#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nvu s LEU 2 N 0.00 4.30 0.16 -0.89 0.05 -1.26 -1.14 118.68 119.90 2nvu s LEU 2 Ca 0.00 0.76 0.07 0.00 0.05 0.00 0.00 54.13 55.02 2nvu s LEU 2 Cb 0.00 -2.60 -0.04 0.00 -2.05 0.00 0.00 46.19 41.50 2nvu s LEU 2 CO 0.00 0.08 -0.16 0.27 -0.55 0.00 0.00 176.35 175.99 2nvu s ILE 3 N 0.31 1.64 -0.07 1.48 -4.36 -0.11 -3.98 121.20 116.11 2nvu s ILE 3 Ca 0.23 -1.96 0.01 0.00 -0.26 0.00 0.00 60.65 58.67 2nvu s ILE 3 Cb -0.15 -1.82 -0.03 0.00 1.25 0.00 0.00 42.46 41.71 2nvu s ILE 3 CO 0.09 -0.45 -0.08 -0.54 0.24 0.00 0.00 174.94 174.21 2nvu s LYS 4 N -3.06 2.74 -0.08 0.37 1.02 -0.40 -1.30 119.74 119.02 2nvu s LYS 4 Ca 0.16 -0.56 0.02 0.00 0.02 0.00 0.00 55.97 55.60 2nvu s LYS 4 Cb -0.04 -2.57 0.02 0.00 -0.52 0.00 0.00 37.83 34.72 2nvu s LYS 4 CO 0.05 0.65 -0.11 0.54 -0.92 0.00 0.00 175.35 175.57 2nvu s VAL 5 N -0.78 1.10 -0.15 3.17 0.11 -0.85 0.19 120.40 123.20 2nvu s VAL 5 Ca 0.12 -0.43 -0.11 0.00 -2.93 0.00 0.00 61.98 58.64 2nvu s VAL 5 Cb -0.11 -1.04 -0.05 0.00 -1.53 0.00 0.00 36.38 33.66 2nvu s VAL 5 CO 0.01 0.36 0.21 -0.54 -3.33 0.00 0.00 175.10 171.81 2nvu s LYS 6 N 0.95 3.96 0.94 1.54 1.02 0.24 -1.46 119.74 126.93 2nvu s LYS 6 Ca -0.09 -0.04 -0.14 0.00 0.02 0.00 0.00 55.97 55.72 2nvu s LYS 6 Cb -0.15 -3.33 0.20 0.00 -0.52 0.00 0.00 37.83 34.03 2nvu s LYS 6 CO 0.00 0.46 1.29 0.95 -0.92 0.00 0.00 175.35 177.13 2nvu s THR 7 N -0.16 2.01 -2.00 2.17 -4.23 0.13 -0.75 115.64 112.81 2nvu s THR 7 Ca 0.14 -0.11 0.13 0.00 -1.18 0.00 0.00 61.69 60.68 2nvu s THR 7 Cb -0.12 -2.91 0.38 0.00 1.34 0.00 0.00 72.50 71.19 2nvu s THR 7 CO 0.03 0.00 1.22 0.18 -0.54 0.00 0.00 174.62 175.50 2nvu n LEU 8 N -3.66 0.00 -0.40 4.79 4.77 -1.26 -1.15 117.00 120.08 2nvu n LEU 8 Ca 0.16 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 56.19 2nvu n LEU 8 Cb 0.59 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.73 2nvu n LEU 8 CO 0.44 0.00 0.41 0.35 -1.33 0.00 0.00 177.39 177.26 2nvu n THR 9 N -0.97 0.04 -0.37 -5.08 -2.24 -1.26 -4.96 114.28 99.43 2nvu n THR 9 Ca 0.10 -0.52 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 2nvu n THR 9 Cb 0.05 1.18 0.00 0.00 -2.10 0.00 0.00 70.33 69.46 2nvu n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2nvu n GLY 10 N 0.55 1.02 3.72 3.38 0.00 -0.30 -5.01 105.19 108.54 2nvu n GLY 10 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 2nvu n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2nvu s LYS 11 N -0.46 4.41 -0.17 1.61 2.20 -1.26 -4.72 119.74 121.35 2nvu s LYS 11 Ca 0.00 1.87 -0.04 0.00 -0.36 0.00 0.00 55.97 57.44 2nvu s LYS 11 Cb 0.00 -3.30 -0.02 0.00 -1.51 0.00 0.00 37.83 32.99 2nvu s LYS 11 CO 0.00 -0.28 -0.04 -2.00 -0.36 0.00 0.00 175.35 172.67 2nvu s GLU 12 N 0.89 3.61 0.19 4.03 2.12 -1.26 0.23 118.70 128.50 2nvu s GLU 12 Ca 0.60 -0.54 0.10 0.00 0.36 0.00 0.00 54.97 55.49 2nvu s GLU 12 Cb -0.32 -2.94 -0.04 0.00 0.26 0.00 0.00 34.13 31.08 2nvu s GLU 12 CO 0.31 0.14 -0.17 0.96 -0.54 0.00 0.00 175.26 175.95 2nvu s ILE 13 N 0.62 2.73 -0.16 -3.70 -4.36 -0.53 -4.95 121.20 110.85 2nvu s ILE 13 Ca -0.02 -1.89 -0.07 0.00 -0.26 0.00 0.00 60.65 58.40 2nvu s ILE 13 Cb -0.14 -2.33 -0.04 0.00 1.25 0.00 0.00 42.46 41.19 2nvu s ILE 13 CO 0.02 -0.13 0.10 -1.61 0.24 0.00 0.00 174.94 173.56 2nvu s GLU 14 N -2.78 3.78 0.04 0.37 2.02 -1.26 -2.00 118.70 118.87 2nvu s GLU 14 Ca 0.23 -0.26 0.05 0.00 0.02 0.00 0.00 54.97 55.01 2nvu s GLU 14 Cb -0.08 -3.22 -0.02 0.00 0.10 0.00 0.00 34.13 30.91 2nvu s GLU 14 CO 0.12 0.47 -0.14 0.42 0.02 0.00 0.00 175.26 176.15 2nvu s ILE 15 N -0.16 1.10 -0.25 -1.63 1.01 -0.42 -5.00 121.20 115.85 2nvu s ILE 15 Ca 0.09 -1.04 -0.09 0.00 0.00 0.00 0.00 60.65 59.61 2nvu s ILE 15 Cb -0.12 -1.00 -0.04 0.00 0.01 0.00 0.00 42.46 41.31 2nvu s ILE 15 CO 0.01 -0.03 0.11 -1.81 0.00 0.00 0.00 174.94 173.22 2nvu s ASP 16 N -1.22 5.59 0.10 3.58 1.11 -1.26 -0.94 116.67 123.63 2nvu s ASP 16 Ca 0.01 -0.06 0.02 0.00 0.18 0.00 0.00 52.55 52.69 2nvu s ASP 16 Cb -0.08 -2.01 -0.04 0.00 1.07 0.00 0.00 42.92 41.86 2nvu s ASP 16 CO 0.01 0.01 -0.06 -0.51 1.18 0.00 0.00 175.17 175.80 2nvu s ILE 17 N 1.39 0.67 -0.04 0.77 1.10 -0.29 -5.00 121.20 119.79 2nvu s ILE 17 Ca 0.06 -1.92 0.06 0.00 -0.51 0.00 0.00 60.65 58.33 2nvu s ILE 17 Cb -0.15 -1.67 -0.02 0.00 0.15 0.00 0.00 42.46 40.77 2nvu s ILE 17 CO 0.05 -0.88 -0.21 -1.61 -2.11 0.00 0.00 174.94 170.19 2nvu s GLU 18 N -3.83 2.40 0.58 3.50 0.41 -1.26 -3.06 118.70 117.45 2nvu s GLU 18 Ca 0.11 -0.83 0.37 0.00 -0.41 0.00 0.00 54.97 54.22 2nvu s GLU 18 Cb 0.05 -2.22 1.31 0.00 -1.78 0.00 0.00 34.13 31.50 2nvu s GLU 18 CO -0.05 0.53 1.47 -1.35 -0.49 0.00 0.00 175.26 175.38 2nvu h PRO 19 N 5.60 0.00 0.00 0.39 0.11 -1.94 0.64 132.00 136.80 2nvu h PRO 19 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2nvu h PRO 19 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2nvu h PRO 19 CO 0.49 0.00 -0.54 -2.37 -0.21 0.00 0.00 178.00 175.37 2nvu n THR 20 N -3.60 0.38 -1.80 -1.15 5.66 -1.26 -1.46 114.28 111.05 2nvu n THR 20 Ca 0.31 -0.27 -0.38 0.00 -3.05 0.00 0.00 64.05 60.66 2nvu n THR 20 Cb 1.66 -0.18 0.05 0.00 -1.55 0.00 0.00 70.33 70.30 2nvu n THR 20 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2nvu s ASP 21 N -4.24 5.12 0.41 1.09 1.01 0.22 -4.76 116.67 115.53 2nvu s ASP 21 Ca 0.07 2.70 -0.15 0.00 0.71 0.00 0.00 52.55 55.87 2nvu s ASP 21 Cb 0.13 -2.63 -0.08 0.00 1.01 0.00 0.00 42.92 41.35 2nvu s ASP 21 CO 0.70 -1.67 0.85 -0.54 0.21 0.00 0.00 175.17 174.72 2nvu s LYS 22 N -3.05 3.97 0.43 8.23 1.02 -1.26 -1.25 119.74 127.83 2nvu s LYS 22 Ca 0.75 0.77 0.12 0.00 0.02 0.00 0.00 55.97 57.62 2nvu s LYS 22 Cb -0.39 -2.30 0.98 0.00 -0.52 0.00 0.00 37.83 35.60 2nvu s LYS 22 CO 0.44 -0.04 2.02 0.28 -0.92 0.00 0.00 175.35 177.13 2nvu h VAL 23 N 1.45 0.97 0.00 3.17 2.07 -1.31 0.04 116.25 122.65 2nvu h VAL 23 Ca -0.48 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 66.89 2nvu h VAL 23 Cb 1.18 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 31.45 2nvu h VAL 23 CO 0.63 0.08 0.00 1.05 0.02 0.00 0.00 177.57 179.35 2nvu h GLU 24 N 0.44 0.00 -0.05 1.57 4.11 -1.83 -2.32 114.58 116.50 2nvu h GLU 24 Ca 0.22 0.00 -0.22 0.00 0.07 0.00 0.00 59.36 59.43 2nvu h GLU 24 Cb 0.31 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.57 2nvu h GLU 24 CO -0.06 0.00 -0.84 -0.09 0.07 0.00 0.00 179.01 178.10 2nvu h ARG 25 N 0.00 0.65 -0.56 1.06 9.65 -1.32 -1.43 114.38 122.43 2nvu h ARG 25 Ca 0.00 -0.64 0.09 0.00 -1.10 0.00 0.00 59.98 58.33 2nvu h ARG 25 Cb 0.57 0.16 -0.07 0.00 -1.39 0.00 0.00 29.97 29.24 2nvu h ARG 25 CO 0.00 1.24 0.19 0.82 2.80 0.00 0.00 179.97 185.02 2nvu h ILE 26 N 0.31 0.78 -0.39 1.20 2.04 -1.12 0.23 117.51 120.56 2nvu h ILE 26 Ca -0.09 -0.13 0.03 0.00 1.00 0.00 0.00 64.86 65.68 2nvu h ILE 26 Cb 1.49 0.38 -0.04 0.00 -0.74 0.00 0.00 36.82 37.91 2nvu h ILE 26 CO 0.17 0.07 0.18 0.11 0.00 0.00 0.00 178.15 178.67 2nvu h LYS 27 N 0.37 0.35 -0.64 2.37 1.57 -1.33 0.34 116.57 119.60 2nvu h LYS 27 Ca 0.28 -0.02 0.03 0.00 -1.87 0.00 0.00 60.65 59.07 2nvu h LYS 27 Cb 0.34 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.53 2nvu h LYS 27 CO -0.30 0.23 0.39 0.93 -0.57 0.00 0.00 179.45 180.14 2nvu h GLU 28 N 0.36 0.74 -0.85 3.15 5.08 0.07 0.15 114.58 123.29 2nvu h GLU 28 Ca 0.17 -0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.51 2nvu h GLU 28 Cb 0.10 -0.17 -0.05 0.00 0.50 0.00 0.00 28.75 29.14 2nvu h GLU 28 CO -0.14 0.49 0.56 0.00 -1.00 0.00 0.00 179.01 178.93 2nvu h ARG 29 N 0.77 1.06 -0.03 2.33 2.47 0.35 -0.86 114.38 120.46 2nvu h ARG 29 Ca 0.26 -0.06 -0.00 0.00 -1.26 0.00 0.00 59.98 58.91 2nvu h ARG 29 Cb 0.03 -0.24 -0.00 0.00 -1.65 0.00 0.00 29.97 28.11 2nvu h ARG 29 CO -0.11 0.70 0.01 0.28 0.56 0.00 0.00 179.97 181.41 2nvu h VAL 30 N 1.10 1.18 -0.52 2.04 2.07 0.66 -3.02 116.25 119.76 2nvu h VAL 30 Ca 0.33 -0.53 0.07 0.00 0.82 0.00 0.00 66.70 67.38 2nvu h VAL 30 Cb -0.04 1.48 -0.03 0.00 -1.52 0.00 0.00 31.29 31.18 2nvu h VAL 30 CO -0.09 0.14 0.35 -0.08 0.02 0.00 0.00 177.57 177.92 2nvu h GLU 31 N -0.16 0.42 -0.63 1.57 4.81 -0.05 -0.10 114.58 120.45 2nvu h GLU 31 Ca 0.01 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.25 2nvu h GLU 31 Cb 0.23 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.47 2nvu h GLU 31 CO -0.00 0.28 0.38 1.49 -0.73 0.00 0.00 179.01 180.43 2nvu h GLU 32 N 0.44 0.71 0.02 1.92 4.81 -1.05 0.19 114.58 121.62 2nvu h GLU 32 Ca 0.23 -0.04 -0.30 0.00 -0.13 0.00 0.00 59.36 59.12 2nvu h GLU 32 Cb 0.35 -0.16 -0.04 0.00 0.63 0.00 0.00 28.75 29.52 2nvu h GLU 32 CO -0.06 0.47 -1.72 0.87 -0.73 0.00 0.00 179.01 177.84 2nvu h LYS 33 N 0.73 0.05 0.00 1.92 1.57 -1.37 -3.41 116.57 116.05 2nvu h LYS 33 Ca 0.26 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 2nvu h LYS 33 Cb 0.06 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.39 2nvu h LYS 33 CO -0.12 0.63 -0.72 0.39 -0.57 0.00 0.00 179.45 179.07 2nvu n GLU 34 N -3.13 2.96 -1.00 3.15 -0.58 -0.12 -5.01 120.64 116.92 2nvu n GLU 34 Ca -0.18 -0.03 0.00 0.00 -0.42 0.00 0.00 57.16 56.53 2nvu n GLU 34 Cb 1.05 -1.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.92 2nvu n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2nvu n GLY 35 N 1.45 0.63 3.57 0.62 0.00 0.67 -4.99 105.19 107.16 2nvu n GLY 35 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2nvu n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2nvu s ILE 36 N -2.53 4.01 -0.35 -0.61 1.01 -1.26 -4.96 121.20 116.51 2nvu s ILE 36 Ca 0.00 0.83 -0.41 0.00 0.00 0.00 0.00 60.65 61.07 2nvu s ILE 36 Cb 0.00 -4.74 -0.16 0.00 0.01 0.00 0.00 42.46 37.57 2nvu s ILE 36 CO 0.00 -1.38 1.83 -2.65 0.00 0.00 0.00 174.94 172.74 2nvu n PRO 37 N 8.48 0.85 0.31 2.79 -0.02 -1.26 -4.22 135.00 141.93 2nvu n PRO 37 Ca 0.08 0.30 0.13 0.00 -2.02 0.00 0.00 63.50 61.99 2nvu n PRO 37 Cb 0.49 -2.00 0.72 0.00 -0.02 0.00 0.00 33.50 32.69 2nvu n PRO 37 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2nvu h PRO 38 N 7.79 0.00 -0.03 0.52 0.13 -1.93 0.57 132.00 139.05 2nvu h PRO 38 Ca -0.40 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.68 2nvu h PRO 38 Cb 1.34 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.46 2nvu h PRO 38 CO 0.99 0.00 -0.25 -0.56 -0.23 0.00 0.00 178.00 177.95 2nvu h GLN 39 N 0.00 0.05 -0.64 0.86 -0.00 -1.99 -2.59 115.11 110.80 2nvu h GLN 39 Ca 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 58.65 58.64 2nvu h GLN 39 Cb 0.70 -0.01 0.00 0.00 -0.00 0.00 0.00 27.48 28.17 2nvu h GLN 39 CO 0.00 0.30 0.00 0.00 -0.00 0.00 0.00 178.83 179.13 2nvu n GLN 40 N -4.22 3.56 -3.33 0.06 10.64 0.19 -4.94 117.38 119.33 2nvu n GLN 40 Ca -0.02 -2.83 -0.38 0.00 -1.83 0.00 0.00 57.00 51.94 2nvu n GLN 40 Cb 0.31 -1.83 -0.06 0.00 -0.86 0.00 0.00 30.24 27.81 2nvu n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.83 0.00 0.00 177.06 174.58 2nvu s GLN 41 N -1.73 4.17 -0.20 2.61 -0.21 -0.98 -5.00 119.66 118.32 2nvu s GLN 41 Ca 0.50 0.59 -0.02 0.00 0.02 0.00 0.00 55.36 56.45 2nvu s GLN 41 Cb 0.31 -3.29 0.06 0.00 1.00 0.00 0.00 33.01 31.09 2nvu s GLN 41 CO 0.25 0.50 0.01 1.03 -2.12 0.00 0.00 175.29 174.97 2nvu s ARG 42 N -0.57 0.88 -0.14 2.91 1.81 -1.26 -5.04 118.95 117.54 2nvu s ARG 42 Ca 0.27 -0.52 -0.07 0.00 -1.72 0.00 0.00 55.73 53.69 2nvu s ARG 42 Cb -0.18 -2.17 -0.04 0.00 -0.45 0.00 0.00 34.95 32.12 2nvu s ARG 42 CO 0.15 -0.61 0.10 -0.51 -0.68 0.00 0.00 175.30 173.75 2nvu s LEU 43 N 1.76 4.11 0.07 2.53 1.43 -1.26 -0.28 118.68 127.03 2nvu s LEU 43 Ca -0.02 0.29 0.08 0.00 -1.03 0.00 0.00 54.13 53.46 2nvu s LEU 43 Cb -0.17 -2.01 -0.03 0.00 0.03 0.00 0.00 46.19 44.00 2nvu s LEU 43 CO -0.07 0.31 -0.20 -0.63 0.23 0.00 0.00 176.35 175.99 2nvu s ILE 44 N -0.46 2.65 -0.22 -0.59 -1.09 -0.09 -1.56 121.20 119.84 2nvu s ILE 44 Ca 0.11 -1.34 -0.06 0.00 -2.23 0.00 0.00 60.65 57.13 2nvu s ILE 44 Cb -0.12 -2.13 0.11 0.00 -1.58 0.00 0.00 42.46 38.74 2nvu s ILE 44 CO 0.02 0.27 0.45 -0.47 -1.23 0.00 0.00 174.94 173.97 2nvu s TYR 45 N -0.97 -0.92 -1.49 3.97 5.04 -0.38 -2.68 117.35 119.93 2nvu s TYR 45 Ca 0.15 1.50 -0.08 0.00 -2.44 0.00 0.00 57.07 56.19 2nvu s TYR 45 Cb -0.10 0.32 0.06 0.00 0.35 0.00 0.00 41.96 42.59 2nvu s TYR 45 CO 0.06 -0.57 0.73 0.45 -1.34 0.00 0.00 175.55 174.88 2nvu n SER 46 N 5.40 -2.53 0.00 4.32 2.88 -1.26 -1.63 113.62 120.80 2nvu n SER 46 Ca -0.07 -0.90 0.00 0.00 -1.33 0.00 0.00 58.87 56.57 2nvu n SER 46 Cb 0.50 -3.46 0.00 0.00 -0.75 0.00 0.00 64.21 60.50 2nvu n SER 46 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2nvu n GLY 47 N -1.69 2.45 3.80 0.46 0.00 -1.26 -5.02 105.19 103.94 2nvu n GLY 47 Ca -0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.57 2nvu n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nvu s LYS 48 N -0.00 3.16 -0.28 1.61 1.02 -0.64 -5.07 119.74 119.53 2nvu s LYS 48 Ca 0.00 -0.40 -0.11 0.00 0.02 0.00 0.00 55.97 55.48 2nvu s LYS 48 Cb 0.00 -2.93 -0.05 0.00 -0.52 0.00 0.00 37.83 34.33 2nvu s LYS 48 CO 0.00 0.68 0.21 1.14 -0.92 0.00 0.00 175.35 176.46 2nvu s GLN 49 N -1.54 3.96 0.06 1.68 -2.07 -1.26 -1.24 119.66 119.25 2nvu s GLN 49 Ca 0.21 -0.29 -0.30 0.00 -1.82 0.00 0.00 55.36 53.16 2nvu s GLN 49 Cb -0.12 -3.66 -0.09 0.00 -1.09 0.00 0.00 33.01 28.05 2nvu s GLN 49 CO 0.11 -0.19 1.86 -1.64 -1.32 0.00 0.00 175.29 174.12 2nvu s MET 50 N 1.79 4.15 0.35 9.60 -1.94 -0.60 -5.00 119.30 127.64 2nvu s MET 50 Ca 0.08 2.54 -0.26 0.00 -1.71 0.00 0.00 55.69 56.34 2nvu s MET 50 Cb -0.16 -3.90 -0.09 0.00 2.01 0.00 0.00 34.83 32.69 2nvu s MET 50 CO 0.11 -0.89 1.07 1.21 -0.01 0.00 0.00 175.02 176.51 2nvu s ASN 51 N 3.56 6.96 0.45 3.03 3.84 -1.26 -4.76 114.94 126.76 2nvu s ASN 51 Ca 0.83 2.13 0.17 0.00 0.21 0.00 0.00 52.86 56.20 2nvu s ASN 51 Cb -0.43 -2.60 1.05 0.00 -0.55 0.00 0.00 41.25 38.72 2nvu s ASN 51 CO 0.38 -0.35 1.98 0.44 -2.79 0.00 0.00 177.10 176.75 2nvu h ASP 52 N 3.03 0.00 0.13 -4.21 5.19 -1.94 -3.09 116.42 115.53 2nvu h ASP 52 Ca -0.48 0.00 -0.28 0.00 -0.62 0.00 0.00 57.03 55.66 2nvu h ASP 52 Cb 1.21 0.00 0.02 0.00 0.18 0.00 0.00 39.33 40.75 2nvu h ASP 52 CO 0.64 0.21 -1.12 -0.33 -3.12 0.00 0.00 179.24 175.52 2nvu h GLU 53 N 0.00 0.61 -7.21 3.56 4.39 -1.97 -3.16 114.58 110.80 2nvu h GLU 53 Ca -0.00 -0.73 -0.46 0.00 0.34 0.00 0.00 59.36 58.51 2nvu h GLU 53 Cb 0.40 0.23 0.20 0.00 -0.10 0.00 0.00 28.75 29.47 2nvu h GLU 53 CO 0.03 1.31 0.09 0.15 -1.16 0.00 0.00 179.01 179.43 2nvu s LYS 54 N -3.15 -0.24 0.32 2.33 3.01 -1.17 -4.71 119.74 116.13 2nvu s LYS 54 Ca -0.09 0.91 0.09 0.00 -1.01 0.00 0.00 55.97 55.87 2nvu s LYS 54 Cb 0.07 -1.63 -0.05 0.00 -1.01 0.00 0.00 37.83 35.21 2nvu s LYS 54 CO 0.92 -3.29 0.02 -0.08 0.51 0.00 0.00 175.35 173.43 2nvu s THR 55 N -2.60 2.84 0.58 2.17 -1.32 -1.26 -1.60 115.64 114.45 2nvu s THR 55 Ca 0.67 -1.93 0.29 0.00 -1.21 0.00 0.00 61.69 59.51 2nvu s THR 55 Cb -0.23 -2.81 0.39 0.00 -1.51 0.00 0.00 72.50 68.34 2nvu s THR 55 CO 0.62 -0.24 1.90 0.00 -2.21 0.00 0.00 174.62 174.69 2nvu h ALA 56 N 1.80 2.24 0.04 11.08 0.00 -1.25 -1.30 119.26 131.87 2nvu h ALA 56 Ca -0.43 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.46 2nvu h ALA 56 Cb 1.25 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2nvu h ALA 56 CO 0.65 -0.74 -0.02 0.00 0.00 0.00 0.00 179.25 179.14 2nvu h ALA 57 N 1.48 -0.05 -0.69 0.00 0.00 -1.52 -2.52 119.26 115.96 2nvu h ALA 57 Ca 0.23 -0.30 0.20 0.00 0.00 0.00 0.00 54.91 55.04 2nvu h ALA 57 Cb 1.20 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.98 2nvu h ALA 57 CO -0.00 -0.20 0.62 -0.44 0.00 0.00 0.00 179.25 179.23 2nvu h ASP 58 N -0.70 0.00 -0.49 0.00 3.32 -1.53 1.18 116.42 118.21 2nvu h ASP 58 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2nvu h ASP 58 Cb 0.62 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.17 2nvu h ASP 58 CO 0.01 0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 176.31 2nvu n TYR 59 N -3.87 0.63 -3.89 4.55 4.02 -1.19 -4.97 117.16 112.44 2nvu n TYR 59 Ca 0.14 -0.32 -0.26 0.00 -0.01 0.00 0.00 57.90 57.45 2nvu n TYR 59 Cb 0.88 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 40.19 2nvu n TYR 59 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 2nvu n LYS 60 N 1.54 -3.10 -2.53 -0.72 5.02 0.41 -4.89 118.16 113.88 2nvu n LYS 60 Ca 0.21 0.43 -0.43 0.00 -2.02 0.00 0.00 58.31 56.50 2nvu n LYS 60 Cb 0.61 -4.50 -0.02 0.00 -0.02 0.00 0.00 35.03 31.10 2nvu n LYS 60 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2nvu s ILE 61 N -3.85 4.43 0.72 -0.18 1.01 -0.96 -5.02 121.20 117.35 2nvu s ILE 61 Ca 0.08 1.71 -0.01 0.00 0.00 0.00 0.00 60.65 62.43 2nvu s ILE 61 Cb -0.03 -4.17 0.13 0.00 0.01 0.00 0.00 42.46 38.39 2nvu s ILE 61 CO 0.88 -0.23 0.99 -0.76 0.00 0.00 0.00 174.94 175.82 2nvu s LEU 62 N 3.52 2.98 0.00 2.97 1.43 -1.26 -4.93 118.68 123.38 2nvu s LEU 62 Ca 0.50 -0.34 0.00 0.00 -1.03 0.00 0.00 54.13 53.26 2nvu s LEU 62 Cb -0.18 -2.01 0.00 0.00 0.03 0.00 0.00 46.19 44.03 2nvu s LEU 62 CO 0.13 -1.86 0.00 0.61 0.23 0.00 0.00 176.35 175.46 2nvu n GLY 63 N -2.84 0.00 1.50 -3.19 0.00 -1.26 -2.68 105.19 96.72 2nvu n GLY 63 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2nvu n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nvu n GLY 64 N 0.00 2.25 3.79 -0.02 0.00 -1.26 -4.01 105.19 105.93 2nvu n GLY 64 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2nvu n GLY 64 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2nvu s SER 65 N 1.91 5.27 -0.13 1.61 0.01 -1.09 -4.82 113.70 116.46 2nvu s SER 65 Ca 0.00 1.88 0.03 0.00 1.31 0.00 0.00 55.95 59.17 2nvu s SER 65 Cb 0.00 -2.54 0.01 0.00 0.21 0.00 0.00 66.02 63.70 2nvu s SER 65 CO 0.00 -1.52 -0.22 -0.69 0.41 0.00 0.00 173.24 171.23 2nvu s VAL 66 N -2.52 2.02 0.06 3.43 1.01 -1.26 -1.28 120.40 121.87 2nvu s VAL 66 Ca 0.64 -0.96 0.02 0.00 0.00 0.00 0.00 61.98 61.68 2nvu s VAL 66 Cb -0.18 -1.78 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 2nvu s VAL 66 CO 0.43 0.54 0.11 -0.76 0.00 0.00 0.00 175.10 175.42 2nvu s LEU 67 N 0.77 3.94 -0.04 3.92 1.43 0.50 -4.86 118.68 124.34 2nvu s LEU 67 Ca -0.08 0.08 0.05 0.00 -1.03 0.00 0.00 54.13 53.15 2nvu s LEU 67 Cb -0.16 -2.55 -0.01 0.00 0.03 0.00 0.00 46.19 43.51 2nvu s LEU 67 CO -0.01 0.19 -0.20 -1.00 0.23 0.00 0.00 176.35 175.57 2nvu s HIS 68 N -1.38 1.92 0.20 0.29 3.76 -1.09 0.80 115.29 119.79 2nvu s HIS 68 Ca 0.29 -0.53 -0.21 0.00 -0.15 0.00 0.00 55.06 54.47 2nvu s HIS 68 Cb -0.12 -1.27 -0.08 0.00 1.11 0.00 0.00 32.58 32.21 2nvu s HIS 68 CO 0.22 -0.16 0.72 -0.51 -0.85 0.00 0.00 174.74 174.16 2nvu s LEU 69 N -0.11 4.41 0.29 0.89 1.43 0.07 -0.91 118.68 124.75 2nvu s LEU 69 Ca -0.02 1.45 0.04 0.00 -1.03 0.00 0.00 54.13 54.57 2nvu s LEU 69 Cb -0.11 -3.47 -0.03 0.00 0.03 0.00 0.00 46.19 42.60 2nvu s LEU 69 CO 0.02 0.09 0.20 -0.69 0.23 0.00 0.00 176.35 176.20 2nvu s VAL 70 N -1.42 0.10 0.16 -1.59 1.01 0.61 -4.49 120.40 114.79 2nvu s VAL 70 Ca 0.40 -2.00 -0.24 0.00 0.00 0.00 0.00 61.98 60.15 2nvu s VAL 70 Cb -0.18 -2.50 0.06 0.00 0.00 0.00 0.00 36.38 33.77 2nvu s VAL 70 CO 0.22 0.00 0.70 -0.22 0.00 0.00 0.00 175.10 175.80 2nvu s LEU 71 N -3.33 -0.44 -0.08 3.92 2.96 -1.26 -4.25 118.68 116.20 2nvu s LEU 71 Ca 0.38 -0.16 0.01 0.00 -0.22 0.00 0.00 54.13 54.14 2nvu s LEU 71 Cb 0.04 2.50 0.02 0.00 0.50 0.00 0.00 46.19 49.25 2nvu s LEU 71 CO 0.21 -0.99 -0.10 0.00 -1.32 0.00 0.00 176.35 174.15 2nvu s ALA 72 N -3.65 1.21 -0.03 5.97 0.00 -1.26 -5.13 121.76 118.87 2nvu s ALA 72 Ca 0.05 -0.42 -0.03 0.00 0.00 0.00 0.00 51.96 51.56 2nvu s ALA 72 Cb -0.02 -0.68 -0.04 0.00 0.00 0.00 0.00 23.12 22.38 2nvu s ALA 72 CO -0.07 -0.10 0.15 -0.51 0.00 0.00 0.00 175.76 175.23 2nvu s LEU 73 N 1.09 4.28 0.00 0.00 1.02 -1.26 -5.02 118.68 118.79 2nvu s LEU 73 Ca -0.07 0.33 0.15 0.00 0.02 0.00 0.00 54.13 54.56 2nvu s LEU 73 Cb -0.14 -2.44 -0.10 0.00 0.02 0.00 0.00 46.19 43.53 2nvu s LEU 73 CO -0.01 0.29 0.71 -2.11 0.02 0.00 0.00 176.35 175.25 2nvu n ARG 74 N 1.20 1.97 -1.74 1.70 1.85 -1.26 -4.98 116.66 115.41 2nvu n ARG 74 Ca -0.13 -0.30 -0.34 0.00 -1.00 0.00 0.00 57.85 56.07 2nvu n ARG 74 Cb 0.53 -1.22 0.06 0.00 -1.05 0.00 0.00 32.46 30.78 2nvu n ARG 74 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 2nvu s GLY 75 N -2.18 2.38 0.00 2.89 0.00 -1.26 -5.40 107.32 103.75 2nvu s GLY 75 Ca 0.08 0.78 0.24 0.00 0.00 0.00 0.00 44.72 45.83 2nvu s GLY 75 CO 0.52 1.16 1.32 0.61 0.00 0.00 0.00 173.10 176.71