#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 4.02 0.63 2.62 -7.23 -1.26 -5.05 120.40 114.13 2dxc s VAL 24 Ca 0.00 1.72 -0.02 0.00 -1.81 0.00 0.00 61.98 61.87 2dxc s VAL 24 Cb 0.00 -3.97 0.05 0.00 0.56 0.00 0.00 36.38 33.02 2dxc s VAL 24 CO 0.00 0.18 0.89 -0.94 -0.31 0.00 0.00 175.10 174.92 2dxc s SER 25 N -1.48 5.00 0.48 4.85 1.04 -1.26 -4.94 113.70 117.40 2dxc s SER 25 Ca 0.50 0.17 0.15 0.00 0.48 0.00 0.00 55.95 57.24 2dxc s SER 25 Cb -0.22 -0.91 1.13 0.00 0.10 0.00 0.00 66.02 66.13 2dxc s SER 25 CO 0.27 -1.40 2.08 0.44 0.98 0.00 0.00 173.24 175.62 2dxc h ASP 26 N -0.27 0.04 -0.24 7.02 3.32 -2.00 -2.08 116.42 122.21 2dxc h ASP 26 Ca -0.43 -0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.52 2dxc h ASP 26 Cb 1.30 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.84 2dxc h ASP 26 CO 0.55 0.10 -0.24 -0.26 -1.72 0.00 0.00 179.24 177.66 2dxc h PHE 27 N 0.04 0.71 -0.56 4.55 0.04 -1.99 -2.01 116.94 117.73 2dxc h PHE 27 Ca 0.01 -0.21 -0.09 0.00 2.80 0.00 0.00 57.97 60.48 2dxc h PHE 27 Cb 0.12 -0.15 -0.02 0.00 2.20 0.00 0.00 35.95 38.10 2dxc h PHE 27 CO 0.00 0.92 0.01 0.93 -0.60 0.00 0.00 178.31 179.57 2dxc h GLU 28 N 0.30 0.96 -0.06 1.51 5.08 -1.83 0.49 114.58 121.04 2dxc h GLU 28 Ca 0.04 -0.28 -0.00 0.00 -1.00 0.00 0.00 59.36 58.12 2dxc h GLU 28 Cb 0.80 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.95 2dxc h GLU 28 CO 0.06 0.94 0.03 0.82 -1.00 0.00 0.00 179.01 179.86 2dxc h ILE 29 N 0.89 1.05 -0.36 3.13 2.04 -1.34 -2.38 117.51 120.52 2dxc h ILE 29 Ca 0.17 -0.13 -0.08 0.00 1.00 0.00 0.00 64.86 65.82 2dxc h ILE 29 Cb 0.50 1.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 2dxc h ILE 29 CO 0.02 0.04 -0.10 0.25 0.00 0.00 0.00 178.15 178.37 2dxc h LEU 30 N 0.04 0.61 -0.02 1.44 5.85 -1.15 -1.97 115.31 120.11 2dxc h LEU 30 Ca 0.02 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.58 2dxc h LEU 30 Cb 0.04 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 40.90 2dxc h LEU 30 CO -0.00 0.74 0.01 -0.08 -0.34 0.00 0.00 178.44 178.77 2dxc h GLU 31 N 0.58 0.03 -0.59 1.25 4.22 -0.68 -0.29 114.58 119.09 2dxc h GLU 31 Ca 0.11 -0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.55 2dxc h GLU 31 Cb 0.51 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.73 2dxc h GLU 31 CO 0.03 0.03 0.38 0.52 -2.18 0.00 0.00 179.01 177.79 2dxc h MET 32 N 0.02 0.78 -0.01 1.92 2.86 -1.30 -0.92 114.93 118.28 2dxc h MET 32 Ca 0.01 -0.05 0.01 0.00 -2.06 0.00 0.00 59.70 57.61 2dxc h MET 32 Cb 0.01 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.48 2dxc h MET 32 CO -0.00 0.53 -0.06 0.00 1.06 0.00 0.00 176.91 178.44 2dxc h ALA 33 N 1.21 -0.05 -0.12 6.32 0.00 -1.04 -0.39 119.26 125.20 2dxc h ALA 33 Ca 0.22 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 2dxc h ALA 33 Cb -0.08 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2dxc h ALA 33 CO -0.05 -0.55 0.07 0.28 0.00 0.00 0.00 179.25 179.01 2dxc h VAL 34 N -0.09 1.08 -0.24 0.00 2.07 -0.85 -1.53 116.25 116.69 2dxc h VAL 34 Ca 0.03 -0.21 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 2dxc h VAL 34 Cb 0.13 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 2dxc h VAL 34 CO -0.07 0.07 0.13 -0.09 0.02 0.00 0.00 177.57 177.63 2dxc h ARG 35 N 0.11 0.33 -0.67 1.57 2.43 -1.05 -0.70 114.38 116.39 2dxc h ARG 35 Ca 0.04 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.16 2dxc h ARG 35 Cb 0.05 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.51 2dxc h ARG 35 CO -0.01 0.29 0.36 0.93 -1.51 0.00 0.00 179.97 180.03 2dxc h GLU 36 N 0.28 0.94 -0.44 0.20 5.08 -1.02 -1.94 114.58 117.68 2dxc h GLU 36 Ca 0.08 -0.12 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 2dxc h GLU 36 Cb 0.05 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 2dxc h GLU 36 CO -0.01 0.72 0.14 -0.07 -1.00 0.00 0.00 179.01 178.78 2dxc h LEU 37 N 0.92 0.64 -0.67 1.33 3.38 -1.09 0.65 115.31 120.47 2dxc h LEU 37 Ca 0.24 -0.21 0.01 0.00 0.09 0.00 0.00 57.88 58.01 2dxc h LEU 37 Cb 0.05 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 2dxc h LEU 37 CO -0.04 0.67 0.44 0.00 0.09 0.00 0.00 178.44 179.60 2dxc h ALA 38 N 0.99 0.85 -0.33 1.53 0.00 -0.91 -0.23 119.26 121.16 2dxc h ALA 38 Ca 0.14 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.87 2dxc h ALA 38 Cb 0.27 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 2dxc h ALA 38 CO -0.00 0.25 -0.33 0.82 0.00 0.00 0.00 179.25 179.99 2dxc h ILE 39 N 0.88 1.29 -0.97 0.00 2.04 -1.21 0.53 117.51 120.08 2dxc h ILE 39 Ca 0.25 -1.50 0.04 0.00 1.00 0.00 0.00 64.86 64.65 2dxc h ILE 39 Cb -0.08 1.51 -0.06 0.00 -0.74 0.00 0.00 36.82 37.45 2dxc h ILE 39 CO -0.07 0.49 0.63 -0.08 0.00 0.00 0.00 178.15 179.13 2dxc h GLU 40 N 0.57 1.17 -0.04 2.37 4.81 -0.49 -1.23 114.58 121.74 2dxc h GLU 40 Ca 0.05 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2dxc h GLU 40 Cb 0.91 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 30.03 2dxc h GLU 40 CO 0.08 0.77 0.00 1.63 -0.73 0.00 0.00 179.01 180.77 2dxc n LYS 41 N -4.48 1.43 -1.93 1.92 4.76 -0.13 -4.93 118.16 114.79 2dxc n LYS 41 Ca 0.13 -0.63 -0.09 0.00 -2.87 0.00 0.00 58.31 54.86 2dxc n LYS 41 Cb 0.12 -1.44 -0.01 0.00 -1.84 0.00 0.00 35.03 31.85 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 1.07 0.28 0.22 0.72 0.00 -0.46 -4.93 105.19 102.08 2dxc n GLY 42 Ca 0.19 -0.53 -0.17 0.00 0.00 0.00 0.00 46.02 45.50 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 0.90 -7.41 0.99 3.38 -1.14 -3.46 115.31 108.57 2dxc h LEU 43 Ca -0.21 -0.63 -0.07 0.00 0.09 0.00 0.00 57.88 57.05 2dxc h LEU 43 Cb 1.01 -0.27 -0.16 0.00 0.09 0.00 0.00 40.66 41.34 2dxc h LEU 43 CO 0.26 1.38 -0.12 0.72 0.09 0.00 0.00 178.44 180.78 2dxc s PHE 44 N -3.74 -0.23 0.47 1.13 -0.12 -1.25 -5.05 117.98 109.19 2dxc s PHE 44 Ca -0.11 0.11 -0.03 0.00 -0.05 0.00 0.00 56.93 56.86 2dxc s PHE 44 Cb 0.08 0.21 -0.02 0.00 -0.63 0.00 0.00 43.02 42.66 2dxc s PHE 44 CO 0.89 -0.59 0.73 -1.54 -0.05 0.00 0.00 175.22 174.67 2dxc s SER 45 N -2.19 6.05 0.42 1.98 1.04 -1.26 -4.08 113.70 115.67 2dxc s SER 45 Ca -0.03 0.65 0.10 0.00 0.48 0.00 0.00 55.95 57.14 2dxc s SER 45 Cb -0.00 -1.94 0.90 0.00 0.10 0.00 0.00 66.02 65.07 2dxc s SER 45 CO -0.05 -0.63 2.00 0.00 0.98 0.00 0.00 173.24 175.54 2dxc h ALA 46 N 0.30 1.66 -0.24 5.32 0.00 -1.98 -1.30 119.26 123.02 2dxc h ALA 46 Ca -0.47 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.29 2dxc h ALA 46 Cb 1.23 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 2dxc h ALA 46 CO 0.60 0.26 0.01 1.49 0.00 0.00 0.00 179.25 181.61 2dxc h GLU 47 N 0.28 0.41 -0.62 0.00 4.81 -1.99 -2.12 114.58 115.35 2dxc h GLU 47 Ca 0.07 -0.13 0.12 0.00 -0.13 0.00 0.00 59.36 59.29 2dxc h GLU 47 Cb 0.18 -0.04 -0.09 0.00 0.63 0.00 0.00 28.75 29.43 2dxc h GLU 47 CO 0.00 0.58 0.11 -0.44 -0.73 0.00 0.00 179.01 178.54 2dxc h ASP 48 N 0.19 -0.04 -0.39 1.04 3.32 -1.63 0.22 116.42 119.13 2dxc h ASP 48 Ca 0.07 0.12 -0.02 0.00 0.02 0.00 0.00 57.03 57.22 2dxc h ASP 48 Cb 0.39 0.18 -0.02 0.00 0.22 0.00 0.00 39.33 40.10 2dxc h ASP 48 CO 0.01 -0.02 0.16 -0.74 -1.72 0.00 0.00 179.24 176.94 2dxc h HIS 49 N 0.24 0.58 -0.45 4.55 2.76 -1.26 0.07 115.15 121.63 2dxc h HIS 49 Ca 0.33 -0.04 -0.02 0.00 -2.20 0.00 0.00 60.37 58.44 2dxc h HIS 49 Cb 0.51 -0.18 -0.02 0.00 1.55 0.00 0.00 27.41 29.27 2dxc h HIS 49 CO -0.27 0.51 0.20 0.00 -1.30 0.00 0.00 177.93 177.07 2dxc h ARG 50 N 0.48 0.66 -0.92 5.26 3.08 -0.63 -1.48 114.38 120.82 2dxc h ARG 50 Ca 0.13 -0.11 0.02 0.00 0.07 0.00 0.00 59.98 60.10 2dxc h ARG 50 Cb 0.17 -0.11 -0.05 0.00 0.08 0.00 0.00 29.97 30.06 2dxc h ARG 50 CO -0.01 0.58 0.61 0.28 -1.07 0.00 0.00 179.97 180.35 2dxc h VAL 51 N 0.58 1.20 -0.32 2.04 2.07 -0.34 -0.30 116.25 121.17 2dxc h VAL 51 Ca 0.15 -0.41 -0.10 0.00 0.82 0.00 0.00 66.70 67.15 2dxc h VAL 51 Cb 0.15 -0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 29.79 2dxc h VAL 51 CO -0.02 0.22 -0.21 -0.25 0.02 0.00 0.00 177.57 177.34 2dxc h TRP 52 N 1.21 0.82 -0.63 1.57 2.91 -0.65 -1.46 115.95 119.73 2dxc h TRP 52 Ca 0.35 -0.22 -0.02 0.00 1.13 0.00 0.00 58.89 60.13 2dxc h TRP 52 Cb -0.07 -0.18 -0.03 0.00 -0.51 0.00 0.00 29.16 28.36 2dxc h TRP 52 CO -0.01 0.94 0.30 0.87 -1.03 0.00 0.00 178.44 179.51 2dxc h LYS 53 N 0.47 0.88 -0.47 2.65 1.57 -0.94 -0.43 116.57 120.30 2dxc h LYS 53 Ca 0.06 -0.12 -0.06 0.00 -1.87 0.00 0.00 60.65 58.67 2dxc h LYS 53 Cb 0.75 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.88 2dxc h LYS 53 CO 0.06 0.69 0.06 -0.44 -0.57 0.00 0.00 179.45 179.24 2dxc h ASP 54 N 0.88 0.77 -0.07 0.86 3.32 -0.87 -1.07 116.42 120.24 2dxc h ASP 54 Ca 0.22 -0.27 0.00 0.00 0.02 0.00 0.00 57.03 57.00 2dxc h ASP 54 Cb 0.10 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.44 2dxc h ASP 54 CO -0.03 0.85 0.05 0.22 -1.72 0.00 0.00 179.24 178.61 2dxc h TYR 55 N 0.66 0.10 -0.83 4.55 3.20 -0.68 -2.37 116.97 121.60 2dxc h TYR 55 Ca 0.14 0.00 0.05 0.00 3.14 0.00 0.00 58.73 62.07 2dxc h TYR 55 Cb 0.42 -0.03 -0.05 0.00 1.54 0.00 0.00 36.73 38.61 2dxc h TYR 55 CO 0.03 0.09 0.54 0.28 -1.64 0.00 0.00 178.16 177.46 2dxc h VAL 56 N 0.08 1.08 0.00 1.81 2.07 -0.95 -1.17 116.25 119.16 2dxc h VAL 56 Ca 0.03 -0.33 -0.02 0.00 0.82 0.00 0.00 66.70 67.20 2dxc h VAL 56 Cb 0.02 0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 29.83 2dxc h VAL 56 CO -0.01 0.17 -0.09 -0.74 0.02 0.00 0.00 177.57 176.93 2dxc h HIS 57 N 0.95 0.00 -0.00 1.57 -0.00 -0.69 -1.93 115.15 115.05 2dxc h HIS 57 Ca 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.72 2dxc h HIS 57 Cb 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.57 2dxc h HIS 57 CO -0.00 0.09 -0.32 0.25 -0.00 0.00 0.00 177.93 177.95 2dxc n THR 58 N -3.60 0.00 -2.73 6.26 -2.24 -0.45 -4.91 114.28 106.61 2dxc n THR 58 Ca -0.02 -0.04 -0.33 0.00 -2.27 0.00 0.00 64.05 61.39 2dxc n THR 58 Cb 0.21 0.15 -0.06 0.00 -2.10 0.00 0.00 70.33 68.53 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 -2.80 3.89 0.00 3.22 1.43 -0.73 -5.04 118.68 118.66 2dxc s LEU 59 Ca 0.17 1.71 -0.28 0.00 -1.03 0.00 0.00 54.13 54.71 2dxc s LEU 59 Cb 0.18 -4.54 0.09 0.00 0.03 0.00 0.00 46.19 41.96 2dxc s LEU 59 CO 0.60 -0.45 1.26 0.61 0.23 0.00 0.00 176.35 178.60 2dxc n GLY 60 N -0.68 0.13 0.14 -3.19 0.00 -1.26 -4.75 105.19 95.58 2dxc n GLY 60 Ca 0.07 -1.01 0.14 0.00 0.00 0.00 0.00 46.02 45.23 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 -0.91 0.76 -0.21 1.61 -0.04 -1.05 -3.14 135.00 132.02 2dxc n PRO 61 Ca 0.06 -0.28 -0.04 0.00 -0.04 0.00 0.00 63.50 63.20 2dxc n PRO 61 Cb 0.54 -1.49 0.06 0.00 -0.04 0.00 0.00 33.50 32.56 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 0.69 0.58 -0.65 1.53 3.38 -1.89 -1.60 115.31 117.34 2dxc h LEU 62 Ca 0.00 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 2dxc h LEU 62 Cb 0.36 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 2dxc h LEU 62 CO 0.00 0.40 0.28 -0.65 0.09 0.00 0.00 178.44 178.56 2dxc h PRO 63 N 0.71 0.97 -0.60 1.13 0.11 -1.76 -1.05 132.00 131.51 2dxc h PRO 63 Ca 0.24 -0.17 -0.07 0.00 0.11 0.00 0.00 66.00 66.12 2dxc h PRO 63 Cb 0.04 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 30.97 2dxc h PRO 63 CO -0.11 0.80 0.11 0.00 -0.21 0.00 0.00 178.00 178.59 2dxc h ALA 64 N 1.12 1.07 -0.55 -0.75 0.00 -1.28 -0.87 119.26 118.00 2dxc h ALA 64 Ca 0.22 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 2dxc h ALA 64 Cb 0.18 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2dxc h ALA 64 CO -0.02 0.61 0.01 0.00 0.00 0.00 0.00 179.25 179.84 2dxc h ALA 65 N 1.21 0.97 -0.25 0.00 0.00 -0.94 -2.28 119.26 117.98 2dxc h ALA 65 Ca 0.19 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.69 2dxc h ALA 65 Cb 0.38 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2dxc h ALA 65 CO 0.01 0.63 -0.35 0.00 0.00 0.00 0.00 179.25 179.54 2dxc h ARG 66 N 0.87 0.54 -0.56 0.00 3.08 -0.77 -1.76 114.38 115.78 2dxc h ARG 66 Ca 0.16 -0.25 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 2dxc h ARG 66 Cb 0.50 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.51 2dxc h ARG 66 CO 0.02 0.81 0.35 1.25 -1.07 0.00 0.00 179.97 181.33 2dxc h LEU 67 N 0.46 0.66 -0.21 3.04 6.46 -0.76 0.12 115.31 125.08 2dxc h LEU 67 Ca 0.05 -0.05 -0.02 0.00 -0.12 0.00 0.00 57.88 57.74 2dxc h LEU 67 Cb 0.82 -0.17 -0.01 0.00 -0.73 0.00 0.00 40.66 40.58 2dxc h LEU 67 CO 0.07 0.51 0.05 0.58 -0.62 0.00 0.00 178.44 179.03 2dxc h VAL 68 N 0.75 1.20 -0.52 1.05 2.07 -1.20 -0.92 116.25 118.68 2dxc h VAL 68 Ca 0.20 -0.65 0.01 0.00 0.82 0.00 0.00 66.70 67.09 2dxc h VAL 68 Cb -0.04 1.24 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 2dxc h VAL 68 CO -0.04 0.20 0.33 0.00 0.02 0.00 0.00 177.57 178.08 2dxc h ALA 69 N 0.87 0.67 -0.80 1.67 0.00 -1.06 -0.35 119.26 120.26 2dxc h ALA 69 Ca 0.07 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2dxc h ALA 69 Cb 0.26 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 2dxc h ALA 69 CO 0.00 0.06 0.42 0.87 0.00 0.00 0.00 179.25 180.60 2dxc h LYS 70 N 0.66 1.12 -0.60 0.00 1.57 -0.62 -2.05 116.57 116.67 2dxc h LYS 70 Ca 0.20 -0.14 -0.07 0.00 -1.87 0.00 0.00 60.65 58.77 2dxc h LYS 70 Cb -0.03 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.04 2dxc h LYS 70 CO -0.07 0.84 0.08 0.00 -0.57 0.00 0.00 179.45 179.73 2dxc h ALA 71 N 1.33 0.79 -0.45 3.86 0.00 -0.50 -0.88 119.26 123.41 2dxc h ALA 71 Ca 0.28 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2dxc h ALA 71 Cb 0.06 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2dxc h ALA 71 CO -0.04 0.56 0.25 -1.49 0.00 0.00 0.00 179.25 178.53 2dxc h TRP 72 N 0.90 0.60 -0.01 0.00 6.55 -0.56 -2.73 115.95 120.69 2dxc h TRP 72 Ca 0.18 -0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.02 2dxc h TRP 72 Cb 0.44 -0.20 0.00 0.00 -0.86 0.00 0.00 29.16 28.54 2dxc h TRP 72 CO 0.03 0.42 -0.23 1.28 -1.05 0.00 0.00 178.44 178.89 2dxc n LEU 73 N -4.42 1.57 -3.43 -4.49 4.77 -0.82 -4.75 117.00 105.43 2dxc n LEU 73 Ca 0.04 -0.51 -0.22 0.00 -0.03 0.00 0.00 56.01 55.29 2dxc n LEU 73 Cb 0.09 -0.05 -0.11 0.00 -2.33 0.00 0.00 43.42 41.02 2dxc n LEU 73 CO 0.36 0.28 -0.23 -0.62 -1.33 0.00 0.00 177.39 175.85 2dxc s ASP 74 N -2.33 2.17 0.36 -1.43 -1.08 -0.37 -5.02 116.67 108.97 2dxc s ASP 74 Ca 0.26 -1.33 0.12 0.00 -0.52 0.00 0.00 52.55 51.09 2dxc s ASP 74 Cb 0.19 0.18 0.92 0.00 -1.46 0.00 0.00 42.92 42.76 2dxc s ASP 74 CO 0.47 -0.35 1.81 -0.65 0.52 0.00 0.00 175.17 176.96 2dxc h PRO 75 N 7.78 0.56 -0.26 4.34 0.11 -1.86 0.65 132.00 143.32 2dxc h PRO 75 Ca -0.07 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.00 2dxc h PRO 75 Cb 1.04 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.01 2dxc h PRO 75 CO 0.31 0.37 0.12 0.93 -0.21 0.00 0.00 178.00 179.52 2dxc h GLU 76 N 0.58 0.38 -0.47 1.05 4.39 -1.95 -1.78 114.58 116.78 2dxc h GLU 76 Ca 0.54 -0.06 -0.09 0.00 0.34 0.00 0.00 59.36 60.09 2dxc h GLU 76 Cb 1.08 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.65 2dxc h GLU 76 CO -0.29 0.39 -0.05 -0.92 -1.16 0.00 0.00 179.01 176.99 2dxc h TYR 77 N 0.28 0.89 -0.64 4.33 3.20 -1.43 -2.55 116.97 121.05 2dxc h TYR 77 Ca 0.09 -0.14 0.01 0.00 3.14 0.00 0.00 58.73 61.82 2dxc h TYR 77 Cb 0.15 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.15 2dxc h TYR 77 CO -0.02 0.84 0.42 -0.22 -1.64 0.00 0.00 178.16 177.55 2dxc h LYS 78 N 0.75 0.84 -0.94 1.82 3.64 -0.66 0.17 116.57 122.20 2dxc h LYS 78 Ca 0.14 -0.05 0.02 0.00 -1.27 0.00 0.00 60.65 59.49 2dxc h LYS 78 Cb 0.53 -0.19 -0.05 0.00 -0.41 0.00 0.00 32.23 32.11 2dxc h LYS 78 CO 0.03 0.56 0.62 0.87 -2.27 0.00 0.00 179.45 179.26 2dxc h LYS 79 N 0.87 1.20 -0.41 1.90 1.57 -1.08 -1.74 116.57 118.88 2dxc h LYS 79 Ca 0.23 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.92 2dxc h LYS 79 Cb -0.10 -0.27 -0.02 0.00 0.08 0.00 0.00 32.23 31.92 2dxc h LYS 79 CO -0.05 0.79 0.16 1.25 -0.57 0.00 0.00 179.45 181.03 2dxc h LEU 80 N 1.23 0.58 -0.42 2.94 5.85 -0.92 -1.87 115.31 122.70 2dxc h LEU 80 Ca 0.36 -0.18 0.06 0.00 0.84 0.00 0.00 57.88 58.96 2dxc h LEU 80 Cb -0.08 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 40.75 2dxc h LEU 80 CO -0.09 0.60 0.14 0.00 -0.34 0.00 0.00 178.44 178.74 2dxc h ILE 82 N 0.30 1.24 0.05 0.00 2.04 -1.16 -3.13 117.51 116.85 2dxc h ILE 82 Ca 0.20 -1.08 -0.33 0.00 1.00 0.00 0.00 64.86 64.65 2dxc h ILE 82 Cb 0.20 1.06 -0.04 0.00 -0.74 0.00 0.00 36.82 37.30 2dxc h ILE 82 CO -0.21 0.36 -1.89 1.21 0.00 0.00 0.00 178.15 177.62 2dxc n GLU 83 N -4.19 0.68 -3.33 2.37 4.07 -0.72 -4.71 120.64 114.82 2dxc n GLU 83 Ca 0.01 0.26 -0.25 0.00 -0.06 0.00 0.00 57.16 57.12 2dxc n GLU 83 Cb 0.34 -1.73 -0.09 0.00 -0.06 0.00 0.00 31.44 29.89 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 -3.19 -0.60 -0.29 4.31 -0.08 0.99 -5.00 116.55 112.68 2dxc n ASP 84 Ca -0.25 -2.45 0.06 0.00 -1.51 0.00 0.00 54.79 50.65 2dxc n ASP 84 Cb 1.06 -0.42 0.21 0.00 2.34 0.00 0.00 41.12 44.31 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 5.38 1.35 0.75 0.27 0.00 -1.55 -1.89 103.07 107.39 2dxc h GLY 85 Ca 0.23 -0.26 0.03 0.00 0.00 0.00 0.00 47.33 47.33 2dxc h GLY 85 CO 0.36 -0.01 0.07 -2.08 0.00 0.00 0.00 176.54 174.88 2dxc h VAL 86 N 0.64 0.91 -0.49 4.60 2.07 -1.90 0.26 116.25 122.34 2dxc h VAL 86 Ca 0.45 -0.06 -0.04 0.00 0.82 0.00 0.00 66.70 67.86 2dxc h VAL 86 Cb 0.60 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 2dxc h VAL 86 CO -0.34 0.03 0.14 -0.08 0.02 0.00 0.00 177.57 177.34 2dxc h GLU 87 N 0.18 0.77 -0.75 1.57 4.57 -1.84 -2.86 114.58 116.24 2dxc h GLU 87 Ca 0.12 -0.18 -0.02 0.00 -1.18 0.00 0.00 59.36 58.10 2dxc h GLU 87 Cb 0.10 -0.11 -0.04 0.00 -0.16 0.00 0.00 28.75 28.55 2dxc h GLU 87 CO -0.13 0.74 0.39 0.00 -1.18 0.00 0.00 179.01 178.83 2dxc h ALA 88 N 1.00 1.29 -0.43 2.92 0.00 -1.01 -2.63 119.26 120.40 2dxc h ALA 88 Ca 0.16 -0.12 0.08 0.00 0.00 0.00 0.00 54.91 55.03 2dxc h ALA 88 Cb 0.30 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2dxc h ALA 88 CO -0.00 0.57 0.29 1.03 0.00 0.00 0.00 179.25 181.14 2dxc h SER 89 N 1.05 0.19 -0.12 0.00 0.87 -0.71 -1.63 113.55 113.21 2dxc h SER 89 Ca 0.26 0.00 0.03 0.00 -1.23 0.00 0.00 61.79 60.86 2dxc h SER 89 Cb 0.05 -0.04 -0.00 0.00 -0.44 0.00 0.00 62.40 61.97 2dxc h SER 89 CO -0.04 0.12 0.09 0.11 -0.53 0.00 0.00 176.83 176.58 2dxc h LYS 90 N 0.22 0.00 0.00 2.24 1.57 -1.45 -1.58 116.57 117.57 2dxc h LYS 90 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 2dxc h LYS 90 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.80 2dxc h LYS 90 CO -0.03 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.85 2dxc h ALA 91 N 1.93 1.00 -0.35 3.86 0.00 -1.45 -2.28 119.26 121.97 2dxc h ALA 91 Ca 0.06 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 2dxc h ALA 91 Cb 0.23 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.97 2dxc h ALA 91 CO -0.00 0.00 0.02 1.33 0.00 0.00 0.00 179.25 180.60 2dxc n VAL 92 N -2.82 2.46 -0.99 0.00 0.24 -0.62 -4.95 118.33 111.65 2dxc n VAL 92 Ca -0.00 -2.15 0.00 0.00 -2.04 0.00 0.00 64.34 60.15 2dxc n VAL 92 Cb 0.21 -0.29 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 -0.72 0.49 3.13 7.63 0.00 -0.86 -4.83 105.19 110.03 2dxc n GLY 93 Ca 0.28 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.12 3.38 -0.42 1.61 1.01 -1.06 -5.00 120.40 117.80 2dxc s VAL 94 Ca 0.00 -2.06 -0.19 0.00 0.00 0.00 0.00 61.98 59.73 2dxc s VAL 94 Cb 0.00 -3.31 0.02 0.00 0.00 0.00 0.00 36.38 33.09 2dxc s VAL 94 CO 0.00 -0.71 0.54 0.21 0.00 0.00 0.00 175.10 175.15 2dxc s ASN 95 N 1.87 6.27 0.61 3.32 3.84 -1.26 -3.28 114.94 126.31 2dxc s ASN 95 Ca 0.08 -0.44 0.33 0.00 0.21 0.00 0.00 52.86 53.03 2dxc s ASN 95 Cb -0.23 -2.27 1.88 0.00 -0.55 0.00 0.00 41.25 40.07 2dxc s ASN 95 CO -0.04 -0.67 2.20 -0.50 -2.79 0.00 0.00 177.10 175.30 2dxc h TRP 96 N 8.77 0.00 0.04 0.43 4.06 -1.94 0.13 115.95 127.45 2dxc h TRP 96 Ca -0.26 0.00 -0.33 0.00 2.06 0.00 0.00 58.89 60.36 2dxc h TRP 96 Cb 1.10 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 29.23 2dxc h TRP 96 CO 0.68 0.00 -1.82 0.28 -3.56 0.00 0.00 178.44 174.02 2dxc n VAL 97 N -3.59 1.62 0.74 1.49 0.31 -1.26 -3.70 118.33 113.93 2dxc n VAL 97 Ca -0.01 -0.35 0.10 0.00 -0.01 0.00 0.00 64.34 64.07 2dxc n VAL 97 Cb 0.19 -1.85 -0.13 0.00 -0.91 0.00 0.00 33.84 31.14 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 -3.97 0.00 -0.06 2.52 -2.24 -1.13 -1.83 114.28 107.57 2dxc n THR 98 Ca -0.37 -0.12 -0.14 0.00 -2.27 0.00 0.00 64.05 61.15 2dxc n THR 98 Cb 0.87 0.77 -0.02 0.00 -2.10 0.00 0.00 70.33 69.86 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 0.90 -4.29 3.42 0.02 -1.00 -3.44 113.55 109.15 2dxc h SER 99 Ca 0.00 -0.48 -0.51 0.00 -0.84 0.00 0.00 61.79 59.96 2dxc h SER 99 Cb 0.59 -0.26 0.12 0.00 0.14 0.00 0.00 62.40 63.00 2dxc h SER 99 CO 0.00 1.26 0.33 -2.84 -1.14 0.00 0.00 176.83 174.44 2dxc s PRO 100 N -4.12 2.42 0.62 3.45 0.02 -1.26 -4.92 135.00 131.20 2dxc s PRO 100 Ca -0.10 1.19 0.38 0.00 0.02 0.00 0.00 61.00 62.49 2dxc s PRO 100 Cb 0.10 -1.92 2.05 0.00 0.02 0.00 0.00 34.50 34.76 2dxc s PRO 100 CO 0.88 -1.52 2.26 -1.35 -0.33 0.00 0.00 177.00 176.95 2dxc h PRO 101 N -0.86 0.00 -0.06 5.54 0.11 -1.93 -3.12 132.00 131.68 2dxc h PRO 101 Ca -0.44 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.55 2dxc h PRO 101 Cb 1.23 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 2dxc h PRO 101 CO 0.52 0.02 -0.53 1.79 -0.21 0.00 0.00 178.00 179.59 2dxc h THR 102 N 0.00 1.37 -0.10 -1.15 1.35 -1.90 -3.47 112.91 109.01 2dxc h THR 102 Ca -0.00 -1.81 -0.04 0.00 -0.55 0.00 0.00 66.41 64.01 2dxc h THR 102 Cb 0.11 1.91 -0.02 0.00 -1.73 0.00 0.00 68.15 68.42 2dxc h THR 102 CO 0.00 0.53 -0.04 0.00 -0.25 0.00 0.00 175.52 175.76 2dxc n GLN 103 N -3.92 -0.41 -1.04 4.72 1.13 -1.18 -4.81 117.38 111.88 2dxc n GLN 103 Ca -0.02 0.35 0.01 0.00 -1.94 0.00 0.00 57.00 55.40 2dxc n GLN 103 Cb 0.55 -3.85 -0.00 0.00 0.11 0.00 0.00 30.24 27.05 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 -2.81 0.00 0.00 1.08 1.16 -1.04 -4.74 117.46 111.12 2dxc n PHE 104 Ca -0.02 -0.31 0.00 0.00 -1.87 0.00 0.00 57.45 55.25 2dxc n PHE 104 Cb 0.13 0.03 0.00 0.00 -1.61 0.00 0.00 39.48 38.03 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 0.23 -2.10 3.76 4.97 0.00 -0.76 -4.87 105.19 106.42 2dxc n GLY 105 Ca -0.02 -1.50 -0.37 0.00 0.00 0.00 0.00 46.02 44.13 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 -2.85 2.72 0.36 2.61 -4.23 -1.26 -4.69 115.64 108.29 2dxc s THR 106 Ca 0.00 0.52 0.04 0.00 -1.18 0.00 0.00 61.69 61.07 2dxc s THR 106 Cb 0.00 -3.25 0.23 0.00 1.34 0.00 0.00 72.50 70.82 2dxc s THR 106 CO 0.00 -0.03 1.98 -0.65 -0.54 0.00 0.00 174.62 175.38 2dxc h PRO 107 N 1.61 0.67 0.00 3.99 0.11 -1.95 -2.57 132.00 133.86 2dxc h PRO 107 Ca -0.50 -0.07 -0.14 0.00 0.11 0.00 0.00 66.00 65.40 2dxc h PRO 107 Cb 1.27 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 2dxc h PRO 107 CO 0.58 0.50 -1.67 0.43 -0.21 0.00 0.00 178.00 177.64 2dxc n SER 108 N -4.40 0.51 0.01 -2.05 7.64 -1.26 -4.37 113.62 109.70 2dxc n SER 108 Ca 0.04 0.22 0.11 0.00 1.01 0.00 0.00 58.87 60.25 2dxc n SER 108 Cb 0.11 0.76 -0.05 0.00 -1.01 0.00 0.00 64.21 64.02 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 -2.69 0.62 -0.43 6.43 8.00 -1.22 -4.95 116.55 122.30 2dxc n ASP 109 Ca -0.11 -0.44 0.00 0.00 0.71 0.00 0.00 54.79 54.95 2dxc n ASP 109 Cb 0.80 1.07 0.00 0.00 -0.02 0.00 0.00 41.12 42.97 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 -1.38 -2.55 1.24 4.01 -0.97 -4.57 117.16 111.10 2dxc n TYR 110 Ca 0.02 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.58 2dxc n TYR 110 Cb 0.42 0.22 0.02 0.00 -0.31 0.00 0.00 39.34 39.69 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 -0.32 0.14 -4.74 0.00 5.15 -1.26 -4.94 115.26 109.30 2dxc n ASN 112 Ca 0.25 -2.66 -0.41 0.00 -0.60 0.00 0.00 54.58 51.17 2dxc n ASN 112 Cb 0.75 -0.63 -0.05 0.00 -0.53 0.00 0.00 39.78 39.33 2dxc n ASN 112 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 2dxc s LEU 113 N -1.02 4.53 -0.04 1.20 2.96 -1.26 -2.39 118.68 122.66 2dxc s LEU 113 Ca 0.35 1.91 0.05 0.00 -0.22 0.00 0.00 54.13 56.22 2dxc s LEU 113 Cb 0.15 -3.60 -0.01 0.00 0.50 0.00 0.00 46.19 43.23 2dxc s LEU 113 CO -0.12 -0.07 -0.19 -0.13 -1.32 0.00 0.00 176.35 174.52 2dxc s ARG 114 N -0.35 1.87 -0.23 1.98 0.52 0.10 -3.35 118.95 119.49 2dxc s ARG 114 Ca 0.46 -0.68 -0.09 0.00 -0.52 0.00 0.00 55.73 54.90 2dxc s ARG 114 Cb -0.26 -1.65 -0.04 0.00 0.52 0.00 0.00 34.95 33.52 2dxc s ARG 114 CO 0.32 0.31 0.12 0.08 0.02 0.00 0.00 175.30 176.15 2dxc s VAL 115 N -0.12 5.00 -0.34 3.52 1.01 -1.25 -2.70 120.40 125.52 2dxc s VAL 115 Ca -0.01 0.05 -0.16 0.00 0.00 0.00 0.00 61.98 61.86 2dxc s VAL 115 Cb -0.11 -3.32 -0.01 0.00 0.00 0.00 0.00 36.38 32.94 2dxc s VAL 115 CO 0.02 0.36 0.41 -0.76 0.00 0.00 0.00 175.10 175.13 2dxc s LEU 116 N 1.09 4.38 -0.35 3.92 1.43 -0.47 -4.53 118.68 124.15 2dxc s LEU 116 Ca 0.06 -0.13 -0.20 0.00 -1.03 0.00 0.00 54.13 52.84 2dxc s LEU 116 Cb -0.14 -2.42 0.00 0.00 0.03 0.00 0.00 46.19 43.66 2dxc s LEU 116 CO 0.04 -0.37 0.59 0.00 0.23 0.00 0.00 176.35 176.84 2dxc s ALA 117 N 2.14 3.46 0.86 4.21 0.00 -1.26 -0.15 121.76 131.02 2dxc s ALA 117 Ca 0.14 -0.92 -0.11 0.00 0.00 0.00 0.00 51.96 51.07 2dxc s ALA 117 Cb -0.16 -3.12 0.11 0.00 0.00 0.00 0.00 23.12 19.95 2dxc s ALA 117 CO 0.12 -1.30 1.09 -0.51 0.00 0.00 0.00 175.76 175.16 2dxc s ASP 118 N 1.78 3.83 0.32 0.00 1.01 -0.04 -4.92 116.67 118.65 2dxc s ASP 118 Ca 0.22 1.49 -0.13 0.00 0.71 0.00 0.00 52.55 54.85 2dxc s ASP 118 Cb -0.15 -2.19 0.02 0.00 1.01 0.00 0.00 42.92 41.61 2dxc s ASP 118 CO 0.14 -2.41 0.62 -0.94 0.21 0.00 0.00 175.17 172.79 2dxc s SER 119 N -3.52 0.16 0.04 0.27 1.04 0.72 -4.58 113.70 107.83 2dxc s SER 119 Ca 0.63 -1.08 0.04 0.00 0.48 0.00 0.00 55.95 56.01 2dxc s SER 119 Cb -0.17 0.72 0.19 0.00 0.10 0.00 0.00 66.02 66.85 2dxc s SER 119 CO 0.56 -1.40 1.11 -2.65 0.98 0.00 0.00 173.24 171.85 2dxc n PRO 120 N -0.49 0.02 0.00 4.02 -0.02 -1.26 -1.90 135.00 135.37 2dxc n PRO 120 Ca -0.04 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 2dxc n PRO 120 Cb 0.61 -1.56 0.00 0.00 -0.02 0.00 0.00 33.50 32.53 2dxc n PRO 120 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2dxc n THR 121 N -1.60 0.65 -3.71 3.45 -2.24 -1.26 -4.88 114.28 104.70 2dxc n THR 121 Ca 0.00 -0.69 -0.11 0.00 -2.27 0.00 0.00 64.05 60.98 2dxc n THR 121 Cb 0.02 0.70 -0.11 0.00 -2.10 0.00 0.00 70.33 68.84 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 -0.65 0.06 -0.04 3.22 2.96 -0.80 -1.08 118.68 122.34 2dxc s LEU 122 Ca 0.00 0.83 -0.01 0.00 -0.22 0.00 0.00 54.13 54.74 2dxc s LEU 122 Cb 0.00 1.28 0.03 0.00 0.50 0.00 0.00 46.19 47.99 2dxc s LEU 122 CO 0.00 -0.18 0.01 -0.75 -1.32 0.00 0.00 176.35 174.11 2dxc s LYS 123 N 1.20 0.31 0.15 1.98 2.36 0.32 -0.20 119.74 125.86 2dxc s LYS 123 Ca -0.08 0.15 0.01 0.00 -2.55 0.00 0.00 55.97 53.50 2dxc s LYS 123 Cb -0.08 -0.63 -0.04 0.00 -1.05 0.00 0.00 37.83 36.03 2dxc s LYS 123 CO -0.10 -0.23 0.31 -1.01 1.55 0.00 0.00 175.35 175.88 2dxc s HIS 124 N 1.55 3.49 -0.09 4.03 3.76 -1.26 -0.82 115.29 125.94 2dxc s HIS 124 Ca -0.02 0.24 -0.07 0.00 -0.15 0.00 0.00 55.06 55.05 2dxc s HIS 124 Cb -0.13 -1.76 0.03 0.00 1.11 0.00 0.00 32.58 31.83 2dxc s HIS 124 CO -0.03 0.48 0.23 0.54 -0.85 0.00 0.00 174.74 175.10 2dxc s VAL 125 N -1.75 -0.02 0.11 -0.90 0.11 -0.77 -4.49 120.40 112.70 2dxc s VAL 125 Ca 0.36 0.06 0.06 0.00 -2.93 0.00 0.00 61.98 59.53 2dxc s VAL 125 Cb -0.11 -0.34 -0.04 0.00 -1.53 0.00 0.00 36.38 34.36 2dxc s VAL 125 CO 0.28 0.02 -0.04 -0.69 -3.33 0.00 0.00 175.10 171.35 2dxc s VAL 126 N 0.54 3.70 0.21 2.04 1.01 -0.23 -1.06 120.40 126.62 2dxc s VAL 126 Ca -0.03 -1.19 -0.22 0.00 0.00 0.00 0.00 61.98 60.53 2dxc s VAL 126 Cb -0.05 -2.77 0.05 0.00 0.00 0.00 0.00 36.38 33.61 2dxc s VAL 126 CO -0.03 0.07 0.64 0.54 0.00 0.00 0.00 175.10 176.32 2dxc s VAL 127 N -1.36 0.00 -0.40 2.92 0.11 -0.75 -4.93 120.40 115.99 2dxc s VAL 127 Ca 0.24 -0.44 0.01 0.00 -2.93 0.00 0.00 61.98 58.86 2dxc s VAL 127 Cb -0.11 -1.43 0.12 0.00 -1.53 0.00 0.00 36.38 33.43 2dxc s VAL 127 CO 0.17 -0.01 0.18 0.00 -3.33 0.00 0.00 175.10 172.11 2dxc h THR 129 N 5.71 1.06 0.05 0.00 1.35 -1.86 -3.35 112.91 115.87 2dxc h THR 129 Ca -0.05 -0.24 -0.23 0.00 -0.55 0.00 0.00 66.41 65.34 2dxc h THR 129 Cb 0.96 1.07 -0.01 0.00 -1.73 0.00 0.00 68.15 68.44 2dxc h THR 129 CO 0.49 0.07 -1.06 -0.07 -0.25 0.00 0.00 175.52 174.70 2dxc h LEU 130 N 0.05 0.30 -9.37 3.87 3.38 -1.91 -3.47 115.31 108.17 2dxc h LEU 130 Ca 0.01 -0.29 -0.59 0.00 0.09 0.00 0.00 57.88 57.10 2dxc h LEU 130 Cb 0.11 -0.10 -0.12 0.00 0.09 0.00 0.00 40.66 40.64 2dxc h LEU 130 CO 0.01 1.17 -0.71 -0.94 0.09 0.00 0.00 178.44 178.06 2dxc s SER 132 N -6.99 4.06 0.00 -0.43 1.04 -1.26 -5.21 113.70 104.92 2dxc s SER 132 Ca -0.03 -0.82 0.00 0.00 0.48 0.00 0.00 55.95 55.58 2dxc s SER 132 Cb 0.09 -0.58 0.00 0.00 0.10 0.00 0.00 66.02 65.63 2dxc s SER 132 CO 0.85 0.03 0.00 0.00 0.98 0.00 0.00 173.24 175.10 2dxc n TYR 134 N -0.67 0.00 -1.21 5.02 9.36 -1.26 -4.94 117.16 123.45 2dxc n TYR 134 Ca -0.06 0.00 -0.35 0.00 3.32 0.00 0.00 57.90 60.80 2dxc n TYR 134 Cb 0.59 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 39.27 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 -0.89 3.41 -0.27 2.98 -0.04 -1.26 -4.79 135.00 134.13 2dxc n PRO 135 Ca 0.00 -2.04 0.07 0.00 -0.04 0.00 0.00 63.50 61.48 2dxc n PRO 135 Cb 0.00 -2.72 0.18 0.00 -0.04 0.00 0.00 33.50 30.92 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 5.11 0.10 -0.82 0.54 3.08 -1.94 -0.80 114.38 119.65 2dxc h ARG 136 Ca 0.80 -0.01 0.16 0.00 0.07 0.00 0.00 59.98 61.00 2dxc h ARG 136 Cb 0.31 -0.02 -0.06 0.00 0.08 0.00 0.00 29.97 30.28 2dxc h ARG 136 CO 1.68 0.07 0.54 -1.35 -1.07 0.00 0.00 179.97 179.84 2dxc h PRO 137 N 0.10 0.45 0.00 0.04 0.11 -1.87 -0.16 132.00 130.67 2dxc h PRO 137 Ca 0.44 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.52 2dxc h PRO 137 Cb 0.80 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.81 2dxc h PRO 137 CO -0.70 0.30 -0.93 1.51 -0.21 0.00 0.00 178.00 177.97 2dxc n ILE 138 N -4.50 0.00 0.00 4.15 3.06 -0.91 -4.71 119.36 116.45 2dxc n ILE 138 Ca 0.16 -0.24 0.00 0.00 -2.50 0.00 0.00 62.75 60.17 2dxc n ILE 138 Cb 0.56 0.72 0.00 0.00 0.54 0.00 0.00 39.64 41.46 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 -1.52 0.00 0.00 9.51 7.94 -0.35 -2.65 117.00 129.93 2dxc n LEU 139 Ca 0.01 -0.26 0.00 0.00 -1.11 0.00 0.00 56.01 54.65 2dxc n LEU 139 Cb 0.24 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.19 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 1.68 -1.57 3.84 -3.96 0.00 -0.09 -2.54 105.19 102.55 2dxc n GLY 140 Ca 0.00 -1.86 -0.33 0.00 0.00 0.00 0.00 46.02 43.83 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 4.06 0.52 1.61 -0.21 -1.26 -3.92 119.66 120.46 2dxc s GLN 141 Ca 0.00 0.78 -0.20 0.00 0.02 0.00 0.00 55.36 55.96 2dxc s GLN 141 Cb 0.00 -2.37 -0.07 0.00 1.00 0.00 0.00 33.01 31.57 2dxc s GLN 141 CO 0.00 0.11 1.09 -1.54 -2.12 0.00 0.00 175.29 172.83 2dxc s SER 142 N -2.26 5.95 0.60 5.90 1.04 -1.26 -5.02 113.70 118.66 2dxc s SER 142 Ca 0.56 2.07 -0.17 0.00 0.48 0.00 0.00 55.95 58.89 2dxc s SER 142 Cb -0.10 -2.57 -0.03 0.00 0.10 0.00 0.00 66.02 63.42 2dxc s SER 142 CO 0.16 -1.05 1.11 -2.84 0.98 0.00 0.00 173.24 171.60 2dxc s PRO 143 N -3.30 3.11 0.18 4.02 0.02 -1.26 -4.95 135.00 132.82 2dxc s PRO 143 Ca 0.70 1.46 -0.13 0.00 0.02 0.00 0.00 61.00 63.05 2dxc s PRO 143 Cb -0.21 -1.99 0.14 0.00 0.02 0.00 0.00 34.50 32.46 2dxc s PRO 143 CO 0.25 -1.02 1.79 1.49 -0.33 0.00 0.00 177.00 179.18 2dxc h GLU 144 N 0.59 0.50 0.00 5.54 4.57 -2.01 -2.13 114.58 121.64 2dxc h GLU 144 Ca -0.48 -0.03 -0.04 0.00 -1.18 0.00 0.00 59.36 57.63 2dxc h GLU 144 Cb 1.25 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 29.72 2dxc h GLU 144 CO 0.56 0.33 -0.18 0.11 -1.18 0.00 0.00 179.01 178.65 2dxc h TRP 145 N 0.51 0.00 0.00 0.92 5.08 -1.98 -2.16 115.95 118.32 2dxc h TRP 145 Ca 0.22 0.00 -0.05 0.00 1.08 0.00 0.00 58.89 60.14 2dxc h TRP 145 Cb 0.13 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.28 2dxc h TRP 145 CO -0.10 0.18 -0.25 -0.92 -1.28 0.00 0.00 178.44 176.07 2dxc h TYR 146 N 0.00 0.00 0.00 0.12 3.20 -1.76 -2.42 116.97 116.11 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 0.35 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.62 2dxc h TYR 146 CO 0.00 0.25 -0.36 0.54 -1.64 0.00 0.00 178.16 176.95 2dxc n ARG 147 N -4.21 0.04 -2.08 1.82 1.74 -0.82 -4.70 116.66 108.45 2dxc n ARG 147 Ca -0.02 0.02 -0.40 0.00 -0.77 0.00 0.00 57.85 56.68 2dxc n ARG 147 Cb 0.30 -1.53 -0.01 0.00 -1.02 0.00 0.00 32.46 30.20 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 -3.19 6.42 0.38 0.55 1.04 -0.91 -4.91 113.70 113.09 2dxc s SER 148 Ca 0.11 2.64 0.08 0.00 0.48 0.00 0.00 55.95 59.26 2dxc s SER 148 Cb 0.17 -2.64 0.82 0.00 0.10 0.00 0.00 66.02 64.47 2dxc s SER 148 CO 0.65 -0.77 1.96 -0.65 0.98 0.00 0.00 173.24 175.42 2dxc h PRO 149 N 2.82 0.64 0.19 4.02 0.11 -1.92 -1.97 132.00 135.89 2dxc h PRO 149 Ca -0.49 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.58 2dxc h PRO 149 Cb 1.24 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 2dxc h PRO 149 CO 0.63 0.43 -0.15 -0.97 -0.21 0.00 0.00 178.00 177.73 2dxc h ASN 150 N 0.66 -0.38 -0.67 -2.05 -0.73 -1.92 0.99 115.58 111.48 2dxc h ASN 150 Ca 0.30 0.03 -0.08 0.00 1.87 0.00 0.00 56.30 58.43 2dxc h ASN 150 Cb 0.33 0.12 -0.03 0.00 0.27 0.00 0.00 38.32 39.02 2dxc h ASN 150 CO -0.10 -0.23 0.12 0.22 -0.37 0.00 0.00 177.43 177.07 2dxc h TYR 151 N -0.35 1.17 0.00 0.67 3.20 -1.70 -1.84 116.97 118.11 2dxc h TYR 151 Ca -0.01 -0.15 -0.05 0.00 3.14 0.00 0.00 58.73 61.66 2dxc h TYR 151 Cb 0.31 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 38.25 2dxc h TYR 151 CO -0.11 0.97 -0.24 0.00 -1.64 0.00 0.00 178.16 177.14 2dxc h ARG 152 N 1.04 0.00 0.00 1.82 3.08 -1.15 -2.31 114.38 116.86 2dxc h ARG 152 Ca 0.21 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.20 2dxc h ARG 152 Cb 0.42 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 2dxc h ARG 152 CO 0.01 0.24 -0.30 0.00 -1.07 0.00 0.00 179.97 178.85 2dxc h ARG 153 N 0.00 0.00 0.25 0.04 3.08 -0.50 -3.43 114.38 113.82 2dxc h ARG 153 Ca -0.00 0.00 -0.33 0.00 0.07 0.00 0.00 59.98 59.72 2dxc h ARG 153 Cb 0.62 0.00 0.04 0.00 0.08 0.00 0.00 29.97 30.70 2dxc h ARG 153 CO 0.03 0.99 -1.45 0.00 -1.07 0.00 0.00 179.97 178.47 2dxc h ARG 154 N -1.00 0.53 -0.69 0.04 3.08 -1.35 -3.40 114.38 111.58 2dxc h ARG 154 Ca -0.08 -0.90 0.13 0.00 0.07 0.00 0.00 59.98 59.20 2dxc h ARG 154 Cb 1.06 0.34 -0.09 0.00 0.08 0.00 0.00 29.97 31.35 2dxc h ARG 154 CO -0.05 1.43 0.21 1.25 -1.07 0.00 0.00 179.97 181.75 2dxc h LEU 155 N 0.11 0.13 -1.66 3.04 5.85 -1.65 0.22 115.31 121.34 2dxc h LEU 155 Ca -0.25 0.12 -0.03 0.00 0.84 0.00 0.00 57.88 58.55 2dxc h LEU 155 Cb 2.14 0.13 -0.00 0.00 0.37 0.00 0.00 40.66 43.29 2dxc h LEU 155 CO 0.27 0.05 -0.16 -0.37 -0.34 0.00 0.00 178.44 177.88 2dxc h VAL 156 N 0.35 0.60 0.00 1.05 -1.51 -1.82 -2.63 116.25 112.28 2dxc h VAL 156 Ca 0.38 -0.74 -0.35 0.00 -1.23 0.00 0.00 66.70 64.76 2dxc h VAL 156 Cb 0.58 1.48 -0.06 0.00 -2.13 0.00 0.00 31.29 31.15 2dxc h VAL 156 CO -0.42 0.16 -2.31 -1.14 -1.23 0.00 0.00 177.57 172.63 2dxc n ARG 157 N -3.59 0.75 -2.82 5.19 0.63 -0.65 -4.70 116.66 111.47 2dxc n ARG 157 Ca -0.01 0.08 -0.22 0.00 -0.92 0.00 0.00 57.85 56.77 2dxc n ARG 157 Cb 0.30 -1.47 -0.02 0.00 0.45 0.00 0.00 32.46 31.72 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 -2.99 2.62 -0.31 -0.14 8.01 0.68 -4.92 117.44 120.39 2dxc n TRP 158 Ca -0.37 -3.53 0.02 0.00 -1.31 0.00 0.00 57.50 52.32 2dxc n TRP 158 Cb 1.01 -0.34 0.21 0.00 -2.01 0.00 0.00 31.31 30.17 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 2.88 1.07 -0.54 -0.99 0.13 -1.63 -1.08 132.00 131.84 2dxc h PRO 159 Ca 0.13 -0.06 0.02 0.00 -0.87 0.00 0.00 66.00 65.22 2dxc h PRO 159 Cb 0.82 -0.24 -0.03 0.00 0.13 0.00 0.00 31.00 31.68 2dxc h PRO 159 CO 0.71 0.71 0.34 0.00 -0.23 0.00 0.00 178.00 179.53 2dxc h ARG 160 N 1.10 0.66 -0.23 0.86 2.47 -1.91 -0.15 114.38 117.18 2dxc h ARG 160 Ca 0.37 -0.04 -0.12 0.00 -1.26 0.00 0.00 59.98 58.93 2dxc h ARG 160 Cb 0.08 -0.15 -0.00 0.00 -1.65 0.00 0.00 29.97 28.25 2dxc h ARG 160 CO -0.12 0.43 -0.31 1.96 0.56 0.00 0.00 179.97 182.49 2dxc h GLN 161 N 0.68 0.62 -0.20 0.04 7.50 -1.84 -2.33 115.11 119.56 2dxc h GLN 161 Ca 0.21 -0.35 -0.01 0.00 0.50 0.00 0.00 58.65 58.99 2dxc h GLN 161 Cb -0.02 0.03 -0.01 0.00 0.05 0.00 0.00 27.48 27.53 2dxc h GLN 161 CO -0.08 0.96 0.08 0.28 -1.50 0.00 0.00 178.83 178.58 2dxc h VAL 162 N 0.31 1.16 -0.72 -0.54 2.07 -1.04 -2.05 116.25 115.44 2dxc h VAL 162 Ca 0.03 -0.47 -0.02 0.00 0.82 0.00 0.00 66.70 67.06 2dxc h VAL 162 Cb 0.89 1.10 -0.03 0.00 -1.52 0.00 0.00 31.29 31.72 2dxc h VAL 162 CO 0.07 0.15 0.38 -0.07 0.02 0.00 0.00 177.57 178.13 2dxc h LEU 163 N 0.18 0.89 -0.91 2.57 3.38 -1.08 -1.69 115.31 118.65 2dxc h LEU 163 Ca 0.07 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2dxc h LEU 163 Cb 0.16 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 2dxc h LEU 163 CO -0.01 0.73 0.56 0.00 0.09 0.00 0.00 178.44 179.81 2dxc h ALA 164 N 1.42 1.16 -0.37 1.53 0.00 -1.12 0.18 119.26 122.05 2dxc h ALA 164 Ca 0.25 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.09 2dxc h ALA 164 Cb 0.04 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 2dxc h ALA 164 CO -0.04 0.60 0.25 0.93 0.00 0.00 0.00 179.25 180.98 2dxc h GLU 165 N 1.25 0.45 -0.00 0.00 5.08 -0.60 0.14 114.58 120.90 2dxc h GLU 165 Ca 0.33 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 2dxc h GLU 165 Cb -0.08 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.07 2dxc h GLU 165 CO -0.06 0.30 -0.03 1.19 -1.00 0.00 0.00 179.01 179.41 2dxc n PHE 166 N -4.48 0.00 -0.38 4.33 3.01 -0.23 -4.89 117.46 114.83 2dxc n PHE 166 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.49 2dxc n PHE 166 Cb 0.09 -0.26 0.00 0.00 -0.01 0.00 0.00 39.48 39.30 2dxc n PHE 166 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2dxc n GLY 167 N 1.28 0.79 3.32 1.37 0.00 0.47 -4.94 105.19 107.47 2dxc n GLY 167 Ca 0.14 -0.22 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 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 2.65 -0.00 0.99 2.96 0.45 -4.97 118.68 120.77 2dxc s LEU 168 Ca 0.00 -0.40 0.02 0.00 -0.22 0.00 0.00 54.13 53.53 2dxc s LEU 168 Cb 0.00 -1.61 -0.01 0.00 0.50 0.00 0.00 46.19 45.07 2dxc s LEU 168 CO 0.00 0.10 -0.07 -1.58 -1.32 0.00 0.00 176.35 173.48 2dxc s GLN 169 N 0.74 0.52 0.15 1.98 0.74 -1.26 -2.54 119.66 120.00 2dxc s GLN 169 Ca -0.05 -0.28 0.06 0.00 0.05 0.00 0.00 55.36 55.14 2dxc s GLN 169 Cb -0.15 -0.49 -0.04 0.00 1.10 0.00 0.00 33.01 33.42 2dxc s GLN 169 CO 0.01 0.13 -0.13 -0.51 -0.55 0.00 0.00 175.29 174.24 2dxc s LEU 170 N -0.27 2.47 0.38 3.68 1.02 -1.26 -5.12 118.68 119.59 2dxc s LEU 170 Ca 0.02 -0.91 -0.25 0.00 0.02 0.00 0.00 54.13 53.01 2dxc s LEU 170 Cb -0.03 -0.54 -0.12 0.00 0.02 0.00 0.00 46.19 45.52 2dxc s LEU 170 CO -0.00 -0.19 0.95 -2.65 0.02 0.00 0.00 176.35 174.47 2dxc n PRO 171 N 0.15 1.24 0.22 1.29 -0.02 -1.26 -4.85 135.00 131.77 2dxc n PRO 171 Ca -0.12 0.44 0.12 0.00 -2.02 0.00 0.00 63.50 61.91 2dxc n PRO 171 Cb 0.59 -1.91 0.70 0.00 -0.02 0.00 0.00 33.50 32.85 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 1.56 0.00 1.78 2.55 4.64 -2.04 -1.62 113.55 120.42 2dxc h SER 172 Ca -0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 2dxc h SER 172 Cb 1.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 2dxc h SER 172 CO 0.57 0.00 -0.07 1.05 -0.87 0.00 0.00 176.83 177.51 2dxc h GLU 173 N 0.00 0.00 -6.86 4.77 9.09 -2.01 -3.45 114.58 116.12 2dxc h GLU 173 Ca 0.05 0.00 -0.52 0.00 0.05 0.00 0.00 59.36 58.94 2dxc h GLU 173 Cb 0.20 0.00 0.06 0.00 -1.65 0.00 0.00 28.75 27.35 2dxc h GLU 173 CO -0.00 0.00 0.62 0.08 0.05 0.00 0.00 179.01 179.76 2dxc s VAL 174 N -3.19 2.82 -0.41 -1.06 1.01 -0.61 -4.96 120.40 114.00 2dxc s VAL 174 Ca 0.07 0.81 -0.27 0.00 0.00 0.00 0.00 61.98 62.60 2dxc s VAL 174 Cb 0.07 -3.52 0.02 0.00 0.00 0.00 0.00 36.38 32.96 2dxc s VAL 174 CO 0.66 0.19 0.99 -1.58 0.00 0.00 0.00 175.10 175.36 2dxc s GLN 175 N -1.67 3.76 -0.20 2.72 0.74 -0.24 -4.93 119.66 119.85 2dxc s GLN 175 Ca 0.49 0.53 -0.19 0.00 0.05 0.00 0.00 55.36 56.24 2dxc s GLN 175 Cb -0.39 -3.85 -0.03 0.00 1.10 0.00 0.00 33.01 29.84 2dxc s GLN 175 CO 0.51 -1.11 0.53 0.42 -0.55 0.00 0.00 175.29 175.09 2dxc s ILE 176 N 3.79 5.10 -0.18 -2.34 -1.09 -1.26 -0.52 121.20 124.70 2dxc s ILE 176 Ca 0.41 0.97 -0.01 0.00 -2.23 0.00 0.00 60.65 59.80 2dxc s ILE 176 Cb -0.10 -3.85 0.00 0.00 -1.58 0.00 0.00 42.46 36.93 2dxc s ILE 176 CO 0.23 0.17 -0.14 -0.60 -1.23 0.00 0.00 174.94 173.37 2dxc s ARG 177 N 1.67 3.19 -0.17 2.79 3.52 -0.00 -4.94 118.95 125.00 2dxc s ARG 177 Ca 0.24 -0.74 -0.16 0.00 -0.13 0.00 0.00 55.73 54.95 2dxc s ARG 177 Cb -0.15 -2.70 -0.04 0.00 -1.56 0.00 0.00 34.95 30.49 2dxc s ARG 177 CO 0.10 -0.10 0.38 0.08 -0.81 0.00 0.00 175.30 174.94 2dxc s VAL 178 N 1.10 5.24 -0.25 7.11 1.01 -1.26 -1.84 120.40 131.52 2dxc s VAL 178 Ca 0.00 0.70 -0.08 0.00 0.00 0.00 0.00 61.98 62.61 2dxc s VAL 178 Cb -0.14 -3.71 -0.03 0.00 0.00 0.00 0.00 36.38 32.49 2dxc s VAL 178 CO -0.04 0.32 0.08 0.00 0.00 0.00 0.00 175.10 175.45 2dxc s ALA 179 N 0.83 3.20 -0.44 5.51 0.00 -0.22 -4.97 121.76 125.68 2dxc s ALA 179 Ca 0.20 -1.10 -0.14 0.00 0.00 0.00 0.00 51.96 50.92 2dxc s ALA 179 Cb -0.14 -2.09 0.06 0.00 0.00 0.00 0.00 23.12 20.95 2dxc s ALA 179 CO 0.07 -0.43 0.34 0.34 0.00 0.00 0.00 175.76 176.08 2dxc s ASP 180 N 1.52 6.06 -1.21 0.00 -1.08 -1.26 -1.80 116.67 118.89 2dxc s ASP 180 Ca 0.06 -1.21 -0.20 0.00 -0.52 0.00 0.00 52.55 50.68 2dxc s ASP 180 Cb -0.15 -2.15 0.01 0.00 -1.46 0.00 0.00 42.92 39.18 2dxc s ASP 180 CO 0.04 -0.57 1.78 -0.44 0.52 0.00 0.00 175.17 176.50 2dxc s SER 181 N 2.23 6.16 -0.01 -0.34 0.01 0.30 -4.71 113.70 117.36 2dxc s SER 181 Ca 0.04 -2.01 0.20 0.00 1.31 0.00 0.00 55.95 55.48 2dxc s SER 181 Cb -0.22 -2.58 -0.24 0.00 0.21 0.00 0.00 66.02 63.19 2dxc s SER 181 CO 0.07 -1.87 0.74 -0.46 0.41 0.00 0.00 173.24 172.13 2dxc n ASN 182 N 10.57 0.79 0.00 2.44 6.94 -1.26 -4.67 115.26 130.07 2dxc n ASN 182 Ca 0.46 -0.73 0.00 0.00 -0.02 0.00 0.00 54.58 54.29 2dxc n ASN 182 Cb 0.47 1.22 0.00 0.00 -2.36 0.00 0.00 39.78 39.11 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 -1.64 1.67 0.00 -3.83 1.13 -1.26 -5.02 117.38 108.42 2dxc n GLN 183 Ca 0.02 0.00 0.14 0.00 -1.94 0.00 0.00 57.00 55.22 2dxc n GLN 183 Cb 0.36 0.00 0.54 0.00 0.11 0.00 0.00 30.24 31.25 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 1.06 -3.15 -1.09 5.02 -1.26 -4.88 118.16 113.86 2dxc n LYS 184 Ca 0.00 -0.52 -0.37 0.00 -2.02 0.00 0.00 58.31 55.40 2dxc n LYS 184 Cb 0.00 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.46 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 -2.30 4.60 0.05 -0.18 2.01 -1.26 -4.27 115.64 114.29 2dxc s THR 185 Ca 0.32 1.28 0.08 0.00 0.31 0.00 0.00 61.69 63.68 2dxc s THR 185 Cb 0.20 -3.90 -0.03 0.00 0.01 0.00 0.00 72.50 68.79 2dxc s THR 185 CO 0.44 0.33 -0.22 -0.13 -0.69 0.00 0.00 174.62 174.35 2dxc s ARG 186 N -1.67 1.46 0.19 4.92 1.81 -1.01 -4.71 118.95 119.95 2dxc s ARG 186 Ca 0.38 -0.99 0.10 0.00 -1.72 0.00 0.00 55.73 53.50 2dxc s ARG 186 Cb -0.18 -1.60 -0.04 0.00 -0.45 0.00 0.00 34.95 32.67 2dxc s ARG 186 CO 0.21 0.41 -0.20 0.71 -0.68 0.00 0.00 175.30 175.75 2dxc s TYR 187 N -0.82 2.04 0.01 -0.53 2.02 -1.26 -0.72 117.35 118.09 2dxc s TYR 187 Ca 0.08 -0.42 0.02 0.00 -0.37 0.00 0.00 57.07 56.38 2dxc s TYR 187 Cb -0.09 -0.99 -0.01 0.00 -0.40 0.00 0.00 41.96 40.46 2dxc s TYR 187 CO 0.02 0.44 -0.05 0.96 -1.57 0.00 0.00 175.55 175.35 2dxc s ILE 188 N -2.01 0.39 -0.14 2.71 -4.36 -1.10 -4.56 121.20 112.12 2dxc s ILE 188 Ca 0.20 -0.47 -0.13 0.00 -0.26 0.00 0.00 60.65 59.98 2dxc s ILE 188 Cb -0.06 -0.38 -0.05 0.00 1.25 0.00 0.00 42.46 43.22 2dxc s ILE 188 CO 0.09 -0.07 0.30 -0.69 0.24 0.00 0.00 174.94 174.81 2dxc s VAL 189 N -0.53 5.29 -0.58 8.37 1.01 0.07 -1.37 120.40 132.66 2dxc s VAL 189 Ca -0.03 0.56 -0.12 0.00 0.00 0.00 0.00 61.98 62.39 2dxc s VAL 189 Cb -0.04 -3.63 0.15 0.00 0.00 0.00 0.00 36.38 32.86 2dxc s VAL 189 CO -0.00 0.42 0.50 -0.32 0.00 0.00 0.00 175.10 175.70 2dxc s MET 190 N 0.21 2.91 0.80 2.72 1.75 0.79 -4.44 119.30 124.04 2dxc s MET 190 Ca 0.17 -1.93 -0.11 0.00 -1.25 0.00 0.00 55.69 52.57 2dxc s MET 190 Cb -0.13 -4.16 0.07 0.00 2.84 0.00 0.00 34.83 33.44 2dxc s MET 190 CO 0.05 -1.27 1.09 -1.25 -0.65 0.00 0.00 175.02 172.99 2dxc s PRO 191 N 1.13 2.07 0.50 4.11 0.04 -1.26 -0.86 135.00 140.72 2dxc s PRO 191 Ca 0.08 0.83 -0.21 0.00 0.04 0.00 0.00 61.00 61.73 2dxc s PRO 191 Cb -0.24 -1.90 -0.07 0.00 0.04 0.00 0.00 34.50 32.33 2dxc s PRO 191 CO -0.01 -1.68 1.12 0.14 0.04 0.00 0.00 177.00 176.61 2dxc s VAL 192 N -3.04 3.29 0.09 -0.36 -7.23 -1.26 -4.79 120.40 107.09 2dxc s VAL 192 Ca 0.61 0.86 -0.31 0.00 -1.81 0.00 0.00 61.98 61.33 2dxc s VAL 192 Cb -0.16 -3.39 -0.08 0.00 0.56 0.00 0.00 36.38 33.32 2dxc s VAL 192 CO 0.55 -0.11 1.53 -0.60 -0.31 0.00 0.00 175.10 176.17 2dxc s ARG 193 N -3.03 4.24 0.62 4.82 3.52 -1.26 -4.82 118.95 123.04 2dxc s ARG 193 Ca 0.68 2.22 -0.14 0.00 -0.13 0.00 0.00 55.73 58.36 2dxc s ARG 193 Cb -0.24 -3.42 -0.02 0.00 -1.56 0.00 0.00 34.95 29.70 2dxc s ARG 193 CO 0.28 -0.62 1.06 -1.25 -0.81 0.00 0.00 175.30 173.96 2dxc s PRO 194 N 1.95 3.20 0.76 5.12 0.04 -1.26 -5.03 135.00 139.77 2dxc s PRO 194 Ca 0.69 1.14 -0.12 0.00 0.04 0.00 0.00 61.00 62.75 2dxc s PRO 194 Cb -0.39 -2.02 0.05 0.00 0.04 0.00 0.00 34.50 32.19 2dxc s PRO 194 CO 0.31 -0.90 1.12 -2.00 0.04 0.00 0.00 177.00 175.56 2dxc s GLU 195 N -4.33 2.17 0.00 4.56 2.56 -1.26 -3.89 118.70 118.51 2dxc s GLU 195 Ca 0.62 1.37 0.00 0.00 0.00 0.00 0.00 54.97 56.97 2dxc s GLU 195 Cb -0.16 -1.87 0.00 0.00 2.00 0.00 0.00 34.13 34.10 2dxc s GLU 195 CO 0.42 -1.73 0.00 0.41 -0.56 0.00 0.00 175.26 173.79 2dxc n GLY 196 N -0.56 0.50 0.41 -1.50 0.00 -1.26 -4.74 105.19 98.04 2dxc n GLY 196 Ca 0.10 -0.90 0.06 0.00 0.00 0.00 0.00 46.02 45.28 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 -2.95 1.26 -1.66 2.61 -2.24 -1.25 -4.92 114.28 105.14 2dxc n THR 197 Ca 0.00 -1.71 -0.48 0.00 -2.27 0.00 0.00 64.05 59.58 2dxc n THR 197 Cb 0.06 0.08 -0.05 0.00 -2.10 0.00 0.00 70.33 68.32 2dxc n THR 197 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2dxc n ASP 198 N -0.82 2.84 0.00 3.42 5.75 -1.26 -1.39 116.55 125.09 2dxc n ASP 198 Ca 0.11 1.07 0.00 0.00 -0.01 0.00 0.00 54.79 55.96 2dxc n ASP 198 Cb 0.71 -1.35 0.00 0.00 -1.03 0.00 0.00 41.12 39.45 2dxc n ASP 198 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2dxc n GLY 199 N 3.50 0.44 3.76 6.12 0.00 -1.26 -4.99 105.19 112.77 2dxc n GLY 199 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.19 2.47 0.81 1.61 0.52 -0.49 -5.01 118.94 116.66 2dxc s TRP 200 Ca 0.00 1.42 -0.12 0.00 0.02 0.00 0.00 56.10 57.42 2dxc s TRP 200 Cb 0.00 -3.68 0.08 0.00 -1.15 0.00 0.00 33.47 28.72 2dxc s TRP 200 CO 0.00 -2.48 1.18 0.95 0.02 0.00 0.00 176.95 176.62 2dxc s THR 201 N -1.37 2.04 0.21 2.01 -4.23 -1.26 -4.85 115.64 108.18 2dxc s THR 201 Ca 0.69 0.01 -0.10 0.00 -1.18 0.00 0.00 61.69 61.11 2dxc s THR 201 Cb -0.37 -3.00 0.14 0.00 1.34 0.00 0.00 72.50 70.61 2dxc s THR 201 CO 0.44 -0.02 1.85 -0.08 -0.54 0.00 0.00 174.62 176.27 2dxc h GLU 202 N -1.07 0.84 -0.76 3.99 4.81 -1.95 -1.49 114.58 118.96 2dxc h GLU 202 Ca -0.46 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 58.73 2dxc h GLU 202 Cb 1.33 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 30.48 2dxc h GLU 202 CO 0.66 0.55 0.50 -0.44 -0.73 0.00 0.00 179.01 179.55 2dxc h ASP 203 N 0.86 0.86 -0.49 1.04 3.32 -1.99 -0.25 116.42 119.78 2dxc h ASP 203 Ca 0.28 -0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.25 2dxc h ASP 203 Cb 0.01 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.33 2dxc h ASP 203 CO -0.10 0.63 0.08 1.56 -1.72 0.00 0.00 179.24 179.68 2dxc h GLN 204 N 1.02 0.81 -0.43 3.56 4.20 -1.80 -2.33 115.11 120.14 2dxc h GLN 204 Ca 0.28 -0.22 -0.15 0.00 0.06 0.00 0.00 58.65 58.62 2dxc h GLN 204 Cb -0.11 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.56 2dxc h GLN 204 CO -0.06 0.81 -0.30 -0.07 -0.67 0.00 0.00 178.83 178.54 2dxc h LEU 205 N 0.69 1.02 -1.28 1.46 3.38 -1.02 -3.07 115.31 116.48 2dxc h LEU 205 Ca 0.15 -0.43 -0.07 0.00 0.09 0.00 0.00 57.88 57.62 2dxc h LEU 205 Cb 0.39 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 2dxc h LEU 205 CO 0.01 1.23 -0.29 0.00 0.09 0.00 0.00 178.44 179.48 2dxc h ALA 206 N 0.82 1.40 0.00 1.53 0.00 -1.01 -2.90 119.26 119.10 2dxc h ALA 206 Ca 0.09 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 2dxc h ALA 206 Cb 0.89 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 2dxc h ALA 206 CO 0.08 0.43 -0.06 1.49 0.00 0.00 0.00 179.25 181.20 2dxc h GLU 207 N 0.11 0.00 -0.10 0.00 4.81 -1.31 -2.28 114.58 115.81 2dxc h GLU 207 Ca 0.02 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 2dxc h GLU 207 Cb 0.57 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.95 2dxc h GLU 207 CO 0.04 0.06 0.00 0.44 -0.73 0.00 0.00 179.01 178.82 2dxc n ILE 208 N -3.96 0.10 -3.15 2.32 -5.35 -1.10 -4.47 119.36 103.75 2dxc n ILE 208 Ca -0.03 -0.53 -0.46 0.00 -0.27 0.00 0.00 62.75 61.47 2dxc n ILE 208 Cb 0.14 1.31 -0.02 0.00 -1.74 0.00 0.00 39.64 39.33 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 -1.90 5.27 0.83 7.28 1.01 -0.86 -4.23 120.40 127.79 2dxc s VAL 209 Ca 0.31 -2.19 -0.12 0.00 0.00 0.00 0.00 61.98 59.97 2dxc s VAL 209 Cb 0.21 -4.62 0.10 0.00 0.00 0.00 0.00 36.38 32.06 2dxc s VAL 209 CO 0.31 -1.26 1.20 0.42 0.00 0.00 0.00 175.10 175.77 2dxc s THR 210 N 1.13 2.01 0.21 3.92 -4.23 -1.26 -4.65 115.64 112.76 2dxc s THR 210 Ca 0.26 -0.01 -0.10 0.00 -1.18 0.00 0.00 61.69 60.66 2dxc s THR 210 Cb -0.08 -3.00 0.13 0.00 1.34 0.00 0.00 72.50 70.90 2dxc s THR 210 CO -0.09 0.00 1.80 -0.09 -0.54 0.00 0.00 174.62 175.70 2dxc h ARG 211 N -1.14 0.61 -0.26 3.99 2.43 -1.95 -1.41 114.38 116.65 2dxc h ARG 211 Ca -0.46 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 58.66 2dxc h ARG 211 Cb 1.31 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.71 2dxc h ARG 211 CO 0.61 0.40 0.10 -0.44 -1.51 0.00 0.00 179.97 179.14 2dxc h ASP 212 N 0.63 0.31 0.02 -3.80 3.32 -1.94 -1.37 116.42 113.58 2dxc h ASP 212 Ca 0.29 -0.02 -0.13 0.00 0.02 0.00 0.00 57.03 57.19 2dxc h ASP 212 Cb 0.20 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 2dxc h ASP 212 CO -0.19 0.29 -0.41 0.00 -1.72 0.00 0.00 179.24 177.21 2dxc h LEU 214 N 0.41 0.00 0.05 0.00 3.38 -0.70 -2.89 115.31 115.56 2dxc h LEU 214 Ca 0.04 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.68 2dxc h LEU 214 Cb 0.89 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.60 2dxc h LEU 214 CO 0.08 0.00 -1.89 -0.38 0.09 0.00 0.00 178.44 176.33 2dxc n ILE 215 N -2.71 1.67 0.00 1.22 2.08 -0.74 -0.76 119.36 120.12 2dxc n ILE 215 Ca 0.03 -0.73 0.00 0.00 0.56 0.00 0.00 62.75 62.61 2dxc n ILE 215 Cb 0.38 -1.31 0.00 0.00 -0.75 0.00 0.00 39.64 37.96 2dxc n ILE 215 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2dxc n GLY 216 N 1.77 0.88 0.42 7.39 0.00 -0.13 -1.07 105.19 114.45 2dxc n GLY 216 Ca -0.25 0.00 0.14 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.97 0.03 -3.84 1.61 0.24 -0.84 -4.63 118.33 109.92 2dxc n VAL 217 Ca 0.00 -0.23 -0.10 0.00 -2.04 0.00 0.00 64.34 61.98 2dxc n VAL 217 Cb 0.00 0.34 -0.06 0.00 -1.47 0.00 0.00 33.84 32.65 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 -1.97 -0.41 0.09 2.33 0.00 -1.18 -4.62 121.76 116.00 2dxc s ALA 218 Ca 0.38 -0.56 0.09 0.00 0.00 0.00 0.00 51.96 51.87 2dxc s ALA 218 Cb 0.20 0.79 -0.03 0.00 0.00 0.00 0.00 23.12 24.08 2dxc s ALA 218 CO 0.33 -0.67 -0.24 0.14 0.00 0.00 0.00 175.76 175.32 2dxc s VAL 219 N -3.91 1.97 0.37 0.00 -7.23 -1.26 -4.14 120.40 106.20 2dxc s VAL 219 Ca 0.11 -1.50 -0.28 0.00 -1.81 0.00 0.00 61.98 58.50 2dxc s VAL 219 Cb 0.02 -1.73 -0.11 0.00 0.56 0.00 0.00 36.38 35.12 2dxc s VAL 219 CO -0.04 0.14 1.43 -2.16 -0.31 0.00 0.00 175.10 174.16 2dxc s PRO 220 N -1.65 4.16 -0.02 4.82 0.04 -1.26 -4.97 135.00 136.12 2dxc s PRO 220 Ca 0.10 2.46 -0.01 0.00 0.04 0.00 0.00 61.00 63.59 2dxc s PRO 220 Cb -0.10 -2.98 0.02 0.00 0.04 0.00 0.00 34.50 31.48 2dxc s PRO 220 CO 0.04 -0.45 0.05 0.15 0.04 0.00 0.00 177.00 176.83 2dxc s LYS 221 N -2.03 0.01 0.25 4.56 1.02 -1.26 -4.66 119.74 117.64 2dxc s LYS 221 Ca 0.52 0.16 -0.31 0.00 0.02 0.00 0.00 55.97 56.36 2dxc s LYS 221 Cb -0.44 -0.14 -0.13 0.00 -0.52 0.00 0.00 37.83 36.60 2dxc s LYS 221 CO 0.60 -0.10 1.46 -2.30 -0.92 0.00 0.00 175.35 174.08 2dxc n PRO 222 N 3.75 2.21 0.00 -1.68 -0.02 -1.26 -1.45 135.00 136.56 2dxc n PRO 222 Ca -0.22 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 2dxc n PRO 222 Cb 0.54 -2.48 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 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 2.19 2.74 3.43 -1.23 0.00 -1.26 -5.00 105.19 106.05 2dxc n GLY 223 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.19 4.86 -0.19 -0.61 1.09 -0.53 -4.92 121.20 118.71 2dxc s ILE 224 Ca 0.00 -0.64 0.06 0.00 -1.10 0.00 0.00 60.65 58.96 2dxc s ILE 224 Cb 0.00 -3.64 0.13 0.00 -1.06 0.00 0.00 42.46 37.88 2dxc s ILE 224 CO 0.00 -0.17 1.09 0.35 -0.10 0.00 0.00 174.94 176.11 2dxc n THR 225 N 5.05 1.21 -3.95 2.92 -2.24 -1.26 -4.42 114.28 111.59 2dxc n THR 225 Ca -0.12 -1.25 -0.09 0.00 -2.27 0.00 0.00 64.05 60.32 2dxc n THR 225 Cb 0.47 0.34 -0.10 0.00 -2.10 0.00 0.00 70.33 68.95 2dxc n THR 225 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2dxc s VAL 226 N -1.39 0.13 0.71 2.28 -7.23 -1.26 -4.91 120.40 108.72 2dxc s VAL 226 Ca 0.11 -1.06 -0.16 0.00 -1.81 0.00 0.00 61.98 59.06 2dxc s VAL 226 Cb 0.08 -0.70 0.02 0.00 0.56 0.00 0.00 36.38 36.34 2dxc s VAL 226 CO 0.04 -0.58 1.14 0.59 -0.31 0.00 0.00 175.10 175.97 2dxc n ASN 227 N 1.05 1.18 -4.72 4.85 3.02 -1.26 -4.87 115.26 114.51 2dxc n ASN 227 Ca -0.20 0.71 -0.42 0.00 -0.03 0.00 0.00 54.58 54.63 2dxc n ASN 227 Cb 0.57 -1.48 -0.01 0.00 -0.61 0.00 0.00 39.78 38.25 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 -2.48 1.89 -1.89 5.41 0.00 -1.26 -4.90 120.51 117.28 2dxc n ALA 228 Ca 0.14 0.37 -0.41 0.00 0.00 0.00 0.00 53.44 53.54 2dxc n ALA 228 Cb 0.49 -2.36 -0.02 0.00 0.00 0.00 0.00 19.45 17.55 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 -1.13 4.32 0.17 0.00 2.20 -1.26 -5.01 119.74 119.02 2dxc s LYS 229 Ca 0.61 2.21 -0.10 0.00 -0.36 0.00 0.00 55.97 58.33 2dxc s LYS 229 Cb -0.54 -3.12 -0.01 0.00 -1.51 0.00 0.00 37.83 32.65 2dxc s LYS 229 CO 0.55 -0.32 0.32 -0.98 -0.36 0.00 0.00 175.35 174.56 2dxc s ARG 230 N -0.61 1.20 0.40 4.03 1.70 -1.26 -5.14 118.95 119.27 2dxc s ARG 230 Ca 0.56 -1.15 -0.25 0.00 -0.47 0.00 0.00 55.73 54.42 2dxc s ARG 230 Cb -0.40 0.39 -0.11 0.00 -0.57 0.00 0.00 34.95 34.26 2dxc s ARG 230 CO 0.44 -0.45 0.99 -2.30 -1.08 0.00 0.00 175.30 172.90 2dxc n PRO 231 N -0.24 1.33 -4.08 3.89 -0.02 -1.26 -4.99 135.00 129.63 2dxc n PRO 231 Ca -0.07 0.47 -0.32 0.00 -2.02 0.00 0.00 63.50 61.56 2dxc n PRO 231 Cb 0.63 -1.99 -0.16 0.00 -0.02 0.00 0.00 33.50 31.96 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 -1.25 2.02 -0.21 -1.45 1.01 -1.26 -5.09 120.40 114.17 2dxc s VAL 232 Ca 0.62 -1.15 -0.25 0.00 0.00 0.00 0.00 61.98 61.20 2dxc s VAL 232 Cb -0.58 -1.95 -0.01 0.00 0.00 0.00 0.00 36.38 33.84 2dxc s VAL 232 CO 0.57 0.31 0.86 -0.22 0.00 0.00 0.00 175.10 176.63 2dxc s LEU 233 N 1.25 4.13 0.41 3.92 2.96 -1.26 -5.02 118.68 125.06 2dxc s LEU 233 Ca -0.00 1.14 -0.23 0.00 -0.22 0.00 0.00 54.13 54.82 2dxc s LEU 233 Cb -0.16 -3.25 -0.09 0.00 0.50 0.00 0.00 46.19 43.19 2dxc s LEU 233 CO -0.10 -0.48 1.02 -0.54 -1.32 0.00 0.00 176.35 174.94 2dxc s LYS 234 N 2.56 4.15 0.37 1.98 1.02 -1.26 -5.05 119.74 123.52 2dxc s LYS 234 Ca 0.38 1.42 -0.08 0.00 0.02 0.00 0.00 55.97 57.71 2dxc s LYS 234 Cb -0.16 -2.45 -0.06 0.00 -0.52 0.00 0.00 37.83 34.65 2dxc s LYS 234 CO 0.10 -0.13 0.70 0.00 -0.92 0.00 0.00 175.35 175.09 2dxc s ALA 235 N -1.77 3.45 0.20 5.17 0.00 -1.26 -4.99 121.76 122.56 2dxc s ALA 235 Ca 0.59 -0.37 -0.06 0.00 0.00 0.00 0.00 51.96 52.12 2dxc s ALA 235 Cb -0.19 -2.55 0.14 0.00 0.00 0.00 0.00 23.12 20.52 2dxc s ALA 235 CO 0.24 0.04 1.62 -0.97 0.00 0.00 0.00 175.76 176.69 2dxc h ASN 236 N 1.27 0.89 -1.99 0.00 -1.24 -2.04 -3.38 115.58 109.09 2dxc h ASN 236 Ca -0.47 -0.30 -0.44 0.00 0.71 0.00 0.00 56.30 55.79 2dxc h ASN 236 Cb 1.19 -0.24 -0.32 0.00 0.73 0.00 0.00 38.32 39.68 2dxc h ASN 236 CO 0.64 1.04 -0.79 -0.60 -1.29 0.00 0.00 177.43 176.43 2dxc s ARG 237 N -4.72 0.85 0.66 6.67 3.52 -1.26 -5.15 118.95 119.52 2dxc s ARG 237 Ca -0.10 -1.52 -0.17 0.00 -0.13 0.00 0.00 55.73 53.81 2dxc s ARG 237 Cb 0.13 -0.95 -0.00 0.00 -1.56 0.00 0.00 34.95 32.57 2dxc s ARG 237 CO 0.85 -1.32 1.19 -1.25 -0.81 0.00 0.00 175.30 173.96 2dxc s PRO 238 N 0.65 2.63 0.00 5.12 0.04 -1.26 -5.25 135.00 136.93 2dxc s PRO 238 Ca 0.27 1.71 0.00 0.00 0.04 0.00 0.00 61.00 63.02 2dxc s PRO 238 Cb -0.04 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.60 2dxc s PRO 238 CO -0.11 -1.44 0.40 0.28 0.04 0.00 0.00 177.00 176.17