#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dfq s HIS 2 N 0.00 2.57 0.02 0.54 3.76 -1.26 -5.12 115.29 115.81 3dfq s HIS 2 Ca 0.00 -0.45 -0.20 0.00 -0.15 0.00 0.00 55.06 54.26 3dfq s HIS 2 Cb 0.00 -1.63 -0.06 0.00 1.11 0.00 0.00 32.58 32.00 3dfq s HIS 2 CO 0.00 -0.03 0.59 0.45 -0.85 0.00 0.00 174.74 174.90 3dfq s SER 3 N -0.38 7.01 -0.47 1.40 0.15 -1.26 -5.01 113.70 115.14 3dfq s SER 3 Ca 0.03 1.20 0.05 0.00 0.70 0.00 0.00 55.95 57.93 3dfq s SER 3 Cb -0.12 -2.37 0.19 0.00 -1.71 0.00 0.00 66.02 62.02 3dfq s SER 3 CO 0.02 0.15 0.43 1.41 1.20 0.00 0.00 173.24 176.46 3dfq n HIS 4 N 2.42 0.18 -0.56 3.44 8.25 -1.26 -5.10 115.22 122.59 3dfq n HIS 4 Ca -0.08 -3.58 -0.24 0.00 -0.26 0.00 0.00 57.72 53.56 3dfq n HIS 4 Cb 0.51 -0.07 -0.04 0.00 1.12 0.00 0.00 29.99 31.50 3dfq n HIS 4 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 3dfq n PRO 5 N 2.24 0.00 0.12 -0.41 -0.02 -1.26 -4.85 135.00 130.82 3dfq n PRO 5 Ca 0.26 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.74 3dfq n PRO 5 Cb 0.47 -0.58 0.07 0.00 -0.02 0.00 0.00 33.50 33.43 3dfq n PRO 5 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dfq h ALA 6 N 2.82 0.68 -3.54 3.55 0.00 -1.99 -3.45 119.26 117.33 3dfq h ALA 6 Ca -0.09 -0.59 -0.34 0.00 0.00 0.00 0.00 54.91 53.89 3dfq h ALA 6 Cb 0.54 -0.10 -0.24 0.00 0.00 0.00 0.00 17.79 17.98 3dfq h ALA 6 CO 0.40 0.81 -0.76 -0.51 0.00 0.00 0.00 179.25 179.19 3dfq s LEU 7 N -6.82 2.17 0.71 0.00 1.43 -1.26 -4.95 118.68 109.96 3dfq s LEU 7 Ca 0.02 -0.40 -0.07 0.00 -1.03 0.00 0.00 54.13 52.64 3dfq s LEU 7 Cb 0.10 -0.32 0.06 0.00 0.03 0.00 0.00 46.19 46.06 3dfq s LEU 7 CO 0.76 -0.06 1.03 0.42 0.23 0.00 0.00 176.35 178.73 3dfq s THR 8 N -0.89 2.30 0.29 5.49 -4.23 -1.26 -4.87 115.64 112.46 3dfq s THR 8 Ca -0.03 -0.22 -0.02 0.00 -1.18 0.00 0.00 61.69 60.24 3dfq s THR 8 Cb -0.07 -3.02 0.21 0.00 1.34 0.00 0.00 72.50 70.96 3dfq s THR 8 CO 0.01 -0.02 1.90 -0.65 -0.54 0.00 0.00 174.62 175.31 3dfq h PRO 9 N -0.64 0.99 -0.58 3.99 0.11 -2.01 -1.16 132.00 132.69 3dfq h PRO 9 Ca -0.45 -0.12 -0.07 0.00 0.11 0.00 0.00 66.00 65.47 3dfq h PRO 9 Cb 1.32 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 3dfq h PRO 9 CO 0.61 0.75 0.10 0.93 -0.21 0.00 0.00 178.00 180.18 3dfq h GLU 10 N 0.99 0.96 -0.65 1.05 3.07 -1.99 -0.24 114.58 117.77 3dfq h GLU 10 Ca 0.25 -0.25 -0.07 0.00 -0.50 0.00 0.00 59.36 58.79 3dfq h GLU 10 Cb 0.07 -0.11 -0.03 0.00 -0.84 0.00 0.00 28.75 27.84 3dfq h GLU 10 CO -0.03 0.91 0.14 1.96 -1.40 0.00 0.00 179.01 180.58 3dfq h GLN 11 N 0.86 1.05 -0.59 2.33 4.20 -1.83 -1.84 115.11 119.28 3dfq h GLN 11 Ca 0.18 -0.26 -0.07 0.00 0.06 0.00 0.00 58.65 58.56 3dfq h GLN 11 Cb 0.41 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 3dfq h GLN 11 CO 0.01 0.95 0.10 0.87 -0.67 0.00 0.00 178.83 180.09 3dfq h LYS 12 N 0.97 0.97 -0.69 1.46 1.57 -0.96 -2.34 116.57 117.56 3dfq h LYS 12 Ca 0.20 -0.26 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 3dfq h LYS 12 Cb 0.38 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.54 3dfq h LYS 12 CO 0.01 0.92 0.36 -0.22 -0.57 0.00 0.00 179.45 179.94 3dfq h LYS 13 N 0.88 0.98 -0.34 3.15 3.64 -0.82 -0.10 116.57 123.95 3dfq h LYS 13 Ca 0.18 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 3dfq h LYS 13 Cb 0.41 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.03 3dfq h LYS 13 CO 0.01 0.75 0.18 1.49 -2.27 0.00 0.00 179.45 179.61 3dfq h GLU 14 N 0.95 0.47 -0.41 1.90 4.81 -1.15 -0.46 114.58 120.70 3dfq h GLU 14 Ca 0.24 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.34 3dfq h GLU 14 Cb 0.07 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 3dfq h GLU 14 CO -0.04 0.41 -0.02 -0.07 -0.73 0.00 0.00 179.01 178.56 3dfq h LEU 15 N 0.42 0.73 -0.50 1.64 3.38 -1.21 -2.04 115.31 117.73 3dfq h LEU 15 Ca 0.12 -0.32 -0.03 0.00 0.09 0.00 0.00 57.88 57.73 3dfq h LEU 15 Cb 0.07 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 3dfq h LEU 15 CO -0.02 0.88 0.18 -1.28 0.09 0.00 0.00 178.44 178.29 3dfq h SER 16 N 0.57 0.71 -0.66 -0.43 0.87 -0.89 -1.13 113.55 112.61 3dfq h SER 16 Ca 0.12 -0.19 -0.01 0.00 -1.23 0.00 0.00 61.79 60.48 3dfq h SER 16 Cb 0.51 -0.19 -0.03 0.00 -0.44 0.00 0.00 62.40 62.25 3dfq h SER 16 CO 0.03 0.71 0.39 0.44 -0.53 0.00 0.00 176.83 177.86 3dfq h ASP 17 N 0.68 0.80 0.10 6.23 3.32 -1.01 -1.35 116.42 125.19 3dfq h ASP 17 Ca 0.17 -0.07 -0.00 0.00 0.02 0.00 0.00 57.03 57.14 3dfq h ASP 17 Cb 0.23 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.58 3dfq h ASP 17 CO -0.01 0.64 -0.05 0.40 -1.72 0.00 0.00 179.24 178.50 3dfq h ILE 18 N 0.90 0.95 -0.79 0.35 2.04 -1.16 -1.89 117.51 117.91 3dfq h ILE 18 Ca 0.24 -0.15 0.09 0.00 1.00 0.00 0.00 64.86 66.03 3dfq h ILE 18 Cb -0.01 1.05 -0.07 0.00 -0.74 0.00 0.00 36.82 37.05 3dfq h ILE 18 CO -0.04 0.04 0.45 0.00 0.00 0.00 0.00 178.15 178.59 3dfq h ALA 19 N 0.70 1.11 -0.22 1.87 0.00 -0.97 -2.16 119.26 119.58 3dfq h ALA 19 Ca -0.01 0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 3dfq h ALA 19 Cb 0.16 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3dfq h ALA 19 CO 0.02 0.09 -0.36 0.45 0.00 0.00 0.00 179.25 179.45 3dfq h HIS 20 N 0.77 0.57 -0.58 0.00 3.86 -1.11 -3.07 115.15 115.59 3dfq h HIS 20 Ca 0.37 -0.15 -0.09 0.00 -1.16 0.00 0.00 60.37 59.35 3dfq h HIS 20 Cb 0.32 -0.13 -0.02 0.00 1.06 0.00 0.00 27.41 28.63 3dfq h HIS 20 CO -0.07 0.79 0.03 0.00 0.86 0.00 0.00 177.93 179.54 3dfq h ARG 21 N 0.41 0.99 -0.82 2.45 3.08 -0.72 -1.44 114.38 118.33 3dfq h ARG 21 Ca 0.04 -0.29 -0.01 0.00 0.07 0.00 0.00 59.98 59.80 3dfq h ARG 21 Cb 0.83 -0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.73 3dfq h ARG 21 CO 0.07 0.96 0.47 0.82 -1.07 0.00 0.00 179.97 181.22 3dfq h ILE 22 N 0.92 1.24 -0.45 2.04 2.04 -1.35 -3.11 117.51 118.83 3dfq h ILE 22 Ca 0.17 -0.55 -0.18 0.00 1.00 0.00 0.00 64.86 65.30 3dfq h ILE 22 Cb 0.50 0.11 -0.10 0.00 -0.74 0.00 0.00 36.82 36.58 3dfq h ILE 22 CO 0.02 0.26 0.08 1.33 0.00 0.00 0.00 178.15 179.84 3dfq n VAL 23 N -4.42 2.61 -1.52 1.67 0.24 -1.15 -4.16 118.33 111.60 3dfq n VAL 23 Ca 0.08 -2.26 -0.37 0.00 -2.04 0.00 0.00 64.34 59.75 3dfq n VAL 23 Cb 0.08 -0.33 0.07 0.00 -1.47 0.00 0.00 33.84 32.19 3dfq n VAL 23 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3dfq n ALA 24 N -0.83 0.12 -1.64 2.33 0.00 -0.56 -4.72 120.51 115.21 3dfq n ALA 24 Ca 0.34 -0.09 -0.63 0.00 0.00 0.00 0.00 53.44 53.06 3dfq n ALA 24 Cb 1.12 -2.14 -0.09 0.00 0.00 0.00 0.00 19.45 18.34 3dfq n ALA 24 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3dfq n PRO 25 N -1.53 0.06 -0.36 0.00 -0.02 -1.26 -0.65 135.00 131.22 3dfq n PRO 25 Ca 0.14 0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.64 3dfq n PRO 25 Cb 0.48 -1.53 0.00 0.00 -0.02 0.00 0.00 33.50 32.44 3dfq n PRO 25 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dfq n GLY 26 N 2.88 1.55 3.73 -1.23 0.00 -1.26 -5.04 105.19 105.82 3dfq n GLY 26 Ca 0.26 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.98 3dfq n GLY 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dfq s LYS 27 N -0.26 2.69 0.00 1.61 1.02 0.17 -4.33 119.74 120.64 3dfq s LYS 27 Ca 0.00 -0.80 0.00 0.00 0.02 0.00 0.00 55.97 55.19 3dfq s LYS 27 Cb 0.00 -2.61 0.00 0.00 -0.52 0.00 0.00 37.83 34.70 3dfq s LYS 27 CO 0.00 0.54 0.00 0.41 -0.92 0.00 0.00 175.35 175.38 3dfq n GLY 28 N 0.43 4.18 3.33 -3.33 0.00 0.27 -4.61 105.19 105.46 3dfq n GLY 28 Ca -0.10 -1.66 -0.32 0.00 0.00 0.00 0.00 46.02 43.95 3dfq n GLY 28 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dfq s ILE 29 N -1.84 2.37 -0.34 -0.61 1.01 0.13 -0.24 121.20 121.68 3dfq s ILE 29 Ca 0.00 -0.96 -0.17 0.00 0.00 0.00 0.00 60.65 59.52 3dfq s ILE 29 Cb 0.00 -1.88 -0.01 0.00 0.01 0.00 0.00 42.46 40.58 3dfq s ILE 29 CO 0.00 0.57 0.44 -0.22 0.00 0.00 0.00 174.94 175.73 3dfq s LEU 30 N -0.35 4.38 -0.62 2.97 2.96 -0.34 -2.14 118.68 125.53 3dfq s LEU 30 Ca 0.02 -0.10 -0.19 0.00 -0.22 0.00 0.00 54.13 53.64 3dfq s LEU 30 Cb -0.12 -2.47 0.10 0.00 0.50 0.00 0.00 46.19 44.21 3dfq s LEU 30 CO 0.02 -0.40 0.76 0.00 -1.32 0.00 0.00 176.35 175.41 3dfq s ALA 31 N 2.20 3.40 -0.22 5.97 0.00 0.28 -1.02 121.76 132.37 3dfq s ALA 31 Ca 0.15 -2.25 0.12 0.00 0.00 0.00 0.00 51.96 49.98 3dfq s ALA 31 Cb -0.16 -3.59 0.44 0.00 0.00 0.00 0.00 23.12 19.81 3dfq s ALA 31 CO 0.12 -2.43 1.20 0.00 0.00 0.00 0.00 175.76 174.65 3dfq n ALA 32 N 6.43 3.94 -0.36 0.00 0.00 -0.79 -4.12 120.51 125.62 3dfq n ALA 32 Ca -0.07 -3.36 -0.10 0.00 0.00 0.00 0.00 53.44 49.92 3dfq n ALA 32 Cb 0.43 -0.40 0.16 0.00 0.00 0.00 0.00 19.45 19.64 3dfq n ALA 32 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3dfq n SER 33 N -0.82 3.64 -4.74 0.00 3.41 -1.01 -4.24 113.62 109.85 3dfq n SER 33 Ca 0.25 -2.90 -0.41 0.00 -0.26 0.00 0.00 58.87 55.55 3dfq n SER 33 Cb 0.83 -0.69 -0.02 0.00 -0.26 0.00 0.00 64.21 64.06 3dfq n SER 33 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3dfq s GLU 34 N -2.11 4.24 1.01 4.33 8.01 -1.26 -4.48 118.70 128.43 3dfq s GLU 34 Ca 0.36 2.35 -0.16 0.00 0.01 0.00 0.00 54.97 57.53 3dfq s GLU 34 Cb 0.29 -3.10 0.20 0.00 -4.31 0.00 0.00 34.13 27.22 3dfq s GLU 34 CO 0.08 -0.47 1.21 -1.54 0.01 0.00 0.00 175.26 174.55 3dfq s SER 35 N 0.47 2.69 0.11 -0.19 1.04 -1.26 -4.66 113.70 111.89 3dfq s SER 35 Ca 0.61 0.56 -0.23 0.00 0.48 0.00 0.00 55.95 57.38 3dfq s SER 35 Cb -0.43 -0.82 -0.10 0.00 0.10 0.00 0.00 66.02 64.77 3dfq s SER 35 CO 0.43 -3.02 1.71 0.74 0.98 0.00 0.00 173.24 174.08 3dfq h THR 36 N -1.83 0.84 -0.46 2.02 2.02 -1.96 0.42 112.91 113.96 3dfq h THR 36 Ca -0.46 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 66.68 3dfq h THR 36 Cb 1.28 0.84 -0.02 0.00 -1.74 0.00 0.00 68.15 68.51 3dfq h THR 36 CO 0.44 0.00 0.14 1.23 0.37 0.00 0.00 175.52 177.70 3dfq h GLY 37 N -0.09 0.73 1.16 2.16 0.00 -2.00 -1.48 103.07 103.54 3dfq h GLY 37 Ca 0.03 -0.38 -0.25 0.00 0.00 0.00 0.00 47.33 46.74 3dfq h GLY 37 CO -0.08 0.36 -0.93 0.23 0.00 0.00 0.00 176.54 176.12 3dfq h SER 38 N 0.66 0.89 0.26 0.19 0.87 -1.80 -3.11 113.55 111.51 3dfq h SER 38 Ca 0.15 -0.71 0.00 0.00 -1.23 0.00 0.00 61.79 60.00 3dfq h SER 38 Cb 0.21 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 61.90 3dfq h SER 38 CO -0.01 1.48 0.00 0.00 -0.53 0.00 0.00 176.83 177.77 3dfq n ILE 39 N -3.92 0.07 -0.13 2.23 0.13 0.14 -3.33 119.36 114.56 3dfq n ILE 39 Ca -0.10 0.02 -0.12 0.00 -1.10 0.00 0.00 62.75 61.45 3dfq n ILE 39 Cb 0.83 -0.58 -0.02 0.00 -0.84 0.00 0.00 39.64 39.03 3dfq n ILE 39 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 3dfq h ALA 40 N 3.50 0.54 -0.18 1.51 0.00 -1.20 -2.41 119.26 121.02 3dfq h ALA 40 Ca 0.00 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 3dfq h ALA 40 Cb 0.13 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3dfq h ALA 40 CO 0.00 0.52 0.10 0.87 0.00 0.00 0.00 179.25 180.74 3dfq h LYS 41 N 0.63 0.25 -0.62 0.00 1.57 -1.72 -1.37 116.57 115.31 3dfq h LYS 41 Ca 0.08 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 58.87 3dfq h LYS 41 Cb 0.79 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 33.01 3dfq h LYS 41 CO 0.06 0.25 0.37 0.00 -0.57 0.00 0.00 179.45 179.56 3dfq h ARG 42 N 0.19 0.69 -0.23 3.15 -0.00 -1.72 -1.90 114.38 114.56 3dfq h ARG 42 Ca 0.06 -0.04 -0.11 0.00 -0.50 0.00 0.00 59.98 59.40 3dfq h ARG 42 Cb 0.07 -0.16 -0.01 0.00 0.00 0.00 0.00 29.97 29.87 3dfq h ARG 42 CO -0.01 0.46 -0.31 -0.07 0.00 0.00 0.00 179.97 180.04 3dfq h LEU 43 N 0.71 0.48 -0.75 3.04 3.38 -1.25 -2.98 115.31 117.94 3dfq h LEU 43 Ca 0.26 -0.18 -0.13 0.00 0.09 0.00 0.00 57.88 57.92 3dfq h LEU 43 Cb 0.07 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 3dfq h LEU 43 CO -0.13 0.77 -0.60 -0.61 0.09 0.00 0.00 178.44 177.96 3dfq h GLN 44 N 0.41 0.00 0.00 1.13 5.75 -0.88 0.36 115.11 121.88 3dfq h GLN 44 Ca 0.05 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.55 3dfq h GLN 44 Cb 0.74 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.29 3dfq h GLN 44 CO 0.06 0.60 -0.02 0.66 -2.65 0.00 0.00 178.83 177.48 3dfq h SER 45 N 0.00 0.00 -0.11 -0.69 4.64 -1.19 -1.22 113.55 114.99 3dfq h SER 45 Ca -0.01 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.29 3dfq h SER 45 Cb 1.10 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.17 3dfq h SER 45 CO 0.08 0.02 -0.08 2.30 -0.87 0.00 0.00 176.83 178.29 3dfq n ILE 46 N -3.21 2.11 -4.06 0.95 -5.35 -1.07 -5.00 119.36 103.73 3dfq n ILE 46 Ca -0.02 -2.35 -0.35 0.00 -0.27 0.00 0.00 62.75 59.76 3dfq n ILE 46 Cb 0.19 -0.25 -0.02 0.00 -1.74 0.00 0.00 39.64 37.81 3dfq n ILE 46 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3dfq n GLY 47 N -1.12 -0.52 3.12 3.28 0.00 -0.46 -4.63 105.19 104.87 3dfq n GLY 47 Ca 0.20 0.27 -0.27 0.00 0.00 0.00 0.00 46.02 46.22 3dfq n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dfq s THR 48 N -3.87 1.49 0.43 2.61 2.01 0.09 -4.99 115.64 113.40 3dfq s THR 48 Ca 0.24 -0.72 -0.26 0.00 0.31 0.00 0.00 61.69 61.26 3dfq s THR 48 Cb -0.12 -1.30 -0.09 0.00 0.01 0.00 0.00 72.50 71.00 3dfq s THR 48 CO 0.95 0.43 1.42 1.21 -0.69 0.00 0.00 174.62 177.93 3dfq n GLU 49 N 3.39 2.30 -3.05 4.92 2.13 -1.26 -4.27 120.64 124.79 3dfq n GLU 49 Ca -0.20 0.82 -0.44 0.00 0.66 0.00 0.00 57.16 58.00 3dfq n GLU 49 Cb 0.53 -2.59 0.00 0.00 0.27 0.00 0.00 31.44 29.64 3dfq n GLU 49 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 3dfq n ASN 50 N 0.05 5.38 -4.68 4.31 5.15 -1.26 -4.79 115.26 119.43 3dfq n ASN 50 Ca 0.04 -3.03 -0.24 0.00 -0.60 0.00 0.00 54.58 50.75 3dfq n ASN 50 Cb 0.40 -1.48 -0.08 0.00 -0.53 0.00 0.00 39.78 38.10 3dfq n ASN 50 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 3dfq s THR 51 N 0.24 2.73 0.31 -0.44 -4.23 -1.26 -5.02 115.64 107.96 3dfq s THR 51 Ca 0.38 -1.83 -0.00 0.00 -1.18 0.00 0.00 61.69 59.05 3dfq s THR 51 Cb -0.04 -2.89 0.21 0.00 1.34 0.00 0.00 72.50 71.11 3dfq s THR 51 CO -0.02 -0.17 1.91 -0.08 -0.54 0.00 0.00 174.62 175.72 3dfq h GLU 52 N 1.66 0.87 -0.46 3.99 4.81 -1.99 -1.39 114.58 122.07 3dfq h GLU 52 Ca -0.43 -0.11 -0.09 0.00 -0.13 0.00 0.00 59.36 58.60 3dfq h GLU 52 Cb 1.25 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.45 3dfq h GLU 52 CO 0.66 0.68 -0.06 1.49 -0.73 0.00 0.00 179.01 181.05 3dfq h GLU 53 N 0.87 0.84 -0.66 1.92 4.57 -1.97 0.55 114.58 120.70 3dfq h GLU 53 Ca 0.21 -0.30 -0.08 0.00 -1.18 0.00 0.00 59.36 58.01 3dfq h GLU 53 Cb 0.10 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.60 3dfq h GLU 53 CO -0.03 0.93 0.08 -0.91 -1.18 0.00 0.00 179.01 177.90 3dfq h ASN 54 N 0.69 1.06 -0.62 1.04 2.35 -1.79 0.72 115.58 119.03 3dfq h ASN 54 Ca 0.12 -0.27 -0.08 0.00 -0.55 0.00 0.00 56.30 55.52 3dfq h ASN 54 Cb 0.58 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.65 3dfq h ASN 54 CO 0.04 1.07 0.06 0.03 -1.65 0.00 0.00 177.43 176.97 3dfq h ARG 55 N 1.02 1.07 -0.27 0.81 3.08 -1.08 -0.96 114.38 118.04 3dfq h ARG 55 Ca 0.20 -0.30 -0.03 0.00 0.07 0.00 0.00 59.98 59.92 3dfq h ARG 55 Cb 0.47 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 3dfq h ARG 55 CO 0.02 1.00 0.06 -0.09 -1.07 0.00 0.00 179.97 179.89 3dfq h ARG 56 N 0.99 0.44 -0.85 0.04 2.43 -0.53 -0.72 114.38 116.18 3dfq h ARG 56 Ca 0.19 -0.11 0.01 0.00 -0.81 0.00 0.00 59.98 59.26 3dfq h ARG 56 Cb 0.48 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.93 3dfq h ARG 56 CO 0.02 0.53 0.56 0.35 -1.51 0.00 0.00 179.97 179.93 3dfq h PHE 57 N 0.27 1.07 -0.14 2.20 3.57 -0.65 0.22 116.94 123.49 3dfq h PHE 57 Ca 0.09 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.59 3dfq h PHE 57 Cb 0.29 -0.36 -0.01 0.00 2.79 0.00 0.00 35.95 38.67 3dfq h PHE 57 CO 0.01 0.67 0.00 -0.92 -2.23 0.00 0.00 178.31 175.84 3dfq h TYR 58 N 1.15 0.26 -0.70 0.41 3.20 -1.01 -0.67 116.97 119.61 3dfq h TYR 58 Ca 0.32 -0.04 -0.04 0.00 3.14 0.00 0.00 58.73 62.10 3dfq h TYR 58 Cb -0.12 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.05 3dfq h TYR 58 CO -0.01 0.47 0.27 0.00 -1.64 0.00 0.00 178.16 177.24 3dfq h ARG 59 N -0.01 1.03 -0.78 1.82 -0.00 -0.83 -2.08 114.38 113.53 3dfq h ARG 59 Ca 0.04 -0.18 -0.03 0.00 -0.50 0.00 0.00 59.98 59.31 3dfq h ARG 59 Cb 0.36 -0.17 -0.04 0.00 0.00 0.00 0.00 29.97 30.12 3dfq h ARG 59 CO 0.01 0.85 0.38 0.37 0.00 0.00 0.00 179.97 181.57 3dfq h GLN 60 N 1.01 1.12 -0.81 0.04 4.15 -0.41 -0.62 115.11 119.58 3dfq h GLN 60 Ca 0.23 -0.16 0.11 0.00 0.77 0.00 0.00 58.65 59.60 3dfq h GLN 60 Cb 0.21 -0.20 -0.08 0.00 0.21 0.00 0.00 27.48 27.62 3dfq h GLN 60 CO -0.02 0.86 0.45 1.25 -1.93 0.00 0.00 178.83 179.44 3dfq h LEU 61 N 1.09 0.61 0.00 -2.39 6.46 -0.42 0.64 115.31 121.31 3dfq h LEU 61 Ca 0.27 0.06 -0.02 0.00 -0.12 0.00 0.00 57.88 58.06 3dfq h LEU 61 Cb 0.11 -0.05 0.00 0.00 -0.73 0.00 0.00 40.66 39.99 3dfq h LEU 61 CO -0.03 0.33 -0.09 -0.07 -0.62 0.00 0.00 178.44 177.95 3dfq h LEU 62 N 0.72 0.07 -1.70 2.25 3.38 -1.17 -3.30 115.31 115.57 3dfq h LEU 62 Ca 0.41 -0.83 -0.03 0.00 0.09 0.00 0.00 57.88 57.51 3dfq h LEU 62 Cb 0.43 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 3dfq h LEU 62 CO -0.28 0.90 -0.16 -0.07 0.09 0.00 0.00 178.44 178.92 3dfq h LEU 63 N -0.74 0.00 -3.59 1.67 3.38 -0.89 -2.96 115.31 112.18 3dfq h LEU 63 Ca -0.01 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 3dfq h LEU 63 Cb 0.91 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.62 3dfq h LEU 63 CO 0.02 0.16 0.09 0.35 0.09 0.00 0.00 178.44 179.14 3dfq n THR 64 N -4.34 2.78 -0.86 0.22 -2.24 0.20 -4.78 114.28 105.26 3dfq n THR 64 Ca -0.03 -1.57 -0.32 0.00 -2.27 0.00 0.00 64.05 59.87 3dfq n THR 64 Cb 0.22 -0.30 0.15 0.00 -2.10 0.00 0.00 70.33 68.30 3dfq n THR 64 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dfq s ALA 65 N -2.87 1.62 1.11 6.98 0.00 -1.12 -4.94 121.76 122.54 3dfq s ALA 65 Ca 0.53 0.70 -0.12 0.00 0.00 0.00 0.00 51.96 53.07 3dfq s ALA 65 Cb 0.42 -3.47 0.25 0.00 0.00 0.00 0.00 23.12 20.32 3dfq s ALA 65 CO 0.14 -2.58 0.99 -0.40 0.00 0.00 0.00 175.76 173.91 3dfq n ASP 66 N -3.87 -1.30 0.00 0.00 5.68 -1.26 -4.84 116.55 110.96 3dfq n ASP 66 Ca 0.13 -0.02 0.00 0.00 -0.50 0.00 0.00 54.79 54.39 3dfq n ASP 66 Cb 0.51 -1.30 0.00 0.00 -1.14 0.00 0.00 41.12 39.20 3dfq n ASP 66 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 3dfq n ASP 67 N -4.60 0.00 0.25 -1.12 8.00 -1.26 -2.43 116.55 115.40 3dfq n ASP 67 Ca 0.05 0.26 0.12 0.00 0.71 0.00 0.00 54.79 55.93 3dfq n ASP 67 Cb 0.54 -0.26 0.66 0.00 -0.02 0.00 0.00 41.12 42.04 3dfq n ASP 67 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 3dfq h ARG 68 N 0.00 0.00 0.00 -1.24 3.08 -2.00 -2.52 114.38 111.70 3dfq h ARG 68 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3dfq h ARG 68 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.13 3dfq h ARG 68 CO 0.00 0.15 -0.27 1.33 -1.07 0.00 0.00 179.97 180.11 3dfq n VAL 69 N -3.64 0.34 -0.09 2.04 0.24 -1.02 -4.27 118.33 111.93 3dfq n VAL 69 Ca -0.02 -0.19 -0.06 0.00 -2.04 0.00 0.00 64.34 62.03 3dfq n VAL 69 Cb 0.27 -0.32 0.00 0.00 -1.47 0.00 0.00 33.84 32.33 3dfq n VAL 69 CO 0.00 0.00 0.00 0.78 -2.14 0.00 0.00 176.83 175.47 3dfq h ASN 70 N 0.00 -0.44 0.54 -1.34 4.21 -1.66 0.51 115.58 117.39 3dfq h ASN 70 Ca 0.00 0.12 0.00 0.00 1.21 0.00 0.00 56.30 57.63 3dfq h ASN 70 Cb 0.67 0.26 0.00 0.00 -1.12 0.00 0.00 38.32 38.12 3dfq h ASN 70 CO 0.00 -0.16 0.00 -0.81 -1.29 0.00 0.00 177.43 175.17 3dfq n PRO 71 N -5.31 0.23 -0.06 0.81 -0.04 -1.26 -3.34 135.00 126.03 3dfq n PRO 71 Ca 0.01 0.08 -0.14 0.00 -0.04 0.00 0.00 63.50 63.42 3dfq n PRO 71 Cb 0.22 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.04 3dfq n PRO 71 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3dfq s ILE 73 N -2.54 4.91 -0.18 0.00 -1.09 0.00 -0.57 121.20 121.74 3dfq s ILE 73 Ca -0.16 -0.80 0.21 0.00 -2.23 0.00 0.00 60.65 57.68 3dfq s ILE 73 Cb 0.07 -3.76 -0.10 0.00 -1.58 0.00 0.00 42.46 37.10 3dfq s ILE 73 CO 0.77 -0.30 0.87 0.61 -1.23 0.00 0.00 174.94 175.67 3dfq n GLY 74 N 5.08 -1.32 3.41 6.18 0.00 0.67 -4.27 105.19 114.94 3dfq n GLY 74 Ca -0.11 -0.27 -0.14 0.00 0.00 0.00 0.00 46.02 45.50 3dfq n GLY 74 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dfq s GLY 75 N -4.50 -0.47 -0.06 -0.02 0.00 -1.06 -1.14 107.32 100.07 3dfq s GLY 75 Ca -0.03 0.65 -0.01 0.00 0.00 0.00 0.00 44.72 45.34 3dfq s GLY 75 CO 0.82 0.34 -0.00 0.14 0.00 0.00 0.00 173.10 174.40 3dfq s VAL 76 N -2.54 0.36 -0.20 1.40 1.01 -0.17 -1.19 120.40 119.07 3dfq s VAL 76 Ca -0.05 0.10 -0.20 0.00 0.00 0.00 0.00 61.98 61.83 3dfq s VAL 76 Cb -0.01 -0.49 -0.03 0.00 0.00 0.00 0.00 36.38 35.85 3dfq s VAL 76 CO -0.02 0.24 0.58 -0.63 0.00 0.00 0.00 175.10 175.26 3dfq s ILE 77 N 1.73 5.06 0.24 2.22 1.01 -0.19 -0.21 121.20 131.06 3dfq s ILE 77 Ca 0.01 1.08 0.09 0.00 0.00 0.00 0.00 60.65 61.83 3dfq s ILE 77 Cb -0.13 -3.90 -0.04 0.00 0.01 0.00 0.00 42.46 38.40 3dfq s ILE 77 CO -0.04 0.15 0.00 -0.76 0.00 0.00 0.00 174.94 174.29 3dfq s LEU 78 N 1.75 3.24 0.34 2.97 1.43 0.24 -1.88 118.68 126.77 3dfq s LEU 78 Ca 0.27 -0.56 -0.06 0.00 -1.03 0.00 0.00 54.13 52.75 3dfq s LEU 78 Cb -0.16 -1.81 -0.05 0.00 0.03 0.00 0.00 46.19 44.21 3dfq s LEU 78 CO 0.10 0.03 0.63 0.12 0.23 0.00 0.00 176.35 177.46 3dfq s PHE 79 N -2.11 3.48 0.21 0.29 5.36 -1.26 -1.90 117.98 122.04 3dfq s PHE 79 Ca 0.30 0.74 -0.19 0.00 -0.96 0.00 0.00 56.93 56.83 3dfq s PHE 79 Cb -0.07 -2.20 0.19 0.00 -0.34 0.00 0.00 43.02 40.60 3dfq s PHE 79 CO 0.19 0.05 1.58 1.25 -1.46 0.00 0.00 175.22 176.83 3dfq h HIS 80 N 1.36 -0.92 -0.55 10.12 6.17 -1.92 -1.30 115.15 128.12 3dfq h HIS 80 Ca -0.48 0.08 0.11 0.00 0.71 0.00 0.00 60.37 60.79 3dfq h HIS 80 Cb 1.19 0.51 -0.09 0.00 2.52 0.00 0.00 27.41 31.55 3dfq h HIS 80 CO 0.58 -0.39 0.03 1.49 0.71 0.00 0.00 177.93 180.36 3dfq h GLU 81 N -0.09 0.15 -0.15 5.26 4.81 -1.98 -2.37 114.58 120.20 3dfq h GLU 81 Ca 0.29 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.43 3dfq h GLU 81 Cb 0.57 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.90 3dfq h GLU 81 CO -0.79 0.10 -0.25 1.15 -0.73 0.00 0.00 179.01 178.48 3dfq h THR 82 N 0.15 1.24 -0.00 0.32 2.02 -1.64 -2.64 112.91 112.36 3dfq h THR 82 Ca 0.28 -1.14 0.00 0.00 0.77 0.00 0.00 66.41 66.33 3dfq h THR 82 Cb 0.44 1.41 -0.00 0.00 -1.74 0.00 0.00 68.15 68.26 3dfq h THR 82 CO -0.44 0.35 0.00 0.25 0.37 0.00 0.00 175.52 176.05 3dfq h LEU 83 N 0.24 0.00 -2.91 2.58 5.85 -0.87 -2.18 115.31 118.02 3dfq h LEU 83 Ca 0.04 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.76 3dfq h LEU 83 Cb 0.58 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.61 3dfq h LEU 83 CO 0.04 0.00 0.00 -1.22 -0.34 0.00 0.00 178.44 176.92 3dfq n TYR 84 N -3.72 0.60 -2.99 1.25 4.01 -1.00 -4.56 117.16 110.75 3dfq n TYR 84 Ca -0.03 -0.53 -0.22 0.00 -0.16 0.00 0.00 57.90 56.96 3dfq n TYR 84 Cb 0.08 -0.06 0.01 0.00 -0.31 0.00 0.00 39.34 39.07 3dfq n TYR 84 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 3dfq s GLN 85 N -1.18 2.95 0.14 -0.72 -0.21 -0.82 -4.98 119.66 114.84 3dfq s GLN 85 Ca 0.29 -0.66 0.07 0.00 0.02 0.00 0.00 55.36 55.08 3dfq s GLN 85 Cb 0.16 -2.59 -0.04 0.00 1.00 0.00 0.00 33.01 31.54 3dfq s GLN 85 CO 0.18 -0.31 -0.17 0.15 -2.12 0.00 0.00 175.29 173.01 3dfq s LYS 86 N -4.53 1.16 1.01 2.91 1.02 -1.26 -1.65 119.74 118.39 3dfq s LYS 86 Ca 0.50 -1.32 -0.14 0.00 0.02 0.00 0.00 55.97 55.03 3dfq s LYS 86 Cb -0.10 -1.15 0.19 0.00 -0.52 0.00 0.00 37.83 36.25 3dfq s LYS 86 CO 0.37 0.23 1.13 0.00 -0.92 0.00 0.00 175.35 176.16 3dfq s ALA 87 N -2.04 1.25 0.38 5.17 0.00 0.67 -4.86 121.76 122.32 3dfq s ALA 87 Ca 0.12 -0.61 0.08 0.00 0.00 0.00 0.00 51.96 51.55 3dfq s ALA 87 Cb -0.06 -3.01 0.80 0.00 0.00 0.00 0.00 23.12 20.86 3dfq s ALA 87 CO 0.05 -2.78 1.96 -0.44 0.00 0.00 0.00 175.76 174.55 3dfq h ASP 88 N -1.88 0.60 0.37 0.00 3.32 -1.99 -0.54 116.42 116.30 3dfq h ASP 88 Ca -0.51 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.55 3dfq h ASP 88 Cb 1.32 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.75 3dfq h ASP 88 CO 0.53 0.38 0.00 -0.90 -1.72 0.00 0.00 179.24 177.53 3dfq n ASP 89 N -4.49 0.00 0.00 6.45 5.68 -1.26 -4.87 116.55 118.06 3dfq n ASP 89 Ca 0.11 -0.09 0.00 0.00 -0.50 0.00 0.00 54.79 54.31 3dfq n ASP 89 Cb 0.27 -0.26 0.00 0.00 -1.14 0.00 0.00 41.12 40.00 3dfq n ASP 89 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3dfq n GLY 90 N 0.54 0.45 3.72 6.12 0.00 -0.21 -5.06 105.19 110.74 3dfq n GLY 90 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 3dfq n GLY 90 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dfq s ARG 91 N -0.92 4.55 0.47 1.61 0.52 -1.26 -4.72 118.95 119.20 3dfq s ARG 91 Ca 0.00 1.55 -0.24 0.00 -0.52 0.00 0.00 55.73 56.51 3dfq s ARG 91 Cb 0.00 -3.40 -0.07 0.00 0.52 0.00 0.00 34.95 32.00 3dfq s ARG 91 CO 0.00 -0.06 1.39 -2.14 0.02 0.00 0.00 175.30 174.51 3dfq s PRO 92 N 0.74 3.60 0.35 3.54 0.02 -1.26 -0.24 135.00 141.76 3dfq s PRO 92 Ca 0.53 2.32 0.08 0.00 0.02 0.00 0.00 61.00 63.95 3dfq s PRO 92 Cb -0.24 -2.57 0.78 0.00 0.02 0.00 0.00 34.50 32.48 3dfq s PRO 92 CO 0.29 -0.85 1.89 0.74 -0.33 0.00 0.00 177.00 178.74 3dfq h PHE 93 N 2.17 0.83 -0.44 6.54 0.04 -1.58 -0.42 116.94 124.07 3dfq h PHE 93 Ca -0.51 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.29 3dfq h PHE 93 Cb 1.27 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 39.13 3dfq h PHE 93 CO 0.50 0.34 0.28 -1.35 -0.60 0.00 0.00 178.31 177.47 3dfq h PRO 94 N 0.73 0.58 -0.32 1.51 0.11 -1.85 -0.95 132.00 131.81 3dfq h PRO 94 Ca 0.42 -0.04 -0.17 0.00 0.11 0.00 0.00 66.00 66.32 3dfq h PRO 94 Cb 0.61 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 31.59 3dfq h PRO 94 CO -0.18 0.40 -0.47 0.37 -0.21 0.00 0.00 178.00 177.90 3dfq h GLN 95 N 0.60 0.88 -0.29 1.05 4.15 -1.45 -1.75 115.11 118.30 3dfq h GLN 95 Ca 0.16 -0.52 0.01 0.00 0.77 0.00 0.00 58.65 59.07 3dfq h GLN 95 Cb -0.04 0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.67 3dfq h GLN 95 CO -0.03 1.16 0.18 0.28 -1.93 0.00 0.00 178.83 178.49 3dfq h VAL 96 N 0.68 1.04 0.00 2.39 2.07 -0.78 -0.10 116.25 121.55 3dfq h VAL 96 Ca 0.03 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 3dfq h VAL 96 Cb 1.08 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 31.50 3dfq h VAL 96 CO 0.11 0.07 -0.00 0.40 0.02 0.00 0.00 177.57 178.16 3dfq h ILE 97 N 0.36 1.02 -0.59 4.57 2.04 -1.12 -2.93 117.51 120.86 3dfq h ILE 97 Ca 0.11 -0.06 -0.03 0.00 1.00 0.00 0.00 64.86 65.88 3dfq h ILE 97 Cb -0.01 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 37.10 3dfq h ILE 97 CO -0.05 0.02 0.23 0.11 0.00 0.00 0.00 178.15 178.46 3dfq h LYS 98 N -0.03 0.85 0.00 2.37 1.57 -1.15 -1.38 116.57 118.81 3dfq h LYS 98 Ca -0.00 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 3dfq h LYS 98 Cb 0.03 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.19 3dfq h LYS 98 CO 0.00 0.70 0.00 0.66 -0.57 0.00 0.00 179.45 180.24 3dfq h SER 99 N 0.84 0.00 -0.68 0.86 4.64 -0.84 -1.17 113.55 117.21 3dfq h SER 99 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 3dfq h SER 99 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 3dfq h SER 99 CO -0.02 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.23 3dfq n LYS 100 N -3.01 3.10 -0.74 4.77 5.02 -0.84 -4.93 118.16 121.54 3dfq n LYS 100 Ca -0.01 -2.67 0.00 0.00 -2.02 0.00 0.00 58.31 53.61 3dfq n LYS 100 Cb 0.20 -1.70 0.00 0.00 -0.02 0.00 0.00 35.03 33.51 3dfq n LYS 100 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dfq n GLY 101 N 1.42 0.66 3.94 0.72 0.00 -0.44 -4.58 105.19 106.91 3dfq n GLY 101 Ca 0.25 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.02 3dfq n GLY 101 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dfq s GLY 102 N -1.97 1.55 -0.06 -0.02 0.00 -0.58 -4.79 107.32 101.44 3dfq s GLY 102 Ca 0.00 -0.98 -0.08 0.00 0.00 0.00 0.00 44.72 43.66 3dfq s GLY 102 CO 0.00 -0.96 0.21 0.14 0.00 0.00 0.00 173.10 172.50 3dfq s VAL 103 N -1.95 5.38 -0.14 1.40 1.01 -0.29 -3.62 120.40 122.20 3dfq s VAL 103 Ca 0.37 0.27 -0.17 0.00 0.00 0.00 0.00 61.98 62.44 3dfq s VAL 103 Cb -0.10 -3.50 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 3dfq s VAL 103 CO 0.30 0.53 0.45 -0.69 0.00 0.00 0.00 175.10 175.69 3dfq s VAL 104 N -1.12 5.20 0.27 2.92 1.01 -1.26 -0.99 120.40 126.42 3dfq s VAL 104 Ca 0.20 0.88 0.11 0.00 0.00 0.00 0.00 61.98 63.17 3dfq s VAL 104 Cb -0.13 -3.79 -0.05 0.00 0.00 0.00 0.00 36.38 32.42 3dfq s VAL 104 CO 0.09 0.32 -0.10 -0.83 0.00 0.00 0.00 175.10 174.59 3dfq s GLY 105 N 0.67 1.77 -0.01 4.51 0.00 0.71 -0.36 107.32 114.61 3dfq s GLY 105 Ca 0.24 -1.76 -0.00 0.00 0.00 0.00 0.00 44.72 43.19 3dfq s GLY 105 CO 0.09 -1.84 0.02 -1.50 0.00 0.00 0.00 173.10 169.88 3dfq s ILE 106 N -2.41 -0.03 -0.05 0.90 1.10 -0.57 -0.59 121.20 119.54 3dfq s ILE 106 Ca 0.31 0.12 -0.30 0.00 -0.51 0.00 0.00 60.65 60.27 3dfq s ILE 106 Cb -0.06 -0.06 -0.03 0.00 0.15 0.00 0.00 42.46 42.46 3dfq s ILE 106 CO 0.18 0.05 1.20 -0.75 -2.11 0.00 0.00 174.94 173.50 3dfq s LYS 107 N 0.62 4.36 0.00 3.50 2.20 -0.80 -1.19 119.74 128.43 3dfq s LYS 107 Ca -0.05 1.67 0.02 0.00 -0.36 0.00 0.00 55.97 57.25 3dfq s LYS 107 Cb -0.07 -3.54 -0.01 0.00 -1.51 0.00 0.00 37.83 32.69 3dfq s LYS 107 CO -0.02 -0.43 0.18 1.33 -0.36 0.00 0.00 175.35 176.05 3dfq n VAL 108 N 4.57 0.00 -1.67 4.02 0.24 -0.35 -4.67 118.33 120.47 3dfq n VAL 108 Ca 0.11 -0.46 -0.31 0.00 -2.04 0.00 0.00 64.34 61.64 3dfq n VAL 108 Cb 0.46 1.01 0.05 0.00 -1.47 0.00 0.00 33.84 33.89 3dfq n VAL 108 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 3dfq s ASP 109 N -0.99 5.32 -0.34 -1.34 1.47 -1.23 -4.85 116.67 114.71 3dfq s ASP 109 Ca 0.01 1.42 0.07 0.00 1.18 0.00 0.00 52.55 55.23 3dfq s ASP 109 Cb 0.02 -2.29 0.47 0.00 -0.34 0.00 0.00 42.92 40.78 3dfq s ASP 109 CO 0.07 -1.46 1.40 0.29 0.68 0.00 0.00 175.17 176.15 3dfq n LYS 110 N -3.12 2.73 0.00 2.11 5.02 0.41 -4.95 118.16 120.36 3dfq n LYS 110 Ca 0.07 -3.67 0.00 0.00 -2.02 0.00 0.00 58.31 52.69 3dfq n LYS 110 Cb 0.55 -2.07 0.00 0.00 -0.02 0.00 0.00 35.03 33.49 3dfq n LYS 110 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dfq n GLY 111 N -0.91 -1.41 3.88 0.72 0.00 -1.26 -4.68 105.19 101.54 3dfq n GLY 111 Ca 0.41 -1.58 -0.30 0.00 0.00 0.00 0.00 46.02 44.55 3dfq n GLY 111 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3dfq s VAL 112 N -1.75 4.82 0.02 1.61 -7.23 -1.26 -1.37 120.40 115.24 3dfq s VAL 112 Ca 0.00 0.53 0.01 0.00 -1.81 0.00 0.00 61.98 60.71 3dfq s VAL 112 Cb 0.00 -3.75 -0.01 0.00 0.56 0.00 0.00 36.38 33.18 3dfq s VAL 112 CO 0.00 -0.55 -0.05 0.68 -0.31 0.00 0.00 175.10 174.88 3dfq s VAL 113 N -2.40 0.30 0.29 1.32 -7.23 -0.30 -4.88 120.40 107.51 3dfq s VAL 113 Ca 0.50 -0.67 -0.29 0.00 -1.81 0.00 0.00 61.98 59.71 3dfq s VAL 113 Cb -0.10 -0.36 -0.10 0.00 0.56 0.00 0.00 36.38 36.38 3dfq s VAL 113 CO 0.33 -0.24 1.28 -2.16 -0.31 0.00 0.00 175.10 174.00 3dfq s PRO 114 N -0.97 4.41 -0.42 4.82 0.04 -1.26 -1.28 135.00 140.34 3dfq s PRO 114 Ca -0.07 2.12 -0.19 0.00 0.04 0.00 0.00 61.00 62.90 3dfq s PRO 114 Cb -0.07 -3.12 0.02 0.00 0.04 0.00 0.00 34.50 31.38 3dfq s PRO 114 CO -0.00 -0.14 0.55 -0.51 0.04 0.00 0.00 177.00 176.94 3dfq s LEU 115 N -1.35 4.59 0.47 -3.56 1.43 0.01 -4.83 118.68 115.43 3dfq s LEU 115 Ca 0.50 -0.39 -0.24 0.00 -1.03 0.00 0.00 54.13 52.97 3dfq s LEU 115 Cb -0.38 -2.59 -0.08 0.00 0.03 0.00 0.00 46.19 43.17 3dfq s LEU 115 CO 0.48 -0.66 1.27 0.00 0.23 0.00 0.00 176.35 177.67 3dfq n ALA 116 N 5.94 1.31 -0.92 4.21 0.00 -1.26 -2.62 120.51 127.17 3dfq n ALA 116 Ca -0.04 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.60 3dfq n ALA 116 Cb 0.48 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.65 3dfq n ALA 116 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dfq n GLY 117 N 0.83 0.55 3.60 0.00 0.00 -1.26 -5.04 105.19 103.88 3dfq n GLY 117 Ca 0.08 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 3dfq n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dfq s THR 118 N -2.06 2.07 -1.28 2.61 -4.23 -1.08 -5.05 115.64 106.63 3dfq s THR 118 Ca 0.00 -2.05 -0.12 0.00 -1.18 0.00 0.00 61.69 58.34 3dfq s THR 118 Cb 0.00 -2.91 0.15 0.00 1.34 0.00 0.00 72.50 71.08 3dfq s THR 118 CO 0.00 -0.05 1.78 -3.20 -0.54 0.00 0.00 174.62 172.60 3dfq n ASN 119 N -0.93 5.00 -1.16 3.99 5.15 -1.26 -4.48 115.26 121.57 3dfq n ASN 119 Ca -0.05 -3.03 -0.12 0.00 -0.60 0.00 0.00 54.58 50.77 3dfq n ASN 119 Cb 0.66 -1.54 -0.03 0.00 -0.53 0.00 0.00 39.78 38.34 3dfq n ASN 119 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3dfq n GLY 120 N 3.45 0.65 3.91 8.20 0.00 -1.26 -5.01 105.19 115.13 3dfq n GLY 120 Ca 0.41 -0.41 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 3dfq n GLY 120 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dfq s GLU 121 N -3.78 3.53 0.23 1.61 2.02 -1.26 -4.96 118.70 116.08 3dfq s GLU 121 Ca 0.00 0.13 0.01 0.00 0.02 0.00 0.00 54.97 55.14 3dfq s GLU 121 Cb 0.00 -2.41 -0.05 0.00 0.10 0.00 0.00 34.13 31.77 3dfq s GLU 121 CO 0.00 -0.17 0.07 0.95 0.02 0.00 0.00 175.26 176.12 3dfq s THR 122 N -2.70 0.57 0.39 3.63 -4.23 -1.26 -0.81 115.64 111.23 3dfq s THR 122 Ca 0.47 -1.99 0.03 0.00 -1.18 0.00 0.00 61.69 59.01 3dfq s THR 122 Cb -0.10 -2.45 -0.01 0.00 1.34 0.00 0.00 72.50 71.28 3dfq s THR 122 CO 0.44 -0.17 0.10 1.07 -0.54 0.00 0.00 174.62 175.53 3dfq n THR 123 N -0.38 0.00 -4.96 3.99 5.66 -0.41 -4.79 114.28 113.41 3dfq n THR 123 Ca -0.02 -2.19 -0.27 0.00 -3.05 0.00 0.00 64.05 58.52 3dfq n THR 123 Cb 0.65 0.71 -0.15 0.00 -1.55 0.00 0.00 70.33 69.99 3dfq n THR 123 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 3dfq s THR 124 N -2.90 1.72 0.43 1.09 2.01 -1.26 -1.15 115.64 115.58 3dfq s THR 124 Ca 0.15 -1.01 0.08 0.00 0.31 0.00 0.00 61.69 61.21 3dfq s THR 124 Cb 0.01 -1.44 -0.01 0.00 0.01 0.00 0.00 72.50 71.06 3dfq s THR 124 CO 0.10 0.41 0.40 0.00 -0.69 0.00 0.00 174.62 174.84 3dfq s GLN 125 N -0.70 2.53 0.00 4.92 -2.07 -0.47 -4.90 119.66 118.96 3dfq s GLN 125 Ca 0.08 -1.55 0.00 0.00 -1.82 0.00 0.00 55.36 52.08 3dfq s GLN 125 Cb -0.08 -2.39 0.00 0.00 -1.09 0.00 0.00 33.01 29.44 3dfq s GLN 125 CO -0.00 -0.23 0.00 0.41 -1.32 0.00 0.00 175.29 174.15 3dfq n GLY 126 N -1.59 -0.17 0.13 2.60 0.00 -1.26 -0.45 105.19 104.45 3dfq n GLY 126 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3dfq n GLY 126 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3dfq h LEU 127 N 0.00 0.00 -9.41 0.99 3.38 -1.90 -3.41 115.31 104.96 3dfq h LEU 127 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 3dfq h LEU 127 Cb 0.00 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.78 3dfq h LEU 127 CO 0.00 0.62 1.18 -1.81 0.09 0.00 0.00 178.44 178.52 3dfq s ASP 128 N -6.58 6.45 -0.74 -0.43 1.01 -1.26 -1.49 116.67 113.64 3dfq s ASP 128 Ca 0.01 2.68 0.00 0.00 0.71 0.00 0.00 52.55 55.95 3dfq s ASP 128 Cb 0.10 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.48 3dfq s ASP 128 CO 0.75 -1.03 0.00 0.61 0.21 0.00 0.00 175.17 175.71 3dfq n GLY 129 N 4.40 0.80 0.33 0.21 0.00 -1.26 -4.89 105.19 104.78 3dfq n GLY 129 Ca 0.19 -0.17 -0.00 0.00 0.00 0.00 0.00 46.02 46.04 3dfq n GLY 129 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3dfq h LEU 130 N 0.00 0.79 -0.45 0.99 5.85 -1.49 -2.10 115.31 118.90 3dfq h LEU 130 Ca -0.14 -0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.51 3dfq h LEU 130 Cb 0.81 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.62 3dfq h LEU 130 CO 0.21 0.64 0.27 -1.28 -0.34 0.00 0.00 178.44 177.94 3dfq h SER 131 N 0.89 0.54 -0.63 1.25 0.87 -1.90 0.97 113.55 115.54 3dfq h SER 131 Ca 0.22 -0.06 -0.08 0.00 -1.23 0.00 0.00 61.79 60.64 3dfq h SER 131 Cb 0.04 -0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 61.84 3dfq h SER 131 CO -0.04 0.45 0.08 -0.33 -0.53 0.00 0.00 176.83 176.46 3dfq h GLU 132 N 0.59 1.08 -0.62 2.24 3.07 -1.91 -1.45 114.58 117.57 3dfq h GLU 132 Ca 0.16 -0.30 -0.05 0.00 -0.50 0.00 0.00 59.36 58.67 3dfq h GLU 132 Cb 0.01 -0.12 -0.03 0.00 -0.84 0.00 0.00 28.75 27.77 3dfq h GLU 132 CO -0.03 1.00 0.18 0.00 -1.40 0.00 0.00 179.01 178.77 3dfq h ARG 133 N 1.00 0.98 -0.53 2.33 3.08 -0.97 -1.96 114.38 118.31 3dfq h ARG 133 Ca 0.19 -0.22 -0.04 0.00 0.07 0.00 0.00 59.98 59.98 3dfq h ARG 133 Cb 0.47 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 3dfq h ARG 133 CO 0.02 0.87 0.16 0.00 -1.07 0.00 0.00 179.97 179.95 3dfq h ALA 135 N 1.02 1.08 -0.29 0.00 0.00 -1.12 -0.09 119.26 119.86 3dfq h ALA 135 Ca 0.17 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 3dfq h ALA 135 Cb 0.29 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3dfq h ALA 135 CO -0.00 0.58 -0.14 0.37 0.00 0.00 0.00 179.25 180.06 3dfq h GLN 136 N 1.18 0.61 -0.47 0.00 5.75 -1.07 -2.14 115.11 118.96 3dfq h GLN 136 Ca 0.30 -0.26 -0.05 0.00 -0.15 0.00 0.00 58.65 58.49 3dfq h GLN 136 Cb 0.01 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 28.52 3dfq h GLN 136 CO -0.05 0.84 0.09 1.88 -2.65 0.00 0.00 178.83 178.94 3dfq h TYR 137 N 0.36 0.74 -0.28 3.99 0.05 -0.70 -1.04 116.97 120.09 3dfq h TYR 137 Ca 0.07 -0.07 -0.02 0.00 0.05 0.00 0.00 58.73 58.76 3dfq h TYR 137 Cb 0.66 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 38.17 3dfq h TYR 137 CO 0.06 0.65 0.11 -0.22 -1.05 0.00 0.00 178.16 177.71 3dfq h LYS 138 N 0.69 0.42 -0.42 4.88 1.63 -0.93 -0.46 116.57 122.39 3dfq h LYS 138 Ca 0.15 -0.08 -0.01 0.00 -0.85 0.00 0.00 60.65 59.86 3dfq h LYS 138 Cb 0.30 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 31.84 3dfq h LYS 138 CO 0.00 0.45 0.20 -0.22 -3.45 0.00 0.00 179.45 176.43 3dfq h LYS 139 N 0.30 0.58 -0.73 1.90 3.64 -0.94 -2.44 116.57 118.87 3dfq h LYS 139 Ca 0.09 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 3dfq h LYS 139 Cb 0.19 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 3dfq h LYS 139 CO -0.01 0.45 0.00 -0.25 -2.27 0.00 0.00 179.45 177.38 3dfq n ASP 140 N -4.40 3.14 0.00 4.20 8.00 -0.43 -4.91 116.55 122.15 3dfq n ASP 140 Ca 0.03 -2.39 0.00 0.00 0.71 0.00 0.00 54.79 53.14 3dfq n ASP 140 Cb 0.12 -0.54 0.00 0.00 -0.02 0.00 0.00 41.12 40.68 3dfq n ASP 140 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dfq n GLY 141 N 0.42 0.46 3.83 0.44 0.00 -0.92 -4.94 105.19 104.48 3dfq n GLY 141 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 3dfq n GLY 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dfq s ALA 142 N -2.00 3.56 0.00 4.61 0.00 -0.23 -4.46 121.76 123.24 3dfq s ALA 142 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 51.96 51.92 3dfq s ALA 142 Cb 0.00 -2.60 0.00 0.00 0.00 0.00 0.00 23.12 20.52 3dfq s ALA 142 CO 0.00 0.42 0.01 -0.25 0.00 0.00 0.00 175.76 175.94 3dfq n ASP 143 N 1.12 0.03 -4.03 0.00 10.43 0.52 -4.06 116.55 120.55 3dfq n ASP 143 Ca -0.07 -0.48 -0.09 0.00 2.57 0.00 0.00 54.79 56.72 3dfq n ASP 143 Cb 0.51 0.90 -0.08 0.00 1.84 0.00 0.00 41.12 44.29 3dfq n ASP 143 CO 0.00 0.00 0.00 0.72 -1.07 0.00 0.00 177.20 176.85 3dfq s PHE 144 N -0.90 0.55 0.23 1.24 -0.71 -1.16 -1.13 117.98 116.10 3dfq s PHE 144 Ca 0.00 -0.94 0.04 0.00 -1.04 0.00 0.00 56.93 54.99 3dfq s PHE 144 Cb 0.00 -0.24 -0.05 0.00 -1.21 0.00 0.00 43.02 41.52 3dfq s PHE 144 CO 0.00 -0.60 -0.03 0.00 -1.34 0.00 0.00 175.22 173.25 3dfq s ALA 145 N -3.98 1.84 -0.04 1.99 0.00 0.09 -1.51 121.76 120.15 3dfq s ALA 145 Ca 0.18 -1.74 0.04 0.00 0.00 0.00 0.00 51.96 50.43 3dfq s ALA 145 Cb 0.05 0.37 -0.00 0.00 0.00 0.00 0.00 23.12 23.54 3dfq s ALA 145 CO -0.01 -0.19 -0.16 0.21 0.00 0.00 0.00 175.76 175.60 3dfq s LYS 146 N -3.82 1.72 -0.14 0.00 2.36 -0.33 -2.07 119.74 117.46 3dfq s LYS 146 Ca 0.27 -0.57 -0.05 0.00 -2.55 0.00 0.00 55.97 53.07 3dfq s LYS 146 Cb 0.05 -1.49 0.07 0.00 -1.05 0.00 0.00 37.83 35.41 3dfq s LYS 146 CO 0.08 0.21 0.27 -0.46 1.55 0.00 0.00 175.35 177.01 3dfq s TRP 147 N 0.10 -0.45 -0.23 4.03 -0.11 -1.26 -1.21 118.94 119.82 3dfq s TRP 147 Ca -0.05 0.96 -0.07 0.00 1.22 0.00 0.00 56.10 58.16 3dfq s TRP 147 Cb -0.12 -0.03 -0.03 0.00 -1.50 0.00 0.00 33.47 31.79 3dfq s TRP 147 CO 0.02 -0.39 0.05 0.50 -4.62 0.00 0.00 176.95 172.51 3dfq s ARG 148 N 2.43 3.68 0.05 5.86 3.52 -1.26 -3.54 118.95 129.69 3dfq s ARG 148 Ca 0.02 -0.48 0.03 0.00 -0.13 0.00 0.00 55.73 55.17 3dfq s ARG 148 Cb -0.12 -3.24 -0.04 0.00 -1.56 0.00 0.00 34.95 29.99 3dfq s ARG 148 CO -0.09 -0.09 0.03 0.00 -0.81 0.00 0.00 175.30 174.35 3dfq s VAL 150 N -1.25 1.06 0.12 0.00 1.01 -1.26 -1.70 120.40 118.37 3dfq s VAL 150 Ca 0.25 -0.44 0.07 0.00 0.00 0.00 0.00 61.98 61.86 3dfq s VAL 150 Cb -0.12 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.25 3dfq s VAL 150 CO 0.17 0.34 -0.18 -0.76 0.00 0.00 0.00 175.10 174.67 3dfq s LEU 151 N 0.64 2.35 0.01 3.92 1.43 0.19 -4.51 118.68 122.72 3dfq s LEU 151 Ca -0.13 -0.75 0.05 0.00 -1.03 0.00 0.00 54.13 52.27 3dfq s LEU 151 Cb -0.15 -0.74 -0.02 0.00 0.03 0.00 0.00 46.19 45.31 3dfq s LEU 151 CO 0.03 -0.03 -0.16 -0.75 0.23 0.00 0.00 176.35 175.67 3dfq s LYS 152 N -2.27 1.22 -0.27 1.70 2.20 -1.26 -0.87 119.74 120.19 3dfq s LYS 152 Ca 0.08 -0.65 -0.18 0.00 -0.36 0.00 0.00 55.97 54.85 3dfq s LYS 152 Cb -0.08 -1.21 -0.02 0.00 -1.51 0.00 0.00 37.83 35.01 3dfq s LYS 152 CO 0.04 0.32 0.53 0.42 -0.36 0.00 0.00 175.35 176.30 3dfq s ILE 153 N -0.52 5.05 0.03 5.43 1.01 -1.26 -2.10 121.20 128.84 3dfq s ILE 153 Ca 0.05 0.84 -0.00 0.00 0.00 0.00 0.00 60.65 61.54 3dfq s ILE 153 Cb -0.07 -3.86 0.00 0.00 0.01 0.00 0.00 42.46 38.55 3dfq s ILE 153 CO 0.00 0.04 0.04 0.61 0.00 0.00 0.00 174.94 175.63 3dfq n GLY 154 N 4.43 2.99 0.35 6.18 0.00 -0.39 -4.79 105.19 113.96 3dfq n GLY 154 Ca -0.04 -1.38 0.03 0.00 0.00 0.00 0.00 46.02 44.63 3dfq n GLY 154 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3dfq h GLU 155 N 0.00 0.93 0.00 1.61 4.11 -2.01 -3.14 114.58 116.08 3dfq h GLU 155 Ca -0.02 -0.06 0.00 0.00 0.07 0.00 0.00 59.36 59.35 3dfq h GLU 155 Cb 0.10 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.14 3dfq h GLU 155 CO 0.03 0.62 -0.13 0.72 0.07 0.00 0.00 179.01 180.32 3dfq n HIS 156 N -4.45 0.00 -4.10 2.06 8.25 -1.26 -5.06 115.22 110.65 3dfq n HIS 156 Ca 0.10 -0.75 -0.12 0.00 -0.26 0.00 0.00 57.72 56.70 3dfq n HIS 156 Cb 0.12 -0.12 -0.11 0.00 1.12 0.00 0.00 29.99 31.00 3dfq n HIS 156 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3dfq s THR 157 N -2.15 0.57 0.21 1.59 -4.23 -1.19 -3.82 115.64 106.62 3dfq s THR 157 Ca 0.24 -1.44 -0.30 0.00 -1.18 0.00 0.00 61.69 59.01 3dfq s THR 157 Cb 0.21 -1.05 -0.09 0.00 1.34 0.00 0.00 72.50 72.91 3dfq s THR 157 CO 0.02 -0.60 1.26 -2.84 -0.54 0.00 0.00 174.62 171.92 3dfq s PRO 158 N -2.55 4.44 0.75 3.99 0.02 -0.89 -1.27 135.00 139.49 3dfq s PRO 158 Ca -0.01 1.99 -0.12 0.00 0.02 0.00 0.00 61.00 62.88 3dfq s PRO 158 Cb -0.03 -3.20 0.04 0.00 0.02 0.00 0.00 34.50 31.33 3dfq s PRO 158 CO -0.02 -0.17 1.13 -1.54 -0.33 0.00 0.00 177.00 176.08 3dfq s SER 159 N 0.15 5.02 0.22 2.53 1.04 -1.25 -4.85 113.70 116.56 3dfq s SER 159 Ca 0.54 0.99 -0.08 0.00 0.48 0.00 0.00 55.95 57.88 3dfq s SER 159 Cb -0.35 -1.65 0.26 0.00 0.10 0.00 0.00 66.02 64.38 3dfq s SER 159 CO 0.39 -1.60 1.84 0.00 0.98 0.00 0.00 173.24 174.84 3dfq h ALA 160 N -0.84 1.01 -0.20 5.32 0.00 -2.00 -1.28 119.26 121.28 3dfq h ALA 160 Ca -0.45 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 3dfq h ALA 160 Cb 1.29 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 3dfq h ALA 160 CO 0.65 0.18 0.09 1.25 0.00 0.00 0.00 179.25 181.42 3dfq h LEU 161 N 0.84 0.28 -0.69 0.00 5.85 -1.99 -1.07 115.31 118.53 3dfq h LEU 161 Ca 0.32 -0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.90 3dfq h LEU 161 Cb 0.14 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.06 3dfq h LEU 161 CO -0.16 0.35 0.45 0.00 -0.34 0.00 0.00 178.44 178.74 3dfq h ALA 162 N 0.94 0.87 -0.11 1.25 0.00 -1.84 0.13 119.26 120.51 3dfq h ALA 162 Ca 0.07 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3dfq h ALA 162 Cb 0.15 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 3dfq h ALA 162 CO -0.01 0.31 0.02 0.82 0.00 0.00 0.00 179.25 180.39 3dfq h ILE 163 N 0.93 1.22 -0.26 0.00 2.04 -1.13 -1.65 117.51 118.68 3dfq h ILE 163 Ca 0.25 -0.71 -0.01 0.00 1.00 0.00 0.00 64.86 65.39 3dfq h ILE 163 Cb -0.10 1.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 3dfq h ILE 163 CO -0.05 0.20 0.12 -0.03 0.00 0.00 0.00 178.15 178.39 3dfq h MET 164 N -0.04 0.38 -0.28 2.37 4.05 -0.97 -1.82 114.93 118.60 3dfq h MET 164 Ca 0.03 -0.06 -0.04 0.00 -0.28 0.00 0.00 59.70 59.35 3dfq h MET 164 Cb 0.30 -0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 31.03 3dfq h MET 164 CO 0.00 0.39 0.01 1.49 0.23 0.00 0.00 176.91 179.03 3dfq h GLU 165 N 0.28 0.49 -0.35 0.39 4.57 -0.76 -1.13 114.58 118.08 3dfq h GLU 165 Ca 0.09 -0.15 -0.09 0.00 -1.18 0.00 0.00 59.36 58.03 3dfq h GLU 165 Cb 0.14 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.67 3dfq h GLU 165 CO -0.01 0.64 -0.16 -0.91 -1.18 0.00 0.00 179.01 177.39 3dfq h ASN 166 N 0.29 0.62 -0.50 1.04 2.35 -1.31 -1.19 115.58 116.88 3dfq h ASN 166 Ca 0.08 -0.19 -0.09 0.00 -0.55 0.00 0.00 56.30 55.55 3dfq h ASN 166 Cb 0.41 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.59 3dfq h ASN 166 CO 0.01 0.80 -0.03 0.00 -1.65 0.00 0.00 177.43 176.56 3dfq h ALA 167 N 1.26 0.93 -0.30 -0.83 0.00 -1.21 -1.81 119.26 117.30 3dfq h ALA 167 Ca 0.09 -0.30 -0.12 0.00 0.00 0.00 0.00 54.91 54.58 3dfq h ALA 167 Cb 0.59 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 3dfq h ALA 167 CO 0.04 0.63 -0.29 -0.97 0.00 0.00 0.00 179.25 178.67 3dfq h ASN 168 N 0.86 0.78 0.06 0.00 -1.24 -0.84 -2.32 115.58 112.88 3dfq h ASN 168 Ca 0.15 -0.47 -0.11 0.00 0.71 0.00 0.00 56.30 56.59 3dfq h ASN 168 Cb 0.55 -0.22 -0.01 0.00 0.73 0.00 0.00 38.32 39.37 3dfq h ASN 168 CO 0.03 1.08 -0.36 1.62 -1.29 0.00 0.00 177.43 178.51 3dfq h VAL 169 N 0.49 1.29 -0.55 2.57 3.04 -1.17 -1.77 116.25 120.15 3dfq h VAL 169 Ca 0.05 -1.47 -0.06 0.00 -1.01 0.00 0.00 66.70 64.21 3dfq h VAL 169 Cb 0.86 1.55 -0.02 0.00 -2.01 0.00 0.00 31.29 31.66 3dfq h VAL 169 CO 0.07 0.45 0.10 -0.07 -1.01 0.00 0.00 177.57 177.12 3dfq h LEU 170 N 0.35 0.82 -0.54 3.16 3.38 -1.26 -1.32 115.31 119.90 3dfq h LEU 170 Ca 0.04 -0.16 -0.10 0.00 0.09 0.00 0.00 57.88 57.74 3dfq h LEU 170 Cb 0.81 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 3dfq h LEU 170 CO 0.06 0.82 -0.07 0.00 0.09 0.00 0.00 178.44 179.34 3dfq h ALA 171 N 1.28 0.73 -0.42 1.53 0.00 -0.96 -0.61 119.26 120.81 3dfq h ALA 171 Ca 0.18 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 3dfq h ALA 171 Cb 0.35 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3dfq h ALA 171 CO 0.00 0.62 0.14 0.00 0.00 0.00 0.00 179.25 180.02 3dfq h ARG 172 N 0.87 0.64 -0.45 0.00 2.47 -1.03 -0.53 114.38 116.33 3dfq h ARG 172 Ca 0.14 -0.13 -0.00 0.00 -1.26 0.00 0.00 59.98 58.73 3dfq h ARG 172 Cb 0.63 -0.10 -0.02 0.00 -1.65 0.00 0.00 29.97 28.84 3dfq h ARG 172 CO 0.04 0.62 0.28 -0.92 0.56 0.00 0.00 179.97 180.55 3dfq h TYR 173 N 0.53 0.60 -0.65 3.04 3.20 -1.11 -1.75 116.97 120.82 3dfq h TYR 173 Ca 0.14 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.97 3dfq h TYR 173 Cb 0.24 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.28 3dfq h TYR 173 CO 0.01 0.41 0.27 0.00 -1.64 0.00 0.00 178.16 177.22 3dfq h ALA 174 N 1.13 0.85 -0.39 1.82 0.00 -0.92 -1.61 119.26 120.14 3dfq h ALA 174 Ca 0.16 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3dfq h ALA 174 Cb -0.01 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 3dfq h ALA 174 CO -0.03 0.45 0.21 1.03 0.00 0.00 0.00 179.25 180.91 3dfq h SER 175 N 0.92 0.49 -0.55 0.00 0.87 -0.81 -1.71 113.55 112.76 3dfq h SER 175 Ca 0.22 -0.10 -0.09 0.00 -1.23 0.00 0.00 61.79 60.59 3dfq h SER 175 Cb 0.19 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 62.00 3dfq h SER 175 CO -0.02 0.45 -0.00 0.40 -0.53 0.00 0.00 176.83 177.13 3dfq h ILE 176 N 0.50 1.26 -0.07 2.23 2.04 -1.17 -2.66 117.51 119.63 3dfq h ILE 176 Ca 0.14 -1.12 0.01 0.00 1.00 0.00 0.00 64.86 64.88 3dfq h ILE 176 Cb 0.07 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.03 3dfq h ILE 176 CO -0.02 0.40 0.02 0.00 0.00 0.00 0.00 178.15 178.55 3dfq h GLN 178 N 0.06 0.00 0.00 0.00 4.20 -1.22 -0.03 115.11 118.12 3dfq h GLN 178 Ca 0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.74 3dfq h GLN 178 Cb 0.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.80 3dfq h GLN 178 CO -0.03 0.10 0.00 1.96 -0.67 0.00 0.00 178.83 180.18 3dfq h GLN 179 N 0.00 0.00 -0.18 1.46 1.08 -1.12 -3.05 115.11 113.29 3dfq h GLN 179 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3dfq h GLN 179 Cb 0.21 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.64 3dfq h GLN 179 CO 0.01 0.00 0.00 0.09 -0.95 0.00 0.00 178.83 177.98 3dfq n ASN 180 N -2.42 3.17 -0.37 1.46 3.02 -0.11 -4.97 115.26 115.04 3dfq n ASN 180 Ca 0.02 -2.80 -0.05 0.00 -0.03 0.00 0.00 54.58 51.72 3dfq n ASN 180 Cb 0.27 -0.42 -0.02 0.00 -0.61 0.00 0.00 39.78 39.00 3dfq n ASN 180 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dfq n GLY 181 N -0.60 0.74 3.52 7.41 0.00 -1.12 -4.76 105.19 110.37 3dfq n GLY 181 Ca 0.17 -0.54 -0.35 0.00 0.00 0.00 0.00 46.02 45.29 3dfq n GLY 181 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dfq s ILE 182 N -2.09 4.31 -0.22 -0.61 -1.09 -0.66 -4.85 121.20 115.98 3dfq s ILE 182 Ca 0.00 -0.19 -0.29 0.00 -2.23 0.00 0.00 60.65 57.94 3dfq s ILE 182 Cb 0.00 -2.95 0.00 0.00 -1.58 0.00 0.00 42.46 37.93 3dfq s ILE 182 CO 0.00 0.43 1.15 -0.69 -1.23 0.00 0.00 174.94 174.59 3dfq s VAL 183 N 0.84 4.47 -0.03 2.92 1.01 -0.29 -3.18 120.40 126.14 3dfq s VAL 183 Ca 0.02 1.76 -0.22 0.00 0.00 0.00 0.00 61.98 63.54 3dfq s VAL 183 Cb -0.14 -4.20 -0.05 0.00 0.00 0.00 0.00 36.38 32.00 3dfq s VAL 183 CO 0.02 -0.23 0.63 -2.16 0.00 0.00 0.00 175.10 173.37 3dfq s PRO 184 N 3.45 4.38 -0.33 2.72 0.04 -1.26 -0.73 135.00 143.27 3dfq s PRO 184 Ca 0.49 0.79 -0.15 0.00 0.04 0.00 0.00 61.00 62.16 3dfq s PRO 184 Cb -0.17 -3.39 -0.02 0.00 0.04 0.00 0.00 34.50 30.96 3dfq s PRO 184 CO 0.12 0.24 0.37 0.42 0.04 0.00 0.00 177.00 178.19 3dfq s ILE 185 N 0.21 5.16 -0.34 0.56 1.01 -0.88 -2.71 121.20 124.21 3dfq s ILE 185 Ca 0.33 0.18 -0.27 0.00 0.00 0.00 0.00 60.65 60.89 3dfq s ILE 185 Cb -0.18 -3.80 0.02 0.00 0.01 0.00 0.00 42.46 38.51 3dfq s ILE 185 CO 0.17 -0.04 0.99 -0.69 0.00 0.00 0.00 174.94 175.37 3dfq s VAL 186 N 2.06 4.55 -0.50 2.92 1.01 0.03 -4.05 120.40 126.42 3dfq s VAL 186 Ca 0.13 1.45 0.04 0.00 0.00 0.00 0.00 61.98 63.60 3dfq s VAL 186 Cb -0.16 -4.37 0.13 0.00 0.00 0.00 0.00 36.38 31.98 3dfq s VAL 186 CO 0.11 -0.50 0.23 -0.70 0.00 0.00 0.00 175.10 174.25 3dfq s GLU 187 N 3.56 1.92 -1.11 2.72 2.12 -1.23 -0.31 118.70 126.37 3dfq s GLU 187 Ca 0.41 -2.53 -0.08 0.00 0.36 0.00 0.00 54.97 53.14 3dfq s GLU 187 Cb -0.12 -3.31 0.29 0.00 0.26 0.00 0.00 34.13 31.25 3dfq s GLU 187 CO 0.17 -1.09 1.21 -0.35 -0.54 0.00 0.00 175.26 174.67 3dfq n PRO 188 N 3.26 3.79 -2.37 4.30 -0.04 -1.24 -1.30 135.00 141.40 3dfq n PRO 188 Ca 0.05 -4.49 -0.42 0.00 -0.04 0.00 0.00 63.50 58.60 3dfq n PRO 188 Cb 0.33 -2.54 -0.03 0.00 -0.04 0.00 0.00 33.50 31.23 3dfq n PRO 188 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 3dfq s GLU 189 N -1.69 4.32 -0.35 0.54 2.12 -0.69 -4.57 118.70 118.38 3dfq s GLU 189 Ca 0.31 1.79 -0.11 0.00 0.36 0.00 0.00 54.97 57.31 3dfq s GLU 189 Cb -0.06 -3.56 0.00 0.00 0.26 0.00 0.00 34.13 30.77 3dfq s GLU 189 CO -0.03 -0.50 0.21 0.42 -0.54 0.00 0.00 175.26 174.82 3dfq s ILE 190 N 2.30 4.85 0.59 -3.70 1.01 -1.26 -0.63 121.20 124.34 3dfq s ILE 190 Ca 0.59 -0.51 -0.20 0.00 0.00 0.00 0.00 60.65 60.53 3dfq s ILE 190 Cb -0.27 -3.56 -0.04 0.00 0.01 0.00 0.00 42.46 38.60 3dfq s ILE 190 CO 0.24 -0.07 1.30 0.18 0.00 0.00 0.00 174.94 176.58 3dfq n LEU 191 N 5.04 5.52 -0.25 2.97 4.77 -0.05 -4.83 117.00 130.18 3dfq n LEU 191 Ca -0.13 0.91 0.15 0.00 -0.03 0.00 0.00 56.01 56.91 3dfq n LEU 191 Cb 0.48 -1.55 0.66 0.00 -2.33 0.00 0.00 43.42 40.68 3dfq n LEU 191 CO 0.36 -0.86 0.93 -0.81 -1.33 0.00 0.00 177.39 175.68 3dfq n PRO 192 N -1.32 1.21 -1.83 3.23 -0.04 -1.26 -4.49 135.00 130.49 3dfq n PRO 192 Ca 0.13 -0.50 -0.41 0.00 -0.04 0.00 0.00 63.50 62.68 3dfq n PRO 192 Cb 0.46 -1.49 -0.02 0.00 -0.04 0.00 0.00 33.50 32.41 3dfq n PRO 192 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3dfq s ASP 193 N -2.13 6.44 0.00 3.54 1.01 -1.26 -0.65 116.67 123.62 3dfq s ASP 193 Ca 0.38 2.89 0.00 0.00 0.71 0.00 0.00 52.55 56.53 3dfq s ASP 193 Cb 0.21 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.51 3dfq s ASP 193 CO 0.39 -0.86 0.00 0.61 0.21 0.00 0.00 175.17 175.51 3dfq n GLY 194 N 2.11 1.64 1.15 0.21 0.00 -1.26 -4.59 105.19 104.44 3dfq n GLY 194 Ca 0.08 -2.20 0.09 0.00 0.00 0.00 0.00 46.02 43.98 3dfq n GLY 194 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3dfq n ASP 195 N 0.00 3.89 -4.72 1.61 5.75 -1.26 -0.75 116.55 121.07 3dfq n ASP 195 Ca 0.00 -2.27 -0.32 0.00 -0.01 0.00 0.00 54.79 52.18 3dfq n ASP 195 Cb 0.00 -0.44 0.11 0.00 -1.03 0.00 0.00 41.12 39.76 3dfq n ASP 195 CO 0.00 0.00 0.00 -1.38 -0.11 0.00 0.00 177.20 175.71 3dfq s HIS 196 N -1.50 2.08 0.52 2.11 -3.43 -1.26 -4.24 115.29 109.57 3dfq s HIS 196 Ca 0.41 1.65 0.02 0.00 -0.80 0.00 0.00 55.06 56.34 3dfq s HIS 196 Cb 0.25 -3.32 0.10 0.00 -1.43 0.00 0.00 32.58 28.18 3dfq s HIS 196 CO 0.22 -2.41 0.71 -0.40 -2.00 0.00 0.00 174.74 170.86 3dfq n ASP 197 N -3.30 1.23 -0.15 7.38 5.68 -1.26 -0.13 116.55 126.00 3dfq n ASP 197 Ca 0.12 -1.97 -0.06 0.00 -0.50 0.00 0.00 54.79 52.37 3dfq n ASP 197 Cb 0.51 -0.44 0.03 0.00 -1.14 0.00 0.00 41.12 40.09 3dfq n ASP 197 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 3dfq h LEU 198 N 0.00 0.41 -1.45 -2.12 5.85 -1.92 -2.53 115.31 113.54 3dfq h LEU 198 Ca -0.24 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.44 3dfq h LEU 198 Cb 0.94 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.89 3dfq h LEU 198 CO 0.28 0.29 -0.28 0.07 -0.34 0.00 0.00 178.44 178.46 3dfq h LYS 199 N 0.52 0.00 -0.27 1.25 2.10 -1.95 -1.01 116.57 117.21 3dfq h LYS 199 Ca 0.19 0.00 -0.18 0.00 -2.00 0.00 0.00 60.65 58.66 3dfq h LYS 199 Cb 0.04 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.37 3dfq h LYS 199 CO -0.10 0.28 -0.55 -0.09 -2.00 0.00 0.00 179.45 176.99 3dfq h ARG 200 N 0.00 0.85 -0.48 0.07 2.43 -1.86 -1.02 114.38 114.36 3dfq h ARG 200 Ca -0.00 -0.55 -0.04 0.00 -0.81 0.00 0.00 59.98 58.58 3dfq h ARG 200 Cb 0.53 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.13 3dfq h ARG 200 CO 0.04 1.18 0.16 0.00 -1.51 0.00 0.00 179.97 179.84 3dfq h GLN 202 N 0.64 0.99 0.27 0.00 4.15 -1.10 0.15 115.11 120.21 3dfq h GLN 202 Ca 0.16 -0.06 -0.01 0.00 0.77 0.00 0.00 58.65 59.50 3dfq h GLN 202 Cb 0.25 -0.22 0.00 0.00 0.21 0.00 0.00 27.48 27.72 3dfq h GLN 202 CO -0.01 0.66 -0.13 -0.92 -1.93 0.00 0.00 178.83 176.51 3dfq h TYR 203 N 1.02 -0.33 -0.77 3.99 3.20 -0.92 -0.57 116.97 122.59 3dfq h TYR 203 Ca 0.27 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.13 3dfq h TYR 203 Cb -0.11 0.11 -0.04 0.00 1.54 0.00 0.00 36.73 38.23 3dfq h TYR 203 CO -0.02 -0.17 0.45 0.28 -1.64 0.00 0.00 178.16 177.07 3dfq h VAL 204 N -0.41 1.22 -0.79 1.81 2.07 -1.03 -1.61 116.25 117.51 3dfq h VAL 204 Ca -0.04 -0.51 -0.02 0.00 0.82 0.00 0.00 66.70 66.95 3dfq h VAL 204 Cb 0.31 0.17 -0.04 0.00 -1.52 0.00 0.00 31.29 30.21 3dfq h VAL 204 CO 0.06 0.24 0.41 0.74 0.02 0.00 0.00 177.57 179.04 3dfq h THR 205 N 1.06 1.24 -0.53 2.57 2.02 -0.55 -0.17 112.91 118.55 3dfq h THR 205 Ca 0.27 -0.63 -0.02 0.00 0.77 0.00 0.00 66.41 66.81 3dfq h THR 205 Cb -0.02 0.21 -0.02 0.00 -1.74 0.00 0.00 68.15 66.58 3dfq h THR 205 CO -0.05 0.27 0.25 -0.33 0.37 0.00 0.00 175.52 176.03 3dfq h GLU 206 N 1.10 0.76 -0.43 6.66 5.08 -0.62 -0.90 114.58 126.23 3dfq h GLU 206 Ca 0.27 -0.11 -0.11 0.00 -1.00 0.00 0.00 59.36 58.41 3dfq h GLU 206 Cb 0.06 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 3dfq h GLU 206 CO -0.04 0.63 -0.19 0.87 -1.00 0.00 0.00 179.01 179.28 3dfq h LYS 207 N 0.71 0.84 -0.07 2.33 1.79 -0.93 -1.90 116.57 119.33 3dfq h LYS 207 Ca 0.18 -0.33 -0.02 0.00 -2.18 0.00 0.00 60.65 58.31 3dfq h LYS 207 Cb 0.13 -0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 30.73 3dfq h LYS 207 CO -0.02 0.96 -0.03 0.28 -1.08 0.00 0.00 179.45 179.56 3dfq h VAL 208 N 0.74 1.32 -0.28 0.50 2.07 -0.87 -2.63 116.25 117.09 3dfq h VAL 208 Ca 0.11 -1.01 -0.04 0.00 0.82 0.00 0.00 66.70 66.58 3dfq h VAL 208 Cb 0.71 1.85 -0.02 0.00 -1.52 0.00 0.00 31.29 32.31 3dfq h VAL 208 CO 0.05 0.28 -0.00 -0.07 0.02 0.00 0.00 177.57 177.85 3dfq h LEU 209 N -0.22 0.39 -0.66 2.57 3.38 -1.15 0.35 115.31 119.97 3dfq h LEU 209 Ca 0.02 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 3dfq h LEU 209 Cb 0.46 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 3dfq h LEU 209 CO 0.01 0.46 0.14 0.00 0.09 0.00 0.00 178.44 179.14 3dfq h ALA 210 N 1.59 0.87 -0.41 1.53 0.00 -1.31 -1.17 119.26 120.37 3dfq h ALA 210 Ca 0.09 -0.25 -0.13 0.00 0.00 0.00 0.00 54.91 54.62 3dfq h ALA 210 Cb 0.28 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3dfq h ALA 210 CO 0.01 0.61 -0.27 0.00 0.00 0.00 0.00 179.25 179.60 3dfq h ALA 211 N 1.06 0.75 -0.06 0.00 0.00 -1.01 -2.11 119.26 117.89 3dfq h ALA 211 Ca 0.20 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 3dfq h ALA 211 Cb 0.40 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 3dfq h ALA 211 CO 0.01 0.66 0.03 0.28 0.00 0.00 0.00 179.25 180.23 3dfq h VAL 212 N 0.74 1.07 0.00 0.00 2.07 -0.57 -1.76 116.25 117.80 3dfq h VAL 212 Ca 0.09 -0.19 -0.08 0.00 0.82 0.00 0.00 66.70 67.33 3dfq h VAL 212 Cb 0.82 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.67 3dfq h VAL 212 CO 0.07 0.06 -0.40 1.88 0.02 0.00 0.00 177.57 179.20 3dfq h TYR 213 N 0.02 0.00 -0.35 1.57 0.05 -1.20 -1.03 116.97 116.02 3dfq h TYR 213 Ca 0.02 0.00 -0.14 0.00 0.05 0.00 0.00 58.73 58.66 3dfq h TYR 213 Cb 0.06 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.79 3dfq h TYR 213 CO -0.05 0.40 -0.34 -0.22 -1.05 0.00 0.00 178.16 176.90 3dfq h LYS 214 N 0.00 0.79 -0.40 4.88 1.63 -1.22 -1.72 116.57 120.54 3dfq h LYS 214 Ca -0.00 -0.38 -0.06 0.00 -0.85 0.00 0.00 60.65 59.35 3dfq h LYS 214 Cb 0.86 -0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.47 3dfq h LYS 214 CO 0.05 1.01 0.00 0.00 -3.45 0.00 0.00 179.45 177.06 3dfq h ALA 215 N 0.95 0.53 -0.86 5.00 0.00 -0.89 -0.91 119.26 123.08 3dfq h ALA 215 Ca 0.07 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.73 3dfq h ALA 215 Cb 0.88 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.49 3dfq h ALA 215 CO 0.08 0.31 0.56 -0.07 0.00 0.00 0.00 179.25 180.13 3dfq h LEU 216 N 0.53 0.99 -0.28 0.00 3.38 -1.08 -1.23 115.31 117.62 3dfq h LEU 216 Ca 0.11 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 3dfq h LEU 216 Cb 0.47 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 3dfq h LEU 216 CO 0.02 0.73 0.05 -1.28 0.09 0.00 0.00 178.44 178.05 3dfq h SER 217 N 1.17 0.44 -0.21 -0.43 0.87 -1.02 -0.14 113.55 114.23 3dfq h SER 217 Ca 0.31 -0.26 0.01 0.00 -1.23 0.00 0.00 61.79 60.62 3dfq h SER 217 Cb -0.12 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 61.72 3dfq h SER 217 CO -0.07 0.59 0.14 0.44 -0.53 0.00 0.00 176.83 177.40 3dfq h ASP 218 N 0.28 0.23 -0.52 6.23 3.32 -0.54 -1.64 116.42 123.78 3dfq h ASP 218 Ca 0.09 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.13 3dfq h ASP 218 Cb 0.33 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.82 3dfq h ASP 218 CO 0.00 0.17 0.00 1.41 -1.72 0.00 0.00 179.24 179.10 3dfq n HIS 219 N -4.51 0.87 -3.67 4.55 8.25 -0.52 -4.95 115.22 115.24 3dfq n HIS 219 Ca 0.00 -0.39 -0.25 0.00 -0.26 0.00 0.00 57.72 56.82 3dfq n HIS 219 Cb 0.09 -0.07 0.07 0.00 1.12 0.00 0.00 29.99 31.19 3dfq n HIS 219 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3dfq n HIS 220 N 0.98 -2.72 -2.66 4.41 8.25 -0.62 -4.89 115.22 117.97 3dfq n HIS 220 Ca 0.19 0.99 -0.41 0.00 -0.26 0.00 0.00 57.72 58.23 3dfq n HIS 220 Cb 0.55 -4.78 -0.05 0.00 1.12 0.00 0.00 29.99 26.83 3dfq n HIS 220 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3dfq s ILE 221 N -3.32 4.20 -0.76 1.59 -1.09 -0.10 -4.90 121.20 116.81 3dfq s ILE 221 Ca 0.59 1.91 -0.23 0.00 -2.23 0.00 0.00 60.65 60.68 3dfq s ILE 221 Cb -0.27 -4.22 0.06 0.00 -1.58 0.00 0.00 42.46 36.45 3dfq s ILE 221 CO 0.76 0.34 1.14 -0.47 -1.23 0.00 0.00 174.94 175.47 3dfq s TYR 222 N -0.30 2.59 0.36 3.97 5.04 -1.26 -4.81 117.35 122.94 3dfq s TYR 222 Ca 0.47 -0.54 0.06 0.00 -2.44 0.00 0.00 57.07 54.62 3dfq s TYR 222 Cb -0.26 -4.44 0.74 0.00 0.35 0.00 0.00 41.96 38.35 3dfq s TYR 222 CO 0.32 -1.79 1.94 -0.07 -1.34 0.00 0.00 175.55 174.60 3dfq h LEU 223 N 11.91 0.68 -2.41 6.97 3.38 -1.94 -0.88 115.31 133.02 3dfq h LEU 223 Ca -0.17 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 3dfq h LEU 223 Cb 1.05 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.67 3dfq h LEU 223 CO 1.23 0.42 -0.03 -0.33 0.09 0.00 0.00 178.44 179.82 3dfq h GLU 224 N 0.76 0.00 -0.87 1.13 3.07 -1.91 -1.45 114.58 115.32 3dfq h GLU 224 Ca 0.35 0.00 -0.51 0.00 -0.50 0.00 0.00 59.36 58.70 3dfq h GLU 224 Cb 0.36 0.00 -0.28 0.00 -0.84 0.00 0.00 28.75 27.99 3dfq h GLU 224 CO -0.13 0.03 0.50 0.41 -1.40 0.00 0.00 179.01 178.42 3dfq n GLY 225 N -0.85 5.09 3.18 -3.84 0.00 -0.34 -4.40 105.19 104.02 3dfq n GLY 225 Ca -0.02 -1.56 -0.10 0.00 0.00 0.00 0.00 46.02 44.33 3dfq n GLY 225 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dfq s THR 226 N -3.81 0.08 0.10 2.61 -4.23 -0.54 -4.07 115.64 105.76 3dfq s THR 226 Ca 0.57 -1.89 0.02 0.00 -1.18 0.00 0.00 61.69 59.21 3dfq s THR 226 Cb 0.47 -2.13 -0.04 0.00 1.34 0.00 0.00 72.50 72.14 3dfq s THR 226 CO 0.05 -0.35 -0.08 -0.76 -0.54 0.00 0.00 174.62 172.95 3dfq s LEU 227 N -3.07 2.47 -0.10 4.79 1.43 -1.10 -3.57 118.68 119.54 3dfq s LEU 227 Ca 0.27 -0.93 0.03 0.00 -1.03 0.00 0.00 54.13 52.48 3dfq s LEU 227 Cb 0.07 -0.14 -0.01 0.00 0.03 0.00 0.00 46.19 46.14 3dfq s LEU 227 CO 0.04 -0.39 -0.21 -0.22 0.23 0.00 0.00 176.35 175.80 3dfq s LEU 228 N -2.80 2.27 -0.61 1.79 2.96 -0.47 -0.79 118.68 121.04 3dfq s LEU 228 Ca 0.09 -0.48 0.04 0.00 -0.22 0.00 0.00 54.13 53.56 3dfq s LEU 228 Cb 0.02 -1.46 0.15 0.00 0.50 0.00 0.00 46.19 45.40 3dfq s LEU 228 CO -0.03 0.19 0.37 -0.75 -1.32 0.00 0.00 176.35 174.81 3dfq s LYS 229 N 0.18 2.23 0.41 1.98 2.20 0.58 0.01 119.74 127.33 3dfq s LYS 229 Ca -0.12 -2.95 0.08 0.00 -0.36 0.00 0.00 55.97 52.61 3dfq s LYS 229 Cb -0.16 -3.39 -0.01 0.00 -1.51 0.00 0.00 37.83 32.76 3dfq s LYS 229 CO 0.07 -1.19 0.46 -1.25 -0.36 0.00 0.00 175.35 173.08 3dfq s PRO 230 N -0.81 2.69 0.53 4.03 0.04 -1.26 -3.73 135.00 136.49 3dfq s PRO 230 Ca 0.21 -1.38 -0.17 0.00 0.04 0.00 0.00 61.00 59.70 3dfq s PRO 230 Cb -0.16 -2.57 -0.07 0.00 0.04 0.00 0.00 34.50 31.74 3dfq s PRO 230 CO -0.07 -0.21 1.00 0.54 0.04 0.00 0.00 177.00 178.30 3dfq s ASN 231 N -4.22 6.42 0.65 6.66 4.22 -1.26 -2.53 114.94 124.87 3dfq s ASN 231 Ca 0.51 1.66 -0.11 0.00 -2.14 0.00 0.00 52.86 52.78 3dfq s ASN 231 Cb -0.07 -2.52 -0.02 0.00 1.28 0.00 0.00 41.25 39.92 3dfq s ASN 231 CO 0.30 -0.73 1.04 -0.04 -2.04 0.00 0.00 177.10 175.64 3dfq s MET 232 N -3.96 3.32 -0.36 3.55 -1.94 -1.26 -4.94 119.30 113.71 3dfq s MET 232 Ca 0.61 0.83 -0.23 0.00 -1.71 0.00 0.00 55.69 55.18 3dfq s MET 232 Cb -0.12 -2.04 0.01 0.00 2.01 0.00 0.00 34.83 34.69 3dfq s MET 232 CO 0.31 -0.79 0.80 0.08 -0.01 0.00 0.00 175.02 175.40 3dfq s VAL 233 N -3.13 4.73 0.13 -6.03 1.01 -1.26 -5.01 120.40 110.84 3dfq s VAL 233 Ca 0.56 0.95 -0.02 0.00 0.00 0.00 0.00 61.98 63.48 3dfq s VAL 233 Cb -0.12 -4.21 -0.04 0.00 0.00 0.00 0.00 36.38 32.01 3dfq s VAL 233 CO 0.54 -0.42 0.08 0.42 0.00 0.00 0.00 175.10 175.73 3dfq s THR 234 N 3.11 0.10 0.84 3.92 -4.23 -1.26 -4.53 115.64 113.59 3dfq s THR 234 Ca 0.32 -1.84 -0.12 0.00 -1.18 0.00 0.00 61.69 58.87 3dfq s THR 234 Cb -0.13 -2.00 0.10 0.00 1.34 0.00 0.00 72.50 71.80 3dfq s THR 234 CO 0.16 -0.46 1.10 -2.16 -0.54 0.00 0.00 174.62 172.72 3dfq s PRO 235 N -4.03 1.73 0.87 3.99 0.04 -1.26 -4.57 135.00 131.76 3dfq s PRO 235 Ca 0.23 0.69 -0.10 0.00 0.04 0.00 0.00 61.00 61.85 3dfq s PRO 235 Cb 0.07 -1.87 0.12 0.00 0.04 0.00 0.00 34.50 32.85 3dfq s PRO 235 CO 0.01 -1.88 1.12 0.20 0.04 0.00 0.00 177.00 176.49 3dfq s GLY 236 N -3.73 1.67 0.47 0.56 0.00 0.82 -4.90 107.32 102.21 3dfq s GLY 236 Ca 0.62 0.39 0.15 0.00 0.00 0.00 0.00 44.72 45.88 3dfq s GLY 236 CO 0.55 0.80 2.04 0.45 0.00 0.00 0.00 173.10 176.94 3dfq h HIS 237 N -1.60 0.01 -0.63 1.90 3.86 -0.43 -2.35 115.15 115.91 3dfq h HIS 237 Ca -0.45 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.76 3dfq h HIS 237 Cb 1.26 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.73 3dfq h HIS 237 CO 0.52 0.13 0.00 0.00 0.86 0.00 0.00 177.93 179.43 3dfq n ALA 238 N -2.52 3.14 -2.26 2.45 0.00 0.07 -4.96 120.51 116.44 3dfq n ALA 238 Ca -0.03 -1.55 -0.42 0.00 0.00 0.00 0.00 53.44 51.45 3dfq n ALA 238 Cb 0.20 -1.04 -0.03 0.00 0.00 0.00 0.00 19.45 18.58 3dfq n ALA 238 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dfq h THR 240 N 4.34 1.25 -3.59 0.00 1.35 -1.91 -3.44 112.91 110.92 3dfq h THR 240 Ca -0.42 -2.19 -0.51 0.00 -0.55 0.00 0.00 66.41 62.74 3dfq h THR 240 Cb 1.21 2.24 -0.01 0.00 -1.73 0.00 0.00 68.15 69.86 3dfq h THR 240 CO 0.85 0.59 0.39 -1.58 -0.25 0.00 0.00 175.52 175.52 3dfq s GLN 241 N -3.37 4.69 0.04 4.72 0.74 -1.26 -5.05 119.66 120.17 3dfq s GLN 241 Ca 0.00 1.53 -0.01 0.00 0.05 0.00 0.00 55.36 56.93 3dfq s GLN 241 Cb 0.11 -3.34 -0.04 0.00 1.10 0.00 0.00 33.01 30.84 3dfq s GLN 241 CO 0.75 0.21 0.21 0.15 -0.55 0.00 0.00 175.29 176.06 3dfq s LYS 242 N -0.24 3.46 0.09 1.67 1.02 -1.26 -5.00 119.74 119.48 3dfq s LYS 242 Ca 0.47 -0.37 0.04 0.00 0.02 0.00 0.00 55.97 56.13 3dfq s LYS 242 Cb -0.25 -3.05 -0.03 0.00 -0.52 0.00 0.00 37.83 33.98 3dfq s LYS 242 CO 0.31 0.62 -0.11 0.71 -0.92 0.00 0.00 175.35 175.97 3dfq s TYR 243 N -1.45 1.07 0.61 3.18 2.02 -1.26 -5.15 117.35 116.36 3dfq s TYR 243 Ca 0.33 -0.61 -0.04 0.00 -0.37 0.00 0.00 57.07 56.38 3dfq s TYR 243 Cb -0.13 -0.59 0.03 0.00 -0.40 0.00 0.00 41.96 40.88 3dfq s TYR 243 CO 0.24 0.01 0.89 -1.54 -1.57 0.00 0.00 175.55 173.58 3dfq s SER 244 N -2.27 5.23 0.37 2.29 1.04 -1.26 -4.95 113.70 114.14 3dfq s SER 244 Ca 0.03 0.38 0.11 0.00 0.48 0.00 0.00 55.95 56.96 3dfq s SER 244 Cb -0.05 -1.24 0.70 0.00 0.10 0.00 0.00 66.02 65.54 3dfq s SER 244 CO 0.01 -1.26 1.83 0.45 0.98 0.00 0.00 173.24 175.25 3dfq h HIS 245 N -0.22 0.10 -0.54 5.02 3.86 -1.99 -2.31 115.15 119.06 3dfq h HIS 245 Ca -0.44 -0.02 -0.08 0.00 -1.16 0.00 0.00 60.37 58.67 3dfq h HIS 245 Cb 1.29 -0.03 -0.02 0.00 1.06 0.00 0.00 27.41 29.71 3dfq h HIS 245 CO 0.39 0.40 0.03 0.93 0.86 0.00 0.00 177.93 180.55 3dfq h GLU 246 N 0.08 0.90 -0.32 2.45 3.07 -1.93 -0.13 114.58 118.70 3dfq h GLU 246 Ca 0.01 -0.24 -0.16 0.00 -0.50 0.00 0.00 59.36 58.47 3dfq h GLU 246 Cb 0.61 -0.10 -0.00 0.00 -0.84 0.00 0.00 28.75 28.41 3dfq h GLU 246 CO 0.04 0.88 -0.42 0.93 -1.40 0.00 0.00 179.01 179.05 3dfq h GLU 247 N 0.84 0.85 -0.74 2.33 5.08 -1.84 -0.38 114.58 120.72 3dfq h GLU 247 Ca 0.16 -0.49 -0.03 0.00 -1.00 0.00 0.00 59.36 58.01 3dfq h GLU 247 Cb 0.45 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.70 3dfq h GLU 247 CO 0.02 1.12 0.35 0.82 -1.00 0.00 0.00 179.01 180.33 3dfq h ILE 248 N 0.64 1.24 -0.46 3.13 2.04 -1.20 -0.61 117.51 122.29 3dfq h ILE 248 Ca 0.04 -0.68 -0.07 0.00 1.00 0.00 0.00 64.86 65.15 3dfq h ILE 248 Cb 1.01 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 37.40 3dfq h ILE 248 CO 0.10 0.29 0.01 0.00 0.00 0.00 0.00 178.15 178.55 3dfq h ALA 249 N 1.18 0.62 -0.45 1.87 0.00 -0.87 -1.12 119.26 120.48 3dfq h ALA 249 Ca 0.25 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3dfq h ALA 249 Cb 0.12 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3dfq h ALA 249 CO -0.03 0.40 0.06 1.98 0.00 0.00 0.00 179.25 181.66 3dfq h MET 250 N 0.66 0.76 -0.62 0.00 1.85 -0.77 -0.52 114.93 116.29 3dfq h MET 250 Ca 0.13 -0.21 -0.09 0.00 -0.61 0.00 0.00 59.70 58.92 3dfq h MET 250 Cb 0.48 -0.08 -0.02 0.00 0.43 0.00 0.00 31.60 32.40 3dfq h MET 250 CO 0.02 0.79 0.03 0.00 -0.40 0.00 0.00 176.91 177.35 3dfq h ALA 251 N 0.94 0.83 0.18 0.39 0.00 -1.06 -0.91 119.26 119.64 3dfq h ALA 251 Ca 0.14 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 3dfq h ALA 251 Cb 0.41 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3dfq h ALA 251 CO 0.01 0.65 -0.09 1.15 0.00 0.00 0.00 179.25 180.98 3dfq h THR 252 N 0.98 0.93 -0.23 0.00 2.02 -1.05 -1.75 112.91 113.80 3dfq h THR 252 Ca 0.18 -0.61 -0.06 0.00 0.77 0.00 0.00 66.41 66.69 3dfq h THR 252 Cb 0.53 1.29 -0.01 0.00 -1.74 0.00 0.00 68.15 68.21 3dfq h THR 252 CO 0.03 0.14 -0.13 0.58 0.37 0.00 0.00 175.52 176.50 3dfq h VAL 253 N -0.55 1.21 -0.24 3.16 2.07 -1.11 -2.00 116.25 118.80 3dfq h VAL 253 Ca -0.02 -0.94 -0.05 0.00 0.82 0.00 0.00 66.70 66.51 3dfq h VAL 253 Cb 0.41 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 3dfq h VAL 253 CO 0.04 0.30 -0.05 0.74 0.02 0.00 0.00 177.57 178.62 3dfq h THR 254 N 0.36 1.28 -0.60 2.57 2.02 -1.13 -0.49 112.91 116.91 3dfq h THR 254 Ca 0.07 -1.05 0.02 0.00 0.77 0.00 0.00 66.41 66.22 3dfq h THR 254 Cb 0.45 1.48 -0.03 0.00 -1.74 0.00 0.00 68.15 68.31 3dfq h THR 254 CO 0.03 0.32 0.39 0.00 0.37 0.00 0.00 175.52 176.63 3dfq h ALA 255 N 0.76 0.77 -0.40 6.16 0.00 -1.05 -1.96 119.26 123.55 3dfq h ALA 255 Ca 0.06 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 3dfq h ALA 255 Cb 0.51 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3dfq h ALA 255 CO 0.02 0.16 0.00 -0.07 0.00 0.00 0.00 179.25 179.36 3dfq h LEU 256 N 0.78 0.69 -1.94 0.00 3.38 -1.27 -2.85 115.31 114.10 3dfq h LEU 256 Ca 0.23 -0.31 0.02 0.00 0.09 0.00 0.00 57.88 57.92 3dfq h LEU 256 Cb -0.04 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 3dfq h LEU 256 CO -0.07 0.83 0.09 0.03 0.09 0.00 0.00 178.44 179.41 3dfq h ARG 257 N 0.54 0.08 -0.00 1.13 3.08 -0.79 0.12 114.38 118.54 3dfq h ARG 257 Ca 0.11 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.16 3dfq h ARG 257 Cb 0.47 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.50 3dfq h ARG 257 CO 0.02 0.05 -0.21 0.54 -1.07 0.00 0.00 179.97 179.31 3dfq n ARG 258 N -4.51 0.16 0.00 0.04 1.74 -0.76 -4.57 116.66 108.76 3dfq n ARG 258 Ca -0.00 -0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.02 3dfq n ARG 258 Cb 0.15 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.09 3dfq n ARG 258 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3dfq n THR 259 N -1.37 0.00 -3.07 0.55 -2.24 -0.74 -5.01 114.28 102.41 3dfq n THR 259 Ca 0.08 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.44 3dfq n THR 259 Cb 0.32 -0.25 -0.06 0.00 -2.10 0.00 0.00 70.33 68.24 3dfq n THR 259 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3dfq s VAL 260 N -1.26 4.83 0.44 2.28 1.01 0.35 -4.78 120.40 123.28 3dfq s VAL 260 Ca 0.00 0.58 -0.25 0.00 0.00 0.00 0.00 61.98 62.31 3dfq s VAL 260 Cb 0.00 -4.14 -0.09 0.00 0.00 0.00 0.00 36.38 32.15 3dfq s VAL 260 CO 0.00 -0.41 1.25 -2.65 0.00 0.00 0.00 175.10 173.30 3dfq n PRO 261 N 6.20 1.83 0.16 2.72 -0.02 -1.26 -4.84 135.00 139.79 3dfq n PRO 261 Ca -0.00 0.65 0.11 0.00 -2.02 0.00 0.00 63.50 62.24 3dfq n PRO 261 Cb 0.48 -2.38 0.57 0.00 -0.02 0.00 0.00 33.50 32.16 3dfq n PRO 261 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3dfq n PRO 262 N -0.11 0.15 0.24 0.52 -0.04 -1.26 -1.62 135.00 132.87 3dfq n PRO 262 Ca 0.07 0.61 0.11 0.00 -0.04 0.00 0.00 63.50 64.25 3dfq n PRO 262 Cb 0.40 -1.95 0.55 0.00 -0.04 0.00 0.00 33.50 32.47 3dfq n PRO 262 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3dfq h ALA 263 N 2.04 1.09 -2.47 0.55 0.00 -1.90 -3.43 119.26 115.13 3dfq h ALA 263 Ca 0.00 -0.17 -0.53 0.00 0.00 0.00 0.00 54.91 54.21 3dfq h ALA 263 Cb 0.05 -0.03 0.03 0.00 0.00 0.00 0.00 17.79 17.84 3dfq h ALA 263 CO 0.00 0.24 1.06 0.08 0.00 0.00 0.00 179.25 180.63 3dfq s VAL 264 N -3.82 2.80 0.28 0.00 1.01 -0.64 -3.38 120.40 116.65 3dfq s VAL 264 Ca -0.01 0.26 -0.01 0.00 0.00 0.00 0.00 61.98 62.23 3dfq s VAL 264 Cb 0.11 -3.17 0.17 0.00 0.00 0.00 0.00 36.38 33.49 3dfq s VAL 264 CO 0.62 -0.00 1.84 0.74 0.00 0.00 0.00 175.10 178.30 3dfq h THR 265 N 4.78 1.22 -2.27 3.92 2.02 -1.67 -3.44 112.91 117.49 3dfq h THR 265 Ca -0.44 -0.76 0.11 0.00 0.77 0.00 0.00 66.41 66.09 3dfq h THR 265 Cb 1.21 0.60 -0.15 0.00 -1.74 0.00 0.00 68.15 68.07 3dfq h THR 265 CO 0.94 0.29 0.50 -0.83 0.37 0.00 0.00 175.52 176.79 3dfq s GLY 266 N -3.60 -0.46 -0.19 2.16 0.00 -1.26 -3.47 107.32 100.50 3dfq s GLY 266 Ca -0.10 1.02 -0.00 0.00 0.00 0.00 0.00 44.72 45.64 3dfq s GLY 266 CO 0.80 0.34 -0.16 0.14 0.00 0.00 0.00 173.10 174.22 3dfq s VAL 267 N -3.11 2.44 -0.44 1.40 1.01 0.34 -1.36 120.40 120.67 3dfq s VAL 267 Ca 0.05 -0.81 -0.01 0.00 0.00 0.00 0.00 61.98 61.21 3dfq s VAL 267 Cb -0.01 -2.05 0.12 0.00 0.00 0.00 0.00 36.38 34.44 3dfq s VAL 267 CO -0.09 0.51 0.22 0.42 0.00 0.00 0.00 175.10 176.16 3dfq s THR 268 N 1.29 3.13 0.37 3.92 -4.23 0.10 -0.76 115.64 119.46 3dfq s THR 268 Ca 0.04 -2.38 -0.27 0.00 -1.18 0.00 0.00 61.69 57.90 3dfq s THR 268 Cb -0.14 -3.15 -0.10 0.00 1.34 0.00 0.00 72.50 70.46 3dfq s THR 268 CO -0.09 -0.72 1.35 -0.36 -0.54 0.00 0.00 174.62 174.26 3dfq s PHE 269 N 0.76 2.84 0.29 3.99 0.08 -0.45 -4.16 117.98 121.32 3dfq s PHE 269 Ca 0.11 1.35 -0.07 0.00 0.12 0.00 0.00 56.93 58.44 3dfq s PHE 269 Cb -0.22 -3.77 -0.06 0.00 -0.57 0.00 0.00 43.02 38.41 3dfq s PHE 269 CO -0.04 -2.25 0.59 -0.48 -0.10 0.00 0.00 175.22 172.94 3dfq s LEU 270 N -2.12 4.06 0.00 -0.37 0.05 -1.05 -1.52 118.68 117.72 3dfq s LEU 270 Ca 0.53 0.84 0.22 0.00 0.05 0.00 0.00 54.13 55.77 3dfq s LEU 270 Cb -0.41 -3.65 -0.10 0.00 -2.05 0.00 0.00 46.19 39.98 3dfq s LEU 270 CO 0.54 -0.19 0.99 -1.54 -0.55 0.00 0.00 176.35 175.60 3dfq n SER 271 N -0.74 0.90 0.00 1.48 3.41 -1.26 -4.35 113.62 113.06 3dfq n SER 271 Ca -0.00 -0.85 0.00 0.00 -0.26 0.00 0.00 58.87 57.75 3dfq n SER 271 Cb 0.53 0.87 0.00 0.00 -0.26 0.00 0.00 64.21 65.36 3dfq n SER 271 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dfq n GLY 272 N 1.50 3.91 1.48 5.00 0.00 -1.26 -1.59 105.19 114.22 3dfq n GLY 272 Ca 0.04 0.04 0.10 0.00 0.00 0.00 0.00 46.02 46.20 3dfq n GLY 272 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dfq n GLY 273 N 0.00 2.74 3.77 -0.02 0.00 -1.26 -4.96 105.19 105.45 3dfq n GLY 273 Ca 0.00 -0.83 -0.38 0.00 0.00 0.00 0.00 46.02 44.81 3dfq n GLY 273 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dfq s GLN 274 N -1.64 3.76 0.92 1.61 -0.21 -0.62 -5.02 119.66 118.46 3dfq s GLN 274 Ca 0.49 1.90 -0.12 0.00 0.02 0.00 0.00 55.36 57.66 3dfq s GLN 274 Cb 0.31 -2.49 0.14 0.00 1.00 0.00 0.00 33.01 31.97 3dfq s GLN 274 CO 0.26 -0.58 1.09 -1.54 -2.12 0.00 0.00 175.29 172.40 3dfq s SER 275 N -1.18 3.30 0.13 5.90 1.04 -1.26 -4.73 113.70 116.91 3dfq s SER 275 Ca 0.62 1.39 -0.20 0.00 0.48 0.00 0.00 55.95 58.25 3dfq s SER 275 Cb -0.32 -2.07 -0.02 0.00 0.10 0.00 0.00 66.02 63.72 3dfq s SER 275 CO 0.39 -2.73 1.70 -0.33 0.98 0.00 0.00 173.24 173.25 3dfq h GLU 276 N -1.61 -0.01 -0.51 4.02 5.08 -1.87 -0.21 114.58 119.46 3dfq h GLU 276 Ca -0.51 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 57.80 3dfq h GLU 276 Cb 1.30 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.53 3dfq h GLU 276 CO 0.56 -0.00 0.11 1.49 -1.00 0.00 0.00 179.01 180.17 3dfq h GLU 277 N -0.01 0.83 -0.68 2.33 4.57 -1.92 -2.69 114.58 117.02 3dfq h GLU 277 Ca 0.11 -0.21 -0.00 0.00 -1.18 0.00 0.00 59.36 58.08 3dfq h GLU 277 Cb 0.17 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 28.62 3dfq h GLU 277 CO -0.23 0.80 0.41 1.49 -1.18 0.00 0.00 179.01 180.31 3dfq h GLU 278 N 0.71 0.92 -0.57 1.92 4.81 -1.84 -0.58 114.58 119.97 3dfq h GLU 278 Ca 0.16 -0.08 -0.03 0.00 -0.13 0.00 0.00 59.36 59.28 3dfq h GLU 278 Cb 0.35 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.51 3dfq h GLU 278 CO 0.00 0.65 0.22 0.00 -0.73 0.00 0.00 179.01 179.16 3dfq h ALA 279 N 1.22 1.33 -0.11 2.92 0.00 -0.92 -0.95 119.26 122.74 3dfq h ALA 279 Ca 0.24 -0.15 -0.15 0.00 0.00 0.00 0.00 54.91 54.85 3dfq h ALA 279 Cb -0.03 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 17.53 3dfq h ALA 279 CO -0.05 0.50 -0.52 0.77 0.00 0.00 0.00 179.25 179.95 3dfq h SER 280 N 0.81 0.65 -0.41 0.00 0.02 -1.11 -2.25 113.55 111.27 3dfq h SER 280 Ca 0.19 -0.64 -0.01 0.00 -0.84 0.00 0.00 61.79 60.50 3dfq h SER 280 Cb 0.16 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.49 3dfq h SER 280 CO -0.02 1.18 0.23 0.40 -1.14 0.00 0.00 176.83 177.48 3dfq h ILE 281 N 0.16 1.15 -0.63 3.27 2.04 -0.91 -0.44 117.51 122.15 3dfq h ILE 281 Ca -0.03 -0.37 -0.07 0.00 1.00 0.00 0.00 64.86 65.39 3dfq h ILE 281 Cb 1.16 0.65 -0.03 0.00 -0.74 0.00 0.00 36.82 37.87 3dfq h ILE 281 CO 0.11 0.15 0.14 0.78 0.00 0.00 0.00 178.15 179.33 3dfq h ASN 282 N 0.53 0.97 -0.73 1.72 2.35 -1.23 -0.38 115.58 118.81 3dfq h ASN 282 Ca 0.14 -0.24 -0.06 0.00 -0.55 0.00 0.00 56.30 55.59 3dfq h ASN 282 Cb 0.04 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.12 3dfq h ASN 282 CO -0.02 0.96 0.20 0.25 -1.65 0.00 0.00 177.43 177.17 3dfq h LEU 283 N 0.94 1.08 -0.43 1.61 5.85 -1.19 0.45 115.31 123.62 3dfq h LEU 283 Ca 0.20 -0.22 -0.04 0.00 0.84 0.00 0.00 57.88 58.66 3dfq h LEU 283 Cb 0.38 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 3dfq h LEU 283 CO 0.00 1.02 0.13 -1.13 -0.34 0.00 0.00 178.44 178.13 3dfq h ASN 284 N 1.10 0.63 -0.75 1.25 -1.24 -0.77 -1.86 115.58 113.93 3dfq h ASN 284 Ca 0.23 -0.21 -0.03 0.00 0.71 0.00 0.00 56.30 57.01 3dfq h ASN 284 Cb 0.34 -0.17 -0.04 0.00 0.73 0.00 0.00 38.32 39.19 3dfq h ASN 284 CO -0.00 0.67 0.36 0.00 -1.29 0.00 0.00 177.43 177.17 3dfq h ALA 285 N 0.98 1.20 -0.75 1.57 0.00 -0.70 -1.17 119.26 120.40 3dfq h ALA 285 Ca 0.14 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3dfq h ALA 285 Cb 0.27 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 3dfq h ALA 285 CO -0.00 0.61 0.48 0.82 0.00 0.00 0.00 179.25 181.16 3dfq h ILE 286 N 1.09 1.20 0.00 0.00 2.04 -0.59 -1.12 117.51 120.13 3dfq h ILE 286 Ca 0.26 -0.38 -0.00 0.00 1.00 0.00 0.00 64.86 65.74 3dfq h ILE 286 Cb 0.12 0.11 -0.00 0.00 -0.74 0.00 0.00 36.82 36.31 3dfq h ILE 286 CO -0.03 0.20 -0.02 0.78 0.00 0.00 0.00 178.15 179.08 3dfq h ASN 287 N 1.02 0.00 0.20 1.72 2.35 -0.62 -2.89 115.58 117.36 3dfq h ASN 287 Ca 0.27 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.02 3dfq h ASN 287 Cb -0.09 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.28 3dfq h ASN 287 CO -0.06 0.02 -0.49 0.29 -1.65 0.00 0.00 177.43 175.54 3dfq n LYS 288 N -3.11 0.58 -1.66 0.81 5.02 -0.51 -4.76 118.16 114.53 3dfq n LYS 288 Ca 0.02 -0.41 -0.47 0.00 -2.02 0.00 0.00 58.31 55.42 3dfq n LYS 288 Cb 0.38 -1.49 -0.05 0.00 -0.02 0.00 0.00 35.03 33.85 3dfq n LYS 288 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3dfq n PRO 290 N 3.91 1.67 -4.09 0.00 -0.04 -1.26 -4.80 135.00 130.39 3dfq n PRO 290 Ca 0.18 -0.92 -0.11 0.00 -0.04 0.00 0.00 63.50 62.61 3dfq n PRO 290 Cb 0.27 -2.01 -0.11 0.00 -0.04 0.00 0.00 33.50 31.61 3dfq n PRO 290 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3dfq s LEU 291 N 0.03 2.38 0.07 1.53 1.43 -1.26 -5.12 118.68 117.73 3dfq s LEU 291 Ca 0.47 -0.77 -0.31 0.00 -1.03 0.00 0.00 54.13 52.50 3dfq s LEU 291 Cb 0.20 -0.03 -0.06 0.00 0.03 0.00 0.00 46.19 46.32 3dfq s LEU 291 CO -0.01 -0.37 1.28 -0.22 0.23 0.00 0.00 176.35 177.26 3dfq s LEU 292 N -2.26 4.36 -0.32 1.79 0.20 -1.26 -5.00 118.68 116.19 3dfq s LEU 292 Ca -0.01 2.13 0.01 0.00 0.69 0.00 0.00 54.13 56.95 3dfq s LEU 292 Cb -0.02 -3.58 0.10 0.00 -0.43 0.00 0.00 46.19 42.26 3dfq s LEU 292 CO -0.03 -0.55 0.07 -0.54 -0.29 0.00 0.00 176.35 175.01 3dfq s LYS 293 N 1.18 1.07 0.00 1.98 1.02 -1.26 -4.97 119.74 118.77 3dfq s LYS 293 Ca 0.61 -1.41 0.04 0.00 0.02 0.00 0.00 55.97 55.22 3dfq s LYS 293 Cb -0.32 -2.53 0.23 0.00 -0.52 0.00 0.00 37.83 34.69 3dfq s LYS 293 CO 0.29 -0.95 0.91 -0.35 -0.92 0.00 0.00 175.35 174.32 3dfq n PRO 294 N 4.59 0.74 -4.08 -1.68 -0.04 -1.26 -4.79 135.00 128.48 3dfq n PRO 294 Ca 0.00 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.36 3dfq n PRO 294 Cb 0.42 -1.08 -0.11 0.00 -0.04 0.00 0.00 33.50 32.69 3dfq n PRO 294 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 3dfq s TRP 295 N -2.00 0.59 0.34 0.54 0.51 -1.26 -4.90 118.94 112.76 3dfq s TRP 295 Ca 0.06 -0.75 -0.29 0.00 -2.12 0.00 0.00 56.10 53.00 3dfq s TRP 295 Cb 0.03 -0.38 -0.11 0.00 -0.81 0.00 0.00 33.47 32.20 3dfq s TRP 295 CO 0.04 -0.20 1.38 0.00 -0.51 0.00 0.00 176.95 177.67 3dfq s ALA 296 N -2.57 3.54 -0.39 0.98 0.00 -1.23 -4.84 121.76 117.26 3dfq s ALA 296 Ca -0.02 1.38 0.03 0.00 0.00 0.00 0.00 51.96 53.35 3dfq s ALA 296 Cb -0.02 -3.53 0.11 0.00 0.00 0.00 0.00 23.12 19.68 3dfq s ALA 296 CO -0.04 -0.80 0.11 -0.51 0.00 0.00 0.00 175.76 174.53 3dfq s LEU 297 N -1.76 4.74 0.00 0.00 1.43 -1.26 -0.51 118.68 121.32 3dfq s LEU 297 Ca 0.51 -2.32 0.00 0.00 -1.03 0.00 0.00 54.13 51.29 3dfq s LEU 297 Cb -0.42 -1.66 0.00 0.00 0.03 0.00 0.00 46.19 44.14 3dfq s LEU 297 CO 0.56 -0.37 0.00 1.07 0.23 0.00 0.00 176.35 177.84 3dfq n THR 298 N 4.05 0.00 -4.33 5.49 5.66 0.06 -4.63 114.28 120.58 3dfq n THR 298 Ca 0.04 0.00 -0.25 0.00 -3.05 0.00 0.00 64.05 60.79 3dfq n THR 298 Cb 0.40 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 69.09 3dfq n THR 298 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 175.07 172.74 3dfq s PHE 299 N 0.12 2.58 -0.43 1.09 -0.71 -1.26 -1.34 117.98 118.02 3dfq s PHE 299 Ca 0.00 -0.25 0.07 0.00 -1.04 0.00 0.00 56.93 55.71 3dfq s PHE 299 Cb 0.00 -1.19 0.22 0.00 -1.21 0.00 0.00 43.02 40.84 3dfq s PHE 299 CO 0.00 0.59 0.57 0.45 -1.34 0.00 0.00 175.22 175.49 3dfq n SER 300 N -0.41 -0.91 -4.89 1.98 2.88 -0.58 0.19 113.62 111.88 3dfq n SER 300 Ca -0.08 -2.76 -0.34 0.00 -1.33 0.00 0.00 58.87 54.36 3dfq n SER 300 Cb 0.58 0.08 -0.05 0.00 -0.75 0.00 0.00 64.21 64.06 3dfq n SER 300 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 3dfq s TYR 301 N -0.35 3.57 0.00 0.66 2.02 -0.91 -4.38 117.35 117.95 3dfq s TYR 301 Ca 0.34 0.46 0.00 0.00 -0.37 0.00 0.00 57.07 57.50 3dfq s TYR 301 Cb 0.14 -1.90 0.00 0.00 -0.40 0.00 0.00 41.96 39.79 3dfq s TYR 301 CO -0.15 0.65 0.00 0.41 -1.57 0.00 0.00 175.55 174.88 3dfq n GLY 302 N 1.14 0.07 0.33 0.71 0.00 -1.26 -0.55 105.19 105.63 3dfq n GLY 302 Ca -0.12 0.00 0.07 0.00 0.00 0.00 0.00 46.02 45.96 3dfq n GLY 302 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3dfq h ARG 303 N 0.00 0.54 0.00 1.61 3.08 -1.93 -0.68 114.38 117.00 3dfq h ARG 303 Ca 0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.02 3dfq h ARG 303 Cb 0.00 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 29.93 3dfq h ARG 303 CO 0.00 0.36 0.00 0.00 -1.07 0.00 0.00 179.97 179.26 3dfq n ALA 304 N -2.48 1.40 -0.01 0.04 0.00 -1.26 -0.71 120.51 117.49 3dfq n ALA 304 Ca 0.06 -0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.51 3dfq n ALA 304 Cb 0.18 -1.18 -0.03 0.00 0.00 0.00 0.00 19.45 18.42 3dfq n ALA 304 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3dfq n LEU 305 N -1.63 0.00 -0.00 0.00 4.77 -0.41 -4.65 117.00 115.08 3dfq n LEU 305 Ca 0.02 0.00 0.07 0.00 -0.03 0.00 0.00 56.01 56.07 3dfq n LEU 305 Cb 0.11 0.02 -0.10 0.00 -2.33 0.00 0.00 43.42 41.12 3dfq n LEU 305 CO 0.09 0.02 -0.52 0.00 -1.33 0.00 0.00 177.39 175.66 3dfq n GLN 306 N -1.76 0.92 -0.11 3.23 6.02 -0.40 -4.53 117.38 120.75 3dfq n GLN 306 Ca -0.02 -0.10 -0.03 0.00 -0.01 0.00 0.00 57.00 56.84 3dfq n GLN 306 Cb 0.23 -1.29 -0.03 0.00 1.02 0.00 0.00 30.24 30.17 3dfq n GLN 306 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3dfq h ALA 307 N 1.44 -0.20 -0.45 -1.58 0.00 -1.15 0.11 119.26 117.44 3dfq h ALA 307 Ca 0.00 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 3dfq h ALA 307 Cb 0.57 1.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.40 3dfq h ALA 307 CO 0.00 -0.32 0.11 0.77 0.00 0.00 0.00 179.25 179.81 3dfq h SER 308 N -0.02 0.61 -0.33 0.00 0.02 -1.86 -2.64 113.55 109.33 3dfq h SER 308 Ca 0.04 -0.10 -0.02 0.00 -0.84 0.00 0.00 61.79 60.88 3dfq h SER 308 Cb 0.13 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.49 3dfq h SER 308 CO -0.26 0.61 0.13 0.00 -1.14 0.00 0.00 176.83 176.17 3dfq h ALA 309 N 1.47 0.43 -0.39 3.77 0.00 -1.59 0.79 119.26 123.75 3dfq h ALA 309 Ca 0.15 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.94 3dfq h ALA 309 Cb 0.25 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 3dfq h ALA 309 CO -0.00 0.04 0.24 1.25 0.00 0.00 0.00 179.25 180.77 3dfq h LEU 310 N 0.39 0.39 -0.33 0.00 5.85 -0.61 -0.14 115.31 120.85 3dfq h LEU 310 Ca 0.11 -0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.78 3dfq h LEU 310 Cb 0.20 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 3dfq h LEU 310 CO -0.01 0.28 -0.00 0.50 -0.34 0.00 0.00 178.44 178.87 3dfq h LYS 311 N 0.48 0.58 -0.62 1.25 3.64 -1.30 -1.86 116.57 118.74 3dfq h LYS 311 Ca 0.15 -0.18 0.02 0.00 -1.27 0.00 0.00 60.65 59.37 3dfq h LYS 311 Cb -0.01 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.72 3dfq h LYS 311 CO -0.06 0.71 0.39 0.00 -2.27 0.00 0.00 179.45 178.22 3dfq h ALA 312 N 0.85 0.80 0.41 5.00 0.00 -0.62 -2.88 119.26 122.81 3dfq h ALA 312 Ca 0.09 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3dfq h ALA 312 Cb 0.45 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 3dfq h ALA 312 CO 0.02 0.16 -0.25 2.35 0.00 0.00 0.00 179.25 181.53 3dfq h TRP 313 N 0.78 -0.65 0.00 0.00 7.01 -0.89 -3.43 115.95 118.77 3dfq h TRP 313 Ca 0.24 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.23 3dfq h TRP 313 Cb -0.03 0.23 0.00 0.00 -2.10 0.00 0.00 29.16 27.27 3dfq h TRP 313 CO -0.04 -0.39 0.00 0.41 -2.79 0.00 0.00 178.44 175.63 3dfq n GLY 314 N -1.38 0.10 1.67 2.65 0.00 -0.71 -1.61 105.19 105.91 3dfq n GLY 314 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 3dfq n GLY 314 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dfq n GLY 315 N -0.37 0.56 3.42 -0.02 0.00 -1.26 -4.81 105.19 102.71 3dfq n GLY 315 Ca 0.00 -0.24 -0.35 0.00 0.00 0.00 0.00 46.02 45.43 3dfq n GLY 315 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dfq s LYS 316 N -0.56 3.59 0.49 1.61 1.02 -0.63 -4.99 119.74 120.27 3dfq s LYS 316 Ca 0.00 -0.52 0.20 0.00 0.02 0.00 0.00 55.97 55.67 3dfq s LYS 316 Cb 0.00 -3.16 1.24 0.00 -0.52 0.00 0.00 37.83 35.38 3dfq s LYS 316 CO 0.00 -0.10 1.98 -0.22 -0.92 0.00 0.00 175.35 176.09 3dfq h LYS 317 N 7.88 0.18 0.00 1.68 3.64 -1.96 -0.25 116.57 127.74 3dfq h LYS 317 Ca -0.38 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.99 3dfq h LYS 317 Cb 1.17 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 3dfq h LYS 317 CO 0.60 0.12 0.00 0.93 -2.27 0.00 0.00 179.45 178.83 3dfq h GLU 318 N 0.18 0.00 -0.70 1.90 3.07 -1.94 -2.44 114.58 114.65 3dfq h GLU 318 Ca 0.28 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.14 3dfq h GLU 318 Cb 0.85 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.76 3dfq h GLU 318 CO -0.05 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.65 3dfq n ASN 319 N -2.32 4.14 -0.10 1.42 3.02 -0.10 -4.64 115.26 116.67 3dfq n ASN 319 Ca 0.01 -2.14 -0.14 0.00 -0.03 0.00 0.00 54.58 52.28 3dfq n ASN 319 Cb 0.17 -0.51 -0.09 0.00 -0.61 0.00 0.00 39.78 38.73 3dfq n ASN 319 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 3dfq h LEU 320 N 4.16 -1.79 -0.24 3.41 5.85 -1.55 0.15 115.31 125.30 3dfq h LEU 320 Ca 0.00 0.23 0.04 0.00 0.84 0.00 0.00 57.88 58.99 3dfq h LEU 320 Cb 1.12 0.73 -0.04 0.00 0.37 0.00 0.00 40.66 42.84 3dfq h LEU 320 CO 0.08 -0.42 -0.01 0.11 -0.34 0.00 0.00 178.44 177.86 3dfq h LYS 321 N -0.44 0.07 -0.95 1.25 1.79 -1.86 0.18 116.57 116.61 3dfq h LYS 321 Ca 0.07 -0.00 0.06 0.00 -2.18 0.00 0.00 60.65 58.59 3dfq h LYS 321 Cb 0.62 -0.01 -0.06 0.00 -1.58 0.00 0.00 32.23 31.19 3dfq h LYS 321 CO -0.55 0.04 0.61 0.00 -1.08 0.00 0.00 179.45 178.46 3dfq h ALA 322 N 1.21 1.30 -0.30 3.86 0.00 -1.78 -0.19 119.26 123.35 3dfq h ALA 322 Ca 0.11 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 3dfq h ALA 322 Cb 0.15 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3dfq h ALA 322 CO -0.20 0.40 -0.06 0.00 0.00 0.00 0.00 179.25 179.39 3dfq h ALA 323 N 1.43 0.41 -0.11 0.00 0.00 -0.40 -2.85 119.26 117.74 3dfq h ALA 323 Ca 0.40 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 3dfq h ALA 323 Cb 0.13 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3dfq h ALA 323 CO -0.16 0.23 -0.23 1.96 0.00 0.00 0.00 179.25 181.05 3dfq h GLN 324 N 0.34 0.19 -0.38 0.00 4.20 -0.48 -2.54 115.11 116.45 3dfq h GLN 324 Ca 0.08 -0.06 -0.09 0.00 0.06 0.00 0.00 58.65 58.64 3dfq h GLN 324 Cb 0.54 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.29 3dfq h GLN 324 CO 0.03 0.42 -0.13 1.49 -0.67 0.00 0.00 178.83 179.96 3dfq h GLU 325 N 0.18 0.68 -0.48 1.46 4.57 -0.93 -0.17 114.58 119.90 3dfq h GLU 325 Ca 0.03 -0.22 -0.08 0.00 -1.18 0.00 0.00 59.36 57.90 3dfq h GLU 325 Cb 0.51 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.02 3dfq h GLU 325 CO 0.03 0.79 -0.02 0.93 -1.18 0.00 0.00 179.01 179.56 3dfq h GLU 326 N 0.62 0.85 -0.20 1.92 4.39 -1.22 -1.42 114.58 119.51 3dfq h GLU 326 Ca 0.11 -0.28 -0.03 0.00 0.34 0.00 0.00 59.36 59.50 3dfq h GLU 326 Cb 0.58 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.15 3dfq h GLU 326 CO 0.04 0.91 0.03 -0.92 -1.16 0.00 0.00 179.01 177.91 3dfq h TYR 327 N 0.71 0.36 -1.00 4.33 3.20 -1.23 -2.79 116.97 120.55 3dfq h TYR 327 Ca 0.13 -0.05 0.05 0.00 3.14 0.00 0.00 58.73 62.00 3dfq h TYR 327 Cb 0.54 -0.10 -0.06 0.00 1.54 0.00 0.00 36.73 38.65 3dfq h TYR 327 CO 0.04 0.49 0.65 0.28 -1.64 0.00 0.00 178.16 177.98 3dfq h VAL 328 N 0.13 1.14 -0.73 1.81 2.07 -0.94 -0.56 116.25 119.17 3dfq h VAL 328 Ca 0.06 -0.42 -0.04 0.00 0.82 0.00 0.00 66.70 67.13 3dfq h VAL 328 Cb 0.33 -0.19 -0.03 0.00 -1.52 0.00 0.00 31.29 29.87 3dfq h VAL 328 CO 0.01 0.22 0.31 0.11 0.02 0.00 0.00 177.57 178.24 3dfq h LYS 329 N 1.22 1.06 -0.01 1.57 1.57 -1.12 -0.91 116.57 119.95 3dfq h LYS 329 Ca 0.41 -0.17 -0.18 0.00 -1.87 0.00 0.00 60.65 58.84 3dfq h LYS 329 Cb 0.07 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.18 3dfq h LYS 329 CO -0.14 0.84 -0.82 0.00 -0.57 0.00 0.00 179.45 178.75 3dfq h ARG 330 N 1.04 0.15 -0.46 3.15 2.47 -1.10 -2.00 114.38 117.65 3dfq h ARG 330 Ca 0.25 -0.16 -0.05 0.00 -1.26 0.00 0.00 59.98 58.76 3dfq h ARG 330 Cb 0.16 0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.51 3dfq h ARG 330 CO -0.03 0.89 0.11 0.00 0.56 0.00 0.00 179.97 181.50 3dfq h ALA 331 N 1.06 0.60 -0.54 0.04 0.00 -0.72 -1.34 119.26 118.36 3dfq h ALA 331 Ca -0.03 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 3dfq h ALA 331 Cb 1.43 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 3dfq h ALA 331 CO 0.12 0.29 0.08 -0.07 0.00 0.00 0.00 179.25 179.67 3dfq h LEU 332 N 0.61 0.86 -0.10 0.00 3.38 -1.15 -1.33 115.31 117.58 3dfq h LEU 332 Ca 0.14 -0.27 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 3dfq h LEU 332 Cb 0.33 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 3dfq h LEU 332 CO 0.00 0.91 0.05 0.00 0.09 0.00 0.00 178.44 179.49 3dfq h ALA 333 N 0.98 0.13 0.00 1.53 0.00 -1.20 -2.34 119.26 118.37 3dfq h ALA 333 Ca 0.16 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 3dfq h ALA 333 Cb 0.42 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3dfq h ALA 333 CO 0.01 -0.32 -0.36 -0.91 0.00 0.00 0.00 179.25 177.66 3dfq h ASN 334 N 0.06 0.00 -0.57 0.00 2.35 -1.21 -0.85 115.58 115.36 3dfq h ASN 334 Ca 0.04 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.70 3dfq h ASN 334 Cb 0.09 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.44 3dfq h ASN 334 CO -0.01 0.36 0.04 -1.28 -1.65 0.00 0.00 177.43 174.89 3dfq h SER 335 N 0.00 0.98 -0.25 5.81 0.87 -1.00 -0.85 113.55 119.12 3dfq h SER 335 Ca -0.00 -0.25 -0.19 0.00 -1.23 0.00 0.00 61.79 60.11 3dfq h SER 335 Cb 0.77 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.47 3dfq h SER 335 CO 0.05 1.01 -0.58 -0.07 -0.53 0.00 0.00 176.83 176.71 3dfq h LEU 336 N 0.94 0.95 -1.09 2.23 3.38 -1.01 -3.25 115.31 117.46 3dfq h LEU 336 Ca 0.18 -0.53 -0.04 0.00 0.09 0.00 0.00 57.88 57.58 3dfq h LEU 336 Cb 0.49 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 3dfq h LEU 336 CO 0.02 1.32 0.21 0.00 0.09 0.00 0.00 178.44 180.09 3dfq h ALA 337 N 0.69 1.27 0.00 1.53 0.00 -0.76 0.51 119.26 122.50 3dfq h ALA 337 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3dfq h ALA 337 Cb 1.19 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.74 3dfq h ALA 337 CO 0.13 0.53 0.00 0.00 0.00 0.00 0.00 179.25 179.90 3dfq n GLN 339 N -0.55 2.25 -1.18 0.00 6.02 -0.65 -4.62 117.38 118.64 3dfq n GLN 339 Ca 0.02 -0.19 -0.06 0.00 -0.01 0.00 0.00 57.00 56.75 3dfq n GLN 339 Cb 0.01 -0.63 -0.03 0.00 1.02 0.00 0.00 30.24 30.61 3dfq n GLN 339 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3dfq n GLY 340 N 0.38 0.87 0.92 1.08 0.00 -0.58 -4.90 105.19 102.96 3dfq n GLY 340 Ca 0.00 -0.65 0.07 0.00 0.00 0.00 0.00 46.02 45.45 3dfq n GLY 340 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3dfq n LYS 341 N -2.67 3.03 -2.63 1.61 5.02 0.08 -4.87 118.16 117.74 3dfq n LYS 341 Ca -0.06 -2.43 -0.40 0.00 -2.02 0.00 0.00 58.31 53.39 3dfq n LYS 341 Cb 0.23 -1.54 -0.05 0.00 -0.02 0.00 0.00 35.03 33.65 3dfq n LYS 341 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 3dfq s TYR 342 N -1.57 3.78 -0.03 2.13 5.04 -1.16 -4.82 117.35 120.72 3dfq s TYR 342 Ca 0.35 1.78 -0.06 0.00 -2.44 0.00 0.00 57.07 56.70 3dfq s TYR 342 Cb 0.22 -3.13 0.01 0.00 0.35 0.00 0.00 41.96 39.41 3dfq s TYR 342 CO 0.17 -0.04 0.14 0.95 -1.34 0.00 0.00 175.55 175.43 3dfq s THR 343 N -0.76 0.04 0.41 4.34 -4.23 -1.25 -4.96 115.64 109.23 3dfq s THR 343 Ca 0.45 -0.34 0.16 0.00 -1.18 0.00 0.00 61.69 60.78 3dfq s THR 343 Cb -0.28 -0.32 0.37 0.00 1.34 0.00 0.00 72.50 73.62 3dfq s THR 343 CO 0.34 -0.19 1.86 -0.65 -0.54 0.00 0.00 174.62 175.45 3dfq h PRO 344 N 5.14 0.43 -0.98 3.99 0.11 -1.96 -1.54 132.00 137.18 3dfq h PRO 344 Ca -0.28 -0.03 0.03 0.00 0.11 0.00 0.00 66.00 65.84 3dfq h PRO 344 Cb 1.20 -0.10 -0.06 0.00 0.11 0.00 0.00 31.00 32.15 3dfq h PRO 344 CO 0.41 0.29 0.64 0.66 -0.21 0.00 0.00 178.00 179.79 3dfq h SER 345 N 0.45 1.08 0.00 -2.05 4.64 -1.96 -3.49 113.55 112.21 3dfq h SER 345 Ca 0.46 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.76 3dfq h SER 345 Cb 1.07 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 3dfq h SER 345 CO -0.18 0.74 0.00 0.61 -0.87 0.00 0.00 176.83 177.14 3dfq n GLY 346 N -1.38 0.36 0.13 -0.77 0.00 -0.58 -4.83 105.19 98.12 3dfq n GLY 346 Ca 0.13 -0.44 0.12 0.00 0.00 0.00 0.00 46.02 45.83 3dfq n GLY 346 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3dfq h GLN 347 N 0.00 0.00 0.41 1.61 1.08 -1.92 -3.34 115.11 112.95 3dfq h GLN 347 Ca 0.00 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.18 3dfq h GLN 347 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 3dfq h GLN 347 CO 0.00 0.00 -0.20 0.00 -0.95 0.00 0.00 178.83 177.68 3dfq h ALA 348 N 2.25 -0.55 -1.95 3.87 0.00 -1.90 -3.49 119.26 117.49 3dfq h ALA 348 Ca 0.00 -0.18 -0.58 0.00 0.00 0.00 0.00 54.91 54.15 3dfq h ALA 348 Cb 0.87 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 3dfq h ALA 348 CO 0.00 -0.58 1.49 0.45 0.00 0.00 0.00 179.25 180.61 3dfq s SER 359 N -4.95 5.42 0.55 0.00 0.15 -1.26 -4.62 113.70 108.99 3dfq s SER 359 Ca -0.12 1.80 0.30 0.00 0.70 0.00 0.00 55.95 58.63 3dfq s SER 359 Cb 0.01 -2.51 1.63 0.00 -1.71 0.00 0.00 66.02 63.45 3dfq s SER 359 CO 0.41 -2.01 2.14 -1.13 1.20 0.00 0.00 173.24 173.85 3dfq h ASN 360 N 15.21 0.00 0.60 5.45 -1.24 -2.02 -0.99 115.58 132.59 3dfq h ASN 360 Ca -0.39 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.62 3dfq h ASN 360 Cb 1.24 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.29 3dfq h ASN 360 CO 0.98 0.07 0.00 1.41 -1.29 0.00 0.00 177.43 178.60 3dfq n HIS 361 N -3.58 0.00 1.53 0.67 8.25 -1.26 -2.42 115.22 118.42 3dfq n HIS 361 Ca -0.02 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.56 3dfq n HIS 361 Cb 0.19 -0.35 0.53 0.00 1.12 0.00 0.00 29.99 31.48 3dfq n HIS 361 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3dfq n ALA 362 N -1.35 2.57 0.32 -1.41 0.00 -0.37 -5.31 120.51 114.96 3dfq n ALA 362 Ca 0.10 -0.39 0.04 0.00 0.00 0.00 0.00 53.44 53.19 3dfq n ALA 362 Cb 0.23 -1.20 0.03 0.00 0.00 0.00 0.00 19.45 18.51 3dfq n ALA 362 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16