#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 3.69 0.84 5.41 0.00 -1.26 -4.90 121.76 125.53 1woq s ALA 12 Ca 0.00 1.25 -0.12 0.00 0.00 0.00 0.00 51.96 53.09 1woq s ALA 12 Cb 0.00 -3.58 0.09 0.00 0.00 0.00 0.00 23.12 19.63 1woq s ALA 12 CO 0.00 -0.70 1.13 -1.25 0.00 0.00 0.00 175.76 174.94 1woq s PRO 13 N 1.09 1.76 0.03 0.00 0.04 -1.26 -4.77 135.00 131.88 1woq s PRO 13 Ca 0.67 0.36 0.02 0.00 0.04 0.00 0.00 61.00 62.10 1woq s PRO 13 Cb -0.40 -1.90 -0.02 0.00 0.04 0.00 0.00 34.50 32.21 1woq s PRO 13 CO 0.31 -1.79 -0.08 -0.51 0.04 0.00 0.00 177.00 174.98 1woq s LEU 14 N -5.79 2.17 0.04 -3.56 1.43 -0.43 -4.61 118.68 107.93 1woq s LEU 14 Ca 0.62 -0.40 -0.27 0.00 -1.03 0.00 0.00 54.13 53.06 1woq s LEU 14 Cb -0.13 -0.24 -0.05 0.00 0.03 0.00 0.00 46.19 45.80 1woq s LEU 14 CO 0.52 -0.10 0.83 -0.63 0.23 0.00 0.00 176.35 177.21 1woq s ILE 15 N -0.93 4.73 -0.03 -0.59 1.01 -1.26 -0.26 121.20 123.87 1woq s ILE 15 Ca -0.05 1.76 0.07 0.00 0.00 0.00 0.00 60.65 62.43 1woq s ILE 15 Cb -0.07 -4.18 -0.02 0.00 0.01 0.00 0.00 42.46 38.20 1woq s ILE 15 CO 0.00 0.32 -0.23 -0.83 0.00 0.00 0.00 174.94 174.20 1woq s GLY 16 N 0.18 1.14 -0.06 6.18 0.00 -0.63 -1.82 107.32 112.32 1woq s GLY 16 Ca 0.42 -0.98 0.04 0.00 0.00 0.00 0.00 44.72 44.20 1woq s GLY 16 CO 0.25 -0.76 -0.19 -0.42 0.00 0.00 0.00 173.10 171.98 1woq s ILE 17 N -0.43 1.59 -0.24 0.90 -1.09 0.13 -1.79 121.20 120.26 1woq s ILE 17 Ca 0.06 -0.79 0.00 0.00 -2.23 0.00 0.00 60.65 57.69 1woq s ILE 17 Cb -0.10 -1.37 0.04 0.00 -1.58 0.00 0.00 42.46 39.45 1woq s ILE 17 CO 0.00 0.45 -0.10 -0.62 -1.23 0.00 0.00 174.94 173.45 1woq s ASP 18 N 0.11 4.18 -0.39 3.58 2.15 1.00 -0.63 116.67 126.66 1woq s ASP 18 Ca -0.07 -1.02 -0.20 0.00 0.43 0.00 0.00 52.55 51.68 1woq s ASP 18 Cb -0.13 -1.60 0.01 0.00 -0.30 0.00 0.00 42.92 40.90 1woq s ASP 18 CO 0.03 -0.13 0.63 -0.63 -0.17 0.00 0.00 175.17 174.90 1woq s ILE 19 N 1.24 4.87 0.53 4.11 1.01 -1.23 -1.95 121.20 129.79 1woq s ILE 19 Ca -0.02 0.36 0.04 0.00 0.00 0.00 0.00 60.65 61.03 1woq s ILE 19 Cb -0.17 -4.13 0.02 0.00 0.01 0.00 0.00 42.46 38.19 1woq s ILE 19 CO -0.06 -0.44 0.26 -0.83 0.00 0.00 0.00 174.94 173.87 1woq s GLY 20 N 1.89 2.62 0.21 6.18 0.00 -0.12 -4.45 107.32 113.65 1woq s GLY 20 Ca 0.23 -0.91 -0.04 0.00 0.00 0.00 0.00 44.72 44.01 1woq s GLY 20 CO 0.17 -2.04 1.59 -1.33 0.00 0.00 0.00 173.10 171.49 1woq h GLY 21 N 0.97 0.75 0.00 0.20 0.00 -1.96 -3.34 103.07 99.68 1woq h GLY 21 Ca -0.39 -0.71 0.00 0.00 0.00 0.00 0.00 47.33 46.23 1woq h GLY 21 CO 0.63 0.64 -1.37 -1.30 0.00 0.00 0.00 176.54 175.14 1woq n THR 22 N -4.06 0.00 -3.76 4.70 -2.24 -1.26 -4.76 114.28 102.90 1woq n THR 22 Ca -0.01 -0.26 -0.13 0.00 -2.27 0.00 0.00 64.05 61.38 1woq n THR 22 Cb 0.49 0.36 -0.08 0.00 -2.10 0.00 0.00 70.33 68.99 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 -3.13 -0.15 -0.29 3.38 0.00 -1.25 -2.48 107.32 103.40 1woq s GLY 23 Ca -0.03 0.27 -0.00 0.00 0.00 0.00 0.00 44.72 44.96 1woq s GLY 23 CO 0.48 0.06 -0.04 -0.42 0.00 0.00 0.00 173.10 173.18 1woq s ILE 24 N -1.53 2.71 0.22 0.90 1.01 -0.47 -0.94 121.20 123.10 1woq s ILE 24 Ca -0.12 -1.46 0.10 0.00 0.00 0.00 0.00 60.65 59.17 1woq s ILE 24 Cb -0.04 -2.56 -0.05 0.00 0.01 0.00 0.00 42.46 39.82 1woq s ILE 24 CO 0.03 -0.07 -0.20 -1.59 0.00 0.00 0.00 174.94 173.11 1woq s LYS 25 N 1.20 1.50 0.19 2.79 -2.85 -0.82 -1.50 119.74 120.25 1woq s LYS 25 Ca -0.06 -1.60 -0.08 0.00 -1.00 0.00 0.00 55.97 53.22 1woq s LYS 25 Cb -0.20 -1.59 -0.01 0.00 -2.06 0.00 0.00 37.83 33.96 1woq s LYS 25 CO -0.02 0.31 0.30 0.20 0.10 0.00 0.00 175.35 176.23 1woq s GLY 26 N -3.09 0.71 0.15 0.59 0.00 0.69 -0.00 107.32 106.36 1woq s GLY 26 Ca 0.23 -1.07 -0.23 0.00 0.00 0.00 0.00 44.72 43.65 1woq s GLY 26 CO 0.11 -0.91 0.60 -0.32 0.00 0.00 0.00 173.10 172.58 1woq s GLY 27 N -3.02 -0.62 -0.30 0.20 0.00 -0.74 -0.64 107.32 102.20 1woq s GLY 27 Ca 0.23 0.52 -0.18 0.00 0.00 0.00 0.00 44.72 45.30 1woq s GLY 27 CO 0.05 0.19 0.50 -0.42 0.00 0.00 0.00 173.10 173.42 1woq s ILE 28 N -3.64 5.06 -0.20 0.90 1.01 -1.26 -1.60 121.20 121.45 1woq s ILE 28 Ca 0.01 0.61 -0.09 0.00 0.00 0.00 0.00 60.65 61.17 1woq s ILE 28 Cb -0.01 -3.87 -0.05 0.00 0.01 0.00 0.00 42.46 38.54 1woq s ILE 28 CO -0.12 -0.04 0.12 -0.69 0.00 0.00 0.00 174.94 174.21 1woq s VAL 29 N 2.32 5.25 -0.52 2.92 1.01 0.64 0.26 120.40 132.29 1woq s VAL 29 Ca 0.19 0.13 -0.18 0.00 0.00 0.00 0.00 61.98 62.13 1woq s VAL 29 Cb -0.16 -3.40 0.07 0.00 0.00 0.00 0.00 36.38 32.90 1woq s VAL 29 CO 0.11 0.43 0.59 -0.62 0.00 0.00 0.00 175.10 175.61 1woq s ASP 30 N 0.50 6.20 0.08 3.32 -1.08 -0.01 -1.32 116.67 124.36 1woq s ASP 30 Ca 0.07 -1.16 0.15 0.00 -0.52 0.00 0.00 52.55 51.09 1woq s ASP 30 Cb -0.12 -2.27 0.64 0.00 -1.46 0.00 0.00 42.92 39.71 1woq s ASP 30 CO -0.00 -0.89 1.46 0.18 0.52 0.00 0.00 175.17 176.43 1woq n LEU 31 N 5.97 0.20 0.08 -1.34 4.77 -1.26 -0.48 117.00 124.93 1woq n LEU 31 Ca -0.09 0.56 -0.10 0.00 -0.03 0.00 0.00 56.01 56.35 1woq n LEU 31 Cb 0.44 -0.54 -0.03 0.00 -2.33 0.00 0.00 43.42 40.96 1woq n LEU 31 CO 0.54 -0.42 0.21 0.11 -1.33 0.00 0.00 177.39 176.49 1woq h LYS 32 N 0.00 0.25 0.00 3.23 6.56 -1.93 -3.34 116.57 121.35 1woq h LYS 32 Ca 0.00 -0.29 0.00 0.00 -1.06 0.00 0.00 60.65 59.30 1woq h LYS 32 Cb 0.21 0.09 0.00 0.00 -0.57 0.00 0.00 32.23 31.96 1woq h LYS 32 CO 0.00 1.01 -1.10 1.63 -2.06 0.00 0.00 179.45 178.94 1woq n LYS 33 N -3.66 1.62 -1.91 3.15 4.01 -0.99 -5.00 118.16 115.39 1woq n LYS 33 Ca -0.05 -0.06 -0.07 0.00 -0.51 0.00 0.00 58.31 57.62 1woq n LYS 33 Cb 0.84 -1.19 -0.01 0.00 -0.51 0.00 0.00 35.03 34.16 1woq n LYS 33 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1woq n GLY 34 N 1.56 0.28 3.37 0.72 0.00 0.36 -5.02 105.19 106.46 1woq n GLY 34 Ca -0.00 -0.62 -0.18 0.00 0.00 0.00 0.00 46.02 45.21 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 -3.92 1.48 0.22 1.61 1.02 -1.18 -4.98 119.74 113.99 1woq s LYS 35 Ca 0.00 -1.79 -0.14 0.00 0.02 0.00 0.00 55.97 54.06 1woq s LYS 35 Cb 0.00 -0.57 -0.08 0.00 -0.52 0.00 0.00 37.83 36.67 1woq s LYS 35 CO 0.00 -0.21 0.61 -0.51 -0.92 0.00 0.00 175.35 174.33 1woq s LEU 36 N -3.37 4.23 -0.30 3.17 1.02 -1.26 -0.83 118.68 121.34 1woq s LEU 36 Ca 0.35 1.12 -0.16 0.00 0.02 0.00 0.00 54.13 55.46 1woq s LEU 36 Cb 0.08 -3.60 -0.02 0.00 0.02 0.00 0.00 46.19 42.66 1woq s LEU 36 CO 0.13 -0.02 0.42 -0.76 0.02 0.00 0.00 176.35 176.14 1woq s LEU 37 N -2.43 4.21 0.00 1.79 1.43 0.14 -4.89 118.68 118.93 1woq s LEU 37 Ca 0.45 0.12 0.00 0.00 -1.03 0.00 0.00 54.13 53.66 1woq s LEU 37 Cb -0.13 -2.47 0.00 0.00 0.03 0.00 0.00 46.19 43.62 1woq s LEU 37 CO 0.20 -0.30 0.00 0.61 0.23 0.00 0.00 176.35 177.08 1woq n GLY 38 N 4.75 -1.79 3.89 -3.19 0.00 -1.26 -4.36 105.19 103.23 1woq n GLY 38 Ca -0.07 -1.37 -0.30 0.00 0.00 0.00 0.00 46.02 44.28 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 3.70 0.53 1.61 0.41 -1.26 -4.97 118.70 118.72 1woq s GLU 39 Ca 0.00 0.15 -0.17 0.00 -0.41 0.00 0.00 54.97 54.54 1woq s GLU 39 Cb 0.00 -2.61 -0.07 0.00 -1.78 0.00 0.00 34.13 29.67 1woq s GLU 39 CO 0.00 0.20 1.01 -0.98 -0.49 0.00 0.00 175.26 175.00 1woq s ARG 40 N -3.40 3.76 -0.05 1.61 1.70 -1.26 -4.80 118.95 116.51 1woq s ARG 40 Ca 0.46 1.10 0.06 0.00 -0.47 0.00 0.00 55.73 56.88 1woq s ARG 40 Cb -0.11 -2.10 -0.01 0.00 -0.57 0.00 0.00 34.95 32.16 1woq s ARG 40 CO 0.28 -0.44 -0.25 0.12 -1.08 0.00 0.00 175.30 173.93 1woq s PHE 41 N -2.45 2.36 0.03 5.89 5.36 0.19 -4.95 117.98 124.42 1woq s PHE 41 Ca 0.62 -0.65 0.02 0.00 -0.96 0.00 0.00 56.93 55.96 1woq s PHE 41 Cb -0.12 -1.55 -0.02 0.00 -0.34 0.00 0.00 43.02 40.99 1woq s PHE 41 CO 0.30 -0.17 -0.07 0.50 -1.46 0.00 0.00 175.22 174.31 1woq s ARG 42 N -0.25 0.49 0.12 10.12 3.52 -1.26 -0.23 118.95 131.46 1woq s ARG 42 Ca -0.01 -0.60 0.05 0.00 -0.13 0.00 0.00 55.73 55.04 1woq s ARG 42 Cb -0.13 -0.32 -0.04 0.00 -1.56 0.00 0.00 34.95 32.91 1woq s ARG 42 CO 0.03 0.07 -0.12 0.14 -0.81 0.00 0.00 175.30 174.60 1woq s VAL 43 N -1.04 1.16 0.44 7.11 -7.23 -0.56 -4.99 120.40 115.29 1woq s VAL 43 Ca -0.07 -1.76 -0.25 0.00 -1.81 0.00 0.00 61.98 58.09 1woq s VAL 43 Cb -0.08 -1.53 -0.08 0.00 0.56 0.00 0.00 36.38 35.25 1woq s VAL 43 CO 0.00 -0.53 1.29 -2.84 -0.31 0.00 0.00 175.10 172.71 1woq s PRO 44 N -2.93 3.80 -0.09 4.82 0.02 -1.26 -1.37 135.00 137.99 1woq s PRO 44 Ca 0.09 2.10 -0.30 0.00 0.02 0.00 0.00 61.00 62.92 1woq s PRO 44 Cb -0.03 -2.62 -0.04 0.00 0.02 0.00 0.00 34.50 31.84 1woq s PRO 44 CO 0.02 -0.61 1.41 0.99 -0.33 0.00 0.00 177.00 178.48 1woq s THR 45 N -1.32 3.94 0.69 0.99 2.01 -1.03 -4.66 115.64 116.26 1woq s THR 45 Ca 0.60 1.19 -0.17 0.00 0.31 0.00 0.00 61.69 63.62 1woq s THR 45 Cb -0.37 -3.77 0.01 0.00 0.01 0.00 0.00 72.50 68.39 1woq s THR 45 CO 0.46 -0.08 1.26 -0.81 -0.69 0.00 0.00 174.62 174.76 1woq n PRO 46 N 6.47 0.86 -3.81 4.92 -0.04 -1.26 -4.91 135.00 137.23 1woq n PRO 46 Ca 0.15 0.36 -0.23 0.00 -0.04 0.00 0.00 63.50 63.74 1woq n PRO 46 Cb 0.44 -2.50 -0.17 0.00 -0.04 0.00 0.00 33.50 31.23 1woq n PRO 46 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1woq s GLN 47 N -3.55 0.65 0.69 0.54 -1.52 -1.26 -2.29 119.66 112.91 1woq s GLN 47 Ca 0.80 0.08 -0.15 0.00 -1.95 0.00 0.00 55.36 54.14 1woq s GLN 47 Cb -0.36 -0.97 0.01 0.00 -0.22 0.00 0.00 33.01 31.48 1woq s GLN 47 CO 0.43 -0.28 1.14 -1.25 -0.25 0.00 0.00 175.29 175.08 1woq s PRO 48 N 1.86 2.55 -1.16 2.91 0.04 -1.26 -5.07 135.00 134.88 1woq s PRO 48 Ca 0.03 1.53 -0.13 0.00 0.04 0.00 0.00 61.00 62.47 1woq s PRO 48 Cb -0.12 -1.91 0.19 0.00 0.04 0.00 0.00 34.50 32.69 1woq s PRO 48 CO -0.05 -1.47 1.33 0.00 0.04 0.00 0.00 177.00 176.86 1woq s ALA 49 N -2.21 4.07 0.38 8.56 0.00 -0.97 -4.87 121.76 126.73 1woq s ALA 49 Ca 0.70 -3.39 0.01 0.00 0.00 0.00 0.00 51.96 49.28 1woq s ALA 49 Cb -0.24 -4.01 -0.02 0.00 0.00 0.00 0.00 23.12 18.86 1woq s ALA 49 CO 0.43 -2.68 0.58 0.95 0.00 0.00 0.00 175.76 175.04 1woq s THR 50 N 1.17 4.57 0.25 0.00 -4.23 -1.26 -4.13 115.64 112.01 1woq s THR 50 Ca 0.39 -0.55 -0.05 0.00 -1.18 0.00 0.00 61.69 60.31 1woq s THR 50 Cb -0.04 -3.67 0.24 0.00 1.34 0.00 0.00 72.50 70.37 1woq s THR 50 CO -0.02 -0.42 1.67 -0.65 -0.54 0.00 0.00 174.62 174.66 1woq h PRO 51 N 0.64 0.23 -0.14 3.99 0.11 -1.94 0.17 132.00 135.05 1woq h PRO 51 Ca -0.48 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 1woq h PRO 51 Cb 1.24 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1woq h PRO 51 CO 0.59 0.15 0.04 1.49 -0.21 0.00 0.00 178.00 180.06 1woq h GLU 52 N 0.24 0.22 -0.46 1.05 4.81 -1.99 -0.74 114.58 117.71 1woq h GLU 52 Ca 0.42 -0.05 -0.11 0.00 -0.13 0.00 0.00 59.36 59.50 1woq h GLU 52 Cb 0.74 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.07 1woq h GLU 52 CO -0.54 0.36 -0.13 0.66 -0.73 0.00 0.00 179.01 178.63 1woq h SER 53 N 0.03 0.91 -0.66 1.04 4.64 -1.71 -2.64 113.55 115.17 1woq h SER 53 Ca 0.04 -0.37 -0.08 0.00 -0.47 0.00 0.00 61.79 60.92 1woq h SER 53 Cb 0.24 -0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 1woq h SER 53 CO -0.00 1.07 0.10 0.58 -0.87 0.00 0.00 176.83 177.71 1woq h VAL 54 N 0.74 1.26 -0.82 0.95 2.07 -0.70 -2.27 116.25 117.49 1woq h VAL 54 Ca 0.11 -1.05 0.02 0.00 0.82 0.00 0.00 66.70 66.61 1woq h VAL 54 Cb 0.68 0.64 -0.05 0.00 -1.52 0.00 0.00 31.29 31.04 1woq h VAL 54 CO 0.05 0.39 0.53 0.00 0.02 0.00 0.00 177.57 178.56 1woq h ALA 55 N 1.07 1.06 -0.56 1.67 0.00 -0.99 -0.31 119.26 121.20 1woq h ALA 55 Ca 0.20 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1woq h ALA 55 Cb 0.45 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1woq h ALA 55 CO 0.01 0.38 0.20 0.93 0.00 0.00 0.00 179.25 180.77 1woq h GLU 56 N 1.05 0.85 -0.55 0.00 4.39 -1.18 -1.42 114.58 117.71 1woq h GLU 56 Ca 0.32 -0.17 -0.04 0.00 0.34 0.00 0.00 59.36 59.80 1woq h GLU 56 Cb -0.04 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.46 1woq h GLU 56 CO -0.10 0.75 0.17 0.00 -1.16 0.00 0.00 179.01 178.68 1woq h ALA 57 N 1.06 0.73 -0.67 3.43 0.00 -0.85 -2.06 119.26 120.90 1woq h ALA 57 Ca 0.18 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1woq h ALA 57 Cb 0.24 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1woq h ALA 57 CO -0.01 0.39 0.31 0.28 0.00 0.00 0.00 179.25 180.22 1woq h VAL 58 N 0.77 1.23 -0.88 0.00 2.07 -0.93 -2.13 116.25 116.39 1woq h VAL 58 Ca 0.18 -0.66 0.05 0.00 0.82 0.00 0.00 66.70 67.09 1woq h VAL 58 Cb 0.28 0.42 -0.06 0.00 -1.52 0.00 0.00 31.29 30.42 1woq h VAL 58 CO -0.01 0.27 0.55 0.00 0.02 0.00 0.00 177.57 178.41 1woq h ALA 59 N 1.14 1.19 -0.56 1.67 0.00 -0.92 -0.62 119.26 121.15 1woq h ALA 59 Ca 0.23 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.05 1woq h ALA 59 Cb 0.14 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1woq h ALA 59 CO -0.03 0.34 0.10 -0.07 0.00 0.00 0.00 179.25 179.59 1woq h LEU 60 N 1.04 0.89 -0.21 0.00 3.38 -0.92 0.73 115.31 120.21 1woq h LEU 60 Ca 0.37 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 1woq h LEU 60 Cb 0.11 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1woq h LEU 60 CO -0.15 0.92 0.05 0.58 0.09 0.00 0.00 178.44 179.93 1woq h VAL 61 N 0.82 1.21 -0.78 1.22 2.07 -0.84 -1.77 116.25 118.18 1woq h VAL 61 Ca 0.17 -0.68 -0.03 0.00 0.82 0.00 0.00 66.70 66.98 1woq h VAL 61 Cb 0.40 1.26 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 1woq h VAL 61 CO 0.01 0.21 0.35 0.58 0.02 0.00 0.00 177.57 178.75 1woq h VAL 62 N 0.15 1.25 -0.59 2.57 2.07 -1.02 -1.96 116.25 118.72 1woq h VAL 62 Ca 0.07 -0.74 -0.01 0.00 0.82 0.00 0.00 66.70 66.84 1woq h VAL 62 Cb 0.28 0.27 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 1woq h VAL 62 CO 0.00 0.31 0.33 0.00 0.02 0.00 0.00 177.57 178.23 1woq h ALA 63 N 1.26 0.76 0.08 1.67 0.00 -0.68 0.44 119.26 122.79 1woq h ALA 63 Ca 0.27 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1woq h ALA 63 Cb 0.15 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1woq h ALA 63 CO -0.03 0.28 -0.04 1.49 0.00 0.00 0.00 179.25 180.95 1woq h GLU 64 N 0.80 -0.10 -0.49 0.00 4.57 -0.96 -2.69 114.58 115.71 1woq h GLU 64 Ca 0.21 0.01 -0.08 0.00 -1.18 0.00 0.00 59.36 58.32 1woq h GLU 64 Cb 0.04 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.63 1woq h GLU 64 CO -0.03 -0.01 -0.01 -0.07 -1.18 0.00 0.00 179.01 177.70 1woq h LEU 65 N -0.17 0.80 -1.70 1.64 3.38 -1.21 -2.69 115.31 115.36 1woq h LEU 65 Ca -0.01 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1woq h LEU 65 Cb 0.14 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.67 1woq h LEU 65 CO 0.02 0.87 0.00 0.28 0.09 0.00 0.00 178.44 179.70 1woq h SER 66 N 0.77 0.00 0.53 -0.43 0.02 -0.82 -2.46 113.55 111.17 1woq h SER 66 Ca 0.15 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 1woq h SER 66 Cb 0.48 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.02 1woq h SER 66 CO 0.02 0.00 -0.31 0.00 -1.14 0.00 0.00 176.83 175.40 1woq n ALA 67 N -2.05 3.13 -1.81 3.77 0.00 -1.02 -4.79 120.51 117.75 1woq n ALA 67 Ca -0.00 -0.30 -0.34 0.00 0.00 0.00 0.00 53.44 52.80 1woq n ALA 67 Cb 0.24 -1.22 -0.06 0.00 0.00 0.00 0.00 19.45 18.41 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 -2.84 4.14 0.55 0.00 0.52 -0.92 -4.95 118.95 115.45 1woq s ARG 68 Ca 0.16 1.23 0.23 0.00 -0.52 0.00 0.00 55.73 56.84 1woq s ARG 68 Cb 0.18 -2.24 1.47 0.00 0.52 0.00 0.00 34.95 34.88 1woq s ARG 68 CO 0.61 -0.12 2.12 -1.00 0.02 0.00 0.00 175.30 176.94 1woq h PRO 69 N 1.98 0.00 -0.25 3.54 0.13 -1.90 -0.70 132.00 134.80 1woq h PRO 69 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1woq h PRO 69 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1woq h PRO 69 CO 0.61 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.53 1woq n GLU 70 N -4.23 1.79 -2.11 0.86 0.00 -1.26 -4.95 120.64 110.73 1woq n GLU 70 Ca 0.01 -1.20 -0.36 0.00 0.00 0.00 0.00 57.16 55.61 1woq n GLU 70 Cb 0.25 -1.35 0.02 0.00 0.00 0.00 0.00 31.44 30.35 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 -1.68 2.63 1.09 -1.84 0.00 -0.27 -4.92 121.76 116.77 1woq s ALA 71 Ca 0.29 0.95 -0.18 0.00 0.00 0.00 0.00 51.96 53.02 1woq s ALA 71 Cb 0.16 -3.42 0.25 0.00 0.00 0.00 0.00 23.12 20.11 1woq s ALA 71 CO 0.23 -0.99 1.24 -0.35 0.00 0.00 0.00 175.76 175.88 1woq n PRO 72 N -1.41 -1.96 -1.66 0.00 -0.04 -1.26 -4.96 135.00 123.71 1woq n PRO 72 Ca 0.13 -1.93 -0.42 0.00 -0.04 0.00 0.00 63.50 61.23 1woq n PRO 72 Cb 0.50 -1.46 0.00 0.00 -0.04 0.00 0.00 33.50 32.50 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 -4.22 0.82 -0.17 0.55 0.00 -1.26 -4.85 120.51 111.38 1woq n ALA 73 Ca -0.21 0.31 0.28 0.00 0.00 0.00 0.00 53.44 53.82 1woq n ALA 73 Cb 0.58 -2.18 0.72 0.00 0.00 0.00 0.00 19.45 18.57 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 2.12 2.82 -0.64 0.00 0.00 -1.94 -0.94 119.26 120.68 1woq h ALA 74 Ca -0.45 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1woq h ALA 74 Cb 1.31 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.16 1woq h ALA 74 CO 0.60 -1.08 0.00 0.41 0.00 0.00 0.00 179.25 179.18 1woq n GLY 75 N -1.71 2.53 3.76 0.00 0.00 -1.26 -4.95 105.19 103.56 1woq n GLY 75 Ca 0.18 -0.70 -0.38 0.00 0.00 0.00 0.00 46.02 45.12 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 -1.01 5.62 0.59 1.61 1.04 -0.36 -4.55 113.70 116.64 1woq s SER 76 Ca 0.43 2.60 -0.19 0.00 0.48 0.00 0.00 55.95 59.28 1woq s SER 76 Cb 0.23 -2.62 -0.04 0.00 0.10 0.00 0.00 66.02 63.68 1woq s SER 76 CO 0.30 -1.31 1.21 -2.16 0.98 0.00 0.00 173.24 172.25 1woq s PRO 77 N -2.81 2.99 -0.09 4.02 0.04 -1.26 -4.64 135.00 133.25 1woq s PRO 77 Ca 0.68 1.82 0.03 0.00 0.04 0.00 0.00 61.00 63.58 1woq s PRO 77 Cb -0.36 -1.93 -0.01 0.00 0.04 0.00 0.00 34.50 32.24 1woq s PRO 77 CO 0.43 -1.19 -0.20 0.08 0.04 0.00 0.00 177.00 176.16 1woq s VAL 78 N -1.60 2.46 -0.02 -0.36 1.01 0.23 -4.45 120.40 117.68 1woq s VAL 78 Ca 0.77 -0.90 -0.14 0.00 0.00 0.00 0.00 61.98 61.72 1woq s VAL 78 Cb -0.30 -1.96 -0.05 0.00 0.00 0.00 0.00 36.38 34.07 1woq s VAL 78 CO 0.33 0.56 0.38 -0.83 0.00 0.00 0.00 175.10 175.53 1woq s GLY 79 N 0.07 2.44 0.00 4.51 0.00 -0.75 -1.83 107.32 111.75 1woq s GLY 79 Ca -0.09 -0.27 0.00 0.00 0.00 0.00 0.00 44.72 44.37 1woq s GLY 79 CO 0.05 0.11 -0.02 0.14 0.00 0.00 0.00 173.10 173.39 1woq s VAL 80 N -1.00 0.12 0.25 1.40 1.01 -0.81 0.17 120.40 121.55 1woq s VAL 80 Ca 0.23 -0.26 0.06 0.00 0.00 0.00 0.00 61.98 62.01 1woq s VAL 80 Cb -0.16 -0.15 -0.03 0.00 0.00 0.00 0.00 36.38 36.04 1woq s VAL 80 CO 0.12 -0.09 0.31 0.42 0.00 0.00 0.00 175.10 175.86 1woq s THR 81 N -0.35 4.90 -0.17 3.92 -4.23 0.20 -0.95 115.64 118.97 1woq s THR 81 Ca -0.03 -1.14 -0.13 0.00 -1.18 0.00 0.00 61.69 59.21 1woq s THR 81 Cb -0.03 -3.67 0.05 0.00 1.34 0.00 0.00 72.50 70.19 1woq s THR 81 CO -0.00 -0.33 0.43 0.12 -0.54 0.00 0.00 174.62 174.30 1woq s PHE 82 N -2.05 -0.53 -1.27 3.99 5.36 -0.66 -3.47 117.98 119.35 1woq s PHE 82 Ca 0.34 1.23 -0.10 0.00 -0.96 0.00 0.00 56.93 57.44 1woq s PHE 82 Cb -0.09 0.21 -0.07 0.00 -0.34 0.00 0.00 43.02 42.74 1woq s PHE 82 CO 0.28 -0.28 2.47 -0.35 -1.46 0.00 0.00 175.22 175.88 1woq n PRO 83 N 3.38 2.81 -3.82 10.12 -0.04 -1.26 -1.54 135.00 144.65 1woq n PRO 83 Ca -0.17 -1.95 -0.01 0.00 -0.04 0.00 0.00 63.50 61.33 1woq n PRO 83 Cb 0.56 -2.75 0.01 0.00 -0.04 0.00 0.00 33.50 31.28 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 3.01 -0.12 0.11 0.55 0.00 -1.26 -4.53 107.32 105.08 1woq s GLY 84 Ca 0.55 0.05 -0.31 0.00 0.00 0.00 0.00 44.72 45.01 1woq s GLY 84 CO -0.04 2.04 1.41 -0.42 0.00 0.00 0.00 173.10 176.09 1woq s ILE 85 N -2.43 3.29 -0.19 0.90 1.01 -1.26 -4.43 121.20 118.09 1woq s ILE 85 Ca 0.20 0.90 0.01 0.00 0.00 0.00 0.00 60.65 61.76 1woq s ILE 85 Cb -0.00 -3.58 0.03 0.00 0.01 0.00 0.00 42.46 38.92 1woq s ILE 85 CO 0.02 0.06 -0.17 -0.63 0.00 0.00 0.00 174.94 174.22 1woq s ILE 86 N 1.28 2.00 -0.14 2.92 -1.09 -1.26 -0.36 121.20 124.54 1woq s ILE 86 Ca 0.65 -1.06 -0.00 0.00 -2.23 0.00 0.00 60.65 58.02 1woq s ILE 86 Cb -0.37 -1.89 0.03 0.00 -1.58 0.00 0.00 42.46 38.65 1woq s ILE 86 CO 0.30 0.39 -0.10 -1.10 -1.23 0.00 0.00 174.94 173.20 1woq s GLN 87 N 1.28 1.85 -1.47 2.79 -0.21 -0.57 -4.77 119.66 118.55 1woq s GLN 87 Ca 0.02 -0.47 -0.07 0.00 0.02 0.00 0.00 55.36 54.85 1woq s GLN 87 Cb -0.15 -1.94 0.05 0.00 1.00 0.00 0.00 33.01 31.97 1woq s GLN 87 CO -0.11 -0.30 0.68 0.72 -2.12 0.00 0.00 175.29 174.16 1woq n HIS 88 N 4.84 -1.87 -0.96 0.91 8.25 -1.26 -1.06 115.22 124.08 1woq n HIS 88 Ca -0.14 0.81 0.00 0.00 -0.26 0.00 0.00 57.72 58.13 1woq n HIS 88 Cb 0.49 -3.77 0.00 0.00 1.12 0.00 0.00 29.99 27.83 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 -1.72 0.37 3.53 -1.41 0.00 -1.26 -4.96 105.19 99.74 1woq n GLY 89 Ca -0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.53 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 -1.87 3.59 -0.12 1.61 1.01 -0.22 -1.13 120.40 123.26 1woq s VAL 90 Ca 0.00 -0.51 -0.29 0.00 0.00 0.00 0.00 61.98 61.18 1woq s VAL 90 Cb 0.00 -2.48 -0.01 0.00 0.00 0.00 0.00 36.38 33.89 1woq s VAL 90 CO 0.00 0.57 1.01 -0.69 0.00 0.00 0.00 175.10 176.00 1woq s VAL 91 N -0.50 4.77 -0.88 2.92 1.01 -0.36 -1.51 120.40 125.85 1woq s VAL 91 Ca 0.07 2.04 0.08 0.00 0.00 0.00 0.00 61.98 64.17 1woq s VAL 91 Cb -0.12 -4.31 0.13 0.00 0.00 0.00 0.00 36.38 32.08 1woq s VAL 91 CO 0.02 -0.02 0.94 1.41 0.00 0.00 0.00 175.10 177.45 1woq n HIS 92 N 5.18 0.14 -3.61 5.22 -0.00 0.51 -0.50 115.22 122.17 1woq n HIS 92 Ca 0.09 -0.21 -0.16 0.00 -0.00 0.00 0.00 57.72 57.44 1woq n HIS 92 Cb 0.48 -0.01 -0.07 0.00 -0.00 0.00 0.00 29.99 30.39 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 -0.81 -0.49 -0.40 0.41 1.04 -1.26 -4.81 113.70 107.38 1woq s SER 93 Ca 0.13 0.50 0.10 0.00 0.48 0.00 0.00 55.95 57.16 1woq s SER 93 Cb 0.08 0.47 0.36 0.00 0.10 0.00 0.00 66.02 67.03 1woq s SER 93 CO 0.11 -0.54 0.96 0.00 0.98 0.00 0.00 173.24 174.74 1woq n ALA 94 N 1.08 1.14 -0.20 5.32 0.00 -1.26 -4.22 120.51 122.36 1woq n ALA 94 Ca -0.20 -2.48 0.01 0.00 0.00 0.00 0.00 53.44 50.77 1woq n ALA 94 Cb 0.57 -1.02 0.10 0.00 0.00 0.00 0.00 19.45 19.10 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 2.90 0.61 0.00 0.00 0.00 -1.97 -3.14 119.26 117.66 1woq h ALA 95 Ca -0.03 0.18 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1woq h ALA 95 Cb 1.08 0.30 -0.07 0.00 0.00 0.00 0.00 17.79 19.10 1woq h ALA 95 CO 0.31 -0.38 -0.58 0.09 0.00 0.00 0.00 179.25 178.69 1woq n ASN 96 N -5.26 1.59 -4.24 0.00 4.13 -1.26 -5.04 115.26 105.19 1woq n ASN 96 Ca 0.09 -3.55 -0.13 0.00 1.68 0.00 0.00 54.58 52.67 1woq n ASN 96 Cb 0.35 -0.49 -0.10 0.00 -1.54 0.00 0.00 39.78 38.00 1woq n ASN 96 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 1woq s VAL 97 N -2.65 0.43 0.16 2.41 -7.23 -1.19 -5.02 120.40 107.31 1woq s VAL 97 Ca 0.37 -1.97 -0.34 0.00 -1.81 0.00 0.00 61.98 58.23 1woq s VAL 97 Cb 0.37 -2.31 -0.15 0.00 0.56 0.00 0.00 36.38 34.85 1woq s VAL 97 CO -0.08 -0.27 1.44 -0.67 -0.31 0.00 0.00 175.10 175.21 1woq n ASP 98 N -0.28 2.47 0.06 4.85 2.03 -1.26 -4.83 116.55 119.58 1woq n ASP 98 Ca -0.03 1.11 0.06 0.00 0.52 0.00 0.00 54.79 56.45 1woq n ASP 98 Cb 0.65 -1.34 0.28 0.00 -0.72 0.00 0.00 41.12 39.98 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 2.71 0.06 0.06 -0.67 4.76 -1.26 -1.57 118.16 122.25 1woq n LYS 99 Ca 0.16 0.49 0.08 0.00 -2.87 0.00 0.00 58.31 56.16 1woq n LYS 99 Cb 0.26 -1.67 0.35 0.00 -1.84 0.00 0.00 35.03 32.13 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 -1.80 0.27 0.16 4.39 3.41 -1.26 -1.68 113.62 117.11 1woq n SER 100 Ca 0.00 0.58 0.02 0.00 -0.26 0.00 0.00 58.87 59.21 1woq n SER 100 Cb 0.07 -0.63 0.24 0.00 -0.26 0.00 0.00 64.21 63.62 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 -2.22 7.33 4.06 -1.65 -3.43 115.95 120.04 1woq h TRP 101 Ca 0.00 0.00 -0.60 0.00 2.06 0.00 0.00 58.89 60.35 1woq h TRP 101 Cb 0.22 0.00 0.06 0.00 -1.00 0.00 0.00 29.16 28.44 1woq h TRP 101 CO 0.00 0.51 0.71 1.28 -3.56 0.00 0.00 178.44 177.39 1woq n LEU 102 N -3.71 2.84 -0.56 -4.49 4.77 -0.68 -1.14 117.00 114.04 1woq n LEU 102 Ca -0.01 1.10 -0.07 0.00 -0.03 0.00 0.00 56.01 56.99 1woq n LEU 102 Cb 0.57 -1.39 -0.03 0.00 -2.33 0.00 0.00 43.42 40.24 1woq n LEU 102 CO 0.40 -0.45 -0.07 -3.20 -1.33 0.00 0.00 177.39 172.74 1woq n ASN 103 N 3.11 -4.78 -4.72 -1.43 4.05 0.35 -4.99 115.26 106.85 1woq n ASN 103 Ca 0.17 0.18 -0.40 0.00 0.45 0.00 0.00 54.58 54.98 1woq n ASN 103 Cb 0.27 -2.93 -0.05 0.00 1.23 0.00 0.00 39.78 38.31 1woq n ASN 103 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 177.26 173.32 1woq s THR 104 N -1.97 5.02 -1.01 -0.44 2.01 -0.30 -4.82 115.64 114.13 1woq s THR 104 Ca 0.00 1.47 -0.22 0.00 0.31 0.00 0.00 61.69 63.24 1woq s THR 104 Cb 0.00 -4.05 0.06 0.00 0.01 0.00 0.00 72.50 68.52 1woq s THR 104 CO 0.00 0.26 1.42 -0.62 -0.69 0.00 0.00 174.62 174.99 1woq s ASP 105 N 0.73 6.52 0.33 3.53 -1.08 -1.26 -1.22 116.67 124.22 1woq s ASP 105 Ca 0.38 -1.53 0.10 0.00 -0.52 0.00 0.00 52.55 50.97 1woq s ASP 105 Cb -0.18 -2.55 0.58 0.00 -1.46 0.00 0.00 42.92 39.31 1woq s ASP 105 CO 0.19 -1.45 1.77 -0.29 0.52 0.00 0.00 175.17 175.90 1woq h ILE 106 N 6.67 1.29 -0.28 4.11 2.10 -1.49 -1.22 117.51 128.68 1woq h ILE 106 Ca 0.20 -1.40 -0.01 0.00 1.08 0.00 0.00 64.86 64.73 1woq h ILE 106 Cb 1.01 1.67 -0.01 0.00 -1.09 0.00 0.00 36.82 38.40 1woq h ILE 106 CO 1.39 0.41 0.13 0.44 -1.08 0.00 0.00 178.15 179.44 1woq h ASP 107 N 0.11 0.38 -0.28 2.19 5.19 -1.75 -0.81 116.42 121.44 1woq h ASP 107 Ca 0.01 -0.14 -0.03 0.00 -0.62 0.00 0.00 57.03 56.25 1woq h ASP 107 Cb 0.73 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 40.13 1woq h ASP 107 CO 0.05 0.42 0.05 0.00 -3.12 0.00 0.00 179.24 176.64 1woq h ALA 108 N 0.98 0.37 -0.20 3.45 0.00 -1.79 -0.33 119.26 121.73 1woq h ALA 108 Ca 0.10 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 54.87 1woq h ALA 108 Cb 0.15 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.77 1woq h ALA 108 CO -0.01 0.06 -0.15 1.25 0.00 0.00 0.00 179.25 180.40 1woq h LEU 109 N 0.29 -0.48 -0.28 0.00 5.85 -1.05 -1.19 115.31 118.44 1woq h LEU 109 Ca 0.09 0.10 -0.20 0.00 0.84 0.00 0.00 57.88 58.70 1woq h LEU 109 Cb 0.33 0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.60 1woq h LEU 109 CO 0.00 -0.19 -0.87 -0.07 -0.34 0.00 0.00 178.44 176.98 1woq h LEU 110 N -0.15 0.40 -0.69 2.25 3.38 -1.11 -2.54 115.31 116.85 1woq h LEU 110 Ca 0.12 -0.31 -0.05 0.00 0.09 0.00 0.00 57.88 57.73 1woq h LEU 110 Cb 0.33 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 1woq h LEU 110 CO -0.30 1.09 0.24 0.74 0.09 0.00 0.00 178.44 180.31 1woq h THR 111 N 0.19 1.25 -0.54 0.22 2.02 -0.88 0.73 112.91 115.89 1woq h THR 111 Ca -0.05 -0.84 -0.08 0.00 0.77 0.00 0.00 66.41 66.21 1woq h THR 111 Cb 1.48 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 68.37 1woq h THR 111 CO 0.14 0.33 0.02 0.00 0.37 0.00 0.00 175.52 176.38 1woq h ALA 112 N 1.11 0.73 -0.18 6.16 0.00 -1.22 -0.76 119.26 125.10 1woq h ALA 112 Ca 0.23 -0.29 -0.22 0.00 0.00 0.00 0.00 54.91 54.64 1woq h ALA 112 Cb 0.27 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.86 1woq h ALA 112 CO -0.01 0.54 -0.73 -0.09 0.00 0.00 0.00 179.25 178.95 1woq h ARG 113 N 0.83 0.80 0.00 0.00 9.65 -1.19 -3.30 114.38 121.16 1woq h ARG 113 Ca 0.16 -0.62 0.00 0.00 -1.10 0.00 0.00 59.98 58.42 1woq h ARG 113 Cb 0.51 0.12 0.00 0.00 -1.39 0.00 0.00 29.97 29.21 1woq h ARG 113 CO 0.02 1.23 -0.33 -0.07 2.80 0.00 0.00 179.97 183.63 1woq h LEU 114 N 0.56 0.00 0.73 3.80 3.38 -0.85 -3.48 115.31 119.44 1woq h LEU 114 Ca -0.04 -0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.79 1woq h LEU 114 Cb 1.36 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.08 1woq h LEU 114 CO 0.15 0.00 -0.16 0.61 0.09 0.00 0.00 178.44 179.14 1woq n GLY 115 N 1.14 0.41 3.42 0.83 0.00 -0.30 -5.01 105.19 105.68 1woq n GLY 115 Ca 0.03 -0.65 -0.13 0.00 0.00 0.00 0.00 46.02 45.27 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 -3.66 1.20 0.30 1.61 1.70 -1.19 -4.97 118.95 113.94 1woq s ARG 116 Ca 0.00 -0.37 -0.30 0.00 -0.47 0.00 0.00 55.73 54.59 1woq s ARG 116 Cb 0.00 0.55 -0.11 0.00 -0.57 0.00 0.00 34.95 34.82 1woq s ARG 116 CO 0.00 -0.49 1.57 -1.25 -1.08 0.00 0.00 175.30 174.04 1woq s PRO 117 N -3.26 4.13 -0.05 3.89 0.04 -1.26 -4.36 135.00 134.13 1woq s PRO 117 Ca -0.01 2.55 0.02 0.00 0.04 0.00 0.00 61.00 63.60 1woq s PRO 117 Cb -0.01 -3.02 0.02 0.00 0.04 0.00 0.00 34.50 31.53 1woq s PRO 117 CO -0.08 -0.60 -0.07 0.08 0.04 0.00 0.00 177.00 176.36 1woq s VAL 118 N -0.16 0.73 -0.12 -0.36 1.01 -1.26 -0.60 120.40 119.64 1woq s VAL 118 Ca 0.61 -0.24 0.01 0.00 0.00 0.00 0.00 61.98 62.36 1woq s VAL 118 Cb -0.47 -0.71 0.02 0.00 0.00 0.00 0.00 36.38 35.22 1woq s VAL 118 CO 0.50 0.26 -0.13 -1.61 0.00 0.00 0.00 175.10 174.11 1woq s GLU 119 N 0.77 2.12 0.14 2.72 2.02 -0.76 -4.68 118.70 121.03 1woq s GLU 119 Ca -0.12 -0.51 -0.06 0.00 0.02 0.00 0.00 54.97 54.30 1woq s GLU 119 Cb -0.15 -1.91 -0.06 0.00 0.10 0.00 0.00 34.13 32.11 1woq s GLU 119 CO 0.01 -0.17 0.40 0.08 0.02 0.00 0.00 175.26 175.61 1woq s VAL 120 N 1.30 5.13 0.02 2.63 1.01 -1.26 -1.92 120.40 127.32 1woq s VAL 120 Ca -0.00 0.16 -0.05 0.00 0.00 0.00 0.00 61.98 62.09 1woq s VAL 120 Cb -0.14 -3.62 -0.01 0.00 0.00 0.00 0.00 36.38 32.61 1woq s VAL 120 CO -0.06 0.08 0.08 -0.51 0.00 0.00 0.00 175.10 174.69 1woq s ILE 121 N -1.62 0.11 0.42 2.22 2.07 -0.12 -4.82 121.20 119.45 1woq s ILE 121 Ca 0.40 -0.93 -0.26 0.00 -1.41 0.00 0.00 60.65 58.45 1woq s ILE 121 Cb -0.12 -0.62 -0.10 0.00 0.13 0.00 0.00 42.46 41.75 1woq s ILE 121 CO 0.23 -0.51 1.38 -3.20 -1.91 0.00 0.00 174.94 170.92 1woq n ASN 122 N 1.16 3.10 -0.28 4.50 2.85 -1.26 -1.65 115.26 123.69 1woq n ASN 122 Ca -0.21 1.14 -0.03 0.00 -0.11 0.00 0.00 54.58 55.37 1woq n ASN 122 Cb 0.57 -1.56 0.08 0.00 1.24 0.00 0.00 39.78 40.11 1woq n ASN 122 CO 0.00 0.00 0.00 -2.24 -2.11 0.00 0.00 177.26 172.91 1woq h ASP 123 N 2.36 0.84 -0.32 1.20 -0.00 -1.57 -1.12 116.42 117.82 1woq h ASP 123 Ca -0.49 -0.01 -0.14 0.00 -0.00 0.00 0.00 57.03 56.38 1woq h ASP 123 Cb 1.27 -0.19 -0.01 0.00 -0.00 0.00 0.00 39.33 40.40 1woq h ASP 123 CO 0.61 0.59 -0.34 0.00 -0.00 0.00 0.00 179.24 180.10 1woq h ALA 124 N 1.31 0.69 -0.86 4.15 0.00 -1.88 -2.08 119.26 120.59 1woq h ALA 124 Ca 0.30 -0.43 0.02 0.00 0.00 0.00 0.00 54.91 54.80 1woq h ALA 124 Cb -0.04 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.58 1woq h ALA 124 CO -0.09 0.67 0.56 -0.44 0.00 0.00 0.00 179.25 179.94 1woq h ASP 125 N 0.71 0.95 -0.41 0.00 5.19 -1.68 0.34 116.42 121.52 1woq h ASP 125 Ca 0.07 -0.02 -0.03 0.00 -0.62 0.00 0.00 57.03 56.44 1woq h ASP 125 Cb 0.90 -0.23 -0.02 0.00 0.18 0.00 0.00 39.33 40.17 1woq h ASP 125 CO 0.08 0.67 0.15 0.00 -3.12 0.00 0.00 179.24 177.03 1woq h ALA 126 N 1.34 0.53 -0.82 3.45 0.00 -1.02 -0.40 119.26 122.33 1woq h ALA 126 Ca 0.33 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 55.11 1woq h ALA 126 Cb -0.06 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.52 1woq h ALA 126 CO -0.09 0.15 0.54 0.00 0.00 0.00 0.00 179.25 179.84 1woq h ALA 127 N 1.00 1.46 -0.39 0.00 0.00 -0.74 -1.68 119.26 118.91 1woq h ALA 127 Ca 0.13 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 1woq h ALA 127 Cb 0.21 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1woq h ALA 127 CO -0.01 0.47 0.00 0.78 0.00 0.00 0.00 179.25 180.50 1woq h GLY 128 N 1.06 0.74 0.87 0.00 0.00 -0.30 -1.11 103.07 104.31 1woq h GLY 128 Ca 0.31 -0.54 0.03 0.00 0.00 0.00 0.00 47.33 47.13 1woq h GLY 128 CO -0.08 0.50 0.39 1.41 0.00 0.00 0.00 176.54 178.75 1woq h LEU 129 N 0.51 0.63 -0.37 3.11 3.38 -0.55 0.67 115.31 122.68 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 0.46 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 1woq h LEU 129 CO 0.02 0.44 0.15 0.00 0.09 0.00 0.00 178.44 179.14 1woq h ALA 130 N 1.27 0.49 -0.34 1.53 0.00 -1.16 -1.50 119.26 119.54 1woq h ALA 130 Ca 0.25 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 1woq h ALA 130 Cb 0.03 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1woq h ALA 130 CO -0.11 0.09 -0.14 0.93 0.00 0.00 0.00 179.25 180.02 1woq h GLU 131 N 0.46 0.61 -0.40 0.00 4.39 -0.79 0.18 114.58 119.03 1woq h GLU 131 Ca 0.12 -0.20 -0.12 0.00 0.34 0.00 0.00 59.36 59.50 1woq h GLU 131 Cb 0.19 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 1woq h GLU 131 CO -0.01 0.73 -0.25 0.00 -1.16 0.00 0.00 179.01 178.32 1woq h ALA 132 N 1.29 0.81 0.13 3.43 0.00 -0.68 0.26 119.26 124.50 1woq h ALA 132 Ca 0.10 -0.39 -0.35 0.00 0.00 0.00 0.00 54.91 54.26 1woq h ALA 132 Cb 0.57 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1woq h ALA 132 CO 0.04 0.65 -1.92 -0.09 0.00 0.00 0.00 179.25 177.93 1woq h ARG 133 N 0.70 0.27 0.00 0.00 9.65 -1.13 -2.93 114.38 120.95 1woq h ARG 133 Ca 0.09 -0.46 0.00 0.00 -1.10 0.00 0.00 59.98 58.51 1woq h ARG 133 Cb 0.78 0.17 0.00 0.00 -1.39 0.00 0.00 29.97 29.53 1woq h ARG 133 CO 0.06 1.22 0.00 0.66 2.80 0.00 0.00 179.97 184.71 1woq n TYR 134 N -3.56 0.00 -0.62 2.20 4.01 0.61 -4.83 117.16 114.96 1woq n TYR 134 Ca -0.31 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.43 1woq n TYR 134 Cb 1.03 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.06 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 0.49 4.57 0.00 2.72 0.00 -0.41 -4.96 105.19 107.60 1woq n GLY 135 Ca 0.00 -1.70 0.03 0.00 0.00 0.00 0.00 46.02 44.35 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 1.31 0.98 4.61 0.00 -1.18 -2.31 120.51 120.91 1woq n ALA 136 Ca 0.00 -0.02 0.10 0.00 0.00 0.00 0.00 53.44 53.52 1woq n ALA 136 Cb 0.00 -1.09 -0.09 0.00 0.00 0.00 0.00 19.45 18.27 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 -0.89 -1.02 3.71 0.00 0.00 -0.05 -4.90 105.19 102.05 1woq n GLY 137 Ca 0.02 -0.58 -0.43 0.00 0.00 0.00 0.00 46.02 45.03 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 -1.51 2.61 -1.00 4.61 0.00 -0.98 -1.71 120.51 122.54 1woq n ALA 138 Ca 0.04 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.89 1woq n ALA 138 Cb 0.33 -2.50 0.00 0.00 0.00 0.00 0.00 19.45 17.29 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 3.82 0.82 3.46 0.00 0.00 -1.26 -5.01 105.19 107.01 1woq n GLY 139 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 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 -3.26 4.57 0.67 1.61 1.01 -0.69 -5.09 120.40 119.21 1woq s VAL 140 Ca 0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 61.98 61.74 1woq s VAL 140 Cb 0.00 -3.22 0.09 0.00 0.00 0.00 0.00 36.38 33.25 1woq s VAL 140 CO 0.00 0.21 0.94 -1.59 0.00 0.00 0.00 175.10 174.66 1woq s LYS 141 N 1.63 2.00 2.02 2.72 -2.85 -1.26 -4.25 119.74 119.75 1woq s LYS 141 Ca 0.06 -0.86 0.00 0.00 -1.00 0.00 0.00 55.97 54.17 1woq s LYS 141 Cb -0.16 -2.34 0.00 0.00 -2.06 0.00 0.00 37.83 33.27 1woq s LYS 141 CO 0.06 -1.21 0.00 0.41 0.10 0.00 0.00 175.35 174.70 1woq n GLY 142 N -2.72 -1.30 3.67 0.59 0.00 -1.26 -4.74 105.19 99.43 1woq n GLY 142 Ca 0.12 -1.27 -0.43 0.00 0.00 0.00 0.00 46.02 44.44 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 4.73 -0.12 2.61 2.01 -1.26 -1.31 115.64 122.30 1woq s THR 143 Ca 0.00 2.03 0.01 0.00 0.31 0.00 0.00 61.69 64.03 1woq s THR 143 Cb 0.00 -4.31 0.02 0.00 0.01 0.00 0.00 72.50 68.22 1woq s THR 143 CO 0.00 -0.10 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.02 1woq s VAL 144 N 2.71 1.30 -0.22 3.82 1.01 0.28 0.25 120.40 129.54 1woq s VAL 144 Ca 0.46 -0.48 -0.04 0.00 0.00 0.00 0.00 61.98 61.91 1woq s VAL 144 Cb -0.16 -1.24 -0.01 0.00 0.00 0.00 0.00 36.38 34.97 1woq s VAL 144 CO 0.11 0.41 -0.04 -0.76 0.00 0.00 0.00 175.10 174.81 1woq s LEU 145 N 1.37 2.93 -0.38 3.92 1.43 -0.78 -1.28 118.68 125.90 1woq s LEU 145 Ca 0.00 -0.44 -0.16 0.00 -1.03 0.00 0.00 54.13 52.51 1woq s LEU 145 Cb -0.13 -1.73 0.01 0.00 0.03 0.00 0.00 46.19 44.36 1woq s LEU 145 CO -0.06 -0.03 0.37 -0.69 0.23 0.00 0.00 176.35 176.16 1woq s VAL 146 N 1.47 5.16 -0.24 -1.59 1.01 -0.65 -1.46 120.40 124.11 1woq s VAL 146 Ca 0.05 -0.25 -0.07 0.00 0.00 0.00 0.00 61.98 61.71 1woq s VAL 146 Cb -0.14 -3.91 -0.03 0.00 0.00 0.00 0.00 36.38 32.29 1woq s VAL 146 CO -0.03 -0.25 0.06 -0.63 0.00 0.00 0.00 175.10 174.24 1woq s ILE 147 N 1.98 4.26 -0.16 2.22 -1.09 0.21 -0.73 121.20 127.88 1woq s ILE 147 Ca 0.10 -0.19 -0.08 0.00 -2.23 0.00 0.00 60.65 58.25 1woq s ILE 147 Cb -0.17 -2.98 -0.04 0.00 -1.58 0.00 0.00 42.46 37.69 1woq s ILE 147 CO 0.12 0.36 0.10 0.42 -1.23 0.00 0.00 174.94 174.71 1woq s THR 148 N 1.47 5.13 -0.28 2.92 -4.23 -0.01 -0.20 115.64 120.44 1woq s THR 148 Ca 0.06 0.08 -0.05 0.00 -1.18 0.00 0.00 61.69 60.60 1woq s THR 148 Cb -0.15 -3.29 0.02 0.00 1.34 0.00 0.00 72.50 70.43 1woq s THR 148 CO 0.03 0.51 0.03 -0.76 -0.54 0.00 0.00 174.62 173.89 1woq s LEU 149 N -0.14 3.66 0.00 4.79 1.43 -0.48 -1.27 118.68 126.67 1woq s LEU 149 Ca 0.09 -0.83 0.00 0.00 -1.03 0.00 0.00 54.13 52.35 1woq s LEU 149 Cb -0.12 -1.79 0.00 0.00 0.03 0.00 0.00 46.19 44.31 1woq s LEU 149 CO 0.01 -0.18 0.00 0.61 0.23 0.00 0.00 176.35 177.01 1woq n GLY 150 N 4.78 3.03 0.26 -3.19 0.00 -1.26 -3.24 105.19 105.57 1woq n GLY 150 Ca -0.15 0.02 -0.02 0.00 0.00 0.00 0.00 46.02 45.87 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 1.00 -4.20 2.61 2.02 -1.95 0.22 112.91 112.61 1woq h THR 151 Ca 0.00 -0.25 -0.31 0.00 0.77 0.00 0.00 66.41 66.62 1woq h THR 151 Cb 0.00 0.22 -0.06 0.00 -1.74 0.00 0.00 68.15 66.57 1woq h THR 151 CO 0.00 0.13 -0.24 0.61 0.37 0.00 0.00 175.52 176.39 1woq n GLY 152 N -1.28 3.74 3.33 2.16 0.00 -1.26 -4.59 105.19 107.28 1woq n GLY 152 Ca 0.08 -2.13 -0.35 0.00 0.00 0.00 0.00 46.02 43.62 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 -2.19 3.50 0.29 -0.61 1.01 -1.26 -4.51 121.20 117.44 1woq s ILE 153 Ca 0.07 -0.45 0.07 0.00 0.00 0.00 0.00 60.65 60.34 1woq s ILE 153 Cb 0.00 -2.60 -0.03 0.00 0.01 0.00 0.00 42.46 39.84 1woq s ILE 153 CO 0.05 0.41 0.26 -0.83 0.00 0.00 0.00 174.94 174.82 1woq s GLY 154 N 1.49 1.57 -0.14 6.18 0.00 -0.39 -3.62 107.32 112.40 1woq s GLY 154 Ca 0.06 -1.52 -0.08 0.00 0.00 0.00 0.00 44.72 43.18 1woq s GLY 154 CO -0.02 -1.50 0.35 -1.35 0.00 0.00 0.00 173.10 170.57 1woq s SER 155 N -3.93 -0.41 -0.19 1.64 1.04 -1.26 -0.83 113.70 109.76 1woq s SER 155 Ca 0.37 0.74 -0.03 0.00 0.48 0.00 0.00 55.95 57.52 1woq s SER 155 Cb -0.07 0.64 -0.01 0.00 0.10 0.00 0.00 66.02 66.68 1woq s SER 155 CO 0.26 -0.17 -0.08 0.00 0.98 0.00 0.00 173.24 174.23 1woq s ALA 156 N 1.20 2.74 -0.41 5.32 0.00 0.09 -4.30 121.76 126.39 1woq s ALA 156 Ca -0.08 -1.10 -0.17 0.00 0.00 0.00 0.00 51.96 50.61 1woq s ALA 156 Cb -0.08 -1.54 0.02 0.00 0.00 0.00 0.00 23.12 21.51 1woq s ALA 156 CO -0.10 -0.25 0.42 0.12 0.00 0.00 0.00 175.76 175.96 1woq s PHE 157 N 1.17 3.18 -0.12 0.00 5.36 -1.26 -1.64 117.98 124.68 1woq s PHE 157 Ca 0.02 -0.32 -0.01 0.00 -0.96 0.00 0.00 56.93 55.65 1woq s PHE 157 Cb -0.14 -2.85 -0.03 0.00 -0.34 0.00 0.00 43.02 39.66 1woq s PHE 157 CO -0.02 -0.66 -0.06 0.42 -1.46 0.00 0.00 175.22 173.44 1woq s ILE 158 N 2.11 3.70 -0.08 3.12 -1.09 -0.40 -0.20 121.20 128.35 1woq s ILE 158 Ca 0.12 -0.45 -0.01 0.00 -2.23 0.00 0.00 60.65 58.08 1woq s ILE 158 Cb -0.17 -2.57 0.03 0.00 -1.58 0.00 0.00 42.46 38.17 1woq s ILE 158 CO 0.13 0.54 -0.00 0.12 -1.23 0.00 0.00 174.94 174.50 1woq s PHE 159 N -0.13 0.76 -1.47 3.97 5.36 0.37 -0.56 117.98 126.28 1woq s PHE 159 Ca 0.02 -0.25 -0.11 0.00 -0.96 0.00 0.00 56.93 55.63 1woq s PHE 159 Cb -0.13 -0.85 0.05 0.00 -0.34 0.00 0.00 43.02 41.75 1woq s PHE 159 CO 0.03 -0.36 0.91 -0.25 -1.46 0.00 0.00 175.22 174.09 1woq n ASP 160 N 5.12 -5.31 0.00 6.13 8.00 -0.43 -1.18 116.55 128.89 1woq n ASP 160 Ca -0.08 -0.59 0.00 0.00 0.71 0.00 0.00 54.79 54.83 1woq n ASP 160 Cb 0.50 -4.24 0.00 0.00 -0.02 0.00 0.00 41.12 37.36 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 -1.68 0.73 3.68 0.44 0.00 -1.26 -4.91 105.19 102.18 1woq n GLY 161 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1woq n GLY 161 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1woq s LYS 162 N -0.23 2.76 -0.11 1.61 1.02 -0.32 -4.93 119.74 119.54 1woq s LYS 162 Ca 0.00 -0.63 -0.29 0.00 0.02 0.00 0.00 55.97 55.07 1woq s LYS 162 Cb 0.00 -2.66 -0.01 0.00 -0.52 0.00 0.00 37.83 34.64 1woq s LYS 162 CO 0.00 0.62 0.99 -1.17 -0.92 0.00 0.00 175.35 174.86 1woq s LEU 163 N -1.59 4.24 -0.56 3.17 2.96 -1.26 -0.48 118.68 125.16 1woq s LEU 163 Ca 0.20 1.49 -0.17 0.00 -0.22 0.00 0.00 54.13 55.42 1woq s LEU 163 Cb -0.11 -3.51 0.11 0.00 0.50 0.00 0.00 46.19 43.17 1woq s LEU 163 CO 0.10 -0.44 0.58 -0.69 -1.32 0.00 0.00 176.35 174.59 1woq s VAL 164 N 2.04 5.04 0.65 1.68 1.01 0.71 -4.96 120.40 126.58 1woq s VAL 164 Ca 0.47 -1.24 -0.18 0.00 0.00 0.00 0.00 61.98 61.03 1woq s VAL 164 Cb -0.18 -4.39 -0.01 0.00 0.00 0.00 0.00 36.38 31.80 1woq s VAL 164 CO 0.17 -0.96 1.29 -0.81 0.00 0.00 0.00 175.10 174.79 1woq n PRO 165 N 5.72 1.08 -2.99 2.72 -0.04 -1.26 -4.06 135.00 136.16 1woq n PRO 165 Ca -0.12 0.43 -0.22 0.00 -0.04 0.00 0.00 63.50 63.55 1woq n PRO 165 Cb 0.41 -2.53 0.03 0.00 -0.04 0.00 0.00 33.50 31.37 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 -1.95 -6.05 -4.71 3.54 5.03 -1.26 -4.98 115.26 104.88 1woq n ASN 166 Ca 0.16 -0.27 -0.42 0.00 0.87 0.00 0.00 54.58 54.92 1woq n ASN 166 Cb 0.48 -4.90 -0.03 0.00 -1.02 0.00 0.00 39.78 34.31 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 -3.16 3.41 -0.65 5.41 0.00 -1.26 -4.93 121.76 120.57 1woq s ALA 167 Ca 0.29 0.86 0.03 0.00 0.00 0.00 0.00 51.96 53.14 1woq s ALA 167 Cb -0.13 -3.45 0.36 0.00 0.00 0.00 0.00 23.12 19.90 1woq s ALA 167 CO 0.36 -0.45 1.25 0.39 0.00 0.00 0.00 175.76 177.30 1woq n GLU 168 N 3.95 3.63 0.06 0.00 -0.58 -1.26 -4.29 120.64 122.16 1woq n GLU 168 Ca 0.09 -4.61 0.07 0.00 -0.42 0.00 0.00 57.16 52.29 1woq n GLU 168 Cb 0.46 -2.29 0.31 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 -0.31 0.25 0.01 -4.62 4.32 -1.26 -1.26 117.00 114.13 1woq n LEU 169 Ca 0.38 0.59 0.10 0.00 -0.02 0.00 0.00 56.01 57.06 1woq n LEU 169 Cb 0.42 -0.59 0.44 0.00 -1.62 0.00 0.00 43.42 42.07 1woq n LEU 169 CO 0.39 -0.54 0.83 0.61 -1.22 0.00 0.00 177.39 177.45 1woq n GLY 170 N -0.77 -1.22 0.77 -0.72 0.00 -1.24 -2.76 105.19 99.25 1woq n GLY 170 Ca 0.01 -0.06 0.08 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.54 0.77 -2.13 1.61 8.25 -0.39 -1.87 115.22 119.92 1woq n HIS 171 Ca 0.05 -0.81 -0.35 0.00 -0.26 0.00 0.00 57.72 56.34 1woq n HIS 171 Cb 0.24 -0.25 0.02 0.00 1.12 0.00 0.00 29.99 31.13 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 -2.46 3.70 -0.06 2.41 1.43 -1.11 -4.67 118.68 117.92 1woq s LEU 172 Ca 0.37 2.28 -0.17 0.00 -1.03 0.00 0.00 54.13 55.58 1woq s LEU 172 Cb 0.29 -4.59 -0.05 0.00 0.03 0.00 0.00 46.19 41.87 1woq s LEU 172 CO 0.09 -1.41 0.46 -0.70 0.23 0.00 0.00 176.35 175.02 1woq s GLU 173 N -3.32 4.18 -0.05 1.70 2.12 -1.26 -0.36 118.70 121.71 1woq s GLU 173 Ca 0.75 0.45 -0.02 0.00 0.36 0.00 0.00 54.97 56.51 1woq s GLU 173 Cb -0.27 -3.34 0.03 0.00 0.26 0.00 0.00 34.13 30.81 1woq s GLU 173 CO 0.30 0.39 0.08 0.42 -0.54 0.00 0.00 175.26 175.92 1woq s ILE 174 N -0.15 -0.12 -1.41 -3.70 1.01 0.43 -4.87 121.20 112.38 1woq s ILE 174 Ca 0.25 0.33 -0.05 0.00 0.00 0.00 0.00 60.65 61.19 1woq s ILE 174 Cb -0.16 -0.17 0.03 0.00 0.01 0.00 0.00 42.46 42.17 1woq s ILE 174 CO 0.12 0.14 0.71 0.47 0.00 0.00 0.00 174.94 176.38 1woq n ASP 175 N 4.90 -2.01 0.00 3.58 8.00 -1.26 -2.15 116.55 127.61 1woq n ASP 175 Ca -0.12 -0.86 0.00 0.00 0.71 0.00 0.00 54.79 54.51 1woq n ASP 175 Cb 0.50 -3.71 0.00 0.00 -0.02 0.00 0.00 41.12 37.89 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 0.87 3.13 0.44 0.00 -1.26 -5.02 105.19 101.67 1woq n GLY 176 Ca -0.19 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.70 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 -3.50 0.87 0.11 1.61 3.76 -0.91 -5.10 115.29 112.13 1woq s HIS 177 Ca 0.00 -0.68 -0.31 0.00 -0.15 0.00 0.00 55.06 53.92 1woq s HIS 177 Cb 0.00 -0.50 -0.10 0.00 1.11 0.00 0.00 32.58 33.10 1woq s HIS 177 CO 0.00 -0.08 1.72 0.34 -0.85 0.00 0.00 174.74 175.87 1woq s ASP 178 N -2.32 6.51 0.24 1.40 -1.08 -1.26 -0.43 116.67 119.72 1woq s ASP 178 Ca 0.02 2.64 -0.12 0.00 -0.52 0.00 0.00 52.55 54.56 1woq s ASP 178 Cb -0.03 -2.57 0.31 0.00 -1.46 0.00 0.00 42.92 39.17 1woq s ASP 178 CO -0.01 -0.93 1.59 0.00 0.52 0.00 0.00 175.17 176.34 1woq h ALA 179 N 8.16 0.46 0.00 3.66 0.00 -0.81 -1.00 119.26 129.72 1woq h ALA 179 Ca -0.44 0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1woq h ALA 179 Cb 1.21 0.64 0.00 0.00 0.00 0.00 0.00 17.79 19.64 1woq h ALA 179 CO 0.94 -0.44 0.00 1.05 0.00 0.00 0.00 179.25 180.80 1woq h GLU 180 N -0.02 0.00 0.00 0.00 4.11 -1.65 -1.21 114.58 115.81 1woq h GLU 180 Ca 0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.80 1woq h GLU 180 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1woq h GLU 180 CO -0.81 0.00 0.00 1.79 0.07 0.00 0.00 179.01 180.06 1woq h THR 181 N 0.00 0.00 0.00 -1.06 1.35 -1.48 -2.67 112.91 109.06 1woq h THR 181 Ca 0.00 -0.34 -0.04 0.00 -0.55 0.00 0.00 66.41 65.47 1woq h THR 181 Cb 0.46 1.24 -0.01 0.00 -1.73 0.00 0.00 68.15 68.11 1woq h THR 181 CO 0.00 0.00 -1.25 0.29 -0.25 0.00 0.00 175.52 174.31 1woq n LYS 182 N -2.79 2.02 -0.06 4.72 4.76 -0.96 -4.77 118.16 121.07 1woq n LYS 182 Ca 0.01 -0.02 0.03 0.00 -2.87 0.00 0.00 58.31 55.45 1woq n LYS 182 Cb 0.24 -1.11 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 -1.95 2.19 -1.45 7.82 0.00 -0.50 -4.48 120.51 122.15 1woq n ALA 183 Ca -0.04 -0.93 -0.29 0.00 0.00 0.00 0.00 53.44 52.18 1woq n ALA 183 Cb 0.42 -0.20 0.14 0.00 0.00 0.00 0.00 19.45 19.81 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 3.41 0.33 0.00 1.04 -1.01 -4.85 113.70 111.77 1woq s SER 184 Ca 0.10 1.05 0.03 0.00 0.48 0.00 0.00 55.95 57.61 1woq s SER 184 Cb 0.05 -1.67 0.57 0.00 0.10 0.00 0.00 66.02 65.08 1woq s SER 184 CO 0.07 -2.63 1.89 0.00 0.98 0.00 0.00 173.24 173.56 1woq h ALA 185 N -1.55 1.38 -0.24 5.32 0.00 -1.21 -2.20 119.26 120.75 1woq h ALA 185 Ca -0.51 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.19 1woq h ALA 185 Cb 1.32 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1woq h ALA 185 CO 0.61 0.45 -0.02 0.28 0.00 0.00 0.00 179.25 180.56 1woq h VAL 186 N 0.64 1.27 -0.70 0.00 2.07 -1.79 -3.04 116.25 114.70 1woq h VAL 186 Ca 0.15 -0.96 0.02 0.00 0.82 0.00 0.00 66.70 66.72 1woq h VAL 186 Cb 0.23 1.42 -0.04 0.00 -1.52 0.00 0.00 31.29 31.38 1woq h VAL 186 CO -0.00 0.30 0.46 0.00 0.02 0.00 0.00 177.57 178.35 1woq h ALA 187 N 0.79 1.54 -0.48 1.67 0.00 -1.75 -1.22 119.26 119.80 1woq h ALA 187 Ca 0.07 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.96 1woq h ALA 187 Cb 0.45 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 1woq h ALA 187 CO 0.02 0.42 0.27 -0.09 0.00 0.00 0.00 179.25 179.86 1woq h ARG 188 N 0.91 0.52 -0.18 0.00 2.43 -1.29 -1.13 114.38 115.64 1woq h ARG 188 Ca 0.26 -0.03 -0.11 0.00 -0.81 0.00 0.00 59.98 59.29 1woq h ARG 188 Cb -0.05 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.38 1woq h ARG 188 CO -0.06 0.34 -0.32 1.49 -1.51 0.00 0.00 179.97 179.91 1woq h GLU 189 N 0.53 0.53 -0.92 0.20 4.22 -1.40 -1.11 114.58 116.63 1woq h GLU 189 Ca 0.20 -0.33 0.06 0.00 0.08 0.00 0.00 59.36 59.37 1woq h GLU 189 Cb 0.05 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.28 1woq h GLU 189 CO -0.11 0.94 0.60 -0.09 -2.18 0.00 0.00 179.01 178.17 1woq h ARG 190 N 0.17 1.04 -0.40 1.92 2.43 -1.02 -1.86 114.38 116.67 1woq h ARG 190 Ca 0.01 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1woq h ARG 190 Cb 0.91 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 30.22 1woq h ARG 190 CO 0.07 0.69 0.00 -0.25 -1.51 0.00 0.00 179.97 178.97 1woq n ASP 191 N -4.48 2.33 -3.39 -3.80 8.00 -0.44 -4.94 116.55 109.83 1woq n ASP 191 Ca 0.14 -1.95 -0.24 0.00 0.71 0.00 0.00 54.79 53.44 1woq n ASP 191 Cb 0.18 -0.26 0.05 0.00 -0.02 0.00 0.00 41.12 41.06 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 1.21 -0.53 3.75 0.44 0.00 -0.70 -4.97 105.19 104.40 1woq n GLY 192 Ca 0.15 0.19 -0.40 0.00 0.00 0.00 0.00 46.02 45.96 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 -7.01 4.57 0.81 0.99 1.02 -0.44 -5.05 118.68 113.57 1woq s LEU 193 Ca 0.47 1.74 -0.12 0.00 0.02 0.00 0.00 54.13 56.25 1woq s LEU 193 Cb -0.22 -3.45 0.09 0.00 0.02 0.00 0.00 46.19 42.64 1woq s LEU 193 CO 0.58 0.10 1.17 -0.94 0.02 0.00 0.00 176.35 177.29 1woq s SER 194 N -0.73 4.36 0.34 2.29 1.04 -1.26 -4.81 113.70 114.94 1woq s SER 194 Ca 0.40 0.65 0.04 0.00 0.48 0.00 0.00 55.95 57.52 1woq s SER 194 Cb -0.24 -1.11 0.63 0.00 0.10 0.00 0.00 66.02 65.40 1woq s SER 194 CO 0.28 -1.97 1.93 -0.50 0.98 0.00 0.00 173.24 173.96 1woq h TRP 195 N -1.06 0.63 -0.44 5.02 -0.00 -1.97 -0.76 115.95 117.36 1woq h TRP 195 Ca -0.45 -0.03 -0.14 0.00 -0.00 0.00 0.00 58.89 58.26 1woq h TRP 195 Cb 1.31 -0.20 -0.01 0.00 -0.00 0.00 0.00 29.16 30.27 1woq h TRP 195 CO 0.12 0.52 -0.29 -0.44 -0.00 0.00 0.00 178.44 178.35 1woq h ASP 196 N 0.63 1.01 -0.16 -3.49 3.32 -1.93 -0.11 116.42 115.69 1woq h ASP 196 Ca 0.15 -0.42 -0.11 0.00 0.02 0.00 0.00 57.03 56.67 1woq h ASP 196 Cb 0.17 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 1woq h ASP 196 CO -0.01 1.22 -0.26 -0.33 -1.72 0.00 0.00 179.24 178.13 1woq h GLU 197 N 0.82 0.63 -0.28 3.56 5.08 -1.83 -2.16 114.58 120.39 1woq h GLU 197 Ca 0.09 -0.26 -0.08 0.00 -1.00 0.00 0.00 59.36 58.12 1woq h GLU 197 Cb 0.87 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.08 1woq h GLU 197 CO 0.08 0.83 -0.16 -0.92 -1.00 0.00 0.00 179.01 177.84 1woq h TYR 198 N 0.55 0.53 -0.24 4.33 3.20 -0.92 -2.27 116.97 122.15 1woq h TYR 198 Ca 0.07 -0.09 -0.02 0.00 3.14 0.00 0.00 58.73 61.84 1woq h TYR 198 Cb 0.73 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.85 1woq h TYR 198 CO 0.03 0.63 0.06 0.77 -1.64 0.00 0.00 178.16 178.00 1woq h SER 199 N 0.45 0.30 -0.23 -2.11 0.02 -0.36 -0.76 113.55 110.86 1woq h SER 199 Ca 0.08 -0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 60.98 1woq h SER 199 Cb 0.53 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.99 1woq h SER 199 CO 0.03 0.31 0.06 0.58 -1.14 0.00 0.00 176.83 176.67 1woq h VAL 200 N 0.34 1.21 -0.77 2.27 2.07 -1.12 0.10 116.25 120.34 1woq h VAL 200 Ca 0.08 -0.67 -0.02 0.00 0.82 0.00 0.00 66.70 66.91 1woq h VAL 200 Cb 0.14 1.22 -0.04 0.00 -1.52 0.00 0.00 31.29 31.09 1woq h VAL 200 CO -0.00 0.21 0.40 -0.07 0.02 0.00 0.00 177.57 178.13 1woq h LEU 201 N 0.19 0.98 -0.66 2.57 3.38 -1.30 -2.09 115.31 118.38 1woq h LEU 201 Ca 0.07 -0.11 -0.14 0.00 0.09 0.00 0.00 57.88 57.79 1woq h LEU 201 Cb 0.27 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1woq h LEU 201 CO 0.00 0.81 -0.49 -0.07 0.09 0.00 0.00 178.44 178.78 1woq h LEU 202 N 1.07 0.49 -0.61 1.67 3.38 -0.98 -0.96 115.31 119.37 1woq h LEU 202 Ca 0.27 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1woq h LEU 202 Cb 0.07 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 1woq h LEU 202 CO -0.04 0.90 0.40 -0.61 0.09 0.00 0.00 178.44 179.18 1woq h GLN 203 N 0.36 0.81 -0.15 1.13 5.75 -0.48 0.12 115.11 122.65 1woq h GLN 203 Ca 0.02 -0.05 -0.01 0.00 -0.15 0.00 0.00 58.65 58.45 1woq h GLN 203 Cb 0.99 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 29.35 1woq h GLN 203 CO 0.09 0.55 0.04 -0.09 -2.65 0.00 0.00 178.83 176.76 1woq h ARG 204 N 0.83 0.24 0.48 1.69 9.65 -1.16 -1.23 114.38 124.88 1woq h ARG 204 Ca 0.22 -0.06 -0.02 0.00 -1.10 0.00 0.00 59.98 59.02 1woq h ARG 204 Cb -0.08 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 28.47 1woq h ARG 204 CO -0.05 0.39 -0.23 -0.92 2.80 0.00 0.00 179.97 181.96 1woq h TYR 205 N 0.05 -0.60 -0.39 2.20 3.20 -0.83 -1.68 116.97 118.92 1woq h TYR 205 Ca 0.05 -0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.83 1woq h TYR 205 Cb 0.25 0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.70 1woq h TYR 205 CO 0.01 -0.33 -0.07 0.74 -1.64 0.00 0.00 178.16 176.87 1woq h PHE 206 N -0.73 0.71 -0.17 -3.82 -1.00 -0.83 -0.96 116.94 110.14 1woq h PHE 206 Ca -0.07 -0.11 -0.11 0.00 2.81 0.00 0.00 57.97 60.50 1woq h PHE 206 Cb 0.54 -0.19 -0.01 0.00 3.61 0.00 0.00 35.95 39.89 1woq h PHE 206 CO -0.02 0.72 -0.37 0.66 -1.61 0.00 0.00 178.31 177.68 1woq h SER 207 N 0.61 0.39 -0.10 2.17 4.64 -1.22 0.14 113.55 120.18 1woq h SER 207 Ca 0.11 -0.16 -0.03 0.00 -0.47 0.00 0.00 61.79 61.25 1woq h SER 207 Cb 0.49 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1woq h SER 207 CO 0.03 0.73 -0.05 -0.74 -0.87 0.00 0.00 176.83 175.93 1woq h HIS 208 N 0.32 0.24 -0.24 4.77 -0.00 -0.88 -1.87 115.15 117.48 1woq h HIS 208 Ca 0.03 -0.06 -0.06 0.00 -0.00 0.00 0.00 60.37 60.29 1woq h HIS 208 Cb 0.80 -0.06 -0.01 0.00 -0.00 0.00 0.00 27.41 28.14 1woq h HIS 208 CO 0.02 0.56 -0.09 0.28 -0.00 0.00 0.00 177.93 178.70 1woq h VAL 209 N -0.15 1.20 -0.78 5.26 2.07 -1.05 -1.04 116.25 121.75 1woq h VAL 209 Ca 0.02 -0.85 -0.04 0.00 0.82 0.00 0.00 66.70 66.66 1woq h VAL 209 Cb 0.49 1.12 -0.03 0.00 -1.52 0.00 0.00 31.29 31.35 1woq h VAL 209 CO 0.01 0.27 0.34 -0.08 0.02 0.00 0.00 177.57 178.14 1woq h GLU 210 N 0.36 1.15 -0.26 1.57 4.81 -0.59 -0.93 114.58 120.68 1woq h GLU 210 Ca 0.07 -0.19 -0.14 0.00 -0.13 0.00 0.00 59.36 58.97 1woq h GLU 210 Cb 0.39 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 1woq h GLU 210 CO 0.02 0.91 -0.42 0.35 -0.73 0.00 0.00 179.01 179.14 1woq h PHE 211 N 1.11 0.78 -0.33 0.92 3.04 -0.57 0.22 116.94 122.12 1woq h PHE 211 Ca 0.26 -0.23 -0.09 0.00 3.98 0.00 0.00 57.97 61.88 1woq h PHE 211 Cb 0.17 -0.16 -0.02 0.00 2.56 0.00 0.00 35.95 38.51 1woq h PHE 211 CO 0.02 0.96 -0.19 -0.07 -2.02 0.00 0.00 178.31 177.01 1woq h LEU 212 N 0.53 0.60 -0.33 0.59 3.38 -0.63 -3.38 115.31 116.06 1woq h LEU 212 Ca 0.04 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1woq h LEU 212 Cb 0.95 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1woq h LEU 212 CO 0.09 0.80 0.00 0.49 0.09 0.00 0.00 178.44 179.90 1woq n PHE 213 N -4.14 0.00 -4.08 1.13 3.72 -0.41 -5.05 117.46 108.63 1woq n PHE 213 Ca 0.00 0.00 -0.45 0.00 -0.05 0.00 0.00 57.45 56.95 1woq n PHE 213 Cb 0.38 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.94 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 -0.11 -3.83 -4.78 4.37 7.64 0.77 -4.87 113.62 112.81 1woq n SER 214 Ca 0.00 -1.29 -0.31 0.00 1.01 0.00 0.00 58.87 58.28 1woq n SER 214 Cb 0.10 -1.74 0.08 0.00 -1.01 0.00 0.00 64.21 61.64 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 -7.38 2.44 0.22 1.43 0.04 -1.26 -4.88 135.00 125.60 1woq s PRO 215 Ca 0.46 1.16 0.12 0.00 0.04 0.00 0.00 61.00 62.78 1woq s PRO 215 Cb -0.25 -1.92 -0.03 0.00 0.04 0.00 0.00 34.50 32.34 1woq s PRO 215 CO 0.97 -1.50 1.39 0.93 0.04 0.00 0.00 177.00 178.82 1woq h GLU 216 N -0.91 0.00 -1.90 4.56 4.39 -0.53 -3.46 114.58 116.73 1woq h GLU 216 Ca -0.44 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.23 1woq h GLU 216 Cb 1.23 0.00 -0.20 0.00 -0.10 0.00 0.00 28.75 29.67 1woq h GLU 216 CO 0.53 0.69 0.26 -1.17 -1.16 0.00 0.00 179.01 178.15 1woq s LEU 217 N -6.57 -0.61 -0.10 1.33 2.96 -1.22 -4.41 118.68 110.06 1woq s LEU 217 Ca 0.03 0.80 0.01 0.00 -0.22 0.00 0.00 54.13 54.75 1woq s LEU 217 Cb 0.09 2.38 -0.02 0.00 0.50 0.00 0.00 46.19 49.13 1woq s LEU 217 CO 0.77 -0.48 -0.14 -0.36 -1.32 0.00 0.00 176.35 174.83 1woq s PHE 218 N -0.82 2.76 -0.14 5.38 2.99 -0.60 -1.86 117.98 125.69 1woq s PHE 218 Ca -0.07 -0.47 0.01 0.00 0.00 0.00 0.00 56.93 56.40 1woq s PHE 218 Cb -0.01 -1.76 0.02 0.00 0.00 0.00 0.00 43.02 41.27 1woq s PHE 218 CO 0.06 -0.07 -0.17 0.42 -0.00 0.00 0.00 175.22 175.46 1woq s ILE 219 N -0.05 1.74 -0.30 0.64 1.01 -0.53 -1.72 121.20 121.99 1woq s ILE 219 Ca -0.03 -0.77 -0.13 0.00 0.00 0.00 0.00 60.65 59.72 1woq s ILE 219 Cb -0.14 -1.59 -0.03 0.00 0.01 0.00 0.00 42.46 40.71 1woq s ILE 219 CO 0.04 0.49 0.29 -0.69 0.00 0.00 0.00 174.94 175.07 1woq s VAL 220 N 1.13 5.23 0.00 2.92 1.01 0.44 -0.62 120.40 130.52 1woq s VAL 220 Ca -0.02 0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.19 1woq s VAL 220 Cb -0.14 -3.67 0.00 0.00 0.00 0.00 0.00 36.38 32.57 1woq s VAL 220 CO -0.06 0.12 0.00 0.61 0.00 0.00 0.00 175.10 175.77 1woq n GLY 221 N 4.93 4.32 0.00 4.51 0.00 0.73 -0.28 105.19 119.39 1woq n GLY 221 Ca -0.11 -2.11 0.00 0.00 0.00 0.00 0.00 46.02 43.80 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 5.00 0.11 0.31 -0.02 0.00 -1.26 -1.38 105.19 107.95 1woq n GLY 222 Ca 0.00 -1.72 -0.06 0.00 0.00 0.00 0.00 46.02 44.24 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 -0.09 0.54 -0.02 0.00 -1.91 -1.62 103.07 99.97 1woq h GLY 223 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 47.33 47.70 1woq h GLY 223 CO 0.00 -0.21 0.00 0.29 0.00 0.00 0.00 176.54 176.62 1woq n ILE 224 N -5.42 0.00 0.39 2.60 -5.35 -1.25 -2.69 119.36 107.63 1woq n ILE 224 Ca 0.03 0.00 0.10 0.00 -0.27 0.00 0.00 62.75 62.61 1woq n ILE 224 Cb 0.33 -0.42 0.44 0.00 -1.74 0.00 0.00 39.64 38.26 1woq n ILE 224 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1woq n SER 225 N -0.77 0.49 0.07 7.28 3.41 -0.61 -0.79 113.62 122.69 1woq n SER 225 Ca 0.09 0.63 0.11 0.00 -0.26 0.00 0.00 58.87 59.44 1woq n SER 225 Cb 0.04 -0.73 0.45 0.00 -0.26 0.00 0.00 64.21 63.71 1woq n SER 225 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1woq n LYS 226 N -2.05 0.12 -0.47 4.33 3.00 -1.10 -2.01 118.16 119.99 1woq n LYS 226 Ca 0.02 0.26 0.08 0.00 -0.00 0.00 0.00 58.31 58.67 1woq n LYS 226 Cb 0.19 -1.69 0.25 0.00 0.00 0.00 0.00 35.03 33.78 1woq n LYS 226 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 1woq n ARG 227 N -1.92 2.83 -0.18 1.64 5.12 0.03 -4.71 116.66 119.47 1woq n ARG 227 Ca 0.04 -2.87 0.22 0.00 -1.93 0.00 0.00 57.85 53.31 1woq n ARG 227 Cb 0.27 -1.84 0.60 0.00 -1.16 0.00 0.00 32.46 30.33 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 1.72 2.44 0.00 7.54 0.00 -1.44 0.68 119.26 130.20 1woq h ALA 228 Ca 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1woq h ALA 228 Cb 1.46 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.26 1woq h ALA 228 CO 0.24 -0.69 0.00 -0.40 0.00 0.00 0.00 179.25 178.40 1woq n ASP 229 N -4.41 0.61 0.06 0.00 5.75 -1.26 -0.78 116.55 116.52 1woq n ASP 229 Ca 0.17 0.72 0.12 0.00 -0.01 0.00 0.00 54.79 55.80 1woq n ASP 229 Cb 0.75 -0.83 0.28 0.00 -1.03 0.00 0.00 41.12 40.29 1woq n ASP 229 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1woq n GLU 230 N -2.26 0.23 0.00 0.11 -0.58 0.23 -4.52 120.64 113.85 1woq n GLU 230 Ca 0.00 0.10 0.00 0.00 -0.42 0.00 0.00 57.16 56.84 1woq n GLU 230 Cb 0.12 -1.68 0.00 0.00 -0.57 0.00 0.00 31.44 29.30 1woq n GLU 230 CO 0.00 0.00 0.00 2.48 -0.48 0.00 0.00 177.13 179.13 1woq n TYR 231 N -2.04 0.00 -0.33 -0.32 0.18 -0.73 -4.64 117.16 109.28 1woq n TYR 231 Ca 0.04 0.00 -0.02 0.00 1.88 0.00 0.00 57.90 59.80 1woq n TYR 231 Cb 0.42 0.00 0.10 0.00 -0.38 0.00 0.00 39.34 39.48 1woq n TYR 231 CO 0.00 0.00 0.00 -0.07 -2.08 0.00 0.00 176.86 174.71 1woq h LEU 232 N 0.00 1.01 -2.29 -3.48 3.38 -1.21 -1.97 115.31 110.75 1woq h LEU 232 Ca 0.00 -0.02 0.04 0.00 0.09 0.00 0.00 57.88 57.99 1woq h LEU 232 Cb 0.12 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1woq h LEU 232 CO 0.00 0.71 0.15 -0.65 0.09 0.00 0.00 178.44 178.75 1woq h PRO 233 N 1.18 0.00 0.00 1.13 0.11 -1.79 -1.30 132.00 131.33 1woq h PRO 233 Ca 0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.45 1woq h PRO 233 Cb -0.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.03 1woq h PRO 233 CO -0.09 0.00 -0.13 -0.91 -0.21 0.00 0.00 178.00 176.66 1woq h ASN 234 N 0.00 0.00 -4.11 -2.05 2.35 -1.69 -3.46 115.58 106.61 1woq h ASN 234 Ca 0.06 -0.02 -0.48 0.00 -0.55 0.00 0.00 56.30 55.32 1woq h ASN 234 Cb 0.37 0.00 0.04 0.00 0.05 0.00 0.00 38.32 38.78 1woq h ASN 234 CO -0.00 0.01 0.39 -0.76 -1.65 0.00 0.00 177.43 175.42 1woq s LEU 235 N -5.31 3.73 -0.48 1.61 1.43 -0.49 -5.02 118.68 114.14 1woq s LEU 235 Ca 0.08 1.92 0.03 0.00 -1.03 0.00 0.00 54.13 55.12 1woq s LEU 235 Cb 0.09 -4.55 0.15 0.00 0.03 0.00 0.00 46.19 41.90 1woq s LEU 235 CO 0.65 -0.94 0.30 -0.13 0.23 0.00 0.00 176.35 176.46 1woq s ARG 236 N -3.50 1.43 0.28 1.70 1.81 -1.26 -5.07 118.95 114.33 1woq s ARG 236 Ca 0.67 -2.26 0.11 0.00 -1.72 0.00 0.00 55.73 52.53 1woq s ARG 236 Cb -0.17 -2.37 -0.05 0.00 -0.45 0.00 0.00 34.95 31.91 1woq s ARG 236 CO 0.26 -1.22 -0.15 -0.51 -0.68 0.00 0.00 175.30 173.00 1woq s LEU 237 N -0.01 2.74 0.15 2.53 1.43 -1.26 -5.01 118.68 119.25 1woq s LEU 237 Ca 0.21 -0.93 0.25 0.00 -1.03 0.00 0.00 54.13 52.63 1woq s LEU 237 Cb -0.16 -1.25 0.48 0.00 0.03 0.00 0.00 46.19 45.29 1woq s LEU 237 CO -0.06 0.03 1.46 -1.14 0.23 0.00 0.00 176.35 176.87 1woq n ARG 238 N -0.69 0.28 -3.88 1.70 3.00 -1.26 -4.81 116.66 111.01 1woq n ARG 238 Ca -0.05 0.13 -0.35 0.00 -0.00 0.00 0.00 57.85 57.57 1woq n ARG 238 Cb 0.60 -1.73 -0.08 0.00 0.00 0.00 0.00 32.46 31.25 1woq n ARG 238 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 1woq s THR 239 N -3.15 5.18 0.46 5.15 2.01 -1.26 -5.07 115.64 118.96 1woq s THR 239 Ca 0.08 0.10 -0.24 0.00 0.31 0.00 0.00 61.69 61.94 1woq s THR 239 Cb 0.13 -3.33 -0.07 0.00 0.01 0.00 0.00 72.50 69.24 1woq s THR 239 CO 0.68 0.49 1.30 -2.16 -0.69 0.00 0.00 174.62 174.25 1woq s PRO 240 N 0.04 3.69 -0.04 4.92 0.04 -1.26 -4.84 135.00 137.53 1woq s PRO 240 Ca 0.08 2.13 -0.00 0.00 0.04 0.00 0.00 61.00 63.25 1woq s PRO 240 Cb -0.12 -2.55 0.03 0.00 0.04 0.00 0.00 34.50 31.90 1woq s PRO 240 CO -0.00 -0.72 0.00 -1.50 0.04 0.00 0.00 177.00 174.82 1woq s ILE 241 N -1.32 0.24 0.08 0.56 2.07 -1.26 -1.56 121.20 120.01 1woq s ILE 241 Ca 0.62 0.10 0.02 0.00 -1.41 0.00 0.00 60.65 59.98 1woq s ILE 241 Cb -0.37 -0.36 -0.04 0.00 0.13 0.00 0.00 42.46 41.82 1woq s ILE 241 CO 0.47 0.19 -0.07 0.68 -1.91 0.00 0.00 174.94 174.29 1woq s VAL 242 N 1.35 0.65 0.61 4.00 -7.23 -0.70 -5.00 120.40 114.09 1woq s VAL 242 Ca -0.05 -1.65 -0.15 0.00 -1.81 0.00 0.00 61.98 58.32 1woq s VAL 242 Cb -0.13 -1.33 -0.03 0.00 0.56 0.00 0.00 36.38 35.45 1woq s VAL 242 CO -0.02 -0.71 1.06 -2.16 -0.31 0.00 0.00 175.10 172.96 1woq s PRO 243 N -3.08 3.24 0.53 4.82 0.04 -1.26 -0.42 135.00 138.86 1woq s PRO 243 Ca 0.05 1.16 -0.20 0.00 0.04 0.00 0.00 61.00 62.04 1woq s PRO 243 Cb 0.00 -2.02 -0.06 0.00 0.04 0.00 0.00 34.50 32.46 1woq s PRO 243 CO -0.03 -0.87 1.17 0.00 0.04 0.00 0.00 177.00 177.31 1woq s ALA 244 N -2.56 2.75 -0.01 8.56 0.00 0.61 -4.67 121.76 126.45 1woq s ALA 244 Ca 0.63 0.93 -0.22 0.00 0.00 0.00 0.00 51.96 53.30 1woq s ALA 244 Cb -0.16 -3.40 -0.22 0.00 0.00 0.00 0.00 23.12 19.34 1woq s ALA 244 CO 0.40 -0.86 1.10 0.28 0.00 0.00 0.00 175.76 176.69 1woq h VAL 245 N 1.35 1.46 -2.79 0.00 2.07 -1.94 -3.43 116.25 112.97 1woq h VAL 245 Ca -0.50 -1.93 -0.65 0.00 0.82 0.00 0.00 66.70 64.45 1woq h VAL 245 Cb 1.27 2.56 -0.06 0.00 -1.52 0.00 0.00 31.29 33.54 1woq h VAL 245 CO 0.58 0.55 -0.37 -0.76 0.02 0.00 0.00 177.57 177.58 1woq s LEU 246 N -8.51 4.42 0.00 2.57 1.02 -1.26 -4.98 118.68 111.94 1woq s LEU 246 Ca -0.14 0.66 0.00 0.00 0.02 0.00 0.00 54.13 54.67 1woq s LEU 246 Cb 0.03 -2.27 0.00 0.00 0.02 0.00 0.00 46.19 43.97 1woq s LEU 246 CO 0.78 0.37 0.00 -1.14 0.02 0.00 0.00 176.35 176.39 1woq n ARG 247 N 1.94 0.00 0.23 1.70 0.63 -1.26 -4.58 116.66 115.32 1woq n ARG 247 Ca -0.18 0.00 0.09 0.00 -0.92 0.00 0.00 57.85 56.84 1woq n ARG 247 Cb 0.54 0.00 0.57 0.00 0.45 0.00 0.00 32.46 34.02 1woq n ARG 247 CO 0.00 0.00 0.00 -0.91 -2.51 0.00 0.00 177.63 174.21 1woq h ASN 248 N 0.00 0.00 -0.18 6.15 4.21 -1.94 -3.13 115.58 120.69 1woq h ASN 248 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1woq h ASN 248 Cb 0.00 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.20 1woq h ASN 248 CO 0.00 0.21 0.00 -0.62 -1.29 0.00 0.00 177.43 175.73 1woq n GLU 249 N -3.80 1.76 -0.15 0.81 1.02 -1.26 -4.72 120.64 114.30 1woq n GLU 249 Ca -0.02 -1.60 -0.05 0.00 -0.02 0.00 0.00 57.16 55.47 1woq n GLU 249 Cb 0.31 -1.23 0.04 0.00 -0.02 0.00 0.00 31.44 30.54 1woq n GLU 249 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1woq h ALA 250 N 1.94 0.58 -0.33 0.62 0.00 -1.79 -1.21 119.26 119.07 1woq h ALA 250 Ca 0.00 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1woq h ALA 250 Cb 0.58 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1woq h ALA 250 CO 0.00 -0.12 -0.04 0.78 0.00 0.00 0.00 179.25 179.88 1woq h GLY 251 N 0.46 0.67 0.79 0.00 0.00 -1.84 -0.42 103.07 102.73 1woq h GLY 251 Ca 0.20 -0.52 0.02 0.00 0.00 0.00 0.00 47.33 47.03 1woq h GLY 251 CO -0.14 0.48 -0.05 -2.22 0.00 0.00 0.00 176.54 174.61 1woq h ILE 252 N 0.41 0.84 -0.30 2.60 2.04 -1.80 -0.22 117.51 121.07 1woq h ILE 252 Ca 0.09 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.92 1woq h ILE 252 Cb 0.51 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 37.42 1woq h ILE 252 CO 0.02 0.00 0.07 0.58 0.00 0.00 0.00 178.15 178.82 1woq h VAL 253 N -0.07 1.22 -0.53 1.67 2.07 -1.20 -2.75 116.25 116.66 1woq h VAL 253 Ca 0.04 -0.74 0.00 0.00 0.82 0.00 0.00 66.70 66.82 1woq h VAL 253 Cb 0.13 1.13 -0.03 0.00 -1.52 0.00 0.00 31.29 31.00 1woq h VAL 253 CO -0.10 0.25 0.33 1.23 0.02 0.00 0.00 177.57 179.30 1woq h GLY 254 N 0.33 0.75 1.23 2.17 0.00 -0.89 -1.03 103.07 105.63 1woq h GLY 254 Ca 0.09 -0.29 -0.08 0.00 0.00 0.00 0.00 47.33 47.06 1woq h GLY 254 CO 0.00 0.28 0.05 0.00 0.00 0.00 0.00 176.54 176.87 1woq h ALA 255 N 1.65 1.01 -0.33 3.60 0.00 -0.83 -1.78 119.26 122.58 1woq h ALA 255 Ca 0.19 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 1woq h ALA 255 Cb -0.05 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1woq h ALA 255 CO -0.04 0.62 -0.19 0.00 0.00 0.00 0.00 179.25 179.64 1woq h ALA 256 N 1.17 0.46 -0.43 0.00 0.00 -1.08 -2.85 119.26 116.54 1woq h ALA 256 Ca 0.17 -0.36 0.07 0.00 0.00 0.00 0.00 54.91 54.79 1woq h ALA 256 Cb 0.45 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.08 1woq h ALA 256 CO 0.02 0.40 0.10 0.82 0.00 0.00 0.00 179.25 180.59 1woq h ILE 257 N 0.47 0.79 -0.73 0.00 2.04 -0.95 -1.98 117.51 117.15 1woq h ILE 257 Ca 0.07 -0.08 0.07 0.00 1.00 0.00 0.00 64.86 65.92 1woq h ILE 257 Cb 0.73 0.53 -0.06 0.00 -0.74 0.00 0.00 36.82 37.28 1woq h ILE 257 CO 0.05 0.04 0.41 -0.08 0.00 0.00 0.00 178.15 178.58 1woq h GLU 258 N 0.24 0.72 -0.06 2.37 4.57 -1.22 0.10 114.58 121.29 1woq h GLU 258 Ca 0.21 -0.04 0.03 0.00 -1.18 0.00 0.00 59.36 58.37 1woq h GLU 258 Cb 0.25 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 28.64 1woq h GLU 258 CO -0.26 0.47 -0.12 0.82 -1.18 0.00 0.00 179.01 178.75 1woq h ILE 259 N 0.74 0.69 -0.37 2.32 2.04 -1.14 -0.01 117.51 121.77 1woq h ILE 259 Ca 0.34 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.24 1woq h ILE 259 Cb 0.24 0.69 -0.04 0.00 -0.74 0.00 0.00 36.82 36.97 1woq h ILE 259 CO -0.21 0.00 0.11 0.00 0.00 0.00 0.00 178.15 178.06 1woq h ALA 260 N 0.84 0.43 -0.49 1.87 0.00 -0.76 0.15 119.26 121.30 1woq h ALA 260 Ca 0.06 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1woq h ALA 260 Cb 0.26 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1woq h ALA 260 CO -0.16 -0.28 0.27 -0.07 0.00 0.00 0.00 179.25 179.01 1woq h LEU 261 N 0.26 0.62 -0.48 0.00 3.38 -0.69 -2.88 115.31 115.52 1woq h LEU 261 Ca 0.17 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 1woq h LEU 261 Cb 0.17 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1woq h LEU 261 CO -0.19 0.53 0.10 1.56 0.09 0.00 0.00 178.44 180.53 1woq h GLN 262 N 0.65 0.78 -0.01 1.13 1.08 -0.59 -3.51 115.11 114.64 1woq h GLN 262 Ca 0.17 -0.20 0.00 0.00 -1.45 0.00 0.00 58.65 57.18 1woq h GLN 262 Cb 0.05 -0.10 0.00 0.00 -0.05 0.00 0.00 27.48 27.39 1woq h GLN 262 CO -0.03 0.77 0.00 0.72 -0.95 0.00 0.00 178.83 179.34