#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nhk s ILE 3 N 0.00 3.59 0.26 0.00 -1.09 -1.26 -0.53 121.20 122.17 1nhk s ILE 3 Ca 0.00 1.02 0.04 0.00 -2.23 0.00 0.00 60.65 59.47 1nhk s ILE 3 Cb 0.00 -3.65 -0.06 0.00 -1.58 0.00 0.00 42.46 37.17 1nhk s ILE 3 CO 0.00 0.01 0.02 -1.61 -1.23 0.00 0.00 174.94 172.13 1nhk s GLU 4 N 2.19 1.45 -0.04 2.79 2.02 0.12 -4.91 118.70 122.32 1nhk s GLU 4 Ca 0.65 -1.76 0.06 0.00 0.02 0.00 0.00 54.97 53.94 1nhk s GLU 4 Cb -0.33 -0.68 -0.01 0.00 0.10 0.00 0.00 34.13 33.21 1nhk s GLU 4 CO 0.28 -0.13 -0.23 1.03 0.02 0.00 0.00 175.26 176.22 1nhk s ARG 5 N -3.88 2.24 0.08 1.61 0.52 -1.26 -1.60 118.95 116.65 1nhk s ARG 5 Ca 0.32 -0.84 0.01 0.00 -0.52 0.00 0.00 55.73 54.69 1nhk s ARG 5 Cb 0.07 -1.98 -0.04 0.00 0.52 0.00 0.00 34.95 33.52 1nhk s ARG 5 CO 0.11 0.40 -0.05 -0.08 0.02 0.00 0.00 175.30 175.71 1nhk s THR 6 N -0.25 0.48 -0.11 0.02 -1.32 -0.37 -4.78 115.64 109.31 1nhk s THR 6 Ca 0.00 -1.88 -0.09 0.00 -1.21 0.00 0.00 61.69 58.51 1nhk s THR 6 Cb -0.12 -1.62 -0.04 0.00 -1.51 0.00 0.00 72.50 69.21 1nhk s THR 6 CO 0.02 -0.92 0.19 -0.22 -2.21 0.00 0.00 174.62 171.47 1nhk s LEU 7 N -2.99 4.37 -0.02 9.08 2.96 -1.26 -1.07 118.68 129.76 1nhk s LEU 7 Ca 0.10 0.52 0.04 0.00 -0.22 0.00 0.00 54.13 54.57 1nhk s LEU 7 Cb 0.06 -2.17 -0.01 0.00 0.50 0.00 0.00 46.19 44.58 1nhk s LEU 7 CO -0.07 0.35 -0.15 -0.55 -1.32 0.00 0.00 176.35 174.61 1nhk s SER 8 N -0.77 1.76 -0.08 3.68 0.15 -0.04 -1.83 113.70 116.57 1nhk s SER 8 Ca 0.16 -0.28 0.01 0.00 0.70 0.00 0.00 55.95 56.54 1nhk s SER 8 Cb -0.13 -0.27 0.02 0.00 -1.71 0.00 0.00 66.02 63.93 1nhk s SER 8 CO 0.05 0.17 -0.09 -0.63 1.20 0.00 0.00 173.24 173.93 1nhk s ILE 9 N -0.23 1.02 -0.38 6.45 1.01 -0.52 -0.25 121.20 128.30 1nhk s ILE 9 Ca 0.03 -0.36 -0.21 0.00 0.00 0.00 0.00 60.65 60.12 1nhk s ILE 9 Cb -0.07 -0.99 0.01 0.00 0.01 0.00 0.00 42.46 41.42 1nhk s ILE 9 CO -0.00 0.35 0.65 -0.63 0.00 0.00 0.00 174.94 175.31 1nhk s ILE 10 N 1.11 4.86 0.89 2.92 1.01 0.49 -1.27 121.20 131.20 1nhk s ILE 10 Ca -0.06 0.49 -0.11 0.00 0.00 0.00 0.00 60.65 60.97 1nhk s ILE 10 Cb -0.14 -4.12 0.12 0.00 0.01 0.00 0.00 42.46 38.33 1nhk s ILE 10 CO -0.01 -0.40 1.10 -0.54 0.00 0.00 0.00 174.94 175.08 1nhk s LYS 11 N 2.78 1.33 0.33 2.79 1.02 0.57 -1.75 119.74 126.81 1nhk s LYS 11 Ca 0.25 1.04 0.11 0.00 0.02 0.00 0.00 55.97 57.39 1nhk s LYS 11 Cb -0.14 -1.80 0.99 0.00 -0.52 0.00 0.00 37.83 36.36 1nhk s LYS 11 CO 0.16 -2.25 1.66 -1.35 -0.92 0.00 0.00 175.35 172.65 1nhk h PRO 12 N -1.57 0.29 -0.11 -1.68 0.11 -1.86 0.76 132.00 127.94 1nhk h PRO 12 Ca -0.48 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.57 1nhk h PRO 12 Cb 1.27 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1nhk h PRO 12 CO 0.51 0.19 -0.13 0.38 -0.21 0.00 0.00 178.00 178.75 1nhk h ASP 13 N 0.30 0.16 -0.53 -2.05 2.03 -1.90 -1.77 116.42 112.65 1nhk h ASP 13 Ca 0.69 -0.03 -0.08 0.00 -0.73 0.00 0.00 57.03 56.88 1nhk h ASP 13 Cb 1.52 -0.04 -0.02 0.00 -0.83 0.00 0.00 39.33 39.96 1nhk h ASP 13 CO -0.62 0.31 0.05 1.23 -1.03 0.00 0.00 179.24 179.18 1nhk h GLY 14 N 0.65 1.01 0.76 7.15 0.00 -1.07 -1.58 103.07 109.99 1nhk h GLY 14 Ca 0.03 -0.67 -0.09 0.00 0.00 0.00 0.00 47.33 46.61 1nhk h GLY 14 CO 0.02 0.62 -0.25 1.41 0.00 0.00 0.00 176.54 178.34 1nhk h LEU 15 N 0.88 0.45 -1.88 3.11 4.07 -1.40 -2.82 115.31 117.72 1nhk h LEU 15 Ca 0.17 -0.55 0.05 0.00 0.08 0.00 0.00 57.88 57.63 1nhk h LEU 15 Cb 0.44 -0.13 -0.01 0.00 1.08 0.00 0.00 40.66 42.04 1nhk h LEU 15 CO 0.02 0.92 0.19 -0.33 -1.08 0.00 0.00 178.44 178.15 1nhk h GLU 16 N 0.00 0.14 -0.00 1.13 5.08 -1.20 0.57 114.58 120.30 1nhk h GLU 16 Ca 0.01 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1nhk h GLU 16 Cb 0.84 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.06 1nhk h GLU 16 CO 0.06 0.09 -0.10 1.63 -1.00 0.00 0.00 179.01 179.69 1nhk n LYS 17 N -4.48 0.31 -2.96 2.33 5.02 -0.61 -4.93 118.16 112.84 1nhk n LYS 17 Ca 0.03 -0.07 -0.16 0.00 -2.02 0.00 0.00 58.31 56.09 1nhk n LYS 17 Cb 0.24 -1.50 0.04 0.00 -0.02 0.00 0.00 35.03 33.79 1nhk n LYS 17 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1nhk n GLY 18 N 1.38 -0.12 0.54 0.72 0.00 0.19 -4.93 105.19 102.96 1nhk n GLY 18 Ca 0.11 -0.11 0.06 0.00 0.00 0.00 0.00 46.02 46.08 1nhk n GLY 18 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1nhk n VAL 19 N -4.16 2.17 -0.00 1.61 0.24 -1.07 -4.75 118.33 112.36 1nhk n VAL 19 Ca -0.05 -2.78 -0.09 0.00 -2.04 0.00 0.00 64.34 59.38 1nhk n VAL 19 Cb 0.57 -0.25 -0.03 0.00 -1.47 0.00 0.00 33.84 32.65 1nhk n VAL 19 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 1nhk h ILE 20 N 0.75 0.69 -0.77 1.34 2.04 -1.90 -1.49 117.51 118.17 1nhk h ILE 20 Ca 0.03 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.91 1nhk h ILE 20 Cb 1.13 0.69 -0.04 0.00 -0.74 0.00 0.00 36.82 37.86 1nhk h ILE 20 CO 0.07 0.00 0.50 1.23 0.00 0.00 0.00 178.15 179.96 1nhk h GLY 21 N -0.12 1.09 1.15 5.37 0.00 -1.96 -1.88 103.07 106.71 1nhk h GLY 21 Ca 0.08 -0.39 -0.04 0.00 0.00 0.00 0.00 47.33 46.98 1nhk h GLY 21 CO -0.20 0.37 0.27 0.50 0.00 0.00 0.00 176.54 177.48 1nhk h LYS 22 N 1.01 1.08 -0.09 4.80 1.57 -1.81 -0.90 116.57 122.22 1nhk h LYS 22 Ca 0.29 -0.20 -0.02 0.00 -1.87 0.00 0.00 60.65 58.86 1nhk h LYS 22 Cb -0.08 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.06 1nhk h LYS 22 CO -0.08 0.89 -0.01 0.82 -0.57 0.00 0.00 179.45 180.50 1nhk h ILE 23 N 1.05 1.26 -1.01 1.86 2.04 -0.97 -2.40 117.51 119.35 1nhk h ILE 23 Ca 0.24 -0.84 0.02 0.00 1.00 0.00 0.00 64.86 65.28 1nhk h ILE 23 Cb 0.22 1.64 -0.05 0.00 -0.74 0.00 0.00 36.82 37.89 1nhk h ILE 23 CO -0.02 0.24 0.66 0.40 0.00 0.00 0.00 178.15 179.43 1nhk h ILE 24 N -0.12 1.22 -0.17 -0.67 2.04 -1.22 -1.50 117.51 117.08 1nhk h ILE 24 Ca 0.03 -0.45 -0.03 0.00 1.00 0.00 0.00 64.86 65.40 1nhk h ILE 24 Cb 0.37 -0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.23 1nhk h ILE 24 CO 0.01 0.24 -0.05 0.28 0.00 0.00 0.00 178.15 178.62 1nhk h SER 25 N 1.32 0.23 -0.66 1.72 0.02 -1.02 -0.72 113.55 114.44 1nhk h SER 25 Ca 0.38 -0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 61.30 1nhk h SER 25 Cb -0.08 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 62.36 1nhk h SER 25 CO -0.10 0.32 0.41 0.03 -1.14 0.00 0.00 176.83 176.35 1nhk h ARG 26 N 0.24 0.89 0.04 3.45 2.47 -0.75 -0.82 114.38 119.91 1nhk h ARG 26 Ca 0.06 -0.08 -0.00 0.00 -1.26 0.00 0.00 59.98 58.70 1nhk h ARG 26 Cb 0.26 -0.19 0.00 0.00 -1.65 0.00 0.00 29.97 28.39 1nhk h ARG 26 CO 0.01 0.63 -0.02 0.74 0.56 0.00 0.00 179.97 181.89 1nhk h PHE 27 N 0.89 -0.05 -0.79 3.04 0.04 -1.21 -3.03 116.94 115.84 1nhk h PHE 27 Ca 0.24 -0.00 0.08 0.00 2.80 0.00 0.00 57.97 61.09 1nhk h PHE 27 Cb -0.04 0.02 -0.07 0.00 2.20 0.00 0.00 35.95 38.06 1nhk h PHE 27 CO -0.02 0.41 0.45 0.93 -0.60 0.00 0.00 178.31 179.48 1nhk h GLU 28 N -0.54 0.75 0.00 1.51 5.08 -0.98 -0.14 114.58 120.26 1nhk h GLU 28 Ca -0.01 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1nhk h GLU 28 Cb 0.49 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.57 1nhk h GLU 28 CO 0.01 0.50 0.00 0.93 -1.00 0.00 0.00 179.01 179.45 1nhk h GLU 29 N 0.77 0.00 -0.64 2.33 5.08 -1.22 -2.50 114.58 118.40 1nhk h GLU 29 Ca 0.37 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.73 1nhk h GLU 29 Cb 0.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1nhk h GLU 29 CO -0.23 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.41 1nhk n LYS 30 N -2.58 2.67 -0.82 2.33 4.76 -0.21 -4.95 118.16 119.36 1nhk n LYS 30 Ca 0.02 -2.56 0.00 0.00 -2.87 0.00 0.00 58.31 52.90 1nhk n LYS 30 Cb 0.31 -1.55 0.00 0.00 -1.84 0.00 0.00 35.03 31.95 1nhk n LYS 30 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1nhk n GLY 31 N 1.59 0.56 3.34 0.72 0.00 -0.94 -5.01 105.19 105.44 1nhk n GLY 31 Ca 0.23 -0.23 -0.45 0.00 0.00 0.00 0.00 46.02 45.56 1nhk n GLY 31 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nhk s LEU 32 N 0.00 5.94 -0.21 0.99 1.43 -0.38 -4.56 118.68 121.89 1nhk s LEU 32 Ca 0.00 -1.64 -0.29 0.00 -1.03 0.00 0.00 54.13 51.17 1nhk s LEU 32 Cb 0.00 -2.23 0.00 0.00 0.03 0.00 0.00 46.19 43.99 1nhk s LEU 32 CO 0.00 -0.88 1.10 -0.75 0.23 0.00 0.00 176.35 176.06 1nhk s LYS 33 N 1.83 4.25 -0.26 1.70 2.20 0.10 -3.38 119.74 126.18 1nhk s LYS 33 Ca 0.05 1.44 -0.29 0.00 -0.36 0.00 0.00 55.97 56.81 1nhk s LYS 33 Cb -0.28 -3.68 -0.02 0.00 -1.51 0.00 0.00 37.83 32.34 1nhk s LYS 33 CO 0.04 -0.66 1.61 -2.14 -0.36 0.00 0.00 175.35 173.84 1nhk s PRO 34 N 3.30 3.71 0.00 4.03 0.02 -1.26 -0.50 135.00 144.29 1nhk s PRO 34 Ca 0.47 1.54 0.14 0.00 0.02 0.00 0.00 61.00 63.17 1nhk s PRO 34 Cb -0.17 -4.05 0.07 0.00 0.02 0.00 0.00 34.50 30.37 1nhk s PRO 34 CO 0.09 -1.40 0.89 1.33 -0.33 0.00 0.00 177.00 177.58 1nhk n VAL 35 N 6.62 0.00 -3.67 3.83 0.24 0.62 -4.95 118.33 121.02 1nhk n VAL 35 Ca 0.19 -0.45 -0.12 0.00 -2.04 0.00 0.00 64.34 61.92 1nhk n VAL 35 Cb 0.46 1.25 -0.08 0.00 -1.47 0.00 0.00 33.84 33.99 1nhk n VAL 35 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1nhk s ALA 36 N -1.37 -1.46 -0.15 2.33 0.00 -1.20 -0.16 121.76 119.75 1nhk s ALA 36 Ca 0.15 1.74 -0.10 0.00 0.00 0.00 0.00 51.96 53.75 1nhk s ALA 36 Cb 0.12 -1.02 0.05 0.00 0.00 0.00 0.00 23.12 22.26 1nhk s ALA 36 CO 0.24 -0.29 0.37 0.42 0.00 0.00 0.00 175.76 176.50 1nhk s ILE 37 N 0.62 -0.02 -0.24 0.00 1.01 -1.26 -1.43 121.20 119.89 1nhk s ILE 37 Ca -0.03 0.06 -0.10 0.00 0.00 0.00 0.00 60.65 60.58 1nhk s ILE 37 Cb -0.05 -0.54 0.09 0.00 0.01 0.00 0.00 42.46 41.98 1nhk s ILE 37 CO -0.04 0.02 0.54 -0.60 0.00 0.00 0.00 174.94 174.87 1nhk s ARG 38 N 0.85 0.50 0.03 2.79 3.52 -0.23 -5.00 118.95 121.41 1nhk s ARG 38 Ca -0.05 1.15 -0.27 0.00 -0.13 0.00 0.00 55.73 56.43 1nhk s ARG 38 Cb -0.06 0.36 -0.05 0.00 -1.56 0.00 0.00 34.95 33.64 1nhk s ARG 38 CO -0.06 -0.19 0.83 -1.17 -0.81 0.00 0.00 175.30 173.90 1nhk s LEU 39 N 2.21 4.43 -0.01 -0.88 0.20 -1.26 -0.76 118.68 122.61 1nhk s LEU 39 Ca -0.06 1.52 -0.17 0.00 0.69 0.00 0.00 54.13 56.10 1nhk s LEU 39 Cb -0.10 -3.34 0.03 0.00 -0.43 0.00 0.00 46.19 42.35 1nhk s LEU 39 CO -0.16 -0.07 0.37 -1.58 -0.29 0.00 0.00 176.35 174.61 1nhk s GLN 40 N 0.28 0.75 -0.34 1.98 0.74 -0.18 -4.97 119.66 117.91 1nhk s GLN 40 Ca 0.43 -0.18 -0.09 0.00 0.05 0.00 0.00 55.36 55.57 1nhk s GLN 40 Cb -0.21 0.34 0.02 0.00 1.10 0.00 0.00 33.01 34.26 1nhk s GLN 40 CO 0.25 -0.22 0.15 -1.58 -0.55 0.00 0.00 175.29 173.34 1nhk s HIS 41 N -1.53 3.22 0.42 1.67 5.65 -1.26 -0.45 115.29 123.01 1nhk s HIS 41 Ca -0.12 -1.00 -0.24 0.00 0.25 0.00 0.00 55.06 53.95 1nhk s HIS 41 Cb -0.04 -2.36 -0.08 0.00 -1.18 0.00 0.00 32.58 28.92 1nhk s HIS 41 CO 0.04 -0.62 1.10 -0.51 -0.65 0.00 0.00 174.74 174.10 1nhk s LEU 42 N 1.52 4.11 0.58 8.88 1.43 -1.26 -5.03 118.68 128.90 1nhk s LEU 42 Ca 0.02 2.16 -0.02 0.00 -1.03 0.00 0.00 54.13 55.26 1nhk s LEU 42 Cb -0.19 -4.18 0.03 0.00 0.03 0.00 0.00 46.19 41.89 1nhk s LEU 42 CO 0.05 -0.64 0.84 -0.94 0.23 0.00 0.00 176.35 175.88 1nhk s SER 43 N -1.45 5.27 0.22 2.29 1.04 -1.26 -4.71 113.70 115.11 1nhk s SER 43 Ca 0.59 0.25 -0.07 0.00 0.48 0.00 0.00 55.95 57.20 1nhk s SER 43 Cb -0.25 -1.14 0.19 0.00 0.10 0.00 0.00 66.02 64.92 1nhk s SER 43 CO 0.31 -1.19 1.83 -0.61 0.98 0.00 0.00 173.24 174.56 1nhk h GLN 44 N -0.09 1.23 -0.87 4.02 4.15 -1.96 -2.22 115.11 119.37 1nhk h GLN 44 Ca -0.44 -0.17 -0.02 0.00 0.77 0.00 0.00 58.65 58.79 1nhk h GLN 44 Cb 1.29 -0.23 -0.04 0.00 0.21 0.00 0.00 27.48 28.71 1nhk h GLN 44 CO 0.56 0.93 0.46 0.00 -1.93 0.00 0.00 178.83 178.85 1nhk h ALA 45 N 1.24 1.11 -0.36 3.38 0.00 -1.99 -0.78 119.26 121.86 1nhk h ALA 45 Ca 0.30 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1nhk h ALA 45 Cb 0.09 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1nhk h ALA 45 CO -0.04 0.63 0.05 1.96 0.00 0.00 0.00 179.25 181.85 1nhk h GLN 46 N 1.22 0.60 -0.40 0.00 4.20 -1.84 -0.91 115.11 117.98 1nhk h GLN 46 Ca 0.30 -0.17 -0.04 0.00 0.06 0.00 0.00 58.65 58.80 1nhk h GLN 46 Cb 0.05 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.75 1nhk h GLN 46 CO -0.05 0.68 0.07 0.00 -0.67 0.00 0.00 178.83 178.87 1nhk h ALA 47 N 0.90 0.53 -0.32 3.87 0.00 -1.23 -0.55 119.26 122.46 1nhk h ALA 47 Ca 0.11 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1nhk h ALA 47 Cb 0.37 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1nhk h ALA 47 CO 0.01 0.23 0.13 0.93 0.00 0.00 0.00 179.25 180.55 1nhk h GLU 48 N 0.51 0.48 -0.29 0.00 5.08 -1.11 -1.74 114.58 117.51 1nhk h GLU 48 Ca 0.12 -0.09 -0.09 0.00 -1.00 0.00 0.00 59.36 58.30 1nhk h GLU 48 Cb 0.35 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 1nhk h GLU 48 CO 0.01 0.48 -0.21 0.78 -1.00 0.00 0.00 179.01 179.06 1nhk h GLY 49 N 0.37 0.59 1.08 -3.84 0.00 -1.05 -2.39 103.07 97.82 1nhk h GLY 49 Ca 0.11 -0.46 -0.11 0.00 0.00 0.00 0.00 47.33 46.87 1nhk h GLY 49 CO -0.01 0.43 -0.06 -2.75 0.00 0.00 0.00 176.54 174.14 1nhk h PHE 50 N 0.48 1.14 -0.98 5.60 3.57 -0.91 -3.14 116.94 122.70 1nhk h PHE 50 Ca 0.08 -0.22 -0.49 0.00 3.53 0.00 0.00 57.97 60.86 1nhk h PHE 50 Cb 0.64 -0.29 -0.29 0.00 2.79 0.00 0.00 35.95 38.80 1nhk h PHE 50 CO 0.02 1.04 0.62 0.66 -2.23 0.00 0.00 178.31 178.42 1nhk n TYR 51 N -4.18 3.02 -0.33 0.41 4.01 -0.67 -4.68 117.16 114.74 1nhk n TYR 51 Ca 0.02 -1.79 0.17 0.00 -0.16 0.00 0.00 57.90 56.13 1nhk n TYR 51 Cb 0.38 -0.93 0.40 0.00 -0.31 0.00 0.00 39.34 38.88 1nhk n TYR 51 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1nhk h ALA 52 N 1.15 1.89 0.00 -0.72 0.00 -1.38 0.29 119.26 120.49 1nhk h ALA 52 Ca 0.61 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.60 1nhk h ALA 52 Cb 2.83 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 20.59 1nhk h ALA 52 CO 1.08 -0.29 0.03 -0.39 0.00 0.00 0.00 179.25 179.69 1nhk h VAL 53 N 0.60 0.00 -0.39 0.00 -1.51 -1.89 -1.01 116.25 112.06 1nhk h VAL 53 Ca 0.59 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 66.06 1nhk h VAL 53 Cb 1.15 0.67 0.00 0.00 -2.13 0.00 0.00 31.29 30.97 1nhk h VAL 53 CO -0.36 0.00 0.00 1.41 -1.23 0.00 0.00 177.57 177.39 1nhk n HIS 54 N -2.57 0.52 0.16 5.19 -0.00 0.09 -4.67 115.22 113.94 1nhk n HIS 54 Ca -0.02 -0.43 0.18 0.00 -0.00 0.00 0.00 57.72 57.44 1nhk n HIS 54 Cb 0.08 -0.02 0.78 0.00 -0.00 0.00 0.00 29.99 30.84 1nhk n HIS 54 CO 0.00 0.00 0.00 1.57 -0.00 0.00 0.00 176.34 177.91 1nhk h LYS 55 N 2.64 0.00 0.00 -0.41 2.10 -1.22 0.01 116.57 119.69 1nhk h LYS 55 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1nhk h LYS 55 Cb 0.77 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.10 1nhk h LYS 55 CO 0.00 0.00 -0.58 0.00 -2.00 0.00 0.00 179.45 176.87 1nhk n ALA 56 N -2.39 3.01 -1.70 0.07 0.00 -1.26 -4.92 120.51 113.32 1nhk n ALA 56 Ca 0.03 -0.26 -0.34 0.00 0.00 0.00 0.00 53.44 52.87 1nhk n ALA 56 Cb 0.40 -1.17 0.01 0.00 0.00 0.00 0.00 19.45 18.68 1nhk n ALA 56 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1nhk s ARG 57 N -3.13 3.32 0.39 0.00 1.81 -0.01 -4.96 118.95 116.37 1nhk s ARG 57 Ca 0.07 1.44 0.28 0.00 -1.72 0.00 0.00 55.73 55.80 1nhk s ARG 57 Cb 0.14 -2.02 1.00 0.00 -0.45 0.00 0.00 34.95 33.63 1nhk s ARG 57 CO 0.71 -0.84 1.81 -1.00 -0.68 0.00 0.00 175.30 175.30 1nhk h PRO 58 N 0.89 0.00 -0.02 3.54 0.13 -1.91 -2.90 132.00 131.72 1nhk h PRO 58 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1nhk h PRO 58 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1nhk h PRO 58 CO 0.57 0.00 -0.03 1.97 -0.23 0.00 0.00 178.00 180.28 1nhk n PHE 59 N -2.69 0.00 -0.06 1.56 1.16 -1.26 -4.51 117.46 111.66 1nhk n PHE 59 Ca 0.02 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.52 1nhk n PHE 59 Cb 0.33 -0.01 -0.02 0.00 -1.61 0.00 0.00 39.48 38.17 1nhk n PHE 59 CO 0.00 0.00 0.00 0.35 -1.87 0.00 0.00 176.76 175.24 1nhk h PHE 60 N 2.54 -0.82 -0.64 2.97 3.57 -1.73 -0.52 116.94 122.31 1nhk h PHE 60 Ca 0.00 0.05 0.05 0.00 3.53 0.00 0.00 57.97 61.59 1nhk h PHE 60 Cb 0.56 0.40 -0.05 0.00 2.79 0.00 0.00 35.95 39.66 1nhk h PHE 60 CO 0.00 -0.37 0.36 0.87 -2.23 0.00 0.00 178.31 176.94 1nhk h LYS 61 N -0.30 0.66 -0.50 1.11 1.57 -1.84 -1.43 116.57 115.84 1nhk h LYS 61 Ca 0.14 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.79 1nhk h LYS 61 Cb 0.52 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 1nhk h LYS 61 CO -0.43 0.44 -0.00 -0.44 -0.57 0.00 0.00 179.45 178.44 1nhk h ASP 62 N 0.68 0.88 -0.47 0.86 3.32 -1.76 -1.75 116.42 118.18 1nhk h ASP 62 Ca 0.28 -0.31 0.03 0.00 0.02 0.00 0.00 57.03 57.05 1nhk h ASP 62 Cb 0.13 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.41 1nhk h ASP 62 CO -0.16 0.97 0.25 0.25 -1.72 0.00 0.00 179.24 178.84 1nhk h LEU 63 N 0.76 0.38 -0.41 1.55 5.85 -0.65 -0.81 115.31 121.99 1nhk h LEU 63 Ca 0.14 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.84 1nhk h LEU 63 Cb 0.53 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.48 1nhk h LEU 63 CO 0.03 0.27 0.11 0.58 -0.34 0.00 0.00 178.44 179.09 1nhk h VAL 64 N 0.50 1.23 -0.68 1.05 2.07 -1.15 -0.05 116.25 119.22 1nhk h VAL 64 Ca 0.20 -0.77 -0.06 0.00 0.82 0.00 0.00 66.70 66.89 1nhk h VAL 64 Cb 0.07 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 30.77 1nhk h VAL 64 CO -0.12 0.27 0.18 1.56 0.02 0.00 0.00 177.57 179.48 1nhk h GLN 65 N 0.52 1.06 -0.31 1.57 1.08 -0.98 -2.43 115.11 115.61 1nhk h GLN 65 Ca 0.13 -0.23 -0.12 0.00 -1.45 0.00 0.00 58.65 56.97 1nhk h GLN 65 Cb 0.30 -0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 27.57 1nhk h GLN 65 CO -0.00 0.92 -0.28 0.35 -0.95 0.00 0.00 178.83 178.87 1nhk h PHE 66 N 1.01 0.88 0.00 2.96 3.57 -1.02 -2.35 116.94 122.00 1nhk h PHE 66 Ca 0.22 -0.26 0.00 0.00 3.53 0.00 0.00 57.97 61.46 1nhk h PHE 66 Cb 0.33 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 38.88 1nhk h PHE 66 CO 0.02 1.01 0.00 0.52 -2.23 0.00 0.00 178.31 177.63 1nhk h MET 67 N 0.50 0.00 -0.18 1.11 2.86 -0.75 -0.94 114.93 117.54 1nhk h MET 67 Ca 0.05 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 1nhk h MET 67 Cb 0.85 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.51 1nhk h MET 67 CO 0.07 0.00 0.00 0.44 1.06 0.00 0.00 176.91 178.48 1nhk n ILE 68 N -2.55 0.54 0.24 -1.22 -5.35 -0.94 -4.59 119.36 105.49 1nhk n ILE 68 Ca -0.00 -0.77 0.10 0.00 -0.27 0.00 0.00 62.75 61.81 1nhk n ILE 68 Cb 0.14 0.83 0.62 0.00 -1.74 0.00 0.00 39.64 39.49 1nhk n ILE 68 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 1nhk h SER 69 N 1.91 0.00 -5.16 7.28 4.64 -0.60 -3.46 113.55 118.15 1nhk h SER 69 Ca 0.00 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.36 1nhk h SER 69 Cb 0.58 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.66 1nhk h SER 69 CO 0.00 0.18 0.40 -0.83 -0.87 0.00 0.00 176.83 175.71 1nhk s GLY 70 N -4.23 0.32 0.75 -0.77 0.00 -1.26 -5.12 107.32 97.02 1nhk s GLY 70 Ca -0.02 -0.65 -0.11 0.00 0.00 0.00 0.00 44.72 43.94 1nhk s GLY 70 CO 0.62 0.86 1.08 2.56 0.00 0.00 0.00 173.10 178.22 1nhk s PRO 71 N -2.08 2.47 0.27 2.90 0.04 -1.26 -4.62 135.00 132.71 1nhk s PRO 71 Ca 0.19 1.06 0.04 0.00 0.04 0.00 0.00 61.00 62.33 1nhk s PRO 71 Cb -0.04 -1.93 -0.06 0.00 0.04 0.00 0.00 34.50 32.51 1nhk s PRO 71 CO 0.10 -1.46 0.00 0.14 0.04 0.00 0.00 177.00 175.82 1nhk s VAL 72 N -2.97 1.21 -0.23 -0.36 -7.23 0.41 -3.91 120.40 107.32 1nhk s VAL 72 Ca 0.60 -2.05 -0.03 0.00 -1.81 0.00 0.00 61.98 58.70 1nhk s VAL 72 Cb -0.16 -2.50 0.00 0.00 0.56 0.00 0.00 36.38 34.28 1nhk s VAL 72 CO 0.56 -0.22 -0.06 -0.69 -0.31 0.00 0.00 175.10 174.38 1nhk s VAL 73 N -3.30 3.12 -0.04 1.32 1.01 -0.72 -1.01 120.40 120.79 1nhk s VAL 73 Ca 0.31 -0.69 -0.16 0.00 0.00 0.00 0.00 61.98 61.45 1nhk s VAL 73 Cb 0.06 -2.46 -0.05 0.00 0.00 0.00 0.00 36.38 33.93 1nhk s VAL 73 CO 0.11 0.36 0.42 -0.76 0.00 0.00 0.00 175.10 175.24 1nhk s LEU 74 N 1.42 4.41 0.02 3.92 1.43 0.06 -0.38 118.68 129.57 1nhk s LEU 74 Ca 0.04 0.90 -0.08 0.00 -1.03 0.00 0.00 54.13 53.97 1nhk s LEU 74 Cb -0.15 -2.61 -0.00 0.00 0.03 0.00 0.00 46.19 43.46 1nhk s LEU 74 CO -0.04 0.23 0.14 -0.04 0.23 0.00 0.00 176.35 176.87 1nhk s MET 75 N -0.54 0.58 -0.16 1.70 -1.94 0.66 -1.07 119.30 118.53 1nhk s MET 75 Ca 0.24 -0.57 0.01 0.00 -1.71 0.00 0.00 55.69 53.66 1nhk s MET 75 Cb -0.16 0.24 0.00 0.00 2.01 0.00 0.00 34.83 36.92 1nhk s MET 75 CO 0.12 -0.15 -0.16 0.08 -0.01 0.00 0.00 175.02 174.90 1nhk s VAL 76 N -2.08 2.52 -0.12 -6.03 1.01 -0.52 -0.86 120.40 114.32 1nhk s VAL 76 Ca -0.09 -0.81 -0.03 0.00 0.00 0.00 0.00 61.98 61.04 1nhk s VAL 76 Cb -0.04 -2.06 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 1nhk s VAL 76 CO -0.02 0.52 0.01 -0.76 0.00 0.00 0.00 175.10 174.85 1nhk s LEU 77 N 0.91 3.56 -0.05 3.92 1.43 -0.23 -0.28 118.68 127.94 1nhk s LEU 77 Ca -0.04 0.08 0.06 0.00 -1.03 0.00 0.00 54.13 53.20 1nhk s LEU 77 Cb -0.15 -1.84 -0.01 0.00 0.03 0.00 0.00 46.19 44.22 1nhk s LEU 77 CO -0.02 0.30 -0.24 -0.70 0.23 0.00 0.00 176.35 175.91 1nhk s GLU 78 N -0.39 2.45 0.00 1.70 2.12 0.34 -1.23 118.70 123.70 1nhk s GLU 78 Ca 0.08 -0.88 0.00 0.00 0.36 0.00 0.00 54.97 54.53 1nhk s GLU 78 Cb -0.12 -2.10 0.00 0.00 0.26 0.00 0.00 34.13 32.17 1nhk s GLU 78 CO 0.02 0.38 0.00 0.41 -0.54 0.00 0.00 175.26 175.53 1nhk n GLY 79 N 2.94 -0.25 3.67 -1.50 0.00 -0.63 -0.72 105.19 108.70 1nhk n GLY 79 Ca -0.17 -1.10 -0.42 0.00 0.00 0.00 0.00 46.02 44.32 1nhk n GLY 79 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1nhk s GLU 80 N -2.00 4.15 -1.42 1.61 2.56 -1.26 -0.70 118.70 121.64 1nhk s GLU 80 Ca 0.00 2.51 -0.11 0.00 0.00 0.00 0.00 54.97 57.37 1nhk s GLU 80 Cb 0.00 -3.90 0.08 0.00 2.00 0.00 0.00 34.13 32.31 1nhk s GLU 80 CO 0.00 -0.88 0.65 -1.71 -0.56 0.00 0.00 175.26 172.76 1nhk n ASN 81 N 6.71 -4.09 -0.31 -1.70 5.15 0.31 -4.79 115.26 116.55 1nhk n ASN 81 Ca 0.18 -0.56 0.12 0.00 -0.60 0.00 0.00 54.58 53.73 1nhk n ASN 81 Cb 0.40 -3.34 0.30 0.00 -0.53 0.00 0.00 39.78 36.61 1nhk n ASN 81 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1nhk h ALA 82 N 0.96 1.42 -0.08 5.20 0.00 -1.69 -0.47 119.26 124.60 1nhk h ALA 82 Ca -0.49 0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.58 1nhk h ALA 82 Cb 1.33 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.21 1nhk h ALA 82 CO 0.60 -0.29 -0.05 0.28 0.00 0.00 0.00 179.25 179.79 1nhk h VAL 83 N 0.45 0.84 -0.12 0.00 2.07 -1.88 0.07 116.25 117.69 1nhk h VAL 83 Ca 0.55 0.00 -0.17 0.00 0.82 0.00 0.00 66.70 67.90 1nhk h VAL 83 Cb 1.00 0.84 0.01 0.00 -1.52 0.00 0.00 31.29 31.62 1nhk h VAL 83 CO -0.50 0.00 -0.60 -0.07 0.02 0.00 0.00 177.57 176.43 1nhk h LEU 84 N -0.05 0.72 -0.48 2.57 3.38 -1.78 -3.07 115.31 116.60 1nhk h LEU 84 Ca 0.05 -0.64 0.02 0.00 0.09 0.00 0.00 57.88 57.40 1nhk h LEU 84 Cb 0.12 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 1nhk h LEU 84 CO -0.11 1.25 0.29 0.00 0.09 0.00 0.00 178.44 179.95 1nhk h ALA 85 N 0.49 0.62 -0.09 1.53 0.00 -1.00 -1.43 119.26 119.38 1nhk h ALA 85 Ca -0.04 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.89 1nhk h ALA 85 Cb 1.24 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 1nhk h ALA 85 CO 0.12 -0.02 -0.14 -0.97 0.00 0.00 0.00 179.25 178.25 1nhk h ASN 86 N 0.58 -0.43 -0.40 0.00 -0.00 -1.05 -1.36 115.58 112.93 1nhk h ASN 86 Ca 0.19 0.08 -0.02 0.00 -0.00 0.00 0.00 56.30 56.55 1nhk h ASN 86 Cb 0.02 0.20 -0.02 0.00 -0.00 0.00 0.00 38.32 38.51 1nhk h ASN 86 CO -0.09 -0.19 0.20 0.03 -0.00 0.00 0.00 177.43 177.39 1nhk h ARG 87 N -0.19 0.60 -0.19 6.67 3.08 -1.37 -0.64 114.38 122.35 1nhk h ARG 87 Ca 0.08 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 1nhk h ARG 87 Cb 0.30 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 1nhk h ARG 87 CO -0.20 0.48 0.02 0.22 -1.07 0.00 0.00 179.97 179.42 1nhk h ASP 88 N 0.61 0.30 -0.75 7.04 1.82 -0.72 -1.65 116.42 123.08 1nhk h ASP 88 Ca 0.15 -0.27 -0.01 0.00 -0.39 0.00 0.00 57.03 56.51 1nhk h ASP 88 Cb 0.08 -0.08 -0.04 0.00 0.68 0.00 0.00 39.33 39.97 1nhk h ASP 88 CO -0.02 0.50 0.42 0.40 -1.61 0.00 0.00 179.24 178.92 1nhk h ILE 89 N 0.10 1.23 -0.42 2.25 2.04 -0.66 -2.67 117.51 119.36 1nhk h ILE 89 Ca 0.06 -0.56 -0.06 0.00 1.00 0.00 0.00 64.86 65.29 1nhk h ILE 89 Cb 0.33 0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 36.59 1nhk h ILE 89 CO 0.00 0.25 0.02 0.24 0.00 0.00 0.00 178.15 178.66 1nhk h MET 90 N 1.06 0.74 0.00 2.37 2.86 -0.98 -1.32 114.93 119.66 1nhk h MET 90 Ca 0.27 -0.23 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1nhk h MET 90 Cb 0.03 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.62 1nhk h MET 90 CO -0.04 0.81 0.00 0.41 1.06 0.00 0.00 176.91 179.14 1nhk n GLY 91 N -0.40 0.06 3.58 8.32 0.00 -0.63 -1.11 105.19 115.00 1nhk n GLY 91 Ca -0.00 -1.90 -0.41 0.00 0.00 0.00 0.00 46.02 43.71 1nhk n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nhk n ALA 92 N 0.46 -0.15 -0.35 4.61 0.00 -1.26 -4.88 120.51 118.95 1nhk n ALA 92 Ca 0.00 0.19 0.03 0.00 0.00 0.00 0.00 53.44 53.66 1nhk n ALA 92 Cb 0.00 -2.02 0.17 0.00 0.00 0.00 0.00 19.45 17.60 1nhk n ALA 92 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1nhk h THR 93 N 1.27 1.04 -3.58 0.00 2.02 -1.95 -3.35 112.91 108.37 1nhk h THR 93 Ca -0.44 -0.37 -0.63 0.00 0.77 0.00 0.00 66.41 65.74 1nhk h THR 93 Cb 1.35 -0.13 -0.13 0.00 -1.74 0.00 0.00 68.15 67.50 1nhk h THR 93 CO 0.55 0.20 0.22 0.21 0.37 0.00 0.00 175.52 177.07 1nhk s ASN 94 N -5.82 6.42 0.41 4.18 3.84 -1.26 -4.61 114.94 118.09 1nhk s ASN 94 Ca -0.12 0.02 0.20 0.00 0.21 0.00 0.00 52.86 53.16 1nhk s ASN 94 Cb 0.20 -2.35 1.14 0.00 -0.55 0.00 0.00 41.25 39.69 1nhk s ASN 94 CO 0.81 -0.73 1.77 -0.65 -2.79 0.00 0.00 177.10 175.51 1nhk h PRO 95 N 8.67 0.35 -0.65 0.43 0.11 -1.83 0.47 132.00 139.55 1nhk h PRO 95 Ca -0.26 -0.02 0.10 0.00 0.11 0.00 0.00 66.00 65.93 1nhk h PRO 95 Cb 1.10 -0.08 -0.04 0.00 0.11 0.00 0.00 31.00 32.09 1nhk h PRO 95 CO 0.89 0.23 0.43 0.00 -0.21 0.00 0.00 178.00 179.34 1nhk h ALA 96 N 1.61 1.95 -0.14 -0.75 0.00 -1.92 -1.19 119.26 118.82 1nhk h ALA 96 Ca 0.60 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.50 1nhk h ALA 96 Cb 1.58 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.27 1nhk h ALA 96 CO -0.29 -0.09 0.00 1.04 0.00 0.00 0.00 179.25 179.91 1nhk n GLN 97 N -4.48 2.36 -2.28 0.00 6.02 0.13 -4.98 117.38 114.15 1nhk n GLN 97 Ca 0.11 -2.00 -0.41 0.00 -0.01 0.00 0.00 57.00 54.69 1nhk n GLN 97 Cb 0.36 -1.48 -0.03 0.00 1.02 0.00 0.00 30.24 30.11 1nhk n GLN 97 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1nhk s ALA 98 N -1.84 3.47 0.66 -1.58 0.00 -0.45 -4.67 121.76 117.35 1nhk s ALA 98 Ca 0.32 1.07 -0.16 0.00 0.00 0.00 0.00 51.96 53.20 1nhk s ALA 98 Cb 0.21 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.91 1nhk s ALA 98 CO 0.31 -0.43 1.14 0.00 0.00 0.00 0.00 175.76 176.78 1nhk s ALA 99 N -0.73 2.40 0.41 0.00 0.00 -1.26 -4.79 121.76 117.78 1nhk s ALA 99 Ca 0.50 0.69 -0.26 0.00 0.00 0.00 0.00 51.96 52.88 1nhk s ALA 99 Cb -0.36 -3.37 -0.09 0.00 0.00 0.00 0.00 23.12 19.31 1nhk s ALA 99 CO 0.44 -1.39 1.32 -2.00 0.00 0.00 0.00 175.76 174.13 1nhk s GLU 100 N -3.93 3.93 0.00 0.00 2.56 -1.26 -2.48 118.70 117.52 1nhk s GLU 100 Ca 0.70 2.20 0.00 0.00 0.00 0.00 0.00 54.97 57.87 1nhk s GLU 100 Cb -0.24 -2.75 0.00 0.00 2.00 0.00 0.00 34.13 33.14 1nhk s GLU 100 CO 0.41 -0.54 0.00 0.41 -0.56 0.00 0.00 175.26 174.98 1nhk n GLY 101 N 0.65 1.21 3.89 -1.50 0.00 -1.26 -5.04 105.19 103.15 1nhk n GLY 101 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 1nhk n GLY 101 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nhk s THR 102 N -2.84 4.89 0.16 2.61 -4.23 -1.04 -4.97 115.64 110.23 1nhk s THR 102 Ca 0.00 0.31 -0.16 0.00 -1.18 0.00 0.00 61.69 60.66 1nhk s THR 102 Cb 0.00 -3.79 0.03 0.00 1.34 0.00 0.00 72.50 70.08 1nhk s THR 102 CO 0.00 -0.61 1.75 0.40 -0.54 0.00 0.00 174.62 175.62 1nhk h ILE 103 N 0.80 0.89 -0.32 2.99 2.04 -1.19 -1.68 117.51 121.04 1nhk h ILE 103 Ca -0.47 -0.10 -0.08 0.00 1.00 0.00 0.00 64.86 65.21 1nhk h ILE 103 Cb 1.20 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 1nhk h ILE 103 CO 0.63 0.05 -0.14 0.03 0.00 0.00 0.00 178.15 178.72 1nhk h ARG 104 N 0.29 0.56 -0.39 2.37 3.08 -1.37 0.99 114.38 119.92 1nhk h ARG 104 Ca 0.17 -0.18 -0.11 0.00 0.07 0.00 0.00 59.98 59.94 1nhk h ARG 104 Cb 0.15 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 1nhk h ARG 104 CO -0.17 0.69 -0.17 -0.22 -1.07 0.00 0.00 179.97 179.03 1nhk h LYS 105 N 0.52 0.80 -0.01 0.04 1.63 -1.72 -1.13 116.57 116.70 1nhk h LYS 105 Ca 0.09 -0.34 -0.18 0.00 -0.85 0.00 0.00 60.65 59.37 1nhk h LYS 105 Cb 0.55 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.14 1nhk h LYS 105 CO 0.03 0.97 -0.81 -0.44 -3.45 0.00 0.00 179.45 175.75 1nhk h ASP 106 N 0.61 0.21 0.00 4.20 3.32 -1.04 -3.40 116.42 120.32 1nhk h ASP 106 Ca 0.09 -0.16 0.00 0.00 0.02 0.00 0.00 57.03 56.98 1nhk h ASP 106 Cb 0.71 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.20 1nhk h ASP 106 CO 0.05 0.93 -0.70 0.49 -1.72 0.00 0.00 179.24 178.30 1nhk n PHE 107 N -3.69 0.00 -2.49 4.55 3.72 0.32 -5.08 117.46 114.80 1nhk n PHE 107 Ca -0.03 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 57.01 1nhk n PHE 107 Cb 0.76 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.27 1nhk n PHE 107 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1nhk s ALA 108 N -1.48 3.02 -0.19 4.37 0.00 -0.43 -4.90 121.76 122.15 1nhk s ALA 108 Ca 0.00 0.73 -0.06 0.00 0.00 0.00 0.00 51.96 52.63 1nhk s ALA 108 Cb 0.00 -3.29 -0.21 0.00 0.00 0.00 0.00 23.12 19.62 1nhk s ALA 108 CO 0.00 -0.32 0.10 2.41 0.00 0.00 0.00 175.76 177.94 1nhk n THR 109 N -0.34 1.64 -3.69 0.00 -1.04 -0.82 -4.91 114.28 105.11 1nhk n THR 109 Ca 0.06 -0.54 -0.08 0.00 -2.04 0.00 0.00 64.05 61.46 1nhk n THR 109 Cb 0.50 -1.68 0.03 0.00 -1.82 0.00 0.00 70.33 67.36 1nhk n THR 109 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1nhk n SER 110 N -3.57 -1.99 0.17 8.00 3.41 -1.06 -4.99 113.62 113.59 1nhk n SER 110 Ca -0.38 -2.39 0.03 0.00 -0.26 0.00 0.00 58.87 55.86 1nhk n SER 110 Cb 0.98 3.32 0.38 0.00 -0.26 0.00 0.00 64.21 68.63 1nhk n SER 110 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 1nhk h ILE 111 N 1.86 1.23 -0.00 -1.33 2.10 -1.96 -2.75 117.51 116.65 1nhk h ILE 111 Ca -0.29 -1.09 -0.03 0.00 1.08 0.00 0.00 64.86 64.53 1nhk h ILE 111 Cb 1.08 1.54 0.00 0.00 -1.09 0.00 0.00 36.82 38.35 1nhk h ILE 111 CO 0.37 0.32 -0.11 -2.24 -1.08 0.00 0.00 178.15 175.40 1nhk h ASP 112 N 0.05 0.11 -3.21 2.19 2.03 -1.96 -3.36 116.42 112.28 1nhk h ASP 112 Ca 0.01 -0.76 -0.78 0.00 -0.73 0.00 0.00 57.03 54.77 1nhk h ASP 112 Cb 0.56 -0.03 -0.30 0.00 -0.83 0.00 0.00 39.33 38.73 1nhk h ASP 112 CO 0.04 0.85 0.42 0.29 -1.03 0.00 0.00 179.24 179.82 1nhk n LYS 113 N -4.63 3.68 -0.96 4.15 5.02 -1.13 -4.82 118.16 119.47 1nhk n LYS 113 Ca -0.09 -4.51 -0.07 0.00 -2.02 0.00 0.00 58.31 51.61 1nhk n LYS 113 Cb 0.43 -2.50 0.26 0.00 -0.02 0.00 0.00 35.03 33.21 1nhk n LYS 113 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1nhk n ASN 114 N 2.01 4.16 0.00 4.39 6.94 -1.05 -1.95 115.26 129.76 1nhk n ASN 114 Ca 0.25 -3.36 0.00 0.00 -0.02 0.00 0.00 54.58 51.45 1nhk n ASN 114 Cb 0.37 -0.72 0.00 0.00 -2.36 0.00 0.00 39.78 37.07 1nhk n ASN 114 CO 0.00 0.00 0.00 0.41 -1.03 0.00 0.00 177.26 176.64 1nhk n THR 115 N -0.53 0.00 -4.06 5.53 -1.04 -1.26 -4.80 114.28 108.12 1nhk n THR 115 Ca 0.41 0.00 -0.08 0.00 -2.04 0.00 0.00 64.05 62.34 1nhk n THR 115 Cb 1.33 0.00 -0.09 0.00 -1.82 0.00 0.00 70.33 69.74 1nhk n THR 115 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 1nhk s VAL 116 N 0.00 0.18 0.04 12.58 -7.23 -1.26 -0.31 120.40 124.40 1nhk s VAL 116 Ca 0.00 -1.71 0.04 0.00 -1.81 0.00 0.00 61.98 58.51 1nhk s VAL 116 Cb 0.00 -1.59 -0.02 0.00 0.56 0.00 0.00 36.38 35.33 1nhk s VAL 116 CO 0.00 -0.83 -0.13 -2.28 -0.31 0.00 0.00 175.10 171.55 1nhk s HIS 117 N -3.93 1.14 -0.02 2.82 2.46 -0.40 -4.90 115.29 112.45 1nhk s HIS 117 Ca 0.10 -0.36 -0.03 0.00 0.47 0.00 0.00 55.06 55.23 1nhk s HIS 117 Cb 0.07 -0.67 0.00 0.00 -0.13 0.00 0.00 32.58 31.85 1nhk s HIS 117 CO -0.08 0.02 0.07 0.20 -2.47 0.00 0.00 174.74 172.49 1nhk s GLY 118 N -1.18 -0.00 0.29 1.59 0.00 -1.26 -1.44 107.32 105.31 1nhk s GLY 118 Ca 0.00 0.06 -0.30 0.00 0.00 0.00 0.00 44.72 44.49 1nhk s GLY 118 CO 0.01 0.01 1.55 1.44 0.00 0.00 0.00 173.10 176.11 1nhk n SER 119 N 2.60 3.64 0.13 1.64 7.64 -0.76 -4.91 113.62 123.59 1nhk n SER 119 Ca -0.15 1.15 0.13 0.00 1.01 0.00 0.00 58.87 61.01 1nhk n SER 119 Cb 0.58 -1.56 0.36 0.00 -1.01 0.00 0.00 64.21 62.57 1nhk n SER 119 CO 0.00 0.00 0.00 -2.24 -3.01 0.00 0.00 175.04 169.79 1nhk h ASP 120 N 4.49 0.00 -5.11 6.43 3.04 -1.93 -3.47 116.42 119.87 1nhk h ASP 120 Ca -0.47 -0.00 -0.04 0.00 -3.24 0.00 0.00 57.03 53.28 1nhk h ASP 120 Cb 1.24 0.00 -0.11 0.00 -1.04 0.00 0.00 39.33 39.42 1nhk h ASP 120 CO 0.77 0.00 -0.03 -0.94 -2.04 0.00 0.00 179.24 177.00 1nhk s SER 121 N -4.85 -0.22 0.38 4.15 1.04 -1.26 -4.98 113.70 107.96 1nhk s SER 121 Ca 0.10 -0.49 0.08 0.00 0.48 0.00 0.00 55.95 56.12 1nhk s SER 121 Cb 0.11 0.54 0.76 0.00 0.10 0.00 0.00 66.02 67.53 1nhk s SER 121 CO 0.61 -0.99 1.93 0.25 0.98 0.00 0.00 173.24 176.02 1nhk h LEU 122 N 2.27 0.30 -0.35 2.42 5.85 -1.95 0.20 115.31 124.06 1nhk h LEU 122 Ca -0.30 -0.05 -0.11 0.00 0.84 0.00 0.00 57.88 58.25 1nhk h LEU 122 Cb 1.26 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.20 1nhk h LEU 122 CO 0.41 0.41 -0.22 -0.08 -0.34 0.00 0.00 178.44 178.61 1nhk h GLU 123 N 0.31 0.76 -0.14 1.25 4.81 -1.99 -2.54 114.58 117.05 1nhk h GLU 123 Ca 0.07 -0.36 -0.16 0.00 -0.13 0.00 0.00 59.36 58.78 1nhk h GLU 123 Cb 0.31 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 1nhk h GLU 123 CO 0.01 0.98 -0.58 -0.91 -0.73 0.00 0.00 179.01 177.79 1nhk h ASN 124 N 0.54 0.48 -0.34 1.04 -0.26 -1.86 -3.17 115.58 112.01 1nhk h ASN 124 Ca 0.07 -0.26 0.04 0.00 -0.56 0.00 0.00 56.30 55.59 1nhk h ASN 124 Cb 0.78 -0.14 -0.04 0.00 -1.06 0.00 0.00 38.32 37.87 1nhk h ASN 124 CO 0.06 0.95 0.11 0.00 -1.06 0.00 0.00 177.43 177.50 1nhk h ALA 125 N 1.06 0.39 -0.66 -0.83 0.00 -0.44 0.11 119.26 118.87 1nhk h ALA 125 Ca 0.00 0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.04 1nhk h ALA 125 Cb 1.10 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.85 1nhk h ALA 125 CO 0.10 -0.28 0.32 0.87 0.00 0.00 0.00 179.25 180.26 1nhk h LYS 126 N 0.25 0.55 -0.11 0.00 6.56 -1.44 -0.27 116.57 122.11 1nhk h LYS 126 Ca 0.15 -0.03 -0.04 0.00 -1.06 0.00 0.00 60.65 59.67 1nhk h LYS 126 Cb 0.13 -0.12 -0.00 0.00 -0.57 0.00 0.00 32.23 31.66 1nhk h LYS 126 CO -0.16 0.36 -0.09 0.82 -2.06 0.00 0.00 179.45 178.32 1nhk h ILE 127 N 0.56 1.34 -0.84 1.86 2.04 -1.39 -2.75 117.51 118.34 1nhk h ILE 127 Ca 0.32 -1.20 -0.03 0.00 1.00 0.00 0.00 64.86 64.95 1nhk h ILE 127 Cb 0.32 1.89 -0.04 0.00 -0.74 0.00 0.00 36.82 38.26 1nhk h ILE 127 CO -0.25 0.34 0.40 -0.33 0.00 0.00 0.00 178.15 178.31 1nhk h GLU 128 N -0.12 1.22 -0.02 2.37 5.08 -0.49 -1.50 114.58 121.12 1nhk h GLU 128 Ca 0.02 -0.18 -0.00 0.00 -1.00 0.00 0.00 59.36 58.19 1nhk h GLU 128 Cb 0.59 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 1nhk h GLU 128 CO 0.02 0.94 0.00 0.82 -1.00 0.00 0.00 179.01 179.80 1nhk h ILE 129 N 1.20 1.22 0.00 3.13 2.04 -1.11 -2.79 117.51 121.21 1nhk h ILE 129 Ca 0.29 -0.65 -0.02 0.00 1.00 0.00 0.00 64.86 65.48 1nhk h ILE 129 Cb 0.13 1.62 -0.00 0.00 -0.74 0.00 0.00 36.82 37.83 1nhk h ILE 129 CO -0.03 0.17 -0.08 0.00 0.00 0.00 0.00 178.15 178.21 1nhk h ALA 130 N 0.74 1.30 -0.45 1.87 0.00 -1.35 0.20 119.26 121.57 1nhk h ALA 130 Ca 0.01 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.74 1nhk h ALA 130 Cb 0.28 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1nhk h ALA 130 CO 0.00 0.10 -0.14 -0.92 0.00 0.00 0.00 179.25 178.29 1nhk h TYR 131 N 0.00 0.92 0.00 0.00 3.20 -0.99 -3.34 116.97 116.75 1nhk h TYR 131 Ca -0.00 -0.18 0.00 0.00 3.14 0.00 0.00 58.73 61.69 1nhk h TYR 131 Cb 0.24 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 38.28 1nhk h TYR 131 CO 0.00 0.91 -0.44 1.19 -1.64 0.00 0.00 178.16 178.18 1nhk n PHE 132 N -4.15 0.00 -4.09 -3.82 3.72 -0.77 -5.03 117.46 103.32 1nhk n PHE 132 Ca 0.01 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.26 1nhk n PHE 132 Cb 0.39 -0.01 -0.14 0.00 -0.94 0.00 0.00 39.48 38.78 1nhk n PHE 132 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 1nhk s PHE 133 N -1.82 0.37 0.54 1.38 0.08 0.63 -5.10 117.98 114.07 1nhk s PHE 133 Ca 0.03 -0.08 -0.13 0.00 0.12 0.00 0.00 56.93 56.87 1nhk s PHE 133 Cb 0.06 -0.24 -0.06 0.00 -0.57 0.00 0.00 43.02 42.21 1nhk s PHE 133 CO 0.34 -0.01 0.97 1.03 -0.10 0.00 0.00 175.22 177.45 1nhk s ARG 134 N -0.13 3.78 0.45 0.44 0.52 -1.26 -4.35 118.95 118.40 1nhk s ARG 134 Ca 0.01 0.79 0.13 0.00 -0.52 0.00 0.00 55.73 56.14 1nhk s ARG 134 Cb -0.02 -2.15 1.02 0.00 0.52 0.00 0.00 34.95 34.32 1nhk s ARG 134 CO -0.00 -0.36 2.03 0.93 0.02 0.00 0.00 175.30 177.92 1nhk h GLU 135 N 0.43 0.12 0.00 3.54 4.39 -1.96 -1.62 114.58 119.47 1nhk h GLU 135 Ca -0.46 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.23 1nhk h GLU 135 Cb 1.19 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.82 1nhk h GLU 135 CO 0.62 0.19 0.00 0.25 -1.16 0.00 0.00 179.01 178.91 1nhk n THR 136 N -4.40 0.36 0.85 1.13 -2.24 -1.26 -2.25 114.28 106.47 1nhk n THR 136 Ca -0.02 0.09 0.11 0.00 -2.27 0.00 0.00 64.05 61.97 1nhk n THR 136 Cb 0.18 -0.79 0.11 0.00 -2.10 0.00 0.00 70.33 67.73 1nhk n THR 136 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1nhk n GLU 137 N -1.22 2.12 -4.16 -0.78 1.02 -0.61 -4.90 120.64 112.11 1nhk n GLU 137 Ca 0.10 -1.87 -0.35 0.00 -0.02 0.00 0.00 57.16 55.02 1nhk n GLU 137 Cb 0.13 -1.43 -0.13 0.00 -0.02 0.00 0.00 31.44 29.98 1nhk n GLU 137 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1nhk s ILE 138 N -1.80 3.67 -0.14 -3.67 1.01 -0.95 -4.60 121.20 114.73 1nhk s ILE 138 Ca 0.27 -0.41 -0.02 0.00 0.00 0.00 0.00 60.65 60.49 1nhk s ILE 138 Cb 0.19 -2.64 0.05 0.00 0.01 0.00 0.00 42.46 40.06 1nhk s ILE 138 CO 0.28 0.45 0.02 -1.00 0.00 0.00 0.00 174.94 174.69 1nhk s HIS 139 N 0.97 0.80 0.50 3.97 3.76 0.77 -5.01 115.29 121.05 1nhk s HIS 139 Ca 0.00 -0.50 -0.13 0.00 -0.15 0.00 0.00 55.06 54.28 1nhk s HIS 139 Cb -0.15 -0.90 -0.07 0.00 1.11 0.00 0.00 32.58 32.58 1nhk s HIS 139 CO 0.01 -0.47 0.93 0.45 -0.85 0.00 0.00 174.74 174.81 1nhk s SER 140 N 1.93 6.50 0.03 1.40 0.15 -1.26 -4.63 113.70 117.82 1nhk s SER 140 Ca 0.02 1.39 -0.15 0.00 0.70 0.00 0.00 55.95 57.91 1nhk s SER 140 Cb -0.15 -2.44 0.02 0.00 -1.71 0.00 0.00 66.02 61.75 1nhk s SER 140 CO -0.07 -0.59 0.33 -0.72 1.20 0.00 0.00 173.24 173.39 1nhk s TYR 141 N -2.67 -0.16 0.35 3.44 1.13 -1.26 -5.15 117.35 113.02 1nhk s TYR 141 Ca 0.56 0.10 -0.15 0.00 -1.41 0.00 0.00 57.07 56.17 1nhk s TYR 141 Cb -0.10 0.13 -0.09 0.00 -1.10 0.00 0.00 41.96 40.79 1nhk s TYR 141 CO 0.36 -0.50 0.76 -1.25 -2.51 0.00 0.00 175.55 172.42 1nhk s PRO 142 N -2.27 4.00 0.17 -3.49 0.04 -1.26 -5.05 135.00 127.14 1nhk s PRO 142 Ca -0.07 0.69 -0.18 0.00 0.04 0.00 0.00 61.00 61.48 1nhk s PRO 142 Cb -0.02 -2.40 -0.08 0.00 0.04 0.00 0.00 34.50 32.05 1nhk s PRO 142 CO -0.01 0.11 0.65 0.71 0.04 0.00 0.00 177.00 178.49 1nhk s TYR 143 N -2.06 3.68 -0.37 0.56 2.02 -1.26 -5.28 117.35 114.63 1nhk s TYR 143 Ca 0.55 1.28 0.03 0.00 -0.37 0.00 0.00 57.07 58.56 1nhk s TYR 143 Cb -0.10 -2.53 0.02 0.00 -0.40 0.00 0.00 41.96 38.95 1nhk s TYR 143 CO 0.19 0.42 0.59 0.94 -1.57 0.00 0.00 175.55 176.12