#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hm9 s ALA 2 N 0.00 1.70 -0.27 2.41 0.00 0.30 -3.08 121.76 122.81 2hm9 s ALA 2 Ca 0.00 -1.12 -0.08 0.00 0.00 0.00 0.00 51.96 50.77 2hm9 s ALA 2 Cb 0.00 -0.27 -0.01 0.00 0.00 0.00 0.00 23.12 22.83 2hm9 s ALA 2 CO 0.00 0.35 0.09 -0.06 0.00 0.00 0.00 175.76 176.14 2hm9 s PHE 3 N -0.98 3.12 -0.22 0.00 0.40 0.50 0.10 117.98 120.90 2hm9 s PHE 3 Ca 0.06 -0.59 0.02 0.00 -0.60 0.00 0.00 56.93 55.82 2hm9 s PHE 3 Cb -0.09 -2.27 0.04 0.00 0.51 0.00 0.00 43.02 41.21 2hm9 s PHE 3 CO 0.03 -0.43 -0.14 -1.17 0.70 0.00 0.00 175.22 174.21 2hm9 s LEU 4 N 1.59 2.82 0.15 -0.37 2.96 -0.82 0.12 118.68 125.13 2hm9 s LEU 4 Ca 0.05 -1.07 -0.18 0.00 -0.22 0.00 0.00 54.13 52.71 2hm9 s LEU 4 Cb -0.16 -1.47 0.04 0.00 0.50 0.00 0.00 46.19 45.10 2hm9 s LEU 4 CO 0.04 -0.12 0.48 -1.66 -1.32 0.00 0.00 176.35 173.77 2hm9 s TRP 5 N 1.21 -0.25 -0.04 5.38 -2.14 -1.09 -4.25 118.94 117.76 2hm9 s TRP 5 Ca -0.03 -0.05 0.06 0.00 2.66 0.00 0.00 56.10 58.73 2hm9 s TRP 5 Cb -0.17 0.36 -0.01 0.00 -3.10 0.00 0.00 33.47 30.55 2hm9 s TRP 5 CO -0.08 -0.80 -0.21 0.00 -2.66 0.00 0.00 176.95 173.20 2hm9 s ALA 6 N -3.81 1.82 0.04 2.67 0.00 -1.26 -2.32 121.76 118.89 2hm9 s ALA 6 Ca 0.04 -0.88 -0.02 0.00 0.00 0.00 0.00 51.96 51.10 2hm9 s ALA 6 Cb 0.00 -0.55 -0.02 0.00 0.00 0.00 0.00 23.12 22.55 2hm9 s ALA 6 CO -0.09 0.37 0.02 1.14 0.00 0.00 0.00 175.76 177.19 2hm9 s GLN 7 N -0.18 0.54 0.85 0.00 -2.07 0.70 -4.65 119.66 114.86 2hm9 s GLN 7 Ca -0.00 -0.92 -0.08 0.00 -1.82 0.00 0.00 55.36 52.53 2hm9 s GLN 7 Cb -0.11 0.20 0.18 0.00 -1.09 0.00 0.00 33.01 32.19 2hm9 s GLN 7 CO 0.02 -0.11 1.16 -0.40 -1.32 0.00 0.00 175.29 174.64 2hm9 n ASP 8 N 0.65 0.73 -0.26 12.60 5.68 -1.04 -2.72 116.55 132.18 2hm9 n ASP 8 Ca -0.18 -1.81 -0.05 0.00 -0.50 0.00 0.00 54.79 52.25 2hm9 n ASP 8 Cb 0.59 -0.83 0.06 0.00 -1.14 0.00 0.00 41.12 39.80 2hm9 n ASP 8 CO 0.00 0.00 0.00 0.08 -1.33 0.00 0.00 177.20 175.95 2hm9 h ARG 9 N 0.00 1.00 -0.67 0.11 0.11 -1.71 -2.70 114.38 110.52 2hm9 h ARG 9 Ca -0.38 -0.10 -0.00 0.00 0.10 0.00 0.00 59.98 59.60 2hm9 h ARG 9 Cb 1.20 -0.20 -0.03 0.00 1.11 0.00 0.00 29.97 32.04 2hm9 h ARG 9 CO 0.33 0.72 0.41 -0.44 0.10 0.00 0.00 179.97 181.09 2hm9 h ASP 10 N 0.99 0.80 0.00 0.08 5.19 -1.91 -3.47 116.42 118.10 2hm9 h ASP 10 Ca 0.26 -0.05 0.00 0.00 -0.62 0.00 0.00 57.03 56.62 2hm9 h ASP 10 Cb -0.01 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 39.30 2hm9 h ASP 10 CO -0.05 0.61 0.00 0.61 -3.12 0.00 0.00 179.24 177.30 2hm9 n GLY 11 N -1.19 0.71 3.79 2.75 0.00 -1.02 -5.11 105.19 105.13 2hm9 n GLY 11 Ca 0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 2hm9 n GLY 11 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2hm9 s LEU 12 N 0.00 4.18 -0.08 0.99 2.96 -1.26 -2.98 118.68 122.49 2hm9 s LEU 12 Ca 0.00 1.81 0.02 0.00 -0.22 0.00 0.00 54.13 55.74 2hm9 s LEU 12 Cb 0.00 -4.21 -0.25 0.00 0.50 0.00 0.00 46.19 42.23 2hm9 s LEU 12 CO 0.00 -0.22 0.52 0.16 -1.32 0.00 0.00 176.35 175.49 2hm9 h ILE 13 N 2.32 0.75 0.00 6.68 3.07 -1.78 -2.76 117.51 125.79 2hm9 h ILE 13 Ca -0.48 -2.52 0.00 0.00 1.55 0.00 0.00 64.86 63.41 2hm9 h ILE 13 Cb 1.19 2.48 0.00 0.00 -0.27 0.00 0.00 36.82 40.22 2hm9 h ILE 13 CO 0.63 0.72 0.00 0.61 -1.05 0.00 0.00 178.15 179.06 2hm9 n GLY 14 N 1.79 -0.54 3.07 0.16 0.00 -1.20 -4.76 105.19 103.71 2hm9 n GLY 14 Ca -0.24 -0.40 -0.13 0.00 0.00 0.00 0.00 46.02 45.25 2hm9 n GLY 14 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2hm9 s LYS 15 N -1.82 0.22 -2.02 1.61 2.20 -1.20 -2.65 119.74 116.07 2hm9 s LYS 15 Ca 0.00 0.42 0.00 0.00 -0.36 0.00 0.00 55.97 56.03 2hm9 s LYS 15 Cb 0.00 -0.01 0.00 0.00 -1.51 0.00 0.00 37.83 36.31 2hm9 s LYS 15 CO 0.00 -0.10 0.00 -0.25 -0.36 0.00 0.00 175.35 174.64 2hm9 n ASP 16 N 3.64 -5.45 0.00 1.43 9.92 -1.26 -2.07 116.55 122.75 2hm9 n ASP 16 Ca -0.19 0.47 0.00 0.00 -0.53 0.00 0.00 54.79 54.54 2hm9 n ASP 16 Cb 0.55 -4.69 0.00 0.00 -0.64 0.00 0.00 41.12 36.34 2hm9 n ASP 16 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2hm9 n GLY 17 N -0.28 2.81 3.79 0.44 0.00 -1.26 -4.84 105.19 105.85 2hm9 n GLY 17 Ca -0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.45 2hm9 n GLY 17 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2hm9 s HIS 18 N -1.34 3.64 -0.46 1.61 -3.43 -0.88 -4.88 115.29 109.55 2hm9 s HIS 18 Ca 0.00 0.92 -0.31 0.00 -0.80 0.00 0.00 55.06 54.87 2hm9 s HIS 18 Cb 0.00 -2.38 -0.11 0.00 -1.43 0.00 0.00 32.58 28.67 2hm9 s HIS 18 CO 0.00 0.46 2.33 1.28 -2.00 0.00 0.00 174.74 176.80 2hm9 n LEU 19 N 2.57 2.10 0.21 5.38 4.77 -1.26 -3.26 117.00 127.51 2hm9 n LEU 19 Ca -0.12 0.09 0.05 0.00 -0.03 0.00 0.00 56.01 56.01 2hm9 n LEU 19 Cb 0.52 -1.35 0.45 0.00 -2.33 0.00 0.00 43.42 40.72 2hm9 n LEU 19 CO 0.39 -0.96 0.80 -0.65 -1.33 0.00 0.00 177.39 175.64 2hm9 h PRO 20 N 14.74 0.00 -6.30 3.23 0.11 -1.86 -3.43 132.00 138.49 2hm9 h PRO 20 Ca -0.25 0.00 -0.55 0.00 0.11 0.00 0.00 66.00 65.31 2hm9 h PRO 20 Cb 1.29 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.36 2hm9 h PRO 20 CO 1.10 0.29 0.13 1.67 -0.21 0.00 0.00 178.00 180.98 2hm9 s TRP 21 N -4.18 3.76 -0.80 0.65 -2.14 -1.26 -5.01 118.94 109.96 2hm9 s TRP 21 Ca -0.03 1.45 -0.19 0.00 2.66 0.00 0.00 56.10 59.99 2hm9 s TRP 21 Cb 0.14 -2.77 0.12 0.00 -3.10 0.00 0.00 33.47 27.86 2hm9 s TRP 21 CO 0.69 0.33 0.97 -1.58 -2.66 0.00 0.00 176.95 174.70 2hm9 s HIS 22 N -0.28 3.06 -0.54 1.66 2.46 -1.26 -4.92 115.29 115.48 2hm9 s HIS 22 Ca 0.37 -1.18 0.05 0.00 0.47 0.00 0.00 55.06 54.77 2hm9 s HIS 22 Cb -0.20 -4.19 0.20 0.00 -0.13 0.00 0.00 32.58 28.26 2hm9 s HIS 22 CO 0.22 -1.44 0.49 -0.11 -2.47 0.00 0.00 174.74 171.44 2hm9 n LEU 23 N 6.51 1.45 -0.40 8.88 7.94 -1.26 -4.96 117.00 135.16 2hm9 n LEU 23 Ca 0.10 -4.88 0.35 0.00 -1.11 0.00 0.00 56.01 50.48 2hm9 n LEU 23 Cb 0.47 -0.04 0.69 0.00 0.53 0.00 0.00 43.42 45.06 2hm9 n LEU 23 CO 0.53 1.90 1.31 1.55 -1.11 0.00 0.00 177.39 181.58 2hm9 h PRO 24 N 4.99 0.11 0.80 1.96 0.13 -1.97 -0.81 132.00 137.20 2hm9 h PRO 24 Ca 0.18 -0.01 -0.04 0.00 -0.87 0.00 0.00 66.00 65.27 2hm9 h PRO 24 Cb 0.81 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 31.91 2hm9 h PRO 24 CO 0.58 0.07 -0.49 0.22 -0.23 0.00 0.00 178.00 178.14 2hm9 h ASP 25 N 0.11 -1.25 -0.34 1.44 1.82 -1.97 0.84 116.42 117.07 2hm9 h ASP 25 Ca 0.67 0.07 -0.06 0.00 -0.39 0.00 0.00 57.03 57.33 2hm9 h ASP 25 Cb 2.37 0.36 -0.02 0.00 0.68 0.00 0.00 39.33 42.72 2hm9 h ASP 25 CO -0.15 -0.76 0.02 -0.78 -1.61 0.00 0.00 179.24 175.96 2hm9 h ASP 26 N -1.21 0.65 -0.66 2.28 1.82 -1.62 -1.83 116.42 115.86 2hm9 h ASP 26 Ca -0.11 -0.13 -0.03 0.00 -0.39 0.00 0.00 57.03 56.37 2hm9 h ASP 26 Cb 0.97 -0.17 -0.03 0.00 0.68 0.00 0.00 39.33 40.78 2hm9 h ASP 26 CO 0.11 0.70 0.28 -0.07 -1.61 0.00 0.00 179.24 178.65 2hm9 h LEU 27 N 0.65 0.89 -0.89 2.28 3.38 -0.95 -1.97 115.31 118.70 2hm9 h LEU 27 Ca 0.14 -0.16 0.02 0.00 0.09 0.00 0.00 57.88 57.97 2hm9 h LEU 27 Cb 0.37 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.85 2hm9 h LEU 27 CO 0.01 0.80 0.58 0.45 0.09 0.00 0.00 178.44 180.37 2hm9 h HIS 28 N 0.92 1.10 -0.39 1.13 3.86 0.12 -1.96 115.15 119.92 2hm9 h HIS 28 Ca 0.22 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.46 2hm9 h HIS 28 Cb 0.17 -0.37 -0.02 0.00 1.06 0.00 0.00 27.41 28.26 2hm9 h HIS 28 CO 0.01 0.66 0.25 -0.92 0.86 0.00 0.00 177.93 178.79 2hm9 h TYR 29 N 1.16 0.51 -0.31 2.45 3.20 -0.68 -0.80 116.97 122.49 2hm9 h TYR 29 Ca 0.34 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.21 2hm9 h TYR 29 Cb -0.07 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.01 2hm9 h TYR 29 CO -0.01 0.34 0.19 0.35 -1.64 0.00 0.00 178.16 177.38 2hm9 h PHE 30 N 0.53 0.41 -0.67 -3.82 3.57 -0.86 -1.82 116.94 114.28 2hm9 h PHE 30 Ca 0.14 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.64 2hm9 h PHE 30 Cb -0.03 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.54 2hm9 h PHE 30 CO -0.04 0.31 0.40 -0.09 -2.23 0.00 0.00 178.31 176.65 2hm9 h ARG 31 N 0.40 0.92 -0.68 1.11 2.43 -1.16 -2.43 114.38 114.97 2hm9 h ARG 31 Ca 0.11 -0.09 -0.06 0.00 -0.81 0.00 0.00 59.98 59.13 2hm9 h ARG 31 Cb 0.02 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.35 2hm9 h ARG 31 CO -0.02 0.66 0.17 0.00 -1.51 0.00 0.00 179.97 179.27 2hm9 h ALA 32 N 1.20 1.03 -0.14 2.80 0.00 -0.95 -2.73 119.26 120.47 2hm9 h ALA 32 Ca 0.24 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 2hm9 h ALA 32 Cb -0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2hm9 h ALA 32 CO -0.04 0.64 -0.22 1.96 0.00 0.00 0.00 179.25 181.58 2hm9 h GLN 33 N 1.02 0.24 -0.12 0.00 4.20 -1.02 -2.49 115.11 116.94 2hm9 h GLN 33 Ca 0.22 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.85 2hm9 h GLN 33 Cb 0.34 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.10 2hm9 h GLN 33 CO -0.00 0.46 0.00 0.25 -0.67 0.00 0.00 178.83 178.87 2hm9 n THR 34 N -4.19 0.16 -3.13 -0.54 -2.24 -0.94 -4.66 114.28 98.74 2hm9 n THR 34 Ca -0.01 -0.18 -0.40 0.00 -2.27 0.00 0.00 64.05 61.18 2hm9 n THR 34 Cb 0.34 0.06 -0.06 0.00 -2.10 0.00 0.00 70.33 68.56 2hm9 n THR 34 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2hm9 s VAL 35 N -1.84 5.00 -0.06 2.28 -7.23 -0.94 -3.67 120.40 113.94 2hm9 s VAL 35 Ca 0.18 1.11 0.00 0.00 -1.81 0.00 0.00 61.98 61.46 2hm9 s VAL 35 Cb 0.09 -3.92 0.00 0.00 0.56 0.00 0.00 36.38 33.11 2hm9 s VAL 35 CO 0.14 0.05 0.00 0.61 -0.31 0.00 0.00 175.10 175.59 2hm9 n GLY 36 N 4.10 0.47 3.09 2.32 0.00 -0.96 -5.03 105.19 109.18 2hm9 n GLY 36 Ca -0.01 -0.59 -0.12 0.00 0.00 0.00 0.00 46.02 45.30 2hm9 n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hm9 s LYS 37 N -1.22 0.61 -0.05 1.61 1.02 -1.24 -4.88 119.74 115.58 2hm9 s LYS 37 Ca 0.00 -0.93 -0.28 0.00 0.02 0.00 0.00 55.97 54.78 2hm9 s LYS 37 Cb 0.00 -0.24 -0.03 0.00 -0.52 0.00 0.00 37.83 37.05 2hm9 s LYS 37 CO 0.00 0.02 0.93 0.42 -0.92 0.00 0.00 175.35 175.80 2hm9 s ILE 38 N -2.08 4.88 0.09 2.17 1.01 -0.30 -3.61 121.20 123.37 2hm9 s ILE 38 Ca -0.04 1.92 0.08 0.00 0.00 0.00 0.00 60.65 62.61 2hm9 s ILE 38 Cb -0.05 -4.26 -0.03 0.00 0.01 0.00 0.00 42.46 38.13 2hm9 s ILE 38 CO -0.01 0.12 -0.20 -0.32 0.00 0.00 0.00 174.94 174.53 2hm9 s MET 39 N 1.33 1.14 -0.11 2.79 -2.45 0.11 0.74 119.30 122.85 2hm9 s MET 39 Ca 0.47 -1.11 0.04 0.00 -1.25 0.00 0.00 55.69 53.84 2hm9 s MET 39 Cb -0.19 -1.37 0.00 0.00 1.25 0.00 0.00 34.83 34.52 2hm9 s MET 39 CO 0.22 0.32 -0.23 0.08 1.05 0.00 0.00 175.02 176.46 2hm9 s VAL 40 N -1.11 2.07 -0.07 10.11 1.01 0.25 -1.26 120.40 131.39 2hm9 s VAL 40 Ca 0.06 -1.01 0.04 0.00 0.00 0.00 0.00 61.98 61.07 2hm9 s VAL 40 Cb -0.10 -1.79 -0.00 0.00 0.00 0.00 0.00 36.38 34.49 2hm9 s VAL 40 CO 0.04 0.56 -0.21 0.68 0.00 0.00 0.00 175.10 176.17 2hm9 s VAL 41 N 0.44 1.78 1.01 2.92 -7.23 0.19 -1.06 120.40 118.44 2hm9 s VAL 41 Ca -0.16 -0.88 -0.12 0.00 -1.81 0.00 0.00 61.98 59.00 2hm9 s VAL 41 Cb -0.17 -1.54 0.19 0.00 0.56 0.00 0.00 36.38 35.42 2hm9 s VAL 41 CO 0.07 0.50 1.09 -0.83 -0.31 0.00 0.00 175.10 175.61 2hm9 s GLY 42 N 0.23 1.57 0.17 2.32 0.00 0.13 -0.89 107.32 110.85 2hm9 s GLY 42 Ca -0.12 -0.31 -0.14 0.00 0.00 0.00 0.00 44.72 44.15 2hm9 s GLY 42 CO 0.06 0.30 1.81 -0.09 0.00 0.00 0.00 173.10 175.17 2hm9 h ARG 43 N -1.94 0.74 -0.39 2.90 1.12 -1.70 -1.04 114.38 114.07 2hm9 h ARG 43 Ca -0.55 -0.07 0.02 0.00 -1.11 0.00 0.00 59.98 58.27 2hm9 h ARG 43 Cb 1.33 -0.15 -0.02 0.00 -0.01 0.00 0.00 29.97 31.11 2hm9 h ARG 43 CO 0.57 0.54 0.26 0.00 -3.11 0.00 0.00 179.97 178.22 2hm9 h ARG 44 N 0.73 0.45 -0.40 0.20 3.08 -1.92 -1.53 114.38 115.00 2hm9 h ARG 44 Ca 0.20 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.19 2hm9 h ARG 44 Cb -0.01 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 2hm9 h ARG 44 CO -0.04 0.30 0.13 1.15 -1.07 0.00 0.00 179.97 180.45 2hm9 h THR 45 N 0.46 1.21 -0.56 2.04 2.02 -1.57 -1.12 112.91 115.39 2hm9 h THR 45 Ca 0.15 -0.68 0.11 0.00 0.77 0.00 0.00 66.41 66.77 2hm9 h THR 45 Cb 0.04 0.91 -0.11 0.00 -1.74 0.00 0.00 68.15 67.25 2hm9 h THR 45 CO -0.03 0.24 -0.14 0.22 0.37 0.00 0.00 175.52 176.18 2hm9 h TYR 46 N 0.50 -0.29 0.00 3.16 3.20 -0.32 0.89 116.97 124.11 2hm9 h TYR 46 Ca 0.13 0.05 -0.09 0.00 3.14 0.00 0.00 58.73 61.96 2hm9 h TYR 46 Cb 0.24 0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 2hm9 h TYR 46 CO 0.01 -0.24 -0.44 0.93 -1.64 0.00 0.00 178.16 176.77 2hm9 h GLU 47 N 0.00 0.00 0.00 1.82 5.08 -1.46 -3.18 114.58 116.84 2hm9 h GLU 47 Ca 0.27 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.46 2hm9 h GLU 47 Cb 0.41 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 2hm9 h GLU 47 CO -0.58 0.44 -0.84 0.77 -1.00 0.00 0.00 179.01 177.80 2hm9 h SER 48 N 0.00 0.00 -3.74 1.42 0.02 0.34 -3.46 113.55 108.13 2hm9 h SER 48 Ca -0.00 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.38 2hm9 h SER 48 Cb 1.14 0.00 0.14 0.00 0.14 0.00 0.00 62.40 63.82 2hm9 h SER 48 CO 0.06 0.75 0.43 0.33 -1.14 0.00 0.00 176.83 177.26 2hm9 n PHE 49 N -3.25 1.82 0.17 3.45 7.35 0.29 -4.72 117.46 122.57 2hm9 n PHE 49 Ca -0.01 0.46 -0.13 0.00 -0.76 0.00 0.00 57.45 57.00 2hm9 n PHE 49 Cb 0.85 -2.30 -0.08 0.00 0.35 0.00 0.00 39.48 38.30 2hm9 n PHE 49 CO 0.00 0.00 0.00 -1.00 -0.76 0.00 0.00 176.76 175.00 2hm9 h PRO 50 N 1.32 -0.43 -2.08 -7.13 0.13 -1.89 -3.46 132.00 118.46 2hm9 h PRO 50 Ca -0.49 0.03 0.02 0.00 -0.87 0.00 0.00 66.00 64.69 2hm9 h PRO 50 Cb 1.32 0.10 -0.21 0.00 0.13 0.00 0.00 31.00 32.33 2hm9 h PRO 50 CO 0.56 -0.12 -0.07 0.21 -0.23 0.00 0.00 178.00 178.35 2hm9 s LYS 51 N -4.80 0.63 0.13 0.86 2.20 -1.26 -5.17 119.74 112.33 2hm9 s LYS 51 Ca -0.14 1.25 0.06 0.00 -0.36 0.00 0.00 55.97 56.78 2hm9 s LYS 51 Cb 0.02 0.36 -0.04 0.00 -1.51 0.00 0.00 37.83 36.66 2hm9 s LYS 51 CO 0.55 -0.17 -0.13 1.03 -0.36 0.00 0.00 175.35 176.27 2hm9 s ARG 52 N 2.04 1.03 0.63 4.03 3.00 -1.26 -4.62 118.95 123.81 2hm9 s ARG 52 Ca -0.08 -1.28 0.03 0.00 0.00 0.00 0.00 55.73 54.39 2hm9 s ARG 52 Cb -0.08 -0.85 0.09 0.00 0.00 0.00 0.00 34.95 34.11 2hm9 s ARG 52 CO -0.19 0.15 0.88 -1.25 0.00 0.00 0.00 175.30 174.89 2hm9 s PRO 53 N -2.87 2.07 -0.19 3.54 0.04 -1.26 -4.83 135.00 131.50 2hm9 s PRO 53 Ca 0.10 -1.19 -0.06 0.00 0.04 0.00 0.00 61.00 59.90 2hm9 s PRO 53 Cb -0.04 -2.46 -0.03 0.00 0.04 0.00 0.00 34.50 32.01 2hm9 s PRO 53 CO 0.03 -1.09 0.01 -0.51 0.04 0.00 0.00 177.00 175.48 2hm9 s LEU 54 N -4.90 3.42 0.82 -3.56 1.02 -1.26 -5.10 118.68 109.11 2hm9 s LEU 54 Ca 0.63 -0.11 -0.13 0.00 0.02 0.00 0.00 54.13 54.53 2hm9 s LEU 54 Cb -0.07 -1.86 0.09 0.00 0.02 0.00 0.00 46.19 44.37 2hm9 s LEU 54 CO 0.41 0.11 1.19 -2.65 0.02 0.00 0.00 176.35 175.43 2hm9 n PRO 55 N 3.97 0.13 -1.53 1.29 -0.02 -1.26 -3.00 135.00 134.58 2hm9 n PRO 55 Ca -0.17 0.12 -0.18 0.00 -2.02 0.00 0.00 63.50 61.26 2hm9 n PRO 55 Cb 0.52 -2.43 -0.07 0.00 -0.02 0.00 0.00 33.50 31.50 2hm9 n PRO 55 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2hm9 n GLU 56 N -3.32 -1.23 -4.00 -0.52 4.71 -1.26 -4.93 120.64 110.09 2hm9 n GLU 56 Ca 0.13 1.12 -0.08 0.00 -0.01 0.00 0.00 57.16 58.32 2hm9 n GLU 56 Cb 0.51 -5.37 -0.10 0.00 -1.01 0.00 0.00 31.44 25.46 2hm9 n GLU 56 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 2hm9 s ARG 57 N -3.53 0.57 -0.37 3.49 0.52 -1.16 -2.26 118.95 116.20 2hm9 s ARG 57 Ca 0.00 -0.93 -0.01 0.00 -0.52 0.00 0.00 55.73 54.27 2hm9 s ARG 57 Cb 0.00 0.21 0.10 0.00 0.52 0.00 0.00 34.95 35.78 2hm9 s ARG 57 CO 0.00 -0.12 0.13 0.99 0.02 0.00 0.00 175.30 176.32 2hm9 s THR 58 N -3.03 2.98 -0.12 0.02 2.01 -1.24 -4.85 115.64 111.42 2hm9 s THR 58 Ca -0.01 -2.02 -0.07 0.00 0.31 0.00 0.00 61.69 59.90 2hm9 s THR 58 Cb 0.01 -3.02 -0.04 0.00 0.01 0.00 0.00 72.50 69.46 2hm9 s THR 58 CO -0.07 -0.57 0.14 0.20 -0.69 0.00 0.00 174.62 173.63 2hm9 s ASN 59 N 1.51 6.37 -0.05 3.53 -0.87 -1.26 -0.71 114.94 123.46 2hm9 s ASN 59 Ca 0.07 0.46 0.03 0.00 -1.57 0.00 0.00 52.86 51.84 2hm9 s ASN 59 Cb -0.21 -2.06 0.01 0.00 -0.02 0.00 0.00 41.25 38.97 2hm9 s ASN 59 CO -0.05 0.41 -0.11 -0.69 -2.57 0.00 0.00 177.10 174.08 2hm9 s VAL 60 N -1.04 1.03 -0.21 1.60 1.01 -0.39 -1.77 120.40 120.63 2hm9 s VAL 60 Ca 0.15 -0.46 -0.08 0.00 0.00 0.00 0.00 61.98 61.60 2hm9 s VAL 60 Cb -0.12 -0.93 -0.04 0.00 0.00 0.00 0.00 36.38 35.29 2hm9 s VAL 60 CO 0.04 0.32 0.08 -0.69 0.00 0.00 0.00 175.10 174.86 2hm9 s VAL 61 N 0.42 4.77 -0.20 2.92 1.01 0.52 0.54 120.40 130.38 2hm9 s VAL 61 Ca -0.09 -0.03 -0.05 0.00 0.00 0.00 0.00 61.98 61.81 2hm9 s VAL 61 Cb -0.13 -3.18 -0.03 0.00 0.00 0.00 0.00 36.38 33.04 2hm9 s VAL 61 CO 0.02 0.40 0.01 -0.22 0.00 0.00 0.00 175.10 175.31 2hm9 s LEU 62 N 0.84 3.31 -0.06 3.92 0.20 -0.07 -1.83 118.68 125.00 2hm9 s LEU 62 Ca 0.04 -0.17 0.03 0.00 0.69 0.00 0.00 54.13 54.72 2hm9 s LEU 62 Cb -0.13 -1.84 0.01 0.00 -0.43 0.00 0.00 46.19 43.80 2hm9 s LEU 62 CO 0.02 0.08 -0.13 0.28 -0.29 0.00 0.00 176.35 176.31 2hm9 s THR 63 N 0.92 1.20 0.13 3.68 -1.32 -1.14 -1.81 115.64 117.32 2hm9 s THR 63 Ca 0.01 -0.53 -0.14 0.00 -1.21 0.00 0.00 61.69 59.82 2hm9 s THR 63 Cb -0.14 -1.08 -0.01 0.00 -1.51 0.00 0.00 72.50 69.76 2hm9 s THR 63 CO 0.02 0.37 1.59 -0.74 -2.21 0.00 0.00 174.62 173.64 2hm9 h HIS 64 N 6.82 0.83 -3.58 9.09 2.76 -1.88 -3.36 115.15 125.84 2hm9 h HIS 64 Ca -0.30 -0.14 -0.51 0.00 -2.20 0.00 0.00 60.37 57.21 2hm9 h HIS 64 Cb 1.19 -0.22 -0.01 0.00 1.55 0.00 0.00 27.41 29.93 2hm9 h HIS 64 CO 0.48 0.81 0.43 -1.14 -1.30 0.00 0.00 177.93 177.21 2hm9 s GLN 65 N -5.03 4.65 0.00 5.26 2.00 -1.26 -4.94 119.66 120.33 2hm9 s GLN 65 Ca -0.13 1.61 0.30 0.00 -2.00 0.00 0.00 55.36 55.14 2hm9 s GLN 65 Cb 0.11 -3.31 1.64 0.00 0.80 0.00 0.00 33.01 32.25 2hm9 s GLN 65 CO 0.80 0.15 2.07 0.39 -0.50 0.00 0.00 175.29 178.20 2hm9 n GLU 66 N 2.45 0.70 -0.34 1.67 1.02 -1.26 -3.10 120.64 121.78 2hm9 n GLU 66 Ca 0.02 0.01 0.10 0.00 -0.02 0.00 0.00 57.16 57.27 2hm9 n GLU 66 Cb 0.47 -1.50 0.28 0.00 -0.02 0.00 0.00 31.44 30.67 2hm9 n GLU 66 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2hm9 n ASP 67 N -1.13 3.40 -4.46 1.62 -0.08 -1.26 -4.93 116.55 109.70 2hm9 n ASP 67 Ca 0.19 -2.05 -0.30 0.00 -1.51 0.00 0.00 54.79 51.11 2hm9 n ASP 67 Cb 0.16 -0.43 -0.12 0.00 2.34 0.00 0.00 41.12 43.07 2hm9 n ASP 67 CO 0.00 0.00 0.00 -0.47 0.12 0.00 0.00 177.20 176.85 2hm9 s TYR 68 N -1.27 2.55 0.09 -0.67 5.04 -1.18 -5.13 117.35 116.78 2hm9 s TYR 68 Ca 0.41 -0.26 0.03 0.00 -2.44 0.00 0.00 57.07 54.82 2hm9 s TYR 68 Cb 0.22 -1.44 -0.03 0.00 0.35 0.00 0.00 41.96 41.06 2hm9 s TYR 68 CO 0.27 0.28 -0.09 -0.65 -1.34 0.00 0.00 175.55 174.02 2hm9 s GLN 69 N -1.60 0.80 0.05 4.97 1.11 -1.26 -4.98 119.66 118.75 2hm9 s GLN 69 Ca 0.15 -1.12 0.05 0.00 0.01 0.00 0.00 55.36 54.45 2hm9 s GLN 69 Cb -0.11 -0.46 -0.02 0.00 -1.01 0.00 0.00 33.01 31.41 2hm9 s GLN 69 CO 0.06 0.07 -0.13 0.00 0.01 0.00 0.00 175.29 175.30 2hm9 s ALA 70 N -2.42 1.09 -0.14 6.09 0.00 -1.26 -5.13 121.76 119.99 2hm9 s ALA 70 Ca 0.04 -0.87 -0.04 0.00 0.00 0.00 0.00 51.96 51.09 2hm9 s ALA 70 Cb -0.03 -0.12 -0.03 0.00 0.00 0.00 0.00 23.12 22.93 2hm9 s ALA 70 CO -0.01 0.17 0.00 -0.65 0.00 0.00 0.00 175.76 175.28 2hm9 s GLN 71 N -1.39 3.50 0.00 0.00 -0.21 -1.26 -4.46 119.66 115.84 2hm9 s GLN 71 Ca -0.01 -0.43 0.00 0.00 0.02 0.00 0.00 55.36 54.94 2hm9 s GLN 71 Cb -0.09 -2.95 0.00 0.00 1.00 0.00 0.00 33.01 30.97 2hm9 s GLN 71 CO 0.02 0.42 0.00 0.41 -2.12 0.00 0.00 175.29 174.02 2hm9 n GLY 72 N 3.01 2.51 2.86 3.09 0.00 -1.26 -4.69 105.19 110.71 2hm9 n GLY 72 Ca -0.18 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.70 2hm9 n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hm9 s ALA 73 N -2.30 0.18 0.24 4.61 0.00 -1.26 -4.54 121.76 118.69 2hm9 s ALA 73 Ca 0.00 0.04 -0.31 0.00 0.00 0.00 0.00 51.96 51.68 2hm9 s ALA 73 Cb 0.00 -0.13 -0.12 0.00 0.00 0.00 0.00 23.12 22.86 2hm9 s ALA 73 CO 0.00 -0.01 1.59 0.28 0.00 0.00 0.00 175.76 177.62 2hm9 n VAL 74 N 3.45 0.62 -3.49 0.00 0.31 -0.73 -3.62 118.33 114.86 2hm9 n VAL 74 Ca -0.18 -0.15 -0.40 0.00 -0.01 0.00 0.00 64.34 63.60 2hm9 n VAL 74 Cb 0.56 -1.81 -0.10 0.00 -0.91 0.00 0.00 33.84 31.57 2hm9 n VAL 74 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2hm9 s VAL 75 N 0.40 5.25 -0.09 2.52 1.01 -1.25 0.20 120.40 128.44 2hm9 s VAL 75 Ca 0.70 -0.06 0.03 0.00 0.00 0.00 0.00 61.98 62.65 2hm9 s VAL 75 Cb -0.55 -3.72 0.00 0.00 0.00 0.00 0.00 36.38 32.11 2hm9 s VAL 75 CO 0.43 0.01 -0.20 0.68 0.00 0.00 0.00 175.10 176.02 2hm9 s VAL 76 N 1.83 1.73 -2.15 2.92 -7.23 -0.76 -4.99 120.40 111.75 2hm9 s VAL 76 Ca 0.08 -0.83 0.21 0.00 -1.81 0.00 0.00 61.98 59.63 2hm9 s VAL 76 Cb -0.17 -1.52 0.05 0.00 0.56 0.00 0.00 36.38 35.31 2hm9 s VAL 76 CO 0.11 0.49 1.07 1.41 -0.31 0.00 0.00 175.10 177.87 2hm9 n HIS 77 N 3.63 0.00 -3.79 2.82 -0.00 -1.26 -2.86 115.22 113.76 2hm9 n HIS 77 Ca -0.20 0.00 -0.36 0.00 -0.00 0.00 0.00 57.72 57.16 2hm9 n HIS 77 Cb 0.53 0.00 -0.10 0.00 -0.00 0.00 0.00 29.99 30.42 2hm9 n HIS 77 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 2hm9 s ASP 78 N -2.11 5.83 0.16 0.41 1.11 -1.26 -4.78 116.67 116.03 2hm9 s ASP 78 Ca 0.20 0.06 -0.13 0.00 0.18 0.00 0.00 52.55 52.86 2hm9 s ASP 78 Cb 0.17 -2.03 0.06 0.00 1.07 0.00 0.00 42.92 42.18 2hm9 s ASP 78 CO 0.43 0.09 1.74 0.58 1.18 0.00 0.00 175.17 179.19 2hm9 h VAL 79 N 5.03 1.21 -0.50 -1.27 2.07 -1.98 -2.26 116.25 118.53 2hm9 h VAL 79 Ca -0.38 -0.60 -0.03 0.00 0.82 0.00 0.00 66.70 66.51 2hm9 h VAL 79 Cb 1.17 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 2hm9 h VAL 79 CO 0.66 0.24 0.18 0.00 0.02 0.00 0.00 177.57 178.67 2hm9 h ALA 80 N 1.09 1.37 -0.63 1.67 0.00 -2.00 -2.34 119.26 118.42 2hm9 h ALA 80 Ca 0.18 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2hm9 h ALA 80 Cb 0.14 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2hm9 h ALA 80 CO -0.02 0.47 0.26 0.00 0.00 0.00 0.00 179.25 179.95 2hm9 h ALA 81 N 1.48 1.26 -0.59 0.00 0.00 -1.83 -0.93 119.26 118.64 2hm9 h ALA 81 Ca 0.17 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2hm9 h ALA 81 Cb 0.18 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 2hm9 h ALA 81 CO -0.01 0.55 0.24 0.28 0.00 0.00 0.00 179.25 180.30 2hm9 h VAL 82 N 0.91 1.23 -0.44 0.00 2.07 -1.03 -0.45 116.25 118.53 2hm9 h VAL 82 Ca 0.22 -0.71 0.00 0.00 0.82 0.00 0.00 66.70 67.03 2hm9 h VAL 82 Cb 0.17 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 30.50 2hm9 h VAL 82 CO -0.02 0.28 0.29 -0.26 0.02 0.00 0.00 177.57 177.87 2hm9 h PHE 83 N 0.82 0.57 -0.54 1.57 0.04 -1.22 -2.39 116.94 115.79 2hm9 h PHE 83 Ca 0.20 0.01 -0.03 0.00 2.80 0.00 0.00 57.97 60.95 2hm9 h PHE 83 Cb 0.20 -0.19 -0.03 0.00 2.20 0.00 0.00 35.95 38.13 2hm9 h PHE 83 CO 0.01 0.37 0.21 0.00 -0.60 0.00 0.00 178.31 178.30 2hm9 h ALA 84 N 1.15 1.37 -0.25 2.45 0.00 -0.78 -2.15 119.26 121.05 2hm9 h ALA 84 Ca 0.16 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2hm9 h ALA 84 Cb -0.05 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2hm9 h ALA 84 CO -0.03 0.48 0.16 -0.92 0.00 0.00 0.00 179.25 178.94 2hm9 h TYR 85 N 0.76 0.31 -0.61 0.00 3.20 -0.58 0.13 116.97 120.19 2hm9 h TYR 85 Ca 0.18 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.00 2hm9 h TYR 85 Cb 0.15 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.29 2hm9 h TYR 85 CO 0.01 0.19 0.14 0.00 -1.64 0.00 0.00 178.16 176.86 2hm9 h ALA 86 N 1.09 1.10 -0.48 1.82 0.00 -1.25 -2.26 119.26 119.29 2hm9 h ALA 86 Ca 0.09 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 2hm9 h ALA 86 Cb -0.04 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 2hm9 h ALA 86 CO -0.02 0.60 0.13 0.87 0.00 0.00 0.00 179.25 180.82 2hm9 h LYS 87 N 0.91 0.71 -0.74 0.00 1.57 -0.90 -2.59 116.57 115.53 2hm9 h LYS 87 Ca 0.19 -0.13 -0.04 0.00 -1.87 0.00 0.00 60.65 58.80 2hm9 h LYS 87 Cb 0.34 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 2hm9 h LYS 87 CO 0.00 0.64 0.30 1.96 -0.57 0.00 0.00 179.45 181.77 2hm9 h GLN 88 N 0.69 1.10 -2.91 3.15 4.20 -0.16 -3.32 115.11 117.86 2hm9 h GLN 88 Ca 0.16 -0.19 -0.64 0.00 0.06 0.00 0.00 58.65 58.04 2hm9 h GLN 88 Cb 0.24 -0.18 -0.40 0.00 0.30 0.00 0.00 27.48 27.43 2hm9 h GLN 88 CO -0.01 0.89 -0.45 0.72 -0.67 0.00 0.00 178.83 179.31 2hm9 n HIS 89 N -4.29 3.50 0.26 2.96 8.25 -0.98 -4.91 115.22 120.02 2hm9 n HIS 89 Ca 0.07 -4.20 0.08 0.00 -0.26 0.00 0.00 57.72 53.41 2hm9 n HIS 89 Cb 0.18 -0.72 0.65 0.00 1.12 0.00 0.00 29.99 31.22 2hm9 n HIS 89 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 2hm9 h PRO 90 N 5.20 0.00 -0.34 -0.41 0.11 -1.66 -2.03 132.00 132.88 2hm9 h PRO 90 Ca 0.17 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.22 2hm9 h PRO 90 Cb 0.74 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.83 2hm9 h PRO 90 CO 0.79 0.02 -0.04 0.22 -0.21 0.00 0.00 178.00 178.78 2hm9 h ASP 91 N 0.00 0.52 -3.32 -2.05 3.58 -1.91 -3.41 116.42 109.83 2hm9 h ASP 91 Ca -0.00 -0.11 -0.63 0.00 0.42 0.00 0.00 57.03 56.71 2hm9 h ASP 91 Cb 0.04 -0.14 -0.18 0.00 1.72 0.00 0.00 39.33 40.77 2hm9 h ASP 91 CO 0.00 0.61 -0.61 -1.58 -2.88 0.00 0.00 179.24 174.79 2hm9 s GLN 92 N -4.91 3.84 0.47 0.28 2.00 -0.76 -5.09 119.66 115.49 2hm9 s GLN 92 Ca -0.08 -0.42 -0.19 0.00 -2.00 0.00 0.00 55.36 52.67 2hm9 s GLN 92 Cb 0.15 -3.11 -0.09 0.00 0.80 0.00 0.00 33.01 30.76 2hm9 s GLN 92 CO 0.77 0.23 0.98 -1.21 -0.50 0.00 0.00 175.29 175.56 2hm9 s GLU 93 N 0.45 4.03 -0.20 1.67 8.01 -1.26 -4.80 118.70 126.61 2hm9 s GLU 93 Ca 0.01 1.10 -0.08 0.00 0.01 0.00 0.00 54.97 56.01 2hm9 s GLU 93 Cb -0.13 -2.15 -0.04 0.00 -4.31 0.00 0.00 34.13 27.50 2hm9 s GLU 93 CO 0.01 -0.20 0.08 -1.17 0.01 0.00 0.00 175.26 173.99 2hm9 s LEU 94 N -3.58 3.83 -0.07 1.80 2.96 -1.25 -1.15 118.68 121.22 2hm9 s LEU 94 Ca 0.62 0.06 0.04 0.00 -0.22 0.00 0.00 54.13 54.63 2hm9 s LEU 94 Cb -0.11 -1.98 -0.00 0.00 0.50 0.00 0.00 46.19 44.60 2hm9 s LEU 94 CO 0.21 0.14 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.48 2hm9 s VAL 95 N 0.61 1.74 -0.47 1.68 1.01 0.23 0.11 120.40 125.30 2hm9 s VAL 95 Ca 0.04 -0.87 -0.17 0.00 0.00 0.00 0.00 61.98 60.99 2hm9 s VAL 95 Cb -0.13 -1.50 0.06 0.00 0.00 0.00 0.00 36.38 34.81 2hm9 s VAL 95 CO 0.01 0.49 0.48 -0.63 0.00 0.00 0.00 175.10 175.45 2hm9 s ILE 96 N 0.14 5.09 -0.93 2.22 -1.09 0.29 0.86 121.20 127.78 2hm9 s ILE 96 Ca -0.09 -0.74 0.23 0.00 -2.23 0.00 0.00 60.65 57.82 2hm9 s ILE 96 Cb -0.14 -4.16 0.21 0.00 -1.58 0.00 0.00 42.46 36.78 2hm9 s ILE 96 CO 0.05 -0.62 1.74 0.00 -1.23 0.00 0.00 174.94 174.88 2hm9 n ALA 97 N 5.60 2.05 0.00 9.38 0.00 -0.22 -1.95 120.51 135.37 2hm9 n ALA 97 Ca -0.10 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.28 2hm9 n ALA 97 Cb 0.45 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.51 2hm9 n ALA 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2hm9 n GLY 98 N 0.87 0.79 0.00 0.00 0.00 -1.24 -4.81 105.19 100.81 2hm9 n GLY 98 Ca 0.05 -1.88 0.00 0.00 0.00 0.00 0.00 46.02 44.19 2hm9 n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hm9 n GLY 99 N -0.79 0.70 0.34 -0.02 0.00 -1.26 0.21 105.19 104.36 2hm9 n GLY 99 Ca 0.00 -1.88 -0.03 0.00 0.00 0.00 0.00 46.02 44.11 2hm9 n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hm9 h ALA 100 N -1.24 1.22 -0.75 4.61 0.00 -1.95 0.36 119.26 121.51 2hm9 h ALA 100 Ca 0.00 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 2hm9 h ALA 100 Cb 0.00 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 2hm9 h ALA 100 CO 0.00 0.60 0.28 0.37 0.00 0.00 0.00 179.25 180.50 2hm9 h GLN 101 N 1.08 1.13 -0.51 0.00 5.75 -1.98 -1.05 115.11 119.53 2hm9 h GLN 101 Ca 0.26 -0.22 -0.05 0.00 -0.15 0.00 0.00 58.65 58.49 2hm9 h GLN 101 Cb 0.10 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.45 2hm9 h GLN 101 CO -0.03 0.93 0.10 0.82 -2.65 0.00 0.00 178.83 178.00 2hm9 h ILE 102 N 1.09 1.25 -0.54 2.39 1.08 -1.54 -2.40 117.51 118.83 2hm9 h ILE 102 Ca 0.25 -0.89 -0.01 0.00 -0.39 0.00 0.00 64.86 63.81 2hm9 h ILE 102 Cb 0.24 0.85 -0.03 0.00 -3.07 0.00 0.00 36.82 34.81 2hm9 h ILE 102 CO -0.02 0.32 0.30 -0.26 -0.69 0.00 0.00 178.15 177.80 2hm9 h PHE 103 N 0.71 0.74 -0.73 1.37 0.04 0.12 -2.48 116.94 116.71 2hm9 h PHE 103 Ca 0.16 -0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.90 2hm9 h PHE 103 Cb 0.36 -0.24 -0.03 0.00 2.20 0.00 0.00 35.95 38.24 2hm9 h PHE 103 CO 0.03 0.54 0.43 1.15 -0.60 0.00 0.00 178.31 179.85 2hm9 h THR 104 N 0.72 1.21 -0.64 -1.55 2.02 -1.05 0.91 112.91 114.53 2hm9 h THR 104 Ca 0.19 -0.48 -0.05 0.00 0.77 0.00 0.00 66.41 66.83 2hm9 h THR 104 Cb 0.05 0.22 -0.03 0.00 -1.74 0.00 0.00 68.15 66.64 2hm9 h THR 104 CO -0.03 0.22 0.19 0.00 0.37 0.00 0.00 175.52 176.27 2hm9 h ALA 105 N 1.22 1.12 -0.34 6.16 0.00 -1.16 -3.20 119.26 123.06 2hm9 h ALA 105 Ca 0.26 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2hm9 h ALA 105 Cb -0.01 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.52 2hm9 h ALA 105 CO -0.05 0.60 0.00 1.19 0.00 0.00 0.00 179.25 180.99 2hm9 n PHE 106 N -4.27 0.46 -0.27 0.00 3.72 -0.96 -4.68 117.46 111.46 2hm9 n PHE 106 Ca 0.05 -0.49 -0.05 0.00 -0.05 0.00 0.00 57.45 56.91 2hm9 n PHE 106 Cb 0.22 -0.03 0.06 0.00 -0.94 0.00 0.00 39.48 38.79 2hm9 n PHE 106 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 2hm9 h LYS 107 N 2.05 1.03 -0.30 -1.08 3.11 0.86 -2.84 116.57 119.40 2hm9 h LYS 107 Ca 0.00 -0.13 -0.05 0.00 -2.81 0.00 0.00 60.65 57.66 2hm9 h LYS 107 Cb 0.73 -0.20 -0.02 0.00 -1.00 0.00 0.00 32.23 31.74 2hm9 h LYS 107 CO 0.00 0.78 -0.02 0.22 -2.81 0.00 0.00 179.45 177.62 2hm9 h ASP 108 N 1.02 0.43 -0.51 4.20 3.58 -1.83 -2.85 116.42 120.46 2hm9 h ASP 108 Ca 0.26 -0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.63 2hm9 h ASP 108 Cb 0.05 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 40.99 2hm9 h ASP 108 CO -0.04 0.52 0.00 0.47 -2.88 0.00 0.00 179.24 177.31 2hm9 n ASP 109 N -4.28 2.85 -4.68 2.28 9.92 -1.09 -4.91 116.55 116.64 2hm9 n ASP 109 Ca 0.01 -2.04 -0.38 0.00 -0.53 0.00 0.00 54.79 51.85 2hm9 n ASP 109 Cb 0.24 -0.36 -0.07 0.00 -0.64 0.00 0.00 41.12 40.29 2hm9 n ASP 109 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2hm9 s VAL 110 N -1.36 5.18 -0.13 2.53 1.01 -1.08 -4.62 120.40 121.93 2hm9 s VAL 110 Ca 0.35 0.81 0.18 0.00 0.00 0.00 0.00 61.98 63.32 2hm9 s VAL 110 Cb 0.19 -3.77 -0.17 0.00 0.00 0.00 0.00 36.38 32.63 2hm9 s VAL 110 CO 0.23 0.26 0.68 -0.90 0.00 0.00 0.00 175.10 175.37 2hm9 n ASP 111 N 4.30 0.61 -4.16 3.32 5.68 -1.18 -4.68 116.55 120.44 2hm9 n ASP 111 Ca -0.07 0.26 -0.31 0.00 -0.50 0.00 0.00 54.79 54.17 2hm9 n ASP 111 Cb 0.51 0.58 -0.17 0.00 -1.14 0.00 0.00 41.12 40.91 2hm9 n ASP 111 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 2hm9 s THR 112 N -2.99 1.91 -0.13 2.12 2.01 -1.18 -1.20 115.64 116.17 2hm9 s THR 112 Ca -0.04 -0.91 0.01 0.00 0.31 0.00 0.00 61.69 61.06 2hm9 s THR 112 Cb 0.09 -1.68 -0.00 0.00 0.01 0.00 0.00 72.50 70.92 2hm9 s THR 112 CO 0.83 0.52 -0.17 -0.76 -0.69 0.00 0.00 174.62 174.35 2hm9 s LEU 113 N 0.64 2.42 -0.18 4.42 1.43 0.17 -0.37 118.68 127.21 2hm9 s LEU 113 Ca -0.12 -0.46 -0.00 0.00 -1.03 0.00 0.00 54.13 52.52 2hm9 s LEU 113 Cb -0.16 -1.53 0.01 0.00 0.03 0.00 0.00 46.19 44.54 2hm9 s LEU 113 CO 0.03 0.12 -0.16 -0.76 0.23 0.00 0.00 176.35 175.81 2hm9 s LEU 114 N 0.57 2.35 -0.04 1.79 1.43 0.31 0.28 118.68 125.37 2hm9 s LEU 114 Ca -0.10 -0.56 0.03 0.00 -1.03 0.00 0.00 54.13 52.47 2hm9 s LEU 114 Cb -0.16 -1.55 0.00 0.00 0.03 0.00 0.00 46.19 44.51 2hm9 s LEU 114 CO 0.04 0.02 -0.14 0.54 0.23 0.00 0.00 176.35 177.03 2hm9 s VAL 115 N 1.22 1.23 -0.17 -1.59 0.11 -0.45 -2.67 120.40 118.07 2hm9 s VAL 115 Ca 0.03 -0.59 -0.03 0.00 -2.93 0.00 0.00 61.98 58.45 2hm9 s VAL 115 Cb -0.14 -1.08 -0.02 0.00 -1.53 0.00 0.00 36.38 33.61 2hm9 s VAL 115 CO -0.08 0.36 -0.04 -0.89 -3.33 0.00 0.00 175.10 171.12 2hm9 s THR 116 N 0.21 3.67 -0.09 5.04 2.01 -0.98 -1.64 115.64 123.85 2hm9 s THR 116 Ca -0.06 -0.42 0.02 0.00 0.31 0.00 0.00 61.69 61.53 2hm9 s THR 116 Cb -0.12 -2.62 -0.02 0.00 0.01 0.00 0.00 72.50 69.75 2hm9 s THR 116 CO 0.02 0.47 -0.14 -0.60 -0.69 0.00 0.00 174.62 173.68 2hm9 s ARG 117 N 0.74 2.98 -0.15 4.92 3.52 -0.79 -0.21 118.95 129.95 2hm9 s ARG 117 Ca -0.02 -0.70 -0.03 0.00 -0.13 0.00 0.00 55.73 54.85 2hm9 s ARG 117 Cb -0.15 -2.51 -0.03 0.00 -1.56 0.00 0.00 34.95 30.71 2hm9 s ARG 117 CO 0.02 0.39 -0.04 -0.51 -0.81 0.00 0.00 175.30 174.35 2hm9 s LEU 118 N -0.13 3.21 0.27 -0.88 1.02 -1.10 -1.58 118.68 119.49 2hm9 s LEU 118 Ca -0.01 -0.14 -0.03 0.00 0.02 0.00 0.00 54.13 53.97 2hm9 s LEU 118 Cb -0.14 -1.77 0.36 0.00 0.02 0.00 0.00 46.19 44.66 2hm9 s LEU 118 CO 0.03 0.17 1.84 0.00 0.02 0.00 0.00 176.35 178.41 2hm9 h ALA 119 N 6.69 1.21 -2.73 4.21 0.00 -1.68 -2.93 119.26 124.04 2hm9 h ALA 119 Ca -0.31 -0.18 -0.50 0.00 0.00 0.00 0.00 54.91 53.92 2hm9 h ALA 119 Cb 1.19 -0.26 0.04 0.00 0.00 0.00 0.00 17.79 18.77 2hm9 h ALA 119 CO 0.62 0.57 0.50 0.20 0.00 0.00 0.00 179.25 181.14 2hm9 s GLY 120 N -3.52 2.91 0.39 0.00 0.00 -1.23 -4.76 107.32 101.11 2hm9 s GLY 120 Ca -0.11 0.94 -0.24 0.00 0.00 0.00 0.00 44.72 45.31 2hm9 s GLY 120 CO 0.81 1.48 1.03 -0.56 0.00 0.00 0.00 173.10 175.86 2hm9 s SER 121 N -1.07 6.83 0.07 1.64 0.01 -1.26 -4.37 113.70 115.55 2hm9 s SER 121 Ca 0.53 2.00 0.03 0.00 1.31 0.00 0.00 55.95 59.83 2hm9 s SER 121 Cb -0.31 -2.58 -0.03 0.00 0.21 0.00 0.00 66.02 63.31 2hm9 s SER 121 CO 0.39 -0.44 -0.10 -0.36 0.41 0.00 0.00 173.24 173.14 2hm9 s PHE 122 N -1.67 0.95 -0.03 2.43 0.40 -1.26 -5.06 117.98 113.73 2hm9 s PHE 122 Ca 0.57 -0.59 0.07 0.00 -0.60 0.00 0.00 56.93 56.38 2hm9 s PHE 122 Cb -0.21 -0.53 -0.02 0.00 0.51 0.00 0.00 43.02 42.76 2hm9 s PHE 122 CO 0.27 -0.03 -0.24 -2.00 0.70 0.00 0.00 175.22 173.91 2hm9 s GLU 123 N -2.29 2.22 0.13 0.44 2.12 -1.26 -4.89 118.70 115.17 2hm9 s GLU 123 Ca -0.00 -0.90 -0.25 0.00 0.36 0.00 0.00 54.97 54.18 2hm9 s GLU 123 Cb -0.06 -2.10 0.07 0.00 0.26 0.00 0.00 34.13 32.30 2hm9 s GLU 123 CO 0.00 0.54 0.88 0.20 -0.54 0.00 0.00 175.26 176.35 2hm9 s GLY 124 N -0.56 -0.31 0.00 -1.50 0.00 -1.26 -4.81 107.32 98.88 2hm9 s GLY 124 Ca 0.08 0.33 0.27 0.00 0.00 0.00 0.00 44.72 45.41 2hm9 s GLY 124 CO -0.00 0.09 1.67 2.09 0.00 0.00 0.00 173.10 176.95 2hm9 n ASP 125 N -0.40 1.17 -4.20 1.64 5.75 -1.19 -4.83 116.55 114.49 2hm9 n ASP 125 Ca -0.07 -1.13 -0.32 0.00 -0.01 0.00 0.00 54.79 53.26 2hm9 n ASP 125 Cb 0.61 0.06 -0.17 0.00 -1.03 0.00 0.00 41.12 40.59 2hm9 n ASP 125 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2hm9 s THR 126 N -2.28 2.01 0.08 2.12 2.01 -1.09 -4.94 115.64 113.57 2hm9 s THR 126 Ca 0.31 -0.99 0.08 0.00 0.31 0.00 0.00 61.69 61.41 2hm9 s THR 126 Cb 0.20 -1.75 -0.04 0.00 0.01 0.00 0.00 72.50 70.93 2hm9 s THR 126 CO 0.44 0.55 -0.20 -0.54 -0.69 0.00 0.00 174.62 174.18 2hm9 s LYS 127 N 0.43 1.86 0.40 4.92 1.02 -1.26 -2.77 119.74 124.33 2hm9 s LYS 127 Ca -0.17 -1.11 -0.25 0.00 0.02 0.00 0.00 55.97 54.45 2hm9 s LYS 127 Cb -0.18 -2.11 -0.08 0.00 -0.52 0.00 0.00 37.83 34.94 2hm9 s LYS 127 CO 0.07 0.50 1.18 1.41 -0.92 0.00 0.00 175.35 177.60 2hm9 s MET 128 N -1.80 4.04 0.62 1.68 -2.45 -1.16 -4.78 119.30 115.45 2hm9 s MET 128 Ca 0.16 1.87 -0.18 0.00 -1.25 0.00 0.00 55.69 56.29 2hm9 s MET 128 Cb -0.10 -2.69 -0.02 0.00 1.25 0.00 0.00 34.83 33.27 2hm9 s MET 128 CO 0.07 -0.34 1.19 0.96 1.05 0.00 0.00 175.02 177.95 2hm9 s ILE 129 N -1.39 2.72 0.45 10.11 -5.25 -1.26 -4.96 121.20 121.61 2hm9 s ILE 129 Ca 0.57 0.42 -0.25 0.00 -0.99 0.00 0.00 60.65 60.39 2hm9 s ILE 129 Cb -0.32 -3.10 -0.08 0.00 2.95 0.00 0.00 42.46 41.91 2hm9 s ILE 129 CO 0.40 -0.13 1.42 -2.16 -1.79 0.00 0.00 174.94 172.69 2hm9 s PRO 130 N -3.51 3.69 0.06 0.37 0.04 -1.26 -5.03 135.00 129.36 2hm9 s PRO 130 Ca 0.75 2.41 0.06 0.00 0.04 0.00 0.00 61.00 64.26 2hm9 s PRO 130 Cb -0.28 -2.66 -0.03 0.00 0.04 0.00 0.00 34.50 31.57 2hm9 s PRO 130 CO 0.35 -0.81 -0.16 -0.51 0.04 0.00 0.00 177.00 175.91 2hm9 s LEU 131 N -2.71 2.22 -0.88 -3.56 1.43 -1.26 -5.08 118.68 108.84 2hm9 s LEU 131 Ca 0.61 -0.55 -0.18 0.00 -1.03 0.00 0.00 54.13 52.98 2hm9 s LEU 131 Cb -0.44 -0.68 0.15 0.00 0.03 0.00 0.00 46.19 45.26 2hm9 s LEU 131 CO 0.56 0.03 1.00 0.20 0.23 0.00 0.00 176.35 178.37 2hm9 s ASN 132 N -1.44 6.63 0.29 2.29 -0.87 -1.26 -4.86 114.94 115.72 2hm9 s ASN 132 Ca 0.02 -2.16 -0.02 0.00 -1.57 0.00 0.00 52.86 49.13 2hm9 s ASN 132 Cb -0.09 -2.34 0.42 0.00 -0.02 0.00 0.00 41.25 39.22 2hm9 s ASN 132 CO 0.02 -0.94 1.91 -0.50 -2.57 0.00 0.00 177.10 175.02 2hm9 h TRP 133 N 8.59 0.97 -0.35 2.20 4.06 -1.98 -2.46 115.95 126.97 2hm9 h TRP 133 Ca 0.11 -0.02 -0.05 0.00 2.06 0.00 0.00 58.89 60.98 2hm9 h TRP 133 Cb 1.03 -0.31 -0.02 0.00 -1.00 0.00 0.00 29.16 28.86 2hm9 h TRP 133 CO 1.11 0.69 -0.01 0.38 -3.56 0.00 0.00 178.44 177.04 2hm9 h ASP 134 N 0.99 0.53 -0.25 -3.49 2.03 -2.05 -2.70 116.42 111.49 2hm9 h ASP 134 Ca 0.25 -0.10 -0.06 0.00 -0.73 0.00 0.00 57.03 56.39 2hm9 h ASP 134 Cb 0.04 -0.14 -0.02 0.00 -0.83 0.00 0.00 39.33 38.39 2hm9 h ASP 134 CO -0.04 0.60 -0.02 -0.78 -1.03 0.00 0.00 179.24 177.97 2hm9 h ASP 135 N 0.53 0.54 -3.56 4.15 3.58 -1.85 -3.43 116.42 116.38 2hm9 h ASP 135 Ca 0.11 -0.11 -0.68 0.00 0.42 0.00 0.00 57.03 56.77 2hm9 h ASP 135 Cb 0.36 -0.14 -0.17 0.00 1.72 0.00 0.00 39.33 41.09 2hm9 h ASP 135 CO 0.01 0.63 -0.68 -0.36 -2.88 0.00 0.00 179.24 175.96 2hm9 s PHE 136 N -4.94 2.97 -0.15 0.28 0.40 -1.02 -3.91 117.98 111.62 2hm9 s PHE 136 Ca -0.08 0.04 -0.02 0.00 -0.60 0.00 0.00 56.93 56.27 2hm9 s PHE 136 Cb 0.15 -1.69 -0.02 0.00 0.51 0.00 0.00 43.02 41.97 2hm9 s PHE 136 CO 0.78 0.38 -0.08 0.99 0.70 0.00 0.00 175.22 177.99 2hm9 s THR 137 N -0.90 3.48 0.17 0.64 2.01 -1.11 -4.83 115.64 115.11 2hm9 s THR 137 Ca 0.15 -0.50 -0.32 0.00 0.31 0.00 0.00 61.69 61.33 2hm9 s THR 137 Cb -0.11 -2.51 -0.10 0.00 0.01 0.00 0.00 72.50 69.79 2hm9 s THR 137 CO 0.04 0.50 1.58 -0.75 -0.69 0.00 0.00 174.62 175.30 2hm9 s LYS 138 N 0.48 4.20 -0.17 4.92 2.20 -1.26 -2.03 119.74 128.09 2hm9 s LYS 138 Ca -0.06 2.39 -0.12 0.00 -0.36 0.00 0.00 55.97 57.82 2hm9 s LYS 138 Cb -0.15 -3.14 -0.22 0.00 -1.51 0.00 0.00 37.83 32.81 2hm9 s LYS 138 CO 0.03 -0.62 0.24 1.33 -0.36 0.00 0.00 175.35 175.98 2hm9 n VAL 139 N 3.90 1.66 -3.63 4.02 0.24 0.03 -4.91 118.33 119.65 2hm9 n VAL 139 Ca 0.14 -0.40 -0.10 0.00 -2.04 0.00 0.00 64.34 61.94 2hm9 n VAL 139 Cb 0.38 -1.85 -0.02 0.00 -1.47 0.00 0.00 33.84 30.88 2hm9 n VAL 139 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 2hm9 s SER 140 N -6.97 -0.41 0.16 -1.34 0.01 -1.19 -5.05 113.70 98.90 2hm9 s SER 140 Ca -0.26 -0.30 -0.20 0.00 1.31 0.00 0.00 55.95 56.50 2hm9 s SER 140 Cb 0.07 0.65 0.05 0.00 0.21 0.00 0.00 66.02 67.00 2hm9 s SER 140 CO 0.68 -1.14 0.53 -0.94 0.41 0.00 0.00 173.24 172.78 2hm9 s SER 141 N -2.83 -0.40 0.00 2.44 1.04 -1.26 -0.76 113.70 111.94 2hm9 s SER 141 Ca 0.06 -0.21 0.02 0.00 0.48 0.00 0.00 55.95 56.30 2hm9 s SER 141 Cb -0.03 0.56 -0.01 0.00 0.10 0.00 0.00 66.02 66.64 2hm9 s SER 141 CO -0.04 -0.96 -0.07 -0.60 0.98 0.00 0.00 173.24 172.55 2hm9 s ARG 142 N -3.79 0.56 -0.15 4.02 3.52 0.29 -4.97 118.95 118.42 2hm9 s ARG 142 Ca 0.03 -0.32 -0.00 0.00 -0.13 0.00 0.00 55.73 55.31 2hm9 s ARG 142 Cb -0.00 -0.52 -0.01 0.00 -1.56 0.00 0.00 34.95 32.86 2hm9 s ARG 142 CO -0.10 0.14 -0.14 0.99 -0.81 0.00 0.00 175.30 175.38 2hm9 s THR 143 N -0.32 2.82 -0.07 4.11 2.01 -1.26 0.80 115.64 123.73 2hm9 s THR 143 Ca 0.01 -0.72 0.04 0.00 0.31 0.00 0.00 61.69 61.33 2hm9 s THR 143 Cb -0.04 -2.20 0.00 0.00 0.01 0.00 0.00 72.50 70.28 2hm9 s THR 143 CO -0.00 0.51 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.56 2hm9 s VAL 144 N 0.76 1.65 -0.20 3.82 1.01 -0.89 -5.02 120.40 121.52 2hm9 s VAL 144 Ca -0.06 -0.79 -0.04 0.00 0.00 0.00 0.00 61.98 61.09 2hm9 s VAL 144 Cb -0.15 -1.43 -0.01 0.00 0.00 0.00 0.00 36.38 34.78 2hm9 s VAL 144 CO 0.01 0.47 -0.04 -1.61 0.00 0.00 0.00 175.10 173.93 2hm9 s GLU 145 N 0.34 3.45 0.81 2.72 2.02 -1.26 -2.34 118.70 124.43 2hm9 s GLU 145 Ca -0.13 -0.60 -0.07 0.00 0.02 0.00 0.00 54.97 54.19 2hm9 s GLU 145 Cb -0.16 -2.98 0.15 0.00 0.10 0.00 0.00 34.13 31.24 2hm9 s GLU 145 CO 0.06 -0.08 1.11 0.34 0.02 0.00 0.00 175.26 176.70 2hm9 s ASP 146 N 1.20 3.93 0.14 -0.19 -1.08 -1.26 -4.96 116.67 114.44 2hm9 s ASP 146 Ca 0.02 -0.10 -0.17 0.00 -0.52 0.00 0.00 52.55 51.79 2hm9 s ASP 146 Cb -0.14 -0.18 -0.01 0.00 -1.46 0.00 0.00 42.92 41.12 2hm9 s ASP 146 CO -0.01 -2.16 1.75 0.71 0.52 0.00 0.00 175.17 175.98 2hm9 h THR 147 N -0.93 1.13 -2.85 1.71 1.35 -1.99 -3.42 112.91 107.90 2hm9 h THR 147 Ca -0.40 -0.32 -0.64 0.00 -0.55 0.00 0.00 66.41 64.50 2hm9 h THR 147 Cb 1.26 0.71 -0.06 0.00 -1.73 0.00 0.00 68.15 68.33 2hm9 h THR 147 CO 0.40 0.13 -0.33 0.20 -0.25 0.00 0.00 175.52 175.67 2hm9 s ASN 148 N -5.62 6.61 0.33 5.36 -0.87 -1.26 -5.00 114.94 114.49 2hm9 s ASN 148 Ca -0.13 0.72 0.04 0.00 -1.57 0.00 0.00 52.86 51.92 2hm9 s ASN 148 Cb 0.10 -2.17 0.64 0.00 -0.02 0.00 0.00 41.25 39.80 2hm9 s ASN 148 CO 0.72 0.36 1.91 1.55 -2.57 0.00 0.00 177.10 179.07 2hm9 h PRO 149 N 4.90 0.87 -0.58 -0.60 0.13 -1.95 -0.87 132.00 133.90 2hm9 h PRO 149 Ca -0.53 -0.05 -0.07 0.00 -0.87 0.00 0.00 66.00 64.48 2hm9 h PRO 149 Cb 1.22 -0.20 -0.02 0.00 0.13 0.00 0.00 31.00 32.13 2hm9 h PRO 149 CO 0.60 0.57 0.08 0.00 -0.23 0.00 0.00 178.00 179.03 2hm9 h ALA 150 N 1.55 1.05 -0.22 -0.56 0.00 -1.93 -2.76 119.26 116.39 2hm9 h ALA 150 Ca 0.39 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 2hm9 h ALA 150 Cb 0.34 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2hm9 h ALA 150 CO -0.16 0.61 -0.27 -0.07 0.00 0.00 0.00 179.25 179.37 2hm9 h LEU 151 N 0.89 0.43 -9.83 0.00 3.38 -1.58 -3.25 115.31 105.34 2hm9 h LEU 151 Ca 0.18 -0.14 -0.53 0.00 0.09 0.00 0.00 57.88 57.47 2hm9 h LEU 151 Cb 0.40 -0.12 0.09 0.00 0.09 0.00 0.00 40.66 41.13 2hm9 h LEU 151 CO 0.01 0.69 0.86 -0.89 0.09 0.00 0.00 178.44 179.20 2hm9 s THR 152 N -4.46 2.07 0.09 0.22 2.01 -0.62 -4.65 115.64 110.30 2hm9 s THR 152 Ca -0.06 0.06 -0.04 0.00 0.31 0.00 0.00 61.69 61.95 2hm9 s THR 152 Cb 0.14 -3.04 -0.02 0.00 0.01 0.00 0.00 72.50 69.59 2hm9 s THR 152 CO 0.78 0.01 0.10 -1.38 -0.69 0.00 0.00 174.62 173.44 2hm9 s HIS 153 N -0.25 0.46 0.07 4.92 -3.43 -0.99 -2.78 115.29 113.31 2hm9 s HIS 153 Ca 0.61 -0.92 0.05 0.00 -0.80 0.00 0.00 55.06 54.01 2hm9 s HIS 153 Cb -0.47 -0.26 -0.03 0.00 -1.43 0.00 0.00 32.58 30.38 2hm9 s HIS 153 CO 0.51 -0.51 -0.14 0.99 -2.00 0.00 0.00 174.74 173.59 2hm9 s THR 154 N -3.94 1.13 -0.20 -5.38 2.01 -0.62 -2.09 115.64 106.56 2hm9 s THR 154 Ca 0.11 -1.31 -0.05 0.00 0.31 0.00 0.00 61.69 60.75 2hm9 s THR 154 Cb 0.06 -1.08 -0.02 0.00 0.01 0.00 0.00 72.50 71.47 2hm9 s THR 154 CO -0.06 -0.22 -0.01 -0.31 -0.69 0.00 0.00 174.62 173.33 2hm9 s TYR 155 N -1.27 3.02 -0.04 4.92 2.02 0.24 -1.89 117.35 124.35 2hm9 s TYR 155 Ca -0.02 -0.50 0.05 0.00 -0.37 0.00 0.00 57.07 56.23 2hm9 s TYR 155 Cb -0.10 -2.07 -0.01 0.00 -0.40 0.00 0.00 41.96 39.38 2hm9 s TYR 155 CO 0.02 -0.26 -0.18 -1.21 -1.57 0.00 0.00 175.55 172.35 2hm9 s GLU 156 N 0.99 1.85 -0.12 -0.62 2.02 -0.65 0.11 118.70 122.27 2hm9 s GLU 156 Ca 0.01 -0.65 0.03 0.00 0.02 0.00 0.00 54.97 54.38 2hm9 s GLU 156 Cb -0.14 -1.62 0.00 0.00 0.10 0.00 0.00 34.13 32.47 2hm9 s GLU 156 CO 0.01 0.28 -0.22 0.08 0.02 0.00 0.00 175.26 175.43 2hm9 s VAL 157 N -0.04 2.17 -0.04 2.63 1.01 0.06 -1.34 120.40 124.85 2hm9 s VAL 157 Ca -0.03 -0.96 0.03 0.00 0.00 0.00 0.00 61.98 61.02 2hm9 s VAL 157 Cb -0.11 -1.85 -0.03 0.00 0.00 0.00 0.00 36.38 34.39 2hm9 s VAL 157 CO 0.02 0.55 -0.13 0.26 0.00 0.00 0.00 175.10 175.80 2hm9 s TRP 158 N 0.56 2.75 -0.11 5.22 0.52 0.14 -0.79 118.94 127.24 2hm9 s TRP 158 Ca -0.13 -0.12 0.03 0.00 0.02 0.00 0.00 56.10 55.90 2hm9 s TRP 158 Cb -0.17 -1.63 -0.00 0.00 -1.15 0.00 0.00 33.47 30.52 2hm9 s TRP 158 CO 0.04 0.23 -0.21 -0.65 0.02 0.00 0.00 176.95 176.38 2hm9 s GLN 159 N -0.85 3.11 0.26 4.98 -0.21 -0.86 0.41 119.66 126.51 2hm9 s GLN 159 Ca 0.12 -0.83 -0.30 0.00 0.02 0.00 0.00 55.36 54.38 2hm9 s GLN 159 Cb -0.11 -2.38 -0.10 0.00 1.00 0.00 0.00 33.01 31.42 2hm9 s GLN 159 CO 0.02 0.20 1.41 0.21 -2.12 0.00 0.00 175.29 175.01 2hm9 s LYS 160 N 0.31 4.29 -0.01 2.91 2.36 -0.34 -2.76 119.74 126.50 2hm9 s LYS 160 Ca -0.16 2.27 0.07 0.00 -2.55 0.00 0.00 55.97 55.60 2hm9 s LYS 160 Cb -0.17 -3.11 -0.02 0.00 -1.05 0.00 0.00 37.83 33.48 2hm9 s LYS 160 CO 0.08 -0.38 -0.22 -1.59 1.55 0.00 0.00 175.35 174.79 2hm9 s LYS 161 N -0.54 1.76 0.00 4.03 -2.85 -1.25 -4.97 119.74 115.92 2hm9 s LYS 161 Ca 0.58 -0.82 0.00 0.00 -1.00 0.00 0.00 55.97 54.72 2hm9 s LYS 161 Cb -0.41 -1.73 0.00 0.00 -2.06 0.00 0.00 37.83 33.63 2hm9 s LYS 161 CO 0.44 0.47 0.00 0.00 0.10 0.00 0.00 175.35 176.36