#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fzr h GLY 18 N 0.00 1.19 0.93 5.00 0.00 -2.05 -0.99 103.07 107.15 1fzr h GLY 18 Ca 0.00 -0.56 -0.01 0.00 0.00 0.00 0.00 47.33 46.77 1fzr h GLY 18 CO 0.00 0.53 0.11 -2.00 0.00 0.00 0.00 176.54 175.19 1fzr h LEU 19 N 1.11 0.28 -0.71 3.11 5.85 -2.05 0.12 115.31 123.02 1fzr h LEU 19 Ca 0.27 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 1fzr h LEU 19 Cb 0.07 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.00 1fzr h LEU 19 CO -0.04 0.31 0.40 -0.08 -0.34 0.00 0.00 178.44 178.69 1fzr h GLU 20 N 0.24 0.99 -0.47 1.25 4.81 -1.93 -1.33 114.58 118.14 1fzr h GLU 20 Ca 0.08 -0.11 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1fzr h GLU 20 Cb 0.10 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.26 1fzr h GLU 20 CO -0.01 0.74 0.29 -0.44 -0.73 0.00 0.00 179.01 178.86 1fzr h ASP 21 N 0.98 0.56 -0.29 1.04 3.32 -0.92 0.16 116.42 121.27 1fzr h ASP 21 Ca 0.25 -0.05 -0.06 0.00 0.02 0.00 0.00 57.03 57.20 1fzr h ASP 21 Cb 0.03 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 1fzr h ASP 21 CO -0.04 0.44 0.00 0.11 -1.72 0.00 0.00 179.24 178.03 1fzr h LYS 22 N 0.63 0.62 -0.22 3.56 1.57 -0.62 0.68 116.57 122.79 1fzr h LYS 22 Ca 0.17 -0.14 -0.18 0.00 -1.87 0.00 0.00 60.65 58.62 1fzr h LYS 22 Cb -0.02 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.21 1fzr h LYS 22 CO -0.03 0.64 -0.59 0.28 -0.57 0.00 0.00 179.45 179.18 1fzr h VAL 23 N 0.59 1.29 -0.48 0.50 2.07 -0.74 -1.07 116.25 118.41 1fzr h VAL 23 Ca 0.12 -1.79 0.02 0.00 0.82 0.00 0.00 66.70 65.87 1fzr h VAL 23 Cb 0.37 1.82 -0.03 0.00 -1.52 0.00 0.00 31.29 31.93 1fzr h VAL 23 CO 0.01 0.57 0.30 -1.28 0.02 0.00 0.00 177.57 177.19 1fzr h SER 24 N 0.52 0.49 -0.87 0.57 0.87 -0.42 -1.74 113.55 112.98 1fzr h SER 24 Ca -0.01 -0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.52 1fzr h SER 24 Cb 1.20 -0.11 -0.04 0.00 -0.44 0.00 0.00 62.40 63.02 1fzr h SER 24 CO 0.13 0.35 0.43 0.50 -0.53 0.00 0.00 176.83 177.71 1fzr h LYS 25 N 0.60 1.24 -0.11 2.24 3.64 -0.78 -0.26 116.57 123.15 1fzr h LYS 25 Ca 0.19 -0.17 0.01 0.00 -1.27 0.00 0.00 60.65 59.41 1fzr h LYS 25 Cb -0.01 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 31.56 1fzr h LYS 25 CO -0.07 0.94 0.01 0.37 -2.27 0.00 0.00 179.45 178.43 1fzr h GLN 26 N 1.24 0.06 -0.30 1.90 4.15 -0.66 -1.16 115.11 120.33 1fzr h GLN 26 Ca 0.30 -0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.68 1fzr h GLN 26 Cb 0.09 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.76 1fzr h GLN 26 CO -0.04 0.04 0.02 -0.07 -1.93 0.00 0.00 178.83 176.85 1fzr h LEU 27 N 0.06 0.50 -0.34 -2.39 3.38 -0.95 -3.02 115.31 112.55 1fzr h LEU 27 Ca 0.05 -0.28 0.03 0.00 0.09 0.00 0.00 57.88 57.76 1fzr h LEU 27 Cb 0.05 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 1fzr h LEU 27 CO -0.07 0.66 0.16 -0.33 0.09 0.00 0.00 178.44 178.96 1fzr h GLU 28 N 0.32 0.33 0.00 1.13 5.08 -0.96 -1.28 114.58 119.20 1fzr h GLU 28 Ca 0.09 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1fzr h GLU 28 Cb 0.39 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 1fzr h GLU 28 CO 0.01 0.22 -0.00 0.66 -1.00 0.00 0.00 179.01 178.90 1fzr h SER 29 N 0.34 0.00 -0.02 1.42 4.64 -1.17 0.41 113.55 119.16 1fzr h SER 29 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1fzr h SER 29 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1fzr h SER 29 CO -0.11 0.00 -0.20 1.17 -0.87 0.00 0.00 176.83 176.82 1fzr n LYS 30 N -3.19 1.85 -1.74 4.77 3.00 -0.69 -4.96 118.16 117.18 1fzr n LYS 30 Ca -0.03 -1.53 -0.10 0.00 -0.00 0.00 0.00 58.31 56.66 1fzr n LYS 30 Cb 0.10 -1.47 -0.02 0.00 0.00 0.00 0.00 35.03 33.64 1fzr n LYS 30 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1fzr n GLY 31 N 1.38 0.55 3.71 3.14 0.00 0.14 -4.98 105.19 109.13 1fzr n GLY 31 Ca 0.12 -0.52 -0.42 0.00 0.00 0.00 0.00 46.02 45.20 1fzr n GLY 31 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fzr s ILE 32 N -2.43 4.28 -1.26 -0.61 -1.09 -0.59 -4.94 121.20 114.56 1fzr s ILE 32 Ca 0.00 1.63 -0.16 0.00 -2.23 0.00 0.00 60.65 59.89 1fzr s ILE 32 Cb 0.00 -4.04 0.12 0.00 -1.58 0.00 0.00 42.46 36.96 1fzr s ILE 32 CO 0.00 0.10 1.60 2.29 -1.23 0.00 0.00 174.94 177.69 1fzr n LYS 33 N 4.23 3.28 -3.15 2.79 2.85 -1.26 -4.65 118.16 122.25 1fzr n LYS 33 Ca 0.09 -3.56 -0.21 0.00 -1.05 0.00 0.00 58.31 53.57 1fzr n LYS 33 Cb 0.47 -3.27 0.01 0.00 -0.65 0.00 0.00 35.03 31.59 1fzr n LYS 33 CO 0.00 0.00 0.00 -0.59 -0.05 0.00 0.00 177.40 176.76 1fzr s PHE 34 N 2.87 3.16 -0.10 5.58 -0.12 -1.26 -5.10 117.98 123.01 1fzr s PHE 34 Ca 0.48 0.04 -0.00 0.00 -0.05 0.00 0.00 56.93 57.40 1fzr s PHE 34 Cb 0.01 -2.22 -0.03 0.00 -0.63 0.00 0.00 43.02 40.16 1fzr s PHE 34 CO 0.04 -0.25 -0.08 -1.21 -0.05 0.00 0.00 175.22 173.67 1fzr s GLU 35 N -4.42 3.05 -0.32 1.99 2.02 -1.26 -5.10 118.70 114.66 1fzr s GLU 35 Ca 0.48 -0.58 -0.09 0.00 0.02 0.00 0.00 54.97 54.79 1fzr s GLU 35 Cb -0.10 -2.65 0.01 0.00 0.10 0.00 0.00 34.13 31.49 1fzr s GLU 35 CO 0.35 0.49 0.15 -0.47 0.02 0.00 0.00 175.26 175.79 1fzr s TYR 36 N -0.33 3.19 -1.29 1.61 5.04 -1.26 -4.58 117.35 119.73 1fzr s TYR 36 Ca 0.04 -0.79 -0.10 0.00 -2.44 0.00 0.00 57.07 53.78 1fzr s TYR 36 Cb -0.13 -2.35 0.08 0.00 0.35 0.00 0.00 41.96 39.92 1fzr s TYR 36 CO 0.02 -0.54 0.50 0.39 -1.34 0.00 0.00 175.55 174.58 1fzr n GLU 37 N 4.95 -3.22 0.09 4.97 1.02 -1.26 -4.85 120.64 122.35 1fzr n GLU 37 Ca -0.13 0.43 0.05 0.00 -0.02 0.00 0.00 57.16 57.48 1fzr n GLU 37 Cb 0.48 -5.12 -0.02 0.00 -0.02 0.00 0.00 31.44 26.76 1fzr n GLU 37 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1fzr h GLU 38 N -0.97 0.00 -6.00 3.49 4.57 -2.02 -3.47 114.58 110.19 1fzr h GLU 38 Ca -0.43 0.00 -0.62 0.00 -1.18 0.00 0.00 59.36 57.12 1fzr h GLU 38 Cb 1.29 0.00 -0.30 0.00 -0.16 0.00 0.00 28.75 29.58 1fzr h GLU 38 CO 0.55 0.22 -0.86 -1.58 -1.18 0.00 0.00 179.01 176.16 1fzr s TRP 39 N -3.08 1.98 0.01 0.92 0.52 -1.26 -5.14 118.94 112.90 1fzr s TRP 39 Ca 0.00 -0.44 0.06 0.00 0.02 0.00 0.00 56.10 55.74 1fzr s TRP 39 Cb 0.08 -1.29 -0.03 0.00 -1.15 0.00 0.00 33.47 31.08 1fzr s TRP 39 CO 0.78 -0.08 -0.16 -1.59 0.02 0.00 0.00 176.95 175.92 1fzr s LYS 40 N -0.38 2.23 -0.35 4.98 -2.85 -1.26 -5.09 119.74 117.01 1fzr s LYS 40 Ca 0.05 -0.89 -0.10 0.00 -1.00 0.00 0.00 55.97 54.04 1fzr s LYS 40 Cb -0.10 -2.26 0.02 0.00 -2.06 0.00 0.00 37.83 33.43 1fzr s LYS 40 CO 0.00 0.57 0.17 0.08 0.10 0.00 0.00 175.35 176.27 1fzr s VAL 41 N -0.88 4.39 0.31 1.79 1.01 -1.26 -5.09 120.40 120.67 1fzr s VAL 41 Ca 0.14 -0.83 -0.26 0.00 0.00 0.00 0.00 61.98 61.03 1fzr s VAL 41 Cb -0.11 -3.41 -0.10 0.00 0.00 0.00 0.00 36.38 32.77 1fzr s VAL 41 CO 0.04 -0.16 0.94 -2.84 0.00 0.00 0.00 175.10 173.08 1fzr s PRO 42 N 1.53 4.60 0.19 2.72 0.02 -1.26 -5.05 135.00 137.75 1fzr s PRO 42 Ca 0.02 1.33 -0.15 0.00 0.02 0.00 0.00 61.00 62.22 1fzr s PRO 42 Cb -0.19 -2.85 0.01 0.00 0.02 0.00 0.00 34.50 31.50 1fzr s PRO 42 CO 0.06 0.31 0.45 1.52 -0.33 0.00 0.00 177.00 179.01 1fzr s TYR 43 N -1.57 0.07 -0.10 6.54 -0.85 -1.26 -5.16 117.35 115.02 1fzr s TYR 43 Ca 0.49 -0.43 0.04 0.00 -0.52 0.00 0.00 57.07 56.65 1fzr s TYR 43 Cb -0.19 0.25 -0.00 0.00 0.38 0.00 0.00 41.96 42.39 1fzr s TYR 43 CO 0.24 -0.87 -0.22 0.08 -1.52 0.00 0.00 175.55 173.26 1fzr s VAL 44 N -3.91 2.24 -0.32 -3.49 1.01 -1.26 -5.08 120.40 109.59 1fzr s VAL 44 Ca 0.13 -0.96 -0.18 0.00 0.00 0.00 0.00 61.98 60.96 1fzr s VAL 44 Cb 0.00 -1.87 -0.01 0.00 0.00 0.00 0.00 36.38 34.50 1fzr s VAL 44 CO -0.01 0.56 0.54 -0.63 0.00 0.00 0.00 175.10 175.56 1fzr s ILE 45 N 0.28 5.01 0.86 2.22 1.01 -1.26 -5.04 121.20 124.27 1fzr s ILE 45 Ca -0.16 0.61 -0.12 0.00 0.00 0.00 0.00 60.65 60.98 1fzr s ILE 45 Cb -0.17 -3.93 0.11 0.00 0.01 0.00 0.00 42.46 38.48 1fzr s ILE 45 CO 0.08 -0.12 1.17 -2.65 0.00 0.00 0.00 174.94 173.42 1fzr n PRO 46 N 5.73 -0.09 -1.24 2.79 -0.02 -1.26 -4.98 135.00 135.93 1fzr n PRO 46 Ca -0.04 0.05 -0.33 0.00 -2.02 0.00 0.00 63.50 61.16 1fzr n PRO 46 Cb 0.49 -2.41 0.11 0.00 -0.02 0.00 0.00 33.50 31.68 1fzr n PRO 46 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1fzr s ALA 47 N -2.34 1.95 0.05 3.55 0.00 -1.26 -5.03 121.76 118.69 1fzr s ALA 47 Ca 0.71 0.82 0.00 0.00 0.00 0.00 0.00 51.96 53.49 1fzr s ALA 47 Cb -0.27 -3.47 -0.03 0.00 0.00 0.00 0.00 23.12 19.35 1fzr s ALA 47 CO 0.54 -2.12 -0.04 -1.54 0.00 0.00 0.00 175.76 172.60 1fzr s SER 48 N -2.19 0.63 -0.08 0.00 1.04 -1.26 -5.15 113.70 106.68 1fzr s SER 48 Ca 0.73 -0.84 -0.06 0.00 0.48 0.00 0.00 55.95 56.25 1fzr s SER 48 Cb -0.28 0.14 -0.04 0.00 0.10 0.00 0.00 66.02 65.94 1fzr s SER 48 CO 0.49 -0.46 0.17 0.20 0.98 0.00 0.00 173.24 174.62 1fzr s ASN 49 N -2.48 6.41 0.28 7.02 0.02 -1.26 -5.10 114.94 119.83 1fzr s ASN 49 Ca 0.01 0.47 -0.10 0.00 -1.02 0.00 0.00 52.86 52.22 1fzr s ASN 49 Cb 0.01 -2.06 -0.00 0.00 0.02 0.00 0.00 41.25 39.22 1fzr s ASN 49 CO -0.06 0.36 0.48 -1.00 0.02 0.00 0.00 177.10 176.91 1fzr s HIS 50 N -1.11 0.54 0.02 2.20 3.76 -1.26 -5.18 115.29 114.27 1fzr s HIS 50 Ca 0.19 -0.89 0.03 0.00 -0.15 0.00 0.00 55.06 54.23 1fzr s HIS 50 Cb -0.12 0.14 -0.02 0.00 1.11 0.00 0.00 32.58 33.69 1fzr s HIS 50 CO 0.08 -1.05 -0.08 0.95 -0.85 0.00 0.00 174.74 173.79 1fzr s THR 51 N -3.68 0.63 -0.09 1.30 -4.23 -1.26 -5.14 115.64 103.16 1fzr s THR 51 Ca 0.25 -0.71 0.04 0.00 -1.18 0.00 0.00 61.69 60.09 1fzr s THR 51 Cb -0.01 -0.60 -0.01 0.00 1.34 0.00 0.00 72.50 73.23 1fzr s THR 51 CO 0.12 -0.08 -0.22 -0.47 -0.54 0.00 0.00 174.62 173.42 1fzr s TYR 52 N -0.74 2.56 -0.40 3.99 5.04 -1.26 -5.10 117.35 121.43 1fzr s TYR 52 Ca -0.02 -0.85 -0.01 0.00 -2.44 0.00 0.00 57.07 53.75 1fzr s TYR 52 Cb -0.06 -1.69 0.11 0.00 0.35 0.00 0.00 41.96 40.67 1fzr s TYR 52 CO 0.00 -0.30 0.18 0.99 -1.34 0.00 0.00 175.55 175.08 1fzr s THR 53 N 0.14 3.02 0.45 4.34 2.01 -1.26 -5.09 115.64 119.24 1fzr s THR 53 Ca -0.12 -2.22 -0.24 0.00 0.31 0.00 0.00 61.69 59.42 1fzr s THR 53 Cb -0.16 -3.10 -0.09 0.00 0.01 0.00 0.00 72.50 69.16 1fzr s THR 53 CO 0.06 -0.68 1.18 -2.65 -0.69 0.00 0.00 174.62 171.85 1fzr n PRO 54 N 4.40 1.67 -0.15 4.92 -0.02 -1.26 -4.89 135.00 139.67 1fzr n PRO 54 Ca 0.00 0.60 -0.09 0.00 -2.02 0.00 0.00 63.50 61.99 1fzr n PRO 54 Cb 0.41 -2.29 0.05 0.00 -0.02 0.00 0.00 33.50 31.65 1fzr n PRO 54 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1fzr h ASP 55 N 1.76 0.94 -4.57 2.55 3.32 -1.75 -3.46 116.42 115.21 1fzr h ASP 55 Ca -0.47 -0.31 -0.28 0.00 0.02 0.00 0.00 57.03 55.98 1fzr h ASP 55 Cb 1.31 -0.26 -0.23 0.00 0.22 0.00 0.00 39.33 40.38 1fzr h ASP 55 CO 0.58 1.07 -0.74 -0.36 -1.72 0.00 0.00 179.24 178.07 1fzr s PHE 56 N -4.79 0.62 -0.19 4.55 0.40 0.44 -5.00 117.98 114.02 1fzr s PHE 56 Ca -0.11 -0.41 0.01 0.00 -0.60 0.00 0.00 56.93 55.82 1fzr s PHE 56 Cb 0.13 -0.38 0.04 0.00 0.51 0.00 0.00 43.02 43.33 1fzr s PHE 56 CO 0.85 -0.07 -0.10 -1.17 0.70 0.00 0.00 175.22 175.43 1fzr s LEU 57 N -1.24 2.09 0.35 -0.37 2.96 -1.26 0.20 118.68 121.41 1fzr s LEU 57 Ca -0.07 -0.80 -0.17 0.00 -0.22 0.00 0.00 54.13 52.87 1fzr s LEU 57 Cb -0.08 -1.17 -0.10 0.00 0.50 0.00 0.00 46.19 45.34 1fzr s LEU 57 CO 0.00 -0.14 0.80 -0.76 -1.32 0.00 0.00 176.35 174.93 1fzr s LEU 58 N 1.45 4.05 0.53 -0.68 1.02 0.99 -4.96 118.68 121.08 1fzr s LEU 58 Ca -0.00 1.41 0.33 0.00 0.02 0.00 0.00 54.13 55.90 1fzr s LEU 58 Cb -0.16 -4.19 1.50 0.00 0.02 0.00 0.00 46.19 43.37 1fzr s LEU 58 CO -0.08 -0.24 1.85 -0.65 0.02 0.00 0.00 176.35 177.25 1fzr h PRO 59 N 2.23 0.02 -0.46 1.29 0.11 -1.97 0.18 132.00 133.39 1fzr h PRO 59 Ca -0.48 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1fzr h PRO 59 Cb 1.18 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1fzr h PRO 59 CO 0.64 0.01 0.00 0.27 -0.21 0.00 0.00 178.00 178.71 1fzr n ASN 60 N -4.24 1.86 0.00 -2.05 6.94 -1.26 -4.83 115.26 111.68 1fzr n ASN 60 Ca 0.22 -2.11 0.00 0.00 -0.02 0.00 0.00 54.58 52.67 1fzr n ASN 60 Cb 1.08 -0.31 0.00 0.00 -2.36 0.00 0.00 39.78 38.19 1fzr n ASN 60 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1fzr n GLY 61 N 0.70 0.75 3.75 4.83 0.00 0.61 -0.72 105.19 115.11 1fzr n GLY 61 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 1fzr n GLY 61 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fzr s ILE 62 N -2.70 4.99 -0.06 -0.61 1.01 -1.24 -4.53 121.20 118.06 1fzr s ILE 62 Ca 0.00 1.24 -0.08 0.00 0.00 0.00 0.00 60.65 61.81 1fzr s ILE 62 Cb 0.00 -3.94 -0.04 0.00 0.01 0.00 0.00 42.46 38.49 1fzr s ILE 62 CO 0.00 0.37 0.22 -0.36 0.00 0.00 0.00 174.94 175.16 1fzr s PHE 63 N 0.17 3.62 -0.05 3.97 0.40 0.59 -0.01 117.98 126.67 1fzr s PHE 63 Ca 0.32 0.61 0.01 0.00 -0.60 0.00 0.00 56.93 57.27 1fzr s PHE 63 Cb -0.18 -2.01 0.02 0.00 0.51 0.00 0.00 43.02 41.37 1fzr s PHE 63 CO 0.16 0.69 -0.05 0.08 0.70 0.00 0.00 175.22 176.80 1fzr s VAL 64 N -1.11 0.60 -0.07 -0.44 1.01 0.13 -0.76 120.40 119.76 1fzr s VAL 64 Ca 0.20 -0.15 0.01 0.00 0.00 0.00 0.00 61.98 62.04 1fzr s VAL 64 Cb -0.13 -0.62 -0.03 0.00 0.00 0.00 0.00 36.38 35.60 1fzr s VAL 64 CO 0.09 0.24 -0.09 -0.75 0.00 0.00 0.00 175.10 174.60 1fzr s LYS 65 N 0.97 2.80 -0.05 2.72 2.47 -0.34 -0.42 119.74 127.88 1fzr s LYS 65 Ca -0.10 -0.59 -0.04 0.00 -1.56 0.00 0.00 55.97 53.68 1fzr s LYS 65 Cb -0.14 -2.57 -0.04 0.00 -1.46 0.00 0.00 37.83 33.62 1fzr s LYS 65 CO -0.00 0.60 0.16 0.95 0.16 0.00 0.00 175.35 177.22 1fzr s THR 66 N -0.63 5.42 -0.09 3.43 -4.23 -1.26 -1.08 115.64 117.20 1fzr s THR 66 Ca 0.09 -0.03 -0.07 0.00 -1.18 0.00 0.00 61.69 60.51 1fzr s THR 66 Cb -0.11 -3.46 0.02 0.00 1.34 0.00 0.00 72.50 70.29 1fzr s THR 66 CO 0.02 0.44 0.22 -0.54 -0.54 0.00 0.00 174.62 174.22 1fzr s LYS 67 N -1.56 0.25 0.00 3.99 -0.14 -0.68 -4.95 119.74 116.65 1fzr s LYS 67 Ca 0.22 0.33 0.00 0.00 -1.36 0.00 0.00 55.97 55.17 1fzr s LYS 67 Cb -0.12 0.09 0.00 0.00 -1.68 0.00 0.00 37.83 36.12 1fzr s LYS 67 CO 0.13 -0.05 0.00 0.41 -0.76 0.00 0.00 175.35 175.08 1fzr n GLY 68 N 3.12 0.30 3.76 -3.33 0.00 -1.26 -1.60 105.19 106.19 1fzr n GLY 68 Ca -0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.49 1fzr n GLY 68 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1fzr s LEU 69 N 0.00 4.06 -0.53 0.99 2.96 -1.26 -4.68 118.68 120.22 1fzr s LEU 69 Ca 0.00 2.53 0.04 0.00 -0.22 0.00 0.00 54.13 56.48 1fzr s LEU 69 Cb 0.00 -4.11 0.16 0.00 0.50 0.00 0.00 46.19 42.74 1fzr s LEU 69 CO 0.00 -1.01 0.38 0.86 -1.32 0.00 0.00 176.35 175.26 1fzr s TRP 70 N -1.38 2.22 0.77 5.38 -0.00 -1.26 -5.11 118.94 119.55 1fzr s TRP 70 Ca 0.62 -2.73 -0.15 0.00 -0.00 0.00 0.00 56.10 53.84 1fzr s TRP 70 Cb -0.35 -1.80 0.02 0.00 -0.00 0.00 0.00 33.47 31.35 1fzr s TRP 70 CO 0.43 -0.71 0.90 0.39 -0.00 0.00 0.00 176.95 177.95 1fzr n GLU 71 N 2.65 0.31 -0.07 5.86 -0.58 -1.26 -4.75 120.64 122.80 1fzr n GLU 71 Ca 0.22 0.16 0.10 0.00 -0.42 0.00 0.00 57.16 57.22 1fzr n GLU 71 Cb 0.40 -2.17 0.49 0.00 -0.57 0.00 0.00 31.44 29.59 1fzr n GLU 71 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1fzr h SER 72 N -0.57 0.39 -0.18 1.62 0.87 -2.00 -0.09 113.55 113.59 1fzr h SER 72 Ca -0.46 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 59.99 1fzr h SER 72 Cb 1.32 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 63.19 1fzr h SER 72 CO 0.45 0.24 -0.24 0.44 -0.53 0.00 0.00 176.83 177.19 1fzr h ASP 73 N 0.44 0.65 0.01 6.23 3.32 -2.00 -1.87 116.42 123.19 1fzr h ASP 73 Ca 0.25 -0.23 -0.16 0.00 0.02 0.00 0.00 57.03 56.91 1fzr h ASP 73 Cb 0.42 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 1fzr h ASP 73 CO -0.07 0.88 -0.56 0.44 -1.72 0.00 0.00 179.24 178.21 1fzr h ASP 74 N 0.56 0.64 -0.53 6.45 3.32 -1.39 -2.01 116.42 123.47 1fzr h ASP 74 Ca 0.08 -0.35 -0.09 0.00 0.02 0.00 0.00 57.03 56.69 1fzr h ASP 74 Cb 0.71 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 40.06 1fzr h ASP 74 CO 0.05 1.07 -0.03 0.03 -1.72 0.00 0.00 179.24 178.64 1fzr h ARG 75 N 0.44 0.95 0.14 3.56 3.08 -1.14 -0.92 114.38 120.49 1fzr h ARG 75 Ca 0.01 -0.32 -0.00 0.00 0.07 0.00 0.00 59.98 59.74 1fzr h ARG 75 Cb 1.11 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 31.08 1fzr h ARG 75 CO 0.11 0.98 -0.08 0.87 -1.07 0.00 0.00 179.97 180.77 1fzr h LYS 76 N 0.82 -0.20 -0.96 0.04 1.57 -1.24 -1.91 116.57 114.69 1fzr h LYS 76 Ca 0.15 0.01 0.06 0.00 -1.87 0.00 0.00 60.65 59.00 1fzr h LYS 76 Cb 0.57 0.05 -0.06 0.00 0.08 0.00 0.00 32.23 32.86 1fzr h LYS 76 CO 0.03 -0.13 0.63 0.87 -0.57 0.00 0.00 179.45 180.27 1fzr h LYS 77 N -0.21 1.10 -0.36 3.15 1.57 -1.20 -1.71 116.57 118.90 1fzr h LYS 77 Ca -0.01 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1fzr h LYS 77 Cb 0.17 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.22 1fzr h LYS 77 CO 0.02 0.73 0.22 1.25 -0.57 0.00 0.00 179.45 181.09 1fzr h HIS 78 N 1.13 0.47 -0.12 -1.35 2.76 -0.74 -0.87 115.15 116.43 1fzr h HIS 78 Ca 0.41 0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 58.53 1fzr h HIS 78 Cb 0.15 -0.16 -0.01 0.00 1.55 0.00 0.00 27.41 28.95 1fzr h HIS 78 CO -0.00 0.33 -0.15 -0.07 -1.30 0.00 0.00 177.93 176.74 1fzr h LEU 79 N 0.47 0.18 -0.05 0.26 3.38 -0.58 -0.29 115.31 118.68 1fzr h LEU 79 Ca 0.13 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1fzr h LEU 79 Cb -0.01 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 1fzr h LEU 79 CO -0.03 0.35 -0.00 -0.07 0.09 0.00 0.00 178.44 178.78 1fzr h LEU 80 N 0.18 0.08 -1.19 1.67 3.38 -0.64 0.68 115.31 119.48 1fzr h LEU 80 Ca 0.04 -0.31 0.02 0.00 0.09 0.00 0.00 57.88 57.71 1fzr h LEU 80 Cb 0.38 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.06 1fzr h LEU 80 CO 0.02 0.38 0.55 0.40 0.09 0.00 0.00 178.44 179.88 1fzr h ILE 81 N -0.21 1.19 0.44 1.22 2.04 -0.98 -0.36 117.51 120.85 1fzr h ILE 81 Ca 0.01 -0.38 -0.02 0.00 1.00 0.00 0.00 64.86 65.47 1fzr h ILE 81 Cb 0.33 -0.01 -0.00 0.00 -0.74 0.00 0.00 36.82 36.40 1fzr h ILE 81 CO 0.00 0.20 -0.28 -0.09 0.00 0.00 0.00 178.15 177.99 1fzr h ARG 82 N 1.11 -0.65 -1.00 2.37 9.65 -0.69 0.19 114.38 125.35 1fzr h ARG 82 Ca 0.31 0.04 0.21 0.00 -1.10 0.00 0.00 59.98 59.45 1fzr h ARG 82 Cb -0.08 0.15 -0.10 0.00 -1.39 0.00 0.00 29.97 28.55 1fzr h ARG 82 CO -0.08 -0.43 0.62 1.49 2.80 0.00 0.00 179.97 184.37 1fzr h GLU 83 N -0.68 0.60 0.00 0.20 4.22 -0.62 -2.72 114.58 115.58 1fzr h GLU 83 Ca -0.06 -0.04 0.00 0.00 0.08 0.00 0.00 59.36 59.34 1fzr h GLU 83 Cb 0.54 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1fzr h GLU 83 CO 0.06 0.40 -0.79 1.96 -2.18 0.00 0.00 179.01 178.45 1fzr h GLN 84 N 0.62 0.00 -1.71 1.92 4.20 -0.85 -3.40 115.11 115.89 1fzr h GLN 84 Ca 0.57 0.00 -0.49 0.00 0.06 0.00 0.00 58.65 58.79 1fzr h GLN 84 Cb 1.10 0.00 -0.41 0.00 0.30 0.00 0.00 27.48 28.47 1fzr h GLN 84 CO -0.35 0.00 -1.00 0.72 -0.67 0.00 0.00 178.83 177.53 1fzr n HIS 85 N -2.62 1.82 0.31 2.96 8.25 0.64 -4.91 115.22 121.66 1fzr n HIS 85 Ca 0.01 -3.46 0.11 0.00 -0.26 0.00 0.00 57.72 54.11 1fzr n HIS 85 Cb 0.53 -0.37 0.57 0.00 1.12 0.00 0.00 29.99 31.84 1fzr n HIS 85 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1fzr h PRO 86 N 2.93 0.00 0.00 -0.41 0.11 -1.77 0.92 132.00 133.78 1fzr h PRO 86 Ca 0.09 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.20 1fzr h PRO 86 Cb 0.92 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.03 1fzr h PRO 86 CO 0.63 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.81 1fzr n GLU 87 N -2.66 0.05 -3.83 1.05 4.71 -1.26 -4.84 120.64 113.86 1fzr n GLU 87 Ca -0.01 0.06 -0.36 0.00 -0.01 0.00 0.00 57.16 56.84 1fzr n GLU 87 Cb 0.50 -1.56 -0.06 0.00 -1.01 0.00 0.00 31.44 29.32 1fzr n GLU 87 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1fzr s LEU 88 N -3.30 4.39 -0.58 -4.62 1.43 0.32 -4.87 118.68 111.46 1fzr s LEU 88 Ca 0.13 0.51 -0.13 0.00 -1.03 0.00 0.00 54.13 53.61 1fzr s LEU 88 Cb 0.17 -2.37 0.14 0.00 0.03 0.00 0.00 46.19 44.17 1fzr s LEU 88 CO 0.53 0.33 0.50 -0.62 0.23 0.00 0.00 176.35 177.32 1fzr s ASP 89 N -1.39 6.09 -0.16 2.29 -1.08 -1.26 -5.04 116.67 116.13 1fzr s ASP 89 Ca 0.21 -2.05 -0.01 0.00 -0.52 0.00 0.00 52.55 50.18 1fzr s ASP 89 Cb -0.13 -2.13 -0.01 0.00 -1.46 0.00 0.00 42.92 39.19 1fzr s ASP 89 CO 0.11 -0.73 -0.12 -0.63 0.52 0.00 0.00 175.17 174.32 1fzr s ILE 90 N 1.17 2.99 0.33 4.11 1.01 -1.26 -0.30 121.20 129.25 1fzr s ILE 90 Ca 0.07 -0.66 0.05 0.00 0.00 0.00 0.00 60.65 60.12 1fzr s ILE 90 Cb -0.25 -2.28 -0.07 0.00 0.01 0.00 0.00 42.46 39.87 1fzr s ILE 90 CO -0.01 0.50 0.01 -0.13 0.00 0.00 0.00 174.94 175.31 1fzr s ARG 91 N 0.78 1.69 -0.02 2.79 0.52 0.06 -4.54 118.95 120.23 1fzr s ARG 91 Ca -0.05 -1.91 0.04 0.00 -0.52 0.00 0.00 55.73 53.29 1fzr s ARG 91 Cb -0.15 -1.13 -0.01 0.00 0.52 0.00 0.00 34.95 34.18 1fzr s ARG 91 CO 0.01 -0.08 -0.15 0.42 0.02 0.00 0.00 175.30 175.52 1fzr s ILE 92 N -3.07 1.22 -0.29 1.52 1.01 -0.64 -1.20 121.20 119.74 1fzr s ILE 92 Ca 0.34 -0.63 -0.04 0.00 0.00 0.00 0.00 60.65 60.32 1fzr s ILE 92 Cb 0.07 -1.04 0.03 0.00 0.01 0.00 0.00 42.46 41.54 1fzr s ILE 92 CO 0.15 0.35 0.02 -0.69 0.00 0.00 0.00 174.94 174.77 1fzr s VAL 93 N -0.13 3.33 0.33 2.92 1.01 -0.24 -1.48 120.40 126.14 1fzr s VAL 93 Ca 0.01 -1.09 0.02 0.00 0.00 0.00 0.00 61.98 60.92 1fzr s VAL 93 Cb -0.08 -2.81 -0.03 0.00 0.00 0.00 0.00 36.38 33.46 1fzr s VAL 93 CO 0.01 -0.00 0.51 -0.36 0.00 0.00 0.00 175.10 175.25 1fzr s PHE 94 N 1.35 3.44 0.14 5.22 0.40 -0.14 -1.69 117.98 126.71 1fzr s PHE 94 Ca -0.01 0.22 -0.12 0.00 -0.60 0.00 0.00 56.93 56.42 1fzr s PHE 94 Cb -0.18 -1.86 -0.04 0.00 0.51 0.00 0.00 43.02 41.45 1fzr s PHE 94 CO -0.00 0.14 1.48 0.77 0.70 0.00 0.00 175.22 178.31 1fzr h SER 95 N 0.83 0.96 -2.55 1.36 0.02 -1.57 0.14 113.55 112.74 1fzr h SER 95 Ca -0.50 -0.45 -0.02 0.00 -0.84 0.00 0.00 61.79 59.99 1fzr h SER 95 Cb 1.23 -0.27 -0.24 0.00 0.14 0.00 0.00 62.40 63.26 1fzr h SER 95 CO 0.60 1.21 -0.20 -0.55 -1.14 0.00 0.00 176.83 176.75 1fzr s SER 96 N -6.75 -0.73 0.00 3.07 0.15 -1.26 -4.34 113.70 103.84 1fzr s SER 96 Ca -0.11 1.28 0.30 0.00 0.70 0.00 0.00 55.95 58.11 1fzr s SER 96 Cb 0.11 1.59 1.41 0.00 -1.71 0.00 0.00 66.02 67.41 1fzr s SER 96 CO 0.87 -0.22 1.95 -1.54 1.20 0.00 0.00 173.24 175.49 1fzr n SER 97 N 5.02 0.87 0.17 5.45 3.41 -1.26 -3.75 113.62 123.53 1fzr n SER 97 Ca -0.14 -1.28 0.06 0.00 -0.26 0.00 0.00 58.87 57.25 1fzr n SER 97 Cb 0.52 -0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.59 1fzr n SER 97 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1fzr h ARG 98 N 1.36 0.00 -6.47 4.33 3.08 -1.96 -1.14 114.38 113.58 1fzr h ARG 98 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 1fzr h ARG 98 Cb 0.29 0.00 0.11 0.00 0.08 0.00 0.00 29.97 30.45 1fzr h ARG 98 CO 0.00 0.31 0.14 2.41 -1.07 0.00 0.00 179.97 181.76 1fzr n THR 99 N -3.20 1.96 -2.77 2.04 -1.04 -1.25 -4.63 114.28 105.40 1fzr n THR 99 Ca 0.02 -0.49 -0.33 0.00 -2.04 0.00 0.00 64.05 61.21 1fzr n THR 99 Cb 0.64 -1.01 -0.06 0.00 -1.82 0.00 0.00 70.33 68.08 1fzr n THR 99 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1fzr s LYS 100 N -1.52 4.18 0.44 -2.82 -0.14 -1.26 -0.95 119.74 117.67 1fzr s LYS 100 Ca 0.59 1.17 0.20 0.00 -1.36 0.00 0.00 55.97 56.57 1fzr s LYS 100 Cb -0.70 -2.20 1.16 0.00 -1.68 0.00 0.00 37.83 34.42 1fzr s LYS 100 CO 0.60 -0.08 1.87 -0.07 -0.76 0.00 0.00 175.35 176.90 1fzr h LEU 101 N 1.91 0.32 -7.00 3.17 3.38 -1.33 -3.44 115.31 112.33 1fzr h LEU 101 Ca -0.49 0.03 0.09 0.00 0.09 0.00 0.00 57.88 57.60 1fzr h LEU 101 Cb 1.19 -0.03 -0.20 0.00 0.09 0.00 0.00 40.66 41.72 1fzr h LEU 101 CO 0.61 0.13 0.51 -0.72 0.09 0.00 0.00 178.44 179.06 1fzr s TYR 102 N -5.34 -0.37 0.00 1.13 -0.85 -1.26 -4.84 117.35 105.82 1fzr s TYR 102 Ca -0.08 0.49 0.00 0.00 -0.52 0.00 0.00 57.07 56.96 1fzr s TYR 102 Cb 0.22 0.48 0.00 0.00 0.38 0.00 0.00 41.96 43.05 1fzr s TYR 102 CO 0.78 -0.43 0.00 0.36 -1.52 0.00 0.00 175.55 174.74 1fzr n LYS 103 N 0.34 0.00 -0.35 -3.49 -0.00 -1.26 0.67 118.16 114.07 1fzr n LYS 103 Ca -0.10 0.00 -0.06 0.00 -0.00 0.00 0.00 58.31 58.15 1fzr n LYS 103 Cb 0.59 0.00 0.06 0.00 -0.00 0.00 0.00 35.03 35.69 1fzr n LYS 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1fzr n GLY 104 N -0.05 2.63 3.83 2.58 0.00 -1.26 -4.93 105.19 107.99 1fzr n GLY 104 Ca 0.00 -0.32 -0.36 0.00 0.00 0.00 0.00 46.02 45.34 1fzr n GLY 104 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1fzr s SER 105 N 0.23 6.97 0.17 1.61 0.15 0.21 -4.97 113.70 118.07 1fzr s SER 105 Ca 0.17 1.27 0.22 0.00 0.70 0.00 0.00 55.95 58.32 1fzr s SER 105 Cb 0.14 -2.36 -0.05 0.00 -1.71 0.00 0.00 66.02 62.04 1fzr s SER 105 CO 0.04 0.08 0.97 -0.81 1.20 0.00 0.00 173.24 174.71 1fzr n PRO 106 N 0.83 0.61 -3.33 5.44 -0.04 -1.26 -4.76 135.00 132.48 1fzr n PRO 106 Ca -0.04 0.09 -0.38 0.00 -0.04 0.00 0.00 63.50 63.13 1fzr n PRO 106 Cb 0.51 -1.79 -0.06 0.00 -0.04 0.00 0.00 33.50 32.12 1fzr n PRO 106 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1fzr s THR 107 N -3.36 5.02 0.41 0.52 -1.32 -1.26 -5.01 115.64 110.63 1fzr s THR 107 Ca -0.01 1.02 0.08 0.00 -1.21 0.00 0.00 61.69 61.57 1fzr s THR 107 Cb 0.10 -3.83 0.00 0.00 -1.51 0.00 0.00 72.50 67.27 1fzr s THR 107 CO 0.80 0.45 0.53 -0.94 -2.21 0.00 0.00 174.62 173.25 1fzr s SER 108 N -0.25 5.62 0.19 8.08 1.04 -1.26 -0.93 113.70 126.19 1fzr s SER 108 Ca 0.27 -0.43 -0.12 0.00 0.48 0.00 0.00 55.95 56.15 1fzr s SER 108 Cb -0.17 -0.73 0.22 0.00 0.10 0.00 0.00 66.02 65.45 1fzr s SER 108 CO 0.14 -0.70 1.71 1.88 0.98 0.00 0.00 173.24 177.25 1fzr h TYR 109 N 0.73 0.15 -0.57 5.02 0.99 -0.90 -0.29 116.97 122.10 1fzr h TYR 109 Ca -0.41 0.03 0.02 0.00 2.00 0.00 0.00 58.73 60.38 1fzr h TYR 109 Cb 1.27 0.01 -0.04 0.00 1.00 0.00 0.00 36.73 38.98 1fzr h TYR 109 CO 0.42 -0.03 0.35 0.78 -0.00 0.00 0.00 178.16 179.69 1fzr h GLY 110 N 0.23 0.82 1.05 3.88 0.00 -1.49 0.10 103.07 107.66 1fzr h GLY 110 Ca 0.27 -0.27 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 1fzr h GLY 110 CO -0.36 0.23 0.27 0.83 0.00 0.00 0.00 176.54 177.51 1fzr h GLU 111 N 0.71 1.16 -0.15 4.80 5.08 -1.65 0.17 114.58 124.69 1fzr h GLU 111 Ca 0.23 -0.23 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1fzr h GLU 111 Cb 0.00 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.05 1fzr h GLU 111 CO -0.09 0.97 0.01 0.35 -1.00 0.00 0.00 179.01 179.24 1fzr h PHE 112 N 1.12 0.00 -0.83 4.33 3.57 -0.21 0.15 116.94 125.07 1fzr h PHE 112 Ca 0.25 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.74 1fzr h PHE 112 Cb 0.27 0.02 -0.04 0.00 2.79 0.00 0.00 35.95 38.99 1fzr h PHE 112 CO 0.02 -0.01 0.45 0.00 -2.23 0.00 0.00 178.31 176.54 1fzr h GLU 114 N 1.16 0.05 -0.82 0.00 5.08 0.04 0.40 114.58 120.49 1fzr h GLU 114 Ca 0.29 -0.01 0.10 0.00 -1.00 0.00 0.00 59.36 58.75 1fzr h GLU 114 Cb 0.03 -0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.19 1fzr h GLU 114 CO -0.05 0.13 0.46 -0.22 -1.00 0.00 0.00 179.01 178.34 1fzr h LYS 115 N -0.05 0.75 -0.61 2.33 3.64 -0.31 -2.48 116.57 119.83 1fzr h LYS 115 Ca 0.01 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1fzr h LYS 115 Cb 0.10 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 1fzr h LYS 115 CO -0.00 0.49 0.00 0.72 -2.27 0.00 0.00 179.45 178.39 1fzr n HIS 116 N -4.76 0.81 -1.79 1.91 8.25 -0.84 -4.95 115.22 113.85 1fzr n HIS 116 Ca 0.14 -0.40 -0.11 0.00 -0.26 0.00 0.00 57.72 57.09 1fzr n HIS 116 Cb 0.29 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.38 1fzr n HIS 116 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1fzr n GLY 117 N 1.47 0.51 3.71 -1.41 0.00 -0.30 -5.01 105.19 104.16 1fzr n GLY 117 Ca 0.20 -0.49 -0.39 0.00 0.00 0.00 0.00 46.02 45.34 1fzr n GLY 117 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fzr s ILE 118 N -2.46 5.07 0.09 -0.61 1.01 0.13 -5.01 121.20 119.42 1fzr s ILE 118 Ca 0.00 1.28 -0.29 0.00 0.00 0.00 0.00 60.65 61.65 1fzr s ILE 118 Cb 0.00 -3.97 -0.06 0.00 0.01 0.00 0.00 42.46 38.44 1fzr s ILE 118 CO 0.00 0.24 0.91 -0.54 0.00 0.00 0.00 174.94 175.55 1fzr s LYS 119 N 1.00 4.65 0.23 2.79 1.02 -1.26 -4.41 119.74 123.75 1fzr s LYS 119 Ca 0.33 1.36 -0.12 0.00 0.02 0.00 0.00 55.97 57.56 1fzr s LYS 119 Cb -0.17 -3.37 -0.01 0.00 -0.52 0.00 0.00 37.83 33.76 1fzr s LYS 119 CO 0.15 0.23 0.43 -0.59 -0.92 0.00 0.00 175.35 174.65 1fzr s PHE 120 N -0.01 0.39 0.35 3.18 -0.12 -1.26 -1.63 117.98 118.88 1fzr s PHE 120 Ca 0.45 -0.74 -0.13 0.00 -0.05 0.00 0.00 56.93 56.46 1fzr s PHE 120 Cb -0.23 0.12 0.03 0.00 -0.63 0.00 0.00 43.02 42.31 1fzr s PHE 120 CO 0.28 -0.92 0.68 0.00 -0.05 0.00 0.00 175.22 175.21 1fzr s ALA 121 N -4.01 -0.43 0.15 1.99 0.00 -0.55 -4.97 121.76 113.95 1fzr s ALA 121 Ca 0.22 -0.87 0.10 0.00 0.00 0.00 0.00 51.96 51.41 1fzr s ALA 121 Cb 0.00 0.84 -0.04 0.00 0.00 0.00 0.00 23.12 23.92 1fzr s ALA 121 CO 0.07 -0.94 -0.19 -0.51 0.00 0.00 0.00 175.76 174.19 1fzr s ASP 122 N -3.08 3.76 0.00 0.00 -0.00 -1.26 -0.96 116.67 115.13 1fzr s ASP 122 Ca 0.19 -0.68 0.00 0.00 -0.00 0.00 0.00 52.55 52.06 1fzr s ASP 122 Cb -0.04 -0.46 0.00 0.00 -0.00 0.00 0.00 42.92 42.42 1fzr s ASP 122 CO 0.13 0.15 0.00 0.29 -0.00 0.00 0.00 175.17 175.73 1fzr n LYS 123 N 0.50 0.00 -4.21 8.23 5.02 0.49 -4.70 118.16 123.49 1fzr n LYS 123 Ca -0.14 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.03 1fzr n LYS 123 Cb 0.54 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.45 1fzr n LYS 123 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1fzr s LEU 124 N 0.00 2.04 -0.16 -0.35 2.01 -1.26 -4.98 118.68 115.98 1fzr s LEU 124 Ca 0.00 -1.18 -0.29 0.00 0.01 0.00 0.00 54.13 52.67 1fzr s LEU 124 Cb 0.00 0.05 -0.01 0.00 0.01 0.00 0.00 46.19 46.24 1fzr s LEU 124 CO 0.00 -0.61 1.16 -0.63 1.01 0.00 0.00 176.35 177.27 1fzr s ILE 125 N -3.77 4.45 0.51 -0.59 1.01 -1.26 -4.88 121.20 116.68 1fzr s ILE 125 Ca 0.23 1.75 -0.23 0.00 0.00 0.00 0.00 60.65 62.41 1fzr s ILE 125 Cb 0.07 -4.13 -0.06 0.00 0.01 0.00 0.00 42.46 38.34 1fzr s ILE 125 CO 0.03 -0.11 1.29 -2.65 0.00 0.00 0.00 174.94 173.50 1fzr n PRO 126 N 6.08 1.69 -0.36 2.79 -0.02 -1.26 -4.91 135.00 139.01 1fzr n PRO 126 Ca 0.12 0.62 -0.02 0.00 -2.02 0.00 0.00 63.50 62.19 1fzr n PRO 126 Cb 0.46 -2.48 0.10 0.00 -0.02 0.00 0.00 33.50 31.56 1fzr n PRO 126 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1fzr h ALA 127 N 1.54 1.21 -0.70 3.55 0.00 -2.01 -2.04 119.26 120.81 1fzr h ALA 127 Ca -0.50 -0.07 0.12 0.00 0.00 0.00 0.00 54.91 54.46 1fzr h ALA 127 Cb 1.31 -0.39 -0.05 0.00 0.00 0.00 0.00 17.79 18.67 1fzr h ALA 127 CO 0.57 0.60 0.47 0.93 0.00 0.00 0.00 179.25 181.82 1fzr h GLU 128 N 1.29 0.47 -0.13 0.00 3.07 -1.99 -2.17 114.58 115.13 1fzr h GLU 128 Ca 0.35 -0.03 -0.01 0.00 -0.50 0.00 0.00 59.36 59.17 1fzr h GLU 128 Cb -0.14 -0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 27.65 1fzr h GLU 128 CO -0.08 0.31 0.04 -1.49 -1.40 0.00 0.00 179.01 176.39 1fzr h TRP 129 N 0.48 0.21 0.00 4.33 4.06 -1.73 -2.82 115.95 120.48 1fzr h TRP 129 Ca 0.33 -0.02 -0.02 0.00 2.06 0.00 0.00 58.89 61.24 1fzr h TRP 129 Cb 0.64 -0.06 -0.00 0.00 -1.00 0.00 0.00 29.16 28.73 1fzr h TRP 129 CO -0.00 0.33 -0.11 0.82 -3.56 0.00 0.00 178.44 175.92 1fzr h ILE 130 N 0.02 0.56 -0.00 1.49 2.04 -1.38 -2.46 117.51 117.79 1fzr h ILE 130 Ca 0.04 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 65.42 1fzr h ILE 130 Cb 0.22 1.31 0.00 0.00 -0.74 0.00 0.00 36.82 37.62 1fzr h ILE 130 CO -0.00 0.11 -0.32 0.29 0.00 0.00 0.00 178.15 178.23 1fzr n LYS 131 N -3.66 0.17 -1.55 2.37 5.02 -0.96 -4.90 118.16 114.65 1fzr n LYS 131 Ca -0.02 -0.08 -0.36 0.00 -2.02 0.00 0.00 58.31 55.83 1fzr n LYS 131 Cb 0.22 -1.50 0.08 0.00 -0.02 0.00 0.00 35.03 33.82 1fzr n LYS 131 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1fzr n GLU 132 N -1.34 0.84 -1.69 1.97 1.02 -0.93 -4.90 120.64 115.60 1fzr n GLU 132 Ca 0.08 0.35 -0.44 0.00 -0.02 0.00 0.00 57.16 57.13 1fzr n GLU 132 Cb 0.33 -2.48 -0.03 0.00 -0.02 0.00 0.00 31.44 29.24 1fzr n GLU 132 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1fzr n PRO 133 N -2.22 2.61 -1.73 3.49 -0.02 -1.26 -4.88 135.00 130.99 1fzr n PRO 133 Ca 0.15 0.95 -0.40 0.00 -2.02 0.00 0.00 63.50 62.17 1fzr n PRO 133 Cb 0.49 -2.80 0.02 0.00 -0.02 0.00 0.00 33.50 31.18 1fzr n PRO 133 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1fzr n LYS 134 N 4.84 2.09 -4.33 -0.52 4.81 -1.26 -4.93 118.16 118.84 1fzr n LYS 134 Ca 0.18 0.74 -0.19 0.00 -0.87 0.00 0.00 58.31 58.17 1fzr n LYS 134 Cb 0.34 -2.51 -0.10 0.00 0.02 0.00 0.00 35.03 32.78 1fzr n LYS 134 CO 0.00 0.00 0.00 -1.59 1.17 0.00 0.00 177.40 176.98 1fzr s LYS 135 N -2.34 1.29 -0.03 1.64 -2.85 0.10 -4.99 119.74 112.56 1fzr s LYS 135 Ca 0.61 -1.53 -0.27 0.00 -1.00 0.00 0.00 55.97 53.78 1fzr s LYS 135 Cb -0.48 -1.14 -0.03 0.00 -2.06 0.00 0.00 37.83 34.12 1fzr s LYS 135 CO 0.58 0.20 0.85 -1.83 0.10 0.00 0.00 175.35 175.25 1fzr s GLU 136 N -3.41 4.50 -0.29 1.78 -1.05 -1.26 -4.17 118.70 114.80 1fzr s GLU 136 Ca 0.20 1.18 -0.10 0.00 -0.15 0.00 0.00 54.97 56.10 1fzr s GLU 136 Cb -0.02 -3.46 -0.03 0.00 -0.44 0.00 0.00 34.13 30.18 1fzr s GLU 136 CO 0.06 -0.00 0.16 0.08 0.95 0.00 0.00 175.26 176.51 1fzr s VAL 137 N 0.94 4.92 -1.15 1.83 1.01 -1.26 -5.01 120.40 121.67 1fzr s VAL 137 Ca 0.45 -0.10 -0.20 0.00 0.00 0.00 0.00 61.98 62.13 1fzr s VAL 137 Cb -0.19 -3.40 -0.05 0.00 0.00 0.00 0.00 36.38 32.74 1fzr s VAL 137 CO 0.23 0.19 1.92 -0.81 0.00 0.00 0.00 175.10 176.63 1fzr n PRO 138 N 5.02 2.11 0.22 2.72 -0.04 -1.26 -4.73 135.00 139.05 1fzr n PRO 138 Ca -0.14 -2.54 0.14 0.00 -0.04 0.00 0.00 63.50 60.91 1fzr n PRO 138 Cb 0.51 -3.44 0.74 0.00 -0.04 0.00 0.00 33.50 31.27 1fzr n PRO 138 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1fzr h PHE 139 N 8.35 0.00 -0.18 0.54 -1.00 -1.95 -0.95 116.94 121.75 1fzr h PHE 139 Ca 0.36 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 61.04 1fzr h PHE 139 Cb 0.83 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.37 1fzr h PHE 139 CO 1.30 0.00 -0.34 0.38 -1.61 0.00 0.00 178.31 178.04 1fzr h ASP 140 N 0.00 0.38 -0.02 2.17 2.03 -2.03 -2.04 116.42 116.92 1fzr h ASP 140 Ca 0.00 -0.15 0.00 0.00 -0.73 0.00 0.00 57.03 56.15 1fzr h ASP 140 Cb 0.15 -0.11 0.00 0.00 -0.83 0.00 0.00 39.33 38.54 1fzr h ASP 140 CO 0.00 0.71 0.00 0.54 -1.03 0.00 0.00 179.24 179.46 1fzr n ARG 141 N -4.07 1.08 -4.45 4.15 1.74 -0.36 -4.84 116.66 109.92 1fzr n ARG 141 Ca -0.01 -0.12 -0.24 0.00 -0.77 0.00 0.00 57.85 56.71 1fzr n ARG 141 Cb 0.45 -1.32 -0.10 0.00 -1.02 0.00 0.00 32.46 30.47 1fzr n ARG 141 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1fzr s LEU 142 N -1.61 2.56 0.13 0.55 1.02 -0.77 -5.13 118.68 115.44 1fzr s LEU 142 Ca 0.30 -1.00 0.07 0.00 0.02 0.00 0.00 54.13 53.52 1fzr s LEU 142 Cb 0.14 -1.06 -0.04 0.00 0.02 0.00 0.00 46.19 45.24 1fzr s LEU 142 CO 0.23 0.03 -0.08 -1.59 0.02 0.00 0.00 176.35 174.96 1fzr s LYS 143 N -3.40 2.16 0.52 1.70 -2.85 -1.26 -4.97 119.74 111.63 1fzr s LYS 143 Ca 0.28 -1.08 0.07 0.00 -1.00 0.00 0.00 55.97 54.23 1fzr s LYS 143 Cb -0.05 -2.29 0.05 0.00 -2.06 0.00 0.00 37.83 33.48 1fzr s LYS 143 CO 0.13 0.49 0.71 0.50 0.10 0.00 0.00 175.35 177.28 1fzr s ARG 144 N -2.43 2.51 0.00 1.78 3.52 -1.26 -5.17 118.95 117.90 1fzr s ARG 144 Ca 0.23 -1.30 0.26 0.00 -0.13 0.00 0.00 55.73 54.79 1fzr s ARG 144 Cb -0.10 -2.65 0.60 0.00 -1.56 0.00 0.00 34.95 31.23 1fzr s ARG 144 CO 0.15 -0.63 1.49 0.36 -0.81 0.00 0.00 175.30 175.85