#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nlk s ILE 3 N 0.00 4.10 0.37 0.00 1.01 -1.26 -0.31 121.20 125.12 1nlk s ILE 3 Ca 0.00 1.40 0.04 0.00 0.00 0.00 0.00 60.65 62.09 1nlk s ILE 3 Cb 0.00 -3.90 -0.05 0.00 0.01 0.00 0.00 42.46 38.52 1nlk s ILE 3 CO 0.00 -0.05 0.08 -1.61 0.00 0.00 0.00 174.94 173.35 1nlk s GLU 4 N 2.82 1.81 -0.03 2.79 2.02 0.10 -4.91 118.70 123.31 1nlk s GLU 4 Ca 0.58 -2.06 0.05 0.00 0.02 0.00 0.00 54.97 53.56 1nlk s GLU 4 Cb -0.26 -0.87 -0.01 0.00 0.10 0.00 0.00 34.13 33.10 1nlk s GLU 4 CO 0.21 -0.30 -0.17 1.03 0.02 0.00 0.00 175.26 176.05 1nlk s ARG 5 N -3.82 1.55 0.05 1.61 0.52 -1.26 -1.59 118.95 116.01 1nlk s ARG 5 Ca 0.29 -0.61 -0.03 0.00 -0.52 0.00 0.00 55.73 54.86 1nlk s ARG 5 Cb 0.06 -1.43 -0.03 0.00 0.52 0.00 0.00 34.95 34.07 1nlk s ARG 5 CO 0.14 0.32 0.02 -0.08 0.02 0.00 0.00 175.30 175.72 1nlk s THR 6 N -0.21 0.18 -0.11 0.02 -1.32 -0.17 -4.80 115.64 109.23 1nlk s THR 6 Ca 0.02 -1.51 -0.15 0.00 -1.21 0.00 0.00 61.69 58.85 1nlk s THR 6 Cb -0.09 -1.27 -0.05 0.00 -1.51 0.00 0.00 72.50 69.59 1nlk s THR 6 CO 0.00 -0.83 0.35 -0.22 -2.21 0.00 0.00 174.62 171.71 1nlk s LEU 7 N -2.64 4.31 -0.01 9.08 2.96 -1.26 -0.48 118.68 130.64 1nlk s LEU 7 Ca 0.02 0.67 0.06 0.00 -0.22 0.00 0.00 54.13 54.67 1nlk s LEU 7 Cb 0.04 -2.47 -0.02 0.00 0.50 0.00 0.00 46.19 44.24 1nlk s LEU 7 CO -0.08 0.15 -0.20 -0.55 -1.32 0.00 0.00 176.35 174.35 1nlk s SER 8 N 0.07 2.30 -0.05 3.68 0.15 0.77 -2.22 113.70 118.40 1nlk s SER 8 Ca 0.20 -0.37 0.00 0.00 0.70 0.00 0.00 55.95 56.48 1nlk s SER 8 Cb -0.14 -0.25 0.02 0.00 -1.71 0.00 0.00 66.02 63.94 1nlk s SER 8 CO 0.07 0.23 -0.03 -0.63 1.20 0.00 0.00 173.24 174.08 1nlk s ILE 9 N -0.50 0.50 -0.45 6.45 1.01 -1.03 0.02 121.20 127.20 1nlk s ILE 9 Ca 0.07 -0.05 -0.22 0.00 0.00 0.00 0.00 60.65 60.45 1nlk s ILE 9 Cb -0.08 -0.57 0.03 0.00 0.01 0.00 0.00 42.46 41.85 1nlk s ILE 9 CO -0.00 0.24 0.71 -0.63 0.00 0.00 0.00 174.94 175.26 1nlk s ILE 10 N 1.26 4.74 0.94 2.92 1.01 -0.00 -0.81 121.20 131.26 1nlk s ILE 10 Ca -0.06 0.23 -0.11 0.00 0.00 0.00 0.00 60.65 60.72 1nlk s ILE 10 Cb -0.14 -4.27 0.16 0.00 0.01 0.00 0.00 42.46 38.22 1nlk s ILE 10 CO -0.02 -0.68 1.12 -0.54 0.00 0.00 0.00 174.94 174.82 1nlk s LYS 11 N 3.06 0.85 0.32 2.79 1.02 0.96 -2.14 119.74 126.60 1nlk s LYS 11 Ca 0.26 1.34 0.09 0.00 0.02 0.00 0.00 55.97 57.67 1nlk s LYS 11 Cb -0.13 -1.72 0.95 0.00 -0.52 0.00 0.00 37.83 36.40 1nlk s LYS 11 CO 0.20 -2.67 1.61 -1.35 -0.92 0.00 0.00 175.35 172.22 1nlk h PRO 12 N -1.89 0.11 0.00 -1.68 0.11 -1.87 0.15 132.00 126.93 1nlk h PRO 12 Ca -0.47 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.60 1nlk h PRO 12 Cb 1.28 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1nlk h PRO 12 CO 0.45 0.07 -0.18 0.38 -0.21 0.00 0.00 178.00 178.52 1nlk h ASP 13 N 0.12 0.00 -0.55 -2.05 2.03 -1.90 -2.57 116.42 111.50 1nlk h ASP 13 Ca 0.67 0.00 -0.08 0.00 -0.73 0.00 0.00 57.03 56.89 1nlk h ASP 13 Cb 1.53 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 40.00 1nlk h ASP 13 CO -0.75 0.18 0.06 1.23 -1.03 0.00 0.00 179.24 178.92 1nlk h GLY 14 N 0.71 1.04 1.04 7.15 0.00 -1.19 -0.99 103.07 110.84 1nlk h GLY 14 Ca -0.00 -0.69 -0.18 0.00 0.00 0.00 0.00 47.33 46.46 1nlk h GLY 14 CO 0.02 0.64 -0.57 1.41 0.00 0.00 0.00 176.54 178.04 1nlk h LEU 15 N 0.91 0.82 -1.56 3.11 4.07 -1.54 -2.64 115.31 118.47 1nlk h LEU 15 Ca 0.18 -0.59 -0.03 0.00 0.08 0.00 0.00 57.88 57.52 1nlk h LEU 15 Cb 0.45 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 41.94 1nlk h LEU 15 CO 0.02 1.27 -0.00 -0.33 -1.08 0.00 0.00 178.44 178.31 1nlk h GLU 16 N 0.41 0.27 0.00 1.13 5.08 -1.28 -0.45 114.58 119.74 1nlk h GLU 16 Ca -0.02 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1nlk h GLU 16 Cb 1.20 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1nlk h GLU 16 CO 0.12 0.30 0.00 1.63 -1.00 0.00 0.00 179.01 180.07 1nlk n LYS 17 N -4.38 0.19 -3.37 2.33 5.02 -0.39 -4.93 118.16 112.64 1nlk n LYS 17 Ca -0.00 0.01 -0.19 0.00 -2.02 0.00 0.00 58.31 56.11 1nlk n LYS 17 Cb 0.18 -1.50 0.06 0.00 -0.02 0.00 0.00 35.03 33.76 1nlk n LYS 17 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1nlk n GLY 18 N 1.31 -0.23 0.46 0.72 0.00 -0.18 -4.95 105.19 102.32 1nlk n GLY 18 Ca 0.10 0.06 0.07 0.00 0.00 0.00 0.00 46.02 46.25 1nlk n GLY 18 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1nlk n VAL 19 N -4.49 2.08 -0.06 1.61 0.24 -1.01 -4.77 118.33 111.94 1nlk n VAL 19 Ca 0.01 -2.93 -0.08 0.00 -2.04 0.00 0.00 64.34 59.30 1nlk n VAL 19 Cb 0.55 -0.22 -0.01 0.00 -1.47 0.00 0.00 33.84 32.68 1nlk n VAL 19 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 1nlk h ILE 20 N 0.82 0.82 -0.28 1.34 2.04 -1.91 -1.37 117.51 118.98 1nlk h ILE 20 Ca -0.00 -0.03 0.01 0.00 1.00 0.00 0.00 64.86 65.84 1nlk h ILE 20 Cb 1.01 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.81 1nlk h ILE 20 CO 0.00 0.01 0.16 1.23 0.00 0.00 0.00 178.15 179.56 1nlk h GLY 21 N 0.08 0.38 0.88 5.37 0.00 -1.97 -1.32 103.07 106.50 1nlk h GLY 21 Ca 0.12 -0.12 0.03 0.00 0.00 0.00 0.00 47.33 47.36 1nlk h GLY 21 CO -0.20 0.11 0.50 0.50 0.00 0.00 0.00 176.54 177.45 1nlk h LYS 22 N 0.34 0.95 -0.33 4.80 1.57 -1.83 -0.09 116.57 121.98 1nlk h LYS 22 Ca 0.11 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.79 1nlk h LYS 22 Cb -0.01 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.08 1nlk h LYS 22 CO -0.05 0.63 0.04 0.82 -0.57 0.00 0.00 179.45 180.31 1nlk h ILE 23 N 0.98 1.24 -0.66 1.86 2.04 -0.97 -2.46 117.51 119.54 1nlk h ILE 23 Ca 0.31 -0.87 -0.06 0.00 1.00 0.00 0.00 64.86 65.24 1nlk h ILE 23 Cb 0.01 1.17 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 1nlk h ILE 23 CO -0.11 0.29 0.16 0.40 0.00 0.00 0.00 178.15 178.89 1nlk h ILE 24 N 0.38 1.25 -0.24 -0.67 2.04 -0.81 -2.23 117.51 117.24 1nlk h ILE 24 Ca 0.10 -0.93 -0.03 0.00 1.00 0.00 0.00 64.86 65.00 1nlk h ILE 24 Cb 0.38 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 1nlk h ILE 24 CO 0.01 0.35 0.01 0.28 0.00 0.00 0.00 178.15 178.80 1nlk h SER 25 N 1.00 0.32 -0.30 1.72 0.02 -0.91 -1.23 113.55 114.16 1nlk h SER 25 Ca 0.21 -0.04 0.04 0.00 -0.84 0.00 0.00 61.79 61.16 1nlk h SER 25 Cb 0.35 -0.08 -0.04 0.00 0.14 0.00 0.00 62.40 62.77 1nlk h SER 25 CO 0.00 0.37 0.07 0.03 -1.14 0.00 0.00 176.83 176.16 1nlk h ARG 26 N 0.34 0.17 0.06 3.45 2.47 -0.91 -0.67 114.38 119.29 1nlk h ARG 26 Ca 0.08 -0.01 -0.00 0.00 -1.26 0.00 0.00 59.98 58.79 1nlk h ARG 26 Cb 0.22 -0.04 0.00 0.00 -1.65 0.00 0.00 29.97 28.51 1nlk h ARG 26 CO 0.00 0.11 -0.03 0.74 0.56 0.00 0.00 179.97 181.36 1nlk h PHE 27 N 0.18 -0.07 -0.85 3.04 0.04 -1.36 -2.73 116.94 115.19 1nlk h PHE 27 Ca 0.14 -0.00 0.11 0.00 2.80 0.00 0.00 57.97 61.02 1nlk h PHE 27 Cb 0.14 0.02 -0.08 0.00 2.20 0.00 0.00 35.95 38.24 1nlk h PHE 27 CO -0.17 0.29 0.48 0.93 -0.60 0.00 0.00 178.31 179.24 1nlk h GLU 28 N -0.45 0.75 0.00 1.51 5.08 -1.04 0.12 114.58 120.55 1nlk h GLU 28 Ca -0.01 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1nlk h GLU 28 Cb 0.40 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.48 1nlk h GLU 28 CO 0.01 0.50 -0.07 0.93 -1.00 0.00 0.00 179.01 179.38 1nlk h GLU 29 N 0.78 0.00 -0.48 2.33 5.08 -1.16 -2.76 114.58 118.37 1nlk h GLU 29 Ca 0.42 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.78 1nlk h GLU 29 Cb 0.44 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1nlk h GLU 29 CO -0.27 0.07 0.00 1.63 -1.00 0.00 0.00 179.01 179.44 1nlk n LYS 30 N -3.15 2.33 -0.63 2.33 4.76 -0.37 -4.94 118.16 118.50 1nlk n LYS 30 Ca 0.02 -2.05 0.00 0.00 -2.87 0.00 0.00 58.31 53.41 1nlk n LYS 30 Cb 0.44 -1.47 0.00 0.00 -1.84 0.00 0.00 35.03 32.16 1nlk n LYS 30 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1nlk n GLY 31 N 1.43 0.71 3.40 0.72 0.00 -0.71 -5.02 105.19 105.72 1nlk n GLY 31 Ca 0.19 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.77 1nlk n GLY 31 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nlk s LEU 32 N 0.00 5.33 -0.23 0.99 1.43 0.26 -4.53 118.68 121.94 1nlk s LEU 32 Ca 0.00 -1.23 -0.27 0.00 -1.03 0.00 0.00 54.13 51.60 1nlk s LEU 32 Cb 0.00 -2.33 0.00 0.00 0.03 0.00 0.00 46.19 43.89 1nlk s LEU 32 CO 0.00 -0.90 0.94 -0.75 0.23 0.00 0.00 176.35 175.87 1nlk s LYS 33 N 2.35 4.24 -0.42 1.70 2.20 0.25 -3.22 119.74 126.83 1nlk s LYS 33 Ca 0.11 1.18 -0.28 0.00 -0.36 0.00 0.00 55.97 56.61 1nlk s LYS 33 Cb -0.23 -3.64 -0.00 0.00 -1.51 0.00 0.00 37.83 32.46 1nlk s LYS 33 CO 0.08 -0.56 1.58 -2.14 -0.36 0.00 0.00 175.35 173.95 1nlk s PRO 34 N 2.97 3.38 0.00 4.03 0.02 -1.26 -0.47 135.00 143.67 1nlk s PRO 34 Ca 0.40 1.02 0.21 0.00 0.02 0.00 0.00 61.00 62.65 1nlk s PRO 34 Cb -0.15 -4.12 0.14 0.00 0.02 0.00 0.00 34.50 30.38 1nlk s PRO 34 CO 0.07 -1.80 1.13 1.33 -0.33 0.00 0.00 177.00 177.40 1nlk n VAL 35 N 7.18 0.00 -3.65 3.83 0.24 -0.26 -4.92 118.33 120.75 1nlk n VAL 35 Ca 0.18 -0.46 -0.11 0.00 -2.04 0.00 0.00 64.34 61.91 1nlk n VAL 35 Cb 0.48 1.40 -0.08 0.00 -1.47 0.00 0.00 33.84 34.18 1nlk n VAL 35 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1nlk s ALA 36 N -1.83 -1.69 -0.12 2.33 0.00 -1.22 -0.21 121.76 119.03 1nlk s ALA 36 Ca 0.23 2.08 -0.10 0.00 0.00 0.00 0.00 51.96 54.18 1nlk s ALA 36 Cb 0.17 -1.22 0.03 0.00 0.00 0.00 0.00 23.12 22.10 1nlk s ALA 36 CO 0.30 -0.34 0.30 0.42 0.00 0.00 0.00 175.76 176.45 1nlk s ILE 37 N 1.00 -0.01 -0.30 0.00 1.01 -1.26 -1.67 121.20 119.97 1nlk s ILE 37 Ca -0.05 0.02 -0.10 0.00 0.00 0.00 0.00 60.65 60.52 1nlk s ILE 37 Cb -0.05 -0.43 0.14 0.00 0.01 0.00 0.00 42.46 42.13 1nlk s ILE 37 CO -0.09 0.01 0.69 -0.60 0.00 0.00 0.00 174.94 174.94 1nlk s ARG 38 N 0.36 0.55 0.10 2.79 3.52 -0.16 -4.99 118.95 121.12 1nlk s ARG 38 Ca -0.02 1.35 -0.30 0.00 -0.13 0.00 0.00 55.73 56.63 1nlk s ARG 38 Cb -0.03 0.81 -0.06 0.00 -1.56 0.00 0.00 34.95 34.11 1nlk s ARG 38 CO -0.01 -0.22 0.99 -1.17 -0.81 0.00 0.00 175.30 174.08 1nlk s LEU 39 N 2.85 4.47 -0.04 -0.88 0.20 -1.26 -0.85 118.68 123.18 1nlk s LEU 39 Ca -0.04 1.82 -0.20 0.00 0.69 0.00 0.00 54.13 56.40 1nlk s LEU 39 Cb -0.12 -3.59 0.04 0.00 -0.43 0.00 0.00 46.19 42.10 1nlk s LEU 39 CO -0.19 -0.14 0.43 -1.58 -0.29 0.00 0.00 176.35 174.59 1nlk s GLN 40 N 0.17 0.78 -0.37 1.98 0.74 0.05 -4.96 119.66 118.05 1nlk s GLN 40 Ca 0.49 0.01 -0.11 0.00 0.05 0.00 0.00 55.36 55.79 1nlk s GLN 40 Cb -0.24 0.36 0.02 0.00 1.10 0.00 0.00 33.01 34.25 1nlk s GLN 40 CO 0.30 -0.22 0.20 -1.58 -0.55 0.00 0.00 175.29 173.44 1nlk s HIS 41 N -1.17 3.24 0.46 1.67 5.65 -1.26 -0.65 115.29 123.23 1nlk s HIS 41 Ca -0.12 -0.92 -0.23 0.00 0.25 0.00 0.00 55.06 54.05 1nlk s HIS 41 Cb -0.03 -2.43 -0.07 0.00 -1.18 0.00 0.00 32.58 28.86 1nlk s HIS 41 CO 0.06 -0.63 1.15 -0.51 -0.65 0.00 0.00 174.74 174.16 1nlk s LEU 42 N 1.56 3.99 0.46 8.88 1.43 -1.26 -5.03 118.68 128.71 1nlk s LEU 42 Ca 0.02 2.26 0.01 0.00 -1.03 0.00 0.00 54.13 55.40 1nlk s LEU 42 Cb -0.19 -4.28 0.01 0.00 0.03 0.00 0.00 46.19 41.75 1nlk s LEU 42 CO 0.07 -0.91 0.67 -0.94 0.23 0.00 0.00 176.35 175.46 1nlk s SER 43 N -1.43 5.71 0.18 2.29 1.04 -1.26 -4.69 113.70 115.54 1nlk s SER 43 Ca 0.64 0.14 -0.13 0.00 0.48 0.00 0.00 55.95 57.08 1nlk s SER 43 Cb -0.27 -1.32 0.10 0.00 0.10 0.00 0.00 66.02 64.63 1nlk s SER 43 CO 0.33 -0.78 1.82 -0.61 0.98 0.00 0.00 173.24 174.98 1nlk h GLN 44 N 0.38 0.64 -1.00 4.02 4.15 -1.96 -1.43 115.11 119.90 1nlk h GLN 44 Ca -0.45 -0.04 0.06 0.00 0.77 0.00 0.00 58.65 58.99 1nlk h GLN 44 Cb 1.26 -0.14 -0.06 0.00 0.21 0.00 0.00 27.48 28.75 1nlk h GLN 44 CO 0.55 0.42 0.65 0.00 -1.93 0.00 0.00 178.83 178.52 1nlk h ALA 45 N 1.23 1.39 -0.20 3.38 0.00 -1.99 -0.88 119.26 122.19 1nlk h ALA 45 Ca 0.21 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.02 1nlk h ALA 45 Cb 0.00 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.47 1nlk h ALA 45 CO -0.09 0.47 -0.17 1.96 0.00 0.00 0.00 179.25 181.43 1nlk h GLN 46 N 1.20 0.47 -0.57 0.00 4.20 -1.78 -1.36 115.11 117.27 1nlk h GLN 46 Ca 0.42 -0.24 -0.06 0.00 0.06 0.00 0.00 58.65 58.84 1nlk h GLN 46 Cb 0.13 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.89 1nlk h GLN 46 CO -0.16 0.80 0.13 0.00 -0.67 0.00 0.00 178.83 178.94 1nlk h ALA 47 N 0.66 0.75 -0.04 3.87 0.00 -0.96 -0.40 119.26 123.14 1nlk h ALA 47 Ca 0.04 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1nlk h ALA 47 Cb 0.70 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 1nlk h ALA 47 CO 0.04 0.46 0.01 0.93 0.00 0.00 0.00 179.25 180.69 1nlk h GLU 48 N 0.82 0.07 -0.53 0.00 5.08 -1.19 -1.58 114.58 117.24 1nlk h GLU 48 Ca 0.18 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1nlk h GLU 48 Cb 0.35 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.57 1nlk h GLU 48 CO 0.00 0.29 0.33 0.78 -1.00 0.00 0.00 179.01 179.41 1nlk h GLY 49 N -0.16 0.76 0.89 -3.84 0.00 -1.13 -1.90 103.07 97.68 1nlk h GLY 49 Ca 0.01 -0.30 -0.08 0.00 0.00 0.00 0.00 47.33 46.96 1nlk h GLY 49 CO 0.00 0.29 -0.15 -2.75 0.00 0.00 0.00 176.54 173.93 1nlk h PHE 50 N 0.73 0.68 -0.70 5.60 3.57 -0.89 -3.17 116.94 122.75 1nlk h PHE 50 Ca 0.19 -0.18 -0.32 0.00 3.53 0.00 0.00 57.97 61.19 1nlk h PHE 50 Cb -0.04 -0.15 -0.19 0.00 2.79 0.00 0.00 35.95 38.35 1nlk h PHE 50 CO 0.00 0.84 0.41 0.66 -2.23 0.00 0.00 178.31 177.99 1nlk n TYR 51 N -4.42 2.22 -0.28 0.41 4.01 -0.61 -4.64 117.16 113.85 1nlk n TYR 51 Ca -0.04 -1.35 0.23 0.00 -0.16 0.00 0.00 57.90 56.58 1nlk n TYR 51 Cb 0.38 -0.72 0.55 0.00 -0.31 0.00 0.00 39.34 39.24 1nlk n TYR 51 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1nlk h ALA 52 N 1.67 2.36 0.00 -0.72 0.00 -1.33 0.15 119.26 121.39 1nlk h ALA 52 Ca 0.40 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.33 1nlk h ALA 52 Cb 2.29 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 20.09 1nlk h ALA 52 CO 0.76 -0.70 -0.02 -0.39 0.00 0.00 0.00 179.25 178.90 1nlk h VAL 53 N 0.33 0.23 -0.71 0.00 -1.51 -1.89 -1.66 116.25 111.03 1nlk h VAL 53 Ca 0.53 -0.16 0.00 0.00 -1.23 0.00 0.00 66.70 65.84 1nlk h VAL 53 Cb 1.46 1.12 0.00 0.00 -2.13 0.00 0.00 31.29 31.74 1nlk h VAL 53 CO -0.19 0.02 0.00 1.41 -1.23 0.00 0.00 177.57 177.58 1nlk n HIS 54 N -3.37 0.99 0.12 5.19 -0.00 0.54 -4.61 115.22 114.08 1nlk n HIS 54 Ca -0.02 -0.51 0.19 0.00 -0.00 0.00 0.00 57.72 57.38 1nlk n HIS 54 Cb 0.13 -0.02 0.76 0.00 -0.00 0.00 0.00 29.99 30.87 1nlk n HIS 54 CO 0.00 0.00 0.00 1.57 -0.00 0.00 0.00 176.34 177.91 1nlk h LYS 55 N 4.17 0.00 -0.03 -0.41 2.10 -1.33 0.06 116.57 121.13 1nlk h LYS 55 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1nlk h LYS 55 Cb 1.01 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.34 1nlk h LYS 55 CO 0.01 0.00 -0.09 0.00 -2.00 0.00 0.00 179.45 177.37 1nlk n ALA 56 N -2.36 2.67 -1.89 0.07 0.00 -1.26 -4.95 120.51 112.79 1nlk n ALA 56 Ca 0.06 -0.68 -0.35 0.00 0.00 0.00 0.00 53.44 52.47 1nlk n ALA 56 Cb 0.53 -0.81 -0.07 0.00 0.00 0.00 0.00 19.45 19.11 1nlk n ALA 56 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1nlk s ARG 57 N -2.09 4.34 0.59 0.00 1.81 0.01 -4.97 118.95 118.63 1nlk s ARG 57 Ca 0.26 1.10 0.37 0.00 -1.72 0.00 0.00 55.73 55.74 1nlk s ARG 57 Cb 0.20 -2.55 1.75 0.00 -0.45 0.00 0.00 34.95 33.89 1nlk s ARG 57 CO 0.35 0.18 2.13 -1.00 -0.68 0.00 0.00 175.30 176.28 1nlk h PRO 58 N 2.66 0.00 -0.01 3.54 0.13 -1.93 -2.59 132.00 133.81 1nlk h PRO 58 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1nlk h PRO 58 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1nlk h PRO 58 CO 0.64 0.01 -0.27 1.97 -0.23 0.00 0.00 178.00 180.12 1nlk n PHE 59 N -3.13 0.00 0.00 1.56 1.16 -1.26 -4.51 117.46 111.27 1nlk n PHE 59 Ca -0.01 0.00 -0.13 0.00 -1.87 0.00 0.00 57.45 55.44 1nlk n PHE 59 Cb 0.22 -0.12 -0.07 0.00 -1.61 0.00 0.00 39.48 37.90 1nlk n PHE 59 CO 0.00 0.00 0.00 0.35 -1.87 0.00 0.00 176.76 175.24 1nlk h PHE 60 N 1.26 -1.30 -0.93 2.97 3.57 -1.67 -0.37 116.94 120.47 1nlk h PHE 60 Ca 0.00 0.05 0.15 0.00 3.53 0.00 0.00 57.97 61.70 1nlk h PHE 60 Cb 0.52 0.59 -0.09 0.00 2.79 0.00 0.00 35.95 39.75 1nlk h PHE 60 CO 0.00 -0.50 0.54 0.87 -2.23 0.00 0.00 178.31 176.99 1nlk h LYS 61 N -0.52 0.74 -0.15 1.11 1.57 -1.82 -0.76 116.57 116.75 1nlk h LYS 61 Ca 0.07 -0.04 -0.15 0.00 -1.87 0.00 0.00 60.65 58.65 1nlk h LYS 61 Cb 0.64 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.79 1nlk h LYS 61 CO -0.41 0.49 -0.50 -0.44 -0.57 0.00 0.00 179.45 178.03 1nlk h ASP 62 N 0.76 0.70 -0.61 0.86 3.32 -1.74 -2.53 116.42 117.18 1nlk h ASP 62 Ca 0.50 -0.60 0.05 0.00 0.02 0.00 0.00 57.03 57.00 1nlk h ASP 62 Cb 0.66 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 39.96 1nlk h ASP 62 CO -0.34 1.18 0.33 0.25 -1.72 0.00 0.00 179.24 178.94 1nlk h LEU 63 N 0.25 0.49 -0.45 1.55 5.85 -0.32 -0.55 115.31 122.13 1nlk h LEU 63 Ca -0.02 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1nlk h LEU 63 Cb 1.13 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 42.07 1nlk h LEU 63 CO 0.11 0.32 0.23 0.58 -0.34 0.00 0.00 178.44 179.34 1nlk h VAL 64 N 0.62 1.17 -0.81 1.05 2.07 -1.15 -0.55 116.25 118.65 1nlk h VAL 64 Ca 0.27 -0.48 -0.04 0.00 0.82 0.00 0.00 66.70 67.27 1nlk h VAL 64 Cb 0.15 0.67 -0.04 0.00 -1.52 0.00 0.00 31.29 30.56 1nlk h VAL 64 CO -0.17 0.19 0.35 1.56 0.02 0.00 0.00 177.57 179.52 1nlk h GLN 65 N 0.58 1.19 -0.17 1.57 1.08 -0.94 -2.41 115.11 116.02 1nlk h GLN 65 Ca 0.15 -0.20 -0.03 0.00 -1.45 0.00 0.00 58.65 57.13 1nlk h GLN 65 Cb 0.09 -0.20 -0.01 0.00 -0.05 0.00 0.00 27.48 27.32 1nlk h GLN 65 CO -0.02 0.94 -0.01 0.35 -0.95 0.00 0.00 178.83 179.15 1nlk h PHE 66 N 1.17 0.33 0.00 2.96 3.57 -0.88 -2.24 116.94 121.85 1nlk h PHE 66 Ca 0.27 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.71 1nlk h PHE 66 Cb 0.18 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 38.84 1nlk h PHE 66 CO 0.02 0.52 0.00 0.52 -2.23 0.00 0.00 178.31 177.14 1nlk h MET 67 N 0.04 0.00 -0.17 1.11 2.86 -0.82 -1.28 114.93 116.67 1nlk h MET 67 Ca 0.05 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 1nlk h MET 67 Cb 0.40 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.06 1nlk h MET 67 CO 0.01 0.00 0.00 0.44 1.06 0.00 0.00 176.91 178.42 1nlk n ILE 68 N -2.92 0.52 0.16 -1.22 -5.35 -0.93 -4.55 119.36 105.07 1nlk n ILE 68 Ca -0.02 -0.76 0.02 0.00 -0.27 0.00 0.00 62.75 61.71 1nlk n ILE 68 Cb 0.08 0.84 0.35 0.00 -1.74 0.00 0.00 39.64 39.17 1nlk n ILE 68 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 1nlk h SER 69 N 1.93 0.08 -3.31 7.28 4.64 -0.60 -3.47 113.55 120.10 1nlk h SER 69 Ca 0.00 -0.03 -0.13 0.00 -0.47 0.00 0.00 61.79 61.16 1nlk h SER 69 Cb 0.58 -0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 62.62 1nlk h SER 69 CO 0.00 0.41 0.09 0.61 -0.87 0.00 0.00 176.83 177.07 1nlk n GLY 70 N -0.51 1.50 3.81 -0.77 0.00 -1.26 -5.12 105.19 102.84 1nlk n GLY 70 Ca -0.02 -1.40 -0.30 0.00 0.00 0.00 0.00 46.02 44.31 1nlk n GLY 70 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1nlk s PRO 71 N -2.38 2.26 0.28 1.61 0.04 -1.26 -4.58 135.00 130.97 1nlk s PRO 71 Ca 0.21 0.68 0.03 0.00 0.04 0.00 0.00 61.00 61.95 1nlk s PRO 71 Cb -0.03 -1.94 -0.06 0.00 0.04 0.00 0.00 34.50 32.52 1nlk s PRO 71 CO 0.15 -1.51 0.07 0.14 0.04 0.00 0.00 177.00 175.89 1nlk s VAL 72 N -3.15 0.87 -0.23 -0.36 -7.23 0.17 -3.93 120.40 106.55 1nlk s VAL 72 Ca 0.60 -2.00 -0.00 0.00 -1.81 0.00 0.00 61.98 58.76 1nlk s VAL 72 Cb -0.14 -2.64 0.03 0.00 0.56 0.00 0.00 36.38 34.18 1nlk s VAL 72 CO 0.54 -0.06 -0.11 -0.69 -0.31 0.00 0.00 175.10 174.48 1nlk s VAL 73 N -3.53 2.58 0.02 1.32 1.01 -0.91 -0.77 120.40 120.12 1nlk s VAL 73 Ca 0.36 -1.05 -0.18 0.00 0.00 0.00 0.00 61.98 61.10 1nlk s VAL 73 Cb 0.08 -2.27 -0.06 0.00 0.00 0.00 0.00 36.38 34.13 1nlk s VAL 73 CO 0.13 0.28 0.52 -0.76 0.00 0.00 0.00 175.10 175.27 1nlk s LEU 74 N 1.29 4.46 0.02 3.92 1.43 -0.03 -0.82 118.68 128.96 1nlk s LEU 74 Ca 0.01 1.11 -0.11 0.00 -1.03 0.00 0.00 54.13 54.11 1nlk s LEU 74 Cb -0.16 -2.80 0.01 0.00 0.03 0.00 0.00 46.19 43.27 1nlk s LEU 74 CO -0.07 0.22 0.22 -0.04 0.23 0.00 0.00 176.35 176.91 1nlk s MET 75 N -0.71 0.64 -0.17 1.70 -1.94 0.10 -0.99 119.30 117.94 1nlk s MET 75 Ca 0.28 -0.45 0.01 0.00 -1.71 0.00 0.00 55.69 53.82 1nlk s MET 75 Cb -0.18 0.27 0.01 0.00 2.01 0.00 0.00 34.83 36.95 1nlk s MET 75 CO 0.16 -0.18 -0.18 0.08 -0.01 0.00 0.00 175.02 174.89 1nlk s VAL 76 N -1.94 2.25 -0.12 -6.03 1.01 -0.67 -0.17 120.40 114.73 1nlk s VAL 76 Ca -0.10 -0.89 -0.06 0.00 0.00 0.00 0.00 61.98 60.94 1nlk s VAL 76 Cb -0.04 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.36 1nlk s VAL 76 CO -0.00 0.53 0.08 -0.76 0.00 0.00 0.00 175.10 174.95 1nlk s LEU 77 N 1.14 4.03 -0.08 3.92 1.43 0.37 -1.10 118.68 128.39 1nlk s LEU 77 Ca 0.01 0.29 0.04 0.00 -1.03 0.00 0.00 54.13 53.44 1nlk s LEU 77 Cb -0.14 -1.98 0.00 0.00 0.03 0.00 0.00 46.19 44.11 1nlk s LEU 77 CO -0.08 0.35 -0.20 -0.70 0.23 0.00 0.00 176.35 175.95 1nlk s GLU 78 N -0.68 2.53 0.00 1.70 2.12 0.38 -1.00 118.70 123.76 1nlk s GLU 78 Ca 0.12 -0.72 0.00 0.00 0.36 0.00 0.00 54.97 54.73 1nlk s GLU 78 Cb -0.12 -1.97 0.00 0.00 0.26 0.00 0.00 34.13 32.30 1nlk s GLU 78 CO 0.02 0.15 0.00 0.41 -0.54 0.00 0.00 175.26 175.30 1nlk n GLY 79 N 3.56 -0.86 3.67 -1.50 0.00 -0.62 -0.58 105.19 108.86 1nlk n GLY 79 Ca -0.20 -1.11 -0.42 0.00 0.00 0.00 0.00 46.02 44.29 1nlk n GLY 79 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1nlk s GLU 80 N -2.00 4.17 -1.41 1.61 2.56 -1.26 -0.72 118.70 121.64 1nlk s GLU 80 Ca 0.00 2.37 -0.09 0.00 0.00 0.00 0.00 54.97 57.25 1nlk s GLU 80 Cb 0.00 -3.92 0.06 0.00 2.00 0.00 0.00 34.13 32.27 1nlk s GLU 80 CO 0.00 -0.85 0.64 -1.71 -0.56 0.00 0.00 175.26 172.78 1nlk n ASN 81 N 6.79 -4.56 -0.30 -1.70 5.15 0.58 -4.77 115.26 116.45 1nlk n ASN 81 Ca 0.18 -0.46 0.10 0.00 -0.60 0.00 0.00 54.58 53.79 1nlk n ASN 81 Cb 0.41 -3.71 0.23 0.00 -0.53 0.00 0.00 39.78 36.18 1nlk n ASN 81 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1nlk h ALA 82 N 0.98 1.00 0.12 5.20 0.00 -1.69 0.02 119.26 124.89 1nlk h ALA 82 Ca -0.49 0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.72 1nlk h ALA 82 Cb 1.33 0.49 -0.03 0.00 0.00 0.00 0.00 17.79 19.58 1nlk h ALA 82 CO 0.58 -0.48 -0.21 0.28 0.00 0.00 0.00 179.25 179.41 1nlk h VAL 83 N 0.08 0.52 -0.20 0.00 2.07 -1.89 0.73 116.25 117.57 1nlk h VAL 83 Ca 0.51 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.96 1nlk h VAL 83 Cb 0.97 0.52 -0.00 0.00 -1.52 0.00 0.00 31.29 31.26 1nlk h VAL 83 CO -0.78 0.00 -0.13 -0.07 0.02 0.00 0.00 177.57 176.61 1nlk h LEU 84 N -0.41 0.46 -0.42 2.57 3.38 -1.76 -3.01 115.31 116.13 1nlk h LEU 84 Ca 0.02 -0.44 0.08 0.00 0.09 0.00 0.00 57.88 57.63 1nlk h LEU 84 Cb 0.42 -0.13 -0.07 0.00 0.09 0.00 0.00 40.66 40.98 1nlk h LEU 84 CO -0.11 0.79 0.00 0.00 0.09 0.00 0.00 178.44 179.21 1nlk h ALA 85 N 0.68 0.39 -0.17 1.53 0.00 -0.87 -0.85 119.26 119.96 1nlk h ALA 85 Ca 0.04 0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.11 1nlk h ALA 85 Cb 0.64 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.59 1nlk h ALA 85 CO 0.04 -0.39 -0.10 -0.97 0.00 0.00 0.00 179.25 177.82 1nlk h ASN 86 N 0.11 -0.33 -0.74 0.00 -0.00 -0.87 -1.83 115.58 111.92 1nlk h ASN 86 Ca 0.21 0.08 -0.03 0.00 -0.00 0.00 0.00 56.30 56.55 1nlk h ASN 86 Cb 0.29 0.18 -0.03 0.00 -0.00 0.00 0.00 38.32 38.76 1nlk h ASN 86 CO -0.34 -0.13 0.35 0.03 -0.00 0.00 0.00 177.43 177.34 1nlk h ARG 87 N -0.09 1.08 -0.48 6.67 3.08 -1.29 -0.21 114.38 123.14 1nlk h ARG 87 Ca 0.10 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 59.98 1nlk h ARG 87 Cb 0.24 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 1nlk h ARG 87 CO -0.23 0.84 0.25 0.22 -1.07 0.00 0.00 179.97 179.97 1nlk h ASP 88 N 1.07 0.61 -0.37 7.04 1.82 -0.73 -1.72 116.42 124.13 1nlk h ASP 88 Ca 0.26 -0.10 -0.08 0.00 -0.39 0.00 0.00 57.03 56.71 1nlk h ASP 88 Cb 0.12 -0.15 -0.02 0.00 0.68 0.00 0.00 39.33 39.96 1nlk h ASP 88 CO -0.03 0.54 -0.06 0.40 -1.61 0.00 0.00 179.24 178.48 1nlk h ILE 89 N 0.63 1.25 -0.18 2.25 2.04 -0.91 -3.02 117.51 119.57 1nlk h ILE 89 Ca 0.17 -1.09 -0.01 0.00 1.00 0.00 0.00 64.86 64.93 1nlk h ILE 89 Cb 0.08 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 1nlk h ILE 89 CO -0.02 0.38 0.09 0.24 0.00 0.00 0.00 178.15 178.83 1nlk h MET 90 N 0.73 0.25 0.00 2.37 2.86 -0.63 -0.46 114.93 120.05 1nlk h MET 90 Ca 0.13 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.74 1nlk h MET 90 Cb 0.53 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.14 1nlk h MET 90 CO 0.03 0.27 0.00 0.41 1.06 0.00 0.00 176.91 178.68 1nlk n GLY 91 N -0.86 0.83 3.70 8.32 0.00 -0.68 -0.67 105.19 115.83 1nlk n GLY 91 Ca -0.04 -2.03 -0.37 0.00 0.00 0.00 0.00 46.02 43.58 1nlk n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nlk n ALA 92 N 1.42 0.90 -0.13 4.61 0.00 -1.26 -4.91 120.51 121.15 1nlk n ALA 92 Ca 0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 53.44 53.39 1nlk n ALA 92 Cb 0.00 -2.27 0.04 0.00 0.00 0.00 0.00 19.45 17.21 1nlk n ALA 92 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1nlk h THR 93 N 0.48 0.79 -3.44 0.00 2.02 -1.95 -3.36 112.91 107.45 1nlk h THR 93 Ca -0.50 -0.08 -0.60 0.00 0.77 0.00 0.00 66.41 66.00 1nlk h THR 93 Cb 1.35 0.54 -0.10 0.00 -1.74 0.00 0.00 68.15 68.19 1nlk h THR 93 CO 0.52 0.04 0.43 0.21 0.37 0.00 0.00 175.52 177.09 1nlk s ASN 94 N -5.32 6.67 0.50 4.18 3.84 -1.26 -4.51 114.94 119.04 1nlk s ASN 94 Ca -0.13 0.64 0.25 0.00 0.21 0.00 0.00 52.86 53.83 1nlk s ASN 94 Cb 0.14 -2.42 1.32 0.00 -0.55 0.00 0.00 41.25 39.75 1nlk s ASN 94 CO 0.72 -0.66 1.93 -0.65 -2.79 0.00 0.00 177.10 175.65 1nlk h PRO 95 N 8.18 0.13 -0.87 0.43 0.11 -1.83 -1.15 132.00 136.99 1nlk h PRO 95 Ca -0.24 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 65.88 1nlk h PRO 95 Cb 1.09 -0.03 -0.05 0.00 0.11 0.00 0.00 31.00 32.13 1nlk h PRO 95 CO 0.90 0.08 0.57 0.00 -0.21 0.00 0.00 178.00 179.34 1nlk h ALA 96 N 1.64 1.13 -0.05 -0.75 0.00 -1.91 -2.05 119.26 117.27 1nlk h ALA 96 Ca 0.36 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1nlk h ALA 96 Cb 1.25 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1nlk h ALA 96 CO -0.05 0.46 0.00 1.04 0.00 0.00 0.00 179.25 180.70 1nlk n GLN 97 N -4.51 1.71 -2.15 0.00 3.00 -0.46 -4.94 117.38 110.02 1nlk n GLN 97 Ca 0.10 -1.04 -0.41 0.00 -0.01 0.00 0.00 57.00 55.64 1nlk n GLN 97 Cb 0.05 -1.46 -0.03 0.00 0.00 0.00 0.00 30.24 28.80 1nlk n GLN 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1nlk s ALA 98 N -1.96 3.53 0.94 -1.58 0.00 -0.77 -4.67 121.76 117.26 1nlk s ALA 98 Ca 0.37 1.20 -0.12 0.00 0.00 0.00 0.00 51.96 53.41 1nlk s ALA 98 Cb 0.20 -3.49 0.16 0.00 0.00 0.00 0.00 23.12 19.99 1nlk s ALA 98 CO 0.32 -0.60 1.09 0.00 0.00 0.00 0.00 175.76 176.57 1nlk s ALA 99 N -0.38 1.21 0.28 0.00 0.00 -1.26 -4.79 121.76 116.83 1nlk s ALA 99 Ca 0.54 -0.03 -0.29 0.00 0.00 0.00 0.00 51.96 52.18 1nlk s ALA 99 Cb -0.38 -3.22 -0.10 0.00 0.00 0.00 0.00 23.12 19.42 1nlk s ALA 99 CO 0.44 -2.64 1.32 -2.00 0.00 0.00 0.00 175.76 172.88 1nlk s GLU 100 N -4.84 4.36 0.00 0.00 2.56 -1.26 -2.90 118.70 116.62 1nlk s GLU 100 Ca 0.65 2.17 0.00 0.00 0.00 0.00 0.00 54.97 57.79 1nlk s GLU 100 Cb -0.19 -3.11 0.00 0.00 2.00 0.00 0.00 34.13 32.82 1nlk s GLU 100 CO 0.58 -0.22 0.00 0.41 -0.56 0.00 0.00 175.26 175.47 1nlk n GLY 101 N 1.43 1.67 3.87 -1.50 0.00 -1.26 -5.03 105.19 104.37 1nlk n GLY 101 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1nlk n GLY 101 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nlk s THR 102 N -3.56 4.72 0.17 2.61 -4.23 -1.14 -4.94 115.64 109.27 1nlk s THR 102 Ca 0.00 0.81 -0.14 0.00 -1.18 0.00 0.00 61.69 61.18 1nlk s THR 102 Cb 0.00 -3.84 0.06 0.00 1.34 0.00 0.00 72.50 70.05 1nlk s THR 102 CO 0.00 -1.02 1.82 0.40 -0.54 0.00 0.00 174.62 175.28 1nlk h ILE 103 N -0.01 1.07 -0.60 2.99 2.04 -0.98 -1.99 117.51 120.03 1nlk h ILE 103 Ca -0.45 -0.21 -0.09 0.00 1.00 0.00 0.00 64.86 65.11 1nlk h ILE 103 Cb 1.19 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.66 1nlk h ILE 103 CO 0.62 0.11 0.01 0.03 0.00 0.00 0.00 178.15 178.92 1nlk h ARG 104 N 0.61 1.04 -0.58 2.37 3.08 -1.14 0.31 114.38 120.08 1nlk h ARG 104 Ca 0.19 -0.32 -0.10 0.00 0.07 0.00 0.00 59.98 59.82 1nlk h ARG 104 Cb -0.01 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 1nlk h ARG 104 CO -0.08 1.02 -0.02 -0.22 -1.07 0.00 0.00 179.97 179.60 1nlk h LYS 105 N 0.96 1.04 0.00 0.04 3.11 -1.76 0.33 116.57 120.28 1nlk h LYS 105 Ca 0.17 -0.34 -0.21 0.00 -2.81 0.00 0.00 60.65 57.46 1nlk h LYS 105 Cb 0.54 -0.09 -0.00 0.00 -1.00 0.00 0.00 32.23 31.68 1nlk h LYS 105 CO 0.03 1.03 -0.91 -0.44 -2.81 0.00 0.00 179.45 176.35 1nlk h ASP 106 N 0.93 0.41 0.00 4.20 3.32 -1.12 -3.41 116.42 120.75 1nlk h ASP 106 Ca 0.16 -0.33 0.00 0.00 0.02 0.00 0.00 57.03 56.88 1nlk h ASP 106 Cb 0.58 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.00 1nlk h ASP 106 CO 0.03 1.13 -0.91 0.49 -1.72 0.00 0.00 179.24 178.26 1nlk n PHE 107 N -3.71 0.00 -2.25 4.55 3.72 0.11 -5.07 117.46 114.81 1nlk n PHE 107 Ca -0.05 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 56.97 1nlk n PHE 107 Cb 0.82 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.35 1nlk n PHE 107 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1nlk s ALA 108 N -1.89 3.04 -0.24 4.37 0.00 0.10 -4.91 121.76 122.23 1nlk s ALA 108 Ca 0.00 0.97 0.05 0.00 0.00 0.00 0.00 51.96 52.97 1nlk s ALA 108 Cb 0.00 -3.39 -0.18 0.00 0.00 0.00 0.00 23.12 19.55 1nlk s ALA 108 CO 0.00 -0.64 -0.17 0.25 0.00 0.00 0.00 175.76 175.21 1nlk n THR 109 N -0.28 1.42 -4.00 0.00 -2.24 -1.16 -4.84 114.28 103.17 1nlk n THR 109 Ca 0.06 -0.60 -0.11 0.00 -2.27 0.00 0.00 64.05 61.13 1nlk n THR 109 Cb 0.47 -1.21 -0.03 0.00 -2.10 0.00 0.00 70.33 67.46 1nlk n THR 109 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1nlk s SER 110 N -6.23 0.36 0.24 3.42 1.04 -1.22 -4.96 113.70 106.34 1nlk s SER 110 Ca -0.29 -1.21 -0.03 0.00 0.48 0.00 0.00 55.95 54.90 1nlk s SER 110 Cb 0.08 0.67 0.27 0.00 0.10 0.00 0.00 66.02 67.15 1nlk s SER 110 CO 0.62 -1.32 1.69 -0.29 0.98 0.00 0.00 173.24 174.92 1nlk h ILE 111 N 2.14 1.26 -0.57 -1.02 2.10 -1.96 -2.81 117.51 116.65 1nlk h ILE 111 Ca -0.28 -1.19 -0.31 0.00 1.08 0.00 0.00 64.86 64.16 1nlk h ILE 111 Cb 1.25 1.08 -0.17 0.00 -1.09 0.00 0.00 36.82 37.89 1nlk h ILE 111 CO 0.38 0.40 0.40 -0.90 -1.08 0.00 0.00 178.15 177.35 1nlk n ASP 112 N -4.16 4.03 -2.66 2.19 5.68 -1.26 -3.82 116.55 116.55 1nlk n ASP 112 Ca 0.01 -2.96 -0.03 0.00 -0.50 0.00 0.00 54.79 51.30 1nlk n ASP 112 Cb 0.37 -0.76 0.08 0.00 -1.14 0.00 0.00 41.12 39.67 1nlk n ASP 112 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 1nlk n LYS 113 N -0.33 0.21 -0.90 0.11 4.81 -1.08 -5.00 118.16 115.99 1nlk n LYS 113 Ca 0.34 -0.77 -0.15 0.00 -0.87 0.00 0.00 58.31 56.86 1nlk n LYS 113 Cb 1.06 -0.14 0.16 0.00 0.02 0.00 0.00 35.03 36.13 1nlk n LYS 113 CO 0.00 0.00 0.00 0.27 1.17 0.00 0.00 177.40 178.84 1nlk n ASN 114 N 0.18 3.73 0.00 3.14 0.23 -1.11 -2.99 115.26 118.45 1nlk n ASN 114 Ca -0.11 -3.14 0.00 0.00 -0.53 0.00 0.00 54.58 50.79 1nlk n ASN 114 Cb 0.73 -0.74 0.00 0.00 -2.08 0.00 0.00 39.78 37.69 1nlk n ASN 114 CO 0.00 0.00 0.00 0.41 -0.93 0.00 0.00 177.26 176.74 1nlk n THR 115 N -0.57 0.00 -4.13 5.53 -1.04 -1.26 -4.76 114.28 108.05 1nlk n THR 115 Ca 0.42 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 62.33 1nlk n THR 115 Cb 1.33 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 69.74 1nlk n THR 115 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 1nlk s VAL 116 N 0.00 0.53 0.10 12.58 -7.23 -1.26 -0.02 120.40 125.10 1nlk s VAL 116 Ca 0.00 -1.78 0.08 0.00 -1.81 0.00 0.00 61.98 58.47 1nlk s VAL 116 Cb 0.00 -1.48 -0.03 0.00 0.56 0.00 0.00 36.38 35.43 1nlk s VAL 116 CO 0.00 -0.84 -0.20 -2.28 -0.31 0.00 0.00 175.10 171.47 1nlk s HIS 117 N -3.39 1.70 -0.09 2.82 2.46 0.01 -4.89 115.29 113.92 1nlk s HIS 117 Ca 0.07 -0.43 -0.09 0.00 0.47 0.00 0.00 55.06 55.09 1nlk s HIS 117 Cb 0.04 -0.93 0.02 0.00 -0.13 0.00 0.00 32.58 31.58 1nlk s HIS 117 CO -0.05 0.18 0.25 0.20 -2.47 0.00 0.00 174.74 172.85 1nlk s GLY 118 N -1.90 -0.18 0.41 1.59 0.00 -1.26 -2.46 107.32 103.52 1nlk s GLY 118 Ca 0.05 0.70 -0.27 0.00 0.00 0.00 0.00 44.72 45.21 1nlk s GLY 118 CO 0.04 0.62 1.46 -0.56 0.00 0.00 0.00 173.10 174.66 1nlk s SER 119 N 0.16 6.13 0.00 1.64 0.01 -0.94 -4.93 113.70 115.76 1nlk s SER 119 Ca -0.00 3.00 0.26 0.00 1.31 0.00 0.00 55.95 60.52 1nlk s SER 119 Cb -0.02 -2.66 0.64 0.00 0.21 0.00 0.00 66.02 64.19 1nlk s SER 119 CO 0.00 -1.01 1.51 -0.90 0.41 0.00 0.00 173.24 173.24 1nlk n ASP 120 N 0.17 0.49 -3.66 2.44 5.68 -1.26 -4.88 116.55 115.51 1nlk n ASP 120 Ca 0.03 -0.23 -0.09 0.00 -0.50 0.00 0.00 54.79 53.99 1nlk n ASP 120 Cb 0.40 0.14 -0.02 0.00 -1.14 0.00 0.00 41.12 40.50 1nlk n ASP 120 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 1nlk s SER 121 N -2.94 -0.39 0.13 -1.12 1.04 -1.26 -4.99 113.70 104.17 1nlk s SER 121 Ca 0.13 -0.34 -0.16 0.00 0.48 0.00 0.00 55.95 56.05 1nlk s SER 121 Cb 0.18 0.66 -0.02 0.00 0.10 0.00 0.00 66.02 66.94 1nlk s SER 121 CO 0.66 -1.15 1.67 -0.07 0.98 0.00 0.00 173.24 175.33 1nlk h LEU 122 N 2.03 0.51 -0.57 2.42 3.38 -1.95 0.12 115.31 121.25 1nlk h LEU 122 Ca -0.27 -0.17 0.06 0.00 0.09 0.00 0.00 57.88 57.59 1nlk h LEU 122 Cb 1.28 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.84 1nlk h LEU 122 CO 0.31 0.54 0.28 -0.33 0.09 0.00 0.00 178.44 179.34 1nlk h GLU 123 N 0.45 0.52 0.00 1.13 5.08 -1.99 -1.78 114.58 118.00 1nlk h GLU 123 Ca 0.12 -0.03 -0.10 0.00 -1.00 0.00 0.00 59.36 58.35 1nlk h GLU 123 Cb 0.19 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 1nlk h GLU 123 CO -0.01 0.34 -0.47 -0.91 -1.00 0.00 0.00 179.01 176.96 1nlk h ASN 124 N 0.53 0.00 -0.46 1.42 4.21 -1.92 -3.11 115.58 116.26 1nlk h ASN 124 Ca 0.26 0.00 -0.03 0.00 1.21 0.00 0.00 56.30 57.74 1nlk h ASN 124 Cb 0.19 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.37 1nlk h ASN 124 CO -0.19 0.47 0.18 0.00 -1.29 0.00 0.00 177.43 176.60 1nlk h ALA 125 N 1.53 0.59 -0.59 -0.83 0.00 0.07 0.12 119.26 120.15 1nlk h ALA 125 Ca -0.00 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 54.79 1nlk h ALA 125 Cb 1.07 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.64 1nlk h ALA 125 CO 0.06 0.21 0.34 0.87 0.00 0.00 0.00 179.25 180.73 1nlk h LYS 126 N 0.60 0.64 0.14 0.00 1.57 -1.33 -0.48 116.57 117.70 1nlk h LYS 126 Ca 0.15 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 1nlk h LYS 126 Cb 0.20 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1nlk h LYS 126 CO -0.01 0.42 -0.07 0.82 -0.57 0.00 0.00 179.45 180.04 1nlk h ILE 127 N 0.66 0.97 -0.82 1.86 2.04 -1.45 -2.27 117.51 118.49 1nlk h ILE 127 Ca 0.25 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 65.63 1nlk h ILE 127 Cb 0.09 1.28 -0.04 0.00 -0.74 0.00 0.00 36.82 37.41 1nlk h ILE 127 CO -0.13 0.12 0.53 -0.33 0.00 0.00 0.00 178.15 178.33 1nlk h GLU 128 N -0.42 1.10 -0.18 2.37 5.08 -0.75 -1.01 114.58 120.77 1nlk h GLU 128 Ca -0.02 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.24 1nlk h GLU 128 Cb 0.33 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1nlk h GLU 128 CO 0.03 0.74 0.03 0.82 -1.00 0.00 0.00 179.01 179.63 1nlk h ILE 129 N 1.12 1.22 0.00 3.13 2.04 -1.11 -2.56 117.51 121.35 1nlk h ILE 129 Ca 0.30 -0.71 -0.01 0.00 1.00 0.00 0.00 64.86 65.44 1nlk h ILE 129 Cb -0.10 1.35 -0.00 0.00 -0.74 0.00 0.00 36.82 37.33 1nlk h ILE 129 CO -0.06 0.22 -0.02 0.00 0.00 0.00 0.00 178.15 178.28 1nlk h ALA 130 N 0.83 1.05 -0.26 1.87 0.00 -1.17 0.20 119.26 121.77 1nlk h ALA 130 Ca 0.05 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.77 1nlk h ALA 130 Cb 0.30 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1nlk h ALA 130 CO 0.00 0.03 -0.52 -0.92 0.00 0.00 0.00 179.25 177.84 1nlk h TYR 131 N 0.00 0.94 -0.00 0.00 3.20 -0.77 -3.37 116.97 116.97 1nlk h TYR 131 Ca -0.00 -0.32 0.00 0.00 3.14 0.00 0.00 58.73 61.54 1nlk h TYR 131 Cb 0.29 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.38 1nlk h TYR 131 CO 0.00 1.11 -0.43 1.19 -1.64 0.00 0.00 178.16 178.40 1nlk n PHE 132 N -4.00 0.00 -3.99 -3.82 3.72 -0.86 -5.03 117.46 103.49 1nlk n PHE 132 Ca -0.03 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.24 1nlk n PHE 132 Cb 0.60 0.00 -0.13 0.00 -0.94 0.00 0.00 39.48 39.01 1nlk n PHE 132 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 1nlk s PHE 133 N -1.85 0.24 0.39 1.38 0.08 0.66 -5.10 117.98 113.78 1nlk s PHE 133 Ca 0.04 -0.16 -0.11 0.00 0.12 0.00 0.00 56.93 56.82 1nlk s PHE 133 Cb 0.07 -0.16 -0.07 0.00 -0.57 0.00 0.00 43.02 42.30 1nlk s PHE 133 CO 0.38 -0.04 0.77 1.03 -0.10 0.00 0.00 175.22 177.25 1nlk s ARG 134 N -0.41 3.81 0.49 0.44 0.52 -1.26 -4.32 118.95 118.21 1nlk s ARG 134 Ca -0.03 0.49 0.17 0.00 -0.52 0.00 0.00 55.73 55.84 1nlk s ARG 134 Cb -0.03 -2.40 1.19 0.00 0.52 0.00 0.00 34.95 34.24 1nlk s ARG 134 CO -0.00 -0.01 2.06 0.93 0.02 0.00 0.00 175.30 178.30 1nlk h GLU 135 N 1.38 0.16 0.00 3.54 4.39 -1.96 -0.09 114.58 122.00 1nlk h GLU 135 Ca -0.47 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.22 1nlk h GLU 135 Cb 1.19 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.80 1nlk h GLU 135 CO 0.64 0.10 0.00 0.25 -1.16 0.00 0.00 179.01 178.84 1nlk n THR 136 N -4.48 0.15 0.81 1.13 -2.24 -1.26 -2.28 114.28 106.11 1nlk n THR 136 Ca 0.04 0.04 0.09 0.00 -2.27 0.00 0.00 64.05 61.95 1nlk n THR 136 Cb 0.27 -0.72 0.02 0.00 -2.10 0.00 0.00 70.33 67.80 1nlk n THR 136 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1nlk n GLU 137 N -1.10 1.57 -4.04 -0.78 1.02 -0.05 -4.90 120.64 112.35 1nlk n GLU 137 Ca 0.13 -1.08 -0.35 0.00 -0.02 0.00 0.00 57.16 55.84 1nlk n GLU 137 Cb 0.10 -1.35 -0.11 0.00 -0.02 0.00 0.00 31.44 30.05 1nlk n GLU 137 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1nlk s ILE 138 N -1.97 4.34 -0.17 -3.67 1.01 -0.97 -4.60 121.20 115.16 1nlk s ILE 138 Ca 0.17 -0.19 -0.03 0.00 0.00 0.00 0.00 60.65 60.60 1nlk s ILE 138 Cb 0.15 -2.96 0.06 0.00 0.01 0.00 0.00 42.46 39.71 1nlk s ILE 138 CO 0.41 0.43 0.05 -1.00 0.00 0.00 0.00 174.94 174.83 1nlk s HIS 139 N 0.80 0.65 0.56 3.97 3.76 0.71 -5.02 115.29 120.73 1nlk s HIS 139 Ca 0.02 -0.54 -0.14 0.00 -0.15 0.00 0.00 55.06 54.25 1nlk s HIS 139 Cb -0.14 -0.86 -0.06 0.00 1.11 0.00 0.00 32.58 32.63 1nlk s HIS 139 CO 0.02 -0.53 1.01 0.45 -0.85 0.00 0.00 174.74 174.84 1nlk s SER 140 N 1.98 6.44 -0.01 1.40 0.15 -1.26 -4.62 113.70 117.78 1nlk s SER 140 Ca 0.01 1.50 -0.23 0.00 0.70 0.00 0.00 55.95 57.94 1nlk s SER 140 Cb -0.16 -2.49 0.05 0.00 -1.71 0.00 0.00 66.02 61.71 1nlk s SER 140 CO -0.08 -0.72 0.50 -0.72 1.20 0.00 0.00 173.24 173.42 1nlk s TYR 141 N -2.88 -0.41 0.40 3.44 -0.85 -1.26 -5.14 117.35 110.65 1nlk s TYR 141 Ca 0.57 0.62 -0.24 0.00 -0.52 0.00 0.00 57.07 57.50 1nlk s TYR 141 Cb -0.10 0.27 -0.09 0.00 0.38 0.00 0.00 41.96 42.42 1nlk s TYR 141 CO 0.42 -0.54 1.06 -1.25 -1.52 0.00 0.00 175.55 173.72 1nlk s PRO 142 N -1.62 4.14 0.59 -3.49 0.04 -1.26 -5.06 135.00 128.33 1nlk s PRO 142 Ca -0.10 1.54 -0.00 0.00 0.04 0.00 0.00 61.00 62.48 1nlk s PRO 142 Cb -0.02 -2.54 0.04 0.00 0.04 0.00 0.00 34.50 32.02 1nlk s PRO 142 CO 0.04 -0.17 0.83 0.71 0.04 0.00 0.00 177.00 178.45 1nlk s TYR 143 N -1.64 2.79 0.00 0.56 2.02 -1.26 -5.28 117.35 114.55 1nlk s TYR 143 Ca 0.58 0.05 0.00 0.00 -0.37 0.00 0.00 57.07 57.33 1nlk s TYR 143 Cb -0.23 -2.85 0.00 0.00 -0.40 0.00 0.00 41.96 38.48 1nlk s TYR 143 CO 0.29 -1.02 0.00 0.00 -1.57 0.00 0.00 175.55 173.25