#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 1.49 -0.26 2.41 0.00 0.31 -3.03 121.76 122.68 2hm9 s ALA 2 Ca 0.00 -0.98 -0.08 0.00 0.00 0.00 0.00 51.96 50.90 2hm9 s ALA 2 Cb 0.00 -0.25 -0.02 0.00 0.00 0.00 0.00 23.12 22.84 2hm9 s ALA 2 CO 0.00 0.31 0.08 -0.06 0.00 0.00 0.00 175.76 176.09 2hm9 s PHE 3 N -0.89 3.10 -0.21 0.00 0.40 0.42 0.74 117.98 121.54 2hm9 s PHE 3 Ca 0.04 -0.46 0.02 0.00 -0.60 0.00 0.00 56.93 55.93 2hm9 s PHE 3 Cb -0.09 -2.26 0.04 0.00 0.51 0.00 0.00 43.02 41.23 2hm9 s PHE 3 CO 0.02 -0.38 -0.14 -1.17 0.70 0.00 0.00 175.22 174.25 2hm9 s LEU 4 N 1.61 2.61 0.17 -0.37 2.96 -1.05 0.12 118.68 124.73 2hm9 s LEU 4 Ca 0.06 -0.97 -0.20 0.00 -0.22 0.00 0.00 54.13 52.80 2hm9 s LEU 4 Cb -0.15 -1.41 0.05 0.00 0.50 0.00 0.00 46.19 45.17 2hm9 s LEU 4 CO 0.04 -0.11 0.54 -1.66 -1.32 0.00 0.00 176.35 173.84 2hm9 s TRP 5 N 1.27 -0.33 -0.03 5.38 -2.14 -1.09 -4.45 118.94 117.55 2hm9 s TRP 5 Ca -0.02 0.05 0.05 0.00 2.66 0.00 0.00 56.10 58.84 2hm9 s TRP 5 Cb -0.16 0.45 -0.01 0.00 -3.10 0.00 0.00 33.47 30.65 2hm9 s TRP 5 CO -0.09 -0.85 -0.18 0.00 -2.66 0.00 0.00 176.95 173.17 2hm9 s ALA 6 N -3.80 1.54 0.03 2.67 0.00 -1.26 -2.63 121.76 118.31 2hm9 s ALA 6 Ca 0.04 -0.76 -0.02 0.00 0.00 0.00 0.00 51.96 51.22 2hm9 s ALA 6 Cb -0.01 -0.44 -0.02 0.00 0.00 0.00 0.00 23.12 22.65 2hm9 s ALA 6 CO -0.09 0.34 0.00 1.14 0.00 0.00 0.00 175.76 177.15 2hm9 s GLN 7 N -0.25 0.46 0.84 0.00 -2.07 0.37 -4.66 119.66 114.35 2hm9 s GLN 7 Ca 0.03 -0.81 -0.09 0.00 -1.82 0.00 0.00 55.36 52.68 2hm9 s GLN 7 Cb -0.09 0.17 0.16 0.00 -1.09 0.00 0.00 33.01 32.16 2hm9 s GLN 7 CO 0.00 -0.09 1.16 0.16 -1.32 0.00 0.00 175.29 175.21 2hm9 s ASP 8 N -2.02 3.73 0.21 12.60 -4.77 -1.07 -2.50 116.67 122.85 2hm9 s ASP 8 Ca -0.07 -0.03 -0.10 0.00 -3.30 0.00 0.00 52.55 49.06 2hm9 s ASP 8 Cb -0.03 -0.18 0.16 0.00 -1.09 0.00 0.00 42.92 41.78 2hm9 s ASP 8 CO -0.04 -2.31 1.84 0.08 0.70 0.00 0.00 175.17 175.45 2hm9 h ARG 9 N -1.10 1.06 -0.69 2.11 -0.00 -1.55 -2.78 114.38 111.43 2hm9 h ARG 9 Ca -0.41 -0.10 -0.02 0.00 -0.00 0.00 0.00 59.98 59.45 2hm9 h ARG 9 Cb 1.25 -0.22 -0.03 0.00 -0.00 0.00 0.00 29.97 30.97 2hm9 h ARG 9 CO 0.39 0.76 0.36 -0.44 -0.00 0.00 0.00 179.97 181.04 2hm9 h ASP 10 N 1.06 0.88 0.00 0.08 5.19 -1.89 -3.47 116.42 118.28 2hm9 h ASP 10 Ca 0.28 -0.11 0.00 0.00 -0.62 0.00 0.00 57.03 56.57 2hm9 h ASP 10 Cb -0.02 -0.22 0.00 0.00 0.18 0.00 0.00 39.33 39.27 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 -1.03 1.12 3.83 2.75 0.00 -1.05 -5.13 105.19 105.69 2hm9 n GLY 11 Ca 0.06 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 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 4.42 -0.06 0.99 2.96 -1.26 -2.92 118.68 122.81 2hm9 s LEU 12 Ca 0.00 1.14 0.03 0.00 -0.22 0.00 0.00 54.13 55.08 2hm9 s LEU 12 Cb 0.00 -3.08 -0.25 0.00 0.50 0.00 0.00 46.19 43.36 2hm9 s LEU 12 CO 0.00 0.18 0.59 0.16 -1.32 0.00 0.00 176.35 175.97 2hm9 h ILE 13 N 3.14 0.82 0.00 6.68 3.07 -1.78 -2.83 117.51 126.62 2hm9 h ILE 13 Ca -0.49 -2.59 0.00 0.00 1.55 0.00 0.00 64.86 63.32 2hm9 h ILE 13 Cb 1.20 2.51 0.00 0.00 -0.27 0.00 0.00 36.82 40.26 2hm9 h ILE 13 CO 0.64 0.69 0.00 0.61 -1.05 0.00 0.00 178.15 179.05 2hm9 n GLY 14 N 1.73 -0.56 2.94 0.16 0.00 -1.11 -4.74 105.19 103.61 2hm9 n GLY 14 Ca -0.22 -0.71 -0.23 0.00 0.00 0.00 0.00 46.02 44.86 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 -1.53 1.28 -1.55 1.61 2.20 -1.09 -2.42 119.74 118.23 2hm9 s LYS 15 Ca 0.00 -0.24 0.00 0.00 -0.36 0.00 0.00 55.97 55.37 2hm9 s LYS 15 Cb 0.00 -1.20 0.00 0.00 -1.51 0.00 0.00 37.83 35.12 2hm9 s LYS 15 CO 0.00 -0.09 0.00 -0.25 -0.36 0.00 0.00 175.35 174.65 2hm9 n ASP 16 N 4.19 -4.46 0.00 1.43 9.92 -1.26 -1.47 116.55 124.90 2hm9 n ASP 16 Ca -0.21 0.27 0.00 0.00 -0.53 0.00 0.00 54.79 54.32 2hm9 n ASP 16 Cb 0.51 -3.91 0.00 0.00 -0.64 0.00 0.00 41.12 37.08 2hm9 n ASP 16 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2hm9 n GLY 17 N -0.56 2.50 3.71 0.44 0.00 -1.26 -4.94 105.19 105.08 2hm9 n GLY 17 Ca -0.17 -0.17 -0.42 0.00 0.00 0.00 0.00 46.02 45.26 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 -1.14 3.64 -0.41 1.61 -3.43 -0.54 -4.87 115.29 110.14 2hm9 s HIS 18 Ca 0.00 1.64 -0.29 0.00 -0.80 0.00 0.00 55.06 55.61 2hm9 s HIS 18 Cb 0.00 -3.17 -0.09 0.00 -1.43 0.00 0.00 32.58 27.90 2hm9 s HIS 18 CO 0.00 -0.21 2.33 1.28 -2.00 0.00 0.00 174.74 176.13 2hm9 n LEU 19 N 3.71 2.41 0.26 5.38 4.77 -1.26 -2.69 117.00 129.57 2hm9 n LEU 19 Ca 0.06 -0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.17 2hm9 n LEU 19 Cb 0.50 -1.44 0.68 0.00 -2.33 0.00 0.00 43.42 40.83 2hm9 n LEU 19 CO 0.53 -1.02 0.94 -0.65 -1.33 0.00 0.00 177.39 175.86 2hm9 h PRO 20 N 15.80 0.00 -6.21 3.23 0.11 -1.87 -3.43 132.00 139.63 2hm9 h PRO 20 Ca -0.29 0.00 -0.56 0.00 0.11 0.00 0.00 66.00 65.26 2hm9 h PRO 20 Cb 1.28 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.34 2hm9 h PRO 20 CO 1.08 0.13 0.03 1.67 -0.21 0.00 0.00 178.00 180.70 2hm9 s TRP 21 N -3.98 3.76 -0.81 0.65 -2.14 -1.26 -5.02 118.94 110.14 2hm9 s TRP 21 Ca -0.02 1.32 -0.17 0.00 2.66 0.00 0.00 56.10 59.89 2hm9 s TRP 21 Cb 0.12 -2.63 0.16 0.00 -3.10 0.00 0.00 33.47 28.02 2hm9 s TRP 21 CO 0.58 0.43 0.88 -1.58 -2.66 0.00 0.00 176.95 174.61 2hm9 s HIS 22 N -0.56 3.36 -0.57 1.66 5.65 -1.26 -4.93 115.29 118.63 2hm9 s HIS 22 Ca 0.32 -1.54 0.05 0.00 0.25 0.00 0.00 55.06 54.14 2hm9 s HIS 22 Cb -0.20 -4.03 0.19 0.00 -1.18 0.00 0.00 32.58 27.36 2hm9 s HIS 22 CO 0.20 -1.24 0.49 -0.11 -0.65 0.00 0.00 174.74 173.42 2hm9 n LEU 23 N 5.45 1.73 -0.48 8.88 7.94 -1.26 -4.95 117.00 134.30 2hm9 n LEU 23 Ca 0.12 -4.93 0.41 0.00 -1.11 0.00 0.00 56.01 50.51 2hm9 n LEU 23 Cb 0.47 -0.19 0.74 0.00 0.53 0.00 0.00 43.42 44.97 2hm9 n LEU 23 CO 0.45 1.87 1.36 -0.65 -1.11 0.00 0.00 177.39 179.31 2hm9 h PRO 24 N 5.15 0.04 0.96 1.96 0.11 -1.98 0.41 132.00 138.65 2hm9 h PRO 24 Ca 0.19 -0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.25 2hm9 h PRO 24 Cb 0.80 -0.01 0.01 0.00 0.11 0.00 0.00 31.00 31.91 2hm9 h PRO 24 CO 0.60 0.03 -0.46 0.22 -0.21 0.00 0.00 178.00 178.18 2hm9 h ASP 25 N 0.05 -1.09 -0.34 -2.05 1.82 -1.97 0.23 116.42 113.07 2hm9 h ASP 25 Ca 0.75 0.04 -0.06 0.00 -0.39 0.00 0.00 57.03 57.37 2hm9 h ASP 25 Cb 2.81 0.28 -0.02 0.00 0.68 0.00 0.00 39.33 43.08 2hm9 h ASP 25 CO -0.10 -0.76 0.03 -0.78 -1.61 0.00 0.00 179.24 176.01 2hm9 h ASP 26 N -1.32 0.64 -0.67 2.28 1.82 -1.38 -2.20 116.42 115.59 2hm9 h ASP 26 Ca -0.13 -0.13 -0.03 0.00 -0.39 0.00 0.00 57.03 56.35 2hm9 h ASP 26 Cb 0.99 -0.17 -0.03 0.00 0.68 0.00 0.00 39.33 40.80 2hm9 h ASP 26 CO 0.22 0.70 0.30 -0.07 -1.61 0.00 0.00 179.24 178.77 2hm9 h LEU 27 N 0.65 0.90 -0.85 2.28 3.38 -0.96 -2.02 115.31 118.69 2hm9 h LEU 27 Ca 0.14 -0.15 0.03 0.00 0.09 0.00 0.00 57.88 57.99 2hm9 h LEU 27 Cb 0.36 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.83 2hm9 h LEU 27 CO 0.01 0.80 0.55 0.45 0.09 0.00 0.00 178.44 180.34 2hm9 h HIS 28 N 0.94 1.03 -0.38 1.13 3.86 -0.05 -1.97 115.15 119.71 2hm9 h HIS 28 Ca 0.23 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.47 2hm9 h HIS 28 Cb 0.16 -0.34 -0.02 0.00 1.06 0.00 0.00 27.41 28.27 2hm9 h HIS 28 CO 0.01 0.60 0.25 -0.92 0.86 0.00 0.00 177.93 178.73 2hm9 h TYR 29 N 1.07 0.48 -0.32 2.45 3.20 -0.80 -0.33 116.97 122.73 2hm9 h TYR 29 Ca 0.34 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.21 2hm9 h TYR 29 Cb -0.01 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.09 2hm9 h TYR 29 CO -0.02 0.31 0.20 0.35 -1.64 0.00 0.00 178.16 177.36 2hm9 h PHE 30 N 0.52 0.42 -0.63 -3.82 3.57 -0.83 -2.32 116.94 113.83 2hm9 h PHE 30 Ca 0.14 0.00 -0.03 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 0.30 0.29 -0.09 -2.23 0.00 0.00 178.31 176.53 2hm9 h ARG 31 N 0.41 0.92 -0.70 1.11 2.43 -1.13 -2.81 114.38 114.61 2hm9 h ARG 31 Ca 0.11 -0.14 -0.05 0.00 -0.81 0.00 0.00 59.98 59.09 2hm9 h ARG 31 Cb -0.00 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.36 2hm9 h ARG 31 CO -0.02 0.75 0.23 0.00 -1.51 0.00 0.00 179.97 179.41 2hm9 h ALA 32 N 1.13 1.08 -0.15 2.80 0.00 -0.92 -2.77 119.26 120.42 2hm9 h ALA 32 Ca 0.22 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 2hm9 h ALA 32 Cb 0.14 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2hm9 h ALA 32 CO -0.03 0.63 -0.22 1.96 0.00 0.00 0.00 179.25 181.60 2hm9 h GLN 33 N 1.03 0.27 -0.13 0.00 4.20 -1.28 -2.50 115.11 116.70 2hm9 h GLN 33 Ca 0.23 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.86 2hm9 h GLN 33 Cb 0.28 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.03 2hm9 h GLN 33 CO -0.01 0.48 0.00 0.25 -0.67 0.00 0.00 178.83 178.88 2hm9 n THR 34 N -4.18 0.18 -3.10 -0.54 -2.24 -1.05 -4.66 114.28 98.67 2hm9 n THR 34 Ca -0.01 -0.20 -0.41 0.00 -2.27 0.00 0.00 64.05 61.17 2hm9 n THR 34 Cb 0.34 0.08 -0.06 0.00 -2.10 0.00 0.00 70.33 68.59 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 -1.82 4.96 -0.12 2.28 -7.23 -0.94 -3.71 120.40 113.82 2hm9 s VAL 35 Ca 0.17 1.07 0.00 0.00 -1.81 0.00 0.00 61.98 61.42 2hm9 s VAL 35 Cb 0.09 -3.96 0.00 0.00 0.56 0.00 0.00 36.38 33.07 2hm9 s VAL 35 CO 0.13 -0.02 0.00 0.61 -0.31 0.00 0.00 175.10 175.51 2hm9 n GLY 36 N 4.22 0.48 3.09 2.32 0.00 -1.26 -5.03 105.19 109.02 2hm9 n GLY 36 Ca -0.00 -0.79 -0.11 0.00 0.00 0.00 0.00 46.02 45.11 2hm9 n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hm9 s LYS 37 N -1.67 0.62 0.01 1.61 3.01 -1.24 -4.71 119.74 117.37 2hm9 s LYS 37 Ca 0.00 -0.98 -0.30 0.00 -1.01 0.00 0.00 55.97 53.68 2hm9 s LYS 37 Cb 0.00 -0.18 -0.03 0.00 -1.01 0.00 0.00 37.83 36.61 2hm9 s LYS 37 CO 0.00 0.00 1.00 0.42 0.51 0.00 0.00 175.35 177.28 2hm9 s ILE 38 N -2.37 4.79 0.06 2.17 1.01 0.16 -4.16 121.20 122.86 2hm9 s ILE 38 Ca -0.02 2.01 0.06 0.00 0.00 0.00 0.00 60.65 62.70 2hm9 s ILE 38 Cb -0.03 -4.29 -0.03 0.00 0.01 0.00 0.00 42.46 38.12 2hm9 s ILE 38 CO -0.02 0.16 -0.18 -0.32 0.00 0.00 0.00 174.94 174.58 2hm9 s MET 39 N 1.00 1.08 -0.10 2.79 1.75 -0.87 0.81 119.30 125.76 2hm9 s MET 39 Ca 0.53 -0.95 0.04 0.00 -1.25 0.00 0.00 55.69 54.06 2hm9 s MET 39 Cb -0.22 -1.18 0.00 0.00 2.84 0.00 0.00 34.83 36.27 2hm9 s MET 39 CO 0.28 0.29 -0.24 0.08 -0.65 0.00 0.00 175.02 174.78 2hm9 s VAL 40 N -1.00 2.04 0.11 10.11 1.01 0.10 -1.25 120.40 131.52 2hm9 s VAL 40 Ca 0.04 -1.00 0.05 0.00 0.00 0.00 0.00 61.98 61.07 2hm9 s VAL 40 Cb -0.09 -1.77 -0.04 0.00 0.00 0.00 0.00 36.38 34.49 2hm9 s VAL 40 CO 0.02 0.55 -0.13 0.68 0.00 0.00 0.00 175.10 176.23 2hm9 s VAL 41 N 0.39 1.20 0.79 2.92 -7.23 0.61 0.11 120.40 119.20 2hm9 s VAL 41 Ca -0.18 -1.67 -0.08 0.00 -1.81 0.00 0.00 61.98 58.24 2hm9 s VAL 41 Cb -0.18 -1.46 0.12 0.00 0.56 0.00 0.00 36.38 35.43 2hm9 s VAL 41 CO 0.08 -0.45 1.11 -0.83 -0.31 0.00 0.00 175.10 174.70 2hm9 s GLY 42 N -2.42 1.73 0.18 2.32 0.00 0.25 0.80 107.32 110.19 2hm9 s GLY 42 Ca 0.07 -1.21 -0.13 0.00 0.00 0.00 0.00 44.72 43.46 2hm9 s GLY 42 CO 0.02 -0.65 1.81 -0.09 0.00 0.00 0.00 173.10 174.19 2hm9 h ARG 43 N -0.91 0.82 -0.63 2.90 1.12 -1.87 -1.63 114.38 114.18 2hm9 h ARG 43 Ca -0.42 -0.08 0.02 0.00 -1.11 0.00 0.00 59.98 58.39 2hm9 h ARG 43 Cb 1.28 -0.17 -0.03 0.00 -0.01 0.00 0.00 29.97 31.04 2hm9 h ARG 43 CO 0.49 0.60 0.42 0.00 -3.11 0.00 0.00 179.97 178.36 2hm9 h ARG 44 N 0.81 0.77 -0.38 0.20 3.08 -1.94 -1.90 114.38 115.02 2hm9 h ARG 44 Ca 0.21 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.19 2hm9 h ARG 44 Cb -0.00 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 29.86 2hm9 h ARG 44 CO -0.04 0.51 0.13 1.15 -1.07 0.00 0.00 179.97 180.65 2hm9 h THR 45 N 0.80 1.21 -0.93 2.04 2.02 -1.65 -1.59 112.91 114.80 2hm9 h THR 45 Ca 0.25 -0.67 0.20 0.00 0.77 0.00 0.00 66.41 66.95 2hm9 h THR 45 Cb 0.00 0.94 -0.11 0.00 -1.74 0.00 0.00 68.15 67.24 2hm9 h THR 45 CO -0.06 0.24 0.51 0.22 0.37 0.00 0.00 175.52 176.79 2hm9 h TYR 46 N 0.46 0.87 0.00 3.16 3.20 -0.50 0.93 116.97 125.10 2hm9 h TYR 46 Ca 0.12 0.04 -0.21 0.00 3.14 0.00 0.00 58.73 61.82 2hm9 h TYR 46 Cb 0.24 -0.24 -0.03 0.00 1.54 0.00 0.00 36.73 38.24 2hm9 h TYR 46 CO 0.01 0.11 -1.10 0.93 -1.64 0.00 0.00 178.16 176.47 2hm9 h GLU 47 N 0.60 0.00 0.00 1.82 5.08 -1.46 -3.32 114.58 117.29 2hm9 h GLU 47 Ca 0.56 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.75 2hm9 h GLU 47 Cb 0.94 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.17 2hm9 h GLU 47 CO -0.43 0.76 -0.98 0.77 -1.00 0.00 0.00 179.01 178.13 2hm9 h SER 48 N 0.00 0.00 -3.44 1.42 0.02 -0.09 -3.47 113.55 107.99 2hm9 h SER 48 Ca -0.08 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.31 2hm9 h SER 48 Cb 1.75 0.00 0.18 0.00 0.14 0.00 0.00 62.40 64.46 2hm9 h SER 48 CO 0.10 0.70 -0.12 0.33 -1.14 0.00 0.00 176.83 176.70 2hm9 n PHE 49 N -3.16 0.04 0.28 3.45 7.35 0.31 -4.91 117.46 120.81 2hm9 n PHE 49 Ca -0.03 0.39 -0.11 0.00 -0.76 0.00 0.00 57.45 56.94 2hm9 n PHE 49 Cb 0.85 -2.02 -0.05 0.00 0.35 0.00 0.00 39.48 38.60 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 -0.07 -0.68 -2.12 -7.13 0.11 -1.90 -3.47 132.00 116.74 2hm9 h PRO 50 Ca -0.47 0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2hm9 h PRO 50 Cb 1.36 0.16 -0.22 0.00 0.11 0.00 0.00 31.00 32.40 2hm9 h PRO 50 CO 0.46 -0.46 -0.06 -1.59 -0.21 0.00 0.00 178.00 176.15 2hm9 s LYS 51 N -4.43 0.63 0.21 1.05 -2.85 -1.26 -5.16 119.74 107.93 2hm9 s LYS 51 Ca -0.10 1.18 0.10 0.00 -1.00 0.00 0.00 55.97 56.15 2hm9 s LYS 51 Cb 0.01 0.20 -0.05 0.00 -2.06 0.00 0.00 37.83 35.93 2hm9 s LYS 51 CO 0.31 -0.16 -0.20 1.03 0.10 0.00 0.00 175.35 176.43 2hm9 s ARG 52 N 1.76 1.47 0.44 1.78 3.00 -1.26 -4.56 118.95 121.58 2hm9 s ARG 52 Ca -0.09 -1.56 0.03 0.00 0.00 0.00 0.00 55.73 54.11 2hm9 s ARG 52 Cb -0.06 -1.60 0.01 0.00 0.00 0.00 0.00 34.95 33.29 2hm9 s ARG 52 CO -0.19 0.32 0.63 -1.25 0.00 0.00 0.00 175.30 174.82 2hm9 s PRO 53 N -3.03 2.92 -0.25 3.54 0.04 -1.26 -4.81 135.00 132.15 2hm9 s PRO 53 Ca 0.22 -0.78 -0.21 0.00 0.04 0.00 0.00 61.00 60.26 2hm9 s PRO 53 Cb -0.06 -2.63 -0.02 0.00 0.04 0.00 0.00 34.50 31.84 2hm9 s PRO 53 CO 0.10 -0.30 0.68 -0.51 0.04 0.00 0.00 177.00 177.01 2hm9 s LEU 54 N -4.49 4.07 0.40 -3.56 1.43 -1.26 -5.04 118.68 110.23 2hm9 s LEU 54 Ca 0.51 0.80 -0.27 0.00 -1.03 0.00 0.00 54.13 54.13 2hm9 s LEU 54 Cb -0.10 -2.94 -0.10 0.00 0.03 0.00 0.00 46.19 43.08 2hm9 s LEU 54 CO 0.36 -0.41 1.44 -2.84 0.23 0.00 0.00 176.35 175.12 2hm9 s PRO 55 N 2.59 3.97 -0.93 1.29 0.02 -1.26 -2.46 135.00 138.23 2hm9 s PRO 55 Ca 0.28 2.45 0.00 0.00 0.02 0.00 0.00 61.00 63.76 2hm9 s PRO 55 Cb -0.15 -2.85 0.00 0.00 0.02 0.00 0.00 34.50 31.52 2hm9 s PRO 55 CO 0.08 -0.60 0.00 0.39 -0.33 0.00 0.00 177.00 176.54 2hm9 n GLU 56 N 0.23 -0.85 -2.28 5.54 1.02 -1.26 -4.99 120.64 118.06 2hm9 n GLU 56 Ca 0.03 0.75 -0.03 0.00 -0.02 0.00 0.00 57.16 57.89 2hm9 n GLU 56 Cb 0.41 -4.69 -0.01 0.00 -0.02 0.00 0.00 31.44 27.13 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 -2.27 1.24 -3.43 3.49 5.12 -1.03 -4.35 116.66 115.44 2hm9 n ARG 57 Ca -0.09 -0.40 -0.21 0.00 -1.93 0.00 0.00 57.85 55.23 2hm9 n ARG 57 Cb 0.35 0.18 -0.11 0.00 -1.16 0.00 0.00 32.46 31.71 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 -1.53 -0.29 -0.10 0.55 2.01 -1.26 -4.97 115.64 110.05 2hm9 s THR 58 Ca 0.02 -0.64 -0.05 0.00 0.31 0.00 0.00 61.69 61.32 2hm9 s THR 58 Cb 0.00 -0.97 -0.04 0.00 0.01 0.00 0.00 72.50 71.51 2hm9 s THR 58 CO 0.01 -0.56 0.09 0.20 -0.69 0.00 0.00 174.62 173.67 2hm9 s ASN 59 N 2.17 5.97 -0.07 3.53 0.02 -1.26 -2.06 114.94 123.24 2hm9 s ASN 59 Ca 0.10 0.34 0.03 0.00 -1.02 0.00 0.00 52.86 52.31 2hm9 s ASN 59 Cb -0.15 -1.84 0.01 0.00 0.02 0.00 0.00 41.25 39.29 2hm9 s ASN 59 CO -0.30 0.38 -0.15 -0.69 0.02 0.00 0.00 177.10 176.36 2hm9 s VAL 60 N -1.01 1.32 -0.30 1.60 1.01 -0.38 -0.29 120.40 122.35 2hm9 s VAL 60 Ca 0.16 -0.59 -0.13 0.00 0.00 0.00 0.00 61.98 61.41 2hm9 s VAL 60 Cb -0.12 -1.18 -0.03 0.00 0.00 0.00 0.00 36.38 35.05 2hm9 s VAL 60 CO 0.05 0.40 0.29 -0.69 0.00 0.00 0.00 175.10 175.15 2hm9 s VAL 61 N 0.57 5.23 -0.20 2.92 1.01 0.53 -0.28 120.40 130.18 2hm9 s VAL 61 Ca -0.15 0.20 -0.06 0.00 0.00 0.00 0.00 61.98 61.97 2hm9 s VAL 61 Cb -0.16 -3.68 -0.03 0.00 0.00 0.00 0.00 36.38 32.51 2hm9 s VAL 61 CO 0.05 0.10 0.03 -0.22 0.00 0.00 0.00 175.10 175.05 2hm9 s LEU 62 N 1.91 3.44 0.03 3.92 0.20 0.24 -1.92 118.68 126.49 2hm9 s LEU 62 Ca 0.10 -0.12 0.02 0.00 0.69 0.00 0.00 54.13 54.82 2hm9 s LEU 62 Cb -0.16 -1.88 -0.02 0.00 -0.43 0.00 0.00 46.19 43.70 2hm9 s LEU 62 CO 0.11 0.08 -0.07 0.28 -0.29 0.00 0.00 176.35 176.46 2hm9 s THR 63 N 0.90 0.49 0.11 3.68 -1.32 -1.18 -3.09 115.64 115.23 2hm9 s THR 63 Ca 0.02 -0.83 -0.16 0.00 -1.21 0.00 0.00 61.69 59.51 2hm9 s THR 63 Cb -0.14 -0.53 -0.05 0.00 -1.51 0.00 0.00 72.50 70.28 2hm9 s THR 63 CO 0.02 -0.24 1.54 1.12 -2.21 0.00 0.00 174.62 174.86 2hm9 h HIS 64 N 4.94 0.67 -3.47 9.09 2.07 -1.89 -3.38 115.15 123.19 2hm9 h HIS 64 Ca -0.33 -0.12 -0.53 0.00 -2.85 0.00 0.00 60.37 56.54 2hm9 h HIS 64 Cb 1.20 -0.17 -0.01 0.00 2.57 0.00 0.00 27.41 30.99 2hm9 h HIS 64 CO 0.58 0.73 0.40 1.14 -3.07 0.00 0.00 177.93 177.71 2hm9 s GLN 65 N -4.96 4.61 0.00 5.12 -2.07 -1.26 -4.94 119.66 116.16 2hm9 s GLN 65 Ca -0.13 1.50 0.31 0.00 -1.82 0.00 0.00 55.36 55.22 2hm9 s GLN 65 Cb 0.09 -3.39 1.83 0.00 -1.09 0.00 0.00 33.01 30.45 2hm9 s GLN 65 CO 0.78 0.05 2.18 0.39 -1.32 0.00 0.00 175.29 177.36 2hm9 n GLU 66 N 3.29 0.93 -0.32 9.60 1.02 -1.26 -3.29 120.64 130.61 2hm9 n GLU 66 Ca 0.04 0.00 0.10 0.00 -0.02 0.00 0.00 57.16 57.29 2hm9 n GLU 66 Cb 0.49 -1.50 0.28 0.00 -0.02 0.00 0.00 31.44 30.69 2hm9 n GLU 66 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 2hm9 n ASP 67 N -1.02 3.38 -4.64 1.62 5.68 -1.26 -4.91 116.55 115.39 2hm9 n ASP 67 Ca 0.23 -2.00 -0.35 0.00 -0.50 0.00 0.00 54.79 52.18 2hm9 n ASP 67 Cb 0.12 -0.42 -0.10 0.00 -1.14 0.00 0.00 41.12 39.59 2hm9 n ASP 67 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 2hm9 s TYR 68 N -1.17 3.26 -0.12 2.11 5.04 -1.21 -5.10 117.35 120.17 2hm9 s TYR 68 Ca 0.42 0.09 -0.03 0.00 -2.44 0.00 0.00 57.07 55.12 2hm9 s TYR 68 Cb 0.22 -2.07 -0.03 0.00 0.35 0.00 0.00 41.96 40.43 2hm9 s TYR 68 CO 0.29 0.18 -0.01 -0.65 -1.34 0.00 0.00 175.55 174.02 2hm9 s GLN 69 N 0.29 3.29 0.05 4.97 1.11 -1.26 -5.01 119.66 123.10 2hm9 s GLN 69 Ca 0.04 -0.45 0.08 0.00 0.01 0.00 0.00 55.36 55.03 2hm9 s GLN 69 Cb -0.12 -2.86 -0.03 0.00 -1.01 0.00 0.00 33.01 29.00 2hm9 s GLN 69 CO 0.00 0.50 -0.22 0.00 0.01 0.00 0.00 175.29 175.58 2hm9 s ALA 70 N -0.33 1.87 -0.12 6.09 0.00 -1.26 -5.14 121.76 122.87 2hm9 s ALA 70 Ca 0.06 -1.12 -0.02 0.00 0.00 0.00 0.00 51.96 50.89 2hm9 s ALA 70 Cb -0.12 -0.36 -0.03 0.00 0.00 0.00 0.00 23.12 22.61 2hm9 s ALA 70 CO 0.02 0.42 -0.05 -0.65 0.00 0.00 0.00 175.76 175.50 2hm9 s GLN 71 N -1.25 3.27 0.00 0.00 -1.52 -1.26 -4.52 119.66 114.38 2hm9 s GLN 71 Ca 0.08 -0.53 0.00 0.00 -1.95 0.00 0.00 55.36 52.96 2hm9 s GLN 71 Cb -0.09 -2.77 0.00 0.00 -0.22 0.00 0.00 33.01 29.93 2hm9 s GLN 71 CO 0.02 0.43 0.00 0.41 -0.25 0.00 0.00 175.29 175.90 2hm9 n GLY 72 N 2.93 3.35 2.93 3.09 0.00 -1.26 -4.80 105.19 111.43 2hm9 n GLY 72 Ca -0.18 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.46 0.36 0.22 4.61 0.00 -1.26 -4.49 121.76 118.74 2hm9 s ALA 73 Ca 0.00 -0.14 -0.32 0.00 0.00 0.00 0.00 51.96 51.50 2hm9 s ALA 73 Cb 0.00 -0.13 -0.12 0.00 0.00 0.00 0.00 23.12 22.87 2hm9 s ALA 73 CO 0.00 0.07 1.67 0.28 0.00 0.00 0.00 175.76 177.77 2hm9 n VAL 74 N 3.13 0.25 -3.40 0.00 0.31 0.60 -3.57 118.33 115.65 2hm9 n VAL 74 Ca -0.15 -0.06 -0.40 0.00 -0.01 0.00 0.00 64.34 63.72 2hm9 n VAL 74 Cb 0.57 -1.90 -0.09 0.00 -0.91 0.00 0.00 33.84 31.51 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 0.84 5.17 -0.07 2.52 1.01 -1.25 0.20 120.40 128.81 2hm9 s VAL 75 Ca 0.73 0.28 0.03 0.00 0.00 0.00 0.00 61.98 63.02 2hm9 s VAL 75 Cb -0.53 -3.76 0.01 0.00 0.00 0.00 0.00 36.38 32.10 2hm9 s VAL 75 CO 0.37 0.02 -0.15 0.68 0.00 0.00 0.00 175.10 176.02 2hm9 s VAL 76 N 2.05 1.37 -1.97 2.92 -7.23 -0.81 -4.98 120.40 111.75 2hm9 s VAL 76 Ca 0.13 -0.62 0.20 0.00 -1.81 0.00 0.00 61.98 59.88 2hm9 s VAL 76 Cb -0.16 -1.23 0.03 0.00 0.56 0.00 0.00 36.38 35.58 2hm9 s VAL 76 CO 0.11 0.41 1.02 1.41 -0.31 0.00 0.00 175.10 177.74 2hm9 n HIS 77 N 3.72 0.00 -3.64 2.82 -0.00 -1.26 -3.11 115.22 113.75 2hm9 n HIS 77 Ca -0.22 0.00 -0.37 0.00 -0.00 0.00 0.00 57.72 57.13 2hm9 n HIS 77 Cb 0.52 0.00 -0.10 0.00 -0.00 0.00 0.00 29.99 30.41 2hm9 n HIS 77 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 2hm9 s ASP 78 N -2.12 6.12 0.17 0.41 1.11 -1.26 -4.83 116.67 116.27 2hm9 s ASP 78 Ca 0.18 0.12 -0.13 0.00 0.18 0.00 0.00 52.55 52.90 2hm9 s ASP 78 Cb 0.16 -2.11 0.06 0.00 1.07 0.00 0.00 42.92 42.10 2hm9 s ASP 78 CO 0.45 0.04 1.75 0.58 1.18 0.00 0.00 175.17 179.17 2hm9 h VAL 79 N 5.06 1.21 -0.54 -1.27 2.07 -1.97 -2.50 116.25 118.31 2hm9 h VAL 79 Ca -0.38 -0.60 -0.04 0.00 0.82 0.00 0.00 66.70 66.50 2hm9 h VAL 79 Cb 1.17 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 31.48 2hm9 h VAL 79 CO 0.65 0.24 0.16 0.00 0.02 0.00 0.00 177.57 178.63 2hm9 h ALA 80 N 1.10 1.27 -0.64 1.67 0.00 -2.00 -2.61 119.26 118.04 2hm9 h ALA 80 Ca 0.19 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 2hm9 h ALA 80 Cb 0.13 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2hm9 h ALA 80 CO -0.02 0.52 0.25 0.00 0.00 0.00 0.00 179.25 180.00 2hm9 h ALA 81 N 1.39 1.24 -0.58 0.00 0.00 -1.87 -0.98 119.26 118.45 2hm9 h ALA 81 Ca 0.18 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2hm9 h ALA 81 Cb 0.25 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2hm9 h ALA 81 CO -0.01 0.56 0.28 0.28 0.00 0.00 0.00 179.25 180.36 2hm9 h VAL 82 N 0.93 1.21 -0.45 0.00 2.07 -1.14 0.89 116.25 119.75 2hm9 h VAL 82 Ca 0.22 -0.59 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 2hm9 h VAL 82 Cb 0.19 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 2hm9 h VAL 82 CO -0.02 0.24 0.26 -0.26 0.02 0.00 0.00 177.57 177.81 2hm9 h PHE 83 N 0.79 0.61 -0.58 1.57 0.04 -1.33 -2.72 116.94 115.32 2hm9 h PHE 83 Ca 0.20 -0.01 -0.04 0.00 2.80 0.00 0.00 57.97 60.91 2hm9 h PHE 83 Cb 0.12 -0.20 -0.03 0.00 2.20 0.00 0.00 35.95 38.05 2hm9 h PHE 83 CO -0.00 0.45 0.18 0.00 -0.60 0.00 0.00 178.31 178.34 2hm9 h ALA 84 N 1.11 1.23 -0.32 2.45 0.00 -0.73 -1.97 119.26 121.03 2hm9 h ALA 84 Ca 0.16 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2hm9 h ALA 84 Cb 0.03 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2hm9 h ALA 84 CO -0.03 0.54 0.21 -0.92 0.00 0.00 0.00 179.25 179.05 2hm9 h TYR 85 N 0.84 0.41 -0.63 0.00 5.03 -0.54 -0.88 116.97 121.20 2hm9 h TYR 85 Ca 0.19 0.01 -0.04 0.00 2.58 0.00 0.00 58.73 61.47 2hm9 h TYR 85 Cb 0.24 -0.14 -0.03 0.00 1.55 0.00 0.00 36.73 38.36 2hm9 h TYR 85 CO 0.02 0.27 0.22 0.00 -1.32 0.00 0.00 178.16 177.34 2hm9 h ALA 86 N 1.10 1.20 -0.57 1.82 0.00 -1.24 -2.33 119.26 119.24 2hm9 h ALA 86 Ca 0.12 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 2hm9 h ALA 86 Cb -0.03 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 2hm9 h ALA 86 CO -0.02 0.57 0.21 0.87 0.00 0.00 0.00 179.25 180.88 2hm9 h LYS 87 N 0.91 0.84 -0.73 0.00 1.57 -0.82 -2.45 116.57 115.90 2hm9 h LYS 87 Ca 0.21 -0.14 -0.05 0.00 -1.87 0.00 0.00 60.65 58.80 2hm9 h LYS 87 Cb 0.23 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.36 2hm9 h LYS 87 CO -0.01 0.70 0.24 1.96 -0.57 0.00 0.00 179.45 181.77 2hm9 h GLN 88 N 0.83 1.11 -2.66 3.15 4.20 -0.64 -3.27 115.11 117.83 2hm9 h GLN 88 Ca 0.19 -0.23 -0.73 0.00 0.06 0.00 0.00 58.65 57.95 2hm9 h GLN 88 Cb 0.19 -0.17 -0.33 0.00 0.30 0.00 0.00 27.48 27.47 2hm9 h GLN 88 CO -0.02 0.94 0.27 0.72 -0.67 0.00 0.00 178.83 180.07 2hm9 n HIS 89 N -4.26 2.80 0.21 2.96 8.25 -0.92 -4.85 115.22 119.40 2hm9 n HIS 89 Ca 0.06 -3.18 0.09 0.00 -0.26 0.00 0.00 57.72 54.43 2hm9 n HIS 89 Cb 0.22 -1.00 0.63 0.00 1.12 0.00 0.00 29.99 30.96 2hm9 n HIS 89 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2hm9 h PRO 90 N 4.98 0.04 -0.38 -0.41 0.13 -1.61 -1.99 132.00 132.76 2hm9 h PRO 90 Ca 0.20 -0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.27 2hm9 h PRO 90 Cb 0.63 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.73 2hm9 h PRO 90 CO 1.15 0.03 0.00 -0.44 -0.23 0.00 0.00 178.00 178.51 2hm9 h ASP 91 N 0.05 0.56 -3.29 1.44 3.32 -1.89 -3.41 116.42 113.19 2hm9 h ASP 91 Ca 0.04 -0.11 -0.63 0.00 0.02 0.00 0.00 57.03 56.35 2hm9 h ASP 91 Cb 0.11 -0.15 -0.18 0.00 0.22 0.00 0.00 39.33 39.33 2hm9 h ASP 91 CO -0.00 0.63 -0.61 -1.10 -1.72 0.00 0.00 179.24 176.43 2hm9 s GLN 92 N -4.97 3.71 0.52 3.56 1.11 -0.75 -5.08 119.66 117.75 2hm9 s GLN 92 Ca -0.08 -0.42 -0.18 0.00 0.01 0.00 0.00 55.36 54.69 2hm9 s GLN 92 Cb 0.15 -3.03 -0.07 0.00 -1.01 0.00 0.00 33.01 29.05 2hm9 s GLN 92 CO 0.78 0.33 1.02 -1.21 0.01 0.00 0.00 175.29 176.22 2hm9 s GLU 93 N 0.16 3.75 -0.22 2.91 0.41 -1.26 -4.63 118.70 119.82 2hm9 s GLU 93 Ca 0.02 1.17 -0.09 0.00 -0.41 0.00 0.00 54.97 55.66 2hm9 s GLU 93 Cb -0.13 -2.10 -0.05 0.00 -1.78 0.00 0.00 34.13 30.08 2hm9 s GLU 93 CO 0.02 -0.45 0.12 -1.17 -0.49 0.00 0.00 175.26 173.28 2hm9 s LEU 94 N -3.91 3.99 -0.06 1.80 2.96 -1.25 0.40 118.68 122.60 2hm9 s LEU 94 Ca 0.63 0.10 0.05 0.00 -0.22 0.00 0.00 54.13 54.68 2hm9 s LEU 94 Cb -0.13 -2.05 -0.00 0.00 0.50 0.00 0.00 46.19 44.51 2hm9 s LEU 94 CO 0.27 0.11 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.51 2hm9 s VAL 95 N 0.79 1.77 -0.39 1.68 1.01 0.24 0.11 120.40 125.61 2hm9 s VAL 95 Ca 0.06 -0.89 -0.18 0.00 0.00 0.00 0.00 61.98 60.98 2hm9 s VAL 95 Cb -0.13 -1.52 0.01 0.00 0.00 0.00 0.00 36.38 34.74 2hm9 s VAL 95 CO 0.02 0.50 0.48 -0.63 0.00 0.00 0.00 175.10 175.47 2hm9 s ILE 96 N 0.10 5.04 -1.09 2.22 -1.09 0.23 0.01 121.20 126.62 2hm9 s ILE 96 Ca -0.08 -0.00 0.20 0.00 -2.23 0.00 0.00 60.65 58.54 2hm9 s ILE 96 Cb -0.14 -4.00 0.21 0.00 -1.58 0.00 0.00 42.46 36.94 2hm9 s ILE 96 CO 0.04 -0.33 1.65 0.00 -1.23 0.00 0.00 174.94 175.08 2hm9 n ALA 97 N 5.71 1.96 0.00 9.38 0.00 0.30 -2.53 120.51 135.33 2hm9 n ALA 97 Ca -0.06 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2hm9 n ALA 97 Cb 0.48 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.60 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 0.57 -1.51 0.00 0.00 0.00 -1.23 -4.87 105.19 98.15 2hm9 n GLY 98 Ca 0.06 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.47 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 0.03 0.34 -0.02 0.00 -1.26 0.87 105.19 105.15 2hm9 n GLY 99 Ca 0.00 -1.27 -0.03 0.00 0.00 0.00 0.00 46.02 44.72 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 -0.77 4.61 0.00 -1.93 0.51 119.26 120.90 2hm9 h ALA 100 Ca 0.00 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2hm9 h ALA 100 Cb 0.00 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.46 2hm9 h ALA 100 CO 0.00 0.59 0.41 1.96 0.00 0.00 0.00 179.25 182.21 2hm9 h GLN 101 N 1.04 1.09 -0.41 0.00 7.50 -1.98 0.62 115.11 122.97 2hm9 h GLN 101 Ca 0.25 -0.14 -0.06 0.00 0.50 0.00 0.00 58.65 59.20 2hm9 h GLN 101 Cb 0.13 -0.21 -0.01 0.00 0.05 0.00 0.00 27.48 27.44 2hm9 h GLN 101 CO -0.03 0.82 0.01 0.82 -1.50 0.00 0.00 178.83 178.95 2hm9 h ILE 102 N 1.07 1.26 -0.45 2.54 1.08 -1.69 -2.50 117.51 118.82 2hm9 h ILE 102 Ca 0.27 -0.99 -0.01 0.00 -0.39 0.00 0.00 64.86 63.73 2hm9 h ILE 102 Cb 0.06 1.09 -0.02 0.00 -3.07 0.00 0.00 36.82 34.88 2hm9 h ILE 102 CO -0.04 0.34 0.24 -0.26 -0.69 0.00 0.00 178.15 177.73 2hm9 h PHE 103 N 0.55 0.63 -0.63 1.37 0.04 -0.20 -2.92 116.94 115.78 2hm9 h PHE 103 Ca 0.12 -0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.87 2hm9 h PHE 103 Cb 0.46 -0.20 -0.03 0.00 2.20 0.00 0.00 35.95 38.38 2hm9 h PHE 103 CO 0.04 0.48 0.42 1.15 -0.60 0.00 0.00 178.31 179.80 2hm9 h THR 104 N 0.58 1.16 -0.71 -1.55 2.02 0.31 1.00 112.91 115.73 2hm9 h THR 104 Ca 0.16 -0.29 -0.03 0.00 0.77 0.00 0.00 66.41 67.01 2hm9 h THR 104 Cb 0.08 0.23 -0.03 0.00 -1.74 0.00 0.00 68.15 66.68 2hm9 h THR 104 CO -0.02 0.16 0.32 0.00 0.37 0.00 0.00 175.52 176.35 2hm9 h ALA 105 N 1.23 1.24 -0.32 6.16 0.00 -1.30 -3.10 119.26 123.17 2hm9 h ALA 105 Ca 0.23 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2hm9 h ALA 105 Cb -0.10 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.41 2hm9 h ALA 105 CO -0.05 0.58 0.00 1.19 0.00 0.00 0.00 179.25 180.96 2hm9 n PHE 106 N -4.32 0.52 -0.23 0.00 3.72 -1.06 -4.68 117.46 111.41 2hm9 n PHE 106 Ca 0.07 -0.55 -0.07 0.00 -0.05 0.00 0.00 57.45 56.85 2hm9 n PHE 106 Cb 0.15 -0.07 0.04 0.00 -0.94 0.00 0.00 39.48 38.66 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 1.92 0.91 -0.35 -1.08 3.11 0.11 -2.93 116.57 118.26 2hm9 h LYS 107 Ca 0.00 -0.12 -0.06 0.00 -2.81 0.00 0.00 60.65 57.65 2hm9 h LYS 107 Cb 0.83 -0.17 -0.02 0.00 -1.00 0.00 0.00 32.23 31.87 2hm9 h LYS 107 CO 0.03 0.71 -0.04 0.22 -2.81 0.00 0.00 179.45 177.57 2hm9 h ASP 108 N 0.87 0.54 -1.57 4.20 3.58 -1.83 -3.16 116.42 119.05 2hm9 h ASP 108 Ca 0.22 -0.12 -0.71 0.00 0.42 0.00 0.00 57.03 56.84 2hm9 h ASP 108 Cb 0.09 -0.14 -0.30 0.00 1.72 0.00 0.00 39.33 40.70 2hm9 h ASP 108 CO -0.03 0.64 0.76 0.47 -2.88 0.00 0.00 179.24 178.20 2hm9 n ASP 109 N -4.24 7.24 -4.25 2.28 9.92 -1.11 -4.96 116.55 121.42 2hm9 n ASP 109 Ca 0.01 -3.81 -0.32 0.00 -0.53 0.00 0.00 54.79 50.14 2hm9 n ASP 109 Cb 0.28 -0.95 -0.16 0.00 -0.64 0.00 0.00 41.12 39.64 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 -5.01 2.34 -0.13 2.53 1.01 -1.20 -4.76 120.40 115.19 2hm9 s VAL 110 Ca 0.56 -0.91 0.17 0.00 0.00 0.00 0.00 61.98 61.80 2hm9 s VAL 110 Cb 0.46 -1.93 -0.23 0.00 0.00 0.00 0.00 36.38 34.68 2hm9 s VAL 110 CO -0.24 0.55 0.45 -0.90 0.00 0.00 0.00 175.10 174.95 2hm9 n ASP 111 N 3.65 0.41 -4.17 3.32 5.75 -1.22 -4.56 116.55 119.73 2hm9 n ASP 111 Ca -0.19 0.18 -0.31 0.00 -0.01 0.00 0.00 54.79 54.47 2hm9 n ASP 111 Cb 0.53 0.70 -0.17 0.00 -1.03 0.00 0.00 41.12 41.15 2hm9 n ASP 111 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2hm9 s THR 112 N -2.77 1.88 -0.14 2.12 2.01 -1.17 -1.28 115.64 116.29 2hm9 s THR 112 Ca -0.07 -0.90 0.02 0.00 0.31 0.00 0.00 61.69 61.05 2hm9 s THR 112 Cb 0.08 -1.65 0.00 0.00 0.01 0.00 0.00 72.50 70.95 2hm9 s THR 112 CO 0.83 0.52 -0.19 -0.76 -0.69 0.00 0.00 174.62 174.33 2hm9 s LEU 113 N 0.55 2.29 -0.19 4.42 1.43 0.22 -0.44 118.68 126.97 2hm9 s LEU 113 Ca -0.15 -0.52 -0.02 0.00 -1.03 0.00 0.00 54.13 52.41 2hm9 s LEU 113 Cb -0.17 -1.49 -0.00 0.00 0.03 0.00 0.00 46.19 44.56 2hm9 s LEU 113 CO 0.05 0.11 -0.10 -0.76 0.23 0.00 0.00 176.35 175.88 2hm9 s LEU 114 N 0.66 2.67 -0.03 1.79 1.43 0.33 0.16 118.68 125.71 2hm9 s LEU 114 Ca -0.09 -0.44 0.03 0.00 -1.03 0.00 0.00 54.13 52.59 2hm9 s LEU 114 Cb -0.16 -1.65 0.00 0.00 0.03 0.00 0.00 46.19 44.41 2hm9 s LEU 114 CO 0.02 0.03 -0.10 0.54 0.23 0.00 0.00 176.35 177.06 2hm9 s VAL 115 N 1.19 0.86 -0.18 -1.59 0.11 -0.78 -2.66 120.40 117.36 2hm9 s VAL 115 Ca 0.02 -0.41 -0.03 0.00 -2.93 0.00 0.00 61.98 58.63 2hm9 s VAL 115 Cb -0.14 -0.76 -0.02 0.00 -1.53 0.00 0.00 36.38 33.93 2hm9 s VAL 115 CO -0.04 0.26 -0.06 -0.89 -3.33 0.00 0.00 175.10 171.05 2hm9 s THR 116 N 0.13 3.45 -0.13 5.04 2.01 -1.08 -1.92 115.64 123.14 2hm9 s THR 116 Ca -0.02 -0.49 -0.04 0.00 0.31 0.00 0.00 61.69 61.44 2hm9 s THR 116 Cb -0.08 -2.53 -0.03 0.00 0.01 0.00 0.00 72.50 69.87 2hm9 s THR 116 CO 0.01 0.46 0.01 -0.60 -0.69 0.00 0.00 174.62 173.81 2hm9 s ARG 117 N 0.92 3.46 -0.14 4.92 3.52 -0.35 -0.48 118.95 130.81 2hm9 s ARG 117 Ca -0.01 -0.41 -0.03 0.00 -0.13 0.00 0.00 55.73 55.15 2hm9 s ARG 117 Cb -0.15 -2.95 -0.03 0.00 -1.56 0.00 0.00 34.95 30.27 2hm9 s ARG 117 CO 0.01 0.46 -0.04 -0.51 -0.81 0.00 0.00 175.30 174.41 2hm9 s LEU 118 N -0.20 3.25 0.27 -0.88 1.02 -1.04 -1.09 118.68 120.00 2hm9 s LEU 118 Ca 0.06 -0.10 -0.03 0.00 0.02 0.00 0.00 54.13 54.08 2hm9 s LEU 118 Cb -0.12 -1.77 0.35 0.00 0.02 0.00 0.00 46.19 44.67 2hm9 s LEU 118 CO 0.02 0.21 1.85 0.00 0.02 0.00 0.00 176.35 178.45 2hm9 h ALA 119 N 6.39 1.22 -2.03 4.21 0.00 -1.67 -2.67 119.26 124.70 2hm9 h ALA 119 Ca -0.35 -0.17 -0.44 0.00 0.00 0.00 0.00 54.91 53.95 2hm9 h ALA 119 Cb 1.19 -0.27 0.17 0.00 0.00 0.00 0.00 17.79 18.87 2hm9 h ALA 119 CO 0.61 0.57 0.41 0.20 0.00 0.00 0.00 179.25 181.04 2hm9 s GLY 120 N -3.48 1.77 0.06 0.00 0.00 -1.23 -4.76 107.32 99.67 2hm9 s GLY 120 Ca -0.11 -1.18 0.04 0.00 0.00 0.00 0.00 44.72 43.48 2hm9 s GLY 120 CO 0.81 -0.41 -0.13 -0.45 0.00 0.00 0.00 173.10 172.93 2hm9 s SER 121 N -4.82 1.51 0.11 1.64 0.15 -1.26 -3.71 113.70 107.31 2hm9 s SER 121 Ca 0.74 -0.55 0.04 0.00 0.70 0.00 0.00 55.95 56.88 2hm9 s SER 121 Cb -0.04 -0.05 -0.04 0.00 -1.71 0.00 0.00 66.02 64.18 2hm9 s SER 121 CO 0.53 -0.07 -0.11 -0.36 1.20 0.00 0.00 173.24 174.43 2hm9 s PHE 122 N -1.15 1.19 -0.08 3.44 0.40 -1.26 -5.09 117.98 115.42 2hm9 s PHE 122 Ca -0.02 -0.62 0.00 0.00 -0.60 0.00 0.00 56.93 55.69 2hm9 s PHE 122 Cb -0.09 -0.64 -0.03 0.00 0.51 0.00 0.00 43.02 42.77 2hm9 s PHE 122 CO 0.02 0.05 -0.07 -1.21 0.70 0.00 0.00 175.22 174.71 2hm9 s GLU 123 N -2.77 2.90 0.20 0.44 0.41 -1.26 -4.87 118.70 113.75 2hm9 s GLU 123 Ca 0.07 -0.56 -0.23 0.00 -0.41 0.00 0.00 54.97 53.84 2hm9 s GLU 123 Cb -0.03 -2.63 0.05 0.00 -1.78 0.00 0.00 34.13 29.74 2hm9 s GLU 123 CO 0.01 0.58 0.84 0.20 -0.49 0.00 0.00 175.26 176.40 2hm9 s GLY 124 N -0.58 -0.19 0.00 -1.39 0.00 -1.26 -4.80 107.32 99.10 2hm9 s GLY 124 Ca 0.09 -0.02 0.28 0.00 0.00 0.00 0.00 44.72 45.06 2hm9 s GLY 124 CO 0.02 -0.02 1.69 1.22 0.00 0.00 0.00 173.10 176.01 2hm9 n ASP 125 N -0.46 1.25 -4.22 1.64 9.92 -1.23 -4.83 116.55 118.62 2hm9 n ASP 125 Ca -0.06 -1.22 -0.32 0.00 -0.53 0.00 0.00 54.79 52.66 2hm9 n ASP 125 Cb 0.60 0.05 -0.17 0.00 -0.64 0.00 0.00 41.12 40.96 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 -2.21 2.17 0.12 -3.53 2.01 -1.01 -4.90 115.64 108.29 2hm9 s THR 126 Ca 0.33 -0.97 0.11 0.00 0.31 0.00 0.00 61.69 61.46 2hm9 s THR 126 Cb 0.20 -1.85 -0.04 0.00 0.01 0.00 0.00 72.50 70.83 2hm9 s THR 126 CO 0.41 0.55 -0.27 -0.54 -0.69 0.00 0.00 174.62 174.09 2hm9 s LYS 127 N 0.48 1.43 0.39 4.92 1.02 -1.26 -2.73 119.74 123.98 2hm9 s LYS 127 Ca -0.15 -1.31 -0.26 0.00 0.02 0.00 0.00 55.97 54.27 2hm9 s LYS 127 Cb -0.17 -1.88 -0.09 0.00 -0.52 0.00 0.00 37.83 35.18 2hm9 s LYS 127 CO 0.06 0.45 1.23 1.41 -0.92 0.00 0.00 175.35 177.58 2hm9 s MET 128 N -1.95 4.09 0.61 1.68 1.75 -1.15 -4.74 119.30 119.59 2hm9 s MET 128 Ca 0.13 2.00 -0.18 0.00 -1.25 0.00 0.00 55.69 56.39 2hm9 s MET 128 Cb -0.10 -2.78 -0.02 0.00 2.84 0.00 0.00 34.83 34.77 2hm9 s MET 128 CO 0.05 -0.34 1.16 0.96 -0.65 0.00 0.00 175.02 176.20 2hm9 s ILE 129 N -1.31 2.91 0.45 10.11 -5.25 -1.26 -4.96 121.20 121.89 2hm9 s ILE 129 Ca 0.55 0.51 -0.25 0.00 -0.99 0.00 0.00 60.65 60.47 2hm9 s ILE 129 Cb -0.34 -3.13 -0.08 0.00 2.95 0.00 0.00 42.46 41.86 2hm9 s ILE 129 CO 0.44 -0.17 1.42 -2.84 -1.79 0.00 0.00 174.94 172.00 2hm9 s PRO 130 N -3.58 3.66 0.05 0.37 0.02 -1.26 -5.03 135.00 129.23 2hm9 s PRO 130 Ca 0.73 2.40 0.06 0.00 0.02 0.00 0.00 61.00 64.21 2hm9 s PRO 130 Cb -0.26 -2.64 -0.02 0.00 0.02 0.00 0.00 34.50 31.60 2hm9 s PRO 130 CO 0.35 -0.83 -0.17 -0.51 -0.33 0.00 0.00 177.00 175.51 2hm9 s LEU 131 N -2.76 2.19 -0.98 -5.54 1.43 -1.26 -5.08 118.68 106.68 2hm9 s LEU 131 Ca 0.61 -0.51 -0.18 0.00 -1.03 0.00 0.00 54.13 53.02 2hm9 s LEU 131 Cb -0.43 -0.74 0.14 0.00 0.03 0.00 0.00 46.19 45.19 2hm9 s LEU 131 CO 0.55 0.07 1.18 0.20 0.23 0.00 0.00 176.35 178.58 2hm9 s ASN 132 N -1.28 6.72 0.27 2.29 -0.87 -1.26 -4.84 114.94 115.97 2hm9 s ASN 132 Ca 0.04 -2.24 -0.04 0.00 -1.57 0.00 0.00 52.86 49.05 2hm9 s ASN 132 Cb -0.09 -2.40 0.35 0.00 -0.02 0.00 0.00 41.25 39.10 2hm9 s ASN 132 CO 0.02 -1.00 1.92 -0.50 -2.57 0.00 0.00 177.10 174.97 2hm9 h TRP 133 N 8.49 1.11 -0.32 2.20 -0.00 -1.98 -2.35 115.95 123.10 2hm9 h TRP 133 Ca 0.19 -0.00 -0.06 0.00 -0.00 0.00 0.00 58.89 59.02 2hm9 h TRP 133 Cb 0.99 -0.37 -0.02 0.00 -0.00 0.00 0.00 29.16 29.77 2hm9 h TRP 133 CO 1.15 0.74 -0.04 0.22 -0.00 0.00 0.00 178.44 180.50 2hm9 h ASP 134 N 1.17 0.49 -0.18 -3.49 1.82 -2.05 -2.60 116.42 111.58 2hm9 h ASP 134 Ca 0.30 -0.10 -0.06 0.00 -0.39 0.00 0.00 57.03 56.78 2hm9 h ASP 134 Cb -0.05 -0.13 -0.02 0.00 0.68 0.00 0.00 39.33 39.81 2hm9 h ASP 134 CO -0.06 0.59 -0.06 0.44 -1.61 0.00 0.00 179.24 178.54 2hm9 h ASP 135 N 0.49 0.48 -3.52 2.28 3.32 -1.83 -3.43 116.42 114.20 2hm9 h ASP 135 Ca 0.10 -0.11 -0.68 0.00 0.02 0.00 0.00 57.03 56.36 2hm9 h ASP 135 Cb 0.39 -0.13 -0.17 0.00 0.22 0.00 0.00 39.33 39.64 2hm9 h ASP 135 CO 0.02 0.59 -0.67 -0.36 -1.72 0.00 0.00 179.24 177.10 2hm9 s PHE 136 N -4.85 3.01 -0.15 4.55 0.40 -0.98 -3.69 117.98 116.27 2hm9 s PHE 136 Ca -0.07 0.07 -0.02 0.00 -0.60 0.00 0.00 56.93 56.31 2hm9 s PHE 136 Cb 0.15 -1.71 -0.02 0.00 0.51 0.00 0.00 43.02 41.95 2hm9 s PHE 136 CO 0.77 0.40 -0.08 0.99 0.70 0.00 0.00 175.22 177.99 2hm9 s THR 137 N -0.89 3.46 0.21 0.64 2.01 -1.07 -4.83 115.64 115.17 2hm9 s THR 137 Ca 0.14 -0.51 -0.31 0.00 0.31 0.00 0.00 61.69 61.32 2hm9 s THR 137 Cb -0.11 -2.50 -0.11 0.00 0.01 0.00 0.00 72.50 69.80 2hm9 s THR 137 CO 0.04 0.50 1.59 -0.75 -0.69 0.00 0.00 174.62 175.31 2hm9 s LYS 138 N 0.48 4.18 -0.19 4.92 2.20 -1.26 -1.86 119.74 128.20 2hm9 s LYS 138 Ca -0.06 2.46 -0.14 0.00 -0.36 0.00 0.00 55.97 57.87 2hm9 s LYS 138 Cb -0.15 -3.10 -0.20 0.00 -1.51 0.00 0.00 37.83 32.87 2hm9 s LYS 138 CO 0.04 -0.62 0.15 1.33 -0.36 0.00 0.00 175.35 175.88 2hm9 n VAL 139 N 3.35 1.61 -3.65 4.02 0.24 0.22 -4.89 118.33 119.24 2hm9 n VAL 139 Ca 0.12 -0.34 -0.10 0.00 -2.04 0.00 0.00 64.34 61.99 2hm9 n VAL 139 Cb 0.38 -1.86 -0.03 0.00 -1.47 0.00 0.00 33.84 30.86 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 -6.98 -0.38 0.16 -1.34 0.01 -1.19 -5.03 113.70 98.94 2hm9 s SER 140 Ca -0.29 -0.33 -0.21 0.00 1.31 0.00 0.00 55.95 56.44 2hm9 s SER 140 Cb 0.08 0.63 0.06 0.00 0.21 0.00 0.00 66.02 66.99 2hm9 s SER 140 CO 0.64 -1.10 0.55 -0.94 0.41 0.00 0.00 173.24 172.80 2hm9 s SER 141 N -2.84 -0.47 0.01 2.44 1.04 -1.26 -0.19 113.70 112.43 2hm9 s SER 141 Ca 0.06 -0.11 0.01 0.00 0.48 0.00 0.00 55.95 56.40 2hm9 s SER 141 Cb -0.02 0.57 -0.01 0.00 0.10 0.00 0.00 66.02 66.66 2hm9 s SER 141 CO -0.04 -0.95 -0.04 -0.60 0.98 0.00 0.00 173.24 172.59 2hm9 s ARG 142 N -3.77 0.28 -0.14 4.02 3.52 0.32 -4.97 118.95 118.21 2hm9 s ARG 142 Ca 0.02 -0.31 0.01 0.00 -0.13 0.00 0.00 55.73 55.32 2hm9 s ARG 142 Cb -0.00 -0.16 -0.00 0.00 -1.56 0.00 0.00 34.95 33.22 2hm9 s ARG 142 CO -0.12 0.03 -0.16 0.99 -0.81 0.00 0.00 175.30 175.24 2hm9 s THR 143 N -0.56 2.67 -0.08 4.11 2.01 -1.26 0.39 115.64 122.92 2hm9 s THR 143 Ca -0.04 -0.78 0.04 0.00 0.31 0.00 0.00 61.69 61.22 2hm9 s THR 143 Cb -0.04 -2.11 0.00 0.00 0.01 0.00 0.00 72.50 70.36 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 0.66 1.78 -0.21 3.82 1.01 -0.72 -5.02 120.40 121.73 2hm9 s VAL 144 Ca -0.08 -0.87 -0.03 0.00 0.00 0.00 0.00 61.98 61.00 2hm9 s VAL 144 Cb -0.16 -1.54 -0.01 0.00 0.00 0.00 0.00 36.38 34.67 2hm9 s VAL 144 CO 0.02 0.50 -0.06 -1.61 0.00 0.00 0.00 175.10 173.95 2hm9 s GLU 145 N 0.28 3.37 0.82 2.72 2.02 -1.26 -1.86 118.70 124.78 2hm9 s GLU 145 Ca -0.13 -0.64 -0.06 0.00 0.02 0.00 0.00 54.97 54.16 2hm9 s GLU 145 Cb -0.16 -2.94 0.16 0.00 0.10 0.00 0.00 34.13 31.29 2hm9 s GLU 145 CO 0.06 -0.14 1.12 0.34 0.02 0.00 0.00 175.26 176.66 2hm9 s ASP 146 N 1.31 3.81 0.14 -0.19 2.15 -1.26 -4.95 116.67 117.67 2hm9 s ASP 146 Ca 0.04 -0.23 -0.16 0.00 0.43 0.00 0.00 52.55 52.62 2hm9 s ASP 146 Cb -0.14 0.03 -0.00 0.00 -0.30 0.00 0.00 42.92 42.50 2hm9 s ASP 146 CO -0.03 -2.24 1.72 0.71 -0.17 0.00 0.00 175.17 175.17 2hm9 h THR 147 N -0.95 1.16 -2.94 1.71 1.35 -1.99 -3.43 112.91 107.82 2hm9 h THR 147 Ca -0.38 -0.46 -0.62 0.00 -0.55 0.00 0.00 66.41 64.40 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 0.37 0.17 -0.27 0.20 -0.25 0.00 0.00 175.52 175.74 2hm9 s ASN 148 N -5.74 6.69 0.29 5.36 -0.87 -1.26 -5.00 114.94 114.42 2hm9 s ASN 148 Ca -0.13 0.82 0.00 0.00 -1.57 0.00 0.00 52.86 51.98 2hm9 s ASN 148 Cb 0.10 -2.20 0.51 0.00 -0.02 0.00 0.00 41.25 39.64 2hm9 s ASN 148 CO 0.74 0.33 1.88 -0.65 -2.57 0.00 0.00 177.10 176.83 2hm9 h PRO 149 N 4.90 1.02 -0.58 -0.60 0.11 -1.95 -1.13 132.00 133.77 2hm9 h PRO 149 Ca -0.52 -0.06 -0.06 0.00 0.11 0.00 0.00 66.00 65.47 2hm9 h PRO 149 Cb 1.22 -0.23 -0.03 0.00 0.11 0.00 0.00 31.00 32.07 2hm9 h PRO 149 CO 0.61 0.68 0.13 0.00 -0.21 0.00 0.00 178.00 179.21 2hm9 h ALA 150 N 1.50 1.13 -0.24 -0.75 0.00 -1.94 -2.70 119.26 116.27 2hm9 h ALA 150 Ca 0.43 -0.22 -0.10 0.00 0.00 0.00 0.00 54.91 55.01 2hm9 h ALA 150 Cb 0.28 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2hm9 h ALA 150 CO -0.18 0.58 -0.29 -0.07 0.00 0.00 0.00 179.25 179.29 2hm9 h LEU 151 N 0.87 0.49 -9.80 0.00 3.38 -1.62 -3.26 115.31 105.37 2hm9 h LEU 151 Ca 0.19 -0.18 -0.54 0.00 0.09 0.00 0.00 57.88 57.44 2hm9 h LEU 151 Cb 0.33 -0.13 0.09 0.00 0.09 0.00 0.00 40.66 41.03 2hm9 h LEU 151 CO 0.00 0.76 0.87 0.41 0.09 0.00 0.00 178.44 180.57 2hm9 n THR 152 N -4.10 1.11 -3.95 0.22 -1.04 -0.69 -4.66 114.28 101.18 2hm9 n THR 152 Ca -0.01 -0.28 -0.09 0.00 -2.04 0.00 0.00 64.05 61.64 2hm9 n THR 152 Cb 0.43 -1.95 -0.09 0.00 -1.82 0.00 0.00 70.33 66.90 2hm9 n THR 152 CO 0.00 0.00 0.00 -1.38 -0.64 0.00 0.00 175.07 173.05 2hm9 s HIS 153 N -0.11 0.26 -0.05 -1.42 -3.43 -0.78 -2.68 115.29 107.08 2hm9 s HIS 153 Ca 0.63 -0.65 0.05 0.00 -0.80 0.00 0.00 55.06 54.30 2hm9 s HIS 153 Cb -0.50 -0.18 -0.01 0.00 -1.43 0.00 0.00 32.58 30.47 2hm9 s HIS 153 CO 0.50 -0.40 -0.21 0.99 -2.00 0.00 0.00 174.74 173.62 2hm9 s THR 154 N -3.15 1.72 -0.18 -5.38 2.01 -0.25 -1.75 115.64 108.66 2hm9 s THR 154 Ca -0.00 -0.88 -0.08 0.00 0.31 0.00 0.00 61.69 61.04 2hm9 s THR 154 Cb 0.02 -1.47 -0.04 0.00 0.01 0.00 0.00 72.50 71.02 2hm9 s THR 154 CO -0.07 0.49 0.08 -0.31 -0.69 0.00 0.00 174.62 174.12 2hm9 s TYR 155 N -0.06 3.31 0.02 4.92 2.02 0.16 -1.21 117.35 126.52 2hm9 s TYR 155 Ca -0.04 0.17 0.03 0.00 -0.37 0.00 0.00 57.07 56.86 2hm9 s TYR 155 Cb -0.13 -2.09 -0.01 0.00 -0.40 0.00 0.00 41.96 39.33 2hm9 s TYR 155 CO 0.03 0.23 -0.09 -1.21 -1.57 0.00 0.00 175.55 172.94 2hm9 s GLU 156 N 0.26 0.65 -0.11 -0.62 2.02 -0.81 0.12 118.70 120.21 2hm9 s GLU 156 Ca 0.05 -0.50 0.03 0.00 0.02 0.00 0.00 54.97 54.58 2hm9 s GLU 156 Cb -0.12 -0.59 0.00 0.00 0.10 0.00 0.00 34.13 33.53 2hm9 s GLU 156 CO -0.00 0.15 -0.22 0.08 0.02 0.00 0.00 175.26 175.28 2hm9 s VAL 157 N -0.63 1.99 -0.06 2.63 1.01 0.74 -1.86 120.40 124.22 2hm9 s VAL 157 Ca -0.01 -0.96 0.02 0.00 0.00 0.00 0.00 61.98 61.03 2hm9 s VAL 157 Cb -0.06 -1.74 -0.03 0.00 0.00 0.00 0.00 36.38 34.56 2hm9 s VAL 157 CO 0.00 0.54 -0.10 0.26 0.00 0.00 0.00 175.10 175.80 2hm9 s TRP 158 N 0.56 2.84 -0.12 5.22 0.52 0.12 -0.61 118.94 127.47 2hm9 s TRP 158 Ca -0.14 -0.08 0.01 0.00 0.02 0.00 0.00 56.10 55.92 2hm9 s TRP 158 Cb -0.17 -1.69 -0.01 0.00 -1.15 0.00 0.00 33.47 30.46 2hm9 s TRP 158 CO 0.04 0.25 -0.17 -0.65 0.02 0.00 0.00 176.95 176.43 2hm9 s GLN 159 N -0.71 3.24 0.26 4.98 -0.21 -0.78 0.71 119.66 127.15 2hm9 s GLN 159 Ca 0.11 -0.76 -0.30 0.00 0.02 0.00 0.00 55.36 54.42 2hm9 s GLN 159 Cb -0.11 -2.51 -0.10 0.00 1.00 0.00 0.00 33.01 31.29 2hm9 s GLN 159 CO 0.01 0.18 1.45 0.21 -2.12 0.00 0.00 175.29 175.03 2hm9 s LYS 160 N 0.39 4.25 0.00 2.91 2.36 -0.40 -2.59 119.74 126.66 2hm9 s LYS 160 Ca -0.13 2.34 0.08 0.00 -2.55 0.00 0.00 55.97 55.70 2hm9 s LYS 160 Cb -0.17 -3.10 -0.02 0.00 -1.05 0.00 0.00 37.83 33.49 2hm9 s LYS 160 CO 0.06 -0.44 -0.25 -1.59 1.55 0.00 0.00 175.35 174.68 2hm9 s LYS 161 N -0.46 2.02 0.00 4.03 -2.85 -1.24 -4.95 119.74 116.28 2hm9 s LYS 161 Ca 0.59 -0.99 0.08 0.00 -1.00 0.00 0.00 55.97 54.66 2hm9 s LYS 161 Cb -0.43 -2.04 0.06 0.00 -2.06 0.00 0.00 37.83 33.37 2hm9 s LYS 161 CO 0.44 0.55 0.75 0.00 0.10 0.00 0.00 175.35 177.19