#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yx5 s GLN 2 N 0.00 4.26 0.07 2.12 0.74 -1.26 0.59 119.66 126.18 1yx5 s GLN 2 Ca 0.00 0.81 0.01 0.00 0.05 0.00 0.00 55.36 56.23 1yx5 s GLN 2 Cb 0.00 -3.19 -0.04 0.00 1.10 0.00 0.00 33.01 30.89 1yx5 s GLN 2 CO 0.00 0.59 -0.05 0.96 -0.55 0.00 0.00 175.29 176.24 1yx5 s ILE 3 N -1.18 0.49 0.01 -2.34 -4.36 -0.21 -0.32 121.20 113.29 1yx5 s ILE 3 Ca 0.32 -1.69 0.04 0.00 -0.26 0.00 0.00 60.65 59.06 1yx5 s ILE 3 Cb -0.20 -1.36 -0.03 0.00 1.25 0.00 0.00 42.46 42.12 1yx5 s ILE 3 CO 0.21 -0.80 -0.09 -0.36 0.24 0.00 0.00 174.94 174.14 1yx5 s PHE 4 N -3.19 2.83 -0.09 1.37 0.08 -0.14 -1.11 117.98 117.73 1yx5 s PHE 4 Ca 0.05 -0.08 0.01 0.00 0.12 0.00 0.00 56.93 57.04 1yx5 s PHE 4 Cb 0.02 -1.59 0.02 0.00 -0.57 0.00 0.00 43.02 40.91 1yx5 s PHE 4 CO -0.05 0.35 -0.12 0.08 -0.10 0.00 0.00 175.22 175.38 1yx5 s VAL 5 N -0.98 1.19 -0.13 -0.44 1.01 -0.17 -0.64 120.40 120.23 1yx5 s VAL 5 Ca 0.17 -0.46 -0.08 0.00 0.00 0.00 0.00 61.98 61.61 1yx5 s VAL 5 Cb -0.11 -1.12 -0.04 0.00 0.00 0.00 0.00 36.38 35.11 1yx5 s VAL 5 CO 0.07 0.38 0.15 -0.54 0.00 0.00 0.00 175.10 175.16 1yx5 s LYS 6 N 1.04 3.57 0.53 2.72 1.02 -0.05 -0.71 119.74 127.86 1yx5 s LYS 6 Ca -0.07 -0.13 0.04 0.00 0.02 0.00 0.00 55.97 55.83 1yx5 s LYS 6 Cb -0.15 -3.23 0.04 0.00 -0.52 0.00 0.00 37.83 33.98 1yx5 s LYS 6 CO -0.01 0.70 0.73 0.95 -0.92 0.00 0.00 175.35 176.81 1yx5 s THR 7 N -0.81 2.67 -0.35 2.17 -4.23 -0.12 -1.11 115.64 113.85 1yx5 s THR 7 Ca 0.14 -0.79 0.19 0.00 -1.18 0.00 0.00 61.69 60.05 1yx5 s THR 7 Cb -0.12 -2.88 0.19 0.00 1.34 0.00 0.00 72.50 71.03 1yx5 s THR 7 CO 0.03 0.00 1.57 0.18 -0.54 0.00 0.00 174.62 175.87 1yx5 n LEU 8 N -2.23 0.49 0.00 4.79 7.99 -1.25 -1.68 117.00 125.11 1yx5 n LEU 8 Ca 0.09 0.71 0.04 0.00 -0.01 0.00 0.00 56.01 56.84 1yx5 n LEU 8 Cb 0.60 -0.75 -0.12 0.00 -0.11 0.00 0.00 43.42 43.04 1yx5 n LEU 8 CO 0.42 -0.84 -0.58 0.35 -1.51 0.00 0.00 177.39 175.24 1yx5 n THR 9 N -2.14 0.71 0.00 -5.08 -2.24 -1.26 -4.97 114.28 99.30 1yx5 n THR 9 Ca -0.01 -0.63 0.00 0.00 -2.27 0.00 0.00 64.05 61.14 1yx5 n THR 9 Cb 0.05 -0.35 0.00 0.00 -2.10 0.00 0.00 70.33 67.93 1yx5 n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yx5 n GLY 10 N 1.38 1.48 3.76 3.38 0.00 -0.67 -5.11 105.19 109.41 1yx5 n GLY 10 Ca -0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.52 1yx5 n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1yx5 s LYS 11 N -0.11 4.52 -0.16 1.61 2.20 -1.26 -4.78 119.74 121.75 1yx5 s LYS 11 Ca 0.00 1.10 -0.02 0.00 -0.36 0.00 0.00 55.97 56.69 1yx5 s LYS 11 Cb 0.00 -3.31 -0.01 0.00 -1.51 0.00 0.00 37.83 33.00 1yx5 s LYS 11 CO 0.00 0.44 -0.10 0.99 -0.36 0.00 0.00 175.35 176.32 1yx5 s THR 12 N -0.63 3.20 -0.10 3.43 2.01 -1.26 -0.94 115.64 121.35 1yx5 s THR 12 Ca 0.37 -0.59 -0.02 0.00 0.31 0.00 0.00 61.69 61.77 1yx5 s THR 12 Cb -0.22 -2.39 -0.03 0.00 0.01 0.00 0.00 72.50 69.87 1yx5 s THR 12 CO 0.24 0.49 -0.04 -0.63 -0.69 0.00 0.00 174.62 174.00 1yx5 s ILE 13 N 0.75 3.94 -0.26 1.82 1.01 0.11 -4.86 121.20 123.72 1yx5 s ILE 13 Ca -0.04 -0.37 -0.10 0.00 0.00 0.00 0.00 60.65 60.14 1yx5 s ILE 13 Cb -0.15 -2.67 -0.04 0.00 0.01 0.00 0.00 42.46 39.61 1yx5 s ILE 13 CO 0.02 0.56 0.15 -0.89 0.00 0.00 0.00 174.94 174.77 1yx5 s THR 14 N -0.40 5.02 0.23 2.92 2.01 -1.26 -1.00 115.64 123.16 1yx5 s THR 14 Ca 0.07 0.07 0.10 0.00 0.31 0.00 0.00 61.69 62.23 1yx5 s THR 14 Cb -0.12 -3.37 -0.05 0.00 0.01 0.00 0.00 72.50 68.97 1yx5 s THR 14 CO 0.02 0.30 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.31 1yx5 s LEU 15 N 1.57 2.56 -0.32 4.42 1.43 -0.27 -4.94 118.68 123.13 1yx5 s LEU 15 Ca 0.07 -1.01 -0.09 0.00 -1.03 0.00 0.00 54.13 52.08 1yx5 s LEU 15 Cb -0.15 -0.89 0.01 0.00 0.03 0.00 0.00 46.19 45.18 1yx5 s LEU 15 CO 0.08 -0.06 0.13 -1.61 0.23 0.00 0.00 176.35 175.12 1yx5 s GLU 16 N -3.48 3.07 0.26 1.70 2.02 -1.26 -1.04 118.70 119.98 1yx5 s GLU 16 Ca 0.25 -0.89 0.03 0.00 0.02 0.00 0.00 54.97 54.38 1yx5 s GLU 16 Cb -0.03 -3.52 -0.03 0.00 0.10 0.00 0.00 34.13 30.65 1yx5 s GLU 16 CO 0.10 -0.51 0.20 0.14 0.02 0.00 0.00 175.26 175.22 1yx5 s VAL 17 N 1.54 0.00 0.35 2.63 -7.23 0.20 -4.89 120.40 112.99 1yx5 s VAL 17 Ca 0.03 -1.99 0.08 0.00 -1.81 0.00 0.00 61.98 58.29 1yx5 s VAL 17 Cb -0.18 -2.50 -0.05 0.00 0.56 0.00 0.00 36.38 34.22 1yx5 s VAL 17 CO 0.05 0.00 0.11 -1.61 -0.31 0.00 0.00 175.10 173.34 1yx5 s GLU 18 N -3.82 2.29 0.36 4.82 8.01 -1.26 0.14 118.70 129.23 1yx5 s GLU 18 Ca 0.40 -1.62 0.17 0.00 0.01 0.00 0.00 54.97 53.92 1yx5 s GLU 18 Cb 0.05 -2.10 0.63 0.00 -4.31 0.00 0.00 34.13 28.40 1yx5 s GLU 18 CO 0.19 0.10 1.72 -1.00 0.01 0.00 0.00 175.26 176.28 1yx5 h PRO 19 N 1.60 0.00 -0.00 0.39 0.13 -1.93 -2.67 132.00 129.51 1yx5 h PRO 19 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1yx5 h PRO 19 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1yx5 h PRO 19 CO 0.65 0.42 -0.06 0.43 -0.23 0.00 0.00 178.00 179.20 1yx5 n SER 20 N -3.61 0.54 -4.77 1.44 7.64 -1.26 -1.24 113.62 112.37 1yx5 n SER 20 Ca -0.00 -0.85 -0.39 0.00 1.01 0.00 0.00 58.87 58.63 1yx5 n SER 20 Cb 0.52 -0.04 -0.03 0.00 -1.01 0.00 0.00 64.21 63.65 1yx5 n SER 20 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1yx5 s ASP 21 N -2.26 6.82 0.56 6.43 1.01 -1.01 -4.80 116.67 123.43 1yx5 s ASP 21 Ca 0.35 2.35 -0.08 0.00 0.71 0.00 0.00 52.55 55.88 1yx5 s ASP 21 Cb 0.21 -2.62 -0.03 0.00 1.01 0.00 0.00 42.92 41.48 1yx5 s ASP 21 CO 0.42 -0.46 0.92 0.42 0.21 0.00 0.00 175.17 176.68 1yx5 s THR 22 N -1.31 4.67 0.37 -1.27 -4.23 -1.26 -1.30 115.64 111.30 1yx5 s THR 22 Ca 0.52 0.53 0.04 0.00 -1.18 0.00 0.00 61.69 61.59 1yx5 s THR 22 Cb -0.32 -3.83 0.27 0.00 1.34 0.00 0.00 72.50 69.97 1yx5 s THR 22 CO 0.41 -0.96 2.02 0.40 -0.54 0.00 0.00 174.62 175.94 1yx5 h ILE 23 N -0.10 1.13 -0.60 2.99 1.08 -1.20 -0.57 117.51 120.23 1yx5 h ILE 23 Ca -0.45 -0.26 0.01 0.00 -0.39 0.00 0.00 64.86 63.77 1yx5 h ILE 23 Cb 1.20 0.30 -0.03 0.00 -3.07 0.00 0.00 36.82 35.22 1yx5 h ILE 23 CO 0.62 0.14 0.40 -0.08 -0.69 0.00 0.00 178.15 178.53 1yx5 h GLU 24 N 0.76 0.78 -0.08 2.37 4.81 -1.84 -0.25 114.58 121.13 1yx5 h GLU 24 Ca 0.22 -0.05 -0.13 0.00 -0.13 0.00 0.00 59.36 59.28 1yx5 h GLU 24 Cb -0.04 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.16 1yx5 h GLU 24 CO -0.05 0.51 -0.52 -0.91 -0.73 0.00 0.00 179.01 177.32 1yx5 h ASN 25 N 0.80 0.22 -0.27 1.04 2.35 -1.45 -2.13 115.58 116.14 1yx5 h ASN 25 Ca 0.22 -0.11 -0.12 0.00 -0.55 0.00 0.00 56.30 55.74 1yx5 h ASN 25 Cb -0.07 -0.06 -0.00 0.00 0.05 0.00 0.00 38.32 38.23 1yx5 h ASN 25 CO -0.05 0.70 -0.29 0.58 -1.65 0.00 0.00 177.43 176.72 1yx5 h VAL 26 N 0.16 1.31 -0.77 2.81 2.07 -0.60 -2.23 116.25 118.99 1yx5 h VAL 26 Ca 0.00 -1.46 -0.04 0.00 0.82 0.00 0.00 66.70 66.02 1yx5 h VAL 26 Cb 0.97 1.63 -0.03 0.00 -1.52 0.00 0.00 31.29 32.33 1yx5 h VAL 26 CO 0.08 0.46 0.33 0.11 0.02 0.00 0.00 177.57 178.58 1yx5 h LYS 27 N 0.40 1.13 -0.58 1.57 1.57 -1.04 -1.67 116.57 117.96 1yx5 h LYS 27 Ca 0.04 -0.19 -0.02 0.00 -1.87 0.00 0.00 60.65 58.61 1yx5 h LYS 27 Cb 0.86 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.95 1yx5 h LYS 27 CO 0.07 0.91 0.28 0.00 -0.57 0.00 0.00 179.45 180.14 1yx5 h ALA 28 N 1.17 1.40 -0.40 3.86 0.00 -1.28 -1.11 119.26 122.90 1yx5 h ALA 28 Ca 0.26 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.93 1yx5 h ALA 28 Cb 0.17 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1yx5 h ALA 28 CO -0.03 0.47 -0.25 0.87 0.00 0.00 0.00 179.25 180.32 1yx5 h LYS 29 N 0.82 0.82 -0.54 0.00 1.57 -0.75 -2.08 116.57 116.41 1yx5 h LYS 29 Ca 0.20 -0.35 -0.11 0.00 -1.87 0.00 0.00 60.65 58.52 1yx5 h LYS 29 Cb 0.08 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 1yx5 h LYS 29 CO -0.03 0.98 -0.10 0.82 -0.57 0.00 0.00 179.45 180.55 1yx5 h ILE 30 N 0.71 1.27 -0.11 1.86 2.04 -0.65 -2.49 117.51 120.14 1yx5 h ILE 30 Ca 0.09 -1.25 0.00 0.00 1.00 0.00 0.00 64.86 64.70 1yx5 h ILE 30 Cb 0.78 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.81 1yx5 h ILE 30 CO 0.06 0.44 0.07 -0.61 0.00 0.00 0.00 178.15 178.12 1yx5 h GLN 31 N 0.90 0.15 -0.13 2.37 -0.00 -1.02 0.64 115.11 118.02 1yx5 h GLN 31 Ca 0.14 -0.01 0.04 0.00 -0.00 0.00 0.00 58.65 58.82 1yx5 h GLN 31 Cb 0.66 -0.03 -0.01 0.00 0.00 0.00 0.00 27.48 28.10 1yx5 h GLN 31 CO 0.05 0.12 0.12 0.22 0.00 0.00 0.00 178.83 179.34 1yx5 h ASP 32 N 0.13 0.00 0.21 -0.69 1.82 -1.23 1.13 116.42 117.79 1yx5 h ASP 32 Ca 0.04 0.00 -0.35 0.00 -0.39 0.00 0.00 57.03 56.33 1yx5 h ASP 32 Cb 0.01 0.00 0.02 0.00 0.68 0.00 0.00 39.33 40.04 1yx5 h ASP 32 CO -0.01 0.00 -1.69 0.11 -1.61 0.00 0.00 179.24 176.04 1yx5 h LYS 33 N 0.00 0.44 0.00 0.28 1.79 -0.80 -3.43 116.57 114.85 1yx5 h LYS 33 Ca 0.06 -0.75 -0.11 0.00 -2.18 0.00 0.00 60.65 57.67 1yx5 h LYS 33 Cb 0.31 0.28 -0.02 0.00 -1.58 0.00 0.00 32.23 31.22 1yx5 h LYS 33 CO -0.00 1.36 -1.14 0.39 -1.08 0.00 0.00 179.45 178.98 1yx5 n GLU 34 N -3.63 0.33 0.00 3.15 -0.58 0.11 -5.05 120.64 114.97 1yx5 n GLU 34 Ca -0.23 0.14 0.00 0.00 -0.42 0.00 0.00 57.16 56.65 1yx5 n GLU 34 Cb 1.09 -1.07 0.00 0.00 -0.57 0.00 0.00 31.44 30.88 1yx5 n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1yx5 n GLY 35 N 2.15 0.90 3.85 0.62 0.00 0.38 -5.03 105.19 108.05 1yx5 n GLY 35 Ca -0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.48 1yx5 n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yx5 s ILE 36 N -1.20 4.92 0.20 -0.61 1.01 -1.26 -5.01 121.20 119.26 1yx5 s ILE 36 Ca 0.00 0.74 -0.30 0.00 0.00 0.00 0.00 60.65 61.09 1yx5 s ILE 36 Cb 0.00 -3.72 -0.09 0.00 0.01 0.00 0.00 42.46 38.67 1yx5 s ILE 36 CO 0.00 0.28 1.30 -2.16 0.00 0.00 0.00 174.94 174.36 1yx5 s PRO 37 N -1.88 4.40 0.55 2.79 0.04 -1.26 -4.22 135.00 135.42 1yx5 s PRO 37 Ca 0.36 2.05 0.25 0.00 0.04 0.00 0.00 61.00 63.69 1yx5 s PRO 37 Cb -0.15 -3.19 1.59 0.00 0.04 0.00 0.00 34.50 32.78 1yx5 s PRO 37 CO 0.19 -0.24 2.19 -1.00 0.04 0.00 0.00 177.00 178.18 1yx5 h PRO 38 N 5.29 0.00 0.00 0.56 0.13 -1.93 -1.15 132.00 134.90 1yx5 h PRO 38 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1yx5 h PRO 38 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1yx5 h PRO 38 CO 0.77 0.03 0.00 0.22 -0.23 0.00 0.00 178.00 178.79 1yx5 h ASP 39 N 0.00 0.00 -0.00 1.44 1.82 -1.97 -2.65 116.42 115.06 1yx5 h ASP 39 Ca -0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1yx5 h ASP 39 Cb 0.08 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.09 1yx5 h ASP 39 CO 0.00 0.00 -0.90 0.00 -1.61 0.00 0.00 179.24 176.74 1yx5 n GLN 40 N -3.04 0.45 -3.59 0.28 3.00 -0.45 -4.89 117.38 109.14 1yx5 n GLN 40 Ca 0.00 -0.11 -0.34 0.00 -0.01 0.00 0.00 57.00 56.54 1yx5 n GLN 40 Cb 0.27 -1.45 -0.05 0.00 0.00 0.00 0.00 30.24 29.01 1yx5 n GLN 40 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.06 176.41 1yx5 s GLN 41 N -2.84 3.74 -0.04 -1.09 -0.21 -1.00 0.13 119.66 118.34 1yx5 s GLN 41 Ca 0.09 0.14 0.03 0.00 0.02 0.00 0.00 55.36 55.64 1yx5 s GLN 41 Cb 0.15 -2.98 0.00 0.00 1.00 0.00 0.00 33.01 31.19 1yx5 s GLN 41 CO 0.80 0.55 -0.11 0.50 -2.12 0.00 0.00 175.29 174.90 1yx5 s ARG 42 N -2.00 1.29 -0.29 2.91 3.52 -0.23 -4.89 118.95 119.26 1yx5 s ARG 42 Ca 0.34 -0.39 -0.09 0.00 -0.13 0.00 0.00 55.73 55.46 1yx5 s ARG 42 Cb -0.14 -1.15 -0.02 0.00 -1.56 0.00 0.00 34.95 32.09 1yx5 s ARG 42 CO 0.19 0.12 0.13 -0.51 -0.81 0.00 0.00 175.30 174.42 1yx5 s LEU 43 N 0.28 3.89 -0.07 -0.88 1.43 -1.26 -0.97 118.68 121.11 1yx5 s LEU 43 Ca -0.06 -0.36 0.05 0.00 -1.03 0.00 0.00 54.13 52.73 1yx5 s LEU 43 Cb -0.11 -1.99 -0.01 0.00 0.03 0.00 0.00 46.19 44.11 1yx5 s LEU 43 CO 0.01 -0.13 -0.23 -0.63 0.23 0.00 0.00 176.35 175.61 1yx5 s ILE 44 N 1.63 1.93 0.02 -0.59 1.09 0.10 -0.85 121.20 124.53 1yx5 s ILE 44 Ca 0.05 -0.98 -0.01 0.00 -1.10 0.00 0.00 60.65 58.61 1yx5 s ILE 44 Cb -0.16 -1.65 -0.02 0.00 -1.06 0.00 0.00 42.46 39.57 1yx5 s ILE 44 CO 0.06 0.54 -0.01 0.12 -0.10 0.00 0.00 174.94 175.55 1yx5 s PHE 45 N 0.03 0.27 -0.52 3.97 2.19 -0.15 -0.99 117.98 122.78 1yx5 s PHE 45 Ca -0.08 -0.56 0.00 0.00 0.33 0.00 0.00 56.93 56.62 1yx5 s PHE 45 Cb -0.15 -0.20 0.00 0.00 -1.31 0.00 0.00 43.02 41.37 1yx5 s PHE 45 CO 0.05 -0.23 0.00 0.00 1.83 0.00 0.00 175.22 176.87 1yx5 n ALA 46 N 1.37 -0.69 -0.91 11.12 0.00 -1.26 0.16 120.51 130.30 1yx5 n ALA 46 Ca -0.22 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1yx5 n ALA 46 Cb 0.56 -0.91 0.00 0.00 0.00 0.00 0.00 19.45 19.10 1yx5 n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yx5 n GLY 47 N -0.50 1.15 3.52 0.00 0.00 -1.26 -5.01 105.19 103.10 1yx5 n GLY 47 Ca -0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.62 1yx5 n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yx5 s LYS 48 N -0.01 3.06 0.18 1.61 1.02 0.43 -5.09 119.74 120.94 1yx5 s LYS 48 Ca 0.00 -0.57 -0.30 0.00 0.02 0.00 0.00 55.97 55.12 1yx5 s LYS 48 Cb 0.00 -2.66 -0.08 0.00 -0.52 0.00 0.00 37.83 34.57 1yx5 s LYS 48 CO 0.00 0.49 1.00 -1.14 -0.92 0.00 0.00 175.35 174.78 1yx5 s GLN 49 N -0.34 4.72 0.16 1.68 0.74 -1.26 -0.98 119.66 124.38 1yx5 s GLN 49 Ca 0.05 1.55 -0.25 0.00 0.05 0.00 0.00 55.36 56.76 1yx5 s GLN 49 Cb -0.12 -3.31 -0.08 0.00 1.10 0.00 0.00 33.01 30.60 1yx5 s GLN 49 CO 0.02 0.28 0.78 -0.51 -0.55 0.00 0.00 175.29 175.31 1yx5 s LEU 50 N -0.58 4.59 -0.07 3.68 1.43 -0.03 -4.94 118.68 122.76 1yx5 s LEU 50 Ca 0.45 1.64 -0.15 0.00 -1.03 0.00 0.00 54.13 55.04 1yx5 s LEU 50 Cb -0.26 -3.29 -0.05 0.00 0.03 0.00 0.00 46.19 42.61 1yx5 s LEU 50 CO 0.33 0.21 0.40 -1.61 0.23 0.00 0.00 176.35 175.90 1yx5 s GLU 51 N -1.13 4.11 0.52 1.70 2.02 -1.26 -4.75 118.70 119.92 1yx5 s GLU 51 Ca 0.36 0.34 0.34 0.00 0.02 0.00 0.00 54.97 56.03 1yx5 s GLU 51 Cb -0.23 -3.33 1.48 0.00 0.10 0.00 0.00 34.13 32.15 1yx5 s GLU 51 CO 0.26 0.43 1.81 0.38 0.02 0.00 0.00 175.26 178.16 1yx5 h ASP 52 N 5.77 0.06 0.34 -0.19 2.03 -1.96 0.91 116.42 123.38 1yx5 h ASP 52 Ca -0.46 0.01 0.00 0.00 -0.73 0.00 0.00 57.03 55.85 1yx5 h ASP 52 Cb 1.19 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.70 1yx5 h ASP 52 CO 0.69 0.01 -0.06 0.61 -1.03 0.00 0.00 179.24 179.46 1yx5 n GLY 53 N -1.72 -0.99 3.94 7.15 0.00 -1.26 -3.73 105.19 108.57 1yx5 n GLY 53 Ca 0.25 -0.23 -0.28 0.00 0.00 0.00 0.00 46.02 45.76 1yx5 n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yx5 s ARG 54 N -2.40 3.45 0.30 1.61 1.81 0.32 -4.95 118.95 119.09 1yx5 s ARG 54 Ca 0.32 -0.52 0.07 0.00 -1.72 0.00 0.00 55.73 53.87 1yx5 s ARG 54 Cb 0.20 -2.97 -0.02 0.00 -0.45 0.00 0.00 34.95 31.71 1yx5 s ARG 54 CO 0.45 0.53 0.37 0.95 -0.68 0.00 0.00 175.30 176.92 1yx5 s THR 55 N -1.69 4.23 0.24 0.02 -4.23 -1.26 -1.08 115.64 111.86 1yx5 s THR 55 Ca 0.35 -1.14 -0.05 0.00 -1.18 0.00 0.00 61.69 59.67 1yx5 s THR 55 Cb -0.12 -3.45 0.20 0.00 1.34 0.00 0.00 72.50 70.47 1yx5 s THR 55 CO 0.28 -0.22 1.76 -0.07 -0.54 0.00 0.00 174.62 175.84 1yx5 h LEU 56 N 1.12 0.43 -1.27 4.79 3.38 -1.15 -1.12 115.31 121.48 1yx5 h LEU 56 Ca -0.47 0.08 0.08 0.00 0.09 0.00 0.00 57.88 57.66 1yx5 h LEU 56 Cb 1.25 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 41.95 1yx5 h LEU 56 CO 0.57 0.22 0.54 0.77 0.09 0.00 0.00 178.44 180.63 1yx5 h SER 57 N 0.57 0.75 -0.04 -0.43 4.64 -1.40 -0.50 113.55 117.14 1yx5 h SER 57 Ca 0.38 0.01 0.01 0.00 -0.47 0.00 0.00 61.79 61.73 1yx5 h SER 57 Cb 0.47 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 62.42 1yx5 h SER 57 CO -0.32 0.46 0.04 0.44 -0.87 0.00 0.00 176.83 176.58 1yx5 h ASP 58 N 0.84 0.00 -0.75 4.97 5.19 -1.47 -0.21 116.42 124.99 1yx5 h ASP 58 Ca 0.37 0.00 -0.25 0.00 -0.62 0.00 0.00 57.03 56.53 1yx5 h ASP 58 Cb 0.35 0.00 -0.15 0.00 0.18 0.00 0.00 39.33 39.71 1yx5 h ASP 58 CO -0.14 0.00 0.30 -1.22 -3.12 0.00 0.00 179.24 175.06 1yx5 n TYR 59 N -4.01 2.44 -2.36 4.55 4.01 -0.24 -4.90 117.16 116.67 1yx5 n TYR 59 Ca -0.02 -1.30 -0.11 0.00 -0.16 0.00 0.00 57.90 56.31 1yx5 n TYR 59 Cb 0.13 -0.71 -0.01 0.00 -0.31 0.00 0.00 39.34 38.44 1yx5 n TYR 59 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1yx5 n ASN 60 N -0.34 -3.55 -4.61 7.72 5.15 -0.09 -4.87 115.26 114.66 1yx5 n ASN 60 Ca 0.43 0.23 -0.43 0.00 -0.60 0.00 0.00 54.58 54.21 1yx5 n ASN 60 Cb 1.40 -3.06 -0.03 0.00 -0.53 0.00 0.00 39.78 37.56 1yx5 n ASN 60 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1yx5 s ILE 61 N -2.50 4.38 0.43 -1.44 1.01 -0.96 -5.02 121.20 117.10 1yx5 s ILE 61 Ca 0.00 1.29 0.08 0.00 0.00 0.00 0.00 60.65 62.02 1yx5 s ILE 61 Cb 0.00 -4.49 -0.01 0.00 0.01 0.00 0.00 42.46 37.97 1yx5 s ILE 61 CO 0.00 -0.77 0.43 -1.10 0.00 0.00 0.00 174.94 173.50 1yx5 s GLN 62 N 3.99 2.56 0.63 2.79 -0.21 -1.26 -4.50 119.66 123.66 1yx5 s GLN 62 Ca 0.44 -1.52 -0.17 0.00 0.02 0.00 0.00 55.36 54.13 1yx5 s GLN 62 Cb -0.10 -2.44 -0.09 0.00 1.00 0.00 0.00 33.01 31.38 1yx5 s GLN 62 CO 0.25 -0.26 0.25 0.36 -2.12 0.00 0.00 175.29 173.77 1yx5 n LYS 63 N -1.64 0.27 -1.34 2.91 2.85 -1.26 -1.27 118.16 118.68 1yx5 n LYS 63 Ca 0.05 0.11 -0.12 0.00 -1.05 0.00 0.00 58.31 57.30 1yx5 n LYS 63 Cb 0.61 -1.49 -0.05 0.00 -0.65 0.00 0.00 35.03 33.45 1yx5 n LYS 63 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1yx5 n GLU 64 N 0.37 -1.42 -2.36 -1.58 -0.58 0.56 -4.95 120.64 110.68 1yx5 n GLU 64 Ca 0.09 0.88 -0.36 0.00 -0.42 0.00 0.00 57.16 57.35 1yx5 n GLU 64 Cb 0.49 -5.15 -0.02 0.00 -0.57 0.00 0.00 31.44 26.19 1yx5 n GLU 64 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 1yx5 s SER 65 N -2.52 6.21 -0.36 1.62 0.01 -0.40 -4.72 113.70 113.54 1yx5 s SER 65 Ca 0.00 2.16 -0.08 0.00 1.31 0.00 0.00 55.95 59.34 1yx5 s SER 65 Cb 0.00 -2.59 0.04 0.00 0.21 0.00 0.00 66.02 63.68 1yx5 s SER 65 CO 0.00 -0.88 0.16 -0.89 0.41 0.00 0.00 173.24 172.04 1yx5 s THR 66 N -1.69 4.08 0.22 1.44 2.01 -1.26 -0.96 115.64 119.48 1yx5 s THR 66 Ca 0.65 -1.10 0.05 0.00 0.31 0.00 0.00 61.69 61.61 1yx5 s THR 66 Cb -0.24 -3.33 -0.03 0.00 0.01 0.00 0.00 72.50 68.90 1yx5 s THR 66 CO 0.29 -0.25 0.28 -0.76 -0.69 0.00 0.00 174.62 173.50 1yx5 s LEU 67 N 1.45 4.13 -0.14 4.42 1.43 0.19 -4.88 118.68 125.27 1yx5 s LEU 67 Ca 0.00 -0.03 -0.03 0.00 -1.03 0.00 0.00 54.13 53.04 1yx5 s LEU 67 Cb -0.20 -2.68 -0.03 0.00 0.03 0.00 0.00 46.19 43.32 1yx5 s LEU 67 CO 0.04 -0.03 -0.03 -1.00 0.23 0.00 0.00 176.35 175.55 1yx5 s HIS 68 N -1.97 3.04 -0.12 0.29 3.76 -0.16 -0.87 115.29 119.26 1yx5 s HIS 68 Ca 0.33 -0.20 -0.03 0.00 -0.15 0.00 0.00 55.06 55.02 1yx5 s HIS 68 Cb -0.09 -1.92 -0.03 0.00 1.11 0.00 0.00 32.58 31.65 1yx5 s HIS 68 CO 0.27 0.06 -0.00 -1.17 -0.85 0.00 0.00 174.74 173.05 1yx5 s LEU 69 N 0.11 3.51 0.10 0.89 2.96 -0.27 -0.72 118.68 125.26 1yx5 s LEU 69 Ca -0.01 0.06 0.08 0.00 -0.22 0.00 0.00 54.13 54.05 1yx5 s LEU 69 Cb -0.13 -1.82 -0.03 0.00 0.50 0.00 0.00 46.19 44.70 1yx5 s LEU 69 CO 0.03 0.30 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.45 1yx5 s VAL 70 N -0.40 1.75 -0.24 1.68 1.01 -0.14 -3.95 120.40 120.12 1yx5 s VAL 70 Ca 0.07 -1.53 -0.16 0.00 0.00 0.00 0.00 61.98 60.36 1yx5 s VAL 70 Cb -0.12 -1.58 -0.04 0.00 0.00 0.00 0.00 36.38 34.64 1yx5 s VAL 70 CO 0.02 -0.03 0.40 -0.76 0.00 0.00 0.00 175.10 174.74 1yx5 s LEU 71 N -1.86 4.09 -1.37 3.92 1.43 -1.26 -1.07 118.68 122.55 1yx5 s LEU 71 Ca 0.07 0.43 -0.10 0.00 -1.03 0.00 0.00 54.13 53.50 1yx5 s LEU 71 Cb -0.10 -2.50 0.10 0.00 0.03 0.00 0.00 46.19 43.72 1yx5 s LEU 71 CO 0.04 -0.15 2.20 -1.14 0.23 0.00 0.00 176.35 177.54 1yx5 n ARG 72 N 4.96 3.67 -0.58 1.70 0.63 0.34 -4.98 116.66 122.39 1yx5 n ARG 72 Ca -0.08 -3.13 -0.29 0.00 -0.92 0.00 0.00 57.85 53.43 1yx5 n ARG 72 Cb 0.51 -2.93 0.26 0.00 0.45 0.00 0.00 32.46 30.75 1yx5 n ARG 72 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1yx5 s LEU 73 N -0.00 0.38 -0.03 6.15 1.43 -1.26 -4.87 118.68 120.47 1yx5 s LEU 73 Ca 0.48 1.28 -0.30 0.00 -1.03 0.00 0.00 54.13 54.56 1yx5 s LEU 73 Cb 0.14 -3.08 -0.04 0.00 0.03 0.00 0.00 46.19 43.24 1yx5 s LEU 73 CO -0.05 -4.42 1.18 -0.13 0.23 0.00 0.00 176.35 173.16 1yx5 s ARG 74 N -4.67 4.38 -0.11 1.70 3.00 -1.26 -4.89 118.95 117.09 1yx5 s ARG 74 Ca 0.68 1.67 0.23 0.00 0.00 0.00 0.00 55.73 58.31 1yx5 s ARG 74 Cb -0.21 -3.51 0.44 0.00 0.00 0.00 0.00 34.95 31.66 1yx5 s ARG 74 CO 0.62 -0.38 1.15 0.41 0.00 0.00 0.00 175.30 177.10 1yx5 n GLY 75 N 3.30 1.32 3.02 -3.53 0.00 -1.26 -5.31 105.19 102.72 1yx5 n GLY 75 Ca 0.10 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.26 1yx5 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93