#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 0.39 0.21 2.41 0.00 -1.13 -2.89 121.76 120.75 1bzf s ALA 2 Ca 0.00 0.09 -0.04 0.00 0.00 0.00 0.00 51.96 52.02 1bzf s ALA 2 Cb 0.00 -0.52 -0.05 0.00 0.00 0.00 0.00 23.12 22.55 1bzf s ALA 2 CO 0.00 -0.30 0.44 -0.06 0.00 0.00 0.00 175.76 175.84 1bzf s PHE 3 N 1.61 3.47 -0.30 0.00 0.40 -1.16 0.46 117.98 122.47 1bzf s PHE 3 Ca -0.02 0.52 -0.04 0.00 -0.60 0.00 0.00 56.93 56.80 1bzf s PHE 3 Cb -0.13 -1.99 0.19 0.00 0.51 0.00 0.00 43.02 41.60 1bzf s PHE 3 CO -0.03 0.34 0.71 -1.17 0.70 0.00 0.00 175.22 175.77 1bzf s LEU 4 N -3.13 -1.17 0.00 -0.37 2.96 -0.90 -1.69 118.68 114.39 1bzf s LEU 4 Ca 0.41 0.74 -0.07 0.00 -0.22 0.00 0.00 54.13 54.99 1bzf s LEU 4 Cb -0.11 1.98 0.00 0.00 0.50 0.00 0.00 46.19 48.56 1bzf s LEU 4 CO 0.27 -0.22 0.14 -1.66 -1.32 0.00 0.00 176.35 173.56 1bzf s TRP 5 N 2.88 0.04 -0.31 5.38 -2.14 -1.13 -4.40 118.94 119.26 1bzf s TRP 5 Ca 0.16 -0.14 -0.14 0.00 2.66 0.00 0.00 56.10 58.64 1bzf s TRP 5 Cb -0.14 -0.05 -0.03 0.00 -3.10 0.00 0.00 33.47 30.16 1bzf s TRP 5 CO -0.19 -0.29 0.32 0.00 -2.66 0.00 0.00 176.95 174.13 1bzf s ALA 6 N -1.42 3.52 0.04 2.67 0.00 -1.26 -2.94 121.76 122.37 1bzf s ALA 6 Ca -0.15 -1.12 0.01 0.00 0.00 0.00 0.00 51.96 50.70 1bzf s ALA 6 Cb -0.07 -2.71 -0.03 0.00 0.00 0.00 0.00 23.12 20.31 1bzf s ALA 6 CO 0.02 -0.86 -0.05 1.14 0.00 0.00 0.00 175.76 176.01 1bzf s GLN 7 N 1.94 0.48 0.43 0.00 -2.07 -1.11 -4.34 119.66 114.99 1bzf s GLN 7 Ca 0.11 -0.83 0.08 0.00 -1.82 0.00 0.00 55.36 52.89 1bzf s GLN 7 Cb -0.16 -0.01 0.00 0.00 -1.09 0.00 0.00 33.01 31.74 1bzf s GLN 7 CO 0.11 -0.03 0.48 0.16 -1.32 0.00 0.00 175.29 174.69 1bzf s ASP 8 N -1.91 5.25 0.48 12.60 1.47 -0.97 -3.42 116.67 130.17 1bzf s ASP 8 Ca -0.07 -0.66 0.32 0.00 1.18 0.00 0.00 52.55 53.32 1bzf s ASP 8 Cb -0.05 -0.50 1.70 0.00 -0.34 0.00 0.00 42.92 43.74 1bzf s ASP 8 CO -0.03 -0.76 1.99 0.08 0.68 0.00 0.00 175.17 177.14 1bzf h ARG 9 N 0.82 0.00 -0.36 2.11 0.11 -1.84 -1.44 114.38 113.77 1bzf h ARG 9 Ca -0.40 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.68 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 0.52 0.00 0.00 -0.25 0.10 0.00 0.00 179.97 180.34 1bzf n ASP 10 N -2.67 0.36 -3.04 0.08 9.92 -1.26 -4.81 116.55 115.15 1bzf n ASP 10 Ca -0.02 -1.69 -0.21 0.00 -0.53 0.00 0.00 54.79 52.35 1bzf n ASP 10 Cb 0.09 -0.18 0.06 0.00 -0.64 0.00 0.00 41.12 40.44 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 0.23 -0.38 3.69 0.44 0.00 -0.54 -5.00 105.19 103.62 1bzf n GLY 11 Ca 0.00 0.10 -0.23 0.00 0.00 0.00 0.00 46.02 45.89 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 -6.35 3.18 0.00 0.99 2.96 -1.23 -3.46 118.68 114.76 1bzf s LEU 12 Ca 0.43 -0.80 0.00 0.00 -0.22 0.00 0.00 54.13 53.54 1bzf s LEU 12 Cb -0.19 -1.63 0.00 0.00 0.50 0.00 0.00 46.19 44.87 1bzf s LEU 12 CO 0.53 -0.22 0.00 2.30 -1.32 0.00 0.00 176.35 177.64 1bzf n ILE 13 N -1.05 0.00 -3.06 6.68 -5.35 -1.16 -2.29 119.36 113.14 1bzf n ILE 13 Ca -0.04 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.44 1bzf n ILE 13 Cb 0.61 -0.09 0.00 0.00 -1.74 0.00 0.00 39.64 38.42 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 0.76 1.63 3.32 3.28 0.00 -1.26 -4.69 105.19 108.23 1bzf n GLY 14 Ca 0.00 -0.86 0.03 0.00 0.00 0.00 0.00 46.02 45.19 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 -1.06 0.24 -1.70 1.61 2.20 0.10 -3.99 119.74 117.13 1bzf s LYS 15 Ca 0.00 0.57 -0.02 0.00 -0.36 0.00 0.00 55.97 56.16 1bzf s LYS 15 Cb 0.00 0.34 0.00 0.00 -1.51 0.00 0.00 37.83 36.66 1bzf s LYS 15 CO 0.00 -0.11 0.27 -0.25 -0.36 0.00 0.00 175.35 174.89 1bzf n ASP 16 N 4.99 -6.06 0.00 1.43 8.00 -1.26 -2.92 116.55 120.74 1bzf n ASP 16 Ca -0.08 -0.14 0.00 0.00 0.71 0.00 0.00 54.79 55.28 1bzf n ASP 16 Cb 0.53 -4.97 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 -1.24 2.15 3.79 0.44 0.00 -1.26 -4.97 105.19 104.09 1bzf n GLY 17 Ca -0.19 -0.37 -0.29 0.00 0.00 0.00 0.00 46.02 45.16 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 2.02 0.45 1.61 -3.43 -1.15 -4.97 115.29 109.83 1bzf s HIS 18 Ca 0.00 0.68 -0.10 0.00 -0.80 0.00 0.00 55.06 54.84 1bzf s HIS 18 Cb 0.00 -3.55 -0.06 0.00 -1.43 0.00 0.00 32.58 27.54 1bzf s HIS 18 CO 0.00 -2.64 0.82 -0.51 -2.00 0.00 0.00 174.74 170.41 1bzf s LEU 19 N -6.13 3.71 0.23 5.38 1.43 -1.26 -0.73 118.68 121.31 1bzf s LEU 19 Ca 0.67 1.16 0.12 0.00 -1.03 0.00 0.00 54.13 55.05 1bzf s LEU 19 Cb -0.12 -4.08 -0.01 0.00 0.03 0.00 0.00 46.19 42.01 1bzf s LEU 19 CO 0.53 -0.50 1.40 1.55 0.23 0.00 0.00 176.35 179.56 1bzf h PRO 20 N 0.85 0.00 -6.12 1.29 0.13 -1.84 -3.45 132.00 122.86 1bzf h PRO 20 Ca -0.47 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.15 1bzf h PRO 20 Cb 1.19 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.27 1bzf h PRO 20 CO 0.63 0.66 -0.45 1.67 -0.23 0.00 0.00 178.00 180.28 1bzf s TRP 21 N -2.89 2.74 -0.35 1.56 -2.14 -1.26 -5.05 118.94 111.55 1bzf s TRP 21 Ca 0.03 -0.44 0.01 0.00 2.66 0.00 0.00 56.10 58.37 1bzf s TRP 21 Cb 0.08 -1.94 0.10 0.00 -3.10 0.00 0.00 33.47 28.62 1bzf s TRP 21 CO 0.77 0.10 0.08 -1.58 -2.66 0.00 0.00 176.95 173.66 1bzf s HIS 22 N -2.44 3.65 -0.68 1.66 2.46 -1.26 -5.02 115.29 113.65 1bzf s HIS 22 Ca 0.43 -2.71 0.05 0.00 0.47 0.00 0.00 55.06 53.30 1bzf s HIS 22 Cb -0.03 -2.90 0.17 0.00 -0.13 0.00 0.00 32.58 29.69 1bzf s HIS 22 CO 0.26 -0.94 0.48 -1.17 -2.47 0.00 0.00 174.74 170.89 1bzf s LEU 23 N 1.01 4.59 0.36 8.88 2.96 -1.26 -4.94 118.68 130.27 1bzf s LEU 23 Ca 0.08 -3.79 0.16 0.00 -0.22 0.00 0.00 54.13 50.36 1bzf s LEU 23 Cb -0.20 -1.56 1.10 0.00 0.50 0.00 0.00 46.19 46.03 1bzf s LEU 23 CO -0.06 -0.09 1.68 -0.65 -1.32 0.00 0.00 176.35 175.91 1bzf h PRO 24 N 5.43 0.33 -0.74 0.98 0.10 -1.99 0.29 132.00 136.41 1bzf h PRO 24 Ca 0.15 -0.02 -0.03 0.00 0.10 0.00 0.00 66.00 66.20 1bzf h PRO 24 Cb 0.77 -0.08 -0.03 0.00 0.10 0.00 0.00 31.00 31.76 1bzf h PRO 24 CO 0.69 0.22 0.35 0.22 0.10 0.00 0.00 178.00 179.58 1bzf h ASP 25 N 0.34 0.97 -0.36 -2.05 1.82 -1.99 -1.98 116.42 113.17 1bzf h ASP 25 Ca 0.71 -0.14 -0.08 0.00 -0.39 0.00 0.00 57.03 57.13 1bzf h ASP 25 Cb 1.69 -0.25 -0.02 0.00 0.68 0.00 0.00 39.33 41.44 1bzf h ASP 25 CO -0.52 0.84 -0.06 -0.78 -1.61 0.00 0.00 179.24 177.11 1bzf h ASP 26 N 1.04 0.75 0.68 2.28 3.58 -0.86 -1.57 116.42 122.32 1bzf h ASP 26 Ca 0.25 -0.20 -0.03 0.00 0.42 0.00 0.00 57.03 57.47 1bzf h ASP 26 Cb 0.13 -0.20 -0.00 0.00 1.72 0.00 0.00 39.33 40.98 1bzf h ASP 26 CO -0.03 0.86 -0.13 -0.07 -2.88 0.00 0.00 179.24 176.98 1bzf h LEU 27 N 0.71 0.00 0.00 2.28 3.38 -0.98 -2.47 115.31 118.23 1bzf h LEU 27 Ca 0.13 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.89 1bzf h LEU 27 Cb 0.52 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.24 1bzf h LEU 27 CO 0.03 0.13 -1.28 0.45 0.09 0.00 0.00 178.44 177.86 1bzf h HIS 28 N 0.00 0.00 0.00 1.13 3.86 -0.65 -3.30 115.15 116.18 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 0.51 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.97 1bzf h HIS 28 CO 0.00 0.82 -0.42 -0.92 0.86 0.00 0.00 177.93 178.27 1bzf h TYR 29 N 0.00 0.00 -0.08 2.45 3.20 -0.89 -3.09 116.97 118.56 1bzf h TYR 29 Ca -0.14 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.72 1bzf h TYR 29 Cb 1.75 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 40.02 1bzf h TYR 29 CO 0.00 0.42 0.03 0.35 -1.64 0.00 0.00 178.16 177.31 1bzf h PHE 30 N 0.00 0.12 0.00 -3.82 3.57 -1.54 -0.56 116.94 114.72 1bzf h PHE 30 Ca -0.00 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.45 1bzf h PHE 30 Cb 1.08 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.78 1bzf h PHE 30 CO 0.00 0.27 -0.16 -0.09 -2.23 0.00 0.00 178.31 176.10 1bzf h ARG 31 N -0.06 0.00 0.00 1.11 2.43 -1.68 -1.87 114.38 114.31 1bzf h ARG 31 Ca 0.03 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.08 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 -0.00 0.16 -0.55 0.00 -1.51 0.00 0.00 179.97 178.07 1bzf h ALA 32 N 1.84 0.67 -0.78 2.80 0.00 -1.35 -3.15 119.26 119.29 1bzf h ALA 32 Ca -0.00 -0.50 -0.51 0.00 0.00 0.00 0.00 54.91 53.90 1bzf h ALA 32 Cb 0.41 -0.09 -0.29 0.00 0.00 0.00 0.00 17.79 17.82 1bzf h ALA 32 CO 0.02 0.68 0.12 1.04 0.00 0.00 0.00 179.25 181.11 1bzf n GLN 33 N -3.27 2.74 0.00 0.00 1.13 -0.26 -4.45 117.38 113.26 1bzf n GLN 33 Ca 0.01 -3.51 0.00 0.00 -1.94 0.00 0.00 57.00 51.56 1bzf n GLN 33 Cb 0.73 -2.17 0.00 0.00 0.11 0.00 0.00 30.24 28.91 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 -0.93 0.00 -2.29 5.09 -2.24 -1.03 -4.98 114.28 107.90 1bzf n THR 34 Ca 0.50 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.87 1bzf n THR 34 Cb 0.94 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 69.14 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 -0.93 3.51 -0.61 2.28 -7.23 -1.19 -2.89 120.40 113.34 1bzf s VAL 35 Ca 0.00 1.17 -0.02 0.00 -1.81 0.00 0.00 61.98 61.32 1bzf s VAL 35 Cb 0.00 -3.75 0.00 0.00 0.56 0.00 0.00 36.38 33.19 1bzf s VAL 35 CO 0.00 0.14 0.22 0.61 -0.31 0.00 0.00 175.10 175.76 1bzf n GLY 36 N 2.79 0.20 3.51 2.32 0.00 -1.22 -5.02 105.19 107.78 1bzf n GLY 36 Ca 0.08 -0.44 -0.10 0.00 0.00 0.00 0.00 46.02 45.56 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 -4.93 1.37 -0.30 1.61 1.02 -1.14 -4.38 119.74 112.99 1bzf s LYS 37 Ca 0.11 -0.84 -0.19 0.00 0.02 0.00 0.00 55.97 55.07 1bzf s LYS 37 Cb -0.05 0.53 -0.01 0.00 -0.52 0.00 0.00 37.83 37.77 1bzf s LYS 37 CO 0.13 -0.58 0.56 0.42 -0.92 0.00 0.00 175.35 174.96 1bzf s ILE 38 N -3.86 5.00 -0.44 2.17 1.01 -0.67 -3.00 121.20 121.40 1bzf s ILE 38 Ca 0.08 0.73 -0.17 0.00 0.00 0.00 0.00 60.65 61.30 1bzf s ILE 38 Cb -0.01 -3.93 0.04 0.00 0.01 0.00 0.00 42.46 38.56 1bzf s ILE 38 CO -0.04 -0.09 0.43 -0.32 0.00 0.00 0.00 174.94 174.93 1bzf s MET 39 N 2.46 3.05 -0.26 2.79 1.75 -0.01 -2.35 119.30 126.73 1bzf s MET 39 Ca 0.22 -0.95 -0.17 0.00 -1.25 0.00 0.00 55.69 53.55 1bzf s MET 39 Cb -0.15 -4.02 -0.03 0.00 2.84 0.00 0.00 34.83 33.46 1bzf s MET 39 CO 0.11 -0.93 0.46 0.08 -0.65 0.00 0.00 175.02 174.10 1bzf s VAL 40 N 2.03 5.11 0.15 10.11 1.01 -1.03 -1.78 120.40 136.00 1bzf s VAL 40 Ca 0.10 0.76 0.03 0.00 0.00 0.00 0.00 61.98 62.86 1bzf s VAL 40 Cb -0.19 -3.78 -0.05 0.00 0.00 0.00 0.00 36.38 32.37 1bzf s VAL 40 CO 0.11 0.12 -0.05 0.68 0.00 0.00 0.00 175.10 175.95 1bzf s VAL 41 N 2.20 0.90 0.00 2.92 -7.23 -0.64 -3.06 120.40 115.50 1bzf s VAL 41 Ca 0.19 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.35 1bzf s VAL 41 Cb -0.16 -1.93 0.00 0.00 0.56 0.00 0.00 36.38 34.85 1bzf s VAL 41 CO 0.09 -0.66 0.00 0.61 -0.31 0.00 0.00 175.10 174.83 1bzf n GLY 42 N -0.19 0.07 0.11 2.32 0.00 -0.81 -1.94 105.19 104.75 1bzf n GLY 42 Ca -0.09 -1.78 -0.17 0.00 0.00 0.00 0.00 46.02 43.98 1bzf n GLY 42 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1bzf h ARG 43 N 0.00 0.26 -0.35 1.61 0.11 -1.94 -2.74 114.38 111.34 1bzf h ARG 43 Ca 0.00 -0.45 -0.15 0.00 0.10 0.00 0.00 59.98 59.48 1bzf h ARG 43 Cb 0.00 0.17 -0.01 0.00 1.11 0.00 0.00 29.97 31.24 1bzf h ARG 43 CO 0.00 1.14 -0.38 0.00 0.10 0.00 0.00 179.97 180.83 1bzf h ARG 44 N 0.07 0.83 0.00 0.08 3.08 -1.95 -2.85 114.38 113.64 1bzf h ARG 44 Ca -0.23 -0.43 -0.13 0.00 0.07 0.00 0.00 59.98 59.27 1bzf h ARG 44 Cb 2.01 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 32.06 1bzf h ARG 44 CO 0.17 1.06 -0.61 1.15 -1.07 0.00 0.00 179.97 180.67 1bzf h THR 45 N 0.68 1.30 0.71 2.04 2.02 -1.92 -2.30 112.91 115.45 1bzf h THR 45 Ca 0.06 -2.19 -0.03 0.00 0.77 0.00 0.00 66.41 65.01 1bzf h THR 45 Cb 0.95 2.23 0.01 0.00 -1.74 0.00 0.00 68.15 69.59 1bzf h THR 45 CO 0.09 0.60 -0.34 0.22 0.37 0.00 0.00 175.52 176.46 1bzf h TYR 46 N 0.00 -0.89 0.00 3.16 3.20 -1.30 -2.73 116.97 118.42 1bzf h TYR 46 Ca -0.01 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.83 1bzf h TYR 46 Cb 1.18 0.29 -0.00 0.00 1.54 0.00 0.00 36.73 39.74 1bzf h TYR 46 CO 0.00 -0.52 -0.05 0.93 -1.64 0.00 0.00 178.16 176.88 1bzf h GLU 47 N -1.13 0.00 0.00 1.82 5.08 -1.58 -2.25 114.58 116.52 1bzf h GLU 47 Ca -0.10 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.23 1bzf h GLU 47 Cb 0.76 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.00 1bzf h GLU 47 CO 0.16 0.05 -0.15 0.77 -1.00 0.00 0.00 179.01 178.85 1bzf h SER 48 N 0.00 0.00 -4.16 1.42 0.02 -1.10 -3.43 113.55 106.30 1bzf h SER 48 Ca -0.00 0.00 -0.50 0.00 -0.84 0.00 0.00 61.79 60.44 1bzf h SER 48 Cb 0.35 0.00 0.17 0.00 0.14 0.00 0.00 62.40 63.06 1bzf h SER 48 CO 0.01 0.15 0.24 -0.36 -1.14 0.00 0.00 176.83 175.72 1bzf s PHE 49 N -4.66 2.00 0.00 3.45 0.08 -0.85 -4.99 117.98 113.01 1bzf s PHE 49 Ca -0.04 1.58 0.00 0.00 0.12 0.00 0.00 56.93 58.59 1bzf s PHE 49 Cb 0.16 -3.20 0.00 0.00 -0.57 0.00 0.00 43.02 39.41 1bzf s PHE 49 CO 0.68 -2.53 0.01 -0.35 -0.10 0.00 0.00 175.22 172.92 1bzf n PRO 50 N -4.03 0.00 -3.55 0.24 -0.04 -1.26 -4.72 135.00 121.64 1bzf n PRO 50 Ca 0.09 0.34 -0.41 0.00 -0.04 0.00 0.00 63.50 63.49 1bzf n PRO 50 Cb 0.53 -0.85 -0.07 0.00 -0.04 0.00 0.00 33.50 33.07 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 -0.70 2.72 0.19 0.54 -0.14 -1.26 -5.07 119.74 116.02 1bzf s LYS 51 Ca 0.00 -2.10 0.04 0.00 -1.36 0.00 0.00 55.97 52.55 1bzf s LYS 51 Cb 0.00 -3.97 -0.03 0.00 -1.68 0.00 0.00 37.83 32.15 1bzf s LYS 51 CO 0.00 -1.21 0.29 -0.98 -0.76 0.00 0.00 175.35 172.69 1bzf s ARG 52 N 0.75 3.33 0.34 1.68 1.70 -1.26 -4.12 118.95 121.37 1bzf s ARG 52 Ca 0.11 -0.73 -0.25 0.00 -0.47 0.00 0.00 55.73 54.39 1bzf s ARG 52 Cb -0.21 -2.86 -0.10 0.00 -0.57 0.00 0.00 34.95 31.20 1bzf s ARG 52 CO -0.03 0.47 0.94 -1.25 -1.08 0.00 0.00 175.30 174.35 1bzf s PRO 53 N -3.56 4.49 -0.10 3.89 0.04 -1.26 -5.07 135.00 133.43 1bzf s PRO 53 Ca 0.34 1.26 -0.29 0.00 0.04 0.00 0.00 61.00 62.34 1bzf s PRO 53 Cb -0.10 -2.66 -0.06 0.00 0.04 0.00 0.00 34.50 31.72 1bzf s PRO 53 CO 0.28 0.21 1.95 -0.51 0.04 0.00 0.00 177.00 178.97 1bzf s LEU 54 N -2.31 4.03 1.00 -3.56 1.43 -1.26 -4.98 118.68 113.03 1bzf s LEU 54 Ca 0.53 2.20 -0.17 0.00 -1.03 0.00 0.00 54.13 55.66 1bzf s LEU 54 Cb -0.16 -3.53 0.22 0.00 0.03 0.00 0.00 46.19 42.75 1bzf s LEU 54 CO 0.21 -1.35 1.31 -2.16 0.23 0.00 0.00 176.35 174.59 1bzf s PRO 55 N 5.03 0.36 -1.73 1.29 0.04 -1.26 -4.27 135.00 134.46 1bzf s PRO 55 Ca 0.87 -0.41 0.00 0.00 0.04 0.00 0.00 61.00 61.51 1bzf s PRO 55 Cb -0.36 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.37 1bzf s PRO 55 CO 0.36 -2.60 0.00 0.39 0.04 0.00 0.00 177.00 175.19 1bzf n GLU 56 N -3.90 -1.58 -1.72 4.56 1.02 -1.26 -4.88 120.64 112.88 1bzf n GLU 56 Ca 0.15 0.98 0.00 0.00 -0.02 0.00 0.00 57.16 58.28 1bzf n GLU 56 Cb 0.59 -5.58 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 2.89 1.18 0.00 0.00 177.13 181.20 1bzf n ARG 57 N -2.89 0.00 -5.08 3.49 1.85 -1.26 -3.41 116.66 109.37 1bzf n ARG 57 Ca -0.24 0.00 -0.32 0.00 -1.00 0.00 0.00 57.85 56.29 1bzf n ARG 57 Cb 0.68 0.00 -0.16 0.00 -1.05 0.00 0.00 32.46 31.93 1bzf n ARG 57 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1bzf s THR 58 N -2.14 2.39 -0.46 8.89 2.01 -1.16 -5.00 115.64 120.16 1bzf s THR 58 Ca 0.00 -0.90 -0.08 0.00 0.31 0.00 0.00 61.69 61.01 1bzf s THR 58 Cb 0.00 -1.94 0.11 0.00 0.01 0.00 0.00 72.50 70.68 1bzf s THR 58 CO 0.00 0.55 0.32 0.20 -0.69 0.00 0.00 174.62 175.00 1bzf s ASN 59 N 0.32 5.64 -0.47 3.53 0.02 -1.26 -0.83 114.94 121.89 1bzf s ASN 59 Ca -0.16 -1.88 -0.16 0.00 -1.02 0.00 0.00 52.86 49.64 1bzf s ASN 59 Cb -0.17 -1.99 0.07 0.00 0.02 0.00 0.00 41.25 39.18 1bzf s ASN 59 CO 0.08 -0.66 0.41 -0.69 0.02 0.00 0.00 177.10 176.26 1bzf s VAL 60 N 1.34 5.21 -0.22 1.60 1.01 -0.73 -1.90 120.40 126.71 1bzf s VAL 60 Ca 0.06 -1.00 -0.21 0.00 0.00 0.00 0.00 61.98 60.83 1bzf s VAL 60 Cb -0.25 -4.13 -0.02 0.00 0.00 0.00 0.00 36.38 31.98 1bzf s VAL 60 CO -0.01 -0.58 0.67 -0.69 0.00 0.00 0.00 175.10 174.49 1bzf s VAL 61 N 1.72 4.98 -0.30 2.92 1.01 -0.56 -1.62 120.40 128.55 1bzf s VAL 61 Ca 0.05 1.25 -0.11 0.00 0.00 0.00 0.00 61.98 63.17 1bzf s VAL 61 Cb -0.24 -3.98 -0.03 0.00 0.00 0.00 0.00 36.38 32.13 1bzf s VAL 61 CO 0.07 0.06 0.18 -0.22 0.00 0.00 0.00 175.10 175.19 1bzf s LEU 62 N 2.21 4.09 0.03 3.92 2.96 -0.82 -2.31 118.68 128.77 1bzf s LEU 62 Ca 0.29 -0.22 -0.06 0.00 -0.22 0.00 0.00 54.13 53.93 1bzf s LEU 62 Cb -0.16 -2.08 -0.01 0.00 0.50 0.00 0.00 46.19 44.44 1bzf s LEU 62 CO 0.10 -0.12 0.12 0.28 -1.32 0.00 0.00 176.35 175.40 1bzf s THR 63 N 1.71 0.12 -0.18 3.68 -1.32 -1.16 -4.23 115.64 114.26 1bzf s THR 63 Ca 0.06 -1.02 -0.00 0.00 -1.21 0.00 0.00 61.69 59.52 1bzf s THR 63 Cb -0.16 -0.85 -0.22 0.00 -1.51 0.00 0.00 72.50 69.76 1bzf s THR 63 CO 0.09 -0.56 0.10 1.41 -2.21 0.00 0.00 174.62 173.45 1bzf n HIS 64 N 0.82 0.62 -2.33 9.09 8.25 -1.26 -4.14 115.22 126.27 1bzf n HIS 64 Ca -0.19 0.14 -0.42 0.00 -0.26 0.00 0.00 57.72 56.99 1bzf n HIS 64 Cb 0.58 -1.08 -0.03 0.00 1.12 0.00 0.00 29.99 30.58 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 -2.54 4.41 -0.14 -0.41 0.74 -1.26 -4.89 119.66 115.57 1bzf s GLN 65 Ca -0.26 1.90 0.01 0.00 0.05 0.00 0.00 55.36 57.06 1bzf s GLN 65 Cb 0.08 -3.28 0.20 0.00 1.10 0.00 0.00 33.01 31.10 1bzf s GLN 65 CO 0.70 -0.26 1.33 0.39 -0.55 0.00 0.00 175.29 176.89 1bzf n GLU 66 N 3.48 1.38 -0.09 1.67 1.02 -1.26 -3.77 120.64 123.06 1bzf n GLU 66 Ca 0.08 -0.90 -0.11 0.00 -0.02 0.00 0.00 57.16 56.21 1bzf n GLU 66 Cb 0.45 -1.35 -0.12 0.00 -0.02 0.00 0.00 31.44 30.39 1bzf n GLU 66 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1bzf n ASP 67 N 0.06 1.28 -4.77 1.62 2.03 -1.26 -4.96 116.55 110.56 1bzf n ASP 67 Ca 0.18 -0.04 -0.39 0.00 0.52 0.00 0.00 54.79 55.06 1bzf n ASP 67 Cb 0.83 0.51 -0.02 0.00 -0.72 0.00 0.00 41.12 41.73 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 -2.42 3.06 -0.00 -0.67 5.04 -1.25 -5.04 117.35 116.07 1bzf s TYR 68 Ca -0.15 1.53 -0.03 0.00 -2.44 0.00 0.00 57.07 55.98 1bzf s TYR 68 Cb 0.06 -3.45 -0.00 0.00 0.35 0.00 0.00 41.96 38.91 1bzf s TYR 68 CO 0.63 -1.44 0.06 -0.65 -1.34 0.00 0.00 175.55 172.82 1bzf s GLN 69 N -2.20 0.27 -0.04 4.97 -0.21 -1.26 -5.10 119.66 116.09 1bzf s GLN 69 Ca 0.56 -0.27 -0.01 0.00 0.02 0.00 0.00 55.36 55.66 1bzf s GLN 69 Cb -0.33 0.11 0.03 0.00 1.00 0.00 0.00 33.01 33.82 1bzf s GLN 69 CO 0.41 -0.05 0.02 0.00 -2.12 0.00 0.00 175.29 173.55 1bzf s ALA 70 N -0.86 0.38 -0.03 6.09 0.00 -1.26 -5.13 121.76 120.96 1bzf s ALA 70 Ca -0.09 0.10 -0.27 0.00 0.00 0.00 0.00 51.96 51.70 1bzf s ALA 70 Cb -0.06 -0.52 -0.03 0.00 0.00 0.00 0.00 23.12 22.51 1bzf s ALA 70 CO 0.00 -0.30 0.85 -0.65 0.00 0.00 0.00 175.76 175.66 1bzf s GLN 71 N 1.62 4.51 -0.33 0.00 -0.21 -1.26 -3.69 119.66 120.30 1bzf s GLN 71 Ca -0.01 1.18 -0.02 0.00 0.02 0.00 0.00 55.36 56.52 1bzf s GLN 71 Cb -0.13 -3.45 0.00 0.00 1.00 0.00 0.00 33.01 30.43 1bzf s GLN 71 CO -0.03 0.01 0.24 0.41 -2.12 0.00 0.00 175.29 173.81 1bzf n GLY 72 N 2.96 0.56 3.58 3.09 0.00 -1.26 -4.74 105.19 109.39 1bzf n GLY 72 Ca 0.03 -0.49 -0.13 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.98 -1.67 -0.59 4.61 0.00 -1.24 -4.81 121.76 115.07 1bzf s ALA 73 Ca 0.12 1.93 -0.28 0.00 0.00 0.00 0.00 51.96 53.73 1bzf s ALA 73 Cb -0.05 -1.12 0.02 0.00 0.00 0.00 0.00 23.12 21.96 1bzf s ALA 73 CO 0.15 -0.32 1.36 0.08 0.00 0.00 0.00 175.76 177.03 1bzf s VAL 74 N 0.43 3.81 -0.53 0.00 1.01 -0.80 -4.81 120.40 119.51 1bzf s VAL 74 Ca -0.01 0.67 -0.16 0.00 0.00 0.00 0.00 61.98 62.48 1bzf s VAL 74 Cb -0.05 -4.55 0.12 0.00 0.00 0.00 0.00 36.38 31.91 1bzf s VAL 74 CO -0.00 -1.29 0.50 -0.69 0.00 0.00 0.00 175.10 173.62 1bzf s VAL 75 N 5.88 5.19 0.39 2.92 1.01 -1.26 -1.50 120.40 133.03 1bzf s VAL 75 Ca 0.48 -1.40 0.06 0.00 0.00 0.00 0.00 61.98 61.12 1bzf s VAL 75 Cb -0.10 -4.32 0.06 0.00 0.00 0.00 0.00 36.38 32.02 1bzf s VAL 75 CO 0.24 -0.85 0.48 1.33 0.00 0.00 0.00 175.10 176.30 1bzf n VAL 76 N 5.27 0.00 -2.44 2.92 0.24 -0.98 -4.99 118.33 118.35 1bzf n VAL 76 Ca -0.13 -1.36 0.02 0.00 -2.04 0.00 0.00 64.34 60.83 1bzf n VAL 76 Cb 0.41 -0.55 0.01 0.00 -1.47 0.00 0.00 33.84 32.24 1bzf n VAL 76 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 1bzf n HIS 77 N -1.74 0.02 -3.60 6.34 8.25 -1.26 -2.99 115.22 120.24 1bzf n HIS 77 Ca 0.08 -0.55 -0.14 0.00 -0.26 0.00 0.00 57.72 56.85 1bzf n HIS 77 Cb 0.41 -0.05 -0.07 0.00 1.12 0.00 0.00 29.99 31.40 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 -1.90 -0.69 0.39 0.41 2.15 -1.26 -4.85 116.67 110.92 1bzf s ASP 78 Ca 0.29 1.20 0.11 0.00 0.43 0.00 0.00 52.55 54.57 1bzf s ASP 78 Cb 0.33 1.17 0.78 0.00 -0.30 0.00 0.00 42.92 44.90 1bzf s ASP 78 CO -0.14 -0.32 1.89 0.58 -0.17 0.00 0.00 175.17 177.01 1bzf h VAL 79 N 3.69 1.20 -0.28 1.11 2.07 -1.98 -2.27 116.25 119.79 1bzf h VAL 79 Ca -0.28 -0.91 -0.08 0.00 0.82 0.00 0.00 66.70 66.25 1bzf h VAL 79 Cb 1.16 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 32.28 1bzf h VAL 79 CO 0.14 0.27 -0.16 0.00 0.02 0.00 0.00 177.57 177.84 1bzf h ALA 80 N 1.65 1.20 -0.36 1.67 0.00 -1.99 -2.37 119.26 119.06 1bzf h ALA 80 Ca 0.03 -0.29 -0.11 0.00 0.00 0.00 0.00 54.91 54.53 1bzf h ALA 80 Cb 0.46 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1bzf h ALA 80 CO 0.03 0.51 -0.24 0.00 0.00 0.00 0.00 179.25 179.56 1bzf h ALA 81 N 1.38 0.91 -0.51 0.00 0.00 -1.82 -0.58 119.26 118.64 1bzf h ALA 81 Ca 0.08 -0.37 -0.09 0.00 0.00 0.00 0.00 54.91 54.52 1bzf h ALA 81 Cb 0.54 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1bzf h ALA 81 CO 0.03 0.62 -0.05 0.28 0.00 0.00 0.00 179.25 180.14 1bzf h VAL 82 N 0.63 1.27 -0.00 0.00 2.07 -1.31 -2.57 116.25 116.34 1bzf h VAL 82 Ca 0.09 -1.17 -0.13 0.00 0.82 0.00 0.00 66.70 66.31 1bzf h VAL 82 Cb 0.73 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 1bzf h VAL 82 CO 0.06 0.41 -0.60 -0.26 0.02 0.00 0.00 177.57 177.20 1bzf h PHE 83 N 0.80 0.01 -0.51 1.57 0.04 -1.26 -2.90 116.94 114.68 1bzf h PHE 83 Ca 0.14 -0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.84 1bzf h PHE 83 Cb 0.59 -0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.72 1bzf h PHE 83 CO 0.04 0.60 0.03 0.00 -0.60 0.00 0.00 178.31 178.39 1bzf h ALA 84 N 1.40 1.09 -0.09 2.45 0.00 -0.81 -1.69 119.26 121.62 1bzf h ALA 84 Ca -0.01 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.51 1bzf h ALA 84 Cb 1.06 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1bzf h ALA 84 CO 0.08 0.58 -0.57 -0.92 0.00 0.00 0.00 179.25 178.42 1bzf h TYR 85 N 0.79 0.34 0.00 0.00 3.20 -1.32 -2.90 116.97 117.07 1bzf h TYR 85 Ca 0.16 -0.12 -0.12 0.00 3.14 0.00 0.00 58.73 61.79 1bzf h TYR 85 Cb 0.43 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.62 1bzf h TYR 85 CO 0.02 0.77 -0.57 0.00 -1.64 0.00 0.00 178.16 176.75 1bzf h ALA 86 N 1.20 1.07 -0.45 1.82 0.00 -1.26 -2.90 119.26 118.73 1bzf h ALA 86 Ca -0.00 -0.51 -0.08 0.00 0.00 0.00 0.00 54.91 54.32 1bzf h ALA 86 Cb 1.06 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 1bzf h ALA 86 CO 0.09 0.71 -0.02 0.87 0.00 0.00 0.00 179.25 180.90 1bzf h LYS 87 N 0.00 0.82 0.00 0.00 1.57 -1.12 -2.61 116.57 115.22 1bzf h LYS 87 Ca -0.01 -0.27 -0.06 0.00 -1.87 0.00 0.00 60.65 58.45 1bzf h LYS 87 Cb 1.00 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.23 1bzf h LYS 87 CO 0.07 0.88 -0.28 0.37 -0.57 0.00 0.00 179.45 179.93 1bzf h GLN 88 N 0.66 0.00 -3.40 3.15 4.15 -1.44 -3.35 115.11 114.89 1bzf h GLN 88 Ca 0.13 0.00 -0.65 0.00 0.77 0.00 0.00 58.65 58.90 1bzf h GLN 88 Cb 0.52 0.00 -0.40 0.00 0.21 0.00 0.00 27.48 27.81 1bzf h GLN 88 CO 0.03 0.28 -0.60 -1.01 -1.93 0.00 0.00 178.83 175.59 1bzf s HIS 89 N -4.23 3.20 -0.23 3.99 3.76 -0.99 -4.90 115.29 115.90 1bzf s HIS 89 Ca -0.03 -3.13 0.17 0.00 -0.15 0.00 0.00 55.06 51.92 1bzf s HIS 89 Cb 0.14 -2.86 0.14 0.00 1.11 0.00 0.00 32.58 31.12 1bzf s HIS 89 CO 0.68 -0.75 1.49 -1.00 -0.85 0.00 0.00 174.74 174.32 1bzf h PRO 90 N 6.54 0.00 0.00 8.40 0.13 -1.69 -3.22 132.00 142.15 1bzf h PRO 90 Ca -0.07 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.01 1bzf h PRO 90 Cb 0.90 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.02 1bzf h PRO 90 CO 0.69 0.37 -0.24 0.38 -0.23 0.00 0.00 178.00 178.97 1bzf h ASP 91 N 0.00 0.00 -3.13 1.44 2.03 -1.90 -3.41 116.42 111.44 1bzf h ASP 91 Ca -0.00 0.00 -0.63 0.00 -0.73 0.00 0.00 57.03 55.66 1bzf h ASP 91 Cb 1.28 0.00 -0.13 0.00 -0.83 0.00 0.00 39.33 39.65 1bzf h ASP 91 CO 0.05 0.24 -0.53 -1.10 -1.03 0.00 0.00 179.24 176.87 1bzf s GLN 92 N -4.04 3.77 0.23 4.15 -0.21 -1.22 -4.95 119.66 117.39 1bzf s GLN 92 Ca -0.02 -0.27 -0.07 0.00 0.02 0.00 0.00 55.36 55.02 1bzf s GLN 92 Cb 0.13 -3.20 -0.06 0.00 1.00 0.00 0.00 33.01 30.88 1bzf s GLN 92 CO 0.65 0.46 0.52 -1.21 -2.12 0.00 0.00 175.29 173.58 1bzf s GLU 93 N -0.13 3.71 0.18 2.91 2.02 -1.26 -4.75 118.70 121.37 1bzf s GLU 93 Ca 0.08 0.11 -0.18 0.00 0.02 0.00 0.00 54.97 55.00 1bzf s GLU 93 Cb -0.12 -2.69 -0.08 0.00 0.10 0.00 0.00 34.13 31.35 1bzf s GLU 93 CO 0.01 0.31 0.66 -1.17 0.02 0.00 0.00 175.26 175.09 1bzf s LEU 94 N -3.04 4.37 -0.08 1.80 2.96 -1.26 -1.67 118.68 121.77 1bzf s LEU 94 Ca 0.45 1.31 -0.04 0.00 -0.22 0.00 0.00 54.13 55.63 1bzf s LEU 94 Cb -0.11 -3.40 0.04 0.00 0.50 0.00 0.00 46.19 43.22 1bzf s LEU 94 CO 0.25 0.09 0.18 -0.69 -1.32 0.00 0.00 176.35 174.85 1bzf s VAL 95 N -1.44 -0.05 -0.20 1.68 1.01 -0.99 -2.83 120.40 117.58 1bzf s VAL 95 Ca 0.39 0.17 -0.16 0.00 0.00 0.00 0.00 61.98 62.39 1bzf s VAL 95 Cb -0.17 -0.28 -0.04 0.00 0.00 0.00 0.00 36.38 35.89 1bzf s VAL 95 CO 0.20 0.07 0.39 -0.63 0.00 0.00 0.00 175.10 175.13 1bzf s ILE 96 N 1.19 5.21 -0.10 2.22 -1.09 0.17 -2.46 121.20 126.33 1bzf s ILE 96 Ca -0.09 0.68 0.11 0.00 -2.23 0.00 0.00 60.65 59.12 1bzf s ILE 96 Cb -0.11 -3.72 -0.16 0.00 -1.58 0.00 0.00 42.46 36.89 1bzf s ILE 96 CO -0.07 0.26 0.08 0.00 -1.23 0.00 0.00 174.94 173.99 1bzf n ALA 97 N 4.45 1.83 0.00 9.38 0.00 -1.17 -2.12 120.51 132.87 1bzf n ALA 97 Ca -0.09 -0.73 0.00 0.00 0.00 0.00 0.00 53.44 52.63 1bzf n ALA 97 Cb 0.51 -0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.88 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 2.16 -2.45 0.00 0.00 0.00 -1.26 -4.80 105.19 98.85 1bzf n GLY 98 Ca -0.17 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 44.58 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 -0.69 0.38 0.25 -0.02 0.00 -1.26 -1.93 105.19 101.92 1bzf n GLY 99 Ca 0.00 -1.61 -0.02 0.00 0.00 0.00 0.00 46.02 44.38 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 -1.86 1.19 -0.02 4.61 0.00 -1.95 -2.20 119.26 119.03 1bzf h ALA 100 Ca 0.00 -0.29 -0.11 0.00 0.00 0.00 0.00 54.91 54.51 1bzf h ALA 100 Cb 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1bzf h ALA 100 CO 0.00 0.52 -0.49 1.96 0.00 0.00 0.00 179.25 181.23 1bzf h GLN 101 N 0.46 0.04 -0.00 0.00 4.20 -2.00 -2.75 115.11 115.06 1bzf h GLN 101 Ca 0.08 -0.02 -0.16 0.00 0.06 0.00 0.00 58.65 58.60 1bzf h GLN 101 Cb 0.55 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.31 1bzf h GLN 101 CO 0.04 0.53 -0.77 0.82 -0.67 0.00 0.00 178.83 178.78 1bzf h ILE 102 N 0.04 1.53 0.04 2.54 1.08 -1.69 -2.69 117.51 118.36 1bzf h ILE 102 Ca -0.00 -2.57 -0.00 0.00 -0.39 0.00 0.00 64.86 61.90 1bzf h ILE 102 Cb 0.89 2.39 0.00 0.00 -3.07 0.00 0.00 36.82 37.03 1bzf h ILE 102 CO 0.07 0.74 -0.02 -0.26 -0.69 0.00 0.00 178.15 177.98 1bzf h PHE 103 N 0.02 -0.05 0.00 1.37 0.04 -1.15 -2.80 116.94 114.38 1bzf h PHE 103 Ca -0.01 -0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.74 1bzf h PHE 103 Cb 1.35 0.02 -0.00 0.00 2.20 0.00 0.00 35.95 39.51 1bzf h PHE 103 CO 0.01 0.38 -0.07 1.15 -0.60 0.00 0.00 178.31 179.18 1bzf h THR 104 N -0.49 0.36 0.13 -1.55 2.02 -1.55 -0.90 112.91 110.93 1bzf h THR 104 Ca -0.01 -0.37 -0.01 0.00 0.77 0.00 0.00 66.41 66.80 1bzf h THR 104 Cb 0.45 1.27 0.00 0.00 -1.74 0.00 0.00 68.15 68.13 1bzf h THR 104 CO 0.01 0.07 -0.06 0.00 0.37 0.00 0.00 175.52 175.90 1bzf h ALA 105 N 1.93 -0.17 -0.15 6.16 0.00 -1.26 -3.02 119.26 122.75 1bzf h ALA 105 Ca -0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1bzf h ALA 105 Cb 0.26 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1bzf h ALA 105 CO 0.01 -0.39 0.00 1.19 0.00 0.00 0.00 179.25 180.06 1bzf n PHE 106 N -4.98 0.20 0.27 0.00 3.01 -1.07 -3.87 117.46 111.01 1bzf n PHE 106 Ca -0.09 -0.10 0.14 0.00 1.01 0.00 0.00 57.45 58.41 1bzf n PHE 106 Cb 0.24 0.00 0.73 0.00 -0.01 0.00 0.00 39.48 40.44 1bzf n PHE 106 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 1bzf h LYS 107 N 1.45 0.00 -0.36 -1.08 3.64 -1.03 -1.68 116.57 117.52 1bzf h LYS 107 Ca 0.00 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.28 1bzf h LYS 107 Cb 0.32 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 1bzf h LYS 107 CO 0.00 0.11 -0.18 0.22 -2.27 0.00 0.00 179.45 177.33 1bzf h ASP 108 N 0.00 0.78 -0.79 4.20 3.58 -1.75 -3.16 116.42 119.28 1bzf h ASP 108 Ca -0.00 -0.41 -0.54 0.00 0.42 0.00 0.00 57.03 56.50 1bzf h ASP 108 Cb 0.38 -0.22 -0.33 0.00 1.72 0.00 0.00 39.33 40.89 1bzf h ASP 108 CO 0.01 1.02 -0.02 0.47 -2.88 0.00 0.00 179.24 177.84 1bzf n ASP 109 N -4.30 5.58 -4.83 2.28 9.92 -1.00 -5.02 116.55 119.18 1bzf n ASP 109 Ca -0.02 -3.77 -0.32 0.00 -0.53 0.00 0.00 54.79 50.15 1bzf n ASP 109 Cb 0.41 -0.64 -0.05 0.00 -0.64 0.00 0.00 41.12 40.20 1bzf n ASP 109 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1bzf s VAL 110 N -4.45 4.48 0.02 2.53 0.11 -0.66 -4.28 120.40 118.14 1bzf s VAL 110 Ca 0.56 1.32 0.00 0.00 -2.93 0.00 0.00 61.98 60.93 1bzf s VAL 110 Cb 0.45 -3.67 0.00 0.00 -1.53 0.00 0.00 36.38 31.63 1bzf s VAL 110 CO 0.02 -0.55 0.00 0.47 -3.33 0.00 0.00 175.10 171.71 1bzf n ASP 111 N -1.23 0.04 -4.90 3.54 9.92 -1.22 -4.93 116.55 117.78 1bzf n ASP 111 Ca 0.07 0.04 -0.28 0.00 -0.53 0.00 0.00 54.79 54.09 1bzf n ASP 111 Cb 0.54 0.01 0.01 0.00 -0.64 0.00 0.00 41.12 41.04 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 -1.11 4.49 -0.37 -3.53 2.01 -1.14 -2.26 115.64 113.73 1bzf s THR 112 Ca 0.00 0.27 0.01 0.00 0.31 0.00 0.00 61.69 62.28 1bzf s THR 112 Cb 0.00 -3.74 0.15 0.00 0.01 0.00 0.00 72.50 68.92 1bzf s THR 112 CO 0.00 -0.79 0.27 -0.76 -0.69 0.00 0.00 174.62 172.65 1bzf s LEU 113 N -4.90 0.82 -0.24 4.42 1.43 -1.12 -2.97 118.68 116.12 1bzf s LEU 113 Ca 0.51 -2.22 -0.21 0.00 -1.03 0.00 0.00 54.13 51.19 1bzf s LEU 113 Cb -0.10 -0.20 -0.02 0.00 0.03 0.00 0.00 46.19 45.89 1bzf s LEU 113 CO 0.47 -0.28 0.63 -0.76 0.23 0.00 0.00 176.35 176.65 1bzf s LEU 114 N 0.97 4.08 0.01 1.79 1.43 -0.68 -3.06 118.68 123.21 1bzf s LEU 114 Ca 0.20 0.74 0.03 0.00 -1.03 0.00 0.00 54.13 54.08 1bzf s LEU 114 Cb -0.17 -2.87 -0.01 0.00 0.03 0.00 0.00 46.19 43.17 1bzf s LEU 114 CO -0.03 -0.36 -0.10 0.54 0.23 0.00 0.00 176.35 176.63 1bzf s VAL 115 N 2.40 0.80 -0.41 -1.59 0.11 -1.14 -2.83 120.40 117.74 1bzf s VAL 115 Ca 0.27 -0.63 -0.06 0.00 -2.93 0.00 0.00 61.98 58.62 1bzf s VAL 115 Cb -0.16 -0.71 0.09 0.00 -1.53 0.00 0.00 36.38 34.08 1bzf s VAL 115 CO 0.09 0.08 0.22 -0.89 -3.33 0.00 0.00 175.10 171.26 1bzf s THR 116 N -0.53 3.74 -0.01 5.04 2.01 -1.15 -1.99 115.64 122.75 1bzf s THR 116 Ca 0.01 -1.68 -0.24 0.00 0.31 0.00 0.00 61.69 60.09 1bzf s THR 116 Cb -0.05 -3.39 -0.04 0.00 0.01 0.00 0.00 72.50 69.02 1bzf s THR 116 CO 0.00 -0.56 0.73 -0.13 -0.69 0.00 0.00 174.62 173.98 1bzf s ARG 117 N 1.30 4.45 -0.13 4.92 0.52 -1.14 -2.75 118.95 126.12 1bzf s ARG 117 Ca 0.04 0.97 -0.02 0.00 -0.52 0.00 0.00 55.73 56.20 1bzf s ARG 117 Cb -0.23 -3.41 -0.03 0.00 0.52 0.00 0.00 34.95 31.81 1bzf s ARG 117 CO -0.01 0.17 -0.05 -0.51 0.02 0.00 0.00 175.30 174.92 1bzf s LEU 118 N 0.39 3.18 0.35 2.53 1.02 -1.22 -2.04 118.68 122.88 1bzf s LEU 118 Ca 0.38 -0.12 0.09 0.00 0.02 0.00 0.00 54.13 54.51 1bzf s LEU 118 Cb -0.19 -1.74 0.64 0.00 0.02 0.00 0.00 46.19 44.92 1bzf s LEU 118 CO 0.20 0.22 1.81 0.00 0.02 0.00 0.00 176.35 178.61 1bzf h ALA 119 N 6.29 1.32 -2.55 4.21 0.00 -1.31 -3.28 119.26 123.95 1bzf h ALA 119 Ca -0.35 -0.32 -0.53 0.00 0.00 0.00 0.00 54.91 53.71 1bzf h ALA 119 Cb 1.19 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.91 1bzf h ALA 119 CO 0.59 0.47 0.55 0.20 0.00 0.00 0.00 179.25 181.06 1bzf s GLY 120 N -4.18 2.52 0.19 0.00 0.00 0.20 -4.93 107.32 101.12 1bzf s GLY 120 Ca -0.04 0.87 -0.22 0.00 0.00 0.00 0.00 44.72 45.32 1bzf s GLY 120 CO 0.75 1.95 0.74 -1.35 0.00 0.00 0.00 173.10 175.18 1bzf s SER 121 N 0.69 7.22 -0.09 1.64 1.04 -1.26 -4.69 113.70 118.24 1bzf s SER 121 Ca 0.56 1.52 -0.04 0.00 0.48 0.00 0.00 55.95 58.47 1bzf s SER 121 Cb -0.30 -2.45 0.05 0.00 0.10 0.00 0.00 66.02 63.41 1bzf s SER 121 CO 0.32 0.13 0.20 -0.36 0.98 0.00 0.00 173.24 174.51 1bzf s PHE 122 N -1.32 -0.25 0.18 5.02 0.08 -1.26 -5.07 117.98 115.36 1bzf s PHE 122 Ca 0.38 0.67 -0.13 0.00 0.12 0.00 0.00 56.93 57.97 1bzf s PHE 122 Cb -0.20 -0.08 -0.07 0.00 -0.57 0.00 0.00 43.02 42.10 1bzf s PHE 122 CO 0.23 -0.24 0.57 -1.21 -0.10 0.00 0.00 175.22 174.47 1bzf s GLU 123 N 1.64 3.95 0.00 0.44 8.01 -1.26 -4.78 118.70 126.70 1bzf s GLU 123 Ca -0.05 0.46 0.00 0.00 0.01 0.00 0.00 54.97 55.39 1bzf s GLU 123 Cb -0.11 -2.83 0.00 0.00 -4.31 0.00 0.00 34.13 26.87 1bzf s GLU 123 CO -0.07 0.42 0.00 0.41 0.01 0.00 0.00 175.26 176.03 1bzf n GLY 124 N 0.51 4.37 0.00 -1.39 0.00 -1.26 -4.94 105.19 102.47 1bzf n GLY 124 Ca -0.03 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.51 1bzf n GLY 124 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1bzf n ASP 125 N 0.00 0.00 -4.70 1.61 2.03 -1.26 -5.05 116.55 109.18 1bzf n ASP 125 Ca 0.00 0.00 -0.36 0.00 0.52 0.00 0.00 54.79 54.95 1bzf n ASP 125 Cb 0.00 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.32 1bzf n ASP 125 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1bzf s THR 126 N -1.00 5.35 0.43 5.18 2.01 -1.26 -5.09 115.64 121.27 1bzf s THR 126 Ca 0.00 0.31 0.08 0.00 0.31 0.00 0.00 61.69 62.39 1bzf s THR 126 Cb 0.00 -3.54 -0.00 0.00 0.01 0.00 0.00 72.50 68.97 1bzf s THR 126 CO 0.00 0.38 0.45 -0.54 -0.69 0.00 0.00 174.62 174.22 1bzf s LYS 127 N 0.71 2.59 0.17 4.92 1.02 -1.26 -2.99 119.74 124.90 1bzf s LYS 127 Ca 0.11 -1.49 -0.15 0.00 0.02 0.00 0.00 55.97 54.46 1bzf s LYS 127 Cb -0.13 -2.48 -0.07 0.00 -0.52 0.00 0.00 37.83 34.63 1bzf s LYS 127 CO 0.02 -0.27 0.59 1.41 -0.92 0.00 0.00 175.35 176.18 1bzf s MET 128 N -4.22 4.02 0.94 1.68 1.75 -1.23 -4.78 119.30 117.46 1bzf s MET 128 Ca 0.50 0.56 -0.11 0.00 -1.25 0.00 0.00 55.69 55.38 1bzf s MET 128 Cb -0.05 -2.88 0.15 0.00 2.84 0.00 0.00 34.83 34.89 1bzf s MET 128 CO 0.29 0.44 1.09 0.96 -0.65 0.00 0.00 175.02 177.15 1bzf s ILE 129 N -1.52 2.49 -0.50 10.11 -4.36 -1.26 -4.95 121.20 121.21 1bzf s ILE 129 Ca 0.40 0.16 -0.29 0.00 -0.26 0.00 0.00 60.65 60.66 1bzf s ILE 129 Cb -0.15 -2.50 0.03 0.00 1.25 0.00 0.00 42.46 41.09 1bzf s ILE 129 CO 0.20 -0.21 1.14 -2.16 0.24 0.00 0.00 174.94 174.15 1bzf s PRO 130 N -4.81 3.67 0.10 0.37 0.04 -1.26 -5.04 135.00 128.08 1bzf s PRO 130 Ca 0.65 0.48 -0.03 0.00 0.04 0.00 0.00 61.00 62.13 1bzf s PRO 130 Cb -0.20 -3.93 -0.05 0.00 0.04 0.00 0.00 34.50 30.36 1bzf s PRO 130 CO 0.58 -1.44 0.31 -0.51 0.04 0.00 0.00 177.00 175.99 1bzf s LEU 131 N 4.53 4.31 -1.08 -3.56 1.43 -1.26 -5.02 118.68 118.03 1bzf s LEU 131 Ca 0.47 0.49 -0.19 0.00 -1.03 0.00 0.00 54.13 53.86 1bzf s LEU 131 Cb -0.07 -3.14 0.10 0.00 0.03 0.00 0.00 46.19 43.11 1bzf s LEU 131 CO 0.30 0.11 1.41 0.21 0.23 0.00 0.00 176.35 178.61 1bzf s ASN 132 N -2.38 6.70 0.36 2.29 3.84 -1.26 -4.78 114.94 119.71 1bzf s ASN 132 Ca 0.38 -2.09 0.27 0.00 0.21 0.00 0.00 52.86 51.63 1bzf s ASN 132 Cb -0.13 -2.49 0.98 0.00 -0.55 0.00 0.00 41.25 39.06 1bzf s ASN 132 CO 0.25 -1.18 1.79 -0.50 -2.79 0.00 0.00 177.10 174.67 1bzf h TRP 133 N 8.62 0.00 0.00 0.43 4.06 -1.98 -2.92 115.95 124.17 1bzf h TRP 133 Ca 0.26 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.21 1bzf h TRP 133 Cb 0.96 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.12 1bzf h TRP 133 CO 1.25 0.00 0.00 -3.47 -3.56 0.00 0.00 178.44 172.66 1bzf n ASP 134 N -2.61 0.00 -1.01 -3.49 -0.08 -1.26 -2.65 116.55 105.46 1bzf n ASP 134 Ca 0.03 -1.40 0.05 0.00 -1.51 0.00 0.00 54.79 51.96 1bzf n ASP 134 Cb 0.33 0.00 0.09 0.00 2.34 0.00 0.00 41.12 43.88 1bzf n ASP 134 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1bzf n ASP 135 N -0.51 1.24 -3.42 1.67 2.03 -1.10 -5.07 116.55 111.39 1bzf n ASP 135 Ca 0.00 -2.72 -0.21 0.00 0.52 0.00 0.00 54.79 52.38 1bzf n ASP 135 Cb 0.00 -0.38 -0.08 0.00 -0.72 0.00 0.00 41.12 39.94 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 -1.29 1.80 -0.17 -0.67 0.08 -1.08 -4.48 117.98 112.16 1bzf s PHE 136 Ca 0.32 -1.63 -0.07 0.00 0.12 0.00 0.00 56.93 55.67 1bzf s PHE 136 Cb 0.34 -0.79 0.08 0.00 -0.57 0.00 0.00 43.02 42.07 1bzf s PHE 136 CO -0.11 -0.80 0.37 0.99 -0.10 0.00 0.00 175.22 175.57 1bzf s THR 137 N -3.36 -0.47 -0.07 0.64 2.01 -0.98 -4.86 115.64 108.54 1bzf s THR 137 Ca 0.38 0.19 -0.30 0.00 0.31 0.00 0.00 61.69 62.27 1bzf s THR 137 Cb 0.02 -0.59 -0.04 0.00 0.01 0.00 0.00 72.50 71.90 1bzf s THR 137 CO 0.27 0.08 1.48 -0.75 -0.69 0.00 0.00 174.62 175.00 1bzf s LYS 138 N 2.31 4.22 -0.19 4.92 2.20 -1.26 -1.85 119.74 130.09 1bzf s LYS 138 Ca -0.03 1.98 0.03 0.00 -0.36 0.00 0.00 55.97 57.60 1bzf s LYS 138 Cb -0.11 -3.82 -0.22 0.00 -1.51 0.00 0.00 37.83 32.17 1bzf s LYS 138 CO -0.11 -0.74 0.09 1.33 -0.36 0.00 0.00 175.35 175.55 1bzf n VAL 139 N 5.24 1.57 -3.86 4.02 0.24 -1.08 -4.98 118.33 119.49 1bzf n VAL 139 Ca 0.15 -0.66 -0.08 0.00 -2.04 0.00 0.00 64.34 61.71 1bzf n VAL 139 Cb 0.44 -1.32 -0.03 0.00 -1.47 0.00 0.00 33.84 31.46 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 -6.47 -0.25 -0.26 -1.34 1.04 -1.24 -5.10 113.70 100.09 1bzf s SER 140 Ca -0.24 -0.62 -0.14 0.00 0.48 0.00 0.00 55.95 55.42 1bzf s SER 140 Cb 0.08 0.70 0.08 0.00 0.10 0.00 0.00 66.02 66.97 1bzf s SER 140 CO 0.71 -1.29 0.63 -0.94 0.98 0.00 0.00 173.24 173.33 1bzf s SER 141 N -2.92 -0.87 -0.33 7.02 1.04 -1.26 -2.41 113.70 113.97 1bzf s SER 141 Ca 0.12 1.40 -0.15 0.00 0.48 0.00 0.00 55.95 57.80 1bzf s SER 141 Cb -0.05 1.30 -0.02 0.00 0.10 0.00 0.00 66.02 67.35 1bzf s SER 141 CO 0.06 -0.23 0.35 -0.60 0.98 0.00 0.00 173.24 173.80 1bzf s ARG 142 N 1.64 3.65 0.21 4.02 6.06 -0.77 -4.92 118.95 128.84 1bzf s ARG 142 Ca -0.10 -0.35 -0.05 0.00 -2.50 0.00 0.00 55.73 52.73 1bzf s ARG 142 Cb -0.06 -3.77 -0.06 0.00 0.06 0.00 0.00 34.95 31.12 1bzf s ARG 142 CO -0.19 -0.47 0.46 0.99 -2.50 0.00 0.00 175.30 173.60 1bzf s THR 143 N 2.00 5.09 -0.24 4.11 2.01 -1.26 -0.43 115.64 126.92 1bzf s THR 143 Ca 0.12 0.05 -0.15 0.00 0.31 0.00 0.00 61.69 62.02 1bzf s THR 143 Cb -0.16 -3.67 0.07 0.00 0.01 0.00 0.00 72.50 68.75 1bzf s THR 143 CO 0.11 -0.12 0.61 0.54 -0.69 0.00 0.00 174.62 175.07 1bzf s VAL 144 N -1.84 -0.01 -0.24 3.82 0.11 -1.10 -4.97 120.40 116.17 1bzf s VAL 144 Ca 0.43 0.03 -0.09 0.00 -2.93 0.00 0.00 61.98 59.41 1bzf s VAL 144 Cb -0.11 -0.88 -0.04 0.00 -1.53 0.00 0.00 36.38 33.82 1bzf s VAL 144 CO 0.26 0.01 0.13 -1.61 -3.33 0.00 0.00 175.10 170.56 1bzf s GLU 145 N 1.45 3.91 0.00 1.54 8.01 -1.26 -3.01 118.70 129.33 1bzf s GLU 145 Ca -0.09 -0.35 0.00 0.00 0.01 0.00 0.00 54.97 54.54 1bzf s GLU 145 Cb -0.06 -3.45 0.00 0.00 -4.31 0.00 0.00 34.13 26.31 1bzf s GLU 145 CO -0.16 -0.03 0.00 -3.47 0.01 0.00 0.00 175.26 171.61 1bzf n ASP 146 N 4.53 0.00 -0.01 -0.19 2.03 -1.26 -4.98 116.55 116.68 1bzf n ASP 146 Ca -0.15 -0.59 -0.18 0.00 0.52 0.00 0.00 54.79 54.38 1bzf n ASP 146 Cb 0.52 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.84 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 -0.58 1.28 -2.80 5.18 1.35 -1.99 -3.44 112.91 111.91 1bzf h THR 147 Ca 0.00 -2.03 -0.65 0.00 -0.55 0.00 0.00 66.41 63.17 1bzf h THR 147 Cb 0.00 2.07 -0.08 0.00 -1.73 0.00 0.00 68.15 68.41 1bzf h THR 147 CO 0.00 0.64 -0.48 0.21 -0.25 0.00 0.00 175.52 175.65 1bzf s ASN 148 N -7.15 6.36 0.32 5.36 3.84 -1.26 -4.98 114.94 117.42 1bzf s ASN 148 Ca -0.10 0.42 0.10 0.00 0.21 0.00 0.00 52.86 53.49 1bzf s ASN 148 Cb 0.08 -2.08 0.91 0.00 -0.55 0.00 0.00 41.25 39.61 1bzf s ASN 148 CO 0.91 0.35 1.73 -0.65 -2.79 0.00 0.00 177.10 176.65 1bzf h PRO 149 N 5.39 0.54 0.00 0.43 0.10 -2.00 0.38 132.00 136.84 1bzf h PRO 149 Ca -0.52 -0.03 -0.15 0.00 0.10 0.00 0.00 66.00 65.40 1bzf h PRO 149 Cb 1.21 -0.12 -0.02 0.00 0.10 0.00 0.00 31.00 32.17 1bzf h PRO 149 CO 0.62 0.36 -0.72 0.00 0.10 0.00 0.00 178.00 178.36 1bzf h ALA 150 N 1.74 0.77 0.00 -0.75 0.00 -1.94 -2.93 119.26 116.15 1bzf h ALA 150 Ca 0.65 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1bzf h ALA 150 Cb 1.27 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1bzf h ALA 150 CO -0.48 0.90 0.00 1.28 0.00 0.00 0.00 179.25 180.95 1bzf n LEU 151 N -3.62 0.00 -4.85 0.00 4.77 0.13 -0.63 117.00 112.80 1bzf n LEU 151 Ca -0.01 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.66 1bzf n LEU 151 Cb 0.72 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.82 1bzf n LEU 151 CO 0.43 0.00 0.71 0.42 -1.33 0.00 0.00 177.39 177.62 1bzf s THR 152 N -2.00 4.47 0.06 -5.08 -4.23 -1.11 -4.03 115.64 103.72 1bzf s THR 152 Ca 0.05 0.87 -0.28 0.00 -1.18 0.00 0.00 61.69 61.15 1bzf s THR 152 Cb 0.03 -3.71 0.10 0.00 1.34 0.00 0.00 72.50 70.25 1bzf s THR 152 CO 0.04 -0.98 1.16 -1.38 -0.54 0.00 0.00 174.62 172.91 1bzf s HIS 153 N -3.04 -0.07 -0.02 3.99 -3.43 -1.17 -1.32 115.29 110.25 1bzf s HIS 153 Ca 0.57 -0.13 -0.00 0.00 -0.80 0.00 0.00 55.06 54.70 1bzf s HIS 153 Cb -0.12 0.59 0.02 0.00 -1.43 0.00 0.00 32.58 31.64 1bzf s HIS 153 CO 0.50 -0.51 0.03 0.99 -2.00 0.00 0.00 174.74 173.76 1bzf s THR 154 N -2.72 -0.04 -0.79 -5.38 2.01 -0.87 -2.72 115.64 105.14 1bzf s THR 154 Ca 0.14 0.13 -0.22 0.00 0.31 0.00 0.00 61.69 62.06 1bzf s THR 154 Cb 0.02 -0.07 0.08 0.00 0.01 0.00 0.00 72.50 72.54 1bzf s THR 154 CO -0.01 0.05 1.10 -0.31 -0.69 0.00 0.00 174.62 174.77 1bzf s TYR 155 N 0.68 2.74 0.34 4.92 2.02 0.43 -2.90 117.35 125.58 1bzf s TYR 155 Ca -0.06 -0.77 -0.26 0.00 -0.37 0.00 0.00 57.07 55.62 1bzf s TYR 155 Cb -0.08 -4.38 -0.10 0.00 -0.40 0.00 0.00 41.96 37.01 1bzf s TYR 155 CO -0.02 -1.69 0.99 -1.21 -1.57 0.00 0.00 175.55 172.05 1bzf s GLU 156 N 3.96 4.47 -0.31 -0.62 2.02 -0.84 -1.84 118.70 125.54 1bzf s GLU 156 Ca 0.29 1.42 -0.01 0.00 0.02 0.00 0.00 54.97 56.69 1bzf s GLU 156 Cb -0.10 -2.76 0.10 0.00 0.10 0.00 0.00 34.13 31.46 1bzf s GLU 156 CO 0.03 0.16 0.11 0.08 0.02 0.00 0.00 175.26 175.65 1bzf s VAL 157 N -1.58 0.69 0.43 2.63 1.01 -1.01 -2.87 120.40 119.69 1bzf s VAL 157 Ca 0.52 -1.31 0.04 0.00 0.00 0.00 0.00 61.98 61.23 1bzf s VAL 157 Cb -0.21 -1.53 0.00 0.00 0.00 0.00 0.00 36.38 34.65 1bzf s VAL 157 CO 0.26 -0.70 0.60 0.26 0.00 0.00 0.00 175.10 175.53 1bzf s TRP 158 N 1.67 3.03 -0.08 5.22 0.52 -1.17 -2.62 118.94 125.50 1bzf s TRP 158 Ca 0.10 -0.10 -0.07 0.00 0.02 0.00 0.00 56.10 56.05 1bzf s TRP 158 Cb -0.17 -2.31 0.02 0.00 -1.15 0.00 0.00 33.47 29.86 1bzf s TRP 158 CO -0.27 -0.36 0.22 -0.65 0.02 0.00 0.00 176.95 175.91 1bzf s GLN 159 N -4.43 0.24 -0.54 4.98 -0.21 -0.77 -2.80 119.66 116.13 1bzf s GLN 159 Ca 0.50 0.32 -0.27 0.00 0.02 0.00 0.00 55.36 55.94 1bzf s GLN 159 Cb -0.10 0.09 -0.03 0.00 1.00 0.00 0.00 33.01 33.98 1bzf s GLN 159 CO 0.35 -0.05 1.90 0.21 -2.12 0.00 0.00 175.29 175.58 1bzf s LYS 160 N 0.25 2.72 -0.18 2.91 2.20 -0.96 -2.33 119.74 124.34 1bzf s LYS 160 Ca -0.01 0.85 -0.05 0.00 -0.36 0.00 0.00 55.97 56.40 1bzf s LYS 160 Cb -0.03 -4.37 0.09 0.00 -1.51 0.00 0.00 37.83 32.02 1bzf s LYS 160 CO -0.01 -2.61 0.34 0.21 -0.36 0.00 0.00 175.35 172.92 1bzf s LYS 161 N 6.88 0.26 0.00 4.03 2.20 -1.26 -5.01 119.74 126.84 1bzf s LYS 161 Ca 0.73 0.77 0.24 0.00 -0.36 0.00 0.00 55.97 57.35 1bzf s LYS 161 Cb -0.15 -0.07 1.44 0.00 -1.51 0.00 0.00 37.83 37.54 1bzf s LYS 161 CO 0.24 -0.37 1.81 0.00 -0.36 0.00 0.00 175.35 176.66