#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fhe s ALA 2 N 0.00 2.75 -0.16 0.55 0.00 -1.15 -4.69 121.76 119.06 2fhe s ALA 2 Ca 0.00 0.59 -0.06 0.00 0.00 0.00 0.00 51.96 52.49 2fhe s ALA 2 Cb 0.00 -3.28 -0.04 0.00 0.00 0.00 0.00 23.12 19.81 2fhe s ALA 2 CO 0.00 -0.65 0.03 0.15 0.00 0.00 0.00 175.76 175.28 2fhe s LYS 3 N -3.58 3.77 -0.07 0.00 -0.14 0.13 0.22 119.74 120.06 2fhe s LYS 3 Ca 0.67 -0.40 0.03 0.00 -1.36 0.00 0.00 55.97 54.92 2fhe s LYS 3 Cb -0.18 -3.08 -0.02 0.00 -1.68 0.00 0.00 37.83 32.87 2fhe s LYS 3 CO 0.29 0.33 -0.18 -0.51 -0.76 0.00 0.00 175.35 174.52 2fhe s LEU 4 N 0.19 2.50 -0.08 3.17 1.43 0.10 -1.09 118.68 124.90 2fhe s LEU 4 Ca 0.02 -0.34 0.04 0.00 -1.03 0.00 0.00 54.13 52.82 2fhe s LEU 4 Cb -0.13 -1.51 -0.00 0.00 0.03 0.00 0.00 46.19 44.58 2fhe s LEU 4 CO 0.01 0.26 -0.21 -0.83 0.23 0.00 0.00 176.35 175.81 2fhe s GLY 5 N -0.23 1.16 -0.02 -3.19 0.00 -0.54 0.19 107.32 104.68 2fhe s GLY 5 Ca 0.00 -0.84 -0.30 0.00 0.00 0.00 0.00 44.72 43.58 2fhe s GLY 5 CO 0.03 -0.32 1.16 -0.47 0.00 0.00 0.00 173.10 173.50 2fhe s TYR 6 N 0.25 -0.12 0.80 1.90 5.04 -1.04 -2.04 117.35 122.13 2fhe s TYR 6 Ca -0.13 -0.02 -0.10 0.00 -2.44 0.00 0.00 57.07 54.38 2fhe s TYR 6 Cb -0.16 0.56 0.07 0.00 0.35 0.00 0.00 41.96 42.78 2fhe s TYR 6 CO 0.06 -0.40 1.10 -1.58 -1.34 0.00 0.00 175.55 173.39 2fhe s TRP 7 N -2.68 2.42 -1.37 4.97 0.52 -1.26 -1.11 118.94 120.43 2fhe s TRP 7 Ca 0.11 1.58 -0.09 0.00 0.02 0.00 0.00 56.10 57.73 2fhe s TRP 7 Cb 0.01 -3.10 -0.09 0.00 -1.15 0.00 0.00 33.47 29.15 2fhe s TRP 7 CO -0.03 -1.97 3.00 1.17 0.02 0.00 0.00 176.95 179.13 2fhe n LYS 8 N -3.65 3.55 -4.31 4.98 4.81 -0.03 -4.66 118.16 118.86 2fhe n LYS 8 Ca 0.09 -2.16 -0.18 0.00 -0.87 0.00 0.00 58.31 55.19 2fhe n LYS 8 Cb 0.53 -2.67 -0.09 0.00 0.02 0.00 0.00 35.03 32.82 2fhe n LYS 8 CO 0.00 0.00 0.00 0.96 1.17 0.00 0.00 177.40 179.53 2fhe s ILE 9 N 1.63 0.22 -0.06 3.15 -4.36 -1.26 -4.48 121.20 116.03 2fhe s ILE 9 Ca 0.68 -2.00 -0.01 0.00 -0.26 0.00 0.00 60.65 59.06 2fhe s ILE 9 Cb 0.20 -2.51 -0.00 0.00 1.25 0.00 0.00 42.46 41.40 2fhe s ILE 9 CO -0.06 0.00 0.03 0.03 0.24 0.00 0.00 174.94 175.19 2fhe h ARG 10 N 2.26 -0.02 0.00 0.37 3.08 -1.32 -3.45 114.38 115.30 2fhe h ARG 10 Ca -0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.73 2fhe h ARG 10 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.30 2fhe h ARG 10 CO 0.49 -0.01 0.00 0.41 -1.07 0.00 0.00 179.97 179.79 2fhe n GLY 11 N 1.78 1.95 0.19 0.04 0.00 0.49 -1.77 105.19 107.87 2fhe n GLY 11 Ca -0.00 0.05 0.13 0.00 0.00 0.00 0.00 46.02 46.19 2fhe n GLY 11 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2fhe h LEU 12 N 0.00 0.00 0.00 0.99 3.38 -1.91 -3.34 115.31 114.43 2fhe h LEU 12 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 2fhe h LEU 12 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2fhe h LEU 12 CO 0.00 0.00 -0.68 -0.61 0.09 0.00 0.00 178.44 177.24 2fhe h GLN 13 N 0.00 0.00 -0.51 1.13 5.75 -1.74 -3.39 115.11 116.34 2fhe h GLN 13 Ca 0.00 0.00 0.10 0.00 -0.15 0.00 0.00 58.65 58.60 2fhe h GLN 13 Cb 0.90 0.00 -0.08 0.00 1.07 0.00 0.00 27.48 29.36 2fhe h GLN 13 CO 0.00 0.11 -0.00 0.37 -2.65 0.00 0.00 178.83 176.66 2fhe h GLN 14 N 0.00 0.11 0.00 1.69 5.75 -1.47 -0.87 115.11 120.31 2fhe h GLN 14 Ca -0.02 -0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.47 2fhe h GLN 14 Cb 1.14 -0.02 -0.00 0.00 1.07 0.00 0.00 27.48 29.66 2fhe h GLN 14 CO 0.02 0.07 -0.01 -1.35 -2.65 0.00 0.00 178.83 174.91 2fhe h PRO 15 N 0.11 0.00 -0.19 -2.39 0.11 -1.82 -1.54 132.00 126.28 2fhe h PRO 15 Ca 0.26 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 66.21 2fhe h PRO 15 Cb 0.39 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.51 2fhe h PRO 15 CO -0.43 0.01 -0.49 0.28 -0.21 0.00 0.00 178.00 177.15 2fhe h VAL 16 N 0.00 1.32 -0.37 3.15 2.07 -1.44 -1.93 116.25 119.06 2fhe h VAL 16 Ca -0.00 -1.73 -0.01 0.00 0.82 0.00 0.00 66.70 65.79 2fhe h VAL 16 Cb 0.01 1.91 -0.02 0.00 -1.52 0.00 0.00 31.29 31.67 2fhe h VAL 16 CO 0.00 0.54 0.20 0.03 0.02 0.00 0.00 177.57 178.36 2fhe h ARG 17 N 0.35 0.51 -0.54 1.57 3.08 -0.83 -0.61 114.38 117.91 2fhe h ARG 17 Ca -0.01 -0.06 0.02 0.00 0.07 0.00 0.00 59.98 60.00 2fhe h ARG 17 Cb 1.11 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 31.02 2fhe h ARG 17 CO 0.11 0.42 0.33 -0.07 -1.07 0.00 0.00 179.97 179.69 2fhe h LEU 18 N 0.47 0.56 -0.52 3.04 3.38 -1.30 -1.33 115.31 119.61 2fhe h LEU 18 Ca 0.13 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.04 2fhe h LEU 18 Cb 0.06 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 2fhe h LEU 18 CO -0.02 0.40 0.11 0.25 0.09 0.00 0.00 178.44 179.26 2fhe h LEU 19 N 0.67 0.81 -0.94 1.67 5.85 -1.08 -1.19 115.31 121.10 2fhe h LEU 19 Ca 0.21 -0.25 -0.00 0.00 0.84 0.00 0.00 57.88 58.68 2fhe h LEU 19 Cb -0.02 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 40.76 2fhe h LEU 19 CO -0.08 0.85 0.57 -0.07 -0.34 0.00 0.00 178.44 179.37 2fhe h LEU 20 N 0.73 1.12 -0.90 2.25 3.38 -0.80 -2.01 115.31 119.09 2fhe h LEU 20 Ca 0.16 -0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.95 2fhe h LEU 20 Cb 0.37 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2fhe h LEU 20 CO 0.01 0.86 -0.51 -0.33 0.09 0.00 0.00 178.44 178.55 2fhe h GLU 21 N 1.29 0.10 -0.19 1.13 4.39 -1.00 -1.70 114.58 118.61 2fhe h GLU 21 Ca 0.34 -0.06 -0.07 0.00 0.34 0.00 0.00 59.36 59.91 2fhe h GLU 21 Cb -0.07 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.58 2fhe h GLU 21 CO -0.06 0.59 -0.15 -0.92 -1.16 0.00 0.00 179.01 177.30 2fhe h TYR 22 N 0.08 0.51 -0.44 4.33 3.20 -0.51 -3.20 116.97 120.95 2fhe h TYR 22 Ca 0.00 -0.15 0.00 0.00 3.14 0.00 0.00 58.73 61.72 2fhe h TYR 22 Cb 0.93 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 39.09 2fhe h TYR 22 CO 0.01 0.78 0.00 1.47 -1.64 0.00 0.00 178.16 178.77 2fhe n LEU 23 N -4.51 2.41 -2.50 2.82 -0.00 -0.91 -4.95 117.00 109.36 2fhe n LEU 23 Ca -0.05 -1.19 -0.17 0.00 -0.00 0.00 0.00 56.01 54.60 2fhe n LEU 23 Cb 0.37 -0.29 0.04 0.00 -0.00 0.00 0.00 43.42 43.54 2fhe n LEU 23 CO 0.40 0.59 0.07 0.61 -0.00 0.00 0.00 177.39 179.07 2fhe n GLY 24 N 1.22 -0.20 3.74 1.47 0.00 -0.97 -4.99 105.19 105.46 2fhe n GLY 24 Ca 0.15 -0.05 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 2fhe n GLY 24 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2fhe s GLU 25 N -5.63 4.51 -0.05 1.61 2.56 -0.68 -5.03 118.70 116.00 2fhe s GLU 25 Ca 0.31 1.10 -0.27 0.00 0.00 0.00 0.00 54.97 56.11 2fhe s GLU 25 Cb -0.14 -3.37 -0.03 0.00 2.00 0.00 0.00 34.13 32.59 2fhe s GLU 25 CO 0.38 0.25 0.87 0.21 -0.56 0.00 0.00 175.26 176.41 2fhe s LYS 26 N 0.05 4.48 0.08 4.30 2.20 -1.26 -4.74 119.74 124.85 2fhe s LYS 26 Ca 0.40 1.18 -0.11 0.00 -0.36 0.00 0.00 55.97 57.08 2fhe s LYS 26 Cb -0.21 -3.47 0.01 0.00 -1.51 0.00 0.00 37.83 32.65 2fhe s LYS 26 CO 0.23 -0.06 0.26 1.52 -0.36 0.00 0.00 175.35 176.95 2fhe s TYR 27 N 1.12 0.01 -0.14 4.03 1.13 -1.26 -2.94 117.35 119.29 2fhe s TYR 27 Ca 0.45 -0.34 0.02 0.00 -1.41 0.00 0.00 57.07 55.79 2fhe s TYR 27 Cb -0.19 0.05 0.01 0.00 -1.10 0.00 0.00 41.96 40.72 2fhe s TYR 27 CO 0.22 -0.56 -0.20 -2.00 -2.51 0.00 0.00 175.55 170.50 2fhe s GLU 28 N -3.49 3.09 -0.24 -3.49 2.56 0.13 -4.90 118.70 112.37 2fhe s GLU 28 Ca 0.02 -0.82 -0.14 0.00 0.00 0.00 0.00 54.97 54.03 2fhe s GLU 28 Cb 0.03 -2.49 -0.04 0.00 2.00 0.00 0.00 34.13 33.62 2fhe s GLU 28 CO -0.09 0.01 0.30 -1.21 -0.56 0.00 0.00 175.26 173.71 2fhe s GLU 29 N 0.77 4.08 -0.65 4.30 2.02 -1.26 0.02 118.70 127.98 2fhe s GLU 29 Ca -0.07 -0.04 -0.17 0.00 0.02 0.00 0.00 54.97 54.71 2fhe s GLU 29 Cb -0.16 -3.58 0.14 0.00 0.10 0.00 0.00 34.13 30.63 2fhe s GLU 29 CO -0.00 -0.09 0.68 -0.65 0.02 0.00 0.00 175.26 175.22 2fhe s GLN 30 N 1.49 3.18 -0.00 1.61 1.11 0.50 -4.91 119.66 122.64 2fhe s GLN 30 Ca 0.13 -1.71 -0.27 0.00 0.01 0.00 0.00 55.36 53.52 2fhe s GLN 30 Cb -0.15 -4.36 -0.04 0.00 -1.01 0.00 0.00 33.01 27.45 2fhe s GLN 30 CO 0.08 -1.44 0.83 0.42 0.01 0.00 0.00 175.29 175.19 2fhe s ILE 31 N 1.82 4.86 -0.27 1.08 -1.09 -1.26 -2.51 121.20 123.83 2fhe s ILE 31 Ca 0.12 1.75 -0.07 0.00 -2.23 0.00 0.00 60.65 60.22 2fhe s ILE 31 Cb -0.22 -4.18 -0.00 0.00 -1.58 0.00 0.00 42.46 36.48 2fhe s ILE 31 CO 0.01 0.26 0.06 -0.31 -1.23 0.00 0.00 174.94 173.73 2fhe s TYR 32 N 0.58 3.10 0.98 3.97 2.02 -0.27 -4.93 117.35 122.80 2fhe s TYR 32 Ca 0.43 -0.80 -0.14 0.00 -0.37 0.00 0.00 57.07 56.20 2fhe s TYR 32 Cb -0.20 -2.23 0.18 0.00 -0.40 0.00 0.00 41.96 39.30 2fhe s TYR 32 CO 0.24 -0.51 1.15 -1.21 -1.57 0.00 0.00 175.55 173.65 2fhe s GLU 33 N 1.53 0.58 0.49 -0.62 0.41 -1.26 -0.85 118.70 118.99 2fhe s GLU 33 Ca 0.04 0.18 0.26 0.00 -0.41 0.00 0.00 54.97 55.03 2fhe s GLU 33 Cb -0.16 -1.78 1.32 0.00 -1.78 0.00 0.00 34.13 31.73 2fhe s GLU 33 CO 0.02 -2.55 1.89 -0.09 -0.49 0.00 0.00 175.26 174.04 2fhe h ARG 34 N -1.75 0.15 -0.46 1.61 2.43 -1.98 -1.34 114.38 113.03 2fhe h ARG 34 Ca -0.49 -0.01 -0.15 0.00 -0.81 0.00 0.00 59.98 58.52 2fhe h ARG 34 Cb 1.32 -0.03 -0.09 0.00 -0.42 0.00 0.00 29.97 30.74 2fhe h ARG 34 CO 0.54 0.10 0.09 -0.25 -1.51 0.00 0.00 179.97 178.94 2fhe n ASP 35 N -4.37 3.70 -1.48 -3.80 8.00 -1.26 -4.53 116.55 112.80 2fhe n ASP 35 Ca 0.18 -3.35 0.11 0.00 0.71 0.00 0.00 54.79 52.44 2fhe n ASP 35 Cb 0.82 -0.65 0.34 0.00 -0.02 0.00 0.00 41.12 41.62 2fhe n ASP 35 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2fhe n ASP 36 N -0.65 4.37 -0.09 -2.24 8.00 -0.50 -4.60 116.55 120.84 2fhe n ASP 36 Ca 0.33 -2.21 -0.07 0.00 0.71 0.00 0.00 54.79 53.55 2fhe n ASP 36 Cb 1.12 -0.54 -0.01 0.00 -0.02 0.00 0.00 41.12 41.67 2fhe n ASP 36 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 2fhe h GLY 37 N 4.26 -0.15 0.60 0.44 0.00 -1.80 -0.44 103.07 105.98 2fhe h GLY 37 Ca 0.00 0.34 0.05 0.00 0.00 0.00 0.00 47.33 47.72 2fhe h GLY 37 CO 0.11 -0.21 0.09 0.83 0.00 0.00 0.00 176.54 177.37 2fhe h GLU 38 N -0.23 0.22 -0.66 4.80 4.39 -1.98 0.14 114.58 121.26 2fhe h GLU 38 Ca 0.16 -0.01 0.14 0.00 0.34 0.00 0.00 59.36 59.99 2fhe h GLU 38 Cb 0.49 -0.05 -0.10 0.00 -0.10 0.00 0.00 28.75 28.99 2fhe h GLU 38 CO -0.47 0.15 0.10 -0.22 -1.16 0.00 0.00 179.01 177.41 2fhe h LYS 39 N 0.23 0.21 -0.10 2.33 3.64 -1.53 -0.93 116.57 120.41 2fhe h LYS 39 Ca 0.17 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.47 2fhe h LYS 39 Cb 0.19 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 2fhe h LYS 39 CO -0.21 0.14 -0.21 2.35 -2.27 0.00 0.00 179.45 179.25 2fhe h TRP 40 N 0.21 0.41 0.00 1.91 2.91 -0.12 -3.14 115.95 118.13 2fhe h TRP 40 Ca 0.36 -0.15 0.00 0.00 1.13 0.00 0.00 58.89 60.23 2fhe h TRP 40 Cb 0.58 -0.08 0.00 0.00 -0.51 0.00 0.00 29.16 29.16 2fhe h TRP 40 CO -0.30 0.82 0.00 1.19 -1.03 0.00 0.00 178.44 179.12 2fhe n PHE 41 N -4.52 0.22 -0.03 2.65 3.72 0.38 -0.35 117.46 119.53 2fhe n PHE 41 Ca -0.07 0.09 -0.06 0.00 -0.05 0.00 0.00 57.45 57.36 2fhe n PHE 41 Cb 0.42 -0.65 -0.13 0.00 -0.94 0.00 0.00 39.48 38.18 2fhe n PHE 41 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2fhe n SER 42 N -1.70 0.62 -0.01 4.37 3.41 -0.40 -4.25 113.62 115.65 2fhe n SER 42 Ca 0.02 0.29 0.08 0.00 -0.26 0.00 0.00 58.87 59.00 2fhe n SER 42 Cb 0.15 0.33 -0.10 0.00 -0.26 0.00 0.00 64.21 64.33 2fhe n SER 42 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 2fhe n LYS 43 N -2.91 1.15 -0.32 4.33 -0.00 -1.04 -4.59 118.16 114.79 2fhe n LYS 43 Ca -0.19 -0.02 0.17 0.00 -0.00 0.00 0.00 58.31 58.27 2fhe n LYS 43 Cb 1.01 -1.34 0.34 0.00 -0.00 0.00 0.00 35.03 35.05 2fhe n LYS 43 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.40 177.18 2fhe h LYS 44 N 0.05 0.08 -0.61 -1.58 3.64 -0.87 0.59 116.57 117.87 2fhe h LYS 44 Ca 0.00 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 2fhe h LYS 44 Cb 0.42 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 2fhe h LYS 44 CO 0.00 0.05 0.03 1.19 -2.27 0.00 0.00 179.45 178.45 2fhe n PHE 45 N -5.35 2.08 0.10 1.91 3.72 -1.26 -4.18 117.46 114.48 2fhe n PHE 45 Ca 0.25 -0.75 0.01 0.00 -0.05 0.00 0.00 57.45 56.91 2fhe n PHE 45 Cb 0.82 -0.52 0.00 0.00 -0.94 0.00 0.00 39.48 38.84 2fhe n PHE 45 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2fhe n GLU 46 N 0.54 2.27 0.00 -1.08 4.71 0.20 -4.68 120.64 122.60 2fhe n GLU 46 Ca 0.28 -0.37 0.14 0.00 -0.01 0.00 0.00 57.16 57.20 2fhe n GLU 46 Cb 1.20 -0.86 0.60 0.00 -1.01 0.00 0.00 31.44 31.36 2fhe n GLU 46 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 2fhe n LEU 47 N -0.36 0.41 -0.14 -4.62 4.77 -1.12 -4.93 117.00 111.00 2fhe n LEU 47 Ca 0.01 0.06 -0.02 0.00 -0.03 0.00 0.00 56.01 56.03 2fhe n LEU 47 Cb 0.05 -0.22 -0.01 0.00 -2.33 0.00 0.00 43.42 40.92 2fhe n LEU 47 CO 0.03 0.08 -0.02 0.61 -1.33 0.00 0.00 177.39 176.76 2fhe n GLY 48 N 1.31 0.51 3.74 -0.72 0.00 -1.26 -5.03 105.19 103.75 2fhe n GLY 48 Ca 0.13 -1.00 -0.40 0.00 0.00 0.00 0.00 46.02 44.75 2fhe n GLY 48 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2fhe s LEU 49 N -0.42 4.44 0.20 0.99 1.43 -1.26 -4.98 118.68 119.08 2fhe s LEU 49 Ca 0.00 1.43 -0.09 0.00 -1.03 0.00 0.00 54.13 54.45 2fhe s LEU 49 Cb 0.00 -3.22 0.13 0.00 0.03 0.00 0.00 46.19 43.12 2fhe s LEU 49 CO 0.00 0.01 1.75 0.44 0.23 0.00 0.00 176.35 178.78 2fhe h ASP 50 N 5.73 1.04 -2.54 2.29 3.32 -1.96 -3.34 116.42 120.95 2fhe h ASP 50 Ca -0.44 -0.19 -0.60 0.00 0.02 0.00 0.00 57.03 55.83 2fhe h ASP 50 Cb 1.20 -0.27 -0.39 0.00 0.22 0.00 0.00 39.33 40.10 2fhe h ASP 50 CO 0.71 0.95 -0.89 -0.76 -1.72 0.00 0.00 179.24 177.53 2fhe s LEU 51 N -9.67 2.07 0.12 1.55 1.43 -1.26 -5.12 118.68 107.80 2fhe s LEU 51 Ca -0.12 -3.17 -0.35 0.00 -1.03 0.00 0.00 54.13 49.47 2fhe s LEU 51 Cb 0.15 -0.68 -0.17 0.00 0.03 0.00 0.00 46.19 45.52 2fhe s LEU 51 CO 0.83 -0.16 1.10 -2.65 0.23 0.00 0.00 176.35 175.69 2fhe n PRO 52 N 2.75 0.75 -3.74 1.29 -0.02 -1.26 -4.75 135.00 130.02 2fhe n PRO 52 Ca 0.27 0.27 0.03 0.00 -2.02 0.00 0.00 63.50 62.04 2fhe n PRO 52 Cb 0.45 -1.73 0.00 0.00 -0.02 0.00 0.00 33.50 32.20 2fhe n PRO 52 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2fhe s ASN 53 N -0.04 -0.02 -0.08 2.55 3.84 -1.26 -5.09 114.94 114.84 2fhe s ASN 53 Ca 0.78 -0.11 0.04 0.00 0.21 0.00 0.00 52.86 53.78 2fhe s ASN 53 Cb -0.98 0.10 0.00 0.00 -0.55 0.00 0.00 41.25 39.83 2fhe s ASN 53 CO 0.53 -0.19 -0.20 -0.76 -2.79 0.00 0.00 177.10 173.68 2fhe s LEU 54 N -3.30 1.95 0.75 3.21 1.43 -1.26 -4.01 118.68 117.46 2fhe s LEU 54 Ca 0.20 -0.47 -0.12 0.00 -1.03 0.00 0.00 54.13 52.71 2fhe s LEU 54 Cb 0.04 -1.22 0.05 0.00 0.03 0.00 0.00 46.19 45.09 2fhe s LEU 54 CO -0.04 0.13 1.13 -2.16 0.23 0.00 0.00 176.35 175.65 2fhe s PRO 55 N 0.37 2.44 0.09 1.29 0.04 -1.26 -4.90 135.00 133.07 2fhe s PRO 55 Ca -0.16 0.31 0.03 0.00 0.04 0.00 0.00 61.00 61.23 2fhe s PRO 55 Cb -0.17 -1.99 -0.04 0.00 0.04 0.00 0.00 34.50 32.35 2fhe s PRO 55 CO 0.07 -1.30 -0.09 1.52 0.04 0.00 0.00 177.00 177.23 2fhe s TYR 56 N -3.45 1.00 -0.04 0.56 -0.85 -0.87 -3.66 117.35 110.04 2fhe s TYR 56 Ca 0.60 -0.69 0.02 0.00 -0.52 0.00 0.00 57.07 56.48 2fhe s TYR 56 Cb -0.11 -0.55 0.01 0.00 0.38 0.00 0.00 41.96 41.69 2fhe s TYR 56 CO 0.51 -0.03 -0.08 -0.47 -1.52 0.00 0.00 175.55 173.96 2fhe s TYR 57 N -2.57 0.99 -0.03 -3.49 6.14 0.48 -1.47 117.35 117.41 2fhe s TYR 57 Ca 0.05 -0.30 -0.01 0.00 0.64 0.00 0.00 57.07 57.46 2fhe s TYR 57 Cb -0.02 -0.77 0.03 0.00 0.42 0.00 0.00 41.96 41.62 2fhe s TYR 57 CO -0.01 -0.19 0.03 0.42 0.64 0.00 0.00 175.55 176.44 2fhe s ILE 58 N 0.64 0.04 0.28 3.14 1.01 -0.25 -0.25 121.20 125.80 2fhe s ILE 58 Ca -0.10 0.23 0.01 0.00 0.00 0.00 0.00 60.65 60.79 2fhe s ILE 58 Cb -0.13 -0.20 -0.00 0.00 0.01 0.00 0.00 42.46 42.14 2fhe s ILE 58 CO 0.01 0.15 0.34 -0.90 0.00 0.00 0.00 174.94 174.54 2fhe n ASP 59 N 4.55 -0.92 0.15 3.58 5.68 -0.22 0.21 116.55 129.58 2fhe n ASP 59 Ca -0.19 -2.63 0.11 0.00 -0.50 0.00 0.00 54.79 51.58 2fhe n ASP 59 Cb 0.50 1.81 0.55 0.00 -1.14 0.00 0.00 41.12 42.84 2fhe n ASP 59 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2fhe n ASP 60 N -1.80 0.56 -0.03 -1.12 9.92 -1.26 -3.08 116.55 119.75 2fhe n ASP 60 Ca 0.03 0.73 -0.01 0.00 -0.53 0.00 0.00 54.79 55.01 2fhe n ASP 60 Cb 0.48 -0.82 -0.06 0.00 -0.64 0.00 0.00 41.12 40.09 2fhe n ASP 60 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2fhe n LYS 61 N -2.22 1.98 -3.97 -1.24 5.02 -1.26 -5.07 118.16 111.39 2fhe n LYS 61 Ca -0.01 -0.03 -0.09 0.00 -2.02 0.00 0.00 58.31 56.17 2fhe n LYS 61 Cb 0.07 -1.18 -0.11 0.00 -0.02 0.00 0.00 35.03 33.79 2fhe n LYS 61 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2fhe s LYS 63 N -1.72 0.99 0.13 0.00 1.02 -1.26 -1.06 119.74 117.84 2fhe s LYS 63 Ca -0.13 -0.51 0.04 0.00 0.02 0.00 0.00 55.97 55.39 2fhe s LYS 63 Cb -0.08 -2.09 -0.04 0.00 -0.52 0.00 0.00 37.83 35.10 2fhe s LYS 63 CO -0.02 -0.56 -0.09 -0.51 -0.92 0.00 0.00 175.35 173.25 2fhe s LEU 64 N 1.73 2.52 0.23 3.17 1.43 0.65 -4.84 118.68 123.59 2fhe s LEU 64 Ca -0.01 -1.01 0.01 0.00 -1.03 0.00 0.00 54.13 52.08 2fhe s LEU 64 Cb -0.17 -0.25 -0.05 0.00 0.03 0.00 0.00 46.19 45.75 2fhe s LEU 64 CO -0.07 -0.38 0.10 0.42 0.23 0.00 0.00 176.35 176.65 2fhe s THR 65 N -3.43 0.39 0.00 5.49 -4.23 -1.26 -0.38 115.64 112.21 2fhe s THR 65 Ca 0.15 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.66 2fhe s THR 65 Cb 0.03 -2.55 0.00 0.00 1.34 0.00 0.00 72.50 71.32 2fhe s THR 65 CO -0.01 -0.04 0.00 0.00 -0.54 0.00 0.00 174.62 174.03 2fhe n GLN 66 N -0.38 0.00 -0.33 3.99 1.13 -1.24 -4.53 117.38 116.01 2fhe n GLN 66 Ca 0.00 0.29 0.13 0.00 -1.94 0.00 0.00 57.00 55.48 2fhe n GLN 66 Cb 0.66 -0.29 0.32 0.00 0.11 0.00 0.00 30.24 31.04 2fhe n GLN 66 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 2fhe h SER 67 N 0.00 0.59 0.19 1.08 4.64 -1.91 -0.92 113.55 117.22 2fhe h SER 67 Ca 0.00 0.12 -0.17 0.00 -0.47 0.00 0.00 61.79 61.28 2fhe h SER 67 Cb 0.00 0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.12 2fhe h SER 67 CO 0.00 0.14 -0.63 0.25 -0.87 0.00 0.00 176.83 175.72 2fhe h LEU 68 N 0.59 0.49 -0.59 5.97 5.85 -1.93 -1.24 115.31 124.44 2fhe h LEU 68 Ca 0.57 -0.29 -0.11 0.00 0.84 0.00 0.00 57.88 58.90 2fhe h LEU 68 Cb 1.00 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.87 2fhe h LEU 68 CO -0.45 0.99 -0.07 0.00 -0.34 0.00 0.00 178.44 178.58 2fhe h ALA 69 N 1.01 0.80 -0.18 1.25 0.00 -1.53 -1.17 119.26 119.42 2fhe h ALA 69 Ca -0.01 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 2fhe h ALA 69 Cb 1.18 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2fhe h ALA 69 CO 0.11 0.67 0.01 0.82 0.00 0.00 0.00 179.25 180.86 2fhe h ILE 70 N 0.94 1.24 -0.49 0.00 2.04 -1.09 -1.76 117.51 118.40 2fhe h ILE 70 Ca 0.15 -0.82 0.02 0.00 1.00 0.00 0.00 64.86 65.22 2fhe h ILE 70 Cb 0.63 1.43 -0.03 0.00 -0.74 0.00 0.00 36.82 38.11 2fhe h ILE 70 CO 0.04 0.25 0.30 0.25 0.00 0.00 0.00 178.15 178.99 2fhe h LEU 71 N 0.08 0.48 -1.47 1.44 5.85 -1.15 -2.67 115.31 117.88 2fhe h LEU 71 Ca 0.05 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.73 2fhe h LEU 71 Cb 0.36 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 2fhe h LEU 71 CO 0.01 0.34 -0.23 0.03 -0.34 0.00 0.00 178.44 178.25 2fhe h ARG 72 N 0.59 0.00 0.06 1.25 3.08 -1.12 -1.89 114.38 116.35 2fhe h ARG 72 Ca 0.19 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.24 2fhe h ARG 72 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.06 2fhe h ARG 72 CO -0.08 0.23 -0.03 -0.92 -1.07 0.00 0.00 179.97 178.10 2fhe h TYR 73 N 0.00 -0.08 -0.79 3.04 3.20 -0.97 0.28 116.97 121.65 2fhe h TYR 73 Ca -0.00 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.84 2fhe h TYR 73 Cb 0.57 0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.83 2fhe h TYR 73 CO 0.00 0.28 0.38 0.82 -1.64 0.00 0.00 178.16 177.99 2fhe h ILE 74 N -0.44 1.25 -0.55 1.81 2.04 -1.40 -0.45 117.51 119.77 2fhe h ILE 74 Ca -0.01 -0.71 -0.10 0.00 1.00 0.00 0.00 64.86 65.05 2fhe h ILE 74 Cb 0.39 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.70 2fhe h ILE 74 CO 0.01 0.30 -0.04 0.00 0.00 0.00 0.00 178.15 178.43 2fhe h ALA 75 N 1.20 0.74 -0.00 1.87 0.00 -1.29 -2.47 119.26 119.30 2fhe h ALA 75 Ca 0.27 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2fhe h ALA 75 Cb 0.13 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 2fhe h ALA 75 CO -0.03 0.60 0.00 0.22 0.00 0.00 0.00 179.25 180.03 2fhe h ASP 76 N 0.87 0.00 -0.02 0.00 1.82 -0.07 0.23 116.42 119.25 2fhe h ASP 76 Ca 0.15 -0.08 0.00 0.00 -0.39 0.00 0.00 57.03 56.72 2fhe h ASP 76 Cb 0.59 -0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.60 2fhe h ASP 76 CO 0.04 0.08 0.05 0.11 -1.61 0.00 0.00 179.24 177.91 2fhe h LYS 77 N -0.08 0.00 -0.34 0.28 1.57 -0.96 -1.25 116.57 115.79 2fhe h LYS 77 Ca 0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2fhe h LYS 77 Cb 0.08 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 2fhe h LYS 77 CO -0.00 0.00 0.00 0.72 -0.57 0.00 0.00 179.45 179.60 2fhe n HIS 78 N -3.28 1.24 -2.09 -1.35 8.25 -0.72 -4.98 115.22 112.30 2fhe n HIS 78 Ca -0.03 -0.85 -0.16 0.00 -0.26 0.00 0.00 57.72 56.43 2fhe n HIS 78 Cb 0.13 -0.37 -0.02 0.00 1.12 0.00 0.00 29.99 30.85 2fhe n HIS 78 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2fhe n GLY 79 N -0.23 0.18 0.99 -1.41 0.00 -0.47 -4.93 105.19 99.32 2fhe n GLY 79 Ca 0.23 -0.24 0.11 0.00 0.00 0.00 0.00 46.02 46.11 2fhe n GLY 79 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2fhe n MET 80 N -2.51 2.25 0.14 1.61 2.81 -0.01 -4.54 117.12 116.87 2fhe n MET 80 Ca -0.18 -2.05 0.05 0.00 -1.81 0.00 0.00 57.70 53.71 2fhe n MET 80 Cb 0.61 -1.45 0.03 0.00 -0.71 0.00 0.00 33.22 31.70 2fhe n MET 80 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 2fhe h ILE 81 N 4.14 0.59 0.00 2.02 5.03 -1.87 -3.47 117.51 123.95 2fhe h ILE 81 Ca 0.00 -1.88 0.00 0.00 -0.12 0.00 0.00 64.86 62.86 2fhe h ILE 81 Cb 0.92 2.23 0.00 0.00 -3.03 0.00 0.00 36.82 36.93 2fhe h ILE 81 CO 0.00 0.34 0.00 0.61 -0.68 0.00 0.00 178.15 178.42 2fhe n GLY 82 N 1.22 3.46 0.02 5.37 0.00 -1.26 -4.18 105.19 109.83 2fhe n GLY 82 Ca 0.01 -1.63 0.11 0.00 0.00 0.00 0.00 46.02 44.50 2fhe n GLY 82 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2fhe n THR 83 N -0.46 0.07 -4.55 2.61 -2.24 -1.26 -4.75 114.28 103.69 2fhe n THR 83 Ca 0.00 -0.46 -0.26 0.00 -2.27 0.00 0.00 64.05 61.06 2fhe n THR 83 Cb 0.00 0.04 -0.11 0.00 -2.10 0.00 0.00 70.33 68.16 2fhe n THR 83 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2fhe s THR 84 N -3.46 1.63 0.22 4.28 -4.23 -1.26 -5.02 115.64 107.80 2fhe s THR 84 Ca -0.06 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 58.41 2fhe s THR 84 Cb 0.14 -2.88 0.05 0.00 1.34 0.00 0.00 72.50 71.14 2fhe s THR 84 CO 0.89 0.00 1.65 0.28 -0.54 0.00 0.00 174.62 176.90 2fhe h SER 85 N 1.90 0.80 -0.51 3.99 0.02 -1.99 -0.50 113.55 117.27 2fhe h SER 85 Ca -0.43 -0.27 -0.09 0.00 -0.84 0.00 0.00 61.79 60.17 2fhe h SER 85 Cb 1.24 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 63.55 2fhe h SER 85 CO 0.76 0.97 -0.02 -0.33 -1.14 0.00 0.00 176.83 177.07 2fhe h GLU 86 N 0.71 0.91 -0.31 3.45 3.07 -1.99 -1.31 114.58 119.11 2fhe h GLU 86 Ca 0.11 -0.30 -0.10 0.00 -0.50 0.00 0.00 59.36 58.57 2fhe h GLU 86 Cb 0.67 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.50 2fhe h GLU 86 CO 0.05 0.94 -0.20 1.49 -1.40 0.00 0.00 179.01 179.89 2fhe h GLU 87 N 0.77 0.68 -0.38 2.33 4.81 -1.92 -1.90 114.58 118.96 2fhe h GLU 87 Ca 0.14 -0.32 -0.04 0.00 -0.13 0.00 0.00 59.36 59.01 2fhe h GLU 87 Cb 0.55 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.90 2fhe h GLU 87 CO 0.03 0.92 0.06 0.00 -0.73 0.00 0.00 179.01 179.29 2fhe h ARG 88 N 0.43 0.57 -0.35 1.92 3.08 -1.00 -1.61 114.38 117.42 2fhe h ARG 88 Ca 0.06 -0.11 -0.16 0.00 0.07 0.00 0.00 59.98 59.84 2fhe h ARG 88 Cb 0.75 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.70 2fhe h ARG 88 CO 0.06 0.55 -0.42 0.00 -1.07 0.00 0.00 179.97 179.08 2fhe h ALA 89 N 1.52 0.58 -0.39 0.04 0.00 -1.12 -1.81 119.26 118.07 2fhe h ALA 89 Ca 0.13 -0.47 -0.06 0.00 0.00 0.00 0.00 54.91 54.50 2fhe h ALA 89 Cb 0.26 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2fhe h ALA 89 CO 0.00 0.68 -0.03 -0.09 0.00 0.00 0.00 179.25 179.81 2fhe h ARG 90 N 0.72 0.63 -0.27 0.00 2.43 -0.94 -0.53 114.38 116.42 2fhe h ARG 90 Ca 0.05 -0.16 -0.04 0.00 -0.81 0.00 0.00 59.98 59.02 2fhe h ARG 90 Cb 1.01 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.48 2fhe h ARG 90 CO 0.10 0.67 -0.00 0.28 -1.51 0.00 0.00 179.97 179.51 2fhe h VAL 91 N 0.60 1.26 -0.33 0.20 2.07 -1.10 -2.17 116.25 116.77 2fhe h VAL 91 Ca 0.12 -0.92 -0.03 0.00 0.82 0.00 0.00 66.70 66.69 2fhe h VAL 91 Cb 0.42 1.33 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 2fhe h VAL 91 CO 0.02 0.29 0.08 0.28 0.02 0.00 0.00 177.57 178.26 2fhe h SER 92 N 0.26 0.43 -0.22 0.57 0.02 -0.90 -1.37 113.55 112.34 2fhe h SER 92 Ca 0.08 -0.05 -0.02 0.00 -0.84 0.00 0.00 61.79 60.96 2fhe h SER 92 Cb 0.42 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.84 2fhe h SER 92 CO 0.01 0.44 0.08 -0.03 -1.14 0.00 0.00 176.83 176.19 2fhe h MET 93 N 0.47 0.34 -0.69 3.45 -1.53 -0.82 -0.87 114.93 115.27 2fhe h MET 93 Ca 0.11 -0.07 -0.01 0.00 -3.44 0.00 0.00 59.70 56.29 2fhe h MET 93 Cb 0.18 -0.05 -0.03 0.00 -0.55 0.00 0.00 31.60 31.14 2fhe h MET 93 CO -0.00 0.41 0.38 0.82 0.14 0.00 0.00 176.91 178.66 2fhe h ILE 94 N 0.20 1.21 -0.40 1.77 2.04 -0.84 -1.65 117.51 119.84 2fhe h ILE 94 Ca 0.07 -0.53 0.00 0.00 1.00 0.00 0.00 64.86 65.41 2fhe h ILE 94 Cb 0.20 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.56 2fhe h ILE 94 CO -0.00 0.23 0.26 -0.33 0.00 0.00 0.00 178.15 178.31 2fhe h GLU 95 N 0.95 0.54 -0.72 2.37 5.08 -1.08 -0.13 114.58 121.59 2fhe h GLU 95 Ca 0.24 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.58 2fhe h GLU 95 Cb 0.03 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.12 2fhe h GLU 95 CO -0.04 0.37 0.47 0.78 -1.00 0.00 0.00 179.01 179.59 2fhe h GLY 96 N 0.54 1.02 1.48 -3.84 0.00 -0.80 0.12 103.07 101.60 2fhe h GLY 96 Ca 0.15 -0.37 -0.10 0.00 0.00 0.00 0.00 47.33 47.01 2fhe h GLY 96 CO -0.03 0.35 -0.24 0.00 0.00 0.00 0.00 176.54 176.62 2fhe h ALA 97 N 1.28 1.01 -0.13 3.60 0.00 -1.00 -1.21 119.26 122.80 2fhe h ALA 97 Ca 0.27 -0.35 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 2fhe h ALA 97 Cb -0.08 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2fhe h ALA 97 CO -0.07 0.59 -0.45 0.00 0.00 0.00 0.00 179.25 179.32 2fhe h ALA 98 N 1.22 0.99 -0.36 0.00 0.00 -0.38 -1.10 119.26 119.63 2fhe h ALA 98 Ca 0.08 -0.45 -0.12 0.00 0.00 0.00 0.00 54.91 54.42 2fhe h ALA 98 Cb 0.69 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2fhe h ALA 98 CO 0.05 0.63 -0.25 0.28 0.00 0.00 0.00 179.25 179.96 2fhe h VAL 99 N 0.26 1.29 -0.66 0.00 2.07 -0.37 -2.34 116.25 116.49 2fhe h VAL 99 Ca 0.02 -1.40 0.02 0.00 0.82 0.00 0.00 66.70 66.15 2fhe h VAL 99 Cb 0.90 1.40 -0.04 0.00 -1.52 0.00 0.00 31.29 32.03 2fhe h VAL 99 CO 0.07 0.46 0.43 0.44 0.02 0.00 0.00 177.57 178.99 2fhe h ASP 100 N 0.59 0.72 -0.32 0.57 3.32 -0.94 0.20 116.42 120.56 2fhe h ASP 100 Ca 0.07 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.11 2fhe h ASP 100 Cb 0.82 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.18 2fhe h ASP 100 CO 0.07 0.51 0.20 0.25 -1.72 0.00 0.00 179.24 178.55 2fhe h LEU 101 N 0.85 0.38 -0.17 1.55 5.85 -1.04 -0.36 115.31 122.37 2fhe h LEU 101 Ca 0.26 -0.04 -0.23 0.00 0.84 0.00 0.00 57.88 58.71 2fhe h LEU 101 Cb -0.04 -0.10 0.01 0.00 0.37 0.00 0.00 40.66 40.90 2fhe h LEU 101 CO -0.08 0.30 -0.91 -0.09 -0.34 0.00 0.00 178.44 177.32 2fhe h ARG 102 N 0.42 0.51 0.00 1.25 9.65 -1.22 -3.22 114.38 121.76 2fhe h ARG 102 Ca 0.12 -0.51 -0.05 0.00 -1.10 0.00 0.00 59.98 58.44 2fhe h ARG 102 Cb -0.02 0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 28.69 2fhe h ARG 102 CO -0.02 1.14 -0.23 0.37 2.80 0.00 0.00 179.97 184.03 2fhe h GLN 103 N 0.30 0.00 -0.24 0.20 4.15 -0.49 -2.44 115.11 116.58 2fhe h GLN 103 Ca -0.08 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.32 2fhe h GLN 103 Cb 1.54 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 29.22 2fhe h GLN 103 CO 0.17 0.23 0.08 0.78 -1.93 0.00 0.00 178.83 178.16 2fhe h GLY 104 N 1.98 0.41 1.69 2.39 0.00 -1.07 -0.06 103.07 108.40 2fhe h GLY 104 Ca -0.00 -0.24 -0.17 0.00 0.00 0.00 0.00 47.33 46.92 2fhe h GLY 104 CO 0.03 0.22 -0.67 1.19 0.00 0.00 0.00 176.54 177.31 2fhe h ILE 105 N 0.23 1.39 -0.64 2.60 2.10 -1.64 -3.14 117.51 118.41 2fhe h ILE 105 Ca 0.08 -2.10 -0.04 0.00 1.08 0.00 0.00 64.86 63.88 2fhe h ILE 105 Cb 0.23 2.08 -0.03 0.00 -1.09 0.00 0.00 36.82 38.01 2fhe h ILE 105 CO -0.00 0.62 0.24 -1.28 -1.08 0.00 0.00 178.15 176.65 2fhe h SER 106 N 0.22 0.90 0.47 2.19 0.87 -1.27 -1.90 113.55 115.03 2fhe h SER 106 Ca -0.02 -0.18 -0.01 0.00 -1.23 0.00 0.00 61.79 60.35 2fhe h SER 106 Cb 1.22 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.93 2fhe h SER 106 CO 0.11 0.84 -0.36 -0.09 -0.53 0.00 0.00 176.83 176.80 2fhe h ARG 107 N 0.91 -0.78 0.00 2.24 2.43 -0.96 -2.76 114.38 115.46 2fhe h ARG 107 Ca 0.21 0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.38 2fhe h ARG 107 Cb 0.23 0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 2fhe h ARG 107 CO -0.01 -0.52 -0.25 -0.84 -1.51 0.00 0.00 179.97 176.84 2fhe h ILE 108 N -0.81 0.71 -0.01 1.20 3.07 -1.56 -3.16 117.51 116.95 2fhe h ILE 108 Ca -0.05 -1.08 -0.13 0.00 1.55 0.00 0.00 64.86 65.16 2fhe h ILE 108 Cb 0.69 1.68 -0.02 0.00 -0.27 0.00 0.00 36.82 38.91 2fhe h ILE 108 CO 0.00 0.24 -0.59 0.28 -1.05 0.00 0.00 178.15 177.03 2fhe h SER 109 N 0.00 0.02 -0.19 2.16 0.02 -1.15 -2.97 113.55 111.45 2fhe h SER 109 Ca -0.00 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 2fhe h SER 109 Cb 0.66 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.20 2fhe h SER 109 CO 0.03 0.61 0.00 -1.22 -1.14 0.00 0.00 176.83 175.11 2fhe n TYR 110 N -3.84 0.22 -3.12 3.45 4.01 -1.06 0.64 117.16 117.47 2fhe n TYR 110 Ca -0.01 -0.11 -0.39 0.00 -0.16 0.00 0.00 57.90 57.22 2fhe n TYR 110 Cb 0.60 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.57 2fhe n TYR 110 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 2fhe s GLN 111 N -1.78 4.40 0.50 -0.72 -1.52 -1.12 -4.84 119.66 114.59 2fhe s GLN 111 Ca 0.34 0.79 0.17 0.00 -1.95 0.00 0.00 55.36 54.70 2fhe s GLN 111 Cb 0.20 -3.42 1.22 0.00 -0.22 0.00 0.00 33.01 30.79 2fhe s GLN 111 CO 0.30 0.14 2.09 -1.35 -0.25 0.00 0.00 175.29 176.23 2fhe h PRO 112 N 6.50 0.11 -0.86 2.91 0.11 -1.90 0.82 132.00 139.69 2fhe h PRO 112 Ca -0.42 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.68 2fhe h PRO 112 Cb 1.19 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 2fhe h PRO 112 CO 0.74 0.07 0.00 1.63 -0.21 0.00 0.00 178.00 180.23 2fhe n LYS 113 N -4.49 2.28 -0.40 1.05 4.76 -1.26 -4.53 118.16 115.56 2fhe n LYS 113 Ca 0.02 -1.04 -0.07 0.00 -2.87 0.00 0.00 58.31 54.35 2fhe n LYS 113 Cb 0.22 -1.75 -0.04 0.00 -1.84 0.00 0.00 35.03 31.62 2fhe n LYS 113 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 2fhe h PHE 114 N 1.31 -1.54 -1.06 2.13 3.57 -0.98 0.20 116.94 120.57 2fhe h PHE 114 Ca 0.00 0.12 0.31 0.00 3.53 0.00 0.00 57.97 61.93 2fhe h PHE 114 Cb 0.99 0.81 -0.13 0.00 2.79 0.00 0.00 35.95 40.42 2fhe h PHE 114 CO 0.36 -0.39 0.64 0.93 -2.23 0.00 0.00 178.31 177.62 2fhe h GLU 115 N -0.00 0.36 0.02 1.11 4.39 -1.85 0.44 114.58 119.04 2fhe h GLU 115 Ca 0.24 -0.02 -0.07 0.00 0.34 0.00 0.00 59.36 59.85 2fhe h GLU 115 Cb 0.50 -0.08 0.01 0.00 -0.10 0.00 0.00 28.75 29.07 2fhe h GLU 115 CO -0.96 0.24 -0.27 1.96 -1.16 0.00 0.00 179.01 178.81 2fhe h GLN 116 N 0.37 0.15 -0.43 2.33 7.50 -1.03 -3.32 115.11 120.68 2fhe h GLN 116 Ca 0.69 -0.19 -0.03 0.00 0.50 0.00 0.00 58.65 59.63 2fhe h GLN 116 Cb 1.66 0.06 -0.02 0.00 0.05 0.00 0.00 27.48 29.23 2fhe h GLN 116 CO -0.48 0.98 0.16 -0.07 -1.50 0.00 0.00 178.83 177.92 2fhe h LEU 117 N -0.59 0.56 -0.88 1.46 3.38 0.14 -3.14 115.31 116.24 2fhe h LEU 117 Ca -0.04 -0.06 0.23 0.00 0.09 0.00 0.00 57.88 58.10 2fhe h LEU 117 Cb 1.09 -0.14 -0.14 0.00 0.09 0.00 0.00 40.66 41.55 2fhe h LEU 117 CO 0.05 0.52 0.24 0.50 0.09 0.00 0.00 178.44 179.84 2fhe h LYS 118 N 0.61 0.21 -0.34 1.13 3.64 -0.29 -1.75 116.57 119.77 2fhe h LYS 118 Ca 0.15 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.51 2fhe h LYS 118 Cb 0.14 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 2fhe h LYS 118 CO -0.01 0.14 0.19 0.93 -2.27 0.00 0.00 179.45 178.43 2fhe h GLU 119 N 0.21 0.47 -0.67 1.90 4.39 -1.73 -0.88 114.58 118.27 2fhe h GLU 119 Ca 0.55 -0.05 -0.08 0.00 0.34 0.00 0.00 59.36 60.13 2fhe h GLU 119 Cb 1.11 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 29.64 2fhe h GLU 119 CO -0.65 0.38 0.12 0.78 -1.16 0.00 0.00 179.01 178.47 2fhe h GLY 120 N 0.43 1.18 0.96 -3.84 0.00 -1.52 -2.22 103.07 98.07 2fhe h GLY 120 Ca 0.12 -0.78 -0.01 0.00 0.00 0.00 0.00 47.33 46.66 2fhe h GLY 120 CO -0.02 0.72 0.20 -1.82 0.00 0.00 0.00 176.54 175.62 2fhe h TYR 121 N 1.03 0.55 0.00 5.60 3.20 -1.17 -2.56 116.97 123.61 2fhe h TYR 121 Ca 0.21 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.01 2fhe h TYR 121 Cb 0.43 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.52 2fhe h TYR 121 CO 0.03 0.44 -0.21 -0.07 -1.64 0.00 0.00 178.16 176.72 2fhe h LEU 122 N 0.49 0.00 -0.66 2.82 3.38 -1.02 -1.29 115.31 119.03 2fhe h LEU 122 Ca 0.13 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.96 2fhe h LEU 122 Cb 0.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2fhe h LEU 122 CO -0.02 0.21 -0.60 0.50 0.09 0.00 0.00 178.44 178.62 2fhe h LYS 123 N 0.00 0.22 0.00 1.13 1.63 -1.00 -3.25 116.57 115.31 2fhe h LYS 123 Ca -0.00 -0.15 -0.08 0.00 -0.85 0.00 0.00 60.65 59.57 2fhe h LYS 123 Cb 0.48 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.12 2fhe h LYS 123 CO 0.03 0.76 -1.31 -0.25 -3.45 0.00 0.00 179.45 175.23 2fhe n ASP 124 N -3.87 0.74 -0.27 4.20 8.00 -0.96 -4.49 116.55 119.90 2fhe n ASP 124 Ca -0.02 0.30 0.01 0.00 0.71 0.00 0.00 54.79 55.79 2fhe n ASP 124 Cb 0.61 0.52 0.08 0.00 -0.02 0.00 0.00 41.12 42.31 2fhe n ASP 124 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 2fhe h LEU 125 N 0.00 -0.81 -0.82 0.64 5.85 -1.28 -2.07 115.31 116.82 2fhe h LEU 125 Ca -0.08 0.24 0.19 0.00 0.84 0.00 0.00 57.88 59.07 2fhe h LEU 125 Cb 1.26 0.51 -0.12 0.00 0.37 0.00 0.00 40.66 42.68 2fhe h LEU 125 CO 0.02 -0.27 0.30 -0.65 -0.34 0.00 0.00 178.44 177.50 2fhe h PRO 126 N -0.02 0.34 -0.66 5.25 0.11 -1.79 -0.57 132.00 134.66 2fhe h PRO 126 Ca 0.36 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 66.40 2fhe h PRO 126 Cb 0.57 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 31.57 2fhe h PRO 126 CO -0.80 0.23 0.23 1.15 -0.21 0.00 0.00 178.00 178.61 2fhe h THR 127 N 0.35 1.25 -0.37 -1.15 2.02 -1.68 -1.51 112.91 111.83 2fhe h THR 127 Ca 0.49 -0.81 -0.02 0.00 0.77 0.00 0.00 66.41 66.84 2fhe h THR 127 Cb 0.88 0.53 -0.02 0.00 -1.74 0.00 0.00 68.15 67.80 2fhe h THR 127 CO -0.51 0.32 0.14 0.74 0.37 0.00 0.00 175.52 176.58 2fhe h THR 128 N 0.95 1.19 -0.78 3.16 2.02 -1.10 -1.63 112.91 116.72 2fhe h THR 128 Ca 0.22 -0.60 -0.04 0.00 0.77 0.00 0.00 66.41 66.76 2fhe h THR 128 Cb 0.25 0.90 -0.03 0.00 -1.74 0.00 0.00 68.15 67.53 2fhe h THR 128 CO -0.01 0.21 0.33 0.24 0.37 0.00 0.00 175.52 176.66 2fhe h MET 129 N 0.45 1.16 -0.77 6.66 2.86 -1.03 -2.15 114.93 122.10 2fhe h MET 129 Ca 0.12 -0.20 -0.03 0.00 -2.06 0.00 0.00 59.70 57.53 2fhe h MET 129 Cb 0.20 -0.19 -0.03 0.00 0.06 0.00 0.00 31.60 31.63 2fhe h MET 129 CO -0.01 0.93 0.35 -0.22 1.06 0.00 0.00 176.91 179.02 2fhe h LYS 130 N 1.12 1.13 -0.74 1.72 3.64 -1.07 0.24 116.57 122.61 2fhe h LYS 130 Ca 0.26 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2fhe h LYS 130 Cb 0.19 -0.20 -0.04 0.00 -0.41 0.00 0.00 32.23 31.78 2fhe h LYS 130 CO -0.02 0.89 0.47 1.98 -2.27 0.00 0.00 179.45 180.50 2fhe h MET 131 N 1.10 0.99 -0.16 1.90 4.05 -0.83 0.22 114.93 122.20 2fhe h MET 131 Ca 0.26 -0.07 -0.19 0.00 -0.28 0.00 0.00 59.70 59.42 2fhe h MET 131 Cb 0.15 -0.22 0.00 0.00 -0.80 0.00 0.00 31.60 30.73 2fhe h MET 131 CO -0.03 0.67 -0.68 -1.49 0.23 0.00 0.00 176.91 175.62 2fhe h TRP 132 N 1.01 0.82 -0.61 1.39 4.06 -0.93 -1.53 115.95 120.16 2fhe h TRP 132 Ca 0.27 -0.34 -0.03 0.00 2.06 0.00 0.00 58.89 60.85 2fhe h TRP 132 Cb -0.09 -0.14 -0.03 0.00 -1.00 0.00 0.00 29.16 27.91 2fhe h TRP 132 CO -0.02 1.12 0.25 1.03 -3.56 0.00 0.00 178.44 177.27 2fhe h SER 133 N 0.45 0.84 -0.38 -3.49 0.87 -0.06 -0.35 113.55 111.44 2fhe h SER 133 Ca -0.02 -0.16 -0.12 0.00 -1.23 0.00 0.00 61.79 60.26 2fhe h SER 133 Cb 1.26 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 62.99 2fhe h SER 133 CO 0.13 0.77 -0.19 0.44 -0.53 0.00 0.00 176.83 177.46 2fhe h ASP 134 N 0.85 0.87 -0.37 6.23 3.32 -0.51 -1.67 116.42 125.14 2fhe h ASP 134 Ca 0.21 -0.31 -0.04 0.00 0.02 0.00 0.00 57.03 56.90 2fhe h ASP 134 Cb 0.19 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 2fhe h ASP 134 CO -0.02 1.04 0.06 0.15 -1.72 0.00 0.00 179.24 178.75 2fhe h PHE 135 N 0.76 0.65 -0.58 4.55 3.57 -0.83 -3.08 116.94 121.97 2fhe h PHE 135 Ca 0.11 -0.09 -0.09 0.00 3.53 0.00 0.00 57.97 61.43 2fhe h PHE 135 Cb 0.72 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.26 2fhe h PHE 135 CO 0.04 0.66 0.03 1.25 -2.23 0.00 0.00 178.31 178.06 2fhe h LEU 136 N 0.45 0.98 0.00 0.59 5.85 -0.98 -3.47 115.31 118.72 2fhe h LEU 136 Ca 0.11 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.54 2fhe h LEU 136 Cb 0.37 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.13 2fhe h LEU 136 CO 0.01 1.03 0.00 0.61 -0.34 0.00 0.00 178.44 179.75 2fhe n GLY 137 N -0.45 3.24 0.27 3.75 0.00 -0.64 -2.01 105.19 109.36 2fhe n GLY 137 Ca 0.02 -0.15 0.13 0.00 0.00 0.00 0.00 46.02 46.02 2fhe n GLY 137 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2fhe n LYS 138 N 14.00 0.93 -2.10 1.61 5.02 -1.26 -4.94 118.16 131.42 2fhe n LYS 138 Ca 0.00 -0.55 -0.37 0.00 -2.02 0.00 0.00 58.31 55.37 2fhe n LYS 138 Cb 0.00 -1.49 0.01 0.00 -0.02 0.00 0.00 35.03 33.53 2fhe n LYS 138 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2fhe s ASN 139 N -2.44 5.84 0.22 4.39 0.01 -0.85 -4.93 114.94 117.17 2fhe s ASN 139 Ca 0.26 2.44 0.04 0.00 -0.71 0.00 0.00 52.86 54.89 2fhe s ASN 139 Cb 0.19 -2.61 0.18 0.00 0.41 0.00 0.00 41.25 39.42 2fhe s ASN 139 CO 0.50 -1.15 1.51 -0.65 -1.51 0.00 0.00 177.10 175.79 2fhe h PRO 140 N 1.79 0.21 -4.83 -0.60 0.11 -1.87 -3.46 132.00 123.35 2fhe h PRO 140 Ca -0.50 -0.17 -0.29 0.00 0.11 0.00 0.00 66.00 65.15 2fhe h PRO 140 Cb 1.27 0.03 -0.15 0.00 0.11 0.00 0.00 31.00 32.26 2fhe h PRO 140 CO 0.59 0.81 -0.67 0.71 -0.21 0.00 0.00 178.00 179.23 2fhe s TYR 141 N -3.59 1.20 0.55 0.65 2.02 -0.74 -4.88 117.35 112.56 2fhe s TYR 141 Ca -0.03 -0.97 0.29 0.00 -0.37 0.00 0.00 57.07 55.98 2fhe s TYR 141 Cb 0.11 -0.68 1.46 0.00 -0.40 0.00 0.00 41.96 42.45 2fhe s TYR 141 CO 0.80 -0.16 1.94 -0.07 -1.57 0.00 0.00 175.55 176.49 2fhe h LEU 142 N 2.72 0.00 -2.95 -1.29 3.38 -1.88 -2.16 115.31 113.14 2fhe h LEU 142 Ca -0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.60 2fhe h LEU 142 Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 2fhe h LEU 142 CO 0.63 0.00 0.00 0.54 0.09 0.00 0.00 178.44 179.70 2fhe n ARG 143 N -4.16 2.88 0.00 1.13 1.74 -1.26 -4.95 116.66 112.03 2fhe n ARG 143 Ca 0.13 -1.90 0.00 0.00 -0.77 0.00 0.00 57.85 55.31 2fhe n ARG 143 Cb 0.75 -1.20 0.00 0.00 -1.02 0.00 0.00 32.46 30.99 2fhe n ARG 143 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2fhe n GLY 144 N 0.04 0.42 0.01 -0.13 0.00 -0.81 -4.79 105.19 99.93 2fhe n GLY 144 Ca 0.08 -1.13 0.11 0.00 0.00 0.00 0.00 46.02 45.08 2fhe n GLY 144 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2fhe n THR 145 N 0.00 0.05 -4.66 2.61 -2.24 -1.26 -1.79 114.28 106.99 2fhe n THR 145 Ca 0.00 -0.06 -0.34 0.00 -2.27 0.00 0.00 64.05 61.38 2fhe n THR 145 Cb 0.00 0.44 -0.12 0.00 -2.10 0.00 0.00 70.33 68.55 2fhe n THR 145 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2fhe s SER 146 N -3.24 4.50 0.54 3.42 0.01 -1.26 -4.86 113.70 112.81 2fhe s SER 146 Ca 0.08 -0.09 -0.19 0.00 1.31 0.00 0.00 55.95 57.07 2fhe s SER 146 Cb 0.16 -1.22 -0.06 0.00 0.21 0.00 0.00 66.02 65.12 2fhe s SER 146 CO 0.77 0.32 1.08 -0.69 0.41 0.00 0.00 173.24 175.13 2fhe s VAL 147 N -0.57 3.53 0.30 3.43 1.01 -1.26 -4.59 120.40 122.26 2fhe s VAL 147 Ca 0.08 0.89 -0.09 0.00 0.00 0.00 0.00 61.98 62.87 2fhe s VAL 147 Cb -0.12 -3.35 0.01 0.00 0.00 0.00 0.00 36.38 32.91 2fhe s VAL 147 CO 0.02 -0.27 0.51 -0.94 0.00 0.00 0.00 175.10 174.42 2fhe s SER 148 N -2.10 0.30 0.50 3.32 1.04 -1.26 -5.05 113.70 110.46 2fhe s SER 148 Ca 0.68 -1.17 0.22 0.00 0.48 0.00 0.00 55.95 56.16 2fhe s SER 148 Cb -0.19 0.65 1.29 0.00 0.10 0.00 0.00 66.02 67.86 2fhe s SER 148 CO 0.27 -1.27 1.99 1.12 0.98 0.00 0.00 173.24 176.34 2fhe h HIS 149 N 2.17 0.13 -0.22 5.02 2.07 -1.96 -1.86 115.15 120.50 2fhe h HIS 149 Ca -0.28 0.00 -0.05 0.00 -2.85 0.00 0.00 60.37 57.19 2fhe h HIS 149 Cb 1.25 -0.04 -0.01 0.00 2.57 0.00 0.00 27.41 31.17 2fhe h HIS 149 CO 0.93 0.05 -0.10 -0.39 -3.07 0.00 0.00 177.93 175.35 2fhe h VAL 150 N 0.12 1.19 -0.82 6.12 -1.51 -1.96 -2.56 116.25 116.83 2fhe h VAL 150 Ca 0.25 -0.84 -0.03 0.00 -1.23 0.00 0.00 66.70 64.85 2fhe h VAL 150 Cb 0.85 1.15 -0.04 0.00 -2.13 0.00 0.00 31.29 31.12 2fhe h VAL 150 CO -0.03 0.27 0.38 0.44 -1.23 0.00 0.00 177.57 177.41 2fhe h ASP 151 N 0.33 1.07 0.65 4.19 3.32 -1.75 -1.16 116.42 123.08 2fhe h ASP 151 Ca 0.07 -0.14 -0.09 0.00 0.02 0.00 0.00 57.03 56.89 2fhe h ASP 151 Cb 0.39 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 2fhe h ASP 151 CO 0.02 0.91 -0.43 -0.26 -1.72 0.00 0.00 179.24 177.76 2fhe h PHE 152 N 1.16 0.00 0.27 4.55 0.04 -1.54 0.12 116.94 121.54 2fhe h PHE 152 Ca 0.28 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 61.04 2fhe h PHE 152 Cb 0.13 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.28 2fhe h PHE 152 CO 0.01 0.43 -0.13 0.52 -0.60 0.00 0.00 178.31 178.54 2fhe h MET 153 N 0.00 -0.35 -0.71 1.51 2.86 -1.03 -2.40 114.93 114.81 2fhe h MET 153 Ca -0.00 0.02 -0.05 0.00 -2.06 0.00 0.00 59.70 57.61 2fhe h MET 153 Cb 0.87 0.08 -0.03 0.00 0.06 0.00 0.00 31.60 32.58 2fhe h MET 153 CO 0.06 -0.01 0.23 0.28 1.06 0.00 0.00 176.91 178.53 2fhe h VAL 154 N -0.80 1.26 -0.04 -2.22 2.07 -1.18 -1.64 116.25 113.69 2fhe h VAL 154 Ca -0.04 -0.87 0.02 0.00 0.82 0.00 0.00 66.70 66.63 2fhe h VAL 154 Cb 0.51 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 2fhe h VAL 154 CO 0.06 0.34 -0.08 0.22 0.02 0.00 0.00 177.57 178.14 2fhe h TYR 155 N 1.04 -0.19 -0.91 1.57 3.20 -0.81 -0.05 116.97 120.82 2fhe h TYR 155 Ca 0.23 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.10 2fhe h TYR 155 Cb 0.29 0.09 -0.04 0.00 1.54 0.00 0.00 36.73 38.60 2fhe h TYR 155 CO 0.02 -0.12 0.54 1.49 -1.64 0.00 0.00 178.16 178.46 2fhe h GLU 156 N -0.11 1.24 -0.56 1.82 4.57 -1.25 -0.32 114.58 119.97 2fhe h GLU 156 Ca 0.05 -0.11 -0.04 0.00 -1.18 0.00 0.00 59.36 58.07 2fhe h GLU 156 Cb 0.18 -0.26 -0.02 0.00 -0.16 0.00 0.00 28.75 28.49 2fhe h GLU 156 CO -0.11 0.87 0.18 0.00 -1.18 0.00 0.00 179.01 178.76 2fhe h ALA 157 N 1.30 0.73 -0.39 2.92 0.00 -0.83 -1.32 119.26 121.67 2fhe h ALA 157 Ca 0.33 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 2fhe h ALA 157 Cb -0.05 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2fhe h ALA 157 CO -0.06 0.39 -0.14 -0.07 0.00 0.00 0.00 179.25 179.37 2fhe h LEU 158 N 0.78 0.80 -1.08 0.00 3.38 -0.73 -2.22 115.31 116.23 2fhe h LEU 158 Ca 0.18 -0.38 -0.00 0.00 0.09 0.00 0.00 57.88 57.76 2fhe h LEU 158 Cb 0.28 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 2fhe h LEU 158 CO -0.01 1.00 0.54 -0.78 0.09 0.00 0.00 178.44 179.28 2fhe h ASP 159 N 0.59 1.02 -0.42 -0.43 3.58 -0.89 -0.68 116.42 119.19 2fhe h ASP 159 Ca 0.09 -0.05 -0.08 0.00 0.42 0.00 0.00 57.03 57.41 2fhe h ASP 159 Cb 0.68 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 41.46 2fhe h ASP 159 CO 0.05 0.77 -0.07 0.00 -2.88 0.00 0.00 179.24 177.11 2fhe h ALA 160 N 1.41 0.58 -0.34 -0.78 0.00 -1.10 -3.08 119.26 115.94 2fhe h ALA 160 Ca 0.31 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 2fhe h ALA 160 Cb -0.08 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 2fhe h ALA 160 CO -0.06 0.43 -0.17 0.82 0.00 0.00 0.00 179.25 180.27 2fhe h ILE 161 N 0.62 1.26 0.00 0.00 2.04 -1.01 -2.14 117.51 118.27 2fhe h ILE 161 Ca 0.11 -1.18 0.00 0.00 1.00 0.00 0.00 64.86 64.79 2fhe h ILE 161 Cb 0.59 1.17 0.00 0.00 -0.74 0.00 0.00 36.82 37.84 2fhe h ILE 161 CO 0.03 0.39 0.00 -2.11 0.00 0.00 0.00 178.15 176.47 2fhe n ARG 162 N -4.15 0.09 0.11 2.37 1.85 -0.30 -0.53 116.66 116.10 2fhe n ARG 162 Ca 0.01 0.48 -0.01 0.00 -1.00 0.00 0.00 57.85 57.32 2fhe n ARG 162 Cb 0.37 -1.73 -0.03 0.00 -1.05 0.00 0.00 32.46 30.03 2fhe n ARG 162 CO 0.00 0.00 0.00 1.88 -0.01 0.00 0.00 177.63 179.50 2fhe h TYR 163 N 0.00 0.00 0.11 2.89 0.05 -1.39 -2.63 116.97 116.01 2fhe h TYR 163 Ca 0.00 0.00 -0.31 0.00 0.05 0.00 0.00 58.73 58.47 2fhe h TYR 163 Cb 0.13 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.86 2fhe h TYR 163 CO 0.00 0.68 -1.66 1.25 -1.05 0.00 0.00 178.16 177.38 2fhe h LEU 164 N 0.00 0.37 -6.82 3.88 5.85 -0.88 -3.43 115.31 114.28 2fhe h LEU 164 Ca -0.01 -0.85 -0.60 0.00 0.84 0.00 0.00 57.88 57.26 2fhe h LEU 164 Cb 1.53 -0.12 -0.40 0.00 0.37 0.00 0.00 40.66 42.04 2fhe h LEU 164 CO 0.09 1.72 -0.79 -0.70 -0.34 0.00 0.00 178.44 178.42 2fhe s GLU 165 N -2.50 0.98 0.59 1.25 -6.30 -0.08 -5.01 118.70 107.63 2fhe s GLU 165 Ca -0.22 -1.73 0.29 0.00 -2.50 0.00 0.00 54.97 50.81 2fhe s GLU 165 Cb 0.06 -1.90 1.49 0.00 0.00 0.00 0.00 34.13 33.77 2fhe s GLU 165 CO 0.75 -1.18 1.91 -1.35 0.02 0.00 0.00 175.26 175.40 2fhe h PRO 166 N 6.84 0.00 -0.62 4.30 0.11 -1.71 -1.43 132.00 139.49 2fhe h PRO 166 Ca 0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.13 2fhe h PRO 166 Cb 0.94 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.05 2fhe h PRO 166 CO 0.39 0.00 0.00 0.72 -0.21 0.00 0.00 178.00 178.90 2fhe n HIS 167 N -3.69 1.23 0.28 0.65 8.25 -1.26 -4.53 115.22 116.15 2fhe n HIS 167 Ca 0.08 -0.59 0.13 0.00 -0.26 0.00 0.00 57.72 57.08 2fhe n HIS 167 Cb 0.64 -0.17 0.80 0.00 1.12 0.00 0.00 29.99 32.39 2fhe n HIS 167 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2fhe n LEU 169 N -3.91 1.83 -0.27 0.00 4.77 -1.26 -4.56 117.00 113.59 2fhe n LEU 169 Ca -0.03 -0.70 0.08 0.00 -0.03 0.00 0.00 56.01 55.34 2fhe n LEU 169 Cb 0.14 -0.01 0.21 0.00 -2.33 0.00 0.00 43.42 41.43 2fhe n LEU 169 CO 0.30 0.35 0.89 0.44 -1.33 0.00 0.00 177.39 178.03 2fhe h ASP 170 N 1.99 -0.15 -0.19 -1.43 5.19 -1.70 0.16 116.42 120.29 2fhe h ASP 170 Ca 0.00 0.19 0.00 0.00 -0.62 0.00 0.00 57.03 56.60 2fhe h ASP 170 Cb 0.71 0.29 0.00 0.00 0.18 0.00 0.00 39.33 40.51 2fhe h ASP 170 CO 0.00 -0.15 0.00 1.41 -3.12 0.00 0.00 179.24 177.38 2fhe n HIS 171 N -5.27 0.25 -3.58 4.55 8.25 -1.26 -4.42 115.22 113.74 2fhe n HIS 171 Ca 0.17 -0.12 -0.27 0.00 -0.26 0.00 0.00 57.72 57.23 2fhe n HIS 171 Cb 0.55 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.56 2fhe n HIS 171 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 2fhe n PHE 172 N 0.10 1.24 -0.27 4.41 3.72 0.56 -4.98 117.46 122.24 2fhe n PHE 172 Ca 0.11 -3.82 0.14 0.00 -0.05 0.00 0.00 57.45 53.83 2fhe n PHE 172 Cb 0.22 -0.23 0.40 0.00 -0.94 0.00 0.00 39.48 38.94 2fhe n PHE 172 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 2fhe h PRO 173 N 5.23 0.61 -0.22 -1.08 0.11 -1.77 -2.00 132.00 132.88 2fhe h PRO 173 Ca 0.20 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 66.19 2fhe h PRO 173 Cb 0.82 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.78 2fhe h PRO 173 CO 0.56 0.41 -0.21 -2.95 -0.21 0.00 0.00 178.00 175.60 2fhe h ASN 174 N 0.63 0.38 0.07 -2.05 -0.00 -1.92 -0.86 115.58 111.83 2fhe h ASN 174 Ca 0.47 -0.11 -0.14 0.00 -0.00 0.00 0.00 56.30 56.52 2fhe h ASN 174 Cb 0.85 -0.10 -0.01 0.00 -0.00 0.00 0.00 38.32 39.06 2fhe h ASN 174 CO -0.22 0.60 -0.46 -0.07 -0.00 0.00 0.00 177.43 177.28 2fhe h LEU 175 N 0.35 0.51 -0.32 6.14 3.38 -1.72 -0.62 115.31 123.02 2fhe h LEU 175 Ca 0.06 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.74 2fhe h LEU 175 Cb 0.57 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 2fhe h LEU 175 CO 0.04 0.90 -0.00 1.56 0.09 0.00 0.00 178.44 181.02 2fhe h GLN 176 N 0.38 0.57 -0.42 1.13 4.20 -1.17 -1.84 115.11 117.96 2fhe h GLN 176 Ca 0.02 -0.18 -0.08 0.00 0.06 0.00 0.00 58.65 58.47 2fhe h GLN 176 Cb 0.96 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.67 2fhe h GLN 176 CO 0.08 0.70 -0.08 1.96 -0.67 0.00 0.00 178.83 180.83 2fhe h GLN 177 N 0.37 0.73 -0.38 1.46 4.20 -1.03 -2.39 115.11 118.08 2fhe h GLN 177 Ca 0.09 -0.22 0.04 0.00 0.06 0.00 0.00 58.65 58.61 2fhe h GLN 177 Cb 0.45 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.12 2fhe h GLN 177 CO 0.02 0.80 0.16 0.35 -0.67 0.00 0.00 178.83 179.49 2fhe h PHE 178 N 0.67 0.30 -0.43 2.96 3.57 -0.86 0.22 116.94 123.37 2fhe h PHE 178 Ca 0.12 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.66 2fhe h PHE 178 Cb 0.53 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 39.16 2fhe h PHE 178 CO 0.03 0.14 0.25 0.52 -2.23 0.00 0.00 178.31 177.01 2fhe h MET 179 N 0.34 0.48 -0.56 1.11 2.86 -1.01 -1.91 114.93 116.25 2fhe h MET 179 Ca 0.17 -0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.71 2fhe h MET 179 Cb 0.11 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 2fhe h MET 179 CO -0.15 0.32 0.07 0.77 1.06 0.00 0.00 176.91 178.98 2fhe h SER 180 N 0.50 0.91 -0.67 1.22 0.02 -0.93 -2.42 113.55 112.18 2fhe h SER 180 Ca 0.17 -0.27 0.04 0.00 -0.84 0.00 0.00 61.79 60.90 2fhe h SER 180 Cb 0.02 -0.24 -0.05 0.00 0.14 0.00 0.00 62.40 62.27 2fhe h SER 180 CO -0.09 0.95 0.39 -0.09 -1.14 0.00 0.00 176.83 176.86 2fhe h ARG 181 N 0.83 0.73 -0.37 3.45 2.43 -0.21 -0.42 114.38 120.82 2fhe h ARG 181 Ca 0.17 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.24 2fhe h ARG 181 Cb 0.44 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 2fhe h ARG 181 CO 0.02 0.48 0.04 0.82 -1.51 0.00 0.00 179.97 179.82 2fhe h ILE 182 N 0.75 1.25 0.00 1.20 1.08 -1.22 -2.72 117.51 117.85 2fhe h ILE 182 Ca 0.29 -0.90 0.00 0.00 -0.39 0.00 0.00 64.86 63.86 2fhe h ILE 182 Cb 0.11 1.11 0.00 0.00 -3.07 0.00 0.00 36.82 34.96 2fhe h ILE 182 CO -0.14 0.30 0.00 -0.33 -0.69 0.00 0.00 178.15 177.29 2fhe h GLU 183 N 0.46 0.00 -0.00 2.37 5.08 -0.92 -2.54 114.58 119.03 2fhe h GLU 183 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 2fhe h GLU 183 Cb 0.39 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.64 2fhe h GLU 183 CO 0.01 0.00 -0.47 0.00 -1.00 0.00 0.00 179.01 177.55 2fhe n ALA 184 N -1.84 3.53 -1.86 3.43 0.00 -0.21 -3.76 120.51 119.80 2fhe n ALA 184 Ca 0.02 -0.42 -0.42 0.00 0.00 0.00 0.00 53.44 52.61 2fhe n ALA 184 Cb 0.24 -1.05 -0.03 0.00 0.00 0.00 0.00 19.45 18.61 2fhe n ALA 184 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2fhe s LEU 185 N -2.78 4.37 0.24 0.00 1.43 -0.96 -4.81 118.68 116.18 2fhe s LEU 185 Ca 0.16 2.68 -0.08 0.00 -1.03 0.00 0.00 54.13 55.86 2fhe s LEU 185 Cb 0.18 -3.59 0.42 0.00 0.03 0.00 0.00 46.19 43.23 2fhe s LEU 185 CO 0.65 -0.89 1.63 -0.65 0.23 0.00 0.00 176.35 177.32 2fhe h PRO 186 N 7.15 0.08 -0.12 1.29 0.11 -1.90 0.16 132.00 138.77 2fhe h PRO 186 Ca -0.43 -0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.56 2fhe h PRO 186 Cb 1.20 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2fhe h PRO 186 CO 0.93 0.05 -0.44 0.66 -0.21 0.00 0.00 178.00 178.99 2fhe h SER 187 N 0.08 0.31 -0.02 -2.05 4.64 -1.90 -2.38 113.55 112.25 2fhe h SER 187 Ca 0.40 -0.14 -0.04 0.00 -0.47 0.00 0.00 61.79 61.55 2fhe h SER 187 Cb 0.70 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 2fhe h SER 187 CO -0.68 0.72 -0.13 0.40 -0.87 0.00 0.00 176.83 176.27 2fhe h ILE 188 N 0.24 1.52 -0.63 0.95 1.08 -1.57 -2.36 117.51 116.75 2fhe h ILE 188 Ca 0.02 -1.71 0.09 0.00 -0.39 0.00 0.00 64.86 62.86 2fhe h ILE 188 Cb 0.88 2.60 -0.07 0.00 -3.07 0.00 0.00 36.82 37.16 2fhe h ILE 188 CO 0.07 0.46 0.26 0.50 -0.69 0.00 0.00 178.15 178.75 2fhe h LYS 189 N -0.52 0.45 -0.42 2.37 3.64 -0.74 0.93 116.57 122.27 2fhe h LYS 189 Ca -0.01 -0.03 -0.11 0.00 -1.27 0.00 0.00 60.65 59.24 2fhe h LYS 189 Cb 0.82 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.53 2fhe h LYS 189 CO 0.03 0.29 -0.17 0.00 -2.27 0.00 0.00 179.45 177.33 2fhe h ALA 190 N 1.41 0.92 -0.49 5.00 0.00 -1.47 -2.55 119.26 122.07 2fhe h ALA 190 Ca 0.31 -0.35 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 2fhe h ALA 190 Cb 0.36 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2fhe h ALA 190 CO -0.29 0.62 -0.16 -0.92 0.00 0.00 0.00 179.25 178.50 2fhe h TYR 191 N 0.71 1.11 0.00 0.00 3.20 -0.75 -2.35 116.97 118.88 2fhe h TYR 191 Ca 0.11 -0.25 0.00 0.00 3.14 0.00 0.00 58.73 61.73 2fhe h TYR 191 Cb 0.67 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 38.67 2fhe h TYR 191 CO 0.04 1.06 0.00 0.52 -1.64 0.00 0.00 178.16 178.14 2fhe h MET 192 N 0.83 0.00 -0.01 1.82 2.86 -0.70 -1.77 114.93 117.96 2fhe h MET 192 Ca 0.12 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 2fhe h MET 192 Cb 0.73 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.39 2fhe h MET 192 CO 0.06 0.00 -0.51 0.39 1.06 0.00 0.00 176.91 177.91 2fhe n GLU 193 N -2.47 0.97 -2.18 1.72 1.02 -0.97 -4.91 120.64 113.80 2fhe n GLU 193 Ca 0.01 -0.77 -0.27 0.00 -0.02 0.00 0.00 57.16 56.11 2fhe n GLU 193 Cb 0.23 -1.48 0.15 0.00 -0.02 0.00 0.00 31.44 30.32 2fhe n GLU 193 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2fhe s SER 194 N -2.56 3.69 0.00 1.62 1.04 -0.66 -4.98 113.70 111.84 2fhe s SER 194 Ca 0.18 0.06 0.21 0.00 0.48 0.00 0.00 55.95 56.87 2fhe s SER 194 Cb 0.18 -0.26 0.54 0.00 0.10 0.00 0.00 66.02 66.57 2fhe s SER 194 CO 0.61 -2.34 1.44 -0.46 0.98 0.00 0.00 173.24 173.47 2fhe n ASN 195 N -3.37 2.80 0.08 7.02 6.94 -1.26 -3.75 115.26 123.71 2fhe n ASN 195 Ca 0.15 -1.92 0.09 0.00 -0.02 0.00 0.00 54.58 52.88 2fhe n ASN 195 Cb 0.60 -0.25 -0.03 0.00 -2.36 0.00 0.00 39.78 37.74 2fhe n ASN 195 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2fhe n ARG 196 N 1.05 0.61 -2.04 -3.83 1.74 -1.26 -4.91 116.66 108.02 2fhe n ARG 196 Ca 0.18 0.12 -0.42 0.00 -0.77 0.00 0.00 57.85 56.96 2fhe n ARG 196 Cb 0.48 -1.80 -0.03 0.00 -1.02 0.00 0.00 32.46 30.09 2fhe n ARG 196 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 2fhe s PHE 197 N -3.27 2.88 -0.39 -1.55 5.36 -1.25 -4.99 117.98 114.77 2fhe s PHE 197 Ca -0.02 0.65 -0.12 0.00 -0.96 0.00 0.00 56.93 56.48 2fhe s PHE 197 Cb 0.10 -3.83 0.03 0.00 -0.34 0.00 0.00 43.02 38.97 2fhe s PHE 197 CO 0.80 -3.13 0.24 0.42 -1.46 0.00 0.00 175.22 172.09 2fhe s ILE 198 N 1.78 4.78 -0.06 3.12 1.01 -1.26 -4.94 121.20 125.63 2fhe s ILE 198 Ca 0.69 -0.83 0.13 0.00 0.00 0.00 0.00 60.65 60.64 2fhe s ILE 198 Cb -0.39 -3.68 -0.19 0.00 0.01 0.00 0.00 42.46 38.21 2fhe s ILE 198 CO 0.31 -0.28 0.78 0.50 0.00 0.00 0.00 174.94 176.25 2fhe h LYS 199 N 8.50 0.00 -2.83 2.79 3.64 -1.98 -3.45 116.57 123.25 2fhe h LYS 199 Ca -0.26 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.02 2fhe h LYS 199 Cb 1.11 0.00 -0.19 0.00 -0.41 0.00 0.00 32.23 32.73 2fhe h LYS 199 CO 0.69 0.47 -0.16 -0.46 -2.27 0.00 0.00 179.45 177.72 2fhe s TRP 200 N -2.72 -0.28 0.76 1.91 -0.11 -1.26 -4.72 118.94 112.53 2fhe s TRP 200 Ca -0.03 0.43 -0.09 0.00 1.22 0.00 0.00 56.10 57.62 2fhe s TRP 200 Cb 0.08 0.17 0.07 0.00 -1.50 0.00 0.00 33.47 32.30 2fhe s TRP 200 CO 0.82 -0.45 1.10 -1.25 -4.62 0.00 0.00 176.95 172.55 2fhe s PRO 201 N -1.43 2.04 -0.15 5.86 0.04 -1.26 -4.83 135.00 135.26 2fhe s PRO 201 Ca -0.12 -0.08 -0.27 0.00 0.04 0.00 0.00 61.00 60.58 2fhe s PRO 201 Cb -0.04 -2.05 -0.25 0.00 0.04 0.00 0.00 34.50 32.21 2fhe s PRO 201 CO 0.05 -1.45 0.64 -0.07 0.04 0.00 0.00 177.00 176.21 2fhe h LEU 202 N -0.85 0.02 0.00 -3.56 3.38 -1.53 -1.04 115.31 111.73 2fhe h LEU 202 Ca -0.45 -0.88 0.00 0.00 0.09 0.00 0.00 57.88 56.64 2fhe h LEU 202 Cb 1.32 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.06 2fhe h LEU 202 CO 0.63 1.14 0.00 0.59 0.09 0.00 0.00 178.44 180.89 2fhe n ASN 203 N -4.54 0.65 -4.75 -0.43 3.02 -0.55 -0.38 115.26 108.29 2fhe n ASN 203 Ca -0.16 -0.93 -0.34 0.00 -0.03 0.00 0.00 54.58 53.12 2fhe n ASN 203 Cb 0.55 0.00 0.07 0.00 -0.61 0.00 0.00 39.78 39.78 2fhe n ASN 203 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2fhe s GLY 204 N -1.60 2.33 0.53 7.41 0.00 -1.26 -4.67 107.32 110.05 2fhe s GLY 204 Ca 0.00 0.76 0.26 0.00 0.00 0.00 0.00 44.72 45.75 2fhe s GLY 204 CO 0.00 1.15 1.97 1.49 0.00 0.00 0.00 173.10 177.70 2fhe h TRP 205 N 0.01 0.03 -0.23 1.90 6.55 -1.90 -1.85 115.95 120.48 2fhe h TRP 205 Ca -0.48 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.36 2fhe h TRP 205 Cb 1.28 -0.01 0.00 0.00 -0.86 0.00 0.00 29.16 29.57 2fhe h TRP 205 CO 0.50 0.01 0.00 -2.39 -1.05 0.00 0.00 178.44 175.51 2fhe n HIS 206 N -4.36 0.30 -2.55 0.49 1.44 -1.26 -4.35 115.22 104.94 2fhe n HIS 206 Ca 0.12 -0.15 -0.36 0.00 -2.01 0.00 0.00 57.72 55.32 2fhe n HIS 206 Cb 0.68 0.00 -0.04 0.00 0.12 0.00 0.00 29.99 30.75 2fhe n HIS 206 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2fhe s ALA 207 N -1.70 3.04 0.44 1.59 0.00 -0.69 -4.93 121.76 119.52 2fhe s ALA 207 Ca 0.18 0.68 0.14 0.00 0.00 0.00 0.00 51.96 52.95 2fhe s ALA 207 Cb 0.09 -3.27 0.99 0.00 0.00 0.00 0.00 23.12 20.93 2fhe s ALA 207 CO 0.13 -0.23 2.00 1.96 0.00 0.00 0.00 175.76 179.61 2fhe h GLN 208 N 2.28 0.06 -4.51 0.00 1.08 -0.09 -3.36 115.11 110.57 2fhe h GLN 208 Ca -0.49 -0.01 -0.35 0.00 -1.45 0.00 0.00 58.65 56.36 2fhe h GLN 208 Cb 1.22 -0.01 -0.28 0.00 -0.05 0.00 0.00 27.48 28.36 2fhe h GLN 208 CO 0.62 0.20 -0.76 0.12 -0.95 0.00 0.00 178.83 178.05 2fhe s PHE 209 N -4.72 0.63 -0.64 2.96 5.36 -1.17 -4.82 117.98 115.58 2fhe s PHE 209 Ca -0.04 -0.16 0.00 0.00 -0.96 0.00 0.00 56.93 55.76 2fhe s PHE 209 Cb 0.16 -0.40 0.00 0.00 -0.34 0.00 0.00 43.02 42.44 2fhe s PHE 209 CO 0.70 -0.02 0.00 0.41 -1.46 0.00 0.00 175.22 174.86 2fhe n GLY 210 N 2.72 0.81 0.12 13.12 0.00 -1.26 -4.69 105.19 116.01 2fhe n GLY 210 Ca -0.14 -0.41 0.09 0.00 0.00 0.00 0.00 46.02 45.56 2fhe n GLY 210 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fhe n GLY 211 N -1.66 4.67 0.00 -0.02 0.00 -1.26 -1.43 105.19 105.50 2fhe n GLY 211 Ca -0.06 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.87 2fhe n GLY 211 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fhe n GLY 212 N -1.35 -1.49 0.00 -0.02 0.00 -1.26 -4.27 105.19 96.82 2fhe n GLY 212 Ca 0.15 -1.42 0.08 0.00 0.00 0.00 0.00 46.02 44.83 2fhe n GLY 212 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2fhe n ASP 213 N 0.00 1.22 -3.79 1.61 8.00 -1.26 -4.63 116.55 117.71 2fhe n ASP 213 Ca 0.00 -0.28 -0.10 0.00 0.71 0.00 0.00 54.79 55.12 2fhe n ASP 213 Cb 0.00 1.48 -0.07 0.00 -0.02 0.00 0.00 41.12 42.50 2fhe n ASP 213 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2fhe s ALA 214 N -2.86 -0.52 0.65 2.24 0.00 -1.26 -4.89 121.76 115.12 2fhe s ALA 214 Ca -0.02 -0.22 -0.17 0.00 0.00 0.00 0.00 51.96 51.54 2fhe s ALA 214 Cb 0.10 0.40 -0.03 0.00 0.00 0.00 0.00 23.12 23.59 2fhe s ALA 214 CO 0.63 -0.45 0.98 -2.30 0.00 0.00 0.00 175.76 174.62 2fhe n PRO 215 N 0.34 0.77 0.00 0.00 -0.02 -1.26 -5.00 135.00 129.83 2fhe n PRO 215 Ca -0.17 0.31 0.14 0.00 -2.02 0.00 0.00 63.50 61.76 2fhe n PRO 215 Cb 0.61 -2.21 0.60 0.00 -0.02 0.00 0.00 33.50 32.48 2fhe n PRO 215 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13