#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 0.81 0.21 2.41 0.00 -1.03 -3.03 121.76 121.13 1bzf s ALA 2 Ca 0.00 -0.19 -0.05 0.00 0.00 0.00 0.00 51.96 51.72 1bzf s ALA 2 Cb 0.00 -0.70 -0.06 0.00 0.00 0.00 0.00 23.12 22.36 1bzf s ALA 2 CO 0.00 -0.35 0.46 -0.06 0.00 0.00 0.00 175.76 175.81 1bzf s PHE 3 N 1.68 3.46 -0.30 0.00 0.40 -1.16 -0.59 117.98 121.48 1bzf s PHE 3 Ca 0.01 0.63 -0.05 0.00 -0.60 0.00 0.00 56.93 56.92 1bzf s PHE 3 Cb -0.13 -2.07 0.18 0.00 0.51 0.00 0.00 43.02 41.51 1bzf s PHE 3 CO -0.05 0.32 0.71 -1.17 0.70 0.00 0.00 175.22 175.74 1bzf s LEU 4 N -3.00 -1.15 -0.02 -0.37 2.96 -0.97 -1.97 118.68 114.16 1bzf s LEU 4 Ca 0.43 0.80 -0.02 0.00 -0.22 0.00 0.00 54.13 55.11 1bzf s LEU 4 Cb -0.11 2.00 0.01 0.00 0.50 0.00 0.00 46.19 48.58 1bzf s LEU 4 CO 0.26 -0.22 0.07 -1.66 -1.32 0.00 0.00 176.35 173.48 1bzf s TRP 5 N 2.87 -0.07 -0.45 5.38 -2.14 -1.14 -4.37 118.94 119.02 1bzf s TRP 5 Ca 0.14 0.18 -0.21 0.00 2.66 0.00 0.00 56.10 58.86 1bzf s TRP 5 Cb -0.14 0.02 0.03 0.00 -3.10 0.00 0.00 33.47 30.29 1bzf s TRP 5 CO -0.19 -0.04 0.69 0.00 -2.66 0.00 0.00 176.95 174.76 1bzf s ALA 6 N 0.03 3.33 0.05 2.67 0.00 -1.26 -3.00 121.76 123.58 1bzf s ALA 6 Ca -0.00 -1.21 0.05 0.00 0.00 0.00 0.00 51.96 50.80 1bzf s ALA 6 Cb -0.00 -3.37 -0.02 0.00 0.00 0.00 0.00 23.12 19.72 1bzf s ALA 6 CO 0.00 -1.87 -0.14 1.14 0.00 0.00 0.00 175.76 174.88 1bzf s GLN 7 N 2.98 0.91 0.53 0.00 -2.07 -1.05 -4.41 119.66 116.54 1bzf s GLN 7 Ca 0.24 -0.84 0.03 0.00 -1.82 0.00 0.00 55.36 52.97 1bzf s GLN 7 Cb -0.14 -0.93 0.03 0.00 -1.09 0.00 0.00 33.01 30.88 1bzf s GLN 7 CO 0.19 0.22 0.74 0.16 -1.32 0.00 0.00 175.29 175.28 1bzf s ASP 8 N -1.36 5.34 0.54 12.60 1.47 -1.02 -3.68 116.67 130.56 1bzf s ASP 8 Ca 0.01 -0.11 0.36 0.00 1.18 0.00 0.00 52.55 53.99 1bzf s ASP 8 Cb -0.09 -0.80 1.93 0.00 -0.34 0.00 0.00 42.92 43.62 1bzf s ASP 8 CO 0.02 -1.08 2.10 0.08 0.68 0.00 0.00 175.17 176.97 1bzf h ARG 9 N 0.18 0.00 -0.43 2.11 0.11 -1.85 -1.14 114.38 113.35 1bzf h ARG 9 Ca -0.41 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.67 1bzf h ARG 9 Cb 1.29 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.37 1bzf h ARG 9 CO 0.50 0.00 0.00 -0.25 0.10 0.00 0.00 179.97 180.32 1bzf n ASP 10 N -2.78 0.43 -2.88 0.08 9.92 -1.26 -4.80 116.55 115.25 1bzf n ASP 10 Ca -0.02 -1.76 -0.21 0.00 -0.53 0.00 0.00 54.79 52.27 1bzf n ASP 10 Cb 0.08 -0.22 0.04 0.00 -0.64 0.00 0.00 41.12 40.38 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 -0.40 3.82 0.44 0.00 -0.43 -5.00 105.19 103.83 1bzf n GLY 11 Ca 0.00 0.07 -0.22 0.00 0.00 0.00 0.00 46.02 45.87 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 -6.23 3.37 0.00 0.99 2.96 -1.23 -3.43 118.68 115.11 1bzf s LEU 12 Ca 0.34 -0.74 0.00 0.00 -0.22 0.00 0.00 54.13 53.51 1bzf s LEU 12 Cb -0.15 -1.93 0.00 0.00 0.50 0.00 0.00 46.19 44.61 1bzf s LEU 12 CO 0.42 -0.48 0.00 2.30 -1.32 0.00 0.00 176.35 177.27 1bzf n ILE 13 N -1.37 0.00 -2.98 6.68 -5.35 -1.19 -2.43 119.36 112.73 1bzf n ILE 13 Ca -0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 1bzf n ILE 13 Cb 0.62 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.52 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 0.40 2.12 3.22 3.28 0.00 -1.26 -4.76 105.19 108.20 1bzf n GLY 14 Ca 0.00 -1.02 0.04 0.00 0.00 0.00 0.00 46.02 45.04 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 -1.83 0.14 -1.55 1.61 2.20 -0.37 -4.05 119.74 115.88 1bzf s LYS 15 Ca 0.00 0.31 -0.05 0.00 -0.36 0.00 0.00 55.97 55.87 1bzf s LYS 15 Cb 0.00 0.18 0.01 0.00 -1.51 0.00 0.00 37.83 36.51 1bzf s LYS 15 CO 0.00 -0.09 0.67 -0.25 -0.36 0.00 0.00 175.35 175.32 1bzf n ASP 16 N 5.01 -6.20 0.00 1.43 9.92 -1.26 -2.91 116.55 122.54 1bzf n ASP 16 Ca -0.08 -0.31 0.00 0.00 -0.53 0.00 0.00 54.79 53.87 1bzf n ASP 16 Cb 0.54 -4.99 0.00 0.00 -0.64 0.00 0.00 41.12 36.03 1bzf n ASP 16 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1bzf n GLY 17 N -1.58 1.93 3.88 0.44 0.00 -1.26 -4.94 105.19 103.67 1bzf n GLY 17 Ca -0.10 -0.23 -0.29 0.00 0.00 0.00 0.00 46.02 45.40 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 2.72 0.55 1.61 -3.43 -1.15 -4.98 115.29 110.61 1bzf s HIS 18 Ca 0.00 0.72 -0.14 0.00 -0.80 0.00 0.00 55.06 54.83 1bzf s HIS 18 Cb 0.00 -3.55 -0.06 0.00 -1.43 0.00 0.00 32.58 27.53 1bzf s HIS 18 CO 0.00 -1.98 0.99 -0.51 -2.00 0.00 0.00 174.74 171.24 1bzf s LEU 19 N -5.69 3.49 0.20 5.38 1.43 -1.26 -1.24 118.68 120.99 1bzf s LEU 19 Ca 0.64 1.49 0.11 0.00 -1.03 0.00 0.00 54.13 55.34 1bzf s LEU 19 Cb -0.11 -4.46 -0.07 0.00 0.03 0.00 0.00 46.19 41.58 1bzf s LEU 19 CO 0.50 -0.68 1.35 1.55 0.23 0.00 0.00 176.35 179.30 1bzf h PRO 20 N 0.47 0.00 -6.16 1.29 0.13 -1.83 -3.45 132.00 122.45 1bzf h PRO 20 Ca -0.46 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 -0.06 0.00 0.13 0.00 0.00 31.00 32.26 1bzf h PRO 20 CO 0.62 0.73 -0.52 1.67 -0.23 0.00 0.00 178.00 180.28 1bzf s TRP 21 N -2.84 2.85 -0.63 1.56 -2.14 -1.26 -5.07 118.94 111.41 1bzf s TRP 21 Ca 0.02 -0.29 0.01 0.00 2.66 0.00 0.00 56.10 58.51 1bzf s TRP 21 Cb 0.09 -1.60 0.16 0.00 -3.10 0.00 0.00 33.47 29.01 1bzf s TRP 21 CO 0.78 0.35 0.42 -1.58 -2.66 0.00 0.00 176.95 174.25 1bzf s HIS 22 N -2.32 3.39 -0.96 1.66 2.46 -1.26 -5.00 115.29 113.26 1bzf s HIS 22 Ca 0.37 -3.02 -0.04 0.00 0.47 0.00 0.00 55.06 52.84 1bzf s HIS 22 Cb -0.05 -2.99 0.24 0.00 -0.13 0.00 0.00 32.58 29.65 1bzf s HIS 22 CO 0.24 -0.75 0.88 -1.17 -2.47 0.00 0.00 174.74 171.47 1bzf s LEU 23 N -0.50 5.80 0.39 8.88 2.96 -1.26 -4.90 118.68 130.05 1bzf s LEU 23 Ca 0.19 -3.68 0.20 0.00 -0.22 0.00 0.00 54.13 50.63 1bzf s LEU 23 Cb -0.19 -2.00 1.18 0.00 0.50 0.00 0.00 46.19 45.68 1bzf s LEU 23 CO -0.05 -0.22 1.69 -0.65 -1.32 0.00 0.00 176.35 175.81 1bzf h PRO 24 N 6.23 0.29 -0.34 0.98 0.10 -1.99 0.16 132.00 137.42 1bzf h PRO 24 Ca 0.16 -0.02 -0.02 0.00 0.10 0.00 0.00 66.00 66.23 1bzf h PRO 24 Cb 0.83 -0.07 -0.02 0.00 0.10 0.00 0.00 31.00 31.85 1bzf h PRO 24 CO 0.90 0.19 0.15 0.22 0.10 0.00 0.00 178.00 179.57 1bzf h ASP 25 N 0.30 0.46 -0.56 -2.05 1.82 -2.00 -2.39 116.42 111.99 1bzf h ASP 25 Ca 0.70 -0.14 -0.04 0.00 -0.39 0.00 0.00 57.03 57.16 1bzf h ASP 25 Cb 1.84 -0.12 -0.03 0.00 0.68 0.00 0.00 39.33 41.71 1bzf h ASP 25 CO -0.43 0.47 0.23 -0.78 -1.61 0.00 0.00 179.24 177.12 1bzf h ASP 26 N 0.41 0.81 0.33 2.28 3.58 -1.12 -1.16 116.42 121.56 1bzf h ASP 26 Ca 0.12 -0.11 -0.02 0.00 0.42 0.00 0.00 57.03 57.43 1bzf h ASP 26 Cb 0.14 -0.21 -0.00 0.00 1.72 0.00 0.00 39.33 40.98 1bzf h ASP 26 CO -0.01 0.74 -0.09 -0.07 -2.88 0.00 0.00 179.24 176.93 1bzf h LEU 27 N 0.87 0.00 0.00 2.28 3.38 -1.03 -1.84 115.31 118.98 1bzf h LEU 27 Ca 0.20 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.95 1bzf h LEU 27 Cb 0.19 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 1bzf h LEU 27 CO -0.02 0.09 -1.28 0.45 0.09 0.00 0.00 178.44 177.77 1bzf h HIS 28 N 0.00 0.00 0.00 1.13 3.86 -0.75 -3.30 115.15 116.09 1bzf h HIS 28 Ca -0.00 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.10 1bzf h HIS 28 Cb 0.28 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.73 1bzf h HIS 28 CO 0.00 0.89 -0.50 -0.92 0.86 0.00 0.00 177.93 178.26 1bzf h TYR 29 N 0.00 0.00 -0.29 2.45 3.20 -0.65 -3.00 116.97 118.68 1bzf h TYR 29 Ca -0.14 0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.68 1bzf h TYR 29 Cb 1.80 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 40.06 1bzf h TYR 29 CO 0.00 0.50 -0.02 0.35 -1.64 0.00 0.00 178.16 177.35 1bzf h PHE 30 N 0.00 0.58 -0.11 -3.82 3.57 -1.47 -0.19 116.94 115.51 1bzf h PHE 30 Ca -0.01 -0.11 -0.07 0.00 3.53 0.00 0.00 57.97 61.32 1bzf h PHE 30 Cb 1.13 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.71 1bzf h PHE 30 CO 0.00 0.69 -0.24 -0.09 -2.23 0.00 0.00 178.31 176.43 1bzf h ARG 31 N 0.30 0.18 -0.00 1.11 2.43 -1.64 -2.41 114.38 114.35 1bzf h ARG 31 Ca 0.08 -0.06 -0.18 0.00 -0.81 0.00 0.00 59.98 59.01 1bzf h ARG 31 Cb 0.47 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.99 1bzf h ARG 31 CO 0.02 0.42 -0.83 0.00 -1.51 0.00 0.00 179.97 178.07 1bzf h ALA 32 N 1.59 0.61 -0.81 2.80 0.00 -1.35 -2.93 119.26 119.17 1bzf h ALA 32 Ca 0.03 -0.72 -0.44 0.00 0.00 0.00 0.00 54.91 53.78 1bzf h ALA 32 Cb 0.53 -0.10 -0.25 0.00 0.00 0.00 0.00 17.79 17.96 1bzf h ALA 32 CO 0.04 0.95 0.56 1.04 0.00 0.00 0.00 179.25 181.84 1bzf n GLN 33 N -3.63 2.06 0.00 0.00 1.13 -0.11 -4.15 117.38 112.69 1bzf n GLN 33 Ca -0.02 -2.48 0.00 0.00 -1.94 0.00 0.00 57.00 52.56 1bzf n GLN 33 Cb 0.78 -1.97 0.00 0.00 0.11 0.00 0.00 30.24 29.16 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 -0.79 0.00 -2.46 5.09 -2.24 -1.05 -4.93 114.28 107.90 1bzf n THR 34 Ca 0.49 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.85 1bzf n THR 34 Cb 1.35 -0.11 -0.03 0.00 -2.10 0.00 0.00 70.33 69.43 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 -1.16 4.15 0.00 2.28 -7.23 -1.11 -2.87 120.40 114.45 1bzf s VAL 35 Ca 0.00 1.54 0.00 0.00 -1.81 0.00 0.00 61.98 61.71 1bzf s VAL 35 Cb 0.00 -3.99 0.00 0.00 0.56 0.00 0.00 36.38 32.95 1bzf s VAL 35 CO 0.00 0.11 0.00 0.61 -0.31 0.00 0.00 175.10 175.51 1bzf n GLY 36 N 3.19 3.07 3.90 2.32 0.00 -1.26 -5.00 105.19 111.41 1bzf n GLY 36 Ca 0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.22 2.25 -0.25 1.61 3.01 -1.14 -4.47 119.74 120.53 1bzf s LYS 37 Ca 0.00 -2.06 -0.13 0.00 -1.01 0.00 0.00 55.97 52.77 1bzf s LYS 37 Cb 0.00 -2.05 -0.05 0.00 -1.01 0.00 0.00 37.83 34.72 1bzf s LYS 37 CO 0.00 -0.62 0.26 0.42 0.51 0.00 0.00 175.35 175.92 1bzf s ILE 38 N -2.79 5.28 -0.61 2.17 1.01 -0.66 -3.62 121.20 121.98 1bzf s ILE 38 Ca 0.31 0.36 -0.22 0.00 0.00 0.00 0.00 60.65 61.09 1bzf s ILE 38 Cb -0.02 -3.59 0.06 0.00 0.01 0.00 0.00 42.46 38.92 1bzf s ILE 38 CO 0.19 0.27 0.91 -0.32 0.00 0.00 0.00 174.94 175.99 1bzf s MET 39 N 1.48 3.17 -0.33 2.79 -2.45 -0.86 -2.72 119.30 120.38 1bzf s MET 39 Ca 0.11 -0.70 -0.17 0.00 -1.25 0.00 0.00 55.69 53.68 1bzf s MET 39 Cb -0.15 -4.17 -0.01 0.00 1.25 0.00 0.00 34.83 31.76 1bzf s MET 39 CO 0.08 -1.65 0.46 0.08 1.05 0.00 0.00 175.02 175.04 1bzf s VAL 40 N 3.82 5.08 0.15 10.11 1.01 -1.02 -2.29 120.40 137.25 1bzf s VAL 40 Ca 0.23 0.32 -0.01 0.00 0.00 0.00 0.00 61.98 62.52 1bzf s VAL 40 Cb -0.16 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.29 1bzf s VAL 40 CO 0.13 -0.12 0.07 0.68 0.00 0.00 0.00 175.10 175.86 1bzf s VAL 41 N 2.25 0.10 0.02 2.92 -7.23 -0.68 -3.05 120.40 114.72 1bzf s VAL 41 Ca 0.16 -1.93 -0.00 0.00 -1.81 0.00 0.00 61.98 58.40 1bzf s VAL 41 Cb -0.16 -2.15 0.00 0.00 0.56 0.00 0.00 36.38 34.64 1bzf s VAL 41 CO 0.12 -0.36 0.02 0.61 -0.31 0.00 0.00 175.10 175.18 1bzf n GLY 42 N -0.14 -0.14 0.09 2.32 0.00 -0.87 -1.36 105.19 105.10 1bzf n GLY 42 Ca -0.04 -1.82 -0.12 0.00 0.00 0.00 0.00 46.02 44.04 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 0.18 -0.11 1.61 0.11 -1.94 -1.93 114.38 112.30 1bzf h ARG 43 Ca -0.01 -0.29 -0.15 0.00 0.10 0.00 0.00 59.98 59.63 1bzf h ARG 43 Cb 0.02 0.11 -0.01 0.00 1.11 0.00 0.00 29.97 31.20 1bzf h ARG 43 CO 0.01 1.13 -0.58 -0.09 0.10 0.00 0.00 179.97 180.53 1bzf h ARG 44 N 0.05 0.34 0.02 0.08 2.43 -1.94 -2.77 114.38 112.60 1bzf h ARG 44 Ca -0.09 -0.23 -0.23 0.00 -0.81 0.00 0.00 59.98 58.63 1bzf h ARG 44 Cb 1.86 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 31.42 1bzf h ARG 44 CO 0.17 0.83 -1.12 1.15 -1.51 0.00 0.00 179.97 179.49 1bzf h THR 45 N 0.26 1.59 0.00 0.20 2.02 -1.91 -2.53 112.91 112.53 1bzf h THR 45 Ca -0.00 -3.29 -0.07 0.00 0.77 0.00 0.00 66.41 63.82 1bzf h THR 45 Cb 1.10 2.82 -0.01 0.00 -1.74 0.00 0.00 68.15 70.31 1bzf h THR 45 CO 0.10 0.92 -0.32 0.22 0.37 0.00 0.00 175.52 176.80 1bzf h TYR 46 N 0.01 0.00 0.00 3.16 3.20 -1.26 -2.57 116.97 119.51 1bzf h TYR 46 Ca -0.06 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.81 1bzf h TYR 46 Cb 1.83 0.00 0.00 0.00 1.54 0.00 0.00 36.73 40.10 1bzf h TYR 46 CO 0.01 0.32 -1.08 0.39 -1.64 0.00 0.00 178.16 176.16 1bzf n GLU 47 N -4.04 0.51 0.29 1.82 -0.58 -1.05 -3.92 120.64 113.65 1bzf n GLU 47 Ca -0.02 0.05 0.15 0.00 -0.42 0.00 0.00 57.16 56.92 1bzf n GLU 47 Cb 0.38 -1.72 0.86 0.00 -0.57 0.00 0.00 31.44 30.38 1bzf n GLU 47 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 1bzf h SER 48 N 0.00 0.00 -4.23 1.62 4.64 -1.01 -3.43 113.55 111.13 1bzf h SER 48 Ca 0.00 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.81 1bzf h SER 48 Cb 0.91 0.00 0.17 0.00 -0.31 0.00 0.00 62.40 63.17 1bzf h SER 48 CO 0.00 0.05 0.26 -0.36 -0.87 0.00 0.00 176.83 175.91 1bzf s PHE 49 N -4.36 2.07 -0.02 4.77 0.08 -1.24 -4.83 117.98 114.45 1bzf s PHE 49 Ca -0.04 1.63 -0.00 0.00 0.12 0.00 0.00 56.93 58.64 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 -2.39 0.02 -1.00 -0.10 0.00 0.00 175.22 172.30 1bzf h PRO 50 N -1.56 -0.00 -5.18 0.24 0.13 -1.93 -3.45 132.00 120.24 1bzf h PRO 50 Ca -0.44 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.06 1bzf h PRO 50 Cb 1.26 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.21 1bzf h PRO 50 CO 0.47 -0.00 -0.57 0.15 -0.23 0.00 0.00 178.00 177.82 1bzf s LYS 51 N -1.15 3.91 0.21 0.86 3.01 -1.26 -5.10 119.74 120.23 1bzf s LYS 51 Ca -0.00 -0.37 0.10 0.00 -1.01 0.00 0.00 55.97 54.69 1bzf s LYS 51 Cb 0.00 -3.28 -0.05 0.00 -1.01 0.00 0.00 37.83 33.50 1bzf s LYS 51 CO 0.00 0.14 -0.19 1.03 0.51 0.00 0.00 175.35 176.84 1bzf s ARG 52 N 0.75 1.44 0.00 1.68 0.52 -1.26 -4.63 118.95 117.44 1bzf s ARG 52 Ca 0.04 -1.57 0.00 0.00 -0.52 0.00 0.00 55.73 53.68 1bzf s ARG 52 Cb -0.13 -1.49 0.00 0.00 0.52 0.00 0.00 34.95 33.85 1bzf s ARG 52 CO 0.02 0.29 0.00 -0.35 0.02 0.00 0.00 175.30 175.28 1bzf n PRO 53 N -0.11 0.36 -3.77 3.54 -0.04 -1.26 -5.09 135.00 128.62 1bzf n PRO 53 Ca -0.10 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.00 1bzf n PRO 53 Cb 0.58 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.93 1bzf n PRO 53 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1bzf s LEU 54 N 0.00 5.20 0.00 1.53 1.43 -1.26 -5.09 118.68 120.49 1bzf s LEU 54 Ca 0.00 -2.37 -0.15 0.00 -1.03 0.00 0.00 54.13 50.57 1bzf s LEU 54 Cb 0.00 -1.83 0.22 0.00 0.03 0.00 0.00 46.19 44.62 1bzf s LEU 54 CO 0.00 -0.46 0.91 -0.81 0.23 0.00 0.00 176.35 176.21 1bzf n PRO 55 N 4.13 -2.28 -2.00 1.29 -0.05 -1.26 -4.17 135.00 130.65 1bzf n PRO 55 Ca 0.02 -1.43 -0.19 0.00 -0.05 0.00 0.00 63.50 61.84 1bzf n PRO 55 Cb 0.40 -1.23 -0.04 0.00 -0.05 0.00 0.00 33.50 32.57 1bzf n PRO 55 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 175.50 175.84 1bzf n GLU 56 N -3.90 -1.45 -3.90 0.54 1.02 -1.26 -4.89 120.64 106.79 1bzf n GLU 56 Ca 0.12 1.05 0.02 0.00 -0.02 0.00 0.00 57.16 58.33 1bzf n GLU 56 Cb 0.46 -5.51 0.01 0.00 -0.02 0.00 0.00 31.44 26.38 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 -4.37 0.40 -0.16 3.49 1.70 -1.26 -4.00 118.95 114.76 1bzf s ARG 57 Ca 0.00 -0.25 -0.13 0.00 -0.47 0.00 0.00 55.73 54.88 1bzf s ARG 57 Cb 0.00 0.12 -0.05 0.00 -0.57 0.00 0.00 34.95 34.45 1bzf s ARG 57 CO 0.00 -0.19 0.27 0.99 -1.08 0.00 0.00 175.30 175.30 1bzf s THR 58 N -2.11 5.31 -0.51 4.99 2.01 -1.24 -5.00 115.64 119.10 1bzf s THR 58 Ca 0.26 0.51 -0.14 0.00 0.31 0.00 0.00 61.69 62.63 1bzf s THR 58 Cb 0.01 -3.61 0.12 0.00 0.01 0.00 0.00 72.50 69.03 1bzf s THR 58 CO -0.01 0.41 0.44 0.20 -0.69 0.00 0.00 174.62 174.97 1bzf s ASN 59 N 0.33 6.02 -0.36 3.53 0.02 -1.26 -2.02 114.94 121.20 1bzf s ASN 59 Ca 0.16 -1.79 -0.05 0.00 -1.02 0.00 0.00 52.86 50.15 1bzf s ASN 59 Cb -0.13 -2.14 0.06 0.00 0.02 0.00 0.00 41.25 39.06 1bzf s ASN 59 CO 0.04 -0.79 0.13 -0.69 0.02 0.00 0.00 177.10 175.81 1bzf s VAL 60 N 1.52 3.62 -0.13 1.60 1.01 -0.97 0.21 120.40 127.27 1bzf s VAL 60 Ca 0.04 -1.41 -0.09 0.00 0.00 0.00 0.00 61.98 60.52 1bzf s VAL 60 Cb -0.28 -3.17 -0.04 0.00 0.00 0.00 0.00 36.38 32.88 1bzf s VAL 60 CO 0.02 -0.33 0.18 -0.69 0.00 0.00 0.00 175.10 174.28 1bzf s VAL 61 N 1.33 5.42 -0.22 2.92 1.01 -1.07 -1.69 120.40 128.09 1bzf s VAL 61 Ca 0.00 0.30 -0.09 0.00 0.00 0.00 0.00 61.98 62.20 1bzf s VAL 61 Cb -0.21 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.66 1bzf s VAL 61 CO 0.01 0.56 0.11 -0.22 0.00 0.00 0.00 175.10 175.55 1bzf s LEU 62 N -0.60 3.88 -0.14 3.92 2.96 -0.46 -1.60 118.68 126.65 1bzf s LEU 62 Ca 0.14 0.04 -0.17 0.00 -0.22 0.00 0.00 54.13 53.92 1bzf s LEU 62 Cb -0.12 -2.02 0.04 0.00 0.50 0.00 0.00 46.19 44.59 1bzf s LEU 62 CO 0.04 0.09 0.47 0.28 -1.32 0.00 0.00 176.35 175.90 1bzf s THR 63 N 0.90 0.01 -0.12 3.68 -1.32 -1.13 -3.63 115.64 114.03 1bzf s THR 63 Ca 0.06 -0.07 -0.11 0.00 -1.21 0.00 0.00 61.69 60.35 1bzf s THR 63 Cb -0.13 -0.68 -0.26 0.00 -1.51 0.00 0.00 72.50 69.91 1bzf s THR 63 CO 0.03 -0.04 0.43 0.45 -2.21 0.00 0.00 174.62 173.28 1bzf h HIS 64 N 4.98 0.44 -3.34 9.09 3.86 -1.90 -3.39 115.15 124.90 1bzf h HIS 64 Ca -0.28 -0.32 -0.52 0.00 -1.16 0.00 0.00 60.37 58.09 1bzf h HIS 64 Cb 1.17 -0.02 0.02 0.00 1.06 0.00 0.00 27.41 29.65 1bzf h HIS 64 CO 0.41 1.68 0.60 -0.65 0.86 0.00 0.00 177.93 180.84 1bzf s GLN 65 N -2.52 4.43 -0.14 2.45 -1.52 -1.26 -4.89 119.66 116.22 1bzf s GLN 65 Ca -0.22 1.92 0.01 0.00 -1.95 0.00 0.00 55.36 55.13 1bzf s GLN 65 Cb 0.06 -3.25 0.20 0.00 -0.22 0.00 0.00 33.01 29.79 1bzf s GLN 65 CO 0.76 -0.20 1.31 -1.91 -0.25 0.00 0.00 175.29 174.99 1bzf n GLU 66 N 2.99 1.38 -0.11 2.91 2.13 -1.26 -3.81 120.64 124.87 1bzf n GLU 66 Ca 0.07 -0.90 -0.13 0.00 0.66 0.00 0.00 57.16 56.86 1bzf n GLU 66 Cb 0.44 -1.35 -0.13 0.00 0.27 0.00 0.00 31.44 30.67 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 0.05 1.22 -4.77 4.31 2.03 -1.26 -4.96 116.55 113.17 1bzf n ASP 67 Ca 0.18 -0.07 -0.36 0.00 0.52 0.00 0.00 54.79 55.06 1bzf n ASP 67 Cb 0.84 0.28 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 -2.48 2.72 0.02 -0.67 5.04 -1.25 -5.04 117.35 115.69 1bzf s TYR 68 Ca -0.21 1.53 -0.10 0.00 -2.44 0.00 0.00 57.07 55.85 1bzf s TYR 68 Cb 0.07 -3.35 0.01 0.00 0.35 0.00 0.00 41.96 39.04 1bzf s TYR 68 CO 0.67 -1.63 0.22 -0.65 -1.34 0.00 0.00 175.55 172.82 1bzf s GLN 69 N -3.06 0.66 -0.01 4.97 -0.21 -1.26 -5.10 119.66 115.65 1bzf s GLN 69 Ca 0.70 -0.49 0.01 0.00 0.02 0.00 0.00 55.36 55.60 1bzf s GLN 69 Cb -0.26 0.28 0.00 0.00 1.00 0.00 0.00 33.01 34.02 1bzf s GLN 69 CO 0.31 -0.19 -0.04 0.00 -2.12 0.00 0.00 175.29 173.25 1bzf s ALA 70 N -2.11 0.36 -0.22 6.09 0.00 -1.26 -5.12 121.76 119.50 1bzf s ALA 70 Ca -0.09 -0.14 -0.23 0.00 0.00 0.00 0.00 51.96 51.50 1bzf s ALA 70 Cb -0.03 -0.12 -0.01 0.00 0.00 0.00 0.00 23.12 22.95 1bzf s ALA 70 CO -0.01 0.07 0.76 -0.65 0.00 0.00 0.00 175.76 175.92 1bzf s GLN 71 N 0.04 4.21 -0.48 0.00 -1.52 -1.26 -3.95 119.66 116.70 1bzf s GLN 71 Ca -0.00 0.83 -0.01 0.00 -1.95 0.00 0.00 55.36 54.24 1bzf s GLN 71 Cb -0.03 -3.61 0.00 0.00 -0.22 0.00 0.00 33.01 29.14 1bzf s GLN 71 CO -0.00 -0.40 0.40 0.41 -0.25 0.00 0.00 175.29 175.45 1bzf n GLY 72 N 3.75 0.17 3.53 3.09 0.00 -1.26 -4.81 105.19 109.66 1bzf n GLY 72 Ca 0.03 -0.26 -0.14 0.00 0.00 0.00 0.00 46.02 45.65 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 -3.14 -1.55 -0.71 4.61 0.00 -1.25 -4.68 121.76 115.04 1bzf s ALA 73 Ca 0.04 1.74 -0.26 0.00 0.00 0.00 0.00 51.96 53.48 1bzf s ALA 73 Cb -0.02 -0.98 0.04 0.00 0.00 0.00 0.00 23.12 22.16 1bzf s ALA 73 CO 0.28 -0.30 1.19 0.08 0.00 0.00 0.00 175.76 177.01 1bzf s VAL 74 N 0.26 3.90 -0.76 0.00 1.01 0.13 -4.81 120.40 120.13 1bzf s VAL 74 Ca -0.01 0.24 -0.27 0.00 0.00 0.00 0.00 61.98 61.95 1bzf s VAL 74 Cb -0.04 -4.84 0.03 0.00 0.00 0.00 0.00 36.38 31.53 1bzf s VAL 74 CO 0.01 -1.71 1.33 -0.69 0.00 0.00 0.00 175.10 174.04 1bzf s VAL 75 N 5.23 3.72 0.55 2.92 1.01 -1.26 -2.61 120.40 129.96 1bzf s VAL 75 Ca 0.32 0.27 -0.05 0.00 0.00 0.00 0.00 61.98 62.53 1bzf s VAL 75 Cb -0.10 -4.88 -0.00 0.00 0.00 0.00 0.00 36.38 31.39 1bzf s VAL 75 CO 0.14 -1.82 0.84 0.68 0.00 0.00 0.00 175.10 174.95 1bzf s VAL 76 N 5.84 3.90 -0.02 2.92 -7.23 -0.62 -4.97 120.40 120.21 1bzf s VAL 76 Ca 0.38 -0.06 0.25 0.00 -1.81 0.00 0.00 61.98 60.74 1bzf s VAL 76 Cb -0.07 -3.52 0.43 0.00 0.56 0.00 0.00 36.38 33.78 1bzf s VAL 76 CO 0.13 -0.50 1.17 1.41 -0.31 0.00 0.00 175.10 177.00 1bzf n HIS 77 N -2.45 0.00 -3.63 2.82 8.25 -1.26 -2.84 115.22 116.11 1bzf n HIS 77 Ca 0.03 -0.60 -0.07 0.00 -0.26 0.00 0.00 57.72 56.83 1bzf n HIS 77 Cb 0.57 -0.16 -0.06 0.00 1.12 0.00 0.00 29.99 31.46 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 -2.12 -0.29 0.33 0.41 2.15 -1.26 -4.89 116.67 111.00 1bzf s ASP 78 Ca 0.34 0.49 0.07 0.00 0.43 0.00 0.00 52.55 53.89 1bzf s ASP 78 Cb 0.39 0.47 0.59 0.00 -0.30 0.00 0.00 42.92 44.07 1bzf s ASP 78 CO -0.16 -0.15 1.79 0.58 -0.17 0.00 0.00 175.17 177.07 1bzf h VAL 79 N 3.08 1.25 -0.22 1.11 2.07 -1.97 -2.54 116.25 119.03 1bzf h VAL 79 Ca -0.24 -1.18 -0.11 0.00 0.82 0.00 0.00 66.70 65.99 1bzf h VAL 79 Cb 1.18 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 32.38 1bzf h VAL 79 CO 0.18 0.36 -0.32 0.00 0.02 0.00 0.00 177.57 177.82 1bzf h ALA 80 N 1.49 1.04 -0.24 1.67 0.00 -1.99 -2.69 119.26 118.53 1bzf h ALA 80 Ca 0.04 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 54.47 1bzf h ALA 80 Cb 0.61 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1bzf h ALA 80 CO 0.04 0.59 -0.26 0.00 0.00 0.00 0.00 179.25 179.62 1bzf h ALA 81 N 1.27 1.12 -0.38 0.00 0.00 -1.86 -1.26 119.26 118.16 1bzf h ALA 81 Ca 0.05 -0.34 -0.12 0.00 0.00 0.00 0.00 54.91 54.50 1bzf h ALA 81 Cb 0.75 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1bzf h ALA 81 CO 0.06 0.55 -0.25 0.28 0.00 0.00 0.00 179.25 179.90 1bzf h VAL 82 N 0.40 1.27 -0.00 0.00 2.07 -1.28 -2.59 116.25 116.12 1bzf h VAL 82 Ca 0.06 -1.36 -0.16 0.00 0.82 0.00 0.00 66.70 66.06 1bzf h VAL 82 Cb 0.67 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.66 1bzf h VAL 82 CO 0.05 0.45 -0.74 -0.26 0.02 0.00 0.00 177.57 177.10 1bzf h PHE 83 N 0.66 0.05 -0.59 1.57 0.04 -1.20 -2.94 116.94 114.51 1bzf h PHE 83 Ca 0.09 -0.02 -0.09 0.00 2.80 0.00 0.00 57.97 60.74 1bzf h PHE 83 Cb 0.76 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.88 1bzf h PHE 83 CO 0.04 0.76 0.01 0.00 -0.60 0.00 0.00 178.31 178.52 1bzf h ALA 84 N 1.24 0.90 -0.14 2.45 0.00 -0.98 -1.95 119.26 120.78 1bzf h ALA 84 Ca -0.01 -0.30 -0.12 0.00 0.00 0.00 0.00 54.91 54.48 1bzf h ALA 84 Cb 1.30 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1bzf h ALA 84 CO 0.10 0.65 -0.43 -0.92 0.00 0.00 0.00 179.25 178.65 1bzf h TYR 85 N 0.94 0.38 0.00 0.00 5.03 -1.43 -2.66 116.97 119.23 1bzf h TYR 85 Ca 0.17 -0.11 -0.07 0.00 2.58 0.00 0.00 58.73 61.30 1bzf h TYR 85 Cb 0.53 -0.08 -0.01 0.00 1.55 0.00 0.00 36.73 38.71 1bzf h TYR 85 CO 0.04 0.71 -0.35 0.00 -1.32 0.00 0.00 178.16 177.23 1bzf h ALA 86 N 1.28 1.05 -0.27 1.82 0.00 -1.29 -3.05 119.26 118.79 1bzf h ALA 86 Ca 0.02 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 1bzf h ALA 86 Cb 0.88 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1bzf h ALA 86 CO 0.07 0.44 0.06 -0.22 0.00 0.00 0.00 179.25 179.61 1bzf h LYS 87 N 0.00 0.43 0.00 0.00 3.64 -1.00 -2.41 116.57 117.24 1bzf h LYS 87 Ca -0.00 -0.10 -0.04 0.00 -1.27 0.00 0.00 60.65 59.23 1bzf h LYS 87 Cb 0.84 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.59 1bzf h LYS 87 CO 0.05 0.52 -0.17 1.96 -2.27 0.00 0.00 179.45 179.54 1bzf h GLN 88 N 0.27 0.00 -3.42 1.90 1.08 -1.53 -3.34 115.11 110.07 1bzf h GLN 88 Ca 0.08 0.00 -0.65 0.00 -1.45 0.00 0.00 58.65 56.64 1bzf h GLN 88 Cb 0.29 0.00 -0.40 0.00 -0.05 0.00 0.00 27.48 27.31 1bzf h GLN 88 CO 0.00 0.17 -0.60 -1.01 -0.95 0.00 0.00 178.83 176.45 1bzf s HIS 89 N -4.31 3.21 -0.20 2.96 3.76 -0.91 -4.91 115.29 114.90 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 0.16 0.00 1.11 0.00 0.00 32.58 31.13 1bzf s HIS 89 CO 0.64 -0.75 1.50 -1.00 -0.85 0.00 0.00 174.74 174.27 1bzf h PRO 90 N 6.56 0.00 0.00 8.40 0.13 -1.68 -3.21 132.00 142.20 1bzf h PRO 90 Ca -0.07 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.99 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 0.39 -0.30 0.38 -0.23 0.00 0.00 178.00 178.93 1bzf h ASP 91 N 0.00 0.00 -3.21 1.44 2.03 -1.90 -3.42 116.42 111.36 1bzf h ASP 91 Ca -0.00 0.00 -0.60 0.00 -0.73 0.00 0.00 57.03 55.70 1bzf h ASP 91 Cb 1.28 0.00 -0.10 0.00 -0.83 0.00 0.00 39.33 39.69 1bzf h ASP 91 CO 0.05 0.30 -0.34 -1.10 -1.03 0.00 0.00 179.24 177.12 1bzf s GLN 92 N -3.68 4.15 0.19 4.15 -0.21 -1.21 -4.94 119.66 118.11 1bzf s GLN 92 Ca -0.00 0.08 -0.03 0.00 0.02 0.00 0.00 55.36 55.43 1bzf s GLN 92 Cb 0.11 -3.39 -0.05 0.00 1.00 0.00 0.00 33.01 30.68 1bzf s GLN 92 CO 0.66 0.33 0.41 -1.21 -2.12 0.00 0.00 175.29 173.36 1bzf s GLU 93 N 0.20 3.57 0.04 2.91 0.41 -1.26 -4.81 118.70 119.76 1bzf s GLU 93 Ca 0.16 -0.19 -0.20 0.00 -0.41 0.00 0.00 54.97 54.33 1bzf s GLU 93 Cb -0.13 -2.82 -0.06 0.00 -1.78 0.00 0.00 34.13 29.34 1bzf s GLU 93 CO 0.04 0.40 0.60 -1.17 -0.49 0.00 0.00 175.26 174.64 1bzf s LEU 94 N -3.10 4.48 -0.06 1.80 2.96 -1.26 -1.65 118.68 121.85 1bzf s LEU 94 Ca 0.40 1.24 -0.01 0.00 -0.22 0.00 0.00 54.13 55.55 1bzf s LEU 94 Cb -0.11 -2.93 0.03 0.00 0.50 0.00 0.00 46.19 43.67 1bzf s LEU 94 CO 0.27 0.19 -0.01 -0.69 -1.32 0.00 0.00 176.35 174.79 1bzf s VAL 95 N -0.70 0.41 -0.27 1.68 1.01 -1.10 -2.46 120.40 118.98 1bzf s VAL 95 Ca 0.30 0.04 -0.17 0.00 0.00 0.00 0.00 61.98 62.16 1bzf s VAL 95 Cb -0.19 -0.53 -0.03 0.00 0.00 0.00 0.00 36.38 35.63 1bzf s VAL 95 CO 0.19 0.24 0.46 -0.63 0.00 0.00 0.00 175.10 175.36 1bzf s ILE 96 N 1.59 5.11 -0.18 2.22 -1.09 0.24 -2.44 121.20 126.65 1bzf s ILE 96 Ca -0.01 0.74 0.17 0.00 -2.23 0.00 0.00 60.65 59.31 1bzf s ILE 96 Cb -0.13 -3.78 -0.23 0.00 -1.58 0.00 0.00 42.46 36.74 1bzf s ILE 96 CO -0.04 0.10 0.07 0.00 -1.23 0.00 0.00 174.94 173.85 1bzf n ALA 97 N 5.46 1.57 0.00 9.38 0.00 -1.17 -2.29 120.51 133.46 1bzf n ALA 97 Ca -0.06 -1.21 0.00 0.00 0.00 0.00 0.00 53.44 52.17 1bzf n ALA 97 Cb 0.50 -0.16 0.00 0.00 0.00 0.00 0.00 19.45 19.80 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 1.84 -1.85 0.00 0.00 0.00 -1.26 -4.76 105.19 99.17 1bzf n GLY 98 Ca -0.30 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.54 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 -0.32 0.50 0.20 -0.02 0.00 -1.26 -2.05 105.19 102.24 1bzf n GLY 99 Ca 0.00 -1.63 0.00 0.00 0.00 0.00 0.00 46.02 44.39 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 1.29 0.00 4.61 0.00 -1.94 -2.38 119.26 119.03 1bzf h ALA 100 Ca 0.00 -0.35 -0.12 0.00 0.00 0.00 0.00 54.91 54.45 1bzf h ALA 100 Cb 0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1bzf h ALA 100 CO 0.00 0.50 -0.56 1.96 0.00 0.00 0.00 179.25 181.15 1bzf h GLN 101 N 0.13 0.00 -0.06 0.00 4.20 -2.00 -3.02 115.11 114.35 1bzf h GLN 101 Ca 0.02 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.52 1bzf h GLN 101 Cb 0.68 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.46 1bzf h GLN 101 CO 0.05 0.56 -0.82 0.82 -0.67 0.00 0.00 178.83 178.76 1bzf h ILE 102 N 0.00 1.36 -0.15 2.54 1.08 -1.70 -2.71 117.51 117.93 1bzf h ILE 102 Ca -0.01 -2.21 -0.01 0.00 -0.39 0.00 0.00 64.86 62.25 1bzf h ILE 102 Cb 1.12 2.20 -0.01 0.00 -3.07 0.00 0.00 36.82 37.06 1bzf h ILE 102 CO 0.07 0.67 0.06 -0.26 -0.69 0.00 0.00 178.15 178.00 1bzf h PHE 103 N 0.32 0.23 0.00 1.37 0.04 -1.39 -2.14 116.94 115.37 1bzf h PHE 103 Ca -0.06 -0.02 -0.03 0.00 2.80 0.00 0.00 57.97 60.67 1bzf h PHE 103 Cb 1.43 -0.07 -0.00 0.00 2.20 0.00 0.00 35.95 39.51 1bzf h PHE 103 CO 0.06 0.31 -0.13 1.79 -0.60 0.00 0.00 178.31 179.74 1bzf h THR 104 N 0.09 0.93 -0.18 -1.55 1.35 -1.57 0.82 112.91 112.80 1bzf h THR 104 Ca 0.05 -0.48 -0.13 0.00 -0.55 0.00 0.00 66.41 65.30 1bzf h THR 104 Cb 0.18 1.27 -0.01 0.00 -1.73 0.00 0.00 68.15 67.86 1bzf h THR 104 CO -0.00 0.13 -0.46 0.00 -0.25 0.00 0.00 175.52 174.94 1bzf h ALA 105 N 1.87 0.88 -0.64 6.62 0.00 -1.08 -2.91 119.26 124.00 1bzf h ALA 105 Ca -0.00 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1bzf h ALA 105 Cb 0.26 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1bzf h ALA 105 CO 0.02 0.65 0.00 1.19 0.00 0.00 0.00 179.25 181.11 1bzf n PHE 106 N -3.99 1.07 0.12 0.00 3.01 -0.71 -4.39 117.46 112.55 1bzf n PHE 106 Ca -0.02 -0.55 -0.00 0.00 1.01 0.00 0.00 57.45 57.89 1bzf n PHE 106 Cb 0.54 -0.09 0.28 0.00 -0.01 0.00 0.00 39.48 40.20 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 3.82 0.19 -0.75 -1.08 3.64 -0.66 -2.17 116.57 119.57 1bzf h LYS 107 Ca 0.00 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1bzf h LYS 107 Cb 1.11 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 1bzf h LYS 107 CO 0.08 0.52 0.00 -3.47 -2.27 0.00 0.00 179.45 174.31 1bzf n ASP 108 N -4.09 0.75 -2.41 4.20 2.03 -1.26 -3.39 116.55 112.38 1bzf n ASP 108 Ca -0.01 -1.89 -0.03 0.00 0.52 0.00 0.00 54.79 53.38 1bzf n ASP 108 Cb 0.42 -0.37 0.10 0.00 -0.72 0.00 0.00 41.12 40.54 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 -0.08 -1.39 -4.88 1.67 8.00 -0.83 -5.13 116.55 113.91 1bzf n ASP 109 Ca 0.00 -2.18 -0.34 0.00 0.71 0.00 0.00 54.79 52.98 1bzf n ASP 109 Cb 0.19 0.63 -0.05 0.00 -0.02 0.00 0.00 41.12 41.86 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 0.11 5.17 0.04 2.53 0.11 -1.12 -4.27 120.40 122.97 1bzf s VAL 110 Ca 0.08 0.29 0.00 0.00 -2.93 0.00 0.00 61.98 59.42 1bzf s VAL 110 Cb 0.38 -3.62 0.00 0.00 -1.53 0.00 0.00 36.38 31.61 1bzf s VAL 110 CO -0.11 0.26 0.00 0.47 -3.33 0.00 0.00 175.10 172.39 1bzf n ASP 111 N 0.81 0.27 -4.89 3.54 8.00 -1.20 -4.92 116.55 118.16 1bzf n ASP 111 Ca -0.08 0.07 -0.21 0.00 0.71 0.00 0.00 54.79 55.28 1bzf n ASP 111 Cb 0.52 -0.06 -0.03 0.00 -0.02 0.00 0.00 41.12 41.53 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 4.63 -0.30 -3.53 2.01 -1.17 -1.05 115.64 114.22 1bzf s THR 112 Ca 0.00 -1.22 -0.03 0.00 0.31 0.00 0.00 61.69 60.74 1bzf s THR 112 Cb 0.00 -3.55 0.11 0.00 0.01 0.00 0.00 72.50 69.07 1bzf s THR 112 CO 0.00 -0.31 0.14 -0.76 -0.69 0.00 0.00 174.62 173.00 1bzf s LEU 113 N -3.93 0.72 -0.44 4.42 1.43 -1.15 -2.98 118.68 116.76 1bzf s LEU 113 Ca 0.35 -1.45 -0.16 0.00 -1.03 0.00 0.00 54.13 51.84 1bzf s LEU 113 Cb -0.08 -0.39 0.04 0.00 0.03 0.00 0.00 46.19 45.78 1bzf s LEU 113 CO 0.27 -0.42 0.39 -0.76 0.23 0.00 0.00 176.35 176.06 1bzf s LEU 114 N 1.91 5.13 -0.07 1.79 1.43 -0.83 -2.73 118.68 125.32 1bzf s LEU 114 Ca 0.10 -0.92 0.03 0.00 -1.03 0.00 0.00 54.13 52.31 1bzf s LEU 114 Cb -0.17 -2.26 -0.02 0.00 0.03 0.00 0.00 46.19 43.77 1bzf s LEU 114 CO -0.31 -0.57 -0.16 0.54 0.23 0.00 0.00 176.35 176.09 1bzf s VAL 115 N 1.89 2.90 -0.43 -1.59 0.11 -1.12 -2.87 120.40 119.29 1bzf s VAL 115 Ca 0.08 -0.76 -0.08 0.00 -2.93 0.00 0.00 61.98 58.28 1bzf s VAL 115 Cb -0.20 -2.15 0.09 0.00 -1.53 0.00 0.00 36.38 32.60 1bzf s VAL 115 CO 0.11 0.57 0.27 -0.89 -3.33 0.00 0.00 175.10 171.82 1bzf s THR 116 N -0.37 4.08 0.17 5.04 2.01 -1.16 -2.23 115.64 123.17 1bzf s THR 116 Ca 0.04 -1.57 -0.18 0.00 0.31 0.00 0.00 61.69 60.29 1bzf s THR 116 Cb -0.12 -3.57 -0.08 0.00 0.01 0.00 0.00 72.50 68.74 1bzf s THR 116 CO 0.02 -0.58 0.65 -0.13 -0.69 0.00 0.00 174.62 173.89 1bzf s ARG 117 N 1.37 4.19 -0.07 4.92 0.52 -1.15 -2.53 118.95 126.19 1bzf s ARG 117 Ca 0.04 0.76 0.05 0.00 -0.52 0.00 0.00 55.73 56.06 1bzf s ARG 117 Cb -0.24 -2.98 -0.01 0.00 0.52 0.00 0.00 34.95 32.24 1bzf s ARG 117 CO 0.01 0.47 -0.24 -0.51 0.02 0.00 0.00 175.30 175.05 1bzf s LEU 118 N -1.76 2.14 0.28 2.53 1.02 -1.24 -2.21 118.68 119.43 1bzf s LEU 118 Ca 0.39 -0.50 0.02 0.00 0.02 0.00 0.00 54.13 54.05 1bzf s LEU 118 Cb -0.17 -1.40 0.40 0.00 0.02 0.00 0.00 46.19 45.03 1bzf s LEU 118 CO 0.20 0.22 1.72 0.00 0.02 0.00 0.00 176.35 178.52 1bzf h ALA 119 N 6.23 1.10 -2.31 4.21 0.00 -0.03 -3.27 119.26 125.17 1bzf h ALA 119 Ca -0.29 -0.34 -0.55 0.00 0.00 0.00 0.00 54.91 53.73 1bzf h ALA 119 Cb 1.19 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 1bzf h ALA 119 CO 0.48 0.56 0.83 0.20 0.00 0.00 0.00 179.25 181.32 1bzf s GLY 120 N -3.98 1.86 0.34 0.00 0.00 0.23 -4.92 107.32 100.85 1bzf s GLY 120 Ca -0.07 0.75 -0.26 0.00 0.00 0.00 0.00 44.72 45.14 1bzf s GLY 120 CO 0.79 2.48 1.02 -1.35 0.00 0.00 0.00 173.10 176.04 1bzf s SER 121 N 1.92 7.09 -0.17 1.64 1.04 -1.26 -4.74 113.70 119.22 1bzf s SER 121 Ca 0.61 2.02 -0.05 0.00 0.48 0.00 0.00 55.95 59.01 1bzf s SER 121 Cb -0.28 -2.59 0.08 0.00 0.10 0.00 0.00 66.02 63.33 1bzf s SER 121 CO 0.24 -0.25 0.30 -0.36 0.98 0.00 0.00 173.24 174.15 1bzf s PHE 122 N -1.52 -0.53 0.25 5.02 0.08 -1.26 -5.07 117.98 114.95 1bzf s PHE 122 Ca 0.52 0.97 -0.19 0.00 0.12 0.00 0.00 56.93 58.35 1bzf s PHE 122 Cb -0.23 -0.00 -0.08 0.00 -0.57 0.00 0.00 43.02 42.13 1bzf s PHE 122 CO 0.29 -0.46 0.73 -1.21 -0.10 0.00 0.00 175.22 174.48 1bzf s GLU 123 N 2.46 4.20 0.00 0.44 2.02 -1.26 -4.77 118.70 121.80 1bzf s GLU 123 Ca 0.03 0.84 0.00 0.00 0.02 0.00 0.00 54.97 55.86 1bzf s GLU 123 Cb -0.13 -2.77 0.00 0.00 0.10 0.00 0.00 34.13 31.33 1bzf s GLU 123 CO -0.11 0.34 0.00 0.41 0.02 0.00 0.00 175.26 175.92 1bzf n GLY 124 N 0.47 4.49 0.00 -1.39 0.00 -1.26 -4.98 105.19 102.51 1bzf n GLY 124 Ca -0.01 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.48 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 -4.86 1.61 8.00 -1.26 -5.05 116.55 114.99 1bzf n ASP 125 Ca 0.00 0.00 -0.36 0.00 0.71 0.00 0.00 54.79 55.14 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 -1.00 5.16 0.43 -3.53 2.01 -1.26 -5.10 115.64 112.36 1bzf s THR 126 Ca 0.00 0.53 0.05 0.00 0.31 0.00 0.00 61.69 62.58 1bzf s THR 126 Cb 0.00 -3.62 -0.05 0.00 0.01 0.00 0.00 72.50 68.83 1bzf s THR 126 CO 0.00 0.47 0.02 -0.54 -0.69 0.00 0.00 174.62 173.88 1bzf s LYS 127 N -1.40 2.01 0.26 4.92 1.02 -1.26 -3.16 119.74 122.12 1bzf s LYS 127 Ca 0.25 -2.19 -0.05 0.00 0.02 0.00 0.00 55.97 54.00 1bzf s LYS 127 Cb -0.15 -1.50 -0.05 0.00 -0.52 0.00 0.00 37.83 35.61 1bzf s LYS 127 CO 0.14 -0.18 0.52 1.41 -0.92 0.00 0.00 175.35 176.31 1bzf s MET 128 N -3.78 3.64 0.80 1.68 -2.45 -1.22 -4.79 119.30 113.18 1bzf s MET 128 Ca 0.25 -0.01 -0.11 0.00 -1.25 0.00 0.00 55.69 54.57 1bzf s MET 128 Cb 0.07 -2.69 0.07 0.00 1.25 0.00 0.00 34.83 33.53 1bzf s MET 128 CO 0.13 0.27 1.09 0.96 1.05 0.00 0.00 175.02 178.52 1bzf s ILE 129 N -1.98 3.15 -0.84 10.11 -4.36 -1.26 -4.96 121.20 121.06 1bzf s ILE 129 Ca 0.43 0.37 -0.25 0.00 -0.26 0.00 0.00 60.65 60.94 1bzf s ILE 129 Cb -0.11 -3.05 0.04 0.00 1.25 0.00 0.00 42.46 40.59 1bzf s ILE 129 CO 0.28 -0.49 1.34 -2.16 0.24 0.00 0.00 174.94 174.15 1bzf s PRO 130 N -5.08 3.34 0.09 0.37 0.04 -1.26 -5.01 135.00 127.49 1bzf s PRO 130 Ca 0.61 -0.59 -0.25 0.00 0.04 0.00 0.00 61.00 60.82 1bzf s PRO 130 Cb -0.15 -4.63 -0.06 0.00 0.04 0.00 0.00 34.50 29.70 1bzf s PRO 130 CO 0.55 -2.17 0.75 -0.51 0.04 0.00 0.00 177.00 175.67 1bzf s LEU 131 N 5.41 4.51 -1.08 -3.56 1.43 -1.26 -4.97 118.68 119.15 1bzf s LEU 131 Ca 0.39 1.50 -0.22 0.00 -1.03 0.00 0.00 54.13 54.77 1bzf s LEU 131 Cb -0.05 -3.22 0.04 0.00 0.03 0.00 0.00 46.19 42.99 1bzf s LEU 131 CO 0.05 0.11 1.58 0.21 0.23 0.00 0.00 176.35 178.53 1bzf s ASN 132 N -0.55 6.41 0.40 2.29 2.47 -1.26 -4.77 114.94 119.93 1bzf s ASN 132 Ca 0.37 -1.63 0.29 0.00 0.42 0.00 0.00 52.86 52.30 1bzf s ASN 132 Cb -0.21 -2.57 1.24 0.00 -1.45 0.00 0.00 41.25 38.26 1bzf s ASN 132 CO 0.24 -1.59 1.85 -0.50 -3.72 0.00 0.00 177.10 173.38 1bzf h TRP 133 N 9.40 0.00 0.00 0.43 4.06 -1.95 -2.58 115.95 125.30 1bzf h TRP 133 Ca 0.25 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 61.18 1bzf h TRP 133 Cb 0.97 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.13 1bzf h TRP 133 CO 1.31 0.00 -0.08 0.22 -3.56 0.00 0.00 178.44 176.33 1bzf h ASP 134 N 0.00 0.00 -0.81 -3.49 3.58 -2.04 -1.22 116.42 112.44 1bzf h ASP 134 Ca 0.00 0.00 -0.42 0.00 0.42 0.00 0.00 57.03 57.03 1bzf h ASP 134 Cb 0.36 0.00 -0.25 0.00 1.72 0.00 0.00 39.33 41.16 1bzf h ASP 134 CO 0.00 0.08 0.53 0.47 -2.88 0.00 0.00 179.24 177.44 1bzf n ASP 135 N -3.89 3.65 -3.65 2.28 9.92 -0.97 -4.92 116.55 118.96 1bzf n ASP 135 Ca -0.02 -3.31 -0.15 0.00 -0.53 0.00 0.00 54.79 50.77 1bzf n ASP 135 Cb 0.17 -0.78 -0.08 0.00 -0.64 0.00 0.00 41.12 39.80 1bzf n ASP 135 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 1bzf s PHE 136 N -2.71 1.28 -0.15 1.24 0.08 -0.46 -4.49 117.98 112.78 1bzf s PHE 136 Ca 0.47 -1.40 -0.11 0.00 0.12 0.00 0.00 56.93 56.00 1bzf s PHE 136 Cb 0.39 -0.44 0.05 0.00 -0.57 0.00 0.00 43.02 42.45 1bzf s PHE 136 CO 0.09 -0.87 0.38 0.99 -0.10 0.00 0.00 175.22 175.70 1bzf s THR 137 N -3.63 -0.01 0.71 0.64 2.01 -1.06 -4.91 115.64 109.39 1bzf s THR 137 Ca 0.36 0.05 -0.12 0.00 0.31 0.00 0.00 61.69 62.29 1bzf s THR 137 Cb 0.03 -0.54 0.02 0.00 0.01 0.00 0.00 72.50 72.02 1bzf s THR 137 CO 0.19 0.02 1.09 -0.75 -0.69 0.00 0.00 174.62 174.48 1bzf s LYS 138 N 0.74 2.61 0.00 4.92 2.20 -1.26 -1.50 119.74 127.45 1bzf s LYS 138 Ca -0.04 1.21 0.00 0.00 -0.36 0.00 0.00 55.97 56.77 1bzf s LYS 138 Cb -0.05 -1.94 0.00 0.00 -1.51 0.00 0.00 37.83 34.33 1bzf s LYS 138 CO -0.05 -1.38 0.00 1.33 -0.36 0.00 0.00 175.35 174.89 1bzf n VAL 139 N -3.00 0.00 -3.53 4.02 0.24 -0.99 -4.86 118.33 110.20 1bzf n VAL 139 Ca 0.09 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.25 1bzf n VAL 139 Cb 0.53 0.00 -0.05 0.00 -1.47 0.00 0.00 33.84 32.85 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 -1.40 -0.50 -0.16 -1.34 1.04 -1.23 -5.08 113.70 105.03 1bzf s SER 140 Ca 0.00 0.20 -0.06 0.00 0.48 0.00 0.00 55.95 56.57 1bzf s SER 140 Cb 0.00 0.53 0.07 0.00 0.10 0.00 0.00 66.02 66.72 1bzf s SER 140 CO 0.00 -0.77 0.34 -0.94 0.98 0.00 0.00 173.24 172.85 1bzf s SER 141 N -2.07 -0.05 -0.47 7.02 1.04 -1.26 -2.01 113.70 115.89 1bzf s SER 141 Ca -0.04 0.78 -0.16 0.00 0.48 0.00 0.00 55.95 57.01 1bzf s SER 141 Cb -0.00 0.94 0.07 0.00 0.10 0.00 0.00 66.02 67.12 1bzf s SER 141 CO -0.03 -0.22 0.42 -0.60 0.98 0.00 0.00 173.24 173.79 1bzf s ARG 142 N 2.27 3.00 0.20 4.02 3.52 -1.07 -4.95 118.95 125.95 1bzf s ARG 142 Ca -0.02 -1.26 -0.22 0.00 -0.13 0.00 0.00 55.73 54.10 1bzf s ARG 142 Cb -0.11 -4.12 -0.08 0.00 -1.56 0.00 0.00 34.95 29.08 1bzf s ARG 142 CO -0.11 -1.04 0.75 0.99 -0.81 0.00 0.00 175.30 175.09 1bzf s THR 143 N 1.79 4.48 -0.09 4.11 2.01 -1.26 -1.85 115.64 124.84 1bzf s THR 143 Ca 0.06 1.46 -0.04 0.00 0.31 0.00 0.00 61.69 63.48 1bzf s THR 143 Cb -0.23 -3.96 0.04 0.00 0.01 0.00 0.00 72.50 68.36 1bzf s THR 143 CO 0.08 0.32 0.20 0.54 -0.69 0.00 0.00 174.62 175.07 1bzf s VAL 144 N -1.39 -0.05 -0.24 3.82 0.11 -1.10 -5.00 120.40 116.56 1bzf s VAL 144 Ca 0.40 0.17 -0.07 0.00 -2.93 0.00 0.00 61.98 59.55 1bzf s VAL 144 Cb -0.19 -0.32 -0.03 0.00 -1.53 0.00 0.00 36.38 34.31 1bzf s VAL 144 CO 0.23 0.07 0.07 -0.70 -3.33 0.00 0.00 175.10 171.43 1bzf s GLU 145 N 1.24 3.69 0.00 1.54 2.12 -1.26 -3.05 118.70 122.97 1bzf s GLU 145 Ca -0.09 -0.47 0.00 0.00 0.36 0.00 0.00 54.97 54.77 1bzf s GLU 145 Cb -0.11 -3.31 0.00 0.00 0.26 0.00 0.00 34.13 30.97 1bzf s GLU 145 CO -0.07 -0.14 0.00 -3.47 -0.54 0.00 0.00 175.26 171.04 1bzf n ASP 146 N 4.78 0.00 -0.01 -1.70 2.03 -1.25 -4.97 116.55 115.43 1bzf n ASP 146 Ca -0.16 -0.58 -0.17 0.00 0.52 0.00 0.00 54.79 54.40 1bzf n ASP 146 Cb 0.52 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.85 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 -0.57 1.29 -2.92 5.18 1.35 -1.99 -3.44 112.91 111.81 1bzf h THR 147 Ca 0.00 -2.01 -0.66 0.00 -0.55 0.00 0.00 66.41 63.19 1bzf h THR 147 Cb 0.00 2.02 -0.10 0.00 -1.73 0.00 0.00 68.15 68.34 1bzf h THR 147 CO 0.00 0.63 -0.52 0.21 -0.25 0.00 0.00 175.52 175.59 1bzf s ASN 148 N -7.11 6.04 0.24 5.36 3.84 -1.26 -5.00 114.94 117.05 1bzf s ASN 148 Ca -0.10 0.34 -0.06 0.00 0.21 0.00 0.00 52.86 53.25 1bzf s ASN 148 Cb 0.09 -1.93 0.45 0.00 -0.55 0.00 0.00 41.25 39.31 1bzf s ASN 148 CO 0.90 0.36 1.67 -0.65 -2.79 0.00 0.00 177.10 176.59 1bzf h PRO 149 N 5.35 0.21 0.00 0.43 0.10 -2.00 0.36 132.00 136.46 1bzf h PRO 149 Ca -0.51 -0.01 -0.04 0.00 0.10 0.00 0.00 66.00 65.54 1bzf h PRO 149 Cb 1.21 -0.05 -0.01 0.00 0.10 0.00 0.00 31.00 32.25 1bzf h PRO 149 CO 0.60 0.14 -0.18 0.00 0.10 0.00 0.00 178.00 178.66 1bzf h ALA 150 N 1.63 1.46 0.00 -0.75 0.00 -1.94 -1.65 119.26 118.01 1bzf h ALA 150 Ca 0.41 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1bzf h ALA 150 Cb 0.71 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1bzf h ALA 150 CO -0.54 0.23 0.00 1.28 0.00 0.00 0.00 179.25 180.21 1bzf n LEU 151 N -3.97 0.89 -4.80 0.00 4.77 0.13 -0.60 117.00 113.41 1bzf n LEU 151 Ca -0.02 -0.45 -0.39 0.00 -0.03 0.00 0.00 56.01 55.13 1bzf n LEU 151 Cb 0.27 -0.45 -0.06 0.00 -2.33 0.00 0.00 43.42 40.85 1bzf n LEU 151 CO 0.34 0.22 0.34 -0.89 -1.33 0.00 0.00 177.39 176.07 1bzf s THR 152 N -1.11 4.61 0.16 -5.08 2.01 -0.62 -3.74 115.64 111.88 1bzf s THR 152 Ca 0.00 1.38 -0.17 0.00 0.31 0.00 0.00 61.69 63.21 1bzf s THR 152 Cb 0.00 -3.98 0.03 0.00 0.01 0.00 0.00 72.50 68.56 1bzf s THR 152 CO 0.00 0.54 0.46 -1.38 -0.69 0.00 0.00 174.62 173.56 1bzf s HIS 153 N -1.12 -0.17 -0.02 4.92 -3.43 -1.17 0.54 115.29 114.83 1bzf s HIS 153 Ca 0.31 -0.15 0.02 0.00 -0.80 0.00 0.00 55.06 54.43 1bzf s HIS 153 Cb -0.21 0.33 0.01 0.00 -1.43 0.00 0.00 32.58 31.27 1bzf s HIS 153 CO 0.21 -0.81 -0.06 0.99 -2.00 0.00 0.00 174.74 173.08 1bzf s THR 154 N -3.84 0.55 -0.81 -5.38 2.01 -0.94 -2.70 115.64 104.54 1bzf s THR 154 Ca 0.06 -0.23 -0.19 0.00 0.31 0.00 0.00 61.69 61.64 1bzf s THR 154 Cb 0.00 -0.51 0.12 0.00 0.01 0.00 0.00 72.50 72.12 1bzf s THR 154 CO -0.08 0.19 1.00 -0.31 -0.69 0.00 0.00 174.62 174.73 1bzf s TYR 155 N 0.30 3.04 0.21 4.92 2.02 -0.77 -2.91 117.35 124.16 1bzf s TYR 155 Ca -0.04 -1.18 -0.30 0.00 -0.37 0.00 0.00 57.07 55.19 1bzf s TYR 155 Cb -0.08 -4.21 -0.08 0.00 -0.40 0.00 0.00 41.96 37.19 1bzf s TYR 155 CO -0.00 -1.46 1.05 -1.21 -1.57 0.00 0.00 175.55 172.36 1bzf s GLU 156 N 2.82 4.68 -0.19 -0.62 2.02 -0.95 -2.59 118.70 123.88 1bzf s GLU 156 Ca 0.26 1.66 0.01 0.00 0.02 0.00 0.00 54.97 56.91 1bzf s GLU 156 Cb -0.11 -3.26 0.04 0.00 0.10 0.00 0.00 34.13 30.89 1bzf s GLU 156 CO -0.02 0.23 -0.11 0.08 0.02 0.00 0.00 175.26 175.46 1bzf s VAL 157 N -0.68 1.59 0.41 2.63 1.01 -0.85 -2.81 120.40 121.69 1bzf s VAL 157 Ca 0.46 -0.90 0.07 0.00 0.00 0.00 0.00 61.98 61.61 1bzf s VAL 157 Cb -0.29 -1.64 -0.05 0.00 0.00 0.00 0.00 36.38 34.41 1bzf s VAL 157 CO 0.35 0.22 0.20 0.26 0.00 0.00 0.00 175.10 176.14 1bzf s TRP 158 N 1.43 2.62 -0.11 5.22 0.52 -1.10 -2.35 118.94 125.17 1bzf s TRP 158 Ca 0.00 -0.58 -0.11 0.00 0.02 0.00 0.00 56.10 55.43 1bzf s TRP 158 Cb -0.15 -1.98 0.03 0.00 -1.15 0.00 0.00 33.47 30.21 1bzf s TRP 158 CO -0.09 0.15 0.32 -0.65 0.02 0.00 0.00 176.95 176.70 1bzf s GLN 159 N -3.93 0.40 -0.22 4.98 -0.21 -0.56 -2.92 119.66 117.20 1bzf s GLN 159 Ca 0.42 0.37 -0.29 0.00 0.02 0.00 0.00 55.36 55.88 1bzf s GLN 159 Cb 0.03 0.19 -0.02 0.00 1.00 0.00 0.00 33.01 34.22 1bzf s GLN 159 CO 0.23 -0.06 1.47 0.21 -2.12 0.00 0.00 175.29 175.02 1bzf s LYS 160 N 0.01 3.94 -0.29 2.91 2.20 -0.22 -2.56 119.74 125.73 1bzf s LYS 160 Ca -0.01 1.58 0.03 0.00 -0.36 0.00 0.00 55.97 57.21 1bzf s LYS 160 Cb -0.03 -3.94 0.20 0.00 -1.51 0.00 0.00 37.83 32.55 1bzf s LYS 160 CO 0.01 -1.11 0.61 0.21 -0.36 0.00 0.00 175.35 174.71 1bzf s LYS 161 N 4.27 0.55 0.00 4.03 2.20 -1.26 -5.01 119.74 124.52 1bzf s LYS 161 Ca 0.64 0.66 0.21 0.00 -0.36 0.00 0.00 55.97 57.12 1bzf s LYS 161 Cb -0.23 0.33 1.25 0.00 -1.51 0.00 0.00 37.83 37.67 1bzf s LYS 161 CO 0.25 -0.90 1.63 0.00 -0.36 0.00 0.00 175.35 175.97