#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 3.43 0.23 3.17 0.74 -1.26 -0.89 119.66 125.07 2xew s GLN 2 Ca 0.00 -0.66 0.06 0.00 0.05 0.00 0.00 55.36 54.81 2xew s GLN 2 Cb 0.00 -2.69 -0.05 0.00 1.10 0.00 0.00 33.01 31.37 2xew s GLN 2 CO 0.00 0.20 -0.07 0.96 -0.55 0.00 0.00 175.29 175.83 2xew s ILE 3 N 0.41 1.39 0.06 -2.34 -4.36 -0.67 0.16 121.20 115.85 2xew s ILE 3 Ca -0.09 -2.10 0.06 0.00 -0.26 0.00 0.00 60.65 58.26 2xew s ILE 3 Cb -0.16 -2.23 -0.04 0.00 1.25 0.00 0.00 42.46 41.29 2xew s ILE 3 CO 0.05 -0.45 -0.14 -0.36 0.24 0.00 0.00 174.94 174.29 2xew s PHE 4 N -3.18 2.67 -0.19 1.37 0.40 -0.39 -1.39 117.98 117.27 2xew s PHE 4 Ca 0.25 -0.19 -0.00 0.00 -0.60 0.00 0.00 56.93 56.40 2xew s PHE 4 Cb 0.03 -1.47 0.05 0.00 0.51 0.00 0.00 43.02 42.14 2xew s PHE 4 CO 0.08 0.34 -0.06 0.08 0.70 0.00 0.00 175.22 176.36 2xew s VAL 5 N -1.04 1.28 -0.04 -0.44 1.01 -0.41 0.24 120.40 120.99 2xew s VAL 5 Ca 0.17 -0.84 -0.01 0.00 0.00 0.00 0.00 61.98 61.31 2xew s VAL 5 Cb -0.11 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.76 2xew s VAL 5 CO 0.09 0.06 0.02 -0.54 0.00 0.00 0.00 175.10 174.73 2xew s LYS 6 N 1.54 2.95 0.60 2.72 1.02 0.07 -0.70 119.74 127.95 2xew s LYS 6 Ca -0.01 -0.48 -0.07 0.00 0.02 0.00 0.00 55.97 55.43 2xew s LYS 6 Cb -0.16 -2.78 -0.00 0.00 -0.52 0.00 0.00 37.83 34.36 2xew s LYS 6 CO -0.07 0.67 0.94 0.95 -0.92 0.00 0.00 175.35 176.91 2xew s THR 7 N -1.01 3.94 -1.71 2.17 -4.23 -0.31 -0.62 115.64 113.86 2xew s THR 7 Ca 0.17 0.22 0.03 0.00 -1.18 0.00 0.00 61.69 60.93 2xew s THR 7 Cb -0.12 -3.57 0.06 0.00 1.34 0.00 0.00 72.50 70.22 2xew s THR 7 CO 0.07 -0.63 0.78 0.18 -0.54 0.00 0.00 174.62 174.48 2xew n LEU 8 N -2.63 0.00 0.00 4.79 4.32 -1.26 -0.17 117.00 122.05 2xew n LEU 8 Ca 0.04 0.14 0.11 0.00 -0.02 0.00 0.00 56.01 56.28 2xew n LEU 8 Cb 0.57 -0.14 -0.05 0.00 -1.62 0.00 0.00 43.42 42.17 2xew n LEU 8 CO 0.54 -0.13 -0.02 0.41 -1.22 0.00 0.00 177.39 176.97 2xew n THR 9 N -1.14 0.02 0.00 -5.08 -1.04 -1.26 -4.97 114.28 100.81 2xew n THR 9 Ca 0.02 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 2xew n THR 9 Cb 0.02 0.73 0.00 0.00 -1.82 0.00 0.00 70.33 69.26 2xew n THR 9 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2xew n GLY 10 N 1.47 2.67 3.57 3.41 0.00 0.77 -5.05 105.19 112.03 2xew n GLY 10 Ca 0.03 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.57 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 -1.72 1.13 -4.94 1.61 5.02 -1.26 -4.67 118.16 113.32 2xew n LYS 11 Ca 0.00 0.40 -0.29 0.00 -2.02 0.00 0.00 58.31 56.41 2xew n LYS 11 Cb 0.00 -1.86 -0.17 0.00 -0.02 0.00 0.00 35.03 32.98 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 -0.36 1.64 -0.14 -0.18 2.01 -1.26 -1.17 115.64 116.18 2xew s THR 12 Ca 0.71 -0.78 -0.02 0.00 0.31 0.00 0.00 61.69 61.90 2xew s THR 12 Cb -0.84 -1.44 -0.02 0.00 0.01 0.00 0.00 72.50 70.21 2xew s THR 12 CO 0.54 0.47 -0.06 -0.63 -0.69 0.00 0.00 174.62 174.24 2xew s ILE 13 N 0.41 3.66 -0.26 1.82 1.01 0.12 -4.96 121.20 123.01 2xew s ILE 13 Ca -0.15 -0.45 -0.12 0.00 0.00 0.00 0.00 60.65 59.93 2xew s ILE 13 Cb -0.16 -2.58 -0.05 0.00 0.01 0.00 0.00 42.46 39.68 2xew s ILE 13 CO 0.06 0.51 0.23 -0.89 0.00 0.00 0.00 174.94 174.85 2xew s THR 14 N 0.25 5.29 0.06 2.92 2.01 -1.26 -1.28 115.64 123.62 2xew s THR 14 Ca -0.05 0.29 0.08 0.00 0.31 0.00 0.00 61.69 62.33 2xew s THR 14 Cb -0.14 -3.57 -0.03 0.00 0.01 0.00 0.00 72.50 68.77 2xew s THR 14 CO 0.04 0.27 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.27 2xew s LEU 15 N 1.52 2.49 -0.20 4.42 1.02 -0.49 -5.02 118.68 122.42 2xew s LEU 15 Ca 0.10 -0.50 -0.05 0.00 0.02 0.00 0.00 54.13 53.69 2xew s LEU 15 Cb -0.15 -1.44 -0.02 0.00 0.02 0.00 0.00 46.19 44.59 2xew s LEU 15 CO 0.08 0.24 -0.00 -1.83 0.02 0.00 0.00 176.35 174.86 2xew s GLU 16 N -1.51 3.59 0.25 1.70 -1.05 -1.26 -1.67 118.70 118.75 2xew s GLU 16 Ca 0.14 -0.53 0.02 0.00 -0.15 0.00 0.00 54.97 54.45 2xew s GLU 16 Cb -0.10 -3.08 -0.04 0.00 -0.44 0.00 0.00 34.13 30.47 2xew s GLU 16 CO 0.05 -0.02 0.18 0.14 0.95 0.00 0.00 175.26 176.57 2xew s VAL 17 N 1.07 0.00 0.16 1.83 -7.23 -0.07 -4.94 120.40 111.22 2xew s VAL 17 Ca 0.02 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.27 2xew s VAL 17 Cb -0.14 -2.50 -0.04 0.00 0.56 0.00 0.00 36.38 34.25 2xew s VAL 17 CO 0.01 0.00 -0.09 -1.61 -0.31 0.00 0.00 175.10 173.10 2xew s GLU 18 N -3.91 2.08 0.61 4.82 2.02 -1.26 0.53 118.70 123.59 2xew s GLU 18 Ca 0.40 -1.19 0.31 0.00 0.02 0.00 0.00 54.97 54.51 2xew s GLU 18 Cb 0.05 -2.21 1.71 0.00 0.10 0.00 0.00 34.13 33.78 2xew s GLU 18 CO 0.18 0.46 2.06 -1.35 0.02 0.00 0.00 175.26 176.63 2xew h PRO 19 N 3.13 0.00 -0.02 0.39 0.11 -1.97 -1.17 132.00 132.47 2xew h PRO 19 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2xew h PRO 19 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2xew h PRO 19 CO 0.53 0.00 -0.03 -1.13 -0.21 0.00 0.00 178.00 177.16 2xew n SER 20 N -3.52 1.81 -4.76 -2.05 3.41 -1.26 -1.93 113.62 105.32 2xew n SER 20 Ca 0.01 -1.57 -0.41 0.00 -0.26 0.00 0.00 58.87 56.65 2xew n SER 20 Cb 0.36 0.02 -0.02 0.00 -0.26 0.00 0.00 64.21 64.32 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 6.55 0.73 4.04 1.01 -0.44 -4.77 116.67 121.74 2xew s ASP 21 Ca 0.34 2.82 -0.11 0.00 0.71 0.00 0.00 52.55 56.31 2xew s ASP 21 Cb 0.21 -2.64 0.03 0.00 1.01 0.00 0.00 42.92 41.52 2xew s ASP 21 CO 0.35 -0.75 1.09 0.42 0.21 0.00 0.00 175.17 176.49 2xew s THR 22 N -0.47 3.43 0.48 -1.27 -4.23 -1.26 -1.16 115.64 111.17 2xew s THR 22 Ca 0.57 0.46 0.16 0.00 -1.18 0.00 0.00 61.69 61.70 2xew s THR 22 Cb -0.44 -3.37 0.31 0.00 1.34 0.00 0.00 72.50 70.35 2xew s THR 22 CO 0.50 -0.60 2.06 0.40 -0.54 0.00 0.00 174.62 176.44 2xew h ILE 23 N -0.78 0.93 -0.38 2.99 1.08 -0.25 -1.84 117.51 119.25 2xew h ILE 23 Ca -0.45 -0.06 -0.05 0.00 -0.39 0.00 0.00 64.86 63.90 2xew h ILE 23 Cb 1.25 0.72 -0.01 0.00 -3.07 0.00 0.00 36.82 35.71 2xew h ILE 23 CO 0.62 0.03 0.03 -0.08 -0.69 0.00 0.00 178.15 178.07 2xew h GLU 24 N 0.19 0.66 -0.73 2.37 4.57 -1.64 -1.73 114.58 118.27 2xew h GLU 24 Ca 0.15 -0.19 0.06 0.00 -1.18 0.00 0.00 59.36 58.20 2xew h GLU 24 Cb 0.36 -0.07 -0.05 0.00 -0.16 0.00 0.00 28.75 28.84 2xew h GLU 24 CO -0.02 0.73 0.48 -0.91 -1.18 0.00 0.00 179.01 178.11 2xew h ASN 25 N 0.49 0.69 -0.30 1.04 2.35 -1.64 0.20 115.58 118.40 2xew h ASN 25 Ca 0.11 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.78 2xew h ASN 25 Cb 0.42 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.63 2xew h ASN 25 CO 0.01 0.45 -0.16 0.58 -1.65 0.00 0.00 177.43 176.66 2xew h VAL 26 N 0.78 1.29 -0.52 2.81 2.07 -1.17 -1.07 116.25 120.45 2xew h VAL 26 Ca 0.31 -1.26 -0.05 0.00 0.82 0.00 0.00 66.70 66.52 2xew h VAL 26 Cb 0.24 1.46 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 2xew h VAL 26 CO -0.10 0.40 0.12 0.11 0.02 0.00 0.00 177.57 178.12 2xew h LYS 27 N 0.40 0.80 -0.74 1.57 1.57 -0.59 -0.10 116.57 119.47 2xew h LYS 27 Ca 0.07 -0.16 -0.03 0.00 -1.87 0.00 0.00 60.65 58.65 2xew h LYS 27 Cb 0.68 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.84 2xew h LYS 27 CO 0.05 0.72 0.33 0.00 -0.57 0.00 0.00 179.45 179.98 2xew h ALA 28 N 1.36 1.18 -0.40 3.86 0.00 -0.39 -0.19 119.26 124.68 2xew h ALA 28 Ca 0.17 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 2xew h ALA 28 Cb 0.29 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2xew h ALA 28 CO -0.00 0.61 -0.24 0.87 0.00 0.00 0.00 179.25 180.49 2xew h LYS 29 N 1.06 0.82 -0.47 0.00 1.57 -0.40 -1.77 116.57 117.39 2xew h LYS 29 Ca 0.25 -0.35 -0.08 0.00 -1.87 0.00 0.00 60.65 58.60 2xew h LYS 29 Cb 0.15 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 2xew h LYS 29 CO -0.03 0.98 -0.04 0.82 -0.57 0.00 0.00 179.45 180.61 2xew h ILE 30 N 0.71 1.25 -0.73 1.86 2.04 -0.47 -1.49 117.51 120.68 2xew h ILE 30 Ca 0.09 -1.06 -0.02 0.00 1.00 0.00 0.00 64.86 64.87 2xew h ILE 30 Cb 0.77 0.93 -0.03 0.00 -0.74 0.00 0.00 36.82 37.75 2xew h ILE 30 CO 0.06 0.37 0.40 -0.61 0.00 0.00 0.00 178.15 178.37 2xew h GLN 31 N 0.74 1.02 -0.76 2.37 4.15 -0.85 0.14 115.11 121.91 2xew h GLN 31 Ca 0.14 -0.12 0.09 0.00 0.77 0.00 0.00 58.65 59.52 2xew h GLN 31 Cb 0.50 -0.20 -0.07 0.00 0.21 0.00 0.00 27.48 27.93 2xew h GLN 31 CO 0.03 0.76 0.41 -0.44 -1.93 0.00 0.00 178.83 177.66 2xew h ASP 32 N 1.01 0.58 1.01 -0.69 3.32 -0.66 0.25 116.42 121.23 2xew h ASP 32 Ca 0.26 0.05 -0.06 0.00 0.02 0.00 0.00 57.03 57.29 2xew h ASP 32 Cb 0.04 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 2xew h ASP 32 CO -0.04 0.34 -1.03 0.11 -1.72 0.00 0.00 179.24 176.90 2xew h LYS 33 N 0.71 0.00 0.00 3.56 1.57 -0.90 -3.42 116.57 118.09 2xew h LYS 33 Ca 0.36 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.14 2xew h LYS 33 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.64 2xew h LYS 33 CO -0.24 0.13 -0.50 0.39 -0.57 0.00 0.00 179.45 178.66 2xew n GLU 34 N -2.82 2.75 -0.65 3.15 -0.58 0.44 -5.03 120.64 117.90 2xew n GLU 34 Ca -0.03 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.71 2xew n GLU 34 Cb 0.66 -0.75 0.00 0.00 -0.57 0.00 0.00 31.44 30.78 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 1.38 0.75 3.64 0.62 0.00 0.85 -5.00 105.19 107.43 2xew n GLY 35 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2xew n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2xew s ILE 36 N -2.66 4.71 0.50 -0.61 1.01 -1.26 -4.97 121.20 117.93 2xew s ILE 36 Ca 0.00 1.69 -0.23 0.00 0.00 0.00 0.00 60.65 62.11 2xew s ILE 36 Cb 0.00 -4.25 -0.06 0.00 0.01 0.00 0.00 42.46 38.16 2xew s ILE 36 CO 0.00 -0.23 1.34 -2.84 0.00 0.00 0.00 174.94 173.21 2xew s PRO 37 N 3.15 3.40 0.24 2.79 0.02 -1.26 -3.72 135.00 139.62 2xew s PRO 37 Ca 0.40 2.20 -0.05 0.00 0.02 0.00 0.00 61.00 63.56 2xew s PRO 37 Cb -0.14 -2.40 0.44 0.00 0.02 0.00 0.00 34.50 32.42 2xew s PRO 37 CO 0.09 -0.97 1.70 -1.35 -0.33 0.00 0.00 177.00 176.15 2xew h PRO 38 N 1.82 0.32 -0.31 5.54 0.11 -1.95 -0.94 132.00 136.58 2xew h PRO 38 Ca -0.51 -0.02 0.09 0.00 0.11 0.00 0.00 66.00 65.68 2xew h PRO 38 Cb 1.28 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 2xew h PRO 38 CO 0.59 0.21 0.28 0.38 -0.21 0.00 0.00 178.00 179.25 2xew h ASP 39 N 0.33 0.00 0.02 -2.05 2.03 -1.98 0.85 116.42 115.62 2xew h ASP 39 Ca 0.40 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.70 2xew h ASP 39 Cb 0.65 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.15 2xew h ASP 39 CO -0.46 0.00 -0.02 0.00 -1.03 0.00 0.00 179.24 177.74 2xew n GLN 40 N -4.04 1.39 -4.30 4.15 6.02 -0.36 -4.68 117.38 115.57 2xew n GLN 40 Ca 0.05 -0.64 -0.34 0.00 -0.01 0.00 0.00 57.00 56.06 2xew n GLN 40 Cb 0.44 -1.49 -0.11 0.00 1.02 0.00 0.00 30.24 30.10 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 -2.05 3.63 -0.11 -1.09 -0.21 0.29 -0.82 119.66 119.31 2xew s GLN 41 Ca 0.40 -0.46 0.03 0.00 0.02 0.00 0.00 55.36 55.35 2xew s GLN 41 Cb 0.21 -2.97 -0.01 0.00 1.00 0.00 0.00 33.01 31.25 2xew s GLN 41 CO 0.36 0.33 -0.20 0.50 -2.12 0.00 0.00 175.29 174.16 2xew s ARG 42 N 0.14 3.11 -0.07 2.91 3.52 0.38 -4.81 118.95 124.13 2xew s ARG 42 Ca 0.01 -0.81 0.01 0.00 -0.13 0.00 0.00 55.73 54.80 2xew s ARG 42 Cb -0.13 -2.40 -0.03 0.00 -1.56 0.00 0.00 34.95 30.83 2xew s ARG 42 CO 0.02 0.22 -0.09 -0.51 -0.81 0.00 0.00 175.30 174.13 2xew s LEU 43 N 0.28 3.06 -0.02 -0.88 1.43 -1.26 -0.44 118.68 120.84 2xew s LEU 43 Ca -0.14 -0.07 0.03 0.00 -1.03 0.00 0.00 54.13 52.91 2xew s LEU 43 Cb -0.17 -1.66 -0.00 0.00 0.03 0.00 0.00 46.19 44.39 2xew s LEU 43 CO 0.07 0.35 -0.11 -0.63 0.23 0.00 0.00 176.35 176.26 2xew s ILE 44 N -0.72 0.95 -0.06 -0.59 1.01 0.25 -0.34 121.20 121.70 2xew s ILE 44 Ca 0.11 -0.47 0.01 0.00 0.00 0.00 0.00 60.65 60.29 2xew s ILE 44 Cb -0.11 -0.83 0.02 0.00 0.01 0.00 0.00 42.46 41.55 2xew s ILE 44 CO 0.01 0.28 -0.06 0.12 0.00 0.00 0.00 174.94 175.30 2xew s PHE 45 N 0.04 0.98 -1.26 3.97 5.36 -0.32 -1.12 117.98 125.63 2xew s PHE 45 Ca -0.01 -0.35 -0.06 0.00 -0.96 0.00 0.00 56.93 55.55 2xew s PHE 45 Cb -0.08 -0.86 -0.01 0.00 -0.34 0.00 0.00 43.02 41.73 2xew s PHE 45 CO 0.01 -0.29 0.68 0.00 -1.46 0.00 0.00 175.22 174.16 2xew n ALA 46 N 4.36 -2.20 0.00 11.12 0.00 -1.26 -1.56 120.51 130.97 2xew n ALA 46 Ca -0.19 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.06 2xew n ALA 46 Cb 0.51 -2.73 0.00 0.00 0.00 0.00 0.00 19.45 17.23 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 -1.66 1.51 3.76 0.00 0.00 -1.26 -4.96 105.19 102.58 2xew n GLY 47 Ca -0.23 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.43 2xew n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2xew s LYS 48 N 0.00 4.07 0.32 1.61 3.01 -0.60 -5.07 119.74 123.07 2xew s LYS 48 Ca 0.00 -0.03 -0.29 0.00 -1.01 0.00 0.00 55.97 54.64 2xew s LYS 48 Cb 0.00 -3.37 -0.10 0.00 -1.01 0.00 0.00 37.83 33.35 2xew s LYS 48 CO 0.00 0.39 1.27 -0.65 0.51 0.00 0.00 175.35 176.86 2xew s GLN 49 N 0.06 4.41 -0.19 1.68 -0.21 -1.26 -1.17 119.66 122.98 2xew s GLN 49 Ca 0.14 2.13 -0.09 0.00 0.02 0.00 0.00 55.36 57.56 2xew s GLN 49 Cb -0.12 -3.10 -0.05 0.00 1.00 0.00 0.00 33.01 30.74 2xew s GLN 49 CO 0.03 -0.11 0.13 -0.51 -2.12 0.00 0.00 175.29 172.70 2xew s LEU 50 N -1.64 4.24 0.01 2.90 1.43 0.54 -4.92 118.68 121.23 2xew s LEU 50 Ca 0.48 0.27 -0.22 0.00 -1.03 0.00 0.00 54.13 53.64 2xew s LEU 50 Cb -0.38 -2.09 -0.05 0.00 0.03 0.00 0.00 46.19 43.70 2xew s LEU 50 CO 0.50 0.22 0.64 -1.61 0.23 0.00 0.00 176.35 176.33 2xew s GLU 51 N 0.12 4.37 0.26 1.70 2.02 -1.26 -4.65 118.70 121.25 2xew s GLU 51 Ca 0.09 0.83 -0.10 0.00 0.02 0.00 0.00 54.97 55.81 2xew s GLU 51 Cb -0.11 -3.35 0.38 0.00 0.10 0.00 0.00 34.13 31.15 2xew s GLU 51 CO -0.01 0.33 1.58 -0.44 0.02 0.00 0.00 175.26 176.74 2xew h ASP 52 N 5.69 -0.89 0.99 -0.19 3.45 -1.97 -1.60 116.42 121.89 2xew h ASP 52 Ca -0.45 0.27 0.00 0.00 0.43 0.00 0.00 57.03 57.29 2xew h ASP 52 Cb 1.20 0.58 0.00 0.00 -0.56 0.00 0.00 39.33 40.55 2xew h ASP 52 CO 0.70 -0.30 0.00 0.61 -1.57 0.00 0.00 179.24 178.68 2xew n GLY 53 N -1.57 -1.44 3.90 2.75 0.00 -1.26 -1.90 105.19 105.67 2xew n GLY 53 Ca 0.13 -0.07 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 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 -3.03 3.43 0.33 1.61 1.81 -0.60 -4.84 118.95 117.65 2xew s ARG 54 Ca 0.12 0.36 0.07 0.00 -1.72 0.00 0.00 55.73 54.56 2xew s ARG 54 Cb 0.16 -2.24 -0.02 0.00 -0.45 0.00 0.00 34.95 32.39 2xew s ARG 54 CO 0.49 -0.44 0.34 0.95 -0.68 0.00 0.00 175.30 175.96 2xew s THR 55 N -2.96 3.76 0.20 0.02 -4.23 -1.26 -0.14 115.64 111.04 2xew s THR 55 Ca 0.51 -1.25 -0.10 0.00 -1.18 0.00 0.00 61.69 59.67 2xew s THR 55 Cb -0.11 -3.28 0.13 0.00 1.34 0.00 0.00 72.50 70.59 2xew s THR 55 CO 0.48 -0.18 1.81 -0.07 -0.54 0.00 0.00 174.62 176.12 2xew h LEU 56 N 1.15 0.54 -0.88 4.79 3.38 -1.16 -2.31 115.31 120.81 2xew h LEU 56 Ca -0.45 0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.44 2xew h LEU 56 Cb 1.25 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.91 2xew h LEU 56 CO 0.57 0.35 -0.24 0.77 0.09 0.00 0.00 178.44 179.99 2xew h SER 57 N 0.67 0.56 -0.43 -0.43 4.64 -1.60 -1.32 113.55 115.64 2xew h SER 57 Ca 0.28 -0.19 0.12 0.00 -0.47 0.00 0.00 61.79 61.53 2xew h SER 57 Cb 0.15 -0.15 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 2xew h SER 57 CO -0.16 0.79 0.46 0.44 -0.87 0.00 0.00 176.83 177.48 2xew h ASP 58 N 0.49 0.00 -0.45 4.97 3.45 -1.71 0.13 116.42 123.31 2xew h ASP 58 Ca 0.07 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.53 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 -3.72 0.60 -3.50 4.55 4.02 -0.72 -4.95 117.16 113.43 2xew n TYR 59 Ca 0.08 -0.43 -0.25 0.00 -0.01 0.00 0.00 57.90 57.29 2xew n TYR 59 Cb 0.64 -0.01 0.06 0.00 -0.02 0.00 0.00 39.34 40.00 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 1.01 -6.02 -4.69 7.72 3.02 0.46 -4.97 115.26 111.80 2xew n ASN 60 Ca 0.16 -0.51 -0.40 0.00 -0.03 0.00 0.00 54.58 53.80 2xew n ASN 60 Cb 0.50 -4.78 -0.05 0.00 -0.61 0.00 0.00 39.78 34.84 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 -3.27 5.00 0.43 2.41 1.01 -0.58 -5.02 121.20 121.19 2xew s ILE 61 Ca 0.53 1.40 0.01 0.00 0.00 0.00 0.00 60.65 62.59 2xew s ILE 61 Cb -0.24 -4.03 -0.01 0.00 0.01 0.00 0.00 42.46 38.20 2xew s ILE 61 CO 0.65 0.16 0.05 0.00 0.00 0.00 0.00 174.94 175.80 2xew n GLN 62 N 4.52 0.77 -1.66 2.79 1.13 -1.26 -4.44 117.38 119.23 2xew n GLN 62 Ca -0.00 -3.30 -0.46 0.00 -1.94 0.00 0.00 57.00 51.30 2xew n GLN 62 Cb 0.50 1.22 -0.03 0.00 0.11 0.00 0.00 30.24 32.04 2xew n GLN 62 CO 0.00 0.00 0.00 0.36 -1.44 0.00 0.00 177.06 175.98 2xew n LYS 63 N -1.04 1.95 -0.98 -1.09 2.85 -1.26 -1.72 118.16 116.87 2xew n LYS 63 Ca -0.14 0.70 0.00 0.00 -1.05 0.00 0.00 58.31 57.82 2xew n LYS 63 Cb 0.58 -2.37 0.00 0.00 -0.65 0.00 0.00 35.03 32.59 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 2.41 -0.08 -1.51 -1.58 4.71 0.41 -4.98 120.64 120.02 2xew n GLU 64 Ca 0.14 0.02 -0.34 0.00 -0.01 0.00 0.00 57.16 56.97 2xew n GLU 64 Cb 0.29 -2.91 0.08 0.00 -1.01 0.00 0.00 31.44 27.89 2xew n GLU 64 CO 0.00 0.00 0.00 -1.12 0.09 0.00 0.00 177.13 176.10 2xew s SER 65 N -2.45 4.47 -0.20 1.62 0.01 -0.70 -4.72 113.70 111.74 2xew s SER 65 Ca 0.00 2.20 -0.02 0.00 1.31 0.00 0.00 55.95 59.44 2xew s SER 65 Cb 0.00 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.66 2xew s SER 65 CO 0.00 -2.07 -0.11 -0.89 0.41 0.00 0.00 173.24 170.58 2xew s THR 66 N -2.18 2.78 0.31 1.44 2.01 -1.26 -1.26 115.64 117.49 2xew s THR 66 Ca 0.71 -0.69 0.03 0.00 0.31 0.00 0.00 61.69 62.04 2xew s THR 66 Cb -0.25 -2.23 -0.03 0.00 0.01 0.00 0.00 72.50 70.00 2xew s THR 66 CO 0.45 0.48 0.47 -0.76 -0.69 0.00 0.00 174.62 174.56 2xew s LEU 67 N 1.36 4.12 -0.08 4.42 1.43 0.14 -4.79 118.68 125.28 2xew s LEU 67 Ca 0.05 0.21 0.05 0.00 -1.03 0.00 0.00 54.13 53.41 2xew s LEU 67 Cb -0.14 -3.05 -0.01 0.00 0.03 0.00 0.00 46.19 43.02 2xew s LEU 67 CO -0.07 -0.24 -0.24 -1.00 0.23 0.00 0.00 176.35 175.03 2xew s HIS 68 N -2.17 2.48 -0.18 0.29 3.76 -0.28 -0.75 115.29 118.45 2xew s HIS 68 Ca 0.38 -0.88 -0.06 0.00 -0.15 0.00 0.00 55.06 54.35 2xew s HIS 68 Cb -0.09 -1.64 -0.04 0.00 1.11 0.00 0.00 32.58 31.92 2xew s HIS 68 CO 0.33 -0.31 0.03 -1.17 -0.85 0.00 0.00 174.74 172.76 2xew s LEU 69 N 0.08 3.59 0.04 0.89 2.96 0.21 -0.58 118.68 125.87 2xew s LEU 69 Ca -0.11 -0.01 0.04 0.00 -0.22 0.00 0.00 54.13 53.83 2xew s LEU 69 Cb -0.16 -1.90 -0.02 0.00 0.50 0.00 0.00 46.19 44.61 2xew s LEU 69 CO 0.06 0.16 -0.13 0.68 -1.32 0.00 0.00 176.35 175.80 2xew s VAL 70 N 0.45 0.98 0.46 1.68 -7.23 0.42 -4.08 120.40 113.09 2xew s VAL 70 Ca 0.01 -0.96 -0.25 0.00 -1.81 0.00 0.00 61.98 58.96 2xew s VAL 70 Cb -0.13 -0.91 -0.08 0.00 0.56 0.00 0.00 36.38 35.82 2xew s VAL 70 CO 0.01 -0.05 1.44 -0.76 -0.31 0.00 0.00 175.10 175.43 2xew s LEU 71 N -1.14 4.08 -0.25 1.32 2.01 -1.26 -0.47 118.68 122.97 2xew s LEU 71 Ca -0.00 2.94 -0.04 0.00 0.01 0.00 0.00 54.13 57.04 2xew s LEU 71 Cb -0.08 -3.97 0.00 0.00 0.01 0.00 0.00 46.19 42.16 2xew s LEU 71 CO 0.01 -1.25 -0.02 -0.60 1.01 0.00 0.00 176.35 175.50 2xew s ARG 72 N -2.52 3.18 0.57 1.70 3.52 -0.00 -4.72 118.95 120.68 2xew s ARG 72 Ca 0.62 -0.76 -0.04 0.00 -0.13 0.00 0.00 55.73 55.42 2xew s ARG 72 Cb -0.44 -3.10 0.02 0.00 -1.56 0.00 0.00 34.95 29.87 2xew s ARG 72 CO 0.56 -0.31 0.85 -0.51 -0.81 0.00 0.00 175.30 175.09 2xew s LEU 73 N 1.45 3.28 0.07 -0.88 1.43 -1.26 -4.66 118.68 118.10 2xew s LEU 73 Ca 0.04 0.50 -0.30 0.00 -1.03 0.00 0.00 54.13 53.34 2xew s LEU 73 Cb -0.16 -3.32 -0.05 0.00 0.03 0.00 0.00 46.19 42.69 2xew s LEU 73 CO -0.02 -1.06 1.11 -0.13 0.23 0.00 0.00 176.35 176.47 2xew s ARG 74 N -4.90 4.52 0.00 1.70 1.81 -1.26 -5.01 118.95 115.80 2xew s ARG 74 Ca 0.54 1.65 0.00 0.00 -1.72 0.00 0.00 55.73 56.19 2xew s ARG 74 Cb -0.10 -3.36 0.00 0.00 -0.45 0.00 0.00 34.95 31.03 2xew s ARG 74 CO 0.43 -0.11 0.00 0.41 -0.68 0.00 0.00 175.30 175.35 2xew n GLY 75 N 2.83 1.99 0.00 -3.53 0.00 -1.26 -5.33 105.19 99.89 2xew n GLY 75 Ca 0.06 -0.01 0.05 0.00 0.00 0.00 0.00 46.02 46.13 2xew n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93