#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2xew s GLN 2 N 0.00 3.71 0.23 3.17 0.74 -1.26 -0.12 119.66 126.14 2xew s GLN 2 Ca 0.00 -0.30 0.05 0.00 0.05 0.00 0.00 55.36 55.17 2xew s GLN 2 Cb 0.00 -3.16 -0.05 0.00 1.10 0.00 0.00 33.01 30.90 2xew s GLN 2 CO 0.00 0.46 -0.05 0.96 -0.55 0.00 0.00 175.29 176.11 2xew s ILE 3 N -0.15 1.36 -0.07 -2.34 -4.36 -0.55 0.53 121.20 115.61 2xew s ILE 3 Ca 0.08 -2.09 0.03 0.00 -0.26 0.00 0.00 60.65 58.40 2xew s ILE 3 Cb -0.12 -2.28 -0.02 0.00 1.25 0.00 0.00 42.46 41.28 2xew s ILE 3 CO 0.01 -0.40 -0.14 -0.36 0.24 0.00 0.00 174.94 174.28 2xew s PHE 4 N -3.21 2.72 -0.17 1.37 0.40 -0.24 -0.96 117.98 117.89 2xew s PHE 4 Ca 0.27 -0.32 0.00 0.00 -0.60 0.00 0.00 56.93 56.27 2xew s PHE 4 Cb 0.04 -1.69 0.00 0.00 0.51 0.00 0.00 43.02 41.88 2xew s PHE 4 CO 0.09 0.05 -0.16 0.08 0.70 0.00 0.00 175.22 175.98 2xew s VAL 5 N -0.39 2.54 -0.04 -0.44 1.01 0.11 -0.29 120.40 122.89 2xew s VAL 5 Ca 0.04 -0.80 0.07 0.00 0.00 0.00 0.00 61.98 61.29 2xew s VAL 5 Cb -0.12 -2.08 -0.02 0.00 0.00 0.00 0.00 36.38 34.16 2xew s VAL 5 CO 0.02 0.51 -0.25 -0.54 0.00 0.00 0.00 175.10 174.84 2xew s LYS 6 N 1.07 2.34 0.83 2.72 1.02 0.31 0.41 119.74 128.44 2xew s LYS 6 Ca -0.00 -0.91 -0.12 0.00 0.02 0.00 0.00 55.97 54.96 2xew s LYS 6 Cb -0.14 -2.12 0.09 0.00 -0.52 0.00 0.00 37.83 35.14 2xew s LYS 6 CO -0.05 0.48 1.10 0.95 -0.92 0.00 0.00 175.35 176.91 2xew s THR 7 N -0.40 2.92 -1.98 2.17 -4.23 -0.66 -0.07 115.64 113.39 2xew s THR 7 Ca 0.03 0.30 0.25 0.00 -1.18 0.00 0.00 61.69 61.10 2xew s THR 7 Cb -0.12 -2.97 0.71 0.00 1.34 0.00 0.00 72.50 71.46 2xew s THR 7 CO 0.01 -0.39 1.87 0.18 -0.54 0.00 0.00 174.62 175.76 2xew n LEU 8 N -3.56 0.00 -0.18 4.79 4.32 -1.26 -1.25 117.00 119.86 2xew n LEU 8 Ca 0.07 0.01 0.13 0.00 -0.02 0.00 0.00 56.01 56.20 2xew n LEU 8 Cb 0.56 -0.01 0.47 0.00 -1.62 0.00 0.00 43.42 42.82 2xew n LEU 8 CO 0.56 -0.00 0.74 1.07 -1.22 0.00 0.00 177.39 178.54 2xew n THR 9 N -1.01 0.00 0.00 -5.08 5.66 -1.26 -4.93 114.28 107.66 2xew n THR 9 Ca 0.19 -0.09 0.00 0.00 -3.05 0.00 0.00 64.05 61.10 2xew n THR 9 Cb 0.09 0.17 0.00 0.00 -1.55 0.00 0.00 70.33 69.04 2xew n THR 9 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2xew n GLY 10 N 1.32 2.33 3.66 1.09 0.00 -0.38 -5.03 105.19 108.18 2xew n GLY 10 Ca 0.13 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.69 2xew n GLY 10 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2xew n LYS 11 N -2.00 1.98 -4.60 1.61 5.02 -1.26 -4.75 118.16 114.16 2xew n LYS 11 Ca 0.00 0.71 -0.33 0.00 -2.02 0.00 0.00 58.31 56.67 2xew n LYS 11 Cb 0.00 -2.40 -0.15 0.00 -0.02 0.00 0.00 35.03 32.46 2xew n LYS 11 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2xew s THR 12 N 0.32 2.79 -0.17 -0.18 2.01 -1.26 -1.66 115.64 117.49 2xew s THR 12 Ca 0.73 -0.73 -0.07 0.00 0.31 0.00 0.00 61.69 61.92 2xew s THR 12 Cb -0.69 -2.18 -0.04 0.00 0.01 0.00 0.00 72.50 69.60 2xew s THR 12 CO 0.45 0.51 0.08 -0.63 -0.69 0.00 0.00 174.62 174.34 2xew s ILE 13 N 0.69 4.94 -0.15 1.82 1.01 0.16 -4.97 121.20 124.71 2xew s ILE 13 Ca -0.07 0.02 -0.04 0.00 0.00 0.00 0.00 60.65 60.56 2xew s ILE 13 Cb -0.16 -3.21 -0.03 0.00 0.01 0.00 0.00 42.46 39.07 2xew s ILE 13 CO 0.02 0.48 -0.01 -0.89 0.00 0.00 0.00 174.94 174.54 2xew s THR 14 N 0.12 4.12 0.07 2.92 2.01 -1.26 0.05 115.64 123.68 2xew s THR 14 Ca 0.06 -0.28 0.06 0.00 0.31 0.00 0.00 61.69 61.84 2xew s THR 14 Cb -0.12 -2.81 -0.03 0.00 0.01 0.00 0.00 72.50 69.55 2xew s THR 14 CO 0.00 0.50 -0.17 -0.76 -0.69 0.00 0.00 174.62 173.51 2xew s LEU 15 N 0.19 2.25 -0.22 4.42 1.43 -0.14 -5.00 118.68 121.61 2xew s LEU 15 Ca -0.00 -0.60 -0.08 0.00 -1.03 0.00 0.00 54.13 52.42 2xew s LEU 15 Cb -0.13 -0.68 -0.04 0.00 0.03 0.00 0.00 46.19 45.37 2xew s LEU 15 CO 0.02 0.00 0.10 -0.70 0.23 0.00 0.00 176.35 176.00 2xew s GLU 16 N -1.63 3.90 0.30 1.70 2.12 -1.26 -1.48 118.70 122.36 2xew s GLU 16 Ca 0.02 -0.36 0.00 0.00 0.36 0.00 0.00 54.97 54.99 2xew s GLU 16 Cb -0.09 -3.36 -0.02 0.00 0.26 0.00 0.00 34.13 30.92 2xew s GLU 16 CO 0.03 0.05 0.34 0.14 -0.54 0.00 0.00 175.26 175.28 2xew s VAL 17 N 1.01 0.00 0.09 3.70 -7.23 0.83 -4.93 120.40 113.87 2xew s VAL 17 Ca 0.05 -1.80 0.07 0.00 -1.81 0.00 0.00 61.98 58.49 2xew s VAL 17 Cb -0.14 -2.53 -0.03 0.00 0.56 0.00 0.00 36.38 34.24 2xew s VAL 17 CO 0.03 0.00 -0.19 -1.61 -0.31 0.00 0.00 175.10 173.02 2xew s GLU 18 N -3.49 1.04 0.59 4.82 2.02 -1.26 -0.40 118.70 122.02 2xew s GLU 18 Ca 0.35 -1.11 0.29 0.00 0.02 0.00 0.00 54.97 54.52 2xew s GLU 18 Cb 0.02 -1.23 1.49 0.00 0.10 0.00 0.00 34.13 34.51 2xew s GLU 18 CO 0.20 0.28 1.92 -1.35 0.02 0.00 0.00 175.26 176.33 2xew h PRO 19 N 4.11 0.00 -0.01 0.39 0.11 -1.96 0.62 132.00 135.26 2xew h PRO 19 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2xew h PRO 19 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2xew h PRO 19 CO 0.40 0.00 -0.02 -1.13 -0.21 0.00 0.00 178.00 177.04 2xew n SER 20 N -3.72 1.25 -4.76 -2.05 3.41 -1.26 -0.74 113.62 105.75 2xew n SER 20 Ca 0.08 -1.37 -0.41 0.00 -0.26 0.00 0.00 58.87 56.91 2xew n SER 20 Cb 0.63 0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 64.57 2xew n SER 20 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2xew s ASP 21 N -2.05 6.80 0.76 4.04 1.01 0.21 -4.76 116.67 122.68 2xew s ASP 21 Ca 0.38 2.61 -0.11 0.00 0.71 0.00 0.00 52.55 56.14 2xew s ASP 21 Cb 0.21 -2.64 0.05 0.00 1.01 0.00 0.00 42.92 41.55 2xew s ASP 21 CO 0.36 -0.54 1.09 0.42 0.21 0.00 0.00 175.17 176.71 2xew s THR 22 N -0.72 3.29 0.31 -1.27 -4.23 -1.26 -0.73 115.64 111.03 2xew s THR 22 Ca 0.52 0.42 0.01 0.00 -1.18 0.00 0.00 61.69 61.46 2xew s THR 22 Cb -0.39 -3.23 0.28 0.00 1.34 0.00 0.00 72.50 70.50 2xew s THR 22 CO 0.48 -0.55 1.94 0.40 -0.54 0.00 0.00 174.62 176.35 2xew h ILE 23 N -0.93 1.11 -0.91 2.99 1.08 -0.45 -2.02 117.51 118.38 2xew h ILE 23 Ca -0.46 -0.35 -0.01 0.00 -0.39 0.00 0.00 64.86 63.65 2xew h ILE 23 Cb 1.26 0.01 -0.04 0.00 -3.07 0.00 0.00 36.82 34.97 2xew h ILE 23 CO 0.60 0.18 0.54 -0.08 -0.69 0.00 0.00 178.15 178.70 2xew h GLU 24 N 1.01 1.25 -0.76 2.37 4.57 -1.51 -1.05 114.58 120.47 2xew h GLU 24 Ca 0.34 -0.12 0.07 0.00 -1.18 0.00 0.00 59.36 58.47 2xew h GLU 24 Cb 0.09 -0.26 -0.06 0.00 -0.16 0.00 0.00 28.75 28.37 2xew h GLU 24 CO -0.11 0.88 0.44 -0.91 -1.18 0.00 0.00 179.01 178.13 2xew h ASN 25 N 1.26 0.66 -0.39 1.04 2.35 -1.65 0.29 115.58 119.13 2xew h ASN 25 Ca 0.33 0.03 -0.04 0.00 -0.55 0.00 0.00 56.30 56.07 2xew h ASN 25 Cb -0.04 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.22 2xew h ASN 25 CO -0.06 0.41 0.10 0.58 -1.65 0.00 0.00 177.43 176.81 2xew h VAL 26 N 0.79 1.23 -0.03 2.81 2.07 -0.98 -1.47 116.25 120.65 2xew h VAL 26 Ca 0.34 -0.78 -0.01 0.00 0.82 0.00 0.00 66.70 67.07 2xew h VAL 26 Cb 0.22 0.99 -0.00 0.00 -1.52 0.00 0.00 31.29 30.98 2xew h VAL 26 CO -0.19 0.27 -0.05 0.11 0.02 0.00 0.00 177.57 177.73 2xew h LYS 27 N 0.49 0.05 -0.21 1.57 1.57 -0.80 0.50 116.57 119.74 2xew h LYS 27 Ca 0.12 -0.01 -0.20 0.00 -1.87 0.00 0.00 60.65 58.70 2xew h LYS 27 Cb 0.31 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.61 2xew h LYS 27 CO 0.00 0.10 -0.65 0.00 -0.57 0.00 0.00 179.45 178.33 2xew h ALA 28 N 1.91 0.44 -0.38 3.86 0.00 -0.50 -1.77 119.26 122.82 2xew h ALA 28 Ca 0.01 -0.56 -0.09 0.00 0.00 0.00 0.00 54.91 54.28 2xew h ALA 28 Cb 0.12 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2xew h ALA 28 CO 0.01 0.69 -0.12 0.87 0.00 0.00 0.00 179.25 180.70 2xew h LYS 29 N 0.57 0.68 -0.51 0.00 1.57 -0.31 0.17 116.57 118.73 2xew h LYS 29 Ca -0.02 -0.22 -0.06 0.00 -1.87 0.00 0.00 60.65 58.48 2xew h LYS 29 Cb 1.26 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.49 2xew h LYS 29 CO 0.14 0.78 0.07 0.82 -0.57 0.00 0.00 179.45 180.68 2xew h ILE 30 N 0.62 1.25 -0.58 1.86 2.04 -0.87 -1.37 117.51 120.46 2xew h ILE 30 Ca 0.11 -0.97 -0.02 0.00 1.00 0.00 0.00 64.86 64.98 2xew h ILE 30 Cb 0.56 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 2xew h ILE 30 CO 0.04 0.35 0.29 -0.61 0.00 0.00 0.00 178.15 178.21 2xew h GLN 31 N 0.74 0.82 -0.87 2.37 4.15 -1.01 0.40 115.11 121.71 2xew h GLN 31 Ca 0.15 -0.11 0.10 0.00 0.77 0.00 0.00 58.65 59.56 2xew h GLN 31 Cb 0.42 -0.15 -0.06 0.00 0.21 0.00 0.00 27.48 27.90 2xew h GLN 31 CO 0.01 0.65 0.56 -0.44 -1.93 0.00 0.00 178.83 177.69 2xew h ASP 32 N 0.78 0.77 0.48 -0.69 3.32 -0.33 0.11 116.42 120.86 2xew h ASP 32 Ca 0.20 0.02 -0.27 0.00 0.02 0.00 0.00 57.03 57.01 2xew h ASP 32 Cb 0.09 -0.14 -0.05 0.00 0.22 0.00 0.00 39.33 39.46 2xew h ASP 32 CO -0.03 0.45 -1.72 0.29 -1.72 0.00 0.00 179.24 176.51 2xew n LYS 33 N -4.53 0.64 0.00 3.56 5.02 -0.55 -4.69 118.16 117.61 2xew n LYS 33 Ca 0.15 0.24 0.00 0.00 -2.02 0.00 0.00 58.31 56.68 2xew n LYS 33 Cb 0.32 -1.76 0.00 0.00 -0.02 0.00 0.00 35.03 33.56 2xew n LYS 33 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2xew n GLU 34 N -2.96 3.88 -0.84 1.97 -0.58 0.14 -5.02 120.64 117.22 2xew n GLU 34 Ca -0.17 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.57 2xew n GLU 34 Cb 1.01 -0.53 0.00 0.00 -0.57 0.00 0.00 31.44 31.35 2xew n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2xew n GLY 35 N 1.08 0.89 3.66 0.62 0.00 0.01 -5.00 105.19 106.46 2xew n GLY 35 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2xew n GLY 35 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2xew s ILE 36 N -3.53 4.71 0.40 -0.61 2.07 -1.26 -4.98 121.20 118.01 2xew s ILE 36 Ca 0.00 1.94 -0.27 0.00 -1.41 0.00 0.00 60.65 60.91 2xew s ILE 36 Cb 0.00 -4.27 -0.10 0.00 0.13 0.00 0.00 42.46 38.22 2xew s ILE 36 CO 0.00 -0.16 1.42 -2.84 -1.91 0.00 0.00 174.94 171.45 2xew s PRO 37 N 3.11 3.99 0.29 3.50 0.02 -1.26 -3.71 135.00 140.94 2xew s PRO 37 Ca 0.42 2.42 0.04 0.00 0.02 0.00 0.00 61.00 63.91 2xew s PRO 37 Cb -0.15 -2.86 0.74 0.00 0.02 0.00 0.00 34.50 32.25 2xew s PRO 37 CO 0.06 -0.57 1.71 -1.35 -0.33 0.00 0.00 177.00 176.52 2xew h PRO 38 N 2.79 0.44 -0.01 5.54 0.11 -1.95 -0.39 132.00 138.53 2xew h PRO 38 Ca -0.50 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.58 2xew h PRO 38 Cb 1.25 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 2xew h PRO 38 CO 0.63 0.29 0.02 0.38 -0.21 0.00 0.00 178.00 179.11 2xew h ASP 39 N 0.45 0.00 -0.20 -2.05 2.03 -1.97 0.28 116.42 114.96 2xew h ASP 39 Ca 0.57 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.87 2xew h ASP 39 Cb 1.05 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.55 2xew h ASP 39 CO -0.51 0.00 0.00 0.00 -1.03 0.00 0.00 179.24 177.70 2xew n GLN 40 N -3.36 1.97 -3.97 4.15 6.02 -0.16 -4.74 117.38 117.29 2xew n GLN 40 Ca -0.03 -1.46 -0.35 0.00 -0.01 0.00 0.00 57.00 55.15 2xew n GLN 40 Cb 0.09 -1.44 -0.12 0.00 1.02 0.00 0.00 30.24 29.79 2xew n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2xew s GLN 41 N -1.74 3.65 -0.23 -1.09 -0.21 0.97 -1.92 119.66 119.09 2xew s GLN 41 Ca 0.34 -0.50 -0.04 0.00 0.02 0.00 0.00 55.36 55.18 2xew s GLN 41 Cb 0.19 -3.16 -0.01 0.00 1.00 0.00 0.00 33.01 31.04 2xew s GLN 41 CO 0.28 -0.03 -0.03 0.50 -2.12 0.00 0.00 175.29 173.89 2xew s ARG 42 N 1.14 3.36 -0.09 2.91 3.52 -0.17 -4.86 118.95 124.75 2xew s ARG 42 Ca 0.03 -0.64 -0.05 0.00 -0.13 0.00 0.00 55.73 54.94 2xew s ARG 42 Cb -0.14 -3.04 -0.04 0.00 -1.56 0.00 0.00 34.95 30.16 2xew s ARG 42 CO 0.02 -0.22 0.12 -0.51 -0.81 0.00 0.00 175.30 173.91 2xew s LEU 43 N 1.48 4.24 -0.01 -0.88 1.43 -1.26 -0.81 118.68 122.88 2xew s LEU 43 Ca 0.05 0.39 0.02 0.00 -1.03 0.00 0.00 54.13 53.56 2xew s LEU 43 Cb -0.14 -2.11 -0.00 0.00 0.03 0.00 0.00 46.19 43.96 2xew s LEU 43 CO -0.03 0.38 -0.07 -0.63 0.23 0.00 0.00 176.35 176.24 2xew s ILE 44 N -1.05 0.52 -0.03 -0.59 1.01 -0.09 -0.82 121.20 120.14 2xew s ILE 44 Ca 0.17 -0.28 -0.01 0.00 0.00 0.00 0.00 60.65 60.53 2xew s ILE 44 Cb -0.12 -0.44 0.03 0.00 0.01 0.00 0.00 42.46 41.95 2xew s ILE 44 CO 0.06 0.15 0.06 0.12 0.00 0.00 0.00 174.94 175.33 2xew s PHE 45 N -0.14 -0.02 -1.53 3.97 5.36 -0.87 -0.44 117.98 124.31 2xew s PHE 45 Ca 0.02 0.24 -0.10 0.00 -0.96 0.00 0.00 56.93 56.14 2xew s PHE 45 Cb -0.03 -0.24 0.08 0.00 -0.34 0.00 0.00 43.02 42.49 2xew s PHE 45 CO -0.00 -0.13 0.69 0.00 -1.46 0.00 0.00 175.22 174.32 2xew n ALA 46 N 4.38 -1.59 -0.93 11.12 0.00 -1.26 -1.98 120.51 130.25 2xew n ALA 46 Ca -0.24 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.13 2xew n ALA 46 Cb 0.50 -2.85 0.00 0.00 0.00 0.00 0.00 19.45 17.10 2xew n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2xew n GLY 47 N -1.69 0.82 3.66 0.00 0.00 -1.26 -4.99 105.19 101.73 2xew n GLY 47 Ca -0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 2xew n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2xew s LYS 48 N -0.17 3.75 0.05 1.61 0.00 -0.84 -5.07 119.74 119.09 2xew s LYS 48 Ca 0.00 -0.34 -0.31 0.00 0.00 0.00 0.00 55.97 55.32 2xew s LYS 48 Cb 0.00 -3.13 -0.07 0.00 0.00 0.00 0.00 37.83 34.64 2xew s LYS 48 CO 0.00 0.39 1.39 -0.65 0.00 0.00 0.00 175.35 176.48 2xew s GLN 49 N 0.03 4.30 -0.03 1.78 -0.21 -1.26 -2.06 119.66 122.22 2xew s GLN 49 Ca 0.05 2.01 -0.24 0.00 0.02 0.00 0.00 55.36 57.20 2xew s GLN 49 Cb -0.12 -3.43 -0.04 0.00 1.00 0.00 0.00 33.01 30.41 2xew s GLN 49 CO 0.01 -0.51 0.72 -0.51 -2.12 0.00 0.00 175.29 172.88 2xew s LEU 50 N 1.82 4.36 -0.05 2.90 1.43 0.00 -4.98 118.68 124.16 2xew s LEU 50 Ca 0.64 1.27 -0.17 0.00 -1.03 0.00 0.00 54.13 54.84 2xew s LEU 50 Cb -0.34 -3.12 -0.05 0.00 0.03 0.00 0.00 46.19 42.71 2xew s LEU 50 CO 0.28 -0.07 0.46 -1.61 0.23 0.00 0.00 176.35 175.65 2xew s GLU 51 N 0.50 4.18 0.29 1.70 2.02 -1.26 -4.70 118.70 121.43 2xew s GLU 51 Ca 0.38 0.47 0.03 0.00 0.02 0.00 0.00 54.97 55.87 2xew s GLU 51 Cb -0.19 -3.34 0.70 0.00 0.10 0.00 0.00 34.13 31.41 2xew s GLU 51 CO 0.20 0.41 1.71 -0.44 0.02 0.00 0.00 175.26 177.15 2xew h ASP 52 N 5.73 0.39 0.89 -0.19 3.45 -1.96 -2.17 116.42 122.55 2xew h ASP 52 Ca -0.46 0.14 0.00 0.00 0.43 0.00 0.00 57.03 57.14 2xew h ASP 52 Cb 1.20 0.10 0.00 0.00 -0.56 0.00 0.00 39.33 40.07 2xew h ASP 52 CO 0.69 0.05 -0.13 0.61 -1.57 0.00 0.00 179.24 178.89 2xew n GLY 53 N -1.33 -1.44 3.87 2.75 0.00 -1.26 -1.40 105.19 106.38 2xew n GLY 53 Ca 0.21 -0.16 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 2xew n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2xew s ARG 54 N -3.00 3.81 0.65 1.61 1.81 -0.82 -4.84 118.95 118.17 2xew s ARG 54 Ca 0.13 0.44 -0.03 0.00 -1.72 0.00 0.00 55.73 54.55 2xew s ARG 54 Cb 0.18 -2.45 0.06 0.00 -0.45 0.00 0.00 34.95 32.29 2xew s ARG 54 CO 0.58 0.06 0.92 0.95 -0.68 0.00 0.00 175.30 177.13 2xew s THR 55 N -2.21 2.42 0.19 0.02 -4.23 -1.26 -0.51 115.64 110.06 2xew s THR 55 Ca 0.51 -0.45 -0.07 0.00 -1.18 0.00 0.00 61.69 60.50 2xew s THR 55 Cb -0.10 -2.98 0.02 0.00 1.34 0.00 0.00 72.50 70.78 2xew s THR 55 CO 0.27 0.00 1.59 -0.07 -0.54 0.00 0.00 174.62 175.88 2xew h LEU 56 N -0.34 0.90 -0.94 4.79 3.38 -0.62 -2.93 115.31 119.56 2xew h LEU 56 Ca -0.43 -0.33 -0.10 0.00 0.09 0.00 0.00 57.88 57.11 2xew h LEU 56 Cb 1.30 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 2xew h LEU 56 CO 0.55 1.08 -0.25 0.77 0.09 0.00 0.00 178.44 180.69 2xew h SER 57 N 0.77 0.48 -0.41 -0.43 4.64 -1.16 0.05 113.55 117.49 2xew h SER 57 Ca 0.10 -0.16 0.12 0.00 -0.47 0.00 0.00 61.79 61.38 2xew h SER 57 Cb 0.76 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.70 2xew h SER 57 CO 0.06 0.73 0.36 0.44 -0.87 0.00 0.00 176.83 177.55 2xew h ASP 58 N 0.43 0.00 -0.64 4.97 3.45 -1.78 0.28 116.42 123.12 2xew h ASP 58 Ca 0.06 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.52 2xew h ASP 58 Cb 0.67 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.44 2xew h ASP 58 CO 0.05 0.00 0.00 -1.22 -1.57 0.00 0.00 179.24 176.50 2xew n TYR 59 N -4.04 0.88 -3.70 4.55 4.02 -0.69 -4.94 117.16 113.24 2xew n TYR 59 Ca 0.07 -0.50 -0.28 0.00 -0.01 0.00 0.00 57.90 57.17 2xew n TYR 59 Cb 0.54 -0.02 0.01 0.00 -0.02 0.00 0.00 39.34 39.86 2xew n TYR 59 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2xew n ASN 60 N 1.36 -4.55 -4.59 7.72 3.02 0.99 -4.91 115.26 114.30 2xew n ASN 60 Ca 0.22 -0.64 -0.42 0.00 -0.03 0.00 0.00 54.58 53.70 2xew n ASN 60 Cb 0.59 -3.67 -0.04 0.00 -0.61 0.00 0.00 39.78 36.04 2xew n ASN 60 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2xew s ILE 61 N -3.18 4.64 0.53 2.41 1.01 -0.08 -5.00 121.20 121.53 2xew s ILE 61 Ca 0.56 0.98 0.05 0.00 0.00 0.00 0.00 60.65 62.24 2xew s ILE 61 Cb -0.29 -4.29 0.05 0.00 0.01 0.00 0.00 42.46 37.94 2xew s ILE 61 CO 0.70 -0.53 0.39 0.00 0.00 0.00 0.00 174.94 175.50 2xew n GLN 62 N 6.65 0.71 -1.62 2.79 6.02 -1.26 -4.49 117.38 126.18 2xew n GLN 62 Ca 0.05 -3.32 -0.41 0.00 -0.01 0.00 0.00 57.00 53.31 2xew n GLN 62 Cb 0.48 0.37 0.01 0.00 1.02 0.00 0.00 30.24 32.12 2xew n GLN 62 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 2xew n LYS 63 N -1.73 1.41 -0.84 -1.09 2.85 -1.26 -1.82 118.16 115.68 2xew n LYS 63 Ca -0.02 0.51 0.00 0.00 -1.05 0.00 0.00 58.31 57.74 2xew n LYS 63 Cb 0.60 -2.10 0.00 0.00 -0.65 0.00 0.00 35.03 32.89 2xew n LYS 63 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2xew n GLU 64 N 0.07 -0.06 -1.69 -1.58 4.71 0.19 -4.98 120.64 117.29 2xew n GLU 64 Ca 0.09 0.02 -0.38 0.00 -0.01 0.00 0.00 57.16 56.88 2xew n GLU 64 Cb 0.40 -3.24 0.06 0.00 -1.01 0.00 0.00 31.44 27.64 2xew n GLU 64 CO 0.00 0.00 0.00 0.43 0.09 0.00 0.00 177.13 177.65 2xew n SER 65 N -0.03 1.75 -4.34 1.62 7.64 -0.75 -4.64 113.62 114.87 2xew n SER 65 Ca 0.00 0.86 -0.37 0.00 1.01 0.00 0.00 58.87 60.37 2xew n SER 65 Cb 0.02 -1.50 -0.13 0.00 -1.01 0.00 0.00 64.21 61.59 2xew n SER 65 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2xew s THR 66 N -1.40 3.90 0.16 0.44 2.01 -1.26 -1.08 115.64 118.42 2xew s THR 66 Ca 0.77 -0.67 -0.08 0.00 0.31 0.00 0.00 61.69 62.03 2xew s THR 66 Cb -0.41 -2.99 -0.06 0.00 0.01 0.00 0.00 72.50 69.05 2xew s THR 66 CO 0.45 0.12 0.45 -0.76 -0.69 0.00 0.00 174.62 174.19 2xew s LEU 67 N 1.50 4.25 -0.09 4.42 1.02 0.61 -4.84 118.68 125.54 2xew s LEU 67 Ca 0.03 0.75 -0.10 0.00 0.02 0.00 0.00 54.13 54.84 2xew s LEU 67 Cb -0.17 -3.40 -0.05 0.00 0.02 0.00 0.00 46.19 42.60 2xew s LEU 67 CO 0.02 0.03 0.22 -1.00 0.02 0.00 0.00 176.35 175.64 2xew s HIS 68 N -1.67 3.63 -0.17 0.29 3.76 0.42 -0.53 115.29 121.02 2xew s HIS 68 Ca 0.42 0.67 -0.03 0.00 -0.15 0.00 0.00 55.06 55.96 2xew s HIS 68 Cb -0.12 -2.06 -0.02 0.00 1.11 0.00 0.00 32.58 31.49 2xew s HIS 68 CO 0.22 0.69 -0.05 -1.17 -0.85 0.00 0.00 174.74 173.58 2xew s LEU 69 N -0.97 3.11 0.05 0.89 2.96 0.90 -0.91 118.68 124.71 2xew s LEU 69 Ca 0.17 -0.22 0.04 0.00 -0.22 0.00 0.00 54.13 53.90 2xew s LEU 69 Cb -0.13 -1.76 -0.02 0.00 0.50 0.00 0.00 46.19 44.78 2xew s LEU 69 CO 0.07 0.12 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.42 2xew s VAL 70 N 0.65 0.80 0.19 1.68 1.01 0.01 -4.18 120.40 120.56 2xew s VAL 70 Ca -0.03 -1.09 -0.30 0.00 0.00 0.00 0.00 61.98 60.56 2xew s VAL 70 Cb -0.15 -0.80 -0.08 0.00 0.00 0.00 0.00 36.38 35.35 2xew s VAL 70 CO 0.02 -0.25 1.13 -0.76 0.00 0.00 0.00 175.10 175.25 2xew s LEU 71 N -1.49 4.48 -0.33 3.92 1.02 -1.26 -1.00 118.68 124.03 2xew s LEU 71 Ca -0.05 2.16 -0.09 0.00 0.02 0.00 0.00 54.13 56.17 2xew s LEU 71 Cb -0.09 -3.61 0.02 0.00 0.02 0.00 0.00 46.19 42.53 2xew s LEU 71 CO 0.01 -0.26 0.14 -0.60 0.02 0.00 0.00 176.35 175.66 2xew s ARG 72 N -0.45 3.00 0.62 1.70 3.52 -0.81 -4.81 118.95 121.73 2xew s ARG 72 Ca 0.50 -0.94 -0.04 0.00 -0.13 0.00 0.00 55.73 55.12 2xew s ARG 72 Cb -0.31 -3.53 0.04 0.00 -1.56 0.00 0.00 34.95 29.59 2xew s ARG 72 CO 0.36 -0.55 0.91 -0.51 -0.81 0.00 0.00 175.30 174.70 2xew s LEU 73 N 1.53 3.09 0.11 -0.88 1.43 -1.26 -4.67 118.68 118.02 2xew s LEU 73 Ca 0.02 0.40 -0.29 0.00 -1.03 0.00 0.00 54.13 53.23 2xew s LEU 73 Cb -0.18 -3.16 -0.06 0.00 0.03 0.00 0.00 46.19 42.82 2xew s LEU 73 CO 0.05 -1.29 0.91 -0.13 0.23 0.00 0.00 176.35 176.11 2xew s ARG 74 N -5.02 4.67 0.00 1.70 0.52 -1.26 -5.01 118.95 114.54 2xew s ARG 74 Ca 0.57 1.36 0.00 0.00 -0.52 0.00 0.00 55.73 57.14 2xew s ARG 74 Cb -0.11 -3.36 0.00 0.00 0.52 0.00 0.00 34.95 32.00 2xew s ARG 74 CO 0.43 0.27 0.00 0.41 0.02 0.00 0.00 175.30 176.43 2xew n GLY 75 N 2.18 0.63 0.71 -3.53 0.00 -1.26 -5.33 105.19 98.60 2xew n GLY 75 Ca 0.01 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.12 2xew n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93