#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eul s ALA 2 N 0.00 1.52 0.03 -5.12 0.00 -1.26 -5.11 121.76 111.82 2eul s ALA 2 Ca 0.00 -2.06 0.06 0.00 0.00 0.00 0.00 51.96 49.97 2eul s ALA 2 Cb 0.00 -1.71 -0.02 0.00 0.00 0.00 0.00 23.12 21.39 2eul s ALA 2 CO 0.00 -1.97 -0.19 1.03 0.00 0.00 0.00 175.76 174.63 2eul s ARG 3 N 0.97 1.32 0.14 0.00 1.81 -1.26 -5.14 118.95 116.80 2eul s ARG 3 Ca 0.15 -0.84 -0.12 0.00 -1.72 0.00 0.00 55.73 53.21 2eul s ARG 3 Cb -0.22 -1.38 -0.07 0.00 -0.45 0.00 0.00 34.95 32.83 2eul s ARG 3 CO -0.07 0.36 0.49 -1.21 -0.68 0.00 0.00 175.30 174.19 2eul s GLU 4 N -0.99 3.86 -0.23 3.54 2.02 -1.26 -4.81 118.70 120.83 2eul s GLU 4 Ca 0.06 0.32 0.02 0.00 0.02 0.00 0.00 54.97 55.39 2eul s GLU 4 Cb -0.08 -2.90 0.05 0.00 0.10 0.00 0.00 34.13 31.31 2eul s GLU 4 CO 0.01 0.47 -0.10 0.08 0.02 0.00 0.00 175.26 175.75 2eul s VAL 5 N -1.52 1.83 0.16 2.63 1.01 -1.12 -5.01 120.40 118.38 2eul s VAL 5 Ca 0.38 -1.30 -0.29 0.00 0.00 0.00 0.00 61.98 60.77 2eul s VAL 5 Cb -0.14 -1.96 -0.07 0.00 0.00 0.00 0.00 36.38 34.21 2eul s VAL 5 CO 0.19 0.04 0.90 -0.54 0.00 0.00 0.00 175.10 175.69 2eul s LYS 6 N 1.28 4.71 0.00 2.72 3.01 -1.26 -1.35 119.74 128.85 2eul s LYS 6 Ca -0.05 1.38 -0.11 0.00 -1.01 0.00 0.00 55.97 56.17 2eul s LYS 6 Cb -0.18 -3.32 0.01 0.00 -1.01 0.00 0.00 37.83 33.33 2eul s LYS 6 CO -0.07 0.39 0.23 -0.51 0.51 0.00 0.00 175.35 175.90 2eul s LEU 7 N -0.61 1.18 0.65 3.17 1.43 -1.01 -4.27 118.68 119.22 2eul s LEU 7 Ca 0.42 -0.09 -0.06 0.00 -1.03 0.00 0.00 54.13 53.37 2eul s LEU 7 Cb -0.24 1.01 0.04 0.00 0.03 0.00 0.00 46.19 47.03 2eul s LEU 7 CO 0.29 -0.44 0.96 -0.89 0.23 0.00 0.00 176.35 176.50 2eul s THR 8 N -1.55 2.87 0.13 5.49 2.01 -1.13 -1.03 115.64 122.43 2eul s THR 8 Ca -0.13 -0.17 -0.27 0.00 0.31 0.00 0.00 61.69 61.43 2eul s THR 8 Cb -0.05 -3.19 -0.04 0.00 0.01 0.00 0.00 72.50 69.22 2eul s THR 8 CO 0.02 -0.20 1.60 0.11 -0.69 0.00 0.00 174.62 175.47 2eul h LYS 9 N -0.39 -0.44 -0.72 4.92 1.79 -1.92 0.30 116.57 120.10 2eul h LYS 9 Ca -0.45 0.03 0.11 0.00 -2.18 0.00 0.00 60.65 58.17 2eul h LYS 9 Cb 1.29 0.10 -0.05 0.00 -1.58 0.00 0.00 32.23 31.99 2eul h LYS 9 CO 0.60 -0.30 0.48 0.00 -1.08 0.00 0.00 179.45 179.15 2eul h ALA 10 N 0.26 1.95 -0.07 3.86 0.00 -1.95 0.13 119.26 123.44 2eul h ALA 10 Ca 0.08 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.85 2eul h ALA 10 Cb 0.58 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2eul h ALA 10 CO -0.33 -0.12 -0.53 0.78 0.00 0.00 0.00 179.25 179.05 2eul h GLY 11 N 0.53 0.23 0.54 0.00 0.00 -1.48 -2.19 103.07 100.69 2eul h GLY 11 Ca 0.34 -0.25 -0.06 0.00 0.00 0.00 0.00 47.33 47.36 2eul h GLY 11 CO -0.12 0.23 -0.20 -1.82 0.00 0.00 0.00 176.54 174.63 2eul h TYR 12 N 0.16 0.28 0.00 5.60 3.20 0.12 -2.93 116.97 123.40 2eul h TYR 12 Ca 0.00 -0.12 -0.01 0.00 3.14 0.00 0.00 58.73 61.74 2eul h TYR 12 Cb 0.99 -0.04 -0.00 0.00 1.54 0.00 0.00 36.73 39.21 2eul h TYR 12 CO 0.02 0.84 -0.05 0.93 -1.64 0.00 0.00 178.16 178.26 2eul h GLU 13 N -0.37 0.00 -0.08 1.82 5.08 -1.09 -2.27 114.58 117.68 2eul h GLU 13 Ca -0.02 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.14 2eul h GLU 13 Cb 0.87 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.12 2eul h GLU 13 CO 0.04 0.05 -0.78 -0.09 -1.00 0.00 0.00 179.01 177.23 2eul h ARG 14 N 0.00 0.49 0.00 2.33 9.65 -1.33 -2.39 114.38 123.14 2eul h ARG 14 Ca -0.00 -0.42 -0.10 0.00 -1.10 0.00 0.00 59.98 58.36 2eul h ARG 14 Cb 0.32 0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 28.98 2eul h ARG 14 CO 0.01 1.06 -0.46 -0.07 2.80 0.00 0.00 179.97 183.30 2eul h LEU 15 N 0.32 0.00 0.42 3.80 3.38 -1.24 -2.76 115.31 119.24 2eul h LEU 15 Ca -0.05 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 2eul h LEU 15 Cb 1.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.13 2eul h LEU 15 CO 0.14 0.46 -0.20 0.24 0.09 0.00 0.00 178.44 179.17 2eul h MET 16 N 0.00 -0.55 -0.90 1.13 2.86 -1.34 -0.95 114.93 115.18 2eul h MET 16 Ca -0.00 0.04 0.19 0.00 -2.06 0.00 0.00 59.70 57.86 2eul h MET 16 Cb 1.21 0.12 -0.07 0.00 0.06 0.00 0.00 31.60 32.92 2eul h MET 16 CO 0.06 -0.24 0.59 1.96 1.06 0.00 0.00 176.91 180.34 2eul h GLN 17 N -0.92 0.49 -0.10 1.72 4.20 -1.47 0.57 115.11 119.60 2eul h GLN 17 Ca -0.06 -0.03 -0.14 0.00 0.06 0.00 0.00 58.65 58.48 2eul h GLN 17 Cb 0.56 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.22 2eul h GLN 17 CO 0.10 0.32 -0.56 0.37 -0.67 0.00 0.00 178.83 178.39 2eul h GLN 18 N 0.50 0.29 -0.22 1.46 5.75 -1.37 -0.72 115.11 120.81 2eul h GLN 18 Ca 0.47 -0.18 -0.18 0.00 -0.15 0.00 0.00 58.65 58.60 2eul h GLN 18 Cb 1.03 0.02 -0.00 0.00 1.07 0.00 0.00 27.48 29.60 2eul h GLN 18 CO -0.20 0.77 -0.59 1.25 -2.65 0.00 0.00 178.83 177.42 2eul h LEU 19 N 0.22 0.79 0.33 -2.39 5.85 0.14 -1.72 115.31 118.53 2eul h LEU 19 Ca 0.00 -0.44 -0.02 0.00 0.84 0.00 0.00 57.88 58.26 2eul h LEU 19 Cb 1.05 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.86 2eul h LEU 19 CO 0.09 1.20 -0.16 -0.08 -0.34 0.00 0.00 178.44 179.15 2eul h GLU 20 N 0.53 -0.42 -0.62 1.25 4.22 -0.24 -1.72 114.58 117.58 2eul h GLU 20 Ca 0.00 0.03 0.08 0.00 0.08 0.00 0.00 59.36 59.55 2eul h GLU 20 Cb 1.17 0.10 -0.06 0.00 0.50 0.00 0.00 28.75 30.45 2eul h GLU 20 CO 0.12 -0.27 0.29 0.00 -2.18 0.00 0.00 179.01 176.97 2eul h ARG 21 N -0.45 0.52 -0.62 1.92 3.08 -1.09 -2.25 114.38 115.48 2eul h ARG 21 Ca -0.04 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 59.94 2eul h ARG 21 Cb 0.34 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.25 2eul h ARG 21 CO 0.07 0.34 0.26 0.93 -1.07 0.00 0.00 179.97 180.51 2eul h GLU 22 N 0.53 0.90 -0.56 0.04 4.39 -1.09 -1.40 114.58 117.40 2eul h GLU 22 Ca 0.30 -0.13 -0.07 0.00 0.34 0.00 0.00 59.36 59.80 2eul h GLU 22 Cb 0.28 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 28.75 2eul h GLU 22 CO -0.24 0.72 0.09 0.00 -1.16 0.00 0.00 179.01 178.42 2eul h ARG 23 N 0.89 0.92 -0.39 2.33 3.08 -0.74 -0.60 114.38 119.86 2eul h ARG 23 Ca 0.21 -0.25 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 2eul h ARG 23 Cb 0.15 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 2eul h ARG 23 CO -0.02 0.89 0.18 0.93 -1.07 0.00 0.00 179.97 180.87 2eul h GLU 24 N 0.81 0.57 -0.80 0.04 4.39 -1.02 -1.14 114.58 117.44 2eul h GLU 24 Ca 0.17 -0.09 0.01 0.00 0.34 0.00 0.00 59.36 59.79 2eul h GLU 24 Cb 0.41 -0.10 -0.04 0.00 -0.10 0.00 0.00 28.75 28.92 2eul h GLU 24 CO 0.01 0.51 0.53 0.00 -1.16 0.00 0.00 179.01 178.91 2eul h ARG 25 N 0.49 1.04 -0.57 2.33 3.08 -1.07 -1.43 114.38 118.24 2eul h ARG 25 Ca 0.13 -0.06 -0.04 0.00 0.07 0.00 0.00 59.98 60.08 2eul h ARG 25 Cb 0.14 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 29.93 2eul h ARG 25 CO -0.02 0.69 0.21 1.25 -1.07 0.00 0.00 179.97 181.03 2eul h LEU 26 N 1.07 0.80 -0.61 3.04 5.85 -0.52 0.26 115.31 125.20 2eul h LEU 26 Ca 0.30 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.84 2eul h LEU 26 Cb -0.10 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.70 2eul h LEU 26 CO -0.07 0.76 0.38 1.56 -0.34 0.00 0.00 178.44 180.74 2eul h GLN 27 N 0.79 0.82 -0.34 1.25 4.20 -0.27 0.40 115.11 121.95 2eul h GLN 27 Ca 0.19 -0.07 -0.07 0.00 0.06 0.00 0.00 58.65 58.76 2eul h GLN 27 Cb 0.23 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 2eul h GLN 27 CO -0.01 0.57 -0.05 1.49 -0.67 0.00 0.00 178.83 180.16 2eul h GLU 28 N 0.82 0.64 -0.53 1.46 4.57 -1.00 -1.19 114.58 119.36 2eul h GLU 28 Ca 0.22 -0.23 0.01 0.00 -1.18 0.00 0.00 59.36 58.18 2eul h GLU 28 Cb -0.05 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.47 2eul h GLU 28 CO -0.04 0.79 0.34 0.00 -1.18 0.00 0.00 179.01 178.92 2eul h ALA 29 N 0.83 0.68 -0.25 2.92 0.00 0.03 -1.18 119.26 122.28 2eul h ALA 29 Ca 0.09 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2eul h ALA 29 Cb 0.54 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2eul h ALA 29 CO 0.03 0.08 0.11 1.15 0.00 0.00 0.00 179.25 180.62 2eul h THR 30 N 0.69 1.16 -0.25 0.00 2.02 -0.10 -1.64 112.91 114.79 2eul h THR 30 Ca 0.20 -0.48 0.04 0.00 0.77 0.00 0.00 66.41 66.94 2eul h THR 30 Cb -0.04 1.01 -0.04 0.00 -1.74 0.00 0.00 68.15 67.34 2eul h THR 30 CO -0.07 0.16 -0.02 0.50 0.37 0.00 0.00 175.52 176.47 2eul h LYS 31 N 0.27 0.05 -0.56 6.66 3.64 -0.90 -2.19 116.57 123.54 2eul h LYS 31 Ca 0.09 -0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.38 2eul h LYS 31 Cb 0.16 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 2eul h LYS 31 CO -0.01 0.04 0.01 0.82 -2.27 0.00 0.00 179.45 178.04 2eul h ILE 32 N 0.06 1.26 -0.71 2.00 2.04 -1.17 -2.63 117.51 118.35 2eul h ILE 32 Ca 0.12 -1.09 0.02 0.00 1.00 0.00 0.00 64.86 64.91 2eul h ILE 32 Cb 0.16 0.81 -0.04 0.00 -0.74 0.00 0.00 36.82 37.02 2eul h ILE 32 CO -0.21 0.39 0.47 0.25 0.00 0.00 0.00 178.15 179.05 2eul h LEU 33 N 0.89 0.78 -0.15 1.44 5.85 -0.76 -0.30 115.31 123.05 2eul h LEU 33 Ca 0.17 -0.02 -0.23 0.00 0.84 0.00 0.00 57.88 58.64 2eul h LEU 33 Cb 0.50 -0.19 0.01 0.00 0.37 0.00 0.00 40.66 41.35 2eul h LEU 33 CO 0.02 0.55 -0.89 -0.61 -0.34 0.00 0.00 178.44 177.17 2eul h GLN 34 N 0.91 0.61 0.00 1.25 5.75 -1.19 -2.51 115.11 119.94 2eul h GLN 34 Ca 0.27 -0.59 -0.01 0.00 -0.15 0.00 0.00 58.65 58.17 2eul h GLN 34 Cb -0.04 0.15 -0.00 0.00 1.07 0.00 0.00 27.48 28.66 2eul h GLN 34 CO -0.07 1.20 -0.06 1.49 -2.65 0.00 0.00 178.83 178.74 2eul h GLU 35 N 0.38 0.00 0.00 1.69 4.57 -1.11 -1.44 114.58 118.67 2eul h GLU 35 Ca -0.08 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.10 2eul h GLU 35 Cb 1.52 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.11 2eul h GLU 35 CO 0.17 0.06 -0.35 -0.11 -1.18 0.00 0.00 179.01 177.59 2eul n LEU 36 N -3.20 0.75 -0.04 1.64 7.94 -0.16 -2.89 117.00 121.05 2eul n LEU 36 Ca 0.00 0.38 -0.18 0.00 -1.11 0.00 0.00 56.01 55.10 2eul n LEU 36 Cb 0.31 -0.24 -0.14 0.00 0.53 0.00 0.00 43.42 43.88 2eul n LEU 36 CO 0.28 -0.11 -0.93 0.23 -1.11 0.00 0.00 177.39 175.76 2eul n MET 37 N -2.17 0.71 -0.07 1.96 2.81 -0.60 -3.93 117.12 115.83 2eul n MET 37 Ca 0.04 0.22 -0.12 0.00 -1.81 0.00 0.00 57.70 56.03 2eul n MET 37 Cb 0.43 -1.66 0.00 0.00 -0.71 0.00 0.00 33.22 31.29 2eul n MET 37 CO 0.00 0.00 0.00 1.05 1.51 0.00 0.00 175.97 178.53 2eul h GLU 38 N 0.04 0.80 0.00 0.03 -0.00 -1.49 -3.33 114.58 110.63 2eul h GLU 38 Ca -0.45 -0.47 0.00 0.00 -0.00 0.00 0.00 59.36 58.44 2eul h GLU 38 Cb 2.01 0.04 0.00 0.00 -0.00 0.00 0.00 28.75 30.80 2eul h GLU 38 CO 0.04 1.10 0.00 -1.13 -0.00 0.00 0.00 179.01 179.02 2eul n SER 39 N -4.01 0.00 -4.57 3.06 3.41 -1.14 -4.23 113.62 106.13 2eul n SER 39 Ca -0.03 0.00 -0.37 0.00 -0.26 0.00 0.00 58.87 58.21 2eul n SER 39 Cb 0.59 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.51 2eul n SER 39 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2eul s SER 40 N -1.79 6.07 0.31 4.04 0.01 -1.25 -4.79 113.70 116.29 2eul s SER 40 Ca 0.00 -1.89 0.04 0.00 1.31 0.00 0.00 55.95 55.41 2eul s SER 40 Cb 0.00 -2.58 0.82 0.00 0.21 0.00 0.00 66.02 64.47 2eul s SER 40 CO 0.00 -1.96 1.58 -0.78 0.41 0.00 0.00 173.24 172.49 2eul h ASP 41 N 8.93 -0.36 -1.64 2.44 -0.00 -1.74 -3.33 116.42 120.72 2eul h ASP 41 Ca 0.31 0.27 -0.45 0.00 -0.00 0.00 0.00 57.03 57.15 2eul h ASP 41 Cb 0.93 0.45 0.00 0.00 -0.00 0.00 0.00 39.33 40.71 2eul h ASP 41 CO 1.36 -0.35 1.54 -0.62 -0.00 0.00 0.00 179.24 181.17 2eul s ASP 42 N -4.96 4.55 -0.18 2.28 3.68 -1.26 -4.85 116.67 115.93 2eul s ASP 42 Ca -0.12 0.92 0.11 0.00 2.13 0.00 0.00 52.55 55.58 2eul s ASP 42 Cb 0.29 -2.51 0.64 0.00 -1.45 0.00 0.00 42.92 39.90 2eul s ASP 42 CO 0.78 -2.83 1.48 0.00 0.13 0.00 0.00 175.17 174.73 2eul n TYR 43 N 15.49 1.63 1.05 -5.34 0.18 -1.25 -3.99 117.16 124.93 2eul n TYR 43 Ca 0.34 -0.57 0.03 0.00 1.88 0.00 0.00 57.90 59.59 2eul n TYR 43 Cb 0.54 -0.42 0.10 0.00 -0.38 0.00 0.00 39.34 39.18 2eul n TYR 43 CO 0.00 0.00 0.00 -0.40 -2.08 0.00 0.00 176.86 174.38 2eul n ASP 44 N 0.50 1.52 -4.81 9.48 3.85 -1.26 -4.56 116.55 121.27 2eul n ASP 44 Ca 0.22 -2.08 -0.34 0.00 -0.71 0.00 0.00 54.79 51.87 2eul n ASP 44 Cb 0.99 -0.27 -0.07 0.00 -1.35 0.00 0.00 41.12 40.42 2eul n ASP 44 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 2eul s ASP 45 N -0.76 7.03 0.55 -1.12 2.15 -1.26 -4.95 116.67 118.31 2eul s ASP 45 Ca 0.15 1.60 0.21 0.00 0.43 0.00 0.00 52.55 54.94 2eul s ASP 45 Cb 0.09 -2.50 1.46 0.00 -0.30 0.00 0.00 42.92 41.67 2eul s ASP 45 CO 0.08 -0.18 2.17 0.77 -0.17 0.00 0.00 175.17 177.84 2eul h SER 46 N 2.58 0.00 0.00 -0.34 4.64 -1.96 -2.97 113.55 115.50 2eul h SER 46 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 2eul h SER 46 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2eul h SER 46 CO 0.64 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.21 2eul n GLY 47 N -1.47 -2.53 0.61 -0.77 0.00 -1.26 -0.75 105.19 99.02 2eul n GLY 47 Ca -0.02 0.00 0.45 0.00 0.00 0.00 0.00 46.02 46.45 2eul n GLY 47 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2eul h LEU 48 N 0.00 0.05 -0.06 0.99 6.46 -1.84 0.82 115.31 121.73 2eul h LEU 48 Ca 0.00 0.02 -0.25 0.00 -0.12 0.00 0.00 57.88 57.53 2eul h LEU 48 Cb 0.00 0.02 0.01 0.00 -0.73 0.00 0.00 40.66 39.96 2eul h LEU 48 CO 0.00 -0.03 -1.04 -0.33 -0.62 0.00 0.00 178.44 176.42 2eul h GLU 49 N 0.02 0.51 -0.02 1.25 4.39 -1.36 -1.66 114.58 117.72 2eul h GLU 49 Ca 0.80 -0.59 -0.12 0.00 0.34 0.00 0.00 59.36 59.80 2eul h GLU 49 Cb 3.09 0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 31.90 2eul h GLU 49 CO -0.08 1.22 -0.53 0.00 -1.16 0.00 0.00 179.01 178.45 2eul h ALA 50 N 0.57 1.08 -0.04 3.43 0.00 0.28 -2.41 119.26 122.18 2eul h ALA 50 Ca -0.11 -0.49 -0.03 0.00 0.00 0.00 0.00 54.91 54.28 2eul h ALA 50 Cb 1.69 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.40 2eul h ALA 50 CO 0.19 0.67 -0.08 0.00 0.00 0.00 0.00 179.25 180.03 2eul h ALA 51 N 1.42 0.06 -0.47 0.00 0.00 -1.06 -2.14 119.26 117.07 2eul h ALA 51 Ca -0.00 -0.32 0.09 0.00 0.00 0.00 0.00 54.91 54.67 2eul h ALA 51 Cb 0.95 -0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.63 2eul h ALA 51 CO 0.07 -0.09 -0.35 -0.22 0.00 0.00 0.00 179.25 178.67 2eul h LYS 52 N -0.41 -0.22 -0.64 0.00 1.63 -1.22 -1.58 116.57 114.13 2eul h LYS 52 Ca 0.00 0.02 0.06 0.00 -0.85 0.00 0.00 60.65 59.87 2eul h LYS 52 Cb 0.66 0.05 -0.05 0.00 -0.60 0.00 0.00 32.23 32.29 2eul h LYS 52 CO 0.02 -0.15 0.35 0.37 -3.45 0.00 0.00 179.45 176.59 2eul h GLN 53 N -0.23 0.63 -0.24 1.90 4.15 -1.43 -2.32 115.11 117.56 2eul h GLN 53 Ca 0.19 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.56 2eul h GLN 53 Cb 0.55 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 28.09 2eul h GLN 53 CO -0.59 0.42 0.10 1.49 -1.93 0.00 0.00 178.83 178.31 2eul h GLU 54 N 0.65 0.36 0.47 1.69 4.57 -0.62 0.22 114.58 121.92 2eul h GLU 54 Ca 0.28 -0.06 -0.01 0.00 -1.18 0.00 0.00 59.36 58.39 2eul h GLU 54 Cb 0.18 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.70 2eul h GLU 54 CO -0.18 0.40 -0.33 -0.22 -1.18 0.00 0.00 179.01 177.50 2eul h LYS 55 N 0.24 -0.76 -0.55 1.92 3.64 -1.25 0.10 116.57 119.92 2eul h LYS 55 Ca 0.08 0.05 0.11 0.00 -1.27 0.00 0.00 60.65 59.62 2eul h LYS 55 Cb 0.17 0.17 -0.09 0.00 -0.41 0.00 0.00 32.23 32.07 2eul h LYS 55 CO -0.01 -0.51 -0.02 0.00 -2.27 0.00 0.00 179.45 176.64 2eul h ALA 56 N -0.36 0.50 -0.30 5.00 0.00 -1.32 0.30 119.26 123.08 2eul h ALA 56 Ca -0.05 0.17 0.07 0.00 0.00 0.00 0.00 54.91 55.10 2eul h ALA 56 Cb 0.66 0.31 -0.07 0.00 0.00 0.00 0.00 17.79 18.69 2eul h ALA 56 CO 0.02 -0.40 -0.17 -0.09 0.00 0.00 0.00 179.25 178.61 2eul h ARG 57 N 0.09 -0.13 -0.40 0.00 1.12 -0.07 0.18 114.38 115.17 2eul h ARG 57 Ca 0.28 0.01 -0.04 0.00 -1.11 0.00 0.00 59.98 59.11 2eul h ARG 57 Cb 0.43 0.03 -0.02 0.00 -0.01 0.00 0.00 29.97 30.40 2eul h ARG 57 CO -0.48 -0.09 0.07 0.82 -3.11 0.00 0.00 179.97 177.18 2eul h ILE 58 N -0.14 1.19 -0.81 1.20 2.04 0.13 -1.64 117.51 119.49 2eul h ILE 58 Ca 0.16 -0.72 -0.01 0.00 1.00 0.00 0.00 64.86 65.29 2eul h ILE 58 Cb 0.38 0.82 -0.04 0.00 -0.74 0.00 0.00 36.82 37.24 2eul h ILE 58 CO -0.39 0.26 0.48 -0.33 0.00 0.00 0.00 178.15 178.17 2eul h GLU 59 N 0.59 1.10 0.09 2.37 5.08 0.12 -1.95 114.58 121.97 2eul h GLU 59 Ca 0.13 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2eul h GLU 59 Cb 0.27 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.29 2eul h GLU 59 CO 0.00 0.77 -0.04 0.00 -1.00 0.00 0.00 179.01 178.74 2eul h ALA 60 N 1.41 -0.12 -0.24 3.43 0.00 -0.10 -0.75 119.26 122.89 2eul h ALA 60 Ca 0.29 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 55.08 2eul h ALA 60 Cb -0.03 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2eul h ALA 60 CO -0.05 -0.44 0.16 0.00 0.00 0.00 0.00 179.25 178.91 2eul h ARG 61 N -0.37 0.23 0.03 0.00 3.08 -1.19 -0.71 114.38 115.45 2eul h ARG 61 Ca -0.01 -0.01 -0.12 0.00 0.07 0.00 0.00 59.98 59.90 2eul h ARG 61 Cb 0.31 -0.05 0.01 0.00 0.08 0.00 0.00 29.97 30.32 2eul h ARG 61 CO 0.02 0.15 -0.49 0.82 -1.07 0.00 0.00 179.97 179.40 2eul h ILE 62 N 0.24 1.52 -0.44 2.04 2.04 -1.14 -1.89 117.51 119.87 2eul h ILE 62 Ca 0.10 -2.16 -0.06 0.00 1.00 0.00 0.00 64.86 63.74 2eul h ILE 62 Cb 0.10 2.85 -0.02 0.00 -0.74 0.00 0.00 36.82 39.01 2eul h ILE 62 CO -0.02 0.61 0.02 0.44 0.00 0.00 0.00 178.15 179.20 2eul h ASP 63 N -0.36 0.67 -0.56 1.72 3.32 -0.94 -1.10 116.42 119.16 2eul h ASP 63 Ca -0.07 -0.14 -0.07 0.00 0.02 0.00 0.00 57.03 56.76 2eul h ASP 63 Cb 1.26 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 40.61 2eul h ASP 63 CO 0.09 0.73 0.08 0.28 -1.72 0.00 0.00 179.24 178.70 2eul h SER 64 N 0.67 0.94 -0.10 6.45 0.02 -1.18 -1.95 113.55 118.39 2eul h SER 64 Ca 0.14 -0.22 -0.10 0.00 -0.84 0.00 0.00 61.79 60.77 2eul h SER 64 Cb 0.39 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.66 2eul h SER 64 CO 0.01 0.95 -0.24 -0.07 -1.14 0.00 0.00 176.83 176.35 2eul h LEU 65 N 0.92 0.54 -0.53 5.07 3.38 -0.67 -1.77 115.31 122.26 2eul h LEU 65 Ca 0.18 -0.18 -0.16 0.00 0.09 0.00 0.00 57.88 57.81 2eul h LEU 65 Cb 0.43 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 2eul h LEU 65 CO 0.01 0.78 -0.71 -0.33 0.09 0.00 0.00 178.44 178.28 2eul h GLU 66 N 0.48 0.15 0.36 1.13 5.08 -1.05 -2.29 114.58 118.44 2eul h GLU 66 Ca 0.07 -0.13 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 2eul h GLU 66 Cb 0.67 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.95 2eul h GLU 66 CO 0.05 0.80 -0.17 0.22 -1.00 0.00 0.00 179.01 178.90 2eul h ASP 67 N 0.10 -0.41 -0.60 1.42 3.58 -1.02 -1.44 116.42 118.04 2eul h ASP 67 Ca -0.02 -0.14 0.12 0.00 0.42 0.00 0.00 57.03 57.42 2eul h ASP 67 Cb 1.26 0.11 -0.10 0.00 1.72 0.00 0.00 39.33 42.32 2eul h ASP 67 CO 0.10 -0.07 0.03 0.40 -2.88 0.00 0.00 179.24 176.83 2eul h ILE 68 N -0.79 0.53 -0.77 2.25 2.04 -1.33 -1.14 117.51 118.30 2eul h ILE 68 Ca -0.05 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.76 2eul h ILE 68 Cb 0.52 0.37 -0.04 0.00 -0.74 0.00 0.00 36.82 36.94 2eul h ILE 68 CO 0.08 0.03 0.48 -0.07 0.00 0.00 0.00 178.15 178.67 2eul h LEU 69 N 0.15 0.91 -1.81 1.44 3.38 -1.32 -1.85 115.31 116.21 2eul h LEU 69 Ca 0.32 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.24 2eul h LEU 69 Cb 0.51 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 2eul h LEU 69 CO -0.49 0.68 -0.02 0.77 0.09 0.00 0.00 178.44 179.47 2eul h SER 70 N 1.06 0.00 0.11 -0.43 4.64 -0.08 -2.53 113.55 116.31 2eul h SER 70 Ca 0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 2eul h SER 70 Cb -0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.02 2eul h SER 70 CO -0.06 0.02 -1.08 0.54 -0.87 0.00 0.00 176.83 175.39 2eul n ARG 71 N -3.15 0.12 -1.55 4.77 1.74 -0.75 -5.00 116.66 112.84 2eul n ARG 71 Ca -0.00 -0.03 -0.48 0.00 -0.77 0.00 0.00 57.85 56.57 2eul n ARG 71 Cb 0.26 -1.51 -0.04 0.00 -1.02 0.00 0.00 32.46 30.15 2eul n ARG 71 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2eul n ALA 72 N -1.64 -1.20 -3.75 7.54 0.00 -0.88 -2.78 120.51 117.81 2eul n ALA 72 Ca 0.03 0.45 -0.27 0.00 0.00 0.00 0.00 53.44 53.65 2eul n ALA 72 Cb 0.37 -1.94 -0.17 0.00 0.00 0.00 0.00 19.45 17.72 2eul n ALA 72 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2eul s VAL 73 N -0.53 0.53 -0.03 0.00 1.01 -0.46 -4.86 120.40 116.07 2eul s VAL 73 Ca 0.69 -0.49 -0.30 0.00 0.00 0.00 0.00 61.98 61.88 2eul s VAL 73 Cb -0.86 -0.99 -0.04 0.00 0.00 0.00 0.00 36.38 34.49 2eul s VAL 73 CO 0.55 -0.14 1.30 -0.63 0.00 0.00 0.00 175.10 176.18 2eul s ILE 74 N 1.86 3.97 0.60 2.22 1.01 -1.26 -2.41 121.20 127.20 2eul s ILE 74 Ca -0.00 1.33 -0.13 0.00 0.00 0.00 0.00 60.65 61.85 2eul s ILE 74 Cb -0.16 -3.85 -0.04 0.00 0.01 0.00 0.00 42.46 38.41 2eul s ILE 74 CO -0.08 -0.00 1.02 -0.76 0.00 0.00 0.00 174.94 175.13 2eul s LEU 75 N 2.29 3.34 0.85 2.97 1.43 -0.20 -4.94 118.68 124.43 2eul s LEU 75 Ca 0.60 1.52 -0.12 0.00 -1.03 0.00 0.00 54.13 55.10 2eul s LEU 75 Cb -0.28 -4.49 0.11 0.00 0.03 0.00 0.00 46.19 41.56 2eul s LEU 75 CO 0.24 -0.90 1.17 -1.61 0.23 0.00 0.00 176.35 175.49 2eul s GLU 76 N -4.79 1.40 0.00 1.70 0.41 -1.26 -4.58 118.70 111.58 2eul s GLU 76 Ca 0.57 1.64 0.00 0.00 -0.41 0.00 0.00 54.97 56.77 2eul s GLU 76 Cb -0.11 -1.76 0.00 0.00 -1.78 0.00 0.00 34.13 30.47 2eul s GLU 76 CO 0.47 -2.37 0.69 0.39 -0.49 0.00 0.00 175.26 173.96 2eul n GLU 77 N -3.71 0.00 -2.33 1.61 1.02 -1.26 -4.08 120.64 111.89 2eul n GLU 77 Ca 0.13 0.21 -0.41 0.00 -0.02 0.00 0.00 57.16 57.06 2eul n GLU 77 Cb 0.51 -1.20 -0.03 0.00 -0.02 0.00 0.00 31.44 30.71 2eul n GLU 77 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2eul s GLY 78 N -0.43 0.80 0.08 0.62 0.00 -1.26 -4.92 107.32 102.21 2eul s GLY 78 Ca 0.00 -0.64 -0.22 0.00 0.00 0.00 0.00 44.72 43.87 2eul s GLY 78 CO 0.00 2.90 0.52 -0.45 0.00 0.00 0.00 173.10 176.07 2eul s SER 79 N 4.97 -0.44 0.25 1.64 0.15 -1.26 -5.15 113.70 113.86 2eul s SER 79 Ca 0.55 0.07 0.00 0.00 0.70 0.00 0.00 55.95 57.27 2eul s SER 79 Cb -0.12 0.51 0.00 0.00 -1.71 0.00 0.00 66.02 64.71 2eul s SER 79 CO 0.25 -0.79 0.00 0.61 1.20 0.00 0.00 173.24 174.50 2eul n GLY 80 N 0.15 -1.40 3.84 9.45 0.00 -1.26 -4.86 105.19 111.11 2eul n GLY 80 Ca -0.18 -0.83 -0.29 0.00 0.00 0.00 0.00 46.02 44.72 2eul n GLY 80 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2eul s GLU 81 N -1.96 0.86 0.25 1.61 0.41 -1.26 -5.02 118.70 113.60 2eul s GLU 81 Ca 0.00 -0.04 0.10 0.00 -0.41 0.00 0.00 54.97 54.63 2eul s GLU 81 Cb 0.00 -1.84 -0.04 0.00 -1.78 0.00 0.00 34.13 30.47 2eul s GLU 81 CO 0.00 -2.32 -0.08 0.54 -0.49 0.00 0.00 175.26 172.91 2eul s VAL 82 N -3.52 3.13 -0.22 2.63 0.11 -1.26 -4.45 120.40 116.81 2eul s VAL 82 Ca 0.68 -2.01 -0.19 0.00 -2.93 0.00 0.00 61.98 57.53 2eul s VAL 82 Cb -0.10 -2.64 -0.03 0.00 -1.53 0.00 0.00 36.38 32.08 2eul s VAL 82 CO 0.52 -0.33 0.57 -0.63 -3.33 0.00 0.00 175.10 171.90 2eul s ILE 83 N -2.26 5.05 0.24 7.04 1.01 0.32 -4.98 121.20 127.62 2eul s ILE 83 Ca 0.30 1.04 0.05 0.00 0.00 0.00 0.00 60.65 62.04 2eul s ILE 83 Cb -0.06 -3.89 -0.02 0.00 0.01 0.00 0.00 42.46 38.50 2eul s ILE 83 CO 0.18 0.11 0.18 0.61 0.00 0.00 0.00 174.94 176.02 2eul n GLY 84 N 4.00 3.29 3.66 6.18 0.00 -1.26 -1.22 105.19 119.83 2eul n GLY 84 Ca -0.03 -1.86 -0.42 0.00 0.00 0.00 0.00 46.02 43.71 2eul n GLY 84 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2eul n LEU 85 N 0.00 3.12 0.00 0.99 4.77 -1.26 -1.29 117.00 123.33 2eul n LEU 85 Ca 0.04 1.12 0.00 0.00 -0.03 0.00 0.00 56.01 57.14 2eul n LEU 85 Cb 0.42 -1.42 0.00 0.00 -2.33 0.00 0.00 43.42 40.09 2eul n LEU 85 CO 0.22 -0.97 0.00 0.61 -1.33 0.00 0.00 177.39 175.92 2eul n GLY 86 N 0.98 2.83 3.75 -0.72 0.00 0.13 -5.00 105.19 107.15 2eul n GLY 86 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 2eul n GLY 86 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eul s SER 87 N -3.21 7.08 -0.26 1.61 0.01 -0.41 -4.80 113.70 113.72 2eul s SER 87 Ca 0.00 2.32 -0.10 0.00 1.31 0.00 0.00 55.95 59.48 2eul s SER 87 Cb 0.00 -2.62 -0.04 0.00 0.21 0.00 0.00 66.02 63.57 2eul s SER 87 CO 0.00 -0.34 0.14 -0.69 0.41 0.00 0.00 173.24 172.77 2eul s VAL 88 N -0.52 5.01 -0.13 3.43 1.01 -1.25 -2.18 120.40 125.76 2eul s VAL 88 Ca 0.50 0.06 -0.01 0.00 0.00 0.00 0.00 61.98 62.54 2eul s VAL 88 Cb -0.34 -3.36 -0.02 0.00 0.00 0.00 0.00 36.38 32.67 2eul s VAL 88 CO 0.40 0.30 -0.11 -0.69 0.00 0.00 0.00 175.10 175.01 2eul s VAL 89 N 1.51 3.29 -0.18 2.92 1.01 0.14 -1.44 120.40 127.65 2eul s VAL 89 Ca 0.07 -0.58 -0.09 0.00 0.00 0.00 0.00 61.98 61.37 2eul s VAL 89 Cb -0.15 -2.39 -0.05 0.00 0.00 0.00 0.00 36.38 33.79 2eul s VAL 89 CO 0.07 0.52 0.13 -1.61 0.00 0.00 0.00 175.10 174.21 2eul s GLU 90 N 0.27 3.99 0.11 2.72 2.02 0.11 -1.25 118.70 126.67 2eul s GLU 90 Ca -0.08 -0.21 0.07 0.00 0.02 0.00 0.00 54.97 54.78 2eul s GLU 90 Cb -0.15 -3.35 -0.04 0.00 0.10 0.00 0.00 34.13 30.69 2eul s GLU 90 CO 0.05 0.42 -0.16 -0.51 0.02 0.00 0.00 175.26 175.07 2eul s LEU 91 N 0.02 2.36 -0.05 1.80 1.43 0.15 -1.36 118.68 123.03 2eul s LEU 91 Ca 0.09 -0.75 0.02 0.00 -1.03 0.00 0.00 54.13 52.47 2eul s LEU 91 Cb -0.11 -0.67 0.01 0.00 0.03 0.00 0.00 46.19 45.45 2eul s LEU 91 CO -0.00 -0.06 -0.09 -0.70 0.23 0.00 0.00 176.35 175.72 2eul s GLU 92 N -2.31 1.22 -0.48 1.70 2.12 -0.81 -0.72 118.70 119.41 2eul s GLU 92 Ca 0.07 -0.29 -0.23 0.00 0.36 0.00 0.00 54.97 54.88 2eul s GLU 92 Cb -0.07 -1.08 0.03 0.00 0.26 0.00 0.00 34.13 33.27 2eul s GLU 92 CO 0.04 0.02 0.82 0.34 -0.54 0.00 0.00 175.26 175.94 2eul s ASP 93 N 0.60 6.38 0.13 -1.70 2.15 -0.25 -1.01 116.67 122.96 2eul s ASP 93 Ca -0.10 -0.25 -0.11 0.00 0.43 0.00 0.00 52.55 52.53 2eul s ASP 93 Cb -0.13 -2.39 0.12 0.00 -0.30 0.00 0.00 42.92 40.21 2eul s ASP 93 CO 0.02 -1.01 0.88 -2.65 -0.17 0.00 0.00 175.17 172.24 2eul n PRO 94 N 6.89 -0.14 0.00 4.34 -0.02 -1.26 0.73 135.00 145.54 2eul n PRO 94 Ca 0.01 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.36 2eul n PRO 94 Cb 0.48 -1.29 0.00 0.00 -0.02 0.00 0.00 33.50 32.67 2eul n PRO 94 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2eul n LEU 95 N -4.82 0.27 0.12 2.45 4.77 -1.26 -3.88 117.00 114.65 2eul n LEU 95 Ca 0.05 0.70 0.11 0.00 -0.03 0.00 0.00 56.01 56.85 2eul n LEU 95 Cb 0.22 -0.33 0.48 0.00 -2.33 0.00 0.00 43.42 41.46 2eul n LEU 95 CO -0.08 -0.33 0.84 -1.54 -1.33 0.00 0.00 177.39 174.95 2eul n SER 96 N -1.50 0.61 -1.43 -1.43 3.41 -1.11 -4.88 113.62 107.29 2eul n SER 96 Ca 0.00 0.66 -0.15 0.00 -0.26 0.00 0.00 58.87 59.12 2eul n SER 96 Cb 0.00 -0.78 -0.04 0.00 -0.26 0.00 0.00 64.21 63.13 2eul n SER 96 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2eul n GLY 97 N -0.08 0.64 3.74 5.00 0.00 0.22 -4.96 105.19 109.75 2eul n GLY 97 Ca 0.02 -0.29 -0.41 0.00 0.00 0.00 0.00 46.02 45.35 2eul n GLY 97 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2eul s GLU 98 N -4.01 4.64 -0.01 1.61 2.56 -1.24 -4.74 118.70 117.51 2eul s GLU 98 Ca 0.00 1.64 -0.08 0.00 0.00 0.00 0.00 54.97 56.53 2eul s GLU 98 Cb 0.00 -3.30 -0.05 0.00 2.00 0.00 0.00 34.13 32.79 2eul s GLU 98 CO 0.00 0.15 0.29 0.50 -0.56 0.00 0.00 175.26 175.63 2eul s ARG 99 N -0.40 3.63 -0.06 4.30 6.06 -1.26 -1.09 118.95 130.14 2eul s ARG 99 Ca 0.48 0.02 -0.03 0.00 -2.50 0.00 0.00 55.73 53.71 2eul s ARG 99 Cb -0.28 -3.11 0.04 0.00 0.06 0.00 0.00 34.95 31.66 2eul s ARG 99 CO 0.34 0.67 0.13 -1.17 -2.50 0.00 0.00 175.30 172.76 2eul s LEU 100 N -1.55 0.63 -0.03 -0.88 2.96 0.10 -4.97 118.68 114.94 2eul s LEU 100 Ca 0.26 0.27 0.05 0.00 -0.22 0.00 0.00 54.13 54.49 2eul s LEU 100 Cb -0.14 0.29 -0.02 0.00 0.50 0.00 0.00 46.19 46.81 2eul s LEU 100 CO 0.14 -0.16 -0.19 -0.55 -1.32 0.00 0.00 176.35 174.27 2eul s SER 101 N 1.36 3.68 -0.05 3.68 0.15 -1.26 0.29 113.70 121.54 2eul s SER 101 Ca -0.07 -0.31 -0.24 0.00 0.70 0.00 0.00 55.95 56.03 2eul s SER 101 Cb -0.12 -0.65 0.05 0.00 -1.71 0.00 0.00 66.02 63.59 2eul s SER 101 CO -0.06 0.33 0.54 -0.69 1.20 0.00 0.00 173.24 174.57 2eul s VAL 102 N -0.71 0.02 -0.12 4.45 1.01 -0.38 -4.24 120.40 120.42 2eul s VAL 102 Ca 0.11 -0.16 0.01 0.00 0.00 0.00 0.00 61.98 61.94 2eul s VAL 102 Cb -0.10 -0.85 0.02 0.00 0.00 0.00 0.00 36.38 35.44 2eul s VAL 102 CO 0.00 -0.09 -0.15 -1.58 0.00 0.00 0.00 175.10 173.28 2eul s GLN 103 N -1.09 2.29 -0.00 2.72 0.74 0.17 0.28 119.66 124.77 2eul s GLN 103 Ca -0.11 -0.58 -0.30 0.00 0.05 0.00 0.00 55.36 54.43 2eul s GLN 103 Cb -0.02 -1.99 -0.03 0.00 1.10 0.00 0.00 33.01 32.07 2eul s GLN 103 CO 0.07 -0.11 0.97 0.08 -0.55 0.00 0.00 175.29 175.75 2eul s VAL 104 N 1.13 4.88 0.31 1.34 1.01 -0.92 0.34 120.40 128.47 2eul s VAL 104 Ca -0.03 2.04 0.04 0.00 0.00 0.00 0.00 61.98 64.03 2eul s VAL 104 Cb -0.14 -4.31 -0.03 0.00 0.00 0.00 0.00 36.38 31.90 2eul s VAL 104 CO -0.04 0.16 0.28 0.68 0.00 0.00 0.00 175.10 176.18 2eul s VAL 105 N 1.01 0.00 0.58 2.92 -7.23 0.10 0.19 120.40 117.98 2eul s VAL 105 Ca 0.51 -1.94 -0.17 0.00 -1.81 0.00 0.00 61.98 58.58 2eul s VAL 105 Cb -0.21 -2.51 -0.04 0.00 0.56 0.00 0.00 36.38 34.18 2eul s VAL 105 CO 0.28 0.00 1.08 -0.44 -0.31 0.00 0.00 175.10 175.70 2eul s SER 106 N -3.31 5.73 0.32 4.85 0.01 -1.26 0.13 113.70 120.16 2eul s SER 106 Ca 0.39 1.93 0.13 0.00 1.31 0.00 0.00 55.95 59.70 2eul s SER 106 Cb 0.03 -2.55 1.03 0.00 0.21 0.00 0.00 66.02 64.74 2eul s SER 106 CO 0.24 -1.21 1.45 -2.65 0.41 0.00 0.00 173.24 171.48 2eul n PRO 107 N -1.83 -0.06 0.01 12.44 -0.02 -1.26 -0.27 135.00 144.01 2eul n PRO 107 Ca 0.10 1.31 0.14 0.00 -2.02 0.00 0.00 63.50 63.02 2eul n PRO 107 Cb 0.52 -2.25 0.53 0.00 -0.02 0.00 0.00 33.50 32.29 2eul n PRO 107 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2eul n ALA 108 N -2.66 2.55 0.94 3.55 0.00 -1.26 -3.23 120.51 120.39 2eul n ALA 108 Ca 0.30 -0.14 0.11 0.00 0.00 0.00 0.00 53.44 53.71 2eul n ALA 108 Cb 1.00 -1.40 0.06 0.00 0.00 0.00 0.00 19.45 19.11 2eul n ALA 108 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2eul n GLU 109 N -1.57 0.04 -1.70 0.00 1.02 0.62 -4.94 120.64 114.11 2eul n GLU 109 Ca 0.07 -0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.77 2eul n GLU 109 Cb 0.35 -1.51 -0.03 0.00 -0.02 0.00 0.00 31.44 30.22 2eul n GLU 109 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2eul n ALA 110 N -1.55 2.33 -3.66 0.62 0.00 -1.11 -4.84 120.51 112.31 2eul n ALA 110 Ca 0.04 0.37 -0.05 0.00 0.00 0.00 0.00 53.44 53.80 2eul n ALA 110 Cb 0.35 -2.53 -0.07 0.00 0.00 0.00 0.00 19.45 17.20 2eul n ALA 110 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2eul s ASN 111 N 1.84 -0.73 0.57 0.00 3.84 -0.72 -4.97 114.94 114.76 2eul s ASN 111 Ca 0.79 1.29 0.32 0.00 0.21 0.00 0.00 52.86 55.47 2eul s ASN 111 Cb -0.53 1.70 1.71 0.00 -0.55 0.00 0.00 41.25 43.58 2eul s ASN 111 CO 0.36 -0.22 2.16 0.58 -2.79 0.00 0.00 177.10 177.18 2eul h VAL 112 N 5.90 0.38 0.06 -5.21 2.07 -1.94 -1.69 116.25 115.83 2eul h VAL 112 Ca -0.20 -0.32 -0.25 0.00 0.82 0.00 0.00 66.70 66.74 2eul h VAL 112 Cb 1.13 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 32.11 2eul h VAL 112 CO 0.13 0.06 -1.21 -0.07 0.02 0.00 0.00 177.57 176.51 2eul h LEU 113 N 0.00 0.21 -9.53 2.57 3.38 -1.95 -3.45 115.31 106.54 2eul h LEU 113 Ca -0.00 -0.24 -0.55 0.00 0.09 0.00 0.00 57.88 57.18 2eul h LEU 113 Cb 0.22 -0.07 0.21 0.00 0.09 0.00 0.00 40.66 41.12 2eul h LEU 113 CO 0.01 1.19 -0.85 0.47 0.09 0.00 0.00 178.44 179.35 2eul n ASP 114 N -3.41 -2.81 0.00 -0.43 9.92 -1.20 -4.93 116.55 113.68 2eul n ASP 114 Ca -0.06 0.39 0.00 0.00 -0.53 0.00 0.00 54.79 54.59 2eul n ASP 114 Cb 0.99 -1.09 0.00 0.00 -0.64 0.00 0.00 41.12 40.38 2eul n ASP 114 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 2eul n THR 115 N -2.89 0.00 -1.93 -3.53 -2.24 -1.26 -3.33 114.28 99.11 2eul n THR 115 Ca 0.06 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.41 2eul n THR 115 Cb 0.53 -0.76 -0.03 0.00 -2.10 0.00 0.00 70.33 67.97 2eul n THR 115 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 2eul s PRO 116 N 0.00 3.54 0.13 -0.78 0.02 -1.26 -4.81 135.00 131.83 2eul s PRO 116 Ca 0.00 1.75 -0.28 0.00 0.02 0.00 0.00 61.00 62.49 2eul s PRO 116 Cb 0.00 -4.17 -0.16 0.00 0.02 0.00 0.00 34.50 30.19 2eul s PRO 116 CO 0.00 -1.62 0.59 -1.33 -0.33 0.00 0.00 177.00 174.31 2eul n MET 117 N 8.14 0.00 -3.25 5.54 2.81 -1.21 -4.19 117.12 124.96 2eul n MET 117 Ca 0.23 0.00 -0.39 0.00 -1.81 0.00 0.00 57.70 55.72 2eul n MET 117 Cb 0.45 -1.01 -0.07 0.00 -0.71 0.00 0.00 33.22 31.88 2eul n MET 117 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2eul s LYS 118 N -0.66 4.12 -0.12 0.03 1.02 -0.64 -0.66 119.74 122.83 2eul s LYS 118 Ca 0.63 0.35 -0.04 0.00 0.02 0.00 0.00 55.97 56.94 2eul s LYS 118 Cb -0.91 -3.61 -0.03 0.00 -0.52 0.00 0.00 37.83 32.76 2eul s LYS 118 CO 0.50 -0.25 0.01 0.42 -0.92 0.00 0.00 175.35 175.12 2eul s ILE 119 N 1.98 4.40 0.59 2.17 -1.09 0.15 -1.76 121.20 127.64 2eul s ILE 119 Ca 0.22 -0.20 -0.20 0.00 -2.23 0.00 0.00 60.65 58.24 2eul s ILE 119 Cb -0.15 -2.90 -0.04 0.00 -1.58 0.00 0.00 42.46 37.79 2eul s ILE 119 CO 0.09 0.56 1.22 -0.24 -1.23 0.00 0.00 174.94 175.34 2eul n SER 120 N 2.68 1.95 0.01 3.58 2.88 -1.26 0.01 113.62 123.47 2eul n SER 120 Ca -0.18 0.89 -0.12 0.00 -1.33 0.00 0.00 58.87 58.14 2eul n SER 120 Cb 0.53 -1.51 -0.06 0.00 -0.75 0.00 0.00 64.21 62.42 2eul n SER 120 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 2eul h ASP 121 N 0.92 0.07 -0.30 -3.46 -0.00 0.76 -2.59 116.42 111.83 2eul h ASP 121 Ca -0.50 -0.05 0.00 0.00 -0.00 0.00 0.00 57.03 56.48 2eul h ASP 121 Cb 1.33 -0.02 0.00 0.00 -0.00 0.00 0.00 39.33 40.64 2eul h ASP 121 CO 0.54 0.10 0.00 0.00 -0.00 0.00 0.00 179.24 179.88 2eul n ALA 122 N -2.13 3.06 -2.01 -0.78 0.00 -1.26 -3.54 120.51 113.85 2eul n ALA 122 Ca -0.06 -0.89 -0.29 0.00 0.00 0.00 0.00 53.44 52.21 2eul n ALA 122 Cb 0.05 -1.05 0.03 0.00 0.00 0.00 0.00 19.45 18.48 2eul n ALA 122 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2eul s SER 123 N -0.49 5.75 0.08 0.00 1.04 -0.97 -4.85 113.70 114.26 2eul s SER 123 Ca 0.26 1.01 -0.26 0.00 0.48 0.00 0.00 55.95 57.44 2eul s SER 123 Cb 0.19 -1.99 -0.11 0.00 0.10 0.00 0.00 66.02 64.21 2eul s SER 123 CO 0.09 -1.05 1.42 -0.65 0.98 0.00 0.00 173.24 174.03 2eul h PRO 124 N -0.30 -0.57 -0.60 4.02 0.11 -1.91 0.16 132.00 132.92 2eul h PRO 124 Ca -0.45 0.04 0.04 0.00 0.11 0.00 0.00 66.00 65.74 2eul h PRO 124 Cb 1.24 0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.44 2eul h PRO 124 CO 0.62 -0.38 0.39 1.98 -0.21 0.00 0.00 178.00 180.41 2eul h MET 125 N -0.59 0.64 -0.66 1.05 1.85 -1.94 -1.28 114.93 114.00 2eul h MET 125 Ca -0.01 -0.04 -0.04 0.00 -0.61 0.00 0.00 59.70 59.00 2eul h MET 125 Cb 0.58 -0.14 -0.03 0.00 0.43 0.00 0.00 31.60 32.44 2eul h MET 125 CO -0.21 0.42 0.26 0.78 -0.40 0.00 0.00 176.91 177.77 2eul h GLY 126 N 0.66 1.07 0.31 1.39 0.00 -1.58 -2.26 103.07 102.66 2eul h GLY 126 Ca 0.24 -0.58 -0.02 0.00 0.00 0.00 0.00 47.33 46.98 2eul h GLY 126 CO -0.07 0.55 -0.16 1.70 0.00 0.00 0.00 176.54 178.56 2eul h LYS 127 N 0.94 -0.42 -0.85 4.80 3.11 0.12 -1.21 116.57 123.06 2eul h LYS 127 Ca 0.22 0.03 0.28 0.00 -2.81 0.00 0.00 60.65 58.37 2eul h LYS 127 Cb 0.21 0.09 -0.16 0.00 -1.00 0.00 0.00 32.23 31.38 2eul h LYS 127 CO -0.02 -0.28 0.18 0.00 -2.81 0.00 0.00 179.45 176.53 2eul n ALA 128 N -2.24 0.60 0.04 5.00 0.00 -0.68 -1.45 120.51 121.78 2eul n ALA 128 Ca -0.05 0.90 -0.19 0.00 0.00 0.00 0.00 53.44 54.09 2eul n ALA 128 Cb 0.17 -0.74 -0.14 0.00 0.00 0.00 0.00 19.45 18.74 2eul n ALA 128 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2eul h LEU 129 N 0.00 0.48 -9.19 0.00 3.38 -1.28 -3.45 115.31 105.25 2eul h LEU 129 Ca 0.59 -0.91 -0.72 0.00 0.09 0.00 0.00 57.88 56.93 2eul h LEU 129 Cb 1.38 -0.15 0.03 0.00 0.09 0.00 0.00 40.66 42.01 2eul h LEU 129 CO -0.75 1.35 0.68 -0.11 0.09 0.00 0.00 178.44 179.70 2eul n LEU 130 N -4.15 1.95 0.00 1.67 7.94 -0.47 -1.54 117.00 122.40 2eul n LEU 130 Ca -0.13 1.10 0.00 0.00 -1.11 0.00 0.00 56.01 55.87 2eul n LEU 130 Cb 0.79 -1.14 0.00 0.00 0.53 0.00 0.00 43.42 43.59 2eul n LEU 130 CO 0.48 -0.76 0.00 0.61 -1.11 0.00 0.00 177.39 176.62 2eul n GLY 131 N 3.39 0.23 3.96 -3.96 0.00 -0.36 -4.98 105.19 103.47 2eul n GLY 131 Ca 0.23 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.05 2eul n GLY 131 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2eul s HIS 132 N -2.00 3.18 0.42 1.61 3.76 -0.59 -4.72 115.29 116.94 2eul s HIS 132 Ca 0.00 -0.17 0.04 0.00 -0.15 0.00 0.00 55.06 54.77 2eul s HIS 132 Cb 0.00 -1.84 -0.02 0.00 1.11 0.00 0.00 32.58 31.82 2eul s HIS 132 CO 0.00 0.15 0.12 -0.98 -0.85 0.00 0.00 174.74 173.17 2eul s ARG 133 N -4.09 1.95 0.28 1.40 1.70 -1.26 -0.52 118.95 118.41 2eul s ARG 133 Ca 0.41 -2.20 -0.30 0.00 -0.47 0.00 0.00 55.73 53.18 2eul s ARG 133 Cb -0.09 -0.71 -0.11 0.00 -0.57 0.00 0.00 34.95 33.47 2eul s ARG 133 CO 0.30 -0.46 1.56 0.08 -1.08 0.00 0.00 175.30 175.70 2eul s VAL 134 N -3.17 2.19 0.00 4.99 1.01 -1.26 -2.06 120.40 122.10 2eul s VAL 134 Ca 0.22 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.37 2eul s VAL 134 Cb 0.03 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.30 2eul s VAL 134 CO 0.13 0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.87 2eul n GLY 135 N 2.19 2.81 3.69 4.51 0.00 -0.63 -4.53 105.19 113.22 2eul n GLY 135 Ca 0.08 -0.81 -0.32 0.00 0.00 0.00 0.00 46.02 44.97 2eul n GLY 135 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2eul s ASP 136 N 0.00 3.30 -0.09 1.61 1.01 -0.87 -2.83 116.67 118.80 2eul s ASP 136 Ca 0.00 2.28 0.01 0.00 0.71 0.00 0.00 52.55 55.55 2eul s ASP 136 Cb 0.00 -2.58 0.02 0.00 1.01 0.00 0.00 42.92 41.37 2eul s ASP 136 CO 0.00 -2.85 -0.12 -0.69 0.21 0.00 0.00 175.17 171.72 2eul s VAL 137 N -2.38 1.20 0.13 -1.27 1.01 -1.26 -1.83 120.40 116.00 2eul s VAL 137 Ca 0.70 -0.46 0.11 0.00 0.00 0.00 0.00 61.98 62.32 2eul s VAL 137 Cb -0.26 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.95 2eul s VAL 137 CO 0.54 0.38 -0.25 -0.76 0.00 0.00 0.00 175.10 175.00 2eul s LEU 138 N 1.07 2.33 -0.22 3.92 1.43 0.05 -4.88 118.68 122.38 2eul s LEU 138 Ca -0.06 -0.76 -0.13 0.00 -1.03 0.00 0.00 54.13 52.15 2eul s LEU 138 Cb -0.15 -1.15 -0.05 0.00 0.03 0.00 0.00 46.19 44.88 2eul s LEU 138 CO -0.01 0.15 0.26 -0.55 0.23 0.00 0.00 176.35 176.43 2eul s SER 139 N -2.12 6.26 -0.10 2.29 0.15 -1.26 0.03 113.70 118.95 2eul s SER 139 Ca 0.14 0.30 0.03 0.00 0.70 0.00 0.00 55.95 57.11 2eul s SER 139 Cb -0.10 -2.16 -0.01 0.00 -1.71 0.00 0.00 66.02 62.05 2eul s SER 139 CO 0.06 0.01 -0.20 -0.76 1.20 0.00 0.00 173.24 173.56 2eul s LEU 140 N 1.12 2.35 0.24 3.45 1.43 0.24 -4.96 118.68 122.55 2eul s LEU 140 Ca 0.13 -0.45 -0.31 0.00 -1.03 0.00 0.00 54.13 52.47 2eul s LEU 140 Cb -0.14 -1.48 -0.13 0.00 0.03 0.00 0.00 46.19 44.47 2eul s LEU 140 CO 0.06 0.19 1.48 -0.67 0.23 0.00 0.00 176.35 177.64 2eul n ASP 141 N 3.34 3.09 -3.87 2.29 4.64 -1.26 -1.91 116.55 122.87 2eul n ASP 141 Ca -0.18 1.13 -0.12 0.00 -1.38 0.00 0.00 54.79 54.24 2eul n ASP 141 Cb 0.53 -1.47 -0.12 0.00 -1.04 0.00 0.00 41.12 39.01 2eul n ASP 141 CO 0.00 0.00 0.00 -0.89 -0.82 0.00 0.00 177.20 175.49 2eul s THR 142 N 0.11 0.03 0.07 5.18 2.01 -1.26 -4.87 115.64 116.90 2eul s THR 142 Ca 0.69 -0.22 -0.25 0.00 0.31 0.00 0.00 61.69 62.22 2eul s THR 142 Cb -0.61 -0.19 -0.16 0.00 0.01 0.00 0.00 72.50 71.55 2eul s THR 142 CO 0.47 -0.12 1.62 -0.65 -0.69 0.00 0.00 174.62 175.26 2eul h PRO 143 N 5.59 -0.11 0.00 4.92 0.11 -2.02 -2.61 132.00 137.88 2eul h PRO 143 Ca -0.26 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2eul h PRO 143 Cb 1.20 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2eul h PRO 143 CO 0.44 0.02 0.00 0.36 -0.21 0.00 0.00 178.00 178.61 2eul n LYS 144 N -5.09 0.15 0.00 1.05 2.85 -1.26 -4.87 118.16 110.99 2eul n LYS 144 Ca -0.08 0.30 0.00 0.00 -1.05 0.00 0.00 58.31 57.48 2eul n LYS 144 Cb 0.11 -1.74 0.00 0.00 -0.65 0.00 0.00 35.03 32.75 2eul n LYS 144 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2eul n GLY 145 N 0.46 3.03 3.63 2.58 0.00 -0.98 -5.09 105.19 108.82 2eul n GLY 145 Ca 0.04 -0.01 -0.55 0.00 0.00 0.00 0.00 46.02 45.50 2eul n GLY 145 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2eul n ARG 146 N 0.00 1.27 -4.26 1.61 0.63 -1.25 -4.30 116.66 110.35 2eul n ARG 146 Ca 0.00 0.44 -0.25 0.00 -0.92 0.00 0.00 57.85 57.12 2eul n ARG 146 Cb 0.00 -2.26 -0.08 0.00 0.45 0.00 0.00 32.46 30.57 2eul n ARG 146 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 2eul s ARG 147 N 4.35 2.27 -0.12 -0.14 0.52 -0.80 -4.91 118.95 120.11 2eul s ARG 147 Ca 1.01 -1.27 0.00 0.00 -0.52 0.00 0.00 55.73 54.95 2eul s ARG 147 Cb -0.97 -2.23 -0.02 0.00 0.52 0.00 0.00 34.95 32.25 2eul s ARG 147 CO 0.60 0.41 -0.13 -1.21 0.02 0.00 0.00 175.30 174.99 2eul s GLU 148 N -3.20 3.29 0.24 3.54 8.01 -1.26 0.82 118.70 130.14 2eul s GLU 148 Ca 0.28 -0.68 0.11 0.00 0.01 0.00 0.00 54.97 54.69 2eul s GLU 148 Cb -0.08 -2.61 -0.05 0.00 -4.31 0.00 0.00 34.13 27.08 2eul s GLU 148 CO 0.18 0.26 -0.17 -0.06 0.01 0.00 0.00 175.26 175.49 2eul s PHE 149 N 0.22 2.40 -0.10 1.61 0.40 0.10 -4.26 117.98 118.35 2eul s PHE 149 Ca -0.08 -0.31 -0.02 0.00 -0.60 0.00 0.00 56.93 55.93 2eul s PHE 149 Cb -0.15 -1.11 -0.03 0.00 0.51 0.00 0.00 43.02 42.24 2eul s PHE 149 CO 0.05 0.61 -0.04 0.50 0.70 0.00 0.00 175.22 177.04 2eul s ARG 150 N -3.17 3.15 -0.64 0.44 3.52 -0.18 -0.77 118.95 121.30 2eul s ARG 150 Ca 0.27 -0.50 -0.27 0.00 -0.13 0.00 0.00 55.73 55.10 2eul s ARG 150 Cb -0.07 -2.76 0.01 0.00 -1.56 0.00 0.00 34.95 30.57 2eul s ARG 150 CO 0.14 0.52 1.47 0.08 -0.81 0.00 0.00 175.30 176.71 2eul s VAL 151 N -0.41 3.66 0.08 7.11 1.01 -0.76 -1.93 120.40 129.15 2eul s VAL 151 Ca 0.07 0.46 -0.13 0.00 0.00 0.00 0.00 61.98 62.38 2eul s VAL 151 Cb -0.12 -4.49 -0.24 0.00 0.00 0.00 0.00 36.38 31.52 2eul s VAL 151 CO 0.02 -1.36 1.18 0.58 0.00 0.00 0.00 175.10 175.52 2eul h VAL 152 N 6.37 1.30 -1.67 2.92 2.07 -1.57 -1.69 116.25 123.98 2eul h VAL 152 Ca -0.27 -2.34 0.12 0.00 0.82 0.00 0.00 66.70 65.03 2eul h VAL 152 Cb 1.09 2.48 -0.21 0.00 -1.52 0.00 0.00 31.29 33.13 2eul h VAL 152 CO 1.22 0.72 0.59 0.00 0.02 0.00 0.00 177.57 180.12 2eul s ALA 153 N -3.21 -1.94 -0.46 1.67 0.00 -1.19 -4.87 121.76 111.77 2eul s ALA 153 Ca -0.09 1.49 0.03 0.00 0.00 0.00 0.00 51.96 53.39 2eul s ALA 153 Cb 0.07 -0.47 0.12 0.00 0.00 0.00 0.00 23.12 22.84 2eul s ALA 153 CO 0.92 -0.41 0.20 0.42 0.00 0.00 0.00 175.76 176.89 2eul s ILE 154 N -1.66 2.26 0.17 0.00 1.01 -1.26 -0.71 121.20 121.01 2eul s ILE 154 Ca 0.02 -2.90 -0.08 0.00 0.00 0.00 0.00 60.65 57.68 2eul s ILE 154 Cb -0.01 -2.60 -0.03 0.00 0.01 0.00 0.00 42.46 39.83 2eul s ILE 154 CO -0.02 -0.76 1.52 0.45 0.00 0.00 0.00 174.94 176.12 2eul h HIS 155 N 6.85 0.99 0.00 3.97 3.86 -1.65 -3.47 115.15 125.70 2eul h HIS 155 Ca -0.06 -0.29 0.00 0.00 -1.16 0.00 0.00 60.37 58.86 2eul h HIS 155 Cb 0.93 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 29.19 2eul h HIS 155 CO 0.49 1.08 0.00 0.41 0.86 0.00 0.00 177.93 180.77