#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 1.41 -0.28 2.41 0.00 0.48 -2.12 121.76 123.66 2hm9 s ALA 2 Ca 0.00 -0.95 -0.08 0.00 0.00 0.00 0.00 51.96 50.94 2hm9 s ALA 2 Cb 0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 23.12 22.88 2hm9 s ALA 2 CO 0.00 0.28 0.09 -0.06 0.00 0.00 0.00 175.76 176.07 2hm9 s PHE 3 N -0.89 3.12 -0.22 0.00 0.40 0.10 0.11 117.98 120.60 2hm9 s PHE 3 Ca 0.04 -0.63 0.02 0.00 -0.60 0.00 0.00 56.93 55.75 2hm9 s PHE 3 Cb -0.08 -2.27 0.04 0.00 0.51 0.00 0.00 43.02 41.22 2hm9 s PHE 3 CO 0.02 -0.45 -0.15 -1.17 0.70 0.00 0.00 175.22 174.17 2hm9 s LEU 4 N 1.58 2.78 0.18 -0.37 2.96 -1.03 0.12 118.68 124.90 2hm9 s LEU 4 Ca 0.05 -1.03 -0.19 0.00 -0.22 0.00 0.00 54.13 52.74 2hm9 s LEU 4 Cb -0.16 -1.50 0.04 0.00 0.50 0.00 0.00 46.19 45.07 2hm9 s LEU 4 CO 0.04 -0.10 0.53 -1.66 -1.32 0.00 0.00 176.35 173.84 2hm9 s TRP 5 N 1.20 -0.22 -0.03 5.38 -2.14 -1.10 -4.37 118.94 117.66 2hm9 s TRP 5 Ca -0.02 -0.10 0.04 0.00 2.66 0.00 0.00 56.10 58.68 2hm9 s TRP 5 Cb -0.17 0.43 -0.01 0.00 -3.10 0.00 0.00 33.47 30.63 2hm9 s TRP 5 CO -0.09 -0.90 -0.15 0.00 -2.66 0.00 0.00 176.95 173.15 2hm9 s ALA 6 N -3.84 1.35 0.04 2.67 0.00 -1.26 -2.52 121.76 118.20 2hm9 s ALA 6 Ca 0.07 -0.63 -0.04 0.00 0.00 0.00 0.00 51.96 51.36 2hm9 s ALA 6 Cb -0.01 -0.42 -0.02 0.00 0.00 0.00 0.00 23.12 22.67 2hm9 s ALA 6 CO -0.05 0.27 0.05 1.14 0.00 0.00 0.00 175.76 177.17 2hm9 s GLN 7 N -0.07 0.59 0.83 0.00 -2.07 0.82 -4.58 119.66 115.17 2hm9 s GLN 7 Ca -0.00 -0.89 -0.07 0.00 -1.82 0.00 0.00 55.36 52.57 2hm9 s GLN 7 Cb -0.09 0.22 0.16 0.00 -1.09 0.00 0.00 33.01 32.21 2hm9 s GLN 7 CO 0.01 -0.14 1.14 0.16 -1.32 0.00 0.00 175.29 175.14 2hm9 s ASP 8 N -2.35 3.79 0.20 12.60 1.47 -0.72 -3.00 116.67 128.67 2hm9 s ASP 8 Ca -0.02 -0.10 -0.10 0.00 1.18 0.00 0.00 52.55 53.51 2hm9 s ASP 8 Cb 0.01 -0.12 0.15 0.00 -0.34 0.00 0.00 42.92 42.61 2hm9 s ASP 8 CO -0.06 -2.26 1.85 0.08 0.68 0.00 0.00 175.17 175.46 2hm9 h ARG 9 N -1.02 1.00 -0.88 2.11 0.11 -1.71 -2.69 114.38 111.29 2hm9 h ARG 9 Ca -0.40 -0.08 0.01 0.00 0.10 0.00 0.00 59.98 59.61 2hm9 h ARG 9 Cb 1.25 -0.21 -0.04 0.00 1.11 0.00 0.00 29.97 32.08 2hm9 h ARG 9 CO 0.39 0.70 0.58 -0.44 0.10 0.00 0.00 179.97 181.30 2hm9 h ASP 10 N 1.01 1.02 0.00 0.08 5.19 -1.91 -3.46 116.42 118.35 2hm9 h ASP 10 Ca 0.27 -0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.65 2hm9 h ASP 10 Cb -0.05 -0.26 0.00 0.00 0.18 0.00 0.00 39.33 39.20 2hm9 h ASP 10 CO -0.05 0.74 0.00 0.61 -3.12 0.00 0.00 179.24 177.42 2hm9 n GLY 11 N -1.33 0.81 3.82 2.75 0.00 -1.01 -5.12 105.19 105.10 2hm9 n GLY 11 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 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 4.48 -0.07 0.99 2.96 -1.26 -2.77 118.68 123.01 2hm9 s LEU 12 Ca 0.00 1.22 0.01 0.00 -0.22 0.00 0.00 54.13 55.13 2hm9 s LEU 12 Cb 0.00 -2.98 -0.26 0.00 0.50 0.00 0.00 46.19 43.45 2hm9 s LEU 12 CO 0.00 0.23 0.58 0.16 -1.32 0.00 0.00 176.35 176.01 2hm9 h ILE 13 N 3.37 0.82 0.00 6.68 3.07 -1.77 -1.90 117.51 127.77 2hm9 h ILE 13 Ca -0.49 -2.57 0.00 0.00 1.55 0.00 0.00 64.86 63.35 2hm9 h ILE 13 Cb 1.21 2.54 0.00 0.00 -0.27 0.00 0.00 36.82 40.30 2hm9 h ILE 13 CO 0.64 0.74 0.00 0.61 -1.05 0.00 0.00 178.15 179.09 2hm9 n GLY 14 N 1.77 -0.57 2.93 0.16 0.00 -1.09 -4.69 105.19 103.71 2hm9 n GLY 14 Ca -0.23 -0.61 -0.16 0.00 0.00 0.00 0.00 46.02 45.02 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 -1.59 0.45 -1.91 1.61 2.36 -1.03 -1.22 119.74 118.40 2hm9 s LYS 15 Ca 0.00 -0.15 0.00 0.00 -2.55 0.00 0.00 55.97 53.27 2hm9 s LYS 15 Cb 0.00 -0.45 0.00 0.00 -1.05 0.00 0.00 37.83 36.33 2hm9 s LYS 15 CO 0.00 0.06 0.00 -0.25 1.55 0.00 0.00 175.35 176.71 2hm9 n ASP 16 N 3.19 -5.03 0.00 1.43 8.00 -1.26 -1.67 116.55 121.21 2hm9 n ASP 16 Ca -0.16 0.38 0.00 0.00 0.71 0.00 0.00 54.79 55.72 2hm9 n ASP 16 Cb 0.57 -4.43 0.00 0.00 -0.02 0.00 0.00 41.12 37.24 2hm9 n ASP 16 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2hm9 n GLY 17 N -0.47 2.84 3.85 0.44 0.00 -1.26 -4.94 105.19 105.65 2hm9 n GLY 17 Ca -0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.48 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 -1.55 3.59 -0.22 1.61 -3.43 -0.67 -4.94 115.29 109.68 2hm9 s HIS 18 Ca 0.00 0.96 -0.28 0.00 -0.80 0.00 0.00 55.06 54.94 2hm9 s HIS 18 Cb 0.00 -2.29 -0.04 0.00 -1.43 0.00 0.00 32.58 28.81 2hm9 s HIS 18 CO 0.00 0.46 2.05 -0.51 -2.00 0.00 0.00 174.74 174.73 2hm9 s LEU 19 N -1.96 3.58 0.31 5.38 1.43 -1.26 -2.47 118.68 123.70 2hm9 s LEU 19 Ca 0.36 1.80 0.16 0.00 -1.03 0.00 0.00 54.13 55.42 2hm9 s LEU 19 Cb -0.15 -3.52 0.39 0.00 0.03 0.00 0.00 46.19 42.95 2hm9 s LEU 19 CO 0.19 -1.76 1.60 1.55 0.23 0.00 0.00 176.35 178.15 2hm9 h PRO 20 N 13.79 0.00 -6.41 1.29 0.13 -1.85 -3.44 132.00 135.50 2hm9 h PRO 20 Ca -0.39 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.20 2hm9 h PRO 20 Cb 1.21 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.31 2hm9 h PRO 20 CO 0.98 0.49 0.23 1.67 -0.23 0.00 0.00 178.00 181.14 2hm9 s TRP 21 N -3.34 3.78 -0.87 1.56 -2.14 -1.26 -5.00 118.94 111.66 2hm9 s TRP 21 Ca 0.01 1.60 -0.19 0.00 2.66 0.00 0.00 56.10 60.18 2hm9 s TRP 21 Cb 0.10 -2.90 0.13 0.00 -3.10 0.00 0.00 33.47 27.71 2hm9 s TRP 21 CO 0.72 0.27 1.05 -1.58 -2.66 0.00 0.00 176.95 174.75 2hm9 s HIS 22 N -0.13 3.14 -0.55 1.66 2.46 -1.26 -4.92 115.29 115.69 2hm9 s HIS 22 Ca 0.41 -1.35 0.04 0.00 0.47 0.00 0.00 55.06 54.63 2hm9 s HIS 22 Cb -0.22 -4.22 0.17 0.00 -0.13 0.00 0.00 32.58 28.18 2hm9 s HIS 22 CO 0.26 -1.44 0.41 -1.17 -2.47 0.00 0.00 174.74 170.33 2hm9 s LEU 23 N 2.54 3.12 0.47 8.88 2.96 -1.26 -4.96 118.68 130.43 2hm9 s LEU 23 Ca 0.29 -3.42 0.31 0.00 -0.22 0.00 0.00 54.13 51.09 2hm9 s LEU 23 Cb -0.08 -1.04 1.41 0.00 0.50 0.00 0.00 46.19 46.98 2hm9 s LEU 23 CO -0.07 -0.13 1.71 -0.65 -1.32 0.00 0.00 176.35 175.89 2hm9 h PRO 24 N 5.58 0.13 0.37 0.98 0.11 -1.98 -1.01 132.00 136.19 2hm9 h PRO 24 Ca 0.19 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.29 2hm9 h PRO 24 Cb 0.84 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.89 2hm9 h PRO 24 CO 0.54 0.09 -0.45 0.22 -0.21 0.00 0.00 178.00 178.20 2hm9 h ASP 25 N 0.14 -1.25 -0.35 -2.05 1.82 -1.97 0.56 116.42 113.32 2hm9 h ASP 25 Ca 0.70 0.11 -0.06 0.00 -0.39 0.00 0.00 57.03 57.39 2hm9 h ASP 25 Cb 2.34 0.42 -0.02 0.00 0.68 0.00 0.00 39.33 42.75 2hm9 h ASP 25 CO -0.22 -0.56 0.02 -0.78 -1.61 0.00 0.00 179.24 176.09 2hm9 h ASP 26 N -0.83 0.67 -0.66 2.28 1.82 -1.61 -2.42 116.42 115.67 2hm9 h ASP 26 Ca -0.04 -0.14 -0.03 0.00 -0.39 0.00 0.00 57.03 56.42 2hm9 h ASP 26 Cb 0.74 -0.18 -0.03 0.00 0.68 0.00 0.00 39.33 40.54 2hm9 h ASP 26 CO -0.10 0.73 0.30 -0.07 -1.61 0.00 0.00 179.24 178.49 2hm9 h LEU 27 N 0.67 0.88 -0.87 2.28 3.38 -0.93 -1.98 115.31 118.73 2hm9 h LEU 27 Ca 0.14 -0.14 0.03 0.00 0.09 0.00 0.00 57.88 57.99 2hm9 h LEU 27 Cb 0.39 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.86 2hm9 h LEU 27 CO 0.01 0.78 0.56 0.45 0.09 0.00 0.00 178.44 180.34 2hm9 h HIS 28 N 0.93 1.06 -0.42 1.13 3.86 0.50 -2.21 115.15 119.99 2hm9 h HIS 28 Ca 0.23 0.03 0.01 0.00 -1.16 0.00 0.00 60.37 59.47 2hm9 h HIS 28 Cb 0.14 -0.35 -0.02 0.00 1.06 0.00 0.00 27.41 28.24 2hm9 h HIS 28 CO 0.01 0.62 0.27 -0.92 0.86 0.00 0.00 177.93 178.76 2hm9 h TYR 29 N 1.10 0.51 -0.27 2.45 3.20 -0.90 -0.31 116.97 122.76 2hm9 h TYR 29 Ca 0.35 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.22 2hm9 h TYR 29 Cb -0.01 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.08 2hm9 h TYR 29 CO -0.02 0.32 0.15 0.35 -1.64 0.00 0.00 178.16 177.32 2hm9 h PHE 30 N 0.55 0.36 -0.60 -3.82 3.57 -0.90 -1.75 116.94 114.37 2hm9 h PHE 30 Ca 0.16 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.63 2hm9 h PHE 30 Cb -0.05 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 38.54 2hm9 h PHE 30 CO -0.05 0.30 0.29 -0.09 -2.23 0.00 0.00 178.31 176.53 2hm9 h ARG 31 N 0.32 0.86 -0.63 1.11 2.43 -1.20 -2.68 114.38 114.59 2hm9 h ARG 31 Ca 0.09 -0.12 -0.06 0.00 -0.81 0.00 0.00 59.98 59.08 2hm9 h ARG 31 Cb 0.06 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.42 2hm9 h ARG 31 CO -0.02 0.69 0.15 0.00 -1.51 0.00 0.00 179.97 179.28 2hm9 h ALA 32 N 1.12 1.08 -0.12 2.80 0.00 -0.92 -2.79 119.26 120.43 2hm9 h ALA 32 Ca 0.21 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 2hm9 h ALA 32 Cb 0.11 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2hm9 h ALA 32 CO -0.03 0.61 -0.23 1.96 0.00 0.00 0.00 179.25 181.56 2hm9 h GLN 33 N 0.94 0.21 -0.13 0.00 1.08 -1.12 -2.54 115.11 113.54 2hm9 h GLN 33 Ca 0.20 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.34 2hm9 h GLN 33 Cb 0.34 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.75 2hm9 h GLN 33 CO 0.00 0.43 0.00 0.25 -0.95 0.00 0.00 178.83 178.56 2hm9 n THR 34 N -4.19 0.17 -3.17 -0.54 -2.24 -1.03 -4.63 114.28 98.65 2hm9 n THR 34 Ca -0.01 -0.19 -0.40 0.00 -2.27 0.00 0.00 64.05 61.18 2hm9 n THR 34 Cb 0.34 0.07 -0.07 0.00 -2.10 0.00 0.00 70.33 68.57 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 -1.83 5.02 -0.27 2.28 -7.23 -0.96 -3.69 120.40 113.72 2hm9 s VAL 35 Ca 0.15 0.96 0.00 0.00 -1.81 0.00 0.00 61.98 61.28 2hm9 s VAL 35 Cb 0.08 -3.90 0.00 0.00 0.56 0.00 0.00 36.38 33.12 2hm9 s VAL 35 CO 0.11 0.03 0.00 0.61 -0.31 0.00 0.00 175.10 175.53 2hm9 n GLY 36 N 4.32 0.58 3.05 2.32 0.00 -1.23 -5.02 105.19 109.20 2hm9 n GLY 36 Ca -0.02 -0.83 -0.10 0.00 0.00 0.00 0.00 46.02 45.07 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 -1.99 0.49 -0.03 1.61 3.01 -1.24 -4.88 119.74 116.71 2hm9 s LYS 37 Ca 0.00 -0.86 -0.28 0.00 -1.01 0.00 0.00 55.97 53.82 2hm9 s LYS 37 Cb 0.00 -0.02 -0.03 0.00 -1.01 0.00 0.00 37.83 36.77 2hm9 s LYS 37 CO 0.00 -0.03 0.88 0.42 0.51 0.00 0.00 175.35 177.13 2hm9 s ILE 38 N -2.18 4.93 0.06 2.17 1.01 -0.20 -4.06 121.20 122.93 2hm9 s ILE 38 Ca -0.06 1.85 0.05 0.00 0.00 0.00 0.00 60.65 62.48 2hm9 s ILE 38 Cb -0.05 -4.22 -0.03 0.00 0.01 0.00 0.00 42.46 38.17 2hm9 s ILE 38 CO -0.03 0.19 -0.14 -0.32 0.00 0.00 0.00 174.94 174.64 2hm9 s MET 39 N 0.96 0.87 -0.12 2.79 -2.45 -0.98 0.67 119.30 121.03 2hm9 s MET 39 Ca 0.47 -0.90 0.02 0.00 -1.25 0.00 0.00 55.69 54.03 2hm9 s MET 39 Cb -0.20 -0.88 -0.00 0.00 1.25 0.00 0.00 34.83 35.00 2hm9 s MET 39 CO 0.24 0.20 -0.19 0.08 1.05 0.00 0.00 175.02 176.40 2hm9 s VAL 40 N -1.13 2.43 -0.09 10.11 1.01 0.22 -0.75 120.40 132.21 2hm9 s VAL 40 Ca -0.01 -0.87 0.04 0.00 0.00 0.00 0.00 61.98 61.14 2hm9 s VAL 40 Cb -0.09 -1.98 -0.00 0.00 0.00 0.00 0.00 36.38 34.31 2hm9 s VAL 40 CO 0.02 0.54 -0.23 0.68 0.00 0.00 0.00 175.10 176.11 2hm9 s VAL 41 N 0.50 1.97 0.99 2.92 -7.23 0.45 -1.30 120.40 118.70 2hm9 s VAL 41 Ca -0.13 -0.98 -0.13 0.00 -1.81 0.00 0.00 61.98 58.94 2hm9 s VAL 41 Cb -0.17 -1.70 0.19 0.00 0.56 0.00 0.00 36.38 35.26 2hm9 s VAL 41 CO 0.05 0.54 1.10 -0.83 -0.31 0.00 0.00 175.10 175.65 2hm9 s GLY 42 N 0.30 1.56 0.18 2.32 0.00 -0.12 -0.99 107.32 110.57 2hm9 s GLY 42 Ca -0.17 -0.43 -0.12 0.00 0.00 0.00 0.00 44.72 44.00 2hm9 s GLY 42 CO 0.08 0.19 1.80 -0.09 0.00 0.00 0.00 173.10 175.08 2hm9 h ARG 43 N -1.86 0.85 -0.59 2.90 1.12 -1.86 -0.39 114.38 114.55 2hm9 h ARG 43 Ca -0.54 -0.09 0.00 0.00 -1.11 0.00 0.00 59.98 58.24 2hm9 h ARG 43 Cb 1.33 -0.17 -0.03 0.00 -0.01 0.00 0.00 29.97 31.09 2hm9 h ARG 43 CO 0.58 0.63 0.37 0.00 -3.11 0.00 0.00 179.97 178.45 2hm9 h ARG 44 N 0.84 0.78 -0.35 0.20 3.08 -1.92 -1.96 114.38 115.05 2hm9 h ARG 44 Ca 0.22 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.18 2hm9 h ARG 44 Cb 0.02 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 29.88 2hm9 h ARG 44 CO -0.04 0.53 0.10 1.15 -1.07 0.00 0.00 179.97 180.65 2hm9 h THR 45 N 0.80 1.21 -0.56 2.04 2.02 -1.56 -1.19 112.91 115.68 2hm9 h THR 45 Ca 0.21 -0.70 0.11 0.00 0.77 0.00 0.00 66.41 66.80 2hm9 h THR 45 Cb -0.06 1.00 -0.11 0.00 -1.74 0.00 0.00 68.15 67.24 2hm9 h THR 45 CO -0.04 0.24 -0.16 0.22 0.37 0.00 0.00 175.52 176.15 2hm9 h TYR 46 N 0.42 -0.36 0.00 3.16 3.20 -0.32 1.03 116.97 124.11 2hm9 h TYR 46 Ca 0.11 0.05 -0.08 0.00 3.14 0.00 0.00 58.73 61.96 2hm9 h TYR 46 Cb 0.27 0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.77 2hm9 h TYR 46 CO 0.01 -0.26 -0.38 0.93 -1.64 0.00 0.00 178.16 176.82 2hm9 h GLU 47 N -0.02 0.00 0.07 1.82 5.08 -1.45 -3.25 114.58 116.83 2hm9 h GLU 47 Ca 0.27 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.39 2hm9 h GLU 47 Cb 0.43 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.71 2hm9 h GLU 47 CO -0.59 0.38 -0.99 1.03 -1.00 0.00 0.00 179.01 177.84 2hm9 h SER 48 N 0.00 0.74 -2.57 1.42 0.87 0.59 -3.46 113.55 111.14 2hm9 h SER 48 Ca -0.00 -0.81 -0.59 0.00 -1.23 0.00 0.00 61.79 59.15 2hm9 h SER 48 Cb 1.05 -0.23 0.17 0.00 -0.44 0.00 0.00 62.40 62.95 2hm9 h SER 48 CO 0.05 1.47 -0.67 0.33 -0.53 0.00 0.00 176.83 177.48 2hm9 n PHE 49 N -3.96 -1.49 -0.02 2.24 7.35 0.33 -4.90 117.46 117.01 2hm9 n PHE 49 Ca -0.12 0.46 -0.16 0.00 -0.76 0.00 0.00 57.45 56.87 2hm9 n PHE 49 Cb 0.87 -1.86 -0.11 0.00 0.35 0.00 0.00 39.48 38.73 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 0.18 0.28 -2.05 -7.13 0.13 -1.90 -3.46 132.00 118.04 2hm9 h PRO 50 Ca -0.44 -0.27 0.06 0.00 -0.87 0.00 0.00 66.00 64.49 2hm9 h PRO 50 Cb 1.42 0.07 -0.21 0.00 0.13 0.00 0.00 31.00 32.41 2hm9 h PRO 50 CO 0.45 0.95 -0.15 0.21 -0.23 0.00 0.00 178.00 179.23 2hm9 s LYS 51 N -3.33 0.55 0.20 0.86 2.20 -1.26 -5.17 119.74 113.79 2hm9 s LYS 51 Ca -0.15 1.41 0.09 0.00 -0.36 0.00 0.00 55.97 56.96 2hm9 s LYS 51 Cb 0.02 0.82 -0.05 0.00 -1.51 0.00 0.00 37.83 37.12 2hm9 s LYS 51 CO 0.77 -0.21 -0.16 1.03 -0.36 0.00 0.00 175.35 176.42 2hm9 s ARG 52 N 2.86 1.36 0.26 4.03 3.00 -1.26 -4.67 118.95 124.53 2hm9 s ARG 52 Ca -0.06 -1.56 -0.02 0.00 0.00 0.00 0.00 55.73 54.10 2hm9 s ARG 52 Cb -0.12 -1.27 0.05 0.00 0.00 0.00 0.00 34.95 33.61 2hm9 s ARG 52 CO -0.18 0.23 0.36 -0.35 0.00 0.00 0.00 175.30 175.36 2hm9 n PRO 53 N -0.20 0.16 -3.67 3.54 -0.04 -1.26 -4.99 135.00 128.54 2hm9 n PRO 53 Ca -0.09 -0.83 -0.39 0.00 -0.04 0.00 0.00 63.50 62.14 2hm9 n PRO 53 Cb 0.59 -0.28 -0.11 0.00 -0.04 0.00 0.00 33.50 33.66 2hm9 n PRO 53 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2hm9 s LEU 54 N 0.00 4.93 0.54 1.53 1.43 -1.26 -5.08 118.68 120.77 2hm9 s LEU 54 Ca 0.23 -1.47 -0.21 0.00 -1.03 0.00 0.00 54.13 51.65 2hm9 s LEU 54 Cb -0.01 -1.93 -0.06 0.00 0.03 0.00 0.00 46.19 44.21 2hm9 s LEU 54 CO 0.15 -0.48 1.05 -2.65 0.23 0.00 0.00 176.35 174.65 2hm9 n PRO 55 N 4.85 1.18 -1.90 1.29 -0.02 -1.26 -2.53 135.00 136.61 2hm9 n PRO 55 Ca -0.10 0.44 -0.12 0.00 -2.02 0.00 0.00 63.50 61.70 2hm9 n PRO 55 Cb 0.43 -2.21 -0.02 0.00 -0.02 0.00 0.00 33.50 31.68 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 -0.68 -0.91 -3.68 -0.52 1.02 -1.26 -4.98 120.64 109.63 2hm9 n GLU 56 Ca 0.12 0.71 -0.09 0.00 -0.02 0.00 0.00 57.16 57.88 2hm9 n GLU 56 Cb 0.45 -4.82 -0.09 0.00 -0.02 0.00 0.00 31.44 26.95 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 -4.00 0.48 -0.66 3.49 0.52 -1.05 -3.50 118.95 114.22 2hm9 s ARG 57 Ca 0.00 0.95 -0.27 0.00 -0.52 0.00 0.00 55.73 55.89 2hm9 s ARG 57 Cb 0.00 0.08 0.03 0.00 0.52 0.00 0.00 34.95 35.58 2hm9 s ARG 57 CO 0.00 -0.17 1.28 0.99 0.02 0.00 0.00 175.30 177.42 2hm9 s THR 58 N 1.62 3.82 -0.08 0.02 2.01 -1.26 -4.72 115.64 117.06 2hm9 s THR 58 Ca -0.09 0.60 -0.04 0.00 0.31 0.00 0.00 61.69 62.47 2hm9 s THR 58 Cb -0.08 -4.78 -0.04 0.00 0.01 0.00 0.00 72.50 67.61 2hm9 s THR 58 CO -0.15 -1.59 0.10 0.20 -0.69 0.00 0.00 174.62 172.49 2hm9 s ASN 59 N 3.64 5.98 -0.07 3.53 -0.87 -1.26 -2.33 114.94 123.55 2hm9 s ASN 59 Ca 0.40 0.32 0.03 0.00 -1.57 0.00 0.00 52.86 52.04 2hm9 s ASN 59 Cb -0.08 -1.84 0.01 0.00 -0.02 0.00 0.00 41.25 39.32 2hm9 s ASN 59 CO 0.20 0.36 -0.16 -0.69 -2.57 0.00 0.00 177.10 174.24 2hm9 s VAL 60 N -1.05 1.40 -0.31 1.60 1.01 0.07 -0.87 120.40 122.26 2hm9 s VAL 60 Ca 0.17 -0.64 -0.15 0.00 0.00 0.00 0.00 61.98 61.36 2hm9 s VAL 60 Cb -0.12 -1.24 -0.03 0.00 0.00 0.00 0.00 36.38 34.99 2hm9 s VAL 60 CO 0.07 0.41 0.36 -0.69 0.00 0.00 0.00 175.10 175.25 2hm9 s VAL 61 N 0.51 5.18 -0.18 2.92 1.01 0.62 -0.41 120.40 130.04 2hm9 s VAL 61 Ca -0.14 0.28 -0.05 0.00 0.00 0.00 0.00 61.98 62.07 2hm9 s VAL 61 Cb -0.16 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 32.44 2hm9 s VAL 61 CO 0.05 0.03 -0.01 -0.22 0.00 0.00 0.00 175.10 174.95 2hm9 s LEU 62 N 2.03 3.32 0.08 3.92 0.20 -0.16 -1.80 118.68 126.27 2hm9 s LEU 62 Ca 0.13 -0.13 0.04 0.00 0.69 0.00 0.00 54.13 54.86 2hm9 s LEU 62 Cb -0.16 -1.82 -0.03 0.00 -0.43 0.00 0.00 46.19 43.75 2hm9 s LEU 62 CO 0.11 0.13 -0.11 0.28 -0.29 0.00 0.00 176.35 176.47 2hm9 s THR 63 N 0.60 0.92 0.16 3.68 -1.32 -1.17 -2.84 115.64 115.67 2hm9 s THR 63 Ca -0.01 -1.40 -0.11 0.00 -1.21 0.00 0.00 61.69 58.97 2hm9 s THR 63 Cb -0.14 -1.09 0.03 0.00 -1.51 0.00 0.00 72.50 69.79 2hm9 s THR 63 CO 0.02 -0.40 1.60 -0.74 -2.21 0.00 0.00 174.62 172.90 2hm9 h HIS 64 N 4.03 1.08 -2.84 9.09 2.76 -1.90 -3.40 115.15 123.97 2hm9 h HIS 64 Ca -0.38 -0.21 -0.65 0.00 -2.20 0.00 0.00 60.37 56.93 2hm9 h HIS 64 Cb 1.19 -0.27 -0.09 0.00 1.55 0.00 0.00 27.41 29.79 2hm9 h HIS 64 CO 0.64 1.00 -0.49 1.14 -1.30 0.00 0.00 177.93 178.91 2hm9 s GLN 65 N -4.94 3.61 0.00 5.26 -2.07 -1.26 -4.99 119.66 115.28 2hm9 s GLN 65 Ca -0.12 -0.17 0.27 0.00 -1.82 0.00 0.00 55.36 53.52 2hm9 s GLN 65 Cb 0.12 -3.23 1.62 0.00 -1.09 0.00 0.00 33.01 30.44 2hm9 s GLN 65 CO 0.85 0.65 1.99 -0.85 -1.32 0.00 0.00 175.29 176.60 2hm9 n GLU 66 N 2.40 0.89 0.00 9.60 0.00 -1.26 -3.19 120.64 129.08 2hm9 n GLU 66 Ca -0.19 0.00 0.14 0.00 0.00 0.00 0.00 57.16 57.11 2hm9 n GLU 66 Cb 0.54 -1.48 0.46 0.00 0.00 0.00 0.00 31.44 30.96 2hm9 n GLU 66 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.13 176.73 2hm9 n ASP 67 N -0.98 1.55 -4.63 -1.84 5.75 -1.26 -4.85 116.55 110.28 2hm9 n ASP 67 Ca 0.20 -1.44 -0.35 0.00 -0.01 0.00 0.00 54.79 53.20 2hm9 n ASP 67 Cb 0.09 0.03 -0.10 0.00 -1.03 0.00 0.00 41.12 40.12 2hm9 n ASP 67 CO 0.00 0.00 0.00 -0.47 -0.11 0.00 0.00 177.20 176.62 2hm9 s TYR 68 N -2.09 3.26 -0.13 2.11 6.14 -1.19 -5.09 117.35 120.35 2hm9 s TYR 68 Ca 0.35 0.08 -0.03 0.00 0.64 0.00 0.00 57.07 58.10 2hm9 s TYR 68 Cb 0.21 -2.10 -0.03 0.00 0.42 0.00 0.00 41.96 40.45 2hm9 s TYR 68 CO 0.37 0.13 -0.03 -0.65 0.64 0.00 0.00 175.55 176.01 2hm9 s GLN 69 N 0.47 3.41 -0.01 4.97 -1.52 -1.26 -5.00 119.66 120.72 2hm9 s GLN 69 Ca 0.04 -0.49 0.06 0.00 -1.95 0.00 0.00 55.36 53.02 2hm9 s GLN 69 Cb -0.12 -2.86 -0.02 0.00 -0.22 0.00 0.00 33.01 29.79 2hm9 s GLN 69 CO 0.00 0.41 -0.18 0.00 -0.25 0.00 0.00 175.29 175.27 2hm9 s ALA 70 N -0.08 1.53 0.09 6.09 0.00 -1.26 -5.14 121.76 122.98 2hm9 s ALA 70 Ca 0.02 -0.81 0.04 0.00 0.00 0.00 0.00 51.96 51.21 2hm9 s ALA 70 Cb -0.13 -0.38 -0.04 0.00 0.00 0.00 0.00 23.12 22.57 2hm9 s ALA 70 CO 0.02 0.37 0.06 -0.65 0.00 0.00 0.00 175.76 175.56 2hm9 s GLN 71 N -0.51 2.78 0.00 0.00 -1.52 -1.26 -4.53 119.66 114.63 2hm9 s GLN 71 Ca 0.07 -0.75 0.00 0.00 -1.95 0.00 0.00 55.36 52.72 2hm9 s GLN 71 Cb -0.07 -2.66 0.00 0.00 -0.22 0.00 0.00 33.01 30.06 2hm9 s GLN 71 CO -0.00 0.55 0.00 0.41 -0.25 0.00 0.00 175.29 176.00 2hm9 n GLY 72 N 0.42 3.33 2.98 3.09 0.00 -1.26 -4.77 105.19 108.97 2hm9 n GLY 72 Ca -0.09 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.50 -0.21 0.23 4.61 0.00 -1.26 -4.60 121.76 118.03 2hm9 s ALA 73 Ca 0.00 0.17 -0.32 0.00 0.00 0.00 0.00 51.96 51.81 2hm9 s ALA 73 Cb 0.00 -0.11 -0.13 0.00 0.00 0.00 0.00 23.12 22.88 2hm9 s ALA 73 CO 0.00 -0.06 1.57 0.28 0.00 0.00 0.00 175.76 177.55 2hm9 n VAL 74 N 2.83 0.52 -3.44 0.00 0.31 -0.05 -3.58 118.33 114.92 2hm9 n VAL 74 Ca -0.14 -0.13 -0.40 0.00 -0.01 0.00 0.00 64.34 63.66 2hm9 n VAL 74 Cb 0.59 -1.74 -0.10 0.00 -0.91 0.00 0.00 33.84 31.68 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 0.47 5.20 -0.09 2.52 1.01 -1.25 0.23 120.40 128.48 2hm9 s VAL 75 Ca 0.71 0.06 0.03 0.00 0.00 0.00 0.00 61.98 62.78 2hm9 s VAL 75 Cb -0.58 -3.77 0.01 0.00 0.00 0.00 0.00 36.38 32.04 2hm9 s VAL 75 CO 0.43 -0.02 -0.19 0.68 0.00 0.00 0.00 175.10 175.99 2hm9 s VAL 76 N 1.95 1.68 -2.04 2.92 -7.23 -0.74 -4.98 120.40 111.95 2hm9 s VAL 76 Ca 0.11 -0.79 0.18 0.00 -1.81 0.00 0.00 61.98 59.68 2hm9 s VAL 76 Cb -0.17 -1.48 0.08 0.00 0.56 0.00 0.00 36.38 35.37 2hm9 s VAL 76 CO 0.11 0.48 1.02 1.41 -0.31 0.00 0.00 175.10 177.81 2hm9 n HIS 77 N 3.76 0.00 -3.69 2.82 8.25 -1.26 -3.04 115.22 122.06 2hm9 n HIS 77 Ca -0.20 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 56.89 2hm9 n HIS 77 Cb 0.52 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.53 2hm9 n HIS 77 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2hm9 s ASP 78 N -1.79 5.87 0.17 0.41 1.11 -1.26 -4.88 116.67 116.29 2hm9 s ASP 78 Ca 0.19 0.01 -0.13 0.00 0.18 0.00 0.00 52.55 52.80 2hm9 s ASP 78 Cb 0.15 -2.07 0.07 0.00 1.07 0.00 0.00 42.92 42.14 2hm9 s ASP 78 CO 0.33 0.02 1.75 0.58 1.18 0.00 0.00 175.17 179.03 2hm9 h VAL 79 N 5.21 1.21 -0.55 -1.27 2.07 -1.97 -2.14 116.25 118.81 2hm9 h VAL 79 Ca -0.37 -0.60 -0.03 0.00 0.82 0.00 0.00 66.70 66.53 2hm9 h VAL 79 Cb 1.18 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 31.48 2hm9 h VAL 79 CO 0.61 0.24 0.23 0.00 0.02 0.00 0.00 177.57 178.67 2hm9 h ALA 80 N 1.10 1.37 -0.65 1.67 0.00 -2.00 -2.43 119.26 118.31 2hm9 h ALA 80 Ca 0.19 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 2hm9 h ALA 80 Cb 0.13 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2hm9 h ALA 80 CO -0.02 0.48 0.24 0.00 0.00 0.00 0.00 179.25 179.95 2hm9 h ALA 81 N 1.47 1.21 -0.55 0.00 0.00 -1.81 -0.98 119.26 118.59 2hm9 h ALA 81 Ca 0.19 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 2hm9 h ALA 81 Cb 0.14 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2hm9 h ALA 81 CO -0.02 0.57 0.19 0.28 0.00 0.00 0.00 179.25 180.27 2hm9 h VAL 82 N 0.94 1.23 -0.48 0.00 2.07 -0.99 0.22 116.25 119.25 2hm9 h VAL 82 Ca 0.22 -0.75 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 2hm9 h VAL 82 Cb 0.20 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 2hm9 h VAL 82 CO -0.02 0.28 0.26 -0.26 0.02 0.00 0.00 177.57 177.86 2hm9 h PHE 83 N 0.75 0.65 -0.58 1.57 0.04 -1.32 -2.57 116.94 115.47 2hm9 h PHE 83 Ca 0.18 -0.01 -0.05 0.00 2.80 0.00 0.00 57.97 60.88 2hm9 h PHE 83 Cb 0.25 -0.21 -0.03 0.00 2.20 0.00 0.00 35.95 38.16 2hm9 h PHE 83 CO 0.01 0.48 0.15 0.00 -0.60 0.00 0.00 178.31 178.35 2hm9 h ALA 84 N 1.11 1.17 -0.29 2.45 0.00 -0.71 -2.23 119.26 120.76 2hm9 h ALA 84 Ca 0.17 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2hm9 h ALA 84 Cb 0.04 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2hm9 h ALA 84 CO -0.03 0.57 0.18 -0.92 0.00 0.00 0.00 179.25 179.05 2hm9 h TYR 85 N 0.86 0.37 -0.61 0.00 5.03 -0.21 0.90 116.97 123.32 2hm9 h TYR 85 Ca 0.19 0.00 -0.05 0.00 2.58 0.00 0.00 58.73 61.45 2hm9 h TYR 85 Cb 0.30 -0.12 -0.03 0.00 1.55 0.00 0.00 36.73 38.43 2hm9 h TYR 85 CO 0.02 0.26 0.17 0.00 -1.32 0.00 0.00 178.16 177.29 2hm9 h ALA 86 N 1.08 1.14 -0.46 1.82 0.00 -1.34 -2.13 119.26 119.38 2hm9 h ALA 86 Ca 0.10 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 2hm9 h ALA 86 Cb -0.01 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2hm9 h ALA 86 CO -0.02 0.58 0.13 -0.22 0.00 0.00 0.00 179.25 179.72 2hm9 h LYS 87 N 0.91 0.68 -0.74 0.00 3.64 -0.86 -2.60 116.57 117.60 2hm9 h LYS 87 Ca 0.20 -0.12 -0.05 0.00 -1.27 0.00 0.00 60.65 59.41 2hm9 h LYS 87 Cb 0.29 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.97 2hm9 h LYS 87 CO -0.00 0.61 0.25 0.37 -2.27 0.00 0.00 179.45 178.41 2hm9 h GLN 88 N 0.67 1.12 -3.13 1.90 4.15 -0.16 -3.32 115.11 116.34 2hm9 h GLN 88 Ca 0.15 -0.22 -0.66 0.00 0.77 0.00 0.00 58.65 58.69 2hm9 h GLN 88 Cb 0.23 -0.17 -0.39 0.00 0.21 0.00 0.00 27.48 27.36 2hm9 h GLN 88 CO -0.01 0.94 -0.32 0.72 -1.93 0.00 0.00 178.83 178.24 2hm9 n HIS 89 N -4.26 3.73 0.18 3.99 8.25 -0.98 -4.90 115.22 121.22 2hm9 n HIS 89 Ca 0.06 -4.19 0.08 0.00 -0.26 0.00 0.00 57.72 53.41 2hm9 n HIS 89 Cb 0.21 -0.88 0.60 0.00 1.12 0.00 0.00 29.99 31.05 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 5.58 0.12 -0.40 -0.41 0.11 -1.67 -2.04 132.00 133.29 2hm9 h PRO 90 Ca 0.16 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 66.21 2hm9 h PRO 90 Cb 0.77 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.83 2hm9 h PRO 90 CO 0.80 0.08 0.01 0.22 -0.21 0.00 0.00 178.00 178.90 2hm9 h ASP 91 N 0.12 0.59 -3.44 -2.05 3.58 -1.90 -3.41 116.42 109.91 2hm9 h ASP 91 Ca 0.06 -0.12 -0.63 0.00 0.42 0.00 0.00 57.03 56.76 2hm9 h ASP 91 Cb 0.09 -0.16 -0.18 0.00 1.72 0.00 0.00 39.33 40.80 2hm9 h ASP 91 CO -0.01 0.65 -0.58 -1.58 -2.88 0.00 0.00 179.24 174.84 2hm9 s GLN 92 N -5.00 3.86 0.47 0.28 0.74 -0.77 -5.09 119.66 114.16 2hm9 s GLN 92 Ca -0.08 -0.39 -0.20 0.00 0.05 0.00 0.00 55.36 54.74 2hm9 s GLN 92 Cb 0.15 -3.26 -0.09 0.00 1.10 0.00 0.00 33.01 30.91 2hm9 s GLN 92 CO 0.78 0.11 1.00 -1.21 -0.55 0.00 0.00 175.29 175.41 2hm9 s GLU 93 N 0.83 3.96 -0.19 1.67 2.02 -1.26 -4.81 118.70 120.92 2hm9 s GLU 93 Ca 0.04 1.19 -0.07 0.00 0.02 0.00 0.00 54.97 56.15 2hm9 s GLU 93 Cb -0.14 -2.13 -0.04 0.00 0.10 0.00 0.00 34.13 31.92 2hm9 s GLU 93 CO 0.02 -0.27 0.06 -1.17 0.02 0.00 0.00 175.26 173.92 2hm9 s LEU 94 N -3.51 3.75 -0.07 1.80 2.96 -1.25 -1.03 118.68 121.32 2hm9 s LEU 94 Ca 0.64 0.04 0.04 0.00 -0.22 0.00 0.00 54.13 54.63 2hm9 s LEU 94 Cb -0.12 -1.95 -0.00 0.00 0.50 0.00 0.00 46.19 44.61 2hm9 s LEU 94 CO 0.20 0.14 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.48 2hm9 s VAL 95 N 0.54 1.76 -0.47 1.68 1.01 0.21 0.18 120.40 125.31 2hm9 s VAL 95 Ca 0.03 -0.87 -0.17 0.00 0.00 0.00 0.00 61.98 60.97 2hm9 s VAL 95 Cb -0.13 -1.52 0.05 0.00 0.00 0.00 0.00 36.38 34.79 2hm9 s VAL 95 CO 0.01 0.49 0.50 -0.63 0.00 0.00 0.00 175.10 175.48 2hm9 s ILE 96 N 0.21 5.04 0.29 2.22 -1.09 0.29 0.72 121.20 128.89 2hm9 s ILE 96 Ca -0.11 -0.63 -0.00 0.00 -2.23 0.00 0.00 60.65 57.68 2hm9 s ILE 96 Cb -0.15 -4.17 0.14 0.00 -1.58 0.00 0.00 42.46 36.69 2hm9 s ILE 96 CO 0.05 -0.63 1.81 0.00 -1.23 0.00 0.00 174.94 174.94 2hm9 h ALA 97 N 8.85 1.21 0.00 9.38 0.00 -1.39 -2.72 119.26 134.58 2hm9 h ALA 97 Ca -0.27 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2hm9 h ALA 97 Cb 1.10 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.70 2hm9 h ALA 97 CO 0.89 0.53 0.00 0.41 0.00 0.00 0.00 179.25 181.08 2hm9 n GLY 98 N -0.77 -0.05 0.00 0.00 0.00 -1.25 -4.72 105.19 98.41 2hm9 n GLY 98 Ca 0.03 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.49 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 -0.04 0.35 -0.02 0.00 -1.26 -0.95 105.19 103.26 2hm9 n GLY 99 Ca 0.00 -1.77 -0.01 0.00 0.00 0.00 0.00 46.02 44.23 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 -1.53 1.33 -0.75 4.61 0.00 -1.94 0.98 119.26 121.97 2hm9 h ALA 100 Ca 0.00 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 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 0.56 0.25 0.37 0.00 0.00 0.00 179.25 180.43 2hm9 h GLN 101 N 1.07 1.15 -0.47 0.00 4.15 -1.98 0.33 115.11 119.37 2hm9 h GLN 101 Ca 0.28 -0.24 -0.06 0.00 0.77 0.00 0.00 58.65 59.40 2hm9 h GLN 101 Cb -0.02 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 27.48 2hm9 h GLN 101 CO -0.05 0.97 0.05 0.82 -1.93 0.00 0.00 178.83 178.69 2hm9 h ILE 102 N 1.10 1.25 -0.56 2.39 1.08 -1.46 -2.50 117.51 118.81 2hm9 h ILE 102 Ca 0.24 -0.96 -0.00 0.00 -0.39 0.00 0.00 64.86 63.75 2hm9 h ILE 102 Cb 0.28 0.97 -0.03 0.00 -3.07 0.00 0.00 36.82 34.97 2hm9 h ILE 102 CO -0.01 0.33 0.33 -0.26 -0.69 0.00 0.00 178.15 177.86 2hm9 h PHE 103 N 0.65 0.74 -0.84 1.37 0.04 0.17 -2.68 116.94 116.38 2hm9 h PHE 103 Ca 0.14 -0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.92 2hm9 h PHE 103 Cb 0.42 -0.24 -0.05 0.00 2.20 0.00 0.00 35.95 38.29 2hm9 h PHE 103 CO 0.03 0.51 0.55 1.79 -0.60 0.00 0.00 178.31 180.59 2hm9 h THR 104 N 0.75 1.18 -0.80 -1.55 1.35 -0.18 0.98 112.91 114.64 2hm9 h THR 104 Ca 0.20 -0.38 -0.02 0.00 -0.55 0.00 0.00 66.41 65.66 2hm9 h THR 104 Cb -0.01 -0.02 -0.04 0.00 -1.73 0.00 0.00 68.15 66.35 2hm9 h THR 104 CO -0.04 0.20 0.41 0.00 -0.25 0.00 0.00 175.52 175.84 2hm9 h ALA 105 N 1.33 1.21 -0.41 6.62 0.00 -1.12 -2.91 119.26 123.98 2hm9 h ALA 105 Ca 0.32 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2hm9 h ALA 105 Cb -0.07 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.40 2hm9 h ALA 105 CO -0.09 0.62 0.00 1.19 0.00 0.00 0.00 179.25 180.97 2hm9 n PHE 106 N -4.33 0.54 0.02 0.00 3.72 -1.02 -4.54 117.46 111.86 2hm9 n PHE 106 Ca 0.08 -0.46 0.00 0.00 -0.05 0.00 0.00 57.45 57.03 2hm9 n PHE 106 Cb 0.12 -0.02 0.32 0.00 -0.94 0.00 0.00 39.48 38.96 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 2.63 0.47 -0.40 -1.08 3.64 0.12 -2.93 116.57 119.02 2hm9 h LYS 107 Ca 0.00 -0.10 -0.05 0.00 -1.27 0.00 0.00 60.65 59.24 2hm9 h LYS 107 Cb 0.78 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.51 2hm9 h LYS 107 CO 0.00 0.51 0.05 0.22 -2.27 0.00 0.00 179.45 177.97 2hm9 h ASP 108 N 0.45 0.56 -3.41 4.20 1.82 -1.80 -3.36 116.42 114.88 2hm9 h ASP 108 Ca 0.10 -0.10 -0.61 0.00 -0.39 0.00 0.00 57.03 56.03 2hm9 h ASP 108 Cb 0.33 -0.15 -0.40 0.00 0.68 0.00 0.00 39.33 39.79 2hm9 h ASP 108 CO 0.01 0.59 -0.73 -1.81 -1.61 0.00 0.00 179.24 175.69 2hm9 s ASP 109 N -6.69 3.63 -0.08 2.28 1.01 -1.11 -5.08 116.67 110.64 2hm9 s ASP 109 Ca -0.08 -2.85 0.03 0.00 0.71 0.00 0.00 52.55 50.35 2hm9 s ASP 109 Cb 0.16 -1.10 0.01 0.00 1.01 0.00 0.00 42.92 43.00 2hm9 s ASP 109 CO 0.77 -0.23 -0.16 -0.69 0.21 0.00 0.00 175.17 175.07 2hm9 s VAL 110 N 0.05 1.46 0.05 -1.27 1.01 -1.25 -4.83 120.40 115.61 2hm9 s VAL 110 Ca 0.20 -0.66 -0.15 0.00 0.00 0.00 0.00 61.98 61.37 2hm9 s VAL 110 Cb -0.19 -1.31 -0.30 0.00 0.00 0.00 0.00 36.38 34.58 2hm9 s VAL 110 CO -0.04 0.43 1.08 -0.78 0.00 0.00 0.00 175.10 175.79 2hm9 h ASP 111 N 6.99 0.87 -3.57 3.32 3.58 -1.80 -3.37 116.42 122.44 2hm9 h ASP 111 Ca -0.28 -0.84 -0.52 0.00 0.42 0.00 0.00 57.03 55.81 2hm9 h ASP 111 Cb 1.20 -0.28 -0.33 0.00 1.72 0.00 0.00 39.33 41.65 2hm9 h ASP 111 CO 0.48 1.63 -0.82 -0.89 -2.88 0.00 0.00 179.24 176.75 2hm9 s THR 112 N -2.92 1.21 -0.17 2.25 2.01 -1.01 -2.20 115.64 114.80 2hm9 s THR 112 Ca -0.10 -0.55 -0.02 0.00 0.31 0.00 0.00 61.69 61.34 2hm9 s THR 112 Cb 0.05 -1.08 -0.01 0.00 0.01 0.00 0.00 72.50 71.47 2hm9 s THR 112 CO 0.93 0.37 -0.10 -0.76 -0.69 0.00 0.00 174.62 174.37 2hm9 s LEU 113 N 0.45 2.76 -0.17 4.42 1.43 0.21 0.01 118.68 127.80 2hm9 s LEU 113 Ca -0.11 -0.36 -0.00 0.00 -1.03 0.00 0.00 54.13 52.63 2hm9 s LEU 113 Cb -0.14 -1.65 0.00 0.00 0.03 0.00 0.00 46.19 44.43 2hm9 s LEU 113 CO 0.03 0.09 -0.15 -0.76 0.23 0.00 0.00 176.35 175.80 2hm9 s LEU 114 N 0.80 2.45 -0.03 1.79 1.43 0.32 -0.37 118.68 125.07 2hm9 s LEU 114 Ca -0.04 -0.51 0.03 0.00 -1.03 0.00 0.00 54.13 52.58 2hm9 s LEU 114 Cb -0.15 -1.57 0.00 0.00 0.03 0.00 0.00 46.19 44.50 2hm9 s LEU 114 CO 0.01 0.04 -0.11 0.54 0.23 0.00 0.00 176.35 177.06 2hm9 s VAL 115 N 1.06 0.97 -0.17 -1.59 0.11 -0.74 -2.73 120.40 117.32 2hm9 s VAL 115 Ca -0.01 -0.45 -0.03 0.00 -2.93 0.00 0.00 61.98 58.57 2hm9 s VAL 115 Cb -0.14 -0.86 -0.02 0.00 -1.53 0.00 0.00 36.38 33.83 2hm9 s VAL 115 CO -0.04 0.30 -0.06 -0.89 -3.33 0.00 0.00 175.10 171.07 2hm9 s THR 116 N 0.24 3.53 -0.09 5.04 2.01 -1.05 -1.90 115.64 123.41 2hm9 s THR 116 Ca -0.05 -0.48 0.03 0.00 0.31 0.00 0.00 61.69 61.51 2hm9 s THR 116 Cb -0.10 -2.55 -0.01 0.00 0.01 0.00 0.00 72.50 69.85 2hm9 s THR 116 CO 0.01 0.48 -0.20 -0.60 -0.69 0.00 0.00 174.62 173.62 2hm9 s ARG 117 N 0.69 2.96 -0.16 4.92 3.52 -0.87 -0.13 118.95 129.88 2hm9 s ARG 117 Ca -0.03 -0.82 -0.05 0.00 -0.13 0.00 0.00 55.73 54.70 2hm9 s ARG 117 Cb -0.15 -2.36 -0.03 0.00 -1.56 0.00 0.00 34.95 30.85 2hm9 s ARG 117 CO 0.02 0.28 -0.01 -0.51 -0.81 0.00 0.00 175.30 174.28 2hm9 s LEU 118 N 0.11 3.44 0.26 -0.88 1.02 -1.16 -1.49 118.68 119.97 2hm9 s LEU 118 Ca -0.10 -0.05 -0.04 0.00 0.02 0.00 0.00 54.13 53.96 2hm9 s LEU 118 Cb -0.16 -1.84 0.31 0.00 0.02 0.00 0.00 46.19 44.52 2hm9 s LEU 118 CO 0.06 0.18 1.83 0.00 0.02 0.00 0.00 176.35 178.44 2hm9 h ALA 119 N 6.65 1.18 -2.71 4.21 0.00 -1.67 -2.85 119.26 124.06 2hm9 h ALA 119 Ca -0.33 -0.18 -0.50 0.00 0.00 0.00 0.00 54.91 53.90 2hm9 h ALA 119 Cb 1.18 -0.28 0.04 0.00 0.00 0.00 0.00 17.79 18.73 2hm9 h ALA 119 CO 0.65 0.60 0.48 0.20 0.00 0.00 0.00 179.25 181.18 2hm9 s GLY 120 N -3.46 2.89 0.46 0.00 0.00 -1.24 -4.77 107.32 101.20 2hm9 s GLY 120 Ca -0.11 0.91 -0.21 0.00 0.00 0.00 0.00 44.72 45.30 2hm9 s GLY 120 CO 0.82 1.43 1.04 -0.45 0.00 0.00 0.00 173.10 175.94 2hm9 s SER 121 N -1.14 6.47 0.06 1.64 0.15 -1.26 -4.42 113.70 115.20 2hm9 s SER 121 Ca 0.54 1.96 0.03 0.00 0.70 0.00 0.00 55.95 59.18 2hm9 s SER 121 Cb -0.30 -2.57 -0.03 0.00 -1.71 0.00 0.00 66.02 61.42 2hm9 s SER 121 CO 0.37 -0.70 -0.09 -0.36 1.20 0.00 0.00 173.24 173.67 2hm9 s PHE 122 N -1.89 0.82 -0.04 3.44 0.40 -1.26 -5.06 117.98 114.39 2hm9 s PHE 122 Ca 0.65 -0.57 0.07 0.00 -0.60 0.00 0.00 56.93 56.48 2hm9 s PHE 122 Cb -0.18 -0.48 -0.02 0.00 0.51 0.00 0.00 43.02 42.86 2hm9 s PHE 122 CO 0.22 -0.06 -0.25 -1.21 0.70 0.00 0.00 175.22 174.62 2hm9 s GLU 123 N -2.03 2.36 0.17 0.44 2.02 -1.26 -4.88 118.70 115.53 2hm9 s GLU 123 Ca -0.04 -0.91 -0.24 0.00 0.02 0.00 0.00 54.97 53.80 2hm9 s GLU 123 Cb -0.07 -2.12 0.06 0.00 0.10 0.00 0.00 34.13 32.10 2hm9 s GLU 123 CO -0.00 0.46 0.85 0.20 0.02 0.00 0.00 175.26 176.80 2hm9 s GLY 124 N -0.37 -0.25 0.00 -1.39 0.00 -1.26 -4.81 107.32 99.24 2hm9 s GLY 124 Ca 0.03 0.12 0.27 0.00 0.00 0.00 0.00 44.72 45.14 2hm9 s GLY 124 CO 0.02 0.02 1.60 1.22 0.00 0.00 0.00 173.10 175.96 2hm9 n ASP 125 N -0.44 1.13 -4.20 1.64 9.92 -1.18 -4.83 116.55 118.60 2hm9 n ASP 125 Ca -0.07 -1.02 -0.32 0.00 -0.53 0.00 0.00 54.79 52.85 2hm9 n ASP 125 Cb 0.61 0.11 -0.17 0.00 -0.64 0.00 0.00 41.12 41.02 2hm9 n ASP 125 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 2hm9 s THR 126 N -2.40 2.04 0.13 -3.53 2.01 -0.36 -4.86 115.64 108.68 2hm9 s THR 126 Ca 0.27 -1.00 0.08 0.00 0.31 0.00 0.00 61.69 61.36 2hm9 s THR 126 Cb 0.20 -1.78 -0.04 0.00 0.01 0.00 0.00 72.50 70.88 2hm9 s THR 126 CO 0.48 0.55 -0.14 -0.54 -0.69 0.00 0.00 174.62 174.28 2hm9 s LYS 127 N 0.53 1.93 0.33 4.92 1.02 -1.26 -2.66 119.74 124.56 2hm9 s LYS 127 Ca -0.14 -1.17 -0.28 0.00 0.02 0.00 0.00 55.97 54.40 2hm9 s LYS 127 Cb -0.17 -2.17 -0.09 0.00 -0.52 0.00 0.00 37.83 34.88 2hm9 s LYS 127 CO 0.05 0.47 1.13 1.41 -0.92 0.00 0.00 175.35 177.49 2hm9 s MET 128 N -2.33 4.41 0.60 1.68 1.75 -1.11 -4.75 119.30 119.53 2hm9 s MET 128 Ca 0.21 1.81 -0.18 0.00 -1.25 0.00 0.00 55.69 56.28 2hm9 s MET 128 Cb -0.10 -2.96 -0.03 0.00 2.84 0.00 0.00 34.83 34.58 2hm9 s MET 128 CO 0.12 -0.00 1.15 0.96 -0.65 0.00 0.00 175.02 176.60 2hm9 s ILE 129 N -1.29 2.96 0.46 10.11 -5.25 -1.26 -4.96 121.20 121.97 2hm9 s ILE 129 Ca 0.50 0.55 -0.25 0.00 -0.99 0.00 0.00 60.65 60.46 2hm9 s ILE 129 Cb -0.31 -3.16 -0.08 0.00 2.95 0.00 0.00 42.46 41.86 2hm9 s ILE 129 CO 0.40 -0.18 1.42 -2.16 -1.79 0.00 0.00 174.94 172.64 2hm9 s PRO 130 N -3.53 3.61 0.06 0.37 0.04 -1.26 -5.03 135.00 129.25 2hm9 s PRO 130 Ca 0.73 2.41 0.06 0.00 0.04 0.00 0.00 61.00 64.24 2hm9 s PRO 130 Cb -0.25 -2.60 -0.03 0.00 0.04 0.00 0.00 34.50 31.66 2hm9 s PRO 130 CO 0.33 -0.88 -0.17 -0.51 0.04 0.00 0.00 177.00 175.82 2hm9 s LEU 131 N -2.83 2.22 -0.90 -3.56 1.43 -1.26 -5.08 118.68 108.71 2hm9 s LEU 131 Ca 0.62 -0.55 -0.18 0.00 -1.03 0.00 0.00 54.13 52.99 2hm9 s LEU 131 Cb -0.44 -0.73 0.15 0.00 0.03 0.00 0.00 46.19 45.20 2hm9 s LEU 131 CO 0.56 0.05 1.04 0.20 0.23 0.00 0.00 176.35 178.42 2hm9 s ASN 132 N -1.43 6.64 0.25 2.29 0.01 -1.26 -4.86 114.94 116.58 2hm9 s ASN 132 Ca 0.03 -2.14 -0.05 0.00 -0.71 0.00 0.00 52.86 50.00 2hm9 s ASN 132 Cb -0.09 -2.36 0.28 0.00 0.41 0.00 0.00 41.25 39.49 2hm9 s ASN 132 CO 0.02 -0.97 1.83 -0.50 -1.51 0.00 0.00 177.10 175.97 2hm9 h TRP 133 N 8.65 1.10 -0.40 2.20 4.06 -1.99 -2.77 115.95 126.79 2hm9 h TRP 133 Ca 0.13 -0.06 -0.05 0.00 2.06 0.00 0.00 58.89 60.97 2hm9 h TRP 133 Cb 1.03 -0.34 -0.02 0.00 -1.00 0.00 0.00 29.16 28.83 2hm9 h TRP 133 CO 1.13 0.82 0.05 0.38 -3.56 0.00 0.00 178.44 177.25 2hm9 h ASP 134 N 1.08 0.58 -0.20 -3.49 2.03 -2.04 -2.68 116.42 111.68 2hm9 h ASP 134 Ca 0.26 -0.10 -0.06 0.00 -0.73 0.00 0.00 57.03 56.39 2hm9 h ASP 134 Cb 0.16 -0.15 -0.02 0.00 -0.83 0.00 0.00 39.33 38.49 2hm9 h ASP 134 CO -0.03 0.61 -0.05 0.44 -1.03 0.00 0.00 179.24 179.18 2hm9 h ASP 135 N 0.60 0.50 -3.26 4.15 3.32 -1.91 -3.42 116.42 116.40 2hm9 h ASP 135 Ca 0.13 -0.11 -0.68 0.00 0.02 0.00 0.00 57.03 56.39 2hm9 h ASP 135 Cb 0.30 -0.13 -0.14 0.00 0.22 0.00 0.00 39.33 39.58 2hm9 h ASP 135 CO 0.00 0.61 -0.61 -0.36 -1.72 0.00 0.00 179.24 177.17 2hm9 s PHE 136 N -4.87 3.20 -0.16 4.55 0.40 -1.01 -4.00 117.98 116.08 2hm9 s PHE 136 Ca -0.07 0.21 -0.03 0.00 -0.60 0.00 0.00 56.93 56.43 2hm9 s PHE 136 Cb 0.15 -1.79 -0.02 0.00 0.51 0.00 0.00 43.02 41.87 2hm9 s PHE 136 CO 0.77 0.50 -0.04 0.99 0.70 0.00 0.00 175.22 178.14 2hm9 s THR 137 N -0.93 3.78 0.18 0.64 2.01 -1.14 -4.83 115.64 115.34 2hm9 s THR 137 Ca 0.14 -0.39 -0.32 0.00 0.31 0.00 0.00 61.69 61.43 2hm9 s THR 137 Cb -0.11 -2.66 -0.10 0.00 0.01 0.00 0.00 72.50 69.63 2hm9 s THR 137 CO 0.04 0.48 1.60 -0.75 -0.69 0.00 0.00 174.62 175.30 2hm9 s LYS 138 N 0.52 4.19 -0.18 4.92 2.20 -1.26 -2.08 119.74 128.05 2hm9 s LYS 138 Ca -0.04 2.42 -0.14 0.00 -0.36 0.00 0.00 55.97 57.86 2hm9 s LYS 138 Cb -0.14 -3.13 -0.22 0.00 -1.51 0.00 0.00 37.83 32.83 2hm9 s LYS 138 CO 0.03 -0.64 0.22 1.33 -0.36 0.00 0.00 175.35 175.93 2hm9 n VAL 139 N 3.93 1.64 -3.62 4.02 0.24 -0.12 -4.90 118.33 119.53 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 0.38 -1.87 -0.03 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 -6.97 -0.40 0.11 -1.34 0.01 -1.19 -5.05 113.70 98.87 2hm9 s SER 140 Ca -0.27 -0.28 -0.22 0.00 1.31 0.00 0.00 55.95 56.49 2hm9 s SER 140 Cb 0.07 0.62 0.06 0.00 0.21 0.00 0.00 66.02 66.98 2hm9 s SER 140 CO 0.66 -1.08 0.53 -0.55 0.41 0.00 0.00 173.24 173.22 2hm9 s SER 141 N -2.82 -0.46 0.01 2.44 0.15 -1.26 -0.86 113.70 110.90 2hm9 s SER 141 Ca 0.06 0.01 0.02 0.00 0.70 0.00 0.00 55.95 56.74 2hm9 s SER 141 Cb -0.02 0.54 -0.01 0.00 -1.71 0.00 0.00 66.02 64.82 2hm9 s SER 141 CO -0.06 -0.85 -0.07 -0.60 1.20 0.00 0.00 173.24 172.86 2hm9 s ARG 142 N -3.27 0.54 -0.14 5.44 6.06 0.19 -4.99 118.95 122.78 2hm9 s ARG 142 Ca -0.01 -0.38 0.01 0.00 -2.50 0.00 0.00 55.73 52.84 2hm9 s ARG 142 Cb -0.00 -0.47 -0.00 0.00 0.06 0.00 0.00 34.95 34.53 2hm9 s ARG 142 CO -0.08 0.12 -0.16 0.99 -2.50 0.00 0.00 175.30 173.67 2hm9 s THR 143 N -0.48 2.70 -0.09 4.11 2.01 -1.26 0.98 115.64 123.61 2hm9 s THR 143 Ca -0.01 -0.77 0.03 0.00 0.31 0.00 0.00 61.69 61.26 2hm9 s THR 143 Cb -0.05 -2.13 0.00 0.00 0.01 0.00 0.00 72.50 70.34 2hm9 s THR 143 CO 0.00 0.52 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.57 2hm9 s VAL 144 N 0.64 1.71 -0.21 3.82 1.01 -0.64 -5.01 120.40 121.72 2hm9 s VAL 144 Ca -0.08 -0.81 -0.04 0.00 0.00 0.00 0.00 61.98 61.04 2hm9 s VAL 144 Cb -0.16 -1.49 -0.01 0.00 0.00 0.00 0.00 36.38 34.71 2hm9 s VAL 144 CO 0.03 0.48 -0.03 -1.61 0.00 0.00 0.00 175.10 173.96 2hm9 s GLU 145 N 0.45 3.46 0.77 2.72 2.02 -1.26 -1.86 118.70 125.00 2hm9 s GLU 145 Ca -0.17 -0.59 -0.04 0.00 0.02 0.00 0.00 54.97 54.18 2hm9 s GLU 145 Cb -0.17 -3.01 0.14 0.00 0.10 0.00 0.00 34.13 31.19 2hm9 s GLU 145 CO 0.07 -0.10 1.07 0.34 0.02 0.00 0.00 175.26 176.65 2hm9 s ASP 146 N 1.26 4.09 0.13 -0.19 2.15 -1.26 -4.96 116.67 117.88 2hm9 s ASP 146 Ca 0.03 -0.20 -0.18 0.00 0.43 0.00 0.00 52.55 52.63 2hm9 s ASP 146 Cb -0.14 -0.11 -0.03 0.00 -0.30 0.00 0.00 42.92 42.33 2hm9 s ASP 146 CO -0.01 -2.05 1.73 0.71 -0.17 0.00 0.00 175.17 175.39 2hm9 h THR 147 N -0.77 1.13 -3.01 1.71 1.35 -1.99 -3.43 112.91 107.90 2hm9 h THR 147 Ca -0.38 -0.34 -0.61 0.00 -0.55 0.00 0.00 66.41 64.53 2hm9 h THR 147 Cb 1.26 0.78 -0.05 0.00 -1.73 0.00 0.00 68.15 68.41 2hm9 h THR 147 CO 0.40 0.13 -0.22 0.20 -0.25 0.00 0.00 175.52 175.79 2hm9 s ASN 148 N -5.60 6.78 0.32 5.36 0.01 -1.26 -4.99 114.94 115.55 2hm9 s ASN 148 Ca -0.13 0.93 0.03 0.00 -0.71 0.00 0.00 52.86 52.98 2hm9 s ASN 148 Cb 0.09 -2.24 0.61 0.00 0.41 0.00 0.00 41.25 40.12 2hm9 s ASN 148 CO 0.72 0.31 1.91 1.55 -1.51 0.00 0.00 177.10 180.08 2hm9 h PRO 149 N 4.60 0.91 -0.65 -0.60 0.13 -1.95 -1.29 132.00 133.15 2hm9 h PRO 149 Ca -0.51 -0.05 -0.07 0.00 -0.87 0.00 0.00 66.00 64.49 2hm9 h PRO 149 Cb 1.22 -0.20 -0.03 0.00 0.13 0.00 0.00 31.00 32.12 2hm9 h PRO 149 CO 0.62 0.60 0.12 0.00 -0.23 0.00 0.00 178.00 179.11 2hm9 h ALA 150 N 1.54 1.00 -0.25 -0.56 0.00 -1.92 -2.78 119.26 116.29 2hm9 h ALA 150 Ca 0.40 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.96 2hm9 h ALA 150 Cb 0.31 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2hm9 h ALA 150 CO -0.16 0.64 -0.23 -0.07 0.00 0.00 0.00 179.25 179.43 2hm9 h LEU 151 N 0.99 0.47 -9.83 0.00 3.38 -1.67 -3.28 115.31 105.36 2hm9 h LEU 151 Ca 0.20 -0.15 -0.54 0.00 0.09 0.00 0.00 57.88 57.48 2hm9 h LEU 151 Cb 0.39 -0.13 0.09 0.00 0.09 0.00 0.00 40.66 41.11 2hm9 h LEU 151 CO 0.01 0.70 0.85 0.41 0.09 0.00 0.00 178.44 180.50 2hm9 n THR 152 N -4.14 1.28 -3.99 0.22 -1.04 -0.59 -4.64 114.28 101.39 2hm9 n THR 152 Ca -0.00 -0.32 -0.09 0.00 -2.04 0.00 0.00 64.05 61.60 2hm9 n THR 152 Cb 0.39 -1.97 -0.08 0.00 -1.82 0.00 0.00 70.33 66.85 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 -0.30 0.46 0.09 -1.42 -3.43 -0.78 -2.72 115.29 107.20 2hm9 s HIS 153 Ca 0.61 -0.85 0.05 0.00 -0.80 0.00 0.00 55.06 54.07 2hm9 s HIS 153 Cb -0.49 -0.17 -0.03 0.00 -1.43 0.00 0.00 32.58 30.45 2hm9 s HIS 153 CO 0.53 -0.62 -0.13 0.99 -2.00 0.00 0.00 174.74 173.51 2hm9 s THR 154 N -3.96 1.09 -0.16 -5.38 2.01 -0.56 -1.62 115.64 107.06 2hm9 s THR 154 Ca 0.16 -1.49 -0.01 0.00 0.31 0.00 0.00 61.69 60.65 2hm9 s THR 154 Cb 0.05 -1.24 -0.01 0.00 0.01 0.00 0.00 72.50 71.31 2hm9 s THR 154 CO -0.03 -0.37 -0.11 -0.31 -0.69 0.00 0.00 174.62 173.12 2hm9 s TYR 155 N -1.82 2.86 -0.05 4.92 2.02 0.28 -2.05 117.35 123.52 2hm9 s TYR 155 Ca 0.02 -0.79 0.04 0.00 -0.37 0.00 0.00 57.07 55.98 2hm9 s TYR 155 Cb -0.07 -1.93 -0.00 0.00 -0.40 0.00 0.00 41.96 39.56 2hm9 s TYR 155 CO 0.02 -0.34 -0.18 -1.21 -1.57 0.00 0.00 175.55 172.26 2hm9 s GLU 156 N 0.74 1.87 -0.13 -0.62 2.02 -0.80 0.55 118.70 122.34 2hm9 s GLU 156 Ca -0.05 -0.64 0.03 0.00 0.02 0.00 0.00 54.97 54.33 2hm9 s GLU 156 Cb -0.15 -1.62 0.01 0.00 0.10 0.00 0.00 34.13 32.47 2hm9 s GLU 156 CO 0.02 0.25 -0.22 0.08 0.02 0.00 0.00 175.26 175.41 2hm9 s VAL 157 N 0.04 2.15 -0.05 2.63 1.01 -0.04 -1.78 120.40 124.35 2hm9 s VAL 157 Ca -0.04 -0.96 0.04 0.00 0.00 0.00 0.00 61.98 61.02 2hm9 s VAL 157 Cb -0.12 -1.85 -0.02 0.00 0.00 0.00 0.00 36.38 34.39 2hm9 s VAL 157 CO 0.02 0.55 -0.16 0.26 0.00 0.00 0.00 175.10 175.77 2hm9 s TRP 158 N 0.66 2.64 -0.12 5.22 0.52 0.50 -0.94 118.94 127.42 2hm9 s TRP 158 Ca -0.11 -0.24 0.01 0.00 0.02 0.00 0.00 56.10 55.79 2hm9 s TRP 158 Cb -0.16 -1.62 -0.01 0.00 -1.15 0.00 0.00 33.47 30.53 2hm9 s TRP 158 CO 0.02 0.12 -0.16 -0.65 0.02 0.00 0.00 176.95 176.31 2hm9 s GLN 159 N -0.65 3.30 0.25 4.98 -0.21 -0.88 0.67 119.66 127.12 2hm9 s GLN 159 Ca 0.10 -0.73 -0.30 0.00 0.02 0.00 0.00 55.36 54.45 2hm9 s GLN 159 Cb -0.11 -2.56 -0.10 0.00 1.00 0.00 0.00 33.01 31.24 2hm9 s GLN 159 CO 0.01 0.19 1.47 0.21 -2.12 0.00 0.00 175.29 175.05 2hm9 s LYS 160 N 0.38 4.24 -0.02 2.91 2.20 -0.94 -2.88 119.74 125.63 2hm9 s LYS 160 Ca -0.12 2.35 0.07 0.00 -0.36 0.00 0.00 55.97 57.91 2hm9 s LYS 160 Cb -0.16 -3.10 -0.02 0.00 -1.51 0.00 0.00 37.83 33.04 2hm9 s LYS 160 CO 0.06 -0.47 -0.22 -1.59 -0.36 0.00 0.00 175.35 172.77 2hm9 s LYS 161 N -0.31 1.81 0.00 4.03 0.00 -1.26 -4.97 119.74 119.04 2hm9 s LYS 161 Ca 0.61 -0.79 0.00 0.00 0.00 0.00 0.00 55.97 55.78 2hm9 s LYS 161 Cb -0.43 -1.74 0.00 0.00 0.00 0.00 0.00 37.83 35.66 2hm9 s LYS 161 CO 0.43 0.47 0.17 0.00 0.00 0.00 0.00 175.35 176.42