -0.20 0.37 -0.33 -0.53 0.00 0.00 176.83 176.10 3dft h GLU 132 N -0.30 0.86 -0.37 2.24 3.07 -1.92 -1.25 114.58 116.92 3dft h GLU 132 Ca -0.01 -0.08 -0.07 0.00 -0.50 0.00 0.00 59.36 58.71 3dft h GLU 132 Cb 0.26 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 27.98 3dft h GLU 132 CO -0.00 0.62 -0.04 0.00 -1.40 0.00 0.00 179.01 178.18 3dft h ARG 133 N 0.88 0.68 -0.63 2.33 3.08 -0.96 -1.29 114.38 118.45 3dft h ARG 133 Ca 0.23 -0.23 -0.02 0.00 0.07 0.00 0.00 59.98 60.02 3dft h ARG 133 Cb -0.02 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 29.95 3dft h ARG 133 CO -0.04 0.80 0.30 0.00 -1.07 0.00 0.00 179.97 179.97 3dft h ALA 135 N 1.13 0.79 -0.37 0.00 0.00 -1.10 0.13 119.26 119.84 3dft h ALA 135 Ca 0.22 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 3dft h ALA 135 Cb 0.12 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3dft h ALA 135 CO -0.03 0.29 0.09 0.37 0.00 0.00 0.00 179.25 179.97 3dft h GLN 136 N 0.84 0.60 -0.68 0.00 5.75 -0.78 -1.91 115.11 118.94 3dft h GLN 136 Ca 0.22 -0.15 -0.05 0.00 -0.15 0.00 0.00 58.65 58.52 3dft h GLN 136 Cb 0.02 -0.08 -0.03 0.00 1.07 0.00 0.00 27.48 28.46 3dft h GLN 136 CO -0.04 0.64 0.21 1.88 -2.65 0.00 0.00 178.83 178.87 3dft h TYR 137 N 0.46 1.07 -0.23 3.99 0.05 -0.30 -1.63 116.97 120.38 3dft h TYR 137 Ca 0.12 -0.10 0.00 0.00 0.05 0.00 0.00 58.73 58.80 3dft h TYR 137 Cb 0.31 -0.31 -0.01 0.00 1.01 0.00 0.00 36.73 37.73 3dft h TYR 137 CO 0.02 0.85 0.15 -0.22 -1.05 0.00 0.00 178.16 177.91 3dft h LYS 138 N 1.00 0.31 -0.14 4.88 1.63 -0.56 -0.55 116.57 123.15 3dft h LYS 138 Ca 0.22 -0.02 -0.02 0.00 -0.85 0.00 0.00 60.65 59.98 3dft h LYS 138 Cb 0.29 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 31.84 3dft h LYS 138 CO -0.01 0.22 0.02 -0.22 -3.45 0.00 0.00 179.45 176.01 3dft h LYS 139 N 0.31 0.19 -0.67 1.90 3.64 -1.06 -2.59 116.57 118.29 3dft h LYS 139 Ca 0.08 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 3dft h LYS 139 Cb -0.02 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 3dft h LYS 139 CO -0.02 0.20 0.00 -0.25 -2.27 0.00 0.00 179.45 177.11 3dft n ASP 140 N -4.44 4.17 0.00 4.20 8.00 -0.64 -4.93 116.55 122.92 3dft n ASP 140 Ca -0.01 -2.55 0.00 0.00 0.71 0.00 0.00 54.79 52.94 3dft n ASP 140 Cb 0.14 -0.59 0.00 0.00 -0.02 0.00 0.00 41.12 40.66 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 0.62 1.43 3.79 0.44 0.00 -0.97 -4.95 105.19 105.55 3dft n GLY 141 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.12 3.47 0.00 4.61 0.00 -0.28 -4.43 121.76 123.00 3dft s ALA 142 Ca 0.00 0.24 0.00 0.00 0.00 0.00 0.00 51.96 52.20 3dft s ALA 142 Cb 0.00 -2.85 0.00 0.00 0.00 0.00 0.00 23.12 20.27 3dft s ALA 142 CO 0.00 0.33 0.00 -0.25 0.00 0.00 0.00 175.76 175.84 3dft n ASP 143 N 1.37 1.40 -4.02 0.00 10.43 0.26 -4.06 116.55 121.94 3dft n ASP 143 Ca -0.06 -0.33 -0.10 0.00 2.57 0.00 0.00 54.79 56.88 3dft n ASP 143 Cb 0.50 0.94 -0.08 0.00 1.84 0.00 0.00 41.12 44.32 3dft n ASP 143 CO 0.00 0.00 0.00 0.72 -1.07 0.00 0.00 177.20 176.85 3dft s PHE 144 N -1.22 0.55 0.17 1.24 -0.71 -1.16 -0.99 117.98 115.87 3dft s PHE 144 Ca 0.00 -0.92 0.02 0.00 -1.04 0.00 0.00 56.93 54.99 3dft s PHE 144 Cb 0.00 -0.20 -0.05 0.00 -1.21 0.00 0.00 43.02 41.57 3dft s PHE 144 CO 0.00 -0.66 -0.02 0.00 -1.34 0.00 0.00 175.22 173.20 3dft s ALA 145 N -4.00 1.38 -0.02 1.99 0.00 -0.12 -1.15 121.76 119.85 3dft s ALA 145 Ca 0.20 -1.57 0.07 0.00 0.00 0.00 0.00 51.96 50.66 3dft s ALA 145 Cb 0.05 0.42 -0.02 0.00 0.00 0.00 0.00 23.12 23.57 3dft s ALA 145 CO 0.01 -0.27 -0.23 0.21 0.00 0.00 0.00 175.76 175.48 3dft s LYS 146 N -3.87 1.85 -0.23 0.00 2.20 -0.62 -1.85 119.74 117.22 3dft s LYS 146 Ca 0.22 -0.82 -0.04 0.00 -0.36 0.00 0.00 55.97 54.97 3dft s LYS 146 Cb 0.05 -1.79 0.12 0.00 -1.51 0.00 0.00 37.83 34.70 3dft s LYS 146 CO 0.03 0.49 0.38 -0.46 -0.36 0.00 0.00 175.35 175.43 3dft s TRP 147 N -0.54 -0.78 -0.26 4.03 -0.11 -1.26 -1.16 118.94 118.87 3dft s TRP 147 Ca 0.09 0.99 -0.10 0.00 1.22 0.00 0.00 56.10 58.29 3dft s TRP 147 Cb -0.09 0.07 -0.05 0.00 -1.50 0.00 0.00 33.47 31.91 3dft s TRP 147 CO -0.01 -0.64 0.16 0.50 -4.62 0.00 0.00 176.95 172.34 3dft s ARG 148 N 2.55 3.97 0.02 5.86 3.52 -1.26 -3.62 118.95 129.98 3dft s ARG 148 Ca 0.09 -0.32 0.02 0.00 -0.13 0.00 0.00 55.73 55.39 3dft s ARG 148 Cb -0.14 -3.57 -0.04 0.00 -1.56 0.00 0.00 34.95 29.64 3dft s ARG 148 CO -0.15 -0.07 0.02 0.00 -0.81 0.00 0.00 175.30 174.29 3dft s VAL 150 N -1.17 1.24 0.17 0.00 1.01 -1.26 -1.77 120.40 118.62 3dft s VAL 150 Ca 0.22 -0.51 0.09 0.00 0.00 0.00 0.00 61.98 61.78 3dft s VAL 150 Cb -0.12 -1.14 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 3dft s VAL 150 CO 0.13 0.38 -0.20 -0.76 0.00 0.00 0.00 175.10 174.66 3dft s LEU 151 N 0.87 2.43 -0.00 3.92 1.43 0.33 -4.45 118.68 123.21 3dft s LEU 151 Ca -0.10 -0.85 0.03 0.00 -1.03 0.00 0.00 54.13 52.17 3dft s LEU 151 Cb -0.15 -0.92 -0.01 0.00 0.03 0.00 0.00 46.19 45.14 3dft s LEU 151 CO 0.01 0.01 -0.10 -1.59 0.23 0.00 0.00 176.35 174.92 3dft s LYS 152 N -2.71 0.76 -0.27 1.70 -2.85 -1.26 -1.03 119.74 114.08 3dft s LYS 152 Ca 0.16 -0.38 -0.22 0.00 -1.00 0.00 0.00 55.97 54.53 3dft s LYS 152 Cb -0.07 -0.73 -0.01 0.00 -2.06 0.00 0.00 37.83 34.97 3dft s LYS 152 CO 0.07 0.20 0.71 0.42 0.10 0.00 0.00 175.35 176.85 3dft s ILE 153 N -0.31 4.90 0.00 3.79 1.01 -1.26 -2.32 121.20 127.01 3dft s ILE 153 Ca 0.03 1.23 0.00 0.00 0.00 0.00 0.00 60.65 61.91 3dft s ILE 153 Cb -0.04 -4.03 0.00 0.00 0.01 0.00 0.00 42.46 38.40 3dft s ILE 153 CO -0.00 -0.07 0.00 0.61 0.00 0.00 0.00 174.94 175.48 3dft n GLY 154 N 4.08 3.64 0.18 6.18 0.00 -0.16 -4.78 105.19 114.33 3dft n GLY 154 Ca 0.02 -1.31 -0.05 0.00 0.00 0.00 0.00 46.02 44.68 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 0.33 0.00 1.61 5.08 -2.00 -3.18 114.58 116.42 3dft h GLU 155 Ca 0.00 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3dft h GLU 155 Cb 0.00 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 3dft h GLU 155 CO 0.00 0.22 -0.16 0.72 -1.00 0.00 0.00 179.01 178.79 3dft n HIS 156 N -4.99 0.00 -4.20 4.33 8.25 -1.26 -5.05 115.22 112.30 3dft n HIS 156 Ca 0.03 -0.88 -0.18 0.00 -0.26 0.00 0.00 57.72 56.42 3dft n HIS 156 Cb 0.15 -0.14 -0.12 0.00 1.12 0.00 0.00 29.99 31.00 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 -2.40 1.19 0.18 1.59 -4.23 -1.20 -3.63 115.64 107.14 3dft s THR 157 Ca 0.28 -1.45 -0.30 0.00 -1.18 0.00 0.00 61.69 59.03 3dft s THR 157 Cb 0.25 -1.24 -0.08 0.00 1.34 0.00 0.00 72.50 72.76 3dft s THR 157 CO 0.01 -0.29 1.29 -2.84 -0.54 0.00 0.00 174.62 172.25 3dft s PRO 158 N -2.07 4.40 0.77 3.99 0.02 -0.98 -0.99 135.00 140.15 3dft s PRO 158 Ca 0.02 2.00 -0.12 0.00 0.02 0.00 0.00 61.00 62.92 3dft s PRO 158 Cb -0.08 -3.22 0.05 0.00 0.02 0.00 0.00 34.50 31.27 3dft s PRO 158 CO 0.02 -0.24 1.11 -1.54 -0.33 0.00 0.00 177.00 176.03 3dft s SER 159 N 0.44 4.82 0.26 2.53 1.04 -1.24 -4.84 113.70 116.71 3dft s SER 159 Ca 0.57 1.13 -0.04 0.00 0.48 0.00 0.00 55.95 58.08 3dft s SER 159 Cb -0.35 -1.84 0.34 0.00 0.10 0.00 0.00 66.02 64.26 3dft s SER 159 CO 0.36 -1.74 1.89 0.00 0.98 0.00 0.00 173.24 174.74 3dft h ALA 160 N -0.93 1.31 0.10 5.32 0.00 -2.00 -1.10 119.26 121.96 3dft h ALA 160 Ca -0.46 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 3dft h ALA 160 Cb 1.28 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3dft h ALA 160 CO 0.62 0.50 -0.05 1.25 0.00 0.00 0.00 179.25 181.58 3dft h LEU 161 N 1.21 -0.11 -0.49 0.00 5.85 -1.99 -1.38 115.31 118.41 3dft h LEU 161 Ca 0.40 -0.10 0.04 0.00 0.84 0.00 0.00 57.88 59.06 3dft h LEU 161 Cb 0.04 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.06 3dft h LEU 161 CO -0.14 0.03 0.25 0.00 -0.34 0.00 0.00 178.44 178.24 3dft h ALA 162 N 0.65 0.62 0.03 1.25 0.00 -1.84 0.24 119.26 120.22 3dft h ALA 162 Ca -0.01 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3dft h ALA 162 Cb 0.20 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3dft h ALA 162 CO 0.02 -0.10 -0.02 0.82 0.00 0.00 0.00 179.25 179.97 3dft h ILE 163 N 0.48 1.07 -0.13 0.00 2.04 -1.17 -1.80 117.51 117.99 3dft h ILE 163 Ca 0.21 -0.32 -0.00 0.00 1.00 0.00 0.00 64.86 65.75 3dft h ILE 163 Cb 0.12 1.28 -0.01 0.00 -0.74 0.00 0.00 36.82 37.47 3dft h ILE 163 CO -0.15 0.08 0.07 -0.03 0.00 0.00 0.00 178.15 178.13 3dft h MET 164 N -0.18 0.19 -0.18 2.37 4.05 -0.91 -1.65 114.93 118.61 3dft h MET 164 Ca -0.00 -0.02 -0.01 0.00 -0.28 0.00 0.00 59.70 59.39 3dft h MET 164 Cb 0.17 -0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 30.92 3dft h MET 164 CO 0.01 0.21 0.08 1.49 0.23 0.00 0.00 176.91 178.93 3dft h GLU 165 N 0.12 0.26 -0.72 0.39 4.57 -0.54 -1.24 114.58 117.42 3dft h GLU 165 Ca 0.05 -0.04 -0.05 0.00 -1.18 0.00 0.00 59.36 58.14 3dft h GLU 165 Cb 0.08 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.59 3dft h GLU 165 CO -0.01 0.30 0.25 -0.91 -1.18 0.00 0.00 179.01 177.47 3dft h ASN 166 N 0.16 1.01 -0.61 1.04 2.35 -1.32 -0.82 115.58 117.39 3dft h ASN 166 Ca 0.06 -0.17 -0.05 0.00 -0.55 0.00 0.00 56.30 55.59 3dft h ASN 166 Cb 0.13 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.21 3dft h ASN 166 CO -0.01 0.93 0.19 0.00 -1.65 0.00 0.00 177.43 176.88 3dft h ALA 167 N 1.21 0.81 -0.25 -0.83 0.00 -1.17 -2.07 119.26 116.96 3dft h ALA 167 Ca 0.24 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 3dft h ALA 167 Cb 0.25 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3dft h ALA 167 CO -0.01 0.48 0.02 -0.97 0.00 0.00 0.00 179.25 178.76 3dft h ASN 168 N 0.88 0.42 0.23 0.00 -1.24 -0.78 -2.38 115.58 112.71 3dft h ASN 168 Ca 0.20 -0.29 -0.07 0.00 0.71 0.00 0.00 56.30 56.85 3dft h ASN 168 Cb 0.30 -0.11 -0.01 0.00 0.73 0.00 0.00 38.32 39.23 3dft h ASN 168 CO -0.00 0.60 -0.28 1.62 -1.29 0.00 0.00 177.43 178.08 3dft h VAL 169 N 0.22 1.22 -0.29 2.57 3.04 -1.12 -1.70 116.25 120.20 3dft h VAL 169 Ca 0.07 -1.06 -0.08 0.00 -1.01 0.00 0.00 66.70 64.62 3dft h VAL 169 Cb 0.38 1.50 -0.02 0.00 -2.01 0.00 0.00 31.29 31.15 3dft h VAL 169 CO 0.01 0.31 -0.18 -0.07 -1.01 0.00 0.00 177.57 176.63 3dft h LEU 170 N 0.08 0.51 -0.34 3.16 3.38 -1.21 -1.50 115.31 119.40 3dft h LEU 170 Ca 0.01 -0.15 -0.17 0.00 0.09 0.00 0.00 57.88 57.66 3dft h LEU 170 Cb 0.54 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 3dft h LEU 170 CO 0.04 0.70 -0.47 0.00 0.09 0.00 0.00 178.44 178.80 3dft h ALA 171 N 1.35 0.51 -0.23 1.53 0.00 -0.81 -1.37 119.26 120.24 3dft h ALA 171 Ca 0.08 -0.49 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 3dft h ALA 171 Cb 0.58 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 3dft h ALA 171 CO 0.04 0.68 0.10 0.00 0.00 0.00 0.00 179.25 180.07 3dft h ARG 172 N 0.72 0.33 -0.78 0.00 2.47 -1.08 -0.09 114.38 115.96 3dft h ARG 172 Ca 0.04 -0.05 0.02 0.00 -1.26 0.00 0.00 59.98 58.72 3dft h ARG 172 Cb 1.08 -0.06 -0.04 0.00 -1.65 0.00 0.00 29.97 29.30 3dft h ARG 172 CO 0.11 0.36 0.50 -0.92 0.56 0.00 0.00 179.97 180.59 3dft h TYR 173 N 0.23 0.95 -0.51 3.04 3.20 -1.25 -1.64 116.97 120.99 3dft h TYR 173 Ca 0.08 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.89 3dft h TYR 173 Cb 0.15 -0.32 -0.02 0.00 1.54 0.00 0.00 36.73 38.08 3dft h TYR 173 CO -0.02 0.56 -0.00 0.00 -1.64 0.00 0.00 178.16 177.06 3dft h ALA 174 N 1.31 0.69 -0.04 1.82 0.00 -0.98 -1.95 119.26 120.10 3dft h ALA 174 Ca 0.30 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.93 3dft h ALA 174 Cb -0.04 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3dft h ALA 174 CO -0.09 0.50 -0.00 1.03 0.00 0.00 0.00 179.25 180.69 3dft h SER 175 N 0.77 -0.02 -0.57 0.00 0.87 -0.54 -1.82 113.55 112.23 3dft h SER 175 Ca 0.14 0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.69 3dft h SER 175 Cb 0.53 0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.48 3dft h SER 175 CO 0.03 -0.00 0.27 0.40 -0.53 0.00 0.00 176.83 176.99 3dft h ILE 176 N 0.01 1.21 -0.15 2.23 2.04 -1.27 -2.66 117.51 118.92 3dft h ILE 176 Ca 0.02 -0.60 0.03 0.00 1.00 0.00 0.00 64.86 65.31 3dft h ILE 176 Cb 0.02 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 36.62 3dft h ILE 176 CO -0.04 0.24 -0.06 0.00 0.00 0.00 0.00 178.15 178.30 3dft h GLN 178 N -0.03 0.00 0.00 0.00 4.20 -1.18 -0.46 115.11 117.64 3dft h GLN 178 Ca 0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.79 3dft h GLN 178 Cb 0.15 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.93 3dft h GLN 178 CO -0.17 0.07 0.00 1.96 -0.67 0.00 0.00 178.83 180.02 3dft h GLN 179 N 0.00 0.00 -0.23 1.46 1.08 -1.08 -3.15 115.11 113.18 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 0.28 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.70 3dft h GLN 179 CO 0.01 0.00 -0.01 0.09 -0.95 0.00 0.00 178.83 177.97 3dft n ASN 180 N -2.95 3.48 -0.79 1.46 4.13 -0.27 -4.96 115.26 115.36 3dft n ASN 180 Ca 0.02 -3.13 -0.10 0.00 1.68 0.00 0.00 54.58 53.05 3dft n ASN 180 Cb 0.35 -0.54 -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 -0.73 1.18 3.49 7.41 0.00 -1.14 -4.75 105.19 110.65 3dft n GLY 181 Ca 0.22 -0.54 -0.35 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.38 4.08 -0.28 -0.61 -1.09 -0.69 -4.85 121.20 115.39 3dft s ILE 182 Ca 0.00 -0.28 -0.29 0.00 -2.23 0.00 0.00 60.65 57.85 3dft s ILE 182 Cb 0.00 -2.83 0.01 0.00 -1.58 0.00 0.00 42.46 38.05 3dft s ILE 182 CO 0.00 0.45 1.18 -0.69 -1.23 0.00 0.00 174.94 174.65 3dft s VAL 183 N 0.75 4.36 -0.02 2.92 1.01 -0.16 -3.28 120.40 125.98 3dft s VAL 183 Ca 0.00 1.57 -0.26 0.00 0.00 0.00 0.00 61.98 63.29 3dft s VAL 183 Cb -0.14 -4.25 -0.04 0.00 0.00 0.00 0.00 36.38 31.95 3dft s VAL 183 CO 0.02 -0.40 0.82 -2.16 0.00 0.00 0.00 175.10 173.38 3dft s PRO 184 N 3.78 4.50 -0.39 2.72 0.04 -1.26 -0.94 135.00 143.45 3dft s PRO 184 Ca 0.51 1.12 -0.17 0.00 0.04 0.00 0.00 61.00 62.50 3dft s PRO 184 Cb -0.15 -3.44 0.01 0.00 0.04 0.00 0.00 34.50 30.95 3dft s PRO 184 CO 0.17 0.05 0.45 0.42 0.04 0.00 0.00 177.00 178.13 3dft s ILE 185 N 0.76 5.08 -0.30 0.56 1.01 -0.77 -2.65 121.20 124.89 3dft s ILE 185 Ca 0.43 -0.10 -0.29 0.00 0.00 0.00 0.00 60.65 60.69 3dft s ILE 185 Cb -0.19 -3.99 0.01 0.00 0.01 0.00 0.00 42.46 38.30 3dft s ILE 185 CO 0.23 -0.32 1.10 -0.69 0.00 0.00 0.00 174.94 175.26 3dft s VAL 186 N 2.20 4.49 -0.46 2.92 1.01 -0.06 -4.09 120.40 126.41 3dft s VAL 186 Ca 0.14 1.73 0.03 0.00 0.00 0.00 0.00 61.98 63.89 3dft s VAL 186 Cb -0.16 -4.35 0.12 0.00 0.00 0.00 0.00 36.38 31.98 3dft s VAL 186 CO 0.13 -0.42 0.20 -0.70 0.00 0.00 0.00 175.10 174.32 3dft s GLU 187 N 3.62 1.70 -1.08 2.72 2.12 -1.24 -0.25 118.70 126.29 3dft s GLU 187 Ca 0.47 -2.28 -0.07 0.00 0.36 0.00 0.00 54.97 53.44 3dft s GLU 187 Cb -0.13 -3.08 0.28 0.00 0.26 0.00 0.00 34.13 31.46 3dft s GLU 187 CO 0.15 -1.07 1.17 -0.35 -0.54 0.00 0.00 175.26 174.61 3dft n PRO 188 N 3.52 3.66 -2.33 4.30 -0.04 -1.25 -1.44 135.00 141.43 3dft n PRO 188 Ca 0.05 -4.49 -0.42 0.00 -0.04 0.00 0.00 63.50 58.60 3dft n PRO 188 Cb 0.35 -2.52 -0.03 0.00 -0.04 0.00 0.00 33.50 31.26 3dft n PRO 188 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 3dft s GLU 189 N -1.66 4.35 -0.34 0.54 2.12 -0.73 -4.60 118.70 118.38 3dft s GLU 189 Ca 0.31 1.86 -0.09 0.00 0.36 0.00 0.00 54.97 57.40 3dft s GLU 189 Cb -0.06 -3.45 0.02 0.00 0.26 0.00 0.00 34.13 30.89 3dft s GLU 189 CO -0.04 -0.43 0.16 0.42 -0.54 0.00 0.00 175.26 174.83 3dft s ILE 190 N 1.76 4.38 0.62 -3.70 1.01 -1.26 -0.51 121.20 123.50 3dft s ILE 190 Ca 0.61 -0.76 -0.19 0.00 0.00 0.00 0.00 60.65 60.31 3dft s ILE 190 Cb -0.30 -3.37 -0.03 0.00 0.01 0.00 0.00 42.46 38.77 3dft s ILE 190 CO 0.27 -0.11 1.18 0.18 0.00 0.00 0.00 174.94 176.46 3dft n LEU 191 N 4.95 5.08 -0.35 2.97 4.77 -0.20 -4.85 117.00 129.38 3dft n LEU 191 Ca -0.13 0.84 0.13 0.00 -0.03 0.00 0.00 56.01 56.83 3dft n LEU 191 Cb 0.47 -1.50 0.58 0.00 -2.33 0.00 0.00 43.42 40.65 3dft n LEU 191 CO 0.34 -1.27 0.90 -0.81 -1.33 0.00 0.00 177.39 175.23 3dft n PRO 192 N -1.44 1.47 -1.90 3.23 -0.04 -1.26 -4.54 135.00 130.52 3dft n PRO 192 Ca 0.14 -0.70 -0.39 0.00 -0.04 0.00 0.00 63.50 62.52 3dft n PRO 192 Cb 0.47 -1.45 0.02 0.00 -0.04 0.00 0.00 33.50 32.51 3dft n PRO 192 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3dft s ASP 193 N -1.86 5.70 0.00 3.54 -0.00 -1.26 -0.61 116.67 122.16 3dft s ASP 193 Ca 0.38 2.71 0.00 0.00 -0.00 0.00 0.00 52.55 55.64 3dft s ASP 193 Cb 0.20 -2.63 0.00 0.00 -0.00 0.00 0.00 42.92 40.48 3dft s ASP 193 CO 0.32 -1.28 0.00 0.61 -0.00 0.00 0.00 175.17 174.82 3dft n GLY 194 N 0.64 1.50 1.02 0.21 0.00 -1.26 -4.61 105.19 102.69 3dft n GLY 194 Ca 0.08 -2.19 0.08 0.00 0.00 0.00 0.00 46.02 43.99 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 3.98 -4.76 1.61 5.75 -1.26 -0.55 116.55 121.32 3dft n ASP 195 Ca 0.00 -2.74 -0.34 0.00 -0.01 0.00 0.00 54.79 51.70 3dft n ASP 195 Cb 0.00 -0.50 0.04 0.00 -1.03 0.00 0.00 41.12 39.63 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 -2.35 2.56 0.40 2.11 -3.43 -1.26 -4.24 115.29 109.08 3dft s HIS 196 Ca 0.41 1.55 -0.03 0.00 -0.80 0.00 0.00 55.06 56.19 3dft s HIS 196 Cb 0.30 -3.25 0.09 0.00 -1.43 0.00 0.00 32.58 28.29 3dft s HIS 196 CO 0.13 -1.79 0.55 -0.40 -2.00 0.00 0.00 174.74 171.23 3dft n ASP 197 N -2.16 0.45 -0.11 7.38 5.68 -1.26 -0.49 116.55 126.03 3dft n ASP 197 Ca 0.11 -1.45 -0.09 0.00 -0.50 0.00 0.00 54.79 52.86 3dft n ASP 197 Cb 0.51 -0.38 -0.01 0.00 -1.14 0.00 0.00 41.12 40.10 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 0.47 -1.43 -2.12 5.85 -1.92 -2.80 115.31 113.36 3dft h LEU 198 Ca -0.18 -0.14 -0.06 0.00 0.84 0.00 0.00 57.88 58.34 3dft h LEU 198 Cb 0.60 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 3dft h LEU 198 CO 0.17 0.48 -0.25 0.07 -0.34 0.00 0.00 178.44 178.56 3dft h LYS 199 N 0.42 0.05 -0.49 1.25 2.10 -1.95 -0.85 116.57 117.10 3dft h LYS 199 Ca 0.12 -0.01 -0.12 0.00 -2.00 0.00 0.00 60.65 58.63 3dft h LYS 199 Cb 0.15 -0.01 -0.02 0.00 -0.90 0.00 0.00 32.23 31.45 3dft h LYS 199 CO -0.01 0.30 -0.17 -0.09 -2.00 0.00 0.00 179.45 177.48 3dft h ARG 200 N 0.05 0.97 -0.33 0.07 9.65 -1.90 -0.90 114.38 121.99 3dft h ARG 200 Ca 0.01 -0.39 -0.06 0.00 -1.10 0.00 0.00 59.98 58.44 3dft h ARG 200 Cb 0.48 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 29.00 3dft h ARG 200 CO 0.03 1.06 -0.03 0.00 2.80 0.00 0.00 179.97 183.83 3dft h GLN 202 N 0.39 0.84 0.04 0.00 4.15 -1.01 0.92 115.11 120.45 3dft h GLN 202 Ca 0.09 -0.05 -0.00 0.00 0.77 0.00 0.00 58.65 59.46 3dft h GLN 202 Cb 0.50 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 28.00 3dft h GLN 202 CO 0.02 0.56 -0.02 -0.92 -1.93 0.00 0.00 178.83 176.54 3dft h TYR 203 N 0.87 -0.05 -0.79 3.99 3.20 -1.06 -1.24 116.97 121.89 3dft h TYR 203 Ca 0.26 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.09 3dft h TYR 203 Cb -0.04 0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.22 3dft h TYR 203 CO -0.04 0.05 0.32 0.28 -1.64 0.00 0.00 178.16 177.13 3dft h VAL 204 N -0.15 1.26 -0.80 1.81 2.07 -1.13 -1.94 116.25 117.38 3dft h VAL 204 Ca -0.01 -0.82 -0.04 0.00 0.82 0.00 0.00 66.70 66.66 3dft h VAL 204 Cb 0.13 0.32 -0.04 0.00 -1.52 0.00 0.00 31.29 30.18 3dft h VAL 204 CO 0.01 0.33 0.36 0.74 0.02 0.00 0.00 177.57 179.03 3dft h THR 205 N 1.14 1.26 -0.42 2.57 2.02 -0.68 -0.55 112.91 118.26 3dft h THR 205 Ca 0.26 -0.77 -0.03 0.00 0.77 0.00 0.00 66.41 66.65 3dft h THR 205 Cb 0.21 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 66.87 3dft h THR 205 CO -0.02 0.32 0.13 -0.33 0.37 0.00 0.00 175.52 175.99 3dft h GLU 206 N 1.15 0.64 -0.59 6.66 5.08 -0.89 -1.10 114.58 125.53 3dft h GLU 206 Ca 0.27 -0.14 -0.08 0.00 -1.00 0.00 0.00 59.36 58.42 3dft h GLU 206 Cb 0.17 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 3dft h GLU 206 CO -0.03 0.63 0.07 0.87 -1.00 0.00 0.00 179.01 179.55 3dft h LYS 207 N 0.53 0.99 -0.03 2.33 1.79 -1.05 -1.43 116.57 119.70 3dft h LYS 207 Ca 0.13 -0.28 -0.00 0.00 -2.18 0.00 0.00 60.65 58.32 3dft h LYS 207 Cb 0.25 -0.11 -0.00 0.00 -1.58 0.00 0.00 32.23 30.79 3dft h LYS 207 CO -0.01 0.95 0.00 0.28 -1.08 0.00 0.00 179.45 179.60 3dft h VAL 208 N 0.89 1.24 -0.52 0.50 2.07 -1.01 -2.34 116.25 117.09 3dft h VAL 208 Ca 0.18 -0.73 -0.03 0.00 0.82 0.00 0.00 66.70 66.94 3dft h VAL 208 Cb 0.46 1.68 -0.03 0.00 -1.52 0.00 0.00 31.29 31.88 3dft h VAL 208 CO 0.02 0.19 0.19 -0.07 0.02 0.00 0.00 177.57 177.92 3dft h LEU 209 N -0.24 0.69 -0.88 2.57 3.38 -1.17 0.58 115.31 120.23 3dft h LEU 209 Ca 0.01 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 57.84 3dft h LEU 209 Cb 0.31 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 3dft h LEU 209 CO 0.00 0.63 0.27 0.00 0.09 0.00 0.00 178.44 179.43 3dft h ALA 210 N 1.47 1.10 -0.17 1.53 0.00 -1.18 -1.40 119.26 120.61 3dft h ALA 210 Ca 0.18 -0.20 -0.16 0.00 0.00 0.00 0.00 54.91 54.73 3dft h ALA 210 Cb 0.17 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3dft h ALA 210 CO -0.01 0.63 -0.56 0.00 0.00 0.00 0.00 179.25 179.30 3dft h ALA 211 N 1.23 0.70 0.07 0.00 0.00 -0.77 -2.64 119.26 117.85 3dft h ALA 211 Ca 0.24 -0.52 -0.00 0.00 0.00 0.00 0.00 54.91 54.63 3dft h ALA 211 Cb 0.23 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3dft h ALA 211 CO -0.02 0.69 -0.03 0.28 0.00 0.00 0.00 179.25 180.17 3dft h VAL 212 N 0.41 0.99 0.00 0.00 2.07 -0.41 -1.78 116.25 117.52 3dft h VAL 212 Ca 0.00 -0.19 -0.08 0.00 0.82 0.00 0.00 66.70 67.26 3dft h VAL 212 Cb 1.10 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.97 3dft h VAL 212 CO 0.10 0.05 -0.36 1.88 0.02 0.00 0.00 177.57 179.26 3dft h TYR 213 N -0.18 0.00 -0.37 1.57 0.05 -1.29 -0.46 116.97 116.29 3dft h TYR 213 Ca -0.01 0.00 -0.16 0.00 0.05 0.00 0.00 58.73 58.61 3dft h TYR 213 Cb 0.15 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.88 3dft h TYR 213 CO -0.05 0.36 -0.39 -0.22 -1.05 0.00 0.00 178.16 176.82 3dft h LYS 214 N 0.00 0.90 -0.57 4.88 1.63 -1.36 -0.99 116.57 121.07 3dft h LYS 214 Ca -0.00 -0.48 -0.10 0.00 -0.85 0.00 0.00 60.65 59.22 3dft h LYS 214 Cb 0.79 0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.42 3dft h LYS 214 CO 0.05 1.13 -0.05 0.00 -3.45 0.00 0.00 179.45 177.13 3dft h ALA 215 N 0.81 0.84 -0.73 5.00 0.00 -0.86 -0.33 119.26 123.99 3dft h ALA 215 Ca 0.06 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.60 3dft h ALA 215 Cb 0.98 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 3dft h ALA 215 CO 0.09 0.66 0.27 -0.07 0.00 0.00 0.00 179.25 180.21 3dft h LEU 216 N 0.93 1.02 -0.29 0.00 3.38 -0.92 -1.70 115.31 117.73 3dft h LEU 216 Ca 0.16 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 3dft h LEU 216 Cb 0.60 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 3dft h LEU 216 CO 0.04 0.92 0.08 -1.28 0.09 0.00 0.00 178.44 178.29 3dft h SER 217 N 1.07 0.43 -0.41 -0.43 0.87 -0.78 -0.77 113.55 113.54 3dft h SER 217 Ca 0.24 -0.22 0.01 0.00 -1.23 0.00 0.00 61.79 60.60 3dft h SER 217 Cb 0.24 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 62.06 3dft h SER 217 CO -0.02 0.53 0.27 0.44 -0.53 0.00 0.00 176.83 177.53 3dft h ASP 218 N 0.30 0.43 -0.41 6.23 3.32 -0.73 -1.67 116.42 123.90 3dft h ASP 218 Ca 0.09 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.13 3dft h ASP 218 Cb 0.27 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.71 3dft h ASP 218 CO -0.00 0.31 0.00 1.41 -1.72 0.00 0.00 179.24 179.24 3dft n HIS 219 N -4.48 0.64 -3.58 4.55 8.25 -0.67 -4.94 115.22 114.99 3dft n HIS 219 Ca 0.03 -0.30 -0.22 0.00 -0.26 0.00 0.00 57.72 56.98 3dft n HIS 219 Cb 0.09 -0.04 0.07 0.00 1.12 0.00 0.00 29.99 31.23 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 0.69 -2.49 -2.86 4.41 8.25 -0.63 -4.89 115.22 117.70 3dft n HIS 220 Ca 0.14 0.96 -0.40 0.00 -0.26 0.00 0.00 57.72 58.16 3dft n HIS 220 Cb 0.41 -4.89 -0.05 0.00 1.12 0.00 0.00 29.99 26.58 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 -3.37 4.53 -0.74 1.59 -1.09 -0.34 -4.91 121.20 116.88 3dft s ILE 221 Ca 0.33 1.86 -0.25 0.00 -2.23 0.00 0.00 60.65 60.36 3dft s ILE 221 Cb -0.15 -4.22 0.05 0.00 -1.58 0.00 0.00 42.46 36.56 3dft s ILE 221 CO 0.75 0.38 1.16 -0.47 -1.23 0.00 0.00 174.94 175.53 3dft s TYR 222 N -0.28 2.50 0.33 3.97 5.04 -1.26 -4.82 117.35 122.82 3dft s TYR 222 Ca 0.42 -0.37 0.02 0.00 -2.44 0.00 0.00 57.07 54.70 3dft s TYR 222 Cb -0.22 -4.49 0.60 0.00 0.35 0.00 0.00 41.96 38.20 3dft s TYR 222 CO 0.27 -1.87 1.95 -0.07 -1.34 0.00 0.00 175.55 174.49 3dft h LEU 223 N 12.22 0.81 -2.50 6.97 3.38 -1.94 -1.36 115.31 132.89 3dft h LEU 223 Ca -0.23 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.74 3dft h LEU 223 Cb 1.05 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.62 3dft h LEU 223 CO 1.24 0.54 -0.01 -0.33 0.09 0.00 0.00 178.44 179.98 3dft h GLU 224 N 0.93 0.00 -0.80 1.13 3.07 -1.90 -1.81 114.58 115.20 3dft h GLU 224 Ca 0.33 0.00 -0.40 0.00 -0.50 0.00 0.00 59.36 58.79 3dft h GLU 224 Cb 0.12 0.00 -0.24 0.00 -0.84 0.00 0.00 28.75 27.80 3dft h GLU 224 CO -0.10 0.01 0.42 0.41 -1.40 0.00 0.00 179.01 178.34 3dft n GLY 225 N -0.77 4.53 3.22 -3.84 0.00 -0.51 -4.34 105.19 103.49 3dft n GLY 225 Ca -0.02 -1.12 -0.13 0.00 0.00 0.00 0.00 46.02 44.75 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 -3.26 0.11 0.08 2.61 -4.23 -0.68 -4.08 115.64 106.19 3dft s THR 226 Ca 0.53 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 59.07 3dft s THR 226 Cb 0.46 -2.51 -0.03 0.00 1.34 0.00 0.00 72.50 71.75 3dft s THR 226 CO 0.08 -0.01 -0.08 -0.76 -0.54 0.00 0.00 174.62 173.31 3dft s LEU 227 N -3.18 2.40 -0.16 4.79 1.43 -1.08 -3.65 118.68 119.23 3dft s LEU 227 Ca 0.38 -0.81 -0.01 0.00 -1.03 0.00 0.00 54.13 52.66 3dft s LEU 227 Cb 0.07 -0.16 -0.01 0.00 0.03 0.00 0.00 46.19 46.12 3dft s LEU 227 CO 0.12 -0.33 -0.10 -0.22 0.23 0.00 0.00 176.35 176.05 3dft s LEU 228 N -2.42 2.81 -0.67 1.79 2.96 -0.35 -0.88 118.68 121.92 3dft s LEU 228 Ca 0.03 -0.33 0.03 0.00 -0.22 0.00 0.00 54.13 53.64 3dft s LEU 228 Cb -0.02 -1.66 0.16 0.00 0.50 0.00 0.00 46.19 45.18 3dft s LEU 228 CO -0.02 0.12 0.46 -0.75 -1.32 0.00 0.00 176.35 174.84 3dft s LYS 229 N 0.66 2.45 0.41 1.98 2.20 0.66 -0.09 119.74 128.01 3dft s LYS 229 Ca -0.05 -3.04 0.08 0.00 -0.36 0.00 0.00 55.97 52.59 3dft s LYS 229 Cb -0.15 -3.50 0.01 0.00 -1.51 0.00 0.00 37.83 32.67 3dft s LYS 229 CO 0.02 -1.22 0.56 -1.25 -0.36 0.00 0.00 175.35 173.10 3dft s PRO 230 N -0.95 2.87 0.55 4.03 0.04 -1.26 -3.81 135.00 136.46 3dft s PRO 230 Ca 0.22 -1.21 -0.14 0.00 0.04 0.00 0.00 61.00 59.91 3dft s PRO 230 Cb -0.13 -2.77 -0.06 0.00 0.04 0.00 0.00 34.50 31.58 3dft s PRO 230 CO -0.10 -0.23 0.99 0.54 0.04 0.00 0.00 177.00 178.24 3dft s ASN 231 N -4.33 6.46 0.70 6.66 4.22 -1.26 -2.17 114.94 125.23 3dft s ASN 231 Ca 0.54 1.48 -0.11 0.00 -2.14 0.00 0.00 52.86 52.62 3dft s ASN 231 Cb -0.10 -2.48 0.01 0.00 1.28 0.00 0.00 41.25 39.96 3dft s ASN 231 CO 0.33 -0.68 1.09 -0.04 -2.04 0.00 0.00 177.10 175.76 3dft s MET 232 N -4.49 2.88 -0.39 3.55 -1.94 -1.26 -4.94 119.30 112.72 3dft s MET 232 Ca 0.57 0.48 -0.21 0.00 -1.71 0.00 0.00 55.69 54.81 3dft s MET 232 Cb -0.10 -2.02 0.01 0.00 2.01 0.00 0.00 34.83 34.72 3dft s MET 232 CO 0.40 -1.02 0.67 0.08 -0.01 0.00 0.00 175.02 175.14 3dft s VAL 233 N -3.35 4.83 0.12 -6.03 1.01 -1.26 -5.02 120.40 110.70 3dft s VAL 233 Ca 0.58 0.49 -0.02 0.00 0.00 0.00 0.00 61.98 63.03 3dft s VAL 233 Cb -0.11 -4.15 -0.03 0.00 0.00 0.00 0.00 36.38 32.09 3dft s VAL 233 CO 0.52 -0.44 0.08 0.42 0.00 0.00 0.00 175.10 175.68 3dft s THR 234 N 2.84 0.12 0.82 3.92 -4.23 -1.26 -4.51 115.64 113.35 3dft s THR 234 Ca 0.25 -1.79 -0.12 0.00 -1.18 0.00 0.00 61.69 58.85 3dft s THR 234 Cb -0.14 -1.91 0.09 0.00 1.34 0.00 0.00 72.50 71.88 3dft s THR 234 CO 0.17 -0.53 1.11 -2.16 -0.54 0.00 0.00 174.62 172.67 3dft s PRO 235 N -4.01 1.86 0.79 3.99 0.04 -1.26 -4.61 135.00 131.79 3dft s PRO 235 Ca 0.20 0.51 -0.10 0.00 0.04 0.00 0.00 61.00 61.64 3dft s PRO 235 Cb 0.07 -1.90 0.06 0.00 0.04 0.00 0.00 34.50 32.77 3dft s PRO 235 CO -0.01 -1.75 1.10 0.20 0.04 0.00 0.00 177.00 176.58 3dft s GLY 236 N -4.00 1.68 0.49 0.56 0.00 0.36 -4.91 107.32 101.50 3dft s GLY 236 Ca 0.61 0.29 0.14 0.00 0.00 0.00 0.00 44.72 45.77 3dft s GLY 236 CO 0.54 0.64 2.11 0.45 0.00 0.00 0.00 173.10 176.84 3dft h HIS 237 N -1.19 0.07 -0.38 1.90 3.86 -0.56 -2.20 115.15 116.66 3dft h HIS 237 Ca -0.44 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.78 3dft h HIS 237 Cb 1.23 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 29.68 3dft h HIS 237 CO 0.57 0.07 0.00 0.00 0.86 0.00 0.00 177.93 179.44 3dft n ALA 238 N -2.53 2.45 -2.25 2.45 0.00 0.29 -4.93 120.51 116.00 3dft n ALA 238 Ca -0.02 -0.78 -0.42 0.00 0.00 0.00 0.00 53.44 52.22 3dft n ALA 238 Cb 0.11 -0.98 -0.03 0.00 0.00 0.00 0.00 19.45 18.54 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 4.17 0.00 -3.80 0.00 1.35 -1.90 -3.46 112.91 109.27 3dft h THR 240 Ca -0.43 -0.86 -0.49 0.00 -0.55 0.00 0.00 66.41 64.08 3dft h THR 240 Cb 1.21 1.62 -0.00 0.00 -1.73 0.00 0.00 68.15 69.25 3dft h THR 240 CO 0.79 0.00 0.41 -1.58 -0.25 0.00 0.00 175.52 174.88 3dft s GLN 241 N -3.24 4.68 -0.01 4.72 0.74 -1.26 -5.04 119.66 120.25 3dft s GLN 241 Ca 0.05 1.60 -0.02 0.00 0.05 0.00 0.00 55.36 57.05 3dft s GLN 241 Cb 0.09 -3.13 -0.04 0.00 1.10 0.00 0.00 33.01 31.03 3dft s GLN 241 CO 0.71 0.31 0.14 0.15 -0.55 0.00 0.00 175.29 176.05 3dft s LYS 242 N -1.49 3.26 0.07 1.67 -0.14 -1.26 -5.03 119.74 116.82 3dft s LYS 242 Ca 0.45 -0.40 0.03 0.00 -1.36 0.00 0.00 55.97 54.69 3dft s LYS 242 Cb -0.27 -2.98 -0.03 0.00 -1.68 0.00 0.00 37.83 32.86 3dft s LYS 242 CO 0.34 0.66 -0.09 0.71 -0.76 0.00 0.00 175.35 176.21 3dft s TYR 243 N -1.27 0.92 0.54 3.18 1.51 -1.26 -5.16 117.35 115.81 3dft s TYR 243 Ca 0.25 -0.62 -0.04 0.00 -1.01 0.00 0.00 57.07 55.66 3dft s TYR 243 Cb -0.12 -0.52 0.00 0.00 -0.11 0.00 0.00 41.96 41.21 3dft s TYR 243 CO 0.17 -0.04 0.82 -1.54 -1.11 0.00 0.00 175.55 173.84 3dft s SER 244 N -2.15 5.71 0.50 2.29 1.04 -1.26 -4.96 113.70 114.88 3dft s SER 244 Ca 0.00 0.59 0.23 0.00 0.48 0.00 0.00 55.95 57.25 3dft s SER 244 Cb -0.05 -1.68 1.30 0.00 0.10 0.00 0.00 66.02 65.69 3dft s SER 244 CO -0.00 -0.92 2.04 0.45 0.98 0.00 0.00 173.24 175.79 3dft h HIS 245 N 0.04 0.00 -0.31 5.02 -0.00 -1.99 -2.10 115.15 115.81 3dft h HIS 245 Ca -0.46 0.00 -0.14 0.00 -0.00 0.00 0.00 60.37 59.77 3dft h HIS 245 Cb 1.25 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.65 3dft h HIS 245 CO 0.47 0.15 -0.37 0.93 -0.00 0.00 0.00 177.93 179.11 3dft h GLU 246 N 0.00 0.72 -0.26 2.45 3.07 -1.93 -0.64 114.58 117.99 3dft h GLU 246 Ca -0.00 -0.36 -0.18 0.00 -0.50 0.00 0.00 59.36 58.32 3dft h GLU 246 Cb 0.35 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.26 3dft h GLU 246 CO 0.02 0.97 -0.56 0.93 -1.40 0.00 0.00 179.01 178.97 3dft h GLU 247 N 0.60 0.79 -0.69 2.33 5.08 -1.78 0.12 114.58 121.03 3dft h GLU 247 Ca 0.06 -0.51 -0.04 0.00 -1.00 0.00 0.00 59.36 57.87 3dft h GLU 247 Cb 0.90 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.18 3dft h GLU 247 CO 0.08 1.14 0.28 0.82 -1.00 0.00 0.00 179.01 180.33 3dft h ILE 248 N 0.61 1.24 -0.49 3.13 2.04 -1.31 -0.68 117.51 122.04 3dft h ILE 248 Ca 0.01 -0.75 -0.06 0.00 1.00 0.00 0.00 64.86 65.06 3dft h ILE 248 Cb 1.15 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 37.66 3dft h ILE 248 CO 0.12 0.30 0.05 0.00 0.00 0.00 0.00 178.15 178.62 3dft h ALA 249 N 1.13 0.65 -0.42 1.87 0.00 -0.92 -0.54 119.26 121.03 3dft h ALA 249 Ca 0.23 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3dft h ALA 249 Cb 0.20 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3dft h ALA 249 CO -0.02 0.40 0.05 1.98 0.00 0.00 0.00 179.25 181.66 3dft h MET 250 N 0.69 0.72 -0.54 0.00 1.85 -0.69 -0.28 114.93 116.67 3dft h MET 250 Ca 0.14 -0.20 -0.06 0.00 -0.61 0.00 0.00 59.70 58.97 3dft h MET 250 Cb 0.43 -0.08 -0.02 0.00 0.43 0.00 0.00 31.60 32.36 3dft h MET 250 CO 0.01 0.77 0.09 0.00 -0.40 0.00 0.00 176.91 177.38 3dft h ALA 251 N 0.92 0.72 0.59 0.39 0.00 -1.05 -0.32 119.26 120.52 3dft h ALA 251 Ca 0.13 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 3dft h ALA 251 Cb 0.41 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.00 3dft h ALA 251 CO 0.01 0.46 -0.28 1.15 0.00 0.00 0.00 179.25 180.59 3dft h THR 252 N 0.79 0.38 -0.23 0.00 2.02 -0.94 -1.45 112.91 113.47 3dft h THR 252 Ca 0.17 -0.17 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 3dft h THR 252 Cb 0.40 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.24 3dft h THR 252 CO 0.01 0.02 -0.05 0.58 0.37 0.00 0.00 175.52 176.46 3dft h VAL 253 N -0.91 1.17 -0.27 3.16 2.07 -1.06 -2.15 116.25 118.27 3dft h VAL 253 Ca -0.08 -0.71 -0.08 0.00 0.82 0.00 0.00 66.70 66.65 3dft h VAL 253 Cb 0.65 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 3dft h VAL 253 CO 0.13 0.23 -0.13 0.74 0.02 0.00 0.00 177.57 178.56 3dft h THR 254 N 0.34 1.30 -0.49 2.57 2.02 -0.98 -1.54 112.91 116.12 3dft h THR 254 Ca 0.07 -1.22 0.00 0.00 0.77 0.00 0.00 66.41 66.03 3dft h THR 254 Cb 0.31 1.51 -0.02 0.00 -1.74 0.00 0.00 68.15 68.21 3dft h THR 254 CO 0.01 0.39 0.32 0.00 0.37 0.00 0.00 175.52 176.61 3dft h ALA 255 N 0.74 0.63 -0.41 6.16 0.00 -0.94 -2.37 119.26 123.07 3dft h ALA 255 Ca 0.06 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 3dft h ALA 255 Cb 0.65 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 3dft h ALA 255 CO 0.04 0.09 0.15 -0.07 0.00 0.00 0.00 179.25 179.45 3dft h LEU 256 N 0.67 0.57 -2.08 0.00 3.38 -1.36 -2.74 115.31 113.75 3dft h LEU 256 Ca 0.18 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 57.99 3dft h LEU 256 Cb -0.06 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.54 3dft h LEU 256 CO -0.04 0.60 0.06 0.03 0.09 0.00 0.00 178.44 179.19 3dft h ARG 257 N 0.51 0.00 -0.00 1.13 3.08 -1.03 0.17 114.38 118.24 3dft h ARG 257 Ca 0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.18 3dft h ARG 257 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.27 3dft h ARG 257 CO -0.01 0.00 -0.29 0.54 -1.07 0.00 0.00 179.97 179.14 3dft n ARG 258 N -4.37 0.25 0.00 0.04 1.74 -0.92 -4.58 116.66 108.82 3dft n ARG 258 Ca -0.01 -0.11 0.00 0.00 -0.77 0.00 0.00 57.85 56.96 3dft n ARG 258 Cb 0.17 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.11 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 -1.28 0.00 -3.09 0.55 -2.24 -0.69 -5.01 114.28 102.53 3dft n THR 259 Ca 0.08 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.45 3dft n THR 259 Cb 0.33 -0.28 -0.06 0.00 -2.10 0.00 0.00 70.33 68.21 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 -1.28 4.86 0.39 2.28 1.01 0.51 -4.77 120.40 123.40 3dft s VAL 260 Ca 0.00 0.61 -0.27 0.00 0.00 0.00 0.00 61.98 62.32 3dft s VAL 260 Cb 0.00 -4.10 -0.10 0.00 0.00 0.00 0.00 36.38 32.18 3dft s VAL 260 CO 0.00 -0.34 1.42 -2.65 0.00 0.00 0.00 175.10 173.53 3dft n PRO 261 N 6.10 2.40 0.05 2.72 -0.02 -1.26 -4.83 135.00 140.17 3dft n PRO 261 Ca -0.01 0.85 0.20 0.00 -2.02 0.00 0.00 63.50 62.51 3dft n PRO 261 Cb 0.48 -2.57 0.72 0.00 -0.02 0.00 0.00 33.50 32.11 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 2.63 0.00 0.00 0.52 0.11 -1.96 -1.42 132.00 131.88 3dft h PRO 262 Ca -0.50 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 3dft h PRO 262 Cb 1.26 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.37 3dft h PRO 262 CO 0.63 0.00 -0.02 0.00 -0.21 0.00 0.00 178.00 178.40 3dft h ALA 263 N 1.70 1.20 -2.43 -0.75 0.00 -1.90 -3.42 119.26 113.66 3dft h ALA 263 Ca 0.21 -0.01 -0.53 0.00 0.00 0.00 0.00 54.91 54.57 3dft h ALA 263 Cb 0.93 -0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.74 3dft h ALA 263 CO -0.00 0.02 1.05 0.08 0.00 0.00 0.00 179.25 180.40 3dft s VAL 264 N -4.26 3.01 0.24 0.00 1.01 -0.54 -3.27 120.40 116.59 3dft s VAL 264 Ca -0.04 0.39 -0.06 0.00 0.00 0.00 0.00 61.98 62.26 3dft s VAL 264 Cb 0.13 -3.25 0.20 0.00 0.00 0.00 0.00 36.38 33.47 3dft s VAL 264 CO 0.49 -0.01 1.85 0.74 0.00 0.00 0.00 175.10 178.17 3dft h THR 265 N 4.97 1.25 -2.41 3.92 2.02 -1.66 -3.44 112.91 117.56 3dft h THR 265 Ca -0.44 -0.67 0.08 0.00 0.77 0.00 0.00 66.41 66.16 3dft h THR 265 Cb 1.21 0.12 -0.15 0.00 -1.74 0.00 0.00 68.15 67.59 3dft h THR 265 CO 0.94 0.30 0.43 -0.83 0.37 0.00 0.00 175.52 176.73 3dft s GLY 266 N -3.29 -0.49 -0.22 2.16 0.00 -1.26 -3.64 107.32 100.57 3dft s GLY 266 Ca -0.12 0.93 -0.01 0.00 0.00 0.00 0.00 44.72 45.52 3dft s GLY 266 CO 0.83 0.32 -0.11 0.14 0.00 0.00 0.00 173.10 174.27 3dft s VAL 267 N -3.20 2.60 -0.54 1.40 1.01 0.32 -1.21 120.40 120.78 3dft s VAL 267 Ca 0.04 -0.97 -0.05 0.00 0.00 0.00 0.00 61.98 61.00 3dft s VAL 267 Cb -0.01 -2.25 0.14 0.00 0.00 0.00 0.00 36.38 34.26 3dft s VAL 267 CO -0.09 0.33 0.37 0.42 0.00 0.00 0.00 175.10 176.12 3dft s THR 268 N 1.32 3.80 0.22 3.92 -4.23 0.87 -0.92 115.64 120.62 3dft s THR 268 Ca 0.02 -2.41 -0.32 0.00 -1.18 0.00 0.00 61.69 57.81 3dft s THR 268 Cb -0.15 -3.51 -0.12 0.00 1.34 0.00 0.00 72.50 70.06 3dft s THR 268 CO -0.07 -0.81 1.70 -0.36 -0.54 0.00 0.00 174.62 174.54 3dft s PHE 269 N 0.62 2.88 0.38 3.99 0.08 -0.64 -4.13 117.98 121.17 3dft s PHE 269 Ca 0.12 0.41 -0.24 0.00 0.12 0.00 0.00 56.93 57.34 3dft s PHE 269 Cb -0.22 -4.13 -0.10 0.00 -0.57 0.00 0.00 43.02 38.01 3dft s PHE 269 CO -0.03 -4.20 1.00 -0.48 -0.10 0.00 0.00 175.22 171.40 3dft s LEU 270 N 0.92 4.17 0.32 -0.37 0.05 -0.92 -1.95 118.68 120.90 3dft s LEU 270 Ca 0.73 1.92 0.14 0.00 0.05 0.00 0.00 54.13 56.96 3dft s LEU 270 Cb -0.49 -4.20 0.51 0.00 -2.05 0.00 0.00 46.19 39.96 3dft s LEU 270 CO 0.34 -0.34 1.68 0.77 -0.55 0.00 0.00 176.35 178.25 3dft h SER 271 N 2.60 0.00 -6.52 1.48 4.64 -1.92 -3.42 113.55 110.41 3dft h SER 271 Ca -0.48 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.33 3dft h SER 271 Cb 1.20 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.18 3dft h SER 271 CO 0.63 0.50 -0.81 0.61 -0.87 0.00 0.00 176.83 176.90 3dft n GLY 272 N 0.18 -0.45 2.95 -0.77 0.00 -1.26 -1.56 105.19 104.28 3dft n GLY 272 Ca -0.01 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 -1.57 0.78 3.74 -0.02 0.00 -1.26 -4.92 105.19 101.94 3dft n GLY 273 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.16 1.80 0.86 1.61 -0.21 -0.60 -5.01 119.66 117.95 3dft s GLN 274 Ca 0.00 1.21 -0.12 0.00 0.02 0.00 0.00 55.36 56.47 3dft s GLN 274 Cb 0.00 -1.84 0.11 0.00 1.00 0.00 0.00 33.01 32.27 3dft s GLN 274 CO 0.00 -1.97 1.11 -1.54 -2.12 0.00 0.00 175.29 170.77 3dft s SER 275 N -3.22 3.94 0.12 5.90 1.04 -1.26 -4.43 113.70 115.79 3dft s SER 275 Ca 0.63 1.21 -0.22 0.00 0.48 0.00 0.00 55.95 58.05 3dft s SER 275 Cb -0.19 -1.89 -0.06 0.00 0.10 0.00 0.00 66.02 63.99 3dft s SER 275 CO 0.57 -2.31 1.69 -0.33 0.98 0.00 0.00 173.24 173.84 3dft h GLU 276 N -1.32 -0.12 -0.22 4.02 5.08 -1.84 -1.28 114.58 118.89 3dft h GLU 276 Ca -0.49 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 57.86 3dft h GLU 276 Cb 1.29 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.56 3dft h GLU 276 CO 0.59 -0.08 0.05 0.93 -1.00 0.00 0.00 179.01 179.50 3dft h GLU 277 N -0.12 0.35 -0.33 2.33 4.39 -1.93 -2.68 114.58 116.59 3dft h GLU 277 Ca 0.06 -0.09 0.06 0.00 0.34 0.00 0.00 59.36 59.74 3dft h GLU 277 Cb 0.21 -0.04 -0.05 0.00 -0.10 0.00 0.00 28.75 28.77 3dft h GLU 277 CO -0.16 0.47 0.01 1.49 -1.16 0.00 0.00 179.01 179.66 3dft h GLU 278 N 0.17 0.10 -1.01 2.33 4.57 -1.90 0.11 114.58 118.95 3dft h GLU 278 Ca 0.07 -0.01 0.01 0.00 -1.18 0.00 0.00 59.36 58.25 3dft h GLU 278 Cb 0.28 -0.02 -0.05 0.00 -0.16 0.00 0.00 28.75 28.80 3dft h GLU 278 CO 0.00 0.07 0.67 0.00 -1.18 0.00 0.00 179.01 178.57 3dft h ALA 279 N 1.28 1.28 -0.15 2.92 0.00 -1.22 -1.15 119.26 122.22 3dft h ALA 279 Ca 0.16 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 3dft h ALA 279 Cb 0.21 -0.41 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 3dft h ALA 279 CO -0.26 0.66 -0.24 0.77 0.00 0.00 0.00 179.25 180.18 3dft h SER 280 N 1.36 0.47 -0.70 0.00 0.02 -1.01 -2.04 113.55 111.65 3dft h SER 280 Ca 0.37 -0.53 -0.03 0.00 -0.84 0.00 0.00 61.79 60.76 3dft h SER 280 Cb -0.15 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 62.23 3dft h SER 280 CO -0.08 0.91 0.31 0.40 -1.14 0.00 0.00 176.83 177.22 3dft h ILE 281 N 0.04 1.24 -0.35 3.27 2.04 -0.67 -0.61 117.51 122.48 3dft h ILE 281 Ca 0.01 -0.71 -0.07 0.00 1.00 0.00 0.00 64.86 65.09 3dft h ILE 281 Cb 0.81 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 3dft h ILE 281 CO 0.05 0.29 -0.06 0.78 0.00 0.00 0.00 178.15 179.21 3dft h ASN 282 N 0.98 0.66 -0.76 1.72 2.35 -1.24 -0.94 115.58 118.35 3dft h ASN 282 Ca 0.24 -0.35 -0.03 0.00 -0.55 0.00 0.00 56.30 55.60 3dft h ASN 282 Cb 0.16 -0.18 -0.04 0.00 0.05 0.00 0.00 38.32 38.32 3dft h ASN 282 CO -0.02 0.86 0.36 0.25 -1.65 0.00 0.00 177.43 177.22 3dft h LEU 283 N 0.46 1.00 -0.23 1.61 5.85 -1.18 0.01 115.31 122.82 3dft h LEU 283 Ca 0.09 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 3dft h LEU 283 Cb 0.56 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 3dft h LEU 283 CO 0.03 0.86 0.11 -1.13 -0.34 0.00 0.00 178.44 177.96 3dft h ASN 284 N 1.10 0.31 -0.65 1.25 -1.24 -0.90 -1.91 115.58 113.53 3dft h ASN 284 Ca 0.26 -0.14 -0.04 0.00 0.71 0.00 0.00 56.30 57.10 3dft h ASN 284 Cb 0.13 -0.08 -0.03 0.00 0.73 0.00 0.00 38.32 39.07 3dft h ASN 284 CO -0.03 0.36 0.25 0.00 -1.29 0.00 0.00 177.43 176.72 3dft h ALA 285 N 0.96 1.17 -0.81 1.57 0.00 -0.73 -1.95 119.26 119.48 3dft h ALA 285 Ca 0.08 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 3dft h ALA 285 Cb 0.14 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 3dft h ALA 285 CO -0.01 0.59 0.41 0.82 0.00 0.00 0.00 179.25 181.06 3dft h ILE 286 N 0.98 1.25 0.00 0.00 2.04 -0.75 -1.22 117.51 119.81 3dft h ILE 286 Ca 0.23 -0.66 0.00 0.00 1.00 0.00 0.00 64.86 65.43 3dft h ILE 286 Cb 0.21 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.48 3dft h ILE 286 CO -0.02 0.29 0.00 0.78 0.00 0.00 0.00 178.15 179.20 3dft h ASN 287 N 1.14 0.00 0.39 1.72 2.35 -0.88 -3.01 115.58 117.29 3dft h ASN 287 Ca 0.28 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.03 3dft h ASN 287 Cb 0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.45 3dft h ASN 287 CO -0.04 0.00 -0.70 0.29 -1.65 0.00 0.00 177.43 175.33 3dft n LYS 288 N -2.72 0.06 -1.66 0.81 5.02 -0.78 -4.74 118.16 114.15 3dft n LYS 288 Ca 0.04 0.00 -0.46 0.00 -2.02 0.00 0.00 58.31 55.87 3dft n LYS 288 Cb 0.43 -1.52 -0.04 0.00 -0.02 0.00 0.00 35.03 33.88 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 5.21 0.41 -6.32 0.00 0.11 -1.91 -3.45 132.00 126.05 3dft h PRO 290 Ca -0.45 -0.02 -0.58 0.00 0.11 0.00 0.00 66.00 65.06 3dft h PRO 290 Cb 1.27 -0.09 0.19 0.00 0.11 0.00 0.00 31.00 32.48 3dft h PRO 290 CO 0.83 0.27 -0.85 1.28 -0.21 0.00 0.00 178.00 179.32 3dft n LEU 291 N -5.01 -1.61 -4.70 2.35 4.77 -1.26 -4.90 117.00 106.63 3dft n LEU 291 Ca 0.11 0.58 -0.42 0.00 -0.03 0.00 0.00 56.01 56.25 3dft n LEU 291 Cb 0.34 -1.02 -0.03 0.00 -2.33 0.00 0.00 43.42 40.38 3dft n LEU 291 CO 0.20 -4.06 0.72 -0.22 -1.33 0.00 0.00 177.39 172.70 3dft s LEU 292 N 2.80 4.34 -0.29 2.23 2.96 -1.26 -5.03 118.68 124.42 3dft s LEU 292 Ca 0.60 1.65 0.03 0.00 -0.22 0.00 0.00 54.13 56.19 3dft s LEU 292 Cb -0.39 -3.57 0.08 0.00 0.50 0.00 0.00 46.19 42.81 3dft s LEU 292 CO 0.63 -0.32 -0.04 -0.54 -1.32 0.00 0.00 176.35 174.76 3dft s LYS 293 N 1.30 1.86 0.00 1.98 3.01 -1.26 -4.98 119.74 121.64 3dft s LYS 293 Ca 0.51 -1.55 0.06 0.00 -1.01 0.00 0.00 55.97 53.99 3dft s LYS 293 Cb -0.21 -2.99 0.37 0.00 -1.01 0.00 0.00 37.83 33.99 3dft s LYS 293 CO 0.25 -0.74 0.89 -0.35 0.51 0.00 0.00 175.35 175.92 3dft n PRO 294 N 4.37 0.58 -4.04 -1.68 -0.04 -1.26 -4.77 135.00 128.17 3dft n PRO 294 Ca -0.06 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.32 3dft n PRO 294 Cb 0.42 -1.17 -0.10 0.00 -0.04 0.00 0.00 33.50 32.61 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 0.41 0.36 0.54 0.51 -1.26 -4.90 118.94 112.60 3dft s TRP 295 Ca 0.09 -0.86 -0.28 0.00 -2.12 0.00 0.00 56.10 52.94 3dft s TRP 295 Cb 0.04 -0.30 -0.10 0.00 -0.81 0.00 0.00 33.47 32.30 3dft s TRP 295 CO 0.07 -0.33 1.34 0.00 -0.51 0.00 0.00 176.95 177.52 3dft s ALA 296 N -3.15 3.44 -0.35 0.98 0.00 -1.24 -4.85 121.76 116.60 3dft s ALA 296 Ca -0.00 1.32 0.04 0.00 0.00 0.00 0.00 51.96 53.31 3dft s ALA 296 Cb 0.02 -3.51 0.10 0.00 0.00 0.00 0.00 23.12 19.74 3dft s ALA 296 CO -0.07 -0.78 0.07 -0.51 0.00 0.00 0.00 175.76 174.47 3dft s LEU 297 N -2.04 4.64 0.00 0.00 1.43 -1.26 -0.52 118.68 120.92 3dft s LEU 297 Ca 0.52 -2.20 0.00 0.00 -1.03 0.00 0.00 54.13 51.42 3dft s LEU 297 Cb -0.41 -1.60 0.00 0.00 0.03 0.00 0.00 46.19 44.21 3dft s LEU 297 CO 0.54 -0.37 0.00 1.07 0.23 0.00 0.00 176.35 177.82 3dft n THR 298 N 4.20 0.00 -4.46 5.49 5.66 -0.10 -4.69 114.28 120.37 3dft n THR 298 Ca 0.04 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 60.79 3dft n THR 298 Cb 0.41 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.09 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 0.32 2.29 -0.44 1.09 -0.71 -1.26 -1.62 117.98 117.64 3dft s PHE 299 Ca 0.00 -0.34 0.07 0.00 -1.04 0.00 0.00 56.93 55.62 3dft s PHE 299 Cb 0.00 -1.02 0.23 0.00 -1.21 0.00 0.00 43.02 41.02 3dft s PHE 299 CO 0.00 0.67 0.64 0.45 -1.34 0.00 0.00 175.22 175.64 3dft n SER 300 N -0.45 -1.38 -4.88 1.98 2.88 -0.82 0.31 113.62 111.27 3dft n SER 300 Ca -0.06 -2.86 -0.34 0.00 -1.33 0.00 0.00 58.87 54.27 3dft n SER 300 Cb 0.59 0.47 -0.05 0.00 -0.75 0.00 0.00 64.21 64.47 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 -0.12 3.55 0.00 0.66 2.02 -0.86 -3.96 117.35 118.64 3dft s TYR 301 Ca 0.33 0.73 0.00 0.00 -0.37 0.00 0.00 57.07 57.76 3dft s TYR 301 Cb 0.15 -2.12 0.00 0.00 -0.40 0.00 0.00 41.96 39.59 3dft s TYR 301 CO -0.16 0.49 0.00 0.41 -1.57 0.00 0.00 175.55 174.72 3dft n GLY 302 N 0.68 -0.01 0.27 0.71 0.00 -1.26 -0.40 105.19 105.18 3dft n GLY 302 Ca -0.06 0.00 0.14 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 -1.92 -1.22 114.38 115.93 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 0.09 0.00 0.00 -1.07 0.00 0.00 179.97 178.99 3dft n ALA 304 N -2.29 1.27 -0.00 0.04 0.00 -1.26 -0.30 120.51 117.96 3dft n ALA 304 Ca -0.02 0.06 0.01 0.00 0.00 0.00 0.00 53.44 53.48 3dft n ALA 304 Cb 0.20 -1.20 -0.01 0.00 0.00 0.00 0.00 19.45 18.43 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 -1.84 0.00 -0.00 0.00 4.77 -0.53 -4.52 117.00 114.87 3dft n LEU 305 Ca 0.01 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.07 3dft n LEU 305 Cb 0.09 0.01 -0.11 0.00 -2.33 0.00 0.00 43.42 41.07 3dft n LEU 305 CO 0.09 0.01 -0.47 0.00 -1.33 0.00 0.00 177.39 175.69 3dft n GLN 306 N -1.68 0.94 0.00 3.23 6.02 -0.76 -4.54 117.38 120.59 3dft n GLN 306 Ca -0.01 -0.10 0.00 0.00 -0.01 0.00 0.00 57.00 56.88 3dft n GLN 306 Cb 0.16 -1.34 0.00 0.00 1.02 0.00 0.00 30.24 30.09 3dft n GLN 306 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3dft n ALA 307 N -1.83 -0.06 0.12 -1.58 0.00 0.58 -0.56 120.51 117.19 3dft n ALA 307 Ca -0.01 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.47 3dft n ALA 307 Cb 0.36 0.41 0.47 0.00 0.00 0.00 0.00 19.45 20.69 3dft n ALA 307 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3dft h SER 308 N 0.00 0.24 -0.03 0.00 0.02 -1.87 -2.64 113.55 109.27 3dft h SER 308 Ca 0.00 -0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 60.92 3dft h SER 308 Cb 0.00 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 62.48 3dft h SER 308 CO 0.00 0.26 0.00 0.00 -1.14 0.00 0.00 176.83 175.95 3dft h ALA 309 N 1.78 0.04 -0.71 3.77 0.00 -1.65 -0.48 119.26 122.01 3dft h ALA 309 Ca 0.07 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 54.88 3dft h ALA 309 Cb 0.13 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.85 3dft h ALA 309 CO -0.00 -0.31 0.41 1.25 0.00 0.00 0.00 179.25 180.60 3dft h LEU 310 N -0.23 0.62 -0.39 0.00 5.85 -0.63 -0.91 115.31 119.63 3dft h LEU 310 Ca 0.01 0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.65 3dft h LEU 310 Cb 0.30 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 3dft h LEU 310 CO 0.00 0.40 -0.17 0.50 -0.34 0.00 0.00 178.44 178.83 3dft h LYS 311 N 0.76 0.81 -0.17 1.25 3.64 -1.39 -1.23 116.57 120.23 3dft h LYS 311 Ca 0.31 -0.35 -0.07 0.00 -1.27 0.00 0.00 60.65 59.28 3dft h LYS 311 Cb 0.17 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 3dft h LYS 311 CO -0.17 0.97 -0.20 0.00 -2.27 0.00 0.00 179.45 177.78 3dft h ALA 312 N 0.82 1.35 -0.06 5.00 0.00 -0.77 -2.98 119.26 122.62 3dft h ALA 312 Ca 0.09 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 3dft h ALA 312 Cb 0.72 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.41 3dft h ALA 312 CO 0.05 0.44 -0.12 2.35 0.00 0.00 0.00 179.25 181.98 3dft h TRP 313 N 0.27 0.24 -1.55 0.00 7.01 -0.99 -3.41 115.95 117.51 3dft h TRP 313 Ca 0.05 -0.08 -0.17 0.00 2.11 0.00 0.00 58.89 60.79 3dft h TRP 313 Cb 0.51 -0.04 -0.07 0.00 -2.10 0.00 0.00 29.16 27.45 3dft h TRP 313 CO 0.01 0.70 -0.16 0.41 -2.79 0.00 0.00 178.44 176.62 3dft n GLY 314 N 0.41 0.81 2.40 2.65 0.00 -0.48 0.28 105.19 111.26 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 -0.15 1.01 3.56 -0.02 0.00 -1.26 -4.88 105.19 103.46 3dft n GLY 315 Ca -0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.20 3.63 0.63 1.61 -0.14 0.14 -4.92 119.74 120.50 3dft s LYS 316 Ca 0.00 0.01 0.38 0.00 -1.36 0.00 0.00 55.97 55.00 3dft s LYS 316 Cb 0.00 -3.83 2.15 0.00 -1.68 0.00 0.00 37.83 34.48 3dft s LYS 316 CO 0.00 -0.78 2.32 0.87 -0.76 0.00 0.00 175.35 177.00 3dft h LYS 317 N 8.52 0.00 0.00 1.68 1.57 -1.95 0.42 116.57 126.81 3dft h LYS 317 Ca -0.26 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.48 3dft h LYS 317 Cb 1.11 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.41 3dft h LYS 317 CO 0.85 0.00 -0.19 0.93 -0.57 0.00 0.00 179.45 180.47 3dft h GLU 318 N 0.00 0.00 -0.12 3.15 3.07 -1.92 -2.73 114.58 116.04 3dft h GLU 318 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3dft h GLU 318 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3dft h GLU 318 CO 0.00 0.19 0.00 0.09 -1.40 0.00 0.00 179.01 177.89 3dft n ASN 319 N -3.33 1.49 -0.40 1.42 5.03 0.14 -4.50 115.26 115.11 3dft n ASN 319 Ca 0.00 -1.63 -0.05 0.00 0.87 0.00 0.00 54.58 53.77 3dft n ASN 319 Cb 0.42 -0.07 -0.02 0.00 -1.02 0.00 0.00 39.78 39.09 3dft n ASN 319 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.26 175.68 3dft h LEU 320 N 2.06 -1.74 -0.65 3.41 5.85 -1.53 0.21 115.31 122.92 3dft h LEU 320 Ca 0.00 0.32 -0.01 0.00 0.84 0.00 0.00 57.88 59.03 3dft h LEU 320 Cb 0.45 0.84 -0.03 0.00 0.37 0.00 0.00 40.66 42.29 3dft h LEU 320 CO 0.00 -0.26 0.35 0.50 -0.34 0.00 0.00 178.44 178.69 3dft h LYS 321 N -0.00 0.91 -0.38 1.25 1.63 -1.86 -1.05 116.57 117.07 3dft h LYS 321 Ca 0.27 -0.11 -0.05 0.00 -0.85 0.00 0.00 60.65 59.91 3dft h LYS 321 Cb 0.52 -0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 31.96 3dft h LYS 321 CO -0.97 0.69 0.05 0.00 -3.45 0.00 0.00 179.45 175.78 3dft h ALA 322 N 1.17 0.51 -0.09 5.00 0.00 -1.46 -1.79 119.26 122.60 3dft h ALA 322 Ca 0.23 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 3dft h ALA 322 Cb 0.05 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 3dft h ALA 322 CO -0.04 0.23 0.05 0.00 0.00 0.00 0.00 179.25 179.50 3dft h ALA 323 N 0.91 0.12 -0.55 0.00 0.00 -0.47 -2.64 119.26 116.63 3dft h ALA 323 Ca 0.12 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3dft h ALA 323 Cb 0.38 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 3dft h ALA 323 CO 0.01 -0.37 0.32 1.96 0.00 0.00 0.00 179.25 181.17 3dft h GLN 324 N 0.08 0.75 -0.89 0.00 4.20 -1.14 -2.18 115.11 115.93 3dft h GLN 324 Ca 0.03 -0.07 0.03 0.00 0.06 0.00 0.00 58.65 58.70 3dft h GLN 324 Cb 0.04 -0.16 -0.05 0.00 0.30 0.00 0.00 27.48 27.61 3dft h GLN 324 CO -0.01 0.54 0.59 1.49 -0.67 0.00 0.00 178.83 180.77 3dft h GLU 325 N 0.76 1.12 -0.29 1.46 4.57 -0.97 0.36 114.58 121.59 3dft h GLU 325 Ca 0.20 -0.07 -0.05 0.00 -1.18 0.00 0.00 59.36 58.26 3dft h GLU 325 Cb -0.01 -0.25 -0.01 0.00 -0.16 0.00 0.00 28.75 28.32 3dft h GLU 325 CO -0.04 0.74 -0.02 0.93 -1.18 0.00 0.00 179.01 179.44 3dft h GLU 326 N 1.15 0.54 -0.28 1.92 4.39 -1.15 -1.81 114.58 119.34 3dft h GLU 326 Ca 0.35 -0.18 0.00 0.00 0.34 0.00 0.00 59.36 59.87 3dft h GLU 326 Cb -0.03 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.56 3dft h GLU 326 CO -0.09 0.70 0.18 -0.92 -1.16 0.00 0.00 179.01 177.72 3dft h TYR 327 N 0.32 0.35 -0.79 4.33 3.20 -1.21 -2.54 116.97 120.64 3dft h TYR 327 Ca 0.08 0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.03 3dft h TYR 327 Cb 0.47 -0.12 -0.06 0.00 1.54 0.00 0.00 36.73 38.56 3dft h TYR 327 CO 0.04 0.23 0.46 0.28 -1.64 0.00 0.00 178.16 177.53 3dft h VAL 328 N 0.37 0.96 -0.52 1.81 2.07 -0.86 -0.75 116.25 119.34 3dft h VAL 328 Ca 0.10 -0.28 -0.03 0.00 0.82 0.00 0.00 66.70 67.31 3dft h VAL 328 Cb -0.03 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 29.80 3dft h VAL 328 CO -0.02 0.15 0.18 0.11 0.02 0.00 0.00 177.57 178.01 3dft h LYS 329 N 0.81 0.76 0.04 1.57 1.57 -0.97 -0.98 116.57 119.36 3dft h LYS 329 Ca 0.36 -0.12 -0.23 0.00 -1.87 0.00 0.00 60.65 58.80 3dft h LYS 329 Cb 0.26 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.43 3dft h LYS 329 CO -0.21 0.64 -1.00 0.00 -0.57 0.00 0.00 179.45 178.32 3dft h ARG 330 N 0.75 0.26 -0.63 3.15 2.47 -0.97 -0.86 114.38 118.55 3dft h ARG 330 Ca 0.18 -0.32 -0.04 0.00 -1.26 0.00 0.00 59.98 58.54 3dft h ARG 330 Cb 0.18 0.10 -0.03 0.00 -1.65 0.00 0.00 29.97 28.58 3dft h ARG 330 CO -0.01 1.06 0.24 0.00 0.56 0.00 0.00 179.97 181.82 3dft h ALA 331 N 0.81 0.82 -0.36 0.04 0.00 -0.85 -0.17 119.26 119.55 3dft h ALA 331 Ca -0.07 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 3dft h ALA 331 Cb 1.66 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.20 3dft h ALA 331 CO 0.16 0.44 -0.04 -0.07 0.00 0.00 0.00 179.25 179.74 3dft h LEU 332 N 0.88 0.66 -0.36 0.00 3.38 -1.15 -1.23 115.31 117.49 3dft h LEU 332 Ca 0.21 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.85 3dft h LEU 332 Cb 0.22 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 3dft h LEU 332 CO -0.02 0.84 0.24 0.00 0.09 0.00 0.00 178.44 179.59 3dft h ALA 333 N 0.84 0.45 0.00 1.53 0.00 -0.86 -2.37 119.26 118.85 3dft h ALA 333 Ca 0.10 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 3dft h ALA 333 Cb 0.52 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3dft h ALA 333 CO 0.03 -0.09 -0.28 -0.91 0.00 0.00 0.00 179.25 178.00 3dft h ASN 334 N 0.48 0.00 -0.52 0.00 2.35 -0.99 -0.80 115.58 116.10 3dft h ASN 334 Ca 0.13 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.78 3dft h ASN 334 Cb -0.05 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 3dft h ASN 334 CO -0.03 0.28 -0.08 -1.28 -1.65 0.00 0.00 177.43 174.67 3dft h SER 335 N 0.00 0.97 -0.13 5.81 0.87 -0.87 -0.56 113.55 119.63 3dft h SER 335 Ca -0.00 -0.34 -0.18 0.00 -1.23 0.00 0.00 61.79 60.04 3dft h SER 335 Cb 0.90 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 62.60 3dft h SER 335 CO 0.04 1.08 -0.57 -0.07 -0.53 0.00 0.00 176.83 176.77 3dft h LEU 336 N 0.84 0.82 -0.48 2.23 3.38 -1.22 -3.20 115.31 117.68 3dft h LEU 336 Ca 0.14 -0.45 0.03 0.00 0.09 0.00 0.00 57.88 57.68 3dft h LEU 336 Cb 0.63 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.11 3dft h LEU 336 CO 0.04 1.22 0.27 0.00 0.09 0.00 0.00 178.44 180.06 3dft h ALA 337 N 0.79 0.62 0.00 1.53 0.00 -0.79 -0.32 119.26 121.09 3dft h ALA 337 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3dft h ALA 337 Cb 1.16 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.83 3dft h ALA 337 CO 0.12 -0.04 0.00 0.00 0.00 0.00 0.00 179.25 179.32 3dft n GLN 339 N -0.52 0.44 -3.05 0.00 6.02 -0.42 -4.64 117.38 115.20 3dft n GLN 339 Ca 0.01 -0.64 -0.18 0.00 -0.01 0.00 0.00 57.00 56.17 3dft n GLN 339 Cb 0.00 -0.79 0.04 0.00 1.02 0.00 0.00 30.24 30.51 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 -0.13 -0.27 0.61 1.08 0.00 -0.03 -4.92 105.19 101.53 3dft n GLY 340 Ca 0.00 -0.01 0.05 0.00 0.00 0.00 0.00 46.02 46.06 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 -3.64 0.69 -3.84 1.61 5.02 -0.27 -4.89 118.16 112.83 3dft n LYS 341 Ca -0.06 -2.13 -0.36 0.00 -2.02 0.00 0.00 58.31 53.75 3dft n LYS 341 Cb 0.58 -0.90 -0.08 0.00 -0.02 0.00 0.00 35.03 34.61 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 -1.47 3.44 -0.08 2.13 5.04 -1.24 -4.80 117.35 120.36 3dft s TYR 342 Ca 0.24 0.35 -0.02 0.00 -2.44 0.00 0.00 57.07 55.19 3dft s TYR 342 Cb 0.24 -2.07 0.04 0.00 0.35 0.00 0.00 41.96 40.52 3dft s TYR 342 CO -0.04 0.42 0.05 0.95 -1.34 0.00 0.00 175.55 175.59 3dft s THR 343 N -0.12 0.01 0.50 4.34 -4.23 -1.26 -4.95 115.64 109.93 3dft s THR 343 Ca 0.10 0.22 0.31 0.00 -1.18 0.00 0.00 61.69 61.14 3dft s THR 343 Cb -0.12 -0.34 0.51 0.00 1.34 0.00 0.00 72.50 73.89 3dft s THR 343 CO 0.00 0.09 1.78 -0.65 -0.54 0.00 0.00 174.62 175.31 3dft h PRO 344 N 8.41 0.11 0.00 3.99 0.11 -1.99 -3.54 132.00 139.09 3dft h PRO 344 Ca -0.14 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.96 3dft h PRO 344 Cb 1.13 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3dft h PRO 344 CO 0.20 0.08 -0.02 0.45 -0.21 0.00 0.00 178.00 178.50 3dft n SER 345 N -4.33 0.09 0.00 -2.05 2.88 -1.26 -5.27 113.62 103.69 3dft n SER 345 Ca 0.26 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.80 3dft n SER 345 Cb 1.16 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.62 3dft n SER 345 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 3dft n SER 359 N -1.09 0.00 -0.13 -3.46 2.88 -1.26 -5.26 113.62 105.31 3dft n SER 359 Ca 0.00 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.65 3dft n SER 359 Cb 0.01 0.00 0.06 0.00 -0.75 0.00 0.00 64.21 63.53 3dft n SER 359 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 3dft n ASN 360 N 0.00 1.07 0.05 -3.46 6.94 -1.26 -3.97 115.26 114.64 3dft n ASN 360 Ca 0.00 -0.89 0.08 0.00 -0.02 0.00 0.00 54.58 53.75 3dft n ASN 360 Cb 0.00 0.60 0.37 0.00 -2.36 0.00 0.00 39.78 38.39 3dft n ASN 360 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 3dft n HIS 361 N -1.11 0.32 1.94 -2.53 8.25 -1.26 -1.68 115.22 119.15 3dft n HIS 361 Ca 0.06 0.13 0.12 0.00 -0.26 0.00 0.00 57.72 57.78 3dft n HIS 361 Cb 0.36 -0.71 0.71 0.00 1.12 0.00 0.00 29.99 31.47 3dft n HIS 361 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3dft n ALA 362 N -1.61 2.64 0.26 -1.41 0.00 -1.25 -5.30 120.51 113.83 3dft n ALA 362 Ca 0.03 -0.19 0.03 0.00 0.00 0.00 0.00 53.44 53.31 3dft n ALA 362 Cb 0.18 -1.38 0.03 0.00 0.00 0.00 0.00 19.45 18.27 3dft n ALA 362 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16