#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 3.00 0.40 3.17 0.74 -1.26 -1.48 119.66 124.22 1ud7 s GLN 2 Ca 0.00 -1.11 0.08 0.00 0.05 0.00 0.00 55.36 54.37 1ud7 s GLN 2 Cb 0.00 -4.05 -0.05 0.00 1.10 0.00 0.00 33.01 30.01 1ud7 s GLN 2 CO 0.00 -0.92 0.17 0.14 -0.55 0.00 0.00 175.29 174.14 1ud7 s VAL 3 N 1.80 2.47 0.15 1.34 -7.23 -0.69 -3.05 120.40 115.19 1ud7 s VAL 3 Ca 0.06 -1.70 0.10 0.00 -1.81 0.00 0.00 61.98 58.64 1ud7 s VAL 3 Cb -0.21 -2.98 -0.04 0.00 0.56 0.00 0.00 36.38 33.71 1ud7 s VAL 3 CO 0.09 -0.05 -0.23 -0.36 -0.31 0.00 0.00 175.10 174.24 1ud7 s PHE 4 N -2.56 2.13 -0.03 2.82 0.08 -0.62 -0.92 117.98 118.88 1ud7 s PHE 4 Ca 0.40 -0.39 0.04 0.00 0.12 0.00 0.00 56.93 57.10 1ud7 s PHE 4 Cb 0.02 -1.10 -0.01 0.00 -0.57 0.00 0.00 43.02 41.36 1ud7 s PHE 4 CO 0.23 0.37 -0.16 -1.17 -0.10 0.00 0.00 175.22 174.39 1ud7 s LEU 5 N -2.35 1.95 -0.07 -0.37 2.96 -0.60 -1.05 118.68 119.14 1ud7 s LEU 5 Ca 0.15 -0.31 -0.04 0.00 -0.22 0.00 0.00 54.13 53.71 1ud7 s LEU 5 Cb -0.09 -0.86 -0.04 0.00 0.50 0.00 0.00 46.19 45.70 1ud7 s LEU 5 CO 0.07 0.16 0.12 -0.75 -1.32 0.00 0.00 176.35 174.64 1ud7 s LYS 6 N -0.12 3.32 0.55 1.98 2.20 0.49 -1.45 119.74 126.71 1ud7 s LYS 6 Ca 0.01 -0.26 0.08 0.00 -0.36 0.00 0.00 55.97 55.43 1ud7 s LYS 6 Cb -0.09 -3.07 0.06 0.00 -1.51 0.00 0.00 37.83 33.22 1ud7 s LYS 6 CO 0.01 0.73 0.61 0.95 -0.36 0.00 0.00 175.35 177.29 1ud7 s THR 7 N -1.10 2.04 -0.96 3.43 -4.23 -0.99 -1.78 115.64 112.04 1ud7 s THR 7 Ca 0.19 -1.20 0.23 0.00 -1.18 0.00 0.00 61.69 59.73 1ud7 s THR 7 Cb -0.12 -2.24 0.20 0.00 1.34 0.00 0.00 72.50 71.68 1ud7 s THR 7 CO 0.08 0.00 1.74 0.18 -0.54 0.00 0.00 174.62 176.09 1ud7 n LEU 8 N -2.00 0.07 -0.00 4.79 4.77 -1.26 -2.79 117.00 120.57 1ud7 n LEU 8 Ca 0.08 0.51 0.11 0.00 -0.03 0.00 0.00 56.01 56.68 1ud7 n LEU 8 Cb 0.62 -0.49 -0.14 0.00 -2.33 0.00 0.00 43.42 41.08 1ud7 n LEU 8 CO 0.40 -0.12 -0.49 0.35 -1.33 0.00 0.00 177.39 176.19 1ud7 n THR 9 N -1.57 0.02 0.00 -5.08 -2.24 -1.26 -4.98 114.28 99.17 1ud7 n THR 9 Ca 0.05 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 1ud7 n THR 9 Cb 0.28 0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 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 1.34 1.81 3.75 3.38 0.00 -1.12 -5.09 105.19 109.24 1ud7 n GLY 10 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 1ud7 n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ud7 s LYS 11 N -0.73 4.15 -0.27 1.61 2.20 -1.26 -4.88 119.74 120.56 1ud7 s LYS 11 Ca 0.00 -0.01 -0.11 0.00 -0.36 0.00 0.00 55.97 55.49 1ud7 s LYS 11 Cb 0.00 -3.40 -0.05 0.00 -1.51 0.00 0.00 37.83 32.88 1ud7 s LYS 11 CO 0.00 0.32 0.20 0.99 -0.36 0.00 0.00 175.35 176.50 1ud7 s THR 12 N 0.25 5.31 0.30 3.43 2.01 -1.26 -2.35 115.64 123.33 1ud7 s THR 12 Ca 0.14 0.21 0.09 0.00 0.31 0.00 0.00 61.69 62.43 1ud7 s THR 12 Cb -0.12 -3.54 -0.04 0.00 0.01 0.00 0.00 72.50 68.81 1ud7 s THR 12 CO 0.02 0.27 0.09 0.68 -0.69 0.00 0.00 174.62 174.99 1ud7 s VAL 13 N 1.60 3.35 -0.38 3.82 -7.23 -0.53 -4.93 120.40 116.10 1ud7 s VAL 13 Ca 0.08 -1.75 0.03 0.00 -1.81 0.00 0.00 61.98 58.53 1ud7 s VAL 13 Cb -0.15 -2.97 0.11 0.00 0.56 0.00 0.00 36.38 33.92 1ud7 s VAL 13 CO 0.09 -0.28 0.10 0.42 -0.31 0.00 0.00 175.10 175.13 1ud7 s THR 14 N -2.35 2.50 -0.17 5.32 -4.23 -1.26 -1.56 115.64 113.88 1ud7 s THR 14 Ca 0.35 -2.43 -0.09 0.00 -1.18 0.00 0.00 61.69 58.34 1ud7 s THR 14 Cb -0.05 -2.80 -0.05 0.00 1.34 0.00 0.00 72.50 70.94 1ud7 s THR 14 CO 0.22 -0.64 0.14 -0.63 -0.54 0.00 0.00 174.62 173.16 1ud7 s ILE 15 N 0.78 5.44 -0.20 2.99 -1.09 -0.10 -4.94 121.20 124.09 1ud7 s ILE 15 Ca 0.11 0.21 -0.10 0.00 -2.23 0.00 0.00 60.65 58.64 1ud7 s ILE 15 Cb -0.20 -3.45 -0.05 0.00 -1.58 0.00 0.00 42.46 37.18 1ud7 s ILE 15 CO -0.06 0.51 0.15 -1.61 -1.23 0.00 0.00 174.94 172.69 1ud7 s GLU 16 N -0.15 4.19 0.24 2.79 8.01 -1.26 -1.70 118.70 130.82 1ud7 s GLU 16 Ca 0.11 -0.19 -0.00 0.00 0.01 0.00 0.00 54.97 54.90 1ud7 s GLU 16 Cb -0.11 -3.43 -0.03 0.00 -4.31 0.00 0.00 34.13 26.25 1ud7 s GLU 16 CO 0.00 0.28 0.21 0.14 0.01 0.00 0.00 175.26 175.90 1ud7 s VAL 17 N 0.41 0.00 -0.07 2.63 -7.23 -0.55 -4.97 120.40 110.63 1ud7 s VAL 17 Ca 0.09 -1.93 0.03 0.00 -1.81 0.00 0.00 61.98 58.36 1ud7 s VAL 17 Cb -0.11 -2.48 0.01 0.00 0.56 0.00 0.00 36.38 34.35 1ud7 s VAL 17 CO -0.01 0.00 -0.16 -1.61 -0.31 0.00 0.00 175.10 173.01 1ud7 s GLU 18 N -3.92 1.98 -0.81 4.82 0.41 -1.26 0.13 118.70 120.04 1ud7 s GLU 18 Ca 0.38 -0.55 -0.16 0.00 -0.41 0.00 0.00 54.97 54.22 1ud7 s GLU 18 Cb 0.05 -1.61 -0.21 0.00 -1.78 0.00 0.00 34.13 30.58 1ud7 s GLU 18 CO 0.16 0.11 2.11 -2.30 -0.49 0.00 0.00 175.26 174.85 1ud7 n PRO 19 N 3.58 0.22 0.00 0.39 -0.02 -1.26 -1.21 135.00 136.70 1ud7 n PRO 19 Ca -0.21 -0.53 0.00 0.00 -2.02 0.00 0.00 63.50 60.74 1ud7 n PRO 19 Cb 0.52 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 1ud7 n PRO 19 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1ud7 n SER 20 N 12.15 0.00 -4.78 2.55 3.41 -1.26 -4.86 113.62 120.83 1ud7 n SER 20 Ca 0.48 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.78 1ud7 n SER 20 Cb 0.33 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.35 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 4.97 0.06 4.04 1.01 -0.35 -4.82 116.67 121.57 1ud7 s ASP 21 Ca 0.00 1.82 -0.10 0.00 0.71 0.00 0.00 52.55 54.98 1ud7 s ASP 21 Cb 0.00 -2.52 -0.06 0.00 1.01 0.00 0.00 42.92 41.35 1ud7 s ASP 21 CO 0.00 -1.72 0.38 0.42 0.21 0.00 0.00 175.17 174.46 1ud7 s THR 22 N -2.75 5.11 0.29 -1.27 -4.23 -1.26 -1.88 115.64 109.65 1ud7 s THR 22 Ca 0.62 0.48 0.03 0.00 -1.18 0.00 0.00 61.69 61.64 1ud7 s THR 22 Cb -0.17 -3.64 0.31 0.00 1.34 0.00 0.00 72.50 70.34 1ud7 s THR 22 CO 0.50 0.34 1.65 0.58 -0.54 0.00 0.00 174.62 177.16 1ud7 h VAL 23 N 3.03 0.31 -0.34 2.29 2.07 -0.78 0.18 116.25 123.00 1ud7 h VAL 23 Ca -0.50 -0.08 0.07 0.00 0.82 0.00 0.00 66.70 67.02 1ud7 h VAL 23 Cb 1.20 0.07 -0.07 0.00 -1.52 0.00 0.00 31.29 30.97 1ud7 h VAL 23 CO 0.65 0.04 -0.12 -0.08 0.02 0.00 0.00 177.57 178.08 1ud7 h GLU 24 N 0.22 -0.05 -0.87 1.57 4.81 -1.80 -0.63 114.58 117.84 1ud7 h GLU 24 Ca 0.57 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.89 1ud7 h GLU 24 Cb 1.17 0.01 -0.07 0.00 0.63 0.00 0.00 28.75 30.49 1ud7 h GLU 24 CO -0.65 -0.03 0.52 -0.91 -0.73 0.00 0.00 179.01 177.21 1ud7 h ASN 25 N -0.05 0.79 -0.45 1.04 2.35 -1.06 -1.60 115.58 116.60 1ud7 h ASN 25 Ca 0.17 0.03 0.04 0.00 -0.55 0.00 0.00 56.30 56.00 1ud7 h ASN 25 Cb 0.31 -0.12 -0.04 0.00 0.05 0.00 0.00 38.32 38.52 1ud7 h ASN 25 CO -0.38 0.47 0.21 0.15 -1.65 0.00 0.00 177.43 176.23 1ud7 h PHE 26 N 0.90 0.39 -0.33 1.19 3.57 -0.59 -1.11 116.94 120.96 1ud7 h PHE 26 Ca 0.40 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.91 1ud7 h PHE 26 Cb 0.30 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.91 1ud7 h PHE 26 CO -0.04 0.19 0.15 0.87 -2.23 0.00 0.00 178.31 177.25 1ud7 h LYS 27 N 0.43 0.46 -0.48 1.11 1.57 -0.39 -1.59 116.57 117.67 1ud7 h LYS 27 Ca 0.20 -0.05 -0.12 0.00 -1.87 0.00 0.00 60.65 58.80 1ud7 h LYS 27 Cb 0.12 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 1ud7 h LYS 27 CO -0.15 0.36 -0.18 0.00 -0.57 0.00 0.00 179.45 178.91 1ud7 h ALA 28 N 1.71 0.67 -0.46 3.86 0.00 -0.49 -1.95 119.26 122.60 1ud7 h ALA 28 Ca 0.12 -0.38 -0.07 0.00 0.00 0.00 0.00 54.91 54.58 1ud7 h ALA 28 Cb 0.06 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1ud7 h ALA 28 CO -0.02 0.64 0.01 0.87 0.00 0.00 0.00 179.25 180.76 1ud7 h LYS 29 N 0.83 0.81 -0.44 0.00 1.57 -0.61 -2.86 116.57 115.86 1ud7 h LYS 29 Ca 0.11 -0.25 -0.05 0.00 -1.87 0.00 0.00 60.65 58.59 1ud7 h LYS 29 Cb 0.76 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.97 1ud7 h LYS 29 CO 0.06 0.85 0.07 0.82 -0.57 0.00 0.00 179.45 180.68 1ud7 h ILE 30 N 0.66 1.21 -0.46 1.86 2.04 -1.24 -2.82 117.51 118.77 1ud7 h ILE 30 Ca 0.13 -0.80 0.01 0.00 1.00 0.00 0.00 64.86 65.21 1ud7 h ILE 30 Cb 0.48 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.33 1ud7 h ILE 30 CO 0.02 0.29 0.28 -0.61 0.00 0.00 0.00 178.15 178.13 1ud7 h GLN 31 N 0.66 0.56 0.00 2.37 4.15 -1.13 0.17 115.11 121.88 1ud7 h GLN 31 Ca 0.14 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.53 1ud7 h GLN 31 Cb 0.31 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 27.87 1ud7 h GLN 31 CO 0.00 0.37 0.00 -0.40 -1.93 0.00 0.00 178.83 176.87 1ud7 n ASP 32 N -4.80 0.28 -0.10 -0.69 5.68 -1.07 0.26 116.55 116.10 1ud7 n ASP 32 Ca 0.02 0.61 -0.15 0.00 -0.50 0.00 0.00 54.79 54.77 1ud7 n ASP 32 Cb 0.05 -0.65 -0.05 0.00 -1.14 0.00 0.00 41.12 39.32 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 -1.85 0.54 -0.06 0.11 5.02 -0.16 -4.75 118.16 117.01 1ud7 n LYS 33 Ca 0.00 0.24 -0.01 0.00 -2.02 0.00 0.00 58.31 56.52 1ud7 n LYS 33 Cb 0.07 -1.46 -0.16 0.00 -0.02 0.00 0.00 35.03 33.45 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 -4.41 0.68 -1.84 1.97 -0.58 0.41 -5.05 120.64 111.83 1ud7 n GLU 34 Ca -0.25 -0.08 -0.01 0.00 -0.42 0.00 0.00 57.16 56.40 1ud7 n GLU 34 Cb 0.61 -1.52 0.00 0.00 -0.57 0.00 0.00 31.44 29.96 1ud7 n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ud7 n GLY 35 N 1.55 -0.32 2.75 0.62 0.00 0.74 -5.01 105.19 105.51 1ud7 n GLY 35 Ca -0.21 -0.07 -0.21 0.00 0.00 0.00 0.00 46.02 45.53 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 -3.01 0.22 0.14 -0.61 1.01 -1.26 -5.02 121.20 112.66 1ud7 s ILE 36 Ca 0.02 0.20 -0.34 0.00 0.00 0.00 0.00 60.65 60.53 1ud7 s ILE 36 Cb -0.00 -0.39 -0.16 0.00 0.01 0.00 0.00 42.46 41.91 1ud7 s ILE 36 CO 0.16 0.22 1.24 -2.65 0.00 0.00 0.00 174.94 173.91 1ud7 n PRO 37 N 5.06 1.17 -0.35 2.79 -0.02 -1.26 -4.58 135.00 137.80 1ud7 n PRO 37 Ca -0.08 0.42 0.14 0.00 -2.02 0.00 0.00 63.50 61.95 1ud7 n PRO 37 Cb 0.50 -1.98 0.33 0.00 -0.02 0.00 0.00 33.50 32.34 1ud7 n PRO 37 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1ud7 h PRO 38 N 3.86 0.72 0.00 0.52 0.11 -1.93 0.37 132.00 135.64 1ud7 h PRO 38 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1ud7 h PRO 38 Cb 1.34 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1ud7 h PRO 38 CO 0.73 0.48 0.04 -0.25 -0.21 0.00 0.00 178.00 178.79 1ud7 n ASP 39 N -4.76 0.53 -0.10 -2.05 9.92 -1.26 -0.33 116.55 118.50 1ud7 n ASP 39 Ca 0.23 0.73 0.01 0.00 -0.53 0.00 0.00 54.79 55.24 1ud7 n ASP 39 Cb 0.59 -0.79 0.03 0.00 -0.64 0.00 0.00 41.12 40.31 1ud7 n ASP 39 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ud7 n GLN 40 N -2.23 2.94 -3.51 -1.24 6.02 0.12 -4.58 117.38 114.91 1ud7 n GLN 40 Ca -0.01 -1.61 -0.41 0.00 -0.01 0.00 0.00 57.00 54.96 1ud7 n GLN 40 Cb 0.07 -1.05 -0.10 0.00 1.02 0.00 0.00 30.24 30.17 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 -1.05 3.37 -0.26 -1.09 -0.21 0.55 -0.65 119.66 120.32 1ud7 s GLN 41 Ca 0.04 -0.73 -0.02 0.00 0.02 0.00 0.00 55.36 54.67 1ud7 s GLN 41 Cb 0.03 -3.85 0.03 0.00 1.00 0.00 0.00 33.01 30.21 1ud7 s GLN 41 CO 0.02 -0.52 -0.03 0.50 -2.12 0.00 0.00 175.29 173.14 1ud7 s ARG 42 N 1.73 2.81 -0.21 2.91 3.52 0.11 -4.88 118.95 124.94 1ud7 s ARG 42 Ca 0.06 -1.00 -0.10 0.00 -0.13 0.00 0.00 55.73 54.56 1ud7 s ARG 42 Cb -0.18 -3.07 -0.05 0.00 -1.56 0.00 0.00 34.95 30.09 1ud7 s ARG 42 CO 0.10 -0.44 0.13 -0.51 -0.81 0.00 0.00 175.30 173.77 1ud7 s LEU 43 N 1.34 4.12 -0.27 -0.88 1.43 -1.26 0.26 118.68 123.42 1ud7 s LEU 43 Ca -0.00 0.17 0.03 0.00 -1.03 0.00 0.00 54.13 53.30 1ud7 s LEU 43 Cb -0.17 -2.07 0.07 0.00 0.03 0.00 0.00 46.19 44.04 1ud7 s LEU 43 CO -0.03 0.15 -0.08 -0.63 0.23 0.00 0.00 176.35 175.99 1ud7 s ILE 44 N 0.54 2.13 -0.05 -0.59 -1.09 -0.30 -1.99 121.20 119.85 1ud7 s ILE 44 Ca 0.07 -1.71 0.02 0.00 -2.23 0.00 0.00 60.65 56.81 1ud7 s ILE 44 Cb -0.12 -2.30 0.01 0.00 -1.58 0.00 0.00 42.46 38.48 1ud7 s ILE 44 CO -0.00 -0.12 -0.09 0.12 -1.23 0.00 0.00 174.94 173.62 1ud7 s PHE 45 N 1.10 1.12 -1.42 3.97 5.36 -0.53 -3.05 117.98 124.53 1ud7 s PHE 45 Ca -0.06 -0.36 -0.09 0.00 -0.96 0.00 0.00 56.93 55.46 1ud7 s PHE 45 Cb -0.20 -0.85 0.04 0.00 -0.34 0.00 0.00 43.02 41.67 1ud7 s PHE 45 CO -0.06 -0.20 1.01 0.00 -1.46 0.00 0.00 175.22 174.51 1ud7 n ALA 46 N 3.72 -1.46 -1.91 11.12 0.00 -1.26 -0.92 120.51 129.80 1ud7 n ALA 46 Ca -0.22 0.19 -0.19 0.00 0.00 0.00 0.00 53.44 53.22 1ud7 n ALA 46 Cb 0.52 -4.29 -0.05 0.00 0.00 0.00 0.00 19.45 15.63 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 -1.74 0.84 2.96 0.00 0.00 -1.26 -4.95 105.19 101.04 1ud7 n GLY 47 Ca -0.04 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.78 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 -4.21 0.85 0.16 1.61 1.02 -0.10 -5.14 119.74 113.94 1ud7 s LYS 48 Ca 0.00 -0.23 -0.27 0.00 0.02 0.00 0.00 55.97 55.50 1ud7 s LYS 48 Cb 0.00 -0.81 -0.08 0.00 -0.52 0.00 0.00 37.83 36.42 1ud7 s LYS 48 CO 0.00 0.05 0.83 -0.65 -0.92 0.00 0.00 175.35 174.66 1ud7 s GLN 49 N 0.37 4.64 -0.09 1.68 -0.21 -1.26 -1.45 119.66 123.33 1ud7 s GLN 49 Ca -0.05 1.25 -0.19 0.00 0.02 0.00 0.00 55.36 56.39 1ud7 s GLN 49 Cb -0.10 -3.30 -0.04 0.00 1.00 0.00 0.00 33.01 30.58 1ud7 s GLN 49 CO 0.00 0.47 0.53 -0.51 -2.12 0.00 0.00 175.29 173.66 1ud7 s LEU 50 N -0.85 4.31 0.26 2.90 1.02 -0.84 -4.99 118.68 120.49 1ud7 s LEU 50 Ca 0.39 0.93 0.07 0.00 0.02 0.00 0.00 54.13 55.53 1ud7 s LEU 50 Cb -0.23 -2.78 -0.03 0.00 0.02 0.00 0.00 46.19 43.16 1ud7 s LEU 50 CO 0.27 0.01 0.21 -1.61 0.02 0.00 0.00 176.35 175.26 1ud7 s GLU 51 N 0.47 2.95 0.00 1.70 0.41 -1.26 -4.64 118.70 118.33 1ud7 s GLU 51 Ca 0.28 -1.05 0.16 0.00 -0.41 0.00 0.00 54.97 53.95 1ud7 s GLU 51 Cb -0.16 -2.58 0.93 0.00 -1.78 0.00 0.00 34.13 30.54 1ud7 s GLU 51 CO 0.13 0.38 1.38 -0.25 -0.49 0.00 0.00 175.26 176.40 1ud7 n ASP 52 N -1.21 0.00 -0.24 -0.19 9.92 -1.26 -2.28 116.55 121.30 1ud7 n ASP 52 Ca -0.08 -0.81 0.07 0.00 -0.53 0.00 0.00 54.79 53.45 1ud7 n ASP 52 Cb 0.58 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 41.04 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 0.26 -0.13 3.87 0.44 0.00 -1.26 -4.36 105.19 104.01 1ud7 n GLY 53 Ca 0.12 -0.40 -0.23 0.00 0.00 0.00 0.00 46.02 45.50 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 -1.87 2.38 0.19 1.61 3.00 -0.96 -4.98 118.95 118.31 1ud7 s ARG 54 Ca 0.10 -1.76 0.00 0.00 0.00 0.00 0.00 55.73 54.08 1ud7 s ARG 54 Cb 0.11 -2.24 -0.00 0.00 0.00 0.00 0.00 34.95 32.82 1ud7 s ARG 54 CO 0.41 -0.36 0.01 0.25 0.00 0.00 0.00 175.30 175.61 1ud7 n THR 55 N -1.61 0.00 -0.01 0.02 -2.24 -1.26 -0.18 114.28 109.00 1ud7 n THR 55 Ca 0.02 -0.95 -0.16 0.00 -2.27 0.00 0.00 64.05 60.69 1ud7 n THR 55 Cb 0.63 0.22 -0.11 0.00 -2.10 0.00 0.00 70.33 68.97 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 0.37 -2.03 3.22 3.38 -1.69 -3.21 115.31 115.35 1ud7 h LEU 56 Ca -0.16 -0.78 -0.02 0.00 0.09 0.00 0.00 57.88 57.02 1ud7 h LEU 56 Cb 0.50 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 1ud7 h LEU 56 CO 0.26 1.10 -0.08 0.77 0.09 0.00 0.00 178.44 180.58 1ud7 h SER 57 N -0.32 0.00 0.16 -0.43 4.64 -1.85 -1.43 113.55 114.32 1ud7 h SER 57 Ca -0.05 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.22 1ud7 h SER 57 Cb 1.17 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 1ud7 h SER 57 CO 0.08 0.08 -0.20 0.44 -0.87 0.00 0.00 176.83 176.37 1ud7 h ASP 58 N 0.00 0.08 -0.63 4.97 3.32 -1.93 -1.80 116.42 120.42 1ud7 h ASP 58 Ca -0.00 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.03 1ud7 h ASP 58 Cb 0.19 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.72 1ud7 h ASP 58 CO 0.01 0.29 0.00 -1.22 -1.72 0.00 0.00 179.24 176.60 1ud7 n TYR 59 N -4.27 1.69 -3.79 4.55 4.01 -0.59 -4.94 117.16 113.83 1ud7 n TYR 59 Ca -0.02 -0.64 -0.25 0.00 -0.16 0.00 0.00 57.90 56.83 1ud7 n TYR 59 Cb 0.28 -0.33 0.03 0.00 -0.31 0.00 0.00 39.34 39.01 1ud7 n TYR 59 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1ud7 n ASN 60 N 1.00 -2.44 -4.70 7.72 5.03 -0.68 -4.92 115.26 116.28 1ud7 n ASN 60 Ca 0.27 -0.81 -0.42 0.00 0.87 0.00 0.00 54.58 54.48 1ud7 n ASN 60 Cb 0.99 -3.95 -0.03 0.00 -1.02 0.00 0.00 39.78 35.78 1ud7 n ASN 60 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1ud7 s ILE 61 N -3.55 4.82 0.38 2.41 1.01 -0.88 -5.03 121.20 120.35 1ud7 s ILE 61 Ca 0.24 2.03 0.01 0.00 0.00 0.00 0.00 60.65 62.92 1ud7 s ILE 61 Cb -0.12 -4.31 -0.00 0.00 0.01 0.00 0.00 42.46 38.04 1ud7 s ILE 61 CO 0.82 0.07 0.02 0.00 0.00 0.00 0.00 174.94 175.85 1ud7 n GLN 62 N 4.60 0.97 -1.77 2.79 1.13 -1.26 -4.76 117.38 119.08 1ud7 n GLN 62 Ca 0.07 -2.82 -0.34 0.00 -1.94 0.00 0.00 57.00 51.97 1ud7 n GLN 62 Cb 0.50 0.91 0.05 0.00 0.11 0.00 0.00 30.24 31.81 1ud7 n GLN 62 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 1ud7 s LYS 63 N -3.37 2.68 -0.62 -1.09 3.01 -1.26 -2.83 119.74 116.27 1ud7 s LYS 63 Ca 0.04 1.66 0.00 0.00 -1.01 0.00 0.00 55.97 56.66 1ud7 s LYS 63 Cb 0.00 -1.91 0.00 0.00 -1.01 0.00 0.00 37.83 34.91 1ud7 s LYS 63 CO 0.02 -1.39 0.00 0.39 0.51 0.00 0.00 175.35 174.88 1ud7 n GLU 64 N -2.17 -0.91 -2.85 1.68 1.02 -1.17 -4.98 120.64 111.26 1ud7 n GLU 64 Ca 0.12 0.59 -0.40 0.00 -0.02 0.00 0.00 57.16 57.46 1ud7 n GLU 64 Cb 0.51 -4.48 -0.05 0.00 -0.02 0.00 0.00 31.44 27.39 1ud7 n GLU 64 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1ud7 s SER 65 N -2.47 7.45 -0.09 1.62 0.01 -1.13 -4.89 113.70 114.20 1ud7 s SER 65 Ca 0.00 1.72 0.03 0.00 1.31 0.00 0.00 55.95 59.01 1ud7 s SER 65 Cb 0.00 -2.55 -0.01 0.00 0.21 0.00 0.00 66.02 63.67 1ud7 s SER 65 CO 0.00 0.07 -0.18 -0.89 0.41 0.00 0.00 173.24 172.65 1ud7 s THR 66 N -0.56 2.62 0.06 1.44 2.01 -1.26 -1.59 115.64 118.36 1ud7 s THR 66 Ca 0.41 -0.84 0.09 0.00 0.31 0.00 0.00 61.69 61.66 1ud7 s THR 66 Cb -0.23 -2.04 -0.03 0.00 0.01 0.00 0.00 72.50 70.21 1ud7 s THR 66 CO 0.28 0.56 -0.26 -0.63 -0.69 0.00 0.00 174.62 173.87 1ud7 s ILE 67 N 0.00 2.13 -0.17 1.82 1.09 -0.21 -4.89 121.20 120.96 1ud7 s ILE 67 Ca -0.06 -1.45 -0.07 0.00 -1.10 0.00 0.00 60.65 57.97 1ud7 s ILE 67 Cb -0.15 -1.83 -0.04 0.00 -1.06 0.00 0.00 42.46 39.38 1ud7 s ILE 67 CO 0.05 0.30 0.06 -1.00 -0.10 0.00 0.00 174.94 174.25 1ud7 s HIS 68 N -0.86 3.25 -0.08 3.97 3.76 -1.17 -0.38 115.29 123.79 1ud7 s HIS 68 Ca 0.12 0.09 -0.05 0.00 -0.15 0.00 0.00 55.06 55.06 1ud7 s HIS 68 Cb -0.10 -2.05 -0.04 0.00 1.11 0.00 0.00 32.58 31.50 1ud7 s HIS 68 CO 0.03 0.20 0.16 -1.17 -0.85 0.00 0.00 174.74 173.10 1ud7 s LEU 69 N 0.21 4.37 0.07 0.89 2.96 -0.73 -1.15 118.68 125.30 1ud7 s LEU 69 Ca 0.04 0.42 0.01 0.00 -0.22 0.00 0.00 54.13 54.37 1ud7 s LEU 69 Cb -0.12 -2.28 -0.04 0.00 0.50 0.00 0.00 46.19 44.25 1ud7 s LEU 69 CO 0.01 0.35 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.65 1ud7 s VAL 70 N -1.14 0.44 -0.15 1.68 1.01 0.14 -4.50 120.40 117.88 1ud7 s VAL 70 Ca 0.20 -1.69 -0.28 0.00 0.00 0.00 0.00 61.98 60.21 1ud7 s VAL 70 Cb -0.12 -1.36 -0.01 0.00 0.00 0.00 0.00 36.38 34.89 1ud7 s VAL 70 CO 0.10 -0.83 0.94 -0.76 0.00 0.00 0.00 175.10 174.55 1ud7 s LEU 71 N -2.67 4.19 0.04 3.92 2.01 -1.26 -0.72 118.68 124.20 1ud7 s LEU 71 Ca 0.05 1.36 0.01 0.00 0.01 0.00 0.00 54.13 55.56 1ud7 s LEU 71 Cb 0.03 -3.42 -0.04 0.00 0.01 0.00 0.00 46.19 42.77 1ud7 s LEU 71 CO -0.06 -0.46 0.09 -0.60 1.01 0.00 0.00 176.35 176.33 1ud7 s ARG 72 N 2.25 3.02 0.26 1.70 3.52 0.18 -4.89 118.95 124.99 1ud7 s ARG 72 Ca 0.43 -0.57 0.06 0.00 -0.13 0.00 0.00 55.73 55.52 1ud7 s ARG 72 Cb -0.17 -2.82 -0.03 0.00 -1.56 0.00 0.00 34.95 30.38 1ud7 s ARG 72 CO 0.14 0.61 0.35 -0.51 -0.81 0.00 0.00 175.30 175.08 1ud7 s LEU 73 N -2.11 4.19 0.22 -0.88 1.43 -1.26 -4.40 118.68 115.87 1ud7 s LEU 73 Ca 0.27 -0.02 0.18 0.00 -1.03 0.00 0.00 54.13 53.53 1ud7 s LEU 73 Cb -0.12 -2.76 0.03 0.00 0.03 0.00 0.00 46.19 43.37 1ud7 s LEU 73 CO 0.19 -0.12 1.19 -0.09 0.23 0.00 0.00 176.35 177.75 1ud7 h ARG 74 N 1.18 0.00 0.00 1.70 2.43 -2.00 -3.48 114.38 114.20 1ud7 h ARG 74 Ca -0.50 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 1ud7 h ARG 74 Cb 1.24 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1ud7 h ARG 74 CO 0.60 0.25 0.00 0.41 -1.51 0.00 0.00 179.97 179.71 1ud7 n GLY 75 N 1.25 0.56 0.00 2.80 0.00 -1.26 -5.22 105.19 103.32 1ud7 n GLY 75 Ca -0.02 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.30 1ud7 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93