#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dxb s SER 25 N 0.00 6.04 0.51 4.52 1.04 -1.26 -4.99 113.70 119.56 2dxb s SER 25 Ca 0.00 -0.13 0.15 0.00 0.48 0.00 0.00 55.95 56.45 2dxb s SER 25 Cb 0.00 -1.36 1.23 0.00 0.10 0.00 0.00 66.02 65.99 2dxb s SER 25 CO 0.00 -0.36 2.14 0.44 0.98 0.00 0.00 173.24 176.44 2dxb h ASP 26 N 0.95 0.05 -0.33 7.02 3.32 -2.05 -1.56 116.42 123.81 2dxb h ASP 26 Ca -0.47 -0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.49 2dxb h ASP 26 Cb 1.25 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.78 2dxb h ASP 26 CO 0.54 0.03 -0.14 -0.26 -1.72 0.00 0.00 179.24 177.69 2dxb h PHE 27 N 0.05 0.77 -0.15 4.55 0.04 -1.99 -1.82 116.94 118.40 2dxb h PHE 27 Ca 0.02 -0.19 -0.11 0.00 2.80 0.00 0.00 57.97 60.50 2dxb h PHE 27 Cb 0.03 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 37.98 2dxb h PHE 27 CO -0.00 0.88 -0.38 0.93 -0.60 0.00 0.00 178.31 179.14 2dxb h GLU 28 N 0.44 0.33 -0.40 1.51 5.08 -1.74 0.75 114.58 120.56 2dxb h GLU 28 Ca 0.07 -0.15 -0.09 0.00 -1.00 0.00 0.00 59.36 58.19 2dxb h GLU 28 Cb 0.67 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.90 2dxb h GLU 28 CO 0.05 0.67 -0.10 0.82 -1.00 0.00 0.00 179.01 179.44 2dxb h ILE 29 N 0.28 1.28 -0.11 3.13 2.04 -1.24 -2.12 117.51 120.77 2dxb h ILE 29 Ca 0.03 -1.20 -0.17 0.00 1.00 0.00 0.00 64.86 64.51 2dxb h ILE 29 Cb 0.80 1.22 -0.01 0.00 -0.74 0.00 0.00 36.82 38.10 2dxb h ILE 29 CO 0.06 0.40 -0.66 0.25 0.00 0.00 0.00 178.15 178.20 2dxb h LEU 30 N 0.59 0.51 -0.45 1.44 5.85 -1.09 -1.97 115.31 120.19 2dxb h LEU 30 Ca 0.10 -0.31 -0.01 0.00 0.84 0.00 0.00 57.88 58.50 2dxb h LEU 30 Cb 0.63 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 2dxb h LEU 30 CO 0.04 1.04 0.25 -0.08 -0.34 0.00 0.00 178.44 179.34 2dxb h GLU 31 N 0.32 0.64 -0.17 1.25 4.22 -0.78 -0.22 114.58 119.84 2dxb h GLU 31 Ca -0.02 -0.08 0.00 0.00 0.08 0.00 0.00 59.36 59.35 2dxb h GLU 31 Cb 1.22 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 2dxb h GLU 31 CO 0.12 0.51 0.11 0.52 -2.18 0.00 0.00 179.01 178.08 2dxb h MET 32 N 0.60 0.23 -0.26 1.92 2.86 -1.30 -1.34 114.93 117.63 2dxb h MET 32 Ca 0.16 -0.02 0.03 0.00 -2.06 0.00 0.00 59.70 57.81 2dxb h MET 32 Cb 0.06 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.64 2dxb h MET 32 CO -0.02 0.18 0.08 0.00 1.06 0.00 0.00 176.91 178.20 2dxb h ALA 33 N 1.04 0.28 -0.06 6.32 0.00 -1.03 -1.26 119.26 124.55 2dxb h ALA 33 Ca 0.06 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 2dxb h ALA 33 Cb 0.00 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 2dxb h ALA 33 CO -0.01 -0.33 0.02 0.28 0.00 0.00 0.00 179.25 179.20 2dxb h VAL 34 N 0.19 1.15 -0.30 0.00 2.07 -0.93 -1.65 116.25 116.78 2dxb h VAL 34 Ca 0.11 -0.44 0.02 0.00 0.82 0.00 0.00 66.70 67.22 2dxb h VAL 34 Cb 0.09 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.18 2dxb h VAL 34 CO -0.13 0.12 0.16 -0.09 0.02 0.00 0.00 177.57 177.65 2dxb h ARG 35 N -0.08 0.32 -0.61 1.57 2.43 -1.13 -0.67 114.38 116.20 2dxb h ARG 35 Ca 0.02 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 2dxb h ARG 35 Cb 0.18 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.63 2dxb h ARG 35 CO -0.00 0.21 0.28 0.93 -1.51 0.00 0.00 179.97 179.88 2dxb h GLU 36 N 0.33 0.88 -0.53 0.20 5.08 -1.20 -1.90 114.58 117.44 2dxb h GLU 36 Ca 0.12 -0.14 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 2dxb h GLU 36 Cb 0.03 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 2dxb h GLU 36 CO -0.08 0.72 0.15 -0.07 -1.00 0.00 0.00 179.01 178.74 2dxb h LEU 37 N 0.83 0.78 -0.73 1.33 3.38 -1.05 0.76 115.31 120.62 2dxb h LEU 37 Ca 0.21 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 2dxb h LEU 37 Cb 0.14 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 2dxb h LEU 37 CO -0.02 0.79 0.38 0.00 0.09 0.00 0.00 178.44 179.68 2dxb h ALA 38 N 1.02 0.93 -0.22 1.53 0.00 -0.92 -0.47 119.26 121.13 2dxb h ALA 38 Ca 0.17 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.82 2dxb h ALA 38 Cb 0.30 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2dxb h ALA 38 CO -0.00 0.47 -0.36 0.82 0.00 0.00 0.00 179.25 180.18 2dxb h ILE 39 N 1.01 1.32 -0.90 0.00 2.04 -1.19 -0.16 117.51 119.63 2dxb h ILE 39 Ca 0.25 -1.57 0.06 0.00 1.00 0.00 0.00 64.86 64.60 2dxb h ILE 39 Cb 0.07 1.79 -0.06 0.00 -0.74 0.00 0.00 36.82 37.89 2dxb h ILE 39 CO -0.04 0.49 0.58 -0.33 0.00 0.00 0.00 178.15 178.86 2dxb h GLU 40 N 0.33 1.00 -0.07 2.37 5.08 -0.57 -0.62 114.58 122.10 2dxb h GLU 40 Ca 0.02 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2dxb h GLU 40 Cb 0.95 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.98 2dxb h GLU 40 CO 0.08 0.66 0.00 1.63 -1.00 0.00 0.00 179.01 180.38 2dxb n LYS 41 N -4.48 1.37 -1.69 2.33 4.76 -0.21 -4.92 118.16 115.32 2dxb n LYS 41 Ca 0.13 -0.56 -0.12 0.00 -2.87 0.00 0.00 58.31 54.89 2dxb n LYS 41 Cb 0.19 -1.38 -0.04 0.00 -1.84 0.00 0.00 35.03 31.97 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 0.99 0.77 0.21 0.72 0.00 -0.24 -4.90 105.19 102.75 2dxb n GLY 42 Ca 0.16 -0.42 -0.11 0.00 0.00 0.00 0.00 46.02 45.66 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 0.65 -7.12 0.99 3.38 -1.26 -3.46 115.31 108.49 2dxb h LEU 43 Ca -0.27 -0.37 -0.04 0.00 0.09 0.00 0.00 57.88 57.29 2dxb h LEU 43 Cb 0.96 -0.19 -0.13 0.00 0.09 0.00 0.00 40.66 41.39 2dxb h LEU 43 CO 0.36 1.10 0.12 0.72 0.09 0.00 0.00 178.44 180.83 2dxb s PHE 44 N -3.91 -0.45 0.33 1.13 -0.12 -1.24 -5.05 117.98 108.66 2dxb s PHE 44 Ca -0.08 0.29 0.02 0.00 -0.05 0.00 0.00 56.93 57.11 2dxb s PHE 44 Cb 0.11 0.45 -0.03 0.00 -0.63 0.00 0.00 43.02 42.92 2dxb s PHE 44 CO 0.85 -0.77 0.51 -1.54 -0.05 0.00 0.00 175.22 174.22 2dxb s SER 45 N -2.57 6.26 0.44 1.98 1.04 -1.26 -4.08 113.70 115.52 2dxb s SER 45 Ca -0.00 0.33 0.12 0.00 0.48 0.00 0.00 55.95 56.88 2dxb s SER 45 Cb -0.00 -1.94 1.01 0.00 0.10 0.00 0.00 66.02 65.19 2dxb s SER 45 CO -0.10 -0.27 2.05 0.00 0.98 0.00 0.00 173.24 175.90 2dxb h ALA 46 N 0.84 1.90 -0.39 5.32 0.00 -1.98 -0.66 119.26 124.29 2dxb h ALA 46 Ca -0.50 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.31 2dxb h ALA 46 Cb 1.22 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 2dxb h ALA 46 CO 0.61 0.04 -0.08 0.93 0.00 0.00 0.00 179.25 180.75 2dxb h GLU 47 N 0.39 0.74 -0.56 0.00 3.07 -1.99 -1.89 114.58 114.34 2dxb h GLU 47 Ca 0.17 -0.28 0.05 0.00 -0.50 0.00 0.00 59.36 58.81 2dxb h GLU 47 Cb 0.20 -0.05 -0.05 0.00 -0.84 0.00 0.00 28.75 28.02 2dxb h GLU 47 CO -0.04 0.87 0.29 -0.44 -1.40 0.00 0.00 179.01 178.29 2dxb h ASP 48 N 0.55 0.42 -0.57 1.42 3.32 -1.52 0.27 116.42 120.31 2dxb h ASP 48 Ca 0.10 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 2dxb h ASP 48 Cb 0.59 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 40.07 2dxb h ASP 48 CO 0.04 0.28 0.33 -0.74 -1.72 0.00 0.00 179.24 177.42 2dxb h HIS 49 N 0.55 0.77 -0.59 4.55 2.76 -1.23 -0.78 115.15 121.18 2dxb h HIS 49 Ca 0.25 -0.01 -0.09 0.00 -2.20 0.00 0.00 60.37 58.32 2dxb h HIS 49 Cb 0.16 -0.25 -0.02 0.00 1.55 0.00 0.00 27.41 28.85 2dxb h HIS 49 CO -0.10 0.54 0.02 0.00 -1.30 0.00 0.00 177.93 177.10 2dxb h ARG 50 N 0.77 1.03 -0.68 5.26 3.08 -0.64 -2.21 114.38 121.00 2dxb h ARG 50 Ca 0.20 -0.32 -0.00 0.00 0.07 0.00 0.00 59.98 59.93 2dxb h ARG 50 Cb 0.01 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 29.93 2dxb h ARG 50 CO -0.04 1.01 0.41 0.28 -1.07 0.00 0.00 179.97 180.56 2dxb h VAL 51 N 0.93 1.20 -0.44 2.04 2.07 -0.03 -1.63 116.25 120.39 2dxb h VAL 51 Ca 0.17 -0.44 -0.09 0.00 0.82 0.00 0.00 66.70 67.16 2dxb h VAL 51 Cb 0.53 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 2dxb h VAL 51 CO 0.03 0.20 -0.09 -0.25 0.02 0.00 0.00 177.57 177.48 2dxb h TRP 52 N 0.93 0.94 -0.11 1.57 2.91 -0.98 -1.41 115.95 119.81 2dxb h TRP 52 Ca 0.24 -0.20 -0.04 0.00 1.13 0.00 0.00 58.89 60.03 2dxb h TRP 52 Cb -0.03 -0.23 -0.01 0.00 -0.51 0.00 0.00 29.16 28.38 2dxb h TRP 52 CO -0.01 0.94 -0.13 0.87 -1.03 0.00 0.00 178.44 179.08 2dxb h LYS 53 N 0.67 0.16 -0.13 2.65 1.57 -1.21 0.01 116.57 120.30 2dxb h LYS 53 Ca 0.11 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.80 2dxb h LYS 53 Cb 0.62 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.90 2dxb h LYS 53 CO 0.04 0.30 -0.15 -0.44 -0.57 0.00 0.00 179.45 178.63 2dxb h ASP 54 N 0.16 0.36 0.08 0.86 3.32 -1.01 -1.87 116.42 118.31 2dxb h ASP 54 Ca 0.03 -0.49 0.02 0.00 0.02 0.00 0.00 57.03 56.61 2dxb h ASP 54 Cb 0.32 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.74 2dxb h ASP 54 CO 0.02 0.78 -0.22 0.22 -1.72 0.00 0.00 179.24 178.32 2dxb h TYR 55 N -0.05 -0.58 -0.82 4.55 3.20 -0.74 -1.95 116.97 120.58 2dxb h TYR 55 Ca 0.02 0.01 0.14 0.00 3.14 0.00 0.00 58.73 62.04 2dxb h TYR 55 Cb 0.68 0.25 -0.09 0.00 1.54 0.00 0.00 36.73 39.11 2dxb h TYR 55 CO 0.09 -0.31 0.41 0.28 -1.64 0.00 0.00 178.16 176.98 2dxb h VAL 56 N -0.39 0.73 0.00 1.81 2.07 -1.00 -0.02 116.25 119.44 2dxb h VAL 56 Ca 0.04 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.34 2dxb h VAL 56 Cb 0.43 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.28 2dxb h VAL 56 CO -0.15 0.11 -0.05 -0.74 0.02 0.00 0.00 177.57 176.77 2dxb h HIS 57 N 0.59 0.00 0.00 1.57 -0.00 -0.57 -1.15 115.15 115.59 2dxb h HIS 57 Ca 0.44 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.81 2dxb h HIS 57 Cb 0.62 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.03 2dxb h HIS 57 CO -0.11 0.05 -0.22 0.25 -0.00 0.00 0.00 177.93 177.90 2dxb n THR 58 N -3.86 0.28 -2.12 6.26 -2.24 -0.03 -4.90 114.28 107.67 2dxb n THR 58 Ca -0.03 -0.16 -0.34 0.00 -2.27 0.00 0.00 64.05 61.26 2dxb n THR 58 Cb 0.14 -0.33 0.01 0.00 -2.10 0.00 0.00 70.33 68.05 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 -3.79 3.61 -0.05 3.22 1.43 -0.44 -5.04 118.68 117.63 2dxb s LEU 59 Ca 0.11 2.02 -0.30 0.00 -1.03 0.00 0.00 54.13 54.93 2dxb s LEU 59 Cb 0.15 -4.56 0.11 0.00 0.03 0.00 0.00 46.19 41.92 2dxb s LEU 59 CO 0.62 -1.26 1.33 -0.83 0.23 0.00 0.00 176.35 176.44 2dxb s GLY 60 N -2.22 -0.26 0.00 -3.19 0.00 -1.26 -4.80 107.32 95.59 2dxb s GLY 60 Ca 0.69 0.34 0.27 0.00 0.00 0.00 0.00 44.72 46.02 2dxb s GLY 60 CO 0.32 4.05 1.69 -1.55 0.00 0.00 0.00 173.10 177.60 2dxb n PRO 61 N -0.78 0.08 -0.27 2.90 -0.04 -0.91 -3.15 135.00 132.83 2dxb n PRO 61 Ca -0.00 -0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.43 2dxb n PRO 61 Cb 0.60 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.69 2dxb n PRO 61 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2dxb h LEU 62 N 0.07 0.65 -0.67 1.53 5.85 -1.88 -2.08 115.31 118.78 2dxb h LEU 62 Ca 0.00 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.78 2dxb h LEU 62 Cb 0.49 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.38 2dxb h LEU 62 CO 0.00 0.41 0.42 -0.65 -0.34 0.00 0.00 178.44 178.28 2dxb h PRO 63 N 0.78 0.80 -0.67 5.25 0.11 -1.76 -0.92 132.00 135.59 2dxb h PRO 63 Ca 0.34 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 66.32 2dxb h PRO 63 Cb 0.23 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 31.14 2dxb h PRO 63 CO -0.20 0.53 0.09 0.00 -0.21 0.00 0.00 178.00 178.21 2dxb h ALA 64 N 1.28 0.89 -0.72 -0.75 0.00 -1.32 -1.34 119.26 117.30 2dxb h ALA 64 Ca 0.27 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2dxb h ALA 64 Cb 0.01 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 2dxb h ALA 64 CO -0.10 0.67 0.32 0.00 0.00 0.00 0.00 179.25 180.15 2dxb h ALA 65 N 1.05 1.21 -0.17 0.00 0.00 -0.97 -1.90 119.26 118.48 2dxb h ALA 65 Ca 0.20 -0.16 -0.13 0.00 0.00 0.00 0.00 54.91 54.82 2dxb h ALA 65 Cb 0.47 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2dxb h ALA 65 CO 0.02 0.59 -0.47 0.00 0.00 0.00 0.00 179.25 179.39 2dxb h ARG 66 N 1.03 0.44 -0.72 0.00 3.08 -0.81 -1.67 114.38 115.72 2dxb h ARG 66 Ca 0.25 -0.24 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 2dxb h ARG 66 Cb 0.14 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.17 2dxb h ARG 66 CO -0.03 0.81 0.24 1.25 -1.07 0.00 0.00 179.97 181.17 2dxb h LEU 67 N 0.35 1.04 -0.50 3.04 6.46 -0.68 -0.16 115.31 124.86 2dxb h LEU 67 Ca 0.02 -0.20 -0.07 0.00 -0.12 0.00 0.00 57.88 57.51 2dxb h LEU 67 Cb 0.96 -0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 40.60 2dxb h LEU 67 CO 0.08 0.96 0.05 0.58 -0.62 0.00 0.00 178.44 179.50 2dxb h VAL 68 N 1.06 1.26 -0.33 1.05 2.07 -1.15 -1.23 116.25 118.97 2dxb h VAL 68 Ca 0.23 -0.99 -0.02 0.00 0.82 0.00 0.00 66.70 66.74 2dxb h VAL 68 Cb 0.29 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 2dxb h VAL 68 CO -0.01 0.35 0.13 0.00 0.02 0.00 0.00 177.57 178.06 2dxb h ALA 69 N 0.95 0.43 -0.64 1.67 0.00 -1.00 -1.19 119.26 119.49 2dxb h ALA 69 Ca 0.15 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2dxb h ALA 69 Cb 0.44 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 2dxb h ALA 69 CO 0.02 0.04 0.34 0.87 0.00 0.00 0.00 179.25 180.51 2dxb h LYS 70 N 0.39 0.90 -0.73 0.00 1.57 -0.94 -2.23 116.57 115.54 2dxb h LYS 70 Ca 0.11 -0.12 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2dxb h LYS 70 Cb 0.19 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.29 2dxb h LYS 70 CO -0.01 0.70 0.41 0.00 -0.57 0.00 0.00 179.45 179.98 2dxb h ALA 71 N 1.16 1.35 -0.20 3.86 0.00 -0.99 0.15 119.26 124.57 2dxb h ALA 71 Ca 0.22 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 2dxb h ALA 71 Cb 0.07 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2dxb h ALA 71 CO -0.03 0.54 -0.11 -1.49 0.00 0.00 0.00 179.25 178.16 2dxb h TRP 72 N 1.02 0.34 0.00 0.00 6.55 -0.65 -3.07 115.95 120.14 2dxb h TRP 72 Ca 0.26 -0.04 0.00 0.00 0.95 0.00 0.00 58.89 60.06 2dxb h TRP 72 Cb 0.01 -0.10 0.00 0.00 -0.86 0.00 0.00 29.16 28.21 2dxb h TRP 72 CO 0.01 0.43 -1.09 1.28 -1.05 0.00 0.00 178.44 178.02 2dxb n LEU 73 N -4.26 0.60 -3.75 -4.49 4.77 -0.71 -4.83 117.00 104.32 2dxb n LEU 73 Ca -0.00 0.01 -0.29 0.00 -0.03 0.00 0.00 56.01 55.71 2dxb n LEU 73 Cb 0.27 -0.09 -0.16 0.00 -2.33 0.00 0.00 43.42 41.12 2dxb n LEU 73 CO 0.38 0.02 -0.36 -0.62 -1.33 0.00 0.00 177.39 175.48 2dxb s ASP 74 N -4.10 3.41 0.24 -1.43 -1.08 0.43 -5.03 116.67 109.11 2dxb s ASP 74 Ca 0.03 -1.14 -0.04 0.00 -0.52 0.00 0.00 52.55 50.87 2dxb s ASP 74 Cb 0.14 -0.75 0.40 0.00 -1.46 0.00 0.00 42.92 41.25 2dxb s ASP 74 CO 0.81 -0.34 1.81 -0.65 0.52 0.00 0.00 175.17 177.32 2dxb h PRO 75 N 8.16 0.78 -0.31 4.34 0.11 -1.87 -1.29 132.00 141.93 2dxb h PRO 75 Ca -0.16 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 65.80 2dxb h PRO 75 Cb 1.08 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.00 2dxb h PRO 75 CO 0.39 0.52 -0.26 0.93 -0.21 0.00 0.00 178.00 179.37 2dxb h GLU 76 N 0.80 0.61 -0.51 1.05 4.39 -1.95 -1.86 114.58 117.11 2dxb h GLU 76 Ca 0.40 -0.25 -0.12 0.00 0.34 0.00 0.00 59.36 59.73 2dxb h GLU 76 Cb 0.35 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.96 2dxb h GLU 76 CO -0.24 0.81 -0.16 -0.92 -1.16 0.00 0.00 179.01 177.34 2dxb h TYR 77 N 0.53 1.14 -0.82 4.33 3.20 -1.77 -2.26 116.97 121.32 2dxb h TYR 77 Ca 0.07 -0.26 0.01 0.00 3.14 0.00 0.00 58.73 61.70 2dxb h TYR 77 Cb 0.72 -0.27 -0.04 0.00 1.54 0.00 0.00 36.73 38.68 2dxb h TYR 77 CO 0.03 1.08 0.54 -0.22 -1.64 0.00 0.00 178.16 177.95 2dxb h LYS 78 N 0.87 1.06 -0.90 1.82 3.64 -0.99 0.84 116.57 122.91 2dxb h LYS 78 Ca 0.12 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.44 2dxb h LYS 78 Cb 0.73 -0.24 -0.04 0.00 -0.41 0.00 0.00 32.23 32.27 2dxb h LYS 78 CO 0.06 0.70 0.56 0.87 -2.27 0.00 0.00 179.45 179.37 2dxb h LYS 79 N 1.09 1.21 -0.52 1.90 1.57 -1.09 -0.87 116.57 119.86 2dxb h LYS 79 Ca 0.31 -0.10 -0.08 0.00 -1.87 0.00 0.00 60.65 58.91 2dxb h LYS 79 Cb -0.09 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 31.94 2dxb h LYS 79 CO -0.08 0.83 0.03 1.25 -0.57 0.00 0.00 179.45 180.92 2dxb h LEU 80 N 1.23 0.88 -0.29 2.94 5.85 -0.73 -1.31 115.31 123.88 2dxb h LEU 80 Ca 0.33 -0.29 0.03 0.00 0.84 0.00 0.00 57.88 58.78 2dxb h LEU 80 Cb -0.08 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.69 2dxb h LEU 80 CO -0.06 0.96 0.12 0.00 -0.34 0.00 0.00 178.44 179.11 2dxb h ILE 82 N 0.25 1.24 0.02 0.00 1.08 -1.02 -3.22 117.51 115.86 2dxb h ILE 82 Ca 0.13 -0.77 -0.27 0.00 -0.39 0.00 0.00 64.86 63.56 2dxb h ILE 82 Cb 0.08 0.58 -0.04 0.00 -3.07 0.00 0.00 36.82 34.37 2dxb h ILE 82 CO -0.11 0.30 -1.46 -0.08 -0.69 0.00 0.00 178.15 176.11 2dxb h GLU 83 N 0.87 0.03 -1.81 2.37 4.57 -0.98 -3.44 114.58 116.20 2dxb h GLU 83 Ca 0.20 -0.06 -0.40 0.00 -1.18 0.00 0.00 59.36 57.93 2dxb h GLU 83 Cb 0.24 0.02 -0.29 0.00 -0.16 0.00 0.00 28.75 28.56 2dxb h GLU 83 CO -0.01 0.75 -0.76 0.34 -1.18 0.00 0.00 179.01 178.14 2dxb s ASP 84 N -6.42 0.33 0.28 1.04 -1.08 0.28 -5.01 116.67 106.10 2dxb s ASP 84 Ca -0.04 -2.38 0.02 0.00 -0.52 0.00 0.00 52.55 49.64 2dxb s ASP 84 Cb 0.09 0.55 0.62 0.00 -1.46 0.00 0.00 42.92 42.72 2dxb s ASP 84 CO 0.82 -0.14 1.79 1.23 0.52 0.00 0.00 175.17 179.39 2dxb h GLY 85 N 5.61 1.63 0.97 2.66 0.00 -1.55 -1.97 103.07 110.41 2dxb h GLY 85 Ca 0.16 -0.35 -0.00 0.00 0.00 0.00 0.00 47.33 47.15 2dxb h GLY 85 CO 0.22 0.01 0.06 -2.08 0.00 0.00 0.00 176.54 174.74 2dxb h VAL 86 N 0.79 1.05 -0.13 4.60 2.07 -1.90 -0.87 116.25 121.87 2dxb h VAL 86 Ca 0.52 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.90 2dxb h VAL 86 Cb 0.71 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 31.45 2dxb h VAL 86 CO -0.34 0.05 0.06 -0.08 0.02 0.00 0.00 177.57 177.28 2dxb h GLU 87 N 0.09 0.19 -0.75 1.57 4.57 -1.83 -2.98 114.58 115.45 2dxb h GLU 87 Ca 0.03 -0.03 0.04 0.00 -1.18 0.00 0.00 59.36 58.23 2dxb h GLU 87 Cb 0.03 -0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 28.54 2dxb h GLU 87 CO -0.01 0.26 0.49 0.00 -1.18 0.00 0.00 179.01 178.57 2dxb h ALA 88 N 0.92 1.60 -0.13 2.92 0.00 -1.25 -2.13 119.26 121.20 2dxb h ALA 88 Ca 0.04 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.96 2dxb h ALA 88 Cb 0.13 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2dxb h ALA 88 CO -0.01 0.31 0.10 1.03 0.00 0.00 0.00 179.25 180.69 2dxb h SER 89 N 0.87 0.00 -0.45 0.00 0.87 -0.99 -1.39 113.55 112.46 2dxb h SER 89 Ca 0.31 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.86 2dxb h SER 89 Cb 0.12 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.06 2dxb h SER 89 CO -0.09 0.00 0.25 0.11 -0.53 0.00 0.00 176.83 176.57 2dxb h LYS 90 N 0.00 0.65 0.00 2.24 1.57 -1.35 -1.84 116.57 117.84 2dxb h LYS 90 Ca 0.06 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2dxb h LYS 90 Cb 0.27 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.45 2dxb h LYS 90 CO -0.00 0.48 0.00 0.00 -0.57 0.00 0.00 179.45 179.36 2dxb n ALA 91 N -2.46 1.09 -1.17 3.86 0.00 -0.52 -1.15 120.51 120.15 2dxb n ALA 91 Ca 0.04 0.18 0.08 0.00 0.00 0.00 0.00 53.44 53.74 2dxb n ALA 91 Cb 0.10 -1.30 0.18 0.00 0.00 0.00 0.00 19.45 18.43 2dxb n ALA 91 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2dxb n VAL 92 N -2.21 2.09 -0.99 0.00 0.24 -0.72 -4.98 118.33 111.76 2dxb n VAL 92 Ca -0.01 -2.36 0.00 0.00 -2.04 0.00 0.00 64.34 59.92 2dxb n VAL 92 Cb 0.05 -0.25 0.00 0.00 -1.47 0.00 0.00 33.84 32.16 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 -1.15 0.61 3.17 7.63 0.00 -0.30 -4.88 105.19 110.27 2dxb n GLY 93 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.49 3.24 -0.41 1.61 1.01 -1.01 -4.99 120.40 117.37 2dxb s VAL 94 Ca 0.00 -1.57 -0.14 0.00 0.00 0.00 0.00 61.98 60.27 2dxb s VAL 94 Cb 0.00 -2.99 0.03 0.00 0.00 0.00 0.00 36.38 33.42 2dxb s VAL 94 CO 0.00 -0.32 0.28 0.21 0.00 0.00 0.00 175.10 175.27 2dxb s ASN 95 N 1.48 6.01 0.65 3.32 3.84 -1.26 -3.24 114.94 125.73 2dxb s ASN 95 Ca 0.00 -0.97 0.35 0.00 0.21 0.00 0.00 52.86 52.44 2dxb s ASN 95 Cb -0.21 -2.12 1.91 0.00 -0.55 0.00 0.00 41.25 40.28 2dxb s ASN 95 CO -0.01 -0.45 2.12 -0.50 -2.79 0.00 0.00 177.10 175.47 2dxb h TRP 96 N 8.58 0.00 0.00 0.43 4.06 -1.94 0.11 115.95 127.19 2dxb h TRP 96 Ca -0.27 0.00 -0.34 0.00 2.06 0.00 0.00 58.89 60.35 2dxb h TRP 96 Cb 1.11 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 29.22 2dxb h TRP 96 CO 0.56 0.00 -1.85 0.28 -3.56 0.00 0.00 178.44 173.88 2dxb n VAL 97 N -3.21 1.53 0.37 1.49 0.31 -1.26 -3.52 118.33 114.03 2dxb n VAL 97 Ca -0.01 -0.19 0.11 0.00 -0.01 0.00 0.00 64.34 64.24 2dxb n VAL 97 Cb 0.27 -1.97 -0.00 0.00 -0.91 0.00 0.00 33.84 31.22 2dxb n VAL 97 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2dxb n THR 98 N -4.35 0.27 -0.13 2.52 -2.24 -1.13 -1.96 114.28 107.27 2dxb n THR 98 Ca -0.42 -0.36 -0.12 0.00 -2.27 0.00 0.00 64.05 60.88 2dxb n THR 98 Cb 0.77 0.03 -0.02 0.00 -2.10 0.00 0.00 70.33 69.01 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 0.81 -4.15 3.42 0.02 -1.06 -3.43 113.55 109.16 2dxb h SER 99 Ca 0.00 -0.41 -0.51 0.00 -0.84 0.00 0.00 61.79 60.04 2dxb h SER 99 Cb 0.84 -0.23 0.09 0.00 0.14 0.00 0.00 62.40 63.24 2dxb h SER 99 CO 0.00 1.04 0.40 -2.84 -1.14 0.00 0.00 176.83 174.29 2dxb s PRO 100 N -4.62 3.00 0.45 3.45 0.02 -1.26 -4.91 135.00 131.12 2dxb s PRO 100 Ca -0.12 1.50 0.25 0.00 0.02 0.00 0.00 61.00 62.65 2dxb s PRO 100 Cb 0.10 -1.97 1.26 0.00 0.02 0.00 0.00 34.50 33.91 2dxb s PRO 100 CO 0.83 -1.11 1.80 -1.35 -0.33 0.00 0.00 177.00 176.84 2dxb h PRO 101 N 0.50 0.24 -0.03 5.54 0.11 -1.93 -2.05 132.00 134.38 2dxb h PRO 101 Ca -0.48 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.52 2dxb h PRO 101 Cb 1.26 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 2dxb h PRO 101 CO 0.55 0.16 -0.41 1.79 -0.21 0.00 0.00 178.00 179.87 2dxb h THR 102 N 0.25 1.30 -0.43 -1.15 1.35 -1.91 -3.47 112.91 108.85 2dxb h THR 102 Ca 0.56 -1.46 -0.19 0.00 -0.55 0.00 0.00 66.41 64.77 2dxb h THR 102 Cb 1.70 1.75 -0.07 0.00 -1.73 0.00 0.00 68.15 69.79 2dxb h THR 102 CO -0.18 0.42 -0.17 1.67 -0.25 0.00 0.00 175.52 177.01 2dxb n GLN 103 N -4.04 -0.65 -0.50 4.72 7.27 -0.77 -4.80 117.38 118.62 2dxb n GLN 103 Ca -0.02 0.82 0.00 0.00 0.07 0.00 0.00 57.00 57.87 2dxb n GLN 103 Cb 0.45 -4.71 0.00 0.00 2.41 0.00 0.00 30.24 28.40 2dxb n GLN 103 CO 0.00 0.00 0.00 1.97 0.07 0.00 0.00 177.06 179.10 2dxb n PHE 104 N -2.73 0.00 0.00 3.69 1.16 -0.87 -4.62 117.46 114.09 2dxb n PHE 104 Ca -0.09 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.49 2dxb n PHE 104 Cb 0.30 -0.02 0.00 0.00 -1.61 0.00 0.00 39.48 38.16 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 0.00 -0.99 3.76 4.97 0.00 -0.83 -4.86 105.19 107.24 2dxb n GLY 105 Ca 0.00 -1.56 -0.37 0.00 0.00 0.00 0.00 46.02 44.09 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 -3.10 2.58 0.32 2.61 -4.23 -1.26 -4.75 115.64 107.81 2dxb s THR 106 Ca 0.00 0.42 0.01 0.00 -1.18 0.00 0.00 61.69 60.93 2dxb s THR 106 Cb 0.00 -3.20 0.27 0.00 1.34 0.00 0.00 72.50 70.91 2dxb s THR 106 CO 0.00 -0.02 1.97 -0.65 -0.54 0.00 0.00 174.62 175.38 2dxb h PRO 107 N 1.55 0.96 0.00 3.99 0.11 -1.95 -2.65 132.00 134.01 2dxb h PRO 107 Ca -0.50 -0.06 -0.07 0.00 0.11 0.00 0.00 66.00 65.48 2dxb h PRO 107 Cb 1.28 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 2dxb h PRO 107 CO 0.58 0.63 -1.32 0.43 -0.21 0.00 0.00 178.00 178.11 2dxb n SER 108 N -4.44 0.72 -0.00 -2.05 7.64 -1.26 -4.35 113.62 109.88 2dxb n SER 108 Ca 0.09 0.29 0.10 0.00 1.01 0.00 0.00 58.87 60.37 2dxb n SER 108 Cb 0.08 0.56 -0.14 0.00 -1.01 0.00 0.00 64.21 63.70 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 0.64 -0.60 6.43 8.00 -1.22 -4.93 116.55 122.17 2dxb n ASP 109 Ca -0.05 -0.61 0.00 0.00 0.71 0.00 0.00 54.79 54.84 2dxb n ASP 109 Cb 0.67 1.38 0.00 0.00 -0.02 0.00 0.00 41.12 43.15 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 -1.78 -1.58 -2.46 1.24 4.02 -1.00 -4.58 117.16 111.01 2dxb n TYR 110 Ca 0.01 0.00 -0.17 0.00 -0.01 0.00 0.00 57.90 57.73 2dxb n TYR 110 Cb 0.41 0.25 0.02 0.00 -0.02 0.00 0.00 39.34 40.01 2dxb n TYR 110 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2dxb n ASN 112 N -0.48 0.60 -4.75 0.00 2.85 -1.26 -4.92 115.26 107.30 2dxb n ASN 112 Ca 0.28 -2.72 -0.40 0.00 -0.11 0.00 0.00 54.58 51.62 2dxb n ASN 112 Cb 0.81 -0.62 -0.06 0.00 1.24 0.00 0.00 39.78 41.15 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 -0.99 4.60 -0.03 1.20 2.96 -1.26 -2.54 118.68 122.62 2dxb s LEU 113 Ca 0.34 1.89 0.04 0.00 -0.22 0.00 0.00 54.13 56.18 2dxb s LEU 113 Cb 0.11 -3.58 -0.00 0.00 0.50 0.00 0.00 46.19 43.22 2dxb s LEU 113 CO -0.13 0.10 -0.16 -0.13 -1.32 0.00 0.00 176.35 174.71 2dxb s ARG 114 N -0.85 1.59 -0.21 1.98 0.52 -0.18 -3.17 118.95 118.63 2dxb s ARG 114 Ca 0.42 -0.57 -0.08 0.00 -0.52 0.00 0.00 55.73 54.98 2dxb s ARG 114 Cb -0.25 -1.43 -0.04 0.00 0.52 0.00 0.00 34.95 33.75 2dxb s ARG 114 CO 0.31 0.26 0.09 0.08 0.02 0.00 0.00 175.30 176.06 2dxb s VAL 115 N -0.05 4.86 -0.30 3.52 1.01 -1.25 -2.71 120.40 125.48 2dxb s VAL 115 Ca -0.01 -0.00 -0.14 0.00 0.00 0.00 0.00 61.98 61.83 2dxb s VAL 115 Cb -0.10 -3.23 -0.03 0.00 0.00 0.00 0.00 36.38 33.02 2dxb s VAL 115 CO 0.01 0.40 0.32 -0.76 0.00 0.00 0.00 175.10 175.08 2dxb s LEU 116 N 0.80 4.19 -0.36 3.92 1.43 -0.41 -4.53 118.68 123.71 2dxb s LEU 116 Ca 0.05 0.01 -0.17 0.00 -1.03 0.00 0.00 54.13 52.99 2dxb s LEU 116 Cb -0.13 -2.31 -0.00 0.00 0.03 0.00 0.00 46.19 43.78 2dxb s LEU 116 CO 0.02 -0.21 0.45 0.00 0.23 0.00 0.00 176.35 176.85 2dxb s ALA 117 N 1.96 3.47 0.88 4.21 0.00 -1.26 0.20 121.76 131.22 2dxb s ALA 117 Ca 0.12 -1.18 -0.11 0.00 0.00 0.00 0.00 51.96 50.79 2dxb s ALA 117 Cb -0.16 -2.97 0.12 0.00 0.00 0.00 0.00 23.12 20.10 2dxb s ALA 117 CO 0.11 -1.26 1.09 -0.51 0.00 0.00 0.00 175.76 175.19 2dxb s ASP 118 N 1.77 3.68 0.35 0.00 1.01 -0.05 -4.92 116.67 118.51 2dxb s ASP 118 Ca 0.15 1.46 -0.10 0.00 0.71 0.00 0.00 52.55 54.78 2dxb s ASP 118 Cb -0.16 -2.15 0.02 0.00 1.01 0.00 0.00 42.92 41.64 2dxb s ASP 118 CO 0.13 -2.50 0.61 -0.94 0.21 0.00 0.00 175.17 172.68 2dxb s SER 119 N -3.51 0.40 0.52 0.27 1.04 0.15 -4.59 113.70 107.99 2dxb s SER 119 Ca 0.63 -1.25 0.33 0.00 0.48 0.00 0.00 55.95 56.14 2dxb s SER 119 Cb -0.17 0.73 1.80 0.00 0.10 0.00 0.00 66.02 68.48 2dxb s SER 119 CO 0.56 -1.44 2.01 -0.65 0.98 0.00 0.00 173.24 174.71 2dxb h PRO 120 N 2.08 0.00 0.00 4.02 0.11 -2.02 -1.99 132.00 134.19 2dxb h PRO 120 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2dxb h PRO 120 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2dxb h PRO 120 CO 0.38 0.00 -0.00 0.25 -0.21 0.00 0.00 178.00 178.42 2dxb n THR 121 N -2.70 0.96 -3.71 -1.15 -2.24 -1.26 -4.86 114.28 99.31 2dxb n THR 121 Ca -0.02 -0.96 -0.12 0.00 -2.27 0.00 0.00 64.05 60.68 2dxb n THR 121 Cb 0.10 0.52 -0.13 0.00 -2.10 0.00 0.00 70.33 68.73 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 -0.96 0.23 -0.06 3.22 2.96 -0.75 -0.98 118.68 122.34 2dxb s LEU 122 Ca 0.00 0.59 -0.01 0.00 -0.22 0.00 0.00 54.13 54.49 2dxb s LEU 122 Cb 0.00 0.82 0.03 0.00 0.50 0.00 0.00 46.19 47.54 2dxb s LEU 122 CO 0.00 -0.18 -0.00 -0.75 -1.32 0.00 0.00 176.35 174.10 2dxb s LYS 123 N 1.45 0.60 0.11 1.98 2.47 -0.23 0.31 119.74 126.44 2dxb s LYS 123 Ca -0.08 0.08 0.01 0.00 -1.56 0.00 0.00 55.97 54.41 2dxb s LYS 123 Cb -0.10 -0.89 -0.04 0.00 -1.46 0.00 0.00 37.83 35.34 2dxb s LYS 123 CO -0.09 -0.25 0.26 -1.01 0.16 0.00 0.00 175.35 174.42 2dxb s HIS 124 N 1.70 3.50 -0.07 4.03 3.76 -1.26 -1.35 115.29 125.60 2dxb s HIS 124 Ca 0.01 0.23 -0.04 0.00 -0.15 0.00 0.00 55.06 55.10 2dxb s HIS 124 Cb -0.13 -1.75 0.03 0.00 1.11 0.00 0.00 32.58 31.85 2dxb s HIS 124 CO -0.04 0.53 0.18 0.54 -0.85 0.00 0.00 174.74 175.10 2dxb s VAL 125 N -1.64 -0.03 0.12 -0.90 0.11 -0.88 -4.48 120.40 112.70 2dxb s VAL 125 Ca 0.35 0.11 0.05 0.00 -2.93 0.00 0.00 61.98 59.57 2dxb s VAL 125 Cb -0.12 -0.27 -0.04 0.00 -1.53 0.00 0.00 36.38 34.42 2dxb s VAL 125 CO 0.28 0.05 0.03 -0.69 -3.33 0.00 0.00 175.10 171.44 2dxb s VAL 126 N 0.82 4.09 0.24 2.04 1.01 -0.56 -0.95 120.40 127.10 2dxb s VAL 126 Ca -0.06 -1.07 -0.21 0.00 0.00 0.00 0.00 61.98 60.64 2dxb s VAL 126 Cb -0.08 -3.00 0.03 0.00 0.00 0.00 0.00 36.38 33.34 2dxb s VAL 126 CO -0.04 0.04 0.67 0.54 0.00 0.00 0.00 175.10 176.31 2dxb s VAL 127 N -1.47 0.00 -0.38 2.92 0.11 -0.42 -4.94 120.40 116.22 2dxb s VAL 127 Ca 0.27 -0.72 0.01 0.00 -2.93 0.00 0.00 61.98 58.60 2dxb s VAL 127 Cb -0.11 -1.71 0.13 0.00 -1.53 0.00 0.00 36.38 33.16 2dxb s VAL 127 CO 0.20 -0.01 0.19 0.00 -3.33 0.00 0.00 175.10 172.15 2dxb h THR 129 N 5.55 0.90 0.10 0.00 1.35 -1.87 -3.36 112.91 115.59 2dxb h THR 129 Ca -0.03 -0.18 -0.26 0.00 -0.55 0.00 0.00 66.41 65.38 2dxb h THR 129 Cb 0.96 1.10 0.00 0.00 -1.73 0.00 0.00 68.15 68.49 2dxb h THR 129 CO 0.42 0.05 -1.18 -0.07 -0.25 0.00 0.00 175.52 174.49 2dxb h LEU 130 N 0.00 0.44 -8.97 3.87 3.38 -1.91 -3.47 115.31 108.66 2dxb h LEU 130 Ca -0.00 -0.44 -0.59 0.00 0.09 0.00 0.00 57.88 56.93 2dxb h LEU 130 Cb 0.10 -0.14 -0.18 0.00 0.09 0.00 0.00 40.66 40.53 2dxb h LEU 130 CO 0.01 1.32 -0.80 -0.94 0.09 0.00 0.00 178.44 178.12 2dxb s SER 132 N -7.13 3.13 0.00 -0.43 1.04 -1.26 -5.21 113.70 103.84 2dxb s SER 132 Ca -0.04 -0.88 0.00 0.00 0.48 0.00 0.00 55.95 55.51 2dxb s SER 132 Cb 0.07 -0.22 0.00 0.00 0.10 0.00 0.00 66.02 65.98 2dxb s SER 132 CO 0.88 0.05 0.00 0.00 0.98 0.00 0.00 173.24 175.15 2dxb n TYR 134 N 0.19 0.00 -1.11 5.02 9.36 -1.26 -4.95 117.16 124.41 2dxb n TYR 134 Ca -0.12 0.00 -0.27 0.00 3.32 0.00 0.00 57.90 60.83 2dxb n TYR 134 Cb 0.57 0.00 -0.07 0.00 -0.63 0.00 0.00 39.34 39.21 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 -0.88 2.88 -0.30 2.98 -0.04 -1.26 -4.77 135.00 133.60 2dxb n PRO 135 Ca 0.00 -1.68 0.04 0.00 -0.04 0.00 0.00 63.50 61.83 2dxb n PRO 135 Cb 0.00 -2.47 0.12 0.00 -0.04 0.00 0.00 33.50 31.11 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 4.57 0.01 -1.03 0.54 3.08 -1.93 -0.29 114.38 119.32 2dxb h ARG 136 Ca 0.59 -0.00 0.26 0.00 0.07 0.00 0.00 59.98 60.90 2dxb h ARG 136 Cb 0.64 -0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.58 2dxb h ARG 136 CO 1.23 0.00 0.63 -1.35 -1.07 0.00 0.00 179.97 179.42 2dxb h PRO 137 N 0.01 0.47 0.00 0.04 0.11 -1.86 0.19 132.00 130.96 2dxb h PRO 137 Ca 0.42 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.50 2dxb h PRO 137 Cb 0.67 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.67 2dxb h PRO 137 CO -0.87 0.31 -0.64 1.51 -0.21 0.00 0.00 178.00 178.10 2dxb n ILE 138 N -4.77 0.00 0.00 4.15 3.06 -0.78 -4.73 119.36 116.29 2dxb n ILE 138 Ca 0.27 -0.22 0.00 0.00 -2.50 0.00 0.00 62.75 60.29 2dxb n ILE 138 Cb 0.82 0.94 0.00 0.00 0.54 0.00 0.00 39.64 41.94 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 -1.33 0.00 0.00 9.51 7.94 -0.19 -2.84 117.00 130.09 2dxb n LEU 139 Ca 0.02 -0.09 0.00 0.00 -1.11 0.00 0.00 56.01 54.83 2dxb n LEU 139 Cb 0.20 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.15 2dxb n LEU 139 CO 0.24 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.13 2dxb n GLY 140 N 1.75 -1.72 3.81 -3.96 0.00 0.61 -2.14 105.19 103.53 2dxb n GLY 140 Ca 0.00 -2.04 -0.35 0.00 0.00 0.00 0.00 46.02 43.63 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 4.34 0.49 1.61 2.00 -1.26 -3.85 119.66 122.99 2dxb s GLN 141 Ca 0.00 1.10 -0.22 0.00 -2.00 0.00 0.00 55.36 54.24 2dxb s GLN 141 Cb 0.00 -2.57 -0.07 0.00 0.80 0.00 0.00 33.01 31.17 2dxb s GLN 141 CO 0.00 0.18 1.16 -1.54 -0.50 0.00 0.00 175.29 174.60 2dxb s SER 142 N -1.89 5.98 0.66 6.67 1.04 -1.26 -5.01 113.70 119.90 2dxb s SER 142 Ca 0.53 2.29 -0.16 0.00 0.48 0.00 0.00 55.95 59.10 2dxb s SER 142 Cb -0.14 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.38 2dxb s SER 142 CO 0.19 -1.05 1.15 -2.84 0.98 0.00 0.00 173.24 171.67 2dxb s PRO 143 N -2.88 2.66 0.19 4.02 0.02 -1.26 -4.93 135.00 132.81 2dxb s PRO 143 Ca 0.67 1.57 -0.13 0.00 0.02 0.00 0.00 61.00 63.13 2dxb s PRO 143 Cb -0.28 -1.92 0.10 0.00 0.02 0.00 0.00 34.50 32.43 2dxb s PRO 143 CO 0.33 -1.39 1.85 1.49 -0.33 0.00 0.00 177.00 178.95 2dxb h GLU 144 N 0.14 0.79 0.00 5.54 4.57 -2.01 -2.41 114.58 121.20 2dxb h GLU 144 Ca -0.48 -0.05 -0.02 0.00 -1.18 0.00 0.00 59.36 57.63 2dxb h GLU 144 Cb 1.27 -0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 29.68 2dxb h GLU 144 CO 0.53 0.52 -0.12 0.11 -1.18 0.00 0.00 179.01 178.88 2dxb h TRP 145 N 0.81 0.00 -0.02 0.92 5.08 -1.98 -2.64 115.95 118.12 2dxb h TRP 145 Ca 0.23 0.00 -0.08 0.00 1.08 0.00 0.00 58.89 60.12 2dxb h TRP 145 Cb -0.08 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.07 2dxb h TRP 145 CO -0.03 0.12 -0.34 -0.92 -1.28 0.00 0.00 178.44 175.98 2dxb h TYR 146 N 0.00 0.05 -0.33 0.12 3.20 -1.80 -2.75 116.97 115.46 2dxb h TYR 146 Ca -0.00 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.86 2dxb h TYR 146 Cb 0.40 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.66 2dxb h TYR 146 CO 0.00 0.38 0.00 2.89 -1.64 0.00 0.00 178.16 179.79 2dxb n ARG 147 N -4.12 2.31 -2.45 1.82 1.85 -1.00 -4.68 116.66 110.39 2dxb n ARG 147 Ca -0.02 -1.98 -0.38 0.00 -1.00 0.00 0.00 57.85 54.47 2dxb n ARG 147 Cb 0.39 -1.48 -0.04 0.00 -1.05 0.00 0.00 32.46 30.28 2dxb n ARG 147 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 2dxb s SER 148 N -1.51 6.86 0.44 2.89 1.04 -1.04 -4.91 113.70 117.48 2dxb s SER 148 Ca 0.37 2.21 0.14 0.00 0.48 0.00 0.00 55.95 59.14 2dxb s SER 148 Cb 0.21 -2.61 1.04 0.00 0.10 0.00 0.00 66.02 64.76 2dxb s SER 148 CO 0.30 -0.43 2.00 -0.65 0.98 0.00 0.00 173.24 175.44 2dxb h PRO 149 N 2.99 0.38 0.25 4.02 0.11 -1.92 -2.05 132.00 135.77 2dxb h PRO 149 Ca -0.48 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 2dxb h PRO 149 Cb 1.22 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 2dxb h PRO 149 CO 0.64 0.25 -0.15 -0.97 -0.21 0.00 0.00 178.00 177.56 2dxb h ASN 150 N 0.39 -0.36 -0.70 -2.05 -0.73 -1.91 0.78 115.58 110.99 2dxb h ASN 150 Ca 0.25 0.02 -0.06 0.00 1.87 0.00 0.00 56.30 58.38 2dxb h ASN 150 Cb 0.47 0.11 -0.03 0.00 0.27 0.00 0.00 38.32 39.13 2dxb h ASN 150 CO -0.06 -0.24 0.22 0.22 -0.37 0.00 0.00 177.43 177.20 2dxb h TYR 151 N -0.38 1.13 0.00 0.67 3.20 -1.69 -2.06 116.97 117.85 2dxb h TYR 151 Ca -0.03 -0.11 -0.06 0.00 3.14 0.00 0.00 58.73 61.67 2dxb h TYR 151 Cb 0.31 -0.33 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 2dxb h TYR 151 CO -0.08 0.90 -0.29 0.00 -1.64 0.00 0.00 178.16 177.05 2dxb h ARG 152 N 1.03 0.00 0.03 1.82 3.08 -1.17 -2.34 114.38 116.84 2dxb h ARG 152 Ca 0.23 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.20 2dxb h ARG 152 Cb 0.30 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.35 2dxb h ARG 152 CO -0.01 0.29 -0.39 0.00 -1.07 0.00 0.00 179.97 178.79 2dxb h ARG 153 N 0.00 0.07 0.22 0.04 3.08 -0.61 -3.42 114.38 113.76 2dxb h ARG 153 Ca -0.00 -0.12 -0.32 0.00 0.07 0.00 0.00 59.98 59.60 2dxb h ARG 153 Cb 0.58 0.05 0.03 0.00 0.08 0.00 0.00 29.97 30.70 2dxb h ARG 153 CO 0.04 1.06 -1.44 0.00 -1.07 0.00 0.00 179.97 178.56 2dxb h ARG 154 N -0.84 0.47 -0.31 0.04 3.08 -1.40 -3.40 114.38 112.02 2dxb h ARG 154 Ca -0.09 -0.81 0.07 0.00 0.07 0.00 0.00 59.98 59.23 2dxb h ARG 154 Cb 1.21 0.30 -0.07 0.00 0.08 0.00 0.00 29.97 31.48 2dxb h ARG 154 CO 0.01 1.38 -0.19 1.25 -1.07 0.00 0.00 179.97 181.35 2dxb h LEU 155 N 0.13 -0.63 -2.19 3.04 5.85 -1.66 0.12 115.31 119.98 2dxb h LEU 155 Ca -0.23 0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.61 2dxb h LEU 155 Cb 2.12 0.33 -0.00 0.00 0.37 0.00 0.00 40.66 43.48 2dxb h LEU 155 CO 0.26 -0.23 -0.05 -0.37 -0.34 0.00 0.00 178.44 177.71 2dxb h VAL 156 N -0.15 0.62 0.00 1.05 -1.51 -1.83 -2.02 116.25 112.42 2dxb h VAL 156 Ca 0.16 -0.22 -0.37 0.00 -1.23 0.00 0.00 66.70 65.04 2dxb h VAL 156 Cb 0.40 1.14 -0.07 0.00 -2.13 0.00 0.00 31.29 30.63 2dxb h VAL 156 CO -0.41 0.05 -2.41 -1.14 -1.23 0.00 0.00 177.57 172.44 2dxb n ARG 157 N -3.87 0.67 -2.67 5.19 0.63 -0.90 -4.68 116.66 111.03 2dxb n ARG 157 Ca -0.03 0.11 -0.22 0.00 -0.92 0.00 0.00 57.85 56.79 2dxb n ARG 157 Cb 0.15 -1.50 -0.00 0.00 0.45 0.00 0.00 32.46 31.55 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 -3.11 2.74 -0.29 -0.14 8.01 0.38 -4.93 117.44 120.10 2dxb n TRP 158 Ca -0.41 -3.26 0.06 0.00 -1.31 0.00 0.00 57.50 52.57 2dxb n TRP 158 Cb 1.01 -0.25 0.20 0.00 -2.01 0.00 0.00 31.31 30.27 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 2.79 0.64 -0.89 -0.99 0.13 -1.51 -0.86 132.00 131.31 2dxb h PRO 159 Ca 0.16 -0.04 -0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2dxb h PRO 159 Cb 0.91 -0.15 -0.04 0.00 0.13 0.00 0.00 31.00 31.85 2dxb h PRO 159 CO 0.73 0.43 0.55 0.00 -0.23 0.00 0.00 178.00 179.48 2dxb h ARG 160 N 0.66 1.21 -0.03 0.86 2.47 -1.91 0.71 114.38 118.35 2dxb h ARG 160 Ca 0.44 -0.10 -0.01 0.00 -1.26 0.00 0.00 59.98 59.05 2dxb h ARG 160 Cb 0.56 -0.26 -0.00 0.00 -1.65 0.00 0.00 29.97 28.63 2dxb h ARG 160 CO -0.33 0.84 -0.00 1.96 0.56 0.00 0.00 179.97 182.99 2dxb h GLN 161 N 1.23 0.05 -0.18 0.04 7.50 -1.63 -1.65 115.11 120.46 2dxb h GLN 161 Ca 0.32 -0.02 -0.01 0.00 0.50 0.00 0.00 58.65 59.45 2dxb h GLN 161 Cb -0.07 -0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.45 2dxb h GLN 161 CO -0.06 0.39 0.09 0.28 -1.50 0.00 0.00 178.83 178.03 2dxb h VAL 162 N -0.28 1.12 -0.97 -0.54 2.07 -1.04 -2.48 116.25 114.13 2dxb h VAL 162 Ca 0.01 -0.35 0.04 0.00 0.82 0.00 0.00 66.70 67.22 2dxb h VAL 162 Cb 0.36 1.02 -0.06 0.00 -1.52 0.00 0.00 31.29 31.10 2dxb h VAL 162 CO 0.00 0.12 0.63 -0.07 0.02 0.00 0.00 177.57 178.27 2dxb h LEU 163 N 0.18 1.05 -1.25 2.57 3.38 -0.88 -1.47 115.31 118.89 2dxb h LEU 163 Ca 0.06 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2dxb h LEU 163 Cb 0.10 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.58 2dxb h LEU 163 CO -0.01 0.72 0.45 0.00 0.09 0.00 0.00 178.44 179.68 2dxb h ALA 164 N 1.44 1.44 -0.09 1.53 0.00 -0.93 0.11 119.26 122.76 2dxb h ALA 164 Ca 0.39 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.19 2dxb h ALA 164 Cb 0.02 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 2dxb h ALA 164 CO -0.12 0.50 -0.12 0.93 0.00 0.00 0.00 179.25 180.43 2dxb h GLU 165 N 0.98 0.13 -0.00 0.00 5.08 -0.83 0.18 114.58 120.12 2dxb h GLU 165 Ca 0.26 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 2dxb h GLU 165 Cb -0.07 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.16 2dxb h GLU 165 CO -0.05 0.26 -0.01 1.19 -1.00 0.00 0.00 179.01 179.40 2dxb n PHE 166 N -4.32 0.00 -0.74 4.33 3.72 -0.25 -4.88 117.46 115.31 2dxb n PHE 166 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 2dxb n PHE 166 Cb 0.23 -0.05 0.00 0.00 -0.94 0.00 0.00 39.48 38.72 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 1.10 0.56 3.29 1.37 0.00 0.64 -4.95 105.19 107.20 2dxb n GLY 167 Ca 0.21 -0.65 -0.33 0.00 0.00 0.00 0.00 46.02 45.24 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 2.56 0.00 0.99 2.96 0.21 -4.96 118.68 120.44 2dxb s LEU 168 Ca 0.00 -0.43 0.02 0.00 -0.22 0.00 0.00 54.13 53.50 2dxb s LEU 168 Cb 0.00 -1.59 -0.01 0.00 0.50 0.00 0.00 46.19 45.09 2dxb s LEU 168 CO 0.00 0.09 -0.07 -1.58 -1.32 0.00 0.00 176.35 173.48 2dxb s GLN 169 N 0.76 0.53 0.17 1.98 0.74 -1.26 -2.41 119.66 120.17 2dxb s GLN 169 Ca -0.06 -0.33 0.07 0.00 0.05 0.00 0.00 55.36 55.09 2dxb s GLN 169 Cb -0.15 -0.48 -0.04 0.00 1.10 0.00 0.00 33.01 33.43 2dxb s GLN 169 CO 0.01 0.13 -0.14 -0.51 -0.55 0.00 0.00 175.29 174.23 2dxb s LEU 170 N -0.40 2.50 0.57 3.68 1.02 -1.26 -5.12 118.68 119.66 2dxb s LEU 170 Ca 0.01 -0.95 -0.19 0.00 0.02 0.00 0.00 54.13 53.02 2dxb s LEU 170 Cb -0.04 -0.58 -0.07 0.00 0.02 0.00 0.00 46.19 45.52 2dxb s LEU 170 CO -0.00 -0.19 0.78 -2.65 0.02 0.00 0.00 176.35 174.31 2dxb n PRO 171 N -0.03 0.77 0.21 1.29 -0.02 -1.26 -4.88 135.00 131.08 2dxb n PRO 171 Ca -0.11 0.30 0.05 0.00 -2.02 0.00 0.00 63.50 61.71 2dxb n PRO 171 Cb 0.59 -1.95 0.45 0.00 -0.02 0.00 0.00 33.50 32.58 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 0.50 0.00 1.56 2.55 4.64 -2.03 -2.58 113.55 118.19 2dxb h SER 172 Ca -0.47 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.81 2dxb h SER 172 Cb 1.38 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.46 2dxb h SER 172 CO 0.50 0.27 -0.21 1.05 -0.87 0.00 0.00 176.83 177.57 2dxb h GLU 173 N 0.00 0.00 -6.87 4.77 9.09 -2.00 -3.45 114.58 116.11 2dxb h GLU 173 Ca -0.00 0.00 -0.53 0.00 0.05 0.00 0.00 59.36 58.88 2dxb h GLU 173 Cb 0.50 0.00 0.07 0.00 -1.65 0.00 0.00 28.75 27.67 2dxb h GLU 173 CO 0.04 0.21 0.68 0.08 0.05 0.00 0.00 179.01 180.06 2dxb s VAL 174 N -3.24 2.59 -0.38 -1.06 1.01 -0.97 -4.95 120.40 113.39 2dxb s VAL 174 Ca 0.04 0.58 -0.25 0.00 0.00 0.00 0.00 61.98 62.35 2dxb s VAL 174 Cb 0.07 -3.37 0.02 0.00 0.00 0.00 0.00 36.38 33.10 2dxb s VAL 174 CO 0.68 0.13 0.91 -1.58 0.00 0.00 0.00 175.10 175.24 2dxb s GLN 175 N -1.64 3.79 -0.23 2.72 0.74 -0.15 -4.92 119.66 119.96 2dxb s GLN 175 Ca 0.51 0.48 -0.16 0.00 0.05 0.00 0.00 55.36 56.25 2dxb s GLN 175 Cb -0.41 -3.82 -0.04 0.00 1.10 0.00 0.00 33.01 29.84 2dxb s GLN 175 CO 0.53 -0.97 0.39 0.42 -0.55 0.00 0.00 175.29 175.12 2dxb s ILE 176 N 3.46 5.18 -0.18 -2.34 1.01 -1.26 -1.06 121.20 126.01 2dxb s ILE 176 Ca 0.37 0.67 -0.01 0.00 0.00 0.00 0.00 60.65 61.67 2dxb s ILE 176 Cb -0.12 -3.72 -0.00 0.00 0.01 0.00 0.00 42.46 38.63 2dxb s ILE 176 CO 0.19 0.21 -0.11 -0.60 0.00 0.00 0.00 174.94 174.64 2dxb s ARG 177 N 1.61 3.28 -0.11 2.79 3.52 -0.45 -4.96 118.95 124.62 2dxb s ARG 177 Ca 0.18 -0.70 -0.17 0.00 -0.13 0.00 0.00 55.73 54.91 2dxb s ARG 177 Cb -0.15 -2.78 -0.04 0.00 -1.56 0.00 0.00 34.95 30.41 2dxb s ARG 177 CO 0.08 -0.08 0.43 0.08 -0.81 0.00 0.00 175.30 175.00 2dxb s VAL 178 N 1.10 5.20 -0.21 7.11 1.01 -1.26 -2.07 120.40 131.28 2dxb s VAL 178 Ca 0.00 0.85 -0.05 0.00 0.00 0.00 0.00 61.98 62.79 2dxb s VAL 178 Cb -0.14 -3.76 -0.02 0.00 0.00 0.00 0.00 36.38 32.45 2dxb s VAL 178 CO -0.03 0.37 -0.01 0.00 0.00 0.00 0.00 175.10 175.43 2dxb s ALA 179 N 0.39 2.95 -0.39 5.51 0.00 -0.13 -4.96 121.76 125.14 2dxb s ALA 179 Ca 0.24 -1.06 -0.11 0.00 0.00 0.00 0.00 51.96 51.03 2dxb s ALA 179 Cb -0.15 -1.76 0.04 0.00 0.00 0.00 0.00 23.12 21.26 2dxb s ALA 179 CO 0.09 -0.26 0.23 0.34 0.00 0.00 0.00 175.76 176.16 2dxb s ASP 180 N 1.20 5.72 -1.25 0.00 -1.08 -1.26 -1.29 116.67 118.71 2dxb s ASP 180 Ca 0.03 -1.15 -0.19 0.00 -0.52 0.00 0.00 52.55 50.72 2dxb s ASP 180 Cb -0.15 -2.02 0.01 0.00 -1.46 0.00 0.00 42.92 39.30 2dxb s ASP 180 CO 0.01 -0.44 1.86 -1.20 0.52 0.00 0.00 175.17 175.92 2dxb n SER 181 N 4.98 4.13 -0.13 -0.34 7.64 0.27 -4.70 113.62 125.47 2dxb n SER 181 Ca -0.11 -2.83 0.11 0.00 1.01 0.00 0.00 58.87 57.04 2dxb n SER 181 Cb 0.45 -1.70 0.05 0.00 -1.01 0.00 0.00 64.21 62.00 2dxb n SER 181 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 2dxb n ASN 182 N 9.81 1.09 0.00 6.43 6.94 -1.26 -4.75 115.26 133.52 2dxb n ASN 182 Ca 0.48 -0.91 0.00 0.00 -0.02 0.00 0.00 54.58 54.13 2dxb n ASN 182 Cb 0.45 0.61 0.00 0.00 -2.36 0.00 0.00 39.78 38.48 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 -1.10 1.34 0.00 -3.83 1.13 -1.26 -5.03 117.38 108.63 2dxb n GLN 183 Ca 0.06 0.00 0.13 0.00 -1.94 0.00 0.00 57.00 55.25 2dxb n GLN 183 Cb 0.36 0.00 0.32 0.00 0.11 0.00 0.00 30.24 31.04 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 0.76 -2.97 -1.09 5.02 -1.26 -4.91 118.16 113.71 2dxb n LYS 184 Ca 0.00 -0.47 -0.38 0.00 -2.02 0.00 0.00 58.31 55.44 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 4.38 0.08 -0.18 2.01 -1.26 -4.33 115.64 113.77 2dxb s THR 185 Ca 0.22 1.63 0.09 0.00 0.31 0.00 0.00 61.69 63.95 2dxb s THR 185 Cb 0.19 -4.06 -0.03 0.00 0.01 0.00 0.00 72.50 68.61 2dxb s THR 185 CO 0.55 0.39 -0.25 -0.13 -0.69 0.00 0.00 174.62 174.49 2dxb s ARG 186 N -1.48 1.51 0.15 4.92 1.81 -1.05 -4.75 118.95 120.05 2dxb s ARG 186 Ca 0.40 -1.15 0.08 0.00 -1.72 0.00 0.00 55.73 53.34 2dxb s ARG 186 Cb -0.21 -1.78 -0.04 0.00 -0.45 0.00 0.00 34.95 32.47 2dxb s ARG 186 CO 0.25 0.44 -0.18 0.71 -0.68 0.00 0.00 175.30 175.84 2dxb s TYR 187 N -0.92 1.77 0.02 -0.53 2.02 -1.26 -1.01 117.35 117.44 2dxb s TYR 187 Ca 0.11 -0.47 0.01 0.00 -0.37 0.00 0.00 57.07 56.36 2dxb s TYR 187 Cb -0.10 -0.91 -0.01 0.00 -0.40 0.00 0.00 41.96 40.54 2dxb s TYR 187 CO 0.03 0.29 -0.05 0.96 -1.57 0.00 0.00 175.55 175.21 2dxb s ILE 188 N -1.86 0.36 -0.17 2.71 -4.36 -1.10 -4.57 121.20 112.20 2dxb s ILE 188 Ca 0.13 -0.60 -0.12 0.00 -0.26 0.00 0.00 60.65 59.80 2dxb s ILE 188 Cb -0.07 -0.38 -0.05 0.00 1.25 0.00 0.00 42.46 43.22 2dxb s ILE 188 CO 0.06 -0.17 0.22 -0.69 0.24 0.00 0.00 174.94 174.60 2dxb s VAL 189 N -0.76 5.35 -0.52 8.37 1.01 -0.15 -1.29 120.40 132.42 2dxb s VAL 189 Ca -0.05 0.39 -0.16 0.00 0.00 0.00 0.00 61.98 62.15 2dxb s VAL 189 Cb -0.06 -3.55 0.10 0.00 0.00 0.00 0.00 36.38 32.87 2dxb s VAL 189 CO -0.00 0.43 0.48 -0.32 0.00 0.00 0.00 175.10 175.69 2dxb s MET 190 N 0.26 2.99 0.72 2.72 1.75 0.13 -4.45 119.30 123.43 2dxb s MET 190 Ca 0.13 -1.51 -0.11 0.00 -1.25 0.00 0.00 55.69 52.95 2dxb s MET 190 Cb -0.12 -4.23 0.03 0.00 2.84 0.00 0.00 34.83 33.35 2dxb s MET 190 CO 0.02 -1.22 1.08 -2.14 -0.65 0.00 0.00 175.02 172.10 2dxb s PRO 191 N 1.73 2.65 0.48 4.11 0.02 -1.26 -0.87 135.00 141.85 2dxb s PRO 191 Ca 0.04 1.08 -0.21 0.00 0.02 0.00 0.00 61.00 61.94 2dxb s PRO 191 Cb -0.27 -1.95 -0.08 0.00 0.02 0.00 0.00 34.50 32.22 2dxb s PRO 191 CO 0.05 -1.33 1.08 0.14 -0.33 0.00 0.00 177.00 176.60 2dxb s VAL 192 N -2.92 3.53 0.03 3.83 -7.23 -1.26 -4.80 120.40 111.58 2dxb s VAL 192 Ca 0.60 1.01 -0.30 0.00 -1.81 0.00 0.00 61.98 61.48 2dxb s VAL 192 Cb -0.16 -3.44 -0.07 0.00 0.56 0.00 0.00 36.38 33.27 2dxb s VAL 192 CO 0.54 -0.15 1.58 -0.60 -0.31 0.00 0.00 175.10 176.16 2dxb s ARG 193 N -3.06 4.22 0.77 4.82 3.52 -1.26 -4.83 118.95 123.13 2dxb s ARG 193 Ca 0.67 2.20 -0.11 0.00 -0.13 0.00 0.00 55.73 58.36 2dxb s ARG 193 Cb -0.21 -3.66 0.05 0.00 -1.56 0.00 0.00 34.95 29.57 2dxb s ARG 193 CO 0.25 -0.71 1.09 -1.25 -0.81 0.00 0.00 175.30 173.86 2dxb s PRO 194 N 2.82 2.33 0.63 5.12 0.04 -1.26 -5.02 135.00 139.65 2dxb s PRO 194 Ca 0.71 1.12 -0.16 0.00 0.04 0.00 0.00 61.00 62.71 2dxb s PRO 194 Cb -0.36 -1.91 -0.02 0.00 0.04 0.00 0.00 34.50 32.25 2dxb s PRO 194 CO 0.30 -1.58 1.11 -1.21 0.04 0.00 0.00 177.00 175.66 2dxb s GLU 195 N -4.93 2.98 0.00 4.56 0.41 -1.26 -3.99 118.70 116.47 2dxb s GLU 195 Ca 0.61 1.43 0.00 0.00 -0.41 0.00 0.00 54.97 56.59 2dxb s GLU 195 Cb -0.17 -1.97 0.00 0.00 -1.78 0.00 0.00 34.13 30.21 2dxb s GLU 195 CO 0.56 -1.12 0.00 0.41 -0.49 0.00 0.00 175.26 174.62 2dxb n GLY 196 N -0.40 0.55 0.53 -1.39 0.00 -1.26 -4.75 105.19 98.48 2dxb n GLY 196 Ca 0.10 -0.80 0.05 0.00 0.00 0.00 0.00 46.02 45.38 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 -3.60 1.07 -2.06 2.61 -2.24 -1.26 -4.92 114.28 103.88 2dxb n THR 197 Ca 0.00 -1.55 -0.42 0.00 -2.27 0.00 0.00 64.05 59.81 2dxb n THR 197 Cb 0.46 0.19 -0.03 0.00 -2.10 0.00 0.00 70.33 68.85 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 -2.23 6.71 0.00 3.42 -0.00 -1.26 -2.18 116.67 121.13 2dxb s ASP 198 Ca 0.24 2.47 0.00 0.00 -0.00 0.00 0.00 52.55 55.26 2dxb s ASP 198 Cb 0.23 -2.59 0.00 0.00 -0.00 0.00 0.00 42.92 40.56 2dxb s ASP 198 CO -0.03 -0.73 0.00 0.61 -0.00 0.00 0.00 175.17 175.02 2dxb n GLY 199 N 3.50 0.96 3.77 0.21 0.00 -1.26 -5.01 105.19 107.35 2dxb n GLY 199 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 2dxb n GLY 199 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2dxb s TRP 200 N -3.83 2.76 0.74 1.61 0.52 -0.93 -5.03 118.94 114.79 2dxb s TRP 200 Ca 0.00 1.46 -0.08 0.00 0.02 0.00 0.00 56.10 57.50 2dxb s TRP 200 Cb 0.00 -3.58 0.08 0.00 -1.15 0.00 0.00 33.47 28.82 2dxb s TRP 200 CO 0.00 -1.99 1.07 0.95 0.02 0.00 0.00 176.95 177.00 2dxb s THR 201 N -1.37 2.20 0.27 2.01 -4.23 -1.26 -4.86 115.64 108.40 2dxb s THR 201 Ca 0.62 -0.22 -0.03 0.00 -1.18 0.00 0.00 61.69 60.88 2dxb s THR 201 Cb -0.35 -2.98 0.27 0.00 1.34 0.00 0.00 72.50 70.78 2dxb s THR 201 CO 0.43 0.00 1.92 -0.08 -0.54 0.00 0.00 174.62 176.36 2dxb h GLU 202 N -0.76 1.18 -0.31 3.99 4.81 -1.95 -1.42 114.58 120.13 2dxb h GLU 202 Ca -0.44 -0.07 -0.13 0.00 -0.13 0.00 0.00 59.36 58.59 2dxb h GLU 202 Cb 1.31 -0.27 -0.01 0.00 0.63 0.00 0.00 28.75 30.41 2dxb h GLU 202 CO 0.59 0.78 -0.34 -0.44 -0.73 0.00 0.00 179.01 178.87 2dxb h ASP 203 N 1.22 0.72 -0.43 1.04 3.32 -1.98 -0.98 116.42 119.31 2dxb h ASP 203 Ca 0.37 -0.30 -0.08 0.00 0.02 0.00 0.00 57.03 57.04 2dxb h ASP 203 Cb -0.02 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 2dxb h ASP 203 CO -0.11 0.99 -0.06 1.56 -1.72 0.00 0.00 179.24 179.90 2dxb h GLN 204 N 0.58 0.81 -0.25 3.56 4.20 -1.79 -2.09 115.11 120.13 2dxb h GLN 204 Ca 0.06 -0.29 -0.06 0.00 0.06 0.00 0.00 58.65 58.42 2dxb h GLN 204 Cb 0.85 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.57 2dxb h GLN 204 CO 0.07 0.90 -0.09 -0.07 -0.67 0.00 0.00 178.83 178.98 2dxb h LEU 205 N 0.64 0.50 -1.81 1.46 3.38 -1.20 -3.02 115.31 115.26 2dxb h LEU 205 Ca 0.12 -0.39 -0.02 0.00 0.09 0.00 0.00 57.88 57.68 2dxb h LEU 205 Cb 0.58 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 2dxb h LEU 205 CO 0.03 0.77 -0.05 0.00 0.09 0.00 0.00 178.44 179.29 2dxb h ALA 206 N 0.74 1.84 0.00 1.53 0.00 -1.15 -2.65 119.26 119.58 2dxb h ALA 206 Ca 0.06 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2dxb h ALA 206 Cb 0.57 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 2dxb h ALA 206 CO 0.03 0.12 -0.09 1.49 0.00 0.00 0.00 179.25 180.80 2dxb h GLU 207 N 0.06 0.00 -0.02 0.00 4.81 -1.24 -2.33 114.58 115.86 2dxb h GLU 207 Ca 0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 2dxb h GLU 207 Cb 0.13 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.51 2dxb h GLU 207 CO 0.01 0.09 -0.16 0.44 -0.73 0.00 0.00 179.01 178.65 2dxb n ILE 208 N -4.18 0.00 -3.04 2.32 -5.35 -1.00 -4.47 119.36 103.64 2dxb n ILE 208 Ca -0.03 -0.32 -0.44 0.00 -0.27 0.00 0.00 62.75 61.69 2dxb n ILE 208 Cb 0.17 1.00 -0.01 0.00 -1.74 0.00 0.00 39.64 39.07 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 -2.20 5.16 0.90 7.28 1.01 -0.88 -4.27 120.40 127.40 2dxb s VAL 209 Ca 0.27 -2.47 -0.13 0.00 0.00 0.00 0.00 61.98 59.65 2dxb s VAL 209 Cb 0.20 -4.79 0.14 0.00 0.00 0.00 0.00 36.38 31.92 2dxb s VAL 209 CO 0.41 -1.47 1.18 0.42 0.00 0.00 0.00 175.10 175.64 2dxb s THR 210 N 1.29 1.98 0.18 3.92 -4.23 -1.26 -4.60 115.64 112.91 2dxb s THR 210 Ca 0.36 0.00 -0.13 0.00 -1.18 0.00 0.00 61.69 60.74 2dxb s THR 210 Cb -0.05 -2.86 0.09 0.00 1.34 0.00 0.00 72.50 71.01 2dxb s THR 210 CO -0.04 0.00 1.74 -0.09 -0.54 0.00 0.00 174.62 175.68 2dxb h ARG 211 N -1.43 0.30 -0.14 3.99 2.43 -1.95 -1.07 114.38 116.51 2dxb h ARG 211 Ca -0.48 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 58.67 2dxb h ARG 211 Cb 1.31 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.79 2dxb h ARG 211 CO 0.58 0.20 0.05 -0.44 -1.51 0.00 0.00 179.97 178.85 2dxb h ASP 212 N 0.31 0.16 0.03 -3.80 3.32 -1.94 -0.76 116.42 113.74 2dxb h ASP 212 Ca 0.23 -0.01 -0.15 0.00 0.02 0.00 0.00 57.03 57.12 2dxb h ASP 212 Cb 0.26 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 2dxb h ASP 212 CO -0.26 0.15 -0.52 0.00 -1.72 0.00 0.00 179.24 176.89 2dxb h LEU 214 N 0.42 0.00 0.10 0.00 3.38 -0.34 -2.72 115.31 116.15 2dxb h LEU 214 Ca 0.01 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.63 2dxb h LEU 214 Cb 1.05 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 2dxb h LEU 214 CO 0.10 0.00 -2.00 -0.38 0.09 0.00 0.00 178.44 176.25 2dxb n ILE 215 N -2.47 1.74 0.00 1.22 2.08 -0.67 -0.98 119.36 120.29 2dxb n ILE 215 Ca 0.03 -0.67 0.00 0.00 0.56 0.00 0.00 62.75 62.67 2dxb n ILE 215 Cb 0.33 -1.62 0.00 0.00 -0.75 0.00 0.00 39.64 37.60 2dxb n ILE 215 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2dxb n GLY 216 N 1.96 0.83 0.24 7.39 0.00 0.15 -1.49 105.19 114.27 2dxb n GLY 216 Ca -0.31 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.76 0.03 -3.67 1.61 0.24 -0.86 -4.68 118.33 110.25 2dxb n VAL 217 Ca 0.00 -0.13 -0.10 0.00 -2.04 0.00 0.00 64.34 62.06 2dxb n VAL 217 Cb 0.00 -0.01 -0.05 0.00 -1.47 0.00 0.00 33.84 32.31 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 -1.97 -0.84 0.11 2.33 0.00 -1.16 -4.65 121.76 115.58 2dxb s ALA 218 Ca 0.39 -0.09 0.09 0.00 0.00 0.00 0.00 51.96 52.36 2dxb s ALA 218 Cb 0.19 0.62 -0.04 0.00 0.00 0.00 0.00 23.12 23.90 2dxb s ALA 218 CO 0.32 -0.60 -0.21 0.14 0.00 0.00 0.00 175.76 175.40 2dxb s VAL 219 N -3.65 2.64 0.34 0.00 -7.23 -1.26 -4.04 120.40 107.20 2dxb s VAL 219 Ca 0.02 -1.55 -0.28 0.00 -1.81 0.00 0.00 61.98 58.36 2dxb s VAL 219 Cb 0.02 -2.18 -0.10 0.00 0.56 0.00 0.00 36.38 34.67 2dxb s VAL 219 CO -0.11 0.13 1.32 -2.16 -0.31 0.00 0.00 175.10 173.97 2dxb s PRO 220 N -2.02 4.31 -0.02 4.82 0.04 -1.26 -4.96 135.00 135.90 2dxb s PRO 220 Ca 0.16 2.24 -0.01 0.00 0.04 0.00 0.00 61.00 63.43 2dxb s PRO 220 Cb -0.10 -3.04 0.02 0.00 0.04 0.00 0.00 34.50 31.42 2dxb s PRO 220 CO 0.08 -0.24 0.04 0.15 0.04 0.00 0.00 177.00 177.08 2dxb s LYS 221 N -1.85 0.01 0.21 4.56 1.02 -1.26 -4.63 119.74 117.80 2dxb s LYS 221 Ca 0.50 0.15 -0.32 0.00 0.02 0.00 0.00 55.97 56.31 2dxb s LYS 221 Cb -0.40 -0.12 -0.13 0.00 -0.52 0.00 0.00 37.83 36.65 2dxb s LYS 221 CO 0.53 -0.10 1.49 -2.30 -0.92 0.00 0.00 175.35 174.05 2dxb n PRO 222 N 3.69 2.11 0.00 -1.68 -0.02 -1.26 -1.62 135.00 136.23 2dxb n PRO 222 Ca -0.21 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 2dxb n PRO 222 Cb 0.55 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 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 2.66 3.37 3.44 -1.23 0.00 -1.26 -5.01 105.19 107.16 2dxb n GLY 223 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.54 4.73 -0.02 -0.61 1.01 -0.64 -4.93 121.20 118.21 2dxb s ILE 224 Ca 0.00 -0.52 0.03 0.00 0.00 0.00 0.00 60.65 60.15 2dxb s ILE 224 Cb 0.00 -3.49 0.04 0.00 0.01 0.00 0.00 42.46 39.02 2dxb s ILE 224 CO 0.00 -0.05 1.00 0.35 0.00 0.00 0.00 174.94 176.24 2dxb n THR 225 N 5.01 1.07 -3.97 2.92 -2.24 -1.26 -4.41 114.28 111.40 2dxb n THR 225 Ca -0.13 -1.12 -0.09 0.00 -2.27 0.00 0.00 64.05 60.44 2dxb n THR 225 Cb 0.48 0.42 -0.10 0.00 -2.10 0.00 0.00 70.33 69.03 2dxb n THR 225 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2dxb s VAL 226 N -1.21 0.14 0.82 2.28 -7.23 -1.26 -4.88 120.40 109.06 2dxb s VAL 226 Ca 0.04 -1.16 -0.13 0.00 -1.81 0.00 0.00 61.98 58.92 2dxb s VAL 226 Cb 0.04 -0.83 0.08 0.00 0.56 0.00 0.00 36.38 36.23 2dxb s VAL 226 CO 0.00 -0.64 1.14 0.59 -0.31 0.00 0.00 175.10 175.89 2dxb n ASN 227 N 0.89 0.77 -4.75 4.85 3.02 -1.26 -4.90 115.26 113.89 2dxb n ASN 227 Ca -0.20 0.57 -0.39 0.00 -0.03 0.00 0.00 54.58 54.53 2dxb n ASN 227 Cb 0.58 -1.48 0.03 0.00 -0.61 0.00 0.00 39.78 38.29 2dxb n ASN 227 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dxb n ALA 228 N -3.33 1.78 -2.17 5.41 0.00 -1.26 -4.91 120.51 116.03 2dxb n ALA 228 Ca 0.13 0.20 -0.42 0.00 0.00 0.00 0.00 53.44 53.35 2dxb n ALA 228 Cb 0.51 -2.36 -0.03 0.00 0.00 0.00 0.00 19.45 17.56 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 -2.60 4.33 0.12 0.00 2.20 -1.26 -5.02 119.74 117.51 2dxb s LYS 229 Ca 0.65 2.06 0.02 0.00 -0.36 0.00 0.00 55.97 58.35 2dxb s LYS 229 Cb -0.44 -3.25 -0.04 0.00 -1.51 0.00 0.00 37.83 32.59 2dxb s LYS 229 CO 0.54 -0.42 -0.05 1.03 -0.36 0.00 0.00 175.35 176.10 2dxb s ARG 230 N 1.02 0.93 0.56 4.03 0.52 -1.26 -5.13 118.95 119.61 2dxb s ARG 230 Ca 0.64 -1.40 -0.21 0.00 -0.52 0.00 0.00 55.73 54.23 2dxb s ARG 230 Cb -0.37 -0.24 -0.05 0.00 0.52 0.00 0.00 34.95 34.82 2dxb s ARG 230 CO 0.31 -0.05 1.34 -2.30 0.02 0.00 0.00 175.30 174.62 2dxb n PRO 231 N -0.11 1.62 -4.05 3.54 -0.02 -1.26 -4.98 135.00 129.74 2dxb n PRO 231 Ca -0.10 0.60 -0.33 0.00 -2.02 0.00 0.00 63.50 61.65 2dxb n PRO 231 Cb 0.62 -2.56 -0.15 0.00 -0.02 0.00 0.00 33.50 31.38 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 -1.30 2.32 -0.14 -1.45 1.01 -1.26 -5.08 120.40 114.50 2dxb s VAL 232 Ca 0.73 -1.30 -0.29 0.00 0.00 0.00 0.00 61.98 61.11 2dxb s VAL 232 Cb -0.41 -2.22 -0.01 0.00 0.00 0.00 0.00 36.38 33.73 2dxb s VAL 232 CO 0.48 0.18 1.15 -0.22 0.00 0.00 0.00 175.10 176.69 2dxb s LEU 233 N 1.21 4.20 0.40 3.92 2.96 -1.26 -5.00 118.68 125.11 2dxb s LEU 233 Ca -0.03 1.63 -0.24 0.00 -0.22 0.00 0.00 54.13 55.27 2dxb s LEU 233 Cb -0.17 -3.55 -0.09 0.00 0.50 0.00 0.00 46.19 42.88 2dxb s LEU 233 CO -0.07 -0.63 1.04 -0.54 -1.32 0.00 0.00 176.35 174.83 2dxb s LYS 234 N 2.80 4.17 0.20 1.98 -0.14 -1.26 -5.05 119.74 122.44 2dxb s LYS 234 Ca 0.52 1.49 -0.07 0.00 -1.36 0.00 0.00 55.97 56.54 2dxb s LYS 234 Cb -0.20 -2.52 -0.06 0.00 -1.68 0.00 0.00 37.83 33.36 2dxb s LYS 234 CO 0.15 -0.13 0.48 0.00 -0.76 0.00 0.00 175.35 175.09 2dxb s ALA 235 N -1.68 3.66 0.11 5.17 0.00 -1.26 -5.00 121.76 122.75 2dxb s ALA 235 Ca 0.58 -0.42 -0.19 0.00 0.00 0.00 0.00 51.96 51.93 2dxb s ALA 235 Cb -0.21 -2.30 -0.07 0.00 0.00 0.00 0.00 23.12 20.54 2dxb s ALA 235 CO 0.27 0.54 1.67 -0.97 0.00 0.00 0.00 175.76 177.27 2dxb h ASN 236 N 2.56 0.31 -2.49 0.00 -1.24 -2.07 -3.36 115.58 109.30 2dxb h ASN 236 Ca -0.47 -0.14 -0.59 0.00 0.71 0.00 0.00 56.30 55.81 2dxb h ASN 236 Cb 1.17 -0.08 -0.39 0.00 0.73 0.00 0.00 38.32 39.75 2dxb h ASN 236 CO 0.70 0.36 -0.89 -1.14 -1.29 0.00 0.00 177.43 175.18 2dxb n ARG 237 N -4.82 0.68 -1.02 6.67 0.63 -1.26 -5.13 116.66 112.41 2dxb n ARG 237 Ca -0.03 -3.53 -0.33 0.00 -0.92 0.00 0.00 57.85 53.04 2dxb n ARG 237 Cb 0.11 -1.79 0.13 0.00 0.45 0.00 0.00 32.46 31.36 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 2.45 0.05 0.00 -0.14 -0.04 -1.26 -5.26 135.00 130.79 2dxb n PRO 238 Ca 0.27 0.09 0.15 0.00 -0.04 0.00 0.00 63.50 63.97 2dxb n PRO 238 Cb 0.45 -2.38 0.88 0.00 -0.04 0.00 0.00 33.50 32.41 2dxb n PRO 238 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74