#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 1.21 -0.26 2.41 0.00 0.37 -3.10 121.76 122.38 2hm9 s ALA 2 Ca 0.00 -0.90 -0.08 0.00 0.00 0.00 0.00 51.96 50.98 2hm9 s ALA 2 Cb 0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 23.12 22.94 2hm9 s ALA 2 CO 0.00 0.21 0.08 -0.06 0.00 0.00 0.00 175.76 176.00 2hm9 s PHE 3 N -1.00 3.10 -0.23 0.00 0.40 0.17 0.02 117.98 120.44 2hm9 s PHE 3 Ca 0.01 -0.50 0.02 0.00 -0.60 0.00 0.00 56.93 55.86 2hm9 s PHE 3 Cb -0.09 -2.26 0.05 0.00 0.51 0.00 0.00 43.02 41.23 2hm9 s PHE 3 CO 0.02 -0.39 -0.13 -1.17 0.70 0.00 0.00 175.22 174.24 2hm9 s LEU 4 N 1.60 2.90 0.15 -0.37 2.96 -1.13 0.13 118.68 124.92 2hm9 s LEU 4 Ca 0.06 -1.12 -0.19 0.00 -0.22 0.00 0.00 54.13 52.66 2hm9 s LEU 4 Cb -0.16 -1.47 0.05 0.00 0.50 0.00 0.00 46.19 45.11 2hm9 s LEU 4 CO 0.04 -0.14 0.50 -1.66 -1.32 0.00 0.00 176.35 173.77 2hm9 s TRP 5 N 1.21 -0.30 -0.03 5.38 -2.14 -1.09 -4.50 118.94 117.46 2hm9 s TRP 5 Ca -0.04 0.02 0.05 0.00 2.66 0.00 0.00 56.10 58.79 2hm9 s TRP 5 Cb -0.18 0.39 -0.01 0.00 -3.10 0.00 0.00 33.47 30.58 2hm9 s TRP 5 CO -0.08 -0.80 -0.19 0.00 -2.66 0.00 0.00 176.95 173.22 2hm9 s ALA 6 N -3.80 1.64 0.05 2.67 0.00 -1.26 -2.25 121.76 118.80 2hm9 s ALA 6 Ca 0.04 -0.80 0.01 0.00 0.00 0.00 0.00 51.96 51.20 2hm9 s ALA 6 Cb 0.00 -0.47 -0.03 0.00 0.00 0.00 0.00 23.12 22.62 2hm9 s ALA 6 CO -0.10 0.35 -0.05 1.14 0.00 0.00 0.00 175.76 177.10 2hm9 s GLN 7 N -0.24 0.54 0.83 0.00 -2.07 0.16 -4.67 119.66 114.22 2hm9 s GLN 7 Ca 0.02 -0.95 -0.07 0.00 -1.82 0.00 0.00 55.36 52.54 2hm9 s GLN 7 Cb -0.10 -0.01 0.16 0.00 -1.09 0.00 0.00 33.01 31.98 2hm9 s GLN 7 CO 0.01 -0.04 1.15 0.16 -1.32 0.00 0.00 175.29 175.25 2hm9 s ASP 8 N -2.20 3.75 0.21 12.60 -4.77 -1.03 -2.43 116.67 122.81 2hm9 s ASP 8 Ca -0.03 -0.12 -0.10 0.00 -3.30 0.00 0.00 52.55 49.00 2hm9 s ASP 8 Cb -0.02 -0.08 0.16 0.00 -1.09 0.00 0.00 42.92 41.89 2hm9 s ASP 8 CO -0.04 -2.28 1.87 0.08 0.70 0.00 0.00 175.17 175.50 2hm9 h ARG 9 N -1.04 1.03 -0.53 2.11 -0.00 -1.47 -2.74 114.38 111.75 2hm9 h ARG 9 Ca -0.39 -0.08 -0.05 0.00 -0.00 0.00 0.00 59.98 59.46 2hm9 h ARG 9 Cb 1.25 -0.22 -0.02 0.00 -0.00 0.00 0.00 29.97 30.97 2hm9 h ARG 9 CO 0.38 0.71 0.13 -0.44 -0.00 0.00 0.00 179.97 180.75 2hm9 h ASP 10 N 1.05 0.80 0.00 0.08 3.32 -1.88 -3.47 116.42 116.31 2hm9 h ASP 10 Ca 0.28 -0.23 0.00 0.00 0.02 0.00 0.00 57.03 57.10 2hm9 h ASP 10 Cb -0.08 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.26 2hm9 h ASP 10 CO -0.06 0.82 0.00 0.61 -1.72 0.00 0.00 179.24 178.90 2hm9 n GLY 11 N -0.62 0.73 3.82 2.75 0.00 -1.03 -5.13 105.19 105.71 2hm9 n GLY 11 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 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 4.26 -0.14 0.99 2.96 -1.26 -2.84 118.68 122.64 2hm9 s LEU 12 Ca 0.00 1.40 0.05 0.00 -0.22 0.00 0.00 54.13 55.37 2hm9 s LEU 12 Cb 0.00 -3.76 -0.23 0.00 0.50 0.00 0.00 46.19 42.70 2hm9 s LEU 12 CO 0.00 -0.04 0.27 2.30 -1.32 0.00 0.00 176.35 177.56 2hm9 n ILE 13 N 0.39 1.60 0.00 6.68 -5.35 -0.99 -2.45 119.36 119.23 2hm9 n ILE 13 Ca -0.00 -0.72 0.00 0.00 -0.27 0.00 0.00 62.75 61.76 2hm9 n ILE 13 Cb 0.52 -1.23 0.00 0.00 -1.74 0.00 0.00 39.64 37.19 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 1.88 -0.16 3.13 3.28 0.00 -0.93 -4.61 105.19 107.78 2hm9 n GLY 14 Ca -0.31 -0.92 -0.28 0.00 0.00 0.00 0.00 46.02 44.51 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 -2.00 2.14 -0.99 1.61 2.20 -0.44 -0.44 119.74 121.82 2hm9 s LYS 15 Ca 0.00 -0.64 0.00 0.00 -0.36 0.00 0.00 55.97 54.97 2hm9 s LYS 15 Cb 0.00 -1.75 0.00 0.00 -1.51 0.00 0.00 37.83 34.57 2hm9 s LYS 15 CO 0.00 0.18 0.00 -0.25 -0.36 0.00 0.00 175.35 174.92 2hm9 n ASP 16 N 3.42 -3.38 0.00 1.43 8.00 -1.26 -0.50 116.55 124.26 2hm9 n ASP 16 Ca -0.20 0.24 0.00 0.00 0.71 0.00 0.00 54.79 55.54 2hm9 n ASP 16 Cb 0.52 -2.97 0.00 0.00 -0.02 0.00 0.00 41.12 38.65 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 -0.62 2.72 3.79 0.44 0.00 -1.26 -4.84 105.19 105.41 2hm9 n GLY 17 Ca -0.12 -0.13 -0.35 0.00 0.00 0.00 0.00 46.02 45.42 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 -1.64 2.94 -0.49 1.61 -3.43 0.35 -4.85 115.29 109.76 2hm9 s HIS 18 Ca 0.00 1.57 -0.28 0.00 -0.80 0.00 0.00 55.06 55.56 2hm9 s HIS 18 Cb 0.00 -3.16 0.03 0.00 -1.43 0.00 0.00 32.58 28.02 2hm9 s HIS 18 CO 0.00 -1.05 1.08 -0.51 -2.00 0.00 0.00 174.74 172.27 2hm9 s LEU 19 N -3.42 3.72 0.46 5.38 1.43 -1.26 -1.33 118.68 123.65 2hm9 s LEU 19 Ca 0.67 0.29 0.20 0.00 -1.03 0.00 0.00 54.13 54.26 2hm9 s LEU 19 Cb -0.20 -3.38 1.11 0.00 0.03 0.00 0.00 46.19 43.75 2hm9 s LEU 19 CO 0.24 -1.24 1.97 1.55 0.23 0.00 0.00 176.35 179.10 2hm9 h PRO 20 N 9.24 0.00 -6.57 1.29 0.13 -1.90 -3.43 132.00 130.77 2hm9 h PRO 20 Ca -0.24 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.38 2hm9 h PRO 20 Cb 1.06 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.17 2hm9 h PRO 20 CO 1.11 0.21 0.30 1.67 -0.23 0.00 0.00 178.00 181.07 2hm9 s TRP 21 N -4.26 3.86 -1.07 1.56 -2.14 -1.26 -4.99 118.94 110.64 2hm9 s TRP 21 Ca -0.03 1.76 -0.13 0.00 2.66 0.00 0.00 56.10 60.36 2hm9 s TRP 21 Cb 0.14 -2.96 0.21 0.00 -3.10 0.00 0.00 33.47 27.75 2hm9 s TRP 21 CO 0.65 0.32 1.16 -1.58 -2.66 0.00 0.00 176.95 174.85 2hm9 s HIS 22 N -0.46 3.75 -0.67 1.66 2.46 -1.26 -4.91 115.29 115.87 2hm9 s HIS 22 Ca 0.43 -2.19 0.05 0.00 0.47 0.00 0.00 55.06 53.83 2hm9 s HIS 22 Cb -0.24 -4.06 0.21 0.00 -0.13 0.00 0.00 32.58 28.36 2hm9 s HIS 22 CO 0.29 -1.19 0.62 -0.11 -2.47 0.00 0.00 174.74 171.88 2hm9 n LEU 23 N 4.49 3.31 -0.43 8.88 7.94 -1.26 -4.94 117.00 134.99 2hm9 n LEU 23 Ca 0.26 -5.31 0.36 0.00 -1.11 0.00 0.00 56.01 50.21 2hm9 n LEU 23 Cb 0.43 -0.68 0.64 0.00 0.53 0.00 0.00 43.42 44.34 2hm9 n LEU 23 CO 0.50 1.91 1.22 -0.65 -1.11 0.00 0.00 177.39 179.26 2hm9 h PRO 24 N 4.79 0.10 0.54 1.96 0.11 -1.98 0.44 132.00 137.97 2hm9 h PRO 24 Ca 0.17 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.26 2hm9 h PRO 24 Cb 0.71 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.79 2hm9 h PRO 24 CO 0.77 0.06 -0.42 0.22 -0.21 0.00 0.00 178.00 178.42 2hm9 h ASP 25 N 0.10 -1.10 -0.39 -2.05 1.82 -1.97 0.66 116.42 113.49 2hm9 h ASP 25 Ca 0.81 0.08 -0.06 0.00 -0.39 0.00 0.00 57.03 57.47 2hm9 h ASP 25 Cb 2.50 0.35 -0.02 0.00 0.68 0.00 0.00 39.33 42.83 2hm9 h ASP 25 CO -0.44 -0.61 0.03 -0.78 -1.61 0.00 0.00 179.24 175.84 2hm9 h ASP 26 N -0.94 0.71 -0.60 2.28 1.82 -1.36 -1.51 116.42 116.82 2hm9 h ASP 26 Ca -0.06 -0.15 -0.04 0.00 -0.39 0.00 0.00 57.03 56.39 2hm9 h ASP 26 Cb 0.79 -0.19 -0.03 0.00 0.68 0.00 0.00 39.33 40.59 2hm9 h ASP 26 CO 0.01 0.76 0.22 -0.07 -1.61 0.00 0.00 179.24 178.54 2hm9 h LEU 27 N 0.71 0.85 -0.88 2.28 3.38 -0.92 -2.04 115.31 118.69 2hm9 h LEU 27 Ca 0.15 -0.19 0.03 0.00 0.09 0.00 0.00 57.88 57.96 2hm9 h LEU 27 Cb 0.39 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.86 2hm9 h LEU 27 CO 0.01 0.81 0.57 0.45 0.09 0.00 0.00 178.44 180.37 2hm9 h HIS 28 N 0.85 1.07 -0.44 1.13 3.86 0.87 -2.01 115.15 120.48 2hm9 h HIS 28 Ca 0.20 0.03 0.01 0.00 -1.16 0.00 0.00 60.37 59.44 2hm9 h HIS 28 Cb 0.24 -0.36 -0.02 0.00 1.06 0.00 0.00 27.41 28.33 2hm9 h HIS 28 CO 0.01 0.62 0.28 -0.92 0.86 0.00 0.00 177.93 178.79 2hm9 h TYR 29 N 1.11 0.53 -0.34 2.45 3.20 -0.72 -0.17 116.97 123.02 2hm9 h TYR 29 Ca 0.35 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.23 2hm9 h TYR 29 Cb -0.01 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.07 2hm9 h TYR 29 CO -0.02 0.33 0.20 0.35 -1.64 0.00 0.00 178.16 177.39 2hm9 h PHE 30 N 0.57 0.46 -0.67 -3.82 3.57 -0.82 -2.20 116.94 114.03 2hm9 h PHE 30 Ca 0.16 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.64 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 0.32 -0.09 -2.23 0.00 0.00 178.31 176.59 2hm9 h ARG 31 N 0.44 0.97 -0.67 1.11 1.12 -1.08 -2.71 114.38 113.56 2hm9 h ARG 31 Ca 0.12 -0.14 -0.05 0.00 -1.11 0.00 0.00 59.98 58.80 2hm9 h ARG 31 Cb 0.02 -0.17 -0.03 0.00 -0.01 0.00 0.00 29.97 29.77 2hm9 h ARG 31 CO -0.02 0.77 0.23 0.00 -3.11 0.00 0.00 179.97 177.83 2hm9 h ALA 32 N 1.15 1.13 -0.19 2.80 0.00 -0.86 -2.58 119.26 120.70 2hm9 h ALA 32 Ca 0.23 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 2hm9 h ALA 32 Cb 0.12 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2hm9 h ALA 32 CO -0.03 0.61 -0.19 1.96 0.00 0.00 0.00 179.25 181.60 2hm9 h GLN 33 N 0.99 0.32 -0.03 0.00 1.08 -1.16 -2.37 115.11 113.93 2hm9 h GLN 33 Ca 0.22 -0.10 0.00 0.00 -1.45 0.00 0.00 58.65 57.33 2hm9 h GLN 33 Cb 0.25 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.65 2hm9 h GLN 33 CO -0.01 0.51 0.00 0.25 -0.95 0.00 0.00 178.83 178.63 2hm9 n THR 34 N -4.19 0.05 -3.16 -0.54 -2.24 -0.98 -4.59 114.28 98.62 2hm9 n THR 34 Ca -0.00 -0.06 -0.41 0.00 -2.27 0.00 0.00 64.05 61.31 2hm9 n THR 34 Cb 0.33 -0.10 -0.07 0.00 -2.10 0.00 0.00 70.33 68.40 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 -1.95 5.00 -0.25 2.28 -7.23 -0.90 -3.69 120.40 113.66 2hm9 s VAL 35 Ca 0.18 0.91 0.00 0.00 -1.81 0.00 0.00 61.98 61.26 2hm9 s VAL 35 Cb 0.08 -3.92 0.00 0.00 0.56 0.00 0.00 36.38 33.11 2hm9 s VAL 35 CO 0.14 -0.02 0.00 0.61 -0.31 0.00 0.00 175.10 175.52 2hm9 n GLY 36 N 4.36 0.57 3.03 2.32 0.00 -0.92 -5.03 105.19 109.53 2hm9 n GLY 36 Ca -0.02 -0.84 -0.09 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 0.45 -0.02 1.61 3.01 -1.24 -4.85 119.74 116.72 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 0.10 -0.03 0.00 -1.01 0.00 0.00 37.83 36.88 2hm9 s LYS 37 CO 0.00 -0.06 0.88 0.42 0.51 0.00 0.00 175.35 177.10 2hm9 s ILE 38 N -2.38 4.92 0.05 2.17 1.01 -0.64 -3.67 121.20 122.66 2hm9 s ILE 38 Ca -0.06 1.84 0.06 0.00 0.00 0.00 0.00 60.65 62.49 2hm9 s ILE 38 Cb -0.03 -4.22 -0.02 0.00 0.01 0.00 0.00 42.46 38.19 2hm9 s ILE 38 CO -0.04 0.20 -0.16 -0.32 0.00 0.00 0.00 174.94 174.62 2hm9 s MET 39 N 0.90 1.02 -0.08 2.79 -2.45 -0.48 0.26 119.30 121.26 2hm9 s MET 39 Ca 0.47 -0.83 0.04 0.00 -1.25 0.00 0.00 55.69 54.12 2hm9 s MET 39 Cb -0.20 -1.07 0.00 0.00 1.25 0.00 0.00 34.83 34.81 2hm9 s MET 39 CO 0.25 0.26 -0.21 0.08 1.05 0.00 0.00 175.02 176.45 2hm9 s VAL 40 N -0.89 1.80 0.12 10.11 1.01 0.12 -0.06 120.40 132.61 2hm9 s VAL 40 Ca 0.03 -0.88 0.06 0.00 0.00 0.00 0.00 61.98 61.18 2hm9 s VAL 40 Cb -0.08 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.70 2hm9 s VAL 40 CO 0.02 0.50 -0.14 0.68 0.00 0.00 0.00 175.10 176.16 2hm9 s VAL 41 N 0.29 1.34 0.85 2.92 -7.23 0.12 0.10 120.40 118.79 2hm9 s VAL 41 Ca -0.14 -1.72 -0.10 0.00 -1.81 0.00 0.00 61.98 58.21 2hm9 s VAL 41 Cb -0.16 -1.53 0.15 0.00 0.56 0.00 0.00 36.38 35.40 2hm9 s VAL 41 CO 0.06 -0.41 1.18 -0.83 -0.31 0.00 0.00 175.10 174.79 2hm9 s GLY 42 N -2.45 1.75 0.18 2.32 0.00 0.31 0.96 107.32 110.39 2hm9 s GLY 42 Ca 0.09 -1.28 -0.12 0.00 0.00 0.00 0.00 44.72 43.41 2hm9 s GLY 42 CO 0.03 -0.63 1.80 3.21 0.00 0.00 0.00 173.10 177.51 2hm9 h ARG 43 N -1.16 0.88 -0.55 2.90 3.08 -1.89 -1.99 114.38 115.65 2hm9 h ARG 43 Ca -0.42 -0.10 0.01 0.00 0.07 0.00 0.00 59.98 59.54 2hm9 h ARG 43 Cb 1.26 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 31.11 2hm9 h ARG 43 CO 0.43 0.66 0.37 0.00 -1.07 0.00 0.00 179.97 180.36 2hm9 h ARG 44 N 0.87 0.72 -0.41 0.04 3.08 -1.94 -1.61 114.38 115.13 2hm9 h ARG 44 Ca 0.22 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.20 2hm9 h ARG 44 Cb 0.03 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 29.90 2hm9 h ARG 44 CO -0.04 0.47 0.12 1.15 -1.07 0.00 0.00 179.97 180.61 2hm9 h THR 45 N 0.74 1.22 -0.90 2.04 2.02 -1.72 -0.99 112.91 115.32 2hm9 h THR 45 Ca 0.20 -0.73 0.18 0.00 0.77 0.00 0.00 66.41 66.83 2hm9 h THR 45 Cb -0.07 0.93 -0.07 0.00 -1.74 0.00 0.00 68.15 67.19 2hm9 h THR 45 CO -0.05 0.26 0.58 0.22 0.37 0.00 0.00 175.52 176.91 2hm9 h TYR 46 N 0.52 0.70 0.00 3.16 3.20 -0.59 0.98 116.97 124.93 2hm9 h TYR 46 Ca 0.13 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.02 2hm9 h TYR 46 Cb 0.27 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 38.33 2hm9 h TYR 46 CO 0.01 0.22 -0.93 0.39 -1.64 0.00 0.00 178.16 176.21 2hm9 n GLU 47 N -4.56 0.42 -0.02 1.82 1.02 -1.07 -4.16 120.64 114.09 2hm9 n GLU 47 Ca 0.19 0.06 0.01 0.00 -0.02 0.00 0.00 57.16 57.40 2hm9 n GLU 47 Cb 0.59 -1.71 -0.14 0.00 -0.02 0.00 0.00 31.44 30.16 2hm9 n GLU 47 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2hm9 n SER 48 N -2.29 0.26 -4.65 1.62 7.64 -0.17 -4.97 113.62 111.06 2hm9 n SER 48 Ca 0.01 0.11 -0.40 0.00 1.01 0.00 0.00 58.87 59.61 2hm9 n SER 48 Cb 0.49 1.11 0.03 0.00 -1.01 0.00 0.00 64.21 64.82 2hm9 n SER 48 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 2hm9 n PHE 49 N -2.61 1.45 0.19 1.43 7.35 0.32 -4.88 117.46 120.71 2hm9 n PHE 49 Ca -0.15 0.49 -0.13 0.00 -0.76 0.00 0.00 57.45 56.90 2hm9 n PHE 49 Cb 0.84 -2.26 -0.07 0.00 0.35 0.00 0.00 39.48 38.34 2hm9 n PHE 49 CO 0.00 0.00 0.00 -1.35 -0.76 0.00 0.00 176.76 174.65 2hm9 h PRO 50 N 1.37 -0.69 -1.98 -7.13 0.11 -1.93 -3.45 132.00 118.31 2hm9 h PRO 50 Ca -0.47 0.05 0.03 0.00 0.11 0.00 0.00 66.00 65.71 2hm9 h PRO 50 Cb 1.33 0.16 -0.21 0.00 0.11 0.00 0.00 31.00 32.38 2hm9 h PRO 50 CO 0.56 -0.46 0.03 0.15 -0.21 0.00 0.00 178.00 178.07 2hm9 s LYS 51 N -5.12 0.69 0.17 1.05 1.02 -1.26 -5.17 119.74 111.11 2hm9 s LYS 51 Ca -0.13 1.22 0.07 0.00 0.02 0.00 0.00 55.97 57.14 2hm9 s LYS 51 Cb 0.04 0.18 -0.04 0.00 -0.52 0.00 0.00 37.83 37.49 2hm9 s LYS 51 CO 0.45 -0.15 -0.14 1.03 -0.92 0.00 0.00 175.35 175.62 2hm9 s ARG 52 N 1.71 1.19 0.69 1.68 3.00 -1.26 -4.42 118.95 121.53 2hm9 s ARG 52 Ca -0.10 -1.45 -0.10 0.00 0.00 0.00 0.00 55.73 54.08 2hm9 s ARG 52 Cb -0.05 -0.98 0.02 0.00 0.00 0.00 0.00 34.95 33.93 2hm9 s ARG 52 CO -0.20 0.17 1.07 -1.25 0.00 0.00 0.00 175.30 175.09 2hm9 s PRO 53 N -3.31 2.82 0.33 3.54 0.04 -1.26 -4.86 135.00 132.29 2hm9 s PRO 53 Ca 0.17 0.35 -0.15 0.00 0.04 0.00 0.00 61.00 61.42 2hm9 s PRO 53 Cb -0.02 -2.06 -0.09 0.00 0.04 0.00 0.00 34.50 32.37 2hm9 s PRO 53 CO 0.04 -1.01 0.74 -0.51 0.04 0.00 0.00 177.00 176.30 2hm9 s LEU 54 N -5.30 4.05 0.05 -3.56 1.43 -1.26 -5.06 118.68 109.03 2hm9 s LEU 54 Ca 0.58 1.27 -0.22 0.00 -1.03 0.00 0.00 54.13 54.72 2hm9 s LEU 54 Cb -0.11 -4.08 -0.06 0.00 0.03 0.00 0.00 46.19 41.97 2hm9 s LEU 54 CO 0.50 -0.21 0.67 -2.16 0.23 0.00 0.00 176.35 175.38 2hm9 s PRO 55 N -3.02 4.39 -1.37 1.29 0.04 -1.26 -3.87 135.00 131.19 2hm9 s PRO 55 Ca 0.54 0.90 0.00 0.00 0.04 0.00 0.00 61.00 62.48 2hm9 s PRO 55 Cb -0.10 -3.31 0.00 0.00 0.04 0.00 0.00 34.50 31.13 2hm9 s PRO 55 CO 0.18 0.44 0.00 0.39 0.04 0.00 0.00 177.00 178.04 2hm9 n GLU 56 N 2.35 -1.27 -3.81 4.56 1.02 -1.26 -4.91 120.64 117.31 2hm9 n GLU 56 Ca -0.06 0.78 -0.12 0.00 -0.02 0.00 0.00 57.16 57.74 2hm9 n GLU 56 Cb 0.50 -5.16 -0.09 0.00 -0.02 0.00 0.00 31.44 26.67 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 -4.75 0.62 -0.41 3.49 0.52 -1.25 -2.17 118.95 115.00 2hm9 s ARG 57 Ca 0.00 -0.37 -0.09 0.00 -0.52 0.00 0.00 55.73 54.76 2hm9 s ARG 57 Cb 0.00 0.27 0.07 0.00 0.52 0.00 0.00 34.95 35.81 2hm9 s ARG 57 CO 0.00 -0.17 0.24 0.99 0.02 0.00 0.00 175.30 176.38 2hm9 s THR 58 N -1.66 4.13 -0.09 0.02 2.01 -1.24 -4.73 115.64 114.07 2hm9 s THR 58 Ca -0.12 -1.39 -0.05 0.00 0.31 0.00 0.00 61.69 60.45 2hm9 s THR 58 Cb -0.05 -3.51 -0.04 0.00 0.01 0.00 0.00 72.50 68.91 2hm9 s THR 58 CO 0.01 -0.47 0.11 0.20 -0.69 0.00 0.00 174.62 173.79 2hm9 s ASN 59 N 2.00 6.08 -0.06 3.53 -0.87 -1.26 -1.38 114.94 122.98 2hm9 s ASN 59 Ca 0.03 0.36 0.02 0.00 -1.57 0.00 0.00 52.86 51.70 2hm9 s ASN 59 Cb -0.22 -1.90 0.01 0.00 -0.02 0.00 0.00 41.25 39.12 2hm9 s ASN 59 CO 0.02 0.37 -0.11 -0.69 -2.57 0.00 0.00 177.10 174.12 2hm9 s VAL 60 N -1.05 1.05 -0.29 1.60 1.01 0.91 -1.48 120.40 122.14 2hm9 s VAL 60 Ca 0.17 -0.45 -0.13 0.00 0.00 0.00 0.00 61.98 61.57 2hm9 s VAL 60 Cb -0.12 -0.96 -0.04 0.00 0.00 0.00 0.00 36.38 35.27 2hm9 s VAL 60 CO 0.06 0.33 0.28 -0.69 0.00 0.00 0.00 175.10 175.09 2hm9 s VAL 61 N 0.57 5.24 -0.23 2.92 1.01 0.45 0.14 120.40 130.49 2hm9 s VAL 61 Ca -0.12 0.29 -0.09 0.00 0.00 0.00 0.00 61.98 62.06 2hm9 s VAL 61 Cb -0.14 -3.64 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 2hm9 s VAL 61 CO 0.03 0.16 0.11 -0.22 0.00 0.00 0.00 175.10 175.18 2hm9 s LEU 62 N 1.91 3.82 -0.06 3.92 0.20 0.27 -2.10 118.68 126.65 2hm9 s LEU 62 Ca 0.11 -0.01 0.03 0.00 0.69 0.00 0.00 54.13 54.94 2hm9 s LEU 62 Cb -0.16 -2.02 0.01 0.00 -0.43 0.00 0.00 46.19 43.59 2hm9 s LEU 62 CO 0.11 0.05 -0.13 0.28 -0.29 0.00 0.00 176.35 176.36 2hm9 s THR 63 N 1.15 1.20 0.14 3.68 -1.32 -1.15 -3.56 115.64 115.79 2hm9 s THR 63 Ca 0.06 -0.54 -0.13 0.00 -1.21 0.00 0.00 61.69 59.86 2hm9 s THR 63 Cb -0.14 -1.07 0.01 0.00 -1.51 0.00 0.00 72.50 69.78 2hm9 s THR 63 CO 0.04 0.36 1.60 0.45 -2.21 0.00 0.00 174.62 174.86 2hm9 h HIS 64 N 6.70 0.87 -3.60 9.09 3.86 -1.88 -3.35 115.15 126.83 2hm9 h HIS 64 Ca -0.31 -0.15 -0.51 0.00 -1.16 0.00 0.00 60.37 58.24 2hm9 h HIS 64 Cb 1.18 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 29.41 2hm9 h HIS 64 CO 0.47 0.84 0.38 1.14 0.86 0.00 0.00 177.93 181.61 2hm9 s GLN 65 N -5.05 4.71 0.00 2.45 -2.07 -1.26 -4.94 119.66 113.51 2hm9 s GLN 65 Ca -0.13 1.51 0.31 0.00 -1.82 0.00 0.00 55.36 55.23 2hm9 s GLN 65 Cb 0.11 -3.34 1.81 0.00 -1.09 0.00 0.00 33.01 30.50 2hm9 s GLN 65 CO 0.81 0.25 2.15 0.39 -1.32 0.00 0.00 175.29 177.57 2hm9 n GLU 66 N 2.44 0.93 -0.35 9.60 1.02 -1.26 -3.06 120.64 129.96 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 -0.25 1.18 0.00 0.00 177.13 178.06 2hm9 n ASP 67 N -1.01 3.68 -4.51 1.62 8.00 -1.26 -4.93 116.55 118.14 2hm9 n ASP 67 Ca 0.23 -2.01 -0.31 0.00 0.71 0.00 0.00 54.79 53.41 2hm9 n ASP 67 Cb 0.11 -0.46 -0.12 0.00 -0.02 0.00 0.00 41.12 40.64 2hm9 n ASP 67 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2hm9 s TYR 68 N -1.10 2.66 0.09 1.24 5.04 -1.17 -5.14 117.35 118.97 2hm9 s TYR 68 Ca 0.46 -0.19 0.03 0.00 -2.44 0.00 0.00 57.07 54.93 2hm9 s TYR 68 Cb 0.24 -1.48 -0.04 0.00 0.35 0.00 0.00 41.96 41.04 2hm9 s TYR 68 CO 0.31 0.32 -0.09 -0.65 -1.34 0.00 0.00 175.55 174.10 2hm9 s GLN 69 N -1.64 0.80 0.03 4.97 -1.52 -1.26 -4.98 119.66 116.05 2hm9 s GLN 69 Ca 0.17 -1.14 0.03 0.00 -1.95 0.00 0.00 55.36 52.46 2hm9 s GLN 69 Cb -0.11 -0.43 -0.02 0.00 -0.22 0.00 0.00 33.01 32.24 2hm9 s GLN 69 CO 0.08 0.05 -0.08 0.00 -0.25 0.00 0.00 175.29 175.09 2hm9 s ALA 70 N -2.55 0.67 -0.13 6.09 0.00 -1.26 -5.12 121.76 119.46 2hm9 s ALA 70 Ca 0.05 -0.62 -0.04 0.00 0.00 0.00 0.00 51.96 51.34 2hm9 s ALA 70 Cb -0.02 -0.05 -0.03 0.00 0.00 0.00 0.00 23.12 23.01 2hm9 s ALA 70 CO -0.01 0.07 0.01 -0.65 0.00 0.00 0.00 175.76 175.18 2hm9 s GLN 71 N -1.06 3.46 0.00 0.00 -1.52 -1.26 -4.44 119.66 114.84 2hm9 s GLN 71 Ca -0.04 -0.42 0.00 0.00 -1.95 0.00 0.00 55.36 52.96 2hm9 s GLN 71 Cb -0.07 -2.95 0.00 0.00 -0.22 0.00 0.00 33.01 29.77 2hm9 s GLN 71 CO 0.00 0.46 0.00 0.41 -0.25 0.00 0.00 175.29 175.91 2hm9 n GLY 72 N 2.91 3.31 2.89 3.09 0.00 -1.26 -4.72 105.19 111.41 2hm9 n GLY 72 Ca -0.18 0.00 -0.16 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 -2.47 0.38 0.22 4.61 0.00 -1.26 -4.53 121.76 118.71 2hm9 s ALA 73 Ca 0.00 -0.04 -0.32 0.00 0.00 0.00 0.00 51.96 51.60 2hm9 s ALA 73 Cb 0.00 -0.21 -0.13 0.00 0.00 0.00 0.00 23.12 22.78 2hm9 s ALA 73 CO 0.00 0.02 1.57 0.28 0.00 0.00 0.00 175.76 177.64 2hm9 n VAL 74 N 3.51 0.44 -3.47 0.00 0.31 -0.55 -3.54 118.33 115.03 2hm9 n VAL 74 Ca -0.19 -0.11 -0.40 0.00 -0.01 0.00 0.00 64.34 63.63 2hm9 n VAL 74 Cb 0.55 -1.71 -0.10 0.00 -0.91 0.00 0.00 33.84 31.67 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 5.23 -0.08 2.52 1.01 -1.25 0.17 120.40 128.54 2hm9 s VAL 75 Ca 0.72 0.02 0.03 0.00 0.00 0.00 0.00 61.98 62.75 2hm9 s VAL 75 Cb -0.60 -3.74 0.01 0.00 0.00 0.00 0.00 36.38 32.05 2hm9 s VAL 75 CO 0.42 -0.00 -0.16 0.68 0.00 0.00 0.00 175.10 176.03 2hm9 s VAL 76 N 1.89 1.47 -2.16 2.92 -7.23 -0.89 -4.99 120.40 111.41 2hm9 s VAL 76 Ca 0.10 -0.67 0.19 0.00 -1.81 0.00 0.00 61.98 59.79 2hm9 s VAL 76 Cb -0.17 -1.31 0.09 0.00 0.56 0.00 0.00 36.38 35.56 2hm9 s VAL 76 CO 0.11 0.43 1.05 1.41 -0.31 0.00 0.00 175.10 177.79 2hm9 n HIS 77 N 3.73 0.00 -3.73 2.82 -0.00 -1.26 -2.91 115.22 113.87 2hm9 n HIS 77 Ca -0.21 0.00 -0.35 0.00 -0.00 0.00 0.00 57.72 57.15 2hm9 n HIS 77 Cb 0.52 0.00 -0.08 0.00 -0.00 0.00 0.00 29.99 30.43 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 -1.84 6.16 0.16 0.41 1.01 -1.26 -4.80 116.67 116.52 2hm9 s ASP 78 Ca 0.20 0.20 -0.14 0.00 0.71 0.00 0.00 52.55 53.52 2hm9 s ASP 78 Cb 0.16 -2.09 0.05 0.00 1.01 0.00 0.00 42.92 42.05 2hm9 s ASP 78 CO 0.34 0.15 1.76 0.58 0.21 0.00 0.00 175.17 178.21 2hm9 h VAL 79 N 4.76 1.19 -0.49 -1.27 2.07 -1.98 -2.25 116.25 118.27 2hm9 h VAL 79 Ca -0.40 -0.49 -0.04 0.00 0.82 0.00 0.00 66.70 66.58 2hm9 h VAL 79 Cb 1.16 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 2hm9 h VAL 79 CO 0.73 0.20 0.13 0.00 0.02 0.00 0.00 177.57 178.65 2hm9 h ALA 80 N 1.11 1.31 -0.60 1.67 0.00 -2.00 -2.59 119.26 118.16 2hm9 h ALA 80 Ca 0.18 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2hm9 h ALA 80 Cb 0.08 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 2hm9 h ALA 80 CO -0.03 0.49 0.24 0.00 0.00 0.00 0.00 179.25 179.95 2hm9 h ALA 81 N 1.43 1.30 -0.57 0.00 0.00 -1.83 0.92 119.26 120.51 2hm9 h ALA 81 Ca 0.16 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2hm9 h ALA 81 Cb 0.25 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2hm9 h ALA 81 CO -0.00 0.52 0.26 0.28 0.00 0.00 0.00 179.25 180.31 2hm9 h VAL 82 N 0.86 1.21 -0.36 0.00 2.07 -1.11 -0.21 116.25 118.71 2hm9 h VAL 82 Ca 0.20 -0.61 -0.00 0.00 0.82 0.00 0.00 66.70 67.11 2hm9 h VAL 82 Cb 0.16 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 2hm9 h VAL 82 CO -0.02 0.24 0.22 -0.26 0.02 0.00 0.00 177.57 177.77 2hm9 h PHE 83 N 0.77 0.47 -0.64 1.57 0.04 -1.22 -2.78 116.94 115.15 2hm9 h PHE 83 Ca 0.19 -0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.93 2hm9 h PHE 83 Cb 0.14 -0.16 -0.03 0.00 2.20 0.00 0.00 35.95 38.10 2hm9 h PHE 83 CO 0.00 0.34 0.26 0.00 -0.60 0.00 0.00 178.31 178.31 2hm9 h ALA 84 N 1.09 1.25 -0.29 2.45 0.00 -0.45 -1.16 119.26 122.16 2hm9 h ALA 84 Ca 0.13 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2hm9 h ALA 84 Cb 0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2hm9 h ALA 84 CO -0.02 0.55 0.18 -0.92 0.00 0.00 0.00 179.25 179.04 2hm9 h TYR 85 N 0.92 0.37 -0.62 0.00 5.03 -0.79 0.66 116.97 122.53 2hm9 h TYR 85 Ca 0.22 0.00 -0.06 0.00 2.58 0.00 0.00 58.73 61.48 2hm9 h TYR 85 Cb 0.17 -0.12 -0.03 0.00 1.55 0.00 0.00 36.73 38.30 2hm9 h TYR 85 CO 0.01 0.25 0.16 0.00 -1.32 0.00 0.00 178.16 177.26 2hm9 h ALA 86 N 1.09 1.11 -0.33 1.82 0.00 -1.24 -2.34 119.26 119.36 2hm9 h ALA 86 Ca 0.10 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 2hm9 h ALA 86 Cb -0.02 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2hm9 h ALA 86 CO -0.02 0.60 0.02 -0.22 0.00 0.00 0.00 179.25 179.63 2hm9 h LYS 87 N 0.93 0.50 -0.73 0.00 3.64 -0.69 -2.23 116.57 117.98 2hm9 h LYS 87 Ca 0.20 -0.10 -0.05 0.00 -1.27 0.00 0.00 60.65 59.44 2hm9 h LYS 87 Cb 0.32 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 2hm9 h LYS 87 CO -0.00 0.51 0.27 1.96 -2.27 0.00 0.00 179.45 179.92 2hm9 h GLN 88 N 0.48 1.09 -3.16 1.90 4.20 -0.33 -3.32 115.11 115.97 2hm9 h GLN 88 Ca 0.11 -0.20 -0.64 0.00 0.06 0.00 0.00 58.65 57.97 2hm9 h GLN 88 Cb 0.28 -0.18 -0.40 0.00 0.30 0.00 0.00 27.48 27.48 2hm9 h GLN 88 CO 0.01 0.90 -0.45 -1.01 -0.67 0.00 0.00 178.83 177.60 2hm9 s HIS 89 N -5.47 3.64 0.50 2.96 3.76 -0.84 -4.91 115.29 114.94 2hm9 s HIS 89 Ca -0.12 -3.26 0.15 0.00 -0.15 0.00 0.00 55.06 51.69 2hm9 s HIS 89 Cb 0.16 -2.85 1.21 0.00 1.11 0.00 0.00 32.58 32.21 2hm9 s HIS 89 CO 0.83 -0.60 2.14 -1.35 -0.85 0.00 0.00 174.74 174.90 2hm9 h PRO 90 N 5.60 0.08 -0.36 8.40 0.11 -1.66 -1.93 132.00 142.24 2hm9 h PRO 90 Ca 0.14 -0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.19 2hm9 h PRO 90 Cb 0.77 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.85 2hm9 h PRO 90 CO 0.75 0.05 0.01 0.22 -0.21 0.00 0.00 178.00 178.82 2hm9 h ASP 91 N 0.08 0.52 -3.26 -2.05 3.58 -1.91 -3.41 116.42 109.96 2hm9 h ASP 91 Ca 0.02 -0.10 -0.62 0.00 0.42 0.00 0.00 57.03 56.75 2hm9 h ASP 91 Cb -0.00 -0.14 -0.16 0.00 1.72 0.00 0.00 39.33 40.75 2hm9 h ASP 91 CO -0.00 0.58 -0.57 -1.58 -2.88 0.00 0.00 179.24 174.78 2hm9 s GLN 92 N -4.99 3.87 0.49 0.28 2.00 -0.73 -5.10 119.66 115.49 2hm9 s GLN 92 Ca -0.08 -0.35 -0.16 0.00 -2.00 0.00 0.00 55.36 52.76 2hm9 s GLN 92 Cb 0.15 -3.16 -0.08 0.00 0.80 0.00 0.00 33.01 30.72 2hm9 s GLN 92 CO 0.77 0.32 0.96 -1.21 -0.50 0.00 0.00 175.29 175.63 2hm9 s GLU 93 N 0.23 3.96 -0.21 1.67 2.02 -1.26 -4.82 118.70 120.30 2hm9 s GLU 93 Ca 0.03 0.92 -0.08 0.00 0.02 0.00 0.00 54.97 55.86 2hm9 s GLU 93 Cb -0.12 -2.17 -0.04 0.00 0.10 0.00 0.00 34.13 31.90 2hm9 s GLU 93 CO 0.01 -0.22 0.09 -1.17 0.02 0.00 0.00 175.26 173.99 2hm9 s LEU 94 N -3.95 3.89 -0.06 1.80 2.96 -1.26 -1.62 118.68 120.44 2hm9 s LEU 94 Ca 0.58 0.07 0.05 0.00 -0.22 0.00 0.00 54.13 54.62 2hm9 s LEU 94 Cb -0.10 -2.01 -0.01 0.00 0.50 0.00 0.00 46.19 44.58 2hm9 s LEU 94 CO 0.29 0.13 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.54 2hm9 s VAL 95 N 0.67 1.84 -0.39 1.68 1.01 0.14 0.14 120.40 125.48 2hm9 s VAL 95 Ca 0.05 -0.94 -0.16 0.00 0.00 0.00 0.00 61.98 60.93 2hm9 s VAL 95 Cb -0.13 -1.57 0.01 0.00 0.00 0.00 0.00 36.38 34.70 2hm9 s VAL 95 CO 0.01 0.52 0.37 -0.63 0.00 0.00 0.00 175.10 175.37 2hm9 s ILE 96 N -0.05 5.16 -1.09 2.22 1.01 0.10 0.14 121.20 128.70 2hm9 s ILE 96 Ca -0.05 -0.32 0.21 0.00 0.00 0.00 0.00 60.65 60.49 2hm9 s ILE 96 Cb -0.13 -3.94 0.22 0.00 0.01 0.00 0.00 42.46 38.61 2hm9 s ILE 96 CO 0.04 -0.29 1.68 0.00 0.00 0.00 0.00 174.94 176.36 2hm9 n ALA 97 N 5.41 2.00 0.00 9.38 0.00 0.29 -2.84 120.51 134.74 2hm9 n ALA 97 Ca -0.09 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.27 2hm9 n ALA 97 Cb 0.48 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.59 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 0.64 -1.66 0.00 0.00 0.00 -1.22 -4.88 105.19 98.07 2hm9 n GLY 98 Ca 0.06 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.43 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 0.34 -0.02 0.00 -1.26 0.11 105.19 104.32 2hm9 n GLY 99 Ca 0.00 -1.28 -0.03 0.00 0.00 0.00 0.00 46.02 44.71 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 -2.00 1.21 -0.76 4.61 0.00 -1.93 0.54 119.26 120.93 2hm9 h ALA 100 Ca 0.00 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 2hm9 h ALA 100 Cb 0.00 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 2hm9 h ALA 100 CO 0.00 0.60 0.37 0.37 0.00 0.00 0.00 179.25 180.59 2hm9 h GLN 101 N 1.06 1.08 -0.35 0.00 4.15 -1.98 0.84 115.11 119.91 2hm9 h GLN 101 Ca 0.26 -0.15 -0.07 0.00 0.77 0.00 0.00 58.65 59.46 2hm9 h GLN 101 Cb 0.12 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.60 2hm9 h GLN 101 CO -0.03 0.83 -0.04 0.82 -1.93 0.00 0.00 178.83 178.49 2hm9 h ILE 102 N 1.06 1.27 -0.51 2.39 1.08 -1.70 -2.29 117.51 118.81 2hm9 h ILE 102 Ca 0.26 -1.05 -0.01 0.00 -0.39 0.00 0.00 64.86 63.66 2hm9 h ILE 102 Cb 0.10 1.25 -0.02 0.00 -3.07 0.00 0.00 36.82 35.08 2hm9 h ILE 102 CO -0.03 0.35 0.27 -0.26 -0.69 0.00 0.00 178.15 177.78 2hm9 h PHE 103 N 0.44 0.71 -0.68 1.37 0.04 -0.26 -2.85 116.94 115.71 2hm9 h PHE 103 Ca 0.09 -0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.84 2hm9 h PHE 103 Cb 0.52 -0.23 -0.03 0.00 2.20 0.00 0.00 35.95 38.41 2hm9 h PHE 103 CO 0.04 0.54 0.42 1.15 -0.60 0.00 0.00 178.31 179.86 2hm9 h THR 104 N 0.68 1.20 -0.77 -1.55 2.02 0.81 1.10 112.91 116.39 2hm9 h THR 104 Ca 0.18 -0.43 -0.03 0.00 0.77 0.00 0.00 66.41 66.90 2hm9 h THR 104 Cb 0.08 0.24 -0.04 0.00 -1.74 0.00 0.00 68.15 66.70 2hm9 h THR 104 CO -0.03 0.20 0.37 0.00 0.37 0.00 0.00 175.52 176.44 2hm9 h ALA 105 N 1.22 1.21 -0.27 6.16 0.00 -1.27 -2.91 119.26 123.40 2hm9 h ALA 105 Ca 0.25 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2hm9 h ALA 105 Cb -0.04 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 2hm9 h ALA 105 CO -0.05 0.61 -0.00 1.19 0.00 0.00 0.00 179.25 181.00 2hm9 n PHE 106 N -4.32 0.94 -0.20 0.00 3.72 -1.02 -4.71 117.46 111.86 2hm9 n PHE 106 Ca 0.08 -0.96 -0.06 0.00 -0.05 0.00 0.00 57.45 56.46 2hm9 n PHE 106 Cb 0.13 -0.33 0.04 0.00 -0.94 0.00 0.00 39.48 38.38 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 1.66 0.76 -0.01 -1.08 3.64 0.15 -1.65 116.57 120.04 2hm9 h LYS 107 Ca 0.03 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2hm9 h LYS 107 Cb 1.46 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 33.11 2hm9 h LYS 107 CO 0.24 0.50 -0.10 -3.47 -2.27 0.00 0.00 179.45 174.35 2hm9 n ASP 108 N -4.69 1.02 -1.32 4.20 -0.08 -1.26 -3.77 116.55 110.64 2hm9 n ASP 108 Ca 0.04 -1.08 0.10 0.00 -1.51 0.00 0.00 54.79 52.34 2hm9 n ASP 108 Cb 0.03 0.03 0.31 0.00 2.34 0.00 0.00 41.12 43.82 2hm9 n ASP 108 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 2hm9 n ASP 109 N -0.41 3.87 -4.31 1.67 8.00 -0.63 -4.92 116.55 119.82 2hm9 n ASP 109 Ca 0.16 -2.16 -0.32 0.00 0.71 0.00 0.00 54.79 53.18 2hm9 n ASP 109 Cb 0.32 -0.49 -0.15 0.00 -0.02 0.00 0.00 41.12 40.78 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 -1.39 2.60 -0.13 2.53 1.01 -1.14 -4.56 120.40 119.33 2hm9 s VAL 110 Ca 0.45 -0.83 0.18 0.00 0.00 0.00 0.00 61.98 61.78 2hm9 s VAL 110 Cb 0.26 -2.05 -0.16 0.00 0.00 0.00 0.00 36.38 34.42 2hm9 s VAL 110 CO 0.27 0.54 0.70 -0.90 0.00 0.00 0.00 175.10 175.72 2hm9 n ASP 111 N 3.43 0.65 -4.26 3.32 5.68 -1.18 -4.75 116.55 119.44 2hm9 n ASP 111 Ca -0.18 0.29 -0.32 0.00 -0.50 0.00 0.00 54.79 54.07 2hm9 n ASP 111 Cb 0.53 0.49 -0.16 0.00 -1.14 0.00 0.00 41.12 40.84 2hm9 n ASP 111 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 2hm9 s THR 112 N -2.96 2.44 -0.14 2.12 2.01 -1.18 -1.29 115.64 116.63 2hm9 s THR 112 Ca -0.04 -0.88 0.01 0.00 0.31 0.00 0.00 61.69 61.09 2hm9 s THR 112 Cb 0.09 -1.98 -0.00 0.00 0.01 0.00 0.00 72.50 70.62 2hm9 s THR 112 CO 0.82 0.54 -0.17 -0.76 -0.69 0.00 0.00 174.62 174.37 2hm9 s LEU 113 N 0.46 2.43 -0.18 4.42 1.43 0.13 -0.66 118.68 126.71 2hm9 s LEU 113 Ca -0.13 -0.46 -0.01 0.00 -1.03 0.00 0.00 54.13 52.49 2hm9 s LEU 113 Cb -0.17 -1.54 -0.00 0.00 0.03 0.00 0.00 46.19 44.52 2hm9 s LEU 113 CO 0.06 0.12 -0.11 -0.76 0.23 0.00 0.00 176.35 175.88 2hm9 s LEU 114 N 0.60 2.61 -0.04 1.79 1.43 0.35 -0.30 118.68 125.12 2hm9 s LEU 114 Ca -0.10 -0.45 0.03 0.00 -1.03 0.00 0.00 54.13 52.58 2hm9 s LEU 114 Cb -0.16 -1.63 0.00 0.00 0.03 0.00 0.00 46.19 44.44 2hm9 s LEU 114 CO 0.03 0.04 -0.12 0.54 0.23 0.00 0.00 176.35 177.06 2hm9 s VAL 115 N 1.12 1.08 -0.17 -1.59 0.11 -0.87 -2.68 120.40 117.39 2hm9 s VAL 115 Ca 0.01 -0.50 -0.04 0.00 -2.93 0.00 0.00 61.98 58.52 2hm9 s VAL 115 Cb -0.14 -0.95 -0.02 0.00 -1.53 0.00 0.00 36.38 33.73 2hm9 s VAL 115 CO -0.03 0.33 -0.04 -0.89 -3.33 0.00 0.00 175.10 171.13 2hm9 s THR 116 N 0.26 3.74 -0.09 5.04 2.01 -0.95 -2.46 115.64 123.19 2hm9 s THR 116 Ca -0.06 -0.40 0.02 0.00 0.31 0.00 0.00 61.69 61.56 2hm9 s THR 116 Cb -0.11 -2.65 -0.02 0.00 0.01 0.00 0.00 72.50 69.72 2hm9 s THR 116 CO 0.02 0.47 -0.15 -0.60 -0.69 0.00 0.00 174.62 173.67 2hm9 s ARG 117 N 0.65 3.00 -0.12 4.92 3.52 -0.88 0.39 118.95 130.42 2hm9 s ARG 117 Ca -0.02 -0.71 -0.01 0.00 -0.13 0.00 0.00 55.73 54.85 2hm9 s ARG 117 Cb -0.14 -2.50 -0.02 0.00 -1.56 0.00 0.00 34.95 30.72 2hm9 s ARG 117 CO 0.02 0.38 -0.07 -0.51 -0.81 0.00 0.00 175.30 174.31 2hm9 s LEU 118 N -0.08 3.09 0.28 -0.88 1.02 -1.02 -1.61 118.68 119.47 2hm9 s LEU 118 Ca -0.03 -0.15 -0.02 0.00 0.02 0.00 0.00 54.13 53.96 2hm9 s LEU 118 Cb -0.14 -1.71 0.40 0.00 0.02 0.00 0.00 46.19 44.76 2hm9 s LEU 118 CO 0.04 0.22 1.88 0.00 0.02 0.00 0.00 176.35 178.51 2hm9 h ALA 119 N 6.28 1.28 -2.12 4.21 0.00 -1.64 -2.43 119.26 124.84 2hm9 h ALA 119 Ca -0.35 -0.15 -0.45 0.00 0.00 0.00 0.00 54.91 53.96 2hm9 h ALA 119 Cb 1.19 -0.27 0.15 0.00 0.00 0.00 0.00 17.79 18.86 2hm9 h ALA 119 CO 0.58 0.55 0.40 0.20 0.00 0.00 0.00 179.25 180.98 2hm9 s GLY 120 N -3.49 1.74 0.04 0.00 0.00 -1.23 -4.71 107.32 99.69 2hm9 s GLY 120 Ca -0.11 -1.11 0.03 0.00 0.00 0.00 0.00 44.72 43.54 2hm9 s GLY 120 CO 0.80 -0.41 -0.09 -0.45 0.00 0.00 0.00 173.10 172.95 2hm9 s SER 121 N -4.81 1.05 0.07 1.64 0.15 -1.26 -3.52 113.70 107.02 2hm9 s SER 121 Ca 0.71 -0.53 0.05 0.00 0.70 0.00 0.00 55.95 56.88 2hm9 s SER 121 Cb -0.05 0.00 -0.03 0.00 -1.71 0.00 0.00 66.02 64.23 2hm9 s SER 121 CO 0.52 -0.14 -0.13 -0.36 1.20 0.00 0.00 173.24 174.33 2hm9 s PHE 122 N -1.24 1.12 -0.03 3.44 0.40 -1.26 -5.08 117.98 115.34 2hm9 s PHE 122 Ca -0.07 -0.50 -0.12 0.00 -0.60 0.00 0.00 56.93 55.64 2hm9 s PHE 122 Cb -0.09 -0.63 -0.05 0.00 0.51 0.00 0.00 43.02 42.76 2hm9 s PHE 122 CO 0.01 0.03 0.34 -2.00 0.70 0.00 0.00 175.22 174.30 2hm9 s GLU 123 N -1.95 3.78 0.18 0.44 2.56 -1.26 -4.88 118.70 117.57 2hm9 s GLU 123 Ca -0.01 0.25 -0.24 0.00 0.00 0.00 0.00 54.97 54.97 2hm9 s GLU 123 Cb -0.08 -3.20 0.05 0.00 2.00 0.00 0.00 34.13 32.90 2hm9 s GLU 123 CO 0.02 0.71 0.80 0.20 -0.56 0.00 0.00 175.26 176.43 2hm9 s GLY 124 N -1.12 -0.27 0.00 -1.50 0.00 -1.26 -4.80 107.32 98.37 2hm9 s GLY 124 Ca 0.22 0.12 0.27 0.00 0.00 0.00 0.00 44.72 45.33 2hm9 s GLY 124 CO 0.11 0.03 1.61 1.34 0.00 0.00 0.00 173.10 176.20 2hm9 n ASP 125 N -0.43 1.18 -4.25 1.64 -0.08 -1.12 -4.84 116.55 108.65 2hm9 n ASP 125 Ca -0.07 -1.07 -0.32 0.00 -1.51 0.00 0.00 54.79 51.81 2hm9 n ASP 125 Cb 0.61 0.10 -0.16 0.00 2.34 0.00 0.00 41.12 44.01 2hm9 n ASP 125 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 2hm9 s THR 126 N -2.36 2.38 0.08 5.18 2.01 0.42 -4.85 115.64 118.50 2hm9 s THR 126 Ca 0.28 -0.89 0.09 0.00 0.31 0.00 0.00 61.69 61.48 2hm9 s THR 126 Cb 0.20 -1.95 -0.03 0.00 0.01 0.00 0.00 72.50 70.72 2hm9 s THR 126 CO 0.47 0.54 -0.23 -0.54 -0.69 0.00 0.00 174.62 174.17 2hm9 s LYS 127 N 0.50 1.77 0.33 4.92 1.02 -1.26 -2.18 119.74 124.84 2hm9 s LYS 127 Ca -0.13 -1.15 -0.28 0.00 0.02 0.00 0.00 55.97 54.43 2hm9 s LYS 127 Cb -0.17 -2.04 -0.10 0.00 -0.52 0.00 0.00 37.83 35.01 2hm9 s LYS 127 CO 0.05 0.50 1.21 1.41 -0.92 0.00 0.00 175.35 177.60 2hm9 s MET 128 N -1.66 4.39 0.62 1.68 1.75 -1.13 -4.76 119.30 120.20 2hm9 s MET 128 Ca 0.14 2.01 -0.18 0.00 -1.25 0.00 0.00 55.69 56.41 2hm9 s MET 128 Cb -0.10 -3.03 -0.02 0.00 2.84 0.00 0.00 34.83 34.51 2hm9 s MET 128 CO 0.05 -0.08 1.21 0.96 -0.65 0.00 0.00 175.02 176.51 2hm9 s ILE 129 N -1.20 2.58 0.46 10.11 -5.25 -1.26 -4.95 121.20 121.68 2hm9 s ILE 129 Ca 0.49 0.34 -0.25 0.00 -0.99 0.00 0.00 60.65 60.24 2hm9 s ILE 129 Cb -0.35 -3.07 -0.08 0.00 2.95 0.00 0.00 42.46 41.90 2hm9 s ILE 129 CO 0.46 -0.10 1.42 -2.16 -1.79 0.00 0.00 174.94 172.77 2hm9 s PRO 130 N -3.48 3.66 0.07 0.37 0.04 -1.26 -5.03 135.00 129.37 2hm9 s PRO 130 Ca 0.77 2.39 0.07 0.00 0.04 0.00 0.00 61.00 64.27 2hm9 s PRO 130 Cb -0.30 -2.63 -0.03 0.00 0.04 0.00 0.00 34.50 31.58 2hm9 s PRO 130 CO 0.36 -0.83 -0.18 -0.51 0.04 0.00 0.00 177.00 175.88 2hm9 s LEU 131 N -2.77 2.23 -0.93 -3.56 1.43 -1.26 -5.08 118.68 108.74 2hm9 s LEU 131 Ca 0.62 -0.57 -0.17 0.00 -1.03 0.00 0.00 54.13 52.97 2hm9 s LEU 131 Cb -0.43 -0.77 0.16 0.00 0.03 0.00 0.00 46.19 45.17 2hm9 s LEU 131 CO 0.55 0.06 1.07 0.20 0.23 0.00 0.00 176.35 178.46 2hm9 s ASN 132 N -1.49 6.71 0.27 2.29 0.01 -1.26 -4.85 114.94 116.61 2hm9 s ASN 132 Ca 0.04 -2.29 -0.03 0.00 -0.71 0.00 0.00 52.86 49.88 2hm9 s ASN 132 Cb -0.09 -2.35 0.36 0.00 0.41 0.00 0.00 41.25 39.57 2hm9 s ASN 132 CO 0.02 -0.91 1.83 -0.50 -1.51 0.00 0.00 177.10 176.03 2hm9 h TRP 133 N 8.43 0.95 -0.39 2.20 -0.00 -1.98 -2.72 115.95 122.44 2hm9 h TRP 133 Ca 0.16 -0.07 -0.06 0.00 -0.00 0.00 0.00 58.89 58.92 2hm9 h TRP 133 Cb 1.01 -0.28 -0.02 0.00 -0.00 0.00 0.00 29.16 29.87 2hm9 h TRP 133 CO 1.12 0.75 0.00 0.22 -0.00 0.00 0.00 178.44 180.54 2hm9 h ASP 134 N 0.91 0.57 -0.23 -3.49 3.58 -2.05 -2.65 116.42 113.06 2hm9 h ASP 134 Ca 0.21 -0.12 -0.06 0.00 0.42 0.00 0.00 57.03 57.48 2hm9 h ASP 134 Cb 0.23 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 41.11 2hm9 h ASP 134 CO -0.01 0.64 -0.03 0.44 -2.88 0.00 0.00 179.24 177.40 2hm9 h ASP 135 N 0.58 0.52 -3.60 2.28 5.19 -1.90 -3.43 116.42 116.08 2hm9 h ASP 135 Ca 0.12 -0.11 -0.68 0.00 -0.62 0.00 0.00 57.03 55.74 2hm9 h ASP 135 Cb 0.36 -0.14 -0.18 0.00 0.18 0.00 0.00 39.33 39.55 2hm9 h ASP 135 CO 0.01 0.61 -0.68 -0.36 -3.12 0.00 0.00 179.24 175.70 2hm9 s PHE 136 N -4.92 2.98 -0.15 4.55 0.40 -1.00 -4.04 117.98 115.79 2hm9 s PHE 136 Ca -0.08 0.05 -0.03 0.00 -0.60 0.00 0.00 56.93 56.27 2hm9 s PHE 136 Cb 0.15 -1.72 -0.03 0.00 0.51 0.00 0.00 43.02 41.94 2hm9 s PHE 136 CO 0.77 0.36 -0.05 0.99 0.70 0.00 0.00 175.22 178.00 2hm9 s THR 137 N -0.84 3.78 0.18 0.64 2.01 -1.15 -4.81 115.64 115.45 2hm9 s THR 137 Ca 0.13 -0.40 -0.31 0.00 0.31 0.00 0.00 61.69 61.42 2hm9 s THR 137 Cb -0.11 -2.65 -0.10 0.00 0.01 0.00 0.00 72.50 69.65 2hm9 s THR 137 CO 0.02 0.49 1.56 -0.75 -0.69 0.00 0.00 174.62 175.26 2hm9 s LYS 138 N 0.40 4.21 -0.17 4.92 2.20 -1.26 -1.78 119.74 128.26 2hm9 s LYS 138 Ca -0.05 2.37 -0.13 0.00 -0.36 0.00 0.00 55.97 57.81 2hm9 s LYS 138 Cb -0.14 -3.14 -0.22 0.00 -1.51 0.00 0.00 37.83 32.81 2hm9 s LYS 138 CO 0.03 -0.60 0.24 1.33 -0.36 0.00 0.00 175.35 175.99 2hm9 n VAL 139 N 3.78 1.66 -3.62 4.02 0.24 0.32 -4.90 118.33 119.83 2hm9 n VAL 139 Ca 0.13 -0.39 -0.10 0.00 -2.04 0.00 0.00 64.34 61.95 2hm9 n VAL 139 Cb 0.38 -1.85 -0.02 0.00 -1.47 0.00 0.00 33.84 30.88 2hm9 n VAL 139 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 2hm9 s SER 140 N -6.97 -0.41 0.15 -1.34 0.01 -1.19 -5.03 113.70 98.92 2hm9 s SER 140 Ca -0.26 -0.29 -0.21 0.00 1.31 0.00 0.00 55.95 56.50 2hm9 s SER 140 Cb 0.07 0.63 0.06 0.00 0.21 0.00 0.00 66.02 66.99 2hm9 s SER 140 CO 0.68 -1.10 0.54 -0.94 0.41 0.00 0.00 173.24 172.83 2hm9 s SER 141 N -2.83 -0.47 0.01 2.44 1.04 -1.26 -0.26 113.70 112.37 2hm9 s SER 141 Ca 0.06 -0.10 0.02 0.00 0.48 0.00 0.00 55.95 56.41 2hm9 s SER 141 Cb -0.02 0.56 -0.01 0.00 0.10 0.00 0.00 66.02 66.65 2hm9 s SER 141 CO -0.05 -0.94 -0.07 -0.60 0.98 0.00 0.00 173.24 172.57 2hm9 s ARG 142 N -3.77 0.51 -0.14 4.02 6.06 0.35 -4.97 118.95 121.01 2hm9 s ARG 142 Ca 0.02 -0.33 0.00 0.00 -2.50 0.00 0.00 55.73 52.92 2hm9 s ARG 142 Cb -0.00 -0.45 -0.01 0.00 0.06 0.00 0.00 34.95 34.55 2hm9 s ARG 142 CO -0.12 0.12 -0.15 0.99 -2.50 0.00 0.00 175.30 173.63 2hm9 s THR 143 N -0.40 2.77 -0.09 4.11 2.01 -1.26 0.81 115.64 123.59 2hm9 s THR 143 Ca -0.00 -0.75 0.04 0.00 0.31 0.00 0.00 61.69 61.29 2hm9 s THR 143 Cb -0.04 -2.16 0.00 0.00 0.01 0.00 0.00 72.50 70.32 2hm9 s THR 143 CO -0.00 0.52 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.55 2hm9 s VAL 144 N 0.56 1.81 -0.21 3.82 1.01 -0.61 -5.01 120.40 121.77 2hm9 s VAL 144 Ca -0.09 -0.88 -0.04 0.00 0.00 0.00 0.00 61.98 60.97 2hm9 s VAL 144 Cb -0.16 -1.57 -0.01 0.00 0.00 0.00 0.00 36.38 34.63 2hm9 s VAL 144 CO 0.04 0.50 -0.03 -1.61 0.00 0.00 0.00 175.10 174.00 2hm9 s GLU 145 N 0.39 3.44 0.79 2.72 2.02 -1.26 -2.01 118.70 124.79 2hm9 s GLU 145 Ca -0.17 -0.60 -0.06 0.00 0.02 0.00 0.00 54.97 54.17 2hm9 s GLU 145 Cb -0.17 -3.02 0.14 0.00 0.10 0.00 0.00 34.13 31.18 2hm9 s GLU 145 CO 0.07 -0.13 1.09 0.34 0.02 0.00 0.00 175.26 176.65 2hm9 s ASP 146 N 1.32 4.03 0.13 -0.19 -1.08 -1.26 -4.95 116.67 114.67 2hm9 s ASP 146 Ca 0.04 -0.13 -0.16 0.00 -0.52 0.00 0.00 52.55 51.78 2hm9 s ASP 146 Cb -0.14 -0.18 -0.01 0.00 -1.46 0.00 0.00 42.92 41.13 2hm9 s ASP 146 CO -0.01 -2.09 1.70 0.71 0.52 0.00 0.00 175.17 176.00 2hm9 h THR 147 N -0.85 1.17 -2.90 1.71 1.35 -1.99 -3.43 112.91 107.98 2hm9 h THR 147 Ca -0.39 -0.51 -0.63 0.00 -0.55 0.00 0.00 66.41 64.33 2hm9 h THR 147 Cb 1.26 0.81 -0.06 0.00 -1.73 0.00 0.00 68.15 68.43 2hm9 h THR 147 CO 0.41 0.19 -0.29 0.21 -0.25 0.00 0.00 175.52 175.79 2hm9 s ASN 148 N -5.77 6.68 0.31 5.36 2.47 -1.26 -5.00 114.94 117.74 2hm9 s ASN 148 Ca -0.13 0.81 0.03 0.00 0.42 0.00 0.00 52.86 53.99 2hm9 s ASN 148 Cb 0.10 -2.20 0.60 0.00 -1.45 0.00 0.00 41.25 38.30 2hm9 s ASN 148 CO 0.74 0.35 1.89 1.55 -3.72 0.00 0.00 177.10 177.91 2hm9 h PRO 149 N 4.80 0.92 -0.58 0.43 0.13 -1.95 -0.91 132.00 134.84 2hm9 h PRO 149 Ca -0.53 -0.06 -0.07 0.00 -0.87 0.00 0.00 66.00 64.48 2hm9 h PRO 149 Cb 1.22 -0.21 -0.02 0.00 0.13 0.00 0.00 31.00 32.12 2hm9 h PRO 149 CO 0.60 0.61 0.08 0.00 -0.23 0.00 0.00 178.00 179.06 2hm9 h ALA 150 N 1.54 1.04 -0.20 -0.56 0.00 -1.94 -2.81 119.26 116.33 2hm9 h ALA 150 Ca 0.42 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 2hm9 h ALA 150 Cb 0.37 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2hm9 h ALA 150 CO -0.18 0.61 -0.29 -0.07 0.00 0.00 0.00 179.25 179.32 2hm9 h LEU 151 N 0.89 0.39 -9.78 0.00 3.38 -1.58 -3.26 115.31 105.36 2hm9 h LEU 151 Ca 0.18 -0.14 -0.53 0.00 0.09 0.00 0.00 57.88 57.48 2hm9 h LEU 151 Cb 0.41 -0.11 0.08 0.00 0.09 0.00 0.00 40.66 41.13 2hm9 h LEU 151 CO 0.01 0.68 0.88 -0.89 0.09 0.00 0.00 178.44 179.21 2hm9 s THR 152 N -4.41 2.16 0.07 0.22 2.01 -0.65 -4.62 115.64 110.41 2hm9 s THR 152 Ca -0.06 0.13 -0.06 0.00 0.31 0.00 0.00 61.69 62.01 2hm9 s THR 152 Cb 0.14 -3.08 -0.02 0.00 0.01 0.00 0.00 72.50 69.55 2hm9 s THR 152 CO 0.78 0.02 0.10 -1.38 -0.69 0.00 0.00 174.62 173.45 2hm9 s HIS 153 N 0.11 0.31 0.02 4.92 -3.43 -0.85 -2.46 115.29 113.90 2hm9 s HIS 153 Ca 0.64 -0.78 0.05 0.00 -0.80 0.00 0.00 55.06 54.16 2hm9 s HIS 153 Cb -0.47 -0.19 -0.02 0.00 -1.43 0.00 0.00 32.58 30.47 2hm9 s HIS 153 CO 0.46 -0.48 -0.14 0.99 -2.00 0.00 0.00 174.74 173.56 2hm9 s THR 154 N -3.89 1.13 -0.15 -5.38 2.01 -0.64 -1.57 115.64 107.15 2hm9 s THR 154 Ca 0.06 -0.88 -0.04 0.00 0.31 0.00 0.00 61.69 61.14 2hm9 s THR 154 Cb 0.06 -1.00 -0.03 0.00 0.01 0.00 0.00 72.50 71.54 2hm9 s THR 154 CO -0.10 0.11 -0.02 -0.31 -0.69 0.00 0.00 174.62 173.60 2hm9 s TYR 155 N -0.68 3.06 0.02 4.92 2.02 0.24 -2.07 117.35 124.87 2hm9 s TYR 155 Ca 0.03 -0.21 0.03 0.00 -0.37 0.00 0.00 57.07 56.55 2hm9 s TYR 155 Cb -0.07 -1.96 -0.02 0.00 -0.40 0.00 0.00 41.96 39.51 2hm9 s TYR 155 CO 0.01 0.02 -0.09 -1.21 -1.57 0.00 0.00 175.55 172.71 2hm9 s GLU 156 N 0.28 0.65 -0.11 -0.62 2.02 -1.03 0.13 118.70 120.02 2hm9 s GLU 156 Ca -0.02 -0.57 0.03 0.00 0.02 0.00 0.00 54.97 54.43 2hm9 s GLU 156 Cb -0.14 -0.57 0.00 0.00 0.10 0.00 0.00 34.13 33.53 2hm9 s GLU 156 CO 0.02 0.14 -0.22 0.08 0.02 0.00 0.00 175.26 175.30 2hm9 s VAL 157 N -0.78 1.95 -0.08 2.63 1.01 0.64 -2.05 120.40 123.72 2hm9 s VAL 157 Ca -0.02 -0.94 0.01 0.00 0.00 0.00 0.00 61.98 61.02 2hm9 s VAL 157 Cb -0.07 -1.71 -0.03 0.00 0.00 0.00 0.00 36.38 34.58 2hm9 s VAL 157 CO 0.00 0.53 -0.07 0.26 0.00 0.00 0.00 175.10 175.83 2hm9 s TRP 158 N 0.53 2.93 -0.12 5.22 0.52 0.59 -0.52 118.94 128.08 2hm9 s TRP 158 Ca -0.15 -0.04 0.03 0.00 0.02 0.00 0.00 56.10 55.96 2hm9 s TRP 158 Cb -0.17 -1.73 0.00 0.00 -1.15 0.00 0.00 33.47 30.42 2hm9 s TRP 158 CO 0.05 0.28 -0.22 -0.65 0.02 0.00 0.00 176.95 176.43 2hm9 s GLN 159 N -0.67 3.08 0.27 4.98 -0.21 -0.73 0.19 119.66 126.57 2hm9 s GLN 159 Ca 0.10 -0.84 -0.30 0.00 0.02 0.00 0.00 55.36 54.34 2hm9 s GLN 159 Cb -0.11 -2.40 -0.10 0.00 1.00 0.00 0.00 33.01 31.40 2hm9 s GLN 159 CO 0.02 0.11 1.44 0.21 -2.12 0.00 0.00 175.29 174.94 2hm9 s LYS 160 N 0.53 4.26 -0.01 2.91 2.36 -0.41 -2.91 119.74 126.47 2hm9 s LYS 160 Ca -0.13 2.33 0.07 0.00 -2.55 0.00 0.00 55.97 55.68 2hm9 s LYS 160 Cb -0.17 -3.09 -0.02 0.00 -1.05 0.00 0.00 37.83 33.51 2hm9 s LYS 160 CO 0.04 -0.41 -0.22 -1.59 1.55 0.00 0.00 175.35 174.73 2hm9 s LYS 161 N -0.69 1.70 0.00 4.03 -2.85 -1.26 -4.97 119.74 115.70 2hm9 s LYS 161 Ca 0.58 -0.80 0.25 0.00 -1.00 0.00 0.00 55.97 54.99 2hm9 s LYS 161 Cb -0.42 -1.67 1.47 0.00 -2.06 0.00 0.00 37.83 35.14 2hm9 s LYS 161 CO 0.46 0.45 1.83 0.00 0.10 0.00 0.00 175.35 178.20