#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 0.39 -0.25 2.41 0.00 0.16 -3.07 121.76 121.41 2hm9 s ALA 2 Ca 0.00 -0.68 -0.05 0.00 0.00 0.00 0.00 51.96 51.23 2hm9 s ALA 2 Cb 0.00 0.08 -0.00 0.00 0.00 0.00 0.00 23.12 23.20 2hm9 s ALA 2 CO 0.00 -0.07 0.01 -0.06 0.00 0.00 0.00 175.76 175.64 2hm9 s PHE 3 N -1.38 3.05 -0.22 0.00 0.40 0.13 0.11 117.98 120.08 2hm9 s PHE 3 Ca -0.12 -0.94 0.02 0.00 -0.60 0.00 0.00 56.93 55.29 2hm9 s PHE 3 Cb -0.10 -2.16 0.04 0.00 0.51 0.00 0.00 43.02 41.31 2hm9 s PHE 3 CO -0.00 -0.55 -0.15 -1.17 0.70 0.00 0.00 175.22 174.06 2hm9 s LEU 4 N 1.49 2.78 0.20 -0.37 2.96 -1.10 0.96 118.68 125.60 2hm9 s LEU 4 Ca 0.04 -1.03 -0.20 0.00 -0.22 0.00 0.00 54.13 52.72 2hm9 s LEU 4 Cb -0.15 -1.49 0.04 0.00 0.50 0.00 0.00 46.19 45.09 2hm9 s LEU 4 CO -0.01 -0.11 0.57 -1.66 -1.32 0.00 0.00 176.35 173.83 2hm9 s TRP 5 N 1.21 -0.25 -0.04 5.38 -2.14 -1.13 -4.52 118.94 117.44 2hm9 s TRP 5 Ca -0.02 -0.07 0.04 0.00 2.66 0.00 0.00 56.10 58.71 2hm9 s TRP 5 Cb -0.17 0.49 -0.01 0.00 -3.10 0.00 0.00 33.47 30.69 2hm9 s TRP 5 CO -0.09 -0.94 -0.17 0.00 -2.66 0.00 0.00 176.95 173.09 2hm9 s ALA 6 N -3.84 1.47 0.04 2.67 0.00 -1.26 -2.25 121.76 118.60 2hm9 s ALA 6 Ca 0.07 -0.68 -0.03 0.00 0.00 0.00 0.00 51.96 51.31 2hm9 s ALA 6 Cb -0.02 -0.47 -0.02 0.00 0.00 0.00 0.00 23.12 22.61 2hm9 s ALA 6 CO -0.04 0.29 0.04 1.14 0.00 0.00 0.00 175.76 177.19 2hm9 s GLN 7 N -0.05 0.58 0.83 0.00 -2.07 0.61 -4.59 119.66 114.97 2hm9 s GLN 7 Ca -0.02 -0.91 -0.08 0.00 -1.82 0.00 0.00 55.36 52.53 2hm9 s GLN 7 Cb -0.10 0.22 0.16 0.00 -1.09 0.00 0.00 33.01 32.19 2hm9 s GLN 7 CO 0.01 -0.13 1.15 0.16 -1.32 0.00 0.00 175.29 175.16 2hm9 s ASP 8 N -2.37 3.79 0.22 12.60 -4.77 -0.92 -2.90 116.67 122.32 2hm9 s ASP 8 Ca -0.01 -0.06 -0.08 0.00 -3.30 0.00 0.00 52.55 49.09 2hm9 s ASP 8 Cb 0.01 -0.17 0.17 0.00 -1.09 0.00 0.00 42.92 41.84 2hm9 s ASP 8 CO -0.07 -2.26 1.83 0.08 0.70 0.00 0.00 175.17 175.46 2hm9 h ARG 9 N -1.04 1.14 -0.89 2.11 0.11 -1.76 -2.56 114.38 111.49 2hm9 h ARG 9 Ca -0.40 -0.14 0.02 0.00 0.10 0.00 0.00 59.98 59.56 2hm9 h ARG 9 Cb 1.25 -0.22 -0.05 0.00 1.11 0.00 0.00 29.97 32.06 2hm9 h ARG 9 CO 0.40 0.85 0.58 -0.44 0.10 0.00 0.00 179.97 181.45 2hm9 h ASP 10 N 1.13 0.99 0.00 0.08 5.19 -1.92 -3.46 116.42 118.42 2hm9 h ASP 10 Ca 0.29 -0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.68 2hm9 h ASP 10 Cb 0.04 -0.24 0.00 0.00 0.18 0.00 0.00 39.33 39.32 2hm9 h ASP 10 CO -0.04 0.70 0.00 0.61 -3.12 0.00 0.00 179.24 177.38 2hm9 n GLY 11 N -1.34 2.00 3.67 2.75 0.00 -0.97 -5.12 105.19 106.18 2hm9 n GLY 11 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 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 3.48 -0.09 0.99 2.96 -1.26 -2.86 118.68 121.90 2hm9 s LEU 12 Ca 0.00 0.04 -0.01 0.00 -0.22 0.00 0.00 54.13 53.95 2hm9 s LEU 12 Cb 0.00 -1.89 -0.25 0.00 0.50 0.00 0.00 46.19 44.54 2hm9 s LEU 12 CO 0.00 0.33 0.48 2.30 -1.32 0.00 0.00 176.35 178.13 2hm9 n ILE 13 N 1.79 1.74 0.00 6.68 -5.35 -0.94 -2.15 119.36 121.12 2hm9 n ILE 13 Ca -0.17 -0.70 0.00 0.00 -0.27 0.00 0.00 62.75 61.61 2hm9 n ILE 13 Cb 0.53 -1.52 0.00 0.00 -1.74 0.00 0.00 39.64 36.91 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 1.85 -0.33 2.98 3.28 0.00 -0.87 -4.58 105.19 107.53 2hm9 n GLY 14 Ca -0.27 -0.54 -0.21 0.00 0.00 0.00 0.00 46.02 45.00 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 -1.77 1.07 -0.99 1.61 2.20 -0.75 0.71 119.74 121.83 2hm9 s LYS 15 Ca 0.00 -0.28 0.00 0.00 -0.36 0.00 0.00 55.97 55.33 2hm9 s LYS 15 Cb 0.00 -0.98 0.00 0.00 -1.51 0.00 0.00 37.83 35.34 2hm9 s LYS 15 CO 0.00 0.06 0.00 -0.25 -0.36 0.00 0.00 175.35 174.80 2hm9 n ASP 16 N 3.55 -3.51 0.00 1.43 8.00 -1.26 -0.82 116.55 123.94 2hm9 n ASP 16 Ca -0.21 0.23 0.00 0.00 0.71 0.00 0.00 54.79 55.53 2hm9 n ASP 16 Cb 0.53 -3.05 0.00 0.00 -0.02 0.00 0.00 41.12 38.58 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 -0.68 2.32 3.76 0.44 0.00 -1.26 -4.85 105.19 104.92 2hm9 n GLY 17 Ca -0.13 -0.34 -0.41 0.00 0.00 0.00 0.00 46.02 45.14 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 -0.85 3.42 -0.41 1.61 -3.43 0.00 -4.83 115.29 110.81 2hm9 s HIS 18 Ca 0.00 1.57 -0.28 0.00 -0.80 0.00 0.00 55.06 55.55 2hm9 s HIS 18 Cb 0.00 -3.41 -0.01 0.00 -1.43 0.00 0.00 32.58 27.74 2hm9 s HIS 18 CO 0.00 -1.00 1.62 -0.51 -2.00 0.00 0.00 174.74 172.86 2hm9 s LEU 19 N -1.28 3.50 0.54 5.38 1.43 -1.26 -1.81 118.68 125.18 2hm9 s LEU 19 Ca 0.47 0.93 0.31 0.00 -1.03 0.00 0.00 54.13 54.81 2hm9 s LEU 19 Cb -0.34 -3.38 1.53 0.00 0.03 0.00 0.00 46.19 44.03 2hm9 s LEU 19 CO 0.43 -1.68 2.08 1.55 0.23 0.00 0.00 176.35 178.96 2hm9 h PRO 20 N 12.11 0.00 -6.32 1.29 0.13 -1.89 -3.43 132.00 133.89 2hm9 h PRO 20 Ca -0.30 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.28 2hm9 h PRO 20 Cb 1.14 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.23 2hm9 h PRO 20 CO 1.09 0.09 0.10 1.67 -0.23 0.00 0.00 178.00 180.71 2hm9 s TRP 21 N -4.06 3.80 -0.93 1.56 -2.14 -1.26 -5.01 118.94 110.90 2hm9 s TRP 21 Ca -0.02 1.44 -0.15 0.00 2.66 0.00 0.00 56.10 60.02 2hm9 s TRP 21 Cb 0.12 -2.70 0.19 0.00 -3.10 0.00 0.00 33.47 27.98 2hm9 s TRP 21 CO 0.56 0.43 0.99 -1.58 -2.66 0.00 0.00 176.95 174.68 2hm9 s HIS 22 N -0.64 3.58 -0.69 1.66 2.46 -1.26 -4.93 115.29 115.46 2hm9 s HIS 22 Ca 0.34 -1.88 0.05 0.00 0.47 0.00 0.00 55.06 54.05 2hm9 s HIS 22 Cb -0.21 -4.02 0.20 0.00 -0.13 0.00 0.00 32.58 28.42 2hm9 s HIS 22 CO 0.22 -1.19 0.60 -0.11 -2.47 0.00 0.00 174.74 171.79 2hm9 n LEU 23 N 4.85 3.35 -0.46 8.88 7.94 -1.26 -4.93 117.00 135.37 2hm9 n LEU 23 Ca 0.20 -5.30 0.38 0.00 -1.11 0.00 0.00 56.01 50.18 2hm9 n LEU 23 Cb 0.46 -0.73 0.67 0.00 0.53 0.00 0.00 43.42 44.35 2hm9 n LEU 23 CO 0.43 1.87 1.28 -0.65 -1.11 0.00 0.00 177.39 179.21 2hm9 h PRO 24 N 4.93 0.09 0.86 1.96 0.11 -1.98 0.12 132.00 138.11 2hm9 h PRO 24 Ca 0.17 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.23 2hm9 h PRO 24 Cb 0.72 -0.02 0.01 0.00 0.11 0.00 0.00 31.00 31.81 2hm9 h PRO 24 CO 0.77 0.06 -0.42 0.22 -0.21 0.00 0.00 178.00 178.43 2hm9 h ASP 25 N 0.10 -0.98 -0.31 -2.05 1.82 -1.97 0.18 116.42 113.20 2hm9 h ASP 25 Ca 0.79 0.03 -0.06 0.00 -0.39 0.00 0.00 57.03 57.40 2hm9 h ASP 25 Cb 2.61 0.25 -0.02 0.00 0.68 0.00 0.00 39.33 42.85 2hm9 h ASP 25 CO -0.30 -0.68 -0.01 -0.78 -1.61 0.00 0.00 179.24 175.86 2hm9 h ASP 26 N -1.20 0.64 -0.65 2.28 1.82 -1.45 -1.89 116.42 115.96 2hm9 h ASP 26 Ca -0.12 -0.14 -0.03 0.00 -0.39 0.00 0.00 57.03 56.34 2hm9 h ASP 26 Cb 0.89 -0.17 -0.03 0.00 0.68 0.00 0.00 39.33 40.70 2hm9 h ASP 26 CO 0.19 0.72 0.27 -0.07 -1.61 0.00 0.00 179.24 178.74 2hm9 h LEU 27 N 0.63 0.88 -0.96 2.28 3.38 -0.80 -1.78 115.31 118.95 2hm9 h LEU 27 Ca 0.13 -0.16 0.03 0.00 0.09 0.00 0.00 57.88 57.96 2hm9 h LEU 27 Cb 0.41 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.88 2hm9 h LEU 27 CO 0.02 0.80 0.63 0.45 0.09 0.00 0.00 178.44 180.43 2hm9 h HIS 28 N 0.91 1.19 -0.36 1.13 3.86 -0.21 -1.50 115.15 120.16 2hm9 h HIS 28 Ca 0.22 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.46 2hm9 h HIS 28 Cb 0.19 -0.40 -0.02 0.00 1.06 0.00 0.00 27.41 28.24 2hm9 h HIS 28 CO 0.01 0.71 0.24 -0.92 0.86 0.00 0.00 177.93 178.82 2hm9 h TYR 29 N 1.24 0.45 -0.30 2.45 3.20 -0.55 0.23 116.97 123.68 2hm9 h TYR 29 Ca 0.37 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.25 2hm9 h TYR 29 Cb -0.05 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.06 2hm9 h TYR 29 CO -0.01 0.28 0.18 0.35 -1.64 0.00 0.00 178.16 177.32 2hm9 h PHE 30 N 0.48 0.40 -0.61 -3.82 3.57 -0.62 -0.54 116.94 115.81 2hm9 h PHE 30 Ca 0.13 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.61 2hm9 h PHE 30 Cb -0.05 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.53 2hm9 h PHE 30 CO -0.05 0.31 0.29 -0.09 -2.23 0.00 0.00 178.31 176.54 2hm9 h ARG 31 N 0.38 0.87 -0.65 1.11 2.43 -1.02 -2.45 114.38 115.05 2hm9 h ARG 31 Ca 0.11 -0.13 -0.06 0.00 -0.81 0.00 0.00 59.98 59.10 2hm9 h ARG 31 Cb 0.02 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.39 2hm9 h ARG 31 CO -0.02 0.70 0.18 0.00 -1.51 0.00 0.00 179.97 179.32 2hm9 h ALA 32 N 1.13 1.10 -0.14 2.80 0.00 -0.28 -2.50 119.26 121.37 2hm9 h ALA 32 Ca 0.21 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 2hm9 h ALA 32 Cb 0.11 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 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 0.96 0.23 -0.09 0.00 1.08 -0.84 -2.50 115.11 113.96 2hm9 h GLN 33 Ca 0.21 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.35 2hm9 h GLN 33 Cb 0.30 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.71 2hm9 h GLN 33 CO -0.00 0.42 0.00 0.25 -0.95 0.00 0.00 178.83 178.55 2hm9 n THR 34 N -4.22 0.12 -3.17 -0.54 -2.24 -0.95 -4.65 114.28 98.63 2hm9 n THR 34 Ca -0.01 -0.13 -0.40 0.00 -2.27 0.00 0.00 64.05 61.24 2hm9 n THR 34 Cb 0.31 0.01 -0.07 0.00 -2.10 0.00 0.00 70.33 68.49 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 -1.88 5.03 -0.28 2.28 -7.23 -0.94 -3.69 120.40 113.69 2hm9 s VAL 35 Ca 0.16 1.02 0.00 0.00 -1.81 0.00 0.00 61.98 61.35 2hm9 s VAL 35 Cb 0.08 -3.88 0.00 0.00 0.56 0.00 0.00 36.38 33.14 2hm9 s VAL 35 CO 0.12 0.06 0.00 0.61 -0.31 0.00 0.00 175.10 175.59 2hm9 n GLY 36 N 4.23 0.59 3.04 2.32 0.00 -1.22 -5.02 105.19 109.12 2hm9 n GLY 36 Ca -0.02 -0.80 -0.11 0.00 0.00 0.00 0.00 46.02 45.09 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 -1.97 0.47 0.01 1.61 1.02 -1.24 -4.70 119.74 114.94 2hm9 s LYS 37 Ca 0.00 -0.79 -0.30 0.00 0.02 0.00 0.00 55.97 54.91 2hm9 s LYS 37 Cb 0.00 -0.06 -0.03 0.00 -0.52 0.00 0.00 37.83 37.21 2hm9 s LYS 37 CO 0.00 -0.01 0.96 0.42 -0.92 0.00 0.00 175.35 175.79 2hm9 s ILE 38 N -1.84 4.82 0.04 2.17 1.01 0.25 -4.04 121.20 123.62 2hm9 s ILE 38 Ca -0.09 2.02 0.02 0.00 0.00 0.00 0.00 60.65 62.60 2hm9 s ILE 38 Cb -0.07 -4.30 -0.02 0.00 0.01 0.00 0.00 42.46 38.08 2hm9 s ILE 38 CO -0.02 0.19 -0.08 -0.32 0.00 0.00 0.00 174.94 174.72 2hm9 s MET 39 N 0.83 0.54 -0.10 2.79 -2.45 -1.12 0.83 119.30 120.62 2hm9 s MET 39 Ca 0.50 -0.67 0.04 0.00 -1.25 0.00 0.00 55.69 54.31 2hm9 s MET 39 Cb -0.21 -0.37 0.00 0.00 1.25 0.00 0.00 34.83 35.50 2hm9 s MET 39 CO 0.28 0.08 -0.23 0.08 1.05 0.00 0.00 175.02 176.27 2hm9 s VAL 40 N -1.13 1.96 -0.05 10.11 1.01 0.71 -0.76 120.40 132.25 2hm9 s VAL 40 Ca -0.07 -0.96 0.05 0.00 0.00 0.00 0.00 61.98 60.99 2hm9 s VAL 40 Cb -0.09 -1.70 -0.00 0.00 0.00 0.00 0.00 36.38 34.59 2hm9 s VAL 40 CO 0.00 0.54 -0.19 0.68 0.00 0.00 0.00 175.10 176.13 2hm9 s VAL 41 N 0.37 1.58 1.04 2.92 -7.23 0.99 0.12 120.40 120.19 2hm9 s VAL 41 Ca -0.18 -0.80 -0.14 0.00 -1.81 0.00 0.00 61.98 59.05 2hm9 s VAL 41 Cb -0.18 -1.36 0.21 0.00 0.56 0.00 0.00 36.38 35.62 2hm9 s VAL 41 CO 0.08 0.45 1.12 -0.83 -0.31 0.00 0.00 175.10 175.61 2hm9 s GLY 42 N 0.03 1.58 0.19 2.32 0.00 0.30 0.07 107.32 111.81 2hm9 s GLY 42 Ca -0.05 -0.61 -0.12 0.00 0.00 0.00 0.00 44.72 43.95 2hm9 s GLY 42 CO 0.03 0.08 1.83 -0.09 0.00 0.00 0.00 173.10 174.95 2hm9 h ARG 43 N -2.02 0.87 -0.61 2.90 1.12 -1.87 -0.71 114.38 114.07 2hm9 h ARG 43 Ca -0.51 -0.08 0.00 0.00 -1.11 0.00 0.00 59.98 58.29 2hm9 h ARG 43 Cb 1.32 -0.19 -0.03 0.00 -0.01 0.00 0.00 29.97 31.06 2hm9 h ARG 43 CO 0.51 0.62 0.39 0.00 -3.11 0.00 0.00 179.97 178.38 2hm9 h ARG 44 N 0.88 0.81 -0.44 0.20 3.08 -1.92 -1.65 114.38 115.34 2hm9 h ARG 44 Ca 0.23 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.20 2hm9 h ARG 44 Cb -0.04 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.82 2hm9 h ARG 44 CO -0.04 0.55 0.15 1.15 -1.07 0.00 0.00 179.97 180.70 2hm9 h THR 45 N 0.83 1.21 -0.75 2.04 2.02 -1.58 -1.66 112.91 115.02 2hm9 h THR 45 Ca 0.22 -0.69 0.17 0.00 0.77 0.00 0.00 66.41 66.88 2hm9 h THR 45 Cb -0.07 0.85 -0.12 0.00 -1.74 0.00 0.00 68.15 67.07 2hm9 h THR 45 CO -0.05 0.25 0.14 0.22 0.37 0.00 0.00 175.52 176.46 2hm9 h TYR 46 N 0.56 0.20 0.00 3.16 3.20 -0.17 0.91 116.97 124.83 2hm9 h TYR 46 Ca 0.14 0.05 -0.17 0.00 3.14 0.00 0.00 58.73 61.89 2hm9 h TYR 46 Cb 0.24 0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.51 2hm9 h TYR 46 CO 0.01 -0.14 -0.82 0.93 -1.64 0.00 0.00 178.16 176.50 2hm9 h GLU 47 N 0.22 0.00 0.00 1.82 4.39 -1.40 -3.25 114.58 116.36 2hm9 h GLU 47 Ca 0.43 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.98 2hm9 h GLU 47 Cb 0.76 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.39 2hm9 h GLU 47 CO -0.56 0.82 -0.73 1.03 -1.16 0.00 0.00 179.01 178.41 2hm9 h SER 48 N 0.00 0.00 -3.60 1.42 0.87 0.07 -3.46 113.55 108.86 2hm9 h SER 48 Ca -0.01 0.00 -0.57 0.00 -1.23 0.00 0.00 61.79 59.99 2hm9 h SER 48 Cb 1.46 0.00 0.14 0.00 -0.44 0.00 0.00 62.40 63.56 2hm9 h SER 48 CO 0.11 0.73 0.35 0.33 -0.53 0.00 0.00 176.83 177.81 2hm9 n PHE 49 N -3.31 1.61 0.52 2.24 7.35 0.29 -4.84 117.46 121.32 2hm9 n PHE 49 Ca 0.01 0.47 -0.20 0.00 -0.76 0.00 0.00 57.45 56.97 2hm9 n PHE 49 Cb 0.81 -2.27 -0.10 0.00 0.35 0.00 0.00 39.48 38.27 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 1.32 -1.28 -1.97 -7.13 0.11 -1.90 -3.46 132.00 117.68 2hm9 h PRO 50 Ca -0.48 0.09 0.02 0.00 0.11 0.00 0.00 66.00 65.73 2hm9 h PRO 50 Cb 1.33 0.29 -0.21 0.00 0.11 0.00 0.00 31.00 32.51 2hm9 h PRO 50 CO 0.56 -0.86 0.06 0.21 -0.21 0.00 0.00 178.00 177.76 2hm9 s LYS 51 N -5.90 0.71 0.17 1.05 2.20 -1.26 -5.17 119.74 111.54 2hm9 s LYS 51 Ca -0.19 1.16 0.07 0.00 -0.36 0.00 0.00 55.97 56.65 2hm9 s LYS 51 Cb 0.02 0.18 -0.04 0.00 -1.51 0.00 0.00 37.83 36.48 2hm9 s LYS 51 CO 0.58 -0.14 -0.15 1.03 -0.36 0.00 0.00 175.35 176.32 2hm9 s ARG 52 N 1.42 1.22 0.53 4.03 3.00 -1.26 -4.48 118.95 123.40 2hm9 s ARG 52 Ca -0.08 -1.44 -0.05 0.00 0.00 0.00 0.00 55.73 54.16 2hm9 s ARG 52 Cb -0.05 -1.08 -0.01 0.00 0.00 0.00 0.00 34.95 33.81 2hm9 s ARG 52 CO -0.16 0.20 0.83 -1.25 0.00 0.00 0.00 175.30 174.91 2hm9 s PRO 53 N -3.19 3.15 0.46 3.54 0.04 -1.26 -4.90 135.00 132.84 2hm9 s PRO 53 Ca 0.17 -0.02 -0.21 0.00 0.04 0.00 0.00 61.00 60.98 2hm9 s PRO 53 Cb -0.03 -2.35 -0.09 0.00 0.04 0.00 0.00 34.50 32.07 2hm9 s PRO 53 CO 0.05 -0.47 1.01 -0.51 0.04 0.00 0.00 177.00 177.12 2hm9 s LEU 54 N -4.84 3.91 0.02 -3.56 1.43 -1.26 -5.02 118.68 109.36 2hm9 s LEU 54 Ca 0.51 1.86 -0.28 0.00 -1.03 0.00 0.00 54.13 55.19 2hm9 s LEU 54 Cb -0.10 -4.51 -0.04 0.00 0.03 0.00 0.00 46.19 41.57 2hm9 s LEU 54 CO 0.44 -0.61 0.91 -2.16 0.23 0.00 0.00 176.35 175.16 2hm9 s PRO 55 N -3.12 4.56 -1.84 1.29 0.04 -1.26 -3.63 135.00 131.04 2hm9 s PRO 55 Ca 0.64 1.30 0.00 0.00 0.04 0.00 0.00 61.00 62.98 2hm9 s PRO 55 Cb -0.15 -3.43 0.00 0.00 0.04 0.00 0.00 34.50 30.96 2hm9 s PRO 55 CO 0.18 0.06 0.00 0.39 0.04 0.00 0.00 177.00 177.67 2hm9 n GLU 56 N 3.53 -1.53 -4.14 4.56 1.02 -1.26 -4.94 120.64 117.88 2hm9 n GLU 56 Ca 0.03 1.05 -0.16 0.00 -0.02 0.00 0.00 57.16 58.06 2hm9 n GLU 56 Cb 0.51 -5.57 -0.15 0.00 -0.02 0.00 0.00 31.44 26.21 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 -4.57 0.45 -0.51 3.49 0.52 -1.24 -3.42 118.95 113.67 2hm9 s ARG 57 Ca 0.00 -0.15 -0.19 0.00 -0.52 0.00 0.00 55.73 54.86 2hm9 s ARG 57 Cb 0.00 -0.45 0.06 0.00 0.52 0.00 0.00 34.95 35.08 2hm9 s ARG 57 CO 0.00 0.07 0.65 0.99 0.02 0.00 0.00 175.30 177.03 2hm9 s THR 58 N 0.07 4.84 -0.08 0.02 2.01 -1.26 -4.63 115.64 116.62 2hm9 s THR 58 Ca -0.00 -0.46 -0.04 0.00 0.31 0.00 0.00 61.69 61.50 2hm9 s THR 58 Cb -0.04 -4.32 -0.04 0.00 0.01 0.00 0.00 72.50 68.11 2hm9 s THR 58 CO -0.00 -0.84 0.09 0.20 -0.69 0.00 0.00 174.62 173.38 2hm9 s ASN 59 N 2.74 5.93 -0.07 3.53 0.02 -1.26 -2.81 114.94 123.03 2hm9 s ASN 59 Ca 0.16 0.31 0.03 0.00 -1.02 0.00 0.00 52.86 52.34 2hm9 s ASN 59 Cb -0.19 -1.82 0.01 0.00 0.02 0.00 0.00 41.25 39.27 2hm9 s ASN 59 CO 0.12 0.37 -0.14 -0.69 0.02 0.00 0.00 177.10 176.78 2hm9 s VAL 60 N -1.04 1.28 -0.25 1.60 1.01 0.06 -1.33 120.40 121.72 2hm9 s VAL 60 Ca 0.17 -0.57 -0.12 0.00 0.00 0.00 0.00 61.98 61.45 2hm9 s VAL 60 Cb -0.12 -1.15 -0.05 0.00 0.00 0.00 0.00 36.38 35.07 2hm9 s VAL 60 CO 0.06 0.38 0.25 -0.69 0.00 0.00 0.00 175.10 175.10 2hm9 s VAL 61 N 0.54 5.28 -0.22 2.92 1.01 0.56 -0.01 120.40 130.48 2hm9 s VAL 61 Ca -0.14 0.33 -0.07 0.00 0.00 0.00 0.00 61.98 62.10 2hm9 s VAL 61 Cb -0.15 -3.58 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 2hm9 s VAL 61 CO 0.04 0.26 0.05 -0.22 0.00 0.00 0.00 175.10 175.24 2hm9 s LEU 62 N 1.54 3.49 -0.06 3.92 0.20 0.11 -1.80 118.68 126.08 2hm9 s LEU 62 Ca 0.10 -0.14 0.03 0.00 0.69 0.00 0.00 54.13 54.81 2hm9 s LEU 62 Cb -0.15 -1.91 0.01 0.00 -0.43 0.00 0.00 46.19 43.71 2hm9 s LEU 62 CO 0.08 0.03 -0.13 0.28 -0.29 0.00 0.00 176.35 176.33 2hm9 s THR 63 N 1.20 1.17 0.13 3.68 -1.32 -1.14 -3.06 115.64 116.30 2hm9 s THR 63 Ca 0.04 -0.52 -0.14 0.00 -1.21 0.00 0.00 61.69 59.87 2hm9 s THR 63 Cb -0.14 -1.06 -0.02 0.00 -1.51 0.00 0.00 72.50 69.77 2hm9 s THR 63 CO 0.03 0.36 1.56 -0.74 -2.21 0.00 0.00 174.62 173.62 2hm9 h HIS 64 N 6.80 0.85 -3.44 9.09 2.76 -1.88 -3.35 115.15 125.98 2hm9 h HIS 64 Ca -0.31 -0.16 -0.52 0.00 -2.20 0.00 0.00 60.37 57.17 2hm9 h HIS 64 Cb 1.19 -0.21 -0.00 0.00 1.55 0.00 0.00 27.41 29.93 2hm9 h HIS 64 CO 0.47 0.86 0.48 1.14 -1.30 0.00 0.00 177.93 179.58 2hm9 s GLN 65 N -4.91 4.55 0.00 5.26 -2.07 -1.26 -4.93 119.66 116.29 2hm9 s GLN 65 Ca -0.13 1.68 0.30 0.00 -1.82 0.00 0.00 55.36 55.39 2hm9 s GLN 65 Cb 0.10 -3.33 1.66 0.00 -1.09 0.00 0.00 33.01 30.36 2hm9 s GLN 65 CO 0.81 -0.03 2.08 -0.85 -1.32 0.00 0.00 175.29 175.99 2hm9 n GLU 66 N 3.04 0.71 -0.32 9.60 0.00 -1.26 -3.22 120.64 129.18 2hm9 n GLU 66 Ca 0.05 0.01 0.09 0.00 0.00 0.00 0.00 57.16 57.30 2hm9 n GLU 66 Cb 0.47 -1.50 0.26 0.00 0.00 0.00 0.00 31.44 30.67 2hm9 n GLU 66 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 2hm9 n ASP 67 N -1.13 3.21 -4.47 -1.84 -0.08 -1.26 -4.92 116.55 106.07 2hm9 n ASP 67 Ca 0.19 -2.05 -0.30 0.00 -1.51 0.00 0.00 54.79 51.11 2hm9 n ASP 67 Cb 0.16 -0.41 -0.12 0.00 2.34 0.00 0.00 41.12 43.10 2hm9 n ASP 67 CO 0.00 0.00 0.00 -0.47 0.12 0.00 0.00 177.20 176.85 2hm9 s TYR 68 N -1.31 2.52 0.09 -0.67 6.14 -1.20 -5.14 117.35 117.78 2hm9 s TYR 68 Ca 0.39 -0.27 0.03 0.00 0.64 0.00 0.00 57.07 57.86 2hm9 s TYR 68 Cb 0.21 -1.38 -0.04 0.00 0.42 0.00 0.00 41.96 41.17 2hm9 s TYR 68 CO 0.25 0.33 -0.09 -0.65 0.64 0.00 0.00 175.55 176.04 2hm9 s GLN 69 N -1.88 0.78 0.02 4.97 1.11 -1.26 -5.00 119.66 118.40 2hm9 s GLN 69 Ca 0.16 -1.13 0.03 0.00 0.01 0.00 0.00 55.36 54.43 2hm9 s GLN 69 Cb -0.10 -0.39 -0.01 0.00 -1.01 0.00 0.00 33.01 31.49 2hm9 s GLN 69 CO 0.08 0.05 -0.09 0.00 0.01 0.00 0.00 175.29 175.34 2hm9 s ALA 70 N -2.58 0.70 -0.12 6.09 0.00 -1.26 -5.13 121.76 119.46 2hm9 s ALA 70 Ca 0.04 -0.56 -0.04 0.00 0.00 0.00 0.00 51.96 51.40 2hm9 s ALA 70 Cb -0.02 -0.09 -0.04 0.00 0.00 0.00 0.00 23.12 22.98 2hm9 s ALA 70 CO -0.01 0.11 0.03 -0.65 0.00 0.00 0.00 175.76 175.23 2hm9 s GLN 71 N -0.83 3.39 0.00 0.00 -1.52 -1.26 -4.45 119.66 114.99 2hm9 s GLN 71 Ca -0.02 -0.36 0.00 0.00 -1.95 0.00 0.00 55.36 53.03 2hm9 s GLN 71 Cb -0.06 -2.97 0.00 0.00 -0.22 0.00 0.00 33.01 29.76 2hm9 s GLN 71 CO 0.00 0.55 0.00 0.41 -0.25 0.00 0.00 175.29 176.00 2hm9 n GLY 72 N 2.65 3.20 2.89 3.09 0.00 -1.26 -4.73 105.19 111.03 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 -2.47 0.25 0.23 4.61 0.00 -1.26 -4.54 121.76 118.57 2hm9 s ALA 73 Ca 0.00 -0.03 -0.32 0.00 0.00 0.00 0.00 51.96 51.61 2hm9 s ALA 73 Cb 0.00 -0.13 -0.13 0.00 0.00 0.00 0.00 23.12 22.86 2hm9 s ALA 73 CO 0.00 0.02 1.59 0.28 0.00 0.00 0.00 175.76 177.65 2hm9 n VAL 74 N 3.34 0.49 -3.42 0.00 0.31 -0.44 -3.61 118.33 114.99 2hm9 n VAL 74 Ca -0.17 -0.12 -0.40 0.00 -0.01 0.00 0.00 64.34 63.64 2hm9 n VAL 74 Cb 0.57 -1.77 -0.09 0.00 -0.91 0.00 0.00 33.84 31.63 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 0.52 5.18 -0.08 2.52 1.01 -1.25 0.21 120.40 128.51 2hm9 s VAL 75 Ca 0.71 0.10 0.03 0.00 0.00 0.00 0.00 61.98 62.82 2hm9 s VAL 75 Cb -0.57 -3.78 0.01 0.00 0.00 0.00 0.00 36.38 32.03 2hm9 s VAL 75 CO 0.42 -0.04 -0.16 0.68 0.00 0.00 0.00 175.10 176.00 2hm9 s VAL 76 N 1.99 1.44 -2.21 2.92 -7.23 -0.75 -4.98 120.40 111.58 2hm9 s VAL 76 Ca 0.12 -0.65 0.21 0.00 -1.81 0.00 0.00 61.98 59.84 2hm9 s VAL 76 Cb -0.16 -1.29 0.08 0.00 0.56 0.00 0.00 36.38 35.56 2hm9 s VAL 76 CO 0.11 0.42 1.08 1.41 -0.31 0.00 0.00 175.10 177.82 2hm9 n HIS 77 N 3.77 0.00 -3.66 2.82 -0.00 -1.26 -2.89 115.22 114.00 2hm9 n HIS 77 Ca -0.21 0.00 -0.37 0.00 -0.00 0.00 0.00 57.72 57.14 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 -2.01 6.02 0.17 0.41 1.01 -1.26 -4.80 116.67 116.20 2hm9 s ASP 78 Ca 0.20 0.06 -0.13 0.00 0.71 0.00 0.00 52.55 53.40 2hm9 s ASP 78 Cb 0.17 -2.09 0.07 0.00 1.01 0.00 0.00 42.92 42.07 2hm9 s ASP 78 CO 0.39 0.03 1.76 0.58 0.21 0.00 0.00 175.17 178.15 2hm9 h VAL 79 N 5.13 1.20 -0.51 -1.27 2.07 -1.98 -1.70 116.25 119.19 2hm9 h VAL 79 Ca -0.37 -0.56 -0.03 0.00 0.82 0.00 0.00 66.70 66.56 2hm9 h VAL 79 Cb 1.18 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 31.44 2hm9 h VAL 79 CO 0.63 0.23 0.17 0.00 0.02 0.00 0.00 177.57 178.62 2hm9 h ALA 80 N 1.12 1.35 -0.64 1.67 0.00 -2.00 -2.34 119.26 118.41 2hm9 h ALA 80 Ca 0.20 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2hm9 h ALA 80 Cb 0.10 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 2hm9 h ALA 80 CO -0.03 0.48 0.26 0.00 0.00 0.00 0.00 179.25 179.96 2hm9 h ALA 81 N 1.46 1.25 -0.52 0.00 0.00 -1.74 -0.60 119.26 119.10 2hm9 h ALA 81 Ca 0.17 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2hm9 h ALA 81 Cb 0.20 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2hm9 h ALA 81 CO -0.01 0.55 0.27 0.28 0.00 0.00 0.00 179.25 180.34 2hm9 h VAL 82 N 0.92 1.19 -0.40 0.00 2.07 -0.84 0.12 116.25 119.31 2hm9 h VAL 82 Ca 0.22 -0.50 -0.00 0.00 0.82 0.00 0.00 66.70 67.23 2hm9 h VAL 82 Cb 0.17 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 2hm9 h VAL 82 CO -0.02 0.20 0.23 -0.26 0.02 0.00 0.00 177.57 177.74 2hm9 h PHE 83 N 0.70 0.53 -0.66 1.57 -1.00 -1.32 -2.39 116.94 114.37 2hm9 h PHE 83 Ca 0.18 -0.01 -0.04 0.00 2.81 0.00 0.00 57.97 60.92 2hm9 h PHE 83 Cb 0.08 -0.17 -0.03 0.00 3.61 0.00 0.00 35.95 39.44 2hm9 h PHE 83 CO -0.01 0.39 0.27 0.00 -1.61 0.00 0.00 178.31 177.35 2hm9 h ALA 84 N 1.09 1.23 -0.30 2.45 0.00 -0.68 -0.87 119.26 122.18 2hm9 h ALA 84 Ca 0.14 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2hm9 h ALA 84 Cb 0.03 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2hm9 h ALA 84 CO -0.02 0.57 0.19 -0.92 0.00 0.00 0.00 179.25 179.06 2hm9 h TYR 85 N 0.95 0.38 -0.62 0.00 5.03 -0.39 -0.12 116.97 122.19 2hm9 h TYR 85 Ca 0.22 0.01 -0.05 0.00 2.58 0.00 0.00 58.73 61.49 2hm9 h TYR 85 Cb 0.18 -0.13 -0.03 0.00 1.55 0.00 0.00 36.73 38.30 2hm9 h TYR 85 CO 0.01 0.26 0.20 0.00 -1.32 0.00 0.00 178.16 177.31 2hm9 h ALA 86 N 1.09 1.17 -0.72 1.82 0.00 -1.13 -2.34 119.26 119.16 2hm9 h ALA 86 Ca 0.11 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 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 0.58 0.30 -0.22 0.00 0.00 0.00 179.25 179.88 2hm9 h LYS 87 N 0.91 1.06 -0.71 0.00 1.63 -0.55 -2.46 116.57 116.46 2hm9 h LYS 87 Ca 0.20 -0.18 -0.06 0.00 -0.85 0.00 0.00 60.65 59.77 2hm9 h LYS 87 Cb 0.26 -0.18 -0.03 0.00 -0.60 0.00 0.00 32.23 31.68 2hm9 h LYS 87 CO -0.01 0.85 0.22 1.96 -3.45 0.00 0.00 179.45 179.02 2hm9 h GLN 88 N 1.04 1.09 -2.77 1.90 4.20 -0.51 -3.26 115.11 116.80 2hm9 h GLN 88 Ca 0.24 -0.23 -0.73 0.00 0.06 0.00 0.00 58.65 57.99 2hm9 h GLN 88 Cb 0.18 -0.16 -0.33 0.00 0.30 0.00 0.00 27.48 27.47 2hm9 h GLN 88 CO -0.02 0.93 0.24 0.72 -0.67 0.00 0.00 178.83 180.03 2hm9 n HIS 89 N -4.26 3.07 0.15 2.96 8.25 -0.93 -4.86 115.22 119.60 2hm9 n HIS 89 Ca 0.06 -3.31 0.08 0.00 -0.26 0.00 0.00 57.72 54.28 2hm9 n HIS 89 Cb 0.23 -1.05 0.58 0.00 1.12 0.00 0.00 29.99 30.87 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 5.17 0.16 -0.28 -0.41 0.13 -1.59 -2.09 132.00 133.08 2hm9 h PRO 90 Ca 0.19 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 65.26 2hm9 h PRO 90 Cb 0.66 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 31.74 2hm9 h PRO 90 CO 1.11 0.11 -0.06 0.22 -0.23 0.00 0.00 178.00 179.15 2hm9 h ASP 91 N 0.16 0.42 -3.25 1.44 1.82 -1.89 -3.42 116.42 111.71 2hm9 h ASP 91 Ca 0.07 -0.08 -0.62 0.00 -0.39 0.00 0.00 57.03 56.01 2hm9 h ASP 91 Cb 0.09 -0.11 -0.16 0.00 0.68 0.00 0.00 39.33 39.84 2hm9 h ASP 91 CO -0.01 0.53 -0.56 -1.58 -1.61 0.00 0.00 179.24 176.00 2hm9 s GLN 92 N -4.87 3.87 0.49 0.28 0.74 -0.79 -5.09 119.66 114.29 2hm9 s GLN 92 Ca -0.07 -0.34 -0.19 0.00 0.05 0.00 0.00 55.36 54.81 2hm9 s GLN 92 Cb 0.15 -3.17 -0.08 0.00 1.10 0.00 0.00 33.01 31.00 2hm9 s GLN 92 CO 0.76 0.33 1.00 -1.21 -0.55 0.00 0.00 175.29 175.62 2hm9 s GLU 93 N 0.20 3.91 -0.17 1.67 2.02 -1.26 -4.71 118.70 120.35 2hm9 s GLU 93 Ca 0.04 1.17 -0.05 0.00 0.02 0.00 0.00 54.97 56.14 2hm9 s GLU 93 Cb -0.12 -2.12 -0.03 0.00 0.10 0.00 0.00 34.13 31.95 2hm9 s GLU 93 CO 0.00 -0.32 0.01 -1.17 0.02 0.00 0.00 175.26 173.81 2hm9 s LEU 94 N -3.67 3.52 0.11 1.80 2.96 -1.25 0.86 118.68 123.02 2hm9 s LEU 94 Ca 0.63 -0.03 0.05 0.00 -0.22 0.00 0.00 54.13 54.55 2hm9 s LEU 94 Cb -0.12 -1.87 -0.04 0.00 0.50 0.00 0.00 46.19 44.66 2hm9 s LEU 94 CO 0.23 0.17 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.62 2hm9 s VAL 95 N 0.38 1.12 -0.34 1.68 1.01 0.24 0.39 120.40 124.88 2hm9 s VAL 95 Ca -0.01 -1.74 -0.10 0.00 0.00 0.00 0.00 61.98 60.13 2hm9 s VAL 95 Cb -0.13 -1.51 0.02 0.00 0.00 0.00 0.00 36.38 34.76 2hm9 s VAL 95 CO 0.02 -0.54 0.17 -0.63 0.00 0.00 0.00 175.10 174.11 2hm9 s ILE 96 N -2.50 4.45 -1.02 2.22 -1.09 0.31 -0.21 121.20 123.37 2hm9 s ILE 96 Ca 0.09 -0.72 0.20 0.00 -2.23 0.00 0.00 60.65 57.99 2hm9 s ILE 96 Cb -0.03 -3.39 0.18 0.00 -1.58 0.00 0.00 42.46 37.64 2hm9 s ILE 96 CO 0.01 -0.10 1.65 0.00 -1.23 0.00 0.00 174.94 175.28 2hm9 n ALA 97 N 4.96 1.94 0.00 9.38 0.00 0.33 -2.70 120.51 134.42 2hm9 n ALA 97 Ca -0.13 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.24 2hm9 n ALA 97 Cb 0.47 -1.33 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 0.60 -1.69 0.00 0.00 0.00 -1.20 -4.89 105.19 98.01 2hm9 n GLY 98 Ca 0.05 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.49 2hm9 n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hm9 n GLY 99 N 0.00 0.22 0.34 -0.02 0.00 -1.26 0.11 105.19 104.57 2hm9 n GLY 99 Ca 0.00 -1.28 -0.02 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 1.29 -0.75 4.61 0.00 -1.93 -0.17 119.26 120.31 2hm9 h ALA 100 Ca 0.00 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 2hm9 h ALA 100 Cb 0.00 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.47 2hm9 h ALA 100 CO 0.00 0.56 0.34 0.37 0.00 0.00 0.00 179.25 180.52 2hm9 h GLN 101 N 1.02 1.10 -0.38 0.00 4.15 -1.98 0.72 115.11 119.72 2hm9 h GLN 101 Ca 0.25 -0.18 -0.06 0.00 0.77 0.00 0.00 58.65 59.43 2hm9 h GLN 101 Cb 0.07 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 27.55 2hm9 h GLN 101 CO -0.04 0.87 -0.01 0.82 -1.93 0.00 0.00 178.83 178.54 2hm9 h ILE 102 N 1.07 1.26 -0.52 2.39 1.08 -1.72 -2.41 117.51 118.65 2hm9 h ILE 102 Ca 0.26 -1.03 -0.02 0.00 -0.39 0.00 0.00 64.86 63.68 2hm9 h ILE 102 Cb 0.15 1.17 -0.02 0.00 -3.07 0.00 0.00 36.82 35.05 2hm9 h ILE 102 CO -0.03 0.34 0.26 -0.26 -0.69 0.00 0.00 178.15 177.78 2hm9 h PHE 103 N 0.50 0.74 -0.67 1.37 0.04 -0.37 -2.74 116.94 115.81 2hm9 h PHE 103 Ca 0.11 -0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.84 2hm9 h PHE 103 Cb 0.49 -0.23 -0.03 0.00 2.20 0.00 0.00 35.95 38.38 2hm9 h PHE 103 CO 0.04 0.57 0.40 1.15 -0.60 0.00 0.00 178.31 179.87 2hm9 h THR 104 N 0.69 1.19 -0.66 -1.55 2.02 0.54 1.01 112.91 116.15 2hm9 h THR 104 Ca 0.18 -0.42 -0.03 0.00 0.77 0.00 0.00 66.41 66.90 2hm9 h THR 104 Cb 0.09 0.27 -0.03 0.00 -1.74 0.00 0.00 68.15 66.74 2hm9 h THR 104 CO -0.02 0.20 0.28 0.00 0.37 0.00 0.00 175.52 176.34 2hm9 h ALA 105 N 1.21 1.25 -0.30 6.16 0.00 -1.30 -2.85 119.26 123.42 2hm9 h ALA 105 Ca 0.24 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2hm9 h ALA 105 Cb -0.03 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 2hm9 h ALA 105 CO -0.05 0.56 0.01 1.19 0.00 0.00 0.00 179.25 180.96 2hm9 n PHE 106 N -4.32 1.08 -0.19 0.00 3.72 -0.98 -4.72 117.46 112.05 2hm9 n PHE 106 Ca 0.06 -0.94 -0.07 0.00 -0.05 0.00 0.00 57.45 56.46 2hm9 n PHE 106 Cb 0.16 -0.35 0.03 0.00 -0.94 0.00 0.00 39.48 38.37 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 1.90 0.74 -0.01 -1.08 3.64 0.13 -2.18 116.57 119.71 2hm9 h LYS 107 Ca 0.03 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2hm9 h LYS 107 Cb 1.53 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 33.19 2hm9 h LYS 107 CO 0.27 0.52 -0.10 -3.47 -2.27 0.00 0.00 179.45 174.40 2hm9 n ASP 108 N -4.67 0.98 -1.44 4.20 -0.08 -1.26 -3.82 116.55 110.46 2hm9 n ASP 108 Ca 0.03 -1.07 0.10 0.00 -1.51 0.00 0.00 54.79 52.35 2hm9 n ASP 108 Cb 0.04 0.02 0.33 0.00 2.34 0.00 0.00 41.12 43.86 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 -0.43 4.24 -4.29 1.67 8.00 -0.83 -4.94 116.55 119.98 2hm9 n ASP 109 Ca 0.17 -2.22 -0.32 0.00 0.71 0.00 0.00 54.79 53.12 2hm9 n ASP 109 Cb 0.31 -0.53 -0.16 0.00 -0.02 0.00 0.00 41.12 40.73 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 -1.45 2.49 -0.14 2.53 1.01 -1.18 -4.48 120.40 119.18 2hm9 s VAL 110 Ca 0.49 -0.87 0.19 0.00 0.00 0.00 0.00 61.98 61.79 2hm9 s VAL 110 Cb 0.28 -1.99 -0.14 0.00 0.00 0.00 0.00 36.38 34.53 2hm9 s VAL 110 CO 0.28 0.55 0.75 0.47 0.00 0.00 0.00 175.10 177.15 2hm9 n ASP 111 N 3.49 0.64 -4.20 3.32 8.00 -1.22 -4.74 116.55 121.85 2hm9 n ASP 111 Ca -0.19 0.27 -0.32 0.00 0.71 0.00 0.00 54.79 55.26 2hm9 n ASP 111 Cb 0.53 0.61 -0.17 0.00 -0.02 0.00 0.00 41.12 42.07 2hm9 n ASP 111 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2hm9 s THR 112 N -3.09 2.06 -0.13 -3.53 2.01 -1.17 0.19 115.64 111.96 2hm9 s THR 112 Ca -0.04 -1.00 0.01 0.00 0.31 0.00 0.00 61.69 60.97 2hm9 s THR 112 Cb 0.09 -1.80 -0.01 0.00 0.01 0.00 0.00 72.50 70.80 2hm9 s THR 112 CO 0.82 0.55 -0.17 -0.76 -0.69 0.00 0.00 174.62 174.38 2hm9 s LEU 113 N 0.57 2.46 -0.18 4.42 1.43 0.25 -0.69 118.68 126.94 2hm9 s LEU 113 Ca -0.13 -0.44 -0.01 0.00 -1.03 0.00 0.00 54.13 52.53 2hm9 s LEU 113 Cb -0.17 -1.54 0.01 0.00 0.03 0.00 0.00 46.19 44.52 2hm9 s LEU 113 CO 0.04 0.14 -0.14 -0.76 0.23 0.00 0.00 176.35 175.85 2hm9 s LEU 114 N 0.50 2.45 -0.03 1.79 1.43 0.27 0.05 118.68 125.14 2hm9 s LEU 114 Ca -0.11 -0.52 0.03 0.00 -1.03 0.00 0.00 54.13 52.50 2hm9 s LEU 114 Cb -0.16 -1.58 -0.00 0.00 0.03 0.00 0.00 46.19 44.48 2hm9 s LEU 114 CO 0.05 0.02 -0.12 0.54 0.23 0.00 0.00 176.35 177.07 2hm9 s VAL 115 N 1.18 0.98 -0.16 -1.59 0.11 -0.44 -2.84 120.40 117.64 2hm9 s VAL 115 Ca 0.02 -0.48 -0.03 0.00 -2.93 0.00 0.00 61.98 58.55 2hm9 s VAL 115 Cb -0.14 -0.85 -0.02 0.00 -1.53 0.00 0.00 36.38 33.83 2hm9 s VAL 115 CO -0.06 0.29 -0.06 -0.89 -3.33 0.00 0.00 175.10 171.05 2hm9 s THR 116 N 0.05 3.57 -0.09 5.04 2.01 -0.95 -1.66 115.64 123.61 2hm9 s THR 116 Ca -0.01 -0.46 0.02 0.00 0.31 0.00 0.00 61.69 61.55 2hm9 s THR 116 Cb -0.08 -2.56 -0.02 0.00 0.01 0.00 0.00 72.50 69.85 2hm9 s THR 116 CO 0.01 0.49 -0.16 -0.60 -0.69 0.00 0.00 174.62 173.66 2hm9 s ARG 117 N 0.58 2.92 -0.15 4.92 3.52 -0.79 -0.29 118.95 129.66 2hm9 s ARG 117 Ca -0.04 -0.74 -0.03 0.00 -0.13 0.00 0.00 55.73 54.79 2hm9 s ARG 117 Cb -0.15 -2.44 -0.02 0.00 -1.56 0.00 0.00 34.95 30.78 2hm9 s ARG 117 CO 0.03 0.38 -0.07 -0.51 -0.81 0.00 0.00 175.30 174.32 2hm9 s LEU 118 N -0.10 3.05 0.27 -0.88 1.02 -1.14 -1.42 118.68 119.47 2hm9 s LEU 118 Ca -0.03 -0.22 -0.03 0.00 0.02 0.00 0.00 54.13 53.88 2hm9 s LEU 118 Cb -0.14 -1.73 0.35 0.00 0.02 0.00 0.00 46.19 44.70 2hm9 s LEU 118 CO 0.04 0.15 1.82 0.00 0.02 0.00 0.00 176.35 178.37 2hm9 h ALA 119 N 6.86 1.18 -2.76 4.21 0.00 -1.69 -3.03 119.26 124.03 2hm9 h ALA 119 Ca -0.30 -0.20 -0.51 0.00 0.00 0.00 0.00 54.91 53.90 2hm9 h ALA 119 Cb 1.19 -0.24 0.04 0.00 0.00 0.00 0.00 17.79 18.78 2hm9 h ALA 119 CO 0.60 0.57 0.50 0.20 0.00 0.00 0.00 179.25 181.12 2hm9 s GLY 120 N -3.57 2.95 0.37 0.00 0.00 -1.24 -4.80 107.32 101.04 2hm9 s GLY 120 Ca -0.10 0.96 -0.25 0.00 0.00 0.00 0.00 44.72 45.32 2hm9 s GLY 120 CO 0.81 1.52 1.06 -0.45 0.00 0.00 0.00 173.10 176.04 2hm9 s SER 121 N -0.98 6.87 0.07 1.64 0.15 -1.26 -4.52 113.70 115.67 2hm9 s SER 121 Ca 0.51 2.10 0.04 0.00 0.70 0.00 0.00 55.95 59.30 2hm9 s SER 121 Cb -0.32 -2.60 -0.03 0.00 -1.71 0.00 0.00 66.02 61.37 2hm9 s SER 121 CO 0.41 -0.41 -0.12 -0.36 1.20 0.00 0.00 173.24 173.95 2hm9 s PHE 122 N -1.53 1.05 -0.05 3.44 0.40 -1.26 -5.08 117.98 114.95 2hm9 s PHE 122 Ca 0.55 -0.50 0.06 0.00 -0.60 0.00 0.00 56.93 56.45 2hm9 s PHE 122 Cb -0.24 -0.60 -0.01 0.00 0.51 0.00 0.00 43.02 42.67 2hm9 s PHE 122 CO 0.31 0.01 -0.24 -1.83 0.70 0.00 0.00 175.22 174.17 2hm9 s GLU 123 N -1.84 2.41 0.16 0.44 -1.05 -1.26 -4.89 118.70 112.68 2hm9 s GLU 123 Ca -0.03 -0.90 -0.24 0.00 -0.15 0.00 0.00 54.97 53.65 2hm9 s GLU 123 Cb -0.09 -2.14 0.06 0.00 -0.44 0.00 0.00 34.13 31.51 2hm9 s GLU 123 CO 0.02 0.45 0.86 0.20 0.95 0.00 0.00 175.26 177.74 2hm9 s GLY 124 N -0.34 -0.26 0.00 -3.83 0.00 -1.26 -4.84 107.32 96.78 2hm9 s GLY 124 Ca 0.02 0.18 0.27 0.00 0.00 0.00 0.00 44.72 45.19 2hm9 s GLY 124 CO 0.02 0.04 1.67 1.34 0.00 0.00 0.00 173.10 176.17 2hm9 n ASP 125 N -0.43 1.21 -4.22 1.64 2.03 -0.81 -4.82 116.55 111.15 2hm9 n ASP 125 Ca -0.07 -1.15 -0.32 0.00 0.52 0.00 0.00 54.79 53.76 2hm9 n ASP 125 Cb 0.61 0.06 -0.16 0.00 -0.72 0.00 0.00 41.12 40.91 2hm9 n ASP 125 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2hm9 s THR 126 N -2.27 2.25 0.09 5.18 2.01 0.22 -4.78 115.64 118.34 2hm9 s THR 126 Ca 0.31 -0.93 0.09 0.00 0.31 0.00 0.00 61.69 61.47 2hm9 s THR 126 Cb 0.20 -1.90 -0.04 0.00 0.01 0.00 0.00 72.50 70.78 2hm9 s THR 126 CO 0.43 0.55 -0.24 -0.54 -0.69 0.00 0.00 174.62 174.13 2hm9 s LYS 127 N 0.60 1.70 0.33 4.92 1.02 -1.26 -2.04 119.74 125.01 2hm9 s LYS 127 Ca -0.11 -1.19 -0.28 0.00 0.02 0.00 0.00 55.97 54.41 2hm9 s LYS 127 Cb -0.16 -2.01 -0.09 0.00 -0.52 0.00 0.00 37.83 35.04 2hm9 s LYS 127 CO 0.03 0.49 1.15 1.41 -0.92 0.00 0.00 175.35 177.50 2hm9 s MET 128 N -1.75 4.41 0.61 1.68 -2.45 -1.14 -4.78 119.30 115.88 2hm9 s MET 128 Ca 0.14 1.85 -0.18 0.00 -1.25 0.00 0.00 55.69 56.25 2hm9 s MET 128 Cb -0.10 -2.98 -0.03 0.00 1.25 0.00 0.00 34.83 32.97 2hm9 s MET 128 CO 0.06 -0.02 1.22 0.96 1.05 0.00 0.00 175.02 178.29 2hm9 s ILE 129 N -1.27 2.54 0.46 10.11 -5.25 -1.26 -4.94 121.20 121.59 2hm9 s ILE 129 Ca 0.50 0.33 -0.25 0.00 -0.99 0.00 0.00 60.65 60.23 2hm9 s ILE 129 Cb -0.32 -3.10 -0.08 0.00 2.95 0.00 0.00 42.46 41.91 2hm9 s ILE 129 CO 0.41 -0.08 1.44 -2.84 -1.79 0.00 0.00 174.94 172.08 2hm9 s PRO 130 N -3.40 3.62 0.06 0.37 0.02 -1.26 -5.03 135.00 129.38 2hm9 s PRO 130 Ca 0.78 2.43 0.07 0.00 0.02 0.00 0.00 61.00 64.30 2hm9 s PRO 130 Cb -0.31 -2.62 -0.03 0.00 0.02 0.00 0.00 34.50 31.56 2hm9 s PRO 130 CO 0.35 -0.87 -0.19 -0.51 -0.33 0.00 0.00 177.00 175.45 2hm9 s LEU 131 N -2.80 2.20 -0.95 -5.54 1.43 -1.26 -5.08 118.68 106.68 2hm9 s LEU 131 Ca 0.62 -0.55 -0.18 0.00 -1.03 0.00 0.00 54.13 53.00 2hm9 s LEU 131 Cb -0.44 -0.84 0.15 0.00 0.03 0.00 0.00 46.19 45.08 2hm9 s LEU 131 CO 0.56 0.10 1.12 0.20 0.23 0.00 0.00 176.35 178.56 2hm9 s ASN 132 N -1.36 6.69 0.24 2.29 0.01 -1.26 -4.84 114.94 116.71 2hm9 s ASN 132 Ca 0.05 -2.22 -0.06 0.00 -0.71 0.00 0.00 52.86 49.92 2hm9 s ASN 132 Cb -0.09 -2.38 0.23 0.00 0.41 0.00 0.00 41.25 39.43 2hm9 s ASN 132 CO 0.02 -0.97 1.85 -0.50 -1.51 0.00 0.00 177.10 175.99 2hm9 h TRP 133 N 8.55 1.21 -0.35 2.20 -0.00 -1.98 -2.44 115.95 123.13 2hm9 h TRP 133 Ca 0.17 -0.04 -0.06 0.00 -0.00 0.00 0.00 58.89 58.96 2hm9 h TRP 133 Cb 1.01 -0.38 -0.02 0.00 -0.00 0.00 0.00 29.16 29.77 2hm9 h TRP 133 CO 1.14 0.84 -0.05 0.22 -0.00 0.00 0.00 178.44 180.60 2hm9 h ASP 134 N 1.22 0.54 -0.24 -3.49 3.58 -2.04 -2.82 116.42 113.16 2hm9 h ASP 134 Ca 0.30 -0.12 -0.05 0.00 0.42 0.00 0.00 57.03 57.58 2hm9 h ASP 134 Cb 0.05 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 40.94 2hm9 h ASP 134 CO -0.05 0.65 -0.00 0.44 -2.88 0.00 0.00 179.24 177.40 2hm9 h ASP 135 N 0.54 0.52 -3.43 2.28 5.19 -1.84 -3.42 116.42 116.24 2hm9 h ASP 135 Ca 0.11 -0.10 -0.67 0.00 -0.62 0.00 0.00 57.03 55.74 2hm9 h ASP 135 Cb 0.42 -0.14 -0.15 0.00 0.18 0.00 0.00 39.33 39.65 2hm9 h ASP 135 CO 0.02 0.59 -0.66 -0.36 -3.12 0.00 0.00 179.24 175.71 2hm9 s PHE 136 N -4.97 3.04 -0.15 4.55 0.40 -1.07 -4.20 117.98 115.58 2hm9 s PHE 136 Ca -0.08 0.07 -0.02 0.00 -0.60 0.00 0.00 56.93 56.30 2hm9 s PHE 136 Cb 0.15 -1.68 -0.02 0.00 0.51 0.00 0.00 43.02 41.98 2hm9 s PHE 136 CO 0.77 0.43 -0.07 0.99 0.70 0.00 0.00 175.22 178.04 2hm9 s THR 137 N -1.01 3.52 0.17 0.64 2.01 -1.15 -4.82 115.64 115.00 2hm9 s THR 137 Ca 0.17 -0.49 -0.32 0.00 0.31 0.00 0.00 61.69 61.37 2hm9 s THR 137 Cb -0.11 -2.53 -0.10 0.00 0.01 0.00 0.00 72.50 69.76 2hm9 s THR 137 CO 0.07 0.50 1.61 -0.75 -0.69 0.00 0.00 174.62 175.36 2hm9 s LYS 138 N 0.50 4.19 -0.09 4.92 2.20 -1.26 -2.01 119.74 128.18 2hm9 s LYS 138 Ca -0.05 2.42 -0.21 0.00 -0.36 0.00 0.00 55.97 57.76 2hm9 s LYS 138 Cb -0.15 -3.17 -0.28 0.00 -1.51 0.00 0.00 37.83 32.72 2hm9 s LYS 138 CO 0.03 -0.65 0.72 -0.39 -0.36 0.00 0.00 175.35 174.70 2hm9 h VAL 139 N 4.03 1.36 -3.16 4.02 -1.51 -1.11 -3.47 116.25 116.41 2hm9 h VAL 139 Ca -0.43 -2.44 -0.01 0.00 -1.23 0.00 0.00 66.70 62.60 2hm9 h VAL 139 Cb 1.20 3.01 -0.10 0.00 -2.13 0.00 0.00 31.29 33.27 2hm9 h VAL 139 CO 0.93 0.66 0.11 -0.55 -1.23 0.00 0.00 177.57 177.50 2hm9 s SER 140 N -6.86 -0.37 0.02 4.19 0.15 -1.20 -5.05 113.70 104.57 2hm9 s SER 140 Ca -0.18 -0.31 0.01 0.00 0.70 0.00 0.00 55.95 56.18 2hm9 s SER 140 Cb 0.02 0.60 -0.02 0.00 -1.71 0.00 0.00 66.02 64.91 2hm9 s SER 140 CO 0.77 -1.05 -0.05 -0.94 1.20 0.00 0.00 173.24 173.17 2hm9 s SER 141 N -2.83 0.59 -0.02 5.45 1.04 -1.26 -1.65 113.70 115.02 2hm9 s SER 141 Ca 0.06 -0.39 0.03 0.00 0.48 0.00 0.00 55.95 56.14 2hm9 s SER 141 Cb -0.01 0.02 -0.00 0.00 0.10 0.00 0.00 66.02 66.12 2hm9 s SER 141 CO -0.06 -0.14 -0.12 -0.60 0.98 0.00 0.00 173.24 173.30 2hm9 s ARG 142 N -1.08 1.05 -0.13 4.02 3.52 0.26 -4.98 118.95 121.61 2hm9 s ARG 142 Ca -0.08 -0.41 0.02 0.00 -0.13 0.00 0.00 55.73 55.14 2hm9 s ARG 142 Cb -0.07 -0.99 -0.00 0.00 -1.56 0.00 0.00 34.95 32.33 2hm9 s ARG 142 CO -0.00 0.21 -0.19 0.99 -0.81 0.00 0.00 175.30 175.50 2hm9 s THR 143 N -0.09 2.44 -0.09 4.11 2.01 -1.26 0.12 115.64 122.87 2hm9 s THR 143 Ca 0.01 -0.87 0.04 0.00 0.31 0.00 0.00 61.69 61.18 2hm9 s THR 143 Cb -0.07 -1.99 0.00 0.00 0.01 0.00 0.00 72.50 70.46 2hm9 s THR 143 CO 0.00 0.54 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.57 2hm9 s VAL 144 N 0.55 1.79 -0.21 3.82 1.01 -0.50 -5.00 120.40 121.85 2hm9 s VAL 144 Ca -0.12 -0.86 -0.04 0.00 0.00 0.00 0.00 61.98 60.96 2hm9 s VAL 144 Cb -0.16 -1.56 -0.01 0.00 0.00 0.00 0.00 36.38 34.65 2hm9 s VAL 144 CO 0.04 0.50 -0.04 -1.61 0.00 0.00 0.00 175.10 173.99 2hm9 s GLU 145 N 0.40 3.42 0.82 2.72 2.02 -1.26 -2.03 118.70 124.78 2hm9 s GLU 145 Ca -0.17 -0.61 -0.05 0.00 0.02 0.00 0.00 54.97 54.16 2hm9 s GLU 145 Cb -0.17 -2.99 0.17 0.00 0.10 0.00 0.00 34.13 31.24 2hm9 s GLU 145 CO 0.07 -0.13 1.12 0.34 0.02 0.00 0.00 175.26 176.67 2hm9 s ASP 146 N 1.32 3.80 0.12 -0.19 -1.08 -1.26 -4.96 116.67 114.42 2hm9 s ASP 146 Ca 0.04 -0.35 -0.18 0.00 -0.52 0.00 0.00 52.55 51.55 2hm9 s ASP 146 Cb -0.14 0.17 -0.04 0.00 -1.46 0.00 0.00 42.92 41.45 2hm9 s ASP 146 CO -0.02 -2.25 1.68 0.71 0.52 0.00 0.00 175.17 175.82 2hm9 h THR 147 N -0.92 1.16 -2.73 1.71 1.35 -1.99 -3.43 112.91 108.06 2hm9 h THR 147 Ca -0.37 -0.48 -0.65 0.00 -0.55 0.00 0.00 66.41 64.36 2hm9 h THR 147 Cb 1.25 0.90 -0.06 0.00 -1.73 0.00 0.00 68.15 68.51 2hm9 h THR 147 CO 0.35 0.17 -0.48 0.21 -0.25 0.00 0.00 175.52 175.52 2hm9 s ASN 148 N -5.70 6.39 0.32 5.36 2.47 -1.26 -5.01 114.94 117.52 2hm9 s ASN 148 Ca -0.13 0.42 0.03 0.00 0.42 0.00 0.00 52.86 53.60 2hm9 s ASN 148 Cb 0.09 -2.04 0.63 0.00 -1.45 0.00 0.00 41.25 38.48 2hm9 s ASN 148 CO 0.73 0.33 1.91 1.55 -3.72 0.00 0.00 177.10 177.91 2hm9 h PRO 149 N 4.40 0.87 -0.58 0.43 0.13 -1.95 -0.71 132.00 134.60 2hm9 h PRO 149 Ca -0.52 -0.05 -0.07 0.00 -0.87 0.00 0.00 66.00 64.49 2hm9 h PRO 149 Cb 1.21 -0.20 -0.02 0.00 0.13 0.00 0.00 31.00 32.12 2hm9 h PRO 149 CO 0.63 0.58 0.08 0.00 -0.23 0.00 0.00 178.00 179.07 2hm9 h ALA 150 N 1.55 1.06 -0.24 -0.56 0.00 -1.92 -2.60 119.26 116.55 2hm9 h ALA 150 Ca 0.39 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 2hm9 h ALA 150 Cb 0.32 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2hm9 h ALA 150 CO -0.15 0.60 -0.28 -0.07 0.00 0.00 0.00 179.25 179.35 2hm9 h LEU 151 N 0.88 0.47 -9.84 0.00 3.38 -1.58 -3.28 115.31 105.34 2hm9 h LEU 151 Ca 0.18 -0.17 -0.53 0.00 0.09 0.00 0.00 57.88 57.45 2hm9 h LEU 151 Cb 0.40 -0.13 0.09 0.00 0.09 0.00 0.00 40.66 41.11 2hm9 h LEU 151 CO 0.01 0.74 0.88 -0.89 0.09 0.00 0.00 178.44 179.27 2hm9 s THR 152 N -4.44 2.01 0.11 0.22 2.01 -0.41 -4.63 115.64 110.51 2hm9 s THR 152 Ca -0.07 0.01 -0.04 0.00 0.31 0.00 0.00 61.69 61.90 2hm9 s THR 152 Cb 0.14 -3.01 -0.03 0.00 0.01 0.00 0.00 72.50 69.61 2hm9 s THR 152 CO 0.79 0.00 0.11 -1.38 -0.69 0.00 0.00 174.62 173.46 2hm9 s HIS 153 N -0.22 0.54 0.12 4.92 -3.43 -0.86 -2.85 115.29 113.51 2hm9 s HIS 153 Ca 0.62 -0.97 0.06 0.00 -0.80 0.00 0.00 55.06 53.97 2hm9 s HIS 153 Cb -0.48 -0.28 -0.04 0.00 -1.43 0.00 0.00 32.58 30.35 2hm9 s HIS 153 CO 0.51 -0.54 -0.14 0.99 -2.00 0.00 0.00 174.74 173.57 2hm9 s THR 154 N -3.96 1.30 -0.17 -5.38 2.01 -0.51 -1.41 115.64 107.52 2hm9 s THR 154 Ca 0.15 -1.68 -0.01 0.00 0.31 0.00 0.00 61.69 60.46 2hm9 s THR 154 Cb 0.06 -1.49 -0.01 0.00 0.01 0.00 0.00 72.50 71.08 2hm9 s THR 154 CO -0.04 -0.40 -0.11 -0.31 -0.69 0.00 0.00 174.62 173.07 2hm9 s TYR 155 N -2.07 2.86 -0.06 4.92 2.02 0.32 -1.88 117.35 123.45 2hm9 s TYR 155 Ca 0.08 -0.89 0.05 0.00 -0.37 0.00 0.00 57.07 55.93 2hm9 s TYR 155 Cb -0.05 -1.95 -0.00 0.00 -0.40 0.00 0.00 41.96 39.56 2hm9 s TYR 155 CO 0.03 -0.42 -0.20 -1.21 -1.57 0.00 0.00 175.55 172.18 2hm9 s GLU 156 N 0.88 2.21 -0.12 -0.62 2.02 -0.66 0.90 118.70 123.30 2hm9 s GLU 156 Ca -0.03 -0.73 0.03 0.00 0.02 0.00 0.00 54.97 54.27 2hm9 s GLU 156 Cb -0.15 -1.84 0.01 0.00 0.10 0.00 0.00 34.13 32.24 2hm9 s GLU 156 CO -0.00 0.26 -0.23 0.08 0.02 0.00 0.00 175.26 175.39 2hm9 s VAL 157 N 0.07 2.07 -0.03 2.63 1.01 -0.66 -1.32 120.40 124.17 2hm9 s VAL 157 Ca -0.07 -1.00 0.04 0.00 0.00 0.00 0.00 61.98 60.96 2hm9 s VAL 157 Cb -0.14 -1.81 -0.03 0.00 0.00 0.00 0.00 36.38 34.41 2hm9 s VAL 157 CO 0.04 0.55 -0.15 0.26 0.00 0.00 0.00 175.10 175.81 2hm9 s TRP 158 N 0.60 2.68 -0.10 5.22 0.52 0.11 -0.47 118.94 127.50 2hm9 s TRP 158 Ca -0.12 -0.17 0.04 0.00 0.02 0.00 0.00 56.10 55.86 2hm9 s TRP 158 Cb -0.17 -1.59 0.00 0.00 -1.15 0.00 0.00 33.47 30.56 2hm9 s TRP 158 CO 0.03 0.21 -0.23 -0.65 0.02 0.00 0.00 176.95 176.33 2hm9 s GLN 159 N -0.91 2.91 0.25 4.98 -1.52 -0.85 0.85 119.66 125.37 2hm9 s GLN 159 Ca 0.12 -0.83 -0.30 0.00 -1.95 0.00 0.00 55.36 52.41 2hm9 s GLN 159 Cb -0.11 -2.23 -0.10 0.00 -0.22 0.00 0.00 33.01 30.35 2hm9 s GLN 159 CO 0.02 0.14 1.46 0.21 -0.25 0.00 0.00 175.29 176.87 2hm9 s LYS 160 N 0.44 4.25 0.24 2.91 2.20 0.13 -2.95 119.74 126.96 2hm9 s LYS 160 Ca -0.17 2.33 -0.30 0.00 -0.36 0.00 0.00 55.97 57.47 2hm9 s LYS 160 Cb -0.17 -3.11 -0.10 0.00 -1.51 0.00 0.00 37.83 32.94 2hm9 s LYS 160 CO 0.07 -0.45 1.38 0.15 -0.36 0.00 0.00 175.35 176.14 2hm9 s LYS 161 N -0.30 4.32 0.00 4.03 1.02 -1.26 -4.97 119.74 122.59 2hm9 s LYS 161 Ca 0.60 2.20 0.28 0.00 0.02 0.00 0.00 55.97 59.07 2hm9 s LYS 161 Cb -0.42 -3.14 1.00 0.00 -0.52 0.00 0.00 37.83 34.74 2hm9 s LYS 161 CO 0.43 -0.33 1.72 0.00 -0.92 0.00 0.00 175.35 176.24