#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ubq s GLN 2 N 0.00 4.13 0.20 3.17 0.74 -1.26 -0.74 119.66 125.89 1ubq s GLN 2 Ca 0.00 0.58 0.04 0.00 0.05 0.00 0.00 55.36 56.03 1ubq s GLN 2 Cb 0.00 -3.27 -0.05 0.00 1.10 0.00 0.00 33.01 30.80 1ubq s GLN 2 CO 0.00 0.57 -0.05 0.96 -0.55 0.00 0.00 175.29 176.22 1ubq s ILE 3 N -0.79 1.12 -0.04 -2.34 -4.36 -0.68 -0.33 121.20 113.79 1ubq s ILE 3 Ca 0.27 -2.05 0.05 0.00 -0.26 0.00 0.00 60.65 58.66 1ubq s ILE 3 Cb -0.18 -2.13 -0.02 0.00 1.25 0.00 0.00 42.46 41.38 1ubq s ILE 3 CO 0.16 -0.51 -0.18 -0.36 0.24 0.00 0.00 174.94 174.29 1ubq s PHE 4 N -3.36 2.58 -0.24 1.37 0.40 0.06 -1.68 117.98 117.12 1ubq s PHE 4 Ca 0.23 -0.25 0.01 0.00 -0.60 0.00 0.00 56.93 56.32 1ubq s PHE 4 Cb 0.04 -1.58 0.04 0.00 0.51 0.00 0.00 43.02 42.03 1ubq s PHE 4 CO 0.05 0.12 -0.11 0.08 0.70 0.00 0.00 175.22 176.07 1ubq s VAL 5 N -0.70 2.43 -0.18 -0.44 1.01 0.48 -0.55 120.40 122.46 1ubq s VAL 5 Ca 0.11 -1.24 -0.15 0.00 0.00 0.00 0.00 61.98 60.70 1ubq s VAL 5 Cb -0.10 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 33.97 1ubq s VAL 5 CO 0.00 0.18 0.35 -0.75 0.00 0.00 0.00 175.10 174.88 1ubq s LYS 6 N 1.23 4.22 0.44 2.72 2.20 -0.19 0.08 119.74 130.44 1ubq s LYS 6 Ca -0.02 0.15 0.08 0.00 -0.36 0.00 0.00 55.97 55.81 1ubq s LYS 6 Cb -0.17 -3.49 0.02 0.00 -1.51 0.00 0.00 37.83 32.68 1ubq s LYS 6 CO -0.07 0.09 0.60 0.95 -0.36 0.00 0.00 175.35 176.57 1ubq s THR 7 N 0.91 2.91 -1.31 3.43 -4.23 -0.21 -1.14 115.64 115.99 1ubq s THR 7 Ca 0.18 -0.98 0.20 0.00 -1.18 0.00 0.00 61.69 59.91 1ubq s THR 7 Cb -0.14 -2.93 0.30 0.00 1.34 0.00 0.00 72.50 71.07 1ubq s THR 7 CO 0.06 0.00 1.64 0.18 -0.54 0.00 0.00 174.62 175.96 1ubq n LEU 8 N -1.92 0.00 -1.53 4.79 4.77 -1.25 -2.79 117.00 119.07 1ubq n LEU 8 Ca 0.09 0.35 0.09 0.00 -0.03 0.00 0.00 56.01 56.51 1ubq n LEU 8 Cb 0.59 -0.35 0.35 0.00 -2.33 0.00 0.00 43.42 41.68 1ubq n LEU 8 CO 0.39 -0.11 0.81 0.35 -1.33 0.00 0.00 177.39 177.50 1ubq n THR 9 N -1.35 1.85 -1.05 -5.08 -2.24 -1.26 -4.92 114.28 100.23 1ubq n THR 9 Ca 0.08 -1.23 -0.02 0.00 -2.27 0.00 0.00 64.05 60.61 1ubq n THR 9 Cb 0.18 0.12 -0.01 0.00 -2.10 0.00 0.00 70.33 68.52 1ubq n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ubq n GLY 10 N 1.02 0.53 3.83 3.38 0.00 -1.12 -5.02 105.19 107.81 1ubq n GLY 10 Ca 0.25 -0.63 -0.37 0.00 0.00 0.00 0.00 46.02 45.27 1ubq n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ubq s LYS 11 N -1.55 3.81 -0.09 1.61 2.20 -1.26 -4.96 119.74 119.51 1ubq s LYS 11 Ca 0.00 0.16 0.05 0.00 -0.36 0.00 0.00 55.97 55.81 1ubq s LYS 11 Cb 0.00 -3.25 -0.00 0.00 -1.51 0.00 0.00 37.83 33.07 1ubq s LYS 11 CO 0.00 0.64 -0.24 0.99 -0.36 0.00 0.00 175.35 176.37 1ubq s THR 12 N -0.76 2.07 -0.04 3.43 2.01 -1.26 -1.05 115.64 120.04 1ubq s THR 12 Ca 0.19 -1.03 0.01 0.00 0.31 0.00 0.00 61.69 61.17 1ubq s THR 12 Cb -0.14 -1.77 -0.03 0.00 0.01 0.00 0.00 72.50 70.56 1ubq s THR 12 CO 0.08 0.56 -0.04 -0.51 -0.69 0.00 0.00 174.62 174.02 1ubq s ILE 13 N 0.17 3.88 -0.11 1.82 2.07 0.11 -4.90 121.20 124.23 1ubq s ILE 13 Ca -0.14 -0.54 -0.06 0.00 -1.41 0.00 0.00 60.65 58.50 1ubq s ILE 13 Cb -0.17 -2.65 -0.04 0.00 0.13 0.00 0.00 42.46 39.74 1ubq s ILE 13 CO 0.07 0.50 0.11 0.42 -1.91 0.00 0.00 174.94 174.14 1ubq s THR 14 N -0.92 5.26 0.14 4.00 -4.23 -1.26 -0.39 115.64 118.24 1ubq s THR 14 Ca 0.15 0.11 0.08 0.00 -1.18 0.00 0.00 61.69 60.85 1ubq s THR 14 Cb -0.11 -3.28 -0.04 0.00 1.34 0.00 0.00 72.50 70.41 1ubq s THR 14 CO 0.05 0.61 -0.17 -0.76 -0.54 0.00 0.00 174.62 173.81 1ubq s LEU 15 N -0.96 2.40 -0.21 4.79 1.02 -0.68 -4.99 118.68 120.05 1ubq s LEU 15 Ca 0.14 -0.81 -0.04 0.00 0.02 0.00 0.00 54.13 53.45 1ubq s LEU 15 Cb -0.12 -0.75 -0.01 0.00 0.02 0.00 0.00 46.19 45.33 1ubq s LEU 15 CO 0.04 -0.05 -0.05 -1.61 0.02 0.00 0.00 176.35 174.70 1ubq s GLU 16 N -2.58 3.40 0.22 1.70 2.02 -1.26 -1.68 118.70 120.52 1ubq s GLU 16 Ca 0.12 -0.62 -0.00 0.00 0.02 0.00 0.00 54.97 54.49 1ubq s GLU 16 Cb -0.06 -2.99 -0.04 0.00 0.10 0.00 0.00 34.13 31.14 1ubq s GLU 16 CO 0.05 -0.15 0.13 0.14 0.02 0.00 0.00 175.26 175.46 1ubq s VAL 17 N 1.35 0.09 0.05 2.63 -7.23 0.08 -4.92 120.40 112.46 1ubq s VAL 17 Ca 0.04 -2.00 0.09 0.00 -1.81 0.00 0.00 61.98 58.31 1ubq s VAL 17 Cb -0.14 -2.52 -0.03 0.00 0.56 0.00 0.00 36.38 34.25 1ubq s VAL 17 CO -0.02 0.00 -0.26 -1.61 -0.31 0.00 0.00 175.10 172.89 1ubq s GLU 18 N -4.09 1.79 0.61 4.82 0.41 -1.26 0.13 118.70 121.10 1ubq s GLU 18 Ca 0.39 -1.12 0.30 0.00 -0.41 0.00 0.00 54.97 54.13 1ubq s GLU 18 Cb 0.07 -1.97 1.63 0.00 -1.78 0.00 0.00 34.13 32.08 1ubq s GLU 18 CO 0.13 0.51 2.02 -1.35 -0.49 0.00 0.00 175.26 176.08 1ubq h PRO 19 N 4.77 0.00 0.00 0.39 0.11 -1.96 0.14 132.00 135.45 1ubq h PRO 19 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1ubq h PRO 19 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1ubq h PRO 19 CO 0.43 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.09 1ubq n SER 20 N -3.59 0.00 -4.78 -2.05 3.41 -1.26 -0.67 113.62 104.69 1ubq n SER 20 Ca 0.03 0.22 -0.36 0.00 -0.26 0.00 0.00 58.87 58.50 1ubq n SER 20 Cb 0.43 -0.41 -0.01 0.00 -0.26 0.00 0.00 64.21 63.96 1ubq n SER 20 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1ubq s ASP 21 N -2.81 6.06 0.56 4.04 1.01 0.50 -4.82 116.67 121.20 1ubq s ASP 21 Ca 0.20 2.17 -0.08 0.00 0.71 0.00 0.00 52.55 55.55 1ubq s ASP 21 Cb 0.19 -2.59 -0.03 0.00 1.01 0.00 0.00 42.92 41.50 1ubq s ASP 21 CO 0.50 -0.99 0.91 0.42 0.21 0.00 0.00 175.17 176.22 1ubq s THR 22 N -1.72 4.70 0.31 -1.27 -4.23 -1.26 -1.41 115.64 110.76 1ubq s THR 22 Ca 0.68 0.50 -0.01 0.00 -1.18 0.00 0.00 61.69 61.68 1ubq s THR 22 Cb -0.24 -3.83 0.22 0.00 1.34 0.00 0.00 72.50 69.99 1ubq s THR 22 CO 0.28 -0.95 1.93 0.40 -0.54 0.00 0.00 174.62 175.74 1ubq h ILE 23 N -0.07 1.20 -0.97 2.99 1.08 -0.84 -1.97 117.51 118.93 1ubq h ILE 23 Ca -0.45 -0.51 0.06 0.00 -0.39 0.00 0.00 64.86 63.56 1ubq h ILE 23 Cb 1.20 0.30 -0.06 0.00 -3.07 0.00 0.00 36.82 35.19 1ubq h ILE 23 CO 0.62 0.23 0.62 -0.08 -0.69 0.00 0.00 178.15 178.84 1ubq h GLU 24 N 0.93 1.11 -0.37 2.37 4.81 -1.35 -1.35 114.58 120.73 1ubq h GLU 24 Ca 0.24 -0.07 -0.05 0.00 -0.13 0.00 0.00 59.36 59.35 1ubq h GLU 24 Cb 0.03 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.14 1ubq h GLU 24 CO -0.04 0.74 0.04 -0.97 -0.73 0.00 0.00 179.01 178.05 1ubq h ASN 25 N 1.14 0.60 -0.41 1.04 -1.24 -1.66 -2.03 115.58 113.02 1ubq h ASN 25 Ca 0.41 -0.27 0.03 0.00 0.71 0.00 0.00 56.30 57.17 1ubq h ASN 25 Cb 0.13 -0.16 -0.03 0.00 0.73 0.00 0.00 38.32 38.99 1ubq h ASN 25 CO -0.16 0.72 0.22 0.58 -1.29 0.00 0.00 177.43 177.51 1ubq h VAL 26 N 0.45 1.01 -0.76 2.57 2.07 -1.01 -0.64 116.25 119.94 1ubq h VAL 26 Ca 0.11 -0.16 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 1ubq h VAL 26 Cb 0.39 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 30.64 1ubq h VAL 26 CO 0.01 0.08 0.46 0.11 0.02 0.00 0.00 177.57 178.25 1ubq h LYS 27 N 0.45 1.03 -0.50 1.57 1.57 -1.11 -1.03 116.57 118.56 1ubq h LYS 27 Ca 0.17 -0.09 -0.09 0.00 -1.87 0.00 0.00 60.65 58.77 1ubq h LYS 27 Cb 0.05 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 1ubq h LYS 27 CO -0.10 0.73 -0.05 0.00 -0.57 0.00 0.00 179.45 179.46 1ubq h ALA 28 N 1.45 0.96 -0.54 3.86 0.00 -0.72 -0.67 119.26 123.61 1ubq h ALA 28 Ca 0.27 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1ubq h ALA 28 Cb -0.04 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1ubq h ALA 28 CO -0.05 0.62 0.10 0.87 0.00 0.00 0.00 179.25 180.79 1ubq h LYS 29 N 0.81 0.85 -0.36 0.00 1.57 -0.28 0.16 116.57 119.32 1ubq h LYS 29 Ca 0.14 -0.19 -0.16 0.00 -1.87 0.00 0.00 60.65 58.57 1ubq h LYS 29 Cb 0.55 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.74 1ubq h LYS 29 CO 0.03 0.78 -0.41 0.82 -0.57 0.00 0.00 179.45 180.10 1ubq h ILE 30 N 0.81 1.27 -0.12 1.86 2.04 -0.97 -0.49 117.51 121.92 1ubq h ILE 30 Ca 0.17 -1.59 -0.00 0.00 1.00 0.00 0.00 64.86 64.44 1ubq h ILE 30 Cb 0.34 1.43 -0.01 0.00 -0.74 0.00 0.00 36.82 37.85 1ubq h ILE 30 CO 0.00 0.53 0.06 -0.61 0.00 0.00 0.00 178.15 178.13 1ubq h GLN 31 N 0.73 0.17 -0.89 2.37 4.15 -0.72 -0.49 115.11 120.42 1ubq h GLN 31 Ca 0.05 -0.02 0.13 0.00 0.77 0.00 0.00 58.65 59.58 1ubq h GLN 31 Cb 1.00 -0.03 -0.09 0.00 0.21 0.00 0.00 27.48 28.58 1ubq h GLN 31 CO 0.10 0.22 0.50 0.22 -1.93 0.00 0.00 178.83 177.94 1ubq h ASP 32 N 0.08 0.67 0.50 -0.69 3.58 -0.79 0.26 116.42 120.04 1ubq h ASP 32 Ca 0.04 0.07 -0.14 0.00 0.42 0.00 0.00 57.03 57.42 1ubq h ASP 32 Cb 0.10 -0.05 -0.03 0.00 1.72 0.00 0.00 39.33 41.08 1ubq h ASP 32 CO -0.01 0.33 -1.62 2.29 -2.88 0.00 0.00 179.24 177.35 1ubq n LYS 33 N -4.78 0.64 0.00 0.28 2.85 -0.21 -4.53 118.16 112.41 1ubq n LYS 33 Ca 0.17 0.09 0.00 0.00 -1.05 0.00 0.00 58.31 57.52 1ubq n LYS 33 Cb 0.39 -1.71 0.00 0.00 -0.65 0.00 0.00 35.03 33.06 1ubq n LYS 33 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1ubq n GLU 34 N -2.71 3.35 -0.94 -1.58 -0.58 -0.22 -5.03 120.64 112.93 1ubq n GLU 34 Ca -0.11 -0.15 0.00 0.00 -0.42 0.00 0.00 57.16 56.48 1ubq n GLU 34 Cb 0.79 -0.59 0.00 0.00 -0.57 0.00 0.00 31.44 31.07 1ubq n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ubq n GLY 35 N 0.52 0.74 3.68 0.62 0.00 0.93 -5.00 105.19 106.67 1ubq n GLY 35 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1ubq n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ubq s ILE 36 N -2.88 4.74 0.30 -0.61 1.01 -1.26 -4.95 121.20 117.56 1ubq s ILE 36 Ca 0.00 2.02 -0.30 0.00 0.00 0.00 0.00 60.65 62.37 1ubq s ILE 36 Cb 0.00 -4.30 -0.12 0.00 0.01 0.00 0.00 42.46 38.05 1ubq s ILE 36 CO 0.00 -0.01 1.44 -2.65 0.00 0.00 0.00 174.94 173.71 1ubq n PRO 37 N 5.15 2.33 0.02 2.79 -0.02 -1.26 -3.87 135.00 140.13 1ubq n PRO 37 Ca 0.09 0.82 0.12 0.00 -2.02 0.00 0.00 63.50 62.51 1ubq n PRO 37 Cb 0.48 -2.50 0.56 0.00 -0.02 0.00 0.00 33.50 32.02 1ubq n PRO 37 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1ubq h PRO 38 N 3.75 0.25 0.00 0.52 0.11 -1.94 -1.07 132.00 133.62 1ubq h PRO 38 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1ubq h PRO 38 Cb 1.26 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1ubq h PRO 38 CO 0.72 0.16 0.00 0.22 -0.21 0.00 0.00 178.00 178.89 1ubq h ASP 39 N 0.25 0.00 0.22 -2.05 1.82 -1.97 -2.17 116.42 112.53 1ubq h ASP 39 Ca 0.20 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.84 1ubq h ASP 39 Cb 0.46 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.47 1ubq h ASP 39 CO -0.04 0.00 -0.83 0.00 -1.61 0.00 0.00 179.24 176.76 1ubq n GLN 40 N -2.38 0.03 -2.95 0.28 6.02 -0.41 -4.84 117.38 113.13 1ubq n GLN 40 Ca 0.01 -0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.60 1ubq n GLN 40 Cb 0.21 -1.51 -0.04 0.00 1.02 0.00 0.00 30.24 29.92 1ubq n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1ubq s GLN 41 N -3.02 4.46 -0.20 -1.09 -0.21 -0.82 0.07 119.66 118.85 1ubq s GLN 41 Ca 0.09 1.02 0.01 0.00 0.02 0.00 0.00 55.36 56.50 1ubq s GLN 41 Cb 0.16 -3.46 0.04 0.00 1.00 0.00 0.00 33.01 30.75 1ubq s GLN 41 CO 0.80 0.02 -0.15 0.50 -2.12 0.00 0.00 175.29 174.34 1ubq s ARG 42 N 0.91 2.52 -0.18 2.91 3.52 0.30 -4.94 118.95 123.99 1ubq s ARG 42 Ca 0.41 -0.96 -0.07 0.00 -0.13 0.00 0.00 55.73 54.97 1ubq s ARG 42 Cb -0.18 -2.60 -0.04 0.00 -1.56 0.00 0.00 34.95 30.57 1ubq s ARG 42 CO 0.20 -0.36 0.06 -0.51 -0.81 0.00 0.00 175.30 173.89 1ubq s LEU 43 N 1.27 3.84 -0.08 -0.88 1.43 -1.26 -0.50 118.68 122.50 1ubq s LEU 43 Ca -0.00 0.09 0.04 0.00 -1.03 0.00 0.00 54.13 53.23 1ubq s LEU 43 Cb -0.16 -1.97 -0.00 0.00 0.03 0.00 0.00 46.19 44.09 1ubq s LEU 43 CO -0.09 0.18 -0.22 -0.63 0.23 0.00 0.00 176.35 175.82 1ubq s ILE 44 N 0.32 1.84 -0.08 -0.59 -1.09 0.50 -0.60 121.20 121.50 1ubq s ILE 44 Ca 0.03 -0.91 -0.03 0.00 -2.23 0.00 0.00 60.65 57.51 1ubq s ILE 44 Cb -0.12 -1.59 0.04 0.00 -1.58 0.00 0.00 42.46 39.21 1ubq s ILE 44 CO 0.00 0.51 0.17 0.12 -1.23 0.00 0.00 174.94 174.51 1ubq s PHE 45 N 0.24 -0.21 -1.51 3.97 5.36 -0.73 -0.39 117.98 124.71 1ubq s PHE 45 Ca -0.13 0.56 -0.07 0.00 -0.96 0.00 0.00 56.93 56.33 1ubq s PHE 45 Cb -0.16 -0.06 0.06 0.00 -0.34 0.00 0.00 43.02 42.52 1ubq s PHE 45 CO 0.06 -0.19 0.58 0.00 -1.46 0.00 0.00 175.22 174.22 1ubq n ALA 46 N 4.26 -1.71 -1.69 11.12 0.00 -1.26 -0.64 120.51 130.59 1ubq n ALA 46 Ca -0.26 -0.15 -0.19 0.00 0.00 0.00 0.00 53.44 52.85 1ubq n ALA 46 Cb 0.52 -2.38 -0.07 0.00 0.00 0.00 0.00 19.45 17.52 1ubq n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ubq n GLY 47 N -1.78 1.49 3.47 0.00 0.00 -1.26 -5.01 105.19 102.11 1ubq n GLY 47 Ca -0.16 -0.09 -0.32 0.00 0.00 0.00 0.00 46.02 45.45 1ubq n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ubq s LYS 48 N -3.84 2.29 -0.05 1.61 1.02 0.18 -5.10 119.74 115.85 1ubq s LYS 48 Ca 0.00 -0.84 -0.24 0.00 0.02 0.00 0.00 55.97 54.91 1ubq s LYS 48 Cb 0.00 -2.29 -0.04 0.00 -0.52 0.00 0.00 37.83 34.99 1ubq s LYS 48 CO 0.00 0.58 0.73 -1.14 -0.92 0.00 0.00 175.35 174.60 1ubq s GLN 49 N -1.11 4.45 0.20 1.68 0.74 -1.26 -1.77 119.66 122.60 1ubq s GLN 49 Ca 0.13 0.95 -0.30 0.00 0.05 0.00 0.00 55.36 56.19 1ubq s GLN 49 Cb -0.11 -3.44 -0.08 0.00 1.10 0.00 0.00 33.01 30.48 1ubq s GLN 49 CO 0.03 0.07 0.96 -0.51 -0.55 0.00 0.00 175.29 175.29 1ubq s LEU 50 N 0.77 4.60 -0.11 3.68 1.43 0.23 -4.99 118.68 124.27 1ubq s LEU 50 Ca 0.39 1.93 -0.06 0.00 -1.03 0.00 0.00 54.13 55.36 1ubq s LEU 50 Cb -0.18 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 42.40 1ubq s LEU 50 CO 0.19 0.07 0.10 -0.70 0.23 0.00 0.00 176.35 176.25 1ubq s GLU 51 N -0.83 3.32 0.29 1.70 2.12 -1.26 -4.69 118.70 119.36 1ubq s GLU 51 Ca 0.43 -0.20 0.05 0.00 0.36 0.00 0.00 54.97 55.60 1ubq s GLU 51 Cb -0.26 -3.09 0.75 0.00 0.26 0.00 0.00 34.13 31.80 1ubq s GLU 51 CO 0.32 0.76 1.70 -0.44 -0.54 0.00 0.00 175.26 177.06 1ubq h ASP 52 N 5.03 0.40 0.76 -1.70 3.45 -1.97 -2.78 116.42 119.61 1ubq h ASP 52 Ca -0.54 0.15 0.00 0.00 0.43 0.00 0.00 57.03 57.07 1ubq h ASP 52 Cb 1.22 0.11 0.00 0.00 -0.56 0.00 0.00 39.33 40.10 1ubq h ASP 52 CO 0.57 0.02 -0.13 0.61 -1.57 0.00 0.00 179.24 178.74 1ubq n GLY 53 N -1.33 -1.35 3.92 2.75 0.00 -1.26 -1.05 105.19 106.87 1ubq n GLY 53 Ca 0.23 -0.18 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 1ubq n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ubq s ARG 54 N -2.89 2.81 0.33 1.61 1.81 -1.05 -4.87 118.95 116.70 1ubq s ARG 54 Ca 0.17 0.01 0.07 0.00 -1.72 0.00 0.00 55.73 54.26 1ubq s ARG 54 Cb 0.19 -2.23 -0.02 0.00 -0.45 0.00 0.00 34.95 32.44 1ubq s ARG 54 CO 0.56 -0.81 0.33 0.95 -0.68 0.00 0.00 175.30 175.64 1ubq s THR 55 N -3.07 3.78 0.33 0.02 -4.23 -1.26 -0.79 115.64 110.42 1ubq s THR 55 Ca 0.55 -1.27 0.02 0.00 -1.18 0.00 0.00 61.69 59.81 1ubq s THR 55 Cb -0.11 -3.27 0.23 0.00 1.34 0.00 0.00 72.50 70.69 1ubq s THR 55 CO 0.46 -0.19 1.96 -0.07 -0.54 0.00 0.00 174.62 176.24 1ubq h LEU 56 N 1.18 0.71 -1.64 4.79 3.38 -0.98 -2.17 115.31 120.58 1ubq h LEU 56 Ca -0.45 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.42 1ubq h LEU 56 Cb 1.25 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 1ubq h LEU 56 CO 0.57 0.58 -0.19 0.77 0.09 0.00 0.00 178.44 180.26 1ubq h SER 57 N 0.80 0.00 -0.97 -0.43 4.64 -1.17 -2.10 113.55 114.32 1ubq h SER 57 Ca 0.21 0.00 0.10 0.00 -0.47 0.00 0.00 61.79 61.63 1ubq h SER 57 Cb 0.03 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.05 1ubq h SER 57 CO -0.03 0.19 0.62 0.44 -0.87 0.00 0.00 176.83 177.17 1ubq h ASP 58 N 0.00 0.91 -0.20 4.97 3.45 -1.66 -0.13 116.42 123.75 1ubq h ASP 58 Ca -0.00 0.03 0.00 0.00 0.43 0.00 0.00 57.03 57.49 1ubq h ASP 58 Cb 0.34 -0.15 0.00 0.00 -0.56 0.00 0.00 39.33 38.95 1ubq h ASP 58 CO 0.02 0.52 0.00 -1.22 -1.57 0.00 0.00 179.24 176.99 1ubq n TYR 59 N -4.56 0.26 -3.60 4.55 4.02 -0.81 -4.97 117.16 112.04 1ubq n TYR 59 Ca 0.17 -0.13 -0.22 0.00 -0.01 0.00 0.00 57.90 57.71 1ubq n TYR 59 Cb 0.31 0.00 0.07 0.00 -0.02 0.00 0.00 39.34 39.70 1ubq n TYR 59 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 1ubq n ASN 60 N 0.49 -3.69 -4.60 7.72 4.05 -0.06 -4.94 115.26 114.23 1ubq n ASN 60 Ca 0.16 -0.65 -0.42 0.00 0.45 0.00 0.00 54.58 54.12 1ubq n ASN 60 Cb 0.36 -4.73 -0.06 0.00 1.23 0.00 0.00 39.78 36.59 1ubq n ASN 60 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1ubq s ILE 61 N -3.39 4.85 0.41 -1.44 1.01 -1.15 -5.05 121.20 116.44 1ubq s ILE 61 Ca 0.29 0.93 0.08 0.00 0.00 0.00 0.00 60.65 61.95 1ubq s ILE 61 Cb -0.13 -4.09 -0.01 0.00 0.01 0.00 0.00 42.46 38.24 1ubq s ILE 61 CO 0.76 -0.25 0.46 -1.10 0.00 0.00 0.00 174.94 174.81 1ubq s GLN 62 N 2.82 2.70 0.42 2.79 -0.21 -1.26 -4.73 119.66 122.19 1ubq s GLN 62 Ca 0.28 -1.37 -0.25 0.00 0.02 0.00 0.00 55.36 54.05 1ubq s GLN 62 Cb -0.14 -2.57 -0.10 0.00 1.00 0.00 0.00 33.01 31.19 1ubq s GLN 62 CO 0.13 -0.20 1.15 0.36 -2.12 0.00 0.00 175.29 174.61 1ubq n LYS 63 N -1.68 1.64 -1.37 2.91 2.85 -1.26 -2.37 118.16 118.89 1ubq n LYS 63 Ca 0.05 0.59 -0.13 0.00 -1.05 0.00 0.00 58.31 57.77 1ubq n LYS 63 Cb 0.60 -2.22 -0.05 0.00 -0.65 0.00 0.00 35.03 32.71 1ubq n LYS 63 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1ubq n GLU 64 N 0.09 -0.99 -1.39 -1.58 1.02 0.55 -5.01 120.64 113.33 1ubq n GLU 64 Ca 0.08 0.93 -0.31 0.00 -0.02 0.00 0.00 57.16 57.84 1ubq n GLU 64 Cb 0.39 -5.00 0.08 0.00 -0.02 0.00 0.00 31.44 26.88 1ubq n GLU 64 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1ubq s SER 65 N -2.78 4.79 -0.13 1.62 0.01 -1.00 -4.73 113.70 111.47 1ubq s SER 65 Ca 0.00 1.79 0.02 0.00 1.31 0.00 0.00 55.95 59.07 1ubq s SER 65 Cb 0.00 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.72 1ubq s SER 65 CO 0.00 -1.85 -0.21 -0.89 0.41 0.00 0.00 173.24 170.70 1ubq s THR 66 N -2.89 2.20 0.15 1.44 2.01 -1.26 -0.76 115.64 116.54 1ubq s THR 66 Ca 0.61 -0.94 0.04 0.00 0.31 0.00 0.00 61.69 61.70 1ubq s THR 66 Cb -0.17 -1.88 -0.04 0.00 0.01 0.00 0.00 72.50 70.43 1ubq s THR 66 CO 0.54 0.55 0.20 -0.76 -0.69 0.00 0.00 174.62 174.46 1ubq s LEU 67 N 0.66 4.04 -0.13 4.42 1.43 0.29 -4.88 118.68 124.53 1ubq s LEU 67 Ca -0.10 0.01 -0.04 0.00 -1.03 0.00 0.00 54.13 52.97 1ubq s LEU 67 Cb -0.16 -2.64 -0.04 0.00 0.03 0.00 0.00 46.19 43.38 1ubq s LEU 67 CO 0.02 0.07 0.03 -1.00 0.23 0.00 0.00 176.35 175.69 1ubq s HIS 68 N -1.73 3.21 -0.29 0.29 3.76 0.47 -1.02 115.29 119.99 1ubq s HIS 68 Ca 0.32 0.12 -0.08 0.00 -0.15 0.00 0.00 55.06 55.28 1ubq s HIS 68 Cb -0.11 -1.91 -0.00 0.00 1.11 0.00 0.00 32.58 31.67 1ubq s HIS 68 CO 0.26 0.34 0.10 -1.17 -0.85 0.00 0.00 174.74 173.41 1ubq s LEU 69 N -0.36 3.86 -0.08 0.89 2.96 -0.29 -0.37 118.68 125.28 1ubq s LEU 69 Ca 0.08 -0.59 -0.01 0.00 -0.22 0.00 0.00 54.13 53.39 1ubq s LEU 69 Cb -0.12 -1.92 -0.03 0.00 0.50 0.00 0.00 46.19 44.62 1ubq s LEU 69 CO 0.02 -0.17 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.17 1ubq s VAL 70 N 1.55 4.11 -0.06 1.68 1.01 0.34 -3.85 120.40 125.17 1ubq s VAL 70 Ca 0.04 -0.33 -0.12 0.00 0.00 0.00 0.00 61.98 61.57 1ubq s VAL 70 Cb -0.17 -2.71 -0.05 0.00 0.00 0.00 0.00 36.38 33.45 1ubq s VAL 70 CO 0.04 0.60 0.30 -0.76 0.00 0.00 0.00 175.10 175.28 1ubq s LEU 71 N -0.85 4.42 -0.39 3.92 1.02 -1.26 -0.54 118.68 125.00 1ubq s LEU 71 Ca 0.13 0.73 0.02 0.00 0.02 0.00 0.00 54.13 55.03 1ubq s LEU 71 Cb -0.11 -2.38 0.11 0.00 0.02 0.00 0.00 46.19 43.83 1ubq s LEU 71 CO 0.02 0.33 0.13 -0.60 0.02 0.00 0.00 176.35 176.25 1ubq s ARG 72 N -0.87 1.72 0.37 1.70 3.52 0.11 -4.97 118.95 120.53 1ubq s ARG 72 Ca 0.20 -1.95 -0.17 0.00 -0.13 0.00 0.00 55.73 53.68 1ubq s ARG 72 Cb -0.15 -3.35 -0.09 0.00 -1.56 0.00 0.00 34.95 29.80 1ubq s ARG 72 CO 0.09 -1.00 0.82 -0.51 -0.81 0.00 0.00 175.30 173.88 1ubq s LEU 73 N 0.84 4.00 -0.74 -0.88 1.02 -1.26 -4.45 118.68 117.20 1ubq s LEU 73 Ca 0.11 1.42 -0.16 0.00 0.02 0.00 0.00 54.13 55.52 1ubq s LEU 73 Cb -0.21 -4.24 0.17 0.00 0.02 0.00 0.00 46.19 41.93 1ubq s LEU 73 CO -0.06 -0.28 0.75 -0.60 0.02 0.00 0.00 176.35 176.18 1ubq s ARG 74 N -3.13 3.38 0.00 1.70 3.52 -1.26 -4.86 118.95 118.30 1ubq s ARG 74 Ca 0.57 -2.01 0.00 0.00 -0.13 0.00 0.00 55.73 54.16 1ubq s ARG 74 Cb -0.10 -4.44 0.00 0.00 -1.56 0.00 0.00 34.95 28.85 1ubq s ARG 74 CO 0.17 -1.41 0.00 0.41 -0.81 0.00 0.00 175.30 173.66 1ubq n GLY 75 N 4.68 3.73 0.00 8.12 0.00 -1.26 -5.25 105.19 115.20 1ubq n GLY 75 Ca 0.05 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.88 1ubq n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93