#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dxb s VAL 24 N 0.00 5.31 0.71 6.31 1.01 -1.26 -5.09 120.40 127.39 2dxb s VAL 24 Ca 0.00 0.53 -0.06 0.00 0.00 0.00 0.00 61.98 62.45 2dxb s VAL 24 Cb 0.00 -3.62 0.06 0.00 0.00 0.00 0.00 36.38 32.82 2dxb s VAL 24 CO 0.00 0.40 1.01 -0.94 0.00 0.00 0.00 175.10 175.57 2dxb s SER 25 N 0.43 4.79 0.46 3.32 1.04 -1.26 -4.94 113.70 117.54 2dxb s SER 25 Ca 0.16 0.43 0.17 0.00 0.48 0.00 0.00 55.95 57.19 2dxb s SER 25 Cb -0.13 -1.07 1.08 0.00 0.10 0.00 0.00 66.02 66.00 2dxb s SER 25 CO 0.04 -1.61 2.00 0.44 0.98 0.00 0.00 173.24 175.08 2dxb h ASP 26 N -0.60 0.00 -0.23 7.02 3.32 -1.99 -2.31 116.42 121.64 2dxb h ASP 26 Ca -0.44 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.53 2dxb h ASP 26 Cb 1.31 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.86 2dxb h ASP 26 CO 0.59 0.19 -0.18 -0.26 -1.72 0.00 0.00 179.24 177.86 2dxb h PHE 27 N 0.00 0.62 -0.27 4.55 0.04 -1.99 -1.70 116.94 118.19 2dxb h PHE 27 Ca -0.00 -0.18 -0.09 0.00 2.80 0.00 0.00 57.97 60.51 2dxb h PHE 27 Cb 0.36 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.36 2dxb h PHE 27 CO 0.00 0.84 -0.20 0.93 -0.60 0.00 0.00 178.31 179.28 2dxb h GLU 28 N 0.22 0.48 -0.26 1.51 5.08 -1.87 0.96 114.58 120.70 2dxb h GLU 28 Ca 0.04 -0.17 -0.05 0.00 -1.00 0.00 0.00 59.36 58.18 2dxb h GLU 28 Cb 0.72 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 2dxb h GLU 28 CO 0.05 0.67 -0.05 0.82 -1.00 0.00 0.00 179.01 179.49 2dxb h ILE 29 N 0.44 1.28 -0.27 3.13 2.04 -1.37 -2.24 117.51 120.51 2dxb h ILE 29 Ca 0.07 -1.04 -0.12 0.00 1.00 0.00 0.00 64.86 64.77 2dxb h ILE 29 Cb 0.60 1.43 -0.01 0.00 -0.74 0.00 0.00 36.82 38.10 2dxb h ILE 29 CO 0.04 0.33 -0.32 0.25 0.00 0.00 0.00 178.15 178.45 2dxb h LEU 30 N 0.25 0.59 -0.34 1.44 5.85 -1.06 -2.24 115.31 119.80 2dxb h LEU 30 Ca 0.07 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.55 2dxb h LEU 30 Cb 0.51 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 2dxb h LEU 30 CO 0.02 0.87 0.18 -0.08 -0.34 0.00 0.00 178.44 179.10 2dxb h GLU 31 N 0.49 0.47 -0.53 1.25 4.22 -0.70 -0.43 114.58 119.35 2dxb h GLU 31 Ca 0.06 -0.06 -0.00 0.00 0.08 0.00 0.00 59.36 59.44 2dxb h GLU 31 Cb 0.79 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.92 2dxb h GLU 31 CO 0.06 0.39 0.31 0.52 -2.18 0.00 0.00 179.01 178.12 2dxb h MET 32 N 0.42 0.72 0.19 1.92 2.86 -1.29 -1.28 114.93 118.47 2dxb h MET 32 Ca 0.12 -0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 57.68 2dxb h MET 32 Cb 0.06 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 31.57 2dxb h MET 32 CO -0.02 0.53 -0.12 0.00 1.06 0.00 0.00 176.91 178.36 2dxb h ALA 33 N 1.15 -0.30 0.02 6.32 0.00 -1.06 -0.46 119.26 124.94 2dxb h ALA 33 Ca 0.19 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2dxb h ALA 33 Cb 0.01 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 2dxb h ALA 33 CO -0.03 -0.68 -0.02 0.28 0.00 0.00 0.00 179.25 178.80 2dxb h VAL 34 N -0.31 0.95 -0.12 0.00 2.07 -0.98 -0.75 116.25 117.10 2dxb h VAL 34 Ca -0.02 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.52 2dxb h VAL 34 Cb 0.26 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 2dxb h VAL 34 CO 0.01 0.00 0.04 -0.09 0.02 0.00 0.00 177.57 177.55 2dxb h ARG 35 N -0.05 0.10 -0.82 1.57 2.43 -1.17 0.26 114.38 116.70 2dxb h ARG 35 Ca 0.00 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.13 2dxb h ARG 35 Cb 0.05 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.54 2dxb h ARG 35 CO -0.01 0.06 0.36 0.93 -1.51 0.00 0.00 179.97 179.80 2dxb h GLU 36 N 0.10 1.20 -0.52 0.20 5.08 -1.00 -1.57 114.58 118.06 2dxb h GLU 36 Ca 0.05 -0.20 -0.09 0.00 -1.00 0.00 0.00 59.36 58.12 2dxb h GLU 36 Cb 0.03 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.06 2dxb h GLU 36 CO -0.06 0.95 -0.04 -0.07 -1.00 0.00 0.00 179.01 178.79 2dxb h LEU 37 N 1.18 0.94 -0.47 1.33 3.38 -0.84 -0.19 115.31 120.65 2dxb h LEU 37 Ca 0.28 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 2dxb h LEU 37 Cb 0.17 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 2dxb h LEU 37 CO -0.03 1.04 0.23 0.00 0.09 0.00 0.00 178.44 179.77 2dxb h ALA 38 N 0.93 0.60 -0.55 1.53 0.00 -0.64 -1.37 119.26 119.76 2dxb h ALA 38 Ca 0.14 -0.11 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 2dxb h ALA 38 Cb 0.58 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 2dxb h ALA 38 CO 0.03 0.15 -0.09 0.82 0.00 0.00 0.00 179.25 180.17 2dxb h ILE 39 N 0.61 1.27 -0.29 0.00 2.04 -1.20 -1.16 117.51 118.78 2dxb h ILE 39 Ca 0.16 -1.25 -0.04 0.00 1.00 0.00 0.00 64.86 64.74 2dxb h ILE 39 Cb 0.10 0.94 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 2dxb h ILE 39 CO -0.02 0.44 0.01 -0.33 0.00 0.00 0.00 178.15 178.25 2dxb h GLU 40 N 0.91 0.43 -0.13 2.37 5.08 -0.72 -2.09 114.58 120.43 2dxb h GLU 40 Ca 0.15 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2dxb h GLU 40 Cb 0.66 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.84 2dxb h GLU 40 CO 0.05 0.45 0.00 1.63 -1.00 0.00 0.00 179.01 180.14 2dxb n LYS 41 N -4.32 1.64 -2.19 2.33 4.76 -0.54 -4.93 118.16 114.90 2dxb n LYS 41 Ca 0.01 -0.95 -0.13 0.00 -2.87 0.00 0.00 58.31 54.37 2dxb n LYS 41 Cb 0.21 -1.40 -0.01 0.00 -1.84 0.00 0.00 35.03 32.00 2dxb n LYS 41 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dxb n GLY 42 N 1.10 -0.07 0.18 0.72 0.00 -0.79 -4.92 105.19 101.42 2dxb n GLY 42 Ca 0.16 -0.36 -0.19 0.00 0.00 0.00 0.00 46.02 45.63 2dxb n GLY 42 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2dxb h LEU 43 N 0.00 0.82 -7.32 0.99 3.38 -1.45 -3.47 115.31 108.26 2dxb h LEU 43 Ca -0.30 -0.74 -0.05 0.00 0.09 0.00 0.00 57.88 56.88 2dxb h LEU 43 Cb 1.20 -0.25 -0.14 0.00 0.09 0.00 0.00 40.66 41.56 2dxb h LEU 43 CO 0.36 1.45 -0.03 0.72 0.09 0.00 0.00 178.44 181.03 2dxb s PHE 44 N -3.32 -0.29 0.44 1.13 -0.12 -1.25 -5.06 117.98 109.52 2dxb s PHE 44 Ca -0.11 0.08 0.03 0.00 -0.05 0.00 0.00 56.93 56.89 2dxb s PHE 44 Cb 0.06 0.30 0.01 0.00 -0.63 0.00 0.00 43.02 42.75 2dxb s PHE 44 CO 0.90 -0.69 0.63 -1.54 -0.05 0.00 0.00 175.22 174.47 2dxb s SER 45 N -2.53 5.71 0.36 1.98 1.04 -1.26 -4.04 113.70 114.95 2dxb s SER 45 Ca 0.00 -0.01 0.06 0.00 0.48 0.00 0.00 55.95 56.48 2dxb s SER 45 Cb 0.01 -1.18 0.67 0.00 0.10 0.00 0.00 66.02 65.62 2dxb s SER 45 CO -0.09 -0.74 1.90 0.00 0.98 0.00 0.00 173.24 175.29 2dxb h ALA 46 N 0.49 1.43 -0.38 5.32 0.00 -1.98 -1.98 119.26 122.16 2dxb h ALA 46 Ca -0.44 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.20 2dxb h ALA 46 Cb 1.27 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2dxb h ALA 46 CO 0.53 0.40 -0.07 1.49 0.00 0.00 0.00 179.25 181.60 2dxb h GLU 47 N 0.43 0.72 -0.71 0.00 4.57 -1.99 -1.97 114.58 115.62 2dxb h GLU 47 Ca 0.09 -0.26 0.07 0.00 -1.18 0.00 0.00 59.36 58.08 2dxb h GLU 47 Cb 0.31 -0.05 -0.06 0.00 -0.16 0.00 0.00 28.75 28.80 2dxb h GLU 47 CO 0.01 0.85 0.38 -0.44 -1.18 0.00 0.00 179.01 178.64 2dxb h ASP 48 N 0.52 0.55 -0.70 1.04 3.32 -1.77 0.28 116.42 119.66 2dxb h ASP 48 Ca 0.10 0.04 -0.04 0.00 0.02 0.00 0.00 57.03 57.15 2dxb h ASP 48 Cb 0.58 -0.06 -0.03 0.00 0.22 0.00 0.00 39.33 40.03 2dxb h ASP 48 CO 0.03 0.34 0.27 -0.74 -1.72 0.00 0.00 179.24 177.42 2dxb h HIS 49 N 0.68 1.07 -0.38 4.55 2.76 -1.16 -0.26 115.15 122.41 2dxb h HIS 49 Ca 0.33 -0.09 -0.15 0.00 -2.20 0.00 0.00 60.37 58.26 2dxb h HIS 49 Cb 0.26 -0.32 -0.01 0.00 1.55 0.00 0.00 27.41 28.90 2dxb h HIS 49 CO -0.08 0.84 -0.35 0.00 -1.30 0.00 0.00 177.93 177.03 2dxb h ARG 50 N 1.00 0.89 -0.58 5.26 3.08 -0.58 -2.21 114.38 121.24 2dxb h ARG 50 Ca 0.23 -0.45 -0.00 0.00 0.07 0.00 0.00 59.98 59.83 2dxb h ARG 50 Cb 0.22 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.25 2dxb h ARG 50 CO -0.02 1.09 0.35 0.28 -1.07 0.00 0.00 179.97 180.61 2dxb h VAL 51 N 0.74 1.17 -0.65 2.04 2.07 -0.10 0.29 116.25 121.81 2dxb h VAL 51 Ca 0.07 -0.38 -0.09 0.00 0.82 0.00 0.00 66.70 67.12 2dxb h VAL 51 Cb 0.93 0.38 -0.03 0.00 -1.52 0.00 0.00 31.29 31.05 2dxb h VAL 51 CO 0.09 0.18 0.07 -0.25 0.02 0.00 0.00 177.57 177.68 2dxb h TRP 52 N 0.79 1.18 -0.60 1.57 2.91 -0.93 -0.73 115.95 120.12 2dxb h TRP 52 Ca 0.21 -0.18 -0.08 0.00 1.13 0.00 0.00 58.89 59.97 2dxb h TRP 52 Cb -0.02 -0.32 -0.02 0.00 -0.51 0.00 0.00 29.16 28.29 2dxb h TRP 52 CO -0.02 1.00 0.05 0.87 -1.03 0.00 0.00 178.44 179.31 2dxb h LYS 53 N 1.02 1.02 -0.42 2.65 1.57 -1.01 -1.12 116.57 120.27 2dxb h LYS 53 Ca 0.19 -0.28 -0.08 0.00 -1.87 0.00 0.00 60.65 58.61 2dxb h LYS 53 Cb 0.48 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 2dxb h LYS 53 CO 0.02 0.96 -0.05 -0.44 -0.57 0.00 0.00 179.45 179.38 2dxb h ASP 54 N 0.94 0.69 -0.26 0.86 3.32 -0.63 -1.68 116.42 119.67 2dxb h ASP 54 Ca 0.18 -0.17 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 2dxb h ASP 54 Cb 0.48 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 2dxb h ASP 54 CO 0.02 0.79 0.11 0.22 -1.72 0.00 0.00 179.24 178.66 2dxb h TYR 55 N 0.66 0.39 -0.84 4.55 3.20 -0.61 -2.73 116.97 121.59 2dxb h TYR 55 Ca 0.13 -0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.98 2dxb h TYR 55 Cb 0.48 -0.12 -0.04 0.00 1.54 0.00 0.00 36.73 38.59 2dxb h TYR 55 CO 0.02 0.39 0.56 0.28 -1.64 0.00 0.00 178.16 177.76 2dxb h VAL 56 N 0.27 1.20 0.00 1.81 2.07 -0.89 -1.60 116.25 119.12 2dxb h VAL 56 Ca 0.09 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.22 2dxb h VAL 56 Cb 0.16 -0.02 -0.00 0.00 -1.52 0.00 0.00 31.29 29.91 2dxb h VAL 56 CO -0.01 0.20 -0.03 -0.74 0.02 0.00 0.00 177.57 177.02 2dxb h HIS 57 N 1.12 0.00 -0.00 1.57 -0.00 -1.01 -1.11 115.15 115.72 2dxb h HIS 57 Ca 0.31 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.68 2dxb h HIS 57 Cb -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.32 2dxb h HIS 57 CO -0.00 0.03 -0.17 0.25 -0.00 0.00 0.00 177.93 178.04 2dxb n THR 58 N -3.49 0.00 -3.05 6.26 -2.24 -0.60 -4.90 114.28 106.26 2dxb n THR 58 Ca -0.02 -0.08 -0.34 0.00 -2.27 0.00 0.00 64.05 61.34 2dxb n THR 58 Cb 0.13 0.07 -0.06 0.00 -2.10 0.00 0.00 70.33 68.37 2dxb n THR 58 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2dxb s LEU 59 N -2.50 4.11 0.02 3.22 1.43 -0.42 -5.06 118.68 119.48 2dxb s LEU 59 Ca 0.27 1.42 -0.28 0.00 -1.03 0.00 0.00 54.13 54.50 2dxb s LEU 59 Cb 0.20 -4.07 0.10 0.00 0.03 0.00 0.00 46.19 42.45 2dxb s LEU 59 CO 0.50 -0.18 1.24 -0.83 0.23 0.00 0.00 176.35 177.31 2dxb s GLY 60 N -2.09 -0.21 0.00 -3.19 0.00 -1.26 -4.82 107.32 95.75 2dxb s GLY 60 Ca 0.53 0.24 0.29 0.00 0.00 0.00 0.00 44.72 45.79 2dxb s GLY 60 CO 0.18 2.83 1.93 -1.55 0.00 0.00 0.00 173.10 176.49 2dxb n PRO 61 N -0.70 0.45 -0.20 2.90 -0.04 -0.99 -3.42 135.00 133.00 2dxb n PRO 61 Ca -0.02 -0.08 -0.05 0.00 -0.04 0.00 0.00 63.50 63.30 2dxb n PRO 61 Cb 0.60 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.61 2dxb n PRO 61 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2dxb h LEU 62 N 0.21 0.61 -0.67 1.53 3.38 -1.87 -2.25 115.31 116.24 2dxb h LEU 62 Ca 0.00 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.01 2dxb h LEU 62 Cb 0.35 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.92 2dxb h LEU 62 CO 0.00 0.43 0.40 -0.65 0.09 0.00 0.00 178.44 178.71 2dxb h PRO 63 N 0.73 0.74 -0.57 1.13 0.11 -1.75 -0.51 132.00 131.89 2dxb h PRO 63 Ca 0.23 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 66.22 2dxb h PRO 63 Cb -0.01 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 30.91 2dxb h PRO 63 CO -0.08 0.49 0.06 0.00 -0.21 0.00 0.00 178.00 178.26 2dxb h ALA 64 N 1.31 0.76 -0.68 -0.75 0.00 -1.32 -1.21 119.26 117.37 2dxb h ALA 64 Ca 0.28 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 2dxb h ALA 64 Cb 0.09 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 2dxb h ALA 64 CO -0.14 0.54 0.24 0.00 0.00 0.00 0.00 179.25 179.89 2dxb h ALA 65 N 0.99 1.14 -0.73 0.00 0.00 -1.08 -2.08 119.26 117.49 2dxb h ALA 65 Ca 0.17 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 2dxb h ALA 65 Cb 0.46 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2dxb h ALA 65 CO 0.02 0.61 0.21 -0.09 0.00 0.00 0.00 179.25 180.00 2dxb h ARG 66 N 1.00 1.15 -0.82 0.00 9.65 -0.79 -1.65 114.38 122.92 2dxb h ARG 66 Ca 0.23 -0.26 -0.04 0.00 -1.10 0.00 0.00 59.98 58.81 2dxb h ARG 66 Cb 0.24 -0.16 -0.04 0.00 -1.39 0.00 0.00 29.97 28.62 2dxb h ARG 66 CO -0.01 0.99 0.38 1.25 2.80 0.00 0.00 179.97 185.37 2dxb h LEU 67 N 1.10 1.09 -0.38 3.80 6.46 -0.62 -0.92 115.31 125.84 2dxb h LEU 67 Ca 0.24 -0.14 -0.07 0.00 -0.12 0.00 0.00 57.88 57.78 2dxb h LEU 67 Cb 0.33 -0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 39.96 2dxb h LEU 67 CO -0.00 0.94 -0.03 0.58 -0.62 0.00 0.00 178.44 179.30 2dxb h VAL 68 N 1.18 1.27 -0.59 1.05 2.07 -1.03 -1.31 116.25 118.89 2dxb h VAL 68 Ca 0.28 -1.06 -0.02 0.00 0.82 0.00 0.00 66.70 66.73 2dxb h VAL 68 Cb 0.15 1.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 2dxb h VAL 68 CO -0.03 0.35 0.31 0.00 0.02 0.00 0.00 177.57 178.22 2dxb h ALA 69 N 0.86 0.76 -0.84 1.67 0.00 -1.02 -0.18 119.26 120.51 2dxb h ALA 69 Ca 0.10 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2dxb h ALA 69 Cb 0.51 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 2dxb h ALA 69 CO 0.03 0.30 0.41 0.87 0.00 0.00 0.00 179.25 180.86 2dxb h LYS 70 N 0.81 1.20 -0.28 0.00 1.57 -1.04 -2.01 116.57 116.82 2dxb h LYS 70 Ca 0.21 -0.17 -0.10 0.00 -1.87 0.00 0.00 60.65 58.72 2dxb h LYS 70 Cb 0.07 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.15 2dxb h LYS 70 CO -0.03 0.92 -0.24 0.00 -0.57 0.00 0.00 179.45 179.53 2dxb h ALA 71 N 1.22 1.07 -0.18 3.86 0.00 -0.78 0.28 119.26 124.73 2dxb h ALA 71 Ca 0.29 -0.34 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 2dxb h ALA 71 Cb 0.10 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2dxb h ALA 71 CO -0.04 0.57 -0.16 -1.49 0.00 0.00 0.00 179.25 178.13 2dxb h TRP 72 N 0.47 0.31 0.00 0.00 6.55 -0.48 -3.03 115.95 119.78 2dxb h TRP 72 Ca 0.07 -0.04 0.00 0.00 0.95 0.00 0.00 58.89 59.87 2dxb h TRP 72 Cb 0.67 -0.08 0.00 0.00 -0.86 0.00 0.00 29.16 28.88 2dxb h TRP 72 CO 0.02 0.45 -0.88 1.28 -1.05 0.00 0.00 178.44 178.27 2dxb n LEU 73 N -4.23 0.72 -3.68 -4.49 4.77 -0.81 -4.82 117.00 104.47 2dxb n LEU 73 Ca -0.00 -0.22 -0.29 0.00 -0.03 0.00 0.00 56.01 55.47 2dxb n LEU 73 Cb 0.31 -0.10 -0.15 0.00 -2.33 0.00 0.00 43.42 41.14 2dxb n LEU 73 CO 0.39 0.16 -0.34 -0.62 -1.33 0.00 0.00 177.39 175.64 2dxb s ASP 74 N -3.25 3.54 0.28 -1.43 -1.08 0.05 -5.01 116.67 109.76 2dxb s ASP 74 Ca 0.08 -1.28 0.02 0.00 -0.52 0.00 0.00 52.55 50.84 2dxb s ASP 74 Cb 0.16 -0.64 0.59 0.00 -1.46 0.00 0.00 42.92 41.57 2dxb s ASP 74 CO 0.80 -0.39 1.80 -0.65 0.52 0.00 0.00 175.17 177.25 2dxb h PRO 75 N 8.23 0.81 -0.32 4.34 0.11 -1.87 0.33 132.00 143.63 2dxb h PRO 75 Ca -0.16 -0.05 -0.13 0.00 0.11 0.00 0.00 66.00 65.77 2dxb h PRO 75 Cb 1.05 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.96 2dxb h PRO 75 CO 0.42 0.54 -0.33 0.93 -0.21 0.00 0.00 178.00 179.34 2dxb h GLU 76 N 0.84 0.70 -0.25 1.05 4.39 -1.95 -1.88 114.58 117.48 2dxb h GLU 76 Ca 0.51 -0.33 -0.16 0.00 0.34 0.00 0.00 59.36 59.72 2dxb h GLU 76 Cb 0.63 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.27 2dxb h GLU 76 CO -0.32 0.93 -0.49 -0.92 -1.16 0.00 0.00 179.01 177.06 2dxb h TYR 77 N 0.59 0.84 -0.45 4.33 3.20 -1.66 -2.43 116.97 121.38 2dxb h TYR 77 Ca 0.06 -0.28 0.02 0.00 3.14 0.00 0.00 58.73 61.67 2dxb h TYR 77 Cb 0.85 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.93 2dxb h TYR 77 CO 0.04 1.04 0.27 -0.22 -1.64 0.00 0.00 178.16 177.65 2dxb h LYS 78 N 0.54 0.52 -0.84 1.82 3.64 -0.72 0.54 116.57 122.07 2dxb h LYS 78 Ca 0.03 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.41 2dxb h LYS 78 Cb 1.05 -0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 32.70 2dxb h LYS 78 CO 0.10 0.34 0.55 0.87 -2.27 0.00 0.00 179.45 179.04 2dxb h LYS 79 N 0.53 0.99 -0.44 1.90 1.57 -1.21 -1.60 116.57 118.31 2dxb h LYS 79 Ca 0.18 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.82 2dxb h LYS 79 Cb 0.02 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.09 2dxb h LYS 79 CO -0.09 0.65 -0.04 1.25 -0.57 0.00 0.00 179.45 180.66 2dxb h LEU 80 N 1.02 0.80 0.01 2.94 5.85 -0.76 -2.15 115.31 123.02 2dxb h LEU 80 Ca 0.34 -0.33 0.01 0.00 0.84 0.00 0.00 57.88 58.74 2dxb h LEU 80 Cb 0.07 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 2dxb h LEU 80 CO -0.10 0.94 -0.08 0.00 -0.34 0.00 0.00 178.44 178.86 2dxb h ILE 82 N -0.14 1.20 0.06 0.00 2.04 -1.30 -3.02 117.51 116.35 2dxb h ILE 82 Ca 0.03 -0.50 -0.32 0.00 1.00 0.00 0.00 64.86 65.07 2dxb h ILE 82 Cb 0.18 0.29 -0.03 0.00 -0.74 0.00 0.00 36.82 36.51 2dxb h ILE 82 CO -0.07 0.22 -1.77 -0.08 0.00 0.00 0.00 178.15 176.45 2dxb h GLU 83 N 0.94 0.13 -1.78 2.37 4.57 -1.15 -3.44 114.58 116.21 2dxb h GLU 83 Ca 0.24 -0.22 -0.42 0.00 -1.18 0.00 0.00 59.36 57.78 2dxb h GLU 83 Cb 0.02 0.08 -0.30 0.00 -0.16 0.00 0.00 28.75 28.39 2dxb h GLU 83 CO -0.04 0.84 -0.80 -3.47 -1.18 0.00 0.00 179.01 174.36 2dxb n ASP 84 N -3.26 -1.57 -0.20 1.04 -0.08 0.15 -5.01 116.55 107.62 2dxb n ASP 84 Ca -0.22 -2.61 0.18 0.00 -1.51 0.00 0.00 54.79 50.63 2dxb n ASP 84 Cb 1.05 0.33 0.53 0.00 2.34 0.00 0.00 41.12 45.36 2dxb n ASP 84 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 2dxb h GLY 85 N 5.25 0.73 0.86 0.27 0.00 -1.56 -1.98 103.07 106.65 2dxb h GLY 85 Ca 0.17 -0.17 -0.01 0.00 0.00 0.00 0.00 47.33 47.33 2dxb h GLY 85 CO 0.25 0.02 0.03 -2.08 0.00 0.00 0.00 176.54 174.76 2dxb h VAL 86 N 0.38 1.14 -0.36 4.60 2.07 -1.90 -0.28 116.25 121.91 2dxb h VAL 86 Ca 0.42 -0.43 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 2dxb h VAL 86 Cb 1.08 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 32.11 2dxb h VAL 86 CO -0.14 0.13 0.15 -0.08 0.02 0.00 0.00 177.57 177.65 2dxb h GLU 87 N -0.02 0.53 -0.43 1.57 4.57 -1.78 -2.91 114.58 116.12 2dxb h GLU 87 Ca 0.03 -0.09 -0.03 0.00 -1.18 0.00 0.00 59.36 58.09 2dxb h GLU 87 Cb 0.17 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.65 2dxb h GLU 87 CO -0.00 0.50 0.15 0.00 -1.18 0.00 0.00 179.01 178.48 2dxb h ALA 88 N 1.00 1.47 0.00 2.92 0.00 -1.27 -2.56 119.26 120.82 2dxb h ALA 88 Ca 0.12 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2dxb h ALA 88 Cb 0.16 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 2dxb h ALA 88 CO -0.01 0.40 -0.08 1.03 0.00 0.00 0.00 179.25 180.59 2dxb h SER 89 N 0.60 0.00 -0.63 0.00 0.87 -0.83 -2.19 113.55 111.37 2dxb h SER 89 Ca 0.15 0.00 0.05 0.00 -1.23 0.00 0.00 61.79 60.76 2dxb h SER 89 Cb 0.15 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.08 2dxb h SER 89 CO -0.01 0.08 0.42 0.11 -0.53 0.00 0.00 176.83 176.90 2dxb h LYS 90 N 0.00 0.65 0.00 2.24 1.57 -1.43 -1.53 116.57 118.07 2dxb h LYS 90 Ca -0.00 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2dxb h LYS 90 Cb 0.16 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.32 2dxb h LYS 90 CO 0.01 0.43 0.00 0.00 -0.57 0.00 0.00 179.45 179.32 2dxb h ALA 91 N 1.65 1.00 -0.33 3.86 0.00 -1.54 -0.27 119.26 123.62 2dxb h ALA 91 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2dxb h ALA 91 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2dxb h ALA 91 CO -0.08 0.00 0.00 1.33 0.00 0.00 0.00 179.25 180.50 2dxb n VAL 92 N -2.84 2.20 -1.01 0.00 0.24 -0.60 -4.96 118.33 111.37 2dxb n VAL 92 Ca -0.02 -1.69 -0.00 0.00 -2.04 0.00 0.00 64.34 60.59 2dxb n VAL 92 Cb 0.10 -0.16 -0.00 0.00 -1.47 0.00 0.00 33.84 32.31 2dxb n VAL 92 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2dxb n GLY 93 N -0.16 0.47 3.08 7.63 0.00 -0.11 -4.87 105.19 111.23 2dxb n GLY 93 Ca 0.21 -0.22 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 2dxb n GLY 93 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dxb s VAL 94 N -1.96 2.63 -0.42 1.61 1.01 -1.04 -5.00 120.40 117.22 2dxb s VAL 94 Ca 0.00 -1.99 -0.16 0.00 0.00 0.00 0.00 61.98 59.83 2dxb s VAL 94 Cb 0.00 -2.76 0.02 0.00 0.00 0.00 0.00 36.38 33.64 2dxb s VAL 94 CO 0.00 -0.44 0.36 0.21 0.00 0.00 0.00 175.10 175.23 2dxb s ASN 95 N 1.22 6.15 0.60 3.32 3.84 -1.26 -3.25 114.94 125.56 2dxb s ASN 95 Ca 0.04 -0.82 0.30 0.00 0.21 0.00 0.00 52.86 52.59 2dxb s ASN 95 Cb -0.20 -2.19 1.67 0.00 -0.55 0.00 0.00 41.25 39.98 2dxb s ASN 95 CO -0.05 -0.51 2.05 -0.50 -2.79 0.00 0.00 177.10 175.30 2dxb h TRP 96 N 8.68 0.00 0.00 0.43 4.06 -1.94 0.14 115.95 127.32 2dxb h TRP 96 Ca -0.27 0.00 -0.16 0.00 2.06 0.00 0.00 58.89 60.52 2dxb h TRP 96 Cb 1.12 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.25 2dxb h TRP 96 CO 0.58 0.00 -0.98 0.28 -3.56 0.00 0.00 178.44 174.77 2dxb h VAL 97 N 0.00 0.79 0.00 1.49 2.07 -1.91 -3.24 116.25 115.45 2dxb h VAL 97 Ca 0.09 -1.94 0.00 0.00 0.82 0.00 0.00 66.70 65.68 2dxb h VAL 97 Cb 0.62 1.84 0.00 0.00 -1.52 0.00 0.00 31.29 32.22 2dxb h VAL 97 CO -0.00 0.27 -1.11 0.35 0.02 0.00 0.00 177.57 177.09 2dxb n THR 98 N -4.49 0.26 -0.14 2.57 -2.24 -1.13 -1.14 114.28 107.96 2dxb n THR 98 Ca -0.25 -0.34 -0.10 0.00 -2.27 0.00 0.00 64.05 61.09 2dxb n THR 98 Cb 0.57 0.04 -0.01 0.00 -2.10 0.00 0.00 70.33 68.83 2dxb n THR 98 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2dxb h SER 99 N 0.00 0.72 -4.19 3.42 0.02 -0.98 -3.43 113.55 109.11 2dxb h SER 99 Ca 0.00 -0.31 -0.52 0.00 -0.84 0.00 0.00 61.79 60.12 2dxb h SER 99 Cb 0.82 -0.19 0.12 0.00 0.14 0.00 0.00 62.40 63.29 2dxb h SER 99 CO 0.00 0.85 0.38 -2.84 -1.14 0.00 0.00 176.83 174.08 2dxb s PRO 100 N -5.00 2.62 0.47 3.45 0.02 -1.26 -4.91 135.00 130.39 2dxb s PRO 100 Ca -0.13 1.52 0.22 0.00 0.02 0.00 0.00 61.00 62.63 2dxb s PRO 100 Cb 0.10 -1.92 1.24 0.00 0.02 0.00 0.00 34.50 33.95 2dxb s PRO 100 CO 0.80 -1.42 1.91 -1.35 -0.33 0.00 0.00 177.00 176.61 2dxb h PRO 101 N -0.01 0.22 0.00 5.54 0.11 -1.93 -2.66 132.00 133.26 2dxb h PRO 101 Ca -0.47 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.55 2dxb h PRO 101 Cb 1.26 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 2dxb h PRO 101 CO 0.53 0.14 -0.35 1.79 -0.21 0.00 0.00 178.00 179.90 2dxb h THR 102 N 0.22 1.18 -0.12 -1.15 1.35 -1.91 -3.47 112.91 109.02 2dxb h THR 102 Ca 0.39 -1.24 -0.05 0.00 -0.55 0.00 0.00 66.41 64.96 2dxb h THR 102 Cb 1.21 1.68 -0.02 0.00 -1.73 0.00 0.00 68.15 69.29 2dxb h THR 102 CO -0.09 0.35 -0.05 0.00 -0.25 0.00 0.00 175.52 175.48 2dxb n GLN 103 N -4.01 -0.46 -1.21 4.72 1.13 -1.00 -4.81 117.38 111.73 2dxb n GLN 103 Ca -0.02 0.39 0.02 0.00 -1.94 0.00 0.00 57.00 55.45 2dxb n GLN 103 Cb 0.40 -3.93 0.00 0.00 0.11 0.00 0.00 30.24 26.82 2dxb n GLN 103 CO 0.00 0.00 0.00 1.97 -1.44 0.00 0.00 177.06 177.59 2dxb n PHE 104 N -2.78 0.00 -0.13 1.08 1.16 -0.92 -4.62 117.46 111.25 2dxb n PHE 104 Ca -0.03 -0.39 0.01 0.00 -1.87 0.00 0.00 57.45 55.18 2dxb n PHE 104 Cb 0.15 -0.03 -0.01 0.00 -1.61 0.00 0.00 39.48 37.98 2dxb n PHE 104 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2dxb n GLY 105 N 0.32 -2.72 3.74 4.97 0.00 -0.29 -4.86 105.19 106.36 2dxb n GLY 105 Ca 0.00 -1.39 -0.37 0.00 0.00 0.00 0.00 46.02 44.26 2dxb n GLY 105 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dxb s THR 106 N -3.24 2.30 0.33 2.61 -4.23 -1.26 -4.75 115.64 107.40 2dxb s THR 106 Ca 0.00 0.19 0.02 0.00 -1.18 0.00 0.00 61.69 60.73 2dxb s THR 106 Cb 0.00 -3.08 0.20 0.00 1.34 0.00 0.00 72.50 70.96 2dxb s THR 106 CO 0.00 -0.04 1.92 -0.65 -0.54 0.00 0.00 174.62 175.31 2dxb h PRO 107 N 0.81 0.72 0.00 3.99 0.11 -1.95 -2.84 132.00 132.84 2dxb h PRO 107 Ca -0.51 -0.10 -0.09 0.00 0.11 0.00 0.00 66.00 65.41 2dxb h PRO 107 Cb 1.32 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 2dxb h PRO 107 CO 0.54 0.60 -1.41 0.43 -0.21 0.00 0.00 178.00 177.95 2dxb n SER 108 N -4.35 0.67 0.00 -2.05 7.64 -1.26 -4.37 113.62 109.90 2dxb n SER 108 Ca 0.04 0.28 0.11 0.00 1.01 0.00 0.00 58.87 60.30 2dxb n SER 108 Cb 0.16 0.61 -0.12 0.00 -1.01 0.00 0.00 64.21 63.85 2dxb n SER 108 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2dxb n ASP 109 N -2.70 0.42 -0.65 6.43 8.00 -1.23 -4.95 116.55 121.87 2dxb n ASP 109 Ca -0.07 -0.30 0.00 0.00 0.71 0.00 0.00 54.79 55.13 2dxb n ASP 109 Cb 0.71 1.46 0.00 0.00 -0.02 0.00 0.00 41.12 43.27 2dxb n ASP 109 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2dxb n TYR 110 N -2.01 -1.63 -2.48 1.24 4.01 -1.07 -4.58 117.16 110.63 2dxb n TYR 110 Ca -0.01 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.55 2dxb n TYR 110 Cb 0.48 0.26 0.02 0.00 -0.31 0.00 0.00 39.34 39.78 2dxb n TYR 110 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2dxb n ASN 112 N -0.43 0.65 -4.75 0.00 2.85 -1.26 -4.95 115.26 107.38 2dxb n ASN 112 Ca 0.28 -2.78 -0.40 0.00 -0.11 0.00 0.00 54.58 51.57 2dxb n ASN 112 Cb 0.78 -0.64 -0.05 0.00 1.24 0.00 0.00 39.78 41.11 2dxb n ASN 112 CO 0.00 0.00 0.00 -0.22 -2.11 0.00 0.00 177.26 174.93 2dxb s LEU 113 N -1.27 4.57 -0.03 1.20 2.96 -1.26 -2.36 118.68 122.49 2dxb s LEU 113 Ca 0.35 2.06 0.05 0.00 -0.22 0.00 0.00 54.13 56.37 2dxb s LEU 113 Cb 0.16 -3.61 -0.01 0.00 0.50 0.00 0.00 46.19 43.23 2dxb s LEU 113 CO -0.10 -0.04 -0.17 -0.13 -1.32 0.00 0.00 176.35 174.59 2dxb s ARG 114 N -0.96 1.53 -0.21 1.98 0.52 0.03 -3.41 118.95 118.44 2dxb s ARG 114 Ca 0.44 -0.59 -0.08 0.00 -0.52 0.00 0.00 55.73 54.98 2dxb s ARG 114 Cb -0.28 -1.41 -0.04 0.00 0.52 0.00 0.00 34.95 33.74 2dxb s ARG 114 CO 0.35 0.30 0.09 0.08 0.02 0.00 0.00 175.30 176.13 2dxb s VAL 115 N -0.17 4.81 -0.39 3.52 1.01 -1.25 -3.01 120.40 124.93 2dxb s VAL 115 Ca 0.01 -0.02 -0.14 0.00 0.00 0.00 0.00 61.98 61.84 2dxb s VAL 115 Cb -0.09 -3.20 0.01 0.00 0.00 0.00 0.00 36.38 33.10 2dxb s VAL 115 CO 0.01 0.41 0.27 -0.76 0.00 0.00 0.00 175.10 175.03 2dxb s LEU 116 N 0.78 4.91 -0.37 3.92 1.43 -0.81 -4.47 118.68 124.07 2dxb s LEU 116 Ca 0.04 -0.80 -0.24 0.00 -1.03 0.00 0.00 54.13 52.11 2dxb s LEU 116 Cb -0.13 -2.13 0.01 0.00 0.03 0.00 0.00 46.19 43.96 2dxb s LEU 116 CO 0.02 -0.39 0.81 0.00 0.23 0.00 0.00 176.35 177.02 2dxb s ALA 117 N 1.67 3.42 0.82 4.21 0.00 -1.26 -0.60 121.76 130.01 2dxb s ALA 117 Ca 0.05 -0.64 -0.11 0.00 0.00 0.00 0.00 51.96 51.26 2dxb s ALA 117 Cb -0.19 -3.40 0.08 0.00 0.00 0.00 0.00 23.12 19.61 2dxb s ALA 117 CO 0.10 -1.54 1.09 -0.51 0.00 0.00 0.00 175.76 174.90 2dxb s ASP 118 N 1.87 4.14 0.32 0.00 1.01 -0.05 -4.93 116.67 119.03 2dxb s ASP 118 Ca 0.32 1.71 -0.08 0.00 0.71 0.00 0.00 52.55 55.22 2dxb s ASP 118 Cb -0.13 -2.40 0.01 0.00 1.01 0.00 0.00 42.92 41.41 2dxb s ASP 118 CO 0.18 -2.25 0.53 -0.94 0.21 0.00 0.00 175.17 172.90 2dxb s SER 119 N -3.39 0.44 0.34 0.27 1.04 0.13 -4.58 113.70 107.94 2dxb s SER 119 Ca 0.62 -1.25 0.22 0.00 0.48 0.00 0.00 55.95 56.02 2dxb s SER 119 Cb -0.17 0.67 1.21 0.00 0.10 0.00 0.00 66.02 67.82 2dxb s SER 119 CO 0.56 -1.32 1.67 -0.65 0.98 0.00 0.00 173.24 174.49 2dxb h PRO 120 N 2.14 0.00 0.00 4.02 0.11 -2.03 -1.74 132.00 134.50 2dxb h PRO 120 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2dxb h PRO 120 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2dxb h PRO 120 CO 0.38 0.00 -0.03 0.25 -0.21 0.00 0.00 178.00 178.39 2dxb n THR 121 N -2.29 1.10 -3.68 -1.15 -2.24 -1.26 -4.87 114.28 99.89 2dxb n THR 121 Ca -0.01 -1.21 -0.09 0.00 -2.27 0.00 0.00 64.05 60.46 2dxb n THR 121 Cb 0.06 0.33 -0.10 0.00 -2.10 0.00 0.00 70.33 68.52 2dxb n THR 121 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2dxb s LEU 122 N -1.39 -0.35 -0.07 3.22 2.96 -0.65 -1.73 118.68 120.67 2dxb s LEU 122 Ca 0.10 0.96 0.01 0.00 -0.22 0.00 0.00 54.13 54.98 2dxb s LEU 122 Cb 0.08 1.40 0.02 0.00 0.50 0.00 0.00 46.19 48.20 2dxb s LEU 122 CO 0.01 -0.21 -0.08 -0.75 -1.32 0.00 0.00 176.35 174.00 2dxb s LYS 123 N 1.88 1.31 0.16 1.98 2.47 -0.52 0.21 119.74 127.23 2dxb s LYS 123 Ca -0.07 -0.24 0.04 0.00 -1.56 0.00 0.00 55.97 54.14 2dxb s LYS 123 Cb -0.10 -1.23 -0.04 0.00 -1.46 0.00 0.00 37.83 35.01 2dxb s LYS 123 CO -0.13 -0.09 0.21 -1.01 0.16 0.00 0.00 175.35 174.48 2dxb s HIS 124 N 1.06 3.30 -0.14 4.03 3.76 -1.26 -0.59 115.29 125.45 2dxb s HIS 124 Ca -0.08 0.04 -0.11 0.00 -0.15 0.00 0.00 55.06 54.75 2dxb s HIS 124 Cb -0.14 -1.57 0.04 0.00 1.11 0.00 0.00 32.58 32.01 2dxb s HIS 124 CO -0.01 0.52 0.35 0.54 -0.85 0.00 0.00 174.74 175.29 2dxb s VAL 125 N -1.77 -0.01 0.15 -0.90 0.11 -0.89 -4.49 120.40 112.60 2dxb s VAL 125 Ca 0.33 0.03 0.07 0.00 -2.93 0.00 0.00 61.98 59.47 2dxb s VAL 125 Cb -0.10 -0.51 -0.04 0.00 -1.53 0.00 0.00 36.38 34.20 2dxb s VAL 125 CO 0.26 0.01 -0.00 -0.69 -3.33 0.00 0.00 175.10 171.35 2dxb s VAL 126 N 0.49 3.79 0.19 2.04 1.01 -0.11 -1.39 120.40 126.41 2dxb s VAL 126 Ca -0.02 -1.29 -0.23 0.00 0.00 0.00 0.00 61.98 60.43 2dxb s VAL 126 Cb -0.04 -2.87 0.05 0.00 0.00 0.00 0.00 36.38 33.52 2dxb s VAL 126 CO -0.03 -0.04 0.73 0.54 0.00 0.00 0.00 175.10 176.31 2dxb s VAL 127 N -1.58 0.00 -0.39 2.92 0.11 -0.72 -4.94 120.40 115.79 2dxb s VAL 127 Ca 0.27 -0.48 0.01 0.00 -2.93 0.00 0.00 61.98 58.84 2dxb s VAL 127 Cb -0.10 -1.53 0.13 0.00 -1.53 0.00 0.00 36.38 33.34 2dxb s VAL 127 CO 0.18 0.00 0.20 0.00 -3.33 0.00 0.00 175.10 172.15 2dxb h THR 129 N 5.51 1.03 0.02 0.00 1.35 -1.87 -3.36 112.91 115.59 2dxb h THR 129 Ca -0.03 -0.11 -0.23 0.00 -0.55 0.00 0.00 66.41 65.49 2dxb h THR 129 Cb 0.96 0.98 0.00 0.00 -1.73 0.00 0.00 68.15 68.36 2dxb h THR 129 CO 0.44 0.04 -0.98 -0.07 -0.25 0.00 0.00 175.52 174.69 2dxb h LEU 130 N 0.07 0.47 -9.56 3.87 3.38 -1.91 -3.47 115.31 108.16 2dxb h LEU 130 Ca 0.02 -0.39 -0.56 0.00 0.09 0.00 0.00 57.88 57.04 2dxb h LEU 130 Cb 0.04 -0.14 -0.09 0.00 0.09 0.00 0.00 40.66 40.55 2dxb h LEU 130 CO -0.00 1.21 -0.64 -0.94 0.09 0.00 0.00 178.44 178.16 2dxb s SER 132 N -7.07 4.57 0.00 -0.43 1.04 -1.26 -5.21 113.70 105.35 2dxb s SER 132 Ca -0.05 -0.63 0.00 0.00 0.48 0.00 0.00 55.95 55.75 2dxb s SER 132 Cb 0.09 -0.86 0.00 0.00 0.10 0.00 0.00 66.02 65.35 2dxb s SER 132 CO 0.86 0.00 0.00 0.00 0.98 0.00 0.00 173.24 175.09 2dxb n TYR 134 N -0.89 0.00 -1.21 5.02 9.36 -1.26 -4.95 117.16 123.24 2dxb n TYR 134 Ca -0.07 0.00 -0.35 0.00 3.32 0.00 0.00 57.90 60.80 2dxb n TYR 134 Cb 0.59 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 39.27 2dxb n TYR 134 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 2dxb n PRO 135 N -1.07 3.23 -0.23 2.98 -0.04 -1.26 -4.79 135.00 133.82 2dxb n PRO 135 Ca 0.00 -2.05 0.00 0.00 -0.04 0.00 0.00 63.50 61.41 2dxb n PRO 135 Cb 0.00 -2.76 0.07 0.00 -0.04 0.00 0.00 33.50 30.77 2dxb n PRO 135 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dxb h ARG 136 N 5.43 0.00 -1.01 0.54 3.08 -1.94 0.34 114.38 120.83 2dxb h ARG 136 Ca 0.76 -0.00 0.24 0.00 0.07 0.00 0.00 59.98 61.06 2dxb h ARG 136 Cb 0.29 -0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.22 2dxb h ARG 136 CO 1.72 0.00 0.60 -1.35 -1.07 0.00 0.00 179.97 179.88 2dxb h PRO 137 N 0.00 0.56 0.00 0.04 0.11 -1.86 0.33 132.00 131.18 2dxb h PRO 137 Ca 0.32 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.40 2dxb h PRO 137 Cb 0.49 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.47 2dxb h PRO 137 CO -0.69 0.37 -1.18 1.51 -0.21 0.00 0.00 178.00 177.81 2dxb n ILE 138 N -4.86 0.00 -0.00 4.15 3.06 -0.92 -4.69 119.36 116.10 2dxb n ILE 138 Ca 0.27 -0.24 0.01 0.00 -2.50 0.00 0.00 62.75 60.29 2dxb n ILE 138 Cb 0.75 0.61 -0.02 0.00 0.54 0.00 0.00 39.64 41.53 2dxb n ILE 138 CO 0.00 0.00 0.00 -0.11 -2.50 0.00 0.00 176.55 173.94 2dxb n LEU 139 N -1.67 0.00 0.00 9.51 7.94 0.06 -2.75 117.00 130.09 2dxb n LEU 139 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 2dxb n LEU 139 Cb 0.32 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.27 2dxb n LEU 139 CO 0.33 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.22 2dxb n GLY 140 N 2.40 -1.87 3.79 -3.96 0.00 0.11 -2.35 105.19 103.30 2dxb n GLY 140 Ca -0.00 -1.98 -0.36 0.00 0.00 0.00 0.00 46.02 43.67 2dxb n GLY 140 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2dxb s GLN 141 N 0.00 4.38 0.51 1.61 2.00 -1.26 -3.89 119.66 123.01 2dxb s GLN 141 Ca 0.00 1.33 -0.20 0.00 -2.00 0.00 0.00 55.36 54.49 2dxb s GLN 141 Cb 0.00 -2.58 -0.07 0.00 0.80 0.00 0.00 33.01 31.16 2dxb s GLN 141 CO 0.00 0.09 1.06 -1.54 -0.50 0.00 0.00 175.29 174.40 2dxb s SER 142 N -1.74 6.13 0.61 6.67 1.04 -1.26 -5.02 113.70 120.12 2dxb s SER 142 Ca 0.55 1.98 -0.17 0.00 0.48 0.00 0.00 55.95 58.79 2dxb s SER 142 Cb -0.17 -2.56 -0.03 0.00 0.10 0.00 0.00 66.02 63.36 2dxb s SER 142 CO 0.22 -0.93 1.14 -2.84 0.98 0.00 0.00 173.24 171.81 2dxb s PRO 143 N -3.33 3.00 0.19 4.02 0.02 -1.26 -4.94 135.00 132.70 2dxb s PRO 143 Ca 0.68 1.57 -0.12 0.00 0.02 0.00 0.00 61.00 63.16 2dxb s PRO 143 Cb -0.18 -1.96 0.17 0.00 0.02 0.00 0.00 34.50 32.55 2dxb s PRO 143 CO 0.23 -1.12 1.78 1.49 -0.33 0.00 0.00 177.00 179.06 2dxb h GLU 144 N 0.61 0.50 0.00 5.54 4.57 -2.00 -2.14 114.58 121.66 2dxb h GLU 144 Ca -0.49 -0.03 -0.04 0.00 -1.18 0.00 0.00 59.36 57.62 2dxb h GLU 144 Cb 1.26 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 29.73 2dxb h GLU 144 CO 0.55 0.33 -0.18 0.11 -1.18 0.00 0.00 179.01 178.64 2dxb h TRP 145 N 0.52 0.00 0.00 0.92 5.08 -1.98 -2.07 115.95 118.42 2dxb h TRP 145 Ca 0.25 0.00 -0.05 0.00 1.08 0.00 0.00 58.89 60.17 2dxb h TRP 145 Cb 0.17 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.33 2dxb h TRP 145 CO -0.11 0.18 -0.22 -0.92 -1.28 0.00 0.00 178.44 176.10 2dxb h TYR 146 N 0.00 0.00 -0.00 0.12 3.20 -1.76 -2.12 116.97 116.41 2dxb h TYR 146 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2dxb h TYR 146 Cb 0.37 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.64 2dxb h TYR 146 CO 0.00 0.22 -0.36 0.54 -1.64 0.00 0.00 178.16 176.92 2dxb n ARG 147 N -4.16 0.08 -2.19 1.82 1.74 -0.79 -4.70 116.66 108.46 2dxb n ARG 147 Ca -0.02 -0.04 -0.40 0.00 -0.77 0.00 0.00 57.85 56.62 2dxb n ARG 147 Cb 0.28 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.20 2dxb n ARG 147 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2dxb s SER 148 N -2.94 6.71 0.44 0.55 1.04 -0.80 -4.91 113.70 113.79 2dxb s SER 148 Ca 0.13 2.56 0.12 0.00 0.48 0.00 0.00 55.95 59.24 2dxb s SER 148 Cb 0.18 -2.64 1.00 0.00 0.10 0.00 0.00 66.02 64.66 2dxb s SER 148 CO 0.64 -0.56 2.03 -0.65 0.98 0.00 0.00 173.24 175.68 2dxb h PRO 149 N 3.18 0.40 -0.00 4.02 0.11 -1.92 -1.72 132.00 136.06 2dxb h PRO 149 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2dxb h PRO 149 Cb 1.23 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 2dxb h PRO 149 CO 0.65 0.26 0.00 -0.97 -0.21 0.00 0.00 178.00 177.73 2dxb h ASN 150 N 0.41 0.00 -0.49 -2.05 -0.73 -1.91 0.14 115.58 110.95 2dxb h ASN 150 Ca 0.20 -0.02 -0.07 0.00 1.87 0.00 0.00 56.30 58.27 2dxb h ASN 150 Cb 0.25 -0.00 -0.02 0.00 0.27 0.00 0.00 38.32 38.83 2dxb h ASN 150 CO -0.05 0.02 0.03 0.22 -0.37 0.00 0.00 177.43 177.29 2dxb h TYR 151 N -0.02 0.91 0.00 0.67 3.20 -1.70 -1.95 116.97 118.08 2dxb h TYR 151 Ca 0.00 -0.15 -0.04 0.00 3.14 0.00 0.00 58.73 61.68 2dxb h TYR 151 Cb 0.02 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.04 2dxb h TYR 151 CO -0.07 0.85 -0.19 0.00 -1.64 0.00 0.00 178.16 177.11 2dxb h ARG 152 N 0.70 0.00 0.11 1.82 3.08 -1.11 -2.39 114.38 116.59 2dxb h ARG 152 Ca 0.14 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.96 2dxb h ARG 152 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.52 2dxb h ARG 152 CO 0.02 0.19 -1.16 0.00 -1.07 0.00 0.00 179.97 177.94 2dxb h ARG 153 N 0.00 0.24 0.11 0.04 3.08 -0.50 -3.43 114.38 113.92 2dxb h ARG 153 Ca -0.00 -0.41 -0.18 0.00 0.07 0.00 0.00 59.98 59.46 2dxb h ARG 153 Cb 0.45 0.15 0.01 0.00 0.08 0.00 0.00 29.97 30.66 2dxb h ARG 153 CO 0.02 1.20 -0.84 0.00 -1.07 0.00 0.00 179.97 179.28 2dxb h ARG 154 N -0.39 0.23 -0.74 0.04 3.08 -1.32 -3.40 114.38 111.89 2dxb h ARG 154 Ca -0.24 -0.40 0.16 0.00 0.07 0.00 0.00 59.98 59.56 2dxb h ARG 154 Cb 1.67 0.15 -0.11 0.00 0.08 0.00 0.00 29.97 31.77 2dxb h ARG 154 CO 0.07 1.19 0.19 1.25 -1.07 0.00 0.00 179.97 181.61 2dxb h LEU 155 N -0.47 0.04 -1.73 3.04 5.85 -1.67 0.26 115.31 120.63 2dxb h LEU 155 Ca -0.16 0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 2dxb h LEU 155 Cb 1.56 0.18 -0.00 0.00 0.37 0.00 0.00 40.66 42.77 2dxb h LEU 155 CO 0.10 -0.02 -0.13 -0.37 -0.34 0.00 0.00 178.44 177.67 2dxb h VAL 156 N 0.29 0.48 0.00 1.05 -1.51 -1.83 -2.18 116.25 112.55 2dxb h VAL 156 Ca 0.41 -0.65 -0.28 0.00 -1.23 0.00 0.00 66.70 64.95 2dxb h VAL 156 Cb 0.70 1.45 -0.05 0.00 -2.13 0.00 0.00 31.29 31.26 2dxb h VAL 156 CO -0.50 0.13 -2.07 -1.14 -1.23 0.00 0.00 177.57 172.76 2dxb n ARG 157 N -3.49 1.17 -2.79 5.19 0.63 -0.54 -4.69 116.66 112.14 2dxb n ARG 157 Ca -0.01 0.03 -0.20 0.00 -0.92 0.00 0.00 57.85 56.75 2dxb n ARG 157 Cb 0.28 -1.39 -0.01 0.00 0.45 0.00 0.00 32.46 31.79 2dxb n ARG 157 CO 0.00 0.00 0.00 0.91 -2.51 0.00 0.00 177.63 176.03 2dxb n TRP 158 N -2.73 2.28 -0.31 -0.14 8.01 0.81 -4.93 117.44 120.43 2dxb n TRP 158 Ca -0.28 -3.39 0.04 0.00 -1.31 0.00 0.00 57.50 52.56 2dxb n TRP 158 Cb 0.96 -0.33 0.18 0.00 -2.01 0.00 0.00 31.31 30.11 2dxb n TRP 158 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 2dxb h PRO 159 N 2.87 0.82 -0.74 -0.99 0.13 -1.54 -1.05 132.00 131.50 2dxb h PRO 159 Ca 0.11 -0.05 -0.04 0.00 -0.87 0.00 0.00 66.00 65.15 2dxb h PRO 159 Cb 0.90 -0.18 -0.03 0.00 0.13 0.00 0.00 31.00 31.81 2dxb h PRO 159 CO 0.68 0.54 0.32 0.00 -0.23 0.00 0.00 178.00 179.31 2dxb h ARG 160 N 0.84 1.10 -0.18 0.86 2.47 -1.92 0.61 114.38 118.16 2dxb h ARG 160 Ca 0.42 -0.19 -0.04 0.00 -1.26 0.00 0.00 59.98 58.91 2dxb h ARG 160 Cb 0.38 -0.18 -0.01 0.00 -1.65 0.00 0.00 29.97 28.51 2dxb h ARG 160 CO -0.25 0.89 -0.03 1.96 0.56 0.00 0.00 179.97 183.10 2dxb h GLN 161 N 1.06 0.35 -0.37 0.04 7.50 -1.78 -1.71 115.11 120.20 2dxb h GLN 161 Ca 0.25 -0.13 -0.02 0.00 0.50 0.00 0.00 58.65 59.25 2dxb h GLN 161 Cb 0.18 -0.02 -0.02 0.00 0.05 0.00 0.00 27.48 27.67 2dxb h GLN 161 CO -0.02 0.59 0.15 0.28 -1.50 0.00 0.00 178.83 178.33 2dxb h VAL 162 N 0.07 1.19 -0.34 -0.54 2.07 -1.07 -2.49 116.25 115.14 2dxb h VAL 162 Ca 0.05 -0.58 -0.02 0.00 0.82 0.00 0.00 66.70 66.97 2dxb h VAL 162 Cb 0.46 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 2dxb h VAL 162 CO 0.02 0.21 0.11 -0.07 0.02 0.00 0.00 177.57 177.85 2dxb h LEU 163 N 0.45 0.44 -0.89 2.57 3.38 -0.86 -2.12 115.31 118.27 2dxb h LEU 163 Ca 0.12 -0.05 -0.09 0.00 0.09 0.00 0.00 57.88 57.96 2dxb h LEU 163 Cb 0.18 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 2dxb h LEU 163 CO -0.01 0.42 -0.10 0.00 0.09 0.00 0.00 178.44 178.84 2dxb h ALA 164 N 1.65 1.07 -0.00 1.53 0.00 -0.98 0.34 119.26 122.86 2dxb h ALA 164 Ca 0.12 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 2dxb h ALA 164 Cb 0.14 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2dxb h ALA 164 CO -0.01 0.57 -0.26 0.93 0.00 0.00 0.00 179.25 180.48 2dxb h GLU 165 N 0.65 0.00 -0.00 0.00 5.08 -0.96 0.64 114.58 119.99 2dxb h GLU 165 Ca 0.11 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 2dxb h GLU 165 Cb 0.55 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2dxb h GLU 165 CO 0.03 0.27 -0.09 1.19 -1.00 0.00 0.00 179.01 179.41 2dxb n PHE 166 N -4.22 0.00 -0.47 4.33 3.72 -0.73 -4.90 117.46 115.18 2dxb n PHE 166 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 2dxb n PHE 166 Cb 0.32 -0.27 0.00 0.00 -0.94 0.00 0.00 39.48 38.58 2dxb n PHE 166 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dxb n GLY 167 N 1.33 0.72 3.31 1.37 0.00 0.22 -4.95 105.19 107.19 2dxb n GLY 167 Ca 0.12 -0.45 -0.33 0.00 0.00 0.00 0.00 46.02 45.37 2dxb n GLY 167 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dxb s LEU 168 N 0.00 2.51 -0.02 0.99 2.96 0.11 -4.96 118.68 120.27 2dxb s LEU 168 Ca 0.00 -0.41 0.01 0.00 -0.22 0.00 0.00 54.13 53.51 2dxb s LEU 168 Cb 0.00 -1.55 0.01 0.00 0.50 0.00 0.00 46.19 45.15 2dxb s LEU 168 CO 0.00 0.15 -0.03 -1.58 -1.32 0.00 0.00 176.35 173.57 2dxb s GLN 169 N 0.41 0.48 0.21 1.98 0.74 -1.26 -2.64 119.66 119.57 2dxb s GLN 169 Ca -0.12 -0.08 0.11 0.00 0.05 0.00 0.00 55.36 55.32 2dxb s GLN 169 Cb -0.16 -0.52 -0.05 0.00 1.10 0.00 0.00 33.01 33.38 2dxb s GLN 169 CO 0.06 -0.01 -0.23 -0.51 -0.55 0.00 0.00 175.29 174.04 2dxb s LEU 170 N 0.48 2.47 0.46 3.68 2.01 -1.26 -5.11 118.68 121.41 2dxb s LEU 170 Ca -0.05 -0.89 -0.24 0.00 0.01 0.00 0.00 54.13 52.96 2dxb s LEU 170 Cb -0.09 -1.17 -0.08 0.00 0.01 0.00 0.00 46.19 44.86 2dxb s LEU 170 CO -0.01 0.11 1.27 -2.65 1.01 0.00 0.00 176.35 176.08 2dxb n PRO 171 N 0.13 1.83 -0.00 1.29 -0.02 -1.26 -4.86 135.00 132.10 2dxb n PRO 171 Ca -0.11 0.66 0.17 0.00 -2.02 0.00 0.00 63.50 62.19 2dxb n PRO 171 Cb 0.57 -2.41 0.63 0.00 -0.02 0.00 0.00 33.50 32.27 2dxb n PRO 171 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2dxb h SER 172 N 1.86 0.11 0.69 2.55 4.64 -2.04 -0.90 113.55 120.46 2dxb h SER 172 Ca -0.49 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.71 2dxb h SER 172 Cb 1.30 -0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 63.35 2dxb h SER 172 CO 0.59 0.06 -0.59 1.05 -0.87 0.00 0.00 176.83 177.07 2dxb h GLU 173 N 0.12 0.00 -6.89 4.77 9.09 -2.01 -3.45 114.58 116.22 2dxb h GLU 173 Ca 0.24 0.00 -0.53 0.00 0.05 0.00 0.00 59.36 59.12 2dxb h GLU 173 Cb 0.80 0.00 0.08 0.00 -1.65 0.00 0.00 28.75 27.98 2dxb h GLU 173 CO -0.03 0.59 0.74 0.08 0.05 0.00 0.00 179.01 180.44 2dxb s VAL 174 N -3.55 2.35 -0.46 -1.06 1.01 -0.34 -4.94 120.40 113.41 2dxb s VAL 174 Ca -0.01 0.34 -0.27 0.00 0.00 0.00 0.00 61.98 62.04 2dxb s VAL 174 Cb 0.12 -3.22 0.03 0.00 0.00 0.00 0.00 36.38 33.31 2dxb s VAL 174 CO 0.75 0.08 1.02 -1.58 0.00 0.00 0.00 175.10 175.36 2dxb s GLN 175 N -1.63 3.65 -0.11 2.72 0.74 -0.70 -4.91 119.66 119.41 2dxb s GLN 175 Ca 0.53 0.38 -0.23 0.00 0.05 0.00 0.00 55.36 56.10 2dxb s GLN 175 Cb -0.44 -3.90 -0.03 0.00 1.10 0.00 0.00 33.01 29.74 2dxb s GLN 175 CO 0.56 -1.26 0.69 0.42 -0.55 0.00 0.00 175.29 175.15 2dxb s ILE 176 N 4.01 5.03 -0.16 -2.34 -1.09 -1.26 -1.44 121.20 123.95 2dxb s ILE 176 Ca 0.42 1.38 0.01 0.00 -2.23 0.00 0.00 60.65 60.23 2dxb s ILE 176 Cb -0.09 -4.02 0.01 0.00 -1.58 0.00 0.00 42.46 36.78 2dxb s ILE 176 CO 0.28 0.19 -0.19 -0.60 -1.23 0.00 0.00 174.94 173.38 2dxb s ARG 177 N 1.24 3.07 -0.19 2.79 3.52 0.24 -4.95 118.95 124.67 2dxb s ARG 177 Ca 0.35 -0.82 -0.13 0.00 -0.13 0.00 0.00 55.73 55.01 2dxb s ARG 177 Cb -0.17 -2.54 -0.05 0.00 -1.56 0.00 0.00 34.95 30.64 2dxb s ARG 177 CO 0.15 -0.06 0.25 0.08 -0.81 0.00 0.00 175.30 174.91 2dxb s VAL 178 N 0.96 5.32 -0.23 7.11 1.01 -1.26 -2.10 120.40 131.21 2dxb s VAL 178 Ca -0.03 0.44 -0.07 0.00 0.00 0.00 0.00 61.98 62.32 2dxb s VAL 178 Cb -0.15 -3.59 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 2dxb s VAL 178 CO -0.04 0.37 0.06 0.00 0.00 0.00 0.00 175.10 175.48 2dxb s ALA 179 N 0.69 3.15 -0.41 5.51 0.00 -0.49 -4.98 121.76 125.24 2dxb s ALA 179 Ca 0.14 -1.07 -0.09 0.00 0.00 0.00 0.00 51.96 50.94 2dxb s ALA 179 Cb -0.13 -2.01 0.08 0.00 0.00 0.00 0.00 23.12 21.06 2dxb s ALA 179 CO 0.03 -0.37 0.24 0.34 0.00 0.00 0.00 175.76 176.00 2dxb s ASP 180 N 1.40 5.59 -1.13 0.00 -1.08 -1.26 -1.75 116.67 118.44 2dxb s ASP 180 Ca 0.05 -1.50 -0.21 0.00 -0.52 0.00 0.00 52.55 50.37 2dxb s ASP 180 Cb -0.15 -1.97 0.06 0.00 -1.46 0.00 0.00 42.92 39.40 2dxb s ASP 180 CO 0.03 -0.52 1.58 -0.94 0.52 0.00 0.00 175.17 175.84 2dxb s SER 181 N 2.04 6.61 0.00 -0.34 1.04 -0.51 -4.72 113.70 117.82 2dxb s SER 181 Ca 0.03 -1.85 0.23 0.00 0.48 0.00 0.00 55.95 54.85 2dxb s SER 181 Cb -0.23 -2.57 0.12 0.00 0.10 0.00 0.00 66.02 63.44 2dxb s SER 181 CO 0.02 -1.40 1.18 -0.46 0.98 0.00 0.00 173.24 173.56 2dxb n ASN 182 N 8.81 2.23 0.00 7.02 6.94 -1.26 -4.74 115.26 134.26 2dxb n ASN 182 Ca 0.40 -1.62 0.00 0.00 -0.02 0.00 0.00 54.58 53.34 2dxb n ASN 182 Cb 0.49 0.31 0.00 0.00 -2.36 0.00 0.00 39.78 38.22 2dxb n ASN 182 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2dxb n GLN 183 N 0.33 0.64 0.00 -3.83 1.13 -1.26 -5.04 117.38 109.34 2dxb n GLN 183 Ca 0.11 0.00 0.12 0.00 -1.94 0.00 0.00 57.00 55.29 2dxb n GLN 183 Cb 0.50 0.00 0.25 0.00 0.11 0.00 0.00 30.24 31.09 2dxb n GLN 183 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2dxb n LYS 184 N 0.00 0.80 -2.94 -1.09 5.02 -1.26 -4.91 118.16 113.77 2dxb n LYS 184 Ca 0.00 -0.54 -0.40 0.00 -2.02 0.00 0.00 58.31 55.36 2dxb n LYS 184 Cb 0.00 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.46 2dxb n LYS 184 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2dxb s THR 185 N -2.57 4.33 0.06 -0.18 2.01 -1.26 -4.27 115.64 113.75 2dxb s THR 185 Ca 0.21 1.77 0.08 0.00 0.31 0.00 0.00 61.69 64.06 2dxb s THR 185 Cb 0.19 -4.17 -0.03 0.00 0.01 0.00 0.00 72.50 68.50 2dxb s THR 185 CO 0.57 0.52 -0.23 -0.13 -0.69 0.00 0.00 174.62 174.65 2dxb s ARG 186 N -1.12 1.51 0.19 4.92 1.81 -0.99 -4.76 118.95 120.51 2dxb s ARG 186 Ca 0.37 -1.06 0.09 0.00 -1.72 0.00 0.00 55.73 53.41 2dxb s ARG 186 Cb -0.24 -1.70 -0.04 0.00 -0.45 0.00 0.00 34.95 32.52 2dxb s ARG 186 CO 0.27 0.43 -0.19 0.71 -0.68 0.00 0.00 175.30 175.84 2dxb s TYR 187 N -0.86 1.94 0.02 -0.53 2.02 -1.26 -0.79 117.35 117.89 2dxb s TYR 187 Ca 0.10 -0.45 0.01 0.00 -0.37 0.00 0.00 57.07 56.36 2dxb s TYR 187 Cb -0.09 -0.94 -0.01 0.00 -0.40 0.00 0.00 41.96 40.51 2dxb s TYR 187 CO 0.03 0.41 -0.04 0.96 -1.57 0.00 0.00 175.55 175.33 2dxb s ILE 188 N -2.19 0.29 -0.12 2.71 -0.00 -1.16 -4.54 121.20 116.19 2dxb s ILE 188 Ca 0.19 -0.66 -0.12 0.00 -0.00 0.00 0.00 60.65 60.06 2dxb s ILE 188 Cb -0.05 -0.35 -0.05 0.00 -0.00 0.00 0.00 42.46 42.01 2dxb s ILE 188 CO 0.08 -0.25 0.27 -0.69 -0.00 0.00 0.00 174.94 174.36 2dxb s VAL 189 N -0.90 5.30 -0.57 8.37 1.01 -0.18 -1.93 120.40 131.50 2dxb s VAL 189 Ca -0.08 0.52 -0.13 0.00 0.00 0.00 0.00 61.98 62.29 2dxb s VAL 189 Cb -0.07 -3.59 0.14 0.00 0.00 0.00 0.00 36.38 32.87 2dxb s VAL 189 CO -0.00 0.49 0.49 -0.32 0.00 0.00 0.00 175.10 175.75 2dxb s MET 190 N -0.23 2.89 0.91 2.72 1.75 0.23 -4.47 119.30 123.11 2dxb s MET 190 Ca 0.17 -1.89 -0.11 0.00 -1.25 0.00 0.00 55.69 52.62 2dxb s MET 190 Cb -0.13 -4.17 0.14 0.00 2.84 0.00 0.00 34.83 33.51 2dxb s MET 190 CO 0.06 -1.27 1.10 -2.14 -0.65 0.00 0.00 175.02 172.11 2dxb s PRO 191 N 1.22 1.12 0.40 4.11 0.02 -1.26 -0.87 135.00 139.74 2dxb s PRO 191 Ca 0.07 1.09 -0.25 0.00 0.02 0.00 0.00 61.00 61.94 2dxb s PRO 191 Cb -0.25 -1.77 -0.09 0.00 0.02 0.00 0.00 34.50 32.41 2dxb s PRO 191 CO -0.00 -2.41 1.10 0.08 -0.33 0.00 0.00 177.00 175.43 2dxb s VAL 192 N -2.79 3.47 0.03 3.83 1.01 -1.26 -4.75 120.40 119.94 2dxb s VAL 192 Ca 0.64 1.18 -0.30 0.00 0.00 0.00 0.00 61.98 63.50 2dxb s VAL 192 Cb -0.20 -3.63 -0.07 0.00 0.00 0.00 0.00 36.38 32.48 2dxb s VAL 192 CO 0.58 0.05 1.52 -0.60 0.00 0.00 0.00 175.10 176.65 2dxb s ARG 193 N -2.39 4.24 0.58 2.72 3.52 -1.26 -4.82 118.95 121.53 2dxb s ARG 193 Ca 0.57 2.13 -0.17 0.00 -0.13 0.00 0.00 55.73 58.14 2dxb s ARG 193 Cb -0.26 -3.60 -0.04 0.00 -1.56 0.00 0.00 34.95 29.48 2dxb s ARG 193 CO 0.32 -0.66 1.06 -1.25 -0.81 0.00 0.00 175.30 173.96 2dxb s PRO 194 N 2.59 3.39 0.79 5.12 0.04 -1.26 -5.04 135.00 140.63 2dxb s PRO 194 Ca 0.68 1.25 -0.13 0.00 0.04 0.00 0.00 61.00 62.84 2dxb s PRO 194 Cb -0.35 -2.04 0.07 0.00 0.04 0.00 0.00 34.50 32.22 2dxb s PRO 194 CO 0.29 -0.76 1.17 -1.21 0.04 0.00 0.00 177.00 176.53 2dxb s GLU 195 N -3.91 1.84 -0.18 4.56 0.41 -1.26 -3.74 118.70 116.41 2dxb s GLU 195 Ca 0.65 1.60 0.00 0.00 -0.41 0.00 0.00 54.97 56.81 2dxb s GLU 195 Cb -0.16 -1.82 0.00 0.00 -1.78 0.00 0.00 34.13 30.37 2dxb s GLU 195 CO 0.34 -2.03 0.00 0.41 -0.49 0.00 0.00 175.26 173.49 2dxb n GLY 196 N 0.08 0.39 0.49 -1.39 0.00 -1.26 -4.71 105.19 98.79 2dxb n GLY 196 Ca 0.12 -0.89 0.07 0.00 0.00 0.00 0.00 46.02 45.32 2dxb n GLY 196 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dxb n THR 197 N -3.55 1.53 -1.82 2.61 -2.24 -1.25 -4.92 114.28 104.63 2dxb n THR 197 Ca -0.02 -2.17 -0.42 0.00 -2.27 0.00 0.00 64.05 59.17 2dxb n THR 197 Cb 0.33 0.01 -0.03 0.00 -2.10 0.00 0.00 70.33 68.53 2dxb n THR 197 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2dxb s ASP 198 N -2.65 6.48 0.00 3.42 1.01 -1.26 -2.08 116.67 121.58 2dxb s ASP 198 Ca 0.30 2.73 0.00 0.00 0.71 0.00 0.00 52.55 56.29 2dxb s ASP 198 Cb 0.29 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.63 2dxb s ASP 198 CO -0.03 -0.92 0.00 0.61 0.21 0.00 0.00 175.17 175.04 2dxb n GLY 199 N 3.93 2.02 3.69 0.21 0.00 -1.26 -5.00 105.19 108.78 2dxb n GLY 199 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 2dxb n GLY 199 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2dxb n TRP 200 N -2.00 1.66 -2.34 1.61 7.02 -0.88 -5.01 117.44 117.49 2dxb n TRP 200 Ca 0.00 0.44 -0.25 0.00 -1.02 0.00 0.00 57.50 56.67 2dxb n TRP 200 Cb 0.00 -2.26 0.10 0.00 -2.42 0.00 0.00 31.31 26.73 2dxb n TRP 200 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 2dxb s THR 201 N -1.37 2.21 0.14 -0.99 -4.23 -1.26 -4.89 115.64 105.25 2dxb s THR 201 Ca 0.74 -0.38 -0.17 0.00 -1.18 0.00 0.00 61.69 60.69 2dxb s THR 201 Cb -0.42 -2.82 -0.01 0.00 1.34 0.00 0.00 72.50 70.58 2dxb s THR 201 CO 0.48 0.00 1.79 -0.08 -0.54 0.00 0.00 174.62 176.27 2dxb h GLU 202 N -0.71 0.40 -0.69 3.99 4.81 -1.95 -1.60 114.58 118.82 2dxb h GLU 202 Ca -0.41 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 58.79 2dxb h GLU 202 Cb 1.28 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 30.54 2dxb h GLU 202 CO 0.47 0.26 0.39 -0.44 -0.73 0.00 0.00 179.01 178.96 2dxb h ASP 203 N 0.41 0.85 -0.34 1.04 3.32 -1.99 -0.15 116.42 119.56 2dxb h ASP 203 Ca 0.12 -0.06 -0.09 0.00 0.02 0.00 0.00 57.03 57.02 2dxb h ASP 203 Cb -0.02 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 2dxb h ASP 203 CO -0.05 0.68 -0.15 1.56 -1.72 0.00 0.00 179.24 179.56 2dxb h GLN 204 N 0.96 0.70 -0.10 3.56 4.20 -1.85 -2.58 115.11 120.01 2dxb h GLN 204 Ca 0.25 -0.30 -0.02 0.00 0.06 0.00 0.00 58.65 58.64 2dxb h GLN 204 Cb 0.01 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 27.76 2dxb h GLN 204 CO -0.04 0.90 -0.00 -0.07 -0.67 0.00 0.00 178.83 178.95 2dxb h LEU 205 N 0.47 0.17 -1.82 1.46 3.38 -0.99 -2.99 115.31 115.00 2dxb h LEU 205 Ca 0.08 -0.31 0.02 0.00 0.09 0.00 0.00 57.88 57.76 2dxb h LEU 205 Cb 0.69 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 2dxb h LEU 205 CO 0.05 0.44 0.16 0.00 0.09 0.00 0.00 178.44 179.18 2dxb h ALA 206 N 0.74 1.93 -0.26 1.53 0.00 -1.07 -2.50 119.26 119.62 2dxb h ALA 206 Ca 0.03 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.95 2dxb h ALA 206 Cb 0.35 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2dxb h ALA 206 CO 0.01 0.05 0.18 1.49 0.00 0.00 0.00 179.25 180.97 2dxb h GLU 207 N 0.24 0.23 -0.21 0.00 4.81 -1.30 -2.07 114.58 116.28 2dxb h GLU 207 Ca 0.10 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 2dxb h GLU 207 Cb 0.09 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.42 2dxb h GLU 207 CO -0.02 0.15 0.00 0.44 -0.73 0.00 0.00 179.01 178.86 2dxb n ILE 208 N -4.49 0.26 -3.23 2.32 -5.35 -0.94 -4.49 119.36 103.44 2dxb n ILE 208 Ca 0.02 -0.51 -0.46 0.00 -0.27 0.00 0.00 62.75 61.53 2dxb n ILE 208 Cb 0.16 0.78 -0.02 0.00 -1.74 0.00 0.00 39.64 38.83 2dxb n ILE 208 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 2dxb s VAL 209 N -1.74 5.50 0.81 7.28 1.01 -0.78 -4.23 120.40 128.25 2dxb s VAL 209 Ca 0.35 -2.54 -0.12 0.00 0.00 0.00 0.00 61.98 59.67 2dxb s VAL 209 Cb 0.20 -4.59 0.08 0.00 0.00 0.00 0.00 36.38 32.08 2dxb s VAL 209 CO 0.30 -1.19 1.17 0.42 0.00 0.00 0.00 175.10 175.79 2dxb s THR 210 N 0.39 2.03 0.16 3.92 -4.23 -1.26 -4.62 115.64 112.03 2dxb s THR 210 Ca 0.25 -0.03 -0.19 0.00 -1.18 0.00 0.00 61.69 60.54 2dxb s THR 210 Cb -0.09 -3.00 0.06 0.00 1.34 0.00 0.00 72.50 70.81 2dxb s THR 210 CO -0.08 0.00 1.66 -0.09 -0.54 0.00 0.00 174.62 175.56 2dxb h ARG 211 N -1.03 -0.10 -0.99 3.99 2.43 -1.96 -0.84 114.38 115.88 2dxb h ARG 211 Ca -0.46 0.01 0.14 0.00 -0.81 0.00 0.00 59.98 58.86 2dxb h ARG 211 Cb 1.32 0.02 -0.09 0.00 -0.42 0.00 0.00 29.97 30.81 2dxb h ARG 211 CO 0.64 -0.06 0.62 -0.44 -1.51 0.00 0.00 179.97 179.22 2dxb h ASP 212 N -0.10 0.87 -0.49 -3.80 3.32 -1.95 0.09 116.42 114.36 2dxb h ASP 212 Ca 0.16 0.06 -0.05 0.00 0.02 0.00 0.00 57.03 57.21 2dxb h ASP 212 Cb 0.35 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 2dxb h ASP 212 CO -0.38 0.43 0.12 0.00 -1.72 0.00 0.00 179.24 177.69 2dxb n LEU 214 N -4.26 0.58 -0.06 0.00 4.77 -0.06 -2.37 117.00 115.59 2dxb n LEU 214 Ca 0.04 0.60 -0.09 0.00 -0.03 0.00 0.00 56.01 56.53 2dxb n LEU 214 Cb 0.24 -0.47 -0.15 0.00 -2.33 0.00 0.00 43.42 40.71 2dxb n LEU 214 CO 0.40 -0.33 -0.88 -0.38 -1.33 0.00 0.00 177.39 174.87 2dxb n ILE 215 N -2.09 1.45 0.00 -0.08 5.41 -0.73 -1.01 119.36 122.31 2dxb n ILE 215 Ca 0.04 -0.82 0.00 0.00 1.00 0.00 0.00 62.75 62.97 2dxb n ILE 215 Cb 0.30 -0.69 0.00 0.00 -0.71 0.00 0.00 39.64 38.55 2dxb n ILE 215 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2dxb n GLY 216 N 1.66 0.64 0.16 7.39 0.00 0.04 -0.94 105.19 114.14 2dxb n GLY 216 Ca -0.26 0.00 0.12 0.00 0.00 0.00 0.00 46.02 45.88 2dxb n GLY 216 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2dxb n VAL 217 N -1.28 0.04 -3.65 1.61 0.24 -0.99 -4.70 118.33 109.61 2dxb n VAL 217 Ca 0.00 -0.10 -0.10 0.00 -2.04 0.00 0.00 64.34 62.10 2dxb n VAL 217 Cb 0.00 -0.12 -0.05 0.00 -1.47 0.00 0.00 33.84 32.20 2dxb n VAL 217 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dxb s ALA 218 N -1.96 -0.91 0.10 2.33 0.00 -1.22 -4.65 121.76 115.45 2dxb s ALA 218 Ca 0.34 -0.08 0.09 0.00 0.00 0.00 0.00 51.96 52.31 2dxb s ALA 218 Cb 0.17 0.71 -0.04 0.00 0.00 0.00 0.00 23.12 23.96 2dxb s ALA 218 CO 0.27 -0.66 -0.20 0.14 0.00 0.00 0.00 175.76 175.32 2dxb s VAL 219 N -3.81 2.71 0.39 0.00 -7.23 -1.26 -4.10 120.40 107.10 2dxb s VAL 219 Ca 0.04 -1.48 -0.26 0.00 -1.81 0.00 0.00 61.98 58.46 2dxb s VAL 219 Cb 0.02 -2.21 -0.09 0.00 0.56 0.00 0.00 36.38 34.66 2dxb s VAL 219 CO -0.11 0.15 1.29 -2.16 -0.31 0.00 0.00 175.10 173.96 2dxb s PRO 220 N -1.96 4.03 -0.02 4.82 0.04 -1.26 -4.96 135.00 135.69 2dxb s PRO 220 Ca 0.16 2.14 -0.00 0.00 0.04 0.00 0.00 61.00 63.34 2dxb s PRO 220 Cb -0.10 -2.79 0.02 0.00 0.04 0.00 0.00 34.50 31.66 2dxb s PRO 220 CO 0.08 -0.43 0.03 0.15 0.04 0.00 0.00 177.00 176.87 2dxb s LYS 221 N -2.18 -0.01 0.28 4.56 1.02 -1.26 -4.69 119.74 117.46 2dxb s LYS 221 Ca 0.56 0.14 -0.30 0.00 0.02 0.00 0.00 55.97 56.39 2dxb s LYS 221 Cb -0.38 -0.15 -0.13 0.00 -0.52 0.00 0.00 37.83 36.65 2dxb s LYS 221 CO 0.49 -0.11 1.33 -2.30 -0.92 0.00 0.00 175.35 173.83 2dxb n PRO 222 N 3.79 2.00 0.00 -1.68 -0.02 -1.26 -1.38 135.00 136.44 2dxb n PRO 222 Ca -0.22 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 2dxb n PRO 222 Cb 0.54 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 2dxb n PRO 222 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dxb n GLY 223 N 1.56 3.27 3.43 -1.23 0.00 -1.26 -5.00 105.19 105.96 2dxb n GLY 223 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 2dxb n GLY 223 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dxb s ILE 224 N -2.17 4.92 -0.18 -0.61 1.09 -0.48 -4.91 121.20 118.85 2dxb s ILE 224 Ca 0.00 -0.67 0.06 0.00 -1.10 0.00 0.00 60.65 58.93 2dxb s ILE 224 Cb 0.00 -3.70 0.12 0.00 -1.06 0.00 0.00 42.46 37.82 2dxb s ILE 224 CO 0.00 -0.21 1.08 0.35 -0.10 0.00 0.00 174.94 176.06 2dxb n THR 225 N 5.07 1.20 -3.99 2.92 -2.24 -1.26 -4.41 114.28 111.57 2dxb n THR 225 Ca -0.12 -1.24 -0.09 0.00 -2.27 0.00 0.00 64.05 60.33 2dxb n THR 225 Cb 0.47 0.35 -0.10 0.00 -2.10 0.00 0.00 70.33 68.95 2dxb n THR 225 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2dxb s VAL 226 N -1.38 0.14 0.75 2.28 0.11 -1.26 -4.90 120.40 116.14 2dxb s VAL 226 Ca 0.11 -1.18 -0.15 0.00 -2.93 0.00 0.00 61.98 57.83 2dxb s VAL 226 Cb 0.08 -0.77 0.05 0.00 -1.53 0.00 0.00 36.38 34.21 2dxb s VAL 226 CO 0.03 -0.65 1.24 0.20 -3.33 0.00 0.00 175.10 172.59 2dxb s ASN 227 N -2.02 3.94 0.36 3.54 0.01 -1.26 -4.89 114.94 114.63 2dxb s ASN 227 Ca -0.07 2.46 -0.28 0.00 -0.71 0.00 0.00 52.86 54.26 2dxb s ASN 227 Cb -0.03 -2.60 -0.11 0.00 0.41 0.00 0.00 41.25 38.92 2dxb s ASN 227 CO -0.04 -2.44 1.45 0.00 -1.51 0.00 0.00 177.10 174.56 2dxb n ALA 228 N -2.81 2.12 -2.12 0.60 0.00 -1.26 -4.90 120.51 112.14 2dxb n ALA 228 Ca 0.14 0.35 -0.42 0.00 0.00 0.00 0.00 53.44 53.51 2dxb n ALA 228 Cb 0.50 -2.38 -0.03 0.00 0.00 0.00 0.00 19.45 17.53 2dxb n ALA 228 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2dxb s LYS 229 N -1.96 4.32 0.11 0.00 2.20 -1.26 -5.01 119.74 118.13 2dxb s LYS 229 Ca 0.54 2.10 -0.05 0.00 -0.36 0.00 0.00 55.97 58.21 2dxb s LYS 229 Cb -0.50 -3.23 -0.02 0.00 -1.51 0.00 0.00 37.83 32.57 2dxb s LYS 229 CO 0.63 -0.43 0.12 -0.98 -0.36 0.00 0.00 175.35 174.33 2dxb s ARG 230 N 0.94 0.88 0.30 4.03 1.70 -1.26 -5.13 118.95 120.40 2dxb s ARG 230 Ca 0.64 -1.19 -0.28 0.00 -0.47 0.00 0.00 55.73 54.43 2dxb s ARG 230 Cb -0.37 0.29 -0.14 0.00 -0.57 0.00 0.00 34.95 34.16 2dxb s ARG 230 CO 0.31 -0.26 1.00 -2.30 -1.08 0.00 0.00 175.30 172.97 2dxb n PRO 231 N -0.06 1.34 -4.06 3.89 -0.02 -1.26 -4.97 135.00 129.86 2dxb n PRO 231 Ca -0.11 0.47 -0.34 0.00 -2.02 0.00 0.00 63.50 61.51 2dxb n PRO 231 Cb 0.62 -1.84 -0.15 0.00 -0.02 0.00 0.00 33.50 32.11 2dxb n PRO 231 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2dxb s VAL 232 N -1.07 2.42 -0.17 -1.45 1.01 -1.26 -5.10 120.40 114.78 2dxb s VAL 232 Ca 0.59 -0.88 -0.23 0.00 0.00 0.00 0.00 61.98 61.45 2dxb s VAL 232 Cb -0.70 -2.08 -0.02 0.00 0.00 0.00 0.00 36.38 33.59 2dxb s VAL 232 CO 0.60 0.46 0.74 -0.22 0.00 0.00 0.00 175.10 176.67 2dxb s LEU 233 N 1.32 4.17 0.31 3.92 2.96 -1.26 -5.04 118.68 125.07 2dxb s LEU 233 Ca 0.04 1.03 -0.27 0.00 -0.22 0.00 0.00 54.13 54.72 2dxb s LEU 233 Cb -0.14 -3.08 -0.10 0.00 0.50 0.00 0.00 46.19 43.38 2dxb s LEU 233 CO -0.10 -0.32 0.97 -0.54 -1.32 0.00 0.00 176.35 175.04 2dxb s LYS 234 N 1.93 4.60 0.46 1.98 1.02 -1.26 -5.06 119.74 123.42 2dxb s LYS 234 Ca 0.34 1.42 -0.06 0.00 0.02 0.00 0.00 55.97 57.69 2dxb s LYS 234 Cb -0.16 -2.90 -0.04 0.00 -0.52 0.00 0.00 37.83 34.20 2dxb s LYS 234 CO 0.12 0.28 0.78 0.00 -0.92 0.00 0.00 175.35 175.61 2dxb s ALA 235 N -1.49 3.39 0.06 5.17 0.00 -1.26 -5.00 121.76 122.62 2dxb s ALA 235 Ca 0.49 -0.44 -0.19 0.00 0.00 0.00 0.00 51.96 51.82 2dxb s ALA 235 Cb -0.22 -2.62 -0.12 0.00 0.00 0.00 0.00 23.12 20.17 2dxb s ALA 235 CO 0.27 -0.28 1.38 -0.97 0.00 0.00 0.00 175.76 176.17 2dxb h ASN 236 N 0.46 0.48 -2.51 0.00 -1.24 -2.03 -3.37 115.58 107.37 2dxb h ASN 236 Ca -0.47 -0.46 -0.60 0.00 0.71 0.00 0.00 56.30 55.49 2dxb h ASN 236 Cb 1.20 -0.13 -0.39 0.00 0.73 0.00 0.00 38.32 39.72 2dxb h ASN 236 CO 0.62 0.84 -0.87 -1.14 -1.29 0.00 0.00 177.43 175.59 2dxb n ARG 237 N -4.49 0.76 -1.55 6.67 0.63 -1.26 -5.13 116.66 112.30 2dxb n ARG 237 Ca -0.05 -3.58 -0.36 0.00 -0.92 0.00 0.00 57.85 52.93 2dxb n ARG 237 Cb 0.37 -1.81 0.08 0.00 0.45 0.00 0.00 32.46 31.56 2dxb n ARG 237 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 2dxb n PRO 238 N 2.39 0.83 0.00 -0.14 -0.04 -1.26 -5.26 135.00 131.52 2dxb n PRO 238 Ca 0.27 0.35 0.10 0.00 -0.04 0.00 0.00 63.50 64.17 2dxb n PRO 238 Cb 0.45 -2.46 0.57 0.00 -0.04 0.00 0.00 33.50 32.02 2dxb n PRO 238 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74