#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dfi n ASP 2 N 0.00 0.00 -0.24 7.83 -0.08 -1.26 -1.36 116.55 121.44 2dfi n ASP 2 Ca 0.00 0.66 0.01 0.00 -1.51 0.00 0.00 54.79 53.95 2dfi n ASP 2 Cb 0.00 -0.16 0.08 0.00 2.34 0.00 0.00 41.12 43.38 2dfi n ASP 2 CO 0.00 0.00 0.00 0.74 0.12 0.00 0.00 177.20 178.06 2dfi h THR 3 N 0.00 0.30 -0.11 5.18 2.02 -1.99 -0.62 112.91 117.69 2dfi h THR 3 Ca 0.00 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.21 2dfi h THR 3 Cb 0.00 0.30 -0.04 0.00 -1.74 0.00 0.00 68.15 66.67 2dfi h THR 3 CO 0.00 0.00 -0.11 -0.33 0.37 0.00 0.00 175.52 175.45 2dfi h GLU 4 N -0.00 -0.14 -0.79 6.66 5.08 -1.61 0.13 114.58 123.91 2dfi h GLU 4 Ca 0.33 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.69 2dfi h GLU 4 Cb 0.51 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.76 2dfi h GLU 4 CO -0.72 -0.09 0.44 0.87 -1.00 0.00 0.00 179.01 178.51 2dfi h LYS 5 N -0.14 1.10 -0.03 2.33 1.57 -0.31 -1.02 116.57 120.07 2dfi h LYS 5 Ca 0.08 -0.12 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2dfi h LYS 5 Cb 0.26 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.35 2dfi h LYS 5 CO -0.20 0.81 0.02 1.25 -0.57 0.00 0.00 179.45 180.76 2dfi h LEU 6 N 1.09 0.04 -1.35 2.94 5.85 -0.62 -0.41 115.31 122.84 2dfi h LEU 6 Ca 0.28 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.90 2dfi h LEU 6 Cb 0.02 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 2dfi h LEU 6 CO -0.05 0.11 0.31 0.24 -0.34 0.00 0.00 178.44 178.71 2dfi h MET 7 N -0.04 0.74 -0.54 1.25 2.86 -0.57 0.53 114.93 119.16 2dfi h MET 7 Ca 0.01 -0.07 -0.08 0.00 -2.06 0.00 0.00 59.70 57.50 2dfi h MET 7 Cb 0.08 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.57 2dfi h MET 7 CO -0.00 0.54 0.03 -0.22 1.06 0.00 0.00 176.91 178.32 2dfi h LYS 8 N 0.76 0.94 -0.37 1.72 1.63 -0.74 0.11 116.57 120.62 2dfi h LYS 8 Ca 0.20 -0.28 -0.06 0.00 -0.85 0.00 0.00 60.65 59.65 2dfi h LYS 8 Cb 0.01 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 31.53 2dfi h LYS 8 CO -0.03 0.94 -0.04 0.00 -3.45 0.00 0.00 179.45 176.86 2dfi h ALA 9 N 0.97 1.24 -0.45 5.00 0.00 -0.15 -2.19 119.26 123.68 2dfi h ALA 9 Ca 0.16 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 2dfi h ALA 9 Cb 0.49 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2dfi h ALA 9 CO 0.02 0.50 0.12 0.78 0.00 0.00 0.00 179.25 180.68 2dfi h GLY 10 N 0.91 0.77 0.97 0.00 0.00 -0.12 -0.57 103.07 105.02 2dfi h GLY 10 Ca 0.11 -0.47 0.01 0.00 0.00 0.00 0.00 47.33 46.98 2dfi h GLY 10 CO 0.02 0.44 0.34 -2.09 0.00 0.00 0.00 176.54 175.25 2dfi h GLU 11 N 0.59 0.68 -0.07 4.80 4.81 -0.44 -0.44 114.58 124.51 2dfi h GLU 11 Ca 0.14 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.32 2dfi h GLU 11 Cb 0.30 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 29.52 2dfi h GLU 11 CO -0.00 0.45 0.01 0.82 -0.73 0.00 0.00 179.01 179.56 2dfi h ILE 12 N 0.70 1.20 -0.90 2.32 2.04 -1.28 -2.26 117.51 119.33 2dfi h ILE 12 Ca 0.20 -0.62 0.17 0.00 1.00 0.00 0.00 64.86 65.61 2dfi h ILE 12 Cb -0.05 1.49 -0.10 0.00 -0.74 0.00 0.00 36.82 37.41 2dfi h ILE 12 CO -0.06 0.17 0.48 0.00 0.00 0.00 0.00 178.15 178.75 2dfi h ALA 13 N 0.79 1.41 -0.19 1.87 0.00 -0.77 0.25 119.26 122.61 2dfi h ALA 13 Ca 0.02 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2dfi h ALA 13 Cb 0.26 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2dfi h ALA 13 CO 0.00 -0.10 0.07 0.87 0.00 0.00 0.00 179.25 180.08 2dfi h LYS 14 N 0.64 0.29 -0.28 0.00 1.57 -0.82 0.55 116.57 118.52 2dfi h LYS 14 Ca 0.51 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 59.21 2dfi h LYS 14 Cb 0.77 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.02 2dfi h LYS 14 CO -0.39 0.38 0.10 0.87 -0.57 0.00 0.00 179.45 179.84 2dfi h LYS 15 N 0.14 0.43 -0.98 3.15 1.57 -0.75 -1.96 116.57 118.18 2dfi h LYS 15 Ca 0.06 -0.09 0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2dfi h LYS 15 Cb 0.21 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.40 2dfi h LYS 15 CO -0.00 0.48 0.65 0.28 -0.57 0.00 0.00 179.45 180.28 2dfi h VAL 16 N 0.29 1.24 -0.45 0.50 2.07 -0.92 -2.05 116.25 116.93 2dfi h VAL 16 Ca 0.09 -0.45 -0.05 0.00 0.82 0.00 0.00 66.70 67.11 2dfi h VAL 16 Cb 0.22 -0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 29.79 2dfi h VAL 16 CO -0.00 0.24 0.08 -0.09 0.02 0.00 0.00 177.57 177.81 2dfi h ARG 17 N 1.31 0.75 -0.42 1.57 2.43 -0.65 -2.01 114.38 117.36 2dfi h ARG 17 Ca 0.36 -0.20 -0.02 0.00 -0.81 0.00 0.00 59.98 59.31 2dfi h ARG 17 Cb -0.13 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.31 2dfi h ARG 17 CO -0.08 0.77 0.18 0.93 -1.51 0.00 0.00 179.97 180.25 2dfi h GLU 18 N 0.61 0.62 -0.53 0.20 4.39 -1.05 -2.03 114.58 116.79 2dfi h GLU 18 Ca 0.14 -0.11 0.01 0.00 0.34 0.00 0.00 59.36 59.75 2dfi h GLU 18 Cb 0.38 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 28.89 2dfi h GLU 18 CO 0.01 0.57 0.34 -0.22 -1.16 0.00 0.00 179.01 178.55 2dfi h LYS 19 N 0.54 0.66 -0.58 2.33 1.63 -1.29 -2.03 116.57 117.83 2dfi h LYS 19 Ca 0.14 -0.04 0.04 0.00 -0.85 0.00 0.00 60.65 59.94 2dfi h LYS 19 Cb 0.17 -0.15 -0.04 0.00 -0.60 0.00 0.00 32.23 31.61 2dfi h LYS 19 CO -0.01 0.44 0.33 0.00 -3.45 0.00 0.00 179.45 176.76 2dfi h ALA 20 N 1.22 0.75 -0.99 5.00 0.00 -1.17 -0.57 119.26 123.50 2dfi h ALA 20 Ca 0.21 0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.15 2dfi h ALA 20 Cb -0.03 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.56 2dfi h ALA 20 CO -0.07 0.03 0.65 0.82 0.00 0.00 0.00 179.25 180.69 2dfi h ILE 21 N 0.65 1.17 0.00 0.00 2.04 -0.86 0.11 117.51 120.61 2dfi h ILE 21 Ca 0.24 -0.43 -0.11 0.00 1.00 0.00 0.00 64.86 65.56 2dfi h ILE 21 Cb 0.08 -0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 35.95 2dfi h ILE 21 CO -0.13 0.23 -0.52 0.50 0.00 0.00 0.00 178.15 178.23 2dfi h LYS 22 N 1.25 0.00 0.00 2.37 3.64 -0.64 -2.90 116.57 120.29 2dfi h LYS 22 Ca 0.40 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.78 2dfi h LYS 22 Cb 0.01 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 2dfi h LYS 22 CO -0.12 0.52 -0.49 1.28 -2.27 0.00 0.00 179.45 178.36 2dfi n LEU 23 N -3.90 0.71 -3.55 5.20 4.77 -0.30 -4.55 117.00 115.38 2dfi n LEU 23 Ca -0.01 0.29 -0.40 0.00 -0.03 0.00 0.00 56.01 55.86 2dfi n LEU 23 Cb 0.54 -0.21 -0.01 0.00 -2.33 0.00 0.00 43.42 41.40 2dfi n LEU 23 CO 0.41 -0.07 2.89 0.00 -1.33 0.00 0.00 177.39 179.28 2dfi n ALA 24 N -1.81 6.06 -2.55 -1.18 0.00 0.27 -4.83 120.51 116.47 2dfi n ALA 24 Ca 0.04 -3.63 -0.24 0.00 0.00 0.00 0.00 53.44 49.61 2dfi n ALA 24 Cb 0.43 -3.47 -0.08 0.00 0.00 0.00 0.00 19.45 16.33 2dfi n ALA 24 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2dfi s ARG 25 N 2.98 2.05 0.19 0.00 3.03 -1.26 -4.54 118.95 121.40 2dfi s ARG 25 Ca 0.55 -1.65 -0.33 0.00 2.03 0.00 0.00 55.73 56.33 2dfi s ARG 25 Cb 0.15 -1.96 -0.15 0.00 -1.03 0.00 0.00 34.95 31.96 2dfi s ARG 25 CO -0.06 0.25 1.31 -2.30 -1.13 0.00 0.00 175.30 173.37 2dfi n PRO 26 N -0.86 1.58 0.00 3.89 -0.02 -1.26 -1.65 135.00 136.68 2dfi n PRO 26 Ca -0.05 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 2dfi n PRO 26 Cb 0.61 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 2dfi n PRO 26 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dfi n GLY 27 N 2.27 2.22 3.69 -1.23 0.00 0.11 -4.98 105.19 107.27 2dfi n GLY 27 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2dfi n GLY 27 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2dfi s MET 28 N -0.75 4.25 0.05 1.61 -1.94 -0.66 -4.67 119.30 117.19 2dfi s MET 28 Ca 0.00 2.12 -0.31 0.00 -1.71 0.00 0.00 55.69 55.80 2dfi s MET 28 Cb 0.00 -3.58 -0.06 0.00 2.01 0.00 0.00 34.83 33.20 2dfi s MET 28 CO 0.00 -0.64 1.28 -1.17 -0.01 0.00 0.00 175.02 174.48 2dfi s LEU 29 N 2.48 4.35 0.21 -0.03 2.96 -1.26 -0.89 118.68 126.50 2dfi s LEU 29 Ca 0.68 2.09 -0.09 0.00 -0.22 0.00 0.00 54.13 56.59 2dfi s LEU 29 Cb -0.35 -3.58 0.26 0.00 0.50 0.00 0.00 46.19 43.03 2dfi s LEU 29 CO 0.29 -0.57 1.80 -0.07 -1.32 0.00 0.00 176.35 176.48 2dfi h LEU 30 N 7.20 0.54 -0.58 -0.68 3.38 -1.60 -2.13 115.31 121.42 2dfi h LEU 30 Ca -0.40 0.04 0.07 0.00 0.09 0.00 0.00 57.88 57.67 2dfi h LEU 30 Cb 1.20 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 41.83 2dfi h LEU 30 CO 0.85 0.34 0.27 0.25 0.09 0.00 0.00 178.44 180.23 2dfi h LEU 31 N 0.67 0.34 -0.62 1.67 7.12 -1.82 -0.12 115.31 122.56 2dfi h LEU 31 Ca 0.31 0.05 -0.04 0.00 0.13 0.00 0.00 57.88 58.33 2dfi h LEU 31 Cb 0.23 -0.01 -0.03 0.00 -0.53 0.00 0.00 40.66 40.33 2dfi h LEU 31 CO -0.20 0.22 0.22 -0.08 -0.13 0.00 0.00 178.44 178.47 2dfi h GLU 32 N 0.50 0.94 0.72 1.25 4.81 -1.83 -1.30 114.58 119.67 2dfi h GLU 32 Ca 0.27 -0.19 -0.03 0.00 -0.13 0.00 0.00 59.36 59.28 2dfi h GLU 32 Cb 0.25 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.49 2dfi h GLU 32 CO -0.22 0.81 -0.37 1.25 -0.73 0.00 0.00 179.01 179.75 2dfi h LEU 33 N 0.87 -0.88 -1.08 1.64 5.85 -0.75 -0.28 115.31 120.68 2dfi h LEU 33 Ca 0.20 0.04 0.15 0.00 0.84 0.00 0.00 57.88 59.11 2dfi h LEU 33 Cb 0.24 0.24 -0.09 0.00 0.37 0.00 0.00 40.66 41.42 2dfi h LEU 33 CO -0.01 -0.61 0.62 0.00 -0.34 0.00 0.00 178.44 178.09 2dfi h ALA 34 N -0.72 1.66 0.01 1.25 0.00 -0.96 -1.11 119.26 119.38 2dfi h ALA 34 Ca -0.10 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2dfi h ALA 34 Cb 0.77 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2dfi h ALA 34 CO 0.15 0.05 -0.00 0.93 0.00 0.00 0.00 179.25 180.38 2dfi h GLU 35 N 0.84 -0.01 -0.95 0.00 4.39 -1.00 -1.98 114.58 115.87 2dfi h GLU 35 Ca 0.51 0.00 0.06 0.00 0.34 0.00 0.00 59.36 60.27 2dfi h GLU 35 Cb 0.69 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 29.28 2dfi h GLU 35 CO -0.29 0.33 0.61 0.77 -1.16 0.00 0.00 179.01 179.28 2dfi h SER 36 N -0.34 0.99 0.26 1.42 0.02 -0.47 0.65 113.55 116.08 2dfi h SER 36 Ca -0.00 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 2dfi h SER 36 Cb 0.34 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.68 2dfi h SER 36 CO 0.00 0.64 -0.13 0.40 -1.14 0.00 0.00 176.83 176.61 2dfi h ILE 37 N 1.13 0.78 0.00 3.27 2.04 -1.19 -0.77 117.51 122.77 2dfi h ILE 37 Ca 0.40 -0.59 -0.02 0.00 1.00 0.00 0.00 64.86 65.66 2dfi h ILE 37 Cb 0.13 1.10 -0.00 0.00 -0.74 0.00 0.00 36.82 37.30 2dfi h ILE 37 CO -0.16 0.12 -0.09 -0.33 0.00 0.00 0.00 178.15 177.69 2dfi h GLU 38 N -0.67 0.00 -0.12 2.37 5.08 -1.16 -1.61 114.58 118.48 2dfi h GLU 38 Ca -0.04 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.26 2dfi h GLU 38 Cb 0.47 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.72 2dfi h GLU 38 CO 0.06 0.09 -0.17 -0.22 -1.00 0.00 0.00 179.01 177.78 2dfi h LYS 39 N 0.00 0.32 -0.72 2.33 3.64 -0.74 -2.93 116.57 118.47 2dfi h LYS 39 Ca -0.00 -0.19 0.03 0.00 -1.27 0.00 0.00 60.65 59.23 2dfi h LYS 39 Cb 0.17 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.96 2dfi h LYS 39 CO 0.01 0.76 0.47 1.98 -2.27 0.00 0.00 179.45 180.40 2dfi h MET 40 N -0.10 0.85 -0.22 1.90 4.05 -0.54 -1.57 114.93 119.30 2dfi h MET 40 Ca 0.01 -0.05 0.01 0.00 -0.28 0.00 0.00 59.70 59.39 2dfi h MET 40 Cb 0.72 -0.19 -0.01 0.00 -0.80 0.00 0.00 31.60 31.32 2dfi h MET 40 CO 0.04 0.56 0.14 0.82 0.23 0.00 0.00 176.91 178.70 2dfi h ILE 41 N 0.87 1.04 -0.44 1.77 2.04 -1.22 -1.91 117.51 119.65 2dfi h ILE 41 Ca 0.29 -0.10 -0.12 0.00 1.00 0.00 0.00 64.86 65.93 2dfi h ILE 41 Cb 0.05 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 2dfi h ILE 41 CO -0.08 0.05 -0.19 0.24 0.00 0.00 0.00 178.15 178.17 2dfi h MET 42 N 0.28 0.91 0.00 2.37 2.86 -1.23 -1.63 114.93 118.49 2dfi h MET 42 Ca 0.09 -0.39 -0.00 0.00 -2.06 0.00 0.00 59.70 57.33 2dfi h MET 42 Cb -0.01 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 31.61 2dfi h MET 42 CO -0.03 1.04 -0.02 1.05 1.06 0.00 0.00 176.91 180.01 2dfi h GLU 43 N 0.75 0.00 -0.10 1.72 4.11 -1.19 -1.04 114.58 118.83 2dfi h GLU 43 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.53 2dfi h GLU 43 Cb 0.76 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.01 2dfi h GLU 43 CO 0.06 0.02 0.00 1.28 0.07 0.00 0.00 179.01 180.44 2dfi n LEU 44 N -3.15 1.47 0.00 3.06 4.77 -0.73 -4.92 117.00 117.50 2dfi n LEU 44 Ca -0.01 -0.57 0.00 0.00 -0.03 0.00 0.00 56.01 55.40 2dfi n LEU 44 Cb 0.22 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 2dfi n LEU 44 CO 0.25 0.28 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 2dfi n GLY 45 N 1.13 0.75 3.47 -0.72 0.00 -0.39 -5.04 105.19 104.39 2dfi n GLY 45 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 2dfi n GLY 45 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dfi n GLY 46 N -2.11 3.09 3.08 -0.02 0.00 -0.64 -4.99 105.19 103.60 2dfi n GLY 46 Ca 0.00 -2.32 -0.17 0.00 0.00 0.00 0.00 46.02 43.53 2dfi n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dfi s LYS 47 N -3.94 0.72 0.29 1.61 3.01 -1.09 -3.54 119.74 116.80 2dfi s LYS 47 Ca 0.18 -0.65 -0.30 0.00 -1.01 0.00 0.00 55.97 54.19 2dfi s LYS 47 Cb -0.01 -0.65 -0.11 0.00 -1.01 0.00 0.00 37.83 36.04 2dfi s LYS 47 CO 0.11 0.16 1.56 -2.14 0.51 0.00 0.00 175.35 175.55 2dfi s PRO 48 N -1.06 4.15 0.32 -1.68 0.02 -1.26 -1.25 135.00 134.23 2dfi s PRO 48 Ca -0.02 2.53 0.24 0.00 0.02 0.00 0.00 61.00 63.78 2dfi s PRO 48 Cb -0.07 -3.03 0.47 0.00 0.02 0.00 0.00 34.50 31.88 2dfi s PRO 48 CO 0.01 -0.59 1.60 0.00 -0.33 0.00 0.00 177.00 177.69 2dfi h ALA 49 N 4.72 0.93 -1.62 -1.55 0.00 -1.26 -3.43 119.26 117.05 2dfi h ALA 49 Ca -0.47 0.00 0.25 0.00 0.00 0.00 0.00 54.91 54.69 2dfi h ALA 49 Cb 1.22 0.00 -0.16 0.00 0.00 0.00 0.00 17.79 18.85 2dfi h ALA 49 CO 0.78 0.00 0.76 -0.59 0.00 0.00 0.00 179.25 180.20 2dfi s PHE 50 N -3.18 -0.13 0.34 0.00 -0.71 -1.26 -4.12 117.98 108.91 2dfi s PHE 50 Ca 0.08 0.04 -0.29 0.00 -1.04 0.00 0.00 56.93 55.72 2dfi s PHE 50 Cb 0.08 0.53 -0.10 0.00 -1.21 0.00 0.00 43.02 42.32 2dfi s PHE 50 CO 0.66 -0.30 1.38 -1.25 -1.34 0.00 0.00 175.22 174.36 2dfi s PRO 51 N -2.56 4.27 0.03 1.99 0.04 -1.26 -4.57 135.00 132.94 2dfi s PRO 51 Ca 0.10 2.34 -0.33 0.00 0.04 0.00 0.00 61.00 63.15 2dfi s PRO 51 Cb 0.01 -3.04 -0.12 0.00 0.04 0.00 0.00 34.50 31.38 2dfi s PRO 51 CO -0.04 -0.32 1.81 0.28 0.04 0.00 0.00 177.00 178.77 2dfi n VAL 52 N 0.88 0.42 -3.40 -0.36 0.31 -1.26 -4.91 118.33 110.00 2dfi n VAL 52 Ca 0.01 -0.08 -0.38 0.00 -0.01 0.00 0.00 64.34 63.88 2dfi n VAL 52 Cb 0.41 -1.90 -0.06 0.00 -0.91 0.00 0.00 33.84 31.38 2dfi n VAL 52 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 2dfi s ASN 53 N 3.11 6.85 -0.36 4.52 0.02 -0.45 -4.53 114.94 124.09 2dfi s ASN 53 Ca 0.87 1.01 0.00 0.00 -1.02 0.00 0.00 52.86 53.72 2dfi s ASN 53 Cb -0.62 -2.29 0.13 0.00 0.02 0.00 0.00 41.25 38.50 2dfi s ASN 53 CO 0.44 0.25 0.20 -0.76 0.02 0.00 0.00 177.10 177.26 2dfi s LEU 54 N -0.74 1.36 -0.21 0.60 1.43 0.77 -1.52 118.68 120.36 2dfi s LEU 54 Ca 0.25 -2.18 -0.07 0.00 -1.03 0.00 0.00 54.13 51.10 2dfi s LEU 54 Cb -0.17 -0.55 -0.04 0.00 0.03 0.00 0.00 46.19 45.46 2dfi s LEU 54 CO 0.14 -0.32 0.07 -0.44 0.23 0.00 0.00 176.35 176.04 2dfi s SER 55 N 1.03 5.45 -0.14 2.29 0.01 -0.69 -4.70 113.70 116.94 2dfi s SER 55 Ca 0.17 -0.04 -0.05 0.00 1.31 0.00 0.00 55.95 57.34 2dfi s SER 55 Cb -0.23 -1.95 -0.04 0.00 0.21 0.00 0.00 66.02 64.01 2dfi s SER 55 CO -0.03 0.08 0.04 -0.63 0.41 0.00 0.00 173.24 173.10 2dfi s ILE 56 N 0.93 4.58 0.00 1.44 1.01 -1.25 -0.16 121.20 127.75 2dfi s ILE 56 Ca 0.04 -0.12 0.00 0.00 0.00 0.00 0.00 60.65 60.57 2dfi s ILE 56 Cb -0.14 -3.01 0.00 0.00 0.01 0.00 0.00 42.46 39.32 2dfi s ILE 56 CO 0.03 0.52 0.00 0.59 0.00 0.00 0.00 174.94 176.08 2dfi n ASN 57 N 2.99 0.00 0.08 3.58 3.02 -0.44 -1.35 115.26 123.16 2dfi n ASN 57 Ca -0.18 0.00 0.10 0.00 -0.03 0.00 0.00 54.58 54.48 2dfi n ASN 57 Cb 0.53 0.00 0.43 0.00 -0.61 0.00 0.00 39.78 40.13 2dfi n ASN 57 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 2dfi n GLU 58 N 4.89 0.13 -2.73 3.52 0.00 -1.26 -1.66 120.64 123.53 2dfi n GLU 58 Ca 0.00 0.35 -0.43 0.00 0.00 0.00 0.00 57.16 57.08 2dfi n GLU 58 Cb 0.00 -1.74 -0.03 0.00 0.00 0.00 0.00 31.44 29.67 2dfi n GLU 58 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 2dfi s ILE 59 N -3.20 4.72 -0.04 3.84 1.01 -0.45 -0.84 121.20 126.23 2dfi s ILE 59 Ca 0.06 1.87 -0.11 0.00 0.00 0.00 0.00 60.65 62.46 2dfi s ILE 59 Cb 0.10 -4.25 -0.31 0.00 0.01 0.00 0.00 42.46 38.00 2dfi s ILE 59 CO 0.37 -0.16 0.68 0.00 0.00 0.00 0.00 174.94 175.83 2dfi h ALA 60 N 7.56 0.15 -2.63 9.38 0.00 -0.65 -3.31 119.26 129.75 2dfi h ALA 60 Ca -0.20 -1.13 0.13 0.00 0.00 0.00 0.00 54.91 53.70 2dfi h ALA 60 Cb 1.07 0.45 -0.03 0.00 0.00 0.00 0.00 17.79 19.28 2dfi h ALA 60 CO 0.95 1.02 0.54 0.00 0.00 0.00 0.00 179.25 181.75 2dfi s ALA 61 N -2.58 -1.45 -1.21 0.00 0.00 -1.18 -4.83 121.76 110.51 2dfi s ALA 61 Ca -0.16 -0.43 -0.08 0.00 0.00 0.00 0.00 51.96 51.29 2dfi s ALA 61 Cb 0.05 0.76 0.01 0.00 0.00 0.00 0.00 23.12 23.94 2dfi s ALA 61 CO 0.86 -1.05 1.06 0.72 0.00 0.00 0.00 175.76 177.34 2dfi n HIS 62 N -0.68 -2.58 -4.10 0.00 8.25 -1.26 -1.98 115.22 112.86 2dfi n HIS 62 Ca -0.04 0.91 -0.30 0.00 -0.26 0.00 0.00 57.72 58.04 2dfi n HIS 62 Cb 0.59 -4.61 -0.17 0.00 1.12 0.00 0.00 29.99 26.93 2dfi n HIS 62 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 2dfi s TYR 63 N -3.29 2.09 -0.02 4.41 6.14 -1.26 -3.94 117.35 121.49 2dfi s TYR 63 Ca 0.52 -1.13 0.01 0.00 0.64 0.00 0.00 57.07 57.12 2dfi s TYR 63 Cb -0.23 -1.54 0.01 0.00 0.42 0.00 0.00 41.96 40.61 2dfi s TYR 63 CO 0.65 -0.62 -0.05 -0.08 0.64 0.00 0.00 175.55 176.09 2dfi s THR 64 N 1.40 0.42 1.17 4.34 -1.32 -1.26 -0.16 115.64 120.23 2dfi s THR 64 Ca 0.03 -0.17 -0.16 0.00 -1.21 0.00 0.00 61.69 60.17 2dfi s THR 64 Cb -0.13 -0.40 0.20 0.00 -1.51 0.00 0.00 72.50 70.67 2dfi s THR 64 CO -0.09 0.15 0.46 -2.65 -2.21 0.00 0.00 174.62 170.28 2dfi n PRO 65 N 3.31 -2.20 -3.92 7.08 -0.02 -1.26 -4.91 135.00 133.08 2dfi n PRO 65 Ca -0.17 -0.62 -0.09 0.00 -2.02 0.00 0.00 63.50 60.59 2dfi n PRO 65 Cb 0.56 -1.90 -0.09 0.00 -0.02 0.00 0.00 33.50 32.05 2dfi n PRO 65 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 2dfi s TYR 66 N -2.29 0.19 0.03 6.00 -0.85 -1.26 -4.54 117.35 114.63 2dfi s TYR 66 Ca 0.62 -0.49 -0.35 0.00 -0.52 0.00 0.00 57.07 56.33 2dfi s TYR 66 Cb -0.18 -0.14 -0.14 0.00 0.38 0.00 0.00 41.96 41.89 2dfi s TYR 66 CO 0.65 -0.37 1.65 1.63 -1.52 0.00 0.00 175.55 177.60 2dfi n LYS 67 N 0.75 1.93 -0.00 -3.49 4.76 -1.26 -0.40 118.16 120.45 2dfi n LYS 67 Ca -0.19 0.70 0.00 0.00 -2.87 0.00 0.00 58.31 55.95 2dfi n LYS 67 Cb 0.59 -2.47 0.00 0.00 -1.84 0.00 0.00 35.03 31.30 2dfi n LYS 67 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dfi n GLY 68 N 3.67 0.09 3.65 0.72 0.00 -1.26 -5.04 105.19 107.02 2dfi n GLY 68 Ca 0.20 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.79 2dfi n GLY 68 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2dfi s ASP 69 N -2.06 6.62 0.00 1.61 3.68 0.46 -4.88 116.67 122.10 2dfi s ASP 69 Ca 0.00 2.01 0.26 0.00 2.13 0.00 0.00 52.55 56.95 2dfi s ASP 69 Cb 0.00 -2.53 0.66 0.00 -1.45 0.00 0.00 42.92 39.59 2dfi s ASP 69 CO 0.00 -1.00 1.51 0.35 0.13 0.00 0.00 175.17 176.17 2dfi n THR 70 N 5.72 0.00 -1.67 1.71 -2.24 -1.26 -4.63 114.28 111.91 2dfi n THR 70 Ca 0.17 -0.28 -0.45 0.00 -2.27 0.00 0.00 64.05 61.22 2dfi n THR 70 Cb 0.44 0.80 -0.03 0.00 -2.10 0.00 0.00 70.33 69.44 2dfi n THR 70 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 2dfi n THR 71 N 0.25 0.92 -4.24 4.28 5.66 -1.26 -4.89 114.28 114.99 2dfi n THR 71 Ca 0.15 -0.23 -0.18 0.00 -3.05 0.00 0.00 64.05 60.74 2dfi n THR 71 Cb 0.42 -1.48 -0.11 0.00 -1.55 0.00 0.00 70.33 67.61 2dfi n THR 71 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 2dfi s VAL 72 N -0.03 1.34 0.28 1.08 -7.23 -1.26 -1.52 120.40 113.06 2dfi s VAL 72 Ca 0.68 -1.71 -0.29 0.00 -1.81 0.00 0.00 61.98 58.85 2dfi s VAL 72 Cb -0.65 -1.53 -0.10 0.00 0.56 0.00 0.00 36.38 34.66 2dfi s VAL 72 CO 0.49 -0.41 1.23 -0.76 -0.31 0.00 0.00 175.10 175.34 2dfi s LEU 73 N -2.44 4.47 0.08 1.32 1.02 -0.07 -4.89 118.68 118.17 2dfi s LEU 73 Ca 0.09 2.47 0.09 0.00 0.02 0.00 0.00 54.13 56.79 2dfi s LEU 73 Cb -0.05 -3.63 -0.03 0.00 0.02 0.00 0.00 46.19 42.50 2dfi s LEU 73 CO 0.03 -0.38 -0.23 -0.54 0.02 0.00 0.00 176.35 175.24 2dfi s LYS 74 N -1.31 1.40 0.35 1.70 1.02 -1.26 -0.72 119.74 120.92 2dfi s LYS 74 Ca 0.49 -1.14 -0.27 0.00 0.02 0.00 0.00 55.97 55.07 2dfi s LYS 74 Cb -0.36 -1.66 -0.12 0.00 -0.52 0.00 0.00 37.83 35.17 2dfi s LYS 74 CO 0.45 0.41 1.26 -1.91 -0.92 0.00 0.00 175.35 174.64 2dfi n GLU 75 N 1.39 2.02 0.00 1.68 2.13 -1.26 -1.33 120.64 125.27 2dfi n GLU 75 Ca -0.18 0.71 0.00 0.00 0.66 0.00 0.00 57.16 58.35 2dfi n GLU 75 Cb 0.53 -2.30 0.00 0.00 0.27 0.00 0.00 31.44 29.94 2dfi n GLU 75 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2dfi n GLY 76 N 0.82 2.50 3.76 8.31 0.00 -0.18 -4.97 105.19 115.42 2dfi n GLY 76 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 2dfi n GLY 76 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dfi s ASP 77 N -2.43 6.56 -0.86 1.61 -0.00 -0.44 -4.69 116.67 116.41 2dfi s ASP 77 Ca 0.00 2.81 -0.17 0.00 -0.00 0.00 0.00 52.55 55.19 2dfi s ASP 77 Cb 0.00 -2.64 0.16 0.00 -0.00 0.00 0.00 42.92 40.44 2dfi s ASP 77 CO 0.00 -0.74 0.96 -0.31 -0.00 0.00 0.00 175.17 175.07 2dfi s TYR 78 N -0.52 3.35 -0.23 4.23 1.51 -1.26 -0.96 117.35 123.47 2dfi s TYR 78 Ca 0.56 -1.57 -0.21 0.00 -1.01 0.00 0.00 57.07 54.84 2dfi s TYR 78 Cb -0.44 -4.09 -0.02 0.00 -0.11 0.00 0.00 41.96 37.31 2dfi s TYR 78 CO 0.51 -1.29 0.67 -1.17 -1.11 0.00 0.00 175.55 173.16 2dfi s LEU 79 N 1.76 4.10 -0.37 -1.29 2.96 0.47 -1.32 118.68 124.99 2dfi s LEU 79 Ca 0.25 0.83 -0.13 0.00 -0.22 0.00 0.00 54.13 54.85 2dfi s LEU 79 Cb -0.08 -2.94 -0.00 0.00 0.50 0.00 0.00 46.19 43.67 2dfi s LEU 79 CO -0.08 -0.36 0.26 -0.54 -1.32 0.00 0.00 176.35 174.31 2dfi s LYS 80 N 2.34 3.26 -0.43 1.98 1.02 0.78 -0.44 119.74 128.26 2dfi s LYS 80 Ca 0.29 -0.81 -0.15 0.00 0.02 0.00 0.00 55.97 55.33 2dfi s LYS 80 Cb -0.16 -3.86 0.04 0.00 -0.52 0.00 0.00 37.83 33.34 2dfi s LYS 80 CO 0.09 -0.57 0.32 0.42 -0.92 0.00 0.00 175.35 174.70 2dfi s ILE 81 N 1.69 5.14 -0.29 2.17 1.01 0.11 -1.70 121.20 129.34 2dfi s ILE 81 Ca 0.05 -0.85 -0.03 0.00 0.00 0.00 0.00 60.65 59.83 2dfi s ILE 81 Cb -0.18 -3.95 0.04 0.00 0.01 0.00 0.00 42.46 38.38 2dfi s ILE 81 CO 0.10 -0.40 0.00 -0.62 0.00 0.00 0.00 174.94 174.02 2dfi s ASP 82 N 2.00 4.83 0.03 3.58 3.68 -0.58 -1.53 116.67 128.69 2dfi s ASP 82 Ca 0.04 -1.14 0.09 0.00 2.13 0.00 0.00 52.55 53.67 2dfi s ASP 82 Cb -0.21 -1.73 -0.03 0.00 -1.45 0.00 0.00 42.92 39.50 2dfi s ASP 82 CO 0.08 -0.24 -0.25 0.68 0.13 0.00 0.00 175.17 175.58 2dfi s VAL 83 N 1.30 2.22 -0.02 1.11 -7.23 -0.35 -1.35 120.40 116.08 2dfi s VAL 83 Ca -0.03 -1.30 0.02 0.00 -1.81 0.00 0.00 61.98 58.85 2dfi s VAL 83 Cb -0.19 -1.85 0.01 0.00 0.56 0.00 0.00 36.38 34.90 2dfi s VAL 83 CO -0.01 0.41 -0.06 -0.83 -0.31 0.00 0.00 175.10 174.30 2dfi s GLY 84 N -1.14 0.37 -0.01 2.32 0.00 -1.26 -1.73 107.32 105.87 2dfi s GLY 84 Ca 0.12 -0.18 0.04 0.00 0.00 0.00 0.00 44.72 44.70 2dfi s GLY 84 CO 0.02 0.05 -0.12 0.14 0.00 0.00 0.00 173.10 173.19 2dfi s VAL 85 N 0.30 0.94 0.05 1.40 1.01 -0.35 -0.82 120.40 122.94 2dfi s VAL 85 Ca -0.04 -0.53 0.03 0.00 0.00 0.00 0.00 61.98 61.45 2dfi s VAL 85 Cb -0.08 -0.79 -0.02 0.00 0.00 0.00 0.00 36.38 35.49 2dfi s VAL 85 CO -0.00 0.26 -0.11 -1.38 0.00 0.00 0.00 175.10 173.87 2dfi s HIS 86 N -0.30 0.90 -0.27 5.22 -3.43 -0.38 0.16 115.29 117.19 2dfi s HIS 86 Ca 0.04 -0.45 0.01 0.00 -0.80 0.00 0.00 55.06 53.86 2dfi s HIS 86 Cb -0.05 -0.53 0.07 0.00 -1.43 0.00 0.00 32.58 30.65 2dfi s HIS 86 CO -0.00 -0.02 -0.00 0.42 -2.00 0.00 0.00 174.74 173.14 2dfi s ILE 87 N -1.22 1.48 -1.51 -5.38 1.01 -0.51 -2.66 121.20 112.40 2dfi s ILE 87 Ca -0.05 -1.42 -0.05 0.00 0.00 0.00 0.00 60.65 59.13 2dfi s ILE 87 Cb -0.09 -1.88 0.01 0.00 0.01 0.00 0.00 42.46 40.50 2dfi s ILE 87 CO 0.01 -0.31 0.72 0.47 0.00 0.00 0.00 174.94 175.84 2dfi n ASP 88 N 4.65 -6.18 0.00 3.58 8.00 -1.26 -2.42 116.55 122.93 2dfi n ASP 88 Ca -0.07 -0.34 0.00 0.00 0.71 0.00 0.00 54.79 55.09 2dfi n ASP 88 Cb 0.43 -4.95 0.00 0.00 -0.02 0.00 0.00 41.12 36.58 2dfi n ASP 88 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dfi n GLY 89 N -1.62 3.40 3.61 0.44 0.00 -1.26 -4.85 105.19 104.90 2dfi n GLY 89 Ca -0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.50 2dfi n GLY 89 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dfi s PHE 90 N -2.81 2.91 -0.08 1.61 0.08 -1.01 -0.45 117.98 118.23 2dfi s PHE 90 Ca 0.00 0.80 -0.15 0.00 0.12 0.00 0.00 56.93 57.70 2dfi s PHE 90 Cb 0.00 -4.18 -0.05 0.00 -0.57 0.00 0.00 43.02 38.22 2dfi s PHE 90 CO 0.00 -1.12 0.39 0.42 -0.10 0.00 0.00 175.22 174.81 2dfi s ILE 91 N 4.16 5.17 -0.15 0.64 1.01 -1.26 -1.43 121.20 129.34 2dfi s ILE 91 Ca 0.46 0.77 -0.01 0.00 0.00 0.00 0.00 60.65 61.87 2dfi s ILE 91 Cb -0.09 -3.71 -0.01 0.00 0.01 0.00 0.00 42.46 38.66 2dfi s ILE 91 CO 0.27 0.45 -0.12 0.00 0.00 0.00 0.00 174.94 175.55 2dfi s ALA 92 N -0.14 2.65 -0.18 9.38 0.00 0.12 -4.98 121.76 128.62 2dfi s ALA 92 Ca 0.22 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 51.21 2dfi s ALA 92 Cb -0.15 -1.32 0.04 0.00 0.00 0.00 0.00 23.12 21.69 2dfi s ALA 92 CO 0.09 0.07 -0.08 0.34 0.00 0.00 0.00 175.76 176.18 2dfi s ASP 93 N 0.65 3.03 0.06 0.00 2.15 -1.26 -1.22 116.67 120.08 2dfi s ASP 93 Ca -0.06 -0.74 0.01 0.00 0.43 0.00 0.00 52.55 52.19 2dfi s ASP 93 Cb -0.15 -1.04 -0.03 0.00 -0.30 0.00 0.00 42.92 41.39 2dfi s ASP 93 CO 0.02 -0.16 -0.06 0.28 -0.17 0.00 0.00 175.17 175.08 2dfi s THR 94 N 1.54 0.49 0.02 1.71 -1.32 -0.71 -3.10 115.64 114.26 2dfi s THR 94 Ca 0.00 -1.54 -0.19 0.00 -1.21 0.00 0.00 61.69 58.75 2dfi s THR 94 Cb -0.15 -1.17 0.04 0.00 -1.51 0.00 0.00 72.50 69.70 2dfi s THR 94 CO -0.08 -0.71 0.42 0.00 -2.21 0.00 0.00 174.62 172.03 2dfi s ALA 95 N -2.78 -1.04 0.08 11.08 0.00 -0.77 -1.21 121.76 127.11 2dfi s ALA 95 Ca 0.01 0.42 -0.06 0.00 0.00 0.00 0.00 51.96 52.32 2dfi s ALA 95 Cb -0.00 0.26 -0.01 0.00 0.00 0.00 0.00 23.12 23.36 2dfi s ALA 95 CO -0.04 -0.41 0.13 0.14 0.00 0.00 0.00 175.76 175.58 2dfi s VAL 96 N -2.11 0.16 -0.10 0.00 -7.23 -0.58 -1.21 120.40 109.34 2dfi s VAL 96 Ca -0.08 -1.36 0.02 0.00 -1.81 0.00 0.00 61.98 58.75 2dfi s VAL 96 Cb -0.02 -1.40 -0.02 0.00 0.56 0.00 0.00 36.38 35.51 2dfi s VAL 96 CO 0.00 -0.75 -0.15 -0.89 -0.31 0.00 0.00 175.10 173.00 2dfi s THR 97 N -3.88 2.89 -0.04 5.32 2.01 -0.99 -0.71 115.64 120.24 2dfi s THR 97 Ca 0.06 -0.74 0.04 0.00 0.31 0.00 0.00 61.69 61.35 2dfi s THR 97 Cb 0.06 -2.17 -0.00 0.00 0.01 0.00 0.00 72.50 70.40 2dfi s THR 97 CO -0.11 0.55 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.54 2dfi s VAL 98 N -0.04 1.24 -0.52 3.82 1.01 0.42 -4.98 120.40 121.36 2dfi s VAL 98 Ca -0.04 -0.61 -0.17 0.00 0.00 0.00 0.00 61.98 61.16 2dfi s VAL 98 Cb -0.14 -1.08 0.09 0.00 0.00 0.00 0.00 36.38 35.25 2dfi s VAL 98 CO 0.04 0.36 0.53 -0.60 0.00 0.00 0.00 175.10 175.43 2dfi s ARG 99 N 0.10 3.03 -0.41 2.72 3.52 -1.26 -0.40 118.95 126.25 2dfi s ARG 99 Ca -0.04 -1.30 -0.43 0.00 -0.13 0.00 0.00 55.73 53.83 2dfi s ARG 99 Cb -0.11 -4.18 -0.18 0.00 -1.56 0.00 0.00 34.95 28.93 2dfi s ARG 99 CO 0.02 -1.23 1.80 0.28 -0.81 0.00 0.00 175.30 175.36 2dfi n VAL 100 N 5.37 0.12 -1.09 7.11 0.31 -0.14 -0.47 118.33 129.55 2dfi n VAL 100 Ca -0.11 -0.04 -0.03 0.00 -0.01 0.00 0.00 64.34 64.15 2dfi n VAL 100 Cb 0.43 -0.85 -0.01 0.00 -0.91 0.00 0.00 33.84 32.49 2dfi n VAL 100 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2dfi n GLY 101 N 4.93 0.55 3.24 2.92 0.00 -1.26 -1.02 105.19 114.55 2dfi n GLY 101 Ca 0.35 -0.20 -0.15 0.00 0.00 0.00 0.00 46.02 46.02 2dfi n GLY 101 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2dfi s MET 102 N -1.54 1.42 0.58 1.61 1.00 0.38 -4.93 119.30 117.82 2dfi s MET 102 Ca 0.00 -1.79 -0.04 0.00 0.00 0.00 0.00 55.69 53.86 2dfi s MET 102 Cb 0.00 0.26 0.02 0.00 0.00 0.00 0.00 34.83 35.12 2dfi s MET 102 CO 0.00 -0.49 0.87 -1.21 0.00 0.00 0.00 175.02 174.19 2dfi s GLU 103 N -3.88 2.75 0.32 2.03 0.41 -1.26 -4.48 118.70 114.59 2dfi s GLU 103 Ca 0.39 -0.25 -0.29 0.00 -0.41 0.00 0.00 54.97 54.42 2dfi s GLU 103 Cb 0.05 -2.33 -0.10 0.00 -1.78 0.00 0.00 34.13 29.97 2dfi s GLU 103 CO 0.18 -0.73 1.32 -2.00 -0.49 0.00 0.00 175.26 173.54 2dfi s GLU 104 N -4.93 4.34 0.32 1.61 2.12 -1.26 -4.76 118.70 116.14 2dfi s GLU 104 Ca 0.55 2.23 0.03 0.00 0.36 0.00 0.00 54.97 58.13 2dfi s GLU 104 Cb -0.10 -3.07 0.03 0.00 0.26 0.00 0.00 34.13 31.24 2dfi s GLU 104 CO 0.43 -0.21 0.23 -0.40 -0.54 0.00 0.00 175.26 174.77 2dfi n ASP 105 N 0.93 2.02 -0.27 -1.70 5.75 -1.26 -4.94 116.55 117.07 2dfi n ASP 105 Ca 0.01 -2.09 0.06 0.00 -0.01 0.00 0.00 54.79 52.75 2dfi n ASP 105 Cb 0.42 -0.02 0.20 0.00 -1.03 0.00 0.00 41.12 40.68 2dfi n ASP 105 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 2dfi h GLU 106 N 0.00 0.53 -0.44 0.11 4.39 -1.99 -0.97 114.58 116.22 2dfi h GLU 106 Ca -0.20 -0.03 -0.04 0.00 0.34 0.00 0.00 59.36 59.42 2dfi h GLU 106 Cb 0.73 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 29.24 2dfi h GLU 106 CO 0.32 0.35 0.10 1.25 -1.16 0.00 0.00 179.01 179.86 2dfi h LEU 107 N 0.54 0.67 -0.58 1.33 5.85 -1.96 -1.47 115.31 119.69 2dfi h LEU 107 Ca 0.43 -0.24 -0.08 0.00 0.84 0.00 0.00 57.88 58.83 2dfi h LEU 107 Cb 0.60 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.44 2dfi h LEU 107 CO -0.37 0.73 0.04 0.24 -0.34 0.00 0.00 178.44 178.74 2dfi h MET 108 N 0.57 1.00 -0.37 1.25 2.86 -1.83 -2.65 114.93 115.75 2dfi h MET 108 Ca 0.14 -0.30 -0.04 0.00 -2.06 0.00 0.00 59.70 57.44 2dfi h MET 108 Cb 0.33 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 2dfi h MET 108 CO 0.00 0.97 0.08 1.49 1.06 0.00 0.00 176.91 180.52 2dfi h GLU 109 N 0.89 0.55 -0.00 1.72 4.81 -1.03 -1.80 114.58 119.72 2dfi h GLU 109 Ca 0.17 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 2dfi h GLU 109 Cb 0.50 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 2dfi h GLU 109 CO 0.02 0.52 -0.02 0.00 -0.73 0.00 0.00 179.01 178.79 2dfi h ALA 110 N 1.56 -0.02 -0.41 2.92 0.00 -0.92 0.61 119.26 123.01 2dfi h ALA 110 Ca 0.13 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2dfi h ALA 110 Cb 0.22 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2dfi h ALA 110 CO -0.00 -0.52 0.17 0.00 0.00 0.00 0.00 179.25 178.89 2dfi h ALA 111 N 0.96 0.53 -0.75 0.00 0.00 -1.31 -0.60 119.26 118.08 2dfi h ALA 111 Ca 0.01 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 2dfi h ALA 111 Cb 0.06 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 2dfi h ALA 111 CO -0.03 0.13 0.34 -0.22 0.00 0.00 0.00 179.25 179.48 2dfi h LYS 112 N 0.51 1.10 0.00 0.00 3.64 -1.12 -1.77 116.57 118.94 2dfi h LYS 112 Ca 0.14 -0.17 -0.14 0.00 -1.27 0.00 0.00 60.65 59.21 2dfi h LYS 112 Cb 0.18 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.79 2dfi h LYS 112 CO -0.01 0.87 -0.64 0.93 -2.27 0.00 0.00 179.45 178.32 2dfi h GLU 113 N 1.07 0.00 -0.60 1.90 4.39 -0.79 -2.09 114.58 118.46 2dfi h GLU 113 Ca 0.26 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.90 2dfi h GLU 113 Cb 0.15 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.77 2dfi h GLU 113 CO -0.03 0.64 0.14 0.00 -1.16 0.00 0.00 179.01 178.61 2dfi h ALA 114 N 1.36 0.80 -0.67 3.43 0.00 -0.76 -0.42 119.26 122.99 2dfi h ALA 114 Ca -0.01 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.61 2dfi h ALA 114 Cb 1.21 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.74 2dfi h ALA 114 CO 0.08 0.51 0.19 1.25 0.00 0.00 0.00 179.25 181.28 2dfi h LEU 115 N 0.88 1.00 -0.64 0.00 5.85 -1.09 -1.29 115.31 120.02 2dfi h LEU 115 Ca 0.19 -0.22 -0.08 0.00 0.84 0.00 0.00 57.88 58.60 2dfi h LEU 115 Cb 0.36 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 2dfi h LEU 115 CO 0.00 0.96 0.07 0.78 -0.34 0.00 0.00 178.44 179.91 2dfi h ASN 116 N 0.99 1.05 -0.10 1.25 2.35 -1.04 -2.00 115.58 118.08 2dfi h ASN 116 Ca 0.21 -0.28 -0.10 0.00 -0.55 0.00 0.00 56.30 55.59 2dfi h ASN 116 Cb 0.33 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.41 2dfi h ASN 116 CO -0.00 1.06 -0.25 0.00 -1.65 0.00 0.00 177.43 176.58 2dfi h ALA 117 N 1.02 1.04 -0.31 -0.83 0.00 -0.88 -1.43 119.26 117.87 2dfi h ALA 117 Ca 0.19 -0.36 -0.12 0.00 0.00 0.00 0.00 54.91 54.62 2dfi h ALA 117 Cb 0.48 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2dfi h ALA 117 CO 0.02 0.58 -0.31 0.00 0.00 0.00 0.00 179.25 179.54 2dfi h ALA 118 N 1.25 0.88 0.00 0.00 0.00 -0.95 -2.89 119.26 117.54 2dfi h ALA 118 Ca 0.07 -0.40 -0.15 0.00 0.00 0.00 0.00 54.91 54.43 2dfi h ALA 118 Cb 0.70 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2dfi h ALA 118 CO 0.05 0.63 -0.72 0.82 0.00 0.00 0.00 179.25 180.03 2dfi h ILE 119 N 0.56 1.48 -0.12 0.00 2.04 -1.21 -1.30 117.51 118.95 2dfi h ILE 119 Ca 0.07 -2.51 -0.07 0.00 1.00 0.00 0.00 64.86 63.35 2dfi h ILE 119 Cb 0.81 2.37 -0.01 0.00 -0.74 0.00 0.00 36.82 39.25 2dfi h ILE 119 CO 0.07 0.71 -0.23 -1.28 0.00 0.00 0.00 178.15 177.42 2dfi h SER 120 N 0.00 0.20 0.00 1.72 0.87 -1.06 -3.04 113.55 112.24 2dfi h SER 120 Ca -0.01 -0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.50 2dfi h SER 120 Cb 1.31 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.22 2dfi h SER 120 CO 0.09 0.44 -0.95 1.33 -0.53 0.00 0.00 176.83 177.22 2dfi n VAL 121 N -4.19 0.00 -2.36 2.23 0.24 -1.12 -4.91 118.33 108.21 2dfi n VAL 121 Ca -0.01 -0.13 -0.42 0.00 -2.04 0.00 0.00 64.34 61.74 2dfi n VAL 121 Cb 0.34 0.88 -0.02 0.00 -1.47 0.00 0.00 33.84 33.56 2dfi n VAL 121 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dfi s ALA 122 N -2.72 2.92 0.21 2.33 0.00 -0.50 -4.88 121.76 119.13 2dfi s ALA 122 Ca 0.05 -0.40 -0.20 0.00 0.00 0.00 0.00 51.96 51.40 2dfi s ALA 122 Cb 0.13 -4.02 0.04 0.00 0.00 0.00 0.00 23.12 19.27 2dfi s ALA 122 CO 0.72 -2.67 0.61 -0.98 0.00 0.00 0.00 175.76 173.44 2dfi s ARG 123 N 5.24 1.48 0.21 0.00 1.70 -1.26 -4.35 118.95 121.97 2dfi s ARG 123 Ca 0.57 -0.79 -0.32 0.00 -0.47 0.00 0.00 55.73 54.72 2dfi s ARG 123 Cb -0.12 0.57 -0.13 0.00 -0.57 0.00 0.00 34.95 34.69 2dfi s ARG 123 CO 0.29 -0.65 1.52 0.00 -1.08 0.00 0.00 175.30 175.37 2dfi n ALA 124 N -0.39 1.45 0.00 7.88 0.00 -1.18 -2.09 120.51 126.18 2dfi n ALA 124 Ca -0.10 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.76 2dfi n ALA 124 Cb 0.62 -2.34 0.00 0.00 0.00 0.00 0.00 19.45 17.73 2dfi n ALA 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dfi n GLY 125 N 2.79 2.88 3.82 0.00 0.00 -0.21 -4.67 105.19 109.80 2dfi n GLY 125 Ca 0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 2dfi n GLY 125 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dfi s VAL 126 N -2.82 4.66 0.23 1.61 1.01 -0.89 -4.78 120.40 119.43 2dfi s VAL 126 Ca 0.00 1.17 -0.22 0.00 0.00 0.00 0.00 61.98 62.93 2dfi s VAL 126 Cb 0.00 -3.85 -0.09 0.00 0.00 0.00 0.00 36.38 32.45 2dfi s VAL 126 CO 0.00 0.29 0.78 -1.61 0.00 0.00 0.00 175.10 174.56 2dfi s GLU 127 N -1.78 4.37 0.31 2.72 2.02 -1.26 -1.05 118.70 124.03 2dfi s GLU 127 Ca 0.39 1.01 0.06 0.00 0.02 0.00 0.00 54.97 56.44 2dfi s GLU 127 Cb -0.17 -2.92 0.73 0.00 0.10 0.00 0.00 34.13 31.86 2dfi s GLU 127 CO 0.20 0.40 1.79 0.82 0.02 0.00 0.00 175.26 178.50 2dfi h ILE 128 N 2.81 0.75 -0.94 -1.63 2.04 -0.82 -0.33 117.51 119.39 2dfi h ILE 128 Ca -0.48 -0.27 0.27 0.00 1.00 0.00 0.00 64.86 65.39 2dfi h ILE 128 Cb 1.19 -0.11 -0.04 0.00 -0.74 0.00 0.00 36.82 37.13 2dfi h ILE 128 CO 0.65 0.14 0.71 0.07 0.00 0.00 0.00 178.15 179.73 2dfi h LYS 129 N 0.79 0.00 -0.19 2.37 2.10 -1.58 0.33 116.57 120.39 2dfi h LYS 129 Ca 0.56 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 59.10 2dfi h LYS 129 Cb 0.84 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.15 2dfi h LYS 129 CO -0.35 0.00 -0.34 0.93 -2.00 0.00 0.00 179.45 177.69 2dfi h GLU 130 N 0.00 0.40 -0.12 0.07 4.39 -1.34 -1.72 114.58 116.26 2dfi h GLU 130 Ca 0.44 -0.17 -0.20 0.00 0.34 0.00 0.00 59.36 59.77 2dfi h GLU 130 Cb 1.87 -0.01 0.01 0.00 -0.10 0.00 0.00 28.75 30.52 2dfi h GLU 130 CO -0.00 0.69 -0.70 -0.07 -1.16 0.00 0.00 179.01 177.77 2dfi h LEU 131 N 0.34 0.82 -0.74 1.33 3.38 -0.48 -2.53 115.31 117.43 2dfi h LEU 131 Ca 0.04 -0.65 0.02 0.00 0.09 0.00 0.00 57.88 57.38 2dfi h LEU 131 Cb 0.77 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.24 2dfi h LEU 131 CO 0.06 1.34 0.48 1.23 0.09 0.00 0.00 178.44 181.64 2dfi h GLY 132 N 0.37 1.05 0.98 0.83 0.00 -1.31 0.40 103.07 105.38 2dfi h GLY 132 Ca -0.05 -0.37 -0.00 0.00 0.00 0.00 0.00 47.33 46.90 2dfi h GLY 132 CO 0.14 0.34 0.16 1.70 0.00 0.00 0.00 176.54 178.89 2dfi h LYS 133 N 0.96 0.37 -0.69 4.80 1.63 -1.30 0.21 116.57 122.55 2dfi h LYS 133 Ca 0.28 -0.03 -0.03 0.00 -0.85 0.00 0.00 60.65 60.02 2dfi h LYS 133 Cb -0.06 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 31.46 2dfi h LYS 133 CO -0.08 0.29 0.32 0.00 -3.45 0.00 0.00 179.45 176.52 2dfi h ALA 134 N 1.06 0.89 0.06 5.00 0.00 -1.04 -0.53 119.26 124.70 2dfi h ALA 134 Ca 0.10 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2dfi h ALA 134 Cb 0.01 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.53 2dfi h ALA 134 CO -0.02 0.47 -0.03 0.82 0.00 0.00 0.00 179.25 180.49 2dfi h ILE 135 N 0.96 1.13 -0.90 0.00 2.04 -0.59 -2.42 117.51 117.72 2dfi h ILE 135 Ca 0.23 -0.65 0.02 0.00 1.00 0.00 0.00 64.86 65.46 2dfi h ILE 135 Cb 0.14 1.55 -0.05 0.00 -0.74 0.00 0.00 36.82 37.72 2dfi h ILE 135 CO -0.03 0.16 0.60 -0.08 0.00 0.00 0.00 178.15 178.80 2dfi h GLU 136 N -0.37 1.17 -0.46 2.37 4.81 -0.52 -2.51 114.58 119.07 2dfi h GLU 136 Ca -0.01 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.13 2dfi h GLU 136 Cb 0.33 -0.26 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 2dfi h GLU 136 CO 0.01 0.77 0.22 -0.91 -0.73 0.00 0.00 179.01 178.37 2dfi h ASN 137 N 1.20 0.60 -0.70 1.04 2.35 -1.04 -1.06 115.58 117.96 2dfi h ASN 137 Ca 0.34 -0.13 -0.07 0.00 -0.55 0.00 0.00 56.30 55.89 2dfi h ASN 137 Cb -0.10 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 38.09 2dfi h ASN 137 CO -0.08 0.56 0.15 -0.33 -1.65 0.00 0.00 177.43 176.08 2dfi h GLU 138 N 0.59 1.14 0.15 0.81 4.39 -1.18 -0.16 114.58 120.31 2dfi h GLU 138 Ca 0.16 -0.28 -0.01 0.00 0.34 0.00 0.00 59.36 59.57 2dfi h GLU 138 Cb 0.12 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 28.63 2dfi h GLU 138 CO -0.02 1.01 -0.07 0.82 -1.16 0.00 0.00 179.01 179.59 2dfi h ILE 139 N 1.07 0.97 -0.23 3.13 2.04 -1.34 -3.01 117.51 120.15 2dfi h ILE 139 Ca 0.22 -1.01 -0.12 0.00 1.00 0.00 0.00 64.86 64.95 2dfi h ILE 139 Cb 0.40 1.55 -0.01 0.00 -0.74 0.00 0.00 36.82 38.01 2dfi h ILE 139 CO 0.01 0.22 -0.35 0.03 0.00 0.00 0.00 178.15 178.06 2dfi h ARG 140 N -0.73 0.49 -0.04 2.37 3.08 -1.16 -1.53 114.38 116.86 2dfi h ARG 140 Ca -0.02 -0.22 -0.02 0.00 0.07 0.00 0.00 59.98 59.79 2dfi h ARG 140 Cb 0.52 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.55 2dfi h ARG 140 CO 0.03 0.78 -0.06 -0.22 -1.07 0.00 0.00 179.97 179.42 2dfi h LYS 141 N 0.42 0.05 -0.06 0.04 3.64 -1.11 -0.49 116.57 119.06 2dfi h LYS 141 Ca 0.05 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2dfi h LYS 141 Cb 0.81 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 2dfi h LYS 141 CO 0.07 0.12 0.00 0.54 -2.27 0.00 0.00 179.45 177.91 2dfi n ARG 142 N -4.43 1.52 -0.31 1.90 1.74 -1.05 -4.92 116.66 111.10 2dfi n ARG 142 Ca -0.02 -0.76 0.00 0.00 -0.77 0.00 0.00 57.85 56.29 2dfi n ARG 142 Cb 0.16 -1.44 0.00 0.00 -1.02 0.00 0.00 32.46 30.16 2dfi n ARG 142 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2dfi n GLY 143 N 1.10 0.83 3.80 -0.13 0.00 -0.19 -5.03 105.19 105.57 2dfi n GLY 143 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 2dfi n GLY 143 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dfi s PHE 144 N -2.04 1.95 0.01 1.61 0.40 -0.60 -5.00 117.98 114.31 2dfi s PHE 144 Ca 0.00 -0.83 0.08 0.00 -0.60 0.00 0.00 56.93 55.58 2dfi s PHE 144 Cb 0.00 -1.80 -0.03 0.00 0.51 0.00 0.00 43.02 41.71 2dfi s PHE 144 CO 0.00 -0.02 -0.23 0.15 0.70 0.00 0.00 175.22 175.81 2dfi s LYS 145 N -4.02 2.06 0.35 0.44 1.02 -0.61 -3.23 119.74 115.75 2dfi s LYS 145 Ca 0.24 -0.96 -0.14 0.00 0.02 0.00 0.00 55.97 55.12 2dfi s LYS 145 Cb 0.01 -2.09 -0.08 0.00 -0.52 0.00 0.00 37.83 35.15 2dfi s LYS 145 CO 0.14 0.55 0.77 -1.25 -0.92 0.00 0.00 175.35 174.64 2dfi s PRO 146 N -0.94 3.96 -0.23 -1.68 0.04 -1.26 -0.32 135.00 134.57 2dfi s PRO 146 Ca 0.11 0.66 -0.25 0.00 0.04 0.00 0.00 61.00 61.57 2dfi s PRO 146 Cb -0.10 -2.39 -0.00 0.00 0.04 0.00 0.00 34.50 32.04 2dfi s PRO 146 CO 0.01 0.09 0.85 0.42 0.04 0.00 0.00 177.00 178.41 2dfi s ILE 147 N -2.11 4.83 -0.70 0.56 1.01 -0.56 -4.52 121.20 119.71 2dfi s ILE 147 Ca 0.54 1.62 0.26 0.00 0.00 0.00 0.00 60.65 63.07 2dfi s ILE 147 Cb -0.10 -4.14 0.29 0.00 0.01 0.00 0.00 42.46 38.52 2dfi s ILE 147 CO 0.21 -0.07 1.77 1.33 0.00 0.00 0.00 174.94 178.18 2dfi n VAL 148 N 5.19 0.63 -0.98 2.92 0.24 -0.16 -3.88 118.33 122.30 2dfi n VAL 148 Ca 0.06 -0.25 0.09 0.00 -2.04 0.00 0.00 64.34 62.20 2dfi n VAL 148 Cb 0.48 -0.64 0.17 0.00 -1.47 0.00 0.00 33.84 32.38 2dfi n VAL 148 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 2dfi n ASN 149 N -2.28 2.82 -3.75 -1.34 6.94 -1.26 -4.93 115.26 111.46 2dfi n ASN 149 Ca 0.05 -2.99 -0.14 0.00 -0.02 0.00 0.00 54.58 51.48 2dfi n ASN 149 Cb 0.41 -0.44 -0.15 0.00 -2.36 0.00 0.00 39.78 37.24 2dfi n ASN 149 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2dfi s LEU 150 N -2.73 0.75 0.00 -4.53 1.43 -1.25 -4.96 118.68 107.38 2dfi s LEU 150 Ca 0.33 0.23 0.00 0.00 -1.03 0.00 0.00 54.13 53.66 2dfi s LEU 150 Cb 0.28 0.23 0.00 0.00 0.03 0.00 0.00 46.19 46.74 2dfi s LEU 150 CO 0.05 -0.15 0.00 -1.54 0.23 0.00 0.00 176.35 174.94 2dfi n SER 151 N 4.30 0.00 -4.22 2.29 3.41 -1.26 -4.68 113.62 113.46 2dfi n SER 151 Ca -0.25 -0.70 -0.29 0.00 -0.26 0.00 0.00 58.87 57.36 2dfi n SER 151 Cb 0.51 0.00 0.22 0.00 -0.26 0.00 0.00 64.21 64.68 2dfi n SER 151 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dfi s GLY 152 N -1.29 1.55 -0.11 5.00 0.00 -0.62 -4.70 107.32 107.16 2dfi s GLY 152 Ca 0.00 -0.60 -0.30 0.00 0.00 0.00 0.00 44.72 43.81 2dfi s GLY 152 CO 0.00 0.17 0.89 -2.38 0.00 0.00 0.00 173.10 171.77 2dfi s HIS 153 N -2.84 -0.45 0.43 1.90 -3.43 -0.12 -1.51 115.29 109.25 2dfi s HIS 153 Ca 0.68 0.73 -0.24 0.00 -0.80 0.00 0.00 55.06 55.44 2dfi s HIS 153 Cb -0.16 0.45 -0.08 0.00 -1.43 0.00 0.00 32.58 31.36 2dfi s HIS 153 CO 0.58 -0.45 1.12 0.21 -2.00 0.00 0.00 174.74 174.20 2dfi s LYS 154 N -1.38 3.97 -0.06 -0.38 2.20 0.46 -0.97 119.74 123.58 2dfi s LYS 154 Ca -0.04 1.67 0.04 0.00 -0.36 0.00 0.00 55.97 57.28 2dfi s LYS 154 Cb -0.00 -2.49 -0.00 0.00 -1.51 0.00 0.00 37.83 33.82 2dfi s LYS 154 CO 0.03 -0.35 -0.20 0.42 -0.36 0.00 0.00 175.35 174.89 2dfi s ILE 155 N -1.58 1.69 0.23 5.43 1.01 0.59 -0.34 121.20 128.23 2dfi s ILE 155 Ca 0.60 -0.84 0.02 0.00 0.00 0.00 0.00 60.65 60.43 2dfi s ILE 155 Cb -0.26 -1.46 -0.05 0.00 0.01 0.00 0.00 42.46 40.70 2dfi s ILE 155 CO 0.32 0.48 0.04 -1.61 0.00 0.00 0.00 174.94 174.17 2dfi s GLU 156 N 0.13 1.32 -0.00 2.79 2.02 -0.57 -4.32 118.70 120.06 2dfi s GLU 156 Ca -0.08 -1.69 -0.37 0.00 0.02 0.00 0.00 54.97 52.85 2dfi s GLU 156 Cb -0.14 -0.38 -0.16 0.00 0.10 0.00 0.00 34.13 33.55 2dfi s GLU 156 CO 0.04 -0.19 1.52 -2.13 0.02 0.00 0.00 175.26 174.51 2dfi n ARG 157 N -0.40 1.38 -2.37 1.61 0.63 -1.26 -0.38 116.66 115.86 2dfi n ARG 157 Ca -0.03 0.50 -0.12 0.00 -0.92 0.00 0.00 57.85 57.28 2dfi n ARG 157 Cb 0.65 -2.19 -0.01 0.00 0.45 0.00 0.00 32.46 31.36 2dfi n ARG 157 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 2dfi n TYR 158 N 3.67 -1.35 -3.42 -0.14 4.01 0.41 -4.91 117.16 115.43 2dfi n TYR 158 Ca 0.20 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.74 2dfi n TYR 158 Cb 0.20 -2.75 -0.10 0.00 -0.31 0.00 0.00 39.34 36.37 2dfi n TYR 158 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 2dfi s LYS 159 N -4.91 0.41 0.21 -0.72 2.20 0.48 -4.71 119.74 112.71 2dfi s LYS 159 Ca 0.00 -0.54 -0.09 0.00 -0.36 0.00 0.00 55.97 54.98 2dfi s LYS 159 Cb 0.00 -0.84 0.23 0.00 -1.51 0.00 0.00 37.83 35.71 2dfi s LYS 159 CO 0.00 -1.09 1.84 1.25 -0.36 0.00 0.00 175.35 176.98 2dfi h LEU 160 N 7.83 0.69 -7.56 5.43 5.85 -1.86 -1.52 115.31 124.16 2dfi h LEU 160 Ca -0.07 0.01 -0.66 0.00 0.84 0.00 0.00 57.88 58.00 2dfi h LEU 160 Cb 1.05 -0.13 -0.40 0.00 0.37 0.00 0.00 40.66 41.54 2dfi h LEU 160 CO 0.31 0.46 -0.64 -1.00 -0.34 0.00 0.00 178.44 177.23 2dfi s HIS 161 N -6.10 3.49 -1.15 1.25 3.76 -1.26 -4.39 115.29 110.89 2dfi s HIS 161 Ca -0.13 -3.01 0.13 0.00 -0.15 0.00 0.00 55.06 51.90 2dfi s HIS 161 Cb 0.16 -2.93 0.58 0.00 1.11 0.00 0.00 32.58 31.51 2dfi s HIS 161 CO 0.77 -0.86 1.38 0.00 -0.85 0.00 0.00 174.74 175.18 2dfi n ALA 162 N 3.75 1.65 0.00 -1.40 0.00 0.54 -4.91 120.51 120.14 2dfi n ALA 162 Ca 0.04 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2dfi n ALA 162 Cb 0.38 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.62 2dfi n ALA 162 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dfi n GLY 163 N -0.18 2.92 3.73 0.00 0.00 -1.26 -4.99 105.19 105.40 2dfi n GLY 163 Ca 0.04 -0.78 -0.41 0.00 0.00 0.00 0.00 46.02 44.87 2dfi n GLY 163 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dfi s ILE 164 N 0.00 3.43 0.37 -0.61 1.01 -1.26 -4.90 121.20 119.24 2dfi s ILE 164 Ca 0.00 1.13 0.08 0.00 0.00 0.00 0.00 60.65 61.87 2dfi s ILE 164 Cb 0.00 -3.73 -0.06 0.00 0.01 0.00 0.00 42.46 38.68 2dfi s ILE 164 CO 0.00 0.15 0.02 -0.94 0.00 0.00 0.00 174.94 174.17 2dfi s SER 165 N 0.50 4.07 -0.48 3.58 1.04 -1.26 -0.40 113.70 120.76 2dfi s SER 165 Ca 0.57 -1.13 0.04 0.00 0.48 0.00 0.00 55.95 55.91 2dfi s SER 165 Cb -0.35 -0.46 0.12 0.00 0.10 0.00 0.00 66.02 65.44 2dfi s SER 165 CO 0.35 -0.33 0.21 -0.63 0.98 0.00 0.00 173.24 173.82 2dfi s ILE 166 N -2.59 2.46 0.93 -1.02 1.01 -0.57 -4.86 121.20 116.55 2dfi s ILE 166 Ca 0.35 -3.07 -0.11 0.00 0.00 0.00 0.00 60.65 57.83 2dfi s ILE 166 Cb 0.03 -2.73 0.11 0.00 0.01 0.00 0.00 42.46 39.88 2dfi s ILE 166 CO 0.19 -0.76 0.91 -2.65 0.00 0.00 0.00 174.94 172.63 2dfi n PRO 167 N 3.38 -0.41 -0.36 2.79 -0.02 -1.26 -1.59 135.00 137.54 2dfi n PRO 167 Ca 0.05 -0.06 0.10 0.00 -2.02 0.00 0.00 63.50 61.57 2dfi n PRO 167 Cb 0.34 -2.21 0.29 0.00 -0.02 0.00 0.00 33.50 31.90 2dfi n PRO 167 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2dfi n ASN 168 N -3.32 3.83 -4.10 2.55 5.03 -1.26 -4.10 115.26 113.88 2dfi n ASN 168 Ca 0.10 -2.07 -0.11 0.00 0.87 0.00 0.00 54.58 53.37 2dfi n ASN 168 Cb 0.52 -0.44 -0.11 0.00 -1.02 0.00 0.00 39.78 38.73 2dfi n ASN 168 CO 0.00 0.00 0.00 0.27 -1.83 0.00 0.00 177.26 175.70 2dfi s ILE 169 N -1.14 0.52 -0.06 2.41 -4.36 -1.26 -3.23 121.20 114.09 2dfi s ILE 169 Ca 0.43 -1.50 -0.30 0.00 -0.26 0.00 0.00 60.65 59.02 2dfi s ILE 169 Cb 0.24 -1.13 -0.02 0.00 1.25 0.00 0.00 42.46 42.80 2dfi s ILE 169 CO 0.28 -0.67 1.02 -0.47 0.24 0.00 0.00 174.94 175.34 2dfi s TYR 170 N -2.62 3.54 -0.20 1.37 6.14 -1.25 -4.54 117.35 119.79 2dfi s TYR 170 Ca 0.00 1.59 0.01 0.00 0.64 0.00 0.00 57.07 59.32 2dfi s TYR 170 Cb -0.02 -3.19 0.04 0.00 0.42 0.00 0.00 41.96 39.21 2dfi s TYR 170 CO -0.03 -0.27 -0.12 1.03 0.64 0.00 0.00 175.55 176.80 2dfi s ARG 171 N 1.65 2.16 0.56 4.97 0.52 -1.26 -4.99 118.95 122.57 2dfi s ARG 171 Ca 0.51 -0.85 0.34 0.00 -0.52 0.00 0.00 55.73 55.21 2dfi s ARG 171 Cb -0.20 -2.43 1.47 0.00 0.52 0.00 0.00 34.95 34.31 2dfi s ARG 171 CO 0.22 -0.40 1.76 -1.00 0.02 0.00 0.00 175.30 175.91 2dfi h PRO 172 N 7.96 0.00 -0.60 3.54 0.13 -1.96 -1.96 132.00 139.11 2dfi h PRO 172 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 2dfi h PRO 172 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 2dfi h PRO 172 CO 0.50 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 178.99 2dfi n HIS 173 N -3.95 1.68 -1.77 1.56 8.25 -1.26 -4.63 115.22 115.10 2dfi n HIS 173 Ca 0.21 -0.67 -0.40 0.00 -0.26 0.00 0.00 57.72 56.60 2dfi n HIS 173 Cb 1.15 -0.35 -0.01 0.00 1.12 0.00 0.00 29.99 31.91 2dfi n HIS 173 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 2dfi n ASP 174 N 0.85 7.29 0.00 0.41 8.00 -0.74 -4.62 116.55 127.75 2dfi n ASP 174 Ca 0.26 -2.90 0.13 0.00 0.71 0.00 0.00 54.79 52.99 2dfi n ASP 174 Cb 1.01 -1.49 0.66 0.00 -0.02 0.00 0.00 41.12 41.27 2dfi n ASP 174 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2dfi n ASN 175 N 3.28 0.00 -4.67 -2.24 5.03 -1.26 -1.60 115.26 113.79 2dfi n ASN 175 Ca 0.63 -0.13 -0.47 0.00 0.87 0.00 0.00 54.58 55.49 2dfi n ASN 175 Cb 0.28 -0.27 -0.04 0.00 -1.02 0.00 0.00 39.78 38.73 2dfi n ASN 175 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2dfi n TYR 176 N -1.27 2.32 -3.53 3.10 4.19 -1.26 -4.72 117.16 116.00 2dfi n TYR 176 Ca 0.13 0.13 -0.36 0.00 3.31 0.00 0.00 57.90 61.10 2dfi n TYR 176 Cb 0.20 -2.60 -0.07 0.00 0.49 0.00 0.00 39.34 37.36 2dfi n TYR 176 CO 0.00 0.00 0.00 0.08 0.91 0.00 0.00 176.86 177.85 2dfi s VAL 177 N 2.27 5.30 0.15 2.97 1.01 -1.26 -0.55 120.40 130.28 2dfi s VAL 177 Ca 0.84 0.57 -0.31 0.00 0.00 0.00 0.00 61.98 63.08 2dfi s VAL 177 Cb -0.67 -3.64 -0.09 0.00 0.00 0.00 0.00 36.38 31.98 2dfi s VAL 177 CO 0.43 0.39 1.47 -0.76 0.00 0.00 0.00 175.10 176.63 2dfi s LEU 178 N 0.45 4.37 0.05 3.92 1.43 -0.21 -4.86 118.68 123.83 2dfi s LEU 178 Ca 0.17 2.50 0.03 0.00 -1.03 0.00 0.00 54.13 55.80 2dfi s LEU 178 Cb -0.13 -3.59 -0.04 0.00 0.03 0.00 0.00 46.19 42.46 2dfi s LEU 178 CO 0.04 -0.73 0.03 -0.54 0.23 0.00 0.00 176.35 175.38 2dfi s LYS 179 N 0.92 2.76 0.31 1.70 3.01 -1.26 -1.04 119.74 126.14 2dfi s LYS 179 Ca 0.66 -0.70 -0.29 0.00 -1.01 0.00 0.00 55.97 54.63 2dfi s LYS 179 Cb -0.40 -2.66 -0.11 0.00 -1.01 0.00 0.00 37.83 33.65 2dfi s LYS 179 CO 0.32 0.58 1.46 -1.83 0.51 0.00 0.00 175.35 176.39 2dfi s GLU 180 N -2.07 4.21 0.00 1.68 -1.05 -1.26 -1.08 118.70 119.12 2dfi s GLU 180 Ca 0.25 2.42 0.00 0.00 -0.15 0.00 0.00 54.97 57.49 2dfi s GLU 180 Cb -0.12 -3.04 0.00 0.00 -0.44 0.00 0.00 34.13 30.53 2dfi s GLU 180 CO 0.17 -0.45 0.00 0.41 0.95 0.00 0.00 175.26 176.34 2dfi n GLY 181 N 1.39 2.31 3.77 -3.83 0.00 0.97 -4.98 105.19 104.83 2dfi n GLY 181 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 2dfi n GLY 181 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dfi s ASP 182 N -1.41 6.71 -0.22 1.61 1.11 -0.25 -4.75 116.67 119.47 2dfi s ASP 182 Ca 0.00 2.74 -0.03 0.00 0.18 0.00 0.00 52.55 55.44 2dfi s ASP 182 Cb 0.00 -2.65 0.00 0.00 1.07 0.00 0.00 42.92 41.34 2dfi s ASP 182 CO 0.00 -0.59 -0.07 -0.69 1.18 0.00 0.00 175.17 175.00 2dfi s VAL 183 N -1.09 3.10 0.09 -1.27 1.01 -1.26 -0.01 120.40 120.97 2dfi s VAL 183 Ca 0.50 -0.64 0.06 0.00 0.00 0.00 0.00 61.98 61.89 2dfi s VAL 183 Cb -0.41 -2.42 -0.03 0.00 0.00 0.00 0.00 36.38 33.52 2dfi s VAL 183 CO 0.54 0.40 -0.15 -0.36 0.00 0.00 0.00 175.10 175.54 2dfi s PHE 184 N 1.43 1.33 -0.14 5.22 0.08 -0.64 -0.30 117.98 124.96 2dfi s PHE 184 Ca 0.05 -0.50 -0.01 0.00 0.12 0.00 0.00 56.93 56.59 2dfi s PHE 184 Cb -0.14 -0.72 -0.02 0.00 -0.57 0.00 0.00 43.02 41.56 2dfi s PHE 184 CO -0.05 0.10 -0.10 0.00 -0.10 0.00 0.00 175.22 175.06 2dfi s ALA 185 N -1.62 2.73 -0.25 5.36 0.00 -0.14 -0.71 121.76 127.12 2dfi s ALA 185 Ca 0.03 -0.87 -0.05 0.00 0.00 0.00 0.00 51.96 51.07 2dfi s ALA 185 Cb -0.08 -1.31 -0.01 0.00 0.00 0.00 0.00 23.12 21.72 2dfi s ALA 185 CO 0.03 0.25 0.02 0.42 0.00 0.00 0.00 175.76 176.47 2dfi s ILE 186 N 0.34 3.78 -0.59 0.00 1.01 -0.57 -0.95 121.20 124.21 2dfi s ILE 186 Ca -0.09 -0.45 0.04 0.00 0.00 0.00 0.00 60.65 60.15 2dfi s ILE 186 Cb -0.15 -2.79 0.16 0.00 0.01 0.00 0.00 42.46 39.69 2dfi s ILE 186 CO 0.05 0.31 0.42 -1.61 0.00 0.00 0.00 174.94 174.11 2dfi s GLU 187 N 1.52 1.92 0.21 2.79 2.02 -1.26 -2.65 118.70 123.25 2dfi s GLU 187 Ca 0.05 -2.86 -0.30 0.00 0.02 0.00 0.00 54.97 51.88 2dfi s GLU 187 Cb -0.15 -2.79 -0.09 0.00 0.10 0.00 0.00 34.13 31.20 2dfi s GLU 187 CO 0.00 -1.29 1.29 -2.14 0.02 0.00 0.00 175.26 173.14 2dfi s PRO 188 N -0.83 4.40 -0.16 0.39 0.02 -1.15 -4.18 135.00 133.49 2dfi s PRO 188 Ca 0.26 2.05 0.01 0.00 0.02 0.00 0.00 61.00 63.33 2dfi s PRO 188 Cb -0.05 -3.19 0.02 0.00 0.02 0.00 0.00 34.50 31.30 2dfi s PRO 188 CO -0.15 -0.22 -0.18 -0.06 -0.33 0.00 0.00 177.00 176.05 2dfi s PHE 189 N -0.03 2.56 0.04 6.54 0.08 -1.26 -3.17 117.98 122.73 2dfi s PHE 189 Ca 0.55 -1.46 0.09 0.00 0.12 0.00 0.00 56.93 56.23 2dfi s PHE 189 Cb -0.36 -1.79 -0.03 0.00 -0.57 0.00 0.00 43.02 40.27 2dfi s PHE 189 CO 0.39 -0.73 -0.26 0.00 -0.10 0.00 0.00 175.22 174.51 2dfi s ALA 190 N 1.28 2.25 0.26 5.36 0.00 -0.68 -1.50 121.76 128.74 2dfi s ALA 190 Ca 0.03 -1.26 -0.01 0.00 0.00 0.00 0.00 51.96 50.71 2dfi s ALA 190 Cb -0.13 -0.48 -0.03 0.00 0.00 0.00 0.00 23.12 22.48 2dfi s ALA 190 CO -0.11 0.53 0.28 -0.08 0.00 0.00 0.00 175.76 176.38 2dfi s THR 191 N -0.80 0.00 -1.44 0.00 -1.32 0.57 -0.60 115.64 112.05 2dfi s THR 191 Ca 0.12 -1.84 0.12 0.00 -1.21 0.00 0.00 61.69 58.88 2dfi s THR 191 Cb -0.10 -2.48 0.07 0.00 -1.51 0.00 0.00 72.50 68.49 2dfi s THR 191 CO 0.02 0.00 0.84 2.30 -2.21 0.00 0.00 174.62 175.57 2dfi n ILE 192 N -0.42 0.00 0.00 5.08 -5.35 -1.10 -1.57 119.36 116.01 2dfi n ILE 192 Ca 0.02 -0.46 0.00 0.00 -0.27 0.00 0.00 62.75 62.04 2dfi n ILE 192 Cb 0.64 1.23 0.00 0.00 -1.74 0.00 0.00 39.64 39.77 2dfi n ILE 192 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2dfi n GLY 193 N 0.78 1.07 0.10 3.28 0.00 -1.26 -4.91 105.19 104.26 2dfi n GLY 193 Ca 0.07 -1.13 -0.15 0.00 0.00 0.00 0.00 46.02 44.81 2dfi n GLY 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dfi h ALA 194 N -1.73 0.35 0.00 4.61 0.00 -1.92 -3.46 119.26 117.10 2dfi h ALA 194 Ca 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 54.91 53.77 2dfi h ALA 194 Cb 0.00 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2dfi h ALA 194 CO 0.00 1.21 0.00 0.41 0.00 0.00 0.00 179.25 180.87 2dfi n GLY 195 N 1.63 1.47 3.50 0.00 0.00 -1.26 -4.92 105.19 105.61 2dfi n GLY 195 Ca -0.15 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.73 2dfi n GLY 195 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2dfi s GLN 196 N -0.31 0.73 0.15 1.61 0.74 -1.26 -0.99 119.66 120.33 2dfi s GLN 196 Ca 0.00 0.76 0.06 0.00 0.05 0.00 0.00 55.36 56.23 2dfi s GLN 196 Cb 0.00 0.35 -0.04 0.00 1.10 0.00 0.00 33.01 34.43 2dfi s GLN 196 CO 0.00 -0.11 0.06 0.14 -0.55 0.00 0.00 175.29 174.84 2dfi s VAL 197 N 0.15 4.13 0.10 1.34 -7.23 -1.26 -0.91 120.40 116.72 2dfi s VAL 197 Ca -0.01 -1.19 0.06 0.00 -1.81 0.00 0.00 61.98 59.03 2dfi s VAL 197 Cb -0.04 -3.07 -0.03 0.00 0.56 0.00 0.00 36.38 33.80 2dfi s VAL 197 CO 0.02 -0.07 -0.16 -0.63 -0.31 0.00 0.00 175.10 173.95 2dfi s ILE 198 N -1.67 1.39 0.20 -0.62 1.01 -0.26 -4.87 121.20 116.38 2dfi s ILE 198 Ca 0.29 -1.53 -0.30 0.00 0.00 0.00 0.00 60.65 59.11 2dfi s ILE 198 Cb -0.10 -1.39 -0.08 0.00 0.01 0.00 0.00 42.46 40.90 2dfi s ILE 198 CO 0.21 -0.24 0.99 -1.61 0.00 0.00 0.00 174.94 174.29 2dfi s GLU 199 N -2.13 4.74 0.06 2.79 2.02 -1.26 -1.58 118.70 123.35 2dfi s GLU 199 Ca 0.05 1.56 -0.06 0.00 0.02 0.00 0.00 54.97 56.54 2dfi s GLU 199 Cb -0.08 -3.29 -0.01 0.00 0.10 0.00 0.00 34.13 30.84 2dfi s GLU 199 CO 0.03 0.32 0.11 0.14 0.02 0.00 0.00 175.26 175.88 2dfi s VAL 200 N -0.69 0.15 0.64 2.63 -7.23 0.28 -4.96 120.40 111.22 2dfi s VAL 200 Ca 0.44 -1.27 -0.17 0.00 -1.81 0.00 0.00 61.98 59.17 2dfi s VAL 200 Cb -0.27 -1.20 -0.01 0.00 0.56 0.00 0.00 36.38 35.46 2dfi s VAL 200 CO 0.33 -0.70 1.15 -2.84 -0.31 0.00 0.00 175.10 172.73 2dfi s PRO 201 N -3.37 2.79 0.60 4.82 0.02 -1.26 -2.36 135.00 136.24 2dfi s PRO 201 Ca 0.01 1.60 0.06 0.00 0.02 0.00 0.00 61.00 62.70 2dfi s PRO 201 Cb 0.03 -1.93 0.09 0.00 0.02 0.00 0.00 34.50 32.71 2dfi s PRO 201 CO -0.08 -1.30 0.82 -1.25 -0.33 0.00 0.00 177.00 174.86 2dfi s PRO 202 N -3.75 2.20 -0.38 5.54 0.04 -1.26 -4.78 135.00 132.61 2dfi s PRO 202 Ca 0.72 -1.40 -0.15 0.00 0.04 0.00 0.00 61.00 60.21 2dfi s PRO 202 Cb -0.25 -2.56 0.00 0.00 0.04 0.00 0.00 34.50 31.73 2dfi s PRO 202 CO 0.38 -0.95 0.31 0.99 0.04 0.00 0.00 177.00 177.76 2dfi s THR 203 N -2.77 5.23 -0.89 1.26 2.01 -1.26 -2.60 115.64 116.63 2dfi s THR 203 Ca 0.62 -0.39 0.10 0.00 0.31 0.00 0.00 61.69 62.34 2dfi s THR 203 Cb -0.06 -3.86 -0.02 0.00 0.01 0.00 0.00 72.50 68.57 2dfi s THR 203 CO 0.40 -0.20 0.62 0.18 -0.69 0.00 0.00 174.62 174.92 2dfi n LEU 204 N 5.23 1.13 -4.01 4.42 4.77 -1.26 -4.87 117.00 122.41 2dfi n LEU 204 Ca -0.11 -0.73 -0.16 0.00 -0.03 0.00 0.00 56.01 54.99 2dfi n LEU 204 Cb 0.48 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.44 2dfi n LEU 204 CO 0.40 0.23 -0.41 -0.63 -1.33 0.00 0.00 177.39 175.65 2dfi s ILE 205 N -1.48 0.56 0.13 -0.08 1.01 -1.25 -1.48 121.20 118.61 2dfi s ILE 205 Ca 0.08 -0.53 -0.02 0.00 0.00 0.00 0.00 60.65 60.18 2dfi s ILE 205 Cb 0.08 -0.51 -0.04 0.00 0.01 0.00 0.00 42.46 42.00 2dfi s ILE 205 CO 0.28 0.00 0.08 -0.31 0.00 0.00 0.00 174.94 175.00 2dfi s TYR 206 N -0.51 0.77 -0.10 3.97 2.02 -0.53 -0.17 117.35 122.81 2dfi s TYR 206 Ca -0.01 -1.15 -0.08 0.00 -0.37 0.00 0.00 57.07 55.46 2dfi s TYR 206 Cb -0.05 -0.41 0.03 0.00 -0.40 0.00 0.00 41.96 41.13 2dfi s TYR 206 CO 0.00 -0.54 0.24 1.41 -1.57 0.00 0.00 175.55 175.10 2dfi s MET 207 N -4.03 0.26 0.26 -0.62 -2.45 -0.26 -1.20 119.30 111.26 2dfi s MET 207 Ca 0.22 0.39 -0.30 0.00 -1.25 0.00 0.00 55.69 54.76 2dfi s MET 207 Cb 0.07 0.06 -0.10 0.00 1.25 0.00 0.00 34.83 36.11 2dfi s MET 207 CO 0.01 -0.07 1.37 -0.47 1.05 0.00 0.00 175.02 176.90 2dfi s TYR 208 N 0.46 3.09 0.00 4.11 5.04 -1.26 -0.37 117.35 128.42 2dfi s TYR 208 Ca -0.03 1.18 0.00 0.00 -2.44 0.00 0.00 57.07 55.78 2dfi s TYR 208 Cb -0.04 -3.72 0.00 0.00 0.35 0.00 0.00 41.96 38.55 2dfi s TYR 208 CO -0.02 -2.24 0.00 0.28 -1.34 0.00 0.00 175.55 172.23 2dfi n VAL 209 N 2.02 0.00 -4.17 3.14 0.31 -0.14 -4.83 118.33 114.66 2dfi n VAL 209 Ca 0.05 0.12 -0.11 0.00 -0.01 0.00 0.00 64.34 64.38 2dfi n VAL 209 Cb 0.41 -1.09 -0.10 0.00 -0.91 0.00 0.00 33.84 32.15 2dfi n VAL 209 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2dfi s ARG 210 N -0.94 0.84 -1.23 5.55 1.70 -0.98 -5.04 118.95 118.84 2dfi s ARG 210 Ca 0.00 -1.31 -0.08 0.00 -0.47 0.00 0.00 55.73 53.87 2dfi s ARG 210 Cb 0.00 -0.25 0.20 0.00 -0.57 0.00 0.00 34.95 34.33 2dfi s ARG 210 CO 0.00 -0.00 1.79 -3.47 -1.08 0.00 0.00 175.30 172.53 2dfi n ASP 211 N 0.04 5.43 -4.87 -2.89 4.64 -1.26 -4.52 116.55 113.11 2dfi n ASP 211 Ca -0.13 -3.19 -0.31 0.00 -1.38 0.00 0.00 54.79 49.78 2dfi n ASP 211 Cb 0.60 -1.43 -0.05 0.00 -1.04 0.00 0.00 41.12 39.21 2dfi n ASP 211 CO 0.00 0.00 0.00 0.68 -0.82 0.00 0.00 177.20 177.06 2dfi s VAL 212 N -0.42 4.80 0.25 5.18 -7.23 -1.26 -5.03 120.40 116.69 2dfi s VAL 212 Ca 0.37 0.64 -0.30 0.00 -1.81 0.00 0.00 61.98 60.88 2dfi s VAL 212 Cb 0.09 -3.67 -0.11 0.00 0.56 0.00 0.00 36.38 33.25 2dfi s VAL 212 CO 0.03 -0.31 1.56 -2.84 -0.31 0.00 0.00 175.10 173.24 2dfi s PRO 213 N -3.34 4.17 -0.17 4.82 0.02 -1.26 -4.98 135.00 134.27 2dfi s PRO 213 Ca 0.51 2.48 -0.01 0.00 0.02 0.00 0.00 61.00 64.00 2dfi s PRO 213 Cb -0.10 -3.07 0.04 0.00 0.02 0.00 0.00 34.50 31.39 2dfi s PRO 213 CO 0.25 -0.58 -0.04 0.08 -0.33 0.00 0.00 177.00 176.37 2dfi s VAL 214 N 0.29 1.02 0.20 3.83 1.01 -1.26 -5.02 120.40 120.47 2dfi s VAL 214 Ca 0.64 -0.60 -0.05 0.00 0.00 0.00 0.00 61.98 61.97 2dfi s VAL 214 Cb -0.46 -1.24 0.01 0.00 0.00 0.00 0.00 36.38 34.70 2dfi s VAL 214 CO 0.42 0.09 1.59 0.03 0.00 0.00 0.00 175.10 177.23 2dfi h ARG 215 N 8.14 0.76 -6.27 2.72 -0.00 -2.00 -3.42 114.38 114.31 2dfi h ARG 215 Ca -0.23 -0.34 -0.56 0.00 -0.50 0.00 0.00 59.98 58.35 2dfi h ARG 215 Cb 1.11 -0.02 -0.02 0.00 0.00 0.00 0.00 29.97 31.04 2dfi h ARG 215 CO 0.39 0.96 1.12 0.08 0.00 0.00 0.00 179.97 182.52 2dfi s VAL 216 N -4.48 3.67 0.12 2.04 1.01 -1.26 -4.92 120.40 116.58 2dfi s VAL 216 Ca -0.09 0.77 -0.29 0.00 0.00 0.00 0.00 61.98 62.37 2dfi s VAL 216 Cb 0.12 -3.65 -0.07 0.00 0.00 0.00 0.00 36.38 32.78 2dfi s VAL 216 CO 0.84 -0.24 1.60 0.00 0.00 0.00 0.00 175.10 177.30 2dfi h ALA 217 N 10.55 -0.58 -0.95 5.51 0.00 -1.98 0.31 119.26 132.13 2dfi h ALA 217 Ca -0.35 -0.03 0.12 0.00 0.00 0.00 0.00 54.91 54.65 2dfi h ALA 217 Cb 1.16 0.65 -0.08 0.00 0.00 0.00 0.00 17.79 19.52 2dfi h ALA 217 CO 0.99 -0.90 0.60 0.37 0.00 0.00 0.00 179.25 180.32 2dfi h GLN 218 N -0.54 0.86 -0.01 0.00 4.15 -1.97 0.96 115.11 118.57 2dfi h GLN 218 Ca 0.05 -0.05 -0.27 0.00 0.77 0.00 0.00 58.65 59.15 2dfi h GLN 218 Cb 0.61 -0.19 0.02 0.00 0.21 0.00 0.00 27.48 28.13 2dfi h GLN 218 CO -0.28 0.57 -1.03 0.00 -1.93 0.00 0.00 178.83 176.16 2dfi h ALA 219 N 1.56 0.14 -0.94 3.38 0.00 -1.76 -2.35 119.26 119.29 2dfi h ALA 219 Ca 0.46 -0.69 0.01 0.00 0.00 0.00 0.00 54.91 54.69 2dfi h ALA 219 Cb 0.53 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 2dfi h ALA 219 CO -0.23 0.69 0.61 -0.09 0.00 0.00 0.00 179.25 180.23 2dfi h ARG 220 N 0.40 1.25 0.00 0.00 2.43 0.55 -1.74 114.38 117.27 2dfi h ARG 220 Ca -0.13 -0.08 -0.14 0.00 -0.81 0.00 0.00 59.98 58.82 2dfi h ARG 220 Cb 1.68 -0.28 -0.02 0.00 -0.42 0.00 0.00 29.97 30.94 2dfi h ARG 220 CO 0.20 0.84 -0.68 0.74 -1.51 0.00 0.00 179.97 179.56 2dfi h PHE 221 N 1.28 0.00 -0.31 2.20 -1.00 -0.88 -2.78 116.94 115.44 2dfi h PHE 221 Ca 0.34 0.00 -0.09 0.00 2.81 0.00 0.00 57.97 61.03 2dfi h PHE 221 Cb -0.13 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.42 2dfi h PHE 221 CO -0.00 0.68 -0.19 1.25 -1.61 0.00 0.00 178.31 178.44 2dfi h LEU 222 N 0.00 0.57 -0.34 1.54 5.85 -0.94 -1.70 115.31 120.29 2dfi h LEU 222 Ca -0.01 -0.18 -0.07 0.00 0.84 0.00 0.00 57.88 58.46 2dfi h LEU 222 Cb 1.44 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.31 2dfi h LEU 222 CO 0.09 0.77 -0.06 0.25 -0.34 0.00 0.00 178.44 179.15 2dfi h LEU 223 N 0.51 0.64 -1.39 2.25 5.85 -1.26 0.11 115.31 122.03 2dfi h LEU 223 Ca 0.08 -0.35 -0.03 0.00 0.84 0.00 0.00 57.88 58.42 2dfi h LEU 223 Cb 0.62 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 2dfi h LEU 223 CO 0.04 0.84 0.05 0.00 -0.34 0.00 0.00 178.44 179.04 2dfi h ALA 224 N 0.82 1.51 0.38 1.25 0.00 -1.29 0.60 119.26 122.53 2dfi h ALA 224 Ca 0.09 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2dfi h ALA 224 Cb 0.55 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2dfi h ALA 224 CO 0.03 0.36 -0.18 -0.22 0.00 0.00 0.00 179.25 179.24 2dfi h LYS 225 N 0.45 -0.49 -0.35 0.00 3.64 -1.00 -3.07 116.57 115.74 2dfi h LYS 225 Ca 0.11 0.03 0.07 0.00 -1.27 0.00 0.00 60.65 59.59 2dfi h LYS 225 Cb 0.22 0.11 -0.06 0.00 -0.41 0.00 0.00 32.23 32.09 2dfi h LYS 225 CO -0.00 -0.18 -0.04 0.82 -2.27 0.00 0.00 179.45 177.78 2dfi h ILE 226 N -0.87 0.69 -0.69 2.00 2.04 -0.71 -0.84 117.51 119.14 2dfi h ILE 226 Ca -0.05 -0.02 0.12 0.00 1.00 0.00 0.00 64.86 65.91 2dfi h ILE 226 Cb 0.54 0.64 -0.08 0.00 -0.74 0.00 0.00 36.82 37.18 2dfi h ILE 226 CO 0.09 0.01 0.27 0.50 0.00 0.00 0.00 178.15 179.01 2dfi h LYS 227 N 0.05 0.42 0.00 2.37 3.64 -0.94 0.12 116.57 122.24 2dfi h LYS 227 Ca 0.17 -0.03 -0.17 0.00 -1.27 0.00 0.00 60.65 59.36 2dfi h LYS 227 Cb 0.25 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.95 2dfi h LYS 227 CO -0.32 0.28 -1.21 0.00 -2.27 0.00 0.00 179.45 175.93 2dfi h ARG 228 N 0.44 0.00 0.16 1.90 3.08 -1.40 -2.48 114.38 116.08 2dfi h ARG 228 Ca 0.36 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 60.10 2dfi h ARG 228 Cb 0.49 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.55 2dfi h ARG 228 CO -0.35 0.39 -1.56 1.49 -1.07 0.00 0.00 179.97 178.87 2dfi h GLU 229 N 0.00 0.35 0.00 0.04 4.81 -0.90 -3.40 114.58 115.47 2dfi h GLU 229 Ca -0.13 -0.59 -0.11 0.00 -0.13 0.00 0.00 59.36 58.40 2dfi h GLU 229 Cb 1.58 0.22 -0.02 0.00 0.63 0.00 0.00 28.75 31.16 2dfi h GLU 229 CO 0.06 1.28 -1.78 0.66 -0.73 0.00 0.00 179.01 178.50 2dfi n TYR 230 N -3.75 0.00 -0.81 0.92 4.01 0.38 -5.07 117.16 112.83 2dfi n TYR 230 Ca -0.24 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.50 2dfi n TYR 230 Cb 1.00 -0.48 0.00 0.00 -0.31 0.00 0.00 39.34 39.55 2dfi n TYR 230 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2dfi n GLY 231 N 1.88 2.86 0.95 2.72 0.00 -0.93 -2.15 105.19 110.52 2dfi n GLY 231 Ca -0.11 -0.27 0.08 0.00 0.00 0.00 0.00 46.02 45.72 2dfi n GLY 231 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dfi n THR 232 N 0.00 0.74 -3.85 2.61 -2.24 -1.26 -4.34 114.28 105.94 2dfi n THR 232 Ca 0.00 -0.68 -0.35 0.00 -2.27 0.00 0.00 64.05 60.74 2dfi n THR 232 Cb 0.00 0.29 -0.05 0.00 -2.10 0.00 0.00 70.33 68.46 2dfi n THR 232 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2dfi s LEU 233 N -1.06 4.38 0.54 3.22 1.02 -0.91 -4.78 118.68 121.09 2dfi s LEU 233 Ca 0.34 0.46 -0.21 0.00 0.02 0.00 0.00 54.13 54.73 2dfi s LEU 233 Cb 0.18 -2.42 -0.07 0.00 0.02 0.00 0.00 46.19 43.90 2dfi s LEU 233 CO 0.22 0.32 1.05 -2.65 0.02 0.00 0.00 176.35 175.30 2dfi n PRO 234 N 1.40 1.19 -4.15 1.29 -0.02 -1.26 -4.68 135.00 128.76 2dfi n PRO 234 Ca -0.14 0.44 -0.11 0.00 -2.02 0.00 0.00 63.50 61.67 2dfi n PRO 234 Cb 0.54 -2.21 -0.10 0.00 -0.02 0.00 0.00 33.50 31.71 2dfi n PRO 234 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 2dfi s PHE 235 N -1.41 0.84 0.01 6.00 -0.12 -0.34 -4.34 117.98 118.63 2dfi s PHE 235 Ca 0.71 -0.88 -0.03 0.00 -0.05 0.00 0.00 56.93 56.68 2dfi s PHE 235 Cb -0.45 -0.49 -0.04 0.00 -0.63 0.00 0.00 43.02 41.40 2dfi s PHE 235 CO 0.50 -0.16 0.22 0.00 -0.05 0.00 0.00 175.22 175.73 2dfi s ALA 236 N -3.41 3.93 0.34 1.99 0.00 -1.26 -1.45 121.76 121.91 2dfi s ALA 236 Ca 0.09 -0.73 0.04 0.00 0.00 0.00 0.00 51.96 51.37 2dfi s ALA 236 Cb 0.04 -1.93 0.68 0.00 0.00 0.00 0.00 23.12 21.92 2dfi s ALA 236 CO -0.05 0.74 1.94 -0.92 0.00 0.00 0.00 175.76 177.47 2dfi h TYR 237 N 3.68 0.84 -0.88 0.00 3.20 -1.60 -1.28 116.97 120.94 2dfi h TYR 237 Ca -0.48 0.02 0.09 0.00 3.14 0.00 0.00 58.73 61.50 2dfi h TYR 237 Cb 1.18 -0.28 -0.06 0.00 1.54 0.00 0.00 36.73 39.11 2dfi h TYR 237 CO 0.66 0.44 0.57 -0.09 -1.64 0.00 0.00 178.16 178.10 2dfi h ARG 238 N 0.83 0.86 0.00 1.82 2.43 -1.80 -1.56 114.38 116.96 2dfi h ARG 238 Ca 0.34 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.46 2dfi h ARG 238 Cb 0.26 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.61 2dfi h ARG 238 CO -0.12 0.57 0.00 -1.49 -1.51 0.00 0.00 179.97 177.42 2dfi h TRP 239 N 0.89 0.00 0.00 2.20 6.55 -1.60 -2.98 115.95 121.01 2dfi h TRP 239 Ca 0.41 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.25 2dfi h TRP 239 Cb 0.38 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.68 2dfi h TRP 239 CO -0.00 0.00 -0.55 1.28 -1.05 0.00 0.00 178.44 178.12 2dfi n LEU 240 N -2.52 0.45 -0.08 -4.49 4.77 -0.61 -4.69 117.00 109.83 2dfi n LEU 240 Ca -0.00 -0.47 0.26 0.00 -0.03 0.00 0.00 56.01 55.77 2dfi n LEU 240 Cb 0.16 0.00 0.70 0.00 -2.33 0.00 0.00 43.42 41.95 2dfi n LEU 240 CO 0.18 0.11 1.23 1.56 -1.33 0.00 0.00 177.39 179.15 2dfi h GLN 241 N 0.00 0.00 -0.25 3.23 4.20 -1.32 0.13 115.11 121.10 2dfi h GLN 241 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2dfi h GLN 241 Cb 0.26 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.04 2dfi h GLN 241 CO 0.00 0.00 0.00 0.09 -0.67 0.00 0.00 178.83 178.25 2dfi n ASN 242 N -3.84 2.94 0.06 1.46 3.02 -1.26 -4.28 115.26 113.36 2dfi n ASN 242 Ca 0.15 -1.92 -0.16 0.00 -0.03 0.00 0.00 54.58 52.62 2dfi n ASN 242 Cb 0.93 -0.16 -0.14 0.00 -0.61 0.00 0.00 39.78 39.80 2dfi n ASN 242 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 2dfi h ASP 243 N 4.02 0.35 -5.07 6.41 3.45 -1.05 -3.48 116.42 121.04 2dfi h ASP 243 Ca 0.00 -0.48 -0.04 0.00 0.43 0.00 0.00 57.03 56.93 2dfi h ASP 243 Cb 0.88 -0.11 -0.12 0.00 -0.56 0.00 0.00 39.33 39.41 2dfi h ASP 243 CO 0.00 1.40 -0.01 0.00 -1.57 0.00 0.00 179.24 179.07 2dfi s MET 244 N -2.62 1.16 0.24 3.56 0.23 -1.25 -5.14 119.30 115.48 2dfi s MET 244 Ca -0.08 -0.70 -0.30 0.00 -1.03 0.00 0.00 55.69 53.58 2dfi s MET 244 Cb 0.07 0.50 -0.15 0.00 -1.53 0.00 0.00 34.83 33.72 2dfi s MET 244 CO 0.85 -0.47 1.06 -2.30 -2.03 0.00 0.00 175.02 172.13 2dfi n PRO 245 N -0.27 1.23 -0.21 3.16 -0.02 -1.26 -4.64 135.00 132.99 2dfi n PRO 245 Ca -0.15 0.44 -0.05 0.00 -2.02 0.00 0.00 63.50 61.72 2dfi n PRO 245 Cb 0.64 -1.85 0.01 0.00 -0.02 0.00 0.00 33.50 32.28 2dfi n PRO 245 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2dfi h GLU 246 N 2.56 -0.14 -0.24 -0.52 4.81 -1.98 0.11 114.58 119.18 2dfi h GLU 246 Ca -0.41 0.01 0.06 0.00 -0.13 0.00 0.00 59.36 58.90 2dfi h GLU 246 Cb 1.34 0.03 -0.07 0.00 0.63 0.00 0.00 28.75 30.69 2dfi h GLU 246 CO 0.65 -0.09 -0.25 0.78 -0.73 0.00 0.00 179.01 179.36 2dfi h GLY 247 N -0.15 -0.18 1.02 1.92 0.00 -2.00 0.40 103.07 104.08 2dfi h GLY 247 Ca 0.24 0.31 -0.04 0.00 0.00 0.00 0.00 47.33 47.85 2dfi h GLY 247 CO -0.68 -0.20 0.29 1.46 0.00 0.00 0.00 176.54 177.41 2dfi h GLN 248 N -0.26 1.05 -0.36 4.80 4.20 -1.68 -2.47 115.11 120.39 2dfi h GLN 248 Ca 0.14 -0.18 0.02 0.00 0.06 0.00 0.00 58.65 58.68 2dfi h GLN 248 Cb 0.47 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 28.05 2dfi h GLN 248 CO -0.39 0.86 0.20 1.25 -0.67 0.00 0.00 178.83 180.07 2dfi h LEU 249 N 1.01 0.31 -0.93 1.46 5.85 -0.16 0.63 115.31 123.47 2dfi h LEU 249 Ca 0.24 0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.97 2dfi h LEU 249 Cb 0.19 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.12 2dfi h LEU 249 CO -0.02 0.23 0.61 0.11 -0.34 0.00 0.00 178.44 179.02 2dfi h LYS 250 N 0.41 1.23 -0.01 1.25 1.57 -0.70 -1.74 116.57 118.58 2dfi h LYS 250 Ca 0.14 -0.08 -0.17 0.00 -1.87 0.00 0.00 60.65 58.68 2dfi h LYS 250 Cb 0.02 -0.27 -0.02 0.00 0.08 0.00 0.00 32.23 32.04 2dfi h LYS 250 CO -0.08 0.82 -0.76 1.25 -0.57 0.00 0.00 179.45 180.11 2dfi h LEU 251 N 1.26 0.11 -0.46 2.94 5.85 -0.99 -2.46 115.31 121.56 2dfi h LEU 251 Ca 0.34 -0.08 -0.09 0.00 0.84 0.00 0.00 57.88 58.89 2dfi h LEU 251 Cb -0.13 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 2dfi h LEU 251 CO -0.07 0.83 -0.07 0.00 -0.34 0.00 0.00 178.44 178.78 2dfi h ALA 252 N 1.17 0.63 -0.45 1.25 0.00 -0.50 -1.56 119.26 119.80 2dfi h ALA 252 Ca -0.02 -0.32 -0.04 0.00 0.00 0.00 0.00 54.91 54.53 2dfi h ALA 252 Cb 1.34 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 2dfi h ALA 252 CO 0.11 0.49 0.11 -0.07 0.00 0.00 0.00 179.25 179.89 2dfi h LEU 253 N 0.70 0.68 -0.79 0.00 3.38 -1.32 -2.24 115.31 115.72 2dfi h LEU 253 Ca 0.12 -0.23 0.05 0.00 0.09 0.00 0.00 57.88 57.91 2dfi h LEU 253 Cb 0.61 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.12 2dfi h LEU 253 CO 0.04 0.74 0.49 0.50 0.09 0.00 0.00 178.44 180.29 2dfi h LYS 254 N 0.59 0.89 -0.32 1.13 1.63 -1.29 -0.35 116.57 118.85 2dfi h LYS 254 Ca 0.14 -0.05 -0.00 0.00 -0.85 0.00 0.00 60.65 59.88 2dfi h LYS 254 Cb 0.32 -0.20 -0.02 0.00 -0.60 0.00 0.00 32.23 31.74 2dfi h LYS 254 CO 0.00 0.59 0.19 1.15 -3.45 0.00 0.00 179.45 177.93 2dfi h THR 255 N 0.92 1.11 -0.16 1.00 2.02 -1.05 -0.93 112.91 115.83 2dfi h THR 255 Ca 0.34 -0.27 -0.04 0.00 0.77 0.00 0.00 66.41 67.21 2dfi h THR 255 Cb 0.11 0.72 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 2dfi h THR 255 CO -0.15 0.11 -0.08 -0.07 0.37 0.00 0.00 175.52 175.70 2dfi h LEU 256 N 0.41 0.23 0.05 2.58 3.38 -0.80 0.05 115.31 121.21 2dfi h LEU 256 Ca 0.11 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 2dfi h LEU 256 Cb 0.02 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2dfi h LEU 256 CO -0.02 0.35 -0.03 -0.33 0.09 0.00 0.00 178.44 178.50 2dfi h GLU 257 N 0.24 -0.07 0.00 1.13 5.08 -0.50 0.65 114.58 121.12 2dfi h GLU 257 Ca 0.05 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.36 2dfi h GLU 257 Cb 0.30 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 2dfi h GLU 257 CO 0.01 0.32 -0.25 0.87 -1.00 0.00 0.00 179.01 178.97 2dfi h LYS 258 N -0.48 0.00 0.00 2.33 1.57 -0.94 -0.85 116.57 118.21 2dfi h LYS 258 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2dfi h LYS 258 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.73 2dfi h LYS 258 CO 0.01 0.25 0.00 0.00 -0.57 0.00 0.00 179.45 179.15 2dfi n ALA 259 N -2.47 2.05 -1.01 3.86 0.00 -0.02 -4.89 120.51 118.04 2dfi n ALA 259 Ca -0.02 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.41 2dfi n ALA 259 Cb 0.31 -1.43 -0.00 0.00 0.00 0.00 0.00 19.45 18.33 2dfi n ALA 259 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dfi n GLY 260 N 0.82 0.46 0.16 0.00 0.00 -0.32 -4.92 105.19 101.39 2dfi n GLY 260 Ca 0.04 -0.51 -0.16 0.00 0.00 0.00 0.00 46.02 45.39 2dfi n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dfi h ALA 261 N 0.00 0.25 -2.25 4.61 0.00 -1.11 -3.38 119.26 117.38 2dfi h ALA 261 Ca -0.01 -0.73 -0.26 0.00 0.00 0.00 0.00 54.91 53.91 2dfi h ALA 261 Cb 0.04 0.01 -0.15 0.00 0.00 0.00 0.00 17.79 17.70 2dfi h ALA 261 CO 0.01 0.79 -0.69 0.96 0.00 0.00 0.00 179.25 180.33 2dfi s ILE 262 N -3.18 0.74 -0.10 0.00 -4.36 -1.04 -0.96 121.20 112.29 2dfi s ILE 262 Ca -0.07 -1.97 0.00 0.00 -0.26 0.00 0.00 60.65 58.36 2dfi s ILE 262 Cb 0.08 -1.85 -0.02 0.00 1.25 0.00 0.00 42.46 41.92 2dfi s ILE 262 CO 0.89 -0.73 -0.10 -0.31 0.24 0.00 0.00 174.94 174.93 2dfi s TYR 263 N -3.60 2.87 0.01 1.37 1.51 0.50 -4.23 117.35 115.78 2dfi s TYR 263 Ca 0.16 -0.29 -0.16 0.00 -1.01 0.00 0.00 57.07 55.77 2dfi s TYR 263 Cb 0.05 -1.79 -0.06 0.00 -0.11 0.00 0.00 41.96 40.05 2dfi s TYR 263 CO -0.01 0.05 0.45 0.20 -1.11 0.00 0.00 175.55 175.13 2dfi s GLY 264 N -0.17 2.52 -0.70 0.71 0.00 -1.26 -1.10 107.32 107.32 2dfi s GLY 264 Ca 0.01 -0.16 0.05 0.00 0.00 0.00 0.00 44.72 44.63 2dfi s GLY 264 CO 0.03 0.27 0.52 -1.72 0.00 0.00 0.00 173.10 172.20 2dfi n TYR 265 N 1.95 3.28 -0.72 1.90 4.01 0.76 -4.97 117.16 123.36 2dfi n TYR 265 Ca -0.13 -4.30 -0.29 0.00 -0.16 0.00 0.00 57.90 53.03 2dfi n TYR 265 Cb 0.52 -0.62 0.22 0.00 -0.31 0.00 0.00 39.34 39.15 2dfi n TYR 265 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 2dfi s PRO 266 N -1.57 -0.37 0.24 -0.72 0.04 -1.26 -3.94 135.00 127.43 2dfi s PRO 266 Ca 0.26 0.84 -0.31 0.00 0.04 0.00 0.00 61.00 61.83 2dfi s PRO 266 Cb -0.02 -1.62 -0.13 0.00 0.04 0.00 0.00 34.50 32.77 2dfi s PRO 266 CO -0.16 -3.36 1.54 0.28 0.04 0.00 0.00 177.00 175.35 2dfi n VAL 267 N -4.66 0.70 -3.66 -0.36 0.31 -0.99 -4.71 118.33 104.96 2dfi n VAL 267 Ca 0.04 -0.18 -0.38 0.00 -0.01 0.00 0.00 64.34 63.82 2dfi n VAL 267 Cb 0.55 -1.72 -0.12 0.00 -0.91 0.00 0.00 33.84 31.64 2dfi n VAL 267 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2dfi s LEU 268 N 0.17 4.05 0.12 7.52 1.43 -0.84 -0.56 118.68 130.57 2dfi s LEU 268 Ca 0.69 -0.45 0.10 0.00 -1.03 0.00 0.00 54.13 53.44 2dfi s LEU 268 Cb -0.58 -2.01 -0.04 0.00 0.03 0.00 0.00 46.19 43.59 2dfi s LEU 268 CO 0.45 -0.17 -0.25 -1.59 0.23 0.00 0.00 176.35 175.02 2dfi s LYS 269 N 1.63 1.31 0.34 1.70 -2.85 -0.61 0.01 119.74 121.27 2dfi s LYS 269 Ca 0.05 -1.28 -0.29 0.00 -1.00 0.00 0.00 55.97 53.45 2dfi s LYS 269 Cb -0.17 -1.73 -0.11 0.00 -2.06 0.00 0.00 37.83 33.76 2dfi s LYS 269 CO 0.06 0.41 1.50 -1.91 0.10 0.00 0.00 175.35 175.51 2dfi n GLU 270 N 0.98 2.60 0.23 1.78 0.00 -0.02 -1.10 120.64 125.11 2dfi n GLU 270 Ca -0.19 0.92 0.09 0.00 0.00 0.00 0.00 57.16 57.98 2dfi n GLU 270 Cb 0.53 -2.64 0.65 0.00 0.00 0.00 0.00 31.44 29.98 2dfi n GLU 270 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.13 177.95 2dfi h ILE 271 N 3.03 0.97 -0.28 6.31 2.04 -1.36 -1.87 117.51 126.34 2dfi h ILE 271 Ca -0.49 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.37 2dfi h ILE 271 Cb 1.24 0.97 0.00 0.00 -0.74 0.00 0.00 36.82 38.29 2dfi h ILE 271 CO 0.69 0.00 0.00 0.54 0.00 0.00 0.00 178.15 179.38 2dfi n ARG 272 N -4.51 3.02 -2.46 2.37 1.74 -1.26 -4.93 116.66 110.63 2dfi n ARG 272 Ca -0.02 -2.84 -0.19 0.00 -0.77 0.00 0.00 57.85 54.03 2dfi n ARG 272 Cb 0.14 -1.85 -0.00 0.00 -1.02 0.00 0.00 32.46 29.73 2dfi n ARG 272 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2dfi n ASN 273 N -0.43 -5.48 -4.76 0.55 3.02 -0.70 -4.93 115.26 102.53 2dfi n ASN 273 Ca 0.21 -0.06 -0.39 0.00 -0.03 0.00 0.00 54.58 54.31 2dfi n ASN 273 Cb 0.90 -4.50 -0.05 0.00 -0.61 0.00 0.00 39.78 35.51 2dfi n ASN 273 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2dfi s GLY 274 N -2.25 3.03 0.33 7.41 0.00 -1.26 -4.70 107.32 109.89 2dfi s GLY 274 Ca 0.05 0.70 -0.29 0.00 0.00 0.00 0.00 44.72 45.18 2dfi s GLY 274 CO 0.06 1.26 1.42 1.39 0.00 0.00 0.00 173.10 177.22 2dfi n ILE 275 N 1.16 1.72 -5.13 0.90 2.08 -1.26 -4.27 119.36 114.55 2dfi n ILE 275 Ca -0.01 -0.43 -0.32 0.00 0.56 0.00 0.00 62.75 62.56 2dfi n ILE 275 Cb 0.47 -1.76 -0.15 0.00 -0.75 0.00 0.00 39.64 37.45 2dfi n ILE 275 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 2dfi s VAL 276 N -0.80 2.48 0.09 1.39 1.01 -0.66 -2.70 120.40 121.20 2dfi s VAL 276 Ca 0.58 -0.95 0.09 0.00 0.00 0.00 0.00 61.98 61.70 2dfi s VAL 276 Cb -0.54 -1.91 -0.03 0.00 0.00 0.00 0.00 36.38 33.90 2dfi s VAL 276 CO 0.59 0.58 -0.23 0.00 0.00 0.00 0.00 175.10 176.05 2dfi s ALA 277 N -0.65 1.95 -0.06 5.51 0.00 0.23 -4.76 121.76 123.97 2dfi s ALA 277 Ca 0.10 -1.25 -0.13 0.00 0.00 0.00 0.00 51.96 50.68 2dfi s ALA 277 Cb -0.10 -0.31 0.03 0.00 0.00 0.00 0.00 23.12 22.73 2dfi s ALA 277 CO -0.00 0.42 0.32 -1.14 0.00 0.00 0.00 175.76 175.35 2dfi s GLN 278 N -1.73 0.54 -0.02 0.00 0.74 -1.26 -1.69 119.66 116.24 2dfi s GLN 278 Ca 0.09 0.09 -0.06 0.00 0.05 0.00 0.00 55.36 55.53 2dfi s GLN 278 Cb -0.10 0.25 0.01 0.00 1.10 0.00 0.00 33.01 34.27 2dfi s GLN 278 CO 0.04 -0.12 0.14 -0.06 -0.55 0.00 0.00 175.29 174.73 2dfi s PHE 279 N -0.67 -0.04 -0.14 1.67 0.08 -1.19 -2.36 117.98 115.34 2dfi s PHE 279 Ca -0.08 0.07 -0.22 0.00 0.12 0.00 0.00 56.93 56.83 2dfi s PHE 279 Cb -0.04 -0.01 0.05 0.00 -0.57 0.00 0.00 43.02 42.45 2dfi s PHE 279 CO 0.03 -0.20 0.56 -2.00 -0.10 0.00 0.00 175.22 173.51 2dfi s GLU 280 N -0.77 0.77 0.03 0.44 2.12 -0.35 -2.92 118.70 118.03 2dfi s GLU 280 Ca -0.09 0.49 -0.01 0.00 0.36 0.00 0.00 54.97 55.72 2dfi s GLU 280 Cb -0.05 0.37 -0.02 0.00 0.26 0.00 0.00 34.13 34.68 2dfi s GLU 280 CO 0.01 -0.16 -0.01 -1.01 -0.54 0.00 0.00 175.26 173.54 2dfi s HIS 281 N -0.37 0.33 -0.14 5.30 3.76 -1.09 -1.85 115.29 121.23 2dfi s HIS 281 Ca -0.05 -0.68 -0.04 0.00 -0.15 0.00 0.00 55.06 54.13 2dfi s HIS 281 Cb -0.03 -0.24 -0.03 0.00 1.11 0.00 0.00 32.58 33.38 2dfi s HIS 281 CO 0.04 -0.27 0.00 0.99 -0.85 0.00 0.00 174.74 174.65 2dfi s THR 282 N -2.33 4.26 0.09 1.30 2.01 -1.18 -1.51 115.64 118.28 2dfi s THR 282 Ca -0.08 -0.24 0.04 0.00 0.31 0.00 0.00 61.69 61.72 2dfi s THR 282 Cb -0.04 -2.86 -0.03 0.00 0.01 0.00 0.00 72.50 69.58 2dfi s THR 282 CO -0.04 0.52 -0.11 0.27 -0.69 0.00 0.00 174.62 174.57 2dfi s ILE 283 N -0.04 0.94 -0.28 1.82 -4.36 0.11 -1.86 121.20 117.53 2dfi s ILE 283 Ca 0.03 -1.52 -0.08 0.00 -0.26 0.00 0.00 60.65 58.82 2dfi s ILE 283 Cb -0.13 -1.23 -0.02 0.00 1.25 0.00 0.00 42.46 42.34 2dfi s ILE 283 CO 0.02 -0.47 0.10 -0.63 0.24 0.00 0.00 174.94 174.19 2dfi s ILE 284 N -2.10 4.34 0.16 8.37 1.01 0.05 -1.62 121.20 131.40 2dfi s ILE 284 Ca 0.02 -0.33 -0.31 0.00 0.00 0.00 0.00 60.65 60.03 2dfi s ILE 284 Cb -0.05 -3.12 -0.10 0.00 0.01 0.00 0.00 42.46 39.20 2dfi s ILE 284 CO 0.01 0.21 1.51 -0.69 0.00 0.00 0.00 174.94 175.98 2dfi s VAL 285 N 1.60 2.79 0.01 2.92 1.01 0.99 -2.03 120.40 127.70 2dfi s VAL 285 Ca 0.05 0.58 -0.07 0.00 0.00 0.00 0.00 61.98 62.54 2dfi s VAL 285 Cb -0.16 -3.37 -0.00 0.00 0.00 0.00 0.00 36.38 32.85 2dfi s VAL 285 CO 0.04 0.05 0.13 -1.61 0.00 0.00 0.00 175.10 173.71 2dfi s GLU 286 N 0.97 0.52 -0.90 2.72 0.41 -1.26 -0.02 118.70 121.13 2dfi s GLU 286 Ca 0.67 -0.49 -0.16 0.00 -0.41 0.00 0.00 54.97 54.58 2dfi s GLU 286 Cb -0.42 0.21 -0.25 0.00 -1.78 0.00 0.00 34.13 31.89 2dfi s GLU 286 CO 0.32 -0.13 2.23 0.36 -0.49 0.00 0.00 175.26 177.56 2dfi n LYS 287 N 1.26 0.22 -1.14 1.61 2.85 -1.26 -3.08 118.16 118.63 2dfi n LYS 287 Ca -0.22 -0.36 0.00 0.00 -1.05 0.00 0.00 58.31 56.68 2dfi n LYS 287 Cb 0.56 -2.11 0.00 0.00 -0.65 0.00 0.00 35.03 32.83 2dfi n LYS 287 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2dfi n ASP 288 N 10.96 -6.15 -3.31 -5.58 8.00 -1.26 -4.91 116.55 114.31 2dfi n ASP 288 Ca 0.58 1.31 -0.09 0.00 0.71 0.00 0.00 54.79 57.30 2dfi n ASP 288 Cb 0.27 -3.37 0.00 0.00 -0.02 0.00 0.00 41.12 38.00 2dfi n ASP 288 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2dfi n SER 289 N -2.17 -6.80 -4.74 -2.24 2.88 -1.26 -4.94 113.62 94.35 2dfi n SER 289 Ca 0.00 -0.40 -0.34 0.00 -1.33 0.00 0.00 58.87 56.80 2dfi n SER 289 Cb 0.32 -4.17 0.07 0.00 -0.75 0.00 0.00 64.21 59.68 2dfi n SER 289 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2dfi s VAL 290 N -3.03 2.56 -0.08 2.46 1.01 -1.26 -4.75 120.40 117.31 2dfi s VAL 290 Ca 0.04 0.28 -0.19 0.00 0.00 0.00 0.00 61.98 62.12 2dfi s VAL 290 Cb -0.01 -2.87 -0.05 0.00 0.00 0.00 0.00 36.38 33.45 2dfi s VAL 290 CO 0.80 -0.14 0.51 -0.63 0.00 0.00 0.00 175.10 175.63 2dfi s ILE 291 N -2.00 5.11 -0.67 2.22 1.09 -0.86 -4.92 121.20 121.16 2dfi s ILE 291 Ca 0.73 1.03 -0.15 0.00 -1.10 0.00 0.00 60.65 61.16 2dfi s ILE 291 Cb -0.27 -3.84 0.17 0.00 -1.06 0.00 0.00 42.46 37.45 2dfi s ILE 291 CO 0.43 0.36 0.62 -0.69 -0.10 0.00 0.00 174.94 175.56 2dfi s VAL 292 N 0.30 5.38 0.52 2.92 1.01 -1.26 -0.77 120.40 128.51 2dfi s VAL 292 Ca 0.27 -1.92 0.29 0.00 0.00 0.00 0.00 61.98 60.63 2dfi s VAL 292 Cb -0.16 -4.40 0.46 0.00 0.00 0.00 0.00 36.38 32.28 2dfi s VAL 292 CO 0.12 -0.95 1.90 0.00 0.00 0.00 0.00 175.10 176.18 2dfi h THR 293 N 5.40 0.59 -0.80 3.92 1.03 -1.74 -1.69 112.91 119.63 2dfi h THR 293 Ca -0.12 -0.01 -0.54 0.00 -0.01 0.00 0.00 66.41 65.73 2dfi h THR 293 Cb 1.07 0.55 -0.31 0.00 -1.07 0.00 0.00 68.15 68.39 2dfi h THR 293 CO 0.91 0.01 0.10 0.00 -0.01 0.00 0.00 175.52 176.53 2dfi n GLN 294 N -4.31 2.84 0.00 0.00 6.02 -1.25 -4.20 117.38 116.48 2dfi n GLN 294 Ca 0.17 -3.57 0.00 0.00 -0.01 0.00 0.00 57.00 53.60 2dfi n GLN 294 Cb 0.89 -2.20 0.00 0.00 1.02 0.00 0.00 30.24 29.95 2dfi n GLN 294 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2dfi n ASP 295 N -0.90 0.00 -0.25 1.08 2.03 -0.63 -4.90 116.55 112.98 2dfi n ASP 295 Ca 0.51 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.82 2dfi n ASP 295 Cb 0.90 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.30 2dfi n ASP 295 CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 2dfi n MET 296 N -1.16 0.00 -2.08 -0.67 2.81 -1.26 -5.07 117.12 109.69 2dfi n MET 296 Ca 0.00 -0.71 -0.01 0.00 -1.81 0.00 0.00 57.70 55.18 2dfi n MET 296 Cb 0.00 -0.47 -0.00 0.00 -0.71 0.00 0.00 33.22 32.03 2dfi n MET 296 CO 0.00 0.00 0.00 -0.89 1.51 0.00 0.00 175.97 176.59 2dfi n ILE 297 N 0.00-10.89 -2.96 2.02 5.41 -1.26 -5.04 119.36 106.64 2dfi n ILE 297 Ca 0.00 2.44 -0.15 0.00 1.00 0.00 0.00 62.75 66.04 2dfi n ILE 297 Cb 0.59 -5.47 0.00 0.00 -0.71 0.00 0.00 39.64 34.06 2dfi n ILE 297 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 2dfi n ASN 298 N 1.41 -1.26 0.00 4.38 3.02 -1.26 -5.00 115.26 116.55 2dfi n ASN 298 Ca -0.04 -3.12 0.00 0.00 -0.03 0.00 0.00 54.58 51.39 2dfi n ASN 298 Cb 0.06 0.67 0.00 0.00 -0.61 0.00 0.00 39.78 39.90 2dfi n ASN 298 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2dfi n LYS 299 N 1.18 0.00 -3.03 3.52 4.76 -1.26 -4.86 118.16 118.47 2dfi n LYS 299 Ca 0.15 0.00 0.02 0.00 -2.87 0.00 0.00 58.31 55.61 2dfi n LYS 299 Cb 0.61 0.00 -0.00 0.00 -1.84 0.00 0.00 35.03 33.80 2dfi n LYS 299 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2dfi s SER 300 N 1.33 -0.96 0.00 4.39 1.04 -1.26 -5.07 113.70 113.17 2dfi s SER 300 Ca 0.00 -0.35 0.00 0.00 0.48 0.00 0.00 55.95 56.08 2dfi s SER 300 Cb 0.00 1.31 0.00 0.00 0.10 0.00 0.00 66.02 67.43 2dfi s SER 300 CO 0.00 -0.12 0.36 0.41 0.98 0.00 0.00 173.24 174.87