#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 0.32 -0.23 2.41 0.00 0.26 -2.72 121.76 121.80 2hm9 s ALA 2 Ca 0.00 -0.52 -0.04 0.00 0.00 0.00 0.00 51.96 51.39 2hm9 s ALA 2 Cb 0.00 0.05 -0.01 0.00 0.00 0.00 0.00 23.12 23.17 2hm9 s ALA 2 CO 0.00 -0.05 -0.02 -0.06 0.00 0.00 0.00 175.76 175.63 2hm9 s PHE 3 N -1.04 2.99 -0.20 0.00 0.40 0.31 -0.76 117.98 119.68 2hm9 s PHE 3 Ca -0.09 -0.93 0.02 0.00 -0.60 0.00 0.00 56.93 55.33 2hm9 s PHE 3 Cb -0.08 -2.13 0.03 0.00 0.51 0.00 0.00 43.02 41.36 2hm9 s PHE 3 CO -0.00 -0.54 -0.17 -1.17 0.70 0.00 0.00 175.22 174.03 2hm9 s LEU 4 N 1.48 2.50 0.14 -0.37 2.96 -1.05 0.15 118.68 124.49 2hm9 s LEU 4 Ca 0.05 -0.86 -0.17 0.00 -0.22 0.00 0.00 54.13 52.93 2hm9 s LEU 4 Cb -0.15 -1.50 0.04 0.00 0.50 0.00 0.00 46.19 45.08 2hm9 s LEU 4 CO -0.02 -0.05 0.45 -1.66 -1.32 0.00 0.00 176.35 173.74 2hm9 s TRP 5 N 1.24 -0.23 -0.02 5.38 -2.14 -0.90 -4.38 118.94 117.88 2hm9 s TRP 5 Ca 0.01 -0.07 0.06 0.00 2.66 0.00 0.00 56.10 58.76 2hm9 s TRP 5 Cb -0.15 0.32 -0.01 0.00 -3.10 0.00 0.00 33.47 30.53 2hm9 s TRP 5 CO -0.11 -0.76 -0.19 0.00 -2.66 0.00 0.00 176.95 173.23 2hm9 s ALA 6 N -3.81 1.63 0.04 2.67 0.00 -1.26 -2.53 121.76 118.50 2hm9 s ALA 6 Ca 0.04 -0.83 -0.05 0.00 0.00 0.00 0.00 51.96 51.11 2hm9 s ALA 6 Cb 0.01 -0.43 -0.01 0.00 0.00 0.00 0.00 23.12 22.68 2hm9 s ALA 6 CO -0.11 0.39 0.09 1.14 0.00 0.00 0.00 175.76 177.27 2hm9 s GLN 7 N -0.39 0.62 0.84 0.00 -2.07 0.92 -4.64 119.66 114.93 2hm9 s GLN 7 Ca 0.06 -0.81 -0.09 0.00 -1.82 0.00 0.00 55.36 52.70 2hm9 s GLN 7 Cb -0.08 0.24 0.16 0.00 -1.09 0.00 0.00 33.01 32.24 2hm9 s GLN 7 CO -0.00 -0.16 1.16 0.16 -1.32 0.00 0.00 175.29 175.13 2hm9 s ASP 8 N -2.26 3.74 0.20 12.60 -4.77 -1.10 -2.62 116.67 122.46 2hm9 s ASP 8 Ca -0.03 -0.03 -0.11 0.00 -3.30 0.00 0.00 52.55 49.09 2hm9 s ASP 8 Cb 0.00 -0.19 0.14 0.00 -1.09 0.00 0.00 42.92 41.78 2hm9 s ASP 8 CO -0.06 -2.30 1.85 0.08 0.70 0.00 0.00 175.17 175.45 2hm9 h ARG 9 N -1.09 0.98 -0.74 2.11 0.11 -1.56 -2.70 114.38 111.48 2hm9 h ARG 9 Ca -0.41 -0.08 0.01 0.00 0.10 0.00 0.00 59.98 59.60 2hm9 h ARG 9 Cb 1.25 -0.21 -0.04 0.00 1.11 0.00 0.00 29.97 32.09 2hm9 h ARG 9 CO 0.40 0.68 0.49 -0.44 0.10 0.00 0.00 179.97 181.20 2hm9 h ASP 10 N 0.99 0.85 0.00 0.08 3.32 -1.88 -3.47 116.42 116.30 2hm9 h ASP 10 Ca 0.26 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.29 2hm9 h ASP 10 Cb -0.05 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.29 2hm9 h ASP 10 CO -0.05 0.61 0.00 0.61 -1.72 0.00 0.00 179.24 178.69 2hm9 n GLY 11 N -1.30 1.43 3.87 2.75 0.00 -1.02 -5.12 105.19 105.80 2hm9 n GLY 11 Ca 0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 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 4.40 -0.06 0.99 2.96 -1.26 -2.76 118.68 122.95 2hm9 s LEU 12 Ca 0.00 0.60 0.05 0.00 -0.22 0.00 0.00 54.13 54.56 2hm9 s LEU 12 Cb 0.00 -2.39 -0.25 0.00 0.50 0.00 0.00 46.19 44.06 2hm9 s LEU 12 CO 0.00 0.34 0.61 0.16 -1.32 0.00 0.00 176.35 176.14 2hm9 h ILE 13 N 3.59 0.84 0.00 6.68 3.07 -1.79 -2.92 117.51 126.98 2hm9 h ILE 13 Ca -0.53 -2.62 0.00 0.00 1.55 0.00 0.00 64.86 63.26 2hm9 h ILE 13 Cb 1.22 2.50 0.00 0.00 -0.27 0.00 0.00 36.82 40.27 2hm9 h ILE 13 CO 0.62 0.67 0.00 0.61 -1.05 0.00 0.00 178.15 179.00 2hm9 n GLY 14 N 1.70 -0.10 3.24 0.16 0.00 -1.08 -4.57 105.19 104.53 2hm9 n GLY 14 Ca -0.21 -1.00 -0.31 0.00 0.00 0.00 0.00 46.02 44.50 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 -2.00 2.63 -2.18 1.61 2.20 -1.19 -1.45 119.74 119.37 2hm9 s LYS 15 Ca 0.00 -0.87 0.00 0.00 -0.36 0.00 0.00 55.97 54.74 2hm9 s LYS 15 Cb 0.00 -2.14 0.00 0.00 -1.51 0.00 0.00 37.83 34.18 2hm9 s LYS 15 CO 0.00 0.30 0.00 -0.25 -0.36 0.00 0.00 175.35 175.04 2hm9 n ASP 16 N 3.16 -5.53 0.00 1.43 9.92 -1.26 -1.69 116.55 122.58 2hm9 n ASP 16 Ca -0.18 0.48 0.00 0.00 -0.53 0.00 0.00 54.79 54.55 2hm9 n ASP 16 Cb 0.52 -4.86 0.00 0.00 -0.64 0.00 0.00 41.12 36.15 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 -0.44 3.02 3.74 0.44 0.00 -1.26 -4.86 105.19 105.83 2hm9 n GLY 17 Ca -0.21 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.51 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 -1.81 1.56 -0.65 1.61 -3.43 -0.68 -4.81 115.29 107.08 2hm9 s HIS 18 Ca 0.00 0.62 -0.15 0.00 -0.80 0.00 0.00 55.06 54.73 2hm9 s HIS 18 Cb 0.00 -3.56 0.16 0.00 -1.43 0.00 0.00 32.58 27.75 2hm9 s HIS 18 CO 0.00 -3.01 0.60 -0.51 -2.00 0.00 0.00 174.74 169.82 2hm9 s LEU 19 N -6.36 6.41 0.54 5.38 1.43 -1.26 -3.16 118.68 121.65 2hm9 s LEU 19 Ca 0.69 -2.14 0.27 0.00 -1.03 0.00 0.00 54.13 51.92 2hm9 s LEU 19 Cb -0.11 -2.21 1.55 0.00 0.03 0.00 0.00 46.19 45.45 2hm9 s LEU 19 CO 0.55 -0.75 2.13 1.55 0.23 0.00 0.00 176.35 180.06 2hm9 h PRO 20 N 8.46 0.00 -6.66 1.29 0.13 -1.89 -3.42 132.00 129.91 2hm9 h PRO 20 Ca -0.14 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.48 2hm9 h PRO 20 Cb 1.08 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.19 2hm9 h PRO 20 CO 0.93 0.08 0.34 1.67 -0.23 0.00 0.00 178.00 180.79 2hm9 s TRP 21 N -4.40 3.91 -0.98 1.56 -2.14 -1.26 -5.00 118.94 110.63 2hm9 s TRP 21 Ca -0.04 1.85 -0.14 0.00 2.66 0.00 0.00 56.10 60.44 2hm9 s TRP 21 Cb 0.14 -3.00 0.21 0.00 -3.10 0.00 0.00 33.47 27.72 2hm9 s TRP 21 CO 0.58 0.36 1.03 -1.58 -2.66 0.00 0.00 176.95 174.69 2hm9 s HIS 22 N -0.70 3.74 -0.61 1.66 2.46 -1.26 -4.92 115.29 115.67 2hm9 s HIS 22 Ca 0.43 -2.09 0.05 0.00 0.47 0.00 0.00 55.06 53.92 2hm9 s HIS 22 Cb -0.25 -3.99 0.19 0.00 -0.13 0.00 0.00 32.58 28.40 2hm9 s HIS 22 CO 0.31 -1.14 0.51 -0.11 -2.47 0.00 0.00 174.74 171.84 2hm9 n LEU 23 N 4.37 2.18 -0.32 8.88 7.94 -1.26 -4.96 117.00 133.82 2hm9 n LEU 23 Ca 0.22 -5.03 0.23 0.00 -1.11 0.00 0.00 56.01 50.32 2hm9 n LEU 23 Cb 0.45 -0.36 0.45 0.00 0.53 0.00 0.00 43.42 44.48 2hm9 n LEU 23 CO 0.45 1.85 1.03 -0.65 -1.11 0.00 0.00 177.39 178.96 2hm9 h PRO 24 N 5.14 0.18 -0.20 1.96 0.11 -1.98 -0.95 132.00 136.25 2hm9 h PRO 24 Ca 0.18 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 66.31 2hm9 h PRO 24 Cb 0.78 -0.04 -0.07 0.00 0.11 0.00 0.00 31.00 31.78 2hm9 h PRO 24 CO 0.64 0.12 -0.55 0.22 -0.21 0.00 0.00 178.00 178.22 2hm9 h ASP 25 N 0.18 -1.76 -0.35 -2.05 1.82 -1.97 0.63 116.42 112.92 2hm9 h ASP 25 Ca 0.71 0.21 -0.05 0.00 -0.39 0.00 0.00 57.03 57.51 2hm9 h ASP 25 Cb 1.66 0.70 -0.02 0.00 0.68 0.00 0.00 39.33 42.35 2hm9 h ASP 25 CO -0.69 -0.46 0.04 -0.78 -1.61 0.00 0.00 179.24 175.73 2hm9 h ASP 26 N -0.54 0.64 -0.63 2.28 1.82 -1.58 -2.27 116.42 116.13 2hm9 h ASP 26 Ca 0.04 -0.13 -0.03 0.00 -0.39 0.00 0.00 57.03 56.52 2hm9 h ASP 26 Cb 0.66 -0.17 -0.03 0.00 0.68 0.00 0.00 39.33 40.47 2hm9 h ASP 26 CO -0.48 0.68 0.26 -0.07 -1.61 0.00 0.00 179.24 178.02 2hm9 h LEU 27 N 0.65 0.86 -0.91 2.28 3.38 -0.54 -2.12 115.31 118.91 2hm9 h LEU 27 Ca 0.14 -0.17 0.03 0.00 0.09 0.00 0.00 57.88 57.97 2hm9 h LEU 27 Cb 0.34 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.82 2hm9 h LEU 27 CO 0.01 0.79 0.60 0.45 0.09 0.00 0.00 178.44 180.38 2hm9 h HIS 28 N 0.88 1.12 -0.39 1.13 3.86 0.66 -1.79 115.15 120.62 2hm9 h HIS 28 Ca 0.21 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.45 2hm9 h HIS 28 Cb 0.19 -0.37 -0.02 0.00 1.06 0.00 0.00 27.41 28.27 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 1.17 0.49 -0.35 2.45 3.20 -0.85 -0.25 116.97 122.84 2hm9 h TYR 29 Ca 0.36 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.24 2hm9 h TYR 29 Cb -0.02 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.06 2hm9 h TYR 29 CO -0.01 0.32 0.21 0.35 -1.64 0.00 0.00 178.16 177.38 2hm9 h PHE 30 N 0.52 0.46 -0.65 -3.82 3.57 -0.82 -2.13 116.94 114.08 2hm9 h PHE 30 Ca 0.14 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.62 2hm9 h PHE 30 Cb -0.05 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 38.51 2hm9 h PHE 30 CO -0.05 0.34 0.31 -0.09 -2.23 0.00 0.00 178.31 176.59 2hm9 h ARG 31 N 0.45 0.93 -0.66 1.11 1.12 -1.07 -2.71 114.38 113.55 2hm9 h ARG 31 Ca 0.12 -0.14 -0.06 0.00 -1.11 0.00 0.00 59.98 58.80 2hm9 h ARG 31 Cb 0.01 -0.17 -0.03 0.00 -0.01 0.00 0.00 29.97 29.78 2hm9 h ARG 31 CO -0.02 0.74 0.18 0.00 -3.11 0.00 0.00 179.97 177.76 2hm9 h ALA 32 N 1.14 1.07 -0.09 2.80 0.00 -0.86 -2.71 119.26 120.60 2hm9 h ALA 32 Ca 0.22 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 2hm9 h ALA 32 Cb 0.12 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2hm9 h ALA 32 CO -0.03 0.62 -0.27 1.96 0.00 0.00 0.00 179.25 181.53 2hm9 h GLN 33 N 0.99 0.16 -0.08 0.00 1.08 -1.22 -2.57 115.11 113.46 2hm9 h GLN 33 Ca 0.21 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.36 2hm9 h GLN 33 Cb 0.32 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.73 2hm9 h GLN 33 CO -0.00 0.42 0.00 0.25 -0.95 0.00 0.00 178.83 178.55 2hm9 n THR 34 N -4.16 0.11 -3.09 -0.54 -2.24 -1.03 -4.65 114.28 98.67 2hm9 n THR 34 Ca -0.01 -0.13 -0.41 0.00 -2.27 0.00 0.00 64.05 61.23 2hm9 n THR 34 Cb 0.36 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.53 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 -1.89 4.97 -0.51 2.28 -7.23 -0.97 -3.71 120.40 113.34 2hm9 s VAL 35 Ca 0.18 1.17 0.00 0.00 -1.81 0.00 0.00 61.98 61.52 2hm9 s VAL 35 Cb 0.09 -3.95 0.00 0.00 0.56 0.00 0.00 36.38 33.08 2hm9 s VAL 35 CO 0.14 0.02 0.00 0.61 -0.31 0.00 0.00 175.10 175.56 2hm9 n GLY 36 N 4.11 0.72 3.04 2.32 0.00 -1.26 -5.02 105.19 109.10 2hm9 n GLY 36 Ca -0.00 -0.83 -0.08 0.00 0.00 0.00 0.00 46.02 45.11 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 -2.54 0.48 -0.02 1.61 1.02 -1.24 -4.84 119.74 114.21 2hm9 s LYS 37 Ca 0.00 -0.94 -0.29 0.00 0.02 0.00 0.00 55.97 54.76 2hm9 s LYS 37 Cb 0.00 0.17 -0.03 0.00 -0.52 0.00 0.00 37.83 37.45 2hm9 s LYS 37 CO 0.00 -0.09 0.95 0.42 -0.92 0.00 0.00 175.35 175.71 2hm9 s ILE 38 N -2.82 4.88 0.05 2.17 -1.09 -0.06 -4.06 121.20 120.28 2hm9 s ILE 38 Ca -0.03 1.98 0.05 0.00 -2.23 0.00 0.00 60.65 60.42 2hm9 s ILE 38 Cb -0.00 -4.28 -0.02 0.00 -1.58 0.00 0.00 42.46 36.57 2hm9 s ILE 38 CO -0.06 0.16 -0.14 -0.32 -1.23 0.00 0.00 174.94 173.34 2hm9 s MET 39 N 1.09 0.90 -0.11 2.79 -2.45 -0.99 0.24 119.30 120.77 2hm9 s MET 39 Ca 0.50 -0.85 0.03 0.00 -1.25 0.00 0.00 55.69 54.12 2hm9 s MET 39 Cb -0.20 -0.92 -0.00 0.00 1.25 0.00 0.00 34.83 34.95 2hm9 s MET 39 CO 0.26 0.22 -0.21 0.08 1.05 0.00 0.00 175.02 176.42 2hm9 s VAL 40 N -1.02 2.33 -0.08 10.11 1.01 0.12 -1.00 120.40 131.87 2hm9 s VAL 40 Ca 0.00 -0.92 0.05 0.00 0.00 0.00 0.00 61.98 61.12 2hm9 s VAL 40 Cb -0.09 -1.92 -0.00 0.00 0.00 0.00 0.00 36.38 34.36 2hm9 s VAL 40 CO 0.02 0.55 -0.24 0.68 0.00 0.00 0.00 175.10 176.10 2hm9 s VAL 41 N 0.42 2.03 0.99 2.92 -7.23 0.19 -0.49 120.40 119.23 2hm9 s VAL 41 Ca -0.15 -1.02 -0.14 0.00 -1.81 0.00 0.00 61.98 58.86 2hm9 s VAL 41 Cb -0.17 -1.74 0.18 0.00 0.56 0.00 0.00 36.38 35.21 2hm9 s VAL 41 CO 0.07 0.56 1.14 -0.83 -0.31 0.00 0.00 175.10 175.72 2hm9 s GLY 42 N 0.18 1.59 0.19 2.32 0.00 0.33 0.34 107.32 112.27 2hm9 s GLY 42 Ca -0.14 -0.63 -0.12 0.00 0.00 0.00 0.00 44.72 43.83 2hm9 s GLY 42 CO 0.07 0.02 1.84 -0.09 0.00 0.00 0.00 173.10 174.94 2hm9 h ARG 43 N -1.81 0.88 -0.42 2.90 1.12 -1.76 -1.12 114.38 114.18 2hm9 h ARG 43 Ca -0.50 -0.07 0.02 0.00 -1.11 0.00 0.00 59.98 58.31 2hm9 h ARG 43 Cb 1.32 -0.19 -0.02 0.00 -0.01 0.00 0.00 29.97 31.07 2hm9 h ARG 43 CO 0.54 0.62 0.28 0.00 -3.11 0.00 0.00 179.97 178.29 2hm9 h ARG 44 N 0.89 0.50 -0.31 0.20 3.08 -1.92 -1.67 114.38 115.15 2hm9 h ARG 44 Ca 0.24 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.23 2hm9 h ARG 44 Cb -0.05 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 29.88 2hm9 h ARG 44 CO -0.05 0.33 0.11 1.15 -1.07 0.00 0.00 179.97 180.44 2hm9 h THR 45 N 0.52 1.19 -0.53 2.04 2.02 -1.56 -1.81 112.91 114.79 2hm9 h THR 45 Ca 0.16 -0.61 0.11 0.00 0.77 0.00 0.00 66.41 66.84 2hm9 h THR 45 Cb 0.01 1.01 -0.10 0.00 -1.74 0.00 0.00 68.15 67.34 2hm9 h THR 45 CO -0.04 0.21 -0.11 0.22 0.37 0.00 0.00 175.52 176.17 2hm9 h TYR 46 N 0.35 -0.25 0.00 3.16 3.20 -0.57 0.84 116.97 123.71 2hm9 h TYR 46 Ca 0.10 0.05 0.00 0.00 3.14 0.00 0.00 58.73 62.02 2hm9 h TYR 46 Cb 0.22 0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.68 2hm9 h TYR 46 CO 0.00 -0.21 0.00 0.93 -1.64 0.00 0.00 178.16 177.24 2hm9 h GLU 47 N 0.01 0.00 0.02 1.82 5.08 -1.49 -3.26 114.58 116.77 2hm9 h GLU 47 Ca 0.26 0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 58.32 2hm9 h GLU 47 Cb 0.39 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.60 2hm9 h GLU 47 CO -0.53 0.00 -1.66 0.77 -1.00 0.00 0.00 179.01 176.60 2hm9 h SER 48 N 0.00 0.08 -3.30 1.42 0.02 0.00 -3.48 113.55 108.30 2hm9 h SER 48 Ca 0.00 -0.16 -0.58 0.00 -0.84 0.00 0.00 61.79 60.21 2hm9 h SER 48 Cb 0.82 -0.03 0.16 0.00 0.14 0.00 0.00 62.40 63.50 2hm9 h SER 48 CO 0.00 1.14 -0.09 0.49 -1.14 0.00 0.00 176.83 177.24 2hm9 n PHE 49 N -3.16 0.22 0.06 3.45 3.01 0.27 -4.93 117.46 116.37 2hm9 n PHE 49 Ca -0.17 0.44 -0.20 0.00 1.01 0.00 0.00 57.45 58.53 2hm9 n PHE 49 Cb 1.04 -2.07 -0.15 0.00 -0.01 0.00 0.00 39.48 38.30 2hm9 n PHE 49 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 2hm9 h PRO 50 N 0.42 0.32 -2.48 -1.08 0.13 -1.90 -3.47 132.00 123.93 2hm9 h PRO 50 Ca -0.47 -0.55 -0.08 0.00 -0.87 0.00 0.00 66.00 64.03 2hm9 h PRO 50 Cb 1.38 0.20 -0.25 0.00 0.13 0.00 0.00 31.00 32.46 2hm9 h PRO 50 CO 0.49 1.26 -0.21 0.15 -0.23 0.00 0.00 178.00 179.47 2hm9 s LYS 51 N -2.44 0.48 0.02 0.86 1.02 -1.26 -5.17 119.74 113.25 2hm9 s LYS 51 Ca -0.13 0.89 -0.01 0.00 0.02 0.00 0.00 55.97 56.73 2hm9 s LYS 51 Cb 0.01 0.04 -0.02 0.00 -0.52 0.00 0.00 37.83 37.34 2hm9 s LYS 51 CO 0.84 -0.15 -0.00 1.03 -0.92 0.00 0.00 175.35 176.15 2hm9 s ARG 52 N 1.37 0.36 0.62 1.68 0.52 -1.26 -4.66 118.95 117.57 2hm9 s ARG 52 Ca -0.09 -0.61 0.02 0.00 -0.52 0.00 0.00 55.73 54.54 2hm9 s ARG 52 Cb -0.07 0.13 0.08 0.00 0.52 0.00 0.00 34.95 35.61 2hm9 s ARG 52 CO -0.13 -0.06 0.86 -1.25 0.02 0.00 0.00 175.30 174.73 2hm9 s PRO 53 N -1.58 2.13 0.30 3.54 0.04 -1.26 -4.92 135.00 133.24 2hm9 s PRO 53 Ca -0.15 -1.13 -0.11 0.00 0.04 0.00 0.00 61.00 59.66 2hm9 s PRO 53 Cb -0.09 -2.47 -0.07 0.00 0.04 0.00 0.00 34.50 31.91 2hm9 s PRO 53 CO -0.01 -1.04 0.65 -0.51 0.04 0.00 0.00 177.00 176.13 2hm9 s LEU 54 N -4.89 4.06 0.11 -3.56 1.43 -1.26 -5.06 118.68 109.51 2hm9 s LEU 54 Ca 0.62 1.06 -0.27 0.00 -1.03 0.00 0.00 54.13 54.51 2hm9 s LEU 54 Cb -0.07 -3.86 -0.07 0.00 0.03 0.00 0.00 46.19 42.22 2hm9 s LEU 54 CO 0.41 -0.19 0.83 -2.16 0.23 0.00 0.00 176.35 175.46 2hm9 s PRO 55 N -3.15 4.60 -1.57 1.29 0.04 -1.26 -3.88 135.00 131.06 2hm9 s PRO 55 Ca 0.50 1.22 -0.02 0.00 0.04 0.00 0.00 61.00 62.73 2hm9 s PRO 55 Cb -0.11 -3.33 0.00 0.00 0.04 0.00 0.00 34.50 31.11 2hm9 s PRO 55 CO 0.23 0.38 0.29 0.39 0.04 0.00 0.00 177.00 178.32 2hm9 n GLU 56 N 2.30 -3.09 -4.07 4.56 1.02 -1.26 -4.92 120.64 115.19 2hm9 n GLU 56 Ca -0.02 0.91 -0.08 0.00 -0.02 0.00 0.00 57.16 57.94 2hm9 n GLU 56 Cb 0.49 -5.58 -0.10 0.00 -0.02 0.00 0.00 31.44 26.23 2hm9 n GLU 56 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2hm9 s ARG 57 N -5.30 0.55 -0.38 3.49 0.52 -1.25 -4.02 118.95 112.55 2hm9 s ARG 57 Ca 0.14 -1.04 -0.06 0.00 -0.52 0.00 0.00 55.73 54.25 2hm9 s ARG 57 Cb -0.06 0.11 0.08 0.00 0.52 0.00 0.00 34.95 35.59 2hm9 s ARG 57 CO 0.18 -0.07 0.17 0.99 0.02 0.00 0.00 175.30 176.58 2hm9 s THR 58 N -3.08 3.68 -0.07 0.02 2.01 -1.26 -4.85 115.64 112.09 2hm9 s THR 58 Ca 0.00 -1.53 -0.03 0.00 0.31 0.00 0.00 61.69 60.44 2hm9 s THR 58 Cb 0.02 -3.27 -0.04 0.00 0.01 0.00 0.00 72.50 69.22 2hm9 s THR 58 CO -0.06 -0.43 0.06 0.20 -0.69 0.00 0.00 174.62 173.70 2hm9 s ASN 59 N 1.77 5.69 -0.06 3.53 -0.87 -1.26 -2.34 114.94 121.40 2hm9 s ASN 59 Ca 0.02 0.24 0.03 0.00 -1.57 0.00 0.00 52.86 51.58 2hm9 s ASN 59 Cb -0.22 -1.69 0.01 0.00 -0.02 0.00 0.00 41.25 39.33 2hm9 s ASN 59 CO -0.00 0.36 -0.14 -0.69 -2.57 0.00 0.00 177.10 174.05 2hm9 s VAL 60 N -1.01 1.27 -0.24 1.60 1.01 -0.17 -1.12 120.40 121.75 2hm9 s VAL 60 Ca 0.17 -0.58 -0.11 0.00 0.00 0.00 0.00 61.98 61.45 2hm9 s VAL 60 Cb -0.12 -1.14 -0.05 0.00 0.00 0.00 0.00 36.38 35.08 2hm9 s VAL 60 CO 0.06 0.38 0.18 -0.69 0.00 0.00 0.00 175.10 175.04 2hm9 s VAL 61 N 0.46 5.34 -0.21 2.92 1.01 0.52 0.57 120.40 131.02 2hm9 s VAL 61 Ca -0.12 0.23 -0.05 0.00 0.00 0.00 0.00 61.98 62.04 2hm9 s VAL 61 Cb -0.15 -3.52 -0.02 0.00 0.00 0.00 0.00 36.38 32.69 2hm9 s VAL 61 CO 0.04 0.33 0.01 -0.22 0.00 0.00 0.00 175.10 175.26 2hm9 s LEU 62 N 1.11 3.28 -0.06 3.92 0.20 0.15 -1.78 118.68 125.50 2hm9 s LEU 62 Ca 0.09 -0.20 0.03 0.00 0.69 0.00 0.00 54.13 54.73 2hm9 s LEU 62 Cb -0.14 -1.84 0.01 0.00 -0.43 0.00 0.00 46.19 43.79 2hm9 s LEU 62 CO 0.05 0.05 -0.14 0.28 -0.29 0.00 0.00 176.35 176.31 2hm9 s THR 63 N 1.07 1.23 0.13 3.68 -1.32 -1.15 -2.18 115.64 117.10 2hm9 s THR 63 Ca 0.02 -0.56 -0.14 0.00 -1.21 0.00 0.00 61.69 59.81 2hm9 s THR 63 Cb -0.14 -1.10 -0.02 0.00 -1.51 0.00 0.00 72.50 69.73 2hm9 s THR 63 CO 0.02 0.37 1.56 -0.74 -2.21 0.00 0.00 174.62 173.61 2hm9 h HIS 64 N 6.75 0.84 -3.63 9.09 2.76 -1.88 -3.37 115.15 125.72 2hm9 h HIS 64 Ca -0.31 -0.16 -0.51 0.00 -2.20 0.00 0.00 60.37 57.19 2hm9 h HIS 64 Cb 1.19 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 29.92 2hm9 h HIS 64 CO 0.47 0.86 0.39 1.14 -1.30 0.00 0.00 177.93 179.49 2hm9 s GLN 65 N -4.90 4.72 0.00 5.26 -2.07 -1.26 -4.94 119.66 116.47 2hm9 s GLN 65 Ca -0.13 1.54 0.30 0.00 -1.82 0.00 0.00 55.36 55.25 2hm9 s GLN 65 Cb 0.10 -3.32 1.76 0.00 -1.09 0.00 0.00 33.01 30.46 2hm9 s GLN 65 CO 0.81 0.27 2.11 0.39 -1.32 0.00 0.00 175.29 177.54 2hm9 n GLU 66 N 2.26 0.88 -0.38 9.60 1.02 -1.26 -3.20 120.64 129.56 2hm9 n GLU 66 Ca 0.01 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.26 2hm9 n GLU 66 Cb 0.48 -1.50 0.30 0.00 -0.02 0.00 0.00 31.44 30.70 2hm9 n GLU 66 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 2hm9 n ASP 67 N -1.03 3.76 -4.50 1.62 5.68 -1.26 -4.94 116.55 115.88 2hm9 n ASP 67 Ca 0.22 -2.07 -0.30 0.00 -0.50 0.00 0.00 54.79 52.14 2hm9 n ASP 67 Cb 0.12 -0.47 -0.11 0.00 -1.14 0.00 0.00 41.12 39.51 2hm9 n ASP 67 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 2hm9 s TYR 68 N -1.21 2.60 0.08 2.11 6.14 -1.19 -5.14 117.35 120.73 2hm9 s TYR 68 Ca 0.46 -0.23 0.02 0.00 0.64 0.00 0.00 57.07 57.95 2hm9 s TYR 68 Cb 0.25 -1.42 -0.04 0.00 0.42 0.00 0.00 41.96 41.18 2hm9 s TYR 68 CO 0.30 0.35 -0.07 -0.65 0.64 0.00 0.00 175.55 176.11 2hm9 s GLN 69 N -1.87 0.72 0.03 4.97 -1.52 -1.26 -4.98 119.66 115.75 2hm9 s GLN 69 Ca 0.17 -1.12 0.02 0.00 -1.95 0.00 0.00 55.36 52.48 2hm9 s GLN 69 Cb -0.11 -0.23 -0.02 0.00 -0.22 0.00 0.00 33.01 32.44 2hm9 s GLN 69 CO 0.09 0.00 -0.07 0.00 -0.25 0.00 0.00 175.29 175.06 2hm9 s ALA 70 N -2.82 0.56 -0.12 6.09 0.00 -1.26 -5.14 121.76 119.07 2hm9 s ALA 70 Ca 0.04 -0.67 -0.03 0.00 0.00 0.00 0.00 51.96 51.29 2hm9 s ALA 70 Cb -0.00 0.02 -0.03 0.00 0.00 0.00 0.00 23.12 23.10 2hm9 s ALA 70 CO -0.03 0.00 -0.01 -0.65 0.00 0.00 0.00 175.76 175.08 2hm9 s GLN 71 N -1.33 3.36 0.00 0.00 -1.52 -1.26 -4.50 119.66 114.41 2hm9 s GLN 71 Ca -0.08 -0.45 0.00 0.00 -1.95 0.00 0.00 55.36 52.89 2hm9 s GLN 71 Cb -0.09 -2.89 0.00 0.00 -0.22 0.00 0.00 33.01 29.82 2hm9 s GLN 71 CO 0.00 0.47 0.00 0.41 -0.25 0.00 0.00 175.29 175.93 2hm9 n GLY 72 N 2.85 3.29 2.97 3.09 0.00 -1.26 -4.73 105.19 111.40 2hm9 n GLY 72 Ca -0.18 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.33 0.67 0.24 4.61 0.00 -1.26 -4.52 121.76 119.18 2hm9 s ALA 73 Ca 0.00 -0.26 -0.32 0.00 0.00 0.00 0.00 51.96 51.39 2hm9 s ALA 73 Cb 0.00 -0.25 -0.13 0.00 0.00 0.00 0.00 23.12 22.75 2hm9 s ALA 73 CO 0.00 0.11 1.59 0.28 0.00 0.00 0.00 175.76 177.74 2hm9 n VAL 74 N 3.23 0.56 -3.38 0.00 0.31 -0.27 -3.56 118.33 115.21 2hm9 n VAL 74 Ca -0.17 -0.14 -0.41 0.00 -0.01 0.00 0.00 64.34 63.62 2hm9 n VAL 74 Cb 0.55 -1.78 -0.09 0.00 -0.91 0.00 0.00 33.84 31.61 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 0.45 5.15 -0.09 2.52 1.01 -1.25 0.20 120.40 128.39 2hm9 s VAL 75 Ca 0.70 0.14 0.03 0.00 0.00 0.00 0.00 61.98 62.86 2hm9 s VAL 75 Cb -0.57 -3.83 0.01 0.00 0.00 0.00 0.00 36.38 32.00 2hm9 s VAL 75 CO 0.43 -0.08 -0.17 0.68 0.00 0.00 0.00 175.10 175.95 2hm9 s VAL 76 N 2.07 1.57 -2.22 2.92 -7.23 -0.74 -4.99 120.40 111.79 2hm9 s VAL 76 Ca 0.13 -0.72 0.20 0.00 -1.81 0.00 0.00 61.98 59.78 2hm9 s VAL 76 Cb -0.16 -1.39 0.09 0.00 0.56 0.00 0.00 36.38 35.48 2hm9 s VAL 76 CO 0.12 0.45 1.07 1.41 -0.31 0.00 0.00 175.10 177.84 2hm9 n HIS 77 N 3.76 0.00 -3.91 2.82 -0.00 -1.26 -2.94 115.22 113.68 2hm9 n HIS 77 Ca -0.21 0.00 -0.35 0.00 -0.00 0.00 0.00 57.72 57.16 2hm9 n HIS 77 Cb 0.52 0.00 -0.09 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 -1.91 5.78 0.16 0.41 1.01 -1.26 -4.80 116.67 116.06 2hm9 s ASP 78 Ca 0.20 0.11 -0.13 0.00 0.71 0.00 0.00 52.55 53.44 2hm9 s ASP 78 Cb 0.16 -2.00 0.06 0.00 1.01 0.00 0.00 42.92 42.15 2hm9 s ASP 78 CO 0.36 0.16 1.75 0.58 0.21 0.00 0.00 175.17 178.23 2hm9 h VAL 79 N 4.86 1.20 -0.58 -1.27 2.07 -1.99 -2.43 116.25 118.12 2hm9 h VAL 79 Ca -0.38 -0.56 -0.03 0.00 0.82 0.00 0.00 66.70 66.56 2hm9 h VAL 79 Cb 1.16 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 31.47 2hm9 h VAL 79 CO 0.71 0.22 0.25 0.00 0.02 0.00 0.00 177.57 178.77 2hm9 h ALA 80 N 1.10 1.36 -0.58 1.67 0.00 -2.00 -2.32 119.26 118.48 2hm9 h ALA 80 Ca 0.19 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 2hm9 h ALA 80 Cb 0.11 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 2hm9 h ALA 80 CO -0.02 0.49 0.19 0.00 0.00 0.00 0.00 179.25 179.91 2hm9 h ALA 81 N 1.46 1.24 -0.55 0.00 0.00 -1.86 -0.78 119.26 118.76 2hm9 h ALA 81 Ca 0.20 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2hm9 h ALA 81 Cb 0.13 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2hm9 h ALA 81 CO -0.02 0.54 0.27 0.28 0.00 0.00 0.00 179.25 180.32 2hm9 h VAL 82 N 0.85 1.20 -0.39 0.00 2.07 -1.04 0.59 116.25 119.53 2hm9 h VAL 82 Ca 0.19 -0.55 0.00 0.00 0.82 0.00 0.00 66.70 67.16 2hm9 h VAL 82 Cb 0.23 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 2hm9 h VAL 82 CO -0.01 0.22 0.25 -0.26 0.02 0.00 0.00 177.57 177.80 2hm9 h PHE 83 N 0.75 0.49 -0.65 1.57 0.04 -1.24 -2.65 116.94 115.26 2hm9 h PHE 83 Ca 0.19 0.01 -0.05 0.00 2.80 0.00 0.00 57.97 60.92 2hm9 h PHE 83 Cb 0.11 -0.17 -0.03 0.00 2.20 0.00 0.00 35.95 38.06 2hm9 h PHE 83 CO -0.01 0.32 0.21 0.00 -0.60 0.00 0.00 178.31 178.24 2hm9 h ALA 84 N 1.13 1.16 -0.23 2.45 0.00 -0.70 -1.46 119.26 121.61 2hm9 h ALA 84 Ca 0.14 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2hm9 h ALA 84 Cb -0.05 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 2hm9 h ALA 84 CO -0.03 0.59 0.14 -0.92 0.00 0.00 0.00 179.25 179.03 2hm9 h TYR 85 N 0.95 0.30 -0.64 0.00 5.03 -0.57 0.14 116.97 122.18 2hm9 h TYR 85 Ca 0.21 -0.00 -0.05 0.00 2.58 0.00 0.00 58.73 61.47 2hm9 h TYR 85 Cb 0.25 -0.10 -0.03 0.00 1.55 0.00 0.00 36.73 38.41 2hm9 h TYR 85 CO 0.02 0.23 0.20 0.00 -1.32 0.00 0.00 178.16 177.29 2hm9 h ALA 86 N 1.04 1.15 -0.67 1.82 0.00 -1.30 -2.10 119.26 119.19 2hm9 h ALA 86 Ca 0.08 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 2hm9 h ALA 86 Cb 0.02 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 2hm9 h ALA 86 CO -0.02 0.59 0.30 -0.22 0.00 0.00 0.00 179.25 179.90 2hm9 h LYS 87 N 0.94 0.97 -0.67 0.00 3.64 -0.67 -2.47 116.57 118.32 2hm9 h LYS 87 Ca 0.21 -0.15 -0.06 0.00 -1.27 0.00 0.00 60.65 59.38 2hm9 h LYS 87 Cb 0.27 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 31.88 2hm9 h LYS 87 CO -0.01 0.77 0.17 1.96 -2.27 0.00 0.00 179.45 180.08 2hm9 h GLN 88 N 0.96 1.04 -2.76 1.90 4.20 -0.08 -3.29 115.11 117.09 2hm9 h GLN 88 Ca 0.23 -0.23 -0.72 0.00 0.06 0.00 0.00 58.65 57.99 2hm9 h GLN 88 Cb 0.14 -0.15 -0.34 0.00 0.30 0.00 0.00 27.48 27.44 2hm9 h GLN 88 CO -0.03 0.91 0.17 0.72 -0.67 0.00 0.00 178.83 179.94 2hm9 n HIS 89 N -4.25 3.16 0.15 2.96 8.25 -0.93 -4.85 115.22 119.70 2hm9 n HIS 89 Ca 0.05 -3.41 0.07 0.00 -0.26 0.00 0.00 57.72 54.17 2hm9 n HIS 89 Cb 0.24 -1.02 0.56 0.00 1.12 0.00 0.00 29.99 30.89 2hm9 n HIS 89 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2hm9 h PRO 90 N 5.14 0.22 -0.36 -0.41 0.13 -1.63 -1.73 132.00 133.34 2hm9 h PRO 90 Ca 0.19 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 65.26 2hm9 h PRO 90 Cb 0.67 -0.05 -0.02 0.00 0.13 0.00 0.00 31.00 31.73 2hm9 h PRO 90 CO 1.08 0.14 0.01 -0.44 -0.23 0.00 0.00 178.00 178.56 2hm9 h ASP 91 N 0.22 0.53 -3.31 1.44 3.32 -1.89 -3.41 116.42 113.32 2hm9 h ASP 91 Ca 0.07 -0.10 -0.63 0.00 0.02 0.00 0.00 57.03 56.39 2hm9 h ASP 91 Cb 0.00 -0.14 -0.19 0.00 0.22 0.00 0.00 39.33 39.23 2hm9 h ASP 91 CO -0.01 0.60 -0.61 -1.10 -1.72 0.00 0.00 179.24 176.39 2hm9 s GLN 92 N -4.98 3.83 0.50 3.56 1.11 -0.65 -5.09 119.66 117.93 2hm9 s GLN 92 Ca -0.08 -0.42 -0.18 0.00 0.01 0.00 0.00 55.36 54.68 2hm9 s GLN 92 Cb 0.15 -3.09 -0.08 0.00 -1.01 0.00 0.00 33.01 28.98 2hm9 s GLN 92 CO 0.77 0.24 1.00 -1.21 0.01 0.00 0.00 175.29 176.10 2hm9 s GLU 93 N 0.43 3.89 -0.19 2.91 2.02 -1.26 -4.72 118.70 121.77 2hm9 s GLU 93 Ca 0.00 1.12 -0.07 0.00 0.02 0.00 0.00 54.97 56.04 2hm9 s GLU 93 Cb -0.13 -2.12 -0.04 0.00 0.10 0.00 0.00 34.13 31.94 2hm9 s GLU 93 CO 0.01 -0.33 0.06 -1.17 0.02 0.00 0.00 175.26 173.86 2hm9 s LEU 94 N -3.79 3.77 -0.06 1.80 2.96 -1.25 -0.88 118.68 121.23 2hm9 s LEU 94 Ca 0.62 0.05 0.04 0.00 -0.22 0.00 0.00 54.13 54.63 2hm9 s LEU 94 Cb -0.12 -1.96 -0.00 0.00 0.50 0.00 0.00 46.19 44.61 2hm9 s LEU 94 CO 0.25 0.15 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.54 2hm9 s VAL 95 N 0.50 1.69 -0.44 1.68 1.01 0.14 0.91 120.40 125.88 2hm9 s VAL 95 Ca 0.03 -0.84 -0.18 0.00 0.00 0.00 0.00 61.98 60.99 2hm9 s VAL 95 Cb -0.13 -1.46 0.03 0.00 0.00 0.00 0.00 36.38 34.83 2hm9 s VAL 95 CO 0.01 0.48 0.48 -0.63 0.00 0.00 0.00 175.10 175.44 2hm9 s ILE 96 N 0.14 5.05 0.27 2.22 1.09 0.06 0.13 121.20 130.17 2hm9 s ILE 96 Ca -0.09 -0.43 -0.01 0.00 -1.10 0.00 0.00 60.65 59.02 2hm9 s ILE 96 Cb -0.14 -4.11 0.12 0.00 -1.06 0.00 0.00 42.46 37.27 2hm9 s ILE 96 CO 0.04 -0.52 1.78 0.00 -0.10 0.00 0.00 174.94 176.14 2hm9 h ALA 97 N 8.79 1.15 0.00 9.38 0.00 -0.99 -2.79 119.26 134.79 2hm9 h ALA 97 Ca -0.27 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2hm9 h ALA 97 Cb 1.11 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.70 2hm9 h ALA 97 CO 0.84 0.55 0.00 0.41 0.00 0.00 0.00 179.25 181.06 2hm9 n GLY 98 N -0.70 0.15 0.00 0.00 0.00 -1.23 -4.68 105.19 98.73 2hm9 n GLY 98 Ca 0.03 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.40 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 0.00 1.22 0.32 -0.02 0.00 -1.26 0.12 105.19 105.57 2hm9 n GLY 99 Ca 0.00 -1.53 -0.04 0.00 0.00 0.00 0.00 46.02 44.45 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 -1.68 1.16 -0.75 4.61 0.00 -1.94 0.39 119.26 121.05 2hm9 h ALA 100 Ca 0.00 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 2hm9 h ALA 100 Cb 0.00 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 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 0.97 1.13 -0.40 0.00 -0.00 -1.98 0.48 115.11 115.32 2hm9 h GLN 101 Ca 0.22 -0.22 -0.07 0.00 -0.00 0.00 0.00 58.65 58.59 2hm9 h GLN 101 Cb 0.24 -0.18 -0.01 0.00 0.00 0.00 0.00 27.48 27.52 2hm9 h GLN 101 CO -0.01 0.94 -0.02 0.82 0.00 0.00 0.00 178.83 180.55 2hm9 h ILE 102 N 1.09 1.26 -0.40 2.39 1.08 -1.71 -1.45 117.51 119.77 2hm9 h ILE 102 Ca 0.25 -1.05 -0.01 0.00 -0.39 0.00 0.00 64.86 63.66 2hm9 h ILE 102 Cb 0.24 1.14 -0.02 0.00 -3.07 0.00 0.00 36.82 35.11 2hm9 h ILE 102 CO -0.02 0.35 0.21 -0.26 -0.69 0.00 0.00 178.15 177.75 2hm9 h PHE 103 N 0.55 0.56 -0.62 1.37 0.04 -0.27 -2.75 116.94 115.82 2hm9 h PHE 103 Ca 0.11 -0.02 -0.04 0.00 2.80 0.00 0.00 57.97 60.83 2hm9 h PHE 103 Cb 0.51 -0.18 -0.03 0.00 2.20 0.00 0.00 35.95 38.45 2hm9 h PHE 103 CO 0.04 0.44 0.24 1.79 -0.60 0.00 0.00 178.31 180.23 2hm9 h THR 104 N 0.51 1.23 -0.87 -1.55 1.35 0.06 0.95 112.91 114.59 2hm9 h THR 104 Ca 0.14 -0.73 -0.03 0.00 -0.55 0.00 0.00 66.41 65.24 2hm9 h THR 104 Cb 0.07 0.55 -0.04 0.00 -1.73 0.00 0.00 68.15 67.01 2hm9 h THR 104 CO -0.02 0.29 0.44 0.00 -0.25 0.00 0.00 175.52 175.97 2hm9 h ALA 105 N 1.09 1.12 -0.19 6.62 0.00 -1.10 -3.03 119.26 123.78 2hm9 h ALA 105 Ca 0.21 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2hm9 h ALA 105 Cb 0.21 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 2hm9 h ALA 105 CO -0.02 0.67 -0.00 1.19 0.00 0.00 0.00 179.25 181.09 2hm9 n PHE 106 N -4.31 0.67 -0.29 0.00 3.72 -1.05 -4.72 117.46 111.49 2hm9 n PHE 106 Ca 0.09 -0.93 -0.05 0.00 -0.05 0.00 0.00 57.45 56.51 2hm9 n PHE 106 Cb 0.13 -0.27 0.07 0.00 -0.94 0.00 0.00 39.48 38.47 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 1.26 1.08 -0.01 -1.08 3.64 0.11 -2.25 116.57 119.32 2hm9 h LYS 107 Ca 0.00 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 2hm9 h LYS 107 Cb 1.32 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 2hm9 h LYS 107 CO 0.16 0.77 -0.28 -3.47 -2.27 0.00 0.00 179.45 174.36 2hm9 n ASP 108 N -4.46 1.31 -1.30 4.20 2.03 -1.26 -3.92 116.55 113.13 2hm9 n ASP 108 Ca 0.08 -1.09 0.11 0.00 0.52 0.00 0.00 54.79 54.41 2hm9 n ASP 108 Cb 0.06 0.20 0.31 0.00 -0.72 0.00 0.00 41.12 40.97 2hm9 n ASP 108 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2hm9 n ASP 109 N -0.42 3.92 -4.23 1.67 8.00 -0.87 -4.92 116.55 119.70 2hm9 n ASP 109 Ca 0.12 -2.03 -0.32 0.00 0.71 0.00 0.00 54.79 53.28 2hm9 n ASP 109 Cb 0.38 -0.47 -0.17 0.00 -0.02 0.00 0.00 41.12 40.84 2hm9 n ASP 109 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2hm9 s VAL 110 N -1.05 2.09 -1.61 2.53 1.01 -1.04 -4.76 120.40 117.58 2hm9 s VAL 110 Ca 0.47 -1.01 0.26 0.00 0.00 0.00 0.00 61.98 61.70 2hm9 s VAL 110 Cb 0.25 -1.79 0.21 0.00 0.00 0.00 0.00 36.38 35.05 2hm9 s VAL 110 CO 0.31 0.56 1.53 0.47 0.00 0.00 0.00 175.10 177.97 2hm9 n ASP 111 N 3.51 0.93 -4.06 3.32 8.00 -1.22 -4.69 116.55 122.33 2hm9 n ASP 111 Ca -0.19 -0.77 -0.28 0.00 0.71 0.00 0.00 54.79 54.26 2hm9 n ASP 111 Cb 0.53 0.16 -0.17 0.00 -0.02 0.00 0.00 41.12 41.63 2hm9 n ASP 111 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2hm9 s THR 112 N -2.60 1.47 -0.14 -3.53 2.01 -1.10 -2.06 115.64 109.69 2hm9 s THR 112 Ca 0.22 -0.64 0.02 0.00 0.31 0.00 0.00 61.69 61.60 2hm9 s THR 112 Cb 0.19 -1.33 0.01 0.00 0.01 0.00 0.00 72.50 71.37 2hm9 s THR 112 CO 0.56 0.43 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.95 2hm9 s LEU 113 N 0.85 2.20 -0.20 4.42 1.43 0.13 0.12 118.68 127.63 2hm9 s LEU 113 Ca -0.10 -0.56 -0.02 0.00 -1.03 0.00 0.00 54.13 52.43 2hm9 s LEU 113 Cb -0.15 -1.47 0.00 0.00 0.03 0.00 0.00 46.19 44.60 2hm9 s LEU 113 CO 0.01 0.09 -0.12 -0.76 0.23 0.00 0.00 176.35 175.81 2hm9 s LEU 114 N 0.74 2.56 -0.04 1.79 1.43 0.39 -0.22 118.68 125.32 2hm9 s LEU 114 Ca -0.08 -0.50 0.04 0.00 -1.03 0.00 0.00 54.13 52.56 2hm9 s LEU 114 Cb -0.16 -1.62 -0.00 0.00 0.03 0.00 0.00 46.19 44.44 2hm9 s LEU 114 CO 0.00 0.00 -0.15 0.54 0.23 0.00 0.00 176.35 176.97 2hm9 s VAL 115 N 1.31 1.27 -0.16 -1.59 0.11 -0.63 -2.13 120.40 118.58 2hm9 s VAL 115 Ca 0.04 -0.62 -0.02 0.00 -2.93 0.00 0.00 61.98 58.44 2hm9 s VAL 115 Cb -0.14 -1.10 -0.02 0.00 -1.53 0.00 0.00 36.38 33.60 2hm9 s VAL 115 CO -0.06 0.37 -0.08 -0.89 -3.33 0.00 0.00 175.10 171.11 2hm9 s THR 116 N 0.09 3.41 -0.10 5.04 2.01 -1.05 -1.87 115.64 123.17 2hm9 s THR 116 Ca -0.04 -0.52 0.00 0.00 0.31 0.00 0.00 61.69 61.44 2hm9 s THR 116 Cb -0.11 -2.48 -0.02 0.00 0.01 0.00 0.00 72.50 69.90 2hm9 s THR 116 CO 0.02 0.49 -0.10 -0.60 -0.69 0.00 0.00 174.62 173.74 2hm9 s ARG 117 N 0.60 3.11 -0.12 4.92 3.52 -0.91 -0.06 118.95 130.00 2hm9 s ARG 117 Ca -0.05 -0.63 -0.02 0.00 -0.13 0.00 0.00 55.73 54.91 2hm9 s ARG 117 Cb -0.15 -2.62 -0.03 0.00 -1.56 0.00 0.00 34.95 30.60 2hm9 s ARG 117 CO 0.03 0.41 -0.06 -0.51 -0.81 0.00 0.00 175.30 174.35 2hm9 s LEU 118 N -0.14 3.14 0.29 -0.88 1.02 -1.08 -1.62 118.68 119.42 2hm9 s LEU 118 Ca 0.00 -0.12 -0.01 0.00 0.02 0.00 0.00 54.13 54.02 2hm9 s LEU 118 Cb -0.13 -1.73 0.43 0.00 0.02 0.00 0.00 46.19 44.78 2hm9 s LEU 118 CO 0.03 0.23 1.86 0.00 0.02 0.00 0.00 176.35 178.49 2hm9 h ALA 119 N 6.23 1.27 -2.05 4.21 0.00 -1.62 -2.66 119.26 124.64 2hm9 h ALA 119 Ca -0.36 -0.17 -0.44 0.00 0.00 0.00 0.00 54.91 53.95 2hm9 h ALA 119 Cb 1.19 -0.24 0.17 0.00 0.00 0.00 0.00 17.79 18.91 2hm9 h ALA 119 CO 0.58 0.53 0.34 0.20 0.00 0.00 0.00 179.25 180.91 2hm9 s GLY 120 N -3.57 1.72 0.07 0.00 0.00 -1.22 -4.76 107.32 99.55 2hm9 s GLY 120 Ca -0.10 -1.11 0.05 0.00 0.00 0.00 0.00 44.72 43.57 2hm9 s GLY 120 CO 0.80 -0.31 -0.15 -1.35 0.00 0.00 0.00 173.10 172.09 2hm9 s SER 121 N -4.59 1.74 0.09 1.64 1.04 -1.26 -3.77 113.70 108.59 2hm9 s SER 121 Ca 0.73 -0.59 0.04 0.00 0.48 0.00 0.00 55.95 56.61 2hm9 s SER 121 Cb -0.06 -0.07 -0.03 0.00 0.10 0.00 0.00 66.02 65.96 2hm9 s SER 121 CO 0.54 -0.04 -0.11 -0.36 0.98 0.00 0.00 173.24 174.24 2hm9 s PHE 122 N -1.18 1.11 -0.07 5.02 0.40 -1.26 -5.09 117.98 116.91 2hm9 s PHE 122 Ca -0.01 -0.59 0.02 0.00 -0.60 0.00 0.00 56.93 55.76 2hm9 s PHE 122 Cb -0.10 -0.61 -0.03 0.00 0.51 0.00 0.00 43.02 42.80 2hm9 s PHE 122 CO 0.02 0.03 -0.11 -2.00 0.70 0.00 0.00 175.22 173.86 2hm9 s GLU 123 N -2.45 2.72 0.20 0.44 2.12 -1.26 -4.85 118.70 115.61 2hm9 s GLU 123 Ca 0.03 -0.63 -0.24 0.00 0.36 0.00 0.00 54.97 54.50 2hm9 s GLU 123 Cb -0.05 -2.50 0.05 0.00 0.26 0.00 0.00 34.13 31.88 2hm9 s GLU 123 CO 0.01 0.59 0.86 0.20 -0.54 0.00 0.00 175.26 176.38 2hm9 s GLY 124 N -0.62 -0.19 0.00 -1.50 0.00 -1.26 -4.80 107.32 98.95 2hm9 s GLY 124 Ca 0.09 -0.02 0.28 0.00 0.00 0.00 0.00 44.72 45.07 2hm9 s GLY 124 CO 0.01 -0.02 1.72 1.34 0.00 0.00 0.00 173.10 176.15 2hm9 n ASP 125 N -0.46 1.07 -4.23 1.64 2.03 -1.21 -4.81 116.55 110.58 2hm9 n ASP 125 Ca -0.05 -1.09 -0.32 0.00 0.52 0.00 0.00 54.79 53.84 2hm9 n ASP 125 Cb 0.60 0.04 -0.16 0.00 -0.72 0.00 0.00 41.12 40.88 2hm9 n ASP 125 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2hm9 s THR 126 N -2.27 2.28 0.13 5.18 2.01 -0.52 -4.90 115.64 117.54 2hm9 s THR 126 Ca 0.32 -0.92 0.11 0.00 0.31 0.00 0.00 61.69 61.50 2hm9 s THR 126 Cb 0.20 -1.91 -0.04 0.00 0.01 0.00 0.00 72.50 70.76 2hm9 s THR 126 CO 0.43 0.54 -0.25 -0.54 -0.69 0.00 0.00 174.62 174.11 2hm9 s LYS 127 N 0.58 1.46 0.35 4.92 3.01 -1.26 -2.63 119.74 126.18 2hm9 s LYS 127 Ca -0.12 -1.33 -0.27 0.00 -1.01 0.00 0.00 55.97 53.24 2hm9 s LYS 127 Cb -0.16 -1.93 -0.09 0.00 -1.01 0.00 0.00 37.83 34.63 2hm9 s LYS 127 CO 0.03 0.45 1.23 1.41 0.51 0.00 0.00 175.35 178.98 2hm9 s MET 128 N -2.10 4.27 0.65 1.68 -2.45 -1.11 -4.78 119.30 115.45 2hm9 s MET 128 Ca 0.15 2.02 -0.17 0.00 -1.25 0.00 0.00 55.69 56.44 2hm9 s MET 128 Cb -0.10 -2.93 -0.00 0.00 1.25 0.00 0.00 34.83 33.04 2hm9 s MET 128 CO 0.07 -0.19 1.18 0.96 1.05 0.00 0.00 175.02 178.08 2hm9 s ILE 129 N -1.24 2.72 0.46 10.11 -5.25 -1.26 -4.95 121.20 121.78 2hm9 s ILE 129 Ca 0.52 0.38 -0.25 0.00 -0.99 0.00 0.00 60.65 60.31 2hm9 s ILE 129 Cb -0.35 -3.00 -0.08 0.00 2.95 0.00 0.00 42.46 41.97 2hm9 s ILE 129 CO 0.46 -0.16 1.41 -2.65 -1.79 0.00 0.00 174.94 172.21 2hm9 n PRO 130 N -2.17 2.16 -4.43 0.37 -0.02 -1.26 -5.03 135.00 124.63 2hm9 n PRO 130 Ca 0.13 0.77 -0.22 0.00 -2.02 0.00 0.00 63.50 62.16 2hm9 n PRO 130 Cb 0.51 -2.60 -0.13 0.00 -0.02 0.00 0.00 33.50 31.25 2hm9 n PRO 130 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2hm9 s LEU 131 N -2.62 2.18 -0.94 2.45 1.43 -1.26 -5.08 118.68 114.84 2hm9 s LEU 131 Ca 0.62 -0.49 -0.17 0.00 -1.03 0.00 0.00 54.13 53.06 2hm9 s LEU 131 Cb -0.45 -0.72 0.15 0.00 0.03 0.00 0.00 46.19 45.20 2hm9 s LEU 131 CO 0.57 0.07 1.08 0.21 0.23 0.00 0.00 176.35 178.51 2hm9 s ASN 132 N -1.20 6.70 0.27 2.29 3.84 -1.26 -4.85 114.94 120.72 2hm9 s ASN 132 Ca 0.03 -2.27 -0.04 0.00 0.21 0.00 0.00 52.86 50.79 2hm9 s ASN 132 Cb -0.08 -2.36 0.33 0.00 -0.55 0.00 0.00 41.25 38.59 2hm9 s ASN 132 CO 0.02 -0.93 1.87 -0.50 -2.79 0.00 0.00 177.10 174.77 2hm9 h TRP 133 N 8.46 1.06 -0.35 0.43 -0.00 -1.98 -2.51 115.95 121.06 2hm9 h TRP 133 Ca 0.16 -0.04 -0.05 0.00 -0.00 0.00 0.00 58.89 58.96 2hm9 h TRP 133 Cb 1.01 -0.33 -0.02 0.00 -0.00 0.00 0.00 29.16 29.82 2hm9 h TRP 133 CO 1.13 0.76 -0.01 -0.44 -0.00 0.00 0.00 178.44 179.88 2hm9 h ASP 134 N 1.07 0.52 -0.31 -3.49 5.19 -2.05 -2.69 116.42 114.67 2hm9 h ASP 134 Ca 0.26 -0.10 -0.05 0.00 -0.62 0.00 0.00 57.03 56.52 2hm9 h ASP 134 Cb 0.09 -0.14 -0.02 0.00 0.18 0.00 0.00 39.33 39.44 2hm9 h ASP 134 CO -0.04 0.60 0.04 -0.78 -3.12 0.00 0.00 179.24 175.94 2hm9 h ASP 135 N 0.53 0.58 -3.42 6.45 3.58 -1.86 -3.43 116.42 118.85 2hm9 h ASP 135 Ca 0.11 -0.11 -0.68 0.00 0.42 0.00 0.00 57.03 56.78 2hm9 h ASP 135 Cb 0.36 -0.15 -0.15 0.00 1.72 0.00 0.00 39.33 41.10 2hm9 h ASP 135 CO 0.01 0.63 -0.65 -0.36 -2.88 0.00 0.00 179.24 175.99 2hm9 s PHE 136 N -5.04 3.07 -0.15 0.28 0.40 -1.01 -3.96 117.98 111.57 2hm9 s PHE 136 Ca -0.08 0.10 -0.02 0.00 -0.60 0.00 0.00 56.93 56.33 2hm9 s PHE 136 Cb 0.15 -1.72 -0.02 0.00 0.51 0.00 0.00 43.02 41.95 2hm9 s PHE 136 CO 0.78 0.43 -0.08 0.99 0.70 0.00 0.00 175.22 178.04 2hm9 s THR 137 N -0.95 3.51 0.15 0.64 2.01 -1.14 -4.82 115.64 115.04 2hm9 s THR 137 Ca 0.16 -0.49 -0.31 0.00 0.31 0.00 0.00 61.69 61.35 2hm9 s THR 137 Cb -0.11 -2.52 -0.10 0.00 0.01 0.00 0.00 72.50 69.78 2hm9 s THR 137 CO 0.05 0.50 1.57 -0.75 -0.69 0.00 0.00 174.62 175.30 2hm9 s LYS 138 N 0.44 4.22 -0.16 4.92 2.20 -1.26 -2.07 119.74 128.02 2hm9 s LYS 138 Ca -0.06 2.34 -0.14 0.00 -0.36 0.00 0.00 55.97 57.75 2hm9 s LYS 138 Cb -0.15 -3.20 -0.23 0.00 -1.51 0.00 0.00 37.83 32.75 2hm9 s LYS 138 CO 0.04 -0.61 0.29 1.33 -0.36 0.00 0.00 175.35 176.03 2hm9 n VAL 139 N 4.03 1.66 -3.66 4.02 0.24 -0.11 -4.92 118.33 119.60 2hm9 n VAL 139 Ca 0.14 -0.35 -0.10 0.00 -2.04 0.00 0.00 64.34 61.99 2hm9 n VAL 139 Cb 0.39 -1.89 -0.02 0.00 -1.47 0.00 0.00 33.84 30.85 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 -6.96 -0.38 0.15 -1.34 0.01 -1.19 -5.05 113.70 98.94 2hm9 s SER 140 Ca -0.26 -0.34 -0.21 0.00 1.31 0.00 0.00 55.95 56.45 2hm9 s SER 140 Cb 0.06 0.64 0.06 0.00 0.21 0.00 0.00 66.02 67.00 2hm9 s SER 140 CO 0.68 -1.13 0.53 -0.55 0.41 0.00 0.00 173.24 173.18 2hm9 s SER 141 N -2.84 -0.46 0.01 2.44 0.15 -1.26 -0.43 113.70 111.31 2hm9 s SER 141 Ca 0.07 -0.11 0.02 0.00 0.70 0.00 0.00 55.95 56.63 2hm9 s SER 141 Cb -0.03 0.56 -0.01 0.00 -1.71 0.00 0.00 66.02 64.83 2hm9 s SER 141 CO -0.03 -0.93 -0.06 -0.60 1.20 0.00 0.00 173.24 172.82 2hm9 s ARG 142 N -3.77 0.42 -0.14 5.44 3.52 0.29 -4.98 118.95 119.74 2hm9 s ARG 142 Ca 0.02 -0.38 0.01 0.00 -0.13 0.00 0.00 55.73 55.25 2hm9 s ARG 142 Cb -0.00 -0.32 -0.00 0.00 -1.56 0.00 0.00 34.95 33.07 2hm9 s ARG 142 CO -0.13 0.08 -0.17 0.99 -0.81 0.00 0.00 175.30 175.26 2hm9 s THR 143 N -0.58 2.56 -0.08 4.11 2.01 -1.26 0.11 115.64 122.51 2hm9 s THR 143 Ca -0.03 -0.82 0.04 0.00 0.31 0.00 0.00 61.69 61.19 2hm9 s THR 143 Cb -0.05 -2.06 0.00 0.00 0.01 0.00 0.00 72.50 70.41 2hm9 s THR 143 CO -0.00 0.53 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.56 2hm9 s VAL 144 N 0.61 1.76 -0.21 3.82 1.01 -0.62 -5.01 120.40 121.76 2hm9 s VAL 144 Ca -0.10 -0.87 -0.04 0.00 0.00 0.00 0.00 61.98 60.98 2hm9 s VAL 144 Cb -0.16 -1.53 -0.01 0.00 0.00 0.00 0.00 36.38 34.68 2hm9 s VAL 144 CO 0.03 0.50 -0.04 -1.61 0.00 0.00 0.00 175.10 173.98 2hm9 s GLU 145 N 0.28 3.43 0.78 2.72 2.02 -1.26 -2.05 118.70 124.61 2hm9 s GLU 145 Ca -0.13 -0.61 -0.04 0.00 0.02 0.00 0.00 54.97 54.21 2hm9 s GLU 145 Cb -0.16 -3.00 0.15 0.00 0.10 0.00 0.00 34.13 31.22 2hm9 s GLU 145 CO 0.06 -0.13 1.07 0.34 0.02 0.00 0.00 175.26 176.62 2hm9 s ASP 146 N 1.31 4.06 0.12 -0.19 2.15 -1.26 -4.96 116.67 117.90 2hm9 s ASP 146 Ca 0.04 -0.25 -0.17 0.00 0.43 0.00 0.00 52.55 52.59 2hm9 s ASP 146 Cb -0.14 -0.04 -0.03 0.00 -0.30 0.00 0.00 42.92 42.40 2hm9 s ASP 146 CO -0.02 -2.07 1.68 0.71 -0.17 0.00 0.00 175.17 175.30 2hm9 h THR 147 N -0.78 1.18 -3.07 1.71 1.35 -1.99 -3.42 112.91 107.89 2hm9 h THR 147 Ca -0.38 -0.53 -0.61 0.00 -0.55 0.00 0.00 66.41 64.35 2hm9 h THR 147 Cb 1.26 0.91 -0.07 0.00 -1.73 0.00 0.00 68.15 68.53 2hm9 h THR 147 CO 0.39 0.19 -0.24 0.21 -0.25 0.00 0.00 175.52 175.82 2hm9 s ASN 148 N -5.74 6.69 0.33 5.36 3.84 -1.26 -4.99 114.94 119.17 2hm9 s ASN 148 Ca -0.13 0.82 0.04 0.00 0.21 0.00 0.00 52.86 53.80 2hm9 s ASN 148 Cb 0.09 -2.23 0.66 0.00 -0.55 0.00 0.00 41.25 39.23 2hm9 s ASN 148 CO 0.73 0.25 1.92 1.55 -2.79 0.00 0.00 177.10 178.76 2hm9 h PRO 149 N 5.35 0.84 -0.60 0.43 0.13 -1.95 -0.34 132.00 135.86 2hm9 h PRO 149 Ca -0.49 -0.05 -0.07 0.00 -0.87 0.00 0.00 66.00 64.53 2hm9 h PRO 149 Cb 1.21 -0.19 -0.03 0.00 0.13 0.00 0.00 31.00 32.12 2hm9 h PRO 149 CO 0.65 0.56 0.11 0.00 -0.23 0.00 0.00 178.00 179.09 2hm9 h ALA 150 N 1.56 1.07 -0.21 -0.56 0.00 -1.94 -2.72 119.26 116.47 2hm9 h ALA 150 Ca 0.38 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 2hm9 h ALA 150 Cb 0.34 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2hm9 h ALA 150 CO -0.15 0.61 -0.30 -0.07 0.00 0.00 0.00 179.25 179.34 2hm9 h LEU 151 N 0.91 0.42 -9.80 0.00 3.38 -1.50 -3.24 115.31 105.48 2hm9 h LEU 151 Ca 0.19 -0.15 -0.54 0.00 0.09 0.00 0.00 57.88 57.47 2hm9 h LEU 151 Cb 0.37 -0.12 0.09 0.00 0.09 0.00 0.00 40.66 41.09 2hm9 h LEU 151 CO 0.01 0.71 0.86 0.41 0.09 0.00 0.00 178.44 180.52 2hm9 n THR 152 N -4.10 1.11 -3.99 0.22 -1.04 -0.42 -4.65 114.28 101.42 2hm9 n THR 152 Ca -0.01 -0.28 -0.09 0.00 -2.04 0.00 0.00 64.05 61.63 2hm9 n THR 152 Cb 0.43 -1.95 -0.08 0.00 -1.82 0.00 0.00 70.33 66.91 2hm9 n THR 152 CO 0.00 0.00 0.00 -1.38 -0.64 0.00 0.00 175.07 173.05 2hm9 s HIS 153 N -0.11 0.44 0.11 -1.42 -3.43 -0.87 -2.44 115.29 107.56 2hm9 s HIS 153 Ca 0.63 -0.85 0.05 0.00 -0.80 0.00 0.00 55.06 54.10 2hm9 s HIS 153 Cb -0.50 -0.18 -0.04 0.00 -1.43 0.00 0.00 32.58 30.43 2hm9 s HIS 153 CO 0.50 -0.59 -0.14 0.99 -2.00 0.00 0.00 174.74 173.51 2hm9 s THR 154 N -3.95 1.22 -0.15 -5.38 2.01 -0.64 -1.59 115.64 107.16 2hm9 s THR 154 Ca 0.14 -1.61 -0.01 0.00 0.31 0.00 0.00 61.69 60.51 2hm9 s THR 154 Cb 0.05 -1.40 -0.01 0.00 0.01 0.00 0.00 72.50 71.14 2hm9 s THR 154 CO -0.04 -0.39 -0.11 -0.31 -0.69 0.00 0.00 174.62 173.08 2hm9 s TYR 155 N -1.99 2.86 -0.03 4.92 2.02 0.30 -2.15 117.35 123.27 2hm9 s TYR 155 Ca 0.06 -0.70 0.04 0.00 -0.37 0.00 0.00 57.07 56.10 2hm9 s TYR 155 Cb -0.06 -1.91 -0.01 0.00 -0.40 0.00 0.00 41.96 39.59 2hm9 s TYR 155 CO 0.02 -0.28 -0.16 -1.21 -1.57 0.00 0.00 175.55 172.35 2hm9 s GLU 156 N 0.60 1.60 -0.12 -0.62 2.02 -0.78 0.11 118.70 121.49 2hm9 s GLU 156 Ca -0.07 -0.58 0.03 0.00 0.02 0.00 0.00 54.97 54.38 2hm9 s GLU 156 Cb -0.15 -1.43 0.01 0.00 0.10 0.00 0.00 34.13 32.65 2hm9 s GLU 156 CO 0.03 0.26 -0.22 0.08 0.02 0.00 0.00 175.26 175.43 2hm9 s VAL 157 N -0.06 2.03 -0.01 2.63 1.01 0.42 -1.61 120.40 124.82 2hm9 s VAL 157 Ca -0.01 -0.98 0.04 0.00 0.00 0.00 0.00 61.98 61.03 2hm9 s VAL 157 Cb -0.10 -1.78 -0.03 0.00 0.00 0.00 0.00 36.38 34.47 2hm9 s VAL 157 CO 0.01 0.55 -0.13 0.26 0.00 0.00 0.00 175.10 175.79 2hm9 s TRP 158 N 0.63 2.72 -0.09 5.22 0.52 0.69 -0.94 118.94 127.68 2hm9 s TRP 158 Ca -0.12 -0.15 0.04 0.00 0.02 0.00 0.00 56.10 55.89 2hm9 s TRP 158 Cb -0.17 -1.57 0.00 0.00 -1.15 0.00 0.00 33.47 30.58 2hm9 s TRP 158 CO 0.03 0.26 -0.23 -0.65 0.02 0.00 0.00 176.95 176.38 2hm9 s GLN 159 N -1.14 2.88 0.24 4.98 -0.21 -0.88 0.19 119.66 125.72 2hm9 s GLN 159 Ca 0.14 -0.83 -0.30 0.00 0.02 0.00 0.00 55.36 54.39 2hm9 s GLN 159 Cb -0.11 -2.20 -0.10 0.00 1.00 0.00 0.00 33.01 31.61 2hm9 s GLN 159 CO 0.04 0.18 1.38 0.21 -2.12 0.00 0.00 175.29 174.98 2hm9 s LYS 160 N 0.34 4.32 -0.04 2.91 2.36 -0.88 -2.89 119.74 125.87 2hm9 s LYS 160 Ca -0.18 2.21 0.07 0.00 -2.55 0.00 0.00 55.97 55.53 2hm9 s LYS 160 Cb -0.17 -3.13 -0.01 0.00 -1.05 0.00 0.00 37.83 33.46 2hm9 s LYS 160 CO 0.08 -0.34 -0.24 -1.59 1.55 0.00 0.00 175.35 174.81 2hm9 s LYS 161 N -0.48 2.21 0.00 4.03 -2.85 -1.25 -4.98 119.74 116.41 2hm9 s LYS 161 Ca 0.57 -0.88 0.00 0.00 -1.00 0.00 0.00 55.97 54.66 2hm9 s LYS 161 Cb -0.40 -2.01 0.00 0.00 -2.06 0.00 0.00 37.83 33.36 2hm9 s LYS 161 CO 0.43 0.46 0.00 0.00 0.10 0.00 0.00 175.35 176.34