#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3huy n ARG 3 N 0.00 2.37 0.00 1.61 3.00 -1.26 -4.78 116.66 117.60 3huy n ARG 3 Ca 0.00 0.81 0.00 0.00 -0.01 0.00 0.00 57.85 58.65 3huy n ARG 3 Cb 0.00 -2.99 0.00 0.00 0.00 0.00 0.00 32.46 29.47 3huy n ARG 3 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.63 178.61 3huy n TYR 4 N 8.84 0.00 -1.26 -1.55 9.36 -1.26 -4.88 117.16 126.41 3huy n TYR 4 Ca 0.25 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.47 3huy n TYR 4 Cb 0.39 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.10 3huy n TYR 4 CO 0.00 0.00 0.00 -0.89 0.22 0.00 0.00 176.86 176.19 3huy n ILE 5 N 0.00 -6.97 0.00 2.97 5.41 -1.26 -5.07 119.36 114.44 3huy n ILE 5 Ca 0.00 1.78 0.00 0.00 1.00 0.00 0.00 62.75 65.53 3huy n ILE 5 Cb 0.00 -3.48 0.00 0.00 -0.71 0.00 0.00 39.64 35.45 3huy n ILE 5 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3huy n GLY 6 N 0.75 0.70 3.72 7.39 0.00 -1.26 -5.07 105.19 111.42 3huy n GLY 6 Ca 0.00 -1.58 -0.42 0.00 0.00 0.00 0.00 46.02 44.02 3huy n GLY 6 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3huy s PRO 7 N -1.94 4.23 -0.08 1.61 0.02 -1.26 -4.92 135.00 132.66 3huy s PRO 7 Ca 0.00 2.33 -0.06 0.00 0.02 0.00 0.00 61.00 63.29 3huy s PRO 7 Cb 0.00 -3.16 -0.04 0.00 0.02 0.00 0.00 34.50 31.33 3huy s PRO 7 CO 0.00 -0.56 -0.13 0.28 -0.33 0.00 0.00 177.00 176.25 3huy n VAL 8 N 3.71 0.79 0.06 3.83 0.31 -1.26 -4.50 118.33 121.26 3huy n VAL 8 Ca 0.12 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.44 3huy n VAL 8 Cb 0.39 -1.71 0.02 0.00 -0.91 0.00 0.00 33.84 31.63 3huy n VAL 8 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3huy n ARG 10 N -0.89 0.86 -0.08 0.00 0.63 -1.26 -3.52 116.66 112.40 3huy n ARG 10 Ca 0.01 -0.43 -0.11 0.00 -0.92 0.00 0.00 57.85 56.40 3huy n ARG 10 Cb 0.00 -1.49 -0.09 0.00 0.45 0.00 0.00 32.46 31.34 3huy n ARG 10 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 3huy n LEU 11 N -0.69 2.37 -0.36 6.15 4.77 0.69 -4.12 117.00 125.80 3huy n LEU 11 Ca 0.14 -0.07 0.37 0.00 -0.03 0.00 0.00 56.01 56.42 3huy n LEU 11 Cb 0.32 -0.41 0.75 0.00 -2.33 0.00 0.00 43.42 41.74 3huy n LEU 11 CO 0.24 0.70 1.34 0.00 -1.33 0.00 0.00 177.39 178.34 3huy n ARG 13 N -4.06 0.39 0.00 0.00 1.74 -1.24 -3.47 116.66 110.03 3huy n ARG 13 Ca 0.28 -1.54 0.00 0.00 -0.77 0.00 0.00 57.85 55.82 3huy n ARG 13 Cb 1.36 -0.29 0.00 0.00 -1.02 0.00 0.00 32.46 32.51 3huy n ARG 13 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 3huy n ARG 14 N -1.90 0.00 0.11 5.56 3.00 -1.26 -3.85 116.66 118.32 3huy n ARG 14 Ca 0.09 0.00 0.12 0.00 -0.00 0.00 0.00 57.85 58.05 3huy n ARG 14 Cb 0.32 -0.53 0.03 0.00 0.00 0.00 0.00 32.46 32.28 3huy n ARG 14 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 3huy h GLU 15 N 0.00 0.00 0.00 -0.14 3.07 -1.75 -3.49 114.58 112.27 3huy h GLU 15 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3huy h GLU 15 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3huy h GLU 15 CO 0.00 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 178.02 3huy n GLY 16 N 1.19 2.18 3.67 -3.84 0.00 -1.23 -4.95 105.19 102.21 3huy n GLY 16 Ca 0.01 -0.10 -0.53 0.00 0.00 0.00 0.00 46.02 45.39 3huy n GLY 16 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3huy n VAL 17 N 0.00 0.25 -1.03 1.61 0.31 -1.26 -4.72 118.33 113.49 3huy n VAL 17 Ca 0.00 -0.04 -0.35 0.00 -0.01 0.00 0.00 64.34 63.93 3huy n VAL 17 Cb 0.00 -1.26 0.07 0.00 -0.91 0.00 0.00 33.84 31.74 3huy n VAL 17 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 3huy n LYS 18 N 4.68 -0.01 -3.93 5.55 4.81 -1.26 -4.74 118.16 123.25 3huy n LYS 18 Ca 0.23 0.02 -0.10 0.00 -0.87 0.00 0.00 58.31 57.59 3huy n LYS 18 Cb 0.19 -1.46 -0.11 0.00 0.02 0.00 0.00 35.03 33.66 3huy n LYS 18 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 3huy s LEU 19 N 2.87 2.00 -0.87 3.14 2.96 -1.26 -5.01 118.68 122.51 3huy s LEU 19 Ca 0.53 -0.34 -0.00 0.00 -0.22 0.00 0.00 54.13 54.10 3huy s LEU 19 Cb -0.27 0.26 0.23 0.00 0.50 0.00 0.00 46.19 46.91 3huy s LEU 19 CO 0.70 -0.28 0.81 -1.22 -1.32 0.00 0.00 176.35 175.04 3huy n TYR 20 N 1.75 3.93 0.40 5.38 4.02 -1.26 -4.73 117.16 126.65 3huy n TYR 20 Ca -0.22 -4.04 0.04 0.00 -0.01 0.00 0.00 57.90 53.67 3huy n TYR 20 Cb 0.56 -1.04 -0.05 0.00 -0.02 0.00 0.00 39.34 38.79 3huy n TYR 20 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 3huy n LEU 21 N 2.03 0.40 -0.05 7.72 4.77 -1.26 -4.55 117.00 126.06 3huy n LEU 21 Ca 0.23 -0.47 -0.05 0.00 -0.03 0.00 0.00 56.01 55.69 3huy n LEU 21 Cb 0.37 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.39 3huy n LEU 21 CO 0.39 0.10 -0.82 0.29 -1.33 0.00 0.00 177.39 176.02 3huy n LYS 22 N -1.26 2.15 0.00 3.23 5.02 -1.26 -4.70 118.16 121.34 3huy n LYS 22 Ca 0.01 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 3huy n LYS 22 Cb 0.15 -1.24 0.00 0.00 -0.02 0.00 0.00 35.03 33.92 3huy n LYS 22 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3huy n GLY 23 N 2.50 1.31 0.14 0.72 0.00 -1.26 -4.60 105.19 103.99 3huy n GLY 23 Ca -0.16 -0.92 -0.04 0.00 0.00 0.00 0.00 46.02 44.90 3huy n GLY 23 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3huy n GLU 24 N 3.46 -0.15 -0.24 1.61 1.02 -1.26 0.60 120.64 125.69 3huy n GLU 24 Ca 0.00 0.77 0.04 0.00 -0.02 0.00 0.00 57.16 57.95 3huy n GLU 24 Cb 0.00 -1.14 0.14 0.00 -0.02 0.00 0.00 31.44 30.42 3huy n GLU 24 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 3huy h ARG 25 N 0.00 0.10 -4.22 3.49 2.43 -1.94 -3.20 114.38 111.04 3huy h ARG 25 Ca 0.05 -0.01 -0.24 0.00 -0.81 0.00 0.00 59.98 58.98 3huy h ARG 25 Cb 0.14 -0.02 0.04 0.00 -0.42 0.00 0.00 29.97 29.71 3huy h ARG 25 CO -0.31 0.07 1.37 0.00 -1.51 0.00 0.00 179.97 179.58 3huy n TYR 27 N 6.10 -2.70 -1.68 0.00 4.02 -1.21 -4.89 117.16 116.81 3huy n TYR 27 Ca 0.20 0.50 -0.53 0.00 -0.01 0.00 0.00 57.90 58.07 3huy n TYR 27 Cb 0.15 1.49 -0.06 0.00 -0.02 0.00 0.00 39.34 40.90 3huy n TYR 27 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 3huy n SER 28 N -2.86 2.85 -3.21 7.72 7.64 0.40 -4.54 113.62 121.61 3huy n SER 28 Ca 0.00 0.97 0.00 0.00 1.01 0.00 0.00 58.87 60.85 3huy n SER 28 Cb 0.00 -1.25 0.00 0.00 -1.01 0.00 0.00 64.21 61.95 3huy n SER 28 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 3huy n PRO 29 N 6.24 0.00 0.00 1.43 -0.02 -1.26 -3.12 135.00 138.27 3huy n PRO 29 Ca 0.26 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 3huy n PRO 29 Cb 0.21 -0.85 0.00 0.00 -0.02 0.00 0.00 33.50 32.84 3huy n PRO 29 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 3huy n LYS 30 N 2.60 0.00 0.00 -0.52 2.85 -1.26 -4.90 118.16 116.92 3huy n LYS 30 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 3huy n LYS 30 Cb 0.12 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.50 3huy n LYS 30 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3huy n ALA 32 N -0.09 0.00 1.21 0.00 0.00 -1.26 -4.73 120.51 115.63 3huy n ALA 32 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 3huy n ALA 32 Cb 0.05 -1.40 0.34 0.00 0.00 0.00 0.00 19.45 18.43 3huy n ALA 32 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 3huy n MET 33 N 0.67 0.83 -0.04 0.00 0.00 -1.26 -1.88 117.12 115.44 3huy n MET 33 Ca 0.00 -0.51 -0.05 0.00 0.00 0.00 0.00 57.70 57.14 3huy n MET 33 Cb 0.43 -1.49 -0.02 0.00 0.00 0.00 0.00 33.22 32.15 3huy n MET 33 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 3huy n GLU 34 N -0.64 0.27 -0.03 2.12 4.71 -1.26 -4.26 120.64 121.57 3huy n GLU 34 Ca 0.12 0.11 -0.14 0.00 -0.01 0.00 0.00 57.16 57.23 3huy n GLU 34 Cb 0.36 -0.94 -0.09 0.00 -1.01 0.00 0.00 31.44 29.76 3huy n GLU 34 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3huy h ARG 35 N -0.52 -0.51 -2.14 3.49 3.08 -1.91 -3.30 114.38 112.57 3huy h ARG 35 Ca 0.00 0.04 -0.58 0.00 0.07 0.00 0.00 59.98 59.51 3huy h ARG 35 Cb 0.52 0.12 -0.41 0.00 0.08 0.00 0.00 29.97 30.27 3huy h ARG 35 CO 0.00 -0.34 -0.78 0.54 -1.07 0.00 0.00 179.97 178.32 3huy n ARG 36 N -5.43 2.05 0.00 0.04 1.74 -0.79 -4.95 116.66 109.32 3huy n ARG 36 Ca -0.05 -4.23 0.00 0.00 -0.77 0.00 0.00 57.85 52.80 3huy n ARG 36 Cb 0.37 -1.94 0.00 0.00 -1.02 0.00 0.00 32.46 29.87 3huy n ARG 36 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 3huy n PRO 37 N 0.80 0.47 -4.12 5.56 -0.04 -1.22 -4.66 135.00 131.79 3huy n PRO 37 Ca 0.27 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.51 3huy n PRO 37 Cb 0.46 -1.08 -0.05 0.00 -0.04 0.00 0.00 33.50 32.79 3huy n PRO 37 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 3huy s TYR 38 N -1.67 3.02 0.87 0.54 -0.85 -1.26 -4.96 117.35 113.04 3huy s TYR 38 Ca 0.00 -0.15 -0.13 0.00 -0.52 0.00 0.00 57.07 56.27 3huy s TYR 38 Cb 0.00 -1.41 0.06 0.00 0.38 0.00 0.00 41.96 40.99 3huy s TYR 38 CO 0.00 0.50 0.76 -2.30 -1.52 0.00 0.00 175.55 172.99 3huy n PRO 39 N -1.15 -0.10 0.00 -3.49 -0.02 -1.03 -4.68 135.00 124.53 3huy n PRO 39 Ca -0.07 0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.44 3huy n PRO 39 Cb 0.58 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 3huy n PRO 39 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3huy n PRO 40 N -2.38 -0.93 -0.37 0.52 -0.04 -1.26 -3.96 135.00 126.58 3huy n PRO 40 Ca 0.10 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.61 3huy n PRO 40 Cb 0.52 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.97 3huy n PRO 40 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3huy n GLY 41 N 1.60 -2.03 0.13 0.55 0.00 -1.26 -2.27 105.19 101.91 3huy n GLY 41 Ca 0.00 -1.37 -0.13 0.00 0.00 0.00 0.00 46.02 44.52 3huy n GLY 41 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3huy h GLN 42 N 0.00 -0.22 0.00 1.61 4.20 -2.03 -3.08 115.11 115.59 3huy h GLN 42 Ca 0.01 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.73 3huy h GLN 42 Cb 0.34 0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.17 3huy h GLN 42 CO 0.00 0.12 0.00 0.72 -0.67 0.00 0.00 178.83 179.00 3huy n HIS 43 N -5.03 0.00 -0.18 2.96 8.25 -1.26 -4.35 115.22 115.61 3huy n HIS 43 Ca -0.09 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.45 3huy n HIS 43 Cb 0.23 -0.07 0.15 0.00 1.12 0.00 0.00 29.99 31.42 3huy n HIS 43 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3huy n GLY 44 N 0.64 -0.72 2.91 -1.41 0.00 -0.96 -2.43 105.19 103.22 3huy n GLY 44 Ca 0.17 0.51 -0.29 0.00 0.00 0.00 0.00 46.02 46.42 3huy n GLY 44 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3huy s GLN 45 N -5.38 2.28 -0.11 1.61 -2.07 -1.26 -2.46 119.66 112.27 3huy s GLN 45 Ca -0.07 -3.09 -0.08 0.00 -1.82 0.00 0.00 55.36 50.30 3huy s GLN 45 Cb 0.15 -3.36 0.04 0.00 -1.09 0.00 0.00 33.01 28.75 3huy s GLN 45 CO 0.40 -1.23 0.27 0.15 -1.32 0.00 0.00 175.29 173.57 3huy s LYS 46 N -1.05 0.29 -0.36 9.60 1.02 -1.02 -5.07 119.74 123.15 3huy s LYS 46 Ca 0.22 0.46 -0.15 0.00 0.02 0.00 0.00 55.97 56.51 3huy s LYS 46 Cb -0.12 0.06 -0.09 0.00 -0.52 0.00 0.00 37.83 37.16 3huy s LYS 46 CO -0.11 -0.09 1.09 -2.13 -0.92 0.00 0.00 175.35 173.19 3huy n ARG 47 N 3.44 0.00 -1.81 1.68 0.63 -1.26 -4.78 116.66 114.55 3huy n ARG 47 Ca -0.17 0.00 -0.39 0.00 -0.92 0.00 0.00 57.85 56.37 3huy n ARG 47 Cb 0.56 -0.65 0.03 0.00 0.45 0.00 0.00 32.46 32.85 3huy n ARG 47 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3huy s ALA 48 N 3.46 3.03 0.33 5.13 0.00 -1.26 -5.01 121.76 127.44 3huy s ALA 48 Ca 0.57 1.38 -0.03 0.00 0.00 0.00 0.00 51.96 53.87 3huy s ALA 48 Cb -0.58 -3.57 -0.04 0.00 0.00 0.00 0.00 23.12 18.92 3huy s ALA 48 CO 0.24 -1.26 0.59 1.03 0.00 0.00 0.00 175.76 176.36 3huy s ARG 49 N -2.67 3.58 0.18 0.00 1.81 -1.26 -5.03 118.95 115.55 3huy s ARG 49 Ca 0.66 -0.06 -0.33 0.00 -1.72 0.00 0.00 55.73 54.28 3huy s ARG 49 Cb -0.42 -2.61 -0.13 0.00 -0.45 0.00 0.00 34.95 31.34 3huy s ARG 49 CO 0.51 0.14 1.61 -2.13 -0.68 0.00 0.00 175.30 174.75 3huy n ARG 50 N -1.36 2.35 -2.68 3.54 0.00 -1.26 -4.94 116.66 112.29 3huy n ARG 50 Ca -0.02 0.85 -0.41 0.00 -0.00 0.00 0.00 57.85 58.27 3huy n ARG 50 Cb 0.55 -2.63 -0.05 0.00 0.00 0.00 0.00 32.46 30.33 3huy n ARG 50 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.63 175.49 3huy s PRO 51 N 0.87 4.73 0.37 -0.14 0.02 -1.26 -5.04 135.00 134.55 3huy s PRO 51 Ca 0.77 1.53 -0.25 0.00 0.02 0.00 0.00 61.00 63.07 3huy s PRO 51 Cb -0.62 -3.32 -0.09 0.00 0.02 0.00 0.00 34.50 30.49 3huy s PRO 51 CO 0.37 0.29 1.01 -1.54 -0.33 0.00 0.00 177.00 176.80 3huy s SER 52 N -0.46 6.96 0.60 2.53 1.04 -1.26 -4.83 113.70 118.29 3huy s SER 52 Ca 0.45 1.96 0.29 0.00 0.48 0.00 0.00 55.95 59.13 3huy s SER 52 Cb -0.26 -2.58 1.15 0.00 0.10 0.00 0.00 66.02 64.43 3huy s SER 52 CO 0.32 -0.34 1.51 0.44 0.98 0.00 0.00 173.24 176.14 3huy h ASP 53 N 2.70 0.00 0.38 7.02 5.19 -2.01 0.85 116.42 130.55 3huy h ASP 53 Ca -0.48 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 55.91 3huy h ASP 53 Cb 1.21 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.72 3huy h ASP 53 CO 0.63 0.00 -0.18 0.22 -3.12 0.00 0.00 179.24 176.79 3huy h TYR 54 N 0.00 -0.47 -0.42 4.55 3.20 -2.00 -3.27 116.97 118.56 3huy h TYR 54 Ca 0.43 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.33 3huy h TYR 54 Cb 2.41 0.16 -0.05 0.00 1.54 0.00 0.00 36.73 40.79 3huy h TYR 54 CO 0.00 -0.29 -0.22 0.00 -1.64 0.00 0.00 178.16 176.00 3huy n ALA 55 N -2.52 -0.20 -1.00 1.82 0.00 0.29 -0.98 120.51 117.92 3huy n ALA 55 Ca -0.06 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.75 3huy n ALA 55 Cb 0.20 -0.10 0.00 0.00 0.00 0.00 0.00 19.45 19.56 3huy n ALA 55 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3huy n VAL 56 N -4.55 0.00 -0.43 0.00 0.31 -1.02 -0.68 118.33 111.97 3huy n VAL 56 Ca 0.02 0.97 0.35 0.00 -0.01 0.00 0.00 64.34 65.68 3huy n VAL 56 Cb 0.13 -1.70 0.59 0.00 -0.91 0.00 0.00 33.84 31.94 3huy n VAL 56 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3huy n ARG 57 N -0.74 -0.03 0.26 5.55 1.74 -0.35 0.70 116.66 123.80 3huy n ARG 57 Ca 0.00 1.03 -0.11 0.00 -0.77 0.00 0.00 57.85 58.00 3huy n ARG 57 Cb 0.00 -2.07 -0.05 0.00 -1.02 0.00 0.00 32.46 29.32 3huy n ARG 57 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 3huy h LEU 58 N 0.00 -0.61 -0.65 0.55 6.46 -0.48 -1.85 115.31 118.72 3huy h LEU 58 Ca 0.74 0.02 0.00 0.00 -0.12 0.00 0.00 57.88 58.53 3huy h LEU 58 Cb 2.50 0.16 0.00 0.00 -0.73 0.00 0.00 40.66 42.58 3huy h LEU 58 CO -0.33 -0.25 0.00 0.54 -0.62 0.00 0.00 178.44 177.78 3huy n ARG 59 N -4.95 0.07 -0.04 1.25 5.12 0.22 -1.47 116.66 116.86 3huy n ARG 59 Ca -0.09 0.55 -0.22 0.00 -1.93 0.00 0.00 57.85 56.17 3huy n ARG 59 Cb 0.28 -1.71 -0.13 0.00 -1.16 0.00 0.00 32.46 29.74 3huy n ARG 59 CO 0.00 0.00 0.00 1.49 -1.93 0.00 0.00 177.63 177.19 3huy h GLU 60 N 0.00 0.14 0.00 5.56 4.57 -1.01 -3.19 114.58 120.66 3huy h GLU 60 Ca 0.00 -0.24 0.00 0.00 -1.18 0.00 0.00 59.36 57.94 3huy h GLU 60 Cb 0.02 0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.70 3huy h GLU 60 CO 0.00 1.12 0.00 1.17 -1.18 0.00 0.00 179.01 180.12 3huy n LYS 61 N -3.97 0.25 -0.03 1.92 0.00 -0.62 -2.17 118.16 113.53 3huy n LYS 61 Ca -0.31 0.12 -0.18 0.00 0.00 0.00 0.00 58.31 57.94 3huy n LYS 61 Cb 0.86 -1.50 -0.14 0.00 0.00 0.00 0.00 35.03 34.26 3huy n LYS 61 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 3huy n GLN 62 N -1.29 0.71 0.15 1.64 1.13 -0.54 -3.12 117.38 116.06 3huy n GLN 62 Ca 0.08 0.23 -0.07 0.00 -1.94 0.00 0.00 57.00 55.31 3huy n GLN 62 Cb 0.14 -1.67 -0.03 0.00 0.11 0.00 0.00 30.24 28.79 3huy n GLN 62 CO 0.00 0.00 0.00 0.87 -1.44 0.00 0.00 177.06 176.49 3huy h LYS 63 N 0.04 -0.39 -0.44 -1.09 1.57 -1.42 0.43 116.57 115.27 3huy h LYS 63 Ca -0.44 0.03 0.13 0.00 -1.87 0.00 0.00 60.65 58.49 3huy h LYS 63 Cb 2.02 0.09 -0.02 0.00 0.08 0.00 0.00 32.23 34.40 3huy h LYS 63 CO 0.05 -0.26 0.76 1.25 -0.57 0.00 0.00 179.45 180.68 3huy h LEU 64 N -0.40 0.00 0.00 2.94 5.85 -1.64 -2.07 115.31 119.99 3huy h LEU 64 Ca -0.04 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.68 3huy h LEU 64 Cb 0.32 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.35 3huy h LEU 64 CO 0.04 0.00 -0.23 -0.09 -0.34 0.00 0.00 178.44 177.82 3huy h ARG 65 N 0.00 0.00 -1.71 1.25 2.43 -1.09 -3.37 114.38 111.89 3huy h ARG 65 Ca 0.21 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.38 3huy h ARG 65 Cb 1.74 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.29 3huy h ARG 65 CO -0.00 0.00 0.00 0.54 -1.51 0.00 0.00 179.97 179.00 3huy n ARG 66 N -4.38 0.63 -0.01 0.20 1.74 0.14 -0.96 116.66 114.01 3huy n ARG 66 Ca -0.03 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 57.00 3huy n ARG 66 Cb 0.12 -1.19 -0.02 0.00 -1.02 0.00 0.00 32.46 30.35 3huy n ARG 66 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 3huy n ILE 67 N 1.23 0.90 1.28 0.55 5.41 -1.06 -4.49 119.36 123.18 3huy n ILE 67 Ca 0.00 0.13 0.14 0.00 1.00 0.00 0.00 62.75 64.02 3huy n ILE 67 Cb 0.31 -1.71 0.67 0.00 -0.71 0.00 0.00 39.64 38.20 3huy n ILE 67 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 3huy n TYR 68 N -3.57 0.00 -3.47 1.39 4.02 -0.91 -4.94 117.16 109.67 3huy n TYR 68 Ca -0.09 0.00 -0.15 0.00 -0.01 0.00 0.00 57.90 57.65 3huy n TYR 68 Cb 0.36 -0.33 0.00 0.00 -0.02 0.00 0.00 39.34 39.35 3huy n TYR 68 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3huy n GLY 69 N 1.36 -1.23 3.17 2.72 0.00 -0.13 -4.99 105.19 106.08 3huy n GLY 69 Ca 0.12 0.59 -0.14 0.00 0.00 0.00 0.00 46.02 46.59 3huy n GLY 69 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3huy s ILE 70 N -2.93 0.90 0.49 -0.61 2.07 -1.21 -4.87 121.20 115.05 3huy s ILE 70 Ca 0.02 -1.63 -0.23 0.00 -1.41 0.00 0.00 60.65 57.41 3huy s ILE 70 Cb -0.00 -1.34 -0.06 0.00 0.13 0.00 0.00 42.46 41.19 3huy s ILE 70 CO 0.84 -0.57 1.26 -0.94 -1.91 0.00 0.00 174.94 173.62 3huy s SER 71 N -2.43 5.78 0.42 4.50 1.04 -1.26 -4.83 113.70 116.91 3huy s SER 71 Ca 0.05 2.54 0.13 0.00 0.48 0.00 0.00 55.95 59.15 3huy s SER 71 Cb -0.03 -2.62 0.89 0.00 0.10 0.00 0.00 66.02 64.36 3huy s SER 71 CO -0.00 -1.20 1.94 -0.08 0.98 0.00 0.00 173.24 174.88 3huy h GLU 72 N 1.84 0.07 0.49 4.02 4.57 -2.00 0.65 114.58 124.23 3huy h GLU 72 Ca -0.50 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 57.64 3huy h GLU 72 Cb 1.27 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.86 3huy h GLU 72 CO 0.59 0.27 -0.24 -0.09 -1.18 0.00 0.00 179.01 178.37 3huy h ARG 73 N 0.07 -0.64 -0.60 1.92 9.65 -1.99 0.31 114.38 123.11 3huy h ARG 73 Ca 0.01 0.04 0.10 0.00 -1.10 0.00 0.00 59.98 59.03 3huy h ARG 73 Cb 0.39 0.14 -0.07 0.00 -1.39 0.00 0.00 29.97 29.04 3huy h ARG 73 CO 0.03 -0.42 0.20 1.96 2.80 0.00 0.00 179.97 184.53 3huy h GLN 74 N -0.74 0.35 0.02 0.20 4.20 -1.87 -2.00 115.11 115.28 3huy h GLN 74 Ca -0.07 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.62 3huy h GLN 74 Cb 0.51 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.20 3huy h GLN 74 CO 0.11 0.23 -0.07 0.35 -0.67 0.00 0.00 178.83 178.79 3huy h PHE 75 N 0.36 -0.19 -0.90 2.96 3.57 0.40 -1.22 116.94 121.91 3huy h PHE 75 Ca 0.30 0.00 0.25 0.00 3.53 0.00 0.00 57.97 62.06 3huy h PHE 75 Cb 0.40 0.08 -0.15 0.00 2.79 0.00 0.00 35.95 39.07 3huy h PHE 75 CO -0.19 -0.08 0.23 -0.09 -2.23 0.00 0.00 178.31 175.96 3huy h ARG 76 N -0.10 0.17 0.00 1.11 9.65 -0.22 -1.22 114.38 123.78 3huy h ARG 76 Ca -0.00 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 3huy h ARG 76 Cb 0.10 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 28.64 3huy h ARG 76 CO -0.03 0.12 0.00 0.09 2.80 0.00 0.00 179.97 182.94 3huy n ASN 77 N -5.25 0.00 0.00 -3.80 3.02 -0.76 -1.23 115.26 107.23 3huy n ASN 77 Ca 0.22 0.09 0.00 0.00 -0.03 0.00 0.00 54.58 54.86 3huy n ASN 77 Cb 0.72 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.89 3huy n ASN 77 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 3huy n LEU 78 N -0.10 0.00 -0.09 3.41 0.00 -0.50 0.24 117.00 119.96 3huy n LEU 78 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 56.01 55.91 3huy n LEU 78 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 43.42 43.38 3huy n LEU 78 CO 0.00 0.00 0.60 0.15 0.00 0.00 0.00 177.39 178.14 3huy h PHE 79 N 0.00 -1.13 -0.92 1.96 3.57 -1.22 -1.70 116.94 117.50 3huy h PHE 79 Ca 0.00 0.06 0.18 0.00 3.53 0.00 0.00 57.97 61.74 3huy h PHE 79 Cb 0.00 0.54 -0.10 0.00 2.79 0.00 0.00 35.95 39.18 3huy h PHE 79 CO 0.00 -0.43 0.50 0.93 -2.23 0.00 0.00 178.31 177.08 3huy h GLU 80 N -0.34 0.63 -0.92 1.11 4.39 0.45 0.71 114.58 120.60 3huy h GLU 80 Ca 0.13 -0.04 0.08 0.00 0.34 0.00 0.00 59.36 59.87 3huy h GLU 80 Cb 0.58 -0.14 -0.07 0.00 -0.10 0.00 0.00 28.75 29.02 3huy h GLU 80 CO -0.52 0.42 0.57 1.49 -1.16 0.00 0.00 179.01 179.81 3huy h GLU 81 N 0.65 0.98 0.00 2.33 4.81 -0.99 0.21 114.58 122.57 3huy h GLU 81 Ca 0.53 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.70 3huy h GLU 81 Cb 0.82 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.98 3huy h GLU 81 CO -0.40 0.65 0.00 0.00 -0.73 0.00 0.00 179.01 178.53 3huy n ALA 82 N -2.36 1.49 -0.07 2.92 0.00 0.24 -0.98 120.51 121.76 3huy n ALA 82 Ca 0.14 -0.03 -0.12 0.00 0.00 0.00 0.00 53.44 53.43 3huy n ALA 82 Cb 0.22 -1.12 -0.14 0.00 0.00 0.00 0.00 19.45 18.40 3huy n ALA 82 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3huy n SER 83 N -1.34 0.87 0.17 0.00 7.64 0.70 -4.02 113.62 117.63 3huy n SER 83 Ca 0.03 0.13 0.10 0.00 1.01 0.00 0.00 58.87 60.14 3huy n SER 83 Cb 0.07 0.20 0.09 0.00 -1.01 0.00 0.00 64.21 63.55 3huy n SER 83 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 3huy h LYS 84 N 0.01 0.00 -6.42 1.43 1.79 -1.02 -3.44 116.57 108.92 3huy h LYS 84 Ca -0.46 0.00 -0.54 0.00 -2.18 0.00 0.00 60.65 57.47 3huy h LYS 84 Cb 2.09 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 32.73 3huy h LYS 84 CO 0.03 0.09 0.53 0.15 -1.08 0.00 0.00 179.45 179.17 3huy s LYS 85 N -3.20 4.46 0.14 3.15 -0.14 -0.15 -4.97 119.74 119.03 3huy s LYS 85 Ca 0.04 1.62 -0.31 0.00 -1.36 0.00 0.00 55.97 55.96 3huy s LYS 85 Cb 0.07 -3.43 -0.09 0.00 -1.68 0.00 0.00 37.83 32.70 3huy s LYS 85 CO 0.72 -0.23 1.43 0.15 -0.76 0.00 0.00 175.35 176.67 3huy s LYS 86 N 1.31 4.29 0.00 1.68 -0.14 -1.26 -4.85 119.74 120.77 3huy s LYS 86 Ca 0.55 2.15 0.00 0.00 -1.36 0.00 0.00 55.97 57.32 3huy s LYS 86 Cb -0.25 -3.22 0.00 0.00 -1.68 0.00 0.00 37.83 32.68 3huy s LYS 86 CO 0.27 -0.47 0.00 0.41 -0.76 0.00 0.00 175.35 174.80 3huy n GLY 87 N 3.46 3.96 3.53 -3.33 0.00 -1.26 -5.02 105.19 106.54 3huy n GLY 87 Ca 0.12 -1.65 -0.48 0.00 0.00 0.00 0.00 46.02 44.01 3huy n GLY 87 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3huy n VAL 88 N -1.56 0.30 0.00 1.61 0.31 -1.26 -4.87 118.33 112.86 3huy n VAL 88 Ca 0.00 -0.28 0.00 0.00 -0.01 0.00 0.00 64.34 64.05 3huy n VAL 88 Cb 0.00 -1.93 0.00 0.00 -0.91 0.00 0.00 33.84 31.00 3huy n VAL 88 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 3huy n THR 89 N 6.93 0.00 0.00 2.52 -1.04 -1.26 -2.62 114.28 118.81 3huy n THR 89 Ca 0.35 1.31 0.00 0.00 -2.04 0.00 0.00 64.05 63.67 3huy n THR 89 Cb 0.30 -1.95 0.00 0.00 -1.82 0.00 0.00 70.33 66.86 3huy n THR 89 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3huy n GLY 90 N -0.95 0.00 0.09 3.41 0.00 -1.26 0.25 105.19 106.73 3huy n GLY 90 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 3huy n GLY 90 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3huy h SER 91 N 0.00 -0.19 -0.53 1.61 0.02 -1.92 -2.35 113.55 110.19 3huy h SER 91 Ca 0.00 0.01 0.05 0.00 -0.84 0.00 0.00 61.79 61.00 3huy h SER 91 Cb 0.00 0.05 -0.06 0.00 0.14 0.00 0.00 62.40 62.52 3huy h SER 91 CO 0.00 -0.13 -0.31 0.52 -1.14 0.00 0.00 176.83 175.77 3huy n VAL 92 N -2.59 -0.36 -0.04 2.27 0.31 0.14 0.12 118.33 118.18 3huy n VAL 92 Ca -0.03 1.55 -0.01 0.00 -0.01 0.00 0.00 64.34 65.84 3huy n VAL 92 Cb 0.09 -1.94 -0.01 0.00 -0.91 0.00 0.00 33.84 31.07 3huy n VAL 92 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 3huy n PHE 93 N -4.33 -0.04 -0.26 3.52 -0.00 -0.17 0.15 117.46 116.33 3huy n PHE 93 Ca 0.01 0.11 -0.00 0.00 -0.00 0.00 0.00 57.45 57.57 3huy n PHE 93 Cb 0.14 -0.49 0.06 0.00 -0.00 0.00 0.00 39.48 39.19 3huy n PHE 93 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.76 176.69 3huy h LEU 94 N 0.00 -0.90 -0.15 -2.13 3.38 0.25 0.68 115.31 116.44 3huy h LEU 94 Ca 0.01 0.23 0.01 0.00 0.09 0.00 0.00 57.88 58.23 3huy h LEU 94 Cb 0.04 0.53 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 3huy h LEU 94 CO -0.08 -0.27 -0.09 0.61 0.09 0.00 0.00 178.44 178.70 3huy n GLY 95 N -1.48 -2.34 0.36 0.83 0.00 0.39 0.60 105.19 103.55 3huy n GLY 95 Ca 0.09 0.54 0.06 0.00 0.00 0.00 0.00 46.02 46.71 3huy n GLY 95 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3huy h LEU 96 N 0.00 0.73 -0.47 0.99 4.07 0.76 -1.01 115.31 120.38 3huy h LEU 96 Ca 0.02 0.01 0.02 0.00 0.08 0.00 0.00 57.88 58.01 3huy h LEU 96 Cb 0.06 -0.15 -0.03 0.00 1.08 0.00 0.00 40.66 41.62 3huy h LEU 96 CO -0.14 0.46 0.28 -0.07 -1.08 0.00 0.00 178.44 177.89 3huy h LEU 97 N 0.83 0.44 -0.08 1.67 3.38 0.23 -2.83 115.31 118.95 3huy h LEU 97 Ca 0.35 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.30 3huy h LEU 97 Cb 0.28 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 3huy h LEU 97 CO -0.12 0.31 -0.04 -0.08 0.09 0.00 0.00 178.44 178.60 3huy h GLU 98 N 0.55 0.16 0.00 1.13 4.57 0.06 -3.16 114.58 117.89 3huy h GLU 98 Ca 0.19 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.30 3huy h GLU 98 Cb 0.02 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.61 3huy h GLU 98 CO -0.09 0.54 0.33 0.43 -1.18 0.00 0.00 179.01 179.03 3huy n SER 99 N -4.76 0.00 -4.75 1.04 7.64 -0.44 -4.18 113.62 108.16 3huy n SER 99 Ca -0.07 0.17 -0.41 0.00 1.01 0.00 0.00 58.87 59.57 3huy n SER 99 Cb 0.26 -0.17 -0.02 0.00 -1.01 0.00 0.00 64.21 63.27 3huy n SER 99 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 3huy s ARG 100 N -2.35 4.18 0.12 1.43 0.52 -1.20 -0.89 118.95 120.77 3huy s ARG 100 Ca -0.00 2.47 -0.20 0.00 -0.52 0.00 0.00 55.73 57.48 3huy s ARG 100 Cb 0.00 -3.06 -0.04 0.00 0.52 0.00 0.00 34.95 32.36 3huy s ARG 100 CO 0.00 -0.56 1.73 1.25 0.02 0.00 0.00 175.30 177.74 3huy h LEU 101 N 5.09 -0.04 -0.52 2.53 6.46 0.10 -0.78 115.31 128.16 3huy h LEU 101 Ca -0.46 0.04 0.00 0.00 -0.12 0.00 0.00 57.88 57.33 3huy h LEU 101 Cb 1.22 0.06 0.00 0.00 -0.73 0.00 0.00 40.66 41.21 3huy h LEU 101 CO 0.80 0.01 0.07 -0.90 -0.62 0.00 0.00 178.44 177.80 3huy n ASP 102 N -5.11 0.20 -0.07 1.25 5.75 -0.88 0.64 116.55 118.33 3huy n ASP 102 Ca -0.03 0.55 -0.07 0.00 -0.01 0.00 0.00 54.79 55.23 3huy n ASP 102 Cb 0.09 -0.56 -0.15 0.00 -1.03 0.00 0.00 41.12 39.47 3huy n ASP 102 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 3huy n ASN 103 N -1.75 0.18 0.04 -1.12 5.15 -0.42 -4.07 115.26 113.26 3huy n ASN 103 Ca -0.01 0.08 -0.13 0.00 -0.60 0.00 0.00 54.58 53.93 3huy n ASN 103 Cb 0.08 0.91 -0.09 0.00 -0.53 0.00 0.00 39.78 40.15 3huy n ASN 103 CO 0.00 0.00 0.00 0.58 1.40 0.00 0.00 177.26 179.24 3huy h VAL 104 N 0.00 1.12 -0.36 3.44 2.07 0.14 -0.69 116.25 121.97 3huy h VAL 104 Ca -0.43 -1.04 0.10 0.00 0.82 0.00 0.00 66.70 66.16 3huy h VAL 104 Cb 2.04 1.76 -0.01 0.00 -1.52 0.00 0.00 31.29 33.55 3huy h VAL 104 CO 0.03 0.24 0.64 0.58 0.02 0.00 0.00 177.57 179.09 3huy h VAL 105 N -0.63 0.14 0.00 2.57 2.07 -1.06 0.27 116.25 119.61 3huy h VAL 105 Ca -0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.51 3huy h VAL 105 Cb 0.50 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 30.71 3huy h VAL 105 CO 0.02 0.00 -0.09 0.22 0.02 0.00 0.00 177.57 177.75 3huy h TYR 106 N 0.00 0.00 -0.99 1.57 3.20 -1.61 -2.89 116.97 116.25 3huy h TYR 106 Ca 0.17 0.00 0.20 0.00 3.14 0.00 0.00 58.73 62.24 3huy h TYR 106 Cb 1.45 0.00 -0.19 0.00 1.54 0.00 0.00 36.73 39.54 3huy h TYR 106 CO 0.00 0.00 -0.25 -0.09 -1.64 0.00 0.00 178.16 176.18 3huy h ARG 107 N -0.97 0.00 0.00 1.82 9.65 0.92 0.92 114.38 126.73 3huy h ARG 107 Ca 0.00 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 3huy h ARG 107 Cb 0.09 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.67 3huy h ARG 107 CO 0.00 0.00 0.00 -0.07 2.80 0.00 0.00 179.97 182.70 3huy h LEU 108 N 0.00 0.00 0.00 3.80 4.07 -0.79 -3.44 115.31 118.95 3huy h LEU 108 Ca 0.48 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.44 3huy h LEU 108 Cb 0.73 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.47 3huy h LEU 108 CO -1.02 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 176.95 3huy n GLY 109 N 0.02 0.59 0.07 0.83 0.00 0.32 -4.92 105.19 102.09 3huy n GLY 109 Ca 0.01 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.07 3huy n GLY 109 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3huy n PHE 110 N -2.00 0.21 -3.73 1.61 3.01 -1.09 -4.43 117.46 111.03 3huy n PHE 110 Ca 0.00 0.11 -0.13 0.00 1.01 0.00 0.00 57.45 58.44 3huy n PHE 110 Cb 0.00 -0.52 -0.09 0.00 -0.01 0.00 0.00 39.48 38.85 3huy n PHE 110 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3huy s ALA 111 N -2.97 -0.98 0.27 4.37 0.00 -1.24 -4.70 121.76 116.52 3huy s ALA 111 Ca -0.01 0.93 0.18 0.00 0.00 0.00 0.00 51.96 53.06 3huy s ALA 111 Cb 0.02 -0.43 0.80 0.00 0.00 0.00 0.00 23.12 23.51 3huy s ALA 111 CO 0.06 -0.22 1.81 -0.24 0.00 0.00 0.00 175.76 177.17 3huy h VAL 112 N 4.26 0.97 -3.82 0.00 3.04 -1.93 -3.44 116.25 115.32 3huy h VAL 112 Ca -0.28 -1.32 -0.34 0.00 -1.01 0.00 0.00 66.70 63.75 3huy h VAL 112 Cb 1.18 1.78 -0.14 0.00 -2.01 0.00 0.00 31.29 32.09 3huy h VAL 112 CO 0.30 0.34 -0.62 -0.94 -1.01 0.00 0.00 177.57 175.64 3huy s SER 113 N -6.55 1.13 0.14 3.17 1.04 -1.26 -4.48 113.70 106.89 3huy s SER 113 Ca -0.01 -1.38 -0.09 0.00 0.48 0.00 0.00 55.95 54.95 3huy s SER 113 Cb 0.12 0.17 -0.04 0.00 0.10 0.00 0.00 66.02 66.38 3huy s SER 113 CO 0.68 -0.73 1.43 0.03 0.98 0.00 0.00 173.24 175.64 3huy h ARG 114 N 2.41 0.80 -0.15 4.02 3.08 -1.88 0.22 114.38 122.88 3huy h ARG 114 Ca -0.38 -0.51 -0.11 0.00 0.07 0.00 0.00 59.98 59.05 3huy h ARG 114 Cb 1.25 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.34 3huy h ARG 114 CO 0.60 1.14 -0.40 0.00 -1.07 0.00 0.00 179.97 180.24 3huy h ARG 115 N 0.62 0.33 0.00 0.04 3.08 -1.93 1.04 114.38 117.57 3huy h ARG 115 Ca 0.01 -0.16 -0.19 0.00 0.07 0.00 0.00 59.98 59.72 3huy h ARG 115 Cb 1.14 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.17 3huy h ARG 115 CO 0.12 0.68 -0.86 0.37 -1.07 0.00 0.00 179.97 179.21 3huy h GLN 116 N 0.28 0.12 0.00 0.04 4.15 -1.93 0.45 115.11 118.22 3huy h GLN 116 Ca 0.03 -0.13 -0.09 0.00 0.77 0.00 0.00 58.65 59.22 3huy h GLN 116 Cb 0.83 0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.54 3huy h GLN 116 CO 0.07 0.91 -0.45 0.00 -1.93 0.00 0.00 178.83 177.43 3huy h ALA 117 N 1.05 1.00 0.23 3.38 0.00 0.51 -1.65 119.26 123.78 3huy h ALA 117 Ca -0.03 -0.41 -0.33 0.00 0.00 0.00 0.00 54.91 54.14 3huy h ALA 117 Cb 1.49 -0.07 0.03 0.00 0.00 0.00 0.00 17.79 19.24 3huy h ALA 117 CO 0.12 0.56 -1.50 -0.09 0.00 0.00 0.00 179.25 178.34 3huy h ARG 118 N 0.00 0.49 0.00 0.00 2.43 0.15 -3.23 114.38 114.22 3huy h ARG 118 Ca -0.00 -0.83 0.00 0.00 -0.81 0.00 0.00 59.98 58.33 3huy h ARG 118 Cb 0.95 0.31 0.00 0.00 -0.42 0.00 0.00 29.97 30.81 3huy h ARG 118 CO 0.06 1.40 0.00 0.94 -1.51 0.00 0.00 179.97 180.86 3huy n GLN 119 N -3.73 0.00 0.00 0.20 -0.06 0.15 -0.80 117.38 113.14 3huy n GLN 119 Ca -0.19 0.64 0.00 0.00 -2.00 0.00 0.00 57.00 55.45 3huy n GLN 119 Cb 1.07 -1.23 0.00 0.00 -4.06 0.00 0.00 30.24 26.03 3huy n GLN 119 CO 0.00 0.00 0.00 1.28 -0.20 0.00 0.00 177.06 178.14 3huy n LEU 120 N -1.78 0.00 -0.25 1.69 4.77 -0.66 -0.26 117.00 120.52 3huy n LEU 120 Ca 0.00 0.55 0.10 0.00 -0.03 0.00 0.00 56.01 56.64 3huy n LEU 120 Cb 0.00 -0.16 0.20 0.00 -2.33 0.00 0.00 43.42 41.13 3huy n LEU 120 CO 0.00 -0.16 0.56 0.52 -1.33 0.00 0.00 177.39 176.98 3huy n VAL 121 N -1.67 -0.30 -0.15 4.08 0.31 -1.10 0.20 118.33 119.71 3huy n VAL 121 Ca 0.00 1.57 -0.03 0.00 -0.01 0.00 0.00 64.34 65.87 3huy n VAL 121 Cb 0.00 -2.29 0.18 0.00 -0.91 0.00 0.00 33.84 30.83 3huy n VAL 121 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 3huy h ARG 122 N 0.00 0.87 -1.05 5.55 9.65 0.15 -2.11 114.38 127.43 3huy h ARG 122 Ca 0.43 -0.17 -0.23 0.00 -1.10 0.00 0.00 59.98 58.91 3huy h ARG 122 Cb 0.87 -0.13 -0.13 0.00 -1.39 0.00 0.00 29.97 29.18 3huy h ARG 122 CO -0.67 0.76 0.29 0.72 2.80 0.00 0.00 179.97 183.87 3huy n HIS 123 N -4.28 1.32 -4.42 2.20 8.25 0.54 -4.87 115.22 113.96 3huy n HIS 123 Ca 0.04 -1.14 -0.37 0.00 -0.26 0.00 0.00 57.72 55.99 3huy n HIS 123 Cb 0.22 -0.58 -0.09 0.00 1.12 0.00 0.00 29.99 30.66 3huy n HIS 123 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3huy n GLY 124 N -0.14 -0.26 0.01 -1.41 0.00 -0.79 -4.79 105.19 97.81 3huy n GLY 124 Ca 0.26 0.12 0.11 0.00 0.00 0.00 0.00 46.02 46.51 3huy n GLY 124 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3huy n HIS 125 N -4.31 0.12 -4.21 1.61 8.25 -1.18 -4.85 115.22 110.65 3huy n HIS 125 Ca -0.10 0.03 -0.24 0.00 -0.26 0.00 0.00 57.72 57.15 3huy n HIS 125 Cb 0.57 -0.27 -0.07 0.00 1.12 0.00 0.00 29.99 31.34 3huy n HIS 125 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3huy s ILE 126 N -3.10 2.81 0.14 1.59 -1.09 -1.26 0.97 121.20 121.25 3huy s ILE 126 Ca 0.06 -1.82 -0.13 0.00 -2.23 0.00 0.00 60.65 56.53 3huy s ILE 126 Cb 0.16 -2.90 0.01 0.00 -1.58 0.00 0.00 42.46 38.15 3huy s ILE 126 CO 0.80 -0.18 0.35 0.28 -1.23 0.00 0.00 174.94 174.95 3huy s THR 127 N -2.48 0.08 -0.37 2.92 -1.32 -0.62 -2.99 115.64 110.86 3huy s THR 127 Ca 0.36 -0.95 0.01 0.00 -1.21 0.00 0.00 61.69 59.90 3huy s THR 127 Cb -0.01 -1.45 0.12 0.00 -1.51 0.00 0.00 72.50 69.65 3huy s THR 127 CO 0.21 -0.35 0.16 -0.69 -2.21 0.00 0.00 174.62 171.74 3huy s VAL 128 N -3.87 1.19 -0.99 5.08 1.01 -0.96 -1.82 120.40 120.04 3huy s VAL 128 Ca 0.08 -1.99 -0.12 0.00 0.00 0.00 0.00 61.98 59.95 3huy s VAL 128 Cb 0.02 -1.87 -0.01 0.00 0.00 0.00 0.00 36.38 34.53 3huy s VAL 128 CO -0.07 -0.78 0.75 -0.46 0.00 0.00 0.00 175.10 174.54 3huy n ASN 129 N 4.21 -5.87 0.00 3.32 6.94 -0.36 -4.37 115.26 119.13 3huy n ASN 129 Ca 0.03 -0.79 0.00 0.00 -0.02 0.00 0.00 54.58 53.80 3huy n ASN 129 Cb 0.38 -3.61 0.00 0.00 -2.36 0.00 0.00 39.78 34.19 3huy n ASN 129 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3huy n GLY 130 N -1.66 0.91 3.09 4.83 0.00 -1.26 -5.05 105.19 106.04 3huy n GLY 130 Ca -0.11 -1.08 -0.36 0.00 0.00 0.00 0.00 46.02 44.47 3huy n GLY 130 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3huy n ARG 131 N 0.00 -0.14 -3.87 1.61 3.00 -1.26 -4.90 116.66 111.10 3huy n ARG 131 Ca 0.00 -0.03 -0.35 0.00 -0.01 0.00 0.00 57.85 57.46 3huy n ARG 131 Cb 0.00 -1.19 -0.05 0.00 0.00 0.00 0.00 32.46 31.22 3huy n ARG 131 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.63 176.65 3huy s ARG 132 N -2.36 3.47 0.01 5.56 1.70 -1.26 -2.28 118.95 123.79 3huy s ARG 132 Ca 0.43 -0.20 0.07 0.00 -0.47 0.00 0.00 55.73 55.55 3huy s ARG 132 Cb -0.13 -3.13 -0.03 0.00 -0.57 0.00 0.00 34.95 31.09 3huy s ARG 132 CO 0.76 0.71 -0.19 0.08 -1.08 0.00 0.00 175.30 175.59 3huy s VAL 133 N -1.21 2.71 -0.03 4.99 1.01 -1.16 -4.91 120.40 121.80 3huy s VAL 133 Ca 0.23 -1.09 0.05 0.00 0.00 0.00 0.00 61.98 61.17 3huy s VAL 133 Cb -0.13 -2.09 0.07 0.00 0.00 0.00 0.00 36.38 34.23 3huy s VAL 133 CO 0.13 0.43 0.93 -0.90 0.00 0.00 0.00 175.10 175.69 3huy n ASP 134 N 1.85 0.85 -4.36 3.32 3.85 -1.25 -4.46 116.55 116.36 3huy n ASP 134 Ca -0.16 -2.07 -0.45 0.00 -0.71 0.00 0.00 54.79 51.40 3huy n ASP 134 Cb 0.52 -0.19 -0.04 0.00 -1.35 0.00 0.00 41.12 40.06 3huy n ASP 134 CO 0.00 0.00 0.00 -0.76 -1.01 0.00 0.00 177.20 175.43 3huy s LEU 135 N -0.86 5.62 0.39 -2.12 2.01 -1.26 -4.23 118.68 118.23 3huy s LEU 135 Ca 0.08 -1.62 0.17 0.00 0.01 0.00 0.00 54.13 52.77 3huy s LEU 135 Cb 0.07 -2.28 1.06 0.00 0.01 0.00 0.00 46.19 45.05 3huy s LEU 135 CO 0.01 -1.03 1.78 -0.65 1.01 0.00 0.00 176.35 177.47 3huy h PRO 136 N 9.02 0.42 -0.11 1.29 0.11 -1.92 1.52 132.00 142.33 3huy h PRO 136 Ca -0.25 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.84 3huy h PRO 136 Cb 1.08 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.10 3huy h PRO 136 CO 1.07 0.28 0.00 -1.13 -0.21 0.00 0.00 178.00 178.01 3huy n SER 137 N -4.63 0.28 -4.77 -2.05 3.41 -1.26 -2.08 113.62 102.52 3huy n SER 137 Ca 0.24 -2.00 -0.40 0.00 -0.26 0.00 0.00 58.87 56.45 3huy n SER 137 Cb 0.82 -0.06 -0.02 0.00 -0.26 0.00 0.00 64.21 64.69 3huy n SER 137 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 3huy s TYR 138 N -1.89 2.99 -0.32 7.33 5.04 0.52 -4.77 117.35 126.26 3huy s TYR 138 Ca 0.02 1.43 -0.14 0.00 -2.44 0.00 0.00 57.07 55.94 3huy s TYR 138 Cb 0.01 -3.65 -0.03 0.00 0.35 0.00 0.00 41.96 38.64 3huy s TYR 138 CO 0.02 -1.87 0.31 0.50 -1.34 0.00 0.00 175.55 173.16 3huy s ARG 139 N -1.95 3.71 0.16 4.97 6.06 -1.26 0.12 118.95 130.77 3huy s ARG 139 Ca 0.52 -0.35 -0.25 0.00 -2.50 0.00 0.00 55.73 53.15 3huy s ARG 139 Cb -0.39 -3.75 -0.08 0.00 0.06 0.00 0.00 34.95 30.80 3huy s ARG 139 CO 0.51 -0.39 0.76 0.08 -2.50 0.00 0.00 175.30 173.75 3huy s VAL 140 N 1.92 4.40 0.02 7.11 1.01 -0.07 -4.93 120.40 129.86 3huy s VAL 140 Ca 0.10 1.65 0.06 0.00 0.00 0.00 0.00 61.98 63.80 3huy s VAL 140 Cb -0.16 -4.11 -0.02 0.00 0.00 0.00 0.00 36.38 32.09 3huy s VAL 140 CO 0.11 0.51 -0.19 -0.13 0.00 0.00 0.00 175.10 175.40 3huy s ARG 141 N -1.20 1.38 -0.16 2.72 0.52 -1.26 -4.86 118.95 116.08 3huy s ARG 141 Ca 0.36 -0.80 -0.29 0.00 -0.52 0.00 0.00 55.73 54.48 3huy s ARG 141 Cb -0.22 -1.41 -0.14 0.00 0.52 0.00 0.00 34.95 33.70 3huy s ARG 141 CO 0.25 0.37 0.90 -2.30 0.02 0.00 0.00 175.30 174.54 3huy n PRO 142 N 2.19 0.00 -1.38 3.54 -0.02 -1.26 -2.99 135.00 135.08 3huy n PRO 142 Ca -0.16 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.32 3huy n PRO 142 Cb 0.54 -1.01 0.00 0.00 -0.02 0.00 0.00 33.50 33.00 3huy n PRO 142 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3huy n GLY 143 N 1.84 0.47 3.23 -1.23 0.00 -0.11 -5.02 105.19 104.36 3huy n GLY 143 Ca 0.17 -0.33 -0.19 0.00 0.00 0.00 0.00 46.02 45.67 3huy n GLY 143 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3huy s ASP 144 N -2.38 1.98 -0.29 1.61 1.11 -1.16 -4.99 116.67 112.55 3huy s ASP 144 Ca 0.00 -0.74 0.02 0.00 0.18 0.00 0.00 52.55 52.01 3huy s ASP 144 Cb 0.00 -0.07 0.08 0.00 1.07 0.00 0.00 42.92 44.00 3huy s ASP 144 CO 0.00 -0.10 -0.00 -1.61 1.18 0.00 0.00 175.17 174.64 3huy s GLU 145 N -2.29 1.55 -0.30 8.23 2.02 -1.26 -0.86 118.70 125.78 3huy s GLU 145 Ca 0.05 -1.39 -0.14 0.00 0.02 0.00 0.00 54.97 53.51 3huy s GLU 145 Cb -0.07 -2.78 -0.03 0.00 0.10 0.00 0.00 34.13 31.35 3huy s GLU 145 CO 0.03 -0.78 0.34 0.42 0.02 0.00 0.00 175.26 175.29 3huy s ILE 146 N 1.19 5.20 0.03 -1.63 1.09 -0.75 -1.22 121.20 125.10 3huy s ILE 146 Ca 0.02 0.29 0.01 0.00 -1.10 0.00 0.00 60.65 59.87 3huy s ILE 146 Cb -0.19 -3.72 -0.02 0.00 -1.06 0.00 0.00 42.46 37.47 3huy s ILE 146 CO -0.10 0.07 -0.05 0.00 -0.10 0.00 0.00 174.94 174.77 3huy s ALA 147 N 2.00 0.33 0.41 9.38 0.00 -0.75 -2.37 121.76 130.75 3huy s ALA 147 Ca 0.12 -0.66 -0.25 0.00 0.00 0.00 0.00 51.96 51.17 3huy s ALA 147 Cb -0.16 0.10 -0.10 0.00 0.00 0.00 0.00 23.12 22.95 3huy s ALA 147 CO 0.11 -0.09 1.18 0.28 0.00 0.00 0.00 175.76 177.24 3huy n VAL 148 N 1.56 2.50 -0.58 0.00 0.31 -0.98 -1.59 118.33 119.55 3huy n VAL 148 Ca -0.23 -0.50 -0.30 0.00 -0.01 0.00 0.00 64.34 63.30 3huy n VAL 148 Cb 0.55 -1.41 0.21 0.00 -0.91 0.00 0.00 33.84 32.28 3huy n VAL 148 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3huy n ALA 149 N -0.27 -2.75 0.08 3.52 0.00 0.27 -4.75 120.51 116.62 3huy n ALA 149 Ca 0.08 -1.03 -0.03 0.00 0.00 0.00 0.00 53.44 52.45 3huy n ALA 149 Cb 0.39 -1.92 -0.02 0.00 0.00 0.00 0.00 19.45 17.90 3huy n ALA 149 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 3huy h GLU 150 N -2.32 -0.21 0.00 0.00 9.09 -1.91 -1.91 114.58 117.32 3huy h GLU 150 Ca -0.55 0.01 0.00 0.00 0.05 0.00 0.00 59.36 58.88 3huy h GLU 150 Cb 1.32 0.05 0.00 0.00 -1.65 0.00 0.00 28.75 28.47 3huy h GLU 150 CO 0.44 -0.14 0.44 -0.22 0.05 0.00 0.00 179.01 179.57 3huy h LYS 151 N -0.41 0.00 0.09 1.06 3.64 -1.97 0.36 116.57 119.35 3huy h LYS 151 Ca -0.02 0.00 -0.32 0.00 -1.27 0.00 0.00 60.65 59.04 3huy h LYS 151 Cb 0.17 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.97 3huy h LYS 151 CO 0.04 0.00 -1.68 0.77 -2.27 0.00 0.00 179.45 176.30 3huy h SER 152 N 0.00 0.31 0.00 4.20 0.02 -1.86 -3.39 113.55 112.83 3huy h SER 152 Ca 0.00 -0.53 0.00 0.00 -0.84 0.00 0.00 61.79 60.42 3huy h SER 152 Cb 0.88 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.32 3huy h SER 152 CO 0.00 1.46 0.00 -2.11 -1.14 0.00 0.00 176.83 175.04 3huy n ARG 153 N -3.37 0.00 -2.26 3.45 1.85 0.13 -1.57 116.66 114.88 3huy n ARG 153 Ca -0.20 0.00 -0.06 0.00 -1.00 0.00 0.00 57.85 56.58 3huy n ARG 153 Cb 1.05 -1.45 0.05 0.00 -1.05 0.00 0.00 32.46 31.05 3huy n ARG 153 CO 0.00 0.00 0.00 0.27 -0.01 0.00 0.00 177.63 177.89 3huy n ASN 154 N -0.67 2.52 -4.75 2.89 6.94 -1.26 -4.75 115.26 116.17 3huy n ASN 154 Ca 0.00 -2.68 -0.34 0.00 -0.02 0.00 0.00 54.58 51.54 3huy n ASN 154 Cb 0.00 -0.42 -0.08 0.00 -2.36 0.00 0.00 39.78 36.92 3huy n ASN 154 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 3huy s LEU 155 N -3.23 3.82 0.00 -4.53 1.43 -0.61 -4.96 118.68 110.59 3huy s LEU 155 Ca 0.36 0.17 0.00 0.00 -1.03 0.00 0.00 54.13 53.63 3huy s LEU 155 Cb 0.36 -2.06 0.00 0.00 0.03 0.00 0.00 46.19 44.52 3huy s LEU 155 CO -0.03 0.33 0.35 -0.62 0.23 0.00 0.00 176.35 176.60 3huy n GLU 156 N 1.64 0.00 -0.02 1.70 4.71 -1.26 -0.63 120.64 126.78 3huy n GLU 156 Ca -0.16 0.35 -0.03 0.00 -0.01 0.00 0.00 57.16 57.31 3huy n GLU 156 Cb 0.53 -0.60 -0.02 0.00 -1.01 0.00 0.00 31.44 30.34 3huy n GLU 156 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 3huy h LEU 157 N 0.00 -0.39 -0.50 -4.62 4.07 -1.96 0.40 115.31 112.31 3huy h LEU 157 Ca 0.00 0.05 0.13 0.00 0.08 0.00 0.00 57.88 58.13 3huy h LEU 157 Cb 0.00 0.16 -0.09 0.00 1.08 0.00 0.00 40.66 41.80 3huy h LEU 157 CO 0.00 -0.09 -0.03 -0.38 -1.08 0.00 0.00 178.44 176.86 3huy n ILE 158 N -3.24 -0.21 0.00 1.22 2.08 -0.44 0.31 119.36 119.08 3huy n ILE 158 Ca -0.01 1.10 0.00 0.00 0.56 0.00 0.00 62.75 64.40 3huy n ILE 158 Cb 0.08 -1.59 0.00 0.00 -0.75 0.00 0.00 39.64 37.38 3huy n ILE 158 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 3huy n ARG 159 N -4.64 0.00 -0.47 0.38 1.74 0.20 -2.41 116.66 111.46 3huy n ARG 159 Ca 0.11 0.41 0.38 0.00 -0.77 0.00 0.00 57.85 57.98 3huy n ARG 159 Cb 0.35 -1.07 0.63 0.00 -1.02 0.00 0.00 32.46 31.34 3huy n ARG 159 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3huy n GLN 160 N -1.74 -0.02 0.09 5.56 6.02 0.13 -0.76 117.38 126.66 3huy n GLN 160 Ca 0.00 1.07 -0.21 0.00 -0.01 0.00 0.00 57.00 57.85 3huy n GLN 160 Cb 0.00 -2.18 -0.15 0.00 1.02 0.00 0.00 30.24 28.93 3huy n GLN 160 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.06 175.14 3huy h ASN 161 N 0.00 0.58 1.01 1.08 2.35 0.47 -3.23 115.58 117.84 3huy h ASN 161 Ca 0.79 -0.77 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 3huy h ASN 161 Cb 2.70 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 40.88 3huy h ASN 161 CO -0.31 1.63 0.00 0.18 -1.65 0.00 0.00 177.43 177.28 3huy n LEU 162 N -3.57 0.58 0.00 1.61 4.77 0.06 -3.80 117.00 116.66 3huy n LEU 162 Ca -0.19 0.60 0.00 0.00 -0.03 0.00 0.00 56.01 56.38 3huy n LEU 162 Cb 1.07 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 41.69 3huy n LEU 162 CO 0.53 -0.33 0.27 1.21 -1.33 0.00 0.00 177.39 177.75 3huy n GLU 163 N -2.09 0.00 0.00 3.23 4.07 -0.42 -2.18 120.64 123.26 3huy n GLU 163 Ca 0.04 0.27 0.00 0.00 -0.06 0.00 0.00 57.16 57.41 3huy n GLU 163 Cb 0.31 -1.04 0.00 0.00 -0.06 0.00 0.00 31.44 30.65 3huy n GLU 163 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3huy n ALA 164 N -0.88 1.15 -0.06 4.31 0.00 -1.25 -0.48 120.51 123.31 3huy n ALA 164 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 3huy n ALA 164 Cb 0.00 -0.89 -0.09 0.00 0.00 0.00 0.00 19.45 18.47 3huy n ALA 164 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 3huy n MET 165 N 0.73 1.99 -1.62 0.00 2.81 -0.92 -4.81 117.12 115.29 3huy n MET 165 Ca 0.00 0.00 -0.51 0.00 -1.81 0.00 0.00 57.70 55.38 3huy n MET 165 Cb 0.00 -1.30 -0.06 0.00 -0.71 0.00 0.00 33.22 31.16 3huy n MET 165 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 3huy n LYS 166 N -2.46 1.41 -0.70 0.03 5.02 0.37 -0.53 118.16 121.31 3huy n LYS 166 Ca -0.19 0.51 0.00 0.00 -2.02 0.00 0.00 58.31 56.61 3huy n LYS 166 Cb 0.87 -2.19 0.00 0.00 -0.02 0.00 0.00 35.03 33.69 3huy n LYS 166 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3huy n GLY 167 N 2.92 0.37 3.51 0.72 0.00 -1.26 -4.95 105.19 106.51 3huy n GLY 167 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 3huy n GLY 167 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3huy s ARG 168 N -0.64 3.77 0.54 1.61 3.52 0.31 -5.09 118.95 122.98 3huy s ARG 168 Ca 0.00 -0.42 -0.18 0.00 -0.13 0.00 0.00 55.73 55.00 3huy s ARG 168 Cb 0.00 -3.40 -0.06 0.00 -1.56 0.00 0.00 34.95 29.93 3huy s ARG 168 CO 0.00 -0.13 1.05 0.15 -0.81 0.00 0.00 175.30 175.56 3huy s LYS 169 N 1.50 3.56 0.54 5.12 1.02 -1.26 -4.90 119.74 125.32 3huy s LYS 169 Ca 0.06 1.27 0.03 0.00 0.02 0.00 0.00 55.97 57.35 3huy s LYS 169 Cb -0.15 -2.06 0.03 0.00 -0.52 0.00 0.00 37.83 35.13 3huy s LYS 169 CO 0.05 -0.62 0.25 0.28 -0.92 0.00 0.00 175.35 174.39 3huy n VAL 170 N -1.52 0.00 -1.60 3.17 0.31 -1.26 -5.09 118.33 112.34 3huy n VAL 170 Ca 0.09 -2.32 -0.47 0.00 -0.01 0.00 0.00 64.34 61.63 3huy n VAL 170 Cb 0.53 0.19 -0.03 0.00 -0.91 0.00 0.00 33.84 33.62 3huy n VAL 170 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3huy n GLY 171 N -1.53 0.14 0.38 2.92 0.00 -1.26 -4.86 105.19 100.98 3huy n GLY 171 Ca -0.10 0.49 0.19 0.00 0.00 0.00 0.00 46.02 46.60 3huy n GLY 171 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3huy h PRO 172 N 3.28 0.51 0.00 1.61 0.11 -1.98 0.53 132.00 136.05 3huy h PRO 172 Ca -0.43 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3huy h PRO 172 Cb 1.33 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3huy h PRO 172 CO 0.69 0.33 0.00 -2.67 -0.21 0.00 0.00 178.00 176.15 3huy n TRP 173 N -4.72 0.00 -4.68 0.65 2.14 -1.26 -4.83 117.44 104.74 3huy n TRP 173 Ca 0.25 0.00 -0.30 0.00 2.07 0.00 0.00 57.50 59.52 3huy n TRP 173 Cb 0.77 0.00 -0.08 0.00 -0.81 0.00 0.00 31.31 31.19 3huy n TRP 173 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 3huy s LEU 174 N -1.76 2.30 0.34 5.67 1.43 0.18 -1.15 118.68 125.70 3huy s LEU 174 Ca 0.33 -1.61 0.07 0.00 -1.03 0.00 0.00 54.13 51.88 3huy s LEU 174 Cb 0.15 -0.61 -0.03 0.00 0.03 0.00 0.00 46.19 45.74 3huy s LEU 174 CO 0.25 -0.81 0.31 -0.94 0.23 0.00 0.00 176.35 175.39 3huy s SER 175 N -3.79 1.72 -0.30 2.29 1.04 -0.83 -4.81 113.70 109.03 3huy s SER 175 Ca 0.14 -1.77 -0.20 0.00 0.48 0.00 0.00 55.95 54.60 3huy s SER 175 Cb 0.03 0.58 0.19 0.00 0.10 0.00 0.00 66.02 66.92 3huy s SER 175 CO 0.08 -1.10 1.27 -0.22 0.98 0.00 0.00 173.24 174.24 3huy s LEU 176 N -3.38 -0.16 -0.80 2.42 2.96 -1.26 -3.79 118.68 114.67 3huy s LEU 176 Ca 0.40 0.27 0.02 0.00 -0.22 0.00 0.00 54.13 54.61 3huy s LEU 176 Cb 0.02 1.26 0.32 0.00 0.50 0.00 0.00 46.19 48.29 3huy s LEU 176 CO 0.28 -0.05 1.29 -0.67 -1.32 0.00 0.00 176.35 175.89 3huy n ASP 177 N 2.53 5.64 0.00 3.68 -0.08 -1.15 -4.95 116.55 122.21 3huy n ASP 177 Ca -0.14 -3.63 0.00 0.00 -1.51 0.00 0.00 54.79 49.51 3huy n ASP 177 Cb 0.57 -0.87 0.00 0.00 2.34 0.00 0.00 41.12 43.16 3huy n ASP 177 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 3huy n VAL 178 N 0.13 0.00 0.15 5.18 0.31 -1.26 0.18 118.33 123.01 3huy n VAL 178 Ca 0.36 0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.80 3huy n VAL 178 Cb 0.34 0.00 -0.15 0.00 -0.91 0.00 0.00 33.84 33.12 3huy n VAL 178 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 3huy n GLU 179 N -3.66 0.56 0.15 5.55 2.13 -1.26 -4.03 120.64 120.07 3huy n GLU 179 Ca 0.00 -0.15 0.02 0.00 0.66 0.00 0.00 57.16 57.69 3huy n GLU 179 Cb 0.00 -1.54 0.18 0.00 0.27 0.00 0.00 31.44 30.35 3huy n GLU 179 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 3huy h GLY 180 N 4.15 0.00 -0.60 8.31 0.00 0.15 -3.47 103.07 111.61 3huy h GLY 180 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 3huy h GLY 180 CO 0.00 0.00 -0.11 1.03 0.00 0.00 0.00 176.54 177.46 3huy n MET 181 N -3.51 -0.37 -3.67 4.80 2.81 0.14 -4.96 117.12 112.37 3huy n MET 181 Ca 0.00 0.30 -0.29 0.00 -1.81 0.00 0.00 57.70 55.90 3huy n MET 181 Cb 0.63 -4.05 -0.16 0.00 -0.71 0.00 0.00 33.22 28.94 3huy n MET 181 CO 0.00 0.00 0.00 -1.59 1.51 0.00 0.00 175.97 175.89 3huy s LYS 182 N -3.94 0.51 0.51 0.03 -2.85 -1.25 -2.32 119.74 110.42 3huy s LYS 182 Ca 0.00 -0.65 0.07 0.00 -1.00 0.00 0.00 55.97 54.40 3huy s LYS 182 Cb 0.00 -1.80 0.03 0.00 -2.06 0.00 0.00 37.83 34.00 3huy s LYS 182 CO 0.00 -0.86 0.50 0.20 0.10 0.00 0.00 175.35 175.29 3huy s GLY 183 N 1.86 2.13 0.05 0.59 0.00 -1.00 -2.91 107.32 108.04 3huy s GLY 183 Ca 0.05 -1.68 0.03 0.00 0.00 0.00 0.00 44.72 43.13 3huy s GLY 183 CO -0.21 -1.79 -0.10 0.54 0.00 0.00 0.00 173.10 171.53 3huy s LYS 184 N -4.34 0.65 -0.62 2.90 1.02 -1.25 -1.81 119.74 116.30 3huy s LYS 184 Ca 0.46 -0.82 -0.18 0.00 0.02 0.00 0.00 55.97 55.45 3huy s LYS 184 Cb -0.04 -0.53 0.12 0.00 -0.52 0.00 0.00 37.83 36.86 3huy s LYS 184 CO 0.28 0.11 0.70 0.12 -0.92 0.00 0.00 175.35 175.64 3huy s PHE 185 N -1.28 3.08 0.00 3.18 5.36 -0.04 -1.96 117.98 126.32 3huy s PHE 185 Ca -0.06 -1.09 0.00 0.00 -0.96 0.00 0.00 56.93 54.82 3huy s PHE 185 Cb -0.10 -3.99 0.00 0.00 -0.34 0.00 0.00 43.02 38.59 3huy s PHE 185 CO 0.01 -1.25 0.22 1.28 -1.46 0.00 0.00 175.22 174.02 3huy n LEU 186 N 6.07 0.38 0.00 6.12 4.77 -0.30 -0.93 117.00 133.11 3huy n LEU 186 Ca -0.07 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 3huy n LEU 186 Cb 0.43 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 3huy n LEU 186 CO 0.56 0.00 0.00 -2.11 -1.33 0.00 0.00 177.39 174.51 3huy n ARG 187 N -0.29 3.67 -4.04 3.23 1.85 -1.21 -3.27 116.66 116.60 3huy n ARG 187 Ca 0.00 0.00 -0.33 0.00 -1.00 0.00 0.00 57.85 56.52 3huy n ARG 187 Cb 0.00 0.00 -0.15 0.00 -1.05 0.00 0.00 32.46 31.26 3huy n ARG 187 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 3huy s LEU 188 N 0.00 2.88 0.00 2.89 1.43 -1.26 -4.66 118.68 119.96 3huy s LEU 188 Ca 0.00 -0.91 0.00 0.00 -1.03 0.00 0.00 54.13 52.19 3huy s LEU 188 Cb 0.00 -1.57 0.00 0.00 0.03 0.00 0.00 46.19 44.65 3huy s LEU 188 CO 0.00 -0.09 0.59 -0.81 0.23 0.00 0.00 176.35 176.26 3huy n PRO 189 N 4.60 0.00 -1.57 1.29 -0.04 -1.26 -4.75 135.00 133.26 3huy n PRO 189 Ca -0.17 0.00 -0.55 0.00 -0.04 0.00 0.00 63.50 62.73 3huy n PRO 189 Cb 0.47 -0.74 -0.08 0.00 -0.04 0.00 0.00 33.50 33.11 3huy n PRO 189 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 3huy n ASP 190 N 3.03 2.16 0.00 3.54 4.64 -1.26 -4.77 116.55 123.89 3huy n ASP 190 Ca 0.00 0.80 0.00 0.00 -1.38 0.00 0.00 54.79 54.21 3huy n ASP 190 Cb 0.29 -1.16 0.00 0.00 -1.04 0.00 0.00 41.12 39.21 3huy n ASP 190 CO 0.00 0.00 0.00 -1.14 -0.82 0.00 0.00 177.20 175.24 3huy n ARG 191 N 6.63 0.00 -0.29 -0.67 3.00 -1.26 0.88 116.66 124.95 3huy n ARG 191 Ca 0.35 0.00 0.07 0.00 -0.00 0.00 0.00 57.85 58.27 3huy n ARG 191 Cb 0.15 0.00 0.19 0.00 0.00 0.00 0.00 32.46 32.80 3huy n ARG 191 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.63 179.12 3huy h GLU 192 N 0.00 0.07 0.00 -0.14 4.57 -2.00 -0.68 114.58 116.40 3huy h GLU 192 Ca 0.00 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 3huy h GLU 192 Cb 0.00 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.57 3huy h GLU 192 CO 0.00 0.05 0.00 -0.25 -1.18 0.00 0.00 179.01 177.63 3huy n ASP 193 N -5.41 0.00 -4.73 1.04 8.00 0.25 -4.62 116.55 111.08 3huy n ASP 193 Ca 0.16 0.12 -0.31 0.00 0.71 0.00 0.00 54.79 55.47 3huy n ASP 193 Cb 0.54 -0.13 -0.07 0.00 -0.02 0.00 0.00 41.12 41.44 3huy n ASP 193 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3huy s LEU 194 N -2.25 3.66 -0.10 0.64 2.01 -0.26 -4.94 118.68 117.44 3huy s LEU 194 Ca 0.01 -0.05 0.16 0.00 0.01 0.00 0.00 54.13 54.26 3huy s LEU 194 Cb 0.00 -2.30 0.36 0.00 0.01 0.00 0.00 46.19 44.26 3huy s LEU 194 CO 0.01 0.20 1.17 0.00 1.01 0.00 0.00 176.35 178.73 3huy n ALA 195 N 0.71 2.82 -1.66 4.21 0.00 -1.26 -5.04 120.51 120.28 3huy n ALA 195 Ca -0.11 -2.60 -0.42 0.00 0.00 0.00 0.00 53.44 50.31 3huy n ALA 195 Cb 0.52 -0.51 0.00 0.00 0.00 0.00 0.00 19.45 19.46 3huy n ALA 195 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3huy n LEU 196 N -0.45 3.20 0.00 0.00 4.32 -1.26 -4.81 117.00 117.99 3huy n LEU 196 Ca 0.12 1.12 0.06 0.00 -0.02 0.00 0.00 56.01 57.29 3huy n LEU 196 Cb 0.85 -1.43 0.35 0.00 -1.62 0.00 0.00 43.42 41.57 3huy n LEU 196 CO -0.03 -0.95 0.59 -0.81 -1.22 0.00 0.00 177.39 174.97 3huy n PRO 197 N 0.30 0.61 -3.49 3.23 -0.04 -1.26 -4.77 135.00 129.57 3huy n PRO 197 Ca 0.07 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.19 3huy n PRO 197 Cb 0.37 -1.30 -0.05 0.00 -0.04 0.00 0.00 33.50 32.48 3huy n PRO 197 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3huy s VAL 198 N -2.00 5.00 -0.24 0.52 1.01 -1.26 -5.08 120.40 118.35 3huy s VAL 198 Ca 0.17 0.54 -0.06 0.00 0.00 0.00 0.00 61.98 62.63 3huy s VAL 198 Cb 0.08 -3.67 -0.02 0.00 0.00 0.00 0.00 36.38 32.77 3huy s VAL 198 CO 0.13 0.20 0.03 0.21 0.00 0.00 0.00 175.10 175.68 3huy s ASN 199 N -1.89 4.85 0.12 3.32 3.84 -1.26 -5.01 114.94 118.91 3huy s ASN 199 Ca 0.37 -0.31 -0.07 0.00 0.21 0.00 0.00 52.86 53.07 3huy s ASN 199 Cb -0.14 -1.86 -0.11 0.00 -0.55 0.00 0.00 41.25 38.59 3huy s ASN 199 CO 0.19 -0.04 1.29 1.05 -2.79 0.00 0.00 177.10 176.80 3huy h GLU 200 N 8.20 0.50 -1.05 0.43 9.09 -1.98 -3.04 114.58 126.74 3huy h GLU 200 Ca -0.39 -0.52 0.27 0.00 0.05 0.00 0.00 59.36 58.78 3huy h GLU 200 Cb 1.17 0.14 -0.11 0.00 -1.65 0.00 0.00 28.75 28.30 3huy h GLU 200 CO 0.59 1.15 0.65 1.96 0.05 0.00 0.00 179.01 183.42 3huy h GLN 201 N 0.30 0.41 0.46 1.06 1.08 -1.97 1.24 115.11 117.69 3huy h GLN 201 Ca -0.08 -0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.07 3huy h GLN 201 Cb 1.56 -0.09 0.00 0.00 -0.05 0.00 0.00 27.48 28.90 3huy h GLN 201 CO 0.17 0.27 -0.22 -0.07 -0.95 0.00 0.00 178.83 178.03 3huy h LEU 202 N 0.43 -0.53 -0.95 1.46 3.38 -1.97 -2.03 115.31 115.10 3huy h LEU 202 Ca 0.63 -0.09 0.26 0.00 0.09 0.00 0.00 57.88 58.78 3huy h LEU 202 Cb 1.50 0.14 -0.14 0.00 0.09 0.00 0.00 40.66 42.25 3huy h LEU 202 CO -0.37 -0.16 0.45 0.58 0.09 0.00 0.00 178.44 179.03 3huy h VAL 203 N -0.96 0.38 -0.32 1.22 2.07 0.86 0.94 116.25 120.45 3huy h VAL 203 Ca -0.06 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 3huy h VAL 203 Cb 0.58 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.33 3huy h VAL 203 CO 0.10 0.06 0.12 0.40 0.02 0.00 0.00 177.57 178.28 3huy h ILE 204 N 0.36 1.19 0.24 4.57 1.08 0.12 -3.16 117.51 121.91 3huy h ILE 204 Ca 0.64 -0.60 0.01 0.00 -0.39 0.00 0.00 64.86 64.51 3huy h ILE 204 Cb 1.32 0.99 -0.03 0.00 -3.07 0.00 0.00 36.82 36.03 3huy h ILE 204 CO -0.58 0.21 -0.38 -0.33 -0.69 0.00 0.00 178.15 176.38 3huy h GLU 205 N 0.37 -0.67 -1.55 2.37 5.08 0.16 -2.01 114.58 118.32 3huy h GLU 205 Ca 0.11 0.05 0.45 0.00 -1.00 0.00 0.00 59.36 58.96 3huy h GLU 205 Cb 0.21 0.15 -0.06 0.00 0.50 0.00 0.00 28.75 29.55 3huy h GLU 205 CO -0.01 -0.44 1.14 0.35 -1.00 0.00 0.00 179.01 179.05 3huy h PHE 206 N -0.69 0.00 -1.21 4.33 3.57 -0.81 -2.71 116.94 119.42 3huy h PHE 206 Ca -0.00 0.00 -0.75 0.00 3.53 0.00 0.00 57.97 60.75 3huy h PHE 206 Cb 0.67 0.00 -0.14 0.00 2.79 0.00 0.00 35.95 39.27 3huy h PHE 206 CO -0.27 0.00 2.16 0.66 -2.23 0.00 0.00 178.31 178.62 3huy n TYR 207 N -4.01 3.23 -1.24 0.41 0.53 -0.76 -2.16 117.16 113.17 3huy n TYR 207 Ca 0.34 -2.87 -0.00 0.00 -1.02 0.00 0.00 57.90 54.36 3huy n TYR 207 Cb 1.63 -2.08 -0.00 0.00 -1.03 0.00 0.00 39.34 37.85 3huy n TYR 207 CO 0.00 0.00 0.00 0.43 -1.02 0.00 0.00 176.86 176.27 3huy n SER 208 N 4.46 -0.03 0.00 7.72 7.64 -1.02 -5.02 113.62 127.36 3huy n SER 208 Ca 0.42 -0.16 0.00 0.00 1.01 0.00 0.00 58.87 60.14 3huy n SER 208 Cb 0.37 0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.58 3huy n SER 208 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89