#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1woq s ALA 12 N 0.00 3.90 0.84 5.41 0.00 -1.26 -5.04 121.76 125.61 1woq s ALA 12 Ca 0.00 -0.87 -0.11 0.00 0.00 0.00 0.00 51.96 50.97 1woq s ALA 12 Cb 0.00 -1.91 0.10 0.00 0.00 0.00 0.00 23.12 21.30 1woq s ALA 12 CO 0.00 0.55 1.09 -2.14 0.00 0.00 0.00 175.76 175.26 1woq s PRO 13 N -3.12 1.72 0.01 0.00 0.02 -1.26 -4.81 135.00 127.57 1woq s PRO 13 Ca 0.37 0.74 0.01 0.00 0.02 0.00 0.00 61.00 62.14 1woq s PRO 13 Cb -0.11 -1.87 -0.01 0.00 0.02 0.00 0.00 34.50 32.53 1woq s PRO 13 CO 0.28 -1.90 -0.05 -0.51 -0.33 0.00 0.00 177.00 174.49 1woq s LEU 14 N -5.98 2.11 0.07 -5.54 1.43 -0.39 -4.61 118.68 105.76 1woq s LEU 14 Ca 0.62 -0.26 -0.30 0.00 -1.03 0.00 0.00 54.13 53.16 1woq s LEU 14 Cb -0.16 -0.17 -0.05 0.00 0.03 0.00 0.00 46.19 45.84 1woq s LEU 14 CO 0.55 -0.06 0.95 -0.63 0.23 0.00 0.00 176.35 177.40 1woq s ILE 15 N -0.61 4.65 -0.07 -0.59 1.01 -1.26 -0.04 121.20 124.29 1woq s ILE 15 Ca -0.03 2.03 0.05 0.00 0.00 0.00 0.00 60.65 62.69 1woq s ILE 15 Cb -0.05 -4.30 -0.00 0.00 0.01 0.00 0.00 42.46 38.11 1woq s ILE 15 CO -0.00 0.26 -0.21 -0.83 0.00 0.00 0.00 174.94 174.16 1woq s GLY 16 N 0.36 1.16 -0.07 6.18 0.00 -0.24 -1.97 107.32 112.74 1woq s GLY 16 Ca 0.48 -0.87 0.05 0.00 0.00 0.00 0.00 44.72 44.38 1woq s GLY 16 CO 0.29 -0.40 -0.24 -0.42 0.00 0.00 0.00 173.10 172.32 1woq s ILE 17 N 0.12 2.08 -0.25 0.90 -1.09 0.79 -1.54 121.20 122.22 1woq s ILE 17 Ca -0.09 -1.05 0.01 0.00 -2.23 0.00 0.00 60.65 57.29 1woq s ILE 17 Cb -0.15 -1.76 0.04 0.00 -1.58 0.00 0.00 42.46 39.01 1woq s ILE 17 CO 0.05 0.57 -0.10 -0.62 -1.23 0.00 0.00 174.94 173.61 1woq s ASP 18 N -0.02 4.20 -0.41 3.58 2.15 0.99 -0.69 116.67 126.48 1woq s ASP 18 Ca -0.08 -1.08 -0.24 0.00 0.43 0.00 0.00 52.55 51.59 1woq s ASP 18 Cb -0.15 -1.59 0.02 0.00 -0.30 0.00 0.00 42.92 40.90 1woq s ASP 18 CO 0.05 -0.14 0.81 -0.63 -0.17 0.00 0.00 175.17 175.09 1woq s ILE 19 N 1.22 4.66 0.48 4.11 1.01 -1.24 -1.88 121.20 129.57 1woq s ILE 19 Ca -0.03 0.73 0.06 0.00 0.00 0.00 0.00 60.65 61.41 1woq s ILE 19 Cb -0.18 -4.28 -0.01 0.00 0.01 0.00 0.00 42.46 38.00 1woq s ILE 19 CO -0.06 -0.59 0.25 -0.83 0.00 0.00 0.00 174.94 173.71 1woq s GLY 20 N 2.00 2.44 0.41 6.18 0.00 -0.78 -4.45 107.32 113.12 1woq s GLY 20 Ca 0.32 -1.51 0.21 0.00 0.00 0.00 0.00 44.72 43.75 1woq s GLY 20 CO 0.20 -1.95 1.79 -1.33 0.00 0.00 0.00 173.10 171.81 1woq h GLY 21 N 1.13 0.00 0.00 0.20 0.00 -1.96 -3.34 103.07 99.10 1woq h GLY 21 Ca -0.41 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 46.85 1woq h GLY 21 CO 0.65 0.00 -1.33 -1.30 0.00 0.00 0.00 176.54 174.56 1woq n THR 22 N -3.48 0.28 -3.77 4.70 -2.24 -1.26 -4.78 114.28 103.73 1woq n THR 22 Ca -0.00 -0.20 -0.13 0.00 -2.27 0.00 0.00 64.05 61.45 1woq n THR 22 Cb 0.46 -0.63 -0.09 0.00 -2.10 0.00 0.00 70.33 67.97 1woq n THR 22 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1woq s GLY 23 N -3.43 -0.12 -0.31 3.38 0.00 -1.26 -0.88 107.32 104.70 1woq s GLY 23 Ca -0.02 0.24 -0.07 0.00 0.00 0.00 0.00 44.72 44.87 1woq s GLY 23 CO 0.21 0.04 0.09 -0.42 0.00 0.00 0.00 173.10 173.02 1woq s ILE 24 N -1.43 3.91 0.03 0.90 1.01 0.56 -1.87 121.20 124.32 1woq s ILE 24 Ca -0.13 -0.82 0.04 0.00 0.00 0.00 0.00 60.65 59.74 1woq s ILE 24 Cb -0.05 -3.07 -0.04 0.00 0.01 0.00 0.00 42.46 39.31 1woq s ILE 24 CO 0.03 0.01 -0.06 -0.54 0.00 0.00 0.00 174.94 174.38 1woq s LYS 25 N 1.47 2.48 0.10 2.79 1.02 -0.79 -1.72 119.74 125.10 1woq s LYS 25 Ca 0.01 -0.79 0.00 0.00 0.02 0.00 0.00 55.97 55.22 1woq s LYS 25 Cb -0.18 -2.48 -0.04 0.00 -0.52 0.00 0.00 37.83 34.61 1woq s LYS 25 CO 0.02 0.58 -0.02 0.20 -0.92 0.00 0.00 175.35 175.21 1woq s GLY 26 N -1.69 0.78 -0.00 -3.33 0.00 0.38 -0.01 107.32 103.44 1woq s GLY 26 Ca 0.19 -1.36 -0.28 0.00 0.00 0.00 0.00 44.72 43.27 1woq s GLY 26 CO 0.10 -1.40 0.76 -0.32 0.00 0.00 0.00 173.10 172.24 1woq s GLY 27 N -3.02 -0.51 -0.31 0.20 0.00 -0.59 -0.58 107.32 102.50 1woq s GLY 27 Ca 0.14 1.15 -0.20 0.00 0.00 0.00 0.00 44.72 45.82 1woq s GLY 27 CO -0.04 0.62 0.62 -0.42 0.00 0.00 0.00 173.10 173.88 1woq s ILE 28 N -2.29 4.94 -0.18 0.90 1.01 -1.26 -1.08 121.20 123.24 1woq s ILE 28 Ca -0.03 0.79 -0.08 0.00 0.00 0.00 0.00 60.65 61.33 1woq s ILE 28 Cb -0.01 -4.00 -0.04 0.00 0.01 0.00 0.00 42.46 38.42 1woq s ILE 28 CO -0.02 -0.16 0.09 -0.69 0.00 0.00 0.00 174.94 174.17 1woq s VAL 29 N 2.60 5.09 -0.44 2.92 1.01 0.94 0.32 120.40 132.84 1woq s VAL 29 Ca 0.24 0.07 -0.16 0.00 0.00 0.00 0.00 61.98 62.14 1woq s VAL 29 Cb -0.15 -3.30 0.04 0.00 0.00 0.00 0.00 36.38 32.97 1woq s VAL 29 CO 0.12 0.46 0.39 -0.62 0.00 0.00 0.00 175.10 175.45 1woq s ASP 30 N 0.27 6.15 0.10 3.32 -1.08 -0.08 -1.26 116.67 124.10 1woq s ASP 30 Ca 0.06 -1.02 0.19 0.00 -0.52 0.00 0.00 52.55 51.26 1woq s ASP 30 Cb -0.12 -2.19 0.80 0.00 -1.46 0.00 0.00 42.92 39.96 1woq s ASP 30 CO -0.01 -0.58 1.60 0.18 0.52 0.00 0.00 175.17 176.88 1woq n LEU 31 N 5.34 0.28 0.04 -1.34 4.77 -1.26 0.04 117.00 124.88 1woq n LEU 31 Ca -0.10 0.56 -0.10 0.00 -0.03 0.00 0.00 56.01 56.34 1woq n LEU 31 Cb 0.46 -0.52 0.03 0.00 -2.33 0.00 0.00 43.42 41.06 1woq n LEU 31 CO 0.45 -0.34 0.36 0.11 -1.33 0.00 0.00 177.39 176.64 1woq h LYS 32 N 0.00 0.43 0.00 3.23 1.79 -1.95 -3.32 116.57 116.76 1woq h LYS 32 Ca 0.00 -0.35 0.00 0.00 -2.18 0.00 0.00 60.65 58.12 1woq h LYS 32 Cb 0.33 0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.05 1woq h LYS 32 CO 0.00 0.98 -1.02 1.63 -1.08 0.00 0.00 179.45 179.96 1woq n LYS 33 N -3.85 1.85 -2.85 3.15 5.02 -1.08 -5.00 118.16 115.40 1woq n LYS 33 Ca -0.04 -0.05 -0.13 0.00 -2.02 0.00 0.00 58.31 56.06 1woq n LYS 33 Cb 0.70 -1.15 0.03 0.00 -0.02 0.00 0.00 35.03 34.59 1woq n LYS 33 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1woq n GLY 34 N 1.55 0.02 3.16 0.72 0.00 0.11 -5.02 105.19 105.72 1woq n GLY 34 Ca 0.00 -0.21 -0.12 0.00 0.00 0.00 0.00 46.02 45.69 1woq n GLY 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1woq s LYS 35 N -5.39 0.81 0.09 1.61 1.02 -1.10 -4.98 119.74 111.81 1woq s LYS 35 Ca 0.23 -1.24 -0.26 0.00 0.02 0.00 0.00 55.97 54.72 1woq s LYS 35 Cb -0.10 -0.29 -0.06 0.00 -0.52 0.00 0.00 37.83 36.85 1woq s LYS 35 CO 0.29 0.01 0.80 -0.51 -0.92 0.00 0.00 175.35 175.01 1woq s LEU 36 N -2.78 4.50 -0.40 3.17 1.02 -1.26 -0.90 118.68 122.04 1woq s LEU 36 Ca 0.08 1.56 -0.25 0.00 0.02 0.00 0.00 54.13 55.54 1woq s LEU 36 Cb 0.02 -3.30 0.02 0.00 0.02 0.00 0.00 46.19 42.95 1woq s LEU 36 CO -0.03 0.07 0.90 -0.76 0.02 0.00 0.00 176.35 176.55 1woq s LEU 37 N -0.41 4.03 0.00 1.79 1.43 0.15 -4.82 118.68 120.85 1woq s LEU 37 Ca 0.39 0.40 0.00 0.00 -1.03 0.00 0.00 54.13 53.88 1woq s LEU 37 Cb -0.22 -3.19 0.00 0.00 0.03 0.00 0.00 46.19 42.81 1woq s LEU 37 CO 0.25 -0.89 0.00 0.61 0.23 0.00 0.00 176.35 176.55 1woq n GLY 38 N 4.58 -1.67 3.94 -3.19 0.00 -1.26 -4.49 105.19 103.10 1woq n GLY 38 Ca 0.06 -1.50 -0.24 0.00 0.00 0.00 0.00 46.02 44.34 1woq n GLY 38 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1woq s GLU 39 N 0.00 3.26 0.35 1.61 0.41 -1.26 -4.99 118.70 118.09 1woq s GLU 39 Ca 0.00 -0.33 -0.14 0.00 -0.41 0.00 0.00 54.97 54.09 1woq s GLU 39 Cb 0.00 -2.56 -0.08 0.00 -1.78 0.00 0.00 34.13 29.71 1woq s GLU 39 CO 0.00 -0.13 0.76 -0.98 -0.49 0.00 0.00 175.26 174.41 1woq s ARG 40 N -4.51 3.95 -0.14 1.61 1.70 -1.26 -4.76 118.95 115.54 1woq s ARG 40 Ca 0.46 0.64 -0.01 0.00 -0.47 0.00 0.00 55.73 56.35 1woq s ARG 40 Cb -0.10 -2.40 -0.01 0.00 -0.57 0.00 0.00 34.95 31.87 1woq s ARG 40 CO 0.38 0.09 -0.12 0.12 -1.08 0.00 0.00 175.30 174.69 1woq s PHE 41 N -2.10 2.83 0.04 5.89 5.36 0.25 -4.95 117.98 125.30 1woq s PHE 41 Ca 0.54 -0.73 0.07 0.00 -0.96 0.00 0.00 56.93 55.85 1woq s PHE 41 Cb -0.10 -1.88 -0.03 0.00 -0.34 0.00 0.00 43.02 40.68 1woq s PHE 41 CO 0.21 -0.28 -0.21 0.50 -1.46 0.00 0.00 175.22 173.98 1woq s ARG 42 N 0.53 1.38 0.05 10.12 3.52 -1.26 -0.47 118.95 132.81 1woq s ARG 42 Ca -0.08 -0.94 0.03 0.00 -0.13 0.00 0.00 55.73 54.60 1woq s ARG 42 Cb -0.16 -1.49 -0.03 0.00 -1.56 0.00 0.00 34.95 31.72 1woq s ARG 42 CO 0.04 0.38 -0.09 0.14 -0.81 0.00 0.00 175.30 174.96 1woq s VAL 43 N -0.81 0.66 0.61 7.11 -7.23 -0.70 -4.99 120.40 115.06 1woq s VAL 43 Ca 0.07 -1.17 -0.19 0.00 -1.81 0.00 0.00 61.98 58.88 1woq s VAL 43 Cb -0.09 -0.76 -0.03 0.00 0.56 0.00 0.00 36.38 36.07 1woq s VAL 43 CO 0.02 -0.38 1.26 -2.84 -0.31 0.00 0.00 175.10 172.85 1woq s PRO 44 N -1.73 2.82 -0.10 4.82 0.02 -1.26 -0.32 135.00 139.25 1woq s PRO 44 Ca -0.07 1.96 -0.30 0.00 0.02 0.00 0.00 61.00 62.61 1woq s PRO 44 Cb -0.09 -1.92 -0.01 0.00 0.02 0.00 0.00 34.50 32.49 1woq s PRO 44 CO 0.01 -1.36 1.03 0.99 -0.33 0.00 0.00 177.00 177.33 1woq s THR 45 N -1.48 4.72 0.39 0.99 2.01 -0.06 -4.54 115.64 117.66 1woq s THR 45 Ca 0.79 1.99 -0.25 0.00 0.31 0.00 0.00 61.69 64.53 1woq s THR 45 Cb -0.34 -4.28 -0.12 0.00 0.01 0.00 0.00 72.50 67.77 1woq s THR 45 CO 0.37 0.01 0.88 -2.65 -0.69 0.00 0.00 174.62 172.53 1woq n PRO 46 N 5.00 1.10 -3.99 4.92 -0.02 -1.26 -4.90 135.00 135.85 1woq n PRO 46 Ca 0.09 0.39 -0.31 0.00 -2.02 0.00 0.00 63.50 61.66 1woq n PRO 46 Cb 0.48 -1.83 -0.16 0.00 -0.02 0.00 0.00 33.50 31.98 1woq n PRO 46 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1woq s GLN 47 N -1.78 1.93 0.80 -0.52 -1.52 -1.26 -1.96 119.66 115.34 1woq s GLN 47 Ca 0.62 -0.96 -0.12 0.00 -1.95 0.00 0.00 55.36 52.96 1woq s GLN 47 Cb -0.61 -2.54 0.07 0.00 -0.22 0.00 0.00 33.01 29.71 1woq s GLN 47 CO 0.58 -0.50 1.10 -1.25 -0.25 0.00 0.00 175.29 174.97 1woq s PRO 48 N 1.35 2.06 -1.14 2.91 0.04 -1.26 -5.06 135.00 133.90 1woq s PRO 48 Ca -0.04 0.56 -0.17 0.00 0.04 0.00 0.00 61.00 61.39 1woq s PRO 48 Cb -0.18 -1.92 0.13 0.00 0.04 0.00 0.00 34.50 32.57 1woq s PRO 48 CO -0.07 -1.62 1.43 0.00 0.04 0.00 0.00 177.00 176.78 1woq s ALA 49 N -3.21 3.55 0.33 8.56 0.00 -0.83 -4.86 121.76 125.31 1woq s ALA 49 Ca 0.61 -3.00 0.05 0.00 0.00 0.00 0.00 51.96 49.63 1woq s ALA 49 Cb -0.14 -4.27 -0.01 0.00 0.00 0.00 0.00 23.12 18.70 1woq s ALA 49 CO 0.54 -3.04 0.47 0.95 0.00 0.00 0.00 175.76 174.68 1woq s THR 50 N 2.82 4.32 0.22 0.00 -4.23 -1.26 -3.12 115.64 114.39 1woq s THR 50 Ca 0.43 -0.93 -0.07 0.00 -1.18 0.00 0.00 61.69 59.94 1woq s THR 50 Cb -0.01 -3.51 0.17 0.00 1.34 0.00 0.00 72.50 70.48 1woq s THR 50 CO -0.02 -0.22 1.75 -0.65 -0.54 0.00 0.00 174.62 174.94 1woq h PRO 51 N 0.89 0.44 0.47 3.99 0.11 -1.94 0.78 132.00 136.74 1woq h PRO 51 Ca -0.47 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.59 1woq h PRO 51 Cb 1.25 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1woq h PRO 51 CO 0.55 0.29 -0.23 1.49 -0.21 0.00 0.00 178.00 179.89 1woq h GLU 52 N 0.45 -0.61 -0.56 1.05 4.57 -1.98 -1.16 114.58 116.35 1woq h GLU 52 Ca 0.35 0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.55 1woq h GLU 52 Cb 0.45 0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 29.15 1woq h GLU 52 CO -0.33 -0.35 0.29 0.66 -1.18 0.00 0.00 179.01 178.10 1woq h SER 53 N -0.77 0.71 -0.75 1.04 4.64 -1.84 -2.45 113.55 114.13 1woq h SER 53 Ca -0.06 -0.11 -0.06 0.00 -0.47 0.00 0.00 61.79 61.09 1woq h SER 53 Cb 0.55 -0.18 -0.03 0.00 -0.31 0.00 0.00 62.40 62.42 1woq h SER 53 CO 0.11 0.62 0.25 0.58 -0.87 0.00 0.00 176.83 177.52 1woq h VAL 54 N 0.75 1.26 -0.87 0.95 2.07 -0.87 -1.76 116.25 117.78 1woq h VAL 54 Ca 0.19 -0.89 0.02 0.00 0.82 0.00 0.00 66.70 66.84 1woq h VAL 54 Cb 0.08 0.42 -0.05 0.00 -1.52 0.00 0.00 31.29 30.23 1woq h VAL 54 CO -0.03 0.35 0.57 0.00 0.02 0.00 0.00 177.57 178.48 1woq h ALA 55 N 1.13 1.12 -0.40 1.67 0.00 -0.96 0.13 119.26 121.95 1woq h ALA 55 Ca 0.24 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 1woq h ALA 55 Cb 0.29 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1woq h ALA 55 CO -0.01 0.46 0.13 0.93 0.00 0.00 0.00 179.25 180.76 1woq h GLU 56 N 1.13 0.61 -0.49 0.00 4.39 -1.03 -0.25 114.58 118.94 1woq h GLU 56 Ca 0.33 -0.13 -0.02 0.00 0.34 0.00 0.00 59.36 59.89 1woq h GLU 56 Cb -0.07 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.46 1woq h GLU 56 CO -0.09 0.60 0.24 0.00 -1.16 0.00 0.00 179.01 178.61 1woq h ALA 57 N 0.98 0.63 -0.66 3.43 0.00 -0.70 -1.08 119.26 121.87 1woq h ALA 57 Ca 0.13 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1woq h ALA 57 Cb 0.24 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1woq h ALA 57 CO -0.01 0.19 0.32 0.28 0.00 0.00 0.00 179.25 180.03 1woq h VAL 58 N 0.65 1.22 -0.92 0.00 2.07 -0.59 -2.13 116.25 116.55 1woq h VAL 58 Ca 0.17 -0.61 0.03 0.00 0.82 0.00 0.00 66.70 67.11 1woq h VAL 58 Cb 0.10 0.41 -0.05 0.00 -1.52 0.00 0.00 31.29 30.24 1woq h VAL 58 CO -0.02 0.25 0.60 0.00 0.02 0.00 0.00 177.57 178.42 1woq h ALA 59 N 1.15 1.21 -0.24 1.67 0.00 -0.61 -0.97 119.26 121.47 1woq h ALA 59 Ca 0.23 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1woq h ALA 59 Cb 0.10 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1woq h ALA 59 CO -0.03 0.48 0.10 1.25 0.00 0.00 0.00 179.25 181.06 1woq h LEU 60 N 1.18 0.32 -0.60 0.00 6.46 -0.73 0.14 115.31 122.08 1woq h LEU 60 Ca 0.36 -0.15 -0.02 0.00 -0.12 0.00 0.00 57.88 57.95 1woq h LEU 60 Cb -0.03 -0.08 -0.03 0.00 -0.73 0.00 0.00 40.66 39.79 1woq h LEU 60 CO -0.11 0.38 0.30 0.58 -0.62 0.00 0.00 178.44 178.97 1woq h VAL 61 N 0.24 1.21 -0.66 1.05 2.07 -1.04 -1.56 116.25 117.56 1woq h VAL 61 Ca 0.08 -0.56 -0.08 0.00 0.82 0.00 0.00 66.70 66.96 1woq h VAL 61 Cb 0.15 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.37 1woq h VAL 61 CO -0.01 0.23 0.12 0.58 0.02 0.00 0.00 177.57 178.51 1woq h VAL 62 N 0.82 1.26 -0.41 2.57 2.07 -1.02 -1.95 116.25 119.60 1woq h VAL 62 Ca 0.21 -1.02 -0.01 0.00 0.82 0.00 0.00 66.70 66.70 1woq h VAL 62 Cb 0.09 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1woq h VAL 62 CO -0.03 0.38 0.23 0.00 0.02 0.00 0.00 177.57 178.18 1woq h ALA 63 N 1.05 0.52 0.21 1.67 0.00 -0.67 0.10 119.26 122.13 1woq h ALA 63 Ca 0.20 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1woq h ALA 63 Cb 0.43 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1woq h ALA 63 CO 0.01 0.03 -0.15 1.49 0.00 0.00 0.00 179.25 180.63 1woq h GLU 64 N 0.53 -0.35 -0.70 0.00 4.57 -1.08 -2.60 114.58 114.95 1woq h GLU 64 Ca 0.14 0.02 -0.04 0.00 -1.18 0.00 0.00 59.36 58.30 1woq h GLU 64 Cb 0.04 0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 28.67 1woq h GLU 64 CO -0.02 -0.23 0.26 -0.07 -1.18 0.00 0.00 179.01 177.77 1woq h LEU 65 N -0.36 0.96 -1.97 1.64 3.38 -1.23 -2.52 115.31 115.20 1woq h LEU 65 Ca -0.01 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.81 1woq h LEU 65 Cb 0.32 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1woq h LEU 65 CO -0.00 0.87 0.00 0.28 0.09 0.00 0.00 178.44 179.68 1woq h SER 66 N 1.02 0.00 0.31 -0.43 0.02 -0.56 -2.09 113.55 111.82 1woq h SER 66 Ca 0.23 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 1woq h SER 66 Cb 0.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.76 1woq h SER 66 CO -0.02 0.00 -0.40 0.00 -1.14 0.00 0.00 176.83 175.28 1woq n ALA 67 N -1.97 3.36 -1.80 3.77 0.00 -0.95 -4.83 120.51 118.08 1woq n ALA 67 Ca -0.01 -0.41 -0.32 0.00 0.00 0.00 0.00 53.44 52.70 1woq n ALA 67 Cb 0.14 -1.09 -0.03 0.00 0.00 0.00 0.00 19.45 18.47 1woq n ALA 67 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1woq s ARG 68 N -2.71 3.83 0.24 0.00 0.52 -0.78 -4.98 118.95 115.07 1woq s ARG 68 Ca 0.18 1.04 -0.05 0.00 -0.52 0.00 0.00 55.73 56.37 1woq s ARG 68 Cb 0.18 -2.12 0.37 0.00 0.52 0.00 0.00 34.95 33.91 1woq s ARG 68 CO 0.61 -0.37 1.80 -1.35 0.02 0.00 0.00 175.30 176.00 1woq h PRO 69 N 0.91 0.70 -0.39 3.54 0.11 -1.92 -1.55 132.00 133.40 1woq h PRO 69 Ca -0.47 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1woq h PRO 69 Cb 1.19 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1woq h PRO 69 CO 0.60 0.46 0.00 -0.85 -0.21 0.00 0.00 178.00 178.01 1woq n GLU 70 N -4.79 1.61 -2.25 1.05 0.00 -1.26 -4.92 120.64 110.08 1woq n GLU 70 Ca 0.12 -0.73 -0.37 0.00 0.00 0.00 0.00 57.16 56.18 1woq n GLU 70 Cb 0.27 -1.31 -0.01 0.00 0.00 0.00 0.00 31.44 30.40 1woq n GLU 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1woq s ALA 71 N -1.66 2.89 1.09 -1.84 0.00 -0.58 -4.91 121.76 116.76 1woq s ALA 71 Ca 0.13 0.91 -0.17 0.00 0.00 0.00 0.00 51.96 52.83 1woq s ALA 71 Cb 0.08 -3.38 0.24 0.00 0.00 0.00 0.00 23.12 20.06 1woq s ALA 71 CO 0.08 -0.70 1.15 -0.35 0.00 0.00 0.00 175.76 175.94 1woq n PRO 72 N -0.72 -1.93 -1.59 0.00 -0.04 -1.26 -4.97 135.00 124.49 1woq n PRO 72 Ca 0.08 -1.80 -0.40 0.00 -0.04 0.00 0.00 63.50 61.35 1woq n PRO 72 Cb 0.49 -1.38 0.03 0.00 -0.04 0.00 0.00 33.50 32.60 1woq n PRO 72 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1woq n ALA 73 N -4.18 -0.01 -0.12 0.55 0.00 -1.26 -4.86 120.51 110.64 1woq n ALA 73 Ca -0.20 0.11 0.14 0.00 0.00 0.00 0.00 53.44 53.49 1woq n ALA 73 Cb 0.54 -2.05 0.51 0.00 0.00 0.00 0.00 19.45 18.44 1woq n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1woq h ALA 74 N 0.97 2.07 -0.73 0.00 0.00 -1.95 -1.99 119.26 117.62 1woq h ALA 74 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1woq h ALA 74 Cb 1.36 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1woq h ALA 74 CO 0.53 -0.23 0.00 0.41 0.00 0.00 0.00 179.25 179.96 1woq n GLY 75 N -1.52 2.53 3.75 0.00 0.00 -1.26 -4.96 105.19 103.73 1woq n GLY 75 Ca 0.12 -0.81 -0.37 0.00 0.00 0.00 0.00 46.02 44.95 1woq n GLY 75 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1woq s SER 76 N -0.99 5.38 0.58 1.61 1.04 -0.75 -4.59 113.70 115.98 1woq s SER 76 Ca 0.50 2.57 -0.19 0.00 0.48 0.00 0.00 55.95 59.31 1woq s SER 76 Cb 0.27 -2.62 -0.04 0.00 0.10 0.00 0.00 66.02 63.73 1woq s SER 76 CO 0.33 -1.48 1.18 -2.16 0.98 0.00 0.00 173.24 172.09 1woq s PRO 77 N -3.00 3.10 -0.06 4.02 0.04 -1.26 -4.64 135.00 133.20 1woq s PRO 77 Ca 0.72 1.76 0.05 0.00 0.04 0.00 0.00 61.00 63.57 1woq s PRO 77 Cb -0.35 -1.96 -0.01 0.00 0.04 0.00 0.00 34.50 32.22 1woq s PRO 77 CO 0.41 -1.08 -0.24 0.08 0.04 0.00 0.00 177.00 176.21 1woq s VAL 78 N -1.65 2.18 -0.09 -0.36 1.01 0.27 -4.45 120.40 117.31 1woq s VAL 78 Ca 0.76 -1.02 -0.12 0.00 0.00 0.00 0.00 61.98 61.60 1woq s VAL 78 Cb -0.28 -1.80 -0.05 0.00 0.00 0.00 0.00 36.38 34.25 1woq s VAL 78 CO 0.31 0.57 0.28 -0.83 0.00 0.00 0.00 175.10 175.43 1woq s GLY 79 N -0.14 2.28 -0.00 4.51 0.00 -0.83 -1.96 107.32 111.17 1woq s GLY 79 Ca -0.04 -0.44 0.01 0.00 0.00 0.00 0.00 44.72 44.26 1woq s GLY 79 CO 0.04 0.06 -0.04 0.14 0.00 0.00 0.00 173.10 173.30 1woq s VAL 80 N -0.56 0.32 0.29 1.40 1.01 -0.58 -0.15 120.40 122.14 1woq s VAL 80 Ca 0.18 -0.21 0.06 0.00 0.00 0.00 0.00 61.98 62.01 1woq s VAL 80 Cb -0.14 -0.28 -0.02 0.00 0.00 0.00 0.00 36.38 35.94 1woq s VAL 80 CO 0.07 0.07 0.41 0.42 0.00 0.00 0.00 175.10 176.07 1woq s THR 81 N -0.15 4.55 -0.18 3.92 -4.23 0.14 -1.30 115.64 118.39 1woq s THR 81 Ca 0.01 -1.01 -0.14 0.00 -1.18 0.00 0.00 61.69 59.37 1woq s THR 81 Cb -0.02 -3.59 0.05 0.00 1.34 0.00 0.00 72.50 70.29 1woq s THR 81 CO -0.00 -0.23 0.47 0.12 -0.54 0.00 0.00 174.62 174.43 1woq s PHE 82 N -2.10 -0.58 -1.19 3.99 5.36 -0.72 -3.64 117.98 119.10 1woq s PHE 82 Ca 0.40 1.33 -0.11 0.00 -0.96 0.00 0.00 56.93 57.59 1woq s PHE 82 Cb -0.09 0.24 -0.07 0.00 -0.34 0.00 0.00 43.02 42.76 1woq s PHE 82 CO 0.30 -0.30 2.35 -0.35 -1.46 0.00 0.00 175.22 175.76 1woq n PRO 83 N 3.40 2.59 -3.73 10.12 -0.04 -1.26 -1.68 135.00 144.40 1woq n PRO 83 Ca -0.17 -1.92 0.00 0.00 -0.04 0.00 0.00 63.50 61.37 1woq n PRO 83 Cb 0.56 -2.77 -0.00 0.00 -0.04 0.00 0.00 33.50 31.26 1woq n PRO 83 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1woq s GLY 84 N 3.27 -0.28 0.11 0.55 0.00 -1.26 -4.50 107.32 105.21 1woq s GLY 84 Ca 0.53 0.38 -0.31 0.00 0.00 0.00 0.00 44.72 45.31 1woq s GLY 84 CO -0.02 1.32 1.49 -0.42 0.00 0.00 0.00 173.10 175.47 1woq s ILE 85 N -2.46 3.09 -0.18 0.90 1.01 -1.26 -4.42 121.20 117.88 1woq s ILE 85 Ca 0.17 0.72 0.01 0.00 0.00 0.00 0.00 60.65 61.56 1woq s ILE 85 Cb 0.02 -3.46 0.02 0.00 0.01 0.00 0.00 42.46 39.05 1woq s ILE 85 CO -0.01 0.04 -0.19 -0.63 0.00 0.00 0.00 174.94 174.15 1woq s ILE 86 N 1.53 1.99 -0.10 2.92 -1.09 -1.26 -0.85 121.20 124.34 1woq s ILE 86 Ca 0.68 -0.93 -0.01 0.00 -2.23 0.00 0.00 60.65 58.16 1woq s ILE 86 Cb -0.39 -1.82 0.03 0.00 -1.58 0.00 0.00 42.46 38.69 1woq s ILE 86 CO 0.30 0.50 -0.06 -1.10 -1.23 0.00 0.00 174.94 173.35 1woq s GLN 87 N 1.31 1.34 -1.55 2.79 -0.21 -0.60 -4.78 119.66 117.96 1woq s GLN 87 Ca 0.04 -0.18 -0.12 0.00 0.02 0.00 0.00 55.36 55.12 1woq s GLN 87 Cb -0.13 -1.46 0.09 0.00 1.00 0.00 0.00 33.01 32.51 1woq s GLN 87 CO -0.12 -0.27 0.81 0.72 -2.12 0.00 0.00 175.29 174.31 1woq n HIS 88 N 4.97 -1.99 -0.97 0.91 8.25 -1.26 -1.05 115.22 124.08 1woq n HIS 88 Ca -0.12 0.84 0.00 0.00 -0.26 0.00 0.00 57.72 58.19 1woq n HIS 88 Cb 0.50 -3.66 0.00 0.00 1.12 0.00 0.00 29.99 27.95 1woq n HIS 88 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1woq n GLY 89 N -1.63 0.40 3.59 -1.41 0.00 -1.26 -4.96 105.19 99.91 1woq n GLY 89 Ca -0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 1woq n GLY 89 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1woq s VAL 90 N -1.92 3.73 -0.08 1.61 1.01 -0.22 -1.21 120.40 123.32 1woq s VAL 90 Ca 0.00 -0.50 -0.27 0.00 0.00 0.00 0.00 61.98 61.21 1woq s VAL 90 Cb 0.00 -2.53 -0.02 0.00 0.00 0.00 0.00 36.38 33.82 1woq s VAL 90 CO 0.00 0.58 0.88 -0.69 0.00 0.00 0.00 175.10 175.87 1woq s VAL 91 N -0.83 4.90 -0.55 2.92 1.01 -0.42 -1.56 120.40 125.86 1woq s VAL 91 Ca 0.13 1.80 0.05 0.00 0.00 0.00 0.00 61.98 63.96 1woq s VAL 91 Cb -0.11 -4.20 0.08 0.00 0.00 0.00 0.00 36.38 32.15 1woq s VAL 91 CO 0.02 0.12 0.84 1.41 0.00 0.00 0.00 175.10 177.49 1woq n HIS 92 N 4.42 0.08 -3.61 5.22 -0.00 -0.03 -0.33 115.22 120.97 1woq n HIS 92 Ca 0.04 -0.19 -0.16 0.00 -0.00 0.00 0.00 57.72 57.41 1woq n HIS 92 Cb 0.50 -0.02 -0.07 0.00 -0.00 0.00 0.00 29.99 30.40 1woq n HIS 92 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 1woq s SER 93 N -0.65 -0.56 -0.38 0.41 1.04 -1.26 -4.83 113.70 107.47 1woq s SER 93 Ca 0.08 0.77 0.12 0.00 0.48 0.00 0.00 55.95 57.39 1woq s SER 93 Cb 0.05 0.73 0.39 0.00 0.10 0.00 0.00 66.02 67.28 1woq s SER 93 CO 0.07 -0.45 1.02 0.00 0.98 0.00 0.00 173.24 174.86 1woq n ALA 94 N 1.59 1.73 -0.24 5.32 0.00 -1.26 -4.17 120.51 123.48 1woq n ALA 94 Ca -0.18 -2.46 0.03 0.00 0.00 0.00 0.00 53.44 50.83 1woq n ALA 94 Cb 0.56 -0.99 0.12 0.00 0.00 0.00 0.00 19.45 19.14 1woq n ALA 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1woq h ALA 95 N 2.77 0.65 0.00 0.00 0.00 -1.96 -3.05 119.26 117.68 1woq h ALA 95 Ca -0.09 0.24 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1woq h ALA 95 Cb 1.14 0.42 -0.03 0.00 0.00 0.00 0.00 17.79 19.32 1woq h ALA 95 CO 0.30 -0.42 -0.50 0.09 0.00 0.00 0.00 179.25 178.72 1woq n ASN 96 N -5.36 1.69 -4.20 0.00 3.02 -1.26 -5.03 115.26 104.12 1woq n ASN 96 Ca 0.11 -3.69 -0.16 0.00 -0.03 0.00 0.00 54.58 50.81 1woq n ASN 96 Cb 0.41 -0.50 -0.10 0.00 -0.61 0.00 0.00 39.78 38.98 1woq n ASN 96 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1woq s VAL 97 N -2.94 0.39 0.22 2.41 -7.23 -1.15 -5.00 120.40 107.09 1woq s VAL 97 Ca 0.37 -2.00 -0.32 0.00 -1.81 0.00 0.00 61.98 58.22 1woq s VAL 97 Cb 0.36 -2.58 -0.14 0.00 0.56 0.00 0.00 36.38 34.59 1woq s VAL 97 CO -0.07 0.00 1.46 -0.67 -0.31 0.00 0.00 175.10 175.51 1woq n ASP 98 N -0.56 2.86 0.01 4.85 2.03 -1.18 -4.84 116.55 119.71 1woq n ASP 98 Ca 0.01 1.13 0.05 0.00 0.52 0.00 0.00 54.79 56.49 1woq n ASP 98 Cb 0.66 -1.43 0.21 0.00 -0.72 0.00 0.00 41.12 39.84 1woq n ASP 98 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1woq n LYS 99 N 2.41 0.02 0.06 -0.67 4.76 -1.26 -1.79 118.16 121.69 1woq n LYS 99 Ca 0.13 0.37 0.09 0.00 -2.87 0.00 0.00 58.31 56.03 1woq n LYS 99 Cb 0.31 -1.54 0.40 0.00 -1.84 0.00 0.00 35.03 32.36 1woq n LYS 99 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1woq n SER 100 N -1.57 0.32 0.21 4.39 3.41 -1.26 -2.17 113.62 116.96 1woq n SER 100 Ca 0.02 0.58 0.08 0.00 -0.26 0.00 0.00 58.87 59.28 1woq n SER 100 Cb 0.10 -0.65 0.47 0.00 -0.26 0.00 0.00 64.21 63.87 1woq n SER 100 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 1woq h TRP 101 N 0.00 0.00 -2.28 7.33 4.06 -1.72 -3.43 115.95 119.91 1woq h TRP 101 Ca 0.00 0.00 -0.58 0.00 2.06 0.00 0.00 58.89 60.37 1woq h TRP 101 Cb 0.31 0.00 0.05 0.00 -1.00 0.00 0.00 29.16 28.52 1woq h TRP 101 CO 0.00 0.28 0.87 1.28 -3.56 0.00 0.00 178.44 177.31 1woq n LEU 102 N -3.64 3.25 -0.31 -4.49 4.77 -0.92 -1.46 117.00 114.19 1woq n LEU 102 Ca -0.01 1.06 -0.04 0.00 -0.03 0.00 0.00 56.01 56.99 1woq n LEU 102 Cb 0.40 -1.44 -0.02 0.00 -2.33 0.00 0.00 43.42 40.04 1woq n LEU 102 CO 0.35 -0.20 -0.04 0.59 -1.33 0.00 0.00 177.39 176.76 1woq n ASN 103 N 3.98 -4.35 -4.72 -1.43 3.02 0.56 -5.00 115.26 107.32 1woq n ASN 103 Ca 0.18 0.10 -0.40 0.00 -0.03 0.00 0.00 54.58 54.42 1woq n ASN 103 Cb 0.30 -2.21 -0.04 0.00 -0.61 0.00 0.00 39.78 37.21 1woq n ASN 103 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1woq s THR 104 N -1.86 4.95 -1.05 3.41 2.01 -0.54 -4.80 115.64 117.76 1woq s THR 104 Ca 0.00 1.63 -0.22 0.00 0.31 0.00 0.00 61.69 63.41 1woq s THR 104 Cb 0.00 -4.12 0.06 0.00 0.01 0.00 0.00 72.50 68.44 1woq s THR 104 CO 0.00 0.25 1.47 -0.62 -0.69 0.00 0.00 174.62 175.02 1woq s ASP 105 N 0.69 6.55 0.36 3.53 -1.08 -1.26 -1.30 116.67 124.15 1woq s ASP 105 Ca 0.41 -1.60 0.11 0.00 -0.52 0.00 0.00 52.55 50.96 1woq s ASP 105 Cb -0.19 -2.56 0.67 0.00 -1.46 0.00 0.00 42.92 39.38 1woq s ASP 105 CO 0.21 -1.45 1.80 -0.29 0.52 0.00 0.00 175.17 175.97 1woq h ILE 106 N 6.61 1.27 -0.47 4.11 2.10 -1.52 -0.74 117.51 128.86 1woq h ILE 106 Ca 0.23 -1.31 -0.00 0.00 1.08 0.00 0.00 64.86 64.85 1woq h ILE 106 Cb 0.99 1.67 -0.02 0.00 -1.09 0.00 0.00 36.82 38.37 1woq h ILE 106 CO 1.42 0.38 0.28 0.44 -1.08 0.00 0.00 178.15 179.58 1woq h ASP 107 N 0.05 0.57 -0.33 2.19 5.19 -1.74 -1.01 116.42 121.35 1woq h ASP 107 Ca 0.00 -0.07 -0.17 0.00 -0.62 0.00 0.00 57.03 56.18 1woq h ASP 107 Cb 0.68 -0.15 -0.00 0.00 0.18 0.00 0.00 39.33 40.04 1woq h ASP 107 CO 0.05 0.47 -0.46 0.00 -3.12 0.00 0.00 179.24 176.18 1woq h ALA 108 N 1.13 0.50 0.17 3.45 0.00 -1.76 -1.30 119.26 121.45 1woq h ALA 108 Ca 0.17 -0.48 0.01 0.00 0.00 0.00 0.00 54.91 54.61 1woq h ALA 108 Cb 0.01 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1woq h ALA 108 CO -0.03 0.66 -0.22 1.25 0.00 0.00 0.00 179.25 180.90 1woq h LEU 109 N 0.69 -0.62 -0.54 0.00 5.85 -0.88 -0.73 115.31 119.08 1woq h LEU 109 Ca 0.03 0.07 -0.16 0.00 0.84 0.00 0.00 57.88 58.66 1woq h LEU 109 Cb 1.07 0.22 -0.01 0.00 0.37 0.00 0.00 40.66 42.31 1woq h LEU 109 CO 0.11 -0.32 -0.64 -0.07 -0.34 0.00 0.00 178.44 177.18 1woq h LEU 110 N -0.45 0.39 -0.67 2.25 3.38 -1.23 -2.13 115.31 116.85 1woq h LEU 110 Ca 0.01 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 1woq h LEU 110 Cb 0.44 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 1woq h LEU 110 CO -0.09 0.92 0.28 0.74 0.09 0.00 0.00 178.44 180.39 1woq h THR 111 N 0.24 1.24 -0.43 0.22 2.02 -1.10 -0.24 112.91 114.86 1woq h THR 111 Ca -0.01 -0.72 -0.07 0.00 0.77 0.00 0.00 66.41 66.37 1woq h THR 111 Cb 1.18 0.46 -0.02 0.00 -1.74 0.00 0.00 68.15 68.04 1woq h THR 111 CO 0.11 0.29 -0.02 0.00 0.37 0.00 0.00 175.52 176.26 1woq h ALA 112 N 1.12 0.59 -0.29 6.16 0.00 -1.04 -0.91 119.26 124.89 1woq h ALA 112 Ca 0.22 -0.28 -0.15 0.00 0.00 0.00 0.00 54.91 54.70 1woq h ALA 112 Cb 0.18 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1woq h ALA 112 CO -0.02 0.40 -0.44 -0.09 0.00 0.00 0.00 179.25 179.10 1woq h ARG 113 N 0.62 0.74 0.00 0.00 9.65 -1.17 -3.25 114.38 120.98 1woq h ARG 113 Ca 0.12 -0.41 0.00 0.00 -1.10 0.00 0.00 59.98 58.59 1woq h ARG 113 Cb 0.52 0.02 0.00 0.00 -1.39 0.00 0.00 29.97 29.12 1woq h ARG 113 CO 0.03 1.03 -0.55 -0.07 2.80 0.00 0.00 179.97 183.21 1woq h LEU 114 N 0.60 0.00 1.56 3.80 3.38 -1.04 -3.48 115.31 120.12 1woq h LEU 114 Ca 0.04 -0.18 -0.25 0.00 0.09 0.00 0.00 57.88 57.58 1woq h LEU 114 Cb 1.00 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.72 1woq h LEU 114 CO 0.09 0.09 -0.30 0.61 0.09 0.00 0.00 178.44 179.02 1woq n GLY 115 N 1.33 0.12 3.41 0.83 0.00 -0.35 -4.99 105.19 105.53 1woq n GLY 115 Ca 0.03 -0.38 -0.14 0.00 0.00 0.00 0.00 46.02 45.53 1woq n GLY 115 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1woq s ARG 116 N -4.34 1.06 0.15 1.61 1.70 -1.16 -4.97 118.95 112.99 1woq s ARG 116 Ca 0.00 -0.18 -0.34 0.00 -0.47 0.00 0.00 55.73 54.75 1woq s ARG 116 Cb 0.00 0.49 -0.13 0.00 -0.57 0.00 0.00 34.95 34.73 1woq s ARG 116 CO 0.00 -0.38 1.62 -2.30 -1.08 0.00 0.00 175.30 173.16 1woq n PRO 117 N 0.42 2.25 -4.62 3.89 -0.02 -1.26 -4.37 135.00 131.29 1woq n PRO 117 Ca -0.18 0.81 -0.23 0.00 -2.02 0.00 0.00 63.50 61.88 1woq n PRO 117 Cb 0.60 -2.60 -0.16 0.00 -0.02 0.00 0.00 33.50 31.32 1woq n PRO 117 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1woq s VAL 118 N 1.22 1.10 -0.06 -1.45 1.01 -1.26 -0.56 120.40 120.39 1woq s VAL 118 Ca 0.79 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 62.24 1woq s VAL 118 Cb -0.65 -0.96 0.02 0.00 0.00 0.00 0.00 36.38 34.79 1woq s VAL 118 CO 0.38 0.33 -0.10 -1.61 0.00 0.00 0.00 175.10 174.10 1woq s GLU 119 N 0.05 1.45 0.01 2.72 2.02 -0.83 -4.74 118.70 119.37 1woq s GLU 119 Ca -0.02 -0.32 -0.00 0.00 0.02 0.00 0.00 54.97 54.65 1woq s GLU 119 Cb -0.09 -1.26 -0.04 0.00 0.10 0.00 0.00 34.13 32.84 1woq s GLU 119 CO 0.01 -0.03 0.10 0.08 0.02 0.00 0.00 175.26 175.44 1woq s VAL 120 N 0.82 4.81 0.03 2.63 1.01 -1.26 -1.52 120.40 126.92 1woq s VAL 120 Ca -0.12 -0.43 -0.03 0.00 0.00 0.00 0.00 61.98 61.40 1woq s VAL 120 Cb -0.15 -3.23 -0.02 0.00 0.00 0.00 0.00 36.38 32.98 1woq s VAL 120 CO 0.02 0.31 0.02 -0.51 0.00 0.00 0.00 175.10 174.94 1woq s ILE 121 N -1.25 0.13 0.47 2.22 2.07 -0.42 -4.81 121.20 119.61 1woq s ILE 121 Ca 0.25 -1.08 -0.24 0.00 -1.41 0.00 0.00 60.65 58.17 1woq s ILE 121 Cb -0.12 -0.65 -0.08 0.00 0.13 0.00 0.00 42.46 41.74 1woq s ILE 121 CO 0.16 -0.59 1.27 -3.20 -1.91 0.00 0.00 174.94 170.67 1woq n ASN 122 N 1.12 2.44 -0.26 4.50 5.15 -1.26 -1.75 115.26 125.20 1woq n ASN 122 Ca -0.21 1.05 -0.04 0.00 -0.60 0.00 0.00 54.58 54.77 1woq n ASN 122 Cb 0.57 -1.51 0.11 0.00 -0.53 0.00 0.00 39.78 38.42 1woq n ASN 122 CO 0.00 0.00 0.00 -2.24 1.40 0.00 0.00 177.26 176.42 1woq h ASP 123 N 1.78 1.02 -0.26 1.20 2.03 -1.61 -0.83 116.42 119.74 1woq h ASP 123 Ca -0.49 -0.14 -0.19 0.00 -0.73 0.00 0.00 57.03 55.48 1woq h ASP 123 Cb 1.30 -0.26 0.00 0.00 -0.83 0.00 0.00 39.33 39.54 1woq h ASP 123 CO 0.58 0.89 -0.55 0.00 -1.03 0.00 0.00 179.24 179.13 1woq h ALA 124 N 1.26 0.48 -0.89 4.15 0.00 -1.88 -2.28 119.26 120.10 1woq h ALA 124 Ca 0.26 -0.52 0.04 0.00 0.00 0.00 0.00 54.91 54.69 1woq h ALA 124 Cb 0.18 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.84 1woq h ALA 124 CO -0.03 0.68 0.57 -0.44 0.00 0.00 0.00 179.25 180.04 1woq h ASP 125 N 0.66 0.95 -0.28 0.00 5.19 -1.70 0.59 116.42 121.83 1woq h ASP 125 Ca 0.01 -0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.41 1woq h ASP 125 Cb 1.16 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 40.45 1woq h ASP 125 CO 0.12 0.65 0.15 0.00 -3.12 0.00 0.00 179.24 177.04 1woq h ALA 126 N 1.37 0.36 -0.79 3.45 0.00 -1.00 0.29 119.26 122.94 1woq h ALA 126 Ca 0.36 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.24 1woq h ALA 126 Cb 0.02 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 1woq h ALA 126 CO -0.12 -0.11 0.52 0.00 0.00 0.00 0.00 179.25 179.53 1woq h ALA 127 N 1.03 1.54 -0.37 0.00 0.00 -0.77 -1.42 119.26 119.27 1woq h ALA 127 Ca 0.10 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1woq h ALA 127 Cb 0.06 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1woq h ALA 127 CO -0.02 0.38 0.07 0.78 0.00 0.00 0.00 179.25 180.46 1woq h GLY 128 N 0.96 0.65 0.86 0.00 0.00 -0.10 -0.29 103.07 105.14 1woq h GLY 128 Ca 0.32 -0.43 0.03 0.00 0.00 0.00 0.00 47.33 47.25 1woq h GLY 128 CO -0.09 0.40 0.45 1.41 0.00 0.00 0.00 176.54 178.71 1woq h LEU 129 N 0.45 0.74 -0.26 3.11 3.38 -0.30 0.48 115.31 122.92 1woq h LEU 129 Ca 0.11 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 1woq h LEU 129 Cb 0.35 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1woq h LEU 129 CO 0.01 0.51 0.07 0.00 0.09 0.00 0.00 178.44 179.12 1woq h ALA 130 N 1.31 0.34 -0.26 1.53 0.00 -1.05 -1.79 119.26 119.35 1woq h ALA 130 Ca 0.29 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 1woq h ALA 130 Cb 0.03 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1woq h ALA 130 CO -0.11 -0.02 -0.29 0.93 0.00 0.00 0.00 179.25 179.76 1woq h GLU 131 N 0.25 0.52 -0.08 0.00 4.39 -0.75 0.21 114.58 119.12 1woq h GLU 131 Ca 0.08 -0.21 -0.12 0.00 0.34 0.00 0.00 59.36 59.45 1woq h GLU 131 Cb 0.26 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 1woq h GLU 131 CO -0.00 0.75 -0.49 0.00 -1.16 0.00 0.00 179.01 178.11 1woq h ALA 132 N 1.24 1.02 0.06 3.43 0.00 -0.82 0.79 119.26 125.00 1woq h ALA 132 Ca 0.06 -0.47 -0.36 0.00 0.00 0.00 0.00 54.91 54.14 1woq h ALA 132 Cb 0.73 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 1woq h ALA 132 CO 0.06 0.65 -2.07 -2.13 0.00 0.00 0.00 179.25 175.75 1woq n ARG 133 N -3.96 0.68 0.00 0.00 0.00 -0.68 -3.17 116.66 109.54 1woq n ARG 133 Ca -0.02 0.28 0.01 0.00 -0.00 0.00 0.00 57.85 58.12 1woq n ARG 133 Cb 0.53 -1.64 -0.01 0.00 0.00 0.00 0.00 32.46 31.34 1woq n ARG 133 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 1woq n TYR 134 N -3.65 0.00 0.00 -0.14 4.01 0.70 -4.83 117.16 113.26 1woq n TYR 134 Ca -0.38 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.36 1woq n TYR 134 Cb 0.96 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.99 1woq n TYR 134 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1woq n GLY 135 N 0.92 4.63 0.02 2.72 0.00 -0.38 -4.92 105.19 108.17 1woq n GLY 135 Ca 0.01 -1.61 0.03 0.00 0.00 0.00 0.00 46.02 44.45 1woq n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1woq n ALA 136 N -3.00 1.25 1.00 4.61 0.00 -1.17 -2.18 120.51 121.01 1woq n ALA 136 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 1woq n ALA 136 Cb 0.00 -1.11 -0.01 0.00 0.00 0.00 0.00 19.45 18.32 1woq n ALA 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1woq n GLY 137 N -0.94 -1.07 3.72 0.00 0.00 0.13 -4.87 105.19 102.16 1woq n GLY 137 Ca 0.01 -0.53 -0.42 0.00 0.00 0.00 0.00 46.02 45.08 1woq n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1woq n ALA 138 N -1.49 2.76 -1.02 4.61 0.00 -0.93 -2.06 120.51 122.38 1woq n ALA 138 Ca 0.04 0.40 -0.01 0.00 0.00 0.00 0.00 53.44 53.88 1woq n ALA 138 Cb 0.33 -2.51 -0.00 0.00 0.00 0.00 0.00 19.45 17.26 1woq n ALA 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1woq n GLY 139 N 3.87 0.39 3.40 0.00 0.00 -1.26 -5.00 105.19 106.59 1woq n GLY 139 Ca 0.16 -0.08 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 1woq n GLY 139 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1woq s VAL 140 N -1.70 4.09 0.70 1.61 1.01 -0.87 -5.10 120.40 120.14 1woq s VAL 140 Ca 0.00 -0.33 -0.04 0.00 0.00 0.00 0.00 61.98 61.61 1woq s VAL 140 Cb 0.00 -2.95 0.09 0.00 0.00 0.00 0.00 36.38 33.52 1woq s VAL 140 CO 0.00 0.30 0.99 -1.59 0.00 0.00 0.00 175.10 174.80 1woq s LYS 141 N 1.57 1.98 2.30 2.72 -2.85 -1.26 -4.22 119.74 119.99 1woq s LYS 141 Ca 0.06 -0.60 0.00 0.00 -1.00 0.00 0.00 55.97 54.42 1woq s LYS 141 Cb -0.15 -2.25 0.00 0.00 -2.06 0.00 0.00 37.83 33.37 1woq s LYS 141 CO 0.02 -1.30 0.00 0.41 0.10 0.00 0.00 175.35 174.59 1woq n GLY 142 N -2.86 -0.97 3.65 0.59 0.00 -1.26 -4.75 105.19 99.59 1woq n GLY 142 Ca 0.10 -1.20 -0.43 0.00 0.00 0.00 0.00 46.02 44.50 1woq n GLY 142 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1woq s THR 143 N 0.00 4.71 -0.12 2.61 2.01 -1.26 -1.20 115.64 122.38 1woq s THR 143 Ca 0.00 1.79 0.02 0.00 0.31 0.00 0.00 61.69 63.81 1woq s THR 143 Cb 0.00 -4.26 0.01 0.00 0.01 0.00 0.00 72.50 68.26 1woq s THR 143 CO 0.00 -0.20 -0.18 -0.69 -0.69 0.00 0.00 174.62 172.86 1woq s VAL 144 N 3.15 1.71 -0.22 3.82 1.01 0.59 0.39 120.40 130.85 1woq s VAL 144 Ca 0.41 -0.77 -0.03 0.00 0.00 0.00 0.00 61.98 61.59 1woq s VAL 144 Cb -0.15 -1.54 0.00 0.00 0.00 0.00 0.00 36.38 34.69 1woq s VAL 144 CO 0.08 0.48 -0.06 -0.76 0.00 0.00 0.00 175.10 174.84 1woq s LEU 145 N 0.96 2.85 -0.33 3.92 1.43 -0.62 -1.00 118.68 125.88 1woq s LEU 145 Ca -0.06 -0.50 -0.14 0.00 -1.03 0.00 0.00 54.13 52.40 1woq s LEU 145 Cb -0.15 -1.70 -0.02 0.00 0.03 0.00 0.00 46.19 44.36 1woq s LEU 145 CO -0.02 -0.04 0.32 -0.69 0.23 0.00 0.00 176.35 176.15 1woq s VAL 146 N 1.44 5.21 -0.21 -1.59 1.01 -0.57 -0.94 120.40 124.74 1woq s VAL 146 Ca 0.05 0.02 -0.04 0.00 0.00 0.00 0.00 61.98 62.01 1woq s VAL 146 Cb -0.14 -3.76 -0.01 0.00 0.00 0.00 0.00 36.38 32.46 1woq s VAL 146 CO -0.05 -0.03 -0.04 -0.63 0.00 0.00 0.00 175.10 174.36 1woq s ILE 147 N 1.92 3.49 -0.16 2.22 -1.09 0.79 -0.43 121.20 127.94 1woq s ILE 147 Ca 0.10 -0.46 -0.07 0.00 -2.23 0.00 0.00 60.65 57.99 1woq s ILE 147 Cb -0.17 -2.58 -0.04 0.00 -1.58 0.00 0.00 42.46 38.09 1woq s ILE 147 CO 0.11 0.43 0.09 0.42 -1.23 0.00 0.00 174.94 174.76 1woq s THR 148 N 1.31 5.10 -0.24 2.92 -4.23 -0.07 -0.71 115.64 119.73 1woq s THR 148 Ca 0.04 0.07 -0.03 0.00 -1.18 0.00 0.00 61.69 60.59 1woq s THR 148 Cb -0.14 -3.27 0.01 0.00 1.34 0.00 0.00 72.50 70.43 1woq s THR 148 CO -0.01 0.51 -0.04 -0.76 -0.54 0.00 0.00 174.62 173.78 1woq s LEU 149 N -0.14 3.10 0.00 4.79 1.43 -0.32 -1.27 118.68 126.26 1woq s LEU 149 Ca 0.09 -0.62 0.00 0.00 -1.03 0.00 0.00 54.13 52.56 1woq s LEU 149 Cb -0.12 -1.72 0.00 0.00 0.03 0.00 0.00 46.19 44.38 1woq s LEU 149 CO 0.01 -0.08 0.00 0.61 0.23 0.00 0.00 176.35 177.11 1woq n GLY 150 N 4.75 2.37 0.36 -3.19 0.00 -1.26 -1.95 105.19 106.26 1woq n GLY 150 Ca -0.17 0.12 -0.01 0.00 0.00 0.00 0.00 46.02 45.96 1woq n GLY 150 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1woq h THR 151 N 0.00 1.22 -4.05 2.61 2.02 -1.95 0.24 112.91 113.01 1woq h THR 151 Ca 0.00 -0.42 -0.33 0.00 0.77 0.00 0.00 66.41 66.43 1woq h THR 151 Cb 0.00 -0.01 -0.07 0.00 -1.74 0.00 0.00 68.15 66.33 1woq h THR 151 CO 0.00 0.22 -0.28 0.61 0.37 0.00 0.00 175.52 176.44 1woq n GLY 152 N -1.37 3.55 3.33 2.16 0.00 -1.26 -4.55 105.19 107.05 1woq n GLY 152 Ca 0.09 -2.00 -0.35 0.00 0.00 0.00 0.00 46.02 43.77 1woq n GLY 152 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1woq s ILE 153 N -2.52 3.53 0.33 -0.61 1.01 -1.26 -4.48 121.20 117.19 1woq s ILE 153 Ca 0.14 -0.44 0.08 0.00 0.00 0.00 0.00 60.65 60.43 1woq s ILE 153 Cb 0.01 -2.61 -0.03 0.00 0.01 0.00 0.00 42.46 39.83 1woq s ILE 153 CO 0.10 0.41 0.26 -0.83 0.00 0.00 0.00 174.94 174.88 1woq s GLY 154 N 1.50 1.77 -0.17 6.18 0.00 -0.40 -3.56 107.32 112.64 1woq s GLY 154 Ca 0.06 -1.66 -0.11 0.00 0.00 0.00 0.00 44.72 43.02 1woq s GLY 154 CO -0.02 -1.59 0.42 -1.35 0.00 0.00 0.00 173.10 170.56 1woq s SER 155 N -3.96 -0.51 -0.18 1.64 1.04 -1.26 -0.89 113.70 109.59 1woq s SER 155 Ca 0.40 0.90 -0.02 0.00 0.48 0.00 0.00 55.95 57.70 1woq s SER 155 Cb -0.06 0.81 -0.01 0.00 0.10 0.00 0.00 66.02 66.86 1woq s SER 155 CO 0.26 -0.18 -0.08 0.00 0.98 0.00 0.00 173.24 174.22 1woq s ALA 156 N 1.12 2.77 -0.37 5.32 0.00 0.43 -4.29 121.76 126.75 1woq s ALA 156 Ca -0.07 -1.01 -0.14 0.00 0.00 0.00 0.00 51.96 50.73 1woq s ALA 156 Cb -0.07 -1.50 -0.00 0.00 0.00 0.00 0.00 23.12 21.55 1woq s ALA 156 CO -0.10 -0.09 0.29 0.12 0.00 0.00 0.00 175.76 175.99 1woq s PHE 157 N 0.90 3.22 -0.13 0.00 5.36 -1.26 -1.51 117.98 124.56 1woq s PHE 157 Ca -0.02 -0.29 -0.01 0.00 -0.96 0.00 0.00 56.93 55.65 1woq s PHE 157 Cb -0.15 -2.57 -0.02 0.00 -0.34 0.00 0.00 43.02 39.94 1woq s PHE 157 CO 0.01 -0.46 -0.10 0.42 -1.46 0.00 0.00 175.22 173.63 1woq s ILE 158 N 1.79 3.37 -0.11 3.12 -1.09 -0.18 -0.12 121.20 128.00 1woq s ILE 158 Ca 0.07 -0.55 -0.01 0.00 -2.23 0.00 0.00 60.65 57.93 1woq s ILE 158 Cb -0.18 -2.43 0.03 0.00 -1.58 0.00 0.00 42.46 38.30 1woq s ILE 158 CO 0.11 0.52 -0.06 0.12 -1.23 0.00 0.00 174.94 174.41 1woq s PHE 159 N 0.19 1.31 -1.47 3.97 5.36 0.52 -0.30 117.98 127.56 1woq s PHE 159 Ca -0.06 -0.63 -0.09 0.00 -0.96 0.00 0.00 56.93 55.19 1woq s PHE 159 Cb -0.15 -1.14 0.06 0.00 -0.34 0.00 0.00 43.02 41.45 1woq s PHE 159 CO 0.04 -0.48 0.86 -0.25 -1.46 0.00 0.00 175.22 173.93 1woq n ASP 160 N 4.99 -3.45 0.00 6.13 8.00 -0.34 -1.12 116.55 130.75 1woq n ASP 160 Ca -0.11 -0.82 0.00 0.00 0.71 0.00 0.00 54.79 54.57 1woq n ASP 160 Cb 0.50 -3.82 0.00 0.00 -0.02 0.00 0.00 41.12 37.78 1woq n ASP 160 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1woq n GLY 161 N -1.67 1.42 3.71 0.44 0.00 -1.26 -4.93 105.19 102.90 1woq n GLY 161 Ca -0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.61 1woq n GLY 161 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1woq s LYS 162 N -0.12 2.97 -0.05 1.61 2.20 -0.27 -4.94 119.74 121.14 1woq s LYS 162 Ca 0.00 -0.46 -0.30 0.00 -0.36 0.00 0.00 55.97 54.85 1woq s LYS 162 Cb 0.00 -2.79 -0.03 0.00 -1.51 0.00 0.00 37.83 33.49 1woq s LYS 162 CO 0.00 0.68 1.16 -1.17 -0.36 0.00 0.00 175.35 175.66 1woq s LEU 163 N -1.22 4.28 -0.55 5.43 2.96 -1.26 -0.36 118.68 127.97 1woq s LEU 163 Ca 0.17 1.78 -0.17 0.00 -0.22 0.00 0.00 54.13 55.69 1woq s LEU 163 Cb -0.12 -3.56 0.12 0.00 0.50 0.00 0.00 46.19 43.14 1woq s LEU 163 CO 0.06 -0.54 0.55 -0.69 -1.32 0.00 0.00 176.35 174.41 1woq s VAL 164 N 2.05 5.11 0.59 1.68 1.01 0.83 -4.95 120.40 126.72 1woq s VAL 164 Ca 0.55 -1.34 -0.19 0.00 0.00 0.00 0.00 61.98 60.99 1woq s VAL 164 Cb -0.24 -4.37 -0.05 0.00 0.00 0.00 0.00 36.38 31.72 1woq s VAL 164 CO 0.22 -0.92 1.04 -0.81 0.00 0.00 0.00 175.10 174.63 1woq n PRO 165 N 5.54 1.03 -3.05 2.72 -0.04 -1.26 -4.05 135.00 135.88 1woq n PRO 165 Ca -0.13 0.39 -0.22 0.00 -0.04 0.00 0.00 63.50 63.51 1woq n PRO 165 Cb 0.41 -2.24 0.02 0.00 -0.04 0.00 0.00 33.50 31.65 1woq n PRO 165 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1woq n ASN 166 N -0.82 -5.28 -4.72 3.54 5.03 -1.26 -4.97 115.26 106.77 1woq n ASN 166 Ca 0.13 -0.27 -0.42 0.00 0.87 0.00 0.00 54.58 54.89 1woq n ASN 166 Cb 0.47 -4.31 -0.03 0.00 -1.02 0.00 0.00 39.78 34.89 1woq n ASN 166 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1woq s ALA 167 N -3.07 3.48 -0.56 5.41 0.00 -1.26 -4.93 121.76 120.83 1woq s ALA 167 Ca 0.30 1.00 0.04 0.00 0.00 0.00 0.00 51.96 53.30 1woq s ALA 167 Cb -0.14 -3.47 0.37 0.00 0.00 0.00 0.00 23.12 19.88 1woq s ALA 167 CO 0.37 -0.49 1.10 0.39 0.00 0.00 0.00 175.76 177.13 1woq n GLU 168 N 3.31 3.42 0.00 0.00 -0.58 -1.26 -4.26 120.64 121.27 1woq n GLU 168 Ca 0.08 -4.67 0.06 0.00 -0.42 0.00 0.00 57.16 52.21 1woq n GLU 168 Cb 0.44 -2.26 0.29 0.00 -0.57 0.00 0.00 31.44 29.35 1woq n GLU 168 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1woq n LEU 169 N -0.34 0.00 0.07 -4.62 4.77 -1.26 -1.37 117.00 114.24 1woq n LEU 169 Ca 0.36 0.32 0.12 0.00 -0.03 0.00 0.00 56.01 56.78 1woq n LEU 169 Cb 0.48 -0.32 0.47 0.00 -2.33 0.00 0.00 43.42 41.72 1woq n LEU 169 CO 0.35 -0.19 0.88 0.61 -1.33 0.00 0.00 177.39 177.70 1woq n GLY 170 N -0.28 -1.45 1.29 -0.72 0.00 -1.23 -2.84 105.19 99.95 1woq n GLY 170 Ca 0.05 -0.02 0.04 0.00 0.00 0.00 0.00 46.02 46.09 1woq n GLY 170 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1woq n HIS 171 N -1.95 1.42 -2.24 1.61 8.25 -0.47 -1.73 115.22 120.10 1woq n HIS 171 Ca 0.05 -0.99 -0.36 0.00 -0.26 0.00 0.00 57.72 56.17 1woq n HIS 171 Cb 0.32 -0.43 0.00 0.00 1.12 0.00 0.00 29.99 31.00 1woq n HIS 171 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1woq s LEU 172 N -2.90 3.80 -0.09 2.41 1.43 -1.13 -4.68 118.68 117.52 1woq s LEU 172 Ca 0.47 2.22 -0.18 0.00 -1.03 0.00 0.00 54.13 55.61 1woq s LEU 172 Cb 0.38 -4.51 -0.04 0.00 0.03 0.00 0.00 46.19 42.04 1woq s LEU 172 CO 0.10 -1.18 0.49 -1.61 0.23 0.00 0.00 176.35 174.38 1woq s GLU 173 N -3.16 4.31 -0.05 1.70 0.41 -1.26 -0.32 118.70 120.32 1woq s GLU 173 Ca 0.71 0.49 -0.02 0.00 -0.41 0.00 0.00 54.97 55.74 1woq s GLU 173 Cb -0.25 -3.41 0.03 0.00 -1.78 0.00 0.00 34.13 28.72 1woq s GLU 173 CO 0.29 0.22 0.08 0.42 -0.49 0.00 0.00 175.26 175.78 1woq s ILE 174 N 0.41 -0.12 -1.47 -1.63 1.01 0.45 -4.87 121.20 114.97 1woq s ILE 174 Ca 0.27 0.35 -0.11 0.00 0.00 0.00 0.00 60.65 61.16 1woq s ILE 174 Cb -0.16 -0.17 0.06 0.00 0.01 0.00 0.00 42.46 42.20 1woq s ILE 174 CO 0.11 0.15 0.94 0.47 0.00 0.00 0.00 174.94 176.61 1woq n ASP 175 N 4.98 -4.14 0.00 3.58 8.00 -1.26 -1.90 116.55 125.81 1woq n ASP 175 Ca -0.11 -0.77 0.00 0.00 0.71 0.00 0.00 54.79 54.62 1woq n ASP 175 Cb 0.50 -4.00 0.00 0.00 -0.02 0.00 0.00 41.12 37.60 1woq n ASP 175 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1woq n GLY 176 N -1.69 0.84 3.32 0.44 0.00 -1.26 -5.02 105.19 101.81 1woq n GLY 176 Ca -0.03 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.77 1woq n GLY 176 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1woq s HIS 177 N -3.35 1.81 -0.01 1.61 3.76 -0.80 -5.08 115.29 113.22 1woq s HIS 177 Ca 0.00 -0.46 -0.30 0.00 -0.15 0.00 0.00 55.06 54.14 1woq s HIS 177 Cb 0.00 -0.91 -0.06 0.00 1.11 0.00 0.00 32.58 32.72 1woq s HIS 177 CO 0.00 0.31 1.47 0.34 -0.85 0.00 0.00 174.74 176.01 1woq s ASP 178 N -2.56 6.79 0.25 1.40 -1.08 -1.26 -0.41 116.67 119.79 1woq s ASP 178 Ca 0.14 2.16 -0.12 0.00 -0.52 0.00 0.00 52.55 54.21 1woq s ASP 178 Cb -0.06 -2.55 0.34 0.00 -1.46 0.00 0.00 42.92 39.18 1woq s ASP 178 CO 0.06 -0.78 1.58 0.00 0.52 0.00 0.00 175.17 176.55 1woq h ALA 179 N 8.22 0.47 0.00 3.66 0.00 -0.78 -1.11 119.26 129.72 1woq h ALA 179 Ca -0.38 0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1woq h ALA 179 Cb 1.18 0.71 -0.00 0.00 0.00 0.00 0.00 17.79 19.67 1woq h ALA 179 CO 0.92 -0.45 -0.09 1.05 0.00 0.00 0.00 179.25 180.68 1woq h GLU 180 N -0.02 0.00 0.00 0.00 4.11 -1.61 -0.37 114.58 116.69 1woq h GLU 180 Ca 0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.82 1woq h GLU 180 Cb 0.62 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.87 1woq h GLU 180 CO -0.88 0.09 0.00 1.79 0.07 0.00 0.00 179.01 180.08 1woq h THR 181 N 0.00 0.00 0.00 -1.06 1.35 -1.50 -2.56 112.91 109.15 1woq h THR 181 Ca -0.00 -0.26 -0.04 0.00 -0.55 0.00 0.00 66.41 65.56 1woq h THR 181 Cb 0.48 1.06 -0.01 0.00 -1.73 0.00 0.00 68.15 67.95 1woq h THR 181 CO 0.01 0.00 -1.17 0.29 -0.25 0.00 0.00 175.52 174.40 1woq n LYS 182 N -2.57 2.96 -0.06 4.72 4.76 -0.90 -4.79 118.16 122.27 1woq n LYS 182 Ca 0.01 -0.01 0.03 0.00 -2.87 0.00 0.00 58.31 55.47 1woq n LYS 182 Cb 0.21 -1.07 0.06 0.00 -1.84 0.00 0.00 35.03 32.39 1woq n LYS 182 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1woq n ALA 183 N -2.01 2.20 -1.37 7.82 0.00 -0.20 -4.46 120.51 122.49 1woq n ALA 183 Ca -0.04 -0.93 -0.29 0.00 0.00 0.00 0.00 53.44 52.19 1woq n ALA 183 Cb 0.49 -0.21 0.17 0.00 0.00 0.00 0.00 19.45 19.90 1woq n ALA 183 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1woq s SER 184 N -0.85 2.74 0.21 0.00 1.04 -0.97 -4.85 113.70 111.02 1woq s SER 184 Ca 0.10 0.93 -0.06 0.00 0.48 0.00 0.00 55.95 57.40 1woq s SER 184 Cb 0.06 -1.44 0.16 0.00 0.10 0.00 0.00 66.02 64.90 1woq s SER 184 CO 0.08 -3.02 1.68 0.00 0.98 0.00 0.00 173.24 172.95 1woq h ALA 185 N -1.82 0.93 -0.33 5.32 0.00 -0.80 -2.45 119.26 120.10 1woq h ALA 185 Ca -0.51 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.05 1woq h ALA 185 Cb 1.32 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1woq h ALA 185 CO 0.55 0.64 -0.01 0.28 0.00 0.00 0.00 179.25 180.71 1woq h VAL 186 N 0.89 1.26 -0.81 0.00 2.07 -1.63 -2.93 116.25 115.09 1woq h VAL 186 Ca 0.16 -0.98 0.06 0.00 0.82 0.00 0.00 66.70 66.76 1woq h VAL 186 Cb 0.53 1.24 -0.05 0.00 -1.52 0.00 0.00 31.29 31.49 1woq h VAL 186 CO 0.03 0.32 0.53 0.00 0.02 0.00 0.00 177.57 178.47 1woq h ALA 187 N 0.85 1.57 -0.27 1.67 0.00 -1.79 0.45 119.26 121.74 1woq h ALA 187 Ca 0.09 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.00 1woq h ALA 187 Cb 0.46 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1woq h ALA 187 CO 0.02 0.31 0.09 -0.09 0.00 0.00 0.00 179.25 179.59 1woq h ARG 188 N 0.93 0.21 -0.13 0.00 2.43 -1.26 -0.26 114.38 116.30 1woq h ARG 188 Ca 0.34 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.43 1woq h ARG 188 Cb 0.17 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.67 1woq h ARG 188 CO -0.12 0.14 -0.19 0.93 -1.51 0.00 0.00 179.97 179.23 1woq h GLU 189 N 0.22 0.36 -0.67 0.20 5.08 -1.29 -1.20 114.58 117.28 1woq h GLU 189 Ca 0.12 -0.21 0.08 0.00 -1.00 0.00 0.00 59.36 58.34 1woq h GLU 189 Cb 0.08 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.29 1woq h GLU 189 CO -0.12 0.79 0.34 -0.09 -1.00 0.00 0.00 179.01 178.93 1woq h ARG 190 N -0.04 0.59 -0.03 2.33 2.43 -0.80 -0.77 114.38 118.10 1woq h ARG 190 Ca 0.01 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1woq h ARG 190 Cb 0.75 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.16 1woq h ARG 190 CO 0.04 0.39 0.00 -0.25 -1.51 0.00 0.00 179.97 178.65 1woq n ASP 191 N -4.84 0.97 -3.63 -3.80 8.00 -0.12 -4.96 116.55 108.17 1woq n ASP 191 Ca 0.09 -1.37 -0.21 0.00 0.71 0.00 0.00 54.79 54.02 1woq n ASP 191 Cb 0.22 -0.01 0.05 0.00 -0.02 0.00 0.00 41.12 41.36 1woq n ASP 191 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1woq n GLY 192 N 1.09 -0.34 3.88 0.44 0.00 -0.30 -5.00 105.19 104.97 1woq n GLY 192 Ca 0.20 0.13 -0.32 0.00 0.00 0.00 0.00 46.02 46.03 1woq n GLY 192 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1woq s LEU 193 N -6.67 4.24 0.77 0.99 1.43 -0.54 -5.04 118.68 113.86 1woq s LEU 193 Ca 0.09 0.76 -0.10 0.00 -1.03 0.00 0.00 54.13 53.85 1woq s LEU 193 Cb -0.04 -3.42 0.07 0.00 0.03 0.00 0.00 46.19 42.83 1woq s LEU 193 CO 0.78 0.02 1.13 -0.94 0.23 0.00 0.00 176.35 177.57 1woq s SER 194 N -2.30 4.68 0.37 2.29 1.04 -1.26 -4.81 113.70 113.71 1woq s SER 194 Ca 0.42 0.72 0.06 0.00 0.48 0.00 0.00 55.95 57.64 1woq s SER 194 Cb -0.12 -1.29 0.71 0.00 0.10 0.00 0.00 66.02 65.41 1woq s SER 194 CO 0.22 -1.77 1.94 -0.50 0.98 0.00 0.00 173.24 174.12 1woq h TRP 195 N -0.89 0.51 -0.42 5.02 4.06 -1.98 0.80 115.95 123.05 1woq h TRP 195 Ca -0.45 -0.03 -0.08 0.00 2.06 0.00 0.00 58.89 60.39 1woq h TRP 195 Cb 1.32 -0.16 -0.01 0.00 -1.00 0.00 0.00 29.16 29.31 1woq h TRP 195 CO 0.34 0.45 -0.05 -0.44 -3.56 0.00 0.00 178.44 175.17 1woq h ASP 196 N 0.50 0.77 -0.09 -3.49 5.19 -1.93 0.49 116.42 117.86 1woq h ASP 196 Ca 0.12 -0.34 -0.11 0.00 -0.62 0.00 0.00 57.03 56.08 1woq h ASP 196 Cb 0.20 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 39.49 1woq h ASP 196 CO -0.00 0.92 -0.30 -0.33 -3.12 0.00 0.00 179.24 176.41 1woq h GLU 197 N 0.59 0.56 -0.32 3.56 5.08 -1.79 -2.53 114.58 119.72 1woq h GLU 197 Ca 0.11 -0.24 -0.10 0.00 -1.00 0.00 0.00 59.36 58.14 1woq h GLU 197 Cb 0.56 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 1woq h GLU 197 CO 0.03 0.79 -0.20 -0.92 -1.00 0.00 0.00 179.01 177.71 1woq h TYR 198 N 0.48 0.68 -0.23 4.33 3.20 -0.60 -2.55 116.97 122.28 1woq h TYR 198 Ca 0.06 -0.14 -0.04 0.00 3.14 0.00 0.00 58.73 61.76 1woq h TYR 198 Cb 0.76 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.85 1woq h TYR 198 CO 0.03 0.77 -0.02 0.77 -1.64 0.00 0.00 178.16 178.06 1woq h SER 199 N 0.54 0.31 -0.51 -2.11 0.02 -0.49 -0.98 113.55 110.33 1woq h SER 199 Ca 0.08 -0.05 -0.03 0.00 -0.84 0.00 0.00 61.79 60.95 1woq h SER 199 Cb 0.65 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 63.09 1woq h SER 199 CO 0.05 0.39 0.20 0.58 -1.14 0.00 0.00 176.83 176.91 1woq h VAL 200 N 0.33 1.22 -0.59 2.27 2.07 -1.16 0.64 116.25 121.03 1woq h VAL 200 Ca 0.07 -0.67 -0.09 0.00 0.82 0.00 0.00 66.70 66.83 1woq h VAL 200 Cb 0.26 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 1woq h VAL 200 CO 0.01 0.25 0.02 -0.07 0.02 0.00 0.00 177.57 177.80 1woq h LEU 201 N 0.68 1.00 -0.93 2.57 3.38 -1.26 -2.30 115.31 118.45 1woq h LEU 201 Ca 0.17 -0.30 -0.10 0.00 0.09 0.00 0.00 57.88 57.74 1woq h LEU 201 Cb 0.20 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1woq h LEU 201 CO -0.01 1.05 -0.36 -0.07 0.09 0.00 0.00 178.44 179.13 1woq h LEU 202 N 0.92 0.34 -0.50 1.67 3.38 -0.96 -0.49 115.31 119.66 1woq h LEU 202 Ca 0.17 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1woq h LEU 202 Cb 0.53 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 1woq h LEU 202 CO 0.03 0.68 0.21 -0.61 0.09 0.00 0.00 178.44 178.84 1woq h GLN 203 N 0.28 0.75 -0.46 1.13 5.75 -0.63 0.67 115.11 122.60 1woq h GLN 203 Ca 0.03 -0.13 -0.10 0.00 -0.15 0.00 0.00 58.65 58.30 1woq h GLN 203 Cb 0.77 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 29.19 1woq h GLN 203 CO 0.06 0.66 -0.10 0.00 -2.65 0.00 0.00 178.83 176.80 1woq h ARG 204 N 0.67 0.88 0.63 1.69 3.08 -1.12 -1.06 114.38 119.14 1woq h ARG 204 Ca 0.17 -0.33 -0.03 0.00 0.07 0.00 0.00 59.98 59.86 1woq h ARG 204 Cb 0.18 -0.05 0.01 0.00 0.08 0.00 0.00 29.97 30.19 1woq h ARG 204 CO -0.02 0.97 -0.30 -0.92 -1.07 0.00 0.00 179.97 178.64 1woq h TYR 205 N 0.71 -0.78 -0.29 3.04 3.20 -0.80 -1.75 116.97 120.30 1woq h TYR 205 Ca 0.12 -0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.91 1woq h TYR 205 Cb 0.65 0.26 -0.02 0.00 1.54 0.00 0.00 36.73 39.16 1woq h TYR 205 CO 0.05 -0.44 -0.06 0.74 -1.64 0.00 0.00 178.16 176.81 1woq h PHE 206 N -1.03 0.49 -0.68 -3.82 -1.00 -0.94 -0.72 116.94 109.24 1woq h PHE 206 Ca -0.09 -0.06 -0.07 0.00 2.81 0.00 0.00 57.97 60.57 1woq h PHE 206 Cb 0.69 -0.14 -0.03 0.00 3.61 0.00 0.00 35.95 40.09 1woq h PHE 206 CO -0.00 0.52 0.16 1.03 -1.61 0.00 0.00 178.31 178.41 1woq h SER 207 N 0.44 1.02 -0.20 2.17 0.87 -1.18 0.63 113.55 117.32 1woq h SER 207 Ca 0.09 -0.21 -0.07 0.00 -1.23 0.00 0.00 61.79 60.37 1woq h SER 207 Cb 0.38 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 62.07 1woq h SER 207 CO 0.02 0.98 -0.15 -0.74 -0.53 0.00 0.00 176.83 176.41 1woq h HIS 208 N 1.03 0.53 -0.31 2.24 -0.00 -0.75 -2.32 115.15 115.56 1woq h HIS 208 Ca 0.21 -0.15 -0.05 0.00 -0.00 0.00 0.00 60.37 60.38 1woq h HIS 208 Cb 0.36 -0.12 -0.02 0.00 -0.00 0.00 0.00 27.41 27.64 1woq h HIS 208 CO 0.03 0.78 -0.03 0.28 -0.00 0.00 0.00 177.93 178.99 1woq h VAL 209 N 0.13 1.20 -0.70 5.26 2.07 -0.98 -1.19 116.25 122.03 1woq h VAL 209 Ca 0.04 -0.82 -0.02 0.00 0.82 0.00 0.00 66.70 66.72 1woq h VAL 209 Cb 0.68 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.41 1woq h VAL 209 CO 0.04 0.28 0.34 -0.08 0.02 0.00 0.00 177.57 178.17 1woq h GLU 210 N 0.47 1.00 -0.32 1.57 4.81 -0.77 -1.25 114.58 120.09 1woq h GLU 210 Ca 0.10 -0.14 -0.15 0.00 -0.13 0.00 0.00 59.36 59.04 1woq h GLU 210 Cb 0.36 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 1woq h GLU 210 CO 0.01 0.78 -0.40 0.35 -0.73 0.00 0.00 179.01 179.03 1woq h PHE 211 N 0.97 0.94 -0.31 0.92 3.04 -0.88 0.71 116.94 122.33 1woq h PHE 211 Ca 0.24 -0.28 -0.08 0.00 3.98 0.00 0.00 57.97 61.83 1woq h PHE 211 Cb 0.11 -0.20 -0.02 0.00 2.56 0.00 0.00 35.95 38.40 1woq h PHE 211 CO 0.00 1.06 -0.13 -0.07 -2.02 0.00 0.00 178.31 177.15 1woq h LEU 212 N 0.64 0.52 -0.37 0.59 3.38 -0.77 -3.38 115.31 115.93 1woq h LEU 212 Ca 0.05 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1woq h LEU 212 Cb 0.96 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.57 1woq h LEU 212 CO 0.09 0.69 0.00 0.49 0.09 0.00 0.00 178.44 179.80 1woq n PHE 213 N -4.19 0.00 -3.98 1.13 3.72 -0.51 -5.05 117.46 108.58 1woq n PHE 213 Ca 0.01 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.08 1woq n PHE 213 Cb 0.34 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.87 1woq n PHE 213 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1woq n SER 214 N -0.16 -2.12 -4.73 4.37 7.64 0.24 -4.89 113.62 113.96 1woq n SER 214 Ca 0.00 -1.13 -0.33 0.00 1.01 0.00 0.00 58.87 58.42 1woq n SER 214 Cb 0.08 -2.55 0.09 0.00 -1.01 0.00 0.00 64.21 60.83 1woq n SER 214 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1woq s PRO 215 N -6.77 2.13 0.18 1.43 0.04 -1.26 -4.86 135.00 125.88 1woq s PRO 215 Ca 0.23 1.56 0.14 0.00 0.04 0.00 0.00 61.00 62.97 1woq s PRO 215 Cb -0.10 -1.85 -0.05 0.00 0.04 0.00 0.00 34.50 32.54 1woq s PRO 215 CO 0.92 -1.80 1.19 0.93 0.04 0.00 0.00 177.00 178.28 1woq h GLU 216 N -0.58 0.00 -1.80 4.56 4.39 -0.40 -3.47 114.58 117.27 1woq h GLU 216 Ca -0.46 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.24 1woq h GLU 216 Cb 1.27 0.00 -0.22 0.00 -0.10 0.00 0.00 28.75 29.71 1woq h GLU 216 CO 0.50 0.50 0.33 -1.17 -1.16 0.00 0.00 179.01 178.01 1woq s LEU 217 N -6.26 -0.55 -0.09 1.33 2.96 -1.23 -4.39 118.68 110.45 1woq s LEU 217 Ca 0.01 0.74 0.01 0.00 -0.22 0.00 0.00 54.13 54.67 1woq s LEU 217 Cb 0.08 2.22 -0.02 0.00 0.50 0.00 0.00 46.19 48.97 1woq s LEU 217 CO 0.78 -0.41 -0.10 -0.36 -1.32 0.00 0.00 176.35 174.94 1woq s PHE 218 N -0.75 2.85 -0.11 5.38 2.99 -0.55 -1.59 117.98 126.21 1woq s PHE 218 Ca -0.05 -0.25 0.02 0.00 0.00 0.00 0.00 56.93 56.65 1woq s PHE 218 Cb -0.02 -1.76 0.02 0.00 0.00 0.00 0.00 43.02 41.26 1woq s PHE 218 CO 0.04 0.09 -0.15 0.42 -0.00 0.00 0.00 175.22 175.62 1woq s ILE 219 N -0.29 1.49 -0.28 0.64 1.01 -0.12 -1.80 121.20 121.85 1woq s ILE 219 Ca 0.03 -0.63 -0.11 0.00 0.00 0.00 0.00 60.65 59.94 1woq s ILE 219 Cb -0.13 -1.37 -0.05 0.00 0.01 0.00 0.00 42.46 40.92 1woq s ILE 219 CO 0.03 0.44 0.19 -0.69 0.00 0.00 0.00 174.94 174.91 1woq s VAL 220 N 1.04 5.31 0.00 2.92 1.01 0.50 -0.15 120.40 131.03 1woq s VAL 220 Ca -0.05 0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.11 1woq s VAL 220 Cb -0.15 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.70 1woq s VAL 220 CO -0.03 0.25 0.00 0.61 0.00 0.00 0.00 175.10 175.94 1woq n GLY 221 N 5.01 7.46 0.00 4.51 0.00 0.11 -0.12 105.19 122.17 1woq n GLY 221 Ca -0.14 -2.05 0.00 0.00 0.00 0.00 0.00 46.02 43.84 1woq n GLY 221 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1woq n GLY 222 N 4.97 0.05 0.41 -0.02 0.00 -1.26 -1.18 105.19 108.16 1woq n GLY 222 Ca 0.00 -1.87 0.21 0.00 0.00 0.00 0.00 46.02 44.36 1woq n GLY 222 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1woq h GLY 223 N 0.00 0.54 -2.46 -0.02 0.00 -1.78 -2.51 103.07 96.84 1woq h GLY 223 Ca 0.00 -0.12 -0.05 0.00 0.00 0.00 0.00 47.33 47.16 1woq h GLY 223 CO 0.00 0.00 0.04 0.29 0.00 0.00 0.00 176.54 176.87 1woq n ILE 224 N -4.43 2.54 0.22 2.60 -5.35 -1.11 -4.40 119.36 109.43 1woq n ILE 224 Ca 0.17 -1.79 0.09 0.00 -0.27 0.00 0.00 62.75 60.95 1woq n ILE 224 Cb 0.74 -0.28 0.51 0.00 -1.74 0.00 0.00 39.64 38.86 1woq n ILE 224 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 1woq h SER 225 N 2.44 0.00 0.56 7.28 4.64 -1.60 -0.92 113.55 125.94 1woq h SER 225 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1woq h SER 225 Cb 1.74 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.83 1woq h SER 225 CO 0.39 0.24 0.00 2.29 -0.87 0.00 0.00 176.83 178.88 1woq n LYS 226 N -3.60 0.02 -0.44 4.77 2.85 -1.26 -1.66 118.16 118.84 1woq n LYS 226 Ca -0.01 0.21 0.08 0.00 -1.05 0.00 0.00 58.31 57.54 1woq n LYS 226 Cb 0.38 -1.50 0.27 0.00 -0.65 0.00 0.00 35.03 33.53 1woq n LYS 226 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1woq n ARG 227 N -1.48 3.26 -0.28 -1.58 5.12 -0.35 -4.68 116.66 116.66 1woq n ARG 227 Ca 0.04 -2.64 0.24 0.00 -1.93 0.00 0.00 57.85 53.57 1woq n ARG 227 Cb 0.19 -1.71 0.57 0.00 -1.16 0.00 0.00 32.46 30.35 1woq n ARG 227 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1woq h ALA 228 N 2.69 2.43 0.00 7.54 0.00 -1.33 0.67 119.26 131.26 1woq h ALA 228 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1woq h ALA 228 Cb 1.26 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1woq h ALA 228 CO 0.17 -0.77 0.00 0.38 0.00 0.00 0.00 179.25 179.03 1woq h ASP 229 N 0.29 0.00 1.49 0.00 2.03 -1.85 -1.10 116.42 117.28 1woq h ASP 229 Ca 0.53 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.83 1woq h ASP 229 Cb 1.54 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 40.04 1woq h ASP 229 CO -0.18 0.00 -0.28 -0.33 -1.03 0.00 0.00 179.24 177.42 1woq h GLU 230 N 0.00 0.00 0.00 4.15 4.39 -1.24 -3.42 114.58 118.46 1woq h GLU 230 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1woq h GLU 230 Cb 0.13 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.78 1woq h GLU 230 CO 0.00 0.00 -0.32 2.48 -1.16 0.00 0.00 179.01 180.01 1woq n TYR 231 N -2.62 0.00 -0.35 4.33 4.11 -0.86 -4.67 117.16 117.10 1woq n TYR 231 Ca 0.04 0.00 0.08 0.00 -0.00 0.00 0.00 57.90 58.01 1woq n TYR 231 Cb 0.49 0.00 0.25 0.00 -0.00 0.00 0.00 39.34 40.08 1woq n TYR 231 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.86 176.79 1woq h LEU 232 N 0.00 0.86 -2.49 -3.48 3.38 -1.48 -1.31 115.31 110.78 1woq h LEU 232 Ca 0.00 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1woq h LEU 232 Cb 0.32 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 1woq h LEU 232 CO 0.00 0.43 0.02 -0.65 0.09 0.00 0.00 178.44 178.33 1woq h PRO 233 N 0.92 0.00 0.00 1.13 0.11 -1.81 -1.89 132.00 130.46 1woq h PRO 233 Ca 0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.61 1woq h PRO 233 Cb 0.56 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.67 1woq h PRO 233 CO -0.29 0.00 -0.34 -0.91 -0.21 0.00 0.00 178.00 176.25 1woq h ASN 234 N 0.00 0.00 -4.08 -2.05 2.35 -1.58 -3.47 115.58 106.75 1woq h ASN 234 Ca 0.01 -0.06 -0.47 0.00 -0.55 0.00 0.00 56.30 55.22 1woq h ASN 234 Cb 0.05 0.00 0.03 0.00 0.05 0.00 0.00 38.32 38.45 1woq h ASN 234 CO -0.00 0.03 0.39 -0.76 -1.65 0.00 0.00 177.43 175.44 1woq s LEU 235 N -4.97 3.81 -0.48 1.61 1.43 -0.71 -5.02 118.68 114.34 1woq s LEU 235 Ca 0.07 1.94 0.03 0.00 -1.03 0.00 0.00 54.13 55.14 1woq s LEU 235 Cb 0.10 -4.56 0.16 0.00 0.03 0.00 0.00 46.19 41.92 1woq s LEU 235 CO 0.68 -0.85 0.33 -0.13 0.23 0.00 0.00 176.35 176.61 1woq s ARG 236 N -3.30 1.36 0.35 1.70 1.81 -1.26 -5.07 118.95 114.54 1woq s ARG 236 Ca 0.68 -2.29 0.08 0.00 -1.72 0.00 0.00 55.73 52.48 1woq s ARG 236 Cb -0.17 -2.18 -0.04 0.00 -0.45 0.00 0.00 34.95 32.10 1woq s ARG 236 CO 0.22 -1.27 0.13 -0.51 -0.68 0.00 0.00 175.30 173.18 1woq s LEU 237 N -0.10 3.21 0.00 2.53 1.43 -1.26 -5.01 118.68 119.48 1woq s LEU 237 Ca 0.24 -0.82 0.25 0.00 -1.03 0.00 0.00 54.13 52.78 1woq s LEU 237 Cb -0.10 -1.67 0.49 0.00 0.03 0.00 0.00 46.19 44.94 1woq s LEU 237 CO -0.10 -0.31 1.42 -2.11 0.23 0.00 0.00 176.35 175.48 1woq n ARG 238 N -1.13 1.95 -4.60 1.70 1.85 -1.26 -4.87 116.66 110.30 1woq n ARG 238 Ca -0.03 -1.47 -0.34 0.00 -1.00 0.00 0.00 57.85 55.01 1woq n ARG 238 Cb 0.62 -1.47 -0.12 0.00 -1.05 0.00 0.00 32.46 30.44 1woq n ARG 238 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1woq s THR 239 N -2.06 3.62 0.40 8.89 2.01 -1.26 -5.09 115.64 122.15 1woq s THR 239 Ca 0.30 -0.49 -0.26 0.00 0.31 0.00 0.00 61.69 61.55 1woq s THR 239 Cb 0.20 -2.51 -0.09 0.00 0.01 0.00 0.00 72.50 70.11 1woq s THR 239 CO 0.34 0.56 1.36 -2.84 -0.69 0.00 0.00 174.62 173.35 1woq s PRO 240 N -0.30 3.96 -0.03 4.92 0.02 -1.26 -4.85 135.00 137.46 1woq s PRO 240 Ca 0.04 2.29 0.00 0.00 0.02 0.00 0.00 61.00 63.36 1woq s PRO 240 Cb -0.13 -2.80 0.03 0.00 0.02 0.00 0.00 34.50 31.62 1woq s PRO 240 CO 0.02 -0.55 -0.00 -1.50 -0.33 0.00 0.00 177.00 174.64 1woq s ILE 241 N -1.21 0.23 0.05 2.83 2.07 -1.26 -1.48 121.20 122.43 1woq s ILE 241 Ca 0.56 0.07 -0.02 0.00 -1.41 0.00 0.00 60.65 59.86 1woq s ILE 241 Cb -0.41 -0.32 -0.03 0.00 0.13 0.00 0.00 42.46 41.82 1woq s ILE 241 CO 0.53 0.16 -0.01 0.68 -1.91 0.00 0.00 174.94 174.40 1woq s VAL 242 N 1.10 0.19 0.54 4.00 -7.23 -0.74 -5.00 120.40 113.26 1woq s VAL 242 Ca -0.09 -1.56 -0.17 0.00 -1.81 0.00 0.00 61.98 58.35 1woq s VAL 242 Cb -0.14 -1.25 -0.06 0.00 0.56 0.00 0.00 36.38 35.49 1woq s VAL 242 CO -0.02 -0.86 1.04 -2.16 -0.31 0.00 0.00 175.10 172.79 1woq s PRO 243 N -3.41 3.59 0.35 4.82 0.04 -1.26 -0.37 135.00 138.77 1woq s PRO 243 Ca 0.02 1.20 -0.28 0.00 0.04 0.00 0.00 61.00 61.98 1woq s PRO 243 Cb 0.04 -2.07 -0.11 0.00 0.04 0.00 0.00 34.50 32.40 1woq s PRO 243 CO -0.08 -0.58 1.48 0.00 0.04 0.00 0.00 177.00 177.86 1woq s ALA 244 N -2.35 3.60 0.08 8.56 0.00 0.83 -4.69 121.76 127.79 1woq s ALA 244 Ca 0.64 1.53 -0.21 0.00 0.00 0.00 0.00 51.96 53.93 1woq s ALA 244 Cb -0.15 -3.60 -0.11 0.00 0.00 0.00 0.00 23.12 19.26 1woq s ALA 244 CO 0.30 -0.99 1.57 0.28 0.00 0.00 0.00 175.76 176.92 1woq h VAL 245 N 3.07 1.20 0.00 0.00 2.07 -1.93 -2.75 116.25 117.91 1woq h VAL 245 Ca -0.50 -0.63 0.00 0.00 0.82 0.00 0.00 66.70 66.39 1woq h VAL 245 Cb 1.23 1.30 0.00 0.00 -1.52 0.00 0.00 31.29 32.31 1woq h VAL 245 CO 0.67 0.19 0.00 0.18 0.02 0.00 0.00 177.57 178.63 1woq n LEU 246 N -4.81 0.00 0.00 2.57 4.32 -1.26 -4.98 117.00 112.84 1woq n LEU 246 Ca -0.05 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.94 1woq n LEU 246 Cb 0.16 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.96 1woq n LEU 246 CO 0.35 0.00 0.00 -1.14 -1.22 0.00 0.00 177.39 175.38 1woq n ARG 247 N -0.66 0.00 -0.34 3.23 0.63 -1.04 -1.55 116.66 116.94 1woq n ARG 247 Ca 0.06 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.00 1woq n ARG 247 Cb 0.03 0.00 0.13 0.00 0.45 0.00 0.00 32.46 33.07 1woq n ARG 247 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 1woq n ASN 248 N -1.10 2.78 -0.57 6.15 4.05 -1.26 -3.11 115.26 122.20 1woq n ASN 248 Ca 0.00 -2.37 0.07 0.00 0.45 0.00 0.00 54.58 52.73 1woq n ASN 248 Cb 0.00 -0.58 0.06 0.00 1.23 0.00 0.00 39.78 40.49 1woq n ASN 248 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 177.26 175.42 1woq n GLU 249 N 0.16 1.00 0.08 1.20 2.13 -0.59 -4.48 120.64 120.14 1woq n GLU 249 Ca 0.12 -1.36 0.03 0.00 0.66 0.00 0.00 57.16 56.61 1woq n GLU 249 Cb 0.65 -1.27 0.41 0.00 0.27 0.00 0.00 31.44 31.50 1woq n GLU 249 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1woq h ALA 250 N 2.80 1.60 -0.17 4.31 0.00 -1.49 -2.74 119.26 123.56 1woq h ALA 250 Ca 0.00 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1woq h ALA 250 Cb 0.60 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1woq h ALA 250 CO 0.00 0.30 0.05 0.78 0.00 0.00 0.00 179.25 180.38 1woq h GLY 251 N 0.62 0.29 0.96 0.00 0.00 -1.83 0.24 103.07 103.34 1woq h GLY 251 Ca 0.08 -0.18 0.01 0.00 0.00 0.00 0.00 47.33 47.24 1woq h GLY 251 CO 0.00 0.17 0.22 -2.22 0.00 0.00 0.00 176.54 174.71 1woq h ILE 252 N 0.09 1.06 -0.40 2.60 2.04 -1.82 -0.64 117.51 120.44 1woq h ILE 252 Ca 0.05 -0.15 -0.07 0.00 1.00 0.00 0.00 64.86 65.69 1woq h ILE 252 Cb 0.25 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 1woq h ILE 252 CO -0.00 0.08 -0.01 0.58 0.00 0.00 0.00 178.15 178.80 1woq h VAL 253 N 0.45 1.26 -0.29 1.67 2.07 -1.40 -2.82 116.25 117.20 1woq h VAL 253 Ca 0.14 -1.03 -0.04 0.00 0.82 0.00 0.00 66.70 66.58 1woq h VAL 253 Cb -0.03 1.13 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 1woq h VAL 253 CO -0.05 0.35 -0.01 1.23 0.02 0.00 0.00 177.57 179.11 1woq h GLY 254 N 0.54 0.48 1.05 2.17 0.00 -0.31 -1.17 103.07 105.83 1woq h GLY 254 Ca 0.11 -0.27 -0.06 0.00 0.00 0.00 0.00 47.33 47.11 1woq h GLY 254 CO 0.02 0.26 0.25 0.00 0.00 0.00 0.00 176.54 177.06 1woq h ALA 255 N 1.57 0.97 -0.50 3.60 0.00 -0.96 -1.09 119.26 122.84 1woq h ALA 255 Ca 0.09 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 1woq h ALA 255 Cb 0.31 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1woq h ALA 255 CO 0.01 0.64 -0.13 0.00 0.00 0.00 0.00 179.25 179.77 1woq h ALA 256 N 1.13 0.81 -0.54 0.00 0.00 -1.16 -2.85 119.26 116.65 1woq h ALA 256 Ca 0.24 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 54.81 1woq h ALA 256 Cb 0.29 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1woq h ALA 256 CO -0.01 0.66 0.35 0.82 0.00 0.00 0.00 179.25 181.07 1woq h ILE 257 N 0.85 1.11 -0.50 0.00 2.04 -0.75 -2.53 117.51 117.73 1woq h ILE 257 Ca 0.13 -0.24 0.07 0.00 1.00 0.00 0.00 64.86 65.82 1woq h ILE 257 Cb 0.68 0.34 -0.06 0.00 -0.74 0.00 0.00 36.82 37.05 1woq h ILE 257 CO 0.05 0.13 0.16 -0.08 0.00 0.00 0.00 178.15 178.41 1woq h GLU 258 N 0.71 0.32 -0.46 2.37 4.57 -1.03 -1.27 114.58 119.79 1woq h GLU 258 Ca 0.21 -0.02 0.05 0.00 -1.18 0.00 0.00 59.36 58.42 1woq h GLU 258 Cb -0.05 -0.07 -0.05 0.00 -0.16 0.00 0.00 28.75 28.42 1woq h GLU 258 CO -0.06 0.21 0.18 0.82 -1.18 0.00 0.00 179.01 178.98 1woq h ILE 259 N 0.33 0.88 0.00 2.32 1.08 -1.24 -1.57 117.51 119.31 1woq h ILE 259 Ca 0.24 -0.13 0.00 0.00 -0.39 0.00 0.00 64.86 64.59 1woq h ILE 259 Cb 0.27 0.48 0.00 0.00 -3.07 0.00 0.00 36.82 34.51 1woq h ILE 259 CO -0.26 0.07 0.00 0.00 -0.69 0.00 0.00 178.15 177.27 1woq h ALA 260 N 1.29 1.00 -0.48 1.87 0.00 -0.96 -1.74 119.26 120.24 1woq h ALA 260 Ca 0.21 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.99 1woq h ALA 260 Cb 0.19 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1woq h ALA 260 CO -0.20 0.00 -0.22 -0.07 0.00 0.00 0.00 179.25 178.76 1woq h LEU 261 N 0.00 1.02 0.00 0.00 3.38 -0.20 -3.33 115.31 116.18 1woq h LEU 261 Ca 0.00 -0.40 -0.35 0.00 0.09 0.00 0.00 57.88 57.23 1woq h LEU 261 Cb 0.36 -0.28 -0.07 0.00 0.09 0.00 0.00 40.66 40.77 1woq h LEU 261 CO 0.00 1.19 -2.30 0.00 0.09 0.00 0.00 178.44 177.43 1woq n GLN 262 N -4.12 0.91 0.00 1.13 0.00 -1.20 -5.13 117.38 108.97 1woq n GLN 262 Ca -0.00 -0.00 0.15 0.00 0.00 0.00 0.00 57.00 57.15 1woq n GLN 262 Cb 0.46 -1.48 0.83 0.00 0.00 0.00 0.00 30.24 30.05 1woq n GLN 262 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78