#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 1.61 -0.26 2.41 0.00 0.43 -2.81 121.76 123.13 2hm9 s ALA 2 Ca 0.00 -1.00 -0.08 0.00 0.00 0.00 0.00 51.96 50.88 2hm9 s ALA 2 Cb 0.00 -0.30 -0.03 0.00 0.00 0.00 0.00 23.12 22.79 2hm9 s ALA 2 CO 0.00 0.35 0.10 -0.06 0.00 0.00 0.00 175.76 176.15 2hm9 s PHE 3 N -0.82 3.12 -0.20 0.00 0.40 0.14 0.62 117.98 121.25 2hm9 s PHE 3 Ca 0.06 -0.36 0.01 0.00 -0.60 0.00 0.00 56.93 56.04 2hm9 s PHE 3 Cb -0.09 -2.28 0.03 0.00 0.51 0.00 0.00 43.02 41.20 2hm9 s PHE 3 CO 0.02 -0.34 -0.15 -1.17 0.70 0.00 0.00 175.22 174.27 2hm9 s LEU 4 N 1.64 2.40 0.17 -0.37 2.96 -0.95 0.16 118.68 124.68 2hm9 s LEU 4 Ca 0.06 -0.84 -0.21 0.00 -0.22 0.00 0.00 54.13 52.92 2hm9 s LEU 4 Cb -0.16 -1.41 0.06 0.00 0.50 0.00 0.00 46.19 45.18 2hm9 s LEU 4 CO 0.05 -0.08 0.56 -1.66 -1.32 0.00 0.00 176.35 173.91 2hm9 s TRP 5 N 1.29 -0.41 -0.04 5.38 -2.14 -1.08 -4.25 118.94 117.68 2hm9 s TRP 5 Ca 0.01 0.15 0.06 0.00 2.66 0.00 0.00 56.10 58.98 2hm9 s TRP 5 Cb -0.15 0.50 -0.01 0.00 -3.10 0.00 0.00 33.47 30.70 2hm9 s TRP 5 CO -0.10 -0.86 -0.23 0.00 -2.66 0.00 0.00 176.95 173.10 2hm9 s ALA 6 N -3.78 1.97 0.04 2.67 0.00 -1.26 -2.49 121.76 118.90 2hm9 s ALA 6 Ca 0.03 -0.97 -0.01 0.00 0.00 0.00 0.00 51.96 51.00 2hm9 s ALA 6 Cb -0.01 -0.57 -0.03 0.00 0.00 0.00 0.00 23.12 22.51 2hm9 s ALA 6 CO -0.10 0.42 -0.01 1.14 0.00 0.00 0.00 175.76 177.21 2hm9 s GLN 7 N -0.29 0.50 0.87 0.00 -2.07 0.73 -4.67 119.66 114.74 2hm9 s GLN 7 Ca 0.01 -0.93 -0.10 0.00 -1.82 0.00 0.00 55.36 52.53 2hm9 s GLN 7 Cb -0.11 0.18 0.18 0.00 -1.09 0.00 0.00 33.01 32.16 2hm9 s GLN 7 CO 0.02 -0.10 1.19 0.16 -1.32 0.00 0.00 175.29 175.24 2hm9 s ASP 8 N -2.27 3.57 0.19 12.60 1.47 -1.02 -2.68 116.67 128.54 2hm9 s ASP 8 Ca -0.03 -0.04 -0.11 0.00 1.18 0.00 0.00 52.55 53.55 2hm9 s ASP 8 Cb 0.00 -0.12 0.12 0.00 -0.34 0.00 0.00 42.92 42.58 2hm9 s ASP 8 CO -0.06 -2.41 1.81 0.08 0.68 0.00 0.00 175.17 175.28 2hm9 h ARG 9 N -1.20 0.95 -0.71 2.11 0.11 -1.67 -2.69 114.38 111.28 2hm9 h ARG 9 Ca -0.41 -0.11 -0.01 0.00 0.10 0.00 0.00 59.98 59.56 2hm9 h ARG 9 Cb 1.24 -0.19 -0.03 0.00 1.11 0.00 0.00 29.97 32.10 2hm9 h ARG 9 CO 0.38 0.71 0.42 -0.44 0.10 0.00 0.00 179.97 181.14 2hm9 h ASP 10 N 0.94 0.87 0.00 0.08 3.32 -1.91 -3.47 116.42 116.25 2hm9 h ASP 10 Ca 0.24 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.22 2hm9 h ASP 10 Cb 0.03 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.36 2hm9 h ASP 10 CO -0.04 0.68 0.00 0.61 -1.72 0.00 0.00 179.24 178.77 2hm9 n GLY 11 N -1.16 0.87 3.85 2.75 0.00 -1.02 -5.13 105.19 105.36 2hm9 n GLY 11 Ca 0.06 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 4.41 -0.09 0.99 0.20 -1.26 -2.96 118.68 119.97 2hm9 s LEU 12 Ca 0.00 0.87 0.02 0.00 0.69 0.00 0.00 54.13 55.71 2hm9 s LEU 12 Cb 0.00 -2.77 -0.25 0.00 -0.43 0.00 0.00 46.19 42.75 2hm9 s LEU 12 CO 0.00 0.25 0.47 2.30 -0.29 0.00 0.00 176.35 179.08 2hm9 n ILE 13 N 1.37 1.70 0.00 6.68 -5.35 -1.09 -2.42 119.36 120.25 2hm9 n ILE 13 Ca -0.11 -0.72 0.00 0.00 -0.27 0.00 0.00 62.75 61.65 2hm9 n ILE 13 Cb 0.52 -1.41 0.00 0.00 -1.74 0.00 0.00 39.64 37.01 2hm9 n ILE 13 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2hm9 n GLY 14 N 1.81 -0.13 3.07 3.28 0.00 -1.04 -4.52 105.19 107.67 2hm9 n GLY 14 Ca -0.26 -0.13 -0.12 0.00 0.00 0.00 0.00 46.02 45.51 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 0.00 0.21 -0.72 1.61 2.20 -1.24 0.16 119.74 121.96 2hm9 s LYS 15 Ca 0.00 0.80 0.00 0.00 -0.36 0.00 0.00 55.97 56.41 2hm9 s LYS 15 Cb 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 37.83 36.32 2hm9 s LYS 15 CO 0.00 -0.31 0.00 -0.25 -0.36 0.00 0.00 175.35 174.43 2hm9 n ASP 16 N 5.36 -4.25 0.00 1.43 8.00 -1.26 -3.06 116.55 122.77 2hm9 n ASP 16 Ca -0.07 0.17 0.00 0.00 0.71 0.00 0.00 54.79 55.60 2hm9 n ASP 16 Cb 0.50 -2.34 0.00 0.00 -0.02 0.00 0.00 41.12 39.25 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 -1.59 3.04 3.77 0.44 0.00 -1.26 -4.54 105.19 105.06 2hm9 n GLY 17 Ca -0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.06 2.64 -0.61 1.61 -3.43 -1.17 -4.92 115.29 107.34 2hm9 s HIS 18 Ca 0.00 1.48 -0.19 0.00 -0.80 0.00 0.00 55.06 55.55 2hm9 s HIS 18 Cb 0.00 -3.04 0.11 0.00 -1.43 0.00 0.00 32.58 28.22 2hm9 s HIS 18 CO 0.00 -1.79 0.73 -0.51 -2.00 0.00 0.00 174.74 171.18 2hm9 s LEU 19 N -5.90 5.36 0.56 5.38 1.43 -1.26 -3.61 118.68 120.65 2hm9 s LEU 19 Ca 0.61 -1.47 0.33 0.00 -1.03 0.00 0.00 54.13 52.57 2hm9 s LEU 19 Cb -0.17 -2.31 1.67 0.00 0.03 0.00 0.00 46.19 45.41 2hm9 s LEU 19 CO 0.56 -1.12 2.13 1.55 0.23 0.00 0.00 176.35 179.70 2hm9 h PRO 20 N 9.16 0.00 -6.11 1.29 0.13 -1.92 -3.43 132.00 131.13 2hm9 h PRO 20 Ca -0.27 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.27 2hm9 h PRO 20 Cb 1.08 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.16 2hm9 h PRO 20 CO 1.10 0.06 -0.12 1.67 -0.23 0.00 0.00 178.00 180.48 2hm9 s TRP 21 N -4.09 3.76 -0.71 1.56 -2.14 -1.26 -5.04 118.94 111.03 2hm9 s TRP 21 Ca -0.03 1.12 -0.20 0.00 2.66 0.00 0.00 56.10 59.65 2hm9 s TRP 21 Cb 0.12 -2.39 0.10 0.00 -3.10 0.00 0.00 33.47 28.20 2hm9 s TRP 21 CO 0.54 0.61 0.91 -1.58 -2.66 0.00 0.00 176.95 174.76 2hm9 s HIS 22 N -1.04 2.92 -0.58 1.66 2.46 -1.26 -4.93 115.29 114.52 2hm9 s HIS 22 Ca 0.26 -0.94 0.06 0.00 0.47 0.00 0.00 55.06 54.92 2hm9 s HIS 22 Cb -0.18 -4.18 0.23 0.00 -0.13 0.00 0.00 32.58 28.32 2hm9 s HIS 22 CO 0.16 -1.47 0.63 -0.11 -2.47 0.00 0.00 174.74 171.47 2hm9 n LEU 23 N 6.85 2.50 -0.33 8.88 7.94 -1.26 -4.97 117.00 136.61 2hm9 n LEU 23 Ca 0.01 -5.16 0.01 0.00 -1.11 0.00 0.00 56.01 49.77 2hm9 n LEU 23 Cb 0.45 -0.29 0.07 0.00 0.53 0.00 0.00 43.42 44.19 2hm9 n LEU 23 CO 0.58 2.00 0.64 -0.65 -1.11 0.00 0.00 177.39 178.85 2hm9 h PRO 24 N 4.43 -0.03 -0.41 1.96 0.11 -1.98 0.21 132.00 136.29 2hm9 h PRO 24 Ca 0.17 0.00 0.08 0.00 0.11 0.00 0.00 66.00 66.36 2hm9 h PRO 24 Cb 0.74 0.01 -0.09 0.00 0.11 0.00 0.00 31.00 31.77 2hm9 h PRO 24 CO 0.70 -0.02 -0.32 0.22 -0.21 0.00 0.00 178.00 178.37 2hm9 h ASP 25 N -0.03 -1.07 -0.30 -2.05 3.58 -1.97 0.35 116.42 114.94 2hm9 h ASP 25 Ca 0.37 0.19 -0.06 0.00 0.42 0.00 0.00 57.03 57.95 2hm9 h ASP 25 Cb 0.62 0.51 -0.02 0.00 1.72 0.00 0.00 39.33 42.16 2hm9 h ASP 25 CO -0.92 -0.32 -0.01 -0.78 -2.88 0.00 0.00 179.24 174.34 2hm9 h ASP 26 N -0.24 0.61 -0.65 2.28 1.82 -1.40 -2.59 116.42 116.24 2hm9 h ASP 26 Ca 0.18 -0.13 -0.03 0.00 -0.39 0.00 0.00 57.03 56.66 2hm9 h ASP 26 Cb 0.54 -0.16 -0.03 0.00 0.68 0.00 0.00 39.33 40.36 2hm9 h ASP 26 CO -0.55 0.69 0.29 -0.07 -1.61 0.00 0.00 179.24 177.99 2hm9 h LEU 27 N 0.61 0.87 -0.90 2.28 3.38 0.17 -2.01 115.31 119.70 2hm9 h LEU 27 Ca 0.12 -0.15 0.03 0.00 0.09 0.00 0.00 57.88 57.98 2hm9 h LEU 27 Cb 0.40 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.87 2hm9 h LEU 27 CO 0.02 0.78 0.58 0.45 0.09 0.00 0.00 178.44 180.36 2hm9 h HIS 28 N 0.91 1.10 -0.37 1.13 3.86 -0.10 -1.70 115.15 119.97 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 0.15 -0.36 -0.02 0.00 1.06 0.00 0.00 27.41 28.24 2hm9 h HIS 28 CO 0.01 0.63 0.24 -0.92 0.86 0.00 0.00 177.93 178.75 2hm9 h TYR 29 N 1.14 0.46 -0.33 2.45 3.20 -1.03 -0.25 116.97 122.62 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 0.00 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.10 2hm9 h TYR 29 CO -0.01 0.29 0.19 0.35 -1.64 0.00 0.00 178.16 177.34 2hm9 h PHE 30 N 0.50 0.43 -0.59 -3.82 3.57 -0.70 -2.33 116.94 114.01 2hm9 h PHE 30 Ca 0.14 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.61 2hm9 h PHE 30 Cb -0.05 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.52 2hm9 h PHE 30 CO -0.05 0.32 0.29 -0.09 -2.23 0.00 0.00 178.31 176.54 2hm9 h ARG 31 N 0.42 0.84 -0.58 1.11 1.12 -1.07 -2.77 114.38 113.46 2hm9 h ARG 31 Ca 0.12 -0.12 -0.07 0.00 -1.11 0.00 0.00 59.98 58.79 2hm9 h ARG 31 Cb 0.01 -0.15 -0.02 0.00 -0.01 0.00 0.00 29.97 29.79 2hm9 h ARG 31 CO -0.02 0.68 0.08 0.00 -3.11 0.00 0.00 179.97 177.60 2hm9 h ALA 32 N 1.12 1.05 -0.08 2.80 0.00 -0.93 -2.73 119.26 120.49 2hm9 h ALA 32 Ca 0.20 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 2hm9 h ALA 32 Cb 0.11 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2hm9 h ALA 32 CO -0.03 0.61 -0.25 1.96 0.00 0.00 0.00 179.25 181.54 2hm9 h GLN 33 N 0.89 0.14 -0.12 0.00 4.20 -1.26 -2.45 115.11 116.51 2hm9 h GLN 33 Ca 0.18 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.85 2hm9 h GLN 33 Cb 0.41 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.17 2hm9 h GLN 33 CO 0.01 0.39 0.00 0.25 -0.67 0.00 0.00 178.83 178.81 2hm9 n THR 34 N -4.19 0.15 -3.06 -0.54 -2.24 -1.04 -4.70 114.28 98.67 2hm9 n THR 34 Ca -0.01 -0.18 -0.41 0.00 -2.27 0.00 0.00 64.05 61.18 2hm9 n THR 34 Cb 0.34 0.05 -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 -1.85 4.96 -0.42 2.28 -7.23 -0.93 -3.74 120.40 113.48 2hm9 s VAL 35 Ca 0.18 1.23 0.00 0.00 -1.81 0.00 0.00 61.98 61.58 2hm9 s VAL 35 Cb 0.09 -3.97 0.00 0.00 0.56 0.00 0.00 36.38 33.06 2hm9 s VAL 35 CO 0.14 0.02 0.00 0.61 -0.31 0.00 0.00 175.10 175.55 2hm9 n GLY 36 N 4.04 0.69 3.08 2.32 0.00 -1.26 -5.03 105.19 109.03 2hm9 n GLY 36 Ca 0.01 -0.81 -0.11 0.00 0.00 0.00 0.00 46.02 45.10 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 -2.23 0.59 0.01 1.61 3.01 -1.24 -4.76 119.74 116.73 2hm9 s LYS 37 Ca 0.00 -0.96 -0.30 0.00 -1.01 0.00 0.00 55.97 53.70 2hm9 s LYS 37 Cb 0.00 -0.14 -0.04 0.00 -1.01 0.00 0.00 37.83 36.64 2hm9 s LYS 37 CO 0.00 -0.01 1.08 0.42 0.51 0.00 0.00 175.35 177.35 2hm9 s ILE 38 N -2.36 4.51 0.06 2.17 -1.09 0.14 -4.20 121.20 120.43 2hm9 s ILE 38 Ca -0.03 1.80 0.06 0.00 -2.23 0.00 0.00 60.65 60.25 2hm9 s ILE 38 Cb -0.03 -4.15 -0.03 0.00 -1.58 0.00 0.00 42.46 36.67 2hm9 s ILE 38 CO -0.03 0.12 -0.15 -0.32 -1.23 0.00 0.00 174.94 173.33 2hm9 s MET 39 N 1.22 0.95 -0.11 2.79 -2.45 -1.01 0.39 119.30 121.09 2hm9 s MET 39 Ca 0.54 -0.89 0.03 0.00 -1.25 0.00 0.00 55.69 54.13 2hm9 s MET 39 Cb -0.24 -1.00 -0.00 0.00 1.25 0.00 0.00 34.83 34.84 2hm9 s MET 39 CO 0.27 0.24 -0.23 0.08 1.05 0.00 0.00 175.02 176.43 2hm9 s VAL 40 N -1.04 2.15 -0.08 10.11 1.01 0.83 -1.63 120.40 131.76 2hm9 s VAL 40 Ca 0.01 -0.98 0.04 0.00 0.00 0.00 0.00 61.98 61.05 2hm9 s VAL 40 Cb -0.09 -1.83 -0.00 0.00 0.00 0.00 0.00 36.38 34.46 2hm9 s VAL 40 CO 0.02 0.55 -0.22 0.68 0.00 0.00 0.00 175.10 176.14 2hm9 s VAL 41 N 0.40 1.84 0.99 2.92 -7.23 0.81 -1.05 120.40 119.09 2hm9 s VAL 41 Ca -0.17 -0.91 -0.13 0.00 -1.81 0.00 0.00 61.98 58.96 2hm9 s VAL 41 Cb -0.17 -1.59 0.18 0.00 0.56 0.00 0.00 36.38 35.36 2hm9 s VAL 41 CO 0.07 0.51 1.12 -0.83 -0.31 0.00 0.00 175.10 175.67 2hm9 s GLY 42 N 0.26 1.58 0.19 2.32 0.00 0.16 -0.94 107.32 110.89 2hm9 s GLY 42 Ca -0.14 -0.55 -0.12 0.00 0.00 0.00 0.00 44.72 43.92 2hm9 s GLY 42 CO 0.06 0.08 1.80 -0.09 0.00 0.00 0.00 173.10 174.96 2hm9 h ARG 43 N -1.82 0.90 -0.36 2.90 1.12 -1.85 -1.03 114.38 114.24 2hm9 h ARG 43 Ca -0.51 -0.10 0.04 0.00 -1.11 0.00 0.00 59.98 58.29 2hm9 h ARG 43 Cb 1.32 -0.18 -0.02 0.00 -0.01 0.00 0.00 29.97 31.09 2hm9 h ARG 43 CO 0.56 0.68 0.24 0.00 -3.11 0.00 0.00 179.97 178.34 2hm9 h ARG 44 N 0.88 0.33 -0.29 0.20 -0.00 -1.91 -1.34 114.38 112.25 2hm9 h ARG 44 Ca 0.23 -0.02 -0.01 0.00 -0.50 0.00 0.00 59.98 59.67 2hm9 h ARG 44 Cb 0.04 -0.08 -0.01 0.00 0.00 0.00 0.00 29.97 29.92 2hm9 h ARG 44 CO -0.04 0.22 0.13 1.15 0.00 0.00 0.00 179.97 181.43 2hm9 h THR 45 N 0.34 1.17 -0.36 2.04 2.02 -1.44 -0.83 112.91 115.85 2hm9 h THR 45 Ca 0.15 -0.50 0.08 0.00 0.77 0.00 0.00 66.41 66.91 2hm9 h THR 45 Cb 0.17 0.96 -0.09 0.00 -1.74 0.00 0.00 68.15 67.46 2hm9 h THR 45 CO -0.03 0.17 -0.31 0.22 0.37 0.00 0.00 175.52 175.94 2hm9 h TYR 46 N 0.33 -0.85 0.00 3.16 3.20 -0.75 0.81 116.97 122.87 2hm9 h TYR 46 Ca 0.10 0.05 -0.09 0.00 3.14 0.00 0.00 58.73 61.93 2hm9 h TYR 46 Cb 0.16 0.43 -0.01 0.00 1.54 0.00 0.00 36.73 38.84 2hm9 h TYR 46 CO -0.01 -0.37 -0.45 0.93 -1.64 0.00 0.00 178.16 176.62 2hm9 h GLU 47 N -0.26 0.00 -0.04 1.82 4.39 -1.45 -3.03 114.58 116.02 2hm9 h GLU 47 Ca 0.17 0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.67 2hm9 h GLU 47 Cb 0.53 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.17 2hm9 h GLU 47 CO -0.51 0.45 -0.81 0.77 -1.16 0.00 0.00 179.01 177.75 2hm9 h SER 48 N 0.00 0.47 -3.73 1.42 0.02 0.47 -3.46 113.55 108.73 2hm9 h SER 48 Ca -0.00 -0.34 -0.57 0.00 -0.84 0.00 0.00 61.79 60.04 2hm9 h SER 48 Cb 0.79 -0.14 0.15 0.00 0.14 0.00 0.00 62.40 63.35 2hm9 h SER 48 CO 0.06 1.10 0.31 0.49 -1.14 0.00 0.00 176.83 177.65 2hm9 n PHE 49 N -3.79 1.40 0.02 3.45 3.01 0.27 -4.85 117.46 116.97 2hm9 n PHE 49 Ca -0.05 0.44 -0.19 0.00 1.01 0.00 0.00 57.45 58.66 2hm9 n PHE 49 Cb 0.76 -2.22 -0.14 0.00 -0.01 0.00 0.00 39.48 37.86 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 0.80 0.25 -2.21 -1.08 0.13 -1.88 -3.47 132.00 124.53 2hm9 h PRO 50 Ca -0.49 -0.42 -0.00 0.00 -0.87 0.00 0.00 66.00 64.22 2hm9 h PRO 50 Cb 1.34 0.16 -0.23 0.00 0.13 0.00 0.00 31.00 32.40 2hm9 h PRO 50 CO 0.53 1.20 -0.17 0.21 -0.23 0.00 0.00 178.00 179.54 2hm9 s LYS 51 N -2.41 0.52 0.14 0.86 2.20 -1.26 -5.17 119.74 114.63 2hm9 s LYS 51 Ca -0.16 1.21 0.08 0.00 -0.36 0.00 0.00 55.97 56.74 2hm9 s LYS 51 Cb 0.01 0.45 -0.04 0.00 -1.51 0.00 0.00 37.83 36.74 2hm9 s LYS 51 CO 0.80 -0.19 -0.18 1.03 -0.36 0.00 0.00 175.35 176.44 2hm9 s ARG 52 N 2.33 1.17 0.44 4.03 0.52 -1.26 -4.71 118.95 121.48 2hm9 s ARG 52 Ca -0.06 -1.30 0.06 0.00 -0.52 0.00 0.00 55.73 53.91 2hm9 s ARG 52 Cb -0.10 -1.24 0.08 0.00 0.52 0.00 0.00 34.95 34.21 2hm9 s ARG 52 CO -0.17 0.26 0.61 -0.35 0.02 0.00 0.00 175.30 175.67 2hm9 n PRO 53 N 0.56 0.63 -3.44 3.54 -0.04 -1.26 -4.85 135.00 130.14 2hm9 n PRO 53 Ca -0.15 -2.28 -0.34 0.00 -0.04 0.00 0.00 63.50 60.69 2hm9 n PRO 53 Cb 0.56 -0.22 -0.06 0.00 -0.04 0.00 0.00 33.50 33.75 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 4.30 0.18 1.53 1.43 -1.26 -5.07 118.68 119.79 2hm9 s LEU 54 Ca 0.46 0.95 -0.28 0.00 -1.03 0.00 0.00 54.13 54.22 2hm9 s LEU 54 Cb -0.03 -3.28 -0.08 0.00 0.03 0.00 0.00 46.19 42.83 2hm9 s LEU 54 CO 0.29 0.08 0.88 -2.16 0.23 0.00 0.00 176.35 175.68 2hm9 s PRO 55 N -2.14 4.72 -1.40 1.29 0.04 -1.26 -3.79 135.00 132.46 2hm9 s PRO 55 Ca 0.39 1.35 0.00 0.00 0.04 0.00 0.00 61.00 62.78 2hm9 s PRO 55 Cb -0.14 -3.30 0.00 0.00 0.04 0.00 0.00 34.50 31.10 2hm9 s PRO 55 CO 0.19 0.46 0.00 0.39 0.04 0.00 0.00 177.00 178.08 2hm9 n GLU 56 N 1.88 -1.10 -2.95 4.56 1.02 -1.26 -4.98 120.64 117.81 2hm9 n GLU 56 Ca -0.02 0.85 -0.10 0.00 -0.02 0.00 0.00 57.16 57.87 2hm9 n GLU 56 Cb 0.48 -5.08 -0.03 0.00 -0.02 0.00 0.00 31.44 26.79 2hm9 n GLU 56 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2hm9 n ARG 57 N -2.49 0.76 -3.51 3.49 5.12 -1.25 -4.25 116.66 114.54 2hm9 n ARG 57 Ca -0.16 -1.36 -0.27 0.00 -1.93 0.00 0.00 57.85 54.12 2hm9 n ARG 57 Cb 0.56 0.76 -0.14 0.00 -1.16 0.00 0.00 32.46 32.49 2hm9 n ARG 57 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 2hm9 s THR 58 N -2.17 -0.09 -0.07 0.55 2.01 -1.26 -4.98 115.64 109.64 2hm9 s THR 58 Ca 0.09 -0.88 -0.04 0.00 0.31 0.00 0.00 61.69 61.17 2hm9 s THR 58 Cb 0.00 -0.99 -0.04 0.00 0.01 0.00 0.00 72.50 71.48 2hm9 s THR 58 CO 0.06 -0.73 0.10 0.20 -0.69 0.00 0.00 174.62 173.56 2hm9 s ASN 59 N 1.96 5.96 -0.06 3.53 0.02 -1.26 -2.40 114.94 122.68 2hm9 s ASN 59 Ca 0.11 0.30 0.03 0.00 -1.02 0.00 0.00 52.86 52.28 2hm9 s ASN 59 Cb -0.17 -1.82 0.01 0.00 0.02 0.00 0.00 41.25 39.29 2hm9 s ASN 59 CO -0.30 0.35 -0.15 -0.69 0.02 0.00 0.00 177.10 176.33 2hm9 s VAL 60 N -1.07 1.33 -0.23 1.60 1.01 -0.65 -1.64 120.40 120.76 2hm9 s VAL 60 Ca 0.18 -0.62 -0.12 0.00 0.00 0.00 0.00 61.98 61.43 2hm9 s VAL 60 Cb -0.12 -1.18 -0.05 0.00 0.00 0.00 0.00 36.38 35.03 2hm9 s VAL 60 CO 0.08 0.39 0.20 -0.69 0.00 0.00 0.00 175.10 175.09 2hm9 s VAL 61 N 0.41 5.33 -0.20 2.92 1.01 0.52 -0.13 120.40 130.26 2hm9 s VAL 61 Ca -0.11 0.29 -0.05 0.00 0.00 0.00 0.00 61.98 62.10 2hm9 s VAL 61 Cb -0.14 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 32.67 2hm9 s VAL 61 CO 0.04 0.34 0.01 -0.22 0.00 0.00 0.00 175.10 175.27 2hm9 s LEU 62 N 1.01 3.32 -0.07 3.92 0.20 -0.11 -1.68 118.68 125.27 2hm9 s LEU 62 Ca 0.10 -0.17 0.03 0.00 0.69 0.00 0.00 54.13 54.78 2hm9 s LEU 62 Cb -0.13 -1.84 0.01 0.00 -0.43 0.00 0.00 46.19 43.79 2hm9 s LEU 62 CO 0.04 0.07 -0.16 0.28 -0.29 0.00 0.00 176.35 176.30 2hm9 s THR 63 N 0.94 1.37 0.13 3.68 -1.32 -1.15 -2.67 115.64 116.63 2hm9 s THR 63 Ca 0.02 -0.63 -0.14 0.00 -1.21 0.00 0.00 61.69 59.72 2hm9 s THR 63 Cb -0.14 -1.22 -0.02 0.00 -1.51 0.00 0.00 72.50 69.61 2hm9 s THR 63 CO 0.02 0.41 1.56 0.45 -2.21 0.00 0.00 174.62 174.85 2hm9 h HIS 64 N 6.76 0.83 -3.54 9.09 3.86 -1.88 -3.36 115.15 126.92 2hm9 h HIS 64 Ca -0.29 -0.16 -0.52 0.00 -1.16 0.00 0.00 60.37 58.25 2hm9 h HIS 64 Cb 1.19 -0.21 -0.00 0.00 1.06 0.00 0.00 27.41 29.45 2hm9 h HIS 64 CO 0.47 0.84 0.45 1.14 0.86 0.00 0.00 177.93 181.69 2hm9 s GLN 65 N -4.94 4.61 0.00 2.45 -2.07 -1.26 -4.94 119.66 113.52 2hm9 s GLN 65 Ca -0.13 1.64 0.28 0.00 -1.82 0.00 0.00 55.36 55.33 2hm9 s GLN 65 Cb 0.10 -3.31 1.53 0.00 -1.09 0.00 0.00 33.01 30.24 2hm9 s GLN 65 CO 0.81 0.09 1.99 0.39 -1.32 0.00 0.00 175.29 177.25 2hm9 n GLU 66 N 2.60 0.61 -0.41 9.60 -0.58 -1.26 -2.99 120.64 128.21 2hm9 n GLU 66 Ca 0.03 0.02 0.10 0.00 -0.42 0.00 0.00 57.16 56.89 2hm9 n GLU 66 Cb 0.47 -1.50 0.31 0.00 -0.57 0.00 0.00 31.44 30.15 2hm9 n GLU 66 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 2hm9 n ASP 67 N -1.16 3.90 -4.61 1.62 5.75 -1.26 -4.94 116.55 115.84 2hm9 n ASP 67 Ca 0.17 -2.11 -0.31 0.00 -0.01 0.00 0.00 54.79 52.53 2hm9 n ASP 67 Cb 0.17 -0.49 -0.09 0.00 -1.03 0.00 0.00 41.12 39.67 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 -1.28 2.85 0.09 2.11 6.14 -1.16 -5.13 117.35 120.98 2hm9 s TYR 68 Ca 0.47 -0.09 0.03 0.00 0.64 0.00 0.00 57.07 58.12 2hm9 s TYR 68 Cb 0.26 -1.51 -0.04 0.00 0.42 0.00 0.00 41.96 41.09 2hm9 s TYR 68 CO 0.29 0.42 -0.08 -0.65 0.64 0.00 0.00 175.55 176.17 2hm9 s GLN 69 N -2.00 0.81 0.03 4.97 -0.21 -1.26 -4.98 119.66 117.02 2hm9 s GLN 69 Ca 0.21 -1.20 0.03 0.00 0.02 0.00 0.00 55.36 54.43 2hm9 s GLN 69 Cb -0.11 -0.37 -0.02 0.00 1.00 0.00 0.00 33.01 33.51 2hm9 s GLN 69 CO 0.13 0.03 -0.10 0.00 -2.12 0.00 0.00 175.29 173.24 2hm9 s ALA 70 N -2.85 0.78 -0.15 6.09 0.00 -1.26 -5.11 121.76 119.26 2hm9 s ALA 70 Ca 0.07 -0.69 -0.04 0.00 0.00 0.00 0.00 51.96 51.30 2hm9 s ALA 70 Cb -0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 23.12 23.02 2hm9 s ALA 70 CO -0.02 0.10 -0.01 -0.65 0.00 0.00 0.00 175.76 175.18 2hm9 s GLN 71 N -1.14 3.60 0.00 0.00 -1.52 -1.26 -4.48 119.66 114.86 2hm9 s GLN 71 Ca -0.03 -0.45 0.00 0.00 -1.95 0.00 0.00 55.36 52.93 2hm9 s GLN 71 Cb -0.08 -2.96 0.00 0.00 -0.22 0.00 0.00 33.01 29.75 2hm9 s GLN 71 CO 0.01 0.35 0.00 0.41 -0.25 0.00 0.00 175.29 175.81 2hm9 n GLY 72 N 3.23 3.31 2.96 3.09 0.00 -1.26 -4.69 105.19 111.82 2hm9 n GLY 72 Ca -0.17 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.48 0.52 0.24 4.61 0.00 -1.26 -4.55 121.76 118.84 2hm9 s ALA 73 Ca 0.00 -0.22 -0.31 0.00 0.00 0.00 0.00 51.96 51.43 2hm9 s ALA 73 Cb 0.00 -0.17 -0.12 0.00 0.00 0.00 0.00 23.12 22.83 2hm9 s ALA 73 CO 0.00 0.10 1.63 0.28 0.00 0.00 0.00 175.76 177.77 2hm9 n VAL 74 N 3.11 0.51 -3.38 0.00 0.31 -0.65 -3.61 118.33 114.61 2hm9 n VAL 74 Ca -0.15 -0.13 -0.41 0.00 -0.01 0.00 0.00 64.34 63.65 2hm9 n VAL 74 Cb 0.57 -1.88 -0.09 0.00 -0.91 0.00 0.00 33.84 31.52 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 0.55 5.15 -0.09 2.52 1.01 -1.25 0.19 120.40 128.49 2hm9 s VAL 75 Ca 0.70 0.09 0.03 0.00 0.00 0.00 0.00 61.98 62.80 2hm9 s VAL 75 Cb -0.53 -3.84 0.01 0.00 0.00 0.00 0.00 36.38 32.02 2hm9 s VAL 75 CO 0.41 -0.10 -0.17 0.68 0.00 0.00 0.00 175.10 175.92 2hm9 s VAL 76 N 2.06 1.54 -2.45 2.92 -7.23 -0.68 -4.99 120.40 111.58 2hm9 s VAL 76 Ca 0.13 -0.71 0.21 0.00 -1.81 0.00 0.00 61.98 59.80 2hm9 s VAL 76 Cb -0.16 -1.37 0.11 0.00 0.56 0.00 0.00 36.38 35.52 2hm9 s VAL 76 CO 0.12 0.45 1.13 1.41 -0.31 0.00 0.00 175.10 177.90 2hm9 n HIS 77 N 3.76 0.00 -3.72 2.82 -0.00 -1.26 -2.93 115.22 113.89 2hm9 n HIS 77 Ca -0.21 0.00 -0.36 0.00 -0.00 0.00 0.00 57.72 57.15 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 -1.97 6.04 0.17 0.41 1.01 -1.26 -4.81 116.67 116.25 2hm9 s ASP 78 Ca 0.23 0.12 -0.13 0.00 0.71 0.00 0.00 52.55 53.48 2hm9 s ASP 78 Cb 0.18 -2.08 0.07 0.00 1.01 0.00 0.00 42.92 42.10 2hm9 s ASP 78 CO 0.35 0.10 1.77 0.58 0.21 0.00 0.00 175.17 178.18 2hm9 h VAL 79 N 4.95 1.19 -0.51 -1.27 2.07 -1.99 -2.30 116.25 118.40 2hm9 h VAL 79 Ca -0.39 -0.52 -0.03 0.00 0.82 0.00 0.00 66.70 66.58 2hm9 h VAL 79 Cb 1.17 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 2hm9 h VAL 79 CO 0.68 0.21 0.19 0.00 0.02 0.00 0.00 177.57 178.67 2hm9 h ALA 80 N 1.12 1.37 -0.65 1.67 0.00 -2.00 -2.36 119.26 118.41 2hm9 h ALA 80 Ca 0.19 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2hm9 h ALA 80 Cb 0.08 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 2hm9 h ALA 80 CO -0.03 0.47 0.27 0.00 0.00 0.00 0.00 179.25 179.96 2hm9 h ALA 81 N 1.48 1.25 -0.53 0.00 0.00 -1.84 -0.35 119.26 119.28 2hm9 h ALA 81 Ca 0.17 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2hm9 h ALA 81 Cb 0.17 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2hm9 h ALA 81 CO -0.01 0.56 0.25 0.28 0.00 0.00 0.00 179.25 180.32 2hm9 h VAL 82 N 0.94 1.20 -0.45 0.00 2.07 -1.10 -0.36 116.25 118.54 2hm9 h VAL 82 Ca 0.22 -0.57 -0.00 0.00 0.82 0.00 0.00 66.70 67.17 2hm9 h VAL 82 Cb 0.16 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 2hm9 h VAL 82 CO -0.02 0.23 0.28 -0.26 0.02 0.00 0.00 177.57 177.81 2hm9 h PHE 83 N 0.71 0.59 -0.58 1.57 0.04 -1.23 -2.75 116.94 115.29 2hm9 h PHE 83 Ca 0.18 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.92 2hm9 h PHE 83 Cb 0.13 -0.19 -0.03 0.00 2.20 0.00 0.00 35.95 38.06 2hm9 h PHE 83 CO -0.00 0.41 0.22 0.00 -0.60 0.00 0.00 178.31 178.33 2hm9 h ALA 84 N 1.13 1.29 -0.30 2.45 0.00 -0.65 -1.93 119.26 121.26 2hm9 h ALA 84 Ca 0.16 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.92 2hm9 h ALA 84 Cb -0.02 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2hm9 h ALA 84 CO -0.03 0.52 0.19 -0.92 0.00 0.00 0.00 179.25 179.01 2hm9 h TYR 85 N 0.84 0.35 -0.58 0.00 5.03 -0.78 0.06 116.97 121.89 2hm9 h TYR 85 Ca 0.20 0.01 -0.05 0.00 2.58 0.00 0.00 58.73 61.46 2hm9 h TYR 85 Cb 0.19 -0.12 -0.03 0.00 1.55 0.00 0.00 36.73 38.32 2hm9 h TYR 85 CO 0.01 0.22 0.15 0.00 -1.32 0.00 0.00 178.16 177.22 2hm9 h ALA 86 N 1.12 1.17 -0.41 1.82 0.00 -1.35 -2.34 119.26 119.27 2hm9 h ALA 86 Ca 0.11 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 2hm9 h ALA 86 Cb -0.03 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2hm9 h ALA 86 CO -0.04 0.57 0.09 -0.22 0.00 0.00 0.00 179.25 179.65 2hm9 h LYS 87 N 0.86 0.61 -0.86 0.00 3.11 -0.67 -2.52 116.57 117.10 2hm9 h LYS 87 Ca 0.19 -0.11 -0.03 0.00 -2.81 0.00 0.00 60.65 57.89 2hm9 h LYS 87 Cb 0.30 -0.10 -0.04 0.00 -1.00 0.00 0.00 32.23 31.39 2hm9 h LYS 87 CO -0.00 0.57 0.42 1.96 -2.81 0.00 0.00 179.45 179.59 2hm9 h GLN 88 N 0.60 1.23 -2.98 1.90 4.20 -0.44 -3.30 115.11 116.32 2hm9 h GLN 88 Ca 0.14 -0.18 -0.65 0.00 0.06 0.00 0.00 58.65 58.02 2hm9 h GLN 88 Cb 0.25 -0.22 -0.39 0.00 0.30 0.00 0.00 27.48 27.41 2hm9 h GLN 88 CO -0.00 0.94 -0.37 0.72 -0.67 0.00 0.00 178.83 179.44 2hm9 n HIS 89 N -4.31 3.59 -0.15 2.96 8.25 -0.95 -4.92 115.22 119.69 2hm9 n HIS 89 Ca 0.09 -4.16 0.08 0.00 -0.26 0.00 0.00 57.72 53.46 2hm9 n HIS 89 Cb 0.14 -0.80 0.39 0.00 1.12 0.00 0.00 29.99 30.84 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 5.33 0.64 -0.42 -0.41 0.11 -1.63 -1.63 132.00 133.99 2hm9 h PRO 90 Ca 0.17 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.18 2hm9 h PRO 90 Cb 0.74 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.69 2hm9 h PRO 90 CO 0.81 0.42 0.04 0.22 -0.21 0.00 0.00 178.00 179.28 2hm9 h ASP 91 N 0.66 0.62 -3.49 -2.05 3.58 -1.91 -3.42 116.42 110.41 2hm9 h ASP 91 Ca 0.30 -0.12 -0.52 0.00 0.42 0.00 0.00 57.03 57.10 2hm9 h ASP 91 Cb 0.32 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 41.19 2hm9 h ASP 91 CO -0.10 0.67 0.40 -1.10 -2.88 0.00 0.00 179.24 176.23 2hm9 s GLN 92 N -5.04 4.63 0.22 0.28 -0.21 -0.61 -5.03 119.66 113.88 2hm9 s GLN 92 Ca -0.09 1.51 -0.21 0.00 0.02 0.00 0.00 55.36 56.59 2hm9 s GLN 92 Cb 0.15 -3.38 -0.08 0.00 1.00 0.00 0.00 33.01 30.70 2hm9 s GLN 92 CO 0.78 0.09 0.75 -1.21 -2.12 0.00 0.00 175.29 173.57 2hm9 s GLU 93 N 0.30 4.33 -0.23 2.91 0.41 -1.26 -4.79 118.70 120.37 2hm9 s GLU 93 Ca 0.50 0.95 -0.09 0.00 -0.41 0.00 0.00 54.97 55.92 2hm9 s GLU 93 Cb -0.24 -2.95 -0.04 0.00 -1.78 0.00 0.00 34.13 29.11 2hm9 s GLU 93 CO 0.30 0.42 0.12 -1.17 -0.49 0.00 0.00 175.26 174.44 2hm9 s LEU 94 N -1.81 3.90 -0.05 1.80 2.96 -1.25 0.24 118.68 124.47 2hm9 s LEU 94 Ca 0.42 0.04 0.04 0.00 -0.22 0.00 0.00 54.13 54.41 2hm9 s LEU 94 Cb -0.18 -2.03 -0.00 0.00 0.50 0.00 0.00 46.19 44.48 2hm9 s LEU 94 CO 0.22 0.07 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.45 2hm9 s VAL 95 N 0.99 1.56 -0.46 1.68 1.01 0.16 0.16 120.40 125.50 2hm9 s VAL 95 Ca 0.06 -0.77 -0.16 0.00 0.00 0.00 0.00 61.98 61.11 2hm9 s VAL 95 Cb -0.14 -1.34 0.06 0.00 0.00 0.00 0.00 36.38 34.96 2hm9 s VAL 95 CO 0.03 0.45 0.38 -0.63 0.00 0.00 0.00 175.10 175.33 2hm9 s ILE 96 N 0.13 5.22 -0.82 2.22 -1.09 0.20 -0.12 121.20 126.93 2hm9 s ILE 96 Ca -0.07 -0.90 0.22 0.00 -2.23 0.00 0.00 60.65 57.67 2hm9 s ILE 96 Cb -0.13 -4.08 0.21 0.00 -1.58 0.00 0.00 42.46 36.88 2hm9 s ILE 96 CO 0.03 -0.51 1.70 0.00 -1.23 0.00 0.00 174.94 174.93 2hm9 n ALA 97 N 5.26 1.94 0.00 9.38 0.00 -0.21 -2.24 120.51 134.64 2hm9 n ALA 97 Ca -0.12 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2hm9 n ALA 97 Cb 0.45 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.52 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 0.62 0.82 0.00 0.00 0.00 -1.23 -4.82 105.19 100.57 2hm9 n GLY 98 Ca 0.04 -1.89 0.00 0.00 0.00 0.00 0.00 46.02 44.18 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 -0.92 0.69 0.35 -0.02 0.00 -1.26 0.38 105.19 104.42 2hm9 n GLY 99 Ca 0.00 -1.88 -0.03 0.00 0.00 0.00 0.00 46.02 44.10 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 -1.16 1.20 -0.72 4.61 0.00 -1.94 0.37 119.26 121.61 2hm9 h ALA 100 Ca 0.00 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 2hm9 h ALA 100 Cb 0.00 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.42 2hm9 h ALA 100 CO 0.00 0.64 0.26 0.37 0.00 0.00 0.00 179.25 180.52 2hm9 h GLN 101 N 1.18 1.09 -0.42 0.00 4.15 -1.98 -0.67 115.11 118.46 2hm9 h GLN 101 Ca 0.29 -0.21 -0.05 0.00 0.77 0.00 0.00 58.65 59.45 2hm9 h GLN 101 Cb 0.06 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 27.56 2hm9 h GLN 101 CO -0.04 0.91 0.06 0.82 -1.93 0.00 0.00 178.83 178.65 2hm9 h ILE 102 N 1.06 1.25 -0.59 2.39 1.08 -1.55 -2.12 117.51 119.03 2hm9 h ILE 102 Ca 0.24 -0.90 -0.00 0.00 -0.39 0.00 0.00 64.86 63.81 2hm9 h ILE 102 Cb 0.25 1.01 -0.03 0.00 -3.07 0.00 0.00 36.82 34.97 2hm9 h ILE 102 CO -0.01 0.31 0.35 -0.26 -0.69 0.00 0.00 178.15 177.85 2hm9 h PHE 103 N 0.56 0.78 -0.70 1.37 0.04 0.15 -2.30 116.94 116.84 2hm9 h PHE 103 Ca 0.13 -0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.89 2hm9 h PHE 103 Cb 0.39 -0.26 -0.03 0.00 2.20 0.00 0.00 35.95 38.25 2hm9 h PHE 103 CO 0.03 0.53 0.43 1.15 -0.60 0.00 0.00 178.31 179.85 2hm9 h THR 104 N 0.80 1.20 -0.65 -1.55 2.02 -0.98 0.90 112.91 114.65 2hm9 h THR 104 Ca 0.21 -0.43 -0.04 0.00 0.77 0.00 0.00 66.41 66.92 2hm9 h THR 104 Cb -0.02 0.22 -0.03 0.00 -1.74 0.00 0.00 68.15 66.58 2hm9 h THR 104 CO -0.04 0.20 0.24 0.00 0.37 0.00 0.00 175.52 176.29 2hm9 h ALA 105 N 1.23 1.19 -0.27 6.16 0.00 -0.98 -3.14 119.26 123.44 2hm9 h ALA 105 Ca 0.25 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2hm9 h ALA 105 Cb -0.04 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.49 2hm9 h ALA 105 CO -0.05 0.58 0.00 1.19 0.00 0.00 0.00 179.25 180.97 2hm9 n PHE 106 N -4.29 0.50 -0.25 0.00 3.72 -0.90 -4.72 117.46 111.52 2hm9 n PHE 106 Ca 0.06 -0.61 -0.06 0.00 -0.05 0.00 0.00 57.45 56.79 2hm9 n PHE 106 Cb 0.19 -0.10 0.05 0.00 -0.94 0.00 0.00 39.48 38.68 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 1.63 0.96 -0.29 -1.08 3.64 0.89 -2.61 116.57 119.71 2hm9 h LYS 107 Ca 0.00 -0.10 -0.05 0.00 -1.27 0.00 0.00 60.65 59.23 2hm9 h LYS 107 Cb 0.88 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 32.49 2hm9 h LYS 107 CO 0.05 0.70 -0.04 0.22 -2.27 0.00 0.00 179.45 178.12 2hm9 h ASP 108 N 0.96 0.42 -0.36 4.20 1.82 -1.83 -2.95 116.42 118.67 2hm9 h ASP 108 Ca 0.25 -0.08 0.00 0.00 -0.39 0.00 0.00 57.03 56.81 2hm9 h ASP 108 Cb 0.00 -0.11 0.00 0.00 0.68 0.00 0.00 39.33 39.90 2hm9 h ASP 108 CO -0.04 0.52 0.00 0.47 -1.61 0.00 0.00 179.24 178.57 2hm9 n ASP 109 N -4.28 2.52 -4.50 2.28 9.92 -1.00 -4.89 116.55 116.60 2hm9 n ASP 109 Ca 0.01 -2.16 -0.34 0.00 -0.53 0.00 0.00 54.79 51.77 2hm9 n ASP 109 Cb 0.25 -0.37 -0.12 0.00 -0.64 0.00 0.00 41.12 40.24 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 -1.63 4.03 -0.13 2.53 1.01 -1.12 -4.49 120.40 120.60 2hm9 s VAL 110 Ca 0.27 -0.30 0.19 0.00 0.00 0.00 0.00 61.98 62.13 2hm9 s VAL 110 Cb 0.16 -2.79 -0.18 0.00 0.00 0.00 0.00 36.38 33.57 2hm9 s VAL 110 CO 0.14 0.47 0.65 0.47 0.00 0.00 0.00 175.10 176.83 2hm9 n ASP 111 N 3.70 0.52 -4.21 3.32 9.92 -1.12 -4.75 116.55 123.93 2hm9 n ASP 111 Ca -0.17 0.22 -0.32 0.00 -0.53 0.00 0.00 54.79 53.99 2hm9 n ASP 111 Cb 0.52 0.75 -0.16 0.00 -0.64 0.00 0.00 41.12 41.59 2hm9 n ASP 111 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 2hm9 s THR 112 N -3.04 2.22 -0.15 -3.53 2.01 -1.15 -0.57 115.64 111.43 2hm9 s THR 112 Ca -0.05 -0.94 0.00 0.00 0.31 0.00 0.00 61.69 61.02 2hm9 s THR 112 Cb 0.09 -1.89 -0.00 0.00 0.01 0.00 0.00 72.50 70.71 2hm9 s THR 112 CO 0.83 0.55 -0.15 -0.76 -0.69 0.00 0.00 174.62 174.40 2hm9 s LEU 113 N 0.63 2.51 -0.19 4.42 1.43 0.22 0.28 118.68 127.98 2hm9 s LEU 113 Ca -0.11 -0.44 -0.01 0.00 -1.03 0.00 0.00 54.13 52.54 2hm9 s LEU 113 Cb -0.16 -1.57 0.00 0.00 0.03 0.00 0.00 46.19 44.49 2hm9 s LEU 113 CO 0.02 0.11 -0.12 -0.76 0.23 0.00 0.00 176.35 175.83 2hm9 s LEU 114 N 0.68 2.54 -0.03 1.79 1.43 0.41 0.27 118.68 125.77 2hm9 s LEU 114 Ca -0.08 -0.49 0.03 0.00 -1.03 0.00 0.00 54.13 52.56 2hm9 s LEU 114 Cb -0.16 -1.61 0.00 0.00 0.03 0.00 0.00 46.19 44.45 2hm9 s LEU 114 CO 0.02 0.02 -0.12 0.54 0.23 0.00 0.00 176.35 177.03 2hm9 s VAL 115 N 1.23 1.04 -0.16 -1.59 0.11 0.02 -2.64 120.40 118.42 2hm9 s VAL 115 Ca 0.03 -0.50 -0.03 0.00 -2.93 0.00 0.00 61.98 58.55 2hm9 s VAL 115 Cb -0.14 -0.91 -0.02 0.00 -1.53 0.00 0.00 36.38 33.77 2hm9 s VAL 115 CO -0.06 0.31 -0.06 -0.89 -3.33 0.00 0.00 175.10 171.08 2hm9 s THR 116 N 0.14 3.59 -0.10 5.04 2.01 -1.04 -1.20 115.64 124.09 2hm9 s THR 116 Ca -0.04 -0.46 0.02 0.00 0.31 0.00 0.00 61.69 61.52 2hm9 s THR 116 Cb -0.10 -2.57 -0.02 0.00 0.01 0.00 0.00 72.50 69.83 2hm9 s THR 116 CO 0.01 0.49 -0.15 -0.60 -0.69 0.00 0.00 174.62 173.68 2hm9 s ARG 117 N 0.56 3.07 -0.17 4.92 3.00 -0.67 -0.19 118.95 129.46 2hm9 s ARG 117 Ca -0.04 -0.71 -0.04 0.00 -1.00 0.00 0.00 55.73 53.94 2hm9 s ARG 117 Cb -0.15 -2.51 -0.02 0.00 0.00 0.00 0.00 34.95 32.27 2hm9 s ARG 117 CO 0.03 0.34 -0.03 -0.51 0.00 0.00 0.00 175.30 175.12 2hm9 s LEU 118 N 0.02 3.20 0.24 -0.88 1.02 -1.09 -1.62 118.68 119.56 2hm9 s LEU 118 Ca -0.05 -0.17 -0.05 0.00 0.02 0.00 0.00 54.13 53.88 2hm9 s LEU 118 Cb -0.14 -1.78 0.26 0.00 0.02 0.00 0.00 46.19 44.55 2hm9 s LEU 118 CO 0.04 0.13 1.82 0.00 0.02 0.00 0.00 176.35 178.36 2hm9 h ALA 119 N 6.97 1.14 -2.79 4.21 0.00 -1.71 -2.62 119.26 124.46 2hm9 h ALA 119 Ca -0.32 -0.18 -0.51 0.00 0.00 0.00 0.00 54.91 53.90 2hm9 h ALA 119 Cb 1.19 -0.29 0.05 0.00 0.00 0.00 0.00 17.79 18.73 2hm9 h ALA 119 CO 0.62 0.62 0.53 0.20 0.00 0.00 0.00 179.25 181.22 2hm9 s GLY 120 N -3.42 2.94 0.42 0.00 0.00 -1.23 -4.74 107.32 101.29 2hm9 s GLY 120 Ca -0.12 1.03 -0.23 0.00 0.00 0.00 0.00 44.72 45.40 2hm9 s GLY 120 CO 0.82 1.60 1.04 -1.35 0.00 0.00 0.00 173.10 175.21 2hm9 s SER 121 N -0.91 6.66 0.07 1.64 1.04 -1.26 -4.39 113.70 116.55 2hm9 s SER 121 Ca 0.52 1.99 0.03 0.00 0.48 0.00 0.00 55.95 58.98 2hm9 s SER 121 Cb -0.33 -2.58 -0.03 0.00 0.10 0.00 0.00 66.02 63.18 2hm9 s SER 121 CO 0.43 -0.56 -0.10 -0.36 0.98 0.00 0.00 173.24 173.63 2hm9 s PHE 122 N -1.77 0.94 -0.05 5.02 0.40 -1.26 -5.06 117.98 116.20 2hm9 s PHE 122 Ca 0.60 -0.58 0.06 0.00 -0.60 0.00 0.00 56.93 56.41 2hm9 s PHE 122 Cb -0.20 -0.53 -0.01 0.00 0.51 0.00 0.00 43.02 42.79 2hm9 s PHE 122 CO 0.25 -0.03 -0.23 -2.00 0.70 0.00 0.00 175.22 173.90 2hm9 s GLU 123 N -2.25 2.32 0.18 0.44 2.12 -1.26 -4.89 118.70 115.36 2hm9 s GLU 123 Ca -0.01 -0.84 -0.24 0.00 0.36 0.00 0.00 54.97 54.24 2hm9 s GLU 123 Cb -0.06 -2.00 0.05 0.00 0.26 0.00 0.00 34.13 32.38 2hm9 s GLU 123 CO 0.00 0.37 0.83 0.20 -0.54 0.00 0.00 175.26 176.12 2hm9 s GLY 124 N -0.17 -0.26 0.00 -1.50 0.00 -1.26 -4.91 107.32 99.22 2hm9 s GLY 124 Ca -0.02 0.13 0.27 0.00 0.00 0.00 0.00 44.72 45.10 2hm9 s GLY 124 CO 0.03 0.03 1.66 1.22 0.00 0.00 0.00 173.10 176.04 2hm9 n ASP 125 N -0.43 1.18 -4.24 1.64 8.00 -0.54 -4.83 116.55 117.33 2hm9 n ASP 125 Ca -0.07 -1.13 -0.32 0.00 0.71 0.00 0.00 54.79 53.98 2hm9 n ASP 125 Cb 0.61 0.07 -0.16 0.00 -0.02 0.00 0.00 41.12 41.61 2hm9 n ASP 125 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2hm9 s THR 126 N -2.29 2.29 0.07 -3.53 2.01 0.12 -4.88 115.64 109.44 2hm9 s THR 126 Ca 0.30 -0.93 0.08 0.00 0.31 0.00 0.00 61.69 61.46 2hm9 s THR 126 Cb 0.20 -1.91 -0.03 0.00 0.01 0.00 0.00 72.50 70.77 2hm9 s THR 126 CO 0.44 0.55 -0.20 -0.54 -0.69 0.00 0.00 174.62 174.17 2hm9 s LYS 127 N 0.49 1.87 0.34 4.92 3.01 -1.26 -2.48 119.74 126.63 2hm9 s LYS 127 Ca -0.14 -1.10 -0.28 0.00 -1.01 0.00 0.00 55.97 53.45 2hm9 s LYS 127 Cb -0.17 -2.10 -0.09 0.00 -1.01 0.00 0.00 37.83 34.45 2hm9 s LYS 127 CO 0.05 0.51 1.17 1.41 0.51 0.00 0.00 175.35 179.00 2hm9 s MET 128 N -1.68 4.36 0.60 1.68 -2.45 -1.15 -4.83 119.30 115.82 2hm9 s MET 128 Ca 0.15 1.90 -0.19 0.00 -1.25 0.00 0.00 55.69 56.30 2hm9 s MET 128 Cb -0.10 -2.97 -0.03 0.00 1.25 0.00 0.00 34.83 32.98 2hm9 s MET 128 CO 0.06 -0.07 1.27 0.96 1.05 0.00 0.00 175.02 178.30 2hm9 s ILE 129 N -1.26 2.28 0.46 10.11 -5.25 -1.26 -4.94 121.20 121.34 2hm9 s ILE 129 Ca 0.50 0.18 -0.25 0.00 -0.99 0.00 0.00 60.65 60.10 2hm9 s ILE 129 Cb -0.33 -3.08 -0.08 0.00 2.95 0.00 0.00 42.46 41.92 2hm9 s ILE 129 CO 0.43 -0.03 1.41 -2.16 -1.79 0.00 0.00 174.94 172.80 2hm9 s PRO 130 N -3.23 3.64 0.06 0.37 0.04 -1.26 -5.03 135.00 129.59 2hm9 s PRO 130 Ca 0.78 2.39 0.07 0.00 0.04 0.00 0.00 61.00 64.28 2hm9 s PRO 130 Cb -0.35 -2.62 -0.03 0.00 0.04 0.00 0.00 34.50 31.54 2hm9 s PRO 130 CO 0.39 -0.84 -0.20 -0.51 0.04 0.00 0.00 177.00 175.88 2hm9 s LEU 131 N -2.79 2.21 -0.91 -3.56 1.43 -1.26 -5.08 118.68 108.72 2hm9 s LEU 131 Ca 0.62 -0.57 -0.18 0.00 -1.03 0.00 0.00 54.13 52.97 2hm9 s LEU 131 Cb -0.43 -0.90 0.14 0.00 0.03 0.00 0.00 46.19 45.02 2hm9 s LEU 131 CO 0.55 0.11 1.09 0.20 0.23 0.00 0.00 176.35 178.53 2hm9 s ASN 132 N -1.41 6.62 0.27 2.29 0.01 -1.26 -4.85 114.94 116.62 2hm9 s ASN 132 Ca 0.06 -2.06 -0.03 0.00 -0.71 0.00 0.00 52.86 50.12 2hm9 s ASN 132 Cb -0.09 -2.38 0.37 0.00 0.41 0.00 0.00 41.25 39.56 2hm9 s ASN 132 CO 0.02 -1.03 1.88 -0.50 -1.51 0.00 0.00 177.10 175.96 2hm9 h TRP 133 N 8.77 1.02 -0.38 2.20 -0.00 -1.98 -2.62 115.95 122.96 2hm9 h TRP 133 Ca 0.13 -0.04 -0.06 0.00 -0.00 0.00 0.00 58.89 58.93 2hm9 h TRP 133 Cb 1.03 -0.32 -0.02 0.00 -0.00 0.00 0.00 29.16 29.85 2hm9 h TRP 133 CO 1.15 0.73 -0.01 0.22 -0.00 0.00 0.00 178.44 180.53 2hm9 h ASP 134 N 1.02 0.56 -0.15 -3.49 1.82 -2.05 -2.78 116.42 111.35 2hm9 h ASP 134 Ca 0.25 -0.12 -0.06 0.00 -0.39 0.00 0.00 57.03 56.71 2hm9 h ASP 134 Cb 0.09 -0.15 -0.02 0.00 0.68 0.00 0.00 39.33 39.93 2hm9 h ASP 134 CO -0.03 0.64 -0.09 -0.78 -1.61 0.00 0.00 179.24 177.37 2hm9 h ASP 135 N 0.57 0.46 -3.53 2.28 3.58 -1.88 -3.43 116.42 114.48 2hm9 h ASP 135 Ca 0.12 -0.11 -0.68 0.00 0.42 0.00 0.00 57.03 56.78 2hm9 h ASP 135 Cb 0.37 -0.12 -0.17 0.00 1.72 0.00 0.00 39.33 41.13 2hm9 h ASP 135 CO 0.01 0.59 -0.67 -0.36 -2.88 0.00 0.00 179.24 175.94 2hm9 s PHE 136 N -4.81 3.02 -0.15 0.28 0.40 -1.05 -4.00 117.98 111.68 2hm9 s PHE 136 Ca -0.07 0.08 -0.03 0.00 -0.60 0.00 0.00 56.93 56.31 2hm9 s PHE 136 Cb 0.15 -1.73 -0.02 0.00 0.51 0.00 0.00 43.02 41.93 2hm9 s PHE 136 CO 0.77 0.39 -0.06 0.99 0.70 0.00 0.00 175.22 178.01 2hm9 s THR 137 N -0.87 3.71 0.20 0.64 2.01 -1.10 -4.83 115.64 115.41 2hm9 s THR 137 Ca 0.13 -0.42 -0.31 0.00 0.31 0.00 0.00 61.69 61.40 2hm9 s THR 137 Cb -0.11 -2.61 -0.11 0.00 0.01 0.00 0.00 72.50 69.68 2hm9 s THR 137 CO 0.03 0.50 1.61 -0.75 -0.69 0.00 0.00 174.62 175.32 2hm9 s LYS 138 N 0.34 4.18 -0.24 4.92 2.20 -1.26 -1.85 119.74 128.03 2hm9 s LYS 138 Ca -0.06 2.46 -0.17 0.00 -0.36 0.00 0.00 55.97 57.85 2hm9 s LYS 138 Cb -0.15 -3.11 -0.14 0.00 -1.51 0.00 0.00 37.83 32.93 2hm9 s LYS 138 CO 0.04 -0.64 -0.14 1.33 -0.36 0.00 0.00 175.35 175.58 2hm9 n VAL 139 N 3.60 1.52 -3.98 4.02 0.24 0.40 -4.90 118.33 119.23 2hm9 n VAL 139 Ca 0.13 -0.18 -0.11 0.00 -2.04 0.00 0.00 64.34 62.14 2hm9 n VAL 139 Cb 0.37 -2.00 -0.12 0.00 -1.47 0.00 0.00 33.84 30.62 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 -7.05 0.33 0.02 -1.34 0.01 -1.19 -5.03 113.70 99.45 2hm9 s SER 140 Ca -0.33 -0.39 0.01 0.00 1.31 0.00 0.00 55.95 56.55 2hm9 s SER 140 Cb 0.10 0.06 -0.01 0.00 0.21 0.00 0.00 66.02 66.37 2hm9 s SER 140 CO 0.51 -0.20 -0.04 -0.55 0.41 0.00 0.00 173.24 173.37 2hm9 s SER 141 N -1.12 0.36 -0.00 2.44 0.15 -1.26 -0.57 113.70 113.70 2hm9 s SER 141 Ca -0.11 -0.36 0.02 0.00 0.70 0.00 0.00 55.95 56.21 2hm9 s SER 141 Cb -0.08 0.05 -0.01 0.00 -1.71 0.00 0.00 66.02 64.27 2hm9 s SER 141 CO -0.01 -0.17 -0.07 -0.60 1.20 0.00 0.00 173.24 173.59 2hm9 s ARG 142 N -1.02 0.56 -0.14 5.44 6.06 0.23 -4.98 118.95 125.10 2hm9 s ARG 142 Ca -0.09 -0.25 0.01 0.00 -2.50 0.00 0.00 55.73 52.90 2hm9 s ARG 142 Cb -0.07 -0.54 -0.00 0.00 0.06 0.00 0.00 34.95 34.40 2hm9 s ARG 142 CO -0.00 0.15 -0.18 0.99 -2.50 0.00 0.00 175.30 173.76 2hm9 s THR 143 N -0.17 2.53 -0.07 4.11 2.01 -1.26 0.10 115.64 122.88 2hm9 s THR 143 Ca 0.03 -0.83 0.03 0.00 0.31 0.00 0.00 61.69 61.23 2hm9 s THR 143 Cb -0.03 -2.04 0.00 0.00 0.01 0.00 0.00 72.50 70.45 2hm9 s THR 143 CO -0.00 0.53 -0.18 0.68 -0.69 0.00 0.00 174.62 174.96 2hm9 s VAL 144 N 0.63 1.56 -0.20 3.82 -7.23 -0.72 -5.01 120.40 113.25 2hm9 s VAL 144 Ca -0.09 -0.74 -0.03 0.00 -1.81 0.00 0.00 61.98 59.31 2hm9 s VAL 144 Cb -0.16 -1.37 -0.01 0.00 0.56 0.00 0.00 36.38 35.40 2hm9 s VAL 144 CO 0.03 0.45 -0.05 -1.61 -0.31 0.00 0.00 175.10 173.60 2hm9 s GLU 145 N 0.42 3.42 0.81 4.82 2.02 -1.26 -2.14 118.70 126.79 2hm9 s GLU 145 Ca -0.14 -0.62 -0.06 0.00 0.02 0.00 0.00 54.97 54.17 2hm9 s GLU 145 Cb -0.16 -2.94 0.16 0.00 0.10 0.00 0.00 34.13 31.28 2hm9 s GLU 145 CO 0.05 -0.08 1.11 0.34 0.02 0.00 0.00 175.26 176.71 2hm9 s ASP 146 N 1.17 3.88 0.13 -0.19 -1.08 -1.26 -4.95 116.67 114.37 2hm9 s ASP 146 Ca 0.02 -0.22 -0.17 0.00 -0.52 0.00 0.00 52.55 51.67 2hm9 s ASP 146 Cb -0.14 -0.02 -0.01 0.00 -1.46 0.00 0.00 42.92 41.29 2hm9 s ASP 146 CO -0.01 -2.19 1.73 0.71 0.52 0.00 0.00 175.17 175.92 2hm9 h THR 147 N -0.92 1.15 -2.85 1.71 1.35 -1.99 -3.43 112.91 107.93 2hm9 h THR 147 Ca -0.38 -0.41 -0.63 0.00 -0.55 0.00 0.00 66.41 64.43 2hm9 h THR 147 Cb 1.25 0.76 -0.06 0.00 -1.73 0.00 0.00 68.15 68.37 2hm9 h THR 147 CO 0.38 0.16 -0.37 0.20 -0.25 0.00 0.00 175.52 175.64 2hm9 s ASN 148 N -5.69 6.54 0.30 5.36 -0.87 -1.26 -5.00 114.94 114.32 2hm9 s ASN 148 Ca -0.13 0.64 0.01 0.00 -1.57 0.00 0.00 52.86 51.81 2hm9 s ASN 148 Cb 0.10 -2.13 0.55 0.00 -0.02 0.00 0.00 41.25 39.76 2hm9 s ASN 148 CO 0.73 0.32 1.89 1.55 -2.57 0.00 0.00 177.10 179.02 2hm9 h PRO 149 N 4.46 0.97 -0.63 -0.60 0.13 -1.95 -1.03 132.00 133.36 2hm9 h PRO 149 Ca -0.52 -0.06 -0.07 0.00 -0.87 0.00 0.00 66.00 64.48 2hm9 h PRO 149 Cb 1.21 -0.22 -0.03 0.00 0.13 0.00 0.00 31.00 32.10 2hm9 h PRO 149 CO 0.62 0.64 0.12 0.00 -0.23 0.00 0.00 178.00 179.16 2hm9 h ALA 150 N 1.52 1.03 -0.27 -0.56 0.00 -1.93 -2.72 119.26 116.33 2hm9 h ALA 150 Ca 0.42 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.99 2hm9 h ALA 150 Cb 0.31 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2hm9 h ALA 150 CO -0.18 0.63 -0.23 -0.07 0.00 0.00 0.00 179.25 179.39 2hm9 h LEU 151 N 0.95 0.52 -9.88 0.00 3.38 -1.64 -3.26 115.31 105.38 2hm9 h LEU 151 Ca 0.20 -0.17 -0.53 0.00 0.09 0.00 0.00 57.88 57.46 2hm9 h LEU 151 Cb 0.38 -0.14 0.10 0.00 0.09 0.00 0.00 40.66 41.09 2hm9 h LEU 151 CO 0.01 0.75 0.85 -0.89 0.09 0.00 0.00 178.44 179.25 2hm9 s THR 152 N -4.54 2.00 0.13 0.22 2.01 -0.50 -4.63 115.64 110.34 2hm9 s THR 152 Ca -0.07 0.00 -0.07 0.00 0.31 0.00 0.00 61.69 61.86 2hm9 s THR 152 Cb 0.14 -3.00 -0.01 0.00 0.01 0.00 0.00 72.50 69.63 2hm9 s THR 152 CO 0.79 0.00 0.20 -1.38 -0.69 0.00 0.00 174.62 173.55 2hm9 s HIS 153 N -0.55 0.43 0.08 4.92 -3.43 -0.91 -3.04 115.29 112.78 2hm9 s HIS 153 Ca 0.58 -0.82 0.06 0.00 -0.80 0.00 0.00 55.06 54.08 2hm9 s HIS 153 Cb -0.48 -0.15 -0.03 0.00 -1.43 0.00 0.00 32.58 30.49 2hm9 s HIS 153 CO 0.56 -0.62 -0.15 0.99 -2.00 0.00 0.00 174.74 173.52 2hm9 s THR 154 N -3.95 1.23 -0.20 -5.38 2.01 -0.64 -1.76 115.64 106.94 2hm9 s THR 154 Ca 0.15 -1.34 -0.05 0.00 0.31 0.00 0.00 61.69 60.76 2hm9 s THR 154 Cb 0.05 -1.16 -0.02 0.00 0.01 0.00 0.00 72.50 71.37 2hm9 s THR 154 CO -0.03 -0.18 0.00 -0.31 -0.69 0.00 0.00 174.62 173.41 2hm9 s TYR 155 N -1.24 3.04 -0.05 4.92 2.02 0.28 -1.68 117.35 124.65 2hm9 s TYR 155 Ca -0.00 -0.48 0.04 0.00 -0.37 0.00 0.00 57.07 56.26 2hm9 s TYR 155 Cb -0.10 -2.09 -0.00 0.00 -0.40 0.00 0.00 41.96 39.36 2hm9 s TYR 155 CO 0.03 -0.26 -0.19 -1.21 -1.57 0.00 0.00 175.55 172.35 2hm9 s GLU 156 N 1.06 1.99 -0.11 -0.62 2.02 -0.34 0.78 118.70 123.48 2hm9 s GLU 156 Ca 0.02 -0.67 0.03 0.00 0.02 0.00 0.00 54.97 54.38 2hm9 s GLU 156 Cb -0.14 -1.70 0.01 0.00 0.10 0.00 0.00 34.13 32.40 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 0.05 1.95 -0.06 2.63 1.01 0.27 -0.80 120.40 125.45 2hm9 s VAL 157 Ca -0.05 -0.94 0.02 0.00 0.00 0.00 0.00 61.98 61.01 2hm9 s VAL 157 Cb -0.12 -1.71 -0.03 0.00 0.00 0.00 0.00 36.38 34.52 2hm9 s VAL 157 CO 0.03 0.53 -0.12 0.26 0.00 0.00 0.00 175.10 175.81 2hm9 s TRP 158 N 0.57 2.79 -0.10 5.22 0.52 0.14 -0.45 118.94 127.63 2hm9 s TRP 158 Ca -0.14 -0.12 0.03 0.00 0.02 0.00 0.00 56.10 55.90 2hm9 s TRP 158 Cb -0.17 -1.67 -0.00 0.00 -1.15 0.00 0.00 33.47 30.48 2hm9 s TRP 158 CO 0.04 0.22 -0.22 -0.65 0.02 0.00 0.00 176.95 176.36 2hm9 s GLN 159 N -0.70 3.08 0.24 4.98 -1.52 -0.77 0.73 119.66 125.69 2hm9 s GLN 159 Ca 0.11 -0.85 -0.30 0.00 -1.95 0.00 0.00 55.36 52.37 2hm9 s GLN 159 Cb -0.11 -2.35 -0.10 0.00 -0.22 0.00 0.00 33.01 30.23 2hm9 s GLN 159 CO 0.01 0.20 1.50 0.21 -0.25 0.00 0.00 175.29 176.96 2hm9 s LYS 160 N 0.31 4.23 0.24 2.91 2.20 0.27 -2.70 119.74 127.20 2hm9 s LYS 160 Ca -0.17 2.37 -0.30 0.00 -0.36 0.00 0.00 55.97 57.51 2hm9 s LYS 160 Cb -0.17 -3.10 -0.10 0.00 -1.51 0.00 0.00 37.83 32.95 2hm9 s LYS 160 CO 0.08 -0.50 1.35 0.15 -0.36 0.00 0.00 175.35 176.07 2hm9 s LYS 161 N -0.02 4.35 0.00 4.03 1.02 -1.26 -4.97 119.74 122.89 2hm9 s LYS 161 Ca 0.63 2.16 0.29 0.00 0.02 0.00 0.00 55.97 59.07 2hm9 s LYS 161 Cb -0.43 -3.14 1.35 0.00 -0.52 0.00 0.00 37.83 35.09 2hm9 s LYS 161 CO 0.41 -0.28 1.91 0.00 -0.92 0.00 0.00 175.35 176.47