#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 1.26 0.14 -0.41 0.00 -1.26 -4.80 119.30 114.24 3fzb s MET 4 Ca 0.00 1.61 -0.18 0.00 0.00 0.00 0.00 55.69 57.12 3fzb s MET 4 Cb 0.00 -1.75 0.02 0.00 0.00 0.00 0.00 34.83 33.10 3fzb s MET 4 CO 0.00 -2.46 1.72 -0.22 0.00 0.00 0.00 175.02 174.05 3fzb h LYS 5 N -1.52 0.09 -0.63 4.11 1.63 -1.95 -2.06 116.57 116.25 3fzb h LYS 5 Ca -0.44 -0.01 0.13 0.00 -0.85 0.00 0.00 60.65 59.48 3fzb h LYS 5 Cb 1.28 -0.02 -0.10 0.00 -0.60 0.00 0.00 32.23 32.78 3fzb h LYS 5 CO 0.43 0.06 0.04 0.45 -3.45 0.00 0.00 179.45 176.98 3fzb h HIS 6 N 0.09 0.03 -0.86 1.91 3.86 -1.97 1.05 115.15 119.26 3fzb h HIS 6 Ca 0.13 0.04 0.02 0.00 -1.16 0.00 0.00 60.37 59.41 3fzb h HIS 6 Cb 0.17 0.08 -0.05 0.00 1.06 0.00 0.00 27.41 28.67 3fzb h HIS 6 CO -0.20 -0.14 0.56 1.15 0.86 0.00 0.00 177.93 180.16 3fzb h THR 7 N 0.15 1.17 -0.09 2.45 2.02 -1.74 -1.86 112.91 115.02 3fzb h THR 7 Ca 0.33 -0.38 -0.20 0.00 0.77 0.00 0.00 66.41 66.92 3fzb h THR 7 Cb 0.54 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.91 3fzb h THR 7 CO -0.51 0.20 -0.78 -0.33 0.37 0.00 0.00 175.52 174.47 3fzb h GLU 8 N 1.12 0.54 0.33 6.66 5.08 -0.36 -2.55 114.58 125.39 3fzb h GLU 8 Ca 0.33 -0.46 -0.01 0.00 -1.00 0.00 0.00 59.36 58.22 3fzb h GLU 8 Cb -0.05 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 3fzb h GLU 8 CO -0.10 1.09 -0.24 -0.07 -1.00 0.00 0.00 179.01 178.70 3fzb h LEU 9 N 0.36 -0.62 0.07 1.33 3.38 0.16 -2.01 115.31 117.97 3fzb h LEU 9 Ca -0.05 0.04 0.02 0.00 0.09 0.00 0.00 57.88 57.98 3fzb h LEU 9 Cb 1.39 0.19 -0.05 0.00 0.09 0.00 0.00 40.66 42.28 3fzb h LEU 9 CO 0.14 -0.34 -0.51 0.03 0.09 0.00 0.00 178.44 177.85 3fzb h ARG 10 N -0.54 -0.68 -0.80 1.13 3.08 -1.47 -2.61 114.38 112.49 3fzb h ARG 10 Ca -0.04 0.05 0.11 0.00 0.07 0.00 0.00 59.98 60.16 3fzb h ARG 10 Cb 0.45 0.15 -0.12 0.00 0.08 0.00 0.00 29.97 30.53 3fzb h ARG 10 CO 0.02 -0.45 -0.37 0.00 -1.07 0.00 0.00 179.97 178.10 3fzb n ALA 11 N -2.93 -0.24 -0.21 0.04 0.00 -0.96 0.03 120.51 116.23 3fzb n ALA 11 Ca -0.08 0.75 0.01 0.00 0.00 0.00 0.00 53.44 54.13 3fzb n ALA 11 Cb 0.40 -0.27 0.10 0.00 0.00 0.00 0.00 19.45 19.68 3fzb n ALA 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fzb h ALA 12 N 0.85 0.57 -0.16 0.00 0.00 -0.97 0.86 119.26 120.43 3fzb h ALA 12 Ca 0.22 0.22 -0.13 0.00 0.00 0.00 0.00 54.91 55.22 3fzb h ALA 12 Cb 0.42 0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 3fzb h ALA 12 CO -0.78 -0.41 -0.45 0.28 0.00 0.00 0.00 179.25 177.89 3fzb h VAL 13 N 0.08 1.32 0.44 0.00 2.07 -0.32 -2.88 116.25 116.96 3fzb h VAL 13 Ca 0.33 -1.64 -0.02 0.00 0.82 0.00 0.00 66.70 66.19 3fzb h VAL 13 Cb 0.54 1.69 0.00 0.00 -1.52 0.00 0.00 31.29 32.00 3fzb h VAL 13 CO -0.59 0.50 -0.21 -0.07 0.02 0.00 0.00 177.57 177.22 3fzb h LEU 14 N 0.31 -0.50 0.00 2.57 3.38 0.97 -2.36 115.31 119.69 3fzb h LEU 14 Ca 0.02 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3fzb h LEU 14 Cb 0.92 0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.80 3fzb h LEU 14 CO 0.08 -0.25 0.00 0.47 0.09 0.00 0.00 178.44 178.83 3fzb n ASP 15 N -5.29 0.00 -0.14 -0.43 8.00 -0.13 -2.20 116.55 116.36 3fzb n ASP 15 Ca -0.11 0.87 0.00 0.00 0.71 0.00 0.00 54.79 56.26 3fzb n ASP 15 Cb 0.28 -0.37 0.02 0.00 -0.02 0.00 0.00 41.12 41.04 3fzb n ASP 15 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3fzb n ALA 16 N -2.04 -0.02 0.76 2.24 0.00 -1.09 0.38 120.51 120.75 3fzb n ALA 16 Ca 0.00 0.38 0.01 0.00 0.00 0.00 0.00 53.44 53.83 3fzb n ALA 16 Cb 0.00 -0.18 0.03 0.00 0.00 0.00 0.00 19.45 19.30 3fzb n ALA 16 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3fzb n LEU 17 N -4.56 0.00 -4.03 0.00 4.77 -0.89 -4.49 117.00 107.80 3fzb n LEU 17 Ca 0.04 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.71 3fzb n LEU 17 Cb 0.16 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.10 3fzb n LEU 17 CO -0.05 0.00 -0.40 -1.61 -1.33 0.00 0.00 177.39 174.00 3fzb s GLU 18 N -2.00 1.85 0.00 3.23 2.02 1.22 -5.04 118.70 119.98 3fzb s GLU 18 Ca 0.02 -1.52 0.00 0.00 0.02 0.00 0.00 54.97 53.48 3fzb s GLU 18 Cb 0.01 -2.97 0.00 0.00 0.10 0.00 0.00 34.13 31.27 3fzb s GLU 18 CO 0.01 -0.73 0.00 1.17 0.02 0.00 0.00 175.26 175.73 3fzb n LYS 19 N 4.39 0.00 -3.66 1.61 4.81 -1.26 -4.99 118.16 119.05 3fzb n LYS 19 Ca -0.06 0.00 -0.18 0.00 -0.87 0.00 0.00 58.31 57.19 3fzb n LYS 19 Cb 0.42 0.00 -0.17 0.00 0.02 0.00 0.00 35.03 35.30 3fzb n LYS 19 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 3fzb s GLY 23 N 0.00 0.13 0.00 3.14 0.00 -1.26 -5.20 107.32 104.13 3fzb s GLY 23 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 44.72 45.09 3fzb s GLY 23 CO 0.00 1.56 0.00 0.00 0.00 0.00 0.00 173.10 174.66 3fzb n ALA 24 N 5.31 0.00 -3.57 3.20 0.00 -1.26 -4.85 120.51 119.34 3fzb n ALA 24 Ca -0.04 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.15 3fzb n ALA 24 Cb 0.50 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.78 3fzb n ALA 24 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3fzb s THR 25 N 0.08 1.07 0.05 0.00 2.01 -0.92 -5.00 115.64 112.93 3fzb s THR 25 Ca 0.00 -0.41 0.03 0.00 0.31 0.00 0.00 61.69 61.62 3fzb s THR 25 Cb 0.00 -1.01 -0.04 0.00 0.01 0.00 0.00 72.50 71.47 3fzb s THR 25 CO 0.00 0.35 0.03 -0.36 -0.69 0.00 0.00 174.62 173.95 3fzb s PHE 26 N 0.91 3.09 -0.05 4.92 0.40 -1.26 -0.57 117.98 125.42 3fzb s PHE 26 Ca -0.10 0.05 0.01 0.00 -0.60 0.00 0.00 56.93 56.30 3fzb s PHE 26 Cb -0.15 -1.62 0.02 0.00 0.51 0.00 0.00 43.02 41.78 3fzb s PHE 26 CO 0.01 0.49 -0.07 -0.06 0.70 0.00 0.00 175.22 176.29 3fzb s PHE 27 N -1.25 0.97 -0.87 0.36 0.40 -0.76 -4.96 117.98 111.86 3fzb s PHE 27 Ca 0.24 -0.31 -0.20 0.00 -0.60 0.00 0.00 56.93 56.06 3fzb s PHE 27 Cb -0.12 -0.79 0.10 0.00 0.51 0.00 0.00 43.02 42.73 3fzb s PHE 27 CO 0.16 -0.21 1.13 0.34 0.70 0.00 0.00 175.22 177.34 3fzb s ASP 28 N 0.82 6.49 0.00 1.36 2.15 -1.26 -2.13 116.67 124.09 3fzb s ASP 28 Ca -0.13 -1.67 0.00 0.00 0.43 0.00 0.00 52.55 51.18 3fzb s ASP 28 Cb -0.15 -2.43 0.00 0.00 -0.30 0.00 0.00 42.92 40.04 3fzb s ASP 28 CO 0.01 -1.23 0.00 0.61 -0.17 0.00 0.00 175.17 174.39 3fzb n GLY 29 N 5.65 2.17 3.53 2.66 0.00 0.59 -4.99 105.19 114.80 3fzb n GLY 29 Ca 0.18 -2.09 -0.41 0.00 0.00 0.00 0.00 46.02 43.70 3fzb n GLY 29 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3fzb s ARG 30 N -1.68 3.50 0.94 1.61 3.00 -1.26 -4.21 118.95 120.85 3fzb s ARG 30 Ca 0.00 -0.58 -0.12 0.00 -1.00 0.00 0.00 55.73 54.03 3fzb s ARG 30 Cb 0.00 -3.81 0.16 0.00 0.00 0.00 0.00 34.95 31.29 3fzb s ARG 30 CO 0.00 -0.48 1.09 -2.14 0.00 0.00 0.00 175.30 173.77 3fzb s PRO 31 N 1.82 0.87 -0.08 5.12 0.02 -1.26 -4.99 135.00 136.50 3fzb s PRO 31 Ca 0.08 0.67 -0.05 0.00 0.02 0.00 0.00 61.00 61.72 3fzb s PRO 31 Cb -0.17 -1.78 -0.04 0.00 0.02 0.00 0.00 34.50 32.53 3fzb s PRO 31 CO 0.11 -2.47 -0.12 0.00 -0.33 0.00 0.00 177.00 174.19 3fzb n ALA 32 N -4.02 2.36 -2.59 -1.55 0.00 -1.26 -5.03 120.51 108.42 3fzb n ALA 32 Ca 0.06 -0.37 -0.32 0.00 0.00 0.00 0.00 53.44 52.82 3fzb n ALA 32 Cb 0.56 0.34 -0.10 0.00 0.00 0.00 0.00 19.45 20.25 3fzb n ALA 32 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3fzb s VAL 33 N -2.20 3.61 0.41 0.00 0.11 -1.26 -5.14 120.40 115.93 3fzb s VAL 33 Ca -0.13 -0.88 0.00 0.00 -2.93 0.00 0.00 61.98 58.05 3fzb s VAL 33 Cb 0.05 -2.60 -0.00 0.00 -1.53 0.00 0.00 36.38 32.30 3fzb s VAL 33 CO 0.17 0.33 0.01 0.49 -3.33 0.00 0.00 175.10 172.76 3fzb n PHE 34 N 1.36 0.91 -3.33 1.54 3.01 -1.26 -5.17 117.46 114.52 3fzb n PHE 34 Ca -0.15 -2.05 -0.14 0.00 1.01 0.00 0.00 57.45 56.13 3fzb n PHE 34 Cb 0.52 -0.26 -0.07 0.00 -0.01 0.00 0.00 39.48 39.67 3fzb n PHE 34 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 3fzb s ASP 35 N -3.26 0.70 0.00 4.37 -1.08 -1.26 -4.96 116.67 111.17 3fzb s ASP 35 Ca 0.01 -1.34 0.00 0.00 -0.52 0.00 0.00 52.55 50.70 3fzb s ASP 35 Cb 0.00 0.82 0.00 0.00 -1.46 0.00 0.00 42.92 42.28 3fzb s ASP 35 CO 0.01 -0.26 0.00 0.00 0.52 0.00 0.00 175.17 175.44 3fzb n ALA 37 N 4.39 0.00 0.18 3.66 0.00 -1.26 -4.57 120.51 122.91 3fzb n ALA 37 Ca 0.10 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.58 3fzb n ALA 37 Cb 0.47 0.00 0.33 0.00 0.00 0.00 0.00 19.45 20.25 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 -4.07 0.00 3.32 -2.01 -3.45 116.42 110.21 3fzb h ASP 38 Ca 0.00 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.50 3fzb h ASP 38 Cb 0.00 0.00 0.15 0.00 0.22 0.00 0.00 39.33 39.70 3fzb h ASP 38 CO 0.00 0.42 0.58 -0.36 -1.72 0.00 0.00 179.24 178.16 3fzb s PHE 39 N -3.76 2.19 -0.02 4.55 0.40 -1.26 -3.88 117.98 116.20 3fzb s PHE 39 Ca -0.01 1.41 -0.30 0.00 -0.60 0.00 0.00 56.93 57.43 3fzb s PHE 39 Cb 0.12 -3.77 -0.04 0.00 0.51 0.00 0.00 43.02 39.84 3fzb s PHE 39 CO 0.71 -2.95 1.23 -2.14 0.70 0.00 0.00 175.22 172.77 3fzb s PRO 40 N -3.09 4.36 0.08 0.24 0.02 -1.26 -4.90 135.00 130.44 3fzb s PRO 40 Ca 0.76 1.74 -0.13 0.00 0.02 0.00 0.00 61.00 63.39 3fzb s PRO 40 Cb -0.40 -3.52 -0.06 0.00 0.02 0.00 0.00 34.50 30.54 3fzb s PRO 40 CO 0.45 -0.43 0.47 0.00 -0.33 0.00 0.00 177.00 177.16 3fzb s ALA 41 N 2.02 3.66 -0.08 -1.55 0.00 -0.58 -2.15 121.76 123.06 3fzb s ALA 41 Ca 0.58 -0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.32 3fzb s ALA 41 Cb -0.27 -2.42 0.02 0.00 0.00 0.00 0.00 23.12 20.46 3fzb s ALA 41 CO 0.24 0.49 -0.07 0.08 0.00 0.00 0.00 175.76 176.51 3fzb s VAL 42 N -1.32 0.85 -0.03 0.00 1.01 0.27 0.17 120.40 121.35 3fzb s VAL 42 Ca 0.32 -0.23 0.05 0.00 0.00 0.00 0.00 61.98 62.12 3fzb s VAL 42 Cb -0.15 -0.87 -0.03 0.00 0.00 0.00 0.00 36.38 35.33 3fzb s VAL 42 CO 0.17 0.32 -0.16 0.00 0.00 0.00 0.00 175.10 175.43 3fzb s ALA 43 N 1.40 2.59 -0.10 5.51 0.00 0.74 -1.83 121.76 130.07 3fzb s ALA 43 Ca -0.02 -1.03 0.03 0.00 0.00 0.00 0.00 51.96 50.94 3fzb s ALA 43 Cb -0.13 -0.87 0.01 0.00 0.00 0.00 0.00 23.12 22.12 3fzb s ALA 43 CO -0.04 0.56 -0.19 0.08 0.00 0.00 0.00 175.76 176.17 3fzb s VAL 44 N -0.75 1.74 0.08 0.00 1.01 -0.91 -1.29 120.40 120.28 3fzb s VAL 44 Ca 0.12 -0.81 -0.26 0.00 0.00 0.00 0.00 61.98 61.02 3fzb s VAL 44 Cb -0.10 -1.54 0.09 0.00 0.00 0.00 0.00 36.38 34.82 3fzb s VAL 44 CO 0.01 0.49 1.14 -0.72 0.00 0.00 0.00 175.10 176.02 3fzb s TYR 45 N 0.66 -0.02 0.16 5.22 -0.85 -1.14 -0.30 117.35 121.09 3fzb s TYR 45 Ca -0.13 -0.21 0.09 0.00 -0.52 0.00 0.00 57.07 56.30 3fzb s TYR 45 Cb -0.16 0.61 -0.04 0.00 0.38 0.00 0.00 41.96 42.75 3fzb s TYR 45 CO 0.03 -0.59 -0.20 -0.51 -1.52 0.00 0.00 175.55 172.76 3fzb s LEU 46 N -3.22 2.42 0.05 -3.49 1.43 -1.26 -0.31 118.68 114.29 3fzb s LEU 46 Ca 0.18 -0.84 -0.02 0.00 -1.03 0.00 0.00 54.13 52.43 3fzb s LEU 46 Cb 0.00 -0.94 -0.03 0.00 0.03 0.00 0.00 46.19 45.25 3fzb s LEU 46 CO 0.01 0.03 -0.00 0.42 0.23 0.00 0.00 176.35 177.03 3fzb s THR 47 N -1.80 0.18 -1.41 5.49 -4.23 -0.81 -4.89 115.64 108.17 3fzb s THR 47 Ca 0.16 -1.52 -0.08 0.00 -1.18 0.00 0.00 61.69 59.07 3fzb s THR 47 Cb -0.07 -1.20 0.04 0.00 1.34 0.00 0.00 72.50 72.61 3fzb s THR 47 CO 0.07 -0.84 0.93 0.61 -0.54 0.00 0.00 174.62 174.86 3fzb n GLY 48 N 0.45 -0.43 3.66 3.99 0.00 -1.26 -1.19 105.19 110.41 3fzb n GLY 48 Ca -0.16 0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 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 -3.42 3.67 0.03 4.61 0.00 -1.25 -4.26 121.76 121.13 3fzb s ALA 49 Ca 0.39 0.10 0.02 0.00 0.00 0.00 0.00 51.96 52.47 3fzb s ALA 49 Cb -0.19 -3.48 -0.02 0.00 0.00 0.00 0.00 23.12 19.43 3fzb s ALA 49 CO 0.80 -1.01 -0.07 -1.83 0.00 0.00 0.00 175.76 173.65 3fzb s GLU 50 N 3.08 0.52 0.28 0.00 -1.05 0.57 -4.96 118.70 117.13 3fzb s GLU 50 Ca 0.42 -0.62 -0.29 0.00 -0.15 0.00 0.00 54.97 54.33 3fzb s GLU 50 Cb -0.15 -0.35 -0.10 0.00 -0.44 0.00 0.00 34.13 33.09 3fzb s GLU 50 CO 0.07 0.07 1.25 -0.47 0.95 0.00 0.00 175.26 177.13 3fzb s TYR 51 N -1.05 3.26 -0.00 4.83 5.04 -1.26 -1.66 117.35 126.51 3fzb s TYR 51 Ca -0.07 1.44 0.00 0.00 -2.44 0.00 0.00 57.07 56.01 3fzb s TYR 51 Cb -0.08 -3.55 0.01 0.00 0.35 0.00 0.00 41.96 38.69 3fzb s TYR 51 CO 0.00 -1.50 0.95 0.25 -1.34 0.00 0.00 175.55 173.92 3fzb n THR 52 N 1.44 0.92 0.00 4.34 -2.24 -0.25 -4.93 114.28 113.56 3fzb n THR 52 Ca 0.01 -0.92 0.00 0.00 -2.27 0.00 0.00 64.05 60.87 3fzb n THR 52 Cb 0.43 0.53 0.00 0.00 -2.10 0.00 0.00 70.33 69.19 3fzb n THR 52 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fzb n GLY 53 N -0.47 0.72 3.52 3.38 0.00 -1.26 -4.92 105.19 106.16 3fzb n GLY 53 Ca 0.00 -2.26 -0.32 0.00 0.00 0.00 0.00 46.02 43.45 3fzb n GLY 53 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fzb s GLU 54 N -0.78 2.35 0.09 1.61 2.02 -1.26 -2.20 118.70 120.53 3fzb s GLU 54 Ca 0.00 -0.82 0.00 0.00 0.02 0.00 0.00 54.97 54.17 3fzb s GLU 54 Cb 0.00 -2.35 0.00 0.00 0.10 0.00 0.00 34.13 31.88 3fzb s GLU 54 CO 0.00 0.58 0.00 0.39 0.02 0.00 0.00 175.26 176.25 3fzb n GLU 55 N 1.67 0.00 0.00 1.61 1.02 -1.26 -4.95 120.64 118.73 3fzb n GLU 55 Ca -0.16 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.98 3fzb n GLU 55 Cb 0.52 -0.35 0.00 0.00 -0.02 0.00 0.00 31.44 31.59 3fzb n GLU 55 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 3fzb n SER 58 N -3.24 0.48 -3.72 1.62 7.64 -1.26 -5.09 113.62 110.05 3fzb n SER 58 Ca 0.00 -0.78 -0.26 0.00 1.01 0.00 0.00 58.87 58.84 3fzb n SER 58 Cb 0.14 0.25 -0.17 0.00 -1.01 0.00 0.00 64.21 63.43 3fzb n SER 58 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 3fzb s ASP 59 N -0.25 2.34 0.05 6.43 1.11 -1.26 -4.98 116.67 120.11 3fzb s ASP 59 Ca 0.00 -0.53 0.01 0.00 0.18 0.00 0.00 52.55 52.21 3fzb s ASP 59 Cb 0.00 -0.47 -0.04 0.00 1.07 0.00 0.00 42.92 43.48 3fzb s ASP 59 CO 0.00 -0.28 0.12 0.42 1.18 0.00 0.00 175.17 176.61 3fzb s THR 60 N 1.95 4.83 0.14 -1.27 -4.23 -0.93 -3.66 115.64 112.47 3fzb s THR 60 Ca 0.02 -0.55 0.02 0.00 -1.18 0.00 0.00 61.69 60.00 3fzb s THR 60 Cb -0.15 -3.30 -0.04 0.00 1.34 0.00 0.00 72.50 70.34 3fzb s THR 60 CO -0.07 0.20 -0.04 0.26 -0.54 0.00 0.00 174.62 174.42 3fzb s TRP 61 N -1.36 1.13 -0.01 3.99 0.52 0.28 -1.09 118.94 122.39 3fzb s TRP 61 Ca 0.29 -0.92 -0.01 0.00 0.02 0.00 0.00 56.10 55.48 3fzb s TRP 61 Cb -0.12 -0.63 0.00 0.00 -1.15 0.00 0.00 33.47 31.57 3fzb s TRP 61 CO 0.21 -0.12 0.03 -1.14 0.02 0.00 0.00 176.95 175.95 3fzb s GLN 62 N -3.85 0.03 0.07 4.98 0.74 -0.66 -1.75 119.66 119.21 3fzb s GLN 62 Ca 0.18 0.04 -0.26 0.00 0.05 0.00 0.00 55.36 55.37 3fzb s GLN 62 Cb 0.05 0.01 0.07 0.00 1.10 0.00 0.00 33.01 34.24 3fzb s GLN 62 CO 0.00 -0.01 0.62 0.00 -0.55 0.00 0.00 175.29 175.36 3fzb s ALA 63 N 0.03 -1.64 -0.20 1.58 0.00 -0.91 -0.31 121.76 120.32 3fzb s ALA 63 Ca -0.00 0.81 -0.23 0.00 0.00 0.00 0.00 51.96 52.54 3fzb s ALA 63 Cb -0.00 0.51 -0.02 0.00 0.00 0.00 0.00 23.12 23.61 3fzb s ALA 63 CO -0.00 -0.60 0.72 -1.21 0.00 0.00 0.00 175.76 174.68 3fzb s GLU 64 N -2.68 4.22 -0.12 0.00 0.41 -0.33 -1.32 118.70 118.89 3fzb s GLU 64 Ca -0.04 0.78 -0.21 0.00 -0.41 0.00 0.00 54.97 55.09 3fzb s GLU 64 Cb -0.01 -3.59 -0.04 0.00 -1.78 0.00 0.00 34.13 28.71 3fzb s GLU 64 CO -0.03 -0.33 0.60 -1.17 -0.49 0.00 0.00 175.26 173.83 3fzb s LEU 65 N 2.19 4.26 -0.12 1.80 2.96 0.50 -1.92 118.68 128.34 3fzb s LEU 65 Ca 0.32 0.96 -0.03 0.00 -0.22 0.00 0.00 54.13 55.16 3fzb s LEU 65 Cb -0.16 -2.88 -0.03 0.00 0.50 0.00 0.00 46.19 43.61 3fzb s LEU 65 CO 0.10 -0.11 -0.01 -1.00 -1.32 0.00 0.00 176.35 174.01 3fzb s HIS 66 N 1.00 3.11 -0.35 5.38 3.76 0.58 -1.12 115.29 127.64 3fzb s HIS 66 Ca 0.31 -0.02 -0.00 0.00 -0.15 0.00 0.00 55.06 55.19 3fzb s HIS 66 Cb -0.16 -1.89 0.12 0.00 1.11 0.00 0.00 32.58 31.76 3fzb s HIS 66 CO 0.13 0.22 0.18 0.42 -0.85 0.00 0.00 174.74 174.84 3fzb s ILE 67 N -0.23 0.60 -0.28 0.60 1.01 -0.01 -2.88 121.20 120.01 3fzb s ILE 67 Ca 0.05 -1.69 -0.09 0.00 0.00 0.00 0.00 60.65 58.93 3fzb s ILE 67 Cb -0.13 -1.44 -0.02 0.00 0.01 0.00 0.00 42.46 40.89 3fzb s ILE 67 CO 0.02 -0.85 0.12 -0.70 0.00 0.00 0.00 174.94 173.53 3fzb s GLU 68 N 1.20 3.49 -0.24 2.79 2.12 -0.41 -1.73 118.70 125.92 3fzb s GLU 68 Ca 0.14 -0.60 -0.15 0.00 0.36 0.00 0.00 54.97 54.72 3fzb s GLU 68 Cb -0.21 -3.46 -0.04 0.00 0.26 0.00 0.00 34.13 30.68 3fzb s GLU 68 CO -0.12 -0.31 0.37 0.54 -0.54 0.00 0.00 175.26 175.20 3fzb s VAL 69 N 1.62 5.20 -0.18 3.70 0.11 -0.36 -0.18 120.40 130.30 3fzb s VAL 69 Ca 0.05 0.61 -0.06 0.00 -2.93 0.00 0.00 61.98 59.66 3fzb s VAL 69 Cb -0.16 -3.70 -0.03 0.00 -1.53 0.00 0.00 36.38 30.95 3fzb s VAL 69 CO 0.05 0.21 0.02 -0.36 -3.33 0.00 0.00 175.10 171.70 3fzb s PHE 70 N 1.64 3.12 -0.01 1.54 0.40 0.44 -1.82 117.98 123.29 3fzb s PHE 70 Ca 0.16 -0.20 0.06 0.00 -0.60 0.00 0.00 56.93 56.36 3fzb s PHE 70 Cb -0.15 -2.06 -0.03 0.00 0.51 0.00 0.00 43.02 41.30 3fzb s PHE 70 CO 0.08 -0.03 -0.20 -0.51 0.70 0.00 0.00 175.22 175.27 3fzb s LEU 71 N 0.61 2.46 -0.35 -0.37 1.43 -1.00 -1.53 118.68 119.91 3fzb s LEU 71 Ca 0.01 -0.36 -0.42 0.00 -1.03 0.00 0.00 54.13 52.33 3fzb s LEU 71 Cb -0.14 -1.46 -0.17 0.00 0.03 0.00 0.00 46.19 44.45 3fzb s LEU 71 CO 0.02 0.31 1.75 -2.65 0.23 0.00 0.00 176.35 176.01 3fzb n PRO 72 N 2.15 0.80 -0.26 1.29 -0.02 -1.26 -1.84 135.00 135.86 3fzb n PRO 72 Ca -0.17 0.29 0.04 0.00 -2.02 0.00 0.00 63.50 61.64 3fzb n PRO 72 Cb 0.52 -1.94 -0.01 0.00 -0.02 0.00 0.00 33.50 32.05 3fzb n PRO 72 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3fzb n ALA 73 N 5.34 -1.34 -1.70 3.55 0.00 0.20 -4.53 120.51 122.04 3fzb n ALA 73 Ca 0.30 0.08 -0.43 0.00 0.00 0.00 0.00 53.44 53.39 3fzb n ALA 73 Cb 0.08 -0.40 -0.03 0.00 0.00 0.00 0.00 19.45 19.09 3fzb n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fzb n GLN 74 N -1.29 2.66 -3.87 0.00 -0.00 -1.26 -3.32 117.38 110.31 3fzb n GLN 74 Ca 0.00 0.96 -0.11 0.00 -0.00 0.00 0.00 57.00 57.86 3fzb n GLN 74 Cb 0.12 -2.81 -0.09 0.00 -0.00 0.00 0.00 30.24 27.46 3fzb n GLN 74 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 3fzb s VAL 75 N 1.68 0.10 0.15 -0.39 1.01 -1.26 -5.01 120.40 116.68 3fzb s VAL 75 Ca 0.78 -0.86 -0.31 0.00 0.00 0.00 0.00 61.98 61.59 3fzb s VAL 75 Cb -0.53 -0.75 -0.10 0.00 0.00 0.00 0.00 36.38 35.00 3fzb s VAL 75 CO 0.35 -0.48 1.59 -2.16 0.00 0.00 0.00 175.10 174.41 3fzb s PRO 76 N -2.16 4.21 0.39 2.72 0.04 -1.26 -4.88 135.00 134.07 3fzb s PRO 76 Ca -0.08 2.36 0.24 0.00 0.04 0.00 0.00 61.00 63.56 3fzb s PRO 76 Cb -0.03 -3.24 1.37 0.00 0.04 0.00 0.00 34.50 32.64 3fzb s PRO 76 CO -0.02 -0.64 1.59 -0.44 0.04 0.00 0.00 177.00 177.54 3fzb h ASP 77 N 7.10 0.30 -0.93 6.66 5.19 -2.00 0.61 116.42 133.35 3fzb h ASP 77 Ca -0.43 0.21 0.05 0.00 -0.62 0.00 0.00 57.03 56.24 3fzb h ASP 77 Cb 1.20 0.21 -0.06 0.00 0.18 0.00 0.00 39.33 40.87 3fzb h ASP 77 CO 0.92 -0.34 0.60 0.77 -3.12 0.00 0.00 179.24 178.07 3fzb h SER 78 N 0.04 0.98 0.72 6.45 4.64 -1.99 -1.15 113.55 123.24 3fzb h SER 78 Ca 0.84 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 62.13 3fzb h SER 78 Cb 2.38 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 64.26 3fzb h SER 78 CO -0.64 0.65 -0.42 -0.08 -0.87 0.00 0.00 176.83 175.47 3fzb h GLU 79 N 1.13 -1.03 -0.71 4.77 4.81 -0.12 0.20 114.58 123.62 3fzb h GLU 79 Ca 0.38 0.07 0.12 0.00 -0.13 0.00 0.00 59.36 59.80 3fzb h GLU 79 Cb 0.08 0.23 -0.13 0.00 0.63 0.00 0.00 28.75 29.56 3fzb h GLU 79 CO -0.14 -0.69 -0.35 -0.07 -0.73 0.00 0.00 179.01 177.03 3fzb h LEU 80 N -1.07 -1.23 -0.59 1.64 3.38 -1.48 0.98 115.31 116.94 3fzb h LEU 80 Ca -0.09 0.25 0.11 0.00 0.09 0.00 0.00 57.88 58.24 3fzb h LEU 80 Cb 0.86 0.63 -0.11 0.00 0.09 0.00 0.00 40.66 42.12 3fzb h LEU 80 CO 0.11 -0.30 -0.28 0.44 0.09 0.00 0.00 178.44 178.50 3fzb h ASP 81 N -0.11 -0.99 -1.01 -0.43 3.32 -0.42 0.49 116.42 117.27 3fzb h ASP 81 Ca 0.27 0.21 0.14 0.00 0.02 0.00 0.00 57.03 57.67 3fzb h ASP 81 Cb 0.56 0.52 -0.09 0.00 0.22 0.00 0.00 39.33 40.54 3fzb h ASP 81 CO -0.77 -0.28 0.63 0.00 -1.72 0.00 0.00 179.24 177.10 3fzb h ALA 82 N 1.16 1.57 -0.51 3.45 0.00 0.18 0.11 119.26 125.23 3fzb h ALA 82 Ca 0.25 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.17 3fzb h ALA 82 Cb 0.53 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 3fzb h ALA 82 CO -0.66 0.15 0.20 2.35 0.00 0.00 0.00 179.25 181.29 3fzb h TRP 83 N 0.93 0.77 -0.27 0.00 7.01 0.24 -2.76 115.95 121.88 3fzb h TRP 83 Ca 0.52 -0.06 -0.04 0.00 2.11 0.00 0.00 58.89 61.43 3fzb h TRP 83 Cb 0.61 -0.23 -0.01 0.00 -2.10 0.00 0.00 29.16 27.43 3fzb h TRP 83 CO -0.00 0.64 0.02 0.52 -2.79 0.00 0.00 178.44 176.83 3fzb h MET 84 N 0.68 0.46 0.00 2.65 2.86 -0.39 -0.46 114.93 120.73 3fzb h MET 84 Ca 0.17 -0.14 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 3fzb h MET 84 Cb 0.20 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 31.81 3fzb h MET 84 CO -0.01 0.61 0.00 -1.91 1.06 0.00 0.00 176.91 176.65 3fzb n GLU 85 N -4.63 0.00 0.00 1.72 4.07 0.25 -0.54 120.64 121.51 3fzb n GLU 85 Ca -0.03 0.41 0.00 0.00 -0.06 0.00 0.00 57.16 57.48 3fzb n GLU 85 Cb 0.23 -1.50 0.00 0.00 -0.06 0.00 0.00 31.44 30.11 3fzb n GLU 85 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 3fzb n SER 86 N -1.49 0.00 0.15 4.31 3.41 -1.05 -4.78 113.62 114.17 3fzb n SER 86 Ca 0.01 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.75 3fzb n SER 86 Cb 0.06 0.00 0.49 0.00 -0.26 0.00 0.00 64.21 64.49 3fzb n SER 86 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 3fzb h ARG 87 N 0.00 0.00 0.00 4.33 3.08 -1.26 -3.40 114.38 117.14 3fzb h ARG 87 Ca 0.00 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.93 3fzb h ARG 87 Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 3fzb h ARG 87 CO 0.00 0.00 -1.21 -0.89 -1.07 0.00 0.00 179.97 176.80 3fzb n ILE 88 N -2.38 0.72 -0.07 2.04 2.08 -1.20 -4.76 119.36 115.79 3fzb n ILE 88 Ca 0.03 -0.01 -0.09 0.00 0.56 0.00 0.00 62.75 63.24 3fzb n ILE 88 Cb 0.29 -1.68 -0.06 0.00 -0.75 0.00 0.00 39.64 37.44 3fzb n ILE 88 CO 0.00 0.00 0.00 1.88 0.56 0.00 0.00 176.55 178.99 3fzb h TYR 89 N -0.33 -1.02 -0.76 1.39 0.05 -1.02 -2.85 116.97 112.42 3fzb h TYR 89 Ca -0.17 0.05 0.12 0.00 0.05 0.00 0.00 58.73 58.77 3fzb h TYR 89 Cb 0.98 0.47 -0.13 0.00 1.01 0.00 0.00 36.73 39.06 3fzb h TYR 89 CO -0.06 -0.30 -0.38 -1.00 -1.05 0.00 0.00 178.16 175.37 3fzb h PRO 90 N -0.26 -0.10 -0.49 4.88 0.13 -1.82 0.07 132.00 134.41 3fzb h PRO 90 Ca 0.04 0.01 0.08 0.00 -0.87 0.00 0.00 66.00 65.26 3fzb h PRO 90 Cb 0.37 0.02 -0.10 0.00 0.13 0.00 0.00 31.00 31.42 3fzb h PRO 90 CO -0.34 -0.07 -0.39 -0.39 -0.23 0.00 0.00 178.00 176.58 3fzb h VAL 91 N -0.10 0.14 -0.92 1.56 -1.51 -1.81 0.28 116.25 113.88 3fzb h VAL 91 Ca 0.27 0.00 0.25 0.00 -1.23 0.00 0.00 66.70 65.98 3fzb h VAL 91 Cb 0.57 0.14 -0.05 0.00 -2.13 0.00 0.00 31.29 29.81 3fzb h VAL 91 CO -0.81 0.00 0.64 -0.03 -1.23 0.00 0.00 177.57 176.14 3fzb h MET 92 N -0.26 0.15 -1.21 5.19 -1.53 -0.80 -2.17 114.93 114.31 3fzb h MET 92 Ca 0.17 -0.01 0.35 0.00 -3.44 0.00 0.00 59.70 56.77 3fzb h MET 92 Cb 0.56 -0.03 -0.07 0.00 -0.55 0.00 0.00 31.60 31.51 3fzb h MET 92 CO -0.62 0.10 0.84 1.03 0.14 0.00 0.00 176.91 178.40 3fzb h SER 93 N 0.15 0.14 -0.80 1.39 0.87 0.47 -3.37 113.55 112.40 3fzb h SER 93 Ca 0.46 0.03 0.11 0.00 -1.23 0.00 0.00 61.79 61.16 3fzb h SER 93 Cb 1.55 0.01 -0.21 0.00 -0.44 0.00 0.00 62.40 63.32 3fzb h SER 93 CO -0.08 0.01 -0.21 -1.81 -0.53 0.00 0.00 176.83 174.21 3fzb s ASP 94 N -5.06 -1.20 -0.56 6.23 1.11 -0.81 -5.10 116.67 111.29 3fzb s ASP 94 Ca -0.06 0.46 0.04 0.00 0.18 0.00 0.00 52.55 53.17 3fzb s ASP 94 Cb 0.24 1.89 0.14 0.00 1.07 0.00 0.00 42.92 46.26 3fzb s ASP 94 CO 0.81 -0.22 0.32 -0.63 1.18 0.00 0.00 175.17 176.63 3fzb s ILE 95 N 2.88 2.50 0.21 0.77 1.01 -1.26 -4.97 121.20 122.35 3fzb s ILE 95 Ca 0.15 -3.49 -0.10 0.00 0.00 0.00 0.00 60.65 57.21 3fzb s ILE 95 Cb -0.11 -2.71 0.18 0.00 0.01 0.00 0.00 42.46 39.83 3fzb s ILE 95 CO -0.21 -0.87 1.69 -0.65 0.00 0.00 0.00 174.94 174.89 3fzb h PRO 96 N 6.20 0.21 -1.01 2.79 0.11 -1.98 0.37 132.00 138.69 3fzb h PRO 96 Ca -0.00 -0.01 0.26 0.00 0.11 0.00 0.00 66.00 66.36 3fzb h PRO 96 Cb 0.86 -0.05 -0.13 0.00 0.11 0.00 0.00 31.00 31.79 3fzb h PRO 96 CO 0.67 0.14 0.60 0.00 -0.21 0.00 0.00 178.00 179.20 3fzb h ALA 97 N 1.52 1.87 0.00 -0.75 0.00 -1.93 -0.88 119.26 119.08 3fzb h ALA 97 Ca 0.33 0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.36 3fzb h ALA 97 Cb 0.51 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 3fzb h ALA 97 CO -0.45 -0.37 -0.02 1.25 0.00 0.00 0.00 179.25 179.66 3fzb h LEU 98 N 0.51 0.00 -0.23 0.00 5.85 -1.39 -3.36 115.31 116.69 3fzb h LEU 98 Ca 0.66 -0.79 0.02 0.00 0.84 0.00 0.00 57.88 58.61 3fzb h LEU 98 Cb 1.35 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.35 3fzb h LEU 98 CO -0.49 0.91 -0.14 -1.54 -0.34 0.00 0.00 178.44 176.85 3fzb n SER 99 N -4.64 -0.25 -0.22 1.25 3.41 0.11 0.44 113.62 113.73 3fzb n SER 99 Ca -0.08 0.97 0.00 0.00 -0.26 0.00 0.00 58.87 59.50 3fzb n SER 99 Cb 0.39 -0.33 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 3fzb n SER 99 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3fzb n ASP 100 N -3.44 0.42 -0.43 4.04 5.68 -0.99 -2.46 116.55 119.36 3fzb n ASP 100 Ca 0.00 -1.91 0.10 0.00 -0.50 0.00 0.00 54.79 52.49 3fzb n ASP 100 Cb 0.06 -0.21 -0.02 0.00 -1.14 0.00 0.00 41.12 39.82 3fzb n ASP 100 CO 0.00 0.00 0.00 -0.11 -1.33 0.00 0.00 177.20 175.76 3fzb n LEU 101 N -0.27 1.87 0.00 -2.12 7.94 0.17 -4.97 117.00 119.62 3fzb n LEU 101 Ca 0.00 -0.74 0.00 0.00 -1.11 0.00 0.00 56.01 54.16 3fzb n LEU 101 Cb 0.10 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.05 3fzb n LEU 101 CO 0.00 0.36 0.00 2.30 -1.11 0.00 0.00 177.39 178.94 3fzb n ILE 102 N -0.18 0.00 0.00 1.96 -5.35 -1.03 -4.83 119.36 109.93 3fzb n ILE 102 Ca 0.08 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.56 3fzb n ILE 102 Cb 0.44 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.34 3fzb n ILE 102 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 3fzb n THR 103 N 0.00 0.00 -3.62 7.28 -2.24 -0.54 -4.99 114.28 110.17 3fzb n THR 103 Ca 0.00 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.63 3fzb n THR 103 Cb 0.00 -0.42 -0.07 0.00 -2.10 0.00 0.00 70.33 67.74 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 -2.08 -0.42 -0.05 3.42 1.04 -1.23 -4.99 113.70 109.39 3fzb s SER 104 Ca 0.00 0.31 -0.12 0.00 0.48 0.00 0.00 55.95 56.62 3fzb s SER 104 Cb 0.00 0.45 0.02 0.00 0.10 0.00 0.00 66.02 66.59 3fzb s SER 104 CO 0.00 -0.60 0.29 -0.32 0.98 0.00 0.00 173.24 173.59 3fzb s MET 105 N -1.72 0.54 -0.19 4.02 1.75 -1.26 -2.24 119.30 120.20 3fzb s MET 105 Ca -0.09 -0.01 -0.27 0.00 -1.25 0.00 0.00 55.69 54.06 3fzb s MET 105 Cb -0.02 0.24 0.08 0.00 2.84 0.00 0.00 34.83 37.98 3fzb s MET 105 CO 0.04 -0.13 0.76 0.54 -0.65 0.00 0.00 175.02 175.58 3fzb s VAL 106 N -0.83 0.00 0.08 10.11 0.11 -1.08 -4.98 120.40 123.82 3fzb s VAL 106 Ca -0.09 0.00 -0.36 0.00 -2.93 0.00 0.00 61.98 58.60 3fzb s VAL 106 Cb -0.04 -1.00 -0.15 0.00 -1.53 0.00 0.00 36.38 33.65 3fzb s VAL 106 CO 0.03 0.00 1.51 0.00 -3.33 0.00 0.00 175.10 173.30 3fzb n ALA 107 N 1.91 0.20 -1.42 1.54 0.00 -1.26 -1.09 120.51 120.39 3fzb n ALA 107 Ca -0.15 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.75 3fzb n ALA 107 Cb 0.56 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 17.78 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 3.41 0.00 -1.69 0.00 2.88 0.34 -4.72 113.62 113.84 3fzb n SER 108 Ca 0.19 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.67 3fzb n SER 108 Cb 0.23 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.68 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 2.90 3.30 2.60 0.46 0.00 -1.10 -4.99 105.19 108.35 3fzb n GLY 109 Ca 0.00 -1.62 -0.26 0.00 0.00 0.00 0.00 46.02 44.15 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 -3.24 0.11 -0.05 1.61 5.04 -1.26 -2.16 117.35 117.40 3fzb s TYR 110 Ca 0.11 -0.71 -0.00 0.00 -2.44 0.00 0.00 57.07 54.03 3fzb s TYR 110 Cb 0.00 -0.78 -0.03 0.00 0.35 0.00 0.00 41.96 41.50 3fzb s TYR 110 CO 0.08 -0.86 -0.01 -0.51 -1.34 0.00 0.00 175.55 172.92 3fzb s ASP 111 N 2.14 5.10 -0.26 4.32 1.01 0.17 -4.92 116.67 124.23 3fzb s ASP 111 Ca 0.09 0.06 -0.09 0.00 0.71 0.00 0.00 52.55 53.32 3fzb s ASP 111 Cb -0.16 -1.37 -0.04 0.00 1.01 0.00 0.00 42.92 42.37 3fzb s ASP 111 CO -0.35 0.34 0.11 -0.31 0.21 0.00 0.00 175.17 175.18 3fzb s TYR 112 N -0.95 3.14 0.39 4.23 1.51 -1.26 0.16 117.35 124.57 3fzb s TYR 112 Ca 0.16 -0.20 0.06 0.00 -1.01 0.00 0.00 57.07 56.07 3fzb s TYR 112 Cb -0.11 -2.28 -0.07 0.00 -0.11 0.00 0.00 41.96 39.38 3fzb s TYR 112 CO 0.05 -0.26 0.03 1.03 -1.11 0.00 0.00 175.55 175.29 3fzb s ARG 113 N 1.62 1.88 -0.04 -0.62 0.52 -0.80 -4.99 118.95 116.52 3fzb s ARG 113 Ca 0.06 -2.07 -0.20 0.00 -0.52 0.00 0.00 55.73 53.00 3fzb s ARG 113 Cb -0.15 -1.39 0.04 0.00 0.52 0.00 0.00 34.95 33.97 3fzb s ARG 113 CO 0.06 -0.12 0.45 1.03 0.02 0.00 0.00 175.30 176.74 3fzb s ARG 114 N -3.77 0.78 -0.23 3.54 3.00 -1.26 0.26 118.95 121.26 3fzb s ARG 114 Ca 0.33 0.04 -0.29 0.00 0.00 0.00 0.00 55.73 55.82 3fzb s ARG 114 Cb 0.09 0.36 -0.03 0.00 0.00 0.00 0.00 34.95 35.37 3fzb s ARG 114 CO 0.16 -0.22 1.77 0.34 0.00 0.00 0.00 175.30 177.35 3fzb s ASP 115 N -1.12 6.13 -0.01 0.23 2.15 0.12 -4.81 116.67 119.37 3fzb s ASP 115 Ca -0.11 1.63 0.17 0.00 0.43 0.00 0.00 52.55 54.67 3fzb s ASP 115 Cb -0.03 -2.53 -0.19 0.00 -0.30 0.00 0.00 42.92 39.87 3fzb s ASP 115 CO 0.06 -1.46 0.65 -0.90 -0.17 0.00 0.00 175.17 173.34 3fzb n ASP 116 N 9.32 0.65 -3.05 -0.34 3.85 -1.26 -4.11 116.55 121.61 3fzb n ASP 116 Ca 0.21 0.29 -0.35 0.00 -0.71 0.00 0.00 54.79 54.23 3fzb n ASP 116 Cb 0.45 0.42 0.01 0.00 -1.35 0.00 0.00 41.12 40.65 3fzb n ASP 116 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 3fzb n ASP 117 N -2.84 6.36 -4.04 -1.12 3.85 -1.26 -5.03 116.55 112.47 3fzb n ASP 117 Ca -0.14 -3.74 -0.34 0.00 -0.71 0.00 0.00 54.79 49.86 3fzb n ASP 117 Cb 0.90 -0.88 -0.12 0.00 -1.35 0.00 0.00 41.12 39.67 3fzb n ASP 117 CO 0.00 0.00 0.00 -0.83 -1.01 0.00 0.00 177.20 175.36 3fzb s GLY 119 N -2.10 2.35 0.16 6.12 0.00 -1.26 -5.08 107.32 107.51 3fzb s GLY 119 Ca 0.47 -3.08 0.23 0.00 0.00 0.00 0.00 44.72 42.34 3fzb s GLY 119 CO -0.24 1.04 1.02 1.47 0.00 0.00 0.00 173.10 176.40 3fzb n LEU 120 N 3.61 0.74 -3.86 0.66 -0.00 -1.26 -4.62 117.00 112.27 3fzb n LEU 120 Ca 0.05 0.26 -0.09 0.00 -0.00 0.00 0.00 56.01 56.23 3fzb n LEU 120 Cb 0.37 -0.07 -0.05 0.00 -0.00 0.00 0.00 43.42 43.67 3fzb n LEU 120 CO 0.32 -0.14 0.21 -1.66 -0.00 0.00 0.00 177.39 176.13 3fzb s TRP 121 N -3.34 0.10 -0.11 1.47 1.48 -1.26 0.61 118.94 117.88 3fzb s TRP 121 Ca -0.00 -0.46 -0.00 0.00 -1.06 0.00 0.00 56.10 54.58 3fzb s TRP 121 Cb 0.11 0.29 0.02 0.00 -1.16 0.00 0.00 33.47 32.73 3fzb s TRP 121 CO 0.79 -0.93 -0.07 -1.12 -4.06 0.00 0.00 176.95 171.56 3fzb s SER 122 N -2.93 2.08 0.35 -2.66 0.01 -0.76 0.16 113.70 109.95 3fzb s SER 122 Ca 0.14 -0.28 0.08 0.00 1.31 0.00 0.00 55.95 57.20 3fzb s SER 122 Cb -0.01 -0.80 -0.04 0.00 0.21 0.00 0.00 66.02 65.38 3fzb s SER 122 CO 0.02 -0.11 0.22 -0.44 0.41 0.00 0.00 173.24 173.33 3fzb s SER 123 N 1.63 4.89 -0.11 2.44 0.01 0.14 -2.39 113.70 120.32 3fzb s SER 123 Ca 0.03 -0.71 -0.00 0.00 1.31 0.00 0.00 55.95 56.58 3fzb s SER 123 Cb -0.13 -0.77 0.02 0.00 0.21 0.00 0.00 66.02 65.36 3fzb s SER 123 CO -0.07 -0.37 -0.08 0.00 0.41 0.00 0.00 173.24 173.13 3fzb s ALA 124 N -2.41 1.30 -0.18 1.44 0.00 -0.76 -1.91 121.76 119.24 3fzb s ALA 124 Ca 0.40 -0.52 -0.01 0.00 0.00 0.00 0.00 51.96 51.83 3fzb s ALA 124 Cb -0.03 -0.87 0.00 0.00 0.00 0.00 0.00 23.12 22.22 3fzb s ALA 124 CO 0.24 -0.36 -0.12 0.34 0.00 0.00 0.00 175.76 175.87 3fzb s ASP 125 N 1.59 3.79 -0.15 0.00 -1.08 0.42 -1.23 116.67 120.01 3fzb s ASP 125 Ca 0.03 -0.48 -0.05 0.00 -0.52 0.00 0.00 52.55 51.53 3fzb s ASP 125 Cb -0.13 -1.61 -0.03 0.00 -1.46 0.00 0.00 42.92 39.69 3fzb s ASP 125 CO -0.07 0.03 -0.00 -0.22 0.52 0.00 0.00 175.17 175.43 3fzb s LEU 126 N 1.16 3.47 0.07 -1.34 2.96 -0.71 0.46 118.68 124.76 3fzb s LEU 126 Ca 0.01 -0.03 0.05 0.00 -0.22 0.00 0.00 54.13 53.95 3fzb s LEU 126 Cb -0.14 -1.84 -0.03 0.00 0.50 0.00 0.00 46.19 44.68 3fzb s LEU 126 CO -0.04 0.20 -0.14 0.42 -1.32 0.00 0.00 176.35 175.46 3fzb s THR 127 N 0.20 1.11 0.05 3.68 -4.23 -0.92 -0.82 115.64 114.70 3fzb s THR 127 Ca 0.00 -1.26 0.04 0.00 -1.18 0.00 0.00 61.69 59.29 3fzb s THR 127 Cb -0.13 -1.06 -0.02 0.00 1.34 0.00 0.00 72.50 72.62 3fzb s THR 127 CO 0.02 -0.19 -0.12 -0.31 -0.54 0.00 0.00 174.62 173.47 3fzb s TYR 128 N -1.21 1.05 -0.30 3.99 1.51 -0.28 -0.50 117.35 121.61 3fzb s TYR 128 Ca -0.02 -0.42 -0.10 0.00 -1.01 0.00 0.00 57.07 55.52 3fzb s TYR 128 Cb -0.10 -0.61 -0.03 0.00 -0.11 0.00 0.00 41.96 41.12 3fzb s TYR 128 CO 0.02 0.01 0.17 0.08 -1.11 0.00 0.00 175.55 174.73 3fzb s VAL 129 N -1.10 4.95 0.19 0.71 1.01 -0.25 0.19 120.40 126.10 3fzb s VAL 129 Ca -0.03 -0.14 0.09 0.00 0.00 0.00 0.00 61.98 61.90 3fzb s VAL 129 Cb -0.09 -3.44 -0.04 0.00 0.00 0.00 0.00 36.38 32.80 3fzb s VAL 129 CO 0.01 0.15 -0.09 0.27 0.00 0.00 0.00 175.10 175.45 3fzb s ILE 130 N 1.69 3.21 -0.04 2.22 -4.36 -0.43 -2.63 121.20 120.86 3fzb s ILE 130 Ca 0.06 -1.69 0.05 0.00 -0.26 0.00 0.00 60.65 58.81 3fzb s ILE 130 Cb -0.16 -2.61 -0.01 0.00 1.25 0.00 0.00 42.46 40.93 3fzb s ILE 130 CO 0.08 -0.14 -0.19 0.42 0.24 0.00 0.00 174.94 175.36 3fzb s THR 131 N -1.78 1.55 0.27 8.37 -4.23 -0.95 -2.13 115.64 116.74 3fzb s THR 131 Ca 0.26 -0.79 -0.14 0.00 -1.18 0.00 0.00 61.69 59.84 3fzb s THR 131 Cb -0.08 -1.32 0.01 0.00 1.34 0.00 0.00 72.50 72.44 3fzb s THR 131 CO 0.16 0.44 0.55 -0.72 -0.54 0.00 0.00 174.62 174.51 3fzb s TYR 132 N -0.04 0.29 -0.53 3.99 -0.85 -0.72 -1.46 117.35 118.03 3fzb s TYR 132 Ca -0.03 -0.68 -0.03 0.00 -0.52 0.00 0.00 57.07 55.80 3fzb s TYR 132 Cb -0.12 0.32 0.14 0.00 0.38 0.00 0.00 41.96 42.68 3fzb s TYR 132 CO 0.02 -1.10 0.34 -1.83 -1.52 0.00 0.00 175.55 171.47 3fzb s GLU 133 N -3.79 2.35 0.00 -3.49 4.04 -1.26 0.98 118.70 117.53 3fzb s GLU 133 Ca 0.20 -2.19 0.12 0.00 0.04 0.00 0.00 54.97 53.14 3fzb s GLU 133 Cb -0.02 -3.70 0.71 0.00 0.02 0.00 0.00 34.13 31.14 3fzb s GLU 133 CO 0.10 -1.14 1.14 -0.12 -1.84 0.00 0.00 175.26 173.40