#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dxc s VAL 24 N 0.00 2.94 0.57 6.31 1.01 -1.26 -5.02 120.40 124.95 2dxc s VAL 24 Ca 0.00 0.73 -0.02 0.00 0.00 0.00 0.00 61.98 62.69 2dxc s VAL 24 Cb 0.00 -3.47 0.02 0.00 0.00 0.00 0.00 36.38 32.94 2dxc s VAL 24 CO 0.00 0.09 0.83 -0.94 0.00 0.00 0.00 175.10 175.08 2dxc s SER 25 N 0.69 5.38 0.48 3.32 1.04 -1.26 -4.96 113.70 118.39 2dxc s SER 25 Ca 0.62 0.32 0.16 0.00 0.48 0.00 0.00 55.95 57.53 2dxc s SER 25 Cb -0.40 -1.26 1.14 0.00 0.10 0.00 0.00 66.02 65.60 2dxc s SER 25 CO 0.36 -1.12 2.06 0.44 0.98 0.00 0.00 173.24 175.97 2dxc h ASP 26 N -0.05 0.00 -0.34 7.02 3.32 -1.99 -2.12 116.42 122.25 2dxc h ASP 26 Ca -0.44 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.46 2dxc h ASP 26 Cb 1.28 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.83 2dxc h ASP 26 CO 0.57 0.11 -0.35 -0.26 -1.72 0.00 0.00 179.24 177.59 2dxc h PHE 27 N 0.00 1.01 -0.39 4.55 0.04 -1.99 -1.49 116.94 118.68 2dxc h PHE 27 Ca -0.00 -0.30 -0.11 0.00 2.80 0.00 0.00 57.97 60.36 2dxc h PHE 27 Cb 0.20 -0.21 -0.02 0.00 2.20 0.00 0.00 35.95 38.12 2dxc h PHE 27 CO 0.00 1.10 -0.19 0.93 -0.60 0.00 0.00 178.31 179.54 2dxc h GLU 28 N 0.62 0.74 -0.27 1.51 5.08 -1.82 0.15 114.58 120.59 2dxc h GLU 28 Ca 0.05 -0.28 -0.04 0.00 -1.00 0.00 0.00 59.36 58.10 2dxc h GLU 28 Cb 0.93 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.13 2dxc h GLU 28 CO 0.09 0.88 0.03 0.82 -1.00 0.00 0.00 179.01 179.83 2dxc h ILE 29 N 0.65 1.24 -0.48 3.13 2.04 -1.34 -2.36 117.51 120.40 2dxc h ILE 29 Ca 0.10 -0.82 -0.11 0.00 1.00 0.00 0.00 64.86 65.03 2dxc h ILE 29 Cb 0.69 1.25 -0.02 0.00 -0.74 0.00 0.00 36.82 38.00 2dxc h ILE 29 CO 0.05 0.26 -0.13 0.25 0.00 0.00 0.00 178.15 178.58 2dxc h LEU 30 N 0.27 0.89 -0.11 1.44 5.85 -1.06 -1.52 115.31 121.07 2dxc h LEU 30 Ca 0.08 -0.29 0.01 0.00 0.84 0.00 0.00 57.88 58.52 2dxc h LEU 30 Cb 0.36 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 2dxc h LEU 30 CO 0.01 1.03 0.05 -0.08 -0.34 0.00 0.00 178.44 179.11 2dxc h GLU 31 N 0.80 0.11 -0.60 1.25 4.22 -0.62 0.42 114.58 120.15 2dxc h GLU 31 Ca 0.13 -0.01 0.01 0.00 0.08 0.00 0.00 59.36 59.57 2dxc h GLU 31 Cb 0.66 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.85 2dxc h GLU 31 CO 0.05 0.07 0.39 1.98 -2.18 0.00 0.00 179.01 179.32 2dxc h MET 32 N 0.11 0.77 -0.04 1.92 4.05 -1.31 -1.04 114.93 119.39 2dxc h MET 32 Ca 0.04 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2dxc h MET 32 Cb 0.01 -0.17 -0.00 0.00 -0.80 0.00 0.00 31.60 30.63 2dxc h MET 32 CO -0.03 0.51 0.01 0.00 0.23 0.00 0.00 176.91 177.63 2dxc h ALA 33 N 1.23 0.04 -0.22 0.39 0.00 -0.83 -0.68 119.26 119.20 2dxc h ALA 33 Ca 0.23 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 2dxc h ALA 33 Cb -0.07 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2dxc h ALA 33 CO -0.06 -0.47 0.10 0.28 0.00 0.00 0.00 179.25 179.10 2dxc h VAL 34 N 0.04 1.14 -0.57 0.00 2.07 -0.71 -1.65 116.25 116.57 2dxc h VAL 34 Ca 0.02 -0.42 -0.04 0.00 0.82 0.00 0.00 66.70 67.08 2dxc h VAL 34 Cb 0.01 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 2dxc h VAL 34 CO -0.02 0.14 0.21 -0.09 0.02 0.00 0.00 177.57 177.84 2dxc h ARG 35 N 0.22 0.86 -0.58 1.57 2.43 -1.10 -0.63 114.38 117.15 2dxc h ARG 35 Ca 0.07 -0.17 -0.07 0.00 -0.81 0.00 0.00 59.98 59.01 2dxc h ARG 35 Cb 0.13 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 2dxc h ARG 35 CO -0.01 0.76 0.09 0.93 -1.51 0.00 0.00 179.97 180.23 2dxc h GLU 36 N 0.79 0.95 -0.49 0.20 5.08 -1.06 -2.09 114.58 117.96 2dxc h GLU 36 Ca 0.19 -0.26 -0.05 0.00 -1.00 0.00 0.00 59.36 58.24 2dxc h GLU 36 Cb 0.23 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 2dxc h GLU 36 CO -0.01 0.91 0.10 -0.07 -1.00 0.00 0.00 179.01 178.94 2dxc h LEU 37 N 0.85 0.76 -0.93 1.33 3.38 -1.09 0.47 115.31 120.07 2dxc h LEU 37 Ca 0.17 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2dxc h LEU 37 Cb 0.42 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 2dxc h LEU 37 CO 0.01 0.81 0.55 0.00 0.09 0.00 0.00 178.44 179.90 2dxc h ALA 38 N 0.98 1.19 -0.15 1.53 0.00 -0.99 -0.32 119.26 121.50 2dxc h ALA 38 Ca 0.15 -0.11 -0.20 0.00 0.00 0.00 0.00 54.91 54.75 2dxc h ALA 38 Cb 0.36 -0.38 0.01 0.00 0.00 0.00 0.00 17.79 17.78 2dxc h ALA 38 CO 0.01 0.67 -0.69 0.82 0.00 0.00 0.00 179.25 180.05 2dxc h ILE 39 N 1.30 1.30 -0.57 0.00 2.04 -1.20 0.80 117.51 121.18 2dxc h ILE 39 Ca 0.33 -1.91 -0.02 0.00 1.00 0.00 0.00 64.86 64.26 2dxc h ILE 39 Cb -0.03 2.00 -0.03 0.00 -0.74 0.00 0.00 36.82 38.03 2dxc h ILE 39 CO -0.06 0.60 0.27 -0.33 0.00 0.00 0.00 178.15 178.63 2dxc h GLU 40 N 0.44 0.80 -0.01 2.37 5.08 -0.60 -1.53 114.58 121.14 2dxc h GLU 40 Ca -0.04 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 2dxc h GLU 40 Cb 1.32 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.41 2dxc h GLU 40 CO 0.14 0.62 -0.02 1.63 -1.00 0.00 0.00 179.01 180.38 2dxc n LYS 41 N -4.36 1.26 -2.14 2.33 4.76 -0.16 -4.93 118.16 114.91 2dxc n LYS 41 Ca 0.05 -0.49 -0.13 0.00 -2.87 0.00 0.00 58.31 54.87 2dxc n LYS 41 Cb 0.13 -1.49 -0.01 0.00 -1.84 0.00 0.00 35.03 31.82 2dxc n LYS 41 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dxc n GLY 42 N 1.13 0.02 0.21 0.72 0.00 -0.58 -4.92 105.19 101.78 2dxc n GLY 42 Ca 0.20 -0.35 -0.17 0.00 0.00 0.00 0.00 46.02 45.70 2dxc n GLY 42 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2dxc h LEU 43 N 0.00 0.88 -7.60 0.99 3.38 -1.10 -3.46 115.31 108.39 2dxc h LEU 43 Ca -0.30 -0.62 -0.09 0.00 0.09 0.00 0.00 57.88 56.96 2dxc h LEU 43 Cb 1.18 -0.26 -0.16 0.00 0.09 0.00 0.00 40.66 41.52 2dxc h LEU 43 CO 0.36 1.35 -0.26 0.72 0.09 0.00 0.00 178.44 180.70 2dxc s PHE 44 N -3.78 -0.05 0.47 1.13 -0.12 -1.24 -5.07 117.98 109.33 2dxc s PHE 44 Ca -0.11 -0.18 0.02 0.00 -0.05 0.00 0.00 56.93 56.61 2dxc s PHE 44 Cb 0.08 0.07 0.01 0.00 -0.63 0.00 0.00 43.02 42.55 2dxc s PHE 44 CO 0.89 -0.53 0.69 -1.54 -0.05 0.00 0.00 175.22 174.67 2dxc s SER 45 N -2.33 5.64 0.33 1.98 1.04 -1.26 -4.09 113.70 115.02 2dxc s SER 45 Ca -0.02 0.11 0.04 0.00 0.48 0.00 0.00 55.95 56.56 2dxc s SER 45 Cb 0.01 -1.23 0.59 0.00 0.10 0.00 0.00 66.02 65.49 2dxc s SER 45 CO -0.06 -0.84 1.89 0.00 0.98 0.00 0.00 173.24 175.21 2dxc h ALA 46 N 0.33 1.38 -0.39 5.32 0.00 -1.98 -2.02 119.26 121.90 2dxc h ALA 46 Ca -0.44 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.24 2dxc h ALA 46 Cb 1.27 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 2dxc h ALA 46 CO 0.55 0.44 0.07 1.49 0.00 0.00 0.00 179.25 181.79 2dxc h GLU 47 N 0.57 0.64 -0.37 0.00 4.57 -1.99 -1.86 114.58 116.14 2dxc h GLU 47 Ca 0.13 -0.17 0.07 0.00 -1.18 0.00 0.00 59.36 58.21 2dxc h GLU 47 Cb 0.27 -0.08 -0.06 0.00 -0.16 0.00 0.00 28.75 28.72 2dxc h GLU 47 CO 0.00 0.69 -0.00 -0.44 -1.18 0.00 0.00 179.01 178.08 2dxc h ASP 48 N 0.49 -0.15 -0.45 1.04 3.32 -1.77 0.22 116.42 119.12 2dxc h ASP 48 Ca 0.12 0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.25 2dxc h ASP 48 Cb 0.35 0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.03 2dxc h ASP 48 CO 0.01 -0.04 0.25 -0.74 -1.72 0.00 0.00 179.24 177.00 2dxc h HIS 49 N 0.10 0.61 -0.54 4.55 2.76 -1.25 -0.04 115.15 121.34 2dxc h HIS 49 Ca 0.18 -0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.31 2dxc h HIS 49 Cb 0.25 -0.20 -0.02 0.00 1.55 0.00 0.00 27.41 28.99 2dxc h HIS 49 CO -0.26 0.45 0.23 0.00 -1.30 0.00 0.00 177.93 177.05 2dxc h ARG 50 N 0.59 0.80 -0.82 5.26 3.08 -0.87 -1.50 114.38 120.91 2dxc h ARG 50 Ca 0.16 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 60.07 2dxc h ARG 50 Cb 0.04 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 29.92 2dxc h ARG 50 CO -0.03 0.69 0.52 0.28 -1.07 0.00 0.00 179.97 180.36 2dxc h VAL 51 N 0.73 1.22 -0.31 2.04 2.07 -0.13 0.28 116.25 122.16 2dxc h VAL 51 Ca 0.18 -0.46 -0.10 0.00 0.82 0.00 0.00 66.70 67.15 2dxc h VAL 51 Cb 0.18 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 29.99 2dxc h VAL 51 CO -0.02 0.23 -0.19 -0.25 0.02 0.00 0.00 177.57 177.36 2dxc h TRP 52 N 1.12 0.78 -0.51 1.57 2.91 -0.78 -0.68 115.95 120.36 2dxc h TRP 52 Ca 0.30 -0.20 0.02 0.00 1.13 0.00 0.00 58.89 60.13 2dxc h TRP 52 Cb -0.08 -0.17 -0.03 0.00 -0.51 0.00 0.00 29.16 28.36 2dxc h TRP 52 CO -0.01 0.91 0.32 0.87 -1.03 0.00 0.00 178.44 179.50 2dxc h LYS 53 N 0.42 0.61 -0.28 2.65 1.57 -0.97 0.18 116.57 120.75 2dxc h LYS 53 Ca 0.06 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.72 2dxc h LYS 53 Cb 0.73 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.88 2dxc h LYS 53 CO 0.05 0.41 -0.18 -0.44 -0.57 0.00 0.00 179.45 178.72 2dxc h ASP 54 N 0.63 0.49 -0.16 0.86 3.32 -0.83 -1.62 116.42 119.11 2dxc h ASP 54 Ca 0.20 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 2dxc h ASP 54 Cb -0.01 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 2dxc h ASP 54 CO -0.08 0.69 0.04 0.22 -1.72 0.00 0.00 179.24 178.39 2dxc h TYR 55 N 0.45 0.25 -0.88 4.55 3.20 -0.38 -2.85 116.97 121.32 2dxc h TYR 55 Ca 0.08 -0.03 0.04 0.00 3.14 0.00 0.00 58.73 61.96 2dxc h TYR 55 Cb 0.57 -0.07 -0.05 0.00 1.54 0.00 0.00 36.73 38.72 2dxc h TYR 55 CO 0.02 0.37 0.58 0.28 -1.64 0.00 0.00 178.16 177.77 2dxc h VAL 56 N 0.07 1.14 0.00 1.81 2.07 -0.75 -1.45 116.25 119.14 2dxc h VAL 56 Ca 0.05 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.19 2dxc h VAL 56 Cb 0.24 -0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 29.96 2dxc h VAL 56 CO -0.00 0.20 -0.03 0.45 0.02 0.00 0.00 177.57 178.21 2dxc h HIS 57 N 1.09 0.00 0.00 1.57 3.86 -1.07 -1.58 115.15 119.02 2dxc h HIS 57 Ca 0.35 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.56 2dxc h HIS 57 Cb 0.03 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.50 2dxc h HIS 57 CO -0.00 0.03 -0.38 0.25 0.86 0.00 0.00 177.93 178.69 2dxc n THR 58 N -3.24 0.13 -2.65 2.45 -2.24 -0.55 -4.90 114.28 103.28 2dxc n THR 58 Ca -0.02 -0.09 -0.33 0.00 -2.27 0.00 0.00 64.05 61.35 2dxc n THR 58 Cb 0.18 -0.08 -0.05 0.00 -2.10 0.00 0.00 70.33 68.28 2dxc n THR 58 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2dxc s LEU 59 N -3.40 3.85 0.00 3.22 1.43 -0.60 -5.04 118.68 118.14 2dxc s LEU 59 Ca 0.11 1.75 -0.27 0.00 -1.03 0.00 0.00 54.13 54.68 2dxc s LEU 59 Cb 0.16 -4.54 0.09 0.00 0.03 0.00 0.00 46.19 41.93 2dxc s LEU 59 CO 0.66 -0.55 1.23 0.61 0.23 0.00 0.00 176.35 178.52 2dxc n GLY 60 N -0.68 0.16 0.05 -3.19 0.00 -1.26 -4.76 105.19 95.52 2dxc n GLY 60 Ca 0.08 -1.01 0.14 0.00 0.00 0.00 0.00 46.02 45.22 2dxc n GLY 60 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dxc n PRO 61 N -0.89 0.34 -0.18 1.61 -0.04 -0.97 -3.18 135.00 131.69 2dxc n PRO 61 Ca 0.05 -0.11 -0.02 0.00 -0.04 0.00 0.00 63.50 63.38 2dxc n PRO 61 Cb 0.53 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.57 2dxc n PRO 61 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2dxc h LEU 62 N 0.26 0.25 -0.63 1.53 -0.00 -1.88 -0.76 115.31 114.08 2dxc h LEU 62 Ca 0.00 0.06 -0.00 0.00 -0.00 0.00 0.00 57.88 57.93 2dxc h LEU 62 Cb 0.43 0.02 -0.03 0.00 -0.00 0.00 0.00 40.66 41.08 2dxc h LEU 62 CO 0.00 0.17 0.37 -0.65 -0.00 0.00 0.00 178.44 178.33 2dxc h PRO 63 N 0.42 0.86 -0.66 1.13 0.11 -1.76 -0.26 132.00 131.82 2dxc h PRO 63 Ca 0.26 -0.08 -0.06 0.00 0.11 0.00 0.00 66.00 66.23 2dxc h PRO 63 Cb 0.26 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 31.16 2dxc h PRO 63 CO -0.24 0.62 0.19 0.00 -0.21 0.00 0.00 178.00 178.35 2dxc h ALA 64 N 1.19 0.87 -0.84 -0.75 0.00 -1.25 -0.59 119.26 117.88 2dxc h ALA 64 Ca 0.22 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2dxc h ALA 64 Cb -0.02 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.48 2dxc h ALA 64 CO -0.04 0.57 0.42 0.00 0.00 0.00 0.00 179.25 180.19 2dxc h ALA 65 N 1.08 1.14 -0.39 0.00 0.00 -0.77 -2.13 119.26 118.19 2dxc h ALA 65 Ca 0.21 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 2dxc h ALA 65 Cb 0.33 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2dxc h ALA 65 CO -0.00 0.66 -0.22 0.00 0.00 0.00 0.00 179.25 179.69 2dxc h ARG 66 N 1.20 0.78 -0.84 0.00 3.08 -0.57 -1.69 114.38 116.33 2dxc h ARG 66 Ca 0.29 -0.31 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 2dxc h ARG 66 Cb 0.10 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.07 2dxc h ARG 66 CO -0.04 0.93 0.45 1.25 -1.07 0.00 0.00 179.97 181.48 2dxc h LEU 67 N 0.68 1.06 -0.33 3.04 6.46 -0.66 0.53 115.31 126.09 2dxc h LEU 67 Ca 0.10 -0.11 -0.06 0.00 -0.12 0.00 0.00 57.88 57.69 2dxc h LEU 67 Cb 0.73 -0.27 -0.01 0.00 -0.73 0.00 0.00 40.66 40.37 2dxc h LEU 67 CO 0.06 0.87 -0.02 0.58 -0.62 0.00 0.00 178.44 179.30 2dxc h VAL 68 N 1.18 1.27 -0.51 1.05 2.07 -1.15 -1.04 116.25 119.11 2dxc h VAL 68 Ca 0.29 -1.02 -0.01 0.00 0.82 0.00 0.00 66.70 66.79 2dxc h VAL 68 Cb 0.05 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.07 2dxc h VAL 68 CO -0.04 0.33 0.29 0.00 0.02 0.00 0.00 177.57 178.17 2dxc h ALA 69 N 0.84 0.65 -0.81 1.67 0.00 -0.97 -1.05 119.26 119.60 2dxc h ALA 69 Ca 0.09 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2dxc h ALA 69 Cb 0.49 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 2dxc h ALA 69 CO 0.02 0.16 0.33 0.87 0.00 0.00 0.00 179.25 180.64 2dxc h LYS 70 N 0.68 1.20 -0.68 0.00 1.57 -0.80 -1.55 116.57 117.00 2dxc h LYS 70 Ca 0.18 -0.21 -0.05 0.00 -1.87 0.00 0.00 60.65 58.70 2dxc h LYS 70 Cb 0.03 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.11 2dxc h LYS 70 CO -0.03 0.96 0.24 0.00 -0.57 0.00 0.00 179.45 180.05 2dxc h ALA 71 N 1.18 0.88 -0.37 3.86 0.00 -0.82 -0.99 119.26 123.01 2dxc h ALA 71 Ca 0.27 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 2dxc h ALA 71 Cb 0.20 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2dxc h ALA 71 CO -0.02 0.53 0.03 -1.49 0.00 0.00 0.00 179.25 178.30 2dxc h TRP 72 N 0.98 0.59 -0.15 0.00 6.55 -0.78 -2.74 115.95 120.40 2dxc h TRP 72 Ca 0.22 -0.06 0.00 0.00 0.95 0.00 0.00 58.89 60.01 2dxc h TRP 72 Cb 0.25 -0.17 0.00 0.00 -0.86 0.00 0.00 29.16 28.38 2dxc h TRP 72 CO 0.02 0.56 0.00 1.28 -1.05 0.00 0.00 178.44 179.25 2dxc n LEU 73 N -4.29 1.90 -3.24 -4.49 4.77 -0.62 -4.70 117.00 106.33 2dxc n LEU 73 Ca 0.02 -0.75 -0.04 0.00 -0.03 0.00 0.00 56.01 55.21 2dxc n LEU 73 Cb 0.24 -0.09 -0.03 0.00 -2.33 0.00 0.00 43.42 41.21 2dxc n LEU 73 CO 0.39 0.38 0.01 -0.62 -1.33 0.00 0.00 177.39 176.22 2dxc s ASP 74 N -1.69 -0.65 0.50 -1.43 -1.08 -0.42 -5.02 116.67 106.87 2dxc s ASP 74 Ca 0.34 -0.56 0.28 0.00 -0.52 0.00 0.00 52.55 52.09 2dxc s ASP 74 Cb 0.19 1.54 1.38 0.00 -1.46 0.00 0.00 42.92 44.57 2dxc s ASP 74 CO 0.29 -0.26 1.86 -0.65 0.52 0.00 0.00 175.17 176.92 2dxc h PRO 75 N 7.55 0.11 -0.37 4.34 0.11 -1.84 0.37 132.00 142.28 2dxc h PRO 75 Ca 0.00 -0.01 -0.16 0.00 0.11 0.00 0.00 66.00 65.95 2dxc h PRO 75 Cb 1.15 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 2dxc h PRO 75 CO 0.17 0.08 -0.38 1.49 -0.21 0.00 0.00 178.00 179.15 2dxc h GLU 76 N 0.12 0.89 -0.29 1.05 4.81 -1.95 -2.03 114.58 117.18 2dxc h GLU 76 Ca 0.47 -0.46 -0.16 0.00 -0.13 0.00 0.00 59.36 59.08 2dxc h GLU 76 Cb 1.66 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 31.04 2dxc h GLU 76 CO -0.07 1.11 -0.45 -0.92 -0.73 0.00 0.00 179.01 177.95 2dxc h TYR 77 N 0.73 0.90 -0.80 0.92 3.20 -1.31 -2.79 116.97 117.82 2dxc h TYR 77 Ca 0.06 -0.29 0.03 0.00 3.14 0.00 0.00 58.73 61.68 2dxc h TYR 77 Cb 0.96 -0.18 -0.05 0.00 1.54 0.00 0.00 36.73 39.00 2dxc h TYR 77 CO 0.06 1.06 0.51 -0.22 -1.64 0.00 0.00 178.16 177.93 2dxc h LYS 78 N 0.60 0.97 -0.65 1.82 3.64 -1.03 0.26 116.57 122.17 2dxc h LYS 78 Ca 0.04 -0.06 0.02 0.00 -1.27 0.00 0.00 60.65 59.38 2dxc h LYS 78 Cb 1.01 -0.22 -0.04 0.00 -0.41 0.00 0.00 32.23 32.58 2dxc h LYS 78 CO 0.10 0.64 0.41 0.87 -2.27 0.00 0.00 179.45 179.20 2dxc h LYS 79 N 1.00 0.79 -0.59 1.90 1.57 -1.20 -1.73 116.57 118.31 2dxc h LYS 79 Ca 0.32 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 59.04 2dxc h LYS 79 Cb 0.01 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.12 2dxc h LYS 79 CO -0.11 0.52 0.32 1.25 -0.57 0.00 0.00 179.45 180.86 2dxc h LEU 80 N 0.82 0.74 -0.55 2.94 5.85 -1.01 -2.30 115.31 121.79 2dxc h LEU 80 Ca 0.25 -0.10 0.05 0.00 0.84 0.00 0.00 57.88 58.92 2dxc h LEU 80 Cb -0.02 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 40.77 2dxc h LEU 80 CO -0.09 0.63 0.27 0.00 -0.34 0.00 0.00 178.44 178.91 2dxc h ILE 82 N 0.52 1.28 0.08 0.00 2.04 -1.12 -3.15 117.51 117.16 2dxc h ILE 82 Ca 0.24 -1.35 -0.34 0.00 1.00 0.00 0.00 64.86 64.42 2dxc h ILE 82 Cb 0.17 1.41 -0.03 0.00 -0.74 0.00 0.00 36.82 37.62 2dxc h ILE 82 CO -0.18 0.42 -1.94 1.21 0.00 0.00 0.00 178.15 177.67 2dxc n GLU 83 N -4.10 0.71 -3.41 2.37 4.07 -0.89 -4.70 120.64 114.70 2dxc n GLU 83 Ca -0.01 0.26 -0.27 0.00 -0.06 0.00 0.00 57.16 57.08 2dxc n GLU 83 Cb 0.43 -1.72 -0.10 0.00 -0.06 0.00 0.00 31.44 29.99 2dxc n GLU 83 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 2dxc n ASP 84 N -3.31 -0.39 -0.27 4.31 -0.08 0.14 -4.99 116.55 111.96 2dxc n ASP 84 Ca -0.28 -2.40 0.05 0.00 -1.51 0.00 0.00 54.79 50.66 2dxc n ASP 84 Cb 1.05 -0.56 0.28 0.00 2.34 0.00 0.00 41.12 44.23 2dxc n ASP 84 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 2dxc h GLY 85 N 5.62 1.24 1.00 0.27 0.00 -1.57 -1.52 103.07 108.11 2dxc h GLY 85 Ca 0.27 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 47.22 2dxc h GLY 85 CO 0.38 0.26 0.10 -2.08 0.00 0.00 0.00 176.54 175.20 2dxc h VAL 86 N 0.94 1.04 -0.33 4.60 2.07 -1.90 0.04 116.25 122.70 2dxc h VAL 86 Ca 0.38 -0.08 -0.04 0.00 0.82 0.00 0.00 66.70 67.78 2dxc h VAL 86 Cb 0.27 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 2dxc h VAL 86 CO -0.15 0.04 0.05 -0.08 0.02 0.00 0.00 177.57 177.45 2dxc h GLU 87 N 0.20 0.56 -0.65 1.57 4.57 -1.84 -2.97 114.58 116.02 2dxc h GLU 87 Ca 0.05 -0.15 0.00 0.00 -1.18 0.00 0.00 59.36 58.08 2dxc h GLU 87 Cb -0.02 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.48 2dxc h GLU 87 CO -0.01 0.65 0.41 0.00 -1.18 0.00 0.00 179.01 178.88 2dxc h ALA 88 N 0.89 1.51 -0.34 2.92 0.00 -1.10 -2.49 119.26 120.65 2dxc h ALA 88 Ca 0.10 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.00 2dxc h ALA 88 Cb 0.37 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2dxc h ALA 88 CO 0.01 0.44 0.23 1.03 0.00 0.00 0.00 179.25 180.96 2dxc h SER 89 N 0.88 0.22 -0.38 0.00 0.87 -0.81 -1.54 113.55 112.78 2dxc h SER 89 Ca 0.23 -0.00 0.07 0.00 -1.23 0.00 0.00 61.79 60.86 2dxc h SER 89 Cb -0.07 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 61.82 2dxc h SER 89 CO -0.05 0.15 0.26 0.11 -0.53 0.00 0.00 176.83 176.77 2dxc h LYS 90 N 0.25 0.23 0.00 2.24 1.57 -1.40 -1.45 116.57 118.00 2dxc h LYS 90 Ca 0.15 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.91 2dxc h LYS 90 Cb 0.26 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.52 2dxc h LYS 90 CO -0.03 0.15 -0.03 0.00 -0.57 0.00 0.00 179.45 178.97 2dxc h ALA 91 N 1.80 1.14 -0.35 3.86 0.00 -1.42 -1.50 119.26 122.78 2dxc h ALA 91 Ca 0.17 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2dxc h ALA 91 Cb 0.38 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2dxc h ALA 91 CO -0.03 0.03 0.00 1.33 0.00 0.00 0.00 179.25 180.58 2dxc n VAL 92 N -3.32 2.37 -0.99 0.00 0.24 -0.57 -4.95 118.33 111.11 2dxc n VAL 92 Ca -0.02 -1.72 0.00 0.00 -2.04 0.00 0.00 64.34 60.56 2dxc n VAL 92 Cb 0.15 -0.23 0.00 0.00 -1.47 0.00 0.00 33.84 32.29 2dxc n VAL 92 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2dxc n GLY 93 N -0.15 0.55 3.15 7.63 0.00 -0.56 -4.85 105.19 110.95 2dxc n GLY 93 Ca 0.23 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.88 2dxc n GLY 93 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dxc s VAL 94 N -2.17 3.38 -0.43 1.61 1.01 -1.04 -4.99 120.40 117.76 2dxc s VAL 94 Ca 0.00 -1.87 -0.17 0.00 0.00 0.00 0.00 61.98 59.94 2dxc s VAL 94 Cb 0.00 -3.23 0.03 0.00 0.00 0.00 0.00 36.38 33.18 2dxc s VAL 94 CO 0.00 -0.59 0.41 0.21 0.00 0.00 0.00 175.10 175.14 2dxc s ASN 95 N 1.80 6.17 0.66 3.32 3.84 -1.26 -3.20 114.94 126.28 2dxc s ASN 95 Ca 0.06 -0.78 0.40 0.00 0.21 0.00 0.00 52.86 52.75 2dxc s ASN 95 Cb -0.22 -2.21 2.18 0.00 -0.55 0.00 0.00 41.25 40.45 2dxc s ASN 95 CO -0.03 -0.57 2.25 -0.50 -2.79 0.00 0.00 177.10 175.46 2dxc h TRP 96 N 8.72 0.00 0.02 0.43 4.06 -1.95 0.25 115.95 127.49 2dxc h TRP 96 Ca -0.27 0.00 -0.37 0.00 2.06 0.00 0.00 58.89 60.32 2dxc h TRP 96 Cb 1.11 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 29.22 2dxc h TRP 96 CO 0.61 0.00 -2.05 0.28 -3.56 0.00 0.00 178.44 173.73 2dxc n VAL 97 N -3.12 1.56 0.40 1.49 0.31 -1.26 -3.52 118.33 114.19 2dxc n VAL 97 Ca -0.03 -0.33 0.11 0.00 -0.01 0.00 0.00 64.34 64.08 2dxc n VAL 97 Cb 0.16 -1.85 -0.11 0.00 -0.91 0.00 0.00 33.84 31.13 2dxc n VAL 97 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2dxc n THR 98 N -4.07 0.06 -0.15 2.52 -2.24 -1.13 -1.69 114.28 107.58 2dxc n THR 98 Ca -0.43 -0.31 -0.11 0.00 -2.27 0.00 0.00 64.05 60.94 2dxc n THR 98 Cb 0.86 0.31 -0.01 0.00 -2.10 0.00 0.00 70.33 69.39 2dxc n THR 98 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2dxc h SER 99 N 0.00 0.83 -4.22 3.42 0.02 -0.77 -3.44 113.55 109.38 2dxc h SER 99 Ca 0.00 -0.34 -0.51 0.00 -0.84 0.00 0.00 61.79 60.10 2dxc h SER 99 Cb 0.80 -0.22 0.11 0.00 0.14 0.00 0.00 62.40 63.23 2dxc h SER 99 CO 0.00 0.97 0.36 -2.84 -1.14 0.00 0.00 176.83 174.19 2dxc s PRO 100 N -4.87 2.61 0.61 3.45 0.02 -1.26 -4.93 135.00 130.62 2dxc s PRO 100 Ca -0.12 1.38 0.33 0.00 0.02 0.00 0.00 61.00 62.60 2dxc s PRO 100 Cb 0.11 -1.93 1.91 0.00 0.02 0.00 0.00 34.50 34.61 2dxc s PRO 100 CO 0.82 -1.40 2.24 -1.35 -0.33 0.00 0.00 177.00 176.98 2dxc h PRO 101 N -0.25 0.00 -0.04 5.54 0.11 -1.93 -3.05 132.00 132.38 2dxc h PRO 101 Ca -0.46 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.53 2dxc h PRO 101 Cb 1.25 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 2dxc h PRO 101 CO 0.53 0.00 -0.52 1.79 -0.21 0.00 0.00 178.00 179.59 2dxc h THR 102 N 0.00 1.36 -0.09 -1.15 1.35 -1.90 -3.47 112.91 109.02 2dxc h THR 102 Ca 0.02 -1.77 -0.04 0.00 -0.55 0.00 0.00 66.41 64.07 2dxc h THR 102 Cb 0.13 1.91 -0.01 0.00 -1.73 0.00 0.00 68.15 68.44 2dxc h THR 102 CO -0.00 0.52 -0.03 0.00 -0.25 0.00 0.00 175.52 175.75 2dxc n GLN 103 N -3.93 -0.30 -1.09 4.72 1.13 -1.15 -4.82 117.38 111.94 2dxc n GLN 103 Ca -0.02 0.36 0.01 0.00 -1.94 0.00 0.00 57.00 55.41 2dxc n GLN 103 Cb 0.54 -3.82 -0.00 0.00 0.11 0.00 0.00 30.24 27.06 2dxc n GLN 103 CO 0.00 0.00 0.00 1.97 -1.44 0.00 0.00 177.06 177.59 2dxc n PHE 104 N -2.86 0.00 0.00 1.08 1.16 -0.99 -4.72 117.46 111.13 2dxc n PHE 104 Ca -0.02 -0.34 0.00 0.00 -1.87 0.00 0.00 57.45 55.22 2dxc n PHE 104 Cb 0.10 0.03 0.00 0.00 -1.61 0.00 0.00 39.48 38.00 2dxc n PHE 104 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2dxc n GLY 105 N 0.25 -2.34 3.76 4.97 0.00 -0.68 -4.87 105.19 106.27 2dxc n GLY 105 Ca -0.02 -1.47 -0.37 0.00 0.00 0.00 0.00 46.02 44.16 2dxc n GLY 105 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dxc s THR 106 N -2.70 2.82 0.39 2.61 -4.23 -1.26 -4.67 115.64 108.60 2dxc s THR 106 Ca 0.00 0.57 0.08 0.00 -1.18 0.00 0.00 61.69 61.16 2dxc s THR 106 Cb 0.00 -3.27 0.21 0.00 1.34 0.00 0.00 72.50 70.78 2dxc s THR 106 CO 0.00 -0.05 1.98 -0.65 -0.54 0.00 0.00 174.62 175.35 2dxc h PRO 107 N 1.52 0.42 0.00 3.99 0.11 -1.95 -2.84 132.00 133.25 2dxc h PRO 107 Ca -0.50 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 65.55 2dxc h PRO 107 Cb 1.27 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 2dxc h PRO 107 CO 0.58 0.39 -1.64 0.43 -0.21 0.00 0.00 178.00 177.54 2dxc n SER 108 N -4.37 0.31 -0.00 -2.05 7.64 -1.26 -4.42 113.62 109.46 2dxc n SER 108 Ca 0.01 0.12 0.10 0.00 1.01 0.00 0.00 58.87 60.11 2dxc n SER 108 Cb 0.17 1.42 -0.14 0.00 -1.01 0.00 0.00 64.21 64.65 2dxc n SER 108 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2dxc n ASP 109 N -2.42 0.58 -0.44 6.43 8.00 -1.23 -4.94 116.55 122.53 2dxc n ASP 109 Ca -0.03 -0.53 0.00 0.00 0.71 0.00 0.00 54.79 54.94 2dxc n ASP 109 Cb 0.57 1.45 0.00 0.00 -0.02 0.00 0.00 41.12 43.12 2dxc n ASP 109 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2dxc n TYR 110 N -1.84 -1.44 -2.54 1.24 4.01 -1.07 -4.57 117.16 110.95 2dxc n TYR 110 Ca 0.00 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.58 2dxc n TYR 110 Cb 0.43 0.24 0.02 0.00 -0.31 0.00 0.00 39.34 39.72 2dxc n TYR 110 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2dxc n ASN 112 N -0.36 0.26 -4.73 0.00 2.85 -1.26 -4.94 115.26 107.08 2dxc n ASN 112 Ca 0.24 -2.66 -0.41 0.00 -0.11 0.00 0.00 54.58 51.64 2dxc n ASN 112 Cb 0.77 -0.62 -0.05 0.00 1.24 0.00 0.00 39.78 41.13 2dxc n ASN 112 CO 0.00 0.00 0.00 -0.22 -2.11 0.00 0.00 177.26 174.93 2dxc s LEU 113 N -0.94 4.53 -0.03 1.20 2.96 -1.26 -2.46 118.68 122.68 2dxc s LEU 113 Ca 0.35 1.88 0.05 0.00 -0.22 0.00 0.00 54.13 56.19 2dxc s LEU 113 Cb 0.13 -3.60 -0.01 0.00 0.50 0.00 0.00 46.19 43.22 2dxc s LEU 113 CO -0.13 -0.05 -0.18 -0.13 -1.32 0.00 0.00 176.35 174.54 2dxc s ARG 114 N -0.31 1.73 -0.22 1.98 0.52 -0.14 -3.39 118.95 119.12 2dxc s ARG 114 Ca 0.46 -0.65 -0.08 0.00 -0.52 0.00 0.00 55.73 54.94 2dxc s ARG 114 Cb -0.25 -1.56 -0.04 0.00 0.52 0.00 0.00 34.95 33.62 2dxc s ARG 114 CO 0.31 0.31 0.09 0.08 0.02 0.00 0.00 175.30 176.12 2dxc s VAL 115 N -0.16 4.79 -0.34 3.52 1.01 -1.25 -2.65 120.40 125.32 2dxc s VAL 115 Ca 0.00 -0.02 -0.14 0.00 0.00 0.00 0.00 61.98 61.83 2dxc s VAL 115 Cb -0.10 -3.21 -0.02 0.00 0.00 0.00 0.00 36.38 33.06 2dxc s VAL 115 CO 0.01 0.38 0.28 -0.76 0.00 0.00 0.00 175.10 175.02 2dxc s LEU 116 N 0.98 4.49 -0.33 3.92 1.43 -0.44 -4.52 118.68 124.21 2dxc s LEU 116 Ca 0.05 -0.35 -0.17 0.00 -1.03 0.00 0.00 54.13 52.63 2dxc s LEU 116 Cb -0.14 -2.21 -0.01 0.00 0.03 0.00 0.00 46.19 43.86 2dxc s LEU 116 CO 0.03 -0.27 0.48 0.00 0.23 0.00 0.00 176.35 176.83 2dxc s ALA 117 N 1.83 3.50 0.90 4.21 0.00 -1.26 0.06 121.76 131.00 2dxc s ALA 117 Ca 0.08 -0.99 -0.12 0.00 0.00 0.00 0.00 51.96 50.94 2dxc s ALA 117 Cb -0.17 -2.96 0.13 0.00 0.00 0.00 0.00 23.12 20.12 2dxc s ALA 117 CO 0.11 -1.12 1.09 -0.51 0.00 0.00 0.00 175.76 175.33 2dxc s ASP 118 N 1.73 3.40 0.33 0.00 1.01 -0.08 -4.93 116.67 118.13 2dxc s ASP 118 Ca 0.18 1.51 -0.11 0.00 0.71 0.00 0.00 52.55 54.83 2dxc s ASP 118 Cb -0.16 -2.18 0.02 0.00 1.01 0.00 0.00 42.92 41.61 2dxc s ASP 118 CO 0.12 -2.68 0.61 -0.94 0.21 0.00 0.00 175.17 172.49 2dxc s SER 119 N -3.38 0.28 0.45 0.27 1.04 0.11 -4.59 113.70 107.88 2dxc s SER 119 Ca 0.64 -1.17 0.28 0.00 0.48 0.00 0.00 55.95 56.17 2dxc s SER 119 Cb -0.18 0.72 1.50 0.00 0.10 0.00 0.00 66.02 68.16 2dxc s SER 119 CO 0.57 -1.41 1.83 -0.65 0.98 0.00 0.00 173.24 174.56 2dxc h PRO 120 N 2.09 0.00 0.00 4.02 0.11 -2.03 -1.86 132.00 134.33 2dxc h PRO 120 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2dxc h PRO 120 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2dxc h PRO 120 CO 0.37 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.41 2dxc n THR 121 N -2.51 0.81 -3.72 -1.15 -2.24 -1.26 -4.88 114.28 99.33 2dxc n THR 121 Ca -0.02 -0.90 -0.12 0.00 -2.27 0.00 0.00 64.05 60.75 2dxc n THR 121 Cb 0.12 0.60 -0.12 0.00 -2.10 0.00 0.00 70.33 68.82 2dxc n THR 121 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2dxc s LEU 122 N -0.81 0.24 -0.05 3.22 2.96 -0.70 -1.14 118.68 122.39 2dxc s LEU 122 Ca 0.00 0.63 -0.00 0.00 -0.22 0.00 0.00 54.13 54.54 2dxc s LEU 122 Cb 0.00 0.91 0.03 0.00 0.50 0.00 0.00 46.19 47.63 2dxc s LEU 122 CO 0.00 -0.18 -0.01 -0.75 -1.32 0.00 0.00 176.35 174.09 2dxc s LYS 123 N 1.34 0.60 0.13 1.98 2.36 -0.30 0.05 119.74 125.90 2dxc s LYS 123 Ca -0.09 0.05 0.02 0.00 -2.55 0.00 0.00 55.97 53.40 2dxc s LYS 123 Cb -0.10 -0.83 -0.04 0.00 -1.05 0.00 0.00 37.83 35.81 2dxc s LYS 123 CO -0.10 -0.21 0.27 -1.01 1.55 0.00 0.00 175.35 175.85 2dxc s HIS 124 N 1.49 3.49 -0.10 4.03 3.76 -1.26 -1.01 115.29 125.69 2dxc s HIS 124 Ca -0.02 0.14 -0.08 0.00 -0.15 0.00 0.00 55.06 54.95 2dxc s HIS 124 Cb -0.13 -1.68 0.03 0.00 1.11 0.00 0.00 32.58 31.91 2dxc s HIS 124 CO -0.03 0.53 0.26 0.54 -0.85 0.00 0.00 174.74 175.19 2dxc s VAL 125 N -1.70 -0.01 0.08 -0.90 0.11 -0.85 -4.49 120.40 112.64 2dxc s VAL 125 Ca 0.35 0.04 0.05 0.00 -2.93 0.00 0.00 61.98 59.49 2dxc s VAL 125 Cb -0.11 -0.37 -0.04 0.00 -1.53 0.00 0.00 36.38 34.32 2dxc s VAL 125 CO 0.28 0.02 -0.05 -0.69 -3.33 0.00 0.00 175.10 171.33 2dxc s VAL 126 N 0.43 3.72 0.23 2.04 1.01 0.12 -1.12 120.40 126.83 2dxc s VAL 126 Ca -0.02 -1.07 -0.21 0.00 0.00 0.00 0.00 61.98 60.68 2dxc s VAL 126 Cb -0.04 -2.74 0.03 0.00 0.00 0.00 0.00 36.38 33.64 2dxc s VAL 126 CO -0.02 0.15 0.64 0.54 0.00 0.00 0.00 175.10 176.41 2dxc s VAL 127 N -1.23 0.00 -0.37 2.92 0.11 -0.71 -4.93 120.40 116.19 2dxc s VAL 127 Ca 0.23 -0.69 0.00 0.00 -2.93 0.00 0.00 61.98 58.59 2dxc s VAL 127 Cb -0.11 -1.65 0.12 0.00 -1.53 0.00 0.00 36.38 33.21 2dxc s VAL 127 CO 0.15 -0.02 0.17 0.00 -3.33 0.00 0.00 175.10 172.07 2dxc h THR 129 N 5.76 0.95 0.08 0.00 1.35 -1.87 -3.35 112.91 115.84 2dxc h THR 129 Ca -0.06 -0.30 -0.25 0.00 -0.55 0.00 0.00 66.41 65.25 2dxc h THR 129 Cb 0.97 1.17 -0.00 0.00 -1.73 0.00 0.00 68.15 68.56 2dxc h THR 129 CO 0.44 0.08 -1.13 -0.07 -0.25 0.00 0.00 175.52 174.60 2dxc h LEU 130 N 0.00 0.38 -9.42 3.87 3.38 -1.92 -3.47 115.31 108.14 2dxc h LEU 130 Ca -0.00 -0.37 -0.58 0.00 0.09 0.00 0.00 57.88 57.01 2dxc h LEU 130 Cb 0.16 -0.12 -0.11 0.00 0.09 0.00 0.00 40.66 40.67 2dxc h LEU 130 CO 0.01 1.26 -0.69 -0.94 0.09 0.00 0.00 178.44 178.17 2dxc s SER 132 N -7.07 4.21 0.00 -0.43 1.04 -1.26 -5.21 113.70 104.99 2dxc s SER 132 Ca -0.04 -0.76 0.00 0.00 0.48 0.00 0.00 55.95 55.64 2dxc s SER 132 Cb 0.08 -0.66 0.00 0.00 0.10 0.00 0.00 66.02 65.54 2dxc s SER 132 CO 0.87 0.02 0.00 0.00 0.98 0.00 0.00 173.24 175.11 2dxc n TYR 134 N -0.70 0.00 -0.94 5.02 9.36 -1.26 -4.94 117.16 123.69 2dxc n TYR 134 Ca -0.07 0.00 -0.25 0.00 3.32 0.00 0.00 57.90 60.91 2dxc n TYR 134 Cb 0.59 0.00 -0.05 0.00 -0.63 0.00 0.00 39.34 39.25 2dxc n TYR 134 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 2dxc n PRO 135 N -1.00 2.51 -0.28 2.98 -0.04 -1.26 -4.77 135.00 133.13 2dxc n PRO 135 Ca 0.00 -1.54 0.04 0.00 -0.04 0.00 0.00 63.50 61.96 2dxc n PRO 135 Cb 0.00 -2.43 0.12 0.00 -0.04 0.00 0.00 33.50 31.16 2dxc n PRO 135 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dxc h ARG 136 N 5.19 0.02 -1.01 0.54 3.08 -1.94 -0.79 114.38 119.46 2dxc h ARG 136 Ca 0.54 -0.00 0.24 0.00 0.07 0.00 0.00 59.98 60.83 2dxc h ARG 136 Cb 0.46 -0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.40 2dxc h ARG 136 CO 1.27 0.01 0.63 -1.35 -1.07 0.00 0.00 179.97 179.46 2dxc h PRO 137 N 0.02 0.50 -0.00 0.04 0.11 -1.86 0.35 132.00 131.16 2dxc h PRO 137 Ca 0.41 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.49 2dxc h PRO 137 Cb 0.66 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.66 2dxc h PRO 137 CO -0.81 0.33 -0.57 1.51 -0.21 0.00 0.00 178.00 178.25 2dxc n ILE 138 N -4.71 0.00 0.00 4.15 3.06 -0.78 -4.71 119.36 116.37 2dxc n ILE 138 Ca 0.25 -0.21 0.00 0.00 -2.50 0.00 0.00 62.75 60.29 2dxc n ILE 138 Cb 0.77 1.01 0.00 0.00 0.54 0.00 0.00 39.64 41.96 2dxc n ILE 138 CO 0.00 0.00 0.00 -0.11 -2.50 0.00 0.00 176.55 173.94 2dxc n LEU 139 N -1.25 0.00 0.00 9.51 7.94 -0.37 -2.66 117.00 130.16 2dxc n LEU 139 Ca 0.02 -0.06 0.00 0.00 -1.11 0.00 0.00 56.01 54.87 2dxc n LEU 139 Cb 0.20 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.15 2dxc n LEU 139 CO 0.25 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.14 2dxc n GLY 140 N 1.98 -1.88 3.84 -3.96 0.00 0.08 -2.29 105.19 102.97 2dxc n GLY 140 Ca 0.00 -2.02 -0.32 0.00 0.00 0.00 0.00 46.02 43.68 2dxc n GLY 140 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dxc s GLN 141 N 0.00 4.04 0.50 1.61 -0.21 -1.26 -3.93 119.66 120.40 2dxc s GLN 141 Ca 0.00 0.82 -0.21 0.00 0.02 0.00 0.00 55.36 55.99 2dxc s GLN 141 Cb 0.00 -2.31 -0.07 0.00 1.00 0.00 0.00 33.01 31.63 2dxc s GLN 141 CO 0.00 0.02 1.11 -1.54 -2.12 0.00 0.00 175.29 172.76 2dxc s SER 142 N -2.46 6.03 0.56 5.90 1.04 -1.26 -5.02 113.70 118.50 2dxc s SER 142 Ca 0.57 2.13 -0.19 0.00 0.48 0.00 0.00 55.95 58.94 2dxc s SER 142 Cb -0.10 -2.58 -0.05 0.00 0.10 0.00 0.00 66.02 63.39 2dxc s SER 142 CO 0.19 -1.00 1.13 -2.84 0.98 0.00 0.00 173.24 171.70 2dxc s PRO 143 N -3.10 3.26 0.20 4.02 0.02 -1.26 -4.94 135.00 133.20 2dxc s PRO 143 Ca 0.69 1.57 -0.11 0.00 0.02 0.00 0.00 61.00 63.17 2dxc s PRO 143 Cb -0.23 -2.00 0.21 0.00 0.02 0.00 0.00 34.50 32.51 2dxc s PRO 143 CO 0.27 -0.91 1.78 1.49 -0.33 0.00 0.00 177.00 179.29 2dxc h GLU 144 N 1.00 0.51 0.00 5.54 4.57 -2.00 -1.83 114.58 122.36 2dxc h GLU 144 Ca -0.49 -0.03 -0.04 0.00 -1.18 0.00 0.00 59.36 57.62 2dxc h GLU 144 Cb 1.26 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 29.73 2dxc h GLU 144 CO 0.56 0.34 -0.18 0.11 -1.18 0.00 0.00 179.01 178.66 2dxc h TRP 145 N 0.52 0.00 0.00 0.92 5.08 -1.98 -2.22 115.95 118.27 2dxc h TRP 145 Ca 0.27 0.00 -0.06 0.00 1.08 0.00 0.00 58.89 60.18 2dxc h TRP 145 Cb 0.23 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.38 2dxc h TRP 145 CO -0.12 0.18 -0.30 -0.92 -1.28 0.00 0.00 178.44 176.01 2dxc h TYR 146 N 0.00 0.00 0.00 0.12 3.20 -1.70 -2.43 116.97 116.15 2dxc h TYR 146 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2dxc h TYR 146 Cb 0.39 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.66 2dxc h TYR 146 CO 0.00 0.30 -0.36 0.54 -1.64 0.00 0.00 178.16 177.00 2dxc n ARG 147 N -4.13 0.20 -2.02 1.82 1.74 -0.85 -4.70 116.66 108.71 2dxc n ARG 147 Ca -0.02 0.09 -0.40 0.00 -0.77 0.00 0.00 57.85 56.75 2dxc n ARG 147 Cb 0.35 -1.66 -0.01 0.00 -1.02 0.00 0.00 32.46 30.12 2dxc n ARG 147 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2dxc s SER 148 N -3.95 6.53 0.47 0.55 1.04 -0.92 -4.90 113.70 112.53 2dxc s SER 148 Ca 0.09 2.77 0.14 0.00 0.48 0.00 0.00 55.95 59.43 2dxc s SER 148 Cb 0.14 -2.65 1.11 0.00 0.10 0.00 0.00 66.02 64.72 2dxc s SER 148 CO 0.66 -0.71 2.06 -0.65 0.98 0.00 0.00 173.24 175.58 2dxc h PRO 149 N 3.09 0.26 0.25 4.02 0.11 -1.92 -1.98 132.00 135.82 2dxc h PRO 149 Ca -0.50 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 2dxc h PRO 149 Cb 1.24 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2dxc h PRO 149 CO 0.64 0.17 -0.12 -0.97 -0.21 0.00 0.00 178.00 177.52 2dxc h ASN 150 N 0.27 -0.28 -0.72 -2.05 -0.73 -1.91 0.15 115.58 110.31 2dxc h ASN 150 Ca 0.16 -0.04 -0.03 0.00 1.87 0.00 0.00 56.30 58.26 2dxc h ASN 150 Cb 0.28 0.07 -0.03 0.00 0.27 0.00 0.00 38.32 38.91 2dxc h ASN 150 CO -0.03 -0.15 0.33 0.22 -0.37 0.00 0.00 177.43 177.43 2dxc h TYR 151 N -0.39 1.05 0.00 0.67 3.20 -1.70 -1.58 116.97 118.22 2dxc h TYR 151 Ca -0.03 -0.06 -0.07 0.00 3.14 0.00 0.00 58.73 61.71 2dxc h TYR 151 Cb 0.30 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 2dxc h TYR 151 CO -0.04 0.79 -0.34 0.00 -1.64 0.00 0.00 178.16 176.93 2dxc h ARG 152 N 1.01 0.00 0.09 1.82 3.08 -1.20 -2.34 114.38 116.84 2dxc h ARG 152 Ca 0.25 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.17 2dxc h ARG 152 Cb 0.14 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.21 2dxc h ARG 152 CO -0.03 0.34 -0.55 0.00 -1.07 0.00 0.00 179.97 178.66 2dxc h ARG 153 N 0.00 0.18 0.19 0.04 3.08 -0.32 -3.43 114.38 114.12 2dxc h ARG 153 Ca -0.00 -0.31 -0.32 0.00 0.07 0.00 0.00 59.98 59.41 2dxc h ARG 153 Cb 0.66 0.12 0.02 0.00 0.08 0.00 0.00 29.97 30.84 2dxc h ARG 153 CO 0.04 1.15 -1.55 0.00 -1.07 0.00 0.00 179.97 178.55 2dxc h ARG 154 N -0.61 0.39 -0.64 0.04 3.08 -1.29 -3.41 114.38 111.95 2dxc h ARG 154 Ca -0.10 -0.67 0.13 0.00 0.07 0.00 0.00 59.98 59.41 2dxc h ARG 154 Cb 1.41 0.25 -0.10 0.00 0.08 0.00 0.00 29.97 31.61 2dxc h ARG 154 CO 0.09 1.32 0.09 1.25 -1.07 0.00 0.00 179.97 181.65 2dxc h LEU 155 N -0.01 -0.11 -1.96 3.04 5.85 -1.65 0.22 115.31 120.69 2dxc h LEU 155 Ca -0.30 0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.53 2dxc h LEU 155 Cb 2.01 0.21 -0.00 0.00 0.37 0.00 0.00 40.66 43.25 2dxc h LEU 155 CO 0.18 -0.05 -0.11 -0.37 -0.34 0.00 0.00 178.44 177.75 2dxc h VAL 156 N 0.20 0.73 0.00 1.05 -1.51 -1.82 -2.64 116.25 112.26 2dxc h VAL 156 Ca 0.34 -0.43 -0.34 0.00 -1.23 0.00 0.00 66.70 65.04 2dxc h VAL 156 Cb 0.55 1.26 -0.06 0.00 -2.13 0.00 0.00 31.29 30.90 2dxc h VAL 156 CO -0.48 0.11 -2.29 -1.14 -1.23 0.00 0.00 177.57 172.53 2dxc n ARG 157 N -3.90 0.77 -2.85 5.19 0.63 -0.56 -4.71 116.66 111.23 2dxc n ARG 157 Ca -0.02 0.07 -0.22 0.00 -0.92 0.00 0.00 57.85 56.76 2dxc n ARG 157 Cb 0.20 -1.47 -0.02 0.00 0.45 0.00 0.00 32.46 31.63 2dxc n ARG 157 CO 0.00 0.00 0.00 0.91 -2.51 0.00 0.00 177.63 176.03 2dxc n TRP 158 N -2.97 2.59 -0.20 -0.14 8.01 0.66 -4.93 117.44 120.47 2dxc n TRP 158 Ca -0.36 -3.58 -0.03 0.00 -1.31 0.00 0.00 57.50 52.21 2dxc n TRP 158 Cb 1.00 -0.36 0.07 0.00 -2.01 0.00 0.00 31.31 30.01 2dxc n TRP 158 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 2dxc h PRO 159 N 2.89 0.59 -0.73 -0.99 0.13 -1.63 -0.88 132.00 131.38 2dxc h PRO 159 Ca 0.13 -0.04 0.08 0.00 -0.87 0.00 0.00 66.00 65.31 2dxc h PRO 159 Cb 0.80 -0.13 -0.07 0.00 0.13 0.00 0.00 31.00 31.74 2dxc h PRO 159 CO 0.71 0.39 0.39 0.00 -0.23 0.00 0.00 178.00 179.25 2dxc h ARG 160 N 0.60 0.65 -0.14 0.86 2.47 -1.91 0.17 114.38 117.09 2dxc h ARG 160 Ca 0.26 -0.04 -0.05 0.00 -1.26 0.00 0.00 59.98 58.89 2dxc h ARG 160 Cb 0.14 -0.15 -0.00 0.00 -1.65 0.00 0.00 29.97 28.31 2dxc h ARG 160 CO -0.16 0.43 -0.10 1.96 0.56 0.00 0.00 179.97 182.66 2dxc h GLN 161 N 0.67 0.31 -0.40 0.04 7.50 -1.82 -2.00 115.11 119.42 2dxc h GLN 161 Ca 0.35 -0.15 -0.01 0.00 0.50 0.00 0.00 58.65 59.34 2dxc h GLN 161 Cb 0.32 -0.00 -0.02 0.00 0.05 0.00 0.00 27.48 27.83 2dxc h GLN 161 CO -0.24 0.68 0.22 0.28 -1.50 0.00 0.00 178.83 178.27 2dxc h VAL 162 N -0.05 1.15 -0.79 -0.54 2.07 -0.82 -2.00 116.25 115.28 2dxc h VAL 162 Ca 0.03 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.16 2dxc h VAL 162 Cb 0.60 0.67 -0.04 0.00 -1.52 0.00 0.00 31.29 31.00 2dxc h VAL 162 CO 0.03 0.15 0.46 -0.07 0.02 0.00 0.00 177.57 178.16 2dxc h LEU 163 N 0.52 0.95 -0.85 2.57 3.38 -0.69 -1.98 115.31 119.21 2dxc h LEU 163 Ca 0.14 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 2dxc h LEU 163 Cb 0.05 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.52 2dxc h LEU 163 CO -0.02 0.74 0.43 0.00 0.09 0.00 0.00 178.44 179.68 2dxc h ALA 164 N 1.42 1.10 -0.71 1.53 0.00 -0.98 0.24 119.26 121.86 2dxc h ALA 164 Ca 0.28 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2dxc h ALA 164 Cb -0.02 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.39 2dxc h ALA 164 CO -0.05 0.64 0.42 0.93 0.00 0.00 0.00 179.25 181.19 2dxc h GLU 165 N 1.20 0.96 0.00 0.00 5.08 -0.65 0.95 114.58 122.12 2dxc h GLU 165 Ca 0.30 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 2dxc h GLU 165 Cb 0.09 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.14 2dxc h GLU 165 CO -0.04 0.67 0.00 1.19 -1.00 0.00 0.00 179.01 179.83 2dxc n PHE 166 N -4.39 0.00 -0.37 4.33 3.72 -0.63 -4.88 117.46 115.24 2dxc n PHE 166 Ca 0.07 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.47 2dxc n PHE 166 Cb 0.07 -0.42 0.00 0.00 -0.94 0.00 0.00 39.48 38.19 2dxc n PHE 166 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dxc n GLY 167 N 0.80 0.78 3.24 1.37 0.00 0.33 -4.95 105.19 106.75 2dxc n GLY 167 Ca 0.08 -0.40 -0.33 0.00 0.00 0.00 0.00 46.02 45.37 2dxc n GLY 167 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dxc s LEU 168 N 0.00 2.28 -0.02 0.99 2.96 0.75 -4.97 118.68 120.66 2dxc s LEU 168 Ca 0.00 -0.52 0.01 0.00 -0.22 0.00 0.00 54.13 53.40 2dxc s LEU 168 Cb 0.00 -1.49 0.01 0.00 0.50 0.00 0.00 46.19 45.22 2dxc s LEU 168 CO 0.00 0.12 -0.04 -1.58 -1.32 0.00 0.00 176.35 173.52 2dxc s GLN 169 N 0.61 0.58 0.24 1.98 0.74 -1.26 -2.57 119.66 119.98 2dxc s GLN 169 Ca -0.11 -0.12 0.12 0.00 0.05 0.00 0.00 55.36 55.30 2dxc s GLN 169 Cb -0.16 -0.60 -0.05 0.00 1.10 0.00 0.00 33.01 33.30 2dxc s GLN 169 CO 0.03 -0.00 -0.21 -0.51 -0.55 0.00 0.00 175.29 174.05 2dxc s LEU 170 N 0.48 2.55 0.52 3.68 2.01 -1.26 -5.11 118.68 121.55 2dxc s LEU 170 Ca -0.06 -0.94 -0.21 0.00 0.01 0.00 0.00 54.13 52.93 2dxc s LEU 170 Cb -0.09 -1.16 -0.07 0.00 0.01 0.00 0.00 46.19 44.88 2dxc s LEU 170 CO -0.00 0.08 1.07 -2.65 1.01 0.00 0.00 176.35 175.85 2dxc n PRO 171 N -0.23 1.27 0.10 1.29 -0.02 -1.26 -4.87 135.00 131.27 2dxc n PRO 171 Ca -0.08 0.47 0.10 0.00 -2.02 0.00 0.00 63.50 61.96 2dxc n PRO 171 Cb 0.58 -2.22 0.57 0.00 -0.02 0.00 0.00 33.50 32.41 2dxc n PRO 171 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2dxc h SER 172 N 1.11 0.18 1.71 2.55 4.64 -2.04 -1.98 113.55 119.73 2dxc h SER 172 Ca -0.48 -0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.81 2dxc h SER 172 Cb 1.34 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 63.38 2dxc h SER 172 CO 0.54 0.12 -0.15 1.05 -0.87 0.00 0.00 176.83 177.52 2dxc h GLU 173 N 0.20 0.00 -6.87 4.77 9.09 -2.01 -3.45 114.58 116.31 2dxc h GLU 173 Ca 0.12 0.00 -0.53 0.00 0.05 0.00 0.00 59.36 59.01 2dxc h GLU 173 Cb 0.24 0.00 0.08 0.00 -1.65 0.00 0.00 28.75 27.42 2dxc h GLU 173 CO -0.02 0.15 0.71 0.08 0.05 0.00 0.00 179.01 179.97 2dxc s VAL 174 N -3.21 2.49 -0.46 -1.06 1.01 -0.75 -4.95 120.40 113.48 2dxc s VAL 174 Ca 0.05 0.48 -0.28 0.00 0.00 0.00 0.00 61.98 62.23 2dxc s VAL 174 Cb 0.06 -3.31 0.03 0.00 0.00 0.00 0.00 36.38 33.17 2dxc s VAL 174 CO 0.68 0.11 1.07 -1.58 0.00 0.00 0.00 175.10 175.38 2dxc s GLN 175 N -1.61 3.70 -0.22 2.72 0.74 -0.30 -4.93 119.66 119.78 2dxc s GLN 175 Ca 0.52 0.49 -0.20 0.00 0.05 0.00 0.00 55.36 56.23 2dxc s GLN 175 Cb -0.42 -3.90 -0.03 0.00 1.10 0.00 0.00 33.01 29.76 2dxc s GLN 175 CO 0.54 -1.29 0.58 0.42 -0.55 0.00 0.00 175.29 174.99 2dxc s ILE 176 N 4.19 5.05 -0.20 -2.34 1.01 -1.26 -1.15 121.20 126.49 2dxc s ILE 176 Ca 0.45 1.07 -0.02 0.00 0.00 0.00 0.00 60.65 62.15 2dxc s ILE 176 Cb -0.08 -3.90 0.00 0.00 0.01 0.00 0.00 42.46 38.49 2dxc s ILE 176 CO 0.29 0.11 -0.12 -0.60 0.00 0.00 0.00 174.94 174.63 2dxc s ARG 177 N 1.97 3.20 -0.17 2.79 3.52 -0.18 -4.96 118.95 125.13 2dxc s ARG 177 Ca 0.26 -0.72 -0.15 0.00 -0.13 0.00 0.00 55.73 54.99 2dxc s ARG 177 Cb -0.16 -2.80 -0.04 0.00 -1.56 0.00 0.00 34.95 30.39 2dxc s ARG 177 CO 0.10 -0.20 0.36 0.08 -0.81 0.00 0.00 175.30 174.83 2dxc s VAL 178 N 1.38 5.25 -0.24 7.11 1.01 -1.26 -2.00 120.40 131.64 2dxc s VAL 178 Ca 0.05 0.68 -0.07 0.00 0.00 0.00 0.00 61.98 62.64 2dxc s VAL 178 Cb -0.14 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 32.51 2dxc s VAL 178 CO -0.08 0.32 0.07 0.00 0.00 0.00 0.00 175.10 175.41 2dxc s ALA 179 N 0.82 3.17 -0.43 5.51 0.00 -0.27 -4.97 121.76 125.59 2dxc s ALA 179 Ca 0.19 -1.09 -0.14 0.00 0.00 0.00 0.00 51.96 50.92 2dxc s ALA 179 Cb -0.14 -2.05 0.05 0.00 0.00 0.00 0.00 23.12 20.98 2dxc s ALA 179 CO 0.07 -0.41 0.33 0.34 0.00 0.00 0.00 175.76 176.09 2dxc s ASP 180 N 1.47 6.04 -1.28 0.00 -1.08 -1.26 -1.74 116.67 118.82 2dxc s ASP 180 Ca 0.06 -1.16 -0.18 0.00 -0.52 0.00 0.00 52.55 50.75 2dxc s ASP 180 Cb -0.15 -2.14 0.02 0.00 -1.46 0.00 0.00 42.92 39.20 2dxc s ASP 180 CO 0.03 -0.54 1.87 -1.20 0.52 0.00 0.00 175.17 175.85 2dxc n SER 181 N 5.14 4.31 0.02 -0.34 7.64 0.30 -4.71 113.62 125.97 2dxc n SER 181 Ca -0.12 -2.86 0.11 0.00 1.01 0.00 0.00 58.87 57.02 2dxc n SER 181 Cb 0.45 -1.70 -0.06 0.00 -1.01 0.00 0.00 64.21 61.89 2dxc n SER 181 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 2dxc n ASN 182 N 9.02 0.52 0.00 6.43 6.94 -1.26 -4.71 115.26 132.20 2dxc n ASN 182 Ca 0.49 -0.26 0.00 0.00 -0.02 0.00 0.00 54.58 54.79 2dxc n ASN 182 Cb 0.45 1.16 0.00 0.00 -2.36 0.00 0.00 39.78 39.02 2dxc n ASN 182 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2dxc n GLN 183 N -2.01 1.35 -0.01 -3.83 1.13 -1.26 -5.01 117.38 107.74 2dxc n GLN 183 Ca 0.00 0.00 0.14 0.00 -1.94 0.00 0.00 57.00 55.20 2dxc n GLN 183 Cb 0.46 0.00 0.49 0.00 0.11 0.00 0.00 30.24 31.31 2dxc n GLN 183 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2dxc n LYS 184 N 0.00 1.71 -3.28 -1.09 5.02 -1.26 -4.90 118.16 114.35 2dxc n LYS 184 Ca 0.00 -1.03 -0.38 0.00 -2.02 0.00 0.00 58.31 54.88 2dxc n LYS 184 Cb 0.00 -1.47 -0.06 0.00 -0.02 0.00 0.00 35.03 33.48 2dxc n LYS 184 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2dxc s THR 185 N -1.98 4.75 0.03 -0.18 2.01 -1.26 -4.27 115.64 114.75 2dxc s THR 185 Ca 0.37 1.16 0.08 0.00 0.31 0.00 0.00 61.69 63.61 2dxc s THR 185 Cb 0.21 -3.87 -0.03 0.00 0.01 0.00 0.00 72.50 68.82 2dxc s THR 185 CO 0.33 0.50 -0.25 -0.13 -0.69 0.00 0.00 174.62 174.38 2dxc s ARG 186 N -1.25 1.72 0.24 4.92 1.81 -1.03 -4.73 118.95 120.63 2dxc s ARG 186 Ca 0.30 -1.02 0.11 0.00 -1.72 0.00 0.00 55.73 53.41 2dxc s ARG 186 Cb -0.19 -1.84 -0.05 0.00 -0.45 0.00 0.00 34.95 32.43 2dxc s ARG 186 CO 0.19 0.48 -0.20 0.71 -0.68 0.00 0.00 175.30 175.80 2dxc s TYR 187 N -0.76 2.21 0.01 -0.53 2.02 -1.26 -0.97 117.35 118.07 2dxc s TYR 187 Ca 0.10 -0.37 0.00 0.00 -0.37 0.00 0.00 57.07 56.44 2dxc s TYR 187 Cb -0.10 -1.00 -0.01 0.00 -0.40 0.00 0.00 41.96 40.45 2dxc s TYR 187 CO 0.01 0.60 -0.02 0.96 -1.57 0.00 0.00 175.55 175.54 2dxc s ILE 188 N -2.31 0.13 -0.17 2.71 -0.00 -1.08 -4.52 121.20 115.95 2dxc s ILE 188 Ca 0.26 -0.35 -0.10 0.00 -0.00 0.00 0.00 60.65 60.46 2dxc s ILE 188 Cb -0.05 -0.17 -0.05 0.00 -0.00 0.00 0.00 42.46 42.19 2dxc s ILE 188 CO 0.12 -0.14 0.17 -0.69 -0.00 0.00 0.00 174.94 174.40 2dxc s VAL 189 N -0.50 5.40 -0.52 8.37 1.01 -0.38 -1.32 120.40 132.45 2dxc s VAL 189 Ca -0.05 0.28 -0.15 0.00 0.00 0.00 0.00 61.98 62.07 2dxc s VAL 189 Cb -0.04 -3.50 0.12 0.00 0.00 0.00 0.00 36.38 32.97 2dxc s VAL 189 CO -0.00 0.46 0.46 -0.32 0.00 0.00 0.00 175.10 175.70 2dxc s MET 190 N 0.11 2.88 0.81 2.72 1.75 0.11 -4.44 119.30 123.25 2dxc s MET 190 Ca 0.11 -1.70 -0.11 0.00 -1.25 0.00 0.00 55.69 52.75 2dxc s MET 190 Cb -0.12 -4.21 0.08 0.00 2.84 0.00 0.00 34.83 33.42 2dxc s MET 190 CO 0.01 -1.28 1.09 -2.14 -0.65 0.00 0.00 175.02 172.05 2dxc s PRO 191 N 1.55 1.92 0.41 4.11 0.02 -1.26 -0.90 135.00 140.84 2dxc s PRO 191 Ca 0.04 1.06 -0.25 0.00 0.02 0.00 0.00 61.00 61.87 2dxc s PRO 191 Cb -0.29 -1.87 -0.08 0.00 0.02 0.00 0.00 34.50 32.28 2dxc s PRO 191 CO 0.02 -1.85 1.17 0.08 -0.33 0.00 0.00 177.00 176.10 2dxc s VAL 192 N -2.91 3.13 0.08 3.83 1.01 -1.26 -4.78 120.40 119.50 2dxc s VAL 192 Ca 0.62 0.94 -0.31 0.00 0.00 0.00 0.00 61.98 63.23 2dxc s VAL 192 Cb -0.17 -3.52 -0.07 0.00 0.00 0.00 0.00 36.38 32.61 2dxc s VAL 192 CO 0.56 0.08 1.42 -0.60 0.00 0.00 0.00 175.10 176.56 2dxc s ARG 193 N -2.33 4.30 0.63 2.72 3.52 -1.26 -4.80 118.95 121.73 2dxc s ARG 193 Ca 0.58 2.07 -0.14 0.00 -0.13 0.00 0.00 55.73 58.11 2dxc s ARG 193 Cb -0.31 -3.35 -0.02 0.00 -1.56 0.00 0.00 34.95 29.71 2dxc s ARG 193 CO 0.39 -0.50 1.06 -1.25 -0.81 0.00 0.00 175.30 174.19 2dxc s PRO 194 N 1.54 3.16 0.74 5.12 0.04 -1.26 -5.04 135.00 139.31 2dxc s PRO 194 Ca 0.65 1.11 -0.11 0.00 0.04 0.00 0.00 61.00 62.69 2dxc s PRO 194 Cb -0.36 -2.01 0.04 0.00 0.04 0.00 0.00 34.50 32.21 2dxc s PRO 194 CO 0.29 -0.93 1.09 -1.21 0.04 0.00 0.00 177.00 176.28 2dxc s GLU 195 N -4.45 2.45 0.00 4.56 0.41 -1.26 -3.96 118.70 116.44 2dxc s GLU 195 Ca 0.61 1.16 0.00 0.00 -0.41 0.00 0.00 54.97 56.33 2dxc s GLU 195 Cb -0.15 -1.92 0.00 0.00 -1.78 0.00 0.00 34.13 30.28 2dxc s GLU 195 CO 0.44 -1.50 0.00 0.41 -0.49 0.00 0.00 175.26 174.12 2dxc n GLY 196 N -1.27 0.55 0.29 -1.39 0.00 -1.26 -4.77 105.19 97.35 2dxc n GLY 196 Ca 0.09 -0.75 0.07 0.00 0.00 0.00 0.00 46.02 45.43 2dxc n GLY 196 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dxc n THR 197 N -2.74 1.52 -1.72 2.61 -2.24 -1.25 -4.96 114.28 105.50 2dxc n THR 197 Ca 0.00 -1.97 -0.42 0.00 -2.27 0.00 0.00 64.05 59.39 2dxc n THR 197 Cb 0.00 -0.05 -0.03 0.00 -2.10 0.00 0.00 70.33 68.15 2dxc n THR 197 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2dxc n ASP 198 N -1.05 3.95 0.00 3.42 9.92 -1.26 -1.84 116.55 129.69 2dxc n ASP 198 Ca 0.13 1.08 0.00 0.00 -0.53 0.00 0.00 54.79 55.47 2dxc n ASP 198 Cb 0.68 -1.57 0.00 0.00 -0.64 0.00 0.00 41.12 39.59 2dxc n ASP 198 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2dxc n GLY 199 N 3.66 0.70 3.76 0.44 0.00 -1.26 -5.00 105.19 107.48 2dxc n GLY 199 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 2dxc n GLY 199 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2dxc s TRP 200 N -2.98 2.55 0.76 1.61 0.52 -0.77 -5.03 118.94 115.61 2dxc s TRP 200 Ca 0.00 1.45 -0.08 0.00 0.02 0.00 0.00 56.10 57.49 2dxc s TRP 200 Cb 0.00 -3.61 0.09 0.00 -1.15 0.00 0.00 33.47 28.81 2dxc s TRP 200 CO 0.00 -2.26 1.08 0.95 0.02 0.00 0.00 176.95 176.74 2dxc s THR 201 N -1.42 2.18 0.15 2.01 -4.23 -1.26 -4.89 115.64 108.18 2dxc s THR 201 Ca 0.68 -0.22 -0.17 0.00 -1.18 0.00 0.00 61.69 60.80 2dxc s THR 201 Cb -0.35 -2.96 0.00 0.00 1.34 0.00 0.00 72.50 70.54 2dxc s THR 201 CO 0.42 0.00 1.79 -0.08 -0.54 0.00 0.00 174.62 176.20 2dxc h GLU 202 N -0.82 0.39 -0.65 3.99 4.81 -1.95 -1.98 114.58 118.37 2dxc h GLU 202 Ca -0.44 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 58.79 2dxc h GLU 202 Cb 1.30 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 30.56 2dxc h GLU 202 CO 0.56 0.26 0.41 -0.44 -0.73 0.00 0.00 179.01 179.07 2dxc h ASP 203 N 0.40 0.70 -0.73 1.04 3.32 -1.99 -0.03 116.42 119.14 2dxc h ASP 203 Ca 0.14 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.16 2dxc h ASP 203 Cb 0.02 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.37 2dxc h ASP 203 CO -0.07 0.49 0.38 1.56 -1.72 0.00 0.00 179.24 179.88 2dxc h GLN 204 N 0.83 1.03 -0.16 3.56 4.20 -1.86 -1.95 115.11 120.76 2dxc h GLN 204 Ca 0.25 -0.13 -0.09 0.00 0.06 0.00 0.00 58.65 58.74 2dxc h GLN 204 Cb -0.04 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 27.55 2dxc h GLN 204 CO -0.08 0.78 -0.26 -0.07 -0.67 0.00 0.00 178.83 178.53 2dxc h LEU 205 N 1.01 0.50 -1.63 1.46 3.38 -1.02 -3.14 115.31 115.86 2dxc h LEU 205 Ca 0.25 -0.53 0.04 0.00 0.09 0.00 0.00 57.88 57.73 2dxc h LEU 205 Cb 0.07 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 2dxc h LEU 205 CO -0.04 0.94 0.31 0.00 0.09 0.00 0.00 178.44 179.74 2dxc h ALA 206 N 0.58 1.84 -0.27 1.53 0.00 -0.92 -2.26 119.26 119.77 2dxc h ALA 206 Ca 0.01 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.92 2dxc h ALA 206 Cb 0.84 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 2dxc h ALA 206 CO 0.06 0.10 0.18 1.49 0.00 0.00 0.00 179.25 181.07 2dxc h GLU 207 N 0.47 0.29 -0.08 0.00 4.81 -1.30 -2.32 114.58 116.46 2dxc h GLU 207 Ca 0.19 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 2dxc h GLU 207 Cb 0.17 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.49 2dxc h GLU 207 CO -0.05 0.19 0.00 0.44 -0.73 0.00 0.00 179.01 178.87 2dxc n ILE 208 N -4.50 0.08 -3.17 2.32 -5.35 -0.85 -4.50 119.36 103.39 2dxc n ILE 208 Ca 0.01 -0.39 -0.46 0.00 -0.27 0.00 0.00 62.75 61.65 2dxc n ILE 208 Cb 0.12 0.84 -0.02 0.00 -1.74 0.00 0.00 39.64 38.83 2dxc n ILE 208 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 2dxc s VAL 209 N -1.92 5.25 0.81 7.28 1.01 -0.87 -4.25 120.40 127.69 2dxc s VAL 209 Ca 0.34 -2.07 -0.11 0.00 0.00 0.00 0.00 61.98 60.14 2dxc s VAL 209 Cb 0.20 -4.59 0.09 0.00 0.00 0.00 0.00 36.38 32.09 2dxc s VAL 209 CO 0.31 -1.21 1.16 0.42 0.00 0.00 0.00 175.10 175.78 2dxc s THR 210 N 1.23 2.06 0.22 3.92 -4.23 -1.26 -4.63 115.64 112.94 2dxc s THR 210 Ca 0.23 -0.06 -0.08 0.00 -1.18 0.00 0.00 61.69 60.60 2dxc s THR 210 Cb -0.09 -2.99 0.16 0.00 1.34 0.00 0.00 72.50 70.92 2dxc s THR 210 CO -0.08 0.00 1.79 -0.09 -0.54 0.00 0.00 174.62 175.69 2dxc h ARG 211 N -1.04 0.59 -0.45 3.99 2.43 -1.96 -1.12 114.38 116.83 2dxc h ARG 211 Ca -0.45 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 58.68 2dxc h ARG 211 Cb 1.31 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.71 2dxc h ARG 211 CO 0.61 0.39 0.27 -0.44 -1.51 0.00 0.00 179.97 179.29 2dxc h ASP 212 N 0.61 0.53 -0.11 -3.80 3.32 -1.94 -1.63 116.42 113.40 2dxc h ASP 212 Ca 0.32 -0.03 -0.12 0.00 0.02 0.00 0.00 57.03 57.23 2dxc h ASP 212 Cb 0.30 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 2dxc h ASP 212 CO -0.24 0.42 -0.33 0.00 -1.72 0.00 0.00 179.24 177.36 2dxc h LEU 214 N 0.51 0.00 0.03 0.00 3.38 -0.72 -2.80 115.31 115.71 2dxc h LEU 214 Ca 0.06 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.71 2dxc h LEU 214 Cb 0.82 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.53 2dxc h LEU 214 CO 0.07 0.00 -1.82 -0.38 0.09 0.00 0.00 178.44 176.39 2dxc n ILE 215 N -2.79 1.63 0.00 1.22 5.41 -0.77 -1.25 119.36 122.81 2dxc n ILE 215 Ca 0.02 -0.77 0.00 0.00 1.00 0.00 0.00 62.75 63.01 2dxc n ILE 215 Cb 0.36 -1.17 0.00 0.00 -0.71 0.00 0.00 39.64 38.12 2dxc n ILE 215 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2dxc n GLY 216 N 1.67 0.82 0.27 7.39 0.00 -0.26 -0.70 105.19 114.39 2dxc n GLY 216 Ca -0.22 0.00 0.14 0.00 0.00 0.00 0.00 46.02 45.95 2dxc n GLY 216 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2dxc n VAL 217 N -1.17 0.00 -3.81 1.61 0.24 -0.90 -4.61 118.33 109.70 2dxc n VAL 217 Ca 0.00 -0.14 -0.10 0.00 -2.04 0.00 0.00 64.34 62.06 2dxc n VAL 217 Cb 0.00 0.18 -0.06 0.00 -1.47 0.00 0.00 33.84 32.49 2dxc n VAL 217 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dxc s ALA 218 N -2.20 -0.49 0.12 2.33 0.00 -1.18 -4.62 121.76 115.71 2dxc s ALA 218 Ca 0.35 -0.47 0.10 0.00 0.00 0.00 0.00 51.96 51.94 2dxc s ALA 218 Cb 0.21 0.74 -0.04 0.00 0.00 0.00 0.00 23.12 24.03 2dxc s ALA 218 CO 0.41 -0.66 -0.25 0.14 0.00 0.00 0.00 175.76 175.40 2dxc s VAL 219 N -3.88 2.36 0.35 0.00 -7.23 -1.26 -4.06 120.40 106.67 2dxc s VAL 219 Ca 0.09 -1.66 -0.29 0.00 -1.81 0.00 0.00 61.98 58.32 2dxc s VAL 219 Cb 0.02 -2.04 -0.11 0.00 0.56 0.00 0.00 36.38 34.82 2dxc s VAL 219 CO -0.06 0.13 1.40 -2.16 -0.31 0.00 0.00 175.10 174.10 2dxc s PRO 220 N -1.97 4.24 -0.01 4.82 0.04 -1.26 -4.97 135.00 135.89 2dxc s PRO 220 Ca 0.14 2.38 0.00 0.00 0.04 0.00 0.00 61.00 63.57 2dxc s PRO 220 Cb -0.10 -3.03 0.02 0.00 0.04 0.00 0.00 34.50 31.43 2dxc s PRO 220 CO 0.06 -0.36 0.02 0.15 0.04 0.00 0.00 177.00 176.91 2dxc s LYS 221 N -1.81 -0.02 0.28 4.56 1.02 -1.26 -4.62 119.74 117.89 2dxc s LYS 221 Ca 0.51 0.13 -0.30 0.00 0.02 0.00 0.00 55.97 56.34 2dxc s LYS 221 Cb -0.43 -0.19 -0.12 0.00 -0.52 0.00 0.00 37.83 36.56 2dxc s LYS 221 CO 0.57 -0.12 1.46 -2.30 -0.92 0.00 0.00 175.35 174.04 2dxc n PRO 222 N 3.89 2.33 0.00 -1.68 -0.02 -1.26 -1.55 135.00 136.71 2dxc n PRO 222 Ca -0.24 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 2dxc n PRO 222 Cb 0.53 -2.52 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 2dxc n PRO 222 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dxc n GLY 223 N 1.86 3.27 3.45 -1.23 0.00 -1.26 -5.00 105.19 106.27 2dxc n GLY 223 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 2dxc n GLY 223 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dxc s ILE 224 N -2.34 5.12 -0.15 -0.61 1.01 -0.59 -4.92 121.20 118.71 2dxc s ILE 224 Ca 0.00 -0.68 0.12 0.00 0.00 0.00 0.00 60.65 60.08 2dxc s ILE 224 Cb 0.00 -3.85 0.22 0.00 0.01 0.00 0.00 42.46 38.84 2dxc s ILE 224 CO 0.00 -0.28 1.14 0.35 0.00 0.00 0.00 174.94 176.14 2dxc n THR 225 N 5.13 1.56 -3.84 2.92 -2.24 -1.26 -4.44 114.28 112.10 2dxc n THR 225 Ca -0.11 -1.70 -0.11 0.00 -2.27 0.00 0.00 64.05 59.86 2dxc n THR 225 Cb 0.47 0.07 -0.09 0.00 -2.10 0.00 0.00 70.33 68.68 2dxc n THR 225 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2dxc s VAL 226 N -2.09 0.09 0.68 2.28 0.11 -1.26 -4.91 120.40 115.31 2dxc s VAL 226 Ca 0.22 -0.77 -0.17 0.00 -2.93 0.00 0.00 61.98 58.32 2dxc s VAL 226 Cb 0.18 -0.72 -0.01 0.00 -1.53 0.00 0.00 36.38 34.29 2dxc s VAL 226 CO 0.04 -0.43 0.97 0.59 -3.33 0.00 0.00 175.10 172.94 2dxc n ASN 227 N 1.00 0.60 -4.75 3.54 3.02 -1.26 -4.87 115.26 112.53 2dxc n ASN 227 Ca -0.20 0.71 -0.42 0.00 -0.03 0.00 0.00 54.58 54.64 2dxc n ASN 227 Cb 0.57 -1.40 -0.01 0.00 -0.61 0.00 0.00 39.78 38.33 2dxc n ASN 227 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dxc n ALA 228 N -2.25 2.30 -1.85 5.41 0.00 -1.26 -4.90 120.51 117.96 2dxc n ALA 228 Ca 0.13 0.36 -0.41 0.00 0.00 0.00 0.00 53.44 53.52 2dxc n ALA 228 Cb 0.49 -2.42 -0.02 0.00 0.00 0.00 0.00 19.45 17.50 2dxc n ALA 228 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2dxc s LYS 229 N -1.42 4.29 0.15 0.00 2.20 -1.26 -5.02 119.74 118.68 2dxc s LYS 229 Ca 0.58 2.27 -0.11 0.00 -0.36 0.00 0.00 55.97 58.35 2dxc s LYS 229 Cb -0.50 -3.09 0.01 0.00 -1.51 0.00 0.00 37.83 32.73 2dxc s LYS 229 CO 0.57 -0.34 0.33 -0.98 -0.36 0.00 0.00 175.35 174.57 2dxc s ARG 230 N -0.92 1.13 0.45 4.03 1.70 -1.26 -5.14 118.95 118.94 2dxc s ARG 230 Ca 0.55 -1.01 -0.23 0.00 -0.47 0.00 0.00 55.73 54.57 2dxc s ARG 230 Cb -0.41 0.41 -0.10 0.00 -0.57 0.00 0.00 34.95 34.28 2dxc s ARG 230 CO 0.47 -0.43 0.90 -2.30 -1.08 0.00 0.00 175.30 172.87 2dxc n PRO 231 N -0.21 1.12 -4.03 3.89 -0.02 -1.26 -4.99 135.00 129.50 2dxc n PRO 231 Ca -0.10 0.41 -0.31 0.00 -2.02 0.00 0.00 63.50 61.47 2dxc n PRO 231 Cb 0.63 -1.95 -0.16 0.00 -0.02 0.00 0.00 33.50 32.00 2dxc n PRO 231 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2dxc s VAL 232 N -1.36 1.77 -0.15 -1.45 1.01 -1.26 -5.10 120.40 113.86 2dxc s VAL 232 Ca 0.65 -1.04 -0.26 0.00 0.00 0.00 0.00 61.98 61.33 2dxc s VAL 232 Cb -0.54 -1.79 -0.01 0.00 0.00 0.00 0.00 36.38 34.03 2dxc s VAL 232 CO 0.56 0.23 0.87 -0.22 0.00 0.00 0.00 175.10 176.54 2dxc s LEU 233 N 1.35 4.19 0.43 3.92 2.96 -1.26 -5.03 118.68 125.24 2dxc s LEU 233 Ca -0.01 1.25 -0.21 0.00 -0.22 0.00 0.00 54.13 54.95 2dxc s LEU 233 Cb -0.16 -3.31 -0.11 0.00 0.50 0.00 0.00 46.19 43.12 2dxc s LEU 233 CO -0.09 -0.41 0.96 -0.54 -1.32 0.00 0.00 176.35 174.96 2dxc s LYS 234 N 2.11 4.20 0.43 1.98 1.02 -1.26 -5.06 119.74 123.16 2dxc s LYS 234 Ca 0.40 1.17 -0.07 0.00 0.02 0.00 0.00 55.97 57.50 2dxc s LYS 234 Cb -0.17 -2.22 -0.05 0.00 -0.52 0.00 0.00 37.83 34.87 2dxc s LYS 234 CO 0.13 -0.06 0.75 0.00 -0.92 0.00 0.00 175.35 175.26 2dxc s ALA 235 N -2.10 3.41 0.18 5.17 0.00 -1.26 -4.99 121.76 122.18 2dxc s ALA 235 Ca 0.62 -0.41 -0.05 0.00 0.00 0.00 0.00 51.96 52.12 2dxc s ALA 235 Cb -0.11 -2.59 0.09 0.00 0.00 0.00 0.00 23.12 20.51 2dxc s ALA 235 CO 0.15 -0.15 1.51 -0.97 0.00 0.00 0.00 175.76 176.30 2dxc h ASN 236 N 0.78 0.71 -2.00 0.00 -1.24 -2.03 -3.38 115.58 108.42 2dxc h ASN 236 Ca -0.47 -0.36 -0.49 0.00 0.71 0.00 0.00 56.30 55.69 2dxc h ASN 236 Cb 1.20 -0.20 -0.33 0.00 0.73 0.00 0.00 38.32 39.71 2dxc h ASN 236 CO 0.63 1.08 -0.89 -1.14 -1.29 0.00 0.00 177.43 175.82 2dxc n ARG 237 N -3.99 0.32 -0.84 6.67 0.63 -1.26 -5.15 116.66 113.04 2dxc n ARG 237 Ca -0.03 -2.92 -0.32 0.00 -0.92 0.00 0.00 57.85 53.67 2dxc n ARG 237 Cb 0.58 -1.58 0.15 0.00 0.45 0.00 0.00 32.46 32.06 2dxc n ARG 237 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 2dxc s PRO 238 N 0.10 1.26 0.00 -0.14 0.04 -1.26 -5.26 135.00 129.74 2dxc s PRO 238 Ca 0.33 1.58 0.26 0.00 0.04 0.00 0.00 61.00 63.21 2dxc s PRO 238 Cb 0.05 -1.75 1.57 0.00 0.04 0.00 0.00 34.50 34.41 2dxc s PRO 238 CO -0.16 -2.46 1.92 0.28 0.04 0.00 0.00 177.00 176.62