#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fzb s MET 4 N 0.00 3.58 0.51 1.57 0.00 -1.26 -4.90 119.30 118.80 3fzb s MET 4 Ca 0.00 1.61 0.21 0.00 0.00 0.00 0.00 55.69 57.51 3fzb s MET 4 Cb 0.00 -2.16 1.29 0.00 0.00 0.00 0.00 34.83 33.96 3fzb s MET 4 CO 0.00 -0.66 2.03 -0.22 0.00 0.00 0.00 175.02 176.17 3fzb h LYS 5 N 1.56 0.08 -0.27 4.11 1.63 -1.93 -1.99 116.57 119.77 3fzb h LYS 5 Ca -0.50 -0.00 -0.13 0.00 -0.85 0.00 0.00 60.65 59.17 3fzb h LYS 5 Cb 1.25 -0.02 -0.00 0.00 -0.60 0.00 0.00 32.23 32.86 3fzb h LYS 5 CO 0.58 0.05 -0.33 0.45 -3.45 0.00 0.00 179.45 176.75 3fzb h HIS 6 N 0.08 0.86 -0.84 1.91 3.86 -1.97 -1.26 115.15 117.79 3fzb h HIS 6 Ca 0.19 -0.27 0.07 0.00 -1.16 0.00 0.00 60.37 59.20 3fzb h HIS 6 Cb 0.65 -0.17 -0.06 0.00 1.06 0.00 0.00 27.41 28.88 3fzb h HIS 6 CO -0.00 1.03 0.51 1.15 0.86 0.00 0.00 177.93 181.48 3fzb h THR 7 N 0.44 1.00 -0.53 2.45 2.02 -1.75 -1.05 112.91 115.48 3fzb h THR 7 Ca 0.04 -0.31 -0.11 0.00 0.77 0.00 0.00 66.41 66.80 3fzb h THR 7 Cb 0.91 0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 67.32 3fzb h THR 7 CO 0.08 0.16 -0.09 -0.33 0.37 0.00 0.00 175.52 175.71 3fzb h GLU 8 N 0.90 0.98 0.40 6.66 5.08 -1.36 -2.61 114.58 124.64 3fzb h GLU 8 Ca 0.38 -0.35 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 3fzb h GLU 8 Cb 0.23 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 3fzb h GLU 8 CO -0.20 1.02 -0.37 -0.07 -1.00 0.00 0.00 179.01 178.40 3fzb h LEU 9 N 0.88 -1.00 -1.05 1.33 3.38 0.04 -1.86 115.31 117.04 3fzb h LEU 9 Ca 0.14 0.08 0.03 0.00 0.09 0.00 0.00 57.88 58.22 3fzb h LEU 9 Cb 0.64 0.32 -0.06 0.00 0.09 0.00 0.00 40.66 41.66 3fzb h LEU 9 CO 0.04 -0.50 0.64 0.03 0.09 0.00 0.00 178.44 178.75 3fzb h ARG 10 N -0.76 1.21 -0.15 1.13 3.08 -1.54 -1.66 114.38 115.68 3fzb h ARG 10 Ca -0.05 -0.07 0.01 0.00 0.07 0.00 0.00 59.98 59.94 3fzb h ARG 10 Cb 0.65 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 3fzb h ARG 10 CO -0.03 0.80 0.10 0.00 -1.07 0.00 0.00 179.97 179.78 3fzb h ALA 11 N 1.43 1.96 -0.40 0.04 0.00 -1.32 0.63 119.26 121.59 3fzb h ALA 11 Ca 0.38 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.21 3fzb h ALA 11 Cb -0.01 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3fzb h ALA 11 CO -0.11 0.02 -0.06 0.00 0.00 0.00 0.00 179.25 179.10 3fzb h ALA 12 N 1.91 0.55 0.36 0.00 0.00 -0.44 -1.52 119.26 120.12 3fzb h ALA 12 Ca 0.06 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 3fzb h ALA 12 Cb 0.06 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3fzb h ALA 12 CO -0.01 0.38 -0.17 0.28 0.00 0.00 0.00 179.25 179.73 3fzb h VAL 13 N 0.56 0.00 -0.91 0.00 2.07 -1.23 -2.92 116.25 113.82 3fzb h VAL 13 Ca 0.11 -0.61 0.17 0.00 0.82 0.00 0.00 66.70 67.18 3fzb h VAL 13 Cb 0.56 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.17 3fzb h VAL 13 CO 0.03 0.00 -0.29 -0.07 0.02 0.00 0.00 177.57 177.26 3fzb h LEU 14 N -1.09 -1.08 0.60 2.57 3.38 0.15 0.35 115.31 120.20 3fzb h LEU 14 Ca -0.05 0.28 -0.03 0.00 0.09 0.00 0.00 57.88 58.18 3fzb h LEU 14 Cb 0.37 0.63 -0.00 0.00 0.09 0.00 0.00 40.66 41.75 3fzb h LEU 14 CO 0.08 -0.30 -0.34 0.44 0.09 0.00 0.00 178.44 178.41 3fzb h ASP 15 N -0.02 -0.83 -0.57 -0.43 3.32 -1.38 0.55 116.42 117.05 3fzb h ASP 15 Ca 0.39 0.04 0.17 0.00 0.02 0.00 0.00 57.03 57.65 3fzb h ASP 15 Cb 0.64 0.24 -0.02 0.00 0.22 0.00 0.00 39.33 40.40 3fzb h ASP 15 CO -0.94 -0.55 0.79 0.00 -1.72 0.00 0.00 179.24 176.83 3fzb h ALA 16 N -0.52 2.35 0.17 3.45 0.00 -0.80 0.65 119.26 124.56 3fzb h ALA 16 Ca -0.08 -0.02 -0.30 0.00 0.00 0.00 0.00 54.91 54.52 3fzb h ALA 16 Cb 0.70 0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.55 3fzb h ALA 16 CO 0.10 -1.09 -1.34 -0.07 0.00 0.00 0.00 179.25 176.85 3fzb h LEU 17 N 0.00 0.55 0.06 0.00 3.38 0.76 -3.20 115.31 116.87 3fzb h LEU 17 Ca 0.27 -0.60 -0.14 0.00 0.09 0.00 0.00 57.88 57.50 3fzb h LEU 17 Cb 1.85 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 42.44 3fzb h LEU 17 CO -0.00 1.47 -0.60 -0.33 0.09 0.00 0.00 178.44 179.07 3fzb h GLU 18 N 0.10 0.30 -0.95 1.13 5.08 0.13 -3.19 114.58 117.18 3fzb h GLU 18 Ca -0.18 -0.40 0.26 0.00 -1.00 0.00 0.00 59.36 58.04 3fzb h GLU 18 Cb 2.04 0.13 -0.14 0.00 0.50 0.00 0.00 28.75 31.29 3fzb h GLU 18 CO 0.22 1.13 0.45 0.87 -1.00 0.00 0.00 179.01 180.69 3fzb h LYS 19 N -0.35 0.36 0.00 2.33 1.57 -1.24 -3.39 116.57 115.85 3fzb h LYS 19 Ca -0.09 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 3fzb h LYS 19 Cb 1.39 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.62 3fzb h LYS 19 CO 0.12 0.24 0.00 1.58 -0.57 0.00 0.00 179.45 180.82 3fzb n HIS 20 N -5.05 0.00 0.00 -1.35 -0.00 -1.20 -5.12 115.22 102.50 3fzb n HIS 20 Ca 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.98 3fzb n HIS 20 Cb 0.78 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.77 3fzb n HIS 20 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.34 173.97 3fzb n THR 22 N 0.00 0.00 -1.57 3.57 5.66 -1.25 -5.07 114.28 115.61 3fzb n THR 22 Ca 0.00 0.00 -0.36 0.00 -3.05 0.00 0.00 64.05 60.64 3fzb n THR 22 Cb 0.00 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 68.75 3fzb n THR 22 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 3fzb s GLY 23 N 0.00 -0.44 0.05 1.09 0.00 -1.26 -4.82 107.32 101.94 3fzb s GLY 23 Ca 0.00 -0.00 -0.28 0.00 0.00 0.00 0.00 44.72 44.43 3fzb s GLY 23 CO 0.00 4.13 1.18 0.00 0.00 0.00 0.00 173.10 178.41 3fzb s ALA 24 N 12.20 -2.04 -0.22 3.20 0.00 -1.26 -4.83 121.76 128.80 3fzb s ALA 24 Ca 0.97 0.43 -0.07 0.00 0.00 0.00 0.00 51.96 53.29 3fzb s ALA 24 Cb -0.17 0.49 -0.04 0.00 0.00 0.00 0.00 23.12 23.41 3fzb s ALA 24 CO 0.26 -1.06 0.07 0.99 0.00 0.00 0.00 175.76 176.02 3fzb s THR 25 N -2.65 4.56 0.17 0.00 2.01 -0.64 -5.00 115.64 114.10 3fzb s THR 25 Ca 0.15 -0.10 0.04 0.00 0.31 0.00 0.00 61.69 62.09 3fzb s THR 25 Cb 0.02 -3.09 -0.04 0.00 0.01 0.00 0.00 72.50 69.40 3fzb s THR 25 CO -0.01 0.39 0.21 -0.36 -0.69 0.00 0.00 174.62 174.16 3fzb s PHE 26 N 1.03 3.29 0.01 4.92 0.40 -1.26 -1.43 117.98 124.94 3fzb s PHE 26 Ca 0.04 0.02 0.04 0.00 -0.60 0.00 0.00 56.93 56.43 3fzb s PHE 26 Cb -0.14 -1.56 -0.01 0.00 0.51 0.00 0.00 43.02 41.82 3fzb s PHE 26 CO 0.03 0.51 -0.12 -0.06 0.70 0.00 0.00 175.22 176.28 3fzb s PHE 27 N -1.81 1.06 -1.09 0.36 0.40 -1.02 -4.94 117.98 110.94 3fzb s PHE 27 Ca 0.33 -0.27 -0.13 0.00 -0.60 0.00 0.00 56.93 56.25 3fzb s PHE 27 Cb -0.10 -0.66 0.21 0.00 0.51 0.00 0.00 43.02 42.98 3fzb s PHE 27 CO 0.26 0.00 1.20 0.34 0.70 0.00 0.00 175.22 177.72 3fzb s ASP 28 N -0.70 7.07 0.00 1.36 2.15 -1.26 -2.72 116.67 122.57 3fzb s ASP 28 Ca 0.02 -3.05 0.00 0.00 0.43 0.00 0.00 52.55 49.95 3fzb s ASP 28 Cb -0.06 -2.31 0.00 0.00 -0.30 0.00 0.00 42.92 40.25 3fzb s ASP 28 CO 0.00 -0.60 0.00 0.61 -0.17 0.00 0.00 175.17 175.01 3fzb n GLY 29 N 3.77 3.48 3.67 2.66 0.00 -0.63 -5.00 105.19 113.14 3fzb n GLY 29 Ca 0.28 -1.74 -0.44 0.00 0.00 0.00 0.00 46.02 44.12 3fzb n GLY 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fzb n ARG 30 N -1.08 2.68 -1.86 1.61 5.12 -1.26 -4.70 116.66 117.17 3fzb n ARG 30 Ca 0.00 0.98 -0.31 0.00 -1.93 0.00 0.00 57.85 56.59 3fzb n ARG 30 Cb 0.00 -2.91 0.02 0.00 -1.16 0.00 0.00 32.46 28.40 3fzb n ARG 30 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 3fzb s PRO 31 N 4.39 3.46 -0.04 5.56 0.04 -1.26 -5.00 135.00 142.15 3fzb s PRO 31 Ca 0.90 0.71 0.10 0.00 0.04 0.00 0.00 61.00 62.75 3fzb s PRO 31 Cb -0.51 -2.07 -0.15 0.00 0.04 0.00 0.00 34.50 31.81 3fzb s PRO 31 CO 0.45 -0.66 0.18 0.00 0.04 0.00 0.00 177.00 177.00 3fzb n ALA 32 N -2.80 2.21 -2.91 8.56 0.00 -1.26 -5.03 120.51 119.27 3fzb n ALA 32 Ca 0.06 -0.37 -0.11 0.00 0.00 0.00 0.00 53.44 53.02 3fzb n ALA 32 Cb 0.54 -0.25 -0.09 0.00 0.00 0.00 0.00 19.45 19.65 3fzb n ALA 32 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3fzb s VAL 33 N -2.60 0.10 0.22 0.00 -7.23 -1.26 -5.18 120.40 104.46 3fzb s VAL 33 Ca -0.04 -0.85 0.02 0.00 -1.81 0.00 0.00 61.98 59.29 3fzb s VAL 33 Cb 0.06 -0.80 -0.05 0.00 0.56 0.00 0.00 36.38 36.15 3fzb s VAL 33 CO 0.44 -0.47 0.05 -0.36 -0.31 0.00 0.00 175.10 174.44 3fzb s PHE 34 N -2.27 1.43 0.16 2.82 0.40 -1.26 -5.14 117.98 114.11 3fzb s PHE 34 Ca -0.07 -1.09 0.06 0.00 -0.60 0.00 0.00 56.93 55.23 3fzb s PHE 34 Cb -0.03 -0.83 -0.04 0.00 0.51 0.00 0.00 43.02 42.64 3fzb s PHE 34 CO -0.02 -0.25 0.03 -0.51 0.70 0.00 0.00 175.22 175.16 3fzb s ASP 35 N -3.26 4.97 0.29 1.36 1.01 -1.26 -4.98 116.67 114.80 3fzb s ASP 35 Ca 0.32 -0.30 0.02 0.00 0.71 0.00 0.00 52.55 53.30 3fzb s ASP 35 Cb 0.07 -1.14 0.73 0.00 1.01 0.00 0.00 42.92 43.60 3fzb s ASP 35 CO 0.09 0.10 1.47 -1.84 0.21 0.00 0.00 175.17 175.20 3fzb n GLU 36 N -0.03 -0.07 0.00 8.23 0.00 -1.26 0.93 120.64 128.44 3fzb n GLU 36 Ca -0.10 1.40 0.05 0.00 0.00 0.00 0.00 57.16 58.51 3fzb n GLU 36 Cb 0.54 -2.23 0.25 0.00 0.00 0.00 0.00 31.44 30.00 3fzb n GLU 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3fzb n ALA 37 N -3.16 1.67 0.10 -1.84 0.00 -1.26 -3.03 120.51 112.99 3fzb n ALA 37 Ca 0.22 -0.05 0.04 0.00 0.00 0.00 0.00 53.44 53.65 3fzb n ALA 37 Cb 0.74 -1.15 -0.01 0.00 0.00 0.00 0.00 19.45 19.02 3fzb n ALA 37 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3fzb h ASP 38 N 0.00 0.00 -3.52 0.00 3.32 0.17 -3.46 116.42 112.93 3fzb h ASP 38 Ca 0.00 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.52 3fzb h ASP 38 Cb 0.07 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.59 3fzb h ASP 38 CO 0.00 0.42 0.26 -0.36 -1.72 0.00 0.00 179.24 177.84 3fzb s PHE 39 N -3.02 3.81 0.43 4.55 0.40 -1.17 -2.84 117.98 120.14 3fzb s PHE 39 Ca 0.01 1.66 -0.24 0.00 -0.60 0.00 0.00 56.93 57.76 3fzb s PHE 39 Cb 0.08 -2.92 -0.08 0.00 0.51 0.00 0.00 43.02 40.62 3fzb s PHE 39 CO 0.77 0.30 1.20 -2.14 0.70 0.00 0.00 175.22 176.05 3fzb s PRO 40 N -0.29 3.89 0.02 0.24 0.02 -1.26 -4.93 135.00 132.68 3fzb s PRO 40 Ca 0.42 1.90 0.08 0.00 0.02 0.00 0.00 61.00 63.42 3fzb s PRO 40 Cb -0.22 -2.58 -0.02 0.00 0.02 0.00 0.00 34.50 31.69 3fzb s PRO 40 CO 0.27 -0.47 -0.24 0.00 -0.33 0.00 0.00 177.00 176.23 3fzb s ALA 41 N -1.42 2.01 -0.17 -1.55 0.00 -0.50 -1.62 121.76 118.52 3fzb s ALA 41 Ca 0.60 -1.11 -0.02 0.00 0.00 0.00 0.00 51.96 51.42 3fzb s ALA 41 Cb -0.32 -0.45 0.05 0.00 0.00 0.00 0.00 23.12 22.40 3fzb s ALA 41 CO 0.40 0.48 0.02 0.08 0.00 0.00 0.00 175.76 176.74 3fzb s VAL 42 N -0.70 0.54 -0.17 0.00 1.01 -0.52 0.16 120.40 120.72 3fzb s VAL 42 Ca 0.10 -0.42 -0.08 0.00 0.00 0.00 0.00 61.98 61.58 3fzb s VAL 42 Cb -0.09 -0.95 -0.04 0.00 0.00 0.00 0.00 36.38 35.30 3fzb s VAL 42 CO 0.01 -0.08 0.10 0.00 0.00 0.00 0.00 175.10 175.12 3fzb s ALA 43 N 1.86 3.60 -0.19 5.51 0.00 0.86 -2.42 121.76 130.99 3fzb s ALA 43 Ca 0.00 -0.71 -0.02 0.00 0.00 0.00 0.00 51.96 51.24 3fzb s ALA 43 Cb -0.16 -2.00 -0.01 0.00 0.00 0.00 0.00 23.12 20.96 3fzb s ALA 43 CO -0.07 0.28 -0.08 0.14 0.00 0.00 0.00 175.76 176.02 3fzb s VAL 44 N 0.02 3.17 0.33 0.00 -7.23 -1.10 -1.05 120.40 114.53 3fzb s VAL 44 Ca 0.08 -0.58 -0.15 0.00 -1.81 0.00 0.00 61.98 59.51 3fzb s VAL 44 Cb -0.12 -2.40 0.03 0.00 0.56 0.00 0.00 36.38 34.46 3fzb s VAL 44 CO 0.00 0.47 0.70 -0.72 -0.31 0.00 0.00 175.10 175.24 3fzb s TYR 45 N 1.07 0.16 0.13 2.82 -0.85 -0.55 -1.60 117.35 118.53 3fzb s TYR 45 Ca 0.00 -0.69 0.10 0.00 -0.52 0.00 0.00 57.07 55.97 3fzb s TYR 45 Cb -0.15 0.62 -0.04 0.00 0.38 0.00 0.00 41.96 42.77 3fzb s TYR 45 CO -0.01 -1.35 -0.25 -0.51 -1.52 0.00 0.00 175.55 171.91 3fzb s LEU 46 N -3.04 2.32 -0.00 -3.49 1.43 -1.26 0.34 118.68 114.98 3fzb s LEU 46 Ca 0.17 -0.74 -0.05 0.00 -1.03 0.00 0.00 54.13 52.47 3fzb s LEU 46 Cb -0.04 -1.09 -0.00 0.00 0.03 0.00 0.00 46.19 45.08 3fzb s LEU 46 CO 0.11 0.13 0.10 0.42 0.23 0.00 0.00 176.35 177.34 3fzb s THR 47 N -1.16 0.08 -1.56 5.49 -4.23 -0.66 -4.90 115.64 108.69 3fzb s THR 47 Ca 0.12 -0.63 -0.01 0.00 -1.18 0.00 0.00 61.69 59.99 3fzb s THR 47 Cb -0.10 -0.36 0.00 0.00 1.34 0.00 0.00 72.50 73.38 3fzb s THR 47 CO 0.06 -0.35 0.08 0.61 -0.54 0.00 0.00 174.62 174.48 3fzb n GLY 48 N 1.71 -0.39 3.74 3.99 0.00 -1.26 -1.35 105.19 111.62 3fzb n GLY 48 Ca -0.21 -0.09 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 3fzb n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fzb s ALA 49 N -2.95 3.78 -0.02 4.61 0.00 -1.26 -4.51 121.76 121.41 3fzb s ALA 49 Ca 0.04 1.50 -0.16 0.00 0.00 0.00 0.00 51.96 53.33 3fzb s ALA 49 Cb -0.02 -3.64 0.03 0.00 0.00 0.00 0.00 23.12 19.49 3fzb s ALA 49 CO 0.05 -0.89 0.34 -2.00 0.00 0.00 0.00 175.76 173.26 3fzb s GLU 50 N 0.23 0.69 -0.31 0.00 2.12 -0.50 -4.99 118.70 115.94 3fzb s GLU 50 Ca 0.67 -0.13 -0.26 0.00 0.36 0.00 0.00 54.97 55.61 3fzb s GLU 50 Cb -0.46 0.31 0.01 0.00 0.26 0.00 0.00 34.13 34.24 3fzb s GLU 50 CO 0.40 -0.19 0.90 -0.47 -0.54 0.00 0.00 175.26 175.36 3fzb s TYR 51 N -1.26 3.19 -0.13 5.30 5.04 -1.26 -1.81 117.35 126.41 3fzb s TYR 51 Ca -0.13 0.97 0.21 0.00 -2.44 0.00 0.00 57.07 55.68 3fzb s TYR 51 Cb -0.05 -3.39 -0.18 0.00 0.35 0.00 0.00 41.96 38.69 3fzb s TYR 51 CO 0.05 -0.64 0.70 2.41 -1.34 0.00 0.00 175.55 176.73 3fzb n THR 52 N 5.65 0.54 -1.90 4.34 -1.04 -0.18 -4.88 114.28 116.82 3fzb n THR 52 Ca 0.07 -0.58 -0.30 0.00 -2.04 0.00 0.00 64.05 61.20 3fzb n THR 52 Cb 0.48 -0.29 -0.06 0.00 -1.82 0.00 0.00 70.33 68.64 3fzb n THR 52 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3fzb n GLY 53 N 1.30 1.13 2.55 3.41 0.00 -0.99 -4.68 105.19 107.91 3fzb n GLY 53 Ca -0.06 -0.72 -0.19 0.00 0.00 0.00 0.00 46.02 45.05 3fzb n GLY 53 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3fzb n GLU 54 N 8.09 2.06 -0.28 1.61 1.02 -1.26 -3.88 120.64 128.00 3fzb n GLU 54 Ca 0.45 -3.90 0.00 0.00 -0.02 0.00 0.00 57.16 53.69 3fzb n GLU 54 Cb 0.46 -1.80 0.00 0.00 -0.02 0.00 0.00 31.44 30.08 3fzb n GLU 54 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3fzb n GLU 55 N -0.11 0.00 -3.41 3.49 -0.58 -1.26 -4.99 120.64 113.78 3fzb n GLU 55 Ca 0.25 -0.37 -0.20 0.00 -0.42 0.00 0.00 57.16 56.42 3fzb n GLU 55 Cb 0.66 -0.24 0.05 0.00 -0.57 0.00 0.00 31.44 31.34 3fzb n GLU 55 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 3fzb n LEU 56 N 0.00 -4.61 -4.31 -4.62 7.94 -1.26 -5.19 117.00 104.95 3fzb n LEU 56 Ca 0.00 -0.78 -0.32 0.00 -1.11 0.00 0.00 56.01 53.80 3fzb n LEU 56 Cb 0.55 -2.88 -0.16 0.00 0.53 0.00 0.00 43.42 41.46 3fzb n LEU 56 CO 0.00 0.15 -0.52 -1.81 -1.11 0.00 0.00 177.39 174.10 3fzb s ASP 57 N -3.38 3.43 -0.54 1.96 1.11 -1.25 -5.06 116.67 112.94 3fzb s ASP 57 Ca 0.42 -0.44 -0.22 0.00 0.18 0.00 0.00 52.55 52.49 3fzb s ASP 57 Cb -0.10 -1.20 0.05 0.00 1.07 0.00 0.00 42.92 42.74 3fzb s ASP 57 CO 0.79 0.21 0.84 -1.81 1.18 0.00 0.00 175.17 176.39 3fzb s ASP 59 N 0.04 6.29 -0.14 0.27 -0.00 -1.26 -4.42 116.67 117.45 3fzb s ASP 59 Ca -0.08 -0.58 -0.03 0.00 -0.00 0.00 0.00 52.55 51.87 3fzb s ASP 59 Cb -0.15 -2.39 -0.03 0.00 -0.00 0.00 0.00 42.92 40.35 3fzb s ASP 59 CO 0.05 -1.14 -0.05 0.28 -0.00 0.00 0.00 175.17 174.31 3fzb s THR 60 N 3.54 3.77 0.40 -1.27 -1.32 -1.26 -4.12 115.64 115.38 3fzb s THR 60 Ca 0.25 -0.41 0.06 0.00 -1.21 0.00 0.00 61.69 60.39 3fzb s THR 60 Cb -0.15 -2.63 -0.07 0.00 -1.51 0.00 0.00 72.50 68.13 3fzb s THR 60 CO 0.16 0.51 0.02 0.26 -2.21 0.00 0.00 174.62 173.36 3fzb s TRP 61 N 0.23 2.41 -0.01 9.09 0.52 0.17 -1.01 118.94 130.34 3fzb s TRP 61 Ca -0.03 -0.73 -0.11 0.00 0.02 0.00 0.00 56.10 55.25 3fzb s TRP 61 Cb -0.14 -1.69 0.01 0.00 -1.15 0.00 0.00 33.47 30.50 3fzb s TRP 61 CO 0.03 0.37 0.23 -1.14 0.02 0.00 0.00 176.95 176.46 3fzb s GLN 62 N -3.74 0.58 0.23 4.98 0.74 -0.75 -1.52 119.66 120.18 3fzb s GLN 62 Ca 0.34 -0.29 -0.22 0.00 0.05 0.00 0.00 55.36 55.23 3fzb s GLN 62 Cb 0.09 0.25 0.04 0.00 1.10 0.00 0.00 33.01 34.49 3fzb s GLN 62 CO 0.17 -0.15 0.77 0.00 -0.55 0.00 0.00 175.29 175.53 3fzb s ALA 63 N -1.36 -1.37 -0.36 1.58 0.00 -0.43 -1.41 121.76 118.41 3fzb s ALA 63 Ca -0.14 -0.11 -0.13 0.00 0.00 0.00 0.00 51.96 51.58 3fzb s ALA 63 Cb -0.06 0.79 -0.00 0.00 0.00 0.00 0.00 23.12 23.85 3fzb s ALA 63 CO 0.03 -1.01 0.25 -1.21 0.00 0.00 0.00 175.76 173.82 3fzb s GLU 64 N -3.74 3.31 -0.16 0.00 0.41 -0.46 -0.50 118.70 117.57 3fzb s GLU 64 Ca 0.10 -0.77 -0.22 0.00 -0.41 0.00 0.00 54.97 53.67 3fzb s GLU 64 Cb -0.04 -3.84 -0.03 0.00 -1.78 0.00 0.00 34.13 28.44 3fzb s GLU 64 CO 0.04 -0.54 0.68 -1.17 -0.49 0.00 0.00 175.26 173.78 3fzb s LEU 65 N 1.70 4.20 -0.11 1.80 2.96 0.74 -1.66 118.68 128.31 3fzb s LEU 65 Ca 0.06 0.99 -0.02 0.00 -0.22 0.00 0.00 54.13 54.94 3fzb s LEU 65 Cb -0.18 -3.00 -0.03 0.00 0.50 0.00 0.00 46.19 43.49 3fzb s LEU 65 CO 0.10 -0.25 -0.05 -1.00 -1.32 0.00 0.00 176.35 173.83 3fzb s HIS 66 N 1.64 2.99 -0.41 5.38 3.76 0.15 -1.22 115.29 127.58 3fzb s HIS 66 Ca 0.33 -0.15 0.02 0.00 -0.15 0.00 0.00 55.06 55.10 3fzb s HIS 66 Cb -0.16 -1.84 0.14 0.00 1.11 0.00 0.00 32.58 31.82 3fzb s HIS 66 CO 0.12 0.14 0.23 0.42 -0.85 0.00 0.00 174.74 174.81 3fzb s ILE 67 N -0.21 1.09 -0.20 0.60 1.09 -0.43 -1.48 121.20 121.67 3fzb s ILE 67 Ca 0.03 -2.31 -0.07 0.00 -1.10 0.00 0.00 60.65 57.20 3fzb s ILE 67 Cb -0.13 -1.77 -0.04 0.00 -1.06 0.00 0.00 42.46 39.46 3fzb s ILE 67 CO 0.02 -0.91 0.06 -0.70 -0.10 0.00 0.00 174.94 173.31 3fzb s GLU 68 N 0.57 3.87 -0.20 2.79 2.12 -0.22 -1.99 118.70 125.64 3fzb s GLU 68 Ca 0.17 -0.40 -0.08 0.00 0.36 0.00 0.00 54.97 55.03 3fzb s GLU 68 Cb -0.24 -3.22 -0.04 0.00 0.26 0.00 0.00 34.13 30.89 3fzb s GLU 68 CO -0.00 0.15 0.07 0.54 -0.54 0.00 0.00 175.26 175.48 3fzb s VAL 69 N 0.69 4.79 -0.09 3.70 0.11 -0.64 -0.10 120.40 128.86 3fzb s VAL 69 Ca 0.03 -0.03 -0.02 0.00 -2.93 0.00 0.00 61.98 59.03 3fzb s VAL 69 Cb -0.13 -3.17 -0.03 0.00 -1.53 0.00 0.00 36.38 31.51 3fzb s VAL 69 CO 0.02 0.43 -0.00 -0.36 -3.33 0.00 0.00 175.10 171.86 3fzb s PHE 70 N 0.61 3.15 0.11 1.54 0.40 0.41 -2.55 117.98 121.65 3fzb s PHE 70 Ca 0.04 0.16 0.10 0.00 -0.60 0.00 0.00 56.93 56.63 3fzb s PHE 70 Cb -0.13 -1.80 -0.04 0.00 0.51 0.00 0.00 43.02 41.57 3fzb s PHE 70 CO 0.01 0.44 -0.25 -0.51 0.70 0.00 0.00 175.22 175.61 3fzb s LEU 71 N -0.80 2.28 -0.03 -0.37 1.43 -0.57 -1.40 118.68 119.22 3fzb s LEU 71 Ca 0.12 -0.70 -0.30 0.00 -1.03 0.00 0.00 54.13 52.23 3fzb s LEU 71 Cb -0.11 -1.15 -0.07 0.00 0.03 0.00 0.00 46.19 44.89 3fzb s LEU 71 CO 0.02 0.17 1.89 -2.16 0.23 0.00 0.00 176.35 176.50 3fzb s PRO 72 N -1.85 4.02 5.93 1.29 0.04 -1.26 -2.19 135.00 140.97 3fzb s PRO 72 Ca 0.12 2.38 0.00 0.00 0.04 0.00 0.00 61.00 63.54 3fzb s PRO 72 Cb -0.10 -4.13 0.00 0.00 0.04 0.00 0.00 34.50 30.31 3fzb s PRO 72 CO 0.05 -1.07 0.00 0.00 0.04 0.00 0.00 177.00 176.02 3fzb n ALA 73 N 7.94 0.00 -2.84 8.56 0.00 0.13 -4.59 120.51 129.70 3fzb n ALA 73 Ca 0.20 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.21 3fzb n ALA 73 Cb 0.42 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.82 3fzb n ALA 73 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 3fzb s GLN 74 N 0.00 3.14 0.25 0.00 0.00 -1.26 -2.14 119.66 119.65 3fzb s GLN 74 Ca 0.00 -0.86 0.11 0.00 -0.00 0.00 0.00 55.36 54.61 3fzb s GLN 74 Cb 0.00 -4.16 -0.05 0.00 0.00 0.00 0.00 33.01 28.80 3fzb s GLN 74 CO 0.00 -1.48 -0.20 0.14 0.00 0.00 0.00 175.29 173.75 3fzb s VAL 75 N 3.22 2.32 0.76 3.63 -7.23 -1.26 -5.08 120.40 116.76 3fzb s VAL 75 Ca 0.19 -2.30 -0.13 0.00 -1.81 0.00 0.00 61.98 57.93 3fzb s VAL 75 Cb -0.19 -2.21 0.06 0.00 0.56 0.00 0.00 36.38 34.60 3fzb s VAL 75 CO 0.12 -0.38 1.13 -2.84 -0.31 0.00 0.00 175.10 172.81 3fzb s PRO 76 N -3.37 2.14 0.53 4.82 0.02 -1.26 -4.88 135.00 133.00 3fzb s PRO 76 Ca 0.27 1.42 0.31 0.00 0.02 0.00 0.00 61.00 63.02 3fzb s PRO 76 Cb -0.05 -1.87 1.41 0.00 0.02 0.00 0.00 34.50 34.02 3fzb s PRO 76 CO 0.13 -1.77 2.02 -0.44 -0.33 0.00 0.00 177.00 176.61 3fzb h ASP 77 N -0.79 0.00 1.56 2.53 5.19 -2.00 -2.55 116.42 120.36 3fzb h ASP 77 Ca -0.45 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.96 3fzb h ASP 77 Cb 1.25 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.76 3fzb h ASP 77 CO 0.50 0.08 0.00 0.28 -3.12 0.00 0.00 179.24 176.98 3fzb h SER 78 N 0.00 0.00 0.74 6.45 0.02 -1.99 -2.21 113.55 116.55 3fzb h SER 78 Ca -0.00 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 60.75 3fzb h SER 78 Cb 0.46 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.98 3fzb h SER 78 CO 0.01 0.00 -0.91 -0.08 -1.14 0.00 0.00 176.83 174.72 3fzb h GLU 79 N 0.00 0.10 -0.29 3.45 4.81 -1.82 -2.37 114.58 118.47 3fzb h GLU 79 Ca 0.00 -0.13 -0.17 0.00 -0.13 0.00 0.00 59.36 58.94 3fzb h GLU 79 Cb 0.78 0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.20 3fzb h GLU 79 CO 0.00 0.93 -0.47 -0.07 -0.73 0.00 0.00 179.01 178.67 3fzb h LEU 80 N 0.05 0.92 -0.70 1.64 3.38 -1.55 -2.20 115.31 116.86 3fzb h LEU 80 Ca -0.03 -0.52 -0.05 0.00 0.09 0.00 0.00 57.88 57.37 3fzb h LEU 80 Cb 1.57 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 42.02 3fzb h LEU 80 CO 0.13 1.26 0.24 0.44 0.09 0.00 0.00 178.44 180.60 3fzb h ASP 81 N 0.60 1.00 0.09 -0.43 5.19 -1.36 0.10 116.42 121.61 3fzb h ASP 81 Ca 0.02 -0.20 -0.00 0.00 -0.62 0.00 0.00 57.03 56.23 3fzb h ASP 81 Cb 1.08 -0.26 -0.00 0.00 0.18 0.00 0.00 39.33 40.33 3fzb h ASP 81 CO 0.11 0.93 -0.05 0.00 -3.12 0.00 0.00 179.24 177.11 3fzb h ALA 82 N 1.11 -0.12 -0.75 3.45 0.00 -1.38 0.92 119.26 122.49 3fzb h ALA 82 Ca 0.23 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.15 3fzb h ALA 82 Cb 0.27 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 3fzb h ALA 82 CO -0.01 -0.57 0.47 2.35 0.00 0.00 0.00 179.25 181.48 3fzb h TRP 83 N -0.13 0.87 -0.17 0.00 7.01 -1.13 0.20 115.95 122.60 3fzb h TRP 83 Ca -0.01 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.00 3fzb h TRP 83 Cb 0.10 -0.28 -0.01 0.00 -2.10 0.00 0.00 29.16 26.87 3fzb h TRP 83 CO -0.08 0.49 0.05 1.98 -2.79 0.00 0.00 178.44 178.08 3fzb h MET 84 N 0.90 0.27 0.00 2.65 4.05 -0.09 -0.56 114.93 122.16 3fzb h MET 84 Ca 0.31 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 59.66 3fzb h MET 84 Cb 0.05 -0.04 0.00 0.00 -0.80 0.00 0.00 31.60 30.81 3fzb h MET 84 CO -0.12 0.40 0.00 0.39 0.23 0.00 0.00 176.91 177.81 3fzb n GLU 85 N -4.81 0.27 -0.00 0.39 4.71 0.31 -1.42 120.64 120.09 3fzb n GLU 85 Ca -0.05 0.03 0.03 0.00 -0.01 0.00 0.00 57.16 57.17 3fzb n GLU 85 Cb 0.16 -1.50 -0.05 0.00 -1.01 0.00 0.00 31.44 29.04 3fzb n GLU 85 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 3fzb n SER 86 N -1.35 2.25 0.00 1.62 3.41 0.66 -4.70 113.62 115.51 3fzb n SER 86 Ca 0.11 -0.25 0.00 0.00 -0.26 0.00 0.00 58.87 58.47 3fzb n SER 86 Cb 0.25 1.19 0.00 0.00 -0.26 0.00 0.00 64.21 65.38 3fzb n SER 86 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3fzb n ARG 87 N -1.51 2.19 0.03 4.33 1.74 -0.23 -4.93 116.66 118.27 3fzb n ARG 87 Ca -0.00 -0.05 -0.00 0.00 -0.77 0.00 0.00 57.85 57.03 3fzb n ARG 87 Cb 0.15 -0.33 -0.00 0.00 -1.02 0.00 0.00 32.46 31.26 3fzb n ARG 87 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 3fzb n ILE 88 N -0.33 0.73 -0.25 0.55 2.08 -1.02 -4.70 119.36 116.42 3fzb n ILE 88 Ca 0.00 0.24 0.04 0.00 0.56 0.00 0.00 62.75 63.59 3fzb n ILE 88 Cb 0.03 -1.36 0.10 0.00 -0.75 0.00 0.00 39.64 37.66 3fzb n ILE 88 CO 0.00 0.00 0.00 -1.22 0.56 0.00 0.00 176.55 175.89 3fzb n TYR 89 N -3.10 0.24 0.03 1.39 4.01 -0.51 -0.40 117.16 118.83 3fzb n TYR 89 Ca -0.00 0.84 -0.11 0.00 -0.16 0.00 0.00 57.90 58.47 3fzb n TYR 89 Cb 0.00 -0.90 -0.05 0.00 -0.31 0.00 0.00 39.34 38.09 3fzb n TYR 89 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 3fzb h PRO 90 N 0.00 -0.13 -0.04 -0.72 0.11 -1.84 -2.71 132.00 126.67 3fzb h PRO 90 Ca 0.33 0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.46 3fzb h PRO 90 Cb 0.50 0.03 -0.00 0.00 0.11 0.00 0.00 31.00 31.64 3fzb h PRO 90 CO -0.71 -0.09 0.07 0.28 -0.21 0.00 0.00 178.00 177.35 3fzb h VAL 91 N -0.13 0.28 -0.15 3.15 2.07 -1.01 -2.24 116.25 118.21 3fzb h VAL 91 Ca 0.05 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.57 3fzb h VAL 91 Cb 0.20 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 30.90 3fzb h VAL 91 CO -0.12 0.00 0.00 0.23 0.02 0.00 0.00 177.57 177.70 3fzb n MET 92 N -3.48 1.86 -0.01 1.57 2.81 -1.02 -3.64 117.12 115.21 3fzb n MET 92 Ca -0.02 -0.75 0.02 0.00 -1.81 0.00 0.00 57.70 55.14 3fzb n MET 92 Cb 0.16 -1.59 -0.07 0.00 -0.71 0.00 0.00 33.22 31.00 3fzb n MET 92 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 3fzb n SER 93 N 0.13 2.78 -3.55 7.83 7.64 -0.84 -4.88 113.62 122.73 3fzb n SER 93 Ca 0.07 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.66 3fzb n SER 93 Cb 0.42 1.26 -0.15 0.00 -1.01 0.00 0.00 64.21 64.73 3fzb n SER 93 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 3fzb s ASP 94 N -3.37 3.55 -0.44 6.43 1.11 -1.24 -5.01 116.67 117.71 3fzb s ASP 94 Ca -0.04 -1.36 0.07 0.00 0.18 0.00 0.00 52.55 51.40 3fzb s ASP 94 Cb 0.05 -0.39 0.23 0.00 1.07 0.00 0.00 42.92 43.88 3fzb s ASP 94 CO 0.39 -0.43 0.65 -0.38 1.18 0.00 0.00 175.17 176.58 3fzb n ILE 95 N 5.16 -0.45 -0.30 0.77 5.41 -1.26 -4.96 119.36 123.73 3fzb n ILE 95 Ca -0.05 -2.75 0.11 0.00 1.00 0.00 0.00 62.75 61.06 3fzb n ILE 95 Cb 0.42 -0.42 0.27 0.00 -0.71 0.00 0.00 39.64 39.21 3fzb n ILE 95 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 3fzb h PRO 96 N 4.32 0.41 -0.28 0.38 0.11 -1.95 -1.56 132.00 133.43 3fzb h PRO 96 Ca 0.02 -0.02 0.06 0.00 0.11 0.00 0.00 66.00 66.17 3fzb h PRO 96 Cb 0.96 -0.09 -0.08 0.00 0.11 0.00 0.00 31.00 31.90 3fzb h PRO 96 CO 0.36 0.27 -0.35 0.00 -0.21 0.00 0.00 178.00 178.07 3fzb h ALA 97 N 1.67 -0.32 -0.42 -0.75 0.00 -1.95 -1.50 119.26 115.99 3fzb h ALA 97 Ca 0.52 0.06 0.08 0.00 0.00 0.00 0.00 54.91 55.57 3fzb h ALA 97 Cb 0.94 0.70 -0.08 0.00 0.00 0.00 0.00 17.79 19.35 3fzb h ALA 97 CO -0.49 -0.79 -0.10 1.25 0.00 0.00 0.00 179.25 179.12 3fzb h LEU 98 N -0.34 -0.37 -0.44 0.00 5.85 -1.57 -2.44 115.31 116.01 3fzb h LEU 98 Ca 0.13 0.12 0.08 0.00 0.84 0.00 0.00 57.88 59.05 3fzb h LEU 98 Cb 0.56 0.25 -0.09 0.00 0.37 0.00 0.00 40.66 41.74 3fzb h LEU 98 CO -0.46 -0.13 -0.37 0.28 -0.34 0.00 0.00 178.44 177.42 3fzb h SER 99 N 0.01 -1.23 -0.12 1.25 0.02 -1.10 -1.12 113.55 111.26 3fzb h SER 99 Ca 0.20 0.21 0.04 0.00 -0.84 0.00 0.00 61.79 61.40 3fzb h SER 99 Cb 0.31 0.56 -0.00 0.00 0.14 0.00 0.00 62.40 63.41 3fzb h SER 99 CO -0.43 -0.34 0.21 0.44 -1.14 0.00 0.00 176.83 175.58 3fzb h ASP 100 N -0.27 0.00 0.80 3.07 3.32 -0.93 -2.35 116.42 120.06 3fzb h ASP 100 Ca 0.17 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.12 3fzb h ASP 100 Cb 0.56 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.09 3fzb h ASP 100 CO -0.58 0.00 -1.27 0.18 -1.72 0.00 0.00 179.24 175.85 3fzb n LEU 101 N -3.45 0.83 -4.69 1.55 4.77 -0.45 -4.97 117.00 110.59 3fzb n LEU 101 Ca 0.00 0.35 -0.23 0.00 -0.03 0.00 0.00 56.01 56.10 3fzb n LEU 101 Cb 0.31 0.02 -0.07 0.00 -2.33 0.00 0.00 43.42 41.36 3fzb n LEU 101 CO 0.23 0.01 -0.25 0.27 -1.33 0.00 0.00 177.39 176.32 3fzb s ILE 102 N -3.10 3.04 -0.94 -0.08 -5.25 -0.89 -4.62 121.20 109.36 3fzb s ILE 102 Ca -0.02 -1.81 0.18 0.00 -0.99 0.00 0.00 60.65 58.01 3fzb s ILE 102 Cb 0.09 -2.91 -0.18 0.00 2.95 0.00 0.00 42.46 42.42 3fzb s ILE 102 CO 0.81 -0.23 0.78 0.35 -1.79 0.00 0.00 174.94 174.86 3fzb n THR 103 N -1.05 0.00 -3.62 8.37 -2.24 0.23 -4.91 114.28 111.06 3fzb n THR 103 Ca -0.04 -0.10 -0.06 0.00 -2.27 0.00 0.00 64.05 61.58 3fzb n THR 103 Cb 0.61 1.02 -0.06 0.00 -2.10 0.00 0.00 70.33 69.81 3fzb n THR 103 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3fzb s SER 104 N -2.64 -0.22 -0.02 3.42 1.04 -1.20 -4.94 113.70 109.14 3fzb s SER 104 Ca 0.08 0.32 -0.02 0.00 0.48 0.00 0.00 55.95 56.80 3fzb s SER 104 Cb 0.14 0.29 0.01 0.00 0.10 0.00 0.00 66.02 66.55 3fzb s SER 104 CO 0.71 -0.14 0.06 -0.32 0.98 0.00 0.00 173.24 174.54 3fzb s MET 105 N -0.55 0.07 -0.13 4.02 0.00 -1.26 -2.27 119.30 119.18 3fzb s MET 105 Ca 0.04 0.09 -0.21 0.00 0.00 0.00 0.00 55.69 55.62 3fzb s MET 105 Cb -0.03 0.03 0.05 0.00 0.00 0.00 0.00 34.83 34.89 3fzb s MET 105 CO -0.07 -0.01 0.53 0.54 0.00 0.00 0.00 175.02 176.01 3fzb s VAL 106 N 0.04 0.01 0.31 10.11 0.11 -0.97 -4.98 120.40 125.03 3fzb s VAL 106 Ca -0.00 -0.09 -0.29 0.00 -2.93 0.00 0.00 61.98 58.67 3fzb s VAL 106 Cb -0.01 -0.78 -0.13 0.00 -1.53 0.00 0.00 36.38 33.93 3fzb s VAL 106 CO 0.00 -0.05 1.23 0.00 -3.33 0.00 0.00 175.10 172.95 3fzb n ALA 107 N 2.07 0.79 -2.00 1.54 0.00 -1.26 -0.09 120.51 121.56 3fzb n ALA 107 Ca -0.16 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.66 3fzb n ALA 107 Cb 0.56 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 17.83 3fzb n ALA 107 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3fzb n SER 108 N 1.15 0.00 -0.73 0.00 2.88 -0.29 -4.61 113.62 112.02 3fzb n SER 108 Ca 0.07 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.61 3fzb n SER 108 Cb 0.34 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.80 3fzb n SER 108 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3fzb n GLY 109 N 4.41 5.68 3.05 0.46 0.00 -1.09 -5.01 105.19 112.69 3fzb n GLY 109 Ca 0.00 -1.90 -0.01 0.00 0.00 0.00 0.00 46.02 44.10 3fzb n GLY 109 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3fzb s TYR 110 N -0.44 -1.51 0.31 1.61 5.04 -1.25 -3.07 117.35 118.03 3fzb s TYR 110 Ca 0.00 0.76 0.08 0.00 -2.44 0.00 0.00 57.07 55.47 3fzb s TYR 110 Cb 0.00 0.12 -0.04 0.00 0.35 0.00 0.00 41.96 42.39 3fzb s TYR 110 CO 0.00 -1.05 0.18 -0.51 -1.34 0.00 0.00 175.55 172.83 3fzb s ASP 111 N 2.70 5.04 -0.12 4.32 1.01 -0.28 -4.90 116.67 124.42 3fzb s ASP 111 Ca 0.10 -0.55 0.01 0.00 0.71 0.00 0.00 52.55 52.81 3fzb s ASP 111 Cb -0.11 -0.97 0.02 0.00 1.01 0.00 0.00 42.92 42.87 3fzb s ASP 111 CO -0.28 -0.22 -0.14 -0.31 0.21 0.00 0.00 175.17 174.44 3fzb s TYR 112 N -2.31 1.99 0.17 4.23 1.51 -1.26 0.29 117.35 121.96 3fzb s TYR 112 Ca 0.37 -1.02 0.06 0.00 -1.01 0.00 0.00 57.07 55.47 3fzb s TYR 112 Cb -0.05 -1.47 -0.04 0.00 -0.11 0.00 0.00 41.96 40.29 3fzb s TYR 112 CO 0.24 -0.56 -0.13 1.03 -1.11 0.00 0.00 175.55 175.02 3fzb s ARG 113 N 1.27 1.20 0.11 -0.62 0.52 -0.84 -5.01 118.95 115.59 3fzb s ARG 113 Ca -0.01 -1.50 -0.07 0.00 -0.52 0.00 0.00 55.73 53.63 3fzb s ARG 113 Cb -0.14 -0.91 -0.01 0.00 0.52 0.00 0.00 34.95 34.41 3fzb s ARG 113 CO -0.06 0.14 0.17 0.50 0.02 0.00 0.00 175.30 176.08 3fzb s ARG 114 N -3.59 0.92 -1.17 3.54 3.52 -1.26 -0.60 118.95 120.31 3fzb s ARG 114 Ca 0.19 -1.12 -0.21 0.00 -0.13 0.00 0.00 55.73 54.46 3fzb s ARG 114 Cb 0.00 0.32 0.02 0.00 -1.56 0.00 0.00 34.95 33.74 3fzb s ARG 114 CO 0.04 -0.29 1.72 0.34 -0.81 0.00 0.00 175.30 176.30 3fzb s ASP 115 N -2.93 6.25 0.00 -2.12 2.15 -0.59 -4.75 116.67 114.69 3fzb s ASP 115 Ca 0.11 -1.89 0.00 0.00 0.43 0.00 0.00 52.55 51.21 3fzb s ASP 115 Cb 0.05 -2.58 0.00 0.00 -0.30 0.00 0.00 42.92 40.09 3fzb s ASP 115 CO -0.06 -1.76 0.57 0.47 -0.17 0.00 0.00 175.17 174.22 3fzb n ASP 116 N 10.18 0.45 -0.06 -0.34 8.00 -1.26 -0.90 116.55 132.61 3fzb n ASP 116 Ca 0.43 -1.60 -0.12 0.00 0.71 0.00 0.00 54.79 54.22 3fzb n ASP 116 Cb 0.47 -0.22 -0.04 0.00 -0.02 0.00 0.00 41.12 41.31 3fzb n ASP 116 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3fzb n ASP 117 N -0.16 1.23 -0.78 -2.24 8.00 -1.26 -4.86 116.55 116.48 3fzb n ASP 117 Ca 0.00 0.20 0.04 0.00 0.71 0.00 0.00 54.79 55.75 3fzb n ASP 117 Cb 0.11 -0.48 0.07 0.00 -0.02 0.00 0.00 41.12 40.80 3fzb n ASP 117 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3fzb n ALA 118 N -3.79 2.50 -2.72 2.24 0.00 -1.21 -5.01 120.51 112.51 3fzb n ALA 118 Ca -0.22 -2.20 -0.09 0.00 0.00 0.00 0.00 53.44 50.93 3fzb n ALA 118 Cb 0.56 -0.53 -0.02 0.00 0.00 0.00 0.00 19.45 19.46 3fzb n ALA 118 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fzb n GLY 119 N -0.31 -0.42 0.07 0.00 0.00 -0.08 -4.80 105.19 99.65 3fzb n GLY 119 Ca 0.09 0.01 0.13 0.00 0.00 0.00 0.00 46.02 46.25 3fzb n GLY 119 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3fzb n LEU 120 N -2.55 0.65 -3.46 0.99 4.77 -1.26 -4.39 117.00 111.75 3fzb n LEU 120 Ca 0.02 0.41 -0.12 0.00 -0.03 0.00 0.00 56.01 56.30 3fzb n LEU 120 Cb 0.43 -0.29 -0.03 0.00 -2.33 0.00 0.00 43.42 41.20 3fzb n LEU 120 CO 0.20 -0.09 0.48 -1.66 -1.33 0.00 0.00 177.39 174.98 3fzb s TRP 121 N -3.10 -0.52 0.08 -1.77 1.48 -1.25 0.19 118.94 114.04 3fzb s TRP 121 Ca 0.10 0.45 0.08 0.00 -1.06 0.00 0.00 56.10 55.67 3fzb s TRP 121 Cb 0.14 0.53 -0.03 0.00 -1.16 0.00 0.00 33.47 32.95 3fzb s TRP 121 CO 0.63 -0.73 -0.21 -1.12 -4.06 0.00 0.00 176.95 171.46 3fzb s SER 122 N -2.38 2.57 0.06 -2.66 0.01 -0.91 -1.54 113.70 108.86 3fzb s SER 122 Ca -0.00 -0.62 -0.05 0.00 1.31 0.00 0.00 55.95 56.59 3fzb s SER 122 Cb -0.01 -0.18 -0.02 0.00 0.21 0.00 0.00 66.02 66.03 3fzb s SER 122 CO -0.08 0.12 0.10 -0.94 0.41 0.00 0.00 173.24 172.84 3fzb s SER 123 N -1.58 0.25 -0.03 2.44 1.04 0.23 -1.51 113.70 114.54 3fzb s SER 123 Ca 0.07 -0.73 0.05 0.00 0.48 0.00 0.00 55.95 55.83 3fzb s SER 123 Cb -0.09 0.27 -0.01 0.00 0.10 0.00 0.00 66.02 66.28 3fzb s SER 123 CO 0.03 -0.63 -0.20 0.00 0.98 0.00 0.00 173.24 173.43 3fzb s ALA 124 N -3.53 1.68 -0.21 5.32 0.00 -1.06 -1.98 121.76 121.98 3fzb s ALA 124 Ca 0.03 -0.82 0.02 0.00 0.00 0.00 0.00 51.96 51.18 3fzb s ALA 124 Cb 0.04 -0.49 0.04 0.00 0.00 0.00 0.00 23.12 22.71 3fzb s ALA 124 CO -0.09 0.36 -0.13 0.34 0.00 0.00 0.00 175.76 176.23 3fzb s ASP 125 N -0.22 3.65 -0.39 0.00 -1.08 0.14 -1.63 116.67 117.15 3fzb s ASP 125 Ca 0.01 -0.98 -0.15 0.00 -0.52 0.00 0.00 52.55 50.92 3fzb s ASP 125 Cb -0.10 -1.41 0.01 0.00 -1.46 0.00 0.00 42.92 39.96 3fzb s ASP 125 CO 0.01 -0.12 0.30 -0.22 0.52 0.00 0.00 175.17 175.66 3fzb s LEU 126 N 1.27 4.94 0.02 -1.34 2.96 -0.84 -1.13 118.68 124.55 3fzb s LEU 126 Ca -0.02 -0.75 0.09 0.00 -0.22 0.00 0.00 54.13 53.22 3fzb s LEU 126 Cb -0.16 -2.17 -0.03 0.00 0.50 0.00 0.00 46.19 44.33 3fzb s LEU 126 CO -0.09 -0.40 -0.25 0.42 -1.32 0.00 0.00 176.35 174.71 3fzb s THR 127 N 1.73 2.03 0.19 3.68 -4.23 -1.18 -1.31 115.64 116.55 3fzb s THR 127 Ca 0.06 -1.26 0.11 0.00 -1.18 0.00 0.00 61.69 59.42 3fzb s THR 127 Cb -0.18 -1.73 -0.04 0.00 1.34 0.00 0.00 72.50 71.89 3fzb s THR 127 CO 0.10 0.41 -0.24 -0.31 -0.54 0.00 0.00 174.62 174.05 3fzb s TYR 128 N -0.73 2.30 -0.25 3.99 1.51 -0.36 -1.14 117.35 122.67 3fzb s TYR 128 Ca 0.11 -0.36 -0.09 0.00 -1.01 0.00 0.00 57.07 55.71 3fzb s TYR 128 Cb -0.10 -1.15 -0.04 0.00 -0.11 0.00 0.00 41.96 40.56 3fzb s TYR 128 CO 0.01 0.49 0.14 0.08 -1.11 0.00 0.00 175.55 175.15 3fzb s VAL 129 N -1.63 5.01 0.33 0.71 1.01 0.87 -0.18 120.40 126.51 3fzb s VAL 129 Ca 0.20 0.06 0.10 0.00 0.00 0.00 0.00 61.98 62.34 3fzb s VAL 129 Cb -0.08 -3.35 -0.06 0.00 0.00 0.00 0.00 36.38 32.89 3fzb s VAL 129 CO 0.10 0.32 -0.09 0.27 0.00 0.00 0.00 175.10 175.70 3fzb s ILE 130 N 1.37 2.37 -0.01 2.22 -4.36 0.34 -2.28 121.20 120.85 3fzb s ILE 130 Ca 0.06 -2.19 0.01 0.00 -0.26 0.00 0.00 60.65 58.28 3fzb s ILE 130 Cb -0.15 -2.63 0.00 0.00 1.25 0.00 0.00 42.46 40.94 3fzb s ILE 130 CO 0.06 -0.23 -0.03 0.42 0.24 0.00 0.00 174.94 175.40 3fzb s THR 131 N -2.57 0.28 0.06 8.37 -4.23 -0.96 -1.31 115.64 115.27 3fzb s THR 131 Ca 0.32 -0.12 -0.02 0.00 -1.18 0.00 0.00 61.69 60.70 3fzb s THR 131 Cb 0.01 -0.26 0.01 0.00 1.34 0.00 0.00 72.50 73.59 3fzb s THR 131 CO 0.17 0.10 0.11 0.00 -0.54 0.00 0.00 174.62 174.45 3fzb n TYR 132 N 3.20 -1.06 -4.71 3.99 0.18 -0.58 0.76 117.16 118.94 3fzb n TYR 132 Ca -0.15 -0.29 -0.24 0.00 1.88 0.00 0.00 57.90 59.09 3fzb n TYR 132 Cb 0.57 0.13 -0.16 0.00 -0.38 0.00 0.00 39.34 39.50 3fzb n TYR 132 CO 0.00 0.00 0.00 -1.21 -2.08 0.00 0.00 176.86 173.57 3fzb s GLU 133 N -2.04 1.56 0.00 -3.48 2.02 -1.26 0.42 118.70 115.92 3fzb s GLU 133 Ca 0.03 -0.52 0.15 0.00 0.02 0.00 0.00 54.97 54.65 3fzb s GLU 133 Cb -0.01 -1.37 0.92 0.00 0.10 0.00 0.00 34.13 33.77 3fzb s GLU 133 CO 0.02 0.20 1.33 -1.33 0.02 0.00 0.00 175.26 175.50