#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 1.19 -0.27 2.41 0.00 0.37 -3.00 121.76 122.46 2hm9 s ALA 2 Ca 0.00 -0.88 -0.07 0.00 0.00 0.00 0.00 51.96 51.01 2hm9 s ALA 2 Cb 0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 23.12 22.95 2hm9 s ALA 2 CO 0.00 0.21 0.06 -0.06 0.00 0.00 0.00 175.76 175.97 2hm9 s PHE 3 N -0.97 3.09 -0.23 0.00 0.40 0.17 0.10 117.98 120.54 2hm9 s PHE 3 Ca 0.01 -0.74 0.02 0.00 -0.60 0.00 0.00 56.93 55.62 2hm9 s PHE 3 Cb -0.08 -2.23 0.05 0.00 0.51 0.00 0.00 43.02 41.27 2hm9 s PHE 3 CO 0.02 -0.48 -0.14 -1.17 0.70 0.00 0.00 175.22 174.15 2hm9 s LEU 4 N 1.55 3.03 0.14 -0.37 2.96 -1.12 0.11 118.68 124.98 2hm9 s LEU 4 Ca 0.05 -1.15 -0.18 0.00 -0.22 0.00 0.00 54.13 52.62 2hm9 s LEU 4 Cb -0.16 -1.53 0.04 0.00 0.50 0.00 0.00 46.19 45.05 2hm9 s LEU 4 CO 0.02 -0.13 0.47 -1.66 -1.32 0.00 0.00 176.35 173.73 2hm9 s TRP 5 N 1.16 -0.29 -0.03 5.38 -2.14 -1.09 -4.51 118.94 117.42 2hm9 s TRP 5 Ca -0.04 0.00 0.05 0.00 2.66 0.00 0.00 56.10 58.77 2hm9 s TRP 5 Cb -0.18 0.36 -0.01 0.00 -3.10 0.00 0.00 33.47 30.54 2hm9 s TRP 5 CO -0.08 -0.77 -0.20 0.00 -2.66 0.00 0.00 176.95 173.25 2hm9 s ALA 6 N -3.80 1.68 0.04 2.67 0.00 -1.26 -2.33 121.76 118.76 2hm9 s ALA 6 Ca 0.03 -0.82 -0.01 0.00 0.00 0.00 0.00 51.96 51.17 2hm9 s ALA 6 Cb 0.01 -0.50 -0.03 0.00 0.00 0.00 0.00 23.12 22.60 2hm9 s ALA 6 CO -0.11 0.35 -0.02 1.14 0.00 0.00 0.00 175.76 177.12 2hm9 s GLN 7 N -0.20 0.49 0.85 0.00 -2.07 0.87 -4.70 119.66 114.90 2hm9 s GLN 7 Ca 0.01 -0.96 -0.09 0.00 -1.82 0.00 0.00 55.36 52.51 2hm9 s GLN 7 Cb -0.10 0.17 0.17 0.00 -1.09 0.00 0.00 33.01 32.16 2hm9 s GLN 7 CO 0.01 -0.09 1.17 0.16 -1.32 0.00 0.00 175.29 175.23 2hm9 s ASP 8 N -2.31 3.64 0.21 12.60 -4.77 -1.14 -2.62 116.67 122.28 2hm9 s ASP 8 Ca -0.03 -0.09 -0.09 0.00 -3.30 0.00 0.00 52.55 49.04 2hm9 s ASP 8 Cb 0.00 -0.08 0.16 0.00 -1.09 0.00 0.00 42.92 41.91 2hm9 s ASP 8 CO -0.06 -2.36 1.84 0.08 0.70 0.00 0.00 175.17 175.37 2hm9 h ARG 9 N -1.14 1.07 -0.74 2.11 0.11 -1.57 -2.86 114.38 111.36 2hm9 h ARG 9 Ca -0.40 -0.11 -0.05 0.00 0.10 0.00 0.00 59.98 59.52 2hm9 h ARG 9 Cb 1.25 -0.22 -0.03 0.00 1.11 0.00 0.00 29.97 32.08 2hm9 h ARG 9 CO 0.37 0.77 0.28 -0.44 0.10 0.00 0.00 179.97 181.06 2hm9 h ASP 10 N 1.07 1.03 0.00 0.08 5.19 -1.89 -3.47 116.42 118.43 2hm9 h ASP 10 Ca 0.28 -0.18 0.00 0.00 -0.62 0.00 0.00 57.03 56.51 2hm9 h ASP 10 Cb -0.00 -0.27 0.00 0.00 0.18 0.00 0.00 39.33 39.24 2hm9 h ASP 10 CO -0.05 0.93 0.00 0.61 -3.12 0.00 0.00 179.24 177.61 2hm9 n GLY 11 N -0.84 1.35 3.84 2.75 0.00 -1.08 -5.13 105.19 106.09 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 -0.07 0.99 2.96 -1.26 -2.83 118.68 122.89 2hm9 s LEU 12 Ca 0.00 0.97 0.01 0.00 -0.22 0.00 0.00 54.13 54.88 2hm9 s LEU 12 Cb 0.00 -2.84 -0.25 0.00 0.50 0.00 0.00 46.19 43.60 2hm9 s LEU 12 CO 0.00 0.24 0.55 0.16 -1.32 0.00 0.00 176.35 175.98 2hm9 h ILE 13 N 3.31 0.79 0.00 6.68 3.07 -1.81 -3.02 117.51 126.53 2hm9 h ILE 13 Ca -0.50 -2.54 0.00 0.00 1.55 0.00 0.00 64.86 63.37 2hm9 h ILE 13 Cb 1.21 2.52 0.00 0.00 -0.27 0.00 0.00 36.82 40.28 2hm9 h ILE 13 CO 0.64 0.74 0.00 0.61 -1.05 0.00 0.00 178.15 179.09 2hm9 n GLY 14 N 1.79 -0.29 3.08 0.16 0.00 -1.06 -4.58 105.19 104.29 2hm9 n GLY 14 Ca -0.24 -0.96 -0.28 0.00 0.00 0.00 0.00 46.02 44.54 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 2.22 -2.03 1.61 2.20 -1.05 -0.55 119.74 120.15 2hm9 s LYS 15 Ca 0.00 -0.58 0.00 0.00 -0.36 0.00 0.00 55.97 55.03 2hm9 s LYS 15 Cb 0.00 -1.82 0.00 0.00 -1.51 0.00 0.00 37.83 34.50 2hm9 s LYS 15 CO 0.00 0.02 0.00 -0.25 -0.36 0.00 0.00 175.35 174.76 2hm9 n ASP 16 N 3.93 -5.65 0.00 1.43 8.00 -1.26 -1.84 116.55 121.16 2hm9 n ASP 16 Ca -0.20 0.30 0.00 0.00 0.71 0.00 0.00 54.79 55.60 2hm9 n ASP 16 Cb 0.52 -4.87 0.00 0.00 -0.02 0.00 0.00 41.12 36.75 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 -0.64 2.78 3.73 0.44 0.00 -1.26 -4.83 105.19 105.42 2hm9 n GLY 17 Ca -0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.39 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 -1.50 3.80 -0.32 1.61 -3.43 -0.77 -4.88 115.29 109.79 2hm9 s HIS 18 Ca 0.00 1.78 -0.28 0.00 -0.80 0.00 0.00 55.06 55.76 2hm9 s HIS 18 Cb 0.00 -3.09 -0.02 0.00 -1.43 0.00 0.00 32.58 28.04 2hm9 s HIS 18 CO 0.00 0.07 1.88 -0.51 -2.00 0.00 0.00 174.74 174.18 2hm9 s LEU 19 N -0.30 3.49 0.46 5.38 1.43 -1.26 -2.53 118.68 125.34 2hm9 s LEU 19 Ca 0.46 1.37 0.21 0.00 -1.03 0.00 0.00 54.13 55.15 2hm9 s LEU 19 Cb -0.25 -3.47 1.10 0.00 0.03 0.00 0.00 46.19 43.60 2hm9 s LEU 19 CO 0.31 -1.78 1.95 1.55 0.23 0.00 0.00 176.35 178.61 2hm9 h PRO 20 N 13.37 0.00 -6.23 1.29 0.13 -1.90 -3.43 132.00 135.23 2hm9 h PRO 20 Ca -0.35 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.23 2hm9 h PRO 20 Cb 1.18 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.27 2hm9 h PRO 20 CO 1.03 0.22 0.04 1.67 -0.23 0.00 0.00 178.00 180.73 2hm9 s TRP 21 N -4.14 3.76 -0.77 1.56 -2.14 -1.26 -5.02 118.94 110.92 2hm9 s TRP 21 Ca -0.02 1.34 -0.14 0.00 2.66 0.00 0.00 56.10 59.93 2hm9 s TRP 21 Cb 0.13 -2.65 0.20 0.00 -3.10 0.00 0.00 33.47 28.06 2hm9 s TRP 21 CO 0.65 0.42 0.72 -1.58 -2.66 0.00 0.00 176.95 174.49 2hm9 s HIS 22 N -0.54 3.65 -0.73 1.66 2.46 -1.26 -4.96 115.29 115.58 2hm9 s HIS 22 Ca 0.33 -1.84 0.04 0.00 0.47 0.00 0.00 55.06 54.06 2hm9 s HIS 22 Cb -0.20 -3.82 0.18 0.00 -0.13 0.00 0.00 32.58 28.61 2hm9 s HIS 22 CO 0.20 -1.00 0.55 -0.11 -2.47 0.00 0.00 174.74 171.91 2hm9 n LEU 23 N 4.27 3.22 -0.56 8.88 7.94 -1.26 -4.94 117.00 134.55 2hm9 n LEU 23 Ca 0.08 -5.23 0.46 0.00 -1.11 0.00 0.00 56.01 50.22 2hm9 n LEU 23 Cb 0.46 -0.79 0.78 0.00 0.53 0.00 0.00 43.42 44.39 2hm9 n LEU 23 CO 0.38 1.76 1.43 -0.65 -1.11 0.00 0.00 177.39 179.20 2hm9 h PRO 24 N 5.35 0.00 0.23 1.96 0.11 -1.98 0.18 132.00 137.85 2hm9 h PRO 24 Ca 0.15 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.25 2hm9 h PRO 24 Cb 0.75 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.86 2hm9 h PRO 24 CO 0.74 0.00 -0.11 0.22 -0.21 0.00 0.00 178.00 178.64 2hm9 h ASP 25 N 0.00 -0.26 -0.29 -2.05 3.58 -1.97 -0.95 116.42 114.48 2hm9 h ASP 25 Ca 0.80 -0.27 -0.06 0.00 0.42 0.00 0.00 57.03 57.92 2hm9 h ASP 25 Cb 3.29 0.07 -0.02 0.00 1.72 0.00 0.00 39.33 44.38 2hm9 h ASP 25 CO -0.01 0.20 -0.00 -0.78 -2.88 0.00 0.00 179.24 175.77 2hm9 h ASP 26 N -0.79 0.60 -0.64 2.28 1.82 -1.12 -2.00 116.42 116.56 2hm9 h ASP 26 Ca -0.03 -0.13 -0.03 0.00 -0.39 0.00 0.00 57.03 56.45 2hm9 h ASP 26 Cb 0.51 -0.16 -0.03 0.00 0.68 0.00 0.00 39.33 40.33 2hm9 h ASP 26 CO 0.05 0.67 0.27 -0.07 -1.61 0.00 0.00 179.24 178.55 2hm9 h LEU 27 N 0.60 0.87 -0.88 2.28 3.38 -1.08 -2.10 115.31 118.37 2hm9 h LEU 27 Ca 0.12 -0.16 0.03 0.00 0.09 0.00 0.00 57.88 57.96 2hm9 h LEU 27 Cb 0.38 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.86 2hm9 h LEU 27 CO 0.01 0.79 0.58 0.45 0.09 0.00 0.00 178.44 180.36 2hm9 h HIS 28 N 0.89 1.08 -0.38 1.13 3.86 -0.69 -1.92 115.15 119.12 2hm9 h HIS 28 Ca 0.21 0.03 0.01 0.00 -1.16 0.00 0.00 60.37 59.46 2hm9 h HIS 28 Cb 0.18 -0.36 -0.02 0.00 1.06 0.00 0.00 27.41 28.27 2hm9 h HIS 28 CO 0.01 0.64 0.25 -0.92 0.86 0.00 0.00 177.93 178.77 2hm9 h TYR 29 N 1.14 0.46 -0.32 2.45 3.20 -0.75 -0.05 116.97 123.11 2hm9 h TYR 29 Ca 0.34 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.22 2hm9 h TYR 29 Cb -0.04 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.06 2hm9 h TYR 29 CO -0.01 0.29 0.18 0.35 -1.64 0.00 0.00 178.16 177.32 2hm9 h PHE 30 N 0.50 0.44 -0.62 -3.82 3.57 -0.83 -1.88 116.94 114.30 2hm9 h PHE 30 Ca 0.14 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.62 2hm9 h PHE 30 Cb -0.04 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.53 2hm9 h PHE 30 CO -0.06 0.35 0.35 -0.09 -2.23 0.00 0.00 178.31 176.63 2hm9 h ARG 31 N 0.40 0.86 -0.69 1.11 2.43 -1.14 -2.62 114.38 114.73 2hm9 h ARG 31 Ca 0.11 -0.10 -0.06 0.00 -0.81 0.00 0.00 59.98 59.13 2hm9 h ARG 31 Cb 0.05 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 29.40 2hm9 h ARG 31 CO -0.02 0.65 0.20 0.00 -1.51 0.00 0.00 179.97 179.29 2hm9 h ALA 32 N 1.17 1.06 -0.12 2.80 0.00 -0.82 -2.83 119.26 120.52 2hm9 h ALA 32 Ca 0.22 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 2hm9 h ALA 32 Cb 0.03 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2hm9 h ALA 32 CO -0.04 0.63 -0.27 1.96 0.00 0.00 0.00 179.25 181.54 2hm9 h GLN 33 N 1.02 0.21 -0.18 0.00 1.08 -1.14 -2.75 115.11 113.34 2hm9 h GLN 33 Ca 0.22 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.35 2hm9 h GLN 33 Cb 0.31 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.72 2hm9 h GLN 33 CO -0.01 0.47 0.00 0.25 -0.95 0.00 0.00 178.83 178.59 2hm9 n THR 34 N -4.16 0.23 -3.11 -0.54 -2.24 -1.01 -4.70 114.28 98.75 2hm9 n THR 34 Ca -0.01 -0.26 -0.40 0.00 -2.27 0.00 0.00 64.05 61.11 2hm9 n THR 34 Cb 0.37 0.13 -0.06 0.00 -2.10 0.00 0.00 70.33 68.66 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 -1.77 4.99 -0.23 2.28 -7.23 -1.04 -3.71 120.40 113.69 2hm9 s VAL 35 Ca 0.19 1.13 0.00 0.00 -1.81 0.00 0.00 61.98 61.49 2hm9 s VAL 35 Cb 0.10 -3.93 0.00 0.00 0.56 0.00 0.00 36.38 33.10 2hm9 s VAL 35 CO 0.14 0.04 0.00 0.61 -0.31 0.00 0.00 175.10 175.58 2hm9 n GLY 36 N 4.12 0.56 3.05 2.32 0.00 -1.22 -5.02 105.19 108.99 2hm9 n GLY 36 Ca -0.01 -0.77 -0.09 0.00 0.00 0.00 0.00 46.02 45.15 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 -1.85 0.50 0.02 1.61 1.02 -1.24 -4.80 119.74 114.99 2hm9 s LYS 37 Ca 0.00 -0.93 -0.30 0.00 0.02 0.00 0.00 55.97 54.76 2hm9 s LYS 37 Cb 0.00 0.06 -0.04 0.00 -0.52 0.00 0.00 37.83 37.33 2hm9 s LYS 37 CO 0.00 -0.05 1.00 0.42 -0.92 0.00 0.00 175.35 175.79 2hm9 s ILE 38 N -2.56 4.76 0.04 2.17 1.01 0.11 -3.82 121.20 122.92 2hm9 s ILE 38 Ca -0.04 2.01 0.06 0.00 0.00 0.00 0.00 60.65 62.68 2hm9 s ILE 38 Cb -0.02 -4.29 -0.02 0.00 0.01 0.00 0.00 42.46 38.14 2hm9 s ILE 38 CO -0.04 0.17 -0.17 -0.32 0.00 0.00 0.00 174.94 174.58 2hm9 s MET 39 N 0.90 1.08 -0.10 2.79 -2.45 -0.54 0.19 119.30 121.17 2hm9 s MET 39 Ca 0.52 -0.84 0.04 0.00 -1.25 0.00 0.00 55.69 54.15 2hm9 s MET 39 Cb -0.22 -1.14 -0.00 0.00 1.25 0.00 0.00 34.83 34.72 2hm9 s MET 39 CO 0.28 0.28 -0.23 0.08 1.05 0.00 0.00 175.02 176.48 2hm9 s VAL 40 N -0.86 2.11 -0.06 10.11 1.01 0.13 -1.14 120.40 131.70 2hm9 s VAL 40 Ca 0.04 -1.00 0.05 0.00 0.00 0.00 0.00 61.98 61.06 2hm9 s VAL 40 Cb -0.08 -1.81 -0.00 0.00 0.00 0.00 0.00 36.38 34.49 2hm9 s VAL 40 CO 0.02 0.56 -0.20 0.68 0.00 0.00 0.00 175.10 176.15 2hm9 s VAL 41 N 0.36 1.69 0.97 2.92 -7.23 0.16 0.42 120.40 119.69 2hm9 s VAL 41 Ca -0.18 -0.85 -0.12 0.00 -1.81 0.00 0.00 61.98 59.02 2hm9 s VAL 41 Cb -0.18 -1.45 0.17 0.00 0.56 0.00 0.00 36.38 35.48 2hm9 s VAL 41 CO 0.08 0.48 1.10 -0.83 -0.31 0.00 0.00 175.10 175.62 2hm9 s GLY 42 N 0.11 1.58 0.19 2.32 0.00 0.36 -0.28 107.32 111.60 2hm9 s GLY 42 Ca -0.08 -0.32 -0.12 0.00 0.00 0.00 0.00 44.72 44.21 2hm9 s GLY 42 CO 0.04 0.27 1.82 -0.09 0.00 0.00 0.00 173.10 175.14 2hm9 h ARG 43 N -1.80 0.90 -0.62 2.90 1.12 -1.81 -0.94 114.38 114.14 2hm9 h ARG 43 Ca -0.53 -0.09 0.01 0.00 -1.11 0.00 0.00 59.98 58.26 2hm9 h ARG 43 Cb 1.32 -0.18 -0.03 0.00 -0.01 0.00 0.00 29.97 31.07 2hm9 h ARG 43 CO 0.57 0.66 0.41 0.00 -3.11 0.00 0.00 179.97 178.50 2hm9 h ARG 44 N 0.89 0.78 -0.47 0.20 3.08 -1.92 -1.22 114.38 115.72 2hm9 h ARG 44 Ca 0.23 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.20 2hm9 h ARG 44 Cb 0.00 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.85 2hm9 h ARG 44 CO -0.04 0.52 0.17 1.15 -1.07 0.00 0.00 179.97 180.70 2hm9 h THR 45 N 0.81 1.22 -1.00 2.04 2.02 -1.58 -0.40 112.91 116.01 2hm9 h THR 45 Ca 0.23 -0.69 0.22 0.00 0.77 0.00 0.00 66.41 66.94 2hm9 h THR 45 Cb -0.05 0.78 -0.11 0.00 -1.74 0.00 0.00 68.15 67.03 2hm9 h THR 45 CO -0.05 0.26 0.61 0.22 0.37 0.00 0.00 175.52 176.92 2hm9 h TYR 46 N 0.63 0.98 0.00 3.16 3.20 0.03 0.81 116.97 125.78 2hm9 h TYR 46 Ca 0.16 0.03 -0.19 0.00 3.14 0.00 0.00 58.73 61.87 2hm9 h TYR 46 Cb 0.23 -0.29 -0.03 0.00 1.54 0.00 0.00 36.73 38.18 2hm9 h TYR 46 CO 0.01 0.15 -1.11 0.93 -1.64 0.00 0.00 178.16 176.50 2hm9 h GLU 47 N 0.64 0.00 0.00 1.82 5.08 -1.35 -3.32 114.58 117.44 2hm9 h GLU 47 Ca 0.60 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.80 2hm9 h GLU 47 Cb 1.11 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.34 2hm9 h GLU 47 CO -0.40 0.58 -0.77 1.03 -1.00 0.00 0.00 179.01 178.45 2hm9 h SER 48 N 0.00 0.00 -3.67 1.42 0.87 0.89 -3.46 113.55 109.60 2hm9 h SER 48 Ca -0.10 0.00 -0.57 0.00 -1.23 0.00 0.00 61.79 59.89 2hm9 h SER 48 Cb 1.66 0.00 0.15 0.00 -0.44 0.00 0.00 62.40 63.77 2hm9 h SER 48 CO 0.08 0.77 0.33 0.33 -0.53 0.00 0.00 176.83 177.81 2hm9 n PHE 49 N -3.33 1.52 -0.00 2.24 7.35 0.26 -4.83 117.46 120.67 2hm9 n PHE 49 Ca 0.01 0.46 -0.17 0.00 -0.76 0.00 0.00 57.45 56.98 2hm9 n PHE 49 Cb 0.83 -2.25 -0.10 0.00 0.35 0.00 0.00 39.48 38.31 2hm9 n PHE 49 CO 0.00 0.00 0.00 -1.00 -0.76 0.00 0.00 176.76 175.00 2hm9 h PRO 50 N 1.08 0.52 -1.91 -7.13 0.13 -1.90 -3.46 132.00 119.33 2hm9 h PRO 50 Ca -0.49 -0.50 0.09 0.00 -0.87 0.00 0.00 66.00 64.23 2hm9 h PRO 50 Cb 1.33 0.13 -0.20 0.00 0.13 0.00 0.00 31.00 32.39 2hm9 h PRO 50 CO 0.55 1.13 -0.09 0.21 -0.23 0.00 0.00 178.00 179.57 2hm9 s LYS 51 N -3.43 0.56 0.14 0.86 2.47 -1.26 -5.17 119.74 113.91 2hm9 s LYS 51 Ca -0.12 1.38 0.06 0.00 -1.56 0.00 0.00 55.97 55.72 2hm9 s LYS 51 Cb 0.05 0.79 -0.04 0.00 -1.46 0.00 0.00 37.83 37.17 2hm9 s LYS 51 CO 0.85 -0.19 -0.13 1.03 0.16 0.00 0.00 175.35 177.06 2hm9 s ARG 52 N 2.78 1.09 0.76 4.03 3.00 -1.26 -4.57 118.95 124.77 2hm9 s ARG 52 Ca -0.06 -1.34 -0.06 0.00 0.00 0.00 0.00 55.73 54.27 2hm9 s ARG 52 Cb -0.11 -0.89 0.12 0.00 0.00 0.00 0.00 34.95 34.07 2hm9 s ARG 52 CO -0.19 0.16 1.06 -1.25 0.00 0.00 0.00 175.30 175.08 2hm9 s PRO 53 N -3.04 1.63 0.21 3.54 0.04 -1.26 -4.93 135.00 131.18 2hm9 s PRO 53 Ca 0.13 -0.71 -0.10 0.00 0.04 0.00 0.00 61.00 60.36 2hm9 s PRO 53 Cb -0.03 -2.19 -0.07 0.00 0.04 0.00 0.00 34.50 32.25 2hm9 s PRO 53 CO 0.03 -1.57 0.54 -0.51 0.04 0.00 0.00 177.00 175.54 2hm9 s LEU 54 N -5.32 4.21 0.14 -3.56 1.43 -1.26 -5.07 118.68 109.25 2hm9 s LEU 54 Ca 0.66 0.94 -0.25 0.00 -1.03 0.00 0.00 54.13 54.45 2hm9 s LEU 54 Cb -0.07 -3.57 -0.08 0.00 0.03 0.00 0.00 46.19 42.51 2hm9 s LEU 54 CO 0.46 -0.03 0.77 -2.16 0.23 0.00 0.00 176.35 175.62 2hm9 s PRO 55 N -2.62 4.55 -1.52 1.29 0.04 -1.26 -3.83 135.00 131.65 2hm9 s PRO 55 Ca 0.45 1.14 0.00 0.00 0.04 0.00 0.00 61.00 62.63 2hm9 s PRO 55 Cb -0.12 -3.28 0.00 0.00 0.04 0.00 0.00 34.50 31.14 2hm9 s PRO 55 CO 0.21 0.52 0.00 0.39 0.04 0.00 0.00 177.00 178.16 2hm9 n GLU 56 N 1.80 -1.31 -4.10 4.56 1.02 -1.26 -4.92 120.64 116.44 2hm9 n GLU 56 Ca -0.05 0.88 -0.08 0.00 -0.02 0.00 0.00 57.16 57.89 2hm9 n GLU 56 Cb 0.49 -5.27 -0.10 0.00 -0.02 0.00 0.00 31.44 26.54 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 -4.53 0.63 -0.39 3.49 0.52 -1.25 -3.41 118.95 114.01 2hm9 s ARG 57 Ca 0.00 -1.19 -0.05 0.00 -0.52 0.00 0.00 55.73 53.97 2hm9 s ARG 57 Cb 0.00 0.12 0.08 0.00 0.52 0.00 0.00 34.95 35.68 2hm9 s ARG 57 CO 0.00 -0.09 0.18 0.99 0.02 0.00 0.00 175.30 176.40 2hm9 s THR 58 N -3.66 3.60 -0.09 0.02 2.01 -1.25 -4.84 115.64 111.43 2hm9 s THR 58 Ca 0.06 -1.62 -0.04 0.00 0.31 0.00 0.00 61.69 60.39 2hm9 s THR 58 Cb 0.06 -3.26 -0.04 0.00 0.01 0.00 0.00 72.50 69.27 2hm9 s THR 58 CO -0.08 -0.47 0.09 0.20 -0.69 0.00 0.00 174.62 173.66 2hm9 s ASN 59 N 1.79 5.90 -0.06 3.53 0.01 -1.26 -1.47 114.94 123.38 2hm9 s ASN 59 Ca 0.03 0.31 0.02 0.00 -0.71 0.00 0.00 52.86 52.51 2hm9 s ASN 59 Cb -0.22 -1.80 0.01 0.00 0.41 0.00 0.00 41.25 39.65 2hm9 s ASN 59 CO -0.01 0.37 -0.12 -0.69 -1.51 0.00 0.00 177.10 175.14 2hm9 s VAL 60 N -1.01 1.13 -0.32 1.60 1.01 -0.29 -0.90 120.40 121.61 2hm9 s VAL 60 Ca 0.16 -0.49 -0.14 0.00 0.00 0.00 0.00 61.98 61.51 2hm9 s VAL 60 Cb -0.12 -1.03 -0.02 0.00 0.00 0.00 0.00 36.38 35.21 2hm9 s VAL 60 CO 0.05 0.35 0.31 -0.69 0.00 0.00 0.00 175.10 175.13 2hm9 s VAL 61 N 0.56 5.22 -0.17 2.92 1.01 0.70 0.37 120.40 131.00 2hm9 s VAL 61 Ca -0.13 0.07 -0.05 0.00 0.00 0.00 0.00 61.98 61.88 2hm9 s VAL 61 Cb -0.15 -3.74 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 2hm9 s VAL 61 CO 0.03 0.00 -0.01 -0.22 0.00 0.00 0.00 175.10 174.90 2hm9 s LEU 62 N 1.92 3.31 0.08 3.92 0.20 0.62 -1.65 118.68 127.07 2hm9 s LEU 62 Ca 0.10 -0.14 0.03 0.00 0.69 0.00 0.00 54.13 54.82 2hm9 s LEU 62 Cb -0.17 -1.82 -0.03 0.00 -0.43 0.00 0.00 46.19 43.75 2hm9 s LEU 62 CO 0.11 0.13 -0.09 0.28 -0.29 0.00 0.00 176.35 176.49 2hm9 s THR 63 N 0.60 0.77 0.14 3.68 -1.32 -1.16 -2.41 115.64 115.93 2hm9 s THR 63 Ca -0.01 -1.49 -0.13 0.00 -1.21 0.00 0.00 61.69 58.85 2hm9 s THR 63 Cb -0.14 -1.15 -0.00 0.00 -1.51 0.00 0.00 72.50 69.69 2hm9 s THR 63 CO 0.02 -0.54 1.57 0.45 -2.21 0.00 0.00 174.62 173.92 2hm9 h HIS 64 N 3.81 0.89 -2.92 9.09 3.86 -1.90 -3.39 115.15 124.60 2hm9 h HIS 64 Ca -0.37 -0.17 -0.65 0.00 -1.16 0.00 0.00 60.37 58.03 2hm9 h HIS 64 Cb 1.19 -0.23 -0.10 0.00 1.06 0.00 0.00 27.41 29.33 2hm9 h HIS 64 CO 0.63 0.88 -0.51 -1.14 0.86 0.00 0.00 177.93 178.65 2hm9 s GLN 65 N -4.94 3.60 0.00 2.45 2.00 -1.26 -4.98 119.66 116.53 2hm9 s GLN 65 Ca -0.12 -0.20 0.25 0.00 -2.00 0.00 0.00 55.36 53.28 2hm9 s GLN 65 Cb 0.11 -3.19 1.32 0.00 0.80 0.00 0.00 33.01 32.04 2hm9 s GLN 65 CO 0.82 0.62 1.84 -0.85 -0.50 0.00 0.00 175.29 177.21 2hm9 n GLU 66 N 2.48 0.47 -0.01 1.67 0.28 -1.26 -2.98 120.64 121.29 2hm9 n GLU 66 Ca -0.19 0.04 -0.04 0.00 -0.16 0.00 0.00 57.16 56.81 2hm9 n GLU 66 Cb 0.54 -1.50 0.19 0.00 1.43 0.00 0.00 31.44 32.09 2hm9 n GLU 66 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 177.13 177.19 2hm9 h ASP 67 N 0.00 0.56 -3.94 -1.84 1.82 -1.97 -3.44 116.42 107.61 2hm9 h ASP 67 Ca 0.00 -0.18 -0.50 0.00 -0.39 0.00 0.00 57.03 55.96 2hm9 h ASP 67 Cb 0.17 -0.15 0.03 0.00 0.68 0.00 0.00 39.33 40.06 2hm9 h ASP 67 CO 0.00 0.77 0.46 -0.47 -1.61 0.00 0.00 179.24 178.39 2hm9 s TYR 68 N -4.58 3.20 0.08 0.28 6.14 -1.16 -5.06 117.35 116.24 2hm9 s TYR 68 Ca -0.07 1.61 0.03 0.00 0.64 0.00 0.00 57.07 59.27 2hm9 s TYR 68 Cb 0.14 -3.27 -0.03 0.00 0.42 0.00 0.00 41.96 39.21 2hm9 s TYR 68 CO 0.80 -0.96 -0.09 -0.65 0.64 0.00 0.00 175.55 175.29 2hm9 s GLN 69 N -2.28 0.75 0.02 4.97 1.11 -1.26 -5.01 119.66 117.95 2hm9 s GLN 69 Ca 0.56 -1.03 0.02 0.00 0.01 0.00 0.00 55.36 54.91 2hm9 s GLN 69 Cb -0.27 -0.45 -0.02 0.00 -1.01 0.00 0.00 33.01 31.26 2hm9 s GLN 69 CO 0.34 0.07 -0.06 0.00 0.01 0.00 0.00 175.29 175.66 2hm9 s ALA 70 N -2.13 0.42 -0.13 6.09 0.00 -1.26 -5.14 121.76 119.61 2hm9 s ALA 70 Ca 0.01 -0.52 -0.03 0.00 0.00 0.00 0.00 51.96 51.42 2hm9 s ALA 70 Cb -0.05 0.01 -0.03 0.00 0.00 0.00 0.00 23.12 23.05 2hm9 s ALA 70 CO -0.00 -0.00 -0.02 -0.65 0.00 0.00 0.00 175.76 175.09 2hm9 s GLN 71 N -1.01 3.38 0.00 0.00 -0.21 -1.26 -4.47 119.66 116.10 2hm9 s GLN 71 Ca -0.07 -0.47 0.00 0.00 0.02 0.00 0.00 55.36 54.85 2hm9 s GLN 71 Cb -0.07 -2.87 0.00 0.00 1.00 0.00 0.00 33.01 31.07 2hm9 s GLN 71 CO -0.00 0.45 0.00 0.41 -2.12 0.00 0.00 175.29 174.03 2hm9 n GLY 72 N 2.93 3.31 3.00 3.09 0.00 -1.26 -4.61 105.19 111.65 2hm9 n GLY 72 Ca -0.18 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.64 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 0.84 0.25 4.61 0.00 -1.26 -4.56 121.76 119.16 2hm9 s ALA 73 Ca 0.00 -0.34 -0.31 0.00 0.00 0.00 0.00 51.96 51.31 2hm9 s ALA 73 Cb 0.00 -0.30 -0.12 0.00 0.00 0.00 0.00 23.12 22.70 2hm9 s ALA 73 CO 0.00 0.14 1.60 0.28 0.00 0.00 0.00 175.76 177.79 2hm9 n VAL 74 N 3.23 0.60 -3.37 0.00 0.31 -0.08 -3.62 118.33 115.40 2hm9 n VAL 74 Ca -0.17 -0.15 -0.41 0.00 -0.01 0.00 0.00 64.34 63.60 2hm9 n VAL 74 Cb 0.55 -1.85 -0.09 0.00 -0.91 0.00 0.00 33.84 31.54 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 0.43 5.14 -0.09 2.52 1.01 -1.25 0.25 120.40 128.42 2hm9 s VAL 75 Ca 0.69 0.15 0.03 0.00 0.00 0.00 0.00 61.98 62.85 2hm9 s VAL 75 Cb -0.54 -3.83 0.01 0.00 0.00 0.00 0.00 36.38 32.02 2hm9 s VAL 75 CO 0.43 -0.09 -0.16 0.68 0.00 0.00 0.00 175.10 175.96 2hm9 s VAL 76 N 2.09 1.50 -1.90 2.92 -7.23 -0.66 -4.97 120.40 112.15 2hm9 s VAL 76 Ca 0.13 -0.68 0.17 0.00 -1.81 0.00 0.00 61.98 59.80 2hm9 s VAL 76 Cb -0.16 -1.34 0.07 0.00 0.56 0.00 0.00 36.38 35.50 2hm9 s VAL 76 CO 0.12 0.44 0.98 1.41 -0.31 0.00 0.00 175.10 177.73 2hm9 n HIS 77 N 3.83 0.00 -3.70 2.82 -0.00 -1.26 -3.01 115.22 113.89 2hm9 n HIS 77 Ca -0.21 0.00 -0.37 0.00 -0.00 0.00 0.00 57.72 57.15 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 -1.73 5.88 0.17 0.41 1.01 -1.26 -4.86 116.67 116.28 2hm9 s ASP 78 Ca 0.17 0.03 -0.13 0.00 0.71 0.00 0.00 52.55 53.34 2hm9 s ASP 78 Cb 0.14 -2.06 0.06 0.00 1.01 0.00 0.00 42.92 42.07 2hm9 s ASP 78 CO 0.32 0.04 1.74 0.58 0.21 0.00 0.00 175.17 178.06 2hm9 h VAL 79 N 5.16 1.21 -0.54 -1.27 2.07 -1.97 -2.25 116.25 118.66 2hm9 h VAL 79 Ca -0.37 -0.62 -0.05 0.00 0.82 0.00 0.00 66.70 66.48 2hm9 h VAL 79 Cb 1.18 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.51 2hm9 h VAL 79 CO 0.62 0.24 0.13 0.00 0.02 0.00 0.00 177.57 178.59 2hm9 h ALA 80 N 1.09 1.21 -0.64 1.67 0.00 -2.00 -2.66 119.26 117.92 2hm9 h ALA 80 Ca 0.19 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 2hm9 h ALA 80 Cb 0.15 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2hm9 h ALA 80 CO -0.02 0.54 0.25 0.00 0.00 0.00 0.00 179.25 180.02 2hm9 h ALA 81 N 1.34 1.24 -0.51 0.00 0.00 -1.84 -1.34 119.26 118.15 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 0.29 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2hm9 h ALA 81 CO -0.00 0.56 0.25 0.28 0.00 0.00 0.00 179.25 180.34 2hm9 h VAL 82 N 0.92 1.19 -0.42 0.00 2.07 -1.07 0.35 116.25 119.29 2hm9 h VAL 82 Ca 0.22 -0.52 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 2hm9 h VAL 82 Cb 0.19 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 2hm9 h VAL 82 CO -0.02 0.21 0.23 -0.26 0.02 0.00 0.00 177.57 177.75 2hm9 h PHE 83 N 0.67 0.57 -0.61 1.57 0.04 -1.36 -2.52 116.94 115.30 2hm9 h PHE 83 Ca 0.17 -0.01 -0.04 0.00 2.80 0.00 0.00 57.97 60.89 2hm9 h PHE 83 Cb 0.10 -0.18 -0.03 0.00 2.20 0.00 0.00 35.95 38.04 2hm9 h PHE 83 CO -0.01 0.43 0.21 0.00 -0.60 0.00 0.00 178.31 178.34 2hm9 h ALA 84 N 1.09 1.21 -0.35 2.45 0.00 -0.92 -1.19 119.26 121.54 2hm9 h ALA 84 Ca 0.15 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2hm9 h ALA 84 Cb 0.05 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2hm9 h ALA 84 CO -0.02 0.56 0.22 -0.92 0.00 0.00 0.00 179.25 179.09 2hm9 h TYR 85 N 0.89 0.45 -0.60 0.00 5.03 -0.59 0.82 116.97 122.97 2hm9 h TYR 85 Ca 0.20 0.01 -0.05 0.00 2.58 0.00 0.00 58.73 61.47 2hm9 h TYR 85 Cb 0.23 -0.15 -0.03 0.00 1.55 0.00 0.00 36.73 38.34 2hm9 h TYR 85 CO 0.02 0.30 0.17 0.00 -1.32 0.00 0.00 178.16 177.33 2hm9 h ALA 86 N 1.11 1.17 -0.57 1.82 0.00 -1.16 -2.21 119.26 119.42 2hm9 h ALA 86 Ca 0.13 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 2hm9 h ALA 86 Cb -0.03 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 2hm9 h ALA 86 CO -0.03 0.57 0.21 -0.22 0.00 0.00 0.00 179.25 179.78 2hm9 h LYS 87 N 0.89 0.83 -0.77 0.00 1.63 -0.44 -2.42 116.57 116.29 2hm9 h LYS 87 Ca 0.20 -0.14 -0.06 0.00 -0.85 0.00 0.00 60.65 59.81 2hm9 h LYS 87 Cb 0.28 -0.14 -0.03 0.00 -0.60 0.00 0.00 32.23 31.73 2hm9 h LYS 87 CO -0.01 0.70 0.26 1.96 -3.45 0.00 0.00 179.45 178.91 2hm9 h GLN 88 N 0.82 1.18 -2.95 1.90 4.20 -0.24 -3.29 115.11 116.73 2hm9 h GLN 88 Ca 0.19 -0.24 -0.75 0.00 0.06 0.00 0.00 58.65 57.91 2hm9 h GLN 88 Cb 0.19 -0.18 -0.32 0.00 0.30 0.00 0.00 27.48 27.47 2hm9 h GLN 88 CO -0.01 0.99 0.32 0.72 -0.67 0.00 0.00 178.83 180.17 2hm9 n HIS 89 N -4.25 3.35 0.25 2.96 8.25 -0.91 -4.85 115.22 120.02 2hm9 n HIS 89 Ca 0.06 -3.37 0.08 0.00 -0.26 0.00 0.00 57.72 54.23 2hm9 n HIS 89 Cb 0.22 -1.17 0.63 0.00 1.12 0.00 0.00 29.99 30.78 2hm9 n HIS 89 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2hm9 h PRO 90 N 5.48 0.01 -0.41 -0.41 0.13 -1.63 -2.04 132.00 133.13 2hm9 h PRO 90 Ca 0.19 -0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.27 2hm9 h PRO 90 Cb 0.70 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.81 2hm9 h PRO 90 CO 1.11 0.02 0.03 -0.44 -0.23 0.00 0.00 178.00 178.49 2hm9 h ASP 91 N 0.01 0.61 -3.29 1.44 3.32 -1.89 -3.41 116.42 113.20 2hm9 h ASP 91 Ca 0.00 -0.12 -0.63 0.00 0.02 0.00 0.00 57.03 56.30 2hm9 h ASP 91 Cb 0.03 -0.16 -0.18 0.00 0.22 0.00 0.00 39.33 39.24 2hm9 h ASP 91 CO 0.00 0.66 -0.61 -1.10 -1.72 0.00 0.00 179.24 176.47 2hm9 s GLN 92 N -5.03 3.78 0.50 3.56 -0.21 -0.77 -5.09 119.66 116.39 2hm9 s GLN 92 Ca -0.08 -0.43 -0.18 0.00 0.02 0.00 0.00 55.36 54.69 2hm9 s GLN 92 Cb 0.15 -3.05 -0.08 0.00 1.00 0.00 0.00 33.01 31.03 2hm9 s GLN 92 CO 0.78 0.29 0.99 -1.21 -2.12 0.00 0.00 175.29 174.02 2hm9 s GLU 93 N 0.28 3.93 -0.21 2.91 8.01 -1.26 -4.70 118.70 127.66 2hm9 s GLU 93 Ca 0.00 1.10 -0.08 0.00 0.01 0.00 0.00 54.97 56.00 2hm9 s GLU 93 Cb -0.13 -2.13 -0.04 0.00 -4.31 0.00 0.00 34.13 27.52 2hm9 s GLU 93 CO 0.02 -0.29 0.10 -1.17 0.01 0.00 0.00 175.26 173.92 2hm9 s LEU 94 N -3.77 3.89 -0.06 1.80 2.96 -1.25 -0.71 118.68 121.54 2hm9 s LEU 94 Ca 0.62 0.07 0.05 0.00 -0.22 0.00 0.00 54.13 54.64 2hm9 s LEU 94 Cb -0.11 -2.01 -0.00 0.00 0.50 0.00 0.00 46.19 44.56 2hm9 s LEU 94 CO 0.25 0.12 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.51 2hm9 s VAL 95 N 0.70 1.70 -0.49 1.68 1.01 0.13 0.14 120.40 125.27 2hm9 s VAL 95 Ca 0.05 -0.86 -0.20 0.00 0.00 0.00 0.00 61.98 60.98 2hm9 s VAL 95 Cb -0.13 -1.46 0.05 0.00 0.00 0.00 0.00 36.38 34.84 2hm9 s VAL 95 CO 0.02 0.48 0.63 -0.63 0.00 0.00 0.00 175.10 175.60 2hm9 s ILE 96 N 0.05 4.85 -0.88 2.22 -1.09 0.29 0.20 121.20 126.84 2hm9 s ILE 96 Ca -0.06 -0.32 0.21 0.00 -2.23 0.00 0.00 60.65 58.25 2hm9 s ILE 96 Cb -0.13 -4.28 0.19 0.00 -1.58 0.00 0.00 42.46 36.66 2hm9 s ILE 96 CO 0.04 -0.76 1.66 0.00 -1.23 0.00 0.00 174.94 174.65 2hm9 n ALA 97 N 6.23 1.90 0.00 9.38 0.00 0.17 -2.77 120.51 135.42 2hm9 n ALA 97 Ca -0.05 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.35 2hm9 n ALA 97 Cb 0.46 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.56 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 0.53 0.82 0.00 0.00 0.00 -1.22 -4.91 105.19 100.42 2hm9 n GLY 98 Ca 0.04 -2.25 0.00 0.00 0.00 0.00 0.00 46.02 43.81 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 -1.01 -0.07 0.34 -0.02 0.00 -1.26 0.14 105.19 103.31 2hm9 n GLY 99 Ca 0.00 -1.77 -0.01 0.00 0.00 0.00 0.00 46.02 44.24 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 -1.57 1.33 -0.76 4.61 0.00 -1.94 0.54 119.26 121.47 2hm9 h ALA 100 Ca 0.00 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 2hm9 h ALA 100 Cb 0.00 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 2hm9 h ALA 100 CO 0.00 0.55 0.30 0.37 0.00 0.00 0.00 179.25 180.47 2hm9 h GLN 101 N 1.01 1.13 -0.44 0.00 5.75 -1.98 0.44 115.11 121.02 2hm9 h GLN 101 Ca 0.26 -0.20 -0.07 0.00 -0.15 0.00 0.00 58.65 58.48 2hm9 h GLN 101 Cb 0.03 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.38 2hm9 h GLN 101 CO -0.04 0.92 0.01 0.82 -2.65 0.00 0.00 178.83 177.89 2hm9 h ILE 102 N 1.09 1.26 -0.49 2.39 1.08 -1.63 -1.99 117.51 119.22 2hm9 h ILE 102 Ca 0.25 -1.03 -0.00 0.00 -0.39 0.00 0.00 64.86 63.69 2hm9 h ILE 102 Cb 0.21 1.05 -0.02 0.00 -3.07 0.00 0.00 36.82 34.99 2hm9 h ILE 102 CO -0.02 0.35 0.29 -0.26 -0.69 0.00 0.00 178.15 177.83 2hm9 h PHE 103 N 0.62 0.66 -0.79 1.37 0.04 0.83 -2.49 116.94 117.17 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 0.48 -0.21 -0.04 0.00 2.20 0.00 0.00 35.95 38.38 2hm9 h PHE 103 CO 0.04 0.46 0.49 1.79 -0.60 0.00 0.00 178.31 180.49 2hm9 h THR 104 N 0.66 1.22 -0.86 -1.55 1.35 0.03 1.02 112.91 114.77 2hm9 h THR 104 Ca 0.18 -0.45 -0.02 0.00 -0.55 0.00 0.00 66.41 65.57 2hm9 h THR 104 Cb 0.00 0.09 -0.04 0.00 -1.73 0.00 0.00 68.15 66.47 2hm9 h THR 104 CO -0.03 0.22 0.47 0.00 -0.25 0.00 0.00 175.52 175.92 2hm9 h ALA 105 N 1.27 1.20 -0.31 6.62 0.00 -0.99 -3.07 119.26 123.96 2hm9 h ALA 105 Ca 0.29 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2hm9 h ALA 105 Cb -0.07 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.38 2hm9 h ALA 105 CO -0.06 0.64 0.00 1.19 0.00 0.00 0.00 179.25 181.03 2hm9 n PHE 106 N -4.33 0.41 -0.19 0.00 3.72 -0.97 -4.62 117.46 111.47 2hm9 n PHE 106 Ca 0.09 -0.38 -0.04 0.00 -0.05 0.00 0.00 57.45 57.07 2hm9 n PHE 106 Cb 0.10 -0.02 0.14 0.00 -0.94 0.00 0.00 39.48 38.76 2hm9 n PHE 106 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 2hm9 h LYS 107 N 2.42 0.98 -0.40 -1.08 3.11 0.12 -2.99 116.57 118.73 2hm9 h LYS 107 Ca 0.00 -0.20 -0.05 0.00 -2.81 0.00 0.00 60.65 57.59 2hm9 h LYS 107 Cb 0.72 -0.15 -0.02 0.00 -1.00 0.00 0.00 32.23 31.78 2hm9 h LYS 107 CO 0.00 0.84 0.02 0.22 -2.81 0.00 0.00 179.45 177.72 2hm9 h ASP 108 N 0.94 0.59 -1.75 4.20 3.58 -1.82 -3.19 116.42 118.98 2hm9 h ASP 108 Ca 0.21 -0.12 -0.69 0.00 0.42 0.00 0.00 57.03 56.86 2hm9 h ASP 108 Cb 0.28 -0.15 -0.34 0.00 1.72 0.00 0.00 39.33 40.84 2hm9 h ASP 108 CO -0.01 0.65 0.26 0.47 -2.88 0.00 0.00 179.24 177.73 2hm9 n ASP 109 N -4.26 6.29 -4.30 2.28 9.92 -1.13 -4.98 116.55 120.37 2hm9 n ASP 109 Ca 0.02 -3.79 -0.32 0.00 -0.53 0.00 0.00 54.79 50.17 2hm9 n ASP 109 Cb 0.25 -0.79 -0.16 0.00 -0.64 0.00 0.00 41.12 39.78 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 -5.26 2.57 -0.11 2.53 1.01 -1.21 -4.65 120.40 115.29 2hm9 s VAL 110 Ca 0.51 -0.84 0.16 0.00 0.00 0.00 0.00 61.98 61.81 2hm9 s VAL 110 Cb 0.42 -2.04 -0.22 0.00 0.00 0.00 0.00 36.38 34.55 2hm9 s VAL 110 CO -0.30 0.54 0.50 -0.67 0.00 0.00 0.00 175.10 175.16 2hm9 n ASP 111 N 3.51 0.52 -4.13 3.32 2.03 -1.19 -4.50 116.55 116.11 2hm9 n ASP 111 Ca -0.19 0.24 -0.30 0.00 0.52 0.00 0.00 54.79 55.07 2hm9 n ASP 111 Cb 0.53 0.49 -0.17 0.00 -0.72 0.00 0.00 41.12 41.25 2hm9 n ASP 111 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2hm9 s THR 112 N -2.71 1.74 -0.15 5.18 2.01 -1.16 -1.27 115.64 119.28 2hm9 s THR 112 Ca -0.06 -0.81 0.00 0.00 0.31 0.00 0.00 61.69 61.13 2hm9 s THR 112 Cb 0.08 -1.54 -0.00 0.00 0.01 0.00 0.00 72.50 71.05 2hm9 s THR 112 CO 0.83 0.49 -0.15 -0.76 -0.69 0.00 0.00 174.62 174.34 2hm9 s LEU 113 N 0.65 2.51 -0.18 4.42 1.43 0.24 -0.66 118.68 127.08 2hm9 s LEU 113 Ca -0.13 -0.45 -0.01 0.00 -1.03 0.00 0.00 54.13 52.51 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 0.03 0.10 -0.12 -0.76 0.23 0.00 0.00 176.35 175.84 2hm9 s LEU 114 N 0.71 2.58 -0.04 1.79 1.43 0.31 -0.29 118.68 125.18 2hm9 s LEU 114 Ca -0.07 -0.46 0.03 0.00 -1.03 0.00 0.00 54.13 52.60 2hm9 s LEU 114 Cb -0.16 -1.62 0.00 0.00 0.03 0.00 0.00 46.19 44.45 2hm9 s LEU 114 CO 0.01 0.04 -0.12 0.54 0.23 0.00 0.00 176.35 177.05 2hm9 s VAL 115 N 1.10 1.04 -0.18 -1.59 0.11 -0.56 -2.67 120.40 117.64 2hm9 s VAL 115 Ca 0.00 -0.49 -0.03 0.00 -2.93 0.00 0.00 61.98 58.53 2hm9 s VAL 115 Cb -0.14 -0.91 -0.02 0.00 -1.53 0.00 0.00 36.38 33.78 2hm9 s VAL 115 CO -0.03 0.31 -0.05 -0.89 -3.33 0.00 0.00 175.10 171.11 2hm9 s THR 116 N 0.19 3.58 -0.10 5.04 2.01 -0.98 -1.75 115.64 123.63 2hm9 s THR 116 Ca -0.04 -0.45 0.00 0.00 0.31 0.00 0.00 61.69 61.52 2hm9 s THR 116 Cb -0.10 -2.59 -0.02 0.00 0.01 0.00 0.00 72.50 69.79 2hm9 s THR 116 CO 0.01 0.46 -0.11 -0.60 -0.69 0.00 0.00 174.62 173.69 2hm9 s ARG 117 N 0.91 3.11 -0.14 4.92 3.52 -0.79 -0.09 118.95 130.39 2hm9 s ARG 117 Ca -0.01 -0.65 -0.03 0.00 -0.13 0.00 0.00 55.73 54.92 2hm9 s ARG 117 Cb -0.15 -2.60 -0.03 0.00 -1.56 0.00 0.00 34.95 30.62 2hm9 s ARG 117 CO 0.01 0.39 -0.03 -0.51 -0.81 0.00 0.00 175.30 174.34 2hm9 s LEU 118 N -0.09 3.29 0.29 -0.88 1.02 -1.08 -1.50 118.68 119.74 2hm9 s LEU 118 Ca -0.01 -0.08 -0.01 0.00 0.02 0.00 0.00 54.13 54.05 2hm9 s LEU 118 Cb -0.14 -1.78 0.45 0.00 0.02 0.00 0.00 46.19 44.74 2hm9 s LEU 118 CO 0.03 0.22 1.88 0.00 0.02 0.00 0.00 176.35 178.50 2hm9 h ALA 119 N 6.35 1.30 -2.04 4.21 0.00 -1.64 -2.75 119.26 124.68 2hm9 h ALA 119 Ca -0.36 -0.16 -0.44 0.00 0.00 0.00 0.00 54.91 53.96 2hm9 h ALA 119 Cb 1.19 -0.24 0.17 0.00 0.00 0.00 0.00 17.79 18.91 2hm9 h ALA 119 CO 0.61 0.52 0.34 0.20 0.00 0.00 0.00 179.25 180.92 2hm9 s GLY 120 N -3.56 1.71 0.05 0.00 0.00 -1.23 -4.78 107.32 99.52 2hm9 s GLY 120 Ca -0.10 -1.10 0.04 0.00 0.00 0.00 0.00 44.72 43.56 2hm9 s GLY 120 CO 0.79 -0.31 -0.12 -1.35 0.00 0.00 0.00 173.10 172.12 2hm9 s SER 121 N -4.57 1.36 0.09 1.64 1.04 -1.26 -3.75 113.70 108.24 2hm9 s SER 121 Ca 0.73 -0.53 0.04 0.00 0.48 0.00 0.00 55.95 56.67 2hm9 s SER 121 Cb -0.06 -0.04 -0.03 0.00 0.10 0.00 0.00 66.02 65.99 2hm9 s SER 121 CO 0.54 -0.08 -0.12 -0.36 0.98 0.00 0.00 173.24 174.20 2hm9 s PHE 122 N -1.15 1.15 -0.09 5.02 0.40 -1.26 -5.09 117.98 116.96 2hm9 s PHE 122 Ca -0.03 -0.58 0.01 0.00 -0.60 0.00 0.00 56.93 55.73 2hm9 s PHE 122 Cb -0.09 -0.63 -0.03 0.00 0.51 0.00 0.00 43.02 42.79 2hm9 s PHE 122 CO 0.01 0.04 -0.10 -1.83 0.70 0.00 0.00 175.22 174.05 2hm9 s GLU 123 N -2.43 2.94 0.24 0.44 -1.05 -1.26 -4.88 118.70 112.69 2hm9 s GLU 123 Ca 0.03 -0.61 -0.22 0.00 -0.15 0.00 0.00 54.97 54.02 2hm9 s GLU 123 Cb -0.05 -2.59 0.04 0.00 -0.44 0.00 0.00 34.13 31.08 2hm9 s GLU 123 CO 0.01 0.51 0.78 0.20 0.95 0.00 0.00 175.26 177.71 2hm9 s GLY 124 N -0.40 -0.16 0.00 -3.83 0.00 -1.26 -4.87 107.32 96.81 2hm9 s GLY 124 Ca 0.05 -0.14 0.28 0.00 0.00 0.00 0.00 44.72 44.91 2hm9 s GLY 124 CO 0.02 -0.05 1.71 1.22 0.00 0.00 0.00 173.10 176.01 2hm9 n ASP 125 N -0.46 1.22 -4.26 1.64 8.00 -1.23 -4.83 116.55 116.64 2hm9 n ASP 125 Ca -0.05 -1.23 -0.33 0.00 0.71 0.00 0.00 54.79 53.90 2hm9 n ASP 125 Cb 0.60 0.04 -0.16 0.00 -0.02 0.00 0.00 41.12 41.58 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 -2.19 2.43 0.09 -3.53 2.01 0.29 -4.88 115.64 109.87 2hm9 s THR 126 Ca 0.33 -0.87 0.10 0.00 0.31 0.00 0.00 61.69 61.56 2hm9 s THR 126 Cb 0.20 -1.98 -0.04 0.00 0.01 0.00 0.00 72.50 70.70 2hm9 s THR 126 CO 0.40 0.54 -0.25 -0.54 -0.69 0.00 0.00 174.62 174.09 2hm9 s LYS 127 N 0.51 1.64 0.33 4.92 3.01 -1.26 -2.56 119.74 126.33 2hm9 s LYS 127 Ca -0.13 -1.22 -0.28 0.00 -1.01 0.00 0.00 55.97 53.34 2hm9 s LYS 127 Cb -0.17 -1.98 -0.10 0.00 -1.01 0.00 0.00 37.83 34.58 2hm9 s LYS 127 CO 0.05 0.48 1.20 1.41 0.51 0.00 0.00 175.35 179.00 2hm9 s MET 128 N -1.75 4.38 0.57 1.68 1.75 -1.13 -4.76 119.30 120.04 2hm9 s MET 128 Ca 0.14 1.98 -0.20 0.00 -1.25 0.00 0.00 55.69 56.36 2hm9 s MET 128 Cb -0.10 -3.01 -0.04 0.00 2.84 0.00 0.00 34.83 34.51 2hm9 s MET 128 CO 0.05 -0.08 1.25 0.96 -0.65 0.00 0.00 175.02 176.55 2hm9 s ILE 129 N -1.22 2.49 0.48 10.11 -5.25 -1.26 -4.95 121.20 121.60 2hm9 s ILE 129 Ca 0.49 0.33 -0.24 0.00 -0.99 0.00 0.00 60.65 60.24 2hm9 s ILE 129 Cb -0.35 -3.15 -0.07 0.00 2.95 0.00 0.00 42.46 41.84 2hm9 s ILE 129 CO 0.45 -0.04 1.42 -2.16 -1.79 0.00 0.00 174.94 172.82 2hm9 s PRO 130 N -3.13 3.52 0.06 0.37 0.04 -1.26 -5.03 135.00 129.58 2hm9 s PRO 130 Ca 0.74 2.39 0.06 0.00 0.04 0.00 0.00 61.00 64.23 2hm9 s PRO 130 Cb -0.34 -2.55 -0.03 0.00 0.04 0.00 0.00 34.50 31.63 2hm9 s PRO 130 CO 0.38 -0.94 -0.16 -0.51 0.04 0.00 0.00 177.00 175.81 2hm9 s LEU 131 N -2.95 2.22 -0.90 -3.56 1.43 -1.26 -5.09 118.68 108.58 2hm9 s LEU 131 Ca 0.64 -0.55 -0.18 0.00 -1.03 0.00 0.00 54.13 53.01 2hm9 s LEU 131 Cb -0.43 -0.67 0.14 0.00 0.03 0.00 0.00 46.19 45.26 2hm9 s LEU 131 CO 0.54 0.02 1.06 0.20 0.23 0.00 0.00 176.35 178.40 2hm9 s ASN 132 N -1.44 6.63 0.27 2.29 0.01 -1.26 -4.85 114.94 116.59 2hm9 s ASN 132 Ca 0.02 -2.11 -0.03 0.00 -0.71 0.00 0.00 52.86 50.03 2hm9 s ASN 132 Cb -0.09 -2.37 0.37 0.00 0.41 0.00 0.00 41.25 39.57 2hm9 s ASN 132 CO 0.02 -1.00 1.88 -0.50 -1.51 0.00 0.00 177.10 175.99 2hm9 h TRP 133 N 8.69 1.01 -0.42 2.20 4.06 -1.98 -2.68 115.95 126.82 2hm9 h TRP 133 Ca 0.13 -0.04 -0.05 0.00 2.06 0.00 0.00 58.89 60.98 2hm9 h TRP 133 Cb 1.03 -0.32 -0.02 0.00 -1.00 0.00 0.00 29.16 28.85 2hm9 h TRP 133 CO 1.13 0.73 0.04 0.38 -3.56 0.00 0.00 178.44 177.16 2hm9 h ASP 134 N 1.01 0.62 -0.15 -3.49 3.04 -2.05 -2.64 116.42 112.77 2hm9 h ASP 134 Ca 0.25 -0.12 -0.06 0.00 -3.24 0.00 0.00 57.03 53.85 2hm9 h ASP 134 Cb 0.10 -0.16 -0.02 0.00 -1.04 0.00 0.00 39.33 38.21 2hm9 h ASP 134 CO -0.03 0.67 -0.09 0.44 -2.04 0.00 0.00 179.24 178.19 2hm9 h ASP 135 N 0.63 0.46 -3.21 4.15 5.19 -1.89 -3.42 116.42 118.33 2hm9 h ASP 135 Ca 0.14 -0.11 -0.68 0.00 -0.62 0.00 0.00 57.03 55.76 2hm9 h ASP 135 Cb 0.34 -0.12 -0.13 0.00 0.18 0.00 0.00 39.33 39.60 2hm9 h ASP 135 CO 0.01 0.59 -0.60 -0.36 -3.12 0.00 0.00 179.24 175.76 2hm9 s PHE 136 N -4.80 3.23 -0.15 4.55 0.40 -0.99 -3.92 117.98 116.29 2hm9 s PHE 136 Ca -0.07 0.24 -0.02 0.00 -0.60 0.00 0.00 56.93 56.47 2hm9 s PHE 136 Cb 0.15 -1.80 -0.02 0.00 0.51 0.00 0.00 43.02 41.86 2hm9 s PHE 136 CO 0.77 0.51 -0.08 0.99 0.70 0.00 0.00 175.22 178.11 2hm9 s THR 137 N -0.95 3.39 0.18 0.64 2.01 -1.14 -4.83 115.64 114.95 2hm9 s THR 137 Ca 0.15 -0.53 -0.32 0.00 0.31 0.00 0.00 61.69 61.30 2hm9 s THR 137 Cb -0.11 -2.47 -0.11 0.00 0.01 0.00 0.00 72.50 69.82 2hm9 s THR 137 CO 0.04 0.50 1.65 -0.75 -0.69 0.00 0.00 174.62 175.36 2hm9 s LYS 138 N 0.55 4.17 -0.19 4.92 2.20 -1.26 -2.34 119.74 127.79 2hm9 s LYS 138 Ca -0.06 2.48 -0.13 0.00 -0.36 0.00 0.00 55.97 57.90 2hm9 s LYS 138 Cb -0.15 -3.15 -0.20 0.00 -1.51 0.00 0.00 37.83 32.81 2hm9 s LYS 138 CO 0.03 -0.68 0.15 1.33 -0.36 0.00 0.00 175.35 175.81 2hm9 n VAL 139 N 4.03 1.62 -3.58 4.02 0.24 -0.33 -4.92 118.33 119.41 2hm9 n VAL 139 Ca 0.15 -0.34 -0.11 0.00 -2.04 0.00 0.00 64.34 62.00 2hm9 n VAL 139 Cb 0.37 -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 -0.41 0.11 -1.34 0.01 -1.20 -5.06 113.70 98.84 2hm9 s SER 140 Ca -0.29 -0.24 -0.21 0.00 1.31 0.00 0.00 55.95 56.52 2hm9 s SER 140 Cb 0.08 0.59 0.06 0.00 0.21 0.00 0.00 66.02 66.95 2hm9 s SER 140 CO 0.64 -1.02 0.53 -0.94 0.41 0.00 0.00 173.24 172.86 2hm9 s SER 141 N -2.81 -0.45 0.00 2.44 1.04 -1.26 -0.70 113.70 111.96 2hm9 s SER 141 Ca 0.04 -0.01 0.03 0.00 0.48 0.00 0.00 55.95 56.49 2hm9 s SER 141 Cb -0.01 0.53 -0.01 0.00 0.10 0.00 0.00 66.02 66.63 2hm9 s SER 141 CO -0.08 -0.86 -0.08 -0.60 0.98 0.00 0.00 173.24 172.60 2hm9 s ARG 142 N -3.32 0.63 -0.14 4.02 3.52 0.33 -4.98 118.95 119.02 2hm9 s ARG 142 Ca -0.01 -0.35 0.01 0.00 -0.13 0.00 0.00 55.73 55.25 2hm9 s ARG 142 Cb -0.00 -0.59 -0.00 0.00 -1.56 0.00 0.00 34.95 32.79 2hm9 s ARG 142 CO -0.09 0.16 -0.17 0.99 -0.81 0.00 0.00 175.30 175.38 2hm9 s THR 143 N -0.34 2.59 -0.09 4.11 2.01 -1.26 0.10 115.64 122.76 2hm9 s THR 143 Ca 0.02 -0.81 0.04 0.00 0.31 0.00 0.00 61.69 61.24 2hm9 s THR 143 Cb -0.04 -2.07 0.00 0.00 0.01 0.00 0.00 72.50 70.40 2hm9 s THR 143 CO -0.00 0.53 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.55 2hm9 s VAL 144 N 0.60 1.84 -0.21 3.82 1.01 -0.78 -5.02 120.40 121.66 2hm9 s VAL 144 Ca -0.10 -0.90 -0.05 0.00 0.00 0.00 0.00 61.98 60.94 2hm9 s VAL 144 Cb -0.16 -1.60 -0.02 0.00 0.00 0.00 0.00 36.38 34.60 2hm9 s VAL 144 CO 0.03 0.51 -0.01 -1.61 0.00 0.00 0.00 175.10 174.02 2hm9 s GLU 145 N 0.38 3.52 0.79 2.72 2.02 -1.26 -2.25 118.70 124.62 2hm9 s GLU 145 Ca -0.17 -0.56 -0.05 0.00 0.02 0.00 0.00 54.97 54.21 2hm9 s GLU 145 Cb -0.17 -3.08 0.15 0.00 0.10 0.00 0.00 34.13 31.13 2hm9 s GLU 145 CO 0.07 -0.10 1.08 0.34 0.02 0.00 0.00 175.26 176.68 2hm9 s ASP 146 N 1.27 4.02 0.13 -0.19 -1.08 -1.26 -4.97 116.67 114.60 2hm9 s ASP 146 Ca 0.04 -0.19 -0.17 0.00 -0.52 0.00 0.00 52.55 51.71 2hm9 s ASP 146 Cb -0.15 -0.10 -0.01 0.00 -1.46 0.00 0.00 42.92 41.21 2hm9 s ASP 146 CO 0.00 -2.10 1.72 0.71 0.52 0.00 0.00 175.17 176.02 2hm9 h THR 147 N -0.83 1.16 -2.77 1.71 1.35 -1.99 -3.43 112.91 108.12 2hm9 h THR 147 Ca -0.38 -0.45 -0.65 0.00 -0.55 0.00 0.00 66.41 64.38 2hm9 h THR 147 Cb 1.26 0.78 -0.06 0.00 -1.73 0.00 0.00 68.15 68.40 2hm9 h THR 147 CO 0.40 0.17 -0.41 0.21 -0.25 0.00 0.00 175.52 175.64 2hm9 s ASN 148 N -5.72 6.50 0.31 5.36 2.47 -1.26 -5.00 114.94 117.60 2hm9 s ASN 148 Ca -0.13 0.59 0.02 0.00 0.42 0.00 0.00 52.86 53.76 2hm9 s ASN 148 Cb 0.10 -2.11 0.60 0.00 -1.45 0.00 0.00 41.25 38.39 2hm9 s ASN 148 CO 0.74 0.36 1.90 1.55 -3.72 0.00 0.00 177.10 177.93 2hm9 h PRO 149 N 4.73 0.92 -0.71 0.43 0.13 -1.94 -0.39 132.00 135.17 2hm9 h PRO 149 Ca -0.53 -0.06 -0.06 0.00 -0.87 0.00 0.00 66.00 64.48 2hm9 h PRO 149 Cb 1.22 -0.21 -0.03 0.00 0.13 0.00 0.00 31.00 32.11 2hm9 h PRO 149 CO 0.60 0.61 0.19 0.00 -0.23 0.00 0.00 178.00 179.17 2hm9 h ALA 150 N 1.54 1.00 -0.24 -0.56 0.00 -1.94 -2.67 119.26 116.40 2hm9 h ALA 150 Ca 0.40 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 2hm9 h ALA 150 Cb 0.31 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2hm9 h ALA 150 CO -0.16 0.65 -0.29 -0.07 0.00 0.00 0.00 179.25 179.38 2hm9 h LEU 151 N 1.06 0.48 -9.82 0.00 3.38 -1.63 -3.26 115.31 105.52 2hm9 h LEU 151 Ca 0.22 -0.17 -0.53 0.00 0.09 0.00 0.00 57.88 57.49 2hm9 h LEU 151 Cb 0.34 -0.13 0.09 0.00 0.09 0.00 0.00 40.66 41.05 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 1.18 -3.98 0.22 -1.04 -0.27 -4.65 114.28 101.64 2hm9 n THR 152 Ca -0.01 -0.29 -0.09 0.00 -2.04 0.00 0.00 64.05 61.62 2hm9 n THR 152 Cb 0.43 -1.98 -0.08 0.00 -1.82 0.00 0.00 70.33 66.88 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 -0.18 0.41 0.10 -1.42 -3.43 -0.95 -2.66 115.29 107.16 2hm9 s HIS 153 Ca 0.62 -0.83 0.05 0.00 -0.80 0.00 0.00 55.06 54.10 2hm9 s HIS 153 Cb -0.49 -0.19 -0.03 0.00 -1.43 0.00 0.00 32.58 30.44 2hm9 s HIS 153 CO 0.51 -0.56 -0.14 0.99 -2.00 0.00 0.00 174.74 173.54 2hm9 s THR 154 N -3.93 1.21 -0.17 -5.38 2.01 -0.56 -1.87 115.64 106.94 2hm9 s THR 154 Ca 0.12 -1.57 -0.02 0.00 0.31 0.00 0.00 61.69 60.53 2hm9 s THR 154 Cb 0.05 -1.36 -0.01 0.00 0.01 0.00 0.00 72.50 71.19 2hm9 s THR 154 CO -0.06 -0.37 -0.08 -0.31 -0.69 0.00 0.00 174.62 173.11 2hm9 s TYR 155 N -1.90 2.90 -0.03 4.92 2.02 0.29 -1.88 117.35 123.66 2hm9 s TYR 155 Ca 0.05 -0.73 0.04 0.00 -0.37 0.00 0.00 57.07 56.07 2hm9 s TYR 155 Cb -0.06 -1.97 -0.01 0.00 -0.40 0.00 0.00 41.96 39.53 2hm9 s TYR 155 CO 0.02 -0.33 -0.16 -1.21 -1.57 0.00 0.00 175.55 172.30 2hm9 s GLU 156 N 0.81 1.62 -0.12 -0.62 8.01 -0.72 0.12 118.70 127.81 2hm9 s GLU 156 Ca -0.03 -0.58 0.03 0.00 0.01 0.00 0.00 54.97 54.40 2hm9 s GLU 156 Cb -0.15 -1.45 0.01 0.00 -4.31 0.00 0.00 34.13 28.23 2hm9 s GLU 156 CO 0.01 0.26 -0.23 0.08 0.01 0.00 0.00 175.26 175.40 2hm9 s VAL 157 N -0.05 2.03 -0.06 2.63 1.01 0.12 -1.50 120.40 124.58 2hm9 s VAL 157 Ca -0.01 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 61.01 2hm9 s VAL 157 Cb -0.10 -1.78 -0.03 0.00 0.00 0.00 0.00 36.38 34.48 2hm9 s VAL 157 CO 0.01 0.55 -0.12 0.26 0.00 0.00 0.00 175.10 175.80 2hm9 s TRP 158 N 0.58 2.77 -0.12 5.22 0.52 0.60 -1.19 118.94 127.32 2hm9 s TRP 158 Ca -0.13 -0.16 0.01 0.00 0.02 0.00 0.00 56.10 55.84 2hm9 s TRP 158 Cb -0.17 -1.67 -0.01 0.00 -1.15 0.00 0.00 33.47 30.46 2hm9 s TRP 158 CO 0.04 0.18 -0.15 -0.65 0.02 0.00 0.00 176.95 176.39 2hm9 s GLN 159 N -0.63 3.30 0.26 4.98 -0.21 -0.99 0.79 119.66 127.16 2hm9 s GLN 159 Ca 0.09 -0.71 -0.30 0.00 0.02 0.00 0.00 55.36 54.46 2hm9 s GLN 159 Cb -0.11 -2.57 -0.10 0.00 1.00 0.00 0.00 33.01 31.22 2hm9 s GLN 159 CO 0.01 0.23 1.42 0.21 -2.12 0.00 0.00 175.29 175.04 2hm9 s LYS 160 N 0.30 4.28 -0.02 2.91 2.36 -0.39 -2.86 119.74 126.31 2hm9 s LYS 160 Ca -0.11 2.29 0.07 0.00 -2.55 0.00 0.00 55.97 55.67 2hm9 s LYS 160 Cb -0.16 -3.10 -0.02 0.00 -1.05 0.00 0.00 37.83 33.50 2hm9 s LYS 160 CO 0.06 -0.38 -0.25 -1.59 1.55 0.00 0.00 175.35 174.74 2hm9 s LYS 161 N -0.60 2.02 0.00 4.03 -2.85 -1.25 -4.97 119.74 116.12 2hm9 s LYS 161 Ca 0.58 -0.88 0.00 0.00 -1.00 0.00 0.00 55.97 54.67 2hm9 s LYS 161 Cb -0.41 -1.94 0.00 0.00 -2.06 0.00 0.00 37.83 33.42 2hm9 s LYS 161 CO 0.45 0.52 0.00 0.00 0.10 0.00 0.00 175.35 176.42