#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 1.25 -0.26 2.41 0.00 0.39 -3.03 121.76 122.52 2hm9 s ALA 2 Ca 0.00 -0.82 -0.07 0.00 0.00 0.00 0.00 51.96 51.07 2hm9 s ALA 2 Cb 0.00 -0.22 -0.02 0.00 0.00 0.00 0.00 23.12 22.88 2hm9 s ALA 2 CO 0.00 0.25 0.07 -0.06 0.00 0.00 0.00 175.76 176.02 2hm9 s PHE 3 N -0.76 3.09 -0.22 0.00 0.40 0.40 0.11 117.98 121.00 2hm9 s PHE 3 Ca 0.03 -0.60 0.02 0.00 -0.60 0.00 0.00 56.93 55.78 2hm9 s PHE 3 Cb -0.08 -2.24 0.04 0.00 0.51 0.00 0.00 43.02 41.26 2hm9 s PHE 3 CO 0.01 -0.43 -0.13 -1.17 0.70 0.00 0.00 175.22 174.20 2hm9 s LEU 4 N 1.58 2.80 0.17 -0.37 2.96 -1.06 0.12 118.68 124.88 2hm9 s LEU 4 Ca 0.05 -1.07 -0.19 0.00 -0.22 0.00 0.00 54.13 52.71 2hm9 s LEU 4 Cb -0.16 -1.46 0.04 0.00 0.50 0.00 0.00 46.19 45.12 2hm9 s LEU 4 CO 0.03 -0.12 0.52 -1.66 -1.32 0.00 0.00 176.35 173.80 2hm9 s TRP 5 N 1.22 -0.29 -0.03 5.38 -2.14 -1.09 -4.42 118.94 117.56 2hm9 s TRP 5 Ca -0.03 -0.00 0.05 0.00 2.66 0.00 0.00 56.10 58.78 2hm9 s TRP 5 Cb -0.17 0.43 -0.01 0.00 -3.10 0.00 0.00 33.47 30.62 2hm9 s TRP 5 CO -0.08 -0.85 -0.19 0.00 -2.66 0.00 0.00 176.95 173.17 2hm9 s ALA 6 N -3.81 1.68 0.04 2.67 0.00 -1.26 -2.26 121.76 118.81 2hm9 s ALA 6 Ca 0.05 -0.81 -0.02 0.00 0.00 0.00 0.00 51.96 51.17 2hm9 s ALA 6 Cb -0.00 -0.49 -0.03 0.00 0.00 0.00 0.00 23.12 22.59 2hm9 s ALA 6 CO -0.09 0.35 0.00 1.14 0.00 0.00 0.00 175.76 177.17 2hm9 s GLN 7 N -0.21 0.52 0.81 0.00 -2.07 0.13 -4.68 119.66 114.16 2hm9 s GLN 7 Ca 0.01 -0.94 -0.09 0.00 -1.82 0.00 0.00 55.36 52.52 2hm9 s GLN 7 Cb -0.10 0.19 0.13 0.00 -1.09 0.00 0.00 33.01 32.13 2hm9 s GLN 7 CO 0.01 -0.10 1.14 0.16 -1.32 0.00 0.00 175.29 175.18 2hm9 s ASP 8 N -2.32 4.06 0.20 12.60 1.47 -0.93 -2.67 116.67 129.09 2hm9 s ASP 8 Ca -0.02 0.24 -0.11 0.00 1.18 0.00 0.00 52.55 53.83 2hm9 s ASP 8 Cb 0.01 -0.59 0.14 0.00 -0.34 0.00 0.00 42.92 42.14 2hm9 s ASP 8 CO -0.06 -2.10 1.86 0.08 0.68 0.00 0.00 175.17 175.63 2hm9 h ARG 9 N -1.01 0.96 -0.83 2.11 0.11 -1.71 -2.74 114.38 111.29 2hm9 h ARG 9 Ca -0.43 -0.07 0.01 0.00 0.10 0.00 0.00 59.98 59.59 2hm9 h ARG 9 Cb 1.28 -0.21 -0.04 0.00 1.11 0.00 0.00 29.97 32.11 2hm9 h ARG 9 CO 0.48 0.66 0.55 -0.44 0.10 0.00 0.00 179.97 181.32 2hm9 h ASP 10 N 0.98 0.94 0.00 0.08 3.32 -1.90 -3.46 116.42 116.37 2hm9 h ASP 10 Ca 0.26 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.29 2hm9 h ASP 10 Cb -0.07 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.25 2hm9 h ASP 10 CO -0.05 0.68 0.00 0.61 -1.72 0.00 0.00 179.24 178.75 2hm9 n GLY 11 N -1.33 0.76 3.88 2.75 0.00 -1.03 -5.13 105.19 105.09 2hm9 n GLY 11 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 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 4.39 -0.07 0.99 0.20 -1.26 -2.78 118.68 120.15 2hm9 s LEU 12 Ca 0.00 0.51 0.02 0.00 0.69 0.00 0.00 54.13 55.35 2hm9 s LEU 12 Cb 0.00 -2.42 -0.25 0.00 -0.43 0.00 0.00 46.19 43.09 2hm9 s LEU 12 CO 0.00 0.32 0.56 0.16 -0.29 0.00 0.00 176.35 177.11 2hm9 h ILE 13 N 3.41 0.79 0.00 6.68 3.07 -1.79 -2.47 117.51 127.20 2hm9 h ILE 13 Ca -0.52 -2.56 0.00 0.00 1.55 0.00 0.00 64.86 63.33 2hm9 h ILE 13 Cb 1.21 2.50 0.00 0.00 -0.27 0.00 0.00 36.82 40.26 2hm9 h ILE 13 CO 0.63 0.71 0.00 0.61 -1.05 0.00 0.00 178.15 179.05 2hm9 n GLY 14 N 1.76 -0.14 2.89 0.16 0.00 -1.10 -4.58 105.19 104.18 2hm9 n GLY 14 Ca -0.23 -0.48 -0.24 0.00 0.00 0.00 0.00 46.02 45.07 2hm9 n GLY 14 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2hm9 s LYS 15 N -0.31 1.16 -2.01 1.61 2.20 -1.23 -1.18 119.74 119.97 2hm9 s LYS 15 Ca 0.00 -0.16 0.00 0.00 -0.36 0.00 0.00 55.97 55.45 2hm9 s LYS 15 Cb 0.00 -1.21 0.00 0.00 -1.51 0.00 0.00 37.83 35.11 2hm9 s LYS 15 CO 0.00 -0.17 0.00 -0.25 -0.36 0.00 0.00 175.35 174.57 2hm9 n ASP 16 N 4.53 -5.35 0.00 1.43 8.00 -1.26 -2.35 116.55 121.56 2hm9 n ASP 16 Ca -0.17 0.43 0.00 0.00 0.71 0.00 0.00 54.79 55.76 2hm9 n ASP 16 Cb 0.51 -4.54 0.00 0.00 -0.02 0.00 0.00 41.12 37.07 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 2.83 3.70 0.44 0.00 -1.26 -4.80 105.19 105.47 2hm9 n GLY 17 Ca -0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 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 -1.42 3.40 -0.26 1.61 -3.43 -0.99 -4.87 115.29 109.33 2hm9 s HIS 18 Ca 0.00 1.35 -0.29 0.00 -0.80 0.00 0.00 55.06 55.31 2hm9 s HIS 18 Cb 0.00 -3.37 -0.06 0.00 -1.43 0.00 0.00 32.58 27.72 2hm9 s HIS 18 CO 0.00 -1.06 2.23 1.28 -2.00 0.00 0.00 174.74 175.19 2hm9 n LEU 19 N 4.31 2.98 0.10 5.38 4.77 -1.26 -3.53 117.00 129.75 2hm9 n LEU 19 Ca 0.09 0.21 -0.01 0.00 -0.03 0.00 0.00 56.01 56.27 2hm9 n LEU 19 Cb 0.47 -1.50 -0.04 0.00 -2.33 0.00 0.00 43.42 40.03 2hm9 n LEU 19 CO 0.55 -0.73 0.28 1.55 -1.33 0.00 0.00 177.39 177.71 2hm9 h PRO 20 N 14.71 0.00 -6.72 3.23 0.13 -1.91 -3.46 132.00 137.99 2hm9 h PRO 20 Ca -0.37 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.26 2hm9 h PRO 20 Cb 1.26 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.37 2hm9 h PRO 20 CO 0.98 0.66 0.31 1.67 -0.23 0.00 0.00 178.00 181.38 2hm9 s TRP 21 N -2.86 3.92 -0.32 1.56 -2.14 -1.26 -5.02 118.94 112.83 2hm9 s TRP 21 Ca 0.02 1.83 -0.26 0.00 2.66 0.00 0.00 56.10 60.36 2hm9 s TRP 21 Cb 0.08 -2.92 0.01 0.00 -3.10 0.00 0.00 33.47 27.54 2hm9 s TRP 21 CO 0.78 0.44 0.90 -1.58 -2.66 0.00 0.00 176.95 174.82 2hm9 s HIS 22 N -1.24 3.18 -0.45 1.66 2.46 -1.26 -4.93 115.29 114.71 2hm9 s HIS 22 Ca 0.41 0.94 0.07 0.00 0.47 0.00 0.00 55.06 56.96 2hm9 s HIS 22 Cb -0.24 -3.42 0.27 0.00 -0.13 0.00 0.00 32.58 29.06 2hm9 s HIS 22 CO 0.29 -0.66 0.87 -0.11 -2.47 0.00 0.00 174.74 172.66 2hm9 n LEU 23 N 6.48 -1.80 -0.32 8.88 7.94 -1.26 -4.91 117.00 132.00 2hm9 n LEU 23 Ca 0.07 -3.85 0.23 0.00 -1.11 0.00 0.00 56.01 51.35 2hm9 n LEU 23 Cb 0.48 0.82 0.45 0.00 0.53 0.00 0.00 43.42 45.69 2hm9 n LEU 23 CO 0.54 2.07 1.01 -0.65 -1.11 0.00 0.00 177.39 179.25 2hm9 h PRO 24 N 3.63 0.14 -0.02 1.96 0.11 -1.99 0.73 132.00 136.56 2hm9 h PRO 24 Ca -0.07 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 66.06 2hm9 h PRO 24 Cb 1.01 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.05 2hm9 h PRO 24 CO 0.32 0.09 -0.23 0.22 -0.21 0.00 0.00 178.00 178.19 2hm9 h ASP 25 N 0.14 -0.70 -0.32 -2.05 3.58 -1.97 0.12 116.42 115.22 2hm9 h ASP 25 Ca 0.72 0.10 -0.07 0.00 0.42 0.00 0.00 57.03 58.20 2hm9 h ASP 25 Cb 1.69 0.29 -0.02 0.00 1.72 0.00 0.00 39.33 43.01 2hm9 h ASP 25 CO -0.72 -0.30 -0.01 -0.78 -2.88 0.00 0.00 179.24 174.54 2hm9 h ASP 26 N -0.35 0.64 -0.67 2.28 1.82 -1.28 -2.43 116.42 116.43 2hm9 h ASP 26 Ca 0.07 -0.15 -0.03 0.00 -0.39 0.00 0.00 57.03 56.53 2hm9 h ASP 26 Cb 0.45 -0.17 -0.03 0.00 0.68 0.00 0.00 39.33 40.26 2hm9 h ASP 26 CO -0.23 0.72 0.29 -0.07 -1.61 0.00 0.00 179.24 178.34 2hm9 h LEU 27 N 0.64 0.90 -0.93 2.28 3.38 -0.62 -2.22 115.31 118.74 2hm9 h LEU 27 Ca 0.13 -0.16 0.03 0.00 0.09 0.00 0.00 57.88 57.97 2hm9 h LEU 27 Cb 0.42 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.88 2hm9 h LEU 27 CO 0.02 0.81 0.61 0.45 0.09 0.00 0.00 178.44 180.42 2hm9 h HIS 28 N 0.94 1.15 -0.32 1.13 3.86 -0.44 -1.66 115.15 119.82 2hm9 h HIS 28 Ca 0.22 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.47 2hm9 h HIS 28 Cb 0.18 -0.39 -0.02 0.00 1.06 0.00 0.00 27.41 28.24 2hm9 h HIS 28 CO 0.01 0.69 0.21 -0.92 0.86 0.00 0.00 177.93 178.77 2hm9 h TYR 29 N 1.21 0.39 -0.30 2.45 3.20 -0.95 0.84 116.97 123.81 2hm9 h TYR 29 Ca 0.36 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.24 2hm9 h TYR 29 Cb -0.05 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.08 2hm9 h TYR 29 CO -0.01 0.24 0.16 0.35 -1.64 0.00 0.00 178.16 177.27 2hm9 h PHE 30 N 0.42 0.41 -0.58 -3.82 3.57 -0.90 -1.67 116.94 114.38 2hm9 h PHE 30 Ca 0.12 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.59 2hm9 h PHE 30 Cb -0.04 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.54 2hm9 h PHE 30 CO -0.06 0.34 0.29 -0.09 -2.23 0.00 0.00 178.31 176.56 2hm9 h ARG 31 N 0.37 0.82 -0.70 1.11 1.12 -1.08 -2.68 114.38 113.34 2hm9 h ARG 31 Ca 0.11 -0.11 -0.06 0.00 -1.11 0.00 0.00 59.98 58.81 2hm9 h ARG 31 Cb 0.06 -0.15 -0.03 0.00 -0.01 0.00 0.00 29.97 29.84 2hm9 h ARG 31 CO -0.02 0.65 0.22 0.00 -3.11 0.00 0.00 179.97 177.71 2hm9 h ALA 32 N 1.12 1.06 -0.14 2.80 0.00 -0.69 -2.75 119.26 120.67 2hm9 h ALA 32 Ca 0.20 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 2hm9 h ALA 32 Cb 0.09 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2hm9 h ALA 32 CO -0.03 0.64 -0.19 1.96 0.00 0.00 0.00 179.25 181.63 2hm9 h GLN 33 N 1.04 0.23 -0.16 0.00 1.08 -1.08 -2.37 115.11 113.85 2hm9 h GLN 33 Ca 0.23 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.36 2hm9 h GLN 33 Cb 0.29 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.70 2hm9 h GLN 33 CO -0.01 0.42 0.00 0.25 -0.95 0.00 0.00 178.83 178.54 2hm9 n THR 34 N -4.22 0.21 -2.93 -0.54 -2.24 -1.03 -4.77 114.28 98.75 2hm9 n THR 34 Ca -0.01 -0.23 -0.41 0.00 -2.27 0.00 0.00 64.05 61.13 2hm9 n THR 34 Cb 0.31 0.10 -0.04 0.00 -2.10 0.00 0.00 70.33 68.60 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 -1.79 4.90 -0.20 2.28 -7.23 -0.90 -3.60 120.40 113.86 2hm9 s VAL 35 Ca 0.17 1.54 0.00 0.00 -1.81 0.00 0.00 61.98 61.88 2hm9 s VAL 35 Cb 0.09 -4.10 0.00 0.00 0.56 0.00 0.00 36.38 32.93 2hm9 s VAL 35 CO 0.13 0.03 0.00 0.61 -0.31 0.00 0.00 175.10 175.56 2hm9 n GLY 36 N 3.56 0.54 3.06 2.32 0.00 -1.26 -5.03 105.19 108.38 2hm9 n GLY 36 Ca 0.03 -0.81 -0.08 0.00 0.00 0.00 0.00 46.02 45.16 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 -1.86 0.52 0.00 1.61 1.02 -1.24 -4.83 119.74 114.97 2hm9 s LYS 37 Ca 0.00 -1.00 -0.30 0.00 0.02 0.00 0.00 55.97 54.69 2hm9 s LYS 37 Cb 0.00 0.12 -0.03 0.00 -0.52 0.00 0.00 37.83 37.40 2hm9 s LYS 37 CO 0.00 -0.07 1.00 0.42 -0.92 0.00 0.00 175.35 175.77 2hm9 s ILE 38 N -2.94 4.80 0.04 2.17 1.01 -0.32 -4.19 121.20 121.77 2hm9 s ILE 38 Ca -0.01 2.01 0.04 0.00 0.00 0.00 0.00 60.65 62.69 2hm9 s ILE 38 Cb 0.01 -4.29 -0.02 0.00 0.01 0.00 0.00 42.46 38.17 2hm9 s ILE 38 CO -0.06 0.15 -0.12 -0.32 0.00 0.00 0.00 174.94 174.59 2hm9 s MET 39 N 1.06 0.78 -0.12 2.79 1.75 -1.12 0.10 119.30 124.54 2hm9 s MET 39 Ca 0.52 -0.74 0.03 0.00 -1.25 0.00 0.00 55.69 54.25 2hm9 s MET 39 Cb -0.22 -0.74 -0.00 0.00 2.84 0.00 0.00 34.83 36.72 2hm9 s MET 39 CO 0.28 0.17 -0.21 0.08 -0.65 0.00 0.00 175.02 174.69 2hm9 s VAL 40 N -0.97 2.27 -0.08 10.11 1.01 0.10 -1.05 120.40 131.80 2hm9 s VAL 40 Ca -0.01 -0.93 0.03 0.00 0.00 0.00 0.00 61.98 61.07 2hm9 s VAL 40 Cb -0.08 -1.90 0.00 0.00 0.00 0.00 0.00 36.38 34.41 2hm9 s VAL 40 CO 0.01 0.55 -0.19 0.68 0.00 0.00 0.00 175.10 176.15 2hm9 s VAL 41 N 0.48 1.62 1.04 2.92 -7.23 -0.50 -0.33 120.40 118.41 2hm9 s VAL 41 Ca -0.14 -0.77 -0.12 0.00 -1.81 0.00 0.00 61.98 59.14 2hm9 s VAL 41 Cb -0.17 -1.42 0.21 0.00 0.56 0.00 0.00 36.38 35.57 2hm9 s VAL 41 CO 0.05 0.46 1.07 -0.83 -0.31 0.00 0.00 175.10 175.55 2hm9 s GLY 42 N 0.42 1.57 0.18 2.32 0.00 0.29 -1.15 107.32 110.95 2hm9 s GLY 42 Ca -0.15 -0.24 -0.12 0.00 0.00 0.00 0.00 44.72 44.21 2hm9 s GLY 42 CO 0.06 0.39 1.83 -0.09 0.00 0.00 0.00 173.10 175.29 2hm9 h ARG 43 N -2.10 0.84 -0.71 2.90 1.12 -1.79 -1.04 114.38 113.59 2hm9 h ARG 43 Ca -0.56 -0.07 0.01 0.00 -1.11 0.00 0.00 59.98 58.24 2hm9 h ARG 43 Cb 1.33 -0.18 -0.04 0.00 -0.01 0.00 0.00 29.97 31.07 2hm9 h ARG 43 CO 0.55 0.60 0.47 0.00 -3.11 0.00 0.00 179.97 178.47 2hm9 h ARG 44 N 0.84 0.93 -0.27 0.20 3.08 -1.91 -2.01 114.38 115.23 2hm9 h ARG 44 Ca 0.22 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.20 2hm9 h ARG 44 Cb -0.03 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.80 2hm9 h ARG 44 CO -0.04 0.61 0.10 1.15 -1.07 0.00 0.00 179.97 180.73 2hm9 h THR 45 N 0.96 1.18 -0.69 2.04 2.02 -1.63 -1.81 112.91 114.98 2hm9 h THR 45 Ca 0.26 -0.55 0.14 0.00 0.77 0.00 0.00 66.41 67.03 2hm9 h THR 45 Cb -0.11 1.03 -0.13 0.00 -1.74 0.00 0.00 68.15 67.20 2hm9 h THR 45 CO -0.06 0.18 -0.20 0.22 0.37 0.00 0.00 175.52 176.03 2hm9 h TYR 46 N 0.29 -0.47 0.00 3.16 3.20 -0.46 1.20 116.97 123.89 2hm9 h TYR 46 Ca 0.09 0.07 -0.09 0.00 3.14 0.00 0.00 58.73 61.94 2hm9 h TYR 46 Cb 0.19 0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.76 2hm9 h TYR 46 CO -0.01 -0.32 -0.43 0.93 -1.64 0.00 0.00 178.16 176.70 2hm9 h GLU 47 N -0.03 0.00 0.00 1.82 4.39 -1.42 -2.88 114.58 116.46 2hm9 h GLU 47 Ca 0.32 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.02 2hm9 h GLU 47 Cb 0.52 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.17 2hm9 h GLU 47 CO -0.72 0.43 -0.21 0.77 -1.16 0.00 0.00 179.01 178.12 2hm9 h SER 48 N 0.00 0.00 -4.16 1.42 0.02 0.94 -3.47 113.55 108.31 2hm9 h SER 48 Ca -0.00 -0.02 -0.54 0.00 -0.84 0.00 0.00 61.79 60.39 2hm9 h SER 48 Cb 0.86 0.00 0.15 0.00 0.14 0.00 0.00 62.40 63.55 2hm9 h SER 48 CO 0.06 0.01 0.42 0.12 -1.14 0.00 0.00 176.83 176.29 2hm9 s PHE 49 N -3.20 2.12 -0.08 3.45 5.36 0.36 -4.82 117.98 121.17 2hm9 s PHE 49 Ca 0.07 1.57 -0.26 0.00 -0.96 0.00 0.00 56.93 57.35 2hm9 s PHE 49 Cb 0.08 -3.49 -0.21 0.00 -0.34 0.00 0.00 43.02 39.06 2hm9 s PHE 49 CO 0.67 -2.57 0.96 -1.00 -1.46 0.00 0.00 175.22 171.83 2hm9 h PRO 50 N -0.04 -0.03 -2.00 10.12 0.13 -1.90 -3.47 132.00 134.80 2hm9 h PRO 50 Ca -0.48 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.69 2hm9 h PRO 50 Cb 1.30 0.01 -0.21 0.00 0.13 0.00 0.00 31.00 32.23 2hm9 h PRO 50 CO 0.51 0.65 -0.04 0.15 -0.23 0.00 0.00 178.00 179.04 2hm9 s LYS 51 N -3.19 0.66 0.09 0.86 -0.14 -1.26 -5.17 119.74 111.59 2hm9 s LYS 51 Ca -0.16 1.31 0.04 0.00 -1.36 0.00 0.00 55.97 55.80 2hm9 s LYS 51 Cb -0.01 0.41 -0.03 0.00 -1.68 0.00 0.00 37.83 36.52 2hm9 s LYS 51 CO 0.63 -0.17 -0.11 1.03 -0.76 0.00 0.00 175.35 175.98 2hm9 s ARG 52 N 2.10 0.81 0.51 1.68 3.00 -1.26 -4.60 118.95 121.20 2hm9 s ARG 52 Ca -0.09 -1.09 0.02 0.00 0.00 0.00 0.00 55.73 54.58 2hm9 s ARG 52 Cb -0.08 -0.56 0.02 0.00 0.00 0.00 0.00 34.95 34.34 2hm9 s ARG 52 CO -0.20 0.10 0.73 -1.25 0.00 0.00 0.00 175.30 174.68 2hm9 s PRO 53 N -2.51 2.67 0.27 3.54 0.04 -1.26 -4.96 135.00 132.78 2hm9 s PRO 53 Ca 0.03 -0.80 -0.22 0.00 0.04 0.00 0.00 61.00 60.05 2hm9 s PRO 53 Cb -0.05 -2.54 -0.09 0.00 0.04 0.00 0.00 34.50 31.86 2hm9 s PRO 53 CO 0.00 -0.58 0.81 -0.51 0.04 0.00 0.00 177.00 176.77 2hm9 s LEU 54 N -4.67 4.32 -0.09 -3.56 1.43 -1.26 -5.03 118.68 109.82 2hm9 s LEU 54 Ca 0.55 1.57 -0.30 0.00 -1.03 0.00 0.00 54.13 54.93 2hm9 s LEU 54 Cb -0.10 -3.79 -0.01 0.00 0.03 0.00 0.00 46.19 42.31 2hm9 s LEU 54 CO 0.37 -0.02 1.00 -2.16 0.23 0.00 0.00 176.35 175.77 2hm9 s PRO 55 N -2.08 4.44 -0.99 1.29 0.04 -1.26 -3.47 135.00 132.98 2hm9 s PRO 55 Ca 0.47 1.40 0.00 0.00 0.04 0.00 0.00 61.00 62.90 2hm9 s PRO 55 Cb -0.17 -3.53 0.00 0.00 0.04 0.00 0.00 34.50 30.84 2hm9 s PRO 55 CO 0.22 -0.27 0.00 0.39 0.04 0.00 0.00 177.00 177.37 2hm9 n GLU 56 N 4.84 -0.79 -4.53 4.56 1.02 -1.26 -5.00 120.64 119.47 2hm9 n GLU 56 Ca 0.08 0.66 -0.23 0.00 -0.02 0.00 0.00 57.16 57.65 2hm9 n GLU 56 Cb 0.49 -4.68 -0.16 0.00 -0.02 0.00 0.00 31.44 27.07 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 -3.86 1.39 -0.77 3.49 1.81 -1.23 -4.47 118.95 115.32 2hm9 s ARG 57 Ca 0.00 -0.39 -0.22 0.00 -1.72 0.00 0.00 55.73 53.40 2hm9 s ARG 57 Cb 0.00 -1.21 0.08 0.00 -0.45 0.00 0.00 34.95 33.36 2hm9 s ARG 57 CO 0.00 0.09 1.10 0.99 -0.68 0.00 0.00 175.30 176.80 2hm9 s THR 58 N 0.40 4.29 -0.09 0.02 2.01 -1.26 -4.72 115.64 116.28 2hm9 s THR 58 Ca -0.08 -0.58 -0.06 0.00 0.31 0.00 0.00 61.69 61.28 2hm9 s THR 58 Cb -0.12 -4.78 -0.04 0.00 0.01 0.00 0.00 72.50 67.56 2hm9 s THR 58 CO 0.02 -1.58 0.14 0.20 -0.69 0.00 0.00 174.62 172.71 2hm9 s ASN 59 N 3.83 6.34 -0.08 3.53 -0.87 -1.26 -2.81 114.94 123.62 2hm9 s ASN 59 Ca 0.29 0.43 0.03 0.00 -1.57 0.00 0.00 52.86 52.04 2hm9 s ASN 59 Cb -0.11 -2.03 0.01 0.00 -0.02 0.00 0.00 41.25 39.10 2hm9 s ASN 59 CO 0.04 0.37 -0.16 -0.69 -2.57 0.00 0.00 177.10 174.10 2hm9 s VAL 60 N -1.10 1.42 -0.30 1.60 1.01 -0.21 -0.61 120.40 122.22 2hm9 s VAL 60 Ca 0.18 -0.64 -0.15 0.00 0.00 0.00 0.00 61.98 61.37 2hm9 s VAL 60 Cb -0.12 -1.27 -0.03 0.00 0.00 0.00 0.00 36.38 34.96 2hm9 s VAL 60 CO 0.07 0.42 0.36 -0.69 0.00 0.00 0.00 175.10 175.27 2hm9 s VAL 61 N 0.58 5.17 -0.17 2.92 1.01 0.59 -1.41 120.40 129.09 2hm9 s VAL 61 Ca -0.16 0.37 -0.04 0.00 0.00 0.00 0.00 61.98 62.15 2hm9 s VAL 61 Cb -0.16 -3.74 -0.03 0.00 0.00 0.00 0.00 36.38 32.45 2hm9 s VAL 61 CO 0.05 0.07 -0.02 -0.22 0.00 0.00 0.00 175.10 174.98 2hm9 s LEU 62 N 2.05 3.26 0.09 3.92 0.20 -0.30 -1.75 118.68 126.15 2hm9 s LEU 62 Ca 0.14 -0.15 0.04 0.00 0.69 0.00 0.00 54.13 54.84 2hm9 s LEU 62 Cb -0.16 -1.80 -0.03 0.00 -0.43 0.00 0.00 46.19 43.76 2hm9 s LEU 62 CO 0.11 0.13 -0.11 0.28 -0.29 0.00 0.00 176.35 176.46 2hm9 s THR 63 N 0.63 0.99 0.14 3.68 -1.32 -1.18 -2.34 115.64 116.24 2hm9 s THR 63 Ca -0.01 -1.48 -0.12 0.00 -1.21 0.00 0.00 61.69 58.86 2hm9 s THR 63 Cb -0.14 -1.20 0.01 0.00 -1.51 0.00 0.00 72.50 69.65 2hm9 s THR 63 CO 0.02 -0.42 1.58 -0.74 -2.21 0.00 0.00 174.62 172.85 2hm9 h HIS 64 N 3.89 0.94 -2.84 9.09 2.76 -1.90 -3.40 115.15 123.68 2hm9 h HIS 64 Ca -0.38 -0.18 -0.65 0.00 -2.20 0.00 0.00 60.37 56.96 2hm9 h HIS 64 Cb 1.19 -0.24 -0.08 0.00 1.55 0.00 0.00 27.41 29.83 2hm9 h HIS 64 CO 0.64 0.91 -0.47 1.14 -1.30 0.00 0.00 177.93 178.84 2hm9 s GLN 65 N -4.94 3.68 0.00 5.26 -2.07 -1.26 -4.98 119.66 115.35 2hm9 s GLN 65 Ca -0.12 -0.14 0.26 0.00 -1.82 0.00 0.00 55.36 53.54 2hm9 s GLN 65 Cb 0.11 -3.26 1.56 0.00 -1.09 0.00 0.00 33.01 30.33 2hm9 s GLN 65 CO 0.82 0.63 1.93 -0.85 -1.32 0.00 0.00 175.29 176.50 2hm9 n GLU 66 N 2.46 0.85 0.00 9.60 0.28 -1.26 -3.11 120.64 129.46 2hm9 n GLU 66 Ca -0.19 0.00 0.14 0.00 -0.16 0.00 0.00 57.16 56.96 2hm9 n GLU 66 Cb 0.54 -1.48 0.57 0.00 1.43 0.00 0.00 31.44 32.50 2hm9 n GLU 66 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2hm9 n ASP 67 N -0.98 1.20 -4.65 -1.84 9.92 -1.26 -4.84 116.55 114.10 2hm9 n ASP 67 Ca 0.20 -1.32 -0.35 0.00 -0.53 0.00 0.00 54.79 52.79 2hm9 n ASP 67 Cb 0.09 0.01 -0.09 0.00 -0.64 0.00 0.00 41.12 40.48 2hm9 n ASP 67 CO 0.00 0.00 0.00 -0.47 0.13 0.00 0.00 177.20 176.86 2hm9 s TYR 68 N -2.08 3.27 -0.12 1.24 6.14 -1.18 -5.09 117.35 119.53 2hm9 s TYR 68 Ca 0.37 0.10 -0.01 0.00 0.64 0.00 0.00 57.07 58.18 2hm9 s TYR 68 Cb 0.21 -2.10 -0.03 0.00 0.42 0.00 0.00 41.96 40.47 2hm9 s TYR 68 CO 0.37 0.16 -0.07 -0.65 0.64 0.00 0.00 175.55 176.00 2hm9 s GLN 69 N 0.40 3.28 0.02 4.97 -0.21 -1.26 -4.99 119.66 121.87 2hm9 s GLN 69 Ca 0.04 -0.56 0.06 0.00 0.02 0.00 0.00 55.36 54.91 2hm9 s GLN 69 Cb -0.12 -2.74 -0.02 0.00 1.00 0.00 0.00 33.01 31.13 2hm9 s GLN 69 CO -0.00 0.39 -0.17 0.00 -2.12 0.00 0.00 175.29 173.39 2hm9 s ALA 70 N -0.07 1.41 0.10 6.09 0.00 -1.26 -5.15 121.76 122.87 2hm9 s ALA 70 Ca 0.01 -0.82 0.04 0.00 0.00 0.00 0.00 51.96 51.18 2hm9 s ALA 70 Cb -0.13 -0.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.65 2hm9 s ALA 70 CO 0.03 0.32 0.07 -0.65 0.00 0.00 0.00 175.76 175.53 2hm9 s GLN 71 N -0.78 2.80 0.00 0.00 -0.21 -1.26 -4.52 119.66 115.68 2hm9 s GLN 71 Ca 0.05 -0.77 0.00 0.00 0.02 0.00 0.00 55.36 54.66 2hm9 s GLN 71 Cb -0.07 -2.66 0.00 0.00 1.00 0.00 0.00 33.01 31.28 2hm9 s GLN 71 CO 0.00 0.54 0.00 0.41 -2.12 0.00 0.00 175.29 174.12 2hm9 n GLY 72 N 0.30 3.32 3.00 3.09 0.00 -1.26 -4.79 105.19 108.85 2hm9 n GLY 72 Ca -0.09 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.33 -0.31 0.26 4.61 0.00 -1.26 -4.57 121.76 118.17 2hm9 s ALA 73 Ca 0.00 0.33 -0.31 0.00 0.00 0.00 0.00 51.96 51.98 2hm9 s ALA 73 Cb 0.00 -0.19 -0.12 0.00 0.00 0.00 0.00 23.12 22.80 2hm9 s ALA 73 CO 0.00 -0.06 1.57 0.28 0.00 0.00 0.00 175.76 177.54 2hm9 n VAL 74 N 2.96 0.76 -3.42 0.00 0.31 0.22 -3.61 118.33 115.56 2hm9 n VAL 74 Ca -0.13 -0.19 -0.41 0.00 -0.01 0.00 0.00 64.34 63.61 2hm9 n VAL 74 Cb 0.59 -1.81 -0.09 0.00 -0.91 0.00 0.00 33.84 31.61 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 0.24 5.18 -0.09 2.52 1.01 -1.25 0.22 120.40 128.23 2hm9 s VAL 75 Ca 0.68 0.06 0.03 0.00 0.00 0.00 0.00 61.98 62.74 2hm9 s VAL 75 Cb -0.55 -3.80 0.01 0.00 0.00 0.00 0.00 36.38 32.04 2hm9 s VAL 75 CO 0.45 -0.06 -0.17 0.68 0.00 0.00 0.00 175.10 176.00 2hm9 s VAL 76 N 1.99 1.55 -1.86 2.92 -7.23 -0.72 -4.98 120.40 112.08 2hm9 s VAL 76 Ca 0.11 -0.71 0.18 0.00 -1.81 0.00 0.00 61.98 59.75 2hm9 s VAL 76 Cb -0.17 -1.38 0.05 0.00 0.56 0.00 0.00 36.38 35.44 2hm9 s VAL 76 CO 0.11 0.45 0.97 1.41 -0.31 0.00 0.00 175.10 177.73 2hm9 n HIS 77 N 3.78 0.00 -3.87 2.82 -0.00 -1.26 -3.12 115.22 113.57 2hm9 n HIS 77 Ca -0.21 0.00 -0.35 0.00 -0.00 0.00 0.00 57.72 57.16 2hm9 n HIS 77 Cb 0.52 0.00 -0.09 0.00 -0.00 0.00 0.00 29.99 30.42 2hm9 n HIS 77 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 2hm9 s ASP 78 N -1.87 5.87 0.17 0.41 1.01 -1.26 -4.88 116.67 116.11 2hm9 s ASP 78 Ca 0.17 0.13 -0.13 0.00 0.71 0.00 0.00 52.55 53.43 2hm9 s ASP 78 Cb 0.15 -2.02 0.07 0.00 1.01 0.00 0.00 42.92 42.12 2hm9 s ASP 78 CO 0.37 0.16 1.74 0.58 0.21 0.00 0.00 175.17 178.23 2hm9 h VAL 79 N 4.84 1.21 -0.53 -1.27 2.07 -1.97 -2.37 116.25 118.23 2hm9 h VAL 79 Ca -0.38 -0.62 -0.04 0.00 0.82 0.00 0.00 66.70 66.48 2hm9 h VAL 79 Cb 1.16 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 31.47 2hm9 h VAL 79 CO 0.71 0.24 0.17 0.00 0.02 0.00 0.00 177.57 178.72 2hm9 h ALA 80 N 1.10 1.30 -0.66 1.67 0.00 -2.00 -2.59 119.26 118.07 2hm9 h ALA 80 Ca 0.19 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 2hm9 h ALA 80 Cb 0.14 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2hm9 h ALA 80 CO -0.02 0.51 0.27 0.00 0.00 0.00 0.00 179.25 180.00 2hm9 h ALA 81 N 1.41 1.22 -0.57 0.00 0.00 -1.85 -1.33 119.26 118.15 2hm9 h ALA 81 Ca 0.18 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 2hm9 h ALA 81 Cb 0.22 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2hm9 h ALA 81 CO -0.01 0.57 0.22 0.28 0.00 0.00 0.00 179.25 180.31 2hm9 h VAL 82 N 0.95 1.23 -0.39 0.00 2.07 -1.12 -0.38 116.25 118.61 2hm9 h VAL 82 Ca 0.22 -0.72 -0.00 0.00 0.82 0.00 0.00 66.70 67.02 2hm9 h VAL 82 Cb 0.18 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 2hm9 h VAL 82 CO -0.02 0.28 0.23 -0.26 0.02 0.00 0.00 177.57 177.82 2hm9 h PHE 83 N 0.79 0.51 -0.56 1.57 0.04 -1.28 -2.64 116.94 115.37 2hm9 h PHE 83 Ca 0.19 -0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.92 2hm9 h PHE 83 Cb 0.22 -0.17 -0.03 0.00 2.20 0.00 0.00 35.95 38.17 2hm9 h PHE 83 CO 0.01 0.37 0.20 0.00 -0.60 0.00 0.00 178.31 178.29 2hm9 h ALA 84 N 1.10 1.29 -0.31 2.45 0.00 -0.97 -2.31 119.26 120.51 2hm9 h ALA 84 Ca 0.14 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.89 2hm9 h ALA 84 Cb 0.01 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 2hm9 h ALA 84 CO -0.03 0.52 0.19 -0.92 0.00 0.00 0.00 179.25 179.01 2hm9 h TYR 85 N 0.81 0.36 -0.57 0.00 5.03 -0.71 0.30 116.97 122.19 2hm9 h TYR 85 Ca 0.19 0.01 -0.06 0.00 2.58 0.00 0.00 58.73 61.45 2hm9 h TYR 85 Cb 0.20 -0.12 -0.03 0.00 1.55 0.00 0.00 36.73 38.34 2hm9 h TYR 85 CO 0.01 0.22 0.11 0.00 -1.32 0.00 0.00 178.16 177.18 2hm9 h ALA 86 N 1.13 1.12 -0.48 1.82 0.00 -1.33 -2.10 119.26 119.42 2hm9 h ALA 86 Ca 0.12 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 2hm9 h ALA 86 Cb -0.02 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2hm9 h ALA 86 CO -0.04 0.58 0.09 -0.22 0.00 0.00 0.00 179.25 179.66 2hm9 h LYS 87 N 0.86 0.73 -0.82 0.00 1.63 -0.79 -2.46 116.57 115.71 2hm9 h LYS 87 Ca 0.18 -0.15 -0.04 0.00 -0.85 0.00 0.00 60.65 59.80 2hm9 h LYS 87 Cb 0.35 -0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 31.84 2hm9 h LYS 87 CO 0.00 0.68 0.37 1.96 -3.45 0.00 0.00 179.45 179.01 2hm9 h GLN 88 N 0.70 1.20 -3.14 1.90 4.20 0.24 -3.32 115.11 116.90 2hm9 h GLN 88 Ca 0.15 -0.19 -0.67 0.00 0.06 0.00 0.00 58.65 58.00 2hm9 h GLN 88 Cb 0.30 -0.21 -0.38 0.00 0.30 0.00 0.00 27.48 27.48 2hm9 h GLN 88 CO 0.00 0.94 -0.29 0.72 -0.67 0.00 0.00 178.83 179.54 2hm9 n HIS 89 N -4.29 3.77 0.25 2.96 8.25 -0.93 -4.91 115.22 120.32 2hm9 n HIS 89 Ca 0.08 -4.17 0.08 0.00 -0.26 0.00 0.00 57.72 53.44 2hm9 n HIS 89 Cb 0.16 -0.90 0.63 0.00 1.12 0.00 0.00 29.99 31.00 2hm9 n HIS 89 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 2hm9 h PRO 90 N 5.60 0.03 -0.32 -0.41 0.11 -1.66 -2.27 132.00 133.07 2hm9 h PRO 90 Ca 0.16 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.21 2hm9 h PRO 90 Cb 0.77 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 31.86 2hm9 h PRO 90 CO 0.81 0.02 -0.05 -0.44 -0.21 0.00 0.00 178.00 178.13 2hm9 h ASP 91 N 0.03 0.50 -3.26 -2.05 3.32 -1.90 -3.42 116.42 109.63 2hm9 h ASP 91 Ca 0.01 -0.11 -0.63 0.00 0.02 0.00 0.00 57.03 56.32 2hm9 h ASP 91 Cb 0.00 -0.13 -0.16 0.00 0.22 0.00 0.00 39.33 39.26 2hm9 h ASP 91 CO -0.00 0.60 -0.57 -1.10 -1.72 0.00 0.00 179.24 176.45 2hm9 s GLN 92 N -4.87 3.84 0.47 3.56 1.11 -0.85 -5.10 119.66 117.81 2hm9 s GLN 92 Ca -0.07 -0.35 -0.19 0.00 0.01 0.00 0.00 55.36 54.75 2hm9 s GLN 92 Cb 0.15 -3.15 -0.09 0.00 -1.01 0.00 0.00 33.01 28.91 2hm9 s GLN 92 CO 0.77 0.34 0.98 -1.21 0.01 0.00 0.00 175.29 176.18 2hm9 s GLU 93 N 0.18 4.01 -0.22 2.91 2.02 -1.26 -4.74 118.70 121.60 2hm9 s GLU 93 Ca 0.04 1.14 -0.10 0.00 0.02 0.00 0.00 54.97 56.07 2hm9 s GLU 93 Cb -0.12 -2.14 -0.05 0.00 0.10 0.00 0.00 34.13 31.92 2hm9 s GLU 93 CO 0.01 -0.23 0.13 -1.17 0.02 0.00 0.00 175.26 174.02 2hm9 s LEU 94 N -3.55 4.08 -0.05 1.80 2.96 -1.25 -1.17 118.68 121.50 2hm9 s LEU 94 Ca 0.63 0.14 0.05 0.00 -0.22 0.00 0.00 54.13 54.72 2hm9 s LEU 94 Cb -0.11 -2.07 -0.00 0.00 0.50 0.00 0.00 46.19 44.50 2hm9 s LEU 94 CO 0.20 0.12 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.47 2hm9 s VAL 95 N 0.72 1.66 -0.45 1.68 1.01 0.11 0.15 120.40 125.28 2hm9 s VAL 95 Ca 0.07 -0.84 -0.17 0.00 0.00 0.00 0.00 61.98 61.04 2hm9 s VAL 95 Cb -0.12 -1.42 0.04 0.00 0.00 0.00 0.00 36.38 34.87 2hm9 s VAL 95 CO 0.01 0.47 0.45 -0.63 0.00 0.00 0.00 175.10 175.41 2hm9 s ILE 96 N 0.05 5.09 -0.96 2.22 -1.09 0.30 0.01 121.20 126.81 2hm9 s ILE 96 Ca -0.06 -0.54 0.21 0.00 -2.23 0.00 0.00 60.65 58.03 2hm9 s ILE 96 Cb -0.13 -4.09 0.18 0.00 -1.58 0.00 0.00 42.46 36.84 2hm9 s ILE 96 CO 0.03 -0.51 1.67 0.00 -1.23 0.00 0.00 174.94 174.90 2hm9 n ALA 97 N 5.59 1.95 0.00 9.38 0.00 0.56 -2.56 120.51 135.42 2hm9 n ALA 97 Ca -0.08 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.29 2hm9 n ALA 97 Cb 0.46 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.57 2hm9 n ALA 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2hm9 n GLY 98 N 0.64 0.66 0.00 0.00 0.00 -1.24 -4.89 105.19 100.37 2hm9 n GLY 98 Ca 0.05 -2.27 0.00 0.00 0.00 0.00 0.00 46.02 43.80 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 -0.67 -0.20 0.33 -0.02 0.00 -1.26 0.11 105.19 103.48 2hm9 n GLY 99 Ca 0.00 -1.75 -0.03 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 -1.61 1.23 -0.76 4.61 0.00 -1.94 0.87 119.26 121.66 2hm9 h ALA 100 Ca 0.00 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 2hm9 h ALA 100 Cb 0.00 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 2hm9 h ALA 100 CO 0.00 0.58 0.27 0.37 0.00 0.00 0.00 179.25 180.46 2hm9 h GLN 101 N 1.00 1.15 -0.47 0.00 4.15 -1.98 0.28 115.11 119.24 2hm9 h GLN 101 Ca 0.24 -0.23 -0.06 0.00 0.77 0.00 0.00 58.65 59.37 2hm9 h GLN 101 Cb 0.13 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 27.63 2hm9 h GLN 101 CO -0.03 0.96 0.05 0.82 -1.93 0.00 0.00 178.83 178.70 2hm9 h ILE 102 N 1.11 1.25 -0.53 2.39 1.08 -1.61 -2.36 117.51 118.84 2hm9 h ILE 102 Ca 0.25 -0.98 -0.00 0.00 -0.39 0.00 0.00 64.86 63.74 2hm9 h ILE 102 Cb 0.27 0.96 -0.03 0.00 -3.07 0.00 0.00 36.82 34.95 2hm9 h ILE 102 CO -0.01 0.34 0.31 -0.26 -0.69 0.00 0.00 178.15 177.84 2hm9 h PHE 103 N 0.67 0.71 -0.77 1.37 0.04 0.15 -2.71 116.94 116.40 2hm9 h PHE 103 Ca 0.14 -0.01 0.01 0.00 2.80 0.00 0.00 57.97 60.91 2hm9 h PHE 103 Cb 0.44 -0.23 -0.04 0.00 2.20 0.00 0.00 35.95 38.32 2hm9 h PHE 103 CO 0.03 0.50 0.51 1.15 -0.60 0.00 0.00 178.31 179.90 2hm9 h THR 104 N 0.71 1.19 -0.77 -1.55 2.02 -0.32 0.71 112.91 114.91 2hm9 h THR 104 Ca 0.19 -0.36 -0.03 0.00 0.77 0.00 0.00 66.41 66.99 2hm9 h THR 104 Cb 0.00 0.07 -0.04 0.00 -1.74 0.00 0.00 68.15 66.44 2hm9 h THR 104 CO -0.03 0.19 0.38 0.00 0.37 0.00 0.00 175.52 176.43 2hm9 h ALA 105 N 1.28 1.22 -0.34 6.16 0.00 -1.12 -3.09 119.26 123.38 2hm9 h ALA 105 Ca 0.28 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2hm9 h ALA 105 Cb -0.12 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.36 2hm9 h ALA 105 CO -0.06 0.60 0.00 1.19 0.00 0.00 0.00 179.25 180.98 2hm9 n PHE 106 N -4.33 0.45 -0.24 0.00 3.72 -1.07 -4.62 117.46 111.37 2hm9 n PHE 106 Ca 0.08 -0.41 -0.05 0.00 -0.05 0.00 0.00 57.45 57.02 2hm9 n PHE 106 Cb 0.13 -0.02 0.11 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 2.41 1.08 -0.31 -1.08 3.11 0.54 -2.93 116.57 119.40 2hm9 h LYS 107 Ca 0.00 -0.20 -0.06 0.00 -2.81 0.00 0.00 60.65 57.58 2hm9 h LYS 107 Cb 0.73 -0.18 -0.02 0.00 -1.00 0.00 0.00 32.23 31.77 2hm9 h LYS 107 CO 0.00 0.89 -0.06 0.22 -2.81 0.00 0.00 179.45 177.69 2hm9 h ASP 108 N 1.06 0.47 -1.40 4.20 3.58 -1.82 -3.13 116.42 119.38 2hm9 h ASP 108 Ca 0.24 -0.10 -0.70 0.00 0.42 0.00 0.00 57.03 56.89 2hm9 h ASP 108 Cb 0.23 -0.12 -0.31 0.00 1.72 0.00 0.00 39.33 40.85 2hm9 h ASP 108 CO -0.02 0.58 0.67 -0.67 -2.88 0.00 0.00 179.24 176.92 2hm9 n ASP 109 N -4.25 7.15 -4.26 2.28 -0.08 -1.11 -4.96 116.55 111.33 2hm9 n ASP 109 Ca 0.01 -3.80 -0.32 0.00 -1.51 0.00 0.00 54.79 49.17 2hm9 n ASP 109 Cb 0.28 -0.91 -0.16 0.00 2.34 0.00 0.00 41.12 42.66 2hm9 n ASP 109 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2hm9 s VAL 110 N -4.96 2.31 -0.11 5.18 1.01 -1.18 -4.56 120.40 118.09 2hm9 s VAL 110 Ca 0.57 -0.93 0.16 0.00 0.00 0.00 0.00 61.98 61.78 2hm9 s VAL 110 Cb 0.47 -1.91 -0.22 0.00 0.00 0.00 0.00 36.38 34.72 2hm9 s VAL 110 CO -0.18 0.55 0.53 0.47 0.00 0.00 0.00 175.10 176.48 2hm9 n ASP 111 N 3.52 0.57 -4.15 3.32 9.92 -1.17 -4.60 116.55 123.96 2hm9 n ASP 111 Ca -0.19 0.26 -0.29 0.00 -0.53 0.00 0.00 54.79 54.04 2hm9 n ASP 111 Cb 0.53 0.43 -0.17 0.00 -0.64 0.00 0.00 41.12 41.27 2hm9 n ASP 111 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 2hm9 s THR 112 N -2.72 1.74 -0.15 -3.53 2.01 -1.17 -1.29 115.64 110.53 2hm9 s THR 112 Ca -0.06 -0.83 0.01 0.00 0.31 0.00 0.00 61.69 61.12 2hm9 s THR 112 Cb 0.08 -1.52 0.00 0.00 0.01 0.00 0.00 72.50 71.07 2hm9 s THR 112 CO 0.83 0.49 -0.17 -0.76 -0.69 0.00 0.00 174.62 174.31 2hm9 s LEU 113 N 0.46 2.38 -0.19 4.42 1.43 0.20 -0.45 118.68 126.94 2hm9 s LEU 113 Ca -0.17 -0.50 -0.01 0.00 -1.03 0.00 0.00 54.13 52.41 2hm9 s LEU 113 Cb -0.17 -1.53 -0.00 0.00 0.03 0.00 0.00 46.19 44.52 2hm9 s LEU 113 CO 0.07 0.09 -0.11 -0.76 0.23 0.00 0.00 176.35 175.87 2hm9 s LEU 114 N 0.76 2.62 -0.03 1.79 1.43 0.32 -0.20 118.68 125.37 2hm9 s LEU 114 Ca -0.07 -0.45 0.03 0.00 -1.03 0.00 0.00 54.13 52.61 2hm9 s LEU 114 Cb -0.16 -1.63 0.00 0.00 0.03 0.00 0.00 46.19 44.44 2hm9 s LEU 114 CO 0.00 0.03 -0.11 0.54 0.23 0.00 0.00 176.35 177.04 2hm9 s VAL 115 N 1.15 0.95 -0.15 -1.59 0.11 -0.26 -2.69 120.40 117.92 2hm9 s VAL 115 Ca 0.01 -0.46 -0.02 0.00 -2.93 0.00 0.00 61.98 58.59 2hm9 s VAL 115 Cb -0.14 -0.84 -0.02 0.00 -1.53 0.00 0.00 36.38 33.86 2hm9 s VAL 115 CO -0.04 0.29 -0.09 -0.89 -3.33 0.00 0.00 175.10 171.04 2hm9 s THR 116 N 0.13 3.28 -0.09 5.04 2.01 -0.96 -1.18 115.64 123.87 2hm9 s THR 116 Ca -0.03 -0.57 0.01 0.00 0.31 0.00 0.00 61.69 61.42 2hm9 s THR 116 Cb -0.09 -2.42 -0.02 0.00 0.01 0.00 0.00 72.50 69.98 2hm9 s THR 116 CO 0.01 0.50 -0.12 -0.60 -0.69 0.00 0.00 174.62 173.71 2hm9 s ARG 117 N 0.60 3.01 -0.15 4.92 3.52 -0.64 0.18 118.95 130.38 2hm9 s ARG 117 Ca -0.06 -0.67 -0.04 0.00 -0.13 0.00 0.00 55.73 54.83 2hm9 s ARG 117 Cb -0.15 -2.55 -0.03 0.00 -1.56 0.00 0.00 34.95 30.66 2hm9 s ARG 117 CO 0.03 0.41 -0.01 -0.51 -0.81 0.00 0.00 175.30 174.41 2hm9 s LEU 118 N -0.17 3.40 0.28 -0.88 1.02 -1.09 -1.40 118.68 119.84 2hm9 s LEU 118 Ca 0.00 -0.05 -0.02 0.00 0.02 0.00 0.00 54.13 54.07 2hm9 s LEU 118 Cb -0.13 -1.82 0.39 0.00 0.02 0.00 0.00 46.19 44.65 2hm9 s LEU 118 CO 0.03 0.20 1.86 0.00 0.02 0.00 0.00 176.35 178.46 2hm9 h ALA 119 N 6.50 1.26 -2.36 4.21 0.00 -1.64 -3.07 119.26 124.16 2hm9 h ALA 119 Ca -0.35 -0.16 -0.47 0.00 0.00 0.00 0.00 54.91 53.93 2hm9 h ALA 119 Cb 1.19 -0.26 0.15 0.00 0.00 0.00 0.00 17.79 18.86 2hm9 h ALA 119 CO 0.63 0.55 0.25 0.20 0.00 0.00 0.00 179.25 180.88 2hm9 s GLY 120 N -3.51 1.60 -0.06 0.00 0.00 -1.24 -4.83 107.32 99.28 2hm9 s GLY 120 Ca -0.11 -0.18 0.01 0.00 0.00 0.00 0.00 44.72 44.45 2hm9 s GLY 120 CO 0.80 0.34 -0.07 -0.45 0.00 0.00 0.00 173.10 173.73 2hm9 s SER 121 N -3.50 4.65 0.08 1.64 0.15 -1.26 -4.22 113.70 111.24 2hm9 s SER 121 Ca 0.64 -0.03 0.05 0.00 0.70 0.00 0.00 55.95 57.30 2hm9 s SER 121 Cb -0.18 -1.16 -0.03 0.00 -1.71 0.00 0.00 66.02 62.94 2hm9 s SER 121 CO 0.57 0.36 -0.12 -0.36 1.20 0.00 0.00 173.24 174.88 2hm9 s PHE 122 N -0.83 1.13 -0.05 3.44 0.08 -1.26 -5.11 117.98 115.38 2hm9 s PHE 122 Ca 0.13 -0.51 0.05 0.00 0.12 0.00 0.00 56.93 56.72 2hm9 s PHE 122 Cb -0.11 -0.63 -0.02 0.00 -0.57 0.00 0.00 43.02 41.69 2hm9 s PHE 122 CO 0.02 0.03 -0.21 -1.21 -0.10 0.00 0.00 175.22 173.76 2hm9 s GLU 123 N -2.01 2.48 0.21 0.44 8.01 -1.26 -4.88 118.70 121.69 2hm9 s GLU 123 Ca -0.01 -0.82 -0.23 0.00 0.01 0.00 0.00 54.97 53.92 2hm9 s GLU 123 Cb -0.08 -2.24 0.04 0.00 -4.31 0.00 0.00 34.13 27.54 2hm9 s GLU 123 CO 0.02 0.50 0.79 0.20 0.01 0.00 0.00 175.26 176.78 2hm9 s GLY 124 N -0.44 -0.22 0.00 -1.39 0.00 -1.26 -4.86 107.32 99.15 2hm9 s GLY 124 Ca 0.05 -0.00 0.27 0.00 0.00 0.00 0.00 44.72 45.04 2hm9 s GLY 124 CO 0.01 -0.01 1.68 1.22 0.00 0.00 0.00 173.10 176.01 2hm9 n ASP 125 N -0.44 1.15 -4.26 1.64 8.00 -1.07 -4.82 116.55 116.75 2hm9 n ASP 125 Ca -0.06 -1.12 -0.33 0.00 0.71 0.00 0.00 54.79 53.99 2hm9 n ASP 125 Cb 0.60 0.06 -0.16 0.00 -0.02 0.00 0.00 41.12 41.60 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 -2.28 2.45 0.09 -3.53 2.01 -0.33 -4.89 115.64 109.16 2hm9 s THR 126 Ca 0.31 -0.86 0.10 0.00 0.31 0.00 0.00 61.69 61.54 2hm9 s THR 126 Cb 0.20 -2.00 -0.04 0.00 0.01 0.00 0.00 72.50 70.68 2hm9 s THR 126 CO 0.44 0.54 -0.24 -0.54 -0.69 0.00 0.00 174.62 174.12 2hm9 s LYS 127 N 0.56 1.69 0.36 4.92 3.01 -1.26 -2.70 119.74 126.33 2hm9 s LYS 127 Ca -0.11 -1.19 -0.27 0.00 -1.01 0.00 0.00 55.97 53.39 2hm9 s LYS 127 Cb -0.16 -2.00 -0.09 0.00 -1.01 0.00 0.00 37.83 34.56 2hm9 s LYS 127 CO 0.04 0.49 1.22 1.41 0.51 0.00 0.00 175.35 179.02 2hm9 s MET 128 N -1.70 4.21 0.62 1.68 -2.45 -1.12 -4.82 119.30 115.72 2hm9 s MET 128 Ca 0.14 1.99 -0.18 0.00 -1.25 0.00 0.00 55.69 56.39 2hm9 s MET 128 Cb -0.10 -2.88 -0.02 0.00 1.25 0.00 0.00 34.83 33.08 2hm9 s MET 128 CO 0.05 -0.23 1.23 0.96 1.05 0.00 0.00 175.02 178.08 2hm9 s ILE 129 N -1.27 2.47 0.45 10.11 -5.25 -1.26 -4.94 121.20 121.51 2hm9 s ILE 129 Ca 0.53 0.28 -0.25 0.00 -0.99 0.00 0.00 60.65 60.22 2hm9 s ILE 129 Cb -0.35 -3.08 -0.08 0.00 2.95 0.00 0.00 42.46 41.90 2hm9 s ILE 129 CO 0.45 -0.07 1.44 -2.16 -1.79 0.00 0.00 174.94 172.81 2hm9 s PRO 130 N -3.41 3.66 0.06 0.37 0.04 -1.26 -5.02 135.00 129.44 2hm9 s PRO 130 Ca 0.78 2.45 0.07 0.00 0.04 0.00 0.00 61.00 64.34 2hm9 s PRO 130 Cb -0.32 -2.65 -0.03 0.00 0.04 0.00 0.00 34.50 31.54 2hm9 s PRO 130 CO 0.36 -0.85 -0.19 -0.51 0.04 0.00 0.00 177.00 175.85 2hm9 s LEU 131 N -2.74 2.20 -0.97 -3.56 1.43 -1.26 -5.08 118.68 108.70 2hm9 s LEU 131 Ca 0.61 -0.55 -0.17 0.00 -1.03 0.00 0.00 54.13 52.99 2hm9 s LEU 131 Cb -0.44 -0.87 0.15 0.00 0.03 0.00 0.00 46.19 45.06 2hm9 s LEU 131 CO 0.57 0.10 1.13 0.20 0.23 0.00 0.00 176.35 178.59 2hm9 s ASN 132 N -1.35 6.74 0.25 2.29 -0.87 -1.26 -4.84 114.94 115.89 2hm9 s ASN 132 Ca 0.06 -2.32 -0.04 0.00 -1.57 0.00 0.00 52.86 48.98 2hm9 s ASN 132 Cb -0.09 -2.37 0.29 0.00 -0.02 0.00 0.00 41.25 39.07 2hm9 s ASN 132 CO 0.02 -0.93 1.84 -0.50 -2.57 0.00 0.00 177.10 174.96 2hm9 h TRP 133 N 8.37 1.07 -0.43 2.20 -0.00 -1.98 -2.72 115.95 122.47 2hm9 h TRP 133 Ca 0.18 -0.06 -0.05 0.00 -0.00 0.00 0.00 58.89 58.95 2hm9 h TRP 133 Cb 1.00 -0.33 -0.02 0.00 -0.00 0.00 0.00 29.16 29.81 2hm9 h TRP 133 CO 1.13 0.80 0.06 0.22 -0.00 0.00 0.00 178.44 180.65 2hm9 h ASP 134 N 1.05 0.61 -0.20 -3.49 1.82 -2.05 -2.57 116.42 111.60 2hm9 h ASP 134 Ca 0.25 -0.11 -0.06 0.00 -0.39 0.00 0.00 57.03 56.71 2hm9 h ASP 134 Cb 0.17 -0.16 -0.02 0.00 0.68 0.00 0.00 39.33 40.00 2hm9 h ASP 134 CO -0.03 0.65 -0.06 -0.78 -1.61 0.00 0.00 179.24 177.41 2hm9 h ASP 135 N 0.63 0.52 -3.23 2.28 3.58 -1.90 -3.43 116.42 114.88 2hm9 h ASP 135 Ca 0.14 -0.12 -0.67 0.00 0.42 0.00 0.00 57.03 56.80 2hm9 h ASP 135 Cb 0.31 -0.14 -0.13 0.00 1.72 0.00 0.00 39.33 41.10 2hm9 h ASP 135 CO 0.01 0.63 -0.61 -0.36 -2.88 0.00 0.00 179.24 176.03 2hm9 s PHE 136 N -4.85 3.20 -0.15 0.28 0.40 -0.97 -4.06 117.98 111.84 2hm9 s PHE 136 Ca -0.08 0.19 -0.02 0.00 -0.60 0.00 0.00 56.93 56.42 2hm9 s PHE 136 Cb 0.15 -1.75 -0.02 0.00 0.51 0.00 0.00 43.02 41.91 2hm9 s PHE 136 CO 0.78 0.51 -0.08 0.99 0.70 0.00 0.00 175.22 178.11 2hm9 s THR 137 N -1.03 3.48 0.17 0.64 2.01 -1.15 -4.83 115.64 114.93 2hm9 s THR 137 Ca 0.18 -0.50 -0.32 0.00 0.31 0.00 0.00 61.69 61.36 2hm9 s THR 137 Cb -0.12 -2.51 -0.10 0.00 0.01 0.00 0.00 72.50 69.79 2hm9 s THR 137 CO 0.08 0.50 1.57 -0.75 -0.69 0.00 0.00 174.62 175.33 2hm9 s LYS 138 N 0.43 4.21 -0.13 4.92 2.20 -1.26 -1.68 119.74 128.42 2hm9 s LYS 138 Ca -0.07 2.38 -0.16 0.00 -0.36 0.00 0.00 55.97 57.76 2hm9 s LYS 138 Cb -0.15 -3.15 -0.25 0.00 -1.51 0.00 0.00 37.83 32.77 2hm9 s LYS 138 CO 0.04 -0.61 0.46 -0.39 -0.36 0.00 0.00 175.35 174.49 2hm9 h VAL 139 N 3.98 0.99 -3.06 4.02 -1.51 -1.08 -3.47 116.25 116.12 2hm9 h VAL 139 Ca -0.43 -2.34 -0.02 0.00 -1.23 0.00 0.00 66.70 62.68 2hm9 h VAL 139 Cb 1.20 2.61 -0.12 0.00 -2.13 0.00 0.00 31.29 32.86 2hm9 h VAL 139 CO 0.91 0.64 0.17 -0.55 -1.23 0.00 0.00 177.57 177.51 2hm9 s SER 140 N -6.95 -0.50 0.03 4.19 0.15 -1.19 -5.05 113.70 104.37 2hm9 s SER 140 Ca -0.22 -0.09 0.02 0.00 0.70 0.00 0.00 55.95 56.35 2hm9 s SER 140 Cb 0.05 0.59 -0.02 0.00 -1.71 0.00 0.00 66.02 64.93 2hm9 s SER 140 CO 0.72 -0.98 -0.06 -0.94 1.20 0.00 0.00 173.24 173.18 2hm9 s SER 141 N -2.77 0.64 -0.02 5.45 1.04 -1.26 -1.64 113.70 115.14 2hm9 s SER 141 Ca 0.02 -0.45 0.03 0.00 0.48 0.00 0.00 55.95 56.03 2hm9 s SER 141 Cb -0.01 0.03 -0.00 0.00 0.10 0.00 0.00 66.02 66.14 2hm9 s SER 141 CO -0.11 -0.18 -0.10 -0.60 0.98 0.00 0.00 173.24 173.22 2hm9 s ARG 142 N -1.28 0.99 -0.14 4.02 3.52 0.20 -4.99 118.95 121.27 2hm9 s ARG 142 Ca -0.09 -0.37 0.02 0.00 -0.13 0.00 0.00 55.73 55.16 2hm9 s ARG 142 Cb -0.08 -0.93 0.00 0.00 -1.56 0.00 0.00 34.95 32.38 2hm9 s ARG 142 CO -0.00 0.18 -0.19 0.99 -0.81 0.00 0.00 175.30 175.47 2hm9 s THR 143 N -0.02 2.39 -0.08 4.11 2.01 -1.26 0.63 115.64 123.41 2hm9 s THR 143 Ca 0.00 -0.88 0.03 0.00 0.31 0.00 0.00 61.69 61.16 2hm9 s THR 143 Cb -0.07 -1.97 0.00 0.00 0.01 0.00 0.00 72.50 70.47 2hm9 s THR 143 CO 0.00 0.54 -0.19 0.68 -0.69 0.00 0.00 174.62 174.96 2hm9 s VAL 144 N 0.69 1.63 -0.20 3.82 -7.23 -0.83 -5.02 120.40 113.25 2hm9 s VAL 144 Ca -0.09 -0.78 -0.04 0.00 -1.81 0.00 0.00 61.98 59.26 2hm9 s VAL 144 Cb -0.16 -1.43 -0.02 0.00 0.56 0.00 0.00 36.38 35.34 2hm9 s VAL 144 CO 0.02 0.46 -0.02 -1.61 -0.31 0.00 0.00 175.10 173.64 2hm9 s GLU 145 N 0.42 3.53 0.76 4.82 2.02 -1.26 -2.30 118.70 126.69 2hm9 s GLU 145 Ca -0.15 -0.56 -0.04 0.00 0.02 0.00 0.00 54.97 54.23 2hm9 s GLU 145 Cb -0.16 -3.03 0.13 0.00 0.10 0.00 0.00 34.13 31.17 2hm9 s GLU 145 CO 0.06 -0.04 1.06 0.34 0.02 0.00 0.00 175.26 176.69 2hm9 s ASP 146 N 1.11 4.15 0.13 -0.19 -1.08 -1.26 -4.95 116.67 114.58 2hm9 s ASP 146 Ca 0.02 -0.17 -0.17 0.00 -0.52 0.00 0.00 52.55 51.71 2hm9 s ASP 146 Cb -0.14 -0.18 -0.02 0.00 -1.46 0.00 0.00 42.92 41.11 2hm9 s ASP 146 CO 0.01 -2.00 1.72 0.71 0.52 0.00 0.00 175.17 176.12 2hm9 h THR 147 N -0.74 1.15 -2.87 1.71 1.35 -1.99 -3.43 112.91 108.09 2hm9 h THR 147 Ca -0.39 -0.40 -0.63 0.00 -0.55 0.00 0.00 66.41 64.44 2hm9 h THR 147 Cb 1.26 0.80 -0.06 0.00 -1.73 0.00 0.00 68.15 68.43 2hm9 h THR 147 CO 0.41 0.15 -0.38 0.20 -0.25 0.00 0.00 175.52 175.66 2hm9 s ASN 148 N -5.66 6.52 0.32 5.36 -0.87 -1.26 -5.00 114.94 114.34 2hm9 s ASN 148 Ca -0.13 0.60 0.03 0.00 -1.57 0.00 0.00 52.86 51.78 2hm9 s ASN 148 Cb 0.09 -2.11 0.62 0.00 -0.02 0.00 0.00 41.25 39.84 2hm9 s ASN 148 CO 0.73 0.29 1.89 -0.65 -2.57 0.00 0.00 177.10 176.79 2hm9 h PRO 149 N 4.25 0.89 -0.58 -0.60 0.11 -1.95 -0.57 132.00 133.56 2hm9 h PRO 149 Ca -0.51 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 65.47 2hm9 h PRO 149 Cb 1.21 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 32.09 2hm9 h PRO 149 CO 0.64 0.59 0.06 0.00 -0.21 0.00 0.00 178.00 179.08 2hm9 h ALA 150 N 1.54 1.01 -0.22 -0.75 0.00 -1.94 -2.69 119.26 116.21 2hm9 h ALA 150 Ca 0.41 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.97 2hm9 h ALA 150 Cb 0.37 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2hm9 h ALA 150 CO -0.18 0.62 -0.24 -0.07 0.00 0.00 0.00 179.25 179.39 2hm9 h LEU 151 N 0.90 0.41 -9.82 0.00 3.38 -1.51 -3.28 115.31 105.38 2hm9 h LEU 151 Ca 0.18 -0.13 -0.53 0.00 0.09 0.00 0.00 57.88 57.49 2hm9 h LEU 151 Cb 0.44 -0.11 0.08 0.00 0.09 0.00 0.00 40.66 41.17 2hm9 h LEU 151 CO 0.02 0.65 0.84 -0.89 0.09 0.00 0.00 178.44 179.15 2hm9 s THR 152 N -4.51 2.16 0.12 0.22 2.01 -0.43 -4.58 115.64 110.64 2hm9 s THR 152 Ca -0.06 0.14 -0.06 0.00 0.31 0.00 0.00 61.69 62.02 2hm9 s THR 152 Cb 0.14 -3.09 -0.02 0.00 0.01 0.00 0.00 72.50 69.54 2hm9 s THR 152 CO 0.78 0.03 0.18 -1.38 -0.69 0.00 0.00 174.62 173.53 2hm9 s HIS 153 N -0.25 0.44 0.11 4.92 -3.43 -0.97 -2.49 115.29 113.62 2hm9 s HIS 153 Ca 0.60 -0.84 0.05 0.00 -0.80 0.00 0.00 55.06 54.07 2hm9 s HIS 153 Cb -0.46 -0.18 -0.04 0.00 -1.43 0.00 0.00 32.58 30.47 2hm9 s HIS 153 CO 0.50 -0.59 -0.13 0.99 -2.00 0.00 0.00 174.74 173.51 2hm9 s THR 154 N -3.95 1.23 -0.17 -5.38 2.01 -0.50 -1.97 115.64 106.92 2hm9 s THR 154 Ca 0.14 -1.67 -0.01 0.00 0.31 0.00 0.00 61.69 60.46 2hm9 s THR 154 Cb 0.05 -1.46 -0.01 0.00 0.01 0.00 0.00 72.50 71.09 2hm9 s THR 154 CO -0.04 -0.43 -0.11 -0.31 -0.69 0.00 0.00 174.62 173.04 2hm9 s TYR 155 N -2.14 2.86 -0.06 4.92 2.02 0.20 -1.62 117.35 123.54 2hm9 s TYR 155 Ca 0.07 -0.85 0.04 0.00 -0.37 0.00 0.00 57.07 55.97 2hm9 s TYR 155 Cb -0.05 -1.94 -0.00 0.00 -0.40 0.00 0.00 41.96 39.57 2hm9 s TYR 155 CO 0.02 -0.39 -0.20 -1.21 -1.57 0.00 0.00 175.55 172.21 2hm9 s GLU 156 N 0.84 2.19 -0.12 -0.62 2.02 -0.32 0.62 118.70 123.31 2hm9 s GLU 156 Ca -0.03 -0.70 0.03 0.00 0.02 0.00 0.00 54.97 54.28 2hm9 s GLU 156 Cb -0.15 -1.82 0.01 0.00 0.10 0.00 0.00 34.13 32.27 2hm9 s GLU 156 CO 0.00 0.23 -0.23 0.08 0.02 0.00 0.00 175.26 175.37 2hm9 s VAL 157 N 0.13 2.08 -0.06 2.63 1.01 -0.65 -1.10 120.40 124.44 2hm9 s VAL 157 Ca -0.08 -0.99 0.04 0.00 0.00 0.00 0.00 61.98 60.94 2hm9 s VAL 157 Cb -0.14 -1.81 -0.02 0.00 0.00 0.00 0.00 36.38 34.40 2hm9 s VAL 157 CO 0.04 0.55 -0.15 0.26 0.00 0.00 0.00 175.10 175.80 2hm9 s TRP 158 N 0.62 2.69 -0.14 5.22 0.52 0.71 -0.41 118.94 128.15 2hm9 s TRP 158 Ca -0.12 -0.23 0.01 0.00 0.02 0.00 0.00 56.10 55.78 2hm9 s TRP 158 Cb -0.16 -1.64 -0.00 0.00 -1.15 0.00 0.00 33.47 30.51 2hm9 s TRP 158 CO 0.02 0.13 -0.16 -0.65 0.02 0.00 0.00 176.95 176.31 2hm9 s GLN 159 N -0.60 3.22 0.27 4.98 -0.21 -0.68 0.63 119.66 127.26 2hm9 s GLN 159 Ca 0.09 -0.76 -0.30 0.00 0.02 0.00 0.00 55.36 54.41 2hm9 s GLN 159 Cb -0.11 -2.58 -0.10 0.00 1.00 0.00 0.00 33.01 31.21 2hm9 s GLN 159 CO 0.01 0.07 1.47 0.21 -2.12 0.00 0.00 175.29 174.93 2hm9 s LYS 160 N 0.67 4.24 -0.04 2.91 2.36 -0.41 -2.92 119.74 126.55 2hm9 s LYS 160 Ca -0.08 2.36 0.07 0.00 -2.55 0.00 0.00 55.97 55.77 2hm9 s LYS 160 Cb -0.16 -3.08 -0.02 0.00 -1.05 0.00 0.00 37.83 33.52 2hm9 s LYS 160 CO 0.02 -0.46 -0.25 -1.59 1.55 0.00 0.00 175.35 174.63 2hm9 s LYS 161 N -0.55 2.32 0.00 4.03 0.00 -1.26 -4.96 119.74 119.32 2hm9 s LYS 161 Ca 0.59 -0.91 0.00 0.00 0.00 0.00 0.00 55.97 55.66 2hm9 s LYS 161 Cb -0.43 -2.11 0.00 0.00 0.00 0.00 0.00 37.83 35.29 2hm9 s LYS 161 CO 0.46 0.49 0.40 0.00 0.00 0.00 0.00 175.35 176.70