#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 0.32 0.26 2.41 0.00 -1.11 -3.03 121.76 120.61 1bzf s ALA 2 Ca 0.00 0.06 0.06 0.00 0.00 0.00 0.00 51.96 52.07 1bzf s ALA 2 Cb 0.00 -0.24 -0.03 0.00 0.00 0.00 0.00 23.12 22.85 1bzf s ALA 2 CO 0.00 -0.02 0.35 -0.06 0.00 0.00 0.00 175.76 176.03 1bzf s PHE 3 N 0.65 3.34 -0.30 0.00 0.40 -1.13 -1.14 117.98 119.81 1bzf s PHE 3 Ca -0.07 -0.07 -0.09 0.00 -0.60 0.00 0.00 56.93 56.10 1bzf s PHE 3 Cb -0.10 -1.61 0.18 0.00 0.51 0.00 0.00 43.02 42.00 1bzf s PHE 3 CO -0.01 0.38 0.92 -1.17 0.70 0.00 0.00 175.22 176.04 1bzf s LEU 4 N -3.99 -0.74 0.01 -0.37 2.96 -0.91 -2.45 118.68 113.19 1bzf s LEU 4 Ca 0.36 0.43 -0.01 0.00 -0.22 0.00 0.00 54.13 54.68 1bzf s LEU 4 Cb -0.09 1.61 -0.01 0.00 0.50 0.00 0.00 46.19 48.20 1bzf s LEU 4 CO 0.29 -0.14 0.01 -1.66 -1.32 0.00 0.00 176.35 173.53 1bzf s TRP 5 N 2.93 0.13 -0.39 5.38 -2.14 -1.13 -4.35 118.94 119.36 1bzf s TRP 5 Ca 0.07 -0.27 -0.18 0.00 2.66 0.00 0.00 56.10 58.37 1bzf s TRP 5 Cb -0.11 -0.10 0.01 0.00 -3.10 0.00 0.00 33.47 30.17 1bzf s TRP 5 CO -0.15 -0.15 0.51 0.00 -2.66 0.00 0.00 176.95 174.51 1bzf s ALA 6 N -0.96 3.43 0.06 2.67 0.00 -1.26 -2.96 121.76 122.74 1bzf s ALA 6 Ca -0.10 -1.23 0.04 0.00 0.00 0.00 0.00 51.96 50.66 1bzf s ALA 6 Cb -0.06 -3.09 -0.03 0.00 0.00 0.00 0.00 23.12 19.94 1bzf s ALA 6 CO -0.00 -1.47 -0.12 1.14 0.00 0.00 0.00 175.76 175.31 1bzf s GLN 7 N 2.39 0.71 0.45 0.00 -2.07 -1.07 -4.36 119.66 115.72 1bzf s GLN 7 Ca 0.17 -0.88 0.07 0.00 -1.82 0.00 0.00 55.36 52.91 1bzf s GLN 7 Cb -0.16 -0.64 0.02 0.00 -1.09 0.00 0.00 33.01 31.15 1bzf s GLN 7 CO 0.15 0.14 0.62 0.16 -1.32 0.00 0.00 175.29 175.03 1bzf s ASP 8 N -1.66 5.55 0.57 12.60 1.47 -0.98 -3.44 116.67 130.78 1bzf s ASP 8 Ca -0.05 -0.41 0.38 0.00 1.18 0.00 0.00 52.55 53.66 1bzf s ASP 8 Cb -0.10 -0.60 2.02 0.00 -0.34 0.00 0.00 42.92 43.91 1bzf s ASP 8 CO 0.02 -0.87 2.16 0.08 0.68 0.00 0.00 175.17 177.24 1bzf h ARG 9 N 0.52 0.00 -0.48 2.11 0.11 -1.85 -1.31 114.38 113.48 1bzf h ARG 9 Ca -0.39 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.69 1bzf h ARG 9 Cb 1.28 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.36 1bzf h ARG 9 CO 0.45 0.00 0.00 -0.25 0.10 0.00 0.00 179.97 180.27 1bzf n ASP 10 N -2.88 0.48 -2.71 0.08 9.92 -1.26 -4.80 116.55 115.38 1bzf n ASP 10 Ca -0.02 -1.75 -0.20 0.00 -0.53 0.00 0.00 54.79 52.29 1bzf n ASP 10 Cb 0.09 -0.24 0.03 0.00 -0.64 0.00 0.00 41.12 40.36 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 0.20 -0.38 3.84 0.44 0.00 -0.50 -5.00 105.19 103.80 1bzf n GLY 11 Ca 0.00 0.03 -0.21 0.00 0.00 0.00 0.00 46.02 45.84 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 -5.99 3.46 0.00 0.99 2.96 -1.23 -3.44 118.68 115.44 1bzf s LEU 12 Ca 0.28 -0.64 0.00 0.00 -0.22 0.00 0.00 54.13 53.54 1bzf s LEU 12 Cb -0.12 -2.07 0.00 0.00 0.50 0.00 0.00 46.19 44.50 1bzf s LEU 12 CO 0.34 -0.47 0.00 2.30 -1.32 0.00 0.00 176.35 177.20 1bzf n ILE 13 N -1.41 0.00 -3.06 6.68 -5.35 -1.21 -2.32 119.36 112.69 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 0.61 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.51 1bzf n ILE 13 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1bzf n GLY 14 N 0.47 1.68 3.38 3.28 0.00 -1.26 -4.71 105.19 108.03 1bzf n GLY 14 Ca 0.00 -0.88 0.02 0.00 0.00 0.00 0.00 46.02 45.16 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 -1.22 0.22 -1.54 1.61 2.20 0.37 -4.00 119.74 117.38 1bzf s LYS 15 Ca 0.00 0.54 -0.04 0.00 -0.36 0.00 0.00 55.97 56.11 1bzf s LYS 15 Cb 0.00 0.30 0.01 0.00 -1.51 0.00 0.00 37.83 36.63 1bzf s LYS 15 CO 0.00 -0.07 0.45 -0.25 -0.36 0.00 0.00 175.35 175.12 1bzf n ASP 16 N 4.69 -5.66 0.00 1.43 8.00 -1.26 -2.83 116.55 120.92 1bzf n ASP 16 Ca -0.09 -0.23 0.00 0.00 0.71 0.00 0.00 54.79 55.18 1bzf n ASP 16 Cb 0.54 -4.62 0.00 0.00 -0.02 0.00 0.00 41.12 37.02 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 -1.35 2.10 3.81 0.44 0.00 -1.26 -4.96 105.19 103.97 1bzf n GLY 17 Ca -0.13 -0.35 -0.30 0.00 0.00 0.00 0.00 46.02 45.25 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 1.27 0.47 1.61 -3.43 -1.13 -4.97 115.29 109.11 1bzf s HIS 18 Ca 0.00 0.41 -0.10 0.00 -0.80 0.00 0.00 55.06 54.57 1bzf s HIS 18 Cb 0.00 -3.85 -0.05 0.00 -1.43 0.00 0.00 32.58 27.25 1bzf s HIS 18 CO 0.00 -3.05 0.83 -0.51 -2.00 0.00 0.00 174.74 170.01 1bzf s LEU 19 N -6.26 3.67 0.17 5.38 1.43 -1.26 -0.48 118.68 121.33 1bzf s LEU 19 Ca 0.72 1.17 0.10 0.00 -1.03 0.00 0.00 54.13 55.08 1bzf s LEU 19 Cb -0.06 -4.10 -0.12 0.00 0.03 0.00 0.00 46.19 41.94 1bzf s LEU 19 CO 0.54 -0.54 1.32 1.55 0.23 0.00 0.00 176.35 179.45 1bzf h PRO 20 N 0.71 0.00 -6.08 1.29 0.13 -1.83 -3.44 132.00 122.79 1bzf h PRO 20 Ca -0.47 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.12 1bzf h PRO 20 Cb 1.19 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.29 1bzf h PRO 20 CO 0.63 0.83 -0.30 1.67 -0.23 0.00 0.00 178.00 180.59 1bzf s TRP 21 N -2.79 1.91 -0.34 1.56 -2.14 -1.26 -5.04 118.94 110.84 1bzf s TRP 21 Ca 0.02 -0.73 0.02 0.00 2.66 0.00 0.00 56.10 58.07 1bzf s TRP 21 Cb 0.09 -2.02 0.10 0.00 -3.10 0.00 0.00 33.47 28.55 1bzf s TRP 21 CO 0.80 -0.44 0.10 -1.58 -2.66 0.00 0.00 176.95 173.16 1bzf s HIS 22 N -2.68 2.61 -0.74 1.66 2.46 -1.26 -5.04 115.29 112.31 1bzf s HIS 22 Ca 0.41 -2.35 0.04 0.00 0.47 0.00 0.00 55.06 53.63 1bzf s HIS 22 Cb -0.03 -2.26 0.18 0.00 -0.13 0.00 0.00 32.58 30.35 1bzf s HIS 22 CO 0.25 -0.89 0.54 -1.17 -2.47 0.00 0.00 174.74 171.00 1bzf s LEU 23 N 1.16 4.96 0.38 8.88 2.96 -1.26 -4.93 118.68 130.83 1bzf s LEU 23 Ca 0.11 -3.82 0.19 0.00 -0.22 0.00 0.00 54.13 50.40 1bzf s LEU 23 Cb -0.19 -1.69 1.16 0.00 0.50 0.00 0.00 46.19 45.97 1bzf s LEU 23 CO -0.15 -0.10 1.70 -0.65 -1.32 0.00 0.00 176.35 175.82 1bzf h PRO 24 N 5.53 0.30 -0.38 0.98 0.10 -1.99 0.16 132.00 136.71 1bzf h PRO 24 Ca 0.14 -0.02 -0.02 0.00 0.10 0.00 0.00 66.00 66.21 1bzf h PRO 24 Cb 0.77 -0.07 -0.02 0.00 0.10 0.00 0.00 31.00 31.78 1bzf h PRO 24 CO 0.74 0.20 0.17 0.22 0.10 0.00 0.00 178.00 179.44 1bzf h ASP 25 N 0.31 0.50 -0.78 -2.05 3.58 -2.00 -2.32 116.42 113.66 1bzf h ASP 25 Ca 0.70 -0.14 -0.04 0.00 0.42 0.00 0.00 57.03 57.97 1bzf h ASP 25 Cb 1.80 -0.13 -0.04 0.00 1.72 0.00 0.00 39.33 42.69 1bzf h ASP 25 CO -0.44 0.50 0.32 -0.78 -2.88 0.00 0.00 179.24 175.96 1bzf h ASP 26 N 0.47 1.08 0.23 2.28 3.58 -1.12 -1.29 116.42 121.64 1bzf h ASP 26 Ca 0.13 -0.16 -0.01 0.00 0.42 0.00 0.00 57.03 57.41 1bzf h ASP 26 Cb 0.14 -0.28 -0.00 0.00 1.72 0.00 0.00 39.33 40.91 1bzf h ASP 26 CO -0.01 0.95 -0.05 -0.07 -2.88 0.00 0.00 179.24 177.17 1bzf h LEU 27 N 1.14 0.00 0.00 2.28 3.38 -1.08 -1.50 115.31 119.54 1bzf h LEU 27 Ca 0.26 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 58.01 1bzf h LEU 27 Cb 0.20 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 1bzf h LEU 27 CO -0.02 0.05 -1.30 0.45 0.09 0.00 0.00 178.44 177.70 1bzf h HIS 28 N 0.00 0.00 0.00 1.13 3.86 -0.73 -3.30 115.15 116.11 1bzf h HIS 28 Ca -0.00 0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 59.13 1bzf h HIS 28 Cb 0.18 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.64 1bzf h HIS 28 CO 0.00 0.85 -0.38 -0.92 0.86 0.00 0.00 177.93 178.34 1bzf h TYR 29 N 0.00 0.00 -0.25 2.45 3.20 -0.49 -3.11 116.97 118.77 1bzf h TYR 29 Ca -0.15 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.69 1bzf h TYR 29 Cb 1.78 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 40.04 1bzf h TYR 29 CO 0.00 0.38 0.04 0.35 -1.64 0.00 0.00 178.16 177.29 1bzf h PHE 30 N 0.00 0.44 0.00 -3.82 3.57 -1.53 -1.85 116.94 113.74 1bzf h PHE 30 Ca -0.00 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.43 1bzf h PHE 30 Cb 0.88 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.50 1bzf h PHE 30 CO 0.00 0.53 0.00 -2.13 -2.23 0.00 0.00 178.31 174.48 1bzf n ARG 31 N -4.69 0.55 -0.11 1.11 0.63 -1.18 -2.53 116.66 110.45 1bzf n ARG 31 Ca -0.03 0.00 -0.12 0.00 -0.92 0.00 0.00 57.85 56.77 1bzf n ARG 31 Cb 0.20 -1.36 -0.15 0.00 0.45 0.00 0.00 32.46 31.60 1bzf n ARG 31 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1bzf n ALA 32 N -0.86 1.48 -1.39 5.13 0.00 -0.72 -4.27 120.51 119.89 1bzf n ALA 32 Ca 0.10 -1.27 -0.13 0.00 0.00 0.00 0.00 53.44 52.14 1bzf n ALA 32 Cb 0.04 -0.16 0.19 0.00 0.00 0.00 0.00 19.45 19.53 1bzf n ALA 32 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1bzf n GLN 33 N -2.91 2.04 0.00 0.00 3.00 -1.05 -4.42 117.38 114.04 1bzf n GLN 33 Ca -0.37 -3.15 0.00 0.00 -0.01 0.00 0.00 57.00 53.47 1bzf n GLN 33 Cb 1.11 -1.97 0.00 0.00 0.00 0.00 0.00 30.24 29.38 1bzf n GLN 33 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 1bzf n THR 34 N -1.12 0.00 -2.24 5.09 -2.24 -1.13 -4.94 114.28 107.68 1bzf n THR 34 Ca 0.44 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.81 1bzf n THR 34 Cb 1.26 -0.65 -0.03 0.00 -2.10 0.00 0.00 70.33 68.81 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 -1.67 3.27 -0.71 2.28 -7.23 -1.26 -2.81 120.40 112.27 1bzf s VAL 35 Ca 0.00 1.05 -0.02 0.00 -1.81 0.00 0.00 61.98 61.20 1bzf s VAL 35 Cb 0.00 -3.67 0.00 0.00 0.56 0.00 0.00 36.38 33.27 1bzf s VAL 35 CO 0.00 0.16 0.23 0.61 -0.31 0.00 0.00 175.10 175.79 1bzf n GLY 36 N 2.29 0.12 3.59 2.32 0.00 -1.18 -5.01 105.19 107.32 1bzf n GLY 36 Ca 0.06 -0.40 -0.09 0.00 0.00 0.00 0.00 46.02 45.59 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 -4.94 1.48 -0.41 1.61 1.02 -1.12 -4.44 119.74 112.94 1bzf s LYS 37 Ca 0.11 -0.88 -0.20 0.00 0.02 0.00 0.00 55.97 55.03 1bzf s LYS 37 Cb -0.05 0.55 0.02 0.00 -0.52 0.00 0.00 37.83 37.82 1bzf s LYS 37 CO 0.14 -0.64 0.60 0.42 -0.92 0.00 0.00 175.35 174.94 1bzf s ILE 38 N -3.88 4.90 -0.42 2.17 1.01 -0.82 -3.48 121.20 120.67 1bzf s ILE 38 Ca 0.10 0.18 -0.23 0.00 0.00 0.00 0.00 60.65 60.69 1bzf s ILE 38 Cb -0.02 -4.13 0.02 0.00 0.01 0.00 0.00 42.46 38.34 1bzf s ILE 38 CO -0.01 -0.47 0.79 -0.32 0.00 0.00 0.00 174.94 174.94 1bzf s MET 39 N 2.66 3.55 -0.26 2.79 1.75 -1.12 -2.91 119.30 125.76 1bzf s MET 39 Ca 0.21 0.07 -0.12 0.00 -1.25 0.00 0.00 55.69 54.60 1bzf s MET 39 Cb -0.15 -3.89 -0.05 0.00 2.84 0.00 0.00 34.83 33.59 1bzf s MET 39 CO 0.17 -1.02 0.22 0.08 -0.65 0.00 0.00 175.02 173.82 1bzf s VAL 40 N 3.25 5.30 0.10 10.11 1.01 -1.09 -1.81 120.40 137.27 1bzf s VAL 40 Ca 0.31 0.28 0.01 0.00 0.00 0.00 0.00 61.98 62.57 1bzf s VAL 40 Cb -0.12 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 1bzf s VAL 40 CO 0.21 0.27 -0.03 0.68 0.00 0.00 0.00 175.10 176.24 1bzf s VAL 41 N 1.48 0.47 0.72 2.92 -7.23 -1.02 -3.04 120.40 114.70 1bzf s VAL 41 Ca 0.09 -1.90 -0.10 0.00 -1.81 0.00 0.00 61.98 58.26 1bzf s VAL 41 Cb -0.15 -1.77 0.16 0.00 0.56 0.00 0.00 36.38 35.19 1bzf s VAL 41 CO 0.08 -0.78 0.98 0.61 -0.31 0.00 0.00 175.10 175.68 1bzf n GLY 42 N -0.04 -0.95 0.22 2.32 0.00 -0.67 -2.91 105.19 103.16 1bzf n GLY 42 Ca -0.11 -1.77 -0.14 0.00 0.00 0.00 0.00 46.02 44.00 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 0.71 -0.20 1.61 1.12 -1.94 -0.97 114.38 114.71 1bzf h ARG 43 Ca -0.32 -0.51 -0.11 0.00 -1.11 0.00 0.00 59.98 57.94 1bzf h ARG 43 Cb 0.93 0.08 -0.01 0.00 -0.01 0.00 0.00 29.97 30.96 1bzf h ARG 43 CO 0.25 1.13 -0.33 0.00 -3.11 0.00 0.00 179.97 177.90 1bzf h ARG 44 N 0.52 0.41 0.00 0.20 3.08 -1.94 -2.72 114.38 113.93 1bzf h ARG 44 Ca -0.02 -0.18 -0.17 0.00 0.07 0.00 0.00 59.98 59.68 1bzf h ARG 44 Cb 1.25 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.27 1bzf h ARG 44 CO 0.13 0.70 -0.82 1.15 -1.07 0.00 0.00 179.97 180.06 1bzf h THR 45 N 0.35 1.48 0.00 2.04 2.02 -1.91 -2.81 112.91 114.09 1bzf h THR 45 Ca 0.04 -2.94 -0.08 0.00 0.77 0.00 0.00 66.41 64.21 1bzf h THR 45 Cb 0.76 2.63 -0.01 0.00 -1.74 0.00 0.00 68.15 69.79 1bzf h THR 45 CO 0.06 0.81 -0.38 0.22 0.37 0.00 0.00 175.52 176.60 1bzf h TYR 46 N 0.00 0.00 0.00 3.16 3.20 -0.90 -2.68 116.97 119.76 1bzf h TYR 46 Ca -0.01 0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.74 1bzf h TYR 46 Cb 1.57 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.82 1bzf h TYR 46 CO 0.00 0.38 -0.96 0.93 -1.64 0.00 0.00 178.16 176.87 1bzf h GLU 47 N 0.00 0.00 0.00 1.82 5.08 -1.46 -3.28 114.58 116.74 1bzf h GLU 47 Ca -0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1bzf h GLU 47 Cb 0.70 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.95 1bzf h GLU 47 CO 0.05 0.33 -0.10 0.66 -1.00 0.00 0.00 179.01 178.95 1bzf h SER 48 N 0.00 0.00 -4.18 1.42 4.64 -1.20 -3.43 113.55 110.80 1bzf h SER 48 Ca -0.08 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.74 1bzf h SER 48 Cb 1.42 0.00 0.18 0.00 -0.31 0.00 0.00 62.40 63.68 1bzf h SER 48 CO 0.05 0.10 0.23 -0.36 -0.87 0.00 0.00 176.83 175.98 1bzf s PHE 49 N -4.34 1.93 -0.08 4.77 0.08 -1.21 -4.99 117.98 114.14 1bzf s PHE 49 Ca -0.03 1.63 -0.00 0.00 0.12 0.00 0.00 56.93 58.64 1bzf s PHE 49 Cb 0.14 -3.22 -0.00 0.00 -0.57 0.00 0.00 43.02 39.36 1bzf s PHE 49 CO 0.59 -2.58 0.01 -1.00 -0.10 0.00 0.00 175.22 172.14 1bzf h PRO 50 N -1.70 -0.01 -2.64 0.24 0.13 -1.91 -3.42 132.00 122.69 1bzf h PRO 50 Ca -0.45 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.07 1bzf h PRO 50 Cb 1.26 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.99 1bzf h PRO 50 CO 0.46 -0.01 -0.72 0.36 -0.23 0.00 0.00 178.00 177.87 1bzf n LYS 51 N -4.38 1.51 -2.74 0.86 2.85 -1.26 -5.10 118.16 109.90 1bzf n LYS 51 Ca -0.00 -4.12 -0.33 0.00 -1.05 0.00 0.00 58.31 52.81 1bzf n LYS 51 Cb 0.00 -2.04 -0.06 0.00 -0.65 0.00 0.00 35.03 32.28 1bzf n LYS 51 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 177.40 176.37 1bzf s ARG 52 N -1.32 4.17 0.66 -1.58 3.03 -1.26 -4.25 118.95 118.41 1bzf s ARG 52 Ca 0.31 1.10 -0.11 0.00 2.03 0.00 0.00 55.73 59.06 1bzf s ARG 52 Cb 0.04 -2.17 -0.01 0.00 -1.03 0.00 0.00 34.95 31.77 1bzf s ARG 52 CO -0.14 -0.08 1.06 -1.25 -1.13 0.00 0.00 175.30 173.76 1bzf s PRO 53 N -3.33 3.25 0.31 3.89 0.04 -1.26 -5.04 135.00 132.86 1bzf s PRO 53 Ca 0.62 0.67 -0.27 0.00 0.04 0.00 0.00 61.00 62.05 1bzf s PRO 53 Cb -0.09 -2.05 -0.09 0.00 0.04 0.00 0.00 34.50 32.30 1bzf s PRO 53 CO 0.16 -0.80 0.98 -0.51 0.04 0.00 0.00 177.00 176.87 1bzf s LEU 54 N -5.29 4.42 0.66 -3.56 1.43 -1.26 -5.05 118.68 110.03 1bzf s LEU 54 Ca 0.56 1.95 -0.11 0.00 -1.03 0.00 0.00 54.13 55.51 1bzf s LEU 54 Cb -0.11 -3.89 -0.01 0.00 0.03 0.00 0.00 46.19 42.21 1bzf s LEU 54 CO 0.53 -0.08 1.05 -2.16 0.23 0.00 0.00 176.35 175.92 1bzf s PRO 55 N -1.82 3.17 -1.77 1.29 0.04 -1.26 -4.03 135.00 130.63 1bzf s PRO 55 Ca 0.48 0.54 0.00 0.00 0.04 0.00 0.00 61.00 62.06 1bzf s PRO 55 Cb -0.23 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.24 1bzf s PRO 55 CO 0.29 -0.81 0.00 0.39 0.04 0.00 0.00 177.00 176.91 1bzf n GLU 56 N -2.86 -1.56 -3.64 4.56 1.02 -1.26 -4.93 120.64 111.98 1bzf n GLU 56 Ca 0.06 1.00 -0.03 0.00 -0.02 0.00 0.00 57.16 58.17 1bzf n GLU 56 Cb 0.56 -5.57 -0.05 0.00 -0.02 0.00 0.00 31.44 26.36 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 -4.79 0.11 0.49 3.49 1.70 -1.26 -3.10 118.95 115.59 1bzf s ARG 57 Ca 0.00 0.06 -0.18 0.00 -0.47 0.00 0.00 55.73 55.13 1bzf s ARG 57 Cb 0.00 0.05 -0.08 0.00 -0.57 0.00 0.00 34.95 34.35 1bzf s ARG 57 CO 0.00 -0.03 0.99 0.99 -1.08 0.00 0.00 175.30 176.18 1bzf s THR 58 N -0.63 4.27 -0.37 4.99 2.01 -1.23 -4.68 115.64 120.00 1bzf s THR 58 Ca 0.08 1.24 0.03 0.00 0.31 0.00 0.00 61.69 63.34 1bzf s THR 58 Cb -0.02 -3.59 0.11 0.00 0.01 0.00 0.00 72.50 69.00 1bzf s THR 58 CO -0.10 -0.48 0.11 0.20 -0.69 0.00 0.00 174.62 173.66 1bzf s ASN 59 N -2.59 4.42 0.21 3.53 0.02 -1.26 -2.79 114.94 116.49 1bzf s ASN 59 Ca 0.62 -2.20 -0.09 0.00 -1.02 0.00 0.00 52.86 50.17 1bzf s ASN 59 Cb -0.11 -1.39 -0.07 0.00 0.02 0.00 0.00 41.25 39.70 1bzf s ASN 59 CO 0.25 -0.36 0.52 -0.69 0.02 0.00 0.00 177.10 176.84 1bzf s VAL 60 N 0.86 4.97 -0.07 1.60 1.01 -0.75 -2.42 120.40 125.60 1bzf s VAL 60 Ca 0.12 0.43 -0.01 0.00 0.00 0.00 0.00 61.98 62.52 1bzf s VAL 60 Cb -0.20 -3.63 0.03 0.00 0.00 0.00 0.00 36.38 32.58 1bzf s VAL 60 CO -0.10 -0.02 0.01 -0.69 0.00 0.00 0.00 175.10 174.29 1bzf s VAL 61 N -1.75 0.32 -0.28 2.92 1.01 -1.09 -2.44 120.40 119.09 1bzf s VAL 61 Ca 0.45 0.14 -0.15 0.00 0.00 0.00 0.00 61.98 62.43 1bzf s VAL 61 Cb -0.12 -0.48 -0.04 0.00 0.00 0.00 0.00 36.38 35.74 1bzf s VAL 61 CO 0.21 0.25 0.36 -0.22 0.00 0.00 0.00 175.10 175.70 1bzf s LEU 62 N 1.92 4.07 0.00 3.92 2.96 -1.14 -1.53 118.68 128.88 1bzf s LEU 62 Ca 0.04 0.21 -0.02 0.00 -0.22 0.00 0.00 54.13 54.14 1bzf s LEU 62 Cb -0.12 -2.39 -0.01 0.00 0.50 0.00 0.00 46.19 44.17 1bzf s LEU 62 CO -0.05 -0.19 0.03 0.28 -1.32 0.00 0.00 176.35 175.11 1bzf s THR 63 N 2.04 0.06 -0.47 3.68 -1.32 -1.15 -4.07 115.64 114.41 1bzf s THR 63 Ca 0.14 -0.52 0.03 0.00 -1.21 0.00 0.00 61.69 60.14 1bzf s THR 63 Cb -0.16 -0.22 0.64 0.00 -1.51 0.00 0.00 72.50 71.25 1bzf s THR 63 CO 0.10 -0.28 1.91 1.57 -2.21 0.00 0.00 174.62 175.71 1bzf n HIS 64 N 2.14 3.02 -3.73 9.09 -0.00 -1.26 -4.51 115.22 119.97 1bzf n HIS 64 Ca -0.19 -1.98 -0.12 0.00 0.46 0.00 0.00 57.72 55.88 1bzf n HIS 64 Cb 0.57 -0.99 -0.10 0.00 -0.12 0.00 0.00 29.99 29.34 1bzf n HIS 64 CO 0.00 0.00 0.00 1.14 0.46 0.00 0.00 176.34 177.94 1bzf s GLN 65 N -3.36 0.43 -0.19 1.57 -2.07 -1.26 -5.02 119.66 109.76 1bzf s GLN 65 Ca 0.57 0.61 0.01 0.00 -1.82 0.00 0.00 55.36 54.73 1bzf s GLN 65 Cb 0.48 0.15 0.24 0.00 -1.09 0.00 0.00 33.01 32.79 1bzf s GLN 65 CO 0.09 -0.08 1.50 -1.91 -1.32 0.00 0.00 175.29 173.57 1bzf n GLU 66 N 3.26 1.52 -0.06 9.60 0.00 -1.26 -4.00 120.64 129.70 1bzf n GLU 66 Ca -0.16 -1.19 -0.18 0.00 0.00 0.00 0.00 57.16 55.63 1bzf n GLU 66 Cb 0.57 -1.47 -0.13 0.00 0.00 0.00 0.00 31.44 30.41 1bzf n GLU 66 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 1bzf n ASP 67 N 0.02 1.74 -4.80 4.31 -0.08 -1.26 -4.94 116.55 111.53 1bzf n ASP 67 Ca 0.23 0.07 -0.32 0.00 -1.51 0.00 0.00 54.79 53.27 1bzf n ASP 67 Cb 0.87 -0.42 0.05 0.00 2.34 0.00 0.00 41.12 43.96 1bzf n ASP 67 CO 0.00 0.00 0.00 -0.47 0.12 0.00 0.00 177.20 176.85 1bzf s TYR 68 N -2.54 2.96 -0.28 -0.67 5.04 -1.26 -5.05 117.35 115.55 1bzf s TYR 68 Ca -0.24 1.48 0.01 0.00 -2.44 0.00 0.00 57.07 55.87 1bzf s TYR 68 Cb 0.08 -2.96 0.16 0.00 0.35 0.00 0.00 41.96 39.58 1bzf s TYR 68 CO 0.71 -1.32 0.40 -0.65 -1.34 0.00 0.00 175.55 173.35 1bzf s GLN 69 N -4.68 0.40 -0.34 4.97 -0.21 -1.26 -5.11 119.66 113.42 1bzf s GLN 69 Ca 0.61 0.17 -0.21 0.00 0.02 0.00 0.00 55.36 55.95 1bzf s GLN 69 Cb -0.16 -0.35 0.00 0.00 1.00 0.00 0.00 33.01 33.51 1bzf s GLN 69 CO 0.49 -0.98 0.64 0.00 -2.12 0.00 0.00 175.29 173.33 1bzf s ALA 70 N 2.53 3.47 -0.13 6.09 0.00 -1.26 -5.03 121.76 127.44 1bzf s ALA 70 Ca 0.10 -0.79 -0.29 0.00 0.00 0.00 0.00 51.96 50.99 1bzf s ALA 70 Cb -0.13 -3.17 -0.01 0.00 0.00 0.00 0.00 23.12 19.81 1bzf s ALA 70 CO -0.28 -1.28 1.00 -0.65 0.00 0.00 0.00 175.76 174.54 1bzf s GLN 71 N 2.71 4.39 0.00 0.00 -0.21 -1.26 -3.57 119.66 121.72 1bzf s GLN 71 Ca 0.25 1.36 0.00 0.00 0.02 0.00 0.00 55.36 56.99 1bzf s GLN 71 Cb -0.14 -3.56 0.00 0.00 1.00 0.00 0.00 33.01 30.31 1bzf s GLN 71 CO 0.14 -0.36 0.00 0.41 -2.12 0.00 0.00 175.29 173.36 1bzf n GLY 72 N 3.15 0.94 3.40 3.09 0.00 -1.26 -4.64 105.19 109.87 1bzf n GLY 72 Ca 0.09 -0.65 -0.14 0.00 0.00 0.00 0.00 46.02 45.32 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 -2.96 -1.36 -0.84 4.61 0.00 -1.23 -4.71 121.76 115.28 1bzf s ALA 73 Ca 0.00 0.68 -0.22 0.00 0.00 0.00 0.00 51.96 52.42 1bzf s ALA 73 Cb 0.00 0.31 0.09 0.00 0.00 0.00 0.00 23.12 23.52 1bzf s ALA 73 CO 0.00 -0.47 1.15 0.08 0.00 0.00 0.00 175.76 176.52 1bzf s VAL 74 N -2.21 4.34 -0.58 0.00 1.01 -1.02 -4.91 120.40 117.04 1bzf s VAL 74 Ca -0.07 -0.82 -0.28 0.00 0.00 0.00 0.00 61.98 60.81 1bzf s VAL 74 Cb -0.01 -4.82 0.01 0.00 0.00 0.00 0.00 36.38 31.57 1bzf s VAL 74 CO 0.00 -1.61 1.48 -0.69 0.00 0.00 0.00 175.10 174.28 1bzf s VAL 75 N 3.88 3.70 0.25 2.92 1.01 -1.26 -2.67 120.40 128.23 1bzf s VAL 75 Ca 0.32 0.56 0.01 0.00 0.00 0.00 0.00 61.98 62.87 1bzf s VAL 75 Cb -0.08 -4.40 -0.04 0.00 0.00 0.00 0.00 36.38 31.86 1bzf s VAL 75 CO -0.01 -1.19 0.44 0.68 0.00 0.00 0.00 175.10 175.01 1bzf s VAL 76 N 6.48 5.18 -0.06 2.92 -7.23 -0.58 -4.95 120.40 122.17 1bzf s VAL 76 Ca 0.53 -0.50 0.23 0.00 -1.81 0.00 0.00 61.98 60.43 1bzf s VAL 76 Cb -0.11 -3.79 0.43 0.00 0.56 0.00 0.00 36.38 33.47 1bzf s VAL 76 CO 0.23 -0.32 1.18 1.41 -0.31 0.00 0.00 175.10 177.29 1bzf n HIS 77 N -1.13 0.11 -3.60 2.82 8.25 -1.26 -2.91 115.22 117.49 1bzf n HIS 77 Ca -0.05 -0.80 -0.09 0.00 -0.26 0.00 0.00 57.72 56.51 1bzf n HIS 77 Cb 0.55 -0.18 -0.06 0.00 1.12 0.00 0.00 29.99 31.43 1bzf n HIS 77 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1bzf s ASP 78 N -2.35 -0.35 0.31 0.41 -1.08 -1.26 -4.94 116.67 107.42 1bzf s ASP 78 Ca 0.35 0.49 0.07 0.00 -0.52 0.00 0.00 52.55 52.94 1bzf s ASP 78 Cb 0.38 0.44 0.52 0.00 -1.46 0.00 0.00 42.92 42.80 1bzf s ASP 78 CO -0.14 -0.24 1.75 0.58 0.52 0.00 0.00 175.17 177.63 1bzf h VAL 79 N 2.86 1.28 -0.10 1.11 2.07 -1.97 -2.64 116.25 118.85 1bzf h VAL 79 Ca -0.21 -1.36 -0.13 0.00 0.82 0.00 0.00 66.70 65.82 1bzf h VAL 79 Cb 1.17 1.58 -0.01 0.00 -1.52 0.00 0.00 31.29 32.51 1bzf h VAL 79 CO 0.24 0.41 -0.51 0.00 0.02 0.00 0.00 177.57 177.73 1bzf h ALA 80 N 1.43 0.96 -0.28 1.67 0.00 -1.99 -2.89 119.26 118.17 1bzf h ALA 80 Ca 0.03 -0.48 -0.10 0.00 0.00 0.00 0.00 54.91 54.36 1bzf h ALA 80 Cb 0.72 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1bzf h ALA 80 CO 0.05 0.66 -0.25 0.00 0.00 0.00 0.00 179.25 179.72 1bzf h ALA 81 N 1.27 1.05 -0.16 0.00 0.00 -1.87 -0.26 119.26 119.29 1bzf h ALA 81 Ca 0.01 -0.35 -0.11 0.00 0.00 0.00 0.00 54.91 54.46 1bzf h ALA 81 Cb 0.97 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1bzf h ALA 81 CO 0.08 0.58 -0.36 0.28 0.00 0.00 0.00 179.25 179.82 1bzf h VAL 82 N 0.48 1.29 0.03 0.00 2.07 -1.32 -2.70 116.25 116.10 1bzf h VAL 82 Ca 0.07 -1.44 -0.23 0.00 0.82 0.00 0.00 66.70 65.92 1bzf h VAL 82 Cb 0.69 1.58 -0.02 0.00 -1.52 0.00 0.00 31.29 32.01 1bzf h VAL 82 CO 0.05 0.44 -1.07 -0.26 0.02 0.00 0.00 177.57 176.75 1bzf h PHE 83 N 0.28 0.12 0.00 1.57 0.04 -1.28 -2.75 116.94 114.92 1bzf h PHE 83 Ca 0.03 -0.09 -0.05 0.00 2.80 0.00 0.00 57.97 60.66 1bzf h PHE 83 Cb 0.77 -0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.91 1bzf h PHE 83 CO 0.02 1.07 -0.25 0.00 -0.60 0.00 0.00 178.31 178.55 1bzf h ALA 84 N 0.90 1.34 0.00 2.45 0.00 -0.83 -1.13 119.26 121.98 1bzf h ALA 84 Ca -0.04 -0.22 -0.15 0.00 0.00 0.00 0.00 54.91 54.49 1bzf h ALA 84 Cb 1.82 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.55 1bzf h ALA 84 CO 0.15 0.31 -1.25 -0.92 0.00 0.00 0.00 179.25 177.54 1bzf h TYR 85 N 0.00 0.00 0.05 0.00 5.03 -1.48 -3.31 116.97 117.25 1bzf h TYR 85 Ca -0.00 0.00 -0.23 0.00 2.58 0.00 0.00 58.73 61.08 1bzf h TYR 85 Cb 0.52 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 38.79 1bzf h TYR 85 CO 0.00 0.53 -1.03 0.00 -1.32 0.00 0.00 178.16 176.34 1bzf h ALA 86 N 1.47 0.33 -0.09 1.82 0.00 -1.14 -3.20 119.26 118.46 1bzf h ALA 86 Ca -0.13 -0.81 -0.08 0.00 0.00 0.00 0.00 54.91 53.89 1bzf h ALA 86 Cb 1.52 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 1bzf h ALA 86 CO 0.05 0.99 -0.30 1.57 0.00 0.00 0.00 179.25 181.56 1bzf h LYS 87 N 0.08 0.16 0.00 0.00 2.10 -1.34 -2.21 116.57 115.37 1bzf h LYS 87 Ca -0.07 -0.06 -0.07 0.00 -2.00 0.00 0.00 60.65 58.46 1bzf h LYS 87 Cb 1.72 -0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 33.03 1bzf h LYS 87 CO 0.16 0.45 -0.32 0.37 -2.00 0.00 0.00 179.45 178.11 1bzf h GLN 88 N 0.14 0.00 -3.43 0.07 4.15 -1.64 -3.36 115.11 111.04 1bzf h GLN 88 Ca 0.02 0.00 -0.65 0.00 0.77 0.00 0.00 58.65 58.80 1bzf h GLN 88 Cb 0.61 0.00 -0.41 0.00 0.21 0.00 0.00 27.48 27.89 1bzf h GLN 88 CO 0.04 0.32 -0.61 -1.01 -1.93 0.00 0.00 178.83 175.64 1bzf s HIS 89 N -3.78 3.21 -0.27 3.99 3.76 -0.83 -4.91 115.29 116.48 1bzf s HIS 89 Ca -0.01 -3.14 0.20 0.00 -0.15 0.00 0.00 55.06 51.96 1bzf s HIS 89 Cb 0.12 -2.85 0.28 0.00 1.11 0.00 0.00 32.58 31.23 1bzf s HIS 89 CO 0.67 -0.75 1.56 -1.00 -0.85 0.00 0.00 174.74 174.36 1bzf h PRO 90 N 6.56 0.00 0.00 8.40 0.13 -1.72 -3.21 132.00 142.16 1bzf h PRO 90 Ca -0.07 0.00 -0.07 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 0.24 -0.32 0.22 -0.23 0.00 0.00 178.00 178.59 1bzf h ASP 91 N 0.00 0.00 -6.25 1.44 3.58 -1.91 -3.44 116.42 109.84 1bzf h ASP 91 Ca -0.00 0.00 -0.49 0.00 0.42 0.00 0.00 57.03 56.96 1bzf h ASP 91 Cb 1.14 0.00 0.05 0.00 1.72 0.00 0.00 39.33 42.25 1bzf h ASP 91 CO 0.03 0.32 0.01 0.00 -2.88 0.00 0.00 179.24 176.72 1bzf n GLN 92 N -3.75 0.30 -4.03 0.28 6.02 -1.21 -4.99 117.38 110.00 1bzf n GLN 92 Ca -0.01 -3.06 -0.11 0.00 -0.01 0.00 0.00 57.00 53.81 1bzf n GLN 92 Cb 0.42 -0.42 -0.11 0.00 1.02 0.00 0.00 30.24 31.14 1bzf n GLN 92 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1bzf s GLU 93 N -4.90 0.44 -0.08 -1.09 0.41 -1.26 -4.96 118.70 107.26 1bzf s GLU 93 Ca 0.65 -0.72 -0.22 0.00 -0.41 0.00 0.00 54.97 54.27 1bzf s GLU 93 Cb -0.05 -0.08 -0.04 0.00 -1.78 0.00 0.00 34.13 32.18 1bzf s GLU 93 CO 0.42 -0.00 0.64 -1.17 -0.49 0.00 0.00 175.26 174.65 1bzf s LEU 94 N -1.62 4.31 -0.07 1.80 2.96 -1.26 -1.95 118.68 122.86 1bzf s LEU 94 Ca -0.12 1.09 0.02 0.00 -0.22 0.00 0.00 54.13 54.90 1bzf s LEU 94 Cb -0.09 -2.97 0.01 0.00 0.50 0.00 0.00 46.19 43.64 1bzf s LEU 94 CO -0.01 -0.08 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.14 1bzf s VAL 95 N 0.71 1.12 -0.32 1.68 1.01 -1.14 -2.74 120.40 120.72 1bzf s VAL 95 Ca 0.34 -0.47 -0.15 0.00 0.00 0.00 0.00 61.98 61.70 1bzf s VAL 95 Cb -0.17 -1.03 -0.02 0.00 0.00 0.00 0.00 36.38 35.16 1bzf s VAL 95 CO 0.16 0.35 0.37 -0.63 0.00 0.00 0.00 175.10 175.35 1bzf s ILE 96 N 0.68 5.17 -0.16 2.22 -1.09 -0.29 -2.68 121.20 125.04 1bzf s ILE 96 Ca -0.14 0.22 0.14 0.00 -2.23 0.00 0.00 60.65 58.64 1bzf s ILE 96 Cb -0.16 -3.78 -0.20 0.00 -1.58 0.00 0.00 42.46 36.74 1bzf s ILE 96 CO 0.04 -0.02 0.06 0.00 -1.23 0.00 0.00 174.94 173.79 1bzf n ALA 97 N 5.38 1.61 0.00 9.38 0.00 -1.17 -2.15 120.51 133.55 1bzf n ALA 97 Ca -0.09 -1.06 0.00 0.00 0.00 0.00 0.00 53.44 52.29 1bzf n ALA 97 Cb 0.50 -0.09 0.00 0.00 0.00 0.00 0.00 19.45 19.85 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 2.00 -2.11 0.00 0.00 0.00 -1.26 -4.75 105.19 99.08 1bzf n GLY 98 Ca -0.26 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.52 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 -0.48 0.80 0.19 -0.02 0.00 -1.26 -1.66 105.19 102.75 1bzf n GLY 99 Ca 0.00 -1.58 0.01 0.00 0.00 0.00 0.00 46.02 44.45 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 -1.85 1.29 0.00 4.61 0.00 -1.95 -2.28 119.26 119.09 1bzf h ALA 100 Ca 0.00 -0.37 -0.12 0.00 0.00 0.00 0.00 54.91 54.42 1bzf h ALA 100 Cb 0.00 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1bzf h ALA 100 CO 0.00 0.52 -0.56 1.96 0.00 0.00 0.00 179.25 181.17 1bzf h GLN 101 N 0.06 0.00 0.03 0.00 1.08 -2.00 -3.08 115.11 111.20 1bzf h GLN 101 Ca 0.00 0.00 -0.22 0.00 -1.45 0.00 0.00 58.65 56.98 1bzf h GLN 101 Cb 0.72 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.15 1bzf h GLN 101 CO 0.05 0.56 -0.99 0.82 -0.95 0.00 0.00 178.83 178.32 1bzf h ILE 102 N 0.00 1.49 0.69 2.54 1.08 -1.70 -2.51 117.51 119.10 1bzf h ILE 102 Ca -0.01 -2.75 -0.03 0.00 -0.39 0.00 0.00 64.86 61.68 1bzf h ILE 102 Cb 1.16 2.60 0.01 0.00 -3.07 0.00 0.00 36.82 37.52 1bzf h ILE 102 CO 0.07 0.80 -0.33 -0.26 -0.69 0.00 0.00 178.15 177.74 1bzf h PHE 103 N 0.12 -0.86 0.00 1.37 0.04 -1.36 -2.28 116.94 113.96 1bzf h PHE 103 Ca -0.07 -0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.67 1bzf h PHE 103 Cb 1.65 0.29 -0.00 0.00 2.20 0.00 0.00 35.95 40.09 1bzf h PHE 103 CO 0.04 -0.51 -0.03 1.15 -0.60 0.00 0.00 178.31 178.37 1bzf h THR 104 N -1.10 0.21 0.00 -1.55 2.02 -1.65 0.87 112.91 111.71 1bzf h THR 104 Ca -0.10 -0.21 -0.11 0.00 0.77 0.00 0.00 66.41 66.76 1bzf h THR 104 Cb 0.75 1.17 -0.02 0.00 -1.74 0.00 0.00 68.15 68.31 1bzf h THR 104 CO 0.16 0.03 -0.53 0.00 0.37 0.00 0.00 175.52 175.55 1bzf h ALA 105 N 1.97 1.04 -0.08 6.16 0.00 -1.04 -3.13 119.26 124.18 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 0.17 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1bzf h ALA 105 CO 0.00 0.66 0.00 1.19 0.00 0.00 0.00 179.25 181.10 1bzf n PHE 106 N -3.79 0.23 0.25 0.00 3.72 -0.49 -4.62 117.46 112.76 1bzf n PHE 106 Ca -0.01 -0.80 0.13 0.00 -0.05 0.00 0.00 57.45 56.71 1bzf n PHE 106 Cb 0.56 -0.15 0.59 0.00 -0.94 0.00 0.00 39.48 39.55 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 0.55 0.00 -0.45 -1.08 5.09 -0.82 -2.84 116.57 117.02 1bzf h LYS 107 Ca 0.00 0.00 -0.13 0.00 0.09 0.00 0.00 60.65 60.61 1bzf h LYS 107 Cb 0.94 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 33.25 1bzf h LYS 107 CO 0.04 0.14 -0.22 0.22 -2.09 0.00 0.00 179.45 177.55 1bzf h ASP 108 N 0.00 0.94 -1.06 7.07 1.82 -1.82 -3.05 116.42 120.32 1bzf h ASP 108 Ca -0.00 -0.35 -0.66 0.00 -0.39 0.00 0.00 57.03 55.63 1bzf h ASP 108 Cb 0.58 -0.26 -0.32 0.00 0.68 0.00 0.00 39.33 40.01 1bzf h ASP 108 CO 0.02 1.12 0.49 0.47 -1.61 0.00 0.00 179.24 179.73 1bzf n ASP 109 N -4.11 7.03 -4.88 2.28 8.00 -1.08 -4.99 116.55 118.79 1bzf n ASP 109 Ca 0.00 -3.78 -0.31 0.00 0.71 0.00 0.00 54.79 51.41 1bzf n ASP 109 Cb 0.45 -0.84 -0.05 0.00 -0.02 0.00 0.00 41.12 40.67 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 -4.83 4.96 0.09 2.53 0.11 -1.15 -3.64 120.40 118.47 1bzf s VAL 110 Ca 0.60 0.36 0.00 0.00 -2.93 0.00 0.00 61.98 60.01 1bzf s VAL 110 Cb 0.48 -3.65 0.00 0.00 -1.53 0.00 0.00 36.38 31.68 1bzf s VAL 110 CO -0.04 -0.15 0.00 0.47 -3.33 0.00 0.00 175.10 172.04 1bzf n ASP 111 N -0.39 0.06 -4.93 3.54 9.92 -1.18 -4.82 116.55 118.75 1bzf n ASP 111 Ca -0.00 0.15 -0.25 0.00 -0.53 0.00 0.00 54.79 54.15 1bzf n ASP 111 Cb 0.53 0.08 0.01 0.00 -0.64 0.00 0.00 41.12 41.09 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 -1.36 4.51 -0.31 -3.53 2.01 -1.17 -1.99 115.64 113.81 1bzf s THR 112 Ca 0.00 -0.14 -0.02 0.00 0.31 0.00 0.00 61.69 61.83 1bzf s THR 112 Cb 0.00 -3.70 0.12 0.00 0.01 0.00 0.00 72.50 68.93 1bzf s THR 112 CO 0.00 -0.60 0.17 -0.76 -0.69 0.00 0.00 174.62 172.75 1bzf s LEU 113 N -4.65 0.58 -0.51 4.42 1.43 -1.15 -2.82 118.68 115.98 1bzf s LEU 113 Ca 0.47 -1.51 -0.18 0.00 -1.03 0.00 0.00 54.13 51.88 1bzf s LEU 113 Cb -0.10 -0.27 0.07 0.00 0.03 0.00 0.00 46.19 45.92 1bzf s LEU 113 CO 0.41 -0.39 0.59 -0.76 0.23 0.00 0.00 176.35 176.43 1bzf s LEU 114 N 1.81 5.21 -0.08 1.79 1.43 -1.02 -2.89 118.68 124.92 1bzf s LEU 114 Ca 0.12 -1.10 0.01 0.00 -1.03 0.00 0.00 54.13 52.12 1bzf s LEU 114 Cb -0.18 -2.36 -0.03 0.00 0.03 0.00 0.00 46.19 43.65 1bzf s LEU 114 CO -0.25 -0.87 -0.08 0.54 0.23 0.00 0.00 176.35 175.92 1bzf s VAL 115 N 2.40 3.56 -0.47 -1.59 0.11 -1.12 -2.85 120.40 120.44 1bzf s VAL 115 Ca 0.12 -0.52 -0.07 0.00 -2.93 0.00 0.00 61.98 58.58 1bzf s VAL 115 Cb -0.21 -2.46 0.12 0.00 -1.53 0.00 0.00 36.38 32.29 1bzf s VAL 115 CO 0.10 0.57 0.31 -0.89 -3.33 0.00 0.00 175.10 171.86 1bzf s THR 116 N -0.50 3.89 0.14 5.04 2.01 -1.16 -2.18 115.64 122.89 1bzf s THR 116 Ca 0.07 -1.97 -0.24 0.00 0.31 0.00 0.00 61.69 59.86 1bzf s THR 116 Cb -0.12 -3.59 -0.08 0.00 0.01 0.00 0.00 72.50 68.72 1bzf s THR 116 CO 0.02 -0.76 0.74 -0.13 -0.69 0.00 0.00 174.62 173.80 1bzf s ARG 117 N 1.17 4.50 -0.06 4.92 0.52 -1.12 -2.61 118.95 126.27 1bzf s ARG 117 Ca 0.08 1.08 0.02 0.00 -0.52 0.00 0.00 55.73 56.38 1bzf s ARG 117 Cb -0.24 -3.26 -0.03 0.00 0.52 0.00 0.00 34.95 31.93 1bzf s ARG 117 CO -0.02 0.57 -0.10 -0.51 0.02 0.00 0.00 175.30 175.25 1bzf s LEU 118 N -1.07 2.98 0.21 2.53 1.02 -1.22 -1.97 118.68 121.16 1bzf s LEU 118 Ca 0.35 -0.10 0.01 0.00 0.02 0.00 0.00 54.13 54.41 1bzf s LEU 118 Cb -0.22 -1.63 0.15 0.00 0.02 0.00 0.00 46.19 44.51 1bzf s LEU 118 CO 0.25 0.35 1.50 0.00 0.02 0.00 0.00 176.35 178.48 1bzf h ALA 119 N 5.28 0.73 -2.49 4.21 0.00 0.32 -3.27 119.26 124.04 1bzf h ALA 119 Ca -0.48 -0.56 -0.53 0.00 0.00 0.00 0.00 54.91 53.34 1bzf h ALA 119 Cb 1.16 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.89 1bzf h ALA 119 CO 0.51 0.73 0.71 0.20 0.00 0.00 0.00 179.25 181.41 1bzf s GLY 120 N -4.27 2.04 0.20 0.00 0.00 0.55 -4.94 107.32 100.90 1bzf s GLY 120 Ca -0.05 1.00 -0.30 0.00 0.00 0.00 0.00 44.72 45.36 1bzf s GLY 120 CO 0.82 2.32 1.03 -0.45 0.00 0.00 0.00 173.10 176.82 1bzf s SER 121 N 1.29 7.41 -0.12 1.64 0.15 -1.26 -4.75 113.70 118.06 1bzf s SER 121 Ca 0.63 2.03 -0.04 0.00 0.70 0.00 0.00 55.95 59.27 1bzf s SER 121 Cb -0.34 -2.61 0.06 0.00 -1.71 0.00 0.00 66.02 61.42 1bzf s SER 121 CO 0.29 -0.08 0.18 -0.36 1.20 0.00 0.00 173.24 174.47 1bzf s PHE 122 N -0.58 -0.22 0.10 3.44 0.08 -1.26 -5.09 117.98 114.45 1bzf s PHE 122 Ca 0.46 0.56 -0.11 0.00 0.12 0.00 0.00 56.93 57.96 1bzf s PHE 122 Cb -0.28 -0.26 -0.06 0.00 -0.57 0.00 0.00 43.02 41.85 1bzf s PHE 122 CO 0.34 -0.35 0.44 -1.21 -0.10 0.00 0.00 175.22 174.34 1bzf s GLU 123 N 2.31 3.82 0.00 0.44 0.41 -1.26 -4.78 118.70 119.64 1bzf s GLU 123 Ca 0.03 0.26 0.00 0.00 -0.41 0.00 0.00 54.97 54.85 1bzf s GLU 123 Cb -0.13 -2.97 0.00 0.00 -1.78 0.00 0.00 34.13 29.25 1bzf s GLU 123 CO -0.07 0.53 0.00 0.41 -0.49 0.00 0.00 175.26 175.64 1bzf n GLY 124 N 0.84 4.06 0.00 -1.39 0.00 -1.26 -4.97 105.19 102.47 1bzf n GLY 124 Ca -0.07 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.35 0.00 0.71 0.00 0.00 54.79 55.15 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 5.03 0.46 -3.53 2.01 -1.26 -5.09 115.64 112.26 1bzf s THR 126 Ca 0.00 0.59 0.03 0.00 0.31 0.00 0.00 61.69 62.62 1bzf s THR 126 Cb 0.00 -3.68 -0.03 0.00 0.01 0.00 0.00 72.50 68.81 1bzf s THR 126 CO 0.00 0.32 0.04 -0.54 -0.69 0.00 0.00 174.62 173.74 1bzf s LYS 127 N -1.81 2.06 0.23 4.92 1.02 -1.26 -3.31 119.74 121.60 1bzf s LYS 127 Ca 0.33 -2.27 -0.08 0.00 0.02 0.00 0.00 55.97 53.96 1bzf s LYS 127 Cb -0.15 -1.30 -0.07 0.00 -0.52 0.00 0.00 37.83 35.80 1bzf s LYS 127 CO 0.18 -0.33 0.53 1.41 -0.92 0.00 0.00 175.35 176.22 1bzf s MET 128 N -3.81 3.74 0.84 1.68 -2.45 -1.22 -4.75 119.30 113.32 1bzf s MET 128 Ca 0.16 0.17 -0.12 0.00 -1.25 0.00 0.00 55.69 54.66 1bzf s MET 128 Cb 0.04 -2.67 0.09 0.00 1.25 0.00 0.00 34.83 33.54 1bzf s MET 128 CO 0.09 0.31 1.10 0.96 1.05 0.00 0.00 175.02 178.53 1bzf s ILE 129 N -1.85 2.83 -0.94 10.11 -4.36 -1.26 -4.95 121.20 120.77 1bzf s ILE 129 Ca 0.46 0.27 -0.24 0.00 -0.26 0.00 0.00 60.65 60.88 1bzf s ILE 129 Cb -0.11 -2.95 0.04 0.00 1.25 0.00 0.00 42.46 40.69 1bzf s ILE 129 CO 0.23 -0.35 1.41 -2.16 0.24 0.00 0.00 174.94 174.31 1bzf s PRO 130 N -5.12 3.48 0.45 0.37 0.04 -1.26 -5.01 135.00 127.95 1bzf s PRO 130 Ca 0.62 -0.88 -0.21 0.00 0.04 0.00 0.00 61.00 60.57 1bzf s PRO 130 Cb -0.15 -5.04 -0.10 0.00 0.04 0.00 0.00 34.50 29.25 1bzf s PRO 130 CO 0.55 -2.20 0.99 -0.51 0.04 0.00 0.00 177.00 175.87 1bzf s LEU 131 N 5.21 3.92 -1.23 -3.56 1.43 -1.26 -4.95 118.68 118.24 1bzf s LEU 131 Ca 0.43 1.80 -0.18 0.00 -1.03 0.00 0.00 54.13 55.15 1bzf s LEU 131 Cb -0.02 -4.52 0.08 0.00 0.03 0.00 0.00 46.19 41.76 1bzf s LEU 131 CO -0.03 -0.52 1.64 0.21 0.23 0.00 0.00 176.35 177.87 1bzf s ASN 132 N -2.07 6.82 0.22 2.29 3.84 -1.26 -4.75 114.94 120.03 1bzf s ASN 132 Ca 0.64 -2.36 0.22 0.00 0.21 0.00 0.00 52.86 51.56 1bzf s ASN 132 Cb -0.13 -2.55 0.92 0.00 -0.55 0.00 0.00 41.25 38.95 1bzf s ASN 132 CO 0.16 -1.16 1.67 0.79 -2.79 0.00 0.00 177.10 175.78 1bzf n TRP 133 N 8.04 0.68 1.41 0.43 7.02 -1.26 -2.51 117.44 131.25 1bzf n TRP 133 Ca 0.44 0.27 0.00 0.00 -1.02 0.00 0.00 57.50 57.19 1bzf n TRP 133 Cb 0.46 -0.93 0.00 0.00 -2.42 0.00 0.00 31.31 28.42 1bzf n TRP 133 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 1bzf n ASP 134 N -2.12 0.00 -1.39 -0.99 8.00 -1.26 -2.73 116.55 116.06 1bzf n ASP 134 Ca 0.02 -1.41 0.04 0.00 0.71 0.00 0.00 54.79 54.16 1bzf n ASP 134 Cb 0.22 0.00 0.05 0.00 -0.02 0.00 0.00 41.12 41.37 1bzf n ASP 134 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1bzf n ASP 135 N -0.50 1.14 -3.60 -2.24 2.03 -1.04 -5.09 116.55 107.25 1bzf n ASP 135 Ca 0.00 -2.30 -0.18 0.00 0.52 0.00 0.00 54.79 52.83 1bzf n ASP 135 Cb 0.00 -0.34 -0.09 0.00 -0.72 0.00 0.00 41.12 39.97 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 -0.60 1.63 -0.13 -0.67 0.08 -1.10 -4.07 117.98 113.11 1bzf s PHE 136 Ca 0.35 -1.58 -0.19 0.00 0.12 0.00 0.00 56.93 55.63 1bzf s PHE 136 Cb 0.39 -0.71 0.05 0.00 -0.57 0.00 0.00 43.02 42.17 1bzf s PHE 136 CO -0.15 -0.78 0.48 0.99 -0.10 0.00 0.00 175.22 175.66 1bzf s THR 137 N -3.60 0.01 0.62 0.64 2.01 -1.01 -4.84 115.64 109.46 1bzf s THR 137 Ca 0.40 -0.10 -0.14 0.00 0.31 0.00 0.00 61.69 62.16 1bzf s THR 137 Cb 0.03 -0.72 -0.03 0.00 0.01 0.00 0.00 72.50 71.80 1bzf s THR 137 CO 0.23 -0.06 1.04 -0.75 -0.69 0.00 0.00 174.62 174.40 1bzf s LYS 138 N -0.29 3.34 0.00 4.92 2.20 -1.26 -1.35 119.74 127.30 1bzf s LYS 138 Ca -0.04 1.02 0.00 0.00 -0.36 0.00 0.00 55.97 56.59 1bzf s LYS 138 Cb -0.03 -2.04 0.00 0.00 -1.51 0.00 0.00 37.83 34.24 1bzf s LYS 138 CO 0.03 -0.78 0.00 1.33 -0.36 0.00 0.00 175.35 175.57 1bzf n VAL 139 N -2.40 0.00 -3.85 4.02 0.24 -1.03 -4.87 118.33 110.44 1bzf n VAL 139 Ca 0.08 0.00 -0.09 0.00 -2.04 0.00 0.00 64.34 62.29 1bzf n VAL 139 Cb 0.53 0.00 -0.07 0.00 -1.47 0.00 0.00 33.84 32.83 1bzf n VAL 139 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1bzf s SER 140 N -1.21 0.10 -0.28 -1.34 0.15 -1.19 -5.06 113.70 104.88 1bzf s SER 140 Ca 0.00 -0.62 -0.02 0.00 0.70 0.00 0.00 55.95 56.01 1bzf s SER 140 Cb 0.00 0.34 0.17 0.00 -1.71 0.00 0.00 66.02 64.81 1bzf s SER 140 CO 0.00 -0.72 0.53 -0.55 1.20 0.00 0.00 173.24 173.70 1bzf s SER 141 N -2.79 -0.85 -0.47 5.45 0.15 -1.26 -1.77 113.70 112.16 1bzf s SER 141 Ca 0.04 0.74 -0.18 0.00 0.70 0.00 0.00 55.95 57.25 1bzf s SER 141 Cb 0.04 1.84 0.05 0.00 -1.71 0.00 0.00 66.02 66.24 1bzf s SER 141 CO -0.10 -0.27 0.53 -0.60 1.20 0.00 0.00 173.24 174.00 1bzf s ARG 142 N 2.76 3.09 0.12 5.44 6.06 -1.11 -4.93 118.95 130.39 1bzf s ARG 142 Ca 0.16 -0.92 -0.16 0.00 -2.50 0.00 0.00 55.73 52.31 1bzf s ARG 142 Cb -0.15 -4.06 -0.07 0.00 0.06 0.00 0.00 34.95 30.73 1bzf s ARG 142 CO -0.19 -1.08 0.55 0.99 -2.50 0.00 0.00 175.30 173.07 1bzf s THR 143 N 2.32 4.84 -0.11 4.11 2.01 -1.26 -1.59 115.64 125.95 1bzf s THR 143 Ca 0.13 0.93 -0.06 0.00 0.31 0.00 0.00 61.69 62.99 1bzf s THR 143 Cb -0.19 -3.77 0.04 0.00 0.01 0.00 0.00 72.50 68.59 1bzf s THR 143 CO 0.12 0.34 0.27 0.54 -0.69 0.00 0.00 174.62 175.20 1bzf s VAL 144 N -1.35 -0.03 -0.22 3.82 0.11 -1.10 -5.01 120.40 116.61 1bzf s VAL 144 Ca 0.35 0.12 -0.05 0.00 -2.93 0.00 0.00 61.98 59.47 1bzf s VAL 144 Cb -0.16 -0.41 -0.02 0.00 -1.53 0.00 0.00 36.38 34.26 1bzf s VAL 144 CO 0.19 0.05 -0.00 -1.61 -3.33 0.00 0.00 175.10 170.39 1bzf s GLU 145 N 1.11 3.53 0.15 1.54 2.02 -1.26 -3.07 118.70 122.72 1bzf s GLU 145 Ca -0.08 -0.55 -0.02 0.00 0.02 0.00 0.00 54.97 54.33 1bzf s GLU 145 Cb -0.09 -3.10 0.04 0.00 0.10 0.00 0.00 34.13 31.08 1bzf s GLU 145 CO -0.08 -0.11 0.21 -3.47 0.02 0.00 0.00 175.26 171.83 1bzf n ASP 146 N 4.61 0.04 -0.13 -0.19 2.03 -1.26 -4.96 116.55 116.68 1bzf n ASP 146 Ca -0.17 -1.09 -0.09 0.00 0.52 0.00 0.00 54.79 53.96 1bzf n ASP 146 Cb 0.51 -0.16 -0.01 0.00 -0.72 0.00 0.00 41.12 40.75 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 -1.05 1.20 -3.25 5.18 1.35 -1.99 -3.43 112.91 110.91 1bzf h THR 147 Ca -0.07 -0.60 -0.49 0.00 -0.55 0.00 0.00 66.41 64.70 1bzf h THR 147 Cb 0.19 0.85 0.02 0.00 -1.73 0.00 0.00 68.15 67.48 1bzf h THR 147 CO 0.05 0.22 -0.03 0.21 -0.25 0.00 0.00 175.52 175.71 1bzf s ASN 148 N -5.85 6.32 0.36 5.36 2.47 -1.26 -4.99 114.94 117.34 1bzf s ASN 148 Ca -0.13 0.74 0.19 0.00 0.42 0.00 0.00 52.86 54.08 1bzf s ASN 148 Cb 0.10 -2.16 0.28 0.00 -1.45 0.00 0.00 41.25 38.02 1bzf s ASN 148 CO 0.75 -0.41 1.56 1.55 -3.72 0.00 0.00 177.10 176.83 1bzf h PRO 149 N 0.68 0.00 0.00 0.43 0.14 -2.00 -3.19 132.00 128.06 1bzf h PRO 149 Ca -0.48 0.00 -0.08 0.00 0.14 0.00 0.00 66.00 65.58 1bzf h PRO 149 Cb 1.21 0.00 -0.01 0.00 0.14 0.00 0.00 31.00 32.33 1bzf h PRO 149 CO 0.62 0.29 -0.73 0.00 0.14 0.00 0.00 178.00 178.32 1bzf h ALA 150 N 1.71 0.70 -0.19 -0.56 0.00 -1.94 -3.25 119.26 115.73 1bzf h ALA 150 Ca -0.00 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1bzf h ALA 150 Cb 1.16 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1bzf h ALA 150 CO 0.04 0.43 0.00 1.28 0.00 0.00 0.00 179.25 180.99 1bzf n LEU 151 N -2.99 2.05 -4.81 0.00 4.77 -1.21 -0.33 117.00 114.48 1bzf n LEU 151 Ca -0.01 -1.03 -0.35 0.00 -0.03 0.00 0.00 56.01 54.58 1bzf n LEU 151 Cb 0.68 -0.43 -0.06 0.00 -2.33 0.00 0.00 43.42 41.27 1bzf n LEU 151 CO 0.40 0.34 0.54 -0.89 -1.33 0.00 0.00 177.39 176.45 1bzf s THR 152 N -1.59 4.42 0.23 -5.08 2.01 -1.23 -4.15 115.64 110.27 1bzf s THR 152 Ca 0.16 1.47 -0.22 0.00 0.31 0.00 0.00 61.69 63.41 1bzf s THR 152 Cb 0.11 -3.83 0.04 0.00 0.01 0.00 0.00 72.50 68.83 1bzf s THR 152 CO 0.07 0.03 0.69 -1.38 -0.69 0.00 0.00 174.62 173.33 1bzf s HIS 153 N -1.74 -0.31 -0.00 4.92 -3.43 -1.18 0.86 115.29 114.41 1bzf s HIS 153 Ca 0.51 -0.06 0.00 0.00 -0.80 0.00 0.00 55.06 54.72 1bzf s HIS 153 Cb -0.15 0.65 0.00 0.00 -1.43 0.00 0.00 32.58 31.66 1bzf s HIS 153 CO 0.20 -1.09 -0.01 0.99 -2.00 0.00 0.00 174.74 172.83 1bzf s THR 154 N -3.84 0.13 -0.83 -5.38 2.01 -0.83 -2.72 115.64 104.18 1bzf s THR 154 Ca 0.08 -0.05 -0.17 0.00 0.31 0.00 0.00 61.69 61.86 1bzf s THR 154 Cb -0.04 -0.13 0.15 0.00 0.01 0.00 0.00 72.50 72.49 1bzf s THR 154 CO -0.00 0.05 0.93 -0.31 -0.69 0.00 0.00 174.62 174.60 1bzf s TYR 155 N 0.10 3.28 -0.02 4.92 2.02 -0.62 -2.79 117.35 124.24 1bzf s TYR 155 Ca -0.01 -1.47 -0.30 0.00 -0.37 0.00 0.00 57.07 54.92 1bzf s TYR 155 Cb -0.02 -4.09 -0.04 0.00 -0.40 0.00 0.00 41.96 37.41 1bzf s TYR 155 CO -0.00 -1.30 1.23 -1.21 -1.57 0.00 0.00 175.55 172.69 1bzf s GLU 156 N 1.94 4.36 -0.31 -0.62 0.41 -0.93 -2.73 118.70 120.83 1bzf s GLU 156 Ca 0.24 1.74 -0.05 0.00 -0.41 0.00 0.00 54.97 56.49 1bzf s GLU 156 Cb -0.10 -3.52 0.03 0.00 -1.78 0.00 0.00 34.13 28.76 1bzf s GLU 156 CO -0.06 -0.43 0.06 0.08 -0.49 0.00 0.00 175.26 174.42 1bzf s VAL 157 N 2.00 3.57 0.39 2.63 1.01 -0.73 -2.81 120.40 126.46 1bzf s VAL 157 Ca 0.58 -1.03 0.08 0.00 0.00 0.00 0.00 61.98 61.60 1bzf s VAL 157 Cb -0.27 -2.94 -0.03 0.00 0.00 0.00 0.00 36.38 33.14 1bzf s VAL 157 CO 0.24 -0.04 0.28 0.26 0.00 0.00 0.00 175.10 175.84 1bzf s TRP 158 N 1.39 2.72 -0.09 5.22 0.52 -1.14 -2.46 118.94 125.10 1bzf s TRP 158 Ca -0.01 -0.46 -0.09 0.00 0.02 0.00 0.00 56.10 55.56 1bzf s TRP 158 Cb -0.18 -1.97 0.02 0.00 -1.15 0.00 0.00 33.47 30.19 1bzf s TRP 158 CO 0.01 0.08 0.25 -0.65 0.02 0.00 0.00 176.95 176.66 1bzf s GLN 159 N -4.01 0.33 0.04 4.98 -0.21 -0.46 -2.91 119.66 117.42 1bzf s GLN 159 Ca 0.44 0.28 -0.30 0.00 0.02 0.00 0.00 55.36 55.79 1bzf s GLN 159 Cb -0.02 0.16 -0.07 0.00 1.00 0.00 0.00 33.01 34.07 1bzf s GLN 159 CO 0.26 -0.05 1.59 0.21 -2.12 0.00 0.00 175.29 175.17 1bzf s LYS 160 N -0.03 4.22 -0.12 2.91 2.20 -0.84 -2.41 119.74 125.67 1bzf s LYS 160 Ca -0.02 2.23 -0.19 0.00 -0.36 0.00 0.00 55.97 57.63 1bzf s LYS 160 Cb -0.02 -3.61 0.04 0.00 -1.51 0.00 0.00 37.83 32.73 1bzf s LYS 160 CO 0.01 -0.70 0.47 0.21 -0.36 0.00 0.00 175.35 174.98 1bzf s LYS 161 N 2.65 0.67 0.00 4.03 2.20 -1.26 -4.97 119.74 123.06 1bzf s LYS 161 Ca 0.71 0.40 0.00 0.00 -0.36 0.00 0.00 55.97 56.72 1bzf s LYS 161 Cb -0.37 0.32 0.00 0.00 -1.51 0.00 0.00 37.83 36.26 1bzf s LYS 161 CO 0.31 -0.14 0.00 0.00 -0.36 0.00 0.00 175.35 175.16