#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 0.96 -0.28 2.41 0.00 0.33 -3.00 121.76 122.18 2hm9 s ALA 2 Ca 0.00 -0.80 -0.07 0.00 0.00 0.00 0.00 51.96 51.09 2hm9 s ALA 2 Cb 0.00 -0.10 -0.01 0.00 0.00 0.00 0.00 23.12 23.01 2hm9 s ALA 2 CO 0.00 0.14 0.08 -0.06 0.00 0.00 0.00 175.76 175.92 2hm9 s PHE 3 N -1.02 3.12 -0.23 0.00 0.40 0.16 0.90 117.98 121.31 2hm9 s PHE 3 Ca -0.02 -0.69 0.01 0.00 -0.60 0.00 0.00 56.93 55.63 2hm9 s PHE 3 Cb -0.08 -2.26 0.04 0.00 0.51 0.00 0.00 43.02 41.22 2hm9 s PHE 3 CO 0.01 -0.47 -0.14 -1.17 0.70 0.00 0.00 175.22 174.15 2hm9 s LEU 4 N 1.56 2.86 0.17 -0.37 2.96 -1.02 0.11 118.68 124.96 2hm9 s LEU 4 Ca 0.05 -0.98 -0.19 0.00 -0.22 0.00 0.00 54.13 52.78 2hm9 s LEU 4 Cb -0.16 -1.55 0.04 0.00 0.50 0.00 0.00 46.19 45.02 2hm9 s LEU 4 CO 0.03 -0.10 0.53 -1.66 -1.32 0.00 0.00 176.35 173.83 2hm9 s TRP 5 N 1.23 -0.27 -0.02 5.38 -2.14 -1.13 -4.43 118.94 117.55 2hm9 s TRP 5 Ca -0.01 -0.03 0.05 0.00 2.66 0.00 0.00 56.10 58.76 2hm9 s TRP 5 Cb -0.16 0.43 -0.01 0.00 -3.10 0.00 0.00 33.47 30.63 2hm9 s TRP 5 CO -0.08 -0.87 -0.17 0.00 -2.66 0.00 0.00 176.95 173.18 2hm9 s ALA 6 N -3.82 1.41 0.03 2.67 0.00 -1.26 -2.49 121.76 118.30 2hm9 s ALA 6 Ca 0.05 -0.70 -0.01 0.00 0.00 0.00 0.00 51.96 51.30 2hm9 s ALA 6 Cb -0.01 -0.40 -0.03 0.00 0.00 0.00 0.00 23.12 22.69 2hm9 s ALA 6 CO -0.08 0.32 -0.02 1.14 0.00 0.00 0.00 175.76 177.13 2hm9 s GLN 7 N -0.25 0.44 0.85 0.00 -2.07 0.15 -4.69 119.66 114.09 2hm9 s GLN 7 Ca 0.03 -0.83 -0.09 0.00 -1.82 0.00 0.00 55.36 52.65 2hm9 s GLN 7 Cb -0.08 0.16 0.17 0.00 -1.09 0.00 0.00 33.01 32.16 2hm9 s GLN 7 CO 0.00 -0.08 1.18 0.16 -1.32 0.00 0.00 175.29 175.23 2hm9 s ASP 8 N -2.01 3.67 0.19 12.60 -4.77 -1.04 -2.65 116.67 122.65 2hm9 s ASP 8 Ca -0.07 -0.01 -0.12 0.00 -3.30 0.00 0.00 52.55 49.04 2hm9 s ASP 8 Cb -0.03 -0.18 0.10 0.00 -1.09 0.00 0.00 42.92 41.73 2hm9 s ASP 8 CO -0.04 -2.34 1.84 0.08 0.70 0.00 0.00 175.17 175.40 2hm9 h ARG 9 N -1.14 0.85 -0.58 2.11 0.11 -1.62 -2.73 114.38 111.38 2hm9 h ARG 9 Ca -0.41 -0.07 -0.03 0.00 0.10 0.00 0.00 59.98 59.57 2hm9 h ARG 9 Cb 1.25 -0.18 -0.03 0.00 1.11 0.00 0.00 29.97 32.12 2hm9 h ARG 9 CO 0.39 0.59 0.24 -0.44 0.10 0.00 0.00 179.97 180.85 2hm9 h ASP 10 N 0.86 0.80 0.00 0.08 5.19 -1.90 -3.47 116.42 117.98 2hm9 h ASP 10 Ca 0.23 -0.16 0.00 0.00 -0.62 0.00 0.00 57.03 56.48 2hm9 h ASP 10 Cb -0.06 -0.21 0.00 0.00 0.18 0.00 0.00 39.33 39.25 2hm9 h ASP 10 CO -0.05 0.74 0.00 0.61 -3.12 0.00 0.00 179.24 177.43 2hm9 n GLY 11 N -0.84 0.46 3.80 2.75 0.00 -1.03 -5.13 105.19 105.20 2hm9 n GLY 11 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 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 4.40 -0.10 0.99 2.96 -1.26 -2.85 118.68 122.83 2hm9 s LEU 12 Ca 0.00 1.59 -0.01 0.00 -0.22 0.00 0.00 54.13 55.49 2hm9 s LEU 12 Cb 0.00 -3.64 -0.25 0.00 0.50 0.00 0.00 46.19 42.80 2hm9 s LEU 12 CO 0.00 0.05 0.45 2.30 -1.32 0.00 0.00 176.35 177.83 2hm9 n ILE 13 N 0.88 1.73 0.00 6.68 -5.35 -1.03 -2.51 119.36 119.76 2hm9 n ILE 13 Ca -0.02 -0.70 0.00 0.00 -0.27 0.00 0.00 62.75 61.76 2hm9 n ILE 13 Cb 0.50 -1.52 0.00 0.00 -1.74 0.00 0.00 39.64 36.88 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 1.87 -0.39 3.06 3.28 0.00 -0.97 -4.67 105.19 107.36 2hm9 n GLY 14 Ca -0.28 -0.63 -0.24 0.00 0.00 0.00 0.00 46.02 44.87 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 1.53 -1.41 1.61 2.20 -1.04 -1.04 119.74 119.59 2hm9 s LYS 15 Ca 0.00 -0.45 0.00 0.00 -0.36 0.00 0.00 55.97 55.16 2hm9 s LYS 15 Cb 0.00 -1.32 0.00 0.00 -1.51 0.00 0.00 37.83 35.00 2hm9 s LYS 15 CO 0.00 0.13 0.00 -0.25 -0.36 0.00 0.00 175.35 174.87 2hm9 n ASP 16 N 3.44 -4.07 0.00 1.43 8.00 -1.26 -1.16 116.55 122.93 2hm9 n ASP 16 Ca -0.20 0.27 0.00 0.00 0.71 0.00 0.00 54.79 55.57 2hm9 n ASP 16 Cb 0.53 -3.61 0.00 0.00 -0.02 0.00 0.00 41.12 38.02 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 -0.52 2.68 3.75 0.44 0.00 -1.26 -4.82 105.19 105.46 2hm9 n GLY 17 Ca -0.16 -0.07 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 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 -1.49 2.48 -0.57 1.61 -3.43 -0.31 -4.83 115.29 108.75 2hm9 s HIS 18 Ca 0.00 1.35 -0.20 0.00 -0.80 0.00 0.00 55.06 55.41 2hm9 s HIS 18 Cb 0.00 -3.11 0.07 0.00 -1.43 0.00 0.00 32.58 28.12 2hm9 s HIS 18 CO 0.00 -2.09 0.76 -0.51 -2.00 0.00 0.00 174.74 170.90 2hm9 s LEU 19 N -6.05 4.89 0.50 5.38 1.43 -1.26 -2.49 118.68 121.07 2hm9 s LEU 19 Ca 0.62 -1.05 0.25 0.00 -1.03 0.00 0.00 54.13 52.93 2hm9 s LEU 19 Cb -0.17 -2.43 1.30 0.00 0.03 0.00 0.00 46.19 44.92 2hm9 s LEU 19 CO 0.56 -1.12 2.01 1.55 0.23 0.00 0.00 176.35 179.58 2hm9 h PRO 20 N 9.22 0.00 -6.45 1.29 0.13 -1.89 -3.43 132.00 130.86 2hm9 h PRO 20 Ca -0.28 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.31 2hm9 h PRO 20 Cb 1.08 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.18 2hm9 h PRO 20 CO 1.07 0.16 0.18 1.67 -0.23 0.00 0.00 178.00 180.85 2hm9 s TRP 21 N -4.12 3.85 -0.87 1.56 -2.14 -1.26 -5.00 118.94 110.96 2hm9 s TRP 21 Ca -0.02 1.59 -0.16 0.00 2.66 0.00 0.00 56.10 60.17 2hm9 s TRP 21 Cb 0.13 -2.80 0.19 0.00 -3.10 0.00 0.00 33.47 27.89 2hm9 s TRP 21 CO 0.61 0.43 0.89 -1.58 -2.66 0.00 0.00 176.95 174.64 2hm9 s HIS 22 N -0.75 3.55 -0.59 1.66 2.46 -1.26 -4.92 115.29 115.44 2hm9 s HIS 22 Ca 0.37 -1.80 0.05 0.00 0.47 0.00 0.00 55.06 54.15 2hm9 s HIS 22 Cb -0.22 -3.98 0.20 0.00 -0.13 0.00 0.00 32.58 28.45 2hm9 s HIS 22 CO 0.25 -1.16 0.53 -0.11 -2.47 0.00 0.00 174.74 171.78 2hm9 n LEU 23 N 4.83 2.11 -0.48 8.88 7.94 -1.26 -4.95 117.00 134.06 2hm9 n LEU 23 Ca 0.18 -5.03 0.40 0.00 -1.11 0.00 0.00 56.01 50.44 2hm9 n LEU 23 Cb 0.48 -0.29 0.71 0.00 0.53 0.00 0.00 43.42 44.85 2hm9 n LEU 23 CO 0.39 1.89 1.33 -0.65 -1.11 0.00 0.00 177.39 179.24 2hm9 h PRO 24 N 4.98 0.07 0.58 1.96 0.11 -1.98 0.19 132.00 137.90 2hm9 h PRO 24 Ca 0.18 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.26 2hm9 h PRO 24 Cb 0.78 -0.02 0.01 0.00 0.11 0.00 0.00 31.00 31.88 2hm9 h PRO 24 CO 0.64 0.05 -0.28 0.22 -0.21 0.00 0.00 178.00 178.42 2hm9 h ASP 25 N 0.07 -0.65 -0.43 -2.05 1.82 -1.97 0.71 116.42 113.92 2hm9 h ASP 25 Ca 0.77 -0.00 -0.05 0.00 -0.39 0.00 0.00 57.03 57.35 2hm9 h ASP 25 Cb 2.72 0.17 -0.02 0.00 0.68 0.00 0.00 39.33 42.88 2hm9 h ASP 25 CO -0.19 -0.43 0.09 -0.78 -1.61 0.00 0.00 179.24 176.32 2hm9 h ASP 26 N -0.83 0.73 -0.63 2.28 1.82 -1.40 -1.17 116.42 117.21 2hm9 h ASP 26 Ca -0.08 -0.14 -0.04 0.00 -0.39 0.00 0.00 57.03 56.38 2hm9 h ASP 26 Cb 0.62 -0.19 -0.03 0.00 0.68 0.00 0.00 39.33 40.41 2hm9 h ASP 26 CO 0.13 0.74 0.24 -0.07 -1.61 0.00 0.00 179.24 178.67 2hm9 h LEU 27 N 0.74 0.88 -0.89 2.28 3.38 -1.00 -1.66 115.31 119.04 2hm9 h LEU 27 Ca 0.16 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 57.98 2hm9 h LEU 27 Cb 0.33 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.80 2hm9 h LEU 27 CO 0.00 0.82 0.58 0.45 0.09 0.00 0.00 178.44 180.38 2hm9 h HIS 28 N 0.89 1.10 -0.37 1.13 3.86 0.12 -1.54 115.15 120.32 2hm9 h HIS 28 Ca 0.21 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.45 2hm9 h HIS 28 Cb 0.22 -0.37 -0.02 0.00 1.06 0.00 0.00 27.41 28.30 2hm9 h HIS 28 CO 0.01 0.65 0.25 -0.92 0.86 0.00 0.00 177.93 178.78 2hm9 h TYR 29 N 1.15 0.47 -0.31 2.45 3.20 -0.62 0.29 116.97 123.61 2hm9 h TYR 29 Ca 0.34 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.22 2hm9 h TYR 29 Cb -0.05 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.05 2hm9 h TYR 29 CO -0.01 0.29 0.18 0.35 -1.64 0.00 0.00 178.16 177.33 2hm9 h PHE 30 N 0.50 0.41 -0.68 -3.82 3.57 -0.72 -1.98 116.94 114.22 2hm9 h PHE 30 Ca 0.14 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.63 2hm9 h PHE 30 Cb -0.06 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.51 2hm9 h PHE 30 CO -0.05 0.31 0.40 -0.09 -2.23 0.00 0.00 178.31 176.65 2hm9 h ARG 31 N 0.39 0.94 -0.67 1.11 2.43 -1.01 -2.82 114.38 114.75 2hm9 h ARG 31 Ca 0.11 -0.09 -0.05 0.00 -0.81 0.00 0.00 59.98 59.14 2hm9 h ARG 31 Cb 0.02 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.35 2hm9 h ARG 31 CO -0.02 0.68 0.22 0.00 -1.51 0.00 0.00 179.97 179.35 2hm9 h ALA 32 N 1.20 1.12 -0.15 2.80 0.00 -0.73 -2.80 119.26 120.71 2hm9 h ALA 32 Ca 0.24 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 2hm9 h ALA 32 Cb -0.00 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 2hm9 h ALA 32 CO -0.04 0.61 -0.21 1.96 0.00 0.00 0.00 179.25 181.56 2hm9 h GLN 33 N 0.99 0.25 -0.08 0.00 1.08 -1.13 -2.58 115.11 113.64 2hm9 h GLN 33 Ca 0.22 -0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.35 2hm9 h GLN 33 Cb 0.26 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.66 2hm9 h GLN 33 CO -0.01 0.46 0.00 0.25 -0.95 0.00 0.00 178.83 178.58 2hm9 n THR 34 N -4.19 0.11 -3.01 -0.54 -2.24 -1.06 -4.68 114.28 98.67 2hm9 n THR 34 Ca -0.01 -0.13 -0.41 0.00 -2.27 0.00 0.00 64.05 61.23 2hm9 n THR 34 Cb 0.33 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.51 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 -1.89 4.90 -0.39 2.28 -7.23 -0.97 -3.65 120.40 113.44 2hm9 s VAL 35 Ca 0.17 1.28 0.00 0.00 -1.81 0.00 0.00 61.98 61.62 2hm9 s VAL 35 Cb 0.09 -4.04 0.00 0.00 0.56 0.00 0.00 36.38 32.99 2hm9 s VAL 35 CO 0.13 -0.06 0.00 0.61 -0.31 0.00 0.00 175.10 175.47 2hm9 n GLY 36 N 4.04 0.67 3.03 2.32 0.00 -1.25 -5.02 105.19 108.97 2hm9 n GLY 36 Ca 0.02 -0.81 -0.09 0.00 0.00 0.00 0.00 46.02 45.14 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 -2.17 0.45 0.01 1.61 1.02 -1.24 -4.74 119.74 114.68 2hm9 s LYS 37 Ca 0.00 -0.84 -0.30 0.00 0.02 0.00 0.00 55.97 54.85 2hm9 s LYS 37 Cb 0.00 0.08 -0.03 0.00 -0.52 0.00 0.00 37.83 37.36 2hm9 s LYS 37 CO 0.00 -0.06 1.01 0.42 -0.92 0.00 0.00 175.35 175.81 2hm9 s ILE 38 N -2.28 4.73 0.05 2.17 -1.09 0.66 -4.16 121.20 121.28 2hm9 s ILE 38 Ca -0.07 1.97 0.04 0.00 -2.23 0.00 0.00 60.65 60.36 2hm9 s ILE 38 Cb -0.04 -4.26 -0.02 0.00 -1.58 0.00 0.00 42.46 36.55 2hm9 s ILE 38 CO -0.04 0.16 -0.12 -0.32 -1.23 0.00 0.00 174.94 173.39 2hm9 s MET 39 N 0.98 0.80 -0.11 2.79 -2.45 -1.03 0.20 119.30 120.47 2hm9 s MET 39 Ca 0.53 -0.77 0.04 0.00 -1.25 0.00 0.00 55.69 54.23 2hm9 s MET 39 Cb -0.22 -0.76 0.00 0.00 1.25 0.00 0.00 34.83 35.10 2hm9 s MET 39 CO 0.28 0.18 -0.23 0.08 1.05 0.00 0.00 175.02 176.38 2hm9 s VAL 40 N -1.00 2.03 -0.06 10.11 1.01 0.94 -1.76 120.40 131.66 2hm9 s VAL 40 Ca -0.01 -0.99 0.04 0.00 0.00 0.00 0.00 61.98 61.02 2hm9 s VAL 40 Cb -0.08 -1.76 -0.00 0.00 0.00 0.00 0.00 36.38 34.53 2hm9 s VAL 40 CO 0.01 0.55 -0.20 0.68 0.00 0.00 0.00 175.10 176.15 2hm9 s VAL 41 N 0.46 1.65 0.99 2.92 -7.23 0.13 0.10 120.40 119.43 2hm9 s VAL 41 Ca -0.16 -0.82 -0.12 0.00 -1.81 0.00 0.00 61.98 59.07 2hm9 s VAL 41 Cb -0.17 -1.43 0.18 0.00 0.56 0.00 0.00 36.38 35.52 2hm9 s VAL 41 CO 0.06 0.47 1.09 -0.83 -0.31 0.00 0.00 175.10 175.58 2hm9 s GLY 42 N 0.16 1.58 0.19 2.32 0.00 0.33 -0.90 107.32 111.00 2hm9 s GLY 42 Ca -0.09 -0.24 -0.11 0.00 0.00 0.00 0.00 44.72 44.28 2hm9 s GLY 42 CO 0.04 0.35 1.83 -0.09 0.00 0.00 0.00 173.10 175.23 2hm9 h ARG 43 N -1.90 0.93 -0.61 2.90 1.12 -1.83 -0.57 114.38 114.43 2hm9 h ARG 43 Ca -0.54 -0.09 0.02 0.00 -1.11 0.00 0.00 59.98 58.26 2hm9 h ARG 43 Cb 1.32 -0.19 -0.03 0.00 -0.01 0.00 0.00 29.97 31.05 2hm9 h ARG 43 CO 0.56 0.67 0.40 0.00 -3.11 0.00 0.00 179.97 178.49 2hm9 h ARG 44 N 0.93 0.75 -0.29 0.20 -0.00 -1.92 -1.59 114.38 112.47 2hm9 h ARG 44 Ca 0.24 -0.05 -0.02 0.00 -0.50 0.00 0.00 59.98 59.66 2hm9 h ARG 44 Cb -0.01 -0.17 -0.01 0.00 0.00 0.00 0.00 29.97 29.77 2hm9 h ARG 44 CO -0.04 0.50 0.11 1.15 0.00 0.00 0.00 179.97 181.68 2hm9 h THR 45 N 0.77 1.18 -0.91 2.04 2.02 -1.45 -2.36 112.91 114.20 2hm9 h THR 45 Ca 0.23 -0.55 0.24 0.00 0.77 0.00 0.00 66.41 67.10 2hm9 h THR 45 Cb -0.01 1.01 -0.13 0.00 -1.74 0.00 0.00 68.15 67.28 2hm9 h THR 45 CO -0.06 0.19 0.39 0.22 0.37 0.00 0.00 175.52 176.63 2hm9 h TYR 46 N 0.31 0.63 0.00 3.16 3.20 -0.17 1.06 116.97 125.16 2hm9 h TYR 46 Ca 0.10 0.04 -0.11 0.00 3.14 0.00 0.00 58.73 61.90 2hm9 h TYR 46 Cb 0.19 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.31 2hm9 h TYR 46 CO -0.01 -0.10 -0.51 0.93 -1.64 0.00 0.00 178.16 176.83 2hm9 h GLU 47 N 0.35 0.00 0.00 1.82 5.08 -1.38 -3.25 114.58 117.19 2hm9 h GLU 47 Ca 0.59 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.73 2hm9 h GLU 47 Cb 1.17 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.39 2hm9 h GLU 47 CO -0.57 0.51 -1.30 0.77 -1.00 0.00 0.00 179.01 177.43 2hm9 h SER 48 N 0.00 0.00 -3.35 1.42 0.02 0.48 -3.47 113.55 108.65 2hm9 h SER 48 Ca -0.01 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 60.37 2hm9 h SER 48 Cb 1.26 0.00 0.17 0.00 0.14 0.00 0.00 62.40 63.97 2hm9 h SER 48 CO 0.07 0.82 -0.08 0.33 -1.14 0.00 0.00 176.83 176.82 2hm9 n PHE 49 N -3.10 0.21 0.25 3.45 7.35 0.31 -4.85 117.46 121.08 2hm9 n PHE 49 Ca -0.08 0.44 -0.12 0.00 -0.76 0.00 0.00 57.45 56.92 2hm9 n PHE 49 Cb 0.93 -2.06 -0.06 0.00 0.35 0.00 0.00 39.48 38.63 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 0.34 -0.65 -2.09 -7.13 0.13 -1.90 -3.47 132.00 117.23 2hm9 h PRO 50 Ca -0.47 0.04 -0.02 0.00 -0.87 0.00 0.00 66.00 64.69 2hm9 h PRO 50 Cb 1.38 0.15 -0.22 0.00 0.13 0.00 0.00 31.00 32.44 2hm9 h PRO 50 CO 0.49 -0.36 0.01 0.21 -0.23 0.00 0.00 178.00 178.11 2hm9 s LYS 51 N -4.20 0.70 0.14 0.86 2.36 -1.26 -5.17 119.74 113.17 2hm9 s LYS 51 Ca -0.12 1.10 0.06 0.00 -2.55 0.00 0.00 55.97 54.45 2hm9 s LYS 51 Cb 0.01 0.20 -0.04 0.00 -1.05 0.00 0.00 37.83 36.95 2hm9 s LYS 51 CO 0.40 -0.13 -0.13 1.03 1.55 0.00 0.00 175.35 178.06 2hm9 s ARG 52 N 1.22 1.07 0.54 4.03 3.00 -1.26 -4.49 118.95 123.06 2hm9 s ARG 52 Ca -0.07 -1.32 -0.03 0.00 0.00 0.00 0.00 55.73 54.31 2hm9 s ARG 52 Cb -0.05 -0.88 0.01 0.00 0.00 0.00 0.00 34.95 34.02 2hm9 s ARG 52 CO -0.13 0.16 0.81 -1.25 0.00 0.00 0.00 175.30 174.89 2hm9 s PRO 53 N -2.99 2.92 0.36 3.54 0.04 -1.26 -4.84 135.00 132.77 2hm9 s PRO 53 Ca 0.12 -0.25 -0.20 0.00 0.04 0.00 0.00 61.00 60.71 2hm9 s PRO 53 Cb -0.03 -2.39 -0.10 0.00 0.04 0.00 0.00 34.50 32.02 2hm9 s PRO 53 CO 0.03 -0.56 0.87 -0.51 0.04 0.00 0.00 177.00 176.87 2hm9 s LEU 54 N -4.82 4.09 0.07 -3.56 1.43 -1.26 -5.04 118.68 109.59 2hm9 s LEU 54 Ca 0.52 1.58 -0.29 0.00 -1.03 0.00 0.00 54.13 54.92 2hm9 s LEU 54 Cb -0.10 -4.22 -0.05 0.00 0.03 0.00 0.00 46.19 41.84 2hm9 s LEU 54 CO 0.42 -0.22 0.91 -2.16 0.23 0.00 0.00 176.35 175.53 2hm9 s PRO 55 N -2.79 4.62 -1.15 1.29 0.04 -1.26 -3.94 135.00 131.81 2hm9 s PRO 55 Ca 0.56 1.34 -0.03 0.00 0.04 0.00 0.00 61.00 62.91 2hm9 s PRO 55 Cb -0.12 -3.39 0.00 0.00 0.04 0.00 0.00 34.50 31.03 2hm9 s PRO 55 CO 0.17 0.17 0.97 0.39 0.04 0.00 0.00 177.00 178.74 2hm9 n GLU 56 N 3.05 -6.50 -1.78 4.56 1.02 -1.26 -4.99 120.64 114.74 2hm9 n GLU 56 Ca 0.02 0.77 -0.01 0.00 -0.02 0.00 0.00 57.16 57.91 2hm9 n GLU 56 Cb 0.50 -5.57 -0.00 0.00 -0.02 0.00 0.00 31.44 26.35 2hm9 n GLU 56 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2hm9 n ARG 57 N -4.13 0.05 -3.39 3.49 5.12 -1.25 -3.84 116.66 112.71 2hm9 n ARG 57 Ca -0.16 -0.21 -0.16 0.00 -1.93 0.00 0.00 57.85 55.38 2hm9 n ARG 57 Cb 0.62 0.20 -0.09 0.00 -1.16 0.00 0.00 32.46 32.03 2hm9 n ARG 57 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 2hm9 s THR 58 N -2.44 -0.41 -0.08 0.55 2.01 -1.26 -4.99 115.64 109.02 2hm9 s THR 58 Ca 0.02 -0.56 -0.05 0.00 0.31 0.00 0.00 61.69 61.41 2hm9 s THR 58 Cb -0.00 -0.94 -0.04 0.00 0.01 0.00 0.00 72.50 71.53 2hm9 s THR 58 CO 0.02 -0.48 0.11 0.20 -0.69 0.00 0.00 174.62 173.78 2hm9 s ASN 59 N 2.21 6.07 -0.06 3.53 0.02 -1.26 -2.47 114.94 122.98 2hm9 s ASN 59 Ca 0.11 0.35 0.03 0.00 -1.02 0.00 0.00 52.86 52.32 2hm9 s ASN 59 Cb -0.14 -1.89 0.01 0.00 0.02 0.00 0.00 41.25 39.25 2hm9 s ASN 59 CO -0.28 0.37 -0.13 -0.69 0.02 0.00 0.00 177.10 176.39 2hm9 s VAL 60 N -1.06 1.16 -0.32 1.60 1.01 -0.72 -1.45 120.40 120.62 2hm9 s VAL 60 Ca 0.17 -0.51 -0.15 0.00 0.00 0.00 0.00 61.98 61.49 2hm9 s VAL 60 Cb -0.12 -1.04 -0.02 0.00 0.00 0.00 0.00 36.38 35.20 2hm9 s VAL 60 CO 0.07 0.35 0.35 -0.69 0.00 0.00 0.00 175.10 175.18 2hm9 s VAL 61 N 0.51 5.18 -0.18 2.92 1.01 0.56 -0.69 120.40 129.71 2hm9 s VAL 61 Ca -0.12 0.19 -0.04 0.00 0.00 0.00 0.00 61.98 62.01 2hm9 s VAL 61 Cb -0.14 -3.76 -0.02 0.00 0.00 0.00 0.00 36.38 32.45 2hm9 s VAL 61 CO 0.03 0.00 -0.03 -0.22 0.00 0.00 0.00 175.10 174.89 2hm9 s LEU 62 N 2.01 3.19 0.09 3.92 0.20 -0.08 -1.87 118.68 126.14 2hm9 s LEU 62 Ca 0.12 -0.20 0.04 0.00 0.69 0.00 0.00 54.13 54.78 2hm9 s LEU 62 Cb -0.16 -1.79 -0.03 0.00 -0.43 0.00 0.00 46.19 43.78 2hm9 s LEU 62 CO 0.11 0.10 -0.10 0.28 -0.29 0.00 0.00 176.35 176.46 2hm9 s THR 63 N 0.75 0.90 0.13 3.68 -1.32 -1.17 -2.67 115.64 115.94 2hm9 s THR 63 Ca -0.01 -1.59 -0.14 0.00 -1.21 0.00 0.00 61.69 58.74 2hm9 s THR 63 Cb -0.14 -1.29 -0.01 0.00 -1.51 0.00 0.00 72.50 69.54 2hm9 s THR 63 CO 0.02 -0.54 1.58 -0.74 -2.21 0.00 0.00 174.62 172.73 2hm9 h HIS 64 N 3.65 0.83 -2.83 9.09 2.76 -1.90 -3.39 115.15 123.36 2hm9 h HIS 64 Ca -0.37 -0.14 -0.55 0.00 -2.20 0.00 0.00 60.37 57.11 2hm9 h HIS 64 Cb 1.19 -0.22 -0.02 0.00 1.55 0.00 0.00 27.41 29.91 2hm9 h HIS 64 CO 0.63 0.82 -0.37 1.14 -1.30 0.00 0.00 177.93 178.86 2hm9 s GLN 65 N -5.01 3.51 0.00 5.26 -2.07 -1.26 -4.99 119.66 115.11 2hm9 s GLN 65 Ca -0.13 -0.37 0.21 0.00 -1.82 0.00 0.00 55.36 53.26 2hm9 s GLN 65 Cb 0.11 -2.88 0.58 0.00 -1.09 0.00 0.00 33.01 29.73 2hm9 s GLN 65 CO 0.80 0.44 1.47 0.39 -1.32 0.00 0.00 175.29 177.07 2hm9 n GLU 66 N -0.49 2.09 0.00 9.60 1.02 -1.26 -3.99 120.64 127.60 2hm9 n GLU 66 Ca -0.05 -1.64 0.14 0.00 -0.02 0.00 0.00 57.16 55.59 2hm9 n GLU 66 Cb 0.53 -1.44 0.48 0.00 -0.02 0.00 0.00 31.44 30.99 2hm9 n GLU 66 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 2hm9 n ASP 67 N 0.86 1.61 -4.66 1.62 5.75 -1.26 -4.86 116.55 115.62 2hm9 n ASP 67 Ca 0.17 -1.52 -0.35 0.00 -0.01 0.00 0.00 54.79 53.09 2hm9 n ASP 67 Cb 0.45 0.01 -0.09 0.00 -1.03 0.00 0.00 41.12 40.46 2hm9 n ASP 67 CO 0.00 0.00 0.00 -0.47 -0.11 0.00 0.00 177.20 176.62 2hm9 s TYR 68 N -2.02 3.26 -0.12 2.11 5.04 -1.26 -5.10 117.35 119.27 2hm9 s TYR 68 Ca 0.37 0.11 -0.00 0.00 -2.44 0.00 0.00 57.07 55.11 2hm9 s TYR 68 Cb 0.21 -2.02 -0.02 0.00 0.35 0.00 0.00 41.96 40.48 2hm9 s TYR 68 CO 0.34 0.24 -0.11 -0.65 -1.34 0.00 0.00 175.55 174.03 2hm9 s GLN 69 N 0.07 3.24 0.02 4.97 1.11 -1.26 -5.02 119.66 122.79 2hm9 s GLN 69 Ca 0.05 -0.64 0.06 0.00 0.01 0.00 0.00 55.36 54.84 2hm9 s GLN 69 Cb -0.12 -2.64 -0.02 0.00 -1.01 0.00 0.00 33.01 29.22 2hm9 s GLN 69 CO 0.01 0.33 -0.18 0.00 0.01 0.00 0.00 175.29 175.45 2hm9 s ALA 70 N 0.07 1.55 0.03 6.09 0.00 -1.26 -5.14 121.76 123.10 2hm9 s ALA 70 Ca -0.04 -0.89 0.02 0.00 0.00 0.00 0.00 51.96 51.05 2hm9 s ALA 70 Cb -0.14 -0.34 -0.04 0.00 0.00 0.00 0.00 23.12 22.60 2hm9 s ALA 70 CO 0.04 0.36 0.06 -0.65 0.00 0.00 0.00 175.76 175.56 2hm9 s GLN 71 N -0.81 2.90 0.00 0.00 -1.52 -1.26 -4.48 119.66 114.49 2hm9 s GLN 71 Ca 0.06 -0.61 0.00 0.00 -1.95 0.00 0.00 55.36 52.86 2hm9 s GLN 71 Cb -0.08 -2.75 0.00 0.00 -0.22 0.00 0.00 33.01 29.96 2hm9 s GLN 71 CO 0.01 0.60 0.00 0.41 -0.25 0.00 0.00 175.29 176.06 2hm9 n GLY 72 N 0.91 3.25 2.87 3.09 0.00 -1.26 -4.78 105.19 109.27 2hm9 n GLY 72 Ca -0.11 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.30 0.11 0.24 4.61 0.00 -1.26 -4.52 121.76 118.64 2hm9 s ALA 73 Ca 0.00 0.01 -0.31 0.00 0.00 0.00 0.00 51.96 51.66 2hm9 s ALA 73 Cb 0.00 -0.07 -0.12 0.00 0.00 0.00 0.00 23.12 22.92 2hm9 s ALA 73 CO 0.00 0.00 1.60 0.28 0.00 0.00 0.00 175.76 177.64 2hm9 n VAL 74 N 3.27 0.55 -3.51 0.00 0.31 -0.53 -3.57 118.33 114.85 2hm9 n VAL 74 Ca -0.15 -0.14 -0.40 0.00 -0.01 0.00 0.00 64.34 63.64 2hm9 n VAL 74 Cb 0.58 -1.82 -0.10 0.00 -0.91 0.00 0.00 33.84 31.59 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 0.48 5.27 -0.10 2.52 1.01 -1.25 0.21 120.40 128.53 2hm9 s VAL 75 Ca 0.70 -0.13 0.03 0.00 0.00 0.00 0.00 61.98 62.59 2hm9 s VAL 75 Cb -0.55 -3.72 0.00 0.00 0.00 0.00 0.00 36.38 32.11 2hm9 s VAL 75 CO 0.42 -0.00 -0.21 0.68 0.00 0.00 0.00 175.10 175.99 2hm9 s VAL 76 N 1.78 1.83 -1.98 2.92 -7.23 -0.78 -4.98 120.40 111.96 2hm9 s VAL 76 Ca 0.07 -0.88 0.20 0.00 -1.81 0.00 0.00 61.98 59.56 2hm9 s VAL 76 Cb -0.17 -1.61 0.03 0.00 0.56 0.00 0.00 36.38 35.20 2hm9 s VAL 76 CO 0.11 0.51 1.02 1.41 -0.31 0.00 0.00 175.10 177.84 2hm9 n HIS 77 N 3.70 0.00 -3.88 2.82 -0.00 -1.26 -3.02 115.22 113.58 2hm9 n HIS 77 Ca -0.20 0.00 -0.35 0.00 -0.00 0.00 0.00 57.72 57.17 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 -2.09 5.84 0.17 0.41 1.11 -1.26 -4.82 116.67 116.02 2hm9 s ASP 78 Ca 0.18 0.12 -0.12 0.00 0.18 0.00 0.00 52.55 52.91 2hm9 s ASP 78 Cb 0.16 -2.02 0.06 0.00 1.07 0.00 0.00 42.92 42.20 2hm9 s ASP 78 CO 0.44 0.16 1.71 0.58 1.18 0.00 0.00 175.17 179.23 2hm9 h VAL 79 N 4.85 1.23 -0.50 -1.27 2.07 -1.95 -2.44 116.25 118.24 2hm9 h VAL 79 Ca -0.38 -0.75 -0.03 0.00 0.82 0.00 0.00 66.70 66.35 2hm9 h VAL 79 Cb 1.16 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 31.56 2hm9 h VAL 79 CO 0.71 0.29 0.18 0.00 0.02 0.00 0.00 177.57 178.77 2hm9 h ALA 80 N 1.06 1.38 -0.59 1.67 0.00 -2.00 -2.27 119.26 118.51 2hm9 h ALA 80 Ca 0.19 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2hm9 h ALA 80 Cb 0.24 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2hm9 h ALA 80 CO -0.01 0.46 0.21 0.00 0.00 0.00 0.00 179.25 179.91 2hm9 h ALA 81 N 1.49 1.26 -0.59 0.00 0.00 -1.86 -0.94 119.26 118.61 2hm9 h ALA 81 Ca 0.17 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2hm9 h ALA 81 Cb 0.18 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 2hm9 h ALA 81 CO -0.01 0.54 0.27 0.28 0.00 0.00 0.00 179.25 180.32 2hm9 h VAL 82 N 0.85 1.22 -0.35 0.00 2.07 -1.06 0.49 116.25 119.47 2hm9 h VAL 82 Ca 0.20 -0.64 -0.00 0.00 0.82 0.00 0.00 66.70 67.08 2hm9 h VAL 82 Cb 0.21 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 2hm9 h VAL 82 CO -0.01 0.25 0.22 -0.26 0.02 0.00 0.00 177.57 177.79 2hm9 h PHE 83 N 0.81 0.45 -0.63 1.57 0.04 -1.17 -2.50 116.94 115.51 2hm9 h PHE 83 Ca 0.20 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.94 2hm9 h PHE 83 Cb 0.15 -0.15 -0.03 0.00 2.20 0.00 0.00 35.95 38.12 2hm9 h PHE 83 CO 0.00 0.32 0.25 0.00 -0.60 0.00 0.00 178.31 178.29 2hm9 h ALA 84 N 1.10 1.26 -0.33 2.45 0.00 -0.78 -1.79 119.26 121.16 2hm9 h ALA 84 Ca 0.13 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2hm9 h ALA 84 Cb -0.01 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2hm9 h ALA 84 CO -0.02 0.55 0.22 -0.92 0.00 0.00 0.00 179.25 179.07 2hm9 h TYR 85 N 0.91 0.42 -0.58 0.00 3.20 -0.49 -0.07 116.97 120.35 2hm9 h TYR 85 Ca 0.22 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 62.04 2hm9 h TYR 85 Cb 0.17 -0.14 -0.03 0.00 1.54 0.00 0.00 36.73 38.28 2hm9 h TYR 85 CO 0.01 0.26 0.15 0.00 -1.64 0.00 0.00 178.16 176.95 2hm9 h ALA 86 N 1.12 1.17 -0.66 1.82 0.00 -1.19 -2.31 119.26 119.21 2hm9 h ALA 86 Ca 0.12 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 2hm9 h ALA 86 Cb -0.05 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.47 2hm9 h ALA 86 CO -0.03 0.57 0.29 -0.22 0.00 0.00 0.00 179.25 179.86 2hm9 h LYS 87 N 0.86 0.95 -0.74 0.00 3.64 -0.70 -2.47 116.57 118.12 2hm9 h LYS 87 Ca 0.19 -0.14 -0.06 0.00 -1.27 0.00 0.00 60.65 59.37 2hm9 h LYS 87 Cb 0.30 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 31.91 2hm9 h LYS 87 CO -0.00 0.75 0.22 1.96 -2.27 0.00 0.00 179.45 180.11 2hm9 h GLN 88 N 0.94 1.15 -2.73 1.90 4.20 -0.47 -3.28 115.11 116.82 2hm9 h GLN 88 Ca 0.23 -0.25 -0.72 0.00 0.06 0.00 0.00 58.65 57.96 2hm9 h GLN 88 Cb 0.13 -0.16 -0.34 0.00 0.30 0.00 0.00 27.48 27.41 2hm9 h GLN 88 CO -0.03 0.98 0.16 0.72 -0.67 0.00 0.00 178.83 180.00 2hm9 n HIS 89 N -4.26 3.11 0.10 2.96 8.25 -0.94 -4.86 115.22 119.59 2hm9 n HIS 89 Ca 0.06 -3.40 0.08 0.00 -0.26 0.00 0.00 57.72 54.20 2hm9 n HIS 89 Cb 0.23 -1.00 0.54 0.00 1.12 0.00 0.00 29.99 30.89 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 5.08 0.26 -0.32 -0.41 0.13 -1.62 -2.07 132.00 133.06 2hm9 h PRO 90 Ca 0.19 -0.02 -0.05 0.00 -0.87 0.00 0.00 66.00 65.26 2hm9 h PRO 90 Cb 0.66 -0.06 -0.02 0.00 0.13 0.00 0.00 31.00 31.72 2hm9 h PRO 90 CO 1.08 0.17 -0.02 0.22 -0.23 0.00 0.00 178.00 179.23 2hm9 h ASP 91 N 0.27 0.46 -3.24 1.44 3.58 -1.89 -3.41 116.42 113.63 2hm9 h ASP 91 Ca 0.11 -0.09 -0.61 0.00 0.42 0.00 0.00 57.03 56.86 2hm9 h ASP 91 Cb 0.10 -0.12 -0.14 0.00 1.72 0.00 0.00 39.33 40.89 2hm9 h ASP 91 CO -0.02 0.54 -0.53 -1.10 -2.88 0.00 0.00 179.24 175.25 2hm9 s GLN 92 N -4.94 4.01 0.50 0.28 1.11 -0.78 -5.08 119.66 114.77 2hm9 s GLN 92 Ca -0.07 -0.29 -0.19 0.00 0.01 0.00 0.00 55.36 54.83 2hm9 s GLN 92 Cb 0.15 -3.28 -0.08 0.00 -1.01 0.00 0.00 33.01 28.79 2hm9 s GLN 92 CO 0.76 0.32 1.01 -1.21 0.01 0.00 0.00 175.29 176.19 2hm9 s GLU 93 N 0.25 3.82 -0.24 2.91 2.02 -1.26 -4.63 118.70 121.58 2hm9 s GLU 93 Ca 0.06 1.18 -0.10 0.00 0.02 0.00 0.00 54.97 56.13 2hm9 s GLU 93 Cb -0.12 -2.11 -0.05 0.00 0.10 0.00 0.00 34.13 31.95 2hm9 s GLU 93 CO -0.00 -0.39 0.15 -1.17 0.02 0.00 0.00 175.26 173.87 2hm9 s LEU 94 N -3.77 4.08 -0.07 1.80 2.96 -1.25 -0.25 118.68 122.18 2hm9 s LEU 94 Ca 0.63 0.10 0.05 0.00 -0.22 0.00 0.00 54.13 54.69 2hm9 s LEU 94 Cb -0.13 -2.09 -0.00 0.00 0.50 0.00 0.00 46.19 44.46 2hm9 s LEU 94 CO 0.25 0.07 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.44 2hm9 s VAL 95 N 1.01 1.81 -0.40 1.68 1.01 0.13 0.12 120.40 125.77 2hm9 s VAL 95 Ca 0.07 -0.91 -0.18 0.00 0.00 0.00 0.00 61.98 60.96 2hm9 s VAL 95 Cb -0.13 -1.56 0.01 0.00 0.00 0.00 0.00 36.38 34.70 2hm9 s VAL 95 CO 0.04 0.51 0.50 -0.63 0.00 0.00 0.00 175.10 175.52 2hm9 s ILE 96 N 0.11 5.01 -0.95 2.22 -1.09 0.26 -0.04 121.20 126.71 2hm9 s ILE 96 Ca -0.09 -0.00 0.19 0.00 -2.23 0.00 0.00 60.65 58.52 2hm9 s ILE 96 Cb -0.15 -4.04 0.17 0.00 -1.58 0.00 0.00 42.46 36.86 2hm9 s ILE 96 CO 0.05 -0.38 1.62 0.00 -1.23 0.00 0.00 174.94 174.99 2hm9 n ALA 97 N 5.79 1.86 0.00 9.38 0.00 0.28 -2.44 120.51 135.39 2hm9 n ALA 97 Ca -0.05 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2hm9 n ALA 97 Cb 0.48 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.61 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 0.44 -1.72 0.00 0.00 0.00 -1.23 -4.87 105.19 97.81 2hm9 n GLY 98 Ca 0.04 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.42 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 0.36 0.34 -0.02 0.00 -1.26 0.12 105.19 104.74 2hm9 n GLY 99 Ca 0.00 -1.29 -0.02 0.00 0.00 0.00 0.00 46.02 44.71 2hm9 n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hm9 h ALA 100 N -2.00 1.27 -0.76 4.61 0.00 -1.93 0.45 119.26 120.90 2hm9 h ALA 100 Ca 0.00 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 2hm9 h ALA 100 Cb 0.00 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 2hm9 h ALA 100 CO 0.00 0.59 0.33 0.37 0.00 0.00 0.00 179.25 180.54 2hm9 h GLN 101 N 1.09 1.11 -0.40 0.00 5.75 -1.98 0.69 115.11 121.37 2hm9 h GLN 101 Ca 0.27 -0.18 -0.06 0.00 -0.15 0.00 0.00 58.65 58.53 2hm9 h GLN 101 Cb 0.04 -0.19 -0.01 0.00 1.07 0.00 0.00 27.48 28.38 2hm9 h GLN 101 CO -0.04 0.88 0.01 0.82 -2.65 0.00 0.00 178.83 177.85 2hm9 h ILE 102 N 1.08 1.26 -0.50 2.39 1.08 -1.69 -2.49 117.51 118.64 2hm9 h ILE 102 Ca 0.26 -0.99 -0.02 0.00 -0.39 0.00 0.00 64.86 63.72 2hm9 h ILE 102 Cb 0.16 1.11 -0.02 0.00 -3.07 0.00 0.00 36.82 35.00 2hm9 h ILE 102 CO -0.03 0.33 0.25 -0.26 -0.69 0.00 0.00 178.15 177.76 2hm9 h PHE 103 N 0.53 0.71 -0.55 1.37 0.04 -0.32 -3.00 116.94 115.72 2hm9 h PHE 103 Ca 0.11 -0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.85 2hm9 h PHE 103 Cb 0.46 -0.22 -0.03 0.00 2.20 0.00 0.00 35.95 38.36 2hm9 h PHE 103 CO 0.04 0.55 0.34 1.15 -0.60 0.00 0.00 178.31 179.79 2hm9 h THR 104 N 0.66 1.16 -0.83 -1.55 2.02 0.52 0.99 112.91 115.88 2hm9 h THR 104 Ca 0.17 -0.35 -0.02 0.00 0.77 0.00 0.00 66.41 66.98 2hm9 h THR 104 Cb 0.10 0.40 -0.04 0.00 -1.74 0.00 0.00 68.15 66.87 2hm9 h THR 104 CO -0.02 0.16 0.44 0.00 0.37 0.00 0.00 175.52 176.47 2hm9 h ALA 105 N 1.17 1.20 -0.31 6.16 0.00 -1.38 -2.85 119.26 123.25 2hm9 h ALA 105 Ca 0.20 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 2hm9 h ALA 105 Cb -0.03 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 17.39 2hm9 h ALA 105 CO -0.04 0.63 0.01 1.19 0.00 0.00 0.00 179.25 181.04 2hm9 n PHE 106 N -4.33 1.07 -0.24 0.00 3.72 -1.08 -4.74 117.46 111.86 2hm9 n PHE 106 Ca 0.09 -1.08 -0.06 0.00 -0.05 0.00 0.00 57.45 56.35 2hm9 n PHE 106 Cb 0.11 -0.38 0.05 0.00 -0.94 0.00 0.00 39.48 38.32 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 1.61 0.92 -0.01 -1.08 3.64 0.13 -2.62 116.57 119.15 2hm9 h LYS 107 Ca 0.07 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2hm9 h LYS 107 Cb 1.55 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 33.19 2hm9 h LYS 107 CO 0.30 0.67 -0.15 -3.47 -2.27 0.00 0.00 179.45 174.53 2hm9 n ASP 108 N -4.54 1.06 -1.57 4.20 -0.08 -1.26 -3.90 116.55 110.46 2hm9 n ASP 108 Ca 0.05 -1.03 0.10 0.00 -1.51 0.00 0.00 54.79 52.41 2hm9 n ASP 108 Cb 0.07 0.06 0.36 0.00 2.34 0.00 0.00 41.12 43.95 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 -0.46 4.64 -4.33 1.67 8.00 -0.99 -4.93 116.55 120.15 2hm9 n ASP 109 Ca 0.15 -2.34 -0.33 0.00 0.71 0.00 0.00 54.79 52.98 2hm9 n ASP 109 Cb 0.33 -0.57 -0.15 0.00 -0.02 0.00 0.00 41.12 40.72 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 -1.64 2.81 -0.13 2.53 1.01 -1.21 -4.55 120.40 119.22 2hm9 s VAL 110 Ca 0.52 -0.75 0.18 0.00 0.00 0.00 0.00 61.98 61.93 2hm9 s VAL 110 Cb 0.32 -2.16 -0.18 0.00 0.00 0.00 0.00 36.38 34.36 2hm9 s VAL 110 CO 0.27 0.53 0.66 -0.67 0.00 0.00 0.00 175.10 175.90 2hm9 n ASP 111 N 3.55 0.57 -4.24 3.32 2.03 -1.21 -4.79 116.55 115.78 2hm9 n ASP 111 Ca -0.18 0.25 -0.33 0.00 0.52 0.00 0.00 54.79 55.05 2hm9 n ASP 111 Cb 0.53 0.64 -0.16 0.00 -0.72 0.00 0.00 41.12 41.40 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 -3.00 2.36 -0.14 5.18 2.01 -1.16 -1.87 115.64 119.02 2hm9 s THR 112 Ca -0.05 -0.89 0.01 0.00 0.31 0.00 0.00 61.69 61.07 2hm9 s THR 112 Cb 0.09 -1.95 -0.00 0.00 0.01 0.00 0.00 72.50 70.65 2hm9 s THR 112 CO 0.83 0.54 -0.18 -0.76 -0.69 0.00 0.00 174.62 174.36 2hm9 s LEU 113 N 0.60 2.37 -0.19 4.42 1.43 0.12 -0.67 118.68 126.76 2hm9 s LEU 113 Ca -0.11 -0.49 -0.02 0.00 -1.03 0.00 0.00 54.13 52.48 2hm9 s LEU 113 Cb -0.16 -1.52 -0.01 0.00 0.03 0.00 0.00 46.19 44.53 2hm9 s LEU 113 CO 0.03 0.11 -0.09 -0.76 0.23 0.00 0.00 176.35 175.86 2hm9 s LEU 114 N 0.68 2.72 -0.03 1.79 1.43 0.31 -0.48 118.68 125.10 2hm9 s LEU 114 Ca -0.09 -0.42 0.03 0.00 -1.03 0.00 0.00 54.13 52.63 2hm9 s LEU 114 Cb -0.16 -1.66 0.00 0.00 0.03 0.00 0.00 46.19 44.40 2hm9 s LEU 114 CO 0.02 0.03 -0.12 0.54 0.23 0.00 0.00 176.35 177.05 2hm9 s VAL 115 N 1.15 1.00 -0.16 -1.59 0.11 -0.35 -2.84 120.40 117.72 2hm9 s VAL 115 Ca 0.01 -0.48 -0.02 0.00 -2.93 0.00 0.00 61.98 58.57 2hm9 s VAL 115 Cb -0.14 -0.87 -0.02 0.00 -1.53 0.00 0.00 36.38 33.82 2hm9 s VAL 115 CO -0.03 0.30 -0.09 -0.89 -3.33 0.00 0.00 175.10 171.06 2hm9 s THR 116 N 0.12 3.32 -0.09 5.04 2.01 -1.04 -1.22 115.64 123.78 2hm9 s THR 116 Ca -0.03 -0.55 0.02 0.00 0.31 0.00 0.00 61.69 61.43 2hm9 s THR 116 Cb -0.09 -2.43 -0.02 0.00 0.01 0.00 0.00 72.50 69.96 2hm9 s THR 116 CO 0.01 0.50 -0.13 -0.60 -0.69 0.00 0.00 174.62 173.70 2hm9 s ARG 117 N 0.59 2.97 -0.12 4.92 3.52 -0.68 0.33 118.95 130.48 2hm9 s ARG 117 Ca -0.06 -0.68 -0.02 0.00 -0.13 0.00 0.00 55.73 54.84 2hm9 s ARG 117 Cb -0.15 -2.52 -0.03 0.00 -1.56 0.00 0.00 34.95 30.69 2hm9 s ARG 117 CO 0.03 0.41 -0.05 -0.51 -0.81 0.00 0.00 175.30 174.37 2hm9 s LEU 118 N -0.17 3.20 0.28 -0.88 1.02 -1.09 -1.24 118.68 119.80 2hm9 s LEU 118 Ca -0.00 -0.10 -0.02 0.00 0.02 0.00 0.00 54.13 54.03 2hm9 s LEU 118 Cb -0.13 -1.74 0.40 0.00 0.02 0.00 0.00 46.19 44.74 2hm9 s LEU 118 CO 0.03 0.24 1.88 0.00 0.02 0.00 0.00 176.35 178.52 2hm9 h ALA 119 N 6.14 1.28 -2.00 4.21 0.00 -1.63 -2.97 119.26 124.29 2hm9 h ALA 119 Ca -0.37 -0.14 -0.45 0.00 0.00 0.00 0.00 54.91 53.94 2hm9 h ALA 119 Cb 1.19 -0.27 0.14 0.00 0.00 0.00 0.00 17.79 18.85 2hm9 h ALA 119 CO 0.58 0.55 0.36 0.20 0.00 0.00 0.00 179.25 180.95 2hm9 s GLY 120 N -3.48 1.75 0.05 0.00 0.00 -1.23 -4.76 107.32 99.66 2hm9 s GLY 120 Ca -0.11 -1.21 0.04 0.00 0.00 0.00 0.00 44.72 43.44 2hm9 s GLY 120 CO 0.80 -0.52 -0.11 -0.45 0.00 0.00 0.00 173.10 172.82 2hm9 s SER 121 N -4.81 1.23 0.08 1.64 0.15 -1.26 -3.83 113.70 106.89 2hm9 s SER 121 Ca 0.71 -0.55 0.05 0.00 0.70 0.00 0.00 55.95 56.86 2hm9 s SER 121 Cb -0.05 -0.01 -0.03 0.00 -1.71 0.00 0.00 66.02 64.21 2hm9 s SER 121 CO 0.51 -0.12 -0.14 -0.36 1.20 0.00 0.00 173.24 174.32 2hm9 s PHE 122 N -1.24 1.25 -0.05 3.44 0.40 -1.26 -5.09 117.98 115.43 2hm9 s PHE 122 Ca -0.05 -0.47 -0.11 0.00 -0.60 0.00 0.00 56.93 55.69 2hm9 s PHE 122 Cb -0.09 -0.70 -0.05 0.00 0.51 0.00 0.00 43.02 42.69 2hm9 s PHE 122 CO 0.01 0.07 0.29 -1.21 0.70 0.00 0.00 175.22 175.08 2hm9 s GLU 123 N -1.84 3.71 0.13 0.44 2.02 -1.26 -4.89 118.70 117.02 2hm9 s GLU 123 Ca -0.01 0.17 -0.25 0.00 0.02 0.00 0.00 54.97 54.91 2hm9 s GLU 123 Cb -0.09 -3.20 0.07 0.00 0.10 0.00 0.00 34.13 31.00 2hm9 s GLU 123 CO 0.02 0.73 0.87 0.20 0.02 0.00 0.00 175.26 177.10 2hm9 s GLY 124 N -1.08 -0.31 0.00 -1.39 0.00 -1.26 -4.80 107.32 98.48 2hm9 s GLY 124 Ca 0.20 0.32 0.28 0.00 0.00 0.00 0.00 44.72 45.51 2hm9 s GLY 124 CO 0.10 0.09 1.69 1.34 0.00 0.00 0.00 173.10 176.32 2hm9 n ASP 125 N -0.40 1.32 -4.21 1.64 -0.08 -1.14 -4.83 116.55 108.84 2hm9 n ASP 125 Ca -0.07 -1.28 -0.32 0.00 -1.51 0.00 0.00 54.79 51.60 2hm9 n ASP 125 Cb 0.61 0.04 -0.17 0.00 2.34 0.00 0.00 41.12 43.95 2hm9 n ASP 125 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 2hm9 s THR 126 N -2.17 2.10 0.11 5.18 2.01 -0.20 -4.84 115.64 117.84 2hm9 s THR 126 Ca 0.34 -0.99 0.10 0.00 0.31 0.00 0.00 61.69 61.45 2hm9 s THR 126 Cb 0.20 -1.82 -0.04 0.00 0.01 0.00 0.00 72.50 70.86 2hm9 s THR 126 CO 0.40 0.55 -0.25 -0.54 -0.69 0.00 0.00 174.62 174.09 2hm9 s LYS 127 N 0.51 1.57 0.33 4.92 3.01 -1.26 -2.29 119.74 126.53 2hm9 s LYS 127 Ca -0.14 -1.26 -0.28 0.00 -1.01 0.00 0.00 55.97 53.28 2hm9 s LYS 127 Cb -0.17 -1.97 -0.09 0.00 -1.01 0.00 0.00 37.83 34.59 2hm9 s LYS 127 CO 0.05 0.47 1.15 1.41 0.51 0.00 0.00 175.35 178.94 2hm9 s MET 128 N -1.93 4.41 0.68 1.68 1.75 -1.13 -4.76 119.30 120.00 2hm9 s MET 128 Ca 0.14 1.86 -0.17 0.00 -1.25 0.00 0.00 55.69 56.28 2hm9 s MET 128 Cb -0.10 -2.99 0.01 0.00 2.84 0.00 0.00 34.83 34.59 2hm9 s MET 128 CO 0.06 -0.01 1.23 0.96 -0.65 0.00 0.00 175.02 176.61 2hm9 s ILE 129 N -1.26 2.32 0.47 10.11 -5.25 -1.26 -4.94 121.20 121.39 2hm9 s ILE 129 Ca 0.49 0.18 -0.24 0.00 -0.99 0.00 0.00 60.65 60.09 2hm9 s ILE 129 Cb -0.32 -2.90 -0.07 0.00 2.95 0.00 0.00 42.46 42.11 2hm9 s ILE 129 CO 0.41 -0.06 1.40 -2.16 -1.79 0.00 0.00 174.94 172.75 2hm9 s PRO 130 N -3.64 3.55 0.05 0.37 0.04 -1.26 -5.03 135.00 129.08 2hm9 s PRO 130 Ca 0.77 2.36 0.07 0.00 0.04 0.00 0.00 61.00 64.24 2hm9 s PRO 130 Cb -0.32 -2.55 -0.03 0.00 0.04 0.00 0.00 34.50 31.65 2hm9 s PRO 130 CO 0.41 -0.91 -0.19 -0.51 0.04 0.00 0.00 177.00 175.84 2hm9 s LEU 131 N -2.93 2.19 -0.96 -3.56 1.43 -1.26 -5.08 118.68 108.51 2hm9 s LEU 131 Ca 0.64 -0.53 -0.17 0.00 -1.03 0.00 0.00 54.13 53.03 2hm9 s LEU 131 Cb -0.43 -0.85 0.15 0.00 0.03 0.00 0.00 46.19 45.09 2hm9 s LEU 131 CO 0.54 0.10 1.13 0.20 0.23 0.00 0.00 176.35 178.55 2hm9 s ASN 132 N -1.30 6.72 0.27 2.29 0.01 -1.26 -4.86 114.94 116.82 2hm9 s ASN 132 Ca 0.05 -2.28 -0.03 0.00 -0.71 0.00 0.00 52.86 49.89 2hm9 s ASN 132 Cb -0.09 -2.38 0.35 0.00 0.41 0.00 0.00 41.25 39.55 2hm9 s ASN 132 CO 0.02 -0.95 1.89 -0.50 -1.51 0.00 0.00 177.10 176.05 2hm9 h TRP 133 N 8.44 1.06 -0.44 2.20 -0.00 -1.98 -2.54 115.95 122.70 2hm9 h TRP 133 Ca 0.18 -0.02 -0.05 0.00 -0.00 0.00 0.00 58.89 58.99 2hm9 h TRP 133 Cb 1.00 -0.34 -0.02 0.00 -0.00 0.00 0.00 29.16 29.80 2hm9 h TRP 133 CO 1.14 0.74 0.08 0.22 -0.00 0.00 0.00 178.44 180.62 2hm9 h ASP 134 N 1.08 0.63 -0.24 -3.49 3.58 -2.04 -2.69 116.42 113.26 2hm9 h ASP 134 Ca 0.27 -0.11 -0.06 0.00 0.42 0.00 0.00 57.03 57.55 2hm9 h ASP 134 Cb 0.04 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 40.91 2hm9 h ASP 134 CO -0.04 0.65 -0.03 0.44 -2.88 0.00 0.00 179.24 177.38 2hm9 h ASP 135 N 0.65 0.53 -3.54 2.28 3.32 -1.87 -3.43 116.42 114.37 2hm9 h ASP 135 Ca 0.14 -0.11 -0.68 0.00 0.02 0.00 0.00 57.03 56.41 2hm9 h ASP 135 Cb 0.30 -0.14 -0.17 0.00 0.22 0.00 0.00 39.33 39.54 2hm9 h ASP 135 CO 0.00 0.62 -0.68 -0.36 -1.72 0.00 0.00 179.24 177.10 2hm9 s PHE 136 N -4.92 2.97 -0.14 4.55 0.40 -1.01 -3.68 117.98 116.14 2hm9 s PHE 136 Ca -0.08 0.02 -0.02 0.00 -0.60 0.00 0.00 56.93 56.26 2hm9 s PHE 136 Cb 0.15 -1.66 -0.02 0.00 0.51 0.00 0.00 43.02 42.00 2hm9 s PHE 136 CO 0.77 0.39 -0.09 0.99 0.70 0.00 0.00 175.22 177.99 2hm9 s THR 137 N -0.96 3.45 0.18 0.64 2.01 -0.42 -4.82 115.64 115.72 2hm9 s THR 137 Ca 0.16 -0.52 -0.32 0.00 0.31 0.00 0.00 61.69 61.33 2hm9 s THR 137 Cb -0.11 -2.48 -0.11 0.00 0.01 0.00 0.00 72.50 69.81 2hm9 s THR 137 CO 0.06 0.51 1.62 -0.75 -0.69 0.00 0.00 174.62 175.37 2hm9 s LYS 138 N 0.37 4.18 -0.23 4.92 2.20 -1.26 -1.52 119.74 128.40 2hm9 s LYS 138 Ca -0.08 2.45 -0.16 0.00 -0.36 0.00 0.00 55.97 57.82 2hm9 s LYS 138 Cb -0.15 -3.12 -0.12 0.00 -1.51 0.00 0.00 37.83 32.92 2hm9 s LYS 138 CO 0.04 -0.65 -0.17 1.33 -0.36 0.00 0.00 175.35 175.54 2hm9 n VAL 139 N 3.92 1.52 -3.99 4.02 0.24 0.94 -4.91 118.33 120.07 2hm9 n VAL 139 Ca 0.14 -0.15 -0.10 0.00 -2.04 0.00 0.00 64.34 62.19 2hm9 n VAL 139 Cb 0.37 -2.04 -0.12 0.00 -1.47 0.00 0.00 33.84 30.58 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 -6.92 0.33 0.03 -1.34 0.01 -1.18 -5.03 113.70 99.60 2hm9 s SER 140 Ca -0.32 -0.42 0.01 0.00 1.31 0.00 0.00 55.95 56.53 2hm9 s SER 140 Cb 0.09 0.07 -0.02 0.00 0.21 0.00 0.00 66.02 66.38 2hm9 s SER 140 CO 0.49 -0.23 -0.06 -0.94 0.41 0.00 0.00 173.24 172.91 2hm9 s SER 141 N -1.22 0.60 -0.00 2.44 1.04 -1.26 -0.61 113.70 114.68 2hm9 s SER 141 Ca -0.12 -0.41 0.02 0.00 0.48 0.00 0.00 55.95 55.92 2hm9 s SER 141 Cb -0.08 0.03 -0.01 0.00 0.10 0.00 0.00 66.02 66.06 2hm9 s SER 141 CO -0.01 -0.16 -0.07 -0.60 0.98 0.00 0.00 173.24 173.38 2hm9 s ARG 142 N -1.16 0.57 -0.13 4.02 3.52 0.21 -4.99 118.95 120.99 2hm9 s ARG 142 Ca -0.08 -0.29 0.02 0.00 -0.13 0.00 0.00 55.73 55.25 2hm9 s ARG 142 Cb -0.08 -0.54 -0.00 0.00 -1.56 0.00 0.00 34.95 32.77 2hm9 s ARG 142 CO -0.00 0.15 -0.19 0.99 -0.81 0.00 0.00 175.30 175.44 2hm9 s THR 143 N -0.24 2.48 -0.08 4.11 2.01 -1.26 0.57 115.64 123.22 2hm9 s THR 143 Ca 0.02 -0.86 0.03 0.00 0.31 0.00 0.00 61.69 61.20 2hm9 s THR 143 Cb -0.03 -2.01 0.00 0.00 0.01 0.00 0.00 72.50 70.48 2hm9 s THR 143 CO -0.00 0.54 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.59 2hm9 s VAL 144 N 0.52 1.61 -0.22 3.82 1.01 -0.74 -5.01 120.40 121.39 2hm9 s VAL 144 Ca -0.12 -0.76 -0.05 0.00 0.00 0.00 0.00 61.98 61.05 2hm9 s VAL 144 Cb -0.16 -1.41 -0.01 0.00 0.00 0.00 0.00 36.38 34.79 2hm9 s VAL 144 CO 0.05 0.46 -0.02 -0.70 0.00 0.00 0.00 175.10 174.89 2hm9 s GLU 145 N 0.42 3.47 0.76 2.72 -6.30 -1.26 -2.10 118.70 116.40 2hm9 s GLU 145 Ca -0.15 -0.58 -0.04 0.00 -2.50 0.00 0.00 54.97 51.70 2hm9 s GLU 145 Cb -0.16 -3.07 0.13 0.00 0.00 0.00 0.00 34.13 31.03 2hm9 s GLU 145 CO 0.06 -0.15 1.05 0.34 0.02 0.00 0.00 175.26 176.58 2hm9 s ASP 146 N 1.41 4.17 0.13 -1.70 -1.08 -1.26 -4.95 116.67 113.38 2hm9 s ASP 146 Ca 0.05 -0.16 -0.17 0.00 -0.52 0.00 0.00 52.55 51.74 2hm9 s ASP 146 Cb -0.14 -0.19 -0.02 0.00 -1.46 0.00 0.00 42.92 41.11 2hm9 s ASP 146 CO -0.01 -1.99 1.71 0.71 0.52 0.00 0.00 175.17 176.11 2hm9 h THR 147 N -0.73 1.16 -2.75 1.71 1.35 -1.99 -3.43 112.91 108.22 2hm9 h THR 147 Ca -0.39 -0.44 -0.65 0.00 -0.55 0.00 0.00 66.41 64.38 2hm9 h THR 147 Cb 1.27 0.82 -0.06 0.00 -1.73 0.00 0.00 68.15 68.45 2hm9 h THR 147 CO 0.42 0.16 -0.45 0.21 -0.25 0.00 0.00 175.52 175.61 2hm9 s ASN 148 N -5.69 6.43 0.30 5.36 2.47 -1.26 -5.01 114.94 117.54 2hm9 s ASN 148 Ca -0.13 0.48 0.02 0.00 0.42 0.00 0.00 52.86 53.65 2hm9 s ASN 148 Cb 0.09 -2.07 0.56 0.00 -1.45 0.00 0.00 41.25 38.39 2hm9 s ASN 148 CO 0.73 0.34 1.88 1.55 -3.72 0.00 0.00 177.10 177.89 2hm9 h PRO 149 N 4.49 0.96 -0.65 0.43 0.13 -1.95 -0.37 132.00 135.06 2hm9 h PRO 149 Ca -0.52 -0.06 -0.06 0.00 -0.87 0.00 0.00 66.00 64.49 2hm9 h PRO 149 Cb 1.21 -0.22 -0.03 0.00 0.13 0.00 0.00 31.00 32.10 2hm9 h PRO 149 CO 0.62 0.64 0.16 0.00 -0.23 0.00 0.00 178.00 179.19 2hm9 h ALA 150 N 1.52 1.06 -0.23 -0.56 0.00 -1.93 -2.68 119.26 116.43 2hm9 h ALA 150 Ca 0.43 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 2hm9 h ALA 150 Cb 0.33 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2hm9 h ALA 150 CO -0.18 0.62 -0.24 -0.07 0.00 0.00 0.00 179.25 179.37 2hm9 h LEU 151 N 0.97 0.44 -9.84 0.00 3.38 -1.52 -3.27 115.31 105.47 2hm9 h LEU 151 Ca 0.21 -0.14 -0.53 0.00 0.09 0.00 0.00 57.88 57.50 2hm9 h LEU 151 Cb 0.34 -0.12 0.09 0.00 0.09 0.00 0.00 40.66 41.06 2hm9 h LEU 151 CO 0.00 0.69 0.86 -0.89 0.09 0.00 0.00 178.44 179.19 2hm9 s THR 152 N -4.50 2.04 0.10 0.22 2.01 -0.30 -4.61 115.64 110.60 2hm9 s THR 152 Ca -0.07 0.03 -0.06 0.00 0.31 0.00 0.00 61.69 61.91 2hm9 s THR 152 Cb 0.14 -3.02 -0.01 0.00 0.01 0.00 0.00 72.50 69.61 2hm9 s THR 152 CO 0.78 0.01 0.15 -1.38 -0.69 0.00 0.00 174.62 173.49 2hm9 s HIS 153 N -0.29 0.35 0.11 4.92 -3.43 -0.89 -2.53 115.29 113.53 2hm9 s HIS 153 Ca 0.61 -0.79 0.05 0.00 -0.80 0.00 0.00 55.06 54.13 2hm9 s HIS 153 Cb -0.48 -0.17 -0.04 0.00 -1.43 0.00 0.00 32.58 30.47 2hm9 s HIS 153 CO 0.52 -0.55 -0.13 0.99 -2.00 0.00 0.00 174.74 173.58 2hm9 s THR 154 N -3.92 1.20 -0.17 -5.38 2.01 -0.37 -1.79 115.64 107.23 2hm9 s THR 154 Ca 0.10 -1.65 -0.02 0.00 0.31 0.00 0.00 61.69 60.43 2hm9 s THR 154 Cb 0.05 -1.44 -0.01 0.00 0.01 0.00 0.00 72.50 71.12 2hm9 s THR 154 CO -0.07 -0.44 -0.10 -0.31 -0.69 0.00 0.00 174.62 173.01 2hm9 s TYR 155 N -2.13 2.87 -0.06 4.92 2.02 0.19 -1.69 117.35 123.48 2hm9 s TYR 155 Ca 0.07 -0.84 0.05 0.00 -0.37 0.00 0.00 57.07 55.98 2hm9 s TYR 155 Cb -0.05 -1.96 -0.01 0.00 -0.40 0.00 0.00 41.96 39.55 2hm9 s TYR 155 CO 0.02 -0.39 -0.21 -1.21 -1.57 0.00 0.00 175.55 172.19 2hm9 s GLU 156 N 0.87 2.26 -0.14 -0.62 8.01 -0.36 0.66 118.70 129.39 2hm9 s GLU 156 Ca -0.03 -0.77 0.02 0.00 0.01 0.00 0.00 54.97 54.20 2hm9 s GLU 156 Cb -0.15 -1.90 0.00 0.00 -4.31 0.00 0.00 34.13 27.77 2hm9 s GLU 156 CO 0.00 0.29 -0.19 0.08 0.01 0.00 0.00 175.26 175.46 2hm9 s VAL 157 N -0.00 2.38 0.09 2.63 1.01 0.22 -1.21 120.40 125.53 2hm9 s VAL 157 Ca -0.06 -0.88 0.08 0.00 0.00 0.00 0.00 61.98 61.13 2hm9 s VAL 157 Cb -0.13 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.24 2hm9 s VAL 157 CO 0.04 0.53 -0.18 0.26 0.00 0.00 0.00 175.10 175.76 2hm9 s TRP 158 N 0.70 2.56 0.05 5.22 0.52 0.37 -0.04 118.94 128.32 2hm9 s TRP 158 Ca -0.09 -0.25 0.03 0.00 0.02 0.00 0.00 56.10 55.81 2hm9 s TRP 158 Cb -0.16 -1.39 -0.03 0.00 -1.15 0.00 0.00 33.47 30.75 2hm9 s TRP 158 CO 0.01 0.35 -0.10 -0.65 0.02 0.00 0.00 176.95 176.58 2hm9 s GLN 159 N -1.93 0.63 0.25 4.98 -1.52 -0.58 0.11 119.66 121.60 2hm9 s GLN 159 Ca 0.17 -0.84 -0.30 0.00 -1.95 0.00 0.00 55.36 52.44 2hm9 s GLN 159 Cb -0.11 -0.47 -0.10 0.00 -0.22 0.00 0.00 33.01 32.12 2hm9 s GLN 159 CO 0.09 0.09 1.37 0.21 -0.25 0.00 0.00 175.29 176.80 2hm9 s LYS 160 N -1.71 4.32 0.01 2.91 2.36 -0.78 -1.30 119.74 125.55 2hm9 s LYS 160 Ca -0.07 2.21 0.08 0.00 -2.55 0.00 0.00 55.97 55.64 2hm9 s LYS 160 Cb -0.10 -3.13 -0.03 0.00 -1.05 0.00 0.00 37.83 33.53 2hm9 s LYS 160 CO 0.01 -0.32 -0.23 -1.59 1.55 0.00 0.00 175.35 174.77 2hm9 s LYS 161 N -0.58 2.06 0.00 4.03 0.00 -1.24 -4.89 119.74 119.11 2hm9 s LYS 161 Ca 0.56 -0.96 0.00 0.00 0.00 0.00 0.00 55.97 55.57 2hm9 s LYS 161 Cb -0.40 -2.09 0.00 0.00 0.00 0.00 0.00 37.83 35.34 2hm9 s LYS 161 CO 0.44 0.55 0.13 0.00 0.00 0.00 0.00 175.35 176.47