#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ud7 s GLN 2 N 0.00 4.05 0.34 3.17 0.74 -1.26 -0.63 119.66 126.07 1ud7 s GLN 2 Ca 0.00 -0.20 0.08 0.00 0.05 0.00 0.00 55.36 55.29 1ud7 s GLN 2 Cb 0.00 -3.58 -0.04 0.00 1.10 0.00 0.00 33.01 30.50 1ud7 s GLN 2 CO 0.00 -0.03 0.18 0.14 -0.55 0.00 0.00 175.29 175.03 1ud7 s VAL 3 N 1.33 3.11 -0.13 1.34 -7.23 0.11 -2.43 120.40 116.50 1ud7 s VAL 3 Ca 0.09 -1.62 0.03 0.00 -1.81 0.00 0.00 61.98 58.67 1ud7 s VAL 3 Cb -0.14 -3.02 0.00 0.00 0.56 0.00 0.00 36.38 33.78 1ud7 s VAL 3 CO 0.07 -0.17 -0.22 -0.36 -0.31 0.00 0.00 175.10 174.11 1ud7 s PHE 4 N -2.40 2.65 -0.04 2.82 0.08 -0.49 -1.72 117.98 118.87 1ud7 s PHE 4 Ca 0.39 -1.20 0.06 0.00 0.12 0.00 0.00 56.93 56.29 1ud7 s PHE 4 Cb -0.03 -1.79 -0.02 0.00 -0.57 0.00 0.00 43.02 40.61 1ud7 s PHE 4 CO 0.24 -0.53 -0.22 -1.17 -0.10 0.00 0.00 175.22 173.44 1ud7 s LEU 5 N 0.65 2.29 -0.01 -0.37 2.96 -0.82 -0.79 118.68 122.58 1ud7 s LEU 5 Ca -0.11 -0.39 0.02 0.00 -0.22 0.00 0.00 54.13 53.43 1ud7 s LEU 5 Cb -0.16 -1.42 -0.03 0.00 0.50 0.00 0.00 46.19 45.07 1ud7 s LEU 5 CO 0.02 0.30 -0.05 -0.54 -1.32 0.00 0.00 176.35 174.76 1ud7 s LYS 6 N -0.48 2.64 0.40 1.98 1.02 -0.80 -1.24 119.74 123.26 1ud7 s LYS 6 Ca 0.06 -0.66 0.06 0.00 0.02 0.00 0.00 55.97 55.45 1ud7 s LYS 6 Cb -0.11 -2.56 0.07 0.00 -0.52 0.00 0.00 37.83 34.71 1ud7 s LYS 6 CO 0.01 0.62 0.55 0.25 -0.92 0.00 0.00 175.35 175.86 1ud7 n THR 7 N 1.65 0.00 0.60 2.17 -2.24 -1.20 -1.71 114.28 113.55 1ud7 n THR 7 Ca -0.16 -1.30 0.08 0.00 -2.27 0.00 0.00 64.05 60.40 1ud7 n THR 7 Cb 0.53 -0.68 0.36 0.00 -2.10 0.00 0.00 70.33 68.44 1ud7 n THR 7 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1ud7 n LEU 8 N 0.00 0.00 -0.05 3.22 4.77 -1.26 -2.45 117.00 121.23 1ud7 n LEU 8 Ca 0.11 0.48 0.02 0.00 -0.03 0.00 0.00 56.01 56.59 1ud7 n LEU 8 Cb 0.41 -0.48 -0.16 0.00 -2.33 0.00 0.00 43.42 40.85 1ud7 n LEU 8 CO 0.26 -0.20 -0.93 0.35 -1.33 0.00 0.00 177.39 175.53 1ud7 n THR 9 N -1.48 0.61 0.00 -5.08 -2.24 -1.26 -5.03 114.28 99.80 1ud7 n THR 9 Ca 0.04 -0.65 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 1ud7 n THR 9 Cb 0.19 -0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.21 1ud7 n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ud7 n GLY 10 N 1.50 3.33 0.00 3.38 0.00 -1.02 -5.09 105.19 107.29 1ud7 n GLY 10 Ca -0.17 -0.88 -0.00 0.00 0.00 0.00 0.00 46.02 44.98 1ud7 n GLY 10 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1ud7 n LYS 11 N 0.00 0.00 -3.94 1.61 4.81 -1.26 -4.10 118.16 115.28 1ud7 n LYS 11 Ca 0.00 0.00 -0.35 0.00 -0.87 0.00 0.00 58.31 57.09 1ud7 n LYS 11 Cb 0.00 -0.00 -0.11 0.00 0.02 0.00 0.00 35.03 34.94 1ud7 n LYS 11 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1ud7 s THR 12 N -0.00 4.52 0.10 3.15 2.01 -1.26 -3.24 115.64 120.92 1ud7 s THR 12 Ca 0.00 -0.12 0.05 0.00 0.31 0.00 0.00 61.69 61.93 1ud7 s THR 12 Cb -0.00 -3.07 -0.04 0.00 0.01 0.00 0.00 72.50 69.40 1ud7 s THR 12 CO 0.00 0.41 0.02 0.68 -0.69 0.00 0.00 174.62 175.04 1ud7 s VAL 13 N 0.93 4.11 -0.39 3.82 -7.23 -0.37 -4.96 120.40 116.31 1ud7 s VAL 13 Ca 0.04 -1.00 -0.01 0.00 -1.81 0.00 0.00 61.98 59.19 1ud7 s VAL 13 Cb -0.14 -2.98 0.11 0.00 0.56 0.00 0.00 36.38 33.93 1ud7 s VAL 13 CO 0.03 0.08 0.17 0.42 -0.31 0.00 0.00 175.10 175.49 1ud7 s THR 14 N -1.39 3.06 -0.01 5.32 -4.23 -1.26 -1.94 115.64 115.19 1ud7 s THR 14 Ca 0.27 -2.13 0.00 0.00 -1.18 0.00 0.00 61.69 58.66 1ud7 s THR 14 Cb -0.11 -3.13 -0.04 0.00 1.34 0.00 0.00 72.50 70.56 1ud7 s THR 14 CO 0.19 -0.67 0.03 -0.63 -0.54 0.00 0.00 174.62 173.00 1ud7 s ILE 15 N 1.08 4.35 -0.19 2.99 1.01 -0.70 -4.93 121.20 124.81 1ud7 s ILE 15 Ca 0.09 -0.50 -0.08 0.00 0.00 0.00 0.00 60.65 60.16 1ud7 s ILE 15 Cb -0.22 -2.94 -0.04 0.00 0.01 0.00 0.00 42.46 39.27 1ud7 s ILE 15 CO -0.05 0.40 0.07 -1.61 0.00 0.00 0.00 174.94 173.74 1ud7 s GLU 16 N -1.53 3.98 0.22 2.79 0.41 -1.26 0.04 118.70 123.34 1ud7 s GLU 16 Ca 0.20 -0.34 -0.02 0.00 -0.41 0.00 0.00 54.97 54.40 1ud7 s GLU 16 Cb -0.12 -3.24 -0.03 0.00 -1.78 0.00 0.00 34.13 28.96 1ud7 s GLU 16 CO 0.10 0.25 0.19 0.14 -0.49 0.00 0.00 175.26 175.45 1ud7 s VAL 17 N 0.45 0.00 0.00 2.63 -7.23 0.20 -4.95 120.40 111.50 1ud7 s VAL 17 Ca 0.04 -1.92 0.02 0.00 -1.81 0.00 0.00 61.98 58.30 1ud7 s VAL 17 Cb -0.12 -2.47 -0.01 0.00 0.56 0.00 0.00 36.38 34.34 1ud7 s VAL 17 CO 0.00 0.00 -0.07 -1.61 -0.31 0.00 0.00 175.10 173.12 1ud7 s GLU 18 N -4.04 0.53 -0.80 4.82 2.02 -1.26 0.11 118.70 120.07 1ud7 s GLU 18 Ca 0.37 -0.30 -0.23 0.00 0.02 0.00 0.00 54.97 54.83 1ud7 s GLU 18 Cb 0.05 -0.49 -0.17 0.00 0.10 0.00 0.00 34.13 33.62 1ud7 s GLU 18 CO 0.13 0.13 2.38 -0.35 0.02 0.00 0.00 175.26 177.58 1ud7 n PRO 19 N 2.74 0.50 0.00 0.39 -0.04 -1.26 -1.62 135.00 135.71 1ud7 n PRO 19 Ca -0.14 -0.61 0.00 0.00 -0.04 0.00 0.00 63.50 62.71 1ud7 n PRO 19 Cb 0.57 -3.17 0.00 0.00 -0.04 0.00 0.00 33.50 30.86 1ud7 n PRO 19 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1ud7 n SER 20 N 16.08 0.00 -4.79 3.54 3.41 -1.26 -4.84 113.62 125.76 1ud7 n SER 20 Ca 0.50 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.80 1ud7 n SER 20 Cb 0.38 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.39 1ud7 n SER 20 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1ud7 s ASP 21 N 0.00 5.06 0.01 4.04 1.01 -0.64 -4.80 116.67 121.34 1ud7 s ASP 21 Ca 0.00 1.77 -0.15 0.00 0.71 0.00 0.00 52.55 54.89 1ud7 s ASP 21 Cb 0.00 -2.52 -0.06 0.00 1.01 0.00 0.00 42.92 41.36 1ud7 s ASP 21 CO 0.00 -1.66 0.41 0.42 0.21 0.00 0.00 175.17 174.55 1ud7 s THR 22 N -2.83 5.02 0.34 -1.27 -4.23 -1.26 -1.75 115.64 109.67 1ud7 s THR 22 Ca 0.61 0.83 0.14 0.00 -1.18 0.00 0.00 61.69 62.09 1ud7 s THR 22 Cb -0.16 -3.71 0.34 0.00 1.34 0.00 0.00 72.50 70.30 1ud7 s THR 22 CO 0.51 0.56 1.63 0.58 -0.54 0.00 0.00 174.62 177.37 1ud7 h VAL 23 N 3.66 0.19 0.41 2.29 2.07 -1.54 0.87 116.25 124.19 1ud7 h VAL 23 Ca -0.51 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 66.93 1ud7 h VAL 23 Cb 1.22 -0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 1ud7 h VAL 23 CO 0.62 0.03 -0.36 -0.08 0.02 0.00 0.00 177.57 177.80 1ud7 h GLU 24 N 0.19 -0.75 -0.83 1.57 4.22 -1.81 -2.13 114.58 115.03 1ud7 h GLU 24 Ca 0.74 0.05 0.18 0.00 0.08 0.00 0.00 59.36 60.41 1ud7 h GLU 24 Cb 1.75 0.17 -0.11 0.00 0.50 0.00 0.00 28.75 31.06 1ud7 h GLU 24 CO -0.68 -0.50 0.35 -0.91 -2.18 0.00 0.00 179.01 175.08 1ud7 h ASN 25 N -0.78 0.30 0.10 1.04 2.35 -1.24 -0.68 115.58 116.67 1ud7 h ASN 25 Ca -0.04 0.13 0.02 0.00 -0.55 0.00 0.00 56.30 55.87 1ud7 h ASN 25 Cb 0.68 0.11 -0.04 0.00 0.05 0.00 0.00 38.32 39.13 1ud7 h ASN 25 CO -0.03 0.06 -0.28 0.15 -1.65 0.00 0.00 177.43 175.68 1ud7 h PHE 26 N 0.43 -0.74 -0.04 1.19 3.57 -0.93 -0.39 116.94 120.01 1ud7 h PHE 26 Ca 0.49 0.02 0.01 0.00 3.53 0.00 0.00 57.97 62.02 1ud7 h PHE 26 Cb 0.84 0.32 -0.00 0.00 2.79 0.00 0.00 35.95 39.89 1ud7 h PHE 26 CO -0.16 -0.38 0.04 0.87 -2.23 0.00 0.00 178.31 176.46 1ud7 h LYS 27 N -0.48 0.00 -0.47 1.11 1.57 -0.59 -1.34 116.57 116.37 1ud7 h LYS 27 Ca 0.04 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.69 1ud7 h LYS 27 Cb 0.52 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 1ud7 h LYS 27 CO -0.17 0.00 -0.18 0.00 -0.57 0.00 0.00 179.45 178.53 1ud7 h ALA 28 N 1.96 0.66 -0.41 3.86 0.00 0.31 -2.02 119.26 123.62 1ud7 h ALA 28 Ca 0.02 -0.37 -0.12 0.00 0.00 0.00 0.00 54.91 54.43 1ud7 h ALA 28 Cb 0.10 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1ud7 h ALA 28 CO -0.00 0.62 -0.23 0.87 0.00 0.00 0.00 179.25 180.50 1ud7 h LYS 29 N 0.80 0.88 -0.43 0.00 1.57 -0.36 -2.97 116.57 116.07 1ud7 h LYS 29 Ca 0.11 -0.40 -0.04 0.00 -1.87 0.00 0.00 60.65 58.46 1ud7 h LYS 29 Cb 0.75 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.02 1ud7 h LYS 29 CO 0.06 1.05 0.11 0.82 -0.57 0.00 0.00 179.45 180.92 1ud7 h ILE 30 N 0.69 1.19 -0.82 1.86 2.04 -1.36 -2.51 117.51 118.59 1ud7 h ILE 30 Ca 0.09 -0.66 -0.00 0.00 1.00 0.00 0.00 64.86 65.29 1ud7 h ILE 30 Cb 0.80 0.74 -0.04 0.00 -0.74 0.00 0.00 36.82 37.59 1ud7 h ILE 30 CO 0.07 0.24 0.50 -0.61 0.00 0.00 0.00 178.15 178.35 1ud7 h GLN 31 N 0.62 1.12 0.00 2.37 -0.00 -1.21 1.14 115.11 119.15 1ud7 h GLN 31 Ca 0.14 -0.10 0.00 0.00 -0.00 0.00 0.00 58.65 58.69 1ud7 h GLN 31 Cb 0.22 -0.23 0.00 0.00 0.00 0.00 0.00 27.48 27.47 1ud7 h GLN 31 CO -0.00 0.79 0.00 -0.40 0.00 0.00 0.00 178.83 179.21 1ud7 n ASP 32 N -4.45 0.46 -0.10 -0.69 5.68 -0.96 0.26 116.55 116.76 1ud7 n ASP 32 Ca 0.08 0.61 -0.13 0.00 -0.50 0.00 0.00 54.79 54.86 1ud7 n ASP 32 Cb 0.06 -0.71 -0.10 0.00 -1.14 0.00 0.00 41.12 39.23 1ud7 n ASP 32 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1ud7 n LYS 33 N -2.01 0.64 -0.00 0.11 5.02 -0.30 -4.58 118.16 117.03 1ud7 n LYS 33 Ca 0.03 0.10 0.10 0.00 -2.02 0.00 0.00 58.31 56.52 1ud7 n LYS 33 Cb 0.21 -1.40 -0.13 0.00 -0.02 0.00 0.00 35.03 33.69 1ud7 n LYS 33 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1ud7 n GLU 34 N -3.01 0.29 -1.44 1.97 4.71 0.38 -4.98 120.64 118.56 1ud7 n GLU 34 Ca -0.34 -0.08 -0.09 0.00 -0.01 0.00 0.00 57.16 56.63 1ud7 n GLU 34 Cb 0.90 -1.51 -0.03 0.00 -1.01 0.00 0.00 31.44 29.78 1ud7 n GLU 34 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1ud7 n GLY 35 N 1.39 0.89 3.48 0.62 0.00 0.72 -5.00 105.19 107.30 1ud7 n GLY 35 Ca 0.01 -0.59 -0.33 0.00 0.00 0.00 0.00 46.02 45.10 1ud7 n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ud7 s ILE 36 N -2.37 3.37 0.64 -0.61 1.01 -1.18 -5.01 121.20 117.05 1ud7 s ILE 36 Ca 0.00 -0.58 -0.16 0.00 0.00 0.00 0.00 60.65 59.90 1ud7 s ILE 36 Cb 0.00 -2.38 -0.01 0.00 0.01 0.00 0.00 42.46 40.08 1ud7 s ILE 36 CO 0.00 0.56 1.15 -2.16 0.00 0.00 0.00 174.94 174.49 1ud7 s PRO 37 N -0.32 2.80 0.39 2.79 0.04 -1.26 -4.01 135.00 135.43 1ud7 s PRO 37 Ca 0.04 1.57 0.08 0.00 0.04 0.00 0.00 61.00 62.72 1ud7 s PRO 37 Cb -0.13 -1.93 0.81 0.00 0.04 0.00 0.00 34.50 33.29 1ud7 s PRO 37 CO 0.02 -1.28 1.97 -1.00 0.04 0.00 0.00 177.00 176.75 1ud7 h PRO 38 N 0.31 0.36 0.00 0.56 0.13 -1.94 -1.84 132.00 129.58 1ud7 h PRO 38 Ca -0.48 -0.06 -0.01 0.00 -0.87 0.00 0.00 66.00 64.58 1ud7 h PRO 38 Cb 1.27 -0.06 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 1ud7 h PRO 38 CO 0.54 0.38 -0.04 0.22 -0.23 0.00 0.00 178.00 178.87 1ud7 h ASP 39 N 0.36 0.00 -0.32 1.44 3.58 -1.97 -0.84 116.42 118.68 1ud7 h ASP 39 Ca 0.08 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.53 1ud7 h ASP 39 Cb 0.21 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.26 1ud7 h ASP 39 CO 0.00 0.04 0.00 0.00 -2.88 0.00 0.00 179.24 176.40 1ud7 n GLN 40 N -3.68 2.90 -3.87 0.28 6.02 -0.74 -4.73 117.38 113.57 1ud7 n GLN 40 Ca -0.03 -2.33 -0.37 0.00 -0.01 0.00 0.00 57.00 54.26 1ud7 n GLN 40 Cb 0.14 -1.47 -0.06 0.00 1.02 0.00 0.00 30.24 29.86 1ud7 n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1ud7 s GLN 41 N -1.65 3.47 -0.20 -1.09 -0.21 -0.32 -2.80 119.66 116.86 1ud7 s GLN 41 Ca 0.30 -0.12 -0.03 0.00 0.02 0.00 0.00 55.36 55.53 1ud7 s GLN 41 Cb 0.20 -3.20 0.06 0.00 1.00 0.00 0.00 33.01 31.08 1ud7 s GLN 41 CO 0.13 0.77 0.05 0.50 -2.12 0.00 0.00 175.29 174.62 1ud7 s ARG 42 N -1.00 0.52 -0.27 2.91 3.52 0.93 -4.69 118.95 120.86 1ud7 s ARG 42 Ca 0.15 -0.39 -0.11 0.00 -0.13 0.00 0.00 55.73 55.25 1ud7 s ARG 42 Cb -0.12 -2.02 -0.05 0.00 -1.56 0.00 0.00 34.95 31.20 1ud7 s ARG 42 CO 0.04 -0.68 0.21 -0.51 -0.81 0.00 0.00 175.30 173.55 1ud7 s LEU 43 N 1.91 4.03 -0.22 -0.88 1.43 -1.26 0.32 118.68 124.02 1ud7 s LEU 43 Ca 0.00 0.04 0.02 0.00 -1.03 0.00 0.00 54.13 53.16 1ud7 s LEU 43 Cb -0.17 -2.15 0.04 0.00 0.03 0.00 0.00 46.19 43.94 1ud7 s LEU 43 CO -0.10 -0.05 -0.15 -0.63 0.23 0.00 0.00 176.35 175.66 1ud7 s ILE 44 N 1.70 2.06 -0.04 -0.59 -1.09 -0.46 -2.17 121.20 120.61 1ud7 s ILE 44 Ca 0.08 -1.27 0.02 0.00 -2.23 0.00 0.00 60.65 57.25 1ud7 s ILE 44 Cb -0.16 -2.04 0.01 0.00 -1.58 0.00 0.00 42.46 38.70 1ud7 s ILE 44 CO 0.10 0.23 -0.09 0.12 -1.23 0.00 0.00 174.94 174.07 1ud7 s PHE 45 N 1.22 1.05 -1.47 3.97 5.36 0.18 -2.73 117.98 125.56 1ud7 s PHE 45 Ca -0.02 -0.32 -0.09 0.00 -0.96 0.00 0.00 56.93 55.54 1ud7 s PHE 45 Cb -0.17 -0.79 0.06 0.00 -0.34 0.00 0.00 43.02 41.78 1ud7 s PHE 45 CO -0.09 -0.18 0.88 0.00 -1.46 0.00 0.00 175.22 174.38 1ud7 n ALA 46 N 3.66 -1.52 -1.34 11.12 0.00 -1.26 -0.06 120.51 131.12 1ud7 n ALA 46 Ca -0.22 0.07 -0.12 0.00 0.00 0.00 0.00 53.44 53.18 1ud7 n ALA 46 Cb 0.52 -3.65 -0.05 0.00 0.00 0.00 0.00 19.45 16.28 1ud7 n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ud7 n GLY 47 N -1.67 1.13 3.19 0.00 0.00 -1.26 -4.95 105.19 101.63 1ud7 n GLY 47 Ca -0.07 -0.04 -0.28 0.00 0.00 0.00 0.00 46.02 45.64 1ud7 n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ud7 s LYS 48 N -2.93 1.90 0.12 1.61 1.02 0.91 -5.13 119.74 117.23 1ud7 s LYS 48 Ca 0.00 -0.72 -0.19 0.00 0.02 0.00 0.00 55.97 55.08 1ud7 s LYS 48 Cb 0.00 -1.70 -0.07 0.00 -0.52 0.00 0.00 37.83 35.54 1ud7 s LYS 48 CO 0.00 0.35 0.60 -1.14 -0.92 0.00 0.00 175.35 174.24 1ud7 s GLN 49 N -0.20 4.19 -0.11 1.68 0.74 -1.26 -0.64 119.66 124.05 1ud7 s GLN 49 Ca 0.01 0.74 -0.24 0.00 0.05 0.00 0.00 55.36 55.91 1ud7 s GLN 49 Cb -0.11 -3.13 -0.03 0.00 1.10 0.00 0.00 33.01 30.85 1ud7 s GLN 49 CO 0.01 0.57 0.74 -0.51 -0.55 0.00 0.00 175.29 175.55 1ud7 s LEU 50 N -1.41 4.26 0.03 3.68 1.43 -0.92 -4.98 118.68 120.77 1ud7 s LEU 50 Ca 0.33 1.17 -0.02 0.00 -1.03 0.00 0.00 54.13 54.58 1ud7 s LEU 50 Cb -0.18 -3.13 -0.04 0.00 0.03 0.00 0.00 46.19 42.87 1ud7 s LEU 50 CO 0.20 -0.22 0.21 -1.61 0.23 0.00 0.00 176.35 175.15 1ud7 s GLU 51 N 1.33 3.46 0.00 1.70 2.02 -1.26 -4.81 118.70 121.13 1ud7 s GLU 51 Ca 0.37 -0.34 0.17 0.00 0.02 0.00 0.00 54.97 55.20 1ud7 s GLU 51 Cb -0.17 -3.06 1.01 0.00 0.10 0.00 0.00 34.13 32.00 1ud7 s GLU 51 CO 0.16 0.64 1.45 -0.25 0.02 0.00 0.00 175.26 177.28 1ud7 n ASP 52 N 0.66 0.00 -0.01 -0.19 9.92 -1.26 -2.16 116.55 123.52 1ud7 n ASP 52 Ca -0.08 -0.44 0.09 0.00 -0.53 0.00 0.00 54.79 53.83 1ud7 n ASP 52 Cb 0.52 -0.05 -0.13 0.00 -0.64 0.00 0.00 41.12 40.82 1ud7 n ASP 52 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ud7 n GLY 53 N 0.10 -0.83 3.98 0.44 0.00 -1.26 -4.52 105.19 103.10 1ud7 n GLY 53 Ca 0.12 -0.49 -0.23 0.00 0.00 0.00 0.00 46.02 45.43 1ud7 n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ud7 s ARG 54 N -3.10 2.28 0.30 1.61 1.81 -0.92 -5.00 118.95 115.93 1ud7 s ARG 54 Ca -0.01 -1.82 0.01 0.00 -1.72 0.00 0.00 55.73 52.18 1ud7 s ARG 54 Cb 0.13 -2.39 -0.00 0.00 -0.45 0.00 0.00 34.95 32.23 1ud7 s ARG 54 CO 0.79 -0.76 0.02 0.25 -0.68 0.00 0.00 175.30 174.92 1ud7 n THR 55 N -2.03 0.00 -0.08 0.02 -2.24 -1.26 -1.80 114.28 106.88 1ud7 n THR 55 Ca 0.08 -1.48 -0.14 0.00 -2.27 0.00 0.00 64.05 60.24 1ud7 n THR 55 Cb 0.63 0.36 -0.05 0.00 -2.10 0.00 0.00 70.33 69.17 1ud7 n THR 55 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1ud7 h LEU 56 N 0.00 0.72 -2.40 3.22 3.38 -1.65 -2.91 115.31 115.67 1ud7 h LEU 56 Ca -0.24 -0.50 -0.01 0.00 0.09 0.00 0.00 57.88 57.22 1ud7 h LEU 56 Cb 0.78 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 1ud7 h LEU 56 CO 0.40 1.08 -0.03 0.77 0.09 0.00 0.00 178.44 180.75 1ud7 h SER 57 N 0.38 0.00 0.02 -0.43 4.64 -1.88 -1.30 113.55 114.99 1ud7 h SER 57 Ca 0.03 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.26 1ud7 h SER 57 Cb 0.91 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.99 1ud7 h SER 57 CO 0.08 0.03 -0.27 0.44 -0.87 0.00 0.00 176.83 176.24 1ud7 h ASP 58 N 0.00 0.39 -0.64 4.97 3.32 -1.90 -2.49 116.42 120.07 1ud7 h ASP 58 Ca -0.00 -0.13 0.00 0.00 0.02 0.00 0.00 57.03 56.92 1ud7 h ASP 58 Cb 0.10 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1ud7 h ASP 58 CO 0.00 0.66 0.00 -1.22 -1.72 0.00 0.00 179.24 176.96 1ud7 n TYR 59 N -4.12 1.72 -3.92 4.55 4.02 -0.54 -4.94 117.16 113.92 1ud7 n TYR 59 Ca -0.01 -0.65 -0.25 0.00 -0.01 0.00 0.00 57.90 56.99 1ud7 n TYR 59 Cb 0.40 -0.34 -0.02 0.00 -0.02 0.00 0.00 39.34 39.37 1ud7 n TYR 59 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1ud7 n ASN 60 N 1.00 -0.39 -4.68 7.72 4.13 -0.94 -4.89 115.26 117.21 1ud7 n ASN 60 Ca 0.27 -0.99 -0.43 0.00 1.68 0.00 0.00 54.58 55.12 1ud7 n ASN 60 Cb 1.01 -3.16 -0.02 0.00 -1.54 0.00 0.00 39.78 36.06 1ud7 n ASN 60 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1ud7 s ILE 61 N -3.93 4.60 0.47 2.41 1.01 -0.91 -5.03 121.20 119.82 1ud7 s ILE 61 Ca 0.00 1.90 0.07 0.00 0.00 0.00 0.00 60.65 62.62 1ud7 s ILE 61 Cb -0.00 -4.22 0.00 0.00 0.01 0.00 0.00 42.46 38.25 1ud7 s ILE 61 CO 0.88 -0.04 0.40 -1.10 0.00 0.00 0.00 174.94 175.08 1ud7 s GLN 62 N 2.41 2.41 0.72 2.79 1.11 -1.26 -4.82 119.66 123.02 1ud7 s GLN 62 Ca 0.50 -1.71 -0.12 0.00 0.01 0.00 0.00 55.36 54.04 1ud7 s GLN 62 Cb -0.19 -2.29 0.03 0.00 -1.01 0.00 0.00 33.01 29.55 1ud7 s GLN 62 CO 0.16 -0.36 1.08 -1.59 0.01 0.00 0.00 175.29 174.59 1ud7 s LYS 63 N -4.20 2.58 0.00 2.91 -2.85 -1.26 -3.15 119.74 113.77 1ud7 s LYS 63 Ca 0.45 1.16 0.00 0.00 -1.00 0.00 0.00 55.97 56.58 1ud7 s LYS 63 Cb -0.03 -1.94 0.00 0.00 -2.06 0.00 0.00 37.83 33.81 1ud7 s LYS 63 CO 0.26 -1.39 0.00 0.39 0.10 0.00 0.00 175.35 174.71 1ud7 n GLU 64 N -3.14 -0.83 -2.62 1.78 -0.58 -1.02 -4.97 120.64 109.27 1ud7 n GLU 64 Ca 0.09 0.21 -0.34 0.00 -0.42 0.00 0.00 57.16 56.69 1ud7 n GLU 64 Cb 0.53 -4.07 -0.05 0.00 -0.57 0.00 0.00 31.44 27.29 1ud7 n GLU 64 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 1ud7 s SER 65 N -2.13 6.59 -0.05 1.62 0.01 -1.19 -4.78 113.70 113.78 1ud7 s SER 65 Ca 0.00 1.88 0.05 0.00 1.31 0.00 0.00 55.95 59.20 1ud7 s SER 65 Cb 0.00 -2.56 -0.02 0.00 0.21 0.00 0.00 66.02 63.65 1ud7 s SER 65 CO 0.00 -0.60 -0.20 -0.89 0.41 0.00 0.00 173.24 171.96 1ud7 s THR 66 N -1.96 2.53 0.07 1.44 2.01 -1.26 -1.40 115.64 117.07 1ud7 s THR 66 Ca 0.64 -0.91 0.08 0.00 0.31 0.00 0.00 61.69 61.81 1ud7 s THR 66 Cb -0.15 -1.95 -0.03 0.00 0.01 0.00 0.00 72.50 70.38 1ud7 s THR 66 CO 0.19 0.58 -0.23 -0.63 -0.69 0.00 0.00 174.62 173.85 1ud7 s ILE 67 N -0.50 1.84 -0.22 1.82 1.01 0.03 -4.90 121.20 120.28 1ud7 s ILE 67 Ca 0.06 -1.41 -0.10 0.00 0.00 0.00 0.00 60.65 59.21 1ud7 s ILE 67 Cb -0.11 -1.62 -0.05 0.00 0.01 0.00 0.00 42.46 40.69 1ud7 s ILE 67 CO 0.01 0.14 0.14 -1.00 0.00 0.00 0.00 174.94 174.23 1ud7 s HIS 68 N -0.94 3.37 -0.17 3.97 3.76 -1.11 -1.90 115.29 122.28 1ud7 s HIS 68 Ca 0.09 0.29 -0.09 0.00 -0.15 0.00 0.00 55.06 55.20 1ud7 s HIS 68 Cb -0.09 -2.21 -0.05 0.00 1.11 0.00 0.00 32.58 31.34 1ud7 s HIS 68 CO 0.03 0.20 0.13 -1.17 -0.85 0.00 0.00 174.74 173.07 1ud7 s LEU 69 N 0.65 4.23 0.18 0.89 2.96 -0.69 -1.35 118.68 125.56 1ud7 s LEU 69 Ca 0.08 0.30 0.02 0.00 -0.22 0.00 0.00 54.13 54.31 1ud7 s LEU 69 Cb -0.12 -2.07 -0.05 0.00 0.50 0.00 0.00 46.19 44.45 1ud7 s LEU 69 CO 0.01 0.26 -0.01 -0.69 -1.32 0.00 0.00 176.35 174.60 1ud7 s VAL 70 N -0.11 0.80 -0.15 1.68 1.01 0.15 -4.31 120.40 119.47 1ud7 s VAL 70 Ca 0.10 -2.00 -0.18 0.00 0.00 0.00 0.00 61.98 59.90 1ud7 s VAL 70 Cb -0.11 -2.14 -0.04 0.00 0.00 0.00 0.00 36.38 34.08 1ud7 s VAL 70 CO 0.00 -0.47 0.49 -0.76 0.00 0.00 0.00 175.10 174.36 1ud7 s LEU 71 N -3.20 4.23 -0.20 3.92 2.01 -1.26 -0.05 118.68 124.13 1ud7 s LEU 71 Ca 0.24 0.76 -0.06 0.00 0.01 0.00 0.00 54.13 55.09 1ud7 s LEU 71 Cb 0.06 -2.70 -0.03 0.00 0.01 0.00 0.00 46.19 43.53 1ud7 s LEU 71 CO 0.05 -0.06 0.02 -0.60 1.01 0.00 0.00 176.35 176.77 1ud7 s ARG 72 N 0.98 3.71 0.00 1.70 3.52 -1.12 -4.92 118.95 122.83 1ud7 s ARG 72 Ca 0.25 -0.47 0.00 0.00 -0.13 0.00 0.00 55.73 55.38 1ud7 s ARG 72 Cb -0.15 -3.13 0.00 0.00 -1.56 0.00 0.00 34.95 30.11 1ud7 s ARG 72 CO 0.10 0.07 0.00 1.28 -0.81 0.00 0.00 175.30 175.94 1ud7 n LEU 73 N 4.10 0.00 0.00 -0.88 4.32 -1.26 -4.54 117.00 118.74 1ud7 n LEU 73 Ca -0.17 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.82 1ud7 n LEU 73 Cb 0.52 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.32 1ud7 n LEU 73 CO 0.32 -0.54 0.00 -1.14 -1.22 0.00 0.00 177.39 174.81 1ud7 n ARG 74 N -0.32 0.00 0.00 3.23 0.63 -1.26 -4.93 116.66 114.00 1ud7 n ARG 74 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1ud7 n ARG 74 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 1ud7 n ARG 74 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1ud7 n GLY 75 N 0.00 1.94 0.00 5.14 0.00 -1.26 -5.25 105.19 105.75 1ud7 n GLY 75 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.42 1ud7 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93