#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hf3 n THR 2 N 0.00 0.00 -1.59 0.44 -2.24 -1.26 -4.92 114.28 104.71 1hf3 n THR 2 Ca 0.00 -0.01 -0.48 0.00 -2.27 0.00 0.00 64.05 61.29 1hf3 n THR 2 Cb 0.00 0.56 -0.04 0.00 -2.10 0.00 0.00 70.33 68.75 1hf3 n THR 2 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hf3 n ALA 3 N -1.51 -0.55 -0.47 6.98 0.00 -1.26 -0.71 120.51 123.00 1hf3 n ALA 3 Ca 0.05 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.95 1hf3 n ALA 3 Cb 0.34 -2.06 0.00 0.00 0.00 0.00 0.00 19.45 17.73 1hf3 n ALA 3 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hf3 n GLY 4 N 2.04 1.98 3.65 0.00 0.00 -1.26 -4.99 105.19 106.62 1hf3 n GLY 4 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 1hf3 n GLY 4 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hf3 s LYS 5 N -0.02 2.40 0.08 1.61 1.02 0.12 -4.88 119.74 120.07 1hf3 s LYS 5 Ca 0.00 -0.96 -0.31 0.00 0.02 0.00 0.00 55.97 54.72 1hf3 s LYS 5 Cb 0.00 -2.43 -0.09 0.00 -0.52 0.00 0.00 37.83 34.80 1hf3 s LYS 5 CO 0.00 0.51 1.65 0.08 -0.92 0.00 0.00 175.35 176.67 1hf3 s VAL 6 N -1.41 2.97 -0.12 3.17 1.01 -1.26 -4.23 120.40 120.53 1hf3 s VAL 6 Ca 0.25 0.46 -0.08 0.00 0.00 0.00 0.00 61.98 62.61 1hf3 s VAL 6 Cb -0.11 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 1hf3 s VAL 6 CO 0.17 0.00 0.17 -0.63 0.00 0.00 0.00 175.10 174.82 1hf3 s ILE 7 N 2.48 5.44 -0.28 2.22 1.01 0.08 -4.91 121.20 127.24 1hf3 s ILE 7 Ca 0.74 0.29 -0.08 0.00 0.00 0.00 0.00 60.65 61.59 1hf3 s ILE 7 Cb -0.40 -3.45 -0.02 0.00 0.01 0.00 0.00 42.46 38.59 1hf3 s ILE 7 CO 0.32 0.58 0.11 -0.54 0.00 0.00 0.00 174.94 175.42 1hf3 s LYS 8 N -0.79 3.54 0.29 2.79 1.02 -1.26 0.47 119.74 125.80 1hf3 s LYS 8 Ca 0.15 -0.56 -0.01 0.00 0.02 0.00 0.00 55.97 55.56 1hf3 s LYS 8 Cb -0.12 -3.44 0.01 0.00 -0.52 0.00 0.00 37.83 33.75 1hf3 s LYS 8 CO 0.04 -0.28 0.40 0.00 -0.92 0.00 0.00 175.35 174.59 1hf3 s LYS 10 N -2.65 3.59 0.05 0.00 -0.14 -1.26 0.53 119.74 119.87 1hf3 s LYS 10 Ca 0.24 -0.14 -0.17 0.00 -1.36 0.00 0.00 55.97 54.53 1hf3 s LYS 10 Cb -0.01 -2.81 0.03 0.00 -1.68 0.00 0.00 37.83 33.37 1hf3 s LYS 10 CO 0.17 0.40 0.39 0.00 -0.76 0.00 0.00 175.35 175.55 1hf3 s ALA 11 N -1.80 -0.92 -0.41 5.17 0.00 -0.52 -1.03 121.76 122.26 1hf3 s ALA 11 Ca 0.41 0.19 -0.19 0.00 0.00 0.00 0.00 51.96 52.37 1hf3 s ALA 11 Cb -0.11 0.39 0.01 0.00 0.00 0.00 0.00 23.12 23.41 1hf3 s ALA 11 CO 0.27 -0.47 0.56 0.00 0.00 0.00 0.00 175.76 176.11 1hf3 s ALA 12 N -2.68 3.41 -0.07 0.00 0.00 0.14 -0.26 121.76 122.29 1hf3 s ALA 12 Ca -0.04 -1.20 -0.03 0.00 0.00 0.00 0.00 51.96 50.68 1hf3 s ALA 12 Cb -0.00 -3.16 -0.04 0.00 0.00 0.00 0.00 23.12 19.92 1hf3 s ALA 12 CO -0.04 -1.56 0.10 0.08 0.00 0.00 0.00 175.76 174.34 1hf3 s VAL 13 N 2.54 5.00 -0.33 0.00 1.01 0.29 -4.34 120.40 124.57 1hf3 s VAL 13 Ca 0.19 -0.12 -0.03 0.00 0.00 0.00 0.00 61.98 62.02 1hf3 s VAL 13 Cb -0.15 -3.21 0.06 0.00 0.00 0.00 0.00 36.38 33.08 1hf3 s VAL 13 CO 0.16 0.50 0.07 -0.22 0.00 0.00 0.00 175.10 175.61 1hf3 s LEU 14 N -1.31 4.31 0.06 3.92 2.96 -0.33 -0.54 118.68 127.74 1hf3 s LEU 14 Ca 0.18 -1.41 0.01 0.00 -0.22 0.00 0.00 54.13 52.69 1hf3 s LEU 14 Cb -0.12 -1.78 -0.25 0.00 0.50 0.00 0.00 46.19 44.54 1hf3 s LEU 14 CO 0.08 -0.34 1.06 -0.50 -1.32 0.00 0.00 176.35 175.33 1hf3 h TRP 15 N 8.06 0.29 -3.17 5.38 4.06 -1.87 -1.30 115.95 127.41 1hf3 h TRP 15 Ca -0.20 -0.21 -0.06 0.00 2.06 0.00 0.00 58.89 60.48 1hf3 h TRP 15 Cb 1.06 -0.01 -0.15 0.00 -1.00 0.00 0.00 29.16 29.06 1hf3 h TRP 15 CO 0.60 1.20 -0.07 -1.83 -3.56 0.00 0.00 178.44 174.78 1hf3 s GLU 16 N -2.66 1.01 0.67 0.49 -1.05 -1.26 -4.37 118.70 111.53 1hf3 s GLU 16 Ca -0.04 -0.51 -0.17 0.00 -0.15 0.00 0.00 54.97 54.10 1hf3 s GLU 16 Cb 0.08 0.45 -0.01 0.00 -0.44 0.00 0.00 34.13 34.21 1hf3 s GLU 16 CO 0.85 -0.37 1.06 0.39 0.95 0.00 0.00 175.26 178.13 1hf3 n GLU 17 N 0.14 0.77 -3.56 -4.83 4.71 -1.26 -3.76 120.64 112.85 1hf3 n GLU 17 Ca -0.17 0.32 -0.26 0.00 -0.01 0.00 0.00 57.16 57.03 1hf3 n GLU 17 Cb 0.62 -2.29 0.03 0.00 -1.01 0.00 0.00 31.44 28.78 1hf3 n GLU 17 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1hf3 n LYS 18 N -1.67 -5.37 -4.31 3.49 5.02 0.81 -4.98 118.16 111.16 1hf3 n LYS 18 Ca 0.14 0.68 -0.17 0.00 -2.02 0.00 0.00 58.31 56.94 1hf3 n LYS 18 Cb 0.49 -5.56 -0.10 0.00 -0.02 0.00 0.00 35.03 29.84 1hf3 n LYS 18 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1hf3 s LYS 19 N -6.25 1.22 0.79 1.97 -0.14 -1.25 -5.09 119.74 110.99 1hf3 s LYS 19 Ca 0.52 -1.51 -0.13 0.00 -1.36 0.00 0.00 55.97 53.50 1hf3 s LYS 19 Cb -0.25 -0.97 0.07 0.00 -1.68 0.00 0.00 37.83 35.00 1hf3 s LYS 19 CO 0.65 0.16 1.16 -2.14 -0.76 0.00 0.00 175.35 174.41 1hf3 s PRO 20 N -3.55 1.85 0.35 -1.68 0.02 -1.26 -4.97 135.00 125.76 1hf3 s PRO 20 Ca 0.19 1.57 -0.27 0.00 0.02 0.00 0.00 61.00 62.51 1hf3 s PRO 20 Cb -0.00 -1.82 -0.09 0.00 0.02 0.00 0.00 34.50 32.61 1hf3 s PRO 20 CO 0.05 -2.02 1.15 -0.06 -0.33 0.00 0.00 177.00 175.79 1hf3 s PHE 21 N -2.37 3.24 -0.30 6.54 0.08 -1.26 -4.82 117.98 119.09 1hf3 s PHE 21 Ca 0.69 1.59 -0.10 0.00 0.12 0.00 0.00 56.93 59.23 1hf3 s PHE 21 Cb -0.24 -3.37 -0.01 0.00 -0.57 0.00 0.00 43.02 38.82 1hf3 s PHE 21 CO 0.51 -1.08 0.16 0.45 -0.10 0.00 0.00 175.22 175.15 1hf3 s SER 22 N -1.01 5.60 -0.44 1.36 0.15 0.30 -4.89 113.70 114.76 1hf3 s SER 22 Ca 0.52 -0.43 -0.29 0.00 0.70 0.00 0.00 55.95 56.45 1hf3 s SER 22 Cb -0.31 -2.02 0.02 0.00 -1.71 0.00 0.00 66.02 62.00 1hf3 s SER 22 CO 0.40 -0.17 1.22 -0.63 1.20 0.00 0.00 173.24 175.26 1hf3 s ILE 23 N 1.64 4.14 0.39 6.45 -1.09 -1.26 -0.55 121.20 130.92 1hf3 s ILE 23 Ca 0.05 1.18 0.07 0.00 -2.23 0.00 0.00 60.65 59.72 1hf3 s ILE 23 Cb -0.17 -4.46 -0.08 0.00 -1.58 0.00 0.00 42.46 36.17 1hf3 s ILE 23 CO 0.07 -0.88 0.01 -1.61 -1.23 0.00 0.00 174.94 171.30 1hf3 s GLU 24 N 4.52 1.91 -0.21 2.79 0.41 0.64 -4.94 118.70 123.81 1hf3 s GLU 24 Ca 0.52 -2.07 -0.19 0.00 -0.41 0.00 0.00 54.97 52.82 1hf3 s GLU 24 Cb -0.10 -1.54 -0.03 0.00 -1.78 0.00 0.00 34.13 30.69 1hf3 s GLU 24 CO 0.30 -0.06 0.56 -2.00 -0.49 0.00 0.00 175.26 173.57 1hf3 s GLU 25 N -3.73 4.17 0.21 1.61 2.12 -1.26 -1.44 118.70 120.38 1hf3 s GLU 25 Ca 0.35 0.46 0.09 0.00 0.36 0.00 0.00 54.97 56.24 1hf3 s GLU 25 Cb 0.09 -3.59 -0.05 0.00 0.26 0.00 0.00 34.13 30.85 1hf3 s GLU 25 CO 0.18 -0.23 -0.18 0.14 -0.54 0.00 0.00 175.26 174.62 1hf3 s VAL 26 N 1.90 2.01 -0.21 3.70 -7.23 0.19 -4.51 120.40 116.24 1hf3 s VAL 26 Ca 0.25 -2.15 -0.09 0.00 -1.81 0.00 0.00 61.98 58.18 1hf3 s VAL 26 Cb -0.16 -2.05 -0.04 0.00 0.56 0.00 0.00 36.38 34.69 1hf3 s VAL 26 CO 0.10 -0.41 0.10 -1.61 -0.31 0.00 0.00 175.10 172.96 1hf3 s GLU 27 N -3.24 3.95 -0.43 4.82 2.02 0.11 -0.17 118.70 125.76 1hf3 s GLU 27 Ca 0.22 -0.34 -0.10 0.00 0.02 0.00 0.00 54.97 54.77 1hf3 s GLU 27 Cb -0.04 -3.35 0.08 0.00 0.10 0.00 0.00 34.13 30.92 1hf3 s GLU 27 CO 0.09 0.12 0.29 0.08 0.02 0.00 0.00 175.26 175.86 1hf3 s VAL 28 N 0.83 4.35 0.82 2.63 1.01 0.18 -1.75 120.40 128.47 1hf3 s VAL 28 Ca 0.05 -1.41 -0.14 0.00 0.00 0.00 0.00 61.98 60.48 1hf3 s VAL 28 Cb -0.13 -3.68 0.04 0.00 0.00 0.00 0.00 36.38 32.61 1hf3 s VAL 28 CO 0.02 -0.55 0.84 0.00 0.00 0.00 0.00 175.10 175.42 1hf3 n ALA 29 N 4.95 -1.01 -1.47 5.51 0.00 0.29 -0.74 120.51 128.04 1hf3 n ALA 29 Ca -0.10 -0.37 -0.32 0.00 0.00 0.00 0.00 53.44 52.65 1hf3 n ALA 29 Cb 0.43 -2.04 0.06 0.00 0.00 0.00 0.00 19.45 17.89 1hf3 n ALA 29 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1hf3 s PRO 30 N -3.64 2.75 0.08 0.00 0.05 -1.26 -4.83 135.00 128.14 1hf3 s PRO 30 Ca 0.67 1.15 -0.30 0.00 0.05 0.00 0.00 61.00 62.58 1hf3 s PRO 30 Cb -0.29 -1.96 -0.05 0.00 0.05 0.00 0.00 34.50 32.25 1hf3 s PRO 30 CO 0.57 -1.26 1.06 -1.25 0.05 0.00 0.00 177.00 176.16 1hf3 s PRO 31 N -4.65 4.56 0.23 0.56 0.04 -1.26 -5.05 135.00 129.44 1hf3 s PRO 31 Ca 0.62 1.59 -0.04 0.00 0.04 0.00 0.00 61.00 63.21 1hf3 s PRO 31 Cb -0.17 -3.37 0.05 0.00 0.04 0.00 0.00 34.50 31.06 1hf3 s PRO 31 CO 0.50 -0.02 0.28 1.63 0.04 0.00 0.00 177.00 179.42 1hf3 n LYS 32 N 3.31 -0.65 -1.71 4.56 4.76 -1.26 -4.42 118.16 122.76 1hf3 n LYS 32 Ca 0.05 -0.43 -0.43 0.00 -2.87 0.00 0.00 58.31 54.63 1hf3 n LYS 32 Cb 0.48 -0.32 -0.01 0.00 -1.84 0.00 0.00 35.03 33.34 1hf3 n LYS 32 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1hf3 n ALA 33 N -3.26 1.60 -2.00 7.82 0.00 -1.26 -2.23 120.51 121.18 1hf3 n ALA 33 Ca -0.05 0.38 -0.15 0.00 0.00 0.00 0.00 53.44 53.62 1hf3 n ALA 33 Cb 0.13 -2.32 -0.02 0.00 0.00 0.00 0.00 19.45 17.23 1hf3 n ALA 33 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1hf3 n HIS 34 N 1.16 -0.47 -4.32 0.00 8.25 -0.22 -4.86 115.22 114.76 1hf3 n HIS 34 Ca 0.07 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.30 1hf3 n HIS 34 Cb 0.35 -2.92 -0.12 0.00 1.12 0.00 0.00 29.99 28.43 1hf3 n HIS 34 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1hf3 s GLU 35 N -4.25 1.24 -0.08 -0.41 2.02 -0.95 -0.95 118.70 115.33 1hf3 s GLU 35 Ca 0.00 -1.32 0.03 0.00 0.02 0.00 0.00 54.97 53.70 1hf3 s GLU 35 Cb 0.00 -1.42 0.01 0.00 0.10 0.00 0.00 34.13 32.82 1hf3 s GLU 35 CO 0.00 0.31 -0.17 0.08 0.02 0.00 0.00 175.26 175.50 1hf3 s VAL 36 N -1.65 1.53 -0.18 2.63 1.01 0.34 0.03 120.40 124.10 1hf3 s VAL 36 Ca 0.13 -0.70 -0.11 0.00 0.00 0.00 0.00 61.98 61.29 1hf3 s VAL 36 Cb -0.08 -1.36 -0.05 0.00 0.00 0.00 0.00 36.38 34.90 1hf3 s VAL 36 CO 0.06 0.44 0.18 -0.60 0.00 0.00 0.00 175.10 175.19 1hf3 s ARG 37 N 0.59 4.17 0.01 2.72 3.52 -0.42 -0.61 118.95 128.93 1hf3 s ARG 37 Ca -0.15 -0.11 0.08 0.00 -0.13 0.00 0.00 55.73 55.41 1hf3 s ARG 37 Cb -0.16 -3.41 -0.03 0.00 -1.56 0.00 0.00 34.95 29.79 1hf3 s ARG 37 CO 0.05 0.31 -0.23 0.42 -0.81 0.00 0.00 175.30 175.04 1hf3 s ILE 38 N 0.30 2.35 -0.34 4.11 1.01 0.85 -1.23 121.20 128.26 1hf3 s ILE 38 Ca 0.11 -1.16 -0.17 0.00 0.00 0.00 0.00 60.65 59.43 1hf3 s ILE 38 Cb -0.12 -1.90 -0.01 0.00 0.01 0.00 0.00 42.46 40.45 1hf3 s ILE 38 CO 0.00 0.47 0.48 -0.75 0.00 0.00 0.00 174.94 175.14 1hf3 s LYS 39 N -0.98 3.66 0.16 2.79 2.20 0.21 -1.28 119.74 126.50 1hf3 s LYS 39 Ca 0.12 -0.17 -0.30 0.00 -0.36 0.00 0.00 55.97 55.25 1hf3 s LYS 39 Cb -0.10 -3.79 -0.08 0.00 -1.51 0.00 0.00 37.83 32.35 1hf3 s LYS 39 CO 0.01 -0.58 1.23 -1.64 -0.36 0.00 0.00 175.35 174.01 1hf3 s MET 40 N 2.29 4.45 -0.23 4.03 -1.94 -0.08 -0.64 119.30 127.19 1hf3 s MET 40 Ca 0.17 1.90 -0.05 0.00 -1.71 0.00 0.00 55.69 56.00 1hf3 s MET 40 Cb -0.16 -3.25 -0.12 0.00 2.01 0.00 0.00 34.83 33.31 1hf3 s MET 40 CO 0.13 -0.16 -0.25 0.28 -0.01 0.00 0.00 175.02 175.00 1hf3 n VAL 41 N 2.84 1.27 -3.72 -6.03 0.31 -0.57 -4.71 118.33 107.71 1hf3 n VAL 41 Ca 0.06 -0.40 -0.13 0.00 -0.01 0.00 0.00 64.34 63.85 1hf3 n VAL 41 Cb 0.44 -1.55 -0.09 0.00 -0.91 0.00 0.00 33.84 31.73 1hf3 n VAL 41 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1hf3 s ALA 42 N -2.43 -1.02 -0.03 3.52 0.00 -0.94 -2.50 121.76 118.36 1hf3 s ALA 42 Ca -0.31 0.98 -0.03 0.00 0.00 0.00 0.00 51.96 52.59 1hf3 s ALA 42 Cb 0.10 -0.45 0.01 0.00 0.00 0.00 0.00 23.12 22.77 1hf3 s ALA 42 CO 0.46 -0.22 0.08 -0.08 0.00 0.00 0.00 175.76 175.99 1hf3 s THR 43 N -0.25 0.01 0.29 0.00 -1.32 -0.07 -1.83 115.64 112.47 1hf3 s THR 43 Ca -0.04 -0.09 -0.02 0.00 -1.21 0.00 0.00 61.69 60.32 1hf3 s THR 43 Cb -0.03 -0.15 -0.04 0.00 -1.51 0.00 0.00 72.50 70.76 1hf3 s THR 43 CO 0.02 -0.05 0.52 -0.83 -2.21 0.00 0.00 174.62 172.07 1hf3 s GLY 44 N -0.13 1.68 -0.35 6.08 0.00 0.76 -0.22 107.32 115.14 1hf3 s GLY 44 Ca -0.02 -0.73 -0.13 0.00 0.00 0.00 0.00 44.72 43.84 1hf3 s GLY 44 CO 0.00 -0.65 0.24 -0.42 0.00 0.00 0.00 173.10 172.28 1hf3 s ILE 45 N -2.12 5.24 0.10 0.90 1.01 -0.62 -4.57 121.20 121.14 1hf3 s ILE 45 Ca 0.41 -0.28 0.05 0.00 0.00 0.00 0.00 60.65 60.83 1hf3 s ILE 45 Cb -0.10 -3.72 -0.04 0.00 0.01 0.00 0.00 42.46 38.61 1hf3 s ILE 45 CO 0.32 -0.04 0.01 0.00 0.00 0.00 0.00 174.94 175.22 1hf3 h ARG 47 N 3.34 0.28 0.00 0.00 9.65 -1.98 -0.43 114.38 125.23 1hf3 h ARG 47 Ca -0.48 -0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.38 1hf3 h ARG 47 Cb 1.17 -0.06 -0.00 0.00 -1.39 0.00 0.00 29.97 29.68 1hf3 h ARG 47 CO 0.60 0.18 -0.04 0.77 2.80 0.00 0.00 179.97 184.29 1hf3 h SER 48 N 0.29 0.00 -0.13 -3.80 0.02 -1.99 -0.11 113.55 107.83 1hf3 h SER 48 Ca 0.37 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 61.17 1hf3 h SER 48 Cb 1.03 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.56 1hf3 h SER 48 CO -0.09 0.04 -0.43 0.44 -1.14 0.00 0.00 176.83 175.65 1hf3 h ASP 49 N 0.00 0.72 0.26 3.07 3.32 -1.48 -2.65 116.42 119.66 1hf3 h ASP 49 Ca -0.00 -0.33 -0.08 0.00 0.02 0.00 0.00 57.03 56.64 1hf3 h ASP 49 Cb 0.07 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 1hf3 h ASP 49 CO 0.00 1.05 -0.33 -0.78 -1.72 0.00 0.00 179.24 177.47 1hf3 h ASP 50 N 0.54 0.10 -0.20 6.45 3.58 -1.18 -2.61 116.42 123.11 1hf3 h ASP 50 Ca 0.04 -0.03 -0.01 0.00 0.42 0.00 0.00 57.03 57.45 1hf3 h ASP 50 Cb 0.96 -0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.97 1hf3 h ASP 50 CO 0.09 0.43 0.11 0.45 -2.88 0.00 0.00 179.24 177.43 1hf3 h HIS 51 N 0.09 0.31 -0.44 0.28 3.86 -0.70 0.33 115.15 118.89 1hf3 h HIS 51 Ca 0.01 -0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.11 1hf3 h HIS 51 Cb 0.62 -0.10 -0.02 0.00 1.06 0.00 0.00 27.41 28.98 1hf3 h HIS 51 CO 0.00 0.24 -0.15 0.28 0.86 0.00 0.00 177.93 179.16 1hf3 h VAL 52 N 0.33 1.26 -0.13 2.45 2.07 -1.36 0.16 116.25 121.04 1hf3 h VAL 52 Ca 0.08 -1.25 -0.06 0.00 0.82 0.00 0.00 66.70 66.29 1hf3 h VAL 52 Cb 0.05 1.09 -0.00 0.00 -1.52 0.00 0.00 31.29 30.91 1hf3 h VAL 52 CO -0.01 0.43 -0.15 0.58 0.02 0.00 0.00 177.57 178.44 1hf3 h VAL 53 N 0.73 1.36 0.00 2.57 2.07 -1.08 -2.54 116.25 119.36 1hf3 h VAL 53 Ca 0.11 -1.33 0.00 0.00 0.82 0.00 0.00 66.70 66.30 1hf3 h VAL 53 Cb 0.66 1.94 0.00 0.00 -1.52 0.00 0.00 31.29 32.38 1hf3 h VAL 53 CO 0.05 0.39 0.00 -1.54 0.02 0.00 0.00 177.57 176.48 1hf3 n SER 54 N -4.57 0.00 0.00 0.57 3.41 0.10 -0.13 113.62 113.00 1hf3 n SER 54 Ca -0.06 0.35 0.00 0.00 -0.26 0.00 0.00 58.87 58.89 1hf3 n SER 54 Cb 0.37 -0.43 0.00 0.00 -0.26 0.00 0.00 64.21 63.89 1hf3 n SER 54 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1hf3 n GLY 55 N 0.18 0.85 0.20 5.00 0.00 -0.65 -4.86 105.19 105.90 1hf3 n GLY 55 Ca 0.05 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.97 1hf3 n GLY 55 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1hf3 h THR 56 N 0.00 1.25 -3.67 2.61 2.02 -1.30 -3.40 112.91 110.41 1hf3 h THR 56 Ca 0.00 -0.90 -0.67 0.00 0.77 0.00 0.00 66.41 65.61 1hf3 h THR 56 Cb 0.00 1.12 -0.22 0.00 -1.74 0.00 0.00 68.15 67.31 1hf3 h THR 56 CO 0.00 0.30 -0.55 -0.22 0.37 0.00 0.00 175.52 175.42 1hf3 s LEU 57 N -9.51 4.10 -0.24 2.58 2.96 -0.32 -0.88 118.68 117.37 1hf3 s LEU 57 Ca -0.13 -0.48 -0.15 0.00 -0.22 0.00 0.00 54.13 53.15 1hf3 s LEU 57 Cb 0.09 -2.01 -0.04 0.00 0.50 0.00 0.00 46.19 44.73 1hf3 s LEU 57 CO 0.77 -0.18 0.39 -0.69 -1.32 0.00 0.00 176.35 175.32 1hf3 s VAL 58 N 1.63 5.18 -0.21 1.68 1.01 -1.26 -4.21 120.40 124.22 1hf3 s VAL 58 Ca 0.05 0.65 -0.19 0.00 0.00 0.00 0.00 61.98 62.49 1hf3 s VAL 58 Cb -0.17 -3.72 0.05 0.00 0.00 0.00 0.00 36.38 32.55 1hf3 s VAL 58 CO 0.07 0.20 0.55 0.28 0.00 0.00 0.00 175.10 176.20 1hf3 s THR 59 N 1.74 0.00 -0.01 3.92 -1.32 -1.26 -4.68 115.64 114.02 1hf3 s THR 59 Ca 0.17 -0.00 -0.39 0.00 -1.21 0.00 0.00 61.69 60.26 1hf3 s THR 59 Cb -0.15 -0.77 -0.18 0.00 -1.51 0.00 0.00 72.50 69.88 1hf3 s THR 59 CO 0.09 -0.00 1.28 -2.65 -2.21 0.00 0.00 174.62 171.12 1hf3 n PRO 60 N 2.77 0.60 -4.14 7.08 -0.02 -1.26 -5.01 135.00 135.02 1hf3 n PRO 60 Ca -0.14 0.22 -0.28 0.00 -2.02 0.00 0.00 63.50 61.28 1hf3 n PRO 60 Cb 0.56 -1.80 -0.07 0.00 -0.02 0.00 0.00 33.50 32.17 1hf3 n PRO 60 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1hf3 s LEU 61 N 0.67 3.51 0.70 2.45 1.43 -1.26 -4.39 118.68 121.79 1hf3 s LEU 61 Ca 0.89 -0.23 -0.12 0.00 -1.03 0.00 0.00 54.13 53.64 1hf3 s LEU 61 Cb -1.13 -2.18 0.02 0.00 0.03 0.00 0.00 46.19 42.92 1hf3 s LEU 61 CO 0.55 0.12 1.08 -2.16 0.23 0.00 0.00 176.35 176.16 1hf3 s PRO 62 N -2.72 2.75 -0.02 1.29 0.04 -1.26 -4.91 135.00 130.17 1hf3 s PRO 62 Ca 0.28 1.12 -0.17 0.00 0.04 0.00 0.00 61.00 62.26 1hf3 s PRO 62 Cb -0.10 -1.96 0.03 0.00 0.04 0.00 0.00 34.50 32.50 1hf3 s PRO 62 CO 0.20 -1.25 0.37 0.54 0.04 0.00 0.00 177.00 176.89 1hf3 s VAL 63 N -2.82 0.05 -0.43 -0.36 0.11 -0.49 -1.32 120.40 115.14 1hf3 s VAL 63 Ca 0.61 -0.39 -0.15 0.00 -2.93 0.00 0.00 61.98 59.12 1hf3 s VAL 63 Cb -0.16 -0.67 0.04 0.00 -1.53 0.00 0.00 36.38 34.06 1hf3 s VAL 63 CO 0.51 -0.22 0.33 -0.63 -3.33 0.00 0.00 175.10 171.76 1hf3 s ILE 64 N -1.29 5.17 0.00 7.04 1.01 -0.77 -1.19 121.20 131.17 1hf3 s ILE 64 Ca -0.13 -0.86 0.00 0.00 0.00 0.00 0.00 60.65 59.66 1hf3 s ILE 64 Cb -0.04 -3.97 0.00 0.00 0.01 0.00 0.00 42.46 38.45 1hf3 s ILE 64 CO 0.05 -0.42 0.00 0.00 0.00 0.00 0.00 174.94 174.57 1hf3 n ALA 65 N 5.16 0.00 -0.03 9.38 0.00 -1.26 -3.61 120.51 130.15 1hf3 n ALA 65 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1hf3 n ALA 65 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.90 1hf3 n ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hf3 n GLY 66 N 5.00 0.11 0.00 0.00 0.00 -1.26 -1.34 105.19 107.70 1hf3 n GLY 66 Ca 0.00 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.79 1hf3 n GLY 66 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1hf3 n HIS 67 N 1.95 0.00 -3.77 1.61 1.44 -1.26 -0.65 115.22 114.54 1hf3 n HIS 67 Ca 0.00 0.00 -0.35 0.00 -2.01 0.00 0.00 57.72 55.36 1hf3 n HIS 67 Cb 0.00 0.01 -0.11 0.00 0.12 0.00 0.00 29.99 30.02 1hf3 n HIS 67 CO 0.00 0.00 0.00 -2.00 -2.81 0.00 0.00 176.34 171.53 1hf3 s GLU 68 N 0.00 2.44 0.35 -1.40 2.12 -1.26 -4.65 118.70 116.30 1hf3 s GLU 68 Ca 0.00 -2.55 -0.06 0.00 0.36 0.00 0.00 54.97 52.73 1hf3 s GLU 68 Cb 0.00 -3.64 0.02 0.00 0.26 0.00 0.00 34.13 30.77 1hf3 s GLU 68 CO 0.00 -1.16 0.56 0.00 -0.54 0.00 0.00 175.26 174.13 1hf3 n ALA 69 N 3.41 -0.77 -3.64 6.30 0.00 -1.23 -0.17 120.51 124.42 1hf3 n ALA 69 Ca 0.07 -1.46 -0.09 0.00 0.00 0.00 0.00 53.44 51.97 1hf3 n ALA 69 Cb 0.37 1.17 -0.07 0.00 0.00 0.00 0.00 19.45 20.92 1hf3 n ALA 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hf3 s ALA 70 N -2.52 -1.87 0.00 0.00 0.00 -0.76 -4.26 121.76 112.35 1hf3 s ALA 70 Ca 0.24 2.32 0.00 0.00 0.00 0.00 0.00 51.96 54.52 1hf3 s ALA 70 Cb -0.02 -1.38 0.00 0.00 0.00 0.00 0.00 23.12 21.72 1hf3 s ALA 70 CO 0.17 -0.37 0.00 0.41 0.00 0.00 0.00 175.76 175.98 1hf3 n GLY 71 N 3.89 3.49 3.22 0.00 0.00 -0.84 -1.51 105.19 113.44 1hf3 n GLY 71 Ca -0.18 -1.26 -0.31 0.00 0.00 0.00 0.00 46.02 44.27 1hf3 n GLY 71 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hf3 s ILE 72 N -2.27 1.94 0.19 -0.61 1.01 0.18 -0.85 121.20 120.80 1hf3 s ILE 72 Ca 0.00 -0.98 -0.32 0.00 0.00 0.00 0.00 60.65 59.35 1hf3 s ILE 72 Cb 0.00 -1.67 -0.11 0.00 0.01 0.00 0.00 42.46 40.69 1hf3 s ILE 72 CO 0.00 0.54 1.65 -0.69 0.00 0.00 0.00 174.94 176.44 1hf3 s VAL 73 N 0.12 2.29 -0.24 2.92 1.01 0.13 -0.62 120.40 126.01 1hf3 s VAL 73 Ca -0.11 0.21 -0.13 0.00 0.00 0.00 0.00 61.98 61.95 1hf3 s VAL 73 Cb -0.16 -3.13 -0.16 0.00 0.00 0.00 0.00 36.38 32.93 1hf3 s VAL 73 CO 0.06 0.02 -0.11 1.21 0.00 0.00 0.00 175.10 176.28 1hf3 n GLU 74 N 3.91 0.61 -3.65 2.72 0.00 -0.36 -1.11 120.64 122.77 1hf3 n GLU 74 Ca 0.15 0.33 -0.11 0.00 0.00 0.00 0.00 57.16 57.52 1hf3 n GLU 74 Cb 0.37 -1.59 -0.05 0.00 0.00 0.00 0.00 31.44 30.17 1hf3 n GLU 74 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.13 175.59 1hf3 s SER 75 N -7.13 -0.25 0.10 4.31 1.04 -1.19 -4.78 113.70 105.81 1hf3 s SER 75 Ca -0.34 -0.20 0.07 0.00 0.48 0.00 0.00 55.95 55.95 1hf3 s SER 75 Cb 0.11 0.46 -0.03 0.00 0.10 0.00 0.00 66.02 66.65 1hf3 s SER 75 CO 0.56 -0.78 -0.17 0.27 0.98 0.00 0.00 173.24 174.10 1hf3 s ILE 76 N -3.32 1.41 0.93 -1.02 -4.36 -1.26 -1.30 121.20 112.28 1hf3 s ILE 76 Ca -0.00 -1.54 -0.15 0.00 -0.26 0.00 0.00 60.65 58.70 1hf3 s ILE 76 Cb 0.01 -1.41 0.17 0.00 1.25 0.00 0.00 42.46 42.48 1hf3 s ILE 76 CO -0.09 -0.23 1.26 -0.83 0.24 0.00 0.00 174.94 175.29 1hf3 s GLY 77 N -2.06 1.70 0.25 6.27 0.00 0.10 -4.93 107.32 108.65 1hf3 s GLY 77 Ca 0.05 -1.00 -0.31 0.00 0.00 0.00 0.00 44.72 43.47 1hf3 s GLY 77 CO 0.03 -0.31 1.58 -0.54 0.00 0.00 0.00 173.10 173.87 1hf3 s GLU 78 N -5.74 4.17 0.00 2.90 2.02 -1.26 -3.21 118.70 117.58 1hf3 s GLU 78 Ca 0.70 2.49 0.00 0.00 0.02 0.00 0.00 54.97 58.18 1hf3 s GLU 78 Cb -0.07 -3.07 0.00 0.00 0.10 0.00 0.00 34.13 31.09 1hf3 s GLU 78 CO 0.52 -0.61 0.00 0.41 0.02 0.00 0.00 175.26 175.60 1hf3 n GLY 79 N 2.79 1.28 3.68 -1.39 0.00 -1.26 -1.05 105.19 109.24 1hf3 n GLY 79 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1hf3 n GLY 79 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hf3 s VAL 80 N -2.68 4.10 -0.00 1.61 1.01 -1.20 -4.80 120.40 118.44 1hf3 s VAL 80 Ca 0.00 1.40 0.01 0.00 0.00 0.00 0.00 61.98 63.40 1hf3 s VAL 80 Cb 0.00 -3.90 -0.02 0.00 0.00 0.00 0.00 36.38 32.45 1hf3 s VAL 80 CO 0.00 -0.05 0.03 0.35 0.00 0.00 0.00 175.10 175.43 1hf3 n THR 81 N 4.92 0.01 0.27 3.92 -2.24 -1.26 -4.81 114.28 115.09 1hf3 n THR 81 Ca 0.13 -0.04 0.12 0.00 -2.27 0.00 0.00 64.05 61.99 1hf3 n THR 81 Cb 0.45 0.29 0.09 0.00 -2.10 0.00 0.00 70.33 69.06 1hf3 n THR 81 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1hf3 h THR 82 N 0.00 0.00 -4.16 4.28 1.35 -1.97 -3.46 112.91 108.95 1hf3 h THR 82 Ca -0.00 -0.84 -0.19 0.00 -0.55 0.00 0.00 66.41 64.82 1hf3 h THR 82 Cb 0.19 1.47 -0.15 0.00 -1.73 0.00 0.00 68.15 67.93 1hf3 h THR 82 CO 0.00 0.00 -0.67 0.68 -0.25 0.00 0.00 175.52 175.28 1hf3 s VAL 83 N -3.28 0.33 0.26 6.82 -7.23 -1.26 -4.74 120.40 111.30 1hf3 s VAL 83 Ca 0.03 -1.90 0.07 0.00 -1.81 0.00 0.00 61.98 58.37 1hf3 s VAL 83 Cb 0.10 -1.85 -0.05 0.00 0.56 0.00 0.00 36.38 35.14 1hf3 s VAL 83 CO 0.74 -0.69 -0.08 -0.13 -0.31 0.00 0.00 175.10 174.63 1hf3 s ARG 84 N -3.95 1.51 0.13 4.82 0.52 -1.26 -5.00 118.95 115.71 1hf3 s ARG 84 Ca 0.17 -1.74 -0.34 0.00 -0.52 0.00 0.00 55.73 53.30 1hf3 s ARG 84 Cb 0.07 -1.18 -0.14 0.00 0.52 0.00 0.00 34.95 34.23 1hf3 s ARG 84 CO -0.02 0.08 1.61 -2.30 0.02 0.00 0.00 175.30 174.69 1hf3 n PRO 85 N -0.54 2.14 0.00 3.54 -0.02 -1.26 -1.17 135.00 137.69 1hf3 n PRO 85 Ca -0.06 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 1hf3 n PRO 85 Cb 0.63 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 1hf3 n PRO 85 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1hf3 n GLY 86 N 3.53 2.74 3.77 -1.23 0.00 -0.26 -4.95 105.19 108.78 1hf3 n GLY 86 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 1hf3 n GLY 86 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1hf3 s ASP 87 N -0.31 6.64 0.02 1.61 1.01 -0.32 -4.63 116.67 120.69 1hf3 s ASP 87 Ca 0.00 2.56 -0.30 0.00 0.71 0.00 0.00 52.55 55.52 1hf3 s ASP 87 Cb 0.00 -2.64 -0.04 0.00 1.01 0.00 0.00 42.92 41.26 1hf3 s ASP 87 CO 0.00 -0.61 1.03 -0.54 0.21 0.00 0.00 175.17 175.26 1hf3 s LYS 88 N -1.99 4.53 0.08 8.23 1.02 -1.26 0.19 119.74 130.55 1hf3 s LYS 88 Ca 0.52 1.50 0.01 0.00 0.02 0.00 0.00 55.97 58.02 1hf3 s LYS 88 Cb -0.37 -3.43 -0.04 0.00 -0.52 0.00 0.00 37.83 33.47 1hf3 s LYS 88 CO 0.48 -0.09 -0.06 0.14 -0.92 0.00 0.00 175.35 174.90 1hf3 s VAL 89 N 0.99 0.57 -0.13 3.17 -7.23 -0.03 -1.40 120.40 116.33 1hf3 s VAL 89 Ca 0.53 -1.83 0.02 0.00 -1.81 0.00 0.00 61.98 58.89 1hf3 s VAL 89 Cb -0.23 -1.55 0.01 0.00 0.56 0.00 0.00 36.38 35.17 1hf3 s VAL 89 CO 0.28 -0.86 -0.19 -0.63 -0.31 0.00 0.00 175.10 173.39 1hf3 s ILE 90 N -3.51 1.85 0.41 -0.62 1.01 -0.42 -1.98 121.20 117.93 1hf3 s ILE 90 Ca 0.09 -0.85 -0.25 0.00 0.00 0.00 0.00 60.65 59.64 1hf3 s ILE 90 Cb 0.05 -1.66 -0.08 0.00 0.01 0.00 0.00 42.46 40.77 1hf3 s ILE 90 CO -0.06 0.51 1.17 -2.16 0.00 0.00 0.00 174.94 174.41 1hf3 s PRO 91 N 0.95 4.02 -0.25 2.79 0.04 -1.26 -2.13 135.00 139.16 1hf3 s PRO 91 Ca -0.05 1.84 -0.03 0.00 0.04 0.00 0.00 61.00 62.80 1hf3 s PRO 91 Cb -0.15 -2.65 0.02 0.00 0.04 0.00 0.00 34.50 31.76 1hf3 s PRO 91 CO -0.03 -0.35 -0.03 -0.51 0.04 0.00 0.00 177.00 176.12 1hf3 s LEU 92 N -2.55 3.29 0.36 -3.56 1.43 0.16 -4.78 118.68 113.03 1hf3 s LEU 92 Ca 0.58 -0.78 0.27 0.00 -1.03 0.00 0.00 54.13 53.17 1hf3 s LEU 92 Cb -0.31 -1.72 0.95 0.00 0.03 0.00 0.00 46.19 45.14 1hf3 s LEU 92 CO 0.38 -0.13 1.79 2.19 0.23 0.00 0.00 176.35 180.81 1hf3 h PHE 93 N 8.07 0.00 -3.67 0.29 -5.15 -1.83 -3.36 116.94 111.29 1hf3 h PHE 93 Ca -0.33 0.00 -0.69 0.00 -0.20 0.00 0.00 57.97 56.74 1hf3 h PHE 93 Cb 1.12 0.00 -0.31 0.00 0.22 0.00 0.00 35.95 36.98 1hf3 h PHE 93 CO 0.59 0.00 -0.63 0.99 -2.00 0.00 0.00 178.31 177.26 1hf3 s THR 94 N -3.35 3.42 1.05 0.88 2.01 -1.26 -4.74 115.64 113.65 1hf3 s THR 94 Ca 0.05 -1.39 -0.15 0.00 0.31 0.00 0.00 61.69 60.52 1hf3 s THR 94 Cb 0.09 -3.02 0.22 0.00 0.01 0.00 0.00 72.50 69.80 1hf3 s THR 94 CO 0.53 -0.25 1.13 -2.16 -0.69 0.00 0.00 174.62 173.18 1hf3 s PRO 95 N 1.30 -0.01 -0.42 4.92 0.04 -1.26 -4.60 135.00 134.97 1hf3 s PRO 95 Ca -0.01 0.18 0.04 0.00 0.04 0.00 0.00 61.00 61.25 1hf3 s PRO 95 Cb -0.20 -1.71 0.17 0.00 0.04 0.00 0.00 34.50 32.79 1hf3 s PRO 95 CO 0.00 -2.96 0.42 -1.14 0.04 0.00 0.00 177.00 173.36 1hf3 s GLN 96 N -5.26 0.85 0.49 4.56 0.74 -0.24 -4.35 119.66 116.45 1hf3 s GLN 96 Ca 0.68 -1.54 0.19 0.00 0.05 0.00 0.00 55.36 54.74 1hf3 s GLN 96 Cb -0.14 -0.96 1.24 0.00 1.10 0.00 0.00 33.01 34.26 1hf3 s GLN 96 CO 0.56 -1.32 2.07 0.00 -0.55 0.00 0.00 175.29 176.05 1hf3 n GLY 98 N -1.07 0.87 0.00 0.00 0.00 -1.26 -4.76 105.19 98.96 1hf3 n GLY 98 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1hf3 n GLY 98 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1hf3 n LYS 99 N -2.02 1.27 -1.72 1.61 5.02 -1.26 -4.68 118.16 116.39 1hf3 n LYS 99 Ca 0.00 0.00 -0.18 0.00 -2.02 0.00 0.00 58.31 56.11 1hf3 n LYS 99 Cb 0.00 -0.89 0.11 0.00 -0.02 0.00 0.00 35.03 34.23 1hf3 n LYS 99 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1hf3 h ARG 101 N 0.00 0.00 0.03 0.00 0.11 -1.98 -0.08 114.38 112.46 1hf3 h ARG 101 Ca -0.27 0.00 -0.15 0.00 0.10 0.00 0.00 59.98 59.66 1hf3 h ARG 101 Cb 0.85 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.95 1hf3 h ARG 101 CO 0.24 0.03 -0.62 0.28 0.10 0.00 0.00 179.97 180.00 1hf3 h VAL 102 N 0.00 1.46 -0.60 0.08 2.07 -1.92 -2.26 116.25 115.09 1hf3 h VAL 102 Ca -0.00 -2.19 -0.01 0.00 0.82 0.00 0.00 66.70 65.33 1hf3 h VAL 102 Cb 0.06 2.77 -0.03 0.00 -1.52 0.00 0.00 31.29 32.58 1hf3 h VAL 102 CO 0.00 0.63 0.34 0.00 0.02 0.00 0.00 177.57 178.56 1hf3 h LYS 104 N 0.83 0.00 -6.63 0.00 1.57 -0.98 -3.44 116.57 107.91 1hf3 h LYS 104 Ca 0.21 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 58.49 1hf3 h LYS 104 Cb 0.01 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 1hf3 h LYS 104 CO -0.04 0.00 0.38 -1.58 -0.57 0.00 0.00 179.45 177.64 1hf3 s HIS 105 N -3.19 3.83 0.49 -1.35 2.46 -0.43 -4.94 115.29 112.16 1hf3 s HIS 105 Ca 0.08 1.80 0.15 0.00 0.47 0.00 0.00 55.06 57.56 1hf3 s HIS 105 Cb 0.11 -3.07 1.15 0.00 -0.13 0.00 0.00 32.58 30.64 1hf3 s HIS 105 CO 0.55 0.15 2.09 -1.35 -2.47 0.00 0.00 174.74 173.72 1hf3 h PRO 106 N 5.09 0.06 0.00 2.88 0.11 -1.86 -3.29 132.00 134.99 1hf3 h PRO 106 Ca -0.44 -0.01 -0.37 0.00 0.11 0.00 0.00 66.00 65.30 1hf3 h PRO 106 Cb 1.21 -0.01 -0.06 0.00 0.11 0.00 0.00 31.00 32.24 1hf3 h PRO 106 CO 0.71 0.09 -2.33 -1.91 -0.21 0.00 0.00 178.00 174.35 1hf3 n GLU 107 N -4.47 0.55 -1.01 1.05 4.07 -1.26 -5.03 120.64 114.53 1hf3 n GLU 107 Ca -0.02 0.17 -0.32 0.00 -0.06 0.00 0.00 57.16 56.93 1hf3 n GLU 107 Cb 0.13 -1.42 0.13 0.00 -0.06 0.00 0.00 31.44 30.23 1hf3 n GLU 107 CO 0.00 0.00 0.00 0.20 -0.06 0.00 0.00 177.13 177.27 1hf3 s GLY 108 N -5.88 1.85 0.00 8.31 0.00 -1.24 -4.93 107.32 105.42 1hf3 s GLY 108 Ca -0.32 0.59 0.00 0.00 0.00 0.00 0.00 44.72 44.98 1hf3 s GLY 108 CO 0.48 0.98 0.01 1.16 0.00 0.00 0.00 173.10 175.74 1hf3 n ASN 109 N -3.69 0.02 -3.92 1.64 6.94 -1.26 -4.73 115.26 110.27 1hf3 n ASN 109 Ca 0.12 -0.24 -0.42 0.00 -0.02 0.00 0.00 54.58 54.01 1hf3 n ASN 109 Cb 0.52 0.09 0.00 0.00 -2.36 0.00 0.00 39.78 38.03 1hf3 n ASN 109 CO 0.00 0.00 0.00 0.33 -1.03 0.00 0.00 177.26 176.56 1hf3 n PHE 110 N -0.09 3.66 -1.56 -2.53 7.35 -1.26 -4.79 117.46 118.24 1hf3 n PHE 110 Ca 0.00 -2.94 -0.46 0.00 -0.76 0.00 0.00 57.45 53.29 1hf3 n PHE 110 Cb 0.04 -2.44 -0.02 0.00 0.35 0.00 0.00 39.48 37.41 1hf3 n PHE 110 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1hf3 n LEU 112 N 1.50 0.00 -1.35 0.00 4.77 -1.26 -1.58 117.00 119.07 1hf3 n LEU 112 Ca 0.12 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.22 1hf3 n LEU 112 Cb 0.29 0.00 0.32 0.00 -2.33 0.00 0.00 43.42 41.70 1hf3 n LEU 112 CO 0.60 0.00 0.77 0.29 -1.33 0.00 0.00 177.39 177.72 1hf3 n LYS 113 N -0.90 2.70 -0.75 3.23 4.76 -1.26 -4.97 118.16 120.97 1hf3 n LYS 113 Ca 0.10 -2.64 -0.31 0.00 -2.87 0.00 0.00 58.31 52.59 1hf3 n LYS 113 Cb 0.05 -1.57 0.16 0.00 -1.84 0.00 0.00 35.03 31.83 1hf3 n LYS 113 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1hf3 s ASN 114 N -1.05 2.98 -0.23 4.39 2.20 -0.62 -4.92 114.94 117.69 1hf3 s ASN 114 Ca 0.49 2.23 0.12 0.00 -0.94 0.00 0.00 52.86 54.76 1hf3 s ASN 114 Cb 0.26 -2.57 0.47 0.00 -2.00 0.00 0.00 41.25 37.41 1hf3 s ASN 114 CO 0.34 -3.06 1.38 -0.67 -2.94 0.00 0.00 177.10 172.14 1hf3 n ASP 115 N -4.11 2.69 -0.10 3.54 2.03 -1.26 -4.64 116.55 114.69 1hf3 n ASP 115 Ca 0.12 -3.52 -0.24 0.00 0.52 0.00 0.00 54.79 51.67 1hf3 n ASP 115 Cb 0.52 -0.57 -0.12 0.00 -0.72 0.00 0.00 41.12 40.23 1hf3 n ASP 115 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1hf3 n LEU 116 N -1.02 2.30 -0.21 -2.67 4.32 -1.26 -3.63 117.00 114.82 1hf3 n LEU 116 Ca 0.26 0.23 -0.08 0.00 -0.02 0.00 0.00 56.01 56.40 1hf3 n LEU 116 Cb 0.90 -0.93 0.05 0.00 -1.62 0.00 0.00 43.42 41.82 1hf3 n LEU 116 CO 0.13 0.64 0.87 0.77 -1.22 0.00 0.00 177.39 178.57 1hf3 h SER 117 N -0.57 1.03 -1.88 -1.43 4.64 -1.99 -3.36 113.55 109.99 1hf3 h SER 117 Ca -0.54 -0.27 -0.47 0.00 -0.47 0.00 0.00 61.79 60.05 1hf3 h SER 117 Cb 1.68 -0.27 -0.32 0.00 -0.31 0.00 0.00 62.40 63.18 1hf3 h SER 117 CO -0.20 1.05 -0.86 0.80 -0.87 0.00 0.00 176.83 176.75 1hf3 n MET 118 N -4.20 0.37 -1.64 4.77 1.56 -1.26 -5.11 117.12 111.61 1hf3 n MET 118 Ca 0.04 -2.84 -0.51 0.00 -0.27 0.00 0.00 57.70 54.12 1hf3 n MET 118 Cb 0.32 -1.55 -0.06 0.00 2.15 0.00 0.00 33.22 34.08 1hf3 n MET 118 CO 0.00 0.00 0.00 -2.30 -0.73 0.00 0.00 175.97 172.94 1hf3 n PRO 119 N 2.61 1.53 -0.10 2.12 -0.02 -1.24 -4.87 135.00 135.02 1hf3 n PRO 119 Ca 0.25 0.55 -0.11 0.00 -2.02 0.00 0.00 63.50 62.17 1hf3 n PRO 119 Cb 0.51 -2.26 -0.14 0.00 -0.02 0.00 0.00 33.50 31.60 1hf3 n PRO 119 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1hf3 n ARG 120 N 3.63 0.83 -2.22 -0.52 1.74 -1.26 -4.60 116.66 114.26 1hf3 n ARG 120 Ca 0.20 0.03 -0.06 0.00 -0.77 0.00 0.00 57.85 57.24 1hf3 n ARG 120 Cb 0.22 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.17 1hf3 n ARG 120 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1hf3 n GLY 121 N 1.96 0.19 3.57 -0.13 0.00 -1.26 -4.72 105.19 104.79 1hf3 n GLY 121 Ca -0.34 -0.60 -0.26 0.00 0.00 0.00 0.00 46.02 44.81 1hf3 n GLY 121 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1hf3 s THR 122 N -2.42 1.25 1.08 2.61 -4.23 -1.26 -0.22 115.64 112.45 1hf3 s THR 122 Ca 0.03 -2.00 -0.18 0.00 -1.18 0.00 0.00 61.69 58.35 1hf3 s THR 122 Cb -0.01 -2.62 0.26 0.00 1.34 0.00 0.00 72.50 71.46 1hf3 s THR 122 CO 0.03 0.00 1.24 0.23 -0.54 0.00 0.00 174.62 175.58 1hf3 n MET 123 N -0.92 -2.04 0.26 3.99 2.81 0.92 -4.68 117.12 117.46 1hf3 n MET 123 Ca -0.07 -1.94 0.11 0.00 -1.81 0.00 0.00 57.70 53.99 1hf3 n MET 123 Cb 0.66 -1.48 0.71 0.00 -0.71 0.00 0.00 33.22 32.40 1hf3 n MET 123 CO 0.00 0.00 0.00 1.96 1.51 0.00 0.00 175.97 179.44 1hf3 h GLN 124 N 0.00 0.00 -0.03 0.03 1.08 -1.97 -0.30 115.11 113.92 1hf3 h GLN 124 Ca -0.42 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.78 1hf3 h GLN 124 Cb 1.22 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.65 1hf3 h GLN 124 CO 0.29 0.10 0.00 -0.40 -0.95 0.00 0.00 178.83 177.87 1hf3 n ASP 125 N -3.92 0.56 0.00 1.46 5.75 -1.26 -4.86 116.55 114.28 1hf3 n ASP 125 Ca -0.02 -1.33 0.00 0.00 -0.01 0.00 0.00 54.79 53.43 1hf3 n ASP 125 Cb 0.19 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.26 1hf3 n ASP 125 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1hf3 n GLY 126 N 1.00 0.72 3.57 6.12 0.00 -0.12 -5.04 105.19 111.44 1hf3 n GLY 126 Ca 0.19 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.96 1hf3 n GLY 126 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1hf3 s THR 127 N -2.39 2.60 0.09 2.61 -4.23 -1.26 -4.78 115.64 108.28 1hf3 s THR 127 Ca 0.00 -2.14 -0.01 0.00 -1.18 0.00 0.00 61.69 58.35 1hf3 s THR 127 Cb 0.00 -2.63 -0.04 0.00 1.34 0.00 0.00 72.50 71.17 1hf3 s THR 127 CO 0.00 -0.28 0.26 -0.55 -0.54 0.00 0.00 174.62 173.51 1hf3 s SER 128 N -3.63 6.40 0.00 3.99 0.15 -1.26 -0.06 113.70 119.29 1hf3 s SER 128 Ca 0.32 0.36 0.18 0.00 0.70 0.00 0.00 55.95 57.52 1hf3 s SER 128 Cb -0.02 -2.00 0.35 0.00 -1.71 0.00 0.00 66.02 62.64 1hf3 s SER 128 CO 0.17 0.13 1.28 0.54 1.20 0.00 0.00 173.24 176.56 1hf3 n ARG 129 N 0.19 2.24 -5.17 5.44 5.12 -1.26 -4.95 116.66 118.27 1hf3 n ARG 129 Ca -0.04 -2.06 -0.32 0.00 -1.93 0.00 0.00 57.85 53.50 1hf3 n ARG 129 Cb 0.51 -1.41 -0.16 0.00 -1.16 0.00 0.00 32.46 30.24 1hf3 n ARG 129 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 1hf3 s PHE 130 N -1.26 2.56 0.03 -1.55 0.08 -1.26 -0.55 117.98 116.04 1hf3 s PHE 130 Ca 0.31 -0.89 0.03 0.00 0.12 0.00 0.00 56.93 56.50 1hf3 s PHE 130 Cb 0.18 -1.69 -0.02 0.00 -0.57 0.00 0.00 43.02 40.92 1hf3 s PHE 130 CO 0.25 -0.32 -0.08 0.95 -0.10 0.00 0.00 175.22 175.92 1hf3 s THR 131 N 0.17 0.61 -0.07 0.64 -4.23 -0.71 -1.54 115.64 110.51 1hf3 s THR 131 Ca -0.13 -0.90 -0.03 0.00 -1.18 0.00 0.00 61.69 59.46 1hf3 s THR 131 Cb -0.16 -0.63 0.04 0.00 1.34 0.00 0.00 72.50 73.09 1hf3 s THR 131 CO 0.07 -0.22 0.15 0.00 -0.54 0.00 0.00 174.62 174.08 1hf3 n ARG 133 N 4.72 -4.45 0.00 0.00 1.74 -1.26 0.37 116.66 117.78 1hf3 n ARG 133 Ca -0.17 0.57 0.00 0.00 -0.77 0.00 0.00 57.85 57.48 1hf3 n ARG 133 Cb 0.51 -5.38 0.00 0.00 -1.02 0.00 0.00 32.46 26.57 1hf3 n ARG 133 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1hf3 n GLY 134 N -1.45 2.74 3.88 -0.13 0.00 -1.26 -5.00 105.19 103.97 1hf3 n GLY 134 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 1hf3 n GLY 134 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hf3 s LYS 135 N 0.00 3.61 0.32 1.61 -0.14 0.16 -5.05 119.74 120.24 1hf3 s LYS 135 Ca 0.00 -0.02 -0.29 0.00 -1.36 0.00 0.00 55.97 54.30 1hf3 s LYS 135 Cb 0.00 -3.09 -0.10 0.00 -1.68 0.00 0.00 37.83 32.96 1hf3 s LYS 135 CO 0.00 0.66 1.32 -1.25 -0.76 0.00 0.00 175.35 175.31 1hf3 s PRO 136 N -1.65 4.35 -0.07 -1.68 0.04 -1.26 -0.65 135.00 134.08 1hf3 s PRO 136 Ca 0.27 2.21 0.05 0.00 0.04 0.00 0.00 61.00 63.57 1hf3 s PRO 136 Cb -0.13 -3.08 -0.01 0.00 0.04 0.00 0.00 34.50 31.31 1hf3 s PRO 136 CO 0.15 -0.21 -0.23 0.42 0.04 0.00 0.00 177.00 177.17 1hf3 s ILE 137 N -0.97 2.21 0.60 0.56 -1.09 -0.59 -4.79 121.20 117.13 1hf3 s ILE 137 Ca 0.50 -1.00 -0.14 0.00 -2.23 0.00 0.00 60.65 57.77 1hf3 s ILE 137 Cb -0.40 -1.82 -0.04 0.00 -1.58 0.00 0.00 42.46 38.63 1hf3 s ILE 137 CO 0.51 0.57 1.04 -1.00 -1.23 0.00 0.00 174.94 174.83 1hf3 s HIS 138 N -0.11 3.17 0.73 3.97 3.76 -0.43 -4.40 115.29 121.98 1hf3 s HIS 138 Ca -0.05 1.46 -0.07 0.00 -0.15 0.00 0.00 55.06 56.25 1hf3 s HIS 138 Cb -0.14 -2.91 0.07 0.00 1.11 0.00 0.00 32.58 30.71 1hf3 s HIS 138 CO 0.04 -0.94 1.05 -1.01 -0.85 0.00 0.00 174.74 173.03 1hf3 s HIS 139 N -2.68 2.77 -0.15 1.40 3.76 0.69 -1.85 115.29 119.23 1hf3 s HIS 139 Ca 0.61 0.42 -0.02 0.00 -0.15 0.00 0.00 55.06 55.92 1hf3 s HIS 139 Cb -0.14 -3.27 0.04 0.00 1.11 0.00 0.00 32.58 30.33 1hf3 s HIS 139 CO 0.41 -1.53 -0.00 0.12 -0.85 0.00 0.00 174.74 172.88 1hf3 s PHE 140 N -3.31 1.17 -1.48 1.40 5.36 -1.24 -4.35 117.98 115.53 1hf3 s PHE 140 Ca 0.61 -0.76 0.00 0.00 -0.96 0.00 0.00 56.93 55.83 1hf3 s PHE 140 Cb -0.10 -1.07 0.00 0.00 -0.34 0.00 0.00 43.02 41.51 1hf3 s PHE 140 CO 0.46 -0.54 0.00 1.28 -1.46 0.00 0.00 175.22 174.96 1hf3 n LEU 141 N 5.01 -1.59 -0.41 6.12 4.77 -1.26 -0.54 117.00 129.10 1hf3 n LEU 141 Ca -0.09 0.08 -0.05 0.00 -0.03 0.00 0.00 56.01 55.92 1hf3 n LEU 141 Cb 0.48 -2.60 -0.02 0.00 -2.33 0.00 0.00 43.42 38.95 1hf3 n LEU 141 CO 0.14 -0.20 -0.05 0.61 -1.33 0.00 0.00 177.39 176.56 1hf3 n GLY 142 N -0.91 0.71 1.14 -0.72 0.00 -1.26 -4.48 105.19 99.67 1hf3 n GLY 142 Ca -0.20 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.58 1hf3 n GLY 142 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1hf3 n THR 143 N -2.56 1.03 -3.21 2.61 -2.24 0.30 -4.53 114.28 105.67 1hf3 n THR 143 Ca -0.05 0.34 -0.20 0.00 -2.27 0.00 0.00 64.05 61.86 1hf3 n THR 143 Cb 0.31 -1.44 0.02 0.00 -2.10 0.00 0.00 70.33 67.13 1hf3 n THR 143 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1hf3 n SER 144 N -3.42 -6.73 -0.92 3.42 7.64 -0.95 -4.69 113.62 107.97 1hf3 n SER 144 Ca 0.00 0.06 0.10 0.00 1.01 0.00 0.00 58.87 60.04 1hf3 n SER 144 Cb 0.00 -3.64 0.15 0.00 -1.01 0.00 0.00 64.21 59.72 1hf3 n SER 144 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1hf3 n THR 145 N -0.65 0.38 -1.93 0.44 -2.24 0.17 -4.43 114.28 106.03 1hf3 n THR 145 Ca -0.01 -0.69 -0.37 0.00 -2.27 0.00 0.00 64.05 60.71 1hf3 n THR 145 Cb 0.57 1.06 -0.01 0.00 -2.10 0.00 0.00 70.33 69.85 1hf3 n THR 145 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1hf3 n PHE 146 N 1.17 2.36 -3.57 4.78 3.72 -0.45 -4.83 117.46 120.65 1hf3 n PHE 146 Ca 0.15 -2.53 -0.17 0.00 -0.05 0.00 0.00 57.45 54.85 1hf3 n PHE 146 Cb 0.52 -1.61 -0.06 0.00 -0.94 0.00 0.00 39.48 37.38 1hf3 n PHE 146 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1hf3 s SER 147 N 0.11 -0.57 0.25 4.37 0.15 -1.26 -0.69 113.70 116.06 1hf3 s SER 147 Ca 0.54 0.59 -0.02 0.00 0.70 0.00 0.00 55.95 57.76 1hf3 s SER 147 Cb 0.25 0.50 0.32 0.00 -1.71 0.00 0.00 66.02 65.37 1hf3 s SER 147 CO -0.15 -0.58 1.72 1.56 1.20 0.00 0.00 173.24 176.99 1hf3 h GLN 148 N 3.16 0.73 -4.99 5.44 4.20 -1.40 -3.40 115.11 118.84 1hf3 h GLN 148 Ca -0.28 -0.23 -0.41 0.00 0.06 0.00 0.00 58.65 57.80 1hf3 h GLN 148 Cb 1.15 -0.07 -0.26 0.00 0.30 0.00 0.00 27.48 28.60 1hf3 h GLN 148 CO 0.39 0.81 -0.78 0.71 -0.67 0.00 0.00 178.83 179.29 1hf3 s TYR 149 N -4.81 1.00 0.11 2.96 1.51 -1.26 -0.90 117.35 115.96 1hf3 s TYR 149 Ca -0.09 -0.28 -0.02 0.00 -1.01 0.00 0.00 57.07 55.68 1hf3 s TYR 149 Cb 0.14 -0.61 -0.04 0.00 -0.11 0.00 0.00 41.96 41.34 1hf3 s TYR 149 CO 0.81 -0.00 0.05 -0.08 -1.11 0.00 0.00 175.55 175.22 1hf3 s THR 150 N -0.60 0.13 -0.11 -0.71 -1.32 -0.40 -4.97 115.64 107.66 1hf3 s THR 150 Ca 0.01 -1.85 0.04 0.00 -1.21 0.00 0.00 61.69 58.68 1hf3 s THR 150 Cb -0.06 -1.91 0.00 0.00 -1.51 0.00 0.00 72.50 69.02 1hf3 s THR 150 CO 0.00 -0.57 -0.23 -0.69 -2.21 0.00 0.00 174.62 170.92 1hf3 s VAL 151 N -4.01 2.09 0.08 5.08 1.01 -1.26 -0.10 120.40 123.28 1hf3 s VAL 151 Ca 0.20 -1.00 0.03 0.00 0.00 0.00 0.00 61.98 61.20 1hf3 s VAL 151 Cb 0.07 -1.80 -0.03 0.00 0.00 0.00 0.00 36.38 34.62 1hf3 s VAL 151 CO -0.01 0.56 -0.09 0.68 0.00 0.00 0.00 175.10 176.24 1hf3 s VAL 152 N 0.42 0.79 0.60 2.92 -7.23 0.22 -4.83 120.40 113.29 1hf3 s VAL 152 Ca -0.17 -1.49 -0.17 0.00 -1.81 0.00 0.00 61.98 58.35 1hf3 s VAL 152 Cb -0.18 -1.16 -0.03 0.00 0.56 0.00 0.00 36.38 35.58 1hf3 s VAL 152 CO 0.07 -0.53 1.10 -1.81 -0.31 0.00 0.00 175.10 173.62 1hf3 s ASP 153 N -2.22 5.54 0.48 4.85 1.01 -1.26 -0.51 116.67 124.55 1hf3 s ASP 153 Ca 0.01 1.99 0.14 0.00 0.71 0.00 0.00 52.55 55.40 1hf3 s ASP 153 Cb -0.04 -2.55 1.11 0.00 1.01 0.00 0.00 42.92 42.44 1hf3 s ASP 153 CO -0.01 -1.34 2.08 -0.08 0.21 0.00 0.00 175.17 176.03 1hf3 h GLU 154 N 0.55 0.08 0.00 8.23 4.81 -1.38 0.90 114.58 127.78 1hf3 h GLU 154 Ca -0.48 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 1hf3 h GLU 154 Cb 1.24 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.60 1hf3 h GLU 154 CO 0.56 0.12 0.00 0.44 -0.73 0.00 0.00 179.01 179.40 1hf3 n ILE 155 N -4.45 0.67 -1.54 2.32 -5.35 -1.26 -2.80 119.36 106.95 1hf3 n ILE 155 Ca -0.02 0.15 -0.08 0.00 -0.27 0.00 0.00 62.75 62.53 1hf3 n ILE 155 Cb 0.14 -0.85 0.17 0.00 -1.74 0.00 0.00 39.64 37.36 1hf3 n ILE 155 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1hf3 n SER 156 N -1.61 2.99 -3.78 7.28 7.64 0.31 -1.08 113.62 125.37 1hf3 n SER 156 Ca 0.04 -3.81 -0.13 0.00 1.01 0.00 0.00 58.87 55.99 1hf3 n SER 156 Cb 0.24 -0.61 -0.11 0.00 -1.01 0.00 0.00 64.21 62.72 1hf3 n SER 156 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1hf3 s VAL 157 N -3.52 0.01 -0.08 0.44 0.11 -1.12 0.36 120.40 116.60 1hf3 s VAL 157 Ca 0.46 -0.11 0.04 0.00 -2.93 0.00 0.00 61.98 59.43 1hf3 s VAL 157 Cb 0.41 -0.43 0.00 0.00 -1.53 0.00 0.00 36.38 34.84 1hf3 s VAL 157 CO -0.01 -0.06 -0.20 0.00 -3.33 0.00 0.00 175.10 171.50 1hf3 s ALA 158 N -0.16 1.87 0.05 1.54 0.00 -0.91 -4.93 121.76 119.22 1hf3 s ALA 158 Ca -0.03 -0.80 -0.30 0.00 0.00 0.00 0.00 51.96 50.83 1hf3 s ALA 158 Cb -0.03 -0.72 -0.05 0.00 0.00 0.00 0.00 23.12 22.33 1hf3 s ALA 158 CO 0.01 0.25 1.06 0.21 0.00 0.00 0.00 175.76 177.29 1hf3 s LYS 159 N 0.39 4.53 0.52 0.00 2.20 -1.26 -1.31 119.74 124.82 1hf3 s LYS 159 Ca -0.16 1.57 0.01 0.00 -0.36 0.00 0.00 55.97 57.03 1hf3 s LYS 159 Cb -0.17 -3.40 -0.00 0.00 -1.51 0.00 0.00 37.83 32.75 1hf3 s LYS 159 CO 0.07 -0.08 0.04 0.96 -0.36 0.00 0.00 175.35 175.98 1hf3 s ILE 160 N 0.81 1.12 0.14 5.43 -4.36 -0.49 -4.64 121.20 119.21 1hf3 s ILE 160 Ca 0.54 -1.95 -0.31 0.00 -0.26 0.00 0.00 60.65 58.66 1hf3 s ILE 160 Cb -0.25 -2.08 -0.11 0.00 1.25 0.00 0.00 42.46 41.28 1hf3 s ILE 160 CO 0.29 0.00 1.82 -0.62 0.24 0.00 0.00 174.94 176.67 1hf3 s ASP 161 N -3.93 6.41 0.63 4.36 -1.08 -1.26 -4.52 116.67 117.27 1hf3 s ASP 161 Ca 0.06 2.79 0.32 0.00 -0.52 0.00 0.00 52.55 55.20 1hf3 s ASP 161 Cb 0.00 -2.57 1.77 0.00 -1.46 0.00 0.00 42.92 40.66 1hf3 s ASP 161 CO 0.03 -1.01 2.06 0.00 0.52 0.00 0.00 175.17 176.78 1hf3 h ALA 162 N 8.32 1.53 -0.05 3.66 0.00 -1.99 0.53 119.26 131.27 1hf3 h ALA 162 Ca -0.46 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1hf3 h ALA 162 Cb 1.22 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1hf3 h ALA 162 CO 0.95 -0.31 0.00 0.00 0.00 0.00 0.00 179.25 179.90 1hf3 n ALA 163 N -2.13 2.49 -1.79 0.00 0.00 -1.26 -4.94 120.51 112.88 1hf3 n ALA 163 Ca 0.00 -0.64 -0.41 0.00 0.00 0.00 0.00 53.44 52.39 1hf3 n ALA 163 Cb 0.34 -0.91 -0.01 0.00 0.00 0.00 0.00 19.45 18.86 1hf3 n ALA 163 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1hf3 s SER 164 N -1.96 6.55 -0.54 0.00 1.04 0.19 -4.92 113.70 114.05 1hf3 s SER 164 Ca 0.31 2.84 -0.27 0.00 0.48 0.00 0.00 55.95 59.32 1hf3 s SER 164 Cb 0.20 -2.65 -0.01 0.00 0.10 0.00 0.00 66.02 63.66 1hf3 s SER 164 CO 0.31 -0.73 1.78 -2.16 0.98 0.00 0.00 173.24 173.41 1hf3 s PRO 165 N -1.48 2.89 0.59 4.02 0.04 -1.26 -4.89 135.00 134.91 1hf3 s PRO 165 Ca 0.54 0.76 0.29 0.00 0.04 0.00 0.00 61.00 62.63 1hf3 s PRO 165 Cb -0.43 -4.30 1.72 0.00 0.04 0.00 0.00 34.50 31.52 1hf3 s PRO 165 CO 0.54 -2.42 2.18 -0.07 0.04 0.00 0.00 177.00 177.27 1hf3 h LEU 166 N 15.30 0.00 -0.32 -3.56 3.38 -1.97 -0.94 115.31 127.21 1hf3 h LEU 166 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 1hf3 h LEU 166 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1hf3 h LEU 166 CO 1.17 0.00 -0.10 -1.84 0.09 0.00 0.00 178.44 177.76 1hf3 n GLU 167 N -3.86 0.84 -0.07 1.13 0.00 -1.26 -2.81 120.64 114.61 1hf3 n GLU 167 Ca -0.01 -0.32 -0.15 0.00 0.00 0.00 0.00 57.16 56.69 1hf3 n GLU 167 Cb 0.20 -1.49 -0.05 0.00 0.00 0.00 0.00 31.44 30.10 1hf3 n GLU 167 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1hf3 n LYS 168 N -0.80 0.33 0.00 3.44 5.02 -0.42 -4.70 118.16 121.03 1hf3 n LYS 168 Ca 0.16 0.14 0.07 0.00 -2.02 0.00 0.00 58.31 56.66 1hf3 n LYS 168 Cb 0.28 -1.06 0.32 0.00 -0.02 0.00 0.00 35.03 34.55 1hf3 n LYS 168 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1hf3 n VAL 169 N -3.77 0.81 0.11 -0.18 0.24 -0.81 -2.39 118.33 112.34 1hf3 n VAL 169 Ca -0.27 0.20 0.10 0.00 -2.04 0.00 0.00 64.34 62.33 1hf3 n VAL 169 Cb 0.65 -0.97 0.58 0.00 -1.47 0.00 0.00 33.84 32.62 1hf3 n VAL 169 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1hf3 h LEU 171 N 0.19 0.00 -1.57 0.00 3.38 -1.80 -0.77 115.31 114.74 1hf3 h LEU 171 Ca 0.12 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 1hf3 h LEU 171 Cb 0.23 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 1hf3 h LEU 171 CO -0.02 0.05 -0.07 0.40 0.09 0.00 0.00 178.44 178.89 1hf3 h ILE 172 N 0.00 0.21 0.00 1.22 2.04 -1.46 -1.84 117.51 117.69 1hf3 h ILE 172 Ca -0.00 -0.62 0.00 0.00 1.00 0.00 0.00 64.86 65.24 1hf3 h ILE 172 Cb 0.34 1.51 0.00 0.00 -0.74 0.00 0.00 36.82 37.93 1hf3 h ILE 172 CO 0.01 0.07 0.00 0.61 0.00 0.00 0.00 178.15 178.84 1hf3 n GLY 173 N -0.13 -1.27 0.00 5.37 0.00 -0.29 -4.43 105.19 104.44 1hf3 n GLY 173 Ca -0.00 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1hf3 n GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hf3 h GLY 175 N 0.00 -1.11 0.89 0.00 0.00 -1.83 0.22 103.07 101.24 1hf3 h GLY 175 Ca 0.00 0.79 -0.01 0.00 0.00 0.00 0.00 47.33 48.11 1hf3 h GLY 175 CO 0.00 -0.15 -0.05 -2.75 0.00 0.00 0.00 176.54 173.59 1hf3 h PHE 176 N -0.19 -0.13 -0.70 5.60 3.57 -1.61 -2.10 116.94 121.38 1hf3 h PHE 176 Ca 0.10 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.55 1hf3 h PHE 176 Cb 0.45 0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.20 1hf3 h PHE 176 CO -0.85 0.01 0.27 0.77 -2.23 0.00 0.00 178.31 176.28 1hf3 h SER 177 N -0.26 0.97 0.51 0.41 0.02 -1.54 -1.88 113.55 111.78 1hf3 h SER 177 Ca -0.01 -0.18 -0.02 0.00 -0.84 0.00 0.00 61.79 60.74 1hf3 h SER 177 Cb 0.21 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.49 1hf3 h SER 177 CO 0.02 0.88 -0.38 0.74 -1.14 0.00 0.00 176.83 176.96 1hf3 h THR 178 N 1.00 0.24 0.44 -2.27 2.02 -0.53 -0.45 112.91 113.36 1hf3 h THR 178 Ca 0.23 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.39 1hf3 h THR 178 Cb 0.22 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 66.86 1hf3 h THR 178 CO -0.02 0.00 -0.34 1.23 0.37 0.00 0.00 175.52 176.77 1hf3 h GLY 179 N -0.87 -1.04 0.20 2.16 0.00 -1.35 -1.15 103.07 101.02 1hf3 h GLY 179 Ca -0.06 0.45 0.09 0.00 0.00 0.00 0.00 47.33 47.82 1hf3 h GLY 179 CO 0.02 -0.34 -0.01 -1.82 0.00 0.00 0.00 176.54 174.38 1hf3 h TYR 180 N -0.75 -0.06 -0.17 5.60 3.20 -1.16 -1.34 116.97 122.29 1hf3 h TYR 180 Ca -0.06 0.04 -0.07 0.00 3.14 0.00 0.00 58.73 61.78 1hf3 h TYR 180 Cb 0.62 0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.98 1hf3 h TYR 180 CO -0.11 -0.12 -0.19 0.78 -1.64 0.00 0.00 178.16 176.88 1hf3 h GLY 181 N 0.10 0.32 0.87 1.82 0.00 -1.13 -0.73 103.07 104.31 1hf3 h GLY 181 Ca 0.24 -0.22 0.03 0.00 0.00 0.00 0.00 47.33 47.37 1hf3 h GLY 181 CO -0.41 0.20 0.38 1.76 0.00 0.00 0.00 176.54 178.48 1hf3 h SER 182 N 0.27 0.62 0.00 0.19 0.02 -0.05 0.42 113.55 115.01 1hf3 h SER 182 Ca 0.05 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.00 1hf3 h SER 182 Cb 0.50 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.91 1hf3 h SER 182 CO 0.03 0.43 -0.00 0.00 -1.14 0.00 0.00 176.83 176.15 1hf3 h ALA 183 N 1.27 -0.00 0.15 3.77 0.00 -1.20 -0.31 119.26 122.94 1hf3 h ALA 183 Ca 0.25 -0.38 -0.32 0.00 0.00 0.00 0.00 54.91 54.46 1hf3 h ALA 183 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1hf3 h ALA 183 CO -0.10 -0.12 -1.57 0.28 0.00 0.00 0.00 179.25 177.74 1hf3 h VAL 184 N -0.77 1.12 0.00 0.00 2.07 -1.12 -1.42 116.25 116.14 1hf3 h VAL 184 Ca -0.00 -2.73 -0.37 0.00 0.82 0.00 0.00 66.70 64.42 1hf3 h VAL 184 Cb 0.76 2.79 -0.07 0.00 -1.52 0.00 0.00 31.29 33.25 1hf3 h VAL 184 CO 0.00 0.83 -2.38 1.17 0.02 0.00 0.00 177.57 177.21 1hf3 n LYS 185 N -3.51 0.68 -0.02 1.57 4.81 0.13 -3.98 118.16 117.84 1hf3 n LYS 185 Ca -0.18 0.04 -0.01 0.00 -0.87 0.00 0.00 58.31 57.29 1hf3 n LYS 185 Cb 1.06 -1.53 -0.00 0.00 0.02 0.00 0.00 35.03 34.57 1hf3 n LYS 185 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 1hf3 h VAL 186 N 0.00 0.00 -0.31 3.15 2.07 -1.00 -3.38 116.25 116.77 1hf3 h VAL 186 Ca -0.55 -0.24 -0.08 0.00 0.82 0.00 0.00 66.70 66.66 1hf3 h VAL 186 Cb 2.16 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.92 1hf3 h VAL 186 CO 0.01 0.00 -0.13 0.00 0.02 0.00 0.00 177.57 177.47 1hf3 h ALA 187 N -1.76 1.20 -5.64 1.67 0.00 -1.19 -3.48 119.26 110.06 1hf3 h ALA 187 Ca 0.00 -0.28 -0.32 0.00 0.00 0.00 0.00 54.91 54.31 1hf3 h ALA 187 Cb 0.09 -0.14 0.17 0.00 0.00 0.00 0.00 17.79 17.91 1hf3 h ALA 187 CO 0.00 0.52 -0.81 1.63 0.00 0.00 0.00 179.25 180.59 1hf3 n LYS 188 N -4.19 -5.04 -1.47 0.00 4.01 -0.68 -4.90 118.16 105.89 1hf3 n LYS 188 Ca 0.01 0.83 -0.51 0.00 -0.51 0.00 0.00 58.31 58.13 1hf3 n LYS 188 Cb 0.33 -5.76 -0.04 0.00 -0.51 0.00 0.00 35.03 29.04 1hf3 n LYS 188 CO 0.00 0.00 0.00 0.28 -1.11 0.00 0.00 177.40 176.57 1hf3 n VAL 189 N -3.87 1.26 -3.97 -0.18 0.31 -0.62 -4.97 118.33 106.28 1hf3 n VAL 189 Ca -0.22 -0.31 -0.26 0.00 -0.01 0.00 0.00 64.34 63.54 1hf3 n VAL 189 Cb 0.65 -0.21 -0.03 0.00 -0.91 0.00 0.00 33.84 33.34 1hf3 n VAL 189 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1hf3 s THR 190 N -0.59 5.17 0.24 2.52 -4.23 -1.26 -4.86 115.64 112.63 1hf3 s THR 190 Ca 0.73 -0.76 -0.31 0.00 -1.18 0.00 0.00 61.69 60.16 1hf3 s THR 190 Cb -1.00 -3.66 -0.12 0.00 1.34 0.00 0.00 72.50 69.06 1hf3 s THR 190 CO 0.56 -0.10 1.57 0.00 -0.54 0.00 0.00 174.62 176.11 1hf3 n GLN 191 N -0.52 2.46 -0.87 3.99 6.02 -1.20 -2.22 117.38 125.05 1hf3 n GLN 191 Ca -0.07 0.88 0.00 0.00 -0.01 0.00 0.00 57.00 57.80 1hf3 n GLN 191 Cb 0.54 -2.64 0.00 0.00 1.02 0.00 0.00 30.24 29.16 1hf3 n GLN 191 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1hf3 n GLY 192 N 2.68 1.00 3.77 1.08 0.00 -0.85 -4.88 105.19 107.99 1hf3 n GLY 192 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 1hf3 n GLY 192 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1hf3 s SER 193 N -3.02 3.59 -0.18 1.61 1.04 -0.94 -4.03 113.70 111.77 1hf3 s SER 193 Ca 0.00 1.11 -0.03 0.00 0.48 0.00 0.00 55.95 57.51 1hf3 s SER 193 Cb 0.00 -1.75 -0.02 0.00 0.10 0.00 0.00 66.02 64.36 1hf3 s SER 193 CO 0.00 -2.52 -0.06 -0.89 0.98 0.00 0.00 173.24 170.76 1hf3 s THR 194 N -3.18 3.50 0.05 2.02 2.01 -1.26 0.11 115.64 118.90 1hf3 s THR 194 Ca 0.63 -0.48 0.09 0.00 0.31 0.00 0.00 61.69 62.25 1hf3 s THR 194 Cb -0.15 -2.55 -0.03 0.00 0.01 0.00 0.00 72.50 69.78 1hf3 s THR 194 CO 0.54 0.46 -0.26 0.00 -0.69 0.00 0.00 174.62 174.68 1hf3 s ALA 196 N -0.83 1.88 -0.22 0.00 0.00 -0.26 -0.38 121.76 121.95 1hf3 s ALA 196 Ca 0.12 -0.86 0.02 0.00 0.00 0.00 0.00 51.96 51.23 1hf3 s ALA 196 Cb -0.10 -0.91 0.04 0.00 0.00 0.00 0.00 23.12 22.15 1hf3 s ALA 196 CO 0.02 -0.11 -0.15 0.08 0.00 0.00 0.00 175.76 175.60 1hf3 s VAL 197 N 1.02 2.12 -0.29 0.00 1.01 -0.10 -1.32 120.40 122.84 1hf3 s VAL 197 Ca -0.05 -1.32 -0.14 0.00 0.00 0.00 0.00 61.98 60.47 1hf3 s VAL 197 Cb -0.15 -2.09 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 1hf3 s VAL 197 CO -0.03 0.23 0.34 -0.36 0.00 0.00 0.00 175.10 175.28 1hf3 s PHE 198 N 1.19 3.23 0.00 5.22 0.40 -0.29 -0.24 117.98 127.49 1hf3 s PHE 198 Ca -0.03 0.27 0.00 0.00 -0.60 0.00 0.00 56.93 56.58 1hf3 s PHE 198 Cb -0.17 -2.57 0.00 0.00 0.51 0.00 0.00 43.02 40.79 1hf3 s PHE 198 CO -0.09 -0.27 0.00 0.41 0.70 0.00 0.00 175.22 175.98 1hf3 n GLY 199 N 4.80 0.82 2.40 4.36 0.00 0.11 -0.46 105.19 117.22 1hf3 n GLY 199 Ca -0.09 -1.19 -0.25 0.00 0.00 0.00 0.00 46.02 44.48 1hf3 n GLY 199 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1hf3 n LEU 200 N -0.01 4.49 0.00 0.99 4.77 -1.26 -4.05 117.00 121.92 1hf3 n LEU 200 Ca 0.00 -4.98 0.00 0.00 -0.03 0.00 0.00 56.01 51.00 1hf3 n LEU 200 Cb 0.00 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 40.73 1hf3 n LEU 200 CO 0.00 2.15 0.00 0.61 -1.33 0.00 0.00 177.39 178.82 1hf3 n GLY 201 N -0.50 -0.08 0.25 -0.72 0.00 -1.26 -4.64 105.19 98.23 1hf3 n GLY 201 Ca 0.38 -1.74 -0.02 0.00 0.00 0.00 0.00 46.02 44.63 1hf3 n GLY 201 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1hf3 h GLY 202 N 0.00 0.53 1.21 -0.02 0.00 -1.93 -1.11 103.07 101.75 1hf3 h GLY 202 Ca 0.00 -0.38 -0.25 0.00 0.00 0.00 0.00 47.33 46.69 1hf3 h GLY 202 CO 0.00 0.35 -0.96 -2.08 0.00 0.00 0.00 176.54 173.85 1hf3 h VAL 203 N 0.45 1.28 -0.74 4.60 2.07 -1.92 -2.89 116.25 119.09 1hf3 h VAL 203 Ca 0.08 -2.16 0.00 0.00 0.82 0.00 0.00 66.70 65.44 1hf3 h VAL 203 Cb 0.54 2.25 -0.04 0.00 -1.52 0.00 0.00 31.29 32.53 1hf3 h VAL 203 CO 0.03 0.67 0.48 1.23 0.02 0.00 0.00 177.57 180.01 1hf3 h GLY 204 N 0.47 1.06 1.73 2.17 0.00 -1.65 -0.70 103.07 106.14 1hf3 h GLY 204 Ca -0.11 -0.41 -0.07 0.00 0.00 0.00 0.00 47.33 46.74 1hf3 h GLY 204 CO 0.19 0.40 -0.21 1.41 0.00 0.00 0.00 176.54 178.34 1hf3 h LEU 205 N 1.01 0.32 -0.98 3.11 3.38 -1.27 0.24 115.31 121.13 1hf3 h LEU 205 Ca 0.27 -0.09 -0.10 0.00 0.09 0.00 0.00 57.88 58.05 1hf3 h LEU 205 Cb -0.09 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1hf3 h LEU 205 CO -0.06 0.54 -0.42 0.28 0.09 0.00 0.00 178.44 178.87 1hf3 h SER 206 N 0.30 0.18 -0.26 -0.43 0.02 -1.12 -0.93 113.55 111.32 1hf3 h SER 206 Ca 0.05 -0.08 -0.04 0.00 -0.84 0.00 0.00 61.79 60.88 1hf3 h SER 206 Cb 0.54 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.02 1hf3 h SER 206 CO 0.04 0.59 -0.01 0.58 -1.14 0.00 0.00 176.83 176.89 1hf3 h VAL 207 N 0.14 1.26 -0.45 2.27 2.07 0.85 -1.30 116.25 121.10 1hf3 h VAL 207 Ca 0.01 -0.93 0.09 0.00 0.82 0.00 0.00 66.70 66.69 1hf3 h VAL 207 Cb 0.81 1.36 -0.09 0.00 -1.52 0.00 0.00 31.29 31.86 1hf3 h VAL 207 CO 0.06 0.29 -0.12 0.40 0.02 0.00 0.00 177.57 178.23 1hf3 h ILE 208 N 0.23 0.54 -0.87 4.57 2.04 -0.77 0.74 117.51 124.00 1hf3 h ILE 208 Ca 0.07 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.96 1hf3 h ILE 208 Cb 0.43 0.54 -0.05 0.00 -0.74 0.00 0.00 36.82 37.00 1hf3 h ILE 208 CO 0.01 0.00 0.56 0.24 0.00 0.00 0.00 178.15 178.97 1hf3 h MET 209 N -0.01 1.07 -0.57 2.37 2.86 -0.91 -0.09 114.93 119.66 1hf3 h MET 209 Ca 0.22 -0.06 -0.07 0.00 -2.06 0.00 0.00 59.70 57.72 1hf3 h MET 209 Cb 0.33 -0.24 -0.02 0.00 0.06 0.00 0.00 31.60 31.73 1hf3 h MET 209 CO -0.47 0.71 0.08 0.78 1.06 0.00 0.00 176.91 179.07 1hf3 h GLY 210 N 1.11 1.02 1.07 8.32 0.00 0.08 -0.07 103.07 114.60 1hf3 h GLY 210 Ca 0.34 -0.69 -0.07 0.00 0.00 0.00 0.00 47.33 46.91 1hf3 h GLY 210 CO -0.10 0.64 0.19 0.00 0.00 0.00 0.00 176.54 177.27 1hf3 h LYS 212 N 1.10 0.98 -0.11 0.00 3.64 -0.98 0.30 116.57 121.49 1hf3 h LYS 212 Ca 0.23 -0.38 -0.07 0.00 -1.27 0.00 0.00 60.65 59.16 1hf3 h LYS 212 Cb 0.36 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 1hf3 h LYS 212 CO -0.00 1.06 -0.25 0.00 -2.27 0.00 0.00 179.45 177.98 1hf3 h ALA 213 N 0.95 1.37 -0.00 5.00 0.00 -0.69 -2.09 119.26 123.79 1hf3 h ALA 213 Ca 0.12 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1hf3 h ALA 213 Cb 0.72 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1hf3 h ALA 213 CO 0.06 0.44 -0.15 0.00 0.00 0.00 0.00 179.25 179.59 1hf3 n ALA 214 N -2.48 2.80 -0.59 0.00 0.00 -0.40 -4.92 120.51 114.91 1hf3 n ALA 214 Ca -0.01 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.19 1hf3 n ALA 214 Cb 0.35 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.47 1hf3 n ALA 214 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hf3 n GLY 215 N 1.37 1.24 3.70 0.00 0.00 -0.79 -3.22 105.19 107.48 1hf3 n GLY 215 Ca 0.11 -0.33 -0.43 0.00 0.00 0.00 0.00 46.02 45.37 1hf3 n GLY 215 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hf3 n ALA 216 N -0.99 1.45 0.09 4.61 0.00 0.10 -2.02 120.51 123.76 1hf3 n ALA 216 Ca 0.00 0.38 -0.04 0.00 0.00 0.00 0.00 53.44 53.78 1hf3 n ALA 216 Cb 0.12 -2.30 -0.00 0.00 0.00 0.00 0.00 19.45 17.27 1hf3 n ALA 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hf3 h ALA 217 N 3.57 0.59 -3.14 0.00 0.00 -0.46 -3.45 119.26 116.37 1hf3 h ALA 217 Ca -0.46 -0.76 -0.22 0.00 0.00 0.00 0.00 54.91 53.47 1hf3 h ALA 217 Cb 1.27 -0.13 -0.31 0.00 0.00 0.00 0.00 17.79 18.62 1hf3 h ALA 217 CO 0.70 1.04 -0.54 0.50 0.00 0.00 0.00 179.25 180.96 1hf3 s ARG 218 N -3.05 0.15 -0.29 0.00 3.52 -0.45 -4.99 118.95 113.84 1hf3 s ARG 218 Ca 0.00 0.44 -0.02 0.00 -0.13 0.00 0.00 55.73 56.03 1hf3 s ARG 218 Cb 0.11 -0.14 0.09 0.00 -1.56 0.00 0.00 34.95 33.45 1hf3 s ARG 218 CO 0.79 -0.16 0.10 0.42 -0.81 0.00 0.00 175.30 175.64 1hf3 s ILE 219 N 1.17 0.56 -0.30 4.11 1.01 -1.26 0.40 121.20 126.88 1hf3 s ILE 219 Ca -0.09 -1.11 -0.18 0.00 0.00 0.00 0.00 60.65 59.27 1hf3 s ILE 219 Cb -0.11 -1.39 -0.01 0.00 0.01 0.00 0.00 42.46 40.96 1hf3 s ILE 219 CO -0.07 -0.63 0.53 -0.63 0.00 0.00 0.00 174.94 174.14 1hf3 s ILE 220 N 1.79 5.02 0.09 2.92 1.01 0.49 0.69 121.20 133.22 1hf3 s ILE 220 Ca 0.08 0.66 -0.16 0.00 0.00 0.00 0.00 60.65 61.23 1hf3 s ILE 220 Cb -0.17 -3.91 -0.07 0.00 0.01 0.00 0.00 42.46 38.33 1hf3 s ILE 220 CO -0.26 -0.08 0.52 -0.83 0.00 0.00 0.00 174.94 174.29 1hf3 s GLY 221 N 1.66 2.52 -0.07 6.18 0.00 -0.75 -0.92 107.32 115.94 1hf3 s GLY 221 Ca 0.21 -0.12 0.01 0.00 0.00 0.00 0.00 44.72 44.82 1hf3 s GLY 221 CO 0.11 0.22 -0.06 0.14 0.00 0.00 0.00 173.10 173.51 1hf3 s VAL 222 N -1.28 0.73 -0.04 1.40 1.01 0.67 -1.18 120.40 121.71 1hf3 s VAL 222 Ca 0.32 -0.19 -0.29 0.00 0.00 0.00 0.00 61.98 61.83 1hf3 s VAL 222 Cb -0.17 -0.76 0.06 0.00 0.00 0.00 0.00 36.38 35.52 1hf3 s VAL 222 CO 0.18 0.29 0.62 -0.62 0.00 0.00 0.00 175.10 175.57 1hf3 s ASP 223 N 1.22 -0.59 0.00 3.32 -1.08 -1.10 0.04 116.67 118.48 1hf3 s ASP 223 Ca -0.06 0.62 0.28 0.00 -0.52 0.00 0.00 52.55 52.87 1hf3 s ASP 223 Cb -0.14 0.51 1.16 0.00 -1.46 0.00 0.00 42.92 42.99 1hf3 s ASP 223 CO -0.02 -0.59 1.81 2.30 0.52 0.00 0.00 175.17 179.19 1hf3 n ILE 224 N 0.95 0.00 -3.74 4.11 -5.35 -1.26 -4.12 119.36 109.94 1hf3 n ILE 224 Ca -0.19 -0.16 -0.36 0.00 -0.27 0.00 0.00 62.75 61.77 1hf3 n ILE 224 Cb 0.57 0.22 -0.11 0.00 -1.74 0.00 0.00 39.64 38.59 1hf3 n ILE 224 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1hf3 s ASN 225 N -2.17 5.27 0.61 7.28 3.84 -1.26 -4.95 114.94 123.56 1hf3 s ASN 225 Ca 0.35 -2.36 0.34 0.00 0.21 0.00 0.00 52.86 51.40 1hf3 s ASN 225 Cb 0.21 -1.85 1.99 0.00 -0.55 0.00 0.00 41.25 41.05 1hf3 s ASN 225 CO 0.40 -0.48 2.29 0.07 -2.79 0.00 0.00 177.10 176.59 1hf3 h LYS 226 N 7.66 0.00 0.00 0.43 2.10 -1.98 -0.19 116.57 124.59 1hf3 h LYS 226 Ca -0.09 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.56 1hf3 h LYS 226 Cb 1.01 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.34 1hf3 h LYS 226 CO 0.71 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.91 1hf3 n ASP 227 N -3.65 0.00 -0.11 7.07 8.00 -1.26 -1.32 116.55 125.28 1hf3 n ASP 227 Ca -0.03 0.26 0.13 0.00 0.71 0.00 0.00 54.79 55.86 1hf3 n ASP 227 Cb 0.08 -0.38 0.37 0.00 -0.02 0.00 0.00 41.12 41.18 1hf3 n ASP 227 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1hf3 n LYS 228 N -1.38 0.41 -0.24 -1.24 4.76 -0.08 -4.39 118.16 116.00 1hf3 n LYS 228 Ca 0.05 -0.22 -0.08 0.00 -2.87 0.00 0.00 58.31 55.20 1hf3 n LYS 228 Cb 0.13 -1.50 0.04 0.00 -1.84 0.00 0.00 35.03 31.87 1hf3 n LYS 228 CO 0.00 0.00 0.00 0.74 -1.37 0.00 0.00 177.40 176.77 1hf3 h PHE 229 N 0.53 1.16 -0.39 2.13 0.04 -1.37 -1.89 116.94 117.16 1hf3 h PHE 229 Ca 0.00 -0.14 -0.02 0.00 2.80 0.00 0.00 57.97 60.61 1hf3 h PHE 229 Cb 0.48 -0.33 -0.02 0.00 2.20 0.00 0.00 35.95 38.29 1hf3 h PHE 229 CO 0.00 0.95 0.17 0.00 -0.60 0.00 0.00 178.31 178.83 1hf3 h ALA 230 N 1.07 0.51 -0.71 2.45 0.00 -1.78 0.25 119.26 121.04 1hf3 h ALA 230 Ca 0.21 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1hf3 h ALA 230 Cb 0.39 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1hf3 h ALA 230 CO 0.00 0.10 0.39 -0.22 0.00 0.00 0.00 179.25 179.53 1hf3 h LYS 231 N 0.49 0.99 -0.30 0.00 3.64 -1.82 0.18 116.57 119.76 1hf3 h LYS 231 Ca 0.13 -0.11 0.04 0.00 -1.27 0.00 0.00 60.65 59.44 1hf3 h LYS 231 Cb 0.17 -0.20 -0.04 0.00 -0.41 0.00 0.00 32.23 31.75 1hf3 h LYS 231 CO -0.01 0.74 0.06 0.00 -2.27 0.00 0.00 179.45 177.97 1hf3 h ALA 232 N 1.20 0.31 -0.94 5.00 0.00 -0.39 -0.10 119.26 124.35 1hf3 h ALA 232 Ca 0.25 0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.26 1hf3 h ALA 232 Cb 0.03 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.84 1hf3 h ALA 232 CO -0.04 -0.35 0.62 0.87 0.00 0.00 0.00 179.25 180.34 1hf3 h LYS 233 N 0.17 1.12 -0.96 0.00 1.57 -0.30 0.34 116.57 118.52 1hf3 h LYS 233 Ca 0.14 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1hf3 h LYS 233 Cb 0.15 -0.25 -0.05 0.00 0.08 0.00 0.00 32.23 32.16 1hf3 h LYS 233 CO -0.18 0.74 0.59 1.49 -0.57 0.00 0.00 179.45 181.52 1hf3 h GLU 234 N 1.16 1.29 -0.14 3.15 4.81 0.59 -2.16 114.58 123.29 1hf3 h GLU 234 Ca 0.38 -0.11 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 1hf3 h GLU 234 Cb 0.06 -0.27 0.00 0.00 0.63 0.00 0.00 28.75 29.16 1hf3 h GLU 234 CO -0.12 0.89 0.00 1.33 -0.73 0.00 0.00 179.01 180.38 1hf3 n VAL 235 N -4.36 0.17 0.00 0.32 0.24 -0.17 -4.90 118.33 109.63 1hf3 n VAL 235 Ca 0.11 -0.33 0.00 0.00 -2.04 0.00 0.00 64.34 62.08 1hf3 n VAL 235 Cb 0.05 0.41 0.00 0.00 -1.47 0.00 0.00 33.84 32.83 1hf3 n VAL 235 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1hf3 n GLY 236 N 1.14 0.78 3.76 7.63 0.00 -0.74 -4.30 105.19 113.47 1hf3 n GLY 236 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 1hf3 n GLY 236 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hf3 s ALA 237 N -0.19 3.03 -0.13 4.61 0.00 0.03 -4.71 121.76 124.41 1hf3 s ALA 237 Ca 0.00 1.25 0.18 0.00 0.00 0.00 0.00 51.96 53.39 1hf3 s ALA 237 Cb 0.00 -3.52 -0.17 0.00 0.00 0.00 0.00 23.12 19.43 1hf3 s ALA 237 CO 0.00 -1.07 0.68 0.25 0.00 0.00 0.00 175.76 175.62 1hf3 n THR 238 N -0.50 1.03 -3.60 0.00 -2.24 0.22 -4.30 114.28 104.88 1hf3 n THR 238 Ca 0.07 -0.68 -0.11 0.00 -2.27 0.00 0.00 64.05 61.06 1hf3 n THR 238 Cb 0.45 -0.58 -0.03 0.00 -2.10 0.00 0.00 70.33 68.06 1hf3 n THR 238 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1hf3 s GLU 239 N -2.96 1.23 -0.01 -0.78 -1.05 -1.21 -5.00 118.70 108.92 1hf3 s GLU 239 Ca -0.05 -0.68 0.01 0.00 -0.15 0.00 0.00 54.97 54.11 1hf3 s GLU 239 Cb 0.09 0.52 0.00 0.00 -0.44 0.00 0.00 34.13 34.31 1hf3 s GLU 239 CO 0.83 -0.51 -0.03 0.00 0.95 0.00 0.00 175.26 176.49 1hf3 s VAL 241 N 0.13 2.05 -0.22 0.00 -7.23 -0.32 -4.94 120.40 109.87 1hf3 s VAL 241 Ca -0.01 -1.56 0.00 0.00 -1.81 0.00 0.00 61.98 58.60 1hf3 s VAL 241 Cb -0.04 -1.80 0.03 0.00 0.56 0.00 0.00 36.38 35.13 1hf3 s VAL 241 CO -0.00 0.14 -0.14 0.21 -0.31 0.00 0.00 175.10 175.00 1hf3 s ASN 242 N -1.73 3.79 0.49 4.85 3.84 -1.26 -2.69 114.94 122.23 1hf3 s ASN 242 Ca 0.11 -0.85 0.28 0.00 0.21 0.00 0.00 52.86 52.61 1hf3 s ASN 242 Cb -0.10 -1.56 1.36 0.00 -0.55 0.00 0.00 41.25 40.40 1hf3 s ASN 242 CO 0.04 -0.07 1.85 -0.65 -2.79 0.00 0.00 177.10 175.48 1hf3 h PRO 243 N 7.93 0.14 0.00 0.43 0.11 -1.95 -2.07 132.00 136.59 1hf3 h PRO 243 Ca -0.36 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1hf3 h PRO 243 Cb 1.11 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1hf3 h PRO 243 CO 0.58 0.09 0.00 1.04 -0.21 0.00 0.00 178.00 179.50 1hf3 n GLN 244 N -4.36 0.02 0.16 1.05 6.02 -1.26 -2.81 117.38 116.20 1hf3 n GLN 244 Ca 0.21 0.14 0.12 0.00 -0.01 0.00 0.00 57.00 57.47 1hf3 n GLN 244 Cb 0.95 -1.50 0.24 0.00 1.02 0.00 0.00 30.24 30.95 1hf3 n GLN 244 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.06 175.61 1hf3 h ASP 245 N 0.00 0.00 -2.80 1.08 3.32 -1.80 -3.47 116.42 112.75 1hf3 h ASP 245 Ca 0.00 -0.01 -0.59 0.00 0.02 0.00 0.00 57.03 56.45 1hf3 h ASP 245 Cb 0.34 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.83 1hf3 h ASP 245 CO 0.00 0.01 -0.56 -0.31 -1.72 0.00 0.00 179.24 176.65 1hf3 s TYR 246 N -3.18 3.20 -0.91 4.55 1.51 -1.12 -5.00 117.35 116.39 1hf3 s TYR 246 Ca 0.08 0.02 0.22 0.00 -1.01 0.00 0.00 57.07 56.38 1hf3 s TYR 246 Cb 0.08 -1.56 0.02 0.00 -0.11 0.00 0.00 41.96 40.40 1hf3 s TYR 246 CO 0.66 0.52 1.05 1.63 -1.11 0.00 0.00 175.55 178.30 1hf3 n LYS 247 N -0.17 0.06 -4.08 -0.62 5.02 -1.26 -4.87 118.16 112.25 1hf3 n LYS 247 Ca -0.08 -0.01 -0.33 0.00 -2.02 0.00 0.00 58.31 55.87 1hf3 n LYS 247 Cb 0.54 -1.51 -0.07 0.00 -0.02 0.00 0.00 35.03 33.97 1hf3 n LYS 247 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1hf3 s LYS 248 N -3.05 3.11 0.38 1.97 1.02 -1.26 -5.08 119.74 116.84 1hf3 s LYS 248 Ca 0.08 -0.46 -0.25 0.00 0.02 0.00 0.00 55.97 55.35 1hf3 s LYS 248 Cb 0.16 -2.89 -0.12 0.00 -0.52 0.00 0.00 37.83 34.47 1hf3 s LYS 248 CO 0.81 0.65 1.00 -2.30 -0.92 0.00 0.00 175.35 174.59 1hf3 n PRO 249 N 1.17 1.35 0.18 -1.68 -0.02 -1.26 -4.79 135.00 129.95 1hf3 n PRO 249 Ca -0.13 0.48 0.14 0.00 -2.02 0.00 0.00 63.50 61.97 1hf3 n PRO 249 Cb 0.53 -1.98 0.59 0.00 -0.02 0.00 0.00 33.50 32.62 1hf3 n PRO 249 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1hf3 h ILE 250 N 1.66 0.00 -0.12 4.25 6.09 -1.96 -1.59 117.51 125.84 1hf3 h ILE 250 Ca -0.43 -0.26 -0.15 0.00 -1.37 0.00 0.00 64.86 62.65 1hf3 h ILE 250 Cb 1.34 1.04 -0.01 0.00 0.47 0.00 0.00 36.82 39.66 1hf3 h ILE 250 CO 0.58 0.00 -0.56 0.06 -3.07 0.00 0.00 178.15 175.15 1hf3 h GLN 251 N 0.00 0.37 -0.24 2.19 -0.00 -1.89 -0.47 115.11 115.07 1hf3 h GLN 251 Ca 0.00 -0.24 -0.11 0.00 -0.00 0.00 0.00 58.65 58.30 1hf3 h GLN 251 Cb 0.34 0.03 -0.00 0.00 -0.00 0.00 0.00 27.48 27.84 1hf3 h GLN 251 CO 0.00 0.84 -0.27 1.49 -0.00 0.00 0.00 178.83 180.89 1hf3 h GLU 252 N 0.28 0.61 -0.17 0.06 4.81 -1.64 -0.15 114.58 118.38 1hf3 h GLU 252 Ca 0.00 -0.33 0.03 0.00 -0.13 0.00 0.00 59.36 58.92 1hf3 h GLU 252 Cb 1.08 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.45 1hf3 h GLU 252 CO 0.10 0.94 -0.00 0.28 -0.73 0.00 0.00 179.01 179.59 1hf3 h VAL 253 N 0.32 0.88 -0.46 0.32 2.07 -1.45 0.89 116.25 118.83 1hf3 h VAL 253 Ca 0.04 -0.02 -0.09 0.00 0.82 0.00 0.00 66.70 67.45 1hf3 h VAL 253 Cb 0.84 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 1hf3 h VAL 253 CO 0.07 0.01 -0.06 -0.07 0.02 0.00 0.00 177.57 177.53 1hf3 h LEU 254 N 0.05 0.77 -0.34 2.57 3.38 -1.01 0.18 115.31 120.92 1hf3 h LEU 254 Ca 0.08 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 1hf3 h LEU 254 Cb 0.10 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1hf3 h LEU 254 CO -0.13 0.88 0.08 0.74 0.09 0.00 0.00 178.44 180.10 1hf3 h THR 255 N 0.73 1.22 -0.65 0.22 2.02 -0.42 -1.87 112.91 114.16 1hf3 h THR 255 Ca 0.13 -0.76 -0.04 0.00 0.77 0.00 0.00 66.41 66.51 1hf3 h THR 255 Cb 0.54 1.07 -0.03 0.00 -1.74 0.00 0.00 68.15 67.99 1hf3 h THR 255 CO 0.03 0.26 0.23 -0.33 0.37 0.00 0.00 175.52 176.08 1hf3 h GLU 256 N 0.40 0.99 -0.33 6.66 5.08 -0.66 0.26 114.58 126.98 1hf3 h GLU 256 Ca 0.11 -0.20 -0.05 0.00 -1.00 0.00 0.00 59.36 58.22 1hf3 h GLU 256 Cb 0.31 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1hf3 h GLU 256 CO 0.00 0.85 -0.00 0.52 -1.00 0.00 0.00 179.01 179.38 1hf3 h MET 257 N 0.93 0.51 -0.30 2.33 2.86 -0.84 -2.91 114.93 117.52 1hf3 h MET 257 Ca 0.21 -0.11 0.00 0.00 -2.06 0.00 0.00 59.70 57.74 1hf3 h MET 257 Cb 0.25 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.83 1hf3 h MET 257 CO -0.01 0.55 0.00 -1.13 1.06 0.00 0.00 176.91 177.37 1hf3 n SER 258 N -4.28 3.28 -2.88 1.22 3.41 -0.71 -5.00 113.62 108.66 1hf3 n SER 258 Ca 0.01 -1.96 -0.12 0.00 -0.26 0.00 0.00 58.87 56.54 1hf3 n SER 258 Cb 0.24 -0.19 0.05 0.00 -0.26 0.00 0.00 64.21 64.06 1hf3 n SER 258 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1hf3 n ASN 259 N 1.39 -5.69 0.00 4.04 4.13 -0.12 -3.98 115.26 115.03 1hf3 n ASN 259 Ca 0.17 -0.55 0.00 0.00 1.68 0.00 0.00 54.58 55.88 1hf3 n ASN 259 Cb 0.58 -4.23 0.00 0.00 -1.54 0.00 0.00 39.78 34.59 1hf3 n ASN 259 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1hf3 n GLY 260 N -1.29 0.74 0.00 7.41 0.00 0.75 -5.01 105.19 107.78 1hf3 n GLY 260 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1hf3 n GLY 260 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hf3 n GLY 261 N -2.01 3.53 3.90 -0.02 0.00 -1.20 -4.23 105.19 105.15 1hf3 n GLY 261 Ca 0.00 -1.70 -0.28 0.00 0.00 0.00 0.00 46.02 44.04 1hf3 n GLY 261 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1hf3 s VAL 262 N -2.02 4.26 0.05 1.61 -7.23 -0.76 -4.24 120.40 112.06 1hf3 s VAL 262 Ca 0.00 0.35 -0.19 0.00 -1.81 0.00 0.00 61.98 60.33 1hf3 s VAL 262 Cb 0.00 -3.68 -0.14 0.00 0.56 0.00 0.00 36.38 33.12 1hf3 s VAL 262 CO 0.00 -0.77 1.32 0.44 -0.31 0.00 0.00 175.10 175.78 1hf3 h ASP 263 N -0.17 0.49 -3.42 4.85 3.32 -1.30 0.74 116.42 120.92 1hf3 h ASP 263 Ca -0.45 -0.52 -0.42 0.00 0.02 0.00 0.00 57.03 55.66 1hf3 h ASP 263 Cb 1.22 -0.14 -0.35 0.00 0.22 0.00 0.00 39.33 40.29 1hf3 h ASP 263 CO 0.62 0.92 -0.77 -0.36 -1.72 0.00 0.00 179.24 177.92 1hf3 s PHE 264 N -4.14 0.75 0.15 4.55 0.08 -1.07 -1.07 117.98 117.23 1hf3 s PHE 264 Ca -0.14 -0.21 0.08 0.00 0.12 0.00 0.00 56.93 56.78 1hf3 s PHE 264 Cb 0.06 -0.70 -0.04 0.00 -0.57 0.00 0.00 43.02 41.77 1hf3 s PHE 264 CO 0.78 -0.22 -0.17 -1.54 -0.10 0.00 0.00 175.22 173.97 1hf3 s SER 265 N 1.09 2.49 -0.04 1.36 1.04 -0.34 -1.10 113.70 118.21 1hf3 s SER 265 Ca -0.08 -0.83 0.01 0.00 0.48 0.00 0.00 55.95 55.52 1hf3 s SER 265 Cb -0.14 -0.13 0.02 0.00 0.10 0.00 0.00 66.02 65.87 1hf3 s SER 265 CO -0.01 -0.06 -0.02 -0.36 0.98 0.00 0.00 173.24 173.77 1hf3 s PHE 266 N -2.00 0.54 -0.33 5.02 0.40 -0.44 -0.81 117.98 120.37 1hf3 s PHE 266 Ca 0.13 -0.11 -0.12 0.00 -0.60 0.00 0.00 56.93 56.24 1hf3 s PHE 266 Cb -0.06 -0.56 -0.02 0.00 0.51 0.00 0.00 43.02 42.90 1hf3 s PHE 266 CO 0.05 -0.17 0.21 -2.00 0.70 0.00 0.00 175.22 174.01 1hf3 s GLU 267 N 1.04 3.49 -0.33 0.44 -6.30 -0.21 -1.14 118.70 115.69 1hf3 s GLU 267 Ca -0.09 -0.64 0.13 0.00 -2.50 0.00 0.00 54.97 51.87 1hf3 s GLU 267 Cb -0.14 -3.73 0.46 0.00 0.00 0.00 0.00 34.13 30.73 1hf3 s GLU 267 CO -0.01 -0.41 1.09 0.28 0.02 0.00 0.00 175.26 176.23 1hf3 n VAL 268 N 5.07 1.83 0.06 3.70 0.31 0.39 -1.03 118.33 128.66 1hf3 n VAL 268 Ca -0.13 -3.82 0.00 0.00 -0.01 0.00 0.00 64.34 60.38 1hf3 n VAL 268 Cb 0.50 -0.16 0.00 0.00 -0.91 0.00 0.00 33.84 33.26 1hf3 n VAL 268 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1hf3 n ILE 269 N -0.47 0.73 0.00 2.52 5.41 -1.25 -4.58 119.36 121.72 1hf3 n ILE 269 Ca 0.26 0.24 0.00 0.00 1.00 0.00 0.00 62.75 64.25 1hf3 n ILE 269 Cb 0.81 -1.29 0.00 0.00 -0.71 0.00 0.00 39.64 38.45 1hf3 n ILE 269 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1hf3 n GLY 270 N 2.91 1.35 3.46 7.39 0.00 -1.26 -4.43 105.19 114.62 1hf3 n GLY 270 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1hf3 n GLY 270 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1hf3 s ARG 271 N -0.23 2.41 0.26 1.61 0.52 -1.26 -4.38 118.95 117.89 1hf3 s ARG 271 Ca 0.00 -0.75 -0.02 0.00 -0.52 0.00 0.00 55.73 54.43 1hf3 s ARG 271 Cb 0.00 -2.32 0.32 0.00 0.52 0.00 0.00 34.95 33.46 1hf3 s ARG 271 CO 0.00 0.61 1.76 -0.07 0.02 0.00 0.00 175.30 177.62 1hf3 h LEU 272 N 5.24 0.79 -0.29 2.53 3.38 -1.97 -1.77 115.31 123.22 1hf3 h LEU 272 Ca -0.46 -0.19 -0.15 0.00 0.09 0.00 0.00 57.88 57.17 1hf3 h LEU 272 Cb 1.15 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 1hf3 h LEU 272 CO 0.50 0.84 -0.40 -2.24 0.09 0.00 0.00 178.44 177.23 1hf3 h ASP 273 N 0.77 0.86 0.89 -0.43 2.03 -1.99 -2.66 116.42 115.89 1hf3 h ASP 273 Ca 0.15 -0.50 -0.05 0.00 -0.73 0.00 0.00 57.03 55.90 1hf3 h ASP 273 Cb 0.43 -0.24 -0.01 0.00 -0.83 0.00 0.00 39.33 38.68 1hf3 h ASP 273 CO 0.02 1.19 -0.26 0.71 -1.03 0.00 0.00 179.24 179.87 1hf3 h THR 274 N 0.55 0.64 -0.47 1.15 1.35 -1.94 -0.71 112.91 113.47 1hf3 h THR 274 Ca 0.03 -1.20 -0.04 0.00 -0.55 0.00 0.00 66.41 64.65 1hf3 h THR 274 Cb 0.99 1.79 -0.02 0.00 -1.73 0.00 0.00 68.15 69.18 1hf3 h THR 274 CO 0.09 0.25 0.14 0.24 -0.25 0.00 0.00 175.52 176.00 1hf3 h MET 275 N 0.00 0.73 -0.14 4.72 2.86 -0.99 0.16 114.93 122.27 1hf3 h MET 275 Ca -0.00 -0.16 -0.15 0.00 -2.06 0.00 0.00 59.70 57.33 1hf3 h MET 275 Cb 0.77 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.32 1hf3 h MET 275 CO 0.03 0.70 -0.55 0.28 1.06 0.00 0.00 176.91 178.43 1hf3 h VAL 276 N 0.63 1.34 -0.37 -2.22 2.07 -1.20 -1.80 116.25 114.69 1hf3 h VAL 276 Ca 0.15 -1.82 -0.05 0.00 0.82 0.00 0.00 66.70 65.80 1hf3 h VAL 276 Cb 0.27 1.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.86 1hf3 h VAL 276 CO -0.00 0.55 0.04 0.74 0.02 0.00 0.00 177.57 178.92 1hf3 h THR 277 N 0.32 1.25 -0.78 2.57 2.02 -0.96 -0.23 112.91 117.10 1hf3 h THR 277 Ca 0.01 -0.91 -0.04 0.00 0.77 0.00 0.00 66.41 66.23 1hf3 h THR 277 Cb 1.06 1.11 -0.03 0.00 -1.74 0.00 0.00 68.15 68.55 1hf3 h THR 277 CO 0.10 0.31 0.31 0.00 0.37 0.00 0.00 175.52 176.60 1hf3 h ALA 278 N 0.90 1.08 -0.05 6.16 0.00 -0.56 -1.59 119.26 125.20 1hf3 h ALA 278 Ca 0.11 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1hf3 h ALA 278 Cb 0.40 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1hf3 h ALA 278 CO 0.01 0.66 0.03 1.25 0.00 0.00 0.00 179.25 181.20 1hf3 h LEU 279 N 1.14 0.06 -1.25 0.00 5.85 -0.98 -3.10 115.31 117.02 1hf3 h LEU 279 Ca 0.26 -0.07 0.08 0.00 0.84 0.00 0.00 57.88 59.00 1hf3 h LEU 279 Cb 0.21 -0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.17 1hf3 h LEU 279 CO -0.02 0.11 0.55 -1.28 -0.34 0.00 0.00 178.44 177.46 1hf3 h SER 280 N 0.01 0.77 1.18 1.25 0.87 -0.65 -2.57 113.55 114.41 1hf3 h SER 280 Ca 0.02 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 1hf3 h SER 280 Cb 0.06 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 61.87 1hf3 h SER 280 CO -0.00 0.47 0.00 0.00 -0.53 0.00 0.00 176.83 176.77 1hf3 n GLN 283 N -1.14 2.53 0.26 0.00 0.00 0.25 -4.67 117.38 114.61 1hf3 n GLN 283 Ca 0.08 0.90 0.10 0.00 -0.00 0.00 0.00 57.00 58.08 1hf3 n GLN 283 Cb 0.54 -2.68 0.69 0.00 0.00 0.00 0.00 30.24 28.79 1hf3 n GLN 283 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.06 178.11 1hf3 h GLU 284 N 5.36 0.00 0.04 3.69 4.11 -1.92 0.40 114.58 126.26 1hf3 h GLU 284 Ca -0.45 0.00 -0.33 0.00 0.07 0.00 0.00 59.36 58.65 1hf3 h GLU 284 Cb 1.23 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.44 1hf3 h GLU 284 CO 0.84 0.08 -1.93 0.00 0.07 0.00 0.00 179.01 178.07 1hf3 n ALA 285 N -2.42 1.29 -1.12 1.06 0.00 -1.26 -2.64 120.51 115.41 1hf3 n ALA 285 Ca -0.03 -0.79 0.00 0.00 0.00 0.00 0.00 53.44 52.62 1hf3 n ALA 285 Cb 0.16 -0.67 0.00 0.00 0.00 0.00 0.00 19.45 18.94 1hf3 n ALA 285 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1hf3 n TYR 286 N -3.17 0.00 -2.26 0.00 0.18 -1.17 -4.41 117.16 106.32 1hf3 n TYR 286 Ca -0.26 0.00 -0.36 0.00 1.88 0.00 0.00 57.90 59.16 1hf3 n TYR 286 Cb 1.06 0.02 -0.00 0.00 -0.38 0.00 0.00 39.34 40.03 1hf3 n TYR 286 CO 0.00 0.00 0.00 0.20 -2.08 0.00 0.00 176.86 174.98 1hf3 s GLY 287 N 0.00 2.72 -0.07 -7.48 0.00 0.14 -4.87 107.32 97.76 1hf3 s GLY 287 Ca 0.00 0.88 0.05 0.00 0.00 0.00 0.00 44.72 45.65 1hf3 s GLY 287 CO 0.00 1.30 -0.22 0.14 0.00 0.00 0.00 173.10 174.32 1hf3 s VAL 288 N -1.64 1.87 -0.06 1.40 1.01 -0.23 -1.91 120.40 120.83 1hf3 s VAL 288 Ca 0.67 -0.94 0.04 0.00 0.00 0.00 0.00 61.98 61.76 1hf3 s VAL 288 Cb -0.26 -1.60 -0.00 0.00 0.00 0.00 0.00 36.38 34.51 1hf3 s VAL 288 CO 0.31 0.52 -0.19 -0.55 0.00 0.00 0.00 175.10 175.19 1hf3 s SER 289 N 0.12 2.47 -0.12 3.32 0.15 0.04 -1.20 113.70 118.49 1hf3 s SER 289 Ca -0.10 -0.42 0.03 0.00 0.70 0.00 0.00 55.95 56.16 1hf3 s SER 289 Cb -0.15 -0.89 0.00 0.00 -1.71 0.00 0.00 66.02 63.27 1hf3 s SER 289 CO 0.05 0.14 -0.22 -0.69 1.20 0.00 0.00 173.24 173.72 1hf3 s VAL 290 N 0.22 2.13 -0.17 4.45 1.01 0.01 -1.07 120.40 126.98 1hf3 s VAL 290 Ca -0.10 -0.98 -0.19 0.00 0.00 0.00 0.00 61.98 60.71 1hf3 s VAL 290 Cb -0.14 -1.83 -0.03 0.00 0.00 0.00 0.00 36.38 34.37 1hf3 s VAL 290 CO 0.04 0.55 0.53 -0.63 0.00 0.00 0.00 175.10 175.60 1hf3 s ILE 291 N 0.54 5.12 -0.01 2.22 1.01 0.44 -1.04 121.20 129.47 1hf3 s ILE 291 Ca -0.14 1.01 0.00 0.00 0.00 0.00 0.00 60.65 61.52 1hf3 s ILE 291 Cb -0.17 -3.86 -0.01 0.00 0.01 0.00 0.00 42.46 38.44 1hf3 s ILE 291 CO 0.04 0.22 -0.01 0.52 0.00 0.00 0.00 174.94 175.72 1hf3 n VAL 292 N 4.25 0.05 -1.96 2.92 0.31 -0.19 -3.03 118.33 120.67 1hf3 n VAL 292 Ca -0.05 -0.02 -0.37 0.00 -0.01 0.00 0.00 64.34 63.89 1hf3 n VAL 292 Cb 0.51 -0.54 0.03 0.00 -0.91 0.00 0.00 33.84 32.93 1hf3 n VAL 292 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1hf3 s GLY 293 N -4.07 2.80 -0.25 2.92 0.00 -0.37 -4.93 107.32 103.43 1hf3 s GLY 293 Ca -0.01 1.10 -0.14 0.00 0.00 0.00 0.00 44.72 45.67 1hf3 s GLY 293 CO 0.02 1.53 0.31 0.14 0.00 0.00 0.00 173.10 175.11 1hf3 s VAL 294 N -1.49 5.24 0.74 1.40 1.01 -1.26 -4.55 120.40 121.49 1hf3 s VAL 294 Ca 0.75 0.48 -0.11 0.00 0.00 0.00 0.00 61.98 63.10 1hf3 s VAL 294 Cb -0.33 -3.64 0.04 0.00 0.00 0.00 0.00 36.38 32.44 1hf3 s VAL 294 CO 0.37 0.23 1.08 -2.16 0.00 0.00 0.00 175.10 174.62 1hf3 s PRO 295 N 1.62 2.51 0.05 2.72 0.04 -1.26 -4.37 135.00 136.32 1hf3 s PRO 295 Ca 0.14 1.07 -0.29 0.00 0.04 0.00 0.00 61.00 61.95 1hf3 s PRO 295 Cb -0.15 -1.93 -0.05 0.00 0.04 0.00 0.00 34.50 32.41 1hf3 s PRO 295 CO 0.08 -1.43 0.93 -1.25 0.04 0.00 0.00 177.00 175.37 1hf3 s PRO 296 N -4.97 4.61 0.15 0.56 0.04 -1.26 -4.80 135.00 129.33 1hf3 s PRO 296 Ca 0.60 1.36 -0.32 0.00 0.04 0.00 0.00 61.00 62.68 1hf3 s PRO 296 Cb -0.16 -3.41 -0.17 0.00 0.04 0.00 0.00 34.50 30.80 1hf3 s PRO 296 CO 0.56 0.12 0.86 -3.47 0.04 0.00 0.00 177.00 175.11 1hf3 n ASP 297 N 3.25 -0.06 -2.85 6.66 2.03 -0.06 -2.71 116.55 122.81 1hf3 n ASP 297 Ca 0.03 1.15 -0.19 0.00 0.52 0.00 0.00 54.79 56.30 1hf3 n ASP 297 Cb 0.50 -1.04 0.00 0.00 -0.72 0.00 0.00 41.12 39.86 1hf3 n ASP 297 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1hf3 n SER 298 N 1.81 -4.50 -4.40 1.67 7.64 -1.26 -4.97 113.62 109.60 1hf3 n SER 298 Ca 0.17 -0.11 -0.33 0.00 1.01 0.00 0.00 58.87 59.62 1hf3 n SER 298 Cb 0.21 -3.74 -0.14 0.00 -1.01 0.00 0.00 64.21 59.53 1hf3 n SER 298 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1hf3 s GLN 299 N -5.48 2.94 0.13 1.43 -1.52 -1.10 -5.11 119.66 110.95 1hf3 s GLN 299 Ca 0.19 -0.71 0.03 0.00 -1.95 0.00 0.00 55.36 52.92 1hf3 s GLN 299 Cb -0.09 -2.48 -0.04 0.00 -0.22 0.00 0.00 33.01 30.18 1hf3 s GLN 299 CO 0.23 0.39 0.18 -0.80 -0.25 0.00 0.00 175.29 175.04 1hf3 s ASN 300 N -0.14 5.87 0.37 5.90 0.01 -1.26 -4.92 114.94 120.77 1hf3 s ASN 300 Ca -0.01 0.03 0.07 0.00 -0.71 0.00 0.00 52.86 52.24 1hf3 s ASN 300 Cb -0.14 -1.65 -0.00 0.00 0.41 0.00 0.00 41.25 39.87 1hf3 s ASN 300 CO 0.03 0.10 0.49 -1.48 -1.51 0.00 0.00 177.10 174.73 1hf3 s LEU 301 N -2.92 3.81 -0.11 0.60 0.05 -1.26 -5.06 118.68 113.78 1hf3 s LEU 301 Ca 0.32 -0.32 0.03 0.00 0.05 0.00 0.00 54.13 54.22 1hf3 s LEU 301 Cb -0.11 -2.65 -0.00 0.00 -2.05 0.00 0.00 46.19 41.38 1hf3 s LEU 301 CO 0.25 -0.55 -0.22 -0.44 -0.55 0.00 0.00 176.35 174.84 1hf3 s SER 302 N -4.22 3.21 -0.01 1.48 0.01 -1.26 -5.11 113.70 107.79 1hf3 s SER 302 Ca 0.48 -0.54 -0.20 0.00 1.31 0.00 0.00 55.95 57.00 1hf3 s SER 302 Cb -0.09 -1.44 0.04 0.00 0.21 0.00 0.00 66.02 64.74 1hf3 s SER 302 CO 0.31 0.15 0.44 0.00 0.41 0.00 0.00 173.24 174.55 1hf3 s MET 303 N 0.42 0.83 -0.32 12.44 0.23 -1.26 -5.00 119.30 126.64 1hf3 s MET 303 Ca -0.16 -0.08 -0.23 0.00 -1.03 0.00 0.00 55.69 54.19 1hf3 s MET 303 Cb -0.17 0.38 0.00 0.00 -1.53 0.00 0.00 34.83 33.51 1hf3 s MET 303 CO 0.07 -0.25 0.78 1.21 -2.03 0.00 0.00 175.02 174.80 1hf3 s ASN 304 N -1.40 6.62 0.43 -1.18 3.84 -1.26 -4.96 114.94 117.03 1hf3 s ASN 304 Ca -0.11 0.56 0.24 0.00 0.21 0.00 0.00 52.86 53.75 1hf3 s ASN 304 Cb -0.03 -2.40 1.29 0.00 -0.55 0.00 0.00 41.25 39.56 1hf3 s ASN 304 CO 0.05 -0.65 1.69 1.55 -2.79 0.00 0.00 177.10 176.96 1hf3 h PRO 305 N 8.24 0.00 0.00 0.43 0.13 -2.02 -0.74 132.00 138.03 1hf3 h PRO 305 Ca -0.25 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.85 1hf3 h PRO 305 Cb 1.10 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.22 1hf3 h PRO 305 CO 0.89 0.00 -0.16 0.52 -0.23 0.00 0.00 178.00 179.02 1hf3 h MET 306 N 0.00 0.00 -0.54 0.86 2.86 -1.99 0.86 114.93 116.98 1hf3 h MET 306 Ca 0.00 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.65 1hf3 h MET 306 Cb 0.31 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.94 1hf3 h MET 306 CO 0.00 0.16 0.36 -0.07 1.06 0.00 0.00 176.91 178.42 1hf3 h LEU 307 N 0.00 0.60 0.01 1.22 3.38 -1.55 -2.78 115.31 116.19 1hf3 h LEU 307 Ca -0.00 -0.01 -0.28 0.00 0.09 0.00 0.00 57.88 57.67 1hf3 h LEU 307 Cb 0.44 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.00 1hf3 h LEU 307 CO 0.02 0.43 -1.62 -0.07 0.09 0.00 0.00 178.44 177.29 1hf3 h LEU 308 N 0.71 0.02 -1.58 1.67 3.38 -1.05 -3.34 115.31 115.11 1hf3 h LEU 308 Ca 0.20 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 1hf3 h LEU 308 Cb -0.04 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1hf3 h LEU 308 CO -0.05 1.03 0.05 0.25 0.09 0.00 0.00 178.44 179.82 1hf3 h LEU 309 N 0.00 0.29 -1.38 1.67 5.85 -1.11 -0.03 115.31 120.61 1hf3 h LEU 309 Ca -0.25 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.44 1hf3 h LEU 309 Cb 1.98 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.94 1hf3 h LEU 309 CO 0.09 0.30 0.00 0.77 -0.34 0.00 0.00 178.44 179.26 1hf3 h SER 310 N 0.32 0.00 0.00 1.25 4.64 -1.71 -3.45 113.55 114.59 1hf3 h SER 310 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 1hf3 h SER 310 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1hf3 h SER 310 CO -0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1hf3 n GLY 311 N -0.27 -0.31 3.77 -0.77 0.00 -0.04 -4.24 105.19 103.33 1hf3 n GLY 311 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1hf3 n GLY 311 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1hf3 s ARG 312 N 0.00 3.09 -0.09 1.61 0.52 -1.08 -4.14 118.95 118.87 1hf3 s ARG 312 Ca 0.00 1.49 0.04 0.00 -0.52 0.00 0.00 55.73 56.74 1hf3 s ARG 312 Cb 0.00 -1.98 -0.01 0.00 0.52 0.00 0.00 34.95 33.48 1hf3 s ARG 312 CO 0.00 -1.03 -0.21 0.99 0.02 0.00 0.00 175.30 175.07 1hf3 s THR 313 N -2.07 2.38 -0.08 0.02 2.01 -0.80 -4.81 115.64 112.28 1hf3 s THR 313 Ca 0.70 -0.93 0.02 0.00 0.31 0.00 0.00 61.69 61.79 1hf3 s THR 313 Cb -0.22 -1.92 0.01 0.00 0.01 0.00 0.00 72.50 70.39 1hf3 s THR 313 CO 0.34 0.56 -0.14 0.86 -0.69 0.00 0.00 174.62 175.55 1hf3 s TRP 314 N 0.07 1.66 0.04 4.92 -0.00 -1.26 -0.78 118.94 123.59 1hf3 s TRP 314 Ca -0.09 -0.66 -0.05 0.00 -0.00 0.00 0.00 56.10 55.31 1hf3 s TRP 314 Cb -0.15 -1.20 -0.01 0.00 -0.00 0.00 0.00 33.47 32.10 1hf3 s TRP 314 CO 0.06 -0.33 0.08 0.15 -0.00 0.00 0.00 176.95 176.90 1hf3 s LYS 315 N 0.71 0.58 0.37 5.86 1.02 -0.23 -4.98 119.74 123.08 1hf3 s LYS 315 Ca -0.13 -0.81 0.04 0.00 0.02 0.00 0.00 55.97 55.09 1hf3 s LYS 315 Cb -0.16 0.22 -0.05 0.00 -0.52 0.00 0.00 37.83 37.32 1hf3 s LYS 315 CO 0.03 -0.14 0.06 0.20 -0.92 0.00 0.00 175.35 174.58 1hf3 s GLY 316 N -2.21 2.34 -0.09 -3.33 0.00 -1.26 -0.42 107.32 102.35 1hf3 s GLY 316 Ca -0.04 -1.78 -0.31 0.00 0.00 0.00 0.00 44.72 42.60 1hf3 s GLY 316 CO -0.05 -1.90 0.77 0.00 0.00 0.00 0.00 173.10 171.91 1hf3 s ALA 317 N -3.14 -1.81 -0.16 3.20 0.00 -1.17 -4.92 121.76 113.75 1hf3 s ALA 317 Ca 0.31 1.42 -0.08 0.00 0.00 0.00 0.00 51.96 53.61 1hf3 s ALA 317 Cb 0.07 -0.23 -0.04 0.00 0.00 0.00 0.00 23.12 22.91 1hf3 s ALA 317 CO 0.14 -0.35 0.11 0.42 0.00 0.00 0.00 175.76 176.08 1hf3 s ILE 318 N -1.10 5.21 -1.62 0.00 -1.09 -1.26 -4.61 121.20 116.72 1hf3 s ILE 318 Ca -0.08 0.11 -0.03 0.00 -2.23 0.00 0.00 60.65 58.42 1hf3 s ILE 318 Cb -0.00 -3.32 0.00 0.00 -1.58 0.00 0.00 42.46 37.56 1hf3 s ILE 318 CO 0.07 0.51 0.43 0.33 -1.23 0.00 0.00 174.94 175.05 1hf3 n PHE 319 N 2.95 -1.67 -1.96 3.97 7.35 -1.26 -2.62 117.46 124.22 1hf3 n PHE 319 Ca -0.18 0.37 -0.17 0.00 -0.76 0.00 0.00 57.45 56.71 1hf3 n PHE 319 Cb 0.53 -4.35 -0.04 0.00 0.35 0.00 0.00 39.48 35.98 1hf3 n PHE 319 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1hf3 n GLY 320 N -1.38 0.56 2.82 7.13 0.00 -1.23 -2.05 105.19 111.04 1hf3 n GLY 320 Ca -0.15 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.69 1hf3 n GLY 320 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hf3 n GLY 321 N -0.95 0.30 3.72 -0.02 0.00 -1.08 -3.72 105.19 103.45 1hf3 n GLY 321 Ca -0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 1hf3 n GLY 321 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1hf3 s PHE 322 N -1.75 3.55 -0.31 1.61 0.08 -0.87 -4.56 117.98 115.73 1hf3 s PHE 322 Ca 0.00 1.49 -0.29 0.00 0.12 0.00 0.00 56.93 58.26 1hf3 s PHE 322 Cb 0.00 -3.29 -0.02 0.00 -0.57 0.00 0.00 43.02 39.14 1hf3 s PHE 322 CO 0.00 -0.73 1.75 0.15 -0.10 0.00 0.00 175.22 176.29 1hf3 s LYS 323 N 0.68 3.44 0.06 0.44 1.02 -1.26 -4.83 119.74 119.29 1hf3 s LYS 323 Ca 0.54 1.46 -0.25 0.00 0.02 0.00 0.00 55.97 57.75 1hf3 s LYS 323 Cb -0.27 -4.16 -0.11 0.00 -0.52 0.00 0.00 37.83 32.77 1hf3 s LYS 323 CO 0.30 -1.73 1.39 0.66 -0.92 0.00 0.00 175.35 175.05 1hf3 h SER 324 N 12.37 -1.04 -0.48 2.83 4.64 -1.83 -0.81 113.55 129.22 1hf3 h SER 324 Ca -0.34 0.09 -0.01 0.00 -0.47 0.00 0.00 61.79 61.07 1hf3 h SER 324 Cb 1.16 0.36 -0.02 0.00 -0.31 0.00 0.00 62.40 63.59 1hf3 h SER 324 CO 1.03 -0.44 0.26 0.50 -0.87 0.00 0.00 176.83 177.30 1hf3 h LYS 325 N -0.64 0.67 -0.52 4.77 3.64 -1.89 0.10 116.57 122.70 1hf3 h LYS 325 Ca -0.03 -0.08 -0.09 0.00 -1.27 0.00 0.00 60.65 59.17 1hf3 h LYS 325 Cb 0.59 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.26 1hf3 h LYS 325 CO -0.11 0.54 -0.05 -0.44 -2.27 0.00 0.00 179.45 177.12 1hf3 h ASP 326 N 0.63 0.91 0.50 4.20 3.32 -1.96 -3.32 116.42 120.70 1hf3 h ASP 326 Ca 0.17 -0.26 -0.22 0.00 0.02 0.00 0.00 57.03 56.73 1hf3 h ASP 326 Cb 0.06 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.33 1hf3 h ASP 326 CO -0.03 1.00 -1.68 -1.20 -1.72 0.00 0.00 179.24 175.61 1hf3 n SER 327 N -4.17 0.68 -0.29 6.45 7.64 -0.31 -4.28 113.62 119.34 1hf3 n SER 327 Ca 0.02 0.31 -0.04 0.00 1.01 0.00 0.00 58.87 60.17 1hf3 n SER 327 Cb 0.35 0.33 0.07 0.00 -1.01 0.00 0.00 64.21 63.96 1hf3 n SER 327 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1hf3 h VAL 328 N 0.00 1.19 -0.15 0.44 2.07 -0.91 -1.42 116.25 117.47 1hf3 h VAL 328 Ca -0.25 -0.36 -0.08 0.00 0.82 0.00 0.00 66.70 66.83 1hf3 h VAL 328 Cb 1.77 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.57 1hf3 h VAL 328 CO 0.05 0.19 -0.28 -0.65 0.02 0.00 0.00 177.57 176.90 1hf3 h PRO 329 N 1.06 0.29 -0.16 1.57 0.11 -1.77 -1.75 132.00 131.34 1hf3 h PRO 329 Ca 0.29 -0.11 -0.16 0.00 0.11 0.00 0.00 66.00 66.14 1hf3 h PRO 329 Cb -0.10 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 30.99 1hf3 h PRO 329 CO -0.07 0.55 -0.51 0.87 -0.21 0.00 0.00 178.00 178.63 1hf3 h LYS 330 N 0.26 0.63 -0.97 1.05 1.79 -1.69 -1.61 116.57 116.02 1hf3 h LYS 330 Ca 0.04 -0.46 0.03 0.00 -2.18 0.00 0.00 60.65 58.08 1hf3 h LYS 330 Cb 0.64 0.08 -0.06 0.00 -1.58 0.00 0.00 32.23 31.31 1hf3 h LYS 330 CO 0.05 1.08 0.64 -0.07 -1.08 0.00 0.00 179.45 180.07 1hf3 h LEU 331 N 0.29 1.07 -0.11 2.94 3.38 -0.91 0.14 115.31 122.10 1hf3 h LEU 331 Ca -0.02 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1hf3 h LEU 331 Cb 1.13 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.63 1hf3 h LEU 331 CO 0.11 0.73 0.01 0.58 0.09 0.00 0.00 178.44 179.96 1hf3 h VAL 332 N 1.24 1.23 -0.63 1.22 2.07 -1.26 0.13 116.25 120.25 1hf3 h VAL 332 Ca 0.38 -0.74 0.07 0.00 0.82 0.00 0.00 66.70 67.24 1hf3 h VAL 332 Cb -0.01 1.51 -0.06 0.00 -1.52 0.00 0.00 31.29 31.21 1hf3 h VAL 332 CO -0.12 0.21 0.31 0.00 0.02 0.00 0.00 177.57 178.00 1hf3 h ALA 333 N 0.77 0.85 -0.64 1.67 0.00 -1.02 0.33 119.26 121.22 1hf3 h ALA 333 Ca 0.03 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1hf3 h ALA 333 Cb 0.32 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1hf3 h ALA 333 CO 0.00 -0.05 0.35 -0.44 0.00 0.00 0.00 179.25 179.11 1hf3 h ASP 334 N 0.57 0.79 -0.30 0.00 5.19 -0.54 -0.05 116.42 122.07 1hf3 h ASP 334 Ca 0.30 -0.06 -0.18 0.00 -0.62 0.00 0.00 57.03 56.46 1hf3 h ASP 334 Cb 0.26 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 39.57 1hf3 h ASP 334 CO -0.22 0.64 -0.53 0.15 -3.12 0.00 0.00 179.24 176.15 1hf3 h PHE 335 N 0.89 1.11 0.00 4.55 3.57 0.23 -1.63 116.94 125.67 1hf3 h PHE 335 Ca 0.23 -0.39 -0.00 0.00 3.53 0.00 0.00 57.97 61.33 1hf3 h PHE 335 Cb 0.03 -0.21 -0.00 0.00 2.79 0.00 0.00 35.95 38.56 1hf3 h PHE 335 CO 0.01 1.23 -0.01 0.52 -2.23 0.00 0.00 178.31 177.83 1hf3 h MET 336 N 0.68 0.00 -0.63 1.11 2.86 0.68 0.26 114.93 119.89 1hf3 h MET 336 Ca 0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1hf3 h MET 336 Cb 1.14 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.80 1hf3 h MET 336 CO 0.12 0.01 0.00 0.00 1.06 0.00 0.00 176.91 178.10 1hf3 n ALA 337 N -2.11 2.41 -1.91 6.32 0.00 -0.15 -4.96 120.51 120.11 1hf3 n ALA 337 Ca -0.02 -1.09 -0.21 0.00 0.00 0.00 0.00 53.44 52.11 1hf3 n ALA 337 Cb 0.12 -0.95 -0.06 0.00 0.00 0.00 0.00 19.45 18.55 1hf3 n ALA 337 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1hf3 n LYS 338 N 1.32 -1.54 0.20 0.00 5.02 0.90 -4.87 118.16 119.18 1hf3 n LYS 338 Ca 0.21 1.15 0.14 0.00 -2.02 0.00 0.00 58.31 57.80 1hf3 n LYS 338 Cb 0.53 -5.65 0.59 0.00 -0.02 0.00 0.00 35.03 30.48 1hf3 n LYS 338 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1hf3 h LYS 339 N 0.00 0.00 -2.34 1.97 1.79 -1.49 -3.43 116.57 113.07 1hf3 h LYS 339 Ca -0.46 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.02 1hf3 h LYS 339 Cb 1.37 0.00 -0.16 0.00 -1.58 0.00 0.00 32.23 31.85 1hf3 h LYS 339 CO 0.61 0.00 0.30 -0.59 -1.08 0.00 0.00 179.45 178.69 1hf3 s PHE 340 N -3.49 -0.53 -0.14 -1.35 -0.12 -1.26 -5.04 117.98 106.05 1hf3 s PHE 340 Ca 0.02 0.63 -0.01 0.00 -0.05 0.00 0.00 56.93 57.52 1hf3 s PHE 340 Cb 0.09 0.49 -0.02 0.00 -0.63 0.00 0.00 43.02 42.95 1hf3 s PHE 340 CO 0.44 -0.65 -0.10 0.00 -0.05 0.00 0.00 175.22 174.87 1hf3 s ALA 341 N -2.40 2.75 -0.41 1.99 0.00 -1.26 -4.79 121.76 117.64 1hf3 s ALA 341 Ca -0.03 -0.86 0.22 0.00 0.00 0.00 0.00 51.96 51.29 1hf3 s ALA 341 Cb -0.01 -1.32 -0.15 0.00 0.00 0.00 0.00 23.12 21.64 1hf3 s ALA 341 CO -0.02 0.25 0.80 1.28 0.00 0.00 0.00 175.76 178.06 1hf3 n LEU 342 N 3.50 0.47 -0.33 0.00 4.77 -1.26 -4.57 117.00 119.58 1hf3 n LEU 342 Ca -0.18 -0.05 0.01 0.00 -0.03 0.00 0.00 56.01 55.76 1hf3 n LEU 342 Cb 0.53 -0.04 0.18 0.00 -2.33 0.00 0.00 43.42 41.76 1hf3 n LEU 342 CO 0.31 0.04 1.27 0.44 -1.33 0.00 0.00 177.39 178.12 1hf3 h ASP 343 N 0.00 1.01 -0.13 -1.43 5.19 -1.95 -2.04 116.42 117.08 1hf3 h ASP 343 Ca 0.00 -0.01 0.04 0.00 -0.62 0.00 0.00 57.03 56.44 1hf3 h ASP 343 Cb 0.82 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 40.10 1hf3 h ASP 343 CO 0.00 0.70 0.11 -0.65 -3.12 0.00 0.00 179.24 176.28 1hf3 h PRO 344 N 1.18 0.00 0.00 3.56 0.11 -2.03 0.28 132.00 135.10 1hf3 h PRO 344 Ca 0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.48 1hf3 h PRO 344 Cb 0.02 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.13 1hf3 h PRO 344 CO -0.11 0.00 -0.09 1.28 -0.21 0.00 0.00 178.00 178.86 1hf3 n LEU 345 N -4.15 0.68 -4.45 2.35 4.77 -0.77 -4.72 117.00 110.72 1hf3 n LEU 345 Ca 0.00 0.51 -0.44 0.00 -0.03 0.00 0.00 56.01 56.05 1hf3 n LEU 345 Cb 0.23 -0.32 -0.08 0.00 -2.33 0.00 0.00 43.42 40.91 1hf3 n LEU 345 CO 0.31 -0.13 0.13 -0.63 -1.33 0.00 0.00 177.39 175.74 1hf3 s ILE 346 N -3.09 5.08 -0.18 -0.08 1.01 0.09 -1.13 121.20 122.90 1hf3 s ILE 346 Ca 0.11 -0.58 0.11 0.00 0.00 0.00 0.00 60.65 60.28 1hf3 s ILE 346 Cb 0.13 -4.12 -0.23 0.00 0.01 0.00 0.00 42.46 38.26 1hf3 s ILE 346 CO 0.61 -0.55 0.13 0.35 0.00 0.00 0.00 174.94 175.48 1hf3 n THR 347 N 5.40 1.49 -4.01 2.92 -2.24 -0.55 -4.93 114.28 112.36 1hf3 n THR 347 Ca -0.09 -0.76 -0.14 0.00 -2.27 0.00 0.00 64.05 60.79 1hf3 n THR 347 Cb 0.46 -0.90 -0.14 0.00 -2.10 0.00 0.00 70.33 67.65 1hf3 n THR 347 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1hf3 s HIS 348 N -2.52 0.25 -0.08 4.78 3.76 -1.19 -5.01 115.29 115.29 1hf3 s HIS 348 Ca -0.16 -0.04 0.03 0.00 -0.15 0.00 0.00 55.06 54.74 1hf3 s HIS 348 Cb 0.07 -0.19 0.01 0.00 1.11 0.00 0.00 32.58 33.58 1hf3 s HIS 348 CO 0.77 -0.02 -0.15 0.54 -0.85 0.00 0.00 174.74 175.03 1hf3 s VAL 349 N 0.07 1.38 0.01 -0.90 0.11 -1.26 -0.96 120.40 118.85 1hf3 s VAL 349 Ca -0.00 -0.62 0.01 0.00 -2.93 0.00 0.00 61.98 58.44 1hf3 s VAL 349 Cb -0.03 -1.24 -0.01 0.00 -1.53 0.00 0.00 36.38 33.57 1hf3 s VAL 349 CO -0.00 0.41 -0.03 -0.76 -3.33 0.00 0.00 175.10 171.38 1hf3 s LEU 350 N 0.62 2.12 0.44 2.54 1.43 -0.28 -4.97 118.68 120.58 1hf3 s LEU 350 Ca -0.15 -0.28 -0.25 0.00 -1.03 0.00 0.00 54.13 52.42 1hf3 s LEU 350 Cb -0.16 -0.06 -0.09 0.00 0.03 0.00 0.00 46.19 45.91 1hf3 s LEU 350 CO 0.05 -0.12 1.31 -0.81 0.23 0.00 0.00 176.35 177.01 1hf3 n PRO 351 N 2.30 1.98 -0.34 1.29 -0.04 -1.26 -0.23 135.00 138.69 1hf3 n PRO 351 Ca -0.18 0.71 0.23 0.00 -0.04 0.00 0.00 63.50 64.21 1hf3 n PRO 351 Cb 0.57 -2.45 0.46 0.00 -0.04 0.00 0.00 33.50 32.04 1hf3 n PRO 351 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 1hf3 h PHE 352 N 2.06 0.92 0.00 0.54 3.57 -0.83 0.50 116.94 123.71 1hf3 h PHE 352 Ca -0.49 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.05 1hf3 h PHE 352 Cb 1.29 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 39.78 1hf3 h PHE 352 CO 0.48 -0.10 0.00 0.93 -2.23 0.00 0.00 178.31 177.39 1hf3 h GLU 353 N 0.39 0.00 -1.00 1.11 3.07 -1.90 -0.55 114.58 115.70 1hf3 h GLU 353 Ca 0.71 0.00 -0.42 0.00 -0.50 0.00 0.00 59.36 59.14 1hf3 h GLU 353 Cb 1.59 0.00 -0.25 0.00 -0.84 0.00 0.00 28.75 29.24 1hf3 h GLU 353 CO -0.55 0.00 0.54 1.63 -1.40 0.00 0.00 179.01 179.23 1hf3 n LYS 354 N -2.99 2.02 -0.14 2.33 5.02 0.17 -4.65 118.16 119.92 1hf3 n LYS 354 Ca -0.02 -2.45 -0.03 0.00 -2.02 0.00 0.00 58.31 53.78 1hf3 n LYS 354 Cb 0.12 -1.96 0.03 0.00 -0.02 0.00 0.00 35.03 33.20 1hf3 n LYS 354 CO 0.00 0.00 0.00 0.97 -0.52 0.00 0.00 177.40 177.85 1hf3 h ILE 355 N 0.82 0.56 -0.40 -0.18 2.10 -1.23 -2.07 117.51 117.10 1hf3 h ILE 355 Ca 0.52 -0.01 -0.01 0.00 1.08 0.00 0.00 64.86 66.45 1hf3 h ILE 355 Cb 2.52 0.53 -0.02 0.00 -1.09 0.00 0.00 36.82 38.76 1hf3 h ILE 355 CO 0.91 0.00 0.22 0.78 -1.08 0.00 0.00 178.15 178.98 1hf3 h ASN 356 N 0.02 0.47 -0.11 2.19 2.35 -1.87 -0.11 115.58 118.53 1hf3 h ASN 356 Ca 0.23 -0.03 -0.10 0.00 -0.55 0.00 0.00 56.30 55.85 1hf3 h ASN 356 Cb 0.34 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.58 1hf3 h ASN 356 CO -0.46 0.38 -0.25 -0.33 -1.65 0.00 0.00 177.43 175.13 1hf3 h GLU 357 N 0.54 0.55 -0.53 0.81 5.08 -1.76 -0.86 114.58 118.41 1hf3 h GLU 357 Ca 0.14 -0.21 -0.04 0.00 -1.00 0.00 0.00 59.36 58.25 1hf3 h GLU 357 Cb 0.01 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 1hf3 h GLU 357 CO -0.02 0.75 0.16 0.78 -1.00 0.00 0.00 179.01 179.68 1hf3 h GLY 358 N 1.01 0.85 1.70 -3.84 0.00 -0.63 -1.07 103.07 101.09 1hf3 h GLY 358 Ca 0.07 -0.46 -0.22 0.00 0.00 0.00 0.00 47.33 46.72 1hf3 h GLY 358 CO 0.05 0.43 -0.97 0.74 0.00 0.00 0.00 176.54 176.80 1hf3 h PHE 359 N 0.77 0.40 -0.20 5.60 -1.00 -0.64 -2.67 116.94 119.20 1hf3 h PHE 359 Ca 0.18 -0.23 -0.10 0.00 2.81 0.00 0.00 57.97 60.62 1hf3 h PHE 359 Cb 0.23 -0.04 -0.01 0.00 3.61 0.00 0.00 35.95 39.74 1hf3 h PHE 359 CO 0.01 1.08 -0.30 -0.44 -1.61 0.00 0.00 178.31 177.05 1hf3 h ASP 360 N 0.13 0.40 -0.10 2.17 3.32 -0.66 0.22 116.42 121.90 1hf3 h ASP 360 Ca -0.07 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 56.84 1hf3 h ASP 360 Cb 1.62 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 41.06 1hf3 h ASP 360 CO 0.15 0.69 0.06 -0.07 -1.72 0.00 0.00 179.24 178.36 1hf3 h LEU 361 N 0.34 0.12 0.36 1.55 3.38 -1.13 0.26 115.31 120.19 1hf3 h LEU 361 Ca 0.05 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1hf3 h LEU 361 Cb 0.71 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.43 1hf3 h LEU 361 CO 0.05 0.12 -0.17 0.25 0.09 0.00 0.00 178.44 178.78 1hf3 h LEU 362 N 0.12 -0.41 -1.60 1.67 5.85 -1.04 -1.14 115.31 118.76 1hf3 h LEU 362 Ca 0.04 -0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.77 1hf3 h LEU 362 Cb 0.01 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 1hf3 h LEU 362 CO -0.01 -0.23 0.34 0.03 -0.34 0.00 0.00 178.44 178.24 1hf3 h ARG 363 N -0.57 0.50 0.00 1.25 3.08 -0.47 -1.91 114.38 116.26 1hf3 h ARG 363 Ca -0.05 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.97 1hf3 h ARG 363 Cb 0.42 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.36 1hf3 h ARG 363 CO 0.08 0.33 0.00 -1.13 -1.07 0.00 0.00 179.97 178.18 1hf3 n SER 364 N -4.47 0.48 0.00 7.04 3.41 0.89 -4.90 113.62 116.06 1hf3 n SER 364 Ca 0.06 0.55 0.00 0.00 -0.26 0.00 0.00 58.87 59.22 1hf3 n SER 364 Cb 0.20 -0.68 0.00 0.00 -0.26 0.00 0.00 64.21 63.47 1hf3 n SER 364 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1hf3 n GLY 365 N 1.29 0.72 0.17 5.00 0.00 -0.72 -4.93 105.19 106.71 1hf3 n GLY 365 Ca 0.06 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.19 1hf3 n GLY 365 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1hf3 h GLU 366 N 2.50 0.00 -5.87 1.61 5.08 -1.46 -3.47 114.58 112.97 1hf3 h GLU 366 Ca 0.00 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.77 1hf3 h GLU 366 Cb 0.00 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.15 1hf3 h GLU 366 CO 0.00 0.04 -0.56 -1.54 -1.00 0.00 0.00 179.01 175.96 1hf3 s SER 367 N -5.88 4.22 0.00 1.42 1.04 -1.11 -5.01 113.70 108.38 1hf3 s SER 367 Ca 0.03 -1.13 0.00 0.00 0.48 0.00 0.00 55.95 55.34 1hf3 s SER 367 Cb 0.07 -0.47 0.00 0.00 0.10 0.00 0.00 66.02 65.72 1hf3 s SER 367 CO 0.73 -0.43 0.00 -0.38 0.98 0.00 0.00 173.24 174.13 1hf3 n ILE 368 N -1.09 0.00 -5.02 -1.02 2.08 -1.26 -4.81 119.36 108.24 1hf3 n ILE 368 Ca -0.03 0.00 -0.32 0.00 0.56 0.00 0.00 62.75 62.96 1hf3 n ILE 368 Cb 0.65 -0.60 -0.15 0.00 -0.75 0.00 0.00 39.64 38.79 1hf3 n ILE 368 CO 0.00 0.00 0.00 -0.13 0.56 0.00 0.00 176.55 176.98 1hf3 s ARG 369 N 0.00 2.73 -0.21 0.38 1.81 -0.28 -4.62 118.95 118.76 1hf3 s ARG 369 Ca 0.00 -0.78 -0.06 0.00 -1.72 0.00 0.00 55.73 53.17 1hf3 s ARG 369 Cb 0.00 -2.35 -0.03 0.00 -0.45 0.00 0.00 34.95 32.13 1hf3 s ARG 369 CO 0.00 0.43 0.02 0.99 -0.68 0.00 0.00 175.30 176.06 1hf3 s THR 370 N -0.24 4.18 -0.23 0.02 2.01 -1.26 -1.49 115.64 118.63 1hf3 s THR 370 Ca -0.00 -0.23 -0.13 0.00 0.31 0.00 0.00 61.69 61.64 1hf3 s THR 370 Cb -0.13 -2.90 -0.04 0.00 0.01 0.00 0.00 72.50 69.43 1hf3 s THR 370 CO 0.03 0.42 0.26 -0.63 -0.69 0.00 0.00 174.62 174.01 1hf3 s ILE 371 N 0.99 5.28 -0.18 1.82 -1.09 -0.13 -1.59 121.20 126.30 1hf3 s ILE 371 Ca 0.02 0.39 -0.19 0.00 -2.23 0.00 0.00 60.65 58.65 1hf3 s ILE 371 Cb -0.14 -3.60 -0.03 0.00 -1.58 0.00 0.00 42.46 37.10 1hf3 s ILE 371 CO 0.02 0.29 0.51 -0.76 -1.23 0.00 0.00 174.94 173.77 1hf3 s LEU 372 N 1.31 4.18 0.03 2.97 1.43 0.70 -1.13 118.68 128.16 1hf3 s LEU 372 Ca 0.12 0.72 0.02 0.00 -1.03 0.00 0.00 54.13 53.97 1hf3 s LEU 372 Cb -0.14 -2.72 -0.04 0.00 0.03 0.00 0.00 46.19 43.32 1hf3 s LEU 372 CO 0.07 -0.14 0.01 0.42 0.23 0.00 0.00 176.35 176.94 1hf3 s THR 373 N 1.38 4.21 -2.38 5.49 -4.23 0.67 -0.89 115.64 119.90 1hf3 s THR 373 Ca 0.25 -0.68 0.19 0.00 -1.18 0.00 0.00 61.69 60.27 1hf3 s THR 373 Cb -0.15 -2.92 0.15 0.00 1.34 0.00 0.00 72.50 70.91 1hf3 s THR 373 CO 0.10 0.30 1.10 0.49 -0.54 0.00 0.00 174.62 176.07