#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 2.51 0.01 2.41 0.00 0.13 -2.44 121.76 124.38 1bzf s ALA 2 Ca 0.00 -1.58 -0.21 0.00 0.00 0.00 0.00 51.96 50.16 1bzf s ALA 2 Cb 0.00 -1.47 -0.05 0.00 0.00 0.00 0.00 23.12 21.59 1bzf s ALA 2 CO 0.00 -0.92 0.63 -0.06 0.00 0.00 0.00 175.76 175.42 1bzf s PHE 3 N 1.17 3.70 -0.22 0.00 0.40 -0.33 -1.33 117.98 121.37 1bzf s PHE 3 Ca -0.04 1.26 -0.04 0.00 -0.60 0.00 0.00 56.93 57.51 1bzf s PHE 3 Cb -0.18 -2.65 0.11 0.00 0.51 0.00 0.00 43.02 40.81 1bzf s PHE 3 CO -0.07 0.34 0.35 -1.17 0.70 0.00 0.00 175.22 175.37 1bzf s LEU 4 N -0.19 -0.53 -0.06 -0.37 2.96 -1.01 -0.85 118.68 118.63 1bzf s LEU 4 Ca 0.33 0.34 -0.05 0.00 -0.22 0.00 0.00 54.13 54.53 1bzf s LEU 4 Cb -0.19 1.01 0.02 0.00 0.50 0.00 0.00 46.19 47.53 1bzf s LEU 4 CO 0.19 -0.28 0.15 -1.66 -1.32 0.00 0.00 176.35 173.43 1bzf s TRP 5 N 2.51 -0.17 -0.42 5.38 -2.14 -1.14 -4.27 118.94 118.69 1bzf s TRP 5 Ca 0.08 0.43 -0.20 0.00 2.66 0.00 0.00 56.10 59.06 1bzf s TRP 5 Cb -0.14 0.04 0.02 0.00 -3.10 0.00 0.00 33.47 30.29 1bzf s TRP 5 CO -0.14 -0.09 0.63 0.00 -2.66 0.00 0.00 176.95 174.69 1bzf s ALA 6 N 0.22 3.37 0.15 2.67 0.00 -1.26 -2.95 121.76 123.96 1bzf s ALA 6 Ca -0.01 -1.14 0.06 0.00 0.00 0.00 0.00 51.96 50.87 1bzf s ALA 6 Cb -0.02 -3.26 -0.04 0.00 0.00 0.00 0.00 23.12 19.80 1bzf s ALA 6 CO -0.01 -1.67 -0.13 1.14 0.00 0.00 0.00 175.76 175.10 1bzf s GLN 7 N 2.76 1.09 0.39 0.00 1.03 -1.05 -4.56 119.66 119.32 1bzf s GLN 7 Ca 0.22 -1.38 0.08 0.00 0.04 0.00 0.00 55.36 54.32 1bzf s GLN 7 Cb -0.14 -0.83 -0.00 0.00 0.03 0.00 0.00 33.01 32.06 1bzf s GLN 7 CO 0.18 0.14 0.50 0.16 -2.54 0.00 0.00 175.29 173.73 1bzf s ASP 8 N -2.88 5.64 0.60 12.60 1.47 -0.79 -3.39 116.67 129.91 1bzf s ASP 8 Ca 0.14 -0.41 0.33 0.00 1.18 0.00 0.00 52.55 53.79 1bzf s ASP 8 Cb -0.01 -0.82 1.92 0.00 -0.34 0.00 0.00 42.92 43.67 1bzf s ASP 8 CO 0.03 -0.63 2.26 0.08 0.68 0.00 0.00 175.17 177.58 1bzf h ARG 9 N 0.80 0.00 0.00 2.11 0.11 -1.83 -0.55 114.38 115.01 1bzf h ARG 9 Ca -0.42 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.66 1bzf h ARG 9 Cb 1.27 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.35 1bzf h ARG 9 CO 0.49 0.01 0.00 -0.25 0.10 0.00 0.00 179.97 180.33 1bzf n ASP 10 N -3.63 0.00 -1.33 0.08 9.92 -1.26 -4.80 116.55 115.53 1bzf n ASP 10 Ca -0.03 -0.22 -0.04 0.00 -0.53 0.00 0.00 54.79 53.97 1bzf n ASP 10 Cb 0.10 -0.07 0.02 0.00 -0.64 0.00 0.00 41.12 40.53 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 -0.35 0.46 3.32 0.44 0.00 -0.22 -5.02 105.19 103.82 1bzf n GLY 11 Ca 0.07 -0.42 -0.23 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.62 2.36 0.00 0.99 2.96 -1.23 -3.48 118.68 117.66 1bzf s LEU 12 Ca 0.07 -0.77 0.00 0.00 -0.22 0.00 0.00 54.13 53.21 1bzf s LEU 12 Cb -0.03 -0.89 0.00 0.00 0.50 0.00 0.00 46.19 45.77 1bzf s LEU 12 CO 0.16 0.03 0.00 2.30 -1.32 0.00 0.00 176.35 177.52 1bzf n ILE 13 N 0.71 0.00 -4.14 6.68 -0.00 -1.21 -1.89 119.36 119.52 1bzf n ILE 13 Ca -0.17 0.00 -0.16 0.00 -0.00 0.00 0.00 62.75 62.43 1bzf n ILE 13 Cb 0.55 -0.48 -0.05 0.00 -0.00 0.00 0.00 39.64 39.66 1bzf n ILE 13 CO 0.00 0.00 0.00 -0.83 -0.00 0.00 0.00 176.55 175.72 1bzf s GLY 14 N -2.74 1.72 -0.30 3.28 0.00 -1.26 -4.79 107.32 103.23 1bzf s GLY 14 Ca 0.00 -1.67 -0.15 0.00 0.00 0.00 0.00 44.72 42.90 1bzf s GLY 14 CO 0.00 -1.12 1.04 1.25 0.00 0.00 0.00 173.10 174.27 1bzf s LYS 15 N -3.13 0.23 -1.74 2.90 2.20 -0.66 -3.97 119.74 115.58 1bzf s LYS 15 Ca 0.33 0.52 -0.01 0.00 -0.36 0.00 0.00 55.97 56.46 1bzf s LYS 15 Cb 0.00 0.31 0.00 0.00 -1.51 0.00 0.00 37.83 36.63 1bzf s LYS 15 CO 0.22 -0.13 0.14 -0.25 -0.36 0.00 0.00 175.35 174.97 1bzf n ASP 16 N 5.07 -5.98 0.00 1.43 8.00 -1.26 -2.85 116.55 120.96 1bzf n ASP 16 Ca -0.08 -0.08 0.00 0.00 0.71 0.00 0.00 54.79 55.34 1bzf n ASP 16 Cb 0.53 -4.94 0.00 0.00 -0.02 0.00 0.00 41.12 36.69 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 -1.13 2.03 3.95 0.44 0.00 -1.26 -4.94 105.19 104.27 1bzf n GLY 17 Ca -0.22 -0.28 -0.29 0.00 0.00 0.00 0.00 46.02 45.23 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 1.25 0.37 1.61 -3.43 -1.13 -4.94 115.29 109.01 1bzf s HIS 18 Ca 0.00 0.11 -0.08 0.00 -0.80 0.00 0.00 55.06 54.29 1bzf s HIS 18 Cb 0.00 -4.07 -0.06 0.00 -1.43 0.00 0.00 32.58 27.02 1bzf s HIS 18 CO 0.00 -2.71 0.69 -0.51 -2.00 0.00 0.00 174.74 170.20 1bzf s LEU 19 N -5.85 3.90 0.15 5.38 1.43 -1.26 -1.65 118.68 120.79 1bzf s LEU 19 Ca 0.76 0.96 0.08 0.00 -1.03 0.00 0.00 54.13 54.90 1bzf s LEU 19 Cb -0.02 -3.82 -0.13 0.00 0.03 0.00 0.00 46.19 42.25 1bzf s LEU 19 CO 0.53 -0.33 1.33 1.55 0.23 0.00 0.00 176.35 179.65 1bzf h PRO 20 N 1.34 0.00 -6.23 1.29 0.13 -1.88 -3.46 132.00 123.19 1bzf h PRO 20 Ca -0.47 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.18 1bzf h PRO 20 Cb 1.19 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 1bzf h PRO 20 CO 0.64 0.91 -0.39 1.67 -0.23 0.00 0.00 178.00 180.60 1bzf s TRP 21 N -2.82 2.85 -0.60 1.56 -2.14 -1.26 -5.08 118.94 111.46 1bzf s TRP 21 Ca 0.01 -0.37 0.04 0.00 2.66 0.00 0.00 56.10 58.45 1bzf s TRP 21 Cb 0.10 -2.01 0.16 0.00 -3.10 0.00 0.00 33.47 28.62 1bzf s TRP 21 CO 0.81 -0.00 0.39 -1.58 -2.66 0.00 0.00 176.95 173.90 1bzf s HIS 22 N -2.35 3.01 -0.95 1.66 2.46 -1.26 -5.01 115.29 112.85 1bzf s HIS 22 Ca 0.45 -3.08 -0.05 0.00 0.47 0.00 0.00 55.06 52.86 1bzf s HIS 22 Cb -0.06 -2.44 0.24 0.00 -0.13 0.00 0.00 32.58 30.19 1bzf s HIS 22 CO 0.28 -0.65 0.87 -1.17 -2.47 0.00 0.00 174.74 171.60 1bzf s LEU 23 N -0.79 5.85 0.36 8.88 2.96 -1.26 -4.91 118.68 129.77 1bzf s LEU 23 Ca 0.23 -3.58 0.17 0.00 -0.22 0.00 0.00 54.13 50.73 1bzf s LEU 23 Cb -0.11 -2.02 1.13 0.00 0.50 0.00 0.00 46.19 45.69 1bzf s LEU 23 CO -0.11 -0.25 1.67 -0.65 -1.32 0.00 0.00 176.35 175.70 1bzf h PRO 24 N 6.37 0.30 -0.69 0.98 0.10 -1.99 0.47 132.00 137.54 1bzf h PRO 24 Ca 0.15 -0.02 -0.04 0.00 0.10 0.00 0.00 66.00 66.20 1bzf h PRO 24 Cb 0.85 -0.07 -0.03 0.00 0.10 0.00 0.00 31.00 31.85 1bzf h PRO 24 CO 0.89 0.20 0.27 0.22 0.10 0.00 0.00 178.00 179.68 1bzf h ASP 25 N 0.31 0.93 0.35 -2.05 1.82 -2.00 -1.66 116.42 114.12 1bzf h ASP 25 Ca 0.73 -0.13 -0.13 0.00 -0.39 0.00 0.00 57.03 57.11 1bzf h ASP 25 Cb 1.76 -0.24 -0.01 0.00 0.68 0.00 0.00 39.33 41.52 1bzf h ASP 25 CO -0.54 0.83 -0.54 -0.78 -1.61 0.00 0.00 179.24 176.60 1bzf h ASP 26 N 0.99 0.23 0.98 2.28 3.58 -0.50 -2.48 116.42 121.51 1bzf h ASP 26 Ca 0.23 -0.12 -0.06 0.00 0.42 0.00 0.00 57.03 57.51 1bzf h ASP 26 Cb 0.19 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.17 1bzf h ASP 26 CO -0.02 0.72 -0.26 -0.07 -2.88 0.00 0.00 179.24 176.73 1bzf h LEU 27 N 0.16 0.00 0.01 2.28 3.38 -0.85 -2.94 115.31 117.35 1bzf h LEU 27 Ca 0.00 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.74 1bzf h LEU 27 Cb 1.00 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.72 1bzf h LEU 27 CO 0.08 0.26 -1.16 0.45 0.09 0.00 0.00 178.44 178.16 1bzf h HIS 28 N 0.00 0.03 0.00 1.13 3.86 -1.01 -3.24 115.15 115.92 1bzf h HIS 28 Ca -0.00 -0.02 -0.06 0.00 -1.16 0.00 0.00 60.37 59.13 1bzf h HIS 28 Cb 0.83 -0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.29 1bzf h HIS 28 CO 0.00 1.02 -0.27 -0.92 0.86 0.00 0.00 177.93 178.62 1bzf h TYR 29 N 0.00 0.00 -0.36 2.45 3.20 -1.28 -3.03 116.97 117.95 1bzf h TYR 29 Ca -0.08 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.77 1bzf h TYR 29 Cb 1.83 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 40.09 1bzf h TYR 29 CO 0.00 0.27 0.14 0.35 -1.64 0.00 0.00 178.16 177.28 1bzf h PHE 30 N 0.00 0.56 0.00 -3.82 3.57 -1.56 -0.26 116.94 115.43 1bzf h PHE 30 Ca -0.00 -0.05 -0.04 0.00 3.53 0.00 0.00 57.97 61.41 1bzf h PHE 30 Cb 0.73 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.30 1bzf h PHE 30 CO 0.00 0.52 -0.19 -0.09 -2.23 0.00 0.00 178.31 176.31 1bzf h ARG 31 N 0.44 0.00 0.00 1.11 2.43 -1.66 -1.92 114.38 114.78 1bzf h ARG 31 Ca 0.12 0.00 -0.17 0.00 -0.81 0.00 0.00 59.98 59.12 1bzf h ARG 31 Cb 0.20 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 1bzf h ARG 31 CO -0.01 0.19 -0.81 0.00 -1.51 0.00 0.00 179.97 177.84 1bzf h ALA 32 N 1.81 0.54 -0.93 2.80 0.00 -1.36 -3.02 119.26 119.10 1bzf h ALA 32 Ca -0.00 -0.74 -0.54 0.00 0.00 0.00 0.00 54.91 53.63 1bzf h ALA 32 Cb 0.37 -0.13 -0.29 0.00 0.00 0.00 0.00 17.79 17.74 1bzf h ALA 32 CO 0.03 1.01 0.61 1.04 0.00 0.00 0.00 179.25 181.93 1bzf n GLN 33 N -3.39 2.40 0.00 0.00 1.13 -0.17 -4.32 117.38 113.03 1bzf n GLN 33 Ca 0.00 -3.16 0.00 0.00 -1.94 0.00 0.00 57.00 51.90 1bzf n GLN 33 Cb 0.83 -2.18 0.00 0.00 0.11 0.00 0.00 30.24 28.99 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 -1.06 0.00 -2.12 5.09 -2.24 -0.99 -4.98 114.28 107.97 1bzf n THR 34 Ca 0.58 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.94 1bzf n THR 34 Cb 1.26 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 69.46 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 3.43 -0.04 2.28 -7.23 -1.14 -2.71 120.40 113.99 1bzf s VAL 35 Ca 0.00 0.88 -0.00 0.00 -1.81 0.00 0.00 61.98 61.05 1bzf s VAL 35 Cb 0.00 -3.57 0.00 0.00 0.56 0.00 0.00 36.38 33.38 1bzf s VAL 35 CO 0.00 0.01 0.02 0.61 -0.31 0.00 0.00 175.10 175.43 1bzf n GLY 36 N 3.72 0.74 3.67 2.32 0.00 -1.24 -5.03 105.19 109.38 1bzf n GLY 36 Ca 0.14 -0.73 -0.10 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 -4.71 1.91 -0.56 1.61 1.02 -1.10 -4.63 119.74 113.29 1bzf s LYS 37 Ca 0.01 -1.42 -0.17 0.00 0.02 0.00 0.00 55.97 54.41 1bzf s LYS 37 Cb -0.00 0.53 0.12 0.00 -0.52 0.00 0.00 37.83 37.96 1bzf s LYS 37 CO 0.01 -0.84 0.56 0.42 -0.92 0.00 0.00 175.35 174.58 1bzf s ILE 38 N -3.17 5.09 -0.01 2.17 1.01 -1.06 -2.87 121.20 122.36 1bzf s ILE 38 Ca 0.21 -1.35 -0.30 0.00 0.00 0.00 0.00 60.65 59.21 1bzf s ILE 38 Cb -0.03 -4.39 -0.05 0.00 0.01 0.00 0.00 42.46 38.01 1bzf s ILE 38 CO 0.13 -0.95 1.31 -0.32 0.00 0.00 0.00 174.94 175.11 1bzf s MET 39 N 1.93 4.32 -0.11 2.79 1.75 0.28 -2.65 119.30 127.61 1bzf s MET 39 Ca 0.06 1.85 -0.01 0.00 -1.25 0.00 0.00 55.69 56.33 1bzf s MET 39 Cb -0.28 -3.54 0.03 0.00 2.84 0.00 0.00 34.83 33.88 1bzf s MET 39 CO 0.04 -0.50 -0.03 0.08 -0.65 0.00 0.00 175.02 173.96 1bzf s VAL 40 N 2.17 0.71 0.24 10.11 1.01 -1.07 -0.93 120.40 132.65 1bzf s VAL 40 Ca 0.61 -0.17 0.04 0.00 0.00 0.00 0.00 61.98 62.45 1bzf s VAL 40 Cb -0.29 -0.85 -0.01 0.00 0.00 0.00 0.00 36.38 35.23 1bzf s VAL 40 CO 0.25 0.24 0.13 1.33 0.00 0.00 0.00 175.10 177.05 1bzf n VAL 41 N 5.03 0.00 -2.63 2.92 0.24 -0.99 -2.86 118.33 120.04 1bzf n VAL 41 Ca -0.10 -1.54 0.00 0.00 -2.04 0.00 0.00 64.34 60.66 1bzf n VAL 41 Cb 0.49 0.64 0.00 0.00 -1.47 0.00 0.00 33.84 33.51 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 0.02 1.45 0.11 7.63 0.00 -0.77 -2.97 105.19 110.66 1bzf n GLY 42 Ca -0.00 -2.05 -0.17 0.00 0.00 0.00 0.00 46.02 43.79 1bzf n GLY 42 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1bzf h ARG 43 N 0.00 0.31 -0.33 1.61 2.43 -1.93 -2.39 114.38 114.09 1bzf h ARG 43 Ca 0.00 -0.53 -0.15 0.00 -0.81 0.00 0.00 59.98 58.48 1bzf h ARG 43 Cb 0.00 0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 29.75 1bzf h ARG 43 CO 0.00 1.26 -0.40 -0.09 -1.51 0.00 0.00 179.97 179.23 1bzf h ARG 44 N 0.09 0.85 0.00 0.20 2.43 -1.96 -2.93 114.38 113.05 1bzf h ARG 44 Ca -0.15 -0.48 -0.08 0.00 -0.81 0.00 0.00 59.98 58.46 1bzf h ARG 44 Cb 2.00 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 31.57 1bzf h ARG 44 CO 0.22 1.11 -0.40 1.15 -1.51 0.00 0.00 179.97 180.54 1bzf h THR 45 N 0.64 0.89 -0.38 0.20 2.02 -1.90 -2.42 112.91 111.97 1bzf h THR 45 Ca 0.04 -1.62 -0.03 0.00 0.77 0.00 0.00 66.41 65.57 1bzf h THR 45 Cb 0.99 1.99 -0.02 0.00 -1.74 0.00 0.00 68.15 69.38 1bzf h THR 45 CO 0.10 0.39 0.13 0.22 0.37 0.00 0.00 175.52 176.73 1bzf h TYR 46 N 0.00 0.60 0.00 3.16 3.20 -1.24 -2.59 116.97 120.10 1bzf h TYR 46 Ca -0.00 -0.05 -0.06 0.00 3.14 0.00 0.00 58.73 61.75 1bzf h TYR 46 Cb 0.96 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 39.05 1bzf h TYR 46 CO 0.00 0.56 -0.29 0.93 -1.64 0.00 0.00 178.16 177.72 1bzf h GLU 47 N 0.47 0.00 0.00 1.82 4.39 -1.48 -3.09 114.58 116.69 1bzf h GLU 47 Ca 0.12 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.81 1bzf h GLU 47 Cb 0.23 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.87 1bzf h GLU 47 CO -0.01 0.29 -0.06 0.77 -1.16 0.00 0.00 179.01 178.84 1bzf h SER 48 N 0.00 0.00 -4.25 1.42 0.02 -1.03 -3.43 113.55 106.28 1bzf h SER 48 Ca -0.00 0.00 -0.51 0.00 -0.84 0.00 0.00 61.79 60.43 1bzf h SER 48 Cb 1.10 0.00 0.16 0.00 0.14 0.00 0.00 62.40 63.80 1bzf h SER 48 CO 0.04 0.06 0.26 -0.36 -1.14 0.00 0.00 176.83 175.69 1bzf s PHE 49 N -4.30 2.10 0.00 3.45 0.08 -1.15 -4.93 117.98 113.23 1bzf s PHE 49 Ca -0.04 1.63 0.00 0.00 0.12 0.00 0.00 56.93 58.65 1bzf s PHE 49 Cb 0.14 -3.19 0.00 0.00 -0.57 0.00 0.00 43.02 39.40 1bzf s PHE 49 CO 0.55 -2.34 0.00 -0.35 -0.10 0.00 0.00 175.22 172.98 1bzf n PRO 50 N -3.90 0.00 -3.63 0.24 -0.04 -1.26 -4.73 135.00 121.69 1bzf n PRO 50 Ca 0.10 0.35 -0.39 0.00 -0.04 0.00 0.00 63.50 63.52 1bzf n PRO 50 Cb 0.53 -0.85 -0.09 0.00 -0.04 0.00 0.00 33.50 33.05 1bzf n PRO 50 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1bzf s LYS 51 N -0.70 2.59 0.20 0.54 2.20 -1.26 -5.07 119.74 118.23 1bzf s LYS 51 Ca 0.00 -2.18 0.03 0.00 -0.36 0.00 0.00 55.97 53.46 1bzf s LYS 51 Cb 0.00 -3.86 -0.03 0.00 -1.51 0.00 0.00 37.83 32.43 1bzf s LYS 51 CO 0.00 -1.18 0.33 -0.98 -0.36 0.00 0.00 175.35 173.17 1bzf s ARG 52 N 0.58 3.45 0.49 4.03 1.70 -1.26 -4.26 118.95 123.68 1bzf s ARG 52 Ca 0.12 -0.64 -0.16 0.00 -0.47 0.00 0.00 55.73 54.58 1bzf s ARG 52 Cb -0.21 -2.91 -0.08 0.00 -0.57 0.00 0.00 34.95 31.18 1bzf s ARG 52 CO -0.04 0.46 0.96 -1.25 -1.08 0.00 0.00 175.30 174.35 1bzf s PRO 53 N -3.60 3.95 -0.26 3.89 0.04 -1.26 -5.09 135.00 132.68 1bzf s PRO 53 Ca 0.35 0.91 -0.29 0.00 0.04 0.00 0.00 61.00 62.01 1bzf s PRO 53 Cb -0.10 -2.17 -0.01 0.00 0.04 0.00 0.00 34.50 32.26 1bzf s PRO 53 CO 0.29 -0.22 1.39 -0.51 0.04 0.00 0.00 177.00 177.99 1bzf s LEU 54 N -3.96 3.93 1.00 -3.56 1.43 -1.26 -5.01 118.68 111.24 1bzf s LEU 54 Ca 0.58 1.39 -0.17 0.00 -1.03 0.00 0.00 54.13 54.91 1bzf s LEU 54 Cb -0.10 -3.54 0.22 0.00 0.03 0.00 0.00 46.19 42.81 1bzf s LEU 54 CO 0.30 -1.09 1.32 -2.16 0.23 0.00 0.00 176.35 174.94 1bzf s PRO 55 N 4.23 0.30 -1.71 1.29 0.04 -1.26 -4.28 135.00 133.62 1bzf s PRO 55 Ca 0.61 -0.43 0.00 0.00 0.04 0.00 0.00 61.00 61.21 1bzf s PRO 55 Cb -0.20 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.53 1bzf s PRO 55 CO 0.24 -2.64 0.00 0.39 0.04 0.00 0.00 177.00 175.03 1bzf n GLU 56 N -3.92 -1.55 -3.60 4.56 1.02 -1.26 -4.92 120.64 110.97 1bzf n GLU 56 Ca 0.16 0.97 0.01 0.00 -0.02 0.00 0.00 57.16 58.28 1bzf n GLU 56 Cb 0.59 -5.54 -0.01 0.00 -0.02 0.00 0.00 31.44 26.46 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 -4.89 0.25 -0.31 3.49 1.70 -1.26 -3.60 118.95 114.33 1bzf s ARG 57 Ca 0.00 -0.13 -0.22 0.00 -0.47 0.00 0.00 55.73 54.91 1bzf s ARG 57 Cb 0.00 0.09 -0.00 0.00 -0.57 0.00 0.00 34.95 34.47 1bzf s ARG 57 CO 0.00 -0.11 0.72 0.99 -1.08 0.00 0.00 175.30 175.82 1bzf s THR 58 N -2.28 4.85 -0.59 4.99 2.01 -1.14 -4.90 115.64 118.58 1bzf s THR 58 Ca 0.13 1.02 -0.21 0.00 0.31 0.00 0.00 61.69 62.95 1bzf s THR 58 Cb 0.04 -4.09 0.08 0.00 0.01 0.00 0.00 72.50 68.54 1bzf s THR 58 CO -0.05 -0.22 0.79 0.20 -0.69 0.00 0.00 174.62 174.66 1bzf s ASN 59 N 1.64 6.20 0.01 3.53 0.02 -1.26 -0.56 114.94 124.52 1bzf s ASN 59 Ca 0.29 -1.10 0.02 0.00 -1.02 0.00 0.00 52.86 51.05 1bzf s ASN 59 Cb -0.14 -2.35 -0.04 0.00 0.02 0.00 0.00 41.25 38.74 1bzf s ASN 59 CO 0.12 -1.18 -0.01 -0.69 0.02 0.00 0.00 177.10 175.37 1bzf s VAL 60 N 3.21 4.10 -0.12 1.60 1.01 -0.10 -1.20 120.40 128.90 1bzf s VAL 60 Ca 0.17 -0.65 -0.02 0.00 0.00 0.00 0.00 61.98 61.48 1bzf s VAL 60 Cb -0.20 -2.84 0.04 0.00 0.00 0.00 0.00 36.38 33.38 1bzf s VAL 60 CO 0.10 0.35 0.01 -0.69 0.00 0.00 0.00 175.10 174.87 1bzf s VAL 61 N -1.10 0.46 -0.28 2.92 1.01 -0.92 -2.36 120.40 120.13 1bzf s VAL 61 Ca 0.20 -0.14 -0.15 0.00 0.00 0.00 0.00 61.98 61.90 1bzf s VAL 61 Cb -0.11 -0.73 -0.04 0.00 0.00 0.00 0.00 36.38 35.50 1bzf s VAL 61 CO 0.11 0.10 0.36 -0.22 0.00 0.00 0.00 175.10 175.44 1bzf s LEU 62 N 1.92 4.07 0.04 3.92 2.96 -1.16 -2.84 118.68 127.60 1bzf s LEU 62 Ca 0.03 0.21 0.01 0.00 -0.22 0.00 0.00 54.13 54.16 1bzf s LEU 62 Cb -0.14 -2.39 -0.03 0.00 0.50 0.00 0.00 46.19 44.13 1bzf s LEU 62 CO -0.06 -0.19 -0.05 0.28 -1.32 0.00 0.00 176.35 175.01 1bzf s THR 63 N 2.04 0.30 -0.15 3.68 -1.32 -1.17 -4.41 115.64 114.61 1bzf s THR 63 Ca 0.14 -1.20 0.01 0.00 -1.21 0.00 0.00 61.69 59.43 1bzf s THR 63 Cb -0.16 -0.70 -0.23 0.00 -1.51 0.00 0.00 72.50 69.90 1bzf s THR 63 CO 0.10 -0.59 0.23 1.57 -2.21 0.00 0.00 174.62 173.73 1bzf n HIS 64 N 1.16 0.76 -2.35 9.09 -0.00 -1.26 -4.29 115.22 118.33 1bzf n HIS 64 Ca -0.21 0.19 -0.41 0.00 0.46 0.00 0.00 57.72 57.74 1bzf n HIS 64 Cb 0.56 -1.11 -0.03 0.00 -0.12 0.00 0.00 29.99 29.29 1bzf n HIS 64 CO 0.00 0.00 0.00 -0.65 0.46 0.00 0.00 176.34 176.15 1bzf s GLN 65 N -2.55 4.45 -0.19 1.57 -0.21 -1.26 -4.90 119.66 116.58 1bzf s GLN 65 Ca -0.21 1.89 0.02 0.00 0.02 0.00 0.00 55.36 57.08 1bzf s GLN 65 Cb 0.07 -3.25 0.29 0.00 1.00 0.00 0.00 33.01 31.11 1bzf s GLN 65 CO 0.74 -0.17 1.38 0.39 -2.12 0.00 0.00 175.29 175.52 1bzf n GLU 66 N 2.90 1.55 -0.11 2.91 4.71 -1.26 -3.93 120.64 127.40 1bzf n GLU 66 Ca 0.06 -1.28 -0.15 0.00 -0.01 0.00 0.00 57.16 55.78 1bzf n GLU 66 Cb 0.45 -1.51 -0.11 0.00 -1.01 0.00 0.00 31.44 29.26 1bzf n GLU 66 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1bzf n ASP 67 N -0.19 2.02 -4.76 1.62 8.00 -1.26 -4.95 116.55 117.02 1bzf n ASP 67 Ca 0.25 -0.10 -0.40 0.00 0.71 0.00 0.00 54.79 55.25 1bzf n ASP 67 Cb 0.99 -0.18 -0.03 0.00 -0.02 0.00 0.00 41.12 41.88 1bzf n ASP 67 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1bzf s TYR 68 N -2.45 3.37 -0.28 1.24 5.04 -1.25 -5.02 117.35 117.99 1bzf s TYR 68 Ca -0.27 1.62 0.00 0.00 -2.44 0.00 0.00 57.07 55.98 1bzf s TYR 68 Cb 0.07 -3.35 0.15 0.00 0.35 0.00 0.00 41.96 39.18 1bzf s TYR 68 CO 0.55 -0.91 0.36 -0.65 -1.34 0.00 0.00 175.55 173.56 1bzf s GLN 69 N -1.77 0.36 -0.35 4.97 -0.21 -1.26 -5.07 119.66 116.32 1bzf s GLN 69 Ca 0.49 0.07 -0.27 0.00 0.02 0.00 0.00 55.36 55.67 1bzf s GLN 69 Cb -0.32 -0.49 0.02 0.00 1.00 0.00 0.00 33.01 33.22 1bzf s GLN 69 CO 0.41 -0.98 1.01 0.00 -2.12 0.00 0.00 175.29 173.61 1bzf s ALA 70 N 2.47 3.43 0.15 6.09 0.00 -1.26 -5.01 121.76 127.62 1bzf s ALA 70 Ca 0.10 -0.27 -0.30 0.00 0.00 0.00 0.00 51.96 51.49 1bzf s ALA 70 Cb -0.13 -3.63 -0.07 0.00 0.00 0.00 0.00 23.12 19.29 1bzf s ALA 70 CO -0.29 -1.60 1.06 -0.65 0.00 0.00 0.00 175.76 174.29 1bzf s GLN 71 N 3.63 4.61 -0.12 0.00 -0.21 -1.26 -3.42 119.66 122.89 1bzf s GLN 71 Ca 0.42 1.64 -0.00 0.00 0.02 0.00 0.00 55.36 57.44 1bzf s GLN 71 Cb -0.12 -3.31 0.00 0.00 1.00 0.00 0.00 33.01 30.58 1bzf s GLN 71 CO 0.18 0.09 0.05 0.41 -2.12 0.00 0.00 175.29 173.90 1bzf n GLY 72 N 2.19 0.58 3.49 3.09 0.00 -1.26 -4.97 105.19 108.32 1bzf n GLY 72 Ca 0.03 -0.71 -0.16 0.00 0.00 0.00 0.00 46.02 45.17 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 -2.56 -1.60 -0.79 4.61 0.00 -1.22 -4.92 121.76 115.28 1bzf s ALA 73 Ca 0.02 1.30 -0.25 0.00 0.00 0.00 0.00 51.96 53.03 1bzf s ALA 73 Cb -0.01 -0.22 -0.02 0.00 0.00 0.00 0.00 23.12 22.86 1bzf s ALA 73 CO 0.03 -0.34 1.81 0.08 0.00 0.00 0.00 175.76 177.34 1bzf s VAL 74 N -0.87 3.48 -0.23 0.00 1.01 -0.34 -4.87 120.40 118.58 1bzf s VAL 74 Ca -0.09 -0.13 -0.14 0.00 0.00 0.00 0.00 61.98 61.62 1bzf s VAL 74 Cb -0.02 -4.16 -0.04 0.00 0.00 0.00 0.00 36.38 32.16 1bzf s VAL 74 CO 0.07 -1.11 0.30 -0.69 0.00 0.00 0.00 175.10 173.67 1bzf s VAL 75 N 8.83 5.26 0.32 2.92 1.01 -1.26 -2.16 120.40 135.32 1bzf s VAL 75 Ca 0.64 0.48 0.03 0.00 0.00 0.00 0.00 61.98 63.13 1bzf s VAL 75 Cb -0.08 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 1bzf s VAL 75 CO 0.08 0.28 0.15 0.68 0.00 0.00 0.00 175.10 176.28 1bzf s VAL 76 N 1.32 0.44 -0.04 2.92 -7.23 -1.13 -4.99 120.40 111.69 1bzf s VAL 76 Ca 0.14 -2.00 0.25 0.00 -1.81 0.00 0.00 61.98 58.56 1bzf s VAL 76 Cb -0.14 -2.51 0.44 0.00 0.56 0.00 0.00 36.38 34.73 1bzf s VAL 76 CO 0.07 0.00 1.17 1.41 -0.31 0.00 0.00 175.10 177.44 1bzf n HIS 77 N -0.65 0.15 -3.69 2.82 8.25 -1.26 -3.02 115.22 117.82 1bzf n HIS 77 Ca -0.00 -0.73 -0.14 0.00 -0.26 0.00 0.00 57.72 56.58 1bzf n HIS 77 Cb 0.65 -0.16 -0.09 0.00 1.12 0.00 0.00 29.99 31.51 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 -2.26 -0.46 0.32 0.41 2.15 -1.26 -4.89 116.67 110.67 1bzf s ASP 78 Ca 0.34 0.75 0.07 0.00 0.43 0.00 0.00 52.55 54.13 1bzf s ASP 78 Cb 0.38 0.78 0.56 0.00 -0.30 0.00 0.00 42.92 44.34 1bzf s ASP 78 CO -0.15 -0.30 1.78 0.58 -0.17 0.00 0.00 175.17 176.91 1bzf h VAL 79 N 4.05 1.26 -0.22 1.11 2.07 -1.98 -2.56 116.25 119.99 1bzf h VAL 79 Ca -0.28 -1.21 -0.10 0.00 0.82 0.00 0.00 66.70 65.94 1bzf h VAL 79 Cb 1.17 1.44 -0.01 0.00 -1.52 0.00 0.00 31.29 32.37 1bzf h VAL 79 CO 0.27 0.37 -0.29 0.00 0.02 0.00 0.00 177.57 177.94 1bzf h ALA 80 N 1.46 1.10 -0.57 1.67 0.00 -1.99 -2.50 119.26 118.43 1bzf h ALA 80 Ca 0.04 -0.36 -0.09 0.00 0.00 0.00 0.00 54.91 54.50 1bzf h ALA 80 Cb 0.63 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1bzf h ALA 80 CO 0.05 0.56 0.00 0.00 0.00 0.00 0.00 179.25 179.86 1bzf h ALA 81 N 1.32 0.92 -0.54 0.00 0.00 -1.87 -0.61 119.26 118.48 1bzf h ALA 81 Ca 0.05 -0.30 -0.11 0.00 0.00 0.00 0.00 54.91 54.56 1bzf h ALA 81 Cb 0.70 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1bzf h ALA 81 CO 0.05 0.64 -0.09 0.28 0.00 0.00 0.00 179.25 180.14 1bzf h VAL 82 N 0.91 1.27 0.00 0.00 2.07 -1.34 -2.63 116.25 116.53 1bzf h VAL 82 Ca 0.17 -1.23 -0.10 0.00 0.82 0.00 0.00 66.70 66.35 1bzf h VAL 82 Cb 0.52 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 1bzf h VAL 82 CO 0.03 0.43 -0.50 -0.26 0.02 0.00 0.00 177.57 177.29 1bzf h PHE 83 N 0.89 0.00 -0.58 1.57 0.04 -1.19 -2.97 116.94 114.71 1bzf h PHE 83 Ca 0.14 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.85 1bzf h PHE 83 Cb 0.64 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.76 1bzf h PHE 83 CO 0.04 0.50 0.08 0.00 -0.60 0.00 0.00 178.31 178.33 1bzf h ALA 84 N 1.50 1.06 -0.31 2.45 0.00 -0.75 -0.06 119.26 123.15 1bzf h ALA 84 Ca -0.00 -0.25 -0.14 0.00 0.00 0.00 0.00 54.91 54.51 1bzf h ALA 84 Cb 0.96 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1bzf h ALA 84 CO 0.06 0.61 -0.37 -0.92 0.00 0.00 0.00 179.25 178.63 1bzf h TYR 85 N 0.88 0.85 -0.08 0.00 5.03 -1.36 -2.32 116.97 119.97 1bzf h TYR 85 Ca 0.18 -0.24 -0.15 0.00 2.58 0.00 0.00 58.73 61.10 1bzf h TYR 85 Cb 0.40 -0.18 -0.01 0.00 1.55 0.00 0.00 36.73 38.49 1bzf h TYR 85 CO 0.03 0.98 -0.61 0.00 -1.32 0.00 0.00 178.16 177.24 1bzf h ALA 86 N 0.99 0.81 -0.35 1.82 0.00 -1.34 -2.66 119.26 118.53 1bzf h ALA 86 Ca 0.05 -0.54 -0.07 0.00 0.00 0.00 0.00 54.91 54.35 1bzf h ALA 86 Cb 0.91 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1bzf h ALA 86 CO 0.08 0.73 -0.07 -0.22 0.00 0.00 0.00 179.25 179.77 1bzf h LYS 87 N 0.21 0.66 0.00 0.00 3.64 -0.84 -2.72 116.57 117.52 1bzf h LYS 87 Ca -0.01 -0.24 -0.05 0.00 -1.27 0.00 0.00 60.65 59.08 1bzf h LYS 87 Cb 1.12 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.89 1bzf h LYS 87 CO 0.10 0.81 -0.24 0.37 -2.27 0.00 0.00 179.45 178.22 1bzf h GLN 88 N 0.45 0.00 -3.39 1.90 4.15 -1.38 -3.34 115.11 113.49 1bzf h GLN 88 Ca 0.09 0.00 -0.64 0.00 0.77 0.00 0.00 58.65 58.87 1bzf h GLN 88 Cb 0.56 0.00 -0.41 0.00 0.21 0.00 0.00 27.48 27.84 1bzf h GLN 88 CO 0.03 0.24 -0.61 -1.01 -1.93 0.00 0.00 178.83 175.55 1bzf s HIS 89 N -4.36 3.20 -0.39 3.99 3.76 -1.01 -4.90 115.29 115.57 1bzf s HIS 89 Ca -0.03 -3.15 0.22 0.00 -0.15 0.00 0.00 55.06 51.96 1bzf s HIS 89 Cb 0.15 -2.85 0.33 0.00 1.11 0.00 0.00 32.58 31.32 1bzf s HIS 89 CO 0.68 -0.75 1.60 -1.00 -0.85 0.00 0.00 174.74 174.43 1bzf h PRO 90 N 6.53 0.00 0.00 8.40 0.13 -1.69 -3.24 132.00 142.13 1bzf h PRO 90 Ca -0.07 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.03 1bzf h PRO 90 Cb 0.89 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.02 1bzf h PRO 90 CO 0.69 0.06 -0.13 0.22 -0.23 0.00 0.00 178.00 178.61 1bzf h ASP 91 N 0.00 0.00 -1.81 1.44 1.82 -1.90 -3.43 116.42 112.54 1bzf h ASP 91 Ca -0.00 0.00 -0.49 0.00 -0.39 0.00 0.00 57.03 56.15 1bzf h ASP 91 Cb 1.03 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 41.01 1bzf h ASP 91 CO 0.01 0.13 -0.43 -1.10 -1.61 0.00 0.00 179.24 176.24 1bzf s GLN 92 N -4.58 2.75 0.03 0.28 -0.21 -1.23 -5.01 119.66 111.69 1bzf s GLN 92 Ca -0.04 -1.28 0.08 0.00 0.02 0.00 0.00 55.36 54.14 1bzf s GLN 92 Cb 0.15 -2.51 -0.03 0.00 1.00 0.00 0.00 33.01 31.63 1bzf s GLN 92 CO 0.65 0.06 -0.24 -1.21 -2.12 0.00 0.00 175.29 172.44 1bzf s GLU 93 N -4.03 1.68 0.19 2.91 2.02 -1.26 -4.92 118.70 115.28 1bzf s GLU 93 Ca 0.42 -1.00 -0.31 0.00 0.02 0.00 0.00 54.97 54.11 1bzf s GLU 93 Cb -0.06 -1.79 -0.09 0.00 0.10 0.00 0.00 34.13 32.29 1bzf s GLU 93 CO 0.27 0.47 1.41 -1.17 0.02 0.00 0.00 175.26 176.26 1bzf s LEU 94 N -1.08 4.39 -0.07 1.80 0.20 -1.26 -2.55 118.68 120.11 1bzf s LEU 94 Ca 0.10 2.51 -0.01 0.00 0.69 0.00 0.00 54.13 57.42 1bzf s LEU 94 Cb -0.09 -3.61 0.03 0.00 -0.43 0.00 0.00 46.19 42.09 1bzf s LEU 94 CO 0.01 -0.66 -0.00 -0.69 -0.29 0.00 0.00 176.35 174.72 1bzf s VAL 95 N 0.46 0.40 -0.04 1.68 1.01 -1.08 -0.69 120.40 122.13 1bzf s VAL 95 Ca 0.61 0.10 -0.11 0.00 0.00 0.00 0.00 61.98 62.58 1bzf s VAL 95 Cb -0.40 -0.55 -0.05 0.00 0.00 0.00 0.00 36.38 35.39 1bzf s VAL 95 CO 0.37 0.26 0.30 -0.63 0.00 0.00 0.00 175.10 175.40 1bzf s ILE 96 N 1.90 5.23 -0.06 2.22 -1.09 -0.44 -2.59 121.20 126.36 1bzf s ILE 96 Ca 0.04 0.54 0.02 0.00 -2.23 0.00 0.00 60.65 59.02 1bzf s ILE 96 Cb -0.12 -3.58 -0.05 0.00 -1.58 0.00 0.00 42.46 37.12 1bzf s ILE 96 CO -0.05 0.56 -0.03 0.00 -1.23 0.00 0.00 174.94 174.19 1bzf n ALA 97 N 1.77 1.86 0.00 9.38 0.00 -1.14 -2.42 120.51 129.97 1bzf n ALA 97 Ca -0.16 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 52.97 1bzf n ALA 97 Cb 0.53 0.26 0.00 0.00 0.00 0.00 0.00 19.45 20.25 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 2.98 -0.85 0.00 0.00 0.00 -1.26 -4.58 105.19 101.47 1bzf n GLY 98 Ca -0.11 -1.29 0.00 0.00 0.00 0.00 0.00 46.02 44.63 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 -0.89 0.70 0.29 -0.02 0.00 -1.26 -1.85 105.19 102.15 1bzf n GLY 99 Ca 0.00 -1.71 0.16 0.00 0.00 0.00 0.00 46.02 44.47 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 -1.64 1.26 -0.32 4.61 0.00 -1.93 -1.95 119.26 119.29 1bzf h ALA 100 Ca 0.00 -0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.71 1bzf h ALA 100 Cb 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1bzf h ALA 100 CO 0.00 0.06 -0.43 1.96 0.00 0.00 0.00 179.25 180.84 1bzf h GLN 101 N 0.00 0.80 -0.22 0.00 7.50 -1.97 -2.22 115.11 119.00 1bzf h GLN 101 Ca -0.00 -0.44 -0.19 0.00 0.50 0.00 0.00 58.65 58.52 1bzf h GLN 101 Cb 0.18 0.02 0.00 0.00 0.05 0.00 0.00 27.48 27.73 1bzf h GLN 101 CO 0.01 1.07 -0.64 0.82 -1.50 0.00 0.00 178.83 178.59 1bzf h ILE 102 N 0.65 1.29 -0.68 2.54 1.08 -1.62 -2.40 117.51 118.36 1bzf h ILE 102 Ca 0.04 -1.85 -0.03 0.00 -0.39 0.00 0.00 64.86 62.63 1bzf h ILE 102 Cb 1.00 1.80 -0.03 0.00 -3.07 0.00 0.00 36.82 36.51 1bzf h ILE 102 CO 0.10 0.59 0.29 -0.26 -0.69 0.00 0.00 178.15 178.18 1bzf h PHE 103 N 0.57 1.02 0.00 1.37 0.04 -1.42 -1.57 116.94 116.95 1bzf h PHE 103 Ca -0.01 -0.07 0.00 0.00 2.80 0.00 0.00 57.97 60.69 1bzf h PHE 103 Cb 1.24 -0.31 0.00 0.00 2.20 0.00 0.00 35.95 39.08 1bzf h PHE 103 CO 0.07 0.78 0.00 1.79 -0.60 0.00 0.00 178.31 180.35 1bzf h THR 104 N 0.97 0.00 0.00 -1.55 1.35 -1.36 0.18 112.91 112.49 1bzf h THR 104 Ca 0.23 -0.53 -0.11 0.00 -0.55 0.00 0.00 66.41 65.45 1bzf h THR 104 Cb 0.18 1.49 -0.02 0.00 -1.73 0.00 0.00 68.15 68.07 1bzf h THR 104 CO -0.02 0.00 -0.53 0.00 -0.25 0.00 0.00 175.52 174.72 1bzf h ALA 105 N 2.06 0.71 0.00 6.62 0.00 -0.76 -3.29 119.26 124.59 1bzf h ALA 105 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1bzf h ALA 105 Cb 0.56 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1bzf h ALA 105 CO 0.00 0.66 -0.11 1.19 0.00 0.00 0.00 179.25 180.99 1bzf n PHE 106 N -3.31 0.00 0.23 0.00 3.72 -1.01 -4.74 117.46 112.35 1bzf n PHE 106 Ca 0.01 -0.77 0.05 0.00 -0.05 0.00 0.00 57.45 56.70 1bzf n PHE 106 Cb 0.70 -0.13 0.51 0.00 -0.94 0.00 0.00 39.48 39.63 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 0.00 0.00 -0.99 -1.08 2.10 -0.73 -1.76 116.57 114.10 1bzf h LYS 107 Ca 0.00 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.64 1bzf h LYS 107 Cb 1.08 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.41 1bzf h LYS 107 CO 0.00 0.17 0.02 -3.47 -2.00 0.00 0.00 179.45 174.17 1bzf n ASP 108 N -4.34 2.30 -1.75 7.07 2.03 -1.26 -3.37 116.55 117.24 1bzf n ASP 108 Ca -0.02 -2.06 -0.05 0.00 0.52 0.00 0.00 54.79 53.18 1bzf n ASP 108 Cb 0.24 -0.51 0.02 0.00 -0.72 0.00 0.00 41.12 40.14 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 0.27 -1.21 -4.88 1.67 8.00 -0.66 -5.13 116.55 114.60 1bzf n ASP 109 Ca 0.02 -2.10 -0.31 0.00 0.71 0.00 0.00 54.79 53.11 1bzf n ASP 109 Cb 0.45 0.48 -0.05 0.00 -0.02 0.00 0.00 41.12 41.97 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 0.06 4.98 0.18 2.53 0.11 -1.22 -3.84 120.40 123.20 1bzf s VAL 110 Ca 0.04 0.35 0.00 0.00 -2.93 0.00 0.00 61.98 59.44 1bzf s VAL 110 Cb 0.20 -3.63 0.00 0.00 -1.53 0.00 0.00 36.38 31.42 1bzf s VAL 110 CO -0.06 -0.09 0.00 0.47 -3.33 0.00 0.00 175.10 172.09 1bzf n ASP 111 N -0.22 0.25 -4.44 3.54 8.00 -1.02 -4.86 116.55 117.80 1bzf n ASP 111 Ca -0.00 0.30 -0.41 0.00 0.71 0.00 0.00 54.79 55.39 1bzf n ASP 111 Cb 0.52 0.11 -0.11 0.00 -0.02 0.00 0.00 41.12 41.63 1bzf n ASP 111 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1bzf s THR 112 N -2.00 4.92 -0.61 -3.53 2.01 -1.17 -1.75 115.64 113.51 1bzf s THR 112 Ca 0.00 -0.60 -0.19 0.00 0.31 0.00 0.00 61.69 61.21 1bzf s THR 112 Cb 0.00 -3.67 0.11 0.00 0.01 0.00 0.00 72.50 68.95 1bzf s THR 112 CO 0.00 -0.16 0.73 -0.76 -0.69 0.00 0.00 174.62 173.73 1bzf s LEU 113 N 1.63 5.42 -0.48 4.42 1.43 -1.08 -1.19 118.68 128.83 1bzf s LEU 113 Ca 0.04 -1.50 -0.15 0.00 -1.03 0.00 0.00 54.13 51.49 1bzf s LEU 113 Cb -0.18 -2.30 0.08 0.00 0.03 0.00 0.00 46.19 43.81 1bzf s LEU 113 CO 0.08 -1.10 0.40 -0.76 0.23 0.00 0.00 176.35 175.20 1bzf s LEU 114 N 2.62 5.67 0.00 1.79 1.43 -0.03 -2.39 118.68 127.76 1bzf s LEU 114 Ca 0.13 -1.41 0.04 0.00 -1.03 0.00 0.00 54.13 51.85 1bzf s LEU 114 Cb -0.23 -2.17 -0.03 0.00 0.03 0.00 0.00 46.19 43.79 1bzf s LEU 114 CO 0.05 -0.67 -0.10 0.54 0.23 0.00 0.00 176.35 176.40 1bzf s VAL 115 N 1.61 3.40 -0.41 -1.59 0.11 -1.08 -2.87 120.40 119.58 1bzf s VAL 115 Ca 0.04 -0.84 -0.02 0.00 -2.93 0.00 0.00 61.98 58.23 1bzf s VAL 115 Cb -0.25 -2.45 0.11 0.00 -1.53 0.00 0.00 36.38 32.26 1bzf s VAL 115 CO 0.06 0.42 0.20 -0.89 -3.33 0.00 0.00 175.10 171.55 1bzf s THR 116 N -0.94 3.23 0.21 5.04 2.01 -1.15 -1.58 115.64 122.47 1bzf s THR 116 Ca 0.16 -2.08 -0.24 0.00 0.31 0.00 0.00 61.69 59.84 1bzf s THR 116 Cb -0.11 -3.23 -0.08 0.00 0.01 0.00 0.00 72.50 69.09 1bzf s THR 116 CO 0.06 -0.69 0.80 -0.13 -0.69 0.00 0.00 174.62 173.97 1bzf s ARG 117 N 1.12 4.49 -0.10 4.92 0.52 -1.12 -2.53 118.95 126.25 1bzf s ARG 117 Ca 0.08 1.12 0.03 0.00 -0.52 0.00 0.00 55.73 56.44 1bzf s ARG 117 Cb -0.23 -3.07 -0.01 0.00 0.52 0.00 0.00 34.95 32.17 1bzf s ARG 117 CO -0.04 0.47 -0.19 -0.51 0.02 0.00 0.00 175.30 175.04 1bzf s LEU 118 N -1.56 2.40 0.36 2.53 1.02 -1.22 -1.93 118.68 120.28 1bzf s LEU 118 Ca 0.41 -0.43 0.07 0.00 0.02 0.00 0.00 54.13 54.19 1bzf s LEU 118 Cb -0.21 -1.50 0.70 0.00 0.02 0.00 0.00 46.19 45.20 1bzf s LEU 118 CO 0.25 0.19 1.91 0.00 0.02 0.00 0.00 176.35 178.71 1bzf h ALA 119 N 6.51 1.45 -2.34 4.21 0.00 0.47 -3.28 119.26 126.28 1bzf h ALA 119 Ca -0.26 -0.19 -0.55 0.00 0.00 0.00 0.00 54.91 53.92 1bzf h ALA 119 Cb 1.21 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1bzf h ALA 119 CO 0.51 0.39 0.74 0.20 0.00 0.00 0.00 179.25 181.09 1bzf s GLY 120 N -3.91 2.03 0.32 0.00 0.00 -0.19 -4.89 107.32 100.67 1bzf s GLY 120 Ca -0.07 0.72 -0.27 0.00 0.00 0.00 0.00 44.72 45.11 1bzf s GLY 120 CO 0.75 2.31 1.02 -1.35 0.00 0.00 0.00 173.10 175.83 1bzf s SER 121 N 1.60 7.19 -0.22 1.64 1.04 -1.26 -4.69 113.70 119.00 1bzf s SER 121 Ca 0.59 2.04 -0.03 0.00 0.48 0.00 0.00 55.95 59.03 1bzf s SER 121 Cb -0.27 -2.60 0.11 0.00 0.10 0.00 0.00 66.02 63.36 1bzf s SER 121 CO 0.24 -0.18 0.29 -0.36 0.98 0.00 0.00 173.24 174.21 1bzf s PHE 122 N -1.43 -0.51 0.48 5.02 0.08 -1.26 -5.05 117.98 115.31 1bzf s PHE 122 Ca 0.49 0.45 -0.17 0.00 0.12 0.00 0.00 56.93 57.82 1bzf s PHE 122 Cb -0.25 -0.21 -0.09 0.00 -0.57 0.00 0.00 43.02 41.91 1bzf s PHE 122 CO 0.31 -0.67 0.96 -2.00 -0.10 0.00 0.00 175.22 173.73 1bzf s GLU 123 N 2.42 4.02 0.00 0.44 2.12 -1.26 -4.75 118.70 121.69 1bzf s GLU 123 Ca 0.09 0.98 0.00 0.00 0.36 0.00 0.00 54.97 56.40 1bzf s GLU 123 Cb -0.15 -2.16 0.00 0.00 0.26 0.00 0.00 34.13 32.07 1bzf s GLU 123 CO -0.15 -0.19 0.00 0.41 -0.54 0.00 0.00 175.26 174.79 1bzf n GLY 124 N -1.30 3.63 1.33 -1.50 0.00 -1.26 -4.95 105.19 101.13 1bzf n GLY 124 Ca 0.06 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.86 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 0.09 -4.79 1.61 8.00 -1.26 -5.06 116.55 115.15 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 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.04 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 -1.71 4.50 0.28 -3.53 2.01 -1.25 -5.07 115.64 110.86 1bzf s THR 126 Ca 0.00 1.54 0.11 0.00 0.31 0.00 0.00 61.69 63.65 1bzf s THR 126 Cb 0.00 -4.06 -0.05 0.00 0.01 0.00 0.00 72.50 68.40 1bzf s THR 126 CO 0.00 0.53 -0.09 -0.54 -0.69 0.00 0.00 174.62 173.83 1bzf s LYS 127 N -1.10 1.99 0.42 4.92 1.02 -1.26 -3.34 119.74 122.38 1bzf s LYS 127 Ca 0.34 -1.62 -0.23 0.00 0.02 0.00 0.00 55.97 54.48 1bzf s LYS 127 Cb -0.22 -1.95 -0.09 0.00 -0.52 0.00 0.00 37.83 35.04 1bzf s LYS 127 CO 0.24 0.32 1.02 1.41 -0.92 0.00 0.00 175.35 177.41 1bzf s MET 128 N -3.61 4.13 0.86 1.68 1.75 -1.23 -4.78 119.30 118.10 1bzf s MET 128 Ca 0.31 1.38 -0.11 0.00 -1.25 0.00 0.00 55.69 56.02 1bzf s MET 128 Cb -0.05 -2.39 0.10 0.00 2.84 0.00 0.00 34.83 35.34 1bzf s MET 128 CO 0.18 -0.15 1.09 0.96 -0.65 0.00 0.00 175.02 176.45 1bzf s ILE 129 N -1.84 2.87 -0.71 10.11 -4.36 -1.26 -4.95 121.20 121.06 1bzf s ILE 129 Ca 0.60 0.28 -0.27 0.00 -0.26 0.00 0.00 60.65 61.00 1bzf s ILE 129 Cb -0.18 -2.80 0.03 0.00 1.25 0.00 0.00 42.46 40.77 1bzf s ILE 129 CO 0.22 -0.37 1.25 -2.16 0.24 0.00 0.00 174.94 174.13 1bzf s PRO 130 N -4.95 3.24 0.32 0.37 0.04 -1.26 -5.03 135.00 127.73 1bzf s PRO 130 Ca 0.63 -0.18 -0.09 0.00 0.04 0.00 0.00 61.00 61.39 1bzf s PRO 130 Cb -0.17 -4.15 -0.06 0.00 0.04 0.00 0.00 34.50 30.15 1bzf s PRO 130 CO 0.56 -2.06 0.64 -0.51 0.04 0.00 0.00 177.00 175.68 1bzf s LEU 131 N 5.54 4.01 -0.98 -3.56 1.43 -1.26 -5.01 118.68 118.85 1bzf s LEU 131 Ca 0.36 0.96 -0.19 0.00 -1.03 0.00 0.00 54.13 54.23 1bzf s LEU 131 Cb -0.08 -3.78 0.13 0.00 0.03 0.00 0.00 46.19 42.48 1bzf s LEU 131 CO 0.17 -0.23 1.22 0.21 0.23 0.00 0.00 176.35 177.94 1bzf s ASN 132 N -2.87 6.68 0.26 2.29 3.84 -1.26 -4.80 114.94 119.07 1bzf s ASN 132 Ca 0.48 -2.11 0.25 0.00 0.21 0.00 0.00 52.86 51.70 1bzf s ASN 132 Cb -0.11 -2.42 0.92 0.00 -0.55 0.00 0.00 41.25 39.10 1bzf s ASN 132 CO 0.27 -1.08 1.75 -0.50 -2.79 0.00 0.00 177.10 174.75 1bzf h TRP 133 N 8.70 0.00 0.00 0.43 4.06 -1.98 -2.97 115.95 124.20 1bzf h TRP 133 Ca 0.19 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.14 1bzf h TRP 133 Cb 1.00 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.16 1bzf h TRP 133 CO 1.18 0.00 0.00 -3.47 -3.56 0.00 0.00 178.44 172.59 1bzf n ASP 134 N -2.32 0.00 -1.34 -3.49 2.03 -1.26 -2.71 116.55 107.46 1bzf n ASP 134 Ca 0.03 -1.39 0.04 0.00 0.52 0.00 0.00 54.79 54.00 1bzf n ASP 134 Cb 0.32 0.00 0.07 0.00 -0.72 0.00 0.00 41.12 40.79 1bzf n ASP 134 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1bzf n ASP 135 N -0.51 1.28 -3.31 1.67 2.03 -1.12 -5.08 116.55 111.50 1bzf n ASP 135 Ca 0.00 -2.53 -0.19 0.00 0.52 0.00 0.00 54.79 52.59 1bzf n ASP 135 Cb 0.00 -0.37 -0.08 0.00 -0.72 0.00 0.00 41.12 39.96 1bzf n ASP 135 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 1bzf s PHE 136 N -1.07 1.74 -0.15 -0.67 0.08 -1.10 -4.28 117.98 112.52 1bzf s PHE 136 Ca 0.35 -1.65 -0.11 0.00 0.12 0.00 0.00 56.93 55.64 1bzf s PHE 136 Cb 0.38 -0.68 0.05 0.00 -0.57 0.00 0.00 43.02 42.20 1bzf s PHE 136 CO -0.13 -0.90 0.39 0.99 -0.10 0.00 0.00 175.22 175.46 1bzf s THR 137 N -3.38 -0.02 -0.25 0.64 2.01 -0.99 -4.90 115.64 108.75 1bzf s THR 137 Ca 0.40 0.06 -0.29 0.00 0.31 0.00 0.00 61.69 62.17 1bzf s THR 137 Cb 0.02 -0.56 0.01 0.00 0.01 0.00 0.00 72.50 71.97 1bzf s THR 137 CO 0.28 0.02 1.12 -0.75 -0.69 0.00 0.00 174.62 174.60 1bzf s LYS 138 N 0.88 4.17 -0.15 4.92 2.20 -1.26 -1.20 119.74 129.30 1bzf s LYS 138 Ca -0.05 1.33 0.09 0.00 -0.36 0.00 0.00 55.97 56.98 1bzf s LYS 138 Cb -0.06 -3.71 -0.23 0.00 -1.51 0.00 0.00 37.83 32.31 1bzf s LYS 138 CO -0.07 -0.77 0.25 1.33 -0.36 0.00 0.00 175.35 175.74 1bzf n VAL 139 N 5.57 1.55 -3.89 4.02 0.24 -0.83 -4.99 118.33 120.00 1bzf n VAL 139 Ca 0.13 -0.75 -0.09 0.00 -2.04 0.00 0.00 64.34 61.59 1bzf n VAL 139 Cb 0.46 -1.04 -0.01 0.00 -1.47 0.00 0.00 33.84 31.78 1bzf n VAL 139 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1bzf s SER 140 N -6.13 -0.01 -0.30 -1.34 0.01 -1.23 -5.09 113.70 99.62 1bzf s SER 140 Ca -0.15 -0.96 -0.12 0.00 1.31 0.00 0.00 55.95 56.03 1bzf s SER 140 Cb 0.07 0.75 0.12 0.00 0.21 0.00 0.00 66.02 67.17 1bzf s SER 140 CO 0.78 -1.44 0.72 -0.55 0.41 0.00 0.00 173.24 173.15 1bzf s SER 141 N -3.03 -1.00 -0.47 2.44 0.15 -1.26 -2.49 113.70 108.04 1bzf s SER 141 Ca 0.17 1.43 -0.18 0.00 0.70 0.00 0.00 55.95 58.07 1bzf s SER 141 Cb -0.04 1.97 0.05 0.00 -1.71 0.00 0.00 66.02 66.28 1bzf s SER 141 CO 0.10 -0.21 0.53 -0.60 1.20 0.00 0.00 173.24 174.27 1bzf s ARG 142 N 2.49 3.10 0.23 5.44 6.06 -0.92 -4.92 118.95 130.43 1bzf s ARG 142 Ca -0.07 -0.88 -0.11 0.00 -2.50 0.00 0.00 55.73 52.18 1bzf s ARG 142 Cb -0.09 -4.05 -0.07 0.00 0.06 0.00 0.00 34.95 30.79 1bzf s ARG 142 CO -0.19 -1.06 0.57 0.99 -2.50 0.00 0.00 175.30 173.11 1bzf s THR 143 N 2.34 4.89 -0.21 4.11 2.01 -1.26 -0.98 115.64 126.55 1bzf s THR 143 Ca 0.13 0.57 -0.11 0.00 0.31 0.00 0.00 61.69 62.58 1bzf s THR 143 Cb -0.19 -3.63 0.07 0.00 0.01 0.00 0.00 72.50 68.76 1bzf s THR 143 CO 0.12 -0.06 0.51 0.54 -0.69 0.00 0.00 174.62 175.04 1bzf s VAL 144 N -1.81 -0.05 -0.24 3.82 0.11 -1.11 -4.98 120.40 116.15 1bzf s VAL 144 Ca 0.47 0.06 -0.06 0.00 -2.93 0.00 0.00 61.98 59.52 1bzf s VAL 144 Cb -0.11 -0.74 -0.02 0.00 -1.53 0.00 0.00 36.38 33.97 1bzf s VAL 144 CO 0.20 0.03 0.04 -0.70 -3.33 0.00 0.00 175.10 171.34 1bzf s GLU 145 N 1.54 3.59 0.00 1.54 2.12 -1.26 -3.06 118.70 123.17 1bzf s GLU 145 Ca -0.09 -0.51 0.00 0.00 0.36 0.00 0.00 54.97 54.72 1bzf s GLU 145 Cb -0.07 -3.22 0.00 0.00 0.26 0.00 0.00 34.13 31.10 1bzf s GLU 145 CO -0.15 -0.16 0.00 -3.47 -0.54 0.00 0.00 175.26 170.94 1bzf n ASP 146 N 4.78 0.00 -0.06 -1.70 2.03 -1.24 -4.97 116.55 115.40 1bzf n ASP 146 Ca -0.17 -0.60 -0.14 0.00 0.52 0.00 0.00 54.79 54.41 1bzf n ASP 146 Cb 0.51 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.89 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 -0.59 1.28 -3.22 5.18 1.35 -1.99 -3.43 112.91 111.49 1bzf h THR 147 Ca 0.00 -1.77 -0.66 0.00 -0.55 0.00 0.00 66.41 63.42 1bzf h THR 147 Cb 0.00 1.69 -0.15 0.00 -1.73 0.00 0.00 68.15 67.97 1bzf h THR 147 CO 0.00 0.57 -0.60 0.21 -0.25 0.00 0.00 175.52 175.46 1bzf s ASN 148 N -6.96 5.42 0.26 5.36 3.84 -1.26 -5.00 114.94 116.60 1bzf s ASN 148 Ca -0.10 0.16 -0.02 0.00 0.21 0.00 0.00 52.86 53.11 1bzf s ASN 148 Cb 0.10 -1.66 0.58 0.00 -0.55 0.00 0.00 41.25 39.72 1bzf s ASN 148 CO 0.88 0.33 1.68 -0.65 -2.79 0.00 0.00 177.10 176.56 1bzf h PRO 149 N 5.50 0.27 -0.10 0.43 0.10 -2.00 0.36 132.00 136.57 1bzf h PRO 149 Ca -0.48 -0.02 -0.02 0.00 0.10 0.00 0.00 66.00 65.58 1bzf h PRO 149 Cb 1.19 -0.06 -0.01 0.00 0.10 0.00 0.00 31.00 32.22 1bzf h PRO 149 CO 0.58 0.18 -0.05 0.00 0.10 0.00 0.00 178.00 178.81 1bzf h ALA 150 N 1.68 1.74 -0.02 -0.75 0.00 -1.95 -0.93 119.26 119.02 1bzf h ALA 150 Ca 0.48 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.28 1bzf h ALA 150 Cb 0.88 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 1bzf h ALA 150 CO -0.55 0.20 0.00 1.28 0.00 0.00 0.00 179.25 180.18 1bzf n LEU 151 N -4.40 1.34 -4.84 0.00 4.77 0.13 -1.02 117.00 112.97 1bzf n LEU 151 Ca -0.01 -0.67 -0.37 0.00 -0.03 0.00 0.00 56.01 54.93 1bzf n LEU 151 Cb 0.18 -0.51 -0.06 0.00 -2.33 0.00 0.00 43.42 40.70 1bzf n LEU 151 CO 0.36 0.28 0.15 -0.89 -1.33 0.00 0.00 177.39 175.96 1bzf s THR 152 N -1.00 4.97 0.23 -5.08 2.01 -0.36 -3.70 115.64 112.71 1bzf s THR 152 Ca 0.02 0.81 -0.19 0.00 0.31 0.00 0.00 61.69 62.64 1bzf s THR 152 Cb 0.02 -3.73 0.03 0.00 0.01 0.00 0.00 72.50 68.82 1bzf s THR 152 CO 0.01 0.45 0.59 -1.38 -0.69 0.00 0.00 174.62 173.59 1bzf s HIS 153 N -1.23 -0.12 -0.02 4.92 -3.43 -1.17 0.97 115.29 115.22 1bzf s HIS 153 Ca 0.29 -0.25 0.00 0.00 -0.80 0.00 0.00 55.06 54.30 1bzf s HIS 153 Cb -0.16 0.48 0.02 0.00 -1.43 0.00 0.00 32.58 31.49 1bzf s HIS 153 CO 0.16 -1.02 -0.00 0.99 -2.00 0.00 0.00 174.74 172.87 1bzf s THR 154 N -3.90 0.14 -0.86 -5.38 2.01 -0.81 -2.75 115.64 104.09 1bzf s THR 154 Ca 0.11 0.04 -0.20 0.00 0.31 0.00 0.00 61.69 61.95 1bzf s THR 154 Cb -0.03 -0.20 0.10 0.00 0.01 0.00 0.00 72.50 72.39 1bzf s THR 154 CO 0.01 0.10 1.12 -0.31 -0.69 0.00 0.00 174.62 174.85 1bzf s TYR 155 N 0.65 2.91 0.28 4.92 2.02 -0.15 -2.81 117.35 125.17 1bzf s TYR 155 Ca -0.06 -1.07 -0.29 0.00 -0.37 0.00 0.00 57.07 55.27 1bzf s TYR 155 Cb -0.09 -4.34 -0.10 0.00 -0.40 0.00 0.00 41.96 37.04 1bzf s TYR 155 CO -0.01 -1.59 1.11 -1.21 -1.57 0.00 0.00 175.55 172.27 1bzf s GLU 156 N 3.38 4.63 -0.25 -0.62 2.02 -0.61 -2.17 118.70 125.07 1bzf s GLU 156 Ca 0.31 1.82 -0.00 0.00 0.02 0.00 0.00 54.97 57.12 1bzf s GLU 156 Cb -0.08 -3.19 0.07 0.00 0.10 0.00 0.00 34.13 31.04 1bzf s GLU 156 CO -0.04 0.19 0.01 0.08 0.02 0.00 0.00 175.26 175.53 1bzf s VAL 157 N -1.13 1.19 0.39 2.63 1.01 -1.04 -2.64 120.40 120.81 1bzf s VAL 157 Ca 0.45 -1.20 0.08 0.00 0.00 0.00 0.00 61.98 61.31 1bzf s VAL 157 Cb -0.32 -1.65 -0.02 0.00 0.00 0.00 0.00 36.38 34.38 1bzf s VAL 157 CO 0.41 -0.31 0.35 0.26 0.00 0.00 0.00 175.10 175.81 1bzf s TRP 158 N 1.52 2.76 -0.05 5.22 0.52 -1.01 -1.96 118.94 125.94 1bzf s TRP 158 Ca 0.01 -0.44 -0.07 0.00 0.02 0.00 0.00 56.10 55.62 1bzf s TRP 158 Cb -0.18 -2.06 0.01 0.00 -1.15 0.00 0.00 33.47 30.10 1bzf s TRP 158 CO -0.11 -0.03 0.18 -0.65 0.02 0.00 0.00 176.95 176.36 1bzf s GLN 159 N -4.09 0.29 -0.08 4.98 -0.21 -0.34 -2.65 119.66 117.56 1bzf s GLN 159 Ca 0.46 0.11 -0.30 0.00 0.02 0.00 0.00 55.36 55.65 1bzf s GLN 159 Cb -0.04 0.13 -0.04 0.00 1.00 0.00 0.00 33.01 34.06 1bzf s GLN 159 CO 0.27 -0.05 1.40 0.21 -2.12 0.00 0.00 175.29 175.00 1bzf s LYS 160 N -0.25 4.24 -0.03 2.91 2.36 -0.72 -2.34 119.74 125.92 1bzf s LYS 160 Ca -0.03 1.89 -0.02 0.00 -2.55 0.00 0.00 55.97 55.26 1bzf s LYS 160 Cb -0.03 -3.74 0.02 0.00 -1.05 0.00 0.00 37.83 33.02 1bzf s LYS 160 CO 0.01 -0.68 0.06 0.15 1.55 0.00 0.00 175.35 176.44 1bzf s LYS 161 N 3.19 0.04 0.00 4.03 1.02 -1.26 -5.01 119.74 121.76 1bzf s LYS 161 Ca 0.62 0.14 0.27 0.00 0.02 0.00 0.00 55.97 57.03 1bzf s LYS 161 Cb -0.28 -0.07 1.61 0.00 -0.52 0.00 0.00 37.83 38.58 1bzf s LYS 161 CO 0.23 -0.07 1.96 0.00 -0.92 0.00 0.00 175.35 176.55