#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hbn s VAL 3 N 0.00 2.87 -0.11 3.15 1.01 0.36 -0.95 120.40 126.74 3hbn s VAL 3 Ca 0.00 -0.77 0.03 0.00 0.00 0.00 0.00 61.98 61.24 3hbn s VAL 3 Cb 0.00 -2.13 -0.00 0.00 0.00 0.00 0.00 36.38 34.24 3hbn s VAL 3 CO 0.00 0.57 -0.21 -0.22 0.00 0.00 0.00 175.10 175.24 3hbn s LEU 4 N -0.37 2.27 -0.19 3.92 2.96 -0.05 -1.18 118.68 126.04 3hbn s LEU 4 Ca 0.04 -0.49 -0.14 0.00 -0.22 0.00 0.00 54.13 53.31 3hbn s LEU 4 Cb -0.12 -1.46 -0.04 0.00 0.50 0.00 0.00 46.19 45.06 3hbn s LEU 4 CO 0.02 0.17 0.32 -0.36 -1.32 0.00 0.00 176.35 175.18 3hbn s PHE 5 N 0.30 3.40 -0.39 5.38 0.40 0.30 -0.63 117.98 126.74 3hbn s PHE 5 Ca -0.16 0.54 -0.12 0.00 -0.60 0.00 0.00 56.93 56.60 3hbn s PHE 5 Cb -0.17 -2.41 0.03 0.00 0.51 0.00 0.00 43.02 40.98 3hbn s PHE 5 CO 0.08 0.10 0.23 0.50 0.70 0.00 0.00 175.22 176.83 3hbn s ARG 6 N 0.95 2.83 -0.22 0.44 6.06 0.50 -0.44 118.95 129.07 3hbn s ARG 6 Ca 0.16 -1.11 -0.26 0.00 -2.50 0.00 0.00 55.73 52.01 3hbn s ARG 6 Cb -0.14 -3.80 0.08 0.00 0.06 0.00 0.00 34.95 31.16 3hbn s ARG 6 CO 0.06 -0.75 0.77 0.45 -2.50 0.00 0.00 175.30 173.33 3hbn s SER 7 N 1.65 -0.67 0.25 -2.12 0.15 -1.19 -1.19 113.70 110.58 3hbn s SER 7 Ca 0.03 1.17 0.11 0.00 0.70 0.00 0.00 55.95 57.96 3hbn s SER 7 Cb -0.20 1.14 -0.05 0.00 -1.71 0.00 0.00 66.02 65.21 3hbn s SER 7 CO 0.07 -0.32 -0.13 -1.81 1.20 0.00 0.00 173.24 172.25 3hbn s ASP 8 N -0.03 3.96 0.02 5.45 1.01 -1.26 -4.46 116.67 121.36 3hbn s ASP 8 Ca -0.02 -0.84 -0.01 0.00 0.71 0.00 0.00 52.55 52.39 3hbn s ASP 8 Cb -0.04 -0.52 -0.02 0.00 1.01 0.00 0.00 42.92 43.35 3hbn s ASP 8 CO 0.02 0.04 -0.00 -0.94 0.21 0.00 0.00 175.17 174.50 3hbn s SER 9 N -3.39 0.25 0.05 0.27 1.04 -1.26 -4.38 113.70 106.27 3hbn s SER 9 Ca 0.29 -0.54 -0.28 0.00 0.48 0.00 0.00 55.95 55.90 3hbn s SER 9 Cb -0.06 0.13 0.10 0.00 0.10 0.00 0.00 66.02 66.29 3hbn s SER 9 CO 0.16 -0.36 1.18 -0.94 0.98 0.00 0.00 173.24 174.26 3hbn s SER 10 N -1.70 -0.07 0.25 7.02 1.04 -1.16 -3.93 113.70 115.15 3hbn s SER 10 Ca -0.12 -0.28 -0.04 0.00 0.48 0.00 0.00 55.95 56.00 3hbn s SER 10 Cb -0.07 0.28 0.46 0.00 0.10 0.00 0.00 66.02 66.79 3hbn s SER 10 CO -0.02 -0.53 1.75 0.28 0.98 0.00 0.00 173.24 175.70 3hbn h SER 11 N 2.00 0.37 -0.05 7.02 0.02 -1.42 -0.14 113.55 121.35 3hbn h SER 11 Ca -0.28 0.10 -0.20 0.00 -0.84 0.00 0.00 61.79 60.57 3hbn h SER 11 Cb 1.21 0.05 0.01 0.00 0.14 0.00 0.00 62.40 63.81 3hbn h SER 11 CO 0.29 0.16 -0.75 1.56 -1.14 0.00 0.00 176.83 176.95 3hbn h GLN 12 N 0.51 0.59 0.01 3.45 1.08 -1.91 -3.34 115.11 115.51 3hbn h GLN 12 Ca 0.42 -0.57 -0.20 0.00 -1.45 0.00 0.00 58.65 56.85 3hbn h GLN 12 Cb 0.60 0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 28.16 3hbn h GLN 12 CO -0.37 1.19 -0.89 0.82 -0.95 0.00 0.00 178.83 178.63 3hbn h ILE 13 N 0.21 1.51 0.00 2.54 2.04 -1.87 -3.49 117.51 118.44 3hbn h ILE 13 Ca -0.08 -2.68 0.00 0.00 1.00 0.00 0.00 64.86 63.10 3hbn h ILE 13 Cb 1.42 2.50 0.00 0.00 -0.74 0.00 0.00 36.82 40.00 3hbn h ILE 13 CO 0.15 0.78 0.00 0.61 0.00 0.00 0.00 178.15 179.69 3hbn n GLY 14 N 0.91 -3.01 0.00 5.37 0.00 -0.08 -4.79 105.19 103.59 3hbn n GLY 14 Ca -0.03 -1.92 0.05 0.00 0.00 0.00 0.00 46.02 44.12 3hbn n GLY 14 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3hbn n PHE 15 N -0.18 0.00 -0.28 1.61 3.72 -1.26 -3.00 117.46 118.07 3hbn n PHE 15 Ca 0.00 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.41 3hbn n PHE 15 Cb 0.00 -0.01 0.13 0.00 -0.94 0.00 0.00 39.48 38.66 3hbn n PHE 15 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3hbn h GLY 16 N 2.53 1.20 0.79 1.37 0.00 -1.94 -0.42 103.07 106.60 3hbn h GLY 16 Ca 0.00 -0.34 -0.02 0.00 0.00 0.00 0.00 47.33 46.98 3hbn h GLY 16 CO 0.00 0.21 -0.19 0.45 0.00 0.00 0.00 176.54 177.01 3hbn h HIS 17 N 0.85 -0.49 -0.61 5.60 3.86 -1.84 -1.88 115.15 120.63 3hbn h HIS 17 Ca 0.36 -0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 59.53 3hbn h HIS 17 Cb 0.21 0.16 -0.03 0.00 1.06 0.00 0.00 27.41 28.82 3hbn h HIS 17 CO -0.05 -0.20 0.28 0.82 0.86 0.00 0.00 177.93 179.65 3hbn h ILE 18 N -0.75 1.22 -0.32 2.45 1.08 -1.72 -0.62 117.51 118.85 3hbn h ILE 18 Ca -0.05 -0.63 -0.00 0.00 -0.39 0.00 0.00 64.86 63.78 3hbn h ILE 18 Cb 0.52 0.50 -0.02 0.00 -3.07 0.00 0.00 36.82 34.76 3hbn h ILE 18 CO 0.09 0.25 0.19 0.11 -0.69 0.00 0.00 178.15 178.10 3hbn h LYS 19 N 0.84 0.44 -0.13 2.37 1.79 -1.05 0.15 116.57 120.97 3hbn h LYS 19 Ca 0.21 -0.04 -0.13 0.00 -2.18 0.00 0.00 60.65 58.51 3hbn h LYS 19 Cb 0.14 -0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 30.69 3hbn h LYS 19 CO -0.02 0.35 -0.47 0.07 -1.08 0.00 0.00 179.45 178.29 3hbn h ARG 20 N 0.40 0.34 -0.78 3.15 0.11 -1.26 -2.86 114.38 113.49 3hbn h ARG 20 Ca 0.11 -0.18 0.00 0.00 0.10 0.00 0.00 59.98 60.01 3hbn h ARG 20 Cb 0.03 0.01 -0.04 0.00 1.11 0.00 0.00 29.97 31.08 3hbn h ARG 20 CO -0.02 0.74 0.49 -0.44 0.10 0.00 0.00 179.97 180.84 3hbn h ASP 21 N 0.27 0.92 0.20 0.08 3.32 -0.63 -1.23 116.42 119.35 3hbn h ASP 21 Ca 0.02 -0.04 -0.06 0.00 0.02 0.00 0.00 57.03 56.97 3hbn h ASP 21 Cb 0.94 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.25 3hbn h ASP 21 CO 0.08 0.69 -0.24 -0.07 -1.72 0.00 0.00 179.24 177.98 3hbn h LEU 22 N 1.06 0.07 -0.03 1.55 3.38 -0.76 0.18 115.31 120.77 3hbn h LEU 22 Ca 0.28 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.22 3hbn h LEU 22 Cb -0.07 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 3hbn h LEU 22 CO -0.06 0.32 -0.05 0.58 0.09 0.00 0.00 178.44 179.32 3hbn h VAL 23 N 0.07 1.41 -0.87 1.22 2.07 -1.18 -3.19 116.25 115.78 3hbn h VAL 23 Ca 0.01 -1.30 0.07 0.00 0.82 0.00 0.00 66.70 66.31 3hbn h VAL 23 Cb 0.47 2.21 -0.06 0.00 -1.52 0.00 0.00 31.29 32.39 3hbn h VAL 23 CO 0.03 0.35 0.56 0.25 0.02 0.00 0.00 177.57 178.79 3hbn h LEU 24 N -0.41 0.83 -2.11 2.57 5.85 -1.00 -2.42 115.31 118.63 3hbn h LEU 24 Ca 0.00 0.01 0.08 0.00 0.84 0.00 0.00 57.88 58.81 3hbn h LEU 24 Cb 0.59 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 3hbn h LEU 24 CO 0.01 0.52 0.23 0.00 -0.34 0.00 0.00 178.44 178.87 3hbn h ALA 25 N 1.54 2.07 0.00 1.25 0.00 -0.63 -0.45 119.26 123.04 3hbn h ALA 25 Ca 0.38 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.28 3hbn h ALA 25 Cb 0.27 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3hbn h ALA 25 CO -0.15 -0.37 0.00 1.63 0.00 0.00 0.00 179.25 180.36 3hbn n LYS 26 N -4.12 0.03 0.11 0.00 5.02 -0.91 -1.92 118.16 116.37 3hbn n LYS 26 Ca 0.04 0.31 0.13 0.00 -2.02 0.00 0.00 58.31 56.77 3hbn n LYS 26 Cb 0.38 -1.57 0.42 0.00 -0.02 0.00 0.00 35.03 34.24 3hbn n LYS 26 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3hbn n GLN 27 N -1.64 0.25 -4.29 1.97 1.13 -0.18 -4.89 117.38 109.74 3hbn n GLN 27 Ca 0.03 0.23 -0.22 0.00 -1.94 0.00 0.00 57.00 55.09 3hbn n GLN 27 Cb 0.16 -1.81 -0.12 0.00 0.11 0.00 0.00 30.24 28.59 3hbn n GLN 27 CO 0.00 0.00 0.00 0.71 -1.44 0.00 0.00 177.06 176.33 3hbn s TYR 28 N -3.12 1.74 -0.13 1.08 2.02 -0.81 -5.07 117.35 113.06 3hbn s TYR 28 Ca 0.10 -0.45 0.17 0.00 -0.37 0.00 0.00 57.07 56.53 3hbn s TYR 28 Cb 0.12 -0.92 -0.23 0.00 -0.40 0.00 0.00 41.96 40.53 3hbn s TYR 28 CO 0.57 0.23 0.45 -1.13 -1.57 0.00 0.00 175.55 174.11 3hbn n SER 29 N 0.79 0.40 -3.96 2.29 3.41 -1.26 -4.71 113.62 110.58 3hbn n SER 29 Ca -0.17 0.18 -0.30 0.00 -0.26 0.00 0.00 58.87 58.31 3hbn n SER 29 Cb 0.55 0.73 -0.13 0.00 -0.26 0.00 0.00 64.21 65.11 3hbn n SER 29 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3hbn s ASP 30 N -5.52 4.65 -0.07 4.04 -1.08 -1.26 -5.08 116.67 112.35 3hbn s ASP 30 Ca -0.07 -3.30 0.03 0.00 -0.52 0.00 0.00 52.55 48.69 3hbn s ASP 30 Cb 0.08 -1.67 -0.02 0.00 -1.46 0.00 0.00 42.92 39.85 3hbn s ASP 30 CO 0.84 -0.20 -0.15 -0.69 0.52 0.00 0.00 175.17 175.49 3hbn s VAL 31 N -0.70 3.00 0.15 1.11 1.01 -1.26 -0.48 120.40 123.22 3hbn s VAL 31 Ca 0.20 -0.73 0.04 0.00 0.00 0.00 0.00 61.98 61.50 3hbn s VAL 31 Cb -0.18 -2.19 -0.04 0.00 0.00 0.00 0.00 36.38 33.96 3hbn s VAL 31 CO -0.06 0.57 -0.10 -0.44 0.00 0.00 0.00 175.10 175.07 3hbn s SER 32 N -0.38 1.79 0.12 3.32 0.01 -0.33 -4.18 113.70 114.06 3hbn s SER 32 Ca 0.04 -1.00 0.11 0.00 1.31 0.00 0.00 55.95 56.40 3hbn s SER 32 Cb -0.12 -0.01 -0.04 0.00 0.21 0.00 0.00 66.02 66.06 3hbn s SER 32 CO 0.02 -0.32 -0.26 -0.36 0.41 0.00 0.00 173.24 172.73 3hbn s PHE 33 N -3.28 2.23 -0.19 2.43 0.08 0.24 -0.54 117.98 118.94 3hbn s PHE 33 Ca 0.16 -0.39 0.01 0.00 0.12 0.00 0.00 56.93 56.84 3hbn s PHE 33 Cb 0.02 -1.21 0.03 0.00 -0.57 0.00 0.00 43.02 41.29 3hbn s PHE 33 CO 0.01 0.31 -0.17 0.00 -0.10 0.00 0.00 175.22 175.27 3hbn s ALA 34 N -1.07 2.30 0.02 5.36 0.00 0.42 0.05 121.76 128.84 3hbn s ALA 34 Ca 0.13 -1.29 0.02 0.00 0.00 0.00 0.00 51.96 50.82 3hbn s ALA 34 Cb -0.10 -1.25 -0.02 0.00 0.00 0.00 0.00 23.12 21.75 3hbn s ALA 34 CO 0.06 -0.54 -0.07 0.00 0.00 0.00 0.00 175.76 175.21 3hbn s LEU 36 N -1.02 4.61 -0.09 0.00 1.43 -1.26 -1.15 118.68 121.20 3hbn s LEU 36 Ca -0.06 1.84 -0.30 0.00 -1.03 0.00 0.00 54.13 54.59 3hbn s LEU 36 Cb -0.07 -3.52 -0.04 0.00 0.03 0.00 0.00 46.19 42.60 3hbn s LEU 36 CO 0.00 0.14 1.40 -2.16 0.23 0.00 0.00 176.35 175.96 3hbn s PRO 37 N -0.99 4.24 0.05 1.29 0.04 -1.26 -4.86 135.00 133.51 3hbn s PRO 37 Ca 0.40 1.88 0.02 0.00 0.04 0.00 0.00 61.00 63.34 3hbn s PRO 37 Cb -0.25 -3.77 -0.03 0.00 0.04 0.00 0.00 34.50 30.50 3hbn s PRO 37 CO 0.30 -0.70 -0.08 -0.51 0.04 0.00 0.00 177.00 176.06 3hbn s LEU 38 N 3.31 2.28 0.14 -3.56 1.43 -1.26 -5.10 118.68 115.92 3hbn s LEU 38 Ca 0.62 -0.60 -0.31 0.00 -1.03 0.00 0.00 54.13 52.81 3hbn s LEU 38 Cb -0.27 -0.15 -0.11 0.00 0.03 0.00 0.00 46.19 45.69 3hbn s LEU 38 CO 0.22 -0.23 1.78 -0.70 0.23 0.00 0.00 176.35 177.65 3hbn s GLU 39 N -1.81 4.14 0.00 1.70 2.56 -1.26 -2.00 118.70 122.03 3hbn s GLU 39 Ca -0.08 2.57 0.00 0.00 0.00 0.00 0.00 54.97 57.46 3hbn s GLU 39 Cb -0.08 -3.46 0.00 0.00 2.00 0.00 0.00 34.13 32.58 3hbn s GLU 39 CO -0.00 -0.81 0.00 0.41 -0.56 0.00 0.00 175.26 174.30 3hbn n GLY 40 N 4.15 0.62 3.62 -1.50 0.00 -1.26 -1.55 105.19 109.26 3hbn n GLY 40 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 3hbn n GLY 40 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hbn s SER 41 N -2.12 2.40 -0.18 1.61 1.04 -0.85 -4.03 113.70 111.56 3hbn s SER 41 Ca 0.00 1.88 0.12 0.00 0.48 0.00 0.00 55.95 58.43 3hbn s SER 41 Cb 0.00 -2.44 0.67 0.00 0.10 0.00 0.00 66.02 64.35 3hbn s SER 41 CO 0.00 -3.38 1.53 0.18 0.98 0.00 0.00 173.24 172.55 3hbn n LEU 42 N -4.40 4.77 -0.34 2.42 4.77 -1.26 -4.65 117.00 118.30 3hbn n LEU 42 Ca 0.08 -2.42 0.12 0.00 -0.03 0.00 0.00 56.01 53.77 3hbn n LEU 42 Cb 0.53 -0.63 0.31 0.00 -2.33 0.00 0.00 43.42 41.30 3hbn n LEU 42 CO 0.53 0.59 1.17 0.40 -1.33 0.00 0.00 177.39 178.76 3hbn h ILE 43 N 3.36 0.70 0.00 -0.08 2.04 -1.92 0.25 117.51 121.85 3hbn h ILE 43 Ca 0.00 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.61 3hbn h ILE 43 Cb 1.63 -0.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.62 3hbn h ILE 43 CO 0.37 0.13 0.00 0.47 0.00 0.00 0.00 178.15 179.12 3hbn n ASP 44 N -4.80 0.21 -0.48 1.72 8.00 -1.26 -2.11 116.55 117.84 3hbn n ASP 44 Ca 0.22 0.56 0.12 0.00 0.71 0.00 0.00 54.79 56.40 3hbn n ASP 44 Cb 0.56 -0.60 0.09 0.00 -0.02 0.00 0.00 41.12 41.15 3hbn n ASP 44 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3hbn n GLU 45 N -1.74 1.23 -3.02 -1.24 -0.58 0.86 -4.88 120.64 111.28 3hbn n GLU 45 Ca 0.03 -0.97 -0.43 0.00 -0.42 0.00 0.00 57.16 55.37 3hbn n GLU 45 Cb 0.17 -1.48 -0.06 0.00 -0.57 0.00 0.00 31.44 29.50 3hbn n GLU 45 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 3hbn s ILE 46 N -2.44 4.72 -0.29 -3.67 1.01 -0.90 -4.95 121.20 114.68 3hbn s ILE 46 Ca 0.21 0.26 -0.02 0.00 0.00 0.00 0.00 60.65 61.10 3hbn s ILE 46 Cb 0.19 -4.28 0.12 0.00 0.01 0.00 0.00 42.46 38.49 3hbn s ILE 46 CO 0.54 -0.69 2.31 -0.81 0.00 0.00 0.00 174.94 176.29 3hbn n PRO 47 N 6.54 1.87 -4.12 2.79 -0.04 -1.26 -4.82 135.00 135.95 3hbn n PRO 47 Ca 0.00 -1.53 -0.09 0.00 -0.04 0.00 0.00 63.50 61.85 3hbn n PRO 47 Cb 0.48 -1.70 -0.10 0.00 -0.04 0.00 0.00 33.50 32.14 3hbn n PRO 47 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3hbn s TYR 48 N -1.39 0.70 0.11 0.54 2.02 -1.26 -5.11 117.35 112.96 3hbn s TYR 48 Ca 0.37 -1.10 -0.35 0.00 -0.37 0.00 0.00 57.07 55.62 3hbn s TYR 48 Cb 0.25 -0.45 -0.14 0.00 -0.40 0.00 0.00 41.96 41.22 3hbn s TYR 48 CO -0.05 -0.39 1.55 -2.30 -1.57 0.00 0.00 175.55 172.79 3hbn n PRO 49 N 0.01 1.89 -3.99 -1.71 -0.02 -1.26 -4.80 135.00 125.12 3hbn n PRO 49 Ca -0.11 0.68 -0.34 0.00 -2.02 0.00 0.00 63.50 61.72 3hbn n PRO 49 Cb 0.62 -2.43 -0.14 0.00 -0.02 0.00 0.00 33.50 31.53 3hbn n PRO 49 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3hbn s VAL 50 N 1.15 2.61 -0.10 -1.45 1.01 -1.26 -0.60 120.40 121.77 3hbn s VAL 50 Ca 0.82 -1.38 -0.30 0.00 0.00 0.00 0.00 61.98 61.12 3hbn s VAL 50 Cb -0.76 -2.46 -0.02 0.00 0.00 0.00 0.00 36.38 33.15 3hbn s VAL 50 CO 0.42 0.02 1.17 -0.31 0.00 0.00 0.00 175.10 176.40 3hbn s TYR 51 N 1.21 3.19 -0.35 5.22 2.02 0.11 -4.94 117.35 123.80 3hbn s TYR 51 Ca -0.05 1.26 -0.23 0.00 -0.37 0.00 0.00 57.07 57.67 3hbn s TYR 51 Cb -0.19 -3.39 0.01 0.00 -0.40 0.00 0.00 41.96 37.99 3hbn s TYR 51 CO -0.04 -1.15 0.79 -2.00 -1.57 0.00 0.00 175.55 171.58 3hbn s GLU 52 N 2.51 3.79 0.11 -0.62 2.12 -1.26 -1.17 118.70 124.18 3hbn s GLU 52 Ca 0.53 0.36 -0.30 0.00 0.36 0.00 0.00 54.97 55.92 3hbn s GLU 52 Cb -0.22 -3.80 -0.06 0.00 0.26 0.00 0.00 34.13 30.31 3hbn s GLU 52 CO 0.19 -0.82 0.99 -0.51 -0.54 0.00 0.00 175.26 174.56 3hbn s LEU 53 N 3.08 4.48 0.28 2.70 1.43 -0.30 -4.96 118.68 125.40 3hbn s LEU 53 Ca 0.32 1.83 0.21 0.00 -1.03 0.00 0.00 54.13 55.46 3hbn s LEU 53 Cb -0.13 -3.59 0.11 0.00 0.03 0.00 0.00 46.19 42.61 3hbn s LEU 53 CO 0.16 -0.12 1.26 0.28 0.23 0.00 0.00 176.35 178.16 3hbn h SER 54 N 5.65 0.00 -5.37 2.29 0.02 -1.96 -3.40 113.55 110.79 3hbn h SER 54 Ca -0.43 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.39 3hbn h SER 54 Cb 1.21 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 63.64 3hbn h SER 54 CO 0.72 0.12 -0.31 -0.94 -1.14 0.00 0.00 176.83 175.28 3hbn s SER 55 N -5.83 0.01 0.00 3.07 1.04 -1.26 -5.02 113.70 105.71 3hbn s SER 55 Ca 0.02 -1.09 0.26 0.00 0.48 0.00 0.00 55.95 55.62 3hbn s SER 55 Cb 0.08 0.50 1.48 0.00 0.10 0.00 0.00 66.02 68.18 3hbn s SER 55 CO 0.75 -1.02 1.96 -0.62 0.98 0.00 0.00 173.24 175.29 3hbn n GLU 56 N -0.33 1.12 -1.68 4.02 1.02 -1.26 -4.92 120.64 118.61 3hbn n GLU 56 Ca -0.01 -0.18 -0.48 0.00 -0.02 0.00 0.00 57.16 56.48 3hbn n GLU 56 Cb 0.63 -1.42 -0.05 0.00 -0.02 0.00 0.00 31.44 30.59 3hbn n GLU 56 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3hbn n SER 57 N -0.72 3.30 0.25 1.62 2.88 -1.26 -4.87 113.62 114.83 3hbn n SER 57 Ca 0.20 1.01 0.09 0.00 -1.33 0.00 0.00 58.87 58.84 3hbn n SER 57 Cb 0.14 -1.38 0.67 0.00 -0.75 0.00 0.00 64.21 62.88 3hbn n SER 57 CO 0.00 0.00 0.00 -0.29 -1.23 0.00 0.00 175.04 173.52 3hbn h ILE 58 N 4.88 0.94 0.00 2.46 6.09 -2.01 -1.67 117.51 128.21 3hbn h ILE 58 Ca -0.47 0.00 -0.06 0.00 -1.37 0.00 0.00 64.86 62.95 3hbn h ILE 58 Cb 1.27 0.98 -0.01 0.00 0.47 0.00 0.00 36.82 39.53 3hbn h ILE 58 CO 0.93 0.00 -0.30 1.88 -3.07 0.00 0.00 178.15 177.59 3hbn h TYR 59 N 0.00 0.00 -0.53 2.19 0.05 -1.99 -1.56 116.97 115.13 3hbn h TYR 59 Ca 0.01 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.72 3hbn h TYR 59 Cb 0.06 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.78 3hbn h TYR 59 CO 0.00 0.30 0.06 1.49 -1.05 0.00 0.00 178.16 178.96 3hbn h GLU 60 N 0.00 0.90 -0.45 4.88 4.81 -1.68 -0.79 114.58 122.25 3hbn h GLU 60 Ca -0.00 -0.26 -0.04 0.00 -0.13 0.00 0.00 59.36 58.93 3hbn h GLU 60 Cb 0.81 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 30.08 3hbn h GLU 60 CO 0.04 0.89 0.11 1.25 -0.73 0.00 0.00 179.01 180.58 3hbn h LEU 61 N 0.79 0.69 -0.62 1.64 5.85 -1.43 -2.34 115.31 119.88 3hbn h LEU 61 Ca 0.16 -0.23 0.04 0.00 0.84 0.00 0.00 57.88 58.69 3hbn h LEU 61 Cb 0.45 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.25 3hbn h LEU 61 CO 0.02 0.74 0.35 0.40 -0.34 0.00 0.00 178.44 179.61 3hbn h ILE 62 N 0.60 1.01 -0.70 4.05 2.04 -1.20 -1.49 117.51 121.83 3hbn h ILE 62 Ca 0.14 -0.23 0.05 0.00 1.00 0.00 0.00 64.86 65.82 3hbn h ILE 62 Cb 0.32 0.28 -0.05 0.00 -0.74 0.00 0.00 36.82 36.62 3hbn h ILE 62 CO 0.00 0.12 0.42 -1.13 0.00 0.00 0.00 178.15 177.56 3hbn h ASN 63 N 0.68 0.66 -0.66 1.72 -1.24 -0.98 -1.63 115.58 114.13 3hbn h ASN 63 Ca 0.26 0.01 -0.07 0.00 0.71 0.00 0.00 56.30 57.22 3hbn h ASN 63 Cb 0.10 -0.12 -0.03 0.00 0.73 0.00 0.00 38.32 39.00 3hbn h ASN 63 CO -0.14 0.44 0.14 0.25 -1.29 0.00 0.00 177.43 176.82 3hbn h LEU 64 N 0.79 1.02 -0.33 0.34 5.85 -0.94 -0.93 115.31 121.11 3hbn h LEU 64 Ca 0.30 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 3hbn h LEU 64 Cb 0.11 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 3hbn h LEU 64 CO -0.15 1.00 0.17 0.40 -0.34 0.00 0.00 178.44 179.53 3hbn h ILE 65 N 0.99 1.15 -0.19 4.05 2.04 -0.90 -2.34 117.51 122.31 3hbn h ILE 65 Ca 0.20 -0.42 -0.03 0.00 1.00 0.00 0.00 64.86 65.61 3hbn h ILE 65 Cb 0.40 0.82 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 3hbn h ILE 65 CO 0.01 0.16 -0.01 0.11 0.00 0.00 0.00 178.15 178.41 3hbn h LYS 66 N 0.41 0.35 -0.56 2.37 1.57 -1.14 -1.75 116.57 117.81 3hbn h LYS 66 Ca 0.12 -0.12 -0.10 0.00 -1.87 0.00 0.00 60.65 58.68 3hbn h LYS 66 Cb 0.10 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 3hbn h LYS 66 CO -0.02 0.56 -0.05 0.93 -0.57 0.00 0.00 179.45 180.31 3hbn h GLU 67 N 0.09 1.02 -0.01 3.15 4.39 -1.15 -2.99 114.58 119.08 3hbn h GLU 67 Ca 0.05 -0.35 0.00 0.00 0.34 0.00 0.00 59.36 59.40 3hbn h GLU 67 Cb 0.41 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 28.98 3hbn h GLU 67 CO 0.01 1.04 -0.20 0.39 -1.16 0.00 0.00 179.01 179.09 3hbn n GLU 68 N -4.19 1.22 -3.66 2.33 -0.58 -0.88 -4.99 120.64 109.89 3hbn n GLU 68 Ca 0.02 -0.79 -0.23 0.00 -0.42 0.00 0.00 57.16 55.74 3hbn n GLU 68 Cb 0.37 -1.48 0.05 0.00 -0.57 0.00 0.00 31.44 29.81 3hbn n GLU 68 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3hbn n LYS 69 N -0.19 -5.98 -2.09 3.49 5.02 -0.68 -4.95 118.16 112.78 3hbn n LYS 69 Ca 0.14 0.71 -0.40 0.00 -2.02 0.00 0.00 58.31 56.74 3hbn n LYS 69 Cb 0.38 -5.53 -0.01 0.00 -0.02 0.00 0.00 35.03 29.85 3hbn n LYS 69 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 3hbn s PHE 70 N -3.46 2.88 -0.11 2.13 0.08 -1.08 -4.82 117.98 113.61 3hbn s PHE 70 Ca 0.24 1.42 0.16 0.00 0.12 0.00 0.00 56.93 58.87 3hbn s PHE 70 Cb -0.11 -3.65 -0.24 0.00 -0.57 0.00 0.00 43.02 38.45 3hbn s PHE 70 CO 0.78 -1.98 0.20 0.39 -0.10 0.00 0.00 175.22 174.52 3hbn n GLU 71 N 0.25 0.95 -4.47 0.44 1.02 -0.13 -4.85 120.64 113.85 3hbn n GLU 71 Ca 0.03 -0.08 -0.24 0.00 -0.02 0.00 0.00 57.16 56.86 3hbn n GLU 71 Cb 0.43 -1.43 -0.17 0.00 -0.02 0.00 0.00 31.44 30.26 3hbn n GLU 71 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3hbn s LEU 72 N -4.82 1.56 -0.18 -4.62 2.96 -0.99 -2.54 118.68 110.05 3hbn s LEU 72 Ca -0.08 -0.26 -0.04 0.00 -0.22 0.00 0.00 54.13 53.54 3hbn s LEU 72 Cb 0.08 -0.74 -0.02 0.00 0.50 0.00 0.00 46.19 46.01 3hbn s LEU 72 CO 0.72 0.01 -0.04 -0.22 -1.32 0.00 0.00 176.35 175.50 3hbn s LEU 73 N 0.75 3.09 -0.30 -0.68 2.96 0.41 -0.87 118.68 124.04 3hbn s LEU 73 Ca -0.13 -0.24 -0.07 0.00 -0.22 0.00 0.00 54.13 53.47 3hbn s LEU 73 Cb -0.15 -1.76 0.01 0.00 0.50 0.00 0.00 46.19 44.79 3hbn s LEU 73 CO 0.03 0.09 0.08 -0.63 -1.32 0.00 0.00 176.35 174.59 3hbn s ILE 74 N 0.83 3.89 -0.24 6.68 1.01 0.20 -0.70 121.20 132.87 3hbn s ILE 74 Ca -0.01 -0.77 -0.09 0.00 0.00 0.00 0.00 60.65 59.77 3hbn s ILE 74 Cb -0.15 -3.03 -0.04 0.00 0.01 0.00 0.00 42.46 39.25 3hbn s ILE 74 CO 0.02 0.05 0.12 -0.63 0.00 0.00 0.00 174.94 174.49 3hbn s ILE 75 N 1.48 4.93 -0.48 2.92 1.01 0.20 -0.37 121.20 130.89 3hbn s ILE 75 Ca 0.02 0.03 0.05 0.00 0.00 0.00 0.00 60.65 60.75 3hbn s ILE 75 Cb -0.17 -3.30 0.19 0.00 0.01 0.00 0.00 42.46 39.19 3hbn s ILE 75 CO 0.02 0.34 0.43 -0.67 0.00 0.00 0.00 174.94 175.06 3hbn n ASP 76 N 4.51 0.57 -3.53 3.58 -0.08 -0.33 -0.99 116.55 120.28 3hbn n ASP 76 Ca -0.15 -2.66 -0.02 0.00 -1.51 0.00 0.00 54.79 50.45 3hbn n ASP 76 Cb 0.52 -0.61 -0.05 0.00 2.34 0.00 0.00 41.12 43.32 3hbn n ASP 76 CO 0.00 0.00 0.00 -2.28 0.12 0.00 0.00 177.20 175.04 3hbn s HIS 77 N -0.62 -1.26 -0.38 -0.67 2.46 -1.26 -4.32 115.29 109.23 3hbn s HIS 77 Ca 0.32 1.97 0.24 0.00 0.47 0.00 0.00 55.06 58.06 3hbn s HIS 77 Cb 0.06 0.62 1.06 0.00 -0.13 0.00 0.00 32.58 34.18 3hbn s HIS 77 CO -0.17 -0.68 1.72 0.66 -2.47 0.00 0.00 174.74 173.81 3hbn n TYR 78 N 5.43 0.85 1.14 3.88 4.01 -1.26 -2.41 117.16 128.80 3hbn n TYR 78 Ca -0.09 0.36 0.12 0.00 -0.16 0.00 0.00 57.90 58.13 3hbn n TYR 78 Cb 0.50 -1.07 0.35 0.00 -0.31 0.00 0.00 39.34 38.80 3hbn n TYR 78 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hbn n GLY 79 N -0.29 0.55 3.44 2.72 0.00 -1.26 -4.79 105.19 105.56 3hbn n GLY 79 Ca 0.01 -0.53 -0.39 0.00 0.00 0.00 0.00 46.02 45.10 3hbn n GLY 79 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hbn s ILE 80 N -1.87 4.69 0.62 -0.61 -1.09 -1.01 -5.09 121.20 116.85 3hbn s ILE 80 Ca 0.34 -0.50 -0.04 0.00 -2.23 0.00 0.00 60.65 58.22 3hbn s ILE 80 Cb 0.20 -3.45 0.04 0.00 -1.58 0.00 0.00 42.46 37.66 3hbn s ILE 80 CO 0.30 -0.02 0.91 -0.94 -1.23 0.00 0.00 174.94 173.96 3hbn s SER 81 N 1.61 5.20 0.27 3.58 1.04 -1.26 -4.89 113.70 119.25 3hbn s SER 81 Ca 0.04 0.42 -0.01 0.00 0.48 0.00 0.00 55.95 56.88 3hbn s SER 81 Cb -0.18 -1.26 0.48 0.00 0.10 0.00 0.00 66.02 65.17 3hbn s SER 81 CO 0.07 -1.29 1.82 1.62 0.98 0.00 0.00 173.24 176.45 3hbn h VAL 82 N -0.27 0.91 -0.53 5.02 3.04 -1.98 -1.10 116.25 121.35 3hbn h VAL 82 Ca -0.44 -0.31 -0.06 0.00 -1.01 0.00 0.00 66.70 64.88 3hbn h VAL 82 Cb 1.29 -0.07 -0.02 0.00 -2.01 0.00 0.00 31.29 30.48 3hbn h VAL 82 CO 0.58 0.16 0.10 0.44 -1.01 0.00 0.00 177.57 177.85 3hbn h ASP 83 N 0.90 0.77 -0.54 3.17 3.32 -1.96 -1.31 116.42 120.77 3hbn h ASP 83 Ca 0.45 -0.15 -0.00 0.00 0.02 0.00 0.00 57.03 57.35 3hbn h ASP 83 Cb 0.43 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.76 3hbn h ASP 83 CO -0.26 0.78 0.32 0.44 -1.72 0.00 0.00 179.24 178.80 3hbn h ASP 84 N 0.79 0.66 -0.40 6.45 3.32 -1.72 -1.13 116.42 124.39 3hbn h ASP 84 Ca 0.17 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 3hbn h ASP 84 Cb 0.33 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 3hbn h ASP 84 CO 0.00 0.53 0.21 -0.33 -1.72 0.00 0.00 179.24 177.93 3hbn h GLU 85 N 0.73 0.56 -0.58 3.56 5.08 -0.91 0.02 114.58 123.04 3hbn h GLU 85 Ca 0.19 -0.07 0.05 0.00 -1.00 0.00 0.00 59.36 58.54 3hbn h GLU 85 Cb -0.00 -0.11 -0.05 0.00 0.50 0.00 0.00 28.75 29.09 3hbn h GLU 85 CO -0.04 0.46 0.30 0.87 -1.00 0.00 0.00 179.01 179.60 3hbn h LYS 86 N 0.51 0.55 -0.35 2.33 1.57 -1.07 -0.69 116.57 119.42 3hbn h LYS 86 Ca 0.14 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.85 3hbn h LYS 86 Cb 0.07 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 3hbn h LYS 86 CO -0.02 0.36 0.06 1.25 -0.57 0.00 0.00 179.45 180.54 3hbn h LEU 87 N 0.57 0.54 -0.41 2.94 5.85 -0.92 -0.81 115.31 123.06 3hbn h LEU 87 Ca 0.26 -0.25 0.06 0.00 0.84 0.00 0.00 57.88 58.79 3hbn h LEU 87 Cb 0.17 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 41.00 3hbn h LEU 87 CO -0.18 0.66 0.09 0.40 -0.34 0.00 0.00 178.44 179.08 3hbn h ILE 88 N 0.41 0.80 0.04 4.05 2.04 -0.72 -0.25 117.51 123.89 3hbn h ILE 88 Ca 0.11 -0.08 0.01 0.00 1.00 0.00 0.00 64.86 65.90 3hbn h ILE 88 Cb 0.34 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 3hbn h ILE 88 CO 0.01 0.04 -0.09 0.50 0.00 0.00 0.00 178.15 178.60 3hbn h LYS 89 N 0.23 -0.18 -0.60 2.37 1.63 -0.82 -1.11 116.57 118.09 3hbn h LYS 89 Ca 0.20 0.01 0.03 0.00 -0.85 0.00 0.00 60.65 60.04 3hbn h LYS 89 Cb 0.23 0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 31.86 3hbn h LYS 89 CO -0.25 -0.12 0.35 1.25 -3.45 0.00 0.00 179.45 177.24 3hbn h LEU 90 N -0.18 0.56 0.00 5.20 5.85 -0.91 0.78 115.31 126.60 3hbn h LEU 90 Ca 0.02 0.01 -0.15 0.00 0.84 0.00 0.00 57.88 58.60 3hbn h LEU 90 Cb 0.20 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 3hbn h LEU 90 CO -0.06 0.39 -0.82 -0.33 -0.34 0.00 0.00 178.44 177.28 3hbn h GLU 91 N 0.69 0.00 0.00 1.25 4.39 -0.88 -3.39 114.58 116.63 3hbn h GLU 91 Ca 0.25 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.95 3hbn h GLU 91 Cb 0.06 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.71 3hbn h GLU 91 CO -0.12 0.64 -1.00 0.25 -1.16 0.00 0.00 179.01 177.62 3hbn n THR 92 N -3.22 0.00 -0.95 1.13 -2.24 -0.44 -5.02 114.28 103.55 3hbn n THR 92 Ca -0.01 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 3hbn n THR 92 Cb 0.83 -0.49 0.00 0.00 -2.10 0.00 0.00 70.33 68.57 3hbn n THR 92 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hbn n GLY 93 N 2.83 0.29 3.76 3.38 0.00 0.26 -4.99 105.19 110.72 3hbn n GLY 93 Ca -0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 3hbn n GLY 93 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hbn s VAL 94 N -1.68 2.72 0.25 1.61 0.11 -1.26 -4.99 120.40 117.16 3hbn s VAL 94 Ca 0.00 0.49 -0.30 0.00 -2.93 0.00 0.00 61.98 59.24 3hbn s VAL 94 Cb 0.00 -3.22 -0.09 0.00 -1.53 0.00 0.00 36.38 31.54 3hbn s VAL 94 CO 0.00 -0.06 1.04 -0.75 -3.33 0.00 0.00 175.10 172.00 3hbn s LYS 95 N -3.09 4.71 -0.13 1.54 2.20 -1.05 -4.82 119.74 119.11 3hbn s LYS 95 Ca 0.72 1.67 0.02 0.00 -0.36 0.00 0.00 55.97 58.02 3hbn s LYS 95 Cb -0.31 -3.24 0.01 0.00 -1.51 0.00 0.00 37.83 32.78 3hbn s LYS 95 CO 0.35 0.30 -0.19 0.42 -0.36 0.00 0.00 175.35 175.87 3hbn s ILE 96 N -1.00 1.81 -0.23 5.43 1.01 -1.26 -0.45 121.20 126.52 3hbn s ILE 96 Ca 0.44 -0.83 -0.06 0.00 0.00 0.00 0.00 60.65 60.20 3hbn s ILE 96 Cb -0.29 -1.62 -0.03 0.00 0.01 0.00 0.00 42.46 40.53 3hbn s ILE 96 CO 0.37 0.50 0.03 -0.22 0.00 0.00 0.00 174.94 175.62 3hbn s LEU 97 N 0.90 3.34 -0.15 2.97 0.20 0.12 -0.26 118.68 125.81 3hbn s LEU 97 Ca -0.07 -0.21 -0.01 0.00 0.69 0.00 0.00 54.13 54.54 3hbn s LEU 97 Cb -0.15 -1.87 -0.02 0.00 -0.43 0.00 0.00 46.19 43.72 3hbn s LEU 97 CO -0.02 0.01 -0.11 -0.44 -0.29 0.00 0.00 176.35 175.51 3hbn s SER 98 N 1.31 4.15 0.38 3.68 0.01 -0.19 -0.63 113.70 122.41 3hbn s SER 98 Ca 0.04 -0.31 -0.25 0.00 1.31 0.00 0.00 55.95 56.74 3hbn s SER 98 Cb -0.15 -1.65 -0.09 0.00 0.21 0.00 0.00 66.02 64.35 3hbn s SER 98 CO 0.02 0.14 1.08 -0.36 0.41 0.00 0.00 173.24 174.53 3hbn s PHE 99 N 0.51 3.28 -0.02 2.43 0.08 -0.16 -0.90 117.98 123.21 3hbn s PHE 99 Ca -0.07 1.64 -0.02 0.00 0.12 0.00 0.00 56.93 58.60 3hbn s PHE 99 Cb -0.15 -3.20 0.00 0.00 -0.57 0.00 0.00 43.02 39.10 3hbn s PHE 99 CO 0.04 -0.74 0.05 0.34 -0.10 0.00 0.00 175.22 174.81 3hbn s ASP 100 N -1.37 -0.05 0.00 1.36 2.15 -0.20 -4.79 116.67 113.77 3hbn s ASP 100 Ca 0.55 0.09 0.00 0.00 0.43 0.00 0.00 52.55 53.63 3hbn s ASP 100 Cb -0.25 0.11 0.00 0.00 -0.30 0.00 0.00 42.92 42.47 3hbn s ASP 100 CO 0.32 -0.03 0.00 0.47 -0.17 0.00 0.00 175.17 175.76 3hbn n ASP 101 N 3.02 1.20 -0.11 -0.34 8.00 -1.26 -4.19 116.55 122.87 3hbn n ASP 101 Ca -0.12 -0.37 0.04 0.00 0.71 0.00 0.00 54.79 55.04 3hbn n ASP 101 Cb 0.60 0.99 -0.01 0.00 -0.02 0.00 0.00 41.12 42.67 3hbn n ASP 101 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3hbn n GLU 102 N -1.11 3.09 -2.24 -1.24 1.02 -1.26 -4.80 120.64 114.10 3hbn n GLU 102 Ca 0.00 -0.34 -0.02 0.00 -0.02 0.00 0.00 57.16 56.78 3hbn n GLU 102 Cb 0.00 -0.94 0.00 0.00 -0.02 0.00 0.00 31.44 30.48 3hbn n GLU 102 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 3hbn n ILE 103 N -0.60 -6.09 -4.26 -3.67 5.41 -1.26 -4.90 119.36 104.00 3hbn n ILE 103 Ca 0.02 0.14 -0.16 0.00 1.00 0.00 0.00 62.75 63.75 3hbn n ILE 103 Cb 0.14 -5.44 -0.11 0.00 -0.71 0.00 0.00 39.64 33.53 3hbn n ILE 103 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 3hbn s LYS 104 N -2.46 1.07 0.49 0.38 1.02 -1.26 -5.12 119.74 113.86 3hbn s LYS 104 Ca 0.06 -1.36 -0.21 0.00 0.02 0.00 0.00 55.97 54.48 3hbn s LYS 104 Cb -0.02 -0.81 -0.08 0.00 -0.52 0.00 0.00 37.83 36.41 3hbn s LYS 104 CO 0.38 0.13 1.08 -1.25 -0.92 0.00 0.00 175.35 174.77 3hbn s PRO 105 N -3.22 3.73 0.01 -1.68 0.04 -1.26 -4.97 135.00 127.65 3hbn s PRO 105 Ca 0.14 1.49 -0.01 0.00 0.04 0.00 0.00 61.00 62.66 3hbn s PRO 105 Cb -0.01 -2.16 -0.01 0.00 0.04 0.00 0.00 34.50 32.35 3hbn s PRO 105 CO 0.02 -0.52 -0.01 -1.01 0.04 0.00 0.00 177.00 175.53 3hbn s HIS 106 N -1.84 0.20 -0.84 0.56 3.76 -0.70 -4.56 115.29 111.87 3hbn s HIS 106 Ca 0.67 -0.40 -0.10 0.00 -0.15 0.00 0.00 55.06 55.07 3hbn s HIS 106 Cb -0.20 -0.15 0.22 0.00 1.11 0.00 0.00 32.58 33.56 3hbn s HIS 106 CO 0.24 -0.17 0.77 -1.58 -0.85 0.00 0.00 174.74 173.15 3hbn s HIS 107 N -1.22 3.79 0.15 1.40 2.46 -1.26 -4.08 115.29 116.53 3hbn s HIS 107 Ca -0.13 -2.31 -0.03 0.00 0.47 0.00 0.00 55.06 53.06 3hbn s HIS 107 Cb -0.08 -3.68 -0.03 0.00 -0.13 0.00 0.00 32.58 28.66 3hbn s HIS 107 CO -0.01 -0.94 0.13 0.00 -2.47 0.00 0.00 174.74 171.45 3hbn n ASP 109 N -0.14 0.88 -3.87 0.00 8.00 0.65 -4.49 116.55 117.56 3hbn n ASP 109 Ca -0.05 0.40 -0.18 0.00 0.71 0.00 0.00 54.79 55.67 3hbn n ASP 109 Cb 0.64 0.05 -0.16 0.00 -0.02 0.00 0.00 41.12 41.63 3hbn n ASP 109 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3hbn s ILE 110 N -2.79 0.38 -0.19 0.53 1.01 -0.86 -0.89 121.20 118.39 3hbn s ILE 110 Ca -0.04 -0.05 -0.05 0.00 0.00 0.00 0.00 60.65 60.51 3hbn s ILE 110 Cb 0.08 -0.42 -0.03 0.00 0.01 0.00 0.00 42.46 42.11 3hbn s ILE 110 CO 0.82 0.18 -0.00 -0.22 0.00 0.00 0.00 174.94 175.71 3hbn s LEU 111 N 0.82 3.29 -0.21 2.97 1.98 -0.08 -1.02 118.68 126.42 3hbn s LEU 111 Ca -0.10 -0.17 0.02 0.00 -2.89 0.00 0.00 54.13 50.99 3hbn s LEU 111 Cb -0.13 -1.83 0.04 0.00 0.66 0.00 0.00 46.19 44.93 3hbn s LEU 111 CO -0.01 0.09 -0.15 -0.22 -1.89 0.00 0.00 176.35 174.17 3hbn s LEU 112 N 0.88 2.65 -0.32 -0.68 2.96 -0.08 0.01 118.68 124.09 3hbn s LEU 112 Ca 0.01 -0.96 0.04 0.00 -0.22 0.00 0.00 54.13 52.99 3hbn s LEU 112 Cb -0.14 -1.47 0.09 0.00 0.50 0.00 0.00 46.19 45.16 3hbn s LEU 112 CO 0.02 -0.09 0.02 0.21 -1.32 0.00 0.00 176.35 175.19 3hbn s ASN 113 N 1.23 4.71 0.00 3.68 3.84 0.05 -1.03 114.94 127.42 3hbn s ASN 113 Ca -0.01 -1.97 0.21 0.00 0.21 0.00 0.00 52.86 51.29 3hbn s ASN 113 Cb -0.16 -1.62 1.13 0.00 -0.55 0.00 0.00 41.25 40.05 3hbn s ASN 113 CO -0.09 -0.34 1.74 1.33 -2.79 0.00 0.00 177.10 176.95 3hbn n VAL 114 N 4.30 0.04 -3.08 -5.21 0.24 -1.26 -1.24 118.33 112.13 3hbn n VAL 114 Ca -0.00 -0.08 -0.37 0.00 -2.04 0.00 0.00 64.34 61.84 3hbn n VAL 114 Cb 0.42 -0.15 -0.06 0.00 -1.47 0.00 0.00 33.84 32.58 3hbn n VAL 114 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 3hbn s ASN 115 N -1.64 7.16 0.42 -1.34 0.01 -1.26 -4.15 114.94 114.14 3hbn s ASN 115 Ca 0.31 1.48 0.13 0.00 -0.71 0.00 0.00 52.86 54.08 3hbn s ASN 115 Cb 0.15 -2.44 1.00 0.00 0.41 0.00 0.00 41.25 40.37 3hbn s ASN 115 CO 0.25 0.11 1.96 0.00 -1.51 0.00 0.00 177.10 177.90 3hbn h ALA 116 N 3.79 2.00 0.00 0.60 0.00 -1.89 -2.59 119.26 121.17 3hbn h ALA 116 Ca -0.48 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.40 3hbn h ALA 116 Cb 1.20 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 3hbn h ALA 116 CO 0.65 -0.15 -0.11 0.10 0.00 0.00 0.00 179.25 179.74 3hbn h TYR 117 N 0.46 0.00 -3.84 0.00 -0.00 -1.93 -3.40 116.97 108.26 3hbn h TYR 117 Ca 0.31 0.00 -0.48 0.00 0.00 0.00 0.00 58.73 58.56 3hbn h TYR 117 Cb 0.59 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.31 3hbn h TYR 117 CO -0.00 0.11 0.37 0.00 -0.00 0.00 0.00 178.16 178.64 3hbn s ALA 118 N -4.18 3.27 0.03 0.10 0.00 -0.98 -4.99 121.76 114.99 3hbn s ALA 118 Ca -0.03 0.63 0.05 0.00 0.00 0.00 0.00 51.96 52.61 3hbn s ALA 118 Cb 0.13 -3.22 -0.02 0.00 0.00 0.00 0.00 23.12 20.01 3hbn s ALA 118 CO 0.58 0.10 -0.16 0.15 0.00 0.00 0.00 175.76 176.43 3hbn s LYS 119 N -1.72 1.13 0.45 0.00 1.02 -1.26 -3.44 119.74 115.92 3hbn s LYS 119 Ca 0.47 -0.74 0.16 0.00 0.02 0.00 0.00 55.97 55.88 3hbn s LYS 119 Cb -0.23 -1.15 1.10 0.00 -0.52 0.00 0.00 37.83 37.03 3hbn s LYS 119 CO 0.29 0.30 1.98 0.00 -0.92 0.00 0.00 175.35 177.00 3hbn h ALA 120 N 5.15 2.12 0.00 5.17 0.00 -1.90 -0.76 119.26 129.04 3hbn h ALA 120 Ca -0.38 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 3hbn h ALA 120 Cb 1.17 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 3hbn h ALA 120 CO 0.45 -0.26 -0.07 0.66 0.00 0.00 0.00 179.25 180.04 3hbn h SER 121 N 0.33 0.00 -0.30 0.00 4.64 -1.98 -1.50 113.55 114.74 3hbn h SER 121 Ca 0.28 0.00 0.09 0.00 -0.47 0.00 0.00 61.79 61.69 3hbn h SER 121 Cb 0.66 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.73 3hbn h SER 121 CO -0.07 0.07 0.31 0.44 -0.87 0.00 0.00 176.83 176.71 3hbn h ASP 122 N 0.00 0.00 -0.72 4.97 3.32 -1.55 -2.76 116.42 119.68 3hbn h ASP 122 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3hbn h ASP 122 Cb 0.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.71 3hbn h ASP 122 CO 0.01 0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 176.31 3hbn n TYR 123 N -3.81 1.10 -1.68 4.55 4.01 -0.56 -4.92 117.16 115.85 3hbn n TYR 123 Ca 0.04 -0.53 -0.45 0.00 -0.16 0.00 0.00 57.90 56.81 3hbn n TYR 123 Cb 0.47 -0.06 -0.04 0.00 -0.31 0.00 0.00 39.34 39.40 3hbn n TYR 123 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 3hbn n GLU 124 N 1.53 2.55 -0.99 -0.72 1.02 -1.04 -0.86 120.64 122.13 3hbn n GLU 124 Ca 0.25 0.93 0.00 0.00 -0.02 0.00 0.00 57.16 58.32 3hbn n GLU 124 Cb 0.69 -2.82 0.00 0.00 -0.02 0.00 0.00 31.44 29.29 3hbn n GLU 124 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hbn n GLY 125 N 4.32 0.95 0.35 0.62 0.00 -1.26 -4.87 105.19 105.31 3hbn n GLY 125 Ca 0.20 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.30 3hbn n GLY 125 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hbn n LEU 126 N 0.00 1.60 -4.29 0.99 4.77 -0.04 -4.98 117.00 115.05 3hbn n LEU 126 Ca 0.00 -0.76 -0.16 0.00 -0.03 0.00 0.00 56.01 55.06 3hbn n LEU 126 Cb 0.00 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 40.99 3hbn n LEU 126 CO 0.00 0.31 -0.36 0.68 -1.33 0.00 0.00 177.39 176.69 3hbn s VAL 127 N -1.88 1.03 0.97 4.08 -7.23 -1.24 -1.72 120.40 114.42 3hbn s VAL 127 Ca 0.13 -2.04 -0.12 0.00 -1.81 0.00 0.00 61.98 58.14 3hbn s VAL 127 Cb 0.13 -2.15 0.17 0.00 0.56 0.00 0.00 36.38 35.09 3hbn s VAL 127 CO 0.40 -0.49 1.09 -2.84 -0.31 0.00 0.00 175.10 172.95 3hbn s PRO 128 N -3.83 0.63 0.47 4.82 0.02 -1.26 -4.93 135.00 130.93 3hbn s PRO 128 Ca 0.24 0.73 0.17 0.00 0.02 0.00 0.00 61.00 62.16 3hbn s PRO 128 Cb 0.05 -1.74 1.14 0.00 0.02 0.00 0.00 34.50 33.96 3hbn s PRO 128 CO 0.05 -2.65 2.04 0.74 -0.33 0.00 0.00 177.00 176.86 3hbn h PHE 129 N -1.84 0.00 -0.65 6.54 0.04 -1.99 -2.57 116.94 116.47 3hbn h PHE 129 Ca -0.53 0.00 -0.29 0.00 2.80 0.00 0.00 57.97 59.95 3hbn h PHE 129 Cb 1.31 0.00 -0.17 0.00 2.20 0.00 0.00 35.95 39.28 3hbn h PHE 129 CO 0.35 0.14 0.25 1.63 -0.60 0.00 0.00 178.31 180.09 3hbn n LYS 130 N -4.26 2.46 -3.15 1.51 4.76 -1.26 -4.98 118.16 113.23 3hbn n LYS 130 Ca -0.03 -3.08 -0.39 0.00 -2.87 0.00 0.00 58.31 51.95 3hbn n LYS 130 Cb 0.21 -2.03 -0.05 0.00 -1.84 0.00 0.00 35.03 31.32 3hbn n LYS 130 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3hbn s GLU 132 N 1.01 4.07 -0.27 0.00 2.12 -0.07 -4.94 118.70 120.62 3hbn s GLU 132 Ca 0.32 0.79 -0.11 0.00 0.36 0.00 0.00 54.97 56.32 3hbn s GLU 132 Cb -0.16 -3.69 -0.05 0.00 0.26 0.00 0.00 34.13 30.49 3hbn s GLU 132 CO 0.14 -0.63 0.18 0.08 -0.54 0.00 0.00 175.26 174.49 3hbn s VAL 133 N 2.97 5.30 -0.29 3.70 1.01 -1.26 -0.90 120.40 130.92 3hbn s VAL 133 Ca 0.35 0.16 0.03 0.00 0.00 0.00 0.00 61.98 62.52 3hbn s VAL 133 Cb -0.14 -3.51 0.08 0.00 0.00 0.00 0.00 36.38 32.80 3hbn s VAL 133 CO 0.10 0.28 -0.04 -0.13 0.00 0.00 0.00 175.10 175.32 3hbn s ARG 134 N 1.54 1.81 -0.01 2.72 0.52 0.10 -4.88 118.95 120.74 3hbn s ARG 134 Ca 0.07 -1.47 0.03 0.00 -0.52 0.00 0.00 55.73 53.84 3hbn s ARG 134 Cb -0.15 -2.92 -0.01 0.00 0.52 0.00 0.00 34.95 32.40 3hbn s ARG 134 CO 0.09 -0.72 -0.11 0.00 0.02 0.00 0.00 175.30 174.58 3hbn n GLY 136 N 2.91 -2.27 0.30 0.00 0.00 -0.37 -4.70 105.19 101.06 3hbn n GLY 136 Ca -0.15 -2.18 0.20 0.00 0.00 0.00 0.00 46.02 43.89 3hbn n GLY 136 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3hbn h PHE 137 N 0.00 0.00 0.00 1.61 3.04 -1.77 0.39 116.94 120.20 3hbn h PHE 137 Ca 0.00 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.95 3hbn h PHE 137 Cb 0.00 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.51 3hbn h PHE 137 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 178.31 176.95 3hbn h SER 138 N 0.00 0.00 -0.25 0.41 4.64 -1.93 -2.22 113.55 114.20 3hbn h SER 138 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 3hbn h SER 138 Cb 0.25 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 3hbn h SER 138 CO 0.00 0.00 -0.00 -1.22 -0.87 0.00 0.00 176.83 174.74 3hbn n TYR 139 N -2.55 0.89 -1.73 4.77 4.02 0.12 -5.03 117.16 117.65 3hbn n TYR 139 Ca 0.00 -0.93 -0.42 0.00 -0.01 0.00 0.00 57.90 56.54 3hbn n TYR 139 Cb 0.18 -0.32 -0.00 0.00 -0.02 0.00 0.00 39.34 39.18 3hbn n TYR 139 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3hbn n ALA 140 N -0.62 1.84 -3.77 -0.72 0.00 -0.84 -4.59 120.51 111.81 3hbn n ALA 140 Ca 0.22 0.35 -0.36 0.00 0.00 0.00 0.00 53.44 53.66 3hbn n ALA 140 Cb 0.89 -2.34 -0.12 0.00 0.00 0.00 0.00 19.45 17.88 3hbn n ALA 140 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3hbn s LEU 141 N -1.42 5.07 -0.02 0.00 1.43 -1.26 -5.08 118.68 117.40 3hbn s LEU 141 Ca 0.55 -1.96 0.03 0.00 -1.03 0.00 0.00 54.13 51.73 3hbn s LEU 141 Cb -0.53 -1.80 -0.00 0.00 0.03 0.00 0.00 46.19 43.89 3hbn s LEU 141 CO 0.62 -0.50 -0.11 -0.63 0.23 0.00 0.00 176.35 175.96 3hbn s ILE 142 N 1.13 0.92 0.63 -0.59 1.01 -1.26 -4.85 121.20 118.19 3hbn s ILE 142 Ca 0.07 -0.47 -0.18 0.00 0.00 0.00 0.00 60.65 60.08 3hbn s ILE 142 Cb -0.22 -0.79 -0.02 0.00 0.01 0.00 0.00 42.46 41.44 3hbn s ILE 142 CO -0.04 0.27 1.22 -0.13 0.00 0.00 0.00 174.94 176.26 3hbn s ARG 143 N -0.05 2.76 0.34 2.79 0.52 -1.26 -4.92 118.95 119.13 3hbn s ARG 143 Ca 0.01 1.84 0.08 0.00 -0.52 0.00 0.00 55.73 57.14 3hbn s ARG 143 Cb -0.07 -1.90 0.79 0.00 0.52 0.00 0.00 34.95 34.29 3hbn s ARG 143 CO 0.00 -1.38 1.85 1.49 0.02 0.00 0.00 175.30 177.28 3hbn h GLU 144 N 0.60 0.71 -0.11 3.54 4.57 -2.01 -1.93 114.58 119.95 3hbn h GLU 144 Ca -0.50 -0.04 0.03 0.00 -1.18 0.00 0.00 59.36 57.67 3hbn h GLU 144 Cb 1.30 -0.16 -0.00 0.00 -0.16 0.00 0.00 28.75 29.73 3hbn h GLU 144 CO 0.54 0.47 0.09 1.05 -1.18 0.00 0.00 179.01 179.98 3hbn h GLU 145 N 0.73 0.00 -0.20 1.92 9.09 -1.98 0.29 114.58 124.43 3hbn h GLU 145 Ca 0.48 0.00 -0.16 0.00 0.05 0.00 0.00 59.36 59.73 3hbn h GLU 145 Cb 0.76 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.86 3hbn h GLU 145 CO -0.24 0.00 -0.53 0.74 0.05 0.00 0.00 179.01 179.03 3hbn h PHE 146 N 0.00 0.72 -0.36 2.06 -1.00 -1.71 -0.55 116.94 116.09 3hbn h PHE 146 Ca 0.05 -0.25 -0.12 0.00 2.81 0.00 0.00 57.97 60.46 3hbn h PHE 146 Cb 0.24 -0.14 -0.01 0.00 3.61 0.00 0.00 35.95 39.66 3hbn h PHE 146 CO 0.00 0.98 -0.26 1.88 -1.61 0.00 0.00 178.31 179.30 3hbn h TYR 147 N 0.45 0.96 -0.16 -0.55 -1.99 -1.11 -1.67 116.97 112.90 3hbn h TYR 147 Ca 0.01 -0.26 -0.04 0.00 2.00 0.00 0.00 58.73 60.44 3hbn h TYR 147 Cb 1.07 -0.21 -0.01 0.00 2.00 0.00 0.00 36.73 39.58 3hbn h TYR 147 CO 0.05 1.04 -0.07 1.96 -0.00 0.00 0.00 178.16 181.13 3hbn h GLN 148 N 0.60 0.24 0.07 4.88 4.20 -0.97 -3.21 115.11 120.93 3hbn h GLN 148 Ca 0.07 -0.05 -0.30 0.00 0.06 0.00 0.00 58.65 58.44 3hbn h GLN 148 Cb 0.83 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.55 3hbn h GLN 148 CO 0.07 0.33 -1.57 1.49 -0.67 0.00 0.00 178.83 178.49 3hbn h GLU 149 N 0.24 0.15 0.00 1.46 4.57 -0.99 -3.23 114.58 116.77 3hbn h GLU 149 Ca 0.05 -0.25 0.00 0.00 -1.18 0.00 0.00 59.36 57.98 3hbn h GLU 149 Cb 0.29 0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.97 3hbn h GLU 149 CO 0.01 0.93 0.00 0.00 -1.18 0.00 0.00 179.01 178.78 3hbn n ALA 150 N -2.63 1.38 -0.04 2.92 0.00 -0.64 -2.15 120.51 119.36 3hbn n ALA 150 Ca -0.16 -0.03 -0.13 0.00 0.00 0.00 0.00 53.44 53.12 3hbn n ALA 150 Cb 1.03 -1.12 -0.14 0.00 0.00 0.00 0.00 19.45 19.22 3hbn n ALA 150 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3hbn n LYS 151 N -1.45 0.68 -2.95 0.00 4.76 -1.22 -4.98 118.16 113.00 3hbn n LYS 151 Ca 0.02 0.22 -0.35 0.00 -2.87 0.00 0.00 58.31 55.34 3hbn n LYS 151 Cb 0.08 -1.70 -0.06 0.00 -1.84 0.00 0.00 35.03 31.50 3hbn n LYS 151 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 3hbn s GLU 152 N -2.56 4.29 -0.34 1.97 2.02 -0.91 -5.06 118.70 118.10 3hbn s GLU 152 Ca -0.13 1.02 -0.13 0.00 0.02 0.00 0.00 54.97 55.75 3hbn s GLU 152 Cb 0.07 -2.59 -0.02 0.00 0.10 0.00 0.00 34.13 31.70 3hbn s GLU 152 CO 0.79 0.21 0.24 -0.80 0.02 0.00 0.00 175.26 175.71 3hbn s ASN 153 N -1.90 6.04 0.01 -0.19 0.01 -1.26 -4.98 114.94 112.66 3hbn s ASN 153 Ca 0.52 -0.43 0.04 0.00 -0.71 0.00 0.00 52.86 52.27 3hbn s ASN 153 Cb -0.14 -2.13 -0.03 0.00 0.41 0.00 0.00 41.25 39.35 3hbn s ASN 153 CO 0.19 -0.24 -0.08 -0.13 -1.51 0.00 0.00 177.10 175.34 3hbn s ARG 154 N 1.72 2.51 0.25 -0.60 0.52 -1.26 -5.11 118.95 116.98 3hbn s ARG 154 Ca 0.06 -0.75 -0.30 0.00 -0.52 0.00 0.00 55.73 54.23 3hbn s ARG 154 Cb -0.17 -2.47 -0.09 0.00 0.52 0.00 0.00 34.95 32.73 3hbn s ARG 154 CO 0.10 0.60 1.24 0.15 0.02 0.00 0.00 175.30 177.41 3hbn s LYS 155 N -1.42 4.45 0.09 3.54 1.02 -1.26 -4.90 119.74 121.26 3hbn s LYS 155 Ca 0.17 2.01 -0.31 0.00 0.02 0.00 0.00 55.97 57.86 3hbn s LYS 155 Cb -0.11 -3.17 -0.07 0.00 -0.52 0.00 0.00 37.83 33.96 3hbn s LYS 155 CO 0.07 -0.11 1.30 0.15 -0.92 0.00 0.00 175.35 175.84 3hbn s LYS 156 N -0.85 4.38 -0.14 1.68 -0.14 -1.26 -4.70 119.74 118.71 3hbn s LYS 156 Ca 0.51 1.93 0.11 0.00 -1.36 0.00 0.00 55.97 57.16 3hbn s LYS 156 Cb -0.36 -3.29 -0.16 0.00 -1.68 0.00 0.00 37.83 32.34 3hbn s LYS 156 CO 0.42 -0.35 0.02 1.63 -0.76 0.00 0.00 175.35 176.31 3hbn n LYS 157 N 3.89 1.52 -4.92 1.68 5.02 0.14 -5.01 118.16 120.48 3hbn n LYS 157 Ca 0.10 0.01 -0.28 0.00 -2.02 0.00 0.00 58.31 56.13 3hbn n LYS 157 Cb 0.44 -1.36 -0.15 0.00 -0.02 0.00 0.00 35.03 33.94 3hbn n LYS 157 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3hbn s TYR 158 N -2.34 1.98 0.10 2.13 1.51 -0.77 -4.93 117.35 115.02 3hbn s TYR 158 Ca -0.10 -0.38 -0.12 0.00 -1.01 0.00 0.00 57.07 55.46 3hbn s TYR 158 Cb 0.04 -1.23 -0.17 0.00 -0.11 0.00 0.00 41.96 40.50 3hbn s TYR 158 CO 0.54 0.03 1.27 -0.44 -1.11 0.00 0.00 175.55 175.85 3hbn h ASP 159 N 5.25 0.91 -4.28 2.29 3.32 -1.03 -0.32 116.42 122.55 3hbn h ASP 159 Ca -0.42 -0.64 -0.39 0.00 0.02 0.00 0.00 57.03 55.60 3hbn h ASP 159 Cb 1.14 -0.27 -0.26 0.00 0.22 0.00 0.00 39.33 40.16 3hbn h ASP 159 CO 0.46 1.44 -0.78 -0.36 -1.72 0.00 0.00 179.24 178.29 3hbn s PHE 160 N -3.60 0.94 -0.14 4.55 0.40 -0.76 -1.87 117.98 117.51 3hbn s PHE 160 Ca -0.10 -0.30 0.02 0.00 -0.60 0.00 0.00 56.93 55.96 3hbn s PHE 160 Cb 0.08 -0.58 0.01 0.00 0.51 0.00 0.00 43.02 43.04 3hbn s PHE 160 CO 0.91 -0.00 -0.21 0.12 0.70 0.00 0.00 175.22 176.74 3hbn s PHE 161 N -0.70 2.68 -0.15 0.36 2.19 -0.21 -0.78 117.98 121.39 3hbn s PHE 161 Ca 0.00 -1.24 -0.01 0.00 0.33 0.00 0.00 56.93 56.01 3hbn s PHE 161 Cb -0.06 -1.82 -0.01 0.00 -1.31 0.00 0.00 43.02 39.81 3hbn s PHE 161 CO 0.00 -0.56 -0.11 0.42 1.83 0.00 0.00 175.22 176.80 3hbn s ILE 162 N 0.75 3.13 0.26 3.12 1.01 0.47 -0.05 121.20 129.89 3hbn s ILE 162 Ca -0.08 -0.62 -0.02 0.00 0.00 0.00 0.00 60.65 59.93 3hbn s ILE 162 Cb -0.16 -2.33 0.01 0.00 0.01 0.00 0.00 42.46 39.99 3hbn s ILE 162 CO -0.00 0.51 0.37 0.00 0.00 0.00 0.00 174.94 175.82 3hbn n GLY 165 N -0.43 -1.61 0.15 0.00 0.00 -1.26 -2.51 105.19 99.53 3hbn n GLY 165 Ca 0.00 -1.52 -0.05 0.00 0.00 0.00 0.00 46.02 44.46 3hbn n GLY 165 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3hbn h GLY 166 N -0.08 0.18 0.00 -0.02 0.00 -1.95 -3.42 103.07 97.78 3hbn h GLY 166 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.08 3hbn h GLY 166 CO 0.00 0.23 -0.47 -1.30 0.00 0.00 0.00 176.54 175.00 3hbn n THR 167 N -3.79 0.00 -3.86 4.70 -2.24 -1.26 -2.16 114.28 105.67 3hbn n THR 167 Ca -0.02 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.39 3hbn n THR 167 Cb 0.67 -0.04 0.02 0.00 -2.10 0.00 0.00 70.33 68.88 3hbn n THR 167 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3hbn n ASP 168 N -0.89 -4.80 0.26 3.42 2.03 -1.26 -4.08 116.55 111.22 3hbn n ASP 168 Ca 0.00 -1.10 0.08 0.00 0.52 0.00 0.00 54.79 54.29 3hbn n ASP 168 Cb 0.09 -2.34 0.63 0.00 -0.72 0.00 0.00 41.12 38.78 3hbn n ASP 168 CO 0.00 0.00 0.00 0.16 -1.92 0.00 0.00 177.20 175.44 3hbn h ILE 169 N -1.86 1.00 -0.00 5.18 3.07 -1.95 -0.84 117.51 122.11 3hbn h ILE 169 Ca -0.66 -0.08 0.00 0.00 1.55 0.00 0.00 64.86 65.68 3hbn h ILE 169 Cb 1.37 1.04 0.00 0.00 -0.27 0.00 0.00 36.82 38.97 3hbn h ILE 169 CO 0.47 0.02 -0.01 0.29 -1.05 0.00 0.00 178.15 177.87 3hbn n LYS 170 N -4.49 0.91 -3.84 0.16 5.02 -1.26 -4.85 118.16 109.81 3hbn n LYS 170 Ca -0.03 -0.12 -0.28 0.00 -2.02 0.00 0.00 58.31 55.86 3hbn n LYS 170 Cb 0.11 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 33.65 3hbn n LYS 170 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 3hbn n ASN 171 N -0.94 -4.06 0.26 4.39 5.15 -0.32 -2.44 115.26 117.30 3hbn n ASN 171 Ca 0.20 -0.77 0.12 0.00 -0.60 0.00 0.00 54.58 53.54 3hbn n ASN 171 Cb 0.18 -4.03 0.70 0.00 -0.53 0.00 0.00 39.78 36.10 3hbn n ASN 171 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 3hbn h LEU 172 N -2.09 0.00 -0.85 1.20 3.38 -1.92 -2.91 115.31 112.12 3hbn h LEU 172 Ca -0.59 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.38 3hbn h LEU 172 Cb 1.37 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.08 3hbn h LEU 172 CO 0.64 0.13 0.53 0.28 0.09 0.00 0.00 178.44 180.11 3hbn h SER 173 N 0.00 1.01 -0.05 -0.43 0.02 -1.90 0.13 113.55 112.33 3hbn h SER 173 Ca -0.00 -0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 60.89 3hbn h SER 173 Cb 0.37 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 62.66 3hbn h SER 173 CO 0.02 0.76 -0.00 0.25 -1.14 0.00 0.00 176.83 176.71 3hbn h LEU 174 N 1.16 0.09 -0.55 5.07 6.46 -1.91 -1.72 115.31 123.92 3hbn h LEU 174 Ca 0.31 -0.34 0.06 0.00 -0.12 0.00 0.00 57.88 57.79 3hbn h LEU 174 Cb -0.08 -0.02 -0.05 0.00 -0.73 0.00 0.00 40.66 39.78 3hbn h LEU 174 CO -0.06 0.40 0.25 -0.61 -0.62 0.00 0.00 178.44 177.81 3hbn h GLN 175 N -0.23 0.47 -0.16 1.25 5.75 -1.44 -0.25 115.11 120.50 3hbn h GLN 175 Ca 0.01 -0.03 -0.04 0.00 -0.15 0.00 0.00 58.65 58.44 3hbn h GLN 175 Cb 0.36 -0.11 -0.00 0.00 1.07 0.00 0.00 27.48 28.80 3hbn h GLN 175 CO 0.00 0.31 -0.07 0.82 -2.65 0.00 0.00 178.83 177.24 3hbn h ILE 176 N 0.48 1.31 -0.75 2.39 2.04 -0.72 -2.82 117.51 119.44 3hbn h ILE 176 Ca 0.25 -1.09 0.00 0.00 1.00 0.00 0.00 64.86 65.02 3hbn h ILE 176 Cb 0.21 1.69 -0.04 0.00 -0.74 0.00 0.00 36.82 37.94 3hbn h ILE 176 CO -0.20 0.32 0.48 0.00 0.00 0.00 0.00 178.15 178.74 3hbn h ALA 177 N 0.69 1.42 0.00 1.87 0.00 -1.16 -2.33 119.26 119.75 3hbn h ALA 177 Ca 0.04 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3hbn h ALA 177 Cb 0.53 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 3hbn h ALA 177 CO 0.02 0.52 -0.06 0.66 0.00 0.00 0.00 179.25 180.39 3hbn h SER 178 N 1.03 0.00 1.41 0.00 4.64 -0.79 -2.41 113.55 117.42 3hbn h SER 178 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 3hbn h SER 178 Cb -0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.01 3hbn h SER 178 CO -0.06 0.06 -0.23 -0.33 -0.87 0.00 0.00 176.83 175.40 3hbn h GLU 179 N 0.00 0.00 -6.57 4.77 5.08 -1.23 -3.47 114.58 113.16 3hbn h GLU 179 Ca -0.00 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.84 3hbn h GLU 179 Cb 0.21 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 3hbn h GLU 179 CO 0.01 0.00 -0.02 -0.51 -1.00 0.00 0.00 179.01 177.49 3hbn s LEU 180 N -4.90 4.12 0.42 1.33 1.43 -0.91 -5.03 118.68 115.14 3hbn s LEU 180 Ca 0.08 1.08 -0.26 0.00 -1.03 0.00 0.00 54.13 54.00 3hbn s LEU 180 Cb 0.11 -3.86 -0.10 0.00 0.03 0.00 0.00 46.19 42.36 3hbn s LEU 180 CO 0.66 -0.14 1.39 -2.65 0.23 0.00 0.00 176.35 175.84 3hbn n PRO 181 N -0.26 2.24 0.08 1.29 -0.02 -1.26 -4.87 135.00 132.21 3hbn n PRO 181 Ca 0.02 0.79 0.08 0.00 -2.02 0.00 0.00 63.50 62.37 3hbn n PRO 181 Cb 0.53 -2.54 0.37 0.00 -0.02 0.00 0.00 33.50 31.84 3hbn n PRO 181 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 3hbn n LYS 182 N 0.09 0.09 0.00 -0.52 2.85 -1.26 -1.38 118.16 118.03 3hbn n LYS 182 Ca 0.05 0.46 0.12 0.00 -1.05 0.00 0.00 58.31 57.89 3hbn n LYS 182 Cb 0.40 -1.73 0.14 0.00 -0.65 0.00 0.00 35.03 33.18 3hbn n LYS 182 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 3hbn n THR 183 N -1.92 0.00 -3.27 0.58 -2.24 -1.26 -4.63 114.28 101.54 3hbn n THR 183 Ca 0.01 -0.28 -0.38 0.00 -2.27 0.00 0.00 64.05 61.12 3hbn n THR 183 Cb 0.11 1.07 -0.06 0.00 -2.10 0.00 0.00 70.33 69.36 3hbn n THR 183 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3hbn s LYS 184 N -2.35 4.30 -0.15 -0.78 -0.14 -0.48 -5.04 119.74 115.10 3hbn s LYS 184 Ca 0.23 0.58 -0.24 0.00 -1.36 0.00 0.00 55.97 55.18 3hbn s LYS 184 Cb 0.19 -3.38 -0.02 0.00 -1.68 0.00 0.00 37.83 32.94 3hbn s LYS 184 CO 0.49 0.27 0.78 0.42 -0.76 0.00 0.00 175.35 176.55 3hbn s ILE 185 N 0.19 4.93 -0.16 2.17 1.01 -1.26 -4.78 121.20 123.31 3hbn s ILE 185 Ca 0.29 1.54 0.00 0.00 0.00 0.00 0.00 60.65 62.48 3hbn s ILE 185 Cb -0.17 -4.09 0.03 0.00 0.01 0.00 0.00 42.46 38.24 3hbn s ILE 185 CO 0.14 0.09 -0.13 -0.63 0.00 0.00 0.00 174.94 174.41 3hbn s ILE 186 N 1.82 1.55 0.03 2.92 1.01 0.39 -0.38 121.20 128.53 3hbn s ILE 186 Ca 0.37 -0.70 -0.15 0.00 0.00 0.00 0.00 60.65 60.17 3hbn s ILE 186 Cb -0.17 -1.50 -0.06 0.00 0.01 0.00 0.00 42.46 40.74 3hbn s ILE 186 CO 0.14 0.38 0.44 -0.94 0.00 0.00 0.00 174.94 174.95 3hbn s SER 187 N 1.48 6.83 -0.08 3.58 1.04 0.04 -0.47 113.70 126.12 3hbn s SER 187 Ca 0.03 1.00 0.02 0.00 0.48 0.00 0.00 55.95 57.48 3hbn s SER 187 Cb -0.14 -2.26 0.02 0.00 0.10 0.00 0.00 66.02 63.74 3hbn s SER 187 CO -0.10 0.29 -0.11 -0.63 0.98 0.00 0.00 173.24 173.67 3hbn s ILE 188 N -1.13 1.15 -0.15 -1.02 1.01 -0.26 -0.40 121.20 120.40 3hbn s ILE 188 Ca 0.26 -0.45 -0.03 0.00 0.00 0.00 0.00 60.65 60.43 3hbn s ILE 188 Cb -0.17 -1.07 -0.02 0.00 0.01 0.00 0.00 42.46 41.20 3hbn s ILE 188 CO 0.15 0.37 -0.06 0.00 0.00 0.00 0.00 174.94 175.40 3hbn s ALA 189 N 0.93 2.91 0.26 9.38 0.00 -0.66 0.29 121.76 134.87 3hbn s ALA 189 Ca -0.09 -0.84 -0.09 0.00 0.00 0.00 0.00 51.96 50.93 3hbn s ALA 189 Cb -0.15 -1.48 -0.01 0.00 0.00 0.00 0.00 23.12 21.48 3hbn s ALA 189 CO 0.00 0.20 0.44 -0.08 0.00 0.00 0.00 175.76 176.32 3hbn s THR 190 N 0.39 0.00 0.34 0.00 -1.32 -0.83 -4.56 115.64 109.66 3hbn s THR 190 Ca -0.05 -1.52 0.07 0.00 -1.21 0.00 0.00 61.69 58.98 3hbn s THR 190 Cb -0.15 -2.34 -0.02 0.00 -1.51 0.00 0.00 72.50 68.48 3hbn s THR 190 CO 0.03 0.00 0.40 -0.94 -2.21 0.00 0.00 174.62 171.90 3hbn s SER 191 N -3.08 5.66 0.00 8.08 1.04 -0.92 -1.02 113.70 123.46 3hbn s SER 191 Ca 0.26 -0.34 0.12 0.00 0.48 0.00 0.00 55.95 56.48 3hbn s SER 191 Cb 0.00 -1.09 0.66 0.00 0.10 0.00 0.00 66.02 65.69 3hbn s SER 191 CO 0.12 -0.41 1.25 -1.54 0.98 0.00 0.00 173.24 173.63 3hbn n SER 192 N -1.53 0.00 -0.34 7.02 3.41 -1.26 -2.15 113.62 118.76 3hbn n SER 192 Ca -0.01 -0.06 0.14 0.00 -0.26 0.00 0.00 58.87 58.68 3hbn n SER 192 Cb 0.59 -0.19 0.48 0.00 -0.26 0.00 0.00 64.21 64.84 3hbn n SER 192 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3hbn n SER 193 N -1.19 1.17 -4.64 4.04 7.64 -1.26 -4.86 113.62 114.52 3hbn n SER 193 Ca 0.07 -1.16 -0.42 0.00 1.01 0.00 0.00 58.87 58.37 3hbn n SER 193 Cb 0.08 0.05 -0.03 0.00 -1.01 0.00 0.00 64.21 63.30 3hbn n SER 193 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 3hbn s ASN 194 N -2.25 6.32 0.00 6.43 3.84 -0.92 -4.49 114.94 123.88 3hbn s ASN 194 Ca 0.32 2.25 0.20 0.00 0.21 0.00 0.00 52.86 55.83 3hbn s ASN 194 Cb 0.20 -2.53 0.97 0.00 -0.55 0.00 0.00 41.25 39.35 3hbn s ASN 194 CO 0.42 -1.21 1.61 -0.81 -2.79 0.00 0.00 177.10 174.33 3hbn n PRO 195 N 7.67 0.25 -0.51 0.43 -0.04 -1.26 -2.32 135.00 139.22 3hbn n PRO 195 Ca 0.21 0.11 0.09 0.00 -0.04 0.00 0.00 63.50 63.87 3hbn n PRO 195 Cb 0.43 -1.50 0.32 0.00 -0.04 0.00 0.00 33.50 32.70 3hbn n PRO 195 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3hbn n ASN 196 N -1.31 4.33 -0.21 3.54 3.02 -1.26 -4.75 115.26 118.62 3hbn n ASN 196 Ca 0.09 -2.39 -0.03 0.00 -0.03 0.00 0.00 54.58 52.22 3hbn n ASN 196 Cb 0.16 -0.52 0.08 0.00 -0.61 0.00 0.00 39.78 38.90 3hbn n ASN 196 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 3hbn h LEU 197 N 3.59 0.54 -0.46 3.41 5.85 -1.83 -0.24 115.31 126.18 3hbn h LEU 197 Ca 0.00 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 3hbn h LEU 197 Cb 1.30 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 42.22 3hbn h LEU 197 CO 0.17 0.36 0.23 0.50 -0.34 0.00 0.00 178.44 179.37 3hbn h LYS 198 N 0.67 0.64 -0.44 1.25 3.64 -1.86 -0.89 116.57 119.59 3hbn h LYS 198 Ca 0.27 -0.08 -0.04 0.00 -1.27 0.00 0.00 60.65 59.52 3hbn h LYS 198 Cb 0.12 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 3hbn h LYS 198 CO -0.15 0.53 0.12 -0.22 -2.27 0.00 0.00 179.45 177.46 3hbn h LYS 199 N 0.59 0.70 -0.72 1.90 1.63 -1.77 -1.90 116.57 117.00 3hbn h LYS 199 Ca 0.16 -0.16 -0.01 0.00 -0.85 0.00 0.00 60.65 59.79 3hbn h LYS 199 Cb 0.08 -0.10 -0.04 0.00 -0.60 0.00 0.00 32.23 31.58 3hbn h LYS 199 CO -0.02 0.69 0.42 1.25 -3.45 0.00 0.00 179.45 178.34 3hbn h LEU 200 N 0.58 0.87 -0.46 5.20 5.85 -0.76 -0.95 115.31 125.65 3hbn h LEU 200 Ca 0.14 -0.06 -0.13 0.00 0.84 0.00 0.00 57.88 58.68 3hbn h LEU 200 Cb 0.30 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 3hbn h LEU 200 CO -0.00 0.68 -0.22 1.56 -0.34 0.00 0.00 178.44 180.12 3hbn h GLN 201 N 1.00 0.95 -0.07 1.25 4.20 -0.98 -0.62 115.11 120.84 3hbn h GLN 201 Ca 0.26 -0.42 -0.00 0.00 0.06 0.00 0.00 58.65 58.55 3hbn h GLN 201 Cb -0.02 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 27.73 3hbn h GLN 201 CO -0.05 1.08 0.04 -0.22 -0.67 0.00 0.00 178.83 179.02 3hbn h LYS 202 N 0.80 0.10 0.06 1.46 3.64 -1.01 -1.23 116.57 120.39 3hbn h LYS 202 Ca 0.10 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.49 3hbn h LYS 202 Cb 0.80 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.57 3hbn h LYS 202 CO 0.07 0.10 -0.14 0.35 -2.27 0.00 0.00 179.45 177.55 3hbn h PHE 203 N 0.07 -0.37 -0.87 1.91 3.04 -1.15 -3.05 116.94 116.52 3hbn h PHE 203 Ca 0.03 0.01 0.04 0.00 3.98 0.00 0.00 57.97 62.02 3hbn h PHE 203 Cb 0.02 0.16 -0.05 0.00 2.56 0.00 0.00 35.95 38.64 3hbn h PHE 203 CO -0.06 -0.21 0.56 0.00 -2.02 0.00 0.00 178.31 176.57 3hbn h ALA 204 N 0.63 1.16 0.00 2.41 0.00 -0.98 -1.94 119.26 120.53 3hbn h ALA 204 Ca 0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3hbn h ALA 204 Cb 0.30 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 3hbn h ALA 204 CO -0.10 0.39 -0.03 -0.22 0.00 0.00 0.00 179.25 179.30 3hbn h LYS 205 N 1.08 0.00 0.00 0.00 3.64 -1.12 -1.74 116.57 118.43 3hbn h LYS 205 Ca 0.35 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.73 3hbn h LYS 205 Cb 0.03 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.85 3hbn h LYS 205 CO -0.13 0.03 -0.22 1.28 -2.27 0.00 0.00 179.45 178.14 3hbn n LEU 206 N -3.74 0.33 -3.89 5.20 4.77 -0.73 -4.72 117.00 114.21 3hbn n LEU 206 Ca -0.03 0.33 -0.30 0.00 -0.03 0.00 0.00 56.01 55.98 3hbn n LEU 206 Cb 0.12 -0.37 -0.15 0.00 -2.33 0.00 0.00 43.42 40.69 3hbn n LEU 206 CO 0.28 0.01 -0.36 -1.00 -1.33 0.00 0.00 177.39 174.98 3hbn s HIS 207 N -3.03 2.60 -0.55 -1.77 3.76 -0.65 -4.99 115.29 110.65 3hbn s HIS 207 Ca 0.12 -2.15 0.20 0.00 -0.15 0.00 0.00 55.06 53.08 3hbn s HIS 207 Cb 0.17 -2.06 0.89 0.00 1.11 0.00 0.00 32.58 32.69 3hbn s HIS 207 CO 0.61 -0.86 1.61 0.27 -0.85 0.00 0.00 174.74 175.52 3hbn n ASN 208 N 4.60 0.49 -0.02 1.40 0.23 -1.26 -1.45 115.26 119.24 3hbn n ASN 208 Ca -0.03 0.65 0.15 0.00 -0.53 0.00 0.00 54.58 54.81 3hbn n ASN 208 Cb 0.43 -0.74 0.76 0.00 -2.08 0.00 0.00 39.78 38.15 3hbn n ASN 208 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 3hbn n ASN 209 N -2.07 0.09 -4.52 0.53 6.94 -1.26 -4.80 115.26 110.17 3hbn n ASN 209 Ca 0.01 -0.35 -0.34 0.00 -0.02 0.00 0.00 54.58 53.88 3hbn n ASN 209 Cb 0.17 -0.20 -0.12 0.00 -2.36 0.00 0.00 39.78 37.27 3hbn n ASN 209 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3hbn s ILE 210 N -2.47 4.14 -0.22 1.53 1.01 -0.53 -0.46 121.20 124.21 3hbn s ILE 210 Ca 0.31 -0.26 -0.01 0.00 0.00 0.00 0.00 60.65 60.69 3hbn s ILE 210 Cb 0.20 -2.84 0.02 0.00 0.01 0.00 0.00 42.46 39.85 3hbn s ILE 210 CO 0.45 0.47 -0.10 -0.60 0.00 0.00 0.00 174.94 175.16 3hbn s ARG 211 N 0.49 3.01 -0.20 2.79 6.06 0.38 -4.91 118.95 126.57 3hbn s ARG 211 Ca -0.01 -0.85 -0.13 0.00 -2.50 0.00 0.00 55.73 52.24 3hbn s ARG 211 Cb -0.14 -2.86 -0.05 0.00 0.06 0.00 0.00 34.95 31.97 3hbn s ARG 211 CO 0.02 -0.29 0.25 -1.17 -2.50 0.00 0.00 175.30 171.61 3hbn s LEU 212 N 1.35 4.18 -0.26 -0.88 2.96 -1.26 -1.10 118.68 123.67 3hbn s LEU 212 Ca 0.03 0.34 -0.02 0.00 -0.22 0.00 0.00 54.13 54.26 3hbn s LEU 212 Cb -0.15 -2.27 0.03 0.00 0.50 0.00 0.00 46.19 44.29 3hbn s LEU 212 CO -0.07 0.07 -0.04 -0.36 -1.32 0.00 0.00 176.35 174.63 3hbn s PHE 213 N 0.79 3.10 -0.20 5.38 0.40 0.14 -4.95 117.98 122.65 3hbn s PHE 213 Ca 0.13 -1.53 -0.11 0.00 -0.60 0.00 0.00 56.93 54.83 3hbn s PHE 213 Cb -0.13 -2.09 -0.05 0.00 0.51 0.00 0.00 43.02 41.26 3hbn s PHE 213 CO 0.04 -0.72 0.16 0.42 0.70 0.00 0.00 175.22 175.82 3hbn s ILE 214 N 1.34 5.39 -1.52 0.64 1.01 -1.26 -1.96 121.20 124.84 3hbn s ILE 214 Ca -0.00 0.26 -0.13 0.00 0.00 0.00 0.00 60.65 60.77 3hbn s ILE 214 Cb -0.17 -3.50 0.08 0.00 0.01 0.00 0.00 42.46 38.88 3hbn s ILE 214 CO -0.03 0.42 0.98 0.47 0.00 0.00 0.00 174.94 176.78 3hbn n ASP 215 N 3.58 -4.71 -4.77 3.58 8.00 -0.19 -4.92 116.55 117.13 3hbn n ASP 215 Ca -0.15 -0.78 -0.39 0.00 0.71 0.00 0.00 54.79 54.18 3hbn n ASP 215 Cb 0.52 -3.92 -0.00 0.00 -0.02 0.00 0.00 41.12 37.70 3hbn n ASP 215 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 3hbn s HIS 216 N -3.32 2.79 -1.65 1.24 2.46 -1.26 -4.94 115.29 110.61 3hbn s HIS 216 Ca 0.64 1.41 0.26 0.00 0.47 0.00 0.00 55.06 57.84 3hbn s HIS 216 Cb -0.32 -3.66 0.63 0.00 -0.13 0.00 0.00 32.58 29.10 3hbn s HIS 216 CO 0.83 -2.10 1.48 0.39 -2.47 0.00 0.00 174.74 172.87 3hbn n GLU 217 N 0.03 0.73 -3.37 2.88 1.02 -1.26 -4.60 120.64 116.07 3hbn n GLU 217 Ca 0.04 -0.46 -0.26 0.00 -0.02 0.00 0.00 57.16 56.47 3hbn n GLU 217 Cb 0.44 -1.49 -0.10 0.00 -0.02 0.00 0.00 31.44 30.27 3hbn n GLU 217 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 3hbn s ASN 218 N -2.58 1.50 0.38 1.62 3.84 -1.26 -4.96 114.94 113.48 3hbn s ASN 218 Ca 0.21 -2.81 0.08 0.00 0.21 0.00 0.00 52.86 50.55 3hbn s ASN 218 Cb 0.19 -0.28 0.76 0.00 -0.55 0.00 0.00 41.25 41.37 3hbn s ASN 218 CO 0.56 -0.19 1.94 0.40 -2.79 0.00 0.00 177.10 177.02 3hbn h ILE 219 N 4.72 1.16 -0.40 -5.21 1.08 -1.99 -2.68 117.51 114.19 3hbn h ILE 219 Ca 0.22 -0.64 0.03 0.00 -0.39 0.00 0.00 64.86 64.08 3hbn h ILE 219 Cb 0.93 0.99 -0.04 0.00 -3.07 0.00 0.00 36.82 35.64 3hbn h ILE 219 CO 0.33 0.21 0.19 0.00 -0.69 0.00 0.00 178.15 178.19 3hbn h ALA 220 N 1.63 0.49 -0.17 1.87 0.00 -1.93 -2.63 119.26 118.52 3hbn h ALA 220 Ca 0.08 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.02 3hbn h ALA 220 Cb 0.26 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3hbn h ALA 220 CO 0.01 -0.18 0.08 -0.22 0.00 0.00 0.00 179.25 178.94 3hbn h LYS 221 N 0.39 0.17 -0.68 0.00 3.64 -1.80 -0.55 116.57 117.74 3hbn h LYS 221 Ca 0.17 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 3hbn h LYS 221 Cb 0.09 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 3hbn h LYS 221 CO -0.13 0.11 0.00 1.28 -2.27 0.00 0.00 179.45 178.44 3hbn n LEU 222 N -5.02 0.00 0.00 5.20 4.77 -0.99 -0.77 117.00 120.19 3hbn n LEU 222 Ca -0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 3hbn n LEU 222 Cb 0.05 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 3hbn n LEU 222 CO 0.32 0.00 0.00 -3.20 -1.33 0.00 0.00 177.39 173.18 3hbn n ASN 224 N 0.63 0.00 -0.18 -1.43 5.15 -0.21 -3.08 115.26 116.14 3hbn n ASN 224 Ca 0.00 0.00 0.13 0.00 -0.60 0.00 0.00 54.58 54.11 3hbn n ASN 224 Cb 0.00 0.00 0.70 0.00 -0.53 0.00 0.00 39.78 39.95 3hbn n ASN 224 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3hbn n GLU 225 N 0.00 1.24 -4.99 1.20 1.02 0.05 -4.75 120.64 114.42 3hbn n GLU 225 Ca 0.00 -0.36 -0.31 0.00 -0.02 0.00 0.00 57.16 56.47 3hbn n GLU 225 Cb 0.00 -1.44 -0.14 0.00 -0.02 0.00 0.00 31.44 29.84 3hbn n GLU 225 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 3hbn s SER 226 N -1.86 3.51 0.06 1.62 0.01 -1.18 0.24 113.70 116.10 3hbn s SER 226 Ca 0.40 -0.40 -0.19 0.00 1.31 0.00 0.00 55.95 57.07 3hbn s SER 226 Cb 0.19 -0.53 -0.11 0.00 0.21 0.00 0.00 66.02 65.78 3hbn s SER 226 CO 0.32 0.30 1.42 0.78 0.41 0.00 0.00 173.24 176.47 3hbn h ASN 227 N 5.13 0.45 -3.81 2.44 2.35 -1.10 -3.45 115.58 117.59 3hbn h ASN 227 Ca -0.46 -0.41 -0.28 0.00 -0.55 0.00 0.00 56.30 54.60 3hbn h ASN 227 Cb 1.14 -0.12 -0.29 0.00 0.05 0.00 0.00 38.32 39.10 3hbn h ASN 227 CO 0.48 0.76 -0.74 -0.75 -1.65 0.00 0.00 177.43 175.53 3hbn s LYS 228 N -4.57 0.23 0.03 0.81 2.20 -0.78 -4.47 119.74 113.19 3hbn s LYS 228 Ca -0.14 -0.09 -0.00 0.00 -0.36 0.00 0.00 55.97 55.38 3hbn s LYS 228 Cb 0.06 -0.24 -0.04 0.00 -1.51 0.00 0.00 37.83 36.11 3hbn s LYS 228 CO 0.76 0.05 0.15 -0.51 -0.36 0.00 0.00 175.35 175.44 3hbn s LEU 229 N -0.00 4.16 -0.26 5.43 1.43 0.05 -1.04 118.68 128.44 3hbn s LEU 229 Ca 0.00 0.21 0.02 0.00 -1.03 0.00 0.00 54.13 53.33 3hbn s LEU 229 Cb -0.02 -2.63 0.07 0.00 0.03 0.00 0.00 46.19 43.63 3hbn s LEU 229 CO -0.00 0.22 -0.05 -0.63 0.23 0.00 0.00 176.35 176.11 3hbn s ILE 230 N -1.37 1.78 0.09 -0.59 1.01 0.93 -0.75 121.20 122.30 3hbn s ILE 230 Ca 0.29 -1.48 0.04 0.00 0.00 0.00 0.00 60.65 59.50 3hbn s ILE 230 Cb -0.13 -2.04 -0.04 0.00 0.01 0.00 0.00 42.46 40.27 3hbn s ILE 230 CO 0.22 -0.16 -0.10 0.27 0.00 0.00 0.00 174.94 175.16 3hbn s ILE 231 N 1.26 0.94 0.72 2.92 -4.36 -0.60 -1.93 121.20 120.15 3hbn s ILE 231 Ca -0.04 -1.61 -0.13 0.00 -0.26 0.00 0.00 60.65 58.61 3hbn s ILE 231 Cb -0.19 -1.33 0.03 0.00 1.25 0.00 0.00 42.46 42.22 3hbn s ILE 231 CO -0.07 -0.53 1.11 -0.94 0.24 0.00 0.00 174.94 174.75 3hbn s SER 232 N -2.38 4.70 -1.42 4.36 1.04 -1.04 -0.35 113.70 118.60 3hbn s SER 232 Ca 0.05 1.97 -0.08 0.00 0.48 0.00 0.00 55.95 58.37 3hbn s SER 232 Cb -0.03 -2.54 0.05 0.00 0.10 0.00 0.00 66.02 63.59 3hbn s SER 232 CO 0.00 -1.91 2.53 0.00 0.98 0.00 0.00 173.24 174.84 3hbn n ALA 233 N -2.96 6.90 -3.00 5.32 0.00 -0.51 -4.30 120.51 121.96 3hbn n ALA 233 Ca 0.10 -3.91 0.00 0.00 0.00 0.00 0.00 53.44 49.63 3hbn n ALA 233 Cb 0.52 -3.02 0.00 0.00 0.00 0.00 0.00 19.45 16.96 3hbn n ALA 233 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3hbn n SER 234 N 2.67 0.00 0.12 0.00 3.41 -1.26 -4.75 113.62 113.81 3hbn n SER 234 Ca 0.66 0.00 0.15 0.00 -0.26 0.00 0.00 58.87 59.42 3hbn n SER 234 Cb 0.26 0.00 0.68 0.00 -0.26 0.00 0.00 64.21 64.88 3hbn n SER 234 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3hbn h SER 235 N 0.00 0.00 -0.31 4.04 0.02 -1.96 -1.92 113.55 113.42 3hbn h SER 235 Ca 0.00 0.00 0.08 0.00 -0.84 0.00 0.00 61.79 61.03 3hbn h SER 235 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 3hbn h SER 235 CO 0.00 0.00 0.22 -0.07 -1.14 0.00 0.00 176.83 175.84 3hbn h LEU 236 N 0.00 0.06 -0.20 5.07 3.38 -1.95 -2.36 115.31 119.30 3hbn h LEU 236 Ca 0.14 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 3hbn h LEU 236 Cb 0.57 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 3hbn h LEU 236 CO -0.00 0.04 0.09 0.58 0.09 0.00 0.00 178.44 179.24 3hbn h VAL 237 N 0.07 1.14 -0.61 1.22 2.07 -1.53 0.83 116.25 119.44 3hbn h VAL 237 Ca 0.15 -0.42 -0.03 0.00 0.82 0.00 0.00 66.70 67.22 3hbn h VAL 237 Cb 0.49 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.28 3hbn h VAL 237 CO -0.01 0.14 0.25 0.78 0.02 0.00 0.00 177.57 178.75 3hbn h ASN 238 N 0.19 0.80 -0.01 0.57 4.21 -1.59 0.13 115.58 119.89 3hbn h ASN 238 Ca 0.07 -0.10 -0.00 0.00 1.21 0.00 0.00 56.30 57.48 3hbn h ASN 238 Cb 0.13 -0.21 -0.00 0.00 -1.12 0.00 0.00 38.32 37.13 3hbn h ASN 238 CO -0.01 0.71 0.00 -0.33 -1.29 0.00 0.00 177.43 176.52 3hbn h GLU 239 N 0.87 0.01 -0.86 0.81 5.08 -1.31 -1.80 114.58 117.38 3hbn h GLU 239 Ca 0.21 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.54 3hbn h GLU 239 Cb 0.15 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.36 3hbn h GLU 239 CO -0.02 0.17 0.43 0.00 -1.00 0.00 0.00 179.01 178.59 3hbn h ALA 240 N 0.84 1.13 -0.86 3.43 0.00 -0.47 -2.38 119.26 120.95 3hbn h ALA 240 Ca 0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3hbn h ALA 240 Cb 0.16 -0.34 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 3hbn h ALA 240 CO -0.00 0.67 0.51 -0.07 0.00 0.00 0.00 179.25 180.36 3hbn h LEU 241 N 1.23 1.04 -0.98 0.00 3.38 -0.64 -1.78 115.31 117.55 3hbn h LEU 241 Ca 0.30 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.16 3hbn h LEU 241 Cb 0.10 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 3hbn h LEU 241 CO -0.04 0.80 0.26 0.25 0.09 0.00 0.00 178.44 179.80 3hbn h LEU 242 N 1.18 0.92 -0.23 1.67 5.85 -0.96 -2.01 115.31 121.72 3hbn h LEU 242 Ca 0.31 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3hbn h LEU 242 Cb -0.04 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 40.75 3hbn h LEU 242 CO -0.06 0.82 0.00 0.18 -0.34 0.00 0.00 178.44 179.05 3hbn n LEU 243 N -4.30 0.36 -3.66 2.25 4.77 -0.93 -4.91 117.00 110.58 3hbn n LEU 243 Ca 0.06 -0.12 -0.28 0.00 -0.03 0.00 0.00 56.01 55.64 3hbn n LEU 243 Cb 0.18 -0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.29 3hbn n LEU 243 CO 0.40 0.06 0.06 0.29 -1.33 0.00 0.00 177.39 176.87 3hbn n LYS 244 N -0.70 -4.98 -2.11 3.23 5.02 -0.75 -4.95 118.16 112.92 3hbn n LYS 244 Ca 0.22 0.61 -0.32 0.00 -2.02 0.00 0.00 58.31 56.80 3hbn n LYS 244 Cb 0.16 -5.46 -0.00 0.00 -0.02 0.00 0.00 35.03 29.71 3hbn n LYS 244 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hbn s ALA 245 N -3.19 2.85 -0.19 7.82 0.00 -0.75 -5.03 121.76 123.26 3hbn s ALA 245 Ca 0.56 0.28 -0.23 0.00 0.00 0.00 0.00 51.96 52.57 3hbn s ALA 245 Cb -0.28 -3.19 -0.02 0.00 0.00 0.00 0.00 23.12 19.64 3hbn s ALA 245 CO 0.69 -0.66 0.72 1.21 0.00 0.00 0.00 175.76 177.72 3hbn s ASN 246 N -3.01 6.79 0.05 0.00 2.47 -1.26 -4.88 114.94 115.10 3hbn s ASN 246 Ca 0.61 0.97 -0.09 0.00 0.42 0.00 0.00 52.86 54.77 3hbn s ASN 246 Cb -0.14 -2.39 0.00 0.00 -1.45 0.00 0.00 41.25 37.27 3hbn s ASN 246 CO 0.37 -0.34 0.19 0.72 -3.72 0.00 0.00 177.10 174.32 3hbn s PHE 247 N 2.10 0.08 -0.08 0.43 -0.71 -1.26 -0.77 117.98 117.76 3hbn s PHE 247 Ca 0.33 -0.34 -0.00 0.00 -1.04 0.00 0.00 56.93 55.87 3hbn s PHE 247 Cb -0.16 -0.04 -0.03 0.00 -1.21 0.00 0.00 43.02 41.58 3hbn s PHE 247 CO 0.11 -0.45 -0.05 0.21 -1.34 0.00 0.00 175.22 173.70 3hbn s LYS 248 N -2.83 2.91 -0.02 1.99 2.20 0.07 -4.37 119.74 119.69 3hbn s LYS 248 Ca -0.03 -0.51 0.01 0.00 -0.36 0.00 0.00 55.97 55.08 3hbn s LYS 248 Cb 0.00 -2.68 -0.04 0.00 -1.51 0.00 0.00 37.83 33.61 3hbn s LYS 248 CO -0.05 0.63 0.00 0.00 -0.36 0.00 0.00 175.35 175.57 3hbn s ALA 249 N -0.70 3.29 -0.21 3.13 0.00 -0.23 -1.56 121.76 125.47 3hbn s ALA 249 Ca 0.11 -0.92 -0.05 0.00 0.00 0.00 0.00 51.96 51.10 3hbn s ALA 249 Cb -0.11 -1.37 -0.02 0.00 0.00 0.00 0.00 23.12 21.62 3hbn s ALA 249 CO 0.02 0.64 -0.02 0.42 0.00 0.00 0.00 175.76 176.82 3hbn s ILE 250 N -1.06 3.72 -0.77 0.00 -1.09 0.53 -0.87 121.20 121.67 3hbn s ILE 250 Ca 0.19 -0.39 -0.24 0.00 -2.23 0.00 0.00 60.65 57.98 3hbn s ILE 250 Cb -0.11 -2.69 0.05 0.00 -1.58 0.00 0.00 42.46 38.13 3hbn s ILE 250 CO 0.09 0.42 1.18 0.00 -1.23 0.00 0.00 174.94 175.40 3hbn h TYR 252 N 9.74 0.41 -4.30 0.00 5.03 -1.93 -3.37 116.97 122.55 3hbn h TYR 252 Ca -0.18 -0.18 -0.16 0.00 2.58 0.00 0.00 58.73 60.79 3hbn h TYR 252 Cb 1.05 -0.06 -0.14 0.00 1.55 0.00 0.00 36.73 39.12 3hbn h TYR 252 CO 1.10 0.91 -0.58 0.14 -1.32 0.00 0.00 178.16 178.41 3hbn s VAL 253 N -3.63 0.10 0.35 1.81 -7.23 -1.26 -4.42 120.40 106.12 3hbn s VAL 253 Ca -0.15 -1.79 0.05 0.00 -1.81 0.00 0.00 61.98 58.28 3hbn s VAL 253 Cb 0.03 -1.98 0.29 0.00 0.56 0.00 0.00 36.38 35.29 3hbn s VAL 253 CO 0.77 -0.45 1.94 0.11 -0.31 0.00 0.00 175.10 177.15 3hbn h LYS 254 N 2.81 0.79 0.00 4.82 1.57 -1.96 -1.99 116.57 122.61 3hbn h LYS 254 Ca -0.34 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.39 3hbn h LYS 254 Cb 1.20 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.33 3hbn h LYS 254 CO 0.57 0.52 0.00 0.27 -0.57 0.00 0.00 179.45 180.24 3hbn n ASN 255 N -4.49 0.40 -0.58 0.86 0.23 -1.26 -1.61 115.26 108.80 3hbn n ASN 255 Ca 0.12 0.67 0.13 0.00 -0.53 0.00 0.00 54.58 54.98 3hbn n ASN 255 Cb 0.24 -0.73 0.43 0.00 -2.08 0.00 0.00 39.78 37.64 3hbn n ASN 255 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3hbn n GLN 256 N -2.02 1.80 -0.16 -3.83 6.02 -0.75 -4.49 117.38 113.95 3hbn n GLN 256 Ca -0.01 -1.17 -0.01 0.00 -0.01 0.00 0.00 57.00 55.80 3hbn n GLN 256 Cb 0.05 -1.47 0.23 0.00 1.02 0.00 0.00 30.24 30.06 3hbn n GLN 256 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 3hbn h GLU 257 N 2.79 0.88 -0.27 -1.09 5.08 -1.47 -0.84 114.58 119.66 3hbn h GLU 257 Ca 0.00 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.24 3hbn h GLU 257 Cb 0.59 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 3hbn h GLU 257 CO 0.00 0.69 0.16 0.77 -1.00 0.00 0.00 179.01 179.63 3hbn h SER 258 N 0.88 0.32 -0.34 1.42 0.02 -1.84 0.82 113.55 114.84 3hbn h SER 258 Ca 0.22 -0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.10 3hbn h SER 258 Cb 0.10 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.54 3hbn h SER 258 CO -0.03 0.28 0.17 0.74 -1.14 0.00 0.00 176.83 176.85 3hbn h THR 259 N 0.34 1.16 -0.39 -2.27 2.02 -1.81 -2.61 112.91 109.34 3hbn h THR 259 Ca 0.10 -0.44 0.04 0.00 0.77 0.00 0.00 66.41 66.88 3hbn h THR 259 Cb 0.02 0.82 -0.04 0.00 -1.74 0.00 0.00 68.15 67.21 3hbn h THR 259 CO -0.02 0.16 0.15 0.00 0.37 0.00 0.00 175.52 176.19 3hbn h ALA 260 N 1.03 0.46 -0.34 6.16 0.00 -0.77 -1.12 119.26 124.68 3hbn h ALA 260 Ca 0.12 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.09 3hbn h ALA 260 Cb 0.10 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 3hbn h ALA 260 CO -0.02 -0.23 0.16 1.15 0.00 0.00 0.00 179.25 180.31 3hbn h THR 261 N 0.32 0.96 -0.58 0.00 2.02 -0.78 -1.84 112.91 113.02 3hbn h THR 261 Ca 0.17 -0.11 -0.03 0.00 0.77 0.00 0.00 66.41 67.21 3hbn h THR 261 Cb 0.14 0.60 -0.03 0.00 -1.74 0.00 0.00 68.15 67.12 3hbn h THR 261 CO -0.16 0.06 0.25 -0.25 0.37 0.00 0.00 175.52 175.79 3hbn h TRP 262 N 0.33 0.87 -0.73 3.16 7.01 -1.11 -1.49 115.95 124.00 3hbn h TRP 262 Ca 0.15 -0.06 -0.01 0.00 2.11 0.00 0.00 58.89 61.08 3hbn h TRP 262 Cb 0.07 -0.26 -0.04 0.00 -2.10 0.00 0.00 29.16 26.83 3hbn h TRP 262 CO -0.11 0.69 0.43 -0.07 -2.79 0.00 0.00 178.44 176.60 3hbn h LEU 263 N 0.80 0.89 -0.04 0.65 3.38 -0.94 -0.60 115.31 119.45 3hbn h LEU 263 Ca 0.20 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 3hbn h LEU 263 Cb 0.18 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 3hbn h LEU 263 CO -0.02 0.70 0.03 0.00 0.09 0.00 0.00 178.44 179.24 3hbn h ALA 264 N 1.23 0.06 -0.98 1.53 0.00 -1.12 -0.77 119.26 119.21 3hbn h ALA 264 Ca 0.26 -0.03 0.18 0.00 0.00 0.00 0.00 54.91 55.33 3hbn h ALA 264 Cb -0.02 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 17.66 3hbn h ALA 264 CO -0.05 -0.42 0.61 -0.22 0.00 0.00 0.00 179.25 179.17 3hbn h LYS 265 N 0.01 0.67 -0.03 0.00 3.64 -0.96 0.10 116.57 120.00 3hbn h LYS 265 Ca 0.02 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3hbn h LYS 265 Cb 0.05 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.72 3hbn h LYS 265 CO -0.00 0.44 0.00 1.63 -2.27 0.00 0.00 179.45 179.25 3hbn n LYS 266 N -4.67 1.26 -0.48 1.90 4.76 -0.26 -4.90 118.16 115.77 3hbn n LYS 266 Ca 0.22 -0.39 0.00 0.00 -2.87 0.00 0.00 58.31 55.27 3hbn n LYS 266 Cb 0.58 -1.41 0.00 0.00 -1.84 0.00 0.00 35.03 32.36 3hbn n LYS 266 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3hbn n GLY 267 N 0.99 0.73 3.84 0.72 0.00 0.35 -5.06 105.19 106.76 3hbn n GLY 267 Ca 0.18 -0.27 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 3hbn n GLY 267 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hbn s TYR 268 N -2.00 3.43 0.15 1.61 1.51 -0.35 -5.01 117.35 116.69 3hbn s TYR 268 Ca 0.00 1.27 -0.31 0.00 -1.01 0.00 0.00 57.07 57.03 3hbn s TYR 268 Cb 0.00 -2.57 -0.08 0.00 -0.11 0.00 0.00 41.96 39.20 3hbn s TYR 268 CO 0.00 0.14 1.33 -1.21 -1.11 0.00 0.00 175.55 174.70 3hbn s GLU 269 N -2.76 4.37 -0.07 -0.62 2.02 -1.26 -4.17 118.70 116.20 3hbn s GLU 269 Ca 0.52 2.03 -0.00 0.00 0.02 0.00 0.00 54.97 57.54 3hbn s GLU 269 Cb -0.12 -3.23 0.02 0.00 0.10 0.00 0.00 34.13 30.91 3hbn s GLU 269 CO 0.18 -0.33 -0.05 0.08 0.02 0.00 0.00 175.26 175.17 3hbn s VAL 270 N 0.61 0.68 -0.23 2.63 1.01 -1.26 -1.07 120.40 122.76 3hbn s VAL 270 Ca 0.60 -0.12 -0.08 0.00 0.00 0.00 0.00 61.98 62.38 3hbn s VAL 270 Cb -0.36 -0.73 -0.04 0.00 0.00 0.00 0.00 36.38 35.25 3hbn s VAL 270 CO 0.34 0.29 0.10 -0.70 0.00 0.00 0.00 175.10 175.13 3hbn s GLU 271 N 1.46 3.83 0.00 2.72 2.56 -0.05 -4.99 118.70 124.23 3hbn s GLU 271 Ca -0.02 -0.40 0.16 0.00 0.00 0.00 0.00 54.97 54.72 3hbn s GLU 271 Cb -0.13 -3.37 -0.02 0.00 2.00 0.00 0.00 34.13 32.61 3hbn s GLU 271 CO -0.04 -0.03 0.84 0.66 -0.56 0.00 0.00 175.26 176.13 3hbn n TYR 272 N 4.50 0.00 0.25 5.30 4.02 -1.26 -0.78 117.16 129.18 3hbn n TYR 272 Ca -0.16 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 57.81 3hbn n TYR 272 Cb 0.52 0.00 0.62 0.00 -0.02 0.00 0.00 39.34 40.46 3hbn n TYR 272 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 176.86 177.42 3hbn h LYS 273 N 1.62 0.00 0.00 -0.72 2.10 -1.94 -2.46 116.57 115.17 3hbn h LYS 273 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3hbn h LYS 273 Cb 0.53 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.86 3hbn h LYS 273 CO 0.00 0.07 0.00 0.66 -2.00 0.00 0.00 179.45 178.18 3hbn n TYR 274 N -4.33 0.00 0.25 0.07 4.02 -1.26 -1.56 117.16 114.35 3hbn n TYR 274 Ca -0.03 0.00 0.11 0.00 -0.01 0.00 0.00 57.90 57.97 3hbn n TYR 274 Cb 0.16 -0.35 0.67 0.00 -0.02 0.00 0.00 39.34 39.80 3hbn n TYR 274 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 3hbn h LEU 275 N 0.00 0.00-10.01 7.72 3.38 -1.59 -3.45 115.31 111.36 3hbn h LEU 275 Ca 0.00 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.47 3hbn h LEU 275 Cb 0.23 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.03 3hbn h LEU 275 CO 0.00 0.13 0.45 -1.61 0.09 0.00 0.00 178.44 177.50 3hbn s GLU 276 N -4.37 3.81 0.47 1.13 0.41 -0.60 -4.92 118.70 114.63 3hbn s GLU 276 Ca -0.03 1.64 0.15 0.00 -0.41 0.00 0.00 54.97 56.32 3hbn s GLU 276 Cb 0.14 -2.35 1.10 0.00 -1.78 0.00 0.00 34.13 31.24 3hbn s GLU 276 CO 0.62 -0.47 2.04 1.25 -0.49 0.00 0.00 175.26 178.20 3hbn h HIS 277 N 2.00 0.00 0.00 1.61 2.76 -1.89 -1.84 115.15 117.79 3hbn h HIS 277 Ca -0.49 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.68 3hbn h HIS 277 Cb 1.24 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.20 3hbn h HIS 277 CO 0.55 0.13 0.00 -2.39 -1.30 0.00 0.00 177.93 174.91 3hbn n HIS 278 N -4.35 0.56 -0.26 5.26 1.44 -1.26 -1.83 115.22 114.77 3hbn n HIS 278 Ca -0.03 0.24 0.06 0.00 -2.01 0.00 0.00 57.72 55.99 3hbn n HIS 278 Cb 0.20 -0.88 0.29 0.00 0.12 0.00 0.00 29.99 29.72 3hbn n HIS 278 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 3hbn n HIS 279 N -2.03 1.36 0.30 -1.40 8.25 -0.69 -4.52 115.22 116.49 3hbn n HIS 279 Ca 0.02 -0.50 0.19 0.00 -0.26 0.00 0.00 57.72 57.16 3hbn n HIS 279 Cb 0.16 -0.30 0.87 0.00 1.12 0.00 0.00 29.99 31.84 3hbn n HIS 279 CO 0.00 0.00 0.00 1.12 0.64 0.00 0.00 176.34 178.10 3hbn h HIS 280 N 3.13 0.00 -3.44 4.41 2.07 -1.53 -3.44 115.15 116.35 3hbn h HIS 280 Ca 0.00 0.00 -0.14 0.00 -2.85 0.00 0.00 60.37 57.38 3hbn h HIS 280 Cb 1.38 0.00 -0.20 0.00 2.57 0.00 0.00 27.41 31.16 3hbn h HIS 280 CO 0.71 0.01 -0.44 -1.01 -3.07 0.00 0.00 177.93 174.13 3hbn s HIS 281 N -3.85 0.01 0.00 6.12 3.76 -1.26 -4.20 115.29 115.87 3hbn s HIS 281 Ca -0.01 -0.09 0.00 0.00 -0.15 0.00 0.00 55.06 54.80 3hbn s HIS 281 Cb 0.10 -0.02 0.00 0.00 1.11 0.00 0.00 32.58 33.77 3hbn s HIS 281 CO 0.50 -0.32 0.00 0.72 -0.85 0.00 0.00 174.74 174.79