#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dx5 s GLN 2 N 0.00 1.22 0.43 3.17 -2.07 -1.26 0.56 119.66 121.71 2dx5 s GLN 2 Ca 0.00 -0.20 0.08 0.00 -1.82 0.00 0.00 55.36 53.42 2dx5 s GLN 2 Cb 0.00 -1.20 -0.02 0.00 -1.09 0.00 0.00 33.01 30.70 2dx5 s GLN 2 CO 0.00 -0.13 0.38 0.96 -1.32 0.00 0.00 175.29 175.18 2dx5 s ILE 3 N 1.19 2.57 -0.04 3.63 -0.00 0.27 -2.31 121.20 126.51 2dx5 s ILE 3 Ca -0.06 -1.36 0.04 0.00 -0.00 0.00 0.00 60.65 59.27 2dx5 s ILE 3 Cb -0.14 -2.93 -0.00 0.00 -0.00 0.00 0.00 42.46 39.38 2dx5 s ILE 3 CO -0.02 0.00 -0.16 -0.36 -0.00 0.00 0.00 174.94 174.40 2dx5 s PHE 4 N -2.50 1.66 -0.32 1.37 0.40 -1.03 -0.22 117.98 117.34 2dx5 s PHE 4 Ca 0.47 -0.48 0.00 0.00 -0.60 0.00 0.00 56.93 56.33 2dx5 s PHE 4 Cb -0.03 -1.12 0.07 0.00 0.51 0.00 0.00 43.02 42.45 2dx5 s PHE 4 CO 0.27 -0.17 0.02 0.08 0.70 0.00 0.00 175.22 176.13 2dx5 s VAL 5 N 0.07 2.73 0.17 -0.44 1.01 -0.95 -0.54 120.40 122.46 2dx5 s VAL 5 Ca -0.04 -1.75 -0.25 0.00 0.00 0.00 0.00 61.98 59.94 2dx5 s VAL 5 Cb -0.11 -2.72 -0.08 0.00 0.00 0.00 0.00 36.38 33.47 2dx5 s VAL 5 CO 0.02 -0.29 0.78 -0.75 0.00 0.00 0.00 175.10 174.86 2dx5 s LYS 6 N 1.13 4.55 0.37 2.72 2.20 -0.45 -2.06 119.74 128.21 2dx5 s LYS 6 Ca -0.01 1.15 0.06 0.00 -0.36 0.00 0.00 55.97 56.81 2dx5 s LYS 6 Cb -0.20 -3.23 -0.00 0.00 -1.51 0.00 0.00 37.83 32.89 2dx5 s LYS 6 CO -0.04 0.56 0.52 0.95 -0.36 0.00 0.00 175.35 176.98 2dx5 s THR 7 N -1.18 3.74 -1.03 3.43 -4.23 0.99 -0.41 115.64 116.95 2dx5 s THR 7 Ca 0.36 -0.95 0.00 0.00 -1.18 0.00 0.00 61.69 59.92 2dx5 s THR 7 Cb -0.23 -3.29 0.00 0.00 1.34 0.00 0.00 72.50 70.32 2dx5 s THR 7 CO 0.26 -0.12 0.40 0.18 -0.54 0.00 0.00 174.62 174.79 2dx5 n LEU 8 N -1.75 0.74 -0.00 4.79 4.77 -1.26 -1.18 117.00 123.12 2dx5 n LEU 8 Ca 0.02 -0.37 0.07 0.00 -0.03 0.00 0.00 56.01 55.70 2dx5 n LEU 8 Cb 0.58 -0.37 -0.09 0.00 -2.33 0.00 0.00 43.42 41.21 2dx5 n LEU 8 CO 0.42 0.19 -0.37 0.35 -1.33 0.00 0.00 177.39 176.65 2dx5 n THR 9 N 0.10 0.00 -0.03 -5.08 -2.24 -1.26 -4.94 114.28 100.83 2dx5 n THR 9 Ca 0.00 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 2dx5 n THR 9 Cb 0.19 0.57 0.00 0.00 -2.10 0.00 0.00 70.33 68.98 2dx5 n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dx5 n GLY 10 N 1.52 0.87 3.77 3.38 0.00 -0.32 -5.06 105.19 109.36 2dx5 n GLY 10 Ca -0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 2dx5 n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2dx5 s LYS 11 N -0.97 4.65 -0.11 1.61 2.36 -1.24 -4.83 119.74 121.20 2dx5 s LYS 11 Ca 0.00 1.37 0.03 0.00 -2.55 0.00 0.00 55.97 54.82 2dx5 s LYS 11 Cb 0.00 -2.92 0.01 0.00 -1.05 0.00 0.00 37.83 33.87 2dx5 s LYS 11 CO 0.00 0.34 -0.20 0.99 1.55 0.00 0.00 175.35 178.03 2dx5 s THR 12 N -1.51 1.87 -0.31 3.43 2.01 -1.26 -0.00 115.64 119.86 2dx5 s THR 12 Ca 0.48 -0.88 -0.11 0.00 0.31 0.00 0.00 61.69 61.49 2dx5 s THR 12 Cb -0.20 -1.65 -0.02 0.00 0.01 0.00 0.00 72.50 70.64 2dx5 s THR 12 CO 0.26 0.51 0.18 -0.63 -0.69 0.00 0.00 174.62 174.26 2dx5 s ILE 13 N 0.68 4.92 -0.43 1.82 -1.09 -0.87 -4.95 121.20 121.27 2dx5 s ILE 13 Ca -0.12 -0.25 -0.25 0.00 -2.23 0.00 0.00 60.65 57.80 2dx5 s ILE 13 Cb -0.16 -3.48 0.02 0.00 -1.58 0.00 0.00 42.46 37.26 2dx5 s ILE 13 CO 0.02 0.08 0.90 0.42 -1.23 0.00 0.00 174.94 175.14 2dx5 s THR 14 N 1.67 4.53 -0.14 2.92 -4.23 -1.26 -2.24 115.64 116.90 2dx5 s THR 14 Ca 0.06 0.84 -0.02 0.00 -1.18 0.00 0.00 61.69 61.38 2dx5 s THR 14 Cb -0.17 -4.38 -0.02 0.00 1.34 0.00 0.00 72.50 69.27 2dx5 s THR 14 CO 0.08 -0.72 -0.07 -0.76 -0.54 0.00 0.00 174.62 172.62 2dx5 s LEU 15 N 3.60 3.10 -0.28 4.79 1.43 0.69 -4.97 118.68 127.03 2dx5 s LEU 15 Ca 0.36 -0.17 -0.17 0.00 -1.03 0.00 0.00 54.13 53.12 2dx5 s LEU 15 Cb -0.11 -1.73 -0.03 0.00 0.03 0.00 0.00 46.19 44.36 2dx5 s LEU 15 CO 0.23 0.19 0.48 -1.83 0.23 0.00 0.00 176.35 175.66 2dx5 s GLU 16 N 0.23 3.97 0.33 1.70 1.03 -1.26 0.95 118.70 125.66 2dx5 s GLU 16 Ca -0.04 0.17 0.02 0.00 0.03 0.00 0.00 54.97 55.14 2dx5 s GLU 16 Cb -0.14 -3.68 -0.01 0.00 -0.80 0.00 0.00 34.13 29.49 2dx5 s GLU 16 CO 0.04 -0.39 0.37 0.14 -1.33 0.00 0.00 175.26 174.09 2dx5 s VAL 17 N 2.27 0.00 0.20 1.83 -7.23 0.19 -4.96 120.40 112.71 2dx5 s VAL 17 Ca 0.19 -1.79 0.08 0.00 -1.81 0.00 0.00 61.98 58.65 2dx5 s VAL 17 Cb -0.16 -2.57 -0.05 0.00 0.56 0.00 0.00 36.38 34.16 2dx5 s VAL 17 CO 0.10 0.00 -0.14 -1.61 -0.31 0.00 0.00 175.10 173.14 2dx5 s GLU 18 N -3.27 1.32 0.49 4.82 0.41 -1.26 -2.07 118.70 119.14 2dx5 s GLU 18 Ca 0.35 -1.59 0.25 0.00 -0.41 0.00 0.00 54.97 53.57 2dx5 s GLU 18 Cb 0.01 -1.11 1.24 0.00 -1.78 0.00 0.00 34.13 32.50 2dx5 s GLU 18 CO 0.23 0.18 1.99 -1.35 -0.49 0.00 0.00 175.26 175.83 2dx5 h PRO 19 N 2.56 0.00 0.00 0.39 0.11 -1.97 -1.27 132.00 131.83 2dx5 h PRO 19 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 2dx5 h PRO 19 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2dx5 h PRO 19 CO 0.62 0.17 0.00 -1.13 -0.21 0.00 0.00 178.00 177.45 2dx5 n SER 20 N -3.65 0.00 -4.76 -2.05 3.41 -1.26 -2.41 113.62 102.90 2dx5 n SER 20 Ca -0.01 0.02 -0.40 0.00 -0.26 0.00 0.00 58.87 58.21 2dx5 n SER 20 Cb 0.30 -0.29 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 2dx5 n SER 20 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2dx5 s ASP 21 N -2.59 6.98 0.44 4.04 1.11 -0.48 -4.86 116.67 121.31 2dx5 s ASP 21 Ca 0.19 2.38 0.01 0.00 0.18 0.00 0.00 52.55 55.31 2dx5 s ASP 21 Cb 0.14 -2.63 -0.00 0.00 1.07 0.00 0.00 42.92 41.49 2dx5 s ASP 21 CO 0.31 -0.36 0.65 0.42 1.18 0.00 0.00 175.17 177.37 2dx5 s THR 22 N -1.23 3.99 0.17 -1.27 -4.23 -1.26 -0.73 115.64 111.08 2dx5 s THR 22 Ca 0.49 -0.56 -0.11 0.00 -1.18 0.00 0.00 61.69 60.33 2dx5 s THR 22 Cb -0.33 -3.46 0.06 0.00 1.34 0.00 0.00 72.50 70.10 2dx5 s THR 22 CO 0.43 -0.31 1.65 0.40 -0.54 0.00 0.00 174.62 176.25 2dx5 h ILE 23 N 0.45 1.26 -0.19 2.99 1.08 -1.51 -1.85 117.51 119.74 2dx5 h ILE 23 Ca -0.46 -1.03 -0.09 0.00 -0.39 0.00 0.00 64.86 62.88 2dx5 h ILE 23 Cb 1.25 0.79 -0.01 0.00 -3.07 0.00 0.00 36.82 35.79 2dx5 h ILE 23 CO 0.57 0.38 -0.29 1.05 -0.69 0.00 0.00 178.15 179.16 2dx5 h GLU 24 N 0.88 0.38 -0.50 2.37 9.09 -1.89 -0.74 114.58 124.16 2dx5 h GLU 24 Ca 0.17 -0.15 0.02 0.00 0.05 0.00 0.00 59.36 59.45 2dx5 h GLU 24 Cb 0.46 -0.02 -0.03 0.00 -1.65 0.00 0.00 28.75 27.51 2dx5 h GLU 24 CO 0.02 0.64 0.31 -0.91 0.05 0.00 0.00 179.01 179.12 2dx5 h ASN 25 N 0.33 0.52 -0.80 3.06 2.35 -1.83 -0.20 115.58 119.02 2dx5 h ASN 25 Ca 0.05 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 2dx5 h ASN 25 Cb 0.69 -0.12 -0.04 0.00 0.05 0.00 0.00 38.32 38.90 2dx5 h ASN 25 CO 0.05 0.37 0.52 0.58 -1.65 0.00 0.00 177.43 177.30 2dx5 h VAL 26 N 0.63 1.21 0.00 2.81 2.07 -0.74 0.66 116.25 122.89 2dx5 h VAL 26 Ca 0.20 -0.40 0.00 0.00 0.82 0.00 0.00 66.70 67.31 2dx5 h VAL 26 Cb -0.02 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 29.79 2dx5 h VAL 26 CO -0.07 0.21 0.00 0.11 0.02 0.00 0.00 177.57 177.84 2dx5 h LYS 27 N 1.09 0.00 -0.11 1.57 1.57 0.38 -2.26 116.57 118.82 2dx5 h LYS 27 Ca 0.29 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.93 2dx5 h LYS 27 Cb -0.11 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.21 2dx5 h LYS 27 CO -0.06 0.00 -0.50 0.00 -0.57 0.00 0.00 179.45 178.32 2dx5 h ALA 28 N 2.06 0.20 0.06 3.86 0.00 0.73 -2.30 119.26 123.87 2dx5 h ALA 28 Ca 0.00 -0.50 0.01 0.00 0.00 0.00 0.00 54.91 54.41 2dx5 h ALA 28 Cb 0.51 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2dx5 h ALA 28 CO 0.00 0.39 -0.10 0.87 0.00 0.00 0.00 179.25 180.41 2dx5 h LYS 29 N 0.13 -0.19 -0.59 0.00 1.79 -0.94 -0.77 116.57 116.00 2dx5 h LYS 29 Ca -0.03 0.01 0.08 0.00 -2.18 0.00 0.00 60.65 58.53 2dx5 h LYS 29 Cb 1.14 0.04 -0.10 0.00 -1.58 0.00 0.00 32.23 31.74 2dx5 h LYS 29 CO 0.10 -0.13 -0.48 0.82 -1.08 0.00 0.00 179.45 178.69 2dx5 h ILE 30 N -0.20 0.06 0.00 1.86 1.08 -1.39 0.11 117.51 119.03 2dx5 h ILE 30 Ca 0.02 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.46 2dx5 h ILE 30 Cb 0.22 0.06 -0.00 0.00 -3.07 0.00 0.00 36.82 34.02 2dx5 h ILE 30 CO -0.06 0.00 -0.13 -0.61 -0.69 0.00 0.00 178.15 176.66 2dx5 h GLN 31 N -0.24 0.00 0.00 2.37 4.15 -1.15 -0.04 115.11 120.20 2dx5 h GLN 31 Ca 0.16 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.58 2dx5 h GLN 31 Cb 0.56 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.25 2dx5 h GLN 31 CO -0.70 0.13 0.00 -0.25 -1.93 0.00 0.00 178.83 176.09 2dx5 n ASP 32 N -3.82 0.00 0.00 -0.69 8.00 0.38 -3.27 116.55 117.15 2dx5 n ASP 32 Ca -0.02 -1.63 0.00 0.00 0.71 0.00 0.00 54.79 53.85 2dx5 n ASP 32 Cb 0.23 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.33 2dx5 n ASP 32 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 2dx5 n LYS 33 N -0.58 0.00 0.00 -1.24 2.85 -0.93 -4.96 118.16 113.31 2dx5 n LYS 33 Ca 0.03 -0.04 0.00 0.00 -1.05 0.00 0.00 58.31 57.25 2dx5 n LYS 33 Cb 0.01 -0.10 0.00 0.00 -0.65 0.00 0.00 35.03 34.30 2dx5 n LYS 33 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2dx5 n GLU 34 N 0.00 1.46 0.00 -1.58 -0.58 -0.07 -5.04 120.64 114.83 2dx5 n GLU 34 Ca 0.00 -0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.73 2dx5 n GLU 34 Cb 0.36 -0.14 0.00 0.00 -0.57 0.00 0.00 31.44 31.09 2dx5 n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2dx5 n GLY 35 N 0.21 2.31 3.65 0.62 0.00 -1.20 -5.00 105.19 105.77 2dx5 n GLY 35 Ca 0.00 -0.48 -0.65 0.00 0.00 0.00 0.00 46.02 44.89 2dx5 n GLY 35 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2dx5 n ILE 36 N 0.00 0.04 -2.07 -0.61 5.41 -1.26 -4.88 119.36 115.99 2dx5 n ILE 36 Ca 0.00 -0.01 -0.37 0.00 1.00 0.00 0.00 62.75 63.37 2dx5 n ILE 36 Cb 0.00 -0.60 0.01 0.00 -0.71 0.00 0.00 39.64 38.34 2dx5 n ILE 36 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 2dx5 s PRO 37 N 3.67 3.46 0.60 0.38 0.02 -1.26 -4.09 135.00 137.77 2dx5 s PRO 37 Ca 1.07 1.93 0.36 0.00 0.02 0.00 0.00 61.00 64.38 2dx5 s PRO 37 Cb -1.44 -2.29 1.90 0.00 0.02 0.00 0.00 34.50 32.69 2dx5 s PRO 37 CO 0.77 -0.84 2.21 -1.35 -0.33 0.00 0.00 177.00 177.45 2dx5 h PRO 38 N 1.70 0.00 -0.29 5.54 0.11 -1.91 -2.40 132.00 134.75 2dx5 h PRO 38 Ca -0.50 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.59 2dx5 h PRO 38 Cb 1.27 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.37 2dx5 h PRO 38 CO 0.59 0.03 0.08 0.22 -0.21 0.00 0.00 178.00 178.71 2dx5 h ASP 39 N 0.00 0.37 0.40 -2.05 -0.00 -1.98 -2.78 116.42 110.38 2dx5 h ASP 39 Ca -0.00 -0.04 0.00 0.00 -0.00 0.00 0.00 57.03 56.99 2dx5 h ASP 39 Cb 0.19 -0.09 0.00 0.00 -0.00 0.00 0.00 39.33 39.42 2dx5 h ASP 39 CO 0.00 0.36 -1.19 0.00 -0.00 0.00 0.00 179.24 178.42 2dx5 n GLN 40 N -4.39 0.37 -2.26 0.28 1.13 -0.92 -4.91 117.38 106.68 2dx5 n GLN 40 Ca 0.01 -0.02 -0.33 0.00 -1.94 0.00 0.00 57.00 54.72 2dx5 n GLN 40 Cb 0.15 -1.60 -0.01 0.00 0.11 0.00 0.00 30.24 28.89 2dx5 n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 2dx5 s GLN 41 N -3.26 3.60 -0.40 -1.09 -0.21 -1.05 -1.63 119.66 115.62 2dx5 s GLN 41 Ca 0.01 1.18 0.05 0.00 0.02 0.00 0.00 55.36 56.63 2dx5 s GLN 41 Cb 0.14 -2.07 0.17 0.00 1.00 0.00 0.00 33.01 32.24 2dx5 s GLN 41 CO 0.82 -0.58 0.50 1.03 -2.12 0.00 0.00 175.29 174.95 2dx5 s ARG 42 N -3.84 0.76 -0.24 2.91 0.52 -1.24 -4.87 118.95 112.95 2dx5 s ARG 42 Ca 0.63 -0.72 -0.29 0.00 -0.52 0.00 0.00 55.73 54.84 2dx5 s ARG 42 Cb -0.15 -0.39 -0.03 0.00 0.52 0.00 0.00 34.95 34.91 2dx5 s ARG 42 CO 0.31 -1.22 1.78 -0.51 0.02 0.00 0.00 175.30 175.68 2dx5 s LEU 43 N 1.47 3.75 0.18 2.53 1.43 -1.26 -2.80 118.68 123.98 2dx5 s LEU 43 Ca 0.18 1.63 0.02 0.00 -1.03 0.00 0.00 54.13 54.94 2dx5 s LEU 43 Cb -0.09 -3.53 -0.04 0.00 0.03 0.00 0.00 46.19 42.57 2dx5 s LEU 43 CO -0.05 -1.48 0.33 -0.63 0.23 0.00 0.00 176.35 174.75 2dx5 s ILE 44 N 6.08 5.28 -0.26 -0.59 -1.09 0.35 -2.54 121.20 128.43 2dx5 s ILE 44 Ca 0.79 -0.69 -0.01 0.00 -2.23 0.00 0.00 60.65 58.52 2dx5 s ILE 44 Cb -0.26 -3.77 0.14 0.00 -1.58 0.00 0.00 42.46 36.99 2dx5 s ILE 44 CO 0.32 -0.17 0.37 0.12 -1.23 0.00 0.00 174.94 174.35 2dx5 s PHE 45 N -1.84 -0.81 -1.27 3.97 5.36 -0.33 -0.24 117.98 122.82 2dx5 s PHE 45 Ca 0.35 0.51 -0.06 0.00 -0.96 0.00 0.00 56.93 56.77 2dx5 s PHE 45 Cb -0.11 -0.12 -0.01 0.00 -0.34 0.00 0.00 43.02 42.45 2dx5 s PHE 45 CO 0.29 -0.83 0.66 0.00 -1.46 0.00 0.00 175.22 173.88 2dx5 n ALA 46 N 5.35 -2.20 0.00 11.12 0.00 -1.26 -1.89 120.51 131.63 2dx5 n ALA 46 Ca -0.02 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.22 2dx5 n ALA 46 Cb 0.49 -2.66 0.00 0.00 0.00 0.00 0.00 19.45 17.28 2dx5 n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dx5 n GLY 47 N -1.70 1.37 3.72 0.00 0.00 -1.26 -4.95 105.19 102.37 2dx5 n GLY 47 Ca -0.23 -0.01 -0.43 0.00 0.00 0.00 0.00 46.02 45.35 2dx5 n GLY 47 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2dx5 n LYS 48 N 0.00 2.44 -3.50 1.61 5.02 -0.79 -4.99 118.16 117.96 2dx5 n LYS 48 Ca 0.00 0.87 -0.36 0.00 -2.02 0.00 0.00 58.31 56.80 2dx5 n LYS 48 Cb 0.00 -2.58 -0.06 0.00 -0.02 0.00 0.00 35.03 32.37 2dx5 n LYS 48 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 2dx5 s GLN 49 N -0.78 3.86 -0.33 1.97 0.74 -1.26 -1.18 119.66 122.67 2dx5 s GLN 49 Ca 0.63 0.32 -0.13 0.00 0.05 0.00 0.00 55.36 56.23 2dx5 s GLN 49 Cb -0.55 -3.03 -0.02 0.00 1.10 0.00 0.00 33.01 30.52 2dx5 s GLN 49 CO 0.52 0.56 0.23 -0.51 -0.55 0.00 0.00 175.29 175.54 2dx5 s LEU 50 N -1.75 4.45 0.43 3.68 1.43 -1.05 -4.96 118.68 120.91 2dx5 s LEU 50 Ca 0.32 -0.37 -0.22 0.00 -1.03 0.00 0.00 54.13 52.84 2dx5 s LEU 50 Cb -0.15 -2.13 -0.10 0.00 0.03 0.00 0.00 46.19 43.84 2dx5 s LEU 50 CO 0.17 -0.21 0.99 -1.83 0.23 0.00 0.00 176.35 175.71 2dx5 s GLU 51 N 1.72 4.12 0.10 1.70 -1.05 -1.26 -4.70 118.70 119.33 2dx5 s GLU 51 Ca 0.06 1.27 -0.29 0.00 -0.15 0.00 0.00 54.97 55.87 2dx5 s GLU 51 Cb -0.17 -2.26 -0.11 0.00 -0.44 0.00 0.00 34.13 31.15 2dx5 s GLU 51 CO 0.10 -0.14 1.63 -0.44 0.95 0.00 0.00 175.26 177.36 2dx5 h ASP 52 N 2.00 -0.79 0.00 0.83 3.45 -1.98 -3.20 116.42 116.73 2dx5 h ASP 52 Ca -0.49 0.08 0.00 0.00 0.43 0.00 0.00 57.03 57.05 2dx5 h ASP 52 Cb 1.20 0.28 0.00 0.00 -0.56 0.00 0.00 39.33 40.25 2dx5 h ASP 52 CO 0.61 -0.40 0.00 0.61 -1.57 0.00 0.00 179.24 178.49 2dx5 n GLY 53 N -1.40 0.97 2.97 2.75 0.00 -1.26 -3.30 105.19 105.92 2dx5 n GLY 53 Ca -0.08 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.68 2dx5 n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dx5 s ARG 54 N -0.02 1.63 0.58 1.61 1.81 -1.21 -5.02 118.95 118.33 2dx5 s ARG 54 Ca 0.00 -0.34 -0.18 0.00 -1.72 0.00 0.00 55.73 53.48 2dx5 s ARG 54 Cb 0.00 -1.50 -0.04 0.00 -0.45 0.00 0.00 34.95 32.96 2dx5 s ARG 54 CO 0.00 -0.11 1.14 0.95 -0.68 0.00 0.00 175.30 176.59 2dx5 s THR 55 N 1.16 3.09 0.29 0.02 -4.23 -1.26 -2.86 115.64 111.85 2dx5 s THR 55 Ca -0.05 0.64 0.03 0.00 -1.18 0.00 0.00 61.69 61.13 2dx5 s THR 55 Cb -0.14 -3.22 0.28 0.00 1.34 0.00 0.00 72.50 70.76 2dx5 s THR 55 CO -0.02 -0.19 1.72 -0.07 -0.54 0.00 0.00 174.62 175.52 2dx5 h LEU 56 N 0.86 0.45 -0.90 4.79 4.07 -0.95 0.18 115.31 123.82 2dx5 h LEU 56 Ca -0.49 0.13 0.24 0.00 0.08 0.00 0.00 57.88 57.84 2dx5 h LEU 56 Cb 1.26 0.08 -0.14 0.00 1.08 0.00 0.00 40.66 42.95 2dx5 h LEU 56 CO 0.56 0.08 0.33 -1.28 -1.08 0.00 0.00 178.44 177.05 2dx5 h SER 57 N 0.50 0.17 0.13 -0.43 0.87 -1.73 0.45 113.55 113.51 2dx5 h SER 57 Ca 0.55 0.18 -0.00 0.00 -1.23 0.00 0.00 61.79 61.29 2dx5 h SER 57 Cb 0.97 0.21 -0.00 0.00 -0.44 0.00 0.00 62.40 63.14 2dx5 h SER 57 CO -0.47 -0.10 -0.01 0.44 -0.53 0.00 0.00 176.83 176.15 2dx5 h ASP 58 N 0.28 0.00 -0.30 6.23 3.32 -0.94 0.25 116.42 125.26 2dx5 h ASP 58 Ca 0.58 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.63 2dx5 h ASP 58 Cb 1.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.71 2dx5 h ASP 58 CO -0.61 0.01 0.00 -1.22 -1.72 0.00 0.00 179.24 175.71 2dx5 n TYR 59 N -3.34 0.38 -3.59 4.55 4.02 0.15 -4.97 117.16 114.36 2dx5 n TYR 59 Ca -0.03 -0.20 -0.23 0.00 -0.01 0.00 0.00 57.90 57.43 2dx5 n TYR 59 Cb 0.11 -0.00 0.05 0.00 -0.02 0.00 0.00 39.34 39.48 2dx5 n TYR 59 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2dx5 n ASN 60 N 1.37 -3.47 -4.72 7.72 5.03 0.08 -4.97 115.26 116.30 2dx5 n ASN 60 Ca 0.17 -0.85 -0.36 0.00 0.87 0.00 0.00 54.58 54.42 2dx5 n ASN 60 Cb 0.58 -4.14 -0.07 0.00 -1.02 0.00 0.00 39.78 35.12 2dx5 n ASN 60 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2dx5 s ILE 61 N -3.55 5.32 0.55 2.41 1.01 -1.22 -5.06 121.20 120.67 2dx5 s ILE 61 Ca 0.23 0.48 0.07 0.00 0.00 0.00 0.00 60.65 61.43 2dx5 s ILE 61 Cb -0.06 -3.60 0.06 0.00 0.01 0.00 0.00 42.46 38.87 2dx5 s ILE 61 CO 0.81 0.39 0.58 -1.10 0.00 0.00 0.00 174.94 175.62 2dx5 s GLN 62 N 0.49 2.29 0.43 2.79 -1.52 -1.26 -4.80 119.66 118.08 2dx5 s GLN 62 Ca 0.15 -1.83 -0.25 0.00 -1.95 0.00 0.00 55.36 51.48 2dx5 s GLN 62 Cb -0.13 -2.36 -0.10 0.00 -0.22 0.00 0.00 33.01 30.20 2dx5 s GLN 62 CO 0.03 -0.71 1.22 0.36 -0.25 0.00 0.00 175.29 175.94 2dx5 n LYS 63 N -1.98 1.80 -1.53 2.91 2.85 -1.26 -2.63 118.16 118.32 2dx5 n LYS 63 Ca 0.07 0.64 -0.18 0.00 -1.05 0.00 0.00 58.31 57.79 2dx5 n LYS 63 Cb 0.63 -2.32 -0.08 0.00 -0.65 0.00 0.00 35.03 32.61 2dx5 n LYS 63 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2dx5 n GLU 64 N 0.01 -1.40 -1.01 -1.58 1.02 -0.98 -4.97 120.64 111.74 2dx5 n GLU 64 Ca 0.07 1.06 -0.30 0.00 -0.02 0.00 0.00 57.16 57.97 2dx5 n GLU 64 Cb 0.40 -5.39 0.23 0.00 -0.02 0.00 0.00 31.44 26.66 2dx5 n GLU 64 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2dx5 s SER 65 N -2.52 1.01 -0.10 1.62 0.01 -1.08 -4.79 113.70 107.85 2dx5 s SER 65 Ca 0.00 0.77 0.00 0.00 1.31 0.00 0.00 55.95 58.03 2dx5 s SER 65 Cb 0.00 -1.12 0.02 0.00 0.21 0.00 0.00 66.02 65.13 2dx5 s SER 65 CO 0.00 -4.08 -0.08 -0.89 0.41 0.00 0.00 173.24 168.60 2dx5 s THR 66 N -2.91 1.01 0.35 1.44 2.01 -1.26 -2.45 115.64 113.82 2dx5 s THR 66 Ca 0.70 -0.30 0.08 0.00 0.31 0.00 0.00 61.69 62.48 2dx5 s THR 66 Cb -0.12 -1.01 -0.05 0.00 0.01 0.00 0.00 72.50 71.33 2dx5 s THR 66 CO 0.57 0.36 0.11 -0.76 -0.69 0.00 0.00 174.62 174.21 2dx5 s LEU 67 N 1.52 3.17 0.16 4.42 1.43 0.30 -4.82 118.68 124.86 2dx5 s LEU 67 Ca 0.01 -0.87 0.10 0.00 -1.03 0.00 0.00 54.13 52.34 2dx5 s LEU 67 Cb -0.13 -1.59 -0.04 0.00 0.03 0.00 0.00 46.19 44.45 2dx5 s LEU 67 CO -0.06 -0.32 -0.22 -1.00 0.23 0.00 0.00 176.35 174.98 2dx5 s HIS 68 N -2.47 2.09 -0.15 0.29 3.76 0.66 -1.34 115.29 118.14 2dx5 s HIS 68 Ca 0.37 -0.40 -0.01 0.00 -0.15 0.00 0.00 55.06 54.87 2dx5 s HIS 68 Cb -0.01 -1.07 -0.01 0.00 1.11 0.00 0.00 32.58 32.60 2dx5 s HIS 68 CO 0.22 0.38 -0.11 -1.17 -0.85 0.00 0.00 174.74 173.22 2dx5 s LEU 69 N -2.46 2.80 -0.16 0.89 0.20 0.45 0.13 118.68 120.53 2dx5 s LEU 69 Ca 0.16 -0.32 -0.02 0.00 0.69 0.00 0.00 54.13 54.64 2dx5 s LEU 69 Cb -0.08 -1.65 0.05 0.00 -0.43 0.00 0.00 46.19 44.08 2dx5 s LEU 69 CO 0.08 0.14 0.03 -0.69 -0.29 0.00 0.00 176.35 175.61 2dx5 s VAL 70 N 0.53 0.48 0.31 1.68 1.01 -1.12 -4.00 120.40 119.28 2dx5 s VAL 70 Ca -0.07 -0.37 -0.29 0.00 0.00 0.00 0.00 61.98 61.24 2dx5 s VAL 70 Cb -0.15 -0.90 -0.11 0.00 0.00 0.00 0.00 36.38 35.22 2dx5 s VAL 70 CO 0.04 -0.08 1.51 -0.76 0.00 0.00 0.00 175.10 175.80 2dx5 s LEU 71 N 1.89 4.36 0.34 3.92 1.43 -1.26 -3.67 118.68 125.69 2dx5 s LEU 71 Ca 0.01 2.89 -0.28 0.00 -1.03 0.00 0.00 54.13 55.71 2dx5 s LEU 71 Cb -0.16 -3.64 -0.12 0.00 0.03 0.00 0.00 46.19 42.30 2dx5 s LEU 71 CO -0.07 -0.82 1.43 0.54 0.23 0.00 0.00 176.35 177.65 2dx5 n ARG 72 N 1.69 2.44 0.00 1.70 1.74 -0.64 -5.03 116.66 118.57 2dx5 n ARG 72 Ca 0.05 0.86 0.00 0.00 -0.77 0.00 0.00 57.85 58.00 2dx5 n ARG 72 Cb 0.39 -2.54 0.02 0.00 -1.02 0.00 0.00 32.46 29.31 2dx5 n ARG 72 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39