#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bzf s ALA 2 N 0.00 3.08 0.07 2.41 0.00 -0.44 -1.99 121.76 124.89 1bzf s ALA 2 Ca 0.00 -2.56 -0.30 0.00 0.00 0.00 0.00 51.96 49.10 1bzf s ALA 2 Cb 0.00 -2.27 -0.05 0.00 0.00 0.00 0.00 23.12 20.80 1bzf s ALA 2 CO 0.00 -1.77 1.11 -0.06 0.00 0.00 0.00 175.76 175.04 1bzf s PHE 3 N 1.02 3.54 -0.19 0.00 0.40 -0.72 -2.71 117.98 119.33 1bzf s PHE 3 Ca 0.09 1.48 -0.04 0.00 -0.60 0.00 0.00 56.93 57.87 1bzf s PHE 3 Cb -0.22 -3.30 0.09 0.00 0.51 0.00 0.00 43.02 40.11 1bzf s PHE 3 CO -0.05 -0.77 0.28 -1.17 0.70 0.00 0.00 175.22 174.21 1bzf s LEU 4 N 0.70 -0.31 -0.01 -0.37 2.96 -1.11 -0.84 118.68 119.71 1bzf s LEU 4 Ca 0.55 0.20 -0.05 0.00 -0.22 0.00 0.00 54.13 54.60 1bzf s LEU 4 Cb -0.27 0.69 -0.00 0.00 0.50 0.00 0.00 46.19 47.11 1bzf s LEU 4 CO 0.30 -0.29 0.10 -1.66 -1.32 0.00 0.00 176.35 173.48 1bzf s TRP 5 N 2.42 0.04 -0.36 5.38 -2.14 -1.15 -4.42 118.94 118.71 1bzf s TRP 5 Ca 0.06 -0.08 -0.15 0.00 2.66 0.00 0.00 56.10 58.59 1bzf s TRP 5 Cb -0.14 -0.05 -0.01 0.00 -3.10 0.00 0.00 33.47 30.17 1bzf s TRP 5 CO -0.12 -0.20 0.34 0.00 -2.66 0.00 0.00 176.95 174.31 1bzf s ALA 6 N -0.99 3.49 0.05 2.67 0.00 -1.26 -2.97 121.76 122.75 1bzf s ALA 6 Ca -0.11 -1.32 0.03 0.00 0.00 0.00 0.00 51.96 50.56 1bzf s ALA 6 Cb -0.06 -2.83 -0.03 0.00 0.00 0.00 0.00 23.12 20.20 1bzf s ALA 6 CO 0.01 -1.15 -0.10 1.14 0.00 0.00 0.00 175.76 175.65 1bzf s GLN 7 N 1.95 0.65 0.47 0.00 -2.07 -1.08 -4.38 119.66 115.20 1bzf s GLN 7 Ca 0.10 -0.84 0.07 0.00 -1.82 0.00 0.00 55.36 52.87 1bzf s GLN 7 Cb -0.17 -0.50 0.03 0.00 -1.09 0.00 0.00 33.01 31.28 1bzf s GLN 7 CO 0.12 0.10 0.65 0.16 -1.32 0.00 0.00 175.29 174.99 1bzf s ASP 8 N -1.67 5.48 0.65 12.60 1.47 -1.08 -3.48 116.67 130.63 1bzf s ASP 8 Ca -0.07 -0.41 0.43 0.00 1.18 0.00 0.00 52.55 53.68 1bzf s ASP 8 Cb -0.10 -0.54 2.30 0.00 -0.34 0.00 0.00 42.92 44.24 1bzf s ASP 8 CO 0.01 -0.94 2.32 0.08 0.68 0.00 0.00 175.17 177.32 1bzf h ARG 9 N 0.44 0.00 -0.45 2.11 0.11 -1.86 -1.05 114.38 113.70 1bzf h ARG 9 Ca -0.39 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.69 1bzf h ARG 9 Cb 1.28 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.36 1bzf h ARG 9 CO 0.45 0.00 0.00 -0.25 0.10 0.00 0.00 179.97 180.27 1bzf n ASP 10 N -3.06 0.45 -3.14 0.08 9.92 -1.26 -4.81 116.55 114.73 1bzf n ASP 10 Ca -0.03 -1.77 -0.21 0.00 -0.53 0.00 0.00 54.79 52.26 1bzf n ASP 10 Cb 0.09 -0.22 0.06 0.00 -0.64 0.00 0.00 41.12 40.41 1bzf n ASP 10 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1bzf n GLY 11 N 0.22 -0.41 3.86 0.44 0.00 -0.40 -5.00 105.19 103.90 1bzf n GLY 11 Ca 0.00 0.13 -0.21 0.00 0.00 0.00 0.00 46.02 45.94 1bzf n GLY 11 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1bzf s LEU 12 N -6.54 3.56 0.00 0.99 2.96 -1.23 -3.42 118.68 115.00 1bzf s LEU 12 Ca 0.46 -0.55 0.00 0.00 -0.22 0.00 0.00 54.13 53.82 1bzf s LEU 12 Cb -0.20 -2.19 0.00 0.00 0.50 0.00 0.00 46.19 44.29 1bzf s LEU 12 CO 0.56 -0.43 0.00 2.30 -1.32 0.00 0.00 176.35 177.47 1bzf n ILE 13 N -1.43 0.00 -3.63 6.68 -5.35 -1.17 -2.64 119.36 111.83 1bzf n ILE 13 Ca -0.00 0.00 -0.07 0.00 -0.27 0.00 0.00 62.75 62.41 1bzf n ILE 13 Cb 0.60 0.00 0.01 0.00 -1.74 0.00 0.00 39.64 38.51 1bzf n ILE 13 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1bzf n GLY 14 N 0.19 1.74 3.22 3.28 0.00 -1.26 -4.78 105.19 107.58 1bzf n GLY 14 Ca 0.00 -1.29 0.04 0.00 0.00 0.00 0.00 46.02 44.77 1bzf n GLY 14 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1bzf s LYS 15 N -2.21 0.14 -1.57 1.61 2.20 -0.70 -3.90 119.74 115.30 1bzf s LYS 15 Ca 0.13 0.30 -0.05 0.00 -0.36 0.00 0.00 55.97 56.00 1bzf s LYS 15 Cb -0.02 0.18 0.01 0.00 -1.51 0.00 0.00 37.83 36.48 1bzf s LYS 15 CO 0.09 -0.09 0.60 -0.25 -0.36 0.00 0.00 175.35 175.35 1bzf n ASP 16 N 5.04 -6.17 0.00 1.43 8.00 -1.26 -2.87 116.55 120.72 1bzf n ASP 16 Ca -0.08 -0.29 0.00 0.00 0.71 0.00 0.00 54.79 55.14 1bzf n ASP 16 Cb 0.54 -4.99 0.00 0.00 -0.02 0.00 0.00 41.12 36.66 1bzf n ASP 16 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bzf n GLY 17 N -1.53 1.72 3.86 0.44 0.00 -1.26 -4.92 105.19 103.50 1bzf n GLY 17 Ca -0.12 -0.12 -0.30 0.00 0.00 0.00 0.00 46.02 45.48 1bzf n GLY 17 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1bzf s HIS 18 N 0.00 1.64 0.62 1.61 -3.43 -1.14 -4.91 115.29 109.68 1bzf s HIS 18 Ca 0.00 0.44 -0.13 0.00 -0.80 0.00 0.00 55.06 54.57 1bzf s HIS 18 Cb 0.00 -3.89 -0.03 0.00 -1.43 0.00 0.00 32.58 27.23 1bzf s HIS 18 CO 0.00 -2.73 1.04 -0.51 -2.00 0.00 0.00 174.74 170.54 1bzf s LEU 19 N -6.04 3.32 0.08 5.38 1.43 -1.26 -1.72 118.68 119.87 1bzf s LEU 19 Ca 0.71 1.60 -0.01 0.00 -1.03 0.00 0.00 54.13 55.40 1bzf s LEU 19 Cb -0.06 -4.50 -0.27 0.00 0.03 0.00 0.00 46.19 41.39 1bzf s LEU 19 CO 0.53 -1.08 1.15 1.55 0.23 0.00 0.00 176.35 178.73 1bzf h PRO 20 N -0.07 0.20 0.00 1.29 0.13 -1.84 -3.44 132.00 128.27 1bzf h PRO 20 Ca -0.45 -0.35 -0.03 0.00 -0.87 0.00 0.00 66.00 64.30 1bzf h PRO 20 Cb 1.20 0.13 -0.00 0.00 0.13 0.00 0.00 31.00 32.46 1bzf h PRO 20 CO 0.59 1.16 -0.01 -2.67 -0.23 0.00 0.00 178.00 176.83 1bzf n TRP 21 N -3.48 -1.72 -3.52 1.56 2.14 -1.26 -5.03 117.44 106.12 1bzf n TRP 21 Ca -0.07 -0.14 -0.29 0.00 2.07 0.00 0.00 57.50 59.07 1bzf n TRP 21 Cb 1.01 -0.03 -0.12 0.00 -0.81 0.00 0.00 31.31 31.36 1bzf n TRP 21 CO 0.00 0.00 0.00 -1.58 2.07 0.00 0.00 177.69 178.18 1bzf s HIS 22 N 0.01 1.25 -0.88 -2.67 2.46 -1.26 -5.04 115.29 109.16 1bzf s HIS 22 Ca 0.02 -2.08 -0.03 0.00 0.47 0.00 0.00 55.06 53.44 1bzf s HIS 22 Cb -0.00 -1.23 0.22 0.00 -0.13 0.00 0.00 32.58 31.44 1bzf s HIS 22 CO 0.01 -0.80 0.77 -1.17 -2.47 0.00 0.00 174.74 171.08 1bzf s LEU 23 N 0.51 5.64 0.37 8.88 2.96 -1.26 -4.92 118.68 130.87 1bzf s LEU 23 Ca 0.22 -3.55 0.18 0.00 -0.22 0.00 0.00 54.13 50.76 1bzf s LEU 23 Cb -0.15 -1.94 1.14 0.00 0.50 0.00 0.00 46.19 45.73 1bzf s LEU 23 CO -0.05 -0.23 1.68 -0.65 -1.32 0.00 0.00 176.35 175.77 1bzf h PRO 24 N 6.29 0.30 -0.82 0.98 0.10 -1.99 0.37 132.00 137.23 1bzf h PRO 24 Ca 0.14 -0.02 -0.04 0.00 0.10 0.00 0.00 66.00 66.18 1bzf h PRO 24 Cb 0.85 -0.07 -0.04 0.00 0.10 0.00 0.00 31.00 31.84 1bzf h PRO 24 CO 0.85 0.20 0.37 0.22 0.10 0.00 0.00 178.00 179.74 1bzf h ASP 25 N 0.31 1.10 0.01 -2.05 3.58 -2.00 -2.05 116.42 115.32 1bzf h ASP 25 Ca 0.72 -0.15 -0.07 0.00 0.42 0.00 0.00 57.03 57.95 1bzf h ASP 25 Cb 1.78 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 42.54 1bzf h ASP 25 CO -0.50 0.94 -0.20 -0.78 -2.88 0.00 0.00 179.24 175.82 1bzf h ASP 26 N 1.18 0.34 0.77 2.28 3.58 -0.68 -1.87 116.42 122.02 1bzf h ASP 26 Ca 0.28 -0.10 -0.05 0.00 0.42 0.00 0.00 57.03 57.58 1bzf h ASP 26 Cb 0.15 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.11 1bzf h ASP 26 CO -0.03 0.56 -0.24 -0.07 -2.88 0.00 0.00 179.24 176.58 1bzf h LEU 27 N 0.32 0.00 0.00 2.28 3.38 -1.05 -2.49 115.31 117.75 1bzf h LEU 27 Ca 0.06 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.80 1bzf h LEU 27 Cb 0.54 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.25 1bzf h LEU 27 CO 0.04 0.24 -1.21 0.45 0.09 0.00 0.00 178.44 178.04 1bzf h HIS 28 N 0.00 0.00 0.00 1.13 3.86 -0.85 -3.28 115.15 116.02 1bzf h HIS 28 Ca -0.00 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.12 1bzf h HIS 28 Cb 0.69 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.15 1bzf h HIS 28 CO 0.00 0.96 -0.41 -0.92 0.86 0.00 0.00 177.93 178.41 1bzf h TYR 29 N 0.00 0.00 -0.27 2.45 3.20 -1.10 -3.09 116.97 118.15 1bzf h TYR 29 Ca -0.10 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.73 1bzf h TYR 29 Cb 1.82 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 40.08 1bzf h TYR 29 CO 0.00 0.41 0.02 0.35 -1.64 0.00 0.00 178.16 177.30 1bzf h PHE 30 N 0.00 0.51 -0.06 -3.82 3.57 -1.51 -0.17 116.94 115.46 1bzf h PHE 30 Ca -0.00 -0.08 -0.06 0.00 3.53 0.00 0.00 57.97 61.36 1bzf h PHE 30 Cb 1.08 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.68 1bzf h PHE 30 CO 0.00 0.60 -0.23 -0.09 -2.23 0.00 0.00 178.31 176.36 1bzf h ARG 31 N 0.26 0.10 0.00 1.11 2.43 -1.65 -2.29 114.38 114.35 1bzf h ARG 31 Ca 0.08 -0.03 -0.18 0.00 -0.81 0.00 0.00 59.98 59.04 1bzf h ARG 31 Cb 0.39 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.91 1bzf h ARG 31 CO 0.01 0.33 -0.85 0.00 -1.51 0.00 0.00 179.97 177.95 1bzf h ALA 32 N 1.68 0.58 -0.89 2.80 0.00 -1.40 -2.85 119.26 119.18 1bzf h ALA 32 Ca 0.02 -0.75 -0.50 0.00 0.00 0.00 0.00 54.91 53.67 1bzf h ALA 32 Cb 0.47 -0.11 -0.27 0.00 0.00 0.00 0.00 17.79 17.87 1bzf h ALA 32 CO 0.03 1.00 0.64 1.04 0.00 0.00 0.00 179.25 181.96 1bzf n GLN 33 N -3.58 2.22 0.00 0.00 1.13 -0.11 -4.19 117.38 112.85 1bzf n GLN 33 Ca -0.02 -2.75 0.00 0.00 -1.94 0.00 0.00 57.00 52.30 1bzf n GLN 33 Cb 0.80 -2.08 0.00 0.00 0.11 0.00 0.00 30.24 29.08 1bzf n GLN 33 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1bzf n THR 34 N -0.89 0.00 -2.22 5.09 -2.24 -1.04 -4.98 114.28 108.00 1bzf n THR 34 Ca 0.54 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.90 1bzf n THR 34 Cb 1.31 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 69.51 1bzf n THR 34 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1bzf s VAL 35 N -1.00 3.54 0.00 2.28 -7.23 -1.08 -2.80 120.40 114.11 1bzf s VAL 35 Ca 0.00 1.06 0.00 0.00 -1.81 0.00 0.00 61.98 61.23 1bzf s VAL 35 Cb 0.00 -3.68 0.00 0.00 0.56 0.00 0.00 36.38 33.26 1bzf s VAL 35 CO 0.00 0.05 0.00 0.61 -0.31 0.00 0.00 175.10 175.45 1bzf n GLY 36 N 3.52 0.68 3.74 2.32 0.00 -1.24 -5.02 105.19 109.20 1bzf n GLY 36 Ca 0.12 -0.72 -0.09 0.00 0.00 0.00 0.00 46.02 45.33 1bzf n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bzf s LYS 37 N -3.69 1.81 -0.39 1.61 1.02 -1.12 -4.61 119.74 114.37 1bzf s LYS 37 Ca 0.00 -1.21 -0.21 0.00 0.02 0.00 0.00 55.97 54.56 1bzf s LYS 37 Cb 0.00 0.56 0.01 0.00 -0.52 0.00 0.00 37.83 37.88 1bzf s LYS 37 CO 0.00 -0.81 0.67 0.42 -0.92 0.00 0.00 175.35 174.71 1bzf s ILE 38 N -3.58 4.83 -0.60 2.17 1.01 -0.92 -2.95 121.20 121.15 1bzf s ILE 38 Ca 0.17 0.47 -0.27 0.00 0.00 0.00 0.00 60.65 61.01 1bzf s ILE 38 Cb -0.04 -4.15 0.03 0.00 0.01 0.00 0.00 42.46 38.31 1bzf s ILE 38 CO 0.09 -0.45 1.15 -0.32 0.00 0.00 0.00 174.94 175.41 1bzf s MET 39 N 2.85 3.42 -0.18 2.79 1.75 0.55 -2.90 119.30 127.57 1bzf s MET 39 Ca 0.25 0.05 -0.02 0.00 -1.25 0.00 0.00 55.69 54.72 1bzf s MET 39 Cb -0.14 -4.05 -0.01 0.00 2.84 0.00 0.00 34.83 33.47 1bzf s MET 39 CO 0.17 -1.71 -0.08 0.08 -0.65 0.00 0.00 175.02 172.82 1bzf s VAL 40 N 4.84 3.18 0.21 10.11 1.01 -1.13 -1.10 120.40 137.52 1bzf s VAL 40 Ca 0.39 -0.58 0.04 0.00 0.00 0.00 0.00 61.98 61.83 1bzf s VAL 40 Cb -0.09 -2.40 -0.02 0.00 0.00 0.00 0.00 36.38 33.88 1bzf s VAL 40 CO 0.22 0.47 0.15 1.33 0.00 0.00 0.00 175.10 177.28 1bzf n VAL 41 N 4.30 0.00 -2.25 2.92 0.24 -0.99 -2.77 118.33 119.77 1bzf n VAL 41 Ca -0.18 -1.48 0.00 0.00 -2.04 0.00 0.00 64.34 60.64 1bzf n VAL 41 Cb 0.51 0.69 0.00 0.00 -1.47 0.00 0.00 33.84 33.57 1bzf n VAL 41 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1bzf n GLY 42 N -0.20 1.58 0.14 7.63 0.00 -0.20 -3.00 105.19 111.14 1bzf n GLY 42 Ca 0.03 -2.03 -0.23 0.00 0.00 0.00 0.00 46.02 43.79 1bzf n GLY 42 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1bzf h ARG 43 N 0.00 0.41 -0.11 1.61 3.08 -1.92 -2.61 114.38 114.84 1bzf h ARG 43 Ca 0.00 -0.70 -0.13 0.00 0.07 0.00 0.00 59.98 59.22 1bzf h ARG 43 Cb 0.00 0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 1bzf h ARG 43 CO 0.00 1.34 -0.49 -0.09 -1.07 0.00 0.00 179.97 179.66 1bzf h ARG 44 N -0.02 0.29 0.00 0.04 2.43 -1.97 -2.86 114.38 112.30 1bzf h ARG 44 Ca -0.28 -0.16 -0.16 0.00 -0.81 0.00 0.00 59.98 58.57 1bzf h ARG 44 Cb 2.01 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 31.54 1bzf h ARG 44 CO 0.19 0.72 -0.77 1.15 -1.51 0.00 0.00 179.97 179.75 1bzf h THR 45 N 0.24 1.50 -0.31 0.20 2.02 -1.92 -2.27 112.91 112.37 1bzf h THR 45 Ca 0.01 -2.70 -0.10 0.00 0.77 0.00 0.00 66.41 64.40 1bzf h THR 45 Cb 0.94 2.48 -0.01 0.00 -1.74 0.00 0.00 68.15 69.82 1bzf h THR 45 CO 0.08 0.76 -0.21 0.22 0.37 0.00 0.00 175.52 176.73 1bzf h TYR 46 N 0.00 0.66 0.00 3.16 3.20 -1.25 -2.77 116.97 119.97 1bzf h TYR 46 Ca -0.01 -0.13 -0.12 0.00 3.14 0.00 0.00 58.73 61.60 1bzf h TYR 46 Cb 1.42 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 39.50 1bzf h TYR 46 CO 0.00 0.76 -0.78 0.93 -1.64 0.00 0.00 178.16 177.42 1bzf h GLU 47 N 0.52 0.00 0.00 1.82 5.08 -1.48 -3.23 114.58 117.29 1bzf h GLU 47 Ca 0.08 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 1bzf h GLU 47 Cb 0.65 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.90 1bzf h GLU 47 CO 0.05 0.45 -0.04 0.66 -1.00 0.00 0.00 179.01 179.13 1bzf h SER 48 N 0.00 0.00 -3.88 1.42 4.64 -1.11 -3.43 113.55 111.19 1bzf h SER 48 Ca -0.05 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.79 1bzf h SER 48 Cb 1.44 0.00 0.19 0.00 -0.31 0.00 0.00 62.40 63.73 1bzf h SER 48 CO 0.06 0.04 0.16 -0.36 -0.87 0.00 0.00 176.83 175.85 1bzf s PHE 49 N -4.20 1.68 0.00 4.77 0.08 -1.19 -4.86 117.98 114.26 1bzf s PHE 49 Ca -0.03 1.47 0.00 0.00 0.12 0.00 0.00 56.93 58.49 1bzf s PHE 49 Cb 0.13 -3.21 0.00 0.00 -0.57 0.00 0.00 43.02 39.37 1bzf s PHE 49 CO 0.51 -3.08 0.00 -0.35 -0.10 0.00 0.00 175.22 172.20 1bzf n PRO 50 N -4.39 0.00 -3.85 0.24 -0.04 -1.26 -4.80 135.00 120.89 1bzf n PRO 50 Ca 0.08 0.30 -0.35 0.00 -0.04 0.00 0.00 63.50 63.48 1bzf n PRO 50 Cb 0.53 -0.79 -0.13 0.00 -0.04 0.00 0.00 33.50 33.08 1bzf n PRO 50 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1bzf s LYS 51 N -0.62 2.11 0.29 0.54 1.02 -1.26 -5.10 119.74 116.73 1bzf s LYS 51 Ca 0.00 -1.61 -0.02 0.00 0.02 0.00 0.00 55.97 54.36 1bzf s LYS 51 Cb 0.00 -3.40 -0.04 0.00 -0.52 0.00 0.00 37.83 33.87 1bzf s LYS 51 CO 0.00 -0.89 0.52 1.03 -0.92 0.00 0.00 175.35 175.09 1bzf s ARG 52 N 1.16 3.55 0.78 1.68 3.00 -1.26 -4.44 118.95 123.43 1bzf s ARG 52 Ca 0.04 -0.19 -0.11 0.00 0.00 0.00 0.00 55.73 55.47 1bzf s ARG 52 Cb -0.21 -2.69 0.07 0.00 0.00 0.00 0.00 34.95 32.12 1bzf s ARG 52 CO -0.03 0.22 1.14 -1.25 0.00 0.00 0.00 175.30 175.38 1bzf s PRO 53 N -3.80 2.06 -0.39 3.54 0.04 -1.26 -5.10 135.00 130.10 1bzf s PRO 53 Ca 0.41 0.05 -0.22 0.00 0.04 0.00 0.00 61.00 61.28 1bzf s PRO 53 Cb -0.10 -2.00 0.01 0.00 0.04 0.00 0.00 34.50 32.44 1bzf s PRO 53 CO 0.32 -1.49 0.70 -0.51 0.04 0.00 0.00 177.00 176.06 1bzf s LEU 54 N -5.49 4.26 0.00 -3.56 1.43 -1.26 -5.05 118.68 109.01 1bzf s LEU 54 Ca 0.61 0.08 -0.16 0.00 -1.03 0.00 0.00 54.13 53.63 1bzf s LEU 54 Cb -0.11 -2.86 0.21 0.00 0.03 0.00 0.00 46.19 43.46 1bzf s LEU 54 CO 0.48 -0.71 1.17 -0.81 0.23 0.00 0.00 176.35 176.71 1bzf n PRO 55 N 6.28 -1.45 -1.91 1.29 -0.04 -1.26 -4.25 135.00 133.67 1bzf n PRO 55 Ca 0.00 -1.82 -0.19 0.00 -0.04 0.00 0.00 63.50 61.45 1bzf n PRO 55 Cb 0.48 -1.28 -0.05 0.00 -0.04 0.00 0.00 33.50 32.61 1bzf n PRO 55 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1bzf n GLU 56 N -3.70 -1.43 -3.78 0.54 1.02 -1.26 -4.89 120.64 107.13 1bzf n GLU 56 Ca 0.15 1.08 0.02 0.00 -0.02 0.00 0.00 57.16 58.39 1bzf n GLU 56 Cb 0.52 -5.51 0.00 0.00 -0.02 0.00 0.00 31.44 26.44 1bzf n GLU 56 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 1bzf s ARG 57 N -4.21 0.34 -0.10 3.49 1.70 -1.26 -3.59 118.95 115.32 1bzf s ARG 57 Ca 0.00 -0.21 -0.18 0.00 -0.47 0.00 0.00 55.73 54.87 1bzf s ARG 57 Cb 0.00 0.11 -0.04 0.00 -0.57 0.00 0.00 34.95 34.44 1bzf s ARG 57 CO 0.00 -0.16 0.48 0.99 -1.08 0.00 0.00 175.30 175.54 1bzf s THR 58 N -2.19 5.15 -0.48 4.99 2.01 -1.15 -4.87 115.64 119.10 1bzf s THR 58 Ca 0.21 0.98 -0.16 0.00 0.31 0.00 0.00 61.69 63.03 1bzf s THR 58 Cb 0.03 -3.82 0.07 0.00 0.01 0.00 0.00 72.50 68.79 1bzf s THR 58 CO -0.03 0.35 0.44 0.20 -0.69 0.00 0.00 174.62 174.90 1bzf s ASN 59 N 0.41 6.16 0.03 3.53 0.02 -1.26 -0.33 114.94 123.50 1bzf s ASN 59 Ca 0.26 -1.25 0.08 0.00 -1.02 0.00 0.00 52.86 50.93 1bzf s ASN 59 Cb -0.16 -2.20 -0.03 0.00 0.02 0.00 0.00 41.25 38.88 1bzf s ASN 59 CO 0.11 -0.69 -0.22 -0.69 0.02 0.00 0.00 177.10 175.63 1bzf s VAL 60 N 1.83 2.50 -0.06 1.60 1.01 -0.26 -0.54 120.40 126.48 1bzf s VAL 60 Ca 0.06 -1.24 -0.00 0.00 0.00 0.00 0.00 61.98 60.80 1bzf s VAL 60 Cb -0.23 -2.01 0.02 0.00 0.00 0.00 0.00 36.38 34.16 1bzf s VAL 60 CO 0.08 0.38 -0.03 -0.69 0.00 0.00 0.00 175.10 174.84 1bzf s VAL 61 N -0.85 0.51 -0.32 2.92 1.01 -1.13 -2.36 120.40 120.18 1bzf s VAL 61 Ca 0.13 -0.02 -0.14 0.00 0.00 0.00 0.00 61.98 61.95 1bzf s VAL 61 Cb -0.10 -0.59 -0.02 0.00 0.00 0.00 0.00 36.38 35.66 1bzf s VAL 61 CO 0.03 0.26 0.31 -0.22 0.00 0.00 0.00 175.10 175.48 1bzf s LEU 62 N 1.49 4.29 -0.21 3.92 2.96 -1.16 -1.65 118.68 128.32 1bzf s LEU 62 Ca -0.02 -0.11 -0.18 0.00 -0.22 0.00 0.00 54.13 53.60 1bzf s LEU 62 Cb -0.13 -2.29 0.06 0.00 0.50 0.00 0.00 46.19 44.33 1bzf s LEU 62 CO -0.03 -0.24 0.55 0.28 -1.32 0.00 0.00 176.35 175.59 1bzf s THR 63 N 1.94 -0.00 -0.31 3.68 -1.32 -1.15 -4.46 115.64 114.02 1bzf s THR 63 Ca 0.11 0.01 0.03 0.00 -1.21 0.00 0.00 61.69 60.63 1bzf s THR 63 Cb -0.16 -0.78 0.45 0.00 -1.51 0.00 0.00 72.50 70.49 1bzf s THR 63 CO 0.11 0.00 1.59 1.41 -2.21 0.00 0.00 174.62 175.52 1bzf n HIS 64 N 3.11 1.98 -4.10 9.09 8.25 -1.26 -4.46 115.22 127.83 1bzf n HIS 64 Ca -0.15 -1.33 -0.35 0.00 -0.26 0.00 0.00 57.72 55.63 1bzf n HIS 64 Cb 0.56 -0.69 -0.13 0.00 1.12 0.00 0.00 29.99 30.85 1bzf n HIS 64 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 1bzf s GLN 65 N -2.17 3.51 -0.14 -0.41 0.74 -1.26 -4.97 119.66 114.96 1bzf s GLN 65 Ca 0.37 -0.57 0.01 0.00 0.05 0.00 0.00 55.36 55.22 1bzf s GLN 65 Cb 0.31 -3.00 0.21 0.00 1.10 0.00 0.00 33.01 31.62 1bzf s GLN 65 CO 0.07 -0.03 1.29 -1.91 -0.55 0.00 0.00 175.29 174.17 1bzf n GLU 66 N 4.34 1.39 0.00 1.67 2.13 -1.26 -3.64 120.64 125.26 1bzf n GLU 66 Ca -0.18 -0.93 0.00 0.00 0.66 0.00 0.00 57.16 56.71 1bzf n GLU 66 Cb 0.52 -1.36 0.00 0.00 0.27 0.00 0.00 31.44 30.86 1bzf n GLU 66 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 1bzf n ASP 67 N 0.00 3.62 -4.77 4.31 2.03 -1.26 -5.05 116.55 115.43 1bzf n ASP 67 Ca 0.19 0.00 -0.37 0.00 0.52 0.00 0.00 54.79 55.13 1bzf n ASP 67 Cb 0.86 0.26 -0.00 0.00 -0.72 0.00 0.00 41.12 41.51 1bzf n ASP 67 CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 1bzf s TYR 68 N -1.78 2.79 0.06 -0.67 5.04 -1.24 -5.04 117.35 116.50 1bzf s TYR 68 Ca 0.00 1.53 -0.08 0.00 -2.44 0.00 0.00 57.07 56.08 1bzf s TYR 68 Cb 0.00 -3.38 -0.00 0.00 0.35 0.00 0.00 41.96 38.92 1bzf s TYR 68 CO 0.00 -1.61 0.17 -0.65 -1.34 0.00 0.00 175.55 172.12 1bzf s GLN 69 N -2.86 0.73 -0.02 4.97 -0.21 -1.26 -5.04 119.66 115.97 1bzf s GLN 69 Ca 0.66 -0.78 0.00 0.00 0.02 0.00 0.00 55.36 55.27 1bzf s GLN 69 Cb -0.28 0.29 0.02 0.00 1.00 0.00 0.00 33.01 34.04 1bzf s GLN 69 CO 0.34 -0.21 -0.00 0.00 -2.12 0.00 0.00 175.29 173.29 1bzf s ALA 70 N -3.05 0.25 -0.26 6.09 0.00 -1.26 -5.12 121.76 118.40 1bzf s ALA 70 Ca -0.01 0.13 -0.22 0.00 0.00 0.00 0.00 51.96 51.86 1bzf s ALA 70 Cb 0.01 -0.24 -0.01 0.00 0.00 0.00 0.00 23.12 22.88 1bzf s ALA 70 CO -0.07 -0.05 0.73 -0.65 0.00 0.00 0.00 175.76 175.72 1bzf s GLN 71 N 0.78 4.10 -0.18 0.00 -1.52 -1.26 -3.90 119.66 117.68 1bzf s GLN 71 Ca -0.07 0.68 -0.01 0.00 -1.95 0.00 0.00 55.36 54.01 1bzf s GLN 71 Cb -0.11 -3.66 0.00 0.00 -0.22 0.00 0.00 33.01 29.02 1bzf s GLN 71 CO -0.02 -0.50 0.16 0.41 -0.25 0.00 0.00 175.29 175.09 1bzf n GLY 72 N 4.03 0.64 3.57 3.09 0.00 -1.26 -4.72 105.19 110.55 1bzf n GLY 72 Ca 0.02 -0.51 -0.10 0.00 0.00 0.00 0.00 46.02 45.44 1bzf n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bzf s ALA 73 N -3.05 -1.70 -0.58 4.61 0.00 -1.25 -4.70 121.76 115.10 1bzf s ALA 73 Ca 0.06 2.13 -0.27 0.00 0.00 0.00 0.00 51.96 53.88 1bzf s ALA 73 Cb -0.03 -1.25 0.00 0.00 0.00 0.00 0.00 23.12 21.84 1bzf s ALA 73 CO 0.10 -0.34 1.55 0.08 0.00 0.00 0.00 175.76 177.15 1bzf s VAL 74 N 1.18 3.64 -0.64 0.00 1.01 0.30 -4.76 120.40 121.13 1bzf s VAL 74 Ca -0.07 0.50 -0.26 0.00 0.00 0.00 0.00 61.98 62.15 1bzf s VAL 74 Cb -0.05 -4.30 0.04 0.00 0.00 0.00 0.00 36.38 32.07 1bzf s VAL 74 CO -0.12 -1.12 1.15 -0.69 0.00 0.00 0.00 175.10 174.32 1bzf s VAL 75 N 6.88 4.02 0.34 2.92 1.01 -1.26 -2.84 120.40 131.46 1bzf s VAL 75 Ca 0.57 0.47 -0.07 0.00 0.00 0.00 0.00 61.98 62.95 1bzf s VAL 75 Cb -0.12 -4.75 -0.06 0.00 0.00 0.00 0.00 36.38 31.45 1bzf s VAL 75 CO 0.23 -1.49 0.64 0.68 0.00 0.00 0.00 175.10 175.16 1bzf s VAL 76 N 4.93 4.94 -0.04 2.92 -7.23 -0.66 -4.94 120.40 120.32 1bzf s VAL 76 Ca 0.35 0.26 0.22 0.00 -1.81 0.00 0.00 61.98 61.00 1bzf s VAL 76 Cb -0.10 -3.74 0.41 0.00 0.56 0.00 0.00 36.38 33.52 1bzf s VAL 76 CO 0.19 -0.41 1.17 1.41 -0.31 0.00 0.00 175.10 177.15 1bzf n HIS 77 N -1.11 0.00 -3.56 2.82 8.25 -1.26 -2.93 115.22 117.44 1bzf n HIS 77 Ca -0.00 -0.67 -0.14 0.00 -0.26 0.00 0.00 57.72 56.65 1bzf n HIS 77 Cb 0.54 -0.16 -0.06 0.00 1.12 0.00 0.00 29.99 31.43 1bzf n HIS 77 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1bzf s ASP 78 N -2.20 -0.50 0.29 0.41 2.15 -1.26 -4.86 116.67 110.70 1bzf s ASP 78 Ca 0.33 0.58 0.05 0.00 0.43 0.00 0.00 52.55 53.94 1bzf s ASP 78 Cb 0.37 0.46 0.45 0.00 -0.30 0.00 0.00 42.92 43.90 1bzf s ASP 78 CO -0.14 -0.44 1.72 0.58 -0.17 0.00 0.00 175.17 176.71 1bzf h VAL 79 N 2.82 1.28 -0.10 1.11 2.07 -1.97 -2.65 116.25 118.82 1bzf h VAL 79 Ca -0.23 -1.37 -0.12 0.00 0.82 0.00 0.00 66.70 65.81 1bzf h VAL 79 Cb 1.15 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 32.43 1bzf h VAL 79 CO 0.33 0.42 -0.46 0.00 0.02 0.00 0.00 177.57 177.87 1bzf h ALA 80 N 1.36 1.04 -0.24 1.67 0.00 -1.99 -2.82 119.26 118.28 1bzf h ALA 80 Ca 0.04 -0.45 -0.10 0.00 0.00 0.00 0.00 54.91 54.40 1bzf h ALA 80 Cb 0.73 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1bzf h ALA 80 CO 0.06 0.63 -0.27 0.00 0.00 0.00 0.00 179.25 179.66 1bzf h ALA 81 N 1.33 1.10 -0.38 0.00 0.00 -1.87 0.11 119.26 119.53 1bzf h ALA 81 Ca 0.01 -0.35 -0.09 0.00 0.00 0.00 0.00 54.91 54.48 1bzf h ALA 81 Cb 0.90 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1bzf h ALA 81 CO 0.07 0.56 -0.11 0.28 0.00 0.00 0.00 179.25 180.06 1bzf h VAL 82 N 0.40 1.28 0.00 0.00 2.07 -1.30 -2.30 116.25 116.40 1bzf h VAL 82 Ca 0.06 -1.19 -0.15 0.00 0.82 0.00 0.00 66.70 66.23 1bzf h VAL 82 Cb 0.69 1.26 -0.02 0.00 -1.52 0.00 0.00 31.29 31.69 1bzf h VAL 82 CO 0.05 0.40 -0.71 -0.26 0.02 0.00 0.00 177.57 177.07 1bzf h PHE 83 N 0.55 0.00 -0.65 1.57 0.04 -1.33 -3.06 116.94 114.06 1bzf h PHE 83 Ca 0.10 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.78 1bzf h PHE 83 Cb 0.63 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.75 1bzf h PHE 83 CO 0.05 0.71 0.08 0.00 -0.60 0.00 0.00 178.31 178.55 1bzf h ALA 84 N 1.29 0.90 -0.43 2.45 0.00 -0.62 -1.26 119.26 121.59 1bzf h ALA 84 Ca -0.01 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.54 1bzf h ALA 84 Cb 1.31 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1bzf h ALA 84 CO 0.09 0.67 -0.02 -0.92 0.00 0.00 0.00 179.25 179.07 1bzf h TYR 85 N 1.02 0.86 0.00 0.00 3.20 -1.39 -2.49 116.97 118.17 1bzf h TYR 85 Ca 0.19 -0.16 -0.04 0.00 3.14 0.00 0.00 58.73 61.87 1bzf h TYR 85 Cb 0.48 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.52 1bzf h TYR 85 CO 0.03 0.85 -0.18 0.00 -1.64 0.00 0.00 178.16 177.23 1bzf h ALA 86 N 0.89 1.20 -0.67 1.82 0.00 -1.41 -2.69 119.26 118.42 1bzf h ALA 86 Ca 0.12 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1bzf h ALA 86 Cb 0.52 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 1bzf h ALA 86 CO 0.03 0.22 0.21 -0.22 0.00 0.00 0.00 179.25 179.48 1bzf h LYS 87 N 0.00 1.04 -0.04 0.00 1.63 -0.76 -2.41 116.57 116.02 1bzf h LYS 87 Ca -0.00 -0.22 -0.11 0.00 -0.85 0.00 0.00 60.65 59.47 1bzf h LYS 87 Cb 0.49 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 31.96 1bzf h LYS 87 CO 0.02 0.90 -0.46 0.37 -3.45 0.00 0.00 179.45 176.84 1bzf h GLN 88 N 0.97 0.10 -3.39 1.90 4.15 -1.42 -3.36 115.11 114.06 1bzf h GLN 88 Ca 0.21 -0.05 -0.65 0.00 0.77 0.00 0.00 58.65 58.94 1bzf h GLN 88 Cb 0.30 0.00 -0.40 0.00 0.21 0.00 0.00 27.48 27.59 1bzf h GLN 88 CO -0.01 0.54 -0.60 -1.01 -1.93 0.00 0.00 178.83 175.83 1bzf s HIS 89 N -4.00 3.21 -0.29 3.99 3.76 -0.91 -4.90 115.29 116.15 1bzf s HIS 89 Ca -0.03 -3.14 0.19 0.00 -0.15 0.00 0.00 55.06 51.93 1bzf s HIS 89 Cb 0.13 -2.86 0.18 0.00 1.11 0.00 0.00 32.58 31.15 1bzf s HIS 89 CO 0.76 -0.74 1.50 -1.00 -0.85 0.00 0.00 174.74 174.40 1bzf h PRO 90 N 6.51 0.00 0.00 8.40 0.13 -1.71 -3.23 132.00 142.10 1bzf h PRO 90 Ca -0.07 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.02 1bzf h PRO 90 Cb 0.89 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.02 1bzf h PRO 90 CO 0.69 0.27 -0.20 -0.44 -0.23 0.00 0.00 178.00 178.09 1bzf h ASP 91 N 0.00 0.00 -5.67 1.44 5.19 -1.90 -3.43 116.42 112.04 1bzf h ASP 91 Ca -0.01 0.00 -0.48 0.00 -0.62 0.00 0.00 57.03 55.93 1bzf h ASP 91 Cb 1.21 0.00 0.08 0.00 0.18 0.00 0.00 39.33 40.80 1bzf h ASP 91 CO 0.03 0.20 0.11 0.00 -3.12 0.00 0.00 179.24 176.46 1bzf n GLN 92 N -3.70 -0.08 -4.00 3.56 6.02 -1.22 -5.02 117.38 112.93 1bzf n GLN 92 Ca -0.01 -2.81 -0.11 0.00 -0.01 0.00 0.00 57.00 54.06 1bzf n GLN 92 Cb 0.32 -0.65 -0.12 0.00 1.02 0.00 0.00 30.24 30.81 1bzf n GLN 92 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1bzf s GLU 93 N -5.14 0.34 -0.52 -1.09 0.41 -1.26 -4.96 118.70 106.48 1bzf s GLU 93 Ca 0.67 -0.57 -0.29 0.00 -0.41 0.00 0.00 54.97 54.38 1bzf s GLU 93 Cb -0.04 -0.03 0.03 0.00 -1.78 0.00 0.00 34.13 32.31 1bzf s GLU 93 CO 0.45 -0.01 1.21 -1.17 -0.49 0.00 0.00 175.26 175.24 1bzf s LEU 94 N -1.29 3.54 -0.32 1.80 2.96 -1.26 -2.18 118.68 121.94 1bzf s LEU 94 Ca -0.12 0.34 -0.07 0.00 -0.22 0.00 0.00 54.13 54.06 1bzf s LEU 94 Cb -0.09 -3.36 0.02 0.00 0.50 0.00 0.00 46.19 43.26 1bzf s LEU 94 CO -0.00 -1.40 0.10 -0.69 -1.32 0.00 0.00 176.35 173.03 1bzf s VAL 95 N 4.88 3.96 -0.23 1.68 1.01 -1.14 -1.33 120.40 129.23 1bzf s VAL 95 Ca 0.48 -0.84 -0.18 0.00 0.00 0.00 0.00 61.98 61.43 1bzf s VAL 95 Cb -0.08 -3.12 -0.03 0.00 0.00 0.00 0.00 36.38 33.15 1bzf s VAL 95 CO 0.29 -0.03 0.52 -0.63 0.00 0.00 0.00 175.10 175.25 1bzf s ILE 96 N 1.47 5.09 -0.17 2.22 -1.09 -1.10 -2.85 121.20 124.77 1bzf s ILE 96 Ca 0.01 0.92 0.17 0.00 -2.23 0.00 0.00 60.65 59.53 1bzf s ILE 96 Cb -0.18 -3.84 -0.24 0.00 -1.58 0.00 0.00 42.46 36.62 1bzf s ILE 96 CO 0.03 0.13 0.11 0.00 -1.23 0.00 0.00 174.94 173.98 1bzf n ALA 97 N 5.14 1.67 0.00 9.38 0.00 -1.12 -2.73 120.51 132.85 1bzf n ALA 97 Ca -0.04 -1.16 0.00 0.00 0.00 0.00 0.00 53.44 52.24 1bzf n ALA 97 Cb 0.50 -0.21 0.00 0.00 0.00 0.00 0.00 19.45 19.74 1bzf n ALA 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bzf n GLY 98 N 1.78 -2.01 0.00 0.00 0.00 -1.26 -4.70 105.19 99.00 1bzf n GLY 98 Ca -0.28 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.55 1bzf n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bzf n GLY 99 N -0.43 0.87 0.19 -0.02 0.00 -1.26 -1.04 105.19 103.50 1bzf n GLY 99 Ca 0.00 -1.59 0.06 0.00 0.00 0.00 0.00 46.02 44.48 1bzf n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bzf h ALA 100 N -1.80 1.01 0.00 4.61 0.00 -1.93 -2.70 119.26 118.45 1bzf h ALA 100 Ca 0.00 -0.34 -0.06 0.00 0.00 0.00 0.00 54.91 54.52 1bzf h ALA 100 Cb 0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1bzf h ALA 100 CO 0.00 0.46 -0.27 0.37 0.00 0.00 0.00 179.25 179.81 1bzf h GLN 101 N 0.00 0.00 0.21 0.00 4.15 -1.99 -2.99 115.11 114.50 1bzf h GLN 101 Ca -0.00 0.00 -0.32 0.00 0.77 0.00 0.00 58.65 59.10 1bzf h GLN 101 Cb 0.88 0.00 0.03 0.00 0.21 0.00 0.00 27.48 28.60 1bzf h GLN 101 CO 0.05 0.27 -1.42 0.82 -1.93 0.00 0.00 178.83 176.62 1bzf h ILE 102 N 0.00 1.33 -0.13 2.39 1.08 -1.75 -2.81 117.51 117.62 1bzf h ILE 102 Ca -0.00 -2.81 -0.01 0.00 -0.39 0.00 0.00 64.86 61.65 1bzf h ILE 102 Cb 0.95 3.00 -0.01 0.00 -3.07 0.00 0.00 36.82 37.69 1bzf h ILE 102 CO 0.04 0.84 0.06 -0.26 -0.69 0.00 0.00 178.15 178.13 1bzf h PHE 103 N 0.12 0.19 -0.24 1.37 0.04 -1.49 -2.04 116.94 114.90 1bzf h PHE 103 Ca -0.22 -0.01 -0.04 0.00 2.80 0.00 0.00 57.97 60.49 1bzf h PHE 103 Cb 2.11 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 40.19 1bzf h PHE 103 CO 0.11 0.25 -0.04 0.00 -0.60 0.00 0.00 178.31 178.03 1bzf h THR 104 N 0.06 1.17 0.00 -1.55 1.03 -1.63 0.44 112.91 112.43 1bzf h THR 104 Ca 0.04 -0.69 -0.03 0.00 -0.01 0.00 0.00 66.41 65.72 1bzf h THR 104 Cb 0.14 1.04 -0.00 0.00 -1.07 0.00 0.00 68.15 68.25 1bzf h THR 104 CO -0.00 0.23 -0.15 0.00 -0.01 0.00 0.00 175.52 175.58 1bzf h ALA 105 N 1.62 1.12 0.00 0.00 0.00 -1.17 -2.92 119.26 117.92 1bzf h ALA 105 Ca 0.08 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1bzf h ALA 105 Cb 0.30 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1bzf h ALA 105 CO 0.01 0.19 -0.13 1.19 0.00 0.00 0.00 179.25 180.52 1bzf n PHE 106 N -3.45 0.00 0.08 0.00 3.72 -0.52 -4.73 117.46 112.56 1bzf n PHE 106 Ca -0.01 -0.95 0.02 0.00 -0.05 0.00 0.00 57.45 56.46 1bzf n PHE 106 Cb 0.32 -0.15 0.38 0.00 -0.94 0.00 0.00 39.48 39.09 1bzf n PHE 106 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 1bzf h LYS 107 N 0.13 0.34 -1.09 -1.08 2.10 0.03 -2.07 116.57 114.93 1bzf h LYS 107 Ca -0.00 -0.07 -0.03 0.00 -2.00 0.00 0.00 60.65 58.55 1bzf h LYS 107 Cb 1.05 -0.05 -0.02 0.00 -0.90 0.00 0.00 32.23 32.31 1bzf h LYS 107 CO 0.00 0.40 0.04 -3.47 -2.00 0.00 0.00 179.45 174.42 1bzf n ASP 108 N -4.31 3.28 -1.46 7.07 2.03 -1.26 -3.32 116.55 118.57 1bzf n ASP 108 Ca 0.00 -2.13 -0.06 0.00 0.52 0.00 0.00 54.79 53.13 1bzf n ASP 108 Cb 0.23 -0.58 -0.01 0.00 -0.72 0.00 0.00 41.12 40.03 1bzf n ASP 108 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1bzf n ASP 109 N 0.51 -1.13 -4.90 1.67 8.00 -0.78 -5.13 116.55 114.80 1bzf n ASP 109 Ca 0.03 -2.05 -0.34 0.00 0.71 0.00 0.00 54.79 53.14 1bzf n ASP 109 Cb 0.56 0.41 -0.05 0.00 -0.02 0.00 0.00 41.12 42.02 1bzf n ASP 109 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1bzf s VAL 110 N 0.04 5.40 0.10 2.53 0.11 -1.21 -2.66 120.40 124.71 1bzf s VAL 110 Ca 0.03 -0.05 0.00 0.00 -2.93 0.00 0.00 61.98 59.02 1bzf s VAL 110 Cb 0.13 -3.54 0.00 0.00 -1.53 0.00 0.00 36.38 31.43 1bzf s VAL 110 CO -0.04 0.34 0.00 0.47 -3.33 0.00 0.00 175.10 172.54 1bzf n ASP 111 N 1.00 0.35 -4.35 3.54 9.92 -0.84 -4.79 116.55 121.38 1bzf n ASP 111 Ca -0.11 0.17 -0.42 0.00 -0.53 0.00 0.00 54.79 53.90 1bzf n ASP 111 Cb 0.53 -0.02 -0.10 0.00 -0.64 0.00 0.00 41.12 40.89 1bzf n ASP 111 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1bzf s THR 112 N -2.00 4.68 -0.62 -3.53 2.01 -1.17 -2.14 115.64 112.88 1bzf s THR 112 Ca 0.00 -1.10 -0.21 0.00 0.31 0.00 0.00 61.69 60.69 1bzf s THR 112 Cb 0.00 -3.75 0.08 0.00 0.01 0.00 0.00 72.50 68.83 1bzf s THR 112 CO 0.00 -0.43 0.86 -0.76 -0.69 0.00 0.00 174.62 173.59 1bzf s LEU 113 N 1.54 4.71 -0.47 4.42 1.43 -1.07 -1.75 118.68 127.50 1bzf s LEU 113 Ca 0.03 -1.06 -0.16 0.00 -1.03 0.00 0.00 54.13 51.91 1bzf s LEU 113 Cb -0.22 -2.42 0.06 0.00 0.03 0.00 0.00 46.19 43.64 1bzf s LEU 113 CO 0.05 -1.28 0.41 -0.76 0.23 0.00 0.00 176.35 175.00 1bzf s LEU 114 N 3.53 5.46 -0.10 1.79 1.43 -0.02 -2.67 118.68 128.10 1bzf s LEU 114 Ca 0.19 -1.21 0.00 0.00 -1.03 0.00 0.00 54.13 52.08 1bzf s LEU 114 Cb -0.19 -2.22 -0.03 0.00 0.03 0.00 0.00 46.19 43.79 1bzf s LEU 114 CO 0.10 -0.65 -0.08 0.54 0.23 0.00 0.00 176.35 176.49 1bzf s VAL 115 N 1.78 3.54 -0.51 -1.59 0.11 -1.13 -2.93 120.40 119.66 1bzf s VAL 115 Ca 0.06 -0.52 -0.07 0.00 -2.93 0.00 0.00 61.98 58.52 1bzf s VAL 115 Cb -0.23 -2.47 0.13 0.00 -1.53 0.00 0.00 36.38 32.29 1bzf s VAL 115 CO 0.08 0.56 0.37 -0.89 -3.33 0.00 0.00 175.10 171.89 1bzf s THR 116 N -0.34 4.04 0.14 5.04 2.01 -1.16 -2.21 115.64 123.16 1bzf s THR 116 Ca 0.04 -2.11 -0.24 0.00 0.31 0.00 0.00 61.69 59.69 1bzf s THR 116 Cb -0.12 -3.66 -0.08 0.00 0.01 0.00 0.00 72.50 68.65 1bzf s THR 116 CO 0.02 -0.80 0.72 -0.13 -0.69 0.00 0.00 174.62 173.75 1bzf s ARG 117 N 0.96 4.47 -0.09 4.92 0.52 -1.13 -2.64 118.95 125.97 1bzf s ARG 117 Ca 0.09 1.05 0.02 0.00 -0.52 0.00 0.00 55.73 56.37 1bzf s ARG 117 Cb -0.23 -3.26 -0.02 0.00 0.52 0.00 0.00 34.95 31.96 1bzf s ARG 117 CO -0.03 0.58 -0.13 -0.51 0.02 0.00 0.00 175.30 175.23 1bzf s LEU 118 N -1.10 2.74 0.28 2.53 1.02 -1.23 -1.97 118.68 120.96 1bzf s LEU 118 Ca 0.34 -0.25 0.05 0.00 0.02 0.00 0.00 54.13 54.28 1bzf s LEU 118 Cb -0.22 -1.59 0.41 0.00 0.02 0.00 0.00 46.19 44.81 1bzf s LEU 118 CO 0.24 0.26 1.68 0.00 0.02 0.00 0.00 176.35 178.55 1bzf h ALA 119 N 6.01 1.06 -2.36 4.21 0.00 0.26 -3.27 119.26 125.17 1bzf h ALA 119 Ca -0.36 -0.41 -0.54 0.00 0.00 0.00 0.00 54.91 53.60 1bzf h ALA 119 Cb 1.18 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 1bzf h ALA 119 CO 0.53 0.59 0.88 0.20 0.00 0.00 0.00 179.25 181.45 1bzf s GLY 120 N -4.16 1.78 0.33 0.00 0.00 -0.26 -4.91 107.32 100.09 1bzf s GLY 120 Ca -0.05 0.90 -0.28 0.00 0.00 0.00 0.00 44.72 45.29 1bzf s GLY 120 CO 0.78 2.60 1.21 -0.45 0.00 0.00 0.00 173.10 177.24 1bzf s SER 121 N 2.08 6.90 -0.24 1.64 0.15 -1.26 -4.76 113.70 118.20 1bzf s SER 121 Ca 0.65 2.47 -0.02 0.00 0.70 0.00 0.00 55.95 59.75 1bzf s SER 121 Cb -0.32 -2.63 0.12 0.00 -1.71 0.00 0.00 66.02 61.48 1bzf s SER 121 CO 0.27 -0.42 0.31 -0.36 1.20 0.00 0.00 173.24 174.23 1bzf s PHE 122 N -1.20 -0.57 0.29 3.44 0.08 -1.26 -5.08 117.98 113.68 1bzf s PHE 122 Ca 0.49 0.37 -0.20 0.00 0.12 0.00 0.00 56.93 57.71 1bzf s PHE 122 Cb -0.35 -0.23 -0.09 0.00 -0.57 0.00 0.00 43.02 41.78 1bzf s PHE 122 CO 0.46 -0.74 0.80 -2.00 -0.10 0.00 0.00 175.22 173.64 1bzf s GLU 123 N 2.43 4.27 0.00 0.44 2.56 -1.26 -4.76 118.70 122.38 1bzf s GLU 123 Ca 0.10 0.96 0.00 0.00 0.00 0.00 0.00 54.97 56.03 1bzf s GLU 123 Cb -0.15 -2.68 0.00 0.00 2.00 0.00 0.00 34.13 33.30 1bzf s GLU 123 CO -0.19 0.27 0.00 0.41 -0.56 0.00 0.00 175.26 175.18 1bzf n GLY 124 N 0.28 4.05 1.97 -1.50 0.00 -1.26 -4.98 105.19 103.76 1bzf n GLY 124 Ca 0.01 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.62 1bzf n GLY 124 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1bzf n ASP 125 N 0.00 0.00 -4.77 1.61 8.00 -1.25 -5.05 116.55 115.09 1bzf n ASP 125 Ca 0.00 0.00 -0.39 0.00 0.71 0.00 0.00 54.79 55.11 1bzf n ASP 125 Cb 0.00 0.08 -0.06 0.00 -0.02 0.00 0.00 41.12 41.12 1bzf n ASP 125 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1bzf s THR 126 N -1.99 4.22 0.45 -3.53 2.01 -1.26 -5.06 115.64 110.48 1bzf s THR 126 Ca 0.00 1.87 0.05 0.00 0.31 0.00 0.00 61.69 63.92 1bzf s THR 126 Cb 0.00 -4.18 -0.05 0.00 0.01 0.00 0.00 72.50 68.28 1bzf s THR 126 CO 0.00 0.42 0.06 -0.54 -0.69 0.00 0.00 174.62 173.87 1bzf s LYS 127 N -1.38 2.09 0.11 4.92 1.02 -1.26 -3.07 119.74 122.16 1bzf s LYS 127 Ca 0.41 -2.15 -0.08 0.00 0.02 0.00 0.00 55.97 54.17 1bzf s LYS 127 Cb -0.23 -1.69 -0.06 0.00 -0.52 0.00 0.00 37.83 35.33 1bzf s LYS 127 CO 0.28 -0.18 0.40 1.41 -0.92 0.00 0.00 175.35 176.34 1bzf s MET 128 N -3.82 3.71 0.91 1.68 1.75 -1.22 -4.77 119.30 117.54 1bzf s MET 128 Ca 0.27 0.09 -0.11 0.00 -1.25 0.00 0.00 55.69 54.69 1bzf s MET 128 Cb 0.06 -2.93 0.14 0.00 2.84 0.00 0.00 34.83 34.94 1bzf s MET 128 CO 0.14 0.52 1.09 0.96 -0.65 0.00 0.00 175.02 177.08 1bzf s ILE 129 N -1.51 2.61 -0.74 10.11 -4.36 -1.26 -4.94 121.20 121.12 1bzf s ILE 129 Ca 0.36 0.20 -0.27 0.00 -0.26 0.00 0.00 60.65 60.68 1bzf s ILE 129 Cb -0.13 -2.62 0.03 0.00 1.25 0.00 0.00 42.46 40.99 1bzf s ILE 129 CO 0.20 -0.26 1.27 -2.16 0.24 0.00 0.00 174.94 174.23 1bzf s PRO 130 N -4.88 3.19 0.10 0.37 0.04 -1.26 -5.02 135.00 127.55 1bzf s PRO 130 Ca 0.64 -0.27 -0.24 0.00 0.04 0.00 0.00 61.00 61.17 1bzf s PRO 130 Cb -0.19 -4.19 -0.07 0.00 0.04 0.00 0.00 34.50 30.10 1bzf s PRO 130 CO 0.57 -2.14 0.73 -0.51 0.04 0.00 0.00 177.00 175.70 1bzf s LEU 131 N 5.68 4.53 -1.14 -3.56 1.43 -1.26 -4.97 118.68 119.39 1bzf s LEU 131 Ca 0.35 1.50 -0.21 0.00 -1.03 0.00 0.00 54.13 54.73 1bzf s LEU 131 Cb -0.08 -3.19 0.03 0.00 0.03 0.00 0.00 46.19 42.98 1bzf s LEU 131 CO 0.15 0.16 1.68 0.21 0.23 0.00 0.00 176.35 178.77 1bzf s ASN 132 N -0.76 6.32 0.44 2.29 3.04 -1.26 -4.75 114.94 120.27 1bzf s ASN 132 Ca 0.35 -1.80 0.30 0.00 0.04 0.00 0.00 52.86 51.76 1bzf s ASN 132 Cb -0.21 -2.58 1.38 0.00 -1.54 0.00 0.00 41.25 38.30 1bzf s ASN 132 CO 0.24 -1.68 1.91 -0.50 -3.04 0.00 0.00 177.10 174.02 1bzf h TRP 133 N 9.04 0.00 0.00 0.43 4.06 -1.95 -2.42 115.95 125.11 1bzf h TRP 133 Ca 0.29 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 61.23 1bzf h TRP 133 Cb 0.94 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.10 1bzf h TRP 133 CO 1.33 0.00 -0.08 -0.44 -3.56 0.00 0.00 178.44 175.68 1bzf h ASP 134 N 0.00 0.00 -0.79 -3.49 5.19 -2.03 -1.36 116.42 113.94 1bzf h ASP 134 Ca 0.00 0.00 -0.42 0.00 -0.62 0.00 0.00 57.03 55.99 1bzf h ASP 134 Cb 0.32 0.00 -0.24 0.00 0.18 0.00 0.00 39.33 39.58 1bzf h ASP 134 CO 0.00 0.08 0.53 0.47 -3.12 0.00 0.00 179.24 177.20 1bzf n ASP 135 N -3.86 3.71 -3.43 6.45 8.00 -0.91 -4.91 116.55 121.59 1bzf n ASP 135 Ca -0.02 -3.28 -0.15 0.00 0.71 0.00 0.00 54.79 52.04 1bzf n ASP 135 Cb 0.18 -0.78 -0.06 0.00 -0.02 0.00 0.00 41.12 40.44 1bzf n ASP 135 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1bzf s PHE 136 N -2.62 1.21 -0.19 1.24 0.08 -0.51 -4.02 117.98 113.16 1bzf s PHE 136 Ca 0.45 -1.36 -0.12 0.00 0.12 0.00 0.00 56.93 56.03 1bzf s PHE 136 Cb 0.38 -0.28 0.06 0.00 -0.57 0.00 0.00 43.02 42.61 1bzf s PHE 136 CO 0.08 -1.00 0.48 0.99 -0.10 0.00 0.00 175.22 175.67 1bzf s THR 137 N -3.34 -0.02 -0.23 0.64 2.01 -1.05 -4.84 115.64 108.81 1bzf s THR 137 Ca 0.34 0.06 -0.29 0.00 0.31 0.00 0.00 61.69 62.11 1bzf s THR 137 Cb 0.01 -0.70 -0.02 0.00 0.01 0.00 0.00 72.50 71.80 1bzf s THR 137 CO 0.21 0.02 1.48 -0.75 -0.69 0.00 0.00 174.62 174.89 1bzf s LYS 138 N 1.29 3.91 -0.17 4.92 2.20 -1.26 -2.16 119.74 128.47 1bzf s LYS 138 Ca -0.08 1.56 0.04 0.00 -0.36 0.00 0.00 55.97 57.12 1bzf s LYS 138 Cb -0.07 -3.95 -0.22 0.00 -1.51 0.00 0.00 37.83 32.07 1bzf s LYS 138 CO -0.12 -1.14 0.17 1.33 -0.36 0.00 0.00 175.35 175.23 1bzf n VAL 139 N 6.17 1.59 -3.93 4.02 0.24 -1.10 -5.00 118.33 120.32 1bzf n VAL 139 Ca 0.17 -0.69 -0.12 0.00 -2.04 0.00 0.00 64.34 61.66 1bzf n VAL 139 Cb 0.45 -1.29 -0.00 0.00 -1.47 0.00 0.00 33.84 31.53 1bzf n VAL 139 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1bzf s SER 140 N -6.44 0.44 0.03 -1.34 1.04 -1.23 -5.09 113.70 101.12 1bzf s SER 140 Ca -0.21 -1.32 -0.27 0.00 0.48 0.00 0.00 55.95 54.62 1bzf s SER 140 Cb 0.07 0.78 0.09 0.00 0.10 0.00 0.00 66.02 67.07 1bzf s SER 140 CO 0.74 -1.54 0.81 -0.55 0.98 0.00 0.00 173.24 173.68 1bzf s SER 141 N -3.15 -0.43 -0.30 7.02 0.15 -1.26 -2.56 113.70 113.18 1bzf s SER 141 Ca 0.22 0.03 -0.01 0.00 0.70 0.00 0.00 55.95 56.89 1bzf s SER 141 Cb -0.03 0.44 0.10 0.00 -1.71 0.00 0.00 66.02 64.82 1bzf s SER 141 CO 0.16 -0.70 0.10 -0.60 1.20 0.00 0.00 173.24 173.39 1bzf s ARG 142 N -3.18 0.63 0.45 5.44 3.52 -1.03 -4.99 118.95 119.78 1bzf s ARG 142 Ca 0.03 -0.94 -0.16 0.00 -0.13 0.00 0.00 55.73 54.53 1bzf s ARG 142 Cb -0.01 -1.86 -0.08 0.00 -1.56 0.00 0.00 34.95 31.43 1bzf s ARG 142 CO -0.09 -0.97 0.91 0.99 -0.81 0.00 0.00 175.30 175.33 1bzf s THR 143 N 1.71 4.56 -0.24 4.11 2.01 -1.26 -2.03 115.64 124.51 1bzf s THR 143 Ca 0.09 1.15 -0.12 0.00 0.31 0.00 0.00 61.69 63.12 1bzf s THR 143 Cb -0.17 -3.68 0.08 0.00 0.01 0.00 0.00 72.50 68.74 1bzf s THR 143 CO -0.26 -0.52 0.56 0.54 -0.69 0.00 0.00 174.62 174.25 1bzf s VAL 144 N -2.40 -0.24 -0.24 3.82 0.11 -1.10 -4.98 120.40 115.36 1bzf s VAL 144 Ca 0.58 0.05 -0.08 0.00 -2.93 0.00 0.00 61.98 59.60 1bzf s VAL 144 Cb -0.10 -0.83 -0.04 0.00 -1.53 0.00 0.00 36.38 33.89 1bzf s VAL 144 CO 0.25 0.02 0.09 -0.70 -3.33 0.00 0.00 175.10 171.44 1bzf s GLU 145 N 1.88 3.78 0.00 1.54 2.12 -1.26 -3.04 118.70 123.72 1bzf s GLU 145 Ca -0.08 -0.42 0.00 0.00 0.36 0.00 0.00 54.97 54.83 1bzf s GLU 145 Cb -0.08 -3.37 0.00 0.00 0.26 0.00 0.00 34.13 30.94 1bzf s GLU 145 CO -0.17 -0.09 0.00 -3.47 -0.54 0.00 0.00 175.26 170.99 1bzf n ASP 146 N 4.68 0.00 0.02 -1.70 2.03 -1.24 -4.96 116.55 115.37 1bzf n ASP 146 Ca -0.16 -0.56 -0.11 0.00 0.52 0.00 0.00 54.79 54.48 1bzf n ASP 146 Cb 0.52 0.00 0.03 0.00 -0.72 0.00 0.00 41.12 40.94 1bzf n ASP 146 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 1bzf h THR 147 N -0.54 1.33 -3.25 5.18 1.35 -1.99 -3.43 112.91 111.55 1bzf h THR 147 Ca 0.00 -1.95 -0.67 0.00 -0.55 0.00 0.00 66.41 63.25 1bzf h THR 147 Cb 0.00 1.92 -0.15 0.00 -1.73 0.00 0.00 68.15 68.19 1bzf h THR 147 CO 0.00 0.60 -0.61 0.21 -0.25 0.00 0.00 175.52 175.47 1bzf s ASN 148 N -6.97 5.34 0.23 5.36 3.84 -1.26 -5.01 114.94 116.47 1bzf s ASN 148 Ca -0.07 0.14 -0.10 0.00 0.21 0.00 0.00 52.86 53.04 1bzf s ASN 148 Cb 0.11 -1.61 0.35 0.00 -0.55 0.00 0.00 41.25 39.54 1bzf s ASN 148 CO 0.85 0.34 1.65 -0.65 -2.79 0.00 0.00 177.10 176.49 1bzf h PRO 149 N 5.46 0.09 0.00 0.43 0.10 -2.00 0.35 132.00 136.44 1bzf h PRO 149 Ca -0.48 -0.01 -0.02 0.00 0.10 0.00 0.00 66.00 65.60 1bzf h PRO 149 Cb 1.19 -0.02 -0.00 0.00 0.10 0.00 0.00 31.00 32.27 1bzf h PRO 149 CO 0.57 0.06 -0.09 0.00 0.10 0.00 0.00 178.00 178.65 1bzf h ALA 150 N 1.63 1.74 -0.01 -0.75 0.00 -1.95 -0.99 119.26 118.94 1bzf h ALA 150 Ca 0.36 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 1bzf h ALA 150 Cb 0.60 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 1bzf h ALA 150 CO -0.60 0.11 0.00 1.28 0.00 0.00 0.00 179.25 180.04 1bzf n LEU 151 N -4.27 1.18 -4.80 0.00 4.77 0.12 -1.10 117.00 112.91 1bzf n LEU 151 Ca -0.03 -0.59 -0.38 0.00 -0.03 0.00 0.00 56.01 54.98 1bzf n LEU 151 Cb 0.17 -0.50 -0.06 0.00 -2.33 0.00 0.00 43.42 40.69 1bzf n LEU 151 CO 0.34 0.27 0.16 -0.89 -1.33 0.00 0.00 177.39 175.94 1bzf s THR 152 N -0.99 5.01 0.24 -5.08 2.01 -0.37 -3.63 115.64 112.83 1bzf s THR 152 Ca 0.01 0.96 -0.13 0.00 0.31 0.00 0.00 61.69 62.84 1bzf s THR 152 Cb 0.01 -3.78 -0.00 0.00 0.01 0.00 0.00 72.50 68.73 1bzf s THR 152 CO 0.00 0.50 0.48 -1.38 -0.69 0.00 0.00 174.62 173.53 1bzf s HIS 153 N -0.57 0.33 -0.00 4.92 -3.43 -1.17 0.81 115.29 116.18 1bzf s HIS 153 Ca 0.25 -0.70 0.00 0.00 -0.80 0.00 0.00 55.06 53.82 1bzf s HIS 153 Cb -0.17 0.20 0.01 0.00 -1.43 0.00 0.00 32.58 31.18 1bzf s HIS 153 CO 0.14 -0.98 0.00 0.99 -2.00 0.00 0.00 174.74 172.89 1bzf s THR 154 N -4.01 0.01 -0.74 -5.38 2.01 -0.83 -2.72 115.64 103.98 1bzf s THR 154 Ca 0.21 0.04 -0.17 0.00 0.31 0.00 0.00 61.69 62.08 1bzf s THR 154 Cb -0.01 -0.05 0.15 0.00 0.01 0.00 0.00 72.50 72.60 1bzf s THR 154 CO 0.08 0.03 0.81 -0.31 -0.69 0.00 0.00 174.62 174.54 1bzf s TYR 155 N 0.24 3.26 0.01 4.92 2.02 -0.86 -2.83 117.35 124.12 1bzf s TYR 155 Ca -0.02 -1.38 -0.30 0.00 -0.37 0.00 0.00 57.07 55.00 1bzf s TYR 155 Cb -0.03 -4.01 -0.04 0.00 -0.40 0.00 0.00 41.96 37.48 1bzf s TYR 155 CO -0.01 -1.24 1.13 -1.21 -1.57 0.00 0.00 175.55 172.66 1bzf s GLU 156 N 1.89 4.45 -0.38 -0.62 2.02 -0.94 -2.46 118.70 122.66 1bzf s GLU 156 Ca 0.18 1.64 -0.03 0.00 0.02 0.00 0.00 54.97 56.78 1bzf s GLU 156 Cb -0.16 -3.43 0.09 0.00 0.10 0.00 0.00 34.13 30.74 1bzf s GLU 156 CO -0.02 -0.24 0.16 0.08 0.02 0.00 0.00 175.26 175.26 1bzf s VAL 157 N 1.32 3.30 0.30 2.63 1.01 -1.06 -2.86 120.40 125.05 1bzf s VAL 157 Ca 0.56 -1.83 0.06 0.00 0.00 0.00 0.00 61.98 60.77 1bzf s VAL 157 Cb -0.26 -3.16 -0.02 0.00 0.00 0.00 0.00 36.38 32.95 1bzf s VAL 157 CO 0.27 -0.53 0.39 0.26 0.00 0.00 0.00 175.10 175.49 1bzf s TRP 158 N 1.19 3.17 0.01 5.22 0.52 -1.09 -2.72 118.94 125.24 1bzf s TRP 158 Ca 0.05 -0.17 -0.00 0.00 0.02 0.00 0.00 56.10 55.99 1bzf s TRP 158 Cb -0.22 -1.81 -0.01 0.00 -1.15 0.00 0.00 33.47 30.28 1bzf s TRP 158 CO -0.03 0.18 -0.01 -0.65 0.02 0.00 0.00 176.95 176.46 1bzf s GLN 159 N -4.07 0.19 -0.14 4.98 -1.52 -0.92 -2.58 119.66 115.59 1bzf s GLN 159 Ca 0.41 -0.36 -0.29 0.00 -1.95 0.00 0.00 55.36 53.17 1bzf s GLN 159 Cb -0.09 0.07 -0.04 0.00 -0.22 0.00 0.00 33.01 32.73 1bzf s GLN 159 CO 0.29 -0.03 1.74 0.21 -0.25 0.00 0.00 175.29 177.25 1bzf s LYS 160 N -0.87 3.86 -0.30 2.91 2.20 -0.91 -2.54 119.74 124.09 1bzf s LYS 160 Ca -0.10 1.96 -0.09 0.00 -0.36 0.00 0.00 55.97 57.39 1bzf s LYS 160 Cb -0.06 -4.08 0.17 0.00 -1.51 0.00 0.00 37.83 32.35 1bzf s LYS 160 CO -0.01 -1.23 0.80 0.21 -0.36 0.00 0.00 175.35 174.77 1bzf s LYS 161 N 4.67 0.42 0.00 4.03 2.20 -1.26 -4.98 119.74 124.83 1bzf s LYS 161 Ca 0.77 0.90 0.29 0.00 -0.36 0.00 0.00 55.97 57.57 1bzf s LYS 161 Cb -0.30 0.52 1.20 0.00 -1.51 0.00 0.00 37.83 37.74 1bzf s LYS 161 CO 0.31 -0.32 1.83 0.00 -0.36 0.00 0.00 175.35 176.81